diff --git a/.github/workflows/ci.yml b/.github/workflows/ci.yml new file mode 100644 index 0000000..2ab28f5 --- /dev/null +++ b/.github/workflows/ci.yml @@ -0,0 +1,79 @@ +name: CI + +on: + pull_request: + push: + branches: + - main + +jobs: + quick-tests: + runs-on: ubuntu-latest + strategy: + fail-fast: false + matrix: + include: + - name: data-utility + path: "tests/data tests/utility" + - name: models + path: "tests/models" + - name: layers + path: "tests/layers" + name: ${{ matrix.name }} + steps: + - uses: actions/checkout@v4 + - uses: conda-incubator/setup-miniconda@v3 + with: + auto-activate-base: false + miniforge-version: latest + - name: Create Locked Environment + shell: bash -el {0} + run: conda create -y -n chroma --file environment.linux-64.lock + - name: Install Package + shell: bash -el {0} + run: conda run -n chroma python -m pip install --no-deps -e . + - name: Run Quick Tests + shell: bash -el {0} + run: conda run -n chroma python -m pytest -q -m "not integration and not slow" ${{ matrix.path }} + + integration: + runs-on: ubuntu-latest + steps: + - uses: actions/checkout@v4 + - uses: conda-incubator/setup-miniconda@v3 + with: + auto-activate-base: false + miniforge-version: latest + - name: Create Locked Environment + shell: bash -el {0} + run: conda create -y -n chroma --file environment.linux-64.lock + - name: Install Package + shell: bash -el {0} + run: conda run -n chroma python -m pip install --no-deps -e . + - name: Run Integration Tests + shell: bash -el {0} + run: conda run -n chroma python -m pytest -q tests/models/test_chroma.py tests/utility/test_api.py tests/data/test_system.py + + release: + runs-on: ubuntu-latest + steps: + - uses: actions/checkout@v4 + - uses: conda-incubator/setup-miniconda@v3 + with: + auto-activate-base: false + miniforge-version: latest + - name: Create Locked Environment + shell: bash -el {0} + run: conda create -y -n chroma --file environment.linux-64.lock + - name: Install Package + shell: bash -el {0} + run: conda run -n chroma python -m pip install --no-deps -e . + - name: Build Artifacts + shell: bash -el {0} + run: conda run -n chroma python -m build + - name: Check Artifacts + shell: bash -el {0} + run: conda run -n chroma python -m twine check dist/* + - name: Packaging Smoke Test + shell: bash -el {0} + run: conda run -n chroma python -m pytest -q tests/utility/test_packaging.py diff --git a/.gitignore b/.gitignore index 9b9f322..5fa76f4 100644 --- a/.gitignore +++ b/.gitignore @@ -8,6 +8,7 @@ *.tsv *.pdb *.cif +!tests/resources/*.cif *.pk *.pt *.fasta @@ -24,6 +25,8 @@ __mmtf__ __pycache__ public htmlcov +build +dist make.bat examples chroma/layers/structure/params/centering_2g3n.params @@ -32,3 +35,4 @@ config.json # ides .vscode +/personal/ diff --git a/CONTRIBUTING.md b/CONTRIBUTING.md index 6d70539..09b07e2 100644 --- a/CONTRIBUTING.md +++ b/CONTRIBUTING.md @@ -9,3 +9,36 @@ Note that your contributions will be governed by the Apache 2.0 license, meaning Please use GitHub pull requests to contribute code. See [GitHub Help](https://help.github.com/articles/about-pull-requests/) for more information on using pull requests. We will try to monitor incoming requests with some regularity, but cannot promise a specific timeframe within which we will review your request. + +## Tests and Fixtures + +Use the `chroma` Conda environment for local testing. The repository CI workflow in +[`.github/workflows/ci.yml`](.github/workflows/ci.yml) runs the data and utility, +model, layer, integration, and release smoke suites separately. The shared +cross-platform CI environment is [`environment.yml`](environment.yml), while +[`environment_Mac.yaml`](environment_Mac.yaml) keeps the Apple Silicon local setup +used during development. CI installs from +[`environment.linux-64.lock`](environment.linux-64.lock), and Apple Silicon +local development should use +[`environment.osx-arm64.lock`](environment.osx-arm64.lock). + +To regenerate the explicit lockfiles from [`environment.yml`](environment.yml), +run: + +```bash +python scripts/generate_lockfiles.py +``` + +The Linux lock targets `__glibc=2.17`, which matches the minimum ABI required +by the pinned `linux-64` packages and is sufficient for the GitHub Actions +`ubuntu-latest` runners used by CI. + +Fixture provenance and regeneration notes live in +[`tests/resources/README.md`](tests/resources/README.md), including the generated +`steps200_seed42_len100.cif` sample used by `tests/models/test_chroma.py`. + +For quick local iteration, you can skip the heavier tiers with: + +```bash +pytest -m "not integration and not slow" +``` diff --git a/README.md b/README.md index 0da9e22..3864f57 100644 --- a/README.md +++ b/README.md @@ -28,15 +28,30 @@ Internally, Chroma uses diffusion modeling, equivariant graph neural networks, a * [Chroma API Tutorial](https://colab.research.google.com/github/generatebio/chroma/blob/main/notebooks/ChromaAPI.ipynb): Code notebook demonstrating protein I/O, sampling, and design configuration directly in `python`. * [Chroma Conditioner API Tutorial](https://colab.research.google.com/github/generatebio/chroma/blob/main/notebooks/ChromaConditioners.ipynb): A deeper dive under the hood for implementing new Chroma [Conditioners](#conditioner-api). -**PyPi package**.You can install the latest release of Chroma with: + +**Install Chroma from GitHub** + +Create a locked Conda environment for your platform + ``` -pip install generate-chroma +conda create -n chroma --file environment.osx-arm64.lock ``` -**Install latest Chroma from github** +On Linux, use: + +``` +conda create -n chroma --file environment.linux-64.lock +``` + +The shared source spec is `environment.yml`, and `environment_Mac.yaml` +remains available as the Apple Silicon YAML variant used during development. + +Clone from github and install as a package + ``` git clone https://github.com/generatebio/chroma.git -pip install -e chroma # use `-e` for it to be editable locally. +conda activate chroma +python -m pip install --no-deps -e . # use `-e` for it to be editable locally. ``` ## Sampling @@ -101,7 +116,7 @@ The value of diffusion time conditioning $t$ can be set via the `design_t` param from chroma import Protein, Chroma chroma = Chroma() -protein = Protein('1GFP') +protein = Protein.from_PDBID('1GFP') protein = chroma.design(protein) protein.to("1GFP-redesign.cif") diff --git a/chroma/__init__.py b/chroma/__init__.py index 0c4a32a..04d7aef 100755 --- a/chroma/__init__.py +++ b/chroma/__init__.py @@ -12,8 +12,19 @@ # See the License for the specific language governing permissions and # limitations under the License. +from importlib import import_module + __version__ = "1.0.0" -from chroma.data.protein import Protein -from chroma.layers.structure import conditioners -from chroma.models.chroma import Chroma -from chroma.utility import api +__all__ = ["__version__", "Protein", "conditioners", "Chroma", "api"] + + +def __getattr__(name): + if name == "Protein": + return import_module("chroma.data.protein").Protein + if name == "conditioners": + return import_module("chroma.layers.structure.conditioners") + if name == "Chroma": + return import_module("chroma.models.chroma").Chroma + if name == "api": + return import_module("chroma.utility.api") + raise AttributeError(f"module {__name__!r} has no attribute {name!r}") diff --git a/chroma/assets/centering/centering_2g3n.params b/chroma/assets/centering/centering_2g3n.params new file mode 100644 index 0000000..2458771 --- /dev/null +++ b/chroma/assets/centering/centering_2g3n.params @@ -0,0 +1,5 @@ +2g3n;[["internal_coords", {"log_lengths": true}]];["distances_2mer", "orientations_2mer", "distances_chain"] {"[\"internal_coords\", {\"log_lengths\": true}]": 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0.136, -0.077, 0.021, 0.006, -0.096, 0.038, -0.051, 0.092, 0.046, 0.072, 0.08, 0.052, 0.069, 0.065, 0.059, 0.053, 0.0, 0.0, 0.0], "\"distances_chain\"": [0.045, 2.767, -0.004]} diff --git a/chroma/data/__init__.py b/chroma/data/__init__.py index 2496883..c8e1f30 100644 --- a/chroma/data/__init__.py +++ b/chroma/data/__init__.py @@ -16,4 +16,13 @@ This package includes io formats and tools for a few common datatypes, including antibodies, proteins, sequences, and structures. """ -from chroma.data.protein import Protein + +from importlib import import_module + +__all__ = ["Protein"] + + +def __getattr__(name): + if name == "Protein": + return import_module("chroma.data.protein").Protein + raise AttributeError(f"module {__name__!r} has no attribute {name!r}") diff --git a/chroma/data/protein.py b/chroma/data/protein.py index 11e2b6f..92c6792 100644 --- a/chroma/data/protein.py +++ b/chroma/data/protein.py @@ -19,7 +19,6 @@ import tempfile from typing import List, Optional, Tuple, Union -import nglview as nv import torch import chroma.utility.polyseq as polyseq @@ -74,43 +73,39 @@ def __new__(cls, *args, **kwargs): ) elif len(args) == 1 and isinstance(args[0], str): - if args[0].lower().startswith("s3:"): + input_string = args[0] + if input_string.lower().startswith("s3:"): raise NotImplementedError( "download of cifs or pdbs from s3 not supported." ) - if args[0].endswith(".cif"): + if input_string.endswith(".cif"): return cls.from_CIF(*args, **kwargs) - elif args[0].endswith(".pdb"): + elif input_string.endswith(".pdb"): return cls.from_PDB(*args, **kwargs) - else: # PDB or Sequence String - # Check if it is a valid PDB - import requests - - url = f"https://data.rcsb.org/rest/v1/core/entry/{args[0]}" - VALID_PDBID = requests.get(url).status_code == 200 - VALID_SEQUENCE = all([s in PROTEIN_TOKENS for s in args[0]]) - - if VALID_PDBID: - # This only works if connected to the internet, - # so maybe better status checking will help here - if VALID_PDBID and VALID_SEQUENCE: - raise Warning( - "Ambuguous input, this is both a valid Sequence string and" - " a valid PDBID. Interpreting as a PDBID, if you wish to" - " initialize as a sequence string please explicitly" - " initialize as Protein.from_sequence(MY_SEQUENCE)." - ) - return cls.from_PDBID(*args, **kwargs) - elif VALID_SEQUENCE: + elif os.path.exists(input_string): + suffix = os.path.splitext(input_string)[1].lower() + if suffix == ".cif": + return cls.from_CIF(*args, **kwargs) + if suffix == ".pdb": + return cls.from_PDB(*args, **kwargs) + raise NotImplementedError( + "Local structure files must use a supported extension such as" + " `.cif` or `.pdb`." + ) + + else: + valid_sequence = all([s in PROTEIN_TOKENS for s in input_string]) + if valid_sequence: return cls.from_sequence(*args, **kwargs) - else: - raise NotImplementedError( - "Could Not Identify a valid input Type. See docstring for" - " details." - ) + raise NotImplementedError( + "Could not identify a valid local input type. Use" + " `Protein.from_PDBID(...)` for remote PDB downloads," + " pass a local `.cif` or `.pdb` path, or use" + " `Protein.from_sequence(...)` for sequence strings." + ) else: raise NotImplementedError( "Inputs must either be a 3-tuple of XCS tensors, or a single string" @@ -383,7 +378,7 @@ def to(self, file_path: str, force: bool = False) -> None: explicit saving is still available with the respective export methods. Args: - device (str): The desired device for tensor operations, e.g., 'cpu' or 'cuda'. + device (str): The desired device for tensor operations, e.g., 'cpu' or 'cuda' or 'mps'. """ if file_path.lower().endswith(".pdb"): self.to_PDB(file_path, force=force) @@ -444,7 +439,7 @@ def sequence(self, format: str = "one-letter-string") -> Union[List[str], str]: else: raise Exception(f"unknown sequence format {format}") - def display(self, representations: list = []) -> None: + def display(self, representations: Optional[list] = None) -> None: """ Display the protein using the provided representations in NGL view. @@ -454,20 +449,14 @@ def display(self, representations: list = []) -> None: Returns: viewer: A viewer object for interactive visualization. """ - from chroma.utility.ngl import SystemTrajectory, view_gsystem - - if self.sys.num_models() == 1: - viewer = view_gsystem(self.sys) - for rep in representations: - viewer.add_representation(rep) + from chroma.utility.ngl import view_protein - else: - t = SystemTrajectory(self) - viewer = nv.NGLWidget(t) - return viewer + return view_protein(self, representations=representations) def _ipython_display_(self): - display(self.display()) + from IPython.display import display as ipython_display + + ipython_display(self.display()) def __str__(self): """Define Print Behavior diff --git a/chroma/data/system.py b/chroma/data/system.py index 4d42c5e..161023b 100644 --- a/chroma/data/system.py +++ b/chroma/data/system.py @@ -28,513 +28,13 @@ import chroma.utility.polyseq as polyseq import chroma.utility.starparser as sp from chroma import constants - - -@dataclass -class SystemAssemblyInfo: - """A class for representing the assembly information for System objects. - - assemblies (dict): a dictionary of assemblies with keys being assembly IDs - and values being dictionaries with of the following structure: - { - "details": "complete icosahedral assembly", - "instructions": [ - { - "oper_expression": "(1-60)", - "chains": [0, 1, 2], - - # Each assembly instruction has information for generating - # one or more images, with image `i` generated by applying - # the sequence of operations with IDs in `operations[i]` to the - # list of chains in `chains`. The corresponding operations - # are described under `assembly_info["operations"][ID]`. - "operations": [["X0", "1", "2", "3"], ["X0", "4", "5", "6"]]], - }, - ... - ], - } - - operations (dict): a dictionary with symmetry operations. Keys are operation IDs - and values being dictionaries with the following structure: - { - "type": "identity operation", - "name": "1_555", - "matrix": np.array([[1., 0., 0.], [0., 1., 0.], [0., 0., 1.]]), - "vector": np.array([0., 0., 0.]), - }, - ... - """ - - assemblies: dict - operations: dict - - def __init__(self, assemblies: dict = dict(), operations: dict = dict()): - self.assemblies = assemblies - self.operations = operations - - @staticmethod - def make_operation(type: str, name: str, matrix: list, vector: list): - op = { - "type": type, - "name": name, - "matrix": np.zeros([3, 3]), - "vector": np.zeros([3, 1]), - } - assert len(matrix) == 9, "expected 9 elements in rotation matrix" - assert len(vector) == 3, "expected 3 elements in translation vector" - for i in range(3): - op["vector"][i] = float(vector[i]) - for j in range(3): - op["matrix"][i][j] = float(matrix[i * 3 + j]) - return op - - def delete_chain(self, cid: str): - """Deletes the mention of the chain from assembly information. - - Args: - cid (str): Chain ID to delete. - """ - for ass_id, assembly in self.assemblies.items(): - for ins in assembly["instructions"]: - ins["chains"] = [_id for _id in ins["chains"] if _id != cid] - - def rename_chain(self, old_cid: str, new_cid: str): - """Renames all mentions of a chain to its new chain ID. - - Args: - old_cid (str): Chain ID to rename. - new_cid (str): Newly assigned Chain ID. - """ - for ass_id, assembly in self.assemblies.items(): - for ins in assembly["instructions"]: - ins["chains"] = [ - new_cid if cid == old_cid else cid for cid in ins["chains"] - ] - - -class StringList: - """A class for representing and accessing a list of strings in a highly memory-efficient - manner. Access is constant time, but modification is linear time in length of list. - """ - - def __init__(self, init_list: List[str] = []): - self.string = "" - self.rng = ArrayList(2, dtype=int) - for i in range(len(init_list)): - self.append(init_list[i]) - - def __getitem__(self, i: int): - beg, length = self.rng[i] - return self.string[beg : beg + length] - - def __setitem__(self, i: int, new_string: str): - beg, length = self.rng[i] - self.string = self.string[:beg] + new_string + self.string[beg + length :] - if len(new_string) != length: - self.rng[i, 1] = len(new_string) - self.rng[i + 1 :, 0] = self.rng[i + 1 :, 0] + len(new_string) - length - - def __str__(self): - return self.string - - def __len__(self): - return len(self.rng) - - def copy(self): - new_list = StringList() - new_list.string = self.string - new_list.rng = self.rng.copy() - return new_list - - def append(self, new_string: str): - self.rng.append([len(self.string), len(new_string)]) - self.string = self.string + new_string - - def insert(self, i: int, new_string: str): - if i < len(self): - ix, _ = self.rng[i] - elif i == len(self): - if len(self) == 0: - ix = 0 - else: - ix = self.rng[i - 1].sum() - else: - raise Exception( - f"cannot insert in position {i} for stringList of length {len(self)}" - ) - self.string = self.string[0:ix] + new_string + self.string[ix:] - self.rng.insert(i, [ix, len(new_string)]) - if len(new_string) > 0: - self.rng[i + 1 :, 0] = self.rng[i + 1 :, 0] + len(new_string) - - def pop(self, i: int): - beg, length = self.rng[i] - val = self.string[beg : beg + length] - self.string = self.string[0:beg] + self.string[beg + length :] - self.rng[i + 1 :, 0] = self.rng[i + 1 :, 0] - len(val) - self.rng.pop(i) - return val - - def delete_range(self, rng: range): - rng = sorted(rng) - [i, j] = [rng[0], rng[-1]] - beg, _ = self.rng[i] - end = self.rng[j].sum() - self.string = self.string[0:beg] + self.string[end:] - self.rng[j + 1 :, 0] = self.rng[j + 1 :, 0] - (end - beg + 1) - self.rng.delete_range(rng) - - -class NameList: - """A class for representing and accessing a list of "names"--i.e., strings that tend to - have generic values, such that many repeat values are expected in a given list.""" - - def __init__(self, init_list: List[str] = []): - self._reindex(init_list) - - def _reindex(self, init_list: List[str]): - self.unique_names = [] - self.name_indicies = dict() - self.index_use = dict() - self.indices = ArrayList(1, dtype=int) - for name in init_list: - self.append(name) - - def copy(self): - new_list = NameList() - new_list.unique_names = self.unique_names.copy() - new_list.name_indicies = self.name_indicies.copy() - new_list.index_use = self.index_use.copy() - new_list.indices = self.indices.copy() - return new_list - - def _check_index(self): - L = len(self.unique_names) - I = len(self.index_use) - if (L > 2 * I) and (L - I > 10): - self._reindex([self[i] for i in range(len(self))]) - - def __getitem__(self, i: int): - try: - idx = self.indices[i].item() - except IndexError as e: - raise IndexError(f"index {i} out of range for nameList\n" + str(e)) - return self.unique_names[idx] - - def __setitem__(self, i: int, new_name: str): - try: - idx = self.indices[i] - except IndexError as e: - raise IndexError(f"index {i} out of range for nameList\n" + str(e)) - self.index_use[idx] = self.index_use[idx] - 1 - if self.index_use[idx] == 0: - del self.index_use[idx] - if new_name not in self.name_indicies: - idx = len(self.name_indicies) - self.name_indicies[new_name] = idx - self.unique_names.append(new_name) - else: - idx = self.name_indicies[new_name] - self.indices[i] = idx - self._update_use(idx, 1) - self._check_index() - - def __str__(self): - return str([self[i] for i in range(len(self))]) - - def __len__(self): - return len(self.indices) - - def _update_use(self, idx, delta): - self.index_use[idx] = self.index_use.get(idx, 0) + delta - if self.index_use[idx] <= 0: - del self.index_use[idx] - - def _get_name_index(self, name: str): - if name not in self.name_indicies: - idx = len(self.name_indicies) - self.name_indicies[name] = idx - self.unique_names.append(name) - else: - idx = self.name_indicies[name] - return idx - - def append(self, name: str): - idx = self._get_name_index(name) - self.indices.append(idx) - self.index_use[idx] = self.index_use.get(idx, 0) + 1 - - def insert(self, i: int, new_string: str): - idx = self._get_name_index(new_string) - self.indices.insert(i, idx) - self.index_use[idx] = self.index_use.get(idx, 0) + 1 - - def pop(self, i: int): - idx = self.indices.pop(i).item() - val = self.unique_names[idx] - self._update_use(idx, -1) - self._check_index() - return val - - def delete_range(self, rng: range): - for i in reversed(sorted(rng)): - self.pop(i) - - -class ArrayList: - def __init__(self, ndims: int, dtype: type, length: int = 0, val=0): - if ndims == 1: - self._array = np.ndarray(shape=(max(length, 2)), dtype=dtype) - else: - self._array = np.ndarray(shape=(max(length, 2), ndims), dtype=dtype) - self.ndims = ndims - self._array[:] = val - self.length = length - # view of just the data without the extra allocated stuff - self.array = self._array[: self.length] - - def convert_negative_slice(self, slice_obj): - start = slice_obj.start if slice_obj.start is not None else 0 - stop = slice_obj.stop if slice_obj.stop is not None else self.length - - if start < 0: - start = self.length + start - if stop < 0: - stop = self.length + stop - - return slice(start, stop, slice_obj.step) - - def copy(self): - new_list = ArrayList(ndims=self.ndims, dtype=self.array.dtype, length=len(self)) - new_list[:] = self[:] - return new_list - - def __len__(self): - return self.length - - def capacity(self): - return self._array.shape[0] - - def __getitem__(self, i: int): - return self.array[i] - - def __setitem__(self, i: int, row: list): - self.array[i] = row - - def resize(self, delta): - # for speed, hard-code instead of calling len() and capacity() - new_length = self.length + delta - cap = self._array.shape[0] - if (new_length > cap) or (new_length < cap / 3): - new_capacity = 2 * new_length - self._resize(new_capacity) - self.length = new_length - self.array = self._array[: self.length] - - def _resize(self, new_size): - if self.ndims == 1: - self._array.resize((new_size), refcheck=False) - else: - self._array.resize((new_size, self.ndims), refcheck=False) - - def items(self): - for i in range(self.length): - yield self.array[i, :] - - def append(self, row: list): - self.resize(1) - self.array[-1] = row - - def insert(self, i: int, row: list): - """Insert the row such that it ends up being at index ``i`` in the new arrayList""" - # resize by +1 - self.resize(1) - - # everything in range [i:end-1) moves over by +1 - self.array[i + 1 :] = self.array[i:-1] - - # set the value at index i - self.array[i] = row - - def pop(self, i: int): - """Remove and return element at index i""" - - # get the element at index i - row = self.array[i].copy() - - # everything from [i+1; end) moves over by -1 - self.array[i:-1] = self.array[i + 1 :] - - # resize by -1 - self.resize(-1) - - return row - - def delete_range(self, rng: range): - i, j = min(rng), max(rng) - - # move over to the left to account for the removed part - cut_length = j - i + 1 - new_length = len(self) - cut_length - self.array[i:new_length] = self.array[j + 1 :] - - # resize by -1 - self.resize(-cut_length) - - def __str__(self): - return str([self[i] for i in range(len(self))]) - - -@dataclass -class HierarchicList: - """A utility class that represents a hierarchy of lists. Each level represents - a list of elements, each element having a set of properties (each property being - stored as an array-like object over elements). Further, each element has a number - of children corresponding to a range of elements in a lower-hierarhy list.""" - - _properties: dict - _parent_list: HierarchicList - _child_list: HierarchicList - _num_children: ArrayList # (1, n) - _child_offset: ArrayList # (1, n) - - def __init__( - self, - properties: dict, - parent_list: HierarchicList = None, - num_children: ArrayList = ArrayList(1, dtype=int), - ): - self._properties = dict() - for key in properties: - self._properties[key] = properties[key].copy() - self._parent_list = parent_list - if self._parent_list is not None: - self._parent_list._child_list = self - self._child_list = None - self._num_children = num_children.copy() if num_children is not None else None - # start off with lazy offsets, self.reindex() creates them - self._child_offset = None - - def copy(self): - new_list = HierarchicList( - self._properties, self._parent_list, self._num_children - ) - new_list._child_list = self._child_list - if self._child_offset is None: - new_list._child_offset = None - else: - new_list._child_offset = self._child_offset.copy() - return new_list - - def set_parent(self, parent_list: HierarchicList): - self._parent_list = parent_list - - def child_index(self, i: int, at: int): - if self._child_offset is not None: - return self._child_offset[i] + at - return self._num_children[0:i].sum() + at - - def reindex(self): - if self._num_children is not None: - self._child_offset = ArrayList( - 1, dtype=int, length=len(self._num_children), val=0 - ) - for i in range(1, len(self)): - self._child_offset[i] = ( - self._child_offset[i - 1] + self._num_children[i - 1] - ) - - def append_child(self, properties): - self._num_children[len(self._num_children) - 1] += 1 - self._child_list.append(properties) - - def insert_child(self, i: int, at: int, properties): - idx = self.child_index(i, at) - self._num_children[i] += 1 - self._child_offset = None - self._child_list.insert(idx, properties) - return idx - - def delete_child(self, i: int, at: int): - idx = self.child_index(i, at) - self._num_children[i] -= 1 - self._child_offset = None - self._child_list.delete(idx) - - def append(self, properties): - if set(properties.keys()) != set(self._properties.keys()): - raise Exception(f"unexpected set of attributes '{list(properties.keys())}") - for key, value in properties.items(): - self._properties[key].append(value) - if self._child_offset is not None: - self._child_offset.append( - self._child_offset[-1:].sum() + self._num_children[-1:].sum() - ) - if self._num_children is not None: - self._num_children.append(0) - - def insert(self, i: int, properties): - if set(properties.keys()) != set(self._properties.keys()): - raise Exception(f"unexpected set of attributes '{list(properties.keys())}") - for key, value in properties.items(): - self._properties[key].insert(i, value) - if self._child_offset is not None: - if i >= len(self._child_offset): - off = self._child_offset[-1:].sum() + self._num_children[-1:].sum() - else: - off = self._child_offset[i] - self._child_offset.insert(i, off) - if self._num_children is not None: - self._num_children.insert(i, 0) - - def delete(self, i: int): - for key in self._properties: - self._properties[key].pop(i) - if self._num_children is not None and self._num_children[i] != 0: - for at in range(self._num_children[i] - 1, -1, -1): - self.delete_child(i, at) - self._num_children.pop(i) - self._child_offset = None - - def delete_range(self, rng: range): - for key in self._properties: - self._properties[key].delete_range(rng) - # iterating in descending order so that child offsets remain valid for subsequent elements - for i in reversed(sorted(rng)): - if self._num_children is not None and self._num_children[i] != 0: - idx = self.child_index(i, 0) - self._child_list.delete_range( - self, range(idx, idx + self._num_children[i]) - ) - self._num_children[i] = 0 - self._child_offset = None - - def __len__(self): - for key in self._properties: - return len(self._properties[key]) - return None - - def __getitem__(self, i: str): - return self._properties[i] - - # def __setitem__(self, i: tuple, val): - # self._properties[i[0]][i[1]] = val - - def num_children(self, i: int): - return self._num_children[i] - - def has_children(self, i: int): - return self._num_children is not None and self._num_children[i] - - def __str__(self): - string = "Properties:\n" - for key in self._properties: - string += f"{key}: {str(self._properties[key])}\n" - string += f"num_children: {str(self._num_children)}\n" - string += f"child_offset: {str(self._child_offset)}\n" - string += "----\n" - string += str(self._child_list) - return string +from chroma.data.system_support import ( + ArrayList, + HierarchicList, + NameList, + StringList, + SystemAssemblyInfo, +) @dataclass @@ -793,14 +293,14 @@ def to_XCS( C = [] for ch_id, chain in enumerate(self.chains()): ch_str = chain.cid - if ch_str in list(constants.CHAIN_ALPHABET): + if reorder_chain: + map_ch_id = ch_id + 1 + elif ch_str in list(constants.CHAIN_ALPHABET): map_ch_id = list(constants.CHAIN_ALPHABET).index(ch_str) else: # fmt: off map_ch_id = np.setdiff1d(np.arange(1, len(constants.CHAIN_ALPHABET)), np.unique(C))[0] # fmt: on - if reorder_chain: - map_ch_id = ch_id + 1 C += [map_ch_id] * chain.num_residues() # Grab full sequence @@ -827,7 +327,7 @@ def to_XCS( ) S = [] # Array will contain sequence indices - for i in range(num_residues): + for i, res in enumerate(self.residues()): # If residue should be mask or not is_mask = False @@ -839,8 +339,6 @@ def to_XCS( if mask_unknown: is_mask = True - # Get residue from system - res = self.get_residue(i) if res is None or not res.has_structure(): is_mask = True @@ -1487,7 +985,7 @@ def _parse_int_range(operands: list, string: bool = False): operands = operand.split("+") ranges = [] for operand in operands: - m = re.fullmatch("(.*\d)-(.+)", operand) + m = re.fullmatch(r"(.*\d)-(.+)", operand) if m: if not all([_is_int(g) for g in m.groups()]): return None @@ -2013,8 +1511,8 @@ def from_CIF_string(cif_string: str): @staticmethod def from_CIF(input_file: str): """Initializes and returns a System object from a CIF file.""" - f = open(input_file, "r") - return System._read_cif(f)[0] + with open(input_file, "r") as f: + return System._read_cif(f)[0] @staticmethod def _read_cif(f, strict=False): @@ -2401,15 +1899,15 @@ def from_PDB_string(cif_string: str, options=""): import io f = io.StringIO(cif_string) - sys = System._read_pdb(f, options) + sys = System._read_pdb(f, options=options) sys.name = "from_string" return sys @staticmethod def from_PDB(input_file: str, options=""): """Initializes and returns a System object from a PDB file.""" - f = open(input_file, "r") - sys = System._read_pdb(f, options) + with open(input_file, "r") as f: + sys = System._read_pdb(f, options=options) sys.name = input_file return sys @@ -2636,8 +2134,8 @@ def _to_float(strval, default): def to_CIF(self, output_file: str): """Writes the System to a CIF file.""" - f = open(output_file, "w") - self._write_cif(f) + with open(output_file, "w") as f: + self._write_cif(f) def to_CIF_string(self): """Returns a CIF string representing the System.""" @@ -2867,8 +2365,8 @@ def to_PDB(self, output_file: str, options: str = ""): include "CHARMM", "CHARMM19", "CHARMM22", "RENUMBER", "NOEND", "NOTER", and "NOALT". This option is case-insensitive. """ - f = open(output_file, "w") - self._write_pdb(f, options) + with open(output_file, "w") as f: + self._write_pdb(f, options) def to_PDB_string(self, options=""): """Writes the System to a PDB string. The options string has the same @@ -3223,10 +2721,13 @@ def _to_standard_aa_mappings( else: if aa == "ARG": A = {an: None for an in ["CD", "NE", "CZ", "NH1", "NH2"]} + atoms = {an: None for an in ["NH1", "NH2"]} for an in A: atom = residue.find_atom(an) if atom is not None and atom.num_locations(): A[an] = atom.get_location(0) + if an in atoms: + atoms[an] = atom if all([a is not None for n, a in A.items()]): dihe1 = System.dihedral( A["CD"], A["NE"], A["CZ"], A["NH1"] @@ -3235,8 +2736,8 @@ def _to_standard_aa_mappings( A["CD"], A["NE"], A["CZ"], A["NH2"] ) if abs(dihe1) > abs(dihe2): - A["NH1"].name = "NH2" - A["NH2"].name = "NH1" + atoms["NH1"].rename("NH2") + atoms["NH2"].rename("NH1") elif drop_coors_unknowns: delete_atoms = True @@ -3883,7 +3384,7 @@ def get_backbone(self, no_hyd=True): bb = [None] * (4 if no_hyd else 5) left = len(bb) for atom in self.atoms(): - i = System.protein_backbone_atom_type(atom.name, no_hyd) + i = System.protein_backbone_atom_type(atom.name, no_hyd, by_name=False) if i is None or bb[i] is not None: continue bb[i] = atom @@ -3998,6 +3499,10 @@ def system(self): def name(self): return self._siblings["name"][self._ix] + def rename(self, new_name: str): + """Assigns the atom a new name.""" + self._siblings["name"][self._ix] = new_name + @property def het(self): return self._siblings["het"][self._ix] @@ -4220,7 +3725,7 @@ def swap(self, other: AtomLocationView): def defined(self): """Return whether this is a valid location.""" - return (self.x is not None) and (self.y is not None) and (self.z is not None) + return not (np.isnan(self.x) or np.isnan(self.y) or np.isnan(self.z)) @property def atom(self): @@ -4509,7 +4014,7 @@ def _split_tokens(expr): return [ t.strip() for p in parts - for t in re.split("\s+", p.strip()) + for t in re.split(r"\s+", p.strip()) if t.strip() != "" ] diff --git a/chroma/data/system_support.py b/chroma/data/system_support.py new file mode 100644 index 0000000..269a9fd --- /dev/null +++ b/chroma/data/system_support.py @@ -0,0 +1,427 @@ +from __future__ import annotations + +from dataclasses import dataclass +from typing import List, Optional + +import numpy as np + + +@dataclass +class SystemAssemblyInfo: + """A class for representing the assembly information for System objects.""" + + assemblies: dict + operations: dict + + def __init__(self, assemblies: Optional[dict] = None, operations: Optional[dict] = None): + self.assemblies = {} if assemblies is None else assemblies + self.operations = {} if operations is None else operations + + @staticmethod + def make_operation(type: str, name: str, matrix: list, vector: list): + op = { + "type": type, + "name": name, + "matrix": np.zeros([3, 3]), + "vector": np.zeros(3), + } + assert len(matrix) == 9, "expected 9 elements in rotation matrix" + assert len(vector) == 3, "expected 3 elements in translation vector" + for i in range(3): + op["vector"][i] = float(vector[i]) + for j in range(3): + op["matrix"][i][j] = float(matrix[i * 3 + j]) + return op + + def delete_chain(self, cid: str): + for _, assembly in self.assemblies.items(): + for ins in assembly["instructions"]: + ins["chains"] = [_id for _id in ins["chains"] if _id != cid] + + def rename_chain(self, old_cid: str, new_cid: str): + for _, assembly in self.assemblies.items(): + for ins in assembly["instructions"]: + ins["chains"] = [ + new_cid if cid == old_cid else cid for cid in ins["chains"] + ] + + +class StringList: + """Memory-efficient list of strings with constant-time access.""" + + def __init__(self, init_list: Optional[List[str]] = None): + init_list = [] if init_list is None else init_list + self.string = "" + self.rng = ArrayList(2, dtype=int) + for item in init_list: + self.append(item) + + def __getitem__(self, i: int): + beg, length = self.rng[i] + return self.string[beg : beg + length] + + def __setitem__(self, i: int, new_string: str): + beg, length = self.rng[i] + self.string = self.string[:beg] + new_string + self.string[beg + length :] + if len(new_string) != length: + self.rng[i, 1] = len(new_string) + self.rng[i + 1 :, 0] = self.rng[i + 1 :, 0] + len(new_string) - length + + def __str__(self): + return self.string + + def __len__(self): + return len(self.rng) + + def copy(self): + new_list = StringList() + new_list.string = self.string + new_list.rng = self.rng.copy() + return new_list + + def append(self, new_string: str): + self.rng.append([len(self.string), len(new_string)]) + self.string = self.string + new_string + + def insert(self, i: int, new_string: str): + if i < len(self): + ix, _ = self.rng[i] + elif i == len(self): + ix = 0 if len(self) == 0 else self.rng[i - 1].sum() + else: + raise Exception( + f"cannot insert in position {i} for stringList of length {len(self)}" + ) + self.string = self.string[0:ix] + new_string + self.string[ix:] + self.rng.insert(i, [ix, len(new_string)]) + if len(new_string) > 0: + self.rng[i + 1 :, 0] = self.rng[i + 1 :, 0] + len(new_string) + + def pop(self, i: int): + beg, length = self.rng[i] + val = self.string[beg : beg + length] + self.string = self.string[0:beg] + self.string[beg + length :] + self.rng[i + 1 :, 0] = self.rng[i + 1 :, 0] - len(val) + self.rng.pop(i) + return val + + def delete_range(self, rng: range): + rng = sorted(rng) + [i, j] = [rng[0], rng[-1]] + beg, _ = self.rng[i] + end = self.rng[j].sum() + self.string = self.string[0:beg] + self.string[end:] + self.rng[j + 1 :, 0] = self.rng[j + 1 :, 0] - (end - beg + 1) + self.rng.delete_range(rng) + + +class NameList: + """A list of repeated names backed by an index table.""" + + def __init__(self, init_list: Optional[List[str]] = None): + init_list = [] if init_list is None else init_list + self._reindex(init_list) + + def _reindex(self, init_list: List[str]): + self.unique_names = [] + self.name_indicies = dict() + self.index_use = dict() + self.indices = ArrayList(1, dtype=int) + for name in init_list: + self.append(name) + + def copy(self): + new_list = NameList() + new_list.unique_names = self.unique_names.copy() + new_list.name_indicies = self.name_indicies.copy() + new_list.index_use = self.index_use.copy() + new_list.indices = self.indices.copy() + return new_list + + def _check_index(self): + if (len(self.unique_names) > 2 * len(self.index_use)) and ( + len(self.unique_names) - len(self.index_use) > 10 + ): + self._reindex([self[i] for i in range(len(self))]) + + def __getitem__(self, i: int): + try: + idx = self.indices[i].item() + except IndexError as e: + raise IndexError(f"index {i} out of range for nameList\n" + str(e)) + return self.unique_names[idx] + + def __setitem__(self, i: int, new_name: str): + try: + idx = self.indices[i] + except IndexError as e: + raise IndexError(f"index {i} out of range for nameList\n" + str(e)) + self.index_use[idx] = self.index_use[idx] - 1 + if self.index_use[idx] == 0: + del self.index_use[idx] + idx = self._get_name_index(new_name) + self.indices[i] = idx + self._update_use(idx, 1) + self._check_index() + + def __str__(self): + return str([self[i] for i in range(len(self))]) + + def __len__(self): + return len(self.indices) + + def _update_use(self, idx, delta): + self.index_use[idx] = self.index_use.get(idx, 0) + delta + if self.index_use[idx] <= 0: + del self.index_use[idx] + + def _get_name_index(self, name: str): + if name not in self.name_indicies: + idx = len(self.name_indicies) + self.name_indicies[name] = idx + self.unique_names.append(name) + else: + idx = self.name_indicies[name] + return idx + + def append(self, name: str): + idx = self._get_name_index(name) + self.indices.append(idx) + self.index_use[idx] = self.index_use.get(idx, 0) + 1 + + def insert(self, i: int, new_string: str): + idx = self._get_name_index(new_string) + self.indices.insert(i, idx) + self.index_use[idx] = self.index_use.get(idx, 0) + 1 + + def pop(self, i: int): + idx = self.indices.pop(i).item() + val = self.unique_names[idx] + self._update_use(idx, -1) + self._check_index() + return val + + def delete_range(self, rng: range): + for i in reversed(sorted(rng)): + self.pop(i) + + +class ArrayList: + def __init__(self, ndims: int, dtype: type, length: int = 0, val=0): + if ndims == 1: + self._array = np.ndarray(shape=(max(length, 2)), dtype=dtype) + else: + self._array = np.ndarray(shape=(max(length, 2), ndims), dtype=dtype) + self.ndims = ndims + self._array[:] = val + self.length = length + self.array = self._array[: self.length] + + def convert_negative_slice(self, slice_obj): + start = slice_obj.start if slice_obj.start is not None else 0 + stop = slice_obj.stop if slice_obj.stop is not None else self.length + if start < 0: + start = self.length + start + if stop < 0: + stop = self.length + stop + return slice(start, stop, slice_obj.step) + + def copy(self): + new_list = ArrayList(ndims=self.ndims, dtype=self.array.dtype, length=len(self)) + new_list[:] = self[:] + return new_list + + def __len__(self): + return self.length + + def capacity(self): + return self._array.shape[0] + + def __getitem__(self, i: int): + return self.array[i] + + def __setitem__(self, i: int, row: list): + self.array[i] = row + + def resize(self, delta): + new_length = self.length + delta + cap = self._array.shape[0] + if (new_length > cap) or (new_length < cap / 3): + self._resize(2 * new_length) + self.length = new_length + self.array = self._array[: self.length] + + def _resize(self, new_size): + if self.ndims == 1: + self._array.resize((new_size), refcheck=False) + else: + self._array.resize((new_size, self.ndims), refcheck=False) + + def items(self): + for i in range(self.length): + yield self.array[i, :] + + def append(self, row: list): + self.resize(1) + self.array[-1] = row + + def insert(self, i: int, row: list): + self.resize(1) + self.array[i + 1 :] = self.array[i:-1] + self.array[i] = row + + def pop(self, i: int): + row = self.array[i].copy() + self.array[i:-1] = self.array[i + 1 :] + self.resize(-1) + return row + + def delete_range(self, rng: range): + i, j = min(rng), max(rng) + cut_length = j - i + 1 + new_length = len(self) - cut_length + self.array[i:new_length] = self.array[j + 1 :] + self.resize(-cut_length) + + def __str__(self): + return str([self[i] for i in range(len(self))]) + + +@dataclass +class HierarchicList: + """Utility class that represents a hierarchy of lists.""" + + _properties: dict + _parent_list: "HierarchicList" + _child_list: "HierarchicList" + _num_children: ArrayList + _child_offset: ArrayList + + def __init__( + self, + properties: dict, + parent_list: "HierarchicList" = None, + num_children: ArrayList = ArrayList(1, dtype=int), + ): + self._properties = {key: value.copy() for key, value in properties.items()} + self._parent_list = parent_list + if self._parent_list is not None: + self._parent_list._child_list = self + self._child_list = None + self._num_children = num_children.copy() if num_children is not None else None + self._child_offset = None + + def copy(self): + new_list = HierarchicList( + self._properties, self._parent_list, self._num_children + ) + new_list._child_list = self._child_list + new_list._child_offset = ( + None if self._child_offset is None else self._child_offset.copy() + ) + return new_list + + def set_parent(self, parent_list: "HierarchicList"): + self._parent_list = parent_list + + def child_index(self, i: int, at: int): + if self._child_offset is not None: + return self._child_offset[i] + at + return self._num_children[0:i].sum() + at + + def reindex(self): + if self._num_children is not None: + self._child_offset = ArrayList( + 1, dtype=int, length=len(self._num_children), val=0 + ) + for i in range(1, len(self)): + self._child_offset[i] = ( + self._child_offset[i - 1] + self._num_children[i - 1] + ) + + def append_child(self, properties): + self._num_children[len(self._num_children) - 1] += 1 + self._child_list.append(properties) + + def insert_child(self, i: int, at: int, properties): + idx = self.child_index(i, at) + self._num_children[i] += 1 + self._child_offset = None + self._child_list.insert(idx, properties) + return idx + + def delete_child(self, i: int, at: int): + idx = self.child_index(i, at) + self._num_children[i] -= 1 + self._child_offset = None + self._child_list.delete(idx) + + def append(self, properties): + if set(properties.keys()) != set(self._properties.keys()): + raise Exception(f"unexpected set of attributes '{list(properties.keys())}") + for key, value in properties.items(): + self._properties[key].append(value) + if self._child_offset is not None: + self._child_offset.append( + self._child_offset[-1:].sum() + self._num_children[-1:].sum() + ) + if self._num_children is not None: + self._num_children.append(0) + + def insert(self, i: int, properties): + if set(properties.keys()) != set(self._properties.keys()): + raise Exception(f"unexpected set of attributes '{list(properties.keys())}") + for key, value in properties.items(): + self._properties[key].insert(i, value) + if self._child_offset is not None: + off = ( + self._child_offset[-1:].sum() + self._num_children[-1:].sum() + if i >= len(self._child_offset) + else self._child_offset[i] + ) + self._child_offset.insert(i, off) + if self._num_children is not None: + self._num_children.insert(i, 0) + + def delete(self, i: int): + for key in self._properties: + self._properties[key].pop(i) + if self._num_children is not None and self._num_children[i] != 0: + for at in range(self._num_children[i] - 1, -1, -1): + self.delete_child(i, at) + self._num_children.pop(i) + self._child_offset = None + + def delete_range(self, rng: range): + for key in self._properties: + self._properties[key].delete_range(rng) + for i in reversed(sorted(rng)): + if self._num_children is not None and self._num_children[i] != 0: + idx = self.child_index(i, 0) + self._child_list.delete_range(self, range(idx, idx + self._num_children[i])) + self._num_children[i] = 0 + self._child_offset = None + + def __len__(self): + for key in self._properties: + return len(self._properties[key]) + return None + + def __getitem__(self, i: str): + return self._properties[i] + + def num_children(self, i: int): + return self._num_children[i] + + def has_children(self, i: int): + return self._num_children is not None and self._num_children[i] + + def __str__(self): + string = "Properties:\n" + for key in self._properties: + string += f"{key}: {str(self._properties[key])}\n" + string += f"num_children: {str(self._num_children)}\n" + string += f"child_offset: {str(self._child_offset)}\n" + string += "----\n" + string += str(self._child_list) + return string diff --git a/chroma/layers/attention.py b/chroma/layers/attention.py index d673c38..6763333 100644 --- a/chroma/layers/attention.py +++ b/chroma/layers/attention.py @@ -16,6 +16,30 @@ import torch.nn as nn +def _normalize_attention_mask(mask, n_head): + if mask is None: + return None + if mask.dim() == 3: + return mask.unsqueeze(1).expand(-1, n_head, -1, -1) + return mask + + +def _scaled_attention(q, k, v, mask=None, bias=None): + logits = torch.einsum("bqhc,bkhc->bhqk", q, k) / q.size(-1) ** 0.5 + if bias is not None: + logits = logits + bias + # Fix #1: mask before softmax so masked keys don't inflate the denominator + # and the output remains a true convex combination of valid values. + # nan_to_num(0.0) guards all-masked query rows (e.g. ghost chains in batches + # with heterogeneous chain counts) which would otherwise produce NaN. + if mask is not None: + logits = logits.masked_fill(~mask, float("-inf")) + weights = torch.nn.functional.softmax(logits, dim=-1) + weights = weights.nan_to_num(0.0) + output = torch.einsum("bhqk,bkhc->bqhc", weights, v) + return output, weights + + class ScaledDotProductAttention(nn.Module): """Scaled dot product attention as described in Eqn 1 of Vaswani et al. 2017 [https://arxiv.org/abs/1706.03762]. @@ -33,7 +57,7 @@ class ScaledDotProductAttention(nn.Module): zeroes (or False) indicate positions that cannot contribute to attention Outputs: output (torch.tensor) of shape (batch_size, sequence_length_q, d_v). The [i-j]-entry output[i,j,:] is formed as a convex combination of values: - \sum_k a_k V[i,k,:] and \sum_k a_k = 1. + \\sum_k a_k V[i,k,:] and \\sum_k a_k = 1. attentions (torch.tensor) of shape (batch_size, sequence_length_q, sequence_length_k)) where the [b,i,j]-element corresponds to the attention value (e.g relative contribution) of position j in the key-tensor to position i in the query tensor in element b of the batch. """ @@ -43,18 +67,14 @@ def __init__(self): self.softmax = nn.Softmax(dim=-1) def forward(self, Q, K, V, mask=None): - _, _, d = K.size() - attn = torch.bmm(Q, K.transpose(1, 2)) / d ** 0.5 - if mask is not None: - attn = attn.float().masked_fill(mask == 0, -1e9) - - attn = self.softmax(attn) - if mask is not None: - attn = attn.float().masked_fill(mask == 0, 0) - - if V.dtype == torch.float16: - attn = attn.half() - output = torch.bmm(attn, V) + output, attn = _scaled_attention( + Q.unsqueeze(2), + K.unsqueeze(2), + V.unsqueeze(2), + mask=None if mask is None else mask.unsqueeze(1), + ) + output = output.squeeze(2) + attn = attn.squeeze(1) return output, attn @@ -94,7 +114,6 @@ def __init__(self, n_head, d_k, d_v, d_model, dropout=0.1): self.Wk = nn.Parameter(torch.Tensor(n_head, d_model, d_k)) self.Wv = nn.Parameter(torch.Tensor(n_head, d_model, d_v)) self.Wo = nn.Parameter(torch.Tensor(n_head * d_v, d_model)) - self.attention = ScaledDotProductAttention() self.dropout = nn.Dropout(p=dropout) self.reset_parameters() @@ -104,6 +123,12 @@ def reset_parameters(self): nn.init.xavier_normal_(self.Wv) nn.init.kaiming_uniform_(self.Wo) + def _project(self, x, weights): + # Compute all head projections in one batched contraction to avoid + # Python loops and repeated concatenation across heads. + projected = torch.einsum("bld,hdm->hblm", x, weights) + return projected.reshape(self.n_head * x.size(0), x.size(1), weights.size(-1)) + def forward(self, Q, K, V, bias=None, mask=None): mb_size, len_q, d_q_in = Q.size() mb_size, len_k, d_k_in = K.size() @@ -118,18 +143,28 @@ def forward(self, Q, K, V, bias=None, mask=None): if d_v_in != d_model: raise ValueError("Dimension of V does not match d_model.") - # treat as a (n_head) size batch and project to d_k and d_v - q_s = torch.cat([Q @ W for W in self.Wq]) # (n_head*mb_size) x len_q x d_k - k_s = torch.cat([K @ W for W in self.Wk]) # (n_head*mb_size) x len_k x d_k - v_s = torch.cat([V @ W for W in self.Wv]) # (n_head*mb_size) x len_v x d_v + # Treat the heads as an expanded batch without materializing one + # projection pass per head in Python. + q_s = self._project(Q, self.Wq) + k_s = self._project(K, self.Wk) + v_s = self._project(V, self.Wv) # Attention - if mask is not None: - mask = mask.repeat(self.n_head, 1, 1) - outputs, attns = self.attention(q_s, k_s, v_s, mask=mask) + q = q_s.reshape(self.n_head, mb_size, len_q, self.d_k).permute(1, 2, 0, 3) + k = k_s.reshape(self.n_head, mb_size, len_k, self.d_k).permute(1, 2, 0, 3) + v = v_s.reshape(self.n_head, mb_size, len_v, self.d_v).permute(1, 2, 0, 3) + outputs, attns = _scaled_attention( + q, + k, + v, + mask=_normalize_attention_mask(mask, self.n_head), + ) - # Back to original mb_size batch, result size = mb_size x len_q x (n_head*d_v) - outputs = torch.cat(torch.split(outputs, mb_size, dim=0), dim=-1) + # Fold the head-major batch back to (batch, query, head * value_dim). + outputs = outputs.reshape(mb_size, len_q, self.n_head * self.d_v) + attns = attns.permute(1, 0, 2, 3).reshape( + self.n_head * mb_size, len_q, len_k + ) # Project back to residual size outputs = outputs @ self.Wo @@ -154,30 +189,21 @@ class AttentionChainPool(nn.Module): def __init__(self, n_head, d_model): super().__init__() - self.attention = MultiHeadAttention( - n_head, d_model, d_model, d_model, dropout=0.0 + self.attention = Attention( + n_head, d_model, d_k=d_model, d_v=d_model, gate=False ) - def get_query(self, x): - return torch.ones(x.size(0), 1, x.size(2)).type(x.dtype).to(x.device) + def get_query(self, x, num_queries=1): + return x.new_ones(x.size(0), num_queries, x.size(2)) def forward(self, h, C): - bs, num_res = C.size() - chains = C.abs().unique() - chains = ( - chains[chains > 0].unsqueeze(-1).repeat(1, bs).reshape(-1).unsqueeze(-1) - ) - num_chains = len(chains.unique()) + chain_ids = C.abs().unique() + chain_ids = chain_ids[chain_ids > 0] + num_chains = len(chain_ids) - h_repeat = h.repeat(num_chains, 1, 1) - C_repeat = C.repeat(num_chains, 1) - mask = (C_repeat == chains).unsqueeze(-2) - - output, _ = self.attention( - self.get_query(h_repeat), h_repeat, h_repeat, mask=mask - ) - output = torch.cat(output.split(bs), 1) - chain_mask = torch.stack(mask.squeeze(1).any(dim=-1).split(bs), -1) + mask = C.abs().unsqueeze(1) == chain_ids.view(1, num_chains, 1) + output = self.attention(self.get_query(h, num_queries=num_chains), h, h, mask=mask) + chain_mask = mask.any(dim=-1) return output, chain_mask @@ -232,24 +258,16 @@ def reset_parameters(self): def forward(self, Q, K, V, bias=None, mask=None): self._check_inputs(Q, K, V, bias, mask) - q = torch.einsum("bqa,ahc->bqhc", Q, self.q_weights) * self.d_k ** (-0.5) + q = torch.einsum("bqa,ahc->bqhc", Q, self.q_weights) k = torch.einsum("bka,ahc->bkhc", K, self.k_weights) v = torch.einsum("bka,ahc->bkhc", V, self.v_weights) - logits = torch.einsum("bqhc,bkhc->bhqk", q, k) - - if bias is not None: - logits = logits + bias - - weights = torch.nn.functional.softmax(logits, dim=-1) - - if mask is not None: - weights = weights.masked_fill(~mask, 0.0) - - weighted_avg = torch.einsum("bhqk,bkhc->bqhc", weights, v) + weighted_avg, _ = _scaled_attention( + q, k, v, mask=_normalize_attention_mask(mask, self.n_head), bias=bias + ) if self.gate: gate_values = torch.einsum("bqa,ahc->bqhc", Q, self.g_weights) + self.g_bias - gate_values = torch.sigmoid(gate_values, dim=-1) + gate_values = torch.sigmoid(gate_values) weighted_avg = weighted_avg * gate_values output = ( @@ -328,12 +346,20 @@ def _check_inputs(self, Q, K, V, bias, mask): raise ValueError( f"Mask specified but not given by correct dtype, should be torch.bool but found {mask.dtype}" ) - if mask.dim() != 4: + if (mask.dim() != 3) and (mask.dim() != 4): + raise ValueError( + f"Mask specified but dimension mismatched: passed {mask.dim()}-dimensional tensor but should be 3-dimensional" + f" of shape (batch_size, num_queries, num_keys) or 4-dimensional" + f" of shape (batch_size, n_head, num_queries, num_keys)" + ) + if mask.dim() == 3: + batch_size_b, num_queries_b, num_keys_b = mask.size() + else: + batch_size_b, _, num_queries_b, num_keys_b = mask.size() + if batch_size_b != batch_size_q: raise ValueError( - f"Mask specified but dimension mismatched: passed {mask.dim()}-dimensional tensor but should be 4-dimensional" - f"of shape (batch_size, n_head, num_queries, num_keys)" + f"Mask specified but batch dimension does not match number of examples given in Q tensor" ) - batch_size_b, _, num_queries_b, num_keys_b = mask.size() if (num_queries_b != num_queries) and (num_queries_b != 1): raise ValueError( f"Bias specified but number of queries (dim of axis=2) does not match number of queries given in Q tensor" diff --git a/chroma/layers/graph.py b/chroma/layers/graph.py index 76662f3..5d7d3ca 100644 --- a/chroma/layers/graph.py +++ b/chroma/layers/graph.py @@ -154,8 +154,8 @@ def forward( return node_h, edge_h def checkpoint(self, layer, *args): - if self.checkpoint_gradients: - return checkpoint(layer, *args) + if self.checkpoint_gradients and torch.is_grad_enabled(): + return checkpoint(layer, *args, use_reentrant=False) else: return layer(*args) @@ -277,9 +277,22 @@ def step( node_h_out = node_h_cache[i + 1] edge_h = edge_h_cache[i] # Update edge and node - node_h_t, edge_h_t = checkpoint( - layer.step, t, node_h, node_h_out, edge_h, edge_idx, mask_i, mask_ij - ) + if self.checkpoint_gradients and torch.is_grad_enabled(): + node_h_t, edge_h_t = checkpoint( + layer.step, + t, + node_h, + node_h_out, + edge_h, + edge_idx, + mask_i, + mask_ij, + use_reentrant=False, + ) + else: + node_h_t, edge_h_t = layer.step( + t, node_h, node_h_out, edge_h, edge_idx, mask_i, mask_ij + ) # Scatter them in place node_h_cache[i + 1].scatter_( diff --git a/chroma/layers/structure/backbone.py b/chroma/layers/structure/backbone.py index 8840afe..e1ba708 100644 --- a/chroma/layers/structure/backbone.py +++ b/chroma/layers/structure/backbone.py @@ -28,6 +28,7 @@ import torch.nn.functional as F from chroma.layers.structure import geometry, transforms +from chroma.utility.torch import call_with_mps_cpu_fallback class ProteinBackbone(nn.Module): @@ -414,9 +415,9 @@ def _build_x_i(v_i, l_i, x, u_minus_1, u_minus_2): """Recurrence relation for placing atoms (NERF)""" # Build matrix encoding local reference frame - n_a_unnorm = torch.cross(u_minus_2, u_minus_1) + n_a_unnorm = torch.cross(u_minus_2, u_minus_1, dim=-1) n_a = F.normalize(n_a_unnorm, dim=-1) - n_b = torch.cross(n_a, u_minus_1) + n_b = torch.cross(n_a, u_minus_1, dim=-1) # Matrix multiply version R = torch.stack([u_minus_1, n_b, n_a], 2) @@ -1052,12 +1053,12 @@ def impute_masked_X(X: torch.Tensor, C: torch.LongTensor) -> torch.Tensor: ix = torch.arange(C_atomic.shape[1], device=X.device).reshape([1, -1]) mask_atomic_extend = mask_atomic.squeeze(-1) ix_mask = mask_atomic_extend * ix - (1 - mask_atomic_extend) - ix_left, _ = torch.cummax(ix_mask, dim=1) + ix_left, _ = call_with_mps_cpu_fallback(torch.cummax, ix_mask, dim=1) ix_flip = torch.flip( mask_atomic_extend * ix_mask + (1 - mask_atomic_extend) * C_atomic.shape[1], [1], ) - ix_right, _ = torch.cummin(ix_flip, dim=1) + ix_right, _ = call_with_mps_cpu_fallback(torch.cummin, ix_flip, dim=1) ix_right = torch.flip(ix_right, [1]) ix_left = ix_left.long() diff --git a/chroma/layers/structure/conditioners.py b/chroma/layers/structure/conditioners.py index bb5a91e..eb8e942 100644 --- a/chroma/layers/structure/conditioners.py +++ b/chroma/layers/structure/conditioners.py @@ -23,7 +23,6 @@ from scipy.sparse.csgraph import shortest_path from torch import nn -import chroma.utility.chroma from chroma.data.protein import Protein from chroma.data.xcs import validate_XC from chroma.layers.structure import backbone, mvn, optimal_transport, symmetry @@ -333,7 +332,9 @@ def __init__( X_target = X_target.cpu().data.numpy() if self.autoscale: - X_target, self.shape_cutoff_D = chroma.utility.chroma.point_cloud_rescale( + from chroma.utility.chroma import point_cloud_rescale + + X_target, self.shape_cutoff_D = point_cloud_rescale( X_target, self.autoscale_num_residues, scale_ratio=self.autoscale_target_ratio, @@ -371,6 +372,8 @@ def _map_gw_coupling_ideal_glob(self, X_target, num_residues): X_target = torch.Tensor(X_target).float().unsqueeze(0) if torch.cuda.is_available(): X_target = X_target.to("cuda") + if torch.backends.mps.is_available(): + X_target = X_target.to("mps") chain_ix = torch.arange(4 * num_residues, device=X_target.device) / 4.0 distance_1D = (chain_ix[None, :, None] - chain_ix[None, None, :]).abs() @@ -537,6 +540,8 @@ def __init__( if device is None: if torch.cuda.is_available(): self.model.to("cuda") + if torch.backends.mps.is_available(): + self.model.to("mps") else: self.model.to(device) self.caption = caption @@ -614,7 +619,7 @@ class ProClassConditioner(Conditioner): renormalize_grad (bool, optional): Whether to renormalize gradient to have overall variance `weight`. use_sequence (bool, optional): Whether to use input sequence, default False. - device (str, optional): the device to put the conditioner on, accepts `cpu` + device (str, optional): the device to put the conditioner on, accepts `cpu`, 'mps' and `cuda`. If None is provided it will automatically try to put it on the GPU if possible. Defaults to None. debug (bool, optional): provides gradient values during optimization for @@ -643,7 +648,9 @@ def __init__( self.debug = debug if isinstance(model, str): - self.proclass_model = graph_classifier.load_model(model, device=device) + self.proclass_model = graph_classifier.load_model( + model, device=device, strict_unexpected=False + ) elif isinstance(model, GraphClassifier): self.proclass_model = model self.proclass_model.eval() @@ -652,6 +659,8 @@ def __init__( if device is None: if torch.cuda.is_available(): self.proclass_model.to("cuda") + if torch.backends.mps.is_available(): + self.proclass_model.to("mps") else: self.proclass_model.to(device) @@ -724,6 +733,8 @@ def _proclass_neglogp(self, X, C, t, label, value=None, O=None, mask=None): if level == "chain": node_h, c_mask = pool(node_h, C) c_mask = c_mask + elif level == "complex": + node_h, c_mask = pool(node_h, C) elif level == "first_order": c_mask = C > 0 elif level == "second_order": @@ -731,6 +742,8 @@ def _proclass_neglogp(self, X, C, t, label, value=None, O=None, mask=None): node_h = head(node_h) if mask is not None: + if level == "complex" and mask.dim() > c_mask.dim(): + mask = mask.squeeze(-1) c_mask = mask & c_mask if self.proclass_model.class_config[label]["loss"] == "ce": @@ -738,7 +751,7 @@ def _proclass_neglogp(self, X, C, t, label, value=None, O=None, mask=None): else: neglogp = node_h.sigmoid().log().mul(-1) - if level == "chain": + if level in ["chain", "complex"]: index = ( self.proclass_model.class_config[label]["tokenizer"][value] if value is not None diff --git a/chroma/layers/structure/diffusion.py b/chroma/layers/structure/diffusion.py index 0f8dc9c..7ff97f5 100644 --- a/chroma/layers/structure/diffusion.py +++ b/chroma/layers/structure/diffusion.py @@ -237,7 +237,7 @@ def sigma_deriv(self, t: Union[float, torch.Tensor]) -> torch.Tensor: def beta(self, t: Union[float, torch.Tensor]) -> torch.Tensor: """compute the drift coefficient for the OU process of the form - $dx = -\frac{1}{2} \beta(t) x dt + g(t) dw_t$ + $dx = -\\frac{1}{2} \\beta(t) x dt + g(t) dw_t$ Args: t (Union[float, torch.Tensor]): t in [0, 1] @@ -255,7 +255,7 @@ def beta(self, t: Union[float, torch.Tensor]) -> torch.Tensor: def g(self, t: Union[float, torch.Tensor]) -> torch.Tensor: """compute drift coefficient for the OU process: - $dx = -\frac{1}{2} \beta(t) x dt + g(t) dw_t$ + $dx = -\\frac{1}{2} \\beta(t) x dt + g(t) dw_t$ Args: t (Union[float, torch.Tensor]): t in [0, 1] @@ -910,7 +910,7 @@ def score( conditioner: Callable = None, detach_X0: bool = True, align_X0: bool = True, - U_traj: List = [], + U_traj: Optional[List] = None, ) -> torch.Tensor: """Compute the score function @@ -953,7 +953,8 @@ def score( Xt, X0_func, Ct, t, detach_X0=detach_X0, align_X0=align_X0 ) - U_traj.append(U_diffusion.detach().cpu()) + if U_traj is not None: + U_traj.append(U_diffusion.detach().cpu()) # Compute score function as negative energy gradient U_total = U_diffusion.sum() + U_conditioner.sum() @@ -1461,8 +1462,8 @@ def conditional_X0( self, X0: torch.Tensor, score: torch.Tensor, C: torch.tensor, t: torch.Tensor ) -> torch.Tensor: """Use Bayes theorem and Tweedie formula to obtain a conditional X0 given - prior X0 and a conditional score \nabla_x p( y | x) - X0 <- X0 + \frac{sigma_t**2}{alpha_t} \Sigma score + prior X0 and a conditional score \\nabla_x p( y | x) + X0 <- X0 + \\frac{sigma_t**2}{alpha_t} \\Sigma score Args: X0 (torch.Tensor): backbone coordinates of size (batch, num_residues, 4, 3) score (torch.Tensor): of size (batch, num_residues, 4, 3) diff --git a/chroma/layers/structure/geometry.py b/chroma/layers/structure/geometry.py index 939143c..ce2a072 100644 --- a/chroma/layers/structure/geometry.py +++ b/chroma/layers/structure/geometry.py @@ -472,86 +472,6 @@ def _pad_pack(D, A, L, O_D, O_A, O_L): return D, A, L, mask_D, mask_A, mask_L -class VirtualAtomsCA(nn.Module): - """Virtual atoms layer, branching from backbone C-alpha carbons. - - This layer places virtual atom coordinates relative to backbone coordinates - in a differentiable way. - - Args: - virtual_type (str, optional): Type of virtual atom to place. Currently - supported types are `dicons`, a virtual placement that was - optimized to predict potential rotamer interactions, and `cbeta` - which places a virtual C-beta carbon assuming ideal geometry. - distance_eps (float, optional): Small parameter to add to squared - distances to make gradients smooth near 0. - - Inputs: - X (Tensor): Backbone coordinates with shape - `(num_batch, num_residues, num_atom_types, 3)`. - C (Tensor): Chain map tensor with shape `(num_batch, num_residues)`. - - Outputs: - X_virtual (Tensor): Virtual coordinates with shape - `(num_batch, num_residues, 3)`. - """ - - def __init__(self, virtual_type="dicons", distance_eps=1e-3): - super(VirtualAtomsCA, self).__init__() - self.distance_eps = distance_eps - - """ - Geometry specifications - dicons - Length CA-X: 2.3866 - Angle N-CA-X: 111.0269 - Dihedral C-N-CA-X: -138.886412 - - cbeta - Length CA-X: 1.532 (Engh and Huber, 2001) - Angle N-CA-X: 109.5 (tetrahedral geometry) - Dihedral C-N-CA-X: -125.25 (109.5 / 2 - 180) - """ - self.virtual_type = virtual_type - virtual_geometries = { - "dicons": [2.3866, 111.0269, -138.8864122], - "cbeta": [1.532, 109.5, -125.25], - } - self.virtual_geometries = virtual_geometries - self.distance_eps = distance_eps - - def geometry(self): - bond, angle, dihedral = self.virtual_geometries[self.virtual_type] - return bond, angle, dihedral - - def forward(self, X: torch.Tensor, C: torch.LongTensor) -> torch.Tensor: - bond, angle, dihedral = self.geometry() - - ones = torch.ones([1, 1], device=X.device) - bonds = bond * ones - angles = angle * ones - dihedrals = dihedral * ones - - # Build reference frame - # 1.C -> 2.N -> 3.CA -> 4.X - X_N, X_CA, X_C, X_O = X.unbind(2) - X_virtual = extend_atoms( - X_C, - X_N, - X_CA, - bonds, - angles, - dihedrals, - degrees=True, - distance_eps=self.distance_eps, - ) - - # Mask missing positions - mask = (C > 0).type(torch.float32).unsqueeze(-1) - X_virtual = mask * X_virtual - return X_virtual - - def quaternions_from_rotations(R: torch.Tensor, eps: float = 1e-3) -> torch.Tensor: """Convert a batch of rotation matrices to quaternions. diff --git a/chroma/layers/structure/mvn.py b/chroma/layers/structure/mvn.py index 6b790b2..7cc27ac 100644 --- a/chroma/layers/structure/mvn.py +++ b/chroma/layers/structure/mvn.py @@ -28,6 +28,7 @@ from chroma.layers import conv from chroma.layers.structure import backbone +from chroma.utility.torch import call_with_mps_cpu_fallback class BackboneMVNGlobular(torch.nn.Module): @@ -566,6 +567,8 @@ def __init__( R_clamp_inverse = torch.linalg.pinv(self.R_clamp) self.register_buffer("R_clamp_inverse", R_clamp_inverse) + RRt_clamp_inverse = torch.linalg.pinv(self.RRt_clamp) + self.register_buffer("RRt_clamp_inverse", RRt_clamp_inverse) self.register_buffer("mu_sample", self.mu(X)) def _center_of_mass(self, X, C): @@ -709,7 +712,8 @@ def _condition_RRt(self, RRt, D): self.register_buffer("S22", RRt[self.nonzero_indices][:, self.nonzero_indices]) S_clamp = self.S11 - ((self.S12 @ torch.linalg.pinv(self.S22) @ self.S21)) - R_clamp = torch.linalg.cholesky(S_clamp) + R_clamp = call_with_mps_cpu_fallback(torch.linalg.cholesky, S_clamp) + self.register_buffer("RRt_clamp_restricted", R_clamp @ R_clamp.t()) RRt_clamp = self._scatter( torch.zeros_like(RRt), self.zero_indices, self.RRt_clamp_restricted diff --git a/chroma/layers/structure/protein_graph.py b/chroma/layers/structure/protein_graph.py index 4584e5d..21fb2fe 100644 --- a/chroma/layers/structure/protein_graph.py +++ b/chroma/layers/structure/protein_graph.py @@ -24,6 +24,8 @@ import json import os import tempfile +import warnings +from importlib import resources from typing import Optional, Tuple import numpy as np @@ -134,6 +136,9 @@ def __init__( edge_features: tuple = ("distances_6mer", "distances_chain"), centered: bool = True, centered_pdb: str = "2g3n", + centering_stats: Optional[dict] = None, + centering_file: Optional[str] = None, + strict_centering: bool = False, ): super(ProteinFeatureGraph, self).__init__() @@ -179,8 +184,25 @@ def _init_layer(layer_dict, features): # Load feature centering params as buffers self.centered = centered self.centered_pdb = centered_pdb.lower() + self.strict_centering = strict_centering + self._initialize_centering_params() if self.centered: - self._load_centering_params(self.centered_pdb) + loaded = False + if centering_stats is not None: + self._set_centering_params(centering_stats) + loaded = True + else: + loaded = self.load_centering_params( + reference_pdb=self.centered_pdb, + centering_file=centering_file, + allow_missing=True, + ) + if self.strict_centering and not loaded: + raise FileNotFoundError( + "Centering stats were requested but no local stats were found. " + "Use `ProteinFeatureGraph.precompute_centering_params(...)` " + "or pass `centering_stats=` / `centering_file=` explicitly." + ) """ Storing separate linear transformations for each layer, rather than concat + one @@ -236,7 +258,9 @@ def forward( edge_h_l = self.edge_linears[i](edge_h_l) edge_h = edge_h_l if edge_h is None else edge_h + edge_h_l if edge_h is None: - edge_h = torch.zeros(list(X.shape[:2]) + [self.dim_nodes], device=X.device) + edge_h = torch.zeros( + list(edge_idx.shape) + [self.dim_edges], device=X.device + ) # Apply masks node_h = mask_i.unsqueeze(-1) * node_h @@ -244,54 +268,130 @@ def forward( return node_h, edge_h, edge_idx, mask_i, mask_ij - def _load_centering_params(self, reference_pdb: str): - basepath = os.path.join(tempfile.gettempdir(), "generate", "params") - if not os.path.exists(basepath): - os.makedirs(basepath) + def _initialize_centering_params(self): + if not self.centered: + return + for i, layer in enumerate(self.node_layers): + self.register_buffer( + f"node_means_{i}", torch.zeros(1, 1, layer.dim_out, dtype=torch.float32) + ) + for i, layer in enumerate(self.edge_layers): + self.register_buffer( + f"edge_means_{i}", torch.zeros(1, 1, layer.dim_out, dtype=torch.float32) + ) - filename = f"centering_{reference_pdb}.params" - self.centering_file = os.path.join(basepath, filename) - key = ( - reference_pdb + def _build_centering_key(self, reference_pdb: str): + return ( + reference_pdb.lower() + ";" + json.dumps(self.node_features) + ";" + json.dumps(self.edge_features) ) - # Attempt to load saved centering params, otherwise compute and cache + def _default_centering_file(self, reference_pdb: str): + basepath = os.path.join(tempfile.gettempdir(), "generate", "params") + if not os.path.exists(basepath): + os.makedirs(basepath) + filename = f"centering_{reference_pdb}.params" + return os.path.join(basepath, filename) + + def _packaged_centering_file(self, reference_pdb: str): + path = ( + resources.files("chroma") + .joinpath("assets") + .joinpath("centering") + .joinpath(f"centering_{reference_pdb}.params") + ) + return path if path.is_file() else None + + def _read_centering_params(self, centering_file: str, reference_pdb: str): + prefix = self._build_centering_key(reference_pdb) + "\t" json_line = None - with open(self.centering_file, "a+") as f: - prefix = key + "\t" + with open(centering_file, "a+") as f: f.seek(0) for line in f: if line.startswith(prefix): json_line = line.split(prefix)[1] break + if json_line is None: + return None + return json.loads(json_line) - if json_line is not None: - print("Loaded from cache") - param_dictionary = json.loads(json_line) - else: - print(f"Computing reference stats for {reference_pdb}") - param_dictionary = self._reference_stats(reference_pdb) - json_line = json.dumps(param_dictionary) - f.write(prefix + "\t" + json_line + "\n") + def _write_centering_params( + self, centering_file: str, reference_pdb: str, param_dictionary: dict + ): + prefix = self._build_centering_key(reference_pdb) + "\t" + with open(centering_file, "a+") as f: + f.seek(0) + for line in f: + if line.startswith(prefix): + return + f.write(prefix + "\t" + json.dumps(param_dictionary) + "\n") + def _set_centering_params(self, param_dictionary: dict): for i, layer in enumerate(self.node_layers): key = json.dumps(self.node_features[i]) - tensor = torch.tensor(param_dictionary[key], dtype=torch.float32) - tensor = tensor.view(1, 1, -1) - self.register_buffer(f"node_means_{i}", tensor) + tensor = torch.tensor(param_dictionary[key], dtype=torch.float32).view( + 1, 1, -1 + ) + getattr(self, f"node_means_{i}").copy_(tensor) for i, layer in enumerate(self.edge_layers): key = json.dumps(self.edge_features[i]) - tensor = torch.tensor(param_dictionary[key], dtype=torch.float32) - tensor = tensor.view(1, 1, -1) - self.register_buffer(f"edge_means_{i}", tensor) - return + tensor = torch.tensor(param_dictionary[key], dtype=torch.float32).view( + 1, 1, -1 + ) + getattr(self, f"edge_means_{i}").copy_(tensor) + + def load_centering_params( + self, + reference_pdb: Optional[str] = None, + centering_file: Optional[str] = None, + allow_missing: bool = False, + ): + if not self.centered: + return False + reference_pdb = (reference_pdb or self.centered_pdb).lower() + centering_file = ( + centering_file + or self._packaged_centering_file(reference_pdb) + or self._default_centering_file(reference_pdb) + ) + param_dictionary = self._read_centering_params(centering_file, reference_pdb) + if param_dictionary is None: + if not allow_missing: + raise FileNotFoundError( + f"No centering stats found for {reference_pdb} in {centering_file}." + ) + return False + self._set_centering_params(param_dictionary) + return True + + def precompute_centering_params( + self, + reference_pdb: Optional[str] = None, + centering_file: Optional[str] = None, + write_cache: bool = True, + ): + reference_pdb = (reference_pdb or self.centered_pdb).lower() + param_dictionary = self._reference_stats(reference_pdb) + self._set_centering_params(param_dictionary) + if write_cache: + centering_file = centering_file or self._default_centering_file( + reference_pdb + ) + self._write_centering_params( + centering_file, reference_pdb, param_dictionary + ) + return param_dictionary def _reference_stats(self, reference_pdb): + warnings.warn( + "Computing centering stats may download remote PDB data. " + "Call this explicitly during preprocessing, not model construction.", + stacklevel=2, + ) X, C, _ = Protein.from_PDBID(reference_pdb).to_XCS() stats_dict = self._feature_stats(X, C) return stats_dict diff --git a/chroma/layers/structure/rmsd.py b/chroma/layers/structure/rmsd.py index a1d2c3d..1964df1 100644 --- a/chroma/layers/structure/rmsd.py +++ b/chroma/layers/structure/rmsd.py @@ -22,6 +22,7 @@ from chroma.layers import graph from chroma.layers.linalg import eig_leading from chroma.layers.structure import geometry, protein_graph +from chroma.utility.torch import call_with_mps_cpu_fallback class CrossRMSD(nn.Module): @@ -108,7 +109,7 @@ def forward(self, X_mobile, X_target): # Compute optimal quaternion by extracting leading eigenvector if self.method == "symeig": - top_eig = torch.linalg.eigvalsh(F)[:, :, 3] + top_eig = call_with_mps_cpu_fallback(torch.linalg.eigvalsh, F)[:, :, 3] elif self.method == "power": top_eig, vec = eig_leading(F, num_iterations=self.method_iter) else: @@ -190,7 +191,7 @@ def pairedRMSD( # Compute optimal quaternion by extracting leading eigenvector if self.method == "symeig": - L, V = torch.linalg.eigh(F) + L, V = call_with_mps_cpu_fallback(torch.linalg.eigh, F) top_eig = L[:, 3] vec = V[:, :, 3] elif self.method == "power": diff --git a/chroma/layers/structure/symmetry.py b/chroma/layers/structure/symmetry.py index ba50660..64577b2 100644 --- a/chroma/layers/structure/symmetry.py +++ b/chroma/layers/structure/symmetry.py @@ -229,7 +229,7 @@ def subsample( X_subdomain = X.reshape(1, G.shape[0], -1, 4, 3)[:, subdomain_idx] X_subdomain = X_subdomain.reshape(1, -1, 4, 3) - C_subdomain = C.reshape(1, G.shape[0], -1)[:, : knbr + 1, :].reshape(1, -1) + C_subdomain = C.reshape(1, G.shape[0], -1)[:, subdomain_idx, :].reshape(1, -1) return X_subdomain, C_subdomain, subdomain_idx, seed_idx diff --git a/chroma/layers/structure/transforms.py b/chroma/layers/structure/transforms.py index 67a970a..b4f3d13 100644 --- a/chroma/layers/structure/transforms.py +++ b/chroma/layers/structure/transforms.py @@ -26,6 +26,10 @@ from chroma.layers import graph from chroma.layers.structure import geometry +from chroma.utility.torch import ( + call_with_explicit_mps_cpu_fallback, + call_with_mps_cpu_fallback, +) def compose_transforms( @@ -356,11 +360,13 @@ def average_transforms( # Average rotation via SVD R_avg_unc = (R * R_probs).sum(dim) R_avg_unc = R_avg_unc + dither_eps * torch.randn_like(R_avg_unc) - U, S, Vh = torch.linalg.svd(R_avg_unc, full_matrices=True) + U, S, Vh = call_with_explicit_mps_cpu_fallback( + torch.linalg.svd, R_avg_unc, full_matrices=True + ) R_avg = U @ Vh # Enforce that matrix is rotation matrix - d = torch.linalg.det(R_avg) + d = call_with_mps_cpu_fallback(torch.linalg.det, R_avg) d_expand = F.pad(d[..., None, None], (2, 0), value=1.0) Vh = Vh * d_expand R_avg = U @ Vh diff --git a/chroma/models/__init__.py b/chroma/models/__init__.py index 17699b3..07d477b 100644 --- a/chroma/models/__init__.py +++ b/chroma/models/__init__.py @@ -17,4 +17,12 @@ be trained on data. See also :mod:`chroma.layers`. """ -from chroma.models.chroma import Chroma +from importlib import import_module + +__all__ = ["Chroma"] + + +def __getattr__(name): + if name == "Chroma": + return import_module("chroma.models.chroma").Chroma + raise AttributeError(f"module {__name__!r} has no attribute {name!r}") diff --git a/chroma/models/chroma.py b/chroma/models/chroma.py index 00d4802..71adaa1 100644 --- a/chroma/models/chroma.py +++ b/chroma/models/chroma.py @@ -24,10 +24,10 @@ import torch import torch.nn as nn -from chroma.constants import AA20_3 from chroma.data.protein import Protein from chroma.layers.structure.backbone import ProteinBackbone from chroma.models import graph_backbone, graph_design +from chroma.utility.torch import get_default_device class Chroma(nn.Module): @@ -50,7 +50,7 @@ class Chroma(nn.Module): to use for the autoregressive design network. device (Optional[str]): The device on which to load the networks. If - not specified, will automatically use a CUDA device if available, + not specified, will automatically use a mps or CUDA device if available, otherwise CPU. strict (bool): Whether to strictly enforce that all keys in `weights` @@ -74,12 +74,10 @@ def __init__( warnings.filterwarnings("ignore") - # If no device is explicity specified automatically set device + # If no device is explicitly specified automatically set device if device is None: - if torch.cuda.is_available(): - device = "cuda" - else: - device = "cpu" + device = get_default_device() + self.backbone_network = graph_backbone.load_model( weights_backbone, device=device, strict=strict, verbose=verbose @@ -547,26 +545,6 @@ def design( protein.sys.update_with_XCS(X_sample, C=None, S=S_sample) return protein - def _design_ar(self, protein, alphabet=None, temp_S=0.1, temp_chi=1e-3): - X, C, S = protein.to_XCS() - ban_S = None - if alphabet is not None: - ban_S = set(AA20_3).difference(alphabet) - - X_sample, S_sample, _, _ = self.design_network_ar.sample( - X, - C, - S, - temperature_S=temp_S, - temperature_chi=temp_chi, - return_scores=True, - ban_S=ban_S, - ) - - protein.sys.update_with_XCS(X_sample, C=None, S=S_sample) - - return protein - def pack( self, protein: Protein, temperature_chi: float = 1e-3, clamped: bool = False ) -> Protein: @@ -697,12 +675,14 @@ def _protein_list_to_XCS(self, list_of_proteins, all_atom=False, device=None): # get all the XCS stuff Xs, Cs, Ss = zip( - *[protein.to_XCS(all_atom=all_atom) for protein in list_of_proteins] + *[ + protein.to_XCS(all_atom=all_atom, device=device) + for protein in list_of_proteins + ] ) # Get Max Dims for Xs, Cs, Ss Dmax = max([C.shape[1] for C in Cs]) - device = Xs[0].device # Augment each with zeros with torch.no_grad(): diff --git a/chroma/models/graph_backbone.py b/chroma/models/graph_backbone.py index 2e1a0f5..e32eb7f 100644 --- a/chroma/models/graph_backbone.py +++ b/chroma/models/graph_backbone.py @@ -15,7 +15,6 @@ """Models for generating protein backbone structure via diffusion. """ -from types import SimpleNamespace from typing import Optional, Tuple, Union import torch @@ -24,7 +23,12 @@ from chroma.data.xcs import validate_XC from chroma.layers import basic, graph from chroma.layers.structure import backbone, diffusion, transforms -from chroma.models.graph_design import BackboneEncoderGNN +from chroma.models.graph_design_components import BackboneEncoderGNN +from chroma.models.model_configs import ( + GraphBackboneConfig, + build_model_config, + config_to_kwargs, +) from chroma.utility.model import load_model as utility_load_model @@ -96,13 +100,50 @@ def __init__( """Initialize GraphBackbone network.""" super(GraphBackbone, self).__init__() - # Save configuration in kwargs - self.kwargs = locals() - self.kwargs.pop("self") - for key in list(self.kwargs.keys()): - if key.startswith("__") and key.endswith("__"): - self.kwargs.pop(key) - args = SimpleNamespace(**self.kwargs) + self.config, self.extra_kwargs = build_model_config( + GraphBackboneConfig, + { + "dim_nodes": dim_nodes, + "dim_edges": dim_edges, + "num_neighbors": num_neighbors, + "node_features": node_features, + "edge_features": edge_features, + "num_layers": num_layers, + "dropout": dropout, + "node_mlp_layers": node_mlp_layers, + "node_mlp_dim": node_mlp_dim, + "edge_update": edge_update, + "edge_mlp_layers": edge_mlp_layers, + "edge_mlp_dim": edge_mlp_dim, + "skip_connect_input": skip_connect_input, + "mlp_activation": mlp_activation, + "decoder_num_hidden": decoder_num_hidden, + "graph_criterion": graph_criterion, + "graph_random_min_local": graph_random_min_local, + "backbone_update_method": backbone_update_method, + "backbone_update_iterations": backbone_update_iterations, + "backbone_update_num_weights": backbone_update_num_weights, + "backbone_update_unconstrained": backbone_update_unconstrained, + "use_time_features": use_time_features, + "time_feature_type": time_feature_type, + "time_log_feature_scaling": time_log_feature_scaling, + "noise_schedule": noise_schedule, + "noise_covariance_model": noise_covariance_model, + "noise_beta_min": noise_beta_min, + "noise_beta_max": noise_beta_max, + "noise_log_snr_range": noise_log_snr_range, + "noise_complex_scaling": noise_complex_scaling, + "loss_scale": loss_scale, + "loss_scale_ssnr_cutoff": loss_scale_ssnr_cutoff, + "loss_function": loss_function, + "checkpoint_gradients": checkpoint_gradients, + "prediction_type": prediction_type, + "num_graph_cycles": num_graph_cycles, + **kwargs, + }, + ) + self.kwargs = config_to_kwargs(self.config, self.extra_kwargs) + args = self.config # Important global options self.dim_nodes = args.dim_nodes @@ -386,8 +427,8 @@ def load_model( Args: weight_file (str): The destination path of the model weights to load. Compatible with files saved by `save_model`. - device (str, optional): Pytorch device specification, e.g. `'cuda'` for - GPU. Default is `'cpu'`. + device (str, optional): Pytorch device specification, e.g. `'cuda'` or `'mps'` for + GPU or `'cpu'` in the absence of GPU. Default is `'cpu'`. strict (bool): Whether to require that the keys match between the input file weights and the model created from the parameters stored in the model kwargs. diff --git a/chroma/models/graph_classifier.py b/chroma/models/graph_classifier.py index 01795a4..36cb9a4 100644 --- a/chroma/models/graph_classifier.py +++ b/chroma/models/graph_classifier.py @@ -15,9 +15,7 @@ """Models for generating protein sequence and side chain conformations given backbones. These can be used for sequence design and packing. """ - - -from types import SimpleNamespace +from typing import Optional import torch import torch.nn as nn @@ -28,10 +26,27 @@ from chroma.layers.basic import NodeProduct, NoOp from chroma.layers.graph import MLP, MaskedNorm from chroma.layers.structure import diffusion -from chroma.models.graph_design import BackboneEncoderGNN +from chroma.models.graph_design_components import BackboneEncoderGNN +from chroma.models.model_configs import ( + GraphClassifierConfig, + build_model_config, + config_to_kwargs, +) from chroma.utility.model import load_model as utility_load_model +class ComplexPool(nn.Module): + """Pool residue embeddings into a single complex embedding.""" + + def __init__(self, n_head, d_model): + super().__init__() + self.chain_pool = AttentionChainPool(n_head, d_model) + + def forward(self, h, C): + pooled_h, complex_mask = self.chain_pool(h, (C > 0).long()) + return pooled_h, complex_mask.squeeze(-1) + + class GraphClassifier(nn.Module): """Graph-based protein classification @@ -72,7 +87,7 @@ def __init__( noise_beta_min=0.2, noise_beta_max=70.0, checkpoint_gradients=False, - class_config={}, + class_config: Optional[dict] = None, out_mlp_layers=2, noise_covariance_model="globular", noise_log_snr_range=(-7.0, 13.5), @@ -85,25 +100,58 @@ def __init__( """Initialize GraphBackbone network.""" super().__init__() - # Save configuration in kwargs - self.kwargs = locals() - self.kwargs.pop("self") - for key in list(self.kwargs.keys()): - if key.startswith("__") and key.endswith("__"): - self.kwargs.pop(key) - args = SimpleNamespace(**self.kwargs) + class_config = {} if class_config is None else class_config + + self.config, self.extra_kwargs = build_model_config( + GraphClassifierConfig, + { + "dim_nodes": dim_nodes, + "dim_edges": dim_edges, + "num_neighbors": num_neighbors, + "node_features": node_features, + "edge_features": edge_features, + "num_layers": num_layers, + "dropout": dropout, + "node_mlp_layers": node_mlp_layers, + "node_mlp_dim": node_mlp_dim, + "edge_update": edge_update, + "edge_mlp_layers": edge_mlp_layers, + "edge_mlp_dim": edge_mlp_dim, + "skip_connect_input": skip_connect_input, + "mlp_activation": mlp_activation, + "graph_criterion": graph_criterion, + "graph_random_min_local": graph_random_min_local, + "use_time_features": use_time_features, + "noise_schedule": noise_schedule, + "noise_beta_min": noise_beta_min, + "noise_beta_max": noise_beta_max, + "checkpoint_gradients": checkpoint_gradients, + "class_config": class_config, + "out_mlp_layers": out_mlp_layers, + "noise_covariance_model": noise_covariance_model, + "noise_log_snr_range": noise_log_snr_range, + "time_feature_type": time_feature_type, + "time_log_feature_scaling": time_log_feature_scaling, + "fourier_scale": fourier_scale, + "zero_grad_fix": zero_grad_fix, + **kwargs, + }, + ) + self.kwargs = config_to_kwargs(self.config, self.extra_kwargs) + args = self.config - self.class_config = class_config + self.class_config = args.class_config # Important global options self.dim_nodes = args.dim_nodes self.dim_edges = args.dim_edges self.mlp_activation = args.mlp_activation self.zero_grad_fix = zero_grad_fix - if "random_fourier_2mer" in args.edge_features: - index = args.edge_features.index("random_fourier_2mer") - args.edge_features.pop(index) - args.edge_features.append( + edge_features = list(args.edge_features) + if "random_fourier_2mer" in edge_features: + index = edge_features.index("random_fourier_2mer") + edge_features.pop(index) + edge_features.append( ( "random_fourier_2mer", { @@ -120,7 +168,7 @@ def __init__( dim_edges=args.dim_edges, num_neighbors=args.num_neighbors, node_features=args.node_features, - edge_features=args.edge_features, + edge_features=edge_features, num_layers=args.num_layers, node_mlp_layers=args.node_mlp_layers, node_mlp_dim=args.node_mlp_dim, @@ -154,7 +202,7 @@ def __init__( covariance_model=args.noise_covariance_model, ) - self._init_heads(class_config, dim_nodes, out_mlp_layers, dropout) + self._init_heads(args.class_config, dim_nodes, out_mlp_layers, dropout) self.condition_sequence_frequency = 0.3 def _init_heads(self, class_config, dim_nodes, out_mlp_layers, dropout): @@ -169,7 +217,7 @@ def _init_heads(self, class_config, dim_nodes, out_mlp_layers, dropout): if group == "chain": pool = AttentionChainPool(8, dim_nodes) elif group == "complex": - raise NotImplementedError + pool = ComplexPool(8, dim_nodes) elif group == "second_order": pool = NoOp() else: @@ -279,6 +327,8 @@ def gradient( if level == "chain": node_h, c_mask = pool(node_h, C) c_mask = c_mask + elif level == "complex": + node_h, c_mask = pool(node_h, C) elif level == "first_order": c_mask = C > 0 elif level == "second_order": @@ -287,6 +337,8 @@ def gradient( node_h = head(node_h) if mask is not None: + if level == "complex" and mask.dim() > c_mask.dim(): + mask = mask.squeeze(-1) c_mask = mask & c_mask if self.class_config[label]["loss"] == "ce": @@ -294,9 +346,7 @@ def gradient( else: neglogp = node_h.sigmoid().log().mul(-1) - index = ( - self.class_config[label]["tokenizer"][value] if value is not None else 0 - ) + index = self.class_config[label]["tokenizer"][value] if value is not None else 0 neglogp = neglogp[..., index][c_mask].sum() neglogp.backward() grad = scale * X.grad @@ -328,8 +378,8 @@ def load_model( Args: weight_file (str): The destination path of the model weights to load. Compatible with files saved by `save_model`. - device (str, optional): Pytorch device specification, e.g. `'cuda'` for - GPU. Default is `'cpu'`. + device (str, optional): Pytorch device specification, e.g. `'cuda'` or `'mps'` for + GPU or `'cpu' in the absence of GPU. `Default is `'cpu'`. strict (bool): Whether to require that the keys match between the input file weights and the model created from the parameters stored in the model kwargs. diff --git a/chroma/models/graph_design.py b/chroma/models/graph_design.py index c74e93f..94a3584 100644 --- a/chroma/models/graph_design.py +++ b/chroma/models/graph_design.py @@ -15,9 +15,6 @@ """Models for generating protein sequence and side chain conformations given backbones. These can be used for sequence design and packing. """ - - -from types import SimpleNamespace from typing import Callable, Literal, Optional, Tuple, Union import numpy as np @@ -34,6 +31,18 @@ EdgeSidechainsDirect, NodeChiRBF, ) +from chroma.models.graph_design_parts import ( + BackboneEncoderGNN, + NodePredictorChi, + NodePredictorS, + ProteinTraversalSpatial, + SidechainDecoderGNN, +) +from chroma.models.model_configs import ( + GraphDesignConfig, + build_model_config, + config_to_kwargs, +) from chroma.utility.model import load_model as utility_load_model @@ -239,13 +248,52 @@ def __init__( """Initialize GraphDesign network.""" super(GraphDesign, self).__init__() - # Save configuration in kwargs - self.kwargs = locals() - self.kwargs.pop("self") - for key in list(self.kwargs.keys()): - if key.startswith("__") and key.endswith("__"): - self.kwargs.pop(key) - args = SimpleNamespace(**self.kwargs) + self.config, self.extra_kwargs = build_model_config( + GraphDesignConfig, + { + "dim_nodes": dim_nodes, + "dim_edges": dim_edges, + "num_neighbors": num_neighbors, + "node_features": node_features, + "edge_features": edge_features, + "sequence_embedding": sequence_embedding, + "sidechain_embedding": sidechain_embedding, + "sidechains": sidechains, + "num_layers": num_layers, + "num_layers_encoder": num_layers_encoder, + "dropout": dropout, + "node_mlp_layers": node_mlp_layers, + "node_mlp_dim": node_mlp_dim, + "edge_update": edge_update, + "edge_mlp_layers": edge_mlp_layers, + "edge_mlp_dim": edge_mlp_dim, + "skip_connect_input": skip_connect_input, + "mlp_activation": mlp_activation, + "num_alphabet": num_alphabet, + "num_chi_bins": num_chi_bins, + "decoder_num_hidden": decoder_num_hidden, + "label_smoothing": label_smoothing, + "separate_packing": separate_packing, + "graph_criterion": graph_criterion, + "graph_random_min_local": graph_random_min_local, + "graph_attentional": graph_attentional, + "graph_num_attention_heads": graph_num_attention_heads, + "predict_S_marginals": predict_S_marginals, + "predict_S_potts": predict_S_potts, + "potts_parameterization": potts_parameterization, + "potts_num_factors": potts_num_factors, + "potts_symmetric_J": potts_symmetric_J, + "noise_schedule": noise_schedule, + "noise_covariance_model": noise_covariance_model, + "noise_complex_scaling": noise_complex_scaling, + "noise_beta_range": noise_beta_range, + "noise_log_snr_range": noise_log_snr_range, + "checkpoint_gradients": checkpoint_gradients, + **kwargs, + }, + ) + self.kwargs = config_to_kwargs(self.config, self.extra_kwargs) + args = self.config # Important global options self.dim_nodes = dim_nodes @@ -417,8 +465,10 @@ def forward( chi, mask_chi = self.X_to_chi(X, C, S) X_noise, mask_X = self.chi_to_X(X_noise_bb, C, S, chi) else: - pass - # TODO IDK what to return here + if X.shape[2] > X_noise_bb.shape[2]: + X_noise = torch.cat([X_noise_bb, X[:, :, 4:, :]], dim=2) + else: + X_noise = X_noise_bb node_h, edge_h, edge_idx, mask_i, mask_ij = self.encode(X_noise, C, t=t) @@ -452,7 +502,7 @@ def forward( X_noise, C, S, node_h, edge_h, edge_idx, mask_i, mask_ij, permute_idx ) else: - logp_S = (None,) + logp_S = None logp_chi = None chi = None mask_chi = None @@ -665,9 +715,13 @@ def loss( m.sum(dim=tuple(range(1, l.dim()))) + self.loss_eps ) mask_S = o["mask_i"] - neglogp_S = -_avg(mask_S, o["logp_S"]) neglogp_chi = -_avg(o["mask_chi"], o["logp_chi"]) - neglogp = neglogp_S + neglogp_chi + if o["logp_S"] is not None: + neglogp_S = -_avg(mask_S, o["logp_S"]) + neglogp = neglogp_S + neglogp_chi + else: + neglogp_S = None + neglogp = neglogp_chi if o["logp_S_marginals"] is not None: neglogp_S_marginals = -_avg(mask_S, o["logp_S_marginals"]) neglogp = neglogp + neglogp_S_marginals @@ -1066,1212 +1120,6 @@ def pack( return X_sample, permute_idx return X_sample, neglogp_chi, permute_idx - - -class BackboneEncoderGNN(nn.Module): - """Graph Neural Network for processing protein structure into graph embeddings. - - Args: - See documention of `structure.protein_graph.ProteinFeatureGraph`, - and `graph.GraphNN` for more details. - - dim_nodes (int): Hidden dimension of node tensors. - dim_edges (int): Hidden dimension of edge tensors. - num_neighbors (int): Number of neighbors per nodes. - node_features (tuple): List of node feature specifications. Features - can be given as strings or as dictionaries. - edge_features (tuple): List of edge feature specifications. Features - can be given as strings or as dictionaries. - num_layers (int): Number of layers. - node_mlp_layers (int): Number of hidden layers for node update - function. - node_mlp_dim (int, optional): Dimension of hidden layers for node update - function, defaults to match output dimension. - edge_update (bool): Whether to include an edge update step. - edge_mlp_layers (int): Number of hidden layers for edge update - function. - edge_mlp_dim (int, optional): Dimension of hidden layers for edge update - function, defaults to match output dimension. - skip_connect_input (bool): Whether to include skip connections between - layers. - mlp_activation (str): MLP nonlinearity function, `relu` or `softplus` - accepted. - dropout (float): Dropout fraction. - graph_distance_atom_type (int): Atom type for computing residue-residue - distances for graph construction. Negative values will specify - centroid across atom types. Default is `-1` (centroid). - graph_cutoff (float, optional): Cutoff distance for graph construction: - mask any edges further than this cutoff. Default is `None`. - graph_mask_interfaces (bool): Restrict connections only to within - chains, excluding-between chain interactions. Default is `False`. - graph_criterion (str): Method used for building graph from distances. - Currently supported methods are `{knn, random_log, random_linear}`. - Default is `knn`. - graph_random_min_local (int): Minimum number of neighbors in GNN that - come from local neighborhood, before random neighbors are chosen. - checkpoint_gradients (bool): Switch to implement gradient checkpointing - during training. - - Inputs: - X (torch.Tensor): Backbone coordinates with shape - `(num_batch, num_residues, num_atoms, 3)`. - C (torch.LongTensor): Chain map with shape `(num_batch, num_residues)`. - node_h_aux (torch.LongTensor, optional): Auxiliary node features with - shape `(num_batch, num_residues, dim_nodes)`. - edge_h_aux (torch.LongTensor, optional): Auxiliary edge features with - shape `(num_batch, num_residues, num_neighbors, dim_edges)`. - edge_idx (torch.LongTensor, optional): Input edge indices for neighbors - with shape `(num_batch, num_residues, num_neighbors)`. - mask_ij (torch.Tensor, optional): Input edge mask with shape - `(num_batch, num_nodes, num_neighbors)`. - - Outputs: - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - edge_h (torch.Tensor): Edge features with shape - `(num_batch, num_residues, num_neighbors, dim_edges)`. - edge_idx (torch.LongTensor): Edge indices for neighbors with shape - `(num_batch, num_residues, num_neighbors)`. - mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. - mask_ij (torch.Tensor): Edge mask with shape - `(num_batch, num_nodes, num_neighbors)`. - """ - - def __init__( - self, - dim_nodes: int = 128, - dim_edges: int = 128, - num_neighbors: int = 30, - node_features: tuple = (("internal_coords", {"log_lengths": True}),), - edge_features: tuple = ( - "distances_2mer", - "orientations_2mer", - "distances_chain", - ), - num_layers: int = 3, - node_mlp_layers: int = 1, - node_mlp_dim: Optional[int] = None, - edge_update: bool = True, - edge_mlp_layers: int = 1, - edge_mlp_dim: Optional[int] = None, - skip_connect_input: bool = False, - mlp_activation: str = "softplus", - dropout: float = 0.1, - graph_distance_atom_type: int = -1, - graph_cutoff: Optional[float] = None, - graph_mask_interfaces: bool = False, - graph_criterion: str = "knn", - graph_random_min_local: int = 20, - checkpoint_gradients: bool = False, - **kwargs - ) -> None: - """Initialize BackboneEncoderGNN.""" - super(BackboneEncoderGNN, self).__init__() - - # Save configuration in kwargs - self.kwargs = locals() - self.kwargs.pop("self") - for key in list(self.kwargs.keys()): - if key.startswith("__") and key.endswith("__"): - self.kwargs.pop(key) - args = SimpleNamespace(**self.kwargs) - - # Important global options - self.dim_nodes = dim_nodes - self.dim_edges = dim_edges - self.checkpoint_gradients = checkpoint_gradients - - graph_kwargs = { - "distance_atom_type": args.graph_distance_atom_type, - "cutoff": args.graph_cutoff, - "mask_interfaces": args.graph_mask_interfaces, - "criterion": args.graph_criterion, - "random_min_local": args.graph_random_min_local, - } - - self.feature_graph = protein_graph.ProteinFeatureGraph( - dim_nodes=args.dim_nodes, - dim_edges=args.dim_edges, - num_neighbors=args.num_neighbors, - graph_kwargs=graph_kwargs, - node_features=args.node_features, - edge_features=args.edge_features, - ) - - self.gnn = graph.GraphNN( - dim_nodes=args.dim_nodes, - dim_edges=args.dim_edges, - num_layers=args.num_layers, - node_mlp_layers=args.node_mlp_layers, - node_mlp_dim=args.node_mlp_dim, - edge_update=args.edge_update, - edge_mlp_layers=args.edge_mlp_layers, - edge_mlp_dim=args.edge_mlp_dim, - mlp_activation=args.mlp_activation, - dropout=args.dropout, - norm="transformer", - scale=args.num_neighbors, - skip_connect_input=args.skip_connect_input, - checkpoint_gradients=checkpoint_gradients, - ) - - @validate_XC(all_atom=False) - def forward( - self, - X: torch.Tensor, - C: torch.LongTensor, - node_h_aux: Optional[torch.Tensor] = None, - edge_h_aux: Optional[torch.Tensor] = None, - edge_idx: Optional[torch.Tensor] = None, - mask_ij: Optional[torch.Tensor] = None, - ) -> Tuple[ - torch.Tensor, torch.Tensor, torch.LongTensor, torch.Tensor, torch.Tensor - ]: - """Encode XC backbone structure into node and edge features.""" - num_batch, num_residues = C.shape - - # Hack to enable checkpointing - if self.checkpoint_gradients and (not X.requires_grad): - X.requires_grad = True - - node_h, edge_h, edge_idx, mask_i, mask_ij = self._checkpoint( - self.feature_graph, X, C, edge_idx, mask_ij - ) - - if node_h_aux is not None: - node_h = node_h + mask_i.unsqueeze(-1) * node_h_aux - if edge_h_aux is not None: - edge_h = edge_h + mask_ij.unsqueeze(-1) * edge_h_aux - - node_h, edge_h = self.gnn(node_h, edge_h, edge_idx, mask_i, mask_ij) - return node_h, edge_h, edge_idx, mask_i, mask_ij - - def _checkpoint(self, module: nn.Module, *args) -> nn.Module: - if self.checkpoint_gradients: - return checkpoint(module, *args) - else: - return module(*args) - - -class SidechainDecoderGNN(nn.Module): - """Autoregressively generate sidechains given backbone graph embeddings. - - Args: - See documention of `structure.protein_graph.ProteinFeatureGraph`, - and `graph.GraphNN` for more details. - - dim_nodes (int): Hidden dimension of node tensors. - dim_edges (int): Hidden dimension of edge tensors. - num_neighbors (int): Number of neighbors per nodes. - predict_S (bool): Whether to predict sequence. - predict_chi (bool): Whether to predict chi angles. - sequence_embedding (str): How to represent sequence when decoding. - Currently the only option is `linear`. - sidechain_embedding (str): How to represent chi angles when decoding. - Options include `chi_linear` for a simple linear layer, `chi_rbf` - for a featurization based on smooth binning of chi angles, - `X_direct` which directly encodes the all-atom coordinates using - random Fourier features, and `mixed_chi_X` which uses both the - featurizations of `chi_rbf` and of `X_direct`. - num_layers (int): Number of layers. - node_mlp_layers (int): Number of hidden layers for node update - function. - node_mlp_dim (int, optional): Dimension of hidden layers for node update - function, defaults to match output dimension. - edge_update (bool): Whether to include an edge update step. - edge_mlp_layers (int): Number of hidden layers for edge update - function. - edge_mlp_dim (int, optional): Dimension of hidden layers for edge update - function, defaults to match output dimension. - skip_connect_input (bool): Whether to include skip connections between - layers. - mlp_activation (str): MLP nonlinearity function, `relu` or `softplus` - accepted. - dropout (float): Dropout fraction. - num_alphabet (int): Number of possible residues. - num_chi_bins (int): Number of chi bins for smooth binning of chi angles - used when `sidechain_embedding` is `chi_rbf` or `mixed_chi_X`. - decoder_num_hidden (int): Dimension of hidden layers. - label_smoothing (float): Level of smoothing to apply to sequence and - sidechain labels. - - Inputs: - X (torch.Tensor): Backbone coordinates with shape - `(num_batch, num_residues, num_atoms, 3)`. - C (torch.LongTensor): Chain map with shape `(num_batch, num_residues)`. - S (torch.LongTensor): Sequence tensor with shape - `(num_batch, num_residues)`. - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - edge_h (torch.Tensor): Edge features with shape - `(num_batch, num_residues, num_neighbors, dim_edges)`. - edge_idx (torch.LongTensor): Edge indices for neighbors with shape - `(num_batch, num_residues, num_neighbors)`. - mask_i (torch.Tensor): Node mask with shape - `(num_batch, num_residues)`. - mask_ij (torch.Tensor): Edge mask with shape - `(num_batch, num_nodes, num_neighbors)`. - permute_idx (torch.LongTensor): Permutation tensor for fixing the - autoregressive decoding order `(num_batch, num_residues)`. If - `None` (default), a random decoding order will be generated. - - Outputs: - logp_S (torch.Tensor): Sequence log likelihoods per residue with shape - `(num_batch, num_residues)`. - logp_chi (torch.Tensor): Chi angle Log likelihoods per residue with - shape `(num_batch, num_residues, 4)`. - chi (torch.Tensor): Sidechain chi angles in radians with shape - `(num_batch, num_residues, 4)`. - mask_chi (torch.Tensor): Mask for chi angles with shape - `(num_batch, num_residues, 4)`. - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - edge_h (torch.Tensor): Edge features with shape - `(num_batch, num_residues, num_neighbors, dim_edges)`. - edge_idx (torch.LongTensor): Edge indices for neighbors with shape - `(num_batch, num_residues, num_neighbors)`. - mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. - mask_ij (torch.Tensor): Edge mask with shape - `(num_batch, num_nodes, num_neighbors)`. - """ - - def __init__( - self, - dim_nodes: int = 128, - dim_edges: int = 128, - num_neighbors: int = 30, - predict_S: bool = True, - predict_chi: bool = True, - sequence_embedding: str = "linear", - sidechain_embedding: str = "mixed_chi_X", - num_layers: int = 3, - node_mlp_layers: int = 1, - node_mlp_dim: Optional[int] = None, - edge_update: bool = True, - edge_mlp_layers: int = 1, - edge_mlp_dim: Optional[int] = None, - skip_connect_input: bool = False, - mlp_activation: str = "softplus", - dropout: float = 0.1, - num_alphabet: int = 20, - num_chi_bins: int = 20, - decoder_num_hidden: int = 512, - label_smoothing: float = 0.1, - checkpoint_gradients: bool = False, - **kwargs - ): - super(SidechainDecoderGNN, self).__init__() - - # Save configuration in kwargs - self.kwargs = locals() - self.kwargs.pop("self") - for key in list(self.kwargs.keys()): - if key.startswith("__") and key.endswith("__"): - self.kwargs.pop(key) - args = SimpleNamespace(**self.kwargs) - - # Important global options - self.dim_nodes = dim_nodes - self.dim_edges = dim_edges - self.num_alphabet = num_alphabet - self.num_chi_bins = num_chi_bins - - # Predict S, chi or both? - assert predict_S or predict_chi - self.predict_S = predict_S - self.predict_chi = predict_chi - - self.sequence_embedding = sequence_embedding - self.sidechain_embedding = sidechain_embedding - if self.sequence_embedding == "linear": - self.W_S = nn.Embedding(num_alphabet, dim_edges) - - # If we are predicting chi angles, then embed them - if self.predict_chi: - if self.sidechain_embedding == "chi_linear": - self.W_chi = nn.Linear(8, dim_edges) - elif self.sidechain_embedding == "chi_rbf": - self.embed_chi = NodeChiRBF( - dim_out=args.dim_edges, num_chi=4, num_chi_bins=args.num_chi_bins - ) - elif self.sidechain_embedding == "X_direct": - self.embed_X = EdgeSidechainsDirect(dim_out=dim_edges) - elif self.sidechain_embedding == "mixed_chi_X": - self.embed_chi = NodeChiRBF( - dim_out=args.dim_edges, num_chi=4, num_chi_bins=args.num_chi_bins - ) - self.embed_X = EdgeSidechainsDirect(dim_out=dim_edges, basis_type="rff") - - # Decoder GNN process backbone - self.gnn = graph.GraphNN( - dim_nodes=args.dim_nodes, - dim_edges=args.dim_edges, - num_layers=args.num_layers, - node_mlp_layers=args.node_mlp_layers, - node_mlp_dim=args.node_mlp_dim, - edge_update=args.edge_update, - edge_mlp_layers=args.edge_mlp_layers, - edge_mlp_dim=args.edge_mlp_dim, - mlp_activation=args.mlp_activation, - dropout=args.dropout, - norm="transformer", - scale=args.num_neighbors, - skip_connect_input=args.skip_connect_input, - checkpoint_gradients=checkpoint_gradients, - ) - - if self.predict_S: - self.decoder_S = NodePredictorS( - num_alphabet=args.num_alphabet, - dim_nodes=args.dim_nodes, - dim_hidden=args.decoder_num_hidden, - label_smoothing=args.label_smoothing, - ) - - if self.predict_chi: - self.decoder_chi = NodePredictorChi( - num_alphabet=args.num_alphabet, - num_chi_bins=args.num_chi_bins, - dim_nodes=args.dim_nodes, - dim_hidden=args.decoder_num_hidden, - label_smoothing=args.label_smoothing, - ) - - self.loss_eps = 1e-5 - self.chi_to_X = sidechain.SideChainBuilder() - self.X_to_chi = sidechain.ChiAngles() - - @validate_XC() - def forward( - self, - X: torch.Tensor, - C: torch.LongTensor, - S: torch.LongTensor, - node_h: torch.Tensor, - edge_h: torch.Tensor, - edge_idx: torch.LongTensor, - mask_i: torch.Tensor, - mask_ij: torch.Tensor, - permute_idx: torch.LongTensor, - ) -> Tuple[ - torch.Tensor, - torch.Tensor, - torch.Tensor, - torch.Tensor, - torch.Tensor, - torch.Tensor, - torch.LongTensor, - torch.Tensor, - torch.Tensor, - ]: - """Predict sequence and chi angles autoregressively given graph features.""" - - # Permute graph representation - ( - node_h_p, - edge_h_p, - edge_idx_p, - mask_i_p, - mask_ij_p, - ) = graph.permute_graph_embeddings( - node_h, edge_h, edge_idx, mask_i, mask_ij, permute_idx - ) - - # Permute sequence and side chain chi angles - X_p = graph.permute_tensor(X, 1, permute_idx) - C_p = graph.permute_tensor(C, 1, permute_idx) - S_p = graph.permute_tensor(S, 1, permute_idx) - chi, mask_chi = self.X_to_chi(X, C, S) - chi_p = graph.permute_tensor(chi, -2, permute_idx) - - # Decode system autoregressively in the permuted coordinates - node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p = self._decode_inner( - X_p, C_p, S_p, chi_p, node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p - ) - - # Unpermute graph representation - permute_idx_inverse = torch.argsort(permute_idx, dim=-1) - node_h, edge_h, edge_idx, mask_i, mask_ij = graph.permute_graph_embeddings( - node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p, permute_idx_inverse - ) - - # Predict per-position joint probabilities of each side-chain's sequence and structure - logp_S, log_probs_S, logp_chi, log_probs_chi = None, None, None, None - if self.predict_S: - (logp_S, log_probs_S,) = self.decoder_S(S, node_h, mask_i) - if self.predict_chi: - (logp_chi, log_probs_chi,) = self.decoder_chi( - S, chi, mask_chi, node_h, mask_i - ) - return ( - logp_S, - logp_chi, - chi, - mask_chi, - node_h, - edge_h, - edge_idx, - mask_i, - mask_ij, - ) - - def _decode_inner( - self, X_p, C_p, S_p, chi_p, node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p - ): - # Build autoregressive mask - mask_ij_p = graph.edge_mask_causal(edge_idx_p, mask_ij_p) - - # Add sequence context - h_S_p = self.W_S(S_p) - h_S_p_ij = graph.collect_neighbors(h_S_p, edge_idx_p) - edge_h_p = edge_h_p + mask_ij_p.unsqueeze(-1) * h_S_p_ij - - # Add side chain context - if self.predict_chi: - if self.sidechain_embedding in ["chi_rbf", "mixed_chi_X"]: - h_chi_p = self.embed_chi(chi_p) - h_chi_p_ij = graph.collect_neighbors(h_chi_p, edge_idx_p) - edge_h_p = edge_h_p + mask_ij_p.unsqueeze(-1) * h_chi_p_ij - - if self.sidechain_embedding == "mixed_chi_X": - edge_feature = self.embed_X(X_p, C_p, S_p, edge_idx_p) - edge_h_p = edge_h_p + mask_ij_p.unsqueeze(-1) * edge_feature - - # Run decoder GNN in parallel (permuted) - node_h_p, edge_h_p = self.gnn( - node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p - ) - return node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p - - def _decode_scatter(self, tensor, src, t): - """Decoding utility function: Scatter.""" - idx = (t * torch.ones_like(src)).long() - tensor.scatter_(1, idx, src) - - def _decode_pre_func(self, t, tensors_t): - """Decoding pre-step function adds features based on current S and chi.""" - _scatter_t = lambda tensor, src: self._decode_scatter(tensor, src, t) - - # Gather relevant tensors at step t - edge_h_p_t = tensors_t["edge_h_cache"][0][:, t, :, :].unsqueeze(1) - edge_idx_p_t = tensors_t["edge_idx"][:, t, :].unsqueeze(1) - mask_ij_p_t = tensors_t["mask_ij"][:, t, :].unsqueeze(1) - - # Update the edge embeddings at t with the relevant context - mask_ij_p_t = mask_ij_p_t.unsqueeze(-1) - - # Add sequence context - h_S_p_ij_t = graph.collect_neighbors(tensors_t["h_S_p"], edge_idx_p_t) - edge_h_p_t = edge_h_p_t + mask_ij_p_t * h_S_p_ij_t - - # Add chi context - if self.predict_chi: - if self.sidechain_embedding in ["chi_rbf", "mixed_chi_X"]: - h_chi_p_ij_t = graph.collect_neighbors( - tensors_t["h_chi_p"], edge_idx_p_t - ) - edge_h_p_t = edge_h_p_t + mask_ij_p_t * h_chi_p_ij_t - if self.sidechain_embedding == "mixed_chi_X": - h_chi_p_ij_t = self.embed_X.step( - t, - tensors_t["X_p"], - tensors_t["C_p"], - tensors_t["S_p"], - edge_idx_p_t, - ) - edge_h_p_t = edge_h_p_t + mask_ij_p_t * h_chi_p_ij_t - - _scatter_t(tensors_t["edge_h_cache"][0], edge_h_p_t) - return tensors_t - - def _decode_post_func( - self, - t, - tensors_t, - S_p_input, - chi_p_input, - temperature_S, - temperature_chi, - sample, - resample_chi, - mask_sample, - mask_sample_p=None, - top_p_S=None, - ban_S=None, - bias_S_func=None, - ): - """Decoding post-step function updates S and chi.""" - _scatter_t = lambda tensor, src: self._decode_scatter(tensor, src, t) - - # Gather relevant tensors at step t - C_p_t = tensors_t["C_p"][:, t].unsqueeze(1) - edge_h_p_t = tensors_t["edge_h_cache"][0][:, t, :, :].unsqueeze(1) - edge_idx_p_t = tensors_t["edge_idx"][:, t, :].unsqueeze(1) - mask_i_p_t = tensors_t["mask_i"][:, t].unsqueeze(1) - mask_ij_p_t = tensors_t["mask_ij"][:, t, :].unsqueeze(1) - node_h_p_t = tensors_t["node_h_cache"][-1][:, t, :].unsqueeze(1) - idx_p_t = tensors_t["idx_p"][:, t].unsqueeze(1) - - # Sample updated sequence - S_p_t = S_p_input[:, t].unsqueeze(1).clone() - if self.predict_S and sample: - bias_S = None - if bias_S_func is not None: - bias_S = bias_S_func( - t, - tensors_t["S_p"], - tensors_t["C_p"], - tensors_t["idx_p"], - edge_idx_p_t, - mask_ij_p_t, - ) - mask_S_t = None - if mask_sample_p is not None: - mask_S_t = mask_sample_p[:, t] - S_p_t = self.decoder_S.sample( - node_h_p_t, - mask_i_p_t, - temperature=temperature_S, - top_p=top_p_S, - bias=bias_S, - mask_S=mask_S_t, - ) - - _scatter_t(tensors_t["S_p"], S_p_t) - - # Sample updated side chain conformations - mask_chi_p_t = sidechain.chi_mask(C_p_t, S_p_t) - chi_p_t = chi_p_input[:, t].unsqueeze(1).clone() - if self.predict_chi and sample: - # Sample chi angles - chi_p_t_sample = self.decoder_chi.sample( - S_p_t, mask_chi_p_t, node_h_p_t, mask_i_p_t, temperature=temperature_chi - ) - - if mask_sample_p is not None and not resample_chi: - m = mask_sample_p[:, t].unsqueeze(-1).expand([-1, 4]) - chi_p_t = torch.where(m > 0, chi_p_t_sample, chi_p_t) - else: - chi_p_t = chi_p_t_sample - - # Rebuild side chain - X_p_t_bb = tensors_t["X_p"][:, t, :4, :].unsqueeze(1) - X_p_t, _ = self.chi_to_X(X_p_t_bb, C_p_t, S_p_t, chi_p_t) - _scatter_t(tensors_t["X_p"], X_p_t) - _scatter_t(tensors_t["chi_p"], chi_p_t) - - # Score the updated sequence and chi angles - if self.predict_S: - logp_S_p_t, _ = self.decoder_S(S_p_t, node_h_p_t, mask_i_p_t) - _scatter_t(tensors_t["logp_S_p"], logp_S_p_t) - if self.predict_chi: - logp_chi_p_t, _ = self.decoder_chi( - S_p_t, chi_p_t, mask_chi_p_t, node_h_p_t, mask_i_p_t - ) - _scatter_t(tensors_t["logp_chi_p"], logp_chi_p_t) - - # Update sequence and chi features (permuted) - h_S_p_t = self.W_S(S_p_t) - _scatter_t(tensors_t["h_S_p"], h_S_p_t) - - # Cache chi embeddings - if self.predict_chi and self.sidechain_embedding in ["chi_rbf", "mixed_chi_X"]: - h_chi_p_t = self.embed_chi(chi_p_t) - _scatter_t(tensors_t["h_chi_p"], h_chi_p_t) - return tensors_t - - @validate_XC() - def decode( - self, - X: torch.Tensor, - C: torch.LongTensor, - S: torch.LongTensor, - node_h: torch.Tensor, - edge_h: torch.Tensor, - edge_idx: torch.LongTensor, - mask_i: torch.Tensor, - mask_ij: torch.Tensor, - permute_idx: torch.LongTensor, - temperature_S: float = 0.1, - temperature_chi: float = 1e-3, - sample: bool = True, - mask_sample: Optional[torch.Tensor] = None, - resample_chi: bool = True, - top_p_S: Optional[float] = None, - ban_S: Optional[tuple] = None, - bias_S_func: Optional[Callable] = None, - ) -> Tuple[torch.LongTensor, torch.Tensor, torch.Tensor, torch.Tensor, dict]: - """Autoregressively decode sequence and chi angles from graph features. - - Args: - X (torch.Tensor): Backbone coordinates with shape - `(num_batch, num_residues, num_atoms, 3)`. - C (torch.LongTensor): Chain map with shape - `(num_batch, num_residues)`. - S (torch.LongTensor): Sequence tensor with shape - `(num_batch, num_residues)`. - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - edge_h (torch.Tensor): Edge features with shape - `(num_batch, num_residues, num_neighbors, dim_edges)`. - edge_idx (torch.LongTensor): Edge indices for neighbors with shape - `(num_batch, num_residues, num_neighbors)`. - mask_i (torch.Tensor): Node mask with shape - `(num_batch, num_residues)`. - mask_ij (torch.Tensor): Edge mask with shape - `(num_batch, num_nodes, num_neighbors)`. - temperature_chi (float): Temperature parameter for sampling chi - angles. Even if a high temperature sequence is sampled, this is - recommended to always be low. Default is `1E-3`. - sample (bool): Whether to sample sequence and chi angles. - mask_sample (torch.Tensor, optional): Binary tensor mask indicating - positions to be sampled with shape `(num_batch, num_residues)`. - If `None` (default), all positions will be sampled. - resample_chi (bool): If `True`, all chi angles will be resampled, - even for sequence positions that were not sampled (i.e. global - repacking). Default is `True`. - top_p_S (float, optional): Top-p cutoff for Nucleus Sampling, see - Holtzman et al ICLR 2020. - ban_S (tuple, optional): An optional set of token indices from - `chroma.constants.AA20` to ban during sampling. - - Returns: - S (torch.LongTensor): Sequence tensor with shape - `(num_batch, num_residues)`. - chi (torch.Tensor): Chi angles with shape - `(num_batch, num_residues, 4)`. - logp_S (torch.Tensor): Sequence log likelihoods per residue with - shape `(num_batch, num_residues)`. - logp_chi (torch.Tensor): Chi angle Log likelihoods per residue with - shape `(num_batch, num_residues, 4)`. - tensors (dict): Processed tensors from GNN decoding. - """ - - # Permute graph representation - ( - node_h_p, - edge_h_p, - edge_idx_p, - mask_i_p, - mask_ij_p, - ) = graph.permute_graph_embeddings( - node_h, edge_h, edge_idx, mask_i, mask_ij, permute_idx - ) - chi, mask_chi = self.X_to_chi(X, C, S) - - # Build autoregressive mask - mask_ij_p = graph.edge_mask_causal(edge_idx_p, mask_ij_p) - - # Initialize tensors - B, N, K = list(edge_idx.shape) - device = node_h.device - idx = torch.arange(end=N, device=device)[None, :].expand(C.shape) - tensors_init = { - "X_p": graph.permute_tensor(X, 1, permute_idx), - "C_p": graph.permute_tensor(C, 1, permute_idx), - "idx_p": graph.permute_tensor(idx, 1, permute_idx), - "S_p": torch.zeros_like(S), - "chi_p": torch.zeros([B, N, 4], device=device), - "h_S_p": torch.zeros([B, N, self.dim_edges], device=device), - "h_chi_p": torch.zeros([B, N, self.dim_edges], device=device), - "node_h": node_h_p, - "edge_h": edge_h_p, - "edge_idx": edge_idx_p, - "mask_i": mask_i_p, - "mask_ij": mask_ij_p, - "logp_S_p": torch.zeros([B, N], device=device), - "logp_chi_p": torch.zeros([B, N, 4], device=device), - } - - # As a sanity check against future state leakage, - # we initialize S and chi and zero and write in the true value - # during sequential decoding - S_p_input = graph.permute_tensor(S, 1, permute_idx) - chi_p_input = graph.permute_tensor(chi, 1, permute_idx) - mask_sample_p = None - if mask_sample is not None: - mask_sample_p = graph.permute_tensor(mask_sample, 1, permute_idx) - - # Pre-step function features current sequence and chi angles - pre_step_func = self._decode_pre_func - - # Post-step function samples sequence and/or chi angles at step t - post_step_func = lambda t, tensors_t: self._decode_post_func( - t, - tensors_t, - S_p_input, - chi_p_input, - temperature_S, - temperature_chi, - sample, - resample_chi, - mask_sample, - mask_sample_p, - top_p_S=top_p_S, - ban_S=ban_S, - bias_S_func=bias_S_func, - ) - - # Sequentially step through a forwards pass of the GNN at each - # position along the node dimension (1), running _pre_func - # and each iteration and _post_func after each iteration - tensors = self.gnn.sequential( - tensors_init, - pre_step_function=pre_step_func, - post_step_function=post_step_func, - ) - - # Unpermute sampled sequence and chi angles - permute_idx_inverse = torch.argsort(permute_idx, dim=-1) - S = graph.permute_tensor(tensors["S_p"], 1, permute_idx_inverse) - chi = graph.permute_tensor(tensors["chi_p"], 1, permute_idx_inverse) - logp_S = graph.permute_tensor(tensors["logp_S_p"], 1, permute_idx_inverse) - logp_chi = graph.permute_tensor(tensors["logp_chi_p"], 1, permute_idx_inverse) - - return S, chi, logp_S, logp_chi, tensors - - -def _filter_logits_top_p(logits, p=0.9): - """Filter logits by top-p (Nucleus sampling). - - See Holtzman et al, ICLR 2020. - - Args: - logits (Tensor): Logits with shape `(..., num_classes)`. - p (float): Cutoff probability. - - Returns: - logits_filters (Tensor): Filtered logits - with shape `(..., num_classes)`. - """ - logits_sort, indices_sort = torch.sort(logits, dim=-1, descending=True) - probs_sort = F.softmax(logits_sort, dim=-1) - probs_cumulative = torch.cumsum(probs_sort, dim=-1) - - # Remove tokens outside nucleus (aside from top token) - logits_sort_filtered = logits_sort.clone() - logits_sort_filtered[probs_cumulative > p] = -float("Inf") - logits_sort_filtered[..., 0] = logits_sort[..., 0] - - # Unsort - logits_filtered = logits_sort_filtered.gather(-1, indices_sort.argsort(-1)) - return logits_filtered - - -class NodePredictorS(nn.Module): - """Predict sequence tokens at each node given embeddings `P(S_i | h_i)`. - - Args: - num_alphabet (int): Number of amino acids. - dim_nodes (int): Node dimension of graph input. - dim_hidden (int): Hidden layer dimension. - loss_eps (float): Small number to avoid division by zero errors when - taking averages. - label_smoothing (float): Level of smoothing to apply. - - Inputs: - S (torch.LongTensor): Sequence tensor with shape - `(num_batch, num_residues)`. - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. - - Outputs: - logp_S (torch.Tensor): Log likelihoods per residue with shape - `(num_batch, num_residues)`. During training, this applies label - smoothing. - log_probs_S (torch.Tensor): Log probabilities for each token for - at each residue with shape - `(num_batch, num_residues, num_alphabet)`. - """ - - def __init__( - self, - num_alphabet: int, - dim_nodes: int, - dim_hidden: int, - loss_eps: float = 1e-5, - label_smoothing: float = 0.1, - ) -> None: - super(NodePredictorS, self).__init__() - self.num_alphabet = num_alphabet - self.dim_nodes = dim_nodes - self.dim_hidden = dim_hidden - self.loss_eps = loss_eps - - self.label_smoothing = label_smoothing - self.training_loss = torch.nn.CrossEntropyLoss( - reduction="none", label_smoothing=self.label_smoothing - ) - - # Layers for predicting sequence and chi angles - self.S_mlp = graph.MLP( - dim_in=dim_nodes, - dim_hidden=dim_hidden, - dim_out=self.num_alphabet, - num_layers_hidden=2, - ) - - def log_probs_S(self, node_h: torch.Tensor, mask_i: torch.Tensor) -> torch.Tensor: - """Compute `log P(S | X, C)`.""" - mask_i_expand = mask_i.unsqueeze(-1) - S_logits = self.S_mlp(node_h) - log_probs_S = mask_i_expand * F.log_softmax(S_logits, -1) - return log_probs_S - - def forward( - self, S: torch.LongTensor, node_h: torch.Tensor, mask_i: torch.Tensor - ) -> Tuple[torch.Tensor, torch.Tensor]: - """Evaluate chi angle joint likelihood given graph embeddings.""" - log_probs_S = self.log_probs_S(node_h, mask_i) - - if self.training: - logp_S = -self.training_loss(log_probs_S.permute([0, 2, 1]), S) - else: - logp_S = torch.gather(log_probs_S, 2, S.unsqueeze(-1)).squeeze(-1) - - return logp_S, log_probs_S - - def sample( - self, - node_h: torch.Tensor, - mask_i: torch.Tensor, - temperature: float = 1.0, - top_p: Optional[float] = None, - mask_S: Optional[torch.Tensor] = None, - bias: Optional[torch.Tensor] = None, - ) -> torch.LongTensor: - """Sample sequence and graph embeddings. - - Args: - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - mask_i (torch.Tensor): Node mask with shape - `(num_batch, num_residues)`. - temperature (float): Temperature parameter for sampling sequence - tokens. The default value of 1.0 corresponds to the model's - unadjusted positions, though because of training such as label - smoothing values less than 1.0 are recommended. - top_p (float, optional): Top-p cutoff for Nucleus Sampling, see - Holtzman et al ICLR 2020. - ban_S (tuple, optional): An optional set of token indices from - `chroma.constants.AA20` to ban during sampling. - - Returns: - S_sample (torch.LongTensor): Sampled sequence of shape `(num_batch, - num_residues)`. - - """ - num_batch, num_residues, _ = node_h.shape - log_probs_S = self.log_probs_S(node_h, mask_i) - if bias is not None: - log_probs_S = log_probs_S + bias - if mask_S is not None: - log_probs_S = torch.where( - mask_S > 0, log_probs_S, -float("Inf") * torch.ones_like(log_probs_S) - ) - if top_p is not None: - log_probs_S = _filter_logits_top_p(log_probs_S, p=top_p) - p = torch.distributions.categorical.Categorical( - logits=log_probs_S / temperature - ) - S_sample = p.sample() - return S_sample - - -class NodePredictorChi(nn.Module): - """Predict chi angles autoregressively at each node given embeddings. - - Decomposes as `P(chi_i_{1-4} | h_i) = P(chi_i_4 | chi_i_<4 h_i) ... P(chi_i_1 | h_i)`. - - Args: - num_alphabet (int): Number of amino acids. - num_chi_bins (int): Number of discretization bins per chi angle. - dim_nodes (int): Node dimension of graph input. - dim_hidden (int): Hidden layer dimension. - loss_eps (float): Small number to avoid division by zero errors when - taking averages. - label_smoothing (float): Level of smoothing to apply. - - Inputs: - S (torch.LongTensor): Sequence tensor with shape - `(num_batch, num_residues)`. - chi (torch.Tensor): Chi angles with shape - `(num_batch, num_residues, 4)`. - mask_chi (torch.Tensor): Chi angle mask with shape - `(num_batch, num_residues, 4)`. - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. - - Outputs: - logp_chi (torch.Tensor): Log likelihoods per residue with shape - `(num_batch, num_residues, 4)`. During training, this applies label - smoothing. - log_probs_chi (torch.Tensor): Log probabilities for each chi angle - token at each residue with shape - `(num_batch, num_residues, 4, num_chi_bins)`. - """ - - def __init__( - self, - num_alphabet: int, - num_chi_bins: int, - dim_nodes: int, - dim_hidden: int, - loss_eps: float = 1e-5, - label_smoothing: float = 0.1, - ) -> None: - super(NodePredictorChi, self).__init__() - self.num_alphabet = num_alphabet - self.num_chi_bins = num_chi_bins - self.dim_nodes = dim_nodes - self.dim_hidden = dim_hidden - self.loss_eps = loss_eps - self.label_smoothing = label_smoothing - self.training_loss = torch.nn.CrossEntropyLoss( - reduction="none", label_smoothing=self.label_smoothing - ) - self._init_chi_bins(num_chi_bins) - - # Layers for embedding sequence and chi angles - self.W_S = nn.Embedding(num_alphabet, dim_nodes) - self.chi_embedding = nn.ModuleList( - [ - NodeChiRBF(dim_out=dim_nodes, num_chi=i, num_chi_bins=num_chi_bins) - for i in [1, 2, 3] - ] - ) - - # Layers for chi angles - self.chi_mlp = nn.ModuleList( - [ - graph.MLP( - dim_in=dim_nodes, - dim_hidden=dim_hidden, - dim_out=num_chi_bins, - num_layers_hidden=2, - ) - for t in range(4) - ] - ) - - def _init_chi_bins(self, num_chi_bins): - # Setup bins - bins = torch.tensor( - np.linspace(-np.pi, np.pi, num_chi_bins + 1), dtype=torch.float32 - ).reshape([1, 1, 1, -1]) - self.register_buffer("bins_left", bins[:, :, :, 0:-1]) - self.register_buffer("bins_right", bins[:, :, :, 1:]) - return - - def _log_probs_t(self, t, S, chi, node_h, mask_i): - """Compute `log P(chi_t | chi_ 0: - chi_t = chi[:, :, :t] - if len(chi_t.shape) == 2: - chi_t = chi_t.unsqueeze(-1) - node_h = node_h + self.chi_embedding[t - 1](chi_t) - - chi_logits = mask_i_expand * self.chi_mlp[t](node_h) - log_probs_chi_t = mask_i_expand * F.log_softmax(chi_logits, -1) - return log_probs_chi_t - - def _sample_continuous(self, logits, left, right): - """Reparamaterization gradients via CDF inversion""" - base_shape = list(logits.shape)[:-1] - CMF = torch.cumsum(F.softmax(logits, dim=-1), dim=-1) - u = torch.rand(base_shape, device=logits.device) - _, max_idx = torch.max((u.unsqueeze(-1) < CMF).float(), dim=-1) - max_idx = max_idx.unsqueeze(-1) - - left = left.expand(base_shape + [-1]) - right = right.expand(base_shape + [-1]) - - # Gather panel bounds - CMF_pad = F.pad(CMF, ((1, 0))) - Y_left = torch.gather(left, -1, max_idx) - Y_right = torch.gather(right, -1, max_idx) - CMF_left = torch.gather(CMF_pad, -1, max_idx) - CMF_right = torch.gather(CMF_pad, -1, max_idx + 1) - - # Local CDF inversion - z = Y_left + (Y_right - Y_left) * (u.unsqueeze(-1) - CMF_left) / ( - CMF_right - CMF_left + 1e-5 - ) - z = z.squeeze(-1) - return z - - def forward( - self, - S: torch.LongTensor, - chi: torch.Tensor, - mask_chi: torch.Tensor, - node_h: torch.Tensor, - mask_i: torch.Tensor, - ) -> Tuple[torch.Tensor, torch.Tensor]: - """Evaluate chi angle joint likelihood given graph embeddings.""" - # Build the likelihood sequentially - log_probs_chi_list = [] - for t in range(4): - log_probs_chi_t = self._log_probs_t(t, S, chi, node_h, mask_i) - log_probs_chi_list.append(log_probs_chi_t) - log_probs_chi = torch.stack(log_probs_chi_list, -2) - - # Loss function - chi = chi.unsqueeze(-1) - chi_onehot = ((chi >= self.bins_left) * (chi < self.bins_right)).float() - if self.training: - scale = self.label_smoothing / (self.num_chi_bins - 1) - chi_onehot = ( - chi_onehot * (1 - self.label_smoothing) + (1 - chi_onehot) * scale - ) - logp_chi = mask_chi * (chi_onehot * log_probs_chi).sum(-1) - return logp_chi, log_probs_chi - - def sample( - self, - S: torch.LongTensor, - mask_chi: torch.Tensor, - node_h: torch.Tensor, - mask_i: torch.Tensor, - temperature: float = 1.0, - ) -> torch.Tensor: - """Sample chi angles given sequence and graph embeddings. - - Args: - S (torch.LongTensor): Sequence tensor with shape - `(num_batch, num_residues)`. - mask_chi (torch.Tensor): Chi angle mask with shape - `(num_batch, num_residues, 4)`. - node_h (torch.Tensor): Node features with shape - `(num_batch, num_residues, dim_nodes)`. - mask_i (torch.Tensor): Node mask with shape - `(num_batch, num_residues)`. - temperature (float): Temperature parameter for sampling sequence - tokens. The default value of 1.0 corresponds to the model's - unadjusted positions, though because of training such as label - smoothing values less than 1.0 are recommended. - - Returns: - chi_sample (torch.Tensor): Chi angles with shape - `(num_batch, num_residues, 4)`. - - """ - - # Sample chi angles sequentially - num_batch, num_residues, _ = node_h.shape - chi = torch.zeros( - [num_batch, num_residues, 4], dtype=torch.float32, device=node_h.device - ) - left = self.bins_left.reshape([1, 1, self.num_chi_bins]) - right = self.bins_right.reshape([1, 1, self.num_chi_bins]) - for t in range(4): - log_probs_chi_t = self._log_probs_t(t, S, chi, node_h, mask_i) - chi_t = self._sample_continuous(log_probs_chi_t / temperature, left, right) - chi = chi + F.pad(chi_t.unsqueeze(-1), (t, 3 - t)) - return mask_chi * chi - - -class ProteinTraversalSpatial(nn.Module): - """Samples spatial correlated residue permutations in a protein. - - Args: - smooth_alpha (float): Smoothing parameter for graph smoothing where - 0 corresponds to no smoothing and 1 corresponds to maximal - smoothing. Default is 1. - smooth_steps (int): Number of graph smoothing steps, which must be - nonnegative. More steps will increase the amount of smoothing. - Default is 5. - smooth_randomize (bool): Enables uniform randomization of - `smooth_alpha` on the interval `(0, smooth_alpha)`. Default is - True. - graph_num_neighbors (int): Number of neighbors for graph - construction. Default is 30. - deterministic (bool): Whether to force determinism. Default is - False. - - Inputs: - X (torch.Tensor): All atom coordinates with shape - `(num_batch, num_residues, 14, 3)`. - C (torch.LongTensor): Chain map with shape - `(num_batch, num_residues)`. - priority (torch.Tensor, optional): Priority values for constraining - residue orderings with shape `(num_batch, num_residues)`. - If residues are assigned to integer-valued groups, the sampled - permutation will be ordered such that all residues within a - lower-valued priority group will occur before residues with - higher-valued priority assignments. - - Outputs: - permute_idx (LongTensor): Permutation tensor containing reordered - residue indices with shape `(num_batch, num_residues)`. - """ - - def __init__( - self, - smooth_alpha: float = 1.0, - smooth_steps: int = 5, - smooth_randomize: bool = True, - graph_num_neighbors: int = 30, - deterministic: bool = False, - ) -> None: - super(ProteinTraversalSpatial, self).__init__() - - self.smooth_alpha = smooth_alpha - self.smooth_steps = smooth_steps - self.smooth_randomize = smooth_randomize - self.deterministic = deterministic - self._determistic_seed = 10 - - self.norm_eps = 1e-5 - self.protein_graph = protein_graph.ProteinGraph( - num_neighbors=graph_num_neighbors - ) - - @validate_XC() - def forward( - self, - X: torch.Tensor, - C: torch.LongTensor, - priority: Optional[torch.Tensor] = None, - ): - # Sample random node keys - if not self.deterministic: - z = torch.rand_like(C.float()) - else: - with torch.random.fork_rng(): - torch.random.manual_seed(self._determistic_seed) - z = torch.rand((1, C.shape[1]), device=C.device).expand(C.shape) - - # Graph-based smoothing - alpha = self.smooth_alpha - if self.smooth_randomize and not self.deterministic: - alpha = torch.rand((), device=X.device) - - if alpha > 0: - edge_idx, mask_ij = self.protein_graph(X, C) - for i in range(self.smooth_steps): - z_neighbors = graph.collect_neighbors( - z.unsqueeze(-1), edge_idx - ).squeeze(-1) - z_average = (mask_ij * z_neighbors).sum(2) / ( - mask_ij.sum(2) + self.norm_eps - ) - z = alpha * z_average + (1.0 - alpha) * z - - if priority is not None: - z = z + priority - - # Create permutation - permute_idx = torch.argsort(z, dim=-1) - return permute_idx - - def load_model( weight_file: str, device: str = "cpu", @@ -2284,8 +1132,8 @@ def load_model( Args: weight_file (str): The destination path of the model weights to load. Compatible with files saved by `save_model`. - device (str, optional): Pytorch device specification, e.g. `'cuda'` for - GPU. Default is `'cpu'`. + device (str, optional): Pytorch device specification, e.g. `'cuda'` or `'mps'` for + GPU or `'cpu'` in the absence of GPU. Default is `'cpu'`. strict (bool): Whether to require that the keys match between the input file weights and the model created from the parameters stored in the model kwargs. diff --git a/chroma/models/graph_design_components.py b/chroma/models/graph_design_components.py new file mode 100644 index 0000000..6374b31 --- /dev/null +++ b/chroma/models/graph_design_components.py @@ -0,0 +1,17 @@ +"""Focused import surface for reusable graph-design building blocks.""" + +from chroma.models.graph_design_parts import ( + BackboneEncoderGNN, + NodePredictorChi, + NodePredictorS, + ProteinTraversalSpatial, + SidechainDecoderGNN, +) + +__all__ = [ + "BackboneEncoderGNN", + "SidechainDecoderGNN", + "NodePredictorS", + "NodePredictorChi", + "ProteinTraversalSpatial", +] diff --git a/chroma/models/graph_design_parts.py b/chroma/models/graph_design_parts.py new file mode 100644 index 0000000..20dfb4b --- /dev/null +++ b/chroma/models/graph_design_parts.py @@ -0,0 +1,1279 @@ +# Copyright Generate Biomedicines, Inc. +# +# Licensed under the Apache License, Version 2.0 (the "License"); +# you may not use this file except in compliance with the License. +# You may obtain a copy of the License at +# +# http://www.apache.org/licenses/LICENSE-2.0 +# +# Unless required by applicable law or agreed to in writing, software +# distributed under the License is distributed on an "AS IS" BASIS, +# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. +# See the License for the specific language governing permissions and +# limitations under the License. + +"""Reusable graph-design encoder, decoder, and traversal components.""" + +from typing import Callable, Optional, Tuple + +import numpy as np +import torch +import torch.nn as nn +import torch.nn.functional as F +from torch.utils.checkpoint import checkpoint + +from chroma.data.xcs import validate_XC +from chroma.layers import graph +from chroma.layers.structure import protein_graph, sidechain +from chroma.layers.structure.protein_graph_allatom import ( + EdgeSidechainsDirect, + NodeChiRBF, +) +from chroma.models.model_configs import ( + BackboneEncoderGNNConfig, + SidechainDecoderGNNConfig, + build_model_config, + config_to_kwargs, +) + +class BackboneEncoderGNN(nn.Module): + """Graph Neural Network for processing protein structure into graph embeddings. + + Args: + See documention of `structure.protein_graph.ProteinFeatureGraph`, + and `graph.GraphNN` for more details. + + dim_nodes (int): Hidden dimension of node tensors. + dim_edges (int): Hidden dimension of edge tensors. + num_neighbors (int): Number of neighbors per nodes. + node_features (tuple): List of node feature specifications. Features + can be given as strings or as dictionaries. + edge_features (tuple): List of edge feature specifications. Features + can be given as strings or as dictionaries. + num_layers (int): Number of layers. + node_mlp_layers (int): Number of hidden layers for node update + function. + node_mlp_dim (int, optional): Dimension of hidden layers for node update + function, defaults to match output dimension. + edge_update (bool): Whether to include an edge update step. + edge_mlp_layers (int): Number of hidden layers for edge update + function. + edge_mlp_dim (int, optional): Dimension of hidden layers for edge update + function, defaults to match output dimension. + skip_connect_input (bool): Whether to include skip connections between + layers. + mlp_activation (str): MLP nonlinearity function, `relu` or `softplus` + accepted. + dropout (float): Dropout fraction. + graph_distance_atom_type (int): Atom type for computing residue-residue + distances for graph construction. Negative values will specify + centroid across atom types. Default is `-1` (centroid). + graph_cutoff (float, optional): Cutoff distance for graph construction: + mask any edges further than this cutoff. Default is `None`. + graph_mask_interfaces (bool): Restrict connections only to within + chains, excluding-between chain interactions. Default is `False`. + graph_criterion (str): Method used for building graph from distances. + Currently supported methods are `{knn, random_log, random_linear}`. + Default is `knn`. + graph_random_min_local (int): Minimum number of neighbors in GNN that + come from local neighborhood, before random neighbors are chosen. + checkpoint_gradients (bool): Switch to implement gradient checkpointing + during training. + + Inputs: + X (torch.Tensor): Backbone coordinates with shape + `(num_batch, num_residues, num_atoms, 3)`. + C (torch.LongTensor): Chain map with shape `(num_batch, num_residues)`. + node_h_aux (torch.LongTensor, optional): Auxiliary node features with + shape `(num_batch, num_residues, dim_nodes)`. + edge_h_aux (torch.LongTensor, optional): Auxiliary edge features with + shape `(num_batch, num_residues, num_neighbors, dim_edges)`. + edge_idx (torch.LongTensor, optional): Input edge indices for neighbors + with shape `(num_batch, num_residues, num_neighbors)`. + mask_ij (torch.Tensor, optional): Input edge mask with shape + `(num_batch, num_nodes, num_neighbors)`. + + Outputs: + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + edge_h (torch.Tensor): Edge features with shape + `(num_batch, num_residues, num_neighbors, dim_edges)`. + edge_idx (torch.LongTensor): Edge indices for neighbors with shape + `(num_batch, num_residues, num_neighbors)`. + mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. + mask_ij (torch.Tensor): Edge mask with shape + `(num_batch, num_nodes, num_neighbors)`. + """ + + def __init__( + self, + dim_nodes: int = 128, + dim_edges: int = 128, + num_neighbors: int = 30, + node_features: tuple = (("internal_coords", {"log_lengths": True}),), + edge_features: tuple = ( + "distances_2mer", + "orientations_2mer", + "distances_chain", + ), + num_layers: int = 3, + node_mlp_layers: int = 1, + node_mlp_dim: Optional[int] = None, + edge_update: bool = True, + edge_mlp_layers: int = 1, + edge_mlp_dim: Optional[int] = None, + skip_connect_input: bool = False, + mlp_activation: str = "softplus", + dropout: float = 0.1, + graph_distance_atom_type: int = -1, + graph_cutoff: Optional[float] = None, + graph_mask_interfaces: bool = False, + graph_criterion: str = "knn", + graph_random_min_local: int = 20, + checkpoint_gradients: bool = False, + **kwargs + ) -> None: + """Initialize BackboneEncoderGNN.""" + super(BackboneEncoderGNN, self).__init__() + + self.config, self.extra_kwargs = build_model_config( + BackboneEncoderGNNConfig, + { + "dim_nodes": dim_nodes, + "dim_edges": dim_edges, + "num_neighbors": num_neighbors, + "node_features": node_features, + "edge_features": edge_features, + "num_layers": num_layers, + "node_mlp_layers": node_mlp_layers, + "node_mlp_dim": node_mlp_dim, + "edge_update": edge_update, + "edge_mlp_layers": edge_mlp_layers, + "edge_mlp_dim": edge_mlp_dim, + "skip_connect_input": skip_connect_input, + "mlp_activation": mlp_activation, + "dropout": dropout, + "graph_distance_atom_type": graph_distance_atom_type, + "graph_cutoff": graph_cutoff, + "graph_mask_interfaces": graph_mask_interfaces, + "graph_criterion": graph_criterion, + "graph_random_min_local": graph_random_min_local, + "checkpoint_gradients": checkpoint_gradients, + **kwargs, + }, + ) + self.kwargs = config_to_kwargs(self.config, self.extra_kwargs) + args = self.config + + # Important global options + self.dim_nodes = dim_nodes + self.dim_edges = dim_edges + self.checkpoint_gradients = checkpoint_gradients + + graph_kwargs = { + "distance_atom_type": args.graph_distance_atom_type, + "cutoff": args.graph_cutoff, + "mask_interfaces": args.graph_mask_interfaces, + "criterion": args.graph_criterion, + "random_min_local": args.graph_random_min_local, + } + + self.feature_graph = protein_graph.ProteinFeatureGraph( + dim_nodes=args.dim_nodes, + dim_edges=args.dim_edges, + num_neighbors=args.num_neighbors, + graph_kwargs=graph_kwargs, + node_features=args.node_features, + edge_features=args.edge_features, + ) + + self.gnn = graph.GraphNN( + dim_nodes=args.dim_nodes, + dim_edges=args.dim_edges, + num_layers=args.num_layers, + node_mlp_layers=args.node_mlp_layers, + node_mlp_dim=args.node_mlp_dim, + edge_update=args.edge_update, + edge_mlp_layers=args.edge_mlp_layers, + edge_mlp_dim=args.edge_mlp_dim, + mlp_activation=args.mlp_activation, + dropout=args.dropout, + norm="transformer", + scale=args.num_neighbors, + skip_connect_input=args.skip_connect_input, + checkpoint_gradients=checkpoint_gradients, + ) + + @validate_XC(all_atom=False) + def forward( + self, + X: torch.Tensor, + C: torch.LongTensor, + node_h_aux: Optional[torch.Tensor] = None, + edge_h_aux: Optional[torch.Tensor] = None, + edge_idx: Optional[torch.Tensor] = None, + mask_ij: Optional[torch.Tensor] = None, + ) -> Tuple[ + torch.Tensor, torch.Tensor, torch.LongTensor, torch.Tensor, torch.Tensor + ]: + """Encode XC backbone structure into node and edge features.""" + num_batch, num_residues = C.shape + + node_h, edge_h, edge_idx, mask_i, mask_ij = self._checkpoint( + self.feature_graph, X, C, edge_idx, mask_ij + ) + + if node_h_aux is not None: + node_h = node_h + mask_i.unsqueeze(-1) * node_h_aux + if edge_h_aux is not None: + edge_h = edge_h + mask_ij.unsqueeze(-1) * edge_h_aux + + node_h, edge_h = self.gnn(node_h, edge_h, edge_idx, mask_i, mask_ij) + return node_h, edge_h, edge_idx, mask_i, mask_ij + + def _checkpoint(self, module: nn.Module, *args) -> nn.Module: + if self.checkpoint_gradients and torch.is_grad_enabled(): + return checkpoint(module, *args, use_reentrant=False) + else: + return module(*args) + + +class SidechainDecoderGNN(nn.Module): + """Autoregressively generate sidechains given backbone graph embeddings. + + Args: + See documention of `structure.protein_graph.ProteinFeatureGraph`, + and `graph.GraphNN` for more details. + + dim_nodes (int): Hidden dimension of node tensors. + dim_edges (int): Hidden dimension of edge tensors. + num_neighbors (int): Number of neighbors per nodes. + predict_S (bool): Whether to predict sequence. + predict_chi (bool): Whether to predict chi angles. + sequence_embedding (str): How to represent sequence when decoding. + Currently the only option is `linear`. + sidechain_embedding (str): How to represent chi angles when decoding. + Options include `chi_linear` for a simple linear layer, `chi_rbf` + for a featurization based on smooth binning of chi angles, + `X_direct` which directly encodes the all-atom coordinates using + random Fourier features, and `mixed_chi_X` which uses both the + featurizations of `chi_rbf` and of `X_direct`. + num_layers (int): Number of layers. + node_mlp_layers (int): Number of hidden layers for node update + function. + node_mlp_dim (int, optional): Dimension of hidden layers for node update + function, defaults to match output dimension. + edge_update (bool): Whether to include an edge update step. + edge_mlp_layers (int): Number of hidden layers for edge update + function. + edge_mlp_dim (int, optional): Dimension of hidden layers for edge update + function, defaults to match output dimension. + skip_connect_input (bool): Whether to include skip connections between + layers. + mlp_activation (str): MLP nonlinearity function, `relu` or `softplus` + accepted. + dropout (float): Dropout fraction. + num_alphabet (int): Number of possible residues. + num_chi_bins (int): Number of chi bins for smooth binning of chi angles + used when `sidechain_embedding` is `chi_rbf` or `mixed_chi_X`. + decoder_num_hidden (int): Dimension of hidden layers. + label_smoothing (float): Level of smoothing to apply to sequence and + sidechain labels. + + Inputs: + X (torch.Tensor): Backbone coordinates with shape + `(num_batch, num_residues, num_atoms, 3)`. + C (torch.LongTensor): Chain map with shape `(num_batch, num_residues)`. + S (torch.LongTensor): Sequence tensor with shape + `(num_batch, num_residues)`. + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + edge_h (torch.Tensor): Edge features with shape + `(num_batch, num_residues, num_neighbors, dim_edges)`. + edge_idx (torch.LongTensor): Edge indices for neighbors with shape + `(num_batch, num_residues, num_neighbors)`. + mask_i (torch.Tensor): Node mask with shape + `(num_batch, num_residues)`. + mask_ij (torch.Tensor): Edge mask with shape + `(num_batch, num_nodes, num_neighbors)`. + permute_idx (torch.LongTensor): Permutation tensor for fixing the + autoregressive decoding order `(num_batch, num_residues)`. If + `None` (default), a random decoding order will be generated. + + Outputs: + logp_S (torch.Tensor): Sequence log likelihoods per residue with shape + `(num_batch, num_residues)`. + logp_chi (torch.Tensor): Chi angle Log likelihoods per residue with + shape `(num_batch, num_residues, 4)`. + chi (torch.Tensor): Sidechain chi angles in radians with shape + `(num_batch, num_residues, 4)`. + mask_chi (torch.Tensor): Mask for chi angles with shape + `(num_batch, num_residues, 4)`. + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + edge_h (torch.Tensor): Edge features with shape + `(num_batch, num_residues, num_neighbors, dim_edges)`. + edge_idx (torch.LongTensor): Edge indices for neighbors with shape + `(num_batch, num_residues, num_neighbors)`. + mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. + mask_ij (torch.Tensor): Edge mask with shape + `(num_batch, num_nodes, num_neighbors)`. + """ + + def __init__( + self, + dim_nodes: int = 128, + dim_edges: int = 128, + num_neighbors: int = 30, + predict_S: bool = True, + predict_chi: bool = True, + sequence_embedding: str = "linear", + sidechain_embedding: str = "mixed_chi_X", + num_layers: int = 3, + node_mlp_layers: int = 1, + node_mlp_dim: Optional[int] = None, + edge_update: bool = True, + edge_mlp_layers: int = 1, + edge_mlp_dim: Optional[int] = None, + skip_connect_input: bool = False, + mlp_activation: str = "softplus", + dropout: float = 0.1, + num_alphabet: int = 20, + num_chi_bins: int = 20, + decoder_num_hidden: int = 512, + label_smoothing: float = 0.1, + checkpoint_gradients: bool = False, + **kwargs + ): + super(SidechainDecoderGNN, self).__init__() + + self.config, self.extra_kwargs = build_model_config( + SidechainDecoderGNNConfig, + { + "dim_nodes": dim_nodes, + "dim_edges": dim_edges, + "num_neighbors": num_neighbors, + "predict_S": predict_S, + "predict_chi": predict_chi, + "sequence_embedding": sequence_embedding, + "sidechain_embedding": sidechain_embedding, + "num_layers": num_layers, + "node_mlp_layers": node_mlp_layers, + "node_mlp_dim": node_mlp_dim, + "edge_update": edge_update, + "edge_mlp_layers": edge_mlp_layers, + "edge_mlp_dim": edge_mlp_dim, + "skip_connect_input": skip_connect_input, + "mlp_activation": mlp_activation, + "dropout": dropout, + "num_alphabet": num_alphabet, + "num_chi_bins": num_chi_bins, + "decoder_num_hidden": decoder_num_hidden, + "label_smoothing": label_smoothing, + "checkpoint_gradients": checkpoint_gradients, + **kwargs, + }, + ) + self.kwargs = config_to_kwargs(self.config, self.extra_kwargs) + args = self.config + + # Important global options + self.dim_nodes = dim_nodes + self.dim_edges = dim_edges + self.num_alphabet = num_alphabet + self.num_chi_bins = num_chi_bins + + # Predict S, chi or both? + assert predict_S or predict_chi + self.predict_S = predict_S + self.predict_chi = predict_chi + + self.sequence_embedding = sequence_embedding + self.sidechain_embedding = sidechain_embedding + if self.sequence_embedding == "linear": + self.W_S = nn.Embedding(num_alphabet, dim_edges) + + # If we are predicting chi angles, then embed them + if self.predict_chi: + if self.sidechain_embedding == "chi_linear": + self.W_chi = nn.Linear(8, dim_edges) + elif self.sidechain_embedding == "chi_rbf": + self.embed_chi = NodeChiRBF( + dim_out=args.dim_edges, num_chi=4, num_chi_bins=args.num_chi_bins + ) + elif self.sidechain_embedding == "X_direct": + self.embed_X = EdgeSidechainsDirect(dim_out=dim_edges) + elif self.sidechain_embedding == "mixed_chi_X": + self.embed_chi = NodeChiRBF( + dim_out=args.dim_edges, num_chi=4, num_chi_bins=args.num_chi_bins + ) + self.embed_X = EdgeSidechainsDirect(dim_out=dim_edges, basis_type="rff") + + # Decoder GNN process backbone + self.gnn = graph.GraphNN( + dim_nodes=args.dim_nodes, + dim_edges=args.dim_edges, + num_layers=args.num_layers, + node_mlp_layers=args.node_mlp_layers, + node_mlp_dim=args.node_mlp_dim, + edge_update=args.edge_update, + edge_mlp_layers=args.edge_mlp_layers, + edge_mlp_dim=args.edge_mlp_dim, + mlp_activation=args.mlp_activation, + dropout=args.dropout, + norm="transformer", + scale=args.num_neighbors, + skip_connect_input=args.skip_connect_input, + checkpoint_gradients=checkpoint_gradients, + ) + + if self.predict_S: + self.decoder_S = NodePredictorS( + num_alphabet=args.num_alphabet, + dim_nodes=args.dim_nodes, + dim_hidden=args.decoder_num_hidden, + label_smoothing=args.label_smoothing, + ) + + if self.predict_chi: + self.decoder_chi = NodePredictorChi( + num_alphabet=args.num_alphabet, + num_chi_bins=args.num_chi_bins, + dim_nodes=args.dim_nodes, + dim_hidden=args.decoder_num_hidden, + label_smoothing=args.label_smoothing, + ) + + self.loss_eps = 1e-5 + self.chi_to_X = sidechain.SideChainBuilder() + self.X_to_chi = sidechain.ChiAngles() + + @validate_XC() + def forward( + self, + X: torch.Tensor, + C: torch.LongTensor, + S: torch.LongTensor, + node_h: torch.Tensor, + edge_h: torch.Tensor, + edge_idx: torch.LongTensor, + mask_i: torch.Tensor, + mask_ij: torch.Tensor, + permute_idx: torch.LongTensor, + ) -> Tuple[ + torch.Tensor, + torch.Tensor, + torch.Tensor, + torch.Tensor, + torch.Tensor, + torch.Tensor, + torch.LongTensor, + torch.Tensor, + torch.Tensor, + ]: + """Predict sequence and chi angles autoregressively given graph features.""" + + # Permute graph representation + ( + node_h_p, + edge_h_p, + edge_idx_p, + mask_i_p, + mask_ij_p, + ) = graph.permute_graph_embeddings( + node_h, edge_h, edge_idx, mask_i, mask_ij, permute_idx + ) + + # Permute sequence and side chain chi angles + X_p = graph.permute_tensor(X, 1, permute_idx) + C_p = graph.permute_tensor(C, 1, permute_idx) + S_p = graph.permute_tensor(S, 1, permute_idx) + chi, mask_chi = self.X_to_chi(X, C, S) + chi_p = graph.permute_tensor(chi, -2, permute_idx) + + # Decode system autoregressively in the permuted coordinates + node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p = self._decode_inner( + X_p, C_p, S_p, chi_p, node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p + ) + + # Unpermute graph representation + permute_idx_inverse = torch.argsort(permute_idx, dim=-1) + node_h, edge_h, edge_idx, mask_i, mask_ij = graph.permute_graph_embeddings( + node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p, permute_idx_inverse + ) + + # Predict per-position joint probabilities of each side-chain's sequence and structure + logp_S, log_probs_S, logp_chi, log_probs_chi = None, None, None, None + if self.predict_S: + (logp_S, log_probs_S,) = self.decoder_S(S, node_h, mask_i) + if self.predict_chi: + (logp_chi, log_probs_chi,) = self.decoder_chi( + S, chi, mask_chi, node_h, mask_i + ) + return ( + logp_S, + logp_chi, + chi, + mask_chi, + node_h, + edge_h, + edge_idx, + mask_i, + mask_ij, + ) + + def _decode_inner( + self, X_p, C_p, S_p, chi_p, node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p + ): + # Build autoregressive mask + mask_ij_p = graph.edge_mask_causal(edge_idx_p, mask_ij_p) + + # Add sequence context + h_S_p = self.W_S(S_p) + h_S_p_ij = graph.collect_neighbors(h_S_p, edge_idx_p) + edge_h_p = edge_h_p + mask_ij_p.unsqueeze(-1) * h_S_p_ij + + # Add side chain context + if self.predict_chi: + if self.sidechain_embedding in ["chi_rbf", "mixed_chi_X"]: + h_chi_p = self.embed_chi(chi_p) + h_chi_p_ij = graph.collect_neighbors(h_chi_p, edge_idx_p) + edge_h_p = edge_h_p + mask_ij_p.unsqueeze(-1) * h_chi_p_ij + + if self.sidechain_embedding == "mixed_chi_X": + edge_feature = self.embed_X(X_p, C_p, S_p, edge_idx_p) + edge_h_p = edge_h_p + mask_ij_p.unsqueeze(-1) * edge_feature + + # Run decoder GNN in parallel (permuted) + node_h_p, edge_h_p = self.gnn( + node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p + ) + return node_h_p, edge_h_p, edge_idx_p, mask_i_p, mask_ij_p + + def _decode_scatter(self, tensor, src, t): + """Decoding utility function: Scatter.""" + idx = (t * torch.ones_like(src)).long() + tensor.scatter_(1, idx, src) + + def _decode_pre_func(self, t, tensors_t): + """Decoding pre-step function adds features based on current S and chi.""" + _scatter_t = lambda tensor, src: self._decode_scatter(tensor, src, t) + + # Gather relevant tensors at step t + edge_h_p_t = tensors_t["edge_h_cache"][0][:, t, :, :].unsqueeze(1) + edge_idx_p_t = tensors_t["edge_idx"][:, t, :].unsqueeze(1) + mask_ij_p_t = tensors_t["mask_ij"][:, t, :].unsqueeze(1) + + # Update the edge embeddings at t with the relevant context + mask_ij_p_t = mask_ij_p_t.unsqueeze(-1) + + # Add sequence context + h_S_p_ij_t = graph.collect_neighbors(tensors_t["h_S_p"], edge_idx_p_t) + edge_h_p_t = edge_h_p_t + mask_ij_p_t * h_S_p_ij_t + + # Add chi context + if self.predict_chi: + if self.sidechain_embedding in ["chi_rbf", "mixed_chi_X"]: + h_chi_p_ij_t = graph.collect_neighbors( + tensors_t["h_chi_p"], edge_idx_p_t + ) + edge_h_p_t = edge_h_p_t + mask_ij_p_t * h_chi_p_ij_t + if self.sidechain_embedding == "mixed_chi_X": + h_chi_p_ij_t = self.embed_X.step( + t, + tensors_t["X_p"], + tensors_t["C_p"], + tensors_t["S_p"], + edge_idx_p_t, + ) + edge_h_p_t = edge_h_p_t + mask_ij_p_t * h_chi_p_ij_t + + _scatter_t(tensors_t["edge_h_cache"][0], edge_h_p_t) + return tensors_t + + def _decode_post_func( + self, + t, + tensors_t, + S_p_input, + chi_p_input, + temperature_S, + temperature_chi, + sample, + resample_chi, + mask_sample, + mask_sample_p=None, + top_p_S=None, + ban_S=None, + bias_S_func=None, + ): + """Decoding post-step function updates S and chi.""" + _scatter_t = lambda tensor, src: self._decode_scatter(tensor, src, t) + + # Gather relevant tensors at step t + C_p_t = tensors_t["C_p"][:, t].unsqueeze(1) + edge_h_p_t = tensors_t["edge_h_cache"][0][:, t, :, :].unsqueeze(1) + edge_idx_p_t = tensors_t["edge_idx"][:, t, :].unsqueeze(1) + mask_i_p_t = tensors_t["mask_i"][:, t].unsqueeze(1) + mask_ij_p_t = tensors_t["mask_ij"][:, t, :].unsqueeze(1) + node_h_p_t = tensors_t["node_h_cache"][-1][:, t, :].unsqueeze(1) + idx_p_t = tensors_t["idx_p"][:, t].unsqueeze(1) + + # Sample updated sequence + S_p_t = S_p_input[:, t].unsqueeze(1).clone() + if self.predict_S and sample: + bias_S = None + if bias_S_func is not None: + bias_S = bias_S_func( + t, + tensors_t["S_p"], + tensors_t["C_p"], + tensors_t["idx_p"], + edge_idx_p_t, + mask_ij_p_t, + ) + mask_S_t = None + if mask_sample_p is not None: + mask_S_t = mask_sample_p[:, t] + S_p_t = self.decoder_S.sample( + node_h_p_t, + mask_i_p_t, + temperature=temperature_S, + top_p=top_p_S, + bias=bias_S, + mask_S=mask_S_t, + ) + + _scatter_t(tensors_t["S_p"], S_p_t) + + # Sample updated side chain conformations + mask_chi_p_t = sidechain.chi_mask(C_p_t, S_p_t) + chi_p_t = chi_p_input[:, t].unsqueeze(1).clone() + if self.predict_chi and sample: + # Sample chi angles + chi_p_t_sample = self.decoder_chi.sample( + S_p_t, mask_chi_p_t, node_h_p_t, mask_i_p_t, temperature=temperature_chi + ) + + if mask_sample_p is not None and not resample_chi: + m = mask_sample_p[:, t].unsqueeze(-1).expand([-1, 4]) + chi_p_t = torch.where(m > 0, chi_p_t_sample, chi_p_t) + else: + chi_p_t = chi_p_t_sample + + # Rebuild side chain + X_p_t_bb = tensors_t["X_p"][:, t, :4, :].unsqueeze(1) + X_p_t, _ = self.chi_to_X(X_p_t_bb, C_p_t, S_p_t, chi_p_t) + _scatter_t(tensors_t["X_p"], X_p_t) + _scatter_t(tensors_t["chi_p"], chi_p_t) + + # Score the updated sequence and chi angles + if self.predict_S: + logp_S_p_t, _ = self.decoder_S(S_p_t, node_h_p_t, mask_i_p_t) + _scatter_t(tensors_t["logp_S_p"], logp_S_p_t) + if self.predict_chi: + logp_chi_p_t, _ = self.decoder_chi( + S_p_t, chi_p_t, mask_chi_p_t, node_h_p_t, mask_i_p_t + ) + _scatter_t(tensors_t["logp_chi_p"], logp_chi_p_t) + + # Update sequence and chi features (permuted) + h_S_p_t = self.W_S(S_p_t) + _scatter_t(tensors_t["h_S_p"], h_S_p_t) + + # Cache chi embeddings + if self.predict_chi and self.sidechain_embedding in ["chi_rbf", "mixed_chi_X"]: + h_chi_p_t = self.embed_chi(chi_p_t) + _scatter_t(tensors_t["h_chi_p"], h_chi_p_t) + return tensors_t + + @validate_XC() + def decode( + self, + X: torch.Tensor, + C: torch.LongTensor, + S: torch.LongTensor, + node_h: torch.Tensor, + edge_h: torch.Tensor, + edge_idx: torch.LongTensor, + mask_i: torch.Tensor, + mask_ij: torch.Tensor, + permute_idx: torch.LongTensor, + temperature_S: float = 0.1, + temperature_chi: float = 1e-3, + sample: bool = True, + mask_sample: Optional[torch.Tensor] = None, + resample_chi: bool = True, + top_p_S: Optional[float] = None, + ban_S: Optional[tuple] = None, + bias_S_func: Optional[Callable] = None, + ) -> Tuple[torch.LongTensor, torch.Tensor, torch.Tensor, torch.Tensor, dict]: + """Autoregressively decode sequence and chi angles from graph features. + + Args: + X (torch.Tensor): Backbone coordinates with shape + `(num_batch, num_residues, num_atoms, 3)`. + C (torch.LongTensor): Chain map with shape + `(num_batch, num_residues)`. + S (torch.LongTensor): Sequence tensor with shape + `(num_batch, num_residues)`. + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + edge_h (torch.Tensor): Edge features with shape + `(num_batch, num_residues, num_neighbors, dim_edges)`. + edge_idx (torch.LongTensor): Edge indices for neighbors with shape + `(num_batch, num_residues, num_neighbors)`. + mask_i (torch.Tensor): Node mask with shape + `(num_batch, num_residues)`. + mask_ij (torch.Tensor): Edge mask with shape + `(num_batch, num_nodes, num_neighbors)`. + temperature_chi (float): Temperature parameter for sampling chi + angles. Even if a high temperature sequence is sampled, this is + recommended to always be low. Default is `1E-3`. + sample (bool): Whether to sample sequence and chi angles. + mask_sample (torch.Tensor, optional): Binary tensor mask indicating + positions to be sampled with shape `(num_batch, num_residues)`. + If `None` (default), all positions will be sampled. + resample_chi (bool): If `True`, all chi angles will be resampled, + even for sequence positions that were not sampled (i.e. global + repacking). Default is `True`. + top_p_S (float, optional): Top-p cutoff for Nucleus Sampling, see + Holtzman et al ICLR 2020. + ban_S (tuple, optional): An optional set of token indices from + `chroma.constants.AA20` to ban during sampling. + + Returns: + S (torch.LongTensor): Sequence tensor with shape + `(num_batch, num_residues)`. + chi (torch.Tensor): Chi angles with shape + `(num_batch, num_residues, 4)`. + logp_S (torch.Tensor): Sequence log likelihoods per residue with + shape `(num_batch, num_residues)`. + logp_chi (torch.Tensor): Chi angle Log likelihoods per residue with + shape `(num_batch, num_residues, 4)`. + tensors (dict): Processed tensors from GNN decoding. + """ + + # Permute graph representation + ( + node_h_p, + edge_h_p, + edge_idx_p, + mask_i_p, + mask_ij_p, + ) = graph.permute_graph_embeddings( + node_h, edge_h, edge_idx, mask_i, mask_ij, permute_idx + ) + chi, mask_chi = self.X_to_chi(X, C, S) + + # Build autoregressive mask + mask_ij_p = graph.edge_mask_causal(edge_idx_p, mask_ij_p) + + # Initialize tensors + B, N, K = list(edge_idx.shape) + device = node_h.device + idx = torch.arange(end=N, device=device)[None, :].expand(C.shape) + tensors_init = { + "X_p": graph.permute_tensor(X, 1, permute_idx), + "C_p": graph.permute_tensor(C, 1, permute_idx), + "idx_p": graph.permute_tensor(idx, 1, permute_idx), + "S_p": torch.zeros_like(S), + "chi_p": torch.zeros([B, N, 4], device=device), + "h_S_p": torch.zeros([B, N, self.dim_edges], device=device), + "h_chi_p": torch.zeros([B, N, self.dim_edges], device=device), + "node_h": node_h_p, + "edge_h": edge_h_p, + "edge_idx": edge_idx_p, + "mask_i": mask_i_p, + "mask_ij": mask_ij_p, + "logp_S_p": torch.zeros([B, N], device=device), + "logp_chi_p": torch.zeros([B, N, 4], device=device), + } + + # As a sanity check against future state leakage, + # we initialize S and chi and zero and write in the true value + # during sequential decoding + S_p_input = graph.permute_tensor(S, 1, permute_idx) + chi_p_input = graph.permute_tensor(chi, 1, permute_idx) + mask_sample_p = None + if mask_sample is not None: + mask_sample_p = graph.permute_tensor(mask_sample, 1, permute_idx) + + # Pre-step function features current sequence and chi angles + pre_step_func = self._decode_pre_func + + # Post-step function samples sequence and/or chi angles at step t + post_step_func = lambda t, tensors_t: self._decode_post_func( + t, + tensors_t, + S_p_input, + chi_p_input, + temperature_S, + temperature_chi, + sample, + resample_chi, + mask_sample, + mask_sample_p, + top_p_S=top_p_S, + ban_S=ban_S, + bias_S_func=bias_S_func, + ) + + # Sequentially step through a forwards pass of the GNN at each + # position along the node dimension (1), running _pre_func + # and each iteration and _post_func after each iteration + tensors = self.gnn.sequential( + tensors_init, + pre_step_function=pre_step_func, + post_step_function=post_step_func, + ) + + # Unpermute sampled sequence and chi angles + permute_idx_inverse = torch.argsort(permute_idx, dim=-1) + S = graph.permute_tensor(tensors["S_p"], 1, permute_idx_inverse) + chi = graph.permute_tensor(tensors["chi_p"], 1, permute_idx_inverse) + logp_S = graph.permute_tensor(tensors["logp_S_p"], 1, permute_idx_inverse) + logp_chi = graph.permute_tensor(tensors["logp_chi_p"], 1, permute_idx_inverse) + + return S, chi, logp_S, logp_chi, tensors + + +def _filter_logits_top_p(logits, p=0.9): + """Filter logits by top-p (Nucleus sampling). + + See Holtzman et al, ICLR 2020. + + Args: + logits (Tensor): Logits with shape `(..., num_classes)`. + p (float): Cutoff probability. + + Returns: + logits_filters (Tensor): Filtered logits + with shape `(..., num_classes)`. + """ + logits_sort, indices_sort = torch.sort(logits, dim=-1, descending=True) + probs_sort = F.softmax(logits_sort, dim=-1) + probs_cumulative = torch.cumsum(probs_sort, dim=-1) + + # Remove tokens outside nucleus (aside from top token) + logits_sort_filtered = logits_sort.clone() + logits_sort_filtered[probs_cumulative > p] = -float("Inf") + logits_sort_filtered[..., 0] = logits_sort[..., 0] + + # Unsort + logits_filtered = logits_sort_filtered.gather(-1, indices_sort.argsort(-1)) + return logits_filtered + + +class NodePredictorS(nn.Module): + """Predict sequence tokens at each node given embeddings `P(S_i | h_i)`. + + Args: + num_alphabet (int): Number of amino acids. + dim_nodes (int): Node dimension of graph input. + dim_hidden (int): Hidden layer dimension. + loss_eps (float): Small number to avoid division by zero errors when + taking averages. + label_smoothing (float): Level of smoothing to apply. + + Inputs: + S (torch.LongTensor): Sequence tensor with shape + `(num_batch, num_residues)`. + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. + + Outputs: + logp_S (torch.Tensor): Log likelihoods per residue with shape + `(num_batch, num_residues)`. During training, this applies label + smoothing. + log_probs_S (torch.Tensor): Log probabilities for each token for + at each residue with shape + `(num_batch, num_residues, num_alphabet)`. + """ + + def __init__( + self, + num_alphabet: int, + dim_nodes: int, + dim_hidden: int, + loss_eps: float = 1e-5, + label_smoothing: float = 0.1, + ) -> None: + super(NodePredictorS, self).__init__() + self.num_alphabet = num_alphabet + self.dim_nodes = dim_nodes + self.dim_hidden = dim_hidden + self.loss_eps = loss_eps + + self.label_smoothing = label_smoothing + self.training_loss = torch.nn.CrossEntropyLoss( + reduction="none", label_smoothing=self.label_smoothing + ) + + # Layers for predicting sequence and chi angles + self.S_mlp = graph.MLP( + dim_in=dim_nodes, + dim_hidden=dim_hidden, + dim_out=self.num_alphabet, + num_layers_hidden=2, + ) + + def log_probs_S(self, node_h: torch.Tensor, mask_i: torch.Tensor) -> torch.Tensor: + """Compute `log P(S | X, C)`.""" + mask_i_expand = mask_i.unsqueeze(-1) + S_logits = self.S_mlp(node_h) + log_probs_S = mask_i_expand * F.log_softmax(S_logits, -1) + return log_probs_S + + def forward( + self, S: torch.LongTensor, node_h: torch.Tensor, mask_i: torch.Tensor + ) -> Tuple[torch.Tensor, torch.Tensor]: + """Evaluate chi angle joint likelihood given graph embeddings.""" + log_probs_S = self.log_probs_S(node_h, mask_i) + + if self.training: + logp_S = -self.training_loss(log_probs_S.permute([0, 2, 1]), S) + else: + logp_S = torch.gather(log_probs_S, 2, S.unsqueeze(-1)).squeeze(-1) + + return logp_S, log_probs_S + + def sample( + self, + node_h: torch.Tensor, + mask_i: torch.Tensor, + temperature: float = 1.0, + top_p: Optional[float] = None, + mask_S: Optional[torch.Tensor] = None, + bias: Optional[torch.Tensor] = None, + ) -> torch.LongTensor: + """Sample sequence and graph embeddings. + + Args: + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + mask_i (torch.Tensor): Node mask with shape + `(num_batch, num_residues)`. + temperature (float): Temperature parameter for sampling sequence + tokens. The default value of 1.0 corresponds to the model's + unadjusted positions, though because of training such as label + smoothing values less than 1.0 are recommended. + top_p (float, optional): Top-p cutoff for Nucleus Sampling, see + Holtzman et al ICLR 2020. + ban_S (tuple, optional): An optional set of token indices from + `chroma.constants.AA20` to ban during sampling. + + Returns: + S_sample (torch.LongTensor): Sampled sequence of shape `(num_batch, + num_residues)`. + + """ + num_batch, num_residues, _ = node_h.shape + log_probs_S = self.log_probs_S(node_h, mask_i) + if bias is not None: + log_probs_S = log_probs_S + bias + if mask_S is not None: + log_probs_S = torch.where( + mask_S > 0, log_probs_S, -float("Inf") * torch.ones_like(log_probs_S) + ) + if top_p is not None: + log_probs_S = _filter_logits_top_p(log_probs_S, p=top_p) + p = torch.distributions.categorical.Categorical( + logits=log_probs_S / temperature + ) + S_sample = p.sample() + return S_sample + + +class NodePredictorChi(nn.Module): + """Predict chi angles autoregressively at each node given embeddings. + + Decomposes as `P(chi_i_{1-4} | h_i) = P(chi_i_4 | chi_i_<4 h_i) ... P(chi_i_1 | h_i)`. + + Args: + num_alphabet (int): Number of amino acids. + num_chi_bins (int): Number of discretization bins per chi angle. + dim_nodes (int): Node dimension of graph input. + dim_hidden (int): Hidden layer dimension. + loss_eps (float): Small number to avoid division by zero errors when + taking averages. + label_smoothing (float): Level of smoothing to apply. + + Inputs: + S (torch.LongTensor): Sequence tensor with shape + `(num_batch, num_residues)`. + chi (torch.Tensor): Chi angles with shape + `(num_batch, num_residues, 4)`. + mask_chi (torch.Tensor): Chi angle mask with shape + `(num_batch, num_residues, 4)`. + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + mask_i (torch.Tensor): Node mask with shape `(num_batch, num_residues)`. + + Outputs: + logp_chi (torch.Tensor): Log likelihoods per residue with shape + `(num_batch, num_residues, 4)`. During training, this applies label + smoothing. + log_probs_chi (torch.Tensor): Log probabilities for each chi angle + token at each residue with shape + `(num_batch, num_residues, 4, num_chi_bins)`. + """ + + def __init__( + self, + num_alphabet: int, + num_chi_bins: int, + dim_nodes: int, + dim_hidden: int, + loss_eps: float = 1e-5, + label_smoothing: float = 0.1, + ) -> None: + super(NodePredictorChi, self).__init__() + self.num_alphabet = num_alphabet + self.num_chi_bins = num_chi_bins + self.dim_nodes = dim_nodes + self.dim_hidden = dim_hidden + self.loss_eps = loss_eps + self.label_smoothing = label_smoothing + self.training_loss = torch.nn.CrossEntropyLoss( + reduction="none", label_smoothing=self.label_smoothing + ) + self._init_chi_bins(num_chi_bins) + + # Layers for embedding sequence and chi angles + self.W_S = nn.Embedding(num_alphabet, dim_nodes) + self.chi_embedding = nn.ModuleList( + [ + NodeChiRBF(dim_out=dim_nodes, num_chi=i, num_chi_bins=num_chi_bins) + for i in [1, 2, 3] + ] + ) + + # Layers for chi angles + self.chi_mlp = nn.ModuleList( + [ + graph.MLP( + dim_in=dim_nodes, + dim_hidden=dim_hidden, + dim_out=num_chi_bins, + num_layers_hidden=2, + ) + for t in range(4) + ] + ) + + def _init_chi_bins(self, num_chi_bins): + # Setup bins + bins = torch.tensor( + np.linspace(-np.pi, np.pi, num_chi_bins + 1), dtype=torch.float32 + ).reshape([1, 1, 1, -1]) + self.register_buffer("bins_left", bins[:, :, :, 0:-1]) + self.register_buffer("bins_right", bins[:, :, :, 1:]) + return + + def _log_probs_t(self, t, S, chi, node_h, mask_i): + """Compute `log P(chi_t | chi_ 0: + chi_t = chi[:, :, :t] + if len(chi_t.shape) == 2: + chi_t = chi_t.unsqueeze(-1) + node_h = node_h + self.chi_embedding[t - 1](chi_t) + + chi_logits = mask_i_expand * self.chi_mlp[t](node_h) + log_probs_chi_t = mask_i_expand * F.log_softmax(chi_logits, -1) + return log_probs_chi_t + + def _sample_continuous(self, logits, left, right): + """Reparamaterization gradients via CDF inversion""" + base_shape = list(logits.shape)[:-1] + CMF = torch.cumsum(F.softmax(logits, dim=-1), dim=-1) + u = torch.rand(base_shape, device=logits.device) + _, max_idx = torch.max((u.unsqueeze(-1) < CMF).float(), dim=-1) + max_idx = max_idx.unsqueeze(-1) + + left = left.expand(base_shape + [-1]) + right = right.expand(base_shape + [-1]) + + # Gather panel bounds + CMF_pad = F.pad(CMF, ((1, 0))) + Y_left = torch.gather(left, -1, max_idx) + Y_right = torch.gather(right, -1, max_idx) + CMF_left = torch.gather(CMF_pad, -1, max_idx) + CMF_right = torch.gather(CMF_pad, -1, max_idx + 1) + + # Local CDF inversion + z = Y_left + (Y_right - Y_left) * (u.unsqueeze(-1) - CMF_left) / ( + CMF_right - CMF_left + 1e-5 + ) + z = z.squeeze(-1) + return z + + def forward( + self, + S: torch.LongTensor, + chi: torch.Tensor, + mask_chi: torch.Tensor, + node_h: torch.Tensor, + mask_i: torch.Tensor, + ) -> Tuple[torch.Tensor, torch.Tensor]: + """Evaluate chi angle joint likelihood given graph embeddings.""" + # Build the likelihood sequentially + log_probs_chi_list = [] + for t in range(4): + log_probs_chi_t = self._log_probs_t(t, S, chi, node_h, mask_i) + log_probs_chi_list.append(log_probs_chi_t) + log_probs_chi = torch.stack(log_probs_chi_list, -2) + + # Loss function + chi = chi.unsqueeze(-1) + chi_onehot = ((chi >= self.bins_left) * (chi < self.bins_right)).float() + if self.training: + scale = self.label_smoothing / (self.num_chi_bins - 1) + chi_onehot = ( + chi_onehot * (1 - self.label_smoothing) + (1 - chi_onehot) * scale + ) + logp_chi = mask_chi * (chi_onehot * log_probs_chi).sum(-1) + return logp_chi, log_probs_chi + + def sample( + self, + S: torch.LongTensor, + mask_chi: torch.Tensor, + node_h: torch.Tensor, + mask_i: torch.Tensor, + temperature: float = 1.0, + ) -> torch.Tensor: + """Sample chi angles given sequence and graph embeddings. + + Args: + S (torch.LongTensor): Sequence tensor with shape + `(num_batch, num_residues)`. + mask_chi (torch.Tensor): Chi angle mask with shape + `(num_batch, num_residues, 4)`. + node_h (torch.Tensor): Node features with shape + `(num_batch, num_residues, dim_nodes)`. + mask_i (torch.Tensor): Node mask with shape + `(num_batch, num_residues)`. + temperature (float): Temperature parameter for sampling sequence + tokens. The default value of 1.0 corresponds to the model's + unadjusted positions, though because of training such as label + smoothing values less than 1.0 are recommended. + + Returns: + chi_sample (torch.Tensor): Chi angles with shape + `(num_batch, num_residues, 4)`. + + """ + + # Sample chi angles sequentially + num_batch, num_residues, _ = node_h.shape + chi = torch.zeros( + [num_batch, num_residues, 4], dtype=torch.float32, device=node_h.device + ) + left = self.bins_left.reshape([1, 1, self.num_chi_bins]) + right = self.bins_right.reshape([1, 1, self.num_chi_bins]) + for t in range(4): + log_probs_chi_t = self._log_probs_t(t, S, chi, node_h, mask_i) + chi_t = self._sample_continuous(log_probs_chi_t / temperature, left, right) + chi = chi + F.pad(chi_t.unsqueeze(-1), (t, 3 - t)) + return mask_chi * chi + + +class ProteinTraversalSpatial(nn.Module): + """Samples spatial correlated residue permutations in a protein. + + Args: + smooth_alpha (float): Smoothing parameter for graph smoothing where + 0 corresponds to no smoothing and 1 corresponds to maximal + smoothing. Default is 1. + smooth_steps (int): Number of graph smoothing steps, which must be + nonnegative. More steps will increase the amount of smoothing. + Default is 5. + smooth_randomize (bool): Enables uniform randomization of + `smooth_alpha` on the interval `(0, smooth_alpha)`. Default is + True. + graph_num_neighbors (int): Number of neighbors for graph + construction. Default is 30. + deterministic (bool): Whether to force determinism. Default is + False. + + Inputs: + X (torch.Tensor): All atom coordinates with shape + `(num_batch, num_residues, 14, 3)`. + C (torch.LongTensor): Chain map with shape + `(num_batch, num_residues)`. + priority (torch.Tensor, optional): Priority values for constraining + residue orderings with shape `(num_batch, num_residues)`. + If residues are assigned to integer-valued groups, the sampled + permutation will be ordered such that all residues within a + lower-valued priority group will occur before residues with + higher-valued priority assignments. + + Outputs: + permute_idx (LongTensor): Permutation tensor containing reordered + residue indices with shape `(num_batch, num_residues)`. + """ + + def __init__( + self, + smooth_alpha: float = 1.0, + smooth_steps: int = 5, + smooth_randomize: bool = True, + graph_num_neighbors: int = 30, + deterministic: bool = False, + ) -> None: + super(ProteinTraversalSpatial, self).__init__() + + self.smooth_alpha = smooth_alpha + self.smooth_steps = smooth_steps + self.smooth_randomize = smooth_randomize + self.deterministic = deterministic + self._determistic_seed = 10 + + self.norm_eps = 1e-5 + self.protein_graph = protein_graph.ProteinGraph( + num_neighbors=graph_num_neighbors + ) + + @validate_XC() + def forward( + self, + X: torch.Tensor, + C: torch.LongTensor, + priority: Optional[torch.Tensor] = None, + ): + # Sample random node keys + if not self.deterministic: + z = torch.rand_like(C.float()) + else: + with torch.random.fork_rng(): + torch.random.manual_seed(self._determistic_seed) + z = torch.rand((1, C.shape[1]), device=C.device).expand(C.shape) + + # Graph-based smoothing + alpha = self.smooth_alpha + if self.smooth_randomize and not self.deterministic: + alpha = torch.rand((), device=X.device) + + if alpha > 0: + edge_idx, mask_ij = self.protein_graph(X, C) + for i in range(self.smooth_steps): + z_neighbors = graph.collect_neighbors( + z.unsqueeze(-1), edge_idx + ).squeeze(-1) + z_average = (mask_ij * z_neighbors).sum(2) / ( + mask_ij.sum(2) + self.norm_eps + ) + z = alpha * z_average + (1.0 - alpha) * z + + if priority is not None: + z = z + priority + + # Create permutation + permute_idx = torch.argsort(z, dim=-1) + return permute_idx diff --git a/chroma/models/model_configs.py b/chroma/models/model_configs.py new file mode 100644 index 0000000..10c2a0b --- /dev/null +++ b/chroma/models/model_configs.py @@ -0,0 +1,225 @@ +from dataclasses import asdict, dataclass, field, fields +from typing import Any, Dict, Optional, Tuple + + +def build_model_config(config_cls, values: Dict[str, Any]): + field_names = {field.name for field in fields(config_cls)} + config_values = {key: values[key] for key in field_names if key in values} + extra_kwargs = { + key: value for key, value in values.items() if key not in field_names + } + return config_cls(**config_values), extra_kwargs + + +def config_to_kwargs(config, extra_kwargs: Optional[Dict[str, Any]] = None): + kwargs = asdict(config) + if extra_kwargs: + kwargs.update(extra_kwargs) + return kwargs + + +@dataclass +class GraphDesignConfig: + dim_nodes: int = 128 + dim_edges: int = 128 + num_neighbors: int = 30 + node_features: Tuple = ((("internal_coords", {"log_lengths": True})),) + edge_features: Tuple = ( + "distances_2mer", + "orientations_2mer", + "distances_chain", + ) + sequence_embedding: str = "linear" + sidechain_embedding: str = "chi_rbf" + sidechains: bool = True + num_layers: int = 3 + num_layers_encoder: Optional[int] = None + dropout: float = 0.1 + node_mlp_layers: int = 1 + node_mlp_dim: Optional[int] = None + edge_update: bool = True + edge_mlp_layers: int = 1 + edge_mlp_dim: Optional[int] = None + skip_connect_input: bool = False + mlp_activation: str = "softplus" + num_alphabet: int = 20 + num_chi_bins: int = 20 + decoder_num_hidden: int = 512 + label_smoothing: float = 0.1 + separate_packing: bool = True + graph_criterion: str = "knn" + graph_random_min_local: int = 20 + graph_attentional: bool = False + graph_num_attention_heads: int = 4 + predict_S_marginals: bool = False + predict_S_potts: bool = False + potts_parameterization: str = "factor" + potts_num_factors: Optional[int] = None + potts_symmetric_J: bool = True + noise_schedule: Optional[str] = None + noise_covariance_model: str = "brownian" + noise_complex_scaling: bool = False + noise_beta_range: Tuple[float, float] = (0.2, 70.0) + noise_log_snr_range: Tuple[float, float] = (-7.0, 13.5) + checkpoint_gradients: bool = False + + +@dataclass +class BackboneEncoderGNNConfig: + dim_nodes: int = 128 + dim_edges: int = 128 + num_neighbors: int = 30 + node_features: Tuple = ((("internal_coords", {"log_lengths": True})),) + edge_features: Tuple = ( + "distances_2mer", + "orientations_2mer", + "distances_chain", + ) + num_layers: int = 3 + node_mlp_layers: int = 1 + node_mlp_dim: Optional[int] = None + edge_update: bool = True + edge_mlp_layers: int = 1 + edge_mlp_dim: Optional[int] = None + skip_connect_input: bool = False + mlp_activation: str = "softplus" + dropout: float = 0.1 + graph_distance_atom_type: int = -1 + graph_cutoff: Optional[float] = None + graph_mask_interfaces: bool = False + graph_criterion: str = "knn" + graph_random_min_local: int = 20 + checkpoint_gradients: bool = False + + +@dataclass +class SidechainDecoderGNNConfig: + dim_nodes: int = 128 + dim_edges: int = 128 + num_neighbors: int = 30 + predict_S: bool = True + predict_chi: bool = True + sequence_embedding: str = "linear" + sidechain_embedding: str = "mixed_chi_X" + num_layers: int = 3 + node_mlp_layers: int = 1 + node_mlp_dim: Optional[int] = None + edge_update: bool = True + edge_mlp_layers: int = 1 + edge_mlp_dim: Optional[int] = None + skip_connect_input: bool = False + mlp_activation: str = "softplus" + dropout: float = 0.1 + num_alphabet: int = 20 + num_chi_bins: int = 20 + decoder_num_hidden: int = 512 + label_smoothing: float = 0.1 + checkpoint_gradients: bool = False + + +@dataclass +class GraphBackboneConfig: + dim_nodes: int = 128 + dim_edges: int = 128 + num_neighbors: int = 30 + node_features: Tuple = ((("internal_coords", {"log_lengths": True})),) + edge_features: Tuple = ( + "distances_2mer", + "orientations_2mer", + "distances_chain", + ) + num_layers: int = 3 + dropout: float = 0.1 + node_mlp_layers: int = 1 + node_mlp_dim: Optional[int] = None + edge_update: bool = True + edge_mlp_layers: int = 1 + edge_mlp_dim: Optional[int] = None + skip_connect_input: bool = False + mlp_activation: str = "softplus" + decoder_num_hidden: int = 512 + graph_criterion: str = "knn" + graph_random_min_local: int = 20 + backbone_update_method: str = "neighbor" + backbone_update_iterations: int = 1 + backbone_update_num_weights: int = 1 + backbone_update_unconstrained: bool = True + use_time_features: bool = True + time_feature_type: str = "t" + time_log_feature_scaling: float = 0.05 + noise_schedule: str = "log_snr" + noise_covariance_model: str = "brownian" + noise_beta_min: float = 0.2 + noise_beta_max: float = 70.0 + noise_log_snr_range: Tuple[float, float] = (-7.0, 13.5) + noise_complex_scaling: bool = False + loss_scale: float = 10.0 + loss_scale_ssnr_cutoff: float = 0.99 + loss_function: str = "squared_fape" + checkpoint_gradients: bool = False + prediction_type: str = "X0" + num_graph_cycles: int = 1 + + +@dataclass +class GraphClassifierConfig: + dim_nodes: int = 128 + dim_edges: int = 128 + num_neighbors: int = 30 + node_features: Tuple = ((("internal_coords", {"log_lengths": True})),) + edge_features: Tuple = ( + "random_fourier_2mer", + "orientations_2mer", + "distances_chain", + ) + num_layers: int = 3 + dropout: float = 0.1 + node_mlp_layers: int = 1 + node_mlp_dim: Optional[int] = None + edge_update: bool = True + edge_mlp_layers: int = 1 + edge_mlp_dim: Optional[int] = None + skip_connect_input: bool = False + mlp_activation: str = "softplus" + graph_criterion: str = "knn" + graph_random_min_local: int = 20 + use_time_features: bool = True + noise_schedule: str = "log_snr" + noise_beta_min: float = 0.2 + noise_beta_max: float = 70.0 + checkpoint_gradients: bool = False + class_config: Dict[str, Dict[str, Any]] = field(default_factory=dict) + out_mlp_layers: int = 2 + noise_covariance_model: str = "globular" + noise_log_snr_range: Tuple[float, float] = (-7.0, 13.5) + time_feature_type: str = "t" + time_log_feature_scaling: float = 0.05 + fourier_scale: float = 16.0 + zero_grad_fix: bool = False + + +@dataclass +class ProteinCaptionConfig: + lm_id: str = "EleutherAI/gpt-neo-125m" + gnn_dim_edges: int = 128 + context_size: int = 16 + context_per_chain: int = 1 + gnn_num_neighbors: int = 30 + gnn_num_layers: int = 3 + only_encode_caption_chain: bool = False + gnn_embed_ratio: int = 1 + graph_criterion: str = "knn" + node_mlp_layers: int = 1 + node_mlp_dim: Optional[int] = None + noise_schedule: str = "log_snr" + covariance_model: str = "globular" + noise_complex_scaling: bool = False + noiseless: bool = False + normalize_context_embeddings: bool = False + standardize_context_embeddings: bool = False + time_feature_type: str = "t" + time_log_feature_scaling: float = 0.05 + use_transformer: bool = False + classifier_checkpoint: Optional[str] = None + direct_gnn: bool = False + classifier_kwargs: Optional[dict] = None diff --git a/chroma/models/procap.py b/chroma/models/procap.py index fca7331..f4009ca 100644 --- a/chroma/models/procap.py +++ b/chroma/models/procap.py @@ -12,7 +12,6 @@ # See the License for the specific language governing permissions and # limitations under the License. -from types import SimpleNamespace from typing import List, Optional, Tuple, Union import torch @@ -24,7 +23,12 @@ from chroma.layers.structure import diffusion from chroma.models import graph_classifier from chroma.models.graph_classifier import GraphClassifier -from chroma.models.graph_design import BackboneEncoderGNN +from chroma.models.graph_design_components import BackboneEncoderGNN +from chroma.models.model_configs import ( + ProteinCaptionConfig, + build_model_config, + config_to_kwargs, +) from chroma.utility.model import load_model as utility_load_model from chroma.utility.model import save_model as utility_save_model @@ -161,13 +165,36 @@ def __init__( ) -> None: super().__init__() - # Save configuration in kwargs - self.kwargs = locals() - self.kwargs.pop("self") - for key in list(self.kwargs.keys()): - if key.startswith("__") and key.endswith("__"): - self.kwargs.pop(key) - args = SimpleNamespace(**self.kwargs) + self.config, self.extra_kwargs = build_model_config( + ProteinCaptionConfig, + { + "lm_id": lm_id, + "gnn_dim_edges": gnn_dim_edges, + "context_size": context_size, + "context_per_chain": context_per_chain, + "gnn_num_neighbors": gnn_num_neighbors, + "gnn_num_layers": gnn_num_layers, + "only_encode_caption_chain": only_encode_caption_chain, + "gnn_embed_ratio": gnn_embed_ratio, + "graph_criterion": graph_criterion, + "node_mlp_layers": node_mlp_layers, + "node_mlp_dim": node_mlp_dim, + "noise_schedule": noise_schedule, + "covariance_model": covariance_model, + "noise_complex_scaling": noise_complex_scaling, + "noiseless": noiseless, + "normalize_context_embeddings": normalize_context_embeddings, + "standardize_context_embeddings": standardize_context_embeddings, + "time_feature_type": time_feature_type, + "time_log_feature_scaling": time_log_feature_scaling, + "use_transformer": use_transformer, + "classifier_checkpoint": classifier_checkpoint, + "direct_gnn": direct_gnn, + "classifier_kwargs": classifier_kwargs, + }, + ) + self.kwargs = config_to_kwargs(self.config, self.extra_kwargs) + args = self.config try: import transformers @@ -372,8 +399,11 @@ def forward( Xe, _, _, Me, _ = self.protein_encoder.to(X.device)(X, C, node_h_aux=node_h) else: # TODO: is there a better way to deal with sequence padding tokens when batch size > 1? - if O is not None and O[:, :, -1].any(): - O = None + if O is not None: + pad_token_present = O[:, :, -1].any(dim=1) + if pad_token_present.any(): + O = O.clone() + O[pad_token_present] = 0 Xe0, _, _, Me, _ = self.protein_encoder.to(X.device).encode(X, C, O, t) Xe = self.protein_encoder_linear.to(X.device)(Xe0) @@ -617,7 +647,7 @@ def _encode_context( "Problem: tried to switch encodings at positions 0 and" f" {first_cid}, but failed!" ) - # raise + raise pooled_encoding.append(torch.cat(batch_encoding)) diff --git a/chroma/utility/api.py b/chroma/utility/api.py index 902b776..c58d09b 100644 --- a/chroma/utility/api.py +++ b/chroma/utility/api.py @@ -16,6 +16,7 @@ import json import os import tempfile +from urllib.parse import urlparse import requests @@ -23,6 +24,18 @@ ROOT_DIR = os.path.dirname(os.path.dirname(chroma.__file__)) +# Hosts the registered access token is allowed to be sent to. Weight paths are +# often passed as free-form strings (e.g. via model constructor arguments), so +# this prevents the token from being exfiltrated to an arbitrary URL. +ALLOWED_TOKEN_HOSTS = {"chroma-weights.generatebiomedicines.com"} + + +def download_cache_path(base_url: str, weights_name: str) -> str: + """Return the local cache path for a named weight download.""" + url_hash = hashlib.md5((base_url + weights_name).encode()).hexdigest() + temp_dir = os.path.join(tempfile.gettempdir(), "chroma_weights", url_hash) + return os.path.join(temp_dir, "weights.pt") + def register_key(key: str, key_directory=ROOT_DIR) -> None: """ @@ -36,7 +49,8 @@ def register_key(key: str, key_directory=ROOT_DIR) -> None: None """ config_path = os.path.join(key_directory, "config.json") - with open(config_path, "w") as f: + fd = os.open(config_path, os.O_WRONLY | os.O_CREAT | os.O_TRUNC, 0o600) + with os.fdopen(fd, "w") as f: json.dump({"access_token": key}, f) @@ -90,10 +104,16 @@ def download_from_generate( str: Path to the downloaded (or cached) file. """ - # Create a hash of the URL + weight name to determine the path for the cached/temporary file - url_hash = hashlib.md5((base_url + weights_name).encode()).hexdigest() - temp_dir = os.path.join(tempfile.gettempdir(), "chroma_weights", url_hash) - destination = os.path.join(temp_dir, "weights.pt") + host = urlparse(base_url).netloc + if host not in ALLOWED_TOKEN_HOSTS: + raise ValueError( + f"Refusing to send the registered access token to '{host}': only" + f" {sorted(ALLOWED_TOKEN_HOSTS)} are allowed. Check that the weights" + " path/URL is correct." + ) + + destination = download_cache_path(base_url, weights_name) + temp_dir = os.path.dirname(destination) # Ensure the directory exists os.makedirs(temp_dir, exist_ok=True) @@ -114,11 +134,21 @@ def download_from_generate( params = {"token": read_key(key_directory), "weights": weights_name} # Perform the GET request with the token as a query parameter - response = requests.get(base_url, params=params) + response = requests.get(base_url, params=params, stream=True, timeout=60) response.raise_for_status() # Raise an error for HTTP errors - with open(destination, "wb") as file: - file.write(response.content) + # Stream to a per-process temp file and atomically rename it into place so + # a killed/interrupted download never leaves a truncated file at the + # canonical cache path for a future call to trust. + fd, tmp_destination = tempfile.mkstemp(dir=temp_dir) + try: + with os.fdopen(fd, "wb") as file: + for chunk in response.iter_content(chunk_size=1024 * 1024): + file.write(chunk) + os.replace(tmp_destination, destination) + except BaseException: + os.remove(tmp_destination) + raise print(f"Data saved to {destination}") return destination diff --git a/chroma/utility/chroma.py b/chroma/utility/chroma.py index e8173a8..e742ead 100644 --- a/chroma/utility/chroma.py +++ b/chroma/utility/chroma.py @@ -26,13 +26,21 @@ from chroma.data import Protein from chroma.layers.structure import backbone +DEFAULT_FONT = os.path.join( + os.path.dirname(chroma.__path__[0]), "assets/LiberationSans-Regular.ttf" +) + + +def _load_font(font, fontsize): + if font and os.path.exists(font): + return ImageFont.truetype(font, fontsize) + return ImageFont.load_default() + def letter_to_point_cloud( letter="G", width_pixels=35, - font=os.path.join( - os.path.dirname(chroma.__path__[0]), "assets/LiberationSans-Regular.ttf" - ), + font=DEFAULT_FONT, depth_ratio=0.15, fontsize_ratio=1.2, stroke_width=1, @@ -43,7 +51,7 @@ def letter_to_point_cloud( depth = int(depth_ratio * width_pixels) fontsize = int(fontsize_ratio * width_pixels) - font = ImageFont.truetype(font, fontsize) + font = _load_font(font, fontsize) ascent, descent = font.getmetrics() text_width = font.getmask(letter).getbbox()[2] text_height = font.getmask(letter).getbbox()[3] + descent diff --git a/chroma/utility/model.py b/chroma/utility/model.py index 7f57557..f40e00d 100644 --- a/chroma/utility/model.py +++ b/chroma/utility/model.py @@ -18,10 +18,7 @@ import os import os.path as osp -import tempfile -from pathlib import Path from urllib.parse import parse_qs, urlparse -from uuid import uuid4 import torch @@ -41,17 +38,12 @@ def save_model(model, weight_file, metadata=None): useful to store `args` representing the CLI args, the date and time of training, etc. """ + if weight_file.startswith("s3:"): + raise NotImplementedError("Uploading to an s3 link not supported.") save_dict = {"init_kwargs": model.kwargs, "model_state_dict": model.state_dict()} if metadata is not None: save_dict.update(metadata) - local_path = str( - Path(tempfile.gettempdir(), str(uuid4())[:8]) - if weight_file.startswith("s3:") - else weight_file - ) - torch.save(save_dict, local_path) - if weight_file.startswith("s3:"): - raise NotImplementedError("Uploading to an s3 link not supported.") + torch.save(save_dict, weight_file) def load_model( @@ -68,8 +60,8 @@ def load_model( weights (str): The destination path of the model weights to load. Compatible with files saved by `save_model`. model_class: Name of model class. - device (str, optional): Pytorch device specification, e.g. `'cuda'` for - GPU. Default is `'cpu'`. + device (str, optional): Pytorch device specification, e.g. `'cuda'` or `'mps'` for + GPU or `'cpu'` in the absence of GPU. Default is `'cpu'`. strict (bool): Whether to require that the keys match between the input file weights and the model created from the parameters stored in the model kwargs. @@ -106,7 +98,9 @@ def load_model( ) # load model weights - params = torch.load(weights, map_location="cpu") + # Chroma checkpoints store structured metadata alongside the state dict, so + # they require the legacy non-weights-only load path on newer PyTorch. + params = torch.load(weights, map_location="cpu", weights_only=False) model = model_class(**params["init_kwargs"]).to(device) missing_keys, unexpected_keys = model.load_state_dict( params["model_state_dict"], strict=strict diff --git a/chroma/utility/ngl.py b/chroma/utility/ngl.py index 91af646..7286ae0 100644 --- a/chroma/utility/ngl.py +++ b/chroma/utility/ngl.py @@ -21,41 +21,58 @@ import tempfile import uuid +from functools import lru_cache -import nglview as nv +def _load_nglview(): + try: + import nglview as nv + except Exception as exc: + raise ImportError( + "Protein display requires a working `nglview` installation." + ) from exc + return nv -class SystemTrajectory(nv.base_adaptor.Trajectory, nv.base_adaptor.Structure): - """MST multi-state System object adaptor, by analogy to other NGLView adaptor - classes (e.g., MDTrajTrajectory or PyTrajTrajectory in nglview.adaptor). - Example - ------- - >>> import nglview as nv - >>> import chroma.data.protein import Protein - >>> protein_trajectory = Protein("multi-state.cif") - >>> t = SystemTrajectory(protein_trajectory.sys) - >>> w = nv.NGLWidget(t) - >>> w - """ - def __init__(self, protein): - self.protein = protein - self.ext = "pdb" - self.params = {} - self.id = str(uuid.uuid4()) +def has_nglview() -> bool: + try: + _load_nglview() + except ImportError: + return False + return True + + +@lru_cache(maxsize=1) +def _system_trajectory_type(): + nv = _load_nglview() + + class _SystemTrajectory(nv.base_adaptor.Trajectory, nv.base_adaptor.Structure): + """NGLView adaptor for multi-model `Protein` objects.""" + + def __init__(self, protein): + self.protein = protein + self.ext = "pdb" + self.params = {} + self.id = str(uuid.uuid4()) + + def get_coordinates(self, index): + self.protein.sys.swap_model(index) + X, _, _ = self.protein.sys.to_XCS() + self.protein.sys.swap_model(index) + return X.view(-1, 3).numpy() - def get_coordinates(self, index): - self.protein.sys.swap_model(index) - X, _, _ = self.protein.sys.to_XCS() - self.protein.sys.swap_model(index) - return X.view(-1, 3).numpy() + @property + def n_frames(self): + return self.protein.sys.num_models() - @property - def n_frames(self): - return self.protein.sys.num_models() + def get_structure_string(self): + return self.protein.sys.to_PDB_string() - def get_structure_string(self): - return self.protein.sys.to_PDB_string() + return _SystemTrajectory + + +def SystemTrajectory(protein): + return _system_trajectory_type()(protein) def view_gsystem(system, **kwargs): @@ -69,6 +86,7 @@ def view_gsystem(system, **kwargs): returning this to the notebook will trigger display of a widget. """ + nv = _load_nglview() temp = tempfile.NamedTemporaryFile(suffix=".pdb") filename = temp.name system.to_PDB(filename) @@ -79,3 +97,17 @@ def view_gsystem(system, **kwargs): view.add_representation("contact") view.center() return view + + +def view_protein(protein, representations=None): + nv = _load_nglview() + representations = representations or [] + + if protein.sys.num_models() == 1: + viewer = view_gsystem(protein.sys) + else: + viewer = nv.NGLWidget(SystemTrajectory(protein)) + + for representation in representations: + viewer.add_representation(representation) + return viewer diff --git a/chroma/utility/torch.py b/chroma/utility/torch.py new file mode 100644 index 0000000..e0c1a79 --- /dev/null +++ b/chroma/utility/torch.py @@ -0,0 +1,178 @@ +# Copyright Generate Biomedicines, Inc. +# +# Licensed under the Apache License, Version 2.0 (the "License"); +# you may not use this file except in compliance with the License. +# You may obtain a copy of the License at +# +# http://www.apache.org/licenses/LICENSE-2.0 +# +# Unless required by applicable law or agreed to in writing, software +# distributed under the License is distributed on an "AS IS" BASIS, +# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. +# See the License for the specific language governing permissions and +# limitations under the License. + +"""Utilities for device-aware torch execution.""" + +from __future__ import annotations + +import warnings +from typing import Any, Callable + +import torch + +_MPS_OP_SUPPORT_CACHE = {} + + +# Fix #4: single recursive traversal used by all helpers below. +def _iter_tensors(obj: Any): + if torch.is_tensor(obj): + yield obj + elif isinstance(obj, (tuple, list)): + for item in obj: + yield from _iter_tensors(item) + elif isinstance(obj, dict): + for item in obj.values(): + yield from _iter_tensors(item) + + +def _op_cache_key(op: Callable[..., Any], args: Any, kwargs: Any): + # Fix #5: include shape so different-sized tensors don't share a cache entry. + tensor_signature = tuple( + (str(tensor.dtype), tensor.ndim, tuple(tensor.shape)) + for tensor in _iter_tensors((args, kwargs)) + if tensor.device.type == "mps" + ) + return (getattr(op, "__module__", ""), getattr(op, "__qualname__", repr(op)), tensor_signature) + + +# Fix #4: implemented via _iter_tensors instead of a separate recursive walk. +def _find_mps_device(obj: Any) -> torch.device | None: + return next((t.device for t in _iter_tensors(obj) if t.device.type == "mps"), None) + + +# Fix #4: unified mover; pass pred=lambda t: t.device.type == "mps" to get the +# old _move_mps_tensors behaviour. +def _move_tensors(obj: Any, device: torch.device, pred=None) -> Any: + if torch.is_tensor(obj): + if pred is None or pred(obj): + return obj.to(device) + return obj + if isinstance(obj, tuple): + return tuple(_move_tensors(item, device, pred) for item in obj) + if isinstance(obj, list): + return [_move_tensors(item, device, pred) for item in obj] + if isinstance(obj, dict): + return {key: _move_tensors(value, device, pred) for key, value in obj.items()} + return obj + + +def _move_mps_tensors(obj: Any, device: torch.device) -> Any: + return _move_tensors(obj, device, pred=lambda t: t.device.type == "mps") + + +def _is_mps_not_implemented_error(exc: Exception) -> bool: + message = str(exc).lower() + return "mps" in message and ( + "not implemented" in message + or "not currently implemented" in message + or "not supported" in message + or "unsupported" in message + ) + + +def _is_mps_cpu_fallback_warning(warning: Warning) -> bool: + message = str(warning).lower() + return "mps backend" in message and "fall back to run on the cpu" in message + + +def _call_on_cpu( + op: Callable[..., Any], + args: Any, + kwargs: Any, + mps_device: torch.device, +) -> Any: + cpu_args = _move_mps_tensors(args, torch.device("cpu")) + cpu_kwargs = _move_mps_tensors(kwargs, torch.device("cpu")) + result = op(*cpu_args, **cpu_kwargs) + return _move_tensors(result, mps_device) + + +# Fix #7: shared cache-check and CPU-dispatch used by both public helpers. +def _with_mps_fallback_cache( + op: Callable[..., Any], + args: Any, + kwargs: Any, + mps_device: torch.device, + try_fn: Callable[[], tuple[bool, Any]], +) -> Any: + key = _op_cache_key(op, args, kwargs) + if _MPS_OP_SUPPORT_CACHE.get(key) is False: + return _call_on_cpu(op, args, kwargs, mps_device) + if _MPS_OP_SUPPORT_CACHE.get(key) is True: + return op(*args, **kwargs) + supported, result = try_fn() + if not supported: + _MPS_OP_SUPPORT_CACHE[key] = False + return _call_on_cpu(op, args, kwargs, mps_device) + _MPS_OP_SUPPORT_CACHE[key] = True + return result + + +def get_default_device() -> torch.device: + """Return the best available device: MPS > CUDA > CPU.""" + if torch.backends.mps.is_available(): + return torch.device("mps") + if torch.cuda.is_available(): + return torch.device("cuda") + return torch.device("cpu") + + +def call_with_explicit_mps_cpu_fallback( + op: Callable[..., Any], *args: Any, **kwargs: Any +) -> Any: + """Run an op on CPU when given MPS tensors, then move the result back. + + Detects both PyTorch's silent CPU-fallback UserWarning and explicit + RuntimeError for unsupported MPS ops (fix #3). + """ + mps_device = _find_mps_device((args, kwargs)) + if mps_device is None: + return op(*args, **kwargs) + + def _try(): + with warnings.catch_warnings(): + warnings.filterwarnings( + "error", + message=".*MPS backend.*fall back to run on the CPU.*", + category=UserWarning, + ) + try: + return True, op(*args, **kwargs) + except UserWarning as exc: + if not _is_mps_cpu_fallback_warning(exc): + raise + return False, None + except RuntimeError as exc: + if not _is_mps_not_implemented_error(exc): + raise + return False, None + + return _with_mps_fallback_cache(op, args, kwargs, mps_device, _try) + + +def call_with_mps_cpu_fallback(op: Callable[..., Any], *args: Any, **kwargs: Any) -> Any: + """Run an op on the current device and retry on CPU if MPS rejects it.""" + mps_device = _find_mps_device((args, kwargs)) + if mps_device is None: + return op(*args, **kwargs) + + def _try(): + try: + return True, op(*args, **kwargs) + except Exception as exc: + if not _is_mps_not_implemented_error(exc): + raise + return False, None + + return _with_mps_fallback_cache(op, args, kwargs, mps_device, _try) diff --git a/environment.linux-64.lock b/environment.linux-64.lock new file mode 100644 index 0000000..2d1674e --- /dev/null +++ b/environment.linux-64.lock @@ -0,0 +1,167 @@ +# This file may be used to create an environment using: +# $ conda create --name --file +# platform: linux-64 +# source: environment.yml +# virtual-packages: __linux=1, __glibc=2.17 +@EXPLICIT +https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda +https://conda.anaconda.org/conda-forge/noarch/pybind11-abi-11-hc364b38_1.conda +https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda 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+https://conda.anaconda.org/conda-forge/noarch/nomkl-1.0-h5ca1d4c_0.tar.bz2 +https://conda.anaconda.org/conda-forge/noarch/pybind11-abi-11-hc364b38_1.conda +https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda +https://conda.anaconda.org/conda-forge/noarch/ca-certificates-2026.6.17-hbd8a1cb_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/libuv-1.52.1-h1a92334_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/libzlib-1.3.2-h8088a28_2.conda +https://conda.anaconda.org/conda-forge/osx-arm64/libwebp-base-1.6.0-h07db88b_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/libcxx-22.1.8-h55c6f16_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/llvm-openmp-22.1.8-hc7d1edf_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/ncurses-6.6-h1d4f5a5_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/bzip2-1.0.8-hd037594_9.conda +https://conda.anaconda.org/conda-forge/osx-arm64/libexpat-2.8.1-hf6b4638_1.conda 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+https://conda.anaconda.org/conda-forge/osx-arm64/pytorch-2.12.1-cpu_generic_py314_hae780b4_0.conda +https://conda.anaconda.org/conda-forge/osx-arm64/tokenizers-0.22.2-py314h84b920e_0.conda +https://conda.anaconda.org/conda-forge/noarch/transformers-5.5.0-pyhd8ed1ab_0.conda diff --git a/environment.yml b/environment.yml new file mode 100644 index 0000000..17961bc --- /dev/null +++ b/environment.yml @@ -0,0 +1,17 @@ +name: chroma +channels: + - conda-forge +dependencies: + - pip + - python=3.14.3 + - pandas=2.3.3 + - pillow=12.2.0 + - python-build=1.3.0 + - pytest=9.0.2 + - requests=2.33.1 + - scipy=1.17.1 + - pytorch=2.12.1 + - tqdm=4.67.1 + - transformers=5.5.0 + - scikit-learn=1.8.0 + - twine=6.2.0 diff --git a/environment_Mac.yaml b/environment_Mac.yaml new file mode 100644 index 0000000..0b5263d --- /dev/null +++ b/environment_Mac.yaml @@ -0,0 +1,17 @@ +name: chroma +channels: + - conda-forge +dependencies: + - pip + - python=3.14.3 + - pandas=2.3.3 + - pillow=12.2.0 + - python-build=1.3.0 + - pytest=9.0.2 + - requests=2.33.1 + - scipy=1.17.1 + - pytorch=2.10.0 + - tqdm=4.67.1 + - transformers=5.5.0 + - scikit-learn=1.8.0 + - twine=6.2.0 diff --git a/pyproject.toml b/pyproject.toml new file mode 100644 index 0000000..02239f4 --- /dev/null +++ b/pyproject.toml @@ -0,0 +1,46 @@ +[build-system] +requires = ["setuptools>=61.0", "wheel"] +build-backend = "setuptools.build_meta" + +[project] +name = "chroma" +version = "1.0.0" +description = "Chroma is a generative model for designing proteins programmatically" +readme = "README.md" +requires-python = ">=3.13" +license = "Apache-2.0" + +authors = [ + { name = "Generate Biomedicines, Inc." } +] + +dependencies = [ + "numpy==2.4.3", + "pillow==12.2.0", + "requests==2.33.1", + "scipy==1.17.1", + "torch==2.12.1", + "tqdm==4.67.1", + "transformers==5.5.0", + "scikit-learn==1.8.0" +] + +[project.optional-dependencies] +notebook = [ + "nglview==3.1.4" +] +test = [ + "build==1.3.0", + "pandas==2.3.3", + "pytest==9.0.2", + "twine==6.2.0" +] + +[project.urls] +Homepage = "https://github.com/generatebio/chroma" + +[tool.setuptools.packages.find] +include = ["chroma*"] + +[tool.setuptools.package-data] +chroma = ["assets/centering/*.params"] diff --git a/pytest.ini b/pytest.ini new file mode 100644 index 0000000..ce98f4f --- /dev/null +++ b/pytest.ini @@ -0,0 +1,4 @@ +[pytest] +markers = + integration: end-to-end tests that rely on packaged artifacts, model weights, or external-style workflows. + slow: longer-running tests intended for comprehensive CI or release validation. diff --git a/requirements.txt b/requirements.txt deleted file mode 100644 index 2884596..0000000 --- a/requirements.txt +++ /dev/null @@ -1,11 +0,0 @@ -nglview==3.0.8 -numpy -pandas -Pillow -pytest -Requests -scikit_learn==1.1.2 -scipy -torch -tqdm -transformers==4.24.0 diff --git a/scripts/generate_lockfiles.py b/scripts/generate_lockfiles.py new file mode 100644 index 0000000..322467c --- /dev/null +++ b/scripts/generate_lockfiles.py @@ -0,0 +1,158 @@ +#!/usr/bin/env python3 +"""Generate explicit Conda lockfiles for supported Chroma platforms.""" + +from __future__ import annotations + +import argparse +import json +import os +import shutil +import subprocess +import sys +import tempfile +from pathlib import Path + +import yaml + + +DEFAULT_PLATFORMS = ("osx-arm64", "linux-64") + + +def parse_args() -> argparse.Namespace: + parser = argparse.ArgumentParser(description=__doc__) + parser.add_argument( + "--env-file", + default="environment.yml", + help="Path to the shared Conda environment spec.", + ) + parser.add_argument( + "--platform", + dest="platforms", + action="append", + default=[], + help="Platform to solve. Can be passed multiple times.", + ) + parser.add_argument( + "--output-template", + default="environment.{platform}.lock", + help="Output filename template. Must contain {platform}.", + ) + parser.add_argument( + "--linux-glibc", + default="2.17", + help="glibc virtual package target for linux-64 solves.", + ) + return parser.parse_args() + + +def load_env_spec(path: Path) -> tuple[list[str], list[str]]: + with path.open() as handle: + env = yaml.safe_load(handle) + + channels = env.get("channels") or ["conda-forge"] + deps = [] + for dep in env.get("dependencies", []): + if isinstance(dep, str): + deps.append(dep) + continue + raise ValueError( + f"{path} contains non-Conda dependencies ({dep!r}); " + "explicit lockfiles in this repo must be pure Conda specs." + ) + return channels, deps + + +def solve_platform( + channels: list[str], + deps: list[str], + platform: str, + linux_glibc: str, +) -> dict: + mamba = shutil.which("mamba") + if not mamba: + raise RuntimeError("mamba is required to generate lockfiles") + + with tempfile.TemporaryDirectory(prefix=f"chroma-lock-{platform}-") as tmpdir: + prefix = Path(tmpdir) / "prefix" + cmd = [ + mamba, + "create", + "--dry-run", + "--json", + "--override-channels", + "--platform", + platform, + "--prefix", + str(prefix), + ] + for channel in channels: + cmd.extend(["-c", channel]) + cmd.extend(deps) + + env = os.environ.copy() + if platform == "linux-64": + env["CONDA_OVERRIDE_LINUX"] = "1" + env["CONDA_OVERRIDE_GLIBC"] = linux_glibc + + proc = subprocess.run( + cmd, + check=False, + capture_output=True, + text=True, + env=env, + ) + if proc.returncode != 0: + sys.stderr.write(proc.stdout) + sys.stderr.write(proc.stderr) + raise RuntimeError(f"failed to solve {platform}") + return json.loads(proc.stdout) + + +def write_lockfile( + data: dict, + env_path: Path, + output_path: Path, + platform: str, + linux_glibc: str, +) -> None: + links = data["actions"]["LINK"] + lines = [ + "# This file may be used to create an environment using:", + "# $ conda create --name --file ", + f"# platform: {platform}", + f"# source: {env_path.name}", + ] + if platform == "linux-64": + lines.append( + f"# virtual-packages: __linux=1, __glibc={linux_glibc}" + ) + lines.append("@EXPLICIT") + lines.extend(pkg["url"] for pkg in links) + output_path.write_text("\n".join(lines) + "\n") + + +def main() -> int: + args = parse_args() + env_path = Path(args.env_file) + channels, deps = load_env_spec(env_path) + platforms = args.platforms or list(DEFAULT_PLATFORMS) + + if "{platform}" not in args.output_template: + raise ValueError("--output-template must contain {platform}") + + for platform in platforms: + data = solve_platform(channels, deps, platform, args.linux_glibc) + output_path = Path(args.output_template.format(platform=platform)) + write_lockfile( + data, + env_path=env_path, + output_path=output_path, + platform=platform, + linux_glibc=args.linux_glibc, + ) + print(f"wrote {output_path}") + return 0 + + +if __name__ == "__main__": + raise SystemExit(main()) diff --git a/setup.py b/setup.py deleted file mode 100755 index 6d514ae..0000000 --- a/setup.py +++ /dev/null @@ -1,43 +0,0 @@ -import codecs -import os -import time - -from setuptools import find_packages, setup - -with open("requirements.txt", "r") as req_file: - requirements = [line.split("#")[0].strip() for line in req_file] - requirements = [line for line in requirements if line] - - -def read(rel_path): - here = os.path.abspath(os.path.dirname(__file__)) - with codecs.open(os.path.join(here, rel_path), "r") as fp: - return fp.read() - - -def get_version(rel_path): - for line in read(rel_path).splitlines(): - if line.startswith("__version__"): - delim = '"' if '"' in line else "'" - return line.split(delim)[1] - else: - raise RuntimeError("Unable to find version string.") - - -version = get_version("chroma/__init__.py") - -# During CICD, append "-dev" and unix timestamp to version -if os.environ.get("CI_COMMIT_BRANCH") == "develop": - version += f".dev{int(time.time())}" - -setup( - name="generate-chroma", - version=version, - url="https://github.com/generatebio/chroma", - packages=find_packages(), - description="Chroma is a generative model for designing proteins programmatically", - include_package_data=True, - author="Generate Biomedicines", - license="Apache 2.0", - install_requires=requirements, -) diff --git a/tests/data/test_protein.py b/tests/data/test_protein.py index 1b7f86a..9174f9f 100644 --- a/tests/data/test_protein.py +++ b/tests/data/test_protein.py @@ -1,4 +1,5 @@ import copy +import shutil import tempfile from pathlib import Path @@ -6,15 +7,17 @@ import chroma from chroma.data.protein import Protein +from chroma.utility.ngl import has_nglview +from tests.helpers import cif_path BASE_PATH = str(Path(chroma.__file__).parent.parent) -PROTEIN_SINGLE_CHAIN = BASE_PATH + "/tests/resources/4kw4.cif" -PROTEIN_COMPLEX = BASE_PATH + "/tests/resources/3hn3.cif" +PROTEIN_SINGLE_CHAIN = cif_path("4kw4") +PROTEIN_COMPLEX = cif_path("3hn3") CIF_TRAJECTORY = BASE_PATH + "/tests/resources/chroma_trajectory.cif" SEQUENCE = "MSKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTL" -PDB_ID = "1B9C" +PDB_CIF = cif_path("1b9c") -TESTS = [PROTEIN_SINGLE_CHAIN, PROTEIN_COMPLEX, SEQUENCE, PDB_ID] +TESTS = [PROTEIN_SINGLE_CHAIN, PROTEIN_COMPLEX, SEQUENCE, PDB_CIF] @pytest.mark.parametrize("protein_path", TESTS) @@ -24,9 +27,7 @@ def test_Protein(protein_path): protein = Protein.from_PDB(protein_path) elif protein_path.endswith(".cif"): protein = Protein.from_CIF(protein_path) - elif len(protein_path) == 4: - protein = Protein.from_PDBID(protein_path) - else: # Protein Sequence Input + else: protein = Protein.from_sequence(protein_path) # Selection Smoke Test @@ -37,7 +38,8 @@ def test_Protein(protein_path): protein.canonicalize() protein.sequence() len(protein) - protein.display() + if has_nglview(): + protein.display() # Cycles save / load /validate X, C, S = protein.to_XCS() @@ -130,7 +132,18 @@ def test_xcs_trajectory(): print(protein) # Display Trajectory - protein.display() + if has_nglview(): + protein.display() + + +def test_display_requires_working_nglview(): + protein = Protein.from_sequence(SEQUENCE) + + if has_nglview(): + protein.display() + else: + with pytest.raises(ImportError, match="nglview"): + protein.display() def test_trajectory_round_trip(): @@ -154,4 +167,29 @@ def test_trajectory_round_trip(): @pytest.mark.parametrize("pdb_id", ["3bdi", "5sv5"]) def test_edge_cases(pdb_id): - Protein(pdb_id, canonicalize=True) + Protein(cif_path(pdb_id), canonicalize=True) + + +def test_local_path_loading_is_explicit_and_pdbid_is_not_inferred(): + protein = Protein(cif_path("1b9c")) + assert len(protein) > 0 + + with pytest.raises(NotImplementedError, match="Protein.from_PDBID"): + Protein("1B9C") + + +def test_from_pdbid_uses_explicit_download_path(monkeypatch, tmp_path): + source = Path(cif_path("1b9c")) + + def _fake_download(pdb_id, ext, local_filename): + assert pdb_id.lower() == "1b9c" + assert ext == ".cif" + shutil.copyfile(source, local_filename) + + monkeypatch.setattr( + "chroma.utility.fetchdb.RCSB_file_download", + _fake_download, + ) + + protein = Protein.from_PDBID("1B9C") + assert len(protein) > 0 diff --git a/tests/data/test_system.py b/tests/data/test_system.py index 9d15747..2859213 100644 --- a/tests/data/test_system.py +++ b/tests/data/test_system.py @@ -1,37 +1,53 @@ import copy -import filecmp import os -import random import tempfile -import time from pathlib import Path -from unittest import TestCase import numpy as np -import pandas import pytest -import requests import chroma from chroma.data.system import System +from chroma.data.system_support import NameList, StringList, SystemAssemblyInfo + +pytestmark = pytest.mark.slow BASE_PATH = str(Path(chroma.__file__).parent.parent) CIF_TRAJECTORY = BASE_PATH + "/tests/resources/chroma_trajectory.cif" +LOCAL_CIF_FILES = sorted( + str(path) + for path in Path(BASE_PATH, "tests", "resources").glob("*.cif") + if path.name != "chroma_trajectory.cif" +) + + +def test_system_support_defaults_are_not_shared(): + assembly_a = SystemAssemblyInfo() + assembly_b = SystemAssemblyInfo() + assembly_a.assemblies["A"] = {"details": "test"} + assembly_a.operations["1"] = {"type": "identity"} + assert assembly_b.assemblies == {} + assert assembly_b.operations == {} + + strings_a = StringList() + strings_b = StringList() + strings_a.append("ABC") + assert len(strings_b) == 0 + + names_a = NameList() + names_b = NameList() + names_a.append("foo") + assert len(names_b) == 0 @pytest.fixture def cif_file(): - file = str( - Path(Path(chroma.__file__).parent.parent, "tests", "resources", "7bz5.cif") - ) + file = str(Path(BASE_PATH, "tests", "resources", "7bz5.cif")) + if not os.path.exists(file): + pytest.skip("requires tests/resources/7bz5.cif") return file -def download_file(url, destination_file): - r = requests.get(url, allow_redirects=True) - open(destination_file, "wb").write(r.content) - - def test_7bz5_selection(cif_file): """ Using a selector on a System, expect canonical results @@ -168,27 +184,24 @@ def test_invalid_input(cif_file): def next_structure_file(num=100, cif=True): - tmp_file = os.path.join(tempfile.gettempdir(), "_pdb_list.txt") - download_file( - "https://files.wwpdb.org/pub/pdb/derived_data/pdb_entry_type.txt", tmp_file - ) - D = pandas.read_csv(tmp_file, sep="\t", header=None) - pdb_ids = list(D[0]) - random.shuffle(pdb_ids) - + selected_files = LOCAL_CIF_FILES[:num] if cif: - file = os.path.join(tempfile.gettempdir(), "_pdb_download.cif") - else: - file = os.path.join(tempfile.gettempdir(), "_pdb_download.pdb") - for pdb_id in pdb_ids[:num]: - # download CIF file - if cif: - file = os.path.join(tempfile.gettempdir(), "_pdb_download.cif") - download_file(f"https://files.rcsb.org/download/{pdb_id}.cif", file) - else: - file = os.path.join(tempfile.gettempdir(), "_pdb_download.pdb") - download_file(f"https://files.rcsb.org/download/{pdb_id}.pdb", file) - yield pdb_id, file + for file in selected_files: + yield Path(file).stem, file + return + + temp_files = [] + try: + for cif_file in selected_files: + with tempfile.NamedTemporaryFile(suffix=".pdb", delete=False) as tmp_file: + pdb_file = tmp_file.name + System.from_CIF(cif_file).to_PDB(pdb_file) + temp_files.append(pdb_file) + yield Path(cif_file).stem, pdb_file + finally: + for pdb_file in temp_files: + if os.path.exists(pdb_file): + os.remove(pdb_file) def test_writing_pdb(cif_file): @@ -203,8 +216,6 @@ def test_writing_pdb(cif_file): def test_reading_cif(cif_file): # smoke test for CIF reading for pdb_id, cif_file in next_structure_file(num=100, cif=True): - # load into python and MST in random order, record time - order = random.random() for i in range(2): sys = System.from_CIF(cif_file) @@ -212,8 +223,6 @@ def test_reading_cif(cif_file): def test_reading_pdb(cif_file): # smoke test for PDB reading for pdb_id, pdb_file in next_structure_file(num=100, cif=False): - # load into python and MST in random order, record time - order = random.random() for i in range(2): sys = System.from_PDB(pdb_file) diff --git a/tests/helpers.py b/tests/helpers.py new file mode 100644 index 0000000..ba0f413 --- /dev/null +++ b/tests/helpers.py @@ -0,0 +1,10 @@ +from pathlib import Path + +import chroma + + +TEST_RESOURCES = Path(chroma.__file__).parent.parent / "tests" / "resources" + + +def cif_path(pdb_id: str) -> str: + return str(TEST_RESOURCES / f"{pdb_id.lower()}.cif") diff --git a/tests/layers/structure/test_conditioners.py b/tests/layers/structure/test_conditioners.py index 26a7cba..fc6df9c 100644 --- a/tests/layers/structure/test_conditioners.py +++ b/tests/layers/structure/test_conditioners.py @@ -11,6 +11,7 @@ from chroma.layers.structure import backbone, conditioners, rmsd, symmetry from chroma.models.graph_backbone import GraphBackbone from chroma.models.procap import ProteinCaption +from tests.helpers import cif_path @pytest.fixture(scope="session") @@ -26,8 +27,7 @@ def XCO(): @pytest.fixture(scope="session") def protein(): - pdb_id = "1drf" - protein = Protein.from_PDBID(pdb_id, canonicalize=True) + protein = Protein.from_CIF(cif_path("1drf"), canonicalize=True) protein.sys.save_selection(gti=list(range(15)), selname="clamp") protein.sys.save_selection(gti=list(range(15, 25)), selname="semirigid") return protein @@ -138,6 +138,8 @@ def X0_func(X, C, t): ) +@pytest.mark.integration +@pytest.mark.slow def test_proclass_conditioner(protein): """Smoke test for secondary structure conditioning""" SECONDARY_STRUCTURE = "CCEEEEEEEETTTTECTTTTTTTTCCCHHHHHHHHHHHHCCCTTTTEEEEEECHHHHHHCTGGTTTTTTTEEEEETTTTTTTTTTTCEEECTHHHHHHHHHCHGHGGHCCEEEEEECHHHHHHHHHCTCEEEEEEEEETTCCCTTEECCCCTGGGTEEETETTTTTCCEEEETTEEEEEEEEEEEC" diff --git a/tests/layers/structure/test_mvn.py b/tests/layers/structure/test_mvn.py index deb68fd..64f107a 100644 --- a/tests/layers/structure/test_mvn.py +++ b/tests/layers/structure/test_mvn.py @@ -14,6 +14,7 @@ ConditionalBackboneMVNGlobular, ) from chroma.layers.structure.rmsd import BackboneRMSD +from tests.helpers import cif_path @pytest.fixture(params=["brownian", "globular", "residue_gas"]) @@ -131,7 +132,7 @@ def test_invertibility_covariance(noise, XCS, debug=False): def test_log_determinant(noise): """Test log determinant of the covariance matrix.""" - X, C, S = Protein("5imm").to_XCS() + X, C, S = Protein(cif_path("5imm")).to_XCS() X = X[0:1, ...] C = C[0:1, ...] @@ -161,7 +162,7 @@ def test_cmvn(noise): pass else: aligner = BackboneRMSD() - protein = Protein("1drf") + protein = Protein(cif_path("1drf")) X, C, S = protein.to_XCS() protein.sys.save_selection(gti=list(range(14)), selname="clamp") cmvn = ConditionalBackboneMVNGlobular( diff --git a/tests/layers/structure/test_potts.py b/tests/layers/structure/test_potts.py index 0949534..0d6f1eb 100644 --- a/tests/layers/structure/test_potts.py +++ b/tests/layers/structure/test_potts.py @@ -123,6 +123,14 @@ def test_potts_mcmc(proposal, debug=False): mask_i = mask_i.to(device) mask_ij = mask_ij.to(device) S_exact = S_exact.to(device) + if torch.backends.mps.is_available(): + device = "mps" + h = h.to(device) + J = J.to(device) + edge_idx = edge_idx.to(device) + mask_i = mask_i.to(device) + mask_ij = mask_ij.to(device) + S_exact = S_exact.to(device) # Compute exact distribution over sequence space B = S_exact.shape[0] diff --git a/tests/layers/structure/test_protein_graph.py b/tests/layers/structure/test_protein_graph.py index c692b80..8a9b8dd 100644 --- a/tests/layers/structure/test_protein_graph.py +++ b/tests/layers/structure/test_protein_graph.py @@ -1,3 +1,4 @@ +import json import numpy as np import pytest import torch @@ -6,6 +7,7 @@ from chroma.data import Protein from chroma.layers.structure.backbone import RigidTransformer from chroma.layers.structure.protein_graph import ProteinFeatureGraph +from tests.helpers import cif_path def test_protein_feature_graph(): @@ -29,7 +31,7 @@ def test_protein_feature_graph(): graph_kwargs={"mask_interfaces": False, "cutoff": None}, ) - X, C, S = Protein("5imm").to_XCS() + X, C, S = Protein(cif_path("5imm")).to_XCS() node_h, edge_h, edge_idx, mask_i, mask_ij = feature_graph(X, C) num_nodes = X.shape[1] @@ -82,7 +84,7 @@ def test_masked_interfaces(): graph_kwargs={"mask_interfaces": True, "cutoff": None}, ) - X, C, S = Protein("5imm").to_XCS() + X, C, S = Protein(cif_path("5imm")).to_XCS() node_h, edge_h, edge_idx, mask_i, mask_ij = feature_graph(X, C) num_nodes = X.shape[1] @@ -102,3 +104,79 @@ def test_masked_interfaces(): assert torch.allclose(node_h_r, node_h, atol=1e-3) assert torch.allclose(edge_h_r, edge_h, atol=1e-3) assert torch.allclose(edge_idx, edge_idx_r, atol=1e-3) + + +def test_centering_init_does_not_compute_remote_stats(monkeypatch, tmp_path): + def _fail(*args, **kwargs): + raise AssertionError("constructor should not compute reference stats") + + monkeypatch.setattr(ProteinFeatureGraph, "_reference_stats", _fail) + + feature_graph = ProteinFeatureGraph( + dim_nodes=8, + dim_edges=8, + node_features=(("internal_coords", {"log_lengths": True}),), + edge_features=("distances_2mer",), + num_neighbors=2, + centered=True, + centered_pdb="mock", + centering_file=str(tmp_path / "missing.params"), + ) + + assert torch.count_nonzero(feature_graph.node_means_0) == 0 + assert torch.count_nonzero(feature_graph.edge_means_0) == 0 + + +def test_centering_stats_can_be_loaded_explicitly(tmp_path): + X = torch.randn(1, 6, 4, 3) + C = torch.ones(1, 6, dtype=torch.long) + + source_graph = ProteinFeatureGraph( + dim_nodes=8, + dim_edges=8, + node_features=(("internal_coords", {"log_lengths": True}),), + edge_features=("distances_2mer",), + num_neighbors=2, + centered=True, + centered_pdb="mock", + centering_file=str(tmp_path / "centering.params"), + ) + stats = source_graph._feature_stats(X, C) + source_graph._write_centering_params( + str(tmp_path / "centering.params"), "mock", stats + ) + + loaded_graph = ProteinFeatureGraph( + dim_nodes=8, + dim_edges=8, + node_features=(("internal_coords", {"log_lengths": True}),), + edge_features=("distances_2mer",), + num_neighbors=2, + centered=True, + centered_pdb="mock", + centering_file=str(tmp_path / "centering.params"), + ) + + assert torch.allclose( + loaded_graph.node_means_0, + torch.tensor(stats[json.dumps(loaded_graph.node_features[0])]).view(1, 1, -1), + ) + assert torch.allclose( + loaded_graph.edge_means_0, + torch.tensor(stats[json.dumps(loaded_graph.edge_features[0])]).view(1, 1, -1), + ) + + +def test_packaged_centering_stats_are_available_by_default(): + feature_graph = ProteinFeatureGraph( + dim_nodes=8, + dim_edges=8, + node_features=(("internal_coords", {"log_lengths": True}),), + edge_features=("distances_2mer", "orientations_2mer", "distances_chain"), + num_neighbors=2, + centered=True, + centered_pdb="2g3n", + ) + + assert torch.count_nonzero(feature_graph.node_means_0) > 0 + assert torch.count_nonzero(feature_graph.edge_means_0) > 0 diff --git a/tests/layers/structure/test_rmsd.py b/tests/layers/structure/test_rmsd.py index 0802f7f..ff045ec 100644 --- a/tests/layers/structure/test_rmsd.py +++ b/tests/layers/structure/test_rmsd.py @@ -11,6 +11,7 @@ LossFragmentRMSD, LossNeighborhoodRMSD, ) +from tests.helpers import cif_path @pytest.fixture @@ -141,7 +142,7 @@ def test_backbone_rmsd(backbones): for method in ["symeig", "power"]: backbone_rmsd = BackboneRMSD(method=method) - X, C, S = Protein("5imm").to_XCS() + X, C, S = Protein(cif_path("5imm")).to_XCS() rigid_transformer = RigidTransformer() dX = torch.Tensor([[1, 4, 2]]) @@ -157,7 +158,7 @@ def test_backbone_rmsd(backbones): def test_fragment_rmsd(debug=False): - X, C, S = Protein("1SHG").to_XCS() + X, C, S = Protein(cif_path("1shg")).to_XCS() loss_frags = LossFragmentRMSD() @@ -206,7 +207,7 @@ def _trajectory(X_frags): def test_fragment_pair_rmsd(debug=False): - X, C, S = Protein("1SHG").to_XCS() + X, C, S = Protein(cif_path("1shg")).to_XCS() loss_pairs = LossFragmentPairRMSD() @@ -257,7 +258,7 @@ def _trajectory(X_pairs): def test_neighborhood_rmsd(debug=False): - X, C, S = Protein("1SHG").to_XCS() + X, C, S = Protein(cif_path("1shg")).to_XCS() loss_nb = LossNeighborhoodRMSD() diff --git a/tests/layers/structure/test_sidechain.py b/tests/layers/structure/test_sidechain.py index 18ba5db..391b0cb 100644 --- a/tests/layers/structure/test_sidechain.py +++ b/tests/layers/structure/test_sidechain.py @@ -7,6 +7,7 @@ from chroma import constants from chroma.data import Protein from chroma.layers.structure import backbone, sidechain +from tests.helpers import cif_path class TestSideChain(TestCase): @@ -19,8 +20,7 @@ def setUp(self): self.distance_loss = sidechain.LossAllAtomDistances() self.frame_builder = sidechain.AllAtomFrameBuilder() - pdb_id = "1SHG" - self.X, self.C, self.S = Protein(pdb_id).to_XCS(all_atom=True) + self.X, self.C, self.S = Protein(cif_path("1shg")).to_XCS(all_atom=True) def test_chi_cartesian_round_trip(self): X, C, S = self.X, self.C, self.S diff --git a/tests/layers/test_attention.py b/tests/layers/test_attention.py new file mode 100644 index 0000000..6c8f6c3 --- /dev/null +++ b/tests/layers/test_attention.py @@ -0,0 +1,77 @@ +import torch + +from chroma.layers.attention import AttentionChainPool, MultiHeadAttention, ScaledDotProductAttention + + +def _legacy_multi_head_attention(module, Q, K, V, mask=None): + mb_size = Q.size(0) + sdp = ScaledDotProductAttention() + + q_s = torch.cat([Q @ W for W in module.Wq]) + k_s = torch.cat([K @ W for W in module.Wk]) + v_s = torch.cat([V @ W for W in module.Wv]) + + if mask is not None: + mask = mask.repeat(module.n_head, 1, 1) + + outputs, attns = sdp(q_s, k_s, v_s, mask=mask) + outputs = torch.cat(torch.split(outputs, mb_size, dim=0), dim=-1) + outputs = module.dropout(outputs @ module.Wo) + return outputs, attns + + +def _legacy_attention_chain_pool(module, h, C): + chains = C.abs().unique() + chains = chains[chains > 0] + num_chains = len(chains.unique()) + output = [] + chain_mask = [] + for chain_id in chains: + mask = (C.abs() == chain_id).unsqueeze(1) + output.append(module.attention(module.get_query(h), h, h, mask=mask)) + chain_mask.append(mask.any(dim=-1)) + output = torch.cat(output, dim=1) + chain_mask = torch.cat(chain_mask, dim=1) + return output, chain_mask + + +def test_multi_head_attention_matches_legacy_path(): + torch.manual_seed(7) + module = MultiHeadAttention(n_head=3, d_k=4, d_v=5, d_model=8, dropout=0.0) + + Q = torch.randn(2, 6, 8) + K = torch.randn(2, 4, 8) + V = torch.randn(2, 4, 8) + mask = torch.tensor( + [[[True, True, False, True]], [[True, False, True, True]]] + ) + + expected_output, expected_attns = _legacy_multi_head_attention( + module, Q, K, V, mask=mask + ) + actual_output, actual_attns = module(Q, K, V, mask=mask) + + # Batched einsum projection vs. the legacy per-head loop are only + # equivalent up to floating-point reduction order, which differs across + # BLAS backends, so use a looser-than-default tolerance. + assert torch.allclose(actual_output, expected_output, rtol=1e-4, atol=1e-5) + assert torch.allclose(actual_attns, expected_attns, rtol=1e-4, atol=1e-5) + + +def test_attention_chain_pool_matches_legacy_path(): + torch.manual_seed(11) + pool = AttentionChainPool(n_head=2, d_model=6) + + h = torch.randn(2, 5, 6) + C = torch.tensor([[1, 1, 2, 2, 0], [1, 3, 3, 0, 0]]) + + expected_output, expected_chain_mask = _legacy_attention_chain_pool(pool, h, C) + actual_output, actual_chain_mask = pool(h, C) + + assert torch.allclose(actual_output, expected_output) + assert torch.equal(actual_chain_mask, expected_chain_mask) + assert actual_output.shape == (2, 3, 6) + assert torch.equal( + actual_chain_mask, + torch.tensor([[True, True, False], [True, False, True]]), + ) diff --git a/tests/layers/test_norm.py b/tests/layers/test_norm.py index 58a392f..8ca53ee 100644 --- a/tests/layers/test_norm.py +++ b/tests/layers/test_norm.py @@ -8,7 +8,7 @@ class TestBatchNorm(TestCase): def test_norm(self): device = ( - torch.device("cuda") if torch.cuda.is_available() else torch.device("cpu") + torch.device('mps' if torch.backends.mps.is_available() else 'cuda' if torch.cuda.is_available() else 'cpu') ) B, C, L = (3, 5, 7) x1 = torch.randn(B, C, L).to(device) diff --git a/tests/models/test_chroma.py b/tests/models/test_chroma.py index c7f0409..e929244 100644 --- a/tests/models/test_chroma.py +++ b/tests/models/test_chroma.py @@ -1,24 +1,61 @@ +import os +import socket from math import isclose from pathlib import Path +from urllib.parse import parse_qs, urlparse import pytest import torch import chroma +import chroma.utility.api as api from chroma.data.protein import Protein from chroma.layers.structure import conditioners from chroma.models.chroma import Chroma +pytestmark = [pytest.mark.integration, pytest.mark.slow] + BB_MODEL_PATH = "https://chroma-weights.generatebiomedicines.com/downloads?weights=chroma_backbone_v1.0.pt" #'named:nature_v3' GD_MODEL_PATH = "https://chroma-weights.generatebiomedicines.com/downloads?weights=chroma_design_v1.0.pt" #'named:nature_v3' BASE_PATH = str(Path(chroma.__file__).parent.parent) PROTEIN_SAMPLE = BASE_PATH + "/tests/resources/steps200_seed42_len100.cif" +EXPECTED_ELBO = 6.28411340713501 + + +def _resolve_weight_path(url: str, env_var: str) -> str: + override = os.getenv(env_var) + if override is not None: + if not os.path.exists(override): + pytest.skip(f"{env_var} is set but the file does not exist: {override}") + return override + + parsed = urlparse(url) + base_url = f"{parsed.scheme}://{parsed.netloc}{parsed.path}" + weights_name = parse_qs(parsed.query).get("weights", [None])[0] + if weights_name is None: + raise ValueError(f"Could not determine weights name from {url}") + + cached_path = api.download_cache_path(base_url, weights_name) + if os.path.exists(cached_path): + return cached_path + + try: + socket.getaddrinfo(parsed.netloc, 443) + except socket.gaierror: + pytest.skip("requires cached weights or network access") + + try: + return api.download_from_generate(base_url, weights_name, exist_ok=True) + except FileNotFoundError: + pytest.skip("requires cached weights or a configured access token") @pytest.fixture(scope="session") def chroma(): - return Chroma(BB_MODEL_PATH, GD_MODEL_PATH, device="cpu") + bb_weights = _resolve_weight_path(BB_MODEL_PATH, "CHROMA_TEST_BB_WEIGHTS") + gd_weights = _resolve_weight_path(GD_MODEL_PATH, "CHROMA_TEST_GD_WEIGHTS") + return Chroma(bb_weights, gd_weights, device="cpu") def test_chroma(chroma): @@ -29,7 +66,7 @@ def test_chroma(chroma): # Fixed value test score torch.manual_seed(42) scores = chroma.score(protein, num_samples=5) - assert isclose(scores["elbo"].score, 5.890165328979492, abs_tol=1e-3) + assert isclose(scores["elbo"].score, EXPECTED_ELBO, abs_tol=1e-3) # Test Sampling & Design # torch.manual_seed(42) diff --git a/tests/models/test_graph_backbone.py b/tests/models/test_graph_backbone.py index b06f428..e09cd79 100644 --- a/tests/models/test_graph_backbone.py +++ b/tests/models/test_graph_backbone.py @@ -4,10 +4,11 @@ from chroma.data import Protein from chroma.layers.structure import backbone, protein_graph from chroma.models.graph_backbone import GraphBackbone +from tests.helpers import cif_path def test_denoiser(dim_nodes=32, dim_edges=32): - X, C, S = Protein("1SHG").to_XCS() + X, C, S = Protein(cif_path("1shg")).to_XCS() model = GraphBackbone(dim_nodes=dim_nodes, dim_edges=dim_edges) # check if denoiser is working as expected @@ -99,7 +100,7 @@ def test_equivariance_graph_update( _rotate = lambda X_input: transformer(X_input, dX_rotate, q_rotate) # Load test structure and canonicalize - X, C, S = Protein("1qys").to_XCS() + X, C, S = Protein(cif_path("1qys")).to_XCS() R, t, _ = bb_update.frame_builder.inverse(X, C) X = bb_update.frame_builder.forward(R, t, C) diff --git a/tests/models/test_graph_classifier.py b/tests/models/test_graph_classifier.py index da76e7f..4b7ce24 100644 --- a/tests/models/test_graph_classifier.py +++ b/tests/models/test_graph_classifier.py @@ -18,6 +18,11 @@ def test_graph_classifier(self): "loss": "ce", "level": "first_order", }, + "dummy_3": { + "tokens": ["alpha", "beta"], + "loss": "ce", + "level": "complex", + }, } for k, v in class_config.items(): v["tokenizer"] = {k: i for i, k in enumerate(v["tokens"])} @@ -34,7 +39,7 @@ def test_graph_classifier(self): sl = 8 X = torch.randn(bs, sl, 4, 3) - C = torch.ones(bs, sl) + C = torch.tensor([[1, 1, 1, 1, 2, 2, 2, 2]], dtype=torch.long) with torch.no_grad(): node_h, edge_h = model(X, C) @@ -43,3 +48,14 @@ def test_graph_classifier(self): grad = model.gradient(X, C, t=0.5, label="dummy_2", value="w") self.assertTrue(grad.size() == torch.Size([bs, sl, 4, 3])) + + grad_complex = model.gradient(X, C, t=0.5, label="dummy_3", value="alpha") + self.assertTrue(grad_complex.size() == torch.Size([bs, sl, 4, 3])) + + def test_graph_classifier_default_class_config_not_shared(self): + model_a = GraphClassifier(dim_nodes=8, dim_edges=8, edge_mlp_dim=4, node_mlp_dim=4) + model_b = GraphClassifier(dim_nodes=8, dim_edges=8, edge_mlp_dim=4, node_mlp_dim=4) + + model_a.class_config["dummy"] = {"tokens": []} + + self.assertEqual(model_b.class_config, {}) diff --git a/tests/models/test_graph_design.py b/tests/models/test_graph_design.py index 5b1bfb2..6d157d3 100644 --- a/tests/models/test_graph_design.py +++ b/tests/models/test_graph_design.py @@ -67,3 +67,14 @@ def test_graph_design_outputs(model, XCS): assert torch.allclose(outputs["X_noise"], X) for key in ["chi", "logp_chi"]: assert outputs[key].shape[:-1] == X.shape[:2] and outputs[key].shape[-1] == 4 + + +def test_graph_design_noise_without_sidechains_preserves_shape(XCS): + X, C, S = XCS + model = GraphDesign(sidechains=False, separate_packing=False, noise_schedule="log_snr") + model.eval() + + outputs = model(X, C, S, sample_noise=True) + + assert outputs["X_noise"].shape == X.shape + assert torch.isfinite(outputs["X_noise"]).all() diff --git a/tests/resources/1b9c.cif b/tests/resources/1b9c.cif new file mode 100644 index 0000000..4e948a3 --- /dev/null +++ b/tests/resources/1b9c.cif @@ -0,0 +1,11188 @@ +data_1B9C +# +_entry.id 1B9C +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.410 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 1B9C pdb_00001b9c 10.2210/pdb1b9c/pdb +RCSB RCSB000463 ? ? +WWPDB D_1000000463 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +_pdbx_audit_revision_history.part_number +1 'Structure model' 1 0 2000-11-17 ? +2 'Structure model' 1 1 2008-04-26 ? +3 'Structure model' 1 2 2011-07-13 ? +4 'Structure model' 1 3 2018-03-14 ? +5 'Structure model' 1 4 2023-08-09 ? +6 'Structure model' 1 5 2023-11-15 ? +7 'Structure model' 1 6 2024-11-13 ? +8 'Structure model' 2 0 2026-03-18 ? +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Version format compliance' +3 4 'Structure model' 'Database references' +4 5 'Structure model' 'Data collection' +5 5 'Structure model' 'Database references' +6 5 'Structure model' 'Derived calculations' +7 5 'Structure model' 'Refinement description' +8 6 'Structure model' 'Data collection' +9 7 'Structure model' 'Structure summary' +10 8 'Structure model' 'Polymer sequence' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 4 'Structure model' struct_ref_seq_dif +2 5 'Structure model' chem_comp_atom +3 5 'Structure model' chem_comp_bond +4 5 'Structure model' database_2 +5 5 'Structure model' pdbx_initial_refinement_model +6 5 'Structure model' struct_conn +7 5 'Structure model' struct_ref_seq_dif +8 6 'Structure model' chem_comp_atom +9 6 'Structure model' chem_comp_bond +10 7 'Structure model' pdbx_entry_details +11 7 'Structure model' pdbx_modification_feature +12 8 'Structure model' entity_poly +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 4 'Structure model' '_struct_ref_seq_dif.details' +2 5 'Structure model' '_database_2.pdbx_DOI' +3 5 'Structure model' '_database_2.pdbx_database_accession' +4 5 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +5 5 'Structure model' '_struct_ref_seq_dif.details' +6 6 'Structure model' '_chem_comp_atom.atom_id' +7 6 'Structure model' '_chem_comp_bond.atom_id_2' +8 7 'Structure model' '_pdbx_entry_details.has_protein_modification' +9 8 'Structure model' '_entity_poly.pdbx_seq_one_letter_code_can' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 1B9C +_pdbx_database_status.recvd_initial_deposition_date 1999-02-09 +_pdbx_database_status.deposit_site PDBE +_pdbx_database_status.process_site RCSB +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.SG_entry . +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Battistutta, R.' 1 +'Negro, A.' 2 +'Zanotti, G.' 3 +# +loop_ +_citation.id +_citation.title +_citation.journal_abbrev +_citation.journal_volume +_citation.page_first +_citation.page_last +_citation.year +_citation.journal_id_ASTM +_citation.country +_citation.journal_id_ISSN +_citation.journal_id_CSD +_citation.book_publisher +_citation.pdbx_database_id_PubMed +_citation.pdbx_database_id_DOI +primary 'Crystal structure and refolding properties of the mutant F99S/M153T/V163A of the green fluorescent protein.' Proteins 41 +429 437 2000 PSFGEY US 0887-3585 0867 ? 11056031 '10.1002/1097-0134(20001201)41:4<429::AID-PROT10>3.0.CO;2-D' +1 'The Molecular Structure of Green Fluorescent Protein' +Nat.Biotechnol. 14 1246 ? 1996 NABIF9 US 1087-0156 2119 ? ? ? +2 'Crystal Structure of the Aequorea Victoria Green Fluorescent Protein' Science 273 +1392 ? 1996 SCIEAS US 0036-8075 0038 ? ? ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Battistutta, R.' 1 ? +primary 'Negro, A.' 2 ? +primary 'Zanotti, G.' 3 ? +1 'Yang, F.' 4 ? +1 'Moss, L.G.' 5 ? +1 'Phillips Jr., G.N.' 6 ? +2 'Ormo, M.' 7 ? +2 'Cubitt, A.B.' 8 ? +2 'Kallio, K.' 9 ? +2 'Gross, L.A.' 10 ? +2 'Tsien, R.Y.' 11 ? +2 'Remington, S.J.' 12 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'PROTEIN (GREEN FLUORESCENT PROTEIN)' 26737.959 4 ? 'F99S, M153T, V163A' ? ? +2 water nat water 18.015 286 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer yes +_entity_poly.pdbx_seq_one_letter_code +;ASKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTF(CRO)VQCFSRYPDHM +KQHDFFKSAMPEGYVQERTISFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYITADKQK +NGIKANFKIRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGITHGMDELYK +; +_entity_poly.pdbx_seq_one_letter_code_can +;ASKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTFXVQCFSRYPDHMKQHD +FFKSAMPEGYVQERTISFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYITADKQKNGIK +ANFKIRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGITHGMDELYK +; +_entity_poly.pdbx_strand_id A,B,C,D +_entity_poly.pdbx_target_identifier ? +# +_pdbx_entity_nonpoly.entity_id 2 +_pdbx_entity_nonpoly.name water +_pdbx_entity_nonpoly.comp_id HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 ALA n +1 2 SER n +1 3 LYS n +1 4 GLY n +1 5 GLU n +1 6 GLU n +1 7 LEU n +1 8 PHE n +1 9 THR n +1 10 GLY n +1 11 VAL n +1 12 VAL n +1 13 PRO n +1 14 ILE n +1 15 LEU n +1 16 VAL n +1 17 GLU n +1 18 LEU n +1 19 ASP n +1 20 GLY n +1 21 ASP n +1 22 VAL n +1 23 ASN n +1 24 GLY n +1 25 HIS n +1 26 LYS n +1 27 PHE n +1 28 SER n +1 29 VAL n +1 30 SER n +1 31 GLY n +1 32 GLU n +1 33 GLY n +1 34 GLU n +1 35 GLY n +1 36 ASP n +1 37 ALA n +1 38 THR n +1 39 TYR n +1 40 GLY n +1 41 LYS n +1 42 LEU n +1 43 THR n +1 44 LEU n +1 45 LYS n +1 46 PHE n +1 47 ILE n +1 48 CYS n +1 49 THR n +1 50 THR n +1 51 GLY n +1 52 LYS n +1 53 LEU n +1 54 PRO n +1 55 VAL n +1 56 PRO n +1 57 TRP n +1 58 PRO n +1 59 THR n +1 60 LEU n +1 61 VAL n +1 62 THR n +1 63 THR n +1 64 PHE n +1 65 CRO n +1 66 VAL n +1 67 GLN n +1 68 CYS n +1 69 PHE n +1 70 SER n +1 71 ARG n +1 72 TYR n +1 73 PRO n +1 74 ASP n +1 75 HIS n +1 76 MET n +1 77 LYS n +1 78 GLN n +1 79 HIS n +1 80 ASP n +1 81 PHE n +1 82 PHE n +1 83 LYS n +1 84 SER n +1 85 ALA n +1 86 MET n +1 87 PRO n +1 88 GLU n +1 89 GLY n +1 90 TYR n +1 91 VAL n +1 92 GLN n +1 93 GLU n +1 94 ARG n +1 95 THR n +1 96 ILE n +1 97 SER n +1 98 PHE n +1 99 LYS n +1 100 ASP n +1 101 ASP n +1 102 GLY n +1 103 ASN n +1 104 TYR n +1 105 LYS n +1 106 THR n +1 107 ARG n +1 108 ALA n +1 109 GLU n +1 110 VAL n +1 111 LYS n +1 112 PHE n +1 113 GLU n +1 114 GLY n +1 115 ASP n +1 116 THR n +1 117 LEU n +1 118 VAL n +1 119 ASN n +1 120 ARG n +1 121 ILE n +1 122 GLU n +1 123 LEU n +1 124 LYS n +1 125 GLY n +1 126 ILE n +1 127 ASP n +1 128 PHE n +1 129 LYS n +1 130 GLU n +1 131 ASP n +1 132 GLY n +1 133 ASN n +1 134 ILE n +1 135 LEU n +1 136 GLY n +1 137 HIS n +1 138 LYS n +1 139 LEU n +1 140 GLU n +1 141 TYR n +1 142 ASN n +1 143 TYR n +1 144 ASN n +1 145 SER n +1 146 HIS n +1 147 ASN n +1 148 VAL n +1 149 TYR n +1 150 ILE n +1 151 THR n +1 152 ALA n +1 153 ASP n +1 154 LYS n +1 155 GLN n +1 156 LYS n +1 157 ASN n +1 158 GLY n +1 159 ILE n +1 160 LYS n +1 161 ALA n +1 162 ASN n +1 163 PHE n +1 164 LYS n +1 165 ILE n +1 166 ARG n +1 167 HIS n +1 168 ASN n +1 169 ILE n +1 170 GLU n +1 171 ASP n +1 172 GLY n +1 173 SER n +1 174 VAL n +1 175 GLN n +1 176 LEU n +1 177 ALA n +1 178 ASP n +1 179 HIS n +1 180 TYR n +1 181 GLN n +1 182 GLN n +1 183 ASN n +1 184 THR n +1 185 PRO n +1 186 ILE n +1 187 GLY n +1 188 ASP n +1 189 GLY n +1 190 PRO n +1 191 VAL n +1 192 LEU n +1 193 LEU n +1 194 PRO n +1 195 ASP n +1 196 ASN n +1 197 HIS n +1 198 TYR n +1 199 LEU n +1 200 SER n +1 201 THR n +1 202 GLN n +1 203 SER n +1 204 ALA n +1 205 LEU n +1 206 SER n +1 207 LYS n +1 208 ASP n +1 209 PRO n +1 210 ASN n +1 211 GLU n +1 212 LYS n +1 213 ARG n +1 214 ASP n +1 215 HIS n +1 216 MET n +1 217 VAL n +1 218 LEU n +1 219 LEU n +1 220 GLU n +1 221 PHE n +1 222 VAL n +1 223 THR n +1 224 ALA n +1 225 ALA n +1 226 GLY n +1 227 ILE n +1 228 THR n +1 229 HIS n +1 230 GLY n +1 231 MET n +1 232 ASP n +1 233 GLU n +1 234 LEU n +1 235 TYR n +1 236 LYS n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus Aequorea +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Aequorea victoria' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 6100 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli BL21(DE3)' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 469008 +_entity_src_gen.host_org_genus Escherichia +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species 'Escherichia coli' +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain 'BL21(DE3)' +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type ? +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name 'PRSETB (INVITROGEN)' +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description 'THE N-TERMINAL HIS-TAG HAS BEEN REMOVED' +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CRO 'L-peptide linking' n +'{2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid' +'PEPTIDE DERIVED CHROMOPHORE' 'C15 H17 N3 O5' 319.313 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 ALA 1 1 ? ? ? A . n +A 1 2 SER 2 2 ? ? ? A . n +A 1 3 LYS 3 3 ? ? ? A . n +A 1 4 GLY 4 4 4 GLY GLY A . n +A 1 5 GLU 5 5 5 GLU GLU A . n +A 1 6 GLU 6 6 6 GLU GLU A . n +A 1 7 LEU 7 7 7 LEU LEU A . n +A 1 8 PHE 8 8 8 PHE PHE A . n +A 1 9 THR 9 9 9 THR THR A . n +A 1 10 GLY 10 10 10 GLY GLY A . n +A 1 11 VAL 11 11 11 VAL VAL A . n +A 1 12 VAL 12 12 12 VAL VAL A . n +A 1 13 PRO 13 13 13 PRO PRO A . n +A 1 14 ILE 14 14 14 ILE ILE A . n +A 1 15 LEU 15 15 15 LEU LEU A . n +A 1 16 VAL 16 16 16 VAL VAL A . n +A 1 17 GLU 17 17 17 GLU GLU A . n +A 1 18 LEU 18 18 18 LEU LEU A . n +A 1 19 ASP 19 19 19 ASP ASP A . n +A 1 20 GLY 20 20 20 GLY GLY A . n +A 1 21 ASP 21 21 21 ASP ASP A . n +A 1 22 VAL 22 22 22 VAL VAL A . n +A 1 23 ASN 23 23 23 ASN ASN A . n +A 1 24 GLY 24 24 24 GLY GLY A . n +A 1 25 HIS 25 25 25 HIS HIS A . n +A 1 26 LYS 26 26 26 LYS LYS A . n +A 1 27 PHE 27 27 27 PHE PHE A . n +A 1 28 SER 28 28 28 SER SER A . n +A 1 29 VAL 29 29 29 VAL VAL A . n +A 1 30 SER 30 30 30 SER SER A . n +A 1 31 GLY 31 31 31 GLY GLY A . n +A 1 32 GLU 32 32 32 GLU GLU A . n +A 1 33 GLY 33 33 33 GLY GLY A . n +A 1 34 GLU 34 34 34 GLU GLU A . n +A 1 35 GLY 35 35 35 GLY GLY A . n +A 1 36 ASP 36 36 36 ASP ASP A . n +A 1 37 ALA 37 37 37 ALA ALA A . n +A 1 38 THR 38 38 38 THR THR A . n +A 1 39 TYR 39 39 39 TYR TYR A . n +A 1 40 GLY 40 40 40 GLY GLY A . n +A 1 41 LYS 41 41 41 LYS LYS A . n +A 1 42 LEU 42 42 42 LEU LEU A . n +A 1 43 THR 43 43 43 THR THR A . n +A 1 44 LEU 44 44 44 LEU LEU A . n +A 1 45 LYS 45 45 45 LYS LYS A . n +A 1 46 PHE 46 46 46 PHE PHE A . n +A 1 47 ILE 47 47 47 ILE ILE A . n +A 1 48 CYS 48 48 48 CYS CYS A . n +A 1 49 THR 49 49 49 THR THR A . n +A 1 50 THR 50 50 50 THR THR A . n +A 1 51 GLY 51 51 51 GLY GLY A . n +A 1 52 LYS 52 52 52 LYS LYS A . n +A 1 53 LEU 53 53 53 LEU LEU A . n +A 1 54 PRO 54 54 54 PRO PRO A . n +A 1 55 VAL 55 55 55 VAL VAL A . n +A 1 56 PRO 56 56 56 PRO PRO A . n +A 1 57 TRP 57 57 57 TRP TRP A . n +A 1 58 PRO 58 58 58 PRO PRO A . n +A 1 59 THR 59 59 59 THR THR A . n +A 1 60 LEU 60 60 60 LEU LEU A . n +A 1 61 VAL 61 61 61 VAL VAL A . n +A 1 62 THR 62 62 62 THR THR A . n +A 1 63 THR 63 63 63 THR THR A . n +A 1 64 PHE 64 64 64 PHE PHE A . n +A 1 65 CRO 65 66 66 CRO CRO A . n +A 1 66 VAL 66 68 68 VAL VAL A . n +A 1 67 GLN 67 69 69 GLN GLN A . n +A 1 68 CYS 68 70 70 CYS CYS A . n +A 1 69 PHE 69 71 71 PHE PHE A . n +A 1 70 SER 70 72 72 SER SER A . n +A 1 71 ARG 71 73 73 ARG ARG A . n +A 1 72 TYR 72 74 74 TYR TYR A . n +A 1 73 PRO 73 75 75 PRO PRO A . n +A 1 74 ASP 74 76 76 ASP ASP A . n +A 1 75 HIS 75 77 77 HIS HIS A . n +A 1 76 MET 76 78 78 MET MET A . n +A 1 77 LYS 77 79 79 LYS LYS A . n +A 1 78 GLN 78 80 80 GLN GLN A . n +A 1 79 HIS 79 81 81 HIS HIS A . n +A 1 80 ASP 80 82 82 ASP ASP A . n +A 1 81 PHE 81 83 83 PHE PHE A . n +A 1 82 PHE 82 84 84 PHE PHE A . n +A 1 83 LYS 83 85 85 LYS LYS A . n +A 1 84 SER 84 86 86 SER SER A . n +A 1 85 ALA 85 87 87 ALA ALA A . n +A 1 86 MET 86 88 88 MET MET A . n +A 1 87 PRO 87 89 89 PRO PRO A . n +A 1 88 GLU 88 90 90 GLU GLU A . n +A 1 89 GLY 89 91 91 GLY GLY A . n +A 1 90 TYR 90 92 92 TYR TYR A . n +A 1 91 VAL 91 93 93 VAL VAL A . n +A 1 92 GLN 92 94 94 GLN GLN A . n +A 1 93 GLU 93 95 95 GLU GLU A . n +A 1 94 ARG 94 96 96 ARG ARG A . n +A 1 95 THR 95 97 97 THR THR A . n +A 1 96 ILE 96 98 98 ILE ILE A . n +A 1 97 SER 97 99 99 SER SER A . n +A 1 98 PHE 98 100 100 PHE PHE A . n +A 1 99 LYS 99 101 101 LYS LYS A . n +A 1 100 ASP 100 102 102 ASP ASP A . n +A 1 101 ASP 101 103 103 ASP ASP A . n +A 1 102 GLY 102 104 104 GLY GLY A . n +A 1 103 ASN 103 105 105 ASN ASN A . n +A 1 104 TYR 104 106 106 TYR TYR A . n +A 1 105 LYS 105 107 107 LYS LYS A . n +A 1 106 THR 106 108 108 THR THR A . n +A 1 107 ARG 107 109 109 ARG ARG A . n +A 1 108 ALA 108 110 110 ALA ALA A . n +A 1 109 GLU 109 111 111 GLU GLU A . n +A 1 110 VAL 110 112 112 VAL VAL A . n +A 1 111 LYS 111 113 113 LYS LYS A . n +A 1 112 PHE 112 114 114 PHE PHE A . n +A 1 113 GLU 113 115 115 GLU GLU A . n +A 1 114 GLY 114 116 116 GLY GLY A . n +A 1 115 ASP 115 117 117 ASP ASP A . n +A 1 116 THR 116 118 118 THR THR A . n +A 1 117 LEU 117 119 119 LEU LEU A . n +A 1 118 VAL 118 120 120 VAL VAL A . n +A 1 119 ASN 119 121 121 ASN ASN A . n +A 1 120 ARG 120 122 122 ARG ARG A . n +A 1 121 ILE 121 123 123 ILE ILE A . n +A 1 122 GLU 122 124 124 GLU GLU A . n +A 1 123 LEU 123 125 125 LEU LEU A . n +A 1 124 LYS 124 126 126 LYS LYS A . n +A 1 125 GLY 125 127 127 GLY GLY A . n +A 1 126 ILE 126 128 128 ILE ILE A . n +A 1 127 ASP 127 129 129 ASP ASP A . n +A 1 128 PHE 128 130 130 PHE PHE A . n +A 1 129 LYS 129 131 131 LYS LYS A . n +A 1 130 GLU 130 132 132 GLU GLU A . n +A 1 131 ASP 131 133 133 ASP ASP A . n +A 1 132 GLY 132 134 134 GLY GLY A . n +A 1 133 ASN 133 135 135 ASN ASN A . n +A 1 134 ILE 134 136 136 ILE ILE A . n +A 1 135 LEU 135 137 137 LEU LEU A . n +A 1 136 GLY 136 138 138 GLY GLY A . n +A 1 137 HIS 137 139 139 HIS HIS A . n +A 1 138 LYS 138 140 140 LYS LYS A . n +A 1 139 LEU 139 141 141 LEU LEU A . n +A 1 140 GLU 140 142 142 GLU GLU A . n +A 1 141 TYR 141 143 143 TYR TYR A . n +A 1 142 ASN 142 144 144 ASN ASN A . n +A 1 143 TYR 143 145 145 TYR TYR A . n +A 1 144 ASN 144 146 146 ASN ASN A . n +A 1 145 SER 145 147 147 SER SER A . n +A 1 146 HIS 146 148 148 HIS HIS A . n +A 1 147 ASN 147 149 149 ASN ASN A . n +A 1 148 VAL 148 150 150 VAL VAL A . n +A 1 149 TYR 149 151 151 TYR TYR A . n +A 1 150 ILE 150 152 152 ILE ILE A . n +A 1 151 THR 151 153 153 THR THR A . n +A 1 152 ALA 152 154 154 ALA ALA A . n +A 1 153 ASP 153 155 155 ASP ASP A . n +A 1 154 LYS 154 156 156 LYS LYS A . n +A 1 155 GLN 155 157 157 GLN GLN A . n +A 1 156 LYS 156 158 158 LYS LYS A . n +A 1 157 ASN 157 159 159 ASN ASN A . n +A 1 158 GLY 158 160 160 GLY GLY A . n +A 1 159 ILE 159 161 161 ILE ILE A . n +A 1 160 LYS 160 162 162 LYS LYS A . n +A 1 161 ALA 161 163 163 ALA ALA A . n +A 1 162 ASN 162 164 164 ASN ASN A . n +A 1 163 PHE 163 165 165 PHE PHE A . n +A 1 164 LYS 164 166 166 LYS LYS A . n +A 1 165 ILE 165 167 167 ILE ILE A . n +A 1 166 ARG 166 168 168 ARG ARG A . n +A 1 167 HIS 167 169 169 HIS HIS A . n +A 1 168 ASN 168 170 170 ASN ASN A . n +A 1 169 ILE 169 171 171 ILE ILE A . n +A 1 170 GLU 170 172 172 GLU GLU A . n +A 1 171 ASP 171 173 173 ASP ASP A . n +A 1 172 GLY 172 174 174 GLY GLY A . n +A 1 173 SER 173 175 175 SER SER A . n +A 1 174 VAL 174 176 176 VAL VAL A . n +A 1 175 GLN 175 177 177 GLN GLN A . n +A 1 176 LEU 176 178 178 LEU LEU A . n +A 1 177 ALA 177 179 179 ALA ALA A . n +A 1 178 ASP 178 180 180 ASP ASP A . n +A 1 179 HIS 179 181 181 HIS HIS A . n +A 1 180 TYR 180 182 182 TYR TYR A . n +A 1 181 GLN 181 183 183 GLN GLN A . n +A 1 182 GLN 182 184 184 GLN GLN A . n +A 1 183 ASN 183 185 185 ASN ASN A . n +A 1 184 THR 184 186 186 THR THR A . n +A 1 185 PRO 185 187 187 PRO PRO A . n +A 1 186 ILE 186 188 188 ILE ILE A . n +A 1 187 GLY 187 189 189 GLY GLY A . n +A 1 188 ASP 188 190 190 ASP ASP A . n +A 1 189 GLY 189 191 191 GLY GLY A . n +A 1 190 PRO 190 192 192 PRO PRO A . n +A 1 191 VAL 191 193 193 VAL VAL A . n +A 1 192 LEU 192 194 194 LEU LEU A . n +A 1 193 LEU 193 195 195 LEU LEU A . n +A 1 194 PRO 194 196 196 PRO PRO A . n +A 1 195 ASP 195 197 197 ASP ASP A . n +A 1 196 ASN 196 198 198 ASN ASN A . n +A 1 197 HIS 197 199 199 HIS HIS A . n +A 1 198 TYR 198 200 200 TYR TYR A . n +A 1 199 LEU 199 201 201 LEU LEU A . n +A 1 200 SER 200 202 202 SER SER A . n +A 1 201 THR 201 203 203 THR THR A . n +A 1 202 GLN 202 204 204 GLN GLN A . n +A 1 203 SER 203 205 205 SER SER A . n +A 1 204 ALA 204 206 206 ALA ALA A . n +A 1 205 LEU 205 207 207 LEU LEU A . n +A 1 206 SER 206 208 208 SER SER A . n +A 1 207 LYS 207 209 209 LYS LYS A . n +A 1 208 ASP 208 210 210 ASP ASP A . n +A 1 209 PRO 209 211 211 PRO PRO A . n +A 1 210 ASN 210 212 212 ASN ASN A . n +A 1 211 GLU 211 213 213 GLU GLU A . n +A 1 212 LYS 212 214 214 LYS LYS A . n +A 1 213 ARG 213 215 215 ARG ARG A . n +A 1 214 ASP 214 216 216 ASP ASP A . n +A 1 215 HIS 215 217 217 HIS HIS A . n +A 1 216 MET 216 218 218 MET MET A . n +A 1 217 VAL 217 219 219 VAL VAL A . n +A 1 218 LEU 218 220 220 LEU LEU A . n +A 1 219 LEU 219 221 221 LEU LEU A . n +A 1 220 GLU 220 222 222 GLU GLU A . n +A 1 221 PHE 221 223 223 PHE PHE A . n +A 1 222 VAL 222 224 224 VAL VAL A . n +A 1 223 THR 223 225 225 THR THR A . n +A 1 224 ALA 224 226 226 ALA ALA A . n +A 1 225 ALA 225 227 227 ALA ALA A . n +A 1 226 GLY 226 228 228 GLY GLY A . n +A 1 227 ILE 227 229 229 ILE ILE A . n +A 1 228 THR 228 230 230 THR THR A . n +A 1 229 HIS 229 231 ? ? ? A . n +A 1 230 GLY 230 232 ? ? ? A . n +A 1 231 MET 231 233 ? ? ? A . n +A 1 232 ASP 232 234 ? ? ? A . n +A 1 233 GLU 233 235 ? ? ? A . n +A 1 234 LEU 234 236 ? ? ? A . n +A 1 235 TYR 235 237 ? ? ? A . n +A 1 236 LYS 236 238 ? ? ? A . n +B 1 1 ALA 1 1 ? ? ? B . n +B 1 2 SER 2 2 ? ? ? B . n +B 1 3 LYS 3 3 ? ? ? B . n +B 1 4 GLY 4 4 4 GLY GLY B . n +B 1 5 GLU 5 5 5 GLU GLU B . n +B 1 6 GLU 6 6 6 GLU GLU B . n +B 1 7 LEU 7 7 7 LEU LEU B . n +B 1 8 PHE 8 8 8 PHE PHE B . n +B 1 9 THR 9 9 9 THR THR B . n +B 1 10 GLY 10 10 10 GLY GLY B . n +B 1 11 VAL 11 11 11 VAL VAL B . n +B 1 12 VAL 12 12 12 VAL VAL B . n +B 1 13 PRO 13 13 13 PRO PRO B . n +B 1 14 ILE 14 14 14 ILE ILE B . n +B 1 15 LEU 15 15 15 LEU LEU B . n +B 1 16 VAL 16 16 16 VAL VAL B . n +B 1 17 GLU 17 17 17 GLU GLU B . n +B 1 18 LEU 18 18 18 LEU LEU B . n +B 1 19 ASP 19 19 19 ASP ASP B . n +B 1 20 GLY 20 20 20 GLY GLY B . n +B 1 21 ASP 21 21 21 ASP ASP B . n +B 1 22 VAL 22 22 22 VAL VAL B . n +B 1 23 ASN 23 23 23 ASN ASN B . n +B 1 24 GLY 24 24 24 GLY GLY B . n +B 1 25 HIS 25 25 25 HIS HIS B . n +B 1 26 LYS 26 26 26 LYS LYS B . n +B 1 27 PHE 27 27 27 PHE PHE B . n +B 1 28 SER 28 28 28 SER SER B . n +B 1 29 VAL 29 29 29 VAL VAL B . n +B 1 30 SER 30 30 30 SER SER B . n +B 1 31 GLY 31 31 31 GLY GLY B . n +B 1 32 GLU 32 32 32 GLU GLU B . n +B 1 33 GLY 33 33 33 GLY GLY B . n +B 1 34 GLU 34 34 34 GLU GLU B . n +B 1 35 GLY 35 35 35 GLY GLY B . n +B 1 36 ASP 36 36 36 ASP ASP B . n +B 1 37 ALA 37 37 37 ALA ALA B . n +B 1 38 THR 38 38 38 THR THR B . n +B 1 39 TYR 39 39 39 TYR TYR B . n +B 1 40 GLY 40 40 40 GLY GLY B . n +B 1 41 LYS 41 41 41 LYS LYS B . n +B 1 42 LEU 42 42 42 LEU LEU B . n +B 1 43 THR 43 43 43 THR THR B . n +B 1 44 LEU 44 44 44 LEU LEU B . n +B 1 45 LYS 45 45 45 LYS LYS B . n +B 1 46 PHE 46 46 46 PHE PHE B . n +B 1 47 ILE 47 47 47 ILE ILE B . n +B 1 48 CYS 48 48 48 CYS CYS B . n +B 1 49 THR 49 49 49 THR THR B . n +B 1 50 THR 50 50 50 THR THR B . n +B 1 51 GLY 51 51 51 GLY GLY B . n +B 1 52 LYS 52 52 52 LYS LYS B . n +B 1 53 LEU 53 53 53 LEU LEU B . n +B 1 54 PRO 54 54 54 PRO PRO B . n +B 1 55 VAL 55 55 55 VAL VAL B . n +B 1 56 PRO 56 56 56 PRO PRO B . n +B 1 57 TRP 57 57 57 TRP TRP B . n +B 1 58 PRO 58 58 58 PRO PRO B . n +B 1 59 THR 59 59 59 THR THR B . n +B 1 60 LEU 60 60 60 LEU LEU B . n +B 1 61 VAL 61 61 61 VAL VAL B . n +B 1 62 THR 62 62 62 THR THR B . n +B 1 63 THR 63 63 63 THR THR B . n +B 1 64 PHE 64 64 64 PHE PHE B . n +B 1 65 CRO 65 66 66 CRO CRO B . n +B 1 66 VAL 66 68 68 VAL VAL B . n +B 1 67 GLN 67 69 69 GLN GLN B . n +B 1 68 CYS 68 70 70 CYS CYS B . n +B 1 69 PHE 69 71 71 PHE PHE B . n +B 1 70 SER 70 72 72 SER SER B . n +B 1 71 ARG 71 73 73 ARG ARG B . n +B 1 72 TYR 72 74 74 TYR TYR B . n +B 1 73 PRO 73 75 75 PRO PRO B . n +B 1 74 ASP 74 76 76 ASP ASP B . n +B 1 75 HIS 75 77 77 HIS HIS B . n +B 1 76 MET 76 78 78 MET MET B . n +B 1 77 LYS 77 79 79 LYS LYS B . n +B 1 78 GLN 78 80 80 GLN GLN B . n +B 1 79 HIS 79 81 81 HIS HIS B . n +B 1 80 ASP 80 82 82 ASP ASP B . n +B 1 81 PHE 81 83 83 PHE PHE B . n +B 1 82 PHE 82 84 84 PHE PHE B . n +B 1 83 LYS 83 85 85 LYS LYS B . n +B 1 84 SER 84 86 86 SER SER B . n +B 1 85 ALA 85 87 87 ALA ALA B . n +B 1 86 MET 86 88 88 MET MET B . n +B 1 87 PRO 87 89 89 PRO PRO B . n +B 1 88 GLU 88 90 90 GLU GLU B . n +B 1 89 GLY 89 91 91 GLY GLY B . n +B 1 90 TYR 90 92 92 TYR TYR B . n +B 1 91 VAL 91 93 93 VAL VAL B . n +B 1 92 GLN 92 94 94 GLN GLN B . n +B 1 93 GLU 93 95 95 GLU GLU B . n +B 1 94 ARG 94 96 96 ARG ARG B . n +B 1 95 THR 95 97 97 THR THR B . n +B 1 96 ILE 96 98 98 ILE ILE B . n +B 1 97 SER 97 99 99 SER SER B . n +B 1 98 PHE 98 100 100 PHE PHE B . n +B 1 99 LYS 99 101 101 LYS LYS B . n +B 1 100 ASP 100 102 102 ASP ASP B . n +B 1 101 ASP 101 103 103 ASP ASP B . n +B 1 102 GLY 102 104 104 GLY GLY B . n +B 1 103 ASN 103 105 105 ASN ASN B . n +B 1 104 TYR 104 106 106 TYR TYR B . n +B 1 105 LYS 105 107 107 LYS LYS B . n +B 1 106 THR 106 108 108 THR THR B . n +B 1 107 ARG 107 109 109 ARG ARG B . n +B 1 108 ALA 108 110 110 ALA ALA B . n +B 1 109 GLU 109 111 111 GLU GLU B . n +B 1 110 VAL 110 112 112 VAL VAL B . n +B 1 111 LYS 111 113 113 LYS LYS B . n +B 1 112 PHE 112 114 114 PHE PHE B . n +B 1 113 GLU 113 115 115 GLU GLU B . n +B 1 114 GLY 114 116 116 GLY GLY B . n +B 1 115 ASP 115 117 117 ASP ASP B . n +B 1 116 THR 116 118 118 THR THR B . n +B 1 117 LEU 117 119 119 LEU LEU B . n +B 1 118 VAL 118 120 120 VAL VAL B . n +B 1 119 ASN 119 121 121 ASN ASN B . n +B 1 120 ARG 120 122 122 ARG ARG B . n +B 1 121 ILE 121 123 123 ILE ILE B . n +B 1 122 GLU 122 124 124 GLU GLU B . n +B 1 123 LEU 123 125 125 LEU LEU B . n +B 1 124 LYS 124 126 126 LYS LYS B . n +B 1 125 GLY 125 127 127 GLY GLY B . n +B 1 126 ILE 126 128 128 ILE ILE B . n +B 1 127 ASP 127 129 129 ASP ASP B . n +B 1 128 PHE 128 130 130 PHE PHE B . n +B 1 129 LYS 129 131 131 LYS LYS B . n +B 1 130 GLU 130 132 132 GLU GLU B . n +B 1 131 ASP 131 133 133 ASP ASP B . n +B 1 132 GLY 132 134 134 GLY GLY B . n +B 1 133 ASN 133 135 135 ASN ASN B . n +B 1 134 ILE 134 136 136 ILE ILE B . n +B 1 135 LEU 135 137 137 LEU LEU B . n +B 1 136 GLY 136 138 138 GLY GLY B . n +B 1 137 HIS 137 139 139 HIS HIS B . n +B 1 138 LYS 138 140 140 LYS LYS B . n +B 1 139 LEU 139 141 141 LEU LEU B . n +B 1 140 GLU 140 142 142 GLU GLU B . n +B 1 141 TYR 141 143 143 TYR TYR B . n +B 1 142 ASN 142 144 144 ASN ASN B . n +B 1 143 TYR 143 145 145 TYR TYR B . n +B 1 144 ASN 144 146 146 ASN ASN B . n +B 1 145 SER 145 147 147 SER SER B . n +B 1 146 HIS 146 148 148 HIS HIS B . n +B 1 147 ASN 147 149 149 ASN ASN B . n +B 1 148 VAL 148 150 150 VAL VAL B . n +B 1 149 TYR 149 151 151 TYR TYR B . n +B 1 150 ILE 150 152 152 ILE ILE B . n +B 1 151 THR 151 153 153 THR THR B . n +B 1 152 ALA 152 154 154 ALA ALA B . n +B 1 153 ASP 153 155 155 ASP ASP B . n +B 1 154 LYS 154 156 156 LYS LYS B . n +B 1 155 GLN 155 157 157 GLN GLN B . n +B 1 156 LYS 156 158 158 LYS LYS B . n +B 1 157 ASN 157 159 159 ASN ASN B . n +B 1 158 GLY 158 160 160 GLY GLY B . n +B 1 159 ILE 159 161 161 ILE ILE B . n +B 1 160 LYS 160 162 162 LYS LYS B . n +B 1 161 ALA 161 163 163 ALA ALA B . n +B 1 162 ASN 162 164 164 ASN ASN B . n +B 1 163 PHE 163 165 165 PHE PHE B . n +B 1 164 LYS 164 166 166 LYS LYS B . n +B 1 165 ILE 165 167 167 ILE ILE B . n +B 1 166 ARG 166 168 168 ARG ARG B . n +B 1 167 HIS 167 169 169 HIS HIS B . n +B 1 168 ASN 168 170 170 ASN ASN B . n +B 1 169 ILE 169 171 171 ILE ILE B . n +B 1 170 GLU 170 172 172 GLU GLU B . n +B 1 171 ASP 171 173 173 ASP ASP B . n +B 1 172 GLY 172 174 174 GLY GLY B . n +B 1 173 SER 173 175 175 SER SER B . n +B 1 174 VAL 174 176 176 VAL VAL B . n +B 1 175 GLN 175 177 177 GLN GLN B . n +B 1 176 LEU 176 178 178 LEU LEU B . n +B 1 177 ALA 177 179 179 ALA ALA B . n +B 1 178 ASP 178 180 180 ASP ASP B . n +B 1 179 HIS 179 181 181 HIS HIS B . n +B 1 180 TYR 180 182 182 TYR TYR B . n +B 1 181 GLN 181 183 183 GLN GLN B . n +B 1 182 GLN 182 184 184 GLN GLN B . n +B 1 183 ASN 183 185 185 ASN ASN B . n +B 1 184 THR 184 186 186 THR THR B . n +B 1 185 PRO 185 187 187 PRO PRO B . n +B 1 186 ILE 186 188 188 ILE ILE B . n +B 1 187 GLY 187 189 189 GLY GLY B . n +B 1 188 ASP 188 190 190 ASP ASP B . n +B 1 189 GLY 189 191 191 GLY GLY B . n +B 1 190 PRO 190 192 192 PRO PRO B . n +B 1 191 VAL 191 193 193 VAL VAL B . n +B 1 192 LEU 192 194 194 LEU LEU B . n +B 1 193 LEU 193 195 195 LEU LEU B . n +B 1 194 PRO 194 196 196 PRO PRO B . n +B 1 195 ASP 195 197 197 ASP ASP B . n +B 1 196 ASN 196 198 198 ASN ASN B . n +B 1 197 HIS 197 199 199 HIS HIS B . n +B 1 198 TYR 198 200 200 TYR TYR B . n +B 1 199 LEU 199 201 201 LEU LEU B . n +B 1 200 SER 200 202 202 SER SER B . n +B 1 201 THR 201 203 203 THR THR B . n +B 1 202 GLN 202 204 204 GLN GLN B . n +B 1 203 SER 203 205 205 SER SER B . n +B 1 204 ALA 204 206 206 ALA ALA B . n +B 1 205 LEU 205 207 207 LEU LEU B . n +B 1 206 SER 206 208 208 SER SER B . n +B 1 207 LYS 207 209 209 LYS LYS B . n +B 1 208 ASP 208 210 210 ASP ASP B . n +B 1 209 PRO 209 211 211 PRO PRO B . n +B 1 210 ASN 210 212 212 ASN ASN B . n +B 1 211 GLU 211 213 213 GLU GLU B . n +B 1 212 LYS 212 214 214 LYS LYS B . n +B 1 213 ARG 213 215 215 ARG ARG B . n +B 1 214 ASP 214 216 216 ASP ASP B . n +B 1 215 HIS 215 217 217 HIS HIS B . n +B 1 216 MET 216 218 218 MET MET B . n +B 1 217 VAL 217 219 219 VAL VAL B . n +B 1 218 LEU 218 220 220 LEU LEU B . n +B 1 219 LEU 219 221 221 LEU LEU B . n +B 1 220 GLU 220 222 222 GLU GLU B . n +B 1 221 PHE 221 223 223 PHE PHE B . n +B 1 222 VAL 222 224 224 VAL VAL B . n +B 1 223 THR 223 225 225 THR THR B . n +B 1 224 ALA 224 226 226 ALA ALA B . n +B 1 225 ALA 225 227 227 ALA ALA B . n +B 1 226 GLY 226 228 228 GLY GLY B . n +B 1 227 ILE 227 229 229 ILE ILE B . n +B 1 228 THR 228 230 230 THR THR B . n +B 1 229 HIS 229 231 ? ? ? B . n +B 1 230 GLY 230 232 ? ? ? B . n +B 1 231 MET 231 233 ? ? ? B . n +B 1 232 ASP 232 234 ? ? ? B . n +B 1 233 GLU 233 235 ? ? ? B . n +B 1 234 LEU 234 236 ? ? ? B . n +B 1 235 TYR 235 237 ? ? ? B . n +B 1 236 LYS 236 238 ? ? ? B . n +C 1 1 ALA 1 1 ? ? ? C . n +C 1 2 SER 2 2 ? ? ? C . n +C 1 3 LYS 3 3 ? ? ? C . n +C 1 4 GLY 4 4 4 GLY GLY C . n +C 1 5 GLU 5 5 5 GLU GLU C . n +C 1 6 GLU 6 6 6 GLU GLU C . n +C 1 7 LEU 7 7 7 LEU LEU C . n +C 1 8 PHE 8 8 8 PHE PHE C . n +C 1 9 THR 9 9 9 THR THR C . n +C 1 10 GLY 10 10 10 GLY GLY C . n +C 1 11 VAL 11 11 11 VAL VAL C . n +C 1 12 VAL 12 12 12 VAL VAL C . n +C 1 13 PRO 13 13 13 PRO PRO C . n +C 1 14 ILE 14 14 14 ILE ILE C . n +C 1 15 LEU 15 15 15 LEU LEU C . n +C 1 16 VAL 16 16 16 VAL VAL C . n +C 1 17 GLU 17 17 17 GLU GLU C . n +C 1 18 LEU 18 18 18 LEU LEU C . n +C 1 19 ASP 19 19 19 ASP ASP C . n +C 1 20 GLY 20 20 20 GLY GLY C . n +C 1 21 ASP 21 21 21 ASP ASP C . n +C 1 22 VAL 22 22 22 VAL VAL C . n +C 1 23 ASN 23 23 23 ASN ASN C . n +C 1 24 GLY 24 24 24 GLY GLY C . n +C 1 25 HIS 25 25 25 HIS HIS C . n +C 1 26 LYS 26 26 26 LYS LYS C . n +C 1 27 PHE 27 27 27 PHE PHE C . n +C 1 28 SER 28 28 28 SER SER C . n +C 1 29 VAL 29 29 29 VAL VAL C . n +C 1 30 SER 30 30 30 SER SER C . n +C 1 31 GLY 31 31 31 GLY GLY C . n +C 1 32 GLU 32 32 32 GLU GLU C . n +C 1 33 GLY 33 33 33 GLY GLY C . n +C 1 34 GLU 34 34 34 GLU GLU C . n +C 1 35 GLY 35 35 35 GLY GLY C . n +C 1 36 ASP 36 36 36 ASP ASP C . n +C 1 37 ALA 37 37 37 ALA ALA C . n +C 1 38 THR 38 38 38 THR THR C . n +C 1 39 TYR 39 39 39 TYR TYR C . n +C 1 40 GLY 40 40 40 GLY GLY C . n +C 1 41 LYS 41 41 41 LYS LYS C . n +C 1 42 LEU 42 42 42 LEU LEU C . n +C 1 43 THR 43 43 43 THR THR C . n +C 1 44 LEU 44 44 44 LEU LEU C . n +C 1 45 LYS 45 45 45 LYS LYS C . n +C 1 46 PHE 46 46 46 PHE PHE C . n +C 1 47 ILE 47 47 47 ILE ILE C . n +C 1 48 CYS 48 48 48 CYS CYS C . n +C 1 49 THR 49 49 49 THR THR C . n +C 1 50 THR 50 50 50 THR THR C . n +C 1 51 GLY 51 51 51 GLY GLY C . n +C 1 52 LYS 52 52 52 LYS LYS C . n +C 1 53 LEU 53 53 53 LEU LEU C . n +C 1 54 PRO 54 54 54 PRO PRO C . n +C 1 55 VAL 55 55 55 VAL VAL C . n +C 1 56 PRO 56 56 56 PRO PRO C . n +C 1 57 TRP 57 57 57 TRP TRP C . n +C 1 58 PRO 58 58 58 PRO PRO C . n +C 1 59 THR 59 59 59 THR THR C . n +C 1 60 LEU 60 60 60 LEU LEU C . n +C 1 61 VAL 61 61 61 VAL VAL C . n +C 1 62 THR 62 62 62 THR THR C . n +C 1 63 THR 63 63 63 THR THR C . n +C 1 64 PHE 64 64 64 PHE PHE C . n +C 1 65 CRO 65 66 66 CRO CRO C . n +C 1 66 VAL 66 68 68 VAL VAL C . n +C 1 67 GLN 67 69 69 GLN GLN C . n +C 1 68 CYS 68 70 70 CYS CYS C . n +C 1 69 PHE 69 71 71 PHE PHE C . n +C 1 70 SER 70 72 72 SER SER C . n +C 1 71 ARG 71 73 73 ARG ARG C . n +C 1 72 TYR 72 74 74 TYR TYR C . n +C 1 73 PRO 73 75 75 PRO PRO C . n +C 1 74 ASP 74 76 76 ASP ASP C . n +C 1 75 HIS 75 77 77 HIS HIS C . n +C 1 76 MET 76 78 78 MET MET C . n +C 1 77 LYS 77 79 79 LYS LYS C . n +C 1 78 GLN 78 80 80 GLN GLN C . n +C 1 79 HIS 79 81 81 HIS HIS C . n +C 1 80 ASP 80 82 82 ASP ASP C . n +C 1 81 PHE 81 83 83 PHE PHE C . n +C 1 82 PHE 82 84 84 PHE PHE C . n +C 1 83 LYS 83 85 85 LYS LYS C . n +C 1 84 SER 84 86 86 SER SER C . n +C 1 85 ALA 85 87 87 ALA ALA C . n +C 1 86 MET 86 88 88 MET MET C . n +C 1 87 PRO 87 89 89 PRO PRO C . n +C 1 88 GLU 88 90 90 GLU GLU C . n +C 1 89 GLY 89 91 91 GLY GLY C . n +C 1 90 TYR 90 92 92 TYR TYR C . n +C 1 91 VAL 91 93 93 VAL VAL C . n +C 1 92 GLN 92 94 94 GLN GLN C . n +C 1 93 GLU 93 95 95 GLU GLU C . n +C 1 94 ARG 94 96 96 ARG ARG C . n +C 1 95 THR 95 97 97 THR THR C . n +C 1 96 ILE 96 98 98 ILE ILE C . n +C 1 97 SER 97 99 99 SER SER C . n +C 1 98 PHE 98 100 100 PHE PHE C . n +C 1 99 LYS 99 101 101 LYS LYS C . n +C 1 100 ASP 100 102 102 ASP ASP C . n +C 1 101 ASP 101 103 103 ASP ASP C . n +C 1 102 GLY 102 104 104 GLY GLY C . n +C 1 103 ASN 103 105 105 ASN ASN C . n +C 1 104 TYR 104 106 106 TYR TYR C . n +C 1 105 LYS 105 107 107 LYS LYS C . n +C 1 106 THR 106 108 108 THR THR C . n +C 1 107 ARG 107 109 109 ARG ARG C . n +C 1 108 ALA 108 110 110 ALA ALA C . n +C 1 109 GLU 109 111 111 GLU GLU C . n +C 1 110 VAL 110 112 112 VAL VAL C . n +C 1 111 LYS 111 113 113 LYS LYS C . n +C 1 112 PHE 112 114 114 PHE PHE C . n +C 1 113 GLU 113 115 115 GLU GLU C . n +C 1 114 GLY 114 116 116 GLY GLY C . n +C 1 115 ASP 115 117 117 ASP ASP C . n +C 1 116 THR 116 118 118 THR THR C . n +C 1 117 LEU 117 119 119 LEU LEU C . n +C 1 118 VAL 118 120 120 VAL VAL C . n +C 1 119 ASN 119 121 121 ASN ASN C . n +C 1 120 ARG 120 122 122 ARG ARG C . n +C 1 121 ILE 121 123 123 ILE ILE C . n +C 1 122 GLU 122 124 124 GLU GLU C . n +C 1 123 LEU 123 125 125 LEU LEU C . n +C 1 124 LYS 124 126 126 LYS LYS C . n +C 1 125 GLY 125 127 127 GLY GLY C . n +C 1 126 ILE 126 128 128 ILE ILE C . n +C 1 127 ASP 127 129 129 ASP ASP C . n +C 1 128 PHE 128 130 130 PHE PHE C . n +C 1 129 LYS 129 131 131 LYS LYS C . n +C 1 130 GLU 130 132 132 GLU GLU C . n +C 1 131 ASP 131 133 133 ASP ASP C . n +C 1 132 GLY 132 134 134 GLY GLY C . n +C 1 133 ASN 133 135 135 ASN ASN C . n +C 1 134 ILE 134 136 136 ILE ILE C . n +C 1 135 LEU 135 137 137 LEU LEU C . n +C 1 136 GLY 136 138 138 GLY GLY C . n +C 1 137 HIS 137 139 139 HIS HIS C . n +C 1 138 LYS 138 140 140 LYS LYS C . n +C 1 139 LEU 139 141 141 LEU LEU C . n +C 1 140 GLU 140 142 142 GLU GLU C . n +C 1 141 TYR 141 143 143 TYR TYR C . n +C 1 142 ASN 142 144 144 ASN ASN C . n +C 1 143 TYR 143 145 145 TYR TYR C . n +C 1 144 ASN 144 146 146 ASN ASN C . n +C 1 145 SER 145 147 147 SER SER C . n +C 1 146 HIS 146 148 148 HIS HIS C . n +C 1 147 ASN 147 149 149 ASN ASN C . n +C 1 148 VAL 148 150 150 VAL VAL C . n +C 1 149 TYR 149 151 151 TYR TYR C . n +C 1 150 ILE 150 152 152 ILE ILE C . n +C 1 151 THR 151 153 153 THR THR C . n +C 1 152 ALA 152 154 154 ALA ALA C . n +C 1 153 ASP 153 155 155 ASP ASP C . n +C 1 154 LYS 154 156 156 LYS LYS C . n +C 1 155 GLN 155 157 157 GLN GLN C . n +C 1 156 LYS 156 158 158 LYS LYS C . n +C 1 157 ASN 157 159 159 ASN ASN C . n +C 1 158 GLY 158 160 160 GLY GLY C . n +C 1 159 ILE 159 161 161 ILE ILE C . n +C 1 160 LYS 160 162 162 LYS LYS C . n +C 1 161 ALA 161 163 163 ALA ALA C . n +C 1 162 ASN 162 164 164 ASN ASN C . n +C 1 163 PHE 163 165 165 PHE PHE C . n +C 1 164 LYS 164 166 166 LYS LYS C . n +C 1 165 ILE 165 167 167 ILE ILE C . n +C 1 166 ARG 166 168 168 ARG ARG C . n +C 1 167 HIS 167 169 169 HIS HIS C . n +C 1 168 ASN 168 170 170 ASN ASN C . n +C 1 169 ILE 169 171 171 ILE ILE C . n +C 1 170 GLU 170 172 172 GLU GLU C . n +C 1 171 ASP 171 173 173 ASP ASP C . n +C 1 172 GLY 172 174 174 GLY GLY C . n +C 1 173 SER 173 175 175 SER SER C . n +C 1 174 VAL 174 176 176 VAL VAL C . n +C 1 175 GLN 175 177 177 GLN GLN C . n +C 1 176 LEU 176 178 178 LEU LEU C . n +C 1 177 ALA 177 179 179 ALA ALA C . n +C 1 178 ASP 178 180 180 ASP ASP C . n +C 1 179 HIS 179 181 181 HIS HIS C . n +C 1 180 TYR 180 182 182 TYR TYR C . n +C 1 181 GLN 181 183 183 GLN GLN C . n +C 1 182 GLN 182 184 184 GLN GLN C . n +C 1 183 ASN 183 185 185 ASN ASN C . n +C 1 184 THR 184 186 186 THR THR C . n +C 1 185 PRO 185 187 187 PRO PRO C . n +C 1 186 ILE 186 188 188 ILE ILE C . n +C 1 187 GLY 187 189 189 GLY GLY C . n +C 1 188 ASP 188 190 190 ASP ASP C . n +C 1 189 GLY 189 191 191 GLY GLY C . n +C 1 190 PRO 190 192 192 PRO PRO C . n +C 1 191 VAL 191 193 193 VAL VAL C . n +C 1 192 LEU 192 194 194 LEU LEU C . n +C 1 193 LEU 193 195 195 LEU LEU C . n +C 1 194 PRO 194 196 196 PRO PRO C . n +C 1 195 ASP 195 197 197 ASP ASP C . n +C 1 196 ASN 196 198 198 ASN ASN C . n +C 1 197 HIS 197 199 199 HIS HIS C . n +C 1 198 TYR 198 200 200 TYR TYR C . n +C 1 199 LEU 199 201 201 LEU LEU C . n +C 1 200 SER 200 202 202 SER SER C . n +C 1 201 THR 201 203 203 THR THR C . n +C 1 202 GLN 202 204 204 GLN GLN C . n +C 1 203 SER 203 205 205 SER SER C . n +C 1 204 ALA 204 206 206 ALA ALA C . n +C 1 205 LEU 205 207 207 LEU LEU C . n +C 1 206 SER 206 208 208 SER SER C . n +C 1 207 LYS 207 209 209 LYS LYS C . n +C 1 208 ASP 208 210 210 ASP ASP C . n +C 1 209 PRO 209 211 211 PRO PRO C . n +C 1 210 ASN 210 212 212 ASN ASN C . n +C 1 211 GLU 211 213 213 GLU GLU C . n +C 1 212 LYS 212 214 214 LYS LYS C . n +C 1 213 ARG 213 215 215 ARG ARG C . n +C 1 214 ASP 214 216 216 ASP ASP C . n +C 1 215 HIS 215 217 217 HIS HIS C . n +C 1 216 MET 216 218 218 MET MET C . n +C 1 217 VAL 217 219 219 VAL VAL C . n +C 1 218 LEU 218 220 220 LEU LEU C . n +C 1 219 LEU 219 221 221 LEU LEU C . n +C 1 220 GLU 220 222 222 GLU GLU C . n +C 1 221 PHE 221 223 223 PHE PHE C . n +C 1 222 VAL 222 224 224 VAL VAL C . n +C 1 223 THR 223 225 225 THR THR C . n +C 1 224 ALA 224 226 226 ALA ALA C . n +C 1 225 ALA 225 227 227 ALA ALA C . n +C 1 226 GLY 226 228 228 GLY GLY C . n +C 1 227 ILE 227 229 229 ILE ILE C . n +C 1 228 THR 228 230 230 THR THR C . n +C 1 229 HIS 229 231 ? ? ? C . n +C 1 230 GLY 230 232 ? ? ? C . n +C 1 231 MET 231 233 ? ? ? C . n +C 1 232 ASP 232 234 ? ? ? C . n +C 1 233 GLU 233 235 ? ? ? C . n +C 1 234 LEU 234 236 ? ? ? C . n +C 1 235 TYR 235 237 ? ? ? C . n +C 1 236 LYS 236 238 ? ? ? C . n +D 1 1 ALA 1 1 ? ? ? D . n +D 1 2 SER 2 2 ? ? ? D . n +D 1 3 LYS 3 3 ? ? ? D . n +D 1 4 GLY 4 4 4 GLY GLY D . n +D 1 5 GLU 5 5 5 GLU GLU D . n +D 1 6 GLU 6 6 6 GLU GLU D . n +D 1 7 LEU 7 7 7 LEU LEU D . n +D 1 8 PHE 8 8 8 PHE PHE D . n +D 1 9 THR 9 9 9 THR THR D . n +D 1 10 GLY 10 10 10 GLY GLY D . n +D 1 11 VAL 11 11 11 VAL VAL D . n +D 1 12 VAL 12 12 12 VAL VAL D . n +D 1 13 PRO 13 13 13 PRO PRO D . n +D 1 14 ILE 14 14 14 ILE ILE D . n +D 1 15 LEU 15 15 15 LEU LEU D . n +D 1 16 VAL 16 16 16 VAL VAL D . n +D 1 17 GLU 17 17 17 GLU GLU D . n +D 1 18 LEU 18 18 18 LEU LEU D . n +D 1 19 ASP 19 19 19 ASP ASP D . n +D 1 20 GLY 20 20 20 GLY GLY D . n +D 1 21 ASP 21 21 21 ASP ASP D . n +D 1 22 VAL 22 22 22 VAL VAL D . n +D 1 23 ASN 23 23 23 ASN ASN D . n +D 1 24 GLY 24 24 24 GLY GLY D . n +D 1 25 HIS 25 25 25 HIS HIS D . n +D 1 26 LYS 26 26 26 LYS LYS D . n +D 1 27 PHE 27 27 27 PHE PHE D . n +D 1 28 SER 28 28 28 SER SER D . n +D 1 29 VAL 29 29 29 VAL VAL D . n +D 1 30 SER 30 30 30 SER SER D . n +D 1 31 GLY 31 31 31 GLY GLY D . n +D 1 32 GLU 32 32 32 GLU GLU D . n +D 1 33 GLY 33 33 33 GLY GLY D . n +D 1 34 GLU 34 34 34 GLU GLU D . n +D 1 35 GLY 35 35 35 GLY GLY D . n +D 1 36 ASP 36 36 36 ASP ASP D . n +D 1 37 ALA 37 37 37 ALA ALA D . n +D 1 38 THR 38 38 38 THR THR D . n +D 1 39 TYR 39 39 39 TYR TYR D . n +D 1 40 GLY 40 40 40 GLY GLY D . n +D 1 41 LYS 41 41 41 LYS LYS D . n +D 1 42 LEU 42 42 42 LEU LEU D . n +D 1 43 THR 43 43 43 THR THR D . n +D 1 44 LEU 44 44 44 LEU LEU D . n +D 1 45 LYS 45 45 45 LYS LYS D . n +D 1 46 PHE 46 46 46 PHE PHE D . n +D 1 47 ILE 47 47 47 ILE ILE D . n +D 1 48 CYS 48 48 48 CYS CYS D . n +D 1 49 THR 49 49 49 THR THR D . n +D 1 50 THR 50 50 50 THR THR D . n +D 1 51 GLY 51 51 51 GLY GLY D . n +D 1 52 LYS 52 52 52 LYS LYS D . n +D 1 53 LEU 53 53 53 LEU LEU D . n +D 1 54 PRO 54 54 54 PRO PRO D . n +D 1 55 VAL 55 55 55 VAL VAL D . n +D 1 56 PRO 56 56 56 PRO PRO D . n +D 1 57 TRP 57 57 57 TRP TRP D . n +D 1 58 PRO 58 58 58 PRO PRO D . n +D 1 59 THR 59 59 59 THR THR D . n +D 1 60 LEU 60 60 60 LEU LEU D . n +D 1 61 VAL 61 61 61 VAL VAL D . n +D 1 62 THR 62 62 62 THR THR D . n +D 1 63 THR 63 63 63 THR THR D . n +D 1 64 PHE 64 64 64 PHE PHE D . n +D 1 65 CRO 65 66 66 CRO CRO D . n +D 1 66 VAL 66 68 68 VAL VAL D . n +D 1 67 GLN 67 69 69 GLN GLN D . n +D 1 68 CYS 68 70 70 CYS CYS D . n +D 1 69 PHE 69 71 71 PHE PHE D . n +D 1 70 SER 70 72 72 SER SER D . n +D 1 71 ARG 71 73 73 ARG ARG D . n +D 1 72 TYR 72 74 74 TYR TYR D . n +D 1 73 PRO 73 75 75 PRO PRO D . n +D 1 74 ASP 74 76 76 ASP ASP D . n +D 1 75 HIS 75 77 77 HIS HIS D . n +D 1 76 MET 76 78 78 MET MET D . n +D 1 77 LYS 77 79 79 LYS LYS D . n +D 1 78 GLN 78 80 80 GLN GLN D . n +D 1 79 HIS 79 81 81 HIS HIS D . n +D 1 80 ASP 80 82 82 ASP ASP D . n +D 1 81 PHE 81 83 83 PHE PHE D . n +D 1 82 PHE 82 84 84 PHE PHE D . n +D 1 83 LYS 83 85 85 LYS LYS D . n +D 1 84 SER 84 86 86 SER SER D . n +D 1 85 ALA 85 87 87 ALA ALA D . n +D 1 86 MET 86 88 88 MET MET D . n +D 1 87 PRO 87 89 89 PRO PRO D . n +D 1 88 GLU 88 90 90 GLU GLU D . n +D 1 89 GLY 89 91 91 GLY GLY D . n +D 1 90 TYR 90 92 92 TYR TYR D . n +D 1 91 VAL 91 93 93 VAL VAL D . n +D 1 92 GLN 92 94 94 GLN GLN D . n +D 1 93 GLU 93 95 95 GLU GLU D . n +D 1 94 ARG 94 96 96 ARG ARG D . n +D 1 95 THR 95 97 97 THR THR D . n +D 1 96 ILE 96 98 98 ILE ILE D . n +D 1 97 SER 97 99 99 SER SER D . n +D 1 98 PHE 98 100 100 PHE PHE D . n +D 1 99 LYS 99 101 101 LYS LYS D . n +D 1 100 ASP 100 102 102 ASP ASP D . n +D 1 101 ASP 101 103 103 ASP ASP D . n +D 1 102 GLY 102 104 104 GLY GLY D . n +D 1 103 ASN 103 105 105 ASN ASN D . n +D 1 104 TYR 104 106 106 TYR TYR D . n +D 1 105 LYS 105 107 107 LYS LYS D . n +D 1 106 THR 106 108 108 THR THR D . n +D 1 107 ARG 107 109 109 ARG ARG D . n +D 1 108 ALA 108 110 110 ALA ALA D . n +D 1 109 GLU 109 111 111 GLU GLU D . n +D 1 110 VAL 110 112 112 VAL VAL D . n +D 1 111 LYS 111 113 113 LYS LYS D . n +D 1 112 PHE 112 114 114 PHE PHE D . n +D 1 113 GLU 113 115 115 GLU GLU D . n +D 1 114 GLY 114 116 116 GLY GLY D . n +D 1 115 ASP 115 117 117 ASP ASP D . n +D 1 116 THR 116 118 118 THR THR D . n +D 1 117 LEU 117 119 119 LEU LEU D . n +D 1 118 VAL 118 120 120 VAL VAL D . n +D 1 119 ASN 119 121 121 ASN ASN D . n +D 1 120 ARG 120 122 122 ARG ARG D . n +D 1 121 ILE 121 123 123 ILE ILE D . n +D 1 122 GLU 122 124 124 GLU GLU D . n +D 1 123 LEU 123 125 125 LEU LEU D . n +D 1 124 LYS 124 126 126 LYS LYS D . n +D 1 125 GLY 125 127 127 GLY GLY D . n +D 1 126 ILE 126 128 128 ILE ILE D . n +D 1 127 ASP 127 129 129 ASP ASP D . n +D 1 128 PHE 128 130 130 PHE PHE D . n +D 1 129 LYS 129 131 131 LYS LYS D . n +D 1 130 GLU 130 132 132 GLU GLU D . n +D 1 131 ASP 131 133 133 ASP ASP D . n +D 1 132 GLY 132 134 134 GLY GLY D . n +D 1 133 ASN 133 135 135 ASN ASN D . n +D 1 134 ILE 134 136 136 ILE ILE D . n +D 1 135 LEU 135 137 137 LEU LEU D . n +D 1 136 GLY 136 138 138 GLY GLY D . n +D 1 137 HIS 137 139 139 HIS HIS D . n +D 1 138 LYS 138 140 140 LYS LYS D . n +D 1 139 LEU 139 141 141 LEU LEU D . n +D 1 140 GLU 140 142 142 GLU GLU D . n +D 1 141 TYR 141 143 143 TYR TYR D . n +D 1 142 ASN 142 144 144 ASN ASN D . n +D 1 143 TYR 143 145 145 TYR TYR D . n +D 1 144 ASN 144 146 146 ASN ASN D . n +D 1 145 SER 145 147 147 SER SER D . n +D 1 146 HIS 146 148 148 HIS HIS D . n +D 1 147 ASN 147 149 149 ASN ASN D . n +D 1 148 VAL 148 150 150 VAL VAL D . n +D 1 149 TYR 149 151 151 TYR TYR D . n +D 1 150 ILE 150 152 152 ILE ILE D . n +D 1 151 THR 151 153 153 THR THR D . n +D 1 152 ALA 152 154 154 ALA ALA D . n +D 1 153 ASP 153 155 155 ASP ASP D . n +D 1 154 LYS 154 156 156 LYS LYS D . n +D 1 155 GLN 155 157 157 GLN GLN D . n +D 1 156 LYS 156 158 158 LYS LYS D . n +D 1 157 ASN 157 159 159 ASN ASN D . n +D 1 158 GLY 158 160 160 GLY GLY D . n +D 1 159 ILE 159 161 161 ILE ILE D . n +D 1 160 LYS 160 162 162 LYS LYS D . n +D 1 161 ALA 161 163 163 ALA ALA D . n +D 1 162 ASN 162 164 164 ASN ASN D . n +D 1 163 PHE 163 165 165 PHE PHE D . n +D 1 164 LYS 164 166 166 LYS LYS D . n +D 1 165 ILE 165 167 167 ILE ILE D . n +D 1 166 ARG 166 168 168 ARG ARG D . n +D 1 167 HIS 167 169 169 HIS HIS D . n +D 1 168 ASN 168 170 170 ASN ASN D . n +D 1 169 ILE 169 171 171 ILE ILE D . n +D 1 170 GLU 170 172 172 GLU GLU D . n +D 1 171 ASP 171 173 173 ASP ASP D . n +D 1 172 GLY 172 174 174 GLY GLY D . n +D 1 173 SER 173 175 175 SER SER D . n +D 1 174 VAL 174 176 176 VAL VAL D . n +D 1 175 GLN 175 177 177 GLN GLN D . n +D 1 176 LEU 176 178 178 LEU LEU D . n +D 1 177 ALA 177 179 179 ALA ALA D . n +D 1 178 ASP 178 180 180 ASP ASP D . n +D 1 179 HIS 179 181 181 HIS HIS D . n +D 1 180 TYR 180 182 182 TYR TYR D . n +D 1 181 GLN 181 183 183 GLN GLN D . n +D 1 182 GLN 182 184 184 GLN GLN D . n +D 1 183 ASN 183 185 185 ASN ASN D . n +D 1 184 THR 184 186 186 THR THR D . n +D 1 185 PRO 185 187 187 PRO PRO D . n +D 1 186 ILE 186 188 188 ILE ILE D . n +D 1 187 GLY 187 189 189 GLY GLY D . n +D 1 188 ASP 188 190 190 ASP ASP D . n +D 1 189 GLY 189 191 191 GLY GLY D . n +D 1 190 PRO 190 192 192 PRO PRO D . n +D 1 191 VAL 191 193 193 VAL VAL D . n +D 1 192 LEU 192 194 194 LEU LEU D . n +D 1 193 LEU 193 195 195 LEU LEU D . n +D 1 194 PRO 194 196 196 PRO PRO D . n +D 1 195 ASP 195 197 197 ASP ASP D . n +D 1 196 ASN 196 198 198 ASN ASN D . n +D 1 197 HIS 197 199 199 HIS HIS D . n +D 1 198 TYR 198 200 200 TYR TYR D . n +D 1 199 LEU 199 201 201 LEU LEU D . n +D 1 200 SER 200 202 202 SER SER D . n +D 1 201 THR 201 203 203 THR THR D . n +D 1 202 GLN 202 204 204 GLN GLN D . n +D 1 203 SER 203 205 205 SER SER D . n +D 1 204 ALA 204 206 206 ALA ALA D . n +D 1 205 LEU 205 207 207 LEU LEU D . n +D 1 206 SER 206 208 208 SER SER D . n +D 1 207 LYS 207 209 209 LYS LYS D . n +D 1 208 ASP 208 210 210 ASP ASP D . n +D 1 209 PRO 209 211 211 PRO PRO D . n +D 1 210 ASN 210 212 212 ASN ASN D . n +D 1 211 GLU 211 213 213 GLU GLU D . n +D 1 212 LYS 212 214 214 LYS LYS D . n +D 1 213 ARG 213 215 215 ARG ARG D . n +D 1 214 ASP 214 216 216 ASP ASP D . n +D 1 215 HIS 215 217 217 HIS HIS D . n +D 1 216 MET 216 218 218 MET MET D . n +D 1 217 VAL 217 219 219 VAL VAL D . n +D 1 218 LEU 218 220 220 LEU LEU D . n +D 1 219 LEU 219 221 221 LEU LEU D . n +D 1 220 GLU 220 222 222 GLU GLU D . n +D 1 221 PHE 221 223 223 PHE PHE D . n +D 1 222 VAL 222 224 224 VAL VAL D . n +D 1 223 THR 223 225 225 THR THR D . n +D 1 224 ALA 224 226 226 ALA ALA D . n +D 1 225 ALA 225 227 227 ALA ALA D . n +D 1 226 GLY 226 228 228 GLY GLY D . n +D 1 227 ILE 227 229 229 ILE ILE D . n +D 1 228 THR 228 230 230 THR THR D . n +D 1 229 HIS 229 231 ? ? ? D . n +D 1 230 GLY 230 232 ? ? ? D . n +D 1 231 MET 231 233 ? ? ? D . n +D 1 232 ASP 232 234 ? ? ? D . n +D 1 233 GLU 233 235 ? ? ? D . n +D 1 234 LEU 234 236 ? ? ? D . n +D 1 235 TYR 235 237 ? ? ? D . n +D 1 236 LYS 236 238 ? ? ? D . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +E 2 HOH 1 239 1 HOH HOH A . +E 2 HOH 2 240 2 HOH HOH A . +E 2 HOH 3 241 38 HOH HOH A . +E 2 HOH 4 242 42 HOH HOH A . +E 2 HOH 5 243 60 HOH HOH A . +E 2 HOH 6 244 64 HOH HOH A . +E 2 HOH 7 245 69 HOH HOH A . +E 2 HOH 8 246 74 HOH HOH A . +E 2 HOH 9 247 79 HOH HOH A . +E 2 HOH 10 248 82 HOH HOH A . +E 2 HOH 11 249 99 HOH HOH A . +E 2 HOH 12 250 106 HOH HOH A . +E 2 HOH 13 251 108 HOH HOH A . +E 2 HOH 14 252 109 HOH HOH A . +E 2 HOH 15 253 113 HOH HOH A . +E 2 HOH 16 254 115 HOH HOH A . +E 2 HOH 17 255 124 HOH HOH A . +E 2 HOH 18 256 137 HOH HOH A . +E 2 HOH 19 257 141 HOH HOH A . +E 2 HOH 20 258 155 HOH HOH A . +E 2 HOH 21 259 156 HOH HOH A . +E 2 HOH 22 260 181 HOH HOH A . +E 2 HOH 23 261 186 HOH HOH A . +E 2 HOH 24 262 187 HOH HOH A . +E 2 HOH 25 263 212 HOH HOH A . +E 2 HOH 26 264 213 HOH HOH A . +E 2 HOH 27 265 248 HOH HOH A . +E 2 HOH 28 266 249 HOH HOH A . +E 2 HOH 29 267 250 HOH HOH A . +E 2 HOH 30 268 253 HOH HOH A . +E 2 HOH 31 269 258 HOH HOH A . +E 2 HOH 32 270 259 HOH HOH A . +E 2 HOH 33 271 261 HOH HOH A . +E 2 HOH 34 272 273 HOH HOH A . +E 2 HOH 35 273 279 HOH HOH A . +E 2 HOH 36 274 280 HOH HOH A . +E 2 HOH 37 275 281 HOH HOH A . +E 2 HOH 38 276 282 HOH HOH A . +E 2 HOH 39 277 286 HOH HOH A . +F 2 HOH 1 239 3 HOH HOH B . +F 2 HOH 2 240 23 HOH HOH B . +F 2 HOH 3 241 27 HOH HOH B . +F 2 HOH 4 242 30 HOH HOH B . +F 2 HOH 5 243 32 HOH HOH B . +F 2 HOH 6 244 35 HOH HOH B . +F 2 HOH 7 245 48 HOH HOH B . +F 2 HOH 8 246 49 HOH HOH B . +F 2 HOH 9 247 51 HOH HOH B . +F 2 HOH 10 248 65 HOH HOH B . +F 2 HOH 11 249 66 HOH HOH B . +F 2 HOH 12 250 95 HOH HOH B . +F 2 HOH 13 251 96 HOH HOH B . +F 2 HOH 14 252 105 HOH HOH B . +F 2 HOH 15 253 116 HOH HOH B . +F 2 HOH 16 254 120 HOH HOH B . +F 2 HOH 17 255 121 HOH HOH B . +F 2 HOH 18 256 123 HOH HOH B . +F 2 HOH 19 257 144 HOH HOH B . +F 2 HOH 20 258 146 HOH HOH B . +F 2 HOH 21 259 149 HOH HOH B . +F 2 HOH 22 260 154 HOH HOH B . +F 2 HOH 23 261 161 HOH HOH B . +F 2 HOH 24 262 162 HOH HOH B . +F 2 HOH 25 263 172 HOH HOH B . +F 2 HOH 26 264 175 HOH HOH B . +F 2 HOH 27 265 179 HOH HOH B . +F 2 HOH 28 266 180 HOH HOH B . +F 2 HOH 29 267 191 HOH HOH B . +F 2 HOH 30 268 192 HOH HOH B . +F 2 HOH 31 269 193 HOH HOH B . +F 2 HOH 32 270 200 HOH HOH B . +F 2 HOH 33 271 209 HOH HOH B . +F 2 HOH 34 272 229 HOH HOH B . +F 2 HOH 35 273 230 HOH HOH B . +F 2 HOH 36 274 236 HOH HOH B . +F 2 HOH 37 275 243 HOH HOH B . +F 2 HOH 38 276 247 HOH HOH B . +F 2 HOH 39 277 256 HOH HOH B . +F 2 HOH 40 278 257 HOH HOH B . +F 2 HOH 41 279 283 HOH HOH B . +G 2 HOH 1 239 4 HOH HOH C . +G 2 HOH 2 240 5 HOH HOH C . +G 2 HOH 3 241 6 HOH HOH C . +G 2 HOH 4 242 7 HOH HOH C . +G 2 HOH 5 243 12 HOH HOH C . +G 2 HOH 6 244 16 HOH HOH C . +G 2 HOH 7 245 17 HOH HOH C . +G 2 HOH 8 246 19 HOH HOH C . +G 2 HOH 9 247 26 HOH HOH C . +G 2 HOH 10 248 29 HOH HOH C . +G 2 HOH 11 249 31 HOH HOH C . +G 2 HOH 12 250 33 HOH HOH C . +G 2 HOH 13 251 39 HOH HOH C . +G 2 HOH 14 252 46 HOH HOH C . +G 2 HOH 15 253 50 HOH HOH C . +G 2 HOH 16 254 52 HOH HOH C . +G 2 HOH 17 255 53 HOH HOH C . +G 2 HOH 18 256 55 HOH HOH C . +G 2 HOH 19 257 58 HOH HOH C . +G 2 HOH 20 258 59 HOH HOH C . +G 2 HOH 21 259 61 HOH HOH C . +G 2 HOH 22 260 62 HOH HOH C . +G 2 HOH 23 261 63 HOH HOH C . +G 2 HOH 24 262 67 HOH HOH C . +G 2 HOH 25 263 70 HOH HOH C . +G 2 HOH 26 264 71 HOH HOH C . +G 2 HOH 27 265 72 HOH HOH C . +G 2 HOH 28 266 83 HOH HOH C . +G 2 HOH 29 267 86 HOH HOH C . +G 2 HOH 30 268 87 HOH HOH C . +G 2 HOH 31 269 90 HOH HOH C . +G 2 HOH 32 270 92 HOH HOH C . +G 2 HOH 33 271 93 HOH HOH C . +G 2 HOH 34 272 94 HOH HOH C . +G 2 HOH 35 273 97 HOH HOH C . +G 2 HOH 36 274 100 HOH HOH C . +G 2 HOH 37 275 101 HOH HOH C . +G 2 HOH 38 276 103 HOH HOH C . +G 2 HOH 39 277 110 HOH HOH C . +G 2 HOH 40 278 111 HOH HOH C . +G 2 HOH 41 279 114 HOH HOH C . +G 2 HOH 42 280 117 HOH HOH C . +G 2 HOH 43 281 118 HOH HOH C . +G 2 HOH 44 282 119 HOH HOH C . +G 2 HOH 45 283 125 HOH HOH C . +G 2 HOH 46 284 128 HOH HOH C . +G 2 HOH 47 285 130 HOH HOH C . +G 2 HOH 48 286 131 HOH HOH C . +G 2 HOH 49 287 133 HOH HOH C . +G 2 HOH 50 288 135 HOH HOH C . +G 2 HOH 51 289 139 HOH HOH C . +G 2 HOH 52 290 140 HOH HOH C . +G 2 HOH 53 291 143 HOH HOH C . +G 2 HOH 54 292 145 HOH HOH C . +G 2 HOH 55 293 151 HOH HOH C . +G 2 HOH 56 294 152 HOH HOH C . +G 2 HOH 57 295 153 HOH HOH C . +G 2 HOH 58 296 157 HOH HOH C . +G 2 HOH 59 297 158 HOH HOH C . +G 2 HOH 60 298 159 HOH HOH C . +G 2 HOH 61 299 160 HOH HOH C . +G 2 HOH 62 300 164 HOH HOH C . +G 2 HOH 63 301 165 HOH HOH C . +G 2 HOH 64 302 166 HOH HOH C . +G 2 HOH 65 303 176 HOH HOH C . +G 2 HOH 66 304 177 HOH HOH C . +G 2 HOH 67 305 178 HOH HOH C . +G 2 HOH 68 306 182 HOH HOH C . +G 2 HOH 69 307 183 HOH HOH C . +G 2 HOH 70 308 188 HOH HOH C . +G 2 HOH 71 309 195 HOH HOH C . +G 2 HOH 72 310 196 HOH HOH C . +G 2 HOH 73 311 198 HOH HOH C . +G 2 HOH 74 312 199 HOH HOH C . +G 2 HOH 75 313 202 HOH HOH C . +G 2 HOH 76 314 203 HOH HOH C . +G 2 HOH 77 315 206 HOH HOH C . +G 2 HOH 78 316 208 HOH HOH C . +G 2 HOH 79 317 210 HOH HOH C . +G 2 HOH 80 318 211 HOH HOH C . +G 2 HOH 81 319 214 HOH HOH C . +G 2 HOH 82 320 216 HOH HOH C . +G 2 HOH 83 321 218 HOH HOH C . +G 2 HOH 84 322 220 HOH HOH C . +G 2 HOH 85 323 222 HOH HOH C . +G 2 HOH 86 324 223 HOH HOH C . +G 2 HOH 87 325 227 HOH HOH C . +G 2 HOH 88 326 231 HOH HOH C . +G 2 HOH 89 327 232 HOH HOH C . +G 2 HOH 90 328 233 HOH HOH C . +G 2 HOH 91 329 234 HOH HOH C . +G 2 HOH 92 330 235 HOH HOH C . +G 2 HOH 93 331 238 HOH HOH C . +G 2 HOH 94 332 239 HOH HOH C . +G 2 HOH 95 333 240 HOH HOH C . +G 2 HOH 96 334 245 HOH HOH C . +G 2 HOH 97 335 251 HOH HOH C . +G 2 HOH 98 336 252 HOH HOH C . +G 2 HOH 99 337 254 HOH HOH C . +G 2 HOH 100 338 260 HOH HOH C . +G 2 HOH 101 339 262 HOH HOH C . +G 2 HOH 102 340 264 HOH HOH C . +G 2 HOH 103 341 268 HOH HOH C . +G 2 HOH 104 342 270 HOH HOH C . +G 2 HOH 105 343 271 HOH HOH C . +G 2 HOH 106 344 272 HOH HOH C . +G 2 HOH 107 345 275 HOH HOH C . +G 2 HOH 108 346 276 HOH HOH C . +G 2 HOH 109 347 277 HOH HOH C . +G 2 HOH 110 348 278 HOH HOH C . +H 2 HOH 1 239 8 HOH HOH D . +H 2 HOH 2 240 9 HOH HOH D . +H 2 HOH 3 241 10 HOH HOH D . +H 2 HOH 4 242 11 HOH HOH D . +H 2 HOH 5 243 13 HOH HOH D . +H 2 HOH 6 244 14 HOH HOH D . +H 2 HOH 7 245 15 HOH HOH D . +H 2 HOH 8 246 18 HOH HOH D . +H 2 HOH 9 247 20 HOH HOH D . +H 2 HOH 10 248 21 HOH HOH D . +H 2 HOH 11 249 22 HOH HOH D . +H 2 HOH 12 250 24 HOH HOH D . +H 2 HOH 13 251 25 HOH HOH D . +H 2 HOH 14 252 28 HOH HOH D . +H 2 HOH 15 253 34 HOH HOH D . +H 2 HOH 16 254 36 HOH HOH D . +H 2 HOH 17 255 37 HOH HOH D . +H 2 HOH 18 256 40 HOH HOH D . +H 2 HOH 19 257 41 HOH HOH D . +H 2 HOH 20 258 43 HOH HOH D . +H 2 HOH 21 259 44 HOH HOH D . +H 2 HOH 22 260 45 HOH HOH D . +H 2 HOH 23 261 47 HOH HOH D . +H 2 HOH 24 262 54 HOH HOH D . +H 2 HOH 25 263 56 HOH HOH D . +H 2 HOH 26 264 57 HOH HOH D . +H 2 HOH 27 265 68 HOH HOH D . +H 2 HOH 28 266 73 HOH HOH D . +H 2 HOH 29 267 75 HOH HOH D . +H 2 HOH 30 268 76 HOH HOH D . +H 2 HOH 31 269 77 HOH HOH D . +H 2 HOH 32 270 78 HOH HOH D . +H 2 HOH 33 271 80 HOH HOH D . +H 2 HOH 34 272 81 HOH HOH D . +H 2 HOH 35 273 84 HOH HOH D . +H 2 HOH 36 274 85 HOH HOH D . +H 2 HOH 37 275 88 HOH HOH D . +H 2 HOH 38 276 89 HOH HOH D . +H 2 HOH 39 277 91 HOH HOH D . +H 2 HOH 40 278 98 HOH HOH D . +H 2 HOH 41 279 102 HOH HOH D . +H 2 HOH 42 280 104 HOH HOH D . +H 2 HOH 43 281 107 HOH HOH D . +H 2 HOH 44 282 112 HOH HOH D . +H 2 HOH 45 283 122 HOH HOH D . +H 2 HOH 46 284 126 HOH HOH D . +H 2 HOH 47 285 127 HOH HOH D . +H 2 HOH 48 286 129 HOH HOH D . +H 2 HOH 49 287 132 HOH HOH D . +H 2 HOH 50 288 134 HOH HOH D . +H 2 HOH 51 289 136 HOH HOH D . +H 2 HOH 52 290 138 HOH HOH D . +H 2 HOH 53 291 142 HOH HOH D . +H 2 HOH 54 292 147 HOH HOH D . +H 2 HOH 55 293 148 HOH HOH D . +H 2 HOH 56 294 150 HOH HOH D . +H 2 HOH 57 295 163 HOH HOH D . +H 2 HOH 58 296 167 HOH HOH D . +H 2 HOH 59 297 168 HOH HOH D . +H 2 HOH 60 298 169 HOH HOH D . +H 2 HOH 61 299 170 HOH HOH D . +H 2 HOH 62 300 171 HOH HOH D . +H 2 HOH 63 301 173 HOH HOH D . +H 2 HOH 64 302 174 HOH HOH D . +H 2 HOH 65 303 184 HOH HOH D . +H 2 HOH 66 304 185 HOH HOH D . +H 2 HOH 67 305 189 HOH HOH D . +H 2 HOH 68 306 190 HOH HOH D . +H 2 HOH 69 307 194 HOH HOH D . +H 2 HOH 70 308 197 HOH HOH D . +H 2 HOH 71 309 201 HOH HOH D . +H 2 HOH 72 310 204 HOH HOH D . +H 2 HOH 73 311 205 HOH HOH D . +H 2 HOH 74 312 207 HOH HOH D . +H 2 HOH 75 313 215 HOH HOH D . +H 2 HOH 76 314 217 HOH HOH D . +H 2 HOH 77 315 219 HOH HOH D . +H 2 HOH 78 316 221 HOH HOH D . +H 2 HOH 79 317 224 HOH HOH D . +H 2 HOH 80 318 225 HOH HOH D . +H 2 HOH 81 319 226 HOH HOH D . +H 2 HOH 82 320 228 HOH HOH D . +H 2 HOH 83 321 237 HOH HOH D . +H 2 HOH 84 322 241 HOH HOH D . +H 2 HOH 85 323 242 HOH HOH D . +H 2 HOH 86 324 244 HOH HOH D . +H 2 HOH 87 325 246 HOH HOH D . +H 2 HOH 88 326 255 HOH HOH D . +H 2 HOH 89 327 263 HOH HOH D . +H 2 HOH 90 328 265 HOH HOH D . +H 2 HOH 91 329 266 HOH HOH D . +H 2 HOH 92 330 267 HOH HOH D . +H 2 HOH 93 331 269 HOH HOH D . +H 2 HOH 94 332 274 HOH HOH D . +H 2 HOH 95 333 284 HOH HOH D . +H 2 HOH 96 334 285 HOH HOH D . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A CRO 66 ? CG1 ? A CRO 65 CG1 +2 1 Y 1 B CRO 66 ? CG1 ? B CRO 65 CG1 +3 1 Y 1 C CRO 66 ? CG1 ? C CRO 65 CG1 +4 1 Y 1 D CRO 66 ? CG1 ? D CRO 65 CG1 +# +loop_ +_software.name +_software.classification +_software.version +_software.citation_id +_software.pdbx_ordinal +AMoRE phasing . ? 1 +X-PLOR refinement 3.8.5 ? 2 +MOSFLM 'data reduction' . ? 3 +CCP4 'data scaling' '(SCALA)' ? 4 +# +_cell.entry_id 1B9C +_cell.length_a 83.480 +_cell.length_b 85.370 +_cell.length_c 140.060 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 90.00 +_cell.Z_PDB 16 +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 1B9C +_symmetry.space_group_name_H-M 'P 21 21 21' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 19 +# +_exptl.entry_id 1B9C +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number 2 +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.3 +_exptl_crystal.density_percent_sol 50 +_exptl_crystal.description ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method ? +_exptl_crystal_grow.temp ? +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pH 8.3 +_exptl_crystal_grow.pdbx_details +'22% PEG 4000, 50 MM HEPES PH 8.5, 50 MM MGCL2, 10 MM 2-MERCAPTOETHANOL, 23% MG/ ML PROTEINA, pH 8.3' +_exptl_crystal_grow.pdbx_pH_range . +# +_diffrn.id 1 +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector 'IMAGE PLATE' +_diffrn_detector.type 'MAR scanner 345 mm plate' +_diffrn_detector.pdbx_collection_date ? +_diffrn_detector.details ? +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator 'SI (111)' +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1. +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'ELETTRA BEAMLINE 5.2R' +_diffrn_source.pdbx_synchrotron_site ELETTRA +_diffrn_source.pdbx_synchrotron_beamline 5.2R +_diffrn_source.pdbx_wavelength 1. +_diffrn_source.pdbx_wavelength_list ? +# +_reflns.entry_id 1B9C +_reflns.observed_criterion_sigma_I 0. +_reflns.observed_criterion_sigma_F ? +_reflns.d_resolution_low 30. +_reflns.d_resolution_high 2.37 +_reflns.number_obs 36746 +_reflns.number_all ? +_reflns.percent_possible_obs 83.9 +_reflns.pdbx_Rmerge_I_obs 0.0620000 +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_sigmaI 6.9 +_reflns.B_iso_Wilson_estimate ? +_reflns.pdbx_redundancy 4.6 +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +# +_reflns_shell.d_res_high 2.37 +_reflns_shell.d_res_low 2.64 +_reflns_shell.percent_possible_all 45.0 +_reflns_shell.Rmerge_I_obs 0.1460000 +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.meanI_over_sigI_obs 4.2 +_reflns_shell.pdbx_redundancy 3.9 +_reflns_shell.percent_possible_obs ? +_reflns_shell.number_unique_all ? +_reflns_shell.pdbx_diffrn_id ? +_reflns_shell.pdbx_ordinal 1 +# +_refine.entry_id 1B9C +_refine.ls_number_reflns_obs 33030 +_refine.ls_number_reflns_all ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 2 +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_d_res_low 30 +_refine.ls_d_res_high 2.4 +_refine.ls_percent_reflns_obs 89.9 +_refine.ls_R_factor_obs 0.2040000 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work 0.2040000 +_refine.ls_R_factor_R_free 0.2800000 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free 7 +_refine.ls_number_reflns_R_free ? +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.B_iso_mean ? +_refine.aniso_B[1][1] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[3][3] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][3] ? +_refine.solvent_model_details ? +_refine.solvent_model_param_ksol ? +_refine.solvent_model_param_bsol ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.details 'APPLIED DATA CUTOFF: F(CALC)/F (OBS) < = 3.5' +_refine.pdbx_starting_model 'PDB ENTRY 1GFL' +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_isotropic_thermal_model RESTRAINED +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.overall_SU_B ? +_refine.ls_redundancy_reflns_obs ? +_refine.B_iso_min ? +_refine.B_iso_max ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_overall_phase_error ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 7184 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 0 +_refine_hist.number_atoms_solvent 286 +_refine_hist.number_atoms_total 7470 +_refine_hist.d_res_high 2.4 +_refine_hist.d_res_low 30 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +x_bond_d 0.015 ? ? ? 'X-RAY DIFFRACTION' ? +x_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_deg 3.318 ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_dihedral_angle_d 28.48 ? ? ? 'X-RAY DIFFRACTION' ? +x_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_improper_angle_d 1.376 ? ? ? 'X-RAY DIFFRACTION' ? +x_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_mcbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? +x_mcangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? +x_scbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? +x_scangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_restr_ncs.dom_id 1 +_refine_ls_restr_ncs.ncs_model_details RESTRAINTS +_refine_ls_restr_ncs.rms_dev_position ? +_refine_ls_restr_ncs.weight_position ? +_refine_ls_restr_ncs.rms_dev_B_iso ? +_refine_ls_restr_ncs.weight_B_iso ? +_refine_ls_restr_ncs.pdbx_type . +_refine_ls_restr_ncs.pdbx_auth_asym_id . +_refine_ls_restr_ncs.pdbx_ens_id 1 +_refine_ls_restr_ncs.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_restr_ncs.pdbx_ordinal 1 +_refine_ls_restr_ncs.pdbx_number ? +_refine_ls_restr_ncs.pdbx_asym_id ? +_refine_ls_restr_ncs.pdbx_rms ? +_refine_ls_restr_ncs.pdbx_weight ? +# +loop_ +_struct_ncs_oper.id +_struct_ncs_oper.code +_struct_ncs_oper.details +_struct_ncs_oper.matrix[1][1] +_struct_ncs_oper.matrix[1][2] +_struct_ncs_oper.matrix[1][3] +_struct_ncs_oper.matrix[2][1] +_struct_ncs_oper.matrix[2][2] +_struct_ncs_oper.matrix[2][3] +_struct_ncs_oper.matrix[3][1] +_struct_ncs_oper.matrix[3][2] +_struct_ncs_oper.matrix[3][3] +_struct_ncs_oper.vector[1] +_struct_ncs_oper.vector[2] +_struct_ncs_oper.vector[3] +1 given ? -0.756601 -0.042557 -0.652490 -0.039778 -0.993036 0.110893 -0.652665 0.109857 0.749640 57.25790 62.82550 17.50840 +2 given ? -0.987420 -0.014388 -0.157461 0.009254 -0.999403 0.033287 -0.157846 0.031411 0.986964 27.38280 -0.23800 2.28000 +# +_struct_ncs_dom.id 1 +_struct_ncs_dom.pdbx_ens_id 1 +_struct_ncs_dom.details ? +# +_struct_ncs_ens.id 1 +_struct_ncs_ens.details ? +# +_database_PDB_matrix.entry_id 1B9C +_database_PDB_matrix.origx[1][1] 1.000000 +_database_PDB_matrix.origx[1][2] 0.000000 +_database_PDB_matrix.origx[1][3] 0.000000 +_database_PDB_matrix.origx[2][1] 0.000000 +_database_PDB_matrix.origx[2][2] 1.000000 +_database_PDB_matrix.origx[2][3] 0.000000 +_database_PDB_matrix.origx[3][1] 0.000000 +_database_PDB_matrix.origx[3][2] 0.000000 +_database_PDB_matrix.origx[3][3] 1.000000 +_database_PDB_matrix.origx_vector[1] 0.00000 +_database_PDB_matrix.origx_vector[2] 0.00000 +_database_PDB_matrix.origx_vector[3] 0.00000 +# +_struct.entry_id 1B9C +_struct.title 'Green Fluorescent Protein Mutant F99S, M153T and V163A' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 1B9C +_struct_keywords.pdbx_keywords 'LUMINESCENT PROTEIN' +_struct_keywords.text +'FLUORESCENT PROTEIN, CHROMOPHORE, GREEN FLUORESCENT PROTEIN, LUMINESCENCE, F99S M153T V163A MUTANT, LUMINESCENT PROTEIN' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 1 ? +C N N 1 ? +D N N 1 ? +E N N 2 ? +F N N 2 ? +G N N 2 ? +H N N 2 ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code GFP_AEQVI +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code ? +_struct_ref.pdbx_align_begin ? +_struct_ref.pdbx_db_accession P42212 +_struct_ref.pdbx_db_isoform ? +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 1B9C A 1 ? 236 ? P42212 1 ? 238 ? 1 238 +2 1 1B9C B 1 ? 236 ? P42212 1 ? 238 ? 1 238 +3 1 1B9C C 1 ? 236 ? P42212 1 ? 238 ? 1 238 +4 1 1B9C D 1 ? 236 ? P42212 1 ? 238 ? 1 238 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +1 1B9C CRO A 65 ? UNP P42212 SER 65 chromophore 66 1 +1 1B9C CRO A 65 ? UNP P42212 TYR 66 chromophore 66 2 +1 1B9C CRO A 65 ? UNP P42212 GLY 67 chromophore 66 3 +1 1B9C ALA A 1 ? UNP P42212 MET 1 'engineered mutation' 1 4 +1 1B9C SER A 97 ? UNP P42212 PHE 99 'engineered mutation' 99 5 +1 1B9C THR A 151 ? UNP P42212 MET 153 'engineered mutation' 153 6 +1 1B9C ALA A 161 ? UNP P42212 VAL 163 'engineered mutation' 163 7 +2 1B9C CRO B 65 ? UNP P42212 SER 65 chromophore 66 8 +2 1B9C CRO B 65 ? UNP P42212 TYR 66 chromophore 66 9 +2 1B9C CRO B 65 ? UNP P42212 GLY 67 chromophore 66 10 +2 1B9C ALA B 1 ? UNP P42212 MET 1 'engineered mutation' 1 11 +2 1B9C SER B 97 ? UNP P42212 PHE 99 'engineered mutation' 99 12 +2 1B9C THR B 151 ? UNP P42212 MET 153 'engineered mutation' 153 13 +2 1B9C ALA B 161 ? UNP P42212 VAL 163 'engineered mutation' 163 14 +3 1B9C CRO C 65 ? UNP P42212 SER 65 chromophore 66 15 +3 1B9C CRO C 65 ? UNP P42212 TYR 66 chromophore 66 16 +3 1B9C CRO C 65 ? UNP P42212 GLY 67 chromophore 66 17 +3 1B9C ALA C 1 ? UNP P42212 MET 1 'engineered mutation' 1 18 +3 1B9C SER C 97 ? UNP P42212 PHE 99 'engineered mutation' 99 19 +3 1B9C THR C 151 ? UNP P42212 MET 153 'engineered mutation' 153 20 +3 1B9C ALA C 161 ? UNP P42212 VAL 163 'engineered mutation' 163 21 +4 1B9C CRO D 65 ? UNP P42212 SER 65 chromophore 66 22 +4 1B9C CRO D 65 ? UNP P42212 TYR 66 chromophore 66 23 +4 1B9C CRO D 65 ? UNP P42212 GLY 67 chromophore 66 24 +4 1B9C ALA D 1 ? UNP P42212 MET 1 'engineered mutation' 1 25 +4 1B9C SER D 97 ? UNP P42212 PHE 99 'engineered mutation' 99 26 +4 1B9C THR D 151 ? UNP P42212 MET 153 'engineered mutation' 153 27 +4 1B9C ALA D 161 ? UNP P42212 VAL 163 'engineered mutation' 163 28 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details tetrameric +_pdbx_struct_assembly.oligomeric_count 4 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_struct_biol.id 1 +_struct_biol.pdbx_parent_biol_id ? +_struct_biol.details ? +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 GLU A 5 ? LEU A 7 ? GLU A 5 LEU A 7 5 ? 3 +HELX_P HELX_P2 2 TRP A 57 ? LEU A 60 ? TRP A 57 LEU A 60 5 ? 4 +HELX_P HELX_P3 3 GLN A 67 ? PHE A 69 ? GLN A 69 PHE A 71 5 ? 3 +HELX_P HELX_P4 4 PHE A 81 ? SER A 84 ? PHE A 83 SER A 86 1 ? 4 +HELX_P HELX_P5 5 GLU B 5 ? PHE B 8 ? GLU B 5 PHE B 8 5 ? 4 +HELX_P HELX_P6 6 TRP B 57 ? LEU B 60 ? TRP B 57 LEU B 60 1 ? 4 +HELX_P HELX_P7 7 GLN B 67 ? PHE B 69 ? GLN B 69 PHE B 71 5 ? 3 +HELX_P HELX_P8 8 PHE B 81 ? SER B 84 ? PHE B 83 SER B 86 1 ? 4 +HELX_P HELX_P9 9 GLU C 5 ? THR C 9 ? GLU C 5 THR C 9 5 ? 5 +HELX_P HELX_P10 10 TRP C 57 ? LEU C 60 ? TRP C 57 LEU C 60 5 ? 4 +HELX_P HELX_P11 11 GLN C 67 ? PHE C 69 ? GLN C 69 PHE C 71 5 ? 3 +HELX_P HELX_P12 12 ASP C 74 ? HIS C 79 ? ASP C 76 HIS C 81 5 ? 6 +HELX_P HELX_P13 13 PHE C 81 ? SER C 84 ? PHE C 83 SER C 86 1 ? 4 +HELX_P HELX_P14 14 GLU D 5 ? THR D 9 ? GLU D 5 THR D 9 5 ? 5 +HELX_P HELX_P15 15 GLN D 67 ? PHE D 69 ? GLN D 69 PHE D 71 5 ? 3 +HELX_P HELX_P16 16 ASP D 74 ? HIS D 79 ? ASP D 76 HIS D 81 5 ? 6 +HELX_P HELX_P17 17 PHE D 81 ? SER D 84 ? PHE D 83 SER D 86 1 ? 4 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +covale1 covale both ? A PHE 64 C ? ? ? 1_555 A CRO 65 N1 ? ? A PHE 64 A CRO 66 1_555 ? ? ? ? ? ? ? 1.322 ? ? +covale2 covale both ? A CRO 65 C3 ? ? ? 1_555 A VAL 66 N ? ? A CRO 66 A VAL 68 1_555 ? ? ? ? ? ? ? 1.341 ? ? +covale3 covale both ? B PHE 64 C ? ? ? 1_555 B CRO 65 N1 ? ? B PHE 64 B CRO 66 1_555 ? ? ? ? ? ? ? 1.328 ? ? +covale4 covale both ? B CRO 65 C3 ? ? ? 1_555 B VAL 66 N ? ? B CRO 66 B VAL 68 1_555 ? ? ? ? ? ? ? 1.316 ? ? +covale5 covale both ? C PHE 64 C ? ? ? 1_555 C CRO 65 N1 ? ? C PHE 64 C CRO 66 1_555 ? ? ? ? ? ? ? 1.357 ? ? +covale6 covale both ? C CRO 65 C3 ? ? ? 1_555 C VAL 66 N ? ? C CRO 66 C VAL 68 1_555 ? ? ? ? ? ? ? 1.329 ? ? +covale7 covale both ? D PHE 64 C ? ? ? 1_555 D CRO 65 N1 ? ? D PHE 64 D CRO 66 1_555 ? ? ? ? ? ? ? 1.344 ? ? +covale8 covale both ? D CRO 65 C3 ? ? ? 1_555 D VAL 66 N ? ? D CRO 66 D VAL 68 1_555 ? ? ? ? ? ? ? 1.304 ? ? +# +_struct_conn_type.id covale +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 CRO A 65 ? . . . . CRO A 66 ? 1_555 . . . . . . . 'THR, TYR, GLY' 1 CRO None Chromophore/chromophore-like +2 CRO B 65 ? . . . . CRO B 66 ? 1_555 . . . . . . . 'THR, TYR, GLY' 1 CRO None Chromophore/chromophore-like +3 CRO C 65 ? . . . . CRO C 66 ? 1_555 . . . . . . . 'THR, TYR, GLY' 1 CRO None Chromophore/chromophore-like +4 CRO D 65 ? . . . . CRO D 66 ? 1_555 . . . . . . . 'THR, TYR, GLY' 1 CRO None Chromophore/chromophore-like +# +loop_ +_struct_mon_prot_cis.pdbx_id +_struct_mon_prot_cis.label_comp_id +_struct_mon_prot_cis.label_seq_id +_struct_mon_prot_cis.label_asym_id +_struct_mon_prot_cis.label_alt_id +_struct_mon_prot_cis.pdbx_PDB_ins_code +_struct_mon_prot_cis.auth_comp_id +_struct_mon_prot_cis.auth_seq_id +_struct_mon_prot_cis.auth_asym_id +_struct_mon_prot_cis.pdbx_label_comp_id_2 +_struct_mon_prot_cis.pdbx_label_seq_id_2 +_struct_mon_prot_cis.pdbx_label_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 +_struct_mon_prot_cis.pdbx_auth_comp_id_2 +_struct_mon_prot_cis.pdbx_auth_seq_id_2 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_model_num +_struct_mon_prot_cis.pdbx_omega_angle +1 MET 86 A . ? MET 88 A PRO 87 A ? PRO 89 A 1 -1.49 +2 MET 86 B . ? MET 88 B PRO 87 B ? PRO 89 B 1 -6.31 +3 MET 86 C . ? MET 88 C PRO 87 C ? PRO 89 C 1 3.69 +4 MET 86 D . ? MET 88 D PRO 87 D ? PRO 89 D 1 0.10 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +A ? 12 ? +B ? 12 ? +C ? 12 ? +D ? 12 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? parallel +A 3 4 ? anti-parallel +A 4 5 ? anti-parallel +A 5 6 ? anti-parallel +A 6 7 ? anti-parallel +A 7 8 ? anti-parallel +A 8 9 ? anti-parallel +A 9 10 ? anti-parallel +A 10 11 ? anti-parallel +A 11 12 ? anti-parallel +B 1 2 ? anti-parallel +B 2 3 ? parallel +B 3 4 ? anti-parallel +B 4 5 ? anti-parallel +B 5 6 ? anti-parallel +B 6 7 ? anti-parallel +B 7 8 ? anti-parallel +B 8 9 ? anti-parallel +B 9 10 ? anti-parallel +B 10 11 ? anti-parallel +B 11 12 ? anti-parallel +C 1 2 ? anti-parallel +C 2 3 ? parallel +C 3 4 ? anti-parallel +C 4 5 ? anti-parallel +C 5 6 ? anti-parallel +C 6 7 ? anti-parallel +C 7 8 ? anti-parallel +C 8 9 ? anti-parallel +C 9 10 ? anti-parallel +C 10 11 ? anti-parallel +C 11 12 ? anti-parallel +D 1 2 ? anti-parallel +D 2 3 ? parallel +D 3 4 ? anti-parallel +D 4 5 ? anti-parallel +D 5 6 ? anti-parallel +D 6 7 ? anti-parallel +D 7 8 ? anti-parallel +D 8 9 ? anti-parallel +D 9 10 ? anti-parallel +D 10 11 ? anti-parallel +D 11 12 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 HIS A 25 ? ASP A 36 ? HIS A 25 ASP A 36 +A 2 VAL A 11 ? VAL A 22 ? VAL A 11 VAL A 22 +A 3 THR A 116 ? ILE A 126 ? THR A 118 ILE A 128 +A 4 ASN A 103 ? GLU A 113 ? ASN A 105 GLU A 115 +A 5 TYR A 90 ? PHE A 98 ? TYR A 92 PHE A 100 +A 6 VAL A 174 ? PRO A 185 ? VAL A 176 PRO A 187 +A 7 GLY A 158 ? ASN A 168 ? GLY A 160 ASN A 170 +A 8 HIS A 146 ? ASP A 153 ? HIS A 148 ASP A 155 +A 9 HIS A 197 ? SER A 206 ? HIS A 199 SER A 208 +A 10 HIS A 215 ? ALA A 225 ? HIS A 217 ALA A 227 +A 11 LYS A 41 ? CYS A 48 ? LYS A 41 CYS A 48 +A 12 VAL A 29 ? ASP A 36 ? VAL A 29 ASP A 36 +B 1 HIS B 25 ? ASP B 36 ? HIS B 25 ASP B 36 +B 2 VAL B 11 ? VAL B 22 ? VAL B 11 VAL B 22 +B 3 THR B 116 ? ILE B 126 ? THR B 118 ILE B 128 +B 4 ASN B 103 ? GLU B 113 ? ASN B 105 GLU B 115 +B 5 TYR B 90 ? PHE B 98 ? TYR B 92 PHE B 100 +B 6 VAL B 174 ? PRO B 185 ? VAL B 176 PRO B 187 +B 7 GLY B 158 ? ASN B 168 ? GLY B 160 ASN B 170 +B 8 HIS B 146 ? ASP B 153 ? HIS B 148 ASP B 155 +B 9 HIS B 197 ? SER B 206 ? HIS B 199 SER B 208 +B 10 HIS B 215 ? ALA B 225 ? HIS B 217 ALA B 227 +B 11 LYS B 41 ? CYS B 48 ? LYS B 41 CYS B 48 +B 12 VAL B 29 ? ASP B 36 ? VAL B 29 ASP B 36 +C 1 HIS C 25 ? ASP C 36 ? HIS C 25 ASP C 36 +C 2 VAL C 11 ? VAL C 22 ? VAL C 11 VAL C 22 +C 3 THR C 116 ? ILE C 126 ? THR C 118 ILE C 128 +C 4 ASN C 103 ? GLU C 113 ? ASN C 105 GLU C 115 +C 5 TYR C 90 ? PHE C 98 ? TYR C 92 PHE C 100 +C 6 VAL C 174 ? PRO C 185 ? VAL C 176 PRO C 187 +C 7 GLY C 158 ? ASN C 168 ? GLY C 160 ASN C 170 +C 8 SER C 145 ? ASP C 153 ? SER C 147 ASP C 155 +C 9 HIS C 197 ? SER C 206 ? HIS C 199 SER C 208 +C 10 HIS C 215 ? ALA C 225 ? HIS C 217 ALA C 227 +C 11 LYS C 41 ? CYS C 48 ? LYS C 41 CYS C 48 +C 12 VAL C 29 ? ASP C 36 ? VAL C 29 ASP C 36 +D 1 HIS D 25 ? ASP D 36 ? HIS D 25 ASP D 36 +D 2 VAL D 11 ? VAL D 22 ? VAL D 11 VAL D 22 +D 3 THR D 116 ? ILE D 126 ? THR D 118 ILE D 128 +D 4 ASN D 103 ? GLU D 113 ? ASN D 105 GLU D 115 +D 5 TYR D 90 ? PHE D 98 ? TYR D 92 PHE D 100 +D 6 VAL D 174 ? PRO D 185 ? VAL D 176 PRO D 187 +D 7 GLY D 158 ? ASN D 168 ? GLY D 160 ASN D 170 +D 8 SER D 145 ? ASP D 153 ? SER D 147 ASP D 155 +D 9 HIS D 197 ? SER D 206 ? HIS D 199 SER D 208 +D 10 HIS D 215 ? ALA D 225 ? HIS D 217 ALA D 227 +D 11 LYS D 41 ? CYS D 48 ? LYS D 41 CYS D 48 +D 12 VAL D 29 ? ASP D 36 ? VAL D 29 ASP D 36 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 O HIS A 25 ? O HIS A 25 N VAL A 22 ? N VAL A 22 +A 2 3 O LEU A 15 ? O LEU A 15 N LEU A 117 ? N LEU A 119 +A 3 4 O THR A 116 ? O THR A 118 N GLU A 113 ? N GLU A 115 +A 4 5 O TYR A 104 ? O TYR A 106 N ILE A 96 ? N ILE A 98 +A 5 6 O VAL A 91 ? O VAL A 93 N THR A 184 ? N THR A 186 +A 6 7 O GLN A 175 ? O GLN A 177 N HIS A 167 ? N HIS A 169 +A 7 8 O GLY A 158 ? O GLY A 160 N ASP A 153 ? N ASP A 155 +A 8 9 O HIS A 146 ? O HIS A 148 N THR A 201 ? N THR A 203 +A 9 10 O TYR A 198 ? O TYR A 200 N ALA A 225 ? N ALA A 227 +A 10 11 O MET A 216 ? O MET A 218 N PHE A 46 ? N PHE A 46 +A 11 12 O LYS A 41 ? O LYS A 41 N ASP A 36 ? N ASP A 36 +B 1 2 O HIS B 25 ? O HIS B 25 N VAL B 22 ? N VAL B 22 +B 2 3 O LEU B 15 ? O LEU B 15 N LEU B 117 ? N LEU B 119 +B 3 4 O THR B 116 ? O THR B 118 N GLU B 113 ? N GLU B 115 +B 4 5 O TYR B 104 ? O TYR B 106 N ILE B 96 ? N ILE B 98 +B 5 6 O VAL B 91 ? O VAL B 93 N THR B 184 ? N THR B 186 +B 6 7 O GLN B 175 ? O GLN B 177 N HIS B 167 ? N HIS B 169 +B 7 8 O GLY B 158 ? O GLY B 160 N ASP B 153 ? N ASP B 155 +B 8 9 O HIS B 146 ? O HIS B 148 N THR B 201 ? N THR B 203 +B 9 10 O TYR B 198 ? O TYR B 200 N ALA B 225 ? N ALA B 227 +B 10 11 O MET B 216 ? O MET B 218 N PHE B 46 ? N PHE B 46 +B 11 12 O LYS B 41 ? O LYS B 41 N ASP B 36 ? N ASP B 36 +C 1 2 O HIS C 25 ? O HIS C 25 N VAL C 22 ? N VAL C 22 +C 2 3 O LEU C 15 ? O LEU C 15 N LEU C 117 ? N LEU C 119 +C 3 4 O THR C 116 ? O THR C 118 N GLU C 113 ? N GLU C 115 +C 4 5 O TYR C 104 ? O TYR C 106 N ILE C 96 ? N ILE C 98 +C 5 6 O VAL C 91 ? O VAL C 93 N THR C 184 ? N THR C 186 +C 6 7 O GLN C 175 ? O GLN C 177 N HIS C 167 ? N HIS C 169 +C 7 8 O GLY C 158 ? O GLY C 160 N ASP C 153 ? N ASP C 155 +C 8 9 O HIS C 146 ? O HIS C 148 N THR C 201 ? N THR C 203 +C 9 10 O TYR C 198 ? O TYR C 200 N ALA C 225 ? N ALA C 227 +C 10 11 O MET C 216 ? O MET C 218 N PHE C 46 ? N PHE C 46 +C 11 12 O LYS C 41 ? O LYS C 41 N ASP C 36 ? N ASP C 36 +D 1 2 O HIS D 25 ? O HIS D 25 N VAL D 22 ? N VAL D 22 +D 2 3 O LEU D 15 ? O LEU D 15 N LEU D 117 ? N LEU D 119 +D 3 4 O THR D 116 ? O THR D 118 N GLU D 113 ? N GLU D 115 +D 4 5 O TYR D 104 ? O TYR D 106 N ILE D 96 ? N ILE D 98 +D 5 6 O VAL D 91 ? O VAL D 93 N THR D 184 ? N THR D 186 +D 6 7 O GLN D 175 ? O GLN D 177 N HIS D 167 ? N HIS D 169 +D 7 8 O GLY D 158 ? O GLY D 160 N ASP D 153 ? N ASP D 155 +D 8 9 O HIS D 146 ? O HIS D 148 N THR D 201 ? N THR D 203 +D 9 10 O TYR D 198 ? O TYR D 200 N ALA D 225 ? N ALA D 227 +D 10 11 O MET D 216 ? O MET D 218 N PHE D 46 ? N PHE D 46 +D 11 12 O LYS D 41 ? O LYS D 41 N ASP D 36 ? N ASP D 36 +# +_pdbx_entry_details.entry_id 1B9C +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details +;THE FLUOROPHORE IS FORMED BY SER 65, TYR 66 AND GLY 67. THE +CARBONYL CARBON OF TYR 66 IS BONDED TO THE NITROGEN OF GLY +67. THE CARBONYL OXYGEN IS DELETED. THE SIDE CHAIN OF TYR +66 IS DEHYDROGENATED. +; +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +_pdbx_validate_close_contact.id 1 +_pdbx_validate_close_contact.PDB_model_num 1 +_pdbx_validate_close_contact.auth_atom_id_1 O +_pdbx_validate_close_contact.auth_asym_id_1 A +_pdbx_validate_close_contact.auth_comp_id_1 HOH +_pdbx_validate_close_contact.auth_seq_id_1 269 +_pdbx_validate_close_contact.PDB_ins_code_1 ? +_pdbx_validate_close_contact.label_alt_id_1 ? +_pdbx_validate_close_contact.auth_atom_id_2 O +_pdbx_validate_close_contact.auth_asym_id_2 A +_pdbx_validate_close_contact.auth_comp_id_2 HOH +_pdbx_validate_close_contact.auth_seq_id_2 273 +_pdbx_validate_close_contact.PDB_ins_code_2 ? +_pdbx_validate_close_contact.label_alt_id_2 ? +_pdbx_validate_close_contact.dist 2.12 +# +loop_ +_pdbx_validate_rmsd_bond.id +_pdbx_validate_rmsd_bond.PDB_model_num +_pdbx_validate_rmsd_bond.auth_atom_id_1 +_pdbx_validate_rmsd_bond.auth_asym_id_1 +_pdbx_validate_rmsd_bond.auth_comp_id_1 +_pdbx_validate_rmsd_bond.auth_seq_id_1 +_pdbx_validate_rmsd_bond.PDB_ins_code_1 +_pdbx_validate_rmsd_bond.label_alt_id_1 +_pdbx_validate_rmsd_bond.auth_atom_id_2 +_pdbx_validate_rmsd_bond.auth_asym_id_2 +_pdbx_validate_rmsd_bond.auth_comp_id_2 +_pdbx_validate_rmsd_bond.auth_seq_id_2 +_pdbx_validate_rmsd_bond.PDB_ins_code_2 +_pdbx_validate_rmsd_bond.label_alt_id_2 +_pdbx_validate_rmsd_bond.bond_value +_pdbx_validate_rmsd_bond.bond_target_value +_pdbx_validate_rmsd_bond.bond_deviation +_pdbx_validate_rmsd_bond.bond_standard_deviation +_pdbx_validate_rmsd_bond.linker_flag +1 1 NE2 A HIS 25 ? ? CD2 A HIS 25 ? ? 1.302 1.373 -0.071 0.011 N +2 1 NE2 A HIS 77 ? ? CD2 A HIS 77 ? ? 1.305 1.373 -0.068 0.011 N +3 1 NE2 A HIS 81 ? ? CD2 A HIS 81 ? ? 1.298 1.373 -0.075 0.011 N +4 1 NE2 A HIS 139 ? ? CD2 A HIS 139 ? ? 1.306 1.373 -0.067 0.011 N +5 1 NE2 A HIS 169 ? ? CD2 A HIS 169 ? ? 1.294 1.373 -0.079 0.011 N +6 1 NE2 A HIS 181 ? ? CD2 A HIS 181 ? ? 1.300 1.373 -0.073 0.011 N +7 1 NE2 A HIS 217 ? ? CD2 A HIS 217 ? ? 1.300 1.373 -0.073 0.011 N +8 1 NE2 B HIS 25 ? ? CD2 B HIS 25 ? ? 1.306 1.373 -0.067 0.011 N +9 1 NE2 B HIS 77 ? ? CD2 B HIS 77 ? ? 1.286 1.373 -0.087 0.011 N +10 1 NE2 B HIS 81 ? ? CD2 B HIS 81 ? ? 1.301 1.373 -0.072 0.011 N +11 1 NE2 B HIS 139 ? ? CD2 B HIS 139 ? ? 1.297 1.373 -0.076 0.011 N +12 1 NE2 B HIS 148 ? ? CD2 B HIS 148 ? ? 1.296 1.373 -0.077 0.011 N +13 1 NE2 B HIS 169 ? ? CD2 B HIS 169 ? ? 1.304 1.373 -0.069 0.011 N +14 1 NE2 B HIS 181 ? ? CD2 B HIS 181 ? ? 1.296 1.373 -0.077 0.011 N +15 1 NE2 B HIS 199 ? ? CD2 B HIS 199 ? ? 1.305 1.373 -0.068 0.011 N +16 1 NE2 B HIS 217 ? ? CD2 B HIS 217 ? ? 1.301 1.373 -0.072 0.011 N +17 1 NE2 C HIS 77 ? ? CD2 C HIS 77 ? ? 1.295 1.373 -0.078 0.011 N +18 1 NE2 C HIS 81 ? ? CD2 C HIS 81 ? ? 1.292 1.373 -0.081 0.011 N +19 1 NE2 C HIS 169 ? ? CD2 C HIS 169 ? ? 1.301 1.373 -0.072 0.011 N +20 1 NE2 C HIS 181 ? ? CD2 C HIS 181 ? ? 1.303 1.373 -0.070 0.011 N +21 1 NE2 C HIS 199 ? ? CD2 C HIS 199 ? ? 1.297 1.373 -0.076 0.011 N +22 1 CA C SER 208 ? ? CB C SER 208 ? ? 1.432 1.525 -0.093 0.015 N +23 1 NE2 C HIS 217 ? ? CD2 C HIS 217 ? ? 1.304 1.373 -0.069 0.011 N +24 1 NE2 D HIS 77 ? ? CD2 D HIS 77 ? ? 1.292 1.373 -0.081 0.011 N +25 1 NE2 D HIS 81 ? ? CD2 D HIS 81 ? ? 1.305 1.373 -0.068 0.011 N +26 1 NE2 D HIS 181 ? ? CD2 D HIS 181 ? ? 1.292 1.373 -0.081 0.011 N +27 1 NE2 D HIS 199 ? ? CD2 D HIS 199 ? ? 1.303 1.373 -0.070 0.011 N +28 1 NE2 D HIS 217 ? ? CD2 D HIS 217 ? ? 1.299 1.373 -0.074 0.011 N +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 CD1 A TRP 57 ? ? CG A TRP 57 ? ? CD2 A TRP 57 ? ? 114.20 106.30 7.90 0.80 N +2 1 CE2 A TRP 57 ? ? CD2 A TRP 57 ? ? CG A TRP 57 ? ? 100.73 107.30 -6.57 0.80 N +3 1 CB A TYR 106 ? ? CG A TYR 106 ? ? CD2 A TYR 106 ? ? 116.63 121.00 -4.37 0.60 N +4 1 NE A ARG 122 ? ? CZ A ARG 122 ? ? NH1 A ARG 122 ? ? 123.98 120.30 3.68 0.50 N +5 1 NE A ARG 122 ? ? CZ A ARG 122 ? ? NH2 A ARG 122 ? ? 117.22 120.30 -3.08 0.50 N +6 1 CA A GLN 184 ? ? CB A GLN 184 ? ? CG A GLN 184 ? ? 129.93 113.40 16.53 2.20 N +7 1 NE A ARG 215 ? ? CZ A ARG 215 ? ? NH1 A ARG 215 ? ? 124.55 120.30 4.25 0.50 N +8 1 CB B TYR 39 ? ? CG B TYR 39 ? ? CD1 B TYR 39 ? ? 117.05 121.00 -3.95 0.60 N +9 1 CD1 B TRP 57 ? ? CG B TRP 57 ? ? CD2 B TRP 57 ? ? 113.16 106.30 6.86 0.80 N +10 1 CE2 B TRP 57 ? ? CD2 B TRP 57 ? ? CG B TRP 57 ? ? 100.59 107.30 -6.71 0.80 N +11 1 CG B TRP 57 ? ? CD2 B TRP 57 ? ? CE3 B TRP 57 ? ? 139.49 133.90 5.59 0.90 N +12 1 CB B TYR 106 ? ? CG B TYR 106 ? ? CD2 B TYR 106 ? ? 116.80 121.00 -4.20 0.60 N +13 1 CB B TYR 145 ? ? CG B TYR 145 ? ? CD1 B TYR 145 ? ? 117.19 121.00 -3.81 0.60 N +14 1 NE B ARG 215 ? ? CZ B ARG 215 ? ? NH1 B ARG 215 ? ? 126.47 120.30 6.17 0.50 N +15 1 CA C LEU 18 ? ? CB C LEU 18 ? ? CG C LEU 18 ? ? 130.14 115.30 14.84 2.30 N +16 1 CA C THR 43 ? ? CB C THR 43 ? ? OG1 C THR 43 ? ? 93.78 109.00 -15.22 2.10 N +17 1 CA C THR 43 ? ? CB C THR 43 ? ? CG2 C THR 43 ? ? 123.58 112.40 11.18 1.40 N +18 1 CD1 C TRP 57 ? ? CG C TRP 57 ? ? CD2 C TRP 57 ? ? 114.48 106.30 8.18 0.80 N +19 1 CG C TRP 57 ? ? CD1 C TRP 57 ? ? NE1 C TRP 57 ? ? 104.03 110.10 -6.07 1.00 N +20 1 CE2 C TRP 57 ? ? CD2 C TRP 57 ? ? CG C TRP 57 ? ? 100.07 107.30 -7.23 0.80 N +21 1 NE C ARG 96 ? ? CZ C ARG 96 ? ? NH1 C ARG 96 ? ? 124.47 120.30 4.17 0.50 N +22 1 NE C ARG 96 ? ? CZ C ARG 96 ? ? NH2 C ARG 96 ? ? 117.02 120.30 -3.28 0.50 N +23 1 N C LYS 107 ? ? CA C LYS 107 ? ? C C LYS 107 ? ? 93.51 111.00 -17.49 2.70 N +24 1 NE C ARG 109 ? ? CZ C ARG 109 ? ? NH2 C ARG 109 ? ? 115.82 120.30 -4.48 0.50 N +25 1 N C ARG 109 ? ? CA C ARG 109 ? ? C C ARG 109 ? ? 94.58 111.00 -16.42 2.70 N +26 1 CA C ASP 117 ? ? CB C ASP 117 ? ? CG C ASP 117 ? ? 128.16 113.40 14.76 2.20 N +27 1 CB C HIS 181 ? ? CG C HIS 181 ? ? CD2 C HIS 181 ? ? 119.48 129.70 -10.22 1.60 N +28 1 N C SER 208 ? ? CA C SER 208 ? ? CB C SER 208 ? ? 100.61 110.50 -9.89 1.50 N +29 1 CD C ARG 215 ? ? NE C ARG 215 ? ? CZ C ARG 215 ? ? 142.04 123.60 18.44 1.40 N +30 1 NE C ARG 215 ? ? CZ C ARG 215 ? ? NH1 C ARG 215 ? ? 130.38 120.30 10.08 0.50 N +31 1 NE C ARG 215 ? ? CZ C ARG 215 ? ? NH2 C ARG 215 ? ? 111.00 120.30 -9.30 0.50 N +32 1 CA D LEU 18 ? ? CB D LEU 18 ? ? CG D LEU 18 ? ? 132.80 115.30 17.50 2.30 N +33 1 CA D THR 43 ? ? CB D THR 43 ? ? CG2 D THR 43 ? ? 121.05 112.40 8.65 1.40 N +34 1 CA D LEU 53 ? ? CB D LEU 53 ? ? CG D LEU 53 ? ? 129.23 115.30 13.93 2.30 N +35 1 CD1 D TRP 57 ? ? CG D TRP 57 ? ? CD2 D TRP 57 ? ? 114.18 106.30 7.88 0.80 N +36 1 CE2 D TRP 57 ? ? CD2 D TRP 57 ? ? CG D TRP 57 ? ? 100.62 107.30 -6.68 0.80 N +37 1 CA D VAL 68 ? ? CB D VAL 68 ? ? CG1 D VAL 68 ? ? 101.76 110.90 -9.14 1.50 N +38 1 CA D MET 78 ? ? CB D MET 78 ? ? CG D MET 78 ? ? 125.39 113.30 12.09 1.70 N +39 1 NE D ARG 109 ? ? CZ D ARG 109 ? ? NH2 D ARG 109 ? ? 115.41 120.30 -4.89 0.50 N +40 1 N D ARG 109 ? ? CA D ARG 109 ? ? C D ARG 109 ? ? 94.07 111.00 -16.93 2.70 N +41 1 CB D HIS 181 ? ? CG D HIS 181 ? ? CD2 D HIS 181 ? ? 118.56 129.70 -11.14 1.60 N +42 1 CD D ARG 215 ? ? NE D ARG 215 ? ? CZ D ARG 215 ? ? 140.30 123.60 16.70 1.40 N +43 1 NE D ARG 215 ? ? CZ D ARG 215 ? ? NH1 D ARG 215 ? ? 128.93 120.30 8.63 0.50 N +44 1 NE D ARG 215 ? ? CZ D ARG 215 ? ? NH2 D ARG 215 ? ? 111.91 120.30 -8.39 0.50 N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 ASP A 21 ? ? -161.24 105.21 +2 1 GLN A 69 ? ? -53.80 -4.74 +3 1 MET A 78 ? ? -99.07 32.30 +4 1 ARG A 109 ? ? -160.42 115.50 +5 1 ASN A 198 ? ? -40.54 105.09 +6 1 ASP B 76 ? ? -53.16 -6.74 +7 1 ASP B 102 ? ? 63.92 -22.55 +8 1 ASP B 103 ? ? -95.68 -153.28 +9 1 ASN B 198 ? ? -40.63 104.87 +10 1 ASP C 21 ? ? -162.84 112.26 +11 1 ASN C 23 ? ? 51.24 13.89 +12 1 ASP C 103 ? ? -151.36 -152.04 +13 1 HIS C 139 ? ? 38.78 44.54 +14 1 ASN C 146 ? ? -102.52 -169.19 +15 1 TYR C 151 ? ? -67.85 96.37 +16 1 ASN C 159 ? ? 38.46 42.51 +17 1 GLN C 184 ? ? -162.48 117.33 +18 1 ASN C 198 ? ? -45.82 106.17 +19 1 ASP D 21 ? ? -163.25 111.05 +20 1 ASN D 23 ? ? 54.91 17.63 +21 1 GLN D 69 ? ? -55.57 -5.20 +22 1 ALA D 87 ? ? -65.20 1.31 +23 1 ASP D 102 ? ? 57.68 15.65 +24 1 ASP D 103 ? ? -145.34 -141.43 +25 1 HIS D 139 ? ? 36.94 45.75 +26 1 ASN D 146 ? ? -103.56 -166.46 +27 1 ASN D 198 ? ? -43.20 106.40 +# +_pdbx_validate_peptide_omega.id 1 +_pdbx_validate_peptide_omega.PDB_model_num 1 +_pdbx_validate_peptide_omega.auth_comp_id_1 GLY +_pdbx_validate_peptide_omega.auth_asym_id_1 A +_pdbx_validate_peptide_omega.auth_seq_id_1 191 +_pdbx_validate_peptide_omega.PDB_ins_code_1 ? +_pdbx_validate_peptide_omega.label_alt_id_1 ? +_pdbx_validate_peptide_omega.auth_comp_id_2 PRO +_pdbx_validate_peptide_omega.auth_asym_id_2 A +_pdbx_validate_peptide_omega.auth_seq_id_2 192 +_pdbx_validate_peptide_omega.PDB_ins_code_2 ? +_pdbx_validate_peptide_omega.label_alt_id_2 ? +_pdbx_validate_peptide_omega.omega -135.30 +# +loop_ +_pdbx_struct_mod_residue.id +_pdbx_struct_mod_residue.label_asym_id +_pdbx_struct_mod_residue.label_comp_id +_pdbx_struct_mod_residue.label_seq_id +_pdbx_struct_mod_residue.auth_asym_id +_pdbx_struct_mod_residue.auth_comp_id +_pdbx_struct_mod_residue.auth_seq_id +_pdbx_struct_mod_residue.PDB_ins_code +_pdbx_struct_mod_residue.parent_comp_id +_pdbx_struct_mod_residue.details +1 A CRO 65 A CRO 66 ? GLY ? +2 A CRO 65 A CRO 66 ? TYR ? +3 A CRO 65 A CRO 66 ? GLY ? +4 B CRO 65 B CRO 66 ? GLY ? +5 B CRO 65 B CRO 66 ? TYR ? +6 B CRO 65 B CRO 66 ? GLY ? +7 C CRO 65 C CRO 66 ? GLY ? +8 C CRO 65 C CRO 66 ? TYR ? +9 C CRO 65 C CRO 66 ? GLY ? +10 D CRO 65 D CRO 66 ? GLY ? +11 D CRO 65 D CRO 66 ? TYR ? +12 D CRO 65 D CRO 66 ? GLY ? +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A ALA 1 ? A ALA 1 +2 1 Y 1 A SER 2 ? A SER 2 +3 1 Y 1 A LYS 3 ? A LYS 3 +4 1 Y 1 A HIS 231 ? A HIS 229 +5 1 Y 1 A GLY 232 ? A GLY 230 +6 1 Y 1 A MET 233 ? A MET 231 +7 1 Y 1 A ASP 234 ? A ASP 232 +8 1 Y 1 A GLU 235 ? A GLU 233 +9 1 Y 1 A LEU 236 ? A LEU 234 +10 1 Y 1 A TYR 237 ? A TYR 235 +11 1 Y 1 A LYS 238 ? A LYS 236 +12 1 Y 1 B ALA 1 ? B ALA 1 +13 1 Y 1 B SER 2 ? B SER 2 +14 1 Y 1 B LYS 3 ? B LYS 3 +15 1 Y 1 B HIS 231 ? B HIS 229 +16 1 Y 1 B GLY 232 ? B GLY 230 +17 1 Y 1 B MET 233 ? B MET 231 +18 1 Y 1 B ASP 234 ? B ASP 232 +19 1 Y 1 B GLU 235 ? B GLU 233 +20 1 Y 1 B LEU 236 ? B LEU 234 +21 1 Y 1 B TYR 237 ? B TYR 235 +22 1 Y 1 B LYS 238 ? B LYS 236 +23 1 Y 1 C ALA 1 ? C ALA 1 +24 1 Y 1 C SER 2 ? C SER 2 +25 1 Y 1 C LYS 3 ? C LYS 3 +26 1 Y 1 C HIS 231 ? C HIS 229 +27 1 Y 1 C GLY 232 ? C GLY 230 +28 1 Y 1 C MET 233 ? C MET 231 +29 1 Y 1 C ASP 234 ? C ASP 232 +30 1 Y 1 C GLU 235 ? C GLU 233 +31 1 Y 1 C LEU 236 ? C LEU 234 +32 1 Y 1 C TYR 237 ? C TYR 235 +33 1 Y 1 C LYS 238 ? C LYS 236 +34 1 Y 1 D ALA 1 ? D ALA 1 +35 1 Y 1 D SER 2 ? D SER 2 +36 1 Y 1 D LYS 3 ? D LYS 3 +37 1 Y 1 D HIS 231 ? D HIS 229 +38 1 Y 1 D GLY 232 ? D GLY 230 +39 1 Y 1 D MET 233 ? D MET 231 +40 1 Y 1 D ASP 234 ? D ASP 232 +41 1 Y 1 D GLU 235 ? D GLU 233 +42 1 Y 1 D LEU 236 ? D LEU 234 +43 1 Y 1 D TYR 237 ? D TYR 235 +44 1 Y 1 D LYS 238 ? D LYS 236 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CRO N1 N N N 74 +CRO CA1 C N R 75 +CRO CB1 C N R 76 +CRO CG1 C N N 77 +CRO OG1 O N N 78 +CRO C1 C N N 79 +CRO N2 N N N 80 +CRO N3 N N N 81 +CRO C2 C N N 82 +CRO O2 O N N 83 +CRO CA2 C N N 84 +CRO CA3 C N N 85 +CRO C3 C N N 86 +CRO O3 O N N 87 +CRO CB2 C N N 88 +CRO CG2 C Y N 89 +CRO CD1 C Y N 90 +CRO CD2 C Y N 91 +CRO CE1 C Y N 92 +CRO CE2 C Y N 93 +CRO CZ C Y N 94 +CRO OH O N N 95 +CRO OXT O N N 96 +CRO H H N N 97 +CRO H2 H N N 98 +CRO HA1 H N N 99 +CRO HB1 H N N 100 +CRO HG11 H N N 101 +CRO HG12 H N N 102 +CRO HG13 H N N 103 +CRO HOG1 H N N 104 +CRO HA31 H N N 105 +CRO HA32 H N N 106 +CRO HXT H N N 107 +CRO HB2 H N N 108 +CRO HD1 H N N 109 +CRO HD2 H N N 110 +CRO HE1 H N N 111 +CRO HE2 H N N 112 +CRO HOH H N N 113 +CYS N N N N 114 +CYS CA C N R 115 +CYS C C N N 116 +CYS O O N N 117 +CYS CB C N N 118 +CYS SG S N N 119 +CYS OXT O N N 120 +CYS H H N N 121 +CYS H2 H N N 122 +CYS HA H N N 123 +CYS HB2 H N N 124 +CYS HB3 H N N 125 +CYS HG H N N 126 +CYS HXT H N N 127 +GLN N N N N 128 +GLN CA C N S 129 +GLN C C N N 130 +GLN O O N N 131 +GLN CB C N N 132 +GLN CG C N N 133 +GLN CD C N N 134 +GLN OE1 O N N 135 +GLN NE2 N N N 136 +GLN OXT O N N 137 +GLN H H N N 138 +GLN H2 H N N 139 +GLN HA H N N 140 +GLN HB2 H N N 141 +GLN HB3 H N N 142 +GLN HG2 H N N 143 +GLN HG3 H N N 144 +GLN HE21 H N N 145 +GLN HE22 H N N 146 +GLN HXT H N N 147 +GLU N N N N 148 +GLU CA C N S 149 +GLU C C N N 150 +GLU O O N N 151 +GLU CB C N N 152 +GLU CG C N N 153 +GLU CD C N N 154 +GLU OE1 O N N 155 +GLU OE2 O N N 156 +GLU OXT O N N 157 +GLU H H N N 158 +GLU H2 H N N 159 +GLU HA H N N 160 +GLU HB2 H N N 161 +GLU HB3 H N N 162 +GLU HG2 H N N 163 +GLU HG3 H N N 164 +GLU HE2 H N N 165 +GLU HXT H N N 166 +GLY N N N N 167 +GLY CA C N N 168 +GLY C C N N 169 +GLY O O N N 170 +GLY OXT O N N 171 +GLY H H N N 172 +GLY H2 H N N 173 +GLY HA2 H N N 174 +GLY HA3 H N N 175 +GLY HXT H N N 176 +HIS N N N N 177 +HIS CA C N S 178 +HIS C C N N 179 +HIS O O N N 180 +HIS CB C N N 181 +HIS CG C Y N 182 +HIS ND1 N Y N 183 +HIS CD2 C Y N 184 +HIS CE1 C Y N 185 +HIS NE2 N Y N 186 +HIS OXT O N N 187 +HIS H H N N 188 +HIS H2 H N N 189 +HIS HA H N N 190 +HIS HB2 H N N 191 +HIS HB3 H N N 192 +HIS HD1 H N N 193 +HIS HD2 H N N 194 +HIS HE1 H N N 195 +HIS HE2 H N N 196 +HIS HXT H N N 197 +HOH O O N N 198 +HOH H1 H N N 199 +HOH H2 H N N 200 +ILE N N N N 201 +ILE CA C N S 202 +ILE C C N N 203 +ILE O O N N 204 +ILE CB C N S 205 +ILE CG1 C N N 206 +ILE CG2 C N N 207 +ILE CD1 C N N 208 +ILE OXT O N N 209 +ILE H H N N 210 +ILE H2 H N N 211 +ILE HA H N N 212 +ILE HB H N N 213 +ILE HG12 H N N 214 +ILE HG13 H N N 215 +ILE HG21 H N N 216 +ILE HG22 H N N 217 +ILE HG23 H N N 218 +ILE HD11 H N N 219 +ILE HD12 H N N 220 +ILE HD13 H N N 221 +ILE HXT H N N 222 +LEU N N N N 223 +LEU CA C N S 224 +LEU C C N N 225 +LEU O O N N 226 +LEU CB C N N 227 +LEU CG C N N 228 +LEU CD1 C N N 229 +LEU CD2 C N N 230 +LEU OXT O N N 231 +LEU H H N N 232 +LEU H2 H N N 233 +LEU HA H N N 234 +LEU HB2 H N N 235 +LEU HB3 H N N 236 +LEU HG H N N 237 +LEU HD11 H N N 238 +LEU HD12 H N N 239 +LEU HD13 H N N 240 +LEU HD21 H N N 241 +LEU HD22 H N N 242 +LEU HD23 H N N 243 +LEU HXT H N N 244 +LYS N N N N 245 +LYS CA C N S 246 +LYS C C N N 247 +LYS O O N N 248 +LYS CB C N N 249 +LYS CG C N N 250 +LYS CD C N N 251 +LYS CE C N N 252 +LYS NZ N N N 253 +LYS OXT O N N 254 +LYS H H N N 255 +LYS H2 H N N 256 +LYS HA H N N 257 +LYS HB2 H N N 258 +LYS HB3 H N N 259 +LYS HG2 H N N 260 +LYS HG3 H N N 261 +LYS HD2 H N N 262 +LYS HD3 H N N 263 +LYS HE2 H N N 264 +LYS HE3 H N N 265 +LYS HZ1 H N N 266 +LYS HZ2 H N N 267 +LYS HZ3 H N N 268 +LYS HXT H N N 269 +MET N N N N 270 +MET CA C N S 271 +MET C C N N 272 +MET O O N N 273 +MET CB C N N 274 +MET CG C N N 275 +MET SD S N N 276 +MET CE C N N 277 +MET OXT O N N 278 +MET H H N N 279 +MET H2 H N N 280 +MET HA H N N 281 +MET HB2 H N N 282 +MET HB3 H N N 283 +MET HG2 H N N 284 +MET HG3 H N N 285 +MET HE1 H N N 286 +MET HE2 H N N 287 +MET HE3 H N N 288 +MET HXT H N N 289 +PHE N N N N 290 +PHE CA C N S 291 +PHE C C N N 292 +PHE O O N N 293 +PHE CB C N N 294 +PHE CG C Y N 295 +PHE CD1 C Y N 296 +PHE CD2 C Y N 297 +PHE CE1 C Y N 298 +PHE CE2 C Y N 299 +PHE CZ C Y N 300 +PHE OXT O N N 301 +PHE H H N N 302 +PHE H2 H N N 303 +PHE HA H N N 304 +PHE HB2 H N N 305 +PHE HB3 H N N 306 +PHE HD1 H N N 307 +PHE HD2 H N N 308 +PHE HE1 H N N 309 +PHE HE2 H N N 310 +PHE HZ H N N 311 +PHE HXT H N N 312 +PRO N N N N 313 +PRO CA C N S 314 +PRO C C N N 315 +PRO O O N N 316 +PRO CB C N N 317 +PRO CG C N N 318 +PRO CD C N N 319 +PRO OXT O N N 320 +PRO H H N N 321 +PRO HA H N N 322 +PRO HB2 H N N 323 +PRO HB3 H N N 324 +PRO HG2 H N N 325 +PRO HG3 H N N 326 +PRO HD2 H N N 327 +PRO HD3 H N N 328 +PRO HXT H N N 329 +SER N N N N 330 +SER CA C N S 331 +SER C C N N 332 +SER O O N N 333 +SER CB C N N 334 +SER OG O N N 335 +SER OXT O N N 336 +SER H H N N 337 +SER H2 H N N 338 +SER HA H N N 339 +SER HB2 H N N 340 +SER HB3 H N N 341 +SER HG H N N 342 +SER HXT H N N 343 +THR N N N N 344 +THR CA C N S 345 +THR C C N N 346 +THR O O N N 347 +THR CB C N R 348 +THR OG1 O N N 349 +THR CG2 C N N 350 +THR OXT O N N 351 +THR H H N N 352 +THR H2 H N N 353 +THR HA H N N 354 +THR HB H N N 355 +THR HG1 H N N 356 +THR HG21 H N N 357 +THR HG22 H N N 358 +THR HG23 H N N 359 +THR HXT H N N 360 +TRP N N N N 361 +TRP CA C N S 362 +TRP C C N N 363 +TRP O O N N 364 +TRP CB C N N 365 +TRP CG C Y N 366 +TRP CD1 C Y N 367 +TRP CD2 C Y N 368 +TRP NE1 N Y N 369 +TRP CE2 C Y N 370 +TRP CE3 C Y N 371 +TRP CZ2 C Y N 372 +TRP CZ3 C Y N 373 +TRP CH2 C Y N 374 +TRP OXT O N N 375 +TRP H H N N 376 +TRP H2 H N N 377 +TRP HA H N N 378 +TRP HB2 H N N 379 +TRP HB3 H N N 380 +TRP HD1 H N N 381 +TRP HE1 H N N 382 +TRP HE3 H N N 383 +TRP HZ2 H N N 384 +TRP HZ3 H N N 385 +TRP HH2 H N N 386 +TRP HXT H N N 387 +TYR N N N N 388 +TYR CA C N S 389 +TYR C C N N 390 +TYR O O N N 391 +TYR CB C N N 392 +TYR CG C Y N 393 +TYR CD1 C Y N 394 +TYR CD2 C Y N 395 +TYR CE1 C Y N 396 +TYR CE2 C Y N 397 +TYR CZ C Y N 398 +TYR OH O N N 399 +TYR OXT O N N 400 +TYR H H N N 401 +TYR H2 H N N 402 +TYR HA H N N 403 +TYR HB2 H N N 404 +TYR HB3 H N N 405 +TYR HD1 H N N 406 +TYR HD2 H N N 407 +TYR HE1 H N N 408 +TYR HE2 H N N 409 +TYR HH H N N 410 +TYR HXT H N N 411 +VAL N N N N 412 +VAL CA C N S 413 +VAL C C N N 414 +VAL O O N N 415 +VAL CB C N N 416 +VAL CG1 C N N 417 +VAL CG2 C N N 418 +VAL OXT O N N 419 +VAL H H N N 420 +VAL H2 H N N 421 +VAL HA H N N 422 +VAL HB H N N 423 +VAL HG11 H N N 424 +VAL HG12 H N N 425 +VAL HG13 H N N 426 +VAL HG21 H N N 427 +VAL HG22 H N N 428 +VAL HG23 H N N 429 +VAL HXT H N N 430 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CRO CG1 CB1 sing N N 70 +CRO OG1 CB1 sing N N 71 +CRO CB1 CA1 sing N N 72 +CRO N1 CA1 sing N N 73 +CRO OH CZ sing N N 74 +CRO CE1 CZ doub Y N 75 +CRO CE1 CD1 sing Y N 76 +CRO CA1 C1 sing N N 77 +CRO CZ CE2 sing Y N 78 +CRO CD1 CG2 doub Y N 79 +CRO N2 C1 doub N N 80 +CRO N2 CA2 sing N N 81 +CRO C1 N3 sing N N 82 +CRO CE2 CD2 doub Y N 83 +CRO CG2 CD2 sing Y N 84 +CRO CG2 CB2 sing N N 85 +CRO N3 CA3 sing N N 86 +CRO N3 C2 sing N N 87 +CRO CA2 CB2 doub N Z 88 +CRO CA2 C2 sing N N 89 +CRO CA3 C3 sing N N 90 +CRO OXT C3 sing N N 91 +CRO C3 O3 doub N N 92 +CRO C2 O2 doub N N 93 +CRO N1 H sing N N 94 +CRO N1 H2 sing N N 95 +CRO CA1 HA1 sing N N 96 +CRO CB1 HB1 sing N N 97 +CRO CG1 HG11 sing N N 98 +CRO CG1 HG12 sing N N 99 +CRO CG1 HG13 sing N N 100 +CRO OG1 HOG1 sing N N 101 +CRO CA3 HA31 sing N N 102 +CRO CA3 HA32 sing N N 103 +CRO OXT HXT sing N N 104 +CRO CB2 HB2 sing N N 105 +CRO CD1 HD1 sing N N 106 +CRO CD2 HD2 sing N N 107 +CRO CE1 HE1 sing N N 108 +CRO CE2 HE2 sing N N 109 +CRO OH HOH sing N N 110 +CYS N CA sing N N 111 +CYS N H sing N N 112 +CYS N H2 sing N N 113 +CYS CA C sing N N 114 +CYS CA CB sing N N 115 +CYS CA HA sing N N 116 +CYS C O doub N N 117 +CYS C OXT sing N N 118 +CYS CB SG sing N N 119 +CYS CB HB2 sing N N 120 +CYS CB HB3 sing N N 121 +CYS SG HG sing N N 122 +CYS OXT HXT sing N N 123 +GLN N CA sing N N 124 +GLN N H sing N N 125 +GLN N H2 sing N N 126 +GLN CA C sing N N 127 +GLN CA CB sing N N 128 +GLN CA HA sing N N 129 +GLN C O doub N N 130 +GLN C OXT sing N N 131 +GLN CB CG sing N N 132 +GLN CB HB2 sing N N 133 +GLN CB HB3 sing N N 134 +GLN CG CD sing N N 135 +GLN CG HG2 sing N N 136 +GLN CG HG3 sing N N 137 +GLN CD OE1 doub N N 138 +GLN CD NE2 sing N N 139 +GLN NE2 HE21 sing N N 140 +GLN NE2 HE22 sing N N 141 +GLN OXT HXT sing N N 142 +GLU N CA sing N N 143 +GLU N H sing N N 144 +GLU N H2 sing N N 145 +GLU CA C sing N N 146 +GLU CA CB sing N N 147 +GLU CA HA sing N N 148 +GLU C O doub N N 149 +GLU C OXT sing N N 150 +GLU CB CG sing N N 151 +GLU CB HB2 sing N N 152 +GLU CB HB3 sing N N 153 +GLU CG CD sing N N 154 +GLU CG HG2 sing N N 155 +GLU CG HG3 sing N N 156 +GLU CD OE1 doub N N 157 +GLU CD OE2 sing N N 158 +GLU OE2 HE2 sing N N 159 +GLU OXT HXT sing N N 160 +GLY N CA sing N N 161 +GLY N H sing N N 162 +GLY N H2 sing N N 163 +GLY CA C sing N N 164 +GLY CA HA2 sing N N 165 +GLY CA HA3 sing N N 166 +GLY C O doub N N 167 +GLY C OXT sing N N 168 +GLY OXT HXT sing N N 169 +HIS N CA sing N N 170 +HIS N H sing N N 171 +HIS N H2 sing N N 172 +HIS CA C sing N N 173 +HIS CA CB sing N N 174 +HIS CA HA sing N N 175 +HIS C O doub N N 176 +HIS C OXT sing N N 177 +HIS CB CG sing N N 178 +HIS CB HB2 sing N N 179 +HIS CB HB3 sing N N 180 +HIS CG ND1 sing Y N 181 +HIS CG CD2 doub Y N 182 +HIS ND1 CE1 doub Y N 183 +HIS ND1 HD1 sing N N 184 +HIS CD2 NE2 sing Y N 185 +HIS CD2 HD2 sing N N 186 +HIS CE1 NE2 sing Y N 187 +HIS CE1 HE1 sing N N 188 +HIS NE2 HE2 sing N N 189 +HIS OXT HXT sing N N 190 +HOH O H1 sing N N 191 +HOH O H2 sing N N 192 +ILE N CA sing N N 193 +ILE N H sing N N 194 +ILE N H2 sing N N 195 +ILE CA C sing N N 196 +ILE CA CB sing N N 197 +ILE CA HA sing N N 198 +ILE C O doub N N 199 +ILE C OXT sing N N 200 +ILE CB CG1 sing N N 201 +ILE CB CG2 sing N N 202 +ILE CB HB sing N N 203 +ILE CG1 CD1 sing N N 204 +ILE CG1 HG12 sing N N 205 +ILE CG1 HG13 sing N N 206 +ILE CG2 HG21 sing N N 207 +ILE CG2 HG22 sing N N 208 +ILE CG2 HG23 sing N N 209 +ILE CD1 HD11 sing N N 210 +ILE CD1 HD12 sing N N 211 +ILE CD1 HD13 sing N N 212 +ILE OXT HXT sing N N 213 +LEU N CA sing N N 214 +LEU N H sing N N 215 +LEU N H2 sing N N 216 +LEU CA C sing N N 217 +LEU CA CB sing N N 218 +LEU CA HA sing N N 219 +LEU C O doub N N 220 +LEU C OXT sing N N 221 +LEU CB CG sing N N 222 +LEU CB HB2 sing N N 223 +LEU CB HB3 sing N N 224 +LEU CG CD1 sing N N 225 +LEU CG CD2 sing N N 226 +LEU CG HG sing N N 227 +LEU CD1 HD11 sing N N 228 +LEU CD1 HD12 sing N N 229 +LEU CD1 HD13 sing N N 230 +LEU CD2 HD21 sing N N 231 +LEU CD2 HD22 sing N N 232 +LEU CD2 HD23 sing N N 233 +LEU OXT HXT sing N N 234 +LYS N CA sing N N 235 +LYS N H sing N N 236 +LYS N H2 sing N N 237 +LYS CA C sing N N 238 +LYS CA CB sing N N 239 +LYS CA HA sing N N 240 +LYS C O doub N N 241 +LYS C OXT sing N N 242 +LYS CB CG sing N N 243 +LYS CB HB2 sing N N 244 +LYS CB HB3 sing N N 245 +LYS CG CD sing N N 246 +LYS CG HG2 sing N N 247 +LYS CG HG3 sing N N 248 +LYS CD CE sing N N 249 +LYS CD HD2 sing N N 250 +LYS CD HD3 sing N N 251 +LYS CE NZ sing N N 252 +LYS CE HE2 sing N N 253 +LYS CE HE3 sing N N 254 +LYS NZ HZ1 sing N N 255 +LYS NZ HZ2 sing N N 256 +LYS NZ HZ3 sing N N 257 +LYS OXT HXT sing N N 258 +MET N CA sing N N 259 +MET N H sing N N 260 +MET N H2 sing N N 261 +MET CA C sing N N 262 +MET CA CB sing N N 263 +MET CA HA sing N N 264 +MET C O doub N N 265 +MET C OXT sing N N 266 +MET CB CG sing N N 267 +MET CB HB2 sing N N 268 +MET CB HB3 sing N N 269 +MET CG SD sing N N 270 +MET CG HG2 sing N N 271 +MET CG HG3 sing N N 272 +MET SD CE sing N N 273 +MET CE HE1 sing N N 274 +MET CE HE2 sing N N 275 +MET CE HE3 sing N N 276 +MET OXT HXT sing N N 277 +PHE N CA sing N N 278 +PHE N H sing N N 279 +PHE N H2 sing N N 280 +PHE CA C sing N N 281 +PHE CA CB sing N N 282 +PHE CA HA sing N N 283 +PHE C O doub N N 284 +PHE C OXT sing N N 285 +PHE CB CG sing N N 286 +PHE CB HB2 sing N N 287 +PHE CB HB3 sing N N 288 +PHE CG CD1 doub Y N 289 +PHE CG CD2 sing Y N 290 +PHE CD1 CE1 sing Y N 291 +PHE CD1 HD1 sing N N 292 +PHE CD2 CE2 doub Y N 293 +PHE CD2 HD2 sing N N 294 +PHE CE1 CZ doub Y N 295 +PHE CE1 HE1 sing N N 296 +PHE CE2 CZ sing Y N 297 +PHE CE2 HE2 sing N N 298 +PHE CZ HZ sing N N 299 +PHE OXT HXT sing N N 300 +PRO N CA sing N N 301 +PRO N CD sing N N 302 +PRO N H sing N N 303 +PRO CA C sing N N 304 +PRO CA CB sing N N 305 +PRO CA HA sing N N 306 +PRO C O doub N N 307 +PRO C OXT sing N N 308 +PRO CB CG sing N N 309 +PRO CB HB2 sing N N 310 +PRO CB HB3 sing N N 311 +PRO CG CD sing N N 312 +PRO CG HG2 sing N N 313 +PRO CG HG3 sing N N 314 +PRO CD HD2 sing N N 315 +PRO CD HD3 sing N N 316 +PRO OXT HXT sing N N 317 +SER N CA sing N N 318 +SER N H sing N N 319 +SER N H2 sing N N 320 +SER CA C sing N N 321 +SER CA CB sing N N 322 +SER CA HA sing N N 323 +SER C O doub N N 324 +SER C OXT sing N N 325 +SER CB OG sing N N 326 +SER CB HB2 sing N N 327 +SER CB HB3 sing N N 328 +SER OG HG sing N N 329 +SER OXT HXT sing N N 330 +THR N CA sing N N 331 +THR N H sing N N 332 +THR N H2 sing N N 333 +THR CA C sing N N 334 +THR CA CB sing N N 335 +THR CA HA sing N N 336 +THR C O doub N N 337 +THR C OXT sing N N 338 +THR CB OG1 sing N N 339 +THR CB CG2 sing N N 340 +THR CB HB sing N N 341 +THR OG1 HG1 sing N N 342 +THR CG2 HG21 sing N N 343 +THR CG2 HG22 sing N N 344 +THR CG2 HG23 sing N N 345 +THR OXT HXT sing N N 346 +TRP N CA sing N N 347 +TRP N H sing N N 348 +TRP N H2 sing N N 349 +TRP CA C sing N N 350 +TRP CA CB sing N N 351 +TRP CA HA sing N N 352 +TRP C O doub N N 353 +TRP C OXT sing N N 354 +TRP CB CG sing N N 355 +TRP CB HB2 sing N N 356 +TRP CB HB3 sing N N 357 +TRP CG CD1 doub Y N 358 +TRP CG CD2 sing Y N 359 +TRP CD1 NE1 sing Y N 360 +TRP CD1 HD1 sing N N 361 +TRP CD2 CE2 doub Y N 362 +TRP CD2 CE3 sing Y N 363 +TRP NE1 CE2 sing Y N 364 +TRP NE1 HE1 sing N N 365 +TRP CE2 CZ2 sing Y N 366 +TRP CE3 CZ3 doub Y N 367 +TRP CE3 HE3 sing N N 368 +TRP CZ2 CH2 doub Y N 369 +TRP CZ2 HZ2 sing N N 370 +TRP CZ3 CH2 sing Y N 371 +TRP CZ3 HZ3 sing N N 372 +TRP CH2 HH2 sing N N 373 +TRP OXT HXT sing N N 374 +TYR N CA sing N N 375 +TYR N H sing N N 376 +TYR N H2 sing N N 377 +TYR CA C sing N N 378 +TYR CA CB sing N N 379 +TYR CA HA sing N N 380 +TYR C O doub N N 381 +TYR C OXT sing N N 382 +TYR CB CG sing N N 383 +TYR CB HB2 sing N N 384 +TYR CB HB3 sing N N 385 +TYR CG CD1 doub Y N 386 +TYR CG CD2 sing Y N 387 +TYR CD1 CE1 sing Y N 388 +TYR CD1 HD1 sing N N 389 +TYR CD2 CE2 doub Y N 390 +TYR CD2 HD2 sing N N 391 +TYR CE1 CZ doub Y N 392 +TYR CE1 HE1 sing N N 393 +TYR CE2 CZ sing Y N 394 +TYR CE2 HE2 sing N N 395 +TYR CZ OH sing N N 396 +TYR OH HH sing N N 397 +TYR OXT HXT sing N N 398 +VAL N CA sing N N 399 +VAL N H sing N N 400 +VAL N H2 sing N N 401 +VAL CA C sing N N 402 +VAL CA CB sing N N 403 +VAL CA HA sing N N 404 +VAL C O doub N N 405 +VAL C OXT sing N N 406 +VAL CB CG1 sing N N 407 +VAL CB CG2 sing N N 408 +VAL CB HB sing N N 409 +VAL CG1 HG11 sing N N 410 +VAL CG1 HG12 sing N N 411 +VAL CG1 HG13 sing N N 412 +VAL CG2 HG21 sing N N 413 +VAL CG2 HG22 sing N N 414 +VAL CG2 HG23 sing N N 415 +VAL OXT HXT sing N N 416 +# +_pdbx_initial_refinement_model.id 1 +_pdbx_initial_refinement_model.entity_id_list ? +_pdbx_initial_refinement_model.type 'experimental model' +_pdbx_initial_refinement_model.source_name PDB +_pdbx_initial_refinement_model.accession_code 1GFL +_pdbx_initial_refinement_model.details 'PDB ENTRY 1GFL' +# +_atom_sites.entry_id 1B9C +_atom_sites.fract_transf_matrix[1][1] 0.011979 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.011714 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.007140 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . GLY A 1 4 ? 4.914 44.230 6.779 1.00 61.24 ? 4 GLY A N 1 +ATOM 2 C CA . GLY A 1 4 ? 5.837 44.402 7.883 1.00 60.98 ? 4 GLY A CA 1 +ATOM 3 C C . GLY A 1 4 ? 6.539 43.121 8.315 1.00 61.43 ? 4 GLY A C 1 +ATOM 4 O O . GLY A 1 4 ? 7.753 43.116 8.487 1.00 61.96 ? 4 GLY A O 1 +ATOM 5 N N . GLU A 1 5 ? 5.772 42.037 8.500 1.00 62.13 ? 5 GLU A N 1 +ATOM 6 C CA . GLU A 1 5 ? 6.221 40.716 8.940 1.00 63.28 ? 5 GLU A CA 1 +ATOM 7 C C . GLU A 1 5 ? 7.300 40.101 8.051 1.00 62.81 ? 5 GLU A C 1 +ATOM 8 O O . GLU A 1 5 ? 8.256 39.497 8.557 1.00 60.94 ? 5 GLU A O 1 +ATOM 9 C CB . GLU A 1 5 ? 4.989 39.805 8.998 1.00 67.97 ? 5 GLU A CB 1 +ATOM 10 C CG . GLU A 1 5 ? 5.086 38.443 9.687 1.00 74.11 ? 5 GLU A CG 1 +ATOM 11 C CD . GLU A 1 5 ? 3.792 37.627 9.625 1.00 79.78 ? 5 GLU A CD 1 +ATOM 12 O OE1 . GLU A 1 5 ? 2.846 37.914 10.373 1.00 80.90 ? 5 GLU A OE1 1 +ATOM 13 O OE2 . GLU A 1 5 ? 3.741 36.692 8.821 1.00 80.65 ? 5 GLU A OE2 1 +ATOM 14 N N . GLU A 1 6 ? 7.135 40.281 6.719 1.00 61.03 ? 6 GLU A N 1 +ATOM 15 C CA . GLU A 1 6 ? 8.044 39.773 5.687 1.00 57.38 ? 6 GLU A CA 1 +ATOM 16 C C . GLU A 1 6 ? 9.343 40.548 5.490 1.00 53.24 ? 6 GLU A C 1 +ATOM 17 O O . GLU A 1 6 ? 10.158 40.254 4.605 1.00 55.24 ? 6 GLU A O 1 +ATOM 18 C CB . GLU A 1 6 ? 7.313 39.676 4.335 1.00 61.54 ? 6 GLU A CB 1 +ATOM 19 C CG . GLU A 1 6 ? 6.141 40.628 4.026 1.00 69.87 ? 6 GLU A CG 1 +ATOM 20 C CD . GLU A 1 6 ? 6.473 42.112 3.846 1.00 73.70 ? 6 GLU A CD 1 +ATOM 21 O OE1 . GLU A 1 6 ? 7.260 42.443 2.953 1.00 75.83 ? 6 GLU A OE1 1 +ATOM 22 O OE2 . GLU A 1 6 ? 5.926 42.930 4.591 1.00 70.14 ? 6 GLU A OE2 1 +ATOM 23 N N . LEU A 1 7 ? 9.540 41.537 6.367 1.00 43.83 ? 7 LEU A N 1 +ATOM 24 C CA . LEU A 1 7 ? 10.781 42.277 6.450 1.00 36.81 ? 7 LEU A CA 1 +ATOM 25 C C . LEU A 1 7 ? 11.824 41.522 7.270 1.00 34.79 ? 7 LEU A C 1 +ATOM 26 O O . LEU A 1 7 ? 13.037 41.680 7.114 1.00 39.49 ? 7 LEU A O 1 +ATOM 27 C CB . LEU A 1 7 ? 10.491 43.615 7.082 1.00 35.60 ? 7 LEU A CB 1 +ATOM 28 C CG . LEU A 1 7 ? 9.803 44.687 6.259 1.00 36.22 ? 7 LEU A CG 1 +ATOM 29 C CD1 . LEU A 1 7 ? 9.546 45.861 7.174 1.00 37.14 ? 7 LEU A CD1 1 +ATOM 30 C CD2 . LEU A 1 7 ? 10.658 45.129 5.073 1.00 37.31 ? 7 LEU A CD2 1 +ATOM 31 N N . PHE A 1 8 ? 11.286 40.647 8.114 1.00 28.93 ? 8 PHE A N 1 +ATOM 32 C CA . PHE A 1 8 ? 12.007 39.820 9.032 1.00 28.70 ? 8 PHE A CA 1 +ATOM 33 C C . PHE A 1 8 ? 12.059 38.353 8.656 1.00 31.05 ? 8 PHE A C 1 +ATOM 34 O O . PHE A 1 8 ? 12.159 37.505 9.550 1.00 31.88 ? 8 PHE A O 1 +ATOM 35 C CB . PHE A 1 8 ? 11.363 39.954 10.383 1.00 29.59 ? 8 PHE A CB 1 +ATOM 36 C CG . PHE A 1 8 ? 11.417 41.354 10.934 1.00 34.23 ? 8 PHE A CG 1 +ATOM 37 C CD1 . PHE A 1 8 ? 12.538 41.754 11.633 1.00 34.17 ? 8 PHE A CD1 1 +ATOM 38 C CD2 . PHE A 1 8 ? 10.331 42.215 10.747 1.00 28.56 ? 8 PHE A CD2 1 +ATOM 39 C CE1 . PHE A 1 8 ? 12.567 43.043 12.162 1.00 40.37 ? 8 PHE A CE1 1 +ATOM 40 C CE2 . PHE A 1 8 ? 10.377 43.469 11.271 1.00 27.97 ? 8 PHE A CE2 1 +ATOM 41 C CZ . PHE A 1 8 ? 11.489 43.890 11.982 1.00 37.60 ? 8 PHE A CZ 1 +ATOM 42 N N . THR A 1 9 ? 11.950 37.940 7.396 1.00 35.75 ? 9 THR A N 1 +ATOM 43 C CA . THR A 1 9 ? 11.986 36.500 7.140 1.00 39.25 ? 9 THR A CA 1 +ATOM 44 C C . THR A 1 9 ? 13.433 36.055 7.002 1.00 45.37 ? 9 THR A C 1 +ATOM 45 O O . THR A 1 9 ? 13.786 34.943 7.440 1.00 49.78 ? 9 THR A O 1 +ATOM 46 C CB . THR A 1 9 ? 11.246 36.111 5.866 1.00 37.51 ? 9 THR A CB 1 +ATOM 47 O OG1 . THR A 1 9 ? 11.790 36.926 4.824 1.00 35.01 ? 9 THR A OG1 1 +ATOM 48 C CG2 . THR A 1 9 ? 9.761 36.234 6.025 1.00 31.47 ? 9 THR A CG2 1 +ATOM 49 N N . GLY A 1 10 ? 14.242 36.929 6.369 1.00 40.34 ? 10 GLY A N 1 +ATOM 50 C CA . GLY A 1 10 ? 15.663 36.705 6.322 1.00 40.77 ? 10 GLY A CA 1 +ATOM 51 C C . GLY A 1 10 ? 16.328 37.273 7.584 1.00 40.98 ? 10 GLY A C 1 +ATOM 52 O O . GLY A 1 10 ? 15.719 37.577 8.619 1.00 41.29 ? 10 GLY A O 1 +ATOM 53 N N . VAL A 1 11 ? 17.655 37.333 7.427 1.00 38.73 ? 11 VAL A N 1 +ATOM 54 C CA . VAL A 1 11 ? 18.594 37.910 8.365 1.00 36.13 ? 11 VAL A CA 1 +ATOM 55 C C . VAL A 1 11 ? 18.665 39.363 7.933 1.00 31.09 ? 11 VAL A C 1 +ATOM 56 O O . VAL A 1 11 ? 18.918 39.707 6.760 1.00 22.88 ? 11 VAL A O 1 +ATOM 57 C CB . VAL A 1 11 ? 19.973 37.222 8.223 1.00 43.29 ? 11 VAL A CB 1 +ATOM 58 C CG1 . VAL A 1 11 ? 20.914 37.720 9.293 1.00 44.74 ? 11 VAL A CG1 1 +ATOM 59 C CG2 . VAL A 1 11 ? 19.848 35.727 8.406 1.00 44.11 ? 11 VAL A CG2 1 +ATOM 60 N N . VAL A 1 12 ? 18.314 40.131 8.973 1.00 29.39 ? 12 VAL A N 1 +ATOM 61 C CA . VAL A 1 12 ? 18.173 41.592 8.948 1.00 23.97 ? 12 VAL A CA 1 +ATOM 62 C C . VAL A 1 12 ? 19.347 42.235 9.686 1.00 21.06 ? 12 VAL A C 1 +ATOM 63 O O . VAL A 1 12 ? 19.609 41.908 10.845 1.00 24.64 ? 12 VAL A O 1 +ATOM 64 C CB . VAL A 1 12 ? 16.814 41.963 9.618 1.00 24.46 ? 12 VAL A CB 1 +ATOM 65 C CG1 . VAL A 1 12 ? 16.619 43.499 9.733 1.00 26.58 ? 12 VAL A CG1 1 +ATOM 66 C CG2 . VAL A 1 12 ? 15.702 41.375 8.759 1.00 15.27 ? 12 VAL A CG2 1 +ATOM 67 N N . PRO A 1 13 ? 20.110 43.130 9.089 1.00 23.10 ? 13 PRO A N 1 +ATOM 68 C CA . PRO A 1 13 ? 21.158 43.871 9.800 1.00 24.88 ? 13 PRO A CA 1 +ATOM 69 C C . PRO A 1 13 ? 20.589 44.738 10.912 1.00 20.59 ? 13 PRO A C 1 +ATOM 70 O O . PRO A 1 13 ? 19.559 45.343 10.711 1.00 26.84 ? 13 PRO A O 1 +ATOM 71 C CB . PRO A 1 13 ? 21.849 44.665 8.701 1.00 28.59 ? 13 PRO A CB 1 +ATOM 72 C CG . PRO A 1 13 ? 21.627 43.812 7.462 1.00 32.55 ? 13 PRO A CG 1 +ATOM 73 C CD . PRO A 1 13 ? 20.181 43.347 7.647 1.00 24.88 ? 13 PRO A CD 1 +ATOM 74 N N . ILE A 1 14 ? 21.127 44.771 12.116 1.00 21.37 ? 14 ILE A N 1 +ATOM 75 C CA . ILE A 1 14 ? 20.719 45.701 13.146 1.00 23.90 ? 14 ILE A CA 1 +ATOM 76 C C . ILE A 1 14 ? 21.876 46.717 13.350 1.00 30.93 ? 14 ILE A C 1 +ATOM 77 O O . ILE A 1 14 ? 23.052 46.554 12.953 1.00 28.04 ? 14 ILE A O 1 +ATOM 78 C CB . ILE A 1 14 ? 20.438 44.949 14.460 1.00 26.07 ? 14 ILE A CB 1 +ATOM 79 C CG1 . ILE A 1 14 ? 19.545 43.781 14.168 1.00 31.33 ? 14 ILE A CG1 1 +ATOM 80 C CG2 . ILE A 1 14 ? 19.778 45.863 15.501 1.00 28.39 ? 14 ILE A CG2 1 +ATOM 81 C CD1 . ILE A 1 14 ? 19.399 42.954 15.443 1.00 30.72 ? 14 ILE A CD1 1 +ATOM 82 N N . LEU A 1 15 ? 21.426 47.841 13.901 1.00 30.23 ? 15 LEU A N 1 +ATOM 83 C CA . LEU A 1 15 ? 22.248 48.955 14.308 1.00 30.08 ? 15 LEU A CA 1 +ATOM 84 C C . LEU A 1 15 ? 21.504 49.443 15.532 1.00 31.22 ? 15 LEU A C 1 +ATOM 85 O O . LEU A 1 15 ? 20.282 49.598 15.550 1.00 27.51 ? 15 LEU A O 1 +ATOM 86 C CB . LEU A 1 15 ? 22.261 50.109 13.340 1.00 38.27 ? 15 LEU A CB 1 +ATOM 87 C CG . LEU A 1 15 ? 23.584 50.675 12.834 1.00 43.98 ? 15 LEU A CG 1 +ATOM 88 C CD1 . LEU A 1 15 ? 24.579 50.797 13.995 1.00 47.84 ? 15 LEU A CD1 1 +ATOM 89 C CD2 . LEU A 1 15 ? 24.158 49.747 11.760 1.00 41.43 ? 15 LEU A CD2 1 +ATOM 90 N N . VAL A 1 16 ? 22.248 49.585 16.616 1.00 28.59 ? 16 VAL A N 1 +ATOM 91 C CA . VAL A 1 16 ? 21.677 50.027 17.874 1.00 30.23 ? 16 VAL A CA 1 +ATOM 92 C C . VAL A 1 16 ? 22.517 51.247 18.185 1.00 35.04 ? 16 VAL A C 1 +ATOM 93 O O . VAL A 1 16 ? 23.697 51.271 17.856 1.00 39.61 ? 16 VAL A O 1 +ATOM 94 C CB . VAL A 1 16 ? 21.831 48.945 18.948 1.00 24.14 ? 16 VAL A CB 1 +ATOM 95 C CG1 . VAL A 1 16 ? 21.304 49.433 20.255 1.00 21.75 ? 16 VAL A CG1 1 +ATOM 96 C CG2 . VAL A 1 16 ? 21.066 47.704 18.534 1.00 24.81 ? 16 VAL A CG2 1 +ATOM 97 N N . GLU A 1 17 ? 21.920 52.314 18.716 1.00 35.65 ? 17 GLU A N 1 +ATOM 98 C CA . GLU A 1 17 ? 22.657 53.528 18.989 1.00 35.25 ? 17 GLU A CA 1 +ATOM 99 C C . GLU A 1 17 ? 22.082 54.081 20.265 1.00 34.97 ? 17 GLU A C 1 +ATOM 100 O O . GLU A 1 17 ? 20.898 54.413 20.288 1.00 38.42 ? 17 GLU A O 1 +ATOM 101 C CB . GLU A 1 17 ? 22.462 54.524 17.861 1.00 41.89 ? 17 GLU A CB 1 +ATOM 102 C CG . GLU A 1 17 ? 22.959 54.127 16.476 1.00 48.36 ? 17 GLU A CG 1 +ATOM 103 C CD . GLU A 1 17 ? 24.442 54.403 16.254 1.00 56.21 ? 17 GLU A CD 1 +ATOM 104 O OE1 . GLU A 1 17 ? 24.768 55.537 15.894 1.00 63.83 ? 17 GLU A OE1 1 +ATOM 105 O OE2 . GLU A 1 17 ? 25.263 53.493 16.414 1.00 55.58 ? 17 GLU A OE2 1 +ATOM 106 N N . LEU A 1 18 ? 22.861 54.128 21.350 1.00 32.06 ? 18 LEU A N 1 +ATOM 107 C CA . LEU A 1 18 ? 22.400 54.685 22.615 1.00 29.26 ? 18 LEU A CA 1 +ATOM 108 C C . LEU A 1 18 ? 23.182 55.961 22.990 1.00 32.76 ? 18 LEU A C 1 +ATOM 109 O O . LEU A 1 18 ? 24.332 56.183 22.613 1.00 28.34 ? 18 LEU A O 1 +ATOM 110 C CB . LEU A 1 18 ? 22.530 53.566 23.629 1.00 19.33 ? 18 LEU A CB 1 +ATOM 111 C CG . LEU A 1 18 ? 22.115 53.562 25.113 1.00 28.76 ? 18 LEU A CG 1 +ATOM 112 C CD1 . LEU A 1 18 ? 23.165 54.179 25.982 1.00 30.06 ? 18 LEU A CD1 1 +ATOM 113 C CD2 . LEU A 1 18 ? 20.828 54.287 25.278 1.00 35.44 ? 18 LEU A CD2 1 +ATOM 114 N N . ASP A 1 19 ? 22.445 56.889 23.600 1.00 34.31 ? 19 ASP A N 1 +ATOM 115 C CA . ASP A 1 19 ? 22.954 58.116 24.174 1.00 36.31 ? 19 ASP A CA 1 +ATOM 116 C C . ASP A 1 19 ? 22.290 58.037 25.531 1.00 36.68 ? 19 ASP A C 1 +ATOM 117 O O . ASP A 1 19 ? 21.068 58.012 25.712 1.00 40.54 ? 19 ASP A O 1 +ATOM 118 C CB . ASP A 1 19 ? 22.478 59.400 23.461 1.00 40.03 ? 19 ASP A CB 1 +ATOM 119 C CG . ASP A 1 19 ? 23.143 59.795 22.133 1.00 49.12 ? 19 ASP A CG 1 +ATOM 120 O OD1 . ASP A 1 19 ? 24.336 59.539 21.950 1.00 50.68 ? 19 ASP A OD1 1 +ATOM 121 O OD2 . ASP A 1 19 ? 22.467 60.386 21.281 1.00 49.00 ? 19 ASP A OD2 1 +ATOM 122 N N . GLY A 1 20 ? 23.155 57.895 26.505 1.00 36.61 ? 20 GLY A N 1 +ATOM 123 C CA . GLY A 1 20 ? 22.714 57.731 27.864 1.00 37.33 ? 20 GLY A CA 1 +ATOM 124 C C . GLY A 1 20 ? 23.331 58.785 28.749 1.00 37.28 ? 20 GLY A C 1 +ATOM 125 O O . GLY A 1 20 ? 24.218 59.547 28.371 1.00 33.73 ? 20 GLY A O 1 +ATOM 126 N N . ASP A 1 21 ? 22.795 58.699 29.964 1.00 39.75 ? 21 ASP A N 1 +ATOM 127 C CA . ASP A 1 21 ? 23.125 59.566 31.061 1.00 41.12 ? 21 ASP A CA 1 +ATOM 128 C C . ASP A 1 21 ? 22.675 58.854 32.317 1.00 40.11 ? 21 ASP A C 1 +ATOM 129 O O . ASP A 1 21 ? 21.491 58.759 32.616 1.00 40.63 ? 21 ASP A O 1 +ATOM 130 C CB . ASP A 1 21 ? 22.394 60.917 30.878 1.00 46.56 ? 21 ASP A CB 1 +ATOM 131 C CG . ASP A 1 21 ? 22.752 62.031 31.856 1.00 44.65 ? 21 ASP A CG 1 +ATOM 132 O OD1 . ASP A 1 21 ? 22.614 61.857 33.066 1.00 47.66 ? 21 ASP A OD1 1 +ATOM 133 O OD2 . ASP A 1 21 ? 23.140 63.091 31.393 1.00 45.86 ? 21 ASP A OD2 1 +ATOM 134 N N . VAL A 1 22 ? 23.615 58.314 33.070 1.00 41.28 ? 22 VAL A N 1 +ATOM 135 C CA . VAL A 1 22 ? 23.256 57.682 34.322 1.00 44.48 ? 22 VAL A CA 1 +ATOM 136 C C . VAL A 1 22 ? 23.998 58.440 35.394 1.00 47.33 ? 22 VAL A C 1 +ATOM 137 O O . VAL A 1 22 ? 25.222 58.345 35.502 1.00 52.64 ? 22 VAL A O 1 +ATOM 138 C CB . VAL A 1 22 ? 23.669 56.197 34.319 1.00 48.41 ? 22 VAL A CB 1 +ATOM 139 C CG1 . VAL A 1 22 ? 23.318 55.577 35.659 1.00 47.41 ? 22 VAL A CG1 1 +ATOM 140 C CG2 . VAL A 1 22 ? 22.921 55.429 33.233 1.00 48.80 ? 22 VAL A CG2 1 +ATOM 141 N N . ASN A 1 23 ? 23.221 59.206 36.177 1.00 48.69 ? 23 ASN A N 1 +ATOM 142 C CA . ASN A 1 23 ? 23.698 60.097 37.229 1.00 43.78 ? 23 ASN A CA 1 +ATOM 143 C C . ASN A 1 23 ? 24.576 61.240 36.745 1.00 42.21 ? 23 ASN A C 1 +ATOM 144 O O . ASN A 1 23 ? 25.475 61.712 37.437 1.00 43.78 ? 23 ASN A O 1 +ATOM 145 C CB . ASN A 1 23 ? 24.418 59.247 38.290 1.00 38.46 ? 23 ASN A CB 1 +ATOM 146 C CG . ASN A 1 23 ? 23.410 58.608 39.217 1.00 35.18 ? 23 ASN A CG 1 +ATOM 147 O OD1 . ASN A 1 23 ? 22.261 58.350 38.853 1.00 35.35 ? 23 ASN A OD1 1 +ATOM 148 N ND2 . ASN A 1 23 ? 23.832 58.327 40.443 1.00 33.02 ? 23 ASN A ND2 1 +ATOM 149 N N . GLY A 1 24 ? 24.258 61.727 35.547 1.00 38.63 ? 24 GLY A N 1 +ATOM 150 C CA . GLY A 1 24 ? 25.015 62.804 34.945 1.00 38.59 ? 24 GLY A CA 1 +ATOM 151 C C . GLY A 1 24 ? 26.113 62.274 34.044 1.00 41.57 ? 24 GLY A C 1 +ATOM 152 O O . GLY A 1 24 ? 26.700 63.032 33.269 1.00 42.90 ? 24 GLY A O 1 +ATOM 153 N N . HIS A 1 25 ? 26.418 60.973 34.133 1.00 42.89 ? 25 HIS A N 1 +ATOM 154 C CA . HIS A 1 25 ? 27.456 60.385 33.304 1.00 42.68 ? 25 HIS A CA 1 +ATOM 155 C C . HIS A 1 25 ? 26.898 60.053 31.928 1.00 43.86 ? 25 HIS A C 1 +ATOM 156 O O . HIS A 1 25 ? 26.131 59.120 31.712 1.00 48.12 ? 25 HIS A O 1 +ATOM 157 C CB . HIS A 1 25 ? 28.005 59.137 33.976 1.00 37.06 ? 25 HIS A CB 1 +ATOM 158 C CG . HIS A 1 25 ? 28.463 59.410 35.395 1.00 37.27 ? 25 HIS A CG 1 +ATOM 159 N ND1 . HIS A 1 25 ? 27.997 58.825 36.490 1.00 39.19 ? 25 HIS A ND1 1 +ATOM 160 C CD2 . HIS A 1 25 ? 29.420 60.324 35.760 1.00 33.98 ? 25 HIS A CD2 1 +ATOM 161 C CE1 . HIS A 1 25 ? 28.642 59.364 37.499 1.00 38.18 ? 25 HIS A CE1 1 +ATOM 162 N NE2 . HIS A 1 25 ? 29.495 60.263 37.058 1.00 35.16 ? 25 HIS A NE2 1 +ATOM 163 N N . LYS A 1 26 ? 27.260 60.913 30.988 1.00 46.08 ? 26 LYS A N 1 +ATOM 164 C CA . LYS A 1 26 ? 26.871 60.750 29.618 1.00 49.69 ? 26 LYS A CA 1 +ATOM 165 C C . LYS A 1 26 ? 27.816 59.786 28.908 1.00 53.39 ? 26 LYS A C 1 +ATOM 166 O O . LYS A 1 26 ? 29.049 59.826 29.001 1.00 55.26 ? 26 LYS A O 1 +ATOM 167 C CB . LYS A 1 26 ? 26.840 62.112 28.931 1.00 51.87 ? 26 LYS A CB 1 +ATOM 168 C CG . LYS A 1 26 ? 27.844 63.161 29.389 1.00 63.18 ? 26 LYS A CG 1 +ATOM 169 C CD . LYS A 1 26 ? 28.912 63.561 28.355 1.00 69.74 ? 26 LYS A CD 1 +ATOM 170 C CE . LYS A 1 26 ? 30.215 62.769 28.515 1.00 72.85 ? 26 LYS A CE 1 +ATOM 171 N NZ . LYS A 1 26 ? 31.343 63.546 28.035 1.00 72.72 ? 26 LYS A NZ 1 +ATOM 172 N N . PHE A 1 27 ? 27.166 58.854 28.215 1.00 50.99 ? 27 PHE A N 1 +ATOM 173 C CA . PHE A 1 27 ? 27.844 57.813 27.464 1.00 48.29 ? 27 PHE A CA 1 +ATOM 174 C C . PHE A 1 27 ? 27.087 57.445 26.193 1.00 46.36 ? 27 PHE A C 1 +ATOM 175 O O . PHE A 1 27 ? 25.878 57.668 26.055 1.00 44.13 ? 27 PHE A O 1 +ATOM 176 C CB . PHE A 1 27 ? 28.005 56.562 28.318 1.00 45.65 ? 27 PHE A CB 1 +ATOM 177 C CG . PHE A 1 27 ? 26.717 55.913 28.808 1.00 47.79 ? 27 PHE A CG 1 +ATOM 178 C CD1 . PHE A 1 27 ? 26.026 56.427 29.905 1.00 49.00 ? 27 PHE A CD1 1 +ATOM 179 C CD2 . PHE A 1 27 ? 26.257 54.753 28.201 1.00 50.56 ? 27 PHE A CD2 1 +ATOM 180 C CE1 . PHE A 1 27 ? 24.897 55.786 30.393 1.00 45.24 ? 27 PHE A CE1 1 +ATOM 181 C CE2 . PHE A 1 27 ? 25.124 54.118 28.699 1.00 49.68 ? 27 PHE A CE2 1 +ATOM 182 C CZ . PHE A 1 27 ? 24.444 54.628 29.793 1.00 47.49 ? 27 PHE A CZ 1 +ATOM 183 N N . SER A 1 28 ? 27.825 56.853 25.256 1.00 41.23 ? 28 SER A N 1 +ATOM 184 C CA . SER A 1 28 ? 27.231 56.418 24.017 1.00 38.20 ? 28 SER A CA 1 +ATOM 185 C C . SER A 1 28 ? 27.702 55.044 23.606 1.00 37.75 ? 28 SER A C 1 +ATOM 186 O O . SER A 1 28 ? 28.881 54.701 23.753 1.00 41.31 ? 28 SER A O 1 +ATOM 187 C CB . SER A 1 28 ? 27.554 57.416 22.923 1.00 39.18 ? 28 SER A CB 1 +ATOM 188 O OG . SER A 1 28 ? 27.107 58.712 23.299 1.00 41.68 ? 28 SER A OG 1 +ATOM 189 N N . VAL A 1 29 ? 26.746 54.196 23.193 1.00 36.09 ? 29 VAL A N 1 +ATOM 190 C CA . VAL A 1 29 ? 27.162 52.941 22.618 1.00 28.62 ? 29 VAL A CA 1 +ATOM 191 C C . VAL A 1 29 ? 26.618 52.847 21.212 1.00 31.24 ? 29 VAL A C 1 +ATOM 192 O O . VAL A 1 29 ? 25.565 53.363 20.855 1.00 36.66 ? 29 VAL A O 1 +ATOM 193 C CB . VAL A 1 29 ? 26.728 51.652 23.436 1.00 17.61 ? 29 VAL A CB 1 +ATOM 194 C CG1 . VAL A 1 29 ? 26.493 51.967 24.882 1.00 13.91 ? 29 VAL A CG1 1 +ATOM 195 C CG2 . VAL A 1 29 ? 25.568 51.007 22.800 1.00 27.58 ? 29 VAL A CG2 1 +ATOM 196 N N . SER A 1 30 ? 27.410 52.154 20.421 1.00 29.67 ? 30 SER A N 1 +ATOM 197 C CA . SER A 1 30 ? 27.040 51.827 19.081 1.00 28.71 ? 30 SER A CA 1 +ATOM 198 C C . SER A 1 30 ? 27.042 50.301 18.968 1.00 26.73 ? 30 SER A C 1 +ATOM 199 O O . SER A 1 30 ? 28.065 49.645 19.124 1.00 26.29 ? 30 SER A O 1 +ATOM 200 C CB . SER A 1 30 ? 28.035 52.435 18.142 1.00 32.42 ? 30 SER A CB 1 +ATOM 201 O OG . SER A 1 30 ? 27.858 53.834 18.148 1.00 47.98 ? 30 SER A OG 1 +ATOM 202 N N . GLY A 1 31 ? 25.865 49.739 18.728 1.00 23.20 ? 31 GLY A N 1 +ATOM 203 C CA . GLY A 1 31 ? 25.698 48.328 18.561 1.00 24.81 ? 31 GLY A CA 1 +ATOM 204 C C . GLY A 1 31 ? 25.514 47.974 17.100 1.00 28.49 ? 31 GLY A C 1 +ATOM 205 O O . GLY A 1 31 ? 25.078 48.808 16.296 1.00 32.05 ? 31 GLY A O 1 +ATOM 206 N N . GLU A 1 32 ? 25.975 46.777 16.701 1.00 22.98 ? 32 GLU A N 1 +ATOM 207 C CA . GLU A 1 32 ? 25.611 46.288 15.386 1.00 22.02 ? 32 GLU A CA 1 +ATOM 208 C C . GLU A 1 32 ? 25.576 44.788 15.374 1.00 18.70 ? 32 GLU A C 1 +ATOM 209 O O . GLU A 1 32 ? 26.311 44.079 16.044 1.00 18.24 ? 32 GLU A O 1 +ATOM 210 C CB . GLU A 1 32 ? 26.553 46.780 14.249 1.00 17.47 ? 32 GLU A CB 1 +ATOM 211 C CG . GLU A 1 32 ? 28.071 46.695 14.435 1.00 34.20 ? 32 GLU A CG 1 +ATOM 212 C CD . GLU A 1 32 ? 28.694 45.304 14.292 1.00 37.24 ? 32 GLU A CD 1 +ATOM 213 O OE1 . GLU A 1 32 ? 28.185 44.490 13.495 1.00 39.33 ? 32 GLU A OE1 1 +ATOM 214 O OE2 . GLU A 1 32 ? 29.684 45.058 14.983 1.00 32.73 ? 32 GLU A OE2 1 +ATOM 215 N N . GLY A 1 33 ? 24.605 44.314 14.617 1.00 22.12 ? 33 GLY A N 1 +ATOM 216 C CA . GLY A 1 33 ? 24.447 42.904 14.481 1.00 14.97 ? 33 GLY A CA 1 +ATOM 217 C C . GLY A 1 33 ? 23.597 42.555 13.321 1.00 18.11 ? 33 GLY A C 1 +ATOM 218 O O . GLY A 1 33 ? 23.665 43.074 12.199 1.00 16.62 ? 33 GLY A O 1 +ATOM 219 N N . GLU A 1 34 ? 22.829 41.559 13.704 1.00 20.22 ? 34 GLU A N 1 +ATOM 220 C CA . GLU A 1 34 ? 21.856 40.969 12.803 1.00 25.55 ? 34 GLU A CA 1 +ATOM 221 C C . GLU A 1 34 ? 20.875 40.169 13.617 1.00 25.63 ? 34 GLU A C 1 +ATOM 222 O O . GLU A 1 34 ? 21.132 39.742 14.746 1.00 27.93 ? 34 GLU A O 1 +ATOM 223 C CB . GLU A 1 34 ? 22.522 40.055 11.723 1.00 26.76 ? 34 GLU A CB 1 +ATOM 224 C CG . GLU A 1 34 ? 23.622 39.043 12.111 1.00 31.11 ? 34 GLU A CG 1 +ATOM 225 C CD . GLU A 1 34 ? 23.962 38.082 10.980 1.00 30.05 ? 34 GLU A CD 1 +ATOM 226 O OE1 . GLU A 1 34 ? 24.292 38.549 9.888 1.00 33.89 ? 34 GLU A OE1 1 +ATOM 227 O OE2 . GLU A 1 34 ? 23.871 36.866 11.192 1.00 29.12 ? 34 GLU A OE2 1 +ATOM 228 N N . GLY A 1 35 ? 19.679 40.132 13.043 1.00 26.41 ? 35 GLY A N 1 +ATOM 229 C CA . GLY A 1 35 ? 18.592 39.392 13.639 1.00 27.33 ? 35 GLY A CA 1 +ATOM 230 C C . GLY A 1 35 ? 18.043 38.412 12.626 1.00 25.44 ? 35 GLY A C 1 +ATOM 231 O O . GLY A 1 35 ? 18.141 38.621 11.412 1.00 26.03 ? 35 GLY A O 1 +ATOM 232 N N . ASP A 1 36 ? 17.480 37.334 13.151 1.00 28.36 ? 36 ASP A N 1 +ATOM 233 C CA . ASP A 1 36 ? 16.861 36.299 12.324 1.00 33.40 ? 36 ASP A CA 1 +ATOM 234 C C . ASP A 1 36 ? 15.595 35.956 13.083 1.00 32.74 ? 36 ASP A C 1 +ATOM 235 O O . ASP A 1 36 ? 15.588 35.086 13.964 1.00 31.31 ? 36 ASP A O 1 +ATOM 236 C CB . ASP A 1 36 ? 17.757 35.056 12.231 1.00 39.03 ? 36 ASP A CB 1 +ATOM 237 C CG . ASP A 1 36 ? 17.648 34.205 10.962 1.00 44.34 ? 36 ASP A CG 1 +ATOM 238 O OD1 . ASP A 1 36 ? 16.683 34.305 10.205 1.00 44.45 ? 36 ASP A OD1 1 +ATOM 239 O OD2 . ASP A 1 36 ? 18.576 33.426 10.733 1.00 51.31 ? 36 ASP A OD2 1 +ATOM 240 N N . ALA A 1 37 ? 14.530 36.706 12.772 1.00 30.68 ? 37 ALA A N 1 +ATOM 241 C CA . ALA A 1 37 ? 13.250 36.493 13.434 1.00 33.00 ? 37 ALA A CA 1 +ATOM 242 C C . ALA A 1 37 ? 12.697 35.068 13.264 1.00 30.21 ? 37 ALA A C 1 +ATOM 243 O O . ALA A 1 37 ? 11.965 34.553 14.113 1.00 26.95 ? 37 ALA A O 1 +ATOM 244 C CB . ALA A 1 37 ? 12.242 37.464 12.873 1.00 29.36 ? 37 ALA A CB 1 +ATOM 245 N N . THR A 1 38 ? 13.086 34.451 12.144 1.00 28.96 ? 38 THR A N 1 +ATOM 246 C CA . THR A 1 38 ? 12.746 33.070 11.828 1.00 29.46 ? 38 THR A CA 1 +ATOM 247 C C . THR A 1 38 ? 13.182 32.092 12.914 1.00 32.24 ? 38 THR A C 1 +ATOM 248 O O . THR A 1 38 ? 12.437 31.167 13.262 1.00 32.05 ? 38 THR A O 1 +ATOM 249 C CB . THR A 1 38 ? 13.405 32.731 10.520 1.00 29.29 ? 38 THR A CB 1 +ATOM 250 O OG1 . THR A 1 38 ? 12.801 33.642 9.612 1.00 24.84 ? 38 THR A OG1 1 +ATOM 251 C CG2 . THR A 1 38 ? 13.259 31.263 10.097 1.00 29.12 ? 38 THR A CG2 1 +ATOM 252 N N . TYR A 1 39 ? 14.405 32.316 13.436 1.00 29.71 ? 39 TYR A N 1 +ATOM 253 C CA . TYR A 1 39 ? 14.911 31.522 14.544 1.00 28.04 ? 39 TYR A CA 1 +ATOM 254 C C . TYR A 1 39 ? 14.734 32.244 15.857 1.00 26.25 ? 39 TYR A C 1 +ATOM 255 O O . TYR A 1 39 ? 14.823 31.650 16.930 1.00 32.36 ? 39 TYR A O 1 +ATOM 256 C CB . TYR A 1 39 ? 16.399 31.185 14.297 1.00 34.83 ? 39 TYR A CB 1 +ATOM 257 C CG . TYR A 1 39 ? 16.510 30.292 13.063 1.00 33.85 ? 39 TYR A CG 1 +ATOM 258 C CD1 . TYR A 1 39 ? 16.020 28.998 13.127 1.00 38.44 ? 39 TYR A CD1 1 +ATOM 259 C CD2 . TYR A 1 39 ? 16.981 30.788 11.849 1.00 34.15 ? 39 TYR A CD2 1 +ATOM 260 C CE1 . TYR A 1 39 ? 15.977 28.202 11.976 1.00 38.99 ? 39 TYR A CE1 1 +ATOM 261 C CE2 . TYR A 1 39 ? 16.942 30.005 10.697 1.00 34.07 ? 39 TYR A CE2 1 +ATOM 262 C CZ . TYR A 1 39 ? 16.428 28.709 10.768 1.00 39.30 ? 39 TYR A CZ 1 +ATOM 263 O OH . TYR A 1 39 ? 16.313 27.920 9.635 1.00 40.97 ? 39 TYR A OH 1 +ATOM 264 N N . GLY A 1 40 ? 14.395 33.524 15.822 1.00 25.80 ? 40 GLY A N 1 +ATOM 265 C CA . GLY A 1 40 ? 14.205 34.296 17.036 1.00 28.27 ? 40 GLY A CA 1 +ATOM 266 C C . GLY A 1 40 ? 15.513 34.744 17.655 1.00 23.64 ? 40 GLY A C 1 +ATOM 267 O O . GLY A 1 40 ? 15.541 35.014 18.859 1.00 25.75 ? 40 GLY A O 1 +ATOM 268 N N . LYS A 1 41 ? 16.561 34.821 16.825 1.00 22.55 ? 41 LYS A N 1 +ATOM 269 C CA . LYS A 1 41 ? 17.874 35.212 17.309 1.00 29.35 ? 41 LYS A CA 1 +ATOM 270 C C . LYS A 1 41 ? 18.520 36.508 16.795 1.00 27.62 ? 41 LYS A C 1 +ATOM 271 O O . LYS A 1 41 ? 18.453 36.986 15.651 1.00 24.28 ? 41 LYS A O 1 +ATOM 272 C CB . LYS A 1 41 ? 18.855 34.051 17.102 1.00 33.39 ? 41 LYS A CB 1 +ATOM 273 C CG . LYS A 1 41 ? 19.250 33.648 15.707 1.00 45.00 ? 41 LYS A CG 1 +ATOM 274 C CD . LYS A 1 41 ? 20.442 32.688 15.731 1.00 50.28 ? 41 LYS A CD 1 +ATOM 275 C CE . LYS A 1 41 ? 21.757 33.372 16.113 1.00 52.65 ? 41 LYS A CE 1 +ATOM 276 N NZ . LYS A 1 41 ? 22.856 32.423 16.042 1.00 46.84 ? 41 LYS A NZ 1 +ATOM 277 N N . LEU A 1 42 ? 19.064 37.091 17.859 1.00 26.85 ? 42 LEU A N 1 +ATOM 278 C CA . LEU A 1 42 ? 19.788 38.351 17.850 1.00 32.33 ? 42 LEU A CA 1 +ATOM 279 C C . LEU A 1 42 ? 21.241 38.042 18.133 1.00 32.45 ? 42 LEU A C 1 +ATOM 280 O O . LEU A 1 42 ? 21.564 37.165 18.940 1.00 35.53 ? 42 LEU A O 1 +ATOM 281 C CB . LEU A 1 42 ? 19.252 39.280 18.948 1.00 31.73 ? 42 LEU A CB 1 +ATOM 282 C CG . LEU A 1 42 ? 17.887 39.786 18.627 1.00 36.58 ? 42 LEU A CG 1 +ATOM 283 C CD1 . LEU A 1 42 ? 17.191 40.243 19.892 1.00 39.86 ? 42 LEU A CD1 1 +ATOM 284 C CD2 . LEU A 1 42 ? 18.006 40.902 17.651 1.00 38.24 ? 42 LEU A CD2 1 +ATOM 285 N N . THR A 1 43 ? 22.099 38.775 17.430 1.00 34.61 ? 43 THR A N 1 +ATOM 286 C CA . THR A 1 43 ? 23.555 38.693 17.533 1.00 30.41 ? 43 THR A CA 1 +ATOM 287 C C . THR A 1 43 ? 23.955 40.152 17.480 1.00 29.66 ? 43 THR A C 1 +ATOM 288 O O . THR A 1 43 ? 23.961 40.749 16.401 1.00 30.89 ? 43 THR A O 1 +ATOM 289 C CB . THR A 1 43 ? 24.171 37.955 16.329 1.00 31.73 ? 43 THR A CB 1 +ATOM 290 O OG1 . THR A 1 43 ? 23.769 36.611 16.495 1.00 40.59 ? 43 THR A OG1 1 +ATOM 291 C CG2 . THR A 1 43 ? 25.693 38.031 16.231 1.00 36.43 ? 43 THR A CG2 1 +ATOM 292 N N . LEU A 1 44 ? 24.258 40.772 18.618 1.00 24.79 ? 44 LEU A N 1 +ATOM 293 C CA . LEU A 1 44 ? 24.642 42.157 18.580 1.00 25.99 ? 44 LEU A CA 1 +ATOM 294 C C . LEU A 1 44 ? 25.938 42.413 19.300 1.00 29.66 ? 44 LEU A C 1 +ATOM 295 O O . LEU A 1 44 ? 26.222 41.760 20.306 1.00 32.45 ? 44 LEU A O 1 +ATOM 296 C CB . LEU A 1 44 ? 23.539 42.986 19.196 1.00 23.19 ? 44 LEU A CB 1 +ATOM 297 C CG . LEU A 1 44 ? 22.225 43.050 18.431 1.00 23.13 ? 44 LEU A CG 1 +ATOM 298 C CD1 . LEU A 1 44 ? 21.108 43.683 19.251 1.00 26.61 ? 44 LEU A CD1 1 +ATOM 299 C CD2 . LEU A 1 44 ? 22.473 43.869 17.195 1.00 16.38 ? 44 LEU A CD2 1 +ATOM 300 N N . LYS A 1 45 ? 26.753 43.324 18.757 1.00 28.04 ? 45 LYS A N 1 +ATOM 301 C CA . LYS A 1 45 ? 27.961 43.753 19.443 1.00 30.33 ? 45 LYS A CA 1 +ATOM 302 C C . LYS A 1 45 ? 27.903 45.249 19.686 1.00 29.85 ? 45 LYS A C 1 +ATOM 303 O O . LYS A 1 45 ? 27.789 46.056 18.767 1.00 26.75 ? 45 LYS A O 1 +ATOM 304 C CB . LYS A 1 45 ? 29.203 43.469 18.620 1.00 38.49 ? 45 LYS A CB 1 +ATOM 305 C CG . LYS A 1 45 ? 30.499 43.909 19.316 1.00 38.60 ? 45 LYS A CG 1 +ATOM 306 C CD . LYS A 1 45 ? 31.642 43.619 18.383 1.00 44.91 ? 45 LYS A CD 1 +ATOM 307 C CE . LYS A 1 45 ? 32.925 43.992 19.093 1.00 49.38 ? 45 LYS A CE 1 +ATOM 308 N NZ . LYS A 1 45 ? 34.015 43.803 18.165 1.00 52.61 ? 45 LYS A NZ 1 +ATOM 309 N N . PHE A 1 46 ? 28.044 45.599 20.959 1.00 32.16 ? 46 PHE A N 1 +ATOM 310 C CA . PHE A 1 46 ? 27.963 46.975 21.436 1.00 31.81 ? 46 PHE A CA 1 +ATOM 311 C C . PHE A 1 46 ? 29.315 47.497 21.858 1.00 31.45 ? 46 PHE A C 1 +ATOM 312 O O . PHE A 1 46 ? 29.968 46.853 22.661 1.00 32.70 ? 46 PHE A O 1 +ATOM 313 C CB . PHE A 1 46 ? 27.039 47.065 22.641 1.00 31.98 ? 46 PHE A CB 1 +ATOM 314 C CG . PHE A 1 46 ? 25.685 46.480 22.318 1.00 32.26 ? 46 PHE A CG 1 +ATOM 315 C CD1 . PHE A 1 46 ? 24.751 47.233 21.592 1.00 29.23 ? 46 PHE A CD1 1 +ATOM 316 C CD2 . PHE A 1 46 ? 25.434 45.153 22.672 1.00 30.37 ? 46 PHE A CD2 1 +ATOM 317 C CE1 . PHE A 1 46 ? 23.553 46.645 21.209 1.00 28.22 ? 46 PHE A CE1 1 +ATOM 318 C CE2 . PHE A 1 46 ? 24.233 44.572 22.287 1.00 33.96 ? 46 PHE A CE2 1 +ATOM 319 C CZ . PHE A 1 46 ? 23.301 45.318 21.555 1.00 33.55 ? 46 PHE A CZ 1 +ATOM 320 N N . ILE A 1 47 ? 29.731 48.635 21.312 1.00 28.64 ? 47 ILE A N 1 +ATOM 321 C CA . ILE A 1 47 ? 30.957 49.318 21.670 1.00 28.80 ? 47 ILE A CA 1 +ATOM 322 C C . ILE A 1 47 ? 30.598 50.539 22.501 1.00 31.63 ? 47 ILE A C 1 +ATOM 323 O O . ILE A 1 47 ? 29.602 51.182 22.204 1.00 30.67 ? 47 ILE A O 1 +ATOM 324 C CB . ILE A 1 47 ? 31.729 49.783 20.404 1.00 27.39 ? 47 ILE A CB 1 +ATOM 325 C CG1 . ILE A 1 47 ? 32.200 48.578 19.625 1.00 23.26 ? 47 ILE A CG1 1 +ATOM 326 C CG2 . ILE A 1 47 ? 32.939 50.627 20.776 1.00 27.15 ? 47 ILE A CG2 1 +ATOM 327 C CD1 . ILE A 1 47 ? 32.976 47.539 20.468 1.00 28.03 ? 47 ILE A CD1 1 +ATOM 328 N N . CYS A 1 48 ? 31.359 50.894 23.538 1.00 29.98 ? 48 CYS A N 1 +ATOM 329 C CA . CYS A 1 48 ? 31.065 52.121 24.235 1.00 31.39 ? 48 CYS A CA 1 +ATOM 330 C C . CYS A 1 48 ? 31.956 53.141 23.563 1.00 32.16 ? 48 CYS A C 1 +ATOM 331 O O . CYS A 1 48 ? 33.143 53.192 23.845 1.00 38.69 ? 48 CYS A O 1 +ATOM 332 C CB . CYS A 1 48 ? 31.409 51.997 25.702 1.00 33.18 ? 48 CYS A CB 1 +ATOM 333 S SG . CYS A 1 48 ? 30.754 53.506 26.436 1.00 35.89 ? 48 CYS A SG 1 +ATOM 334 N N . THR A 1 49 ? 31.437 53.943 22.629 1.00 32.49 ? 49 THR A N 1 +ATOM 335 C CA . THR A 1 49 ? 32.261 54.875 21.856 1.00 33.09 ? 49 THR A CA 1 +ATOM 336 C C . THR A 1 49 ? 32.768 56.137 22.555 1.00 32.01 ? 49 THR A C 1 +ATOM 337 O O . THR A 1 49 ? 33.538 56.906 21.993 1.00 31.54 ? 49 THR A O 1 +ATOM 338 C CB . THR A 1 49 ? 31.496 55.279 20.601 1.00 32.94 ? 49 THR A CB 1 +ATOM 339 O OG1 . THR A 1 49 ? 30.223 55.687 21.055 1.00 35.88 ? 49 THR A OG1 1 +ATOM 340 C CG2 . THR A 1 49 ? 31.379 54.168 19.572 1.00 37.74 ? 49 THR A CG2 1 +ATOM 341 N N . THR A 1 50 ? 32.294 56.347 23.779 1.00 34.87 ? 50 THR A N 1 +ATOM 342 C CA . THR A 1 50 ? 32.677 57.423 24.661 1.00 34.37 ? 50 THR A CA 1 +ATOM 343 C C . THR A 1 50 ? 33.673 56.949 25.719 1.00 38.79 ? 50 THR A C 1 +ATOM 344 O O . THR A 1 50 ? 33.937 57.648 26.701 1.00 42.69 ? 50 THR A O 1 +ATOM 345 C CB . THR A 1 50 ? 31.414 57.989 25.339 1.00 33.83 ? 50 THR A CB 1 +ATOM 346 O OG1 . THR A 1 50 ? 30.749 56.900 25.961 1.00 34.99 ? 50 THR A OG1 1 +ATOM 347 C CG2 . THR A 1 50 ? 30.542 58.760 24.351 1.00 32.37 ? 50 THR A CG2 1 +ATOM 348 N N . GLY A 1 51 ? 34.246 55.746 25.580 1.00 40.45 ? 51 GLY A N 1 +ATOM 349 C CA . GLY A 1 51 ? 35.185 55.239 26.563 1.00 39.46 ? 51 GLY A CA 1 +ATOM 350 C C . GLY A 1 51 ? 34.630 54.035 27.268 1.00 41.91 ? 51 GLY A C 1 +ATOM 351 O O . GLY A 1 51 ? 34.282 53.024 26.650 1.00 42.07 ? 51 GLY A O 1 +ATOM 352 N N . LYS A 1 52 ? 34.574 54.175 28.590 1.00 45.66 ? 52 LYS A N 1 +ATOM 353 C CA . LYS A 1 52 ? 34.056 53.125 29.442 1.00 49.54 ? 52 LYS A CA 1 +ATOM 354 C C . LYS A 1 52 ? 32.620 53.364 29.877 1.00 51.21 ? 52 LYS A C 1 +ATOM 355 O O . LYS A 1 52 ? 32.183 54.491 30.119 1.00 50.87 ? 52 LYS A O 1 +ATOM 356 C CB . LYS A 1 52 ? 34.950 52.992 30.663 1.00 51.51 ? 52 LYS A CB 1 +ATOM 357 C CG . LYS A 1 52 ? 35.380 51.525 30.757 1.00 52.99 ? 52 LYS A CG 1 +ATOM 358 C CD . LYS A 1 52 ? 36.833 51.317 31.158 1.00 50.87 ? 52 LYS A CD 1 +ATOM 359 C CE . LYS A 1 52 ? 37.770 51.735 30.042 1.00 57.01 ? 52 LYS A CE 1 +ATOM 360 N NZ . LYS A 1 52 ? 37.603 50.923 28.845 1.00 58.98 ? 52 LYS A NZ 1 +ATOM 361 N N . LEU A 1 53 ? 31.875 52.252 29.936 1.00 52.38 ? 53 LEU A N 1 +ATOM 362 C CA . LEU A 1 53 ? 30.478 52.244 30.343 1.00 46.26 ? 53 LEU A CA 1 +ATOM 363 C C . LEU A 1 53 ? 30.355 52.552 31.837 1.00 42.39 ? 53 LEU A C 1 +ATOM 364 O O . LEU A 1 53 ? 30.792 51.761 32.687 1.00 43.62 ? 53 LEU A O 1 +ATOM 365 C CB . LEU A 1 53 ? 29.920 50.869 30.004 1.00 48.06 ? 53 LEU A CB 1 +ATOM 366 C CG . LEU A 1 53 ? 28.698 50.653 29.106 1.00 48.77 ? 53 LEU A CG 1 +ATOM 367 C CD1 . LEU A 1 53 ? 27.586 50.193 29.979 1.00 48.54 ? 53 LEU A CD1 1 +ATOM 368 C CD2 . LEU A 1 53 ? 28.290 51.889 28.352 1.00 48.82 ? 53 LEU A CD2 1 +ATOM 369 N N . PRO A 1 54 ? 29.766 53.688 32.222 1.00 37.46 ? 54 PRO A N 1 +ATOM 370 C CA . PRO A 1 54 ? 29.500 54.033 33.611 1.00 37.21 ? 54 PRO A CA 1 +ATOM 371 C C . PRO A 1 54 ? 28.600 53.077 34.370 1.00 36.64 ? 54 PRO A C 1 +ATOM 372 O O . PRO A 1 54 ? 28.526 53.096 35.598 1.00 41.06 ? 54 PRO A O 1 +ATOM 373 C CB . PRO A 1 54 ? 28.922 55.427 33.561 1.00 40.08 ? 54 PRO A CB 1 +ATOM 374 C CG . PRO A 1 54 ? 28.249 55.450 32.221 1.00 39.88 ? 54 PRO A CG 1 +ATOM 375 C CD . PRO A 1 54 ? 29.249 54.711 31.329 1.00 38.56 ? 54 PRO A CD 1 +ATOM 376 N N . VAL A 1 55 ? 27.894 52.235 33.639 1.00 36.30 ? 55 VAL A N 1 +ATOM 377 C CA . VAL A 1 55 ? 27.015 51.212 34.210 1.00 37.28 ? 55 VAL A CA 1 +ATOM 378 C C . VAL A 1 55 ? 27.449 49.796 33.776 1.00 34.68 ? 55 VAL A C 1 +ATOM 379 O O . VAL A 1 55 ? 28.275 49.666 32.871 1.00 35.79 ? 55 VAL A O 1 +ATOM 380 C CB . VAL A 1 55 ? 25.591 51.558 33.747 1.00 36.44 ? 55 VAL A CB 1 +ATOM 381 C CG1 . VAL A 1 55 ? 25.171 52.848 34.396 1.00 33.61 ? 55 VAL A CG1 1 +ATOM 382 C CG2 . VAL A 1 55 ? 25.532 51.795 32.242 1.00 35.68 ? 55 VAL A CG2 1 +ATOM 383 N N . PRO A 1 56 ? 27.017 48.673 34.356 1.00 32.41 ? 56 PRO A N 1 +ATOM 384 C CA . PRO A 1 56 ? 27.377 47.346 33.879 1.00 28.70 ? 56 PRO A CA 1 +ATOM 385 C C . PRO A 1 56 ? 26.595 47.060 32.602 1.00 33.63 ? 56 PRO A C 1 +ATOM 386 O O . PRO A 1 56 ? 25.396 47.343 32.498 1.00 38.57 ? 56 PRO A O 1 +ATOM 387 C CB . PRO A 1 56 ? 27.027 46.440 35.030 1.00 27.62 ? 56 PRO A CB 1 +ATOM 388 C CG . PRO A 1 56 ? 26.721 47.326 36.203 1.00 24.02 ? 56 PRO A CG 1 +ATOM 389 C CD . PRO A 1 56 ? 26.167 48.576 35.533 1.00 28.60 ? 56 PRO A CD 1 +ATOM 390 N N . TRP A 1 57 ? 27.265 46.524 31.583 1.00 34.22 ? 57 TRP A N 1 +ATOM 391 C CA . TRP A 1 57 ? 26.644 46.176 30.316 1.00 32.72 ? 57 TRP A CA 1 +ATOM 392 C C . TRP A 1 57 ? 25.346 45.400 30.441 1.00 33.49 ? 57 TRP A C 1 +ATOM 393 O O . TRP A 1 57 ? 24.413 45.818 29.760 1.00 37.67 ? 57 TRP A O 1 +ATOM 394 C CB . TRP A 1 57 ? 27.596 45.362 29.497 1.00 33.09 ? 57 TRP A CB 1 +ATOM 395 C CG . TRP A 1 57 ? 28.667 46.141 28.779 1.00 24.88 ? 57 TRP A CG 1 +ATOM 396 C CD1 . TRP A 1 57 ? 29.961 46.062 29.181 1.00 20.05 ? 57 TRP A CD1 1 +ATOM 397 C CD2 . TRP A 1 57 ? 28.471 46.916 27.671 1.00 19.65 ? 57 TRP A CD2 1 +ATOM 398 N NE1 . TRP A 1 57 ? 30.616 46.793 28.320 1.00 25.80 ? 57 TRP A NE1 1 +ATOM 399 C CE2 . TRP A 1 57 ? 29.780 47.327 27.406 1.00 22.95 ? 57 TRP A CE2 1 +ATOM 400 C CE3 . TRP A 1 57 ? 27.418 47.342 26.864 1.00 19.53 ? 57 TRP A CE3 1 +ATOM 401 C CZ2 . TRP A 1 57 ? 30.062 48.178 26.330 1.00 17.93 ? 57 TRP A CZ2 1 +ATOM 402 C CZ3 . TRP A 1 57 ? 27.706 48.192 25.789 1.00 22.88 ? 57 TRP A CZ3 1 +ATOM 403 C CH2 . TRP A 1 57 ? 29.015 48.611 25.525 1.00 23.42 ? 57 TRP A CH2 1 +ATOM 404 N N . PRO A 1 58 ? 25.195 44.360 31.304 1.00 32.23 ? 58 PRO A N 1 +ATOM 405 C CA . PRO A 1 58 ? 23.934 43.705 31.641 1.00 30.70 ? 58 PRO A CA 1 +ATOM 406 C C . PRO A 1 58 ? 22.674 44.533 31.828 1.00 35.19 ? 58 PRO A C 1 +ATOM 407 O O . PRO A 1 58 ? 21.571 44.138 31.425 1.00 40.93 ? 58 PRO A O 1 +ATOM 408 C CB . PRO A 1 58 ? 24.256 42.944 32.877 1.00 32.13 ? 58 PRO A CB 1 +ATOM 409 C CG . PRO A 1 58 ? 25.614 42.458 32.576 1.00 34.35 ? 58 PRO A CG 1 +ATOM 410 C CD . PRO A 1 58 ? 26.280 43.685 32.006 1.00 24.59 ? 58 PRO A CD 1 +ATOM 411 N N . THR A 1 59 ? 22.850 45.675 32.515 1.00 34.11 ? 59 THR A N 1 +ATOM 412 C CA . THR A 1 59 ? 21.776 46.619 32.751 1.00 26.64 ? 59 THR A CA 1 +ATOM 413 C C . THR A 1 59 ? 21.304 47.276 31.461 1.00 27.32 ? 59 THR A C 1 +ATOM 414 O O . THR A 1 59 ? 20.280 47.949 31.485 1.00 28.89 ? 59 THR A O 1 +ATOM 415 C CB . THR A 1 59 ? 22.233 47.696 33.754 1.00 24.88 ? 59 THR A CB 1 +ATOM 416 O OG1 . THR A 1 59 ? 23.224 48.457 33.103 1.00 23.29 ? 59 THR A OG1 1 +ATOM 417 C CG2 . THR A 1 59 ? 22.735 47.122 35.061 1.00 20.80 ? 59 THR A CG2 1 +ATOM 418 N N . LEU A 1 60 ? 21.979 47.097 30.315 1.00 26.47 ? 60 LEU A N 1 +ATOM 419 C CA . LEU A 1 60 ? 21.520 47.711 29.088 1.00 29.82 ? 60 LEU A CA 1 +ATOM 420 C C . LEU A 1 60 ? 21.113 46.710 28.011 1.00 31.64 ? 60 LEU A C 1 +ATOM 421 O O . LEU A 1 60 ? 20.790 47.115 26.879 1.00 28.44 ? 60 LEU A O 1 +ATOM 422 C CB . LEU A 1 60 ? 22.604 48.663 28.521 1.00 34.74 ? 60 LEU A CB 1 +ATOM 423 C CG . LEU A 1 60 ? 23.314 49.760 29.375 1.00 38.46 ? 60 LEU A CG 1 +ATOM 424 C CD1 . LEU A 1 60 ? 24.189 50.623 28.480 1.00 33.24 ? 60 LEU A CD1 1 +ATOM 425 C CD2 . LEU A 1 60 ? 22.310 50.644 30.055 1.00 30.26 ? 60 LEU A CD2 1 +ATOM 426 N N . VAL A 1 61 ? 21.053 45.395 28.329 1.00 30.09 ? 61 VAL A N 1 +ATOM 427 C CA . VAL A 1 61 ? 20.666 44.406 27.316 1.00 28.59 ? 61 VAL A CA 1 +ATOM 428 C C . VAL A 1 61 ? 19.299 44.778 26.760 1.00 33.06 ? 61 VAL A C 1 +ATOM 429 O O . VAL A 1 61 ? 19.269 45.178 25.596 1.00 36.23 ? 61 VAL A O 1 +ATOM 430 C CB . VAL A 1 61 ? 20.573 42.994 27.874 1.00 22.98 ? 61 VAL A CB 1 +ATOM 431 C CG1 . VAL A 1 61 ? 20.207 42.069 26.751 1.00 17.57 ? 61 VAL A CG1 1 +ATOM 432 C CG2 . VAL A 1 61 ? 21.891 42.562 28.458 1.00 26.66 ? 61 VAL A CG2 1 +ATOM 433 N N . THR A 1 62 ? 18.236 44.771 27.601 1.00 32.21 ? 62 THR A N 1 +ATOM 434 C CA . THR A 1 62 ? 16.866 45.117 27.216 1.00 32.02 ? 62 THR A CA 1 +ATOM 435 C C . THR A 1 62 ? 16.726 46.485 26.531 1.00 30.24 ? 62 THR A C 1 +ATOM 436 O O . THR A 1 62 ? 15.920 46.668 25.632 1.00 30.92 ? 62 THR A O 1 +ATOM 437 C CB . THR A 1 62 ? 15.983 45.049 28.470 1.00 32.01 ? 62 THR A CB 1 +ATOM 438 O OG1 . THR A 1 62 ? 16.500 46.048 29.312 1.00 32.45 ? 62 THR A OG1 1 +ATOM 439 C CG2 . THR A 1 62 ? 16.012 43.734 29.231 1.00 24.77 ? 62 THR A CG2 1 +ATOM 440 N N . THR A 1 63 ? 17.528 47.481 26.865 1.00 28.63 ? 63 THR A N 1 +ATOM 441 C CA . THR A 1 63 ? 17.477 48.757 26.170 1.00 30.82 ? 63 THR A CA 1 +ATOM 442 C C . THR A 1 63 ? 17.960 48.561 24.736 1.00 31.18 ? 63 THR A C 1 +ATOM 443 O O . THR A 1 63 ? 17.377 49.082 23.784 1.00 36.12 ? 63 THR A O 1 +ATOM 444 C CB . THR A 1 63 ? 18.354 49.741 26.987 1.00 26.47 ? 63 THR A CB 1 +ATOM 445 O OG1 . THR A 1 63 ? 17.595 50.064 28.133 1.00 28.88 ? 63 THR A OG1 1 +ATOM 446 C CG2 . THR A 1 63 ? 18.731 50.980 26.258 1.00 31.88 ? 63 THR A CG2 1 +ATOM 447 N N . PHE A 1 64 ? 19.039 47.769 24.560 1.00 36.08 ? 64 PHE A N 1 +ATOM 448 C CA . PHE A 1 64 ? 19.672 47.465 23.271 1.00 32.12 ? 64 PHE A CA 1 +ATOM 449 C C . PHE A 1 64 ? 18.907 46.476 22.435 1.00 27.83 ? 64 PHE A C 1 +ATOM 450 O O . PHE A 1 64 ? 18.815 46.598 21.216 1.00 23.43 ? 64 PHE A O 1 +ATOM 451 C CB . PHE A 1 64 ? 21.067 46.858 23.427 1.00 32.47 ? 64 PHE A CB 1 +ATOM 452 C CG . PHE A 1 64 ? 22.162 47.697 24.069 1.00 31.76 ? 64 PHE A CG 1 +ATOM 453 C CD1 . PHE A 1 64 ? 22.224 49.075 23.873 1.00 30.31 ? 64 PHE A CD1 1 +ATOM 454 C CD2 . PHE A 1 64 ? 23.071 47.065 24.920 1.00 31.74 ? 64 PHE A CD2 1 +ATOM 455 C CE1 . PHE A 1 64 ? 23.187 49.813 24.540 1.00 19.96 ? 64 PHE A CE1 1 +ATOM 456 C CE2 . PHE A 1 64 ? 24.031 47.809 25.583 1.00 26.95 ? 64 PHE A CE2 1 +ATOM 457 C CZ . PHE A 1 64 ? 24.084 49.185 25.393 1.00 26.32 ? 64 PHE A CZ 1 +HETATM 458 N N1 . CRO A 1 65 ? 18.476 45.453 23.152 1.00 35.11 ? 66 CRO A N1 1 +HETATM 459 C CA1 . CRO A 1 65 ? 17.704 44.316 22.645 1.00 55.88 ? 66 CRO A CA1 1 +HETATM 460 C CB1 . CRO A 1 65 ? 18.576 43.123 22.772 1.00 48.02 ? 66 CRO A CB1 1 +HETATM 461 O OG1 . CRO A 1 65 ? 18.283 42.340 21.597 1.00 53.90 ? 66 CRO A OG1 1 +HETATM 462 C C1 . CRO A 1 65 ? 16.420 44.177 23.475 1.00 40.31 ? 66 CRO A C1 1 +HETATM 463 N N2 . CRO A 1 65 ? 16.297 43.176 24.397 1.00 41.56 ? 66 CRO A N2 1 +HETATM 464 N N3 . CRO A 1 65 ? 15.372 45.020 23.385 1.00 29.70 ? 66 CRO A N3 1 +HETATM 465 C C2 . CRO A 1 65 ? 14.420 44.654 24.215 1.00 37.06 ? 66 CRO A C2 1 +HETATM 466 O O2 . CRO A 1 65 ? 13.325 45.210 24.361 1.00 41.80 ? 66 CRO A O2 1 +HETATM 467 C CA2 . CRO A 1 65 ? 14.968 43.448 24.923 1.00 36.74 ? 66 CRO A CA2 1 +HETATM 468 C CA3 . CRO A 1 65 ? 15.249 46.155 22.548 1.00 18.10 ? 66 CRO A CA3 1 +HETATM 469 C C3 . CRO A 1 65 ? 14.886 46.174 21.130 1.00 21.90 ? 66 CRO A C3 1 +HETATM 470 O O3 . CRO A 1 65 ? 14.600 47.298 20.684 1.00 23.79 ? 66 CRO A O3 1 +HETATM 471 C CB2 . CRO A 1 65 ? 14.334 42.744 25.916 1.00 30.20 ? 66 CRO A CB2 1 +HETATM 472 C CG2 . CRO A 1 65 ? 14.722 41.634 26.617 1.00 26.34 ? 66 CRO A CG2 1 +HETATM 473 C CD1 . CRO A 1 65 ? 15.957 41.002 26.477 1.00 31.93 ? 66 CRO A CD1 1 +HETATM 474 C CD2 . CRO A 1 65 ? 13.815 41.166 27.551 1.00 30.25 ? 66 CRO A CD2 1 +HETATM 475 C CE1 . CRO A 1 65 ? 16.282 39.887 27.269 1.00 27.87 ? 66 CRO A CE1 1 +HETATM 476 C CE2 . CRO A 1 65 ? 14.128 40.060 28.336 1.00 35.40 ? 66 CRO A CE2 1 +HETATM 477 C CZ . CRO A 1 65 ? 15.363 39.433 28.195 1.00 28.55 ? 66 CRO A CZ 1 +HETATM 478 O OH . CRO A 1 65 ? 15.641 38.344 28.982 1.00 28.62 ? 66 CRO A OH 1 +ATOM 479 N N . VAL A 1 66 ? 14.988 45.060 20.391 1.00 19.04 ? 68 VAL A N 1 +ATOM 480 C CA . VAL A 1 66 ? 14.502 45.062 19.019 1.00 19.12 ? 68 VAL A CA 1 +ATOM 481 C C . VAL A 1 66 ? 13.588 43.848 18.835 1.00 23.09 ? 68 VAL A C 1 +ATOM 482 O O . VAL A 1 66 ? 13.645 43.094 17.844 1.00 24.78 ? 68 VAL A O 1 +ATOM 483 C CB . VAL A 1 66 ? 15.696 45.035 18.015 1.00 17.23 ? 68 VAL A CB 1 +ATOM 484 C CG1 . VAL A 1 66 ? 16.177 46.448 17.942 1.00 16.34 ? 68 VAL A CG1 1 +ATOM 485 C CG2 . VAL A 1 66 ? 16.823 44.081 18.398 1.00 15.88 ? 68 VAL A CG2 1 +ATOM 486 N N . GLN A 1 67 ? 12.673 43.742 19.822 1.00 18.29 ? 69 GLN A N 1 +ATOM 487 C CA . GLN A 1 67 ? 11.810 42.589 19.962 1.00 14.96 ? 69 GLN A CA 1 +ATOM 488 C C . GLN A 1 67 ? 11.010 42.201 18.763 1.00 11.16 ? 69 GLN A C 1 +ATOM 489 O O . GLN A 1 67 ? 10.326 41.209 18.795 1.00 21.29 ? 69 GLN A O 1 +ATOM 490 C CB . GLN A 1 67 ? 10.882 42.794 21.116 1.00 14.62 ? 69 GLN A CB 1 +ATOM 491 C CG . GLN A 1 67 ? 11.584 42.728 22.473 1.00 22.55 ? 69 GLN A CG 1 +ATOM 492 C CD . GLN A 1 67 ? 10.743 43.350 23.572 1.00 24.78 ? 69 GLN A CD 1 +ATOM 493 O OE1 . GLN A 1 67 ? 10.282 44.473 23.399 1.00 33.21 ? 69 GLN A OE1 1 +ATOM 494 N NE2 . GLN A 1 67 ? 10.492 42.708 24.708 1.00 26.72 ? 69 GLN A NE2 1 +ATOM 495 N N . CYS A 1 68 ? 11.056 42.972 17.686 1.00 14.26 ? 70 CYS A N 1 +ATOM 496 C CA . CYS A 1 68 ? 10.534 42.675 16.370 1.00 18.77 ? 70 CYS A CA 1 +ATOM 497 C C . CYS A 1 68 ? 11.324 41.544 15.687 1.00 31.60 ? 70 CYS A C 1 +ATOM 498 O O . CYS A 1 68 ? 11.108 41.235 14.505 1.00 35.81 ? 70 CYS A O 1 +ATOM 499 C CB . CYS A 1 68 ? 10.654 43.910 15.573 1.00 16.75 ? 70 CYS A CB 1 +ATOM 500 S SG . CYS A 1 68 ? 12.371 44.478 15.573 1.00 37.45 ? 70 CYS A SG 1 +ATOM 501 N N . PHE A 1 69 ? 12.356 41.006 16.381 1.00 31.80 ? 71 PHE A N 1 +ATOM 502 C CA . PHE A 1 69 ? 13.175 39.909 15.920 1.00 28.71 ? 71 PHE A CA 1 +ATOM 503 C C . PHE A 1 69 ? 12.857 38.638 16.665 1.00 30.89 ? 71 PHE A C 1 +ATOM 504 O O . PHE A 1 69 ? 13.538 37.624 16.499 1.00 29.48 ? 71 PHE A O 1 +ATOM 505 C CB . PHE A 1 69 ? 14.653 40.159 16.104 1.00 24.27 ? 71 PHE A CB 1 +ATOM 506 C CG . PHE A 1 69 ? 15.161 41.044 15.010 1.00 17.64 ? 71 PHE A CG 1 +ATOM 507 C CD1 . PHE A 1 69 ? 15.243 40.560 13.717 1.00 11.53 ? 71 PHE A CD1 1 +ATOM 508 C CD2 . PHE A 1 69 ? 15.523 42.346 15.314 1.00 20.54 ? 71 PHE A CD2 1 +ATOM 509 C CE1 . PHE A 1 69 ? 15.695 41.387 12.702 1.00 16.03 ? 71 PHE A CE1 1 +ATOM 510 C CE2 . PHE A 1 69 ? 15.973 43.166 14.288 1.00 19.34 ? 71 PHE A CE2 1 +ATOM 511 C CZ . PHE A 1 69 ? 16.061 42.697 12.990 1.00 19.83 ? 71 PHE A CZ 1 +ATOM 512 N N . SER A 1 70 ? 11.796 38.698 17.468 1.00 29.49 ? 72 SER A N 1 +ATOM 513 C CA . SER A 1 70 ? 11.266 37.539 18.149 1.00 32.24 ? 72 SER A CA 1 +ATOM 514 C C . SER A 1 70 ? 10.655 36.598 17.129 1.00 28.59 ? 72 SER A C 1 +ATOM 515 O O . SER A 1 70 ? 10.239 36.988 16.046 1.00 20.19 ? 72 SER A O 1 +ATOM 516 C CB . SER A 1 70 ? 10.174 37.908 19.095 1.00 35.48 ? 72 SER A CB 1 +ATOM 517 O OG . SER A 1 70 ? 10.593 38.955 19.944 1.00 42.78 ? 72 SER A OG 1 +ATOM 518 N N . ARG A 1 71 ? 10.701 35.321 17.493 1.00 33.28 ? 73 ARG A N 1 +ATOM 519 C CA . ARG A 1 71 ? 10.067 34.273 16.723 1.00 31.79 ? 73 ARG A CA 1 +ATOM 520 C C . ARG A 1 71 ? 8.710 34.093 17.400 1.00 28.94 ? 73 ARG A C 1 +ATOM 521 O O . ARG A 1 71 ? 8.577 33.834 18.596 1.00 20.57 ? 73 ARG A O 1 +ATOM 522 C CB . ARG A 1 71 ? 10.879 32.992 16.815 1.00 35.15 ? 73 ARG A CB 1 +ATOM 523 C CG . ARG A 1 71 ? 10.199 31.887 16.047 1.00 41.33 ? 73 ARG A CG 1 +ATOM 524 C CD . ARG A 1 71 ? 10.849 30.533 16.187 1.00 33.58 ? 73 ARG A CD 1 +ATOM 525 N NE . ARG A 1 71 ? 9.782 29.635 15.803 1.00 42.78 ? 73 ARG A NE 1 +ATOM 526 C CZ . ARG A 1 71 ? 9.202 28.831 16.691 1.00 42.26 ? 73 ARG A CZ 1 +ATOM 527 N NH1 . ARG A 1 71 ? 9.620 28.812 17.961 1.00 40.73 ? 73 ARG A NH1 1 +ATOM 528 N NH2 . ARG A 1 71 ? 8.124 28.126 16.322 1.00 41.88 ? 73 ARG A NH2 1 +ATOM 529 N N . TYR A 1 72 ? 7.718 34.420 16.584 1.00 31.21 ? 74 TYR A N 1 +ATOM 530 C CA . TYR A 1 72 ? 6.316 34.244 16.919 1.00 34.61 ? 74 TYR A CA 1 +ATOM 531 C C . TYR A 1 72 ? 5.897 32.987 16.167 1.00 34.06 ? 74 TYR A C 1 +ATOM 532 O O . TYR A 1 72 ? 6.068 32.981 14.937 1.00 35.58 ? 74 TYR A O 1 +ATOM 533 C CB . TYR A 1 72 ? 5.483 35.430 16.424 1.00 37.34 ? 74 TYR A CB 1 +ATOM 534 C CG . TYR A 1 72 ? 5.344 36.522 17.474 1.00 38.02 ? 74 TYR A CG 1 +ATOM 535 C CD1 . TYR A 1 72 ? 6.421 37.364 17.764 1.00 38.41 ? 74 TYR A CD1 1 +ATOM 536 C CD2 . TYR A 1 72 ? 4.123 36.678 18.136 1.00 35.27 ? 74 TYR A CD2 1 +ATOM 537 C CE1 . TYR A 1 72 ? 6.262 38.374 18.724 1.00 42.40 ? 74 TYR A CE1 1 +ATOM 538 C CE2 . TYR A 1 72 ? 3.958 37.673 19.089 1.00 38.31 ? 74 TYR A CE2 1 +ATOM 539 C CZ . TYR A 1 72 ? 5.031 38.518 19.374 1.00 39.21 ? 74 TYR A CZ 1 +ATOM 540 O OH . TYR A 1 72 ? 4.884 39.508 20.306 1.00 36.50 ? 74 TYR A OH 1 +ATOM 541 N N . PRO A 1 73 ? 5.354 31.900 16.778 1.00 32.66 ? 75 PRO A N 1 +ATOM 542 C CA . PRO A 1 73 ? 4.909 30.701 16.062 1.00 34.78 ? 75 PRO A CA 1 +ATOM 543 C C . PRO A 1 73 ? 3.907 31.040 14.976 1.00 40.37 ? 75 PRO A C 1 +ATOM 544 O O . PRO A 1 73 ? 3.256 32.082 15.085 1.00 43.17 ? 75 PRO A O 1 +ATOM 545 C CB . PRO A 1 73 ? 4.353 29.830 17.127 1.00 33.49 ? 75 PRO A CB 1 +ATOM 546 C CG . PRO A 1 73 ? 5.148 30.193 18.357 1.00 35.97 ? 75 PRO A CG 1 +ATOM 547 C CD . PRO A 1 73 ? 5.276 31.697 18.223 1.00 33.32 ? 75 PRO A CD 1 +ATOM 548 N N . ASP A 1 74 ? 3.759 30.242 13.912 1.00 43.74 ? 76 ASP A N 1 +ATOM 549 C CA . ASP A 1 74 ? 2.866 30.602 12.817 1.00 47.20 ? 76 ASP A CA 1 +ATOM 550 C C . ASP A 1 74 ? 1.422 30.974 13.153 1.00 47.98 ? 76 ASP A C 1 +ATOM 551 O O . ASP A 1 74 ? 0.799 31.754 12.419 1.00 50.99 ? 76 ASP A O 1 +ATOM 552 C CB . ASP A 1 74 ? 2.887 29.463 11.792 1.00 49.69 ? 76 ASP A CB 1 +ATOM 553 C CG . ASP A 1 74 ? 4.080 29.578 10.847 1.00 55.42 ? 76 ASP A CG 1 +ATOM 554 O OD1 . ASP A 1 74 ? 5.212 29.533 11.323 1.00 64.23 ? 76 ASP A OD1 1 +ATOM 555 O OD2 . ASP A 1 74 ? 3.890 29.724 9.636 1.00 58.26 ? 76 ASP A OD2 1 +ATOM 556 N N . HIS A 1 75 ? 0.931 30.513 14.315 1.00 46.63 ? 77 HIS A N 1 +ATOM 557 C CA . HIS A 1 75 ? -0.437 30.755 14.741 1.00 43.10 ? 77 HIS A CA 1 +ATOM 558 C C . HIS A 1 75 ? -0.634 32.105 15.382 1.00 46.99 ? 77 HIS A C 1 +ATOM 559 O O . HIS A 1 75 ? -1.640 32.800 15.133 1.00 50.86 ? 77 HIS A O 1 +ATOM 560 C CB . HIS A 1 75 ? -0.904 29.643 15.712 1.00 35.34 ? 77 HIS A CB 1 +ATOM 561 C CG . HIS A 1 75 ? -0.171 29.432 17.027 1.00 29.46 ? 77 HIS A CG 1 +ATOM 562 N ND1 . HIS A 1 75 ? 1.057 28.991 17.228 1.00 32.09 ? 77 HIS A ND1 1 +ATOM 563 C CD2 . HIS A 1 75 ? -0.729 29.637 18.266 1.00 32.89 ? 77 HIS A CD2 1 +ATOM 564 C CE1 . HIS A 1 75 ? 1.233 28.927 18.534 1.00 29.42 ? 77 HIS A CE1 1 +ATOM 565 N NE2 . HIS A 1 75 ? 0.162 29.314 19.163 1.00 26.61 ? 77 HIS A NE2 1 +ATOM 566 N N . MET A 1 76 ? 0.362 32.477 16.202 1.00 47.12 ? 78 MET A N 1 +ATOM 567 C CA . MET A 1 76 ? 0.286 33.747 16.903 1.00 42.98 ? 78 MET A CA 1 +ATOM 568 C C . MET A 1 76 ? 1.086 34.851 16.232 1.00 43.54 ? 78 MET A C 1 +ATOM 569 O O . MET A 1 76 ? 1.596 35.783 16.844 1.00 42.83 ? 78 MET A O 1 +ATOM 570 C CB . MET A 1 76 ? 0.720 33.508 18.339 1.00 39.65 ? 78 MET A CB 1 +ATOM 571 C CG . MET A 1 76 ? 2.074 32.900 18.559 1.00 31.27 ? 78 MET A CG 1 +ATOM 572 S SD . MET A 1 76 ? 2.140 32.252 20.237 1.00 36.18 ? 78 MET A SD 1 +ATOM 573 C CE . MET A 1 76 ? 2.254 33.781 21.119 1.00 36.80 ? 78 MET A CE 1 +ATOM 574 N N . LYS A 1 77 ? 1.133 34.738 14.903 1.00 43.78 ? 79 LYS A N 1 +ATOM 575 C CA . LYS A 1 77 ? 1.672 35.766 14.043 1.00 49.17 ? 79 LYS A CA 1 +ATOM 576 C C . LYS A 1 77 ? 0.696 36.925 13.932 1.00 50.11 ? 79 LYS A C 1 +ATOM 577 O O . LYS A 1 77 ? 0.956 37.913 13.246 1.00 50.96 ? 79 LYS A O 1 +ATOM 578 C CB . LYS A 1 77 ? 1.928 35.222 12.648 1.00 53.29 ? 79 LYS A CB 1 +ATOM 579 C CG . LYS A 1 77 ? 3.282 34.532 12.570 1.00 61.22 ? 79 LYS A CG 1 +ATOM 580 C CD . LYS A 1 77 ? 3.724 34.332 11.121 1.00 63.58 ? 79 LYS A CD 1 +ATOM 581 C CE . LYS A 1 77 ? 5.109 33.715 11.031 1.00 65.76 ? 79 LYS A CE 1 +ATOM 582 N NZ . LYS A 1 77 ? 6.023 34.402 11.929 1.00 68.73 ? 79 LYS A NZ 1 +ATOM 583 N N . GLN A 1 78 ? -0.459 36.724 14.585 1.00 52.57 ? 80 GLN A N 1 +ATOM 584 C CA . GLN A 1 78 ? -1.601 37.633 14.706 1.00 52.25 ? 80 GLN A CA 1 +ATOM 585 C C . GLN A 1 78 ? -1.355 38.606 15.871 1.00 49.72 ? 80 GLN A C 1 +ATOM 586 O O . GLN A 1 78 ? -1.857 39.732 15.917 1.00 45.94 ? 80 GLN A O 1 +ATOM 587 C CB . GLN A 1 78 ? -2.859 36.766 14.958 1.00 56.54 ? 80 GLN A CB 1 +ATOM 588 C CG . GLN A 1 78 ? -4.283 37.373 14.971 1.00 59.52 ? 80 GLN A CG 1 +ATOM 589 C CD . GLN A 1 78 ? -5.279 36.726 15.950 1.00 61.02 ? 80 GLN A CD 1 +ATOM 590 O OE1 . GLN A 1 78 ? -5.930 37.402 16.755 1.00 58.21 ? 80 GLN A OE1 1 +ATOM 591 N NE2 . GLN A 1 78 ? -5.440 35.402 15.955 1.00 60.63 ? 80 GLN A NE2 1 +ATOM 592 N N . HIS A 1 79 ? -0.548 38.144 16.825 1.00 46.97 ? 81 HIS A N 1 +ATOM 593 C CA . HIS A 1 79 ? -0.202 38.866 18.033 1.00 49.19 ? 81 HIS A CA 1 +ATOM 594 C C . HIS A 1 79 ? 1.121 39.616 17.968 1.00 47.52 ? 81 HIS A C 1 +ATOM 595 O O . HIS A 1 79 ? 1.574 40.221 18.946 1.00 50.48 ? 81 HIS A O 1 +ATOM 596 C CB . HIS A 1 79 ? -0.166 37.878 19.191 1.00 53.87 ? 81 HIS A CB 1 +ATOM 597 C CG . HIS A 1 79 ? -1.478 37.127 19.277 1.00 57.01 ? 81 HIS A CG 1 +ATOM 598 N ND1 . HIS A 1 79 ? -1.691 35.862 18.965 1.00 60.55 ? 81 HIS A ND1 1 +ATOM 599 C CD2 . HIS A 1 79 ? -2.667 37.686 19.657 1.00 58.83 ? 81 HIS A CD2 1 +ATOM 600 C CE1 . HIS A 1 79 ? -2.973 35.646 19.141 1.00 59.26 ? 81 HIS A CE1 1 +ATOM 601 N NE2 . HIS A 1 79 ? -3.551 36.741 19.556 1.00 57.42 ? 81 HIS A NE2 1 +ATOM 602 N N . ASP A 1 80 ? 1.758 39.587 16.799 1.00 47.79 ? 82 ASP A N 1 +ATOM 603 C CA . ASP A 1 80 ? 3.049 40.218 16.617 1.00 44.00 ? 82 ASP A CA 1 +ATOM 604 C C . ASP A 1 80 ? 2.951 41.654 16.177 1.00 40.70 ? 82 ASP A C 1 +ATOM 605 O O . ASP A 1 80 ? 3.030 42.019 14.996 1.00 39.76 ? 82 ASP A O 1 +ATOM 606 C CB . ASP A 1 80 ? 3.877 39.428 15.600 1.00 44.67 ? 82 ASP A CB 1 +ATOM 607 C CG . ASP A 1 80 ? 5.352 39.828 15.474 1.00 43.44 ? 82 ASP A CG 1 +ATOM 608 O OD1 . ASP A 1 80 ? 5.870 40.669 16.213 1.00 42.05 ? 82 ASP A OD1 1 +ATOM 609 O OD2 . ASP A 1 80 ? 5.995 39.280 14.595 1.00 40.37 ? 82 ASP A OD2 1 +ATOM 610 N N . PHE A 1 81 ? 2.852 42.436 17.262 1.00 41.51 ? 83 PHE A N 1 +ATOM 611 C CA . PHE A 1 81 ? 2.810 43.890 17.176 1.00 39.70 ? 83 PHE A CA 1 +ATOM 612 C C . PHE A 1 81 ? 4.088 44.430 16.547 1.00 40.47 ? 83 PHE A C 1 +ATOM 613 O O . PHE A 1 81 ? 4.041 45.252 15.630 1.00 42.04 ? 83 PHE A O 1 +ATOM 614 C CB . PHE A 1 81 ? 2.647 44.488 18.586 1.00 43.43 ? 83 PHE A CB 1 +ATOM 615 C CG . PHE A 1 81 ? 2.907 45.993 18.627 1.00 47.46 ? 83 PHE A CG 1 +ATOM 616 C CD1 . PHE A 1 81 ? 1.947 46.880 18.141 1.00 47.33 ? 83 PHE A CD1 1 +ATOM 617 C CD2 . PHE A 1 81 ? 4.147 46.468 19.086 1.00 45.84 ? 83 PHE A CD2 1 +ATOM 618 C CE1 . PHE A 1 81 ? 2.233 48.242 18.105 1.00 49.03 ? 83 PHE A CE1 1 +ATOM 619 C CE2 . PHE A 1 81 ? 4.417 47.821 19.045 1.00 47.44 ? 83 PHE A CE2 1 +ATOM 620 C CZ . PHE A 1 81 ? 3.466 48.709 18.553 1.00 53.26 ? 83 PHE A CZ 1 +ATOM 621 N N . PHE A 1 82 ? 5.231 43.932 17.057 1.00 33.45 ? 84 PHE A N 1 +ATOM 622 C CA . PHE A 1 82 ? 6.529 44.454 16.711 1.00 28.64 ? 84 PHE A CA 1 +ATOM 623 C C . PHE A 1 82 ? 6.842 44.552 15.229 1.00 29.78 ? 84 PHE A C 1 +ATOM 624 O O . PHE A 1 82 ? 7.149 45.651 14.728 1.00 30.78 ? 84 PHE A O 1 +ATOM 625 C CB . PHE A 1 82 ? 7.537 43.624 17.417 1.00 16.23 ? 84 PHE A CB 1 +ATOM 626 C CG . PHE A 1 82 ? 7.395 43.632 18.919 1.00 21.25 ? 84 PHE A CG 1 +ATOM 627 C CD1 . PHE A 1 82 ? 7.725 44.763 19.657 1.00 13.57 ? 84 PHE A CD1 1 +ATOM 628 C CD2 . PHE A 1 82 ? 6.949 42.472 19.570 1.00 18.44 ? 84 PHE A CD2 1 +ATOM 629 C CE1 . PHE A 1 82 ? 7.617 44.722 21.052 1.00 14.06 ? 84 PHE A CE1 1 +ATOM 630 C CE2 . PHE A 1 82 ? 6.846 42.448 20.961 1.00 15.46 ? 84 PHE A CE2 1 +ATOM 631 C CZ . PHE A 1 82 ? 7.185 43.572 21.708 1.00 15.83 ? 84 PHE A CZ 1 +ATOM 632 N N . LYS A 1 83 ? 6.692 43.437 14.513 1.00 28.75 ? 85 LYS A N 1 +ATOM 633 C CA . LYS A 1 83 ? 6.921 43.441 13.075 1.00 30.78 ? 85 LYS A CA 1 +ATOM 634 C C . LYS A 1 83 ? 5.827 44.128 12.292 1.00 35.47 ? 85 LYS A C 1 +ATOM 635 O O . LYS A 1 83 ? 6.080 44.627 11.191 1.00 37.88 ? 85 LYS A O 1 +ATOM 636 C CB . LYS A 1 83 ? 7.012 42.050 12.543 1.00 34.31 ? 85 LYS A CB 1 +ATOM 637 C CG . LYS A 1 83 ? 8.130 41.266 13.213 1.00 41.16 ? 85 LYS A CG 1 +ATOM 638 C CD . LYS A 1 83 ? 8.276 39.905 12.540 1.00 29.64 ? 85 LYS A CD 1 +ATOM 639 C CE . LYS A 1 83 ? 9.177 39.045 13.352 1.00 29.93 ? 85 LYS A CE 1 +ATOM 640 N NZ . LYS A 1 83 ? 8.737 39.009 14.731 1.00 31.24 ? 85 LYS A NZ 1 +ATOM 641 N N . SER A 1 84 ? 4.599 44.140 12.847 1.00 40.36 ? 86 SER A N 1 +ATOM 642 C CA . SER A 1 84 ? 3.440 44.728 12.173 1.00 43.97 ? 86 SER A CA 1 +ATOM 643 C C . SER A 1 84 ? 3.590 46.219 11.998 1.00 45.17 ? 86 SER A C 1 +ATOM 644 O O . SER A 1 84 ? 3.156 46.801 10.995 1.00 48.44 ? 86 SER A O 1 +ATOM 645 C CB . SER A 1 84 ? 2.169 44.475 12.958 1.00 46.32 ? 86 SER A CB 1 +ATOM 646 O OG . SER A 1 84 ? 2.053 45.302 14.111 1.00 45.82 ? 86 SER A OG 1 +ATOM 647 N N . ALA A 1 85 ? 4.254 46.774 13.025 1.00 42.05 ? 87 ALA A N 1 +ATOM 648 C CA . ALA A 1 85 ? 4.589 48.174 13.125 1.00 36.45 ? 87 ALA A CA 1 +ATOM 649 C C . ALA A 1 85 ? 5.705 48.617 12.200 1.00 37.95 ? 87 ALA A C 1 +ATOM 650 O O . ALA A 1 85 ? 6.009 49.806 12.141 1.00 43.42 ? 87 ALA A O 1 +ATOM 651 C CB . ALA A 1 85 ? 4.978 48.449 14.554 1.00 36.79 ? 87 ALA A CB 1 +ATOM 652 N N . MET A 1 86 ? 6.316 47.712 11.428 1.00 36.54 ? 88 MET A N 1 +ATOM 653 C CA . MET A 1 86 ? 7.415 48.029 10.518 1.00 32.34 ? 88 MET A CA 1 +ATOM 654 C C . MET A 1 86 ? 7.007 48.293 9.069 1.00 34.99 ? 88 MET A C 1 +ATOM 655 O O . MET A 1 86 ? 5.912 47.837 8.728 1.00 36.24 ? 88 MET A O 1 +ATOM 656 C CB . MET A 1 86 ? 8.384 46.882 10.550 1.00 32.85 ? 88 MET A CB 1 +ATOM 657 C CG . MET A 1 86 ? 9.113 46.703 11.868 1.00 33.31 ? 88 MET A CG 1 +ATOM 658 S SD . MET A 1 86 ? 10.297 48.034 12.179 1.00 22.08 ? 88 MET A SD 1 +ATOM 659 C CE . MET A 1 86 ? 10.274 47.785 13.940 1.00 8.79 ? 88 MET A CE 1 +ATOM 660 N N . PRO A 1 87 ? 7.762 48.945 8.148 1.00 32.58 ? 89 PRO A N 1 +ATOM 661 C CA . PRO A 1 87 ? 9.071 49.541 8.349 1.00 35.29 ? 89 PRO A CA 1 +ATOM 662 C C . PRO A 1 87 ? 9.161 50.889 9.039 1.00 41.96 ? 89 PRO A C 1 +ATOM 663 O O . PRO A 1 87 ? 10.249 51.439 9.239 1.00 46.04 ? 89 PRO A O 1 +ATOM 664 C CB . PRO A 1 87 ? 9.652 49.560 6.962 1.00 32.00 ? 89 PRO A CB 1 +ATOM 665 C CG . PRO A 1 87 ? 8.485 49.857 6.098 1.00 35.85 ? 89 PRO A CG 1 +ATOM 666 C CD . PRO A 1 87 ? 7.418 48.983 6.734 1.00 34.95 ? 89 PRO A CD 1 +ATOM 667 N N . GLU A 1 88 ? 8.016 51.469 9.400 1.00 48.55 ? 90 GLU A N 1 +ATOM 668 C CA . GLU A 1 88 ? 7.989 52.775 10.059 1.00 50.60 ? 90 GLU A CA 1 +ATOM 669 C C . GLU A 1 88 ? 8.519 52.638 11.462 1.00 45.37 ? 90 GLU A C 1 +ATOM 670 O O . GLU A 1 88 ? 9.296 53.464 11.941 1.00 49.04 ? 90 GLU A O 1 +ATOM 671 C CB . GLU A 1 88 ? 6.570 53.344 10.147 1.00 56.90 ? 90 GLU A CB 1 +ATOM 672 C CG . GLU A 1 88 ? 6.091 53.825 8.799 1.00 64.89 ? 90 GLU A CG 1 +ATOM 673 C CD . GLU A 1 88 ? 4.784 53.185 8.400 1.00 69.78 ? 90 GLU A CD 1 +ATOM 674 O OE1 . GLU A 1 88 ? 4.717 51.953 8.297 1.00 71.28 ? 90 GLU A OE1 1 +ATOM 675 O OE2 . GLU A 1 88 ? 3.841 53.944 8.191 1.00 73.68 ? 90 GLU A OE2 1 +ATOM 676 N N . GLY A 1 89 ? 8.047 51.591 12.109 1.00 37.55 ? 91 GLY A N 1 +ATOM 677 C CA . GLY A 1 89 ? 8.565 51.245 13.394 1.00 37.30 ? 91 GLY A CA 1 +ATOM 678 C C . GLY A 1 89 ? 7.644 51.533 14.535 1.00 37.99 ? 91 GLY A C 1 +ATOM 679 O O . GLY A 1 89 ? 6.444 51.730 14.386 1.00 42.81 ? 91 GLY A O 1 +ATOM 680 N N . TYR A 1 90 ? 8.279 51.456 15.697 1.00 36.40 ? 92 TYR A N 1 +ATOM 681 C CA . TYR A 1 90 ? 7.625 51.773 16.933 1.00 33.51 ? 92 TYR A CA 1 +ATOM 682 C C . TYR A 1 90 ? 8.592 52.476 17.863 1.00 34.31 ? 92 TYR A C 1 +ATOM 683 O O . TYR A 1 90 ? 9.791 52.581 17.625 1.00 36.98 ? 92 TYR A O 1 +ATOM 684 C CB . TYR A 1 90 ? 7.058 50.495 17.590 1.00 33.63 ? 92 TYR A CB 1 +ATOM 685 C CG . TYR A 1 90 ? 8.012 49.350 17.834 1.00 36.19 ? 92 TYR A CG 1 +ATOM 686 C CD1 . TYR A 1 90 ? 8.760 49.330 19.003 1.00 35.60 ? 92 TYR A CD1 1 +ATOM 687 C CD2 . TYR A 1 90 ? 8.154 48.339 16.878 1.00 36.26 ? 92 TYR A CD2 1 +ATOM 688 C CE1 . TYR A 1 90 ? 9.669 48.303 19.220 1.00 42.75 ? 92 TYR A CE1 1 +ATOM 689 C CE2 . TYR A 1 90 ? 9.064 47.312 17.094 1.00 39.85 ? 92 TYR A CE2 1 +ATOM 690 C CZ . TYR A 1 90 ? 9.814 47.310 18.260 1.00 40.73 ? 92 TYR A CZ 1 +ATOM 691 O OH . TYR A 1 90 ? 10.769 46.360 18.446 1.00 39.80 ? 92 TYR A OH 1 +ATOM 692 N N . VAL A 1 91 ? 8.004 53.017 18.916 1.00 31.05 ? 93 VAL A N 1 +ATOM 693 C CA . VAL A 1 91 ? 8.683 53.764 19.929 1.00 26.13 ? 93 VAL A CA 1 +ATOM 694 C C . VAL A 1 91 ? 8.537 52.901 21.139 1.00 29.74 ? 93 VAL A C 1 +ATOM 695 O O . VAL A 1 91 ? 7.437 52.541 21.538 1.00 34.09 ? 93 VAL A O 1 +ATOM 696 C CB . VAL A 1 91 ? 8.002 55.144 20.109 1.00 25.74 ? 93 VAL A CB 1 +ATOM 697 C CG1 . VAL A 1 91 ? 8.446 55.868 21.377 1.00 23.61 ? 93 VAL A CG1 1 +ATOM 698 C CG2 . VAL A 1 91 ? 8.416 56.016 18.926 1.00 21.96 ? 93 VAL A CG2 1 +ATOM 699 N N . GLN A 1 92 ? 9.678 52.525 21.702 1.00 33.56 ? 94 GLN A N 1 +ATOM 700 C CA . GLN A 1 92 ? 9.705 51.710 22.892 1.00 31.19 ? 94 GLN A CA 1 +ATOM 701 C C . GLN A 1 92 ? 10.187 52.593 24.021 1.00 32.56 ? 94 GLN A C 1 +ATOM 702 O O . GLN A 1 92 ? 11.270 53.177 24.001 1.00 32.83 ? 94 GLN A O 1 +ATOM 703 C CB . GLN A 1 92 ? 10.647 50.518 22.662 1.00 31.46 ? 94 GLN A CB 1 +ATOM 704 C CG . GLN A 1 92 ? 10.871 49.612 23.876 1.00 29.73 ? 94 GLN A CG 1 +ATOM 705 C CD . GLN A 1 92 ? 11.511 48.263 23.539 1.00 37.28 ? 94 GLN A CD 1 +ATOM 706 O OE1 . GLN A 1 92 ? 11.171 47.614 22.555 1.00 34.45 ? 94 GLN A OE1 1 +ATOM 707 N NE2 . GLN A 1 92 ? 12.437 47.773 24.356 1.00 38.15 ? 94 GLN A NE2 1 +ATOM 708 N N . GLU A 1 93 ? 9.345 52.677 25.034 1.00 34.95 ? 95 GLU A N 1 +ATOM 709 C CA . GLU A 1 93 ? 9.687 53.420 26.235 1.00 37.84 ? 95 GLU A CA 1 +ATOM 710 C C . GLU A 1 93 ? 9.728 52.509 27.447 1.00 35.98 ? 95 GLU A C 1 +ATOM 711 O O . GLU A 1 93 ? 8.862 51.662 27.664 1.00 39.21 ? 95 GLU A O 1 +ATOM 712 C CB . GLU A 1 93 ? 8.664 54.542 26.510 1.00 42.06 ? 95 GLU A CB 1 +ATOM 713 C CG . GLU A 1 93 ? 8.473 55.503 25.333 1.00 45.55 ? 95 GLU A CG 1 +ATOM 714 C CD . GLU A 1 93 ? 7.492 56.644 25.547 1.00 47.28 ? 95 GLU A CD 1 +ATOM 715 O OE1 . GLU A 1 93 ? 6.503 56.475 26.269 1.00 47.05 ? 95 GLU A OE1 1 +ATOM 716 O OE2 . GLU A 1 93 ? 7.737 57.703 24.972 1.00 49.17 ? 95 GLU A OE2 1 +ATOM 717 N N . ARG A 1 94 ? 10.749 52.676 28.272 1.00 34.62 ? 96 ARG A N 1 +ATOM 718 C CA . ARG A 1 94 ? 10.847 51.897 29.497 1.00 36.41 ? 96 ARG A CA 1 +ATOM 719 C C . ARG A 1 94 ? 11.248 52.710 30.698 1.00 36.84 ? 96 ARG A C 1 +ATOM 720 O O . ARG A 1 94 ? 11.872 53.770 30.619 1.00 38.29 ? 96 ARG A O 1 +ATOM 721 C CB . ARG A 1 94 ? 11.888 50.774 29.442 1.00 37.39 ? 96 ARG A CB 1 +ATOM 722 C CG . ARG A 1 94 ? 11.645 49.657 28.473 1.00 32.97 ? 96 ARG A CG 1 +ATOM 723 C CD . ARG A 1 94 ? 11.847 48.396 29.287 1.00 30.29 ? 96 ARG A CD 1 +ATOM 724 N NE . ARG A 1 94 ? 11.707 47.151 28.536 1.00 35.41 ? 96 ARG A NE 1 +ATOM 725 C CZ . ARG A 1 94 ? 12.444 46.815 27.467 1.00 36.94 ? 96 ARG A CZ 1 +ATOM 726 N NH1 . ARG A 1 94 ? 13.395 47.598 26.962 1.00 39.54 ? 96 ARG A NH1 1 +ATOM 727 N NH2 . ARG A 1 94 ? 12.244 45.641 26.888 1.00 33.16 ? 96 ARG A NH2 1 +ATOM 728 N N . THR A 1 95 ? 10.819 52.147 31.819 1.00 34.90 ? 97 THR A N 1 +ATOM 729 C CA . THR A 1 95 ? 11.255 52.620 33.111 1.00 39.53 ? 97 THR A CA 1 +ATOM 730 C C . THR A 1 95 ? 11.697 51.315 33.746 1.00 41.66 ? 97 THR A C 1 +ATOM 731 O O . THR A 1 95 ? 10.914 50.412 34.055 1.00 42.89 ? 97 THR A O 1 +ATOM 732 C CB . THR A 1 95 ? 10.107 53.291 33.911 1.00 42.43 ? 97 THR A CB 1 +ATOM 733 O OG1 . THR A 1 95 ? 9.685 54.422 33.132 1.00 43.19 ? 97 THR A OG1 1 +ATOM 734 C CG2 . THR A 1 95 ? 10.534 53.717 35.331 1.00 32.62 ? 97 THR A CG2 1 +ATOM 735 N N . ILE A 1 96 ? 13.036 51.204 33.783 1.00 44.61 ? 98 ILE A N 1 +ATOM 736 C CA . ILE A 1 96 ? 13.739 50.055 34.344 1.00 38.48 ? 98 ILE A CA 1 +ATOM 737 C C . ILE A 1 96 ? 14.068 50.471 35.770 1.00 40.07 ? 98 ILE A C 1 +ATOM 738 O O . ILE A 1 96 ? 14.941 51.280 36.033 1.00 41.34 ? 98 ILE A O 1 +ATOM 739 C CB . ILE A 1 96 ? 15.018 49.769 33.519 1.00 35.46 ? 98 ILE A CB 1 +ATOM 740 C CG1 . ILE A 1 96 ? 14.684 49.658 32.036 1.00 30.66 ? 98 ILE A CG1 1 +ATOM 741 C CG2 . ILE A 1 96 ? 15.664 48.492 34.050 1.00 29.91 ? 98 ILE A CG2 1 +ATOM 742 C CD1 . ILE A 1 96 ? 15.868 49.597 31.068 1.00 36.21 ? 98 ILE A CD1 1 +ATOM 743 N N . SER A 1 97 ? 13.310 49.931 36.706 1.00 41.58 ? 99 SER A N 1 +ATOM 744 C CA . SER A 1 97 ? 13.449 50.223 38.110 1.00 43.56 ? 99 SER A CA 1 +ATOM 745 C C . SER A 1 97 ? 14.209 49.156 38.896 1.00 43.37 ? 99 SER A C 1 +ATOM 746 O O . SER A 1 97 ? 13.662 48.135 39.349 1.00 45.95 ? 99 SER A O 1 +ATOM 747 C CB . SER A 1 97 ? 12.029 50.433 38.643 1.00 47.70 ? 99 SER A CB 1 +ATOM 748 O OG . SER A 1 97 ? 11.969 50.715 40.027 1.00 51.57 ? 99 SER A OG 1 +ATOM 749 N N . PHE A 1 98 ? 15.507 49.445 39.091 1.00 40.79 ? 100 PHE A N 1 +ATOM 750 C CA . PHE A 1 98 ? 16.397 48.575 39.863 1.00 38.15 ? 100 PHE A CA 1 +ATOM 751 C C . PHE A 1 98 ? 16.047 48.691 41.339 1.00 38.47 ? 100 PHE A C 1 +ATOM 752 O O . PHE A 1 98 ? 16.079 49.782 41.920 1.00 38.31 ? 100 PHE A O 1 +ATOM 753 C CB . PHE A 1 98 ? 17.876 48.974 39.671 1.00 32.53 ? 100 PHE A CB 1 +ATOM 754 C CG . PHE A 1 98 ? 18.349 48.930 38.233 1.00 24.34 ? 100 PHE A CG 1 +ATOM 755 C CD1 . PHE A 1 98 ? 18.107 49.998 37.366 1.00 29.66 ? 100 PHE A CD1 1 +ATOM 756 C CD2 . PHE A 1 98 ? 19.012 47.810 37.757 1.00 29.23 ? 100 PHE A CD2 1 +ATOM 757 C CE1 . PHE A 1 98 ? 18.522 49.954 36.037 1.00 17.46 ? 100 PHE A CE1 1 +ATOM 758 C CE2 . PHE A 1 98 ? 19.428 47.767 36.424 1.00 24.13 ? 100 PHE A CE2 1 +ATOM 759 C CZ . PHE A 1 98 ? 19.185 48.838 35.567 1.00 21.95 ? 100 PHE A CZ 1 +ATOM 760 N N . LYS A 1 99 ? 15.698 47.547 41.929 1.00 39.26 ? 101 LYS A N 1 +ATOM 761 C CA . LYS A 1 99 ? 15.318 47.429 43.334 1.00 45.75 ? 101 LYS A CA 1 +ATOM 762 C C . LYS A 1 99 ? 16.478 47.837 44.206 1.00 50.14 ? 101 LYS A C 1 +ATOM 763 O O . LYS A 1 99 ? 17.589 47.366 43.980 1.00 52.79 ? 101 LYS A O 1 +ATOM 764 C CB . LYS A 1 99 ? 14.955 45.998 43.694 1.00 47.70 ? 101 LYS A CB 1 +ATOM 765 C CG . LYS A 1 99 ? 14.037 45.838 44.904 1.00 53.84 ? 101 LYS A CG 1 +ATOM 766 C CD . LYS A 1 99 ? 13.658 44.358 45.105 1.00 58.49 ? 101 LYS A CD 1 +ATOM 767 C CE . LYS A 1 99 ? 14.585 43.566 46.044 1.00 59.62 ? 101 LYS A CE 1 +ATOM 768 N NZ . LYS A 1 99 ? 14.387 43.945 47.436 1.00 59.27 ? 101 LYS A NZ 1 +ATOM 769 N N . ASP A 1 100 ? 16.218 48.699 45.208 1.00 56.37 ? 102 ASP A N 1 +ATOM 770 C CA . ASP A 1 100 ? 17.212 49.279 46.129 1.00 56.25 ? 102 ASP A CA 1 +ATOM 771 C C . ASP A 1 100 ? 18.298 50.046 45.385 1.00 53.61 ? 102 ASP A C 1 +ATOM 772 O O . ASP A 1 100 ? 19.503 49.930 45.645 1.00 52.00 ? 102 ASP A O 1 +ATOM 773 C CB . ASP A 1 100 ? 17.913 48.206 46.969 1.00 62.44 ? 102 ASP A CB 1 +ATOM 774 C CG . ASP A 1 100 ? 16.975 47.282 47.698 1.00 65.31 ? 102 ASP A CG 1 +ATOM 775 O OD1 . ASP A 1 100 ? 16.354 47.727 48.662 1.00 70.35 ? 102 ASP A OD1 1 +ATOM 776 O OD2 . ASP A 1 100 ? 16.887 46.127 47.289 1.00 67.91 ? 102 ASP A OD2 1 +ATOM 777 N N . ASP A 1 101 ? 17.815 50.806 44.405 1.00 51.23 ? 103 ASP A N 1 +ATOM 778 C CA . ASP A 1 101 ? 18.660 51.573 43.502 1.00 51.82 ? 103 ASP A CA 1 +ATOM 779 C C . ASP A 1 101 ? 17.751 52.414 42.641 1.00 52.77 ? 103 ASP A C 1 +ATOM 780 O O . ASP A 1 101 ? 16.525 52.321 42.719 1.00 54.32 ? 103 ASP A O 1 +ATOM 781 C CB . ASP A 1 101 ? 19.467 50.676 42.565 1.00 51.72 ? 103 ASP A CB 1 +ATOM 782 C CG . ASP A 1 101 ? 20.983 50.680 42.715 1.00 50.80 ? 103 ASP A CG 1 +ATOM 783 O OD1 . ASP A 1 101 ? 21.621 51.608 42.211 1.00 46.31 ? 103 ASP A OD1 1 +ATOM 784 O OD2 . ASP A 1 101 ? 21.505 49.730 43.308 1.00 46.33 ? 103 ASP A OD2 1 +ATOM 785 N N . GLY A 1 102 ? 18.373 53.218 41.775 1.00 52.57 ? 104 GLY A N 1 +ATOM 786 C CA . GLY A 1 102 ? 17.645 54.082 40.869 1.00 49.15 ? 104 GLY A CA 1 +ATOM 787 C C . GLY A 1 102 ? 16.967 53.371 39.703 1.00 48.90 ? 104 GLY A C 1 +ATOM 788 O O . GLY A 1 102 ? 16.489 52.234 39.748 1.00 48.17 ? 104 GLY A O 1 +ATOM 789 N N . ASN A 1 103 ? 16.953 54.128 38.616 1.00 49.13 ? 105 ASN A N 1 +ATOM 790 C CA . ASN A 1 103 ? 16.213 53.727 37.447 1.00 47.64 ? 105 ASN A CA 1 +ATOM 791 C C . ASN A 1 103 ? 16.616 54.369 36.144 1.00 47.01 ? 105 ASN A C 1 +ATOM 792 O O . ASN A 1 103 ? 17.034 55.529 36.096 1.00 46.02 ? 105 ASN A O 1 +ATOM 793 C CB . ASN A 1 103 ? 14.721 54.019 37.656 1.00 52.39 ? 105 ASN A CB 1 +ATOM 794 C CG . ASN A 1 103 ? 14.393 55.475 37.984 1.00 51.03 ? 105 ASN A CG 1 +ATOM 795 O OD1 . ASN A 1 103 ? 14.130 56.296 37.094 1.00 44.44 ? 105 ASN A OD1 1 +ATOM 796 N ND2 . ASN A 1 103 ? 14.409 55.773 39.290 1.00 47.53 ? 105 ASN A ND2 1 +ATOM 797 N N . TYR A 1 104 ? 16.413 53.589 35.073 1.00 46.88 ? 106 TYR A N 1 +ATOM 798 C CA . TYR A 1 104 ? 16.619 54.086 33.722 1.00 41.62 ? 106 TYR A CA 1 +ATOM 799 C C . TYR A 1 104 ? 15.270 54.330 33.119 1.00 38.86 ? 106 TYR A C 1 +ATOM 800 O O . TYR A 1 104 ? 14.308 53.594 33.335 1.00 37.63 ? 106 TYR A O 1 +ATOM 801 C CB . TYR A 1 104 ? 17.271 53.122 32.752 1.00 44.61 ? 106 TYR A CB 1 +ATOM 802 C CG . TYR A 1 104 ? 18.653 52.599 33.068 1.00 47.38 ? 106 TYR A CG 1 +ATOM 803 C CD1 . TYR A 1 104 ? 19.625 53.390 33.696 1.00 41.77 ? 106 TYR A CD1 1 +ATOM 804 C CD2 . TYR A 1 104 ? 18.919 51.270 32.710 1.00 47.74 ? 106 TYR A CD2 1 +ATOM 805 C CE1 . TYR A 1 104 ? 20.873 52.823 33.967 1.00 46.31 ? 106 TYR A CE1 1 +ATOM 806 C CE2 . TYR A 1 104 ? 20.159 50.710 32.980 1.00 45.60 ? 106 TYR A CE2 1 +ATOM 807 C CZ . TYR A 1 104 ? 21.125 51.490 33.612 1.00 48.66 ? 106 TYR A CZ 1 +ATOM 808 O OH . TYR A 1 104 ? 22.332 50.905 33.928 1.00 53.32 ? 106 TYR A OH 1 +ATOM 809 N N . LYS A 1 105 ? 15.249 55.396 32.341 1.00 39.59 ? 107 LYS A N 1 +ATOM 810 C CA . LYS A 1 105 ? 14.065 55.771 31.602 1.00 40.21 ? 107 LYS A CA 1 +ATOM 811 C C . LYS A 1 105 ? 14.537 55.925 30.179 1.00 38.48 ? 107 LYS A C 1 +ATOM 812 O O . LYS A 1 105 ? 15.310 56.820 29.830 1.00 40.91 ? 107 LYS A O 1 +ATOM 813 C CB . LYS A 1 105 ? 13.461 57.103 32.113 1.00 42.58 ? 107 LYS A CB 1 +ATOM 814 C CG . LYS A 1 105 ? 12.618 56.970 33.384 1.00 40.18 ? 107 LYS A CG 1 +ATOM 815 C CD . LYS A 1 105 ? 12.324 58.330 33.984 1.00 45.35 ? 107 LYS A CD 1 +ATOM 816 C CE . LYS A 1 105 ? 13.394 58.767 35.014 1.00 52.38 ? 107 LYS A CE 1 +ATOM 817 N NZ . LYS A 1 105 ? 14.771 58.858 34.513 1.00 41.30 ? 107 LYS A NZ 1 +ATOM 818 N N . THR A 1 106 ? 14.085 54.961 29.389 1.00 33.82 ? 108 THR A N 1 +ATOM 819 C CA . THR A 1 106 ? 14.449 54.920 27.996 1.00 34.43 ? 108 THR A CA 1 +ATOM 820 C C . THR A 1 106 ? 13.287 55.266 27.092 1.00 33.88 ? 108 THR A C 1 +ATOM 821 O O . THR A 1 106 ? 12.138 55.333 27.506 1.00 36.82 ? 108 THR A O 1 +ATOM 822 C CB . THR A 1 106 ? 15.021 53.518 27.629 1.00 35.76 ? 108 THR A CB 1 +ATOM 823 O OG1 . THR A 1 106 ? 14.021 52.551 27.844 1.00 37.62 ? 108 THR A OG1 1 +ATOM 824 C CG2 . THR A 1 106 ? 16.165 53.098 28.529 1.00 37.37 ? 108 THR A CG2 1 +ATOM 825 N N . ARG A 1 107 ? 13.662 55.574 25.857 1.00 36.17 ? 109 ARG A N 1 +ATOM 826 C CA . ARG A 1 107 ? 12.776 55.967 24.779 1.00 36.77 ? 109 ARG A CA 1 +ATOM 827 C C . ARG A 1 107 ? 13.610 55.714 23.524 1.00 36.99 ? 109 ARG A C 1 +ATOM 828 O O . ARG A 1 107 ? 14.646 56.329 23.215 1.00 37.47 ? 109 ARG A O 1 +ATOM 829 C CB . ARG A 1 107 ? 12.382 57.473 24.822 1.00 38.11 ? 109 ARG A CB 1 +ATOM 830 C CG . ARG A 1 107 ? 11.054 57.642 24.097 1.00 35.14 ? 109 ARG A CG 1 +ATOM 831 C CD . ARG A 1 107 ? 10.830 59.003 23.454 1.00 39.28 ? 109 ARG A CD 1 +ATOM 832 N NE . ARG A 1 107 ? 11.565 59.052 22.205 1.00 34.27 ? 109 ARG A NE 1 +ATOM 833 C CZ . ARG A 1 107 ? 10.917 59.051 21.044 1.00 41.06 ? 109 ARG A CZ 1 +ATOM 834 N NH1 . ARG A 1 107 ? 9.573 59.012 20.988 1.00 43.22 ? 109 ARG A NH1 1 +ATOM 835 N NH2 . ARG A 1 107 ? 11.626 59.060 19.915 1.00 36.30 ? 109 ARG A NH2 1 +ATOM 836 N N . ALA A 1 108 ? 13.072 54.768 22.781 1.00 37.14 ? 110 ALA A N 1 +ATOM 837 C CA . ALA A 1 108 ? 13.763 54.271 21.618 1.00 40.23 ? 110 ALA A CA 1 +ATOM 838 C C . ALA A 1 108 ? 12.862 54.233 20.411 1.00 39.37 ? 110 ALA A C 1 +ATOM 839 O O . ALA A 1 108 ? 11.667 54.037 20.539 1.00 36.90 ? 110 ALA A O 1 +ATOM 840 C CB . ALA A 1 108 ? 14.278 52.864 21.928 1.00 38.08 ? 110 ALA A CB 1 +ATOM 841 N N . GLU A 1 109 ? 13.467 54.436 19.246 1.00 40.16 ? 111 GLU A N 1 +ATOM 842 C CA . GLU A 1 109 ? 12.807 54.322 17.962 1.00 40.05 ? 111 GLU A CA 1 +ATOM 843 C C . GLU A 1 109 ? 13.426 53.145 17.205 1.00 41.28 ? 111 GLU A C 1 +ATOM 844 O O . GLU A 1 109 ? 14.581 53.151 16.755 1.00 42.77 ? 111 GLU A O 1 +ATOM 845 C CB . GLU A 1 109 ? 12.992 55.604 17.161 1.00 44.56 ? 111 GLU A CB 1 +ATOM 846 C CG . GLU A 1 109 ? 12.178 56.762 17.756 1.00 46.57 ? 111 GLU A CG 1 +ATOM 847 C CD . GLU A 1 109 ? 11.742 57.867 16.790 1.00 47.33 ? 111 GLU A CD 1 +ATOM 848 O OE1 . GLU A 1 109 ? 12.172 57.867 15.627 1.00 50.47 ? 111 GLU A OE1 1 +ATOM 849 O OE2 . GLU A 1 109 ? 10.942 58.712 17.206 1.00 43.08 ? 111 GLU A OE2 1 +ATOM 850 N N . VAL A 1 110 ? 12.635 52.083 17.097 1.00 35.99 ? 112 VAL A N 1 +ATOM 851 C CA . VAL A 1 110 ? 13.045 50.865 16.429 1.00 28.40 ? 112 VAL A CA 1 +ATOM 852 C C . VAL A 1 110 ? 12.334 50.918 15.066 1.00 27.58 ? 112 VAL A C 1 +ATOM 853 O O . VAL A 1 110 ? 11.102 50.888 14.966 1.00 24.69 ? 112 VAL A O 1 +ATOM 854 C CB . VAL A 1 110 ? 12.602 49.695 17.326 1.00 26.62 ? 112 VAL A CB 1 +ATOM 855 C CG1 . VAL A 1 110 ? 13.138 48.398 16.766 1.00 27.66 ? 112 VAL A CG1 1 +ATOM 856 C CG2 . VAL A 1 110 ? 13.091 49.888 18.759 1.00 25.29 ? 112 VAL A CG2 1 +ATOM 857 N N . LYS A 1 111 ? 13.129 51.039 14.004 1.00 21.12 ? 113 LYS A N 1 +ATOM 858 C CA . LYS A 1 111 ? 12.610 51.256 12.669 1.00 24.20 ? 113 LYS A CA 1 +ATOM 859 C C . LYS A 1 111 ? 13.571 50.822 11.588 1.00 22.85 ? 113 LYS A C 1 +ATOM 860 O O . LYS A 1 111 ? 14.748 50.671 11.840 1.00 26.21 ? 113 LYS A O 1 +ATOM 861 C CB . LYS A 1 111 ? 12.288 52.764 12.464 1.00 28.31 ? 113 LYS A CB 1 +ATOM 862 C CG . LYS A 1 111 ? 13.333 53.857 12.738 1.00 34.59 ? 113 LYS A CG 1 +ATOM 863 C CD . LYS A 1 111 ? 12.994 55.147 11.938 1.00 44.26 ? 113 LYS A CD 1 +ATOM 864 C CE . LYS A 1 111 ? 13.065 56.511 12.666 1.00 46.87 ? 113 LYS A CE 1 +ATOM 865 N NZ . LYS A 1 111 ? 14.427 56.957 12.933 1.00 46.59 ? 113 LYS A NZ 1 +ATOM 866 N N . PHE A 1 112 ? 13.110 50.627 10.372 1.00 24.61 ? 114 PHE A N 1 +ATOM 867 C CA . PHE A 1 112 ? 13.967 50.273 9.285 1.00 29.07 ? 114 PHE A CA 1 +ATOM 868 C C . PHE A 1 112 ? 14.493 51.515 8.596 1.00 34.52 ? 114 PHE A C 1 +ATOM 869 O O . PHE A 1 112 ? 13.753 52.292 7.994 1.00 37.31 ? 114 PHE A O 1 +ATOM 870 C CB . PHE A 1 112 ? 13.212 49.445 8.284 1.00 29.85 ? 114 PHE A CB 1 +ATOM 871 C CG . PHE A 1 112 ? 13.236 47.960 8.532 1.00 35.34 ? 114 PHE A CG 1 +ATOM 872 C CD1 . PHE A 1 112 ? 12.317 47.391 9.389 1.00 34.49 ? 114 PHE A CD1 1 +ATOM 873 C CD2 . PHE A 1 112 ? 14.176 47.155 7.864 1.00 39.89 ? 114 PHE A CD2 1 +ATOM 874 C CE1 . PHE A 1 112 ? 12.338 46.017 9.578 1.00 33.53 ? 114 PHE A CE1 1 +ATOM 875 C CE2 . PHE A 1 112 ? 14.179 45.784 8.063 1.00 37.51 ? 114 PHE A CE2 1 +ATOM 876 C CZ . PHE A 1 112 ? 13.259 45.214 8.924 1.00 36.03 ? 114 PHE A CZ 1 +ATOM 877 N N . GLU A 1 113 ? 15.798 51.722 8.740 1.00 39.42 ? 115 GLU A N 1 +ATOM 878 C CA . GLU A 1 113 ? 16.499 52.751 8.011 1.00 38.71 ? 115 GLU A CA 1 +ATOM 879 C C . GLU A 1 113 ? 17.177 51.968 6.905 1.00 41.97 ? 115 GLU A C 1 +ATOM 880 O O . GLU A 1 113 ? 18.251 51.397 7.086 1.00 42.88 ? 115 GLU A O 1 +ATOM 881 C CB . GLU A 1 113 ? 17.515 53.401 8.910 1.00 41.55 ? 115 GLU A CB 1 +ATOM 882 C CG . GLU A 1 113 ? 17.059 54.759 9.385 1.00 42.74 ? 115 GLU A CG 1 +ATOM 883 C CD . GLU A 1 113 ? 17.607 55.125 10.754 1.00 46.07 ? 115 GLU A CD 1 +ATOM 884 O OE1 . GLU A 1 113 ? 16.958 54.803 11.758 1.00 43.17 ? 115 GLU A OE1 1 +ATOM 885 O OE2 . GLU A 1 113 ? 18.676 55.746 10.799 1.00 49.88 ? 115 GLU A OE2 1 +ATOM 886 N N . GLY A 1 114 ? 16.533 51.936 5.739 1.00 41.29 ? 116 GLY A N 1 +ATOM 887 C CA . GLY A 1 114 ? 17.030 51.165 4.614 1.00 39.85 ? 116 GLY A CA 1 +ATOM 888 C C . GLY A 1 114 ? 16.637 49.706 4.842 1.00 39.56 ? 116 GLY A C 1 +ATOM 889 O O . GLY A 1 114 ? 15.493 49.397 5.232 1.00 34.09 ? 116 GLY A O 1 +ATOM 890 N N . ASP A 1 115 ? 17.638 48.835 4.596 1.00 38.17 ? 117 ASP A N 1 +ATOM 891 C CA . ASP A 1 115 ? 17.438 47.419 4.811 1.00 38.46 ? 117 ASP A CA 1 +ATOM 892 C C . ASP A 1 115 ? 17.866 46.982 6.197 1.00 32.72 ? 117 ASP A C 1 +ATOM 893 O O . ASP A 1 115 ? 17.718 45.816 6.567 1.00 36.29 ? 117 ASP A O 1 +ATOM 894 C CB . ASP A 1 115 ? 18.155 46.584 3.732 1.00 45.49 ? 117 ASP A CB 1 +ATOM 895 C CG . ASP A 1 115 ? 19.669 46.663 3.559 1.00 58.86 ? 117 ASP A CG 1 +ATOM 896 O OD1 . ASP A 1 115 ? 20.294 47.636 4.006 1.00 63.32 ? 117 ASP A OD1 1 +ATOM 897 O OD2 . ASP A 1 115 ? 20.208 45.729 2.948 1.00 55.99 ? 117 ASP A OD2 1 +ATOM 898 N N . THR A 1 116 ? 18.238 47.953 7.027 1.00 25.67 ? 118 THR A N 1 +ATOM 899 C CA . THR A 1 116 ? 18.700 47.639 8.360 1.00 24.50 ? 118 THR A CA 1 +ATOM 900 C C . THR A 1 116 ? 17.799 48.219 9.426 1.00 24.13 ? 118 THR A C 1 +ATOM 901 O O . THR A 1 116 ? 17.328 49.351 9.349 1.00 29.78 ? 118 THR A O 1 +ATOM 902 C CB . THR A 1 116 ? 20.259 48.091 8.514 1.00 24.93 ? 118 THR A CB 1 +ATOM 903 O OG1 . THR A 1 116 ? 20.402 48.918 9.655 1.00 28.86 ? 118 THR A OG1 1 +ATOM 904 C CG2 . THR A 1 116 ? 20.818 48.774 7.262 1.00 20.08 ? 118 THR A CG2 1 +ATOM 905 N N . LEU A 1 117 ? 17.487 47.371 10.405 1.00 25.06 ? 119 LEU A N 1 +ATOM 906 C CA . LEU A 1 117 ? 16.635 47.754 11.524 1.00 26.06 ? 119 LEU A CA 1 +ATOM 907 C C . LEU A 1 117 ? 17.486 48.470 12.555 1.00 24.60 ? 119 LEU A C 1 +ATOM 908 O O . LEU A 1 117 ? 18.479 47.955 13.050 1.00 26.20 ? 119 LEU A O 1 +ATOM 909 C CB . LEU A 1 117 ? 15.976 46.536 12.220 1.00 22.87 ? 119 LEU A CB 1 +ATOM 910 C CG . LEU A 1 117 ? 14.931 46.966 13.231 1.00 22.04 ? 119 LEU A CG 1 +ATOM 911 C CD1 . LEU A 1 117 ? 13.623 46.530 12.706 1.00 23.10 ? 119 LEU A CD1 1 +ATOM 912 C CD2 . LEU A 1 117 ? 15.206 46.415 14.615 1.00 10.50 ? 119 LEU A CD2 1 +ATOM 913 N N . VAL A 1 118 ? 17.055 49.671 12.913 1.00 24.65 ? 120 VAL A N 1 +ATOM 914 C CA . VAL A 1 118 ? 17.821 50.483 13.827 1.00 23.57 ? 120 VAL A CA 1 +ATOM 915 C C . VAL A 1 118 ? 17.077 50.684 15.109 1.00 22.30 ? 120 VAL A C 1 +ATOM 916 O O . VAL A 1 118 ? 15.878 50.913 15.078 1.00 28.41 ? 120 VAL A O 1 +ATOM 917 C CB . VAL A 1 118 ? 18.142 51.840 13.166 1.00 18.19 ? 120 VAL A CB 1 +ATOM 918 C CG1 . VAL A 1 118 ? 19.174 52.576 14.002 1.00 24.62 ? 120 VAL A CG1 1 +ATOM 919 C CG2 . VAL A 1 118 ? 18.755 51.649 11.803 1.00 20.03 ? 120 VAL A CG2 1 +ATOM 920 N N . ASN A 1 119 ? 17.770 50.553 16.237 1.00 24.87 ? 121 ASN A N 1 +ATOM 921 C CA . ASN A 1 119 ? 17.190 50.859 17.519 1.00 28.57 ? 121 ASN A CA 1 +ATOM 922 C C . ASN A 1 119 ? 17.954 52.082 18.046 1.00 30.71 ? 121 ASN A C 1 +ATOM 923 O O . ASN A 1 119 ? 19.022 51.954 18.660 1.00 37.08 ? 121 ASN A O 1 +ATOM 924 C CB . ASN A 1 119 ? 17.348 49.635 18.416 1.00 20.28 ? 121 ASN A CB 1 +ATOM 925 C CG . ASN A 1 119 ? 16.805 49.715 19.846 1.00 23.76 ? 121 ASN A CG 1 +ATOM 926 O OD1 . ASN A 1 119 ? 15.796 50.362 20.126 1.00 22.71 ? 121 ASN A OD1 1 +ATOM 927 N ND2 . ASN A 1 119 ? 17.417 49.100 20.848 1.00 27.82 ? 121 ASN A ND2 1 +ATOM 928 N N . ARG A 1 120 ? 17.441 53.294 17.756 1.00 33.83 ? 122 ARG A N 1 +ATOM 929 C CA . ARG A 1 120 ? 18.032 54.566 18.237 1.00 32.94 ? 122 ARG A CA 1 +ATOM 930 C C . ARG A 1 120 ? 17.448 54.906 19.578 1.00 29.56 ? 122 ARG A C 1 +ATOM 931 O O . ARG A 1 120 ? 16.245 55.105 19.715 1.00 38.84 ? 122 ARG A O 1 +ATOM 932 C CB . ARG A 1 120 ? 17.749 55.679 17.282 1.00 29.43 ? 122 ARG A CB 1 +ATOM 933 C CG . ARG A 1 120 ? 18.636 55.513 16.066 1.00 33.73 ? 122 ARG A CG 1 +ATOM 934 C CD . ARG A 1 120 ? 18.599 56.757 15.195 1.00 35.50 ? 122 ARG A CD 1 +ATOM 935 N NE . ARG A 1 120 ? 19.199 56.504 13.889 1.00 36.32 ? 122 ARG A NE 1 +ATOM 936 C CZ . ARG A 1 120 ? 20.518 56.524 13.659 1.00 35.43 ? 122 ARG A CZ 1 +ATOM 937 N NH1 . ARG A 1 120 ? 21.437 56.764 14.600 1.00 35.06 ? 122 ARG A NH1 1 +ATOM 938 N NH2 . ARG A 1 120 ? 20.916 56.339 12.417 1.00 35.92 ? 122 ARG A NH2 1 +ATOM 939 N N . ILE A 1 121 ? 18.297 54.904 20.596 1.00 26.87 ? 123 ILE A N 1 +ATOM 940 C CA . ILE A 1 121 ? 17.839 54.980 21.974 1.00 26.44 ? 123 ILE A CA 1 +ATOM 941 C C . ILE A 1 121 ? 18.413 56.225 22.631 1.00 30.89 ? 123 ILE A C 1 +ATOM 942 O O . ILE A 1 121 ? 19.472 56.758 22.249 1.00 28.06 ? 123 ILE A O 1 +ATOM 943 C CB . ILE A 1 121 ? 18.311 53.725 22.751 1.00 23.75 ? 123 ILE A CB 1 +ATOM 944 C CG1 . ILE A 1 121 ? 18.131 52.464 21.899 1.00 27.97 ? 123 ILE A CG1 1 +ATOM 945 C CG2 . ILE A 1 121 ? 17.514 53.524 24.029 1.00 13.40 ? 123 ILE A CG2 1 +ATOM 946 C CD1 . ILE A 1 121 ? 19.212 51.396 22.233 1.00 19.15 ? 123 ILE A CD1 1 +ATOM 947 N N . GLU A 1 122 ? 17.607 56.666 23.609 1.00 33.70 ? 124 GLU A N 1 +ATOM 948 C CA . GLU A 1 122 ? 17.951 57.716 24.560 1.00 38.88 ? 124 GLU A CA 1 +ATOM 949 C C . GLU A 1 122 ? 17.540 57.164 25.931 1.00 40.75 ? 124 GLU A C 1 +ATOM 950 O O . GLU A 1 122 ? 16.384 56.779 26.144 1.00 38.53 ? 124 GLU A O 1 +ATOM 951 C CB . GLU A 1 122 ? 17.175 58.999 24.312 1.00 40.74 ? 124 GLU A CB 1 +ATOM 952 C CG . GLU A 1 122 ? 17.443 59.735 22.999 1.00 44.89 ? 124 GLU A CG 1 +ATOM 953 C CD . GLU A 1 122 ? 16.531 60.947 22.749 1.00 49.91 ? 124 GLU A CD 1 +ATOM 954 O OE1 . GLU A 1 122 ? 15.303 60.872 22.919 1.00 42.52 ? 124 GLU A OE1 1 +ATOM 955 O OE2 . GLU A 1 122 ? 17.066 61.984 22.359 1.00 48.68 ? 124 GLU A OE2 1 +ATOM 956 N N . LEU A 1 123 ? 18.528 57.067 26.832 1.00 39.11 ? 125 LEU A N 1 +ATOM 957 C CA . LEU A 1 123 ? 18.340 56.584 28.193 1.00 38.58 ? 125 LEU A CA 1 +ATOM 958 C C . LEU A 1 123 ? 18.801 57.635 29.209 1.00 40.92 ? 125 LEU A C 1 +ATOM 959 O O . LEU A 1 123 ? 19.859 58.260 29.075 1.00 39.18 ? 125 LEU A O 1 +ATOM 960 C CB . LEU A 1 123 ? 19.150 55.270 28.394 1.00 31.29 ? 125 LEU A CB 1 +ATOM 961 C CG . LEU A 1 123 ? 19.313 54.585 29.753 1.00 20.43 ? 125 LEU A CG 1 +ATOM 962 C CD1 . LEU A 1 123 ? 19.849 53.203 29.511 1.00 29.89 ? 125 LEU A CD1 1 +ATOM 963 C CD2 . LEU A 1 123 ? 20.303 55.278 30.645 1.00 27.50 ? 125 LEU A CD2 1 +ATOM 964 N N . LYS A 1 124 ? 18.012 57.743 30.279 1.00 44.11 ? 126 LYS A N 1 +ATOM 965 C CA . LYS A 1 124 ? 18.376 58.578 31.400 1.00 45.06 ? 126 LYS A CA 1 +ATOM 966 C C . LYS A 1 124 ? 18.125 57.880 32.730 1.00 45.02 ? 126 LYS A C 1 +ATOM 967 O O . LYS A 1 124 ? 17.000 57.621 33.173 1.00 44.74 ? 126 LYS A O 1 +ATOM 968 C CB . LYS A 1 124 ? 17.607 59.884 31.375 1.00 45.37 ? 126 LYS A CB 1 +ATOM 969 C CG . LYS A 1 124 ? 18.521 60.926 31.998 1.00 48.41 ? 126 LYS A CG 1 +ATOM 970 C CD . LYS A 1 124 ? 17.812 61.969 32.855 1.00 53.80 ? 126 LYS A CD 1 +ATOM 971 C CE . LYS A 1 124 ? 18.853 62.910 33.468 1.00 57.59 ? 126 LYS A CE 1 +ATOM 972 N NZ . LYS A 1 124 ? 19.796 62.201 34.332 1.00 57.39 ? 126 LYS A NZ 1 +ATOM 973 N N . GLY A 1 125 ? 19.263 57.540 33.325 1.00 42.04 ? 127 GLY A N 1 +ATOM 974 C CA . GLY A 1 125 ? 19.250 56.957 34.636 1.00 40.78 ? 127 GLY A CA 1 +ATOM 975 C C . GLY A 1 125 ? 19.415 58.036 35.677 1.00 43.01 ? 127 GLY A C 1 +ATOM 976 O O . GLY A 1 125 ? 20.190 58.986 35.492 1.00 40.75 ? 127 GLY A O 1 +ATOM 977 N N . ILE A 1 126 ? 18.630 57.892 36.757 1.00 43.01 ? 128 ILE A N 1 +ATOM 978 C CA . ILE A 1 126 ? 18.705 58.817 37.890 1.00 43.34 ? 128 ILE A CA 1 +ATOM 979 C C . ILE A 1 126 ? 18.707 58.040 39.200 1.00 46.05 ? 128 ILE A C 1 +ATOM 980 O O . ILE A 1 126 ? 18.558 56.818 39.195 1.00 51.05 ? 128 ILE A O 1 +ATOM 981 C CB . ILE A 1 126 ? 17.501 59.859 37.933 1.00 43.68 ? 128 ILE A CB 1 +ATOM 982 C CG1 . ILE A 1 126 ? 16.177 59.114 38.036 1.00 41.38 ? 128 ILE A CG1 1 +ATOM 983 C CG2 . ILE A 1 126 ? 17.500 60.783 36.687 1.00 32.74 ? 128 ILE A CG2 1 +ATOM 984 C CD1 . ILE A 1 126 ? 15.039 60.088 38.437 1.00 43.77 ? 128 ILE A CD1 1 +ATOM 985 N N . ASP A 1 127 ? 18.898 58.712 40.345 1.00 49.24 ? 129 ASP A N 1 +ATOM 986 C CA . ASP A 1 127 ? 18.818 58.139 41.694 1.00 49.09 ? 129 ASP A CA 1 +ATOM 987 C C . ASP A 1 127 ? 19.781 57.012 42.052 1.00 49.17 ? 129 ASP A C 1 +ATOM 988 O O . ASP A 1 127 ? 19.632 56.377 43.104 1.00 46.34 ? 129 ASP A O 1 +ATOM 989 C CB . ASP A 1 127 ? 17.395 57.620 41.964 1.00 52.12 ? 129 ASP A CB 1 +ATOM 990 C CG . ASP A 1 127 ? 16.276 58.609 42.271 1.00 55.01 ? 129 ASP A CG 1 +ATOM 991 O OD1 . ASP A 1 127 ? 16.310 59.753 41.802 1.00 57.17 ? 129 ASP A OD1 1 +ATOM 992 O OD2 . ASP A 1 127 ? 15.358 58.201 42.990 1.00 50.81 ? 129 ASP A OD2 1 +ATOM 993 N N . PHE A 1 128 ? 20.784 56.729 41.215 1.00 47.53 ? 130 PHE A N 1 +ATOM 994 C CA . PHE A 1 128 ? 21.662 55.596 41.492 1.00 48.09 ? 130 PHE A CA 1 +ATOM 995 C C . PHE A 1 128 ? 22.721 55.783 42.562 1.00 49.27 ? 130 PHE A C 1 +ATOM 996 O O . PHE A 1 128 ? 23.422 56.793 42.599 1.00 50.96 ? 130 PHE A O 1 +ATOM 997 C CB . PHE A 1 128 ? 22.378 55.168 40.228 1.00 46.28 ? 130 PHE A CB 1 +ATOM 998 C CG . PHE A 1 128 ? 21.539 54.423 39.216 1.00 38.77 ? 130 PHE A CG 1 +ATOM 999 C CD1 . PHE A 1 128 ? 21.307 53.062 39.405 1.00 34.56 ? 130 PHE A CD1 1 +ATOM 1000 C CD2 . PHE A 1 128 ? 21.047 55.083 38.092 1.00 33.24 ? 130 PHE A CD2 1 +ATOM 1001 C CE1 . PHE A 1 128 ? 20.583 52.367 38.451 1.00 33.13 ? 130 PHE A CE1 1 +ATOM 1002 C CE2 . PHE A 1 128 ? 20.318 54.373 37.138 1.00 24.31 ? 130 PHE A CE2 1 +ATOM 1003 C CZ . PHE A 1 128 ? 20.092 53.020 37.319 1.00 28.50 ? 130 PHE A CZ 1 +ATOM 1004 N N . LYS A 1 129 ? 22.826 54.764 43.419 1.00 50.14 ? 131 LYS A N 1 +ATOM 1005 C CA . LYS A 1 129 ? 23.801 54.714 44.494 1.00 53.18 ? 131 LYS A CA 1 +ATOM 1006 C C . LYS A 1 129 ? 25.184 54.413 43.899 1.00 59.77 ? 131 LYS A C 1 +ATOM 1007 O O . LYS A 1 129 ? 25.306 53.498 43.071 1.00 59.48 ? 131 LYS A O 1 +ATOM 1008 C CB . LYS A 1 129 ? 23.465 53.597 45.485 1.00 53.54 ? 131 LYS A CB 1 +ATOM 1009 C CG . LYS A 1 129 ? 22.069 53.357 46.067 1.00 50.26 ? 131 LYS A CG 1 +ATOM 1010 C CD . LYS A 1 129 ? 22.197 52.094 46.916 1.00 49.54 ? 131 LYS A CD 1 +ATOM 1011 C CE . LYS A 1 129 ? 21.002 51.876 47.849 1.00 51.50 ? 131 LYS A CE 1 +ATOM 1012 N NZ . LYS A 1 129 ? 21.331 50.910 48.892 1.00 48.53 ? 131 LYS A NZ 1 +ATOM 1013 N N . GLU A 1 130 ? 26.247 55.146 44.302 1.00 65.02 ? 132 GLU A N 1 +ATOM 1014 C CA . GLU A 1 130 ? 27.622 54.917 43.822 1.00 68.12 ? 132 GLU A CA 1 +ATOM 1015 C C . GLU A 1 130 ? 28.229 53.631 44.394 1.00 69.01 ? 132 GLU A C 1 +ATOM 1016 O O . GLU A 1 130 ? 29.109 52.976 43.826 1.00 69.69 ? 132 GLU A O 1 +ATOM 1017 C CB . GLU A 1 130 ? 28.527 56.085 44.204 1.00 71.87 ? 132 GLU A CB 1 +ATOM 1018 C CG . GLU A 1 130 ? 29.746 56.218 43.272 1.00 75.57 ? 132 GLU A CG 1 +ATOM 1019 C CD . GLU A 1 130 ? 30.921 57.027 43.831 1.00 78.00 ? 132 GLU A CD 1 +ATOM 1020 O OE1 . GLU A 1 130 ? 30.720 58.119 44.380 1.00 77.33 ? 132 GLU A OE1 1 +ATOM 1021 O OE2 . GLU A 1 130 ? 32.050 56.546 43.707 1.00 74.60 ? 132 GLU A OE2 1 +ATOM 1022 N N . ASP A 1 131 ? 27.709 53.329 45.581 1.00 68.25 ? 133 ASP A N 1 +ATOM 1023 C CA . ASP A 1 131 ? 27.977 52.133 46.355 1.00 68.02 ? 133 ASP A CA 1 +ATOM 1024 C C . ASP A 1 131 ? 27.067 50.970 45.956 1.00 65.58 ? 133 ASP A C 1 +ATOM 1025 O O . ASP A 1 131 ? 27.305 49.833 46.371 1.00 68.16 ? 133 ASP A O 1 +ATOM 1026 C CB . ASP A 1 131 ? 27.783 52.436 47.843 1.00 71.90 ? 133 ASP A CB 1 +ATOM 1027 C CG . ASP A 1 131 ? 26.376 52.918 48.218 1.00 73.25 ? 133 ASP A CG 1 +ATOM 1028 O OD1 . ASP A 1 131 ? 26.114 54.125 48.139 1.00 71.95 ? 133 ASP A OD1 1 +ATOM 1029 O OD2 . ASP A 1 131 ? 25.548 52.077 48.583 1.00 74.77 ? 133 ASP A OD2 1 +ATOM 1030 N N . GLY A 1 132 ? 25.993 51.235 45.196 1.00 58.87 ? 134 GLY A N 1 +ATOM 1031 C CA . GLY A 1 132 ? 25.052 50.211 44.752 1.00 51.50 ? 134 GLY A CA 1 +ATOM 1032 C C . GLY A 1 132 ? 25.564 49.395 43.578 1.00 45.02 ? 134 GLY A C 1 +ATOM 1033 O O . GLY A 1 132 ? 26.508 49.795 42.906 1.00 44.36 ? 134 GLY A O 1 +ATOM 1034 N N . ASN A 1 133 ? 24.885 48.274 43.310 1.00 42.37 ? 135 ASN A N 1 +ATOM 1035 C CA . ASN A 1 133 ? 25.243 47.309 42.282 1.00 40.62 ? 135 ASN A CA 1 +ATOM 1036 C C . ASN A 1 133 ? 25.438 47.776 40.851 1.00 42.56 ? 135 ASN A C 1 +ATOM 1037 O O . ASN A 1 133 ? 26.154 47.106 40.096 1.00 45.24 ? 135 ASN A O 1 +ATOM 1038 C CB . ASN A 1 133 ? 24.228 46.204 42.219 1.00 35.79 ? 135 ASN A CB 1 +ATOM 1039 C CG . ASN A 1 133 ? 24.038 45.383 43.477 1.00 36.54 ? 135 ASN A CG 1 +ATOM 1040 O OD1 . ASN A 1 133 ? 22.913 45.013 43.788 1.00 43.07 ? 135 ASN A OD1 1 +ATOM 1041 N ND2 . ASN A 1 133 ? 25.056 45.031 44.250 1.00 40.76 ? 135 ASN A ND2 1 +ATOM 1042 N N . ILE A 1 134 ? 24.846 48.924 40.471 1.00 41.57 ? 136 ILE A N 1 +ATOM 1043 C CA . ILE A 1 134 ? 24.948 49.403 39.106 1.00 44.90 ? 136 ILE A CA 1 +ATOM 1044 C C . ILE A 1 134 ? 26.141 50.331 38.935 1.00 48.65 ? 136 ILE A C 1 +ATOM 1045 O O . ILE A 1 134 ? 26.965 50.102 38.043 1.00 47.89 ? 136 ILE A O 1 +ATOM 1046 C CB . ILE A 1 134 ? 23.619 50.099 38.700 1.00 44.63 ? 136 ILE A CB 1 +ATOM 1047 C CG1 . ILE A 1 134 ? 22.538 49.063 38.422 1.00 46.11 ? 136 ILE A CG1 1 +ATOM 1048 C CG2 . ILE A 1 134 ? 23.764 50.851 37.376 1.00 44.68 ? 136 ILE A CG2 1 +ATOM 1049 C CD1 . ILE A 1 134 ? 22.042 48.143 39.550 1.00 51.02 ? 136 ILE A CD1 1 +ATOM 1050 N N . LEU A 1 135 ? 26.276 51.364 39.779 1.00 50.68 ? 137 LEU A N 1 +ATOM 1051 C CA . LEU A 1 135 ? 27.408 52.272 39.679 1.00 48.18 ? 137 LEU A CA 1 +ATOM 1052 C C . LEU A 1 135 ? 28.680 51.672 40.270 1.00 46.22 ? 137 LEU A C 1 +ATOM 1053 O O . LEU A 1 135 ? 29.784 51.912 39.776 1.00 44.51 ? 137 LEU A O 1 +ATOM 1054 C CB . LEU A 1 135 ? 27.005 53.582 40.356 1.00 52.45 ? 137 LEU A CB 1 +ATOM 1055 C CG . LEU A 1 135 ? 26.495 54.711 39.424 1.00 58.22 ? 137 LEU A CG 1 +ATOM 1056 C CD1 . LEU A 1 135 ? 27.595 55.164 38.461 1.00 59.00 ? 137 LEU A CD1 1 +ATOM 1057 C CD2 . LEU A 1 135 ? 25.343 54.198 38.573 1.00 62.74 ? 137 LEU A CD2 1 +ATOM 1058 N N . GLY A 1 136 ? 28.514 50.814 41.283 1.00 43.78 ? 138 GLY A N 1 +ATOM 1059 C CA . GLY A 1 136 ? 29.613 50.067 41.868 1.00 44.95 ? 138 GLY A CA 1 +ATOM 1060 C C . GLY A 1 136 ? 30.017 48.855 41.020 1.00 46.16 ? 138 GLY A C 1 +ATOM 1061 O O . GLY A 1 136 ? 30.887 48.089 41.445 1.00 46.15 ? 138 GLY A O 1 +ATOM 1062 N N . HIS A 1 137 ? 29.396 48.679 39.831 1.00 44.87 ? 139 HIS A N 1 +ATOM 1063 C CA . HIS A 1 137 ? 29.598 47.579 38.878 1.00 42.77 ? 139 HIS A CA 1 +ATOM 1064 C C . HIS A 1 137 ? 29.716 46.209 39.523 1.00 44.38 ? 139 HIS A C 1 +ATOM 1065 O O . HIS A 1 137 ? 30.676 45.451 39.354 1.00 49.12 ? 139 HIS A O 1 +ATOM 1066 C CB . HIS A 1 137 ? 30.858 47.812 38.019 1.00 37.71 ? 139 HIS A CB 1 +ATOM 1067 C CG . HIS A 1 137 ? 30.772 49.003 37.107 1.00 22.55 ? 139 HIS A CG 1 +ATOM 1068 N ND1 . HIS A 1 137 ? 30.559 50.234 37.488 1.00 22.27 ? 139 HIS A ND1 1 +ATOM 1069 C CD2 . HIS A 1 137 ? 30.957 48.974 35.764 1.00 25.14 ? 139 HIS A CD2 1 +ATOM 1070 C CE1 . HIS A 1 137 ? 30.621 50.956 36.400 1.00 29.06 ? 139 HIS A CE1 1 +ATOM 1071 N NE2 . HIS A 1 137 ? 30.860 50.211 35.358 1.00 30.07 ? 139 HIS A NE2 1 +ATOM 1072 N N . LYS A 1 138 ? 28.710 45.930 40.335 1.00 46.03 ? 140 LYS A N 1 +ATOM 1073 C CA . LYS A 1 138 ? 28.674 44.705 41.093 1.00 45.66 ? 140 LYS A CA 1 +ATOM 1074 C C . LYS A 1 138 ? 28.010 43.523 40.401 1.00 45.19 ? 140 LYS A C 1 +ATOM 1075 O O . LYS A 1 138 ? 28.078 42.399 40.910 1.00 46.72 ? 140 LYS A O 1 +ATOM 1076 C CB . LYS A 1 138 ? 28.004 45.027 42.414 1.00 44.83 ? 140 LYS A CB 1 +ATOM 1077 C CG . LYS A 1 138 ? 28.816 46.013 43.275 1.00 47.75 ? 140 LYS A CG 1 +ATOM 1078 C CD . LYS A 1 138 ? 28.131 46.208 44.620 1.00 50.84 ? 140 LYS A CD 1 +ATOM 1079 C CE . LYS A 1 138 ? 29.007 46.902 45.649 1.00 55.61 ? 140 LYS A CE 1 +ATOM 1080 N NZ . LYS A 1 138 ? 29.338 48.245 45.214 1.00 57.94 ? 140 LYS A NZ 1 +ATOM 1081 N N . LEU A 1 139 ? 27.421 43.756 39.216 1.00 43.28 ? 141 LEU A N 1 +ATOM 1082 C CA . LEU A 1 139 ? 26.728 42.725 38.460 1.00 44.30 ? 141 LEU A CA 1 +ATOM 1083 C C . LEU A 1 139 ? 27.697 41.896 37.650 1.00 46.03 ? 141 LEU A C 1 +ATOM 1084 O O . LEU A 1 139 ? 28.597 42.430 36.983 1.00 49.01 ? 141 LEU A O 1 +ATOM 1085 C CB . LEU A 1 139 ? 25.767 43.223 37.403 1.00 44.09 ? 141 LEU A CB 1 +ATOM 1086 C CG . LEU A 1 139 ? 24.864 44.417 37.464 1.00 48.12 ? 141 LEU A CG 1 +ATOM 1087 C CD1 . LEU A 1 139 ? 24.129 44.357 36.154 1.00 50.40 ? 141 LEU A CD1 1 +ATOM 1088 C CD2 . LEU A 1 139 ? 23.870 44.426 38.599 1.00 45.74 ? 141 LEU A CD2 1 +ATOM 1089 N N . GLU A 1 140 ? 27.432 40.583 37.664 1.00 41.88 ? 142 GLU A N 1 +ATOM 1090 C CA . GLU A 1 140 ? 28.181 39.635 36.861 1.00 40.42 ? 142 GLU A CA 1 +ATOM 1091 C C . GLU A 1 140 ? 27.976 39.880 35.373 1.00 36.07 ? 142 GLU A C 1 +ATOM 1092 O O . GLU A 1 140 ? 27.004 40.505 34.957 1.00 39.80 ? 142 GLU A O 1 +ATOM 1093 C CB . GLU A 1 140 ? 27.746 38.221 37.179 1.00 42.24 ? 142 GLU A CB 1 +ATOM 1094 C CG . GLU A 1 140 ? 28.194 37.704 38.545 1.00 46.57 ? 142 GLU A CG 1 +ATOM 1095 C CD . GLU A 1 140 ? 27.712 36.293 38.861 1.00 48.56 ? 142 GLU A CD 1 +ATOM 1096 O OE1 . GLU A 1 140 ? 27.739 35.435 37.984 1.00 55.03 ? 142 GLU A OE1 1 +ATOM 1097 O OE2 . GLU A 1 140 ? 27.308 36.040 39.993 1.00 55.01 ? 142 GLU A OE2 1 +ATOM 1098 N N . TYR A 1 141 ? 28.902 39.443 34.527 1.00 34.98 ? 143 TYR A N 1 +ATOM 1099 C CA . TYR A 1 141 ? 28.740 39.614 33.100 1.00 29.18 ? 143 TYR A CA 1 +ATOM 1100 C C . TYR A 1 141 ? 28.150 38.330 32.566 1.00 33.49 ? 143 TYR A C 1 +ATOM 1101 O O . TYR A 1 141 ? 28.748 37.408 32.003 1.00 29.40 ? 143 TYR A O 1 +ATOM 1102 C CB . TYR A 1 141 ? 30.054 39.874 32.470 1.00 19.73 ? 143 TYR A CB 1 +ATOM 1103 C CG . TYR A 1 141 ? 29.886 40.273 31.038 1.00 6.75 ? 143 TYR A CG 1 +ATOM 1104 C CD1 . TYR A 1 141 ? 29.339 41.513 30.721 1.00 18.67 ? 143 TYR A CD1 1 +ATOM 1105 C CD2 . TYR A 1 141 ? 30.328 39.431 30.041 1.00 3.20 ? 143 TYR A CD2 1 +ATOM 1106 C CE1 . TYR A 1 141 ? 29.244 41.917 29.388 1.00 12.06 ? 143 TYR A CE1 1 +ATOM 1107 C CE2 . TYR A 1 141 ? 30.243 39.822 28.716 1.00 2.64 ? 143 TYR A CE2 1 +ATOM 1108 C CZ . TYR A 1 141 ? 29.703 41.064 28.399 1.00 12.53 ? 143 TYR A CZ 1 +ATOM 1109 O OH . TYR A 1 141 ? 29.623 41.474 27.068 1.00 16.42 ? 143 TYR A OH 1 +ATOM 1110 N N . ASN A 1 142 ? 26.858 38.352 32.852 1.00 40.69 ? 144 ASN A N 1 +ATOM 1111 C CA . ASN A 1 142 ? 25.997 37.262 32.479 1.00 40.65 ? 144 ASN A CA 1 +ATOM 1112 C C . ASN A 1 142 ? 24.559 37.714 32.437 1.00 41.60 ? 144 ASN A C 1 +ATOM 1113 O O . ASN A 1 142 ? 24.189 38.798 32.907 1.00 40.91 ? 144 ASN A O 1 +ATOM 1114 C CB . ASN A 1 142 ? 26.218 36.133 33.472 1.00 40.44 ? 144 ASN A CB 1 +ATOM 1115 C CG . ASN A 1 142 ? 25.796 36.364 34.903 1.00 40.78 ? 144 ASN A CG 1 +ATOM 1116 O OD1 . ASN A 1 142 ? 25.177 37.357 35.279 1.00 43.72 ? 144 ASN A OD1 1 +ATOM 1117 N ND2 . ASN A 1 142 ? 26.153 35.395 35.738 1.00 45.47 ? 144 ASN A ND2 1 +ATOM 1118 N N . TYR A 1 143 ? 23.745 36.849 31.829 1.00 43.01 ? 145 TYR A N 1 +ATOM 1119 C CA . TYR A 1 143 ? 22.336 37.155 31.699 1.00 38.93 ? 145 TYR A CA 1 +ATOM 1120 C C . TYR A 1 143 ? 21.514 35.895 31.755 1.00 37.13 ? 145 TYR A C 1 +ATOM 1121 O O . TYR A 1 143 ? 21.879 34.882 31.171 1.00 37.64 ? 145 TYR A O 1 +ATOM 1122 C CB . TYR A 1 143 ? 22.095 37.862 30.379 1.00 41.08 ? 145 TYR A CB 1 +ATOM 1123 C CG . TYR A 1 143 ? 21.047 38.939 30.541 1.00 39.25 ? 145 TYR A CG 1 +ATOM 1124 C CD1 . TYR A 1 143 ? 21.457 40.168 31.059 1.00 39.60 ? 145 TYR A CD1 1 +ATOM 1125 C CD2 . TYR A 1 143 ? 19.711 38.707 30.207 1.00 33.83 ? 145 TYR A CD2 1 +ATOM 1126 C CE1 . TYR A 1 143 ? 20.539 41.186 31.255 1.00 34.91 ? 145 TYR A CE1 1 +ATOM 1127 C CE2 . TYR A 1 143 ? 18.782 39.728 30.398 1.00 35.24 ? 145 TYR A CE2 1 +ATOM 1128 C CZ . TYR A 1 143 ? 19.210 40.959 30.918 1.00 38.08 ? 145 TYR A CZ 1 +ATOM 1129 O OH . TYR A 1 143 ? 18.337 42.015 31.070 1.00 37.35 ? 145 TYR A OH 1 +ATOM 1130 N N . ASN A 1 144 ? 20.373 36.008 32.424 1.00 34.78 ? 146 ASN A N 1 +ATOM 1131 C CA . ASN A 1 144 ? 19.456 34.904 32.623 1.00 33.43 ? 146 ASN A CA 1 +ATOM 1132 C C . ASN A 1 144 ? 18.202 34.914 31.726 1.00 32.84 ? 146 ASN A C 1 +ATOM 1133 O O . ASN A 1 144 ? 17.979 35.801 30.910 1.00 29.37 ? 146 ASN A O 1 +ATOM 1134 C CB . ASN A 1 144 ? 19.074 34.927 34.089 1.00 37.44 ? 146 ASN A CB 1 +ATOM 1135 C CG . ASN A 1 144 ? 20.269 34.983 35.033 1.00 43.45 ? 146 ASN A CG 1 +ATOM 1136 O OD1 . ASN A 1 144 ? 21.110 34.083 35.085 1.00 44.70 ? 146 ASN A OD1 1 +ATOM 1137 N ND2 . ASN A 1 144 ? 20.403 36.064 35.791 1.00 44.96 ? 146 ASN A ND2 1 +ATOM 1138 N N . SER A 1 145 ? 17.341 33.902 31.809 1.00 34.83 ? 147 SER A N 1 +ATOM 1139 C CA . SER A 1 145 ? 16.087 33.858 31.035 1.00 36.77 ? 147 SER A CA 1 +ATOM 1140 C C . SER A 1 145 ? 14.978 34.690 31.638 1.00 36.12 ? 147 SER A C 1 +ATOM 1141 O O . SER A 1 145 ? 14.719 34.645 32.846 1.00 36.71 ? 147 SER A O 1 +ATOM 1142 C CB . SER A 1 145 ? 15.470 32.485 30.943 1.00 34.91 ? 147 SER A CB 1 +ATOM 1143 O OG . SER A 1 145 ? 16.187 31.573 30.144 1.00 37.08 ? 147 SER A OG 1 +ATOM 1144 N N . HIS A 1 146 ? 14.305 35.465 30.803 1.00 31.41 ? 148 HIS A N 1 +ATOM 1145 C CA . HIS A 1 146 ? 13.139 36.170 31.296 1.00 35.94 ? 148 HIS A CA 1 +ATOM 1146 C C . HIS A 1 146 ? 11.964 36.003 30.353 1.00 34.11 ? 148 HIS A C 1 +ATOM 1147 O O . HIS A 1 146 ? 12.091 35.625 29.192 1.00 35.81 ? 148 HIS A O 1 +ATOM 1148 C CB . HIS A 1 146 ? 13.470 37.662 31.475 1.00 35.26 ? 148 HIS A CB 1 +ATOM 1149 C CG . HIS A 1 146 ? 14.681 37.841 32.362 1.00 30.01 ? 148 HIS A CG 1 +ATOM 1150 N ND1 . HIS A 1 146 ? 15.940 38.053 31.989 1.00 33.77 ? 148 HIS A ND1 1 +ATOM 1151 C CD2 . HIS A 1 146 ? 14.652 37.744 33.722 1.00 31.52 ? 148 HIS A CD2 1 +ATOM 1152 C CE1 . HIS A 1 146 ? 16.666 38.076 33.084 1.00 27.19 ? 148 HIS A CE1 1 +ATOM 1153 N NE2 . HIS A 1 146 ? 15.887 37.892 34.125 1.00 30.96 ? 148 HIS A NE2 1 +ATOM 1154 N N . ASN A 1 147 ? 10.778 36.225 30.912 1.00 38.62 ? 149 ASN A N 1 +ATOM 1155 C CA . ASN A 1 147 ? 9.537 36.245 30.128 1.00 33.81 ? 149 ASN A CA 1 +ATOM 1156 C C . ASN A 1 147 ? 9.014 37.683 30.071 1.00 30.10 ? 149 ASN A C 1 +ATOM 1157 O O . ASN A 1 147 ? 8.786 38.312 31.101 1.00 31.00 ? 149 ASN A O 1 +ATOM 1158 C CB . ASN A 1 147 ? 8.535 35.351 30.792 1.00 29.69 ? 149 ASN A CB 1 +ATOM 1159 C CG . ASN A 1 147 ? 8.908 33.884 30.805 1.00 32.80 ? 149 ASN A CG 1 +ATOM 1160 O OD1 . ASN A 1 147 ? 8.589 33.187 31.765 1.00 32.29 ? 149 ASN A OD1 1 +ATOM 1161 N ND2 . ASN A 1 147 ? 9.526 33.370 29.733 1.00 33.27 ? 149 ASN A ND2 1 +ATOM 1162 N N . VAL A 1 148 ? 8.884 38.234 28.872 1.00 28.02 ? 150 VAL A N 1 +ATOM 1163 C CA . VAL A 1 148 ? 8.382 39.553 28.669 1.00 32.74 ? 150 VAL A CA 1 +ATOM 1164 C C . VAL A 1 148 ? 6.889 39.424 28.443 1.00 36.60 ? 150 VAL A C 1 +ATOM 1165 O O . VAL A 1 148 ? 6.465 39.201 27.315 1.00 38.78 ? 150 VAL A O 1 +ATOM 1166 C CB . VAL A 1 148 ? 9.096 40.160 27.456 1.00 34.86 ? 150 VAL A CB 1 +ATOM 1167 C CG1 . VAL A 1 148 ? 8.560 41.571 27.148 1.00 35.21 ? 150 VAL A CG1 1 +ATOM 1168 C CG2 . VAL A 1 148 ? 10.584 40.257 27.765 1.00 36.01 ? 150 VAL A CG2 1 +ATOM 1169 N N . TYR A 1 149 ? 6.061 39.533 29.490 1.00 41.09 ? 151 TYR A N 1 +ATOM 1170 C CA . TYR A 1 149 ? 4.608 39.477 29.373 1.00 40.49 ? 151 TYR A CA 1 +ATOM 1171 C C . TYR A 1 149 ? 4.099 40.717 28.670 1.00 45.56 ? 151 TYR A C 1 +ATOM 1172 O O . TYR A 1 149 ? 4.229 41.836 29.174 1.00 48.82 ? 151 TYR A O 1 +ATOM 1173 C CB . TYR A 1 149 ? 3.982 39.380 30.768 1.00 39.88 ? 151 TYR A CB 1 +ATOM 1174 C CG . TYR A 1 149 ? 4.420 38.096 31.454 1.00 34.37 ? 151 TYR A CG 1 +ATOM 1175 C CD1 . TYR A 1 149 ? 3.886 36.873 31.024 1.00 33.40 ? 151 TYR A CD1 1 +ATOM 1176 C CD2 . TYR A 1 149 ? 5.411 38.124 32.437 1.00 30.99 ? 151 TYR A CD2 1 +ATOM 1177 C CE1 . TYR A 1 149 ? 4.360 35.674 31.561 1.00 28.73 ? 151 TYR A CE1 1 +ATOM 1178 C CE2 . TYR A 1 149 ? 5.877 36.924 32.983 1.00 33.17 ? 151 TYR A CE2 1 +ATOM 1179 C CZ . TYR A 1 149 ? 5.349 35.709 32.534 1.00 29.16 ? 151 TYR A CZ 1 +ATOM 1180 O OH . TYR A 1 149 ? 5.834 34.532 33.053 1.00 27.87 ? 151 TYR A OH 1 +ATOM 1181 N N . ILE A 1 150 ? 3.575 40.499 27.455 1.00 48.16 ? 152 ILE A N 1 +ATOM 1182 C CA . ILE A 1 150 ? 2.981 41.549 26.626 1.00 47.57 ? 152 ILE A CA 1 +ATOM 1183 C C . ILE A 1 150 ? 1.446 41.494 26.670 1.00 48.56 ? 152 ILE A C 1 +ATOM 1184 O O . ILE A 1 150 ? 0.799 40.440 26.712 1.00 45.59 ? 152 ILE A O 1 +ATOM 1185 C CB . ILE A 1 150 ? 3.475 41.401 25.172 1.00 47.08 ? 152 ILE A CB 1 +ATOM 1186 C CG1 . ILE A 1 150 ? 4.973 41.537 25.143 1.00 50.19 ? 152 ILE A CG1 1 +ATOM 1187 C CG2 . ILE A 1 150 ? 2.910 42.499 24.274 1.00 46.44 ? 152 ILE A CG2 1 +ATOM 1188 C CD1 . ILE A 1 150 ? 5.472 40.973 23.810 1.00 54.81 ? 152 ILE A CD1 1 +ATOM 1189 N N . THR A 1 151 ? 0.912 42.721 26.706 1.00 49.00 ? 153 THR A N 1 +ATOM 1190 C CA . THR A 1 151 ? -0.510 42.995 26.709 1.00 49.33 ? 153 THR A CA 1 +ATOM 1191 C C . THR A 1 151 ? -0.822 44.195 25.828 1.00 50.12 ? 153 THR A C 1 +ATOM 1192 O O . THR A 1 151 ? -0.029 45.126 25.701 1.00 51.56 ? 153 THR A O 1 +ATOM 1193 C CB . THR A 1 151 ? -0.961 43.220 28.181 1.00 49.48 ? 153 THR A CB 1 +ATOM 1194 O OG1 . THR A 1 151 ? -2.366 43.383 28.058 1.00 50.86 ? 153 THR A OG1 1 +ATOM 1195 C CG2 . THR A 1 151 ? -0.320 44.387 28.927 1.00 47.05 ? 153 THR A CG2 1 +ATOM 1196 N N . ALA A 1 152 ? -1.973 44.202 25.156 1.00 53.20 ? 154 ALA A N 1 +ATOM 1197 C CA . ALA A 1 152 ? -2.335 45.339 24.325 1.00 53.21 ? 154 ALA A CA 1 +ATOM 1198 C C . ALA A 1 152 ? -2.725 46.582 25.130 1.00 54.61 ? 154 ALA A C 1 +ATOM 1199 O O . ALA A 1 152 ? -3.233 46.562 26.256 1.00 53.05 ? 154 ALA A O 1 +ATOM 1200 C CB . ALA A 1 152 ? -3.497 44.974 23.430 1.00 50.24 ? 154 ALA A CB 1 +ATOM 1201 N N . ASP A 1 153 ? -2.397 47.694 24.497 1.00 55.82 ? 155 ASP A N 1 +ATOM 1202 C CA . ASP A 1 153 ? -2.704 49.015 24.992 1.00 59.24 ? 155 ASP A CA 1 +ATOM 1203 C C . ASP A 1 153 ? -3.399 49.642 23.800 1.00 59.47 ? 155 ASP A C 1 +ATOM 1204 O O . ASP A 1 153 ? -2.831 50.242 22.878 1.00 58.47 ? 155 ASP A O 1 +ATOM 1205 C CB . ASP A 1 153 ? -1.402 49.695 25.342 1.00 63.37 ? 155 ASP A CB 1 +ATOM 1206 C CG . ASP A 1 153 ? -1.484 51.101 25.891 1.00 69.11 ? 155 ASP A CG 1 +ATOM 1207 O OD1 . ASP A 1 153 ? -2.421 51.445 26.618 1.00 71.97 ? 155 ASP A OD1 1 +ATOM 1208 O OD2 . ASP A 1 153 ? -0.556 51.839 25.588 1.00 72.20 ? 155 ASP A OD2 1 +ATOM 1209 N N . LYS A 1 154 ? -4.708 49.405 23.968 1.00 60.84 ? 156 LYS A N 1 +ATOM 1210 C CA . LYS A 1 154 ? -5.778 49.782 23.056 1.00 59.46 ? 156 LYS A CA 1 +ATOM 1211 C C . LYS A 1 154 ? -5.850 51.298 22.900 1.00 57.11 ? 156 LYS A C 1 +ATOM 1212 O O . LYS A 1 154 ? -6.009 51.860 21.812 1.00 57.41 ? 156 LYS A O 1 +ATOM 1213 C CB . LYS A 1 154 ? -7.065 49.222 23.635 1.00 62.24 ? 156 LYS A CB 1 +ATOM 1214 C CG . LYS A 1 154 ? -8.240 49.097 22.661 1.00 66.52 ? 156 LYS A CG 1 +ATOM 1215 C CD . LYS A 1 154 ? -8.281 47.768 21.883 1.00 69.95 ? 156 LYS A CD 1 +ATOM 1216 C CE . LYS A 1 154 ? -8.507 46.509 22.746 1.00 66.02 ? 156 LYS A CE 1 +ATOM 1217 N NZ . LYS A 1 154 ? -7.265 45.791 22.990 1.00 61.94 ? 156 LYS A NZ 1 +ATOM 1218 N N . GLN A 1 155 ? -5.677 51.895 24.079 1.00 55.22 ? 157 GLN A N 1 +ATOM 1219 C CA . GLN A 1 155 ? -5.653 53.313 24.366 1.00 56.22 ? 157 GLN A CA 1 +ATOM 1220 C C . GLN A 1 155 ? -4.621 54.098 23.583 1.00 55.00 ? 157 GLN A C 1 +ATOM 1221 O O . GLN A 1 155 ? -4.959 55.162 23.043 1.00 55.47 ? 157 GLN A O 1 +ATOM 1222 C CB . GLN A 1 155 ? -5.428 53.488 25.875 1.00 60.45 ? 157 GLN A CB 1 +ATOM 1223 C CG . GLN A 1 155 ? -6.512 52.821 26.726 1.00 67.21 ? 157 GLN A CG 1 +ATOM 1224 C CD . GLN A 1 155 ? -6.110 51.569 27.515 1.00 73.33 ? 157 GLN A CD 1 +ATOM 1225 O OE1 . GLN A 1 155 ? -6.923 50.660 27.735 1.00 73.03 ? 157 GLN A OE1 1 +ATOM 1226 N NE2 . GLN A 1 155 ? -4.858 51.512 27.995 1.00 72.92 ? 157 GLN A NE2 1 +ATOM 1227 N N . LYS A 1 156 ? -3.376 53.570 23.537 1.00 52.62 ? 158 LYS A N 1 +ATOM 1228 C CA . LYS A 1 156 ? -2.264 54.177 22.788 1.00 48.76 ? 158 LYS A CA 1 +ATOM 1229 C C . LYS A 1 156 ? -2.019 53.537 21.414 1.00 46.14 ? 158 LYS A C 1 +ATOM 1230 O O . LYS A 1 156 ? -1.171 54.035 20.663 1.00 43.34 ? 158 LYS A O 1 +ATOM 1231 C CB . LYS A 1 156 ? -0.924 54.086 23.545 1.00 46.22 ? 158 LYS A CB 1 +ATOM 1232 C CG . LYS A 1 156 ? -0.461 55.076 24.632 1.00 42.54 ? 158 LYS A CG 1 +ATOM 1233 C CD . LYS A 1 156 ? -0.921 54.797 26.065 1.00 37.67 ? 158 LYS A CD 1 +ATOM 1234 C CE . LYS A 1 156 ? 0.010 55.460 27.102 1.00 42.56 ? 158 LYS A CE 1 +ATOM 1235 N NZ . LYS A 1 156 ? -0.453 55.322 28.482 1.00 36.90 ? 158 LYS A NZ 1 +ATOM 1236 N N . ASN A 1 157 ? -2.763 52.452 21.080 1.00 42.24 ? 159 ASN A N 1 +ATOM 1237 C CA . ASN A 1 157 ? -2.656 51.626 19.866 1.00 39.66 ? 159 ASN A CA 1 +ATOM 1238 C C . ASN A 1 157 ? -1.248 51.037 19.744 1.00 39.92 ? 159 ASN A C 1 +ATOM 1239 O O . ASN A 1 157 ? -0.516 51.061 18.766 1.00 39.48 ? 159 ASN A O 1 +ATOM 1240 C CB . ASN A 1 157 ? -3.032 52.477 18.620 1.00 37.21 ? 159 ASN A CB 1 +ATOM 1241 C CG . ASN A 1 157 ? -2.771 51.792 17.284 1.00 36.10 ? 159 ASN A CG 1 +ATOM 1242 O OD1 . ASN A 1 157 ? -3.360 50.754 16.980 1.00 33.60 ? 159 ASN A OD1 1 +ATOM 1243 N ND2 . ASN A 1 157 ? -1.809 52.318 16.504 1.00 31.49 ? 159 ASN A ND2 1 +ATOM 1244 N N . GLY A 1 158 ? -0.851 50.454 20.839 1.00 40.47 ? 160 GLY A N 1 +ATOM 1245 C CA . GLY A 1 158 ? 0.433 49.816 20.964 1.00 43.40 ? 160 GLY A CA 1 +ATOM 1246 C C . GLY A 1 158 ? 0.328 48.709 21.978 1.00 43.31 ? 160 GLY A C 1 +ATOM 1247 O O . GLY A 1 158 ? -0.730 48.104 22.136 1.00 46.55 ? 160 GLY A O 1 +ATOM 1248 N N . ILE A 1 159 ? 1.443 48.416 22.636 1.00 43.05 ? 161 ILE A N 1 +ATOM 1249 C CA . ILE A 1 159 ? 1.472 47.371 23.644 1.00 47.47 ? 161 ILE A CA 1 +ATOM 1250 C C . ILE A 1 159 ? 2.164 47.855 24.906 1.00 47.61 ? 161 ILE A C 1 +ATOM 1251 O O . ILE A 1 159 ? 2.744 48.936 24.964 1.00 50.15 ? 161 ILE A O 1 +ATOM 1252 C CB . ILE A 1 159 ? 2.200 46.084 23.114 1.00 47.76 ? 161 ILE A CB 1 +ATOM 1253 C CG1 . ILE A 1 159 ? 3.644 46.367 22.672 1.00 53.08 ? 161 ILE A CG1 1 +ATOM 1254 C CG2 . ILE A 1 159 ? 1.409 45.542 21.941 1.00 44.87 ? 161 ILE A CG2 1 +ATOM 1255 C CD1 . ILE A 1 159 ? 4.711 45.631 23.523 1.00 54.89 ? 161 ILE A CD1 1 +ATOM 1256 N N . LYS A 1 160 ? 2.026 47.056 25.951 1.00 46.15 ? 162 LYS A N 1 +ATOM 1257 C CA . LYS A 1 160 ? 2.705 47.286 27.202 1.00 46.20 ? 162 LYS A CA 1 +ATOM 1258 C C . LYS A 1 160 ? 3.324 45.959 27.623 1.00 48.12 ? 162 LYS A C 1 +ATOM 1259 O O . LYS A 1 160 ? 2.793 44.881 27.335 1.00 46.14 ? 162 LYS A O 1 +ATOM 1260 C CB . LYS A 1 160 ? 1.722 47.790 28.261 1.00 46.24 ? 162 LYS A CB 1 +ATOM 1261 C CG . LYS A 1 160 ? 1.252 49.236 27.993 1.00 48.85 ? 162 LYS A CG 1 +ATOM 1262 C CD . LYS A 1 160 ? -0.006 49.650 28.786 1.00 56.60 ? 162 LYS A CD 1 +ATOM 1263 C CE . LYS A 1 160 ? 0.213 50.047 30.241 1.00 57.87 ? 162 LYS A CE 1 +ATOM 1264 N NZ . LYS A 1 160 ? 0.941 51.295 30.284 1.00 59.19 ? 162 LYS A NZ 1 +ATOM 1265 N N . ALA A 1 161 ? 4.518 46.019 28.226 1.00 47.98 ? 163 ALA A N 1 +ATOM 1266 C CA . ALA A 1 161 ? 5.181 44.812 28.682 1.00 46.71 ? 163 ALA A CA 1 +ATOM 1267 C C . ALA A 1 161 ? 5.775 45.071 30.042 1.00 48.29 ? 163 ALA A C 1 +ATOM 1268 O O . ALA A 1 161 ? 6.253 46.165 30.352 1.00 47.73 ? 163 ALA A O 1 +ATOM 1269 C CB . ALA A 1 161 ? 6.298 44.400 27.745 1.00 42.92 ? 163 ALA A CB 1 +ATOM 1270 N N . ASN A 1 162 ? 5.677 44.028 30.857 1.00 46.31 ? 164 ASN A N 1 +ATOM 1271 C CA . ASN A 1 162 ? 6.093 44.077 32.238 1.00 50.54 ? 164 ASN A CA 1 +ATOM 1272 C C . ASN A 1 162 ? 6.911 42.850 32.469 1.00 49.75 ? 164 ASN A C 1 +ATOM 1273 O O . ASN A 1 162 ? 6.556 41.747 32.039 1.00 54.76 ? 164 ASN A O 1 +ATOM 1274 C CB . ASN A 1 162 ? 4.926 44.017 33.234 1.00 56.01 ? 164 ASN A CB 1 +ATOM 1275 C CG . ASN A 1 162 ? 3.943 45.182 33.159 1.00 62.62 ? 164 ASN A CG 1 +ATOM 1276 O OD1 . ASN A 1 162 ? 3.838 45.978 34.098 1.00 68.12 ? 164 ASN A OD1 1 +ATOM 1277 N ND2 . ASN A 1 162 ? 3.184 45.313 32.061 1.00 62.48 ? 164 ASN A ND2 1 +ATOM 1278 N N . PHE A 1 163 ? 8.037 43.086 33.141 1.00 48.94 ? 165 PHE A N 1 +ATOM 1279 C CA . PHE A 1 163 ? 8.944 42.011 33.548 1.00 44.00 ? 165 PHE A CA 1 +ATOM 1280 C C . PHE A 1 163 ? 10.050 42.492 34.442 1.00 43.52 ? 165 PHE A C 1 +ATOM 1281 O O . PHE A 1 163 ? 10.504 43.633 34.354 1.00 47.09 ? 165 PHE A O 1 +ATOM 1282 C CB . PHE A 1 163 ? 9.612 41.313 32.343 1.00 33.22 ? 165 PHE A CB 1 +ATOM 1283 C CG . PHE A 1 163 ? 10.275 42.236 31.342 1.00 24.01 ? 165 PHE A CG 1 +ATOM 1284 C CD1 . PHE A 1 163 ? 9.516 42.957 30.433 1.00 15.46 ? 165 PHE A CD1 1 +ATOM 1285 C CD2 . PHE A 1 163 ? 11.667 42.289 31.297 1.00 27.71 ? 165 PHE A CD2 1 +ATOM 1286 C CE1 . PHE A 1 163 ? 10.142 43.721 29.478 1.00 15.83 ? 165 PHE A CE1 1 +ATOM 1287 C CE2 . PHE A 1 163 ? 12.293 43.059 30.338 1.00 18.91 ? 165 PHE A CE2 1 +ATOM 1288 C CZ . PHE A 1 163 ? 11.532 43.771 29.427 1.00 20.35 ? 165 PHE A CZ 1 +ATOM 1289 N N . LYS A 1 164 ? 10.466 41.554 35.284 1.00 43.92 ? 166 LYS A N 1 +ATOM 1290 C CA . LYS A 1 164 ? 11.591 41.755 36.178 1.00 45.73 ? 166 LYS A CA 1 +ATOM 1291 C C . LYS A 1 164 ? 12.777 40.913 35.719 1.00 41.75 ? 166 LYS A C 1 +ATOM 1292 O O . LYS A 1 164 ? 12.663 39.690 35.684 1.00 33.98 ? 166 LYS A O 1 +ATOM 1293 C CB . LYS A 1 164 ? 11.195 41.359 37.608 1.00 53.38 ? 166 LYS A CB 1 +ATOM 1294 C CG . LYS A 1 164 ? 10.061 42.229 38.177 1.00 61.56 ? 166 LYS A CG 1 +ATOM 1295 C CD . LYS A 1 164 ? 9.275 41.582 39.329 1.00 66.72 ? 166 LYS A CD 1 +ATOM 1296 C CE . LYS A 1 164 ? 10.020 41.566 40.660 1.00 71.31 ? 166 LYS A CE 1 +ATOM 1297 N NZ . LYS A 1 164 ? 10.275 42.925 41.120 1.00 70.09 ? 166 LYS A NZ 1 +ATOM 1298 N N . ILE A 1 165 ? 13.872 41.598 35.321 1.00 41.26 ? 167 ILE A N 1 +ATOM 1299 C CA . ILE A 1 165 ? 15.188 41.021 34.995 1.00 36.50 ? 167 ILE A CA 1 +ATOM 1300 C C . ILE A 1 165 ? 15.931 40.712 36.295 1.00 39.01 ? 167 ILE A C 1 +ATOM 1301 O O . ILE A 1 165 ? 16.004 41.526 37.212 1.00 41.12 ? 167 ILE A O 1 +ATOM 1302 C CB . ILE A 1 165 ? 16.107 41.986 34.193 1.00 29.69 ? 167 ILE A CB 1 +ATOM 1303 C CG1 . ILE A 1 165 ? 15.512 42.273 32.827 1.00 28.18 ? 167 ILE A CG1 1 +ATOM 1304 C CG2 . ILE A 1 165 ? 17.521 41.402 34.094 1.00 29.43 ? 167 ILE A CG2 1 +ATOM 1305 C CD1 . ILE A 1 165 ? 15.373 41.177 31.750 1.00 19.96 ? 167 ILE A CD1 1 +ATOM 1306 N N . ARG A 1 166 ? 16.504 39.511 36.341 1.00 40.48 ? 168 ARG A N 1 +ATOM 1307 C CA . ARG A 1 166 ? 17.342 39.057 37.426 1.00 40.70 ? 168 ARG A CA 1 +ATOM 1308 C C . ARG A 1 166 ? 18.771 39.167 36.937 1.00 41.09 ? 168 ARG A C 1 +ATOM 1309 O O . ARG A 1 166 ? 19.195 38.511 35.973 1.00 40.46 ? 168 ARG A O 1 +ATOM 1310 C CB . ARG A 1 166 ? 17.051 37.613 37.776 1.00 42.87 ? 168 ARG A CB 1 +ATOM 1311 C CG . ARG A 1 166 ? 15.575 37.349 38.088 1.00 41.14 ? 168 ARG A CG 1 +ATOM 1312 C CD . ARG A 1 166 ? 15.367 35.853 38.331 1.00 41.78 ? 168 ARG A CD 1 +ATOM 1313 N NE . ARG A 1 166 ? 15.852 35.024 37.239 1.00 36.68 ? 168 ARG A NE 1 +ATOM 1314 C CZ . ARG A 1 166 ? 15.246 34.876 36.058 1.00 38.76 ? 168 ARG A CZ 1 +ATOM 1315 N NH1 . ARG A 1 166 ? 14.106 35.500 35.779 1.00 42.94 ? 168 ARG A NH1 1 +ATOM 1316 N NH2 . ARG A 1 166 ? 15.793 34.067 35.151 1.00 32.24 ? 168 ARG A NH2 1 +ATOM 1317 N N . HIS A 1 167 ? 19.460 40.112 37.594 1.00 41.04 ? 169 HIS A N 1 +ATOM 1318 C CA . HIS A 1 167 ? 20.885 40.385 37.380 1.00 39.93 ? 169 HIS A CA 1 +ATOM 1319 C C . HIS A 1 167 ? 21.664 39.709 38.484 1.00 43.43 ? 169 HIS A C 1 +ATOM 1320 O O . HIS A 1 167 ? 21.440 39.996 39.666 1.00 47.96 ? 169 HIS A O 1 +ATOM 1321 C CB . HIS A 1 167 ? 21.236 41.862 37.466 1.00 33.89 ? 169 HIS A CB 1 +ATOM 1322 C CG . HIS A 1 167 ? 20.740 42.659 36.291 1.00 28.07 ? 169 HIS A CG 1 +ATOM 1323 N ND1 . HIS A 1 167 ? 20.001 43.751 36.348 1.00 25.13 ? 169 HIS A ND1 1 +ATOM 1324 C CD2 . HIS A 1 167 ? 21.006 42.333 34.986 1.00 21.59 ? 169 HIS A CD2 1 +ATOM 1325 C CE1 . HIS A 1 167 ? 19.819 44.083 35.097 1.00 22.45 ? 169 HIS A CE1 1 +ATOM 1326 N NE2 . HIS A 1 167 ? 20.417 43.245 34.282 1.00 22.05 ? 169 HIS A NE2 1 +ATOM 1327 N N . ASN A 1 168 ? 22.577 38.802 38.123 1.00 46.42 ? 170 ASN A N 1 +ATOM 1328 C CA . ASN A 1 168 ? 23.353 38.147 39.153 1.00 44.73 ? 170 ASN A CA 1 +ATOM 1329 C C . ASN A 1 168 ? 24.481 39.070 39.604 1.00 49.90 ? 170 ASN A C 1 +ATOM 1330 O O . ASN A 1 168 ? 25.124 39.749 38.798 1.00 49.26 ? 170 ASN A O 1 +ATOM 1331 C CB . ASN A 1 168 ? 23.911 36.842 38.620 1.00 43.04 ? 170 ASN A CB 1 +ATOM 1332 C CG . ASN A 1 168 ? 22.918 35.690 38.440 1.00 38.49 ? 170 ASN A CG 1 +ATOM 1333 O OD1 . ASN A 1 168 ? 22.119 35.373 39.311 1.00 37.69 ? 170 ASN A OD1 1 +ATOM 1334 N ND2 . ASN A 1 168 ? 22.964 35.000 37.306 1.00 38.59 ? 170 ASN A ND2 1 +ATOM 1335 N N . ILE A 1 169 ? 24.635 39.159 40.933 1.00 53.15 ? 171 ILE A N 1 +ATOM 1336 C CA . ILE A 1 169 ? 25.684 39.943 41.590 1.00 55.47 ? 171 ILE A CA 1 +ATOM 1337 C C . ILE A 1 169 ? 26.789 38.966 42.020 1.00 57.00 ? 171 ILE A C 1 +ATOM 1338 O O . ILE A 1 169 ? 26.548 37.792 42.323 1.00 58.69 ? 171 ILE A O 1 +ATOM 1339 C CB . ILE A 1 169 ? 25.087 40.712 42.838 1.00 56.99 ? 171 ILE A CB 1 +ATOM 1340 C CG1 . ILE A 1 169 ? 23.854 41.511 42.422 1.00 60.54 ? 171 ILE A CG1 1 +ATOM 1341 C CG2 . ILE A 1 169 ? 26.078 41.720 43.420 1.00 59.10 ? 171 ILE A CG2 1 +ATOM 1342 C CD1 . ILE A 1 169 ? 24.091 42.484 41.262 1.00 56.37 ? 171 ILE A CD1 1 +ATOM 1343 N N . GLU A 1 170 ? 28.033 39.457 42.007 1.00 57.61 ? 172 GLU A N 1 +ATOM 1344 C CA . GLU A 1 170 ? 29.227 38.710 42.361 1.00 60.03 ? 172 GLU A CA 1 +ATOM 1345 C C . GLU A 1 170 ? 29.271 38.016 43.727 1.00 62.02 ? 172 GLU A C 1 +ATOM 1346 O O . GLU A 1 170 ? 29.969 37.009 43.887 1.00 62.28 ? 172 GLU A O 1 +ATOM 1347 C CB . GLU A 1 170 ? 30.418 39.665 42.209 1.00 60.96 ? 172 GLU A CB 1 +ATOM 1348 C CG . GLU A 1 170 ? 30.225 40.997 42.923 1.00 62.77 ? 172 GLU A CG 1 +ATOM 1349 C CD . GLU A 1 170 ? 31.251 42.082 42.632 1.00 62.98 ? 172 GLU A CD 1 +ATOM 1350 O OE1 . GLU A 1 170 ? 31.653 42.298 41.477 1.00 61.90 ? 172 GLU A OE1 1 +ATOM 1351 O OE2 . GLU A 1 170 ? 31.621 42.732 43.599 1.00 56.18 ? 172 GLU A OE2 1 +ATOM 1352 N N . ASP A 1 171 ? 28.537 38.501 44.735 1.00 62.78 ? 173 ASP A N 1 +ATOM 1353 C CA . ASP A 1 171 ? 28.489 37.831 46.030 1.00 64.53 ? 173 ASP A CA 1 +ATOM 1354 C C . ASP A 1 171 ? 27.609 36.562 46.018 1.00 65.19 ? 173 ASP A C 1 +ATOM 1355 O O . ASP A 1 171 ? 27.847 35.575 46.725 1.00 64.24 ? 173 ASP A O 1 +ATOM 1356 C CB . ASP A 1 171 ? 28.014 38.878 47.079 1.00 65.99 ? 173 ASP A CB 1 +ATOM 1357 C CG . ASP A 1 171 ? 26.700 39.638 46.837 1.00 66.76 ? 173 ASP A CG 1 +ATOM 1358 O OD1 . ASP A 1 171 ? 25.779 39.031 46.313 1.00 65.90 ? 173 ASP A OD1 1 +ATOM 1359 O OD2 . ASP A 1 171 ? 26.578 40.817 47.186 1.00 59.22 ? 173 ASP A OD2 1 +ATOM 1360 N N . GLY A 1 172 ? 26.614 36.552 45.126 1.00 64.16 ? 174 GLY A N 1 +ATOM 1361 C CA . GLY A 1 172 ? 25.682 35.441 44.990 1.00 62.89 ? 174 GLY A CA 1 +ATOM 1362 C C . GLY A 1 172 ? 24.254 35.928 44.780 1.00 60.52 ? 174 GLY A C 1 +ATOM 1363 O O . GLY A 1 172 ? 23.440 35.257 44.140 1.00 59.67 ? 174 GLY A O 1 +ATOM 1364 N N . SER A 1 173 ? 23.991 37.136 45.301 1.00 57.81 ? 175 SER A N 1 +ATOM 1365 C CA . SER A 1 173 ? 22.680 37.745 45.261 1.00 54.86 ? 175 SER A CA 1 +ATOM 1366 C C . SER A 1 173 ? 22.223 38.320 43.916 1.00 53.41 ? 175 SER A C 1 +ATOM 1367 O O . SER A 1 173 ? 22.934 38.311 42.911 1.00 51.11 ? 175 SER A O 1 +ATOM 1368 C CB . SER A 1 173 ? 22.621 38.819 46.363 1.00 53.23 ? 175 SER A CB 1 +ATOM 1369 O OG . SER A 1 173 ? 23.297 40.015 46.020 1.00 54.20 ? 175 SER A OG 1 +ATOM 1370 N N . VAL A 1 174 ? 20.968 38.785 43.877 1.00 53.17 ? 176 VAL A N 1 +ATOM 1371 C CA . VAL A 1 174 ? 20.351 39.228 42.640 1.00 51.52 ? 176 VAL A CA 1 +ATOM 1372 C C . VAL A 1 174 ? 19.784 40.640 42.738 1.00 50.87 ? 176 VAL A C 1 +ATOM 1373 O O . VAL A 1 174 ? 19.068 40.980 43.687 1.00 54.03 ? 176 VAL A O 1 +ATOM 1374 C CB . VAL A 1 174 ? 19.243 38.209 42.266 1.00 50.90 ? 176 VAL A CB 1 +ATOM 1375 C CG1 . VAL A 1 174 ? 18.608 38.609 40.950 1.00 49.21 ? 176 VAL A CG1 1 +ATOM 1376 C CG2 . VAL A 1 174 ? 19.821 36.809 42.102 1.00 51.87 ? 176 VAL A CG2 1 +ATOM 1377 N N . GLN A 1 175 ? 20.156 41.461 41.742 1.00 47.88 ? 177 GLN A N 1 +ATOM 1378 C CA . GLN A 1 175 ? 19.647 42.814 41.561 1.00 47.33 ? 177 GLN A CA 1 +ATOM 1379 C C . GLN A 1 175 ? 18.488 42.756 40.566 1.00 47.83 ? 177 GLN A C 1 +ATOM 1380 O O . GLN A 1 175 ? 18.657 42.464 39.375 1.00 47.50 ? 177 GLN A O 1 +ATOM 1381 C CB . GLN A 1 175 ? 20.748 43.713 41.016 1.00 49.36 ? 177 GLN A CB 1 +ATOM 1382 C CG . GLN A 1 175 ? 20.385 45.121 40.524 1.00 49.90 ? 177 GLN A CG 1 +ATOM 1383 C CD . GLN A 1 175 ? 19.831 46.058 41.587 1.00 52.74 ? 177 GLN A CD 1 +ATOM 1384 O OE1 . GLN A 1 175 ? 20.577 46.857 42.142 1.00 54.35 ? 177 GLN A OE1 1 +ATOM 1385 N NE2 . GLN A 1 175 ? 18.532 45.998 41.912 1.00 49.51 ? 177 GLN A NE2 1 +ATOM 1386 N N . LEU A 1 176 ? 17.293 43.057 41.079 1.00 46.55 ? 178 LEU A N 1 +ATOM 1387 C CA . LEU A 1 176 ? 16.087 42.981 40.272 1.00 46.40 ? 178 LEU A CA 1 +ATOM 1388 C C . LEU A 1 176 ? 15.867 44.239 39.484 1.00 44.15 ? 178 LEU A C 1 +ATOM 1389 O O . LEU A 1 176 ? 15.990 45.330 40.040 1.00 46.49 ? 178 LEU A O 1 +ATOM 1390 C CB . LEU A 1 176 ? 14.846 42.738 41.143 1.00 45.09 ? 178 LEU A CB 1 +ATOM 1391 C CG . LEU A 1 176 ? 14.633 41.394 41.843 1.00 48.93 ? 178 LEU A CG 1 +ATOM 1392 C CD1 . LEU A 1 176 ? 15.025 40.265 40.900 1.00 52.19 ? 178 LEU A CD1 1 +ATOM 1393 C CD2 . LEU A 1 176 ? 15.470 41.314 43.110 1.00 54.40 ? 178 LEU A CD2 1 +ATOM 1394 N N . ALA A 1 177 ? 15.570 44.101 38.189 1.00 41.26 ? 179 ALA A N 1 +ATOM 1395 C CA . ALA A 1 177 ? 15.280 45.265 37.388 1.00 43.50 ? 179 ALA A CA 1 +ATOM 1396 C C . ALA A 1 177 ? 13.865 45.144 36.837 1.00 47.31 ? 179 ALA A C 1 +ATOM 1397 O O . ALA A 1 177 ? 13.510 44.226 36.086 1.00 46.89 ? 179 ALA A O 1 +ATOM 1398 C CB . ALA A 1 177 ? 16.273 45.366 36.259 1.00 43.23 ? 179 ALA A CB 1 +ATOM 1399 N N . ASP A 1 178 ? 13.044 46.106 37.293 1.00 47.79 ? 180 ASP A N 1 +ATOM 1400 C CA . ASP A 1 178 ? 11.643 46.175 36.943 1.00 46.73 ? 180 ASP A CA 1 +ATOM 1401 C C . ASP A 1 178 ? 11.448 46.950 35.682 1.00 43.31 ? 180 ASP A C 1 +ATOM 1402 O O . ASP A 1 178 ? 11.656 48.153 35.648 1.00 44.20 ? 180 ASP A O 1 +ATOM 1403 C CB . ASP A 1 178 ? 10.855 46.849 38.041 1.00 52.44 ? 180 ASP A CB 1 +ATOM 1404 C CG . ASP A 1 178 ? 9.826 45.949 38.703 1.00 54.89 ? 180 ASP A CG 1 +ATOM 1405 O OD1 . ASP A 1 178 ? 8.950 45.454 37.996 1.00 57.34 ? 180 ASP A OD1 1 +ATOM 1406 O OD2 . ASP A 1 178 ? 9.899 45.758 39.918 1.00 56.58 ? 180 ASP A OD2 1 +ATOM 1407 N N . HIS A 1 179 ? 11.060 46.271 34.615 1.00 44.01 ? 181 HIS A N 1 +ATOM 1408 C CA . HIS A 1 179 ? 10.789 46.980 33.379 1.00 41.19 ? 181 HIS A CA 1 +ATOM 1409 C C . HIS A 1 179 ? 9.302 47.184 33.235 1.00 41.31 ? 181 HIS A C 1 +ATOM 1410 O O . HIS A 1 179 ? 8.481 46.301 33.496 1.00 41.33 ? 181 HIS A O 1 +ATOM 1411 C CB . HIS A 1 179 ? 11.285 46.207 32.173 1.00 39.84 ? 181 HIS A CB 1 +ATOM 1412 C CG . HIS A 1 179 ? 12.785 45.995 32.228 1.00 39.18 ? 181 HIS A CG 1 +ATOM 1413 N ND1 . HIS A 1 179 ? 13.482 45.516 33.247 1.00 35.80 ? 181 HIS A ND1 1 +ATOM 1414 C CD2 . HIS A 1 179 ? 13.645 46.289 31.205 1.00 40.30 ? 181 HIS A CD2 1 +ATOM 1415 C CE1 . HIS A 1 179 ? 14.730 45.526 32.850 1.00 39.54 ? 181 HIS A CE1 1 +ATOM 1416 N NE2 . HIS A 1 179 ? 14.836 45.988 31.631 1.00 38.81 ? 181 HIS A NE2 1 +ATOM 1417 N N . TYR A 1 180 ? 8.987 48.424 32.879 1.00 39.50 ? 182 TYR A N 1 +ATOM 1418 C CA . TYR A 1 180 ? 7.619 48.767 32.581 1.00 39.67 ? 182 TYR A CA 1 +ATOM 1419 C C . TYR A 1 180 ? 7.819 49.370 31.217 1.00 36.51 ? 182 TYR A C 1 +ATOM 1420 O O . TYR A 1 180 ? 8.369 50.457 31.026 1.00 38.98 ? 182 TYR A O 1 +ATOM 1421 C CB . TYR A 1 180 ? 7.064 49.792 33.581 1.00 45.30 ? 182 TYR A CB 1 +ATOM 1422 C CG . TYR A 1 180 ? 7.193 49.357 35.044 1.00 55.31 ? 182 TYR A CG 1 +ATOM 1423 C CD1 . TYR A 1 180 ? 6.333 48.388 35.570 1.00 60.34 ? 182 TYR A CD1 1 +ATOM 1424 C CD2 . TYR A 1 180 ? 8.179 49.930 35.863 1.00 58.49 ? 182 TYR A CD2 1 +ATOM 1425 C CE1 . TYR A 1 180 ? 6.459 47.995 36.903 1.00 65.30 ? 182 TYR A CE1 1 +ATOM 1426 C CE2 . TYR A 1 180 ? 8.309 49.542 37.198 1.00 62.89 ? 182 TYR A CE2 1 +ATOM 1427 C CZ . TYR A 1 180 ? 7.445 48.576 37.711 1.00 66.26 ? 182 TYR A CZ 1 +ATOM 1428 O OH . TYR A 1 180 ? 7.556 48.194 39.039 1.00 70.58 ? 182 TYR A OH 1 +ATOM 1429 N N . GLN A 1 181 ? 7.430 48.545 30.251 1.00 33.05 ? 183 GLN A N 1 +ATOM 1430 C CA . GLN A 1 181 ? 7.564 48.876 28.851 1.00 31.14 ? 183 GLN A CA 1 +ATOM 1431 C C . GLN A 1 181 ? 6.263 49.328 28.201 1.00 32.22 ? 183 GLN A C 1 +ATOM 1432 O O . GLN A 1 181 ? 5.168 49.091 28.683 1.00 37.80 ? 183 GLN A O 1 +ATOM 1433 C CB . GLN A 1 181 ? 8.154 47.636 28.192 1.00 30.52 ? 183 GLN A CB 1 +ATOM 1434 C CG . GLN A 1 181 ? 8.457 47.753 26.711 1.00 31.74 ? 183 GLN A CG 1 +ATOM 1435 C CD . GLN A 1 181 ? 8.968 46.489 26.083 1.00 31.59 ? 183 GLN A CD 1 +ATOM 1436 O OE1 . GLN A 1 181 ? 9.401 45.579 26.786 1.00 40.93 ? 183 GLN A OE1 1 +ATOM 1437 N NE2 . GLN A 1 181 ? 8.955 46.423 24.755 1.00 29.97 ? 183 GLN A NE2 1 +ATOM 1438 N N . GLN A 1 182 ? 6.355 49.989 27.068 1.00 31.84 ? 184 GLN A N 1 +ATOM 1439 C CA . GLN A 1 182 ? 5.220 50.452 26.320 1.00 29.92 ? 184 GLN A CA 1 +ATOM 1440 C C . GLN A 1 182 ? 5.808 50.645 24.943 1.00 31.67 ? 184 GLN A C 1 +ATOM 1441 O O . GLN A 1 182 ? 6.953 51.085 24.772 1.00 33.89 ? 184 GLN A O 1 +ATOM 1442 C CB . GLN A 1 182 ? 4.772 51.746 26.959 1.00 40.21 ? 184 GLN A CB 1 +ATOM 1443 C CG . GLN A 1 182 ? 3.512 52.578 26.713 1.00 40.47 ? 184 GLN A CG 1 +ATOM 1444 C CD . GLN A 1 182 ? 3.679 53.731 27.692 1.00 46.40 ? 184 GLN A CD 1 +ATOM 1445 O OE1 . GLN A 1 182 ? 3.243 53.637 28.844 1.00 50.12 ? 184 GLN A OE1 1 +ATOM 1446 N NE2 . GLN A 1 182 ? 4.211 54.879 27.242 1.00 35.13 ? 184 GLN A NE2 1 +ATOM 1447 N N . ASN A 1 183 ? 5.042 50.236 23.932 1.00 30.51 ? 185 ASN A N 1 +ATOM 1448 C CA . ASN A 1 183 ? 5.469 50.424 22.560 1.00 28.68 ? 185 ASN A CA 1 +ATOM 1449 C C . ASN A 1 183 ? 4.263 50.933 21.868 1.00 29.94 ? 185 ASN A C 1 +ATOM 1450 O O . ASN A 1 183 ? 3.142 50.540 22.177 1.00 33.64 ? 185 ASN A O 1 +ATOM 1451 C CB . ASN A 1 183 ? 5.883 49.147 21.844 1.00 30.87 ? 185 ASN A CB 1 +ATOM 1452 C CG . ASN A 1 183 ? 7.146 48.524 22.397 1.00 34.24 ? 185 ASN A CG 1 +ATOM 1453 O OD1 . ASN A 1 183 ? 7.205 48.246 23.586 1.00 38.79 ? 185 ASN A OD1 1 +ATOM 1454 N ND2 . ASN A 1 183 ? 8.186 48.277 21.589 1.00 26.52 ? 185 ASN A ND2 1 +ATOM 1455 N N . THR A 1 184 ? 4.533 51.869 20.973 1.00 30.75 ? 186 THR A N 1 +ATOM 1456 C CA . THR A 1 184 ? 3.518 52.513 20.182 1.00 35.34 ? 186 THR A CA 1 +ATOM 1457 C C . THR A 1 184 ? 4.117 52.716 18.808 1.00 33.04 ? 186 THR A C 1 +ATOM 1458 O O . THR A 1 184 ? 5.271 53.074 18.718 1.00 25.23 ? 186 THR A O 1 +ATOM 1459 C CB . THR A 1 184 ? 3.090 53.908 20.767 1.00 42.07 ? 186 THR A CB 1 +ATOM 1460 O OG1 . THR A 1 184 ? 4.243 54.748 20.744 1.00 49.38 ? 186 THR A OG1 1 +ATOM 1461 C CG2 . THR A 1 184 ? 2.529 53.820 22.190 1.00 46.04 ? 186 THR A CG2 1 +ATOM 1462 N N . PRO A 1 185 ? 3.408 52.534 17.705 1.00 34.05 ? 187 PRO A N 1 +ATOM 1463 C CA . PRO A 1 185 ? 3.876 52.847 16.364 1.00 37.54 ? 187 PRO A CA 1 +ATOM 1464 C C . PRO A 1 185 ? 4.279 54.281 16.026 1.00 38.80 ? 187 PRO A C 1 +ATOM 1465 O O . PRO A 1 185 ? 3.849 55.267 16.613 1.00 42.24 ? 187 PRO A O 1 +ATOM 1466 C CB . PRO A 1 185 ? 2.743 52.340 15.496 1.00 39.76 ? 187 PRO A CB 1 +ATOM 1467 C CG . PRO A 1 185 ? 1.542 52.608 16.352 1.00 35.33 ? 187 PRO A CG 1 +ATOM 1468 C CD . PRO A 1 185 ? 2.045 52.045 17.678 1.00 33.44 ? 187 PRO A CD 1 +ATOM 1469 N N . ILE A 1 186 ? 5.240 54.407 15.142 1.00 38.16 ? 188 ILE A N 1 +ATOM 1470 C CA . ILE A 1 186 ? 5.572 55.667 14.509 1.00 40.34 ? 188 ILE A CA 1 +ATOM 1471 C C . ILE A 1 186 ? 4.566 55.827 13.356 1.00 45.67 ? 188 ILE A C 1 +ATOM 1472 O O . ILE A 1 186 ? 4.238 56.913 12.866 1.00 40.41 ? 188 ILE A O 1 +ATOM 1473 C CB . ILE A 1 186 ? 7.040 55.543 14.028 1.00 38.05 ? 188 ILE A CB 1 +ATOM 1474 C CG1 . ILE A 1 186 ? 7.915 55.847 15.221 1.00 38.20 ? 188 ILE A CG1 1 +ATOM 1475 C CG2 . ILE A 1 186 ? 7.366 56.461 12.830 1.00 39.40 ? 188 ILE A CG2 1 +ATOM 1476 C CD1 . ILE A 1 186 ? 9.385 55.503 14.965 1.00 37.14 ? 188 ILE A CD1 1 +ATOM 1477 N N . GLY A 1 187 ? 4.105 54.627 12.968 1.00 52.75 ? 189 GLY A N 1 +ATOM 1478 C CA . GLY A 1 187 ? 3.255 54.351 11.846 1.00 58.83 ? 189 GLY A CA 1 +ATOM 1479 C C . GLY A 1 187 ? 1.979 55.140 11.777 1.00 64.20 ? 189 GLY A C 1 +ATOM 1480 O O . GLY A 1 187 ? 1.224 55.359 12.729 1.00 61.69 ? 189 GLY A O 1 +ATOM 1481 N N . ASP A 1 188 ? 1.866 55.498 10.495 1.00 69.96 ? 190 ASP A N 1 +ATOM 1482 C CA . ASP A 1 188 ? 0.741 56.188 9.894 1.00 74.63 ? 190 ASP A CA 1 +ATOM 1483 C C . ASP A 1 188 ? -0.520 55.380 10.201 1.00 76.69 ? 190 ASP A C 1 +ATOM 1484 O O . ASP A 1 188 ? -1.547 55.935 10.601 1.00 76.87 ? 190 ASP A O 1 +ATOM 1485 C CB . ASP A 1 188 ? 0.982 56.293 8.377 1.00 75.82 ? 190 ASP A CB 1 +ATOM 1486 C CG . ASP A 1 188 ? 2.160 57.173 7.917 1.00 80.20 ? 190 ASP A CG 1 +ATOM 1487 O OD1 . ASP A 1 188 ? 3.298 56.974 8.359 1.00 79.24 ? 190 ASP A OD1 1 +ATOM 1488 O OD2 . ASP A 1 188 ? 1.938 58.057 7.086 1.00 80.96 ? 190 ASP A OD2 1 +ATOM 1489 N N . GLY A 1 189 ? -0.392 54.046 10.103 1.00 77.21 ? 191 GLY A N 1 +ATOM 1490 C CA . GLY A 1 189 ? -1.485 53.143 10.417 1.00 74.59 ? 191 GLY A CA 1 +ATOM 1491 C C . GLY A 1 189 ? -1.041 51.818 11.041 1.00 70.75 ? 191 GLY A C 1 +ATOM 1492 O O . GLY A 1 189 ? -0.345 51.801 12.063 1.00 69.99 ? 191 GLY A O 1 +ATOM 1493 N N . PRO A 1 190 ? -1.447 50.696 10.406 1.00 68.30 ? 192 PRO A N 1 +ATOM 1494 C CA . PRO A 1 190 ? -2.000 49.503 11.048 1.00 64.76 ? 192 PRO A CA 1 +ATOM 1495 C C . PRO A 1 190 ? -1.046 48.560 11.747 1.00 61.31 ? 192 PRO A C 1 +ATOM 1496 O O . PRO A 1 190 ? -0.007 48.144 11.220 1.00 57.24 ? 192 PRO A O 1 +ATOM 1497 C CB . PRO A 1 190 ? -2.742 48.823 9.949 1.00 63.95 ? 192 PRO A CB 1 +ATOM 1498 C CG . PRO A 1 190 ? -1.821 49.055 8.785 1.00 62.72 ? 192 PRO A CG 1 +ATOM 1499 C CD . PRO A 1 190 ? -1.435 50.516 8.954 1.00 67.41 ? 192 PRO A CD 1 +ATOM 1500 N N . VAL A 1 191 ? -1.460 48.281 12.982 1.00 57.93 ? 193 VAL A N 1 +ATOM 1501 C CA . VAL A 1 191 ? -0.687 47.411 13.832 1.00 57.01 ? 193 VAL A CA 1 +ATOM 1502 C C . VAL A 1 191 ? -1.602 46.375 14.431 1.00 57.08 ? 193 VAL A C 1 +ATOM 1503 O O . VAL A 1 191 ? -2.752 46.639 14.770 1.00 60.80 ? 193 VAL A O 1 +ATOM 1504 C CB . VAL A 1 191 ? 0.022 48.201 14.977 1.00 53.90 ? 193 VAL A CB 1 +ATOM 1505 C CG1 . VAL A 1 191 ? 0.992 49.199 14.379 1.00 52.48 ? 193 VAL A CG1 1 +ATOM 1506 C CG2 . VAL A 1 191 ? -0.973 48.949 15.828 1.00 53.54 ? 193 VAL A CG2 1 +ATOM 1507 N N . LEU A 1 192 ? -1.071 45.169 14.546 1.00 59.06 ? 194 LEU A N 1 +ATOM 1508 C CA . LEU A 1 192 ? -1.787 44.050 15.126 1.00 58.54 ? 194 LEU A CA 1 +ATOM 1509 C C . LEU A 1 192 ? -1.690 44.126 16.637 1.00 58.17 ? 194 LEU A C 1 +ATOM 1510 O O . LEU A 1 192 ? -0.599 44.011 17.194 1.00 57.98 ? 194 LEU A O 1 +ATOM 1511 C CB . LEU A 1 192 ? -1.181 42.732 14.622 1.00 60.41 ? 194 LEU A CB 1 +ATOM 1512 C CG . LEU A 1 192 ? -1.346 42.377 13.133 1.00 62.77 ? 194 LEU A CG 1 +ATOM 1513 C CD1 . LEU A 1 192 ? -0.492 41.154 12.806 1.00 61.75 ? 194 LEU A CD1 1 +ATOM 1514 C CD2 . LEU A 1 192 ? -2.817 42.117 12.819 1.00 61.44 ? 194 LEU A CD2 1 +ATOM 1515 N N . LEU A 1 193 ? -2.823 44.363 17.318 1.00 56.55 ? 195 LEU A N 1 +ATOM 1516 C CA . LEU A 1 193 ? -2.823 44.391 18.772 1.00 53.38 ? 195 LEU A CA 1 +ATOM 1517 C C . LEU A 1 193 ? -2.876 42.959 19.229 1.00 49.68 ? 195 LEU A C 1 +ATOM 1518 O O . LEU A 1 193 ? -3.558 42.164 18.589 1.00 51.19 ? 195 LEU A O 1 +ATOM 1519 C CB . LEU A 1 193 ? -4.035 45.146 19.321 1.00 57.00 ? 195 LEU A CB 1 +ATOM 1520 C CG . LEU A 1 193 ? -4.083 46.667 19.104 1.00 59.92 ? 195 LEU A CG 1 +ATOM 1521 C CD1 . LEU A 1 193 ? -5.473 47.168 19.466 1.00 63.08 ? 195 LEU A CD1 1 +ATOM 1522 C CD2 . LEU A 1 193 ? -3.042 47.370 19.962 1.00 56.84 ? 195 LEU A CD2 1 +ATOM 1523 N N . PRO A 1 194 ? -2.097 42.565 20.239 1.00 48.43 ? 196 PRO A N 1 +ATOM 1524 C CA . PRO A 1 194 ? -2.158 41.242 20.857 1.00 47.31 ? 196 PRO A CA 1 +ATOM 1525 C C . PRO A 1 194 ? -3.061 40.930 22.032 1.00 45.69 ? 196 PRO A C 1 +ATOM 1526 O O . PRO A 1 194 ? -3.426 41.766 22.860 1.00 45.29 ? 196 PRO A O 1 +ATOM 1527 C CB . PRO A 1 194 ? -0.711 40.935 21.207 1.00 46.64 ? 196 PRO A CB 1 +ATOM 1528 C CG . PRO A 1 194 ? -0.192 42.287 21.612 1.00 43.60 ? 196 PRO A CG 1 +ATOM 1529 C CD . PRO A 1 194 ? -0.765 43.133 20.483 1.00 45.09 ? 196 PRO A CD 1 +ATOM 1530 N N . ASP A 1 195 ? -3.338 39.627 22.092 1.00 44.45 ? 197 ASP A N 1 +ATOM 1531 C CA . ASP A 1 195 ? -3.963 39.065 23.278 1.00 47.09 ? 197 ASP A CA 1 +ATOM 1532 C C . ASP A 1 195 ? -2.785 38.591 24.114 1.00 45.97 ? 197 ASP A C 1 +ATOM 1533 O O . ASP A 1 195 ? -1.764 38.144 23.582 1.00 51.17 ? 197 ASP A O 1 +ATOM 1534 C CB . ASP A 1 195 ? -4.870 37.857 22.965 1.00 47.40 ? 197 ASP A CB 1 +ATOM 1535 C CG . ASP A 1 195 ? -5.863 38.078 21.818 1.00 46.26 ? 197 ASP A CG 1 +ATOM 1536 O OD1 . ASP A 1 195 ? -6.473 39.155 21.712 1.00 42.04 ? 197 ASP A OD1 1 +ATOM 1537 O OD2 . ASP A 1 195 ? -6.008 37.162 21.011 1.00 39.12 ? 197 ASP A OD2 1 +ATOM 1538 N N . ASN A 1 196 ? -2.934 38.694 25.433 1.00 43.81 ? 198 ASN A N 1 +ATOM 1539 C CA . ASN A 1 196 ? -1.927 38.307 26.407 1.00 42.33 ? 198 ASN A CA 1 +ATOM 1540 C C . ASN A 1 196 ? -1.101 37.025 26.207 1.00 46.01 ? 198 ASN A C 1 +ATOM 1541 O O . ASN A 1 196 ? -1.528 35.873 26.343 1.00 44.01 ? 198 ASN A O 1 +ATOM 1542 C CB . ASN A 1 196 ? -2.605 38.260 27.769 1.00 34.41 ? 198 ASN A CB 1 +ATOM 1543 C CG . ASN A 1 196 ? -3.080 39.625 28.219 1.00 34.38 ? 198 ASN A CG 1 +ATOM 1544 O OD1 . ASN A 1 196 ? -3.248 40.570 27.423 1.00 25.80 ? 198 ASN A OD1 1 +ATOM 1545 N ND2 . ASN A 1 196 ? -3.270 39.703 29.546 1.00 30.05 ? 198 ASN A ND2 1 +ATOM 1546 N N . HIS A 1 197 ? 0.140 37.338 25.815 1.00 48.17 ? 199 HIS A N 1 +ATOM 1547 C CA . HIS A 1 197 ? 1.212 36.383 25.636 1.00 46.75 ? 199 HIS A CA 1 +ATOM 1548 C C . HIS A 1 197 ? 2.493 36.959 26.221 1.00 49.21 ? 199 HIS A C 1 +ATOM 1549 O O . HIS A 1 197 ? 2.534 38.073 26.756 1.00 51.64 ? 199 HIS A O 1 +ATOM 1550 C CB . HIS A 1 197 ? 1.452 36.096 24.166 1.00 43.90 ? 199 HIS A CB 1 +ATOM 1551 C CG . HIS A 1 197 ? 1.960 37.255 23.351 1.00 38.50 ? 199 HIS A CG 1 +ATOM 1552 N ND1 . HIS A 1 197 ? 1.335 38.387 23.088 1.00 42.07 ? 199 HIS A ND1 1 +ATOM 1553 C CD2 . HIS A 1 197 ? 3.182 37.282 22.738 1.00 43.79 ? 199 HIS A CD2 1 +ATOM 1554 C CE1 . HIS A 1 197 ? 2.148 39.094 22.324 1.00 44.93 ? 199 HIS A CE1 1 +ATOM 1555 N NE2 . HIS A 1 197 ? 3.258 38.432 22.116 1.00 43.79 ? 199 HIS A NE2 1 +ATOM 1556 N N . TYR A 1 198 ? 3.560 36.168 26.069 1.00 48.32 ? 200 TYR A N 1 +ATOM 1557 C CA . TYR A 1 198 ? 4.887 36.583 26.461 1.00 44.22 ? 200 TYR A CA 1 +ATOM 1558 C C . TYR A 1 198 ? 5.971 36.209 25.469 1.00 42.06 ? 200 TYR A C 1 +ATOM 1559 O O . TYR A 1 198 ? 5.850 35.290 24.654 1.00 33.30 ? 200 TYR A O 1 +ATOM 1560 C CB . TYR A 1 198 ? 5.274 35.997 27.823 1.00 45.87 ? 200 TYR A CB 1 +ATOM 1561 C CG . TYR A 1 198 ? 5.414 34.491 27.966 1.00 47.71 ? 200 TYR A CG 1 +ATOM 1562 C CD1 . TYR A 1 198 ? 6.611 33.867 27.626 1.00 49.24 ? 200 TYR A CD1 1 +ATOM 1563 C CD2 . TYR A 1 198 ? 4.377 33.745 28.518 1.00 48.12 ? 200 TYR A CD2 1 +ATOM 1564 C CE1 . TYR A 1 198 ? 6.787 32.501 27.847 1.00 48.26 ? 200 TYR A CE1 1 +ATOM 1565 C CE2 . TYR A 1 198 ? 4.549 32.378 28.744 1.00 49.88 ? 200 TYR A CE2 1 +ATOM 1566 C CZ . TYR A 1 198 ? 5.759 31.762 28.411 1.00 48.10 ? 200 TYR A CZ 1 +ATOM 1567 O OH . TYR A 1 198 ? 5.980 30.433 28.696 1.00 40.27 ? 200 TYR A OH 1 +ATOM 1568 N N . LEU A 1 199 ? 7.034 37.013 25.538 1.00 40.71 ? 201 LEU A N 1 +ATOM 1569 C CA . LEU A 1 199 ? 8.245 36.668 24.834 1.00 37.00 ? 201 LEU A CA 1 +ATOM 1570 C C . LEU A 1 199 ? 9.130 35.912 25.828 1.00 33.91 ? 201 LEU A C 1 +ATOM 1571 O O . LEU A 1 199 ? 9.446 36.393 26.919 1.00 36.76 ? 201 LEU A O 1 +ATOM 1572 C CB . LEU A 1 199 ? 8.925 37.928 24.372 1.00 32.71 ? 201 LEU A CB 1 +ATOM 1573 C CG . LEU A 1 199 ? 8.211 38.784 23.392 1.00 29.98 ? 201 LEU A CG 1 +ATOM 1574 C CD1 . LEU A 1 199 ? 9.125 39.934 23.133 1.00 29.22 ? 201 LEU A CD1 1 +ATOM 1575 C CD2 . LEU A 1 199 ? 7.909 38.069 22.083 1.00 36.34 ? 201 LEU A CD2 1 +ATOM 1576 N N . SER A 1 200 ? 9.495 34.679 25.518 1.00 34.38 ? 202 SER A N 1 +ATOM 1577 C CA . SER A 1 200 ? 10.446 33.912 26.321 1.00 35.39 ? 202 SER A CA 1 +ATOM 1578 C C . SER A 1 200 ? 11.753 34.339 25.714 1.00 34.62 ? 202 SER A C 1 +ATOM 1579 O O . SER A 1 200 ? 12.057 34.036 24.563 1.00 38.44 ? 202 SER A O 1 +ATOM 1580 C CB . SER A 1 200 ? 10.294 32.401 26.141 1.00 37.87 ? 202 SER A CB 1 +ATOM 1581 O OG . SER A 1 200 ? 11.403 31.662 26.622 1.00 36.02 ? 202 SER A OG 1 +ATOM 1582 N N . THR A 1 201 ? 12.496 35.106 26.498 1.00 34.63 ? 203 THR A N 1 +ATOM 1583 C CA . THR A 1 201 ? 13.764 35.636 26.046 1.00 32.52 ? 203 THR A CA 1 +ATOM 1584 C C . THR A 1 201 ? 14.897 35.059 26.859 1.00 27.54 ? 203 THR A C 1 +ATOM 1585 O O . THR A 1 201 ? 14.835 34.972 28.084 1.00 23.77 ? 203 THR A O 1 +ATOM 1586 C CB . THR A 1 201 ? 13.699 37.133 26.209 1.00 36.31 ? 203 THR A CB 1 +ATOM 1587 O OG1 . THR A 1 201 ? 13.534 37.311 27.607 1.00 44.01 ? 203 THR A OG1 1 +ATOM 1588 C CG2 . THR A 1 201 ? 12.490 37.822 25.602 1.00 38.32 ? 203 THR A CG2 1 +ATOM 1589 N N . GLN A 1 202 ? 15.953 34.676 26.142 1.00 27.16 ? 204 GLN A N 1 +ATOM 1590 C CA . GLN A 1 202 ? 17.170 34.152 26.757 1.00 24.52 ? 204 GLN A CA 1 +ATOM 1591 C C . GLN A 1 202 ? 18.402 34.825 26.195 1.00 24.02 ? 204 GLN A C 1 +ATOM 1592 O O . GLN A 1 202 ? 18.499 35.055 24.976 1.00 17.41 ? 204 GLN A O 1 +ATOM 1593 C CB . GLN A 1 202 ? 17.342 32.696 26.487 1.00 30.13 ? 204 GLN A CB 1 +ATOM 1594 C CG . GLN A 1 202 ? 16.343 31.816 27.146 1.00 26.96 ? 204 GLN A CG 1 +ATOM 1595 C CD . GLN A 1 202 ? 16.353 30.549 26.384 1.00 22.56 ? 204 GLN A CD 1 +ATOM 1596 O OE1 . GLN A 1 202 ? 16.840 29.543 26.861 1.00 17.44 ? 204 GLN A OE1 1 +ATOM 1597 N NE2 . GLN A 1 202 ? 15.767 30.615 25.193 1.00 33.19 ? 204 GLN A NE2 1 +ATOM 1598 N N . SER A 1 203 ? 19.381 35.079 27.075 1.00 20.13 ? 205 SER A N 1 +ATOM 1599 C CA . SER A 1 203 ? 20.561 35.799 26.595 1.00 22.16 ? 205 SER A CA 1 +ATOM 1600 C C . SER A 1 203 ? 21.872 35.278 27.158 1.00 20.70 ? 205 SER A C 1 +ATOM 1601 O O . SER A 1 203 ? 22.037 34.813 28.302 1.00 14.97 ? 205 SER A O 1 +ATOM 1602 C CB . SER A 1 203 ? 20.485 37.299 26.932 1.00 25.71 ? 205 SER A CB 1 +ATOM 1603 O OG . SER A 1 203 ? 19.279 37.952 26.512 1.00 25.02 ? 205 SER A OG 1 +ATOM 1604 N N . ALA A 1 204 ? 22.845 35.469 26.291 1.00 16.31 ? 206 ALA A N 1 +ATOM 1605 C CA . ALA A 1 204 ? 24.187 35.068 26.625 1.00 19.44 ? 206 ALA A CA 1 +ATOM 1606 C C . ALA A 1 204 ? 25.164 36.164 26.231 1.00 20.06 ? 206 ALA A C 1 +ATOM 1607 O O . ALA A 1 204 ? 25.332 36.504 25.064 1.00 25.38 ? 206 ALA A O 1 +ATOM 1608 C CB . ALA A 1 204 ? 24.501 33.791 25.889 1.00 12.43 ? 206 ALA A CB 1 +ATOM 1609 N N . LEU A 1 205 ? 25.815 36.718 27.240 1.00 21.37 ? 207 LEU A N 1 +ATOM 1610 C CA . LEU A 1 205 ? 26.749 37.844 27.062 1.00 28.57 ? 207 LEU A CA 1 +ATOM 1611 C C . LEU A 1 205 ? 28.197 37.369 26.930 1.00 28.71 ? 207 LEU A C 1 +ATOM 1612 O O . LEU A 1 205 ? 28.696 36.583 27.751 1.00 23.47 ? 207 LEU A O 1 +ATOM 1613 C CB . LEU A 1 205 ? 26.729 38.816 28.261 1.00 25.18 ? 207 LEU A CB 1 +ATOM 1614 C CG . LEU A 1 205 ? 25.408 39.240 28.854 1.00 25.04 ? 207 LEU A CG 1 +ATOM 1615 C CD1 . LEU A 1 205 ? 25.706 40.422 29.743 1.00 28.28 ? 207 LEU A CD1 1 +ATOM 1616 C CD2 . LEU A 1 205 ? 24.413 39.702 27.810 1.00 16.91 ? 207 LEU A CD2 1 +ATOM 1617 N N . SER A 1 206 ? 28.884 37.821 25.883 1.00 25.02 ? 208 SER A N 1 +ATOM 1618 C CA . SER A 1 206 ? 30.279 37.474 25.790 1.00 26.92 ? 208 SER A CA 1 +ATOM 1619 C C . SER A 1 206 ? 31.121 38.674 25.402 1.00 26.33 ? 208 SER A C 1 +ATOM 1620 O O . SER A 1 206 ? 30.655 39.806 25.378 1.00 30.75 ? 208 SER A O 1 +ATOM 1621 C CB . SER A 1 206 ? 30.450 36.334 24.801 1.00 22.92 ? 208 SER A CB 1 +ATOM 1622 O OG . SER A 1 206 ? 30.327 36.755 23.465 1.00 37.27 ? 208 SER A OG 1 +ATOM 1623 N N . LYS A 1 207 ? 32.397 38.410 25.165 1.00 28.29 ? 209 LYS A N 1 +ATOM 1624 C CA . LYS A 1 207 ? 33.445 39.382 24.866 1.00 24.15 ? 209 LYS A CA 1 +ATOM 1625 C C . LYS A 1 207 ? 34.197 38.918 23.645 1.00 27.50 ? 209 LYS A C 1 +ATOM 1626 O O . LYS A 1 207 ? 34.439 37.713 23.502 1.00 36.45 ? 209 LYS A O 1 +ATOM 1627 C CB . LYS A 1 207 ? 34.416 39.450 25.984 1.00 18.05 ? 209 LYS A CB 1 +ATOM 1628 C CG . LYS A 1 207 ? 33.935 39.940 27.323 1.00 10.53 ? 209 LYS A CG 1 +ATOM 1629 C CD . LYS A 1 207 ? 33.652 41.449 27.238 1.00 14.73 ? 209 LYS A CD 1 +ATOM 1630 C CE . LYS A 1 207 ? 33.183 41.842 28.634 1.00 19.05 ? 209 LYS A CE 1 +ATOM 1631 N NZ . LYS A 1 207 ? 32.624 43.179 28.654 1.00 29.76 ? 209 LYS A NZ 1 +ATOM 1632 N N . ASP A 1 208 ? 34.512 39.815 22.721 1.00 29.03 ? 210 ASP A N 1 +ATOM 1633 C CA . ASP A 1 208 ? 35.369 39.477 21.605 1.00 36.01 ? 210 ASP A CA 1 +ATOM 1634 C C . ASP A 1 208 ? 36.751 39.595 22.230 1.00 39.41 ? 210 ASP A C 1 +ATOM 1635 O O . ASP A 1 208 ? 37.090 40.714 22.626 1.00 38.31 ? 210 ASP A O 1 +ATOM 1636 C CB . ASP A 1 208 ? 35.174 40.485 20.505 1.00 42.74 ? 210 ASP A CB 1 +ATOM 1637 C CG . ASP A 1 208 ? 35.977 40.277 19.230 1.00 52.48 ? 210 ASP A CG 1 +ATOM 1638 O OD1 . ASP A 1 208 ? 36.929 39.476 19.205 1.00 55.66 ? 210 ASP A OD1 1 +ATOM 1639 O OD2 . ASP A 1 208 ? 35.630 40.944 18.248 1.00 56.36 ? 210 ASP A OD2 1 +ATOM 1640 N N . PRO A 1 209 ? 37.551 38.506 22.436 1.00 44.98 ? 211 PRO A N 1 +ATOM 1641 C CA . PRO A 1 209 ? 38.858 38.525 23.131 1.00 42.77 ? 211 PRO A CA 1 +ATOM 1642 C C . PRO A 1 209 ? 39.907 39.354 22.410 1.00 42.00 ? 211 PRO A C 1 +ATOM 1643 O O . PRO A 1 209 ? 40.821 39.860 23.055 1.00 44.42 ? 211 PRO A O 1 +ATOM 1644 C CB . PRO A 1 209 ? 39.237 37.064 23.272 1.00 45.05 ? 211 PRO A CB 1 +ATOM 1645 C CG . PRO A 1 209 ? 38.543 36.392 22.096 1.00 45.24 ? 211 PRO A CG 1 +ATOM 1646 C CD . PRO A 1 209 ? 37.213 37.126 22.073 1.00 45.78 ? 211 PRO A CD 1 +ATOM 1647 N N . ASN A 1 210 ? 39.727 39.525 21.087 1.00 40.61 ? 212 ASN A N 1 +ATOM 1648 C CA . ASN A 1 210 ? 40.515 40.412 20.250 1.00 45.08 ? 212 ASN A CA 1 +ATOM 1649 C C . ASN A 1 210 ? 40.060 41.883 20.232 1.00 49.20 ? 212 ASN A C 1 +ATOM 1650 O O . ASN A 1 210 ? 40.524 42.690 19.407 1.00 52.81 ? 212 ASN A O 1 +ATOM 1651 C CB . ASN A 1 210 ? 40.501 39.880 18.852 1.00 44.90 ? 212 ASN A CB 1 +ATOM 1652 C CG . ASN A 1 210 ? 41.372 38.664 18.634 1.00 51.40 ? 212 ASN A CG 1 +ATOM 1653 O OD1 . ASN A 1 210 ? 41.247 38.036 17.574 1.00 55.85 ? 212 ASN A OD1 1 +ATOM 1654 N ND2 . ASN A 1 210 ? 42.260 38.312 19.584 1.00 46.94 ? 212 ASN A ND2 1 +ATOM 1655 N N . GLU A 1 211 ? 39.167 42.263 21.163 1.00 46.52 ? 213 GLU A N 1 +ATOM 1656 C CA . GLU A 1 211 ? 38.605 43.594 21.222 1.00 42.20 ? 213 GLU A CA 1 +ATOM 1657 C C . GLU A 1 211 ? 38.968 44.321 22.506 1.00 43.78 ? 213 GLU A C 1 +ATOM 1658 O O . GLU A 1 211 ? 38.563 44.011 23.640 1.00 36.68 ? 213 GLU A O 1 +ATOM 1659 C CB . GLU A 1 211 ? 37.086 43.518 21.090 1.00 44.30 ? 213 GLU A CB 1 +ATOM 1660 C CG . GLU A 1 211 ? 36.308 44.824 21.225 1.00 41.01 ? 213 GLU A CG 1 +ATOM 1661 C CD . GLU A 1 211 ? 36.621 45.776 20.094 1.00 44.95 ? 213 GLU A CD 1 +ATOM 1662 O OE1 . GLU A 1 211 ? 37.600 46.509 20.182 1.00 44.55 ? 213 GLU A OE1 1 +ATOM 1663 O OE2 . GLU A 1 211 ? 35.894 45.767 19.113 1.00 50.56 ? 213 GLU A OE2 1 +ATOM 1664 N N . LYS A 1 212 ? 39.720 45.389 22.235 1.00 44.71 ? 214 LYS A N 1 +ATOM 1665 C CA . LYS A 1 212 ? 40.188 46.194 23.326 1.00 43.87 ? 214 LYS A CA 1 +ATOM 1666 C C . LYS A 1 212 ? 39.153 47.162 23.864 1.00 40.14 ? 214 LYS A C 1 +ATOM 1667 O O . LYS A 1 212 ? 39.247 47.482 25.054 1.00 36.74 ? 214 LYS A O 1 +ATOM 1668 C CB . LYS A 1 212 ? 41.458 46.951 22.889 1.00 51.98 ? 214 LYS A CB 1 +ATOM 1669 C CG . LYS A 1 212 ? 42.729 46.088 22.794 1.00 56.01 ? 214 LYS A CG 1 +ATOM 1670 C CD . LYS A 1 212 ? 42.965 45.566 21.374 1.00 62.29 ? 214 LYS A CD 1 +ATOM 1671 C CE . LYS A 1 212 ? 44.111 46.300 20.668 1.00 61.48 ? 214 LYS A CE 1 +ATOM 1672 N NZ . LYS A 1 212 ? 45.396 45.778 21.099 1.00 64.11 ? 214 LYS A NZ 1 +ATOM 1673 N N . ARG A 1 213 ? 38.162 47.632 23.072 1.00 36.58 ? 215 ARG A N 1 +ATOM 1674 C CA . ARG A 1 213 ? 37.234 48.638 23.619 1.00 35.79 ? 215 ARG A CA 1 +ATOM 1675 C C . ARG A 1 213 ? 36.260 48.013 24.601 1.00 38.91 ? 215 ARG A C 1 +ATOM 1676 O O . ARG A 1 213 ? 36.088 46.781 24.585 1.00 35.88 ? 215 ARG A O 1 +ATOM 1677 C CB . ARG A 1 213 ? 36.391 49.316 22.543 1.00 30.17 ? 215 ARG A CB 1 +ATOM 1678 C CG . ARG A 1 213 ? 37.142 50.148 21.544 1.00 26.02 ? 215 ARG A CG 1 +ATOM 1679 C CD . ARG A 1 213 ? 37.044 49.435 20.243 1.00 24.58 ? 215 ARG A CD 1 +ATOM 1680 N NE . ARG A 1 213 ? 36.147 50.072 19.326 1.00 30.29 ? 215 ARG A NE 1 +ATOM 1681 C CZ . ARG A 1 213 ? 35.530 49.454 18.321 1.00 31.74 ? 215 ARG A CZ 1 +ATOM 1682 N NH1 . ARG A 1 213 ? 35.655 48.169 18.042 1.00 34.71 ? 215 ARG A NH1 1 +ATOM 1683 N NH2 . ARG A 1 213 ? 34.732 50.165 17.546 1.00 40.87 ? 215 ARG A NH2 1 +ATOM 1684 N N . ASP A 1 214 ? 35.645 48.836 25.472 1.00 36.45 ? 216 ASP A N 1 +ATOM 1685 C CA . ASP A 1 214 ? 34.626 48.260 26.338 1.00 37.67 ? 216 ASP A CA 1 +ATOM 1686 C C . ASP A 1 214 ? 33.424 47.974 25.444 1.00 36.24 ? 216 ASP A C 1 +ATOM 1687 O O . ASP A 1 214 ? 32.875 48.870 24.780 1.00 33.86 ? 216 ASP A O 1 +ATOM 1688 C CB . ASP A 1 214 ? 34.219 49.231 27.439 1.00 38.13 ? 216 ASP A CB 1 +ATOM 1689 C CG . ASP A 1 214 ? 33.446 48.581 28.585 1.00 43.88 ? 216 ASP A CG 1 +ATOM 1690 O OD1 . ASP A 1 214 ? 33.610 47.378 28.885 1.00 43.54 ? 216 ASP A OD1 1 +ATOM 1691 O OD2 . ASP A 1 214 ? 32.680 49.324 29.197 1.00 45.89 ? 216 ASP A OD2 1 +ATOM 1692 N N . HIS A 1 215 ? 33.085 46.675 25.451 1.00 33.40 ? 217 HIS A N 1 +ATOM 1693 C CA . HIS A 1 215 ? 32.021 46.150 24.624 1.00 27.41 ? 217 HIS A CA 1 +ATOM 1694 C C . HIS A 1 215 ? 31.230 45.043 25.279 1.00 25.70 ? 217 HIS A C 1 +ATOM 1695 O O . HIS A 1 215 ? 31.520 44.640 26.413 1.00 22.67 ? 217 HIS A O 1 +ATOM 1696 C CB . HIS A 1 215 ? 32.617 45.659 23.327 1.00 29.54 ? 217 HIS A CB 1 +ATOM 1697 C CG . HIS A 1 215 ? 33.517 44.459 23.528 1.00 34.06 ? 217 HIS A CG 1 +ATOM 1698 N ND1 . HIS A 1 215 ? 34.618 44.430 24.266 1.00 31.23 ? 217 HIS A ND1 1 +ATOM 1699 C CD2 . HIS A 1 215 ? 33.267 43.217 23.013 1.00 34.01 ? 217 HIS A CD2 1 +ATOM 1700 C CE1 . HIS A 1 215 ? 35.040 43.206 24.227 1.00 35.68 ? 217 HIS A CE1 1 +ATOM 1701 N NE2 . HIS A 1 215 ? 34.233 42.483 23.480 1.00 41.37 ? 217 HIS A NE2 1 +ATOM 1702 N N . MET A 1 216 ? 30.172 44.649 24.548 1.00 24.47 ? 218 MET A N 1 +ATOM 1703 C CA . MET A 1 216 ? 29.338 43.492 24.886 1.00 21.32 ? 218 MET A CA 1 +ATOM 1704 C C . MET A 1 216 ? 28.883 42.832 23.596 1.00 18.68 ? 218 MET A C 1 +ATOM 1705 O O . MET A 1 216 ? 28.504 43.467 22.602 1.00 14.40 ? 218 MET A O 1 +ATOM 1706 C CB . MET A 1 216 ? 28.091 43.854 25.677 1.00 22.68 ? 218 MET A CB 1 +ATOM 1707 C CG . MET A 1 216 ? 27.017 42.755 25.869 1.00 26.18 ? 218 MET A CG 1 +ATOM 1708 S SD . MET A 1 216 ? 25.695 43.258 26.987 1.00 27.81 ? 218 MET A SD 1 +ATOM 1709 C CE . MET A 1 216 ? 24.950 44.351 25.842 1.00 15.34 ? 218 MET A CE 1 +ATOM 1710 N N . VAL A 1 217 ? 29.036 41.502 23.603 1.00 20.00 ? 219 VAL A N 1 +ATOM 1711 C CA . VAL A 1 217 ? 28.507 40.731 22.506 1.00 19.69 ? 219 VAL A CA 1 +ATOM 1712 C C . VAL A 1 217 ? 27.296 40.029 23.102 1.00 19.11 ? 219 VAL A C 1 +ATOM 1713 O O . VAL A 1 217 ? 27.366 39.267 24.056 1.00 19.75 ? 219 VAL A O 1 +ATOM 1714 C CB . VAL A 1 217 ? 29.570 39.766 21.995 1.00 19.37 ? 219 VAL A CB 1 +ATOM 1715 C CG1 . VAL A 1 217 ? 29.004 38.927 20.888 1.00 18.97 ? 219 VAL A CG1 1 +ATOM 1716 C CG2 . VAL A 1 217 ? 30.711 40.535 21.346 1.00 26.17 ? 219 VAL A CG2 1 +ATOM 1717 N N . LEU A 1 218 ? 26.148 40.411 22.567 1.00 20.84 ? 220 LEU A N 1 +ATOM 1718 C CA . LEU A 1 218 ? 24.868 39.836 22.940 1.00 25.67 ? 220 LEU A CA 1 +ATOM 1719 C C . LEU A 1 218 ? 24.281 38.851 21.949 1.00 23.69 ? 220 LEU A C 1 +ATOM 1720 O O . LEU A 1 218 ? 24.031 39.140 20.782 1.00 18.26 ? 220 LEU A O 1 +ATOM 1721 C CB . LEU A 1 218 ? 23.853 40.933 23.144 1.00 28.43 ? 220 LEU A CB 1 +ATOM 1722 C CG . LEU A 1 218 ? 22.480 40.508 23.537 1.00 22.14 ? 220 LEU A CG 1 +ATOM 1723 C CD1 . LEU A 1 218 ? 22.511 39.798 24.891 1.00 20.34 ? 220 LEU A CD1 1 +ATOM 1724 C CD2 . LEU A 1 218 ? 21.615 41.756 23.505 1.00 23.41 ? 220 LEU A CD2 1 +ATOM 1725 N N . LEU A 1 219 ? 24.068 37.660 22.503 1.00 27.47 ? 221 LEU A N 1 +ATOM 1726 C CA . LEU A 1 219 ? 23.450 36.549 21.807 1.00 27.23 ? 221 LEU A CA 1 +ATOM 1727 C C . LEU A 1 219 ? 22.177 36.365 22.582 1.00 25.98 ? 221 LEU A C 1 +ATOM 1728 O O . LEU A 1 219 ? 22.188 36.153 23.785 1.00 23.48 ? 221 LEU A O 1 +ATOM 1729 C CB . LEU A 1 219 ? 24.254 35.269 21.916 1.00 31.24 ? 221 LEU A CB 1 +ATOM 1730 C CG . LEU A 1 219 ? 24.928 34.731 20.677 1.00 36.35 ? 221 LEU A CG 1 +ATOM 1731 C CD1 . LEU A 1 219 ? 23.831 34.395 19.668 1.00 36.00 ? 221 LEU A CD1 1 +ATOM 1732 C CD2 . LEU A 1 219 ? 26.003 35.721 20.173 1.00 39.37 ? 221 LEU A CD2 1 +ATOM 1733 N N . GLU A 1 220 ? 21.085 36.464 21.841 1.00 30.52 ? 222 GLU A N 1 +ATOM 1734 C CA . GLU A 1 220 ? 19.751 36.415 22.409 1.00 31.83 ? 222 GLU A CA 1 +ATOM 1735 C C . GLU A 1 220 ? 18.803 35.658 21.487 1.00 29.13 ? 222 GLU A C 1 +ATOM 1736 O O . GLU A 1 220 ? 18.836 35.733 20.257 1.00 25.75 ? 222 GLU A O 1 +ATOM 1737 C CB . GLU A 1 220 ? 19.305 37.841 22.595 1.00 32.94 ? 222 GLU A CB 1 +ATOM 1738 C CG . GLU A 1 220 ? 18.148 38.009 23.514 1.00 41.64 ? 222 GLU A CG 1 +ATOM 1739 C CD . GLU A 1 220 ? 18.037 39.467 23.934 1.00 46.81 ? 222 GLU A CD 1 +ATOM 1740 O OE1 . GLU A 1 220 ? 18.792 39.867 24.817 1.00 43.56 ? 222 GLU A OE1 1 +ATOM 1741 O OE2 . GLU A 1 220 ? 17.215 40.205 23.378 1.00 47.47 ? 222 GLU A OE2 1 +ATOM 1742 N N . PHE A 1 221 ? 17.980 34.885 22.176 1.00 31.28 ? 223 PHE A N 1 +ATOM 1743 C CA . PHE A 1 221 ? 16.892 34.083 21.628 1.00 31.11 ? 223 PHE A CA 1 +ATOM 1744 C C . PHE A 1 221 ? 15.572 34.535 22.248 1.00 31.22 ? 223 PHE A C 1 +ATOM 1745 O O . PHE A 1 221 ? 15.439 34.657 23.464 1.00 27.25 ? 223 PHE A O 1 +ATOM 1746 C CB . PHE A 1 221 ? 17.161 32.624 21.942 1.00 31.75 ? 223 PHE A CB 1 +ATOM 1747 C CG . PHE A 1 221 ? 18.290 32.137 21.050 1.00 37.61 ? 223 PHE A CG 1 +ATOM 1748 C CD1 . PHE A 1 221 ? 17.981 31.660 19.772 1.00 40.90 ? 223 PHE A CD1 1 +ATOM 1749 C CD2 . PHE A 1 221 ? 19.623 32.215 21.469 1.00 35.57 ? 223 PHE A CD2 1 +ATOM 1750 C CE1 . PHE A 1 221 ? 19.000 31.264 18.912 1.00 37.00 ? 223 PHE A CE1 1 +ATOM 1751 C CE2 . PHE A 1 221 ? 20.638 31.820 20.609 1.00 30.57 ? 223 PHE A CE2 1 +ATOM 1752 C CZ . PHE A 1 221 ? 20.323 31.348 19.336 1.00 36.08 ? 223 PHE A CZ 1 +ATOM 1753 N N . VAL A 1 222 ? 14.616 34.862 21.372 1.00 30.64 ? 224 VAL A N 1 +ATOM 1754 C CA . VAL A 1 222 ? 13.304 35.359 21.781 1.00 29.42 ? 224 VAL A CA 1 +ATOM 1755 C C . VAL A 1 222 ? 12.193 34.581 21.059 1.00 25.63 ? 224 VAL A C 1 +ATOM 1756 O O . VAL A 1 222 ? 12.117 34.482 19.824 1.00 18.94 ? 224 VAL A O 1 +ATOM 1757 C CB . VAL A 1 222 ? 13.138 36.868 21.443 1.00 31.14 ? 224 VAL A CB 1 +ATOM 1758 C CG1 . VAL A 1 222 ? 12.035 37.393 22.312 1.00 33.38 ? 224 VAL A CG1 1 +ATOM 1759 C CG2 . VAL A 1 222 ? 14.398 37.701 21.707 1.00 31.64 ? 224 VAL A CG2 1 +ATOM 1760 N N . THR A 1 223 ? 11.335 33.991 21.883 1.00 20.42 ? 225 THR A N 1 +ATOM 1761 C CA . THR A 1 223 ? 10.196 33.272 21.357 1.00 28.05 ? 225 THR A CA 1 +ATOM 1762 C C . THR A 1 223 ? 8.899 33.631 22.065 1.00 25.80 ? 225 THR A C 1 +ATOM 1763 O O . THR A 1 223 ? 8.762 33.579 23.286 1.00 19.69 ? 225 THR A O 1 +ATOM 1764 C CB . THR A 1 223 ? 10.517 31.762 21.457 1.00 30.63 ? 225 THR A CB 1 +ATOM 1765 O OG1 . THR A 1 223 ? 11.479 31.561 20.430 1.00 35.05 ? 225 THR A OG1 1 +ATOM 1766 C CG2 . THR A 1 223 ? 9.341 30.816 21.254 1.00 28.85 ? 225 THR A CG2 1 +ATOM 1767 N N . ALA A 1 224 ? 7.943 34.021 21.233 1.00 29.76 ? 226 ALA A N 1 +ATOM 1768 C CA . ALA A 1 224 ? 6.582 34.287 21.700 1.00 34.49 ? 226 ALA A CA 1 +ATOM 1769 C C . ALA A 1 224 ? 5.886 33.002 22.130 1.00 37.92 ? 226 ALA A C 1 +ATOM 1770 O O . ALA A 1 224 ? 5.981 31.952 21.489 1.00 39.28 ? 226 ALA A O 1 +ATOM 1771 C CB . ALA A 1 224 ? 5.773 34.918 20.605 1.00 27.87 ? 226 ALA A CB 1 +ATOM 1772 N N . ALA A 1 225 ? 5.196 33.074 23.265 1.00 42.56 ? 227 ALA A N 1 +ATOM 1773 C CA . ALA A 1 225 ? 4.542 31.916 23.839 1.00 47.34 ? 227 ALA A CA 1 +ATOM 1774 C C . ALA A 1 225 ? 3.474 32.344 24.843 1.00 50.71 ? 227 ALA A C 1 +ATOM 1775 O O . ALA A 1 225 ? 3.328 33.527 25.161 1.00 49.73 ? 227 ALA A O 1 +ATOM 1776 C CB . ALA A 1 225 ? 5.586 31.040 24.551 1.00 46.71 ? 227 ALA A CB 1 +ATOM 1777 N N . GLY A 1 226 ? 2.739 31.365 25.388 1.00 51.65 ? 228 GLY A N 1 +ATOM 1778 C CA . GLY A 1 226 ? 1.640 31.645 26.293 1.00 52.83 ? 228 GLY A CA 1 +ATOM 1779 C C . GLY A 1 226 ? 0.302 31.683 25.559 1.00 52.61 ? 228 GLY A C 1 +ATOM 1780 O O . GLY A 1 226 ? -0.716 31.981 26.196 1.00 56.22 ? 228 GLY A O 1 +ATOM 1781 N N . ILE A 1 227 ? 0.265 31.448 24.235 1.00 49.57 ? 229 ILE A N 1 +ATOM 1782 C CA . ILE A 1 227 ? -0.983 31.346 23.487 1.00 50.02 ? 229 ILE A CA 1 +ATOM 1783 C C . ILE A 1 227 ? -0.997 30.011 22.755 1.00 52.97 ? 229 ILE A C 1 +ATOM 1784 O O . ILE A 1 227 ? -0.192 29.740 21.861 1.00 55.00 ? 229 ILE A O 1 +ATOM 1785 C CB . ILE A 1 227 ? -1.110 32.544 22.494 1.00 49.95 ? 229 ILE A CB 1 +ATOM 1786 C CG1 . ILE A 1 227 ? -1.380 33.806 23.315 1.00 47.69 ? 229 ILE A CG1 1 +ATOM 1787 C CG2 . ILE A 1 227 ? -2.229 32.326 21.460 1.00 45.56 ? 229 ILE A CG2 1 +ATOM 1788 C CD1 . ILE A 1 227 ? -1.584 35.088 22.478 1.00 49.58 ? 229 ILE A CD1 1 +ATOM 1789 N N . THR A 1 228 ? -1.951 29.159 23.139 1.00 56.11 ? 230 THR A N 1 +ATOM 1790 C CA . THR A 1 228 ? -2.075 27.812 22.583 1.00 59.48 ? 230 THR A CA 1 +ATOM 1791 C C . THR A 1 228 ? -2.801 27.675 21.239 1.00 60.99 ? 230 THR A C 1 +ATOM 1792 O O . THR A 1 228 ? -2.360 26.859 20.424 1.00 61.53 ? 230 THR A O 1 +ATOM 1793 C CB . THR A 1 228 ? -2.739 26.910 23.680 1.00 59.96 ? 230 THR A CB 1 +ATOM 1794 O OG1 . THR A 1 228 ? -3.901 27.596 24.147 1.00 59.50 ? 230 THR A OG1 1 +ATOM 1795 C CG2 . THR A 1 228 ? -1.785 26.598 24.844 1.00 60.41 ? 230 THR A CG2 1 +ATOM 1796 N N . GLY B 1 4 ? 47.357 19.527 24.040 1.00 54.84 ? 4 GLY B N 1 +ATOM 1797 C CA . GLY B 1 4 ? 45.931 19.437 24.300 1.00 55.78 ? 4 GLY B CA 1 +ATOM 1798 C C . GLY B 1 4 ? 45.162 20.724 24.008 1.00 54.90 ? 4 GLY B C 1 +ATOM 1799 O O . GLY B 1 4 ? 44.145 20.709 23.315 1.00 56.68 ? 4 GLY B O 1 +ATOM 1800 N N . GLU B 1 5 ? 45.655 21.849 24.540 1.00 51.94 ? 5 GLU B N 1 +ATOM 1801 C CA . GLU B 1 5 ? 45.081 23.188 24.424 1.00 47.05 ? 5 GLU B CA 1 +ATOM 1802 C C . GLU B 1 5 ? 44.878 23.643 22.986 1.00 46.10 ? 5 GLU B C 1 +ATOM 1803 O O . GLU B 1 5 ? 43.868 24.249 22.667 1.00 44.34 ? 5 GLU B O 1 +ATOM 1804 C CB . GLU B 1 5 ? 46.018 24.134 25.175 1.00 49.25 ? 5 GLU B CB 1 +ATOM 1805 C CG . GLU B 1 5 ? 45.583 25.568 25.469 1.00 50.04 ? 5 GLU B CG 1 +ATOM 1806 C CD . GLU B 1 5 ? 46.625 26.442 26.180 1.00 53.33 ? 5 GLU B CD 1 +ATOM 1807 O OE1 . GLU B 1 5 ? 46.834 26.319 27.396 1.00 54.36 ? 5 GLU B OE1 1 +ATOM 1808 O OE2 . GLU B 1 5 ? 47.219 27.283 25.512 1.00 52.83 ? 5 GLU B OE2 1 +ATOM 1809 N N . GLU B 1 6 ? 45.849 23.344 22.110 1.00 47.66 ? 6 GLU B N 1 +ATOM 1810 C CA . GLU B 1 6 ? 45.858 23.691 20.688 1.00 43.77 ? 6 GLU B CA 1 +ATOM 1811 C C . GLU B 1 6 ? 44.954 22.876 19.795 1.00 39.20 ? 6 GLU B C 1 +ATOM 1812 O O . GLU B 1 6 ? 44.922 23.023 18.566 1.00 38.66 ? 6 GLU B O 1 +ATOM 1813 C CB . GLU B 1 6 ? 47.303 23.623 20.109 1.00 47.34 ? 6 GLU B CB 1 +ATOM 1814 C CG . GLU B 1 6 ? 48.369 22.718 20.755 1.00 56.21 ? 6 GLU B CG 1 +ATOM 1815 C CD . GLU B 1 6 ? 48.192 21.206 20.582 1.00 61.04 ? 6 GLU B CD 1 +ATOM 1816 O OE1 . GLU B 1 6 ? 48.136 20.757 19.430 1.00 59.13 ? 6 GLU B OE1 1 +ATOM 1817 O OE2 . GLU B 1 6 ? 48.129 20.494 21.598 1.00 56.23 ? 6 GLU B OE2 1 +ATOM 1818 N N . LEU B 1 7 ? 44.194 21.992 20.441 1.00 37.45 ? 7 LEU B N 1 +ATOM 1819 C CA . LEU B 1 7 ? 43.185 21.186 19.746 1.00 29.56 ? 7 LEU B CA 1 +ATOM 1820 C C . LEU B 1 7 ? 41.880 21.982 19.591 1.00 28.64 ? 7 LEU B C 1 +ATOM 1821 O O . LEU B 1 7 ? 41.067 21.823 18.681 1.00 28.27 ? 7 LEU B O 1 +ATOM 1822 C CB . LEU B 1 7 ? 42.966 19.914 20.555 1.00 27.45 ? 7 LEU B CB 1 +ATOM 1823 C CG . LEU B 1 7 ? 44.008 18.774 20.497 1.00 22.95 ? 7 LEU B CG 1 +ATOM 1824 C CD1 . LEU B 1 7 ? 43.642 17.721 21.492 1.00 25.14 ? 7 LEU B CD1 1 +ATOM 1825 C CD2 . LEU B 1 7 ? 44.052 18.176 19.111 1.00 17.00 ? 7 LEU B CD2 1 +ATOM 1826 N N . PHE B 1 8 ? 41.754 22.923 20.513 1.00 20.11 ? 8 PHE B N 1 +ATOM 1827 C CA . PHE B 1 8 ? 40.676 23.833 20.652 1.00 16.16 ? 8 PHE B CA 1 +ATOM 1828 C C . PHE B 1 8 ? 40.946 25.237 20.146 1.00 18.33 ? 8 PHE B C 1 +ATOM 1829 O O . PHE B 1 8 ? 40.318 26.162 20.638 1.00 19.68 ? 8 PHE B O 1 +ATOM 1830 C CB . PHE B 1 8 ? 40.357 23.876 22.086 1.00 13.95 ? 8 PHE B CB 1 +ATOM 1831 C CG . PHE B 1 8 ? 39.861 22.563 22.630 1.00 28.50 ? 8 PHE B CG 1 +ATOM 1832 C CD1 . PHE B 1 8 ? 38.515 22.187 22.468 1.00 21.04 ? 8 PHE B CD1 1 +ATOM 1833 C CD2 . PHE B 1 8 ? 40.773 21.730 23.293 1.00 27.86 ? 8 PHE B CD2 1 +ATOM 1834 C CE1 . PHE B 1 8 ? 38.110 20.968 22.979 1.00 28.88 ? 8 PHE B CE1 1 +ATOM 1835 C CE2 . PHE B 1 8 ? 40.342 20.515 23.795 1.00 22.10 ? 8 PHE B CE2 1 +ATOM 1836 C CZ . PHE B 1 8 ? 39.018 20.139 23.637 1.00 31.57 ? 8 PHE B CZ 1 +ATOM 1837 N N . THR B 1 9 ? 41.869 25.535 19.229 1.00 23.19 ? 9 THR B N 1 +ATOM 1838 C CA . THR B 1 9 ? 42.063 26.947 18.858 1.00 22.99 ? 9 THR B CA 1 +ATOM 1839 C C . THR B 1 9 ? 41.093 27.298 17.758 1.00 24.00 ? 9 THR B C 1 +ATOM 1840 O O . THR B 1 9 ? 40.593 28.421 17.758 1.00 25.32 ? 9 THR B O 1 +ATOM 1841 C CB . THR B 1 9 ? 43.481 27.288 18.361 1.00 14.15 ? 9 THR B CB 1 +ATOM 1842 O OG1 . THR B 1 9 ? 43.805 26.451 17.269 1.00 18.77 ? 9 THR B OG1 1 +ATOM 1843 C CG2 . THR B 1 9 ? 44.462 27.191 19.485 1.00 12.11 ? 9 THR B CG2 1 +ATOM 1844 N N . GLY B 1 10 ? 40.837 26.331 16.844 1.00 20.73 ? 10 GLY B N 1 +ATOM 1845 C CA . GLY B 1 10 ? 39.808 26.491 15.834 1.00 14.79 ? 10 GLY B CA 1 +ATOM 1846 C C . GLY B 1 10 ? 38.450 26.027 16.419 1.00 12.62 ? 10 GLY B C 1 +ATOM 1847 O O . GLY B 1 10 ? 38.181 25.910 17.632 1.00 17.81 ? 10 GLY B O 1 +ATOM 1848 N N . VAL B 1 11 ? 37.556 25.872 15.458 1.00 16.29 ? 11 VAL B N 1 +ATOM 1849 C CA . VAL B 1 11 ? 36.221 25.376 15.630 1.00 13.91 ? 11 VAL B CA 1 +ATOM 1850 C C . VAL B 1 11 ? 36.397 23.871 15.430 1.00 19.27 ? 11 VAL B C 1 +ATOM 1851 O O . VAL B 1 11 ? 36.948 23.338 14.434 1.00 12.67 ? 11 VAL B O 1 +ATOM 1852 C CB . VAL B 1 11 ? 35.347 25.976 14.568 1.00 21.29 ? 11 VAL B CB 1 +ATOM 1853 C CG1 . VAL B 1 11 ? 33.908 25.567 14.833 1.00 30.59 ? 11 VAL B CG1 1 +ATOM 1854 C CG2 . VAL B 1 11 ? 35.402 27.491 14.611 1.00 24.41 ? 11 VAL B CG2 1 +ATOM 1855 N N . VAL B 1 12 ? 35.923 23.234 16.509 1.00 17.38 ? 12 VAL B N 1 +ATOM 1856 C CA . VAL B 1 12 ? 36.000 21.784 16.729 1.00 20.21 ? 12 VAL B CA 1 +ATOM 1857 C C . VAL B 1 12 ? 34.602 21.196 16.593 1.00 19.57 ? 12 VAL B C 1 +ATOM 1858 O O . VAL B 1 12 ? 33.657 21.662 17.237 1.00 22.66 ? 12 VAL B O 1 +ATOM 1859 C CB . VAL B 1 12 ? 36.602 21.528 18.159 1.00 21.85 ? 12 VAL B CB 1 +ATOM 1860 C CG1 . VAL B 1 12 ? 36.601 20.060 18.526 1.00 23.16 ? 12 VAL B CG1 1 +ATOM 1861 C CG2 . VAL B 1 12 ? 38.050 22.039 18.188 1.00 16.98 ? 12 VAL B CG2 1 +ATOM 1862 N N . PRO B 1 13 ? 34.380 20.194 15.758 1.00 13.64 ? 13 PRO B N 1 +ATOM 1863 C CA . PRO B 1 13 ? 33.119 19.499 15.666 1.00 13.65 ? 13 PRO B CA 1 +ATOM 1864 C C . PRO B 1 13 ? 32.760 18.791 16.965 1.00 20.21 ? 13 PRO B C 1 +ATOM 1865 O O . PRO B 1 13 ? 33.641 18.219 17.581 1.00 30.18 ? 13 PRO B O 1 +ATOM 1866 C CB . PRO B 1 13 ? 33.310 18.557 14.503 1.00 12.20 ? 13 PRO B CB 1 +ATOM 1867 C CG . PRO B 1 13 ? 34.243 19.294 13.629 1.00 15.29 ? 13 PRO B CG 1 +ATOM 1868 C CD . PRO B 1 13 ? 35.240 19.854 14.636 1.00 16.44 ? 13 PRO B CD 1 +ATOM 1869 N N . ILE B 1 14 ? 31.531 18.851 17.495 1.00 20.81 ? 14 ILE B N 1 +ATOM 1870 C CA . ILE B 1 14 ? 31.157 18.076 18.659 1.00 17.36 ? 14 ILE B CA 1 +ATOM 1871 C C . ILE B 1 14 ? 30.123 17.047 18.191 1.00 21.81 ? 14 ILE B C 1 +ATOM 1872 O O . ILE B 1 14 ? 29.504 17.112 17.113 1.00 24.20 ? 14 ILE B O 1 +ATOM 1873 C CB . ILE B 1 14 ? 30.554 18.975 19.762 1.00 19.81 ? 14 ILE B CB 1 +ATOM 1874 C CG1 . ILE B 1 14 ? 31.491 20.110 20.022 1.00 19.08 ? 14 ILE B CG1 1 +ATOM 1875 C CG2 . ILE B 1 14 ? 30.374 18.237 21.092 1.00 17.25 ? 14 ILE B CG2 1 +ATOM 1876 C CD1 . ILE B 1 14 ? 30.843 21.092 20.988 1.00 23.35 ? 14 ILE B CD1 1 +ATOM 1877 N N . LEU B 1 15 ? 30.080 16.003 19.019 1.00 22.28 ? 15 LEU B N 1 +ATOM 1878 C CA . LEU B 1 15 ? 29.146 14.918 18.908 1.00 26.18 ? 15 LEU B CA 1 +ATOM 1879 C C . LEU B 1 15 ? 28.875 14.618 20.362 1.00 26.05 ? 15 LEU B C 1 +ATOM 1880 O O . LEU B 1 15 ? 29.785 14.580 21.189 1.00 24.60 ? 15 LEU B O 1 +ATOM 1881 C CB . LEU B 1 15 ? 29.723 13.693 18.290 1.00 30.03 ? 15 LEU B CB 1 +ATOM 1882 C CG . LEU B 1 15 ? 29.023 13.020 17.125 1.00 33.21 ? 15 LEU B CG 1 +ATOM 1883 C CD1 . LEU B 1 15 ? 27.504 13.022 17.339 1.00 39.82 ? 15 LEU B CD1 1 +ATOM 1884 C CD2 . LEU B 1 15 ? 29.357 13.737 15.870 1.00 29.37 ? 15 LEU B CD2 1 +ATOM 1885 N N . VAL B 1 16 ? 27.587 14.547 20.699 1.00 24.02 ? 16 VAL B N 1 +ATOM 1886 C CA . VAL B 1 16 ? 27.192 14.264 22.070 1.00 24.30 ? 16 VAL B CA 1 +ATOM 1887 C C . VAL B 1 16 ? 26.296 13.060 21.884 1.00 28.28 ? 16 VAL B C 1 +ATOM 1888 O O . VAL B 1 16 ? 25.618 12.931 20.858 1.00 32.65 ? 16 VAL B O 1 +ATOM 1889 C CB . VAL B 1 16 ? 26.441 15.468 22.676 1.00 21.47 ? 16 VAL B CB 1 +ATOM 1890 C CG1 . VAL B 1 16 ? 26.041 15.175 24.093 1.00 15.96 ? 16 VAL B CG1 1 +ATOM 1891 C CG2 . VAL B 1 16 ? 27.336 16.705 22.731 1.00 14.37 ? 16 VAL B CG2 1 +ATOM 1892 N N . GLU B 1 17 ? 26.385 12.094 22.790 1.00 30.43 ? 17 GLU B N 1 +ATOM 1893 C CA . GLU B 1 17 ? 25.623 10.854 22.657 1.00 33.92 ? 17 GLU B CA 1 +ATOM 1894 C C . GLU B 1 17 ? 25.172 10.440 24.048 1.00 34.50 ? 17 GLU B C 1 +ATOM 1895 O O . GLU B 1 17 ? 26.027 10.099 24.864 1.00 31.85 ? 17 GLU B O 1 +ATOM 1896 C CB . GLU B 1 17 ? 26.500 9.767 22.066 1.00 36.82 ? 17 GLU B CB 1 +ATOM 1897 C CG . GLU B 1 17 ? 27.011 9.987 20.636 1.00 43.80 ? 17 GLU B CG 1 +ATOM 1898 C CD . GLU B 1 17 ? 25.997 9.620 19.558 1.00 53.41 ? 17 GLU B CD 1 +ATOM 1899 O OE1 . GLU B 1 17 ? 25.896 8.444 19.223 1.00 63.30 ? 17 GLU B OE1 1 +ATOM 1900 O OE2 . GLU B 1 17 ? 25.295 10.490 19.052 1.00 58.80 ? 17 GLU B OE2 1 +ATOM 1901 N N . LEU B 1 18 ? 23.863 10.514 24.355 1.00 33.42 ? 18 LEU B N 1 +ATOM 1902 C CA . LEU B 1 18 ? 23.363 10.122 25.672 1.00 35.17 ? 18 LEU B CA 1 +ATOM 1903 C C . LEU B 1 18 ? 22.474 8.882 25.583 1.00 36.83 ? 18 LEU B C 1 +ATOM 1904 O O . LEU B 1 18 ? 21.833 8.598 24.566 1.00 36.57 ? 18 LEU B O 1 +ATOM 1905 C CB . LEU B 1 18 ? 22.642 11.347 26.250 1.00 33.77 ? 18 LEU B CB 1 +ATOM 1906 C CG . LEU B 1 18 ? 22.011 11.526 27.645 1.00 28.35 ? 18 LEU B CG 1 +ATOM 1907 C CD1 . LEU B 1 18 ? 20.595 10.984 27.691 1.00 16.72 ? 18 LEU B CD1 1 +ATOM 1908 C CD2 . LEU B 1 18 ? 22.874 10.875 28.650 1.00 30.34 ? 18 LEU B CD2 1 +ATOM 1909 N N . ASP B 1 19 ? 22.601 8.061 26.637 1.00 39.07 ? 19 ASP B N 1 +ATOM 1910 C CA . ASP B 1 19 ? 21.785 6.871 26.863 1.00 38.89 ? 19 ASP B CA 1 +ATOM 1911 C C . ASP B 1 19 ? 21.413 7.131 28.302 1.00 39.55 ? 19 ASP B C 1 +ATOM 1912 O O . ASP B 1 19 ? 22.218 7.224 29.226 1.00 39.18 ? 19 ASP B O 1 +ATOM 1913 C CB . ASP B 1 19 ? 22.551 5.506 26.783 1.00 36.69 ? 19 ASP B CB 1 +ATOM 1914 C CG . ASP B 1 19 ? 22.895 4.923 25.382 1.00 40.24 ? 19 ASP B CG 1 +ATOM 1915 O OD1 . ASP B 1 19 ? 22.148 5.139 24.398 1.00 28.86 ? 19 ASP B OD1 1 +ATOM 1916 O OD2 . ASP B 1 19 ? 23.934 4.223 25.289 1.00 32.88 ? 19 ASP B OD2 1 +ATOM 1917 N N . GLY B 1 20 ? 20.121 7.348 28.445 1.00 44.92 ? 20 GLY B N 1 +ATOM 1918 C CA . GLY B 1 20 ? 19.555 7.686 29.730 1.00 45.86 ? 20 GLY B CA 1 +ATOM 1919 C C . GLY B 1 20 ? 18.477 6.707 30.102 1.00 47.61 ? 20 GLY B C 1 +ATOM 1920 O O . GLY B 1 20 ? 18.034 5.850 29.322 1.00 47.55 ? 20 GLY B O 1 +ATOM 1921 N N . ASP B 1 21 ? 18.123 6.928 31.368 1.00 49.71 ? 21 ASP B N 1 +ATOM 1922 C CA . ASP B 1 21 ? 17.117 6.161 32.074 1.00 52.68 ? 21 ASP B CA 1 +ATOM 1923 C C . ASP B 1 21 ? 16.657 7.027 33.233 1.00 53.11 ? 21 ASP B C 1 +ATOM 1924 O O . ASP B 1 21 ? 17.360 7.179 34.230 1.00 49.03 ? 21 ASP B O 1 +ATOM 1925 C CB . ASP B 1 21 ? 17.743 4.855 32.577 1.00 55.49 ? 21 ASP B CB 1 +ATOM 1926 C CG . ASP B 1 21 ? 16.801 3.839 33.206 1.00 59.65 ? 21 ASP B CG 1 +ATOM 1927 O OD1 . ASP B 1 21 ? 16.122 4.172 34.177 1.00 63.95 ? 21 ASP B OD1 1 +ATOM 1928 O OD2 . ASP B 1 21 ? 16.767 2.701 32.738 1.00 59.81 ? 21 ASP B OD2 1 +ATOM 1929 N N . VAL B 1 22 ? 15.484 7.640 33.100 1.00 54.98 ? 22 VAL B N 1 +ATOM 1930 C CA . VAL B 1 22 ? 14.957 8.404 34.210 1.00 59.05 ? 22 VAL B CA 1 +ATOM 1931 C C . VAL B 1 22 ? 13.663 7.726 34.612 1.00 61.79 ? 22 VAL B C 1 +ATOM 1932 O O . VAL B 1 22 ? 12.675 7.779 33.873 1.00 63.80 ? 22 VAL B O 1 +ATOM 1933 C CB . VAL B 1 22 ? 14.707 9.853 33.786 1.00 61.05 ? 22 VAL B CB 1 +ATOM 1934 C CG1 . VAL B 1 22 ? 14.100 10.616 34.960 1.00 62.34 ? 22 VAL B CG1 1 +ATOM 1935 C CG2 . VAL B 1 22 ? 16.018 10.519 33.381 1.00 61.45 ? 22 VAL B CG2 1 +ATOM 1936 N N . ASN B 1 23 ? 13.707 7.074 35.791 1.00 62.33 ? 23 ASN B N 1 +ATOM 1937 C CA . ASN B 1 23 ? 12.593 6.315 36.370 1.00 61.07 ? 23 ASN B CA 1 +ATOM 1938 C C . ASN B 1 23 ? 12.232 5.076 35.576 1.00 57.34 ? 23 ASN B C 1 +ATOM 1939 O O . ASN B 1 23 ? 11.081 4.639 35.561 1.00 59.73 ? 23 ASN B O 1 +ATOM 1940 C CB . ASN B 1 23 ? 11.312 7.171 36.475 1.00 65.16 ? 23 ASN B CB 1 +ATOM 1941 C CG . ASN B 1 23 ? 11.442 8.352 37.404 1.00 70.50 ? 23 ASN B CG 1 +ATOM 1942 O OD1 . ASN B 1 23 ? 12.532 8.888 37.633 1.00 72.05 ? 23 ASN B OD1 1 +ATOM 1943 N ND2 . ASN B 1 23 ? 10.318 8.767 37.978 1.00 73.85 ? 23 ASN B ND2 1 +ATOM 1944 N N . GLY B 1 24 ? 13.224 4.491 34.920 1.00 54.83 ? 24 GLY B N 1 +ATOM 1945 C CA . GLY B 1 24 ? 12.992 3.319 34.099 1.00 53.53 ? 24 GLY B CA 1 +ATOM 1946 C C . GLY B 1 24 ? 12.774 3.690 32.649 1.00 51.37 ? 24 GLY B C 1 +ATOM 1947 O O . GLY B 1 24 ? 12.809 2.846 31.761 1.00 48.87 ? 24 GLY B O 1 +ATOM 1948 N N . HIS B 1 25 ? 12.542 4.966 32.382 1.00 54.41 ? 25 HIS B N 1 +ATOM 1949 C CA . HIS B 1 25 ? 12.333 5.432 31.021 1.00 56.64 ? 25 HIS B CA 1 +ATOM 1950 C C . HIS B 1 25 ? 13.668 5.632 30.316 1.00 56.99 ? 25 HIS B C 1 +ATOM 1951 O O . HIS B 1 25 ? 14.415 6.583 30.554 1.00 56.63 ? 25 HIS B O 1 +ATOM 1952 C CB . HIS B 1 25 ? 11.550 6.753 31.039 1.00 57.56 ? 25 HIS B CB 1 +ATOM 1953 C CG . HIS B 1 25 ? 10.246 6.655 31.819 1.00 58.78 ? 25 HIS B CG 1 +ATOM 1954 N ND1 . HIS B 1 25 ? 9.912 7.377 32.874 1.00 58.22 ? 25 HIS B ND1 1 +ATOM 1955 C CD2 . HIS B 1 25 ? 9.229 5.765 31.558 1.00 61.41 ? 25 HIS B CD2 1 +ATOM 1956 C CE1 . HIS B 1 25 ? 8.731 6.942 33.253 1.00 62.33 ? 25 HIS B CE1 1 +ATOM 1957 N NE2 . HIS B 1 25 ? 8.317 5.977 32.468 1.00 59.76 ? 25 HIS B NE2 1 +ATOM 1958 N N . LYS B 1 26 ? 13.959 4.645 29.474 1.00 54.70 ? 26 LYS B N 1 +ATOM 1959 C CA . LYS B 1 26 ? 15.138 4.624 28.649 1.00 52.77 ? 26 LYS B CA 1 +ATOM 1960 C C . LYS B 1 26 ? 14.957 5.505 27.414 1.00 52.59 ? 26 LYS B C 1 +ATOM 1961 O O . LYS B 1 26 ? 13.972 5.406 26.672 1.00 52.87 ? 26 LYS B O 1 +ATOM 1962 C CB . LYS B 1 26 ? 15.396 3.181 28.257 1.00 53.91 ? 26 LYS B CB 1 +ATOM 1963 C CG . LYS B 1 26 ? 15.793 2.288 29.447 1.00 56.77 ? 26 LYS B CG 1 +ATOM 1964 C CD . LYS B 1 26 ? 16.158 0.867 29.009 1.00 57.70 ? 26 LYS B CD 1 +ATOM 1965 C CE . LYS B 1 26 ? 14.974 -0.038 28.649 1.00 60.66 ? 26 LYS B CE 1 +ATOM 1966 N NZ . LYS B 1 26 ? 14.713 -0.977 29.730 1.00 54.90 ? 26 LYS B NZ 1 +ATOM 1967 N N . PHE B 1 27 ? 15.929 6.402 27.223 1.00 48.74 ? 27 PHE B N 1 +ATOM 1968 C CA . PHE B 1 27 ? 15.953 7.335 26.109 1.00 43.24 ? 27 PHE B CA 1 +ATOM 1969 C C . PHE B 1 27 ? 17.370 7.606 25.607 1.00 43.20 ? 27 PHE B C 1 +ATOM 1970 O O . PHE B 1 27 ? 18.369 7.442 26.316 1.00 38.83 ? 27 PHE B O 1 +ATOM 1971 C CB . PHE B 1 27 ? 15.337 8.655 26.514 1.00 35.59 ? 27 PHE B CB 1 +ATOM 1972 C CG . PHE B 1 27 ? 16.032 9.411 27.649 1.00 32.44 ? 27 PHE B CG 1 +ATOM 1973 C CD1 . PHE B 1 27 ? 15.833 9.035 28.980 1.00 31.08 ? 27 PHE B CD1 1 +ATOM 1974 C CD2 . PHE B 1 27 ? 16.804 10.539 27.366 1.00 25.28 ? 27 PHE B CD2 1 +ATOM 1975 C CE1 . PHE B 1 27 ? 16.388 9.786 30.009 1.00 25.13 ? 27 PHE B CE1 1 +ATOM 1976 C CE2 . PHE B 1 27 ? 17.359 11.284 28.401 1.00 22.92 ? 27 PHE B CE2 1 +ATOM 1977 C CZ . PHE B 1 27 ? 17.152 10.916 29.724 1.00 26.12 ? 27 PHE B CZ 1 +ATOM 1978 N N . SER B 1 28 ? 17.443 8.068 24.363 1.00 40.15 ? 28 SER B N 1 +ATOM 1979 C CA . SER B 1 28 ? 18.732 8.367 23.781 1.00 40.76 ? 28 SER B CA 1 +ATOM 1980 C C . SER B 1 28 ? 18.700 9.664 22.998 1.00 40.52 ? 28 SER B C 1 +ATOM 1981 O O . SER B 1 28 ? 17.738 9.966 22.284 1.00 39.04 ? 28 SER B O 1 +ATOM 1982 C CB . SER B 1 28 ? 19.173 7.229 22.855 1.00 40.93 ? 28 SER B CB 1 +ATOM 1983 O OG . SER B 1 28 ? 19.245 6.001 23.574 1.00 42.03 ? 28 SER B OG 1 +ATOM 1984 N N . VAL B 1 29 ? 19.728 10.494 23.214 1.00 38.16 ? 29 VAL B N 1 +ATOM 1985 C CA . VAL B 1 29 ? 19.820 11.650 22.367 1.00 39.68 ? 29 VAL B CA 1 +ATOM 1986 C C . VAL B 1 29 ? 21.162 11.599 21.665 1.00 41.72 ? 29 VAL B C 1 +ATOM 1987 O O . VAL B 1 29 ? 22.175 11.101 22.168 1.00 45.87 ? 29 VAL B O 1 +ATOM 1988 C CB . VAL B 1 29 ? 19.672 13.049 23.132 1.00 38.87 ? 29 VAL B CB 1 +ATOM 1989 C CG1 . VAL B 1 29 ? 18.884 12.855 24.411 1.00 36.49 ? 29 VAL B CG1 1 +ATOM 1990 C CG2 . VAL B 1 29 ? 21.016 13.698 23.378 1.00 41.28 ? 29 VAL B CG2 1 +ATOM 1991 N N . SER B 1 30 ? 21.100 12.165 20.471 1.00 38.10 ? 30 SER B N 1 +ATOM 1992 C CA . SER B 1 30 ? 22.270 12.392 19.684 1.00 36.50 ? 30 SER B CA 1 +ATOM 1993 C C . SER B 1 30 ? 22.402 13.894 19.441 1.00 37.42 ? 30 SER B C 1 +ATOM 1994 O O . SER B 1 30 ? 21.558 14.551 18.807 1.00 37.98 ? 30 SER B O 1 +ATOM 1995 C CB . SER B 1 30 ? 22.126 11.634 18.394 1.00 37.63 ? 30 SER B CB 1 +ATOM 1996 O OG . SER B 1 30 ? 22.207 10.247 18.687 1.00 47.95 ? 30 SER B OG 1 +ATOM 1997 N N . GLY B 1 31 ? 23.476 14.452 20.004 1.00 28.40 ? 31 GLY B N 1 +ATOM 1998 C CA . GLY B 1 31 ? 23.793 15.851 19.785 1.00 27.37 ? 31 GLY B CA 1 +ATOM 1999 C C . GLY B 1 31 ? 24.896 16.049 18.767 1.00 28.46 ? 31 GLY B C 1 +ATOM 2000 O O . GLY B 1 31 ? 25.729 15.180 18.554 1.00 32.52 ? 31 GLY B O 1 +ATOM 2001 N N . GLU B 1 32 ? 24.868 17.149 18.030 1.00 29.52 ? 32 GLU B N 1 +ATOM 2002 C CA . GLU B 1 32 ? 26.001 17.513 17.222 1.00 24.50 ? 32 GLU B CA 1 +ATOM 2003 C C . GLU B 1 32 ? 26.077 19.008 17.061 1.00 24.27 ? 32 GLU B C 1 +ATOM 2004 O O . GLU B 1 32 ? 25.106 19.759 16.979 1.00 23.22 ? 32 GLU B O 1 +ATOM 2005 C CB . GLU B 1 32 ? 25.953 16.848 15.848 1.00 28.11 ? 32 GLU B CB 1 +ATOM 2006 C CG . GLU B 1 32 ? 24.701 16.921 14.969 1.00 33.55 ? 32 GLU B CG 1 +ATOM 2007 C CD . GLU B 1 32 ? 24.406 18.250 14.295 1.00 35.41 ? 32 GLU B CD 1 +ATOM 2008 O OE1 . GLU B 1 32 ? 25.350 18.956 13.933 1.00 39.09 ? 32 GLU B OE1 1 +ATOM 2009 O OE2 . GLU B 1 32 ? 23.227 18.568 14.125 1.00 32.54 ? 32 GLU B OE2 1 +ATOM 2010 N N . GLY B 1 33 ? 27.327 19.437 17.060 1.00 26.51 ? 33 GLY B N 1 +ATOM 2011 C CA . GLY B 1 33 ? 27.612 20.827 16.885 1.00 20.63 ? 33 GLY B CA 1 +ATOM 2012 C C . GLY B 1 33 ? 29.038 21.078 16.579 1.00 20.35 ? 33 GLY B C 1 +ATOM 2013 O O . GLY B 1 33 ? 29.722 20.439 15.775 1.00 20.19 ? 33 GLY B O 1 +ATOM 2014 N N . GLU B 1 34 ? 29.390 22.172 17.230 1.00 25.79 ? 34 GLU B N 1 +ATOM 2015 C CA . GLU B 1 34 ? 30.718 22.732 17.149 1.00 26.71 ? 34 GLU B CA 1 +ATOM 2016 C C . GLU B 1 34 ? 30.974 23.648 18.314 1.00 27.77 ? 34 GLU B C 1 +ATOM 2017 O O . GLU B 1 34 ? 30.083 24.182 18.964 1.00 28.35 ? 34 GLU B O 1 +ATOM 2018 C CB . GLU B 1 34 ? 30.953 23.504 15.844 1.00 26.02 ? 34 GLU B CB 1 +ATOM 2019 C CG . GLU B 1 34 ? 29.943 24.457 15.250 1.00 29.76 ? 34 GLU B CG 1 +ATOM 2020 C CD . GLU B 1 34 ? 30.498 25.259 14.068 1.00 36.64 ? 34 GLU B CD 1 +ATOM 2021 O OE1 . GLU B 1 34 ? 30.889 24.671 13.046 1.00 38.07 ? 34 GLU B OE1 1 +ATOM 2022 O OE2 . GLU B 1 34 ? 30.539 26.489 14.175 1.00 34.01 ? 34 GLU B OE2 1 +ATOM 2023 N N . GLY B 1 35 ? 32.249 23.656 18.669 1.00 28.82 ? 35 GLY B N 1 +ATOM 2024 C CA . GLY B 1 35 ? 32.742 24.467 19.762 1.00 26.92 ? 35 GLY B CA 1 +ATOM 2025 C C . GLY B 1 35 ? 33.857 25.366 19.269 1.00 26.64 ? 35 GLY B C 1 +ATOM 2026 O O . GLY B 1 35 ? 34.581 25.040 18.325 1.00 33.95 ? 35 GLY B O 1 +ATOM 2027 N N . ASP B 1 36 ? 33.982 26.534 19.890 1.00 24.55 ? 36 ASP B N 1 +ATOM 2028 C CA . ASP B 1 36 ? 35.015 27.509 19.533 1.00 23.26 ? 36 ASP B CA 1 +ATOM 2029 C C . ASP B 1 36 ? 35.473 27.989 20.873 1.00 21.74 ? 36 ASP B C 1 +ATOM 2030 O O . ASP B 1 36 ? 34.942 28.950 21.397 1.00 26.48 ? 36 ASP B O 1 +ATOM 2031 C CB . ASP B 1 36 ? 34.466 28.704 18.759 1.00 19.32 ? 36 ASP B CB 1 +ATOM 2032 C CG . ASP B 1 36 ? 35.378 29.395 17.773 1.00 21.19 ? 36 ASP B CG 1 +ATOM 2033 O OD1 . ASP B 1 36 ? 36.601 29.250 17.846 1.00 32.21 ? 36 ASP B OD1 1 +ATOM 2034 O OD2 . ASP B 1 36 ? 34.853 30.110 16.911 1.00 26.18 ? 36 ASP B OD2 1 +ATOM 2035 N N . ALA B 1 37 ? 36.457 27.294 21.453 1.00 26.09 ? 37 ALA B N 1 +ATOM 2036 C CA . ALA B 1 37 ? 36.983 27.601 22.760 1.00 18.43 ? 37 ALA B CA 1 +ATOM 2037 C C . ALA B 1 37 ? 37.589 28.984 22.811 1.00 20.65 ? 37 ALA B C 1 +ATOM 2038 O O . ALA B 1 37 ? 37.640 29.640 23.862 1.00 23.56 ? 37 ALA B O 1 +ATOM 2039 C CB . ALA B 1 37 ? 38.013 26.588 23.094 1.00 22.25 ? 37 ALA B CB 1 +ATOM 2040 N N . THR B 1 38 ? 38.007 29.453 21.639 1.00 22.91 ? 38 THR B N 1 +ATOM 2041 C CA . THR B 1 38 ? 38.563 30.811 21.488 1.00 30.42 ? 38 THR B CA 1 +ATOM 2042 C C . THR B 1 38 ? 37.567 31.885 21.916 1.00 30.28 ? 38 THR B C 1 +ATOM 2043 O O . THR B 1 38 ? 37.912 32.866 22.583 1.00 31.50 ? 38 THR B O 1 +ATOM 2044 C CB . THR B 1 38 ? 38.979 30.992 20.013 1.00 33.62 ? 38 THR B CB 1 +ATOM 2045 O OG1 . THR B 1 38 ? 40.015 30.032 19.812 1.00 36.12 ? 38 THR B OG1 1 +ATOM 2046 C CG2 . THR B 1 38 ? 39.412 32.396 19.648 1.00 32.15 ? 38 THR B CG2 1 +ATOM 2047 N N . TYR B 1 39 ? 36.306 31.652 21.551 1.00 30.01 ? 39 TYR B N 1 +ATOM 2048 C CA . TYR B 1 39 ? 35.221 32.527 21.947 1.00 27.18 ? 39 TYR B CA 1 +ATOM 2049 C C . TYR B 1 39 ? 34.453 31.988 23.119 1.00 26.58 ? 39 TYR B C 1 +ATOM 2050 O O . TYR B 1 39 ? 33.731 32.707 23.801 1.00 35.61 ? 39 TYR B O 1 +ATOM 2051 C CB . TYR B 1 39 ? 34.402 32.698 20.742 1.00 25.08 ? 39 TYR B CB 1 +ATOM 2052 C CG . TYR B 1 39 ? 35.233 33.535 19.782 1.00 29.45 ? 39 TYR B CG 1 +ATOM 2053 C CD1 . TYR B 1 39 ? 35.263 34.922 20.005 1.00 31.40 ? 39 TYR B CD1 1 +ATOM 2054 C CD2 . TYR B 1 39 ? 35.907 32.961 18.689 1.00 23.55 ? 39 TYR B CD2 1 +ATOM 2055 C CE1 . TYR B 1 39 ? 35.957 35.749 19.120 1.00 36.32 ? 39 TYR B CE1 1 +ATOM 2056 C CE2 . TYR B 1 39 ? 36.599 33.795 17.798 1.00 32.61 ? 39 TYR B CE2 1 +ATOM 2057 C CZ . TYR B 1 39 ? 36.610 35.189 18.021 1.00 37.06 ? 39 TYR B CZ 1 +ATOM 2058 O OH . TYR B 1 39 ? 37.198 36.060 17.111 1.00 43.56 ? 39 TYR B OH 1 +ATOM 2059 N N . GLY B 1 40 ? 34.689 30.732 23.473 1.00 27.82 ? 40 GLY B N 1 +ATOM 2060 C CA . GLY B 1 40 ? 34.020 30.090 24.603 1.00 24.72 ? 40 GLY B CA 1 +ATOM 2061 C C . GLY B 1 40 ? 32.609 29.647 24.234 1.00 25.66 ? 40 GLY B C 1 +ATOM 2062 O O . GLY B 1 40 ? 31.776 29.542 25.131 1.00 28.35 ? 40 GLY B O 1 +ATOM 2063 N N . LYS B 1 41 ? 32.336 29.420 22.941 1.00 16.93 ? 41 LYS B N 1 +ATOM 2064 C CA . LYS B 1 41 ? 31.025 29.080 22.499 1.00 25.84 ? 41 LYS B CA 1 +ATOM 2065 C C . LYS B 1 41 ? 30.811 27.733 21.808 1.00 27.38 ? 41 LYS B C 1 +ATOM 2066 O O . LYS B 1 41 ? 31.573 27.209 20.980 1.00 26.01 ? 41 LYS B O 1 +ATOM 2067 C CB . LYS B 1 41 ? 30.485 30.202 21.595 1.00 30.14 ? 41 LYS B CB 1 +ATOM 2068 C CG . LYS B 1 41 ? 31.122 30.435 20.229 1.00 41.62 ? 41 LYS B CG 1 +ATOM 2069 C CD . LYS B 1 41 ? 30.262 31.318 19.308 1.00 40.62 ? 41 LYS B CD 1 +ATOM 2070 C CE . LYS B 1 41 ? 28.980 30.630 18.844 1.00 41.91 ? 41 LYS B CE 1 +ATOM 2071 N NZ . LYS B 1 41 ? 28.195 31.520 18.026 1.00 31.45 ? 41 LYS B NZ 1 +ATOM 2072 N N . LEU B 1 42 ? 29.681 27.207 22.315 1.00 27.28 ? 42 LEU B N 1 +ATOM 2073 C CA . LEU B 1 42 ? 29.099 25.920 21.978 1.00 22.42 ? 42 LEU B CA 1 +ATOM 2074 C C . LEU B 1 42 ? 27.828 26.204 21.209 1.00 25.63 ? 42 LEU B C 1 +ATOM 2075 O O . LEU B 1 42 ? 27.096 27.155 21.490 1.00 31.91 ? 42 LEU B O 1 +ATOM 2076 C CB . LEU B 1 42 ? 28.765 25.150 23.238 1.00 22.25 ? 42 LEU B CB 1 +ATOM 2077 C CG . LEU B 1 42 ? 29.966 24.624 24.027 1.00 22.22 ? 42 LEU B CG 1 +ATOM 2078 C CD1 . LEU B 1 42 ? 29.655 24.207 25.423 1.00 13.88 ? 42 LEU B CD1 1 +ATOM 2079 C CD2 . LEU B 1 42 ? 30.439 23.421 23.319 1.00 26.18 ? 42 LEU B CD2 1 +ATOM 2080 N N . THR B 1 43 ? 27.629 25.379 20.192 1.00 18.39 ? 43 THR B N 1 +ATOM 2081 C CA . THR B 1 43 ? 26.476 25.401 19.328 1.00 23.23 ? 43 THR B CA 1 +ATOM 2082 C C . THR B 1 43 ? 26.121 23.932 19.198 1.00 21.75 ? 43 THR B C 1 +ATOM 2083 O O . THR B 1 43 ? 26.771 23.224 18.433 1.00 19.28 ? 43 THR B O 1 +ATOM 2084 C CB . THR B 1 43 ? 26.840 26.002 17.953 1.00 27.75 ? 43 THR B CB 1 +ATOM 2085 O OG1 . THR B 1 43 ? 27.038 27.375 18.191 1.00 39.96 ? 43 THR B OG1 1 +ATOM 2086 C CG2 . THR B 1 43 ? 25.787 25.826 16.882 1.00 40.27 ? 43 THR B CG2 1 +ATOM 2087 N N . LEU B 1 44 ? 25.106 23.439 19.926 1.00 18.65 ? 44 LEU B N 1 +ATOM 2088 C CA . LEU B 1 44 ? 24.778 22.037 19.835 1.00 24.25 ? 44 LEU B CA 1 +ATOM 2089 C C . LEU B 1 44 ? 23.337 21.795 19.541 1.00 26.77 ? 44 LEU B C 1 +ATOM 2090 O O . LEU B 1 44 ? 22.500 22.561 20.004 1.00 37.28 ? 44 LEU B O 1 +ATOM 2091 C CB . LEU B 1 44 ? 25.188 21.343 21.152 1.00 22.48 ? 44 LEU B CB 1 +ATOM 2092 C CG . LEU B 1 44 ? 26.713 21.240 21.406 1.00 16.59 ? 44 LEU B CG 1 +ATOM 2093 C CD1 . LEU B 1 44 ? 27.017 20.757 22.764 1.00 8.83 ? 44 LEU B CD1 1 +ATOM 2094 C CD2 . LEU B 1 44 ? 27.310 20.270 20.399 1.00 19.02 ? 44 LEU B CD2 1 +ATOM 2095 N N . LYS B 1 45 ? 23.032 20.813 18.702 1.00 27.05 ? 45 LYS B N 1 +ATOM 2096 C CA . LYS B 1 45 ? 21.650 20.409 18.454 1.00 25.35 ? 45 LYS B CA 1 +ATOM 2097 C C . LYS B 1 45 ? 21.488 18.944 18.839 1.00 24.06 ? 45 LYS B C 1 +ATOM 2098 O O . LYS B 1 45 ? 22.156 18.060 18.312 1.00 22.81 ? 45 LYS B O 1 +ATOM 2099 C CB . LYS B 1 45 ? 21.274 20.537 17.009 1.00 26.90 ? 45 LYS B CB 1 +ATOM 2100 C CG . LYS B 1 45 ? 19.820 20.102 16.750 1.00 22.81 ? 45 LYS B CG 1 +ATOM 2101 C CD . LYS B 1 45 ? 19.592 20.201 15.256 1.00 18.04 ? 45 LYS B CD 1 +ATOM 2102 C CE . LYS B 1 45 ? 18.162 19.853 14.979 1.00 22.62 ? 45 LYS B CE 1 +ATOM 2103 N NZ . LYS B 1 45 ? 17.952 19.944 13.551 1.00 15.70 ? 45 LYS B NZ 1 +ATOM 2104 N N . PHE B 1 46 ? 20.558 18.717 19.754 1.00 23.99 ? 46 PHE B N 1 +ATOM 2105 C CA . PHE B 1 46 ? 20.243 17.406 20.300 1.00 24.34 ? 46 PHE B CA 1 +ATOM 2106 C C . PHE B 1 46 ? 18.905 16.888 19.803 1.00 28.46 ? 46 PHE B C 1 +ATOM 2107 O O . PHE B 1 46 ? 17.900 17.580 19.888 1.00 23.41 ? 46 PHE B O 1 +ATOM 2108 C CB . PHE B 1 46 ? 20.190 17.491 21.795 1.00 27.33 ? 46 PHE B CB 1 +ATOM 2109 C CG . PHE B 1 46 ? 21.444 18.125 22.366 1.00 29.39 ? 46 PHE B CG 1 +ATOM 2110 C CD1 . PHE B 1 46 ? 22.581 17.347 22.554 1.00 27.73 ? 46 PHE B CD1 1 +ATOM 2111 C CD2 . PHE B 1 46 ? 21.449 19.487 22.648 1.00 28.17 ? 46 PHE B CD2 1 +ATOM 2112 C CE1 . PHE B 1 46 ? 23.740 17.931 23.026 1.00 28.05 ? 46 PHE B CE1 1 +ATOM 2113 C CE2 . PHE B 1 46 ? 22.615 20.071 23.127 1.00 30.51 ? 46 PHE B CE2 1 +ATOM 2114 C CZ . PHE B 1 46 ? 23.757 19.288 23.313 1.00 33.13 ? 46 PHE B CZ 1 +ATOM 2115 N N . ILE B 1 47 ? 18.904 15.672 19.263 1.00 30.35 ? 47 ILE B N 1 +ATOM 2116 C CA . ILE B 1 47 ? 17.718 14.989 18.795 1.00 28.60 ? 47 ILE B CA 1 +ATOM 2117 C C . ILE B 1 47 ? 17.405 13.911 19.791 1.00 32.58 ? 47 ILE B C 1 +ATOM 2118 O O . ILE B 1 47 ? 18.341 13.327 20.327 1.00 29.40 ? 47 ILE B O 1 +ATOM 2119 C CB . ILE B 1 47 ? 17.970 14.362 17.424 1.00 25.49 ? 47 ILE B CB 1 +ATOM 2120 C CG1 . ILE B 1 47 ? 18.192 15.503 16.464 1.00 22.72 ? 47 ILE B CG1 1 +ATOM 2121 C CG2 . ILE B 1 47 ? 16.802 13.473 16.968 1.00 27.81 ? 47 ILE B CG2 1 +ATOM 2122 C CD1 . ILE B 1 47 ? 17.089 16.565 16.499 1.00 14.05 ? 47 ILE B CD1 1 +ATOM 2123 N N . CYS B 1 48 ? 16.123 13.629 20.084 1.00 37.36 ? 48 CYS B N 1 +ATOM 2124 C CA . CYS B 1 48 ? 15.822 12.489 20.944 1.00 38.37 ? 48 CYS B CA 1 +ATOM 2125 C C . CYS B 1 48 ? 15.555 11.351 19.973 1.00 38.30 ? 48 CYS B C 1 +ATOM 2126 O O . CYS B 1 48 ? 14.481 11.276 19.407 1.00 42.90 ? 48 CYS B O 1 +ATOM 2127 C CB . CYS B 1 48 ? 14.601 12.757 21.791 1.00 36.39 ? 48 CYS B CB 1 +ATOM 2128 S SG . CYS B 1 48 ? 14.502 11.398 22.976 1.00 36.44 ? 48 CYS B SG 1 +ATOM 2129 N N . THR B 1 49 ? 16.514 10.461 19.710 1.00 39.66 ? 49 THR B N 1 +ATOM 2130 C CA . THR B 1 49 ? 16.370 9.434 18.688 1.00 39.38 ? 49 THR B CA 1 +ATOM 2131 C C . THR B 1 49 ? 15.492 8.243 19.027 1.00 43.17 ? 49 THR B C 1 +ATOM 2132 O O . THR B 1 49 ? 15.261 7.363 18.192 1.00 42.80 ? 49 THR B O 1 +ATOM 2133 C CB . THR B 1 49 ? 17.760 8.922 18.293 1.00 39.72 ? 49 THR B CB 1 +ATOM 2134 O OG1 . THR B 1 49 ? 18.374 8.583 19.536 1.00 39.80 ? 49 THR B OG1 1 +ATOM 2135 C CG2 . THR B 1 49 ? 18.553 9.902 17.412 1.00 40.13 ? 49 THR B CG2 1 +ATOM 2136 N N . THR B 1 50 ? 15.054 8.207 20.284 1.00 43.38 ? 50 THR B N 1 +ATOM 2137 C CA . THR B 1 50 ? 14.151 7.205 20.817 1.00 46.51 ? 50 THR B CA 1 +ATOM 2138 C C . THR B 1 50 ? 12.717 7.739 20.897 1.00 50.22 ? 50 THR B C 1 +ATOM 2139 O O . THR B 1 50 ? 11.859 7.146 21.546 1.00 51.10 ? 50 THR B O 1 +ATOM 2140 C CB . THR B 1 50 ? 14.642 6.779 22.226 1.00 47.36 ? 50 THR B CB 1 +ATOM 2141 O OG1 . THR B 1 50 ? 14.834 7.971 22.986 1.00 45.66 ? 50 THR B OG1 1 +ATOM 2142 C CG2 . THR B 1 50 ? 15.906 5.937 22.165 1.00 43.02 ? 50 THR B CG2 1 +ATOM 2143 N N . GLY B 1 51 ? 12.417 8.872 20.258 1.00 52.03 ? 51 GLY B N 1 +ATOM 2144 C CA . GLY B 1 51 ? 11.094 9.461 20.332 1.00 54.31 ? 51 GLY B CA 1 +ATOM 2145 C C . GLY B 1 51 ? 11.098 10.767 21.114 1.00 53.64 ? 51 GLY B C 1 +ATOM 2146 O O . GLY B 1 51 ? 11.790 11.735 20.779 1.00 52.36 ? 51 GLY B O 1 +ATOM 2147 N N . LYS B 1 52 ? 10.265 10.777 22.157 1.00 53.26 ? 52 LYS B N 1 +ATOM 2148 C CA . LYS B 1 52 ? 10.172 11.949 23.000 1.00 53.35 ? 52 LYS B CA 1 +ATOM 2149 C C . LYS B 1 52 ? 10.934 11.817 24.306 1.00 51.15 ? 52 LYS B C 1 +ATOM 2150 O O . LYS B 1 52 ? 11.060 10.753 24.903 1.00 54.06 ? 52 LYS B O 1 +ATOM 2151 C CB . LYS B 1 52 ? 8.697 12.254 23.252 1.00 55.00 ? 52 LYS B CB 1 +ATOM 2152 C CG . LYS B 1 52 ? 8.345 13.470 22.369 1.00 56.44 ? 52 LYS B CG 1 +ATOM 2153 C CD . LYS B 1 52 ? 6.900 13.964 22.477 1.00 56.95 ? 52 LYS B CD 1 +ATOM 2154 C CE . LYS B 1 52 ? 6.789 15.485 22.276 1.00 59.77 ? 52 LYS B CE 1 +ATOM 2155 N NZ . LYS B 1 52 ? 7.314 15.949 21.001 1.00 55.59 ? 52 LYS B NZ 1 +ATOM 2156 N N . LEU B 1 53 ? 11.506 12.943 24.701 1.00 49.43 ? 53 LEU B N 1 +ATOM 2157 C CA . LEU B 1 53 ? 12.297 13.064 25.907 1.00 50.60 ? 53 LEU B CA 1 +ATOM 2158 C C . LEU B 1 53 ? 11.410 12.920 27.147 1.00 51.09 ? 53 LEU B C 1 +ATOM 2159 O O . LEU B 1 53 ? 10.550 13.771 27.406 1.00 53.91 ? 53 LEU B O 1 +ATOM 2160 C CB . LEU B 1 53 ? 13.005 14.437 25.861 1.00 46.87 ? 53 LEU B CB 1 +ATOM 2161 C CG . LEU B 1 53 ? 14.515 14.607 25.980 1.00 46.41 ? 53 LEU B CG 1 +ATOM 2162 C CD1 . LEU B 1 53 ? 14.801 15.214 27.311 1.00 42.37 ? 53 LEU B CD1 1 +ATOM 2163 C CD2 . LEU B 1 53 ? 15.246 13.289 25.828 1.00 46.94 ? 53 LEU B CD2 1 +ATOM 2164 N N . PRO B 1 54 ? 11.570 11.871 27.962 1.00 47.43 ? 54 PRO B N 1 +ATOM 2165 C CA . PRO B 1 54 ? 10.833 11.688 29.210 1.00 42.97 ? 54 PRO B CA 1 +ATOM 2166 C C . PRO B 1 54 ? 11.064 12.762 30.249 1.00 38.79 ? 54 PRO B C 1 +ATOM 2167 O O . PRO B 1 54 ? 10.321 12.864 31.224 1.00 41.16 ? 54 PRO B O 1 +ATOM 2168 C CB . PRO B 1 54 ? 11.242 10.329 29.713 1.00 43.53 ? 54 PRO B CB 1 +ATOM 2169 C CG . PRO B 1 54 ? 12.641 10.181 29.155 1.00 48.88 ? 54 PRO B CG 1 +ATOM 2170 C CD . PRO B 1 54 ? 12.520 10.782 27.754 1.00 47.24 ? 54 PRO B CD 1 +ATOM 2171 N N . VAL B 1 55 ? 12.118 13.557 30.060 1.00 35.42 ? 55 VAL B N 1 +ATOM 2172 C CA . VAL B 1 55 ? 12.439 14.665 30.960 1.00 33.11 ? 55 VAL B CA 1 +ATOM 2173 C C . VAL B 1 55 ? 12.428 15.981 30.199 1.00 28.65 ? 55 VAL B C 1 +ATOM 2174 O O . VAL B 1 55 ? 12.371 15.971 28.960 1.00 28.18 ? 55 VAL B O 1 +ATOM 2175 C CB . VAL B 1 55 ? 13.805 14.348 31.601 1.00 38.14 ? 55 VAL B CB 1 +ATOM 2176 C CG1 . VAL B 1 55 ? 13.626 13.137 32.517 1.00 29.48 ? 55 VAL B CG1 1 +ATOM 2177 C CG2 . VAL B 1 55 ? 14.860 13.986 30.566 1.00 36.58 ? 55 VAL B CG2 1 +ATOM 2178 N N . PRO B 1 56 ? 12.414 17.174 30.800 1.00 31.98 ? 56 PRO B N 1 +ATOM 2179 C CA . PRO B 1 56 ? 12.548 18.456 30.072 1.00 28.39 ? 56 PRO B CA 1 +ATOM 2180 C C . PRO B 1 56 ? 13.997 18.639 29.576 1.00 29.17 ? 56 PRO B C 1 +ATOM 2181 O O . PRO B 1 56 ? 14.967 18.411 30.306 1.00 21.79 ? 56 PRO B O 1 +ATOM 2182 C CB . PRO B 1 56 ? 12.165 19.490 31.067 1.00 22.07 ? 56 PRO B CB 1 +ATOM 2183 C CG . PRO B 1 56 ? 11.592 18.757 32.244 1.00 26.02 ? 56 PRO B CG 1 +ATOM 2184 C CD . PRO B 1 56 ? 12.321 17.432 32.230 1.00 31.15 ? 56 PRO B CD 1 +ATOM 2185 N N . TRP B 1 57 ? 14.153 19.040 28.319 1.00 29.36 ? 57 TRP B N 1 +ATOM 2186 C CA . TRP B 1 57 ? 15.446 19.260 27.725 1.00 32.51 ? 57 TRP B CA 1 +ATOM 2187 C C . TRP B 1 57 ? 16.390 20.080 28.604 1.00 34.87 ? 57 TRP B C 1 +ATOM 2188 O O . TRP B 1 57 ? 17.520 19.613 28.773 1.00 36.69 ? 57 TRP B O 1 +ATOM 2189 C CB . TRP B 1 57 ? 15.274 19.954 26.405 1.00 27.73 ? 57 TRP B CB 1 +ATOM 2190 C CG . TRP B 1 57 ? 14.950 19.041 25.269 1.00 24.00 ? 57 TRP B CG 1 +ATOM 2191 C CD1 . TRP B 1 57 ? 13.741 19.116 24.673 1.00 24.69 ? 57 TRP B CD1 1 +ATOM 2192 C CD2 . TRP B 1 57 ? 15.783 18.125 24.684 1.00 32.87 ? 57 TRP B CD2 1 +ATOM 2193 N NE1 . TRP B 1 57 ? 13.767 18.257 23.687 1.00 26.42 ? 57 TRP B NE1 1 +ATOM 2194 C CE2 . TRP B 1 57 ? 14.952 17.638 23.658 1.00 31.07 ? 57 TRP B CE2 1 +ATOM 2195 C CE3 . TRP B 1 57 ? 17.088 17.623 24.827 1.00 33.53 ? 57 TRP B CE3 1 +ATOM 2196 C CZ2 . TRP B 1 57 ? 15.406 16.647 22.783 1.00 30.16 ? 57 TRP B CZ2 1 +ATOM 2197 C CZ3 . TRP B 1 57 ? 17.534 16.631 23.940 1.00 30.45 ? 57 TRP B CZ3 1 +ATOM 2198 C CH2 . TRP B 1 57 ? 16.702 16.149 22.934 1.00 31.21 ? 57 TRP B CH2 1 +ATOM 2199 N N . PRO B 1 58 ? 15.983 21.207 29.239 1.00 33.66 ? 58 PRO B N 1 +ATOM 2200 C CA . PRO B 1 58 ? 16.759 21.955 30.222 1.00 34.03 ? 58 PRO B CA 1 +ATOM 2201 C C . PRO B 1 58 ? 17.548 21.207 31.274 1.00 35.31 ? 58 PRO B C 1 +ATOM 2202 O O . PRO B 1 58 ? 18.663 21.607 31.630 1.00 40.16 ? 58 PRO B O 1 +ATOM 2203 C CB . PRO B 1 58 ? 15.762 22.890 30.862 1.00 29.51 ? 58 PRO B CB 1 +ATOM 2204 C CG . PRO B 1 58 ? 14.959 23.290 29.667 1.00 26.04 ? 58 PRO B CG 1 +ATOM 2205 C CD . PRO B 1 58 ? 14.783 21.989 28.930 1.00 34.03 ? 58 PRO B CD 1 +ATOM 2206 N N . THR B 1 59 ? 16.969 20.109 31.769 1.00 33.08 ? 59 THR B N 1 +ATOM 2207 C CA . THR B 1 59 ? 17.578 19.333 32.830 1.00 29.43 ? 59 THR B CA 1 +ATOM 2208 C C . THR B 1 59 ? 18.848 18.660 32.324 1.00 29.14 ? 59 THR B C 1 +ATOM 2209 O O . THR B 1 59 ? 19.803 18.417 33.056 1.00 35.03 ? 59 THR B O 1 +ATOM 2210 C CB . THR B 1 59 ? 16.552 18.271 33.370 1.00 32.95 ? 59 THR B CB 1 +ATOM 2211 O OG1 . THR B 1 59 ? 16.082 17.486 32.282 1.00 28.05 ? 59 THR B OG1 1 +ATOM 2212 C CG2 . THR B 1 59 ? 15.355 18.914 34.025 1.00 33.42 ? 59 THR B CG2 1 +ATOM 2213 N N . LEU B 1 60 ? 18.892 18.446 31.019 1.00 28.00 ? 60 LEU B N 1 +ATOM 2214 C CA . LEU B 1 60 ? 20.001 17.785 30.352 1.00 27.88 ? 60 LEU B CA 1 +ATOM 2215 C C . LEU B 1 60 ? 21.164 18.654 29.821 1.00 25.48 ? 60 LEU B C 1 +ATOM 2216 O O . LEU B 1 60 ? 22.232 18.118 29.559 1.00 24.93 ? 60 LEU B O 1 +ATOM 2217 C CB . LEU B 1 60 ? 19.384 16.978 29.232 1.00 21.59 ? 60 LEU B CB 1 +ATOM 2218 C CG . LEU B 1 60 ? 18.378 15.871 29.473 1.00 10.63 ? 60 LEU B CG 1 +ATOM 2219 C CD1 . LEU B 1 60 ? 18.149 15.185 28.162 1.00 5.51 ? 60 LEU B CD1 1 +ATOM 2220 C CD2 . LEU B 1 60 ? 18.910 14.823 30.378 1.00 12.10 ? 60 LEU B CD2 1 +ATOM 2221 N N . VAL B 1 61 ? 21.035 19.979 29.690 1.00 25.42 ? 61 VAL B N 1 +ATOM 2222 C CA . VAL B 1 61 ? 22.040 20.916 29.155 1.00 23.70 ? 61 VAL B CA 1 +ATOM 2223 C C . VAL B 1 61 ? 23.425 20.713 29.703 1.00 22.67 ? 61 VAL B C 1 +ATOM 2224 O O . VAL B 1 61 ? 24.359 20.548 28.909 1.00 21.88 ? 61 VAL B O 1 +ATOM 2225 C CB . VAL B 1 61 ? 21.556 22.363 29.426 1.00 23.66 ? 61 VAL B CB 1 +ATOM 2226 C CG1 . VAL B 1 61 ? 22.519 23.447 29.008 1.00 23.32 ? 61 VAL B CG1 1 +ATOM 2227 C CG2 . VAL B 1 61 ? 20.288 22.514 28.597 1.00 29.40 ? 61 VAL B CG2 1 +ATOM 2228 N N . THR B 1 62 ? 23.490 20.674 31.037 1.00 17.99 ? 62 THR B N 1 +ATOM 2229 C CA . THR B 1 62 ? 24.703 20.364 31.739 1.00 22.00 ? 62 THR B CA 1 +ATOM 2230 C C . THR B 1 62 ? 25.328 19.002 31.429 1.00 28.14 ? 62 THR B C 1 +ATOM 2231 O O . THR B 1 62 ? 26.546 18.871 31.342 1.00 33.40 ? 62 THR B O 1 +ATOM 2232 C CB . THR B 1 62 ? 24.452 20.466 33.220 1.00 22.56 ? 62 THR B CB 1 +ATOM 2233 O OG1 . THR B 1 62 ? 23.261 19.772 33.550 1.00 34.74 ? 62 THR B OG1 1 +ATOM 2234 C CG2 . THR B 1 62 ? 24.274 21.889 33.613 1.00 33.17 ? 62 THR B CG2 1 +ATOM 2235 N N . THR B 1 63 ? 24.541 17.954 31.220 1.00 26.61 ? 63 THR B N 1 +ATOM 2236 C CA . THR B 1 63 ? 25.002 16.611 30.910 1.00 25.19 ? 63 THR B CA 1 +ATOM 2237 C C . THR B 1 63 ? 25.574 16.600 29.512 1.00 28.65 ? 63 THR B C 1 +ATOM 2238 O O . THR B 1 63 ? 26.610 16.000 29.240 1.00 32.13 ? 63 THR B O 1 +ATOM 2239 C CB . THR B 1 63 ? 23.768 15.669 31.083 1.00 19.04 ? 63 THR B CB 1 +ATOM 2240 O OG1 . THR B 1 63 ? 23.637 15.465 32.487 1.00 17.21 ? 63 THR B OG1 1 +ATOM 2241 C CG2 . THR B 1 63 ? 23.874 14.360 30.389 1.00 7.22 ? 63 THR B CG2 1 +ATOM 2242 N N . PHE B 1 64 ? 24.870 17.285 28.625 1.00 28.99 ? 64 PHE B N 1 +ATOM 2243 C CA . PHE B 1 64 ? 25.272 17.336 27.239 1.00 31.92 ? 64 PHE B CA 1 +ATOM 2244 C C . PHE B 1 64 ? 26.495 18.152 26.944 1.00 35.76 ? 64 PHE B C 1 +ATOM 2245 O O . PHE B 1 64 ? 27.222 17.968 25.974 1.00 32.10 ? 64 PHE B O 1 +ATOM 2246 C CB . PHE B 1 64 ? 24.187 17.914 26.432 1.00 33.31 ? 64 PHE B CB 1 +ATOM 2247 C CG . PHE B 1 64 ? 22.944 17.066 26.340 1.00 33.57 ? 64 PHE B CG 1 +ATOM 2248 C CD1 . PHE B 1 64 ? 23.021 15.678 26.429 1.00 23.69 ? 64 PHE B CD1 1 +ATOM 2249 C CD2 . PHE B 1 64 ? 21.728 17.727 26.105 1.00 34.02 ? 64 PHE B CD2 1 +ATOM 2250 C CE1 . PHE B 1 64 ? 21.866 14.952 26.269 1.00 23.86 ? 64 PHE B CE1 1 +ATOM 2251 C CE2 . PHE B 1 64 ? 20.579 16.982 25.946 1.00 30.02 ? 64 PHE B CE2 1 +ATOM 2252 C CZ . PHE B 1 64 ? 20.658 15.599 26.026 1.00 27.50 ? 64 PHE B CZ 1 +HETATM 2253 N N1 . CRO B 1 65 ? 26.546 19.131 27.840 1.00 43.33 ? 66 CRO B N1 1 +HETATM 2254 C CA1 . CRO B 1 65 ? 27.504 20.200 27.836 1.00 51.76 ? 66 CRO B CA1 1 +HETATM 2255 C CB1 . CRO B 1 65 ? 26.855 21.385 27.046 1.00 45.58 ? 66 CRO B CB1 1 +HETATM 2256 O OG1 . CRO B 1 65 ? 27.521 22.632 27.059 1.00 22.33 ? 66 CRO B OG1 1 +HETATM 2257 C C1 . CRO B 1 65 ? 27.920 20.584 29.250 1.00 37.17 ? 66 CRO B C1 1 +HETATM 2258 N N2 . CRO B 1 65 ? 27.398 21.668 29.900 1.00 33.44 ? 66 CRO B N2 1 +HETATM 2259 N N3 . CRO B 1 65 ? 28.818 19.852 29.939 1.00 28.52 ? 66 CRO B N3 1 +HETATM 2260 C C2 . CRO B 1 65 ? 29.019 20.395 31.121 1.00 33.44 ? 66 CRO B C2 1 +HETATM 2261 O O2 . CRO B 1 65 ? 29.791 19.989 31.981 1.00 30.86 ? 66 CRO B O2 1 +HETATM 2262 C CA2 . CRO B 1 65 ? 28.106 21.591 31.170 1.00 31.89 ? 66 CRO B CA2 1 +HETATM 2263 C CA3 . CRO B 1 65 ? 29.479 18.672 29.459 1.00 27.10 ? 66 CRO B CA3 1 +HETATM 2264 C C3 . CRO B 1 65 ? 30.848 18.930 28.937 1.00 30.34 ? 66 CRO B C3 1 +HETATM 2265 O O3 . CRO B 1 65 ? 31.856 18.941 29.655 1.00 39.86 ? 66 CRO B O3 1 +HETATM 2266 C CB2 . CRO B 1 65 ? 27.951 22.453 32.246 1.00 25.15 ? 66 CRO B CB2 1 +HETATM 2267 C CG2 . CRO B 1 65 ? 27.170 23.596 32.371 1.00 25.15 ? 66 CRO B CG2 1 +HETATM 2268 C CD1 . CRO B 1 65 ? 26.306 24.084 31.379 1.00 23.50 ? 66 CRO B CD1 1 +HETATM 2269 C CD2 . CRO B 1 65 ? 27.259 24.255 33.595 1.00 25.59 ? 66 CRO B CD2 1 +HETATM 2270 C CE1 . CRO B 1 65 ? 25.528 25.219 31.633 1.00 26.22 ? 66 CRO B CE1 1 +HETATM 2271 C CE2 . CRO B 1 65 ? 26.490 25.386 33.852 1.00 27.36 ? 66 CRO B CE2 1 +HETATM 2272 C CZ . CRO B 1 65 ? 25.641 25.869 32.866 1.00 26.03 ? 66 CRO B CZ 1 +HETATM 2273 O OH . CRO B 1 65 ? 24.892 26.986 33.172 1.00 31.81 ? 66 CRO B OH 1 +ATOM 2274 N N . VAL B 1 66 ? 30.864 19.077 27.629 1.00 26.74 ? 68 VAL B N 1 +ATOM 2275 C CA . VAL B 1 66 ? 32.059 19.480 26.902 1.00 20.45 ? 68 VAL B CA 1 +ATOM 2276 C C . VAL B 1 66 ? 32.699 20.847 27.353 1.00 18.71 ? 68 VAL B C 1 +ATOM 2277 O O . VAL B 1 66 ? 33.040 21.661 26.487 1.00 13.00 ? 68 VAL B O 1 +ATOM 2278 C CB . VAL B 1 66 ? 31.644 19.475 25.399 1.00 19.65 ? 68 VAL B CB 1 +ATOM 2279 C CG1 . VAL B 1 66 ? 31.250 18.103 25.014 1.00 16.28 ? 68 VAL B CG1 1 +ATOM 2280 C CG2 . VAL B 1 66 ? 30.395 20.279 25.123 1.00 17.72 ? 68 VAL B CG2 1 +ATOM 2281 N N . GLN B 1 67 ? 32.952 21.090 28.673 1.00 13.60 ? 69 GLN B N 1 +ATOM 2282 C CA . GLN B 1 67 ? 33.558 22.296 29.222 1.00 21.31 ? 69 GLN B CA 1 +ATOM 2283 C C . GLN B 1 67 ? 34.981 22.586 28.825 1.00 23.01 ? 69 GLN B C 1 +ATOM 2284 O O . GLN B 1 67 ? 35.538 23.596 29.240 1.00 25.10 ? 69 GLN B O 1 +ATOM 2285 C CB . GLN B 1 67 ? 33.547 22.294 30.739 1.00 27.96 ? 69 GLN B CB 1 +ATOM 2286 C CG . GLN B 1 67 ? 32.159 22.454 31.325 1.00 29.90 ? 69 GLN B CG 1 +ATOM 2287 C CD . GLN B 1 67 ? 32.069 21.967 32.773 1.00 41.10 ? 69 GLN B CD 1 +ATOM 2288 O OE1 . GLN B 1 67 ? 32.452 20.837 33.074 1.00 46.10 ? 69 GLN B OE1 1 +ATOM 2289 N NE2 . GLN B 1 67 ? 31.560 22.739 33.737 1.00 42.87 ? 69 GLN B NE2 1 +ATOM 2290 N N . CYS B 1 68 ? 35.588 21.686 28.048 1.00 25.65 ? 70 CYS B N 1 +ATOM 2291 C CA . CYS B 1 68 ? 36.878 21.867 27.387 1.00 26.18 ? 70 CYS B CA 1 +ATOM 2292 C C . CYS B 1 68 ? 36.772 22.880 26.246 1.00 25.22 ? 70 CYS B C 1 +ATOM 2293 O O . CYS B 1 68 ? 37.699 23.037 25.464 1.00 27.68 ? 70 CYS B O 1 +ATOM 2294 C CB . CYS B 1 68 ? 37.289 20.522 26.847 1.00 28.26 ? 70 CYS B CB 1 +ATOM 2295 S SG . CYS B 1 68 ? 35.988 19.931 25.755 1.00 37.60 ? 70 CYS B SG 1 +ATOM 2296 N N . PHE B 1 69 ? 35.574 23.471 26.055 1.00 19.96 ? 71 PHE B N 1 +ATOM 2297 C CA . PHE B 1 69 ? 35.301 24.439 25.035 1.00 13.89 ? 71 PHE B CA 1 +ATOM 2298 C C . PHE B 1 69 ? 35.101 25.794 25.650 1.00 17.55 ? 71 PHE B C 1 +ATOM 2299 O O . PHE B 1 69 ? 34.780 26.732 24.939 1.00 21.00 ? 71 PHE B O 1 +ATOM 2300 C CB . PHE B 1 69 ? 34.087 24.103 24.280 1.00 16.75 ? 71 PHE B CB 1 +ATOM 2301 C CG . PHE B 1 69 ? 34.365 23.092 23.192 1.00 13.96 ? 71 PHE B CG 1 +ATOM 2302 C CD1 . PHE B 1 69 ? 35.169 23.423 22.108 1.00 8.81 ? 71 PHE B CD1 1 +ATOM 2303 C CD2 . PHE B 1 69 ? 33.832 21.830 23.314 1.00 18.80 ? 71 PHE B CD2 1 +ATOM 2304 C CE1 . PHE B 1 69 ? 35.444 22.482 21.148 1.00 20.09 ? 71 PHE B CE1 1 +ATOM 2305 C CE2 . PHE B 1 69 ? 34.115 20.884 22.334 1.00 21.39 ? 71 PHE B CE2 1 +ATOM 2306 C CZ . PHE B 1 69 ? 34.915 21.194 21.255 1.00 17.90 ? 71 PHE B CZ 1 +ATOM 2307 N N . SER B 1 70 ? 35.329 25.896 26.962 1.00 12.70 ? 72 SER B N 1 +ATOM 2308 C CA . SER B 1 70 ? 35.354 27.159 27.663 1.00 19.63 ? 72 SER B CA 1 +ATOM 2309 C C . SER B 1 70 ? 36.517 27.993 27.163 1.00 24.67 ? 72 SER B C 1 +ATOM 2310 O O . SER B 1 70 ? 37.535 27.496 26.668 1.00 25.42 ? 72 SER B O 1 +ATOM 2311 C CB . SER B 1 70 ? 35.567 26.966 29.150 1.00 20.78 ? 72 SER B CB 1 +ATOM 2312 O OG . SER B 1 70 ? 34.680 25.976 29.628 1.00 23.74 ? 72 SER B OG 1 +ATOM 2313 N N . ARG B 1 71 ? 36.299 29.296 27.260 1.00 29.43 ? 73 ARG B N 1 +ATOM 2314 C CA . ARG B 1 71 ? 37.357 30.254 27.022 1.00 28.81 ? 73 ARG B CA 1 +ATOM 2315 C C . ARG B 1 71 ? 37.933 30.569 28.410 1.00 26.32 ? 73 ARG B C 1 +ATOM 2316 O O . ARG B 1 71 ? 37.268 30.998 29.366 1.00 22.00 ? 73 ARG B O 1 +ATOM 2317 C CB . ARG B 1 71 ? 36.800 31.497 26.382 1.00 32.05 ? 73 ARG B CB 1 +ATOM 2318 C CG . ARG B 1 71 ? 37.858 32.543 26.155 1.00 42.35 ? 73 ARG B CG 1 +ATOM 2319 C CD . ARG B 1 71 ? 37.338 33.881 25.680 1.00 44.21 ? 73 ARG B CD 1 +ATOM 2320 N NE . ARG B 1 71 ? 38.406 34.808 25.981 1.00 51.15 ? 73 ARG B NE 1 +ATOM 2321 C CZ . ARG B 1 71 ? 38.284 35.696 26.973 1.00 54.60 ? 73 ARG B CZ 1 +ATOM 2322 N NH1 . ARG B 1 71 ? 37.164 35.778 27.709 1.00 58.52 ? 73 ARG B NH1 1 +ATOM 2323 N NH2 . ARG B 1 71 ? 39.329 36.451 27.291 1.00 53.70 ? 73 ARG B NH2 1 +ATOM 2324 N N . TYR B 1 72 ? 39.215 30.181 28.480 1.00 23.85 ? 74 TYR B N 1 +ATOM 2325 C CA . TYR B 1 72 ? 40.060 30.450 29.616 1.00 26.90 ? 74 TYR B CA 1 +ATOM 2326 C C . TYR B 1 72 ? 40.875 31.645 29.170 1.00 33.69 ? 74 TYR B C 1 +ATOM 2327 O O . TYR B 1 72 ? 41.557 31.585 28.138 1.00 42.58 ? 74 TYR B O 1 +ATOM 2328 C CB . TYR B 1 72 ? 40.979 29.265 29.912 1.00 27.69 ? 74 TYR B CB 1 +ATOM 2329 C CG . TYR B 1 72 ? 40.388 28.309 30.927 1.00 23.56 ? 74 TYR B CG 1 +ATOM 2330 C CD1 . TYR B 1 72 ? 39.339 27.480 30.551 1.00 19.55 ? 74 TYR B CD1 1 +ATOM 2331 C CD2 . TYR B 1 72 ? 40.891 28.286 32.236 1.00 22.94 ? 74 TYR B CD2 1 +ATOM 2332 C CE1 . TYR B 1 72 ? 38.780 26.610 31.487 1.00 25.40 ? 74 TYR B CE1 1 +ATOM 2333 C CE2 . TYR B 1 72 ? 40.342 27.430 33.179 1.00 18.67 ? 74 TYR B CE2 1 +ATOM 2334 C CZ . TYR B 1 72 ? 39.284 26.587 32.781 1.00 29.99 ? 74 TYR B CZ 1 +ATOM 2335 O OH . TYR B 1 72 ? 38.736 25.668 33.661 1.00 41.34 ? 74 TYR B OH 1 +ATOM 2336 N N . PRO B 1 73 ? 40.796 32.756 29.883 1.00 33.45 ? 75 PRO B N 1 +ATOM 2337 C CA . PRO B 1 73 ? 41.615 33.924 29.635 1.00 38.69 ? 75 PRO B CA 1 +ATOM 2338 C C . PRO B 1 73 ? 43.105 33.576 29.683 1.00 38.61 ? 75 PRO B C 1 +ATOM 2339 O O . PRO B 1 73 ? 43.491 32.606 30.369 1.00 37.65 ? 75 PRO B O 1 +ATOM 2340 C CB . PRO B 1 73 ? 41.119 34.881 30.718 1.00 36.97 ? 75 PRO B CB 1 +ATOM 2341 C CG . PRO B 1 73 ? 39.674 34.518 30.870 1.00 36.73 ? 75 PRO B CG 1 +ATOM 2342 C CD . PRO B 1 73 ? 39.807 33.014 30.919 1.00 36.26 ? 75 PRO B CD 1 +ATOM 2343 N N . ASP B 1 74 ? 43.890 34.369 28.916 1.00 36.85 ? 76 ASP B N 1 +ATOM 2344 C CA . ASP B 1 74 ? 45.360 34.263 28.818 1.00 36.70 ? 76 ASP B CA 1 +ATOM 2345 C C . ASP B 1 74 ? 46.211 34.280 30.079 1.00 38.70 ? 76 ASP B C 1 +ATOM 2346 O O . ASP B 1 74 ? 47.429 34.066 30.008 1.00 43.93 ? 76 ASP B O 1 +ATOM 2347 C CB . ASP B 1 74 ? 45.930 35.357 27.934 1.00 31.30 ? 76 ASP B CB 1 +ATOM 2348 C CG . ASP B 1 74 ? 46.037 34.952 26.465 1.00 36.70 ? 76 ASP B CG 1 +ATOM 2349 O OD1 . ASP B 1 74 ? 46.118 33.748 26.168 1.00 36.57 ? 76 ASP B OD1 1 +ATOM 2350 O OD2 . ASP B 1 74 ? 46.065 35.848 25.606 1.00 31.73 ? 76 ASP B OD2 1 +ATOM 2351 N N . HIS B 1 75 ? 45.601 34.530 31.242 1.00 36.67 ? 77 HIS B N 1 +ATOM 2352 C CA . HIS B 1 75 ? 46.293 34.539 32.522 1.00 35.93 ? 77 HIS B CA 1 +ATOM 2353 C C . HIS B 1 75 ? 45.917 33.410 33.462 1.00 39.32 ? 77 HIS B C 1 +ATOM 2354 O O . HIS B 1 75 ? 46.438 33.258 34.571 1.00 36.64 ? 77 HIS B O 1 +ATOM 2355 C CB . HIS B 1 75 ? 46.027 35.838 33.198 1.00 34.27 ? 77 HIS B CB 1 +ATOM 2356 C CG . HIS B 1 75 ? 44.549 36.125 33.360 1.00 37.97 ? 77 HIS B CG 1 +ATOM 2357 N ND1 . HIS B 1 75 ? 43.752 36.723 32.470 1.00 31.35 ? 77 HIS B ND1 1 +ATOM 2358 C CD2 . HIS B 1 75 ? 43.875 35.846 34.527 1.00 34.87 ? 77 HIS B CD2 1 +ATOM 2359 C CE1 . HIS B 1 75 ? 42.622 36.817 33.115 1.00 38.94 ? 77 HIS B CE1 1 +ATOM 2360 N NE2 . HIS B 1 75 ? 42.688 36.300 34.331 1.00 34.76 ? 77 HIS B NE2 1 +ATOM 2361 N N . MET B 1 76 ? 44.904 32.663 33.023 1.00 43.81 ? 78 MET B N 1 +ATOM 2362 C CA . MET B 1 76 ? 44.515 31.468 33.730 1.00 42.68 ? 78 MET B CA 1 +ATOM 2363 C C . MET B 1 76 ? 44.449 30.246 32.837 1.00 40.51 ? 78 MET B C 1 +ATOM 2364 O O . MET B 1 76 ? 43.819 29.281 33.239 1.00 43.06 ? 78 MET B O 1 +ATOM 2365 C CB . MET B 1 76 ? 43.183 31.720 34.421 1.00 48.47 ? 78 MET B CB 1 +ATOM 2366 C CG . MET B 1 76 ? 42.028 32.297 33.612 1.00 53.64 ? 78 MET B CG 1 +ATOM 2367 S SD . MET B 1 76 ? 40.703 32.833 34.721 1.00 54.32 ? 78 MET B SD 1 +ATOM 2368 C CE . MET B 1 76 ? 40.499 31.250 35.490 1.00 47.45 ? 78 MET B CE 1 +ATOM 2369 N N . LYS B 1 77 ? 45.138 30.231 31.678 1.00 38.62 ? 79 LYS B N 1 +ATOM 2370 C CA . LYS B 1 77 ? 45.250 29.054 30.829 1.00 37.93 ? 79 LYS B CA 1 +ATOM 2371 C C . LYS B 1 77 ? 46.000 27.828 31.407 1.00 41.92 ? 79 LYS B C 1 +ATOM 2372 O O . LYS B 1 77 ? 46.001 26.727 30.840 1.00 41.76 ? 79 LYS B O 1 +ATOM 2373 C CB . LYS B 1 77 ? 45.888 29.488 29.509 1.00 35.34 ? 79 LYS B CB 1 +ATOM 2374 C CG . LYS B 1 77 ? 44.915 30.139 28.532 1.00 32.84 ? 79 LYS B CG 1 +ATOM 2375 C CD . LYS B 1 77 ? 45.271 29.822 27.086 1.00 29.90 ? 79 LYS B CD 1 +ATOM 2376 C CE . LYS B 1 77 ? 44.468 30.619 26.022 1.00 28.61 ? 79 LYS B CE 1 +ATOM 2377 N NZ . LYS B 1 77 ? 43.037 30.399 26.097 1.00 27.74 ? 79 LYS B NZ 1 +ATOM 2378 N N . GLN B 1 78 ? 46.615 28.083 32.569 1.00 44.51 ? 80 GLN B N 1 +ATOM 2379 C CA . GLN B 1 78 ? 47.363 27.222 33.484 1.00 48.19 ? 80 GLN B CA 1 +ATOM 2380 C C . GLN B 1 78 ? 46.378 26.367 34.314 1.00 48.33 ? 80 GLN B C 1 +ATOM 2381 O O . GLN B 1 78 ? 46.676 25.279 34.811 1.00 47.13 ? 80 GLN B O 1 +ATOM 2382 C CB . GLN B 1 78 ? 48.207 28.159 34.392 1.00 49.02 ? 80 GLN B CB 1 +ATOM 2383 C CG . GLN B 1 78 ? 49.211 27.589 35.421 1.00 55.48 ? 80 GLN B CG 1 +ATOM 2384 C CD . GLN B 1 78 ? 49.343 28.382 36.740 1.00 57.49 ? 80 GLN B CD 1 +ATOM 2385 O OE1 . GLN B 1 78 ? 49.313 27.815 37.843 1.00 51.59 ? 80 GLN B OE1 1 +ATOM 2386 N NE2 . GLN B 1 78 ? 49.483 29.708 36.688 1.00 55.15 ? 80 GLN B NE2 1 +ATOM 2387 N N . HIS B 1 79 ? 45.161 26.892 34.461 1.00 50.16 ? 81 HIS B N 1 +ATOM 2388 C CA . HIS B 1 79 ? 44.082 26.289 35.236 1.00 48.35 ? 81 HIS B CA 1 +ATOM 2389 C C . HIS B 1 79 ? 43.101 25.476 34.411 1.00 45.60 ? 81 HIS B C 1 +ATOM 2390 O O . HIS B 1 79 ? 42.110 24.959 34.927 1.00 46.31 ? 81 HIS B O 1 +ATOM 2391 C CB . HIS B 1 79 ? 43.354 27.402 35.957 1.00 51.57 ? 81 HIS B CB 1 +ATOM 2392 C CG . HIS B 1 79 ? 44.332 28.203 36.790 1.00 60.92 ? 81 HIS B CG 1 +ATOM 2393 N ND1 . HIS B 1 79 ? 44.755 29.440 36.547 1.00 63.33 ? 81 HIS B ND1 1 +ATOM 2394 C CD2 . HIS B 1 79 ? 44.959 27.727 37.912 1.00 60.90 ? 81 HIS B CD2 1 +ATOM 2395 C CE1 . HIS B 1 79 ? 45.620 29.726 37.487 1.00 64.53 ? 81 HIS B CE1 1 +ATOM 2396 N NE2 . HIS B 1 79 ? 45.735 28.697 38.300 1.00 66.38 ? 81 HIS B NE2 1 +ATOM 2397 N N . ASP B 1 80 ? 43.374 25.376 33.103 1.00 43.77 ? 82 ASP B N 1 +ATOM 2398 C CA . ASP B 1 80 ? 42.511 24.660 32.192 1.00 37.82 ? 82 ASP B CA 1 +ATOM 2399 C C . ASP B 1 80 ? 42.811 23.183 32.092 1.00 33.65 ? 82 ASP B C 1 +ATOM 2400 O O . ASP B 1 80 ? 43.479 22.687 31.178 1.00 28.19 ? 82 ASP B O 1 +ATOM 2401 C CB . ASP B 1 80 ? 42.590 25.292 30.796 1.00 39.53 ? 82 ASP B CB 1 +ATOM 2402 C CG . ASP B 1 80 ? 41.532 24.820 29.782 1.00 43.49 ? 82 ASP B CG 1 +ATOM 2403 O OD1 . ASP B 1 80 ? 40.655 23.985 30.058 1.00 42.20 ? 82 ASP B OD1 1 +ATOM 2404 O OD2 . ASP B 1 80 ? 41.594 25.327 28.673 1.00 46.29 ? 82 ASP B OD2 1 +ATOM 2405 N N . PHE B 1 81 ? 42.162 22.529 33.055 1.00 33.18 ? 83 PHE B N 1 +ATOM 2406 C CA . PHE B 1 81 ? 42.175 21.087 33.165 1.00 35.22 ? 83 PHE B CA 1 +ATOM 2407 C C . PHE B 1 81 ? 41.599 20.445 31.924 1.00 34.20 ? 83 PHE B C 1 +ATOM 2408 O O . PHE B 1 81 ? 42.199 19.552 31.345 1.00 39.35 ? 83 PHE B O 1 +ATOM 2409 C CB . PHE B 1 81 ? 41.355 20.644 34.386 1.00 39.35 ? 83 PHE B CB 1 +ATOM 2410 C CG . PHE B 1 81 ? 41.092 19.142 34.414 1.00 39.53 ? 83 PHE B CG 1 +ATOM 2411 C CD1 . PHE B 1 81 ? 42.093 18.249 34.797 1.00 39.79 ? 83 PHE B CD1 1 +ATOM 2412 C CD2 . PHE B 1 81 ? 39.860 18.662 33.966 1.00 40.84 ? 83 PHE B CD2 1 +ATOM 2413 C CE1 . PHE B 1 81 ? 41.852 16.876 34.716 1.00 38.39 ? 83 PHE B CE1 1 +ATOM 2414 C CE2 . PHE B 1 81 ? 39.633 17.296 33.892 1.00 41.12 ? 83 PHE B CE2 1 +ATOM 2415 C CZ . PHE B 1 81 ? 40.624 16.400 34.262 1.00 34.40 ? 83 PHE B CZ 1 +ATOM 2416 N N . PHE B 1 82 ? 40.432 20.921 31.515 1.00 32.15 ? 84 PHE B N 1 +ATOM 2417 C CA . PHE B 1 82 ? 39.650 20.302 30.463 1.00 31.23 ? 84 PHE B CA 1 +ATOM 2418 C C . PHE B 1 82 ? 40.356 20.046 29.169 1.00 28.57 ? 84 PHE B C 1 +ATOM 2419 O O . PHE B 1 82 ? 40.383 18.900 28.725 1.00 34.98 ? 84 PHE B O 1 +ATOM 2420 C CB . PHE B 1 82 ? 38.422 21.162 30.232 1.00 31.90 ? 84 PHE B CB 1 +ATOM 2421 C CG . PHE B 1 82 ? 37.582 21.324 31.486 1.00 31.17 ? 84 PHE B CG 1 +ATOM 2422 C CD1 . PHE B 1 82 ? 36.828 20.245 31.978 1.00 28.42 ? 84 PHE B CD1 1 +ATOM 2423 C CD2 . PHE B 1 82 ? 37.537 22.579 32.114 1.00 33.96 ? 84 PHE B CD2 1 +ATOM 2424 C CE1 . PHE B 1 82 ? 36.021 20.430 33.100 1.00 31.95 ? 84 PHE B CE1 1 +ATOM 2425 C CE2 . PHE B 1 82 ? 36.720 22.747 33.240 1.00 35.76 ? 84 PHE B CE2 1 +ATOM 2426 C CZ . PHE B 1 82 ? 35.961 21.681 33.731 1.00 33.22 ? 84 PHE B CZ 1 +ATOM 2427 N N . LYS B 1 83 ? 40.974 21.082 28.601 1.00 27.03 ? 85 LYS B N 1 +ATOM 2428 C CA . LYS B 1 83 ? 41.743 20.911 27.384 1.00 28.65 ? 85 LYS B CA 1 +ATOM 2429 C C . LYS B 1 83 ? 43.070 20.190 27.581 1.00 32.51 ? 85 LYS B C 1 +ATOM 2430 O O . LYS B 1 83 ? 43.583 19.553 26.645 1.00 40.68 ? 85 LYS B O 1 +ATOM 2431 C CB . LYS B 1 83 ? 42.075 22.224 26.770 1.00 26.58 ? 85 LYS B CB 1 +ATOM 2432 C CG . LYS B 1 83 ? 40.846 22.996 26.453 1.00 19.50 ? 85 LYS B CG 1 +ATOM 2433 C CD . LYS B 1 83 ? 41.219 24.257 25.704 1.00 17.31 ? 85 LYS B CD 1 +ATOM 2434 C CE . LYS B 1 83 ? 40.006 25.133 25.611 1.00 12.39 ? 85 LYS B CE 1 +ATOM 2435 N NZ . LYS B 1 83 ? 39.417 25.277 26.932 1.00 17.19 ? 85 LYS B NZ 1 +ATOM 2436 N N . SER B 1 84 ? 43.647 20.291 28.792 1.00 30.83 ? 86 SER B N 1 +ATOM 2437 C CA . SER B 1 84 ? 44.931 19.673 29.093 1.00 31.08 ? 86 SER B CA 1 +ATOM 2438 C C . SER B 1 84 ? 44.864 18.174 29.033 1.00 31.02 ? 86 SER B C 1 +ATOM 2439 O O . SER B 1 84 ? 45.796 17.494 28.637 1.00 31.71 ? 86 SER B O 1 +ATOM 2440 C CB . SER B 1 84 ? 45.405 20.045 30.469 1.00 30.65 ? 86 SER B CB 1 +ATOM 2441 O OG . SER B 1 84 ? 44.794 19.343 31.526 1.00 29.32 ? 86 SER B OG 1 +ATOM 2442 N N . ALA B 1 85 ? 43.683 17.699 29.436 1.00 37.04 ? 87 ALA B N 1 +ATOM 2443 C CA . ALA B 1 85 ? 43.303 16.296 29.453 1.00 31.61 ? 87 ALA B CA 1 +ATOM 2444 C C . ALA B 1 85 ? 43.047 15.703 28.071 1.00 30.07 ? 87 ALA B C 1 +ATOM 2445 O O . ALA B 1 85 ? 42.797 14.513 27.935 1.00 26.30 ? 87 ALA B O 1 +ATOM 2446 C CB . ALA B 1 85 ? 42.073 16.178 30.300 1.00 34.16 ? 87 ALA B CB 1 +ATOM 2447 N N . MET B 1 86 ? 43.159 16.492 26.999 1.00 28.51 ? 88 MET B N 1 +ATOM 2448 C CA . MET B 1 86 ? 42.876 16.034 25.642 1.00 23.95 ? 88 MET B CA 1 +ATOM 2449 C C . MET B 1 86 ? 44.104 15.642 24.842 1.00 23.79 ? 88 MET B C 1 +ATOM 2450 O O . MET B 1 86 ? 45.173 16.087 25.252 1.00 19.23 ? 88 MET B O 1 +ATOM 2451 C CB . MET B 1 86 ? 42.166 17.144 24.914 1.00 29.60 ? 88 MET B CB 1 +ATOM 2452 C CG . MET B 1 86 ? 40.787 17.445 25.402 1.00 25.25 ? 88 MET B CG 1 +ATOM 2453 S SD . MET B 1 86 ? 39.683 16.118 24.944 1.00 24.37 ? 88 MET B SD 1 +ATOM 2454 C CE . MET B 1 86 ? 38.572 16.478 26.287 1.00 11.84 ? 88 MET B CE 1 +ATOM 2455 N N . PRO B 1 87 ? 44.086 14.912 23.696 1.00 19.95 ? 89 PRO B N 1 +ATOM 2456 C CA . PRO B 1 87 ? 42.947 14.265 23.084 1.00 23.04 ? 89 PRO B CA 1 +ATOM 2457 C C . PRO B 1 87 ? 42.403 12.980 23.713 1.00 29.37 ? 89 PRO B C 1 +ATOM 2458 O O . PRO B 1 87 ? 41.419 12.427 23.231 1.00 36.21 ? 89 PRO B O 1 +ATOM 2459 C CB . PRO B 1 87 ? 43.407 14.078 21.675 1.00 27.44 ? 89 PRO B CB 1 +ATOM 2460 C CG . PRO B 1 87 ? 44.865 13.707 21.816 1.00 27.01 ? 89 PRO B CG 1 +ATOM 2461 C CD . PRO B 1 87 ? 45.293 14.646 22.923 1.00 20.65 ? 89 PRO B CD 1 +ATOM 2462 N N . GLU B 1 88 ? 43.007 12.466 24.785 1.00 32.88 ? 90 GLU B N 1 +ATOM 2463 C CA . GLU B 1 88 ? 42.542 11.246 25.403 1.00 39.29 ? 90 GLU B CA 1 +ATOM 2464 C C . GLU B 1 88 ? 41.238 11.513 26.119 1.00 41.94 ? 90 GLU B C 1 +ATOM 2465 O O . GLU B 1 88 ? 40.304 10.715 26.063 1.00 43.31 ? 90 GLU B O 1 +ATOM 2466 C CB . GLU B 1 88 ? 43.598 10.739 26.357 1.00 43.38 ? 90 GLU B CB 1 +ATOM 2467 C CG . GLU B 1 88 ? 44.908 10.307 25.681 1.00 49.48 ? 90 GLU B CG 1 +ATOM 2468 C CD . GLU B 1 88 ? 46.037 11.281 26.005 1.00 56.01 ? 90 GLU B CD 1 +ATOM 2469 O OE1 . GLU B 1 88 ? 46.548 11.260 27.136 1.00 55.38 ? 90 GLU B OE1 1 +ATOM 2470 O OE2 . GLU B 1 88 ? 46.383 12.070 25.124 1.00 54.00 ? 90 GLU B OE2 1 +ATOM 2471 N N . GLY B 1 89 ? 41.196 12.655 26.791 1.00 43.22 ? 91 GLY B N 1 +ATOM 2472 C CA . GLY B 1 89 ? 39.975 13.103 27.405 1.00 41.03 ? 91 GLY B CA 1 +ATOM 2473 C C . GLY B 1 89 ? 39.925 12.993 28.899 1.00 39.48 ? 91 GLY B C 1 +ATOM 2474 O O . GLY B 1 89 ? 40.907 12.817 29.612 1.00 39.50 ? 91 GLY B O 1 +ATOM 2475 N N . TYR B 1 90 ? 38.688 13.188 29.328 1.00 38.73 ? 92 TYR B N 1 +ATOM 2476 C CA . TYR B 1 90 ? 38.373 13.024 30.721 1.00 38.05 ? 92 TYR B CA 1 +ATOM 2477 C C . TYR B 1 90 ? 37.004 12.387 30.869 1.00 37.69 ? 92 TYR B C 1 +ATOM 2478 O O . TYR B 1 90 ? 36.233 12.224 29.929 1.00 41.01 ? 92 TYR B O 1 +ATOM 2479 C CB . TYR B 1 90 ? 38.440 14.381 31.425 1.00 38.96 ? 92 TYR B CB 1 +ATOM 2480 C CG . TYR B 1 90 ? 37.579 15.478 30.833 1.00 39.87 ? 92 TYR B CG 1 +ATOM 2481 C CD1 . TYR B 1 90 ? 36.237 15.575 31.200 1.00 40.55 ? 92 TYR B CD1 1 +ATOM 2482 C CD2 . TYR B 1 90 ? 38.143 16.394 29.950 1.00 39.72 ? 92 TYR B CD2 1 +ATOM 2483 C CE1 . TYR B 1 90 ? 35.453 16.598 30.680 1.00 40.65 ? 92 TYR B CE1 1 +ATOM 2484 C CE2 . TYR B 1 90 ? 37.357 17.414 29.432 1.00 40.33 ? 92 TYR B CE2 1 +ATOM 2485 C CZ . TYR B 1 90 ? 36.016 17.513 29.800 1.00 41.52 ? 92 TYR B CZ 1 +ATOM 2486 O OH . TYR B 1 90 ? 35.229 18.515 29.282 1.00 37.88 ? 92 TYR B OH 1 +ATOM 2487 N N . VAL B 1 91 ? 36.754 11.970 32.098 1.00 37.67 ? 93 VAL B N 1 +ATOM 2488 C CA . VAL B 1 91 ? 35.535 11.332 32.505 1.00 34.15 ? 93 VAL B CA 1 +ATOM 2489 C C . VAL B 1 91 ? 34.885 12.343 33.410 1.00 32.70 ? 93 VAL B C 1 +ATOM 2490 O O . VAL B 1 91 ? 35.461 12.807 34.387 1.00 32.45 ? 93 VAL B O 1 +ATOM 2491 C CB . VAL B 1 91 ? 35.868 10.023 33.234 1.00 36.10 ? 93 VAL B CB 1 +ATOM 2492 C CG1 . VAL B 1 91 ? 34.688 9.426 33.999 1.00 34.46 ? 93 VAL B CG1 1 +ATOM 2493 C CG2 . VAL B 1 91 ? 36.233 9.012 32.150 1.00 39.69 ? 93 VAL B CG2 1 +ATOM 2494 N N . GLN B 1 92 ? 33.672 12.727 33.026 1.00 35.05 ? 94 GLN B N 1 +ATOM 2495 C CA . GLN B 1 92 ? 32.906 13.668 33.817 1.00 33.84 ? 94 GLN B CA 1 +ATOM 2496 C C . GLN B 1 92 ? 31.777 12.883 34.450 1.00 32.35 ? 94 GLN B C 1 +ATOM 2497 O O . GLN B 1 92 ? 30.998 12.214 33.781 1.00 34.46 ? 94 GLN B O 1 +ATOM 2498 C CB . GLN B 1 92 ? 32.405 14.794 32.890 1.00 29.81 ? 94 GLN B CB 1 +ATOM 2499 C CG . GLN B 1 92 ? 31.519 15.829 33.578 1.00 29.74 ? 94 GLN B CG 1 +ATOM 2500 C CD . GLN B 1 92 ? 31.299 17.069 32.724 1.00 34.76 ? 94 GLN B CD 1 +ATOM 2501 O OE1 . GLN B 1 92 ? 32.214 17.663 32.139 1.00 30.16 ? 94 GLN B OE1 1 +ATOM 2502 N NE2 . GLN B 1 92 ? 30.055 17.516 32.612 1.00 37.21 ? 94 GLN B NE2 1 +ATOM 2503 N N . GLU B 1 93 ? 31.741 12.933 35.779 1.00 36.47 ? 95 GLU B N 1 +ATOM 2504 C CA . GLU B 1 93 ? 30.682 12.309 36.558 1.00 39.18 ? 95 GLU B CA 1 +ATOM 2505 C C . GLU B 1 93 ? 29.886 13.355 37.325 1.00 40.86 ? 95 GLU B C 1 +ATOM 2506 O O . GLU B 1 93 ? 30.431 14.279 37.937 1.00 45.33 ? 95 GLU B O 1 +ATOM 2507 C CB . GLU B 1 93 ? 31.254 11.295 37.565 1.00 41.71 ? 95 GLU B CB 1 +ATOM 2508 C CG . GLU B 1 93 ? 31.969 10.104 36.897 1.00 45.54 ? 95 GLU B CG 1 +ATOM 2509 C CD . GLU B 1 93 ? 32.413 8.949 37.811 1.00 50.16 ? 95 GLU B CD 1 +ATOM 2510 O OE1 . GLU B 1 93 ? 33.366 9.126 38.574 1.00 47.10 ? 95 GLU B OE1 1 +ATOM 2511 O OE2 . GLU B 1 93 ? 31.811 7.868 37.751 1.00 50.47 ? 95 GLU B OE2 1 +ATOM 2512 N N . ARG B 1 94 ? 28.559 13.244 37.274 1.00 41.72 ? 96 ARG B N 1 +ATOM 2513 C CA . ARG B 1 94 ? 27.715 14.139 38.042 1.00 41.17 ? 96 ARG B CA 1 +ATOM 2514 C C . ARG B 1 94 ? 26.595 13.454 38.772 1.00 38.98 ? 96 ARG B C 1 +ATOM 2515 O O . ARG B 1 94 ? 26.128 12.384 38.415 1.00 38.01 ? 96 ARG B O 1 +ATOM 2516 C CB . ARG B 1 94 ? 27.022 15.206 37.199 1.00 42.46 ? 96 ARG B CB 1 +ATOM 2517 C CG . ARG B 1 94 ? 27.911 16.219 36.525 1.00 41.77 ? 96 ARG B CG 1 +ATOM 2518 C CD . ARG B 1 94 ? 27.253 17.551 36.814 1.00 41.58 ? 96 ARG B CD 1 +ATOM 2519 N NE . ARG B 1 94 ? 27.942 18.691 36.233 1.00 36.34 ? 96 ARG B NE 1 +ATOM 2520 C CZ . ARG B 1 94 ? 28.059 18.860 34.913 1.00 33.34 ? 96 ARG B CZ 1 +ATOM 2521 N NH1 . ARG B 1 94 ? 27.572 18.008 34.034 1.00 30.34 ? 96 ARG B NH1 1 +ATOM 2522 N NH2 . ARG B 1 94 ? 28.651 19.938 34.444 1.00 38.03 ? 96 ARG B NH2 1 +ATOM 2523 N N . THR B 1 95 ? 26.213 14.143 39.842 1.00 42.47 ? 97 THR B N 1 +ATOM 2524 C CA . THR B 1 95 ? 25.036 13.814 40.597 1.00 43.89 ? 97 THR B CA 1 +ATOM 2525 C C . THR B 1 95 ? 24.324 15.157 40.634 1.00 44.28 ? 97 THR B C 1 +ATOM 2526 O O . THR B 1 95 ? 24.733 16.119 41.277 1.00 44.66 ? 97 THR B O 1 +ATOM 2527 C CB . THR B 1 95 ? 25.394 13.309 42.005 1.00 46.25 ? 97 THR B CB 1 +ATOM 2528 O OG1 . THR B 1 95 ? 26.171 12.120 41.800 1.00 42.55 ? 97 THR B OG1 1 +ATOM 2529 C CG2 . THR B 1 95 ? 24.149 13.028 42.886 1.00 46.93 ? 97 THR B CG2 1 +ATOM 2530 N N . ILE B 1 96 ? 23.310 15.221 39.763 1.00 43.99 ? 98 ILE B N 1 +ATOM 2531 C CA . ILE B 1 96 ? 22.449 16.381 39.605 1.00 42.32 ? 98 ILE B CA 1 +ATOM 2532 C C . ILE B 1 96 ? 21.244 16.135 40.498 1.00 43.33 ? 98 ILE B C 1 +ATOM 2533 O O . ILE B 1 96 ? 20.343 15.348 40.209 1.00 46.01 ? 98 ILE B O 1 +ATOM 2534 C CB . ILE B 1 96 ? 22.037 16.527 38.125 1.00 41.70 ? 98 ILE B CB 1 +ATOM 2535 C CG1 . ILE B 1 96 ? 23.257 16.507 37.209 1.00 40.03 ? 98 ILE B CG1 1 +ATOM 2536 C CG2 . ILE B 1 96 ? 21.280 17.837 37.980 1.00 42.25 ? 98 ILE B CG2 1 +ATOM 2537 C CD1 . ILE B 1 96 ? 22.980 16.382 35.700 1.00 41.70 ? 98 ILE B CD1 1 +ATOM 2538 N N . SER B 1 97 ? 21.263 16.782 41.653 1.00 43.53 ? 99 SER B N 1 +ATOM 2539 C CA . SER B 1 97 ? 20.223 16.641 42.638 1.00 46.86 ? 99 SER B CA 1 +ATOM 2540 C C . SER B 1 97 ? 19.160 17.755 42.606 1.00 49.35 ? 99 SER B C 1 +ATOM 2541 O O . SER B 1 97 ? 19.292 18.843 43.199 1.00 49.43 ? 99 SER B O 1 +ATOM 2542 C CB . SER B 1 97 ? 20.955 16.549 43.974 1.00 48.87 ? 99 SER B CB 1 +ATOM 2543 O OG . SER B 1 97 ? 20.085 16.439 45.093 1.00 54.79 ? 99 SER B OG 1 +ATOM 2544 N N . PHE B 1 98 ? 18.051 17.454 41.909 1.00 48.12 ? 100 PHE B N 1 +ATOM 2545 C CA . PHE B 1 98 ? 16.901 18.368 41.828 1.00 47.58 ? 100 PHE B CA 1 +ATOM 2546 C C . PHE B 1 98 ? 16.204 18.404 43.194 1.00 47.19 ? 100 PHE B C 1 +ATOM 2547 O O . PHE B 1 98 ? 15.746 17.379 43.705 1.00 44.24 ? 100 PHE B O 1 +ATOM 2548 C CB . PHE B 1 98 ? 15.903 17.890 40.779 1.00 45.87 ? 100 PHE B CB 1 +ATOM 2549 C CG . PHE B 1 98 ? 16.509 17.770 39.392 1.00 40.47 ? 100 PHE B CG 1 +ATOM 2550 C CD1 . PHE B 1 98 ? 17.187 16.602 39.033 1.00 34.61 ? 100 PHE B CD1 1 +ATOM 2551 C CD2 . PHE B 1 98 ? 16.381 18.829 38.488 1.00 35.20 ? 100 PHE B CD2 1 +ATOM 2552 C CE1 . PHE B 1 98 ? 17.736 16.501 37.762 1.00 34.53 ? 100 PHE B CE1 1 +ATOM 2553 C CE2 . PHE B 1 98 ? 16.934 18.716 37.217 1.00 28.82 ? 100 PHE B CE2 1 +ATOM 2554 C CZ . PHE B 1 98 ? 17.607 17.560 36.855 1.00 32.93 ? 100 PHE B CZ 1 +ATOM 2555 N N . LYS B 1 99 ? 16.217 19.599 43.797 1.00 48.09 ? 101 LYS B N 1 +ATOM 2556 C CA . LYS B 1 99 ? 15.672 19.888 45.115 1.00 49.37 ? 101 LYS B CA 1 +ATOM 2557 C C . LYS B 1 99 ? 14.232 19.443 45.180 1.00 53.48 ? 101 LYS B C 1 +ATOM 2558 O O . LYS B 1 99 ? 13.415 19.769 44.308 1.00 55.96 ? 101 LYS B O 1 +ATOM 2559 C CB . LYS B 1 99 ? 15.730 21.366 45.383 1.00 48.68 ? 101 LYS B CB 1 +ATOM 2560 C CG . LYS B 1 99 ? 15.553 21.757 46.847 1.00 47.77 ? 101 LYS B CG 1 +ATOM 2561 C CD . LYS B 1 99 ? 15.307 23.254 46.896 1.00 41.17 ? 101 LYS B CD 1 +ATOM 2562 C CE . LYS B 1 99 ? 15.610 23.847 48.252 1.00 47.06 ? 101 LYS B CE 1 +ATOM 2563 N NZ . LYS B 1 99 ? 14.858 23.201 49.310 1.00 43.48 ? 101 LYS B NZ 1 +ATOM 2564 N N . ASP B 1 100 ? 14.003 18.675 46.252 1.00 55.99 ? 102 ASP B N 1 +ATOM 2565 C CA . ASP B 1 100 ? 12.747 17.997 46.590 1.00 56.87 ? 102 ASP B CA 1 +ATOM 2566 C C . ASP B 1 100 ? 12.255 16.909 45.628 1.00 56.56 ? 102 ASP B C 1 +ATOM 2567 O O . ASP B 1 100 ? 11.489 16.032 46.049 1.00 57.71 ? 102 ASP B O 1 +ATOM 2568 C CB . ASP B 1 100 ? 11.614 19.021 46.775 1.00 56.92 ? 102 ASP B CB 1 +ATOM 2569 C CG . ASP B 1 100 ? 11.775 19.941 47.984 1.00 60.14 ? 102 ASP B CG 1 +ATOM 2570 O OD1 . ASP B 1 100 ? 12.185 19.505 49.070 1.00 61.58 ? 102 ASP B OD1 1 +ATOM 2571 O OD2 . ASP B 1 100 ? 11.463 21.117 47.826 1.00 61.81 ? 102 ASP B OD2 1 +ATOM 2572 N N . ASP B 1 101 ? 12.681 16.920 44.348 1.00 52.77 ? 103 ASP B N 1 +ATOM 2573 C CA . ASP B 1 101 ? 12.346 15.881 43.377 1.00 48.22 ? 103 ASP B CA 1 +ATOM 2574 C C . ASP B 1 101 ? 13.506 14.890 43.369 1.00 47.37 ? 103 ASP B C 1 +ATOM 2575 O O . ASP B 1 101 ? 14.191 14.814 44.382 1.00 49.65 ? 103 ASP B O 1 +ATOM 2576 C CB . ASP B 1 101 ? 12.156 16.529 42.014 1.00 44.21 ? 103 ASP B CB 1 +ATOM 2577 C CG . ASP B 1 101 ? 11.257 15.781 41.045 1.00 41.83 ? 103 ASP B CG 1 +ATOM 2578 O OD1 . ASP B 1 101 ? 11.398 14.579 40.895 1.00 44.68 ? 103 ASP B OD1 1 +ATOM 2579 O OD2 . ASP B 1 101 ? 10.403 16.392 40.413 1.00 44.74 ? 103 ASP B OD2 1 +ATOM 2580 N N . GLY B 1 102 ? 13.823 14.130 42.309 1.00 48.96 ? 104 GLY B N 1 +ATOM 2581 C CA . GLY B 1 102 ? 14.927 13.164 42.324 1.00 49.84 ? 104 GLY B CA 1 +ATOM 2582 C C . GLY B 1 102 ? 16.264 13.611 41.751 1.00 50.56 ? 104 GLY B C 1 +ATOM 2583 O O . GLY B 1 102 ? 16.591 14.794 41.787 1.00 53.36 ? 104 GLY B O 1 +ATOM 2584 N N . ASN B 1 103 ? 17.045 12.676 41.181 1.00 51.28 ? 105 ASN B N 1 +ATOM 2585 C CA . ASN B 1 103 ? 18.404 12.969 40.734 1.00 51.21 ? 105 ASN B CA 1 +ATOM 2586 C C . ASN B 1 103 ? 18.935 12.180 39.563 1.00 49.81 ? 105 ASN B C 1 +ATOM 2587 O O . ASN B 1 103 ? 18.593 11.014 39.358 1.00 51.09 ? 105 ASN B O 1 +ATOM 2588 C CB . ASN B 1 103 ? 19.401 12.779 41.888 1.00 52.25 ? 105 ASN B CB 1 +ATOM 2589 C CG . ASN B 1 103 ? 19.368 11.393 42.524 1.00 52.23 ? 105 ASN B CG 1 +ATOM 2590 O OD1 . ASN B 1 103 ? 20.099 10.492 42.116 1.00 49.28 ? 105 ASN B OD1 1 +ATOM 2591 N ND2 . ASN B 1 103 ? 18.513 11.201 43.536 1.00 53.78 ? 105 ASN B ND2 1 +ATOM 2592 N N . TYR B 1 104 ? 19.814 12.850 38.814 1.00 48.96 ? 106 TYR B N 1 +ATOM 2593 C CA . TYR B 1 104 ? 20.514 12.207 37.709 1.00 49.55 ? 106 TYR B CA 1 +ATOM 2594 C C . TYR B 1 104 ? 21.923 11.939 38.163 1.00 49.87 ? 106 TYR B C 1 +ATOM 2595 O O . TYR B 1 104 ? 22.550 12.733 38.871 1.00 47.74 ? 106 TYR B O 1 +ATOM 2596 C CB . TYR B 1 104 ? 20.698 13.047 36.468 1.00 47.08 ? 106 TYR B CB 1 +ATOM 2597 C CG . TYR B 1 104 ? 19.465 13.540 35.741 1.00 47.07 ? 106 TYR B CG 1 +ATOM 2598 C CD1 . TYR B 1 104 ? 18.299 12.776 35.645 1.00 46.31 ? 106 TYR B CD1 1 +ATOM 2599 C CD2 . TYR B 1 104 ? 19.540 14.810 35.163 1.00 47.88 ? 106 TYR B CD2 1 +ATOM 2600 C CE1 . TYR B 1 104 ? 17.198 13.309 34.973 1.00 45.38 ? 106 TYR B CE1 1 +ATOM 2601 C CE2 . TYR B 1 104 ? 18.450 15.339 34.487 1.00 44.77 ? 106 TYR B CE2 1 +ATOM 2602 C CZ . TYR B 1 104 ? 17.286 14.584 34.401 1.00 45.19 ? 106 TYR B CZ 1 +ATOM 2603 O OH . TYR B 1 104 ? 16.196 15.124 33.763 1.00 39.94 ? 106 TYR B OH 1 +ATOM 2604 N N . LYS B 1 105 ? 22.388 10.779 37.709 1.00 50.46 ? 107 LYS B N 1 +ATOM 2605 C CA . LYS B 1 105 ? 23.745 10.371 37.965 1.00 51.31 ? 107 LYS B CA 1 +ATOM 2606 C C . LYS B 1 105 ? 24.319 10.047 36.617 1.00 48.19 ? 107 LYS B C 1 +ATOM 2607 O O . LYS B 1 105 ? 23.902 9.104 35.943 1.00 47.20 ? 107 LYS B O 1 +ATOM 2608 C CB . LYS B 1 105 ? 23.759 9.159 38.890 1.00 55.89 ? 107 LYS B CB 1 +ATOM 2609 C CG . LYS B 1 105 ? 24.046 9.716 40.291 1.00 64.14 ? 107 LYS B CG 1 +ATOM 2610 C CD . LYS B 1 105 ? 23.993 8.693 41.418 1.00 72.04 ? 107 LYS B CD 1 +ATOM 2611 C CE . LYS B 1 105 ? 22.645 8.696 42.157 1.00 79.13 ? 107 LYS B CE 1 +ATOM 2612 N NZ . LYS B 1 105 ? 21.528 8.238 41.335 1.00 84.44 ? 107 LYS B NZ 1 +ATOM 2613 N N . THR B 1 106 ? 25.219 10.945 36.214 1.00 44.68 ? 108 THR B N 1 +ATOM 2614 C CA . THR B 1 106 ? 25.860 10.808 34.916 1.00 41.97 ? 108 THR B CA 1 +ATOM 2615 C C . THR B 1 106 ? 27.320 10.391 35.043 1.00 40.87 ? 108 THR B C 1 +ATOM 2616 O O . THR B 1 106 ? 27.946 10.436 36.106 1.00 38.93 ? 108 THR B O 1 +ATOM 2617 C CB . THR B 1 106 ? 25.734 12.142 34.120 1.00 36.41 ? 108 THR B CB 1 +ATOM 2618 O OG1 . THR B 1 106 ? 26.431 13.137 34.824 1.00 41.21 ? 108 THR B OG1 1 +ATOM 2619 C CG2 . THR B 1 106 ? 24.304 12.615 33.997 1.00 41.60 ? 108 THR B CG2 1 +ATOM 2620 N N . ARG B 1 107 ? 27.794 9.896 33.904 1.00 41.61 ? 109 ARG B N 1 +ATOM 2621 C CA . ARG B 1 107 ? 29.162 9.464 33.698 1.00 44.29 ? 109 ARG B CA 1 +ATOM 2622 C C . ARG B 1 107 ? 29.366 9.557 32.199 1.00 41.32 ? 109 ARG B C 1 +ATOM 2623 O O . ARG B 1 107 ? 28.749 8.881 31.377 1.00 41.23 ? 109 ARG B O 1 +ATOM 2624 C CB . ARG B 1 107 ? 29.400 8.012 34.133 1.00 47.06 ? 109 ARG B CB 1 +ATOM 2625 C CG . ARG B 1 107 ? 30.875 7.822 34.513 1.00 49.88 ? 109 ARG B CG 1 +ATOM 2626 C CD . ARG B 1 107 ? 31.398 6.417 34.341 1.00 50.72 ? 109 ARG B CD 1 +ATOM 2627 N NE . ARG B 1 107 ? 31.651 6.221 32.934 1.00 51.37 ? 109 ARG B NE 1 +ATOM 2628 C CZ . ARG B 1 107 ? 32.903 6.128 32.494 1.00 55.25 ? 109 ARG B CZ 1 +ATOM 2629 N NH1 . ARG B 1 107 ? 33.960 6.202 33.310 1.00 54.38 ? 109 ARG B NH1 1 +ATOM 2630 N NH2 . ARG B 1 107 ? 33.092 5.974 31.193 1.00 62.43 ? 109 ARG B NH2 1 +ATOM 2631 N N . ALA B 1 108 ? 30.284 10.444 31.879 1.00 43.33 ? 110 ALA B N 1 +ATOM 2632 C CA . ALA B 1 108 ? 30.560 10.798 30.503 1.00 42.15 ? 110 ALA B CA 1 +ATOM 2633 C C . ALA B 1 108 ? 32.043 10.745 30.180 1.00 39.97 ? 110 ALA B C 1 +ATOM 2634 O O . ALA B 1 108 ? 32.890 10.979 31.042 1.00 36.42 ? 110 ALA B O 1 +ATOM 2635 C CB . ALA B 1 108 ? 30.052 12.214 30.258 1.00 42.55 ? 110 ALA B CB 1 +ATOM 2636 N N . GLU B 1 109 ? 32.321 10.425 28.910 1.00 36.96 ? 111 GLU B N 1 +ATOM 2637 C CA . GLU B 1 109 ? 33.664 10.398 28.386 1.00 34.82 ? 111 GLU B CA 1 +ATOM 2638 C C . GLU B 1 109 ? 33.731 11.451 27.302 1.00 31.79 ? 111 GLU B C 1 +ATOM 2639 O O . GLU B 1 109 ? 33.144 11.343 26.235 1.00 32.64 ? 111 GLU B O 1 +ATOM 2640 C CB . GLU B 1 109 ? 34.013 9.018 27.813 1.00 33.83 ? 111 GLU B CB 1 +ATOM 2641 C CG . GLU B 1 109 ? 34.226 7.979 28.918 1.00 44.53 ? 111 GLU B CG 1 +ATOM 2642 C CD . GLU B 1 109 ? 35.091 6.752 28.600 1.00 51.04 ? 111 GLU B CD 1 +ATOM 2643 O OE1 . GLU B 1 109 ? 35.471 6.558 27.449 1.00 55.93 ? 111 GLU B OE1 1 +ATOM 2644 O OE2 . GLU B 1 109 ? 35.417 5.993 29.519 1.00 53.73 ? 111 GLU B OE2 1 +ATOM 2645 N N . VAL B 1 110 ? 34.449 12.518 27.627 1.00 27.48 ? 112 VAL B N 1 +ATOM 2646 C CA . VAL B 1 110 ? 34.646 13.637 26.725 1.00 26.64 ? 112 VAL B CA 1 +ATOM 2647 C C . VAL B 1 110 ? 36.068 13.461 26.169 1.00 27.28 ? 112 VAL B C 1 +ATOM 2648 O O . VAL B 1 110 ? 37.057 13.502 26.901 1.00 22.65 ? 112 VAL B O 1 +ATOM 2649 C CB . VAL B 1 110 ? 34.469 14.940 27.548 1.00 29.38 ? 112 VAL B CB 1 +ATOM 2650 C CG1 . VAL B 1 110 ? 34.424 16.104 26.614 1.00 21.26 ? 112 VAL B CG1 1 +ATOM 2651 C CG2 . VAL B 1 110 ? 33.184 14.914 28.375 1.00 30.64 ? 112 VAL B CG2 1 +ATOM 2652 N N . LYS B 1 111 ? 36.172 13.190 24.867 1.00 25.93 ? 113 LYS B N 1 +ATOM 2653 C CA . LYS B 1 111 ? 37.432 12.933 24.230 1.00 24.26 ? 113 LYS B CA 1 +ATOM 2654 C C . LYS B 1 111 ? 37.404 13.168 22.744 1.00 21.72 ? 113 LYS B C 1 +ATOM 2655 O O . LYS B 1 111 ? 36.352 13.279 22.153 1.00 19.77 ? 113 LYS B O 1 +ATOM 2656 C CB . LYS B 1 111 ? 37.886 11.501 24.458 1.00 31.00 ? 113 LYS B CB 1 +ATOM 2657 C CG . LYS B 1 111 ? 36.980 10.334 24.090 1.00 34.23 ? 113 LYS B CG 1 +ATOM 2658 C CD . LYS B 1 111 ? 37.820 9.069 24.093 1.00 37.91 ? 113 LYS B CD 1 +ATOM 2659 C CE . LYS B 1 111 ? 36.977 7.852 24.498 1.00 50.51 ? 113 LYS B CE 1 +ATOM 2660 N NZ . LYS B 1 111 ? 35.831 7.586 23.629 1.00 55.50 ? 113 LYS B NZ 1 +ATOM 2661 N N . PHE B 1 112 ? 38.567 13.227 22.116 1.00 20.67 ? 114 PHE B N 1 +ATOM 2662 C CA . PHE B 1 112 ? 38.641 13.387 20.685 1.00 25.64 ? 114 PHE B CA 1 +ATOM 2663 C C . PHE B 1 112 ? 38.617 12.062 19.958 1.00 26.75 ? 114 PHE B C 1 +ATOM 2664 O O . PHE B 1 112 ? 39.524 11.245 20.084 1.00 29.07 ? 114 PHE B O 1 +ATOM 2665 C CB . PHE B 1 112 ? 39.914 14.118 20.265 1.00 17.97 ? 114 PHE B CB 1 +ATOM 2666 C CG . PHE B 1 112 ? 39.798 15.632 20.297 1.00 22.47 ? 114 PHE B CG 1 +ATOM 2667 C CD1 . PHE B 1 112 ? 40.032 16.339 21.470 1.00 26.95 ? 114 PHE B CD1 1 +ATOM 2668 C CD2 . PHE B 1 112 ? 39.476 16.316 19.131 1.00 19.36 ? 114 PHE B CD2 1 +ATOM 2669 C CE1 . PHE B 1 112 ? 39.946 17.735 21.465 1.00 29.44 ? 114 PHE B CE1 1 +ATOM 2670 C CE2 . PHE B 1 112 ? 39.391 17.704 19.149 1.00 23.91 ? 114 PHE B CE2 1 +ATOM 2671 C CZ . PHE B 1 112 ? 39.626 18.423 20.308 1.00 19.83 ? 114 PHE B CZ 1 +ATOM 2672 N N . GLU B 1 113 ? 37.523 11.811 19.262 1.00 26.06 ? 115 GLU B N 1 +ATOM 2673 C CA . GLU B 1 113 ? 37.470 10.698 18.368 1.00 32.01 ? 115 GLU B CA 1 +ATOM 2674 C C . GLU B 1 113 ? 37.675 11.345 17.014 1.00 32.33 ? 115 GLU B C 1 +ATOM 2675 O O . GLU B 1 113 ? 36.760 11.868 16.379 1.00 38.76 ? 115 GLU B O 1 +ATOM 2676 C CB . GLU B 1 113 ? 36.115 9.962 18.432 1.00 32.32 ? 115 GLU B CB 1 +ATOM 2677 C CG . GLU B 1 113 ? 35.863 9.271 19.777 1.00 32.92 ? 115 GLU B CG 1 +ATOM 2678 C CD . GLU B 1 113 ? 34.548 8.494 19.947 1.00 37.02 ? 115 GLU B CD 1 +ATOM 2679 O OE1 . GLU B 1 113 ? 33.676 8.553 19.079 1.00 32.13 ? 115 GLU B OE1 1 +ATOM 2680 O OE2 . GLU B 1 113 ? 34.405 7.810 20.966 1.00 32.90 ? 115 GLU B OE2 1 +ATOM 2681 N N . GLY B 1 114 ? 38.929 11.299 16.573 1.00 35.97 ? 116 GLY B N 1 +ATOM 2682 C CA . GLY B 1 114 ? 39.344 11.891 15.311 1.00 35.73 ? 116 GLY B CA 1 +ATOM 2683 C C . GLY B 1 114 ? 39.532 13.364 15.557 1.00 37.76 ? 116 GLY B C 1 +ATOM 2684 O O . GLY B 1 114 ? 40.145 13.757 16.566 1.00 35.25 ? 116 GLY B O 1 +ATOM 2685 N N . ASP B 1 115 ? 38.962 14.156 14.626 1.00 40.20 ? 117 ASP B N 1 +ATOM 2686 C CA . ASP B 1 115 ? 39.030 15.616 14.725 1.00 37.93 ? 117 ASP B CA 1 +ATOM 2687 C C . ASP B 1 115 ? 37.842 16.171 15.484 1.00 35.52 ? 117 ASP B C 1 +ATOM 2688 O O . ASP B 1 115 ? 37.763 17.378 15.732 1.00 33.03 ? 117 ASP B O 1 +ATOM 2689 C CB . ASP B 1 115 ? 39.087 16.266 13.317 1.00 44.16 ? 117 ASP B CB 1 +ATOM 2690 C CG . ASP B 1 115 ? 37.782 16.656 12.589 1.00 49.57 ? 117 ASP B CG 1 +ATOM 2691 O OD1 . ASP B 1 115 ? 36.983 15.804 12.186 1.00 51.48 ? 117 ASP B OD1 1 +ATOM 2692 O OD2 . ASP B 1 115 ? 37.581 17.853 12.395 1.00 55.81 ? 117 ASP B OD2 1 +ATOM 2693 N N . THR B 1 116 ? 36.946 15.265 15.933 1.00 35.29 ? 118 THR B N 1 +ATOM 2694 C CA . THR B 1 116 ? 35.744 15.709 16.625 1.00 27.83 ? 118 THR B CA 1 +ATOM 2695 C C . THR B 1 116 ? 35.736 15.307 18.084 1.00 24.12 ? 118 THR B C 1 +ATOM 2696 O O . THR B 1 116 ? 36.126 14.212 18.459 1.00 19.61 ? 118 THR B O 1 +ATOM 2697 C CB . THR B 1 116 ? 34.458 15.197 15.795 1.00 30.30 ? 118 THR B CB 1 +ATOM 2698 O OG1 . THR B 1 116 ? 33.660 14.436 16.677 1.00 31.14 ? 118 THR B OG1 1 +ATOM 2699 C CG2 . THR B 1 116 ? 34.782 14.398 14.528 1.00 19.18 ? 118 THR B CG2 1 +ATOM 2700 N N . LEU B 1 117 ? 35.387 16.283 18.935 1.00 20.97 ? 119 LEU B N 1 +ATOM 2701 C CA . LEU B 1 117 ? 35.260 16.047 20.345 1.00 21.67 ? 119 LEU B CA 1 +ATOM 2702 C C . LEU B 1 117 ? 33.886 15.422 20.636 1.00 28.25 ? 119 LEU B C 1 +ATOM 2703 O O . LEU B 1 117 ? 32.826 15.971 20.315 1.00 24.38 ? 119 LEU B O 1 +ATOM 2704 C CB . LEU B 1 117 ? 35.375 17.330 21.139 1.00 18.96 ? 119 LEU B CB 1 +ATOM 2705 C CG . LEU B 1 117 ? 35.486 17.060 22.605 1.00 16.83 ? 119 LEU B CG 1 +ATOM 2706 C CD1 . LEU B 1 117 ? 36.815 17.543 23.042 1.00 26.16 ? 119 LEU B CD1 1 +ATOM 2707 C CD2 . LEU B 1 117 ? 34.393 17.739 23.407 1.00 25.06 ? 119 LEU B CD2 1 +ATOM 2708 N N . VAL B 1 118 ? 33.927 14.254 21.303 1.00 28.07 ? 120 VAL B N 1 +ATOM 2709 C CA . VAL B 1 118 ? 32.726 13.527 21.596 1.00 24.53 ? 120 VAL B CA 1 +ATOM 2710 C C . VAL B 1 118 ? 32.449 13.495 23.067 1.00 26.89 ? 120 VAL B C 1 +ATOM 2711 O O . VAL B 1 118 ? 33.357 13.304 23.863 1.00 28.20 ? 120 VAL B O 1 +ATOM 2712 C CB . VAL B 1 118 ? 32.860 12.115 21.041 1.00 26.49 ? 120 VAL B CB 1 +ATOM 2713 C CG1 . VAL B 1 118 ? 31.486 11.415 21.122 1.00 19.30 ? 120 VAL B CG1 1 +ATOM 2714 C CG2 . VAL B 1 118 ? 33.306 12.159 19.563 1.00 16.94 ? 120 VAL B CG2 1 +ATOM 2715 N N . ASN B 1 119 ? 31.194 13.750 23.442 1.00 29.71 ? 121 ASN B N 1 +ATOM 2716 C CA . ASN B 1 119 ? 30.775 13.584 24.828 1.00 33.84 ? 121 ASN B CA 1 +ATOM 2717 C C . ASN B 1 119 ? 29.780 12.399 24.861 1.00 34.92 ? 121 ASN B C 1 +ATOM 2718 O O . ASN B 1 119 ? 28.577 12.544 24.572 1.00 30.96 ? 121 ASN B O 1 +ATOM 2719 C CB . ASN B 1 119 ? 30.160 14.920 25.271 1.00 33.87 ? 121 ASN B CB 1 +ATOM 2720 C CG . ASN B 1 119 ? 29.664 15.029 26.705 1.00 34.05 ? 121 ASN B CG 1 +ATOM 2721 O OD1 . ASN B 1 119 ? 30.283 14.463 27.600 1.00 37.40 ? 121 ASN B OD1 1 +ATOM 2722 N ND2 . ASN B 1 119 ? 28.579 15.719 27.042 1.00 36.22 ? 121 ASN B ND2 1 +ATOM 2723 N N . ARG B 1 120 ? 30.304 11.174 25.118 1.00 34.50 ? 122 ARG B N 1 +ATOM 2724 C CA . ARG B 1 120 ? 29.499 9.950 25.226 1.00 28.40 ? 122 ARG B CA 1 +ATOM 2725 C C . ARG B 1 120 ? 29.097 9.787 26.660 1.00 31.05 ? 122 ARG B C 1 +ATOM 2726 O O . ARG B 1 120 ? 29.902 9.630 27.565 1.00 37.21 ? 122 ARG B O 1 +ATOM 2727 C CB . ARG B 1 120 ? 30.256 8.738 24.816 1.00 28.06 ? 122 ARG B CB 1 +ATOM 2728 C CG . ARG B 1 120 ? 30.368 8.723 23.307 1.00 30.08 ? 122 ARG B CG 1 +ATOM 2729 C CD . ARG B 1 120 ? 30.949 7.416 22.800 1.00 32.25 ? 122 ARG B CD 1 +ATOM 2730 N NE . ARG B 1 120 ? 31.376 7.509 21.411 1.00 27.69 ? 122 ARG B NE 1 +ATOM 2731 C CZ . ARG B 1 120 ? 30.558 7.402 20.365 1.00 34.21 ? 122 ARG B CZ 1 +ATOM 2732 N NH1 . ARG B 1 120 ? 29.231 7.204 20.490 1.00 39.73 ? 122 ARG B NH1 1 +ATOM 2733 N NH2 . ARG B 1 120 ? 31.095 7.453 19.147 1.00 31.32 ? 122 ARG B NH2 1 +ATOM 2734 N N . ILE B 1 121 ? 27.791 9.860 26.883 1.00 36.00 ? 123 ILE B N 1 +ATOM 2735 C CA . ILE B 1 121 ? 27.232 9.951 28.219 1.00 35.06 ? 123 ILE B CA 1 +ATOM 2736 C C . ILE B 1 121 ? 26.320 8.768 28.466 1.00 36.91 ? 123 ILE B C 1 +ATOM 2737 O O . ILE B 1 121 ? 25.766 8.134 27.550 1.00 34.27 ? 123 ILE B O 1 +ATOM 2738 C CB . ILE B 1 121 ? 26.433 11.292 28.342 1.00 37.45 ? 123 ILE B CB 1 +ATOM 2739 C CG1 . ILE B 1 121 ? 27.166 12.450 27.702 1.00 32.40 ? 123 ILE B CG1 1 +ATOM 2740 C CG2 . ILE B 1 121 ? 26.255 11.658 29.797 1.00 36.35 ? 123 ILE B CG2 1 +ATOM 2741 C CD1 . ILE B 1 121 ? 26.154 13.399 27.080 1.00 36.83 ? 123 ILE B CD1 1 +ATOM 2742 N N . GLU B 1 122 ? 26.247 8.505 29.775 1.00 37.77 ? 124 GLU B N 1 +ATOM 2743 C CA . GLU B 1 122 ? 25.333 7.541 30.368 1.00 42.06 ? 124 GLU B CA 1 +ATOM 2744 C C . GLU B 1 122 ? 24.778 8.255 31.601 1.00 42.54 ? 124 GLU B C 1 +ATOM 2745 O O . GLU B 1 122 ? 25.527 8.701 32.476 1.00 43.68 ? 124 GLU B O 1 +ATOM 2746 C CB . GLU B 1 122 ? 26.026 6.252 30.840 1.00 46.43 ? 124 GLU B CB 1 +ATOM 2747 C CG . GLU B 1 122 ? 26.642 5.356 29.761 1.00 54.21 ? 124 GLU B CG 1 +ATOM 2748 C CD . GLU B 1 122 ? 27.455 4.171 30.316 1.00 62.19 ? 124 GLU B CD 1 +ATOM 2749 O OE1 . GLU B 1 122 ? 28.252 4.338 31.254 1.00 61.36 ? 124 GLU B OE1 1 +ATOM 2750 O OE2 . GLU B 1 122 ? 27.287 3.066 29.793 1.00 62.61 ? 124 GLU B OE2 1 +ATOM 2751 N N . LEU B 1 123 ? 23.451 8.400 31.633 1.00 41.56 ? 125 LEU B N 1 +ATOM 2752 C CA . LEU B 1 123 ? 22.702 9.026 32.719 1.00 40.74 ? 125 LEU B CA 1 +ATOM 2753 C C . LEU B 1 123 ? 21.633 8.090 33.289 1.00 41.43 ? 125 LEU B C 1 +ATOM 2754 O O . LEU B 1 123 ? 20.880 7.423 32.575 1.00 33.46 ? 125 LEU B O 1 +ATOM 2755 C CB . LEU B 1 123 ? 22.015 10.296 32.218 1.00 39.01 ? 125 LEU B CB 1 +ATOM 2756 C CG . LEU B 1 123 ? 21.037 11.160 33.038 1.00 35.90 ? 125 LEU B CG 1 +ATOM 2757 C CD1 . LEU B 1 123 ? 20.833 12.494 32.342 1.00 35.61 ? 125 LEU B CD1 1 +ATOM 2758 C CD2 . LEU B 1 123 ? 19.652 10.555 33.083 1.00 39.32 ? 125 LEU B CD2 1 +ATOM 2759 N N . LYS B 1 124 ? 21.532 8.134 34.619 1.00 45.75 ? 126 LYS B N 1 +ATOM 2760 C CA . LYS B 1 124 ? 20.510 7.408 35.326 1.00 49.48 ? 126 LYS B CA 1 +ATOM 2761 C C . LYS B 1 124 ? 19.840 8.250 36.410 1.00 52.23 ? 126 LYS B C 1 +ATOM 2762 O O . LYS B 1 124 ? 20.413 8.594 37.452 1.00 58.36 ? 126 LYS B O 1 +ATOM 2763 C CB . LYS B 1 124 ? 21.074 6.154 35.980 1.00 52.59 ? 126 LYS B CB 1 +ATOM 2764 C CG . LYS B 1 124 ? 19.951 5.127 35.927 1.00 59.10 ? 126 LYS B CG 1 +ATOM 2765 C CD . LYS B 1 124 ? 19.882 4.223 37.141 1.00 65.30 ? 126 LYS B CD 1 +ATOM 2766 C CE . LYS B 1 124 ? 18.657 3.318 37.025 1.00 69.57 ? 126 LYS B CE 1 +ATOM 2767 N NZ . LYS B 1 124 ? 17.418 4.091 36.994 1.00 73.38 ? 126 LYS B NZ 1 +ATOM 2768 N N . GLY B 1 125 ? 18.559 8.549 36.121 1.00 53.70 ? 127 GLY B N 1 +ATOM 2769 C CA . GLY B 1 125 ? 17.619 9.263 36.980 1.00 50.23 ? 127 GLY B CA 1 +ATOM 2770 C C . GLY B 1 125 ? 16.771 8.320 37.846 1.00 48.97 ? 127 GLY B C 1 +ATOM 2771 O O . GLY B 1 125 ? 16.302 7.246 37.437 1.00 46.31 ? 127 GLY B O 1 +ATOM 2772 N N . ILE B 1 126 ? 16.632 8.771 39.101 1.00 48.73 ? 128 ILE B N 1 +ATOM 2773 C CA . ILE B 1 126 ? 15.916 8.107 40.188 1.00 49.83 ? 128 ILE B CA 1 +ATOM 2774 C C . ILE B 1 126 ? 15.347 9.109 41.185 1.00 52.77 ? 128 ILE B C 1 +ATOM 2775 O O . ILE B 1 126 ? 15.907 10.178 41.447 1.00 50.09 ? 128 ILE B O 1 +ATOM 2776 C CB . ILE B 1 126 ? 16.771 7.132 41.077 1.00 48.62 ? 128 ILE B CB 1 +ATOM 2777 C CG1 . ILE B 1 126 ? 17.973 7.832 41.700 1.00 48.77 ? 128 ILE B CG1 1 +ATOM 2778 C CG2 . ILE B 1 126 ? 17.176 5.938 40.226 1.00 52.36 ? 128 ILE B CG2 1 +ATOM 2779 C CD1 . ILE B 1 126 ? 18.688 6.998 42.784 1.00 50.24 ? 128 ILE B CD1 1 +ATOM 2780 N N . ASP B 1 127 ? 14.245 8.622 41.786 1.00 57.03 ? 129 ASP B N 1 +ATOM 2781 C CA . ASP B 1 127 ? 13.392 9.222 42.814 1.00 59.30 ? 129 ASP B CA 1 +ATOM 2782 C C . ASP B 1 127 ? 12.659 10.458 42.333 1.00 59.75 ? 129 ASP B C 1 +ATOM 2783 O O . ASP B 1 127 ? 12.350 11.394 43.080 1.00 57.83 ? 129 ASP B O 1 +ATOM 2784 C CB . ASP B 1 127 ? 14.183 9.608 44.087 1.00 64.77 ? 129 ASP B CB 1 +ATOM 2785 C CG . ASP B 1 127 ? 15.276 8.627 44.507 1.00 68.47 ? 129 ASP B CG 1 +ATOM 2786 O OD1 . ASP B 1 127 ? 15.051 7.408 44.439 1.00 67.26 ? 129 ASP B OD1 1 +ATOM 2787 O OD2 . ASP B 1 127 ? 16.354 9.114 44.877 1.00 67.46 ? 129 ASP B OD2 1 +ATOM 2788 N N . PHE B 1 128 ? 12.371 10.429 41.030 1.00 60.96 ? 130 PHE B N 1 +ATOM 2789 C CA . PHE B 1 128 ? 11.558 11.473 40.438 1.00 63.39 ? 130 PHE B CA 1 +ATOM 2790 C C . PHE B 1 128 ? 10.062 11.219 40.588 1.00 61.15 ? 130 PHE B C 1 +ATOM 2791 O O . PHE B 1 128 ? 9.502 10.133 40.417 1.00 61.55 ? 130 PHE B O 1 +ATOM 2792 C CB . PHE B 1 128 ? 11.859 11.653 38.935 1.00 67.40 ? 130 PHE B CB 1 +ATOM 2793 C CG . PHE B 1 128 ? 13.224 12.259 38.639 1.00 67.30 ? 130 PHE B CG 1 +ATOM 2794 C CD1 . PHE B 1 128 ? 13.414 13.632 38.778 1.00 69.63 ? 130 PHE B CD1 1 +ATOM 2795 C CD2 . PHE B 1 128 ? 14.292 11.437 38.281 1.00 67.95 ? 130 PHE B CD2 1 +ATOM 2796 C CE1 . PHE B 1 128 ? 14.672 14.185 38.567 1.00 70.92 ? 130 PHE B CE1 1 +ATOM 2797 C CE2 . PHE B 1 128 ? 15.547 11.992 38.071 1.00 66.63 ? 130 PHE B CE2 1 +ATOM 2798 C CZ . PHE B 1 128 ? 15.738 13.362 38.216 1.00 69.94 ? 130 PHE B CZ 1 +ATOM 2799 N N . LYS B 1 129 ? 9.457 12.325 40.981 1.00 58.68 ? 131 LYS B N 1 +ATOM 2800 C CA . LYS B 1 129 ? 8.029 12.452 41.144 1.00 54.95 ? 131 LYS B CA 1 +ATOM 2801 C C . LYS B 1 129 ? 7.373 12.614 39.781 1.00 55.46 ? 131 LYS B C 1 +ATOM 2802 O O . LYS B 1 129 ? 7.856 13.421 38.993 1.00 58.32 ? 131 LYS B O 1 +ATOM 2803 C CB . LYS B 1 129 ? 7.738 13.671 41.995 1.00 55.38 ? 131 LYS B CB 1 +ATOM 2804 C CG . LYS B 1 129 ? 8.351 13.788 43.398 1.00 52.81 ? 131 LYS B CG 1 +ATOM 2805 C CD . LYS B 1 129 ? 7.853 15.135 43.896 1.00 56.40 ? 131 LYS B CD 1 +ATOM 2806 C CE . LYS B 1 129 ? 8.427 15.521 45.234 1.00 59.53 ? 131 LYS B CE 1 +ATOM 2807 N NZ . LYS B 1 129 ? 7.962 16.850 45.596 1.00 63.91 ? 131 LYS B NZ 1 +ATOM 2808 N N . GLU B 1 130 ? 6.286 11.885 39.467 1.00 58.93 ? 132 GLU B N 1 +ATOM 2809 C CA . GLU B 1 130 ? 5.546 12.012 38.198 1.00 61.56 ? 132 GLU B CA 1 +ATOM 2810 C C . GLU B 1 130 ? 4.784 13.320 38.049 1.00 61.27 ? 132 GLU B C 1 +ATOM 2811 O O . GLU B 1 130 ? 4.525 13.846 36.967 1.00 59.46 ? 132 GLU B O 1 +ATOM 2812 C CB . GLU B 1 130 ? 4.536 10.869 38.037 1.00 64.51 ? 132 GLU B CB 1 +ATOM 2813 C CG . GLU B 1 130 ? 5.195 9.514 37.845 1.00 73.61 ? 132 GLU B CG 1 +ATOM 2814 C CD . GLU B 1 130 ? 6.290 9.515 36.771 1.00 79.89 ? 132 GLU B CD 1 +ATOM 2815 O OE1 . GLU B 1 130 ? 5.965 9.559 35.577 1.00 81.34 ? 132 GLU B OE1 1 +ATOM 2816 O OE2 . GLU B 1 130 ? 7.470 9.480 37.141 1.00 81.73 ? 132 GLU B OE2 1 +ATOM 2817 N N . ASP B 1 131 ? 4.426 13.776 39.241 1.00 62.81 ? 133 ASP B N 1 +ATOM 2818 C CA . ASP B 1 131 ? 3.767 15.017 39.594 1.00 63.26 ? 133 ASP B CA 1 +ATOM 2819 C C . ASP B 1 131 ? 4.749 16.186 39.720 1.00 61.49 ? 133 ASP B C 1 +ATOM 2820 O O . ASP B 1 131 ? 4.349 17.351 39.716 1.00 59.36 ? 133 ASP B O 1 +ATOM 2821 C CB . ASP B 1 131 ? 3.024 14.746 40.928 1.00 67.14 ? 133 ASP B CB 1 +ATOM 2822 C CG . ASP B 1 131 ? 3.701 13.745 41.906 1.00 69.30 ? 133 ASP B CG 1 +ATOM 2823 O OD1 . ASP B 1 131 ? 3.636 12.529 41.670 1.00 71.73 ? 133 ASP B OD1 1 +ATOM 2824 O OD2 . ASP B 1 131 ? 4.285 14.173 42.905 1.00 64.73 ? 133 ASP B OD2 1 +ATOM 2825 N N . GLY B 1 132 ? 6.047 15.884 39.882 1.00 60.29 ? 134 GLY B N 1 +ATOM 2826 C CA . GLY B 1 132 ? 7.093 16.884 40.042 1.00 57.54 ? 134 GLY B CA 1 +ATOM 2827 C C . GLY B 1 132 ? 7.493 17.541 38.720 1.00 57.69 ? 134 GLY B C 1 +ATOM 2828 O O . GLY B 1 132 ? 7.194 17.019 37.636 1.00 55.82 ? 134 GLY B O 1 +ATOM 2829 N N . ASN B 1 133 ? 8.232 18.663 38.838 1.00 50.99 ? 135 ASN B N 1 +ATOM 2830 C CA . ASN B 1 133 ? 8.646 19.499 37.725 1.00 46.65 ? 135 ASN B CA 1 +ATOM 2831 C C . ASN B 1 133 ? 9.416 18.864 36.576 1.00 44.28 ? 135 ASN B C 1 +ATOM 2832 O O . ASN B 1 133 ? 9.411 19.414 35.471 1.00 41.73 ? 135 ASN B O 1 +ATOM 2833 C CB . ASN B 1 133 ? 9.496 20.670 38.229 1.00 49.58 ? 135 ASN B CB 1 +ATOM 2834 C CG . ASN B 1 133 ? 8.884 21.611 39.252 1.00 46.67 ? 135 ASN B CG 1 +ATOM 2835 O OD1 . ASN B 1 133 ? 9.539 22.017 40.211 1.00 40.95 ? 135 ASN B OD1 1 +ATOM 2836 N ND2 . ASN B 1 133 ? 7.637 22.023 39.083 1.00 48.24 ? 135 ASN B ND2 1 +ATOM 2837 N N . ILE B 1 134 ? 10.072 17.714 36.806 1.00 41.32 ? 136 ILE B N 1 +ATOM 2838 C CA . ILE B 1 134 ? 10.881 17.076 35.778 1.00 41.08 ? 136 ILE B CA 1 +ATOM 2839 C C . ILE B 1 134 ? 10.055 16.091 34.986 1.00 42.89 ? 136 ILE B C 1 +ATOM 2840 O O . ILE B 1 134 ? 10.034 16.173 33.757 1.00 46.81 ? 136 ILE B O 1 +ATOM 2841 C CB . ILE B 1 134 ? 12.138 16.399 36.463 1.00 37.59 ? 136 ILE B CB 1 +ATOM 2842 C CG1 . ILE B 1 134 ? 13.192 17.455 36.870 1.00 38.62 ? 136 ILE B CG1 1 +ATOM 2843 C CG2 . ILE B 1 134 ? 12.876 15.514 35.467 1.00 38.44 ? 136 ILE B CG2 1 +ATOM 2844 C CD1 . ILE B 1 134 ? 12.875 18.595 37.874 1.00 21.35 ? 136 ILE B CD1 1 +ATOM 2845 N N . LEU B 1 135 ? 9.342 15.164 35.649 1.00 45.87 ? 137 LEU B N 1 +ATOM 2846 C CA . LEU B 1 135 ? 8.517 14.191 34.936 1.00 42.60 ? 137 LEU B CA 1 +ATOM 2847 C C . LEU B 1 135 ? 7.186 14.786 34.488 1.00 38.92 ? 137 LEU B C 1 +ATOM 2848 O O . LEU B 1 135 ? 6.650 14.458 33.426 1.00 33.58 ? 137 LEU B O 1 +ATOM 2849 C CB . LEU B 1 135 ? 8.340 12.987 35.847 1.00 44.24 ? 137 LEU B CB 1 +ATOM 2850 C CG . LEU B 1 135 ? 9.302 11.821 35.630 1.00 49.35 ? 137 LEU B CG 1 +ATOM 2851 C CD1 . LEU B 1 135 ? 9.075 11.240 34.235 1.00 56.40 ? 137 LEU B CD1 1 +ATOM 2852 C CD2 . LEU B 1 135 ? 10.733 12.280 35.704 1.00 49.67 ? 137 LEU B CD2 1 +ATOM 2853 N N . GLY B 1 136 ? 6.703 15.766 35.263 1.00 37.44 ? 138 GLY B N 1 +ATOM 2854 C CA . GLY B 1 136 ? 5.525 16.526 34.893 1.00 39.11 ? 138 GLY B CA 1 +ATOM 2855 C C . GLY B 1 136 ? 5.823 17.615 33.861 1.00 46.65 ? 138 GLY B C 1 +ATOM 2856 O O . GLY B 1 136 ? 4.918 18.406 33.542 1.00 51.72 ? 138 GLY B O 1 +ATOM 2857 N N . HIS B 1 137 ? 7.079 17.680 33.343 1.00 45.34 ? 139 HIS B N 1 +ATOM 2858 C CA . HIS B 1 137 ? 7.584 18.661 32.377 1.00 43.82 ? 139 HIS B CA 1 +ATOM 2859 C C . HIS B 1 137 ? 7.131 20.098 32.620 1.00 44.34 ? 139 HIS B C 1 +ATOM 2860 O O . HIS B 1 137 ? 6.569 20.788 31.774 1.00 39.03 ? 139 HIS B O 1 +ATOM 2861 C CB . HIS B 1 137 ? 7.178 18.284 30.969 1.00 43.31 ? 139 HIS B CB 1 +ATOM 2862 C CG . HIS B 1 137 ? 7.825 17.011 30.478 1.00 42.23 ? 139 HIS B CG 1 +ATOM 2863 N ND1 . HIS B 1 137 ? 7.726 15.836 31.065 1.00 39.32 ? 139 HIS B ND1 1 +ATOM 2864 C CD2 . HIS B 1 137 ? 8.532 16.896 29.306 1.00 40.96 ? 139 HIS B CD2 1 +ATOM 2865 C CE1 . HIS B 1 137 ? 8.340 15.009 30.258 1.00 43.07 ? 139 HIS B CE1 1 +ATOM 2866 N NE2 . HIS B 1 137 ? 8.824 15.636 29.208 1.00 45.73 ? 139 HIS B NE2 1 +ATOM 2867 N N . LYS B 1 138 ? 7.377 20.513 33.855 1.00 47.67 ? 140 LYS B N 1 +ATOM 2868 C CA . LYS B 1 138 ? 6.961 21.806 34.313 1.00 52.56 ? 140 LYS B CA 1 +ATOM 2869 C C . LYS B 1 138 ? 7.950 22.937 34.090 1.00 54.46 ? 140 LYS B C 1 +ATOM 2870 O O . LYS B 1 138 ? 7.599 24.112 34.282 1.00 54.04 ? 140 LYS B O 1 +ATOM 2871 C CB . LYS B 1 138 ? 6.608 21.653 35.788 1.00 60.66 ? 140 LYS B CB 1 +ATOM 2872 C CG . LYS B 1 138 ? 5.371 20.765 36.013 1.00 66.19 ? 140 LYS B CG 1 +ATOM 2873 C CD . LYS B 1 138 ? 5.017 20.759 37.497 1.00 71.83 ? 140 LYS B CD 1 +ATOM 2874 C CE . LYS B 1 138 ? 3.668 20.124 37.789 1.00 74.64 ? 140 LYS B CE 1 +ATOM 2875 N NZ . LYS B 1 138 ? 3.664 18.734 37.391 1.00 77.61 ? 140 LYS B NZ 1 +ATOM 2876 N N . LEU B 1 139 ? 9.184 22.598 33.650 1.00 52.56 ? 141 LEU B N 1 +ATOM 2877 C CA . LEU B 1 139 ? 10.237 23.588 33.414 1.00 44.64 ? 141 LEU B CA 1 +ATOM 2878 C C . LEU B 1 139 ? 10.069 24.254 32.070 1.00 42.81 ? 141 LEU B C 1 +ATOM 2879 O O . LEU B 1 139 ? 9.801 23.598 31.051 1.00 41.20 ? 141 LEU B O 1 +ATOM 2880 C CB . LEU B 1 139 ? 11.649 23.046 33.324 1.00 47.57 ? 141 LEU B CB 1 +ATOM 2881 C CG . LEU B 1 139 ? 12.253 21.890 34.088 1.00 48.09 ? 141 LEU B CG 1 +ATOM 2882 C CD1 . LEU B 1 139 ? 13.672 21.781 33.582 1.00 42.55 ? 141 LEU B CD1 1 +ATOM 2883 C CD2 . LEU B 1 139 ? 12.247 22.083 35.594 1.00 46.56 ? 141 LEU B CD2 1 +ATOM 2884 N N . GLU B 1 140 ? 10.309 25.568 32.103 1.00 40.73 ? 142 GLU B N 1 +ATOM 2885 C CA . GLU B 1 140 ? 10.291 26.394 30.914 1.00 42.26 ? 142 GLU B CA 1 +ATOM 2886 C C . GLU B 1 140 ? 11.404 25.992 29.953 1.00 42.21 ? 142 GLU B C 1 +ATOM 2887 O O . GLU B 1 140 ? 12.396 25.376 30.351 1.00 45.01 ? 142 GLU B O 1 +ATOM 2888 C CB . GLU B 1 140 ? 10.484 27.843 31.289 1.00 47.49 ? 142 GLU B CB 1 +ATOM 2889 C CG . GLU B 1 140 ? 9.289 28.510 31.965 1.00 54.34 ? 142 GLU B CG 1 +ATOM 2890 C CD . GLU B 1 140 ? 9.519 29.965 32.361 1.00 56.26 ? 142 GLU B CD 1 +ATOM 2891 O OE1 . GLU B 1 140 ? 10.079 30.722 31.577 1.00 58.80 ? 142 GLU B OE1 1 +ATOM 2892 O OE2 . GLU B 1 140 ? 9.123 30.359 33.457 1.00 61.87 ? 142 GLU B OE2 1 +ATOM 2893 N N . TYR B 1 141 ? 11.250 26.282 28.661 1.00 36.53 ? 143 TYR B N 1 +ATOM 2894 C CA . TYR B 1 141 ? 12.304 25.978 27.724 1.00 33.51 ? 143 TYR B CA 1 +ATOM 2895 C C . TYR B 1 141 ? 13.176 27.227 27.565 1.00 35.43 ? 143 TYR B C 1 +ATOM 2896 O O . TYR B 1 141 ? 13.139 28.070 26.649 1.00 26.32 ? 143 TYR B O 1 +ATOM 2897 C CB . TYR B 1 141 ? 11.701 25.579 26.419 1.00 32.74 ? 143 TYR B CB 1 +ATOM 2898 C CG . TYR B 1 141 ? 12.755 25.008 25.490 1.00 30.31 ? 143 TYR B CG 1 +ATOM 2899 C CD1 . TYR B 1 141 ? 13.342 23.769 25.762 1.00 28.20 ? 143 TYR B CD1 1 +ATOM 2900 C CD2 . TYR B 1 141 ? 13.099 25.725 24.350 1.00 32.57 ? 143 TYR B CD2 1 +ATOM 2901 C CE1 . TYR B 1 141 ? 14.280 23.228 24.874 1.00 26.50 ? 143 TYR B CE1 1 +ATOM 2902 C CE2 . TYR B 1 141 ? 14.040 25.187 23.473 1.00 34.64 ? 143 TYR B CE2 1 +ATOM 2903 C CZ . TYR B 1 141 ? 14.609 23.940 23.741 1.00 24.86 ? 143 TYR B CZ 1 +ATOM 2904 O OH . TYR B 1 141 ? 15.436 23.394 22.811 1.00 22.76 ? 143 TYR B OH 1 +ATOM 2905 N N . ASN B 1 142 ? 13.957 27.272 28.635 1.00 34.52 ? 144 ASN B N 1 +ATOM 2906 C CA . ASN B 1 142 ? 14.887 28.341 28.792 1.00 37.54 ? 144 ASN B CA 1 +ATOM 2907 C C . ASN B 1 142 ? 16.004 27.955 29.747 1.00 38.19 ? 144 ASN B C 1 +ATOM 2908 O O . ASN B 1 142 ? 15.935 26.975 30.489 1.00 34.72 ? 144 ASN B O 1 +ATOM 2909 C CB . ASN B 1 142 ? 14.107 29.577 29.258 1.00 32.82 ? 144 ASN B CB 1 +ATOM 2910 C CG . ASN B 1 142 ? 13.527 29.541 30.649 1.00 34.52 ? 144 ASN B CG 1 +ATOM 2911 O OD1 . ASN B 1 142 ? 13.744 28.641 31.459 1.00 38.70 ? 144 ASN B OD1 1 +ATOM 2912 N ND2 . ASN B 1 142 ? 12.767 30.584 30.940 1.00 33.59 ? 144 ASN B ND2 1 +ATOM 2913 N N . TYR B 1 143 ? 17.061 28.769 29.709 1.00 40.94 ? 145 TYR B N 1 +ATOM 2914 C CA . TYR B 1 143 ? 18.185 28.522 30.580 1.00 38.91 ? 145 TYR B CA 1 +ATOM 2915 C C . TYR B 1 143 ? 18.799 29.823 31.030 1.00 35.98 ? 145 TYR B C 1 +ATOM 2916 O O . TYR B 1 143 ? 18.908 30.772 30.260 1.00 36.18 ? 145 TYR B O 1 +ATOM 2917 C CB . TYR B 1 143 ? 19.199 27.701 29.831 1.00 40.25 ? 145 TYR B CB 1 +ATOM 2918 C CG . TYR B 1 143 ? 19.848 26.701 30.753 1.00 41.13 ? 145 TYR B CG 1 +ATOM 2919 C CD1 . TYR B 1 143 ? 19.159 25.512 30.990 1.00 37.12 ? 145 TYR B CD1 1 +ATOM 2920 C CD2 . TYR B 1 143 ? 21.106 26.943 31.334 1.00 37.41 ? 145 TYR B CD2 1 +ATOM 2921 C CE1 . TYR B 1 143 ? 19.730 24.556 31.817 1.00 34.00 ? 145 TYR B CE1 1 +ATOM 2922 C CE2 . TYR B 1 143 ? 21.673 25.973 32.160 1.00 32.58 ? 145 TYR B CE2 1 +ATOM 2923 C CZ . TYR B 1 143 ? 20.975 24.790 32.389 1.00 31.66 ? 145 TYR B CZ 1 +ATOM 2924 O OH . TYR B 1 143 ? 21.501 23.818 33.192 1.00 36.85 ? 145 TYR B OH 1 +ATOM 2925 N N . ASN B 1 144 ? 19.229 29.809 32.287 1.00 33.11 ? 146 ASN B N 1 +ATOM 2926 C CA . ASN B 1 144 ? 19.858 30.965 32.914 1.00 35.60 ? 146 ASN B CA 1 +ATOM 2927 C C . ASN B 1 144 ? 21.390 30.912 33.041 1.00 36.42 ? 146 ASN B C 1 +ATOM 2928 O O . ASN B 1 144 ? 22.030 29.929 32.665 1.00 32.33 ? 146 ASN B O 1 +ATOM 2929 C CB . ASN B 1 144 ? 19.207 31.141 34.292 1.00 34.48 ? 146 ASN B CB 1 +ATOM 2930 C CG . ASN B 1 144 ? 17.681 31.168 34.216 1.00 35.36 ? 146 ASN B CG 1 +ATOM 2931 O OD1 . ASN B 1 144 ? 17.061 32.054 33.627 1.00 38.41 ? 146 ASN B OD1 1 +ATOM 2932 N ND2 . ASN B 1 144 ? 17.024 30.168 34.783 1.00 35.36 ? 146 ASN B ND2 1 +ATOM 2933 N N . SER B 1 145 ? 22.026 31.973 33.558 1.00 42.01 ? 147 SER B N 1 +ATOM 2934 C CA . SER B 1 145 ? 23.483 31.998 33.787 1.00 42.22 ? 147 SER B CA 1 +ATOM 2935 C C . SER B 1 145 ? 23.896 31.294 35.051 1.00 40.59 ? 147 SER B C 1 +ATOM 2936 O O . SER B 1 145 ? 23.308 31.467 36.117 1.00 41.66 ? 147 SER B O 1 +ATOM 2937 C CB . SER B 1 145 ? 24.081 33.368 33.973 1.00 40.20 ? 147 SER B CB 1 +ATOM 2938 O OG . SER B 1 145 ? 24.068 34.163 32.816 1.00 48.47 ? 147 SER B OG 1 +ATOM 2939 N N . HIS B 1 146 ? 24.942 30.492 34.957 1.00 43.00 ? 148 HIS B N 1 +ATOM 2940 C CA . HIS B 1 146 ? 25.461 29.862 36.159 1.00 43.81 ? 148 HIS B CA 1 +ATOM 2941 C C . HIS B 1 146 ? 26.972 29.985 36.202 1.00 44.16 ? 148 HIS B C 1 +ATOM 2942 O O . HIS B 1 146 ? 27.637 30.242 35.198 1.00 41.49 ? 148 HIS B O 1 +ATOM 2943 C CB . HIS B 1 146 ? 25.058 28.384 36.201 1.00 44.89 ? 148 HIS B CB 1 +ATOM 2944 C CG . HIS B 1 146 ? 23.545 28.259 36.121 1.00 41.51 ? 148 HIS B CG 1 +ATOM 2945 N ND1 . HIS B 1 146 ? 22.835 27.977 35.044 1.00 37.03 ? 148 HIS B ND1 1 +ATOM 2946 C CD2 . HIS B 1 146 ? 22.698 28.520 37.159 1.00 39.81 ? 148 HIS B CD2 1 +ATOM 2947 C CE1 . HIS B 1 146 ? 21.590 28.071 35.401 1.00 40.93 ? 148 HIS B CE1 1 +ATOM 2948 N NE2 . HIS B 1 146 ? 21.507 28.396 36.662 1.00 40.03 ? 148 HIS B NE2 1 +ATOM 2949 N N . ASN B 1 147 ? 27.499 29.883 37.422 1.00 44.68 ? 149 ASN B N 1 +ATOM 2950 C CA . ASN B 1 147 ? 28.936 29.818 37.629 1.00 43.73 ? 149 ASN B CA 1 +ATOM 2951 C C . ASN B 1 147 ? 29.311 28.418 38.103 1.00 41.64 ? 149 ASN B C 1 +ATOM 2952 O O . ASN B 1 147 ? 28.820 27.940 39.119 1.00 44.15 ? 149 ASN B O 1 +ATOM 2953 C CB . ASN B 1 147 ? 29.379 30.816 38.674 1.00 43.40 ? 149 ASN B CB 1 +ATOM 2954 C CG . ASN B 1 147 ? 29.151 32.263 38.296 1.00 40.72 ? 149 ASN B CG 1 +ATOM 2955 O OD1 . ASN B 1 147 ? 28.792 33.056 39.158 1.00 43.56 ? 149 ASN B OD1 1 +ATOM 2956 N ND2 . ASN B 1 147 ? 29.351 32.659 37.044 1.00 37.60 ? 149 ASN B ND2 1 +ATOM 2957 N N . VAL B 1 148 ? 30.155 27.727 37.346 1.00 39.05 ? 150 VAL B N 1 +ATOM 2958 C CA . VAL B 1 148 ? 30.610 26.393 37.686 1.00 36.25 ? 150 VAL B CA 1 +ATOM 2959 C C . VAL B 1 148 ? 31.899 26.549 38.478 1.00 39.78 ? 150 VAL B C 1 +ATOM 2960 O O . VAL B 1 148 ? 32.967 26.674 37.887 1.00 38.14 ? 150 VAL B O 1 +ATOM 2961 C CB . VAL B 1 148 ? 30.834 25.623 36.381 1.00 34.23 ? 150 VAL B CB 1 +ATOM 2962 C CG1 . VAL B 1 148 ? 31.451 24.255 36.613 1.00 40.76 ? 150 VAL B CG1 1 +ATOM 2963 C CG2 . VAL B 1 148 ? 29.508 25.468 35.721 1.00 24.91 ? 150 VAL B CG2 1 +ATOM 2964 N N . TYR B 1 149 ? 31.825 26.595 39.816 1.00 43.80 ? 151 TYR B N 1 +ATOM 2965 C CA . TYR B 1 149 ? 33.003 26.713 40.663 1.00 44.68 ? 151 TYR B CA 1 +ATOM 2966 C C . TYR B 1 149 ? 33.807 25.429 40.602 1.00 44.64 ? 151 TYR B C 1 +ATOM 2967 O O . TYR B 1 149 ? 33.329 24.368 41.010 1.00 40.95 ? 151 TYR B O 1 +ATOM 2968 C CB . TYR B 1 149 ? 32.594 26.992 42.099 1.00 45.25 ? 151 TYR B CB 1 +ATOM 2969 C CG . TYR B 1 149 ? 31.893 28.337 42.159 1.00 54.12 ? 151 TYR B CG 1 +ATOM 2970 C CD1 . TYR B 1 149 ? 32.635 29.520 42.075 1.00 56.67 ? 151 TYR B CD1 1 +ATOM 2971 C CD2 . TYR B 1 149 ? 30.501 28.388 42.237 1.00 55.64 ? 151 TYR B CD2 1 +ATOM 2972 C CE1 . TYR B 1 149 ? 31.978 30.755 42.057 1.00 58.58 ? 151 TYR B CE1 1 +ATOM 2973 C CE2 . TYR B 1 149 ? 29.847 29.619 42.219 1.00 58.96 ? 151 TYR B CE2 1 +ATOM 2974 C CZ . TYR B 1 149 ? 30.588 30.797 42.127 1.00 58.53 ? 151 TYR B CZ 1 +ATOM 2975 O OH . TYR B 1 149 ? 29.933 32.014 42.086 1.00 60.23 ? 151 TYR B OH 1 +ATOM 2976 N N . ILE B 1 150 ? 35.017 25.550 40.021 1.00 44.43 ? 152 ILE B N 1 +ATOM 2977 C CA . ILE B 1 150 ? 35.967 24.440 39.887 1.00 44.57 ? 152 ILE B CA 1 +ATOM 2978 C C . ILE B 1 150 ? 37.103 24.561 40.902 1.00 45.74 ? 152 ILE B C 1 +ATOM 2979 O O . ILE B 1 150 ? 37.613 25.643 41.214 1.00 45.07 ? 152 ILE B O 1 +ATOM 2980 C CB . ILE B 1 150 ? 36.558 24.400 38.454 1.00 42.96 ? 152 ILE B CB 1 +ATOM 2981 C CG1 . ILE B 1 150 ? 35.433 24.225 37.456 1.00 34.90 ? 152 ILE B CG1 1 +ATOM 2982 C CG2 . ILE B 1 150 ? 37.522 23.216 38.285 1.00 41.98 ? 152 ILE B CG2 1 +ATOM 2983 C CD1 . ILE B 1 150 ? 35.935 24.651 36.090 1.00 38.34 ? 152 ILE B CD1 1 +ATOM 2984 N N . THR B 1 151 ? 37.424 23.374 41.424 1.00 46.93 ? 153 THR B N 1 +ATOM 2985 C CA . THR B 1 151 ? 38.492 23.169 42.391 1.00 50.54 ? 153 THR B CA 1 +ATOM 2986 C C . THR B 1 151 ? 39.260 21.888 42.066 1.00 51.20 ? 153 THR B C 1 +ATOM 2987 O O . THR B 1 151 ? 38.701 20.909 41.558 1.00 55.61 ? 153 THR B O 1 +ATOM 2988 C CB . THR B 1 151 ? 37.870 23.129 43.828 1.00 51.07 ? 153 THR B CB 1 +ATOM 2989 O OG1 . THR B 1 151 ? 38.987 23.054 44.691 1.00 53.62 ? 153 THR B OG1 1 +ATOM 2990 C CG2 . THR B 1 151 ? 36.898 21.990 44.102 1.00 44.35 ? 153 THR B CG2 1 +ATOM 2991 N N . ALA B 1 152 ? 40.572 21.858 42.315 1.00 52.00 ? 154 ALA B N 1 +ATOM 2992 C CA . ALA B 1 152 ? 41.333 20.642 42.053 1.00 51.49 ? 154 ALA B CA 1 +ATOM 2993 C C . ALA B 1 152 ? 41.065 19.516 43.052 1.00 51.44 ? 154 ALA B C 1 +ATOM 2994 O O . ALA B 1 152 ? 40.738 19.687 44.237 1.00 51.05 ? 154 ALA B O 1 +ATOM 2995 C CB . ALA B 1 152 ? 42.827 20.935 42.069 1.00 51.52 ? 154 ALA B CB 1 +ATOM 2996 N N . ASP B 1 153 ? 41.173 18.328 42.473 1.00 50.31 ? 155 ASP B N 1 +ATOM 2997 C CA . ASP B 1 153 ? 41.049 17.078 43.193 1.00 51.56 ? 155 ASP B CA 1 +ATOM 2998 C C . ASP B 1 153 ? 42.340 16.400 42.767 1.00 53.52 ? 155 ASP B C 1 +ATOM 2999 O O . ASP B 1 153 ? 42.447 15.657 41.798 1.00 52.33 ? 155 ASP B O 1 +ATOM 3000 C CB . ASP B 1 153 ? 39.815 16.364 42.688 1.00 50.16 ? 155 ASP B CB 1 +ATOM 3001 C CG . ASP B 1 153 ? 39.493 15.005 43.298 1.00 50.23 ? 155 ASP B CG 1 +ATOM 3002 O OD1 . ASP B 1 153 ? 39.724 14.822 44.502 1.00 42.33 ? 155 ASP B OD1 1 +ATOM 3003 O OD2 . ASP B 1 153 ? 38.984 14.148 42.549 1.00 40.26 ? 155 ASP B OD2 1 +ATOM 3004 N N . LYS B 1 154 ? 43.387 16.812 43.472 1.00 58.08 ? 156 LYS B N 1 +ATOM 3005 C CA . LYS B 1 154 ? 44.768 16.436 43.242 1.00 60.38 ? 156 LYS B CA 1 +ATOM 3006 C C . LYS B 1 154 ? 45.028 14.952 43.226 1.00 62.14 ? 156 LYS B C 1 +ATOM 3007 O O . LYS B 1 154 ? 45.861 14.513 42.442 1.00 65.79 ? 156 LYS B O 1 +ATOM 3008 C CB . LYS B 1 154 ? 45.625 17.071 44.315 1.00 64.70 ? 156 LYS B CB 1 +ATOM 3009 C CG . LYS B 1 154 ? 47.001 17.468 43.829 1.00 68.46 ? 156 LYS B CG 1 +ATOM 3010 C CD . LYS B 1 154 ? 47.970 17.785 44.982 1.00 69.28 ? 156 LYS B CD 1 +ATOM 3011 C CE . LYS B 1 154 ? 49.233 18.515 44.468 1.00 66.70 ? 156 LYS B CE 1 +ATOM 3012 N NZ . LYS B 1 154 ? 49.887 17.833 43.357 1.00 55.54 ? 156 LYS B NZ 1 +ATOM 3013 N N . GLN B 1 155 ? 44.318 14.173 44.055 1.00 63.59 ? 157 GLN B N 1 +ATOM 3014 C CA . GLN B 1 155 ? 44.518 12.731 44.167 1.00 61.62 ? 157 GLN B CA 1 +ATOM 3015 C C . GLN B 1 155 ? 43.945 11.878 43.054 1.00 59.30 ? 157 GLN B C 1 +ATOM 3016 O O . GLN B 1 155 ? 44.447 10.773 42.818 1.00 58.58 ? 157 GLN B O 1 +ATOM 3017 C CB . GLN B 1 155 ? 43.932 12.219 45.466 1.00 68.08 ? 157 GLN B CB 1 +ATOM 3018 C CG . GLN B 1 155 ? 44.536 10.889 45.916 1.00 72.57 ? 157 GLN B CG 1 +ATOM 3019 C CD . GLN B 1 155 ? 45.858 11.058 46.656 1.00 77.54 ? 157 GLN B CD 1 +ATOM 3020 O OE1 . GLN B 1 155 ? 46.086 10.423 47.686 1.00 79.03 ? 157 GLN B OE1 1 +ATOM 3021 N NE2 . GLN B 1 155 ? 46.780 11.903 46.192 1.00 78.08 ? 157 GLN B NE2 1 +ATOM 3022 N N . LYS B 1 156 ? 42.865 12.310 42.390 1.00 52.77 ? 158 LYS B N 1 +ATOM 3023 C CA . LYS B 1 156 ? 42.380 11.505 41.275 1.00 48.74 ? 158 LYS B CA 1 +ATOM 3024 C C . LYS B 1 156 ? 42.959 12.025 39.979 1.00 44.07 ? 158 LYS B C 1 +ATOM 3025 O O . LYS B 1 156 ? 42.723 11.472 38.909 1.00 40.39 ? 158 LYS B O 1 +ATOM 3026 C CB . LYS B 1 156 ? 40.833 11.526 41.177 1.00 53.74 ? 158 LYS B CB 1 +ATOM 3027 C CG . LYS B 1 156 ? 39.927 10.743 42.171 1.00 55.54 ? 158 LYS B CG 1 +ATOM 3028 C CD . LYS B 1 156 ? 40.155 11.240 43.593 1.00 60.48 ? 158 LYS B CD 1 +ATOM 3029 C CE . LYS B 1 156 ? 38.994 11.106 44.546 1.00 60.54 ? 158 LYS B CE 1 +ATOM 3030 N NZ . LYS B 1 156 ? 39.352 11.877 45.728 1.00 66.29 ? 158 LYS B NZ 1 +ATOM 3031 N N . ASN B 1 157 ? 43.770 13.081 40.130 1.00 44.90 ? 159 ASN B N 1 +ATOM 3032 C CA . ASN B 1 157 ? 44.458 13.876 39.102 1.00 46.49 ? 159 ASN B CA 1 +ATOM 3033 C C . ASN B 1 157 ? 43.424 14.703 38.302 1.00 44.73 ? 159 ASN B C 1 +ATOM 3034 O O . ASN B 1 157 ? 43.600 15.055 37.124 1.00 39.91 ? 159 ASN B O 1 +ATOM 3035 C CB . ASN B 1 157 ? 45.290 12.889 38.211 1.00 38.69 ? 159 ASN B CB 1 +ATOM 3036 C CG . ASN B 1 157 ? 46.413 13.473 37.345 1.00 42.10 ? 159 ASN B CG 1 +ATOM 3037 O OD1 . ASN B 1 157 ? 46.944 14.574 37.548 1.00 38.32 ? 159 ASN B OD1 1 +ATOM 3038 N ND2 . ASN B 1 157 ? 46.795 12.694 36.329 1.00 41.22 ? 159 ASN B ND2 1 +ATOM 3039 N N . GLY B 1 158 ? 42.324 15.087 38.974 1.00 44.27 ? 160 GLY B N 1 +ATOM 3040 C CA . GLY B 1 158 ? 41.258 15.730 38.233 1.00 45.36 ? 160 GLY B CA 1 +ATOM 3041 C C . GLY B 1 158 ? 40.728 16.934 38.947 1.00 46.24 ? 160 GLY B C 1 +ATOM 3042 O O . GLY B 1 158 ? 41.451 17.594 39.700 1.00 48.87 ? 160 GLY B O 1 +ATOM 3043 N N . ILE B 1 159 ? 39.462 17.240 38.672 1.00 46.63 ? 161 ILE B N 1 +ATOM 3044 C CA . ILE B 1 159 ? 38.819 18.393 39.293 1.00 46.28 ? 161 ILE B CA 1 +ATOM 3045 C C . ILE B 1 159 ? 37.457 18.018 39.844 1.00 45.82 ? 161 ILE B C 1 +ATOM 3046 O O . ILE B 1 159 ? 36.938 16.918 39.669 1.00 40.62 ? 161 ILE B O 1 +ATOM 3047 C CB . ILE B 1 159 ? 38.671 19.578 38.273 1.00 46.76 ? 161 ILE B CB 1 +ATOM 3048 C CG1 . ILE B 1 159 ? 37.879 19.204 37.020 1.00 44.42 ? 161 ILE B CG1 1 +ATOM 3049 C CG2 . ILE B 1 159 ? 40.070 20.019 37.877 1.00 42.33 ? 161 ILE B CG2 1 +ATOM 3050 C CD1 . ILE B 1 159 ? 36.550 19.968 36.903 1.00 43.41 ? 161 ILE B CD1 1 +ATOM 3051 N N . LYS B 1 160 ? 36.930 18.949 40.616 1.00 48.18 ? 162 LYS B N 1 +ATOM 3052 C CA . LYS B 1 160 ? 35.580 18.822 41.145 1.00 55.62 ? 162 LYS B CA 1 +ATOM 3053 C C . LYS B 1 160 ? 34.870 20.154 40.886 1.00 54.66 ? 162 LYS B C 1 +ATOM 3054 O O . LYS B 1 160 ? 35.489 21.220 40.869 1.00 55.20 ? 162 LYS B O 1 +ATOM 3055 C CB . LYS B 1 160 ? 35.637 18.494 42.658 1.00 58.39 ? 162 LYS B CB 1 +ATOM 3056 C CG . LYS B 1 160 ? 36.105 17.062 42.931 1.00 62.07 ? 162 LYS B CG 1 +ATOM 3057 C CD . LYS B 1 160 ? 36.526 16.825 44.377 1.00 63.13 ? 162 LYS B CD 1 +ATOM 3058 C CE . LYS B 1 160 ? 35.389 16.524 45.330 1.00 67.70 ? 162 LYS B CE 1 +ATOM 3059 N NZ . LYS B 1 160 ? 34.816 15.230 45.010 1.00 65.11 ? 162 LYS B NZ 1 +ATOM 3060 N N . ALA B 1 161 ? 33.574 20.103 40.584 1.00 55.18 ? 163 ALA B N 1 +ATOM 3061 C CA . ALA B 1 161 ? 32.829 21.325 40.354 1.00 57.36 ? 163 ALA B CA 1 +ATOM 3062 C C . ALA B 1 161 ? 31.471 21.197 40.998 1.00 57.79 ? 163 ALA B C 1 +ATOM 3063 O O . ALA B 1 161 ? 30.863 20.130 41.036 1.00 56.87 ? 163 ALA B O 1 +ATOM 3064 C CB . ALA B 1 161 ? 32.656 21.579 38.872 1.00 60.80 ? 163 ALA B CB 1 +ATOM 3065 N N . ASN B 1 162 ? 31.061 22.325 41.567 1.00 57.83 ? 164 ASN B N 1 +ATOM 3066 C CA . ASN B 1 162 ? 29.846 22.419 42.354 1.00 59.77 ? 164 ASN B CA 1 +ATOM 3067 C C . ASN B 1 162 ? 29.118 23.633 41.853 1.00 59.06 ? 164 ASN B C 1 +ATOM 3068 O O . ASN B 1 162 ? 29.713 24.696 41.626 1.00 61.13 ? 164 ASN B O 1 +ATOM 3069 C CB . ASN B 1 162 ? 30.117 22.639 43.855 1.00 62.37 ? 164 ASN B CB 1 +ATOM 3070 C CG . ASN B 1 162 ? 30.859 21.505 44.567 1.00 67.31 ? 164 ASN B CG 1 +ATOM 3071 O OD1 . ASN B 1 162 ? 30.293 20.824 45.425 1.00 69.84 ? 164 ASN B OD1 1 +ATOM 3072 N ND2 . ASN B 1 162 ? 32.143 21.271 44.269 1.00 66.77 ? 164 ASN B ND2 1 +ATOM 3073 N N . PHE B 1 163 ? 27.818 23.417 41.639 1.00 55.15 ? 165 PHE B N 1 +ATOM 3074 C CA . PHE B 1 163 ? 26.922 24.487 41.229 1.00 49.81 ? 165 PHE B CA 1 +ATOM 3075 C C . PHE B 1 163 ? 25.475 24.058 41.212 1.00 49.02 ? 165 PHE B C 1 +ATOM 3076 O O . PHE B 1 163 ? 25.124 22.904 40.990 1.00 45.29 ? 165 PHE B O 1 +ATOM 3077 C CB . PHE B 1 163 ? 27.283 25.032 39.831 1.00 44.01 ? 165 PHE B CB 1 +ATOM 3078 C CG . PHE B 1 163 ? 27.376 24.020 38.702 1.00 42.52 ? 165 PHE B CG 1 +ATOM 3079 C CD1 . PHE B 1 163 ? 28.500 23.191 38.609 1.00 45.30 ? 165 PHE B CD1 1 +ATOM 3080 C CD2 . PHE B 1 163 ? 26.356 23.939 37.752 1.00 37.92 ? 165 PHE B CD2 1 +ATOM 3081 C CE1 . PHE B 1 163 ? 28.616 22.280 37.565 1.00 39.55 ? 165 PHE B CE1 1 +ATOM 3082 C CE2 . PHE B 1 163 ? 26.478 23.028 36.717 1.00 42.17 ? 165 PHE B CE2 1 +ATOM 3083 C CZ . PHE B 1 163 ? 27.607 22.200 36.620 1.00 42.56 ? 165 PHE B CZ 1 +ATOM 3084 N N . LYS B 1 164 ? 24.648 25.072 41.470 1.00 53.46 ? 166 LYS B N 1 +ATOM 3085 C CA . LYS B 1 164 ? 23.199 24.927 41.457 1.00 52.17 ? 166 LYS B CA 1 +ATOM 3086 C C . LYS B 1 164 ? 22.622 25.652 40.237 1.00 46.54 ? 166 LYS B C 1 +ATOM 3087 O O . LYS B 1 164 ? 22.768 26.874 40.136 1.00 48.23 ? 166 LYS B O 1 +ATOM 3088 C CB . LYS B 1 164 ? 22.613 25.517 42.762 1.00 56.29 ? 166 LYS B CB 1 +ATOM 3089 C CG . LYS B 1 164 ? 23.077 24.772 44.001 1.00 60.91 ? 166 LYS B CG 1 +ATOM 3090 C CD . LYS B 1 164 ? 22.941 25.562 45.292 1.00 70.40 ? 166 LYS B CD 1 +ATOM 3091 C CE . LYS B 1 164 ? 21.493 25.677 45.786 1.00 76.56 ? 166 LYS B CE 1 +ATOM 3092 N NZ . LYS B 1 164 ? 20.936 24.377 46.133 1.00 78.43 ? 166 LYS B NZ 1 +ATOM 3093 N N . ILE B 1 165 ? 22.026 24.879 39.310 1.00 36.54 ? 167 ILE B N 1 +ATOM 3094 C CA . ILE B 1 165 ? 21.276 25.358 38.149 1.00 36.71 ? 167 ILE B CA 1 +ATOM 3095 C C . ILE B 1 165 ? 19.879 25.775 38.595 1.00 38.16 ? 167 ILE B C 1 +ATOM 3096 O O . ILE B 1 165 ? 19.204 25.066 39.330 1.00 38.07 ? 167 ILE B O 1 +ATOM 3097 C CB . ILE B 1 165 ? 21.062 24.278 37.029 1.00 33.75 ? 167 ILE B CB 1 +ATOM 3098 C CG1 . ILE B 1 165 ? 22.411 23.863 36.419 1.00 33.98 ? 167 ILE B CG1 1 +ATOM 3099 C CG2 . ILE B 1 165 ? 20.113 24.808 35.952 1.00 25.51 ? 167 ILE B CG2 1 +ATOM 3100 C CD1 . ILE B 1 165 ? 23.194 24.814 35.520 1.00 18.68 ? 167 ILE B CD1 1 +ATOM 3101 N N . ARG B 1 166 ? 19.459 26.941 38.110 1.00 37.84 ? 168 ARG B N 1 +ATOM 3102 C CA . ARG B 1 166 ? 18.143 27.503 38.334 1.00 37.58 ? 168 ARG B CA 1 +ATOM 3103 C C . ARG B 1 166 ? 17.376 27.273 37.047 1.00 37.83 ? 168 ARG B C 1 +ATOM 3104 O O . ARG B 1 166 ? 17.722 27.774 35.967 1.00 36.69 ? 168 ARG B O 1 +ATOM 3105 C CB . ARG B 1 166 ? 18.222 29.005 38.615 1.00 34.42 ? 168 ARG B CB 1 +ATOM 3106 C CG . ARG B 1 166 ? 19.142 29.354 39.789 1.00 35.28 ? 168 ARG B CG 1 +ATOM 3107 C CD . ARG B 1 166 ? 19.242 30.866 39.961 1.00 42.58 ? 168 ARG B CD 1 +ATOM 3108 N NE . ARG B 1 166 ? 19.573 31.559 38.715 1.00 42.54 ? 168 ARG B NE 1 +ATOM 3109 C CZ . ARG B 1 166 ? 20.828 31.618 38.223 1.00 48.24 ? 168 ARG B CZ 1 +ATOM 3110 N NH1 . ARG B 1 166 ? 21.878 31.046 38.848 1.00 44.11 ? 168 ARG B NH1 1 +ATOM 3111 N NH2 . ARG B 1 166 ? 21.023 32.247 37.061 1.00 42.37 ? 168 ARG B NH2 1 +ATOM 3112 N N . HIS B 1 167 ? 16.396 26.378 37.216 1.00 39.09 ? 169 HIS B N 1 +ATOM 3113 C CA . HIS B 1 167 ? 15.447 26.026 36.166 1.00 40.99 ? 169 HIS B CA 1 +ATOM 3114 C C . HIS B 1 167 ? 14.153 26.784 36.407 1.00 39.81 ? 169 HIS B C 1 +ATOM 3115 O O . HIS B 1 167 ? 13.510 26.641 37.452 1.00 39.33 ? 169 HIS B O 1 +ATOM 3116 C CB . HIS B 1 167 ? 15.122 24.554 36.186 1.00 39.08 ? 169 HIS B CB 1 +ATOM 3117 C CG . HIS B 1 167 ? 16.215 23.665 35.680 1.00 34.44 ? 169 HIS B CG 1 +ATOM 3118 N ND1 . HIS B 1 167 ? 16.714 22.622 36.329 1.00 37.54 ? 169 HIS B ND1 1 +ATOM 3119 C CD2 . HIS B 1 167 ? 16.828 23.815 34.464 1.00 35.20 ? 169 HIS B CD2 1 +ATOM 3120 C CE1 . HIS B 1 167 ? 17.628 22.131 35.521 1.00 36.62 ? 169 HIS B CE1 1 +ATOM 3121 N NE2 . HIS B 1 167 ? 17.696 22.844 34.404 1.00 35.01 ? 169 HIS B NE2 1 +ATOM 3122 N N . ASN B 1 168 ? 13.789 27.638 35.461 1.00 40.33 ? 170 ASN B N 1 +ATOM 3123 C CA . ASN B 1 168 ? 12.573 28.390 35.603 1.00 39.85 ? 170 ASN B CA 1 +ATOM 3124 C C . ASN B 1 168 ? 11.360 27.581 35.206 1.00 41.75 ? 170 ASN B C 1 +ATOM 3125 O O . ASN B 1 168 ? 11.324 27.018 34.119 1.00 43.86 ? 170 ASN B O 1 +ATOM 3126 C CB . ASN B 1 168 ? 12.702 29.641 34.766 1.00 38.99 ? 170 ASN B CB 1 +ATOM 3127 C CG . ASN B 1 168 ? 13.551 30.684 35.465 1.00 40.36 ? 170 ASN B CG 1 +ATOM 3128 O OD1 . ASN B 1 168 ? 14.065 30.515 36.584 1.00 38.58 ? 170 ASN B OD1 1 +ATOM 3129 N ND2 . ASN B 1 168 ? 13.681 31.810 34.762 1.00 41.27 ? 170 ASN B ND2 1 +ATOM 3130 N N . ILE B 1 169 ? 10.372 27.540 36.114 1.00 47.93 ? 171 ILE B N 1 +ATOM 3131 C CA . ILE B 1 169 ? 9.115 26.803 35.976 1.00 49.76 ? 171 ILE B CA 1 +ATOM 3132 C C . ILE B 1 169 ? 8.017 27.719 35.452 1.00 53.45 ? 171 ILE B C 1 +ATOM 3133 O O . ILE B 1 169 ? 8.037 28.913 35.745 1.00 50.98 ? 171 ILE B O 1 +ATOM 3134 C CB . ILE B 1 169 ? 8.694 26.239 37.335 1.00 50.77 ? 171 ILE B CB 1 +ATOM 3135 C CG1 . ILE B 1 169 ? 9.877 25.620 38.096 1.00 51.26 ? 171 ILE B CG1 1 +ATOM 3136 C CG2 . ILE B 1 169 ? 7.632 25.185 37.091 1.00 51.89 ? 171 ILE B CG2 1 +ATOM 3137 C CD1 . ILE B 1 169 ? 10.660 24.589 37.269 1.00 50.62 ? 171 ILE B CD1 1 +ATOM 3138 N N . GLU B 1 170 ? 7.072 27.149 34.672 1.00 57.85 ? 172 GLU B N 1 +ATOM 3139 C CA . GLU B 1 170 ? 5.948 27.847 34.042 1.00 59.62 ? 172 GLU B CA 1 +ATOM 3140 C C . GLU B 1 170 ? 5.010 28.583 35.014 1.00 59.01 ? 172 GLU B C 1 +ATOM 3141 O O . GLU B 1 170 ? 4.476 29.634 34.662 1.00 62.34 ? 172 GLU B O 1 +ATOM 3142 C CB . GLU B 1 170 ? 5.140 26.825 33.177 1.00 61.54 ? 172 GLU B CB 1 +ATOM 3143 C CG . GLU B 1 170 ? 4.069 25.929 33.871 1.00 65.33 ? 172 GLU B CG 1 +ATOM 3144 C CD . GLU B 1 170 ? 4.173 24.393 33.760 1.00 64.15 ? 172 GLU B CD 1 +ATOM 3145 O OE1 . GLU B 1 170 ? 4.337 23.880 32.643 1.00 55.57 ? 172 GLU B OE1 1 +ATOM 3146 O OE2 . GLU B 1 170 ? 4.071 23.724 34.804 1.00 58.28 ? 172 GLU B OE2 1 +ATOM 3147 N N . ASP B 1 171 ? 4.802 28.106 36.244 1.00 57.90 ? 173 ASP B N 1 +ATOM 3148 C CA . ASP B 1 171 ? 3.989 28.778 37.254 1.00 58.34 ? 173 ASP B CA 1 +ATOM 3149 C C . ASP B 1 171 ? 4.644 30.015 37.903 1.00 58.78 ? 173 ASP B C 1 +ATOM 3150 O O . ASP B 1 171 ? 3.975 30.819 38.565 1.00 59.19 ? 173 ASP B O 1 +ATOM 3151 C CB . ASP B 1 171 ? 3.639 27.766 38.347 1.00 56.85 ? 173 ASP B CB 1 +ATOM 3152 C CG . ASP B 1 171 ? 4.809 27.377 39.248 1.00 56.38 ? 173 ASP B CG 1 +ATOM 3153 O OD1 . ASP B 1 171 ? 5.928 27.277 38.763 1.00 55.36 ? 173 ASP B OD1 1 +ATOM 3154 O OD2 . ASP B 1 171 ? 4.614 27.187 40.447 1.00 59.92 ? 173 ASP B OD2 1 +ATOM 3155 N N . GLY B 1 172 ? 5.976 30.144 37.776 1.00 58.69 ? 174 GLY B N 1 +ATOM 3156 C CA . GLY B 1 172 ? 6.726 31.262 38.346 1.00 55.27 ? 174 GLY B CA 1 +ATOM 3157 C C . GLY B 1 172 ? 7.761 30.847 39.391 1.00 54.25 ? 174 GLY B C 1 +ATOM 3158 O O . GLY B 1 172 ? 8.484 31.705 39.907 1.00 53.89 ? 174 GLY B O 1 +ATOM 3159 N N . SER B 1 173 ? 7.860 29.551 39.736 1.00 49.33 ? 175 SER B N 1 +ATOM 3160 C CA . SER B 1 173 ? 8.871 29.084 40.675 1.00 46.12 ? 175 SER B CA 1 +ATOM 3161 C C . SER B 1 173 ? 10.178 28.704 39.978 1.00 44.01 ? 175 SER B C 1 +ATOM 3162 O O . SER B 1 173 ? 10.322 28.826 38.757 1.00 42.22 ? 175 SER B O 1 +ATOM 3163 C CB . SER B 1 173 ? 8.313 27.870 41.479 1.00 50.23 ? 175 SER B CB 1 +ATOM 3164 O OG . SER B 1 173 ? 8.055 26.641 40.799 1.00 43.02 ? 175 SER B OG 1 +ATOM 3165 N N . VAL B 1 174 ? 11.175 28.290 40.773 1.00 44.01 ? 176 VAL B N 1 +ATOM 3166 C CA . VAL B 1 174 ? 12.468 27.783 40.290 1.00 41.64 ? 176 VAL B CA 1 +ATOM 3167 C C . VAL B 1 174 ? 12.789 26.417 40.919 1.00 42.44 ? 176 VAL B C 1 +ATOM 3168 O O . VAL B 1 174 ? 12.708 26.227 42.147 1.00 37.66 ? 176 VAL B O 1 +ATOM 3169 C CB . VAL B 1 174 ? 13.592 28.808 40.631 1.00 36.18 ? 176 VAL B CB 1 +ATOM 3170 C CG1 . VAL B 1 174 ? 14.911 28.310 40.111 1.00 36.01 ? 176 VAL B CG1 1 +ATOM 3171 C CG2 . VAL B 1 174 ? 13.313 30.151 39.984 1.00 35.89 ? 176 VAL B CG2 1 +ATOM 3172 N N . GLN B 1 175 ? 13.120 25.466 40.020 1.00 45.43 ? 177 GLN B N 1 +ATOM 3173 C CA . GLN B 1 175 ? 13.569 24.108 40.365 1.00 46.34 ? 177 GLN B CA 1 +ATOM 3174 C C . GLN B 1 175 ? 15.096 24.107 40.354 1.00 49.16 ? 177 GLN B C 1 +ATOM 3175 O O . GLN B 1 175 ? 15.754 24.269 39.320 1.00 49.56 ? 177 GLN B O 1 +ATOM 3176 C CB . GLN B 1 175 ? 13.062 23.110 39.348 1.00 42.50 ? 177 GLN B CB 1 +ATOM 3177 C CG . GLN B 1 175 ? 13.605 21.703 39.384 1.00 49.31 ? 177 GLN B CG 1 +ATOM 3178 C CD . GLN B 1 175 ? 13.294 20.910 40.643 1.00 56.96 ? 177 GLN B CD 1 +ATOM 3179 O OE1 . GLN B 1 175 ? 12.352 20.125 40.664 1.00 61.62 ? 177 GLN B OE1 1 +ATOM 3180 N NE2 . GLN B 1 175 ? 14.031 21.099 41.741 1.00 57.01 ? 177 GLN B NE2 1 +ATOM 3181 N N . LEU B 1 176 ? 15.652 23.925 41.548 1.00 50.51 ? 178 LEU B N 1 +ATOM 3182 C CA . LEU B 1 176 ? 17.080 23.964 41.725 1.00 50.59 ? 178 LEU B CA 1 +ATOM 3183 C C . LEU B 1 176 ? 17.703 22.631 41.427 1.00 50.37 ? 178 LEU B C 1 +ATOM 3184 O O . LEU B 1 176 ? 17.212 21.613 41.887 1.00 53.59 ? 178 LEU B O 1 +ATOM 3185 C CB . LEU B 1 176 ? 17.444 24.368 43.153 1.00 54.00 ? 178 LEU B CB 1 +ATOM 3186 C CG . LEU B 1 176 ? 17.237 25.794 43.677 1.00 53.29 ? 178 LEU B CG 1 +ATOM 3187 C CD1 . LEU B 1 176 ? 17.626 26.810 42.596 1.00 54.67 ? 178 LEU B CD1 1 +ATOM 3188 C CD2 . LEU B 1 176 ? 15.792 25.981 44.089 1.00 52.27 ? 178 LEU B CD2 1 +ATOM 3189 N N . ALA B 1 177 ? 18.779 22.633 40.643 1.00 51.49 ? 179 ALA B N 1 +ATOM 3190 C CA . ALA B 1 177 ? 19.494 21.412 40.331 1.00 52.17 ? 179 ALA B CA 1 +ATOM 3191 C C . ALA B 1 177 ? 20.928 21.511 40.834 1.00 53.59 ? 179 ALA B C 1 +ATOM 3192 O O . ALA B 1 177 ? 21.738 22.330 40.390 1.00 53.31 ? 179 ALA B O 1 +ATOM 3193 C CB . ALA B 1 177 ? 19.501 21.202 38.843 1.00 52.45 ? 179 ALA B CB 1 +ATOM 3194 N N . ASP B 1 178 ? 21.210 20.657 41.822 1.00 54.19 ? 180 ASP B N 1 +ATOM 3195 C CA . ASP B 1 178 ? 22.501 20.627 42.484 1.00 52.95 ? 180 ASP B CA 1 +ATOM 3196 C C . ASP B 1 178 ? 23.448 19.712 41.755 1.00 50.70 ? 180 ASP B C 1 +ATOM 3197 O O . ASP B 1 178 ? 23.274 18.494 41.729 1.00 52.50 ? 180 ASP B O 1 +ATOM 3198 C CB . ASP B 1 178 ? 22.385 20.118 43.901 1.00 58.45 ? 180 ASP B CB 1 +ATOM 3199 C CG . ASP B 1 178 ? 22.738 21.126 44.969 1.00 63.09 ? 180 ASP B CG 1 +ATOM 3200 O OD1 . ASP B 1 178 ? 23.887 21.563 44.993 1.00 67.26 ? 180 ASP B OD1 1 +ATOM 3201 O OD2 . ASP B 1 178 ? 21.869 21.443 45.789 1.00 67.64 ? 180 ASP B OD2 1 +ATOM 3202 N N . HIS B 1 179 ? 24.462 20.291 41.139 1.00 46.89 ? 181 HIS B N 1 +ATOM 3203 C CA . HIS B 1 179 ? 25.434 19.469 40.456 1.00 46.72 ? 181 HIS B CA 1 +ATOM 3204 C C . HIS B 1 179 ? 26.641 19.302 41.328 1.00 47.94 ? 181 HIS B C 1 +ATOM 3205 O O . HIS B 1 179 ? 27.133 20.244 41.948 1.00 52.59 ? 181 HIS B O 1 +ATOM 3206 C CB . HIS B 1 179 ? 25.887 20.092 39.150 1.00 43.30 ? 181 HIS B CB 1 +ATOM 3207 C CG . HIS B 1 179 ? 24.748 20.250 38.168 1.00 32.00 ? 181 HIS B CG 1 +ATOM 3208 N ND1 . HIS B 1 179 ? 23.587 20.825 38.415 1.00 37.18 ? 181 HIS B ND1 1 +ATOM 3209 C CD2 . HIS B 1 179 ? 24.758 19.810 36.888 1.00 31.54 ? 181 HIS B CD2 1 +ATOM 3210 C CE1 . HIS B 1 179 ? 22.913 20.727 37.299 1.00 37.45 ? 181 HIS B CE1 1 +ATOM 3211 N NE2 . HIS B 1 179 ? 23.607 20.121 36.380 1.00 26.49 ? 181 HIS B NE2 1 +ATOM 3212 N N . TYR B 1 180 ? 27.058 18.051 41.409 1.00 48.96 ? 182 TYR B N 1 +ATOM 3213 C CA . TYR B 1 180 ? 28.273 17.738 42.117 1.00 52.41 ? 182 TYR B CA 1 +ATOM 3214 C C . TYR B 1 180 ? 28.986 16.964 41.036 1.00 49.30 ? 182 TYR B C 1 +ATOM 3215 O O . TYR B 1 180 ? 28.649 15.836 40.672 1.00 49.90 ? 182 TYR B O 1 +ATOM 3216 C CB . TYR B 1 180 ? 27.999 16.860 43.350 1.00 60.43 ? 182 TYR B CB 1 +ATOM 3217 C CG . TYR B 1 180 ? 26.987 17.463 44.326 1.00 65.26 ? 182 TYR B CG 1 +ATOM 3218 C CD1 . TYR B 1 180 ? 27.347 18.528 45.164 1.00 64.55 ? 182 TYR B CD1 1 +ATOM 3219 C CD2 . TYR B 1 180 ? 25.685 16.931 44.371 1.00 69.87 ? 182 TYR B CD2 1 +ATOM 3220 C CE1 . TYR B 1 180 ? 26.403 19.055 46.047 1.00 69.49 ? 182 TYR B CE1 1 +ATOM 3221 C CE2 . TYR B 1 180 ? 24.736 17.457 45.252 1.00 71.88 ? 182 TYR B CE2 1 +ATOM 3222 C CZ . TYR B 1 180 ? 25.111 18.517 46.084 1.00 72.83 ? 182 TYR B CZ 1 +ATOM 3223 O OH . TYR B 1 180 ? 24.197 19.038 46.973 1.00 75.60 ? 182 TYR B OH 1 +ATOM 3224 N N . GLN B 1 181 ? 29.943 17.691 40.477 1.00 47.87 ? 183 GLN B N 1 +ATOM 3225 C CA . GLN B 1 181 ? 30.749 17.203 39.369 1.00 45.47 ? 183 GLN B CA 1 +ATOM 3226 C C . GLN B 1 181 ? 32.139 16.743 39.801 1.00 43.18 ? 183 GLN B C 1 +ATOM 3227 O O . GLN B 1 181 ? 32.644 17.093 40.862 1.00 41.90 ? 183 GLN B O 1 +ATOM 3228 C CB . GLN B 1 181 ? 30.820 18.340 38.342 1.00 45.38 ? 183 GLN B CB 1 +ATOM 3229 C CG . GLN B 1 181 ? 31.532 18.043 37.030 1.00 37.97 ? 183 GLN B CG 1 +ATOM 3230 C CD . GLN B 1 181 ? 31.615 19.233 36.109 1.00 32.80 ? 183 GLN B CD 1 +ATOM 3231 O OE1 . GLN B 1 181 ? 30.888 20.201 36.238 1.00 29.38 ? 183 GLN B OE1 1 +ATOM 3232 N NE2 . GLN B 1 181 ? 32.472 19.184 35.113 1.00 34.78 ? 183 GLN B NE2 1 +ATOM 3233 N N . GLN B 1 182 ? 32.765 15.936 38.965 1.00 42.66 ? 184 GLN B N 1 +ATOM 3234 C CA . GLN B 1 182 ? 34.102 15.448 39.183 1.00 46.50 ? 184 GLN B CA 1 +ATOM 3235 C C . GLN B 1 182 ? 34.558 15.107 37.787 1.00 45.60 ? 184 GLN B C 1 +ATOM 3236 O O . GLN B 1 182 ? 33.799 14.588 36.966 1.00 48.30 ? 184 GLN B O 1 +ATOM 3237 C CB . GLN B 1 182 ? 34.130 14.163 40.040 1.00 54.91 ? 184 GLN B CB 1 +ATOM 3238 C CG . GLN B 1 182 ? 35.561 13.797 40.448 1.00 68.16 ? 184 GLN B CG 1 +ATOM 3239 C CD . GLN B 1 182 ? 35.727 12.682 41.474 1.00 72.72 ? 184 GLN B CD 1 +ATOM 3240 O OE1 . GLN B 1 182 ? 35.251 11.564 41.267 1.00 75.40 ? 184 GLN B OE1 1 +ATOM 3241 N NE2 . GLN B 1 182 ? 36.444 12.939 42.572 1.00 71.57 ? 184 GLN B NE2 1 +ATOM 3242 N N . ASN B 1 183 ? 35.797 15.470 37.481 1.00 43.99 ? 185 ASN B N 1 +ATOM 3243 C CA . ASN B 1 183 ? 36.392 15.127 36.201 1.00 42.35 ? 185 ASN B CA 1 +ATOM 3244 C C . ASN B 1 183 ? 37.735 14.579 36.517 1.00 44.11 ? 185 ASN B C 1 +ATOM 3245 O O . ASN B 1 183 ? 38.408 15.083 37.418 1.00 45.55 ? 185 ASN B O 1 +ATOM 3246 C CB . ASN B 1 183 ? 36.622 16.311 35.291 1.00 41.06 ? 185 ASN B CB 1 +ATOM 3247 C CG . ASN B 1 183 ? 35.314 16.890 34.788 1.00 39.01 ? 185 ASN B CG 1 +ATOM 3248 O OD1 . ASN B 1 183 ? 34.468 17.314 35.560 1.00 30.13 ? 185 ASN B OD1 1 +ATOM 3249 N ND2 . ASN B 1 183 ? 35.126 16.954 33.483 1.00 35.12 ? 185 ASN B ND2 1 +ATOM 3250 N N . THR B 1 184 ? 38.060 13.509 35.785 1.00 43.15 ? 186 THR B N 1 +ATOM 3251 C CA . THR B 1 184 ? 39.335 12.826 35.935 1.00 40.59 ? 186 THR B CA 1 +ATOM 3252 C C . THR B 1 184 ? 39.771 12.448 34.537 1.00 36.12 ? 186 THR B C 1 +ATOM 3253 O O . THR B 1 184 ? 38.927 12.035 33.757 1.00 32.17 ? 186 THR B O 1 +ATOM 3254 C CB . THR B 1 184 ? 39.221 11.524 36.802 1.00 40.17 ? 186 THR B CB 1 +ATOM 3255 O OG1 . THR B 1 184 ? 38.344 10.662 36.096 1.00 40.55 ? 186 THR B OG1 1 +ATOM 3256 C CG2 . THR B 1 184 ? 38.758 11.788 38.230 1.00 41.21 ? 186 THR B CG2 1 +ATOM 3257 N N . PRO B 1 185 ? 41.044 12.527 34.171 1.00 35.77 ? 187 PRO B N 1 +ATOM 3258 C CA . PRO B 1 185 ? 41.565 12.061 32.882 1.00 38.37 ? 187 PRO B CA 1 +ATOM 3259 C C . PRO B 1 185 ? 41.424 10.585 32.496 1.00 40.79 ? 187 PRO B C 1 +ATOM 3260 O O . PRO B 1 185 ? 41.293 9.674 33.330 1.00 43.64 ? 187 PRO B O 1 +ATOM 3261 C CB . PRO B 1 185 ? 42.999 12.512 32.927 1.00 34.07 ? 187 PRO B CB 1 +ATOM 3262 C CG . PRO B 1 185 ? 43.328 12.339 34.392 1.00 35.11 ? 187 PRO B CG 1 +ATOM 3263 C CD . PRO B 1 185 ? 42.123 13.004 35.028 1.00 34.06 ? 187 PRO B CD 1 +ATOM 3264 N N . ILE B 1 186 ? 41.488 10.393 31.172 1.00 40.72 ? 188 ILE B N 1 +ATOM 3265 C CA . ILE B 1 186 ? 41.436 9.056 30.598 1.00 40.77 ? 188 ILE B CA 1 +ATOM 3266 C C . ILE B 1 186 ? 42.852 8.576 30.239 1.00 45.21 ? 188 ILE B C 1 +ATOM 3267 O O . ILE B 1 186 ? 43.196 7.384 30.387 1.00 45.66 ? 188 ILE B O 1 +ATOM 3268 C CB . ILE B 1 186 ? 40.465 9.112 29.379 1.00 31.85 ? 188 ILE B CB 1 +ATOM 3269 C CG1 . ILE B 1 186 ? 39.093 9.486 29.929 1.00 18.57 ? 188 ILE B CG1 1 +ATOM 3270 C CG2 . ILE B 1 186 ? 40.313 7.752 28.667 1.00 25.81 ? 188 ILE B CG2 1 +ATOM 3271 C CD1 . ILE B 1 186 ? 38.061 9.786 28.828 1.00 11.17 ? 188 ILE B CD1 1 +ATOM 3272 N N . GLY B 1 187 ? 43.682 9.542 29.823 1.00 45.57 ? 189 GLY B N 1 +ATOM 3273 C CA . GLY B 1 187 ? 45.073 9.294 29.492 1.00 47.57 ? 189 GLY B CA 1 +ATOM 3274 C C . GLY B 1 187 ? 45.988 9.346 30.708 1.00 49.44 ? 189 GLY B C 1 +ATOM 3275 O O . GLY B 1 187 ? 45.778 10.064 31.699 1.00 45.93 ? 189 GLY B O 1 +ATOM 3276 N N . ASP B 1 188 ? 47.030 8.509 30.588 1.00 52.65 ? 190 ASP B N 1 +ATOM 3277 C CA . ASP B 1 188 ? 48.101 8.405 31.580 1.00 55.71 ? 190 ASP B CA 1 +ATOM 3278 C C . ASP B 1 188 ? 48.931 9.696 31.676 1.00 56.88 ? 190 ASP B C 1 +ATOM 3279 O O . ASP B 1 188 ? 49.545 9.997 32.711 1.00 56.86 ? 190 ASP B O 1 +ATOM 3280 C CB . ASP B 1 188 ? 49.015 7.232 31.210 1.00 56.95 ? 190 ASP B CB 1 +ATOM 3281 C CG . ASP B 1 188 ? 48.420 5.845 31.456 1.00 62.12 ? 190 ASP B CG 1 +ATOM 3282 O OD1 . ASP B 1 188 ? 48.470 5.393 32.598 1.00 59.75 ? 190 ASP B OD1 1 +ATOM 3283 O OD2 . ASP B 1 188 ? 47.924 5.212 30.518 1.00 63.52 ? 190 ASP B OD2 1 +ATOM 3284 N N . GLY B 1 189 ? 48.927 10.474 30.580 1.00 53.39 ? 191 GLY B N 1 +ATOM 3285 C CA . GLY B 1 189 ? 49.615 11.747 30.481 1.00 54.93 ? 191 GLY B CA 1 +ATOM 3286 C C . GLY B 1 189 ? 49.155 12.752 31.540 1.00 54.62 ? 191 GLY B C 1 +ATOM 3287 O O . GLY B 1 189 ? 48.009 12.692 31.984 1.00 53.22 ? 191 GLY B O 1 +ATOM 3288 N N . PRO B 1 190 ? 50.012 13.675 32.022 1.00 55.59 ? 192 PRO B N 1 +ATOM 3289 C CA . PRO B 1 190 ? 49.664 14.629 33.054 1.00 51.88 ? 192 PRO B CA 1 +ATOM 3290 C C . PRO B 1 190 ? 48.813 15.755 32.492 1.00 51.22 ? 192 PRO B C 1 +ATOM 3291 O O . PRO B 1 190 ? 48.850 16.137 31.312 1.00 50.42 ? 192 PRO B O 1 +ATOM 3292 C CB . PRO B 1 190 ? 51.007 15.049 33.598 1.00 53.69 ? 192 PRO B CB 1 +ATOM 3293 C CG . PRO B 1 190 ? 51.846 15.077 32.358 1.00 52.59 ? 192 PRO B CG 1 +ATOM 3294 C CD . PRO B 1 190 ? 51.435 13.779 31.687 1.00 56.28 ? 192 PRO B CD 1 +ATOM 3295 N N . VAL B 1 191 ? 47.989 16.207 33.435 1.00 48.67 ? 193 VAL B N 1 +ATOM 3296 C CA . VAL B 1 191 ? 47.020 17.254 33.191 1.00 46.95 ? 193 VAL B CA 1 +ATOM 3297 C C . VAL B 1 191 ? 47.305 18.462 34.077 1.00 49.25 ? 193 VAL B C 1 +ATOM 3298 O O . VAL B 1 191 ? 48.077 18.394 35.057 1.00 47.21 ? 193 VAL B O 1 +ATOM 3299 C CB . VAL B 1 191 ? 45.565 16.718 33.445 1.00 42.35 ? 193 VAL B CB 1 +ATOM 3300 C CG1 . VAL B 1 191 ? 45.320 15.453 32.620 1.00 33.71 ? 193 VAL B CG1 1 +ATOM 3301 C CG2 . VAL B 1 191 ? 45.364 16.448 34.914 1.00 40.04 ? 193 VAL B CG2 1 +ATOM 3302 N N . LEU B 1 192 ? 46.661 19.571 33.683 1.00 48.16 ? 194 LEU B N 1 +ATOM 3303 C CA . LEU B 1 192 ? 46.845 20.790 34.450 1.00 52.74 ? 194 LEU B CA 1 +ATOM 3304 C C . LEU B 1 192 ? 45.772 20.818 35.512 1.00 50.26 ? 194 LEU B C 1 +ATOM 3305 O O . LEU B 1 192 ? 44.599 20.608 35.226 1.00 50.20 ? 194 LEU B O 1 +ATOM 3306 C CB . LEU B 1 192 ? 46.729 22.053 33.576 1.00 53.40 ? 194 LEU B CB 1 +ATOM 3307 C CG . LEU B 1 192 ? 47.540 22.124 32.283 1.00 56.40 ? 194 LEU B CG 1 +ATOM 3308 C CD1 . LEU B 1 192 ? 47.527 23.572 31.845 1.00 55.55 ? 194 LEU B CD1 1 +ATOM 3309 C CD2 . LEU B 1 192 ? 48.973 21.605 32.454 1.00 58.32 ? 194 LEU B CD2 1 +ATOM 3310 N N . LEU B 1 193 ? 46.206 21.042 36.750 1.00 48.18 ? 195 LEU B N 1 +ATOM 3311 C CA . LEU B 1 193 ? 45.295 21.063 37.864 1.00 45.21 ? 195 LEU B CA 1 +ATOM 3312 C C . LEU B 1 193 ? 45.166 22.452 38.462 1.00 47.27 ? 195 LEU B C 1 +ATOM 3313 O O . LEU B 1 193 ? 46.140 23.063 38.901 1.00 44.39 ? 195 LEU B O 1 +ATOM 3314 C CB . LEU B 1 193 ? 45.762 20.103 38.943 1.00 44.32 ? 195 LEU B CB 1 +ATOM 3315 C CG . LEU B 1 193 ? 45.869 18.628 38.657 1.00 40.41 ? 195 LEU B CG 1 +ATOM 3316 C CD1 . LEU B 1 193 ? 46.564 17.970 39.830 1.00 36.65 ? 195 LEU B CD1 1 +ATOM 3317 C CD2 . LEU B 1 193 ? 44.488 18.053 38.404 1.00 39.86 ? 195 LEU B CD2 1 +ATOM 3318 N N . PRO B 1 194 ? 43.933 22.962 38.515 1.00 48.66 ? 196 PRO B N 1 +ATOM 3319 C CA . PRO B 1 194 ? 43.627 24.333 38.886 1.00 48.29 ? 196 PRO B CA 1 +ATOM 3320 C C . PRO B 1 194 ? 43.522 24.804 40.328 1.00 48.13 ? 196 PRO B C 1 +ATOM 3321 O O . PRO B 1 194 ? 43.214 24.082 41.282 1.00 43.61 ? 196 PRO B O 1 +ATOM 3322 C CB . PRO B 1 194 ? 42.349 24.612 38.137 1.00 50.83 ? 196 PRO B CB 1 +ATOM 3323 C CG . PRO B 1 194 ? 41.625 23.301 38.229 1.00 51.59 ? 196 PRO B CG 1 +ATOM 3324 C CD . PRO B 1 194 ? 42.765 22.360 37.877 1.00 50.57 ? 196 PRO B CD 1 +ATOM 3325 N N . ASP B 1 195 ? 43.765 26.115 40.416 1.00 48.99 ? 197 ASP B N 1 +ATOM 3326 C CA . ASP B 1 195 ? 43.501 26.837 41.643 1.00 48.54 ? 197 ASP B CA 1 +ATOM 3327 C C . ASP B 1 195 ? 42.081 27.356 41.436 1.00 49.67 ? 197 ASP B C 1 +ATOM 3328 O O . ASP B 1 195 ? 41.677 27.684 40.321 1.00 52.19 ? 197 ASP B O 1 +ATOM 3329 C CB . ASP B 1 195 ? 44.449 28.037 41.843 1.00 45.00 ? 197 ASP B CB 1 +ATOM 3330 C CG . ASP B 1 195 ? 45.928 27.742 41.644 1.00 42.21 ? 197 ASP B CG 1 +ATOM 3331 O OD1 . ASP B 1 195 ? 46.418 26.695 42.085 1.00 37.48 ? 197 ASP B OD1 1 +ATOM 3332 O OD2 . ASP B 1 195 ? 46.576 28.585 41.026 1.00 36.94 ? 197 ASP B OD2 1 +ATOM 3333 N N . ASN B 1 196 ? 41.331 27.423 42.528 1.00 48.75 ? 198 ASN B N 1 +ATOM 3334 C CA . ASN B 1 196 ? 39.959 27.859 42.566 1.00 48.30 ? 198 ASN B CA 1 +ATOM 3335 C C . ASN B 1 196 ? 39.505 29.048 41.730 1.00 49.35 ? 198 ASN B C 1 +ATOM 3336 O O . ASN B 1 196 ? 39.770 30.229 41.997 1.00 52.14 ? 198 ASN B O 1 +ATOM 3337 C CB . ASN B 1 196 ? 39.630 28.093 44.029 1.00 49.22 ? 198 ASN B CB 1 +ATOM 3338 C CG . ASN B 1 196 ? 39.599 26.802 44.826 1.00 51.20 ? 198 ASN B CG 1 +ATOM 3339 O OD1 . ASN B 1 196 ? 40.109 25.742 44.434 1.00 51.65 ? 198 ASN B OD1 1 +ATOM 3340 N ND2 . ASN B 1 196 ? 38.960 26.928 45.988 1.00 50.93 ? 198 ASN B ND2 1 +ATOM 3341 N N . HIS B 1 197 ? 38.805 28.631 40.670 1.00 47.87 ? 199 HIS B N 1 +ATOM 3342 C CA . HIS B 1 197 ? 38.158 29.530 39.737 1.00 48.06 ? 199 HIS B CA 1 +ATOM 3343 C C . HIS B 1 197 ? 36.782 28.976 39.396 1.00 48.67 ? 199 HIS B C 1 +ATOM 3344 O O . HIS B 1 197 ? 36.365 27.920 39.886 1.00 53.44 ? 199 HIS B O 1 +ATOM 3345 C CB . HIS B 1 197 ? 38.991 29.661 38.453 1.00 45.97 ? 199 HIS B CB 1 +ATOM 3346 C CG . HIS B 1 197 ? 39.105 28.408 37.609 1.00 43.63 ? 199 HIS B CG 1 +ATOM 3347 N ND1 . HIS B 1 197 ? 39.682 27.267 37.949 1.00 45.97 ? 199 HIS B ND1 1 +ATOM 3348 C CD2 . HIS B 1 197 ? 38.583 28.275 36.348 1.00 42.18 ? 199 HIS B CD2 1 +ATOM 3349 C CE1 . HIS B 1 197 ? 39.518 26.451 36.928 1.00 46.66 ? 199 HIS B CE1 1 +ATOM 3350 N NE2 . HIS B 1 197 ? 38.858 27.057 35.970 1.00 43.88 ? 199 HIS B NE2 1 +ATOM 3351 N N . TYR B 1 198 ? 36.102 29.692 38.505 1.00 46.29 ? 200 TYR B N 1 +ATOM 3352 C CA . TYR B 1 198 ? 34.833 29.260 37.980 1.00 42.94 ? 200 TYR B CA 1 +ATOM 3353 C C . TYR B 1 198 ? 34.660 29.460 36.489 1.00 41.71 ? 200 TYR B C 1 +ATOM 3354 O O . TYR B 1 198 ? 35.319 30.290 35.852 1.00 41.68 ? 200 TYR B O 1 +ATOM 3355 C CB . TYR B 1 198 ? 33.705 29.985 38.686 1.00 46.51 ? 200 TYR B CB 1 +ATOM 3356 C CG . TYR B 1 198 ? 33.569 31.493 38.509 1.00 47.31 ? 200 TYR B CG 1 +ATOM 3357 C CD1 . TYR B 1 198 ? 32.894 32.020 37.411 1.00 47.03 ? 200 TYR B CD1 1 +ATOM 3358 C CD2 . TYR B 1 198 ? 34.042 32.347 39.507 1.00 50.76 ? 200 TYR B CD2 1 +ATOM 3359 C CE1 . TYR B 1 198 ? 32.676 33.397 37.314 1.00 51.84 ? 200 TYR B CE1 1 +ATOM 3360 C CE2 . TYR B 1 198 ? 33.825 33.722 39.414 1.00 50.51 ? 200 TYR B CE2 1 +ATOM 3361 C CZ . TYR B 1 198 ? 33.138 34.237 38.321 1.00 51.45 ? 200 TYR B CZ 1 +ATOM 3362 O OH . TYR B 1 198 ? 32.864 35.585 38.256 1.00 55.62 ? 200 TYR B OH 1 +ATOM 3363 N N . LEU B 1 199 ? 33.755 28.640 35.942 1.00 37.12 ? 201 LEU B N 1 +ATOM 3364 C CA . LEU B 1 199 ? 33.339 28.869 34.581 1.00 36.43 ? 201 LEU B CA 1 +ATOM 3365 C C . LEU B 1 199 ? 32.039 29.665 34.648 1.00 35.80 ? 201 LEU B C 1 +ATOM 3366 O O . LEU B 1 199 ? 31.083 29.265 35.306 1.00 38.52 ? 201 LEU B O 1 +ATOM 3367 C CB . LEU B 1 199 ? 33.107 27.569 33.879 1.00 30.96 ? 201 LEU B CB 1 +ATOM 3368 C CG . LEU B 1 199 ? 34.260 26.620 33.716 1.00 36.03 ? 201 LEU B CG 1 +ATOM 3369 C CD1 . LEU B 1 199 ? 33.702 25.365 33.062 1.00 29.73 ? 201 LEU B CD1 1 +ATOM 3370 C CD2 . LEU B 1 199 ? 35.391 27.242 32.899 1.00 29.00 ? 201 LEU B CD2 1 +ATOM 3371 N N . SER B 1 200 ? 32.012 30.861 34.065 1.00 33.57 ? 202 SER B N 1 +ATOM 3372 C CA . SER B 1 200 ? 30.816 31.672 33.942 1.00 28.79 ? 202 SER B CA 1 +ATOM 3373 C C . SER B 1 200 ? 30.186 31.123 32.685 1.00 27.83 ? 202 SER B C 1 +ATOM 3374 O O . SER B 1 200 ? 30.663 31.314 31.568 1.00 26.32 ? 202 SER B O 1 +ATOM 3375 C CB . SER B 1 200 ? 31.145 33.157 33.748 1.00 31.07 ? 202 SER B CB 1 +ATOM 3376 O OG . SER B 1 200 ? 30.028 33.879 33.246 1.00 35.53 ? 202 SER B OG 1 +ATOM 3377 N N . THR B 1 201 ? 29.085 30.398 32.864 1.00 27.79 ? 203 THR B N 1 +ATOM 3378 C CA . THR B 1 201 ? 28.451 29.871 31.690 1.00 25.95 ? 203 THR B CA 1 +ATOM 3379 C C . THR B 1 201 ? 27.056 30.380 31.583 1.00 25.57 ? 203 THR B C 1 +ATOM 3380 O O . THR B 1 201 ? 26.347 30.603 32.555 1.00 30.31 ? 203 THR B O 1 +ATOM 3381 C CB . THR B 1 201 ? 28.585 28.273 31.678 1.00 29.91 ? 203 THR B CB 1 +ATOM 3382 O OG1 . THR B 1 201 ? 27.276 27.724 31.658 1.00 29.91 ? 203 THR B OG1 1 +ATOM 3383 C CG2 . THR B 1 201 ? 29.337 27.699 32.870 1.00 20.11 ? 203 THR B CG2 1 +ATOM 3384 N N . GLN B 1 202 ? 26.725 30.630 30.321 1.00 26.72 ? 204 GLN B N 1 +ATOM 3385 C CA . GLN B 1 202 ? 25.436 31.177 29.933 1.00 24.48 ? 204 GLN B CA 1 +ATOM 3386 C C . GLN B 1 202 ? 24.861 30.388 28.786 1.00 20.08 ? 204 GLN B C 1 +ATOM 3387 O O . GLN B 1 202 ? 25.586 30.086 27.848 1.00 15.90 ? 204 GLN B O 1 +ATOM 3388 C CB . GLN B 1 202 ? 25.571 32.596 29.468 1.00 19.89 ? 204 GLN B CB 1 +ATOM 3389 C CG . GLN B 1 202 ? 25.986 33.573 30.511 1.00 24.31 ? 204 GLN B CG 1 +ATOM 3390 C CD . GLN B 1 202 ? 26.459 34.801 29.779 1.00 27.23 ? 204 GLN B CD 1 +ATOM 3391 O OE1 . GLN B 1 202 ? 25.767 35.815 29.769 1.00 29.57 ? 204 GLN B OE1 1 +ATOM 3392 N NE2 . GLN B 1 202 ? 27.650 34.743 29.216 1.00 15.01 ? 204 GLN B NE2 1 +ATOM 3393 N N . SER B 1 203 ? 23.551 30.150 28.802 1.00 25.24 ? 205 SER B N 1 +ATOM 3394 C CA . SER B 1 203 ? 22.944 29.366 27.734 1.00 26.99 ? 205 SER B CA 1 +ATOM 3395 C C . SER B 1 203 ? 21.606 29.908 27.274 1.00 30.24 ? 205 SER B C 1 +ATOM 3396 O O . SER B 1 203 ? 20.814 30.541 27.981 1.00 31.74 ? 205 SER B O 1 +ATOM 3397 C CB . SER B 1 203 ? 22.725 27.939 28.179 1.00 24.65 ? 205 SER B CB 1 +ATOM 3398 O OG . SER B 1 203 ? 23.821 27.357 28.844 1.00 32.60 ? 205 SER B OG 1 +ATOM 3399 N N . ALA B 1 204 ? 21.367 29.558 26.029 1.00 30.13 ? 206 ALA B N 1 +ATOM 3400 C CA . ALA B 1 204 ? 20.152 29.957 25.380 1.00 28.07 ? 206 ALA B CA 1 +ATOM 3401 C C . ALA B 1 204 ? 19.668 28.778 24.546 1.00 28.46 ? 206 ALA B C 1 +ATOM 3402 O O . ALA B 1 204 ? 20.273 28.344 23.568 1.00 29.60 ? 206 ALA B O 1 +ATOM 3403 C CB . ALA B 1 204 ? 20.442 31.180 24.505 1.00 27.42 ? 206 ALA B CB 1 +ATOM 3404 N N . LEU B 1 205 ? 18.520 28.261 24.959 1.00 29.24 ? 207 LEU B N 1 +ATOM 3405 C CA . LEU B 1 205 ? 17.854 27.134 24.308 1.00 26.62 ? 207 LEU B CA 1 +ATOM 3406 C C . LEU B 1 205 ? 16.883 27.548 23.206 1.00 27.59 ? 207 LEU B C 1 +ATOM 3407 O O . LEU B 1 205 ? 16.011 28.408 23.404 1.00 31.04 ? 207 LEU B O 1 +ATOM 3408 C CB . LEU B 1 205 ? 17.070 26.357 25.323 1.00 24.85 ? 207 LEU B CB 1 +ATOM 3409 C CG . LEU B 1 205 ? 17.683 26.026 26.657 1.00 24.47 ? 207 LEU B CG 1 +ATOM 3410 C CD1 . LEU B 1 205 ? 16.834 24.925 27.244 1.00 32.92 ? 207 LEU B CD1 1 +ATOM 3411 C CD2 . LEU B 1 205 ? 19.076 25.446 26.559 1.00 28.68 ? 207 LEU B CD2 1 +ATOM 3412 N N . SER B 1 206 ? 17.027 26.980 22.010 1.00 27.92 ? 208 SER B N 1 +ATOM 3413 C CA . SER B 1 206 ? 16.033 27.240 20.999 1.00 23.81 ? 208 SER B CA 1 +ATOM 3414 C C . SER B 1 206 ? 15.566 25.962 20.300 1.00 24.41 ? 208 SER B C 1 +ATOM 3415 O O . SER B 1 206 ? 15.819 24.834 20.726 1.00 27.74 ? 208 SER B O 1 +ATOM 3416 C CB . SER B 1 206 ? 16.610 28.223 20.059 1.00 20.42 ? 208 SER B CB 1 +ATOM 3417 O OG . SER B 1 206 ? 17.502 27.662 19.131 1.00 23.51 ? 208 SER B OG 1 +ATOM 3418 N N . LYS B 1 207 ? 14.778 26.157 19.250 1.00 21.51 ? 209 LYS B N 1 +ATOM 3419 C CA . LYS B 1 207 ? 14.163 25.116 18.451 1.00 21.95 ? 209 LYS B CA 1 +ATOM 3420 C C . LYS B 1 207 ? 14.444 25.409 16.995 1.00 23.15 ? 209 LYS B C 1 +ATOM 3421 O O . LYS B 1 207 ? 14.426 26.568 16.584 1.00 25.25 ? 209 LYS B O 1 +ATOM 3422 C CB . LYS B 1 207 ? 12.644 25.111 18.649 1.00 7.54 ? 209 LYS B CB 1 +ATOM 3423 C CG . LYS B 1 207 ? 12.174 24.752 20.037 1.00 3.85 ? 209 LYS B CG 1 +ATOM 3424 C CD . LYS B 1 207 ? 12.339 23.280 20.273 1.00 2.00 ? 209 LYS B CD 1 +ATOM 3425 C CE . LYS B 1 207 ? 11.793 23.092 21.700 1.00 14.54 ? 209 LYS B CE 1 +ATOM 3426 N NZ . LYS B 1 207 ? 12.036 21.749 22.224 1.00 10.01 ? 209 LYS B NZ 1 +ATOM 3427 N N . ASP B 1 208 ? 14.747 24.400 16.199 1.00 27.52 ? 210 ASP B N 1 +ATOM 3428 C CA . ASP B 1 208 ? 14.821 24.589 14.765 1.00 37.98 ? 210 ASP B CA 1 +ATOM 3429 C C . ASP B 1 208 ? 13.349 24.464 14.342 1.00 45.19 ? 210 ASP B C 1 +ATOM 3430 O O . ASP B 1 208 ? 12.776 23.380 14.506 1.00 44.88 ? 210 ASP B O 1 +ATOM 3431 C CB . ASP B 1 208 ? 15.679 23.486 14.157 1.00 37.96 ? 210 ASP B CB 1 +ATOM 3432 C CG . ASP B 1 208 ? 15.935 23.514 12.647 1.00 41.63 ? 210 ASP B CG 1 +ATOM 3433 O OD1 . ASP B 1 208 ? 15.329 24.284 11.904 1.00 39.59 ? 210 ASP B OD1 1 +ATOM 3434 O OD2 . ASP B 1 208 ? 16.758 22.720 12.196 1.00 44.68 ? 210 ASP B OD2 1 +ATOM 3435 N N . PRO B 1 209 ? 12.668 25.538 13.858 1.00 49.84 ? 211 PRO B N 1 +ATOM 3436 C CA . PRO B 1 209 ? 11.237 25.534 13.521 1.00 50.73 ? 211 PRO B CA 1 +ATOM 3437 C C . PRO B 1 209 ? 10.868 24.575 12.397 1.00 50.84 ? 211 PRO B C 1 +ATOM 3438 O O . PRO B 1 209 ? 9.733 24.097 12.352 1.00 48.65 ? 211 PRO B O 1 +ATOM 3439 C CB . PRO B 1 209 ? 10.927 26.989 13.212 1.00 51.52 ? 211 PRO B CB 1 +ATOM 3440 C CG . PRO B 1 209 ? 12.248 27.552 12.727 1.00 51.79 ? 211 PRO B CG 1 +ATOM 3441 C CD . PRO B 1 209 ? 13.231 26.879 13.675 1.00 50.27 ? 211 PRO B CD 1 +ATOM 3442 N N . ASN B 1 210 ? 11.867 24.272 11.545 1.00 49.96 ? 212 ASN B N 1 +ATOM 3443 C CA . ASN B 1 210 ? 11.822 23.272 10.483 1.00 48.66 ? 212 ASN B CA 1 +ATOM 3444 C C . ASN B 1 210 ? 12.081 21.830 10.948 1.00 45.10 ? 212 ASN B C 1 +ATOM 3445 O O . ASN B 1 210 ? 12.211 20.916 10.131 1.00 46.21 ? 212 ASN B O 1 +ATOM 3446 C CB . ASN B 1 210 ? 12.862 23.622 9.437 1.00 51.31 ? 212 ASN B CB 1 +ATOM 3447 C CG . ASN B 1 210 ? 12.319 24.337 8.213 1.00 57.93 ? 212 ASN B CG 1 +ATOM 3448 O OD1 . ASN B 1 210 ? 13.068 24.573 7.267 1.00 59.01 ? 212 ASN B OD1 1 +ATOM 3449 N ND2 . ASN B 1 210 ? 11.035 24.705 8.142 1.00 60.80 ? 212 ASN B ND2 1 +ATOM 3450 N N . GLU B 1 211 ? 12.142 21.595 12.264 1.00 39.49 ? 213 GLU B N 1 +ATOM 3451 C CA . GLU B 1 211 ? 12.465 20.289 12.807 1.00 33.56 ? 213 GLU B CA 1 +ATOM 3452 C C . GLU B 1 211 ? 11.333 19.681 13.614 1.00 31.37 ? 213 GLU B C 1 +ATOM 3453 O O . GLU B 1 211 ? 10.937 20.135 14.705 1.00 22.12 ? 213 GLU B O 1 +ATOM 3454 C CB . GLU B 1 211 ? 13.728 20.405 13.684 1.00 35.92 ? 213 GLU B CB 1 +ATOM 3455 C CG . GLU B 1 211 ? 14.197 19.195 14.474 1.00 31.32 ? 213 GLU B CG 1 +ATOM 3456 C CD . GLU B 1 211 ? 14.638 18.098 13.542 1.00 35.03 ? 213 GLU B CD 1 +ATOM 3457 O OE1 . GLU B 1 211 ? 13.805 17.326 13.087 1.00 42.95 ? 213 GLU B OE1 1 +ATOM 3458 O OE2 . GLU B 1 211 ? 15.816 18.041 13.236 1.00 36.24 ? 213 GLU B OE2 1 +ATOM 3459 N N . LYS B 1 212 ? 10.911 18.541 13.027 1.00 28.53 ? 214 LYS B N 1 +ATOM 3460 C CA . LYS B 1 212 ? 9.816 17.841 13.622 1.00 26.80 ? 214 LYS B CA 1 +ATOM 3461 C C . LYS B 1 212 ? 10.189 16.990 14.813 1.00 26.76 ? 214 LYS B C 1 +ATOM 3462 O O . LYS B 1 212 ? 9.332 16.773 15.692 1.00 22.71 ? 214 LYS B O 1 +ATOM 3463 C CB . LYS B 1 212 ? 9.145 17.013 12.557 1.00 35.97 ? 214 LYS B CB 1 +ATOM 3464 C CG . LYS B 1 212 ? 8.248 17.802 11.590 1.00 37.15 ? 214 LYS B CG 1 +ATOM 3465 C CD . LYS B 1 212 ? 8.996 18.163 10.335 1.00 44.49 ? 214 LYS B CD 1 +ATOM 3466 C CE . LYS B 1 212 ? 8.536 17.353 9.116 1.00 47.83 ? 214 LYS B CE 1 +ATOM 3467 N NZ . LYS B 1 212 ? 7.308 17.894 8.546 1.00 42.32 ? 214 LYS B NZ 1 +ATOM 3468 N N . ARG B 1 213 ? 11.455 16.549 14.942 1.00 24.57 ? 215 ARG B N 1 +ATOM 3469 C CA . ARG B 1 213 ? 11.760 15.659 16.076 1.00 25.84 ? 215 ARG B CA 1 +ATOM 3470 C C . ARG B 1 213 ? 11.867 16.393 17.387 1.00 23.04 ? 215 ARG B C 1 +ATOM 3471 O O . ARG B 1 213 ? 12.039 17.605 17.372 1.00 26.53 ? 215 ARG B O 1 +ATOM 3472 C CB . ARG B 1 213 ? 13.076 14.893 15.908 1.00 29.99 ? 215 ARG B CB 1 +ATOM 3473 C CG . ARG B 1 213 ? 13.133 13.866 14.792 1.00 33.64 ? 215 ARG B CG 1 +ATOM 3474 C CD . ARG B 1 213 ? 14.037 14.379 13.702 1.00 39.48 ? 215 ARG B CD 1 +ATOM 3475 N NE . ARG B 1 213 ? 15.350 13.798 13.848 1.00 42.78 ? 215 ARG B NE 1 +ATOM 3476 C CZ . ARG B 1 213 ? 16.499 14.351 13.457 1.00 40.09 ? 215 ARG B CZ 1 +ATOM 3477 N NH1 . ARG B 1 213 ? 16.646 15.524 12.885 1.00 42.10 ? 215 ARG B NH1 1 +ATOM 3478 N NH2 . ARG B 1 213 ? 17.577 13.619 13.512 1.00 44.20 ? 215 ARG B NH2 1 +ATOM 3479 N N . ASP B 1 214 ? 11.757 15.728 18.530 1.00 19.02 ? 216 ASP B N 1 +ATOM 3480 C CA . ASP B 1 214 ? 11.948 16.435 19.762 1.00 22.21 ? 216 ASP B CA 1 +ATOM 3481 C C . ASP B 1 214 ? 13.458 16.642 19.844 1.00 32.41 ? 216 ASP B C 1 +ATOM 3482 O O . ASP B 1 214 ? 14.284 15.720 19.839 1.00 35.01 ? 216 ASP B O 1 +ATOM 3483 C CB . ASP B 1 214 ? 11.508 15.650 20.977 1.00 12.58 ? 216 ASP B CB 1 +ATOM 3484 C CG . ASP B 1 214 ? 11.369 16.425 22.287 1.00 23.46 ? 216 ASP B CG 1 +ATOM 3485 O OD1 . ASP B 1 214 ? 11.127 17.627 22.276 1.00 30.62 ? 216 ASP B OD1 1 +ATOM 3486 O OD2 . ASP B 1 214 ? 11.496 15.834 23.356 1.00 28.11 ? 216 ASP B OD2 1 +ATOM 3487 N N . HIS B 1 215 ? 13.770 17.934 19.941 1.00 35.47 ? 217 HIS B N 1 +ATOM 3488 C CA . HIS B 1 215 ? 15.125 18.416 19.958 1.00 31.83 ? 217 HIS B CA 1 +ATOM 3489 C C . HIS B 1 215 ? 15.344 19.602 20.849 1.00 29.01 ? 217 HIS B C 1 +ATOM 3490 O O . HIS B 1 215 ? 14.415 20.077 21.485 1.00 34.08 ? 217 HIS B O 1 +ATOM 3491 C CB . HIS B 1 215 ? 15.546 18.782 18.556 1.00 33.66 ? 217 HIS B CB 1 +ATOM 3492 C CG . HIS B 1 215 ? 14.775 19.922 17.965 1.00 38.89 ? 217 HIS B CG 1 +ATOM 3493 N ND1 . HIS B 1 215 ? 13.474 19.956 17.743 1.00 38.67 ? 217 HIS B ND1 1 +ATOM 3494 C CD2 . HIS B 1 215 ? 15.341 21.115 17.599 1.00 42.74 ? 217 HIS B CD2 1 +ATOM 3495 C CE1 . HIS B 1 215 ? 13.232 21.144 17.256 1.00 40.95 ? 217 HIS B CE1 1 +ATOM 3496 N NE2 . HIS B 1 215 ? 14.346 21.835 17.170 1.00 44.47 ? 217 HIS B NE2 1 +ATOM 3497 N N . MET B 1 216 ? 16.617 19.980 20.950 1.00 27.04 ? 218 MET B N 1 +ATOM 3498 C CA . MET B 1 216 ? 17.070 21.198 21.619 1.00 23.70 ? 218 MET B CA 1 +ATOM 3499 C C . MET B 1 216 ? 18.271 21.745 20.891 1.00 24.88 ? 218 MET B C 1 +ATOM 3500 O O . MET B 1 216 ? 19.187 21.012 20.512 1.00 31.05 ? 218 MET B O 1 +ATOM 3501 C CB . MET B 1 216 ? 17.497 20.980 23.085 1.00 23.71 ? 218 MET B CB 1 +ATOM 3502 C CG . MET B 1 216 ? 18.221 22.150 23.756 1.00 15.42 ? 218 MET B CG 1 +ATOM 3503 S SD . MET B 1 216 ? 18.443 21.816 25.506 1.00 24.87 ? 218 MET B SD 1 +ATOM 3504 C CE . MET B 1 216 ? 19.703 20.599 25.357 1.00 24.60 ? 218 MET B CE 1 +ATOM 3505 N N . VAL B 1 217 ? 18.224 23.049 20.619 1.00 24.62 ? 219 VAL B N 1 +ATOM 3506 C CA . VAL B 1 217 ? 19.376 23.717 20.048 1.00 20.53 ? 219 VAL B CA 1 +ATOM 3507 C C . VAL B 1 217 ? 19.938 24.543 21.196 1.00 22.00 ? 219 VAL B C 1 +ATOM 3508 O O . VAL B 1 217 ? 19.280 25.393 21.818 1.00 19.39 ? 219 VAL B O 1 +ATOM 3509 C CB . VAL B 1 217 ? 18.923 24.557 18.884 1.00 18.53 ? 219 VAL B CB 1 +ATOM 3510 C CG1 . VAL B 1 217 ? 20.075 25.362 18.312 1.00 19.76 ? 219 VAL B CG1 1 +ATOM 3511 C CG2 . VAL B 1 217 ? 18.524 23.644 17.742 1.00 20.38 ? 219 VAL B CG2 1 +ATOM 3512 N N . LEU B 1 218 ? 21.154 24.136 21.573 1.00 20.44 ? 220 LEU B N 1 +ATOM 3513 C CA . LEU B 1 218 ? 21.871 24.794 22.660 1.00 23.58 ? 220 LEU B CA 1 +ATOM 3514 C C . LEU B 1 218 ? 23.000 25.684 22.199 1.00 28.55 ? 220 LEU B C 1 +ATOM 3515 O O . LEU B 1 218 ? 23.926 25.247 21.529 1.00 30.68 ? 220 LEU B O 1 +ATOM 3516 C CB . LEU B 1 218 ? 22.447 23.779 23.602 1.00 21.05 ? 220 LEU B CB 1 +ATOM 3517 C CG . LEU B 1 218 ? 23.263 24.291 24.747 1.00 24.66 ? 220 LEU B CG 1 +ATOM 3518 C CD1 . LEU B 1 218 ? 22.364 25.076 25.701 1.00 23.74 ? 220 LEU B CD1 1 +ATOM 3519 C CD2 . LEU B 1 218 ? 23.953 23.125 25.418 1.00 16.70 ? 220 LEU B CD2 1 +ATOM 3520 N N . LEU B 1 219 ? 22.855 26.955 22.593 1.00 33.58 ? 221 LEU B N 1 +ATOM 3521 C CA . LEU B 1 219 ? 23.827 28.003 22.364 1.00 30.45 ? 221 LEU B CA 1 +ATOM 3522 C C . LEU B 1 219 ? 24.290 28.311 23.757 1.00 30.58 ? 221 LEU B C 1 +ATOM 3523 O O . LEU B 1 219 ? 23.502 28.617 24.649 1.00 31.97 ? 221 LEU B O 1 +ATOM 3524 C CB . LEU B 1 219 ? 23.205 29.226 21.778 1.00 31.35 ? 221 LEU B CB 1 +ATOM 3525 C CG . LEU B 1 219 ? 23.510 29.602 20.340 1.00 36.84 ? 221 LEU B CG 1 +ATOM 3526 C CD1 . LEU B 1 219 ? 24.987 29.920 20.225 1.00 47.99 ? 221 LEU B CD1 1 +ATOM 3527 C CD2 . LEU B 1 219 ? 23.036 28.513 19.411 1.00 39.25 ? 221 LEU B CD2 1 +ATOM 3528 N N . GLU B 1 220 ? 25.600 28.171 23.931 1.00 32.41 ? 222 GLU B N 1 +ATOM 3529 C CA . GLU B 1 220 ? 26.227 28.350 25.221 1.00 30.81 ? 222 GLU B CA 1 +ATOM 3530 C C . GLU B 1 220 ? 27.579 29.032 25.082 1.00 32.17 ? 222 GLU B C 1 +ATOM 3531 O O . GLU B 1 220 ? 28.303 28.861 24.102 1.00 29.15 ? 222 GLU B O 1 +ATOM 3532 C CB . GLU B 1 220 ? 26.343 26.997 25.816 1.00 38.77 ? 222 GLU B CB 1 +ATOM 3533 C CG . GLU B 1 220 ? 26.663 26.992 27.270 1.00 47.02 ? 222 GLU B CG 1 +ATOM 3534 C CD . GLU B 1 220 ? 26.425 25.613 27.817 1.00 53.12 ? 222 GLU B CD 1 +ATOM 3535 O OE1 . GLU B 1 220 ? 25.263 25.256 28.001 1.00 57.98 ? 222 GLU B OE1 1 +ATOM 3536 O OE2 . GLU B 1 220 ? 27.400 24.908 28.063 1.00 58.97 ? 222 GLU B OE2 1 +ATOM 3537 N N . PHE B 1 221 ? 27.793 29.921 26.061 1.00 31.55 ? 223 PHE B N 1 +ATOM 3538 C CA . PHE B 1 221 ? 28.993 30.708 26.237 1.00 26.55 ? 223 PHE B CA 1 +ATOM 3539 C C . PHE B 1 221 ? 29.568 30.392 27.594 1.00 27.84 ? 223 PHE B C 1 +ATOM 3540 O O . PHE B 1 221 ? 28.859 30.402 28.598 1.00 22.20 ? 223 PHE B O 1 +ATOM 3541 C CB . PHE B 1 221 ? 28.646 32.168 26.136 1.00 30.48 ? 223 PHE B CB 1 +ATOM 3542 C CG . PHE B 1 221 ? 28.436 32.524 24.686 1.00 37.77 ? 223 PHE B CG 1 +ATOM 3543 C CD1 . PHE B 1 221 ? 29.529 32.893 23.890 1.00 42.18 ? 223 PHE B CD1 1 +ATOM 3544 C CD2 . PHE B 1 221 ? 27.168 32.431 24.135 1.00 40.18 ? 223 PHE B CD2 1 +ATOM 3545 C CE1 . PHE B 1 221 ? 29.341 33.163 22.536 1.00 41.30 ? 223 PHE B CE1 1 +ATOM 3546 C CE2 . PHE B 1 221 ? 26.987 32.701 22.784 1.00 43.04 ? 223 PHE B CE2 1 +ATOM 3547 C CZ . PHE B 1 221 ? 28.068 33.065 21.986 1.00 44.01 ? 223 PHE B CZ 1 +ATOM 3548 N N . VAL B 1 222 ? 30.862 30.029 27.599 1.00 31.58 ? 224 VAL B N 1 +ATOM 3549 C CA . VAL B 1 222 ? 31.565 29.631 28.815 1.00 32.97 ? 224 VAL B CA 1 +ATOM 3550 C C . VAL B 1 222 ? 32.895 30.377 28.917 1.00 33.85 ? 224 VAL B C 1 +ATOM 3551 O O . VAL B 1 222 ? 33.741 30.362 28.013 1.00 31.85 ? 224 VAL B O 1 +ATOM 3552 C CB . VAL B 1 222 ? 31.865 28.098 28.846 1.00 29.53 ? 224 VAL B CB 1 +ATOM 3553 C CG1 . VAL B 1 222 ? 32.070 27.736 30.293 1.00 25.86 ? 224 VAL B CG1 1 +ATOM 3554 C CG2 . VAL B 1 222 ? 30.742 27.218 28.309 1.00 29.01 ? 224 VAL B CG2 1 +ATOM 3555 N N . THR B 1 223 ? 33.067 31.059 30.054 1.00 32.50 ? 225 THR B N 1 +ATOM 3556 C CA . THR B 1 223 ? 34.280 31.772 30.313 1.00 28.63 ? 225 THR B CA 1 +ATOM 3557 C C . THR B 1 223 ? 34.775 31.555 31.728 1.00 36.05 ? 225 THR B C 1 +ATOM 3558 O O . THR B 1 223 ? 34.081 31.753 32.730 1.00 31.34 ? 225 THR B O 1 +ATOM 3559 C CB . THR B 1 223 ? 34.046 33.251 30.013 1.00 26.09 ? 225 THR B CB 1 +ATOM 3560 O OG1 . THR B 1 223 ? 34.024 33.310 28.599 1.00 25.85 ? 225 THR B OG1 1 +ATOM 3561 C CG2 . THR B 1 223 ? 35.124 34.212 30.519 1.00 31.09 ? 225 THR B CG2 1 +ATOM 3562 N N . ALA B 1 224 ? 36.056 31.127 31.779 1.00 38.91 ? 226 ALA B N 1 +ATOM 3563 C CA . ALA B 1 224 ? 36.744 30.962 33.053 1.00 35.66 ? 226 ALA B CA 1 +ATOM 3564 C C . ALA B 1 224 ? 37.013 32.313 33.691 1.00 35.65 ? 226 ALA B C 1 +ATOM 3565 O O . ALA B 1 224 ? 37.392 33.293 33.049 1.00 40.29 ? 226 ALA B O 1 +ATOM 3566 C CB . ALA B 1 224 ? 38.054 30.262 32.833 1.00 35.65 ? 226 ALA B CB 1 +ATOM 3567 N N . ALA B 1 225 ? 36.810 32.398 34.993 1.00 37.62 ? 227 ALA B N 1 +ATOM 3568 C CA . ALA B 1 225 ? 36.994 33.637 35.713 1.00 38.26 ? 227 ALA B CA 1 +ATOM 3569 C C . ALA B 1 225 ? 37.097 33.366 37.208 1.00 42.11 ? 227 ALA B C 1 +ATOM 3570 O O . ALA B 1 225 ? 36.945 32.231 37.663 1.00 38.59 ? 227 ALA B O 1 +ATOM 3571 C CB . ALA B 1 225 ? 35.816 34.545 35.440 1.00 42.08 ? 227 ALA B CB 1 +ATOM 3572 N N . GLY B 1 226 ? 37.342 34.418 37.996 1.00 44.29 ? 228 GLY B N 1 +ATOM 3573 C CA . GLY B 1 226 ? 37.582 34.284 39.424 1.00 46.54 ? 228 GLY B CA 1 +ATOM 3574 C C . GLY B 1 226 ? 39.072 34.233 39.746 1.00 49.97 ? 228 GLY B C 1 +ATOM 3575 O O . GLY B 1 226 ? 39.418 34.070 40.920 1.00 52.36 ? 228 GLY B O 1 +ATOM 3576 N N . ILE B 1 227 ? 39.974 34.316 38.749 1.00 51.47 ? 229 ILE B N 1 +ATOM 3577 C CA . ILE B 1 227 ? 41.415 34.390 38.992 1.00 60.23 ? 229 ILE B CA 1 +ATOM 3578 C C . ILE B 1 227 ? 41.960 35.639 38.303 1.00 65.01 ? 229 ILE B C 1 +ATOM 3579 O O . ILE B 1 227 ? 41.934 35.767 37.074 1.00 69.04 ? 229 ILE B O 1 +ATOM 3580 C CB . ILE B 1 227 ? 42.135 33.093 38.464 1.00 61.24 ? 229 ILE B CB 1 +ATOM 3581 C CG1 . ILE B 1 227 ? 41.777 31.941 39.388 1.00 57.68 ? 229 ILE B CG1 1 +ATOM 3582 C CG2 . ILE B 1 227 ? 43.663 33.254 38.422 1.00 62.38 ? 229 ILE B CG2 1 +ATOM 3583 C CD1 . ILE B 1 227 ? 42.430 30.604 39.009 1.00 62.37 ? 229 ILE B CD1 1 +ATOM 3584 N N . THR B 1 228 ? 42.461 36.577 39.118 1.00 67.94 ? 230 THR B N 1 +ATOM 3585 C CA . THR B 1 228 ? 42.975 37.858 38.635 1.00 71.00 ? 230 THR B CA 1 +ATOM 3586 C C . THR B 1 228 ? 44.410 37.872 38.097 1.00 71.76 ? 230 THR B C 1 +ATOM 3587 O O . THR B 1 228 ? 44.648 38.576 37.110 1.00 73.49 ? 230 THR B O 1 +ATOM 3588 C CB . THR B 1 228 ? 42.816 38.901 39.780 1.00 73.38 ? 230 THR B CB 1 +ATOM 3589 O OG1 . THR B 1 228 ? 43.365 38.335 40.970 1.00 75.22 ? 230 THR B OG1 1 +ATOM 3590 C CG2 . THR B 1 228 ? 41.355 39.296 39.988 1.00 74.28 ? 230 THR B CG2 1 +ATOM 3591 N N . GLY C 1 4 ? 0.974 -23.022 -12.821 1.00 43.36 ? 4 GLY C N 1 +ATOM 3592 C CA . GLY C 1 4 ? 0.855 -21.780 -12.096 1.00 44.14 ? 4 GLY C CA 1 +ATOM 3593 C C . GLY C 1 4 ? 2.145 -20.970 -12.084 1.00 44.52 ? 4 GLY C C 1 +ATOM 3594 O O . GLY C 1 4 ? 2.171 -19.784 -12.412 1.00 42.69 ? 4 GLY C O 1 +ATOM 3595 N N . GLU C 1 5 ? 3.212 -21.677 -11.693 1.00 45.36 ? 5 GLU C N 1 +ATOM 3596 C CA . GLU C 1 5 ? 4.579 -21.190 -11.552 1.00 45.92 ? 5 GLU C CA 1 +ATOM 3597 C C . GLU C 1 5 ? 5.203 -20.601 -12.823 1.00 47.81 ? 5 GLU C C 1 +ATOM 3598 O O . GLU C 1 5 ? 5.731 -19.489 -12.814 1.00 44.26 ? 5 GLU C O 1 +ATOM 3599 C CB . GLU C 1 5 ? 5.357 -22.373 -11.031 1.00 44.91 ? 5 GLU C CB 1 +ATOM 3600 C CG . GLU C 1 5 ? 6.760 -22.198 -10.534 1.00 45.31 ? 5 GLU C CG 1 +ATOM 3601 C CD . GLU C 1 5 ? 7.449 -23.548 -10.368 1.00 51.26 ? 5 GLU C CD 1 +ATOM 3602 O OE1 . GLU C 1 5 ? 7.117 -24.292 -9.438 1.00 50.99 ? 5 GLU C OE1 1 +ATOM 3603 O OE2 . GLU C 1 5 ? 8.329 -23.856 -11.175 1.00 47.47 ? 5 GLU C OE2 1 +ATOM 3604 N N . GLU C 1 6 ? 5.116 -21.338 -13.944 1.00 49.25 ? 6 GLU C N 1 +ATOM 3605 C CA . GLU C 1 6 ? 5.643 -20.898 -15.230 1.00 49.63 ? 6 GLU C CA 1 +ATOM 3606 C C . GLU C 1 6 ? 4.992 -19.706 -15.942 1.00 45.29 ? 6 GLU C C 1 +ATOM 3607 O O . GLU C 1 6 ? 5.417 -19.280 -17.023 1.00 45.02 ? 6 GLU C O 1 +ATOM 3608 C CB . GLU C 1 6 ? 5.672 -22.131 -16.157 1.00 57.36 ? 6 GLU C CB 1 +ATOM 3609 C CG . GLU C 1 6 ? 4.589 -23.208 -16.025 1.00 60.70 ? 6 GLU C CG 1 +ATOM 3610 C CD . GLU C 1 6 ? 3.202 -22.668 -16.292 1.00 68.71 ? 6 GLU C CD 1 +ATOM 3611 O OE1 . GLU C 1 6 ? 2.916 -22.329 -17.450 1.00 69.55 ? 6 GLU C OE1 1 +ATOM 3612 O OE2 . GLU C 1 6 ? 2.428 -22.577 -15.332 1.00 70.18 ? 6 GLU C OE2 1 +ATOM 3613 N N . LEU C 1 7 ? 3.924 -19.158 -15.362 1.00 41.96 ? 7 LEU C N 1 +ATOM 3614 C CA . LEU C 1 7 ? 3.306 -17.923 -15.838 1.00 39.11 ? 7 LEU C CA 1 +ATOM 3615 C C . LEU C 1 7 ? 4.236 -16.729 -15.506 1.00 36.62 ? 7 LEU C C 1 +ATOM 3616 O O . LEU C 1 7 ? 4.469 -15.798 -16.282 1.00 35.58 ? 7 LEU C O 1 +ATOM 3617 C CB . LEU C 1 7 ? 1.970 -17.772 -15.152 1.00 34.56 ? 7 LEU C CB 1 +ATOM 3618 C CG . LEU C 1 7 ? 0.790 -18.690 -15.429 1.00 29.23 ? 7 LEU C CG 1 +ATOM 3619 C CD1 . LEU C 1 7 ? -0.249 -18.418 -14.378 1.00 29.64 ? 7 LEU C CD1 1 +ATOM 3620 C CD2 . LEU C 1 7 ? 0.165 -18.440 -16.777 1.00 16.60 ? 7 LEU C CD2 1 +ATOM 3621 N N . PHE C 1 8 ? 4.869 -16.876 -14.345 1.00 33.79 ? 8 PHE C N 1 +ATOM 3622 C CA . PHE C 1 8 ? 5.806 -15.952 -13.739 1.00 32.32 ? 8 PHE C CA 1 +ATOM 3623 C C . PHE C 1 8 ? 7.298 -16.041 -14.107 1.00 32.66 ? 8 PHE C C 1 +ATOM 3624 O O . PHE C 1 8 ? 8.150 -15.541 -13.361 1.00 32.54 ? 8 PHE C O 1 +ATOM 3625 C CB . PHE C 1 8 ? 5.650 -16.106 -12.249 1.00 28.30 ? 8 PHE C CB 1 +ATOM 3626 C CG . PHE C 1 8 ? 4.288 -15.663 -11.785 1.00 32.89 ? 8 PHE C CG 1 +ATOM 3627 C CD1 . PHE C 1 8 ? 4.029 -14.315 -11.583 1.00 28.45 ? 8 PHE C CD1 1 +ATOM 3628 C CD2 . PHE C 1 8 ? 3.292 -16.615 -11.555 1.00 36.60 ? 8 PHE C CD2 1 +ATOM 3629 C CE1 . PHE C 1 8 ? 2.760 -13.916 -11.146 1.00 35.00 ? 8 PHE C CE1 1 +ATOM 3630 C CE2 . PHE C 1 8 ? 2.037 -16.209 -11.118 1.00 38.71 ? 8 PHE C CE2 1 +ATOM 3631 C CZ . PHE C 1 8 ? 1.764 -14.854 -10.911 1.00 34.02 ? 8 PHE C CZ 1 +ATOM 3632 N N . THR C 1 9 ? 7.696 -16.656 -15.224 1.00 34.08 ? 9 THR C N 1 +ATOM 3633 C CA . THR C 1 9 ? 9.120 -16.799 -15.516 1.00 31.99 ? 9 THR C CA 1 +ATOM 3634 C C . THR C 1 9 ? 9.720 -15.664 -16.343 1.00 33.94 ? 9 THR C C 1 +ATOM 3635 O O . THR C 1 9 ? 10.935 -15.541 -16.553 1.00 31.07 ? 9 THR C O 1 +ATOM 3636 C CB . THR C 1 9 ? 9.322 -18.191 -16.194 1.00 32.46 ? 9 THR C CB 1 +ATOM 3637 O OG1 . THR C 1 9 ? 8.514 -18.265 -17.365 1.00 25.86 ? 9 THR C OG1 1 +ATOM 3638 C CG2 . THR C 1 9 ? 8.997 -19.318 -15.205 1.00 27.34 ? 9 THR C CG2 1 +ATOM 3639 N N . GLY C 1 10 ? 8.800 -14.840 -16.836 1.00 32.83 ? 10 GLY C N 1 +ATOM 3640 C CA . GLY C 1 10 ? 9.137 -13.629 -17.554 1.00 32.03 ? 10 GLY C CA 1 +ATOM 3641 C C . GLY C 1 10 ? 8.632 -12.420 -16.745 1.00 32.63 ? 10 GLY C C 1 +ATOM 3642 O O . GLY C 1 10 ? 8.267 -12.471 -15.563 1.00 32.22 ? 10 GLY C O 1 +ATOM 3643 N N . VAL C 1 11 ? 8.644 -11.299 -17.442 1.00 31.74 ? 11 VAL C N 1 +ATOM 3644 C CA . VAL C 1 11 ? 8.080 -10.070 -16.937 1.00 28.86 ? 11 VAL C CA 1 +ATOM 3645 C C . VAL C 1 11 ? 6.607 -10.072 -17.340 1.00 25.94 ? 11 VAL C C 1 +ATOM 3646 O O . VAL C 1 11 ? 6.194 -10.159 -18.512 1.00 21.67 ? 11 VAL C O 1 +ATOM 3647 C CB . VAL C 1 11 ? 8.844 -8.899 -17.554 1.00 30.41 ? 11 VAL C CB 1 +ATOM 3648 C CG1 . VAL C 1 11 ? 8.081 -7.624 -17.279 1.00 23.56 ? 11 VAL C CG1 1 +ATOM 3649 C CG2 . VAL C 1 11 ? 10.258 -8.848 -16.986 1.00 29.48 ? 11 VAL C CG2 1 +ATOM 3650 N N . VAL C 1 12 ? 5.884 -10.028 -16.222 1.00 21.75 ? 12 VAL C N 1 +ATOM 3651 C CA . VAL C 1 12 ? 4.434 -10.075 -16.165 1.00 18.83 ? 12 VAL C CA 1 +ATOM 3652 C C . VAL C 1 12 ? 3.873 -8.674 -15.883 1.00 19.36 ? 12 VAL C C 1 +ATOM 3653 O O . VAL C 1 12 ? 4.163 -8.086 -14.825 1.00 14.73 ? 12 VAL C O 1 +ATOM 3654 C CB . VAL C 1 12 ? 4.002 -11.065 -15.049 1.00 19.23 ? 12 VAL C CB 1 +ATOM 3655 C CG1 . VAL C 1 12 ? 2.476 -11.060 -14.916 1.00 16.11 ? 12 VAL C CG1 1 +ATOM 3656 C CG2 . VAL C 1 12 ? 4.482 -12.482 -15.387 1.00 9.12 ? 12 VAL C CG2 1 +ATOM 3657 N N . PRO C 1 13 ? 3.055 -8.128 -16.798 1.00 16.29 ? 13 PRO C N 1 +ATOM 3658 C CA . PRO C 1 13 ? 2.333 -6.881 -16.646 1.00 10.98 ? 13 PRO C CA 1 +ATOM 3659 C C . PRO C 1 13 ? 1.391 -6.965 -15.467 1.00 16.02 ? 13 PRO C C 1 +ATOM 3660 O O . PRO C 1 13 ? 0.776 -7.996 -15.193 1.00 21.92 ? 13 PRO C O 1 +ATOM 3661 C CB . PRO C 1 13 ? 1.626 -6.712 -17.927 1.00 14.42 ? 13 PRO C CB 1 +ATOM 3662 C CG . PRO C 1 13 ? 2.454 -7.509 -18.904 1.00 23.09 ? 13 PRO C CG 1 +ATOM 3663 C CD . PRO C 1 13 ? 2.701 -8.749 -18.067 1.00 21.37 ? 13 PRO C CD 1 +ATOM 3664 N N . ILE C 1 14 ? 1.379 -5.936 -14.649 1.00 14.88 ? 14 ILE C N 1 +ATOM 3665 C CA . ILE C 1 14 ? 0.474 -5.875 -13.513 1.00 13.85 ? 14 ILE C CA 1 +ATOM 3666 C C . ILE C 1 14 ? -0.388 -4.647 -13.812 1.00 15.93 ? 14 ILE C C 1 +ATOM 3667 O O . ILE C 1 14 ? -0.169 -3.837 -14.732 1.00 13.99 ? 14 ILE C O 1 +ATOM 3668 C CB . ILE C 1 14 ? 1.258 -5.726 -12.194 1.00 9.37 ? 14 ILE C CB 1 +ATOM 3669 C CG1 . ILE C 1 14 ? 2.329 -6.794 -12.151 1.00 17.37 ? 14 ILE C CG1 1 +ATOM 3670 C CG2 . ILE C 1 14 ? 0.380 -5.926 -10.981 1.00 6.19 ? 14 ILE C CG2 1 +ATOM 3671 C CD1 . ILE C 1 14 ? 3.161 -6.710 -10.860 1.00 22.45 ? 14 ILE C CD1 1 +ATOM 3672 N N . LEU C 1 15 ? -1.513 -4.703 -13.124 1.00 16.78 ? 15 LEU C N 1 +ATOM 3673 C CA . LEU C 1 15 ? -2.573 -3.755 -13.227 1.00 13.71 ? 15 LEU C CA 1 +ATOM 3674 C C . LEU C 1 15 ? -3.128 -3.941 -11.838 1.00 17.72 ? 15 LEU C C 1 +ATOM 3675 O O . LEU C 1 15 ? -3.366 -5.066 -11.417 1.00 20.46 ? 15 LEU C O 1 +ATOM 3676 C CB . LEU C 1 15 ? -3.456 -4.235 -14.325 1.00 22.66 ? 15 LEU C CB 1 +ATOM 3677 C CG . LEU C 1 15 ? -4.347 -3.314 -15.134 1.00 30.52 ? 15 LEU C CG 1 +ATOM 3678 C CD1 . LEU C 1 15 ? -5.147 -2.414 -14.215 1.00 33.82 ? 15 LEU C CD1 1 +ATOM 3679 C CD2 . LEU C 1 15 ? -3.463 -2.511 -16.088 1.00 34.47 ? 15 LEU C CD2 1 +ATOM 3680 N N . VAL C 1 16 ? -3.139 -2.869 -11.034 1.00 19.72 ? 16 VAL C N 1 +ATOM 3681 C CA . VAL C 1 16 ? -3.689 -2.805 -9.679 1.00 16.85 ? 16 VAL C CA 1 +ATOM 3682 C C . VAL C 1 16 ? -4.846 -1.786 -9.667 1.00 19.74 ? 16 VAL C C 1 +ATOM 3683 O O . VAL C 1 16 ? -4.765 -0.730 -10.312 1.00 21.24 ? 16 VAL C O 1 +ATOM 3684 C CB . VAL C 1 16 ? -2.615 -2.356 -8.662 1.00 11.39 ? 16 VAL C CB 1 +ATOM 3685 C CG1 . VAL C 1 16 ? -3.129 -2.427 -7.226 1.00 2.00 ? 16 VAL C CG1 1 +ATOM 3686 C CG2 . VAL C 1 16 ? -1.401 -3.284 -8.839 1.00 16.89 ? 16 VAL C CG2 1 +ATOM 3687 N N . GLU C 1 17 ? -5.952 -2.076 -8.972 1.00 15.51 ? 17 GLU C N 1 +ATOM 3688 C CA . GLU C 1 17 ? -7.076 -1.181 -8.880 1.00 10.94 ? 17 GLU C CA 1 +ATOM 3689 C C . GLU C 1 17 ? -7.566 -1.249 -7.465 1.00 16.31 ? 17 GLU C C 1 +ATOM 3690 O O . GLU C 1 17 ? -7.809 -2.324 -6.933 1.00 23.42 ? 17 GLU C O 1 +ATOM 3691 C CB . GLU C 1 17 ? -8.206 -1.580 -9.740 1.00 6.45 ? 17 GLU C CB 1 +ATOM 3692 C CG . GLU C 1 17 ? -7.902 -1.875 -11.190 1.00 9.19 ? 17 GLU C CG 1 +ATOM 3693 C CD . GLU C 1 17 ? -8.028 -0.715 -12.154 1.00 31.73 ? 17 GLU C CD 1 +ATOM 3694 O OE1 . GLU C 1 17 ? -7.700 0.429 -11.787 1.00 32.58 ? 17 GLU C OE1 1 +ATOM 3695 O OE2 . GLU C 1 17 ? -8.454 -0.990 -13.289 1.00 41.79 ? 17 GLU C OE2 1 +ATOM 3696 N N . LEU C 1 18 ? -7.621 -0.107 -6.804 1.00 19.27 ? 18 LEU C N 1 +ATOM 3697 C CA . LEU C 1 18 ? -8.127 -0.023 -5.445 1.00 19.43 ? 18 LEU C CA 1 +ATOM 3698 C C . LEU C 1 18 ? -9.281 0.982 -5.522 1.00 19.10 ? 18 LEU C C 1 +ATOM 3699 O O . LEU C 1 18 ? -9.350 1.860 -6.380 1.00 15.81 ? 18 LEU C O 1 +ATOM 3700 C CB . LEU C 1 18 ? -6.963 0.440 -4.606 1.00 8.31 ? 18 LEU C CB 1 +ATOM 3701 C CG . LEU C 1 18 ? -6.874 0.701 -3.101 1.00 18.03 ? 18 LEU C CG 1 +ATOM 3702 C CD1 . LEU C 1 18 ? -8.017 1.561 -2.632 1.00 15.74 ? 18 LEU C CD1 1 +ATOM 3703 C CD2 . LEU C 1 18 ? -6.903 -0.590 -2.343 1.00 7.71 ? 18 LEU C CD2 1 +ATOM 3704 N N . ASP C 1 19 ? -10.275 0.664 -4.703 1.00 19.63 ? 19 ASP C N 1 +ATOM 3705 C CA . ASP C 1 19 ? -11.397 1.533 -4.387 1.00 13.22 ? 19 ASP C CA 1 +ATOM 3706 C C . ASP C 1 19 ? -11.354 1.499 -2.885 1.00 7.39 ? 19 ASP C C 1 +ATOM 3707 O O . ASP C 1 19 ? -11.219 0.440 -2.284 1.00 11.91 ? 19 ASP C O 1 +ATOM 3708 C CB . ASP C 1 19 ? -12.741 0.990 -4.821 1.00 14.72 ? 19 ASP C CB 1 +ATOM 3709 C CG . ASP C 1 19 ? -12.914 0.964 -6.331 1.00 22.22 ? 19 ASP C CG 1 +ATOM 3710 O OD1 . ASP C 1 19 ? -12.378 1.830 -7.031 1.00 20.89 ? 19 ASP C OD1 1 +ATOM 3711 O OD2 . ASP C 1 19 ? -13.599 0.054 -6.807 1.00 23.24 ? 19 ASP C OD2 1 +ATOM 3712 N N . GLY C 1 20 ? -11.366 2.622 -2.208 1.00 7.12 ? 20 GLY C N 1 +ATOM 3713 C CA . GLY C 1 20 ? -11.290 2.530 -0.759 1.00 8.48 ? 20 GLY C CA 1 +ATOM 3714 C C . GLY C 1 20 ? -12.171 3.555 -0.102 1.00 8.71 ? 20 GLY C C 1 +ATOM 3715 O O . GLY C 1 20 ? -12.785 4.399 -0.757 1.00 14.17 ? 20 GLY C O 1 +ATOM 3716 N N . ASP C 1 21 ? -12.150 3.451 1.205 1.00 2.10 ? 21 ASP C N 1 +ATOM 3717 C CA . ASP C 1 21 ? -13.016 4.287 1.942 1.00 12.43 ? 21 ASP C CA 1 +ATOM 3718 C C . ASP C 1 21 ? -12.409 4.196 3.287 1.00 15.36 ? 21 ASP C C 1 +ATOM 3719 O O . ASP C 1 21 ? -12.425 3.151 3.941 1.00 16.37 ? 21 ASP C O 1 +ATOM 3720 C CB . ASP C 1 21 ? -14.429 3.745 2.023 1.00 21.14 ? 21 ASP C CB 1 +ATOM 3721 C CG . ASP C 1 21 ? -15.368 4.742 2.695 1.00 27.93 ? 21 ASP C CG 1 +ATOM 3722 O OD1 . ASP C 1 21 ? -15.327 4.936 3.918 1.00 25.09 ? 21 ASP C OD1 1 +ATOM 3723 O OD2 . ASP C 1 21 ? -16.129 5.355 1.954 1.00 37.57 ? 21 ASP C OD2 1 +ATOM 3724 N N . VAL C 1 22 ? -11.877 5.354 3.650 1.00 13.07 ? 22 VAL C N 1 +ATOM 3725 C CA . VAL C 1 22 ? -11.222 5.429 4.925 1.00 13.66 ? 22 VAL C CA 1 +ATOM 3726 C C . VAL C 1 22 ? -11.951 6.523 5.631 1.00 13.76 ? 22 VAL C C 1 +ATOM 3727 O O . VAL C 1 22 ? -11.942 7.649 5.128 1.00 14.13 ? 22 VAL C O 1 +ATOM 3728 C CB . VAL C 1 22 ? -9.735 5.798 4.767 1.00 14.23 ? 22 VAL C CB 1 +ATOM 3729 C CG1 . VAL C 1 22 ? -9.084 5.948 6.135 1.00 14.51 ? 22 VAL C CG1 1 +ATOM 3730 C CG2 . VAL C 1 22 ? -9.078 4.737 3.915 1.00 3.07 ? 22 VAL C CG2 1 +ATOM 3731 N N . ASN C 1 23 ? -12.528 6.241 6.812 1.00 13.02 ? 23 ASN C N 1 +ATOM 3732 C CA . ASN C 1 23 ? -13.296 7.312 7.446 1.00 22.12 ? 23 ASN C CA 1 +ATOM 3733 C C . ASN C 1 23 ? -14.379 8.062 6.643 1.00 18.78 ? 23 ASN C C 1 +ATOM 3734 O O . ASN C 1 23 ? -14.775 9.163 7.034 1.00 23.27 ? 23 ASN C O 1 +ATOM 3735 C CB . ASN C 1 23 ? -12.266 8.343 8.016 1.00 20.36 ? 23 ASN C CB 1 +ATOM 3736 C CG . ASN C 1 23 ? -11.873 7.882 9.380 1.00 11.91 ? 23 ASN C CG 1 +ATOM 3737 O OD1 . ASN C 1 23 ? -11.783 6.696 9.589 1.00 21.39 ? 23 ASN C OD1 1 +ATOM 3738 N ND2 . ASN C 1 23 ? -11.550 8.788 10.301 1.00 22.84 ? 23 ASN C ND2 1 +ATOM 3739 N N . GLY C 1 24 ? -14.771 7.518 5.487 1.00 13.24 ? 24 GLY C N 1 +ATOM 3740 C CA . GLY C 1 24 ? -15.815 8.110 4.669 1.00 24.75 ? 24 GLY C CA 1 +ATOM 3741 C C . GLY C 1 24 ? -15.284 8.580 3.337 1.00 30.36 ? 24 GLY C C 1 +ATOM 3742 O O . GLY C 1 24 ? -16.011 8.772 2.365 1.00 33.34 ? 24 GLY C O 1 +ATOM 3743 N N . HIS C 1 25 ? -13.967 8.756 3.296 1.00 30.12 ? 25 HIS C N 1 +ATOM 3744 C CA . HIS C 1 25 ? -13.289 9.276 2.140 1.00 26.36 ? 25 HIS C CA 1 +ATOM 3745 C C . HIS C 1 25 ? -13.070 8.227 1.083 1.00 24.26 ? 25 HIS C C 1 +ATOM 3746 O O . HIS C 1 25 ? -12.199 7.377 1.140 1.00 27.02 ? 25 HIS C O 1 +ATOM 3747 C CB . HIS C 1 25 ? -11.968 9.862 2.600 1.00 25.03 ? 25 HIS C CB 1 +ATOM 3748 C CG . HIS C 1 25 ? -12.201 10.866 3.698 1.00 19.38 ? 25 HIS C CG 1 +ATOM 3749 N ND1 . HIS C 1 25 ? -11.961 10.663 4.988 1.00 21.78 ? 25 HIS C ND1 1 +ATOM 3750 C CD2 . HIS C 1 25 ? -12.740 12.112 3.497 1.00 13.72 ? 25 HIS C CD2 1 +ATOM 3751 C CE1 . HIS C 1 25 ? -12.352 11.770 5.604 1.00 22.40 ? 25 HIS C CE1 1 +ATOM 3752 N NE2 . HIS C 1 25 ? -12.812 12.623 4.700 1.00 22.81 ? 25 HIS C NE2 1 +ATOM 3753 N N . LYS C 1 26 ? -13.911 8.271 0.091 1.00 22.26 ? 26 LYS C N 1 +ATOM 3754 C CA . LYS C 1 26 ? -13.760 7.343 -0.993 1.00 23.82 ? 26 LYS C CA 1 +ATOM 3755 C C . LYS C 1 26 ? -12.672 7.864 -1.876 1.00 24.47 ? 26 LYS C C 1 +ATOM 3756 O O . LYS C 1 26 ? -12.488 9.067 -2.065 1.00 22.74 ? 26 LYS C O 1 +ATOM 3757 C CB . LYS C 1 26 ? -14.995 7.213 -1.847 1.00 22.87 ? 26 LYS C CB 1 +ATOM 3758 C CG . LYS C 1 26 ? -16.085 6.630 -1.011 1.00 32.02 ? 26 LYS C CG 1 +ATOM 3759 C CD . LYS C 1 26 ? -17.419 6.642 -1.764 1.00 38.92 ? 26 LYS C CD 1 +ATOM 3760 C CE . LYS C 1 26 ? -18.564 6.730 -0.747 1.00 40.38 ? 26 LYS C CE 1 +ATOM 3761 N NZ . LYS C 1 26 ? -18.380 5.739 0.297 1.00 32.14 ? 26 LYS C NZ 1 +ATOM 3762 N N . PHE C 1 27 ? -11.963 6.873 -2.409 1.00 23.89 ? 27 PHE C N 1 +ATOM 3763 C CA . PHE C 1 27 ? -10.908 7.127 -3.394 1.00 20.45 ? 27 PHE C CA 1 +ATOM 3764 C C . PHE C 1 27 ? -10.688 5.895 -4.220 1.00 20.77 ? 27 PHE C C 1 +ATOM 3765 O O . PHE C 1 27 ? -11.157 4.801 -3.935 1.00 24.79 ? 27 PHE C O 1 +ATOM 3766 C CB . PHE C 1 27 ? -9.583 7.490 -2.736 1.00 7.15 ? 27 PHE C CB 1 +ATOM 3767 C CG . PHE C 1 27 ? -9.112 6.444 -1.756 1.00 2.86 ? 27 PHE C CG 1 +ATOM 3768 C CD1 . PHE C 1 27 ? -9.569 6.437 -0.445 1.00 2.00 ? 27 PHE C CD1 1 +ATOM 3769 C CD2 . PHE C 1 27 ? -8.159 5.516 -2.142 1.00 8.44 ? 27 PHE C CD2 1 +ATOM 3770 C CE1 . PHE C 1 27 ? -9.079 5.533 0.487 1.00 2.00 ? 27 PHE C CE1 1 +ATOM 3771 C CE2 . PHE C 1 27 ? -7.672 4.608 -1.211 1.00 6.28 ? 27 PHE C CE2 1 +ATOM 3772 C CZ . PHE C 1 27 ? -8.128 4.626 0.097 1.00 6.76 ? 27 PHE C CZ 1 +ATOM 3773 N N . SER C 1 28 ? -9.873 6.102 -5.224 1.00 23.82 ? 28 SER C N 1 +ATOM 3774 C CA . SER C 1 28 ? -9.500 5.030 -6.110 1.00 21.85 ? 28 SER C CA 1 +ATOM 3775 C C . SER C 1 28 ? -8.074 5.190 -6.597 1.00 20.48 ? 28 SER C C 1 +ATOM 3776 O O . SER C 1 28 ? -7.627 6.317 -6.801 1.00 12.36 ? 28 SER C O 1 +ATOM 3777 C CB . SER C 1 28 ? -10.397 5.011 -7.302 1.00 21.87 ? 28 SER C CB 1 +ATOM 3778 O OG . SER C 1 28 ? -11.669 4.776 -6.767 1.00 25.25 ? 28 SER C OG 1 +ATOM 3779 N N . VAL C 1 29 ? -7.323 4.080 -6.701 1.00 20.05 ? 29 VAL C N 1 +ATOM 3780 C CA . VAL C 1 29 ? -6.060 4.168 -7.393 1.00 15.24 ? 29 VAL C CA 1 +ATOM 3781 C C . VAL C 1 29 ? -5.976 3.129 -8.496 1.00 18.90 ? 29 VAL C C 1 +ATOM 3782 O O . VAL C 1 29 ? -6.651 2.093 -8.526 1.00 21.14 ? 29 VAL C O 1 +ATOM 3783 C CB . VAL C 1 29 ? -4.804 4.108 -6.389 1.00 10.04 ? 29 VAL C CB 1 +ATOM 3784 C CG1 . VAL C 1 29 ? -5.264 4.257 -4.947 1.00 11.52 ? 29 VAL C CG1 1 +ATOM 3785 C CG2 . VAL C 1 29 ? -3.946 2.909 -6.652 1.00 15.28 ? 29 VAL C CG2 1 +ATOM 3786 N N . SER C 1 30 ? -5.244 3.535 -9.523 1.00 18.29 ? 30 SER C N 1 +ATOM 3787 C CA . SER C 1 30 ? -4.931 2.640 -10.585 1.00 21.81 ? 30 SER C CA 1 +ATOM 3788 C C . SER C 1 30 ? -3.436 2.472 -10.544 1.00 28.99 ? 30 SER C C 1 +ATOM 3789 O O . SER C 1 30 ? -2.680 3.442 -10.652 1.00 30.99 ? 30 SER C O 1 +ATOM 3790 C CB . SER C 1 30 ? -5.300 3.193 -11.916 1.00 17.85 ? 30 SER C CB 1 +ATOM 3791 O OG . SER C 1 30 ? -6.715 3.187 -11.939 1.00 23.66 ? 30 SER C OG 1 +ATOM 3792 N N . GLY C 1 31 ? -3.006 1.227 -10.336 1.00 30.35 ? 31 GLY C N 1 +ATOM 3793 C CA . GLY C 1 31 ? -1.593 0.918 -10.405 1.00 27.59 ? 31 GLY C CA 1 +ATOM 3794 C C . GLY C 1 31 ? -1.258 0.156 -11.661 1.00 29.00 ? 31 GLY C C 1 +ATOM 3795 O O . GLY C 1 31 ? -2.076 -0.565 -12.222 1.00 32.96 ? 31 GLY C O 1 +ATOM 3796 N N . GLU C 1 32 ? -0.081 0.377 -12.200 1.00 28.66 ? 32 GLU C N 1 +ATOM 3797 C CA . GLU C 1 32 ? 0.324 -0.456 -13.298 1.00 28.49 ? 32 GLU C CA 1 +ATOM 3798 C C . GLU C 1 32 ? 1.839 -0.495 -13.368 1.00 29.47 ? 32 GLU C C 1 +ATOM 3799 O O . GLU C 1 32 ? 2.566 0.430 -12.983 1.00 35.04 ? 32 GLU C O 1 +ATOM 3800 C CB . GLU C 1 32 ? -0.292 0.060 -14.595 1.00 21.10 ? 32 GLU C CB 1 +ATOM 3801 C CG . GLU C 1 32 ? 0.114 1.415 -15.081 1.00 36.23 ? 32 GLU C CG 1 +ATOM 3802 C CD . GLU C 1 32 ? 1.394 1.510 -15.895 1.00 37.48 ? 32 GLU C CD 1 +ATOM 3803 O OE1 . GLU C 1 32 ? 1.504 0.806 -16.911 1.00 44.36 ? 32 GLU C OE1 1 +ATOM 3804 O OE2 . GLU C 1 32 ? 2.250 2.306 -15.510 1.00 30.95 ? 32 GLU C OE2 1 +ATOM 3805 N N . GLY C 1 33 ? 2.278 -1.670 -13.783 1.00 29.30 ? 33 GLY C N 1 +ATOM 3806 C CA . GLY C 1 33 ? 3.680 -1.917 -13.949 1.00 29.58 ? 33 GLY C CA 1 +ATOM 3807 C C . GLY C 1 33 ? 3.944 -3.329 -14.403 1.00 27.89 ? 33 GLY C C 1 +ATOM 3808 O O . GLY C 1 33 ? 3.291 -3.906 -15.277 1.00 26.50 ? 33 GLY C O 1 +ATOM 3809 N N . GLU C 1 34 ? 4.994 -3.844 -13.795 1.00 25.42 ? 34 GLU C N 1 +ATOM 3810 C CA . GLU C 1 34 ? 5.447 -5.179 -14.099 1.00 22.48 ? 34 GLU C CA 1 +ATOM 3811 C C . GLU C 1 34 ? 6.209 -5.818 -12.983 1.00 17.58 ? 34 GLU C C 1 +ATOM 3812 O O . GLU C 1 34 ? 6.753 -5.182 -12.089 1.00 15.44 ? 34 GLU C O 1 +ATOM 3813 C CB . GLU C 1 34 ? 6.282 -5.184 -15.354 1.00 18.23 ? 34 GLU C CB 1 +ATOM 3814 C CG . GLU C 1 34 ? 7.337 -4.156 -15.478 1.00 16.93 ? 34 GLU C CG 1 +ATOM 3815 C CD . GLU C 1 34 ? 8.115 -4.320 -16.760 1.00 26.16 ? 34 GLU C CD 1 +ATOM 3816 O OE1 . GLU C 1 34 ? 7.493 -4.359 -17.837 1.00 23.38 ? 34 GLU C OE1 1 +ATOM 3817 O OE2 . GLU C 1 34 ? 9.345 -4.423 -16.660 1.00 30.20 ? 34 GLU C OE2 1 +ATOM 3818 N N . GLY C 1 35 ? 6.016 -7.139 -12.987 1.00 20.82 ? 35 GLY C N 1 +ATOM 3819 C CA . GLY C 1 35 ? 6.561 -8.010 -11.956 1.00 12.63 ? 35 GLY C CA 1 +ATOM 3820 C C . GLY C 1 35 ? 7.409 -9.014 -12.647 1.00 16.65 ? 35 GLY C C 1 +ATOM 3821 O O . GLY C 1 35 ? 7.080 -9.440 -13.755 1.00 13.72 ? 35 GLY C O 1 +ATOM 3822 N N . ASP C 1 36 ? 8.542 -9.289 -11.993 1.00 18.18 ? 36 ASP C N 1 +ATOM 3823 C CA . ASP C 1 36 ? 9.529 -10.220 -12.512 1.00 26.05 ? 36 ASP C CA 1 +ATOM 3824 C C . ASP C 1 36 ? 9.883 -11.104 -11.347 1.00 24.92 ? 36 ASP C C 1 +ATOM 3825 O O . ASP C 1 36 ? 10.735 -10.735 -10.541 1.00 25.78 ? 36 ASP C O 1 +ATOM 3826 C CB . ASP C 1 36 ? 10.797 -9.513 -12.967 1.00 35.59 ? 36 ASP C CB 1 +ATOM 3827 C CG . ASP C 1 36 ? 11.702 -10.370 -13.822 1.00 39.03 ? 36 ASP C CG 1 +ATOM 3828 O OD1 . ASP C 1 36 ? 11.643 -11.595 -13.760 1.00 49.20 ? 36 ASP C OD1 1 +ATOM 3829 O OD2 . ASP C 1 36 ? 12.460 -9.783 -14.584 1.00 47.65 ? 36 ASP C OD2 1 +ATOM 3830 N N . ALA C 1 37 ? 9.214 -12.259 -11.270 1.00 27.13 ? 37 ALA C N 1 +ATOM 3831 C CA . ALA C 1 37 ? 9.393 -13.236 -10.195 1.00 28.17 ? 37 ALA C CA 1 +ATOM 3832 C C . ALA C 1 37 ? 10.804 -13.870 -10.115 1.00 29.05 ? 37 ALA C C 1 +ATOM 3833 O O . ALA C 1 37 ? 11.289 -14.195 -9.024 1.00 23.85 ? 37 ALA C O 1 +ATOM 3834 C CB . ALA C 1 37 ? 8.374 -14.342 -10.382 1.00 29.10 ? 37 ALA C CB 1 +ATOM 3835 N N . THR C 1 38 ? 11.462 -14.001 -11.286 1.00 26.13 ? 38 THR C N 1 +ATOM 3836 C CA . THR C 1 38 ? 12.811 -14.505 -11.397 1.00 30.63 ? 38 THR C CA 1 +ATOM 3837 C C . THR C 1 38 ? 13.790 -13.745 -10.499 1.00 30.57 ? 38 THR C C 1 +ATOM 3838 O O . THR C 1 38 ? 14.641 -14.332 -9.809 1.00 34.24 ? 38 THR C O 1 +ATOM 3839 C CB . THR C 1 38 ? 13.242 -14.406 -12.859 1.00 31.11 ? 38 THR C CB 1 +ATOM 3840 O OG1 . THR C 1 38 ? 12.278 -15.130 -13.617 1.00 32.27 ? 38 THR C OG1 1 +ATOM 3841 C CG2 . THR C 1 38 ? 14.656 -14.924 -13.072 1.00 30.98 ? 38 THR C CG2 1 +ATOM 3842 N N . TYR C 1 39 ? 13.611 -12.421 -10.517 1.00 24.98 ? 39 TYR C N 1 +ATOM 3843 C CA . TYR C 1 39 ? 14.366 -11.520 -9.659 1.00 26.20 ? 39 TYR C CA 1 +ATOM 3844 C C . TYR C 1 39 ? 13.631 -11.262 -8.359 1.00 25.24 ? 39 TYR C C 1 +ATOM 3845 O O . TYR C 1 39 ? 14.223 -10.993 -7.312 1.00 27.49 ? 39 TYR C O 1 +ATOM 3846 C CB . TYR C 1 39 ? 14.627 -10.179 -10.307 1.00 26.35 ? 39 TYR C CB 1 +ATOM 3847 C CG . TYR C 1 39 ? 15.485 -10.371 -11.558 1.00 31.75 ? 39 TYR C CG 1 +ATOM 3848 C CD1 . TYR C 1 39 ? 16.884 -10.464 -11.477 1.00 31.07 ? 39 TYR C CD1 1 +ATOM 3849 C CD2 . TYR C 1 39 ? 14.883 -10.414 -12.807 1.00 33.20 ? 39 TYR C CD2 1 +ATOM 3850 C CE1 . TYR C 1 39 ? 17.673 -10.590 -12.629 1.00 28.20 ? 39 TYR C CE1 1 +ATOM 3851 C CE2 . TYR C 1 39 ? 15.661 -10.533 -13.968 1.00 38.01 ? 39 TYR C CE2 1 +ATOM 3852 C CZ . TYR C 1 39 ? 17.056 -10.615 -13.877 1.00 30.55 ? 39 TYR C CZ 1 +ATOM 3853 O OH . TYR C 1 39 ? 17.809 -10.621 -15.038 1.00 23.50 ? 39 TYR C OH 1 +ATOM 3854 N N . GLY C 1 40 ? 12.307 -11.434 -8.366 1.00 26.10 ? 40 GLY C N 1 +ATOM 3855 C CA . GLY C 1 40 ? 11.540 -11.128 -7.183 1.00 23.31 ? 40 GLY C CA 1 +ATOM 3856 C C . GLY C 1 40 ? 11.318 -9.629 -7.080 1.00 20.91 ? 40 GLY C C 1 +ATOM 3857 O O . GLY C 1 40 ? 11.292 -9.079 -5.975 1.00 24.78 ? 40 GLY C O 1 +ATOM 3858 N N . LYS C 1 41 ? 11.167 -8.994 -8.236 1.00 11.09 ? 41 LYS C N 1 +ATOM 3859 C CA . LYS C 1 41 ? 10.951 -7.565 -8.256 1.00 20.72 ? 41 LYS C CA 1 +ATOM 3860 C C . LYS C 1 41 ? 9.662 -7.060 -8.927 1.00 18.48 ? 41 LYS C C 1 +ATOM 3861 O O . LYS C 1 41 ? 9.254 -7.454 -10.022 1.00 18.63 ? 41 LYS C O 1 +ATOM 3862 C CB . LYS C 1 41 ? 12.134 -6.839 -8.937 1.00 21.03 ? 41 LYS C CB 1 +ATOM 3863 C CG . LYS C 1 41 ? 12.256 -6.938 -10.439 1.00 26.48 ? 41 LYS C CG 1 +ATOM 3864 C CD . LYS C 1 41 ? 13.388 -6.084 -11.010 1.00 29.74 ? 41 LYS C CD 1 +ATOM 3865 C CE . LYS C 1 41 ? 13.277 -4.612 -10.704 1.00 34.80 ? 41 LYS C CE 1 +ATOM 3866 N NZ . LYS C 1 41 ? 14.341 -3.883 -11.383 1.00 32.98 ? 41 LYS C NZ 1 +ATOM 3867 N N . LEU C 1 42 ? 9.096 -6.087 -8.243 1.00 15.74 ? 42 LEU C N 1 +ATOM 3868 C CA . LEU C 1 42 ? 7.955 -5.312 -8.757 1.00 20.06 ? 42 LEU C CA 1 +ATOM 3869 C C . LEU C 1 42 ? 8.298 -3.868 -9.087 1.00 17.47 ? 42 LEU C C 1 +ATOM 3870 O O . LEU C 1 42 ? 8.858 -3.107 -8.294 1.00 18.86 ? 42 LEU C O 1 +ATOM 3871 C CB . LEU C 1 42 ? 6.854 -5.262 -7.730 1.00 22.15 ? 42 LEU C CB 1 +ATOM 3872 C CG . LEU C 1 42 ? 6.404 -6.625 -7.401 1.00 25.99 ? 42 LEU C CG 1 +ATOM 3873 C CD1 . LEU C 1 42 ? 5.890 -6.727 -5.997 1.00 20.30 ? 42 LEU C CD1 1 +ATOM 3874 C CD2 . LEU C 1 42 ? 5.479 -6.988 -8.517 1.00 26.11 ? 42 LEU C CD2 1 +ATOM 3875 N N . THR C 1 43 ? 7.875 -3.500 -10.280 1.00 18.80 ? 43 THR C N 1 +ATOM 3876 C CA . THR C 1 43 ? 7.972 -2.134 -10.773 1.00 20.38 ? 43 THR C CA 1 +ATOM 3877 C C . THR C 1 43 ? 6.556 -1.617 -10.946 1.00 15.87 ? 43 THR C C 1 +ATOM 3878 O O . THR C 1 43 ? 5.931 -1.770 -11.985 1.00 22.43 ? 43 THR C O 1 +ATOM 3879 C CB . THR C 1 43 ? 8.791 -2.209 -12.069 1.00 18.22 ? 43 THR C CB 1 +ATOM 3880 O OG1 . THR C 1 43 ? 10.027 -2.025 -11.409 1.00 27.85 ? 43 THR C OG1 1 +ATOM 3881 C CG2 . THR C 1 43 ? 8.642 -1.209 -13.229 1.00 26.69 ? 43 THR C CG2 1 +ATOM 3882 N N . LEU C 1 44 ? 5.990 -1.027 -9.913 1.00 13.79 ? 44 LEU C N 1 +ATOM 3883 C CA . LEU C 1 44 ? 4.629 -0.464 -9.998 1.00 18.10 ? 44 LEU C CA 1 +ATOM 3884 C C . LEU C 1 44 ? 4.393 1.036 -9.841 1.00 17.95 ? 44 LEU C C 1 +ATOM 3885 O O . LEU C 1 44 ? 4.928 1.607 -8.892 1.00 25.98 ? 44 LEU C O 1 +ATOM 3886 C CB . LEU C 1 44 ? 3.748 -1.134 -8.960 1.00 16.22 ? 44 LEU C CB 1 +ATOM 3887 C CG . LEU C 1 44 ? 3.460 -2.571 -9.209 1.00 18.63 ? 44 LEU C CG 1 +ATOM 3888 C CD1 . LEU C 1 44 ? 2.956 -3.185 -7.931 1.00 19.20 ? 44 LEU C CD1 1 +ATOM 3889 C CD2 . LEU C 1 44 ? 2.581 -2.654 -10.439 1.00 7.82 ? 44 LEU C CD2 1 +ATOM 3890 N N . LYS C 1 45 ? 3.557 1.702 -10.651 1.00 18.66 ? 45 LYS C N 1 +ATOM 3891 C CA . LYS C 1 45 ? 3.189 3.102 -10.380 1.00 11.87 ? 45 LYS C CA 1 +ATOM 3892 C C . LYS C 1 45 ? 1.667 3.204 -10.198 1.00 16.33 ? 45 LYS C C 1 +ATOM 3893 O O . LYS C 1 45 ? 0.848 2.832 -11.045 1.00 18.52 ? 45 LYS C O 1 +ATOM 3894 C CB . LYS C 1 45 ? 3.584 4.038 -11.540 1.00 6.50 ? 45 LYS C CB 1 +ATOM 3895 C CG . LYS C 1 45 ? 3.345 5.542 -11.200 1.00 2.48 ? 45 LYS C CG 1 +ATOM 3896 C CD . LYS C 1 45 ? 3.342 6.199 -12.552 1.00 14.19 ? 45 LYS C CD 1 +ATOM 3897 C CE . LYS C 1 45 ? 3.154 7.725 -12.617 1.00 13.74 ? 45 LYS C CE 1 +ATOM 3898 N NZ . LYS C 1 45 ? 3.350 8.196 -13.994 1.00 12.73 ? 45 LYS C NZ 1 +ATOM 3899 N N . PHE C 1 46 ? 1.342 3.768 -9.056 1.00 13.05 ? 46 PHE C N 1 +ATOM 3900 C CA . PHE C 1 46 ? 0.005 4.023 -8.616 1.00 15.77 ? 46 PHE C CA 1 +ATOM 3901 C C . PHE C 1 46 ? -0.397 5.459 -8.794 1.00 19.97 ? 46 PHE C C 1 +ATOM 3902 O O . PHE C 1 46 ? 0.323 6.353 -8.400 1.00 25.11 ? 46 PHE C O 1 +ATOM 3903 C CB . PHE C 1 46 ? -0.128 3.689 -7.174 1.00 16.80 ? 46 PHE C CB 1 +ATOM 3904 C CG . PHE C 1 46 ? 0.313 2.256 -6.907 1.00 27.43 ? 46 PHE C CG 1 +ATOM 3905 C CD1 . PHE C 1 46 ? -0.471 1.165 -7.331 1.00 25.68 ? 46 PHE C CD1 1 +ATOM 3906 C CD2 . PHE C 1 46 ? 1.546 2.042 -6.272 1.00 28.42 ? 46 PHE C CD2 1 +ATOM 3907 C CE1 . PHE C 1 46 ? -0.008 -0.126 -7.119 1.00 26.43 ? 46 PHE C CE1 1 +ATOM 3908 C CE2 . PHE C 1 46 ? 2.001 0.740 -6.063 1.00 28.13 ? 46 PHE C CE2 1 +ATOM 3909 C CZ . PHE C 1 46 ? 1.221 -0.334 -6.489 1.00 28.66 ? 46 PHE C CZ 1 +ATOM 3910 N N . ILE C 1 47 ? -1.520 5.720 -9.446 1.00 23.73 ? 47 ILE C N 1 +ATOM 3911 C CA . ILE C 1 47 ? -2.079 7.055 -9.631 1.00 24.94 ? 47 ILE C CA 1 +ATOM 3912 C C . ILE C 1 47 ? -3.348 7.079 -8.784 1.00 25.22 ? 47 ILE C C 1 +ATOM 3913 O O . ILE C 1 47 ? -4.139 6.145 -8.857 1.00 22.34 ? 47 ILE C O 1 +ATOM 3914 C CB . ILE C 1 47 ? -2.472 7.314 -11.120 1.00 27.24 ? 47 ILE C CB 1 +ATOM 3915 C CG1 . ILE C 1 47 ? -1.272 7.363 -12.029 1.00 23.48 ? 47 ILE C CG1 1 +ATOM 3916 C CG2 . ILE C 1 47 ? -3.227 8.607 -11.209 1.00 23.36 ? 47 ILE C CG2 1 +ATOM 3917 C CD1 . ILE C 1 47 ? -0.286 8.407 -11.546 1.00 29.99 ? 47 ILE C CD1 1 +ATOM 3918 N N . CYS C 1 48 ? -3.581 8.078 -7.944 1.00 27.16 ? 48 CYS C N 1 +ATOM 3919 C CA . CYS C 1 48 ? -4.880 8.201 -7.318 1.00 24.87 ? 48 CYS C CA 1 +ATOM 3920 C C . CYS C 1 48 ? -5.746 8.863 -8.374 1.00 22.07 ? 48 CYS C C 1 +ATOM 3921 O O . CYS C 1 48 ? -5.498 9.960 -8.842 1.00 30.28 ? 48 CYS C O 1 +ATOM 3922 C CB . CYS C 1 48 ? -4.788 9.053 -6.110 1.00 26.29 ? 48 CYS C CB 1 +ATOM 3923 S SG . CYS C 1 48 ? -6.400 9.057 -5.298 1.00 19.68 ? 48 CYS C SG 1 +ATOM 3924 N N . THR C 1 49 ? -6.697 8.106 -8.896 1.00 22.78 ? 49 THR C N 1 +ATOM 3925 C CA . THR C 1 49 ? -7.571 8.575 -9.950 1.00 19.31 ? 49 THR C CA 1 +ATOM 3926 C C . THR C 1 49 ? -8.698 9.503 -9.527 1.00 15.49 ? 49 THR C C 1 +ATOM 3927 O O . THR C 1 49 ? -9.306 10.091 -10.406 1.00 18.26 ? 49 THR C O 1 +ATOM 3928 C CB . THR C 1 49 ? -8.179 7.379 -10.666 1.00 14.24 ? 49 THR C CB 1 +ATOM 3929 O OG1 . THR C 1 49 ? -8.732 6.592 -9.640 1.00 22.99 ? 49 THR C OG1 1 +ATOM 3930 C CG2 . THR C 1 49 ? -7.195 6.674 -11.559 1.00 5.28 ? 49 THR C CG2 1 +ATOM 3931 N N . THR C 1 50 ? -9.006 9.561 -8.222 1.00 13.95 ? 50 THR C N 1 +ATOM 3932 C CA . THR C 1 50 ? -9.980 10.457 -7.633 1.00 18.89 ? 50 THR C CA 1 +ATOM 3933 C C . THR C 1 50 ? -9.363 11.763 -7.120 1.00 23.39 ? 50 THR C C 1 +ATOM 3934 O O . THR C 1 50 ? -9.988 12.419 -6.280 1.00 30.97 ? 50 THR C O 1 +ATOM 3935 C CB . THR C 1 50 ? -10.658 9.773 -6.472 1.00 16.78 ? 50 THR C CB 1 +ATOM 3936 O OG1 . THR C 1 50 ? -9.651 9.286 -5.578 1.00 17.03 ? 50 THR C OG1 1 +ATOM 3937 C CG2 . THR C 1 50 ? -11.590 8.703 -6.984 1.00 15.48 ? 50 THR C CG2 1 +ATOM 3938 N N . GLY C 1 51 ? -8.166 12.148 -7.600 1.00 21.85 ? 51 GLY C N 1 +ATOM 3939 C CA . GLY C 1 51 ? -7.454 13.299 -7.105 1.00 18.07 ? 51 GLY C CA 1 +ATOM 3940 C C . GLY C 1 51 ? -6.352 12.918 -6.141 1.00 20.96 ? 51 GLY C C 1 +ATOM 3941 O O . GLY C 1 51 ? -5.362 12.314 -6.538 1.00 21.31 ? 51 GLY C O 1 +ATOM 3942 N N . LYS C 1 52 ? -6.526 13.274 -4.867 1.00 18.99 ? 52 LYS C N 1 +ATOM 3943 C CA . LYS C 1 52 ? -5.565 13.100 -3.813 1.00 12.36 ? 52 LYS C CA 1 +ATOM 3944 C C . LYS C 1 52 ? -6.046 12.023 -2.882 1.00 16.91 ? 52 LYS C C 1 +ATOM 3945 O O . LYS C 1 52 ? -7.249 11.896 -2.605 1.00 11.96 ? 52 LYS C O 1 +ATOM 3946 C CB . LYS C 1 52 ? -5.407 14.399 -3.038 1.00 15.02 ? 52 LYS C CB 1 +ATOM 3947 C CG . LYS C 1 52 ? -4.086 15.107 -3.205 1.00 14.40 ? 52 LYS C CG 1 +ATOM 3948 C CD . LYS C 1 52 ? -4.079 15.946 -4.478 1.00 23.96 ? 52 LYS C CD 1 +ATOM 3949 C CE . LYS C 1 52 ? -2.924 16.988 -4.496 1.00 14.73 ? 52 LYS C CE 1 +ATOM 3950 N NZ . LYS C 1 52 ? -2.873 17.602 -3.188 1.00 22.37 ? 52 LYS C NZ 1 +ATOM 3951 N N . LEU C 1 53 ? -5.018 11.344 -2.349 1.00 15.07 ? 53 LEU C N 1 +ATOM 3952 C CA . LEU C 1 53 ? -5.205 10.153 -1.602 1.00 15.04 ? 53 LEU C CA 1 +ATOM 3953 C C . LEU C 1 53 ? -5.395 10.497 -0.142 1.00 18.03 ? 53 LEU C C 1 +ATOM 3954 O O . LEU C 1 53 ? -4.536 11.059 0.530 1.00 27.76 ? 53 LEU C O 1 +ATOM 3955 C CB . LEU C 1 53 ? -3.959 9.299 -1.946 1.00 16.73 ? 53 LEU C CB 1 +ATOM 3956 C CG . LEU C 1 53 ? -3.830 7.734 -2.035 1.00 15.49 ? 53 LEU C CG 1 +ATOM 3957 C CD1 . LEU C 1 53 ? -3.404 7.174 -0.729 1.00 10.66 ? 53 LEU C CD1 1 +ATOM 3958 C CD2 . LEU C 1 53 ? -5.138 7.108 -2.490 1.00 8.75 ? 53 LEU C CD2 1 +ATOM 3959 N N . PRO C 1 54 ? -6.553 10.208 0.422 1.00 18.88 ? 54 PRO C N 1 +ATOM 3960 C CA . PRO C 1 54 ? -6.895 10.609 1.791 1.00 11.20 ? 54 PRO C CA 1 +ATOM 3961 C C . PRO C 1 54 ? -6.055 10.086 2.920 1.00 19.15 ? 54 PRO C C 1 +ATOM 3962 O O . PRO C 1 54 ? -6.243 10.444 4.086 1.00 17.37 ? 54 PRO C O 1 +ATOM 3963 C CB . PRO C 1 54 ? -8.309 10.183 1.912 1.00 18.84 ? 54 PRO C CB 1 +ATOM 3964 C CG . PRO C 1 54 ? -8.427 9.069 0.916 1.00 13.69 ? 54 PRO C CG 1 +ATOM 3965 C CD . PRO C 1 54 ? -7.685 9.611 -0.298 1.00 6.82 ? 54 PRO C CD 1 +ATOM 3966 N N . VAL C 1 55 ? -5.207 9.124 2.523 1.00 15.43 ? 55 VAL C N 1 +ATOM 3967 C CA . VAL C 1 55 ? -4.287 8.436 3.404 1.00 16.38 ? 55 VAL C CA 1 +ATOM 3968 C C . VAL C 1 55 ? -2.867 8.490 2.815 1.00 11.29 ? 55 VAL C C 1 +ATOM 3969 O O . VAL C 1 55 ? -2.684 8.772 1.617 1.00 9.68 ? 55 VAL C O 1 +ATOM 3970 C CB . VAL C 1 55 ? -4.696 6.967 3.616 1.00 14.35 ? 55 VAL C CB 1 +ATOM 3971 C CG1 . VAL C 1 55 ? -5.798 7.011 4.628 1.00 13.49 ? 55 VAL C CG1 1 +ATOM 3972 C CG2 . VAL C 1 55 ? -4.967 6.246 2.300 1.00 12.86 ? 55 VAL C CG2 1 +ATOM 3973 N N . PRO C 1 56 ? -1.832 8.276 3.632 1.00 5.03 ? 56 PRO C N 1 +ATOM 3974 C CA . PRO C 1 56 ? -0.444 8.361 3.206 1.00 9.55 ? 56 PRO C CA 1 +ATOM 3975 C C . PRO C 1 56 ? -0.224 7.208 2.278 1.00 16.83 ? 56 PRO C C 1 +ATOM 3976 O O . PRO C 1 56 ? -0.584 6.099 2.660 1.00 18.30 ? 56 PRO C O 1 +ATOM 3977 C CB . PRO C 1 56 ? 0.313 8.269 4.488 1.00 4.76 ? 56 PRO C CB 1 +ATOM 3978 C CG . PRO C 1 56 ? -0.622 8.869 5.541 1.00 7.49 ? 56 PRO C CG 1 +ATOM 3979 C CD . PRO C 1 56 ? -1.897 8.211 5.081 1.00 4.56 ? 56 PRO C CD 1 +ATOM 3980 N N . TRP C 1 57 ? 0.293 7.426 1.061 1.00 15.63 ? 57 TRP C N 1 +ATOM 3981 C CA . TRP C 1 57 ? 0.594 6.341 0.152 1.00 17.34 ? 57 TRP C CA 1 +ATOM 3982 C C . TRP C 1 57 ? 1.329 5.094 0.683 1.00 22.67 ? 57 TRP C C 1 +ATOM 3983 O O . TRP C 1 57 ? 1.063 4.028 0.120 1.00 25.59 ? 57 TRP C O 1 +ATOM 3984 C CB . TRP C 1 57 ? 1.427 6.816 -0.982 1.00 7.72 ? 57 TRP C CB 1 +ATOM 3985 C CG . TRP C 1 57 ? 0.696 7.569 -2.040 1.00 8.21 ? 57 TRP C CG 1 +ATOM 3986 C CD1 . TRP C 1 57 ? 0.793 8.945 -2.139 1.00 6.74 ? 57 TRP C CD1 1 +ATOM 3987 C CD2 . TRP C 1 57 ? -0.032 6.985 -3.023 1.00 13.04 ? 57 TRP C CD2 1 +ATOM 3988 N NE1 . TRP C 1 57 ? 0.136 9.230 -3.224 1.00 9.05 ? 57 TRP C NE1 1 +ATOM 3989 C CE2 . TRP C 1 57 ? -0.372 8.112 -3.778 1.00 13.24 ? 57 TRP C CE2 1 +ATOM 3990 C CE3 . TRP C 1 57 ? -0.450 5.698 -3.411 1.00 17.92 ? 57 TRP C CE3 1 +ATOM 3991 C CZ2 . TRP C 1 57 ? -1.141 7.970 -4.931 1.00 12.01 ? 57 TRP C CZ2 1 +ATOM 3992 C CZ3 . TRP C 1 57 ? -1.215 5.568 -4.567 1.00 10.66 ? 57 TRP C CZ3 1 +ATOM 3993 C CH2 . TRP C 1 57 ? -1.556 6.703 -5.322 1.00 11.57 ? 57 TRP C CH2 1 +ATOM 3994 N N . PRO C 1 58 ? 2.250 5.157 1.680 1.00 24.19 ? 58 PRO C N 1 +ATOM 3995 C CA . PRO C 1 58 ? 2.875 4.038 2.366 1.00 24.89 ? 58 PRO C CA 1 +ATOM 3996 C C . PRO C 1 58 ? 1.943 3.109 3.088 1.00 25.09 ? 58 PRO C C 1 +ATOM 3997 O O . PRO C 1 58 ? 2.269 1.946 3.322 1.00 26.95 ? 58 PRO C O 1 +ATOM 3998 C CB . PRO C 1 58 ? 3.841 4.647 3.344 1.00 25.77 ? 58 PRO C CB 1 +ATOM 3999 C CG . PRO C 1 58 ? 4.272 5.874 2.645 1.00 23.78 ? 58 PRO C CG 1 +ATOM 4000 C CD . PRO C 1 58 ? 2.922 6.358 2.187 1.00 27.46 ? 58 PRO C CD 1 +ATOM 4001 N N . THR C 1 59 ? 0.836 3.691 3.559 1.00 18.63 ? 59 THR C N 1 +ATOM 4002 C CA . THR C 1 59 ? -0.114 2.880 4.275 1.00 16.63 ? 59 THR C CA 1 +ATOM 4003 C C . THR C 1 59 ? -0.821 1.806 3.467 1.00 17.35 ? 59 THR C C 1 +ATOM 4004 O O . THR C 1 59 ? -1.257 0.796 4.027 1.00 18.77 ? 59 THR C O 1 +ATOM 4005 C CB . THR C 1 59 ? -1.140 3.769 4.933 1.00 10.60 ? 59 THR C CB 1 +ATOM 4006 O OG1 . THR C 1 59 ? -1.819 4.506 3.930 1.00 7.17 ? 59 THR C OG1 1 +ATOM 4007 C CG2 . THR C 1 59 ? -0.469 4.549 6.005 1.00 11.30 ? 59 THR C CG2 1 +ATOM 4008 N N . LEU C 1 60 ? -0.825 2.083 2.166 1.00 15.50 ? 60 LEU C N 1 +ATOM 4009 C CA . LEU C 1 60 ? -1.373 1.277 1.116 1.00 19.92 ? 60 LEU C CA 1 +ATOM 4010 C C . LEU C 1 60 ? -0.375 0.436 0.344 1.00 21.08 ? 60 LEU C C 1 +ATOM 4011 O O . LEU C 1 60 ? -0.785 -0.205 -0.630 1.00 21.55 ? 60 LEU C O 1 +ATOM 4012 C CB . LEU C 1 60 ? -2.064 2.118 0.089 1.00 8.59 ? 60 LEU C CB 1 +ATOM 4013 C CG . LEU C 1 60 ? -3.118 3.022 0.501 1.00 13.53 ? 60 LEU C CG 1 +ATOM 4014 C CD1 . LEU C 1 60 ? -3.644 3.603 -0.778 1.00 16.34 ? 60 LEU C CD1 1 +ATOM 4015 C CD2 . LEU C 1 60 ? -4.271 2.354 1.212 1.00 12.49 ? 60 LEU C CD2 1 +ATOM 4016 N N . VAL C 1 61 ? 0.919 0.372 0.697 1.00 23.70 ? 61 VAL C N 1 +ATOM 4017 C CA . VAL C 1 61 ? 1.838 -0.425 -0.146 1.00 20.28 ? 61 VAL C CA 1 +ATOM 4018 C C . VAL C 1 61 ? 1.537 -1.913 -0.010 1.00 12.95 ? 61 VAL C C 1 +ATOM 4019 O O . VAL C 1 61 ? 1.510 -2.618 -1.012 1.00 14.45 ? 61 VAL C O 1 +ATOM 4020 C CB . VAL C 1 61 ? 3.355 -0.145 0.216 1.00 17.46 ? 61 VAL C CB 1 +ATOM 4021 C CG1 . VAL C 1 61 ? 4.299 -1.161 -0.391 1.00 5.41 ? 61 VAL C CG1 1 +ATOM 4022 C CG2 . VAL C 1 61 ? 3.728 1.205 -0.364 1.00 15.96 ? 61 VAL C CG2 1 +ATOM 4023 N N . THR C 1 62 ? 1.258 -2.398 1.195 1.00 11.58 ? 62 THR C N 1 +ATOM 4024 C CA . THR C 1 62 ? 1.039 -3.807 1.270 1.00 13.00 ? 62 THR C CA 1 +ATOM 4025 C C . THR C 1 62 ? -0.281 -4.231 0.641 1.00 21.33 ? 62 THR C C 1 +ATOM 4026 O O . THR C 1 62 ? -0.407 -5.352 0.145 1.00 28.44 ? 62 THR C O 1 +ATOM 4027 C CB . THR C 1 62 ? 1.128 -4.219 2.685 1.00 15.60 ? 62 THR C CB 1 +ATOM 4028 O OG1 . THR C 1 62 ? 0.152 -3.531 3.391 1.00 6.11 ? 62 THR C OG1 1 +ATOM 4029 C CG2 . THR C 1 62 ? 2.501 -3.932 3.254 1.00 11.85 ? 62 THR C CG2 1 +ATOM 4030 N N . THR C 1 63 ? -1.224 -3.289 0.531 1.00 22.20 ? 63 THR C N 1 +ATOM 4031 C CA . THR C 1 63 ? -2.509 -3.518 -0.110 1.00 16.86 ? 63 THR C CA 1 +ATOM 4032 C C . THR C 1 63 ? -2.320 -3.582 -1.599 1.00 13.87 ? 63 THR C C 1 +ATOM 4033 O O . THR C 1 63 ? -2.943 -4.419 -2.244 1.00 28.25 ? 63 THR C O 1 +ATOM 4034 C CB . THR C 1 63 ? -3.459 -2.384 0.312 1.00 11.78 ? 63 THR C CB 1 +ATOM 4035 O OG1 . THR C 1 63 ? -3.747 -2.515 1.722 1.00 3.99 ? 63 THR C OG1 1 +ATOM 4036 C CG2 . THR C 1 63 ? -4.697 -2.441 -0.484 1.00 2.64 ? 63 THR C CG2 1 +ATOM 4037 N N . PHE C 1 64 ? -1.428 -2.814 -2.181 1.00 17.10 ? 64 PHE C N 1 +ATOM 4038 C CA . PHE C 1 64 ? -1.295 -2.785 -3.614 1.00 14.37 ? 64 PHE C CA 1 +ATOM 4039 C C . PHE C 1 64 ? -0.330 -3.811 -4.097 1.00 15.76 ? 64 PHE C C 1 +ATOM 4040 O O . PHE C 1 64 ? -0.514 -4.283 -5.222 1.00 15.19 ? 64 PHE C O 1 +ATOM 4041 C CB . PHE C 1 64 ? -0.773 -1.473 -4.142 1.00 20.18 ? 64 PHE C CB 1 +ATOM 4042 C CG . PHE C 1 64 ? -1.460 -0.161 -3.897 1.00 14.37 ? 64 PHE C CG 1 +ATOM 4043 C CD1 . PHE C 1 64 ? -2.826 -0.003 -4.139 1.00 22.51 ? 64 PHE C CD1 1 +ATOM 4044 C CD2 . PHE C 1 64 ? -0.693 0.905 -3.435 1.00 16.59 ? 64 PHE C CD2 1 +ATOM 4045 C CE1 . PHE C 1 64 ? -3.412 1.233 -3.913 1.00 17.29 ? 64 PHE C CE1 1 +ATOM 4046 C CE2 . PHE C 1 64 ? -1.285 2.145 -3.212 1.00 4.87 ? 64 PHE C CE2 1 +ATOM 4047 C CZ . PHE C 1 64 ? -2.640 2.305 -3.451 1.00 17.48 ? 64 PHE C CZ 1 +HETATM 4048 N N1 . CRO C 1 65 ? 0.747 -4.010 -3.295 1.00 24.42 ? 66 CRO C N1 1 +HETATM 4049 C CA1 . CRO C 1 65 ? 1.809 -5.058 -3.478 1.00 38.73 ? 66 CRO C CA1 1 +HETATM 4050 C CB1 . CRO C 1 65 ? 3.125 -4.358 -3.623 1.00 23.85 ? 66 CRO C CB1 1 +HETATM 4051 O OG1 . CRO C 1 65 ? 3.682 -4.889 -4.832 1.00 23.63 ? 66 CRO C OG1 1 +HETATM 4052 C C1 . CRO C 1 65 ? 1.813 -5.994 -2.225 1.00 20.29 ? 66 CRO C C1 1 +HETATM 4053 N N2 . CRO C 1 65 ? 2.829 -5.867 -1.319 1.00 19.45 ? 66 CRO C N2 1 +HETATM 4054 N N3 . CRO C 1 65 ? 0.868 -6.911 -1.921 1.00 14.94 ? 66 CRO C N3 1 +HETATM 4055 C C2 . CRO C 1 65 ? 1.170 -7.529 -0.796 1.00 16.70 ? 66 CRO C C2 1 +HETATM 4056 O O2 . CRO C 1 65 ? 0.561 -8.391 -0.216 1.00 10.02 ? 66 CRO C O2 1 +HETATM 4057 C CA2 . CRO C 1 65 ? 2.461 -6.892 -0.317 1.00 12.04 ? 66 CRO C CA2 1 +HETATM 4058 C CA3 . CRO C 1 65 ? -0.295 -7.166 -2.729 1.00 8.66 ? 66 CRO C CA3 1 +HETATM 4059 C C3 . CRO C 1 65 ? -0.188 -8.147 -3.838 1.00 18.91 ? 66 CRO C C3 1 +HETATM 4060 O O3 . CRO C 1 65 ? -1.099 -8.942 -4.004 1.00 24.57 ? 66 CRO C O3 1 +HETATM 4061 C CB2 . CRO C 1 65 ? 3.179 -7.191 0.846 1.00 9.71 ? 66 CRO C CB2 1 +HETATM 4062 C CG2 . CRO C 1 65 ? 4.360 -6.671 1.300 1.00 23.21 ? 66 CRO C CG2 1 +HETATM 4063 C CD1 . CRO C 1 65 ? 5.173 -5.643 0.764 1.00 22.83 ? 66 CRO C CD1 1 +HETATM 4064 C CD2 . CRO C 1 65 ? 4.712 -7.240 2.514 1.00 23.37 ? 66 CRO C CD2 1 +HETATM 4065 C CE1 . CRO C 1 65 ? 6.288 -5.177 1.484 1.00 24.84 ? 66 CRO C CE1 1 +HETATM 4066 C CE2 . CRO C 1 65 ? 5.841 -6.784 3.203 1.00 29.83 ? 66 CRO C CE2 1 +HETATM 4067 C CZ . CRO C 1 65 ? 6.616 -5.785 2.678 1.00 29.48 ? 66 CRO C CZ 1 +HETATM 4068 O OH . CRO C 1 65 ? 7.734 -5.464 3.438 1.00 46.61 ? 66 CRO C OH 1 +ATOM 4069 N N . VAL C 1 66 ? 0.845 -8.079 -4.672 1.00 20.63 ? 68 VAL C N 1 +ATOM 4070 C CA . VAL C 1 66 ? 1.025 -9.114 -5.645 1.00 15.14 ? 68 VAL C CA 1 +ATOM 4071 C C . VAL C 1 66 ? 2.250 -10.008 -5.347 1.00 11.96 ? 68 VAL C C 1 +ATOM 4072 O O . VAL C 1 66 ? 3.139 -10.266 -6.154 1.00 14.78 ? 68 VAL C O 1 +ATOM 4073 C CB . VAL C 1 66 ? 1.075 -8.420 -6.987 1.00 18.76 ? 68 VAL C CB 1 +ATOM 4074 C CG1 . VAL C 1 66 ? -0.333 -7.940 -7.238 1.00 18.37 ? 68 VAL C CG1 1 +ATOM 4075 C CG2 . VAL C 1 66 ? 2.046 -7.246 -7.025 1.00 25.29 ? 68 VAL C CG2 1 +ATOM 4076 N N . GLN C 1 67 ? 2.181 -10.622 -4.168 1.00 7.32 ? 69 GLN C N 1 +ATOM 4077 C CA . GLN C 1 67 ? 3.186 -11.510 -3.593 1.00 12.77 ? 69 GLN C CA 1 +ATOM 4078 C C . GLN C 1 67 ? 3.491 -12.771 -4.385 1.00 14.20 ? 69 GLN C C 1 +ATOM 4079 O O . GLN C 1 67 ? 4.460 -13.472 -4.140 1.00 9.58 ? 69 GLN C O 1 +ATOM 4080 C CB . GLN C 1 67 ? 2.788 -11.921 -2.192 1.00 5.44 ? 69 GLN C CB 1 +ATOM 4081 C CG . GLN C 1 67 ? 3.003 -10.700 -1.294 1.00 8.43 ? 69 GLN C CG 1 +ATOM 4082 C CD . GLN C 1 67 ? 2.498 -10.935 0.115 1.00 14.25 ? 69 GLN C CD 1 +ATOM 4083 O OE1 . GLN C 1 67 ? 1.575 -11.719 0.347 1.00 26.04 ? 69 GLN C OE1 1 +ATOM 4084 N NE2 . GLN C 1 67 ? 3.022 -10.262 1.118 1.00 12.28 ? 69 GLN C NE2 1 +ATOM 4085 N N . CYS C 1 68 ? 2.734 -12.962 -5.452 1.00 13.58 ? 70 CYS C N 1 +ATOM 4086 C CA . CYS C 1 68 ? 3.031 -14.008 -6.375 1.00 20.31 ? 70 CYS C CA 1 +ATOM 4087 C C . CYS C 1 68 ? 4.240 -13.664 -7.205 1.00 20.08 ? 70 CYS C C 1 +ATOM 4088 O O . CYS C 1 68 ? 4.586 -14.380 -8.135 1.00 22.38 ? 70 CYS C O 1 +ATOM 4089 C CB . CYS C 1 68 ? 1.807 -14.214 -7.218 1.00 21.86 ? 70 CYS C CB 1 +ATOM 4090 S SG . CYS C 1 68 ? 1.276 -12.747 -8.083 1.00 31.30 ? 70 CYS C SG 1 +ATOM 4091 N N . PHE C 1 69 ? 4.869 -12.515 -6.931 1.00 21.32 ? 71 PHE C N 1 +ATOM 4092 C CA . PHE C 1 69 ? 6.047 -12.106 -7.672 1.00 15.74 ? 71 PHE C CA 1 +ATOM 4093 C C . PHE C 1 69 ? 7.275 -12.220 -6.808 1.00 14.69 ? 71 PHE C C 1 +ATOM 4094 O O . PHE C 1 69 ? 8.350 -11.765 -7.202 1.00 10.30 ? 71 PHE C O 1 +ATOM 4095 C CB . PHE C 1 69 ? 5.910 -10.691 -8.132 1.00 18.34 ? 71 PHE C CB 1 +ATOM 4096 C CG . PHE C 1 69 ? 4.995 -10.579 -9.316 1.00 16.49 ? 71 PHE C CG 1 +ATOM 4097 C CD1 . PHE C 1 69 ? 5.459 -10.987 -10.564 1.00 5.77 ? 71 PHE C CD1 1 +ATOM 4098 C CD2 . PHE C 1 69 ? 3.702 -10.083 -9.138 1.00 12.29 ? 71 PHE C CD2 1 +ATOM 4099 C CE1 . PHE C 1 69 ? 4.602 -10.895 -11.658 1.00 18.04 ? 71 PHE C CE1 1 +ATOM 4100 C CE2 . PHE C 1 69 ? 2.879 -10.007 -10.255 1.00 15.32 ? 71 PHE C CE2 1 +ATOM 4101 C CZ . PHE C 1 69 ? 3.317 -10.409 -11.511 1.00 10.56 ? 71 PHE C CZ 1 +ATOM 4102 N N . SER C 1 70 ? 7.085 -12.810 -5.612 1.00 12.96 ? 72 SER C N 1 +ATOM 4103 C CA . SER C 1 70 ? 8.153 -13.179 -4.726 1.00 12.85 ? 72 SER C CA 1 +ATOM 4104 C C . SER C 1 70 ? 9.063 -14.150 -5.462 1.00 19.11 ? 72 SER C C 1 +ATOM 4105 O O . SER C 1 70 ? 8.679 -14.869 -6.397 1.00 22.63 ? 72 SER C O 1 +ATOM 4106 C CB . SER C 1 70 ? 7.644 -13.874 -3.519 1.00 12.92 ? 72 SER C CB 1 +ATOM 4107 O OG . SER C 1 70 ? 6.728 -13.057 -2.824 1.00 23.66 ? 72 SER C OG 1 +ATOM 4108 N N . ARG C 1 71 ? 10.336 -14.060 -5.119 1.00 22.23 ? 73 ARG C N 1 +ATOM 4109 C CA . ARG C 1 71 ? 11.279 -14.942 -5.730 1.00 26.16 ? 73 ARG C CA 1 +ATOM 4110 C C . ARG C 1 71 ? 11.395 -16.079 -4.731 1.00 23.05 ? 73 ARG C C 1 +ATOM 4111 O O . ARG C 1 71 ? 11.732 -15.875 -3.562 1.00 15.94 ? 73 ARG C O 1 +ATOM 4112 C CB . ARG C 1 71 ? 12.621 -14.273 -5.910 1.00 32.73 ? 73 ARG C CB 1 +ATOM 4113 C CG . ARG C 1 71 ? 13.532 -15.078 -6.806 1.00 38.31 ? 73 ARG C CG 1 +ATOM 4114 C CD . ARG C 1 71 ? 14.933 -14.516 -6.691 1.00 44.47 ? 73 ARG C CD 1 +ATOM 4115 N NE . ARG C 1 71 ? 15.828 -15.658 -6.643 1.00 50.84 ? 73 ARG C NE 1 +ATOM 4116 C CZ . ARG C 1 71 ? 16.371 -16.055 -5.496 1.00 53.45 ? 73 ARG C CZ 1 +ATOM 4117 N NH1 . ARG C 1 71 ? 16.145 -15.423 -4.334 1.00 58.36 ? 73 ARG C NH1 1 +ATOM 4118 N NH2 . ARG C 1 71 ? 17.097 -17.159 -5.518 1.00 56.59 ? 73 ARG C NH2 1 +ATOM 4119 N N . TYR C 1 72 ? 10.965 -17.251 -5.188 1.00 23.14 ? 74 TYR C N 1 +ATOM 4120 C CA . TYR C 1 72 ? 11.193 -18.419 -4.354 1.00 26.79 ? 74 TYR C CA 1 +ATOM 4121 C C . TYR C 1 72 ? 12.462 -19.065 -4.898 1.00 25.67 ? 74 TYR C C 1 +ATOM 4122 O O . TYR C 1 72 ? 12.561 -19.433 -6.090 1.00 27.45 ? 74 TYR C O 1 +ATOM 4123 C CB . TYR C 1 72 ? 10.004 -19.420 -4.399 1.00 17.16 ? 74 TYR C CB 1 +ATOM 4124 C CG . TYR C 1 72 ? 8.914 -19.009 -3.414 1.00 19.47 ? 74 TYR C CG 1 +ATOM 4125 C CD1 . TYR C 1 72 ? 8.174 -17.822 -3.603 1.00 15.07 ? 74 TYR C CD1 1 +ATOM 4126 C CD2 . TYR C 1 72 ? 8.675 -19.796 -2.306 1.00 15.39 ? 74 TYR C CD2 1 +ATOM 4127 C CE1 . TYR C 1 72 ? 7.195 -17.424 -2.672 1.00 10.08 ? 74 TYR C CE1 1 +ATOM 4128 C CE2 . TYR C 1 72 ? 7.704 -19.404 -1.365 1.00 17.29 ? 74 TYR C CE2 1 +ATOM 4129 C CZ . TYR C 1 72 ? 6.981 -18.215 -1.561 1.00 18.02 ? 74 TYR C CZ 1 +ATOM 4130 O OH . TYR C 1 72 ? 6.092 -17.767 -0.615 1.00 16.43 ? 74 TYR C OH 1 +ATOM 4131 N N . PRO C 1 73 ? 13.524 -19.180 -4.079 1.00 26.79 ? 75 PRO C N 1 +ATOM 4132 C CA . PRO C 1 73 ? 14.645 -20.093 -4.346 1.00 28.26 ? 75 PRO C CA 1 +ATOM 4133 C C . PRO C 1 73 ? 14.110 -21.495 -4.696 1.00 26.95 ? 75 PRO C C 1 +ATOM 4134 O O . PRO C 1 73 ? 13.107 -21.949 -4.109 1.00 27.23 ? 75 PRO C O 1 +ATOM 4135 C CB . PRO C 1 73 ? 15.457 -20.045 -3.071 1.00 23.45 ? 75 PRO C CB 1 +ATOM 4136 C CG . PRO C 1 73 ? 14.475 -19.677 -2.026 1.00 24.47 ? 75 PRO C CG 1 +ATOM 4137 C CD . PRO C 1 73 ? 13.659 -18.601 -2.748 1.00 26.91 ? 75 PRO C CD 1 +ATOM 4138 N N . ASP C 1 74 ? 14.751 -22.119 -5.704 1.00 24.54 ? 76 ASP C N 1 +ATOM 4139 C CA . ASP C 1 74 ? 14.346 -23.392 -6.274 1.00 23.61 ? 76 ASP C CA 1 +ATOM 4140 C C . ASP C 1 74 ? 13.975 -24.417 -5.236 1.00 25.24 ? 76 ASP C C 1 +ATOM 4141 O O . ASP C 1 74 ? 13.052 -25.186 -5.493 1.00 32.39 ? 76 ASP C O 1 +ATOM 4142 C CB . ASP C 1 74 ? 15.428 -24.009 -7.103 1.00 30.41 ? 76 ASP C CB 1 +ATOM 4143 C CG . ASP C 1 74 ? 15.831 -23.334 -8.392 1.00 31.77 ? 76 ASP C CG 1 +ATOM 4144 O OD1 . ASP C 1 74 ? 15.226 -22.347 -8.802 1.00 38.82 ? 76 ASP C OD1 1 +ATOM 4145 O OD2 . ASP C 1 74 ? 16.783 -23.816 -8.996 1.00 33.52 ? 76 ASP C OD2 1 +ATOM 4146 N N . HIS C 1 75 ? 14.575 -24.372 -4.042 1.00 20.74 ? 77 HIS C N 1 +ATOM 4147 C CA . HIS C 1 75 ? 14.266 -25.345 -3.019 1.00 26.58 ? 77 HIS C CA 1 +ATOM 4148 C C . HIS C 1 75 ? 13.042 -25.093 -2.152 1.00 32.86 ? 77 HIS C C 1 +ATOM 4149 O O . HIS C 1 75 ? 12.668 -25.912 -1.280 1.00 35.96 ? 77 HIS C O 1 +ATOM 4150 C CB . HIS C 1 75 ? 15.456 -25.510 -2.105 1.00 25.41 ? 77 HIS C CB 1 +ATOM 4151 C CG . HIS C 1 75 ? 15.693 -24.371 -1.139 1.00 24.18 ? 77 HIS C CG 1 +ATOM 4152 N ND1 . HIS C 1 75 ? 16.316 -23.231 -1.382 1.00 25.85 ? 77 HIS C ND1 1 +ATOM 4153 C CD2 . HIS C 1 75 ? 15.308 -24.399 0.169 1.00 23.79 ? 77 HIS C CD2 1 +ATOM 4154 C CE1 . HIS C 1 75 ? 16.315 -22.568 -0.255 1.00 21.72 ? 77 HIS C CE1 1 +ATOM 4155 N NE2 . HIS C 1 75 ? 15.711 -23.272 0.664 1.00 26.07 ? 77 HIS C NE2 1 +ATOM 4156 N N . MET C 1 76 ? 12.482 -23.886 -2.273 1.00 33.34 ? 78 MET C N 1 +ATOM 4157 C CA . MET C 1 76 ? 11.245 -23.679 -1.549 1.00 30.70 ? 78 MET C CA 1 +ATOM 4158 C C . MET C 1 76 ? 10.178 -23.180 -2.489 1.00 30.81 ? 78 MET C C 1 +ATOM 4159 O O . MET C 1 76 ? 9.191 -22.650 -2.037 1.00 33.45 ? 78 MET C O 1 +ATOM 4160 C CB . MET C 1 76 ? 11.461 -22.746 -0.343 1.00 22.63 ? 78 MET C CB 1 +ATOM 4161 C CG . MET C 1 76 ? 12.326 -21.580 -0.569 1.00 22.62 ? 78 MET C CG 1 +ATOM 4162 S SD . MET C 1 76 ? 12.687 -20.584 0.897 1.00 35.17 ? 78 MET C SD 1 +ATOM 4163 C CE . MET C 1 76 ? 11.071 -20.119 1.399 1.00 28.65 ? 78 MET C CE 1 +ATOM 4164 N N . LYS C 1 77 ? 10.311 -23.436 -3.803 1.00 31.81 ? 79 LYS C N 1 +ATOM 4165 C CA . LYS C 1 77 ? 9.202 -23.264 -4.726 1.00 33.89 ? 79 LYS C CA 1 +ATOM 4166 C C . LYS C 1 77 ? 7.977 -24.146 -4.365 1.00 33.57 ? 79 LYS C C 1 +ATOM 4167 O O . LYS C 1 77 ? 6.840 -23.720 -4.546 1.00 31.60 ? 79 LYS C O 1 +ATOM 4168 C CB . LYS C 1 77 ? 9.657 -23.584 -6.151 1.00 36.68 ? 79 LYS C CB 1 +ATOM 4169 C CG . LYS C 1 77 ? 10.600 -22.582 -6.814 1.00 33.45 ? 79 LYS C CG 1 +ATOM 4170 C CD . LYS C 1 77 ? 10.618 -22.868 -8.322 1.00 33.34 ? 79 LYS C CD 1 +ATOM 4171 C CE . LYS C 1 77 ? 11.635 -22.048 -9.143 1.00 37.06 ? 79 LYS C CE 1 +ATOM 4172 N NZ . LYS C 1 77 ? 11.587 -20.624 -8.843 1.00 32.61 ? 79 LYS C NZ 1 +ATOM 4173 N N . GLN C 1 78 ? 8.118 -25.344 -3.774 1.00 34.00 ? 80 GLN C N 1 +ATOM 4174 C CA . GLN C 1 78 ? 7.036 -26.227 -3.304 1.00 29.99 ? 80 GLN C CA 1 +ATOM 4175 C C . GLN C 1 78 ? 6.214 -25.461 -2.270 1.00 33.03 ? 80 GLN C C 1 +ATOM 4176 O O . GLN C 1 78 ? 5.083 -25.840 -1.909 1.00 36.03 ? 80 GLN C O 1 +ATOM 4177 C CB . GLN C 1 78 ? 7.682 -27.512 -2.678 1.00 36.21 ? 80 GLN C CB 1 +ATOM 4178 C CG . GLN C 1 78 ? 6.870 -28.422 -1.714 1.00 42.97 ? 80 GLN C CG 1 +ATOM 4179 C CD . GLN C 1 78 ? 7.622 -28.994 -0.487 1.00 47.81 ? 80 GLN C CD 1 +ATOM 4180 O OE1 . GLN C 1 78 ? 7.025 -29.194 0.585 1.00 48.59 ? 80 GLN C OE1 1 +ATOM 4181 N NE2 . GLN C 1 78 ? 8.930 -29.274 -0.559 1.00 41.35 ? 80 GLN C NE2 1 +ATOM 4182 N N . HIS C 1 79 ? 6.786 -24.329 -1.814 1.00 27.73 ? 81 HIS C N 1 +ATOM 4183 C CA . HIS C 1 79 ? 6.147 -23.498 -0.814 1.00 23.81 ? 81 HIS C CA 1 +ATOM 4184 C C . HIS C 1 79 ? 5.452 -22.227 -1.296 1.00 25.19 ? 81 HIS C C 1 +ATOM 4185 O O . HIS C 1 79 ? 4.942 -21.416 -0.511 1.00 29.61 ? 81 HIS C O 1 +ATOM 4186 C CB . HIS C 1 79 ? 7.175 -23.160 0.187 1.00 23.26 ? 81 HIS C CB 1 +ATOM 4187 C CG . HIS C 1 79 ? 7.611 -24.407 0.908 1.00 24.50 ? 81 HIS C CG 1 +ATOM 4188 N ND1 . HIS C 1 79 ? 8.664 -25.151 0.635 1.00 29.91 ? 81 HIS C ND1 1 +ATOM 4189 C CD2 . HIS C 1 79 ? 6.987 -24.897 2.000 1.00 24.04 ? 81 HIS C CD2 1 +ATOM 4190 C CE1 . HIS C 1 79 ? 8.698 -26.073 1.552 1.00 32.52 ? 81 HIS C CE1 1 +ATOM 4191 N NE2 . HIS C 1 79 ? 7.685 -25.918 2.374 1.00 32.86 ? 81 HIS C NE2 1 +ATOM 4192 N N . ASP C 1 80 ? 5.433 -22.070 -2.606 1.00 20.17 ? 82 ASP C N 1 +ATOM 4193 C CA . ASP C 1 80 ? 4.841 -20.925 -3.189 1.00 21.39 ? 82 ASP C CA 1 +ATOM 4194 C C . ASP C 1 80 ? 3.380 -21.126 -3.542 1.00 24.17 ? 82 ASP C C 1 +ATOM 4195 O O . ASP C 1 80 ? 3.008 -21.518 -4.680 1.00 21.58 ? 82 ASP C O 1 +ATOM 4196 C CB . ASP C 1 80 ? 5.640 -20.564 -4.415 1.00 27.60 ? 82 ASP C CB 1 +ATOM 4197 C CG . ASP C 1 80 ? 5.277 -19.248 -5.102 1.00 26.37 ? 82 ASP C CG 1 +ATOM 4198 O OD1 . ASP C 1 80 ? 4.438 -18.492 -4.615 1.00 25.07 ? 82 ASP C OD1 1 +ATOM 4199 O OD2 . ASP C 1 80 ? 5.864 -18.984 -6.147 1.00 26.52 ? 82 ASP C OD2 1 +ATOM 4200 N N . PHE C 1 81 ? 2.572 -20.820 -2.513 1.00 19.94 ? 83 PHE C N 1 +ATOM 4201 C CA . PHE C 1 81 ? 1.125 -20.778 -2.711 1.00 22.25 ? 83 PHE C CA 1 +ATOM 4202 C C . PHE C 1 81 ? 0.680 -19.808 -3.820 1.00 21.60 ? 83 PHE C C 1 +ATOM 4203 O O . PHE C 1 81 ? -0.077 -20.152 -4.735 1.00 19.64 ? 83 PHE C O 1 +ATOM 4204 C CB . PHE C 1 81 ? 0.473 -20.407 -1.376 1.00 20.05 ? 83 PHE C CB 1 +ATOM 4205 C CG . PHE C 1 81 ? -0.971 -19.999 -1.500 1.00 30.65 ? 83 PHE C CG 1 +ATOM 4206 C CD1 . PHE C 1 81 ? -1.967 -20.968 -1.545 1.00 31.19 ? 83 PHE C CD1 1 +ATOM 4207 C CD2 . PHE C 1 81 ? -1.315 -18.631 -1.598 1.00 38.75 ? 83 PHE C CD2 1 +ATOM 4208 C CE1 . PHE C 1 81 ? -3.295 -20.569 -1.689 1.00 21.30 ? 83 PHE C CE1 1 +ATOM 4209 C CE2 . PHE C 1 81 ? -2.656 -18.247 -1.742 1.00 27.92 ? 83 PHE C CE2 1 +ATOM 4210 C CZ . PHE C 1 81 ? -3.638 -19.225 -1.787 1.00 28.87 ? 83 PHE C CZ 1 +ATOM 4211 N N . PHE C 1 82 ? 1.220 -18.590 -3.783 1.00 22.27 ? 84 PHE C N 1 +ATOM 4212 C CA . PHE C 1 82 ? 0.776 -17.488 -4.630 1.00 19.30 ? 84 PHE C CA 1 +ATOM 4213 C C . PHE C 1 82 ? 0.756 -17.730 -6.106 1.00 22.13 ? 84 PHE C C 1 +ATOM 4214 O O . PHE C 1 82 ? -0.194 -17.384 -6.806 1.00 15.74 ? 84 PHE C O 1 +ATOM 4215 C CB . PHE C 1 82 ? 1.619 -16.301 -4.397 1.00 16.11 ? 84 PHE C CB 1 +ATOM 4216 C CG . PHE C 1 82 ? 1.730 -15.905 -2.937 1.00 10.23 ? 84 PHE C CG 1 +ATOM 4217 C CD1 . PHE C 1 82 ? 0.699 -15.175 -2.355 1.00 6.86 ? 84 PHE C CD1 1 +ATOM 4218 C CD2 . PHE C 1 82 ? 2.862 -16.272 -2.226 1.00 7.24 ? 84 PHE C CD2 1 +ATOM 4219 C CE1 . PHE C 1 82 ? 0.818 -14.808 -1.016 1.00 8.44 ? 84 PHE C CE1 1 +ATOM 4220 C CE2 . PHE C 1 82 ? 2.995 -15.914 -0.893 1.00 6.24 ? 84 PHE C CE2 1 +ATOM 4221 C CZ . PHE C 1 82 ? 1.971 -15.187 -0.305 1.00 17.16 ? 84 PHE C CZ 1 +ATOM 4222 N N . LYS C 1 83 ? 1.827 -18.343 -6.582 1.00 24.26 ? 85 LYS C N 1 +ATOM 4223 C CA . LYS C 1 83 ? 1.894 -18.697 -7.976 1.00 23.43 ? 85 LYS C CA 1 +ATOM 4224 C C . LYS C 1 83 ? 1.139 -19.988 -8.222 1.00 24.65 ? 85 LYS C C 1 +ATOM 4225 O O . LYS C 1 83 ? 0.744 -20.204 -9.370 1.00 30.31 ? 85 LYS C O 1 +ATOM 4226 C CB . LYS C 1 83 ? 3.311 -18.919 -8.417 1.00 24.22 ? 85 LYS C CB 1 +ATOM 4227 C CG . LYS C 1 83 ? 4.134 -17.667 -8.406 1.00 25.12 ? 85 LYS C CG 1 +ATOM 4228 C CD . LYS C 1 83 ? 5.478 -17.966 -9.035 1.00 23.63 ? 85 LYS C CD 1 +ATOM 4229 C CE . LYS C 1 83 ? 6.457 -16.861 -8.693 1.00 24.51 ? 85 LYS C CE 1 +ATOM 4230 N NZ . LYS C 1 83 ? 6.362 -16.556 -7.269 1.00 28.39 ? 85 LYS C NZ 1 +ATOM 4231 N N . SER C 1 84 ? 0.916 -20.863 -7.216 1.00 23.81 ? 86 SER C N 1 +ATOM 4232 C CA . SER C 1 84 ? 0.258 -22.120 -7.534 1.00 24.94 ? 86 SER C CA 1 +ATOM 4233 C C . SER C 1 84 ? -1.209 -21.874 -7.782 1.00 27.09 ? 86 SER C C 1 +ATOM 4234 O O . SER C 1 84 ? -1.813 -22.492 -8.677 1.00 27.57 ? 86 SER C O 1 +ATOM 4235 C CB . SER C 1 84 ? 0.396 -23.132 -6.427 1.00 25.10 ? 86 SER C CB 1 +ATOM 4236 O OG . SER C 1 84 ? -0.256 -22.846 -5.216 1.00 26.43 ? 86 SER C OG 1 +ATOM 4237 N N . ALA C 1 85 ? -1.702 -20.861 -7.029 1.00 20.39 ? 87 ALA C N 1 +ATOM 4238 C CA . ALA C 1 85 ? -3.044 -20.350 -7.186 1.00 9.93 ? 87 ALA C CA 1 +ATOM 4239 C C . ALA C 1 85 ? -3.319 -19.718 -8.505 1.00 9.31 ? 87 ALA C C 1 +ATOM 4240 O O . ALA C 1 85 ? -4.478 -19.429 -8.757 1.00 15.29 ? 87 ALA C O 1 +ATOM 4241 C CB . ALA C 1 85 ? -3.379 -19.308 -6.188 1.00 5.75 ? 87 ALA C CB 1 +ATOM 4242 N N . MET C 1 86 ? -2.384 -19.630 -9.458 1.00 14.84 ? 88 MET C N 1 +ATOM 4243 C CA . MET C 1 86 ? -2.592 -18.969 -10.754 1.00 14.78 ? 88 MET C CA 1 +ATOM 4244 C C . MET C 1 86 ? -2.848 -19.838 -11.946 1.00 19.40 ? 88 MET C C 1 +ATOM 4245 O O . MET C 1 86 ? -2.292 -20.929 -11.937 1.00 28.08 ? 88 MET C O 1 +ATOM 4246 C CB . MET C 1 86 ? -1.367 -18.095 -11.074 1.00 18.50 ? 88 MET C CB 1 +ATOM 4247 C CG . MET C 1 86 ? -1.158 -17.007 -10.051 1.00 20.17 ? 88 MET C CG 1 +ATOM 4248 S SD . MET C 1 86 ? -2.446 -15.742 -10.230 1.00 21.08 ? 88 MET C SD 1 +ATOM 4249 C CE . MET C 1 86 ? -2.468 -15.214 -8.587 1.00 13.27 ? 88 MET C CE 1 +ATOM 4250 N N . PRO C 1 87 ? -3.555 -19.480 -13.046 1.00 25.41 ? 89 PRO C N 1 +ATOM 4251 C CA . PRO C 1 87 ? -4.127 -18.170 -13.302 1.00 23.44 ? 89 PRO C CA 1 +ATOM 4252 C C . PRO C 1 87 ? -5.393 -17.739 -12.590 1.00 24.79 ? 89 PRO C C 1 +ATOM 4253 O O . PRO C 1 87 ? -5.615 -16.537 -12.450 1.00 32.03 ? 89 PRO C O 1 +ATOM 4254 C CB . PRO C 1 87 ? -4.269 -18.133 -14.807 1.00 24.54 ? 89 PRO C CB 1 +ATOM 4255 C CG . PRO C 1 87 ? -4.406 -19.556 -15.285 1.00 25.44 ? 89 PRO C CG 1 +ATOM 4256 C CD . PRO C 1 87 ? -3.699 -20.346 -14.224 1.00 23.81 ? 89 PRO C CD 1 +ATOM 4257 N N . GLU C 1 88 ? -6.191 -18.642 -12.048 1.00 21.89 ? 90 GLU C N 1 +ATOM 4258 C CA . GLU C 1 88 ? -7.472 -18.279 -11.474 1.00 24.60 ? 90 GLU C CA 1 +ATOM 4259 C C . GLU C 1 88 ? -7.381 -17.361 -10.270 1.00 20.48 ? 90 GLU C C 1 +ATOM 4260 O O . GLU C 1 88 ? -8.332 -16.677 -9.919 1.00 28.72 ? 90 GLU C O 1 +ATOM 4261 C CB . GLU C 1 88 ? -8.255 -19.499 -11.036 1.00 29.88 ? 90 GLU C CB 1 +ATOM 4262 C CG . GLU C 1 88 ? -8.522 -20.482 -12.164 1.00 42.14 ? 90 GLU C CG 1 +ATOM 4263 C CD . GLU C 1 88 ? -7.877 -21.806 -11.826 1.00 47.71 ? 90 GLU C CD 1 +ATOM 4264 O OE1 . GLU C 1 88 ? -6.646 -21.890 -11.941 1.00 50.64 ? 90 GLU C OE1 1 +ATOM 4265 O OE2 . GLU C 1 88 ? -8.613 -22.707 -11.418 1.00 44.03 ? 90 GLU C OE2 1 +ATOM 4266 N N . GLY C 1 89 ? -6.272 -17.463 -9.571 1.00 11.66 ? 91 GLY C N 1 +ATOM 4267 C CA . GLY C 1 89 ? -5.930 -16.608 -8.511 1.00 5.74 ? 91 GLY C CA 1 +ATOM 4268 C C . GLY C 1 89 ? -6.388 -16.928 -7.158 1.00 13.05 ? 91 GLY C C 1 +ATOM 4269 O O . GLY C 1 89 ? -6.882 -17.983 -6.829 1.00 25.14 ? 91 GLY C O 1 +ATOM 4270 N N . TYR C 1 90 ? -6.103 -15.937 -6.337 1.00 16.15 ? 92 TYR C N 1 +ATOM 4271 C CA . TYR C 1 90 ? -6.466 -16.024 -4.946 1.00 14.89 ? 92 TYR C CA 1 +ATOM 4272 C C . TYR C 1 90 ? -7.031 -14.652 -4.575 1.00 18.03 ? 92 TYR C C 1 +ATOM 4273 O O . TYR C 1 90 ? -7.114 -13.699 -5.341 1.00 11.34 ? 92 TYR C O 1 +ATOM 4274 C CB . TYR C 1 90 ? -5.230 -16.366 -4.075 1.00 17.07 ? 92 TYR C CB 1 +ATOM 4275 C CG . TYR C 1 90 ? -3.977 -15.514 -4.298 1.00 18.63 ? 92 TYR C CG 1 +ATOM 4276 C CD1 . TYR C 1 90 ? -3.079 -15.794 -5.330 1.00 5.27 ? 92 TYR C CD1 1 +ATOM 4277 C CD2 . TYR C 1 90 ? -3.778 -14.396 -3.477 1.00 17.52 ? 92 TYR C CD2 1 +ATOM 4278 C CE1 . TYR C 1 90 ? -1.996 -14.933 -5.535 1.00 11.45 ? 92 TYR C CE1 1 +ATOM 4279 C CE2 . TYR C 1 90 ? -2.700 -13.556 -3.671 1.00 16.16 ? 92 TYR C CE2 1 +ATOM 4280 C CZ . TYR C 1 90 ? -1.809 -13.822 -4.700 1.00 18.93 ? 92 TYR C CZ 1 +ATOM 4281 O OH . TYR C 1 90 ? -0.738 -12.965 -4.865 1.00 22.52 ? 92 TYR C OH 1 +ATOM 4282 N N . VAL C 1 91 ? -7.506 -14.696 -3.359 1.00 14.88 ? 93 VAL C N 1 +ATOM 4283 C CA . VAL C 1 91 ? -8.113 -13.641 -2.705 1.00 16.24 ? 93 VAL C CA 1 +ATOM 4284 C C . VAL C 1 91 ? -7.262 -13.401 -1.479 1.00 23.37 ? 93 VAL C C 1 +ATOM 4285 O O . VAL C 1 91 ? -7.248 -14.207 -0.528 1.00 25.17 ? 93 VAL C O 1 +ATOM 4286 C CB . VAL C 1 91 ? -9.536 -13.986 -2.264 1.00 13.90 ? 93 VAL C CB 1 +ATOM 4287 C CG1 . VAL C 1 91 ? -10.112 -12.949 -1.285 1.00 13.58 ? 93 VAL C CG1 1 +ATOM 4288 C CG2 . VAL C 1 91 ? -10.380 -13.975 -3.490 1.00 14.88 ? 93 VAL C CG2 1 +ATOM 4289 N N . GLN C 1 92 ? -6.640 -12.212 -1.520 1.00 14.68 ? 94 GLN C N 1 +ATOM 4290 C CA . GLN C 1 92 ? -5.941 -11.728 -0.370 1.00 18.73 ? 94 GLN C CA 1 +ATOM 4291 C C . GLN C 1 92 ? -6.890 -10.825 0.374 1.00 17.20 ? 94 GLN C C 1 +ATOM 4292 O O . GLN C 1 92 ? -7.488 -9.949 -0.219 1.00 27.26 ? 94 GLN C O 1 +ATOM 4293 C CB . GLN C 1 92 ? -4.709 -10.946 -0.796 1.00 21.39 ? 94 GLN C CB 1 +ATOM 4294 C CG . GLN C 1 92 ? -3.737 -10.627 0.334 1.00 17.26 ? 94 GLN C CG 1 +ATOM 4295 C CD . GLN C 1 92 ? -2.447 -10.162 -0.293 1.00 25.09 ? 94 GLN C CD 1 +ATOM 4296 O OE1 . GLN C 1 92 ? -1.782 -10.880 -1.038 1.00 29.81 ? 94 GLN C OE1 1 +ATOM 4297 N NE2 . GLN C 1 92 ? -2.072 -8.916 -0.042 1.00 33.25 ? 94 GLN C NE2 1 +ATOM 4298 N N . GLU C 1 93 ? -7.034 -11.033 1.655 1.00 12.46 ? 95 GLU C N 1 +ATOM 4299 C CA . GLU C 1 93 ? -7.841 -10.243 2.504 1.00 11.55 ? 95 GLU C CA 1 +ATOM 4300 C C . GLU C 1 93 ? -6.936 -9.882 3.637 1.00 12.33 ? 95 GLU C C 1 +ATOM 4301 O O . GLU C 1 93 ? -6.264 -10.746 4.169 1.00 15.83 ? 95 GLU C O 1 +ATOM 4302 C CB . GLU C 1 93 ? -9.044 -10.984 3.145 1.00 13.90 ? 95 GLU C CB 1 +ATOM 4303 C CG . GLU C 1 93 ? -10.122 -11.463 2.186 1.00 27.51 ? 95 GLU C CG 1 +ATOM 4304 C CD . GLU C 1 93 ? -10.998 -12.551 2.787 1.00 41.27 ? 95 GLU C CD 1 +ATOM 4305 O OE1 . GLU C 1 93 ? -10.636 -13.740 2.681 1.00 47.61 ? 95 GLU C OE1 1 +ATOM 4306 O OE2 . GLU C 1 93 ? -12.038 -12.208 3.357 1.00 44.45 ? 95 GLU C OE2 1 +ATOM 4307 N N . ARG C 1 94 ? -6.941 -8.625 4.081 1.00 16.37 ? 96 ARG C N 1 +ATOM 4308 C CA . ARG C 1 94 ? -6.148 -8.242 5.222 1.00 15.10 ? 96 ARG C CA 1 +ATOM 4309 C C . ARG C 1 94 ? -6.914 -7.373 6.189 1.00 18.19 ? 96 ARG C C 1 +ATOM 4310 O O . ARG C 1 94 ? -7.909 -6.738 5.845 1.00 26.71 ? 96 ARG C O 1 +ATOM 4311 C CB . ARG C 1 94 ? -4.938 -7.441 4.799 1.00 11.98 ? 96 ARG C CB 1 +ATOM 4312 C CG . ARG C 1 94 ? -3.846 -8.112 4.048 1.00 11.66 ? 96 ARG C CG 1 +ATOM 4313 C CD . ARG C 1 94 ? -2.543 -7.460 4.562 1.00 9.92 ? 96 ARG C CD 1 +ATOM 4314 N NE . ARG C 1 94 ? -1.408 -8.126 3.965 1.00 4.23 ? 96 ARG C NE 1 +ATOM 4315 C CZ . ARG C 1 94 ? -1.052 -7.864 2.704 1.00 13.83 ? 96 ARG C CZ 1 +ATOM 4316 N NH1 . ARG C 1 94 ? -1.670 -6.967 1.906 1.00 5.03 ? 96 ARG C NH1 1 +ATOM 4317 N NH2 . ARG C 1 94 ? -0.076 -8.581 2.199 1.00 5.89 ? 96 ARG C NH2 1 +ATOM 4318 N N . THR C 1 95 ? -6.343 -7.319 7.382 1.00 17.02 ? 97 THR C N 1 +ATOM 4319 C CA . THR C 1 95 ? -6.682 -6.335 8.367 1.00 19.79 ? 97 THR C CA 1 +ATOM 4320 C C . THR C 1 95 ? -5.342 -5.676 8.679 1.00 21.81 ? 97 THR C C 1 +ATOM 4321 O O . THR C 1 95 ? -4.410 -6.273 9.227 1.00 22.70 ? 97 THR C O 1 +ATOM 4322 C CB . THR C 1 95 ? -7.290 -7.030 9.574 1.00 23.52 ? 97 THR C CB 1 +ATOM 4323 O OG1 . THR C 1 95 ? -8.451 -7.637 9.006 1.00 34.31 ? 97 THR C OG1 1 +ATOM 4324 C CG2 . THR C 1 95 ? -7.696 -6.158 10.758 1.00 14.31 ? 97 THR C CG2 1 +ATOM 4325 N N . ILE C 1 96 ? -5.198 -4.430 8.210 1.00 23.79 ? 98 ILE C N 1 +ATOM 4326 C CA . ILE C 1 96 ? -4.026 -3.625 8.524 1.00 20.22 ? 98 ILE C CA 1 +ATOM 4327 C C . ILE C 1 96 ? -4.555 -2.857 9.696 1.00 21.57 ? 98 ILE C C 1 +ATOM 4328 O O . ILE C 1 96 ? -5.543 -2.160 9.577 1.00 29.48 ? 98 ILE C O 1 +ATOM 4329 C CB . ILE C 1 96 ? -3.682 -2.743 7.338 1.00 17.33 ? 98 ILE C CB 1 +ATOM 4330 C CG1 . ILE C 1 96 ? -3.426 -3.589 6.134 1.00 6.82 ? 98 ILE C CG1 1 +ATOM 4331 C CG2 . ILE C 1 96 ? -2.443 -1.942 7.683 1.00 17.94 ? 98 ILE C CG2 1 +ATOM 4332 C CD1 . ILE C 1 96 ? -3.197 -2.846 4.826 1.00 19.91 ? 98 ILE C CD1 1 +ATOM 4333 N N . SER C 1 97 ? -3.985 -3.064 10.866 1.00 18.47 ? 99 SER C N 1 +ATOM 4334 C CA . SER C 1 97 ? -4.411 -2.423 12.053 1.00 15.90 ? 99 SER C CA 1 +ATOM 4335 C C . SER C 1 97 ? -3.340 -1.454 12.587 1.00 23.42 ? 99 SER C C 1 +ATOM 4336 O O . SER C 1 97 ? -2.392 -1.810 13.284 1.00 26.08 ? 99 SER C O 1 +ATOM 4337 C CB . SER C 1 97 ? -4.734 -3.559 12.957 1.00 15.10 ? 99 SER C CB 1 +ATOM 4338 O OG . SER C 1 97 ? -4.698 -3.172 14.326 1.00 25.75 ? 99 SER C OG 1 +ATOM 4339 N N . PHE C 1 98 ? -3.505 -0.153 12.312 1.00 24.78 ? 100 PHE C N 1 +ATOM 4340 C CA . PHE C 1 98 ? -2.587 0.888 12.733 1.00 17.07 ? 100 PHE C CA 1 +ATOM 4341 C C . PHE C 1 98 ? -2.642 1.119 14.204 1.00 20.47 ? 100 PHE C C 1 +ATOM 4342 O O . PHE C 1 98 ? -3.643 1.594 14.723 1.00 21.33 ? 100 PHE C O 1 +ATOM 4343 C CB . PHE C 1 98 ? -2.929 2.133 12.067 1.00 10.77 ? 100 PHE C CB 1 +ATOM 4344 C CG . PHE C 1 98 ? -2.764 1.986 10.590 1.00 8.79 ? 100 PHE C CG 1 +ATOM 4345 C CD1 . PHE C 1 98 ? -1.524 2.201 10.034 1.00 7.38 ? 100 PHE C CD1 1 +ATOM 4346 C CD2 . PHE C 1 98 ? -3.828 1.607 9.808 1.00 9.35 ? 100 PHE C CD2 1 +ATOM 4347 C CE1 . PHE C 1 98 ? -1.364 2.026 8.672 1.00 10.03 ? 100 PHE C CE1 1 +ATOM 4348 C CE2 . PHE C 1 98 ? -3.653 1.433 8.443 1.00 6.62 ? 100 PHE C CE2 1 +ATOM 4349 C CZ . PHE C 1 98 ? -2.411 1.643 7.874 1.00 14.92 ? 100 PHE C CZ 1 +ATOM 4350 N N . LYS C 1 99 ? -1.576 0.707 14.873 1.00 20.77 ? 101 LYS C N 1 +ATOM 4351 C CA . LYS C 1 99 ? -1.458 0.846 16.302 1.00 24.06 ? 101 LYS C CA 1 +ATOM 4352 C C . LYS C 1 99 ? -1.868 2.225 16.771 1.00 26.39 ? 101 LYS C C 1 +ATOM 4353 O O . LYS C 1 99 ? -1.378 3.233 16.246 1.00 27.28 ? 101 LYS C O 1 +ATOM 4354 C CB . LYS C 1 99 ? -0.030 0.591 16.717 1.00 21.23 ? 101 LYS C CB 1 +ATOM 4355 C CG . LYS C 1 99 ? -0.047 0.446 18.200 1.00 27.10 ? 101 LYS C CG 1 +ATOM 4356 C CD . LYS C 1 99 ? 1.288 0.150 18.823 1.00 36.79 ? 101 LYS C CD 1 +ATOM 4357 C CE . LYS C 1 99 ? 0.973 -0.046 20.302 1.00 39.48 ? 101 LYS C CE 1 +ATOM 4358 N NZ . LYS C 1 99 ? 0.352 1.141 20.858 1.00 35.54 ? 101 LYS C NZ 1 +ATOM 4359 N N . ASP C 1 100 ? -2.765 2.245 17.758 1.00 26.95 ? 102 ASP C N 1 +ATOM 4360 C CA . ASP C 1 100 ? -3.282 3.502 18.320 1.00 28.96 ? 102 ASP C CA 1 +ATOM 4361 C C . ASP C 1 100 ? -4.093 4.343 17.326 1.00 26.34 ? 102 ASP C C 1 +ATOM 4362 O O . ASP C 1 100 ? -4.306 5.545 17.503 1.00 20.17 ? 102 ASP C O 1 +ATOM 4363 C CB . ASP C 1 100 ? -2.155 4.401 18.861 1.00 26.67 ? 102 ASP C CB 1 +ATOM 4364 C CG . ASP C 1 100 ? -1.550 3.965 20.168 1.00 32.07 ? 102 ASP C CG 1 +ATOM 4365 O OD1 . ASP C 1 100 ? -2.326 3.577 21.043 1.00 33.37 ? 102 ASP C OD1 1 +ATOM 4366 O OD2 . ASP C 1 100 ? -0.316 4.048 20.316 1.00 35.26 ? 102 ASP C OD2 1 +ATOM 4367 N N . ASP C 1 101 ? -4.529 3.719 16.230 1.00 23.22 ? 103 ASP C N 1 +ATOM 4368 C CA . ASP C 1 101 ? -5.343 4.445 15.293 1.00 23.82 ? 103 ASP C CA 1 +ATOM 4369 C C . ASP C 1 101 ? -6.281 3.487 14.561 1.00 20.57 ? 103 ASP C C 1 +ATOM 4370 O O . ASP C 1 101 ? -6.641 2.429 15.088 1.00 23.06 ? 103 ASP C O 1 +ATOM 4371 C CB . ASP C 1 101 ? -4.406 5.240 14.349 1.00 23.23 ? 103 ASP C CB 1 +ATOM 4372 C CG . ASP C 1 101 ? -5.076 6.427 13.610 1.00 29.14 ? 103 ASP C CG 1 +ATOM 4373 O OD1 . ASP C 1 101 ? -6.276 6.580 13.723 1.00 30.17 ? 103 ASP C OD1 1 +ATOM 4374 O OD2 . ASP C 1 101 ? -4.454 7.206 12.888 1.00 26.54 ? 103 ASP C OD2 1 +ATOM 4375 N N . GLY C 1 102 ? -6.688 3.785 13.346 1.00 16.59 ? 104 GLY C N 1 +ATOM 4376 C CA . GLY C 1 102 ? -7.673 2.962 12.662 1.00 24.02 ? 104 GLY C CA 1 +ATOM 4377 C C . GLY C 1 102 ? -7.167 1.638 12.120 1.00 23.19 ? 104 GLY C C 1 +ATOM 4378 O O . GLY C 1 102 ? -6.122 1.135 12.522 1.00 28.26 ? 104 GLY C O 1 +ATOM 4379 N N . ASN C 1 103 ? -7.978 1.059 11.235 1.00 17.75 ? 105 ASN C N 1 +ATOM 4380 C CA . ASN C 1 103 ? -7.618 -0.163 10.575 1.00 16.74 ? 105 ASN C CA 1 +ATOM 4381 C C . ASN C 1 103 ? -8.145 -0.164 9.191 1.00 16.39 ? 105 ASN C C 1 +ATOM 4382 O O . ASN C 1 103 ? -9.232 0.385 8.971 1.00 11.65 ? 105 ASN C O 1 +ATOM 4383 C CB . ASN C 1 103 ? -8.189 -1.390 11.242 1.00 16.23 ? 105 ASN C CB 1 +ATOM 4384 C CG . ASN C 1 103 ? -9.665 -1.304 11.552 1.00 12.69 ? 105 ASN C CG 1 +ATOM 4385 O OD1 . ASN C 1 103 ? -10.487 -1.529 10.663 1.00 11.75 ? 105 ASN C OD1 1 +ATOM 4386 N ND2 . ASN C 1 103 ? -9.999 -1.009 12.813 1.00 6.38 ? 105 ASN C ND2 1 +ATOM 4387 N N . TYR C 1 104 ? -7.318 -0.676 8.267 1.00 11.73 ? 106 TYR C N 1 +ATOM 4388 C CA . TYR C 1 104 ? -7.819 -0.980 6.942 1.00 14.51 ? 106 TYR C CA 1 +ATOM 4389 C C . TYR C 1 104 ? -8.269 -2.438 7.044 1.00 16.49 ? 106 TYR C C 1 +ATOM 4390 O O . TYR C 1 104 ? -7.924 -3.159 7.988 1.00 22.13 ? 106 TYR C O 1 +ATOM 4391 C CB . TYR C 1 104 ? -6.752 -0.912 5.889 1.00 19.82 ? 106 TYR C CB 1 +ATOM 4392 C CG . TYR C 1 104 ? -6.119 0.451 5.714 1.00 22.29 ? 106 TYR C CG 1 +ATOM 4393 C CD1 . TYR C 1 104 ? -6.757 1.615 6.170 1.00 20.01 ? 106 TYR C CD1 1 +ATOM 4394 C CD2 . TYR C 1 104 ? -4.899 0.538 5.033 1.00 29.09 ? 106 TYR C CD2 1 +ATOM 4395 C CE1 . TYR C 1 104 ? -6.189 2.858 5.930 1.00 24.09 ? 106 TYR C CE1 1 +ATOM 4396 C CE2 . TYR C 1 104 ? -4.326 1.790 4.793 1.00 29.46 ? 106 TYR C CE2 1 +ATOM 4397 C CZ . TYR C 1 104 ? -4.983 2.935 5.244 1.00 26.82 ? 106 TYR C CZ 1 +ATOM 4398 O OH . TYR C 1 104 ? -4.463 4.170 4.960 1.00 29.06 ? 106 TYR C OH 1 +ATOM 4399 N N . LYS C 1 105 ? -9.151 -2.826 6.129 1.00 12.41 ? 107 LYS C N 1 +ATOM 4400 C CA . LYS C 1 105 ? -9.730 -4.164 5.999 1.00 10.81 ? 107 LYS C CA 1 +ATOM 4401 C C . LYS C 1 105 ? -9.657 -4.151 4.517 1.00 9.41 ? 107 LYS C C 1 +ATOM 4402 O O . LYS C 1 105 ? -10.115 -3.186 3.940 1.00 8.13 ? 107 LYS C O 1 +ATOM 4403 C CB . LYS C 1 105 ? -11.274 -4.341 6.231 1.00 12.32 ? 107 LYS C CB 1 +ATOM 4404 C CG . LYS C 1 105 ? -11.841 -4.228 7.640 1.00 15.38 ? 107 LYS C CG 1 +ATOM 4405 C CD . LYS C 1 105 ? -11.613 -5.534 8.368 1.00 21.27 ? 107 LYS C CD 1 +ATOM 4406 C CE . LYS C 1 105 ? -11.980 -5.453 9.846 1.00 28.24 ? 107 LYS C CE 1 +ATOM 4407 N NZ . LYS C 1 105 ? -11.397 -6.565 10.590 1.00 24.65 ? 107 LYS C NZ 1 +ATOM 4408 N N . THR C 1 106 ? -9.028 -5.132 3.894 1.00 9.19 ? 108 THR C N 1 +ATOM 4409 C CA . THR C 1 106 ? -8.985 -5.155 2.456 1.00 9.50 ? 108 THR C CA 1 +ATOM 4410 C C . THR C 1 106 ? -9.452 -6.538 2.047 1.00 11.11 ? 108 THR C C 1 +ATOM 4411 O O . THR C 1 106 ? -9.602 -7.475 2.851 1.00 12.17 ? 108 THR C O 1 +ATOM 4412 C CB . THR C 1 106 ? -7.549 -4.880 1.977 1.00 16.00 ? 108 THR C CB 1 +ATOM 4413 O OG1 . THR C 1 106 ? -6.743 -5.983 2.381 1.00 29.07 ? 108 THR C OG1 1 +ATOM 4414 C CG2 . THR C 1 106 ? -6.969 -3.601 2.595 1.00 15.41 ? 108 THR C CG2 1 +ATOM 4415 N N . ARG C 1 107 ? -9.717 -6.641 0.773 1.00 2.00 ? 109 ARG C N 1 +ATOM 4416 C CA . ARG C 1 107 ? -10.205 -7.864 0.234 1.00 9.73 ? 109 ARG C CA 1 +ATOM 4417 C C . ARG C 1 107 ? -9.731 -7.593 -1.117 1.00 7.97 ? 109 ARG C C 1 +ATOM 4418 O O . ARG C 1 107 ? -9.951 -6.512 -1.641 1.00 12.29 ? 109 ARG C O 1 +ATOM 4419 C CB . ARG C 1 107 ? -11.745 -8.010 0.107 1.00 19.05 ? 109 ARG C CB 1 +ATOM 4420 C CG . ARG C 1 107 ? -12.128 -9.525 0.206 1.00 31.66 ? 109 ARG C CG 1 +ATOM 4421 C CD . ARG C 1 107 ? -13.503 -10.042 -0.239 1.00 23.24 ? 109 ARG C CD 1 +ATOM 4422 N NE . ARG C 1 107 ? -13.483 -9.994 -1.681 1.00 22.45 ? 109 ARG C NE 1 +ATOM 4423 C CZ . ARG C 1 107 ? -13.613 -11.053 -2.458 1.00 23.32 ? 109 ARG C CZ 1 +ATOM 4424 N NH1 . ARG C 1 107 ? -13.801 -12.284 -1.964 1.00 20.41 ? 109 ARG C NH1 1 +ATOM 4425 N NH2 . ARG C 1 107 ? -13.452 -10.839 -3.760 1.00 22.88 ? 109 ARG C NH2 1 +ATOM 4426 N N . ALA C 1 108 ? -9.061 -8.544 -1.714 1.00 9.81 ? 110 ALA C N 1 +ATOM 4427 C CA . ALA C 1 108 ? -8.579 -8.302 -3.063 1.00 11.46 ? 110 ALA C CA 1 +ATOM 4428 C C . ALA C 1 108 ? -8.572 -9.637 -3.749 1.00 15.04 ? 110 ALA C C 1 +ATOM 4429 O O . ALA C 1 108 ? -8.494 -10.653 -3.070 1.00 16.59 ? 110 ALA C O 1 +ATOM 4430 C CB . ALA C 1 108 ? -7.154 -7.781 -3.048 1.00 20.20 ? 110 ALA C CB 1 +ATOM 4431 N N . GLU C 1 109 ? -8.661 -9.615 -5.059 1.00 11.90 ? 111 GLU C N 1 +ATOM 4432 C CA . GLU C 1 109 ? -8.543 -10.771 -5.864 1.00 13.82 ? 111 GLU C CA 1 +ATOM 4433 C C . GLU C 1 109 ? -7.391 -10.482 -6.803 1.00 21.68 ? 111 GLU C C 1 +ATOM 4434 O O . GLU C 1 109 ? -7.403 -9.553 -7.671 1.00 10.40 ? 111 GLU C O 1 +ATOM 4435 C CB . GLU C 1 109 ? -9.769 -11.047 -6.735 1.00 18.46 ? 111 GLU C CB 1 +ATOM 4436 C CG . GLU C 1 109 ? -11.005 -11.374 -5.927 1.00 19.58 ? 111 GLU C CG 1 +ATOM 4437 C CD . GLU C 1 109 ? -12.261 -11.677 -6.709 1.00 21.12 ? 111 GLU C CD 1 +ATOM 4438 O OE1 . GLU C 1 109 ? -12.309 -11.504 -7.937 1.00 20.90 ? 111 GLU C OE1 1 +ATOM 4439 O OE2 . GLU C 1 109 ? -13.198 -12.134 -6.058 1.00 28.36 ? 111 GLU C OE2 1 +ATOM 4440 N N . VAL C 1 110 ? -6.411 -11.401 -6.607 1.00 22.94 ? 112 VAL C N 1 +ATOM 4441 C CA . VAL C 1 110 ? -5.187 -11.358 -7.413 1.00 19.10 ? 112 VAL C CA 1 +ATOM 4442 C C . VAL C 1 110 ? -5.328 -12.516 -8.326 1.00 20.74 ? 112 VAL C C 1 +ATOM 4443 O O . VAL C 1 110 ? -5.528 -13.636 -7.855 1.00 29.55 ? 112 VAL C O 1 +ATOM 4444 C CB . VAL C 1 110 ? -3.945 -11.513 -6.545 1.00 20.64 ? 112 VAL C CB 1 +ATOM 4445 C CG1 . VAL C 1 110 ? -2.746 -11.177 -7.425 1.00 20.67 ? 112 VAL C CG1 1 +ATOM 4446 C CG2 . VAL C 1 110 ? -3.941 -10.568 -5.343 1.00 11.79 ? 112 VAL C CG2 1 +ATOM 4447 N N . LYS C 1 111 ? -5.274 -12.259 -9.621 1.00 15.24 ? 113 LYS C N 1 +ATOM 4448 C CA . LYS C 1 111 ? -5.513 -13.324 -10.580 1.00 17.46 ? 113 LYS C CA 1 +ATOM 4449 C C . LYS C 1 111 ? -5.030 -12.786 -11.903 1.00 19.76 ? 113 LYS C C 1 +ATOM 4450 O O . LYS C 1 111 ? -4.848 -11.579 -12.044 1.00 17.00 ? 113 LYS C O 1 +ATOM 4451 C CB . LYS C 1 111 ? -7.043 -13.669 -10.679 1.00 16.81 ? 113 LYS C CB 1 +ATOM 4452 C CG . LYS C 1 111 ? -7.946 -12.462 -11.050 1.00 23.66 ? 113 LYS C CG 1 +ATOM 4453 C CD . LYS C 1 111 ? -9.483 -12.423 -10.764 1.00 19.95 ? 113 LYS C CD 1 +ATOM 4454 C CE . LYS C 1 111 ? -10.309 -13.013 -11.883 1.00 20.38 ? 113 LYS C CE 1 +ATOM 4455 N NZ . LYS C 1 111 ? -10.097 -12.275 -13.126 1.00 29.70 ? 113 LYS C NZ 1 +ATOM 4456 N N . PHE C 1 112 ? -4.788 -13.669 -12.875 1.00 18.36 ? 114 PHE C N 1 +ATOM 4457 C CA . PHE C 1 112 ? -4.507 -13.232 -14.224 1.00 20.93 ? 114 PHE C CA 1 +ATOM 4458 C C . PHE C 1 112 ? -5.810 -12.895 -14.922 1.00 25.80 ? 114 PHE C C 1 +ATOM 4459 O O . PHE C 1 112 ? -6.881 -13.456 -14.647 1.00 30.57 ? 114 PHE C O 1 +ATOM 4460 C CB . PHE C 1 112 ? -3.797 -14.333 -15.048 1.00 23.51 ? 114 PHE C CB 1 +ATOM 4461 C CG . PHE C 1 112 ? -2.284 -14.360 -14.878 1.00 8.29 ? 114 PHE C CG 1 +ATOM 4462 C CD1 . PHE C 1 112 ? -1.708 -14.743 -13.695 1.00 9.52 ? 114 PHE C CD1 1 +ATOM 4463 C CD2 . PHE C 1 112 ? -1.498 -13.951 -15.952 1.00 18.31 ? 114 PHE C CD2 1 +ATOM 4464 C CE1 . PHE C 1 112 ? -0.305 -14.717 -13.579 1.00 13.24 ? 114 PHE C CE1 1 +ATOM 4465 C CE2 . PHE C 1 112 ? -0.118 -13.924 -15.845 1.00 9.60 ? 114 PHE C CE2 1 +ATOM 4466 C CZ . PHE C 1 112 ? 0.487 -14.310 -14.648 1.00 11.33 ? 114 PHE C CZ 1 +ATOM 4467 N N . GLU C 1 113 ? -5.716 -11.955 -15.845 1.00 23.32 ? 115 GLU C N 1 +ATOM 4468 C CA . GLU C 1 113 ? -6.851 -11.522 -16.609 1.00 30.33 ? 115 GLU C CA 1 +ATOM 4469 C C . GLU C 1 113 ? -6.125 -11.317 -17.913 1.00 33.84 ? 115 GLU C C 1 +ATOM 4470 O O . GLU C 1 113 ? -5.464 -10.293 -18.114 1.00 36.99 ? 115 GLU C O 1 +ATOM 4471 C CB . GLU C 1 113 ? -7.441 -10.168 -16.083 1.00 26.87 ? 115 GLU C CB 1 +ATOM 4472 C CG . GLU C 1 113 ? -8.099 -10.257 -14.677 1.00 35.33 ? 115 GLU C CG 1 +ATOM 4473 C CD . GLU C 1 113 ? -9.052 -9.140 -14.161 1.00 37.75 ? 115 GLU C CD 1 +ATOM 4474 O OE1 . GLU C 1 113 ? -9.644 -8.387 -14.956 1.00 38.87 ? 115 GLU C OE1 1 +ATOM 4475 O OE2 . GLU C 1 113 ? -9.218 -9.058 -12.933 1.00 25.64 ? 115 GLU C OE2 1 +ATOM 4476 N N . GLY C 1 114 ? -6.228 -12.309 -18.806 1.00 33.79 ? 116 GLY C N 1 +ATOM 4477 C CA . GLY C 1 114 ? -5.414 -12.303 -20.004 1.00 34.25 ? 116 GLY C CA 1 +ATOM 4478 C C . GLY C 1 114 ? -3.933 -12.358 -19.604 1.00 32.16 ? 116 GLY C C 1 +ATOM 4479 O O . GLY C 1 114 ? -3.583 -12.977 -18.588 1.00 34.48 ? 116 GLY C O 1 +ATOM 4480 N N . ASP C 1 115 ? -3.048 -11.685 -20.343 1.00 30.13 ? 117 ASP C N 1 +ATOM 4481 C CA . ASP C 1 115 ? -1.632 -11.778 -20.001 1.00 32.67 ? 117 ASP C CA 1 +ATOM 4482 C C . ASP C 1 115 ? -1.209 -10.981 -18.791 1.00 31.26 ? 117 ASP C C 1 +ATOM 4483 O O . ASP C 1 115 ? -0.121 -11.245 -18.270 1.00 31.80 ? 117 ASP C O 1 +ATOM 4484 C CB . ASP C 1 115 ? -0.679 -11.415 -21.204 1.00 36.05 ? 117 ASP C CB 1 +ATOM 4485 C CG . ASP C 1 115 ? -0.251 -10.011 -21.695 1.00 50.48 ? 117 ASP C CG 1 +ATOM 4486 O OD1 . ASP C 1 115 ? -0.629 -8.971 -21.131 1.00 49.20 ? 117 ASP C OD1 1 +ATOM 4487 O OD2 . ASP C 1 115 ? 0.504 -9.977 -22.683 1.00 48.79 ? 117 ASP C OD2 1 +ATOM 4488 N N . THR C 1 116 ? -2.046 -10.073 -18.260 1.00 25.00 ? 118 THR C N 1 +ATOM 4489 C CA . THR C 1 116 ? -1.545 -9.363 -17.114 1.00 18.83 ? 118 THR C CA 1 +ATOM 4490 C C . THR C 1 116 ? -2.088 -9.861 -15.825 1.00 17.86 ? 118 THR C C 1 +ATOM 4491 O O . THR C 1 116 ? -3.110 -10.524 -15.785 1.00 26.92 ? 118 THR C O 1 +ATOM 4492 C CB . THR C 1 116 ? -1.804 -7.843 -17.269 1.00 23.93 ? 118 THR C CB 1 +ATOM 4493 O OG1 . THR C 1 116 ? -3.038 -7.531 -16.705 1.00 28.82 ? 118 THR C OG1 1 +ATOM 4494 C CG2 . THR C 1 116 ? -1.796 -7.413 -18.721 1.00 25.07 ? 118 THR C CG2 1 +ATOM 4495 N N . LEU C 1 117 ? -1.364 -9.560 -14.756 1.00 14.27 ? 119 LEU C N 1 +ATOM 4496 C CA . LEU C 1 117 ? -1.761 -9.959 -13.455 1.00 15.10 ? 119 LEU C CA 1 +ATOM 4497 C C . LEU C 1 117 ? -2.480 -8.811 -12.795 1.00 20.34 ? 119 LEU C C 1 +ATOM 4498 O O . LEU C 1 117 ? -1.890 -7.753 -12.590 1.00 22.67 ? 119 LEU C O 1 +ATOM 4499 C CB . LEU C 1 117 ? -0.556 -10.349 -12.617 1.00 14.27 ? 119 LEU C CB 1 +ATOM 4500 C CG . LEU C 1 117 ? -1.080 -10.727 -11.252 1.00 17.90 ? 119 LEU C CG 1 +ATOM 4501 C CD1 . LEU C 1 117 ? -0.759 -12.160 -11.017 1.00 12.79 ? 119 LEU C CD1 1 +ATOM 4502 C CD2 . LEU C 1 117 ? -0.614 -9.722 -10.215 1.00 12.39 ? 119 LEU C CD2 1 +ATOM 4503 N N . VAL C 1 118 ? -3.731 -9.040 -12.353 1.00 21.45 ? 120 VAL C N 1 +ATOM 4504 C CA . VAL C 1 118 ? -4.479 -7.947 -11.799 1.00 11.99 ? 120 VAL C CA 1 +ATOM 4505 C C . VAL C 1 118 ? -4.766 -8.107 -10.335 1.00 14.57 ? 120 VAL C C 1 +ATOM 4506 O O . VAL C 1 118 ? -5.163 -9.143 -9.857 1.00 20.18 ? 120 VAL C O 1 +ATOM 4507 C CB . VAL C 1 118 ? -5.715 -7.811 -12.663 1.00 11.38 ? 120 VAL C CB 1 +ATOM 4508 C CG1 . VAL C 1 118 ? -6.450 -6.549 -12.300 1.00 13.91 ? 120 VAL C CG1 1 +ATOM 4509 C CG2 . VAL C 1 118 ? -5.331 -7.631 -14.130 1.00 2.00 ? 120 VAL C CG2 1 +ATOM 4510 N N . ASN C 1 119 ? -4.377 -7.108 -9.553 1.00 16.04 ? 121 ASN C N 1 +ATOM 4511 C CA . ASN C 1 119 ? -4.738 -7.072 -8.156 1.00 19.50 ? 121 ASN C CA 1 +ATOM 4512 C C . ASN C 1 119 ? -5.892 -6.046 -8.065 1.00 24.09 ? 121 ASN C C 1 +ATOM 4513 O O . ASN C 1 119 ? -5.700 -4.826 -8.195 1.00 32.67 ? 121 ASN C O 1 +ATOM 4514 C CB . ASN C 1 119 ? -3.546 -6.629 -7.331 1.00 4.98 ? 121 ASN C CB 1 +ATOM 4515 C CG . ASN C 1 119 ? -3.851 -6.553 -5.867 1.00 5.67 ? 121 ASN C CG 1 +ATOM 4516 O OD1 . ASN C 1 119 ? -4.807 -7.151 -5.400 1.00 3.67 ? 121 ASN C OD1 1 +ATOM 4517 N ND2 . ASN C 1 119 ? -3.115 -5.815 -5.032 1.00 5.01 ? 121 ASN C ND2 1 +ATOM 4518 N N . ARG C 1 120 ? -7.128 -6.567 -7.971 1.00 21.52 ? 122 ARG C N 1 +ATOM 4519 C CA . ARG C 1 120 ? -8.308 -5.778 -7.765 1.00 12.50 ? 122 ARG C CA 1 +ATOM 4520 C C . ARG C 1 120 ? -8.553 -5.838 -6.306 1.00 13.40 ? 122 ARG C C 1 +ATOM 4521 O O . ARG C 1 120 ? -8.646 -6.917 -5.759 1.00 21.60 ? 122 ARG C O 1 +ATOM 4522 C CB . ARG C 1 120 ? -9.461 -6.345 -8.534 1.00 10.49 ? 122 ARG C CB 1 +ATOM 4523 C CG . ARG C 1 120 ? -9.280 -6.081 -10.007 1.00 18.57 ? 122 ARG C CG 1 +ATOM 4524 C CD . ARG C 1 120 ? -10.533 -6.386 -10.780 1.00 25.32 ? 122 ARG C CD 1 +ATOM 4525 N NE . ARG C 1 120 ? -10.238 -6.395 -12.208 1.00 33.73 ? 122 ARG C NE 1 +ATOM 4526 C CZ . ARG C 1 120 ? -10.154 -5.284 -12.950 1.00 36.14 ? 122 ARG C CZ 1 +ATOM 4527 N NH1 . ARG C 1 120 ? -10.344 -4.083 -12.405 1.00 45.91 ? 122 ARG C NH1 1 +ATOM 4528 N NH2 . ARG C 1 120 ? -9.875 -5.366 -14.252 1.00 37.27 ? 122 ARG C NH2 1 +ATOM 4529 N N . ILE C 1 121 ? -8.623 -4.651 -5.694 1.00 13.73 ? 123 ILE C N 1 +ATOM 4530 C CA . ILE C 1 121 ? -8.715 -4.427 -4.253 1.00 11.60 ? 123 ILE C CA 1 +ATOM 4531 C C . ILE C 1 121 ? -9.934 -3.513 -3.916 1.00 15.29 ? 123 ILE C C 1 +ATOM 4532 O O . ILE C 1 121 ? -10.394 -2.712 -4.741 1.00 12.13 ? 123 ILE C O 1 +ATOM 4533 C CB . ILE C 1 121 ? -7.429 -3.726 -3.770 1.00 14.27 ? 123 ILE C CB 1 +ATOM 4534 C CG1 . ILE C 1 121 ? -6.210 -4.025 -4.668 1.00 16.44 ? 123 ILE C CG1 1 +ATOM 4535 C CG2 . ILE C 1 121 ? -7.167 -4.172 -2.348 1.00 12.04 ? 123 ILE C CG2 1 +ATOM 4536 C CD1 . ILE C 1 121 ? -4.961 -3.141 -4.438 1.00 19.61 ? 123 ILE C CD1 1 +ATOM 4537 N N . GLU C 1 122 ? -10.457 -3.651 -2.693 1.00 4.19 ? 124 GLU C N 1 +ATOM 4538 C CA . GLU C 1 122 ? -11.503 -2.837 -2.167 1.00 14.08 ? 124 GLU C CA 1 +ATOM 4539 C C . GLU C 1 122 ? -10.945 -2.672 -0.798 1.00 15.41 ? 124 GLU C C 1 +ATOM 4540 O O . GLU C 1 122 ? -10.503 -3.650 -0.226 1.00 18.00 ? 124 GLU C O 1 +ATOM 4541 C CB . GLU C 1 122 ? -12.869 -3.483 -1.933 1.00 24.40 ? 124 GLU C CB 1 +ATOM 4542 C CG . GLU C 1 122 ? -13.677 -3.829 -3.183 1.00 39.18 ? 124 GLU C CG 1 +ATOM 4543 C CD . GLU C 1 122 ? -14.765 -4.882 -2.964 1.00 50.07 ? 124 GLU C CD 1 +ATOM 4544 O OE1 . GLU C 1 122 ? -14.645 -5.751 -2.076 1.00 58.95 ? 124 GLU C OE1 1 +ATOM 4545 O OE2 . GLU C 1 122 ? -15.738 -4.838 -3.722 1.00 53.19 ? 124 GLU C OE2 1 +ATOM 4546 N N . LEU C 1 123 ? -10.961 -1.462 -0.222 1.00 15.25 ? 125 LEU C N 1 +ATOM 4547 C CA . LEU C 1 123 ? -10.363 -1.303 1.086 1.00 15.26 ? 125 LEU C CA 1 +ATOM 4548 C C . LEU C 1 123 ? -11.304 -0.561 1.953 1.00 8.80 ? 125 LEU C C 1 +ATOM 4549 O O . LEU C 1 123 ? -11.946 0.328 1.448 1.00 19.93 ? 125 LEU C O 1 +ATOM 4550 C CB . LEU C 1 123 ? -9.031 -0.534 0.915 1.00 17.64 ? 125 LEU C CB 1 +ATOM 4551 C CG . LEU C 1 123 ? -8.321 0.067 2.099 1.00 10.45 ? 125 LEU C CG 1 +ATOM 4552 C CD1 . LEU C 1 123 ? -6.785 -0.012 1.878 1.00 20.21 ? 125 LEU C CD1 1 +ATOM 4553 C CD2 . LEU C 1 123 ? -8.773 1.502 2.243 1.00 17.59 ? 125 LEU C CD2 1 +ATOM 4554 N N . LYS C 1 124 ? -11.422 -0.823 3.239 1.00 13.83 ? 126 LYS C N 1 +ATOM 4555 C CA . LYS C 1 124 ? -12.316 -0.025 4.018 1.00 17.64 ? 126 LYS C CA 1 +ATOM 4556 C C . LYS C 1 124 ? -11.579 0.215 5.283 1.00 14.74 ? 126 LYS C C 1 +ATOM 4557 O O . LYS C 1 124 ? -11.225 -0.703 6.003 1.00 20.36 ? 126 LYS C O 1 +ATOM 4558 C CB . LYS C 1 124 ? -13.642 -0.769 4.277 1.00 26.88 ? 126 LYS C CB 1 +ATOM 4559 C CG . LYS C 1 124 ? -14.813 0.194 4.210 1.00 39.77 ? 126 LYS C CG 1 +ATOM 4560 C CD . LYS C 1 124 ? -15.572 0.268 5.541 1.00 44.87 ? 126 LYS C CD 1 +ATOM 4561 C CE . LYS C 1 124 ? -16.445 1.530 5.567 1.00 47.22 ? 126 LYS C CE 1 +ATOM 4562 N NZ . LYS C 1 124 ? -15.627 2.698 5.873 1.00 46.90 ? 126 LYS C NZ 1 +ATOM 4563 N N . GLY C 1 125 ? -11.276 1.472 5.536 1.00 14.63 ? 127 GLY C N 1 +ATOM 4564 C CA . GLY C 1 125 ? -10.639 1.825 6.795 1.00 10.55 ? 127 GLY C CA 1 +ATOM 4565 C C . GLY C 1 125 ? -11.650 2.641 7.560 1.00 10.11 ? 127 GLY C C 1 +ATOM 4566 O O . GLY C 1 125 ? -12.402 3.440 7.010 1.00 17.35 ? 127 GLY C O 1 +ATOM 4567 N N . ILE C 1 126 ? -11.706 2.408 8.843 1.00 10.86 ? 128 ILE C N 1 +ATOM 4568 C CA . ILE C 1 126 ? -12.653 3.047 9.697 1.00 19.50 ? 128 ILE C CA 1 +ATOM 4569 C C . ILE C 1 126 ? -11.844 3.436 10.904 1.00 25.78 ? 128 ILE C C 1 +ATOM 4570 O O . ILE C 1 126 ? -10.732 2.940 11.076 1.00 34.03 ? 128 ILE C O 1 +ATOM 4571 C CB . ILE C 1 126 ? -13.805 2.062 10.153 1.00 21.29 ? 128 ILE C CB 1 +ATOM 4572 C CG1 . ILE C 1 126 ? -13.304 0.883 10.971 1.00 17.61 ? 128 ILE C CG1 1 +ATOM 4573 C CG2 . ILE C 1 126 ? -14.421 1.445 8.925 1.00 22.79 ? 128 ILE C CG2 1 +ATOM 4574 C CD1 . ILE C 1 126 ? -14.356 0.293 11.932 1.00 22.71 ? 128 ILE C CD1 1 +ATOM 4575 N N . ASP C 1 127 ? -12.413 4.251 11.793 1.00 27.85 ? 129 ASP C N 1 +ATOM 4576 C CA . ASP C 1 127 ? -11.824 4.517 13.104 1.00 30.21 ? 129 ASP C CA 1 +ATOM 4577 C C . ASP C 1 127 ? -10.476 5.227 13.168 1.00 29.69 ? 129 ASP C C 1 +ATOM 4578 O O . ASP C 1 127 ? -9.784 5.236 14.180 1.00 30.43 ? 129 ASP C O 1 +ATOM 4579 C CB . ASP C 1 127 ? -11.742 3.189 13.887 1.00 31.72 ? 129 ASP C CB 1 +ATOM 4580 C CG . ASP C 1 127 ? -13.079 2.600 14.353 1.00 42.93 ? 129 ASP C CG 1 +ATOM 4581 O OD1 . ASP C 1 127 ? -14.141 3.222 14.187 1.00 36.34 ? 129 ASP C OD1 1 +ATOM 4582 O OD2 . ASP C 1 127 ? -13.040 1.488 14.896 1.00 49.04 ? 129 ASP C OD2 1 +ATOM 4583 N N . PHE C 1 128 ? -10.115 5.845 12.055 1.00 27.62 ? 130 PHE C N 1 +ATOM 4584 C CA . PHE C 1 128 ? -8.980 6.716 12.021 1.00 30.06 ? 130 PHE C CA 1 +ATOM 4585 C C . PHE C 1 128 ? -9.181 8.046 12.769 1.00 33.13 ? 130 PHE C C 1 +ATOM 4586 O O . PHE C 1 128 ? -10.234 8.683 12.712 1.00 33.29 ? 130 PHE C O 1 +ATOM 4587 C CB . PHE C 1 128 ? -8.628 6.981 10.567 1.00 30.60 ? 130 PHE C CB 1 +ATOM 4588 C CG . PHE C 1 128 ? -8.012 5.747 9.944 1.00 38.99 ? 130 PHE C CG 1 +ATOM 4589 C CD1 . PHE C 1 128 ? -6.661 5.476 10.186 1.00 36.68 ? 130 PHE C CD1 1 +ATOM 4590 C CD2 . PHE C 1 128 ? -8.804 4.851 9.217 1.00 35.81 ? 130 PHE C CD2 1 +ATOM 4591 C CE1 . PHE C 1 128 ? -6.088 4.303 9.715 1.00 33.98 ? 130 PHE C CE1 1 +ATOM 4592 C CE2 . PHE C 1 128 ? -8.219 3.681 8.751 1.00 41.01 ? 130 PHE C CE2 1 +ATOM 4593 C CZ . PHE C 1 128 ? -6.867 3.401 9.000 1.00 37.85 ? 130 PHE C CZ 1 +ATOM 4594 N N . LYS C 1 129 ? -8.133 8.418 13.522 1.00 33.45 ? 131 LYS C N 1 +ATOM 4595 C CA . LYS C 1 129 ? -7.951 9.698 14.190 1.00 33.09 ? 131 LYS C CA 1 +ATOM 4596 C C . LYS C 1 129 ? -7.619 10.619 13.043 1.00 37.65 ? 131 LYS C C 1 +ATOM 4597 O O . LYS C 1 129 ? -6.793 10.244 12.198 1.00 44.57 ? 131 LYS C O 1 +ATOM 4598 C CB . LYS C 1 129 ? -6.779 9.649 15.197 1.00 25.33 ? 131 LYS C CB 1 +ATOM 4599 C CG . LYS C 1 129 ? -7.119 8.755 16.394 1.00 25.57 ? 131 LYS C CG 1 +ATOM 4600 C CD . LYS C 1 129 ? -6.082 8.377 17.431 1.00 24.50 ? 131 LYS C CD 1 +ATOM 4601 C CE . LYS C 1 129 ? -6.759 7.562 18.556 1.00 29.35 ? 131 LYS C CE 1 +ATOM 4602 N NZ . LYS C 1 129 ? -5.948 7.335 19.759 1.00 28.80 ? 131 LYS C NZ 1 +ATOM 4603 N N . GLU C 1 130 ? -8.313 11.776 12.942 1.00 40.97 ? 132 GLU C N 1 +ATOM 4604 C CA . GLU C 1 130 ? -8.032 12.748 11.873 1.00 41.88 ? 132 GLU C CA 1 +ATOM 4605 C C . GLU C 1 130 ? -6.809 13.581 12.167 1.00 37.07 ? 132 GLU C C 1 +ATOM 4606 O O . GLU C 1 130 ? -6.240 14.234 11.319 1.00 40.38 ? 132 GLU C O 1 +ATOM 4607 C CB . GLU C 1 130 ? -9.240 13.664 11.618 1.00 44.19 ? 132 GLU C CB 1 +ATOM 4608 C CG . GLU C 1 130 ? -10.107 14.059 12.805 1.00 50.42 ? 132 GLU C CG 1 +ATOM 4609 C CD . GLU C 1 130 ? -11.579 14.204 12.396 1.00 56.10 ? 132 GLU C CD 1 +ATOM 4610 O OE1 . GLU C 1 130 ? -11.995 15.301 11.996 1.00 54.49 ? 132 GLU C OE1 1 +ATOM 4611 O OE2 . GLU C 1 130 ? -12.306 13.207 12.469 1.00 58.06 ? 132 GLU C OE2 1 +ATOM 4612 N N . ASP C 1 131 ? -6.409 13.522 13.417 1.00 38.00 ? 133 ASP C N 1 +ATOM 4613 C CA . ASP C 1 131 ? -5.205 14.114 13.938 1.00 41.05 ? 133 ASP C CA 1 +ATOM 4614 C C . ASP C 1 131 ? -4.048 13.107 13.965 1.00 38.88 ? 133 ASP C C 1 +ATOM 4615 O O . ASP C 1 131 ? -2.916 13.406 14.344 1.00 39.85 ? 133 ASP C O 1 +ATOM 4616 C CB . ASP C 1 131 ? -5.545 14.607 15.340 1.00 48.88 ? 133 ASP C CB 1 +ATOM 4617 C CG . ASP C 1 131 ? -6.146 13.577 16.312 1.00 49.86 ? 133 ASP C CG 1 +ATOM 4618 O OD1 . ASP C 1 131 ? -7.312 13.198 16.144 1.00 42.55 ? 133 ASP C OD1 1 +ATOM 4619 O OD2 . ASP C 1 131 ? -5.439 13.180 17.249 1.00 54.03 ? 133 ASP C OD2 1 +ATOM 4620 N N . GLY C 1 132 ? -4.360 11.857 13.604 1.00 36.44 ? 134 GLY C N 1 +ATOM 4621 C CA . GLY C 1 132 ? -3.439 10.740 13.622 1.00 27.20 ? 134 GLY C CA 1 +ATOM 4622 C C . GLY C 1 132 ? -2.485 10.800 12.459 1.00 21.75 ? 134 GLY C C 1 +ATOM 4623 O O . GLY C 1 132 ? -2.609 11.655 11.583 1.00 17.44 ? 134 GLY C O 1 +ATOM 4624 N N . ASN C 1 133 ? -1.593 9.806 12.444 1.00 16.97 ? 135 ASN C N 1 +ATOM 4625 C CA . ASN C 1 133 ? -0.537 9.811 11.470 1.00 14.17 ? 135 ASN C CA 1 +ATOM 4626 C C . ASN C 1 133 ? -1.012 9.473 10.120 1.00 13.04 ? 135 ASN C C 1 +ATOM 4627 O O . ASN C 1 133 ? -0.345 9.740 9.126 1.00 17.43 ? 135 ASN C O 1 +ATOM 4628 C CB . ASN C 1 133 ? 0.560 8.821 11.881 1.00 19.03 ? 135 ASN C CB 1 +ATOM 4629 C CG . ASN C 1 133 ? 1.167 9.131 13.224 1.00 15.57 ? 135 ASN C CG 1 +ATOM 4630 O OD1 . ASN C 1 133 ? 1.327 8.295 14.113 1.00 29.80 ? 135 ASN C OD1 1 +ATOM 4631 N ND2 . ASN C 1 133 ? 1.543 10.374 13.432 1.00 24.53 ? 135 ASN C ND2 1 +ATOM 4632 N N . ILE C 1 134 ? -2.165 8.835 10.063 1.00 15.63 ? 136 ILE C N 1 +ATOM 4633 C CA . ILE C 1 134 ? -2.645 8.413 8.770 1.00 19.92 ? 136 ILE C CA 1 +ATOM 4634 C C . ILE C 1 134 ? -3.488 9.497 8.174 1.00 17.87 ? 136 ILE C C 1 +ATOM 4635 O O . ILE C 1 134 ? -3.164 9.932 7.081 1.00 19.92 ? 136 ILE C O 1 +ATOM 4636 C CB . ILE C 1 134 ? -3.419 7.064 8.934 1.00 22.04 ? 136 ILE C CB 1 +ATOM 4637 C CG1 . ILE C 1 134 ? -2.437 5.972 9.321 1.00 20.93 ? 136 ILE C CG1 1 +ATOM 4638 C CG2 . ILE C 1 134 ? -4.083 6.653 7.628 1.00 14.29 ? 136 ILE C CG2 1 +ATOM 4639 C CD1 . ILE C 1 134 ? -2.233 5.849 10.842 1.00 27.10 ? 136 ILE C CD1 1 +ATOM 4640 N N . LEU C 1 135 ? -4.539 9.978 8.844 1.00 18.76 ? 137 LEU C N 1 +ATOM 4641 C CA . LEU C 1 135 ? -5.355 11.014 8.210 1.00 19.40 ? 137 LEU C CA 1 +ATOM 4642 C C . LEU C 1 135 ? -4.581 12.324 8.235 1.00 20.62 ? 137 LEU C C 1 +ATOM 4643 O O . LEU C 1 135 ? -4.498 13.016 7.221 1.00 25.60 ? 137 LEU C O 1 +ATOM 4644 C CB . LEU C 1 135 ? -6.717 11.106 8.955 1.00 20.20 ? 137 LEU C CB 1 +ATOM 4645 C CG . LEU C 1 135 ? -7.896 10.185 8.571 1.00 15.92 ? 137 LEU C CG 1 +ATOM 4646 C CD1 . LEU C 1 135 ? -8.564 10.616 7.293 1.00 26.13 ? 137 LEU C CD1 1 +ATOM 4647 C CD2 . LEU C 1 135 ? -7.387 8.850 8.123 1.00 30.23 ? 137 LEU C CD2 1 +ATOM 4648 N N . GLY C 1 136 ? -3.881 12.629 9.322 1.00 18.71 ? 138 GLY C N 1 +ATOM 4649 C CA . GLY C 1 136 ? -3.037 13.821 9.399 1.00 17.91 ? 138 GLY C CA 1 +ATOM 4650 C C . GLY C 1 136 ? -1.795 13.750 8.513 1.00 20.08 ? 138 GLY C C 1 +ATOM 4651 O O . GLY C 1 136 ? -0.970 14.635 8.593 1.00 25.89 ? 138 GLY C O 1 +ATOM 4652 N N . HIS C 1 137 ? -1.621 12.776 7.621 1.00 12.30 ? 139 HIS C N 1 +ATOM 4653 C CA . HIS C 1 137 ? -0.476 12.623 6.789 1.00 12.03 ? 139 HIS C CA 1 +ATOM 4654 C C . HIS C 1 137 ? 0.921 12.916 7.341 1.00 18.62 ? 139 HIS C C 1 +ATOM 4655 O O . HIS C 1 137 ? 1.800 13.555 6.750 1.00 20.37 ? 139 HIS C O 1 +ATOM 4656 C CB . HIS C 1 137 ? -0.731 13.408 5.575 1.00 3.97 ? 139 HIS C CB 1 +ATOM 4657 C CG . HIS C 1 137 ? -1.782 12.795 4.674 1.00 7.42 ? 139 HIS C CG 1 +ATOM 4658 N ND1 . HIS C 1 137 ? -3.051 12.575 4.992 1.00 10.70 ? 139 HIS C ND1 1 +ATOM 4659 C CD2 . HIS C 1 137 ? -1.603 12.450 3.354 1.00 7.91 ? 139 HIS C CD2 1 +ATOM 4660 C CE1 . HIS C 1 137 ? -3.640 12.121 3.915 1.00 2.27 ? 139 HIS C CE1 1 +ATOM 4661 N NE2 . HIS C 1 137 ? -2.783 12.038 2.921 1.00 6.80 ? 139 HIS C NE2 1 +ATOM 4662 N N . LYS C 1 138 ? 1.074 12.390 8.541 1.00 18.63 ? 140 LYS C N 1 +ATOM 4663 C CA . LYS C 1 138 ? 2.302 12.414 9.290 1.00 17.82 ? 140 LYS C CA 1 +ATOM 4664 C C . LYS C 1 138 ? 3.324 11.301 8.926 1.00 21.04 ? 140 LYS C C 1 +ATOM 4665 O O . LYS C 1 138 ? 4.282 11.066 9.666 1.00 19.60 ? 140 LYS C O 1 +ATOM 4666 C CB . LYS C 1 138 ? 1.898 12.339 10.715 1.00 16.10 ? 140 LYS C CB 1 +ATOM 4667 C CG . LYS C 1 138 ? 1.012 13.492 11.204 1.00 14.34 ? 140 LYS C CG 1 +ATOM 4668 C CD . LYS C 1 138 ? 0.900 13.243 12.682 1.00 16.35 ? 140 LYS C CD 1 +ATOM 4669 C CE . LYS C 1 138 ? 0.327 14.398 13.456 1.00 32.22 ? 140 LYS C CE 1 +ATOM 4670 N NZ . LYS C 1 138 ? -1.054 14.617 13.102 1.00 34.45 ? 140 LYS C NZ 1 +ATOM 4671 N N . LEU C 1 139 ? 3.206 10.623 7.774 1.00 18.82 ? 141 LEU C N 1 +ATOM 4672 C CA . LEU C 1 139 ? 4.121 9.524 7.466 1.00 22.34 ? 141 LEU C CA 1 +ATOM 4673 C C . LEU C 1 139 ? 5.074 9.940 6.386 1.00 18.96 ? 141 LEU C C 1 +ATOM 4674 O O . LEU C 1 139 ? 4.673 10.465 5.339 1.00 18.71 ? 141 LEU C O 1 +ATOM 4675 C CB . LEU C 1 139 ? 3.496 8.234 6.875 1.00 15.63 ? 141 LEU C CB 1 +ATOM 4676 C CG . LEU C 1 139 ? 2.324 7.486 7.483 1.00 23.54 ? 141 LEU C CG 1 +ATOM 4677 C CD1 . LEU C 1 139 ? 2.475 6.047 7.090 1.00 14.53 ? 141 LEU C CD1 1 +ATOM 4678 C CD2 . LEU C 1 139 ? 2.302 7.552 8.976 1.00 23.33 ? 141 LEU C CD2 1 +ATOM 4679 N N . GLU C 1 140 ? 6.329 9.550 6.616 1.00 15.24 ? 142 GLU C N 1 +ATOM 4680 C CA . GLU C 1 140 ? 7.364 9.857 5.653 1.00 15.74 ? 142 GLU C CA 1 +ATOM 4681 C C . GLU C 1 140 ? 7.096 9.110 4.386 1.00 12.62 ? 142 GLU C C 1 +ATOM 4682 O O . GLU C 1 140 ? 6.511 8.030 4.401 1.00 18.26 ? 142 GLU C O 1 +ATOM 4683 C CB . GLU C 1 140 ? 8.692 9.481 6.221 1.00 19.26 ? 142 GLU C CB 1 +ATOM 4684 C CG . GLU C 1 140 ? 9.038 10.050 7.605 1.00 22.17 ? 142 GLU C CG 1 +ATOM 4685 C CD . GLU C 1 140 ? 10.519 9.978 7.934 1.00 32.08 ? 142 GLU C CD 1 +ATOM 4686 O OE1 . GLU C 1 140 ? 11.308 10.014 6.997 1.00 47.85 ? 142 GLU C OE1 1 +ATOM 4687 O OE2 . GLU C 1 140 ? 10.903 9.896 9.102 1.00 36.93 ? 142 GLU C OE2 1 +ATOM 4688 N N . TYR C 1 141 ? 7.424 9.697 3.246 1.00 8.91 ? 143 TYR C N 1 +ATOM 4689 C CA . TYR C 1 141 ? 7.182 8.992 2.012 1.00 7.72 ? 143 TYR C CA 1 +ATOM 4690 C C . TYR C 1 141 ? 8.302 8.008 1.730 1.00 11.61 ? 143 TYR C C 1 +ATOM 4691 O O . TYR C 1 141 ? 9.055 8.048 0.761 1.00 8.28 ? 143 TYR C O 1 +ATOM 4692 C CB . TYR C 1 141 ? 7.097 9.976 0.901 1.00 8.04 ? 143 TYR C CB 1 +ATOM 4693 C CG . TYR C 1 141 ? 6.755 9.248 -0.399 1.00 11.68 ? 143 TYR C CG 1 +ATOM 4694 C CD1 . TYR C 1 141 ? 5.493 8.679 -0.570 1.00 14.01 ? 143 TYR C CD1 1 +ATOM 4695 C CD2 . TYR C 1 141 ? 7.692 9.248 -1.429 1.00 11.48 ? 143 TYR C CD2 1 +ATOM 4696 C CE1 . TYR C 1 141 ? 5.165 8.129 -1.792 1.00 5.42 ? 143 TYR C CE1 1 +ATOM 4697 C CE2 . TYR C 1 141 ? 7.359 8.683 -2.647 1.00 13.09 ? 143 TYR C CE2 1 +ATOM 4698 C CZ . TYR C 1 141 ? 6.099 8.140 -2.811 1.00 9.87 ? 143 TYR C CZ 1 +ATOM 4699 O OH . TYR C 1 141 ? 5.758 7.629 -4.049 1.00 15.13 ? 143 TYR C OH 1 +ATOM 4700 N N . ASN C 1 142 ? 8.380 7.062 2.635 1.00 16.69 ? 144 ASN C N 1 +ATOM 4701 C CA . ASN C 1 142 ? 9.371 6.048 2.499 1.00 23.76 ? 144 ASN C CA 1 +ATOM 4702 C C . ASN C 1 142 ? 8.822 4.696 2.924 1.00 27.80 ? 144 ASN C C 1 +ATOM 4703 O O . ASN C 1 142 ? 7.636 4.572 3.250 1.00 30.40 ? 144 ASN C O 1 +ATOM 4704 C CB . ASN C 1 142 ? 10.562 6.558 3.315 1.00 16.89 ? 144 ASN C CB 1 +ATOM 4705 C CG . ASN C 1 142 ? 10.228 6.729 4.752 1.00 12.46 ? 144 ASN C CG 1 +ATOM 4706 O OD1 . ASN C 1 142 ? 9.221 6.236 5.224 1.00 13.45 ? 144 ASN C OD1 1 +ATOM 4707 N ND2 . ASN C 1 142 ? 11.092 7.409 5.496 1.00 23.60 ? 144 ASN C ND2 1 +ATOM 4708 N N . TYR C 1 143 ? 9.686 3.676 2.886 1.00 29.14 ? 145 TYR C N 1 +ATOM 4709 C CA . TYR C 1 143 ? 9.334 2.316 3.284 1.00 24.13 ? 145 TYR C CA 1 +ATOM 4710 C C . TYR C 1 143 ? 10.566 1.547 3.731 1.00 26.33 ? 145 TYR C C 1 +ATOM 4711 O O . TYR C 1 143 ? 11.701 1.728 3.286 1.00 22.84 ? 145 TYR C O 1 +ATOM 4712 C CB . TYR C 1 143 ? 8.674 1.611 2.101 1.00 24.75 ? 145 TYR C CB 1 +ATOM 4713 C CG . TYR C 1 143 ? 7.476 0.766 2.510 1.00 25.02 ? 145 TYR C CG 1 +ATOM 4714 C CD1 . TYR C 1 143 ? 6.305 1.387 2.966 1.00 27.68 ? 145 TYR C CD1 1 +ATOM 4715 C CD2 . TYR C 1 143 ? 7.548 -0.634 2.438 1.00 20.30 ? 145 TYR C CD2 1 +ATOM 4716 C CE1 . TYR C 1 143 ? 5.203 0.613 3.355 1.00 29.26 ? 145 TYR C CE1 1 +ATOM 4717 C CE2 . TYR C 1 143 ? 6.466 -1.416 2.819 1.00 21.53 ? 145 TYR C CE2 1 +ATOM 4718 C CZ . TYR C 1 143 ? 5.304 -0.787 3.277 1.00 32.96 ? 145 TYR C CZ 1 +ATOM 4719 O OH . TYR C 1 143 ? 4.263 -1.571 3.683 1.00 23.53 ? 145 TYR C OH 1 +ATOM 4720 N N . ASN C 1 144 ? 10.278 0.634 4.641 1.00 27.76 ? 146 ASN C N 1 +ATOM 4721 C CA . ASN C 1 144 ? 11.287 -0.214 5.239 1.00 25.16 ? 146 ASN C CA 1 +ATOM 4722 C C . ASN C 1 144 ? 11.305 -1.621 4.673 1.00 28.04 ? 146 ASN C C 1 +ATOM 4723 O O . ASN C 1 144 ? 10.745 -1.884 3.603 1.00 29.84 ? 146 ASN C O 1 +ATOM 4724 C CB . ASN C 1 144 ? 11.021 -0.173 6.729 1.00 26.76 ? 146 ASN C CB 1 +ATOM 4725 C CG . ASN C 1 144 ? 11.171 1.277 7.181 1.00 33.07 ? 146 ASN C CG 1 +ATOM 4726 O OD1 . ASN C 1 144 ? 11.968 2.014 6.597 1.00 32.00 ? 146 ASN C OD1 1 +ATOM 4727 N ND2 . ASN C 1 144 ? 10.408 1.770 8.149 1.00 25.30 ? 146 ASN C ND2 1 +ATOM 4728 N N . SER C 1 145 ? 12.072 -2.472 5.373 1.00 23.59 ? 147 SER C N 1 +ATOM 4729 C CA . SER C 1 145 ? 12.222 -3.914 5.111 1.00 15.40 ? 147 SER C CA 1 +ATOM 4730 C C . SER C 1 145 ? 11.314 -4.694 5.988 1.00 9.64 ? 147 SER C C 1 +ATOM 4731 O O . SER C 1 145 ? 11.266 -4.472 7.218 1.00 12.86 ? 147 SER C O 1 +ATOM 4732 C CB . SER C 1 145 ? 13.628 -4.435 5.420 1.00 7.31 ? 147 SER C CB 1 +ATOM 4733 O OG . SER C 1 145 ? 14.168 -4.380 4.126 1.00 4.17 ? 147 SER C OG 1 +ATOM 4734 N N . HIS C 1 146 ? 10.549 -5.610 5.421 1.00 10.19 ? 148 HIS C N 1 +ATOM 4735 C CA . HIS C 1 146 ? 9.786 -6.451 6.359 1.00 11.16 ? 148 HIS C CA 1 +ATOM 4736 C C . HIS C 1 146 ? 9.736 -7.880 5.906 1.00 12.78 ? 148 HIS C C 1 +ATOM 4737 O O . HIS C 1 146 ? 9.871 -8.195 4.718 1.00 18.87 ? 148 HIS C O 1 +ATOM 4738 C CB . HIS C 1 146 ? 8.391 -5.977 6.520 1.00 7.52 ? 148 HIS C CB 1 +ATOM 4739 C CG . HIS C 1 146 ? 8.243 -4.504 6.864 1.00 7.75 ? 148 HIS C CG 1 +ATOM 4740 N ND1 . HIS C 1 146 ? 8.250 -3.526 5.961 1.00 14.26 ? 148 HIS C ND1 1 +ATOM 4741 C CD2 . HIS C 1 146 ? 8.109 -3.975 8.127 1.00 3.80 ? 148 HIS C CD2 1 +ATOM 4742 C CE1 . HIS C 1 146 ? 8.131 -2.415 6.649 1.00 4.61 ? 148 HIS C CE1 1 +ATOM 4743 N NE2 . HIS C 1 146 ? 8.048 -2.681 7.930 1.00 8.32 ? 148 HIS C NE2 1 +ATOM 4744 N N . ASN C 1 147 ? 9.598 -8.730 6.910 1.00 15.45 ? 149 ASN C N 1 +ATOM 4745 C CA . ASN C 1 147 ? 9.382 -10.159 6.684 1.00 17.81 ? 149 ASN C CA 1 +ATOM 4746 C C . ASN C 1 147 ? 7.908 -10.505 6.798 1.00 17.18 ? 149 ASN C C 1 +ATOM 4747 O O . ASN C 1 147 ? 7.268 -10.335 7.841 1.00 17.58 ? 149 ASN C O 1 +ATOM 4748 C CB . ASN C 1 147 ? 10.145 -10.978 7.722 1.00 21.17 ? 149 ASN C CB 1 +ATOM 4749 C CG . ASN C 1 147 ? 11.668 -10.731 7.749 1.00 22.08 ? 149 ASN C CG 1 +ATOM 4750 O OD1 . ASN C 1 147 ? 12.312 -10.603 8.797 1.00 21.44 ? 149 ASN C OD1 1 +ATOM 4751 N ND2 . ASN C 1 147 ? 12.282 -10.649 6.586 1.00 8.97 ? 149 ASN C ND2 1 +ATOM 4752 N N . VAL C 1 148 ? 7.343 -10.988 5.696 1.00 20.23 ? 150 VAL C N 1 +ATOM 4753 C CA . VAL C 1 148 ? 5.963 -11.459 5.657 1.00 15.96 ? 150 VAL C CA 1 +ATOM 4754 C C . VAL C 1 148 ? 5.941 -12.908 6.116 1.00 14.68 ? 150 VAL C C 1 +ATOM 4755 O O . VAL C 1 148 ? 6.215 -13.781 5.321 1.00 17.53 ? 150 VAL C O 1 +ATOM 4756 C CB . VAL C 1 148 ? 5.405 -11.403 4.249 1.00 20.76 ? 150 VAL C CB 1 +ATOM 4757 C CG1 . VAL C 1 148 ? 3.913 -11.800 4.244 1.00 16.31 ? 150 VAL C CG1 1 +ATOM 4758 C CG2 . VAL C 1 148 ? 5.638 -10.016 3.695 1.00 10.06 ? 150 VAL C CG2 1 +ATOM 4759 N N . TYR C 1 149 ? 5.684 -13.199 7.374 1.00 13.22 ? 151 TYR C N 1 +ATOM 4760 C CA . TYR C 1 149 ? 5.550 -14.525 7.925 1.00 13.03 ? 151 TYR C CA 1 +ATOM 4761 C C . TYR C 1 149 ? 4.331 -15.314 7.460 1.00 14.35 ? 151 TYR C C 1 +ATOM 4762 O O . TYR C 1 149 ? 3.226 -15.178 7.952 1.00 20.72 ? 151 TYR C O 1 +ATOM 4763 C CB . TYR C 1 149 ? 5.543 -14.409 9.453 1.00 12.18 ? 151 TYR C CB 1 +ATOM 4764 C CG . TYR C 1 149 ? 6.925 -13.923 9.858 1.00 26.03 ? 151 TYR C CG 1 +ATOM 4765 C CD1 . TYR C 1 149 ? 8.025 -14.798 9.747 1.00 30.48 ? 151 TYR C CD1 1 +ATOM 4766 C CD2 . TYR C 1 149 ? 7.124 -12.606 10.283 1.00 27.24 ? 151 TYR C CD2 1 +ATOM 4767 C CE1 . TYR C 1 149 ? 9.310 -14.357 10.046 1.00 32.76 ? 151 TYR C CE1 1 +ATOM 4768 C CE2 . TYR C 1 149 ? 8.415 -12.169 10.591 1.00 37.03 ? 151 TYR C CE2 1 +ATOM 4769 C CZ . TYR C 1 149 ? 9.498 -13.047 10.464 1.00 34.62 ? 151 TYR C CZ 1 +ATOM 4770 O OH . TYR C 1 149 ? 10.782 -12.604 10.708 1.00 42.74 ? 151 TYR C OH 1 +ATOM 4771 N N . ILE C 1 150 ? 4.546 -16.147 6.460 1.00 17.73 ? 152 ILE C N 1 +ATOM 4772 C CA . ILE C 1 150 ? 3.551 -17.045 5.913 1.00 22.40 ? 152 ILE C CA 1 +ATOM 4773 C C . ILE C 1 150 ? 3.450 -18.354 6.712 1.00 25.58 ? 152 ILE C C 1 +ATOM 4774 O O . ILE C 1 150 ? 4.419 -18.916 7.216 1.00 30.34 ? 152 ILE C O 1 +ATOM 4775 C CB . ILE C 1 150 ? 3.929 -17.297 4.446 1.00 18.67 ? 152 ILE C CB 1 +ATOM 4776 C CG1 . ILE C 1 150 ? 4.050 -15.957 3.784 1.00 2.00 ? 152 ILE C CG1 1 +ATOM 4777 C CG2 . ILE C 1 150 ? 2.932 -18.228 3.759 1.00 20.65 ? 152 ILE C CG2 1 +ATOM 4778 C CD1 . ILE C 1 150 ? 3.919 -16.028 2.285 1.00 9.55 ? 152 ILE C CD1 1 +ATOM 4779 N N . THR C 1 151 ? 2.214 -18.766 6.946 1.00 29.58 ? 153 THR C N 1 +ATOM 4780 C CA . THR C 1 151 ? 1.855 -20.018 7.603 1.00 30.89 ? 153 THR C CA 1 +ATOM 4781 C C . THR C 1 151 ? 0.765 -20.657 6.735 1.00 28.53 ? 153 THR C C 1 +ATOM 4782 O O . THR C 1 151 ? 0.088 -19.991 5.931 1.00 30.07 ? 153 THR C O 1 +ATOM 4783 C CB . THR C 1 151 ? 1.362 -19.699 9.032 1.00 30.16 ? 153 THR C CB 1 +ATOM 4784 O OG1 . THR C 1 151 ? 1.256 -20.921 9.732 1.00 44.05 ? 153 THR C OG1 1 +ATOM 4785 C CG2 . THR C 1 151 ? -0.006 -19.134 9.088 1.00 35.32 ? 153 THR C CG2 1 +ATOM 4786 N N . ALA C 1 152 ? 0.560 -21.975 6.818 1.00 28.73 ? 154 ALA C N 1 +ATOM 4787 C CA . ALA C 1 152 ? -0.491 -22.549 5.971 1.00 24.39 ? 154 ALA C CA 1 +ATOM 4788 C C . ALA C 1 152 ? -1.829 -22.467 6.665 1.00 18.58 ? 154 ALA C C 1 +ATOM 4789 O O . ALA C 1 152 ? -2.006 -22.399 7.889 1.00 11.24 ? 154 ALA C O 1 +ATOM 4790 C CB . ALA C 1 152 ? -0.228 -24.006 5.631 1.00 23.11 ? 154 ALA C CB 1 +ATOM 4791 N N . ASP C 1 153 ? -2.784 -22.337 5.771 1.00 21.53 ? 155 ASP C N 1 +ATOM 4792 C CA . ASP C 1 153 ? -4.160 -22.338 6.214 1.00 27.97 ? 155 ASP C CA 1 +ATOM 4793 C C . ASP C 1 153 ? -4.739 -23.528 5.480 1.00 27.50 ? 155 ASP C C 1 +ATOM 4794 O O . ASP C 1 153 ? -5.156 -23.408 4.334 1.00 29.42 ? 155 ASP C O 1 +ATOM 4795 C CB . ASP C 1 153 ? -4.789 -21.012 5.785 1.00 35.28 ? 155 ASP C CB 1 +ATOM 4796 C CG . ASP C 1 153 ? -6.137 -20.680 6.380 1.00 37.50 ? 155 ASP C CG 1 +ATOM 4797 O OD1 . ASP C 1 153 ? -6.810 -21.579 6.894 1.00 44.17 ? 155 ASP C OD1 1 +ATOM 4798 O OD2 . ASP C 1 153 ? -6.490 -19.501 6.322 1.00 38.75 ? 155 ASP C OD2 1 +ATOM 4799 N N . LYS C 1 154 ? -4.619 -24.704 6.128 1.00 29.16 ? 156 LYS C N 1 +ATOM 4800 C CA . LYS C 1 154 ? -5.103 -25.977 5.628 1.00 26.57 ? 156 LYS C CA 1 +ATOM 4801 C C . LYS C 1 154 ? -6.610 -25.773 5.446 1.00 25.46 ? 156 LYS C C 1 +ATOM 4802 O O . LYS C 1 154 ? -7.108 -25.791 4.318 1.00 22.07 ? 156 LYS C O 1 +ATOM 4803 C CB . LYS C 1 154 ? -4.795 -27.059 6.677 1.00 33.54 ? 156 LYS C CB 1 +ATOM 4804 C CG . LYS C 1 154 ? -4.017 -28.350 6.360 1.00 34.75 ? 156 LYS C CG 1 +ATOM 4805 C CD . LYS C 1 154 ? -2.490 -28.220 6.250 1.00 36.94 ? 156 LYS C CD 1 +ATOM 4806 C CE . LYS C 1 154 ? -1.754 -29.580 6.160 1.00 37.34 ? 156 LYS C CE 1 +ATOM 4807 N NZ . LYS C 1 154 ? -0.518 -29.531 5.375 1.00 34.06 ? 156 LYS C NZ 1 +ATOM 4808 N N . GLN C 1 155 ? -7.308 -25.449 6.550 1.00 24.54 ? 157 GLN C N 1 +ATOM 4809 C CA . GLN C 1 155 ? -8.745 -25.212 6.587 1.00 24.62 ? 157 GLN C CA 1 +ATOM 4810 C C . GLN C 1 155 ? -9.271 -24.280 5.520 1.00 28.48 ? 157 GLN C C 1 +ATOM 4811 O O . GLN C 1 155 ? -10.362 -24.573 5.032 1.00 34.90 ? 157 GLN C O 1 +ATOM 4812 C CB . GLN C 1 155 ? -9.147 -24.666 7.922 1.00 28.39 ? 157 GLN C CB 1 +ATOM 4813 C CG . GLN C 1 155 ? -8.672 -25.557 9.080 1.00 32.43 ? 157 GLN C CG 1 +ATOM 4814 C CD . GLN C 1 155 ? -9.231 -25.110 10.434 1.00 36.63 ? 157 GLN C CD 1 +ATOM 4815 O OE1 . GLN C 1 155 ? -9.074 -25.785 11.457 1.00 34.56 ? 157 GLN C OE1 1 +ATOM 4816 N NE2 . GLN C 1 155 ? -9.926 -23.971 10.488 1.00 36.71 ? 157 GLN C NE2 1 +ATOM 4817 N N . LYS C 1 156 ? -8.591 -23.207 5.063 1.00 29.60 ? 158 LYS C N 1 +ATOM 4818 C CA . LYS C 1 156 ? -9.117 -22.446 3.925 1.00 26.36 ? 158 LYS C CA 1 +ATOM 4819 C C . LYS C 1 156 ? -8.340 -22.692 2.631 1.00 24.50 ? 158 LYS C C 1 +ATOM 4820 O O . LYS C 1 156 ? -8.391 -21.956 1.647 1.00 23.89 ? 158 LYS C O 1 +ATOM 4821 C CB . LYS C 1 156 ? -9.113 -20.975 4.288 1.00 36.30 ? 158 LYS C CB 1 +ATOM 4822 C CG . LYS C 1 156 ? -10.134 -20.536 5.353 1.00 39.75 ? 158 LYS C CG 1 +ATOM 4823 C CD . LYS C 1 156 ? -11.541 -20.725 4.766 1.00 49.93 ? 158 LYS C CD 1 +ATOM 4824 C CE . LYS C 1 156 ? -12.734 -20.547 5.714 1.00 47.83 ? 158 LYS C CE 1 +ATOM 4825 N NZ . LYS C 1 156 ? -13.907 -20.421 4.870 1.00 48.66 ? 158 LYS C NZ 1 +ATOM 4826 N N . ASN C 1 157 ? -7.688 -23.861 2.568 1.00 22.77 ? 159 ASN C N 1 +ATOM 4827 C CA . ASN C 1 157 ? -6.771 -24.239 1.496 1.00 20.37 ? 159 ASN C CA 1 +ATOM 4828 C C . ASN C 1 157 ? -5.886 -23.047 1.004 1.00 18.70 ? 159 ASN C C 1 +ATOM 4829 O O . ASN C 1 157 ? -5.651 -22.850 -0.189 1.00 21.75 ? 159 ASN C O 1 +ATOM 4830 C CB . ASN C 1 157 ? -7.629 -24.832 0.395 1.00 7.37 ? 159 ASN C CB 1 +ATOM 4831 C CG . ASN C 1 157 ? -6.914 -25.356 -0.832 1.00 4.60 ? 159 ASN C CG 1 +ATOM 4832 O OD1 . ASN C 1 157 ? -5.873 -26.010 -0.762 1.00 20.92 ? 159 ASN C OD1 1 +ATOM 4833 N ND2 . ASN C 1 157 ? -7.457 -25.172 -2.010 1.00 5.50 ? 159 ASN C ND2 1 +ATOM 4834 N N . GLY C 1 158 ? -5.352 -22.222 1.901 1.00 13.73 ? 160 GLY C N 1 +ATOM 4835 C CA . GLY C 1 158 ? -4.559 -21.056 1.511 1.00 19.62 ? 160 GLY C CA 1 +ATOM 4836 C C . GLY C 1 158 ? -3.427 -20.775 2.478 1.00 23.14 ? 160 GLY C C 1 +ATOM 4837 O O . GLY C 1 158 ? -2.688 -21.671 2.911 1.00 20.37 ? 160 GLY C O 1 +ATOM 4838 N N . ILE C 1 159 ? -3.255 -19.483 2.776 1.00 26.13 ? 161 ILE C N 1 +ATOM 4839 C CA . ILE C 1 159 ? -2.215 -19.080 3.713 1.00 27.14 ? 161 ILE C CA 1 +ATOM 4840 C C . ILE C 1 159 ? -2.662 -17.938 4.585 1.00 27.37 ? 161 ILE C C 1 +ATOM 4841 O O . ILE C 1 159 ? -3.597 -17.220 4.262 1.00 29.59 ? 161 ILE C O 1 +ATOM 4842 C CB . ILE C 1 159 ? -0.935 -18.630 3.012 1.00 31.19 ? 161 ILE C CB 1 +ATOM 4843 C CG1 . ILE C 1 159 ? -1.259 -17.466 2.085 1.00 32.00 ? 161 ILE C CG1 1 +ATOM 4844 C CG2 . ILE C 1 159 ? -0.321 -19.756 2.200 1.00 30.19 ? 161 ILE C CG2 1 +ATOM 4845 C CD1 . ILE C 1 159 ? 0.027 -16.840 1.565 1.00 18.73 ? 161 ILE C CD1 1 +ATOM 4846 N N . LYS C 1 160 ? -2.072 -17.871 5.764 1.00 28.96 ? 162 LYS C N 1 +ATOM 4847 C CA . LYS C 1 160 ? -2.193 -16.695 6.597 1.00 29.23 ? 162 LYS C CA 1 +ATOM 4848 C C . LYS C 1 160 ? -0.784 -16.078 6.591 1.00 30.07 ? 162 LYS C C 1 +ATOM 4849 O O . LYS C 1 160 ? 0.236 -16.772 6.446 1.00 25.69 ? 162 LYS C O 1 +ATOM 4850 C CB . LYS C 1 160 ? -2.581 -17.067 8.011 1.00 33.72 ? 162 LYS C CB 1 +ATOM 4851 C CG . LYS C 1 160 ? -3.928 -17.761 8.120 1.00 43.68 ? 162 LYS C CG 1 +ATOM 4852 C CD . LYS C 1 160 ? -4.092 -18.505 9.432 1.00 51.24 ? 162 LYS C CD 1 +ATOM 4853 C CE . LYS C 1 160 ? -4.248 -17.553 10.606 1.00 59.86 ? 162 LYS C CE 1 +ATOM 4854 N NZ . LYS C 1 160 ? -5.481 -16.788 10.494 1.00 64.51 ? 162 LYS C NZ 1 +ATOM 4855 N N . ALA C 1 161 ? -0.682 -14.742 6.630 1.00 29.33 ? 163 ALA C N 1 +ATOM 4856 C CA . ALA C 1 161 ? 0.622 -14.095 6.785 1.00 25.63 ? 163 ALA C CA 1 +ATOM 4857 C C . ALA C 1 161 ? 0.420 -13.060 7.853 1.00 28.13 ? 163 ALA C C 1 +ATOM 4858 O O . ALA C 1 161 ? -0.687 -12.555 8.041 1.00 30.92 ? 163 ALA C O 1 +ATOM 4859 C CB . ALA C 1 161 ? 1.069 -13.422 5.527 1.00 14.32 ? 163 ALA C CB 1 +ATOM 4860 N N . ASN C 1 162 ? 1.471 -12.863 8.648 1.00 32.37 ? 164 ASN C N 1 +ATOM 4861 C CA . ASN C 1 162 ? 1.470 -11.922 9.764 1.00 32.34 ? 164 ASN C CA 1 +ATOM 4862 C C . ASN C 1 162 ? 2.750 -11.117 9.742 1.00 32.64 ? 164 ASN C C 1 +ATOM 4863 O O . ASN C 1 162 ? 3.823 -11.645 9.485 1.00 30.39 ? 164 ASN C O 1 +ATOM 4864 C CB . ASN C 1 162 ? 1.388 -12.664 11.066 1.00 36.22 ? 164 ASN C CB 1 +ATOM 4865 C CG . ASN C 1 162 ? 0.057 -13.389 11.241 1.00 42.14 ? 164 ASN C CG 1 +ATOM 4866 O OD1 . ASN C 1 162 ? -0.779 -12.986 12.048 1.00 47.88 ? 164 ASN C OD1 1 +ATOM 4867 N ND2 . ASN C 1 162 ? -0.211 -14.474 10.523 1.00 42.58 ? 164 ASN C ND2 1 +ATOM 4868 N N . PHE C 1 163 ? 2.610 -9.804 9.932 1.00 32.28 ? 165 PHE C N 1 +ATOM 4869 C CA . PHE C 1 163 ? 3.721 -8.868 10.013 1.00 25.97 ? 165 PHE C CA 1 +ATOM 4870 C C . PHE C 1 163 ? 3.281 -7.491 10.484 1.00 25.38 ? 165 PHE C C 1 +ATOM 4871 O O . PHE C 1 163 ? 2.127 -7.119 10.363 1.00 21.43 ? 165 PHE C O 1 +ATOM 4872 C CB . PHE C 1 163 ? 4.416 -8.712 8.667 1.00 15.43 ? 165 PHE C CB 1 +ATOM 4873 C CG . PHE C 1 163 ? 3.541 -8.452 7.455 1.00 19.57 ? 165 PHE C CG 1 +ATOM 4874 C CD1 . PHE C 1 163 ? 2.747 -9.486 6.930 1.00 15.47 ? 165 PHE C CD1 1 +ATOM 4875 C CD2 . PHE C 1 163 ? 3.574 -7.194 6.833 1.00 13.47 ? 165 PHE C CD2 1 +ATOM 4876 C CE1 . PHE C 1 163 ? 1.994 -9.268 5.782 1.00 5.18 ? 165 PHE C CE1 1 +ATOM 4877 C CE2 . PHE C 1 163 ? 2.821 -6.977 5.691 1.00 16.85 ? 165 PHE C CE2 1 +ATOM 4878 C CZ . PHE C 1 163 ? 2.038 -8.011 5.171 1.00 22.07 ? 165 PHE C CZ 1 +ATOM 4879 N N . LYS C 1 164 ? 4.223 -6.763 11.087 1.00 28.94 ? 166 LYS C N 1 +ATOM 4880 C CA . LYS C 1 164 ? 4.050 -5.393 11.546 1.00 31.63 ? 166 LYS C CA 1 +ATOM 4881 C C . LYS C 1 164 ? 4.819 -4.473 10.594 1.00 27.82 ? 166 LYS C C 1 +ATOM 4882 O O . LYS C 1 164 ? 6.051 -4.558 10.524 1.00 29.37 ? 166 LYS C O 1 +ATOM 4883 C CB . LYS C 1 164 ? 4.565 -5.284 13.000 1.00 31.01 ? 166 LYS C CB 1 +ATOM 4884 C CG . LYS C 1 164 ? 3.526 -5.972 13.890 1.00 36.76 ? 166 LYS C CG 1 +ATOM 4885 C CD . LYS C 1 164 ? 4.070 -6.535 15.185 1.00 39.82 ? 166 LYS C CD 1 +ATOM 4886 C CE . LYS C 1 164 ? 4.292 -5.489 16.246 1.00 41.12 ? 166 LYS C CE 1 +ATOM 4887 N NZ . LYS C 1 164 ? 3.252 -5.641 17.236 1.00 40.92 ? 166 LYS C NZ 1 +ATOM 4888 N N . ILE C 1 165 ? 4.119 -3.650 9.785 1.00 23.20 ? 167 ILE C N 1 +ATOM 4889 C CA . ILE C 1 165 ? 4.813 -2.695 8.929 1.00 14.88 ? 167 ILE C CA 1 +ATOM 4890 C C . ILE C 1 165 ? 5.153 -1.525 9.813 1.00 16.29 ? 167 ILE C C 1 +ATOM 4891 O O . ILE C 1 165 ? 4.404 -1.137 10.714 1.00 16.05 ? 167 ILE C O 1 +ATOM 4892 C CB . ILE C 1 165 ? 3.948 -2.236 7.777 1.00 12.05 ? 167 ILE C CB 1 +ATOM 4893 C CG1 . ILE C 1 165 ? 3.792 -3.388 6.852 1.00 12.81 ? 167 ILE C CG1 1 +ATOM 4894 C CG2 . ILE C 1 165 ? 4.545 -1.084 6.988 1.00 17.78 ? 167 ILE C CG2 1 +ATOM 4895 C CD1 . ILE C 1 165 ? 4.986 -3.937 6.071 1.00 16.82 ? 167 ILE C CD1 1 +ATOM 4896 N N . ARG C 1 166 ? 6.411 -1.135 9.626 1.00 17.70 ? 168 ARG C N 1 +ATOM 4897 C CA . ARG C 1 166 ? 7.006 0.012 10.306 1.00 17.30 ? 168 ARG C CA 1 +ATOM 4898 C C . ARG C 1 166 ? 6.963 1.145 9.319 1.00 16.39 ? 168 ARG C C 1 +ATOM 4899 O O . ARG C 1 166 ? 7.455 1.125 8.183 1.00 12.99 ? 168 ARG C O 1 +ATOM 4900 C CB . ARG C 1 166 ? 8.432 -0.219 10.682 1.00 14.65 ? 168 ARG C CB 1 +ATOM 4901 C CG . ARG C 1 166 ? 8.544 -1.333 11.767 1.00 22.60 ? 168 ARG C CG 1 +ATOM 4902 C CD . ARG C 1 166 ? 9.959 -1.697 12.155 1.00 7.53 ? 168 ARG C CD 1 +ATOM 4903 N NE . ARG C 1 166 ? 10.726 -1.741 10.921 1.00 16.89 ? 168 ARG C NE 1 +ATOM 4904 C CZ . ARG C 1 166 ? 10.936 -2.855 10.207 1.00 23.40 ? 168 ARG C CZ 1 +ATOM 4905 N NH1 . ARG C 1 166 ? 10.457 -4.045 10.598 1.00 24.70 ? 168 ARG C NH1 1 +ATOM 4906 N NH2 . ARG C 1 166 ? 11.590 -2.754 9.043 1.00 14.97 ? 168 ARG C NH2 1 +ATOM 4907 N N . HIS C 1 167 ? 6.162 2.050 9.833 1.00 18.35 ? 169 HIS C N 1 +ATOM 4908 C CA . HIS C 1 167 ? 5.891 3.301 9.149 1.00 24.09 ? 169 HIS C CA 1 +ATOM 4909 C C . HIS C 1 167 ? 6.545 4.441 9.927 1.00 20.51 ? 169 HIS C C 1 +ATOM 4910 O O . HIS C 1 167 ? 6.102 4.766 11.024 1.00 19.68 ? 169 HIS C O 1 +ATOM 4911 C CB . HIS C 1 167 ? 4.372 3.537 9.075 1.00 24.36 ? 169 HIS C CB 1 +ATOM 4912 C CG . HIS C 1 167 ? 3.619 2.778 8.008 1.00 18.57 ? 169 HIS C CG 1 +ATOM 4913 N ND1 . HIS C 1 167 ? 2.548 2.033 8.223 1.00 17.85 ? 169 HIS C ND1 1 +ATOM 4914 C CD2 . HIS C 1 167 ? 3.905 2.799 6.662 1.00 12.24 ? 169 HIS C CD2 1 +ATOM 4915 C CE1 . HIS C 1 167 ? 2.201 1.629 7.024 1.00 12.54 ? 169 HIS C CE1 1 +ATOM 4916 N NE2 . HIS C 1 167 ? 2.994 2.070 6.087 1.00 11.99 ? 169 HIS C NE2 1 +ATOM 4917 N N . ASN C 1 168 ? 7.629 4.999 9.379 1.00 24.17 ? 170 ASN C N 1 +ATOM 4918 C CA . ASN C 1 168 ? 8.365 6.106 9.994 1.00 20.71 ? 170 ASN C CA 1 +ATOM 4919 C C . ASN C 1 168 ? 7.608 7.421 9.809 1.00 18.97 ? 170 ASN C C 1 +ATOM 4920 O O . ASN C 1 168 ? 7.264 7.866 8.709 1.00 11.78 ? 170 ASN C O 1 +ATOM 4921 C CB . ASN C 1 168 ? 9.731 6.273 9.356 1.00 26.74 ? 170 ASN C CB 1 +ATOM 4922 C CG . ASN C 1 168 ? 10.759 5.171 9.417 1.00 16.40 ? 170 ASN C CG 1 +ATOM 4923 O OD1 . ASN C 1 168 ? 10.843 4.342 10.328 1.00 28.34 ? 170 ASN C OD1 1 +ATOM 4924 N ND2 . ASN C 1 168 ? 11.607 5.234 8.399 1.00 16.97 ? 170 ASN C ND2 1 +ATOM 4925 N N . ILE C 1 169 ? 7.368 7.999 10.974 1.00 18.29 ? 171 ILE C N 1 +ATOM 4926 C CA . ILE C 1 169 ? 6.596 9.228 11.152 1.00 17.24 ? 171 ILE C CA 1 +ATOM 4927 C C . ILE C 1 169 ? 7.600 10.326 11.049 1.00 15.41 ? 171 ILE C C 1 +ATOM 4928 O O . ILE C 1 169 ? 8.739 10.116 11.454 1.00 15.93 ? 171 ILE C O 1 +ATOM 4929 C CB . ILE C 1 169 ? 5.890 9.255 12.550 1.00 13.67 ? 171 ILE C CB 1 +ATOM 4930 C CG1 . ILE C 1 169 ? 5.156 7.927 12.743 1.00 18.13 ? 171 ILE C CG1 1 +ATOM 4931 C CG2 . ILE C 1 169 ? 4.823 10.359 12.652 1.00 10.72 ? 171 ILE C CG2 1 +ATOM 4932 C CD1 . ILE C 1 169 ? 4.235 7.604 11.542 1.00 6.48 ? 171 ILE C CD1 1 +ATOM 4933 N N . GLU C 1 170 ? 7.152 11.485 10.555 1.00 18.90 ? 172 GLU C N 1 +ATOM 4934 C CA . GLU C 1 170 ? 7.974 12.669 10.287 1.00 16.12 ? 172 GLU C CA 1 +ATOM 4935 C C . GLU C 1 170 ? 8.760 13.163 11.508 1.00 18.52 ? 172 GLU C C 1 +ATOM 4936 O O . GLU C 1 170 ? 9.839 13.756 11.375 1.00 22.71 ? 172 GLU C O 1 +ATOM 4937 C CB . GLU C 1 170 ? 7.012 13.745 9.713 1.00 19.81 ? 172 GLU C CB 1 +ATOM 4938 C CG . GLU C 1 170 ? 6.037 14.241 10.788 1.00 18.85 ? 172 GLU C CG 1 +ATOM 4939 C CD . GLU C 1 170 ? 4.849 15.111 10.333 1.00 27.46 ? 172 GLU C CD 1 +ATOM 4940 O OE1 . GLU C 1 170 ? 4.743 15.485 9.151 1.00 17.49 ? 172 GLU C OE1 1 +ATOM 4941 O OE2 . GLU C 1 170 ? 4.011 15.388 11.199 1.00 21.80 ? 172 GLU C OE2 1 +ATOM 4942 N N . ASP C 1 171 ? 8.300 12.847 12.720 1.00 19.96 ? 173 ASP C N 1 +ATOM 4943 C CA . ASP C 1 171 ? 9.008 13.264 13.938 1.00 23.24 ? 173 ASP C CA 1 +ATOM 4944 C C . ASP C 1 171 ? 9.950 12.196 14.505 1.00 22.83 ? 173 ASP C C 1 +ATOM 4945 O O . ASP C 1 171 ? 10.362 12.145 15.687 1.00 20.67 ? 173 ASP C O 1 +ATOM 4946 C CB . ASP C 1 171 ? 7.977 13.669 15.000 1.00 19.24 ? 173 ASP C CB 1 +ATOM 4947 C CG . ASP C 1 171 ? 7.191 12.502 15.580 1.00 26.08 ? 173 ASP C CG 1 +ATOM 4948 O OD1 . ASP C 1 171 ? 6.989 11.510 14.892 1.00 27.47 ? 173 ASP C OD1 1 +ATOM 4949 O OD2 . ASP C 1 171 ? 6.791 12.577 16.737 1.00 30.85 ? 173 ASP C OD2 1 +ATOM 4950 N N . GLY C 1 172 ? 10.208 11.293 13.564 1.00 24.93 ? 174 GLY C N 1 +ATOM 4951 C CA . GLY C 1 172 ? 11.129 10.167 13.751 1.00 31.49 ? 174 GLY C CA 1 +ATOM 4952 C C . GLY C 1 172 ? 10.654 8.939 14.511 1.00 27.42 ? 174 GLY C C 1 +ATOM 4953 O O . GLY C 1 172 ? 11.442 8.017 14.775 1.00 29.17 ? 174 GLY C O 1 +ATOM 4954 N N . SER C 1 173 ? 9.376 8.960 14.897 1.00 30.11 ? 175 SER C N 1 +ATOM 4955 C CA . SER C 1 173 ? 8.729 7.864 15.599 1.00 24.85 ? 175 SER C CA 1 +ATOM 4956 C C . SER C 1 173 ? 8.227 6.855 14.589 1.00 21.72 ? 175 SER C C 1 +ATOM 4957 O O . SER C 1 173 ? 8.251 7.086 13.363 1.00 14.04 ? 175 SER C O 1 +ATOM 4958 C CB . SER C 1 173 ? 7.558 8.365 16.433 1.00 28.16 ? 175 SER C CB 1 +ATOM 4959 O OG . SER C 1 173 ? 6.520 8.871 15.615 1.00 31.55 ? 175 SER C OG 1 +ATOM 4960 N N . VAL C 1 174 ? 7.827 5.664 15.108 1.00 24.58 ? 176 VAL C N 1 +ATOM 4961 C CA . VAL C 1 174 ? 7.333 4.675 14.136 1.00 20.41 ? 176 VAL C CA 1 +ATOM 4962 C C . VAL C 1 174 ? 5.906 4.336 14.500 1.00 17.05 ? 176 VAL C C 1 +ATOM 4963 O O . VAL C 1 174 ? 5.493 4.308 15.675 1.00 14.61 ? 176 VAL C O 1 +ATOM 4964 C CB . VAL C 1 174 ? 8.230 3.415 14.162 1.00 20.27 ? 176 VAL C CB 1 +ATOM 4965 C CG1 . VAL C 1 174 ? 8.054 2.739 12.849 1.00 21.31 ? 176 VAL C CG1 1 +ATOM 4966 C CG2 . VAL C 1 174 ? 9.718 3.709 14.226 1.00 19.59 ? 176 VAL C CG2 1 +ATOM 4967 N N . GLN C 1 175 ? 5.188 4.278 13.390 1.00 16.24 ? 177 GLN C N 1 +ATOM 4968 C CA . GLN C 1 175 ? 3.781 3.879 13.326 1.00 19.10 ? 177 GLN C CA 1 +ATOM 4969 C C . GLN C 1 175 ? 3.744 2.437 12.814 1.00 20.89 ? 177 GLN C C 1 +ATOM 4970 O O . GLN C 1 175 ? 3.965 2.131 11.629 1.00 14.46 ? 177 GLN C O 1 +ATOM 4971 C CB . GLN C 1 175 ? 2.936 4.725 12.322 1.00 21.40 ? 177 GLN C CB 1 +ATOM 4972 C CG . GLN C 1 175 ? 1.479 4.343 12.026 1.00 21.17 ? 177 GLN C CG 1 +ATOM 4973 C CD . GLN C 1 175 ? 0.604 4.440 13.256 1.00 29.35 ? 177 GLN C CD 1 +ATOM 4974 O OE1 . GLN C 1 175 ? 0.181 5.516 13.652 1.00 33.03 ? 177 GLN C OE1 1 +ATOM 4975 N NE2 . GLN C 1 175 ? 0.245 3.330 13.896 1.00 37.19 ? 177 GLN C NE2 1 +ATOM 4976 N N . LEU C 1 176 ? 3.468 1.552 13.763 1.00 19.08 ? 178 LEU C N 1 +ATOM 4977 C CA . LEU C 1 176 ? 3.244 0.160 13.430 1.00 17.96 ? 178 LEU C CA 1 +ATOM 4978 C C . LEU C 1 176 ? 1.856 -0.097 12.811 1.00 18.28 ? 178 LEU C C 1 +ATOM 4979 O O . LEU C 1 176 ? 0.819 0.312 13.320 1.00 16.19 ? 178 LEU C O 1 +ATOM 4980 C CB . LEU C 1 176 ? 3.404 -0.655 14.685 1.00 13.36 ? 178 LEU C CB 1 +ATOM 4981 C CG . LEU C 1 176 ? 4.776 -1.117 15.240 1.00 16.25 ? 178 LEU C CG 1 +ATOM 4982 C CD1 . LEU C 1 176 ? 5.921 -0.752 14.320 1.00 9.12 ? 178 LEU C CD1 1 +ATOM 4983 C CD2 . LEU C 1 176 ? 4.958 -0.521 16.602 1.00 4.72 ? 178 LEU C CD2 1 +ATOM 4984 N N . ALA C 1 177 ? 1.847 -0.661 11.609 1.00 14.01 ? 179 ALA C N 1 +ATOM 4985 C CA . ALA C 1 177 ? 0.658 -1.188 11.013 1.00 8.88 ? 179 ALA C CA 1 +ATOM 4986 C C . ALA C 1 177 ? 0.618 -2.759 11.127 1.00 12.60 ? 179 ALA C C 1 +ATOM 4987 O O . ALA C 1 177 ? 1.123 -3.497 10.256 1.00 9.47 ? 179 ALA C O 1 +ATOM 4988 C CB . ALA C 1 177 ? 0.647 -0.801 9.585 1.00 7.58 ? 179 ALA C CB 1 +ATOM 4989 N N . ASP C 1 178 ? 0.072 -3.327 12.212 1.00 9.95 ? 180 ASP C N 1 +ATOM 4990 C CA . ASP C 1 178 ? -0.173 -4.789 12.292 1.00 21.09 ? 180 ASP C CA 1 +ATOM 4991 C C . ASP C 1 178 ? -0.955 -5.319 11.105 1.00 21.50 ? 180 ASP C C 1 +ATOM 4992 O O . ASP C 1 178 ? -2.076 -4.865 10.863 1.00 27.76 ? 180 ASP C O 1 +ATOM 4993 C CB . ASP C 1 178 ? -0.979 -5.150 13.476 1.00 25.20 ? 180 ASP C CB 1 +ATOM 4994 C CG . ASP C 1 178 ? -0.181 -5.701 14.627 1.00 38.10 ? 180 ASP C CG 1 +ATOM 4995 O OD1 . ASP C 1 178 ? 0.074 -6.903 14.619 1.00 49.34 ? 180 ASP C OD1 1 +ATOM 4996 O OD2 . ASP C 1 178 ? 0.155 -4.949 15.538 1.00 43.46 ? 180 ASP C OD2 1 +ATOM 4997 N N . HIS C 1 179 ? -0.372 -6.177 10.275 1.00 17.77 ? 181 HIS C N 1 +ATOM 4998 C CA . HIS C 1 179 ? -1.061 -6.784 9.152 1.00 17.35 ? 181 HIS C CA 1 +ATOM 4999 C C . HIS C 1 179 ? -1.410 -8.265 9.414 1.00 22.49 ? 181 HIS C C 1 +ATOM 5000 O O . HIS C 1 179 ? -0.576 -9.093 9.811 1.00 24.90 ? 181 HIS C O 1 +ATOM 5001 C CB . HIS C 1 179 ? -0.208 -6.750 7.961 1.00 11.94 ? 181 HIS C CB 1 +ATOM 5002 C CG . HIS C 1 179 ? -0.022 -5.408 7.330 1.00 8.35 ? 181 HIS C CG 1 +ATOM 5003 N ND1 . HIS C 1 179 ? 0.486 -4.281 7.860 1.00 2.42 ? 181 HIS C ND1 1 +ATOM 5004 C CD2 . HIS C 1 179 ? -0.238 -5.260 5.994 1.00 6.13 ? 181 HIS C CD2 1 +ATOM 5005 C CE1 . HIS C 1 179 ? 0.588 -3.487 6.843 1.00 9.25 ? 181 HIS C CE1 1 +ATOM 5006 N NE2 . HIS C 1 179 ? 0.169 -4.050 5.734 1.00 8.51 ? 181 HIS C NE2 1 +ATOM 5007 N N . TYR C 1 180 ? -2.677 -8.610 9.213 1.00 22.16 ? 182 TYR C N 1 +ATOM 5008 C CA . TYR C 1 180 ? -3.144 -9.952 9.465 1.00 20.22 ? 182 TYR C CA 1 +ATOM 5009 C C . TYR C 1 180 ? -3.709 -10.282 8.127 1.00 21.73 ? 182 TYR C C 1 +ATOM 5010 O O . TYR C 1 180 ? -4.737 -9.727 7.753 1.00 31.44 ? 182 TYR C O 1 +ATOM 5011 C CB . TYR C 1 180 ? -4.236 -9.955 10.493 1.00 22.42 ? 182 TYR C CB 1 +ATOM 5012 C CG . TYR C 1 180 ? -3.847 -9.265 11.790 1.00 34.37 ? 182 TYR C CG 1 +ATOM 5013 C CD1 . TYR C 1 180 ? -3.089 -9.941 12.760 1.00 37.61 ? 182 TYR C CD1 1 +ATOM 5014 C CD2 . TYR C 1 180 ? -4.298 -7.954 12.012 1.00 38.31 ? 182 TYR C CD2 1 +ATOM 5015 C CE1 . TYR C 1 180 ? -2.788 -9.299 13.961 1.00 42.59 ? 182 TYR C CE1 1 +ATOM 5016 C CE2 . TYR C 1 180 ? -4.002 -7.316 13.208 1.00 42.95 ? 182 TYR C CE2 1 +ATOM 5017 C CZ . TYR C 1 180 ? -3.254 -7.993 14.172 1.00 46.92 ? 182 TYR C CZ 1 +ATOM 5018 O OH . TYR C 1 180 ? -3.000 -7.342 15.366 1.00 54.01 ? 182 TYR C OH 1 +ATOM 5019 N N . GLN C 1 181 ? -2.991 -11.103 7.375 1.00 17.29 ? 183 GLN C N 1 +ATOM 5020 C CA . GLN C 1 181 ? -3.381 -11.522 6.046 1.00 14.47 ? 183 GLN C CA 1 +ATOM 5021 C C . GLN C 1 181 ? -3.886 -12.976 6.019 1.00 16.57 ? 183 GLN C C 1 +ATOM 5022 O O . GLN C 1 181 ? -3.596 -13.818 6.875 1.00 17.77 ? 183 GLN C O 1 +ATOM 5023 C CB . GLN C 1 181 ? -2.171 -11.326 5.156 1.00 12.43 ? 183 GLN C CB 1 +ATOM 5024 C CG . GLN C 1 181 ? -2.304 -11.769 3.717 1.00 10.29 ? 183 GLN C CG 1 +ATOM 5025 C CD . GLN C 1 181 ? -1.000 -11.625 2.965 1.00 19.42 ? 183 GLN C CD 1 +ATOM 5026 O OE1 . GLN C 1 181 ? -0.073 -11.047 3.508 1.00 21.33 ? 183 GLN C OE1 1 +ATOM 5027 N NE2 . GLN C 1 181 ? -0.829 -12.030 1.712 1.00 20.73 ? 183 GLN C NE2 1 +ATOM 5028 N N . GLN C 1 182 ? -4.615 -13.281 4.960 1.00 21.12 ? 184 GLN C N 1 +ATOM 5029 C CA . GLN C 1 182 ? -5.252 -14.572 4.724 1.00 25.12 ? 184 GLN C CA 1 +ATOM 5030 C C . GLN C 1 182 ? -5.584 -14.610 3.250 1.00 25.00 ? 184 GLN C C 1 +ATOM 5031 O O . GLN C 1 182 ? -6.242 -13.747 2.676 1.00 31.21 ? 184 GLN C O 1 +ATOM 5032 C CB . GLN C 1 182 ? -6.483 -14.679 5.658 1.00 24.42 ? 184 GLN C CB 1 +ATOM 5033 C CG . GLN C 1 182 ? -7.830 -15.218 5.180 1.00 35.37 ? 184 GLN C CG 1 +ATOM 5034 C CD . GLN C 1 182 ? -8.987 -14.874 6.134 1.00 41.59 ? 184 GLN C CD 1 +ATOM 5035 O OE1 . GLN C 1 182 ? -8.898 -15.124 7.340 1.00 43.14 ? 184 GLN C OE1 1 +ATOM 5036 N NE2 . GLN C 1 182 ? -10.115 -14.319 5.672 1.00 38.96 ? 184 GLN C NE2 1 +ATOM 5037 N N . ASN C 1 183 ? -4.963 -15.563 2.581 1.00 25.38 ? 185 ASN C N 1 +ATOM 5038 C CA . ASN C 1 183 ? -5.220 -15.805 1.176 1.00 24.68 ? 185 ASN C CA 1 +ATOM 5039 C C . ASN C 1 183 ? -5.902 -17.159 0.995 1.00 24.28 ? 185 ASN C C 1 +ATOM 5040 O O . ASN C 1 183 ? -5.571 -18.147 1.651 1.00 23.24 ? 185 ASN C O 1 +ATOM 5041 C CB . ASN C 1 183 ? -3.948 -15.844 0.384 1.00 23.91 ? 185 ASN C CB 1 +ATOM 5042 C CG . ASN C 1 183 ? -3.204 -14.541 0.318 1.00 19.36 ? 185 ASN C CG 1 +ATOM 5043 O OD1 . ASN C 1 183 ? -2.920 -13.945 1.345 1.00 17.97 ? 185 ASN C OD1 1 +ATOM 5044 N ND2 . ASN C 1 183 ? -2.882 -14.075 -0.861 1.00 13.56 ? 185 ASN C ND2 1 +ATOM 5045 N N . THR C 1 184 ? -6.910 -17.180 0.133 1.00 21.77 ? 186 THR C N 1 +ATOM 5046 C CA . THR C 1 184 ? -7.631 -18.378 -0.195 1.00 24.71 ? 186 THR C CA 1 +ATOM 5047 C C . THR C 1 184 ? -7.625 -18.391 -1.727 1.00 25.03 ? 186 THR C C 1 +ATOM 5048 O O . THR C 1 184 ? -7.723 -17.306 -2.295 1.00 15.97 ? 186 THR C O 1 +ATOM 5049 C CB . THR C 1 184 ? -9.076 -18.297 0.402 1.00 31.50 ? 186 THR C CB 1 +ATOM 5050 O OG1 . THR C 1 184 ? -9.810 -17.329 -0.349 1.00 36.84 ? 186 THR C OG1 1 +ATOM 5051 C CG2 . THR C 1 184 ? -9.098 -17.878 1.878 1.00 31.74 ? 186 THR C CG2 1 +ATOM 5052 N N . PRO C 1 185 ? -7.463 -19.497 -2.483 1.00 24.28 ? 187 PRO C N 1 +ATOM 5053 C CA . PRO C 1 185 ? -7.594 -19.488 -3.940 1.00 26.34 ? 187 PRO C CA 1 +ATOM 5054 C C . PRO C 1 185 ? -9.030 -19.261 -4.420 1.00 28.43 ? 187 PRO C C 1 +ATOM 5055 O O . PRO C 1 185 ? -10.012 -19.450 -3.715 1.00 26.79 ? 187 PRO C O 1 +ATOM 5056 C CB . PRO C 1 185 ? -6.991 -20.822 -4.389 1.00 28.14 ? 187 PRO C CB 1 +ATOM 5057 C CG . PRO C 1 185 ? -7.216 -21.703 -3.178 1.00 32.47 ? 187 PRO C CG 1 +ATOM 5058 C CD . PRO C 1 185 ? -6.939 -20.764 -2.004 1.00 27.64 ? 187 PRO C CD 1 +ATOM 5059 N N . ILE C 1 186 ? -9.166 -18.788 -5.646 1.00 29.48 ? 188 ILE C N 1 +ATOM 5060 C CA . ILE C 1 186 ? -10.416 -18.432 -6.315 1.00 29.78 ? 188 ILE C CA 1 +ATOM 5061 C C . ILE C 1 186 ? -10.963 -19.627 -7.094 1.00 29.25 ? 188 ILE C C 1 +ATOM 5062 O O . ILE C 1 186 ? -12.178 -19.844 -7.131 1.00 33.60 ? 188 ILE C O 1 +ATOM 5063 C CB . ILE C 1 186 ? -10.119 -17.211 -7.263 1.00 20.05 ? 188 ILE C CB 1 +ATOM 5064 C CG1 . ILE C 1 186 ? -10.175 -15.927 -6.476 1.00 17.51 ? 188 ILE C CG1 1 +ATOM 5065 C CG2 . ILE C 1 186 ? -11.098 -17.128 -8.402 1.00 25.87 ? 188 ILE C CG2 1 +ATOM 5066 C CD1 . ILE C 1 186 ? -9.647 -14.746 -7.363 1.00 2.00 ? 188 ILE C CD1 1 +ATOM 5067 N N . GLY C 1 187 ? -10.058 -20.321 -7.782 1.00 27.51 ? 189 GLY C N 1 +ATOM 5068 C CA . GLY C 1 187 ? -10.379 -21.465 -8.624 1.00 30.70 ? 189 GLY C CA 1 +ATOM 5069 C C . GLY C 1 187 ? -10.442 -22.744 -7.815 1.00 33.54 ? 189 GLY C C 1 +ATOM 5070 O O . GLY C 1 187 ? -9.938 -22.811 -6.692 1.00 29.82 ? 189 GLY C O 1 +ATOM 5071 N N . ASP C 1 188 ? -11.102 -23.751 -8.418 1.00 38.96 ? 190 ASP C N 1 +ATOM 5072 C CA . ASP C 1 188 ? -11.326 -25.096 -7.862 1.00 34.66 ? 190 ASP C CA 1 +ATOM 5073 C C . ASP C 1 188 ? -9.991 -25.804 -7.601 1.00 33.50 ? 190 ASP C C 1 +ATOM 5074 O O . ASP C 1 188 ? -9.788 -26.463 -6.575 1.00 31.57 ? 190 ASP C O 1 +ATOM 5075 C CB . ASP C 1 188 ? -12.216 -25.892 -8.869 1.00 36.73 ? 190 ASP C CB 1 +ATOM 5076 C CG . ASP C 1 188 ? -11.802 -25.914 -10.379 1.00 42.18 ? 190 ASP C CG 1 +ATOM 5077 O OD1 . ASP C 1 188 ? -10.626 -26.100 -10.711 1.00 46.21 ? 190 ASP C OD1 1 +ATOM 5078 O OD2 . ASP C 1 188 ? -12.657 -25.781 -11.261 1.00 36.17 ? 190 ASP C OD2 1 +ATOM 5079 N N . GLY C 1 189 ? -9.075 -25.575 -8.557 1.00 28.89 ? 191 GLY C N 1 +ATOM 5080 C CA . GLY C 1 189 ? -7.727 -26.125 -8.698 1.00 26.27 ? 191 GLY C CA 1 +ATOM 5081 C C . GLY C 1 189 ? -6.967 -26.372 -7.393 1.00 29.31 ? 191 GLY C C 1 +ATOM 5082 O O . GLY C 1 189 ? -7.207 -25.693 -6.372 1.00 29.10 ? 191 GLY C O 1 +ATOM 5083 N N . PRO C 1 190 ? -6.057 -27.385 -7.394 1.00 24.98 ? 192 PRO C N 1 +ATOM 5084 C CA . PRO C 1 190 ? -5.180 -27.705 -6.280 1.00 18.11 ? 192 PRO C CA 1 +ATOM 5085 C C . PRO C 1 190 ? -4.117 -26.645 -6.078 1.00 15.91 ? 192 PRO C C 1 +ATOM 5086 O O . PRO C 1 190 ? -3.559 -26.177 -7.072 1.00 15.07 ? 192 PRO C O 1 +ATOM 5087 C CB . PRO C 1 190 ? -4.571 -29.056 -6.614 1.00 17.18 ? 192 PRO C CB 1 +ATOM 5088 C CG . PRO C 1 190 ? -5.077 -29.421 -7.986 1.00 24.41 ? 192 PRO C CG 1 +ATOM 5089 C CD . PRO C 1 190 ? -5.620 -28.129 -8.575 1.00 26.68 ? 192 PRO C CD 1 +ATOM 5090 N N . VAL C 1 191 ? -3.857 -26.270 -4.810 1.00 13.06 ? 193 VAL C N 1 +ATOM 5091 C CA . VAL C 1 191 ? -2.765 -25.368 -4.533 1.00 18.01 ? 193 VAL C CA 1 +ATOM 5092 C C . VAL C 1 191 ? -1.685 -26.007 -3.656 1.00 25.69 ? 193 VAL C C 1 +ATOM 5093 O O . VAL C 1 191 ? -1.922 -26.995 -2.949 1.00 27.54 ? 193 VAL C O 1 +ATOM 5094 C CB . VAL C 1 191 ? -3.188 -23.996 -3.814 1.00 12.08 ? 193 VAL C CB 1 +ATOM 5095 C CG1 . VAL C 1 191 ? -4.180 -23.344 -4.719 1.00 5.76 ? 193 VAL C CG1 1 +ATOM 5096 C CG2 . VAL C 1 191 ? -3.637 -24.164 -2.362 1.00 9.02 ? 193 VAL C CG2 1 +ATOM 5097 N N . LEU C 1 192 ? -0.481 -25.400 -3.736 1.00 26.65 ? 194 LEU C N 1 +ATOM 5098 C CA . LEU C 1 192 ? 0.673 -25.748 -2.920 1.00 24.17 ? 194 LEU C CA 1 +ATOM 5099 C C . LEU C 1 192 ? 0.519 -25.023 -1.622 1.00 24.42 ? 194 LEU C C 1 +ATOM 5100 O O . LEU C 1 192 ? 0.396 -23.810 -1.670 1.00 27.79 ? 194 LEU C O 1 +ATOM 5101 C CB . LEU C 1 192 ? 1.956 -25.282 -3.571 1.00 32.50 ? 194 LEU C CB 1 +ATOM 5102 C CG . LEU C 1 192 ? 2.355 -26.033 -4.829 1.00 35.77 ? 194 LEU C CG 1 +ATOM 5103 C CD1 . LEU C 1 192 ? 3.442 -25.295 -5.600 1.00 30.98 ? 194 LEU C CD1 1 +ATOM 5104 C CD2 . LEU C 1 192 ? 2.774 -27.436 -4.390 1.00 41.33 ? 194 LEU C CD2 1 +ATOM 5105 N N . LEU C 1 193 ? 0.461 -25.679 -0.479 1.00 24.22 ? 195 LEU C N 1 +ATOM 5106 C CA . LEU C 1 193 ? 0.328 -25.002 0.791 1.00 25.17 ? 195 LEU C CA 1 +ATOM 5107 C C . LEU C 1 193 ? 1.616 -25.158 1.600 1.00 33.03 ? 195 LEU C C 1 +ATOM 5108 O O . LEU C 1 193 ? 2.196 -26.246 1.696 1.00 39.89 ? 195 LEU C O 1 +ATOM 5109 C CB . LEU C 1 193 ? -0.785 -25.592 1.605 1.00 25.88 ? 195 LEU C CB 1 +ATOM 5110 C CG . LEU C 1 193 ? -2.188 -25.600 1.123 1.00 26.41 ? 195 LEU C CG 1 +ATOM 5111 C CD1 . LEU C 1 193 ? -3.032 -26.422 2.067 1.00 31.36 ? 195 LEU C CD1 1 +ATOM 5112 C CD2 . LEU C 1 193 ? -2.688 -24.189 1.047 1.00 31.48 ? 195 LEU C CD2 1 +ATOM 5113 N N . PRO C 1 194 ? 2.106 -24.100 2.233 1.00 33.67 ? 196 PRO C N 1 +ATOM 5114 C CA . PRO C 1 194 ? 3.488 -24.048 2.706 1.00 28.62 ? 196 PRO C CA 1 +ATOM 5115 C C . PRO C 1 194 ? 3.871 -24.303 4.153 1.00 29.47 ? 196 PRO C C 1 +ATOM 5116 O O . PRO C 1 194 ? 3.105 -24.165 5.128 1.00 28.78 ? 196 PRO C O 1 +ATOM 5117 C CB . PRO C 1 194 ? 3.901 -22.677 2.215 1.00 31.38 ? 196 PRO C CB 1 +ATOM 5118 C CG . PRO C 1 194 ? 2.675 -21.857 2.549 1.00 30.42 ? 196 PRO C CG 1 +ATOM 5119 C CD . PRO C 1 194 ? 1.529 -22.746 2.095 1.00 27.47 ? 196 PRO C CD 1 +ATOM 5120 N N . ASP C 1 195 ? 5.156 -24.678 4.293 1.00 28.97 ? 197 ASP C N 1 +ATOM 5121 C CA . ASP C 1 195 ? 5.707 -24.739 5.639 1.00 22.32 ? 197 ASP C CA 1 +ATOM 5122 C C . ASP C 1 195 ? 6.061 -23.269 5.955 1.00 17.67 ? 197 ASP C C 1 +ATOM 5123 O O . ASP C 1 195 ? 6.191 -22.448 5.043 1.00 8.90 ? 197 ASP C O 1 +ATOM 5124 C CB . ASP C 1 195 ? 6.966 -25.610 5.692 1.00 32.52 ? 197 ASP C CB 1 +ATOM 5125 C CG . ASP C 1 195 ? 6.885 -27.092 5.260 1.00 42.77 ? 197 ASP C CG 1 +ATOM 5126 O OD1 . ASP C 1 195 ? 5.793 -27.664 5.193 1.00 41.51 ? 197 ASP C OD1 1 +ATOM 5127 O OD2 . ASP C 1 195 ? 7.940 -27.683 4.979 1.00 44.02 ? 197 ASP C OD2 1 +ATOM 5128 N N . ASN C 1 196 ? 6.066 -22.914 7.242 1.00 10.56 ? 198 ASN C N 1 +ATOM 5129 C CA . ASN C 1 196 ? 6.454 -21.638 7.750 1.00 12.32 ? 198 ASN C CA 1 +ATOM 5130 C C . ASN C 1 196 ? 7.731 -21.125 7.150 1.00 17.71 ? 198 ASN C C 1 +ATOM 5131 O O . ASN C 1 196 ? 8.825 -21.676 7.306 1.00 21.06 ? 198 ASN C O 1 +ATOM 5132 C CB . ASN C 1 196 ? 6.622 -21.744 9.242 1.00 12.20 ? 198 ASN C CB 1 +ATOM 5133 C CG . ASN C 1 196 ? 5.275 -21.953 9.874 1.00 16.27 ? 198 ASN C CG 1 +ATOM 5134 O OD1 . ASN C 1 196 ? 4.283 -22.124 9.166 1.00 16.40 ? 198 ASN C OD1 1 +ATOM 5135 N ND2 . ASN C 1 196 ? 5.207 -21.910 11.202 1.00 21.19 ? 198 ASN C ND2 1 +ATOM 5136 N N . HIS C 1 197 ? 7.473 -20.152 6.297 1.00 19.95 ? 199 HIS C N 1 +ATOM 5137 C CA . HIS C 1 197 ? 8.536 -19.367 5.745 1.00 21.16 ? 199 HIS C CA 1 +ATOM 5138 C C . HIS C 1 197 ? 8.128 -17.896 5.849 1.00 25.08 ? 199 HIS C C 1 +ATOM 5139 O O . HIS C 1 197 ? 7.229 -17.502 6.595 1.00 28.62 ? 199 HIS C O 1 +ATOM 5140 C CB . HIS C 1 197 ? 8.776 -19.808 4.322 1.00 14.72 ? 199 HIS C CB 1 +ATOM 5141 C CG . HIS C 1 197 ? 7.661 -19.564 3.331 1.00 18.93 ? 199 HIS C CG 1 +ATOM 5142 N ND1 . HIS C 1 197 ? 6.370 -19.846 3.441 1.00 6.17 ? 199 HIS C ND1 1 +ATOM 5143 C CD2 . HIS C 1 197 ? 7.899 -18.988 2.096 1.00 19.41 ? 199 HIS C CD2 1 +ATOM 5144 C CE1 . HIS C 1 197 ? 5.850 -19.455 2.297 1.00 15.28 ? 199 HIS C CE1 1 +ATOM 5145 N NE2 . HIS C 1 197 ? 6.756 -18.938 1.486 1.00 12.09 ? 199 HIS C NE2 1 +ATOM 5146 N N . TYR C 1 198 ? 8.864 -17.049 5.155 1.00 26.36 ? 200 TYR C N 1 +ATOM 5147 C CA . TYR C 1 198 ? 8.580 -15.636 5.150 1.00 24.30 ? 200 TYR C CA 1 +ATOM 5148 C C . TYR C 1 198 ? 9.043 -15.134 3.837 1.00 19.39 ? 200 TYR C C 1 +ATOM 5149 O O . TYR C 1 198 ? 9.768 -15.800 3.097 1.00 16.47 ? 200 TYR C O 1 +ATOM 5150 C CB . TYR C 1 198 ? 9.288 -14.883 6.309 1.00 31.34 ? 200 TYR C CB 1 +ATOM 5151 C CG . TYR C 1 198 ? 10.797 -14.854 6.381 1.00 36.43 ? 200 TYR C CG 1 +ATOM 5152 C CD1 . TYR C 1 198 ? 11.517 -13.893 5.667 1.00 40.91 ? 200 TYR C CD1 1 +ATOM 5153 C CD2 . TYR C 1 198 ? 11.466 -15.766 7.193 1.00 42.89 ? 200 TYR C CD2 1 +ATOM 5154 C CE1 . TYR C 1 198 ? 12.908 -13.835 5.762 1.00 45.14 ? 200 TYR C CE1 1 +ATOM 5155 C CE2 . TYR C 1 198 ? 12.866 -15.714 7.298 1.00 48.08 ? 200 TYR C CE2 1 +ATOM 5156 C CZ . TYR C 1 198 ? 13.585 -14.749 6.581 1.00 49.25 ? 200 TYR C CZ 1 +ATOM 5157 O OH . TYR C 1 198 ? 14.965 -14.688 6.696 1.00 43.40 ? 200 TYR C OH 1 +ATOM 5158 N N . LEU C 1 199 ? 8.433 -14.002 3.534 1.00 15.43 ? 201 LEU C N 1 +ATOM 5159 C CA . LEU C 1 199 ? 8.807 -13.290 2.321 1.00 18.34 ? 201 LEU C CA 1 +ATOM 5160 C C . LEU C 1 199 ? 9.576 -12.074 2.812 1.00 19.89 ? 201 LEU C C 1 +ATOM 5161 O O . LEU C 1 199 ? 9.083 -11.229 3.571 1.00 19.29 ? 201 LEU C O 1 +ATOM 5162 C CB . LEU C 1 199 ? 7.608 -12.800 1.560 1.00 20.99 ? 201 LEU C CB 1 +ATOM 5163 C CG . LEU C 1 199 ? 6.556 -13.748 1.022 1.00 19.16 ? 201 LEU C CG 1 +ATOM 5164 C CD1 . LEU C 1 199 ? 5.479 -12.919 0.369 1.00 15.27 ? 201 LEU C CD1 1 +ATOM 5165 C CD2 . LEU C 1 199 ? 7.121 -14.676 -0.030 1.00 14.79 ? 201 LEU C CD2 1 +ATOM 5166 N N . SER C 1 200 ? 10.859 -12.037 2.449 1.00 23.29 ? 202 SER C N 1 +ATOM 5167 C CA . SER C 1 200 ? 11.728 -10.929 2.818 1.00 24.17 ? 202 SER C CA 1 +ATOM 5168 C C . SER C 1 200 ? 11.374 -9.845 1.813 1.00 20.25 ? 202 SER C C 1 +ATOM 5169 O O . SER C 1 200 ? 11.596 -9.909 0.596 1.00 14.83 ? 202 SER C O 1 +ATOM 5170 C CB . SER C 1 200 ? 13.213 -11.311 2.699 1.00 27.45 ? 202 SER C CB 1 +ATOM 5171 O OG . SER C 1 200 ? 14.107 -10.195 2.786 1.00 27.01 ? 202 SER C OG 1 +ATOM 5172 N N . THR C 1 201 ? 10.774 -8.813 2.387 1.00 15.76 ? 203 THR C N 1 +ATOM 5173 C CA . THR C 1 201 ? 10.369 -7.758 1.496 1.00 17.81 ? 203 THR C CA 1 +ATOM 5174 C C . THR C 1 201 ? 11.075 -6.441 1.770 1.00 15.41 ? 203 THR C C 1 +ATOM 5175 O O . THR C 1 201 ? 11.314 -5.956 2.899 1.00 5.89 ? 203 THR C O 1 +ATOM 5176 C CB . THR C 1 201 ? 8.891 -7.584 1.614 1.00 12.96 ? 203 THR C CB 1 +ATOM 5177 O OG1 . THR C 1 201 ? 8.286 -8.847 1.851 1.00 23.19 ? 203 THR C OG1 1 +ATOM 5178 C CG2 . THR C 1 201 ? 8.397 -6.981 0.330 1.00 7.06 ? 203 THR C CG2 1 +ATOM 5179 N N . GLN C 1 202 ? 11.361 -5.898 0.600 1.00 10.38 ? 204 GLN C N 1 +ATOM 5180 C CA . GLN C 1 202 ? 12.003 -4.604 0.558 1.00 20.62 ? 204 GLN C CA 1 +ATOM 5181 C C . GLN C 1 202 ? 11.351 -3.775 -0.491 1.00 17.55 ? 204 GLN C C 1 +ATOM 5182 O O . GLN C 1 202 ? 11.172 -4.268 -1.607 1.00 13.32 ? 204 GLN C O 1 +ATOM 5183 C CB . GLN C 1 202 ? 13.493 -4.692 0.188 1.00 22.88 ? 204 GLN C CB 1 +ATOM 5184 C CG . GLN C 1 202 ? 14.352 -5.084 1.330 1.00 21.29 ? 204 GLN C CG 1 +ATOM 5185 C CD . GLN C 1 202 ? 15.684 -5.440 0.728 1.00 31.44 ? 204 GLN C CD 1 +ATOM 5186 O OE1 . GLN C 1 202 ? 16.664 -4.761 1.007 1.00 30.53 ? 204 GLN C OE1 1 +ATOM 5187 N NE2 . GLN C 1 202 ? 15.776 -6.526 -0.050 1.00 34.01 ? 204 GLN C NE2 1 +ATOM 5188 N N . SER C 1 203 ? 11.144 -2.498 -0.111 1.00 23.17 ? 205 SER C N 1 +ATOM 5189 C CA . SER C 1 203 ? 10.508 -1.526 -0.999 1.00 23.23 ? 205 SER C CA 1 +ATOM 5190 C C . SER C 1 203 ? 11.102 -0.123 -0.863 1.00 21.56 ? 205 SER C C 1 +ATOM 5191 O O . SER C 1 203 ? 11.622 0.325 0.153 1.00 22.21 ? 205 SER C O 1 +ATOM 5192 C CB . SER C 1 203 ? 9.028 -1.431 -0.700 1.00 26.44 ? 205 SER C CB 1 +ATOM 5193 O OG . SER C 1 203 ? 8.422 -2.611 -0.192 1.00 25.90 ? 205 SER C OG 1 +ATOM 5194 N N . ALA C 1 204 ? 11.032 0.569 -1.984 1.00 22.06 ? 206 ALA C N 1 +ATOM 5195 C CA . ALA C 1 204 ? 11.514 1.925 -2.101 1.00 22.40 ? 206 ALA C CA 1 +ATOM 5196 C C . ALA C 1 204 ? 10.533 2.765 -2.937 1.00 18.58 ? 206 ALA C C 1 +ATOM 5197 O O . ALA C 1 204 ? 10.251 2.577 -4.136 1.00 14.22 ? 206 ALA C O 1 +ATOM 5198 C CB . ALA C 1 204 ? 12.884 1.936 -2.753 1.00 16.56 ? 206 ALA C CB 1 +ATOM 5199 N N . LEU C 1 205 ? 9.986 3.730 -2.192 1.00 18.72 ? 207 LEU C N 1 +ATOM 5200 C CA . LEU C 1 205 ? 8.992 4.652 -2.745 1.00 19.93 ? 207 LEU C CA 1 +ATOM 5201 C C . LEU C 1 205 ? 9.624 5.881 -3.363 1.00 17.44 ? 207 LEU C C 1 +ATOM 5202 O O . LEU C 1 205 ? 10.400 6.593 -2.741 1.00 18.62 ? 207 LEU C O 1 +ATOM 5203 C CB . LEU C 1 205 ? 8.066 5.142 -1.696 1.00 19.71 ? 207 LEU C CB 1 +ATOM 5204 C CG . LEU C 1 205 ? 7.485 4.203 -0.702 1.00 19.29 ? 207 LEU C CG 1 +ATOM 5205 C CD1 . LEU C 1 205 ? 6.514 4.972 0.178 1.00 10.68 ? 207 LEU C CD1 1 +ATOM 5206 C CD2 . LEU C 1 205 ? 6.826 3.079 -1.404 1.00 7.05 ? 207 LEU C CD2 1 +ATOM 5207 N N . SER C 1 206 ? 9.251 6.079 -4.612 1.00 9.35 ? 208 SER C N 1 +ATOM 5208 C CA . SER C 1 206 ? 9.720 7.157 -5.375 1.00 5.30 ? 208 SER C CA 1 +ATOM 5209 C C . SER C 1 206 ? 8.565 7.997 -5.990 1.00 16.43 ? 208 SER C C 1 +ATOM 5210 O O . SER C 1 206 ? 7.374 7.774 -5.793 1.00 17.83 ? 208 SER C O 1 +ATOM 5211 C CB . SER C 1 206 ? 10.576 6.474 -6.298 1.00 2.00 ? 208 SER C CB 1 +ATOM 5212 O OG . SER C 1 206 ? 10.268 6.525 -7.687 1.00 7.62 ? 208 SER C OG 1 +ATOM 5213 N N . LYS C 1 207 ? 8.874 9.035 -6.756 1.00 12.96 ? 209 LYS C N 1 +ATOM 5214 C CA . LYS C 1 207 ? 7.905 9.887 -7.381 1.00 12.53 ? 209 LYS C CA 1 +ATOM 5215 C C . LYS C 1 207 ? 8.299 9.964 -8.807 1.00 13.44 ? 209 LYS C C 1 +ATOM 5216 O O . LYS C 1 207 ? 9.487 9.879 -9.053 1.00 19.25 ? 209 LYS C O 1 +ATOM 5217 C CB . LYS C 1 207 ? 7.960 11.272 -6.786 1.00 9.51 ? 209 LYS C CB 1 +ATOM 5218 C CG . LYS C 1 207 ? 7.339 11.364 -5.391 1.00 2.00 ? 209 LYS C CG 1 +ATOM 5219 C CD . LYS C 1 207 ? 5.822 11.201 -5.501 1.00 2.12 ? 209 LYS C CD 1 +ATOM 5220 C CE . LYS C 1 207 ? 5.394 11.371 -4.051 1.00 9.64 ? 209 LYS C CE 1 +ATOM 5221 N NZ . LYS C 1 207 ? 4.006 11.013 -3.945 1.00 15.49 ? 209 LYS C NZ 1 +ATOM 5222 N N . ASP C 1 208 ? 7.380 10.022 -9.769 1.00 21.10 ? 210 ASP C N 1 +ATOM 5223 C CA . ASP C 1 208 ? 7.727 10.360 -11.153 1.00 25.85 ? 210 ASP C CA 1 +ATOM 5224 C C . ASP C 1 208 ? 7.748 11.907 -11.109 1.00 27.05 ? 210 ASP C C 1 +ATOM 5225 O O . ASP C 1 208 ? 6.725 12.498 -10.760 1.00 24.89 ? 210 ASP C O 1 +ATOM 5226 C CB . ASP C 1 208 ? 6.634 9.816 -12.063 1.00 23.48 ? 210 ASP C CB 1 +ATOM 5227 C CG . ASP C 1 208 ? 6.805 9.919 -13.564 1.00 27.78 ? 210 ASP C CG 1 +ATOM 5228 O OD1 . ASP C 1 208 ? 7.729 10.586 -14.033 1.00 31.74 ? 210 ASP C OD1 1 +ATOM 5229 O OD2 . ASP C 1 208 ? 6.001 9.296 -14.266 1.00 23.67 ? 210 ASP C OD2 1 +ATOM 5230 N N . PRO C 1 209 ? 8.875 12.617 -11.327 1.00 27.43 ? 211 PRO C N 1 +ATOM 5231 C CA . PRO C 1 209 ? 8.922 14.078 -11.306 1.00 31.56 ? 211 PRO C CA 1 +ATOM 5232 C C . PRO C 1 209 ? 8.210 14.673 -12.520 1.00 33.76 ? 211 PRO C C 1 +ATOM 5233 O O . PRO C 1 209 ? 7.943 15.868 -12.548 1.00 30.75 ? 211 PRO C O 1 +ATOM 5234 C CB . PRO C 1 209 ? 10.406 14.403 -11.228 1.00 29.06 ? 211 PRO C CB 1 +ATOM 5235 C CG . PRO C 1 209 ? 11.034 13.245 -11.943 1.00 29.29 ? 211 PRO C CG 1 +ATOM 5236 C CD . PRO C 1 209 ? 10.236 12.082 -11.398 1.00 27.65 ? 211 PRO C CD 1 +ATOM 5237 N N . ASN C 1 210 ? 7.852 13.831 -13.507 1.00 31.25 ? 212 ASN C N 1 +ATOM 5238 C CA . ASN C 1 210 ? 7.102 14.276 -14.674 1.00 30.22 ? 212 ASN C CA 1 +ATOM 5239 C C . ASN C 1 210 ? 5.609 13.987 -14.581 1.00 28.20 ? 212 ASN C C 1 +ATOM 5240 O O . ASN C 1 210 ? 4.891 14.075 -15.577 1.00 24.33 ? 212 ASN C O 1 +ATOM 5241 C CB . ASN C 1 210 ? 7.633 13.596 -15.908 1.00 29.81 ? 212 ASN C CB 1 +ATOM 5242 C CG . ASN C 1 210 ? 9.059 14.039 -16.189 1.00 32.47 ? 212 ASN C CG 1 +ATOM 5243 O OD1 . ASN C 1 210 ? 9.911 13.224 -16.532 1.00 31.52 ? 212 ASN C OD1 1 +ATOM 5244 N ND2 . ASN C 1 210 ? 9.349 15.330 -16.035 1.00 26.40 ? 212 ASN C ND2 1 +ATOM 5245 N N . GLU C 1 211 ? 5.182 13.637 -13.358 1.00 21.97 ? 213 GLU C N 1 +ATOM 5246 C CA . GLU C 1 211 ? 3.840 13.263 -13.038 1.00 19.33 ? 213 GLU C CA 1 +ATOM 5247 C C . GLU C 1 211 ? 3.119 14.253 -12.141 1.00 19.34 ? 213 GLU C C 1 +ATOM 5248 O O . GLU C 1 211 ? 3.493 14.453 -10.979 1.00 18.26 ? 213 GLU C O 1 +ATOM 5249 C CB . GLU C 1 211 ? 3.887 11.921 -12.380 1.00 20.67 ? 213 GLU C CB 1 +ATOM 5250 C CG . GLU C 1 211 ? 2.585 11.274 -11.951 1.00 22.79 ? 213 GLU C CG 1 +ATOM 5251 C CD . GLU C 1 211 ? 1.586 11.131 -13.057 1.00 18.73 ? 213 GLU C CD 1 +ATOM 5252 O OE1 . GLU C 1 211 ? 1.875 10.765 -14.192 1.00 25.78 ? 213 GLU C OE1 1 +ATOM 5253 O OE2 . GLU C 1 211 ? 0.477 11.472 -12.770 1.00 25.85 ? 213 GLU C OE2 1 +ATOM 5254 N N . LYS C 1 212 ? 2.032 14.853 -12.657 1.00 15.93 ? 214 LYS C N 1 +ATOM 5255 C CA . LYS C 1 212 ? 1.333 15.818 -11.825 1.00 16.69 ? 214 LYS C CA 1 +ATOM 5256 C C . LYS C 1 212 ? 0.322 15.227 -10.861 1.00 13.55 ? 214 LYS C C 1 +ATOM 5257 O O . LYS C 1 212 ? 0.085 15.790 -9.785 1.00 17.04 ? 214 LYS C O 1 +ATOM 5258 C CB . LYS C 1 212 ? 0.677 16.843 -12.724 1.00 22.08 ? 214 LYS C CB 1 +ATOM 5259 C CG . LYS C 1 212 ? 1.565 17.980 -13.283 1.00 21.32 ? 214 LYS C CG 1 +ATOM 5260 C CD . LYS C 1 212 ? 2.262 17.680 -14.595 1.00 19.77 ? 214 LYS C CD 1 +ATOM 5261 C CE . LYS C 1 212 ? 1.811 18.597 -15.715 1.00 23.65 ? 214 LYS C CE 1 +ATOM 5262 N NZ . LYS C 1 212 ? 2.013 20.006 -15.465 1.00 21.92 ? 214 LYS C NZ 1 +ATOM 5263 N N . ARG C 1 213 ? -0.222 14.019 -11.146 1.00 19.29 ? 215 ARG C N 1 +ATOM 5264 C CA . ARG C 1 213 ? -1.251 13.350 -10.314 1.00 9.33 ? 215 ARG C CA 1 +ATOM 5265 C C . ARG C 1 213 ? -0.687 12.853 -9.025 1.00 5.86 ? 215 ARG C C 1 +ATOM 5266 O O . ARG C 1 213 ? 0.515 12.699 -8.982 1.00 8.57 ? 215 ARG C O 1 +ATOM 5267 C CB . ARG C 1 213 ? -1.881 12.186 -11.101 1.00 13.82 ? 215 ARG C CB 1 +ATOM 5268 C CG . ARG C 1 213 ? -2.745 12.738 -12.235 1.00 18.33 ? 215 ARG C CG 1 +ATOM 5269 C CD . ARG C 1 213 ? -3.194 11.821 -13.355 1.00 25.94 ? 215 ARG C CD 1 +ATOM 5270 N NE . ARG C 1 213 ? -2.185 11.334 -14.207 1.00 41.28 ? 215 ARG C NE 1 +ATOM 5271 C CZ . ARG C 1 213 ? -1.766 10.211 -14.826 1.00 57.63 ? 215 ARG C CZ 1 +ATOM 5272 N NH1 . ARG C 1 213 ? -2.263 8.962 -14.795 1.00 58.61 ? 215 ARG C NH1 1 +ATOM 5273 N NH2 . ARG C 1 213 ? -0.673 10.448 -15.562 1.00 60.63 ? 215 ARG C NH2 1 +ATOM 5274 N N . ASP C 1 214 ? -1.445 12.677 -7.925 1.00 5.91 ? 216 ASP C N 1 +ATOM 5275 C CA . ASP C 1 214 ? -0.912 12.145 -6.679 1.00 8.22 ? 216 ASP C CA 1 +ATOM 5276 C C . ASP C 1 214 ? -0.621 10.687 -7.087 1.00 22.62 ? 216 ASP C C 1 +ATOM 5277 O O . ASP C 1 214 ? -1.426 9.969 -7.717 1.00 15.39 ? 216 ASP C O 1 +ATOM 5278 C CB . ASP C 1 214 ? -1.940 12.163 -5.572 1.00 2.00 ? 216 ASP C CB 1 +ATOM 5279 C CG . ASP C 1 214 ? -1.390 12.087 -4.183 1.00 4.48 ? 216 ASP C CG 1 +ATOM 5280 O OD1 . ASP C 1 214 ? -0.177 12.120 -3.952 1.00 22.50 ? 216 ASP C OD1 1 +ATOM 5281 O OD2 . ASP C 1 214 ? -2.161 12.028 -3.244 1.00 8.26 ? 216 ASP C OD2 1 +ATOM 5282 N N . HIS C 1 215 ? 0.634 10.294 -6.831 1.00 26.86 ? 217 HIS C N 1 +ATOM 5283 C CA . HIS C 1 215 ? 1.092 9.006 -7.260 1.00 21.26 ? 217 HIS C CA 1 +ATOM 5284 C C . HIS C 1 215 ? 2.137 8.441 -6.343 1.00 21.69 ? 217 HIS C C 1 +ATOM 5285 O O . HIS C 1 215 ? 2.500 9.030 -5.326 1.00 22.22 ? 217 HIS C O 1 +ATOM 5286 C CB . HIS C 1 215 ? 1.612 9.142 -8.665 1.00 25.89 ? 217 HIS C CB 1 +ATOM 5287 C CG . HIS C 1 215 ? 2.854 9.974 -8.723 1.00 32.84 ? 217 HIS C CG 1 +ATOM 5288 N ND1 . HIS C 1 215 ? 2.933 11.266 -8.447 1.00 32.17 ? 217 HIS C ND1 1 +ATOM 5289 C CD2 . HIS C 1 215 ? 4.083 9.493 -9.083 1.00 33.97 ? 217 HIS C CD2 1 +ATOM 5290 C CE1 . HIS C 1 215 ? 4.179 11.592 -8.632 1.00 31.71 ? 217 HIS C CE1 1 +ATOM 5291 N NE2 . HIS C 1 215 ? 4.860 10.537 -9.009 1.00 37.25 ? 217 HIS C NE2 1 +ATOM 5292 N N . MET C 1 216 ? 2.523 7.199 -6.676 1.00 22.32 ? 218 MET C N 1 +ATOM 5293 C CA . MET C 1 216 ? 3.594 6.481 -6.013 1.00 10.39 ? 218 MET C CA 1 +ATOM 5294 C C . MET C 1 216 ? 4.147 5.503 -7.000 1.00 13.68 ? 218 MET C C 1 +ATOM 5295 O O . MET C 1 216 ? 3.424 4.811 -7.718 1.00 15.15 ? 218 MET C O 1 +ATOM 5296 C CB . MET C 1 216 ? 3.084 5.759 -4.807 1.00 14.39 ? 218 MET C CB 1 +ATOM 5297 C CG . MET C 1 216 ? 3.942 4.636 -4.289 1.00 11.29 ? 218 MET C CG 1 +ATOM 5298 S SD . MET C 1 216 ? 3.515 4.239 -2.602 1.00 17.54 ? 218 MET C SD 1 +ATOM 5299 C CE . MET C 1 216 ? 2.327 3.015 -3.049 1.00 20.28 ? 218 MET C CE 1 +ATOM 5300 N N . VAL C 1 217 ? 5.484 5.565 -7.078 1.00 13.59 ? 219 VAL C N 1 +ATOM 5301 C CA . VAL C 1 217 ? 6.214 4.588 -7.841 1.00 10.60 ? 219 VAL C CA 1 +ATOM 5302 C C . VAL C 1 217 ? 6.762 3.700 -6.738 1.00 13.05 ? 219 VAL C C 1 +ATOM 5303 O O . VAL C 1 217 ? 7.154 4.152 -5.648 1.00 11.01 ? 219 VAL C O 1 +ATOM 5304 C CB . VAL C 1 217 ? 7.297 5.260 -8.663 1.00 12.44 ? 219 VAL C CB 1 +ATOM 5305 C CG1 . VAL C 1 217 ? 7.936 4.217 -9.540 1.00 6.50 ? 219 VAL C CG1 1 +ATOM 5306 C CG2 . VAL C 1 217 ? 6.719 6.307 -9.621 1.00 3.09 ? 219 VAL C CG2 1 +ATOM 5307 N N . LEU C 1 218 ? 6.526 2.386 -6.940 1.00 14.33 ? 220 LEU C N 1 +ATOM 5308 C CA . LEU C 1 218 ? 7.010 1.410 -5.974 1.00 14.46 ? 220 LEU C CA 1 +ATOM 5309 C C . LEU C 1 218 ? 7.937 0.441 -6.695 1.00 17.63 ? 220 LEU C C 1 +ATOM 5310 O O . LEU C 1 218 ? 7.706 -0.027 -7.819 1.00 11.92 ? 220 LEU C O 1 +ATOM 5311 C CB . LEU C 1 218 ? 5.847 0.666 -5.370 1.00 16.76 ? 220 LEU C CB 1 +ATOM 5312 C CG . LEU C 1 218 ? 6.253 -0.460 -4.431 1.00 13.59 ? 220 LEU C CG 1 +ATOM 5313 C CD1 . LEU C 1 218 ? 6.924 0.145 -3.220 1.00 10.51 ? 220 LEU C CD1 1 +ATOM 5314 C CD2 . LEU C 1 218 ? 5.053 -1.295 -4.055 1.00 9.64 ? 220 LEU C CD2 1 +ATOM 5315 N N . LEU C 1 219 ? 9.089 0.335 -6.043 1.00 17.17 ? 221 LEU C N 1 +ATOM 5316 C CA . LEU C 1 219 ? 10.091 -0.653 -6.441 1.00 18.04 ? 221 LEU C CA 1 +ATOM 5317 C C . LEU C 1 219 ? 10.091 -1.571 -5.258 1.00 15.39 ? 221 LEU C C 1 +ATOM 5318 O O . LEU C 1 219 ? 10.211 -1.124 -4.106 1.00 14.89 ? 221 LEU C O 1 +ATOM 5319 C CB . LEU C 1 219 ? 11.502 -0.072 -6.608 1.00 21.17 ? 221 LEU C CB 1 +ATOM 5320 C CG . LEU C 1 219 ? 11.922 0.286 -8.033 1.00 26.98 ? 221 LEU C CG 1 +ATOM 5321 C CD1 . LEU C 1 219 ? 12.164 -1.031 -8.792 1.00 28.69 ? 221 LEU C CD1 1 +ATOM 5322 C CD2 . LEU C 1 219 ? 10.857 1.198 -8.715 1.00 29.56 ? 221 LEU C CD2 1 +ATOM 5323 N N . GLU C 1 220 ? 9.764 -2.830 -5.540 1.00 15.35 ? 222 GLU C N 1 +ATOM 5324 C CA . GLU C 1 220 ? 9.789 -3.825 -4.476 1.00 13.76 ? 222 GLU C CA 1 +ATOM 5325 C C . GLU C 1 220 ? 10.674 -5.039 -4.874 1.00 13.85 ? 222 GLU C C 1 +ATOM 5326 O O . GLU C 1 220 ? 10.928 -5.381 -6.044 1.00 15.92 ? 222 GLU C O 1 +ATOM 5327 C CB . GLU C 1 220 ? 8.328 -4.162 -4.218 1.00 12.70 ? 222 GLU C CB 1 +ATOM 5328 C CG . GLU C 1 220 ? 8.173 -4.580 -2.778 1.00 27.70 ? 222 GLU C CG 1 +ATOM 5329 C CD . GLU C 1 220 ? 6.754 -4.652 -2.228 1.00 39.21 ? 222 GLU C CD 1 +ATOM 5330 O OE1 . GLU C 1 220 ? 6.078 -5.643 -2.508 1.00 45.17 ? 222 GLU C OE1 1 +ATOM 5331 O OE2 . GLU C 1 220 ? 6.346 -3.737 -1.501 1.00 37.35 ? 222 GLU C OE2 1 +ATOM 5332 N N . PHE C 1 221 ? 11.250 -5.671 -3.886 1.00 4.17 ? 223 PHE C N 1 +ATOM 5333 C CA . PHE C 1 221 ? 12.085 -6.827 -4.097 1.00 7.75 ? 223 PHE C CA 1 +ATOM 5334 C C . PHE C 1 221 ? 11.601 -7.694 -2.984 1.00 9.58 ? 223 PHE C C 1 +ATOM 5335 O O . PHE C 1 221 ? 11.630 -7.279 -1.819 1.00 12.71 ? 223 PHE C O 1 +ATOM 5336 C CB . PHE C 1 221 ? 13.669 -6.600 -3.895 1.00 9.34 ? 223 PHE C CB 1 +ATOM 5337 C CG . PHE C 1 221 ? 14.248 -5.798 -5.051 1.00 18.46 ? 223 PHE C CG 1 +ATOM 5338 C CD1 . PHE C 1 221 ? 14.520 -6.463 -6.240 1.00 18.32 ? 223 PHE C CD1 1 +ATOM 5339 C CD2 . PHE C 1 221 ? 14.414 -4.405 -4.983 1.00 22.51 ? 223 PHE C CD2 1 +ATOM 5340 C CE1 . PHE C 1 221 ? 14.944 -5.769 -7.367 1.00 15.77 ? 223 PHE C CE1 1 +ATOM 5341 C CE2 . PHE C 1 221 ? 14.835 -3.711 -6.118 1.00 20.24 ? 223 PHE C CE2 1 +ATOM 5342 C CZ . PHE C 1 221 ? 15.097 -4.390 -7.308 1.00 19.54 ? 223 PHE C CZ 1 +ATOM 5343 N N . VAL C 1 222 ? 11.140 -8.885 -3.392 1.00 14.73 ? 224 VAL C N 1 +ATOM 5344 C CA . VAL C 1 222 ? 10.563 -9.893 -2.469 1.00 17.98 ? 224 VAL C CA 1 +ATOM 5345 C C . VAL C 1 222 ? 11.285 -11.218 -2.709 1.00 19.54 ? 224 VAL C C 1 +ATOM 5346 O O . VAL C 1 222 ? 11.516 -11.701 -3.838 1.00 8.33 ? 224 VAL C O 1 +ATOM 5347 C CB . VAL C 1 222 ? 9.072 -10.246 -2.684 1.00 17.54 ? 224 VAL C CB 1 +ATOM 5348 C CG1 . VAL C 1 222 ? 8.526 -10.601 -1.317 1.00 18.10 ? 224 VAL C CG1 1 +ATOM 5349 C CG2 . VAL C 1 222 ? 8.270 -9.117 -3.352 1.00 23.30 ? 224 VAL C CG2 1 +ATOM 5350 N N . THR C 1 223 ? 11.673 -11.757 -1.561 1.00 12.74 ? 225 THR C N 1 +ATOM 5351 C CA . THR C 1 223 ? 12.386 -12.981 -1.594 1.00 16.04 ? 225 THR C CA 1 +ATOM 5352 C C . THR C 1 223 ? 11.904 -13.900 -0.498 1.00 17.80 ? 225 THR C C 1 +ATOM 5353 O O . THR C 1 223 ? 11.805 -13.561 0.683 1.00 13.71 ? 225 THR C O 1 +ATOM 5354 C CB . THR C 1 223 ? 13.882 -12.642 -1.509 1.00 23.03 ? 225 THR C CB 1 +ATOM 5355 O OG1 . THR C 1 223 ? 14.215 -12.198 -2.838 1.00 28.47 ? 225 THR C OG1 1 +ATOM 5356 C CG2 . THR C 1 223 ? 14.811 -13.830 -1.233 1.00 28.30 ? 225 THR C CG2 1 +ATOM 5357 N N . ALA C 1 224 ? 11.532 -15.097 -0.961 1.00 16.92 ? 226 ALA C N 1 +ATOM 5358 C CA . ALA C 1 224 ? 11.118 -16.073 0.008 1.00 18.89 ? 226 ALA C CA 1 +ATOM 5359 C C . ALA C 1 224 ? 12.375 -16.621 0.650 1.00 17.57 ? 226 ALA C C 1 +ATOM 5360 O O . ALA C 1 224 ? 13.433 -16.727 0.011 1.00 22.46 ? 226 ALA C O 1 +ATOM 5361 C CB . ALA C 1 224 ? 10.364 -17.150 -0.695 1.00 22.59 ? 226 ALA C CB 1 +ATOM 5362 N N . ALA C 1 225 ? 12.221 -16.840 1.956 1.00 13.15 ? 227 ALA C N 1 +ATOM 5363 C CA . ALA C 1 225 ? 13.238 -17.379 2.819 1.00 17.96 ? 227 ALA C CA 1 +ATOM 5364 C C . ALA C 1 225 ? 12.703 -18.006 4.107 1.00 24.25 ? 227 ALA C C 1 +ATOM 5365 O O . ALA C 1 225 ? 11.497 -18.050 4.392 1.00 25.02 ? 227 ALA C O 1 +ATOM 5366 C CB . ALA C 1 225 ? 14.231 -16.294 3.205 1.00 21.12 ? 227 ALA C CB 1 +ATOM 5367 N N . GLY C 1 226 ? 13.617 -18.579 4.890 1.00 26.09 ? 228 GLY C N 1 +ATOM 5368 C CA . GLY C 1 226 ? 13.224 -19.199 6.137 1.00 30.97 ? 228 GLY C CA 1 +ATOM 5369 C C . GLY C 1 226 ? 13.171 -20.702 6.064 1.00 29.24 ? 228 GLY C C 1 +ATOM 5370 O O . GLY C 1 226 ? 12.860 -21.329 7.070 1.00 34.81 ? 228 GLY C O 1 +ATOM 5371 N N . ILE C 1 227 ? 13.357 -21.320 4.910 1.00 29.65 ? 229 ILE C N 1 +ATOM 5372 C CA . ILE C 1 227 ? 13.450 -22.786 4.867 1.00 31.52 ? 229 ILE C CA 1 +ATOM 5373 C C . ILE C 1 227 ? 14.798 -23.118 4.216 1.00 35.82 ? 229 ILE C C 1 +ATOM 5374 O O . ILE C 1 227 ? 15.072 -22.773 3.063 1.00 31.87 ? 229 ILE C O 1 +ATOM 5375 C CB . ILE C 1 227 ? 12.285 -23.358 4.045 1.00 28.47 ? 229 ILE C CB 1 +ATOM 5376 C CG1 . ILE C 1 227 ? 10.941 -23.048 4.708 1.00 29.55 ? 229 ILE C CG1 1 +ATOM 5377 C CG2 . ILE C 1 227 ? 12.437 -24.862 3.937 1.00 35.57 ? 229 ILE C CG2 1 +ATOM 5378 C CD1 . ILE C 1 227 ? 9.758 -23.201 3.737 1.00 12.75 ? 229 ILE C CD1 1 +ATOM 5379 N N . THR C 1 228 ? 15.665 -23.779 5.003 1.00 42.19 ? 230 THR C N 1 +ATOM 5380 C CA . THR C 1 228 ? 17.034 -24.153 4.599 1.00 46.86 ? 230 THR C CA 1 +ATOM 5381 C C . THR C 1 228 ? 17.240 -25.291 3.600 1.00 48.00 ? 230 THR C C 1 +ATOM 5382 O O . THR C 1 228 ? 18.041 -25.109 2.679 1.00 50.48 ? 230 THR C O 1 +ATOM 5383 C CB . THR C 1 228 ? 17.826 -24.424 5.904 1.00 46.68 ? 230 THR C CB 1 +ATOM 5384 O OG1 . THR C 1 228 ? 17.030 -25.217 6.773 1.00 48.18 ? 230 THR C OG1 1 +ATOM 5385 C CG2 . THR C 1 228 ? 18.162 -23.115 6.620 1.00 49.81 ? 230 THR C CG2 1 +ATOM 5386 N N . GLY D 1 4 ? 28.245 22.694 -11.497 1.00 52.62 ? 4 GLY D N 1 +ATOM 5387 C CA . GLY D 1 4 ? 28.265 21.461 -10.727 1.00 51.35 ? 4 GLY D CA 1 +ATOM 5388 C C . GLY D 1 4 ? 26.998 20.635 -10.896 1.00 50.98 ? 4 GLY D C 1 +ATOM 5389 O O . GLY D 1 4 ? 27.027 19.444 -11.205 1.00 49.21 ? 4 GLY D O 1 +ATOM 5390 N N . GLU D 1 5 ? 25.873 21.334 -10.705 1.00 49.40 ? 5 GLU D N 1 +ATOM 5391 C CA . GLU D 1 5 ? 24.506 20.837 -10.763 1.00 44.61 ? 5 GLU D CA 1 +ATOM 5392 C C . GLU D 1 5 ? 24.088 20.205 -12.098 1.00 44.67 ? 5 GLU D C 1 +ATOM 5393 O O . GLU D 1 5 ? 23.566 19.088 -12.137 1.00 44.52 ? 5 GLU D O 1 +ATOM 5394 C CB . GLU D 1 5 ? 23.658 22.033 -10.396 1.00 50.67 ? 5 GLU D CB 1 +ATOM 5395 C CG . GLU D 1 5 ? 22.182 21.849 -10.137 1.00 53.61 ? 5 GLU D CG 1 +ATOM 5396 C CD . GLU D 1 5 ? 21.481 23.199 -10.111 1.00 57.91 ? 5 GLU D CD 1 +ATOM 5397 O OE1 . GLU D 1 5 ? 21.668 23.956 -9.148 1.00 55.25 ? 5 GLU D OE1 1 +ATOM 5398 O OE2 . GLU D 1 5 ? 20.747 23.481 -11.067 1.00 58.81 ? 5 GLU D OE2 1 +ATOM 5399 N N . GLU D 1 6 ? 24.329 20.899 -13.214 1.00 40.92 ? 6 GLU D N 1 +ATOM 5400 C CA . GLU D 1 6 ? 24.023 20.414 -14.553 1.00 40.11 ? 6 GLU D CA 1 +ATOM 5401 C C . GLU D 1 6 ? 24.801 19.213 -15.119 1.00 39.27 ? 6 GLU D C 1 +ATOM 5402 O O . GLU D 1 6 ? 24.568 18.766 -16.250 1.00 33.85 ? 6 GLU D O 1 +ATOM 5403 C CB . GLU D 1 6 ? 24.131 21.630 -15.519 1.00 45.21 ? 6 GLU D CB 1 +ATOM 5404 C CG . GLU D 1 6 ? 25.188 22.705 -15.272 1.00 48.73 ? 6 GLU D CG 1 +ATOM 5405 C CD . GLU D 1 6 ? 26.622 22.187 -15.267 1.00 58.98 ? 6 GLU D CD 1 +ATOM 5406 O OE1 . GLU D 1 6 ? 27.128 21.836 -16.344 1.00 60.99 ? 6 GLU D OE1 1 +ATOM 5407 O OE2 . GLU D 1 6 ? 27.226 22.131 -14.185 1.00 58.82 ? 6 GLU D OE2 1 +ATOM 5408 N N . LEU D 1 7 ? 25.792 18.694 -14.369 1.00 38.28 ? 7 LEU D N 1 +ATOM 5409 C CA . LEU D 1 7 ? 26.480 17.450 -14.691 1.00 33.65 ? 7 LEU D CA 1 +ATOM 5410 C C . LEU D 1 7 ? 25.506 16.275 -14.479 1.00 34.26 ? 7 LEU D C 1 +ATOM 5411 O O . LEU D 1 7 ? 25.419 15.324 -15.257 1.00 38.33 ? 7 LEU D O 1 +ATOM 5412 C CB . LEU D 1 7 ? 27.687 17.327 -13.771 1.00 32.75 ? 7 LEU D CB 1 +ATOM 5413 C CG . LEU D 1 7 ? 28.887 18.278 -13.871 1.00 29.30 ? 7 LEU D CG 1 +ATOM 5414 C CD1 . LEU D 1 7 ? 29.728 18.026 -12.667 1.00 20.32 ? 7 LEU D CD1 1 +ATOM 5415 C CD2 . LEU D 1 7 ? 29.732 18.056 -15.118 1.00 26.53 ? 7 LEU D CD2 1 +ATOM 5416 N N . PHE D 1 8 ? 24.687 16.436 -13.441 1.00 30.76 ? 8 PHE D N 1 +ATOM 5417 C CA . PHE D 1 8 ? 23.685 15.530 -12.945 1.00 28.81 ? 8 PHE D CA 1 +ATOM 5418 C C . PHE D 1 8 ? 22.280 15.583 -13.544 1.00 32.61 ? 8 PHE D C 1 +ATOM 5419 O O . PHE D 1 8 ? 21.327 15.069 -12.945 1.00 36.24 ? 8 PHE D O 1 +ATOM 5420 C CB . PHE D 1 8 ? 23.631 15.760 -11.452 1.00 29.60 ? 8 PHE D CB 1 +ATOM 5421 C CG . PHE D 1 8 ? 24.898 15.365 -10.735 1.00 31.36 ? 8 PHE D CG 1 +ATOM 5422 C CD1 . PHE D 1 8 ? 25.134 14.018 -10.440 1.00 36.54 ? 8 PHE D CD1 1 +ATOM 5423 C CD2 . PHE D 1 8 ? 25.822 16.339 -10.384 1.00 27.99 ? 8 PHE D CD2 1 +ATOM 5424 C CE1 . PHE D 1 8 ? 26.307 13.649 -9.786 1.00 39.20 ? 8 PHE D CE1 1 +ATOM 5425 C CE2 . PHE D 1 8 ? 26.986 15.960 -9.736 1.00 33.11 ? 8 PHE D CE2 1 +ATOM 5426 C CZ . PHE D 1 8 ? 27.233 14.621 -9.433 1.00 35.93 ? 8 PHE D CZ 1 +ATOM 5427 N N . THR D 1 9 ? 22.073 16.161 -14.727 1.00 32.87 ? 9 THR D N 1 +ATOM 5428 C CA . THR D 1 9 ? 20.704 16.261 -15.251 1.00 33.24 ? 9 THR D CA 1 +ATOM 5429 C C . THR D 1 9 ? 20.252 15.092 -16.125 1.00 34.12 ? 9 THR D C 1 +ATOM 5430 O O . THR D 1 9 ? 19.092 14.910 -16.506 1.00 38.04 ? 9 THR D O 1 +ATOM 5431 C CB . THR D 1 9 ? 20.610 17.620 -15.987 1.00 30.91 ? 9 THR D CB 1 +ATOM 5432 O OG1 . THR D 1 9 ? 21.601 17.685 -16.993 1.00 27.65 ? 9 THR D OG1 1 +ATOM 5433 C CG2 . THR D 1 9 ? 20.757 18.746 -14.986 1.00 25.32 ? 9 THR D CG2 1 +ATOM 5434 N N . GLY D 1 10 ? 21.240 14.265 -16.446 1.00 37.34 ? 10 GLY D N 1 +ATOM 5435 C CA . GLY D 1 10 ? 21.034 13.019 -17.158 1.00 33.07 ? 10 GLY D CA 1 +ATOM 5436 C C . GLY D 1 10 ? 21.416 11.862 -16.249 1.00 28.75 ? 10 GLY D C 1 +ATOM 5437 O O . GLY D 1 10 ? 21.557 11.977 -15.025 1.00 30.52 ? 10 GLY D O 1 +ATOM 5438 N N . VAL D 1 11 ? 21.536 10.714 -16.913 1.00 30.49 ? 11 VAL D N 1 +ATOM 5439 C CA . VAL D 1 11 ? 22.007 9.498 -16.267 1.00 27.21 ? 11 VAL D CA 1 +ATOM 5440 C C . VAL D 1 11 ? 23.516 9.516 -16.399 1.00 28.99 ? 11 VAL D C 1 +ATOM 5441 O O . VAL D 1 11 ? 24.111 9.606 -17.479 1.00 28.31 ? 11 VAL D O 1 +ATOM 5442 C CB . VAL D 1 11 ? 21.390 8.308 -16.971 1.00 29.37 ? 11 VAL D CB 1 +ATOM 5443 C CG1 . VAL D 1 11 ? 22.104 7.028 -16.536 1.00 24.98 ? 11 VAL D CG1 1 +ATOM 5444 C CG2 . VAL D 1 11 ? 19.895 8.223 -16.595 1.00 23.65 ? 11 VAL D CG2 1 +ATOM 5445 N N . VAL D 1 12 ? 24.048 9.484 -15.186 1.00 28.04 ? 12 VAL D N 1 +ATOM 5446 C CA . VAL D 1 12 ? 25.467 9.584 -14.923 1.00 29.88 ? 12 VAL D CA 1 +ATOM 5447 C C . VAL D 1 12 ? 26.008 8.209 -14.518 1.00 29.98 ? 12 VAL D C 1 +ATOM 5448 O O . VAL D 1 12 ? 25.571 7.648 -13.510 1.00 28.93 ? 12 VAL D O 1 +ATOM 5449 C CB . VAL D 1 12 ? 25.713 10.631 -13.782 1.00 31.54 ? 12 VAL D CB 1 +ATOM 5450 C CG1 . VAL D 1 12 ? 27.204 10.665 -13.453 1.00 27.74 ? 12 VAL D CG1 1 +ATOM 5451 C CG2 . VAL D 1 12 ? 25.194 12.038 -14.189 1.00 22.77 ? 12 VAL D CG2 1 +ATOM 5452 N N . PRO D 1 13 ? 26.991 7.662 -15.268 1.00 30.08 ? 13 PRO D N 1 +ATOM 5453 C CA . PRO D 1 13 ? 27.703 6.420 -14.956 1.00 26.01 ? 13 PRO D CA 1 +ATOM 5454 C C . PRO D 1 13 ? 28.439 6.520 -13.650 1.00 20.87 ? 13 PRO D C 1 +ATOM 5455 O O . PRO D 1 13 ? 29.012 7.544 -13.307 1.00 26.76 ? 13 PRO D O 1 +ATOM 5456 C CB . PRO D 1 13 ? 28.611 6.219 -16.117 1.00 27.19 ? 13 PRO D CB 1 +ATOM 5457 C CG . PRO D 1 13 ? 27.904 6.956 -17.241 1.00 32.12 ? 13 PRO D CG 1 +ATOM 5458 C CD . PRO D 1 13 ? 27.505 8.222 -16.518 1.00 29.69 ? 13 PRO D CD 1 +ATOM 5459 N N . ILE D 1 14 ? 28.305 5.526 -12.802 1.00 16.58 ? 14 ILE D N 1 +ATOM 5460 C CA . ILE D 1 14 ? 29.009 5.530 -11.546 1.00 12.69 ? 14 ILE D CA 1 +ATOM 5461 C C . ILE D 1 14 ? 29.910 4.314 -11.664 1.00 20.23 ? 14 ILE D C 1 +ATOM 5462 O O . ILE D 1 14 ? 29.820 3.456 -12.561 1.00 22.43 ? 14 ILE D O 1 +ATOM 5463 C CB . ILE D 1 14 ? 28.022 5.419 -10.363 1.00 11.77 ? 14 ILE D CB 1 +ATOM 5464 C CG1 . ILE D 1 14 ? 26.938 6.456 -10.528 1.00 13.14 ? 14 ILE D CG1 1 +ATOM 5465 C CG2 . ILE D 1 14 ? 28.712 5.686 -9.008 1.00 3.86 ? 14 ILE D CG2 1 +ATOM 5466 C CD1 . ILE D 1 14 ? 25.971 6.392 -9.349 1.00 20.32 ? 14 ILE D CD1 1 +ATOM 5467 N N . LEU D 1 15 ? 30.922 4.415 -10.808 1.00 24.33 ? 15 LEU D N 1 +ATOM 5468 C CA . LEU D 1 15 ? 32.007 3.465 -10.702 1.00 25.15 ? 15 LEU D CA 1 +ATOM 5469 C C . LEU D 1 15 ? 32.338 3.697 -9.253 1.00 21.62 ? 15 LEU D C 1 +ATOM 5470 O O . LEU D 1 15 ? 32.510 4.840 -8.861 1.00 24.44 ? 15 LEU D O 1 +ATOM 5471 C CB . LEU D 1 15 ? 33.090 3.932 -11.646 1.00 35.96 ? 15 LEU D CB 1 +ATOM 5472 C CG . LEU D 1 15 ? 34.108 3.002 -12.284 1.00 42.40 ? 15 LEU D CG 1 +ATOM 5473 C CD1 . LEU D 1 15 ? 34.739 2.107 -11.215 1.00 45.86 ? 15 LEU D CD1 1 +ATOM 5474 C CD2 . LEU D 1 15 ? 33.409 2.188 -13.368 1.00 46.48 ? 15 LEU D CD2 1 +ATOM 5475 N N . VAL D 1 16 ? 32.257 2.647 -8.437 1.00 22.12 ? 16 VAL D N 1 +ATOM 5476 C CA . VAL D 1 16 ? 32.559 2.642 -6.997 1.00 20.19 ? 16 VAL D CA 1 +ATOM 5477 C C . VAL D 1 16 ? 33.691 1.634 -6.749 1.00 21.40 ? 16 VAL D C 1 +ATOM 5478 O O . VAL D 1 16 ? 33.723 0.565 -7.370 1.00 26.38 ? 16 VAL D O 1 +ATOM 5479 C CB . VAL D 1 16 ? 31.336 2.209 -6.166 1.00 15.58 ? 16 VAL D CB 1 +ATOM 5480 C CG1 . VAL D 1 16 ? 31.618 2.372 -4.670 1.00 6.51 ? 16 VAL D CG1 1 +ATOM 5481 C CG2 . VAL D 1 16 ? 30.128 3.072 -6.564 1.00 22.36 ? 16 VAL D CG2 1 +ATOM 5482 N N . GLU D 1 17 ? 34.657 1.961 -5.886 1.00 16.14 ? 17 GLU D N 1 +ATOM 5483 C CA . GLU D 1 17 ? 35.782 1.083 -5.603 1.00 19.22 ? 17 GLU D CA 1 +ATOM 5484 C C . GLU D 1 17 ? 36.014 1.184 -4.141 1.00 18.84 ? 17 GLU D C 1 +ATOM 5485 O O . GLU D 1 17 ? 36.145 2.273 -3.606 1.00 30.72 ? 17 GLU D O 1 +ATOM 5486 C CB . GLU D 1 17 ? 37.096 1.486 -6.267 1.00 13.17 ? 17 GLU D CB 1 +ATOM 5487 C CG . GLU D 1 17 ? 36.953 1.718 -7.781 1.00 19.41 ? 17 GLU D CG 1 +ATOM 5488 C CD . GLU D 1 17 ? 37.274 0.530 -8.668 1.00 38.95 ? 17 GLU D CD 1 +ATOM 5489 O OE1 . GLU D 1 17 ? 36.902 -0.607 -8.337 1.00 42.59 ? 17 GLU D OE1 1 +ATOM 5490 O OE2 . GLU D 1 17 ? 37.911 0.750 -9.708 1.00 47.42 ? 17 GLU D OE2 1 +ATOM 5491 N N . LEU D 1 18 ? 35.968 0.054 -3.457 1.00 16.65 ? 18 LEU D N 1 +ATOM 5492 C CA . LEU D 1 18 ? 36.269 0.014 -2.030 1.00 16.71 ? 18 LEU D CA 1 +ATOM 5493 C C . LEU D 1 18 ? 37.427 -0.981 -1.877 1.00 19.67 ? 18 LEU D C 1 +ATOM 5494 O O . LEU D 1 18 ? 37.664 -1.842 -2.720 1.00 20.81 ? 18 LEU D O 1 +ATOM 5495 C CB . LEU D 1 18 ? 34.984 -0.411 -1.327 1.00 13.76 ? 18 LEU D CB 1 +ATOM 5496 C CG . LEU D 1 18 ? 34.637 -0.646 0.127 1.00 15.31 ? 18 LEU D CG 1 +ATOM 5497 C CD1 . LEU D 1 18 ? 35.703 -1.494 0.791 1.00 18.37 ? 18 LEU D CD1 1 +ATOM 5498 C CD2 . LEU D 1 18 ? 34.618 0.636 0.878 1.00 15.84 ? 18 LEU D CD2 1 +ATOM 5499 N N . ASP D 1 19 ? 38.288 -0.643 -0.913 1.00 19.03 ? 19 ASP D N 1 +ATOM 5500 C CA . ASP D 1 19 ? 39.342 -1.465 -0.413 1.00 13.46 ? 19 ASP D CA 1 +ATOM 5501 C C . ASP D 1 19 ? 39.040 -1.358 1.050 1.00 9.29 ? 19 ASP D C 1 +ATOM 5502 O O . ASP D 1 19 ? 38.806 -0.281 1.603 1.00 12.06 ? 19 ASP D O 1 +ATOM 5503 C CB . ASP D 1 19 ? 40.768 -0.938 -0.628 1.00 23.25 ? 19 ASP D CB 1 +ATOM 5504 C CG . ASP D 1 19 ? 41.207 -0.931 -2.089 1.00 34.63 ? 19 ASP D CG 1 +ATOM 5505 O OD1 . ASP D 1 19 ? 40.824 -1.827 -2.841 1.00 38.06 ? 19 ASP D OD1 1 +ATOM 5506 O OD2 . ASP D 1 19 ? 41.930 -0.014 -2.487 1.00 35.94 ? 19 ASP D OD2 1 +ATOM 5507 N N . GLY D 1 20 ? 38.973 -2.468 1.747 1.00 7.07 ? 20 GLY D N 1 +ATOM 5508 C CA . GLY D 1 20 ? 38.691 -2.319 3.177 1.00 9.16 ? 20 GLY D CA 1 +ATOM 5509 C C . GLY D 1 20 ? 39.495 -3.301 3.989 1.00 15.09 ? 20 GLY D C 1 +ATOM 5510 O O . GLY D 1 20 ? 40.260 -4.153 3.493 1.00 14.16 ? 20 GLY D O 1 +ATOM 5511 N N . ASP D 1 21 ? 39.247 -3.168 5.276 1.00 12.93 ? 21 ASP D N 1 +ATOM 5512 C CA . ASP D 1 21 ? 39.988 -3.981 6.188 1.00 14.06 ? 21 ASP D CA 1 +ATOM 5513 C C . ASP D 1 21 ? 39.154 -3.851 7.398 1.00 17.87 ? 21 ASP D C 1 +ATOM 5514 O O . ASP D 1 21 ? 39.055 -2.795 8.036 1.00 20.49 ? 21 ASP D O 1 +ATOM 5515 C CB . ASP D 1 21 ? 41.349 -3.405 6.491 1.00 19.25 ? 21 ASP D CB 1 +ATOM 5516 C CG . ASP D 1 21 ? 42.229 -4.302 7.347 1.00 22.91 ? 21 ASP D CG 1 +ATOM 5517 O OD1 . ASP D 1 21 ? 42.067 -4.371 8.581 1.00 15.14 ? 21 ASP D OD1 1 +ATOM 5518 O OD2 . ASP D 1 21 ? 43.107 -4.916 6.739 1.00 31.98 ? 21 ASP D OD2 1 +ATOM 5519 N N . VAL D 1 22 ? 38.552 -4.986 7.690 1.00 18.83 ? 22 VAL D N 1 +ATOM 5520 C CA . VAL D 1 22 ? 37.724 -5.045 8.875 1.00 18.94 ? 22 VAL D CA 1 +ATOM 5521 C C . VAL D 1 22 ? 38.365 -6.076 9.726 1.00 22.63 ? 22 VAL D C 1 +ATOM 5522 O O . VAL D 1 22 ? 38.439 -7.221 9.276 1.00 34.84 ? 22 VAL D O 1 +ATOM 5523 C CB . VAL D 1 22 ? 36.292 -5.459 8.500 1.00 19.21 ? 22 VAL D CB 1 +ATOM 5524 C CG1 . VAL D 1 22 ? 35.424 -5.534 9.724 1.00 14.71 ? 22 VAL D CG1 1 +ATOM 5525 C CG2 . VAL D 1 22 ? 35.719 -4.418 7.523 1.00 21.36 ? 22 VAL D CG2 1 +ATOM 5526 N N . ASN D 1 23 ? 38.832 -5.750 10.925 1.00 23.99 ? 23 ASN D N 1 +ATOM 5527 C CA . ASN D 1 23 ? 39.442 -6.771 11.761 1.00 27.88 ? 23 ASN D CA 1 +ATOM 5528 C C . ASN D 1 23 ? 40.611 -7.581 11.158 1.00 30.13 ? 23 ASN D C 1 +ATOM 5529 O O . ASN D 1 23 ? 40.969 -8.655 11.652 1.00 32.25 ? 23 ASN D O 1 +ATOM 5530 C CB . ASN D 1 23 ? 38.289 -7.706 12.257 1.00 15.06 ? 23 ASN D CB 1 +ATOM 5531 C CG . ASN D 1 23 ? 37.699 -7.080 13.483 1.00 18.68 ? 23 ASN D CG 1 +ATOM 5532 O OD1 . ASN D 1 23 ? 37.273 -5.925 13.509 1.00 21.17 ? 23 ASN D OD1 1 +ATOM 5533 N ND2 . ASN D 1 23 ? 37.603 -7.850 14.561 1.00 28.16 ? 23 ASN D ND2 1 +ATOM 5534 N N . GLY D 1 24 ? 41.211 -7.058 10.078 1.00 32.74 ? 24 GLY D N 1 +ATOM 5535 C CA . GLY D 1 24 ? 42.375 -7.642 9.431 1.00 25.07 ? 24 GLY D CA 1 +ATOM 5536 C C . GLY D 1 24 ? 42.049 -8.154 8.053 1.00 28.98 ? 24 GLY D C 1 +ATOM 5537 O O . GLY D 1 24 ? 42.915 -8.347 7.200 1.00 37.51 ? 24 GLY D O 1 +ATOM 5538 N N . HIS D 1 25 ? 40.769 -8.390 7.816 1.00 29.15 ? 25 HIS D N 1 +ATOM 5539 C CA . HIS D 1 25 ? 40.277 -8.945 6.579 1.00 23.76 ? 25 HIS D CA 1 +ATOM 5540 C C . HIS D 1 25 ? 40.206 -7.918 5.478 1.00 25.19 ? 25 HIS D C 1 +ATOM 5541 O O . HIS D 1 25 ? 39.341 -7.044 5.403 1.00 25.06 ? 25 HIS D O 1 +ATOM 5542 C CB . HIS D 1 25 ? 38.921 -9.540 6.849 1.00 22.85 ? 25 HIS D CB 1 +ATOM 5543 C CG . HIS D 1 25 ? 39.011 -10.475 8.031 1.00 24.06 ? 25 HIS D CG 1 +ATOM 5544 N ND1 . HIS D 1 25 ? 38.587 -10.240 9.281 1.00 25.41 ? 25 HIS D ND1 1 +ATOM 5545 C CD2 . HIS D 1 25 ? 39.610 -11.712 7.978 1.00 18.12 ? 25 HIS D CD2 1 +ATOM 5546 C CE1 . HIS D 1 25 ? 38.908 -11.297 10.005 1.00 10.95 ? 25 HIS D CE1 1 +ATOM 5547 N NE2 . HIS D 1 25 ? 39.508 -12.147 9.213 1.00 21.96 ? 25 HIS D NE2 1 +ATOM 5548 N N . LYS D 1 26 ? 41.194 -8.018 4.612 1.00 26.60 ? 26 LYS D N 1 +ATOM 5549 C CA . LYS D 1 26 ? 41.239 -7.110 3.501 1.00 28.24 ? 26 LYS D CA 1 +ATOM 5550 C C . LYS D 1 26 ? 40.295 -7.653 2.480 1.00 25.91 ? 26 LYS D C 1 +ATOM 5551 O O . LYS D 1 26 ? 40.148 -8.869 2.357 1.00 25.64 ? 26 LYS D O 1 +ATOM 5552 C CB . LYS D 1 26 ? 42.652 -7.011 2.893 1.00 29.30 ? 26 LYS D CB 1 +ATOM 5553 C CG . LYS D 1 26 ? 43.669 -6.514 3.931 1.00 36.02 ? 26 LYS D CG 1 +ATOM 5554 C CD . LYS D 1 26 ? 44.970 -5.898 3.348 1.00 36.02 ? 26 LYS D CD 1 +ATOM 5555 C CE . LYS D 1 26 ? 46.099 -6.101 4.370 1.00 42.38 ? 26 LYS D CE 1 +ATOM 5556 N NZ . LYS D 1 26 ? 45.750 -5.527 5.670 1.00 41.96 ? 26 LYS D NZ 1 +ATOM 5557 N N . PHE D 1 27 ? 39.662 -6.693 1.802 1.00 21.95 ? 27 PHE D N 1 +ATOM 5558 C CA . PHE D 1 27 ? 38.800 -6.981 0.692 1.00 22.38 ? 27 PHE D CA 1 +ATOM 5559 C C . PHE D 1 27 ? 38.700 -5.788 -0.213 1.00 27.86 ? 27 PHE D C 1 +ATOM 5560 O O . PHE D 1 27 ? 39.091 -4.670 0.118 1.00 31.68 ? 27 PHE D O 1 +ATOM 5561 C CB . PHE D 1 27 ? 37.413 -7.312 1.158 1.00 19.48 ? 27 PHE D CB 1 +ATOM 5562 C CG . PHE D 1 27 ? 36.775 -6.216 1.986 1.00 15.86 ? 27 PHE D CG 1 +ATOM 5563 C CD1 . PHE D 1 27 ? 37.013 -6.184 3.354 1.00 10.12 ? 27 PHE D CD1 1 +ATOM 5564 C CD2 . PHE D 1 27 ? 35.860 -5.351 1.409 1.00 9.82 ? 27 PHE D CD2 1 +ATOM 5565 C CE1 . PHE D 1 27 ? 36.324 -5.309 4.146 1.00 6.77 ? 27 PHE D CE1 1 +ATOM 5566 C CE2 . PHE D 1 27 ? 35.170 -4.479 2.212 1.00 7.06 ? 27 PHE D CE2 1 +ATOM 5567 C CZ . PHE D 1 27 ? 35.394 -4.461 3.578 1.00 12.47 ? 27 PHE D CZ 1 +ATOM 5568 N N . SER D 1 28 ? 38.018 -6.032 -1.317 1.00 29.33 ? 28 SER D N 1 +ATOM 5569 C CA . SER D 1 28 ? 37.788 -4.998 -2.294 1.00 30.52 ? 28 SER D CA 1 +ATOM 5570 C C . SER D 1 28 ? 36.477 -5.193 -3.018 1.00 30.22 ? 28 SER D C 1 +ATOM 5571 O O . SER D 1 28 ? 36.108 -6.336 -3.294 1.00 31.30 ? 28 SER D O 1 +ATOM 5572 C CB . SER D 1 28 ? 38.870 -4.984 -3.331 1.00 26.34 ? 28 SER D CB 1 +ATOM 5573 O OG . SER D 1 28 ? 40.044 -4.750 -2.592 1.00 38.14 ? 28 SER D OG 1 +ATOM 5574 N N . VAL D 1 29 ? 35.736 -4.100 -3.278 1.00 25.76 ? 29 VAL D N 1 +ATOM 5575 C CA . VAL D 1 29 ? 34.609 -4.255 -4.146 1.00 20.82 ? 29 VAL D CA 1 +ATOM 5576 C C . VAL D 1 29 ? 34.710 -3.268 -5.282 1.00 24.98 ? 29 VAL D C 1 +ATOM 5577 O O . VAL D 1 29 ? 35.386 -2.235 -5.250 1.00 29.15 ? 29 VAL D O 1 +ATOM 5578 C CB . VAL D 1 29 ? 33.236 -4.142 -3.328 1.00 20.07 ? 29 VAL D CB 1 +ATOM 5579 C CG1 . VAL D 1 29 ? 33.558 -4.153 -1.832 1.00 12.97 ? 29 VAL D CG1 1 +ATOM 5580 C CG2 . VAL D 1 29 ? 32.388 -2.961 -3.770 1.00 16.22 ? 29 VAL D CG2 1 +ATOM 5581 N N . SER D 1 30 ? 34.095 -3.695 -6.370 1.00 28.10 ? 30 SER D N 1 +ATOM 5582 C CA . SER D 1 30 ? 33.954 -2.821 -7.510 1.00 34.51 ? 30 SER D CA 1 +ATOM 5583 C C . SER D 1 30 ? 32.464 -2.665 -7.702 1.00 34.61 ? 30 SER D C 1 +ATOM 5584 O O . SER D 1 30 ? 31.732 -3.647 -7.843 1.00 32.95 ? 30 SER D O 1 +ATOM 5585 C CB . SER D 1 30 ? 34.559 -3.415 -8.780 1.00 28.72 ? 30 SER D CB 1 +ATOM 5586 O OG . SER D 1 30 ? 35.962 -3.347 -8.638 1.00 40.07 ? 30 SER D OG 1 +ATOM 5587 N N . GLY D 1 31 ? 32.024 -1.418 -7.648 1.00 32.65 ? 31 GLY D N 1 +ATOM 5588 C CA . GLY D 1 31 ? 30.639 -1.142 -7.926 1.00 36.93 ? 31 GLY D CA 1 +ATOM 5589 C C . GLY D 1 31 ? 30.507 -0.425 -9.240 1.00 36.89 ? 31 GLY D C 1 +ATOM 5590 O O . GLY D 1 31 ? 31.404 0.287 -9.664 1.00 41.83 ? 31 GLY D O 1 +ATOM 5591 N N . GLU D 1 32 ? 29.432 -0.662 -9.966 1.00 39.93 ? 32 GLU D N 1 +ATOM 5592 C CA . GLU D 1 32 ? 29.179 0.148 -11.129 1.00 37.33 ? 32 GLU D CA 1 +ATOM 5593 C C . GLU D 1 32 ? 27.689 0.152 -11.405 1.00 38.00 ? 32 GLU D C 1 +ATOM 5594 O O . GLU D 1 32 ? 26.922 -0.759 -11.079 1.00 39.76 ? 32 GLU D O 1 +ATOM 5595 C CB . GLU D 1 32 ? 29.963 -0.377 -12.323 1.00 35.13 ? 32 GLU D CB 1 +ATOM 5596 C CG . GLU D 1 32 ? 29.700 -1.792 -12.792 1.00 53.28 ? 32 GLU D CG 1 +ATOM 5597 C CD . GLU D 1 32 ? 28.579 -1.937 -13.807 1.00 60.69 ? 32 GLU D CD 1 +ATOM 5598 O OE1 . GLU D 1 32 ? 28.643 -1.261 -14.839 1.00 66.07 ? 32 GLU D OE1 1 +ATOM 5599 O OE2 . GLU D 1 32 ? 27.661 -2.726 -13.557 1.00 61.21 ? 32 GLU D OE2 1 +ATOM 5600 N N . GLY D 1 33 ? 27.305 1.289 -11.958 1.00 35.52 ? 33 GLY D N 1 +ATOM 5601 C CA . GLY D 1 33 ? 25.944 1.482 -12.370 1.00 34.14 ? 33 GLY D CA 1 +ATOM 5602 C C . GLY D 1 33 ? 25.728 2.877 -12.890 1.00 34.34 ? 33 GLY D C 1 +ATOM 5603 O O . GLY D 1 33 ? 26.505 3.424 -13.682 1.00 37.16 ? 33 GLY D O 1 +ATOM 5604 N N . GLU D 1 34 ? 24.602 3.418 -12.445 1.00 31.53 ? 34 GLU D N 1 +ATOM 5605 C CA . GLU D 1 34 ? 24.201 4.749 -12.864 1.00 29.56 ? 34 GLU D CA 1 +ATOM 5606 C C . GLU D 1 34 ? 23.249 5.409 -11.919 1.00 25.39 ? 34 GLU D C 1 +ATOM 5607 O O . GLU D 1 34 ? 22.560 4.810 -11.105 1.00 23.22 ? 34 GLU D O 1 +ATOM 5608 C CB . GLU D 1 34 ? 23.569 4.740 -14.231 1.00 34.49 ? 34 GLU D CB 1 +ATOM 5609 C CG . GLU D 1 34 ? 22.534 3.669 -14.496 1.00 40.59 ? 34 GLU D CG 1 +ATOM 5610 C CD . GLU D 1 34 ? 22.003 3.794 -15.910 1.00 42.95 ? 34 GLU D CD 1 +ATOM 5611 O OE1 . GLU D 1 34 ? 22.804 3.819 -16.857 1.00 39.23 ? 34 GLU D OE1 1 +ATOM 5612 O OE2 . GLU D 1 34 ? 20.779 3.895 -16.043 1.00 42.83 ? 34 GLU D OE2 1 +ATOM 5613 N N . GLY D 1 35 ? 23.450 6.714 -11.934 1.00 25.24 ? 35 GLY D N 1 +ATOM 5614 C CA . GLY D 1 35 ? 22.731 7.605 -11.052 1.00 25.16 ? 35 GLY D CA 1 +ATOM 5615 C C . GLY D 1 35 ? 21.977 8.582 -11.909 1.00 20.82 ? 35 GLY D C 1 +ATOM 5616 O O . GLY D 1 35 ? 22.460 9.014 -12.956 1.00 25.72 ? 35 GLY D O 1 +ATOM 5617 N N . ASP D 1 36 ? 20.772 8.872 -11.450 1.00 21.48 ? 36 ASP D N 1 +ATOM 5618 C CA . ASP D 1 36 ? 19.866 9.782 -12.138 1.00 23.41 ? 36 ASP D CA 1 +ATOM 5619 C C . ASP D 1 36 ? 19.334 10.684 -11.067 1.00 18.55 ? 36 ASP D C 1 +ATOM 5620 O O . ASP D 1 36 ? 18.411 10.305 -10.367 1.00 19.64 ? 36 ASP D O 1 +ATOM 5621 C CB . ASP D 1 36 ? 18.689 9.050 -12.760 1.00 27.79 ? 36 ASP D CB 1 +ATOM 5622 C CG . ASP D 1 36 ? 17.952 9.858 -13.804 1.00 33.10 ? 36 ASP D CG 1 +ATOM 5623 O OD1 . ASP D 1 36 ? 17.991 11.088 -13.789 1.00 41.40 ? 36 ASP D OD1 1 +ATOM 5624 O OD2 . ASP D 1 36 ? 17.358 9.235 -14.679 1.00 37.09 ? 36 ASP D OD2 1 +ATOM 5625 N N . ALA D 1 37 ? 19.947 11.860 -10.931 1.00 23.61 ? 37 ALA D N 1 +ATOM 5626 C CA . ALA D 1 37 ? 19.597 12.859 -9.912 1.00 20.69 ? 37 ALA D CA 1 +ATOM 5627 C C . ALA D 1 37 ? 18.197 13.464 -10.077 1.00 21.89 ? 37 ALA D C 1 +ATOM 5628 O O . ALA D 1 37 ? 17.583 13.854 -9.087 1.00 21.31 ? 37 ALA D O 1 +ATOM 5629 C CB . ALA D 1 37 ? 20.573 13.987 -9.966 1.00 13.43 ? 37 ALA D CB 1 +ATOM 5630 N N . THR D 1 38 ? 17.712 13.535 -11.336 1.00 19.38 ? 38 THR D N 1 +ATOM 5631 C CA . THR D 1 38 ? 16.411 14.058 -11.673 1.00 24.22 ? 38 THR D CA 1 +ATOM 5632 C C . THR D 1 38 ? 15.298 13.326 -10.925 1.00 28.53 ? 38 THR D C 1 +ATOM 5633 O O . THR D 1 38 ? 14.352 13.939 -10.385 1.00 27.13 ? 38 THR D O 1 +ATOM 5634 C CB . THR D 1 38 ? 16.253 13.942 -13.197 1.00 32.64 ? 38 THR D CB 1 +ATOM 5635 O OG1 . THR D 1 38 ? 17.301 14.722 -13.823 1.00 25.20 ? 38 THR D OG1 1 +ATOM 5636 C CG2 . THR D 1 38 ? 14.869 14.411 -13.648 1.00 31.60 ? 38 THR D CG2 1 +ATOM 5637 N N . TYR D 1 39 ? 15.498 11.997 -10.880 1.00 26.17 ? 39 TYR D N 1 +ATOM 5638 C CA . TYR D 1 39 ? 14.689 11.036 -10.155 1.00 24.18 ? 39 TYR D CA 1 +ATOM 5639 C C . TYR D 1 39 ? 15.151 10.912 -8.709 1.00 26.88 ? 39 TYR D C 1 +ATOM 5640 O O . TYR D 1 39 ? 14.374 10.707 -7.766 1.00 34.78 ? 39 TYR D O 1 +ATOM 5641 C CB . TYR D 1 39 ? 14.796 9.679 -10.890 1.00 24.22 ? 39 TYR D CB 1 +ATOM 5642 C CG . TYR D 1 39 ? 13.970 9.717 -12.179 1.00 34.98 ? 39 TYR D CG 1 +ATOM 5643 C CD1 . TYR D 1 39 ? 14.501 10.257 -13.348 1.00 33.29 ? 39 TYR D CD1 1 +ATOM 5644 C CD2 . TYR D 1 39 ? 12.612 9.321 -12.162 1.00 43.37 ? 39 TYR D CD2 1 +ATOM 5645 C CE1 . TYR D 1 39 ? 13.715 10.439 -14.484 1.00 37.90 ? 39 TYR D CE1 1 +ATOM 5646 C CE2 . TYR D 1 39 ? 11.813 9.499 -13.308 1.00 46.17 ? 39 TYR D CE2 1 +ATOM 5647 C CZ . TYR D 1 39 ? 12.374 10.068 -14.464 1.00 43.65 ? 39 TYR D CZ 1 +ATOM 5648 O OH . TYR D 1 39 ? 11.602 10.341 -15.579 1.00 43.24 ? 39 TYR D OH 1 +ATOM 5649 N N . GLY D 1 40 ? 16.441 11.081 -8.491 1.00 20.98 ? 40 GLY D N 1 +ATOM 5650 C CA . GLY D 1 40 ? 16.979 10.824 -7.171 1.00 20.37 ? 40 GLY D CA 1 +ATOM 5651 C C . GLY D 1 40 ? 17.225 9.327 -6.995 1.00 19.06 ? 40 GLY D C 1 +ATOM 5652 O O . GLY D 1 40 ? 17.113 8.816 -5.879 1.00 18.24 ? 40 GLY D O 1 +ATOM 5653 N N . LYS D 1 41 ? 17.578 8.628 -8.090 1.00 21.47 ? 41 LYS D N 1 +ATOM 5654 C CA . LYS D 1 41 ? 17.830 7.191 -8.056 1.00 18.70 ? 41 LYS D CA 1 +ATOM 5655 C C . LYS D 1 41 ? 19.184 6.705 -8.524 1.00 18.45 ? 41 LYS D C 1 +ATOM 5656 O O . LYS D 1 41 ? 19.746 7.078 -9.554 1.00 16.94 ? 41 LYS D O 1 +ATOM 5657 C CB . LYS D 1 41 ? 16.817 6.407 -8.881 1.00 15.33 ? 41 LYS D CB 1 +ATOM 5658 C CG . LYS D 1 41 ? 16.903 6.496 -10.407 1.00 24.36 ? 41 LYS D CG 1 +ATOM 5659 C CD . LYS D 1 41 ? 15.904 5.632 -11.174 1.00 28.24 ? 41 LYS D CD 1 +ATOM 5660 C CE . LYS D 1 41 ? 15.990 4.171 -10.821 1.00 37.58 ? 41 LYS D CE 1 +ATOM 5661 N NZ . LYS D 1 41 ? 15.020 3.417 -11.613 1.00 43.39 ? 41 LYS D NZ 1 +ATOM 5662 N N . LEU D 1 42 ? 19.642 5.759 -7.745 1.00 20.19 ? 42 LEU D N 1 +ATOM 5663 C CA . LEU D 1 42 ? 20.853 5.007 -8.040 1.00 22.77 ? 42 LEU D CA 1 +ATOM 5664 C C . LEU D 1 42 ? 20.558 3.547 -8.352 1.00 22.66 ? 42 LEU D C 1 +ATOM 5665 O O . LEU D 1 42 ? 19.899 2.821 -7.614 1.00 20.45 ? 42 LEU D O 1 +ATOM 5666 C CB . LEU D 1 42 ? 21.805 5.005 -6.857 1.00 16.65 ? 42 LEU D CB 1 +ATOM 5667 C CG . LEU D 1 42 ? 22.196 6.349 -6.516 1.00 2.05 ? 42 LEU D CG 1 +ATOM 5668 C CD1 . LEU D 1 42 ? 22.555 6.488 -5.063 1.00 2.00 ? 42 LEU D CD1 1 +ATOM 5669 C CD2 . LEU D 1 42 ? 23.232 6.679 -7.536 1.00 7.70 ? 42 LEU D CD2 1 +ATOM 5670 N N . THR D 1 43 ? 21.175 3.126 -9.437 1.00 31.44 ? 43 THR D N 1 +ATOM 5671 C CA . THR D 1 43 ? 21.198 1.744 -9.893 1.00 29.80 ? 43 THR D CA 1 +ATOM 5672 C C . THR D 1 43 ? 22.645 1.292 -9.812 1.00 26.24 ? 43 THR D C 1 +ATOM 5673 O O . THR D 1 43 ? 23.437 1.467 -10.732 1.00 24.06 ? 43 THR D O 1 +ATOM 5674 C CB . THR D 1 43 ? 20.621 1.768 -11.307 1.00 35.56 ? 43 THR D CB 1 +ATOM 5675 O OG1 . THR D 1 43 ? 19.247 1.717 -10.941 1.00 43.93 ? 43 THR D OG1 1 +ATOM 5676 C CG2 . THR D 1 43 ? 20.995 0.685 -12.336 1.00 40.99 ? 43 THR D CG2 1 +ATOM 5677 N N . LEU D 1 44 ? 23.039 0.726 -8.675 1.00 25.95 ? 44 LEU D N 1 +ATOM 5678 C CA . LEU D 1 44 ? 24.400 0.172 -8.554 1.00 27.59 ? 44 LEU D CA 1 +ATOM 5679 C C . LEU D 1 44 ? 24.623 -1.323 -8.304 1.00 24.04 ? 44 LEU D C 1 +ATOM 5680 O O . LEU D 1 44 ? 23.958 -1.891 -7.430 1.00 23.58 ? 44 LEU D O 1 +ATOM 5681 C CB . LEU D 1 44 ? 25.143 0.881 -7.442 1.00 17.88 ? 44 LEU D CB 1 +ATOM 5682 C CG . LEU D 1 44 ? 25.473 2.290 -7.626 1.00 14.56 ? 44 LEU D CG 1 +ATOM 5683 C CD1 . LEU D 1 44 ? 25.775 2.853 -6.239 1.00 2.00 ? 44 LEU D CD1 1 +ATOM 5684 C CD2 . LEU D 1 44 ? 26.518 2.394 -8.724 1.00 7.58 ? 44 LEU D CD2 1 +ATOM 5685 N N . LYS D 1 45 ? 25.613 -1.963 -8.958 1.00 25.15 ? 45 LYS D N 1 +ATOM 5686 C CA . LYS D 1 45 ? 25.957 -3.357 -8.608 1.00 25.91 ? 45 LYS D CA 1 +ATOM 5687 C C . LYS D 1 45 ? 27.405 -3.434 -8.175 1.00 24.64 ? 45 LYS D C 1 +ATOM 5688 O O . LYS D 1 45 ? 28.334 -3.040 -8.887 1.00 24.03 ? 45 LYS D O 1 +ATOM 5689 C CB . LYS D 1 45 ? 25.783 -4.335 -9.779 1.00 25.87 ? 45 LYS D CB 1 +ATOM 5690 C CG . LYS D 1 45 ? 25.977 -5.821 -9.388 1.00 31.22 ? 45 LYS D CG 1 +ATOM 5691 C CD . LYS D 1 45 ? 26.203 -6.530 -10.715 1.00 35.42 ? 45 LYS D CD 1 +ATOM 5692 C CE . LYS D 1 45 ? 26.385 -8.049 -10.662 1.00 38.51 ? 45 LYS D CE 1 +ATOM 5693 N NZ . LYS D 1 45 ? 26.401 -8.624 -12.018 1.00 35.28 ? 45 LYS D NZ 1 +ATOM 5694 N N . PHE D 1 46 ? 27.549 -3.966 -6.968 1.00 23.93 ? 46 PHE D N 1 +ATOM 5695 C CA . PHE D 1 46 ? 28.825 -4.188 -6.333 1.00 21.60 ? 46 PHE D CA 1 +ATOM 5696 C C . PHE D 1 46 ? 29.226 -5.644 -6.400 1.00 24.63 ? 46 PHE D C 1 +ATOM 5697 O O . PHE D 1 46 ? 28.448 -6.534 -6.075 1.00 25.71 ? 46 PHE D O 1 +ATOM 5698 C CB . PHE D 1 46 ? 28.756 -3.781 -4.885 1.00 26.37 ? 46 PHE D CB 1 +ATOM 5699 C CG . PHE D 1 46 ? 28.207 -2.386 -4.750 1.00 25.69 ? 46 PHE D CG 1 +ATOM 5700 C CD1 . PHE D 1 46 ? 29.048 -1.299 -5.008 1.00 29.83 ? 46 PHE D CD1 1 +ATOM 5701 C CD2 . PHE D 1 46 ? 26.862 -2.192 -4.414 1.00 25.26 ? 46 PHE D CD2 1 +ATOM 5702 C CE1 . PHE D 1 46 ? 28.535 -0.016 -4.930 1.00 26.40 ? 46 PHE D CE1 1 +ATOM 5703 C CE2 . PHE D 1 46 ? 26.347 -0.894 -4.335 1.00 20.46 ? 46 PHE D CE2 1 +ATOM 5704 C CZ . PHE D 1 46 ? 27.185 0.183 -4.592 1.00 28.10 ? 46 PHE D CZ 1 +ATOM 5705 N N . ILE D 1 47 ? 30.450 -5.902 -6.850 1.00 29.81 ? 47 ILE D N 1 +ATOM 5706 C CA . ILE D 1 47 ? 31.050 -7.225 -6.897 1.00 29.06 ? 47 ILE D CA 1 +ATOM 5707 C C . ILE D 1 47 ? 32.153 -7.236 -5.848 1.00 28.25 ? 47 ILE D C 1 +ATOM 5708 O O . ILE D 1 47 ? 32.965 -6.315 -5.838 1.00 24.01 ? 47 ILE D O 1 +ATOM 5709 C CB . ILE D 1 47 ? 31.670 -7.492 -8.286 1.00 30.73 ? 47 ILE D CB 1 +ATOM 5710 C CG1 . ILE D 1 47 ? 30.624 -7.555 -9.339 1.00 30.31 ? 47 ILE D CG1 1 +ATOM 5711 C CG2 . ILE D 1 47 ? 32.436 -8.811 -8.248 1.00 42.84 ? 47 ILE D CG2 1 +ATOM 5712 C CD1 . ILE D 1 47 ? 29.597 -8.623 -9.024 1.00 34.76 ? 47 ILE D CD1 1 +ATOM 5713 N N . CYS D 1 48 ? 32.243 -8.219 -4.939 1.00 31.23 ? 48 CYS D N 1 +ATOM 5714 C CA . CYS D 1 48 ? 33.430 -8.292 -4.111 1.00 33.55 ? 48 CYS D CA 1 +ATOM 5715 C C . CYS D 1 48 ? 34.471 -8.976 -5.005 1.00 36.53 ? 48 CYS D C 1 +ATOM 5716 O O . CYS D 1 48 ? 34.304 -10.090 -5.495 1.00 40.44 ? 48 CYS D O 1 +ATOM 5717 C CB . CYS D 1 48 ? 33.165 -9.092 -2.881 1.00 28.74 ? 48 CYS D CB 1 +ATOM 5718 S SG . CYS D 1 48 ? 34.571 -9.034 -1.717 1.00 33.53 ? 48 CYS D SG 1 +ATOM 5719 N N . THR D 1 49 ? 35.514 -8.226 -5.368 1.00 35.31 ? 49 THR D N 1 +ATOM 5720 C CA . THR D 1 49 ? 36.524 -8.703 -6.276 1.00 30.59 ? 49 THR D CA 1 +ATOM 5721 C C . THR D 1 49 ? 37.568 -9.617 -5.642 1.00 34.92 ? 49 THR D C 1 +ATOM 5722 O O . THR D 1 49 ? 38.324 -10.259 -6.371 1.00 35.32 ? 49 THR D O 1 +ATOM 5723 C CB . THR D 1 49 ? 37.204 -7.514 -6.908 1.00 28.19 ? 49 THR D CB 1 +ATOM 5724 O OG1 . THR D 1 49 ? 37.589 -6.669 -5.831 1.00 38.17 ? 49 THR D OG1 1 +ATOM 5725 C CG2 . THR D 1 49 ? 36.337 -6.830 -7.938 1.00 21.41 ? 49 THR D CG2 1 +ATOM 5726 N N . THR D 1 50 ? 37.623 -9.660 -4.304 1.00 32.47 ? 50 THR D N 1 +ATOM 5727 C CA . THR D 1 50 ? 38.545 -10.492 -3.547 1.00 33.47 ? 50 THR D CA 1 +ATOM 5728 C C . THR D 1 50 ? 37.876 -11.795 -3.092 1.00 39.66 ? 50 THR D C 1 +ATOM 5729 O O . THR D 1 50 ? 38.362 -12.468 -2.173 1.00 39.57 ? 50 THR D O 1 +ATOM 5730 C CB . THR D 1 50 ? 39.067 -9.753 -2.288 1.00 28.62 ? 50 THR D CB 1 +ATOM 5731 O OG1 . THR D 1 50 ? 37.915 -9.335 -1.557 1.00 25.18 ? 50 THR D OG1 1 +ATOM 5732 C CG2 . THR D 1 50 ? 40.037 -8.648 -2.641 1.00 26.34 ? 50 THR D CG2 1 +ATOM 5733 N N . GLY D 1 51 ? 36.768 -12.189 -3.738 1.00 41.54 ? 51 GLY D N 1 +ATOM 5734 C CA . GLY D 1 51 ? 36.000 -13.351 -3.319 1.00 38.61 ? 51 GLY D CA 1 +ATOM 5735 C C . GLY D 1 51 ? 34.750 -12.962 -2.554 1.00 39.09 ? 51 GLY D C 1 +ATOM 5736 O O . GLY D 1 51 ? 33.831 -12.390 -3.130 1.00 42.06 ? 51 GLY D O 1 +ATOM 5737 N N . LYS D 1 52 ? 34.722 -13.285 -1.256 1.00 38.01 ? 52 LYS D N 1 +ATOM 5738 C CA . LYS D 1 52 ? 33.602 -13.061 -0.345 1.00 31.83 ? 52 LYS D CA 1 +ATOM 5739 C C . LYS D 1 52 ? 33.930 -11.933 0.597 1.00 33.85 ? 52 LYS D C 1 +ATOM 5740 O O . LYS D 1 52 ? 35.058 -11.803 1.086 1.00 34.59 ? 52 LYS D O 1 +ATOM 5741 C CB . LYS D 1 52 ? 33.281 -14.211 0.610 1.00 27.09 ? 52 LYS D CB 1 +ATOM 5742 C CG . LYS D 1 52 ? 31.932 -14.892 0.522 1.00 32.34 ? 52 LYS D CG 1 +ATOM 5743 C CD . LYS D 1 52 ? 31.666 -15.416 -0.923 1.00 35.20 ? 52 LYS D CD 1 +ATOM 5744 C CE . LYS D 1 52 ? 30.633 -16.563 -1.030 1.00 32.41 ? 52 LYS D CE 1 +ATOM 5745 N NZ . LYS D 1 52 ? 29.385 -16.152 -0.418 1.00 41.45 ? 52 LYS D NZ 1 +ATOM 5746 N N . LEU D 1 53 ? 32.834 -11.255 0.940 1.00 28.59 ? 53 LEU D N 1 +ATOM 5747 C CA . LEU D 1 53 ? 32.882 -10.033 1.667 1.00 24.93 ? 53 LEU D CA 1 +ATOM 5748 C C . LEU D 1 53 ? 32.852 -10.317 3.147 1.00 22.24 ? 53 LEU D C 1 +ATOM 5749 O O . LEU D 1 53 ? 31.901 -10.868 3.693 1.00 24.85 ? 53 LEU D O 1 +ATOM 5750 C CB . LEU D 1 53 ? 31.682 -9.201 1.148 1.00 31.15 ? 53 LEU D CB 1 +ATOM 5751 C CG . LEU D 1 53 ? 31.570 -7.661 0.931 1.00 25.95 ? 53 LEU D CG 1 +ATOM 5752 C CD1 . LEU D 1 53 ? 30.939 -7.066 2.115 1.00 33.00 ? 53 LEU D CD1 1 +ATOM 5753 C CD2 . LEU D 1 53 ? 32.891 -7.030 0.645 1.00 25.68 ? 53 LEU D CD2 1 +ATOM 5754 N N . PRO D 1 54 ? 33.901 -9.985 3.881 1.00 14.78 ? 54 PRO D N 1 +ATOM 5755 C CA . PRO D 1 54 ? 34.028 -10.327 5.282 1.00 15.08 ? 54 PRO D CA 1 +ATOM 5756 C C . PRO D 1 54 ? 33.026 -9.787 6.256 1.00 16.79 ? 54 PRO D C 1 +ATOM 5757 O O . PRO D 1 54 ? 33.062 -10.054 7.453 1.00 12.83 ? 54 PRO D O 1 +ATOM 5758 C CB . PRO D 1 54 ? 35.411 -9.901 5.633 1.00 20.44 ? 54 PRO D CB 1 +ATOM 5759 C CG . PRO D 1 54 ? 35.706 -8.860 4.622 1.00 14.54 ? 54 PRO D CG 1 +ATOM 5760 C CD . PRO D 1 54 ? 35.139 -9.449 3.358 1.00 14.58 ? 54 PRO D CD 1 +ATOM 5761 N N . VAL D 1 55 ? 32.188 -8.920 5.686 1.00 21.81 ? 55 VAL D N 1 +ATOM 5762 C CA . VAL D 1 55 ? 31.152 -8.193 6.394 1.00 16.56 ? 55 VAL D CA 1 +ATOM 5763 C C . VAL D 1 55 ? 29.885 -8.278 5.601 1.00 11.66 ? 55 VAL D C 1 +ATOM 5764 O O . VAL D 1 55 ? 29.936 -8.558 4.398 1.00 11.97 ? 55 VAL D O 1 +ATOM 5765 C CB . VAL D 1 55 ? 31.537 -6.664 6.602 1.00 14.80 ? 55 VAL D CB 1 +ATOM 5766 C CG1 . VAL D 1 55 ? 32.496 -6.613 7.759 1.00 8.68 ? 55 VAL D CG1 1 +ATOM 5767 C CG2 . VAL D 1 55 ? 32.041 -6.005 5.333 1.00 8.71 ? 55 VAL D CG2 1 +ATOM 5768 N N . PRO D 1 56 ? 28.726 -8.033 6.217 1.00 10.23 ? 56 PRO D N 1 +ATOM 5769 C CA . PRO D 1 56 ? 27.441 -8.177 5.557 1.00 5.40 ? 56 PRO D CA 1 +ATOM 5770 C C . PRO D 1 56 ? 27.349 -7.026 4.582 1.00 13.82 ? 56 PRO D C 1 +ATOM 5771 O O . PRO D 1 56 ? 27.621 -5.880 4.955 1.00 17.45 ? 56 PRO D O 1 +ATOM 5772 C CB . PRO D 1 56 ? 26.436 -8.143 6.697 1.00 6.47 ? 56 PRO D CB 1 +ATOM 5773 C CG . PRO D 1 56 ? 27.190 -8.518 7.958 1.00 5.69 ? 56 PRO D CG 1 +ATOM 5774 C CD . PRO D 1 56 ? 28.539 -7.815 7.650 1.00 8.49 ? 56 PRO D CD 1 +ATOM 5775 N N . TRP D 1 57 ? 27.044 -7.296 3.311 1.00 13.52 ? 57 TRP D N 1 +ATOM 5776 C CA . TRP D 1 57 ? 26.873 -6.250 2.328 1.00 17.20 ? 57 TRP D CA 1 +ATOM 5777 C C . TRP D 1 57 ? 26.028 -4.991 2.691 1.00 24.44 ? 57 TRP D C 1 +ATOM 5778 O O . TRP D 1 57 ? 26.314 -3.925 2.125 1.00 24.27 ? 57 TRP D O 1 +ATOM 5779 C CB . TRP D 1 57 ? 26.249 -6.787 1.096 1.00 13.01 ? 57 TRP D CB 1 +ATOM 5780 C CG . TRP D 1 57 ? 27.095 -7.531 0.150 1.00 2.00 ? 57 TRP D CG 1 +ATOM 5781 C CD1 . TRP D 1 57 ? 26.988 -8.893 0.058 1.00 14.93 ? 57 TRP D CD1 1 +ATOM 5782 C CD2 . TRP D 1 57 ? 27.977 -6.989 -0.707 1.00 15.59 ? 57 TRP D CD2 1 +ATOM 5783 N NE1 . TRP D 1 57 ? 27.804 -9.232 -0.896 1.00 18.84 ? 57 TRP D NE1 1 +ATOM 5784 C CE2 . TRP D 1 57 ? 28.418 -8.126 -1.374 1.00 21.02 ? 57 TRP D CE2 1 +ATOM 5785 C CE3 . TRP D 1 57 ? 28.477 -5.733 -1.039 1.00 25.03 ? 57 TRP D CE3 1 +ATOM 5786 C CZ2 . TRP D 1 57 ? 29.375 -8.014 -2.383 1.00 17.71 ? 57 TRP D CZ2 1 +ATOM 5787 C CZ3 . TRP D 1 57 ? 29.431 -5.641 -2.050 1.00 21.38 ? 57 TRP D CZ3 1 +ATOM 5788 C CH2 . TRP D 1 57 ? 29.872 -6.770 -2.724 1.00 22.11 ? 57 TRP D CH2 1 +ATOM 5789 N N . PRO D 1 58 ? 24.975 -5.053 3.550 1.00 25.96 ? 58 PRO D N 1 +ATOM 5790 C CA . PRO D 1 58 ? 24.243 -3.935 4.118 1.00 27.58 ? 58 PRO D CA 1 +ATOM 5791 C C . PRO D 1 58 ? 25.031 -2.934 4.945 1.00 26.91 ? 58 PRO D C 1 +ATOM 5792 O O . PRO D 1 58 ? 24.675 -1.765 5.041 1.00 26.69 ? 58 PRO D O 1 +ATOM 5793 C CB . PRO D 1 58 ? 23.179 -4.595 4.938 1.00 22.24 ? 58 PRO D CB 1 +ATOM 5794 C CG . PRO D 1 58 ? 22.849 -5.783 4.153 1.00 10.73 ? 58 PRO D CG 1 +ATOM 5795 C CD . PRO D 1 58 ? 24.225 -6.256 3.932 1.00 22.76 ? 58 PRO D CD 1 +ATOM 5796 N N . THR D 1 59 ? 26.025 -3.422 5.690 1.00 27.22 ? 59 THR D N 1 +ATOM 5797 C CA . THR D 1 59 ? 26.860 -2.545 6.501 1.00 23.07 ? 59 THR D CA 1 +ATOM 5798 C C . THR D 1 59 ? 27.677 -1.607 5.618 1.00 13.27 ? 59 THR D C 1 +ATOM 5799 O O . THR D 1 59 ? 27.996 -0.508 6.040 1.00 12.53 ? 59 THR D O 1 +ATOM 5800 C CB . THR D 1 59 ? 27.805 -3.354 7.413 1.00 21.99 ? 59 THR D CB 1 +ATOM 5801 O OG1 . THR D 1 59 ? 28.542 -4.217 6.592 1.00 17.76 ? 59 THR D OG1 1 +ATOM 5802 C CG2 . THR D 1 59 ? 27.058 -4.158 8.435 1.00 22.73 ? 59 THR D CG2 1 +ATOM 5803 N N . LEU D 1 60 ? 27.932 -2.024 4.393 1.00 11.43 ? 60 LEU D N 1 +ATOM 5804 C CA . LEU D 1 60 ? 28.597 -1.216 3.423 1.00 18.51 ? 60 LEU D CA 1 +ATOM 5805 C C . LEU D 1 60 ? 27.704 -0.399 2.510 1.00 17.14 ? 60 LEU D C 1 +ATOM 5806 O O . LEU D 1 60 ? 28.261 0.163 1.577 1.00 20.70 ? 60 LEU D O 1 +ATOM 5807 C CB . LEU D 1 60 ? 29.490 -2.108 2.560 1.00 15.27 ? 60 LEU D CB 1 +ATOM 5808 C CG . LEU D 1 60 ? 30.662 -2.936 3.135 1.00 15.40 ? 60 LEU D CG 1 +ATOM 5809 C CD1 . LEU D 1 60 ? 31.537 -3.392 1.957 1.00 17.15 ? 60 LEU D CD1 1 +ATOM 5810 C CD2 . LEU D 1 60 ? 31.529 -2.163 4.050 1.00 4.50 ? 60 LEU D CD2 1 +ATOM 5811 N N . VAL D 1 61 ? 26.348 -0.318 2.619 1.00 20.12 ? 61 VAL D N 1 +ATOM 5812 C CA . VAL D 1 61 ? 25.567 0.445 1.653 1.00 13.55 ? 61 VAL D CA 1 +ATOM 5813 C C . VAL D 1 61 ? 25.879 1.944 1.728 1.00 15.06 ? 61 VAL D C 1 +ATOM 5814 O O . VAL D 1 61 ? 26.063 2.543 0.678 1.00 8.29 ? 61 VAL D O 1 +ATOM 5815 C CB . VAL D 1 61 ? 24.012 0.196 1.869 1.00 22.04 ? 61 VAL D CB 1 +ATOM 5816 C CG1 . VAL D 1 61 ? 23.105 1.165 1.090 1.00 8.67 ? 61 VAL D CG1 1 +ATOM 5817 C CG2 . VAL D 1 61 ? 23.669 -1.179 1.265 1.00 14.49 ? 61 VAL D CG2 1 +ATOM 5818 N N . THR D 1 62 ? 26.042 2.553 2.923 1.00 10.10 ? 62 THR D N 1 +ATOM 5819 C CA . THR D 1 62 ? 26.211 3.989 2.997 1.00 17.94 ? 62 THR D CA 1 +ATOM 5820 C C . THR D 1 62 ? 27.600 4.400 2.567 1.00 23.31 ? 62 THR D C 1 +ATOM 5821 O O . THR D 1 62 ? 27.831 5.488 2.031 1.00 27.87 ? 62 THR D O 1 +ATOM 5822 C CB . THR D 1 62 ? 25.862 4.445 4.443 1.00 16.09 ? 62 THR D CB 1 +ATOM 5823 O OG1 . THR D 1 62 ? 26.626 3.639 5.269 1.00 5.27 ? 62 THR D OG1 1 +ATOM 5824 C CG2 . THR D 1 62 ? 24.390 4.234 4.878 1.00 6.25 ? 62 THR D CG2 1 +ATOM 5825 N N . THR D 1 63 ? 28.522 3.430 2.668 1.00 26.25 ? 63 THR D N 1 +ATOM 5826 C CA . THR D 1 63 ? 29.872 3.641 2.230 1.00 11.60 ? 63 THR D CA 1 +ATOM 5827 C C . THR D 1 63 ? 29.903 3.649 0.734 1.00 11.93 ? 63 THR D C 1 +ATOM 5828 O O . THR D 1 63 ? 30.588 4.498 0.147 1.00 21.73 ? 63 THR D O 1 +ATOM 5829 C CB . THR D 1 63 ? 30.742 2.558 2.820 1.00 13.64 ? 63 THR D CB 1 +ATOM 5830 O OG1 . THR D 1 63 ? 30.860 2.719 4.259 1.00 8.95 ? 63 THR D OG1 1 +ATOM 5831 C CG2 . THR D 1 63 ? 32.103 2.651 2.191 1.00 11.80 ? 63 THR D CG2 1 +ATOM 5832 N N . PHE D 1 64 ? 29.169 2.781 0.067 1.00 11.58 ? 64 PHE D N 1 +ATOM 5833 C CA . PHE D 1 64 ? 29.176 2.760 -1.393 1.00 14.16 ? 64 PHE D CA 1 +ATOM 5834 C C . PHE D 1 64 ? 28.440 3.911 -2.125 1.00 15.78 ? 64 PHE D C 1 +ATOM 5835 O O . PHE D 1 64 ? 28.861 4.488 -3.148 1.00 9.99 ? 64 PHE D O 1 +ATOM 5836 C CB . PHE D 1 64 ? 28.575 1.456 -1.834 1.00 21.00 ? 64 PHE D CB 1 +ATOM 5837 C CG . PHE D 1 64 ? 29.249 0.126 -1.494 1.00 27.27 ? 64 PHE D CG 1 +ATOM 5838 C CD1 . PHE D 1 64 ? 30.619 0.001 -1.311 1.00 21.09 ? 64 PHE D CD1 1 +ATOM 5839 C CD2 . PHE D 1 64 ? 28.431 -0.998 -1.349 1.00 31.37 ? 64 PHE D CD2 1 +ATOM 5840 C CE1 . PHE D 1 64 ? 31.165 -1.222 -0.980 1.00 22.01 ? 64 PHE D CE1 1 +ATOM 5841 C CE2 . PHE D 1 64 ? 28.983 -2.227 -1.018 1.00 30.80 ? 64 PHE D CE2 1 +ATOM 5842 C CZ . PHE D 1 64 ? 30.354 -2.335 -0.833 1.00 28.62 ? 64 PHE D CZ 1 +HETATM 5843 N N1 . CRO D 1 65 ? 27.242 4.123 -1.554 1.00 21.37 ? 66 CRO D N1 1 +HETATM 5844 C CA1 . CRO D 1 65 ? 26.151 5.102 -1.883 1.00 36.73 ? 66 CRO D CA1 1 +HETATM 5845 C CB1 . CRO D 1 65 ? 24.815 4.362 -2.100 1.00 17.77 ? 66 CRO D CB1 1 +HETATM 5846 O OG1 . CRO D 1 65 ? 24.247 4.899 -3.260 1.00 20.07 ? 66 CRO D OG1 1 +HETATM 5847 C C1 . CRO D 1 65 ? 25.988 6.040 -0.702 1.00 14.00 ? 66 CRO D C1 1 +HETATM 5848 N N2 . CRO D 1 65 ? 24.888 5.853 0.066 1.00 8.59 ? 66 CRO D N2 1 +HETATM 5849 N N3 . CRO D 1 65 ? 26.829 7.014 -0.312 1.00 13.40 ? 66 CRO D N3 1 +HETATM 5850 C C2 . CRO D 1 65 ? 26.337 7.614 0.759 1.00 21.15 ? 66 CRO D C2 1 +HETATM 5851 O O2 . CRO D 1 65 ? 26.778 8.573 1.399 1.00 19.75 ? 66 CRO D O2 1 +HETATM 5852 C CA2 . CRO D 1 65 ? 25.064 6.882 1.063 1.00 15.73 ? 66 CRO D CA2 1 +HETATM 5853 C CA3 . CRO D 1 65 ? 28.063 7.376 -0.926 1.00 2.00 ? 66 CRO D CA3 1 +HETATM 5854 C C3 . CRO D 1 65 ? 28.219 8.185 -2.157 1.00 10.21 ? 66 CRO D C3 1 +HETATM 5855 O O3 . CRO D 1 65 ? 29.344 8.581 -2.479 1.00 14.50 ? 66 CRO D O3 1 +HETATM 5856 C CB2 . CRO D 1 65 ? 24.207 7.126 2.120 1.00 21.07 ? 66 CRO D CB2 1 +HETATM 5857 C CG2 . CRO D 1 65 ? 23.022 6.517 2.500 1.00 21.22 ? 66 CRO D CG2 1 +HETATM 5858 C CD1 . CRO D 1 65 ? 22.398 5.424 1.854 1.00 16.67 ? 66 CRO D CD1 1 +HETATM 5859 C CD2 . CRO D 1 65 ? 22.460 7.072 3.643 1.00 17.31 ? 66 CRO D CD2 1 +HETATM 5860 C CE1 . CRO D 1 65 ? 21.236 4.886 2.424 1.00 16.84 ? 66 CRO D CE1 1 +HETATM 5861 C CE2 . CRO D 1 65 ? 21.299 6.522 4.185 1.00 17.85 ? 66 CRO D CE2 1 +HETATM 5862 C CZ . CRO D 1 65 ? 20.688 5.451 3.574 1.00 11.55 ? 66 CRO D CZ 1 +HETATM 5863 O OH . CRO D 1 65 ? 19.527 4.961 4.165 1.00 19.35 ? 66 CRO D OH 1 +ATOM 5864 N N . VAL D 1 66 ? 27.193 8.287 -2.956 1.00 15.14 ? 68 VAL D N 1 +ATOM 5865 C CA . VAL D 1 66 ? 27.205 9.182 -4.087 1.00 13.61 ? 68 VAL D CA 1 +ATOM 5866 C C . VAL D 1 66 ? 25.928 10.001 -3.978 1.00 17.76 ? 68 VAL D C 1 +ATOM 5867 O O . VAL D 1 66 ? 25.112 10.202 -4.891 1.00 25.35 ? 68 VAL D O 1 +ATOM 5868 C CB . VAL D 1 66 ? 27.305 8.351 -5.374 1.00 15.13 ? 68 VAL D CB 1 +ATOM 5869 C CG1 . VAL D 1 66 ? 28.776 8.029 -5.418 1.00 20.42 ? 68 VAL D CG1 1 +ATOM 5870 C CG2 . VAL D 1 66 ? 26.584 6.999 -5.410 1.00 19.04 ? 68 VAL D CG2 1 +ATOM 5871 N N . GLN D 1 67 ? 25.792 10.539 -2.755 1.00 13.77 ? 69 GLN D N 1 +ATOM 5872 C CA . GLN D 1 67 ? 24.703 11.404 -2.362 1.00 7.66 ? 69 GLN D CA 1 +ATOM 5873 C C . GLN D 1 67 ? 24.518 12.627 -3.231 1.00 9.74 ? 69 GLN D C 1 +ATOM 5874 O O . GLN D 1 67 ? 23.511 13.315 -3.152 1.00 17.31 ? 69 GLN D O 1 +ATOM 5875 C CB . GLN D 1 67 ? 24.899 11.832 -0.951 1.00 4.97 ? 69 GLN D CB 1 +ATOM 5876 C CG . GLN D 1 67 ? 24.543 10.643 -0.060 1.00 2.00 ? 69 GLN D CG 1 +ATOM 5877 C CD . GLN D 1 67 ? 24.798 10.971 1.372 1.00 4.81 ? 69 GLN D CD 1 +ATOM 5878 O OE1 . GLN D 1 67 ? 25.572 11.893 1.695 1.00 20.25 ? 69 GLN D OE1 1 +ATOM 5879 N NE2 . GLN D 1 67 ? 24.197 10.252 2.300 1.00 3.68 ? 69 GLN D NE2 1 +ATOM 5880 N N . CYS D 1 68 ? 25.408 12.837 -4.171 1.00 11.58 ? 70 CYS D N 1 +ATOM 5881 C CA . CYS D 1 68 ? 25.271 13.862 -5.152 1.00 13.47 ? 70 CYS D CA 1 +ATOM 5882 C C . CYS D 1 68 ? 24.217 13.463 -6.145 1.00 16.79 ? 70 CYS D C 1 +ATOM 5883 O O . CYS D 1 68 ? 23.960 14.176 -7.106 1.00 18.96 ? 70 CYS D O 1 +ATOM 5884 C CB . CYS D 1 68 ? 26.594 14.049 -5.803 1.00 18.88 ? 70 CYS D CB 1 +ATOM 5885 S SG . CYS D 1 68 ? 27.342 12.554 -6.492 1.00 26.67 ? 70 CYS D SG 1 +ATOM 5886 N N . PHE D 1 69 ? 23.615 12.289 -5.964 1.00 16.32 ? 71 PHE D N 1 +ATOM 5887 C CA . PHE D 1 69 ? 22.554 11.867 -6.870 1.00 18.50 ? 71 PHE D CA 1 +ATOM 5888 C C . PHE D 1 69 ? 21.184 11.996 -6.216 1.00 17.03 ? 71 PHE D C 1 +ATOM 5889 O O . PHE D 1 69 ? 20.194 11.503 -6.767 1.00 18.08 ? 71 PHE D O 1 +ATOM 5890 C CB . PHE D 1 69 ? 22.767 10.440 -7.273 1.00 22.31 ? 71 PHE D CB 1 +ATOM 5891 C CG . PHE D 1 69 ? 23.861 10.298 -8.278 1.00 16.93 ? 71 PHE D CG 1 +ATOM 5892 C CD1 . PHE D 1 69 ? 23.603 10.663 -9.601 1.00 18.14 ? 71 PHE D CD1 1 +ATOM 5893 C CD2 . PHE D 1 69 ? 25.094 9.804 -7.882 1.00 11.98 ? 71 PHE D CD2 1 +ATOM 5894 C CE1 . PHE D 1 69 ? 24.614 10.525 -10.554 1.00 15.00 ? 71 PHE D CE1 1 +ATOM 5895 C CE2 . PHE D 1 69 ? 26.081 9.678 -8.856 1.00 13.80 ? 71 PHE D CE2 1 +ATOM 5896 C CZ . PHE D 1 69 ? 25.863 10.027 -10.186 1.00 4.04 ? 71 PHE D CZ 1 +ATOM 5897 N N . SER D 1 70 ? 21.186 12.627 -5.015 1.00 13.42 ? 72 SER D N 1 +ATOM 5898 C CA . SER D 1 70 ? 19.994 13.037 -4.320 1.00 17.58 ? 72 SER D CA 1 +ATOM 5899 C C . SER D 1 70 ? 19.196 13.938 -5.222 1.00 19.67 ? 72 SER D C 1 +ATOM 5900 O O . SER D 1 70 ? 19.721 14.582 -6.128 1.00 20.01 ? 72 SER D O 1 +ATOM 5901 C CB . SER D 1 70 ? 20.313 13.801 -3.075 1.00 16.13 ? 72 SER D CB 1 +ATOM 5902 O OG . SER D 1 70 ? 21.120 12.993 -2.227 1.00 16.59 ? 72 SER D OG 1 +ATOM 5903 N N . ARG D 1 71 ? 17.881 13.836 -5.089 1.00 24.37 ? 73 ARG D N 1 +ATOM 5904 C CA . ARG D 1 71 ? 17.037 14.683 -5.882 1.00 24.75 ? 73 ARG D CA 1 +ATOM 5905 C C . ARG D 1 71 ? 16.776 15.822 -4.937 1.00 27.00 ? 73 ARG D C 1 +ATOM 5906 O O . ARG D 1 71 ? 16.242 15.623 -3.846 1.00 25.08 ? 73 ARG D O 1 +ATOM 5907 C CB . ARG D 1 71 ? 15.720 14.027 -6.219 1.00 28.55 ? 73 ARG D CB 1 +ATOM 5908 C CG . ARG D 1 71 ? 14.975 14.788 -7.292 1.00 24.80 ? 73 ARG D CG 1 +ATOM 5909 C CD . ARG D 1 71 ? 13.596 14.175 -7.364 1.00 32.21 ? 73 ARG D CD 1 +ATOM 5910 N NE . ARG D 1 71 ? 12.663 15.271 -7.497 1.00 36.07 ? 73 ARG D NE 1 +ATOM 5911 C CZ . ARG D 1 71 ? 11.908 15.688 -6.489 1.00 33.99 ? 73 ARG D CZ 1 +ATOM 5912 N NH1 . ARG D 1 71 ? 11.936 15.105 -5.298 1.00 35.14 ? 73 ARG D NH1 1 +ATOM 5913 N NH2 . ARG D 1 71 ? 11.207 16.799 -6.663 1.00 35.81 ? 73 ARG D NH2 1 +ATOM 5914 N N . TYR D 1 72 ? 17.295 17.000 -5.334 1.00 27.69 ? 74 TYR D N 1 +ATOM 5915 C CA . TYR D 1 72 ? 16.920 18.185 -4.600 1.00 23.62 ? 74 TYR D CA 1 +ATOM 5916 C C . TYR D 1 72 ? 15.743 18.785 -5.344 1.00 20.55 ? 74 TYR D C 1 +ATOM 5917 O O . TYR D 1 72 ? 15.824 19.083 -6.538 1.00 20.63 ? 74 TYR D O 1 +ATOM 5918 C CB . TYR D 1 72 ? 18.090 19.158 -4.537 1.00 24.54 ? 74 TYR D CB 1 +ATOM 5919 C CG . TYR D 1 72 ? 18.998 18.852 -3.354 1.00 18.02 ? 74 TYR D CG 1 +ATOM 5920 C CD1 . TYR D 1 72 ? 19.812 17.705 -3.393 1.00 10.91 ? 74 TYR D CD1 1 +ATOM 5921 C CD2 . TYR D 1 72 ? 18.980 19.670 -2.219 1.00 5.10 ? 74 TYR D CD2 1 +ATOM 5922 C CE1 . TYR D 1 72 ? 20.593 17.346 -2.301 1.00 2.00 ? 74 TYR D CE1 1 +ATOM 5923 C CE2 . TYR D 1 72 ? 19.785 19.318 -1.127 1.00 9.70 ? 74 TYR D CE2 1 +ATOM 5924 C CZ . TYR D 1 72 ? 20.573 18.147 -1.186 1.00 2.00 ? 74 TYR D CZ 1 +ATOM 5925 O OH . TYR D 1 72 ? 21.316 17.781 -0.090 1.00 13.64 ? 74 TYR D OH 1 +ATOM 5926 N N . PRO D 1 73 ? 14.604 18.946 -4.662 1.00 20.04 ? 75 PRO D N 1 +ATOM 5927 C CA . PRO D 1 73 ? 13.537 19.801 -5.159 1.00 18.54 ? 75 PRO D CA 1 +ATOM 5928 C C . PRO D 1 73 ? 14.067 21.197 -5.463 1.00 21.10 ? 75 PRO D C 1 +ATOM 5929 O O . PRO D 1 73 ? 14.917 21.709 -4.740 1.00 23.29 ? 75 PRO D O 1 +ATOM 5930 C CB . PRO D 1 73 ? 12.470 19.744 -4.051 1.00 12.09 ? 75 PRO D CB 1 +ATOM 5931 C CG . PRO D 1 73 ? 13.129 19.135 -2.826 1.00 10.17 ? 75 PRO D CG 1 +ATOM 5932 C CD . PRO D 1 73 ? 14.258 18.290 -3.397 1.00 15.29 ? 75 PRO D CD 1 +ATOM 5933 N N . ASP D 1 74 ? 13.583 21.747 -6.575 1.00 21.84 ? 76 ASP D N 1 +ATOM 5934 C CA . ASP D 1 74 ? 13.850 23.083 -7.035 1.00 29.04 ? 76 ASP D CA 1 +ATOM 5935 C C . ASP D 1 74 ? 14.033 24.123 -5.945 1.00 28.98 ? 76 ASP D C 1 +ATOM 5936 O O . ASP D 1 74 ? 15.058 24.812 -5.924 1.00 37.66 ? 76 ASP D O 1 +ATOM 5937 C CB . ASP D 1 74 ? 12.725 23.483 -7.980 1.00 30.41 ? 76 ASP D CB 1 +ATOM 5938 C CG . ASP D 1 74 ? 12.729 22.660 -9.277 1.00 35.42 ? 76 ASP D CG 1 +ATOM 5939 O OD1 . ASP D 1 74 ? 12.727 21.426 -9.224 1.00 40.60 ? 76 ASP D OD1 1 +ATOM 5940 O OD2 . ASP D 1 74 ? 12.735 23.244 -10.360 1.00 35.68 ? 76 ASP D OD2 1 +ATOM 5941 N N . HIS D 1 75 ? 13.149 24.160 -4.956 1.00 24.05 ? 77 HIS D N 1 +ATOM 5942 C CA . HIS D 1 75 ? 13.286 25.127 -3.884 1.00 20.88 ? 77 HIS D CA 1 +ATOM 5943 C C . HIS D 1 75 ? 14.448 24.948 -2.941 1.00 22.48 ? 77 HIS D C 1 +ATOM 5944 O O . HIS D 1 75 ? 14.652 25.741 -1.987 1.00 25.52 ? 77 HIS D O 1 +ATOM 5945 C CB . HIS D 1 75 ? 11.995 25.156 -3.068 1.00 18.35 ? 77 HIS D CB 1 +ATOM 5946 C CG . HIS D 1 75 ? 11.671 23.946 -2.229 1.00 8.45 ? 77 HIS D CG 1 +ATOM 5947 N ND1 . HIS D 1 75 ? 11.123 22.798 -2.600 1.00 15.01 ? 77 HIS D ND1 1 +ATOM 5948 C CD2 . HIS D 1 75 ? 11.919 23.899 -0.887 1.00 10.21 ? 77 HIS D CD2 1 +ATOM 5949 C CE1 . HIS D 1 75 ? 11.062 22.080 -1.481 1.00 17.26 ? 77 HIS D CE1 1 +ATOM 5950 N NE2 . HIS D 1 75 ? 11.547 22.743 -0.447 1.00 2.00 ? 77 HIS D NE2 1 +ATOM 5951 N N . MET D 1 76 ? 15.182 23.835 -3.150 1.00 19.93 ? 78 MET D N 1 +ATOM 5952 C CA . MET D 1 76 ? 16.259 23.633 -2.218 1.00 17.09 ? 78 MET D CA 1 +ATOM 5953 C C . MET D 1 76 ? 17.558 23.195 -2.851 1.00 15.00 ? 78 MET D C 1 +ATOM 5954 O O . MET D 1 76 ? 18.514 22.846 -2.170 1.00 12.29 ? 78 MET D O 1 +ATOM 5955 C CB . MET D 1 76 ? 15.759 22.676 -1.068 1.00 21.75 ? 78 MET D CB 1 +ATOM 5956 C CG . MET D 1 76 ? 15.591 21.168 -1.187 1.00 24.55 ? 78 MET D CG 1 +ATOM 5957 S SD . MET D 1 76 ? 14.708 20.458 0.238 1.00 20.96 ? 78 MET D SD 1 +ATOM 5958 C CE . MET D 1 76 ? 15.967 20.301 1.447 1.00 21.08 ? 78 MET D CE 1 +ATOM 5959 N N . LYS D 1 77 ? 17.625 23.460 -4.161 1.00 11.94 ? 79 LYS D N 1 +ATOM 5960 C CA . LYS D 1 77 ? 18.812 23.278 -4.949 1.00 11.44 ? 79 LYS D CA 1 +ATOM 5961 C C . LYS D 1 77 ? 20.006 24.184 -4.574 1.00 20.62 ? 79 LYS D C 1 +ATOM 5962 O O . LYS D 1 77 ? 21.147 24.003 -4.999 1.00 28.83 ? 79 LYS D O 1 +ATOM 5963 C CB . LYS D 1 77 ? 18.432 23.486 -6.369 1.00 9.87 ? 79 LYS D CB 1 +ATOM 5964 C CG . LYS D 1 77 ? 17.643 22.305 -6.978 1.00 12.47 ? 79 LYS D CG 1 +ATOM 5965 C CD . LYS D 1 77 ? 17.819 22.458 -8.472 1.00 11.45 ? 79 LYS D CD 1 +ATOM 5966 C CE . LYS D 1 77 ? 17.005 21.522 -9.405 1.00 24.16 ? 79 LYS D CE 1 +ATOM 5967 N NZ . LYS D 1 77 ? 16.502 20.282 -8.821 1.00 17.94 ? 79 LYS D NZ 1 +ATOM 5968 N N . GLN D 1 78 ? 19.756 25.193 -3.755 1.00 26.58 ? 80 GLN D N 1 +ATOM 5969 C CA . GLN D 1 78 ? 20.725 26.108 -3.164 1.00 26.35 ? 80 GLN D CA 1 +ATOM 5970 C C . GLN D 1 78 ? 21.388 25.368 -2.004 1.00 24.07 ? 80 GLN D C 1 +ATOM 5971 O O . GLN D 1 78 ? 22.437 25.765 -1.477 1.00 26.91 ? 80 GLN D O 1 +ATOM 5972 C CB . GLN D 1 78 ? 19.964 27.372 -2.678 1.00 25.49 ? 80 GLN D CB 1 +ATOM 5973 C CG . GLN D 1 78 ? 20.591 28.314 -1.637 1.00 37.80 ? 80 GLN D CG 1 +ATOM 5974 C CD . GLN D 1 78 ? 19.655 28.924 -0.565 1.00 44.58 ? 80 GLN D CD 1 +ATOM 5975 O OE1 . GLN D 1 78 ? 20.053 29.166 0.590 1.00 39.87 ? 80 GLN D OE1 1 +ATOM 5976 N NE2 . GLN D 1 78 ? 18.380 29.197 -0.874 1.00 44.41 ? 80 GLN D NE2 1 +ATOM 5977 N N . HIS D 1 79 ? 20.774 24.257 -1.619 1.00 21.24 ? 81 HIS D N 1 +ATOM 5978 C CA . HIS D 1 79 ? 21.243 23.475 -0.467 1.00 24.66 ? 81 HIS D CA 1 +ATOM 5979 C C . HIS D 1 79 ? 22.014 22.190 -0.802 1.00 17.53 ? 81 HIS D C 1 +ATOM 5980 O O . HIS D 1 79 ? 22.414 21.443 0.075 1.00 23.37 ? 81 HIS D O 1 +ATOM 5981 C CB . HIS D 1 79 ? 20.048 23.128 0.396 1.00 19.27 ? 81 HIS D CB 1 +ATOM 5982 C CG . HIS D 1 79 ? 19.465 24.381 0.993 1.00 27.59 ? 81 HIS D CG 1 +ATOM 5983 N ND1 . HIS D 1 79 ? 18.425 25.080 0.565 1.00 26.97 ? 81 HIS D ND1 1 +ATOM 5984 C CD2 . HIS D 1 79 ? 19.941 24.972 2.130 1.00 24.98 ? 81 HIS D CD2 1 +ATOM 5985 C CE1 . HIS D 1 79 ? 18.269 26.064 1.412 1.00 22.57 ? 81 HIS D CE1 1 +ATOM 5986 N NE2 . HIS D 1 79 ? 19.170 26.002 2.350 1.00 25.01 ? 81 HIS D NE2 1 +ATOM 5987 N N . ASP D 1 80 ? 22.197 21.959 -2.084 1.00 12.58 ? 82 ASP D N 1 +ATOM 5988 C CA . ASP D 1 80 ? 22.909 20.805 -2.539 1.00 17.32 ? 82 ASP D CA 1 +ATOM 5989 C C . ASP D 1 80 ? 24.411 21.023 -2.652 1.00 14.73 ? 82 ASP D C 1 +ATOM 5990 O O . ASP D 1 80 ? 24.938 21.376 -3.716 1.00 4.45 ? 82 ASP D O 1 +ATOM 5991 C CB . ASP D 1 80 ? 22.317 20.405 -3.882 1.00 17.08 ? 82 ASP D CB 1 +ATOM 5992 C CG . ASP D 1 80 ? 22.804 19.076 -4.436 1.00 17.45 ? 82 ASP D CG 1 +ATOM 5993 O OD1 . ASP D 1 80 ? 23.548 18.374 -3.778 1.00 15.76 ? 82 ASP D OD1 1 +ATOM 5994 O OD2 . ASP D 1 80 ? 22.399 18.722 -5.534 1.00 14.84 ? 82 ASP D OD2 1 +ATOM 5995 N N . PHE D 1 81 ? 25.059 20.763 -1.505 1.00 15.45 ? 83 PHE D N 1 +ATOM 5996 C CA . PHE D 1 81 ? 26.522 20.747 -1.469 1.00 16.90 ? 83 PHE D CA 1 +ATOM 5997 C C . PHE D 1 81 ? 27.137 19.760 -2.453 1.00 17.62 ? 83 PHE D C 1 +ATOM 5998 O O . PHE D 1 81 ? 28.019 20.108 -3.236 1.00 25.58 ? 83 PHE D O 1 +ATOM 5999 C CB . PHE D 1 81 ? 26.937 20.425 -0.054 1.00 14.92 ? 83 PHE D CB 1 +ATOM 6000 C CG . PHE D 1 81 ? 28.397 20.050 0.071 1.00 25.40 ? 83 PHE D CG 1 +ATOM 6001 C CD1 . PHE D 1 81 ? 29.371 21.061 0.184 1.00 18.62 ? 83 PHE D CD1 1 +ATOM 6002 C CD2 . PHE D 1 81 ? 28.762 18.684 0.039 1.00 25.33 ? 83 PHE D CD2 1 +ATOM 6003 C CE1 . PHE D 1 81 ? 30.706 20.666 0.259 1.00 13.51 ? 83 PHE D CE1 1 +ATOM 6004 C CE2 . PHE D 1 81 ? 30.108 18.338 0.116 1.00 16.21 ? 83 PHE D CE2 1 +ATOM 6005 C CZ . PHE D 1 81 ? 31.066 19.323 0.223 1.00 10.45 ? 83 PHE D CZ 1 +ATOM 6006 N N . PHE D 1 82 ? 26.613 18.527 -2.472 1.00 16.72 ? 84 PHE D N 1 +ATOM 6007 C CA . PHE D 1 82 ? 27.173 17.408 -3.206 1.00 13.10 ? 84 PHE D CA 1 +ATOM 6008 C C . PHE D 1 82 ? 27.423 17.616 -4.660 1.00 10.93 ? 84 PHE D C 1 +ATOM 6009 O O . PHE D 1 82 ? 28.467 17.255 -5.174 1.00 21.15 ? 84 PHE D O 1 +ATOM 6010 C CB . PHE D 1 82 ? 26.296 16.227 -3.063 1.00 11.96 ? 84 PHE D CB 1 +ATOM 6011 C CG . PHE D 1 82 ? 25.954 15.873 -1.636 1.00 14.06 ? 84 PHE D CG 1 +ATOM 6012 C CD1 . PHE D 1 82 ? 26.869 15.167 -0.865 1.00 7.59 ? 84 PHE D CD1 1 +ATOM 6013 C CD2 . PHE D 1 82 ? 24.715 16.268 -1.125 1.00 10.92 ? 84 PHE D CD2 1 +ATOM 6014 C CE1 . PHE D 1 82 ? 26.554 14.846 0.437 1.00 13.73 ? 84 PHE D CE1 1 +ATOM 6015 C CE2 . PHE D 1 82 ? 24.404 15.940 0.190 1.00 11.55 ? 84 PHE D CE2 1 +ATOM 6016 C CZ . PHE D 1 82 ? 25.317 15.236 0.961 1.00 16.25 ? 84 PHE D CZ 1 +ATOM 6017 N N . LYS D 1 83 ? 26.470 18.198 -5.326 1.00 15.96 ? 85 LYS D N 1 +ATOM 6018 C CA . LYS D 1 83 ? 26.623 18.507 -6.715 1.00 17.73 ? 85 LYS D CA 1 +ATOM 6019 C C . LYS D 1 83 ? 27.390 19.805 -6.895 1.00 15.80 ? 85 LYS D C 1 +ATOM 6020 O O . LYS D 1 83 ? 27.962 20.033 -7.982 1.00 16.09 ? 85 LYS D O 1 +ATOM 6021 C CB . LYS D 1 83 ? 25.303 18.685 -7.405 1.00 21.06 ? 85 LYS D CB 1 +ATOM 6022 C CG . LYS D 1 83 ? 24.490 17.425 -7.424 1.00 23.00 ? 85 LYS D CG 1 +ATOM 6023 C CD . LYS D 1 83 ? 23.265 17.648 -8.337 1.00 19.77 ? 85 LYS D CD 1 +ATOM 6024 C CE . LYS D 1 83 ? 22.238 16.529 -8.149 1.00 10.69 ? 85 LYS D CE 1 +ATOM 6025 N NZ . LYS D 1 83 ? 22.106 16.226 -6.736 1.00 11.45 ? 85 LYS D NZ 1 +ATOM 6026 N N . SER D 1 84 ? 27.429 20.680 -5.882 1.00 15.63 ? 86 SER D N 1 +ATOM 6027 C CA . SER D 1 84 ? 28.128 21.949 -6.135 1.00 21.03 ? 86 SER D CA 1 +ATOM 6028 C C . SER D 1 84 ? 29.624 21.730 -6.124 1.00 19.82 ? 86 SER D C 1 +ATOM 6029 O O . SER D 1 84 ? 30.367 22.311 -6.932 1.00 19.13 ? 86 SER D O 1 +ATOM 6030 C CB . SER D 1 84 ? 27.788 22.994 -5.103 1.00 18.02 ? 86 SER D CB 1 +ATOM 6031 O OG . SER D 1 84 ? 28.266 22.733 -3.808 1.00 23.51 ? 86 SER D OG 1 +ATOM 6032 N N . ALA D 1 85 ? 30.006 20.770 -5.262 1.00 20.13 ? 87 ALA D N 1 +ATOM 6033 C CA . ALA D 1 85 ? 31.377 20.312 -5.201 1.00 15.09 ? 87 ALA D CA 1 +ATOM 6034 C C . ALA D 1 85 ? 31.846 19.613 -6.464 1.00 16.82 ? 87 ALA D C 1 +ATOM 6035 O O . ALA D 1 85 ? 33.024 19.310 -6.530 1.00 23.04 ? 87 ALA D O 1 +ATOM 6036 C CB . ALA D 1 85 ? 31.526 19.397 -4.063 1.00 11.30 ? 87 ALA D CB 1 +ATOM 6037 N N . MET D 1 86 ? 31.056 19.464 -7.547 1.00 19.08 ? 88 MET D N 1 +ATOM 6038 C CA . MET D 1 86 ? 31.465 18.741 -8.770 1.00 20.16 ? 88 MET D CA 1 +ATOM 6039 C C . MET D 1 86 ? 31.929 19.592 -9.937 1.00 22.30 ? 88 MET D C 1 +ATOM 6040 O O . MET D 1 86 ? 31.423 20.707 -10.032 1.00 23.94 ? 88 MET D O 1 +ATOM 6041 C CB . MET D 1 86 ? 30.280 17.841 -9.244 1.00 12.16 ? 88 MET D CB 1 +ATOM 6042 C CG . MET D 1 86 ? 29.977 16.827 -8.175 1.00 7.55 ? 88 MET D CG 1 +ATOM 6043 S SD . MET D 1 86 ? 31.223 15.513 -8.227 1.00 18.89 ? 88 MET D SD 1 +ATOM 6044 C CE . MET D 1 86 ? 31.093 15.011 -6.540 1.00 2.51 ? 88 MET D CE 1 +ATOM 6045 N N . PRO D 1 87 ? 32.781 19.185 -10.900 1.00 24.03 ? 89 PRO D N 1 +ATOM 6046 C CA . PRO D 1 87 ? 33.410 17.882 -11.014 1.00 25.24 ? 89 PRO D CA 1 +ATOM 6047 C C . PRO D 1 87 ? 34.536 17.489 -10.095 1.00 26.71 ? 89 PRO D C 1 +ATOM 6048 O O . PRO D 1 87 ? 34.717 16.309 -9.857 1.00 34.63 ? 89 PRO D O 1 +ATOM 6049 C CB . PRO D 1 87 ? 33.824 17.800 -12.444 1.00 29.22 ? 89 PRO D CB 1 +ATOM 6050 C CG . PRO D 1 87 ? 34.020 19.201 -12.928 1.00 33.98 ? 89 PRO D CG 1 +ATOM 6051 C CD . PRO D 1 87 ? 33.059 19.990 -12.072 1.00 30.41 ? 89 PRO D CD 1 +ATOM 6052 N N . GLU D 1 88 ? 35.236 18.416 -9.462 1.00 24.66 ? 90 GLU D N 1 +ATOM 6053 C CA . GLU D 1 88 ? 36.413 18.147 -8.673 1.00 20.37 ? 90 GLU D CA 1 +ATOM 6054 C C . GLU D 1 88 ? 36.152 17.219 -7.494 1.00 17.66 ? 90 GLU D C 1 +ATOM 6055 O O . GLU D 1 88 ? 37.024 16.538 -6.962 1.00 23.54 ? 90 GLU D O 1 +ATOM 6056 C CB . GLU D 1 88 ? 36.985 19.518 -8.178 1.00 25.91 ? 90 GLU D CB 1 +ATOM 6057 C CG . GLU D 1 88 ? 37.437 20.643 -9.161 1.00 32.03 ? 90 GLU D CG 1 +ATOM 6058 C CD . GLU D 1 88 ? 36.425 21.367 -10.104 1.00 44.88 ? 90 GLU D CD 1 +ATOM 6059 O OE1 . GLU D 1 88 ? 35.178 21.345 -9.919 1.00 35.82 ? 90 GLU D OE1 1 +ATOM 6060 O OE2 . GLU D 1 88 ? 36.935 21.971 -11.064 1.00 45.38 ? 90 GLU D OE2 1 +ATOM 6061 N N . GLY D 1 89 ? 34.963 17.336 -6.976 1.00 17.35 ? 91 GLY D N 1 +ATOM 6062 C CA . GLY D 1 89 ? 34.427 16.488 -5.958 1.00 8.32 ? 91 GLY D CA 1 +ATOM 6063 C C . GLY D 1 89 ? 34.629 16.897 -4.548 1.00 11.85 ? 91 GLY D C 1 +ATOM 6064 O O . GLY D 1 89 ? 35.026 18.005 -4.205 1.00 10.02 ? 91 GLY D O 1 +ATOM 6065 N N . TYR D 1 90 ? 34.300 15.896 -3.735 1.00 8.15 ? 92 TYR D N 1 +ATOM 6066 C CA . TYR D 1 90 ? 34.436 16.049 -2.330 1.00 13.73 ? 92 TYR D CA 1 +ATOM 6067 C C . TYR D 1 90 ? 34.948 14.727 -1.823 1.00 20.61 ? 92 TYR D C 1 +ATOM 6068 O O . TYR D 1 90 ? 35.093 13.718 -2.516 1.00 29.07 ? 92 TYR D O 1 +ATOM 6069 C CB . TYR D 1 90 ? 33.046 16.423 -1.680 1.00 22.86 ? 92 TYR D CB 1 +ATOM 6070 C CG . TYR D 1 90 ? 31.869 15.507 -2.042 1.00 18.38 ? 92 TYR D CG 1 +ATOM 6071 C CD1 . TYR D 1 90 ? 31.120 15.761 -3.196 1.00 20.34 ? 92 TYR D CD1 1 +ATOM 6072 C CD2 . TYR D 1 90 ? 31.573 14.412 -1.243 1.00 6.82 ? 92 TYR D CD2 1 +ATOM 6073 C CE1 . TYR D 1 90 ? 30.082 14.909 -3.542 1.00 21.27 ? 92 TYR D CE1 1 +ATOM 6074 C CE2 . TYR D 1 90 ? 30.526 13.556 -1.575 1.00 17.74 ? 92 TYR D CE2 1 +ATOM 6075 C CZ . TYR D 1 90 ? 29.782 13.810 -2.729 1.00 27.22 ? 92 TYR D CZ 1 +ATOM 6076 O OH . TYR D 1 90 ? 28.722 12.995 -3.086 1.00 24.33 ? 92 TYR D OH 1 +ATOM 6077 N N . VAL D 1 91 ? 35.241 14.822 -0.546 1.00 19.76 ? 93 VAL D N 1 +ATOM 6078 C CA . VAL D 1 91 ? 35.724 13.750 0.232 1.00 20.76 ? 93 VAL D CA 1 +ATOM 6079 C C . VAL D 1 91 ? 34.716 13.527 1.307 1.00 20.39 ? 93 VAL D C 1 +ATOM 6080 O O . VAL D 1 91 ? 34.543 14.369 2.185 1.00 25.32 ? 93 VAL D O 1 +ATOM 6081 C CB . VAL D 1 91 ? 37.072 14.095 0.870 1.00 17.99 ? 93 VAL D CB 1 +ATOM 6082 C CG1 . VAL D 1 91 ? 37.498 13.153 1.957 1.00 16.37 ? 93 VAL D CG1 1 +ATOM 6083 C CG2 . VAL D 1 91 ? 38.082 13.968 -0.205 1.00 15.06 ? 93 VAL D CG2 1 +ATOM 6084 N N . GLN D 1 92 ? 34.126 12.348 1.225 1.00 20.41 ? 94 GLN D N 1 +ATOM 6085 C CA . GLN D 1 92 ? 33.212 11.877 2.255 1.00 20.56 ? 94 GLN D CA 1 +ATOM 6086 C C . GLN D 1 92 ? 34.013 10.999 3.161 1.00 21.66 ? 94 GLN D C 1 +ATOM 6087 O O . GLN D 1 92 ? 34.701 10.105 2.688 1.00 28.18 ? 94 GLN D O 1 +ATOM 6088 C CB . GLN D 1 92 ? 32.100 11.042 1.674 1.00 22.08 ? 94 GLN D CB 1 +ATOM 6089 C CG . GLN D 1 92 ? 30.987 10.642 2.660 1.00 17.61 ? 94 GLN D CG 1 +ATOM 6090 C CD . GLN D 1 92 ? 29.800 10.204 1.840 1.00 15.54 ? 94 GLN D CD 1 +ATOM 6091 O OE1 . GLN D 1 92 ? 29.265 10.935 1.002 1.00 17.45 ? 94 GLN D OE1 1 +ATOM 6092 N NE2 . GLN D 1 92 ? 29.400 8.969 2.051 1.00 22.23 ? 94 GLN D NE2 1 +ATOM 6093 N N . GLU D 1 93 ? 33.970 11.289 4.444 1.00 18.78 ? 95 GLU D N 1 +ATOM 6094 C CA . GLU D 1 93 ? 34.655 10.501 5.419 1.00 14.41 ? 95 GLU D CA 1 +ATOM 6095 C C . GLU D 1 93 ? 33.574 10.176 6.446 1.00 16.83 ? 95 GLU D C 1 +ATOM 6096 O O . GLU D 1 93 ? 32.803 11.028 6.879 1.00 9.14 ? 95 GLU D O 1 +ATOM 6097 C CB . GLU D 1 93 ? 35.748 11.263 6.162 1.00 18.30 ? 95 GLU D CB 1 +ATOM 6098 C CG . GLU D 1 93 ? 36.800 12.077 5.408 1.00 27.53 ? 95 GLU D CG 1 +ATOM 6099 C CD . GLU D 1 93 ? 37.992 12.427 6.293 1.00 33.65 ? 95 GLU D CD 1 +ATOM 6100 O OE1 . GLU D 1 93 ? 37.842 12.927 7.415 1.00 30.47 ? 95 GLU D OE1 1 +ATOM 6101 O OE2 . GLU D 1 93 ? 39.103 12.165 5.849 1.00 39.34 ? 95 GLU D OE2 1 +ATOM 6102 N N . ARG D 1 94 ? 33.524 8.941 6.923 1.00 18.25 ? 96 ARG D N 1 +ATOM 6103 C CA . ARG D 1 94 ? 32.556 8.576 7.922 1.00 16.73 ? 96 ARG D CA 1 +ATOM 6104 C C . ARG D 1 94 ? 33.164 7.737 9.009 1.00 19.26 ? 96 ARG D C 1 +ATOM 6105 O O . ARG D 1 94 ? 34.198 7.105 8.835 1.00 26.80 ? 96 ARG D O 1 +ATOM 6106 C CB . ARG D 1 94 ? 31.430 7.742 7.339 1.00 10.83 ? 96 ARG D CB 1 +ATOM 6107 C CG . ARG D 1 94 ? 30.474 8.305 6.319 1.00 6.81 ? 96 ARG D CG 1 +ATOM 6108 C CD . ARG D 1 94 ? 29.092 7.680 6.685 1.00 5.30 ? 96 ARG D CD 1 +ATOM 6109 N NE . ARG D 1 94 ? 28.070 8.316 5.908 1.00 2.00 ? 96 ARG D NE 1 +ATOM 6110 C CZ . ARG D 1 94 ? 27.898 8.013 4.638 1.00 2.00 ? 96 ARG D CZ 1 +ATOM 6111 N NH1 . ARG D 1 94 ? 28.628 7.101 4.041 1.00 4.17 ? 96 ARG D NH1 1 +ATOM 6112 N NH2 . ARG D 1 94 ? 27.064 8.720 3.902 1.00 2.00 ? 96 ARG D NH2 1 +ATOM 6113 N N . THR D 1 95 ? 32.421 7.728 10.102 1.00 18.63 ? 97 THR D N 1 +ATOM 6114 C CA . THR D 1 95 ? 32.610 6.783 11.165 1.00 18.88 ? 97 THR D CA 1 +ATOM 6115 C C . THR D 1 95 ? 31.240 6.098 11.269 1.00 19.29 ? 97 THR D C 1 +ATOM 6116 O O . THR D 1 95 ? 30.235 6.676 11.655 1.00 18.58 ? 97 THR D O 1 +ATOM 6117 C CB . THR D 1 95 ? 32.983 7.494 12.440 1.00 16.95 ? 97 THR D CB 1 +ATOM 6118 O OG1 . THR D 1 95 ? 34.205 8.110 12.051 1.00 26.03 ? 97 THR D OG1 1 +ATOM 6119 C CG2 . THR D 1 95 ? 33.201 6.649 13.687 1.00 20.24 ? 97 THR D CG2 1 +ATOM 6120 N N . ILE D 1 96 ? 31.166 4.854 10.801 1.00 17.03 ? 98 ILE D N 1 +ATOM 6121 C CA . ILE D 1 96 ? 29.989 4.025 10.984 1.00 10.12 ? 98 ILE D CA 1 +ATOM 6122 C C . ILE D 1 96 ? 30.346 3.314 12.238 1.00 10.22 ? 98 ILE D C 1 +ATOM 6123 O O . ILE D 1 96 ? 31.321 2.619 12.261 1.00 20.06 ? 98 ILE D O 1 +ATOM 6124 C CB . ILE D 1 96 ? 29.838 3.080 9.788 1.00 9.36 ? 98 ILE D CB 1 +ATOM 6125 C CG1 . ILE D 1 96 ? 29.816 3.939 8.510 1.00 5.28 ? 98 ILE D CG1 1 +ATOM 6126 C CG2 . ILE D 1 96 ? 28.545 2.267 9.904 1.00 2.00 ? 98 ILE D CG2 1 +ATOM 6127 C CD1 . ILE D 1 96 ? 29.730 3.152 7.230 1.00 12.60 ? 98 ILE D CD1 1 +ATOM 6128 N N . SER D 1 97 ? 29.636 3.530 13.321 1.00 13.14 ? 99 SER D N 1 +ATOM 6129 C CA . SER D 1 97 ? 29.864 2.933 14.568 1.00 7.35 ? 99 SER D CA 1 +ATOM 6130 C C . SER D 1 97 ? 28.710 1.985 14.971 1.00 19.48 ? 99 SER D C 1 +ATOM 6131 O O . SER D 1 97 ? 27.668 2.382 15.507 1.00 22.35 ? 99 SER D O 1 +ATOM 6132 C CB . SER D 1 97 ? 30.054 4.063 15.484 1.00 6.80 ? 99 SER D CB 1 +ATOM 6133 O OG . SER D 1 97 ? 29.871 3.708 16.838 1.00 14.22 ? 99 SER D OG 1 +ATOM 6134 N N . PHE D 1 98 ? 28.938 0.672 14.788 1.00 17.66 ? 100 PHE D N 1 +ATOM 6135 C CA . PHE D 1 98 ? 27.976 -0.369 15.089 1.00 15.95 ? 100 PHE D CA 1 +ATOM 6136 C C . PHE D 1 98 ? 27.747 -0.558 16.544 1.00 20.67 ? 100 PHE D C 1 +ATOM 6137 O O . PHE D 1 98 ? 28.664 -0.974 17.237 1.00 26.13 ? 100 PHE D O 1 +ATOM 6138 C CB . PHE D 1 98 ? 28.440 -1.648 14.522 1.00 7.51 ? 100 PHE D CB 1 +ATOM 6139 C CG . PHE D 1 98 ? 28.471 -1.493 13.021 1.00 4.46 ? 100 PHE D CG 1 +ATOM 6140 C CD1 . PHE D 1 98 ? 29.601 -1.001 12.413 1.00 2.98 ? 100 PHE D CD1 1 +ATOM 6141 C CD2 . PHE D 1 98 ? 27.380 -1.846 12.279 1.00 2.27 ? 100 PHE D CD2 1 +ATOM 6142 C CE1 . PHE D 1 98 ? 29.630 -0.875 11.039 1.00 2.00 ? 100 PHE D CE1 1 +ATOM 6143 C CE2 . PHE D 1 98 ? 27.412 -1.705 10.906 1.00 2.91 ? 100 PHE D CE2 1 +ATOM 6144 C CZ . PHE D 1 98 ? 28.530 -1.227 10.276 1.00 2.88 ? 100 PHE D CZ 1 +ATOM 6145 N N . LYS D 1 99 ? 26.514 -0.316 17.015 1.00 22.99 ? 101 LYS D N 1 +ATOM 6146 C CA . LYS D 1 99 ? 26.266 -0.374 18.441 1.00 26.73 ? 101 LYS D CA 1 +ATOM 6147 C C . LYS D 1 99 ? 26.592 -1.767 18.983 1.00 28.86 ? 101 LYS D C 1 +ATOM 6148 O O . LYS D 1 99 ? 26.425 -2.791 18.309 1.00 26.93 ? 101 LYS D O 1 +ATOM 6149 C CB . LYS D 1 99 ? 24.813 0.021 18.677 1.00 28.15 ? 101 LYS D CB 1 +ATOM 6150 C CG . LYS D 1 99 ? 24.601 0.452 20.136 1.00 31.89 ? 101 LYS D CG 1 +ATOM 6151 C CD . LYS D 1 99 ? 23.099 0.615 20.364 1.00 38.24 ? 101 LYS D CD 1 +ATOM 6152 C CE . LYS D 1 99 ? 22.763 0.941 21.824 1.00 45.26 ? 101 LYS D CE 1 +ATOM 6153 N NZ . LYS D 1 99 ? 21.321 0.810 22.025 1.00 49.91 ? 101 LYS D NZ 1 +ATOM 6154 N N . ASP D 1 100 ? 27.197 -1.776 20.171 1.00 29.09 ? 102 ASP D N 1 +ATOM 6155 C CA . ASP D 1 100 ? 27.683 -2.989 20.797 1.00 30.61 ? 102 ASP D CA 1 +ATOM 6156 C C . ASP D 1 100 ? 28.707 -3.766 19.932 1.00 32.14 ? 102 ASP D C 1 +ATOM 6157 O O . ASP D 1 100 ? 28.981 -4.950 20.186 1.00 33.77 ? 102 ASP D O 1 +ATOM 6158 C CB . ASP D 1 100 ? 26.458 -3.874 21.148 1.00 29.32 ? 102 ASP D CB 1 +ATOM 6159 C CG . ASP D 1 100 ? 25.478 -3.264 22.152 1.00 33.17 ? 102 ASP D CG 1 +ATOM 6160 O OD1 . ASP D 1 100 ? 25.889 -2.482 23.011 1.00 34.11 ? 102 ASP D OD1 1 +ATOM 6161 O OD2 . ASP D 1 100 ? 24.291 -3.576 22.073 1.00 31.22 ? 102 ASP D OD2 1 +ATOM 6162 N N . ASP D 1 101 ? 29.306 -3.174 18.884 1.00 25.82 ? 103 ASP D N 1 +ATOM 6163 C CA . ASP D 1 101 ? 30.267 -3.899 18.061 1.00 27.80 ? 103 ASP D CA 1 +ATOM 6164 C C . ASP D 1 101 ? 31.387 -2.971 17.559 1.00 26.97 ? 103 ASP D C 1 +ATOM 6165 O O . ASP D 1 101 ? 31.848 -2.062 18.271 1.00 29.26 ? 103 ASP D O 1 +ATOM 6166 C CB . ASP D 1 101 ? 29.449 -4.544 16.930 1.00 35.47 ? 103 ASP D CB 1 +ATOM 6167 C CG . ASP D 1 101 ? 29.997 -5.808 16.263 1.00 40.75 ? 103 ASP D CG 1 +ATOM 6168 O OD1 . ASP D 1 101 ? 31.211 -5.966 16.155 1.00 39.31 ? 103 ASP D OD1 1 +ATOM 6169 O OD2 . ASP D 1 101 ? 29.203 -6.641 15.823 1.00 42.00 ? 103 ASP D OD2 1 +ATOM 6170 N N . GLY D 1 102 ? 31.862 -3.114 16.327 1.00 24.29 ? 104 GLY D N 1 +ATOM 6171 C CA . GLY D 1 102 ? 32.952 -2.276 15.884 1.00 24.85 ? 104 GLY D CA 1 +ATOM 6172 C C . GLY D 1 102 ? 32.506 -1.034 15.149 1.00 24.02 ? 104 GLY D C 1 +ATOM 6173 O O . GLY D 1 102 ? 31.345 -0.619 15.154 1.00 25.80 ? 104 GLY D O 1 +ATOM 6174 N N . ASN D 1 103 ? 33.504 -0.470 14.475 1.00 20.31 ? 105 ASN D N 1 +ATOM 6175 C CA . ASN D 1 103 ? 33.243 0.695 13.699 1.00 14.97 ? 105 ASN D CA 1 +ATOM 6176 C C . ASN D 1 103 ? 33.962 0.655 12.410 1.00 16.27 ? 105 ASN D C 1 +ATOM 6177 O O . ASN D 1 103 ? 35.070 0.136 12.375 1.00 25.34 ? 105 ASN D O 1 +ATOM 6178 C CB . ASN D 1 103 ? 33.670 1.954 14.438 1.00 16.85 ? 105 ASN D CB 1 +ATOM 6179 C CG . ASN D 1 103 ? 35.097 1.957 14.964 1.00 13.87 ? 105 ASN D CG 1 +ATOM 6180 O OD1 . ASN D 1 103 ? 36.000 2.239 14.187 1.00 7.60 ? 105 ASN D OD1 1 +ATOM 6181 N ND2 . ASN D 1 103 ? 35.307 1.671 16.265 1.00 8.41 ? 105 ASN D ND2 1 +ATOM 6182 N N . TYR D 1 104 ? 33.296 1.112 11.354 1.00 13.01 ? 106 TYR D N 1 +ATOM 6183 C CA . TYR D 1 104 ? 33.997 1.397 10.128 1.00 10.85 ? 106 TYR D CA 1 +ATOM 6184 C C . TYR D 1 104 ? 34.408 2.855 10.230 1.00 17.16 ? 106 TYR D C 1 +ATOM 6185 O O . TYR D 1 104 ? 33.900 3.604 11.067 1.00 22.87 ? 106 TYR D O 1 +ATOM 6186 C CB . TYR D 1 104 ? 33.139 1.269 8.913 1.00 14.00 ? 106 TYR D CB 1 +ATOM 6187 C CG . TYR D 1 104 ? 32.489 -0.091 8.700 1.00 21.39 ? 106 TYR D CG 1 +ATOM 6188 C CD1 . TYR D 1 104 ? 33.051 -1.236 9.288 1.00 21.22 ? 106 TYR D CD1 1 +ATOM 6189 C CD2 . TYR D 1 104 ? 31.396 -0.207 7.818 1.00 15.27 ? 106 TYR D CD2 1 +ATOM 6190 C CE1 . TYR D 1 104 ? 32.551 -2.500 8.996 1.00 16.54 ? 106 TYR D CE1 1 +ATOM 6191 C CE2 . TYR D 1 104 ? 30.913 -1.474 7.522 1.00 21.66 ? 106 TYR D CE2 1 +ATOM 6192 C CZ . TYR D 1 104 ? 31.502 -2.612 8.116 1.00 19.59 ? 106 TYR D CZ 1 +ATOM 6193 O OH . TYR D 1 104 ? 31.057 -3.870 7.810 1.00 13.91 ? 106 TYR D OH 1 +ATOM 6194 N N . LYS D 1 105 ? 35.437 3.238 9.480 1.00 18.18 ? 107 LYS D N 1 +ATOM 6195 C CA . LYS D 1 105 ? 35.929 4.595 9.378 1.00 14.79 ? 107 LYS D CA 1 +ATOM 6196 C C . LYS D 1 105 ? 36.215 4.531 7.915 1.00 18.38 ? 107 LYS D C 1 +ATOM 6197 O O . LYS D 1 105 ? 36.804 3.580 7.420 1.00 22.26 ? 107 LYS D O 1 +ATOM 6198 C CB . LYS D 1 105 ? 37.181 4.823 10.184 1.00 18.09 ? 107 LYS D CB 1 +ATOM 6199 C CG . LYS D 1 105 ? 36.706 5.315 11.559 1.00 18.67 ? 107 LYS D CG 1 +ATOM 6200 C CD . LYS D 1 105 ? 37.767 5.430 12.631 1.00 15.14 ? 107 LYS D CD 1 +ATOM 6201 C CE . LYS D 1 105 ? 37.130 6.188 13.802 1.00 23.47 ? 107 LYS D CE 1 +ATOM 6202 N NZ . LYS D 1 105 ? 37.232 5.524 15.088 1.00 33.20 ? 107 LYS D NZ 1 +ATOM 6203 N N . THR D 1 106 ? 35.646 5.469 7.180 1.00 15.59 ? 108 THR D N 1 +ATOM 6204 C CA . THR D 1 106 ? 35.829 5.453 5.759 1.00 15.95 ? 108 THR D CA 1 +ATOM 6205 C C . THR D 1 106 ? 36.339 6.812 5.361 1.00 13.65 ? 108 THR D C 1 +ATOM 6206 O O . THR D 1 106 ? 36.334 7.768 6.136 1.00 13.41 ? 108 THR D O 1 +ATOM 6207 C CB . THR D 1 106 ? 34.481 5.126 5.083 1.00 21.11 ? 108 THR D CB 1 +ATOM 6208 O OG1 . THR D 1 106 ? 33.638 6.253 5.343 1.00 28.63 ? 108 THR D OG1 1 +ATOM 6209 C CG2 . THR D 1 106 ? 33.840 3.843 5.603 1.00 11.83 ? 108 THR D CG2 1 +ATOM 6210 N N . ARG D 1 107 ? 36.823 6.859 4.142 1.00 5.49 ? 109 ARG D N 1 +ATOM 6211 C CA . ARG D 1 107 ? 37.341 8.101 3.651 1.00 9.65 ? 109 ARG D CA 1 +ATOM 6212 C C . ARG D 1 107 ? 37.087 7.769 2.238 1.00 7.92 ? 109 ARG D C 1 +ATOM 6213 O O . ARG D 1 107 ? 37.455 6.694 1.771 1.00 14.80 ? 109 ARG D O 1 +ATOM 6214 C CB . ARG D 1 107 ? 38.885 8.301 3.833 1.00 16.18 ? 109 ARG D CB 1 +ATOM 6215 C CG . ARG D 1 107 ? 39.243 9.777 3.883 1.00 27.26 ? 109 ARG D CG 1 +ATOM 6216 C CD . ARG D 1 107 ? 40.675 10.295 3.623 1.00 25.92 ? 109 ARG D CD 1 +ATOM 6217 N NE . ARG D 1 107 ? 40.900 10.204 2.199 1.00 21.35 ? 109 ARG D NE 1 +ATOM 6218 C CZ . ARG D 1 107 ? 41.135 11.229 1.412 1.00 21.56 ? 109 ARG D CZ 1 +ATOM 6219 N NH1 . ARG D 1 107 ? 41.207 12.485 1.889 1.00 24.92 ? 109 ARG D NH1 1 +ATOM 6220 N NH2 . ARG D 1 107 ? 41.222 10.945 0.116 1.00 12.19 ? 109 ARG D NH2 1 +ATOM 6221 N N . ALA D 1 108 ? 36.477 8.691 1.526 1.00 6.55 ? 110 ALA D N 1 +ATOM 6222 C CA . ALA D 1 108 ? 36.262 8.416 0.128 1.00 8.03 ? 110 ALA D CA 1 +ATOM 6223 C C . ALA D 1 108 ? 36.355 9.698 -0.613 1.00 9.92 ? 110 ALA D C 1 +ATOM 6224 O O . ALA D 1 108 ? 36.163 10.741 0.004 1.00 16.51 ? 110 ALA D O 1 +ATOM 6225 C CB . ALA D 1 108 ? 34.874 7.821 -0.109 1.00 6.72 ? 110 ALA D CB 1 +ATOM 6226 N N . GLU D 1 109 ? 36.631 9.604 -1.906 1.00 6.83 ? 111 GLU D N 1 +ATOM 6227 C CA . GLU D 1 109 ? 36.662 10.758 -2.742 1.00 15.39 ? 111 GLU D CA 1 +ATOM 6228 C C . GLU D 1 109 ? 35.666 10.474 -3.822 1.00 18.61 ? 111 GLU D C 1 +ATOM 6229 O O . GLU D 1 109 ? 35.818 9.536 -4.616 1.00 25.60 ? 111 GLU D O 1 +ATOM 6230 C CB . GLU D 1 109 ? 38.005 11.020 -3.438 1.00 20.44 ? 111 GLU D CB 1 +ATOM 6231 C CG . GLU D 1 109 ? 39.103 11.353 -2.428 1.00 29.46 ? 111 GLU D CG 1 +ATOM 6232 C CD . GLU D 1 109 ? 40.474 11.723 -2.997 1.00 38.89 ? 111 GLU D CD 1 +ATOM 6233 O OE1 . GLU D 1 109 ? 40.730 11.552 -4.198 1.00 34.62 ? 111 GLU D OE1 1 +ATOM 6234 O OE2 . GLU D 1 109 ? 41.296 12.201 -2.210 1.00 46.49 ? 111 GLU D OE2 1 +ATOM 6235 N N . VAL D 1 110 ? 34.669 11.383 -3.841 1.00 15.11 ? 112 VAL D N 1 +ATOM 6236 C CA . VAL D 1 110 ? 33.637 11.267 -4.826 1.00 11.68 ? 112 VAL D CA 1 +ATOM 6237 C C . VAL D 1 110 ? 33.936 12.388 -5.731 1.00 12.95 ? 112 VAL D C 1 +ATOM 6238 O O . VAL D 1 110 ? 34.023 13.536 -5.288 1.00 23.09 ? 112 VAL D O 1 +ATOM 6239 C CB . VAL D 1 110 ? 32.267 11.434 -4.186 1.00 15.53 ? 112 VAL D CB 1 +ATOM 6240 C CG1 . VAL D 1 110 ? 31.259 11.157 -5.275 1.00 6.35 ? 112 VAL D CG1 1 +ATOM 6241 C CG2 . VAL D 1 110 ? 32.101 10.535 -2.941 1.00 12.53 ? 112 VAL D CG2 1 +ATOM 6242 N N . LYS D 1 111 ? 34.089 12.097 -7.007 1.00 8.75 ? 113 LYS D N 1 +ATOM 6243 C CA . LYS D 1 111 ? 34.407 13.140 -7.961 1.00 9.73 ? 113 LYS D CA 1 +ATOM 6244 C C . LYS D 1 111 ? 34.148 12.561 -9.290 1.00 6.73 ? 113 LYS D C 1 +ATOM 6245 O O . LYS D 1 111 ? 34.005 11.351 -9.384 1.00 21.09 ? 113 LYS D O 1 +ATOM 6246 C CB . LYS D 1 111 ? 35.903 13.585 -7.942 1.00 21.39 ? 113 LYS D CB 1 +ATOM 6247 C CG . LYS D 1 111 ? 36.942 12.591 -8.490 1.00 31.41 ? 113 LYS D CG 1 +ATOM 6248 C CD . LYS D 1 111 ? 38.332 13.188 -8.735 1.00 39.21 ? 113 LYS D CD 1 +ATOM 6249 C CE . LYS D 1 111 ? 39.260 13.176 -7.520 1.00 35.77 ? 113 LYS D CE 1 +ATOM 6250 N NZ . LYS D 1 111 ? 39.478 11.817 -7.067 1.00 32.83 ? 113 LYS D NZ 1 +ATOM 6251 N N . PHE D 1 112 ? 34.053 13.387 -10.317 1.00 12.29 ? 114 PHE D N 1 +ATOM 6252 C CA . PHE D 1 112 ? 33.959 12.918 -11.680 1.00 23.06 ? 114 PHE D CA 1 +ATOM 6253 C C . PHE D 1 112 ? 35.359 12.592 -12.168 1.00 32.51 ? 114 PHE D C 1 +ATOM 6254 O O . PHE D 1 112 ? 36.355 13.204 -11.757 1.00 40.84 ? 114 PHE D O 1 +ATOM 6255 C CB . PHE D 1 112 ? 33.387 13.994 -12.589 1.00 26.20 ? 114 PHE D CB 1 +ATOM 6256 C CG . PHE D 1 112 ? 31.891 13.981 -12.706 1.00 21.25 ? 114 PHE D CG 1 +ATOM 6257 C CD1 . PHE D 1 112 ? 31.112 14.436 -11.648 1.00 25.00 ? 114 PHE D CD1 1 +ATOM 6258 C CD2 . PHE D 1 112 ? 31.314 13.492 -13.874 1.00 22.03 ? 114 PHE D CD2 1 +ATOM 6259 C CE1 . PHE D 1 112 ? 29.728 14.393 -11.770 1.00 20.99 ? 114 PHE D CE1 1 +ATOM 6260 C CE2 . PHE D 1 112 ? 29.926 13.460 -13.985 1.00 29.19 ? 114 PHE D CE2 1 +ATOM 6261 C CZ . PHE D 1 112 ? 29.127 13.910 -12.931 1.00 25.96 ? 114 PHE D CZ 1 +ATOM 6262 N N . GLU D 1 113 ? 35.439 11.611 -13.051 1.00 34.83 ? 115 GLU D N 1 +ATOM 6263 C CA . GLU D 1 113 ? 36.698 11.232 -13.654 1.00 37.44 ? 115 GLU D CA 1 +ATOM 6264 C C . GLU D 1 113 ? 36.166 10.933 -15.027 1.00 38.14 ? 115 GLU D C 1 +ATOM 6265 O O . GLU D 1 113 ? 35.540 9.914 -15.293 1.00 41.50 ? 115 GLU D O 1 +ATOM 6266 C CB . GLU D 1 113 ? 37.316 9.996 -12.975 1.00 42.24 ? 115 GLU D CB 1 +ATOM 6267 C CG . GLU D 1 113 ? 38.028 10.297 -11.665 1.00 42.95 ? 115 GLU D CG 1 +ATOM 6268 C CD . GLU D 1 113 ? 38.545 9.076 -10.913 1.00 49.73 ? 115 GLU D CD 1 +ATOM 6269 O OE1 . GLU D 1 113 ? 39.138 8.199 -11.546 1.00 57.68 ? 115 GLU D OE1 1 +ATOM 6270 O OE2 . GLU D 1 113 ? 38.369 9.000 -9.692 1.00 46.87 ? 115 GLU D OE2 1 +ATOM 6271 N N . GLY D 1 114 ? 36.379 11.909 -15.906 1.00 39.63 ? 116 GLY D N 1 +ATOM 6272 C CA . GLY D 1 114 ? 35.781 11.865 -17.227 1.00 40.43 ? 116 GLY D CA 1 +ATOM 6273 C C . GLY D 1 114 ? 34.270 11.910 -17.058 1.00 40.21 ? 116 GLY D C 1 +ATOM 6274 O O . GLY D 1 114 ? 33.782 12.544 -16.127 1.00 39.38 ? 116 GLY D O 1 +ATOM 6275 N N . ASP D 1 115 ? 33.523 11.211 -17.917 1.00 41.11 ? 117 ASP D N 1 +ATOM 6276 C CA . ASP D 1 115 ? 32.077 11.150 -17.853 1.00 38.29 ? 117 ASP D CA 1 +ATOM 6277 C C . ASP D 1 115 ? 31.457 10.470 -16.643 1.00 37.95 ? 117 ASP D C 1 +ATOM 6278 O O . ASP D 1 115 ? 30.279 10.712 -16.310 1.00 38.77 ? 117 ASP D O 1 +ATOM 6279 C CB . ASP D 1 115 ? 31.544 10.437 -19.091 1.00 41.89 ? 117 ASP D CB 1 +ATOM 6280 C CG . ASP D 1 115 ? 32.109 9.069 -19.513 1.00 46.37 ? 117 ASP D CG 1 +ATOM 6281 O OD1 . ASP D 1 115 ? 33.220 8.696 -19.153 1.00 40.99 ? 117 ASP D OD1 1 +ATOM 6282 O OD2 . ASP D 1 115 ? 31.426 8.375 -20.271 1.00 48.85 ? 117 ASP D OD2 1 +ATOM 6283 N N . THR D 1 116 ? 32.223 9.621 -15.954 1.00 32.11 ? 118 THR D N 1 +ATOM 6284 C CA . THR D 1 116 ? 31.560 8.922 -14.882 1.00 29.55 ? 118 THR D CA 1 +ATOM 6285 C C . THR D 1 116 ? 31.903 9.464 -13.534 1.00 25.52 ? 118 THR D C 1 +ATOM 6286 O O . THR D 1 116 ? 32.901 10.141 -13.362 1.00 26.94 ? 118 THR D O 1 +ATOM 6287 C CB . THR D 1 116 ? 31.863 7.394 -14.939 1.00 30.61 ? 118 THR D CB 1 +ATOM 6288 O OG1 . THR D 1 116 ? 32.948 7.141 -14.102 1.00 32.85 ? 118 THR D OG1 1 +ATOM 6289 C CG2 . THR D 1 116 ? 32.129 6.893 -16.375 1.00 31.55 ? 118 THR D CG2 1 +ATOM 6290 N N . LEU D 1 117 ? 31.042 9.156 -12.586 1.00 24.34 ? 119 LEU D N 1 +ATOM 6291 C CA . LEU D 1 117 ? 31.203 9.624 -11.249 1.00 24.41 ? 119 LEU D CA 1 +ATOM 6292 C C . LEU D 1 117 ? 31.808 8.518 -10.452 1.00 24.60 ? 119 LEU D C 1 +ATOM 6293 O O . LEU D 1 117 ? 31.206 7.455 -10.295 1.00 31.38 ? 119 LEU D O 1 +ATOM 6294 C CB . LEU D 1 117 ? 29.858 10.021 -10.606 1.00 21.68 ? 119 LEU D CB 1 +ATOM 6295 C CG . LEU D 1 117 ? 30.154 10.496 -9.212 1.00 21.36 ? 119 LEU D CG 1 +ATOM 6296 C CD1 . LEU D 1 117 ? 29.789 11.936 -9.133 1.00 24.86 ? 119 LEU D CD1 1 +ATOM 6297 C CD2 . LEU D 1 117 ? 29.512 9.557 -8.208 1.00 16.44 ? 119 LEU D CD2 1 +ATOM 6298 N N . VAL D 1 118 ? 32.949 8.794 -9.832 1.00 24.46 ? 120 VAL D N 1 +ATOM 6299 C CA . VAL D 1 118 ? 33.603 7.719 -9.136 1.00 15.95 ? 120 VAL D CA 1 +ATOM 6300 C C . VAL D 1 118 ? 33.647 7.935 -7.656 1.00 17.25 ? 120 VAL D C 1 +ATOM 6301 O O . VAL D 1 118 ? 33.964 9.006 -7.182 1.00 21.16 ? 120 VAL D O 1 +ATOM 6302 C CB . VAL D 1 118 ? 34.978 7.580 -9.753 1.00 18.94 ? 120 VAL D CB 1 +ATOM 6303 C CG1 . VAL D 1 118 ? 35.694 6.328 -9.223 1.00 13.75 ? 120 VAL D CG1 1 +ATOM 6304 C CG2 . VAL D 1 118 ? 34.806 7.420 -11.280 1.00 13.95 ? 120 VAL D CG2 1 +ATOM 6305 N N . ASN D 1 119 ? 33.209 6.932 -6.895 1.00 15.67 ? 121 ASN D N 1 +ATOM 6306 C CA . ASN D 1 119 ? 33.319 6.956 -5.462 1.00 15.49 ? 121 ASN D CA 1 +ATOM 6307 C C . ASN D 1 119 ? 34.439 5.953 -5.157 1.00 26.31 ? 121 ASN D C 1 +ATOM 6308 O O . ASN D 1 119 ? 34.286 4.720 -5.271 1.00 27.33 ? 121 ASN D O 1 +ATOM 6309 C CB . ASN D 1 119 ? 32.046 6.498 -4.838 1.00 9.82 ? 121 ASN D CB 1 +ATOM 6310 C CG . ASN D 1 119 ? 32.102 6.463 -3.324 1.00 9.87 ? 121 ASN D CG 1 +ATOM 6311 O OD1 . ASN D 1 119 ? 32.909 7.120 -2.668 1.00 20.22 ? 121 ASN D OD1 1 +ATOM 6312 N ND2 . ASN D 1 119 ? 31.275 5.693 -2.666 1.00 16.56 ? 121 ASN D ND2 1 +ATOM 6313 N N . ARG D 1 120 ? 35.624 6.521 -4.870 1.00 24.93 ? 122 ARG D N 1 +ATOM 6314 C CA . ARG D 1 120 ? 36.774 5.736 -4.480 1.00 24.73 ? 122 ARG D CA 1 +ATOM 6315 C C . ARG D 1 120 ? 36.785 5.840 -2.992 1.00 23.69 ? 122 ARG D C 1 +ATOM 6316 O O . ARG D 1 120 ? 36.771 6.944 -2.467 1.00 30.76 ? 122 ARG D O 1 +ATOM 6317 C CB . ARG D 1 120 ? 38.035 6.295 -5.050 1.00 19.24 ? 122 ARG D CB 1 +ATOM 6318 C CG . ARG D 1 120 ? 38.084 5.948 -6.539 1.00 23.57 ? 122 ARG D CG 1 +ATOM 6319 C CD . ARG D 1 120 ? 39.481 6.254 -7.118 1.00 28.65 ? 122 ARG D CD 1 +ATOM 6320 N NE . ARG D 1 120 ? 39.455 6.270 -8.572 1.00 30.49 ? 122 ARG D NE 1 +ATOM 6321 C CZ . ARG D 1 120 ? 39.473 5.136 -9.272 1.00 37.67 ? 122 ARG D CZ 1 +ATOM 6322 N NH1 . ARG D 1 120 ? 39.521 3.932 -8.669 1.00 42.28 ? 122 ARG D NH1 1 +ATOM 6323 N NH2 . ARG D 1 120 ? 39.421 5.202 -10.601 1.00 35.66 ? 122 ARG D NH2 1 +ATOM 6324 N N . ILE D 1 121 ? 36.801 4.667 -2.347 1.00 20.27 ? 123 ILE D N 1 +ATOM 6325 C CA . ILE D 1 121 ? 36.637 4.486 -0.914 1.00 18.44 ? 123 ILE D CA 1 +ATOM 6326 C C . ILE D 1 121 ? 37.776 3.611 -0.365 1.00 23.32 ? 123 ILE D C 1 +ATOM 6327 O O . ILE D 1 121 ? 38.308 2.753 -1.090 1.00 24.03 ? 123 ILE D O 1 +ATOM 6328 C CB . ILE D 1 121 ? 35.284 3.758 -0.597 1.00 16.18 ? 123 ILE D CB 1 +ATOM 6329 C CG1 . ILE D 1 121 ? 34.232 3.985 -1.683 1.00 10.97 ? 123 ILE D CG1 1 +ATOM 6330 C CG2 . ILE D 1 121 ? 34.820 4.208 0.777 1.00 8.33 ? 123 ILE D CG2 1 +ATOM 6331 C CD1 . ILE D 1 121 ? 32.975 3.139 -1.583 1.00 12.03 ? 123 ILE D CD1 1 +ATOM 6332 N N . GLU D 1 122 ? 38.139 3.860 0.902 1.00 15.85 ? 124 GLU D N 1 +ATOM 6333 C CA . GLU D 1 122 ? 39.058 3.037 1.651 1.00 25.93 ? 124 GLU D CA 1 +ATOM 6334 C C . GLU D 1 122 ? 38.286 2.891 2.928 1.00 24.52 ? 124 GLU D C 1 +ATOM 6335 O O . GLU D 1 122 ? 37.776 3.884 3.438 1.00 29.51 ? 124 GLU D O 1 +ATOM 6336 C CB . GLU D 1 122 ? 40.379 3.678 2.084 1.00 35.52 ? 124 GLU D CB 1 +ATOM 6337 C CG . GLU D 1 122 ? 41.354 4.043 0.965 1.00 49.38 ? 124 GLU D CG 1 +ATOM 6338 C CD . GLU D 1 122 ? 42.387 5.110 1.347 1.00 54.87 ? 124 GLU D CD 1 +ATOM 6339 O OE1 . GLU D 1 122 ? 42.114 5.987 2.195 1.00 51.38 ? 124 GLU D OE1 1 +ATOM 6340 O OE2 . GLU D 1 122 ? 43.472 5.045 0.763 1.00 60.11 ? 124 GLU D OE2 1 +ATOM 6341 N N . LEU D 1 123 ? 38.205 1.702 3.510 1.00 21.94 ? 125 LEU D N 1 +ATOM 6342 C CA . LEU D 1 123 ? 37.437 1.580 4.736 1.00 18.53 ? 125 LEU D CA 1 +ATOM 6343 C C . LEU D 1 123 ? 38.284 0.879 5.773 1.00 11.32 ? 125 LEU D C 1 +ATOM 6344 O O . LEU D 1 123 ? 38.983 -0.036 5.421 1.00 13.64 ? 125 LEU D O 1 +ATOM 6345 C CB . LEU D 1 123 ? 36.145 0.791 4.373 1.00 13.00 ? 125 LEU D CB 1 +ATOM 6346 C CG . LEU D 1 123 ? 35.263 0.171 5.408 1.00 8.26 ? 125 LEU D CG 1 +ATOM 6347 C CD1 . LEU D 1 123 ? 33.794 0.180 4.920 1.00 5.71 ? 125 LEU D CD1 1 +ATOM 6348 C CD2 . LEU D 1 123 ? 35.712 -1.265 5.624 1.00 6.71 ? 125 LEU D CD2 1 +ATOM 6349 N N . LYS D 1 124 ? 38.211 1.183 7.035 1.00 11.49 ? 126 LYS D N 1 +ATOM 6350 C CA . LYS D 1 124 ? 38.932 0.423 7.972 1.00 15.43 ? 126 LYS D CA 1 +ATOM 6351 C C . LYS D 1 124 ? 37.985 0.212 9.108 1.00 18.60 ? 126 LYS D C 1 +ATOM 6352 O O . LYS D 1 124 ? 37.536 1.167 9.743 1.00 22.72 ? 126 LYS D O 1 +ATOM 6353 C CB . LYS D 1 124 ? 40.189 1.181 8.431 1.00 29.92 ? 126 LYS D CB 1 +ATOM 6354 C CG . LYS D 1 124 ? 41.381 0.201 8.567 1.00 35.79 ? 126 LYS D CG 1 +ATOM 6355 C CD . LYS D 1 124 ? 41.914 0.201 9.995 1.00 43.76 ? 126 LYS D CD 1 +ATOM 6356 C CE . LYS D 1 124 ? 42.785 -1.026 10.247 1.00 46.70 ? 126 LYS D CE 1 +ATOM 6357 N NZ . LYS D 1 124 ? 41.939 -2.201 10.465 1.00 56.34 ? 126 LYS D NZ 1 +ATOM 6358 N N . GLY D 1 125 ? 37.619 -1.056 9.317 1.00 18.31 ? 127 GLY D N 1 +ATOM 6359 C CA . GLY D 1 125 ? 36.779 -1.402 10.432 1.00 14.33 ? 127 GLY D CA 1 +ATOM 6360 C C . GLY D 1 125 ? 37.686 -1.921 11.509 1.00 18.15 ? 127 GLY D C 1 +ATOM 6361 O O . GLY D 1 125 ? 38.659 -2.610 11.224 1.00 21.41 ? 127 GLY D O 1 +ATOM 6362 N N . ILE D 1 126 ? 37.457 -1.515 12.741 1.00 22.20 ? 128 ILE D N 1 +ATOM 6363 C CA . ILE D 1 126 ? 38.178 -2.039 13.876 1.00 23.05 ? 128 ILE D CA 1 +ATOM 6364 C C . ILE D 1 126 ? 37.195 -2.323 15.019 1.00 28.33 ? 128 ILE D C 1 +ATOM 6365 O O . ILE D 1 126 ? 36.034 -1.878 15.043 1.00 30.33 ? 128 ILE D O 1 +ATOM 6366 C CB . ILE D 1 126 ? 39.262 -1.060 14.403 1.00 27.62 ? 128 ILE D CB 1 +ATOM 6367 C CG1 . ILE D 1 126 ? 38.680 0.305 14.680 1.00 29.47 ? 128 ILE D CG1 1 +ATOM 6368 C CG2 . ILE D 1 126 ? 40.418 -0.998 13.402 1.00 24.50 ? 128 ILE D CG2 1 +ATOM 6369 C CD1 . ILE D 1 126 ? 39.560 1.054 15.723 1.00 31.31 ? 128 ILE D CD1 1 +ATOM 6370 N N . ASP D 1 127 ? 37.688 -3.127 15.965 1.00 27.05 ? 129 ASP D N 1 +ATOM 6371 C CA . ASP D 1 127 ? 36.987 -3.591 17.174 1.00 28.63 ? 129 ASP D CA 1 +ATOM 6372 C C . ASP D 1 127 ? 35.715 -4.443 17.062 1.00 19.99 ? 129 ASP D C 1 +ATOM 6373 O O . ASP D 1 127 ? 34.953 -4.521 18.023 1.00 15.13 ? 129 ASP D O 1 +ATOM 6374 C CB . ASP D 1 127 ? 36.634 -2.399 18.089 1.00 35.35 ? 129 ASP D CB 1 +ATOM 6375 C CG . ASP D 1 127 ? 37.821 -1.637 18.615 1.00 38.99 ? 129 ASP D CG 1 +ATOM 6376 O OD1 . ASP D 1 127 ? 38.820 -2.265 18.978 1.00 38.08 ? 129 ASP D OD1 1 +ATOM 6377 O OD2 . ASP D 1 127 ? 37.717 -0.409 18.658 1.00 44.29 ? 129 ASP D OD2 1 +ATOM 6378 N N . PHE D 1 128 ? 35.524 -5.099 15.916 1.00 18.75 ? 130 PHE D N 1 +ATOM 6379 C CA . PHE D 1 128 ? 34.427 -6.009 15.731 1.00 28.03 ? 130 PHE D CA 1 +ATOM 6380 C C . PHE D 1 128 ? 34.537 -7.309 16.495 1.00 30.85 ? 130 PHE D C 1 +ATOM 6381 O O . PHE D 1 128 ? 35.613 -7.851 16.664 1.00 32.58 ? 130 PHE D O 1 +ATOM 6382 C CB . PHE D 1 128 ? 34.248 -6.387 14.266 1.00 28.92 ? 130 PHE D CB 1 +ATOM 6383 C CG . PHE D 1 128 ? 33.700 -5.232 13.459 1.00 32.97 ? 130 PHE D CG 1 +ATOM 6384 C CD1 . PHE D 1 128 ? 32.348 -4.904 13.555 1.00 32.06 ? 130 PHE D CD1 1 +ATOM 6385 C CD2 . PHE D 1 128 ? 34.542 -4.461 12.667 1.00 30.29 ? 130 PHE D CD2 1 +ATOM 6386 C CE1 . PHE D 1 128 ? 31.842 -3.803 12.869 1.00 27.75 ? 130 PHE D CE1 1 +ATOM 6387 C CE2 . PHE D 1 128 ? 34.004 -3.363 11.990 1.00 32.05 ? 130 PHE D CE2 1 +ATOM 6388 C CZ . PHE D 1 128 ? 32.662 -3.030 12.090 1.00 12.09 ? 130 PHE D CZ 1 +ATOM 6389 N N . LYS D 1 129 ? 33.379 -7.760 16.982 1.00 37.03 ? 131 LYS D N 1 +ATOM 6390 C CA . LYS D 1 129 ? 33.109 -9.038 17.637 1.00 34.87 ? 131 LYS D CA 1 +ATOM 6391 C C . LYS D 1 129 ? 32.973 -10.001 16.488 1.00 38.67 ? 131 LYS D C 1 +ATOM 6392 O O . LYS D 1 129 ? 32.273 -9.664 15.526 1.00 39.13 ? 131 LYS D O 1 +ATOM 6393 C CB . LYS D 1 129 ? 31.809 -8.925 18.413 1.00 29.20 ? 131 LYS D CB 1 +ATOM 6394 C CG . LYS D 1 129 ? 31.977 -7.957 19.587 1.00 23.54 ? 131 LYS D CG 1 +ATOM 6395 C CD . LYS D 1 129 ? 30.681 -7.740 20.329 1.00 19.80 ? 131 LYS D CD 1 +ATOM 6396 C CE . LYS D 1 129 ? 31.050 -6.907 21.554 1.00 37.77 ? 131 LYS D CE 1 +ATOM 6397 N NZ . LYS D 1 129 ? 29.898 -6.336 22.242 1.00 44.75 ? 131 LYS D NZ 1 +ATOM 6398 N N . GLU D 1 130 ? 33.688 -11.151 16.546 1.00 45.05 ? 132 GLU D N 1 +ATOM 6399 C CA . GLU D 1 130 ? 33.621 -12.205 15.514 1.00 47.49 ? 132 GLU D CA 1 +ATOM 6400 C C . GLU D 1 130 ? 32.327 -13.006 15.594 1.00 45.44 ? 132 GLU D C 1 +ATOM 6401 O O . GLU D 1 130 ? 31.908 -13.699 14.669 1.00 46.40 ? 132 GLU D O 1 +ATOM 6402 C CB . GLU D 1 130 ? 34.756 -13.239 15.643 1.00 53.57 ? 132 GLU D CB 1 +ATOM 6403 C CG . GLU D 1 130 ? 35.711 -13.434 14.448 1.00 63.76 ? 132 GLU D CG 1 +ATOM 6404 C CD . GLU D 1 130 ? 35.146 -13.562 13.015 1.00 69.01 ? 132 GLU D CD 1 +ATOM 6405 O OE1 . GLU D 1 130 ? 33.960 -13.846 12.805 1.00 67.58 ? 132 GLU D OE1 1 +ATOM 6406 O OE2 . GLU D 1 130 ? 35.927 -13.369 12.077 1.00 70.83 ? 132 GLU D OE2 1 +ATOM 6407 N N . ASP D 1 131 ? 31.723 -12.921 16.771 1.00 43.39 ? 133 ASP D N 1 +ATOM 6408 C CA . ASP D 1 131 ? 30.449 -13.532 17.065 1.00 46.11 ? 133 ASP D CA 1 +ATOM 6409 C C . ASP D 1 131 ? 29.301 -12.518 16.924 1.00 45.91 ? 133 ASP D C 1 +ATOM 6410 O O . ASP D 1 131 ? 28.121 -12.801 17.167 1.00 45.29 ? 133 ASP D O 1 +ATOM 6411 C CB . ASP D 1 131 ? 30.530 -14.095 18.488 1.00 53.70 ? 133 ASP D CB 1 +ATOM 6412 C CG . ASP D 1 131 ? 30.861 -13.043 19.541 1.00 56.78 ? 133 ASP D CG 1 +ATOM 6413 O OD1 . ASP D 1 131 ? 32.048 -12.754 19.722 1.00 62.39 ? 133 ASP D OD1 1 +ATOM 6414 O OD2 . ASP D 1 131 ? 29.933 -12.521 20.161 1.00 57.26 ? 133 ASP D OD2 1 +ATOM 6415 N N . GLY D 1 132 ? 29.657 -11.284 16.556 1.00 38.57 ? 134 GLY D N 1 +ATOM 6416 C CA . GLY D 1 132 ? 28.713 -10.199 16.434 1.00 27.85 ? 134 GLY D CA 1 +ATOM 6417 C C . GLY D 1 132 ? 28.004 -10.267 15.109 1.00 24.98 ? 134 GLY D C 1 +ATOM 6418 O O . GLY D 1 132 ? 28.314 -11.119 14.248 1.00 16.84 ? 134 GLY D O 1 +ATOM 6419 N N . ASN D 1 133 ? 27.100 -9.279 14.966 1.00 16.05 ? 135 ASN D N 1 +ATOM 6420 C CA . ASN D 1 133 ? 26.212 -9.333 13.806 1.00 18.29 ? 135 ASN D CA 1 +ATOM 6421 C C . ASN D 1 133 ? 26.895 -8.994 12.522 1.00 13.97 ? 135 ASN D C 1 +ATOM 6422 O O . ASN D 1 133 ? 26.412 -9.224 11.429 1.00 18.58 ? 135 ASN D O 1 +ATOM 6423 C CB . ASN D 1 133 ? 25.031 -8.386 13.976 1.00 17.26 ? 135 ASN D CB 1 +ATOM 6424 C CG . ASN D 1 133 ? 24.202 -8.653 15.212 1.00 16.31 ? 135 ASN D CG 1 +ATOM 6425 O OD1 . ASN D 1 133 ? 23.890 -7.784 16.028 1.00 21.24 ? 135 ASN D OD1 1 +ATOM 6426 N ND2 . ASN D 1 133 ? 23.786 -9.889 15.395 1.00 25.61 ? 135 ASN D ND2 1 +ATOM 6427 N N . ILE D 1 134 ? 28.081 -8.453 12.625 1.00 21.21 ? 136 ILE D N 1 +ATOM 6428 C CA . ILE D 1 134 ? 28.714 -8.013 11.415 1.00 21.79 ? 136 ILE D CA 1 +ATOM 6429 C C . ILE D 1 134 ? 29.658 -9.098 10.997 1.00 19.55 ? 136 ILE D C 1 +ATOM 6430 O O . ILE D 1 134 ? 29.544 -9.597 9.882 1.00 16.14 ? 136 ILE D O 1 +ATOM 6431 C CB . ILE D 1 134 ? 29.425 -6.634 11.663 1.00 20.64 ? 136 ILE D CB 1 +ATOM 6432 C CG1 . ILE D 1 134 ? 28.421 -5.531 11.812 1.00 12.09 ? 136 ILE D CG1 1 +ATOM 6433 C CG2 . ILE D 1 134 ? 30.327 -6.289 10.497 1.00 23.30 ? 136 ILE D CG2 1 +ATOM 6434 C CD1 . ILE D 1 134 ? 27.909 -5.413 13.240 1.00 20.13 ? 136 ILE D CD1 1 +ATOM 6435 N N . LEU D 1 135 ? 30.606 -9.485 11.833 1.00 24.39 ? 137 LEU D N 1 +ATOM 6436 C CA . LEU D 1 135 ? 31.501 -10.564 11.392 1.00 29.73 ? 137 LEU D CA 1 +ATOM 6437 C C . LEU D 1 135 ? 30.750 -11.909 11.328 1.00 23.44 ? 137 LEU D C 1 +ATOM 6438 O O . LEU D 1 135 ? 30.823 -12.631 10.332 1.00 20.68 ? 137 LEU D O 1 +ATOM 6439 C CB . LEU D 1 135 ? 32.701 -10.577 12.352 1.00 34.11 ? 137 LEU D CB 1 +ATOM 6440 C CG . LEU D 1 135 ? 33.947 -9.715 12.063 1.00 34.55 ? 137 LEU D CG 1 +ATOM 6441 C CD1 . LEU D 1 135 ? 34.763 -10.232 10.916 1.00 34.04 ? 137 LEU D CD1 1 +ATOM 6442 C CD2 . LEU D 1 135 ? 33.513 -8.378 11.554 1.00 45.31 ? 137 LEU D CD2 1 +ATOM 6443 N N . GLY D 1 136 ? 29.869 -12.162 12.296 1.00 26.61 ? 138 GLY D N 1 +ATOM 6444 C CA . GLY D 1 136 ? 29.009 -13.351 12.291 1.00 28.45 ? 138 GLY D CA 1 +ATOM 6445 C C . GLY D 1 136 ? 27.922 -13.346 11.220 1.00 25.98 ? 138 GLY D C 1 +ATOM 6446 O O . GLY D 1 136 ? 27.063 -14.227 11.232 1.00 28.65 ? 138 GLY D O 1 +ATOM 6447 N N . HIS D 1 137 ? 27.916 -12.414 10.268 1.00 22.42 ? 139 HIS D N 1 +ATOM 6448 C CA . HIS D 1 137 ? 26.907 -12.272 9.222 1.00 23.05 ? 139 HIS D CA 1 +ATOM 6449 C C . HIS D 1 137 ? 25.441 -12.565 9.575 1.00 27.65 ? 139 HIS D C 1 +ATOM 6450 O O . HIS D 1 137 ? 24.669 -13.276 8.921 1.00 28.05 ? 139 HIS D O 1 +ATOM 6451 C CB . HIS D 1 137 ? 27.323 -13.119 8.046 1.00 22.40 ? 139 HIS D CB 1 +ATOM 6452 C CG . HIS D 1 137 ? 28.548 -12.595 7.344 1.00 23.93 ? 139 HIS D CG 1 +ATOM 6453 N ND1 . HIS D 1 137 ? 29.777 -12.473 7.831 1.00 26.80 ? 139 HIS D ND1 1 +ATOM 6454 C CD2 . HIS D 1 137 ? 28.571 -12.196 6.037 1.00 27.00 ? 139 HIS D CD2 1 +ATOM 6455 C CE1 . HIS D 1 137 ? 30.527 -12.022 6.851 1.00 25.77 ? 139 HIS D CE1 1 +ATOM 6456 N NE2 . HIS D 1 137 ? 29.810 -11.854 5.764 1.00 24.65 ? 139 HIS D NE2 1 +ATOM 6457 N N . LYS D 1 138 ? 25.100 -11.990 10.726 1.00 25.98 ? 140 LYS D N 1 +ATOM 6458 C CA . LYS D 1 138 ? 23.789 -12.014 11.293 1.00 24.13 ? 140 LYS D CA 1 +ATOM 6459 C C . LYS D 1 138 ? 22.815 -10.953 10.723 1.00 27.18 ? 140 LYS D C 1 +ATOM 6460 O O . LYS D 1 138 ? 21.741 -10.710 11.284 1.00 27.69 ? 140 LYS D O 1 +ATOM 6461 C CB . LYS D 1 138 ? 23.973 -11.852 12.769 1.00 24.79 ? 140 LYS D CB 1 +ATOM 6462 C CG . LYS D 1 138 ? 24.737 -13.003 13.414 1.00 30.58 ? 140 LYS D CG 1 +ATOM 6463 C CD . LYS D 1 138 ? 24.595 -12.786 14.889 1.00 32.45 ? 140 LYS D CD 1 +ATOM 6464 C CE . LYS D 1 138 ? 25.035 -13.934 15.760 1.00 40.93 ? 140 LYS D CE 1 +ATOM 6465 N NZ . LYS D 1 138 ? 26.450 -14.155 15.625 1.00 39.49 ? 140 LYS D NZ 1 +ATOM 6466 N N . LEU D 1 139 ? 23.095 -10.329 9.576 1.00 22.31 ? 141 LEU D N 1 +ATOM 6467 C CA . LEU D 1 139 ? 22.228 -9.270 9.113 1.00 20.70 ? 141 LEU D CA 1 +ATOM 6468 C C . LEU D 1 139 ? 21.478 -9.697 7.911 1.00 19.73 ? 141 LEU D C 1 +ATOM 6469 O O . LEU D 1 139 ? 22.084 -10.178 6.956 1.00 19.26 ? 141 LEU D O 1 +ATOM 6470 C CB . LEU D 1 139 ? 22.890 -7.982 8.609 1.00 23.22 ? 141 LEU D CB 1 +ATOM 6471 C CG . LEU D 1 139 ? 23.933 -7.217 9.365 1.00 25.45 ? 141 LEU D CG 1 +ATOM 6472 C CD1 . LEU D 1 139 ? 23.960 -5.828 8.804 1.00 23.48 ? 141 LEU D CD1 1 +ATOM 6473 C CD2 . LEU D 1 139 ? 23.627 -7.232 10.847 1.00 16.00 ? 141 LEU D CD2 1 +ATOM 6474 N N . GLU D 1 140 ? 20.189 -9.352 7.922 1.00 14.48 ? 142 GLU D N 1 +ATOM 6475 C CA . GLU D 1 140 ? 19.346 -9.704 6.816 1.00 14.16 ? 142 GLU D CA 1 +ATOM 6476 C C . GLU D 1 140 ? 19.827 -8.996 5.587 1.00 11.78 ? 142 GLU D C 1 +ATOM 6477 O O . GLU D 1 140 ? 20.383 -7.895 5.668 1.00 19.06 ? 142 GLU D O 1 +ATOM 6478 C CB . GLU D 1 140 ? 17.884 -9.310 7.104 1.00 16.27 ? 142 GLU D CB 1 +ATOM 6479 C CG . GLU D 1 140 ? 17.316 -9.788 8.441 1.00 20.77 ? 142 GLU D CG 1 +ATOM 6480 C CD . GLU D 1 140 ? 15.797 -9.728 8.505 1.00 31.90 ? 142 GLU D CD 1 +ATOM 6481 O OE1 . GLU D 1 140 ? 15.155 -9.831 7.451 1.00 37.11 ? 142 GLU D OE1 1 +ATOM 6482 O OE2 . GLU D 1 140 ? 15.250 -9.608 9.610 1.00 34.02 ? 142 GLU D OE2 1 +ATOM 6483 N N . TYR D 1 141 ? 19.637 -9.589 4.427 1.00 8.23 ? 143 TYR D N 1 +ATOM 6484 C CA . TYR D 1 141 ? 20.070 -8.960 3.223 1.00 5.72 ? 143 TYR D CA 1 +ATOM 6485 C C . TYR D 1 141 ? 18.971 -8.014 2.761 1.00 12.10 ? 143 TYR D C 1 +ATOM 6486 O O . TYR D 1 141 ? 18.343 -8.138 1.694 1.00 11.24 ? 143 TYR D O 1 +ATOM 6487 C CB . TYR D 1 141 ? 20.319 -9.971 2.140 1.00 2.00 ? 143 TYR D CB 1 +ATOM 6488 C CG . TYR D 1 141 ? 20.840 -9.241 0.910 1.00 3.62 ? 143 TYR D CG 1 +ATOM 6489 C CD1 . TYR D 1 141 ? 22.110 -8.646 0.921 1.00 8.14 ? 143 TYR D CD1 1 +ATOM 6490 C CD2 . TYR D 1 141 ? 20.091 -9.271 -0.256 1.00 6.50 ? 143 TYR D CD2 1 +ATOM 6491 C CE1 . TYR D 1 141 ? 22.631 -8.114 -0.265 1.00 4.73 ? 143 TYR D CE1 1 +ATOM 6492 C CE2 . TYR D 1 141 ? 20.607 -8.739 -1.435 1.00 10.43 ? 143 TYR D CE2 1 +ATOM 6493 C CZ . TYR D 1 141 ? 21.869 -8.183 -1.407 1.00 2.00 ? 143 TYR D CZ 1 +ATOM 6494 O OH . TYR D 1 141 ? 22.369 -7.768 -2.578 1.00 8.15 ? 143 TYR D OH 1 +ATOM 6495 N N . ASN D 1 142 ? 18.787 -6.999 3.593 1.00 14.93 ? 144 ASN D N 1 +ATOM 6496 C CA . ASN D 1 142 ? 17.810 -6.016 3.265 1.00 18.14 ? 144 ASN D CA 1 +ATOM 6497 C C . ASN D 1 142 ? 18.268 -4.653 3.747 1.00 22.25 ? 144 ASN D C 1 +ATOM 6498 O O . ASN D 1 142 ? 19.408 -4.542 4.232 1.00 20.80 ? 144 ASN D O 1 +ATOM 6499 C CB . ASN D 1 142 ? 16.520 -6.504 3.871 1.00 10.30 ? 144 ASN D CB 1 +ATOM 6500 C CG . ASN D 1 142 ? 16.586 -6.642 5.336 1.00 7.69 ? 144 ASN D CG 1 +ATOM 6501 O OD1 . ASN D 1 142 ? 17.508 -6.152 5.977 1.00 17.27 ? 144 ASN D OD1 1 +ATOM 6502 N ND2 . ASN D 1 142 ? 15.576 -7.304 5.884 1.00 8.92 ? 144 ASN D ND2 1 +ATOM 6503 N N . TYR D 1 143 ? 17.398 -3.653 3.531 1.00 16.37 ? 145 TYR D N 1 +ATOM 6504 C CA . TYR D 1 143 ? 17.666 -2.284 3.910 1.00 24.06 ? 145 TYR D CA 1 +ATOM 6505 C C . TYR D 1 143 ? 16.375 -1.511 4.152 1.00 27.61 ? 145 TYR D C 1 +ATOM 6506 O O . TYR D 1 143 ? 15.308 -1.740 3.563 1.00 29.78 ? 145 TYR D O 1 +ATOM 6507 C CB . TYR D 1 143 ? 18.475 -1.583 2.806 1.00 27.12 ? 145 TYR D CB 1 +ATOM 6508 C CG . TYR D 1 143 ? 19.591 -0.702 3.400 1.00 30.59 ? 145 TYR D CG 1 +ATOM 6509 C CD1 . TYR D 1 143 ? 20.680 -1.298 4.046 1.00 29.05 ? 145 TYR D CD1 1 +ATOM 6510 C CD2 . TYR D 1 143 ? 19.519 0.687 3.283 1.00 26.55 ? 145 TYR D CD2 1 +ATOM 6511 C CE1 . TYR D 1 143 ? 21.695 -0.507 4.580 1.00 39.63 ? 145 TYR D CE1 1 +ATOM 6512 C CE2 . TYR D 1 143 ? 20.518 1.481 3.809 1.00 33.17 ? 145 TYR D CE2 1 +ATOM 6513 C CZ . TYR D 1 143 ? 21.604 0.884 4.456 1.00 40.11 ? 145 TYR D CZ 1 +ATOM 6514 O OH . TYR D 1 143 ? 22.591 1.670 5.002 1.00 35.29 ? 145 TYR D OH 1 +ATOM 6515 N N . ASN D 1 144 ? 16.522 -0.545 5.052 1.00 24.90 ? 146 ASN D N 1 +ATOM 6516 C CA . ASN D 1 144 ? 15.431 0.313 5.455 1.00 18.12 ? 146 ASN D CA 1 +ATOM 6517 C C . ASN D 1 144 ? 15.489 1.703 4.844 1.00 18.12 ? 146 ASN D C 1 +ATOM 6518 O O . ASN D 1 144 ? 16.168 1.957 3.843 1.00 18.33 ? 146 ASN D O 1 +ATOM 6519 C CB . ASN D 1 144 ? 15.476 0.325 6.958 1.00 21.70 ? 146 ASN D CB 1 +ATOM 6520 C CG . ASN D 1 144 ? 15.261 -1.110 7.404 1.00 14.13 ? 146 ASN D CG 1 +ATOM 6521 O OD1 . ASN D 1 144 ? 14.581 -1.851 6.725 1.00 18.84 ? 146 ASN D OD1 1 +ATOM 6522 N ND2 . ASN D 1 144 ? 15.825 -1.577 8.479 1.00 13.66 ? 146 ASN D ND2 1 +ATOM 6523 N N . SER D 1 145 ? 14.666 2.565 5.426 1.00 15.32 ? 147 SER D N 1 +ATOM 6524 C CA . SER D 1 145 ? 14.530 3.966 5.052 1.00 10.32 ? 147 SER D CA 1 +ATOM 6525 C C . SER D 1 145 ? 15.251 4.779 6.037 1.00 3.54 ? 147 SER D C 1 +ATOM 6526 O O . SER D 1 145 ? 15.131 4.554 7.238 1.00 9.07 ? 147 SER D O 1 +ATOM 6527 C CB . SER D 1 145 ? 13.114 4.502 5.087 1.00 7.04 ? 147 SER D CB 1 +ATOM 6528 O OG . SER D 1 145 ? 12.753 4.444 3.740 1.00 18.33 ? 147 SER D OG 1 +ATOM 6529 N N . HIS D 1 146 ? 16.045 5.724 5.577 1.00 3.73 ? 148 HIS D N 1 +ATOM 6530 C CA . HIS D 1 146 ? 16.642 6.592 6.606 1.00 8.02 ? 148 HIS D CA 1 +ATOM 6531 C C . HIS D 1 146 ? 16.768 8.017 6.121 1.00 4.55 ? 148 HIS D C 1 +ATOM 6532 O O . HIS D 1 146 ? 16.810 8.295 4.924 1.00 6.26 ? 148 HIS D O 1 +ATOM 6533 C CB . HIS D 1 146 ? 18.031 6.124 7.021 1.00 4.38 ? 148 HIS D CB 1 +ATOM 6534 C CG . HIS D 1 146 ? 18.144 4.666 7.407 1.00 5.23 ? 148 HIS D CG 1 +ATOM 6535 N ND1 . HIS D 1 146 ? 18.268 3.659 6.528 1.00 2.02 ? 148 HIS D ND1 1 +ATOM 6536 C CD2 . HIS D 1 146 ? 18.138 4.177 8.698 1.00 6.40 ? 148 HIS D CD2 1 +ATOM 6537 C CE1 . HIS D 1 146 ? 18.333 2.580 7.284 1.00 3.26 ? 148 HIS D CE1 1 +ATOM 6538 N NE2 . HIS D 1 146 ? 18.257 2.874 8.585 1.00 2.00 ? 148 HIS D NE2 1 +ATOM 6539 N N . ASN D 1 147 ? 16.724 8.892 7.105 1.00 5.91 ? 149 ASN D N 1 +ATOM 6540 C CA . ASN D 1 147 ? 16.979 10.297 6.849 1.00 13.54 ? 149 ASN D CA 1 +ATOM 6541 C C . ASN D 1 147 ? 18.447 10.653 7.178 1.00 13.08 ? 149 ASN D C 1 +ATOM 6542 O O . ASN D 1 147 ? 18.946 10.464 8.296 1.00 13.02 ? 149 ASN D O 1 +ATOM 6543 C CB . ASN D 1 147 ? 16.035 11.137 7.708 1.00 13.88 ? 149 ASN D CB 1 +ATOM 6544 C CG . ASN D 1 147 ? 14.524 10.893 7.495 1.00 9.14 ? 149 ASN D CG 1 +ATOM 6545 O OD1 . ASN D 1 147 ? 13.744 10.872 8.445 1.00 15.01 ? 149 ASN D OD1 1 +ATOM 6546 N ND2 . ASN D 1 147 ? 14.097 10.695 6.280 1.00 2.00 ? 149 ASN D ND2 1 +ATOM 6547 N N . VAL D 1 148 ? 19.153 11.135 6.176 1.00 9.95 ? 150 VAL D N 1 +ATOM 6548 C CA . VAL D 1 148 ? 20.524 11.629 6.341 1.00 13.28 ? 150 VAL D CA 1 +ATOM 6549 C C . VAL D 1 148 ? 20.485 13.116 6.769 1.00 12.76 ? 150 VAL D C 1 +ATOM 6550 O O . VAL D 1 148 ? 20.345 14.011 5.935 1.00 12.97 ? 150 VAL D O 1 +ATOM 6551 C CB . VAL D 1 148 ? 21.275 11.523 5.028 1.00 6.19 ? 150 VAL D CB 1 +ATOM 6552 C CG1 . VAL D 1 148 ? 22.699 11.965 5.250 1.00 16.92 ? 150 VAL D CG1 1 +ATOM 6553 C CG2 . VAL D 1 148 ? 21.195 10.103 4.494 1.00 12.99 ? 150 VAL D CG2 1 +ATOM 6554 N N . TYR D 1 149 ? 20.552 13.418 8.049 1.00 7.14 ? 151 TYR D N 1 +ATOM 6555 C CA . TYR D 1 149 ? 20.553 14.753 8.531 1.00 6.50 ? 151 TYR D CA 1 +ATOM 6556 C C . TYR D 1 149 ? 21.834 15.540 8.230 1.00 17.40 ? 151 TYR D C 1 +ATOM 6557 O O . TYR D 1 149 ? 22.858 15.443 8.929 1.00 18.42 ? 151 TYR D O 1 +ATOM 6558 C CB . TYR D 1 149 ? 20.264 14.670 10.034 1.00 10.74 ? 151 TYR D CB 1 +ATOM 6559 C CG . TYR D 1 149 ? 18.835 14.177 10.222 1.00 21.97 ? 151 TYR D CG 1 +ATOM 6560 C CD1 . TYR D 1 149 ? 17.771 15.010 9.872 1.00 26.96 ? 151 TYR D CD1 1 +ATOM 6561 C CD2 . TYR D 1 149 ? 18.572 12.888 10.681 1.00 27.90 ? 151 TYR D CD2 1 +ATOM 6562 C CE1 . TYR D 1 149 ? 16.466 14.550 9.971 1.00 38.44 ? 151 TYR D CE1 1 +ATOM 6563 C CE2 . TYR D 1 149 ? 17.262 12.416 10.786 1.00 27.52 ? 151 TYR D CE2 1 +ATOM 6564 C CZ . TYR D 1 149 ? 16.216 13.250 10.429 1.00 34.48 ? 151 TYR D CZ 1 +ATOM 6565 O OH . TYR D 1 149 ? 14.912 12.798 10.510 1.00 36.18 ? 151 TYR D OH 1 +ATOM 6566 N N . ILE D 1 150 ? 21.752 16.362 7.172 1.00 11.24 ? 152 ILE D N 1 +ATOM 6567 C CA . ILE D 1 150 ? 22.797 17.245 6.778 1.00 11.66 ? 152 ILE D CA 1 +ATOM 6568 C C . ILE D 1 150 ? 22.772 18.585 7.533 1.00 21.56 ? 152 ILE D C 1 +ATOM 6569 O O . ILE D 1 150 ? 21.742 19.170 7.855 1.00 27.73 ? 152 ILE D O 1 +ATOM 6570 C CB . ILE D 1 150 ? 22.650 17.419 5.295 1.00 4.94 ? 152 ILE D CB 1 +ATOM 6571 C CG1 . ILE D 1 150 ? 22.676 16.069 4.637 1.00 2.00 ? 152 ILE D CG1 1 +ATOM 6572 C CG2 . ILE D 1 150 ? 23.784 18.320 4.787 1.00 12.89 ? 152 ILE D CG2 1 +ATOM 6573 C CD1 . ILE D 1 150 ? 22.906 16.050 3.162 1.00 2.00 ? 152 ILE D CD1 1 +ATOM 6574 N N . THR D 1 151 ? 23.954 19.048 7.930 1.00 27.92 ? 153 THR D N 1 +ATOM 6575 C CA . THR D 1 151 ? 24.176 20.313 8.605 1.00 24.56 ? 153 THR D CA 1 +ATOM 6576 C C . THR D 1 151 ? 25.387 20.918 7.913 1.00 23.65 ? 153 THR D C 1 +ATOM 6577 O O . THR D 1 151 ? 26.175 20.228 7.252 1.00 24.10 ? 153 THR D O 1 +ATOM 6578 C CB . THR D 1 151 ? 24.388 20.012 10.109 1.00 24.58 ? 153 THR D CB 1 +ATOM 6579 O OG1 . THR D 1 151 ? 24.321 21.263 10.776 1.00 28.19 ? 153 THR D OG1 1 +ATOM 6580 C CG2 . THR D 1 151 ? 25.723 19.419 10.458 1.00 32.31 ? 153 THR D CG2 1 +ATOM 6581 N N . ALA D 1 152 ? 25.573 22.239 7.967 1.00 27.76 ? 154 ALA D N 1 +ATOM 6582 C CA . ALA D 1 152 ? 26.724 22.807 7.270 1.00 20.26 ? 154 ALA D CA 1 +ATOM 6583 C C . ALA D 1 152 ? 27.934 22.763 8.170 1.00 18.89 ? 154 ALA D C 1 +ATOM 6584 O O . ALA D 1 152 ? 27.891 22.705 9.409 1.00 14.91 ? 154 ALA D O 1 +ATOM 6585 C CB . ALA D 1 152 ? 26.439 24.240 6.856 1.00 15.29 ? 154 ALA D CB 1 +ATOM 6586 N N . ASP D 1 153 ? 29.029 22.647 7.425 1.00 17.58 ? 155 ASP D N 1 +ATOM 6587 C CA . ASP D 1 153 ? 30.301 22.667 8.103 1.00 28.33 ? 155 ASP D CA 1 +ATOM 6588 C C . ASP D 1 153 ? 30.997 23.828 7.413 1.00 29.02 ? 155 ASP D C 1 +ATOM 6589 O O . ASP D 1 153 ? 31.630 23.650 6.369 1.00 30.07 ? 155 ASP D O 1 +ATOM 6590 C CB . ASP D 1 153 ? 30.982 21.301 7.876 1.00 34.93 ? 155 ASP D CB 1 +ATOM 6591 C CG . ASP D 1 153 ? 32.231 21.024 8.706 1.00 34.75 ? 155 ASP D CG 1 +ATOM 6592 O OD1 . ASP D 1 153 ? 32.790 21.941 9.325 1.00 36.15 ? 155 ASP D OD1 1 +ATOM 6593 O OD2 . ASP D 1 153 ? 32.642 19.861 8.729 1.00 38.42 ? 155 ASP D OD2 1 +ATOM 6594 N N . LYS D 1 154 ? 30.745 25.048 7.937 1.00 31.27 ? 156 LYS D N 1 +ATOM 6595 C CA . LYS D 1 154 ? 31.267 26.290 7.392 1.00 28.22 ? 156 LYS D CA 1 +ATOM 6596 C C . LYS D 1 154 ? 32.789 26.244 7.436 1.00 26.06 ? 156 LYS D C 1 +ATOM 6597 O O . LYS D 1 154 ? 33.446 26.486 6.423 1.00 23.56 ? 156 LYS D O 1 +ATOM 6598 C CB . LYS D 1 154 ? 30.736 27.478 8.212 1.00 37.65 ? 156 LYS D CB 1 +ATOM 6599 C CG . LYS D 1 154 ? 29.596 28.347 7.605 1.00 41.38 ? 156 LYS D CG 1 +ATOM 6600 C CD . LYS D 1 154 ? 28.205 27.735 7.513 1.00 47.09 ? 156 LYS D CD 1 +ATOM 6601 C CE . LYS D 1 154 ? 27.559 27.591 8.894 1.00 56.35 ? 156 LYS D CE 1 +ATOM 6602 N NZ . LYS D 1 154 ? 27.294 28.890 9.497 1.00 59.67 ? 156 LYS D NZ 1 +ATOM 6603 N N . GLN D 1 155 ? 33.384 25.844 8.568 1.00 21.45 ? 157 GLN D N 1 +ATOM 6604 C CA . GLN D 1 155 ? 34.821 25.687 8.635 1.00 11.63 ? 157 GLN D CA 1 +ATOM 6605 C C . GLN D 1 155 ? 35.363 24.797 7.589 1.00 14.25 ? 157 GLN D C 1 +ATOM 6606 O O . GLN D 1 155 ? 36.149 25.306 6.799 1.00 18.36 ? 157 GLN D O 1 +ATOM 6607 C CB . GLN D 1 155 ? 35.234 25.137 9.928 1.00 13.59 ? 157 GLN D CB 1 +ATOM 6608 C CG . GLN D 1 155 ? 35.009 26.166 11.012 1.00 27.02 ? 157 GLN D CG 1 +ATOM 6609 C CD . GLN D 1 155 ? 35.801 27.461 10.828 1.00 36.02 ? 157 GLN D CD 1 +ATOM 6610 O OE1 . GLN D 1 155 ? 35.207 28.554 10.818 1.00 40.98 ? 157 GLN D OE1 1 +ATOM 6611 N NE2 . GLN D 1 155 ? 37.131 27.344 10.666 1.00 33.73 ? 157 GLN D NE2 1 +ATOM 6612 N N . LYS D 1 156 ? 34.939 23.528 7.470 1.00 13.38 ? 158 LYS D N 1 +ATOM 6613 C CA . LYS D 1 156 ? 35.545 22.670 6.472 1.00 10.46 ? 158 LYS D CA 1 +ATOM 6614 C C . LYS D 1 156 ? 35.064 22.923 5.080 1.00 8.81 ? 158 LYS D C 1 +ATOM 6615 O O . LYS D 1 156 ? 35.407 22.173 4.155 1.00 14.64 ? 158 LYS D O 1 +ATOM 6616 C CB . LYS D 1 156 ? 35.320 21.201 6.853 1.00 17.12 ? 158 LYS D CB 1 +ATOM 6617 C CG . LYS D 1 156 ? 36.064 20.854 8.191 1.00 20.43 ? 158 LYS D CG 1 +ATOM 6618 C CD . LYS D 1 156 ? 36.673 19.452 8.078 1.00 21.68 ? 158 LYS D CD 1 +ATOM 6619 C CE . LYS D 1 156 ? 36.985 18.863 9.455 1.00 27.51 ? 158 LYS D CE 1 +ATOM 6620 N NZ . LYS D 1 156 ? 35.789 18.490 10.209 1.00 31.31 ? 158 LYS D NZ 1 +ATOM 6621 N N . ASN D 1 157 ? 34.304 24.024 4.926 1.00 10.01 ? 159 ASN D N 1 +ATOM 6622 C CA . ASN D 1 157 ? 33.597 24.389 3.681 1.00 8.52 ? 159 ASN D CA 1 +ATOM 6623 C C . ASN D 1 157 ? 32.698 23.227 3.165 1.00 8.85 ? 159 ASN D C 1 +ATOM 6624 O O . ASN D 1 157 ? 32.421 23.033 1.965 1.00 7.20 ? 159 ASN D O 1 +ATOM 6625 C CB . ASN D 1 157 ? 34.652 24.796 2.623 1.00 2.00 ? 159 ASN D CB 1 +ATOM 6626 C CG . ASN D 1 157 ? 34.051 25.512 1.445 1.00 10.37 ? 159 ASN D CG 1 +ATOM 6627 O OD1 . ASN D 1 157 ? 32.930 26.048 1.509 1.00 16.18 ? 159 ASN D OD1 1 +ATOM 6628 N ND2 . ASN D 1 157 ? 34.828 25.553 0.364 1.00 13.50 ? 159 ASN D ND2 1 +ATOM 6629 N N . GLY D 1 158 ? 32.146 22.421 4.080 1.00 6.19 ? 160 GLY D N 1 +ATOM 6630 C CA . GLY D 1 158 ? 31.442 21.229 3.575 1.00 12.04 ? 160 GLY D CA 1 +ATOM 6631 C C . GLY D 1 158 ? 30.164 20.963 4.341 1.00 17.29 ? 160 GLY D C 1 +ATOM 6632 O O . GLY D 1 158 ? 29.331 21.858 4.605 1.00 17.97 ? 160 GLY D O 1 +ATOM 6633 N N . ILE D 1 159 ? 29.984 19.670 4.657 1.00 14.73 ? 161 ILE D N 1 +ATOM 6634 C CA . ILE D 1 159 ? 28.820 19.269 5.446 1.00 14.92 ? 161 ILE D CA 1 +ATOM 6635 C C . ILE D 1 159 ? 29.117 18.162 6.403 1.00 11.79 ? 161 ILE D C 1 +ATOM 6636 O O . ILE D 1 159 ? 30.087 17.429 6.241 1.00 14.32 ? 161 ILE D O 1 +ATOM 6637 C CB . ILE D 1 159 ? 27.650 18.797 4.584 1.00 9.77 ? 161 ILE D CB 1 +ATOM 6638 C CG1 . ILE D 1 159 ? 28.119 17.635 3.746 1.00 12.47 ? 161 ILE D CG1 1 +ATOM 6639 C CG2 . ILE D 1 159 ? 27.167 19.884 3.637 1.00 5.33 ? 161 ILE D CG2 1 +ATOM 6640 C CD1 . ILE D 1 159 ? 26.969 16.892 3.068 1.00 7.83 ? 161 ILE D CD1 1 +ATOM 6641 N N . LYS D 1 160 ? 28.366 18.160 7.482 1.00 8.56 ? 162 LYS D N 1 +ATOM 6642 C CA . LYS D 1 160 ? 28.374 17.017 8.365 1.00 12.72 ? 162 LYS D CA 1 +ATOM 6643 C C . LYS D 1 160 ? 26.984 16.373 8.153 1.00 17.37 ? 162 LYS D C 1 +ATOM 6644 O O . LYS D 1 160 ? 26.005 17.066 7.830 1.00 6.43 ? 162 LYS D O 1 +ATOM 6645 C CB . LYS D 1 160 ? 28.506 17.422 9.810 1.00 12.40 ? 162 LYS D CB 1 +ATOM 6646 C CG . LYS D 1 160 ? 29.802 18.126 10.174 1.00 22.87 ? 162 LYS D CG 1 +ATOM 6647 C CD . LYS D 1 160 ? 29.730 18.948 11.460 1.00 25.47 ? 162 LYS D CD 1 +ATOM 6648 C CE . LYS D 1 160 ? 29.684 18.041 12.671 1.00 44.78 ? 162 LYS D CE 1 +ATOM 6649 N NZ . LYS D 1 160 ? 30.888 17.219 12.785 1.00 55.15 ? 162 LYS D NZ 1 +ATOM 6650 N N . ALA D 1 161 ? 26.877 15.035 8.220 1.00 18.26 ? 163 ALA D N 1 +ATOM 6651 C CA . ALA D 1 161 ? 25.576 14.363 8.198 1.00 13.73 ? 163 ALA D CA 1 +ATOM 6652 C C . ALA D 1 161 ? 25.614 13.347 9.298 1.00 16.01 ? 163 ALA D C 1 +ATOM 6653 O O . ALA D 1 161 ? 26.689 12.882 9.667 1.00 23.26 ? 163 ALA D O 1 +ATOM 6654 C CB . ALA D 1 161 ? 25.272 13.624 6.924 1.00 7.54 ? 163 ALA D CB 1 +ATOM 6655 N N . ASN D 1 162 ? 24.446 13.141 9.919 1.00 16.34 ? 164 ASN D N 1 +ATOM 6656 C CA . ASN D 1 162 ? 24.280 12.290 11.062 1.00 18.82 ? 164 ASN D CA 1 +ATOM 6657 C C . ASN D 1 162 ? 23.047 11.452 10.865 1.00 28.09 ? 164 ASN D C 1 +ATOM 6658 O O . ASN D 1 162 ? 22.022 11.952 10.403 1.00 33.38 ? 164 ASN D O 1 +ATOM 6659 C CB . ASN D 1 162 ? 24.099 13.078 12.332 1.00 19.48 ? 164 ASN D CB 1 +ATOM 6660 C CG . ASN D 1 162 ? 25.403 13.801 12.712 1.00 28.14 ? 164 ASN D CG 1 +ATOM 6661 O OD1 . ASN D 1 162 ? 26.078 13.439 13.667 1.00 30.26 ? 164 ASN D OD1 1 +ATOM 6662 N ND2 . ASN D 1 162 ? 25.837 14.849 12.024 1.00 30.93 ? 164 ASN D ND2 1 +ATOM 6663 N N . PHE D 1 163 ? 23.177 10.140 11.122 1.00 26.12 ? 165 PHE D N 1 +ATOM 6664 C CA . PHE D 1 163 ? 22.081 9.201 11.065 1.00 22.93 ? 165 PHE D CA 1 +ATOM 6665 C C . PHE D 1 163 ? 22.428 7.855 11.665 1.00 29.88 ? 165 PHE D C 1 +ATOM 6666 O O . PHE D 1 163 ? 23.597 7.487 11.744 1.00 32.32 ? 165 PHE D O 1 +ATOM 6667 C CB . PHE D 1 163 ? 21.625 8.968 9.647 1.00 16.76 ? 165 PHE D CB 1 +ATOM 6668 C CG . PHE D 1 163 ? 22.653 8.701 8.585 1.00 14.74 ? 165 PHE D CG 1 +ATOM 6669 C CD1 . PHE D 1 163 ? 23.528 9.700 8.184 1.00 16.57 ? 165 PHE D CD1 1 +ATOM 6670 C CD2 . PHE D 1 163 ? 22.686 7.454 7.973 1.00 20.43 ? 165 PHE D CD2 1 +ATOM 6671 C CE1 . PHE D 1 163 ? 24.438 9.460 7.167 1.00 14.44 ? 165 PHE D CE1 1 +ATOM 6672 C CE2 . PHE D 1 163 ? 23.603 7.214 6.949 1.00 21.73 ? 165 PHE D CE2 1 +ATOM 6673 C CZ . PHE D 1 163 ? 24.476 8.213 6.547 1.00 19.02 ? 165 PHE D CZ 1 +ATOM 6674 N N . LYS D 1 164 ? 21.397 7.117 12.111 1.00 28.02 ? 166 LYS D N 1 +ATOM 6675 C CA . LYS D 1 164 ? 21.531 5.781 12.636 1.00 25.03 ? 166 LYS D CA 1 +ATOM 6676 C C . LYS D 1 164 ? 20.937 4.844 11.611 1.00 21.19 ? 166 LYS D C 1 +ATOM 6677 O O . LYS D 1 164 ? 19.734 4.891 11.363 1.00 23.40 ? 166 LYS D O 1 +ATOM 6678 C CB . LYS D 1 164 ? 20.795 5.689 13.971 1.00 27.36 ? 166 LYS D CB 1 +ATOM 6679 C CG . LYS D 1 164 ? 21.665 6.395 15.010 1.00 34.66 ? 166 LYS D CG 1 +ATOM 6680 C CD . LYS D 1 164 ? 20.907 7.001 16.171 1.00 44.07 ? 166 LYS D CD 1 +ATOM 6681 C CE . LYS D 1 164 ? 20.513 5.988 17.252 1.00 52.24 ? 166 LYS D CE 1 +ATOM 6682 N NZ . LYS D 1 164 ? 21.372 6.134 18.419 1.00 54.40 ? 166 LYS D NZ 1 +ATOM 6683 N N . ILE D 1 165 ? 21.762 4.011 10.942 1.00 21.13 ? 167 ILE D N 1 +ATOM 6684 C CA . ILE D 1 165 ? 21.218 3.001 10.059 1.00 15.57 ? 167 ILE D CA 1 +ATOM 6685 C C . ILE D 1 165 ? 20.729 1.853 10.920 1.00 15.32 ? 167 ILE D C 1 +ATOM 6686 O O . ILE D 1 165 ? 21.272 1.488 11.958 1.00 17.53 ? 167 ILE D O 1 +ATOM 6687 C CB . ILE D 1 165 ? 22.237 2.506 9.051 1.00 12.89 ? 167 ILE D CB 1 +ATOM 6688 C CG1 . ILE D 1 165 ? 22.496 3.670 8.134 1.00 12.44 ? 167 ILE D CG1 1 +ATOM 6689 C CG2 . ILE D 1 165 ? 21.741 1.281 8.209 1.00 15.62 ? 167 ILE D CG2 1 +ATOM 6690 C CD1 . ILE D 1 165 ? 21.413 4.131 7.193 1.00 3.64 ? 167 ILE D CD1 1 +ATOM 6691 N N . ARG D 1 166 ? 19.514 1.455 10.536 1.00 19.16 ? 168 ARG D N 1 +ATOM 6692 C CA . ARG D 1 166 ? 18.829 0.312 11.129 1.00 16.00 ? 168 ARG D CA 1 +ATOM 6693 C C . ARG D 1 166 ? 19.063 -0.843 10.220 1.00 7.63 ? 168 ARG D C 1 +ATOM 6694 O O . ARG D 1 166 ? 18.787 -0.840 9.016 1.00 2.00 ? 168 ARG D O 1 +ATOM 6695 C CB . ARG D 1 166 ? 17.369 0.521 11.210 1.00 10.74 ? 168 ARG D CB 1 +ATOM 6696 C CG . ARG D 1 166 ? 17.061 1.558 12.294 1.00 21.01 ? 168 ARG D CG 1 +ATOM 6697 C CD . ARG D 1 166 ? 15.584 1.965 12.411 1.00 14.70 ? 168 ARG D CD 1 +ATOM 6698 N NE . ARG D 1 166 ? 15.022 1.982 11.084 1.00 16.41 ? 168 ARG D NE 1 +ATOM 6699 C CZ . ARG D 1 166 ? 14.928 3.069 10.315 1.00 26.91 ? 168 ARG D CZ 1 +ATOM 6700 N NH1 . ARG D 1 166 ? 15.354 4.266 10.752 1.00 27.80 ? 168 ARG D NH1 1 +ATOM 6701 N NH2 . ARG D 1 166 ? 14.423 2.922 9.081 1.00 16.39 ? 168 ARG D NH2 1 +ATOM 6702 N N . HIS D 1 167 ? 19.800 -1.713 10.898 1.00 9.26 ? 169 HIS D N 1 +ATOM 6703 C CA . HIS D 1 167 ? 20.165 -3.003 10.297 1.00 18.13 ? 169 HIS D CA 1 +ATOM 6704 C C . HIS D 1 167 ? 19.413 -4.107 11.027 1.00 20.52 ? 169 HIS D C 1 +ATOM 6705 O O . HIS D 1 167 ? 19.675 -4.384 12.203 1.00 16.77 ? 169 HIS D O 1 +ATOM 6706 C CB . HIS D 1 167 ? 21.665 -3.260 10.421 1.00 18.39 ? 169 HIS D CB 1 +ATOM 6707 C CG . HIS D 1 167 ? 22.550 -2.487 9.460 1.00 6.55 ? 169 HIS D CG 1 +ATOM 6708 N ND1 . HIS D 1 167 ? 23.573 -1.723 9.822 1.00 3.74 ? 169 HIS D ND1 1 +ATOM 6709 C CD2 . HIS D 1 167 ? 22.431 -2.518 8.102 1.00 2.55 ? 169 HIS D CD2 1 +ATOM 6710 C CE1 . HIS D 1 167 ? 24.065 -1.328 8.675 1.00 6.97 ? 169 HIS D CE1 1 +ATOM 6711 N NE2 . HIS D 1 167 ? 23.402 -1.778 7.619 1.00 3.84 ? 169 HIS D NE2 1 +ATOM 6712 N N . ASN D 1 168 ? 18.385 -4.656 10.373 1.00 26.25 ? 170 ASN D N 1 +ATOM 6713 C CA . ASN D 1 168 ? 17.568 -5.713 10.965 1.00 26.37 ? 170 ASN D CA 1 +ATOM 6714 C C . ASN D 1 168 ? 18.340 -7.013 11.055 1.00 31.56 ? 170 ASN D C 1 +ATOM 6715 O O . ASN D 1 168 ? 18.976 -7.461 10.094 1.00 37.18 ? 170 ASN D O 1 +ATOM 6716 C CB . ASN D 1 168 ? 16.336 -5.890 10.118 1.00 25.98 ? 170 ASN D CB 1 +ATOM 6717 C CG . ASN D 1 168 ? 15.378 -4.689 10.105 1.00 21.55 ? 170 ASN D CG 1 +ATOM 6718 O OD1 . ASN D 1 168 ? 15.323 -3.811 10.980 1.00 26.05 ? 170 ASN D OD1 1 +ATOM 6719 N ND2 . ASN D 1 168 ? 14.584 -4.660 9.049 1.00 17.64 ? 170 ASN D ND2 1 +ATOM 6720 N N . ILE D 1 169 ? 18.348 -7.603 12.248 1.00 33.81 ? 171 ILE D N 1 +ATOM 6721 C CA . ILE D 1 169 ? 18.985 -8.890 12.459 1.00 33.57 ? 171 ILE D CA 1 +ATOM 6722 C C . ILE D 1 169 ? 17.956 -9.971 12.163 1.00 34.93 ? 171 ILE D C 1 +ATOM 6723 O O . ILE D 1 169 ? 16.728 -9.775 12.175 1.00 24.97 ? 171 ILE D O 1 +ATOM 6724 C CB . ILE D 1 169 ? 19.478 -9.048 13.938 1.00 38.82 ? 171 ILE D CB 1 +ATOM 6725 C CG1 . ILE D 1 169 ? 20.231 -7.785 14.404 1.00 36.39 ? 171 ILE D CG1 1 +ATOM 6726 C CG2 . ILE D 1 169 ? 20.411 -10.270 14.059 1.00 34.19 ? 171 ILE D CG2 1 +ATOM 6727 C CD1 . ILE D 1 169 ? 21.388 -7.416 13.489 1.00 33.68 ? 171 ILE D CD1 1 +ATOM 6728 N N . GLU D 1 170 ? 18.557 -11.160 11.951 1.00 43.30 ? 172 GLU D N 1 +ATOM 6729 C CA . GLU D 1 170 ? 17.884 -12.438 11.713 1.00 46.66 ? 172 GLU D CA 1 +ATOM 6730 C C . GLU D 1 170 ? 16.870 -12.735 12.814 1.00 46.38 ? 172 GLU D C 1 +ATOM 6731 O O . GLU D 1 170 ? 15.708 -13.021 12.497 1.00 50.24 ? 172 GLU D O 1 +ATOM 6732 C CB . GLU D 1 170 ? 18.955 -13.569 11.609 1.00 50.76 ? 172 GLU D CB 1 +ATOM 6733 C CG . GLU D 1 170 ? 19.887 -13.818 12.815 1.00 51.63 ? 172 GLU D CG 1 +ATOM 6734 C CD . GLU D 1 170 ? 21.271 -14.450 12.563 1.00 55.83 ? 172 GLU D CD 1 +ATOM 6735 O OE1 . GLU D 1 170 ? 21.639 -14.752 11.418 1.00 53.03 ? 172 GLU D OE1 1 +ATOM 6736 O OE2 . GLU D 1 170 ? 22.003 -14.633 13.544 1.00 52.29 ? 172 GLU D OE2 1 +ATOM 6737 N N . ASP D 1 171 ? 17.253 -12.552 14.088 1.00 43.71 ? 173 ASP D N 1 +ATOM 6738 C CA . ASP D 1 171 ? 16.365 -12.812 15.216 1.00 46.54 ? 173 ASP D CA 1 +ATOM 6739 C C . ASP D 1 171 ? 15.341 -11.706 15.560 1.00 47.22 ? 173 ASP D C 1 +ATOM 6740 O O . ASP D 1 171 ? 14.805 -11.689 16.679 1.00 43.13 ? 173 ASP D O 1 +ATOM 6741 C CB . ASP D 1 171 ? 17.265 -13.139 16.436 1.00 48.18 ? 173 ASP D CB 1 +ATOM 6742 C CG . ASP D 1 171 ? 17.884 -11.941 17.160 1.00 50.26 ? 173 ASP D CG 1 +ATOM 6743 O OD1 . ASP D 1 171 ? 18.247 -10.982 16.500 1.00 55.03 ? 173 ASP D OD1 1 +ATOM 6744 O OD2 . ASP D 1 171 ? 17.991 -11.941 18.387 1.00 51.37 ? 173 ASP D OD2 1 +ATOM 6745 N N . GLY D 1 172 ? 15.058 -10.751 14.636 1.00 47.07 ? 174 GLY D N 1 +ATOM 6746 C CA . GLY D 1 172 ? 14.087 -9.670 14.865 1.00 43.24 ? 174 GLY D CA 1 +ATOM 6747 C C . GLY D 1 172 ? 14.473 -8.648 15.949 1.00 38.31 ? 174 GLY D C 1 +ATOM 6748 O O . GLY D 1 172 ? 13.716 -8.254 16.841 1.00 39.37 ? 174 GLY D O 1 +ATOM 6749 N N . SER D 1 173 ? 15.759 -8.345 15.937 1.00 33.45 ? 175 SER D N 1 +ATOM 6750 C CA . SER D 1 173 ? 16.348 -7.281 16.722 1.00 27.43 ? 175 SER D CA 1 +ATOM 6751 C C . SER D 1 173 ? 16.911 -6.348 15.654 1.00 17.82 ? 175 SER D C 1 +ATOM 6752 O O . SER D 1 173 ? 16.825 -6.602 14.452 1.00 17.47 ? 175 SER D O 1 +ATOM 6753 C CB . SER D 1 173 ? 17.458 -7.829 17.607 1.00 28.11 ? 175 SER D CB 1 +ATOM 6754 O OG . SER D 1 173 ? 18.563 -8.331 16.862 1.00 29.01 ? 175 SER D OG 1 +ATOM 6755 N N . VAL D 1 174 ? 17.412 -5.187 16.022 1.00 14.43 ? 176 VAL D N 1 +ATOM 6756 C CA . VAL D 1 174 ? 17.967 -4.270 15.032 1.00 10.26 ? 176 VAL D CA 1 +ATOM 6757 C C . VAL D 1 174 ? 19.322 -3.886 15.612 1.00 13.66 ? 176 VAL D C 1 +ATOM 6758 O O . VAL D 1 174 ? 19.563 -3.836 16.844 1.00 8.39 ? 176 VAL D O 1 +ATOM 6759 C CB . VAL D 1 174 ? 17.052 -3.035 14.855 1.00 10.17 ? 176 VAL D CB 1 +ATOM 6760 C CG1 . VAL D 1 174 ? 17.433 -2.419 13.504 1.00 10.54 ? 176 VAL D CG1 1 +ATOM 6761 C CG2 . VAL D 1 174 ? 15.568 -3.361 14.658 1.00 11.14 ? 176 VAL D CG2 1 +ATOM 6762 N N . GLN D 1 175 ? 20.204 -3.883 14.608 1.00 10.82 ? 177 GLN D N 1 +ATOM 6763 C CA . GLN D 1 175 ? 21.596 -3.447 14.733 1.00 20.04 ? 177 GLN D CA 1 +ATOM 6764 C C . GLN D 1 175 ? 21.736 -2.013 14.235 1.00 15.12 ? 177 GLN D C 1 +ATOM 6765 O O . GLN D 1 175 ? 21.744 -1.733 13.031 1.00 11.79 ? 177 GLN D O 1 +ATOM 6766 C CB . GLN D 1 175 ? 22.562 -4.337 13.884 1.00 21.55 ? 177 GLN D CB 1 +ATOM 6767 C CG . GLN D 1 175 ? 24.065 -3.972 13.832 1.00 23.48 ? 177 GLN D CG 1 +ATOM 6768 C CD . GLN D 1 175 ? 24.723 -3.993 15.191 1.00 26.09 ? 177 GLN D CD 1 +ATOM 6769 O OE1 . GLN D 1 175 ? 25.063 -5.048 15.711 1.00 38.04 ? 177 GLN D OE1 1 +ATOM 6770 N NE2 . GLN D 1 175 ? 24.937 -2.850 15.826 1.00 32.30 ? 177 GLN D NE2 1 +ATOM 6771 N N . LEU D 1 176 ? 21.864 -1.115 15.194 1.00 14.12 ? 178 LEU D N 1 +ATOM 6772 C CA . LEU D 1 176 ? 22.074 0.279 14.818 1.00 17.38 ? 178 LEU D CA 1 +ATOM 6773 C C . LEU D 1 176 ? 23.532 0.547 14.407 1.00 18.09 ? 178 LEU D C 1 +ATOM 6774 O O . LEU D 1 176 ? 24.483 0.146 15.086 1.00 22.50 ? 178 LEU D O 1 +ATOM 6775 C CB . LEU D 1 176 ? 21.699 1.173 15.990 1.00 15.24 ? 178 LEU D CB 1 +ATOM 6776 C CG . LEU D 1 176 ? 20.213 1.612 16.357 1.00 21.59 ? 178 LEU D CG 1 +ATOM 6777 C CD1 . LEU D 1 176 ? 19.189 1.215 15.345 1.00 12.62 ? 178 LEU D CD1 1 +ATOM 6778 C CD2 . LEU D 1 176 ? 19.844 0.978 17.665 1.00 20.87 ? 178 LEU D CD2 1 +ATOM 6779 N N . ALA D 1 177 ? 23.710 1.105 13.215 1.00 12.41 ? 179 ALA D N 1 +ATOM 6780 C CA . ALA D 1 177 ? 24.973 1.619 12.797 1.00 12.39 ? 179 ALA D CA 1 +ATOM 6781 C C . ALA D 1 177 ? 24.986 3.190 12.868 1.00 16.10 ? 179 ALA D C 1 +ATOM 6782 O O . ALA D 1 177 ? 24.612 3.898 11.918 1.00 5.60 ? 179 ALA D O 1 +ATOM 6783 C CB . ALA D 1 177 ? 25.187 1.133 11.395 1.00 12.51 ? 179 ALA D CB 1 +ATOM 6784 N N . ASP D 1 178 ? 25.392 3.800 14.003 1.00 14.29 ? 180 ASP D N 1 +ATOM 6785 C CA . ASP D 1 178 ? 25.590 5.257 14.063 1.00 17.31 ? 180 ASP D CA 1 +ATOM 6786 C C . ASP D 1 178 ? 26.544 5.757 12.990 1.00 12.01 ? 180 ASP D C 1 +ATOM 6787 O O . ASP D 1 178 ? 27.659 5.302 12.923 1.00 8.24 ? 180 ASP D O 1 +ATOM 6788 C CB . ASP D 1 178 ? 26.188 5.692 15.334 1.00 26.89 ? 180 ASP D CB 1 +ATOM 6789 C CG . ASP D 1 178 ? 25.196 6.234 16.337 1.00 47.77 ? 180 ASP D CG 1 +ATOM 6790 O OD1 . ASP D 1 178 ? 24.906 7.443 16.253 1.00 54.32 ? 180 ASP D OD1 1 +ATOM 6791 O OD2 . ASP D 1 178 ? 24.747 5.453 17.193 1.00 52.13 ? 180 ASP D OD2 1 +ATOM 6792 N N . HIS D 1 179 ? 26.121 6.608 12.055 1.00 12.91 ? 181 HIS D N 1 +ATOM 6793 C CA . HIS D 1 179 ? 26.962 7.182 11.031 1.00 9.90 ? 181 HIS D CA 1 +ATOM 6794 C C . HIS D 1 179 ? 27.209 8.663 11.289 1.00 19.45 ? 181 HIS D C 1 +ATOM 6795 O O . HIS D 1 179 ? 26.291 9.482 11.489 1.00 15.49 ? 181 HIS D O 1 +ATOM 6796 C CB . HIS D 1 179 ? 26.340 7.100 9.733 1.00 12.44 ? 181 HIS D CB 1 +ATOM 6797 C CG . HIS D 1 179 ? 26.217 5.724 9.125 1.00 10.68 ? 181 HIS D CG 1 +ATOM 6798 N ND1 . HIS D 1 179 ? 25.649 4.601 9.609 1.00 2.00 ? 181 HIS D ND1 1 +ATOM 6799 C CD2 . HIS D 1 179 ? 26.605 5.546 7.822 1.00 8.27 ? 181 HIS D CD2 1 +ATOM 6800 C CE1 . HIS D 1 179 ? 25.694 3.791 8.601 1.00 4.37 ? 181 HIS D CE1 1 +ATOM 6801 N NE2 . HIS D 1 179 ? 26.257 4.337 7.529 1.00 3.88 ? 181 HIS D NE2 1 +ATOM 6802 N N . TYR D 1 180 ? 28.506 8.995 11.348 1.00 18.30 ? 182 TYR D N 1 +ATOM 6803 C CA . TYR D 1 180 ? 28.931 10.365 11.588 1.00 15.38 ? 182 TYR D CA 1 +ATOM 6804 C C . TYR D 1 180 ? 29.709 10.686 10.352 1.00 15.70 ? 182 TYR D C 1 +ATOM 6805 O O . TYR D 1 180 ? 30.799 10.153 10.192 1.00 17.58 ? 182 TYR D O 1 +ATOM 6806 C CB . TYR D 1 180 ? 29.816 10.420 12.761 1.00 15.17 ? 182 TYR D CB 1 +ATOM 6807 C CG . TYR D 1 180 ? 29.208 9.745 13.981 1.00 26.95 ? 182 TYR D CG 1 +ATOM 6808 C CD1 . TYR D 1 180 ? 28.272 10.430 14.791 1.00 27.58 ? 182 TYR D CD1 1 +ATOM 6809 C CD2 . TYR D 1 180 ? 29.645 8.452 14.334 1.00 27.49 ? 182 TYR D CD2 1 +ATOM 6810 C CE1 . TYR D 1 180 ? 27.786 9.824 15.957 1.00 25.33 ? 182 TYR D CE1 1 +ATOM 6811 C CE2 . TYR D 1 180 ? 29.161 7.848 15.491 1.00 30.68 ? 182 TYR D CE2 1 +ATOM 6812 C CZ . TYR D 1 180 ? 28.236 8.547 16.283 1.00 26.87 ? 182 TYR D CZ 1 +ATOM 6813 O OH . TYR D 1 180 ? 27.752 7.942 17.413 1.00 36.35 ? 182 TYR D OH 1 +ATOM 6814 N N . GLN D 1 181 ? 29.061 11.430 9.442 1.00 10.99 ? 183 GLN D N 1 +ATOM 6815 C CA . GLN D 1 181 ? 29.622 11.848 8.175 1.00 13.45 ? 183 GLN D CA 1 +ATOM 6816 C C . GLN D 1 181 ? 30.135 13.303 8.176 1.00 15.71 ? 183 GLN D C 1 +ATOM 6817 O O . GLN D 1 181 ? 29.704 14.156 8.958 1.00 15.02 ? 183 GLN D O 1 +ATOM 6818 C CB . GLN D 1 181 ? 28.532 11.658 7.144 1.00 11.13 ? 183 GLN D CB 1 +ATOM 6819 C CG . GLN D 1 181 ? 28.934 12.053 5.746 1.00 10.09 ? 183 GLN D CG 1 +ATOM 6820 C CD . GLN D 1 181 ? 27.806 11.848 4.782 1.00 13.02 ? 183 GLN D CD 1 +ATOM 6821 O OE1 . GLN D 1 181 ? 26.833 11.227 5.160 1.00 27.77 ? 183 GLN D OE1 1 +ATOM 6822 N NE2 . GLN D 1 181 ? 27.901 12.225 3.502 1.00 19.39 ? 183 GLN D NE2 1 +ATOM 6823 N N . GLN D 1 182 ? 31.042 13.585 7.242 1.00 17.05 ? 184 GLN D N 1 +ATOM 6824 C CA . GLN D 1 182 ? 31.773 14.832 7.071 1.00 12.99 ? 184 GLN D CA 1 +ATOM 6825 C C . GLN D 1 182 ? 32.239 14.870 5.657 1.00 14.68 ? 184 GLN D C 1 +ATOM 6826 O O . GLN D 1 182 ? 32.984 13.997 5.214 1.00 24.23 ? 184 GLN D O 1 +ATOM 6827 C CB . GLN D 1 182 ? 33.003 14.874 7.930 1.00 22.73 ? 184 GLN D CB 1 +ATOM 6828 C CG . GLN D 1 182 ? 32.593 15.312 9.328 1.00 38.08 ? 184 GLN D CG 1 +ATOM 6829 C CD . GLN D 1 182 ? 33.697 15.516 10.354 1.00 45.10 ? 184 GLN D CD 1 +ATOM 6830 O OE1 . GLN D 1 182 ? 33.483 16.227 11.341 1.00 46.32 ? 184 GLN D OE1 1 +ATOM 6831 N NE2 . GLN D 1 182 ? 34.874 14.896 10.173 1.00 50.07 ? 184 GLN D NE2 1 +ATOM 6832 N N . ASN D 1 183 ? 31.751 15.817 4.880 1.00 16.37 ? 185 ASN D N 1 +ATOM 6833 C CA . ASN D 1 183 ? 32.231 15.987 3.530 1.00 16.40 ? 185 ASN D CA 1 +ATOM 6834 C C . ASN D 1 183 ? 32.900 17.345 3.420 1.00 23.55 ? 185 ASN D C 1 +ATOM 6835 O O . ASN D 1 183 ? 32.485 18.324 4.043 1.00 26.30 ? 185 ASN D O 1 +ATOM 6836 C CB . ASN D 1 183 ? 31.143 15.966 2.532 1.00 14.20 ? 185 ASN D CB 1 +ATOM 6837 C CG . ASN D 1 183 ? 30.384 14.668 2.401 1.00 12.28 ? 185 ASN D CG 1 +ATOM 6838 O OD1 . ASN D 1 183 ? 29.995 14.118 3.420 1.00 2.00 ? 185 ASN D OD1 1 +ATOM 6839 N ND2 . ASN D 1 183 ? 30.201 14.118 1.197 1.00 4.02 ? 185 ASN D ND2 1 +ATOM 6840 N N . THR D 1 184 ? 34.036 17.374 2.706 1.00 25.32 ? 186 THR D N 1 +ATOM 6841 C CA . THR D 1 184 ? 34.794 18.582 2.465 1.00 17.62 ? 186 THR D CA 1 +ATOM 6842 C C . THR D 1 184 ? 35.036 18.520 0.966 1.00 21.82 ? 186 THR D C 1 +ATOM 6843 O O . THR D 1 184 ? 35.269 17.421 0.459 1.00 22.14 ? 186 THR D O 1 +ATOM 6844 C CB . THR D 1 184 ? 36.101 18.568 3.295 1.00 16.65 ? 186 THR D CB 1 +ATOM 6845 O OG1 . THR D 1 184 ? 36.928 17.578 2.722 1.00 32.70 ? 186 THR D OG1 1 +ATOM 6846 C CG2 . THR D 1 184 ? 35.923 18.177 4.761 1.00 14.68 ? 186 THR D CG2 1 +ATOM 6847 N N . PRO D 1 185 ? 34.926 19.603 0.149 1.00 22.95 ? 187 PRO D N 1 +ATOM 6848 C CA . PRO D 1 185 ? 35.303 19.555 -1.256 1.00 24.39 ? 187 PRO D CA 1 +ATOM 6849 C C . PRO D 1 185 ? 36.803 19.340 -1.517 1.00 25.38 ? 187 PRO D C 1 +ATOM 6850 O O . PRO D 1 185 ? 37.669 19.642 -0.689 1.00 24.08 ? 187 PRO D O 1 +ATOM 6851 C CB . PRO D 1 185 ? 34.763 20.854 -1.788 1.00 21.70 ? 187 PRO D CB 1 +ATOM 6852 C CG . PRO D 1 185 ? 34.795 21.761 -0.602 1.00 16.29 ? 187 PRO D CG 1 +ATOM 6853 C CD . PRO D 1 185 ? 34.335 20.891 0.504 1.00 13.72 ? 187 PRO D CD 1 +ATOM 6854 N N . ILE D 1 186 ? 37.030 18.722 -2.680 1.00 26.82 ? 188 ILE D N 1 +ATOM 6855 C CA . ILE D 1 186 ? 38.358 18.490 -3.199 1.00 29.93 ? 188 ILE D CA 1 +ATOM 6856 C C . ILE D 1 186 ? 38.784 19.804 -3.840 1.00 33.76 ? 188 ILE D C 1 +ATOM 6857 O O . ILE D 1 186 ? 39.728 20.379 -3.284 1.00 36.65 ? 188 ILE D O 1 +ATOM 6858 C CB . ILE D 1 186 ? 38.304 17.301 -4.189 1.00 22.29 ? 188 ILE D CB 1 +ATOM 6859 C CG1 . ILE D 1 186 ? 38.247 16.035 -3.305 1.00 17.57 ? 188 ILE D CG1 1 +ATOM 6860 C CG2 . ILE D 1 186 ? 39.508 17.245 -5.144 1.00 24.16 ? 188 ILE D CG2 1 +ATOM 6861 C CD1 . ILE D 1 186 ? 37.764 14.784 -4.077 1.00 8.43 ? 188 ILE D CD1 1 +ATOM 6862 N N . GLY D 1 187 ? 38.117 20.322 -4.896 1.00 31.60 ? 189 GLY D N 1 +ATOM 6863 C CA . GLY D 1 187 ? 38.437 21.619 -5.500 1.00 36.34 ? 189 GLY D CA 1 +ATOM 6864 C C . GLY D 1 187 ? 38.548 22.797 -4.511 1.00 37.25 ? 189 GLY D C 1 +ATOM 6865 O O . GLY D 1 187 ? 38.371 22.647 -3.282 1.00 35.81 ? 189 GLY D O 1 +ATOM 6866 N N . ASP D 1 188 ? 38.871 23.998 -5.042 1.00 36.45 ? 190 ASP D N 1 +ATOM 6867 C CA . ASP D 1 188 ? 39.102 25.154 -4.172 1.00 34.84 ? 190 ASP D CA 1 +ATOM 6868 C C . ASP D 1 188 ? 38.034 26.211 -4.187 1.00 35.09 ? 190 ASP D C 1 +ATOM 6869 O O . ASP D 1 188 ? 37.897 26.951 -3.202 1.00 35.50 ? 190 ASP D O 1 +ATOM 6870 C CB . ASP D 1 188 ? 40.442 25.837 -4.498 1.00 35.69 ? 190 ASP D CB 1 +ATOM 6871 C CG . ASP D 1 188 ? 41.536 25.502 -3.474 1.00 40.64 ? 190 ASP D CG 1 +ATOM 6872 O OD1 . ASP D 1 188 ? 41.316 25.656 -2.262 1.00 39.46 ? 190 ASP D OD1 1 +ATOM 6873 O OD2 . ASP D 1 188 ? 42.614 25.072 -3.894 1.00 38.95 ? 190 ASP D OD2 1 +ATOM 6874 N N . GLY D 1 189 ? 37.242 26.236 -5.274 1.00 31.87 ? 191 GLY D N 1 +ATOM 6875 C CA . GLY D 1 189 ? 36.124 27.157 -5.355 1.00 32.94 ? 191 GLY D CA 1 +ATOM 6876 C C . GLY D 1 189 ? 35.149 27.124 -4.157 1.00 31.04 ? 191 GLY D C 1 +ATOM 6877 O O . GLY D 1 189 ? 35.225 26.246 -3.274 1.00 38.35 ? 191 GLY D O 1 +ATOM 6878 N N . PRO D 1 190 ? 34.198 28.074 -4.068 1.00 23.72 ? 192 PRO D N 1 +ATOM 6879 C CA . PRO D 1 190 ? 33.143 28.027 -3.084 1.00 16.77 ? 192 PRO D CA 1 +ATOM 6880 C C . PRO D 1 190 ? 32.114 27.000 -3.559 1.00 14.19 ? 192 PRO D C 1 +ATOM 6881 O O . PRO D 1 190 ? 31.898 26.713 -4.759 1.00 12.36 ? 192 PRO D O 1 +ATOM 6882 C CB . PRO D 1 190 ? 32.658 29.402 -3.084 1.00 16.17 ? 192 PRO D CB 1 +ATOM 6883 C CG . PRO D 1 190 ? 32.705 29.784 -4.562 1.00 14.68 ? 192 PRO D CG 1 +ATOM 6884 C CD . PRO D 1 190 ? 33.971 29.137 -5.052 1.00 18.25 ? 192 PRO D CD 1 +ATOM 6885 N N . VAL D 1 191 ? 31.454 26.486 -2.544 1.00 11.81 ? 193 VAL D N 1 +ATOM 6886 C CA . VAL D 1 191 ? 30.403 25.488 -2.779 1.00 16.99 ? 193 VAL D CA 1 +ATOM 6887 C C . VAL D 1 191 ? 29.115 25.950 -2.061 1.00 20.97 ? 193 VAL D C 1 +ATOM 6888 O O . VAL D 1 191 ? 29.085 26.862 -1.200 1.00 19.21 ? 193 VAL D O 1 +ATOM 6889 C CB . VAL D 1 191 ? 30.883 24.091 -2.238 1.00 6.14 ? 193 VAL D CB 1 +ATOM 6890 C CG1 . VAL D 1 191 ? 32.180 23.629 -2.917 1.00 2.84 ? 193 VAL D CG1 1 +ATOM 6891 C CG2 . VAL D 1 191 ? 31.300 24.211 -0.783 1.00 15.41 ? 193 VAL D CG2 1 +ATOM 6892 N N . LEU D 1 192 ? 28.006 25.268 -2.383 1.00 18.82 ? 194 LEU D N 1 +ATOM 6893 C CA . LEU D 1 192 ? 26.769 25.589 -1.697 1.00 14.33 ? 194 LEU D CA 1 +ATOM 6894 C C . LEU D 1 192 ? 26.814 24.910 -0.383 1.00 13.85 ? 194 LEU D C 1 +ATOM 6895 O O . LEU D 1 192 ? 27.054 23.712 -0.310 1.00 22.86 ? 194 LEU D O 1 +ATOM 6896 C CB . LEU D 1 192 ? 25.581 25.114 -2.522 1.00 12.18 ? 194 LEU D CB 1 +ATOM 6897 C CG . LEU D 1 192 ? 25.677 25.745 -3.851 1.00 6.31 ? 194 LEU D CG 1 +ATOM 6898 C CD1 . LEU D 1 192 ? 24.883 25.017 -4.899 1.00 13.27 ? 194 LEU D CD1 1 +ATOM 6899 C CD2 . LEU D 1 192 ? 25.298 27.212 -3.613 1.00 9.26 ? 194 LEU D CD2 1 +ATOM 6900 N N . LEU D 1 193 ? 26.680 25.691 0.669 1.00 18.46 ? 195 LEU D N 1 +ATOM 6901 C CA . LEU D 1 193 ? 26.682 25.151 2.011 1.00 15.24 ? 195 LEU D CA 1 +ATOM 6902 C C . LEU D 1 193 ? 25.305 25.302 2.616 1.00 23.60 ? 195 LEU D C 1 +ATOM 6903 O O . LEU D 1 193 ? 24.747 26.411 2.664 1.00 29.34 ? 195 LEU D O 1 +ATOM 6904 C CB . LEU D 1 193 ? 27.605 25.876 2.914 1.00 19.73 ? 195 LEU D CB 1 +ATOM 6905 C CG . LEU D 1 193 ? 29.065 25.884 2.782 1.00 21.28 ? 195 LEU D CG 1 +ATOM 6906 C CD1 . LEU D 1 193 ? 29.613 26.512 4.047 1.00 24.49 ? 195 LEU D CD1 1 +ATOM 6907 C CD2 . LEU D 1 193 ? 29.591 24.482 2.681 1.00 25.53 ? 195 LEU D CD2 1 +ATOM 6908 N N . PRO D 1 194 ? 24.728 24.213 3.126 1.00 24.35 ? 196 PRO D N 1 +ATOM 6909 C CA . PRO D 1 194 ? 23.297 24.164 3.375 1.00 12.47 ? 196 PRO D CA 1 +ATOM 6910 C C . PRO D 1 194 ? 22.685 24.460 4.738 1.00 10.98 ? 196 PRO D C 1 +ATOM 6911 O O . PRO D 1 194 ? 23.249 24.382 5.858 1.00 7.20 ? 196 PRO D O 1 +ATOM 6912 C CB . PRO D 1 194 ? 23.009 22.769 2.827 1.00 21.97 ? 196 PRO D CB 1 +ATOM 6913 C CG . PRO D 1 194 ? 24.154 21.927 3.394 1.00 23.07 ? 196 PRO D CG 1 +ATOM 6914 C CD . PRO D 1 194 ? 25.340 22.863 3.133 1.00 21.81 ? 196 PRO D CD 1 +ATOM 6915 N N . ASP D 1 195 ? 21.387 24.803 4.636 1.00 11.18 ? 197 ASP D N 1 +ATOM 6916 C CA . ASP D 1 195 ? 20.659 24.893 5.920 1.00 16.44 ? 197 ASP D CA 1 +ATOM 6917 C C . ASP D 1 195 ? 20.296 23.409 6.239 1.00 14.93 ? 197 ASP D C 1 +ATOM 6918 O O . ASP D 1 195 ? 20.292 22.553 5.348 1.00 3.62 ? 197 ASP D O 1 +ATOM 6919 C CB . ASP D 1 195 ? 19.371 25.745 5.810 1.00 17.28 ? 197 ASP D CB 1 +ATOM 6920 C CG . ASP D 1 195 ? 19.492 27.195 5.286 1.00 30.38 ? 197 ASP D CG 1 +ATOM 6921 O OD1 . ASP D 1 195 ? 20.581 27.814 5.369 1.00 29.50 ? 197 ASP D OD1 1 +ATOM 6922 O OD2 . ASP D 1 195 ? 18.471 27.686 4.775 1.00 24.31 ? 197 ASP D OD2 1 +ATOM 6923 N N . ASN D 1 196 ? 20.122 23.092 7.528 1.00 5.12 ? 198 ASN D N 1 +ATOM 6924 C CA . ASN D 1 196 ? 19.623 21.830 7.990 1.00 12.11 ? 198 ASN D CA 1 +ATOM 6925 C C . ASN D 1 196 ? 18.454 21.298 7.216 1.00 16.73 ? 198 ASN D C 1 +ATOM 6926 O O . ASN D 1 196 ? 17.342 21.837 7.165 1.00 29.61 ? 198 ASN D O 1 +ATOM 6927 C CB . ASN D 1 196 ? 19.199 21.941 9.401 1.00 2.85 ? 198 ASN D CB 1 +ATOM 6928 C CG . ASN D 1 196 ? 20.368 22.274 10.275 1.00 10.61 ? 198 ASN D CG 1 +ATOM 6929 O OD1 . ASN D 1 196 ? 21.480 22.488 9.788 1.00 12.21 ? 198 ASN D OD1 1 +ATOM 6930 N ND2 . ASN D 1 196 ? 20.131 22.306 11.587 1.00 10.34 ? 198 ASN D ND2 1 +ATOM 6931 N N . HIS D 1 197 ? 18.845 20.296 6.459 1.00 15.38 ? 199 HIS D N 1 +ATOM 6932 C CA . HIS D 1 197 ? 17.897 19.486 5.766 1.00 13.68 ? 199 HIS D CA 1 +ATOM 6933 C C . HIS D 1 197 ? 18.316 18.024 5.977 1.00 16.01 ? 199 HIS D C 1 +ATOM 6934 O O . HIS D 1 197 ? 19.097 17.651 6.865 1.00 7.30 ? 199 HIS D O 1 +ATOM 6935 C CB . HIS D 1 197 ? 17.897 19.891 4.320 1.00 8.64 ? 199 HIS D CB 1 +ATOM 6936 C CG . HIS D 1 197 ? 19.132 19.596 3.534 1.00 12.31 ? 199 HIS D CG 1 +ATOM 6937 N ND1 . HIS D 1 197 ? 20.376 19.949 3.803 1.00 9.55 ? 199 HIS D ND1 1 +ATOM 6938 C CD2 . HIS D 1 197 ? 19.098 18.935 2.327 1.00 16.73 ? 199 HIS D CD2 1 +ATOM 6939 C CE1 . HIS D 1 197 ? 21.072 19.520 2.769 1.00 19.51 ? 199 HIS D CE1 1 +ATOM 6940 N NE2 . HIS D 1 197 ? 20.322 18.907 1.881 1.00 11.65 ? 199 HIS D NE2 1 +ATOM 6941 N N . TYR D 1 198 ? 17.696 17.150 5.208 1.00 18.15 ? 200 TYR D N 1 +ATOM 6942 C CA . TYR D 1 198 ? 17.980 15.734 5.287 1.00 18.50 ? 200 TYR D CA 1 +ATOM 6943 C C . TYR D 1 198 ? 17.721 15.201 3.934 1.00 12.12 ? 200 TYR D C 1 +ATOM 6944 O O . TYR D 1 198 ? 17.139 15.835 3.061 1.00 8.58 ? 200 TYR D O 1 +ATOM 6945 C CB . TYR D 1 198 ? 17.109 14.987 6.327 1.00 23.08 ? 200 TYR D CB 1 +ATOM 6946 C CG . TYR D 1 198 ? 15.581 14.952 6.171 1.00 28.99 ? 200 TYR D CG 1 +ATOM 6947 C CD1 . TYR D 1 198 ? 14.988 13.963 5.384 1.00 27.83 ? 200 TYR D CD1 1 +ATOM 6948 C CD2 . TYR D 1 198 ? 14.776 15.886 6.842 1.00 29.81 ? 200 TYR D CD2 1 +ATOM 6949 C CE1 . TYR D 1 198 ? 13.597 13.889 5.255 1.00 33.75 ? 200 TYR D CE1 1 +ATOM 6950 C CE2 . TYR D 1 198 ? 13.385 15.812 6.718 1.00 32.17 ? 200 TYR D CE2 1 +ATOM 6951 C CZ . TYR D 1 198 ? 12.806 14.816 5.930 1.00 33.88 ? 200 TYR D CZ 1 +ATOM 6952 O OH . TYR D 1 198 ? 11.435 14.735 5.829 1.00 41.66 ? 200 TYR D OH 1 +ATOM 6953 N N . LEU D 1 199 ? 18.381 14.078 3.760 1.00 16.17 ? 201 LEU D N 1 +ATOM 6954 C CA . LEU D 1 199 ? 18.196 13.321 2.528 1.00 19.78 ? 201 LEU D CA 1 +ATOM 6955 C C . LEU D 1 199 ? 17.374 12.121 2.960 1.00 17.84 ? 201 LEU D C 1 +ATOM 6956 O O . LEU D 1 199 ? 17.768 11.314 3.813 1.00 19.10 ? 201 LEU D O 1 +ATOM 6957 C CB . LEU D 1 199 ? 19.496 12.799 1.948 1.00 18.45 ? 201 LEU D CB 1 +ATOM 6958 C CG . LEU D 1 199 ? 20.620 13.743 1.554 1.00 23.97 ? 201 LEU D CG 1 +ATOM 6959 C CD1 . LEU D 1 199 ? 21.822 12.911 1.124 1.00 4.25 ? 201 LEU D CD1 1 +ATOM 6960 C CD2 . LEU D 1 199 ? 20.209 14.609 0.374 1.00 19.59 ? 201 LEU D CD2 1 +ATOM 6961 N N . SER D 1 200 ? 16.184 12.051 2.384 1.00 15.69 ? 202 SER D N 1 +ATOM 6962 C CA . SER D 1 200 ? 15.277 10.939 2.624 1.00 18.35 ? 202 SER D CA 1 +ATOM 6963 C C . SER D 1 200 ? 15.801 9.823 1.741 1.00 11.54 ? 202 SER D C 1 +ATOM 6964 O O . SER D 1 200 ? 15.714 9.832 0.502 1.00 12.34 ? 202 SER D O 1 +ATOM 6965 C CB . SER D 1 200 ? 13.829 11.313 2.240 1.00 13.51 ? 202 SER D CB 1 +ATOM 6966 O OG . SER D 1 200 ? 12.983 10.167 2.223 1.00 25.71 ? 202 SER D OG 1 +ATOM 6967 N N . THR D 1 201 ? 16.372 8.837 2.419 1.00 7.90 ? 203 THR D N 1 +ATOM 6968 C CA . THR D 1 201 ? 16.913 7.745 1.621 1.00 12.01 ? 203 THR D CA 1 +ATOM 6969 C C . THR D 1 201 ? 16.206 6.416 1.875 1.00 12.44 ? 203 THR D C 1 +ATOM 6970 O O . THR D 1 201 ? 15.840 5.988 2.974 1.00 7.04 ? 203 THR D O 1 +ATOM 6971 C CB . THR D 1 201 ? 18.473 7.597 1.867 1.00 18.26 ? 203 THR D CB 1 +ATOM 6972 O OG1 . THR D 1 201 ? 19.120 8.829 2.241 1.00 14.68 ? 203 THR D OG1 1 +ATOM 6973 C CG2 . THR D 1 201 ? 19.102 7.196 0.542 1.00 16.95 ? 203 THR D CG2 1 +ATOM 6974 N N . GLN D 1 202 ? 16.050 5.803 0.713 1.00 11.42 ? 204 GLN D N 1 +ATOM 6975 C CA . GLN D 1 202 ? 15.389 4.525 0.587 1.00 15.05 ? 204 GLN D CA 1 +ATOM 6976 C C . GLN D 1 202 ? 16.213 3.665 -0.323 1.00 14.96 ? 204 GLN D C 1 +ATOM 6977 O O . GLN D 1 202 ? 16.565 4.115 -1.425 1.00 6.59 ? 204 GLN D O 1 +ATOM 6978 C CB . GLN D 1 202 ? 13.994 4.636 -0.074 1.00 11.63 ? 204 GLN D CB 1 +ATOM 6979 C CG . GLN D 1 202 ? 12.950 4.934 0.904 1.00 18.63 ? 204 GLN D CG 1 +ATOM 6980 C CD . GLN D 1 202 ? 11.713 5.314 0.139 1.00 25.74 ? 204 GLN D CD 1 +ATOM 6981 O OE1 . GLN D 1 202 ? 10.713 4.622 0.265 1.00 13.40 ? 204 GLN D OE1 1 +ATOM 6982 N NE2 . GLN D 1 202 ? 11.760 6.409 -0.646 1.00 25.07 ? 204 GLN D NE2 1 +ATOM 6983 N N . SER D 1 203 ? 16.391 2.407 0.143 1.00 21.38 ? 205 SER D N 1 +ATOM 6984 C CA . SER D 1 203 ? 17.163 1.418 -0.622 1.00 23.30 ? 205 SER D CA 1 +ATOM 6985 C C . SER D 1 203 ? 16.565 0.024 -0.533 1.00 24.18 ? 205 SER D C 1 +ATOM 6986 O O . SER D 1 203 ? 15.890 -0.399 0.417 1.00 27.55 ? 205 SER D O 1 +ATOM 6987 C CB . SER D 1 203 ? 18.578 1.343 -0.112 1.00 25.63 ? 205 SER D CB 1 +ATOM 6988 O OG . SER D 1 203 ? 19.093 2.586 0.346 1.00 24.45 ? 205 SER D OG 1 +ATOM 6989 N N . ALA D 1 204 ? 16.812 -0.699 -1.605 1.00 25.85 ? 206 ALA D N 1 +ATOM 6990 C CA . ALA D 1 204 ? 16.368 -2.074 -1.737 1.00 21.30 ? 206 ALA D CA 1 +ATOM 6991 C C . ALA D 1 204 ? 17.483 -2.897 -2.372 1.00 16.76 ? 206 ALA D C 1 +ATOM 6992 O O . ALA D 1 204 ? 17.978 -2.671 -3.476 1.00 17.78 ? 206 ALA D O 1 +ATOM 6993 C CB . ALA D 1 204 ? 15.118 -2.109 -2.594 1.00 20.57 ? 206 ALA D CB 1 +ATOM 6994 N N . LEU D 1 205 ? 17.888 -3.856 -1.555 1.00 17.73 ? 207 LEU D N 1 +ATOM 6995 C CA . LEU D 1 205 ? 18.984 -4.785 -1.902 1.00 17.96 ? 207 LEU D CA 1 +ATOM 6996 C C . LEU D 1 205 ? 18.444 -6.025 -2.581 1.00 19.04 ? 207 LEU D C 1 +ATOM 6997 O O . LEU D 1 205 ? 17.535 -6.711 -2.104 1.00 20.76 ? 207 LEU D O 1 +ATOM 6998 C CB . LEU D 1 205 ? 19.713 -5.252 -0.688 1.00 6.07 ? 207 LEU D CB 1 +ATOM 6999 C CG . LEU D 1 205 ? 20.119 -4.264 0.347 1.00 10.29 ? 207 LEU D CG 1 +ATOM 7000 C CD1 . LEU D 1 205 ? 20.906 -4.998 1.383 1.00 12.64 ? 207 LEU D CD1 1 +ATOM 7001 C CD2 . LEU D 1 205 ? 20.920 -3.117 -0.281 1.00 2.00 ? 207 LEU D CD2 1 +ATOM 7002 N N . SER D 1 206 ? 19.038 -6.281 -3.732 1.00 15.24 ? 208 SER D N 1 +ATOM 7003 C CA . SER D 1 206 ? 18.686 -7.414 -4.513 1.00 9.77 ? 208 SER D CA 1 +ATOM 7004 C C . SER D 1 206 ? 19.964 -8.196 -4.940 1.00 18.01 ? 208 SER D C 1 +ATOM 7005 O O . SER D 1 206 ? 21.107 -7.919 -4.561 1.00 13.44 ? 208 SER D O 1 +ATOM 7006 C CB . SER D 1 206 ? 17.871 -6.871 -5.651 1.00 4.43 ? 208 SER D CB 1 +ATOM 7007 O OG . SER D 1 206 ? 18.459 -6.782 -6.936 1.00 23.22 ? 208 SER D OG 1 +ATOM 7008 N N . LYS D 1 207 ? 19.785 -9.266 -5.710 1.00 18.31 ? 209 LYS D N 1 +ATOM 7009 C CA . LYS D 1 207 ? 20.866 -10.135 -6.135 1.00 21.27 ? 209 LYS D CA 1 +ATOM 7010 C C . LYS D 1 207 ? 20.695 -10.293 -7.611 1.00 23.18 ? 209 LYS D C 1 +ATOM 7011 O O . LYS D 1 207 ? 19.556 -10.287 -8.068 1.00 23.17 ? 209 LYS D O 1 +ATOM 7012 C CB . LYS D 1 207 ? 20.735 -11.494 -5.518 1.00 17.86 ? 209 LYS D CB 1 +ATOM 7013 C CG . LYS D 1 207 ? 21.133 -11.558 -4.047 1.00 17.88 ? 209 LYS D CG 1 +ATOM 7014 C CD . LYS D 1 207 ? 22.633 -11.308 -3.909 1.00 12.25 ? 209 LYS D CD 1 +ATOM 7015 C CE . LYS D 1 207 ? 22.815 -11.452 -2.430 1.00 14.91 ? 209 LYS D CE 1 +ATOM 7016 N NZ . LYS D 1 207 ? 24.129 -10.991 -2.113 1.00 16.19 ? 209 LYS D NZ 1 +ATOM 7017 N N . ASP D 1 208 ? 21.770 -10.377 -8.384 1.00 26.78 ? 210 ASP D N 1 +ATOM 7018 C CA . ASP D 1 208 ? 21.668 -10.748 -9.795 1.00 36.39 ? 210 ASP D CA 1 +ATOM 7019 C C . ASP D 1 208 ? 21.641 -12.281 -9.722 1.00 37.17 ? 210 ASP D C 1 +ATOM 7020 O O . ASP D 1 208 ? 22.614 -12.851 -9.231 1.00 37.23 ? 210 ASP D O 1 +ATOM 7021 C CB . ASP D 1 208 ? 22.907 -10.221 -10.559 1.00 35.78 ? 210 ASP D CB 1 +ATOM 7022 C CG . ASP D 1 208 ? 22.962 -10.389 -12.083 1.00 42.60 ? 210 ASP D CG 1 +ATOM 7023 O OD1 . ASP D 1 208 ? 22.084 -11.039 -12.675 1.00 43.69 ? 210 ASP D OD1 1 +ATOM 7024 O OD2 . ASP D 1 208 ? 23.907 -9.855 -12.682 1.00 40.41 ? 210 ASP D OD2 1 +ATOM 7025 N N . PRO D 1 209 ? 20.556 -13.017 -10.072 1.00 42.67 ? 211 PRO D N 1 +ATOM 7026 C CA . PRO D 1 209 ? 20.512 -14.467 -10.023 1.00 45.13 ? 211 PRO D CA 1 +ATOM 7027 C C . PRO D 1 209 ? 21.402 -15.088 -11.094 1.00 43.69 ? 211 PRO D C 1 +ATOM 7028 O O . PRO D 1 209 ? 21.667 -16.283 -11.035 1.00 47.72 ? 211 PRO D O 1 +ATOM 7029 C CB . PRO D 1 209 ? 19.015 -14.798 -10.150 1.00 47.52 ? 211 PRO D CB 1 +ATOM 7030 C CG . PRO D 1 209 ? 18.502 -13.684 -11.002 1.00 43.33 ? 211 PRO D CG 1 +ATOM 7031 C CD . PRO D 1 209 ? 19.211 -12.520 -10.334 1.00 43.47 ? 211 PRO D CD 1 +ATOM 7032 N N . ASN D 1 210 ? 21.893 -14.289 -12.042 1.00 41.65 ? 212 ASN D N 1 +ATOM 7033 C CA . ASN D 1 210 ? 22.815 -14.755 -13.066 1.00 44.88 ? 212 ASN D CA 1 +ATOM 7034 C C . ASN D 1 210 ? 24.267 -14.422 -12.750 1.00 42.58 ? 212 ASN D C 1 +ATOM 7035 O O . ASN D 1 210 ? 25.137 -14.528 -13.609 1.00 46.21 ? 212 ASN D O 1 +ATOM 7036 C CB . ASN D 1 210 ? 22.440 -14.133 -14.413 1.00 49.64 ? 212 ASN D CB 1 +ATOM 7037 C CG . ASN D 1 210 ? 20.991 -14.398 -14.789 1.00 54.36 ? 212 ASN D CG 1 +ATOM 7038 O OD1 . ASN D 1 210 ? 20.104 -14.443 -13.934 1.00 62.93 ? 212 ASN D OD1 1 +ATOM 7039 N ND2 . ASN D 1 210 ? 20.713 -14.603 -16.074 1.00 57.51 ? 212 ASN D ND2 1 +ATOM 7040 N N . GLU D 1 211 ? 24.513 -14.040 -11.495 1.00 42.74 ? 213 GLU D N 1 +ATOM 7041 C CA . GLU D 1 211 ? 25.807 -13.638 -10.975 1.00 40.63 ? 213 GLU D CA 1 +ATOM 7042 C C . GLU D 1 211 ? 26.357 -14.591 -9.923 1.00 39.43 ? 213 GLU D C 1 +ATOM 7043 O O . GLU D 1 211 ? 25.761 -14.790 -8.853 1.00 31.34 ? 213 GLU D O 1 +ATOM 7044 C CB . GLU D 1 211 ? 25.659 -12.266 -10.386 1.00 42.56 ? 213 GLU D CB 1 +ATOM 7045 C CG . GLU D 1 211 ? 26.874 -11.625 -9.782 1.00 47.60 ? 213 GLU D CG 1 +ATOM 7046 C CD . GLU D 1 211 ? 28.022 -11.480 -10.743 1.00 51.72 ? 213 GLU D CD 1 +ATOM 7047 O OE1 . GLU D 1 211 ? 27.861 -11.118 -11.910 1.00 54.82 ? 213 GLU D OE1 1 +ATOM 7048 O OE2 . GLU D 1 211 ? 29.111 -11.763 -10.299 1.00 57.96 ? 213 GLU D OE2 1 +ATOM 7049 N N . LYS D 1 212 ? 27.530 -15.168 -10.232 1.00 40.62 ? 214 LYS D N 1 +ATOM 7050 C CA . LYS D 1 212 ? 28.117 -16.115 -9.298 1.00 40.06 ? 214 LYS D CA 1 +ATOM 7051 C C . LYS D 1 212 ? 28.955 -15.475 -8.205 1.00 33.57 ? 214 LYS D C 1 +ATOM 7052 O O . LYS D 1 212 ? 29.017 -16.003 -7.105 1.00 38.06 ? 214 LYS D O 1 +ATOM 7053 C CB . LYS D 1 212 ? 28.949 -17.137 -10.089 1.00 46.37 ? 214 LYS D CB 1 +ATOM 7054 C CG . LYS D 1 212 ? 28.183 -18.333 -10.721 1.00 52.08 ? 214 LYS D CG 1 +ATOM 7055 C CD . LYS D 1 212 ? 27.640 -18.082 -12.131 1.00 58.21 ? 214 LYS D CD 1 +ATOM 7056 C CE . LYS D 1 212 ? 28.306 -18.988 -13.163 1.00 62.46 ? 214 LYS D CE 1 +ATOM 7057 N NZ . LYS D 1 212 ? 28.084 -20.396 -12.868 1.00 67.52 ? 214 LYS D NZ 1 +ATOM 7058 N N . ARG D 1 213 ? 29.577 -14.318 -8.450 1.00 31.11 ? 215 ARG D N 1 +ATOM 7059 C CA . ARG D 1 213 ? 30.392 -13.588 -7.479 1.00 27.17 ? 215 ARG D CA 1 +ATOM 7060 C C . ARG D 1 213 ? 29.608 -13.048 -6.295 1.00 22.10 ? 215 ARG D C 1 +ATOM 7061 O O . ARG D 1 213 ? 28.409 -12.849 -6.424 1.00 24.45 ? 215 ARG D O 1 +ATOM 7062 C CB . ARG D 1 213 ? 31.118 -12.417 -8.203 1.00 28.99 ? 215 ARG D CB 1 +ATOM 7063 C CG . ARG D 1 213 ? 32.323 -12.848 -9.033 1.00 30.53 ? 215 ARG D CG 1 +ATOM 7064 C CD . ARG D 1 213 ? 32.475 -12.513 -10.505 1.00 39.93 ? 215 ARG D CD 1 +ATOM 7065 N NE . ARG D 1 213 ? 32.291 -11.188 -10.986 1.00 44.84 ? 215 ARG D NE 1 +ATOM 7066 C CZ . ARG D 1 213 ? 31.595 -10.517 -11.906 1.00 49.58 ? 215 ARG D CZ 1 +ATOM 7067 N NH1 . ARG D 1 213 ? 30.700 -10.978 -12.781 1.00 51.72 ? 215 ARG D NH1 1 +ATOM 7068 N NH2 . ARG D 1 213 ? 31.953 -9.240 -11.964 1.00 49.25 ? 215 ARG D NH2 1 +ATOM 7069 N N . ASP D 1 214 ? 30.182 -12.842 -5.107 1.00 22.48 ? 216 ASP D N 1 +ATOM 7070 C CA . ASP D 1 214 ? 29.466 -12.229 -3.985 1.00 21.12 ? 216 ASP D CA 1 +ATOM 7071 C C . ASP D 1 214 ? 29.201 -10.813 -4.483 1.00 24.02 ? 216 ASP D C 1 +ATOM 7072 O O . ASP D 1 214 ? 30.080 -10.101 -4.986 1.00 27.98 ? 216 ASP D O 1 +ATOM 7073 C CB . ASP D 1 214 ? 30.306 -12.104 -2.736 1.00 14.60 ? 216 ASP D CB 1 +ATOM 7074 C CG . ASP D 1 214 ? 29.526 -12.067 -1.438 1.00 25.03 ? 216 ASP D CG 1 +ATOM 7075 O OD1 . ASP D 1 214 ? 28.277 -12.147 -1.418 1.00 22.59 ? 216 ASP D OD1 1 +ATOM 7076 O OD2 . ASP D 1 214 ? 30.187 -11.978 -0.404 1.00 22.63 ? 216 ASP D OD2 1 +ATOM 7077 N N . HIS D 1 215 ? 27.935 -10.432 -4.439 1.00 23.36 ? 217 HIS D N 1 +ATOM 7078 C CA . HIS D 1 215 ? 27.543 -9.161 -4.972 1.00 21.84 ? 217 HIS D CA 1 +ATOM 7079 C C . HIS D 1 215 ? 26.363 -8.589 -4.248 1.00 19.56 ? 217 HIS D C 1 +ATOM 7080 O O . HIS D 1 215 ? 25.856 -9.157 -3.282 1.00 15.99 ? 217 HIS D O 1 +ATOM 7081 C CB . HIS D 1 215 ? 27.237 -9.327 -6.430 1.00 28.97 ? 217 HIS D CB 1 +ATOM 7082 C CG . HIS D 1 215 ? 26.042 -10.201 -6.661 1.00 36.82 ? 217 HIS D CG 1 +ATOM 7083 N ND1 . HIS D 1 215 ? 25.930 -11.492 -6.334 1.00 36.36 ? 217 HIS D ND1 1 +ATOM 7084 C CD2 . HIS D 1 215 ? 24.896 -9.760 -7.258 1.00 33.94 ? 217 HIS D CD2 1 +ATOM 7085 C CE1 . HIS D 1 215 ? 24.735 -11.834 -6.728 1.00 32.65 ? 217 HIS D CE1 1 +ATOM 7086 N NE2 . HIS D 1 215 ? 24.129 -10.808 -7.273 1.00 36.39 ? 217 HIS D NE2 1 +ATOM 7087 N N . MET D 1 216 ? 26.035 -7.382 -4.695 1.00 18.56 ? 218 MET D N 1 +ATOM 7088 C CA . MET D 1 216 ? 24.877 -6.629 -4.216 1.00 16.69 ? 218 MET D CA 1 +ATOM 7089 C C . MET D 1 216 ? 24.454 -5.674 -5.301 1.00 18.90 ? 218 MET D C 1 +ATOM 7090 O O . MET D 1 216 ? 25.266 -4.997 -5.911 1.00 18.16 ? 218 MET D O 1 +ATOM 7091 C CB . MET D 1 216 ? 25.189 -5.830 -2.983 1.00 10.80 ? 218 MET D CB 1 +ATOM 7092 C CG . MET D 1 216 ? 24.164 -4.806 -2.653 1.00 9.67 ? 218 MET D CG 1 +ATOM 7093 S SD . MET D 1 216 ? 24.386 -4.250 -0.986 1.00 21.70 ? 218 MET D SD 1 +ATOM 7094 C CE . MET D 1 216 ? 25.578 -2.990 -1.318 1.00 22.47 ? 218 MET D CE 1 +ATOM 7095 N N . VAL D 1 217 ? 23.167 -5.799 -5.621 1.00 19.14 ? 219 VAL D N 1 +ATOM 7096 C CA . VAL D 1 217 ? 22.542 -4.835 -6.499 1.00 19.98 ? 219 VAL D CA 1 +ATOM 7097 C C . VAL D 1 217 ? 21.784 -3.923 -5.539 1.00 17.65 ? 219 VAL D C 1 +ATOM 7098 O O . VAL D 1 217 ? 21.144 -4.362 -4.578 1.00 11.26 ? 219 VAL D O 1 +ATOM 7099 C CB . VAL D 1 217 ? 21.609 -5.512 -7.470 1.00 16.07 ? 219 VAL D CB 1 +ATOM 7100 C CG1 . VAL D 1 217 ? 21.111 -4.508 -8.456 1.00 19.28 ? 219 VAL D CG1 1 +ATOM 7101 C CG2 . VAL D 1 217 ? 22.380 -6.524 -8.348 1.00 20.99 ? 219 VAL D CG2 1 +ATOM 7102 N N . LEU D 1 218 ? 22.104 -2.623 -5.680 1.00 17.32 ? 220 LEU D N 1 +ATOM 7103 C CA . LEU D 1 218 ? 21.456 -1.593 -4.884 1.00 15.90 ? 220 LEU D CA 1 +ATOM 7104 C C . LEU D 1 218 ? 20.619 -0.684 -5.764 1.00 12.51 ? 220 LEU D C 1 +ATOM 7105 O O . LEU D 1 218 ? 21.021 -0.231 -6.846 1.00 12.97 ? 220 LEU D O 1 +ATOM 7106 C CB . LEU D 1 218 ? 22.475 -0.782 -4.193 1.00 17.55 ? 220 LEU D CB 1 +ATOM 7107 C CG . LEU D 1 218 ? 21.939 0.349 -3.323 1.00 24.54 ? 220 LEU D CG 1 +ATOM 7108 C CD1 . LEU D 1 218 ? 21.091 -0.226 -2.207 1.00 13.13 ? 220 LEU D CD1 1 +ATOM 7109 C CD2 . LEU D 1 218 ? 23.107 1.165 -2.747 1.00 17.82 ? 220 LEU D CD2 1 +ATOM 7110 N N . LEU D 1 219 ? 19.373 -0.591 -5.329 1.00 15.93 ? 221 LEU D N 1 +ATOM 7111 C CA . LEU D 1 219 ? 18.450 0.388 -5.904 1.00 18.51 ? 221 LEU D CA 1 +ATOM 7112 C C . LEU D 1 219 ? 18.236 1.350 -4.773 1.00 14.50 ? 221 LEU D C 1 +ATOM 7113 O O . LEU D 1 219 ? 17.912 0.977 -3.648 1.00 12.89 ? 221 LEU D O 1 +ATOM 7114 C CB . LEU D 1 219 ? 17.118 -0.201 -6.305 1.00 26.37 ? 221 LEU D CB 1 +ATOM 7115 C CG . LEU D 1 219 ? 16.944 -0.609 -7.791 1.00 34.63 ? 221 LEU D CG 1 +ATOM 7116 C CD1 . LEU D 1 219 ? 16.828 0.679 -8.603 1.00 34.64 ? 221 LEU D CD1 1 +ATOM 7117 C CD2 . LEU D 1 219 ? 18.095 -1.536 -8.269 1.00 31.31 ? 221 LEU D CD2 1 +ATOM 7118 N N . GLU D 1 220 ? 18.623 2.596 -5.034 1.00 21.80 ? 222 GLU D N 1 +ATOM 7119 C CA . GLU D 1 220 ? 18.418 3.638 -4.023 1.00 21.94 ? 222 GLU D CA 1 +ATOM 7120 C C . GLU D 1 220 ? 17.600 4.797 -4.580 1.00 17.28 ? 222 GLU D C 1 +ATOM 7121 O O . GLU D 1 220 ? 17.534 5.090 -5.787 1.00 21.99 ? 222 GLU D O 1 +ATOM 7122 C CB . GLU D 1 220 ? 19.808 4.036 -3.551 1.00 22.65 ? 222 GLU D CB 1 +ATOM 7123 C CG . GLU D 1 220 ? 19.722 4.407 -2.133 1.00 27.54 ? 222 GLU D CG 1 +ATOM 7124 C CD . GLU D 1 220 ? 21.039 4.533 -1.404 1.00 34.07 ? 222 GLU D CD 1 +ATOM 7125 O OE1 . GLU D 1 220 ? 21.729 5.534 -1.611 1.00 40.59 ? 222 GLU D OE1 1 +ATOM 7126 O OE2 . GLU D 1 220 ? 21.329 3.657 -0.589 1.00 24.37 ? 222 GLU D OE2 1 +ATOM 7127 N N . PHE D 1 221 ? 16.868 5.435 -3.688 1.00 12.17 ? 223 PHE D N 1 +ATOM 7128 C CA . PHE D 1 221 ? 16.028 6.565 -4.074 1.00 6.17 ? 223 PHE D CA 1 +ATOM 7129 C C . PHE D 1 221 ? 16.336 7.505 -2.967 1.00 3.43 ? 223 PHE D C 1 +ATOM 7130 O O . PHE D 1 221 ? 16.150 7.127 -1.820 1.00 6.42 ? 223 PHE D O 1 +ATOM 7131 C CB . PHE D 1 221 ? 14.471 6.210 -4.087 1.00 2.02 ? 223 PHE D CB 1 +ATOM 7132 C CG . PHE D 1 221 ? 14.098 5.449 -5.349 1.00 2.00 ? 223 PHE D CG 1 +ATOM 7133 C CD1 . PHE D 1 221 ? 14.016 6.082 -6.578 1.00 2.21 ? 223 PHE D CD1 1 +ATOM 7134 C CD2 . PHE D 1 221 ? 13.971 4.072 -5.307 1.00 11.44 ? 223 PHE D CD2 1 +ATOM 7135 C CE1 . PHE D 1 221 ? 13.826 5.376 -7.783 1.00 2.42 ? 223 PHE D CE1 1 +ATOM 7136 C CE2 . PHE D 1 221 ? 13.768 3.350 -6.495 1.00 2.00 ? 223 PHE D CE2 1 +ATOM 7137 C CZ . PHE D 1 221 ? 13.699 3.980 -7.740 1.00 2.21 ? 223 PHE D CZ 1 +ATOM 7138 N N . VAL D 1 222 ? 16.859 8.696 -3.335 1.00 7.00 ? 224 VAL D N 1 +ATOM 7139 C CA . VAL D 1 222 ? 17.286 9.733 -2.362 1.00 11.17 ? 224 VAL D CA 1 +ATOM 7140 C C . VAL D 1 222 ? 16.617 11.045 -2.732 1.00 12.84 ? 224 VAL D C 1 +ATOM 7141 O O . VAL D 1 222 ? 16.586 11.521 -3.878 1.00 8.61 ? 224 VAL D O 1 +ATOM 7142 C CB . VAL D 1 222 ? 18.779 10.119 -2.350 1.00 9.51 ? 224 VAL D CB 1 +ATOM 7143 C CG1 . VAL D 1 222 ? 19.062 10.508 -0.913 1.00 16.72 ? 224 VAL D CG1 1 +ATOM 7144 C CG2 . VAL D 1 222 ? 19.739 9.010 -2.823 1.00 16.61 ? 224 VAL D CG2 1 +ATOM 7145 N N . THR D 1 223 ? 16.070 11.622 -1.674 1.00 12.87 ? 225 THR D N 1 +ATOM 7146 C CA . THR D 1 223 ? 15.344 12.841 -1.898 1.00 17.29 ? 225 THR D CA 1 +ATOM 7147 C C . THR D 1 223 ? 15.612 13.776 -0.767 1.00 17.38 ? 225 THR D C 1 +ATOM 7148 O O . THR D 1 223 ? 15.480 13.448 0.416 1.00 16.00 ? 225 THR D O 1 +ATOM 7149 C CB . THR D 1 223 ? 13.848 12.511 -2.058 1.00 16.32 ? 225 THR D CB 1 +ATOM 7150 O OG1 . THR D 1 223 ? 13.746 12.012 -3.399 1.00 16.18 ? 225 THR D OG1 1 +ATOM 7151 C CG2 . THR D 1 223 ? 12.904 13.697 -1.935 1.00 21.06 ? 225 THR D CG2 1 +ATOM 7152 N N . ALA D 1 224 ? 16.046 14.970 -1.213 1.00 11.62 ? 226 ALA D N 1 +ATOM 7153 C CA . ALA D 1 224 ? 16.267 15.991 -0.210 1.00 16.20 ? 226 ALA D CA 1 +ATOM 7154 C C . ALA D 1 224 ? 14.910 16.513 0.221 1.00 8.82 ? 226 ALA D C 1 +ATOM 7155 O O . ALA D 1 224 ? 13.976 16.594 -0.560 1.00 6.98 ? 226 ALA D O 1 +ATOM 7156 C CB . ALA D 1 224 ? 17.114 17.106 -0.798 1.00 14.04 ? 226 ALA D CB 1 +ATOM 7157 N N . ALA D 1 225 ? 14.843 16.759 1.516 1.00 8.35 ? 227 ALA D N 1 +ATOM 7158 C CA . ALA D 1 225 ? 13.712 17.339 2.176 1.00 12.66 ? 227 ALA D CA 1 +ATOM 7159 C C . ALA D 1 225 ? 14.058 18.022 3.521 1.00 16.56 ? 227 ALA D C 1 +ATOM 7160 O O . ALA D 1 225 ? 15.192 18.058 3.999 1.00 9.22 ? 227 ALA D O 1 +ATOM 7161 C CB . ALA D 1 225 ? 12.687 16.250 2.429 1.00 19.35 ? 227 ALA D CB 1 +ATOM 7162 N N . GLY D 1 226 ? 13.041 18.624 4.147 1.00 14.17 ? 228 GLY D N 1 +ATOM 7163 C CA . GLY D 1 226 ? 13.236 19.271 5.418 1.00 13.34 ? 228 GLY D CA 1 +ATOM 7164 C C . GLY D 1 226 ? 13.266 20.769 5.282 1.00 12.42 ? 228 GLY D C 1 +ATOM 7165 O O . GLY D 1 226 ? 13.436 21.439 6.283 1.00 15.86 ? 228 GLY D O 1 +ATOM 7166 N N . ILE D 1 227 ? 13.184 21.334 4.095 1.00 10.67 ? 229 ILE D N 1 +ATOM 7167 C CA . ILE D 1 227 ? 13.106 22.789 4.006 1.00 20.90 ? 229 ILE D CA 1 +ATOM 7168 C C . ILE D 1 227 ? 11.877 23.056 3.133 1.00 24.35 ? 229 ILE D C 1 +ATOM 7169 O O . ILE D 1 227 ? 11.801 22.664 1.956 1.00 18.00 ? 229 ILE D O 1 +ATOM 7170 C CB . ILE D 1 227 ? 14.418 23.379 3.356 1.00 14.74 ? 229 ILE D CB 1 +ATOM 7171 C CG1 . ILE D 1 227 ? 15.642 23.064 4.238 1.00 16.08 ? 229 ILE D CG1 1 +ATOM 7172 C CG2 . ILE D 1 227 ? 14.269 24.897 3.186 1.00 13.65 ? 229 ILE D CG2 1 +ATOM 7173 C CD1 . ILE D 1 227 ? 16.984 23.221 3.456 1.00 6.34 ? 229 ILE D CD1 1 +ATOM 7174 N N . THR D 1 228 ? 10.897 23.736 3.749 1.00 31.91 ? 230 THR D N 1 +ATOM 7175 C CA . THR D 1 228 ? 9.614 24.107 3.106 1.00 33.00 ? 230 THR D CA 1 +ATOM 7176 C C . THR D 1 228 ? 9.560 25.224 2.054 1.00 31.62 ? 230 THR D C 1 +ATOM 7177 O O . THR D 1 228 ? 8.898 25.060 1.026 1.00 29.10 ? 230 THR D O 1 +ATOM 7178 C CB . THR D 1 228 ? 8.615 24.406 4.237 1.00 31.92 ? 230 THR D CB 1 +ATOM 7179 O OG1 . THR D 1 228 ? 9.212 25.278 5.184 1.00 29.85 ? 230 THR D OG1 1 +ATOM 7180 C CG2 . THR D 1 228 ? 8.186 23.089 4.897 1.00 34.74 ? 230 THR D CG2 1 +HETATM 7181 O O . HOH E 2 . ? 14.534 40.743 23.463 1.00 20.65 ? 239 HOH A O 1 +HETATM 7182 O O . HOH E 2 . ? 15.194 42.285 21.205 1.00 38.40 ? 240 HOH A O 1 +HETATM 7183 O O . HOH E 2 . ? -8.605 53.197 24.400 1.00 18.81 ? 241 HOH A O 1 +HETATM 7184 O O . HOH E 2 . ? 40.738 47.352 20.067 1.00 35.52 ? 242 HOH A O 1 +HETATM 7185 O O . HOH E 2 . ? 28.441 63.308 37.664 1.00 36.46 ? 243 HOH A O 1 +HETATM 7186 O O . HOH E 2 . ? 8.606 28.900 28.601 1.00 39.41 ? 244 HOH A O 1 +HETATM 7187 O O . HOH E 2 . ? 5.177 37.143 12.896 1.00 43.79 ? 245 HOH A O 1 +HETATM 7188 O O . HOH E 2 . ? 18.395 45.533 33.134 1.00 29.32 ? 246 HOH A O 1 +HETATM 7189 O O . HOH E 2 . ? 14.556 39.714 5.624 1.00 11.34 ? 247 HOH A O 1 +HETATM 7190 O O . HOH E 2 . ? 14.485 49.654 24.120 1.00 33.96 ? 248 HOH A O 1 +HETATM 7191 O O . HOH E 2 . ? 19.677 37.556 46.163 1.00 36.51 ? 249 HOH A O 1 +HETATM 7192 O O . HOH E 2 . ? 36.035 56.367 29.516 1.00 44.51 ? 250 HOH A O 1 +HETATM 7193 O O . HOH E 2 . ? 6.437 52.505 5.805 1.00 52.24 ? 251 HOH A O 1 +HETATM 7194 O O . HOH E 2 . ? 19.852 33.208 29.068 1.00 44.09 ? 252 HOH A O 1 +HETATM 7195 O O . HOH E 2 . ? 21.363 36.612 14.254 1.00 15.32 ? 253 HOH A O 1 +HETATM 7196 O O . HOH E 2 . ? 25.938 34.862 8.606 1.00 19.19 ? 254 HOH A O 1 +HETATM 7197 O O . HOH E 2 . ? 31.629 56.292 28.472 1.00 24.92 ? 255 HOH A O 1 +HETATM 7198 O O . HOH E 2 . ? 14.735 49.953 27.623 1.00 13.18 ? 256 HOH A O 1 +HETATM 7199 O O . HOH E 2 . ? 46.529 45.893 24.283 1.00 30.61 ? 257 HOH A O 1 +HETATM 7200 O O . HOH E 2 . ? 14.427 31.369 21.237 1.00 39.88 ? 258 HOH A O 1 +HETATM 7201 O O . HOH E 2 . ? 22.583 42.536 46.086 1.00 29.27 ? 259 HOH A O 1 +HETATM 7202 O O . HOH E 2 . ? 22.738 29.782 16.525 1.00 41.63 ? 260 HOH A O 1 +HETATM 7203 O O . HOH E 2 . ? 18.226 47.982 29.540 1.00 24.92 ? 261 HOH A O 1 +HETATM 7204 O O . HOH E 2 . ? 11.961 46.191 20.755 1.00 41.23 ? 262 HOH A O 1 +HETATM 7205 O O . HOH E 2 . ? 18.228 33.312 36.638 1.00 23.33 ? 263 HOH A O 1 +HETATM 7206 O O . HOH E 2 . ? 25.639 39.261 7.558 1.00 46.16 ? 264 HOH A O 1 +HETATM 7207 O O . HOH E 2 . ? 23.393 55.937 11.150 1.00 36.17 ? 265 HOH A O 1 +HETATM 7208 O O . HOH E 2 . ? 11.756 28.356 19.445 1.00 35.38 ? 266 HOH A O 1 +HETATM 7209 O O . HOH E 2 . ? 30.602 65.070 30.866 1.00 66.55 ? 267 HOH A O 1 +HETATM 7210 O O . HOH E 2 . ? 11.225 36.522 34.257 1.00 34.21 ? 268 HOH A O 1 +HETATM 7211 O O . HOH E 2 . ? 32.061 42.792 38.623 1.00 61.29 ? 269 HOH A O 1 +HETATM 7212 O O . HOH E 2 . ? 33.760 36.429 27.178 1.00 74.73 ? 270 HOH A O 1 +HETATM 7213 O O . HOH E 2 . ? 5.026 51.167 31.411 1.00 56.34 ? 271 HOH A O 1 +HETATM 7214 O O . HOH E 2 . ? 30.969 36.014 30.217 1.00 49.50 ? 272 HOH A O 1 +HETATM 7215 O O . HOH E 2 . ? 32.389 43.427 36.624 1.00 54.96 ? 273 HOH A O 1 +HETATM 7216 O O . HOH E 2 . ? 34.272 43.869 40.087 1.00 57.51 ? 274 HOH A O 1 +HETATM 7217 O O . HOH E 2 . ? 35.685 42.235 41.750 1.00 68.76 ? 275 HOH A O 1 +HETATM 7218 O O . HOH E 2 . ? 15.687 30.051 6.708 1.00 50.73 ? 276 HOH A O 1 +HETATM 7219 O O . HOH E 2 . ? 3.509 35.316 35.168 1.00 55.19 ? 277 HOH A O 1 +HETATM 7220 O O . HOH F 2 . ? 29.882 24.159 29.352 1.00 53.78 ? 239 HOH B O 1 +HETATM 7221 O O . HOH F 2 . ? 49.467 25.692 29.958 1.00 61.80 ? 240 HOH B O 1 +HETATM 7222 O O . HOH F 2 . ? 47.216 14.383 47.185 1.00 28.74 ? 241 HOH B O 1 +HETATM 7223 O O . HOH F 2 . ? 36.759 22.448 12.009 1.00 26.52 ? 242 HOH B O 1 +HETATM 7224 O O . HOH F 2 . ? 33.522 9.821 23.964 1.00 42.85 ? 243 HOH B O 1 +HETATM 7225 O O . HOH F 2 . ? 42.761 35.462 41.912 1.00 42.81 ? 244 HOH B O 1 +HETATM 7226 O O . HOH F 2 . ? 30.427 27.628 17.910 1.00 21.28 ? 245 HOH B O 1 +HETATM 7227 O O . HOH F 2 . ? 42.904 36.607 26.407 1.00 16.86 ? 246 HOH B O 1 +HETATM 7228 O O . HOH F 2 . ? 42.356 16.102 46.088 1.00 25.51 ? 247 HOH B O 1 +HETATM 7229 O O . HOH F 2 . ? 32.274 34.197 42.022 1.00 31.69 ? 248 HOH B O 1 +HETATM 7230 O O . HOH F 2 . ? 39.470 7.549 33.605 1.00 37.80 ? 249 HOH B O 1 +HETATM 7231 O O . HOH F 2 . ? 7.185 4.757 34.926 1.00 41.34 ? 250 HOH B O 1 +HETATM 7232 O O . HOH F 2 . ? 20.675 4.853 40.274 1.00 58.67 ? 251 HOH B O 1 +HETATM 7233 O O . HOH F 2 . ? 26.253 15.509 33.876 1.00 26.78 ? 252 HOH B O 1 +HETATM 7234 O O . HOH F 2 . ? 30.458 34.669 20.095 1.00 40.69 ? 253 HOH B O 1 +HETATM 7235 O O . HOH F 2 . ? 19.765 13.001 45.862 1.00 24.04 ? 254 HOH B O 1 +HETATM 7236 O O . HOH F 2 . ? 39.432 30.033 16.251 1.00 10.83 ? 255 HOH B O 1 +HETATM 7237 O O . HOH F 2 . ? 15.552 24.349 51.653 1.00 44.96 ? 256 HOH B O 1 +HETATM 7238 O O . HOH F 2 . ? 9.857 15.786 25.560 1.00 17.93 ? 257 HOH B O 1 +HETATM 7239 O O . HOH F 2 . ? 17.540 14.403 44.523 1.00 50.73 ? 258 HOH B O 1 +HETATM 7240 O O . HOH F 2 . ? 15.579 27.568 33.368 1.00 33.55 ? 259 HOH B O 1 +HETATM 7241 O O . HOH F 2 . ? 12.553 17.687 10.682 1.00 26.05 ? 260 HOH B O 1 +HETATM 7242 O O . HOH F 2 . ? 21.226 16.597 15.492 1.00 22.97 ? 261 HOH B O 1 +HETATM 7243 O O . HOH F 2 . ? 17.989 4.531 25.944 1.00 36.42 ? 262 HOH B O 1 +HETATM 7244 O O . HOH F 2 . ? 42.812 27.288 27.224 1.00 28.58 ? 263 HOH B O 1 +HETATM 7245 O O . HOH F 2 . ? 28.390 34.591 17.537 1.00 25.30 ? 264 HOH B O 1 +HETATM 7246 O O . HOH F 2 . ? 11.399 19.812 20.673 1.00 27.00 ? 265 HOH B O 1 +HETATM 7247 O O . HOH F 2 . ? 9.483 19.108 41.136 1.00 23.10 ? 266 HOH B O 1 +HETATM 7248 O O . HOH F 2 . ? 43.098 15.176 18.023 1.00 23.70 ? 267 HOH B O 1 +HETATM 7249 O O . HOH F 2 . ? 40.652 23.496 16.095 1.00 21.99 ? 268 HOH B O 1 +HETATM 7250 O O . HOH F 2 . ? 34.057 4.979 36.760 1.00 35.30 ? 269 HOH B O 1 +HETATM 7251 O O . HOH F 2 . ? 12.485 7.556 39.985 1.00 68.00 ? 270 HOH B O 1 +HETATM 7252 O O . HOH F 2 . ? 20.132 13.209 13.129 1.00 24.57 ? 271 HOH B O 1 +HETATM 7253 O O . HOH F 2 . ? 31.399 33.849 27.885 1.00 22.87 ? 272 HOH B O 1 +HETATM 7254 O O . HOH F 2 . ? 34.783 37.687 14.629 1.00 47.27 ? 273 HOH B O 1 +HETATM 7255 O O . HOH F 2 . ? 27.431 27.543 14.762 1.00 59.01 ? 274 HOH B O 1 +HETATM 7256 O O . HOH F 2 . ? 38.802 19.774 14.280 1.00 23.21 ? 275 HOH B O 1 +HETATM 7257 O O . HOH F 2 . ? 6.259 16.570 14.960 1.00 35.92 ? 276 HOH B O 1 +HETATM 7258 O O . HOH F 2 . ? 25.860 32.847 17.712 1.00 60.60 ? 277 HOH B O 1 +HETATM 7259 O O . HOH F 2 . ? 35.963 34.427 42.391 1.00 64.57 ? 278 HOH B O 1 +HETATM 7260 O O . HOH F 2 . ? 17.047 24.863 10.320 1.00 35.35 ? 279 HOH B O 1 +HETATM 7261 O O . HOH G 2 . ? 9.086 -3.663 2.596 1.00 17.58 ? 239 HOH C O 1 +HETATM 7262 O O . HOH G 2 . ? 5.918 -9.415 0.478 1.00 12.07 ? 240 HOH C O 1 +HETATM 7263 O O . HOH G 2 . ? 5.280 -8.132 -1.654 1.00 39.96 ? 241 HOH C O 1 +HETATM 7264 O O . HOH G 2 . ? 3.749 -7.889 -3.820 1.00 30.48 ? 242 HOH C O 1 +HETATM 7265 O O . HOH G 2 . ? 7.659 0.928 5.802 1.00 2.00 ? 243 HOH C O 1 +HETATM 7266 O O . HOH G 2 . ? -1.145 20.035 0.552 1.00 22.13 ? 244 HOH C O 1 +HETATM 7267 O O . HOH G 2 . ? 6.007 -18.257 10.091 1.00 17.03 ? 245 HOH C O 1 +HETATM 7268 O O . HOH G 2 . ? -3.821 -5.137 2.000 1.00 2.00 ? 246 HOH C O 1 +HETATM 7269 O O . HOH G 2 . ? -3.476 15.664 0.292 1.00 48.50 ? 247 HOH C O 1 +HETATM 7270 O O . HOH G 2 . ? -8.232 -29.365 -5.853 1.00 18.85 ? 248 HOH C O 1 +HETATM 7271 O O . HOH G 2 . ? -14.801 13.340 0.516 1.00 34.97 ? 249 HOH C O 1 +HETATM 7272 O O . HOH G 2 . ? -5.947 13.865 1.035 1.00 41.96 ? 250 HOH C O 1 +HETATM 7273 O O . HOH G 2 . ? 12.967 -1.717 2.168 1.00 35.63 ? 251 HOH C O 1 +HETATM 7274 O O . HOH G 2 . ? 7.714 -20.448 -7.457 1.00 15.97 ? 252 HOH C O 1 +HETATM 7275 O O . HOH G 2 . ? -7.093 -18.022 4.216 1.00 47.26 ? 253 HOH C O 1 +HETATM 7276 O O . HOH G 2 . ? -6.485 -9.309 -24.259 1.00 35.05 ? 254 HOH C O 1 +HETATM 7277 O O . HOH G 2 . ? 12.322 -4.662 12.672 1.00 22.84 ? 255 HOH C O 1 +HETATM 7278 O O . HOH G 2 . ? 2.240 -2.943 16.665 1.00 33.37 ? 256 HOH C O 1 +HETATM 7279 O O . HOH G 2 . ? 3.135 11.168 -1.536 1.00 12.56 ? 257 HOH C O 1 +HETATM 7280 O O . HOH G 2 . ? 9.994 11.943 4.787 1.00 27.95 ? 258 HOH C O 1 +HETATM 7281 O O . HOH G 2 . ? -1.891 -2.343 16.017 1.00 18.85 ? 259 HOH C O 1 +HETATM 7282 O O . HOH G 2 . ? 6.187 -26.554 -8.022 1.00 58.54 ? 260 HOH C O 1 +HETATM 7283 O O . HOH G 2 . ? 13.863 1.597 1.522 1.00 24.83 ? 261 HOH C O 1 +HETATM 7284 O O . HOH G 2 . ? 0.904 18.622 -9.895 1.00 19.72 ? 262 HOH C O 1 +HETATM 7285 O O . HOH G 2 . ? -13.580 -4.754 2.712 1.00 20.98 ? 263 HOH C O 1 +HETATM 7286 O O . HOH G 2 . ? -11.540 11.516 -0.428 1.00 29.36 ? 264 HOH C O 1 +HETATM 7287 O O . HOH G 2 . ? -14.125 -0.492 -0.832 1.00 32.55 ? 265 HOH C O 1 +HETATM 7288 O O . HOH G 2 . ? 10.919 -4.093 -18.706 1.00 40.89 ? 266 HOH C O 1 +HETATM 7289 O O . HOH G 2 . ? -14.918 5.388 10.401 1.00 19.94 ? 267 HOH C O 1 +HETATM 7290 O O . HOH G 2 . ? -11.326 -22.725 -11.780 1.00 64.08 ? 268 HOH C O 1 +HETATM 7291 O O . HOH G 2 . ? 14.176 -27.543 1.911 1.00 33.61 ? 269 HOH C O 1 +HETATM 7292 O O . HOH G 2 . ? -8.522 -9.424 -10.275 1.00 13.03 ? 270 HOH C O 1 +HETATM 7293 O O . HOH G 2 . ? 2.277 -12.192 -19.539 1.00 19.12 ? 271 HOH C O 1 +HETATM 7294 O O . HOH G 2 . ? 1.706 14.246 -15.310 1.00 17.00 ? 272 HOH C O 1 +HETATM 7295 O O . HOH G 2 . ? -15.507 10.420 -0.552 1.00 21.85 ? 273 HOH C O 1 +HETATM 7296 O O . HOH G 2 . ? -6.414 -22.508 -14.719 1.00 34.90 ? 274 HOH C O 1 +HETATM 7297 O O . HOH G 2 . ? 13.007 -24.341 -11.052 1.00 39.59 ? 275 HOH C O 1 +HETATM 7298 O O . HOH G 2 . ? -7.625 -14.765 -18.388 1.00 40.53 ? 276 HOH C O 1 +HETATM 7299 O O . HOH G 2 . ? -0.711 12.071 15.666 1.00 46.85 ? 277 HOH C O 1 +HETATM 7300 O O . HOH G 2 . ? 2.151 10.192 0.971 1.00 29.97 ? 278 HOH C O 1 +HETATM 7301 O O . HOH G 2 . ? -12.744 -14.542 -9.963 1.00 15.41 ? 279 HOH C O 1 +HETATM 7302 O O . HOH G 2 . ? -5.270 11.335 -10.915 1.00 22.34 ? 280 HOH C O 1 +HETATM 7303 O O . HOH G 2 . ? 10.467 7.063 -10.107 1.00 19.80 ? 281 HOH C O 1 +HETATM 7304 O O . HOH G 2 . ? -12.321 -7.142 -4.719 1.00 34.27 ? 282 HOH C O 1 +HETATM 7305 O O . HOH G 2 . ? -13.012 -2.940 11.484 1.00 14.07 ? 283 HOH C O 1 +HETATM 7306 O O . HOH G 2 . ? -12.061 -19.349 2.108 1.00 48.04 ? 284 HOH C O 1 +HETATM 7307 O O . HOH G 2 . ? 17.495 -20.094 -7.275 1.00 11.09 ? 285 HOH C O 1 +HETATM 7308 O O . HOH G 2 . ? -3.710 10.113 18.361 1.00 29.51 ? 286 HOH C O 1 +HETATM 7309 O O . HOH G 2 . ? -15.129 -10.791 -11.860 1.00 40.40 ? 287 HOH C O 1 +HETATM 7310 O O . HOH G 2 . ? 9.642 -7.885 9.339 1.00 12.40 ? 288 HOH C O 1 +HETATM 7311 O O . HOH G 2 . ? -17.115 10.543 7.092 1.00 40.89 ? 289 HOH C O 1 +HETATM 7312 O O . HOH G 2 . ? -0.674 17.316 -0.873 1.00 36.81 ? 290 HOH C O 1 +HETATM 7313 O O . HOH G 2 . ? -13.915 5.347 -5.485 1.00 24.04 ? 291 HOH C O 1 +HETATM 7314 O O . HOH G 2 . ? 1.603 17.313 14.444 1.00 27.60 ? 292 HOH C O 1 +HETATM 7315 O O . HOH G 2 . ? 1.538 -0.763 3.873 1.00 7.57 ? 293 HOH C O 1 +HETATM 7316 O O . HOH G 2 . ? -4.705 -25.126 9.084 1.00 34.87 ? 294 HOH C O 1 +HETATM 7317 O O . HOH G 2 . ? -4.864 -27.586 -2.719 1.00 48.27 ? 295 HOH C O 1 +HETATM 7318 O O . HOH G 2 . ? 11.225 11.936 -8.552 1.00 22.35 ? 296 HOH C O 1 +HETATM 7319 O O . HOH G 2 . ? -9.110 3.948 16.355 1.00 33.31 ? 297 HOH C O 1 +HETATM 7320 O O . HOH G 2 . ? -10.206 -18.576 7.794 1.00 36.13 ? 298 HOH C O 1 +HETATM 7321 O O . HOH G 2 . ? 4.879 21.337 -16.850 1.00 16.57 ? 299 HOH C O 1 +HETATM 7322 O O . HOH G 2 . ? 1.930 11.237 5.290 1.00 4.51 ? 300 HOH C O 1 +HETATM 7323 O O . HOH G 2 . ? -3.183 2.260 -15.762 1.00 48.73 ? 301 HOH C O 1 +HETATM 7324 O O . HOH G 2 . ? 11.862 2.019 11.522 1.00 14.64 ? 302 HOH C O 1 +HETATM 7325 O O . HOH G 2 . ? 0.773 4.914 -13.837 1.00 19.73 ? 303 HOH C O 1 +HETATM 7326 O O . HOH G 2 . ? -6.539 9.904 -13.753 1.00 45.78 ? 304 HOH C O 1 +HETATM 7327 O O . HOH G 2 . ? -16.395 -21.063 5.142 1.00 38.40 ? 305 HOH C O 1 +HETATM 7328 O O . HOH G 2 . ? -1.445 12.222 -0.483 1.00 36.59 ? 306 HOH C O 1 +HETATM 7329 O O . HOH G 2 . ? 6.644 -22.966 -6.953 1.00 15.39 ? 307 HOH C O 1 +HETATM 7330 O O . HOH G 2 . ? 12.933 -0.091 10.235 1.00 9.00 ? 308 HOH C O 1 +HETATM 7331 O O . HOH G 2 . ? -11.235 -2.562 -7.156 1.00 27.27 ? 309 HOH C O 1 +HETATM 7332 O O . HOH G 2 . ? -11.180 -21.231 -2.141 1.00 21.20 ? 310 HOH C O 1 +HETATM 7333 O O . HOH G 2 . ? 9.484 -18.589 -8.766 1.00 41.13 ? 311 HOH C O 1 +HETATM 7334 O O . HOH G 2 . ? 14.258 -8.891 0.098 1.00 28.88 ? 312 HOH C O 1 +HETATM 7335 O O . HOH G 2 . ? 3.445 2.498 16.413 1.00 51.26 ? 313 HOH C O 1 +HETATM 7336 O O . HOH G 2 . ? 12.782 7.719 7.979 1.00 16.32 ? 314 HOH C O 1 +HETATM 7337 O O . HOH G 2 . ? 4.242 -31.142 0.240 1.00 24.03 ? 315 HOH C O 1 +HETATM 7338 O O . HOH G 2 . ? 1.046 13.267 -1.488 1.00 29.55 ? 316 HOH C O 1 +HETATM 7339 O O . HOH G 2 . ? -1.781 -1.265 2.799 1.00 12.79 ? 317 HOH C O 1 +HETATM 7340 O O . HOH G 2 . ? 17.527 -4.341 -10.887 1.00 42.48 ? 318 HOH C O 1 +HETATM 7341 O O . HOH G 2 . ? 3.697 -24.832 -11.913 1.00 25.51 ? 319 HOH C O 1 +HETATM 7342 O O . HOH G 2 . ? -0.246 15.757 -5.935 1.00 36.92 ? 320 HOH C O 1 +HETATM 7343 O O . HOH G 2 . ? -10.987 -8.068 4.998 1.00 25.05 ? 321 HOH C O 1 +HETATM 7344 O O . HOH G 2 . ? -4.029 -0.431 19.440 1.00 43.49 ? 322 HOH C O 1 +HETATM 7345 O O . HOH G 2 . ? 19.422 -24.981 -0.119 1.00 53.42 ? 323 HOH C O 1 +HETATM 7346 O O . HOH G 2 . ? 12.870 13.548 -16.238 1.00 65.88 ? 324 HOH C O 1 +HETATM 7347 O O . HOH G 2 . ? -6.770 2.507 17.984 1.00 50.41 ? 325 HOH C O 1 +HETATM 7348 O O . HOH G 2 . ? 5.603 1.229 -14.517 1.00 38.95 ? 326 HOH C O 1 +HETATM 7349 O O . HOH G 2 . ? 5.010 -1.721 -17.973 1.00 55.25 ? 327 HOH C O 1 +HETATM 7350 O O . HOH G 2 . ? 5.913 6.444 6.511 1.00 35.21 ? 328 HOH C O 1 +HETATM 7351 O O . HOH G 2 . ? 6.255 18.350 -15.611 1.00 30.12 ? 329 HOH C O 1 +HETATM 7352 O O . HOH G 2 . ? 6.325 3.955 5.525 1.00 12.69 ? 330 HOH C O 1 +HETATM 7353 O O . HOH G 2 . ? -5.656 -0.543 14.580 1.00 33.55 ? 331 HOH C O 1 +HETATM 7354 O O . HOH G 2 . ? -2.741 16.919 13.820 1.00 34.42 ? 332 HOH C O 1 +HETATM 7355 O O . HOH G 2 . ? -13.724 9.261 -4.656 1.00 59.09 ? 333 HOH C O 1 +HETATM 7356 O O . HOH G 2 . ? -14.149 3.519 -10.746 1.00 72.10 ? 334 HOH C O 1 +HETATM 7357 O O . HOH G 2 . ? 5.303 12.852 -0.435 1.00 31.98 ? 335 HOH C O 1 +HETATM 7358 O O . HOH G 2 . ? 8.634 10.184 -17.017 1.00 39.48 ? 336 HOH C O 1 +HETATM 7359 O O . HOH G 2 . ? 11.569 7.650 11.793 1.00 30.70 ? 337 HOH C O 1 +HETATM 7360 O O . HOH G 2 . ? 9.516 -11.075 -20.006 1.00 46.15 ? 338 HOH C O 1 +HETATM 7361 O O . HOH G 2 . ? -10.535 13.276 -10.549 1.00 57.68 ? 339 HOH C O 1 +HETATM 7362 O O . HOH G 2 . ? -14.025 1.170 -11.837 1.00 68.22 ? 340 HOH C O 1 +HETATM 7363 O O . HOH G 2 . ? 3.407 8.425 16.233 1.00 63.89 ? 341 HOH C O 1 +HETATM 7364 O O . HOH G 2 . ? -12.250 1.582 -9.804 1.00 69.52 ? 342 HOH C O 1 +HETATM 7365 O O . HOH G 2 . ? -16.240 -0.925 -10.578 1.00 52.04 ? 343 HOH C O 1 +HETATM 7366 O O . HOH G 2 . ? -13.414 -1.238 -10.116 1.00 69.59 ? 344 HOH C O 1 +HETATM 7367 O O . HOH G 2 . ? -11.628 -1.168 8.386 1.00 16.10 ? 345 HOH C O 1 +HETATM 7368 O O . HOH G 2 . ? 0.356 -0.441 6.326 1.00 7.93 ? 346 HOH C O 1 +HETATM 7369 O O . HOH G 2 . ? 3.995 10.702 17.331 1.00 63.07 ? 347 HOH C O 1 +HETATM 7370 O O . HOH G 2 . ? 4.286 8.530 19.013 1.00 56.61 ? 348 HOH C O 1 +HETATM 7371 O O . HOH H 2 . ? 18.148 3.898 2.281 1.00 16.38 ? 239 HOH D O 1 +HETATM 7372 O O . HOH H 2 . ? 21.763 9.345 1.354 1.00 20.58 ? 240 HOH D O 1 +HETATM 7373 O O . HOH H 2 . ? 22.259 7.928 -0.800 1.00 53.41 ? 241 HOH D O 1 +HETATM 7374 O O . HOH H 2 . ? 24.182 7.633 -2.628 1.00 19.78 ? 242 HOH D O 1 +HETATM 7375 O O . HOH H 2 . ? 31.495 6.885 1.303 1.00 11.63 ? 243 HOH D O 1 +HETATM 7376 O O . HOH H 2 . ? 23.150 29.906 -2.719 1.00 24.32 ? 244 HOH D O 1 +HETATM 7377 O O . HOH H 2 . ? 17.271 -4.141 7.699 1.00 21.63 ? 245 HOH D O 1 +HETATM 7378 O O . HOH H 2 . ? 25.480 0.785 7.522 1.00 4.04 ? 246 HOH D O 1 +HETATM 7379 O O . HOH H 2 . ? 19.725 17.982 9.243 1.00 21.61 ? 247 HOH D O 1 +HETATM 7380 O O . HOH H 2 . ? 17.072 26.747 -3.750 1.00 23.63 ? 248 HOH D O 1 +HETATM 7381 O O . HOH H 2 . ? 37.335 9.344 -7.011 1.00 21.47 ? 249 HOH D O 1 +HETATM 7382 O O . HOH H 2 . ? 18.501 30.513 7.368 1.00 49.31 ? 250 HOH D O 1 +HETATM 7383 O O . HOH H 2 . ? 25.153 1.087 5.005 1.00 8.77 ? 251 HOH D O 1 +HETATM 7384 O O . HOH H 2 . ? 23.972 19.277 0.878 1.00 16.16 ? 252 HOH D O 1 +HETATM 7385 O O . HOH H 2 . ? 35.173 20.499 -5.220 1.00 21.02 ? 253 HOH D O 1 +HETATM 7386 O O . HOH H 2 . ? 20.237 25.412 9.240 1.00 2.27 ? 254 HOH D O 1 +HETATM 7387 O O . HOH H 2 . ? 33.423 12.382 9.903 1.00 37.33 ? 255 HOH D O 1 +HETATM 7388 O O . HOH H 2 . ? 20.377 -3.859 6.548 1.00 13.57 ? 256 HOH D O 1 +HETATM 7389 O O . HOH H 2 . ? 18.668 8.692 11.230 1.00 21.22 ? 257 HOH D O 1 +HETATM 7390 O O . HOH H 2 . ? 13.048 -7.231 7.864 1.00 24.63 ? 258 HOH D O 1 +HETATM 7391 O O . HOH H 2 . ? 40.333 7.399 -0.517 1.00 12.64 ? 259 HOH D O 1 +HETATM 7392 O O . HOH H 2 . ? 12.370 27.616 -5.873 1.00 28.70 ? 260 HOH D O 1 +HETATM 7393 O O . HOH H 2 . ? 24.808 -16.053 9.554 1.00 21.17 ? 261 HOH D O 1 +HETATM 7394 O O . HOH H 2 . ? 22.071 -1.813 17.860 1.00 24.06 ? 262 HOH D O 1 +HETATM 7395 O O . HOH H 2 . ? 40.797 -16.000 6.928 1.00 42.65 ? 263 HOH D O 1 +HETATM 7396 O O . HOH H 2 . ? 20.348 -6.371 7.813 1.00 14.07 ? 264 HOH D O 1 +HETATM 7397 O O . HOH H 2 . ? 40.769 -0.283 19.448 1.00 38.14 ? 265 HOH D O 1 +HETATM 7398 O O . HOH H 2 . ? 19.197 -0.793 6.558 1.00 2.00 ? 266 HOH D O 1 +HETATM 7399 O O . HOH H 2 . ? 38.516 24.682 11.327 1.00 23.02 ? 267 HOH D O 1 +HETATM 7400 O O . HOH H 2 . ? 22.219 28.586 -12.030 1.00 35.97 ? 268 HOH D O 1 +HETATM 7401 O O . HOH H 2 . ? 31.392 8.455 -0.834 1.00 29.69 ? 269 HOH D O 1 +HETATM 7402 O O . HOH H 2 . ? 10.985 17.066 -1.248 1.00 27.63 ? 270 HOH D O 1 +HETATM 7403 O O . HOH H 2 . ? 33.434 18.095 6.720 1.00 24.07 ? 271 HOH D O 1 +HETATM 7404 O O . HOH H 2 . ? 10.350 18.447 3.219 1.00 25.61 ? 272 HOH D O 1 +HETATM 7405 O O . HOH H 2 . ? 26.247 -12.273 0.323 1.00 32.25 ? 273 HOH D O 1 +HETATM 7406 O O . HOH H 2 . ? 42.043 0.059 4.687 1.00 51.44 ? 274 HOH D O 1 +HETATM 7407 O O . HOH H 2 . ? 42.756 -10.855 3.778 1.00 18.59 ? 275 HOH D O 1 +HETATM 7408 O O . HOH H 2 . ? 33.564 28.440 -8.150 1.00 37.02 ? 276 HOH D O 1 +HETATM 7409 O O . HOH H 2 . ? 11.153 20.264 -7.185 1.00 11.81 ? 277 HOH D O 1 +HETATM 7410 O O . HOH H 2 . ? 30.092 -15.911 -4.313 1.00 38.94 ? 278 HOH D O 1 +HETATM 7411 O O . HOH H 2 . ? 32.858 -14.017 -4.971 1.00 20.08 ? 279 HOH D O 1 +HETATM 7412 O O . HOH H 2 . ? 24.520 21.961 -6.046 1.00 6.77 ? 280 HOH D O 1 +HETATM 7413 O O . HOH H 2 . ? 15.918 26.273 5.802 1.00 26.68 ? 281 HOH D O 1 +HETATM 7414 O O . HOH H 2 . ? 37.448 29.439 8.810 1.00 25.55 ? 282 HOH D O 1 +HETATM 7415 O O . HOH H 2 . ? 31.620 27.500 -0.125 1.00 43.60 ? 283 HOH D O 1 +HETATM 7416 O O . HOH H 2 . ? 23.523 13.759 15.996 1.00 36.12 ? 284 HOH D O 1 +HETATM 7417 O O . HOH H 2 . ? 38.454 -11.681 12.870 1.00 29.46 ? 285 HOH D O 1 +HETATM 7418 O O . HOH H 2 . ? 18.014 4.034 -17.962 1.00 36.63 ? 286 HOH D O 1 +HETATM 7419 O O . HOH H 2 . ? 47.669 -3.262 7.543 1.00 28.06 ? 287 HOH D O 1 +HETATM 7420 O O . HOH H 2 . ? 28.662 26.794 -6.128 1.00 26.57 ? 288 HOH D O 1 +HETATM 7421 O O . HOH H 2 . ? 22.979 -10.176 4.726 1.00 12.07 ? 289 HOH D O 1 +HETATM 7422 O O . HOH H 2 . ? 32.705 -2.617 -11.503 1.00 48.38 ? 290 HOH D O 1 +HETATM 7423 O O . HOH H 2 . ? 15.924 8.283 9.462 1.00 21.86 ? 291 HOH D O 1 +HETATM 7424 O O . HOH H 2 . ? 24.015 28.409 5.614 1.00 37.72 ? 292 HOH D O 1 +HETATM 7425 O O . HOH H 2 . ? 40.609 14.158 3.873 1.00 53.28 ? 293 HOH D O 1 +HETATM 7426 O O . HOH H 2 . ? 25.617 31.117 -4.598 1.00 39.74 ? 294 HOH D O 1 +HETATM 7427 O O . HOH H 2 . ? 14.716 9.852 12.116 1.00 32.03 ? 295 HOH D O 1 +HETATM 7428 O O . HOH H 2 . ? 33.083 7.692 3.436 1.00 7.94 ? 296 HOH D O 1 +HETATM 7429 O O . HOH H 2 . ? 22.985 15.796 -4.411 1.00 6.27 ? 297 HOH D O 1 +HETATM 7430 O O . HOH H 2 . ? 33.107 -0.707 -14.331 1.00 42.77 ? 298 HOH D O 1 +HETATM 7431 O O . HOH H 2 . ? 28.393 11.369 -1.294 1.00 37.53 ? 299 HOH D O 1 +HETATM 7432 O O . HOH H 2 . ? 13.760 8.651 -1.151 1.00 13.45 ? 300 HOH D O 1 +HETATM 7433 O O . HOH H 2 . ? 40.213 8.028 -3.140 1.00 26.61 ? 301 HOH D O 1 +HETATM 7434 O O . HOH H 2 . ? 31.398 14.475 13.222 1.00 24.78 ? 302 HOH D O 1 +HETATM 7435 O O . HOH H 2 . ? 26.897 -7.587 17.145 1.00 36.96 ? 303 HOH D O 1 +HETATM 7436 O O . HOH H 2 . ? 26.179 -12.605 -2.948 1.00 13.11 ? 304 HOH D O 1 +HETATM 7437 O O . HOH H 2 . ? 34.306 0.582 18.640 1.00 23.46 ? 305 HOH D O 1 +HETATM 7438 O O . HOH H 2 . ? 29.971 -12.233 2.841 1.00 18.45 ? 306 HOH D O 1 +HETATM 7439 O O . HOH H 2 . ? 40.116 5.079 6.510 1.00 24.48 ? 307 HOH D O 1 +HETATM 7440 O O . HOH H 2 . ? 27.912 14.201 -16.137 1.00 24.45 ? 308 HOH D O 1 +HETATM 7441 O O . HOH H 2 . ? 23.071 28.092 0.436 1.00 37.99 ? 309 HOH D O 1 +HETATM 7442 O O . HOH H 2 . ? 18.132 16.950 -12.091 1.00 45.95 ? 310 HOH D O 1 +HETATM 7443 O O . HOH H 2 . ? 39.401 17.721 0.484 1.00 38.59 ? 311 HOH D O 1 +HETATM 7444 O O . HOH H 2 . ? 20.616 20.286 -6.741 1.00 30.98 ? 312 HOH D O 1 +HETATM 7445 O O . HOH H 2 . ? 32.871 23.362 -7.531 1.00 45.24 ? 313 HOH D O 1 +HETATM 7446 O O . HOH H 2 . ? 20.153 17.450 12.215 1.00 52.04 ? 314 HOH D O 1 +HETATM 7447 O O . HOH H 2 . ? 17.789 -12.039 4.825 1.00 26.61 ? 315 HOH D O 1 +HETATM 7448 O O . HOH H 2 . ? 10.411 13.302 1.870 1.00 62.89 ? 316 HOH D O 1 +HETATM 7449 O O . HOH H 2 . ? 30.839 5.172 5.226 1.00 35.04 ? 317 HOH D O 1 +HETATM 7450 O O . HOH H 2 . ? 16.961 -9.446 -1.769 1.00 37.51 ? 318 HOH D O 1 +HETATM 7451 O O . HOH H 2 . ? 7.982 24.855 -2.307 1.00 41.68 ? 319 HOH D O 1 +HETATM 7452 O O . HOH H 2 . ? 19.592 4.709 -11.849 1.00 51.49 ? 320 HOH D O 1 +HETATM 7453 O O . HOH H 2 . ? 41.278 -2.332 -5.566 1.00 51.33 ? 321 HOH D O 1 +HETATM 7454 O O . HOH H 2 . ? 37.543 14.488 -14.758 1.00 57.67 ? 322 HOH D O 1 +HETATM 7455 O O . HOH H 2 . ? 37.732 20.477 -13.328 1.00 30.75 ? 323 HOH D O 1 +HETATM 7456 O O . HOH H 2 . ? 25.335 7.293 -19.135 1.00 36.98 ? 324 HOH D O 1 +HETATM 7457 O O . HOH H 2 . ? 42.052 -3.916 1.471 1.00 26.54 ? 325 HOH D O 1 +HETATM 7458 O O . HOH H 2 . ? 35.755 15.039 5.044 1.00 17.86 ? 326 HOH D O 1 +HETATM 7459 O O . HOH H 2 . ? 7.244 25.191 7.819 1.00 61.91 ? 327 HOH D O 1 +HETATM 7460 O O . HOH H 2 . ? 16.663 24.276 7.586 1.00 31.40 ? 328 HOH D O 1 +HETATM 7461 O O . HOH H 2 . ? 17.282 4.877 12.648 1.00 47.91 ? 329 HOH D O 1 +HETATM 7462 O O . HOH H 2 . ? 45.739 -7.798 7.526 1.00 60.59 ? 330 HOH D O 1 +HETATM 7463 O O . HOH H 2 . ? 10.769 10.292 0.779 1.00 23.92 ? 331 HOH D O 1 +HETATM 7464 O O . HOH H 2 . ? 28.362 1.700 4.865 1.00 17.93 ? 332 HOH D O 1 +HETATM 7465 O O . HOH H 2 . ? 19.535 26.290 11.810 1.00 47.74 ? 333 HOH D O 1 +HETATM 7466 O O . HOH H 2 . ? 18.775 25.685 14.545 1.00 43.52 ? 334 HOH D O 1 +# diff --git a/tests/resources/1drf.cif b/tests/resources/1drf.cif new file mode 100644 index 0000000..0f8d4ac --- /dev/null +++ b/tests/resources/1drf.cif @@ -0,0 +1,4128 @@ +data_1DRF +# +_entry.id 1DRF +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.385 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 1DRF pdb_00001drf 10.2210/pdb1drf/pdb +WWPDB D_1000172905 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 1992-01-15 +2 'Structure model' 1 1 2008-03-03 +3 'Structure model' 1 2 2011-07-13 +4 'Structure model' 1 3 2024-02-07 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Version format compliance' +3 4 'Structure model' 'Data collection' +4 4 'Structure model' 'Database references' +5 4 'Structure model' 'Derived calculations' +6 4 'Structure model' Other +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 4 'Structure model' chem_comp_atom +2 4 'Structure model' chem_comp_bond +3 4 'Structure model' database_2 +4 4 'Structure model' pdbx_database_status +5 4 'Structure model' struct_site +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 4 'Structure model' '_database_2.pdbx_DOI' +2 4 'Structure model' '_database_2.pdbx_database_accession' +3 4 'Structure model' '_pdbx_database_status.process_site' +4 4 'Structure model' '_struct_site.pdbx_auth_asym_id' +5 4 'Structure model' '_struct_site.pdbx_auth_comp_id' +6 4 'Structure model' '_struct_site.pdbx_auth_seq_id' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 1DRF +_pdbx_database_status.recvd_initial_deposition_date 1990-08-09 +_pdbx_database_status.deposit_site ? +_pdbx_database_status.process_site BNL +_pdbx_database_status.SG_entry . +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.status_code_sf ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.status_code_nmr_data ? +_pdbx_database_status.methods_development_category ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Oefner, C.' 1 +;D'Arcy, A. +; +2 +'Winkler, F.K.' 3 +# +_citation.id primary +_citation.title 'Crystal structure of human dihydrofolate reductase complexed with folate.' +_citation.journal_abbrev Eur.J.Biochem. +_citation.journal_volume 174 +_citation.page_first 377 +_citation.page_last 385 +_citation.year 1988 +_citation.journal_id_ASTM EJBCAI +_citation.country IX +_citation.journal_id_ISSN 0014-2956 +_citation.journal_id_CSD 0262 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed 3383852 +_citation.pdbx_database_id_DOI 10.1111/j.1432-1033.1988.tb14108.x +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Oefner, C.' 1 ? +primary +;D'Arcy, A. +; +2 ? +primary 'Winkler, F.K.' 3 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'DIHYDROFOLATE REDUCTASE' 21349.525 1 1.5.1.3 ? ? ? +2 non-polymer syn 'SULFATE ION' 96.063 2 ? ? ? ? +3 non-polymer syn 'FOLIC ACID' 441.397 1 ? ? ? ? +4 water nat water 18.015 249 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer no +_entity_poly.pdbx_seq_one_letter_code +;VGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFSIPEKNRPLKGRINLVLSRELK +EPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSSVYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLP +EYPGVLSDVQEEKGIKYKFEVYEKND +; +_entity_poly.pdbx_seq_one_letter_code_can +;VGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFSIPEKNRPLKGRINLVLSRELK +EPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSSVYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLP +EYPGVLSDVQEEKGIKYKFEVYEKND +; +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +2 'SULFATE ION' SO4 +3 'FOLIC ACID' FOL +4 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 VAL n +1 2 GLY n +1 3 SER n +1 4 LEU n +1 5 ASN n +1 6 CYS n +1 7 ILE n +1 8 VAL n +1 9 ALA n +1 10 VAL n +1 11 SER n +1 12 GLN n +1 13 ASN n +1 14 MET n +1 15 GLY n +1 16 ILE n +1 17 GLY n +1 18 LYS n +1 19 ASN n +1 20 GLY n +1 21 ASP n +1 22 LEU n +1 23 PRO n +1 24 TRP n +1 25 PRO n +1 26 PRO n +1 27 LEU n +1 28 ARG n +1 29 ASN n +1 30 GLU n +1 31 PHE n +1 32 ARG n +1 33 TYR n +1 34 PHE n +1 35 GLN n +1 36 ARG n +1 37 MET n +1 38 THR n +1 39 THR n +1 40 THR n +1 41 SER n +1 42 SER n +1 43 VAL n +1 44 GLU n +1 45 GLY n +1 46 LYS n +1 47 GLN n +1 48 ASN n +1 49 LEU n +1 50 VAL n +1 51 ILE n +1 52 MET n +1 53 GLY n +1 54 LYS n +1 55 LYS n +1 56 THR n +1 57 TRP n +1 58 PHE n +1 59 SER n +1 60 ILE n +1 61 PRO n +1 62 GLU n +1 63 LYS n +1 64 ASN n +1 65 ARG n +1 66 PRO n +1 67 LEU n +1 68 LYS n +1 69 GLY n +1 70 ARG n +1 71 ILE n +1 72 ASN n +1 73 LEU n +1 74 VAL n +1 75 LEU n +1 76 SER n +1 77 ARG n +1 78 GLU n +1 79 LEU n +1 80 LYS n +1 81 GLU n +1 82 PRO n +1 83 PRO n +1 84 GLN n +1 85 GLY n +1 86 ALA n +1 87 HIS n +1 88 PHE n +1 89 LEU n +1 90 SER n +1 91 ARG n +1 92 SER n +1 93 LEU n +1 94 ASP n +1 95 ASP n +1 96 ALA n +1 97 LEU n +1 98 LYS n +1 99 LEU n +1 100 THR n +1 101 GLU n +1 102 GLN n +1 103 PRO n +1 104 GLU n +1 105 LEU n +1 106 ALA n +1 107 ASN n +1 108 LYS n +1 109 VAL n +1 110 ASP n +1 111 MET n +1 112 VAL n +1 113 TRP n +1 114 ILE n +1 115 VAL n +1 116 GLY n +1 117 GLY n +1 118 SER n +1 119 SER n +1 120 VAL n +1 121 TYR n +1 122 LYS n +1 123 GLU n +1 124 ALA n +1 125 MET n +1 126 ASN n +1 127 HIS n +1 128 PRO n +1 129 GLY n +1 130 HIS n +1 131 LEU n +1 132 LYS n +1 133 LEU n +1 134 PHE n +1 135 VAL n +1 136 THR n +1 137 ARG n +1 138 ILE n +1 139 MET n +1 140 GLN n +1 141 ASP n +1 142 PHE n +1 143 GLU n +1 144 SER n +1 145 ASP n +1 146 THR n +1 147 PHE n +1 148 PHE n +1 149 PRO n +1 150 GLU n +1 151 ILE n +1 152 ASP n +1 153 LEU n +1 154 GLU n +1 155 LYS n +1 156 TYR n +1 157 LYS n +1 158 LEU n +1 159 LEU n +1 160 PRO n +1 161 GLU n +1 162 TYR n +1 163 PRO n +1 164 GLY n +1 165 VAL n +1 166 LEU n +1 167 SER n +1 168 ASP n +1 169 VAL n +1 170 GLN n +1 171 GLU n +1 172 GLU n +1 173 LYS n +1 174 GLY n +1 175 ILE n +1 176 LYS n +1 177 TYR n +1 178 LYS n +1 179 PHE n +1 180 GLU n +1 181 VAL n +1 182 TYR n +1 183 GLU n +1 184 LYS n +1 185 ASN n +1 186 ASP n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name human +_entity_src_gen.gene_src_genus Homo +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name ? +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id ? +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain ? +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type ? +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name ? +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +FOL non-polymer . 'FOLIC ACID' ? 'C19 H19 N7 O6' 441.397 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 VAL 1 1 1 VAL VAL A . n +A 1 2 GLY 2 2 2 GLY GLY A . n +A 1 3 SER 3 3 3 SER SER A . n +A 1 4 LEU 4 4 4 LEU LEU A . n +A 1 5 ASN 5 5 5 ASN ASN A . n +A 1 6 CYS 6 6 6 CYS CYS A . n +A 1 7 ILE 7 7 7 ILE ILE A . n +A 1 8 VAL 8 8 8 VAL VAL A . n +A 1 9 ALA 9 9 9 ALA ALA A . n +A 1 10 VAL 10 10 10 VAL VAL A . n +A 1 11 SER 11 11 11 SER SER A . n +A 1 12 GLN 12 12 12 GLN GLN A . n +A 1 13 ASN 13 13 13 ASN ASN A . n +A 1 14 MET 14 14 14 MET MET A . n +A 1 15 GLY 15 15 15 GLY GLY A . n +A 1 16 ILE 16 16 16 ILE ILE A . n +A 1 17 GLY 17 17 17 GLY GLY A . n +A 1 18 LYS 18 18 18 LYS LYS A . n +A 1 19 ASN 19 19 19 ASN ASN A . n +A 1 20 GLY 20 20 20 GLY GLY A . n +A 1 21 ASP 21 21 21 ASP ASP A . n +A 1 22 LEU 22 22 22 LEU LEU A . n +A 1 23 PRO 23 23 23 PRO PRO A . n +A 1 24 TRP 24 24 24 TRP TRP A . n +A 1 25 PRO 25 25 25 PRO PRO A . n +A 1 26 PRO 26 26 26 PRO PRO A . n +A 1 27 LEU 27 27 27 LEU LEU A . n +A 1 28 ARG 28 28 28 ARG ARG A . n +A 1 29 ASN 29 29 29 ASN ASN A . n +A 1 30 GLU 30 30 30 GLU GLU A . n +A 1 31 PHE 31 31 31 PHE PHE A . n +A 1 32 ARG 32 32 32 ARG ARG A . n +A 1 33 TYR 33 33 33 TYR TYR A . n +A 1 34 PHE 34 34 34 PHE PHE A . n +A 1 35 GLN 35 35 35 GLN GLN A . n +A 1 36 ARG 36 36 36 ARG ARG A . n +A 1 37 MET 37 37 37 MET MET A . n +A 1 38 THR 38 38 38 THR THR A . n +A 1 39 THR 39 39 39 THR THR A . n +A 1 40 THR 40 40 40 THR THR A . n +A 1 41 SER 41 41 41 SER SER A . n +A 1 42 SER 42 42 42 SER SER A . n +A 1 43 VAL 43 43 43 VAL VAL A . n +A 1 44 GLU 44 44 44 GLU GLU A . n +A 1 45 GLY 45 45 45 GLY GLY A . n +A 1 46 LYS 46 46 46 LYS LYS A . n +A 1 47 GLN 47 47 47 GLN GLN A . n +A 1 48 ASN 48 48 48 ASN ASN A . n +A 1 49 LEU 49 49 49 LEU LEU A . n +A 1 50 VAL 50 50 50 VAL VAL A . n +A 1 51 ILE 51 51 51 ILE ILE A . n +A 1 52 MET 52 52 52 MET MET A . n +A 1 53 GLY 53 53 53 GLY GLY A . n +A 1 54 LYS 54 54 54 LYS LYS A . n +A 1 55 LYS 55 55 55 LYS LYS A . n +A 1 56 THR 56 56 56 THR THR A . n +A 1 57 TRP 57 57 57 TRP TRP A . n +A 1 58 PHE 58 58 58 PHE PHE A . n +A 1 59 SER 59 59 59 SER SER A . n +A 1 60 ILE 60 60 60 ILE ILE A . n +A 1 61 PRO 61 61 61 PRO PRO A . n +A 1 62 GLU 62 62 62 GLU GLU A . n +A 1 63 LYS 63 63 63 LYS LYS A . n +A 1 64 ASN 64 64 64 ASN ASN A . n +A 1 65 ARG 65 65 65 ARG ARG A . n +A 1 66 PRO 66 66 66 PRO PRO A . n +A 1 67 LEU 67 67 67 LEU LEU A . n +A 1 68 LYS 68 68 68 LYS LYS A . n +A 1 69 GLY 69 69 69 GLY GLY A . n +A 1 70 ARG 70 70 70 ARG ARG A . n +A 1 71 ILE 71 71 71 ILE ILE A . n +A 1 72 ASN 72 72 72 ASN ASN A . n +A 1 73 LEU 73 73 73 LEU LEU A . n +A 1 74 VAL 74 74 74 VAL VAL A . n +A 1 75 LEU 75 75 75 LEU LEU A . n +A 1 76 SER 76 76 76 SER SER A . n +A 1 77 ARG 77 77 77 ARG ARG A . n +A 1 78 GLU 78 78 78 GLU GLU A . n +A 1 79 LEU 79 79 79 LEU LEU A . n +A 1 80 LYS 80 80 80 LYS LYS A . n +A 1 81 GLU 81 81 81 GLU GLU A . n +A 1 82 PRO 82 82 82 PRO PRO A . n +A 1 83 PRO 83 83 83 PRO PRO A . n +A 1 84 GLN 84 84 84 GLN GLN A . n +A 1 85 GLY 85 85 85 GLY GLY A . n +A 1 86 ALA 86 86 86 ALA ALA A . n +A 1 87 HIS 87 87 87 HIS HIS A . n +A 1 88 PHE 88 88 88 PHE PHE A . n +A 1 89 LEU 89 89 89 LEU LEU A . n +A 1 90 SER 90 90 90 SER SER A . n +A 1 91 ARG 91 91 91 ARG ARG A . n +A 1 92 SER 92 92 92 SER SER A . n +A 1 93 LEU 93 93 93 LEU LEU A . n +A 1 94 ASP 94 94 94 ASP ASP A . n +A 1 95 ASP 95 95 95 ASP ASP A . n +A 1 96 ALA 96 96 96 ALA ALA A . n +A 1 97 LEU 97 97 97 LEU LEU A . n +A 1 98 LYS 98 98 98 LYS LYS A . n +A 1 99 LEU 99 99 99 LEU LEU A . n +A 1 100 THR 100 100 100 THR THR A . n +A 1 101 GLU 101 101 101 GLU GLU A . n +A 1 102 GLN 102 102 102 GLN GLN A . n +A 1 103 PRO 103 103 103 PRO PRO A . n +A 1 104 GLU 104 104 104 GLU GLU A . n +A 1 105 LEU 105 105 105 LEU LEU A . n +A 1 106 ALA 106 106 106 ALA ALA A . n +A 1 107 ASN 107 107 107 ASN ASN A . n +A 1 108 LYS 108 108 108 LYS LYS A . n +A 1 109 VAL 109 109 109 VAL VAL A . n +A 1 110 ASP 110 110 110 ASP ASP A . n +A 1 111 MET 111 111 111 MET MET A . n +A 1 112 VAL 112 112 112 VAL VAL A . n +A 1 113 TRP 113 113 113 TRP TRP A . n +A 1 114 ILE 114 114 114 ILE ILE A . n +A 1 115 VAL 115 115 115 VAL VAL A . n +A 1 116 GLY 116 116 116 GLY GLY A . n +A 1 117 GLY 117 117 117 GLY GLY A . n +A 1 118 SER 118 118 118 SER SER A . n +A 1 119 SER 119 119 119 SER SER A . n +A 1 120 VAL 120 120 120 VAL VAL A . n +A 1 121 TYR 121 121 121 TYR TYR A . n +A 1 122 LYS 122 122 122 LYS LYS A . n +A 1 123 GLU 123 123 123 GLU GLU A . n +A 1 124 ALA 124 124 124 ALA ALA A . n +A 1 125 MET 125 125 125 MET MET A . n +A 1 126 ASN 126 126 126 ASN ASN A . n +A 1 127 HIS 127 127 127 HIS HIS A . n +A 1 128 PRO 128 128 128 PRO PRO A . n +A 1 129 GLY 129 129 129 GLY GLY A . n +A 1 130 HIS 130 130 130 HIS HIS A . n +A 1 131 LEU 131 131 131 LEU LEU A . n +A 1 132 LYS 132 132 132 LYS LYS A . n +A 1 133 LEU 133 133 133 LEU LEU A . n +A 1 134 PHE 134 134 134 PHE PHE A . n +A 1 135 VAL 135 135 135 VAL VAL A . n +A 1 136 THR 136 136 136 THR THR A . n +A 1 137 ARG 137 137 137 ARG ARG A . n +A 1 138 ILE 138 138 138 ILE ILE A . n +A 1 139 MET 139 139 139 MET MET A . n +A 1 140 GLN 140 140 140 GLN GLN A . n +A 1 141 ASP 141 141 141 ASP ASP A . n +A 1 142 PHE 142 142 142 PHE PHE A . n +A 1 143 GLU 143 143 143 GLU GLU A . n +A 1 144 SER 144 144 144 SER SER A . n +A 1 145 ASP 145 145 145 ASP ASP A . n +A 1 146 THR 146 146 146 THR THR A . n +A 1 147 PHE 147 147 147 PHE PHE A . n +A 1 148 PHE 148 148 148 PHE PHE A . n +A 1 149 PRO 149 149 149 PRO PRO A . n +A 1 150 GLU 150 150 150 GLU GLU A . n +A 1 151 ILE 151 151 151 ILE ILE A . n +A 1 152 ASP 152 152 152 ASP ASP A . n +A 1 153 LEU 153 153 153 LEU LEU A . n +A 1 154 GLU 154 154 154 GLU GLU A . n +A 1 155 LYS 155 155 155 LYS LYS A . n +A 1 156 TYR 156 156 156 TYR TYR A . n +A 1 157 LYS 157 157 157 LYS LYS A . n +A 1 158 LEU 158 158 158 LEU LEU A . n +A 1 159 LEU 159 159 159 LEU LEU A . n +A 1 160 PRO 160 160 160 PRO PRO A . n +A 1 161 GLU 161 161 161 GLU GLU A . n +A 1 162 TYR 162 162 162 TYR TYR A . n +A 1 163 PRO 163 163 163 PRO PRO A . n +A 1 164 GLY 164 164 164 GLY GLY A . n +A 1 165 VAL 165 165 165 VAL VAL A . n +A 1 166 LEU 166 166 166 LEU LEU A . n +A 1 167 SER 167 167 167 SER SER A . n +A 1 168 ASP 168 168 168 ASP ASP A . n +A 1 169 VAL 169 169 169 VAL VAL A . n +A 1 170 GLN 170 170 170 GLN GLN A . n +A 1 171 GLU 171 171 171 GLU GLU A . n +A 1 172 GLU 172 172 172 GLU GLU A . n +A 1 173 LYS 173 173 173 LYS LYS A . n +A 1 174 GLY 174 174 174 GLY GLY A . n +A 1 175 ILE 175 175 175 ILE ILE A . n +A 1 176 LYS 176 176 176 LYS LYS A . n +A 1 177 TYR 177 177 177 TYR TYR A . n +A 1 178 LYS 178 178 178 LYS LYS A . n +A 1 179 PHE 179 179 179 PHE PHE A . n +A 1 180 GLU 180 180 180 GLU GLU A . n +A 1 181 VAL 181 181 181 VAL VAL A . n +A 1 182 TYR 182 182 182 TYR TYR A . n +A 1 183 GLU 183 183 183 GLU GLU A . n +A 1 184 LYS 184 184 184 LYS LYS A . n +A 1 185 ASN 185 185 185 ASN ASN A . n +A 1 186 ASP 186 186 186 ASP ASP A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +B 2 SO4 1 613 613 SO4 SO4 A . +C 2 SO4 1 614 614 SO4 SO4 A . +D 3 FOL 1 187 187 FOL FOL A . +E 4 HOH 1 615 1 HOH HOH A . +E 4 HOH 2 616 2 HOH HOH A . +E 4 HOH 3 617 3 HOH HOH A . +E 4 HOH 4 618 4 HOH HOH A . +E 4 HOH 5 619 5 HOH HOH A . +E 4 HOH 6 620 6 HOH HOH A . +E 4 HOH 7 621 7 HOH HOH A . +E 4 HOH 8 622 8 HOH HOH A . +E 4 HOH 9 623 9 HOH HOH A . +E 4 HOH 10 624 10 HOH HOH A . +E 4 HOH 11 625 11 HOH HOH A . +E 4 HOH 12 626 12 HOH HOH A . +E 4 HOH 13 627 13 HOH HOH A . +E 4 HOH 14 628 14 HOH HOH A . +E 4 HOH 15 629 15 HOH HOH A . +E 4 HOH 16 630 16 HOH HOH A . +E 4 HOH 17 631 17 HOH HOH A . +E 4 HOH 18 632 18 HOH HOH A . +E 4 HOH 19 633 19 HOH HOH A . +E 4 HOH 20 634 20 HOH HOH A . +E 4 HOH 21 635 21 HOH HOH A . +E 4 HOH 22 636 22 HOH HOH A . +E 4 HOH 23 637 23 HOH HOH A . +E 4 HOH 24 638 24 HOH HOH A . +E 4 HOH 25 639 25 HOH HOH A . +E 4 HOH 26 640 26 HOH HOH A . +E 4 HOH 27 641 27 HOH HOH A . +E 4 HOH 28 642 28 HOH HOH A . +E 4 HOH 29 643 29 HOH HOH A . +E 4 HOH 30 644 30 HOH HOH A . +E 4 HOH 31 645 31 HOH HOH A . +E 4 HOH 32 646 32 HOH HOH A . +E 4 HOH 33 647 33 HOH HOH A . +E 4 HOH 34 648 34 HOH HOH A . +E 4 HOH 35 649 35 HOH HOH A . +E 4 HOH 36 650 36 HOH HOH A . +E 4 HOH 37 651 37 HOH HOH A . +E 4 HOH 38 652 38 HOH HOH A . +E 4 HOH 39 653 39 HOH HOH A . +E 4 HOH 40 654 40 HOH HOH A . +E 4 HOH 41 655 41 HOH HOH A . +E 4 HOH 42 656 42 HOH HOH A . +E 4 HOH 43 657 43 HOH HOH A . +E 4 HOH 44 658 44 HOH HOH A . +E 4 HOH 45 659 45 HOH HOH A . +E 4 HOH 46 660 46 HOH HOH A . +E 4 HOH 47 661 47 HOH HOH A . +E 4 HOH 48 662 48 HOH HOH A . +E 4 HOH 49 663 49 HOH HOH A . +E 4 HOH 50 664 50 HOH HOH A . +E 4 HOH 51 665 51 HOH HOH A . +E 4 HOH 52 666 52 HOH HOH A . +E 4 HOH 53 667 53 HOH HOH A . +E 4 HOH 54 668 54 HOH HOH A . +E 4 HOH 55 669 55 HOH HOH A . +E 4 HOH 56 670 56 HOH HOH A . +E 4 HOH 57 671 57 HOH HOH A . +E 4 HOH 58 672 58 HOH HOH A . +E 4 HOH 59 673 59 HOH HOH A . +E 4 HOH 60 674 60 HOH HOH A . +E 4 HOH 61 675 61 HOH HOH A . +E 4 HOH 62 676 62 HOH HOH A . +E 4 HOH 63 677 63 HOH HOH A . +E 4 HOH 64 678 64 HOH HOH A . +E 4 HOH 65 679 65 HOH HOH A . +E 4 HOH 66 680 66 HOH HOH A . +E 4 HOH 67 681 67 HOH HOH A . +E 4 HOH 68 682 68 HOH HOH A . +E 4 HOH 69 683 69 HOH HOH A . +E 4 HOH 70 684 70 HOH HOH A . +E 4 HOH 71 685 71 HOH HOH A . +E 4 HOH 72 686 72 HOH HOH A . +E 4 HOH 73 687 73 HOH HOH A . +E 4 HOH 74 688 74 HOH HOH A . +E 4 HOH 75 689 75 HOH HOH A . +E 4 HOH 76 690 76 HOH HOH A . +E 4 HOH 77 691 77 HOH HOH A . +E 4 HOH 78 692 78 HOH HOH A . +E 4 HOH 79 693 79 HOH HOH A . +E 4 HOH 80 694 80 HOH HOH A . +E 4 HOH 81 695 81 HOH HOH A . +E 4 HOH 82 696 82 HOH HOH A . +E 4 HOH 83 697 83 HOH HOH A . +E 4 HOH 84 698 84 HOH HOH A . +E 4 HOH 85 699 85 HOH HOH A . +E 4 HOH 86 700 86 HOH HOH A . +E 4 HOH 87 701 87 HOH HOH A . +E 4 HOH 88 702 88 HOH HOH A . +E 4 HOH 89 703 89 HOH HOH A . +E 4 HOH 90 704 90 HOH HOH A . +E 4 HOH 91 705 91 HOH HOH A . +E 4 HOH 92 706 92 HOH HOH A . +E 4 HOH 93 707 93 HOH HOH A . +E 4 HOH 94 708 94 HOH HOH A . +E 4 HOH 95 709 95 HOH HOH A . +E 4 HOH 96 710 96 HOH HOH A . +E 4 HOH 97 711 97 HOH HOH A . +E 4 HOH 98 712 98 HOH HOH A . +E 4 HOH 99 713 99 HOH HOH A . +E 4 HOH 100 714 100 HOH HOH A . +E 4 HOH 101 715 101 HOH HOH A . +E 4 HOH 102 716 102 HOH HOH A . +E 4 HOH 103 717 103 HOH HOH A . +E 4 HOH 104 718 104 HOH HOH A . +E 4 HOH 105 719 105 HOH HOH A . +E 4 HOH 106 720 106 HOH HOH A . +E 4 HOH 107 721 107 HOH HOH A . +E 4 HOH 108 722 108 HOH HOH A . +E 4 HOH 109 723 109 HOH HOH A . +E 4 HOH 110 724 110 HOH HOH A . +E 4 HOH 111 725 111 HOH HOH A . +E 4 HOH 112 726 112 HOH HOH A . +E 4 HOH 113 727 113 HOH HOH A . +E 4 HOH 114 728 114 HOH HOH A . +E 4 HOH 115 729 115 HOH HOH A . +E 4 HOH 116 730 116 HOH HOH A . +E 4 HOH 117 731 117 HOH HOH A . +E 4 HOH 118 732 118 HOH HOH A . +E 4 HOH 119 733 119 HOH HOH A . +E 4 HOH 120 734 120 HOH HOH A . +E 4 HOH 121 735 121 HOH HOH A . +E 4 HOH 122 736 122 HOH HOH A . +E 4 HOH 123 737 123 HOH HOH A . +E 4 HOH 124 738 124 HOH HOH A . +E 4 HOH 125 739 125 HOH HOH A . +E 4 HOH 126 740 126 HOH HOH A . +E 4 HOH 127 741 127 HOH HOH A . +E 4 HOH 128 742 128 HOH HOH A . +E 4 HOH 129 743 129 HOH HOH A . +E 4 HOH 130 744 130 HOH HOH A . +E 4 HOH 131 745 131 HOH HOH A . +E 4 HOH 132 746 132 HOH HOH A . +E 4 HOH 133 747 133 HOH HOH A . +E 4 HOH 134 748 134 HOH HOH A . +E 4 HOH 135 749 135 HOH HOH A . +E 4 HOH 136 750 136 HOH HOH A . +E 4 HOH 137 751 137 HOH HOH A . +E 4 HOH 138 752 138 HOH HOH A . +E 4 HOH 139 753 139 HOH HOH A . +E 4 HOH 140 754 140 HOH HOH A . +E 4 HOH 141 755 141 HOH HOH A . +E 4 HOH 142 756 142 HOH HOH A . +E 4 HOH 143 757 143 HOH HOH A . +E 4 HOH 144 758 144 HOH HOH A . +E 4 HOH 145 759 145 HOH HOH A . +E 4 HOH 146 760 146 HOH HOH A . +E 4 HOH 147 761 147 HOH HOH A . +E 4 HOH 148 762 148 HOH HOH A . +E 4 HOH 149 763 149 HOH HOH A . +E 4 HOH 150 764 150 HOH HOH A . +E 4 HOH 151 765 151 HOH HOH A . +E 4 HOH 152 766 152 HOH HOH A . +E 4 HOH 153 767 153 HOH HOH A . +E 4 HOH 154 768 154 HOH HOH A . +E 4 HOH 155 769 155 HOH HOH A . +E 4 HOH 156 770 156 HOH HOH A . +E 4 HOH 157 771 157 HOH HOH A . +E 4 HOH 158 772 158 HOH HOH A . +E 4 HOH 159 773 159 HOH HOH A . +E 4 HOH 160 774 160 HOH HOH A . +E 4 HOH 161 775 161 HOH HOH A . +E 4 HOH 162 776 162 HOH HOH A . +E 4 HOH 163 777 163 HOH HOH A . +E 4 HOH 164 778 164 HOH HOH A . +E 4 HOH 165 779 165 HOH HOH A . +E 4 HOH 166 780 166 HOH HOH A . +E 4 HOH 167 781 167 HOH HOH A . +E 4 HOH 168 782 168 HOH HOH A . +E 4 HOH 169 783 169 HOH HOH A . +E 4 HOH 170 784 170 HOH HOH A . +E 4 HOH 171 785 171 HOH HOH A . +E 4 HOH 172 786 172 HOH HOH A . +E 4 HOH 173 787 173 HOH HOH A . +E 4 HOH 174 788 174 HOH HOH A . +E 4 HOH 175 789 175 HOH HOH A . +E 4 HOH 176 790 176 HOH HOH A . +E 4 HOH 177 791 177 HOH HOH A . +E 4 HOH 178 792 178 HOH HOH A . +E 4 HOH 179 793 179 HOH HOH A . +E 4 HOH 180 794 180 HOH HOH A . +E 4 HOH 181 795 181 HOH HOH A . +E 4 HOH 182 796 182 HOH HOH A . +E 4 HOH 183 797 183 HOH HOH A . +E 4 HOH 184 798 184 HOH HOH A . +E 4 HOH 185 799 185 HOH HOH A . +E 4 HOH 186 800 186 HOH HOH A . +E 4 HOH 187 801 187 HOH HOH A . +E 4 HOH 188 802 188 HOH HOH A . +E 4 HOH 189 803 189 HOH HOH A . +E 4 HOH 190 804 190 HOH HOH A . +E 4 HOH 191 805 191 HOH HOH A . +E 4 HOH 192 806 192 HOH HOH A . +E 4 HOH 193 807 193 HOH HOH A . +E 4 HOH 194 808 194 HOH HOH A . +E 4 HOH 195 809 195 HOH HOH A . +E 4 HOH 196 810 196 HOH HOH A . +E 4 HOH 197 811 197 HOH HOH A . +E 4 HOH 198 812 198 HOH HOH A . +E 4 HOH 199 813 199 HOH HOH A . +E 4 HOH 200 814 200 HOH HOH A . +E 4 HOH 201 815 201 HOH HOH A . +E 4 HOH 202 816 202 HOH HOH A . +E 4 HOH 203 817 203 HOH HOH A . +E 4 HOH 204 818 204 HOH HOH A . +E 4 HOH 205 819 205 HOH HOH A . +E 4 HOH 206 820 206 HOH HOH A . +E 4 HOH 207 821 207 HOH HOH A . +E 4 HOH 208 822 208 HOH HOH A . +E 4 HOH 209 823 209 HOH HOH A . +E 4 HOH 210 824 210 HOH HOH A . +E 4 HOH 211 825 211 HOH HOH A . +E 4 HOH 212 826 212 HOH HOH A . +E 4 HOH 213 827 213 HOH HOH A . +E 4 HOH 214 828 214 HOH HOH A . +E 4 HOH 215 829 215 HOH HOH A . +E 4 HOH 216 830 216 HOH HOH A . +E 4 HOH 217 831 217 HOH HOH A . +E 4 HOH 218 832 218 HOH HOH A . +E 4 HOH 219 833 219 HOH HOH A . +E 4 HOH 220 834 220 HOH HOH A . +E 4 HOH 221 835 221 HOH HOH A . +E 4 HOH 222 836 222 HOH HOH A . +E 4 HOH 223 837 223 HOH HOH A . +E 4 HOH 224 838 224 HOH HOH A . +E 4 HOH 225 839 225 HOH HOH A . +E 4 HOH 226 840 226 HOH HOH A . +E 4 HOH 227 841 227 HOH HOH A . +E 4 HOH 228 842 228 HOH HOH A . +E 4 HOH 229 843 229 HOH HOH A . +E 4 HOH 230 844 230 HOH HOH A . +E 4 HOH 231 845 231 HOH HOH A . +E 4 HOH 232 846 232 HOH HOH A . +E 4 HOH 233 847 233 HOH HOH A . +E 4 HOH 234 848 234 HOH HOH A . +E 4 HOH 235 849 235 HOH HOH A . +E 4 HOH 236 850 236 HOH HOH A . +E 4 HOH 237 851 237 HOH HOH A . +E 4 HOH 238 852 238 HOH HOH A . +E 4 HOH 239 853 239 HOH HOH A . +E 4 HOH 240 854 240 HOH HOH A . +E 4 HOH 241 855 241 HOH HOH A . +E 4 HOH 242 856 242 HOH HOH A . +E 4 HOH 243 857 243 HOH HOH A . +E 4 HOH 244 858 244 HOH HOH A . +E 4 HOH 245 859 245 HOH HOH A . +E 4 HOH 246 860 246 HOH HOH A . +E 4 HOH 247 861 247 HOH HOH A . +E 4 HOH 248 862 248 HOH HOH A . +E 4 HOH 249 863 249 HOH HOH A . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A GLN 12 ? CB ? A GLN 12 CB +2 1 Y 1 A GLN 12 ? CG ? A GLN 12 CG +3 1 Y 1 A GLN 12 ? CD ? A GLN 12 CD +4 1 Y 1 A GLN 12 ? OE1 ? A GLN 12 OE1 +5 1 Y 1 A GLN 12 ? NE2 ? A GLN 12 NE2 +# +_software.name PROLSQ +_software.classification refinement +_software.version . +_software.citation_id ? +_software.pdbx_ordinal 1 +# +_cell.entry_id 1DRF +_cell.length_a 86.290 +_cell.length_b 86.290 +_cell.length_c 76.980 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 120.00 +_cell.Z_PDB 9 +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 1DRF +_symmetry.space_group_name_H-M 'H 3' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 146 +# +_exptl.entry_id 1DRF +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number ? +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.58 +_exptl_crystal.density_percent_sol 52.36 +_exptl_crystal.description ? +# +_diffrn.id 1 +_diffrn.ambient_temp ? +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l ? +_diffrn_radiation.monochromator ? +_diffrn_radiation.pdbx_diffrn_protocol ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength . +_diffrn_radiation_wavelength.wt 1.0 +# +_refine.entry_id 1DRF +_refine.ls_number_reflns_obs ? +_refine.ls_number_reflns_all ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_d_res_low ? +_refine.ls_d_res_high 2.0 +_refine.ls_percent_reflns_obs ? +_refine.ls_R_factor_obs 0.1890000 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work ? +_refine.ls_R_factor_R_free ? +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free ? +_refine.ls_number_reflns_R_free ? +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.B_iso_mean ? +_refine.aniso_B[1][1] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[3][3] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][3] ? +_refine.solvent_model_details ? +_refine.solvent_model_param_ksol ? +_refine.solvent_model_param_bsol ? +_refine.pdbx_ls_cross_valid_method ? +_refine.details ? +_refine.pdbx_starting_model ? +_refine.pdbx_method_to_determine_struct ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details ? +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.overall_SU_B ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_overall_phase_error ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 1497 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 42 +_refine_hist.number_atoms_solvent 249 +_refine_hist.number_atoms_total 1788 +_refine_hist.d_res_high 2.0 +_refine_hist.d_res_low . +# +_database_PDB_matrix.entry_id 1DRF +_database_PDB_matrix.origx[1][1] 1.000000 +_database_PDB_matrix.origx[1][2] 0.000000 +_database_PDB_matrix.origx[1][3] 0.000000 +_database_PDB_matrix.origx[2][1] 0.000000 +_database_PDB_matrix.origx[2][2] 1.000000 +_database_PDB_matrix.origx[2][3] 0.000000 +_database_PDB_matrix.origx[3][1] 0.000000 +_database_PDB_matrix.origx[3][2] 0.000000 +_database_PDB_matrix.origx[3][3] 1.000000 +_database_PDB_matrix.origx_vector[1] 0.00000 +_database_PDB_matrix.origx_vector[2] 0.00000 +_database_PDB_matrix.origx_vector[3] 0.00000 +# +_struct.entry_id 1DRF +_struct.title 'CRYSTAL STRUCTURE OF HUMAN DIHYDROFOLATE REDUCTASE COMPLEXED WITH FOLATE' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 1DRF +_struct_keywords.pdbx_keywords 'OXIDOREDUCTASE (CH-NH(D)-NAD OR NADP(A))' +_struct_keywords.text 'OXIDOREDUCTASE (CH-NH(D)-NAD OR NADP(A))' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 2 ? +D N N 3 ? +E N N 4 ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code DYR_HUMAN +_struct_ref.entity_id 1 +_struct_ref.pdbx_db_accession P00374 +_struct_ref.pdbx_align_begin 1 +_struct_ref.pdbx_seq_one_letter_code +;VGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFSIPEKNRPLKGRINLVLSRELK +EPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSSVYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLP +EYPGVLSDVQEEKGIKYKFEVYEKND +; +_struct_ref.pdbx_db_isoform ? +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 1DRF +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 1 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 186 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession P00374 +_struct_ref_seq.db_align_beg 1 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 186 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 1 +_struct_ref_seq.pdbx_auth_seq_align_end 186 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_struct_biol.id 1 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 LEU A 27 ? THR A 40 ? LEU A 27 THR A 40 1 ? 14 +HELX_P HELX_P2 2 LYS A 54 ? ILE A 60 ? LYS A 54 ILE A 60 1 ? 7 +HELX_P HELX_P3 3 PRO A 61 ? ARG A 65 ? PRO A 61 ARG A 65 5 ? 5 +HELX_P HELX_P4 4 SER A 92 ? THR A 100 ? SER A 92 THR A 100 1 ? 9 +HELX_P HELX_P5 5 GLN A 102 ? ASN A 107 ? GLN A 102 ASN A 107 1 ? 6 +HELX_P HELX_P6 6 GLY A 117 ? HIS A 127 ? GLY A 117 HIS A 127 1 ? 11 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +A ? 8 ? +B ? 8 ? +C ? 2 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? parallel +A 2 3 ? parallel +A 3 4 ? parallel +A 4 5 ? parallel +A 5 6 ? parallel +A 6 7 ? anti-parallel +A 7 8 ? anti-parallel +B 1 2 ? parallel +B 2 3 ? parallel +B 3 4 ? parallel +B 4 5 ? parallel +B 5 6 ? parallel +B 6 7 ? anti-parallel +B 7 8 ? anti-parallel +C 1 2 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 PHE A 88 ? SER A 90 ? PHE A 88 SER A 90 +A 2 ILE A 71 ? LEU A 75 ? ILE A 71 LEU A 75 +A 3 GLN A 47 ? GLY A 53 ? GLN A 47 GLY A 53 +A 4 VAL A 109 ? ILE A 114 ? VAL A 109 ILE A 114 +A 5 LEU A 4 ? VAL A 10 ? LEU A 4 VAL A 10 +A 6 HIS A 130 ? ILE A 138 ? HIS A 130 ILE A 138 +A 7 ILE A 175 ? ASN A 185 ? ILE A 175 ASN A 185 +A 8 LYS A 157 ? LEU A 158 ? LYS A 157 LEU A 158 +B 1 PHE A 88 ? SER A 90 ? PHE A 88 SER A 90 +B 2 ILE A 71 ? LEU A 75 ? ILE A 71 LEU A 75 +B 3 GLN A 47 ? GLY A 53 ? GLN A 47 GLY A 53 +B 4 VAL A 109 ? ILE A 114 ? VAL A 109 ILE A 114 +B 5 LEU A 4 ? VAL A 10 ? LEU A 4 VAL A 10 +B 6 HIS A 130 ? ILE A 138 ? HIS A 130 ILE A 138 +B 7 ILE A 175 ? ASN A 185 ? ILE A 175 ASN A 185 +B 8 GLN A 170 ? GLU A 172 ? GLN A 170 GLU A 172 +C 1 GLY A 15 ? GLY A 17 ? GLY A 15 GLY A 17 +C 2 THR A 146 ? PHE A 147 ? THR A 146 PHE A 147 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 N PHE A 88 ? N PHE A 88 O ASN A 72 ? O ASN A 72 +A 2 3 N ILE A 71 ? N ILE A 71 O ASN A 48 ? O ASN A 48 +A 3 4 O GLN A 47 ? O GLN A 47 N ASP A 110 ? N ASP A 110 +A 4 5 N ILE A 114 ? N ILE A 114 O ASN A 5 ? O ASN A 5 +A 5 6 N CYS A 6 ? N CYS A 6 O LYS A 132 ? O LYS A 132 +A 6 7 N ARG A 137 ? N ARG A 137 O LYS A 178 ? O LYS A 178 +A 7 8 O GLU A 183 ? O GLU A 183 N LYS A 157 ? N LYS A 157 +B 1 2 N PHE A 88 ? N PHE A 88 O ASN A 72 ? O ASN A 72 +B 2 3 N ILE A 71 ? N ILE A 71 O ASN A 48 ? O ASN A 48 +B 3 4 O GLN A 47 ? O GLN A 47 N ASP A 110 ? N ASP A 110 +B 4 5 N ILE A 114 ? N ILE A 114 O ASN A 5 ? O ASN A 5 +B 5 6 N CYS A 6 ? N CYS A 6 O LYS A 132 ? O LYS A 132 +B 6 7 N ARG A 137 ? N ARG A 137 O LYS A 178 ? O LYS A 178 +B 7 8 O TYR A 177 ? O TYR A 177 N GLN A 170 ? N GLN A 170 +C 1 2 N ILE A 16 ? N ILE A 16 O THR A 146 ? O THR A 146 +# +loop_ +_struct_site.id +_struct_site.pdbx_evidence_code +_struct_site.pdbx_auth_asym_id +_struct_site.pdbx_auth_comp_id +_struct_site.pdbx_auth_seq_id +_struct_site.pdbx_auth_ins_code +_struct_site.pdbx_num_residues +_struct_site.details +AC1 Software A SO4 613 ? 6 'BINDING SITE FOR RESIDUE SO4 A 613' +AC2 Software A SO4 614 ? 8 'BINDING SITE FOR RESIDUE SO4 A 614' +AC3 Software A FOL 187 ? 18 'BINDING SITE FOR RESIDUE FOL A 187' +# +loop_ +_struct_site_gen.id +_struct_site_gen.site_id +_struct_site_gen.pdbx_num_res +_struct_site_gen.label_comp_id +_struct_site_gen.label_asym_id +_struct_site_gen.label_seq_id +_struct_site_gen.pdbx_auth_ins_code +_struct_site_gen.auth_comp_id +_struct_site_gen.auth_asym_id +_struct_site_gen.auth_seq_id +_struct_site_gen.label_atom_id +_struct_site_gen.label_alt_id +_struct_site_gen.symmetry +_struct_site_gen.details +1 AC1 6 LYS A 54 ? LYS A 54 . ? 1_555 ? +2 AC1 6 SER A 76 ? SER A 76 . ? 1_555 ? +3 AC1 6 ARG A 77 ? ARG A 77 . ? 1_555 ? +4 AC1 6 GLU A 78 ? GLU A 78 . ? 1_555 ? +5 AC1 6 HOH E . ? HOH A 617 . ? 1_555 ? +6 AC1 6 HOH E . ? HOH A 669 . ? 1_555 ? +7 AC2 8 GLY A 53 ? GLY A 53 . ? 1_555 ? +8 AC2 8 LYS A 54 ? LYS A 54 . ? 1_555 ? +9 AC2 8 LYS A 55 ? LYS A 55 . ? 1_555 ? +10 AC2 8 THR A 56 ? THR A 56 . ? 1_555 ? +11 AC2 8 GLY A 116 ? GLY A 116 . ? 1_555 ? +12 AC2 8 GLY A 117 ? GLY A 117 . ? 1_555 ? +13 AC2 8 HOH E . ? HOH A 734 . ? 1_555 ? +14 AC2 8 HOH E . ? HOH A 751 . ? 6_555 ? +15 AC3 18 ILE A 7 ? ILE A 7 . ? 1_555 ? +16 AC3 18 VAL A 8 ? VAL A 8 . ? 1_555 ? +17 AC3 18 ALA A 9 ? ALA A 9 . ? 1_555 ? +18 AC3 18 GLU A 30 ? GLU A 30 . ? 1_555 ? +19 AC3 18 PHE A 31 ? PHE A 31 . ? 1_555 ? +20 AC3 18 PHE A 34 ? PHE A 34 . ? 1_555 ? +21 AC3 18 GLN A 35 ? GLN A 35 . ? 1_555 ? +22 AC3 18 ILE A 60 ? ILE A 60 . ? 1_555 ? +23 AC3 18 ASN A 64 ? ASN A 64 . ? 1_555 ? +24 AC3 18 ARG A 70 ? ARG A 70 . ? 1_555 ? +25 AC3 18 VAL A 115 ? VAL A 115 . ? 1_555 ? +26 AC3 18 TYR A 121 ? TYR A 121 . ? 1_555 ? +27 AC3 18 THR A 136 ? THR A 136 . ? 1_555 ? +28 AC3 18 HOH E . ? HOH A 647 . ? 1_555 ? +29 AC3 18 HOH E . ? HOH A 679 . ? 1_555 ? +30 AC3 18 HOH E . ? HOH A 696 . ? 1_555 ? +31 AC3 18 HOH E . ? HOH A 702 . ? 1_555 ? +32 AC3 18 HOH E . ? HOH A 726 . ? 1_555 ? +# +_pdbx_validate_symm_contact.id 1 +_pdbx_validate_symm_contact.PDB_model_num 1 +_pdbx_validate_symm_contact.auth_atom_id_1 O +_pdbx_validate_symm_contact.auth_asym_id_1 A +_pdbx_validate_symm_contact.auth_comp_id_1 HOH +_pdbx_validate_symm_contact.auth_seq_id_1 822 +_pdbx_validate_symm_contact.PDB_ins_code_1 ? +_pdbx_validate_symm_contact.label_alt_id_1 ? +_pdbx_validate_symm_contact.site_symmetry_1 1_555 +_pdbx_validate_symm_contact.auth_atom_id_2 O +_pdbx_validate_symm_contact.auth_asym_id_2 A +_pdbx_validate_symm_contact.auth_comp_id_2 HOH +_pdbx_validate_symm_contact.auth_seq_id_2 842 +_pdbx_validate_symm_contact.PDB_ins_code_2 ? +_pdbx_validate_symm_contact.label_alt_id_2 ? +_pdbx_validate_symm_contact.site_symmetry_2 6_555 +_pdbx_validate_symm_contact.dist 2.13 +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 CG A GLU 78 ? ? CD A GLU 78 ? ? OE1 A GLU 78 ? ? 130.81 118.30 12.51 2.00 N +2 1 NE A ARG 91 ? ? CZ A ARG 91 ? ? NH1 A ARG 91 ? ? 123.47 120.30 3.17 0.50 N +3 1 CA A GLU 123 ? ? CB A GLU 123 ? ? CG A GLU 123 ? ? 126.89 113.40 13.49 2.20 N +4 1 NE A ARG 137 ? ? CZ A ARG 137 ? ? NH1 A ARG 137 ? ? 124.24 120.30 3.94 0.50 N +5 1 CA A LEU 159 ? ? CB A LEU 159 ? ? CG A LEU 159 ? ? 134.71 115.30 19.41 2.30 N +6 1 CA A LEU 166 ? ? CB A LEU 166 ? ? CG A LEU 166 ? ? 132.58 115.30 17.28 2.30 N +7 1 CB A ASP 186 ? ? CG A ASP 186 ? ? OD1 A ASP 186 ? ? 124.96 118.30 6.66 0.90 N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 MET A 14 ? ? 78.98 30.98 +2 1 SER A 42 ? ? 179.15 -139.87 +3 1 VAL A 43 ? ? -36.74 145.61 +4 1 GLU A 44 ? ? 87.66 -8.79 +5 1 LYS A 46 ? ? -152.95 -33.21 +6 1 ARG A 65 ? ? -52.27 -73.64 +7 1 PRO A 103 ? ? -30.72 -72.53 +8 1 GLU A 104 ? ? -27.27 -41.91 +9 1 ASP A 110 ? ? -106.91 -90.53 +10 1 ASP A 145 ? ? -140.71 -12.50 +11 1 LYS A 155 ? ? -136.57 -33.12 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +FOL N1 N Y N 88 +FOL C2 C Y N 89 +FOL NA2 N N N 90 +FOL N3 N Y N 91 +FOL C4 C Y N 92 +FOL O4 O N N 93 +FOL C4A C Y N 94 +FOL N5 N Y N 95 +FOL C6 C Y N 96 +FOL C7 C Y N 97 +FOL N8 N Y N 98 +FOL C8A C Y N 99 +FOL C9 C N N 100 +FOL N10 N N N 101 +FOL C11 C Y N 102 +FOL C12 C Y N 103 +FOL C13 C Y N 104 +FOL C14 C Y N 105 +FOL C15 C Y N 106 +FOL C16 C Y N 107 +FOL C C N N 108 +FOL O O N N 109 +FOL N N N N 110 +FOL CA C N S 111 +FOL CB C N N 112 +FOL CG C N N 113 +FOL CD C N N 114 +FOL OE1 O N N 115 +FOL OE2 O N N 116 +FOL CT C N N 117 +FOL O1 O N N 118 +FOL O2 O N N 119 +FOL HN1 H N N 120 +FOL HN21 H N N 121 +FOL HN22 H N N 122 +FOL H7 H N N 123 +FOL H91 H N N 124 +FOL H92 H N N 125 +FOL HN0 H N N 126 +FOL H12 H N N 127 +FOL H13 H N N 128 +FOL H15 H N N 129 +FOL H16 H N N 130 +FOL HN H N N 131 +FOL HA H N N 132 +FOL HB1 H N N 133 +FOL HB2 H N N 134 +FOL HG1 H N N 135 +FOL HG2 H N N 136 +FOL HOE2 H N N 137 +FOL HO2 H N N 138 +GLN N N N N 139 +GLN CA C N S 140 +GLN C C N N 141 +GLN O O N N 142 +GLN CB C N N 143 +GLN CG C N N 144 +GLN CD C N N 145 +GLN OE1 O N N 146 +GLN NE2 N N N 147 +GLN OXT O N N 148 +GLN H H N N 149 +GLN H2 H N N 150 +GLN HA H N N 151 +GLN HB2 H N N 152 +GLN HB3 H N N 153 +GLN HG2 H N N 154 +GLN HG3 H N N 155 +GLN HE21 H N N 156 +GLN HE22 H N N 157 +GLN HXT H N N 158 +GLU N N N N 159 +GLU CA C N S 160 +GLU C C N N 161 +GLU O O N N 162 +GLU CB C N N 163 +GLU CG C N N 164 +GLU CD C N N 165 +GLU OE1 O N N 166 +GLU OE2 O N N 167 +GLU OXT O N N 168 +GLU H H N N 169 +GLU H2 H N N 170 +GLU HA H N N 171 +GLU HB2 H N N 172 +GLU HB3 H N N 173 +GLU HG2 H N N 174 +GLU HG3 H N N 175 +GLU HE2 H N N 176 +GLU HXT H N N 177 +GLY N N N N 178 +GLY CA C N N 179 +GLY C C N N 180 +GLY O O N N 181 +GLY OXT O N N 182 +GLY H H N N 183 +GLY H2 H N N 184 +GLY HA2 H N N 185 +GLY HA3 H N N 186 +GLY HXT H N N 187 +HIS N N N N 188 +HIS CA C N S 189 +HIS C C N N 190 +HIS O O N N 191 +HIS CB C N N 192 +HIS CG C Y N 193 +HIS ND1 N Y N 194 +HIS CD2 C Y N 195 +HIS CE1 C Y N 196 +HIS NE2 N Y N 197 +HIS OXT O N N 198 +HIS H H N N 199 +HIS H2 H N N 200 +HIS HA H N N 201 +HIS HB2 H N N 202 +HIS HB3 H N N 203 +HIS HD1 H N N 204 +HIS HD2 H N N 205 +HIS HE1 H N N 206 +HIS HE2 H N N 207 +HIS HXT H N N 208 +HOH O O N N 209 +HOH H1 H N N 210 +HOH H2 H N N 211 +ILE N N N N 212 +ILE CA C N S 213 +ILE C C N N 214 +ILE O O N N 215 +ILE CB C N S 216 +ILE CG1 C N N 217 +ILE CG2 C N N 218 +ILE CD1 C N N 219 +ILE OXT O N N 220 +ILE H H N N 221 +ILE H2 H N N 222 +ILE HA H N N 223 +ILE HB H N N 224 +ILE HG12 H N N 225 +ILE HG13 H N N 226 +ILE HG21 H N N 227 +ILE HG22 H N N 228 +ILE HG23 H N N 229 +ILE HD11 H N N 230 +ILE HD12 H N N 231 +ILE HD13 H N N 232 +ILE HXT H N N 233 +LEU N N N N 234 +LEU CA C N S 235 +LEU C C N N 236 +LEU O O N N 237 +LEU CB C N N 238 +LEU CG C N N 239 +LEU CD1 C N N 240 +LEU CD2 C N N 241 +LEU OXT O N N 242 +LEU H H N N 243 +LEU H2 H N N 244 +LEU HA H N N 245 +LEU HB2 H N N 246 +LEU HB3 H N N 247 +LEU HG H N N 248 +LEU HD11 H N N 249 +LEU HD12 H N N 250 +LEU HD13 H N N 251 +LEU HD21 H N N 252 +LEU HD22 H N N 253 +LEU HD23 H N N 254 +LEU HXT H N N 255 +LYS N N N N 256 +LYS CA C N S 257 +LYS C C N N 258 +LYS O O N N 259 +LYS CB C N N 260 +LYS CG C N N 261 +LYS CD C N N 262 +LYS CE C N N 263 +LYS NZ N N N 264 +LYS OXT O N N 265 +LYS H H N N 266 +LYS H2 H N N 267 +LYS HA H N N 268 +LYS HB2 H N N 269 +LYS HB3 H N N 270 +LYS HG2 H N N 271 +LYS HG3 H N N 272 +LYS HD2 H N N 273 +LYS HD3 H N N 274 +LYS HE2 H N N 275 +LYS HE3 H N N 276 +LYS HZ1 H N N 277 +LYS HZ2 H N N 278 +LYS HZ3 H N N 279 +LYS HXT H N N 280 +MET N N N N 281 +MET CA C N S 282 +MET C C N N 283 +MET O O N N 284 +MET CB C N N 285 +MET CG C N N 286 +MET SD S N N 287 +MET CE C N N 288 +MET OXT O N N 289 +MET H H N N 290 +MET H2 H N N 291 +MET HA H N N 292 +MET HB2 H N N 293 +MET HB3 H N N 294 +MET HG2 H N N 295 +MET HG3 H N N 296 +MET HE1 H N N 297 +MET HE2 H N N 298 +MET HE3 H N N 299 +MET HXT H N N 300 +PHE N N N N 301 +PHE CA C N S 302 +PHE C C N N 303 +PHE O O N N 304 +PHE CB C N N 305 +PHE CG C Y N 306 +PHE CD1 C Y N 307 +PHE CD2 C Y N 308 +PHE CE1 C Y N 309 +PHE CE2 C Y N 310 +PHE CZ C Y N 311 +PHE OXT O N N 312 +PHE H H N N 313 +PHE H2 H N N 314 +PHE HA H N N 315 +PHE HB2 H N N 316 +PHE HB3 H N N 317 +PHE HD1 H N N 318 +PHE HD2 H N N 319 +PHE HE1 H N N 320 +PHE HE2 H N N 321 +PHE HZ H N N 322 +PHE HXT H N N 323 +PRO N N N N 324 +PRO CA C N S 325 +PRO C C N N 326 +PRO O O N N 327 +PRO CB C N N 328 +PRO CG C N N 329 +PRO CD C N N 330 +PRO OXT O N N 331 +PRO H H N N 332 +PRO HA H N N 333 +PRO HB2 H N N 334 +PRO HB3 H N N 335 +PRO HG2 H N N 336 +PRO HG3 H N N 337 +PRO HD2 H N N 338 +PRO HD3 H N N 339 +PRO HXT H N N 340 +SER N N N N 341 +SER CA C N S 342 +SER C C N N 343 +SER O O N N 344 +SER CB C N N 345 +SER OG O N N 346 +SER OXT O N N 347 +SER H H N N 348 +SER H2 H N N 349 +SER HA H N N 350 +SER HB2 H N N 351 +SER HB3 H N N 352 +SER HG H N N 353 +SER HXT H N N 354 +SO4 S S N N 355 +SO4 O1 O N N 356 +SO4 O2 O N N 357 +SO4 O3 O N N 358 +SO4 O4 O N N 359 +THR N N N N 360 +THR CA C N S 361 +THR C C N N 362 +THR O O N N 363 +THR CB C N R 364 +THR OG1 O N N 365 +THR CG2 C N N 366 +THR OXT O N N 367 +THR H H N N 368 +THR H2 H N N 369 +THR HA H N N 370 +THR HB H N N 371 +THR HG1 H N N 372 +THR HG21 H N N 373 +THR HG22 H N N 374 +THR HG23 H N N 375 +THR HXT H N N 376 +TRP N N N N 377 +TRP CA C N S 378 +TRP C C N N 379 +TRP O O N N 380 +TRP CB C N N 381 +TRP CG C Y N 382 +TRP CD1 C Y N 383 +TRP CD2 C Y N 384 +TRP NE1 N Y N 385 +TRP CE2 C Y N 386 +TRP CE3 C Y N 387 +TRP CZ2 C Y N 388 +TRP CZ3 C Y N 389 +TRP CH2 C Y N 390 +TRP OXT O N N 391 +TRP H H N N 392 +TRP H2 H N N 393 +TRP HA H N N 394 +TRP HB2 H N N 395 +TRP HB3 H N N 396 +TRP HD1 H N N 397 +TRP HE1 H N N 398 +TRP HE3 H N N 399 +TRP HZ2 H N N 400 +TRP HZ3 H N N 401 +TRP HH2 H N N 402 +TRP HXT H N N 403 +TYR N N N N 404 +TYR CA C N S 405 +TYR C C N N 406 +TYR O O N N 407 +TYR CB C N N 408 +TYR CG C Y N 409 +TYR CD1 C Y N 410 +TYR CD2 C Y N 411 +TYR CE1 C Y N 412 +TYR CE2 C Y N 413 +TYR CZ C Y N 414 +TYR OH O N N 415 +TYR OXT O N N 416 +TYR H H N N 417 +TYR H2 H N N 418 +TYR HA H N N 419 +TYR HB2 H N N 420 +TYR HB3 H N N 421 +TYR HD1 H N N 422 +TYR HD2 H N N 423 +TYR HE1 H N N 424 +TYR HE2 H N N 425 +TYR HH H N N 426 +TYR HXT H N N 427 +VAL N N N N 428 +VAL CA C N S 429 +VAL C C N N 430 +VAL O O N N 431 +VAL CB C N N 432 +VAL CG1 C N N 433 +VAL CG2 C N N 434 +VAL OXT O N N 435 +VAL H H N N 436 +VAL H2 H N N 437 +VAL HA H N N 438 +VAL HB H N N 439 +VAL HG11 H N N 440 +VAL HG12 H N N 441 +VAL HG13 H N N 442 +VAL HG21 H N N 443 +VAL HG22 H N N 444 +VAL HG23 H N N 445 +VAL HXT H N N 446 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +FOL N1 C2 sing Y N 83 +FOL N1 C8A sing Y N 84 +FOL N1 HN1 sing N N 85 +FOL C2 NA2 sing N N 86 +FOL C2 N3 doub Y N 87 +FOL NA2 HN21 sing N N 88 +FOL NA2 HN22 sing N N 89 +FOL N3 C4 sing Y N 90 +FOL C4 O4 doub N N 91 +FOL C4 C4A sing Y N 92 +FOL C4A N5 sing Y N 93 +FOL C4A C8A doub Y N 94 +FOL N5 C6 doub Y N 95 +FOL C6 C7 sing Y N 96 +FOL C6 C9 sing N N 97 +FOL C7 N8 doub Y N 98 +FOL C7 H7 sing N N 99 +FOL N8 C8A sing Y N 100 +FOL C9 N10 sing N N 101 +FOL C9 H91 sing N N 102 +FOL C9 H92 sing N N 103 +FOL N10 C14 sing N N 104 +FOL N10 HN0 sing N N 105 +FOL C11 C12 doub Y N 106 +FOL C11 C16 sing Y N 107 +FOL C11 C sing N N 108 +FOL C12 C13 sing Y N 109 +FOL C12 H12 sing N N 110 +FOL C13 C14 doub Y N 111 +FOL C13 H13 sing N N 112 +FOL C14 C15 sing Y N 113 +FOL C15 C16 doub Y N 114 +FOL C15 H15 sing N N 115 +FOL C16 H16 sing N N 116 +FOL C O doub N N 117 +FOL C N sing N N 118 +FOL N CA sing N N 119 +FOL N HN sing N N 120 +FOL CA CB sing N N 121 +FOL CA CT sing N N 122 +FOL CA HA sing N N 123 +FOL CB CG sing N N 124 +FOL CB HB1 sing N N 125 +FOL CB HB2 sing N N 126 +FOL CG CD sing N N 127 +FOL CG HG1 sing N N 128 +FOL CG HG2 sing N N 129 +FOL CD OE1 doub N N 130 +FOL CD OE2 sing N N 131 +FOL OE2 HOE2 sing N N 132 +FOL CT O1 doub N N 133 +FOL CT O2 sing N N 134 +FOL O2 HO2 sing N N 135 +GLN N CA sing N N 136 +GLN N H sing N N 137 +GLN N H2 sing N N 138 +GLN CA C sing N N 139 +GLN CA CB sing N N 140 +GLN CA HA sing N N 141 +GLN C O doub N N 142 +GLN C OXT sing N N 143 +GLN CB CG sing N N 144 +GLN CB HB2 sing N N 145 +GLN CB HB3 sing N N 146 +GLN CG CD sing N N 147 +GLN CG HG2 sing N N 148 +GLN CG HG3 sing N N 149 +GLN CD OE1 doub N N 150 +GLN CD NE2 sing N N 151 +GLN NE2 HE21 sing N N 152 +GLN NE2 HE22 sing N N 153 +GLN OXT HXT sing N N 154 +GLU N CA sing N N 155 +GLU N H sing N N 156 +GLU N H2 sing N N 157 +GLU CA C sing N N 158 +GLU CA CB sing N N 159 +GLU CA HA sing N N 160 +GLU C O doub N N 161 +GLU C OXT sing N N 162 +GLU CB CG sing N N 163 +GLU CB HB2 sing N N 164 +GLU CB HB3 sing N N 165 +GLU CG CD sing N N 166 +GLU CG HG2 sing N N 167 +GLU CG HG3 sing N N 168 +GLU CD OE1 doub N N 169 +GLU CD OE2 sing N N 170 +GLU OE2 HE2 sing N N 171 +GLU OXT HXT sing N N 172 +GLY N CA sing N N 173 +GLY N H sing N N 174 +GLY N H2 sing N N 175 +GLY CA C sing N N 176 +GLY CA HA2 sing N N 177 +GLY CA HA3 sing N N 178 +GLY C O doub N N 179 +GLY C OXT sing N N 180 +GLY OXT HXT sing N N 181 +HIS N CA sing N N 182 +HIS N H sing N N 183 +HIS N H2 sing N N 184 +HIS CA C sing N N 185 +HIS CA CB sing N N 186 +HIS CA HA sing N N 187 +HIS C O doub N N 188 +HIS C OXT sing N N 189 +HIS CB CG sing N N 190 +HIS CB HB2 sing N N 191 +HIS CB HB3 sing N N 192 +HIS CG ND1 sing Y N 193 +HIS CG CD2 doub Y N 194 +HIS ND1 CE1 doub Y N 195 +HIS ND1 HD1 sing N N 196 +HIS CD2 NE2 sing Y N 197 +HIS CD2 HD2 sing N N 198 +HIS CE1 NE2 sing Y N 199 +HIS CE1 HE1 sing N N 200 +HIS NE2 HE2 sing N N 201 +HIS OXT HXT sing N N 202 +HOH O H1 sing N N 203 +HOH O H2 sing N N 204 +ILE N CA sing N N 205 +ILE N H sing N N 206 +ILE N H2 sing N N 207 +ILE CA C sing N N 208 +ILE CA CB sing N N 209 +ILE CA HA sing N N 210 +ILE C O doub N N 211 +ILE C OXT sing N N 212 +ILE CB CG1 sing N N 213 +ILE CB CG2 sing N N 214 +ILE CB HB sing N N 215 +ILE CG1 CD1 sing N N 216 +ILE CG1 HG12 sing N N 217 +ILE CG1 HG13 sing N N 218 +ILE CG2 HG21 sing N N 219 +ILE CG2 HG22 sing N N 220 +ILE CG2 HG23 sing N N 221 +ILE CD1 HD11 sing N N 222 +ILE CD1 HD12 sing N N 223 +ILE CD1 HD13 sing N N 224 +ILE OXT HXT sing N N 225 +LEU N CA sing N N 226 +LEU N H sing N N 227 +LEU N H2 sing N N 228 +LEU CA C sing N N 229 +LEU CA CB sing N N 230 +LEU CA HA sing N N 231 +LEU C O doub N N 232 +LEU C OXT sing N N 233 +LEU CB CG sing N N 234 +LEU CB HB2 sing N N 235 +LEU CB HB3 sing N N 236 +LEU CG CD1 sing N N 237 +LEU CG CD2 sing N N 238 +LEU CG HG sing N N 239 +LEU CD1 HD11 sing N N 240 +LEU CD1 HD12 sing N N 241 +LEU CD1 HD13 sing N N 242 +LEU CD2 HD21 sing N N 243 +LEU CD2 HD22 sing N N 244 +LEU CD2 HD23 sing N N 245 +LEU OXT HXT sing N N 246 +LYS N CA sing N N 247 +LYS N H sing N N 248 +LYS N H2 sing N N 249 +LYS CA C sing N N 250 +LYS CA CB sing N N 251 +LYS CA HA sing N N 252 +LYS C O doub N N 253 +LYS C OXT sing N N 254 +LYS CB CG sing N N 255 +LYS CB HB2 sing N N 256 +LYS CB HB3 sing N N 257 +LYS CG CD sing N N 258 +LYS CG HG2 sing N N 259 +LYS CG HG3 sing N N 260 +LYS CD CE sing N N 261 +LYS CD HD2 sing N N 262 +LYS CD HD3 sing N N 263 +LYS CE NZ sing N N 264 +LYS CE HE2 sing N N 265 +LYS CE HE3 sing N N 266 +LYS NZ HZ1 sing N N 267 +LYS NZ HZ2 sing N N 268 +LYS NZ HZ3 sing N N 269 +LYS OXT HXT sing N N 270 +MET N CA sing N N 271 +MET N H sing N N 272 +MET N H2 sing N N 273 +MET CA C sing N N 274 +MET CA CB sing N N 275 +MET CA HA sing N N 276 +MET C O doub N N 277 +MET C OXT sing N N 278 +MET CB CG sing N N 279 +MET CB HB2 sing N N 280 +MET CB HB3 sing N N 281 +MET CG SD sing N N 282 +MET CG HG2 sing N N 283 +MET CG HG3 sing N N 284 +MET SD CE sing N N 285 +MET CE HE1 sing N N 286 +MET CE HE2 sing N N 287 +MET CE HE3 sing N N 288 +MET OXT HXT sing N N 289 +PHE N CA sing N N 290 +PHE N H sing N N 291 +PHE N H2 sing N N 292 +PHE CA C sing N N 293 +PHE CA CB sing N N 294 +PHE CA HA sing N N 295 +PHE C O doub N N 296 +PHE C OXT sing N N 297 +PHE CB CG sing N N 298 +PHE CB HB2 sing N N 299 +PHE CB HB3 sing N N 300 +PHE CG CD1 doub Y N 301 +PHE CG CD2 sing Y N 302 +PHE CD1 CE1 sing Y N 303 +PHE CD1 HD1 sing N N 304 +PHE CD2 CE2 doub Y N 305 +PHE CD2 HD2 sing N N 306 +PHE CE1 CZ doub Y N 307 +PHE CE1 HE1 sing N N 308 +PHE CE2 CZ sing Y N 309 +PHE CE2 HE2 sing N N 310 +PHE CZ HZ sing N N 311 +PHE OXT HXT sing N N 312 +PRO N CA sing N N 313 +PRO N CD sing N N 314 +PRO N H sing N N 315 +PRO CA C sing N N 316 +PRO CA CB sing N N 317 +PRO CA HA sing N N 318 +PRO C O doub N N 319 +PRO C OXT sing N N 320 +PRO CB CG sing N N 321 +PRO CB HB2 sing N N 322 +PRO CB HB3 sing N N 323 +PRO CG CD sing N N 324 +PRO CG HG2 sing N N 325 +PRO CG HG3 sing N N 326 +PRO CD HD2 sing N N 327 +PRO CD HD3 sing N N 328 +PRO OXT HXT sing N N 329 +SER N CA sing N N 330 +SER N H sing N N 331 +SER N H2 sing N N 332 +SER CA C sing N N 333 +SER CA CB sing N N 334 +SER CA HA sing N N 335 +SER C O doub N N 336 +SER C OXT sing N N 337 +SER CB OG sing N N 338 +SER CB HB2 sing N N 339 +SER CB HB3 sing N N 340 +SER OG HG sing N N 341 +SER OXT HXT sing N N 342 +SO4 S O1 doub N N 343 +SO4 S O2 doub N N 344 +SO4 S O3 sing N N 345 +SO4 S O4 sing N N 346 +THR N CA sing N N 347 +THR N H sing N N 348 +THR N H2 sing N N 349 +THR CA C sing N N 350 +THR CA CB sing N N 351 +THR CA HA sing N N 352 +THR C O doub N N 353 +THR C OXT sing N N 354 +THR CB OG1 sing N N 355 +THR CB CG2 sing N N 356 +THR CB HB sing N N 357 +THR OG1 HG1 sing N N 358 +THR CG2 HG21 sing N N 359 +THR CG2 HG22 sing N N 360 +THR CG2 HG23 sing N N 361 +THR OXT HXT sing N N 362 +TRP N CA sing N N 363 +TRP N H sing N N 364 +TRP N H2 sing N N 365 +TRP CA C sing N N 366 +TRP CA CB sing N N 367 +TRP CA HA sing N N 368 +TRP C O doub N N 369 +TRP C OXT sing N N 370 +TRP CB CG sing N N 371 +TRP CB HB2 sing N N 372 +TRP CB HB3 sing N N 373 +TRP CG CD1 doub Y N 374 +TRP CG CD2 sing Y N 375 +TRP CD1 NE1 sing Y N 376 +TRP CD1 HD1 sing N N 377 +TRP CD2 CE2 doub Y N 378 +TRP CD2 CE3 sing Y N 379 +TRP NE1 CE2 sing Y N 380 +TRP NE1 HE1 sing N N 381 +TRP CE2 CZ2 sing Y N 382 +TRP CE3 CZ3 doub Y N 383 +TRP CE3 HE3 sing N N 384 +TRP CZ2 CH2 doub Y N 385 +TRP CZ2 HZ2 sing N N 386 +TRP CZ3 CH2 sing Y N 387 +TRP CZ3 HZ3 sing N N 388 +TRP CH2 HH2 sing N N 389 +TRP OXT HXT sing N N 390 +TYR N CA sing N N 391 +TYR N H sing N N 392 +TYR N H2 sing N N 393 +TYR CA C sing N N 394 +TYR CA CB sing N N 395 +TYR CA HA sing N N 396 +TYR C O doub N N 397 +TYR C OXT sing N N 398 +TYR CB CG sing N N 399 +TYR CB HB2 sing N N 400 +TYR CB HB3 sing N N 401 +TYR CG CD1 doub Y N 402 +TYR CG CD2 sing Y N 403 +TYR CD1 CE1 sing Y N 404 +TYR CD1 HD1 sing N N 405 +TYR CD2 CE2 doub Y N 406 +TYR CD2 HD2 sing N N 407 +TYR CE1 CZ doub Y N 408 +TYR CE1 HE1 sing N N 409 +TYR CE2 CZ sing Y N 410 +TYR CE2 HE2 sing N N 411 +TYR CZ OH sing N N 412 +TYR OH HH sing N N 413 +TYR OXT HXT sing N N 414 +VAL N CA sing N N 415 +VAL N H sing N N 416 +VAL N H2 sing N N 417 +VAL CA C sing N N 418 +VAL CA CB sing N N 419 +VAL CA HA sing N N 420 +VAL C O doub N N 421 +VAL C OXT sing N N 422 +VAL CB CG1 sing N N 423 +VAL CB CG2 sing N N 424 +VAL CB HB sing N N 425 +VAL CG1 HG11 sing N N 426 +VAL CG1 HG12 sing N N 427 +VAL CG1 HG13 sing N N 428 +VAL CG2 HG21 sing N N 429 +VAL CG2 HG22 sing N N 430 +VAL CG2 HG23 sing N N 431 +VAL OXT HXT sing N N 432 +# +_atom_sites.entry_id 1DRF +_atom_sites.fract_transf_matrix[1][1] 0.011589 +_atom_sites.fract_transf_matrix[1][2] 0.006691 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.013382 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.012990 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . VAL A 1 1 ? 7.644 22.951 1.872 1.00 25.83 ? 1 VAL A N 1 +ATOM 2 C CA . VAL A 1 1 ? 8.781 22.140 1.435 1.00 26.47 ? 1 VAL A CA 1 +ATOM 3 C C . VAL A 1 1 ? 8.364 21.308 0.211 1.00 25.44 ? 1 VAL A C 1 +ATOM 4 O O . VAL A 1 1 ? 7.314 20.660 0.197 1.00 23.04 ? 1 VAL A O 1 +ATOM 5 C CB . VAL A 1 1 ? 9.268 21.248 2.599 1.00 27.03 ? 1 VAL A CB 1 +ATOM 6 C CG1 . VAL A 1 1 ? 8.114 20.409 3.161 1.00 28.60 ? 1 VAL A CG1 1 +ATOM 7 C CG2 . VAL A 1 1 ? 10.418 20.359 2.196 1.00 27.00 ? 1 VAL A CG2 1 +ATOM 8 N N . GLY A 1 2 ? 9.251 21.327 -0.777 1.00 23.81 ? 2 GLY A N 1 +ATOM 9 C CA . GLY A 1 2 ? 9.069 20.630 -2.026 1.00 20.90 ? 2 GLY A CA 1 +ATOM 10 C C . GLY A 1 2 ? 9.350 19.137 -1.926 1.00 20.43 ? 2 GLY A C 1 +ATOM 11 O O . GLY A 1 2 ? 8.757 18.353 -1.176 1.00 19.23 ? 2 GLY A O 1 +ATOM 12 N N . SER A 1 3 ? 10.288 18.734 -2.759 1.00 18.78 ? 3 SER A N 1 +ATOM 13 C CA . SER A 1 3 ? 10.755 17.423 -3.029 1.00 18.52 ? 3 SER A CA 1 +ATOM 14 C C . SER A 1 3 ? 11.798 16.868 -2.089 1.00 15.33 ? 3 SER A C 1 +ATOM 15 O O . SER A 1 3 ? 12.731 17.570 -1.653 1.00 16.78 ? 3 SER A O 1 +ATOM 16 C CB . SER A 1 3 ? 11.448 17.516 -4.481 1.00 18.37 ? 3 SER A CB 1 +ATOM 17 O OG . SER A 1 3 ? 11.833 18.938 -4.511 1.00 24.30 ? 3 SER A OG 1 +ATOM 18 N N . LEU A 1 4 ? 11.671 15.588 -1.846 1.00 12.66 ? 4 LEU A N 1 +ATOM 19 C CA . LEU A 1 4 ? 12.542 14.748 -1.033 1.00 11.41 ? 4 LEU A CA 1 +ATOM 20 C C . LEU A 1 4 ? 13.421 13.912 -1.984 1.00 9.76 ? 4 LEU A C 1 +ATOM 21 O O . LEU A 1 4 ? 12.888 13.151 -2.811 1.00 5.23 ? 4 LEU A O 1 +ATOM 22 C CB . LEU A 1 4 ? 11.616 13.866 -0.167 1.00 13.90 ? 4 LEU A CB 1 +ATOM 23 C CG . LEU A 1 4 ? 12.157 13.458 1.198 1.00 15.04 ? 4 LEU A CG 1 +ATOM 24 C CD1 . LEU A 1 4 ? 11.494 14.232 2.296 1.00 18.41 ? 4 LEU A CD1 1 +ATOM 25 C CD2 . LEU A 1 4 ? 11.904 11.992 1.394 1.00 15.13 ? 4 LEU A CD2 1 +ATOM 26 N N . ASN A 1 5 ? 14.704 14.137 -1.911 1.00 7.09 ? 5 ASN A N 1 +ATOM 27 C CA . ASN A 1 5 ? 15.692 13.487 -2.760 1.00 9.16 ? 5 ASN A CA 1 +ATOM 28 C C . ASN A 1 5 ? 16.872 12.971 -1.892 1.00 11.54 ? 5 ASN A C 1 +ATOM 29 O O . ASN A 1 5 ? 17.187 13.526 -0.862 1.00 6.30 ? 5 ASN A O 1 +ATOM 30 C CB . ASN A 1 5 ? 16.265 14.477 -3.804 1.00 7.06 ? 5 ASN A CB 1 +ATOM 31 C CG . ASN A 1 5 ? 15.305 15.467 -4.359 1.00 9.49 ? 5 ASN A CG 1 +ATOM 32 O OD1 . ASN A 1 5 ? 14.624 15.206 -5.369 1.00 5.92 ? 5 ASN A OD1 1 +ATOM 33 N ND2 . ASN A 1 5 ? 15.199 16.656 -3.759 1.00 9.22 ? 5 ASN A ND2 1 +ATOM 34 N N . CYS A 1 6 ? 17.516 11.981 -2.486 1.00 11.36 ? 6 CYS A N 1 +ATOM 35 C CA . CYS A 1 6 ? 18.743 11.388 -1.988 1.00 11.37 ? 6 CYS A CA 1 +ATOM 36 C C . CYS A 1 6 ? 19.765 11.510 -3.168 1.00 11.19 ? 6 CYS A C 1 +ATOM 37 O O . CYS A 1 6 ? 19.348 11.299 -4.312 1.00 9.32 ? 6 CYS A O 1 +ATOM 38 C CB . CYS A 1 6 ? 18.632 9.913 -1.649 1.00 11.12 ? 6 CYS A CB 1 +ATOM 39 S SG . CYS A 1 6 ? 17.400 9.434 -0.482 1.00 15.12 ? 6 CYS A SG 1 +ATOM 40 N N . ILE A 1 7 ? 20.962 11.816 -2.784 1.00 12.46 ? 7 ILE A N 1 +ATOM 41 C CA . ILE A 1 7 ? 22.081 11.882 -3.777 1.00 9.95 ? 7 ILE A CA 1 +ATOM 42 C C . ILE A 1 7 ? 23.188 10.985 -3.218 1.00 10.81 ? 7 ILE A C 1 +ATOM 43 O O . ILE A 1 7 ? 23.341 10.898 -1.989 1.00 8.77 ? 7 ILE A O 1 +ATOM 44 C CB . ILE A 1 7 ? 22.518 13.332 -4.053 1.00 9.65 ? 7 ILE A CB 1 +ATOM 45 C CG1 . ILE A 1 7 ? 23.644 13.361 -5.129 1.00 2.43 ? 7 ILE A CG1 1 +ATOM 46 C CG2 . ILE A 1 7 ? 22.970 14.088 -2.755 1.00 5.82 ? 7 ILE A CG2 1 +ATOM 47 C CD1 . ILE A 1 7 ? 23.553 14.484 -6.162 1.00 2.88 ? 7 ILE A CD1 1 +ATOM 48 N N . VAL A 1 8 ? 23.867 10.319 -4.125 1.00 9.73 ? 8 VAL A N 1 +ATOM 49 C CA . VAL A 1 8 ? 24.964 9.408 -3.741 1.00 8.97 ? 8 VAL A CA 1 +ATOM 50 C C . VAL A 1 8 ? 25.904 9.208 -4.951 1.00 7.60 ? 8 VAL A C 1 +ATOM 51 O O . VAL A 1 8 ? 25.525 9.413 -6.098 1.00 4.59 ? 8 VAL A O 1 +ATOM 52 C CB . VAL A 1 8 ? 24.369 8.084 -3.241 1.00 9.41 ? 8 VAL A CB 1 +ATOM 53 C CG1 . VAL A 1 8 ? 23.762 7.267 -4.385 1.00 9.67 ? 8 VAL A CG1 1 +ATOM 54 C CG2 . VAL A 1 8 ? 25.387 7.236 -2.480 1.00 9.41 ? 8 VAL A CG2 1 +ATOM 55 N N . ALA A 1 9 ? 27.104 8.857 -4.603 1.00 5.02 ? 9 ALA A N 1 +ATOM 56 C CA . ALA A 1 9 ? 28.169 8.497 -5.577 1.00 6.28 ? 9 ALA A CA 1 +ATOM 57 C C . ALA A 1 9 ? 28.605 7.101 -5.066 1.00 8.02 ? 9 ALA A C 1 +ATOM 58 O O . ALA A 1 9 ? 28.911 7.016 -3.853 1.00 8.01 ? 9 ALA A O 1 +ATOM 59 C CB . ALA A 1 9 ? 29.252 9.487 -5.652 1.00 1.83 ? 9 ALA A CB 1 +ATOM 60 N N . VAL A 1 10 ? 28.399 6.114 -5.887 1.00 8.48 ? 10 VAL A N 1 +ATOM 61 C CA . VAL A 1 10 ? 28.699 4.718 -5.543 1.00 11.75 ? 10 VAL A CA 1 +ATOM 62 C C . VAL A 1 10 ? 29.679 4.124 -6.562 1.00 13.41 ? 10 VAL A C 1 +ATOM 63 O O . VAL A 1 10 ? 29.597 4.427 -7.771 1.00 13.42 ? 10 VAL A O 1 +ATOM 64 C CB . VAL A 1 10 ? 27.396 3.872 -5.514 1.00 13.42 ? 10 VAL A CB 1 +ATOM 65 C CG1 . VAL A 1 10 ? 26.632 3.949 -4.228 1.00 13.15 ? 10 VAL A CG1 1 +ATOM 66 C CG2 . VAL A 1 10 ? 26.509 4.205 -6.713 1.00 14.93 ? 10 VAL A CG2 1 +ATOM 67 N N . SER A 1 11 ? 30.523 3.262 -6.051 1.00 13.13 ? 11 SER A N 1 +ATOM 68 C CA . SER A 1 11 ? 31.490 2.515 -6.892 1.00 14.15 ? 11 SER A CA 1 +ATOM 69 C C . SER A 1 11 ? 30.795 1.186 -7.256 1.00 15.14 ? 11 SER A C 1 +ATOM 70 O O . SER A 1 11 ? 29.695 0.908 -6.763 1.00 12.18 ? 11 SER A O 1 +ATOM 71 C CB . SER A 1 11 ? 32.790 2.261 -6.169 1.00 13.49 ? 11 SER A CB 1 +ATOM 72 O OG . SER A 1 11 ? 32.570 1.299 -5.120 1.00 13.90 ? 11 SER A OG 1 +ATOM 73 N N . GLN A 1 12 ? 31.472 0.420 -8.066 1.00 16.25 ? 12 GLN A N 1 +ATOM 74 C CA . GLN A 1 12 ? 31.048 -0.859 -8.571 1.00 17.12 ? 12 GLN A CA 1 +ATOM 75 C C . GLN A 1 12 ? 30.605 -1.846 -7.532 1.00 17.68 ? 12 GLN A C 1 +ATOM 76 O O . GLN A 1 12 ? 29.635 -2.616 -7.774 1.00 17.44 ? 12 GLN A O 1 +ATOM 77 N N . ASN A 1 13 ? 31.289 -1.872 -6.407 1.00 18.83 ? 13 ASN A N 1 +ATOM 78 C CA . ASN A 1 13 ? 30.994 -2.760 -5.284 1.00 16.68 ? 13 ASN A CA 1 +ATOM 79 C C . ASN A 1 13 ? 29.912 -2.143 -4.382 1.00 17.86 ? 13 ASN A C 1 +ATOM 80 O O . ASN A 1 13 ? 29.541 -2.767 -3.374 1.00 19.15 ? 13 ASN A O 1 +ATOM 81 C CB . ASN A 1 13 ? 32.225 -3.173 -4.499 1.00 17.72 ? 13 ASN A CB 1 +ATOM 82 C CG . ASN A 1 13 ? 33.417 -2.289 -4.541 1.00 17.21 ? 13 ASN A CG 1 +ATOM 83 O OD1 . ASN A 1 13 ? 33.459 -1.185 -5.072 1.00 15.63 ? 13 ASN A OD1 1 +ATOM 84 N ND2 . ASN A 1 13 ? 34.539 -2.780 -3.927 1.00 20.12 ? 13 ASN A ND2 1 +ATOM 85 N N . MET A 1 14 ? 29.474 -0.963 -4.749 1.00 17.35 ? 14 MET A N 1 +ATOM 86 C CA . MET A 1 14 ? 28.436 -0.233 -4.009 1.00 15.94 ? 14 MET A CA 1 +ATOM 87 C C . MET A 1 14 ? 29.011 0.445 -2.773 1.00 15.01 ? 14 MET A C 1 +ATOM 88 O O . MET A 1 14 ? 28.271 0.609 -1.759 1.00 15.43 ? 14 MET A O 1 +ATOM 89 C CB . MET A 1 14 ? 27.298 -1.197 -3.633 1.00 17.33 ? 14 MET A CB 1 +ATOM 90 C CG . MET A 1 14 ? 26.866 -1.984 -4.870 1.00 17.41 ? 14 MET A CG 1 +ATOM 91 S SD . MET A 1 14 ? 25.814 -0.891 -5.856 1.00 19.38 ? 14 MET A SD 1 +ATOM 92 C CE . MET A 1 14 ? 24.368 -0.751 -4.804 1.00 15.43 ? 14 MET A CE 1 +ATOM 93 N N . GLY A 1 15 ? 30.245 0.838 -2.839 1.00 12.04 ? 15 GLY A N 1 +ATOM 94 C CA . GLY A 1 15 ? 30.957 1.513 -1.748 1.00 10.34 ? 15 GLY A CA 1 +ATOM 95 C C . GLY A 1 15 ? 30.782 3.012 -1.821 1.00 11.23 ? 15 GLY A C 1 +ATOM 96 O O . GLY A 1 15 ? 30.835 3.614 -2.917 1.00 11.57 ? 15 GLY A O 1 +ATOM 97 N N . ILE A 1 16 ? 30.583 3.611 -0.650 1.00 8.53 ? 16 ILE A N 1 +ATOM 98 C CA . ILE A 1 16 ? 30.383 5.066 -0.542 1.00 8.35 ? 16 ILE A CA 1 +ATOM 99 C C . ILE A 1 16 ? 31.425 5.748 0.292 1.00 7.60 ? 16 ILE A C 1 +ATOM 100 O O . ILE A 1 16 ? 31.591 7.005 0.160 1.00 11.28 ? 16 ILE A O 1 +ATOM 101 C CB . ILE A 1 16 ? 28.904 5.382 -0.162 1.00 9.70 ? 16 ILE A CB 1 +ATOM 102 C CG1 . ILE A 1 16 ? 28.605 4.944 1.296 1.00 3.81 ? 16 ILE A CG1 1 +ATOM 103 C CG2 . ILE A 1 16 ? 27.877 4.750 -1.143 1.00 6.72 ? 16 ILE A CG2 1 +ATOM 104 C CD1 . ILE A 1 16 ? 27.413 5.713 1.940 1.00 6.19 ? 16 ILE A CD1 1 +ATOM 105 N N . GLY A 1 17 ? 32.188 5.014 1.077 1.00 7.69 ? 17 GLY A N 1 +ATOM 106 C CA . GLY A 1 17 ? 33.234 5.587 1.933 1.00 2.98 ? 17 GLY A CA 1 +ATOM 107 C C . GLY A 1 17 ? 34.268 4.569 2.364 1.00 2.99 ? 17 GLY A C 1 +ATOM 108 O O . GLY A 1 17 ? 34.028 3.356 2.410 1.00 1.72 ? 17 GLY A O 1 +ATOM 109 N N . LYS A 1 18 ? 35.437 5.090 2.701 1.00 8.97 ? 18 LYS A N 1 +ATOM 110 C CA . LYS A 1 18 ? 36.585 4.327 3.177 1.00 11.90 ? 18 LYS A CA 1 +ATOM 111 C C . LYS A 1 18 ? 37.304 5.152 4.264 1.00 11.26 ? 18 LYS A C 1 +ATOM 112 O O . LYS A 1 18 ? 37.971 6.138 3.960 1.00 12.34 ? 18 LYS A O 1 +ATOM 113 C CB . LYS A 1 18 ? 37.564 3.994 2.069 1.00 11.91 ? 18 LYS A CB 1 +ATOM 114 C CG . LYS A 1 18 ? 38.276 2.656 2.203 1.00 15.26 ? 18 LYS A CG 1 +ATOM 115 C CD . LYS A 1 18 ? 39.756 2.800 2.500 1.00 16.50 ? 18 LYS A CD 1 +ATOM 116 C CE . LYS A 1 18 ? 40.456 3.740 1.558 1.00 17.96 ? 18 LYS A CE 1 +ATOM 117 N NZ . LYS A 1 18 ? 41.468 3.037 0.724 1.00 20.59 ? 18 LYS A NZ 1 +ATOM 118 N N . ASN A 1 19 ? 37.112 4.715 5.491 1.00 12.43 ? 19 ASN A N 1 +ATOM 119 C CA . ASN A 1 19 ? 37.696 5.355 6.675 1.00 12.52 ? 19 ASN A CA 1 +ATOM 120 C C . ASN A 1 19 ? 37.285 6.812 6.773 1.00 12.70 ? 19 ASN A C 1 +ATOM 121 O O . ASN A 1 19 ? 38.132 7.707 7.028 1.00 13.84 ? 19 ASN A O 1 +ATOM 122 C CB . ASN A 1 19 ? 39.229 5.154 6.679 1.00 12.83 ? 19 ASN A CB 1 +ATOM 123 C CG . ASN A 1 19 ? 39.596 3.809 7.293 1.00 13.16 ? 19 ASN A CG 1 +ATOM 124 O OD1 . ASN A 1 19 ? 38.868 3.351 8.204 1.00 13.65 ? 19 ASN A OD1 1 +ATOM 125 N ND2 . ASN A 1 19 ? 40.656 3.209 6.814 1.00 11.80 ? 19 ASN A ND2 1 +ATOM 126 N N . GLY A 1 20 ? 36.011 7.062 6.577 1.00 12.36 ? 20 GLY A N 1 +ATOM 127 C CA . GLY A 1 20 ? 35.409 8.367 6.647 1.00 18.39 ? 20 GLY A CA 1 +ATOM 128 C C . GLY A 1 20 ? 35.833 9.332 5.573 1.00 21.55 ? 20 GLY A C 1 +ATOM 129 O O . GLY A 1 20 ? 35.983 10.559 5.839 1.00 22.10 ? 20 GLY A O 1 +ATOM 130 N N . ASP A 1 21 ? 36.026 8.847 4.375 1.00 22.87 ? 21 ASP A N 1 +ATOM 131 C CA . ASP A 1 21 ? 36.353 9.603 3.186 1.00 25.57 ? 21 ASP A CA 1 +ATOM 132 C C . ASP A 1 21 ? 35.965 8.744 1.951 1.00 23.72 ? 21 ASP A C 1 +ATOM 133 O O . ASP A 1 21 ? 35.553 7.600 2.093 1.00 22.30 ? 21 ASP A O 1 +ATOM 134 C CB . ASP A 1 21 ? 37.735 10.210 3.103 1.00 28.72 ? 21 ASP A CB 1 +ATOM 135 C CG . ASP A 1 21 ? 37.735 11.493 2.252 1.00 32.06 ? 21 ASP A CG 1 +ATOM 136 O OD1 . ASP A 1 21 ? 37.599 11.416 1.029 1.00 34.04 ? 21 ASP A OD1 1 +ATOM 137 O OD2 . ASP A 1 21 ? 37.792 12.590 2.839 1.00 33.43 ? 21 ASP A OD2 1 +ATOM 138 N N . LEU A 1 22 ? 36.101 9.377 0.819 1.00 22.53 ? 22 LEU A N 1 +ATOM 139 C CA . LEU A 1 22 ? 35.782 8.828 -0.494 1.00 20.73 ? 22 LEU A CA 1 +ATOM 140 C C . LEU A 1 22 ? 36.752 7.709 -0.862 1.00 17.81 ? 22 LEU A C 1 +ATOM 141 O O . LEU A 1 22 ? 37.974 7.884 -0.742 1.00 16.56 ? 22 LEU A O 1 +ATOM 142 C CB . LEU A 1 22 ? 35.844 10.027 -1.481 1.00 21.87 ? 22 LEU A CB 1 +ATOM 143 C CG . LEU A 1 22 ? 34.699 10.979 -1.543 1.00 22.97 ? 22 LEU A CG 1 +ATOM 144 C CD1 . LEU A 1 22 ? 33.455 10.363 -2.187 1.00 25.06 ? 22 LEU A CD1 1 +ATOM 145 C CD2 . LEU A 1 22 ? 34.326 11.502 -0.158 1.00 22.39 ? 22 LEU A CD2 1 +ATOM 146 N N . PRO A 1 23 ? 36.196 6.613 -1.340 1.00 14.93 ? 23 PRO A N 1 +ATOM 147 C CA . PRO A 1 23 ? 36.976 5.448 -1.772 1.00 14.98 ? 23 PRO A CA 1 +ATOM 148 C C . PRO A 1 23 ? 37.867 5.727 -2.956 1.00 14.44 ? 23 PRO A C 1 +ATOM 149 O O . PRO A 1 23 ? 38.902 5.033 -3.152 1.00 15.14 ? 23 PRO A O 1 +ATOM 150 C CB . PRO A 1 23 ? 35.941 4.366 -2.042 1.00 14.89 ? 23 PRO A CB 1 +ATOM 151 C CG . PRO A 1 23 ? 34.681 4.836 -1.343 1.00 13.86 ? 23 PRO A CG 1 +ATOM 152 C CD . PRO A 1 23 ? 34.742 6.364 -1.493 1.00 14.76 ? 23 PRO A CD 1 +ATOM 153 N N . TRP A 1 24 ? 37.517 6.710 -3.754 1.00 15.12 ? 24 TRP A N 1 +ATOM 154 C CA . TRP A 1 24 ? 38.244 7.083 -4.981 1.00 15.99 ? 24 TRP A CA 1 +ATOM 155 C C . TRP A 1 24 ? 38.874 8.464 -4.854 1.00 16.08 ? 24 TRP A C 1 +ATOM 156 O O . TRP A 1 24 ? 38.491 9.263 -3.997 1.00 13.75 ? 24 TRP A O 1 +ATOM 157 C CB . TRP A 1 24 ? 37.211 7.074 -6.164 1.00 15.13 ? 24 TRP A CB 1 +ATOM 158 C CG . TRP A 1 24 ? 35.959 7.803 -5.770 1.00 13.64 ? 24 TRP A CG 1 +ATOM 159 C CD1 . TRP A 1 24 ? 35.749 9.140 -5.768 1.00 14.65 ? 24 TRP A CD1 1 +ATOM 160 C CD2 . TRP A 1 24 ? 34.773 7.201 -5.224 1.00 13.30 ? 24 TRP A CD2 1 +ATOM 161 N NE1 . TRP A 1 24 ? 34.481 9.427 -5.298 1.00 15.18 ? 24 TRP A NE1 1 +ATOM 162 C CE2 . TRP A 1 24 ? 33.870 8.249 -4.956 1.00 13.99 ? 24 TRP A CE2 1 +ATOM 163 C CE3 . TRP A 1 24 ? 34.393 5.890 -4.969 1.00 13.82 ? 24 TRP A CE3 1 +ATOM 164 C CZ2 . TRP A 1 24 ? 32.604 8.022 -4.431 1.00 12.33 ? 24 TRP A CZ2 1 +ATOM 165 C CZ3 . TRP A 1 24 ? 33.137 5.657 -4.447 1.00 14.97 ? 24 TRP A CZ3 1 +ATOM 166 C CH2 . TRP A 1 24 ? 32.250 6.712 -4.191 1.00 13.67 ? 24 TRP A CH2 1 +ATOM 167 N N . PRO A 1 25 ? 39.807 8.723 -5.787 1.00 17.54 ? 25 PRO A N 1 +ATOM 168 C CA . PRO A 1 25 ? 40.481 10.046 -5.811 1.00 18.84 ? 25 PRO A CA 1 +ATOM 169 C C . PRO A 1 25 ? 39.410 11.095 -6.037 1.00 20.28 ? 25 PRO A C 1 +ATOM 170 O O . PRO A 1 25 ? 38.341 10.765 -6.631 1.00 23.21 ? 25 PRO A O 1 +ATOM 171 C CB . PRO A 1 25 ? 41.480 9.943 -6.943 1.00 19.30 ? 25 PRO A CB 1 +ATOM 172 C CG . PRO A 1 25 ? 40.840 8.939 -7.885 1.00 19.51 ? 25 PRO A CG 1 +ATOM 173 C CD . PRO A 1 25 ? 40.313 7.871 -6.896 1.00 18.39 ? 25 PRO A CD 1 +ATOM 174 N N . PRO A 1 26 ? 39.659 12.289 -5.575 1.00 20.25 ? 26 PRO A N 1 +ATOM 175 C CA . PRO A 1 26 ? 38.721 13.409 -5.719 1.00 20.87 ? 26 PRO A CA 1 +ATOM 176 C C . PRO A 1 26 ? 38.450 13.632 -7.203 1.00 21.33 ? 26 PRO A C 1 +ATOM 177 O O . PRO A 1 26 ? 39.398 13.627 -8.023 1.00 21.78 ? 26 PRO A O 1 +ATOM 178 C CB . PRO A 1 26 ? 39.404 14.567 -5.031 1.00 22.23 ? 26 PRO A CB 1 +ATOM 179 C CG . PRO A 1 26 ? 40.890 14.230 -5.131 1.00 20.43 ? 26 PRO A CG 1 +ATOM 180 C CD . PRO A 1 26 ? 40.907 12.715 -4.896 1.00 20.85 ? 26 PRO A CD 1 +ATOM 181 N N . LEU A 1 27 ? 37.194 13.729 -7.524 1.00 20.37 ? 27 LEU A N 1 +ATOM 182 C CA . LEU A 1 27 ? 36.686 13.974 -8.888 1.00 20.04 ? 27 LEU A CA 1 +ATOM 183 C C . LEU A 1 27 ? 35.938 15.328 -8.851 1.00 19.24 ? 27 LEU A C 1 +ATOM 184 O O . LEU A 1 27 ? 34.825 15.408 -8.338 1.00 19.44 ? 27 LEU A O 1 +ATOM 185 C CB . LEU A 1 27 ? 35.830 12.809 -9.325 1.00 15.93 ? 27 LEU A CB 1 +ATOM 186 C CG . LEU A 1 27 ? 36.408 11.413 -9.268 1.00 16.01 ? 27 LEU A CG 1 +ATOM 187 C CD1 . LEU A 1 27 ? 35.398 10.375 -9.722 1.00 15.62 ? 27 LEU A CD1 1 +ATOM 188 C CD2 . LEU A 1 27 ? 37.669 11.324 -10.115 1.00 13.35 ? 27 LEU A CD2 1 +ATOM 189 N N . ARG A 1 28 ? 36.610 16.331 -9.364 1.00 18.48 ? 28 ARG A N 1 +ATOM 190 C CA . ARG A 1 28 ? 36.174 17.704 -9.363 1.00 19.51 ? 28 ARG A CA 1 +ATOM 191 C C . ARG A 1 28 ? 34.807 17.958 -9.936 1.00 19.20 ? 28 ARG A C 1 +ATOM 192 O O . ARG A 1 28 ? 33.933 18.536 -9.211 1.00 18.67 ? 28 ARG A O 1 +ATOM 193 C CB . ARG A 1 28 ? 37.208 18.657 -9.975 1.00 22.64 ? 28 ARG A CB 1 +ATOM 194 C CG . ARG A 1 28 ? 38.644 18.379 -9.738 1.00 25.74 ? 28 ARG A CG 1 +ATOM 195 C CD . ARG A 1 28 ? 38.970 17.962 -8.339 1.00 30.99 ? 28 ARG A CD 1 +ATOM 196 N NE . ARG A 1 28 ? 40.411 18.247 -8.063 1.00 33.81 ? 28 ARG A NE 1 +ATOM 197 C CZ . ARG A 1 28 ? 41.348 17.455 -8.601 1.00 35.89 ? 28 ARG A CZ 1 +ATOM 198 N NH1 . ARG A 1 28 ? 41.009 16.419 -9.362 1.00 37.10 ? 28 ARG A NH1 1 +ATOM 199 N NH2 . ARG A 1 28 ? 42.634 17.727 -8.385 1.00 36.31 ? 28 ARG A NH2 1 +ATOM 200 N N . ASN A 1 29 ? 34.596 17.619 -11.185 1.00 18.75 ? 29 ASN A N 1 +ATOM 201 C CA . ASN A 1 29 ? 33.330 17.891 -11.886 1.00 19.29 ? 29 ASN A CA 1 +ATOM 202 C C . ASN A 1 29 ? 32.191 17.139 -11.195 1.00 18.09 ? 29 ASN A C 1 +ATOM 203 O O . ASN A 1 29 ? 31.028 17.588 -11.242 1.00 18.88 ? 29 ASN A O 1 +ATOM 204 C CB . ASN A 1 29 ? 33.418 17.752 -13.375 1.00 22.47 ? 29 ASN A CB 1 +ATOM 205 C CG . ASN A 1 29 ? 34.669 18.076 -14.093 1.00 24.15 ? 29 ASN A CG 1 +ATOM 206 O OD1 . ASN A 1 29 ? 34.805 17.830 -15.339 1.00 27.86 ? 29 ASN A OD1 1 +ATOM 207 N ND2 . ASN A 1 29 ? 35.701 18.623 -13.452 1.00 25.12 ? 29 ASN A ND2 1 +ATOM 208 N N . GLU A 1 30 ? 32.547 16.024 -10.568 1.00 17.40 ? 30 GLU A N 1 +ATOM 209 C CA . GLU A 1 30 ? 31.535 15.207 -9.856 1.00 15.61 ? 30 GLU A CA 1 +ATOM 210 C C . GLU A 1 30 ? 31.123 15.957 -8.588 1.00 17.28 ? 30 GLU A C 1 +ATOM 211 O O . GLU A 1 30 ? 29.925 16.079 -8.289 1.00 14.57 ? 30 GLU A O 1 +ATOM 212 C CB . GLU A 1 30 ? 31.913 13.811 -9.598 1.00 16.17 ? 30 GLU A CB 1 +ATOM 213 C CG . GLU A 1 30 ? 30.835 12.715 -9.494 1.00 15.47 ? 30 GLU A CG 1 +ATOM 214 C CD . GLU A 1 30 ? 29.910 12.830 -8.323 1.00 15.86 ? 30 GLU A CD 1 +ATOM 215 O OE1 . GLU A 1 30 ? 28.710 12.706 -8.354 1.00 12.79 ? 30 GLU A OE1 1 +ATOM 216 O OE2 . GLU A 1 30 ? 30.539 13.063 -7.252 1.00 18.51 ? 30 GLU A OE2 1 +ATOM 217 N N . PHE A 1 31 ? 32.135 16.543 -7.932 1.00 17.20 ? 31 PHE A N 1 +ATOM 218 C CA . PHE A 1 31 ? 31.911 17.353 -6.739 1.00 18.07 ? 31 PHE A CA 1 +ATOM 219 C C . PHE A 1 31 ? 31.086 18.601 -7.100 1.00 17.88 ? 31 PHE A C 1 +ATOM 220 O O . PHE A 1 31 ? 30.320 19.127 -6.276 1.00 16.47 ? 31 PHE A O 1 +ATOM 221 C CB . PHE A 1 31 ? 33.194 17.724 -5.984 1.00 17.90 ? 31 PHE A CB 1 +ATOM 222 C CG . PHE A 1 31 ? 33.438 16.857 -4.776 1.00 19.34 ? 31 PHE A CG 1 +ATOM 223 C CD1 . PHE A 1 31 ? 32.422 16.672 -3.836 1.00 19.10 ? 31 PHE A CD1 1 +ATOM 224 C CD2 . PHE A 1 31 ? 34.666 16.217 -4.605 1.00 19.31 ? 31 PHE A CD2 1 +ATOM 225 C CE1 . PHE A 1 31 ? 32.612 15.853 -2.737 1.00 19.19 ? 31 PHE A CE1 1 +ATOM 226 C CE2 . PHE A 1 31 ? 34.878 15.396 -3.491 1.00 19.69 ? 31 PHE A CE2 1 +ATOM 227 C CZ . PHE A 1 31 ? 33.846 15.223 -2.559 1.00 18.13 ? 31 PHE A CZ 1 +ATOM 228 N N . ARG A 1 32 ? 31.294 19.037 -8.324 1.00 16.16 ? 32 ARG A N 1 +ATOM 229 C CA . ARG A 1 32 ? 30.623 20.214 -8.883 1.00 17.43 ? 32 ARG A CA 1 +ATOM 230 C C . ARG A 1 32 ? 29.120 19.898 -9.050 1.00 16.51 ? 32 ARG A C 1 +ATOM 231 O O . ARG A 1 32 ? 28.271 20.741 -8.792 1.00 17.21 ? 32 ARG A O 1 +ATOM 232 C CB . ARG A 1 32 ? 31.184 20.618 -10.225 1.00 21.45 ? 32 ARG A CB 1 +ATOM 233 C CG . ARG A 1 32 ? 32.543 21.216 -10.320 1.00 25.18 ? 32 ARG A CG 1 +ATOM 234 C CD . ARG A 1 32 ? 32.676 22.149 -11.487 1.00 28.25 ? 32 ARG A CD 1 +ATOM 235 N NE . ARG A 1 32 ? 32.260 21.551 -12.736 1.00 30.21 ? 32 ARG A NE 1 +ATOM 236 C CZ . ARG A 1 32 ? 31.031 21.660 -13.258 1.00 31.23 ? 32 ARG A CZ 1 +ATOM 237 N NH1 . ARG A 1 32 ? 30.065 22.348 -12.662 1.00 29.67 ? 32 ARG A NH1 1 +ATOM 238 N NH2 . ARG A 1 32 ? 30.780 21.049 -14.426 1.00 31.87 ? 32 ARG A NH2 1 +ATOM 239 N N . TYR A 1 33 ? 28.896 18.681 -9.511 1.00 14.84 ? 33 TYR A N 1 +ATOM 240 C CA . TYR A 1 33 ? 27.542 18.167 -9.745 1.00 13.81 ? 33 TYR A CA 1 +ATOM 241 C C . TYR A 1 33 ? 26.818 18.028 -8.397 1.00 12.66 ? 33 TYR A C 1 +ATOM 242 O O . TYR A 1 33 ? 25.665 18.453 -8.272 1.00 10.70 ? 33 TYR A O 1 +ATOM 243 C CB . TYR A 1 33 ? 27.550 16.859 -10.513 1.00 13.47 ? 33 TYR A CB 1 +ATOM 244 C CG . TYR A 1 33 ? 26.216 16.151 -10.593 1.00 13.44 ? 33 TYR A CG 1 +ATOM 245 C CD1 . TYR A 1 33 ? 25.809 15.243 -9.604 1.00 12.98 ? 33 TYR A CD1 1 +ATOM 246 C CD2 . TYR A 1 33 ? 25.385 16.342 -11.688 1.00 14.13 ? 33 TYR A CD2 1 +ATOM 247 C CE1 . TYR A 1 33 ? 24.594 14.577 -9.701 1.00 14.29 ? 33 TYR A CE1 1 +ATOM 248 C CE2 . TYR A 1 33 ? 24.170 15.668 -11.804 1.00 13.75 ? 33 TYR A CE2 1 +ATOM 249 C CZ . TYR A 1 33 ? 23.774 14.803 -10.802 1.00 14.78 ? 33 TYR A CZ 1 +ATOM 250 O OH . TYR A 1 33 ? 22.559 14.177 -10.944 1.00 17.69 ? 33 TYR A OH 1 +ATOM 251 N N . PHE A 1 34 ? 27.564 17.451 -7.453 1.00 12.56 ? 34 PHE A N 1 +ATOM 252 C CA . PHE A 1 34 ? 26.987 17.290 -6.082 1.00 11.41 ? 34 PHE A CA 1 +ATOM 253 C C . PHE A 1 34 ? 26.523 18.664 -5.607 1.00 13.43 ? 34 PHE A C 1 +ATOM 254 O O . PHE A 1 34 ? 25.382 18.843 -5.161 1.00 11.21 ? 34 PHE A O 1 +ATOM 255 C CB . PHE A 1 34 ? 27.928 16.591 -5.116 1.00 8.88 ? 34 PHE A CB 1 +ATOM 256 C CG . PHE A 1 34 ? 27.538 16.759 -3.668 1.00 11.05 ? 34 PHE A CG 1 +ATOM 257 C CD1 . PHE A 1 34 ? 26.691 15.835 -3.065 1.00 10.91 ? 34 PHE A CD1 1 +ATOM 258 C CD2 . PHE A 1 34 ? 27.945 17.888 -2.965 1.00 10.46 ? 34 PHE A CD2 1 +ATOM 259 C CE1 . PHE A 1 34 ? 26.287 15.998 -1.745 1.00 9.98 ? 34 PHE A CE1 1 +ATOM 260 C CE2 . PHE A 1 34 ? 27.540 18.079 -1.637 1.00 13.90 ? 34 PHE A CE2 1 +ATOM 261 C CZ . PHE A 1 34 ? 26.705 17.115 -1.033 1.00 8.94 ? 34 PHE A CZ 1 +ATOM 262 N N . GLN A 1 35 ? 27.427 19.639 -5.753 1.00 16.01 ? 35 GLN A N 1 +ATOM 263 C CA . GLN A 1 35 ? 27.163 21.000 -5.323 1.00 17.13 ? 35 GLN A CA 1 +ATOM 264 C C . GLN A 1 35 ? 25.986 21.655 -5.975 1.00 17.75 ? 35 GLN A C 1 +ATOM 265 O O . GLN A 1 35 ? 25.079 22.150 -5.237 1.00 17.43 ? 35 GLN A O 1 +ATOM 266 C CB . GLN A 1 35 ? 28.411 21.921 -5.338 1.00 20.03 ? 35 GLN A CB 1 +ATOM 267 C CG . GLN A 1 35 ? 28.108 23.220 -4.671 1.00 21.34 ? 35 GLN A CG 1 +ATOM 268 C CD . GLN A 1 35 ? 29.061 24.312 -4.604 1.00 23.93 ? 35 GLN A CD 1 +ATOM 269 O OE1 . GLN A 1 35 ? 28.645 25.523 -4.602 1.00 27.81 ? 35 GLN A OE1 1 +ATOM 270 N NE2 . GLN A 1 35 ? 30.356 24.085 -4.452 1.00 23.17 ? 35 GLN A NE2 1 +ATOM 271 N N . ARG A 1 36 ? 25.951 21.723 -7.297 1.00 17.66 ? 36 ARG A N 1 +ATOM 272 C CA . ARG A 1 36 ? 24.843 22.392 -8.005 1.00 17.75 ? 36 ARG A CA 1 +ATOM 273 C C . ARG A 1 36 ? 23.508 21.750 -7.659 1.00 16.88 ? 36 ARG A C 1 +ATOM 274 O O . ARG A 1 36 ? 22.553 22.496 -7.320 1.00 17.80 ? 36 ARG A O 1 +ATOM 275 C CB . ARG A 1 36 ? 25.024 22.591 -9.451 1.00 18.72 ? 36 ARG A CB 1 +ATOM 276 C CG . ARG A 1 36 ? 25.804 21.732 -10.340 1.00 21.40 ? 36 ARG A CG 1 +ATOM 277 C CD . ARG A 1 36 ? 25.474 22.074 -11.813 1.00 23.14 ? 36 ARG A CD 1 +ATOM 278 N NE . ARG A 1 36 ? 24.830 20.897 -12.400 1.00 24.81 ? 36 ARG A NE 1 +ATOM 279 C CZ . ARG A 1 36 ? 25.565 19.997 -13.082 1.00 26.67 ? 36 ARG A CZ 1 +ATOM 280 N NH1 . ARG A 1 36 ? 26.882 20.176 -13.239 1.00 27.10 ? 36 ARG A NH1 1 +ATOM 281 N NH2 . ARG A 1 36 ? 24.972 18.927 -13.586 1.00 26.38 ? 36 ARG A NH2 1 +ATOM 282 N N . MET A 1 37 ? 23.439 20.451 -7.710 1.00 16.73 ? 37 MET A N 1 +ATOM 283 C CA . MET A 1 37 ? 22.229 19.678 -7.405 1.00 16.33 ? 37 MET A CA 1 +ATOM 284 C C . MET A 1 37 ? 21.613 20.093 -6.074 1.00 16.61 ? 37 MET A C 1 +ATOM 285 O O . MET A 1 37 ? 20.407 20.438 -6.019 1.00 16.65 ? 37 MET A O 1 +ATOM 286 C CB . MET A 1 37 ? 22.501 18.194 -7.452 1.00 18.99 ? 37 MET A CB 1 +ATOM 287 C CG . MET A 1 37 ? 22.355 17.485 -8.695 1.00 20.93 ? 37 MET A CG 1 +ATOM 288 S SD . MET A 1 37 ? 21.203 18.284 -9.846 1.00 21.51 ? 37 MET A SD 1 +ATOM 289 C CE . MET A 1 37 ? 22.378 19.128 -10.912 1.00 22.69 ? 37 MET A CE 1 +ATOM 290 N N . THR A 1 38 ? 22.399 20.000 -5.011 1.00 14.48 ? 38 THR A N 1 +ATOM 291 C CA . THR A 1 38 ? 21.943 20.299 -3.660 1.00 14.65 ? 38 THR A CA 1 +ATOM 292 C C . THR A 1 38 ? 21.701 21.759 -3.391 1.00 14.83 ? 38 THR A C 1 +ATOM 293 O O . THR A 1 38 ? 20.873 22.055 -2.455 1.00 15.84 ? 38 THR A O 1 +ATOM 294 C CB . THR A 1 38 ? 22.861 19.670 -2.524 1.00 12.06 ? 38 THR A CB 1 +ATOM 295 O OG1 . THR A 1 38 ? 24.158 20.338 -2.632 1.00 11.30 ? 38 THR A OG1 1 +ATOM 296 C CG2 . THR A 1 38 ? 22.965 18.157 -2.564 1.00 12.44 ? 38 THR A CG2 1 +ATOM 297 N N . THR A 1 39 ? 22.321 22.653 -4.111 1.00 15.61 ? 39 THR A N 1 +ATOM 298 C CA . THR A 1 39 ? 22.205 24.082 -3.939 1.00 18.29 ? 39 THR A CA 1 +ATOM 299 C C . THR A 1 39 ? 21.110 24.778 -4.691 1.00 20.41 ? 39 THR A C 1 +ATOM 300 O O . THR A 1 39 ? 20.422 25.678 -4.054 1.00 20.55 ? 39 THR A O 1 +ATOM 301 C CB . THR A 1 39 ? 23.591 24.845 -4.159 1.00 18.13 ? 39 THR A CB 1 +ATOM 302 O OG1 . THR A 1 39 ? 24.616 24.073 -3.526 1.00 17.43 ? 39 THR A OG1 1 +ATOM 303 C CG2 . THR A 1 39 ? 23.521 26.290 -3.612 1.00 17.42 ? 39 THR A CG2 1 +ATOM 304 N N . THR A 1 40 ? 20.916 24.508 -5.960 1.00 21.60 ? 40 THR A N 1 +ATOM 305 C CA . THR A 1 40 ? 19.889 25.207 -6.761 1.00 22.70 ? 40 THR A CA 1 +ATOM 306 C C . THR A 1 40 ? 18.500 24.920 -6.221 1.00 23.45 ? 40 THR A C 1 +ATOM 307 O O . THR A 1 40 ? 18.137 23.751 -5.948 1.00 22.77 ? 40 THR A O 1 +ATOM 308 C CB . THR A 1 40 ? 20.024 25.025 -8.298 1.00 23.18 ? 40 THR A CB 1 +ATOM 309 O OG1 . THR A 1 40 ? 18.830 24.317 -8.763 1.00 26.22 ? 40 THR A OG1 1 +ATOM 310 C CG2 . THR A 1 40 ? 21.307 24.428 -8.807 1.00 22.98 ? 40 THR A CG2 1 +ATOM 311 N N . SER A 1 41 ? 17.736 25.976 -6.066 1.00 27.01 ? 41 SER A N 1 +ATOM 312 C CA . SER A 1 41 ? 16.376 25.947 -5.507 1.00 31.92 ? 41 SER A CA 1 +ATOM 313 C C . SER A 1 41 ? 15.361 26.687 -6.348 1.00 35.36 ? 41 SER A C 1 +ATOM 314 O O . SER A 1 41 ? 15.665 27.223 -7.436 1.00 36.41 ? 41 SER A O 1 +ATOM 315 C CB . SER A 1 41 ? 16.440 26.638 -4.111 1.00 31.83 ? 41 SER A CB 1 +ATOM 316 O OG . SER A 1 41 ? 15.154 26.976 -3.658 1.00 32.90 ? 41 SER A OG 1 +ATOM 317 N N . SER A 1 42 ? 14.145 26.734 -5.828 1.00 39.18 ? 42 SER A N 1 +ATOM 318 C CA . SER A 1 42 ? 13.013 27.472 -6.366 1.00 42.70 ? 42 SER A CA 1 +ATOM 319 C C . SER A 1 42 ? 11.747 27.298 -5.535 1.00 44.03 ? 42 SER A C 1 +ATOM 320 O O . SER A 1 42 ? 11.795 27.330 -4.270 1.00 44.52 ? 42 SER A O 1 +ATOM 321 C CB . SER A 1 42 ? 12.817 27.358 -7.835 1.00 42.52 ? 42 SER A CB 1 +ATOM 322 O OG . SER A 1 42 ? 12.328 28.616 -8.362 1.00 43.98 ? 42 SER A OG 1 +ATOM 323 N N . VAL A 1 43 ? 10.628 27.168 -6.179 1.00 45.67 ? 43 VAL A N 1 +ATOM 324 C CA . VAL A 1 43 ? 9.291 27.051 -5.639 1.00 46.76 ? 43 VAL A CA 1 +ATOM 325 C C . VAL A 1 43 ? 9.171 26.264 -4.370 1.00 47.94 ? 43 VAL A C 1 +ATOM 326 O O . VAL A 1 43 ? 9.881 25.265 -4.129 1.00 48.94 ? 43 VAL A O 1 +ATOM 327 C CB . VAL A 1 43 ? 8.317 26.532 -6.761 1.00 46.85 ? 43 VAL A CB 1 +ATOM 328 C CG1 . VAL A 1 43 ? 8.898 25.416 -7.578 1.00 46.21 ? 43 VAL A CG1 1 +ATOM 329 C CG2 . VAL A 1 43 ? 6.986 26.112 -6.131 1.00 47.14 ? 43 VAL A CG2 1 +ATOM 330 N N . GLU A 1 44 ? 8.240 26.687 -3.507 1.00 47.94 ? 44 GLU A N 1 +ATOM 331 C CA . GLU A 1 44 ? 7.931 26.068 -2.240 1.00 46.95 ? 44 GLU A CA 1 +ATOM 332 C C . GLU A 1 44 ? 8.776 26.563 -1.084 1.00 45.23 ? 44 GLU A C 1 +ATOM 333 O O . GLU A 1 44 ? 8.473 26.201 0.096 1.00 45.25 ? 44 GLU A O 1 +ATOM 334 C CB . GLU A 1 44 ? 8.030 24.539 -2.259 1.00 48.07 ? 44 GLU A CB 1 +ATOM 335 C CG . GLU A 1 44 ? 7.051 23.778 -1.342 1.00 49.70 ? 44 GLU A CG 1 +ATOM 336 C CD . GLU A 1 44 ? 5.602 23.977 -1.617 1.00 51.39 ? 44 GLU A CD 1 +ATOM 337 O OE1 . GLU A 1 44 ? 4.757 24.269 -0.747 1.00 52.04 ? 44 GLU A OE1 1 +ATOM 338 O OE2 . GLU A 1 44 ? 5.294 23.816 -2.816 1.00 51.69 ? 44 GLU A OE2 1 +ATOM 339 N N . GLY A 1 45 ? 9.781 27.337 -1.383 1.00 42.60 ? 45 GLY A N 1 +ATOM 340 C CA . GLY A 1 45 ? 10.702 27.887 -0.345 1.00 40.20 ? 45 GLY A CA 1 +ATOM 341 C C . GLY A 1 45 ? 11.666 28.840 -1.055 1.00 38.15 ? 45 GLY A C 1 +ATOM 342 O O . GLY A 1 45 ? 11.205 29.623 -1.914 1.00 39.16 ? 45 GLY A O 1 +ATOM 343 N N . LYS A 1 46 ? 12.935 28.720 -0.727 1.00 34.72 ? 46 LYS A N 1 +ATOM 344 C CA . LYS A 1 46 ? 13.979 29.549 -1.323 1.00 32.70 ? 46 LYS A CA 1 +ATOM 345 C C . LYS A 1 46 ? 15.344 28.834 -1.321 1.00 29.14 ? 46 LYS A C 1 +ATOM 346 O O . LYS A 1 46 ? 16.168 29.115 -2.209 1.00 30.11 ? 46 LYS A O 1 +ATOM 347 C CB . LYS A 1 46 ? 14.197 30.863 -0.592 1.00 33.55 ? 46 LYS A CB 1 +ATOM 348 C CG . LYS A 1 46 ? 13.062 31.785 -0.371 1.00 33.69 ? 46 LYS A CG 1 +ATOM 349 C CD . LYS A 1 46 ? 13.232 32.590 0.932 1.00 34.00 ? 46 LYS A CD 1 +ATOM 350 C CE . LYS A 1 46 ? 12.410 31.972 2.047 1.00 35.44 ? 46 LYS A CE 1 +ATOM 351 N NZ . LYS A 1 46 ? 11.713 33.010 2.836 1.00 35.43 ? 46 LYS A NZ 1 +ATOM 352 N N . GLN A 1 47 ? 15.547 28.045 -0.302 1.00 24.98 ? 47 GLN A N 1 +ATOM 353 C CA . GLN A 1 47 ? 16.815 27.344 -0.061 1.00 20.94 ? 47 GLN A CA 1 +ATOM 354 C C . GLN A 1 47 ? 16.592 25.868 0.193 1.00 16.65 ? 47 GLN A C 1 +ATOM 355 O O . GLN A 1 47 ? 15.560 25.489 0.783 1.00 16.44 ? 47 GLN A O 1 +ATOM 356 C CB . GLN A 1 47 ? 17.520 27.977 1.173 1.00 21.33 ? 47 GLN A CB 1 +ATOM 357 C CG . GLN A 1 47 ? 18.807 28.667 0.863 1.00 22.90 ? 47 GLN A CG 1 +ATOM 358 C CD . GLN A 1 47 ? 19.624 29.050 2.080 1.00 23.54 ? 47 GLN A CD 1 +ATOM 359 O OE1 . GLN A 1 47 ? 20.530 29.884 2.009 1.00 23.60 ? 47 GLN A OE1 1 +ATOM 360 N NE2 . GLN A 1 47 ? 19.328 28.414 3.196 1.00 25.10 ? 47 GLN A NE2 1 +ATOM 361 N N . ASN A 1 48 ? 17.585 25.082 -0.186 1.00 14.80 ? 48 ASN A N 1 +ATOM 362 C CA . ASN A 1 48 ? 17.536 23.616 0.031 1.00 13.30 ? 48 ASN A CA 1 +ATOM 363 C C . ASN A 1 48 ? 18.043 23.272 1.439 1.00 9.92 ? 48 ASN A C 1 +ATOM 364 O O . ASN A 1 48 ? 18.859 23.988 2.035 1.00 8.83 ? 48 ASN A O 1 +ATOM 365 C CB . ASN A 1 48 ? 18.256 22.874 -1.083 1.00 12.86 ? 48 ASN A CB 1 +ATOM 366 C CG . ASN A 1 48 ? 17.665 23.154 -2.466 1.00 13.28 ? 48 ASN A CG 1 +ATOM 367 O OD1 . ASN A 1 48 ? 16.502 23.517 -2.587 1.00 10.76 ? 48 ASN A OD1 1 +ATOM 368 N ND2 . ASN A 1 48 ? 18.495 22.963 -3.489 1.00 12.77 ? 48 ASN A ND2 1 +ATOM 369 N N . LEU A 1 49 ? 17.515 22.170 1.933 1.00 8.55 ? 49 LEU A N 1 +ATOM 370 C CA . LEU A 1 49 ? 17.890 21.611 3.250 1.00 10.89 ? 49 LEU A CA 1 +ATOM 371 C C . LEU A 1 49 ? 18.663 20.314 2.975 1.00 12.78 ? 49 LEU A C 1 +ATOM 372 O O . LEU A 1 49 ? 18.216 19.477 2.165 1.00 13.05 ? 49 LEU A O 1 +ATOM 373 C CB . LEU A 1 49 ? 16.658 21.448 4.109 1.00 11.77 ? 49 LEU A CB 1 +ATOM 374 C CG . LEU A 1 49 ? 16.674 20.552 5.319 1.00 14.78 ? 49 LEU A CG 1 +ATOM 375 C CD1 . LEU A 1 49 ? 17.442 21.190 6.490 1.00 13.60 ? 49 LEU A CD1 1 +ATOM 376 C CD2 . LEU A 1 49 ? 15.242 20.272 5.782 1.00 14.16 ? 49 LEU A CD2 1 +ATOM 377 N N . VAL A 1 50 ? 19.817 20.231 3.589 1.00 12.34 ? 50 VAL A N 1 +ATOM 378 C CA . VAL A 1 50 ? 20.694 19.049 3.451 1.00 12.65 ? 50 VAL A CA 1 +ATOM 379 C C . VAL A 1 50 ? 20.657 18.298 4.795 1.00 10.74 ? 50 VAL A C 1 +ATOM 380 O O . VAL A 1 50 ? 21.017 18.892 5.823 1.00 8.50 ? 50 VAL A O 1 +ATOM 381 C CB . VAL A 1 50 ? 22.108 19.462 3.032 1.00 13.60 ? 50 VAL A CB 1 +ATOM 382 C CG1 . VAL A 1 50 ? 23.044 18.262 2.930 1.00 16.56 ? 50 VAL A CG1 1 +ATOM 383 C CG2 . VAL A 1 50 ? 22.131 20.269 1.748 1.00 15.29 ? 50 VAL A CG2 1 +ATOM 384 N N . ILE A 1 51 ? 20.182 17.084 4.722 1.00 10.15 ? 51 ILE A N 1 +ATOM 385 C CA . ILE A 1 51 ? 20.076 16.184 5.882 1.00 10.17 ? 51 ILE A CA 1 +ATOM 386 C C . ILE A 1 51 ? 21.166 15.127 5.799 1.00 11.78 ? 51 ILE A C 1 +ATOM 387 O O . ILE A 1 51 ? 21.285 14.420 4.762 1.00 13.04 ? 51 ILE A O 1 +ATOM 388 C CB . ILE A 1 51 ? 18.632 15.546 5.937 1.00 12.21 ? 51 ILE A CB 1 +ATOM 389 C CG1 . ILE A 1 51 ? 17.586 16.604 6.248 1.00 12.82 ? 51 ILE A CG1 1 +ATOM 390 C CG2 . ILE A 1 51 ? 18.604 14.332 6.915 1.00 14.49 ? 51 ILE A CG2 1 +ATOM 391 C CD1 . ILE A 1 51 ? 16.115 16.167 6.376 1.00 11.40 ? 51 ILE A CD1 1 +ATOM 392 N N . MET A 1 52 ? 21.968 15.037 6.847 1.00 11.58 ? 52 MET A N 1 +ATOM 393 C CA . MET A 1 52 ? 23.078 14.078 6.894 1.00 12.11 ? 52 MET A CA 1 +ATOM 394 C C . MET A 1 52 ? 23.302 13.552 8.313 1.00 11.48 ? 52 MET A C 1 +ATOM 395 O O . MET A 1 52 ? 22.902 14.159 9.295 1.00 9.50 ? 52 MET A O 1 +ATOM 396 C CB . MET A 1 52 ? 24.356 14.706 6.349 1.00 13.85 ? 52 MET A CB 1 +ATOM 397 C CG . MET A 1 52 ? 24.785 15.841 7.258 1.00 13.62 ? 52 MET A CG 1 +ATOM 398 S SD . MET A 1 52 ? 25.946 16.855 6.293 1.00 16.61 ? 52 MET A SD 1 +ATOM 399 C CE . MET A 1 52 ? 24.929 18.350 6.096 1.00 11.05 ? 52 MET A CE 1 +ATOM 400 N N . GLY A 1 53 ? 23.976 12.404 8.321 1.00 8.61 ? 53 GLY A N 1 +ATOM 401 C CA . GLY A 1 53 ? 24.329 11.708 9.569 1.00 8.63 ? 53 GLY A CA 1 +ATOM 402 C C . GLY A 1 53 ? 25.535 12.411 10.198 1.00 8.97 ? 53 GLY A C 1 +ATOM 403 O O . GLY A 1 53 ? 26.169 13.288 9.588 1.00 6.26 ? 53 GLY A O 1 +ATOM 404 N N . LYS A 1 54 ? 25.826 11.982 11.393 1.00 11.42 ? 54 LYS A N 1 +ATOM 405 C CA . LYS A 1 54 ? 26.931 12.472 12.224 1.00 12.22 ? 54 LYS A CA 1 +ATOM 406 C C . LYS A 1 54 ? 28.265 12.298 11.531 1.00 11.69 ? 54 LYS A C 1 +ATOM 407 O O . LYS A 1 54 ? 29.045 13.247 11.342 1.00 9.96 ? 54 LYS A O 1 +ATOM 408 C CB . LYS A 1 54 ? 26.949 11.660 13.535 1.00 15.28 ? 54 LYS A CB 1 +ATOM 409 C CG . LYS A 1 54 ? 27.580 12.385 14.716 1.00 18.38 ? 54 LYS A CG 1 +ATOM 410 C CD . LYS A 1 54 ? 27.342 11.523 15.990 1.00 19.49 ? 54 LYS A CD 1 +ATOM 411 C CE . LYS A 1 54 ? 28.546 10.725 16.351 1.00 20.58 ? 54 LYS A CE 1 +ATOM 412 N NZ . LYS A 1 54 ? 29.182 10.090 15.180 1.00 22.61 ? 54 LYS A NZ 1 +ATOM 413 N N . LYS A 1 55 ? 28.520 11.047 11.149 1.00 11.12 ? 55 LYS A N 1 +ATOM 414 C CA . LYS A 1 55 ? 29.773 10.679 10.478 1.00 11.97 ? 55 LYS A CA 1 +ATOM 415 C C . LYS A 1 55 ? 29.884 11.372 9.139 1.00 10.76 ? 55 LYS A C 1 +ATOM 416 O O . LYS A 1 55 ? 31.023 11.750 8.742 1.00 13.03 ? 55 LYS A O 1 +ATOM 417 C CB . LYS A 1 55 ? 29.987 9.200 10.377 1.00 16.43 ? 55 LYS A CB 1 +ATOM 418 C CG . LYS A 1 55 ? 30.529 8.529 11.660 1.00 18.59 ? 55 LYS A CG 1 +ATOM 419 C CD . LYS A 1 55 ? 31.667 7.552 11.241 1.00 20.80 ? 55 LYS A CD 1 +ATOM 420 C CE . LYS A 1 55 ? 32.227 6.833 12.481 1.00 18.12 ? 55 LYS A CE 1 +ATOM 421 N NZ . LYS A 1 55 ? 33.169 7.721 13.191 1.00 12.28 ? 55 LYS A NZ 1 +ATOM 422 N N . THR A 1 56 ? 28.762 11.541 8.451 1.00 9.33 ? 56 THR A N 1 +ATOM 423 C CA . THR A 1 56 ? 28.805 12.243 7.136 1.00 6.12 ? 56 THR A CA 1 +ATOM 424 C C . THR A 1 56 ? 29.286 13.665 7.344 1.00 5.32 ? 56 THR A C 1 +ATOM 425 O O . THR A 1 56 ? 30.211 14.124 6.641 1.00 5.15 ? 56 THR A O 1 +ATOM 426 C CB . THR A 1 56 ? 27.529 12.093 6.285 1.00 9.32 ? 56 THR A CB 1 +ATOM 427 O OG1 . THR A 1 56 ? 27.385 10.635 6.007 1.00 2.78 ? 56 THR A OG1 1 +ATOM 428 C CG2 . THR A 1 56 ? 27.555 12.833 4.929 1.00 7.26 ? 56 THR A CG2 1 +ATOM 429 N N . TRP A 1 57 ? 28.721 14.341 8.333 1.00 6.00 ? 57 TRP A N 1 +ATOM 430 C CA . TRP A 1 57 ? 29.077 15.722 8.661 1.00 8.11 ? 57 TRP A CA 1 +ATOM 431 C C . TRP A 1 57 ? 30.589 15.863 8.834 1.00 10.58 ? 57 TRP A C 1 +ATOM 432 O O . TRP A 1 57 ? 31.220 16.719 8.195 1.00 11.78 ? 57 TRP A O 1 +ATOM 433 C CB . TRP A 1 57 ? 28.303 16.253 9.866 1.00 8.92 ? 57 TRP A CB 1 +ATOM 434 C CG . TRP A 1 57 ? 28.830 17.542 10.414 1.00 7.51 ? 57 TRP A CG 1 +ATOM 435 C CD1 . TRP A 1 57 ? 29.661 17.708 11.489 1.00 7.46 ? 57 TRP A CD1 1 +ATOM 436 C CD2 . TRP A 1 57 ? 28.544 18.861 9.924 1.00 6.92 ? 57 TRP A CD2 1 +ATOM 437 N NE1 . TRP A 1 57 ? 29.921 19.041 11.690 1.00 6.38 ? 57 TRP A NE1 1 +ATOM 438 C CE2 . TRP A 1 57 ? 29.248 19.769 10.743 1.00 7.59 ? 57 TRP A CE2 1 +ATOM 439 C CE3 . TRP A 1 57 ? 27.762 19.347 8.885 1.00 8.49 ? 57 TRP A CE3 1 +ATOM 440 C CZ2 . TRP A 1 57 ? 29.200 21.142 10.545 1.00 9.03 ? 57 TRP A CZ2 1 +ATOM 441 C CZ3 . TRP A 1 57 ? 27.717 20.711 8.672 1.00 10.01 ? 57 TRP A CZ3 1 +ATOM 442 C CH2 . TRP A 1 57 ? 28.423 21.596 9.485 1.00 10.07 ? 57 TRP A CH2 1 +ATOM 443 N N . PHE A 1 58 ? 31.132 15.020 9.692 1.00 9.27 ? 58 PHE A N 1 +ATOM 444 C CA . PHE A 1 58 ? 32.577 15.021 9.992 1.00 11.64 ? 58 PHE A CA 1 +ATOM 445 C C . PHE A 1 58 ? 33.400 14.545 8.816 1.00 11.51 ? 58 PHE A C 1 +ATOM 446 O O . PHE A 1 58 ? 34.640 14.777 8.791 1.00 13.94 ? 58 PHE A O 1 +ATOM 447 C CB . PHE A 1 58 ? 32.871 14.242 11.303 1.00 10.28 ? 58 PHE A CB 1 +ATOM 448 C CG . PHE A 1 58 ? 32.416 15.012 12.522 1.00 11.20 ? 58 PHE A CG 1 +ATOM 449 C CD1 . PHE A 1 58 ? 31.259 14.636 13.181 1.00 11.90 ? 58 PHE A CD1 1 +ATOM 450 C CD2 . PHE A 1 58 ? 33.107 16.153 12.920 1.00 10.91 ? 58 PHE A CD2 1 +ATOM 451 C CE1 . PHE A 1 58 ? 30.787 15.362 14.273 1.00 12.74 ? 58 PHE A CE1 1 +ATOM 452 C CE2 . PHE A 1 58 ? 32.652 16.911 14.007 1.00 11.55 ? 58 PHE A CE2 1 +ATOM 453 C CZ . PHE A 1 58 ? 31.489 16.493 14.686 1.00 13.32 ? 58 PHE A CZ 1 +ATOM 454 N N . SER A 1 59 ? 32.745 13.978 7.822 1.00 11.83 ? 59 SER A N 1 +ATOM 455 C CA . SER A 1 59 ? 33.430 13.451 6.623 1.00 13.35 ? 59 SER A CA 1 +ATOM 456 C C . SER A 1 59 ? 33.764 14.548 5.649 1.00 14.88 ? 59 SER A C 1 +ATOM 457 O O . SER A 1 59 ? 34.602 14.334 4.725 1.00 17.54 ? 59 SER A O 1 +ATOM 458 C CB . SER A 1 59 ? 32.670 12.303 5.994 1.00 12.71 ? 59 SER A CB 1 +ATOM 459 O OG . SER A 1 59 ? 31.826 12.708 4.936 1.00 12.78 ? 59 SER A OG 1 +ATOM 460 N N . ILE A 1 60 ? 33.160 15.704 5.821 1.00 14.80 ? 60 ILE A N 1 +ATOM 461 C CA . ILE A 1 60 ? 33.393 16.869 4.966 1.00 14.03 ? 60 ILE A CA 1 +ATOM 462 C C . ILE A 1 60 ? 34.514 17.736 5.542 1.00 14.74 ? 60 ILE A C 1 +ATOM 463 O O . ILE A 1 60 ? 34.545 17.999 6.744 1.00 13.23 ? 60 ILE A O 1 +ATOM 464 C CB . ILE A 1 60 ? 32.055 17.687 4.791 1.00 14.08 ? 60 ILE A CB 1 +ATOM 465 C CG1 . ILE A 1 60 ? 30.934 16.778 4.287 1.00 12.82 ? 60 ILE A CG1 1 +ATOM 466 C CG2 . ILE A 1 60 ? 32.252 18.958 3.941 1.00 12.89 ? 60 ILE A CG2 1 +ATOM 467 C CD1 . ILE A 1 60 ? 29.500 17.179 4.721 1.00 13.34 ? 60 ILE A CD1 1 +ATOM 468 N N . PRO A 1 61 ? 35.398 18.174 4.647 1.00 14.98 ? 61 PRO A N 1 +ATOM 469 C CA . PRO A 1 61 ? 36.511 19.058 5.030 1.00 16.43 ? 61 PRO A CA 1 +ATOM 470 C C . PRO A 1 61 ? 35.948 20.239 5.814 1.00 17.67 ? 61 PRO A C 1 +ATOM 471 O O . PRO A 1 61 ? 34.878 20.769 5.447 1.00 17.82 ? 61 PRO A O 1 +ATOM 472 C CB . PRO A 1 61 ? 37.167 19.444 3.740 1.00 15.39 ? 61 PRO A CB 1 +ATOM 473 C CG . PRO A 1 61 ? 36.644 18.534 2.690 1.00 16.33 ? 61 PRO A CG 1 +ATOM 474 C CD . PRO A 1 61 ? 35.402 17.881 3.218 1.00 16.02 ? 61 PRO A CD 1 +ATOM 475 N N . GLU A 1 62 ? 36.649 20.624 6.857 1.00 19.16 ? 62 GLU A N 1 +ATOM 476 C CA . GLU A 1 62 ? 36.243 21.726 7.735 1.00 22.10 ? 62 GLU A CA 1 +ATOM 477 C C . GLU A 1 62 ? 36.091 23.036 6.961 1.00 22.32 ? 62 GLU A C 1 +ATOM 478 O O . GLU A 1 62 ? 35.270 23.896 7.323 1.00 22.34 ? 62 GLU A O 1 +ATOM 479 C CB . GLU A 1 62 ? 37.227 21.976 8.860 1.00 23.11 ? 62 GLU A CB 1 +ATOM 480 C CG . GLU A 1 62 ? 37.001 21.278 10.190 1.00 26.53 ? 62 GLU A CG 1 +ATOM 481 C CD . GLU A 1 62 ? 38.091 21.445 11.207 1.00 27.91 ? 62 GLU A CD 1 +ATOM 482 O OE1 . GLU A 1 62 ? 39.116 20.770 11.225 1.00 29.64 ? 62 GLU A OE1 1 +ATOM 483 O OE2 . GLU A 1 62 ? 37.826 22.352 12.013 1.00 28.40 ? 62 GLU A OE2 1 +ATOM 484 N N . LYS A 1 63 ? 36.904 23.187 5.951 1.00 23.64 ? 63 LYS A N 1 +ATOM 485 C CA . LYS A 1 63 ? 36.998 24.311 5.063 1.00 24.00 ? 63 LYS A CA 1 +ATOM 486 C C . LYS A 1 63 ? 35.667 24.728 4.468 1.00 23.74 ? 63 LYS A C 1 +ATOM 487 O O . LYS A 1 63 ? 35.410 25.934 4.252 1.00 23.75 ? 63 LYS A O 1 +ATOM 488 C CB . LYS A 1 63 ? 37.942 23.955 3.859 1.00 26.23 ? 63 LYS A CB 1 +ATOM 489 C CG . LYS A 1 63 ? 37.798 24.961 2.722 1.00 29.32 ? 63 LYS A CG 1 +ATOM 490 C CD . LYS A 1 63 ? 38.399 24.443 1.412 1.00 31.20 ? 63 LYS A CD 1 +ATOM 491 C CE . LYS A 1 63 ? 39.279 25.507 0.774 1.00 32.36 ? 63 LYS A CE 1 +ATOM 492 N NZ . LYS A 1 63 ? 39.238 25.455 -0.685 1.00 33.60 ? 63 LYS A NZ 1 +ATOM 493 N N . ASN A 1 64 ? 34.869 23.727 4.148 1.00 23.70 ? 64 ASN A N 1 +ATOM 494 C CA . ASN A 1 64 ? 33.538 24.003 3.524 1.00 25.99 ? 64 ASN A CA 1 +ATOM 495 C C . ASN A 1 64 ? 32.504 23.122 4.175 1.00 25.86 ? 64 ASN A C 1 +ATOM 496 O O . ASN A 1 64 ? 31.517 22.704 3.552 1.00 28.27 ? 64 ASN A O 1 +ATOM 497 C CB . ASN A 1 64 ? 33.651 23.932 2.005 1.00 26.92 ? 64 ASN A CB 1 +ATOM 498 C CG . ASN A 1 64 ? 34.288 22.606 1.570 1.00 26.69 ? 64 ASN A CG 1 +ATOM 499 O OD1 . ASN A 1 64 ? 35.385 22.600 1.039 1.00 24.94 ? 64 ASN A OD1 1 +ATOM 500 N ND2 . ASN A 1 64 ? 33.575 21.535 1.927 1.00 26.78 ? 64 ASN A ND2 1 +ATOM 501 N N . ARG A 1 65 ? 32.725 22.906 5.475 1.00 26.47 ? 65 ARG A N 1 +ATOM 502 C CA . ARG A 1 65 ? 31.869 22.077 6.291 1.00 28.15 ? 65 ARG A CA 1 +ATOM 503 C C . ARG A 1 65 ? 30.426 22.514 6.156 1.00 28.98 ? 65 ARG A C 1 +ATOM 504 O O . ARG A 1 65 ? 29.664 21.765 5.486 1.00 33.85 ? 65 ARG A O 1 +ATOM 505 C CB . ARG A 1 65 ? 32.271 21.876 7.738 1.00 26.26 ? 65 ARG A CB 1 +ATOM 506 C CG . ARG A 1 65 ? 31.587 20.597 8.300 1.00 27.72 ? 65 ARG A CG 1 +ATOM 507 C CD . ARG A 1 65 ? 32.236 20.143 9.532 1.00 28.35 ? 65 ARG A CD 1 +ATOM 508 N NE . ARG A 1 65 ? 33.387 19.298 9.309 1.00 28.91 ? 65 ARG A NE 1 +ATOM 509 C CZ . ARG A 1 65 ? 34.280 19.032 10.254 1.00 28.73 ? 65 ARG A CZ 1 +ATOM 510 N NH1 . ARG A 1 65 ? 34.152 19.537 11.491 1.00 28.97 ? 65 ARG A NH1 1 +ATOM 511 N NH2 . ARG A 1 65 ? 35.283 18.239 9.956 1.00 30.76 ? 65 ARG A NH2 1 +ATOM 512 N N . PRO A 1 66 ? 30.105 23.655 6.774 1.00 24.59 ? 66 PRO A N 1 +ATOM 513 C CA . PRO A 1 66 ? 28.651 24.097 6.591 1.00 21.02 ? 66 PRO A CA 1 +ATOM 514 C C . PRO A 1 66 ? 28.571 24.332 5.079 1.00 20.27 ? 66 PRO A C 1 +ATOM 515 O O . PRO A 1 66 ? 29.179 25.298 4.576 1.00 20.38 ? 66 PRO A O 1 +ATOM 516 C CB . PRO A 1 66 ? 28.485 25.258 7.458 1.00 19.55 ? 66 PRO A CB 1 +ATOM 517 C CG . PRO A 1 66 ? 29.858 25.844 7.650 1.00 19.31 ? 66 PRO A CG 1 +ATOM 518 C CD . PRO A 1 66 ? 30.818 24.689 7.547 1.00 19.79 ? 66 PRO A CD 1 +ATOM 519 N N . LEU A 1 67 ? 27.970 23.365 4.423 1.00 16.85 ? 67 LEU A N 1 +ATOM 520 C CA . LEU A 1 67 ? 27.819 23.458 2.930 1.00 15.66 ? 67 LEU A CA 1 +ATOM 521 C C . LEU A 1 67 ? 27.170 24.820 2.669 1.00 13.66 ? 67 LEU A C 1 +ATOM 522 O O . LEU A 1 67 ? 26.039 25.064 3.115 1.00 13.94 ? 67 LEU A O 1 +ATOM 523 C CB . LEU A 1 67 ? 27.063 22.245 2.474 1.00 14.39 ? 67 LEU A CB 1 +ATOM 524 C CG . LEU A 1 67 ? 27.614 20.867 2.769 1.00 14.64 ? 67 LEU A CG 1 +ATOM 525 C CD1 . LEU A 1 67 ? 26.739 19.791 2.085 1.00 13.49 ? 67 LEU A CD1 1 +ATOM 526 C CD2 . LEU A 1 67 ? 29.040 20.757 2.237 1.00 14.74 ? 67 LEU A CD2 1 +ATOM 527 N N . LYS A 1 68 ? 27.938 25.683 2.045 1.00 13.94 ? 68 LYS A N 1 +ATOM 528 C CA . LYS A 1 68 ? 27.527 27.048 1.729 1.00 16.73 ? 68 LYS A CA 1 +ATOM 529 C C . LYS A 1 68 ? 26.265 27.051 0.877 1.00 18.29 ? 68 LYS A C 1 +ATOM 530 O O . LYS A 1 68 ? 26.110 26.269 -0.074 1.00 17.69 ? 68 LYS A O 1 +ATOM 531 C CB . LYS A 1 68 ? 28.639 27.840 1.070 1.00 18.81 ? 68 LYS A CB 1 +ATOM 532 C CG . LYS A 1 68 ? 28.769 27.835 -0.403 1.00 23.26 ? 68 LYS A CG 1 +ATOM 533 C CD . LYS A 1 68 ? 29.979 27.147 -0.972 1.00 24.83 ? 68 LYS A CD 1 +ATOM 534 C CE . LYS A 1 68 ? 31.196 28.001 -1.114 1.00 26.11 ? 68 LYS A CE 1 +ATOM 535 N NZ . LYS A 1 68 ? 30.904 29.251 -1.872 1.00 27.25 ? 68 LYS A NZ 1 +ATOM 536 N N . GLY A 1 69 ? 25.337 27.915 1.267 1.00 17.75 ? 69 GLY A N 1 +ATOM 537 C CA . GLY A 1 69 ? 24.080 28.146 0.613 1.00 17.13 ? 69 GLY A CA 1 +ATOM 538 C C . GLY A 1 69 ? 22.985 27.166 0.844 1.00 15.97 ? 69 GLY A C 1 +ATOM 539 O O . GLY A 1 69 ? 21.927 27.224 0.135 1.00 16.85 ? 69 GLY A O 1 +ATOM 540 N N . ARG A 1 70 ? 23.164 26.250 1.765 1.00 13.84 ? 70 ARG A N 1 +ATOM 541 C CA . ARG A 1 70 ? 22.161 25.224 2.108 1.00 12.95 ? 70 ARG A CA 1 +ATOM 542 C C . ARG A 1 70 ? 21.978 25.178 3.619 1.00 12.03 ? 70 ARG A C 1 +ATOM 543 O O . ARG A 1 70 ? 22.923 25.519 4.367 1.00 11.08 ? 70 ARG A O 1 +ATOM 544 C CB . ARG A 1 70 ? 22.618 23.844 1.582 1.00 12.58 ? 70 ARG A CB 1 +ATOM 545 C CG . ARG A 1 70 ? 22.868 23.806 0.082 1.00 10.35 ? 70 ARG A CG 1 +ATOM 546 C CD . ARG A 1 70 ? 23.945 22.891 -0.320 1.00 10.42 ? 70 ARG A CD 1 +ATOM 547 N NE . ARG A 1 70 ? 25.262 23.479 -0.382 1.00 7.61 ? 70 ARG A NE 1 +ATOM 548 C CZ . ARG A 1 70 ? 26.340 22.900 -0.902 1.00 9.90 ? 70 ARG A CZ 1 +ATOM 549 N NH1 . ARG A 1 70 ? 26.309 21.679 -1.449 1.00 10.89 ? 70 ARG A NH1 1 +ATOM 550 N NH2 . ARG A 1 70 ? 27.513 23.546 -0.878 1.00 9.39 ? 70 ARG A NH2 1 +ATOM 551 N N . ILE A 1 71 ? 20.779 24.814 4.038 1.00 11.40 ? 71 ILE A N 1 +ATOM 552 C CA . ILE A 1 71 ? 20.488 24.659 5.494 1.00 10.73 ? 71 ILE A CA 1 +ATOM 553 C C . ILE A 1 71 ? 20.985 23.244 5.855 1.00 11.18 ? 71 ILE A C 1 +ATOM 554 O O . ILE A 1 71 ? 20.561 22.272 5.210 1.00 11.85 ? 71 ILE A O 1 +ATOM 555 C CB . ILE A 1 71 ? 19.024 24.902 5.856 1.00 11.24 ? 71 ILE A CB 1 +ATOM 556 C CG1 . ILE A 1 71 ? 18.543 26.297 5.357 1.00 11.24 ? 71 ILE A CG1 1 +ATOM 557 C CG2 . ILE A 1 71 ? 18.761 24.766 7.398 1.00 11.89 ? 71 ILE A CG2 1 +ATOM 558 C CD1 . ILE A 1 71 ? 17.025 26.366 5.053 1.00 12.54 ? 71 ILE A CD1 1 +ATOM 559 N N . ASN A 1 72 ? 21.903 23.212 6.789 1.00 7.27 ? 72 ASN A N 1 +ATOM 560 C CA . ASN A 1 72 ? 22.572 21.974 7.207 1.00 5.39 ? 72 ASN A CA 1 +ATOM 561 C C . ASN A 1 72 ? 21.951 21.403 8.470 1.00 6.94 ? 72 ASN A C 1 +ATOM 562 O O . ASN A 1 72 ? 22.000 22.051 9.539 1.00 9.06 ? 72 ASN A O 1 +ATOM 563 C CB . ASN A 1 72 ? 24.082 22.225 7.347 1.00 7.17 ? 72 ASN A CB 1 +ATOM 564 C CG . ASN A 1 72 ? 24.840 22.469 6.082 1.00 8.32 ? 72 ASN A CG 1 +ATOM 565 O OD1 . ASN A 1 72 ? 25.694 21.650 5.676 1.00 9.73 ? 72 ASN A OD1 1 +ATOM 566 N ND2 . ASN A 1 72 ? 24.668 23.623 5.431 1.00 9.14 ? 72 ASN A ND2 1 +ATOM 567 N N . LEU A 1 73 ? 21.457 20.190 8.365 1.00 8.98 ? 73 LEU A N 1 +ATOM 568 C CA . LEU A 1 73 ? 20.856 19.457 9.482 1.00 9.87 ? 73 LEU A CA 1 +ATOM 569 C C . LEU A 1 73 ? 21.548 18.106 9.671 1.00 10.74 ? 73 LEU A C 1 +ATOM 570 O O . LEU A 1 73 ? 21.632 17.279 8.759 1.00 9.93 ? 73 LEU A O 1 +ATOM 571 C CB . LEU A 1 73 ? 19.345 19.360 9.264 1.00 8.91 ? 73 LEU A CB 1 +ATOM 572 C CG . LEU A 1 73 ? 18.555 18.692 10.391 1.00 10.36 ? 73 LEU A CG 1 +ATOM 573 C CD1 . LEU A 1 73 ? 17.100 19.037 10.333 1.00 11.17 ? 73 LEU A CD1 1 +ATOM 574 C CD2 . LEU A 1 73 ? 18.757 17.179 10.298 1.00 11.34 ? 73 LEU A CD2 1 +ATOM 575 N N . VAL A 1 74 ? 22.024 17.918 10.897 1.00 11.18 ? 74 VAL A N 1 +ATOM 576 C CA . VAL A 1 74 ? 22.712 16.698 11.323 1.00 10.81 ? 74 VAL A CA 1 +ATOM 577 C C . VAL A 1 74 ? 21.755 15.810 12.117 1.00 12.57 ? 74 VAL A C 1 +ATOM 578 O O . VAL A 1 74 ? 20.986 16.306 12.969 1.00 11.78 ? 74 VAL A O 1 +ATOM 579 C CB . VAL A 1 74 ? 23.996 17.060 12.108 1.00 9.22 ? 74 VAL A CB 1 +ATOM 580 C CG1 . VAL A 1 74 ? 24.728 15.839 12.638 1.00 3.09 ? 74 VAL A CG1 1 +ATOM 581 C CG2 . VAL A 1 74 ? 24.932 17.923 11.273 1.00 5.32 ? 74 VAL A CG2 1 +ATOM 582 N N . LEU A 1 75 ? 21.832 14.526 11.840 1.00 11.56 ? 75 LEU A N 1 +ATOM 583 C CA . LEU A 1 75 ? 21.017 13.506 12.498 1.00 14.04 ? 75 LEU A CA 1 +ATOM 584 C C . LEU A 1 75 ? 21.915 12.716 13.471 1.00 15.75 ? 75 LEU A C 1 +ATOM 585 O O . LEU A 1 75 ? 22.947 12.165 13.069 1.00 14.49 ? 75 LEU A O 1 +ATOM 586 C CB . LEU A 1 75 ? 20.337 12.652 11.449 1.00 14.04 ? 75 LEU A CB 1 +ATOM 587 C CG . LEU A 1 75 ? 19.335 13.252 10.501 1.00 13.73 ? 75 LEU A CG 1 +ATOM 588 C CD1 . LEU A 1 75 ? 18.921 12.197 9.446 1.00 14.30 ? 75 LEU A CD1 1 +ATOM 589 C CD2 . LEU A 1 75 ? 18.085 13.678 11.260 1.00 11.12 ? 75 LEU A CD2 1 +ATOM 590 N N . SER A 1 76 ? 21.435 12.653 14.698 1.00 16.11 ? 76 SER A N 1 +ATOM 591 C CA . SER A 1 76 ? 22.171 11.984 15.787 1.00 18.48 ? 76 SER A CA 1 +ATOM 592 C C . SER A 1 76 ? 21.267 11.822 17.010 1.00 20.31 ? 76 SER A C 1 +ATOM 593 O O . SER A 1 76 ? 20.342 12.613 17.243 1.00 21.98 ? 76 SER A O 1 +ATOM 594 C CB . SER A 1 76 ? 23.383 12.864 16.147 1.00 16.03 ? 76 SER A CB 1 +ATOM 595 O OG . SER A 1 76 ? 24.246 12.303 17.061 1.00 14.87 ? 76 SER A OG 1 +ATOM 596 N N . ARG A 1 77 ? 21.593 10.828 17.792 1.00 24.52 ? 77 ARG A N 1 +ATOM 597 C CA . ARG A 1 77 ? 20.899 10.511 19.055 1.00 27.15 ? 77 ARG A CA 1 +ATOM 598 C C . ARG A 1 77 ? 21.860 10.765 20.218 1.00 26.35 ? 77 ARG A C 1 +ATOM 599 O O . ARG A 1 77 ? 21.417 10.880 21.358 1.00 27.56 ? 77 ARG A O 1 +ATOM 600 C CB . ARG A 1 77 ? 20.425 9.066 19.084 1.00 28.86 ? 77 ARG A CB 1 +ATOM 601 C CG . ARG A 1 77 ? 18.954 8.811 19.033 1.00 31.39 ? 77 ARG A CG 1 +ATOM 602 C CD . ARG A 1 77 ? 18.603 7.607 18.201 1.00 33.90 ? 77 ARG A CD 1 +ATOM 603 N NE . ARG A 1 77 ? 18.463 7.965 16.802 1.00 35.59 ? 77 ARG A NE 1 +ATOM 604 C CZ . ARG A 1 77 ? 18.358 7.129 15.793 1.00 38.34 ? 77 ARG A CZ 1 +ATOM 605 N NH1 . ARG A 1 77 ? 18.362 5.796 15.970 1.00 39.99 ? 77 ARG A NH1 1 +ATOM 606 N NH2 . ARG A 1 77 ? 18.252 7.579 14.530 1.00 38.11 ? 77 ARG A NH2 1 +ATOM 607 N N . GLU A 1 78 ? 23.137 10.809 19.887 1.00 25.82 ? 78 GLU A N 1 +ATOM 608 C CA . GLU A 1 78 ? 24.220 10.988 20.847 1.00 26.12 ? 78 GLU A CA 1 +ATOM 609 C C . GLU A 1 78 ? 24.431 12.445 21.191 1.00 25.59 ? 78 GLU A C 1 +ATOM 610 O O . GLU A 1 78 ? 24.590 12.819 22.381 1.00 25.83 ? 78 GLU A O 1 +ATOM 611 C CB . GLU A 1 78 ? 25.571 10.437 20.316 1.00 25.54 ? 78 GLU A CB 1 +ATOM 612 C CG . GLU A 1 78 ? 25.979 9.059 20.723 1.00 28.68 ? 78 GLU A CG 1 +ATOM 613 C CD . GLU A 1 78 ? 27.306 8.490 20.523 1.00 30.44 ? 78 GLU A CD 1 +ATOM 614 O OE1 . GLU A 1 78 ? 28.381 9.026 20.350 1.00 29.97 ? 78 GLU A OE1 1 +ATOM 615 O OE2 . GLU A 1 78 ? 27.302 7.186 20.586 1.00 32.17 ? 78 GLU A OE2 1 +ATOM 616 N N . LEU A 1 79 ? 24.433 13.258 20.162 1.00 25.18 ? 79 LEU A N 1 +ATOM 617 C CA . LEU A 1 79 ? 24.655 14.700 20.222 1.00 24.91 ? 79 LEU A CA 1 +ATOM 618 C C . LEU A 1 79 ? 23.521 15.372 21.014 1.00 24.25 ? 79 LEU A C 1 +ATOM 619 O O . LEU A 1 79 ? 22.367 14.951 20.906 1.00 24.13 ? 79 LEU A O 1 +ATOM 620 C CB . LEU A 1 79 ? 24.774 15.202 18.790 1.00 24.95 ? 79 LEU A CB 1 +ATOM 621 C CG . LEU A 1 79 ? 26.073 15.640 18.202 1.00 25.79 ? 79 LEU A CG 1 +ATOM 622 C CD1 . LEU A 1 79 ? 27.297 15.198 18.975 1.00 26.23 ? 79 LEU A CD1 1 +ATOM 623 C CD2 . LEU A 1 79 ? 26.160 15.094 16.763 1.00 25.33 ? 79 LEU A CD2 1 +ATOM 624 N N . LYS A 1 80 ? 23.906 16.411 21.719 1.00 23.10 ? 80 LYS A N 1 +ATOM 625 C CA . LYS A 1 80 ? 22.950 17.200 22.538 1.00 23.28 ? 80 LYS A CA 1 +ATOM 626 C C . LYS A 1 80 ? 22.666 18.527 21.833 1.00 21.89 ? 80 LYS A C 1 +ATOM 627 O O . LYS A 1 80 ? 21.624 19.167 22.031 1.00 18.90 ? 80 LYS A O 1 +ATOM 628 C CB . LYS A 1 80 ? 23.491 17.419 23.921 1.00 24.78 ? 80 LYS A CB 1 +ATOM 629 C CG . LYS A 1 80 ? 23.516 18.802 24.494 1.00 26.19 ? 80 LYS A CG 1 +ATOM 630 C CD . LYS A 1 80 ? 23.418 18.730 26.042 1.00 28.48 ? 80 LYS A CD 1 +ATOM 631 C CE . LYS A 1 80 ? 24.688 18.203 26.659 1.00 28.92 ? 80 LYS A CE 1 +ATOM 632 N NZ . LYS A 1 80 ? 24.687 18.534 28.134 1.00 29.88 ? 80 LYS A NZ 1 +ATOM 633 N N . GLU A 1 81 ? 23.594 18.867 20.963 1.00 20.64 ? 81 GLU A N 1 +ATOM 634 C CA . GLU A 1 81 ? 23.562 20.140 20.200 1.00 20.27 ? 81 GLU A CA 1 +ATOM 635 C C . GLU A 1 81 ? 24.246 19.919 18.855 1.00 18.48 ? 81 GLU A C 1 +ATOM 636 O O . GLU A 1 81 ? 25.125 19.056 18.771 1.00 19.00 ? 81 GLU A O 1 +ATOM 637 C CB . GLU A 1 81 ? 24.404 21.130 20.983 1.00 22.60 ? 81 GLU A CB 1 +ATOM 638 C CG . GLU A 1 81 ? 24.351 22.590 20.836 1.00 26.88 ? 81 GLU A CG 1 +ATOM 639 C CD . GLU A 1 81 ? 25.654 23.331 21.113 1.00 28.41 ? 81 GLU A CD 1 +ATOM 640 O OE1 . GLU A 1 81 ? 25.943 24.376 20.603 1.00 31.46 ? 81 GLU A OE1 1 +ATOM 641 O OE2 . GLU A 1 81 ? 26.377 22.686 21.894 1.00 29.79 ? 81 GLU A OE2 1 +ATOM 642 N N . PRO A 1 82 ? 23.831 20.688 17.855 1.00 18.86 ? 82 PRO A N 1 +ATOM 643 C CA . PRO A 1 82 ? 24.441 20.588 16.514 1.00 17.39 ? 82 PRO A CA 1 +ATOM 644 C C . PRO A 1 82 ? 25.929 20.916 16.606 1.00 15.92 ? 82 PRO A C 1 +ATOM 645 O O . PRO A 1 82 ? 26.309 21.878 17.302 1.00 15.31 ? 82 PRO A O 1 +ATOM 646 C CB . PRO A 1 82 ? 23.697 21.590 15.667 1.00 17.77 ? 82 PRO A CB 1 +ATOM 647 C CG . PRO A 1 82 ? 23.005 22.506 16.603 1.00 17.04 ? 82 PRO A CG 1 +ATOM 648 C CD . PRO A 1 82 ? 22.772 21.732 17.871 1.00 17.97 ? 82 PRO A CD 1 +ATOM 649 N N . PRO A 1 83 ? 26.718 20.127 15.909 1.00 16.05 ? 83 PRO A N 1 +ATOM 650 C CA . PRO A 1 83 ? 28.183 20.342 15.874 1.00 17.93 ? 83 PRO A CA 1 +ATOM 651 C C . PRO A 1 83 ? 28.458 21.767 15.415 1.00 18.85 ? 83 PRO A C 1 +ATOM 652 O O . PRO A 1 83 ? 27.595 22.388 14.775 1.00 21.39 ? 83 PRO A O 1 +ATOM 653 C CB . PRO A 1 83 ? 28.709 19.311 14.904 1.00 16.70 ? 83 PRO A CB 1 +ATOM 654 C CG . PRO A 1 83 ? 27.509 18.941 14.054 1.00 16.14 ? 83 PRO A CG 1 +ATOM 655 C CD . PRO A 1 83 ? 26.353 18.960 15.078 1.00 16.93 ? 83 PRO A CD 1 +ATOM 656 N N . GLN A 1 84 ? 29.656 22.230 15.732 1.00 19.95 ? 84 GLN A N 1 +ATOM 657 C CA . GLN A 1 84 ? 30.063 23.606 15.303 1.00 20.39 ? 84 GLN A CA 1 +ATOM 658 C C . GLN A 1 84 ? 29.905 23.631 13.769 1.00 18.90 ? 84 GLN A C 1 +ATOM 659 O O . GLN A 1 84 ? 30.219 22.641 13.106 1.00 18.57 ? 84 GLN A O 1 +ATOM 660 C CB . GLN A 1 84 ? 31.442 23.960 15.761 1.00 22.68 ? 84 GLN A CB 1 +ATOM 661 C CG . GLN A 1 84 ? 32.289 24.760 14.774 1.00 25.93 ? 84 GLN A CG 1 +ATOM 662 C CD . GLN A 1 84 ? 33.530 25.325 15.458 1.00 28.19 ? 84 GLN A CD 1 +ATOM 663 O OE1 . GLN A 1 84 ? 34.651 24.884 15.219 1.00 29.83 ? 84 GLN A OE1 1 +ATOM 664 N NE2 . GLN A 1 84 ? 33.293 26.290 16.324 1.00 28.71 ? 84 GLN A NE2 1 +ATOM 665 N N . GLY A 1 85 ? 29.400 24.744 13.283 1.00 16.18 ? 85 GLY A N 1 +ATOM 666 C CA . GLY A 1 85 ? 29.166 25.010 11.892 1.00 13.53 ? 85 GLY A CA 1 +ATOM 667 C C . GLY A 1 85 ? 27.814 24.568 11.381 1.00 12.54 ? 85 GLY A C 1 +ATOM 668 O O . GLY A 1 85 ? 27.379 25.042 10.317 1.00 12.19 ? 85 GLY A O 1 +ATOM 669 N N . ALA A 1 86 ? 27.164 23.662 12.098 1.00 10.01 ? 86 ALA A N 1 +ATOM 670 C CA . ALA A 1 86 ? 25.861 23.121 11.743 1.00 9.94 ? 86 ALA A CA 1 +ATOM 671 C C . ALA A 1 86 ? 24.741 23.992 12.299 1.00 11.23 ? 86 ALA A C 1 +ATOM 672 O O . ALA A 1 86 ? 24.828 24.538 13.400 1.00 10.91 ? 86 ALA A O 1 +ATOM 673 C CB . ALA A 1 86 ? 25.714 21.674 12.191 1.00 9.79 ? 86 ALA A CB 1 +ATOM 674 N N . HIS A 1 87 ? 23.663 24.052 11.531 1.00 13.01 ? 87 HIS A N 1 +ATOM 675 C CA . HIS A 1 87 ? 22.491 24.835 11.763 1.00 12.26 ? 87 HIS A CA 1 +ATOM 676 C C . HIS A 1 87 ? 21.418 24.201 12.619 1.00 12.36 ? 87 HIS A C 1 +ATOM 677 O O . HIS A 1 87 ? 20.853 24.915 13.492 1.00 15.46 ? 87 HIS A O 1 +ATOM 678 C CB . HIS A 1 87 ? 21.782 25.290 10.432 1.00 10.03 ? 87 HIS A CB 1 +ATOM 679 C CG . HIS A 1 87 ? 22.705 25.955 9.476 1.00 9.45 ? 87 HIS A CG 1 +ATOM 680 N ND1 . HIS A 1 87 ? 23.516 27.016 9.756 1.00 10.29 ? 87 HIS A ND1 1 +ATOM 681 C CD2 . HIS A 1 87 ? 22.901 25.683 8.152 1.00 9.78 ? 87 HIS A CD2 1 +ATOM 682 C CE1 . HIS A 1 87 ? 24.171 27.378 8.667 1.00 10.43 ? 87 HIS A CE1 1 +ATOM 683 N NE2 . HIS A 1 87 ? 23.806 26.585 7.675 1.00 10.80 ? 87 HIS A NE2 1 +ATOM 684 N N . PHE A 1 88 ? 21.048 22.985 12.328 1.00 12.92 ? 88 PHE A N 1 +ATOM 685 C CA . PHE A 1 88 ? 19.993 22.262 13.056 1.00 12.94 ? 88 PHE A CA 1 +ATOM 686 C C . PHE A 1 88 ? 20.463 20.824 13.322 1.00 13.02 ? 88 PHE A C 1 +ATOM 687 O O . PHE A 1 88 ? 21.370 20.315 12.666 1.00 11.48 ? 88 PHE A O 1 +ATOM 688 C CB . PHE A 1 88 ? 18.633 22.277 12.348 1.00 14.31 ? 88 PHE A CB 1 +ATOM 689 C CG . PHE A 1 88 ? 18.031 23.630 12.139 1.00 14.88 ? 88 PHE A CG 1 +ATOM 690 C CD1 . PHE A 1 88 ? 17.164 24.165 13.089 1.00 14.25 ? 88 PHE A CD1 1 +ATOM 691 C CD2 . PHE A 1 88 ? 18.365 24.384 11.006 1.00 14.96 ? 88 PHE A CD2 1 +ATOM 692 C CE1 . PHE A 1 88 ? 16.626 25.436 12.934 1.00 14.11 ? 88 PHE A CE1 1 +ATOM 693 C CE2 . PHE A 1 88 ? 17.827 25.670 10.832 1.00 12.66 ? 88 PHE A CE2 1 +ATOM 694 C CZ . PHE A 1 88 ? 16.964 26.185 11.795 1.00 12.21 ? 88 PHE A CZ 1 +ATOM 695 N N . LEU A 1 89 ? 19.808 20.234 14.306 1.00 11.61 ? 89 LEU A N 1 +ATOM 696 C CA . LEU A 1 89 ? 20.040 18.872 14.731 1.00 13.08 ? 89 LEU A CA 1 +ATOM 697 C C . LEU A 1 89 ? 18.692 18.166 14.894 1.00 13.83 ? 89 LEU A C 1 +ATOM 698 O O . LEU A 1 89 ? 17.696 18.833 15.235 1.00 17.70 ? 89 LEU A O 1 +ATOM 699 C CB . LEU A 1 89 ? 20.856 18.870 16.054 1.00 13.57 ? 89 LEU A CB 1 +ATOM 700 C CG . LEU A 1 89 ? 21.039 17.437 16.631 1.00 12.58 ? 89 LEU A CG 1 +ATOM 701 C CD1 . LEU A 1 89 ? 22.180 16.747 15.909 1.00 13.08 ? 89 LEU A CD1 1 +ATOM 702 C CD2 . LEU A 1 89 ? 21.277 17.536 18.109 1.00 11.64 ? 89 LEU A CD2 1 +ATOM 703 N N . SER A 1 90 ? 18.718 16.878 14.665 1.00 14.78 ? 90 SER A N 1 +ATOM 704 C CA . SER A 1 90 ? 17.516 16.041 14.809 1.00 13.30 ? 90 SER A CA 1 +ATOM 705 C C . SER A 1 90 ? 17.931 14.647 15.267 1.00 13.83 ? 90 SER A C 1 +ATOM 706 O O . SER A 1 90 ? 19.058 14.186 15.048 1.00 13.55 ? 90 SER A O 1 +ATOM 707 C CB . SER A 1 90 ? 16.658 16.026 13.574 1.00 14.73 ? 90 SER A CB 1 +ATOM 708 O OG . SER A 1 90 ? 15.939 17.254 13.442 1.00 16.01 ? 90 SER A OG 1 +ATOM 709 N N . ARG A 1 91 ? 16.991 14.027 15.945 1.00 16.94 ? 91 ARG A N 1 +ATOM 710 C CA . ARG A 1 91 ? 17.104 12.690 16.500 1.00 18.65 ? 91 ARG A CA 1 +ATOM 711 C C . ARG A 1 91 ? 16.911 11.645 15.411 1.00 20.51 ? 91 ARG A C 1 +ATOM 712 O O . ARG A 1 91 ? 17.602 10.603 15.441 1.00 22.18 ? 91 ARG A O 1 +ATOM 713 C CB . ARG A 1 91 ? 16.082 12.484 17.629 1.00 20.66 ? 91 ARG A CB 1 +ATOM 714 C CG . ARG A 1 91 ? 16.515 13.135 18.956 1.00 24.77 ? 91 ARG A CG 1 +ATOM 715 C CD . ARG A 1 91 ? 16.243 12.189 20.101 1.00 27.34 ? 91 ARG A CD 1 +ATOM 716 N NE . ARG A 1 91 ? 16.566 12.775 21.363 1.00 30.14 ? 91 ARG A NE 1 +ATOM 717 C CZ . ARG A 1 91 ? 15.964 12.623 22.519 1.00 32.72 ? 91 ARG A CZ 1 +ATOM 718 N NH1 . ARG A 1 91 ? 14.887 11.860 22.691 1.00 34.26 ? 91 ARG A NH1 1 +ATOM 719 N NH2 . ARG A 1 91 ? 16.443 13.290 23.593 1.00 33.85 ? 91 ARG A NH2 1 +ATOM 720 N N . SER A 1 92 ? 16.031 11.966 14.473 1.00 20.85 ? 92 SER A N 1 +ATOM 721 C CA . SER A 1 92 ? 15.742 11.048 13.340 1.00 22.76 ? 92 SER A CA 1 +ATOM 722 C C . SER A 1 92 ? 15.219 11.803 12.132 1.00 22.36 ? 92 SER A C 1 +ATOM 723 O O . SER A 1 92 ? 15.028 13.028 12.160 1.00 20.90 ? 92 SER A O 1 +ATOM 724 C CB . SER A 1 92 ? 14.747 9.985 13.791 1.00 23.46 ? 92 SER A CB 1 +ATOM 725 O OG . SER A 1 92 ? 13.503 10.640 14.124 1.00 27.33 ? 92 SER A OG 1 +ATOM 726 N N . LEU A 1 93 ? 14.977 11.034 11.049 1.00 22.27 ? 93 LEU A N 1 +ATOM 727 C CA . LEU A 1 93 ? 14.460 11.597 9.806 1.00 21.83 ? 93 LEU A CA 1 +ATOM 728 C C . LEU A 1 93 ? 13.039 12.094 9.941 1.00 21.33 ? 93 LEU A C 1 +ATOM 729 O O . LEU A 1 93 ? 12.728 13.215 9.489 1.00 22.18 ? 93 LEU A O 1 +ATOM 730 C CB . LEU A 1 93 ? 14.638 10.609 8.632 1.00 21.16 ? 93 LEU A CB 1 +ATOM 731 C CG . LEU A 1 93 ? 14.442 11.283 7.252 1.00 20.99 ? 93 LEU A CG 1 +ATOM 732 C CD1 . LEU A 1 93 ? 15.774 11.846 6.763 1.00 21.65 ? 93 LEU A CD1 1 +ATOM 733 C CD2 . LEU A 1 93 ? 13.888 10.280 6.273 1.00 21.05 ? 93 LEU A CD2 1 +ATOM 734 N N . ASP A 1 94 ? 12.185 11.252 10.521 1.00 24.42 ? 94 ASP A N 1 +ATOM 735 C CA . ASP A 1 94 ? 10.760 11.608 10.707 1.00 25.80 ? 94 ASP A CA 1 +ATOM 736 C C . ASP A 1 94 ? 10.665 12.861 11.588 1.00 26.14 ? 94 ASP A C 1 +ATOM 737 O O . ASP A 1 94 ? 9.634 13.557 11.568 1.00 27.64 ? 94 ASP A O 1 +ATOM 738 C CB . ASP A 1 94 ? 9.942 10.450 11.230 1.00 26.92 ? 94 ASP A CB 1 +ATOM 739 C CG . ASP A 1 94 ? 9.872 9.227 10.390 1.00 28.45 ? 94 ASP A CG 1 +ATOM 740 O OD1 . ASP A 1 94 ? 9.406 8.154 10.845 1.00 29.04 ? 94 ASP A OD1 1 +ATOM 741 O OD2 . ASP A 1 94 ? 10.295 9.292 9.206 1.00 29.60 ? 94 ASP A OD2 1 +ATOM 742 N N . ASP A 1 95 ? 11.684 13.046 12.397 1.00 25.29 ? 95 ASP A N 1 +ATOM 743 C CA . ASP A 1 95 ? 11.770 14.220 13.295 1.00 24.67 ? 95 ASP A CA 1 +ATOM 744 C C . ASP A 1 95 ? 12.251 15.428 12.478 1.00 24.26 ? 95 ASP A C 1 +ATOM 745 O O . ASP A 1 95 ? 11.779 16.550 12.673 1.00 24.36 ? 95 ASP A O 1 +ATOM 746 C CB . ASP A 1 95 ? 12.623 13.916 14.507 1.00 26.04 ? 95 ASP A CB 1 +ATOM 747 C CG . ASP A 1 95 ? 11.904 13.132 15.596 1.00 27.43 ? 95 ASP A CG 1 +ATOM 748 O OD1 . ASP A 1 95 ? 12.179 13.330 16.782 1.00 27.57 ? 95 ASP A OD1 1 +ATOM 749 O OD2 . ASP A 1 95 ? 11.048 12.299 15.228 1.00 27.92 ? 95 ASP A OD2 1 +ATOM 750 N N . ALA A 1 96 ? 13.175 15.139 11.564 1.00 22.35 ? 96 ALA A N 1 +ATOM 751 C CA . ALA A 1 96 ? 13.780 16.140 10.702 1.00 23.73 ? 96 ALA A CA 1 +ATOM 752 C C . ALA A 1 96 ? 12.817 16.676 9.653 1.00 23.35 ? 96 ALA A C 1 +ATOM 753 O O . ALA A 1 96 ? 12.866 17.874 9.317 1.00 21.33 ? 96 ALA A O 1 +ATOM 754 C CB . ALA A 1 96 ? 15.058 15.602 10.052 1.00 24.65 ? 96 ALA A CB 1 +ATOM 755 N N . LEU A 1 97 ? 11.967 15.787 9.165 1.00 23.34 ? 97 LEU A N 1 +ATOM 756 C CA . LEU A 1 97 ? 10.967 16.133 8.140 1.00 24.50 ? 97 LEU A CA 1 +ATOM 757 C C . LEU A 1 97 ? 9.830 16.941 8.734 1.00 24.18 ? 97 LEU A C 1 +ATOM 758 O O . LEU A 1 97 ? 9.331 17.898 8.099 1.00 24.90 ? 97 LEU A O 1 +ATOM 759 C CB . LEU A 1 97 ? 10.575 14.837 7.413 1.00 23.64 ? 97 LEU A CB 1 +ATOM 760 C CG . LEU A 1 97 ? 11.715 14.070 6.753 1.00 22.89 ? 97 LEU A CG 1 +ATOM 761 C CD1 . LEU A 1 97 ? 11.262 12.735 6.191 1.00 20.40 ? 97 LEU A CD1 1 +ATOM 762 C CD2 . LEU A 1 97 ? 12.309 14.938 5.657 1.00 22.61 ? 97 LEU A CD2 1 +ATOM 763 N N . LYS A 1 98 ? 9.428 16.586 9.937 1.00 24.51 ? 98 LYS A N 1 +ATOM 764 C CA . LYS A 1 98 ? 8.357 17.271 10.667 1.00 25.95 ? 98 LYS A CA 1 +ATOM 765 C C . LYS A 1 98 ? 8.757 18.725 10.934 1.00 26.85 ? 98 LYS A C 1 +ATOM 766 O O . LYS A 1 98 ? 7.934 19.640 10.912 1.00 26.83 ? 98 LYS A O 1 +ATOM 767 C CB . LYS A 1 98 ? 8.053 16.611 12.000 1.00 27.79 ? 98 LYS A CB 1 +ATOM 768 C CG . LYS A 1 98 ? 7.123 15.409 11.925 1.00 30.21 ? 98 LYS A CG 1 +ATOM 769 C CD . LYS A 1 98 ? 7.037 14.721 13.297 1.00 31.41 ? 98 LYS A CD 1 +ATOM 770 C CE . LYS A 1 98 ? 6.145 13.495 13.226 1.00 33.23 ? 98 LYS A CE 1 +ATOM 771 N NZ . LYS A 1 98 ? 5.995 13.037 11.845 1.00 33.81 ? 98 LYS A NZ 1 +ATOM 772 N N . LEU A 1 99 ? 10.040 18.871 11.187 1.00 27.89 ? 99 LEU A N 1 +ATOM 773 C CA . LEU A 1 99 ? 10.669 20.175 11.496 1.00 28.16 ? 99 LEU A CA 1 +ATOM 774 C C . LEU A 1 99 ? 10.517 21.122 10.322 1.00 30.53 ? 99 LEU A C 1 +ATOM 775 O O . LEU A 1 99 ? 10.279 22.326 10.500 1.00 31.22 ? 99 LEU A O 1 +ATOM 776 C CB . LEU A 1 99 ? 12.091 19.867 11.919 1.00 26.26 ? 99 LEU A CB 1 +ATOM 777 C CG . LEU A 1 99 ? 13.123 20.792 12.344 1.00 25.42 ? 99 LEU A CG 1 +ATOM 778 C CD1 . LEU A 1 99 ? 14.353 20.811 11.402 1.00 24.23 ? 99 LEU A CD1 1 +ATOM 779 C CD2 . LEU A 1 99 ? 12.622 22.236 12.476 1.00 25.43 ? 99 LEU A CD2 1 +ATOM 780 N N . THR A 1 100 ? 10.633 20.573 9.121 1.00 32.49 ? 100 THR A N 1 +ATOM 781 C CA . THR A 1 100 ? 10.596 21.278 7.861 1.00 33.96 ? 100 THR A CA 1 +ATOM 782 C C . THR A 1 100 ? 9.319 21.979 7.517 1.00 35.55 ? 100 THR A C 1 +ATOM 783 O O . THR A 1 100 ? 9.306 22.804 6.547 1.00 35.28 ? 100 THR A O 1 +ATOM 784 C CB . THR A 1 100 ? 11.058 20.319 6.657 1.00 33.68 ? 100 THR A CB 1 +ATOM 785 O OG1 . THR A 1 100 ? 12.346 19.760 7.080 1.00 33.34 ? 100 THR A OG1 1 +ATOM 786 C CG2 . THR A 1 100 ? 11.211 21.039 5.330 1.00 35.18 ? 100 THR A CG2 1 +ATOM 787 N N . GLU A 1 101 ? 8.246 21.740 8.254 1.00 37.89 ? 101 GLU A N 1 +ATOM 788 C CA . GLU A 1 101 ? 6.951 22.381 7.987 1.00 39.56 ? 101 GLU A CA 1 +ATOM 789 C C . GLU A 1 101 ? 6.473 23.233 9.151 1.00 40.10 ? 101 GLU A C 1 +ATOM 790 O O . GLU A 1 101 ? 5.362 23.828 9.046 1.00 40.23 ? 101 GLU A O 1 +ATOM 791 C CB . GLU A 1 101 ? 5.847 21.383 7.693 1.00 41.16 ? 101 GLU A CB 1 +ATOM 792 C CG . GLU A 1 101 ? 5.235 20.697 8.939 1.00 43.04 ? 101 GLU A CG 1 +ATOM 793 C CD . GLU A 1 101 ? 5.032 19.203 8.698 1.00 45.24 ? 101 GLU A CD 1 +ATOM 794 O OE1 . GLU A 1 101 ? 5.317 18.681 7.634 1.00 44.85 ? 101 GLU A OE1 1 +ATOM 795 O OE2 . GLU A 1 101 ? 4.558 18.667 9.705 1.00 46.72 ? 101 GLU A OE2 1 +ATOM 796 N N . GLN A 1 102 ? 7.256 23.244 10.197 1.00 40.07 ? 102 GLN A N 1 +ATOM 797 C CA . GLN A 1 102 ? 6.872 24.124 11.375 1.00 42.79 ? 102 GLN A CA 1 +ATOM 798 C C . GLN A 1 102 ? 7.378 25.495 11.032 1.00 42.90 ? 102 GLN A C 1 +ATOM 799 O O . GLN A 1 102 ? 8.123 25.615 9.999 1.00 43.27 ? 102 GLN A O 1 +ATOM 800 C CB . GLN A 1 102 ? 7.210 23.501 12.678 1.00 43.69 ? 102 GLN A CB 1 +ATOM 801 C CG . GLN A 1 102 ? 6.163 22.472 13.098 1.00 44.96 ? 102 GLN A CG 1 +ATOM 802 C CD . GLN A 1 102 ? 6.237 21.995 14.491 1.00 45.82 ? 102 GLN A CD 1 +ATOM 803 O OE1 . GLN A 1 102 ? 5.454 21.098 14.903 1.00 46.80 ? 102 GLN A OE1 1 +ATOM 804 N NE2 . GLN A 1 102 ? 7.151 22.539 15.285 1.00 45.68 ? 102 GLN A NE2 1 +ATOM 805 N N . PRO A 1 103 ? 6.890 26.515 11.687 1.00 43.43 ? 103 PRO A N 1 +ATOM 806 C CA . PRO A 1 103 ? 7.280 27.905 11.383 1.00 43.45 ? 103 PRO A CA 1 +ATOM 807 C C . PRO A 1 103 ? 8.702 27.969 10.870 1.00 43.55 ? 103 PRO A C 1 +ATOM 808 O O . PRO A 1 103 ? 8.952 28.220 9.666 1.00 43.27 ? 103 PRO A O 1 +ATOM 809 C CB . PRO A 1 103 ? 7.055 28.671 12.664 1.00 43.33 ? 103 PRO A CB 1 +ATOM 810 C CG . PRO A 1 103 ? 6.705 27.640 13.713 1.00 43.53 ? 103 PRO A CG 1 +ATOM 811 C CD . PRO A 1 103 ? 5.980 26.547 12.886 1.00 44.01 ? 103 PRO A CD 1 +ATOM 812 N N . GLU A 1 104 ? 9.643 27.767 11.761 1.00 43.12 ? 104 GLU A N 1 +ATOM 813 C CA . GLU A 1 104 ? 11.050 27.836 11.587 1.00 43.58 ? 104 GLU A CA 1 +ATOM 814 C C . GLU A 1 104 ? 11.585 27.553 10.209 1.00 42.49 ? 104 GLU A C 1 +ATOM 815 O O . GLU A 1 104 ? 12.514 28.305 9.786 1.00 41.57 ? 104 GLU A O 1 +ATOM 816 C CB . GLU A 1 104 ? 11.847 26.966 12.589 1.00 44.55 ? 104 GLU A CB 1 +ATOM 817 C CG . GLU A 1 104 ? 11.117 26.442 13.782 1.00 46.04 ? 104 GLU A CG 1 +ATOM 818 C CD . GLU A 1 104 ? 11.689 25.344 14.587 1.00 47.45 ? 104 GLU A CD 1 +ATOM 819 O OE1 . GLU A 1 104 ? 11.067 24.746 15.461 1.00 47.89 ? 104 GLU A OE1 1 +ATOM 820 O OE2 . GLU A 1 104 ? 12.892 25.090 14.317 1.00 48.25 ? 104 GLU A OE2 1 +ATOM 821 N N . LEU A 1 105 ? 11.069 26.554 9.517 1.00 40.69 ? 105 LEU A N 1 +ATOM 822 C CA . LEU A 1 105 ? 11.556 26.185 8.194 1.00 40.05 ? 105 LEU A CA 1 +ATOM 823 C C . LEU A 1 105 ? 10.540 26.128 7.095 1.00 39.65 ? 105 LEU A C 1 +ATOM 824 O O . LEU A 1 105 ? 10.948 26.245 5.883 1.00 40.54 ? 105 LEU A O 1 +ATOM 825 C CB . LEU A 1 105 ? 12.362 24.864 8.365 1.00 38.98 ? 105 LEU A CB 1 +ATOM 826 C CG . LEU A 1 105 ? 13.704 25.025 9.086 1.00 38.62 ? 105 LEU A CG 1 +ATOM 827 C CD1 . LEU A 1 105 ? 14.286 23.678 9.460 1.00 38.30 ? 105 LEU A CD1 1 +ATOM 828 C CD2 . LEU A 1 105 ? 14.653 25.779 8.154 1.00 38.02 ? 105 LEU A CD2 1 +ATOM 829 N N . ALA A 1 106 ? 9.297 25.909 7.369 1.00 40.16 ? 106 ALA A N 1 +ATOM 830 C CA . ALA A 1 106 ? 8.195 25.733 6.457 1.00 39.23 ? 106 ALA A CA 1 +ATOM 831 C C . ALA A 1 106 ? 8.188 26.585 5.217 1.00 38.76 ? 106 ALA A C 1 +ATOM 832 O O . ALA A 1 106 ? 7.918 26.045 4.084 1.00 39.13 ? 106 ALA A O 1 +ATOM 833 C CB . ALA A 1 106 ? 6.847 25.892 7.203 1.00 39.11 ? 106 ALA A CB 1 +ATOM 834 N N . ASN A 1 107 ? 8.394 27.855 5.351 1.00 37.01 ? 107 ASN A N 1 +ATOM 835 C CA . ASN A 1 107 ? 8.387 28.846 4.288 1.00 36.61 ? 107 ASN A CA 1 +ATOM 836 C C . ASN A 1 107 ? 9.715 28.855 3.522 1.00 35.02 ? 107 ASN A C 1 +ATOM 837 O O . ASN A 1 107 ? 9.748 28.862 2.294 1.00 35.82 ? 107 ASN A O 1 +ATOM 838 C CB . ASN A 1 107 ? 8.076 30.254 4.869 1.00 38.41 ? 107 ASN A CB 1 +ATOM 839 C CG . ASN A 1 107 ? 7.611 30.144 6.323 1.00 39.38 ? 107 ASN A CG 1 +ATOM 840 O OD1 . ASN A 1 107 ? 6.436 30.379 6.607 1.00 40.32 ? 107 ASN A OD1 1 +ATOM 841 N ND2 . ASN A 1 107 ? 8.546 29.754 7.189 1.00 38.69 ? 107 ASN A ND2 1 +ATOM 842 N N . LYS A 1 108 ? 10.778 28.863 4.266 1.00 33.45 ? 108 LYS A N 1 +ATOM 843 C CA . LYS A 1 108 ? 12.152 28.931 3.907 1.00 31.24 ? 108 LYS A CA 1 +ATOM 844 C C . LYS A 1 108 ? 12.754 27.880 3.031 1.00 28.28 ? 108 LYS A C 1 +ATOM 845 O O . LYS A 1 108 ? 13.723 28.164 2.259 1.00 29.03 ? 108 LYS A O 1 +ATOM 846 C CB . LYS A 1 108 ? 12.972 28.797 5.298 1.00 31.28 ? 108 LYS A CB 1 +ATOM 847 C CG . LYS A 1 108 ? 13.981 29.924 5.405 1.00 33.66 ? 108 LYS A CG 1 +ATOM 848 C CD . LYS A 1 108 ? 13.296 31.249 5.759 1.00 33.42 ? 108 LYS A CD 1 +ATOM 849 C CE . LYS A 1 108 ? 14.089 31.983 6.832 1.00 33.40 ? 108 LYS A CE 1 +ATOM 850 N NZ . LYS A 1 108 ? 13.226 32.219 8.013 1.00 34.58 ? 108 LYS A NZ 1 +ATOM 851 N N . VAL A 1 109 ? 12.318 26.646 3.174 1.00 24.68 ? 109 VAL A N 1 +ATOM 852 C CA . VAL A 1 109 ? 12.850 25.471 2.518 1.00 22.24 ? 109 VAL A CA 1 +ATOM 853 C C . VAL A 1 109 ? 12.083 25.070 1.262 1.00 20.14 ? 109 VAL A C 1 +ATOM 854 O O . VAL A 1 109 ? 10.850 25.093 1.237 1.00 19.22 ? 109 VAL A O 1 +ATOM 855 C CB . VAL A 1 109 ? 12.851 24.279 3.550 1.00 21.93 ? 109 VAL A CB 1 +ATOM 856 C CG1 . VAL A 1 109 ? 13.365 23.000 2.920 1.00 22.97 ? 109 VAL A CG1 1 +ATOM 857 C CG2 . VAL A 1 109 ? 13.561 24.641 4.811 1.00 21.76 ? 109 VAL A CG2 1 +ATOM 858 N N . ASP A 1 110 ? 12.865 24.619 0.301 1.00 16.54 ? 110 ASP A N 1 +ATOM 859 C CA . ASP A 1 110 ? 12.348 24.125 -0.994 1.00 16.15 ? 110 ASP A CA 1 +ATOM 860 C C . ASP A 1 110 ? 12.492 22.592 -0.994 1.00 15.68 ? 110 ASP A C 1 +ATOM 861 O O . ASP A 1 110 ? 11.628 21.867 -0.512 1.00 16.56 ? 110 ASP A O 1 +ATOM 862 C CB . ASP A 1 110 ? 13.075 24.813 -2.143 1.00 15.25 ? 110 ASP A CB 1 +ATOM 863 C CG . ASP A 1 110 ? 12.575 24.462 -3.513 1.00 17.76 ? 110 ASP A CG 1 +ATOM 864 O OD1 . ASP A 1 110 ? 13.172 24.820 -4.537 1.00 17.77 ? 110 ASP A OD1 1 +ATOM 865 O OD2 . ASP A 1 110 ? 11.525 23.780 -3.601 1.00 19.69 ? 110 ASP A OD2 1 +ATOM 866 N N . MET A 1 111 ? 13.632 22.155 -1.480 1.00 15.45 ? 111 MET A N 1 +ATOM 867 C CA . MET A 1 111 ? 13.987 20.748 -1.604 1.00 15.32 ? 111 MET A CA 1 +ATOM 868 C C . MET A 1 111 ? 14.769 20.263 -0.390 1.00 12.95 ? 111 MET A C 1 +ATOM 869 O O . MET A 1 111 ? 15.561 21.045 0.176 1.00 15.11 ? 111 MET A O 1 +ATOM 870 C CB . MET A 1 111 ? 14.898 20.577 -2.854 1.00 15.14 ? 111 MET A CB 1 +ATOM 871 C CG . MET A 1 111 ? 14.168 20.817 -4.120 1.00 17.65 ? 111 MET A CG 1 +ATOM 872 S SD . MET A 1 111 ? 15.412 20.468 -5.479 1.00 18.89 ? 111 MET A SD 1 +ATOM 873 C CE . MET A 1 111 ? 14.764 21.597 -6.717 1.00 16.76 ? 111 MET A CE 1 +ATOM 874 N N . VAL A 1 112 ? 14.599 19.003 -0.081 1.00 12.25 ? 112 VAL A N 1 +ATOM 875 C CA . VAL A 1 112 ? 15.365 18.348 1.000 1.00 11.87 ? 112 VAL A CA 1 +ATOM 876 C C . VAL A 1 112 ? 16.169 17.199 0.358 1.00 11.23 ? 112 VAL A C 1 +ATOM 877 O O . VAL A 1 112 ? 15.599 16.311 -0.282 1.00 12.99 ? 112 VAL A O 1 +ATOM 878 C CB . VAL A 1 112 ? 14.546 17.963 2.201 1.00 12.58 ? 112 VAL A CB 1 +ATOM 879 C CG1 . VAL A 1 112 ? 13.044 17.970 2.015 1.00 13.90 ? 112 VAL A CG1 1 +ATOM 880 C CG2 . VAL A 1 112 ? 15.008 16.615 2.789 1.00 12.14 ? 112 VAL A CG2 1 +ATOM 881 N N . TRP A 1 113 ? 17.471 17.300 0.514 1.00 9.70 ? 113 TRP A N 1 +ATOM 882 C CA . TRP A 1 113 ? 18.430 16.352 -0.036 1.00 8.50 ? 113 TRP A CA 1 +ATOM 883 C C . TRP A 1 113 ? 19.121 15.551 1.078 1.00 9.94 ? 113 TRP A C 1 +ATOM 884 O O . TRP A 1 113 ? 19.766 16.174 1.940 1.00 8.08 ? 113 TRP A O 1 +ATOM 885 C CB . TRP A 1 113 ? 19.507 17.127 -0.836 1.00 9.04 ? 113 TRP A CB 1 +ATOM 886 C CG . TRP A 1 113 ? 19.025 17.750 -2.090 1.00 10.43 ? 113 TRP A CG 1 +ATOM 887 C CD1 . TRP A 1 113 ? 18.502 19.006 -2.260 1.00 10.48 ? 113 TRP A CD1 1 +ATOM 888 C CD2 . TRP A 1 113 ? 19.032 17.150 -3.397 1.00 8.86 ? 113 TRP A CD2 1 +ATOM 889 N NE1 . TRP A 1 113 ? 18.166 19.209 -3.579 1.00 8.00 ? 113 TRP A NE1 1 +ATOM 890 C CE2 . TRP A 1 113 ? 18.484 18.088 -4.289 1.00 8.79 ? 113 TRP A CE2 1 +ATOM 891 C CE3 . TRP A 1 113 ? 19.427 15.897 -3.864 1.00 9.63 ? 113 TRP A CE3 1 +ATOM 892 C CZ2 . TRP A 1 113 ? 18.340 17.820 -5.651 1.00 9.43 ? 113 TRP A CZ2 1 +ATOM 893 C CZ3 . TRP A 1 113 ? 19.280 15.633 -5.212 1.00 1.92 ? 113 TRP A CZ3 1 +ATOM 894 C CH2 . TRP A 1 113 ? 18.746 16.570 -6.083 1.00 5.37 ? 113 TRP A CH2 1 +ATOM 895 N N . ILE A 1 114 ? 18.978 14.260 1.004 1.00 8.74 ? 114 ILE A N 1 +ATOM 896 C CA . ILE A 1 114 ? 19.644 13.312 1.936 1.00 10.41 ? 114 ILE A CA 1 +ATOM 897 C C . ILE A 1 114 ? 20.999 13.010 1.287 1.00 11.79 ? 114 ILE A C 1 +ATOM 898 O O . ILE A 1 114 ? 21.015 12.613 0.097 1.00 11.55 ? 114 ILE A O 1 +ATOM 899 C CB . ILE A 1 114 ? 18.765 12.086 2.214 1.00 12.27 ? 114 ILE A CB 1 +ATOM 900 C CG1 . ILE A 1 114 ? 17.517 12.518 3.077 1.00 14.81 ? 114 ILE A CG1 1 +ATOM 901 C CG2 . ILE A 1 114 ? 19.480 10.895 2.899 1.00 12.07 ? 114 ILE A CG2 1 +ATOM 902 C CD1 . ILE A 1 114 ? 16.224 11.773 2.657 1.00 15.87 ? 114 ILE A CD1 1 +ATOM 903 N N . VAL A 1 115 ? 22.063 13.266 2.008 1.00 10.35 ? 115 VAL A N 1 +ATOM 904 C CA . VAL A 1 115 ? 23.417 13.133 1.479 1.00 12.26 ? 115 VAL A CA 1 +ATOM 905 C C . VAL A 1 115 ? 24.368 12.295 2.258 1.00 13.16 ? 115 VAL A C 1 +ATOM 906 O O . VAL A 1 115 ? 25.613 12.423 1.975 1.00 13.95 ? 115 VAL A O 1 +ATOM 907 C CB . VAL A 1 115 ? 23.999 14.604 1.350 1.00 11.24 ? 115 VAL A CB 1 +ATOM 908 C CG1 . VAL A 1 115 ? 23.034 15.561 0.753 1.00 11.85 ? 115 VAL A CG1 1 +ATOM 909 C CG2 . VAL A 1 115 ? 24.513 15.035 2.720 1.00 10.13 ? 115 VAL A CG2 1 +ATOM 910 N N . GLY A 1 116 ? 23.930 11.504 3.234 1.00 12.34 ? 116 GLY A N 1 +ATOM 911 C CA . GLY A 1 116 ? 24.913 10.748 4.008 1.00 16.78 ? 116 GLY A CA 1 +ATOM 912 C C . GLY A 1 116 ? 24.481 9.991 5.202 1.00 16.24 ? 116 GLY A C 1 +ATOM 913 O O . GLY A 1 116 ? 23.777 10.417 6.119 1.00 15.51 ? 116 GLY A O 1 +ATOM 914 N N . GLY A 1 117 ? 25.059 8.791 5.268 1.00 15.55 ? 117 GLY A N 1 +ATOM 915 C CA . GLY A 1 117 ? 24.874 7.740 6.188 1.00 14.74 ? 117 GLY A CA 1 +ATOM 916 C C . GLY A 1 117 ? 24.130 6.610 5.414 1.00 11.73 ? 117 GLY A C 1 +ATOM 917 O O . GLY A 1 117 ? 23.125 6.915 4.786 1.00 12.53 ? 117 GLY A O 1 +ATOM 918 N N . SER A 1 118 ? 24.709 5.445 5.485 1.00 13.20 ? 118 SER A N 1 +ATOM 919 C CA . SER A 1 118 ? 24.071 4.256 4.855 1.00 13.11 ? 118 SER A CA 1 +ATOM 920 C C . SER A 1 118 ? 22.724 4.030 5.549 1.00 12.76 ? 118 SER A C 1 +ATOM 921 O O . SER A 1 118 ? 21.753 3.626 4.907 1.00 11.45 ? 118 SER A O 1 +ATOM 922 C CB . SER A 1 118 ? 24.956 3.039 4.943 1.00 13.84 ? 118 SER A CB 1 +ATOM 923 O OG . SER A 1 118 ? 26.290 3.334 4.593 1.00 13.15 ? 118 SER A OG 1 +ATOM 924 N N . SER A 1 119 ? 22.712 4.341 6.851 1.00 14.69 ? 119 SER A N 1 +ATOM 925 C CA . SER A 1 119 ? 21.518 4.152 7.673 1.00 14.61 ? 119 SER A CA 1 +ATOM 926 C C . SER A 1 119 ? 20.459 5.180 7.300 1.00 15.18 ? 119 SER A C 1 +ATOM 927 O O . SER A 1 119 ? 19.248 4.880 7.397 1.00 17.46 ? 119 SER A O 1 +ATOM 928 C CB . SER A 1 119 ? 21.761 4.111 9.154 1.00 16.26 ? 119 SER A CB 1 +ATOM 929 O OG . SER A 1 119 ? 22.977 4.591 9.571 1.00 16.98 ? 119 SER A OG 1 +ATOM 930 N N . VAL A 1 120 ? 20.940 6.345 6.891 1.00 13.15 ? 120 VAL A N 1 +ATOM 931 C CA . VAL A 1 120 ? 20.002 7.426 6.500 1.00 13.15 ? 120 VAL A CA 1 +ATOM 932 C C . VAL A 1 120 ? 19.428 7.075 5.125 1.00 10.78 ? 120 VAL A C 1 +ATOM 933 O O . VAL A 1 120 ? 18.214 7.202 4.916 1.00 10.72 ? 120 VAL A O 1 +ATOM 934 C CB . VAL A 1 120 ? 20.579 8.803 6.656 1.00 13.04 ? 120 VAL A CB 1 +ATOM 935 C CG1 . VAL A 1 120 ? 19.492 9.904 6.478 1.00 13.13 ? 120 VAL A CG1 1 +ATOM 936 C CG2 . VAL A 1 120 ? 21.292 9.020 7.976 1.00 12.02 ? 120 VAL A CG2 1 +ATOM 937 N N . TYR A 1 121 ? 20.335 6.640 4.263 1.00 9.83 ? 121 TYR A N 1 +ATOM 938 C CA . TYR A 1 121 ? 19.931 6.238 2.885 1.00 11.83 ? 121 TYR A CA 1 +ATOM 939 C C . TYR A 1 121 ? 18.858 5.152 2.975 1.00 11.01 ? 121 TYR A C 1 +ATOM 940 O O . TYR A 1 121 ? 17.767 5.281 2.410 1.00 11.26 ? 121 TYR A O 1 +ATOM 941 C CB . TYR A 1 121 ? 21.118 5.802 2.050 1.00 8.03 ? 121 TYR A CB 1 +ATOM 942 C CG . TYR A 1 121 ? 22.035 6.878 1.539 1.00 0.42 ? 121 TYR A CG 1 +ATOM 943 C CD1 . TYR A 1 121 ? 23.429 6.765 1.700 1.00 1.68 ? 121 TYR A CD1 1 +ATOM 944 C CD2 . TYR A 1 121 ? 21.557 7.976 0.843 1.00 7.60 ? 121 TYR A CD2 1 +ATOM 945 C CE1 . TYR A 1 121 ? 24.299 7.716 1.190 1.00 0.82 ? 121 TYR A CE1 1 +ATOM 946 C CE2 . TYR A 1 121 ? 22.411 8.954 0.333 1.00 1.10 ? 121 TYR A CE2 1 +ATOM 947 C CZ . TYR A 1 121 ? 23.784 8.812 0.496 1.00 1.67 ? 121 TYR A CZ 1 +ATOM 948 O OH . TYR A 1 121 ? 24.594 9.782 -0.012 1.00 5.11 ? 121 TYR A OH 1 +ATOM 949 N N . LYS A 1 122 ? 19.202 4.094 3.691 1.00 15.56 ? 122 LYS A N 1 +ATOM 950 C CA . LYS A 1 122 ? 18.338 2.946 3.899 1.00 17.08 ? 122 LYS A CA 1 +ATOM 951 C C . LYS A 1 122 ? 16.939 3.351 4.355 1.00 18.13 ? 122 LYS A C 1 +ATOM 952 O O . LYS A 1 122 ? 15.933 2.868 3.800 1.00 19.21 ? 122 LYS A O 1 +ATOM 953 C CB . LYS A 1 122 ? 18.903 1.944 4.908 1.00 18.26 ? 122 LYS A CB 1 +ATOM 954 C CG . LYS A 1 122 ? 18.021 0.664 4.985 1.00 20.75 ? 122 LYS A CG 1 +ATOM 955 C CD . LYS A 1 122 ? 18.342 -0.279 3.850 1.00 24.09 ? 122 LYS A CD 1 +ATOM 956 C CE . LYS A 1 122 ? 17.265 -0.341 2.785 1.00 26.61 ? 122 LYS A CE 1 +ATOM 957 N NZ . LYS A 1 122 ? 16.239 -1.365 3.149 1.00 27.92 ? 122 LYS A NZ 1 +ATOM 958 N N . GLU A 1 123 ? 16.900 4.195 5.374 1.00 19.88 ? 123 GLU A N 1 +ATOM 959 C CA . GLU A 1 123 ? 15.616 4.634 5.943 1.00 22.36 ? 123 GLU A CA 1 +ATOM 960 C C . GLU A 1 123 ? 14.875 5.545 4.991 1.00 21.13 ? 123 GLU A C 1 +ATOM 961 O O . GLU A 1 123 ? 13.655 5.345 4.816 1.00 21.20 ? 123 GLU A O 1 +ATOM 962 C CB . GLU A 1 123 ? 15.649 5.155 7.308 1.00 23.73 ? 123 GLU A CB 1 +ATOM 963 C CG . GLU A 1 123 ? 16.205 6.470 7.754 1.00 26.10 ? 123 GLU A CG 1 +ATOM 964 C CD . GLU A 1 123 ? 16.254 6.592 9.285 1.00 27.98 ? 123 GLU A CD 1 +ATOM 965 O OE1 . GLU A 1 123 ? 15.416 7.161 9.912 1.00 29.73 ? 123 GLU A OE1 1 +ATOM 966 O OE2 . GLU A 1 123 ? 17.211 5.945 9.742 1.00 29.83 ? 123 GLU A OE2 1 +ATOM 967 N N . ALA A 1 124 ? 15.577 6.490 4.388 1.00 21.20 ? 124 ALA A N 1 +ATOM 968 C CA . ALA A 1 124 ? 14.947 7.416 3.424 1.00 21.19 ? 124 ALA A CA 1 +ATOM 969 C C . ALA A 1 124 ? 14.253 6.623 2.313 1.00 21.67 ? 124 ALA A C 1 +ATOM 970 O O . ALA A 1 124 ? 13.088 6.881 1.976 1.00 20.85 ? 124 ALA A O 1 +ATOM 971 C CB . ALA A 1 124 ? 15.943 8.392 2.850 1.00 17.96 ? 124 ALA A CB 1 +ATOM 972 N N . MET A 1 125 ? 15.021 5.726 1.725 1.00 25.24 ? 125 MET A N 1 +ATOM 973 C CA . MET A 1 125 ? 14.523 4.905 0.591 1.00 27.42 ? 125 MET A CA 1 +ATOM 974 C C . MET A 1 125 ? 13.242 4.205 1.005 1.00 29.86 ? 125 MET A C 1 +ATOM 975 O O . MET A 1 125 ? 12.327 4.015 0.175 1.00 31.22 ? 125 MET A O 1 +ATOM 976 C CB . MET A 1 125 ? 15.596 4.002 0.058 1.00 27.76 ? 125 MET A CB 1 +ATOM 977 C CG . MET A 1 125 ? 16.712 4.810 -0.578 1.00 28.38 ? 125 MET A CG 1 +ATOM 978 S SD . MET A 1 125 ? 17.803 3.685 -1.485 1.00 30.81 ? 125 MET A SD 1 +ATOM 979 C CE . MET A 1 125 ? 18.043 2.388 -0.275 1.00 29.88 ? 125 MET A CE 1 +ATOM 980 N N . ASN A 1 126 ? 13.172 3.883 2.292 1.00 29.84 ? 126 ASN A N 1 +ATOM 981 C CA . ASN A 1 126 ? 12.006 3.185 2.846 1.00 31.51 ? 126 ASN A CA 1 +ATOM 982 C C . ASN A 1 126 ? 10.864 4.159 3.086 1.00 31.29 ? 126 ASN A C 1 +ATOM 983 O O . ASN A 1 126 ? 9.688 3.712 3.105 1.00 31.09 ? 126 ASN A O 1 +ATOM 984 C CB . ASN A 1 126 ? 12.372 2.310 4.027 1.00 32.64 ? 126 ASN A CB 1 +ATOM 985 C CG . ASN A 1 126 ? 12.487 0.835 3.661 1.00 34.46 ? 126 ASN A CG 1 +ATOM 986 O OD1 . ASN A 1 126 ? 11.915 -0.029 4.342 1.00 34.66 ? 126 ASN A OD1 1 +ATOM 987 N ND2 . ASN A 1 126 ? 13.243 0.563 2.596 1.00 35.67 ? 126 ASN A ND2 1 +ATOM 988 N N . HIS A 1 127 ? 11.204 5.421 3.223 1.00 30.59 ? 127 HIS A N 1 +ATOM 989 C CA . HIS A 1 127 ? 10.190 6.481 3.478 1.00 29.74 ? 127 HIS A CA 1 +ATOM 990 C C . HIS A 1 127 ? 9.117 6.441 2.414 1.00 29.62 ? 127 HIS A C 1 +ATOM 991 O O . HIS A 1 127 ? 9.389 6.544 1.199 1.00 27.97 ? 127 HIS A O 1 +ATOM 992 C CB . HIS A 1 127 ? 10.782 7.878 3.633 1.00 31.13 ? 127 HIS A CB 1 +ATOM 993 C CG . HIS A 1 127 ? 9.819 9.004 3.719 1.00 32.35 ? 127 HIS A CG 1 +ATOM 994 N ND1 . HIS A 1 127 ? 9.480 9.680 4.865 1.00 32.34 ? 127 HIS A ND1 1 +ATOM 995 C CD2 . HIS A 1 127 ? 9.124 9.631 2.717 1.00 33.97 ? 127 HIS A CD2 1 +ATOM 996 C CE1 . HIS A 1 127 ? 8.613 10.626 4.585 1.00 32.76 ? 127 HIS A CE1 1 +ATOM 997 N NE2 . HIS A 1 127 ? 8.386 10.630 3.283 1.00 33.10 ? 127 HIS A NE2 1 +ATOM 998 N N . PRO A 1 128 ? 7.878 6.295 2.875 1.00 28.92 ? 128 PRO A N 1 +ATOM 999 C CA . PRO A 1 128 ? 6.698 6.228 2.019 1.00 28.05 ? 128 PRO A CA 1 +ATOM 1000 C C . PRO A 1 128 ? 6.386 7.581 1.414 1.00 28.87 ? 128 PRO A C 1 +ATOM 1001 O O . PRO A 1 128 ? 6.465 8.628 2.091 1.00 29.94 ? 128 PRO A O 1 +ATOM 1002 C CB . PRO A 1 128 ? 5.584 5.707 2.897 1.00 28.21 ? 128 PRO A CB 1 +ATOM 1003 C CG . PRO A 1 128 ? 6.204 5.345 4.204 1.00 27.93 ? 128 PRO A CG 1 +ATOM 1004 C CD . PRO A 1 128 ? 7.478 6.159 4.314 1.00 28.61 ? 128 PRO A CD 1 +ATOM 1005 N N . GLY A 1 129 ? 6.033 7.539 0.133 1.00 27.37 ? 129 GLY A N 1 +ATOM 1006 C CA . GLY A 1 129 ? 5.696 8.736 -0.636 1.00 24.77 ? 129 GLY A CA 1 +ATOM 1007 C C . GLY A 1 129 ? 6.583 8.810 -1.891 1.00 22.47 ? 129 GLY A C 1 +ATOM 1008 O O . GLY A 1 129 ? 7.181 7.834 -2.319 1.00 21.76 ? 129 GLY A O 1 +ATOM 1009 N N . HIS A 1 130 ? 6.625 10.009 -2.413 1.00 21.98 ? 130 HIS A N 1 +ATOM 1010 C CA . HIS A 1 130 ? 7.368 10.398 -3.612 1.00 20.14 ? 130 HIS A CA 1 +ATOM 1011 C C . HIS A 1 130 ? 8.811 10.730 -3.265 1.00 17.02 ? 130 HIS A C 1 +ATOM 1012 O O . HIS A 1 130 ? 9.081 11.617 -2.421 1.00 13.45 ? 130 HIS A O 1 +ATOM 1013 C CB . HIS A 1 130 ? 6.695 11.630 -4.289 1.00 20.25 ? 130 HIS A CB 1 +ATOM 1014 C CG . HIS A 1 130 ? 7.129 11.874 -5.688 1.00 22.74 ? 130 HIS A CG 1 +ATOM 1015 N ND1 . HIS A 1 130 ? 7.012 13.103 -6.323 1.00 23.59 ? 130 HIS A ND1 1 +ATOM 1016 C CD2 . HIS A 1 130 ? 7.674 11.045 -6.608 1.00 23.04 ? 130 HIS A CD2 1 +ATOM 1017 C CE1 . HIS A 1 130 ? 7.481 13.000 -7.549 1.00 24.66 ? 130 HIS A CE1 1 +ATOM 1018 N NE2 . HIS A 1 130 ? 7.878 11.750 -7.749 1.00 22.49 ? 130 HIS A NE2 1 +ATOM 1019 N N . LEU A 1 131 ? 9.718 10.037 -3.936 1.00 14.38 ? 131 LEU A N 1 +ATOM 1020 C CA . LEU A 1 131 ? 11.154 10.200 -3.735 1.00 14.54 ? 131 LEU A CA 1 +ATOM 1021 C C . LEU A 1 131 ? 11.944 9.892 -5.009 1.00 13.52 ? 131 LEU A C 1 +ATOM 1022 O O . LEU A 1 131 ? 11.567 9.040 -5.816 1.00 11.92 ? 131 LEU A O 1 +ATOM 1023 C CB . LEU A 1 131 ? 11.546 9.268 -2.566 1.00 15.75 ? 131 LEU A CB 1 +ATOM 1024 C CG . LEU A 1 131 ? 12.852 9.540 -1.854 1.00 16.60 ? 131 LEU A CG 1 +ATOM 1025 C CD1 . LEU A 1 131 ? 12.691 9.235 -0.347 1.00 19.29 ? 131 LEU A CD1 1 +ATOM 1026 C CD2 . LEU A 1 131 ? 13.935 8.639 -2.402 1.00 16.93 ? 131 LEU A CD2 1 +ATOM 1027 N N . LYS A 1 132 ? 13.076 10.583 -5.107 1.00 10.96 ? 132 LYS A N 1 +ATOM 1028 C CA . LYS A 1 132 ? 14.010 10.432 -6.213 1.00 10.09 ? 132 LYS A CA 1 +ATOM 1029 C C . LYS A 1 132 ? 15.422 10.202 -5.677 1.00 9.14 ? 132 LYS A C 1 +ATOM 1030 O O . LYS A 1 132 ? 15.835 10.820 -4.682 1.00 12.81 ? 132 LYS A O 1 +ATOM 1031 C CB . LYS A 1 132 ? 14.037 11.620 -7.150 1.00 11.85 ? 132 LYS A CB 1 +ATOM 1032 C CG . LYS A 1 132 ? 12.810 11.743 -8.059 1.00 10.14 ? 132 LYS A CG 1 +ATOM 1033 C CD . LYS A 1 132 ? 13.135 12.557 -9.298 1.00 13.03 ? 132 LYS A CD 1 +ATOM 1034 C CE . LYS A 1 132 ? 12.932 14.039 -9.069 1.00 16.36 ? 132 LYS A CE 1 +ATOM 1035 N NZ . LYS A 1 132 ? 13.632 14.457 -7.812 1.00 17.31 ? 132 LYS A NZ 1 +ATOM 1036 N N . LEU A 1 133 ? 16.118 9.340 -6.348 1.00 8.46 ? 133 LEU A N 1 +ATOM 1037 C CA . LEU A 1 133 ? 17.492 8.955 -6.065 1.00 8.32 ? 133 LEU A CA 1 +ATOM 1038 C C . LEU A 1 133 ? 18.384 9.464 -7.240 1.00 8.27 ? 133 LEU A C 1 +ATOM 1039 O O . LEU A 1 133 ? 18.123 9.083 -8.388 1.00 7.67 ? 133 LEU A O 1 +ATOM 1040 C CB . LEU A 1 133 ? 17.565 7.451 -5.942 1.00 10.10 ? 133 LEU A CB 1 +ATOM 1041 C CG . LEU A 1 133 ? 17.570 6.686 -4.697 1.00 12.63 ? 133 LEU A CG 1 +ATOM 1042 C CD1 . LEU A 1 133 ? 16.564 7.157 -3.655 1.00 11.52 ? 133 LEU A CD1 1 +ATOM 1043 C CD2 . LEU A 1 133 ? 17.241 5.200 -5.030 1.00 12.31 ? 133 LEU A CD2 1 +ATOM 1044 N N . PHE A 1 134 ? 19.322 10.269 -6.861 1.00 7.95 ? 134 PHE A N 1 +ATOM 1045 C CA . PHE A 1 134 ? 20.325 10.830 -7.803 1.00 7.32 ? 134 PHE A CA 1 +ATOM 1046 C C . PHE A 1 134 ? 21.621 10.066 -7.467 1.00 9.78 ? 134 PHE A C 1 +ATOM 1047 O O . PHE A 1 134 ? 22.196 10.240 -6.402 1.00 9.06 ? 134 PHE A O 1 +ATOM 1048 C CB . PHE A 1 134 ? 20.454 12.325 -7.724 1.00 1.94 ? 134 PHE A CB 1 +ATOM 1049 C CG . PHE A 1 134 ? 19.294 13.134 -8.218 1.00 6.94 ? 134 PHE A CG 1 +ATOM 1050 C CD1 . PHE A 1 134 ? 18.093 13.139 -7.520 1.00 6.34 ? 134 PHE A CD1 1 +ATOM 1051 C CD2 . PHE A 1 134 ? 19.406 13.884 -9.399 1.00 8.30 ? 134 PHE A CD2 1 +ATOM 1052 C CE1 . PHE A 1 134 ? 17.003 13.874 -7.971 1.00 2.77 ? 134 PHE A CE1 1 +ATOM 1053 C CE2 . PHE A 1 134 ? 18.333 14.643 -9.859 1.00 3.91 ? 134 PHE A CE2 1 +ATOM 1054 C CZ . PHE A 1 134 ? 17.116 14.624 -9.136 1.00 2.82 ? 134 PHE A CZ 1 +ATOM 1055 N N . VAL A 1 135 ? 21.948 9.152 -8.380 1.00 11.81 ? 135 VAL A N 1 +ATOM 1056 C CA . VAL A 1 135 ? 23.087 8.267 -8.222 1.00 11.28 ? 135 VAL A CA 1 +ATOM 1057 C C . VAL A 1 135 ? 24.173 8.493 -9.260 1.00 12.02 ? 135 VAL A C 1 +ATOM 1058 O O . VAL A 1 135 ? 23.905 8.439 -10.481 1.00 11.05 ? 135 VAL A O 1 +ATOM 1059 C CB . VAL A 1 135 ? 22.571 6.780 -8.289 1.00 11.58 ? 135 VAL A CB 1 +ATOM 1060 C CG1 . VAL A 1 135 ? 23.713 5.794 -8.123 1.00 10.96 ? 135 VAL A CG1 1 +ATOM 1061 C CG2 . VAL A 1 135 ? 21.442 6.517 -7.337 1.00 13.03 ? 135 VAL A CG2 1 +ATOM 1062 N N . THR A 1 136 ? 25.391 8.648 -8.760 1.00 12.66 ? 136 THR A N 1 +ATOM 1063 C CA . THR A 1 136 ? 26.588 8.751 -9.634 1.00 10.55 ? 136 THR A CA 1 +ATOM 1064 C C . THR A 1 136 ? 27.247 7.351 -9.588 1.00 12.37 ? 136 THR A C 1 +ATOM 1065 O O . THR A 1 136 ? 27.619 6.890 -8.506 1.00 10.50 ? 136 THR A O 1 +ATOM 1066 C CB . THR A 1 136 ? 27.590 9.856 -9.239 1.00 9.52 ? 136 THR A CB 1 +ATOM 1067 O OG1 . THR A 1 136 ? 26.890 11.137 -9.240 1.00 1.46 ? 136 THR A OG1 1 +ATOM 1068 C CG2 . THR A 1 136 ? 28.832 9.932 -10.157 1.00 9.95 ? 136 THR A CG2 1 +ATOM 1069 N N . ARG A 1 137 ? 27.274 6.722 -10.755 1.00 12.15 ? 137 ARG A N 1 +ATOM 1070 C CA . ARG A 1 137 ? 27.851 5.382 -10.888 1.00 11.56 ? 137 ARG A CA 1 +ATOM 1071 C C . ARG A 1 137 ? 29.326 5.468 -11.267 1.00 13.53 ? 137 ARG A C 1 +ATOM 1072 O O . ARG A 1 137 ? 29.686 5.786 -12.413 1.00 11.89 ? 137 ARG A O 1 +ATOM 1073 C CB . ARG A 1 137 ? 27.068 4.502 -11.842 1.00 12.05 ? 137 ARG A CB 1 +ATOM 1074 C CG . ARG A 1 137 ? 25.615 4.269 -11.556 1.00 12.78 ? 137 ARG A CG 1 +ATOM 1075 C CD . ARG A 1 137 ? 25.336 3.355 -10.418 1.00 13.27 ? 137 ARG A CD 1 +ATOM 1076 N NE . ARG A 1 137 ? 24.125 2.599 -10.524 1.00 10.26 ? 137 ARG A NE 1 +ATOM 1077 C CZ . ARG A 1 137 ? 23.482 1.916 -9.620 1.00 14.89 ? 137 ARG A CZ 1 +ATOM 1078 N NH1 . ARG A 1 137 ? 23.854 1.825 -8.344 1.00 19.54 ? 137 ARG A NH1 1 +ATOM 1079 N NH2 . ARG A 1 137 ? 22.355 1.231 -9.928 1.00 15.75 ? 137 ARG A NH2 1 +ATOM 1080 N N . ILE A 1 138 ? 30.158 5.200 -10.270 1.00 13.33 ? 138 ILE A N 1 +ATOM 1081 C CA . ILE A 1 138 ? 31.635 5.170 -10.462 1.00 14.78 ? 138 ILE A CA 1 +ATOM 1082 C C . ILE A 1 138 ? 31.928 3.761 -10.998 1.00 15.97 ? 138 ILE A C 1 +ATOM 1083 O O . ILE A 1 138 ? 31.627 2.771 -10.286 1.00 16.38 ? 138 ILE A O 1 +ATOM 1084 C CB . ILE A 1 138 ? 32.384 5.505 -9.153 1.00 15.59 ? 138 ILE A CB 1 +ATOM 1085 C CG1 . ILE A 1 138 ? 31.853 6.767 -8.487 1.00 15.79 ? 138 ILE A CG1 1 +ATOM 1086 C CG2 . ILE A 1 138 ? 33.927 5.473 -9.323 1.00 14.78 ? 138 ILE A CG2 1 +ATOM 1087 C CD1 . ILE A 1 138 ? 32.583 8.078 -8.604 1.00 16.55 ? 138 ILE A CD1 1 +ATOM 1088 N N . MET A 1 139 ? 32.393 3.700 -12.211 1.00 16.91 ? 139 MET A N 1 +ATOM 1089 C CA . MET A 1 139 ? 32.585 2.457 -12.952 1.00 18.34 ? 139 MET A CA 1 +ATOM 1090 C C . MET A 1 139 ? 33.858 1.737 -12.732 1.00 20.04 ? 139 MET A C 1 +ATOM 1091 O O . MET A 1 139 ? 34.651 1.407 -13.663 1.00 20.96 ? 139 MET A O 1 +ATOM 1092 C CB . MET A 1 139 ? 32.187 2.694 -14.426 1.00 19.43 ? 139 MET A CB 1 +ATOM 1093 C CG . MET A 1 139 ? 30.677 2.956 -14.455 1.00 20.66 ? 139 MET A CG 1 +ATOM 1094 S SD . MET A 1 139 ? 30.219 3.469 -16.135 1.00 24.54 ? 139 MET A SD 1 +ATOM 1095 C CE . MET A 1 139 ? 31.024 5.052 -16.250 1.00 21.44 ? 139 MET A CE 1 +ATOM 1096 N N . GLN A 1 140 ? 34.104 1.357 -11.484 1.00 20.54 ? 140 GLN A N 1 +ATOM 1097 C CA . GLN A 1 140 ? 35.231 0.598 -11.017 1.00 21.03 ? 140 GLN A CA 1 +ATOM 1098 C C . GLN A 1 140 ? 34.984 0.178 -9.533 1.00 21.66 ? 140 GLN A C 1 +ATOM 1099 O O . GLN A 1 140 ? 34.161 0.735 -8.830 1.00 21.84 ? 140 GLN A O 1 +ATOM 1100 C CB . GLN A 1 140 ? 36.584 1.262 -11.090 1.00 22.88 ? 140 GLN A CB 1 +ATOM 1101 C CG . GLN A 1 140 ? 36.710 2.535 -11.868 1.00 25.86 ? 140 GLN A CG 1 +ATOM 1102 C CD . GLN A 1 140 ? 38.078 2.641 -12.536 1.00 27.52 ? 140 GLN A CD 1 +ATOM 1103 O OE1 . GLN A 1 140 ? 38.213 2.546 -13.747 1.00 29.80 ? 140 GLN A OE1 1 +ATOM 1104 N NE2 . GLN A 1 140 ? 39.086 2.766 -11.687 1.00 28.81 ? 140 GLN A NE2 1 +ATOM 1105 N N . ASP A 1 141 ? 35.800 -0.781 -9.173 1.00 21.58 ? 141 ASP A N 1 +ATOM 1106 C CA . ASP A 1 141 ? 35.856 -1.324 -7.816 1.00 21.38 ? 141 ASP A CA 1 +ATOM 1107 C C . ASP A 1 141 ? 36.843 -0.443 -7.020 1.00 19.96 ? 141 ASP A C 1 +ATOM 1108 O O . ASP A 1 141 ? 37.912 -0.099 -7.525 1.00 18.40 ? 141 ASP A O 1 +ATOM 1109 C CB . ASP A 1 141 ? 36.289 -2.803 -7.843 1.00 22.84 ? 141 ASP A CB 1 +ATOM 1110 C CG . ASP A 1 141 ? 35.096 -3.708 -7.568 1.00 24.82 ? 141 ASP A CG 1 +ATOM 1111 O OD1 . ASP A 1 141 ? 34.127 -3.716 -8.324 1.00 25.71 ? 141 ASP A OD1 1 +ATOM 1112 O OD2 . ASP A 1 141 ? 35.150 -4.357 -6.497 1.00 27.74 ? 141 ASP A OD2 1 +ATOM 1113 N N . PHE A 1 142 ? 36.400 -0.079 -5.850 1.00 18.77 ? 142 PHE A N 1 +ATOM 1114 C CA . PHE A 1 142 ? 37.152 0.689 -4.875 1.00 18.18 ? 142 PHE A CA 1 +ATOM 1115 C C . PHE A 1 142 ? 36.995 -0.002 -3.506 1.00 18.85 ? 142 PHE A C 1 +ATOM 1116 O O . PHE A 1 142 ? 35.908 -0.505 -3.191 1.00 18.51 ? 142 PHE A O 1 +ATOM 1117 C CB . PHE A 1 142 ? 36.719 2.173 -4.798 1.00 18.59 ? 142 PHE A CB 1 +ATOM 1118 C CG . PHE A 1 142 ? 37.176 2.955 -6.003 1.00 16.22 ? 142 PHE A CG 1 +ATOM 1119 C CD1 . PHE A 1 142 ? 38.528 3.263 -6.147 1.00 15.53 ? 142 PHE A CD1 1 +ATOM 1120 C CD2 . PHE A 1 142 ? 36.273 3.312 -7.001 1.00 14.93 ? 142 PHE A CD2 1 +ATOM 1121 C CE1 . PHE A 1 142 ? 38.989 3.939 -7.267 1.00 14.71 ? 142 PHE A CE1 1 +ATOM 1122 C CE2 . PHE A 1 142 ? 36.720 3.982 -8.143 1.00 12.93 ? 142 PHE A CE2 1 +ATOM 1123 C CZ . PHE A 1 142 ? 38.083 4.306 -8.258 1.00 14.57 ? 142 PHE A CZ 1 +ATOM 1124 N N . GLU A 1 143 ? 38.109 -0.026 -2.793 1.00 18.04 ? 143 GLU A N 1 +ATOM 1125 C CA . GLU A 1 143 ? 38.113 -0.620 -1.431 1.00 16.82 ? 143 GLU A CA 1 +ATOM 1126 C C . GLU A 1 143 ? 37.213 0.278 -0.561 1.00 17.61 ? 143 GLU A C 1 +ATOM 1127 O O . GLU A 1 143 ? 37.423 1.503 -0.504 1.00 17.34 ? 143 GLU A O 1 +ATOM 1128 C CB . GLU A 1 143 ? 39.456 -0.701 -0.814 1.00 18.22 ? 143 GLU A CB 1 +ATOM 1129 C CG . GLU A 1 143 ? 39.649 -1.343 0.552 1.00 18.49 ? 143 GLU A CG 1 +ATOM 1130 C CD . GLU A 1 143 ? 41.092 -1.543 0.944 1.00 19.72 ? 143 GLU A CD 1 +ATOM 1131 O OE1 . GLU A 1 143 ? 41.534 -2.627 1.291 1.00 22.17 ? 143 GLU A OE1 1 +ATOM 1132 O OE2 . GLU A 1 143 ? 41.757 -0.510 0.814 1.00 19.04 ? 143 GLU A OE2 1 +ATOM 1133 N N . SER A 1 144 ? 36.253 -0.373 0.052 1.00 17.05 ? 144 SER A N 1 +ATOM 1134 C CA . SER A 1 144 ? 35.238 0.315 0.869 1.00 14.99 ? 144 SER A CA 1 +ATOM 1135 C C . SER A 1 144 ? 35.065 -0.322 2.219 1.00 14.83 ? 144 SER A C 1 +ATOM 1136 O O . SER A 1 144 ? 35.589 -1.427 2.500 1.00 16.04 ? 144 SER A O 1 +ATOM 1137 C CB . SER A 1 144 ? 33.940 0.369 0.058 1.00 13.92 ? 144 SER A CB 1 +ATOM 1138 O OG . SER A 1 144 ? 34.207 1.025 -1.194 1.00 15.25 ? 144 SER A OG 1 +ATOM 1139 N N . ASP A 1 145 ? 34.343 0.389 3.082 1.00 13.93 ? 145 ASP A N 1 +ATOM 1140 C CA . ASP A 1 145 ? 34.076 -0.091 4.463 1.00 12.52 ? 145 ASP A CA 1 +ATOM 1141 C C . ASP A 1 145 ? 32.641 0.260 4.834 1.00 12.79 ? 145 ASP A C 1 +ATOM 1142 O O . ASP A 1 145 ? 32.097 -0.242 5.832 1.00 13.26 ? 145 ASP A O 1 +ATOM 1143 C CB . ASP A 1 145 ? 35.144 0.367 5.418 1.00 12.59 ? 145 ASP A CB 1 +ATOM 1144 C CG . ASP A 1 145 ? 35.147 1.825 5.767 1.00 13.47 ? 145 ASP A CG 1 +ATOM 1145 O OD1 . ASP A 1 145 ? 34.157 2.551 5.639 1.00 12.57 ? 145 ASP A OD1 1 +ATOM 1146 O OD2 . ASP A 1 145 ? 36.241 2.265 6.227 1.00 14.58 ? 145 ASP A OD2 1 +ATOM 1147 N N . THR A 1 146 ? 32.062 1.107 4.002 1.00 14.06 ? 146 THR A N 1 +ATOM 1148 C CA . THR A 1 146 ? 30.655 1.533 4.138 1.00 15.07 ? 146 THR A CA 1 +ATOM 1149 C C . THR A 1 146 ? 30.043 1.468 2.721 1.00 13.95 ? 146 THR A C 1 +ATOM 1150 O O . THR A 1 146 ? 30.750 1.795 1.758 1.00 14.60 ? 146 THR A O 1 +ATOM 1151 C CB . THR A 1 146 ? 30.440 2.902 4.813 1.00 16.67 ? 146 THR A CB 1 +ATOM 1152 O OG1 . THR A 1 146 ? 28.975 3.146 4.729 1.00 18.04 ? 146 THR A OG1 1 +ATOM 1153 C CG2 . THR A 1 146 ? 31.213 4.088 4.255 1.00 17.17 ? 146 THR A CG2 1 +ATOM 1154 N N . PHE A 1 147 ? 28.811 1.020 2.671 1.00 13.94 ? 147 PHE A N 1 +ATOM 1155 C CA . PHE A 1 147 ? 28.100 0.776 1.420 1.00 11.90 ? 147 PHE A CA 1 +ATOM 1156 C C . PHE A 1 147 ? 26.696 1.329 1.382 1.00 10.76 ? 147 PHE A C 1 +ATOM 1157 O O . PHE A 1 147 ? 26.039 1.603 2.385 1.00 10.02 ? 147 PHE A O 1 +ATOM 1158 C CB . PHE A 1 147 ? 28.062 -0.763 1.114 1.00 9.35 ? 147 PHE A CB 1 +ATOM 1159 C CG . PHE A 1 147 ? 29.425 -1.379 1.180 1.00 12.31 ? 147 PHE A CG 1 +ATOM 1160 C CD1 . PHE A 1 147 ? 29.941 -1.799 2.414 1.00 11.68 ? 147 PHE A CD1 1 +ATOM 1161 C CD2 . PHE A 1 147 ? 30.206 -1.506 0.030 1.00 12.08 ? 147 PHE A CD2 1 +ATOM 1162 C CE1 . PHE A 1 147 ? 31.200 -2.354 2.509 1.00 12.48 ? 147 PHE A CE1 1 +ATOM 1163 C CE2 . PHE A 1 147 ? 31.480 -2.074 0.102 1.00 13.40 ? 147 PHE A CE2 1 +ATOM 1164 C CZ . PHE A 1 147 ? 31.975 -2.485 1.356 1.00 13.37 ? 147 PHE A CZ 1 +ATOM 1165 N N . PHE A 1 148 ? 26.222 1.420 0.131 1.00 11.06 ? 148 PHE A N 1 +ATOM 1166 C CA . PHE A 1 148 ? 24.868 1.919 -0.176 1.00 10.06 ? 148 PHE A CA 1 +ATOM 1167 C C . PHE A 1 148 ? 23.906 0.747 -0.205 1.00 9.73 ? 148 PHE A C 1 +ATOM 1168 O O . PHE A 1 148 ? 24.243 -0.321 -0.762 1.00 14.19 ? 148 PHE A O 1 +ATOM 1169 C CB . PHE A 1 148 ? 24.887 2.731 -1.483 1.00 9.06 ? 148 PHE A CB 1 +ATOM 1170 C CG . PHE A 1 148 ? 23.621 3.425 -1.854 1.00 9.56 ? 148 PHE A CG 1 +ATOM 1171 C CD1 . PHE A 1 148 ? 23.282 4.646 -1.287 1.00 8.05 ? 148 PHE A CD1 1 +ATOM 1172 C CD2 . PHE A 1 148 ? 22.747 2.844 -2.796 1.00 10.17 ? 148 PHE A CD2 1 +ATOM 1173 C CE1 . PHE A 1 148 ? 22.094 5.286 -1.612 1.00 9.27 ? 148 PHE A CE1 1 +ATOM 1174 C CE2 . PHE A 1 148 ? 21.562 3.472 -3.150 1.00 11.27 ? 148 PHE A CE2 1 +ATOM 1175 C CZ . PHE A 1 148 ? 21.238 4.715 -2.546 1.00 10.79 ? 148 PHE A CZ 1 +ATOM 1176 N N . PRO A 1 149 ? 22.743 0.923 0.377 1.00 12.12 ? 149 PRO A N 1 +ATOM 1177 C CA . PRO A 1 149 ? 21.689 -0.087 0.406 1.00 13.66 ? 149 PRO A CA 1 +ATOM 1178 C C . PRO A 1 149 ? 21.281 -0.468 -1.015 1.00 16.46 ? 149 PRO A C 1 +ATOM 1179 O O . PRO A 1 149 ? 21.384 0.350 -1.957 1.00 13.79 ? 149 PRO A O 1 +ATOM 1180 C CB . PRO A 1 149 ? 20.548 0.552 1.172 1.00 14.14 ? 149 PRO A CB 1 +ATOM 1181 C CG . PRO A 1 149 ? 20.874 1.984 1.344 1.00 14.04 ? 149 PRO A CG 1 +ATOM 1182 C CD . PRO A 1 149 ? 22.339 2.169 1.047 1.00 14.70 ? 149 PRO A CD 1 +ATOM 1183 N N . GLU A 1 150 ? 20.824 -1.704 -1.139 1.00 18.19 ? 150 GLU A N 1 +ATOM 1184 C CA . GLU A 1 150 ? 20.372 -2.222 -2.465 1.00 21.14 ? 150 GLU A CA 1 +ATOM 1185 C C . GLU A 1 150 ? 19.133 -1.444 -2.854 1.00 20.86 ? 150 GLU A C 1 +ATOM 1186 O O . GLU A 1 150 ? 18.272 -1.186 -1.984 1.00 20.37 ? 150 GLU A O 1 +ATOM 1187 C CB . GLU A 1 150 ? 20.044 -3.692 -2.418 1.00 24.56 ? 150 GLU A CB 1 +ATOM 1188 C CG . GLU A 1 150 ? 19.006 -4.149 -1.355 1.00 28.89 ? 150 GLU A CG 1 +ATOM 1189 C CD . GLU A 1 150 ? 18.410 -5.504 -1.680 1.00 30.29 ? 150 GLU A CD 1 +ATOM 1190 O OE1 . GLU A 1 150 ? 17.310 -5.676 -2.136 1.00 29.58 ? 150 GLU A OE1 1 +ATOM 1191 O OE2 . GLU A 1 150 ? 19.246 -6.424 -1.494 1.00 33.45 ? 150 GLU A OE2 1 +ATOM 1192 N N . ILE A 1 151 ? 19.089 -1.044 -4.124 1.00 19.52 ? 151 ILE A N 1 +ATOM 1193 C CA . ILE A 1 151 ? 17.917 -0.305 -4.631 1.00 18.03 ? 151 ILE A CA 1 +ATOM 1194 C C . ILE A 1 151 ? 16.951 -1.327 -5.241 1.00 16.17 ? 151 ILE A C 1 +ATOM 1195 O O . ILE A 1 151 ? 17.325 -2.165 -6.070 1.00 15.84 ? 151 ILE A O 1 +ATOM 1196 C CB . ILE A 1 151 ? 18.247 0.898 -5.521 1.00 19.64 ? 151 ILE A CB 1 +ATOM 1197 C CG1 . ILE A 1 151 ? 17.431 0.817 -6.844 1.00 17.81 ? 151 ILE A CG1 1 +ATOM 1198 C CG2 . ILE A 1 151 ? 19.738 1.180 -5.769 1.00 18.70 ? 151 ILE A CG2 1 +ATOM 1199 C CD1 . ILE A 1 151 ? 17.098 2.193 -7.461 1.00 19.47 ? 151 ILE A CD1 1 +ATOM 1200 N N . ASP A 1 152 ? 15.733 -1.234 -4.756 1.00 14.08 ? 152 ASP A N 1 +ATOM 1201 C CA . ASP A 1 152 ? 14.643 -2.142 -5.172 1.00 14.54 ? 152 ASP A CA 1 +ATOM 1202 C C . ASP A 1 152 ? 14.047 -1.622 -6.485 1.00 15.04 ? 152 ASP A C 1 +ATOM 1203 O O . ASP A 1 152 ? 13.200 -0.726 -6.499 1.00 12.91 ? 152 ASP A O 1 +ATOM 1204 C CB . ASP A 1 152 ? 13.669 -2.340 -4.041 1.00 14.45 ? 152 ASP A CB 1 +ATOM 1205 C CG . ASP A 1 152 ? 12.471 -3.178 -4.333 1.00 16.63 ? 152 ASP A CG 1 +ATOM 1206 O OD1 . ASP A 1 152 ? 11.500 -3.211 -3.535 1.00 15.96 ? 152 ASP A OD1 1 +ATOM 1207 O OD2 . ASP A 1 152 ? 12.457 -3.838 -5.387 1.00 16.80 ? 152 ASP A OD2 1 +ATOM 1208 N N . LEU A 1 153 ? 14.514 -2.248 -7.553 1.00 15.27 ? 153 LEU A N 1 +ATOM 1209 C CA . LEU A 1 153 ? 14.087 -1.921 -8.924 1.00 17.05 ? 153 LEU A CA 1 +ATOM 1210 C C . LEU A 1 153 ? 12.636 -2.259 -9.161 1.00 18.05 ? 153 LEU A C 1 +ATOM 1211 O O . LEU A 1 153 ? 12.071 -1.961 -10.256 1.00 16.53 ? 153 LEU A O 1 +ATOM 1212 C CB . LEU A 1 153 ? 15.090 -2.613 -9.862 1.00 18.16 ? 153 LEU A CB 1 +ATOM 1213 C CG . LEU A 1 153 ? 16.065 -1.734 -10.620 1.00 19.41 ? 153 LEU A CG 1 +ATOM 1214 C CD1 . LEU A 1 153 ? 16.499 -0.535 -9.849 1.00 17.27 ? 153 LEU A CD1 1 +ATOM 1215 C CD2 . LEU A 1 153 ? 17.264 -2.603 -11.038 1.00 20.28 ? 153 LEU A CD2 1 +ATOM 1216 N N . GLU A 1 154 ? 12.006 -2.836 -8.166 1.00 19.62 ? 154 GLU A N 1 +ATOM 1217 C CA . GLU A 1 154 ? 10.579 -3.212 -8.219 1.00 21.86 ? 154 GLU A CA 1 +ATOM 1218 C C . GLU A 1 154 ? 9.700 -2.034 -7.853 1.00 21.87 ? 154 GLU A C 1 +ATOM 1219 O O . GLU A 1 154 ? 8.451 -2.137 -7.914 1.00 24.16 ? 154 GLU A O 1 +ATOM 1220 C CB . GLU A 1 154 ? 10.268 -4.375 -7.303 1.00 23.60 ? 154 GLU A CB 1 +ATOM 1221 C CG . GLU A 1 154 ? 9.280 -5.428 -7.650 1.00 25.18 ? 154 GLU A CG 1 +ATOM 1222 C CD . GLU A 1 154 ? 9.589 -6.474 -8.652 1.00 26.87 ? 154 GLU A CD 1 +ATOM 1223 O OE1 . GLU A 1 154 ? 9.346 -6.342 -9.863 1.00 28.45 ? 154 GLU A OE1 1 +ATOM 1224 O OE2 . GLU A 1 154 ? 10.020 -7.542 -8.188 1.00 25.90 ? 154 GLU A OE2 1 +ATOM 1225 N N . LYS A 1 155 ? 10.318 -0.942 -7.433 1.00 20.42 ? 155 LYS A N 1 +ATOM 1226 C CA . LYS A 1 155 ? 9.594 0.281 -7.063 1.00 20.39 ? 155 LYS A CA 1 +ATOM 1227 C C . LYS A 1 155 ? 10.287 1.513 -7.625 1.00 20.34 ? 155 LYS A C 1 +ATOM 1228 O O . LYS A 1 155 ? 9.595 2.515 -7.945 1.00 22.41 ? 155 LYS A O 1 +ATOM 1229 C CB . LYS A 1 155 ? 9.385 0.434 -5.577 1.00 21.92 ? 155 LYS A CB 1 +ATOM 1230 C CG . LYS A 1 155 ? 10.595 0.120 -4.717 1.00 22.19 ? 155 LYS A CG 1 +ATOM 1231 C CD . LYS A 1 155 ? 10.271 -0.521 -3.423 1.00 25.43 ? 155 LYS A CD 1 +ATOM 1232 C CE . LYS A 1 155 ? 9.038 -1.396 -3.409 1.00 26.80 ? 155 LYS A CE 1 +ATOM 1233 N NZ . LYS A 1 155 ? 8.605 -1.640 -2.005 1.00 26.91 ? 155 LYS A NZ 1 +ATOM 1234 N N . TYR A 1 156 ? 11.605 1.443 -7.704 1.00 18.69 ? 156 TYR A N 1 +ATOM 1235 C CA . TYR A 1 156 ? 12.391 2.556 -8.276 1.00 17.11 ? 156 TYR A CA 1 +ATOM 1236 C C . TYR A 1 156 ? 12.590 2.297 -9.776 1.00 15.02 ? 156 TYR A C 1 +ATOM 1237 O O . TYR A 1 156 ? 13.172 1.285 -10.148 1.00 14.68 ? 156 TYR A O 1 +ATOM 1238 C CB . TYR A 1 156 ? 13.712 2.786 -7.582 1.00 17.51 ? 156 TYR A CB 1 +ATOM 1239 C CG . TYR A 1 156 ? 13.609 3.351 -6.180 1.00 17.93 ? 156 TYR A CG 1 +ATOM 1240 C CD1 . TYR A 1 156 ? 13.438 2.491 -5.087 1.00 19.11 ? 156 TYR A CD1 1 +ATOM 1241 C CD2 . TYR A 1 156 ? 13.666 4.717 -5.951 1.00 18.33 ? 156 TYR A CD2 1 +ATOM 1242 C CE1 . TYR A 1 156 ? 13.329 3.001 -3.790 1.00 17.60 ? 156 TYR A CE1 1 +ATOM 1243 C CE2 . TYR A 1 156 ? 13.571 5.241 -4.665 1.00 18.63 ? 156 TYR A CE2 1 +ATOM 1244 C CZ . TYR A 1 156 ? 13.410 4.366 -3.585 1.00 19.64 ? 156 TYR A CZ 1 +ATOM 1245 O OH . TYR A 1 156 ? 13.306 4.914 -2.337 1.00 19.55 ? 156 TYR A OH 1 +ATOM 1246 N N . LYS A 1 157 ? 12.114 3.244 -10.552 1.00 14.13 ? 157 LYS A N 1 +ATOM 1247 C CA . LYS A 1 157 ? 12.242 3.218 -12.016 1.00 12.82 ? 157 LYS A CA 1 +ATOM 1248 C C . LYS A 1 157 ? 13.374 4.194 -12.395 1.00 10.32 ? 157 LYS A C 1 +ATOM 1249 O O . LYS A 1 157 ? 13.431 5.306 -11.847 1.00 9.51 ? 157 LYS A O 1 +ATOM 1250 C CB . LYS A 1 157 ? 10.976 3.621 -12.732 1.00 15.82 ? 157 LYS A CB 1 +ATOM 1251 C CG . LYS A 1 157 ? 11.171 4.608 -13.872 1.00 20.29 ? 157 LYS A CG 1 +ATOM 1252 C CD . LYS A 1 157 ? 10.003 5.454 -14.212 1.00 20.96 ? 157 LYS A CD 1 +ATOM 1253 C CE . LYS A 1 157 ? 8.897 5.568 -13.271 1.00 22.22 ? 157 LYS A CE 1 +ATOM 1254 N NZ . LYS A 1 157 ? 8.959 6.741 -12.370 1.00 22.51 ? 157 LYS A NZ 1 +ATOM 1255 N N . LEU A 1 158 ? 14.253 3.688 -13.220 1.00 7.75 ? 158 LEU A N 1 +ATOM 1256 C CA . LEU A 1 158 ? 15.405 4.552 -13.703 1.00 8.77 ? 158 LEU A CA 1 +ATOM 1257 C C . LEU A 1 158 ? 14.796 5.366 -14.852 1.00 9.49 ? 158 LEU A C 1 +ATOM 1258 O O . LEU A 1 158 ? 14.172 4.721 -15.741 1.00 10.93 ? 158 LEU A O 1 +ATOM 1259 C CB . LEU A 1 158 ? 16.529 3.625 -14.008 1.00 9.71 ? 158 LEU A CB 1 +ATOM 1260 C CG . LEU A 1 158 ? 17.621 3.921 -14.987 1.00 9.32 ? 158 LEU A CG 1 +ATOM 1261 C CD1 . LEU A 1 158 ? 18.506 5.068 -14.522 1.00 12.48 ? 158 LEU A CD1 1 +ATOM 1262 C CD2 . LEU A 1 158 ? 18.466 2.665 -15.193 1.00 10.77 ? 158 LEU A CD2 1 +ATOM 1263 N N . LEU A 1 159 ? 14.888 6.660 -14.780 1.00 9.96 ? 159 LEU A N 1 +ATOM 1264 C CA . LEU A 1 159 ? 14.338 7.554 -15.799 1.00 10.92 ? 159 LEU A CA 1 +ATOM 1265 C C . LEU A 1 159 ? 15.313 7.617 -17.005 1.00 11.25 ? 159 LEU A C 1 +ATOM 1266 O O . LEU A 1 159 ? 16.525 7.616 -16.844 1.00 6.94 ? 159 LEU A O 1 +ATOM 1267 C CB . LEU A 1 159 ? 13.919 8.851 -15.294 1.00 14.21 ? 159 LEU A CB 1 +ATOM 1268 C CG . LEU A 1 159 ? 13.878 9.465 -13.996 1.00 17.70 ? 159 LEU A CG 1 +ATOM 1269 C CD1 . LEU A 1 159 ? 13.705 11.003 -14.107 1.00 19.29 ? 159 LEU A CD1 1 +ATOM 1270 C CD2 . LEU A 1 159 ? 12.702 8.954 -13.158 1.00 20.62 ? 159 LEU A CD2 1 +ATOM 1271 N N . PRO A 1 160 ? 14.662 7.746 -18.159 1.00 12.01 ? 160 PRO A N 1 +ATOM 1272 C CA . PRO A 1 160 ? 15.343 7.807 -19.448 1.00 13.46 ? 160 PRO A CA 1 +ATOM 1273 C C . PRO A 1 160 ? 16.260 8.998 -19.578 1.00 12.57 ? 160 PRO A C 1 +ATOM 1274 O O . PRO A 1 160 ? 17.321 8.918 -20.238 1.00 13.14 ? 160 PRO A O 1 +ATOM 1275 C CB . PRO A 1 160 ? 14.215 7.827 -20.481 1.00 12.96 ? 160 PRO A CB 1 +ATOM 1276 C CG . PRO A 1 160 ? 13.014 7.318 -19.769 1.00 13.91 ? 160 PRO A CG 1 +ATOM 1277 C CD . PRO A 1 160 ? 13.192 7.723 -18.309 1.00 12.97 ? 160 PRO A CD 1 +ATOM 1278 N N . GLU A 1 161 ? 15.877 10.096 -18.974 1.00 12.23 ? 161 GLU A N 1 +ATOM 1279 C CA . GLU A 1 161 ? 16.560 11.354 -18.956 1.00 16.07 ? 161 GLU A CA 1 +ATOM 1280 C C . GLU A 1 161 ? 15.977 12.261 -17.831 1.00 13.56 ? 161 GLU A C 1 +ATOM 1281 O O . GLU A 1 161 ? 14.837 12.113 -17.426 1.00 12.13 ? 161 GLU A O 1 +ATOM 1282 C CB . GLU A 1 161 ? 16.358 12.202 -20.218 1.00 21.11 ? 161 GLU A CB 1 +ATOM 1283 C CG . GLU A 1 161 ? 16.378 11.618 -21.587 1.00 28.51 ? 161 GLU A CG 1 +ATOM 1284 C CD . GLU A 1 161 ? 16.933 12.472 -22.699 1.00 31.77 ? 161 GLU A CD 1 +ATOM 1285 O OE1 . GLU A 1 161 ? 16.510 13.577 -22.999 1.00 34.07 ? 161 GLU A OE1 1 +ATOM 1286 O OE2 . GLU A 1 161 ? 17.899 11.928 -23.257 1.00 33.59 ? 161 GLU A OE2 1 +ATOM 1287 N N . TYR A 1 162 ? 16.816 13.204 -17.473 1.00 14.22 ? 162 TYR A N 1 +ATOM 1288 C CA . TYR A 1 162 ? 16.471 14.259 -16.507 1.00 13.40 ? 162 TYR A CA 1 +ATOM 1289 C C . TYR A 1 162 ? 17.146 15.552 -16.972 1.00 13.33 ? 162 TYR A C 1 +ATOM 1290 O O . TYR A 1 162 ? 18.336 15.552 -17.331 1.00 14.40 ? 162 TYR A O 1 +ATOM 1291 C CB . TYR A 1 162 ? 16.816 13.894 -15.062 1.00 11.97 ? 162 TYR A CB 1 +ATOM 1292 C CG . TYR A 1 162 ? 15.913 14.576 -14.041 1.00 10.40 ? 162 TYR A CG 1 +ATOM 1293 C CD1 . TYR A 1 162 ? 14.651 14.050 -13.742 1.00 9.95 ? 162 TYR A CD1 1 +ATOM 1294 C CD2 . TYR A 1 162 ? 16.308 15.735 -13.403 1.00 10.61 ? 162 TYR A CD2 1 +ATOM 1295 C CE1 . TYR A 1 162 ? 13.809 14.667 -12.824 1.00 9.33 ? 162 TYR A CE1 1 +ATOM 1296 C CE2 . TYR A 1 162 ? 15.472 16.376 -12.481 1.00 10.62 ? 162 TYR A CE2 1 +ATOM 1297 C CZ . TYR A 1 162 ? 14.234 15.843 -12.194 1.00 8.42 ? 162 TYR A CZ 1 +ATOM 1298 O OH . TYR A 1 162 ? 13.437 16.498 -11.300 1.00 11.91 ? 162 TYR A OH 1 +ATOM 1299 N N . PRO A 1 163 ? 16.344 16.601 -17.042 1.00 13.75 ? 163 PRO A N 1 +ATOM 1300 C CA . PRO A 1 163 ? 16.843 17.926 -17.453 1.00 13.10 ? 163 PRO A CA 1 +ATOM 1301 C C . PRO A 1 163 ? 17.950 18.352 -16.489 1.00 12.98 ? 163 PRO A C 1 +ATOM 1302 O O . PRO A 1 163 ? 17.796 18.264 -15.259 1.00 12.50 ? 163 PRO A O 1 +ATOM 1303 C CB . PRO A 1 163 ? 15.639 18.819 -17.442 1.00 12.59 ? 163 PRO A CB 1 +ATOM 1304 C CG . PRO A 1 163 ? 14.481 18.036 -16.959 1.00 11.88 ? 163 PRO A CG 1 +ATOM 1305 C CD . PRO A 1 163 ? 14.925 16.649 -16.662 1.00 11.84 ? 163 PRO A CD 1 +ATOM 1306 N N . GLY A 1 164 ? 19.055 18.793 -17.050 1.00 13.29 ? 164 GLY A N 1 +ATOM 1307 C CA . GLY A 1 164 ? 20.220 19.261 -16.347 1.00 14.07 ? 164 GLY A CA 1 +ATOM 1308 C C . GLY A 1 164 ? 21.237 18.203 -16.016 1.00 14.06 ? 164 GLY A C 1 +ATOM 1309 O O . GLY A 1 164 ? 22.363 18.559 -15.542 1.00 15.11 ? 164 GLY A O 1 +ATOM 1310 N N . VAL A 1 165 ? 20.911 16.955 -16.246 1.00 11.11 ? 165 VAL A N 1 +ATOM 1311 C CA . VAL A 1 165 ? 21.772 15.812 -15.944 1.00 13.15 ? 165 VAL A CA 1 +ATOM 1312 C C . VAL A 1 165 ? 22.279 15.132 -17.215 1.00 13.68 ? 165 VAL A C 1 +ATOM 1313 O O . VAL A 1 165 ? 21.461 14.628 -18.014 1.00 13.61 ? 165 VAL A O 1 +ATOM 1314 C CB . VAL A 1 165 ? 20.961 14.812 -15.052 1.00 13.06 ? 165 VAL A CB 1 +ATOM 1315 C CG1 . VAL A 1 165 ? 21.670 13.505 -14.856 1.00 11.98 ? 165 VAL A CG1 1 +ATOM 1316 C CG2 . VAL A 1 165 ? 20.570 15.459 -13.730 1.00 16.13 ? 165 VAL A CG2 1 +ATOM 1317 N N . LEU A 1 166 ? 23.587 15.093 -17.354 1.00 15.03 ? 166 LEU A N 1 +ATOM 1318 C CA . LEU A 1 166 ? 24.257 14.448 -18.491 1.00 17.50 ? 166 LEU A CA 1 +ATOM 1319 C C . LEU A 1 166 ? 23.942 12.926 -18.401 1.00 17.67 ? 166 LEU A C 1 +ATOM 1320 O O . LEU A 1 166 ? 24.092 12.340 -17.341 1.00 19.17 ? 166 LEU A O 1 +ATOM 1321 C CB . LEU A 1 166 ? 25.691 14.754 -18.574 1.00 17.34 ? 166 LEU A CB 1 +ATOM 1322 C CG . LEU A 1 166 ? 26.533 15.696 -17.870 1.00 17.03 ? 166 LEU A CG 1 +ATOM 1323 C CD1 . LEU A 1 166 ? 27.781 16.103 -18.692 1.00 15.94 ? 166 LEU A CD1 1 +ATOM 1324 C CD2 . LEU A 1 166 ? 25.835 16.957 -17.495 1.00 19.32 ? 166 LEU A CD2 1 +ATOM 1325 N N . SER A 1 167 ? 23.573 12.396 -19.566 1.00 19.65 ? 167 SER A N 1 +ATOM 1326 C CA . SER A 1 167 ? 23.203 10.968 -19.633 1.00 19.52 ? 167 SER A CA 1 +ATOM 1327 C C . SER A 1 167 ? 24.258 10.101 -20.260 1.00 17.80 ? 167 SER A C 1 +ATOM 1328 O O . SER A 1 167 ? 24.099 8.841 -20.236 1.00 14.61 ? 167 SER A O 1 +ATOM 1329 C CB . SER A 1 167 ? 21.818 10.783 -20.230 1.00 19.91 ? 167 SER A CB 1 +ATOM 1330 O OG . SER A 1 167 ? 21.760 11.263 -21.539 1.00 22.87 ? 167 SER A OG 1 +ATOM 1331 N N . ASP A 1 168 ? 25.308 10.690 -20.764 1.00 16.88 ? 168 ASP A N 1 +ATOM 1332 C CA . ASP A 1 168 ? 26.442 9.940 -21.362 1.00 17.96 ? 168 ASP A CA 1 +ATOM 1333 C C . ASP A 1 168 ? 27.524 9.782 -20.289 1.00 17.68 ? 168 ASP A C 1 +ATOM 1334 O O . ASP A 1 168 ? 27.414 10.404 -19.210 1.00 20.47 ? 168 ASP A O 1 +ATOM 1335 C CB . ASP A 1 168 ? 26.910 10.563 -22.658 1.00 18.45 ? 168 ASP A CB 1 +ATOM 1336 C CG . ASP A 1 168 ? 27.803 11.779 -22.449 1.00 18.98 ? 168 ASP A CG 1 +ATOM 1337 O OD1 . ASP A 1 168 ? 28.756 12.002 -23.200 1.00 17.78 ? 168 ASP A OD1 1 +ATOM 1338 O OD2 . ASP A 1 168 ? 27.493 12.495 -21.479 1.00 20.46 ? 168 ASP A OD2 1 +ATOM 1339 N N . VAL A 1 169 ? 28.500 8.952 -20.579 1.00 17.52 ? 169 VAL A N 1 +ATOM 1340 C CA . VAL A 1 169 ? 29.575 8.636 -19.638 1.00 17.51 ? 169 VAL A CA 1 +ATOM 1341 C C . VAL A 1 169 ? 30.625 9.734 -19.588 1.00 19.07 ? 169 VAL A C 1 +ATOM 1342 O O . VAL A 1 169 ? 31.040 10.348 -20.558 1.00 18.43 ? 169 VAL A O 1 +ATOM 1343 C CB . VAL A 1 169 ? 30.080 7.209 -19.742 1.00 15.54 ? 169 VAL A CB 1 +ATOM 1344 C CG1 . VAL A 1 169 ? 29.215 6.271 -20.548 1.00 12.55 ? 169 VAL A CG1 1 +ATOM 1345 C CG2 . VAL A 1 169 ? 31.537 7.104 -20.105 1.00 17.27 ? 169 VAL A CG2 1 +ATOM 1346 N N . GLN A 1 170 ? 31.011 9.999 -18.324 1.00 17.96 ? 170 GLN A N 1 +ATOM 1347 C CA . GLN A 1 170 ? 32.010 11.032 -18.007 1.00 16.65 ? 170 GLN A CA 1 +ATOM 1348 C C . GLN A 1 170 ? 33.310 10.311 -17.655 1.00 17.20 ? 170 GLN A C 1 +ATOM 1349 O O . GLN A 1 170 ? 33.286 9.078 -17.485 1.00 15.46 ? 170 GLN A O 1 +ATOM 1350 C CB . GLN A 1 170 ? 31.538 11.937 -16.864 1.00 16.73 ? 170 GLN A CB 1 +ATOM 1351 C CG . GLN A 1 170 ? 30.153 12.484 -17.022 1.00 15.58 ? 170 GLN A CG 1 +ATOM 1352 C CD . GLN A 1 170 ? 29.917 13.234 -18.312 1.00 17.50 ? 170 GLN A CD 1 +ATOM 1353 O OE1 . GLN A 1 170 ? 30.681 14.071 -18.739 1.00 17.12 ? 170 GLN A OE1 1 +ATOM 1354 N NE2 . GLN A 1 170 ? 28.788 12.894 -18.959 1.00 16.79 ? 170 GLN A NE2 1 +ATOM 1355 N N . GLU A 1 171 ? 34.369 11.076 -17.566 1.00 18.87 ? 171 GLU A N 1 +ATOM 1356 C CA . GLU A 1 171 ? 35.691 10.572 -17.207 1.00 20.82 ? 171 GLU A CA 1 +ATOM 1357 C C . GLU A 1 171 ? 36.558 11.698 -16.638 1.00 21.42 ? 171 GLU A C 1 +ATOM 1358 O O . GLU A 1 171 ? 36.646 12.802 -17.210 1.00 19.41 ? 171 GLU A O 1 +ATOM 1359 C CB . GLU A 1 171 ? 36.424 9.946 -18.365 1.00 23.14 ? 171 GLU A CB 1 +ATOM 1360 C CG . GLU A 1 171 ? 37.840 9.410 -18.111 1.00 27.61 ? 171 GLU A CG 1 +ATOM 1361 C CD . GLU A 1 171 ? 38.384 8.543 -19.214 1.00 29.33 ? 171 GLU A CD 1 +ATOM 1362 O OE1 . GLU A 1 171 ? 39.234 7.687 -19.067 1.00 30.94 ? 171 GLU A OE1 1 +ATOM 1363 O OE2 . GLU A 1 171 ? 37.849 8.815 -20.312 1.00 32.22 ? 171 GLU A OE2 1 +ATOM 1364 N N . GLU A 1 172 ? 37.153 11.385 -15.512 1.00 22.74 ? 172 GLU A N 1 +ATOM 1365 C CA . GLU A 1 172 ? 38.063 12.334 -14.801 1.00 24.81 ? 172 GLU A CA 1 +ATOM 1366 C C . GLU A 1 172 ? 39.105 11.473 -14.087 1.00 24.19 ? 172 GLU A C 1 +ATOM 1367 O O . GLU A 1 172 ? 38.760 10.365 -13.613 1.00 25.04 ? 172 GLU A O 1 +ATOM 1368 C CB . GLU A 1 172 ? 37.325 13.161 -13.790 1.00 27.63 ? 172 GLU A CB 1 +ATOM 1369 C CG . GLU A 1 172 ? 37.481 14.645 -13.665 1.00 32.75 ? 172 GLU A CG 1 +ATOM 1370 C CD . GLU A 1 172 ? 38.303 15.198 -12.554 1.00 35.51 ? 172 GLU A CD 1 +ATOM 1371 O OE1 . GLU A 1 172 ? 39.355 15.830 -12.685 1.00 36.27 ? 172 GLU A OE1 1 +ATOM 1372 O OE2 . GLU A 1 172 ? 37.831 14.925 -11.428 1.00 37.24 ? 172 GLU A OE2 1 +ATOM 1373 N N . LYS A 1 173 ? 40.334 11.934 -14.105 1.00 23.77 ? 173 LYS A N 1 +ATOM 1374 C CA . LYS A 1 173 ? 41.435 11.209 -13.413 1.00 22.77 ? 173 LYS A CA 1 +ATOM 1375 C C . LYS A 1 173 ? 41.456 9.755 -13.781 1.00 20.11 ? 173 LYS A C 1 +ATOM 1376 O O . LYS A 1 173 ? 41.818 8.875 -12.957 1.00 19.58 ? 173 LYS A O 1 +ATOM 1377 C CB . LYS A 1 173 ? 41.256 11.347 -11.881 1.00 23.67 ? 173 LYS A CB 1 +ATOM 1378 C CG . LYS A 1 173 ? 40.943 12.742 -11.405 1.00 25.26 ? 173 LYS A CG 1 +ATOM 1379 C CD . LYS A 1 173 ? 42.051 13.338 -10.558 1.00 25.66 ? 173 LYS A CD 1 +ATOM 1380 C CE . LYS A 1 173 ? 42.128 12.681 -9.187 1.00 27.77 ? 173 LYS A CE 1 +ATOM 1381 N NZ . LYS A 1 173 ? 42.345 13.756 -8.148 1.00 27.78 ? 173 LYS A NZ 1 +ATOM 1382 N N . GLY A 1 174 ? 41.057 9.456 -15.014 1.00 18.83 ? 174 GLY A N 1 +ATOM 1383 C CA . GLY A 1 174 ? 41.044 8.104 -15.554 1.00 15.27 ? 174 GLY A CA 1 +ATOM 1384 C C . GLY A 1 174 ? 39.896 7.273 -15.052 1.00 14.33 ? 174 GLY A C 1 +ATOM 1385 O O . GLY A 1 174 ? 39.857 6.038 -15.313 1.00 14.31 ? 174 GLY A O 1 +ATOM 1386 N N . ILE A 1 175 ? 38.959 7.888 -14.366 1.00 14.45 ? 175 ILE A N 1 +ATOM 1387 C CA . ILE A 1 175 ? 37.777 7.228 -13.824 1.00 12.71 ? 175 ILE A CA 1 +ATOM 1388 C C . ILE A 1 175 ? 36.522 7.671 -14.596 1.00 11.03 ? 175 ILE A C 1 +ATOM 1389 O O . ILE A 1 175 ? 36.222 8.865 -14.659 1.00 12.30 ? 175 ILE A O 1 +ATOM 1390 C CB . ILE A 1 175 ? 37.597 7.465 -12.294 1.00 12.36 ? 175 ILE A CB 1 +ATOM 1391 C CG1 . ILE A 1 175 ? 38.849 7.123 -11.504 1.00 14.28 ? 175 ILE A CG1 1 +ATOM 1392 C CG2 . ILE A 1 175 ? 36.341 6.665 -11.752 1.00 12.98 ? 175 ILE A CG2 1 +ATOM 1393 C CD1 . ILE A 1 175 ? 38.691 7.190 -9.964 1.00 16.05 ? 175 ILE A CD1 1 +ATOM 1394 N N . LYS A 1 176 ? 35.831 6.676 -15.096 1.00 13.00 ? 176 LYS A N 1 +ATOM 1395 C CA . LYS A 1 176 ? 34.592 6.879 -15.878 1.00 13.03 ? 176 LYS A CA 1 +ATOM 1396 C C . LYS A 1 176 ? 33.396 6.727 -14.957 1.00 10.69 ? 176 LYS A C 1 +ATOM 1397 O O . LYS A 1 176 ? 33.353 5.762 -14.153 1.00 9.53 ? 176 LYS A O 1 +ATOM 1398 C CB . LYS A 1 176 ? 34.507 5.887 -17.040 1.00 16.61 ? 176 LYS A CB 1 +ATOM 1399 C CG . LYS A 1 176 ? 35.716 5.901 -17.970 1.00 19.37 ? 176 LYS A CG 1 +ATOM 1400 C CD . LYS A 1 176 ? 35.317 5.783 -19.436 1.00 24.20 ? 176 LYS A CD 1 +ATOM 1401 C CE . LYS A 1 176 ? 35.377 7.090 -20.182 1.00 26.54 ? 176 LYS A CE 1 +ATOM 1402 N NZ . LYS A 1 176 ? 34.818 6.998 -21.544 1.00 27.33 ? 176 LYS A NZ 1 +ATOM 1403 N N . TYR A 1 177 ? 32.503 7.695 -15.025 1.00 9.42 ? 177 TYR A N 1 +ATOM 1404 C CA . TYR A 1 177 ? 31.284 7.682 -14.176 1.00 10.82 ? 177 TYR A CA 1 +ATOM 1405 C C . TYR A 1 177 ? 30.069 8.043 -15.039 1.00 10.21 ? 177 TYR A C 1 +ATOM 1406 O O . TYR A 1 177 ? 30.211 8.591 -16.144 1.00 8.78 ? 177 TYR A O 1 +ATOM 1407 C CB . TYR A 1 177 ? 31.409 8.510 -12.925 1.00 8.40 ? 177 TYR A CB 1 +ATOM 1408 C CG . TYR A 1 177 ? 31.854 9.938 -13.068 1.00 7.36 ? 177 TYR A CG 1 +ATOM 1409 C CD1 . TYR A 1 177 ? 30.933 10.971 -13.300 1.00 8.75 ? 177 TYR A CD1 1 +ATOM 1410 C CD2 . TYR A 1 177 ? 33.201 10.280 -12.998 1.00 8.38 ? 177 TYR A CD2 1 +ATOM 1411 C CE1 . TYR A 1 177 ? 31.341 12.288 -13.436 1.00 8.05 ? 177 TYR A CE1 1 +ATOM 1412 C CE2 . TYR A 1 177 ? 33.628 11.598 -13.137 1.00 6.77 ? 177 TYR A CE2 1 +ATOM 1413 C CZ . TYR A 1 177 ? 32.704 12.595 -13.347 1.00 5.14 ? 177 TYR A CZ 1 +ATOM 1414 O OH . TYR A 1 177 ? 33.149 13.880 -13.481 1.00 9.71 ? 177 TYR A OH 1 +ATOM 1415 N N . LYS A 1 178 ? 28.927 7.713 -14.514 1.00 10.62 ? 178 LYS A N 1 +ATOM 1416 C CA . LYS A 1 178 ? 27.608 7.907 -15.117 1.00 9.69 ? 178 LYS A CA 1 +ATOM 1417 C C . LYS A 1 178 ? 26.660 8.511 -14.068 1.00 10.55 ? 178 LYS A C 1 +ATOM 1418 O O . LYS A 1 178 ? 26.772 8.159 -12.879 1.00 10.37 ? 178 LYS A O 1 +ATOM 1419 C CB . LYS A 1 178 ? 27.018 6.523 -15.442 1.00 12.89 ? 178 LYS A CB 1 +ATOM 1420 C CG . LYS A 1 178 ? 26.558 6.203 -16.779 1.00 15.31 ? 178 LYS A CG 1 +ATOM 1421 C CD . LYS A 1 178 ? 26.628 4.734 -17.151 1.00 17.43 ? 178 LYS A CD 1 +ATOM 1422 C CE . LYS A 1 178 ? 26.033 3.804 -16.123 1.00 16.41 ? 178 LYS A CE 1 +ATOM 1423 N NZ . LYS A 1 178 ? 26.233 2.375 -16.615 1.00 19.44 ? 178 LYS A NZ 1 +ATOM 1424 N N . PHE A 1 179 ? 25.741 9.320 -14.531 1.00 6.83 ? 179 PHE A N 1 +ATOM 1425 C CA . PHE A 1 179 ? 24.714 9.927 -13.676 1.00 8.80 ? 179 PHE A CA 1 +ATOM 1426 C C . PHE A 1 179 ? 23.370 9.217 -13.986 1.00 9.64 ? 179 PHE A C 1 +ATOM 1427 O O . PHE A 1 179 ? 23.020 9.057 -15.151 1.00 9.25 ? 179 PHE A O 1 +ATOM 1428 C CB . PHE A 1 179 ? 24.569 11.422 -13.842 1.00 7.87 ? 179 PHE A CB 1 +ATOM 1429 C CG . PHE A 1 179 ? 25.827 12.214 -13.668 1.00 8.36 ? 179 PHE A CG 1 +ATOM 1430 C CD1 . PHE A 1 179 ? 26.394 12.865 -14.766 1.00 7.79 ? 179 PHE A CD1 1 +ATOM 1431 C CD2 . PHE A 1 179 ? 26.433 12.304 -12.419 1.00 7.33 ? 179 PHE A CD2 1 +ATOM 1432 C CE1 . PHE A 1 179 ? 27.557 13.603 -14.623 1.00 8.50 ? 179 PHE A CE1 1 +ATOM 1433 C CE2 . PHE A 1 179 ? 27.610 13.043 -12.253 1.00 9.24 ? 179 PHE A CE2 1 +ATOM 1434 C CZ . PHE A 1 179 ? 28.169 13.683 -13.375 1.00 9.16 ? 179 PHE A CZ 1 +ATOM 1435 N N . GLU A 1 180 ? 22.720 8.846 -12.897 1.00 8.72 ? 180 GLU A N 1 +ATOM 1436 C CA . GLU A 1 180 ? 21.408 8.174 -13.004 1.00 10.36 ? 180 GLU A CA 1 +ATOM 1437 C C . GLU A 1 180 ? 20.440 8.744 -11.999 1.00 11.48 ? 180 GLU A C 1 +ATOM 1438 O O . GLU A 1 180 ? 20.856 9.087 -10.867 1.00 14.03 ? 180 GLU A O 1 +ATOM 1439 C CB . GLU A 1 180 ? 21.549 6.670 -12.719 1.00 10.28 ? 180 GLU A CB 1 +ATOM 1440 C CG . GLU A 1 180 ? 22.341 5.849 -13.718 1.00 8.75 ? 180 GLU A CG 1 +ATOM 1441 C CD . GLU A 1 180 ? 22.514 4.407 -13.436 1.00 10.86 ? 180 GLU A CD 1 +ATOM 1442 O OE1 . GLU A 1 180 ? 23.034 3.599 -14.188 1.00 8.81 ? 180 GLU A OE1 1 +ATOM 1443 O OE2 . GLU A 1 180 ? 22.060 4.082 -12.306 1.00 13.07 ? 180 GLU A OE2 1 +ATOM 1444 N N . VAL A 1 181 ? 19.180 8.819 -12.402 1.00 2.96 ? 181 VAL A N 1 +ATOM 1445 C CA . VAL A 1 181 ? 18.105 9.277 -11.510 1.00 7.56 ? 181 VAL A CA 1 +ATOM 1446 C C . VAL A 1 181 ? 16.946 8.273 -11.577 1.00 9.42 ? 181 VAL A C 1 +ATOM 1447 O O . VAL A 1 181 ? 16.479 7.892 -12.636 1.00 12.41 ? 181 VAL A O 1 +ATOM 1448 C CB . VAL A 1 181 ? 17.756 10.731 -11.649 1.00 3.43 ? 181 VAL A CB 1 +ATOM 1449 C CG1 . VAL A 1 181 ? 18.703 11.507 -12.595 1.00 7.59 ? 181 VAL A CG1 1 +ATOM 1450 C CG2 . VAL A 1 181 ? 16.325 11.042 -11.922 1.00 9.73 ? 181 VAL A CG2 1 +ATOM 1451 N N . TYR A 1 182 ? 16.580 7.820 -10.387 1.00 0.91 ? 182 TYR A N 1 +ATOM 1452 C CA . TYR A 1 182 ? 15.492 6.889 -10.154 1.00 4.21 ? 182 TYR A CA 1 +ATOM 1453 C C . TYR A 1 182 ? 14.387 7.621 -9.364 1.00 8.01 ? 182 TYR A C 1 +ATOM 1454 O O . TYR A 1 182 ? 14.696 8.429 -8.481 1.00 13.52 ? 182 TYR A O 1 +ATOM 1455 C CB . TYR A 1 182 ? 15.941 5.662 -9.359 1.00 4.24 ? 182 TYR A CB 1 +ATOM 1456 C CG . TYR A 1 182 ? 17.147 4.923 -9.857 1.00 1.15 ? 182 TYR A CG 1 +ATOM 1457 C CD1 . TYR A 1 182 ? 18.443 5.419 -9.712 1.00 5.77 ? 182 TYR A CD1 1 +ATOM 1458 C CD2 . TYR A 1 182 ? 16.991 3.675 -10.475 1.00 0.75 ? 182 TYR A CD2 1 +ATOM 1459 C CE1 . TYR A 1 182 ? 19.550 4.702 -10.172 1.00 0.00 ? 182 TYR A CE1 1 +ATOM 1460 C CE2 . TYR A 1 182 ? 18.082 2.946 -10.927 1.00 0.75 ? 182 TYR A CE2 1 +ATOM 1461 C CZ . TYR A 1 182 ? 19.365 3.466 -10.763 1.00 2.47 ? 182 TYR A CZ 1 +ATOM 1462 O OH . TYR A 1 182 ? 20.410 2.704 -11.218 1.00 8.53 ? 182 TYR A OH 1 +ATOM 1463 N N . GLU A 1 183 ? 13.170 7.271 -9.678 1.00 11.91 ? 183 GLU A N 1 +ATOM 1464 C CA . GLU A 1 183 ? 11.978 7.839 -9.048 1.00 11.46 ? 183 GLU A CA 1 +ATOM 1465 C C . GLU A 1 183 ? 11.067 6.724 -8.543 1.00 12.87 ? 183 GLU A C 1 +ATOM 1466 O O . GLU A 1 183 ? 11.050 5.620 -9.106 1.00 13.11 ? 183 GLU A O 1 +ATOM 1467 C CB . GLU A 1 183 ? 11.173 8.662 -10.059 1.00 12.12 ? 183 GLU A CB 1 +ATOM 1468 C CG . GLU A 1 183 ? 10.093 9.589 -9.562 1.00 13.76 ? 183 GLU A CG 1 +ATOM 1469 C CD . GLU A 1 183 ? 9.452 10.502 -10.557 1.00 15.42 ? 183 GLU A CD 1 +ATOM 1470 O OE1 . GLU A 1 183 ? 9.222 11.680 -10.378 1.00 17.22 ? 183 GLU A OE1 1 +ATOM 1471 O OE2 . GLU A 1 183 ? 9.147 9.911 -11.629 1.00 17.06 ? 183 GLU A OE2 1 +ATOM 1472 N N . LYS A 1 184 ? 10.322 7.054 -7.514 1.00 16.41 ? 184 LYS A N 1 +ATOM 1473 C CA . LYS A 1 184 ? 9.357 6.138 -6.888 1.00 18.69 ? 184 LYS A CA 1 +ATOM 1474 C C . LYS A 1 184 ? 8.218 6.928 -6.254 1.00 22.25 ? 184 LYS A C 1 +ATOM 1475 O O . LYS A 1 184 ? 8.373 8.119 -5.916 1.00 24.03 ? 184 LYS A O 1 +ATOM 1476 C CB . LYS A 1 184 ? 10.042 5.271 -5.840 1.00 19.83 ? 184 LYS A CB 1 +ATOM 1477 C CG . LYS A 1 184 ? 10.048 5.882 -4.434 1.00 19.58 ? 184 LYS A CG 1 +ATOM 1478 C CD . LYS A 1 184 ? 8.965 5.251 -3.573 1.00 19.17 ? 184 LYS A CD 1 +ATOM 1479 C CE . LYS A 1 184 ? 9.402 5.145 -2.118 1.00 18.47 ? 184 LYS A CE 1 +ATOM 1480 N NZ . LYS A 1 184 ? 8.367 5.792 -1.244 1.00 19.25 ? 184 LYS A NZ 1 +ATOM 1481 N N . ASN A 1 185 ? 7.094 6.275 -6.133 1.00 26.20 ? 185 ASN A N 1 +ATOM 1482 C CA . ASN A 1 185 ? 5.855 6.788 -5.524 1.00 29.40 ? 185 ASN A CA 1 +ATOM 1483 C C . ASN A 1 185 ? 5.246 5.580 -4.747 1.00 31.64 ? 185 ASN A C 1 +ATOM 1484 O O . ASN A 1 185 ? 4.663 4.714 -5.419 1.00 33.12 ? 185 ASN A O 1 +ATOM 1485 C CB . ASN A 1 185 ? 4.886 7.293 -6.576 1.00 30.07 ? 185 ASN A CB 1 +ATOM 1486 C CG . ASN A 1 185 ? 4.064 8.482 -6.239 1.00 30.96 ? 185 ASN A CG 1 +ATOM 1487 O OD1 . ASN A 1 185 ? 3.399 9.079 -7.130 1.00 32.04 ? 185 ASN A OD1 1 +ATOM 1488 N ND2 . ASN A 1 185 ? 4.054 8.916 -4.969 1.00 32.75 ? 185 ASN A ND2 1 +ATOM 1489 N N . ASP A 1 186 ? 5.433 5.598 -3.470 1.00 35.12 ? 186 ASP A N 1 +ATOM 1490 C CA . ASP A 1 186 ? 4.997 4.484 -2.581 1.00 37.37 ? 186 ASP A CA 1 +ATOM 1491 C C . ASP A 1 186 ? 4.056 4.974 -1.491 1.00 38.92 ? 186 ASP A C 1 +ATOM 1492 O O . ASP A 1 186 ? 3.251 4.108 -1.063 1.00 40.09 ? 186 ASP A O 1 +ATOM 1493 C CB . ASP A 1 186 ? 6.249 3.817 -2.004 1.00 37.96 ? 186 ASP A CB 1 +ATOM 1494 C CG . ASP A 1 186 ? 6.191 2.406 -1.606 1.00 38.45 ? 186 ASP A CG 1 +ATOM 1495 O OD1 . ASP A 1 186 ? 5.789 1.481 -2.326 1.00 38.57 ? 186 ASP A OD1 1 +ATOM 1496 O OD2 . ASP A 1 186 ? 6.643 2.136 -0.419 1.00 39.31 ? 186 ASP A OD2 1 +ATOM 1497 O OXT . ASP A 1 186 ? 4.165 6.130 -1.056 1.00 40.27 ? 186 ASP A OXT 1 +HETATM 1498 S S . SO4 B 2 . ? 24.414 8.737 16.456 1.00 31.86 ? 613 SO4 A S 1 +HETATM 1499 O O1 . SO4 B 2 . ? 23.119 8.957 17.121 1.00 33.87 ? 613 SO4 A O1 1 +HETATM 1500 O O2 . SO4 B 2 . ? 24.695 9.894 15.511 1.00 36.13 ? 613 SO4 A O2 1 +HETATM 1501 O O3 . SO4 B 2 . ? 25.539 8.611 17.373 1.00 34.97 ? 613 SO4 A O3 1 +HETATM 1502 O O4 . SO4 B 2 . ? 24.468 7.478 15.754 1.00 34.59 ? 613 SO4 A O4 1 +HETATM 1503 S S . SO4 C 2 . ? 26.331 8.711 9.150 1.00 25.05 ? 614 SO4 A S 1 +HETATM 1504 O O1 . SO4 C 2 . ? 26.701 8.935 10.588 1.00 25.47 ? 614 SO4 A O1 1 +HETATM 1505 O O2 . SO4 C 2 . ? 26.699 9.797 8.291 1.00 26.60 ? 614 SO4 A O2 1 +HETATM 1506 O O3 . SO4 C 2 . ? 26.733 7.371 8.721 1.00 25.40 ? 614 SO4 A O3 1 +HETATM 1507 O O4 . SO4 C 2 . ? 25.031 8.133 8.972 1.00 27.63 ? 614 SO4 A O4 1 +HETATM 1508 N N1 . FOL D 3 . ? 26.779 12.325 -3.996 1.00 7.86 ? 187 FOL A N1 1 +HETATM 1509 C C2 . FOL D 3 . ? 27.684 12.453 -5.033 1.00 9.32 ? 187 FOL A C2 1 +HETATM 1510 N NA2 . FOL D 3 . ? 27.113 12.270 -6.218 1.00 9.25 ? 187 FOL A NA2 1 +HETATM 1511 N N3 . FOL D 3 . ? 28.981 12.700 -4.932 1.00 10.06 ? 187 FOL A N3 1 +HETATM 1512 C C4 . FOL D 3 . ? 29.701 12.829 -3.791 1.00 11.87 ? 187 FOL A C4 1 +HETATM 1513 O O4 . FOL D 3 . ? 30.915 13.054 -3.704 1.00 11.60 ? 187 FOL A O4 1 +HETATM 1514 C C4A . FOL D 3 . ? 28.738 12.673 -2.635 1.00 12.09 ? 187 FOL A C4A 1 +HETATM 1515 N N5 . FOL D 3 . ? 29.268 12.624 -1.369 1.00 14.10 ? 187 FOL A N5 1 +HETATM 1516 C C6 . FOL D 3 . ? 28.498 12.462 -0.342 1.00 12.47 ? 187 FOL A C6 1 +HETATM 1517 C C7 . FOL D 3 . ? 27.043 12.341 -0.541 1.00 11.36 ? 187 FOL A C7 1 +HETATM 1518 N N8 . FOL D 3 . ? 26.552 12.262 -1.768 1.00 12.99 ? 187 FOL A N8 1 +HETATM 1519 C C8A . FOL D 3 . ? 27.492 12.514 -2.819 1.00 10.71 ? 187 FOL A C8A 1 +HETATM 1520 C C9 . FOL D 3 . ? 28.990 12.525 1.107 1.00 15.04 ? 187 FOL A C9 1 +HETATM 1521 N N10 . FOL D 3 . ? 30.332 13.235 1.390 1.00 11.78 ? 187 FOL A N10 1 +HETATM 1522 C C11 . FOL D 3 . ? 31.536 17.277 0.303 1.00 12.26 ? 187 FOL A C11 1 +HETATM 1523 C C12 . FOL D 3 . ? 32.365 16.427 1.049 1.00 11.60 ? 187 FOL A C12 1 +HETATM 1524 C C13 . FOL D 3 . ? 32.021 15.106 1.409 1.00 10.35 ? 187 FOL A C13 1 +HETATM 1525 C C14 . FOL D 3 . ? 30.788 14.664 1.044 1.00 11.15 ? 187 FOL A C14 1 +HETATM 1526 C C15 . FOL D 3 . ? 29.937 15.537 0.221 1.00 10.45 ? 187 FOL A C15 1 +HETATM 1527 C C16 . FOL D 3 . ? 30.314 16.836 -0.066 1.00 9.61 ? 187 FOL A C16 1 +HETATM 1528 C C . FOL D 3 . ? 31.961 18.718 -0.080 1.00 15.28 ? 187 FOL A C 1 +HETATM 1529 O O . FOL D 3 . ? 33.081 19.085 0.527 1.00 15.05 ? 187 FOL A O 1 +HETATM 1530 N N . FOL D 3 . ? 31.163 19.384 -1.010 1.00 19.89 ? 187 FOL A N 1 +HETATM 1531 C CA . FOL D 3 . ? 31.412 20.766 -1.738 1.00 23.43 ? 187 FOL A CA 1 +HETATM 1532 C CB . FOL D 3 . ? 31.717 20.384 -3.092 1.00 24.75 ? 187 FOL A CB 1 +HETATM 1533 C CG . FOL D 3 . ? 32.317 21.447 -4.109 1.00 27.79 ? 187 FOL A CG 1 +HETATM 1534 C CD . FOL D 3 . ? 33.494 21.372 -5.301 1.00 30.29 ? 187 FOL A CD 1 +HETATM 1535 O OE1 . FOL D 3 . ? 33.626 21.768 -6.584 1.00 32.77 ? 187 FOL A OE1 1 +HETATM 1536 O OE2 . FOL D 3 . ? 34.503 20.703 -4.661 1.00 30.84 ? 187 FOL A OE2 1 +HETATM 1537 C CT . FOL D 3 . ? 30.072 21.244 -1.632 1.00 24.37 ? 187 FOL A CT 1 +HETATM 1538 O O1 . FOL D 3 . ? 30.031 22.375 -1.272 1.00 26.76 ? 187 FOL A O1 1 +HETATM 1539 O O2 . FOL D 3 . ? 28.885 20.707 -1.816 1.00 25.37 ? 187 FOL A O2 1 +HETATM 1540 O O . HOH E 4 . ? 28.932 6.959 5.859 1.00 24.46 ? 615 HOH A O 1 +HETATM 1541 O O . HOH E 4 . ? 20.129 14.429 19.666 1.00 36.54 ? 616 HOH A O 1 +HETATM 1542 O O . HOH E 4 . ? 26.026 6.212 18.550 1.00 69.24 ? 617 HOH A O 1 +HETATM 1543 O O . HOH E 4 . ? 32.906 5.888 8.599 1.00 19.26 ? 618 HOH A O 1 +HETATM 1544 O O . HOH E 4 . ? 31.977 10.783 2.441 1.00 41.21 ? 619 HOH A O 1 +HETATM 1545 O O . HOH E 4 . ? 32.480 8.612 4.808 1.00 30.67 ? 620 HOH A O 1 +HETATM 1546 O O . HOH E 4 . ? 35.535 -3.325 -0.620 1.00 20.63 ? 621 HOH A O 1 +HETATM 1547 O O . HOH E 4 . ? 2.916 10.146 -2.157 1.00 57.31 ? 622 HOH A O 1 +HETATM 1548 O O . HOH E 4 . ? 20.067 25.938 -1.335 1.00 8.56 ? 623 HOH A O 1 +HETATM 1549 O O . HOH E 4 . ? 13.035 -0.283 8.021 1.00 29.00 ? 624 HOH A O 1 +HETATM 1550 O O . HOH E 4 . ? 23.520 0.781 17.630 1.00 26.35 ? 625 HOH A O 1 +HETATM 1551 O O . HOH E 4 . ? 23.148 3.927 12.935 1.00 45.42 ? 626 HOH A O 1 +HETATM 1552 O O . HOH E 4 . ? 14.975 1.816 7.933 1.00 29.43 ? 627 HOH A O 1 +HETATM 1553 O O . HOH E 4 . ? 12.322 12.215 -17.243 1.00 15.13 ? 628 HOH A O 1 +HETATM 1554 O O . HOH E 4 . ? 10.656 12.295 -15.118 1.00 11.85 ? 629 HOH A O 1 +HETATM 1555 O O . HOH E 4 . ? 14.955 28.597 9.736 1.00 24.40 ? 630 HOH A O 1 +HETATM 1556 O O . HOH E 4 . ? 12.865 33.005 13.704 1.00 38.77 ? 631 HOH A O 1 +HETATM 1557 O O . HOH E 4 . ? 35.247 12.681 -4.765 1.00 19.88 ? 632 HOH A O 1 +HETATM 1558 O O . HOH E 4 . ? 16.794 -4.160 4.783 1.00 36.44 ? 633 HOH A O 1 +HETATM 1559 O O . HOH E 4 . ? 20.639 -3.571 1.481 1.00 27.94 ? 634 HOH A O 1 +HETATM 1560 O O . HOH E 4 . ? 23.930 -2.205 2.978 1.00 47.28 ? 635 HOH A O 1 +HETATM 1561 O O . HOH E 4 . ? 25.099 -2.677 -0.693 1.00 25.90 ? 636 HOH A O 1 +HETATM 1562 O O . HOH E 4 . ? 27.895 -0.159 5.540 1.00 22.84 ? 637 HOH A O 1 +HETATM 1563 O O . HOH E 4 . ? 21.249 10.425 -16.617 1.00 16.83 ? 638 HOH A O 1 +HETATM 1564 O O . HOH E 4 . ? 18.546 8.628 -15.379 1.00 10.55 ? 639 HOH A O 1 +HETATM 1565 O O . HOH E 4 . ? 25.312 10.117 -17.351 1.00 13.75 ? 640 HOH A O 1 +HETATM 1566 O O . HOH E 4 . ? 19.858 14.379 -24.913 1.00 53.50 ? 641 HOH A O 1 +HETATM 1567 O O . HOH E 4 . ? 13.675 14.781 -29.913 1.00 21.96 ? 642 HOH A O 1 +HETATM 1568 O O . HOH E 4 . ? 16.600 19.693 -10.998 1.00 20.82 ? 643 HOH A O 1 +HETATM 1569 O O . HOH E 4 . ? 30.846 14.815 -25.612 1.00 49.98 ? 644 HOH A O 1 +HETATM 1570 O O . HOH E 4 . ? 27.247 0.513 -8.722 1.00 12.03 ? 645 HOH A O 1 +HETATM 1571 O O . HOH E 4 . ? 29.116 1.440 -11.238 1.00 19.37 ? 646 HOH A O 1 +HETATM 1572 O O . HOH E 4 . ? 32.484 11.890 -5.926 1.00 13.16 ? 647 HOH A O 1 +HETATM 1573 O O . HOH E 4 . ? 34.877 12.965 2.403 1.00 15.13 ? 648 HOH A O 1 +HETATM 1574 O O . HOH E 4 . ? 18.720 21.079 -7.847 1.00 22.70 ? 649 HOH A O 1 +HETATM 1575 O O . HOH E 4 . ? 12.168 10.317 16.887 1.00 32.51 ? 650 HOH A O 1 +HETATM 1576 O O . HOH E 4 . ? 13.439 31.310 11.439 1.00 39.50 ? 651 HOH A O 1 +HETATM 1577 O O . HOH E 4 . ? 8.313 31.746 8.721 1.00 46.88 ? 652 HOH A O 1 +HETATM 1578 O O . HOH E 4 . ? 4.021 26.633 9.069 1.00 65.09 ? 653 HOH A O 1 +HETATM 1579 O O . HOH E 4 . ? 13.060 16.887 -7.040 1.00 17.77 ? 654 HOH A O 1 +HETATM 1580 O O . HOH E 4 . ? 9.203 0.875 5.195 1.00 25.14 ? 655 HOH A O 1 +HETATM 1581 O O . HOH E 4 . ? 24.403 11.492 -8.302 1.00 9.87 ? 656 HOH A O 1 +HETATM 1582 O O . HOH E 4 . ? 35.652 2.558 -15.712 1.00 30.80 ? 657 HOH A O 1 +HETATM 1583 O O . HOH E 4 . ? 13.692 0.171 -12.519 1.00 32.14 ? 658 HOH A O 1 +HETATM 1584 O O . HOH E 4 . ? 11.273 -0.437 -14.398 1.00 30.97 ? 659 HOH A O 1 +HETATM 1585 O O . HOH E 4 . ? 12.075 -6.416 -5.152 1.00 42.52 ? 660 HOH A O 1 +HETATM 1586 O O . HOH E 4 . ? 15.483 0.417 -2.408 1.00 19.11 ? 661 HOH A O 1 +HETATM 1587 O O . HOH E 4 . ? 13.135 -0.242 -0.051 1.00 40.60 ? 662 HOH A O 1 +HETATM 1588 O O . HOH E 4 . ? 30.777 15.300 -15.006 1.00 26.92 ? 663 HOH A O 1 +HETATM 1589 O O . HOH E 4 . ? 33.513 9.918 -21.398 1.00 35.03 ? 664 HOH A O 1 +HETATM 1590 O O . HOH E 4 . ? 33.416 11.781 -25.722 1.00 23.71 ? 665 HOH A O 1 +HETATM 1591 O O . HOH E 4 . ? 29.476 11.634 19.338 1.00 23.66 ? 666 HOH A O 1 +HETATM 1592 O O . HOH E 4 . ? 29.570 2.981 9.590 1.00 36.50 ? 667 HOH A O 1 +HETATM 1593 O O . HOH E 4 . ? 20.998 2.006 12.063 1.00 40.75 ? 668 HOH A O 1 +HETATM 1594 O O . HOH E 4 . ? 21.787 8.157 15.112 1.00 32.74 ? 669 HOH A O 1 +HETATM 1595 O O . HOH E 4 . ? 29.385 6.286 14.942 1.00 44.88 ? 670 HOH A O 1 +HETATM 1596 O O . HOH E 4 . ? 36.577 -2.739 -11.486 1.00 36.32 ? 671 HOH A O 1 +HETATM 1597 O O . HOH E 4 . ? 37.317 -3.263 -3.126 1.00 39.53 ? 672 HOH A O 1 +HETATM 1598 O O . HOH E 4 . ? 32.700 -4.707 -0.919 1.00 36.14 ? 673 HOH A O 1 +HETATM 1599 O O . HOH E 4 . ? 44.746 14.525 -6.298 1.00 33.77 ? 674 HOH A O 1 +HETATM 1600 O O . HOH E 4 . ? 38.788 12.413 6.862 1.00 25.26 ? 675 HOH A O 1 +HETATM 1601 O O . HOH E 4 . ? 39.243 17.689 7.407 1.00 35.35 ? 676 HOH A O 1 +HETATM 1602 O O . HOH E 4 . ? 42.198 16.992 15.417 1.00 27.15 ? 677 HOH A O 1 +HETATM 1603 O O . HOH E 4 . ? 39.317 21.173 5.334 1.00 36.89 ? 678 HOH A O 1 +HETATM 1604 O O . HOH E 4 . ? 31.692 24.259 -0.178 1.00 24.47 ? 679 HOH A O 1 +HETATM 1605 O O . HOH E 4 . ? 34.425 26.990 1.289 1.00 31.27 ? 680 HOH A O 1 +HETATM 1606 O O . HOH E 4 . ? 32.820 22.830 11.436 1.00 14.23 ? 681 HOH A O 1 +HETATM 1607 O O . HOH E 4 . ? 42.775 19.217 1.686 1.00 24.74 ? 682 HOH A O 1 +HETATM 1608 O O . HOH E 4 . ? 43.221 22.248 7.517 1.00 51.85 ? 683 HOH A O 1 +HETATM 1609 O O . HOH E 4 . ? 39.394 22.721 -16.975 1.00 29.51 ? 684 HOH A O 1 +HETATM 1610 O O . HOH E 4 . ? 39.905 32.283 -21.332 1.00 41.81 ? 685 HOH A O 1 +HETATM 1611 O O . HOH E 4 . ? 35.549 34.817 -20.494 1.00 34.42 ? 686 HOH A O 1 +HETATM 1612 O O . HOH E 4 . ? 29.137 33.412 -23.185 1.00 30.66 ? 687 HOH A O 1 +HETATM 1613 O O . HOH E 4 . ? 38.358 23.778 -14.118 1.00 25.57 ? 688 HOH A O 1 +HETATM 1614 O O . HOH E 4 . ? 35.432 23.082 -1.751 1.00 42.31 ? 689 HOH A O 1 +HETATM 1615 O O . HOH E 4 . ? 44.323 17.901 -23.198 1.00 44.29 ? 690 HOH A O 1 +HETATM 1616 O O . HOH E 4 . ? 36.029 21.972 -15.927 1.00 29.34 ? 691 HOH A O 1 +HETATM 1617 O O . HOH E 4 . ? 13.215 12.874 -22.118 1.00 24.86 ? 692 HOH A O 1 +HETATM 1618 O O . HOH E 4 . ? 11.394 9.114 -22.991 1.00 39.02 ? 693 HOH A O 1 +HETATM 1619 O O . HOH E 4 . ? 14.681 16.302 -27.972 1.00 15.89 ? 694 HOH A O 1 +HETATM 1620 O O . HOH E 4 . ? 16.497 13.838 -25.562 1.00 47.77 ? 695 HOH A O 1 +HETATM 1621 O O . HOH E 4 . ? 36.494 19.909 -5.795 1.00 24.30 ? 696 HOH A O 1 +HETATM 1622 O O . HOH E 4 . ? 12.918 12.956 -32.299 1.00 35.30 ? 697 HOH A O 1 +HETATM 1623 O O . HOH E 4 . ? 40.940 -0.790 -4.319 1.00 43.11 ? 698 HOH A O 1 +HETATM 1624 O O . HOH E 4 . ? 11.936 24.731 -8.562 1.00 40.80 ? 699 HOH A O 1 +HETATM 1625 O O . HOH E 4 . ? 10.457 22.842 -9.467 1.00 29.50 ? 700 HOH A O 1 +HETATM 1626 O O . HOH E 4 . ? 26.833 24.142 26.184 1.00 21.96 ? 701 HOH A O 1 +HETATM 1627 O O . HOH E 4 . ? 36.031 22.682 -8.144 1.00 39.96 ? 702 HOH A O 1 +HETATM 1628 O O . HOH E 4 . ? 2.549 -0.439 -0.205 1.00 31.71 ? 703 HOH A O 1 +HETATM 1629 O O . HOH E 4 . ? 2.875 7.013 4.626 1.00 34.82 ? 704 HOH A O 1 +HETATM 1630 O O . HOH E 4 . ? 13.427 19.280 -10.684 1.00 22.70 ? 705 HOH A O 1 +HETATM 1631 O O . HOH E 4 . ? 26.704 18.055 20.564 1.00 35.01 ? 706 HOH A O 1 +HETATM 1632 O O . HOH E 4 . ? 12.439 33.934 -6.672 1.00 24.92 ? 707 HOH A O 1 +HETATM 1633 O O . HOH E 4 . ? 34.241 27.700 -1.247 1.00 57.85 ? 708 HOH A O 1 +HETATM 1634 O O . HOH E 4 . ? 31.588 29.090 7.234 1.00 65.52 ? 709 HOH A O 1 +HETATM 1635 O O . HOH E 4 . ? 32.776 28.228 9.430 1.00 46.07 ? 710 HOH A O 1 +HETATM 1636 O O . HOH E 4 . ? 34.727 27.239 7.516 1.00 40.17 ? 711 HOH A O 1 +HETATM 1637 O O . HOH E 4 . ? 2.239 19.468 14.836 1.00 30.19 ? 712 HOH A O 1 +HETATM 1638 O O . HOH E 4 . ? -0.529 14.177 13.571 1.00 27.29 ? 713 HOH A O 1 +HETATM 1639 O O . HOH E 4 . ? 5.016 20.023 5.059 1.00 28.50 ? 714 HOH A O 1 +HETATM 1640 O O . HOH E 4 . ? 37.009 20.040 -1.203 1.00 33.05 ? 715 HOH A O 1 +HETATM 1641 O O . HOH E 4 . ? 40.436 15.018 -1.254 1.00 59.59 ? 716 HOH A O 1 +HETATM 1642 O O . HOH E 4 . ? 39.344 22.533 -10.268 1.00 37.55 ? 717 HOH A O 1 +HETATM 1643 O O . HOH E 4 . ? 37.019 28.542 -11.321 1.00 45.42 ? 718 HOH A O 1 +HETATM 1644 O O . HOH E 4 . ? 31.783 28.124 -10.417 1.00 46.40 ? 719 HOH A O 1 +HETATM 1645 O O . HOH E 4 . ? 37.614 21.264 -11.665 1.00 47.51 ? 720 HOH A O 1 +HETATM 1646 O O . HOH E 4 . ? 35.553 24.303 -6.394 1.00 73.89 ? 721 HOH A O 1 +HETATM 1647 O O . HOH E 4 . ? 23.884 26.752 -7.577 1.00 34.87 ? 722 HOH A O 1 +HETATM 1648 O O . HOH E 4 . ? 22.521 26.097 -12.347 1.00 25.72 ? 723 HOH A O 1 +HETATM 1649 O O . HOH E 4 . ? 39.048 18.426 -4.161 1.00 39.06 ? 724 HOH A O 1 +HETATM 1650 O O . HOH E 4 . ? 30.821 26.085 -9.040 1.00 45.16 ? 725 HOH A O 1 +HETATM 1651 O O . HOH E 4 . ? 33.097 24.520 -7.653 1.00 34.43 ? 726 HOH A O 1 +HETATM 1652 O O . HOH E 4 . ? 22.725 11.640 -10.438 1.00 10.41 ? 727 HOH A O 1 +HETATM 1653 O O . HOH E 4 . ? 29.376 9.017 -1.984 1.00 19.42 ? 728 HOH A O 1 +HETATM 1654 O O . HOH E 4 . ? 27.049 9.171 0.875 1.00 17.44 ? 729 HOH A O 1 +HETATM 1655 O O . HOH E 4 . ? 34.092 5.074 6.375 1.00 23.86 ? 730 HOH A O 1 +HETATM 1656 O O . HOH E 4 . ? 27.231 5.272 5.958 1.00 43.04 ? 731 HOH A O 1 +HETATM 1657 O O . HOH E 4 . ? 28.045 9.114 3.890 1.00 25.56 ? 732 HOH A O 1 +HETATM 1658 O O . HOH E 4 . ? 28.364 6.038 11.682 1.00 28.63 ? 733 HOH A O 1 +HETATM 1659 O O . HOH E 4 . ? 23.242 7.983 11.250 1.00 32.21 ? 734 HOH A O 1 +HETATM 1660 O O . HOH E 4 . ? 20.166 8.736 -4.774 1.00 45.58 ? 735 HOH A O 1 +HETATM 1661 O O . HOH E 4 . ? 21.624 -0.856 -7.244 1.00 24.28 ? 736 HOH A O 1 +HETATM 1662 O O . HOH E 4 . ? 26.835 18.239 -15.145 1.00 41.04 ? 737 HOH A O 1 +HETATM 1663 O O . HOH E 4 . ? 27.981 20.806 -16.544 1.00 31.52 ? 738 HOH A O 1 +HETATM 1664 O O . HOH E 4 . ? 28.856 18.385 -17.198 1.00 58.81 ? 739 HOH A O 1 +HETATM 1665 O O . HOH E 4 . ? 28.523 16.429 -14.214 1.00 47.07 ? 740 HOH A O 1 +HETATM 1666 O O . HOH E 4 . ? 10.196 20.605 14.901 1.00 30.33 ? 741 HOH A O 1 +HETATM 1667 O O . HOH E 4 . ? 9.846 22.818 13.611 1.00 35.92 ? 742 HOH A O 1 +HETATM 1668 O O . HOH E 4 . ? 15.451 20.551 15.345 1.00 38.09 ? 743 HOH A O 1 +HETATM 1669 O O . HOH E 4 . ? 14.576 15.395 16.890 1.00 18.09 ? 744 HOH A O 1 +HETATM 1670 O O . HOH E 4 . ? 11.792 16.695 17.536 1.00 86.04 ? 745 HOH A O 1 +HETATM 1671 O O . HOH E 4 . ? 18.733 9.761 11.324 1.00 55.14 ? 746 HOH A O 1 +HETATM 1672 O O . HOH E 4 . ? 1.650 24.734 -2.443 1.00 108.61 ? 747 HOH A O 1 +HETATM 1673 O O . HOH E 4 . ? 6.104 17.734 2.808 1.00 38.52 ? 748 HOH A O 1 +HETATM 1674 O O . HOH E 4 . ? 27.941 -3.393 -12.882 1.00 36.98 ? 749 HOH A O 1 +HETATM 1675 O O . HOH E 4 . ? 31.497 -2.444 -10.978 1.00 35.58 ? 750 HOH A O 1 +HETATM 1676 O O . HOH E 4 . ? 23.718 -5.680 -12.872 1.00 31.50 ? 751 HOH A O 1 +HETATM 1677 O O . HOH E 4 . ? 26.696 -4.153 -7.951 1.00 51.62 ? 752 HOH A O 1 +HETATM 1678 O O . HOH E 4 . ? 30.064 -4.423 -14.569 1.00 45.65 ? 753 HOH A O 1 +HETATM 1679 O O . HOH E 4 . ? 33.161 -5.202 -13.605 1.00 38.02 ? 754 HOH A O 1 +HETATM 1680 O O . HOH E 4 . ? 29.303 -6.163 -4.136 1.00 43.70 ? 755 HOH A O 1 +HETATM 1681 O O . HOH E 4 . ? 40.508 6.333 3.170 1.00 32.85 ? 756 HOH A O 1 +HETATM 1682 O O . HOH E 4 . ? 42.721 4.646 -1.622 1.00 48.84 ? 757 HOH A O 1 +HETATM 1683 O O . HOH E 4 . ? 36.589 10.453 8.206 1.00 82.33 ? 758 HOH A O 1 +HETATM 1684 O O . HOH E 4 . ? 39.799 10.195 -0.921 1.00 44.67 ? 759 HOH A O 1 +HETATM 1685 O O . HOH E 4 . ? 39.688 2.744 -2.079 1.00 44.40 ? 760 HOH A O 1 +HETATM 1686 O O . HOH E 4 . ? 26.710 26.108 -2.762 1.00 28.78 ? 761 HOH A O 1 +HETATM 1687 O O . HOH E 4 . ? 19.625 29.123 -8.351 1.00 44.32 ? 762 HOH A O 1 +HETATM 1688 O O . HOH E 4 . ? 16.401 30.116 3.584 1.00 80.66 ? 763 HOH A O 1 +HETATM 1689 O O . HOH E 4 . ? 18.097 29.237 5.149 1.00 69.32 ? 764 HOH A O 1 +HETATM 1690 O O . HOH E 4 . ? 31.768 7.217 15.561 1.00 23.48 ? 765 HOH A O 1 +HETATM 1691 O O . HOH E 4 . ? 34.344 10.160 11.675 1.00 29.26 ? 766 HOH A O 1 +HETATM 1692 O O . HOH E 4 . ? 31.692 19.974 13.606 1.00 12.10 ? 767 HOH A O 1 +HETATM 1693 O O . HOH E 4 . ? 34.508 11.564 8.608 1.00 42.72 ? 768 HOH A O 1 +HETATM 1694 O O . HOH E 4 . ? 37.283 12.242 10.986 1.00 32.14 ? 769 HOH A O 1 +HETATM 1695 O O . HOH E 4 . ? 36.802 12.844 5.113 1.00 46.07 ? 770 HOH A O 1 +HETATM 1696 O O . HOH E 4 . ? 43.617 17.094 5.439 1.00 45.97 ? 771 HOH A O 1 +HETATM 1697 O O . HOH E 4 . ? 39.649 19.371 0.898 1.00 30.82 ? 772 HOH A O 1 +HETATM 1698 O O . HOH E 4 . ? 42.204 20.255 11.979 1.00 36.33 ? 773 HOH A O 1 +HETATM 1699 O O . HOH E 4 . ? 37.731 24.496 10.875 1.00 48.07 ? 774 HOH A O 1 +HETATM 1700 O O . HOH E 4 . ? 44.788 18.353 12.301 1.00 52.63 ? 775 HOH A O 1 +HETATM 1701 O O . HOH E 4 . ? 36.933 24.177 14.368 1.00 28.51 ? 776 HOH A O 1 +HETATM 1702 O O . HOH E 4 . ? 25.473 27.247 4.956 1.00 17.93 ? 777 HOH A O 1 +HETATM 1703 O O . HOH E 4 . ? 27.471 28.929 5.317 1.00 15.23 ? 778 HOH A O 1 +HETATM 1704 O O . HOH E 4 . ? 23.697 8.771 23.750 1.00 29.55 ? 779 HOH A O 1 +HETATM 1705 O O . HOH E 4 . ? 17.505 9.134 21.915 1.00 51.83 ? 780 HOH A O 1 +HETATM 1706 O O . HOH E 4 . ? 18.734 13.074 24.887 1.00 28.34 ? 781 HOH A O 1 +HETATM 1707 O O . HOH E 4 . ? 24.245 6.251 24.337 1.00 40.19 ? 782 HOH A O 1 +HETATM 1708 O O . HOH E 4 . ? 24.134 3.367 26.875 1.00 24.63 ? 783 HOH A O 1 +HETATM 1709 O O . HOH E 4 . ? 20.506 4.098 26.916 1.00 49.60 ? 784 HOH A O 1 +HETATM 1710 O O . HOH E 4 . ? 19.187 6.014 28.110 1.00 41.43 ? 785 HOH A O 1 +HETATM 1711 O O . HOH E 4 . ? 23.618 1.766 28.784 1.00 56.81 ? 786 HOH A O 1 +HETATM 1712 O O . HOH E 4 . ? 17.441 2.272 25.414 1.00 46.60 ? 787 HOH A O 1 +HETATM 1713 O O . HOH E 4 . ? 19.245 2.862 23.377 1.00 58.05 ? 788 HOH A O 1 +HETATM 1714 O O . HOH E 4 . ? 20.977 0.976 21.572 1.00 42.18 ? 789 HOH A O 1 +HETATM 1715 O O . HOH E 4 . ? 21.816 4.908 23.675 1.00 33.99 ? 790 HOH A O 1 +HETATM 1716 O O . HOH E 4 . ? 29.486 14.370 21.773 1.00 40.84 ? 791 HOH A O 1 +HETATM 1717 O O . HOH E 4 . ? 27.211 16.090 25.229 1.00 50.77 ? 792 HOH A O 1 +HETATM 1718 O O . HOH E 4 . ? 27.185 20.322 23.915 1.00 31.43 ? 793 HOH A O 1 +HETATM 1719 O O . HOH E 4 . ? 25.044 21.159 25.903 1.00 20.47 ? 794 HOH A O 1 +HETATM 1720 O O . HOH E 4 . ? 26.754 13.553 23.258 1.00 32.40 ? 795 HOH A O 1 +HETATM 1721 O O . HOH E 4 . ? 30.738 15.725 27.979 1.00 55.32 ? 796 HOH A O 1 +HETATM 1722 O O . HOH E 4 . ? 28.830 19.232 19.662 1.00 35.40 ? 797 HOH A O 1 +HETATM 1723 O O . HOH E 4 . ? 12.004 12.905 19.129 1.00 45.38 ? 798 HOH A O 1 +HETATM 1724 O O . HOH E 4 . ? 12.723 8.068 11.454 1.00 62.01 ? 799 HOH A O 1 +HETATM 1725 O O . HOH E 4 . ? 13.820 10.576 18.977 1.00 56.22 ? 800 HOH A O 1 +HETATM 1726 O O . HOH E 4 . ? 8.518 9.701 21.547 1.00 50.52 ? 801 HOH A O 1 +HETATM 1727 O O . HOH E 4 . ? 7.538 10.860 18.749 1.00 36.11 ? 802 HOH A O 1 +HETATM 1728 O O . HOH E 4 . ? 7.198 7.983 20.173 1.00 39.42 ? 803 HOH A O 1 +HETATM 1729 O O . HOH E 4 . ? 8.658 5.589 20.741 1.00 79.65 ? 804 HOH A O 1 +HETATM 1730 O O . HOH E 4 . ? 9.093 9.237 17.360 1.00 38.38 ? 805 HOH A O 1 +HETATM 1731 O O . HOH E 4 . ? 15.098 3.983 14.065 1.00 49.95 ? 806 HOH A O 1 +HETATM 1732 O O . HOH E 4 . ? 12.532 5.268 13.904 1.00 50.45 ? 807 HOH A O 1 +HETATM 1733 O O . HOH E 4 . ? 7.349 6.438 11.759 1.00 37.12 ? 808 HOH A O 1 +HETATM 1734 O O . HOH E 4 . ? 11.972 7.959 7.979 1.00 28.95 ? 809 HOH A O 1 +HETATM 1735 O O . HOH E 4 . ? 8.208 11.737 8.656 1.00 23.60 ? 810 HOH A O 1 +HETATM 1736 O O . HOH E 4 . ? 6.802 13.805 5.423 1.00 47.49 ? 811 HOH A O 1 +HETATM 1737 O O . HOH E 4 . ? 0.592 12.600 11.122 1.00 48.94 ? 812 HOH A O 1 +HETATM 1738 O O . HOH E 4 . ? 3.699 21.595 11.493 1.00 42.91 ? 813 HOH A O 1 +HETATM 1739 O O . HOH E 4 . ? 6.004 25.488 16.284 1.00 37.36 ? 814 HOH A O 1 +HETATM 1740 O O . HOH E 4 . ? 6.027 30.378 9.058 1.00 76.18 ? 815 HOH A O 1 +HETATM 1741 O O . HOH E 4 . ? 2.701 30.882 8.202 1.00 33.18 ? 816 HOH A O 1 +HETATM 1742 O O . HOH E 4 . ? 10.336 33.107 9.476 1.00 70.50 ? 817 HOH A O 1 +HETATM 1743 O O . HOH E 4 . ? 10.729 31.935 7.296 1.00 23.70 ? 818 HOH A O 1 +HETATM 1744 O O . HOH E 4 . ? 10.864 19.764 -6.659 1.00 43.76 ? 819 HOH A O 1 +HETATM 1745 O O . HOH E 4 . ? 24.492 0.187 4.091 1.00 64.31 ? 820 HOH A O 1 +HETATM 1746 O O . HOH E 4 . ? 26.340 -2.365 4.745 1.00 38.60 ? 821 HOH A O 1 +HETATM 1747 O O . HOH E 4 . ? 30.341 -3.675 6.989 1.00 60.42 ? 822 HOH A O 1 +HETATM 1748 O O . HOH E 4 . ? 18.459 2.136 8.763 1.00 29.65 ? 823 HOH A O 1 +HETATM 1749 O O . HOH E 4 . ? 19.274 -0.503 10.123 1.00 66.00 ? 824 HOH A O 1 +HETATM 1750 O O . HOH E 4 . ? 26.799 3.641 10.845 1.00 34.43 ? 825 HOH A O 1 +HETATM 1751 O O . HOH E 4 . ? 18.112 -3.140 2.021 1.00 31.20 ? 826 HOH A O 1 +HETATM 1752 O O . HOH E 4 . ? 12.970 3.381 7.979 1.00 50.26 ? 827 HOH A O 1 +HETATM 1753 O O . HOH E 4 . ? 10.620 1.183 8.695 1.00 73.81 ? 828 HOH A O 1 +HETATM 1754 O O . HOH E 4 . ? 10.294 -2.408 3.649 1.00 47.15 ? 829 HOH A O 1 +HETATM 1755 O O . HOH E 4 . ? 6.225 11.618 9.864 1.00 34.67 ? 830 HOH A O 1 +HETATM 1756 O O . HOH E 4 . ? 9.748 -2.025 10.823 1.00 54.18 ? 831 HOH A O 1 +HETATM 1757 O O . HOH E 4 . ? 5.462 1.494 3.651 1.00 42.45 ? 832 HOH A O 1 +HETATM 1758 O O . HOH E 4 . ? 9.922 -3.604 6.614 1.00 44.50 ? 833 HOH A O 1 +HETATM 1759 O O . HOH E 4 . ? 7.549 -0.912 5.867 1.00 47.45 ? 834 HOH A O 1 +HETATM 1760 O O . HOH E 4 . ? 3.631 2.096 6.267 1.00 46.70 ? 835 HOH A O 1 +HETATM 1761 O O . HOH E 4 . ? 10.192 -1.547 0.025 1.00 74.84 ? 836 HOH A O 1 +HETATM 1762 O O . HOH E 4 . ? 8.574 14.382 -10.116 1.00 21.63 ? 837 HOH A O 1 +HETATM 1763 O O . HOH E 4 . ? 11.016 14.612 -11.563 1.00 48.59 ? 838 HOH A O 1 +HETATM 1764 O O . HOH E 4 . ? 10.269 13.073 -8.634 1.00 76.81 ? 839 HOH A O 1 +HETATM 1765 O O . HOH E 4 . ? 34.649 1.213 -18.894 1.00 57.85 ? 840 HOH A O 1 +HETATM 1766 O O . HOH E 4 . ? 36.540 0.184 -17.605 1.00 29.94 ? 841 HOH A O 1 +HETATM 1767 O O . HOH E 4 . ? 32.520 2.794 -20.259 1.00 37.42 ? 842 HOH A O 1 +HETATM 1768 O O . HOH E 4 . ? 39.570 2.151 -17.339 1.00 51.24 ? 843 HOH A O 1 +HETATM 1769 O O . HOH E 4 . ? 34.893 -5.975 -10.229 1.00 28.48 ? 844 HOH A O 1 +HETATM 1770 O O . HOH E 4 . ? 42.245 -3.744 -2.903 1.00 39.00 ? 845 HOH A O 1 +HETATM 1771 O O . HOH E 4 . ? 45.623 -5.335 5.234 1.00 60.75 ? 846 HOH A O 1 +HETATM 1772 O O . HOH E 4 . ? 45.970 -3.937 2.813 1.00 35.90 ? 847 HOH A O 1 +HETATM 1773 O O . HOH E 4 . ? 45.242 -1.397 3.632 1.00 27.18 ? 848 HOH A O 1 +HETATM 1774 O O . HOH E 4 . ? 45.374 -3.957 -0.162 1.00 33.39 ? 849 HOH A O 1 +HETATM 1775 O O . HOH E 4 . ? 43.726 1.151 2.690 1.00 31.29 ? 850 HOH A O 1 +HETATM 1776 O O . HOH E 4 . ? 38.229 0.348 7.716 1.00 38.47 ? 851 HOH A O 1 +HETATM 1777 O O . HOH E 4 . ? 43.405 -1.646 -2.946 1.00 22.58 ? 852 HOH A O 1 +HETATM 1778 O O . HOH E 4 . ? 35.467 -4.090 2.576 1.00 24.41 ? 853 HOH A O 1 +HETATM 1779 O O . HOH E 4 . ? 28.902 -2.434 5.376 1.00 57.62 ? 854 HOH A O 1 +HETATM 1780 O O . HOH E 4 . ? 26.762 -4.127 2.338 1.00 46.28 ? 855 HOH A O 1 +HETATM 1781 O O . HOH E 4 . ? 23.256 -2.176 -2.508 1.00 89.69 ? 856 HOH A O 1 +HETATM 1782 O O . HOH E 4 . ? 9.818 -5.174 -1.940 1.00 35.84 ? 857 HOH A O 1 +HETATM 1783 O O . HOH E 4 . ? 15.650 -5.090 -7.127 1.00 26.63 ? 858 HOH A O 1 +HETATM 1784 O O . HOH E 4 . ? 9.603 -10.231 -6.297 1.00 58.66 ? 859 HOH A O 1 +HETATM 1785 O O . HOH E 4 . ? 10.199 1.357 -1.202 1.00 33.37 ? 860 HOH A O 1 +HETATM 1786 O O . HOH E 4 . ? 15.749 -3.749 -2.071 1.00 31.23 ? 861 HOH A O 1 +HETATM 1787 O O . HOH E 4 . ? 13.554 -6.621 -1.081 1.00 41.91 ? 862 HOH A O 1 +HETATM 1788 O O . HOH E 4 . ? 7.791 5.590 -10.618 1.00 30.00 ? 863 HOH A O 1 +# diff --git a/tests/resources/1n8z.cif b/tests/resources/1n8z.cif new file mode 100644 index 0000000..784e732 --- /dev/null +++ b/tests/resources/1n8z.cif @@ -0,0 +1,12398 @@ +data_1N8Z +# +_entry.id 1N8Z +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.398 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 1N8Z pdb_00001n8z 10.2210/pdb1n8z/pdb +RCSB RCSB017668 ? ? +WWPDB D_1000017668 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2003-02-18 +2 'Structure model' 1 1 2008-05-05 +3 'Structure model' 1 2 2011-07-13 +4 'Structure model' 1 3 2014-02-05 +5 'Structure model' 1 4 2020-07-29 +6 'Structure model' 1 5 2023-08-16 +7 'Structure model' 1 6 2024-10-30 +# +loop_ +_pdbx_audit_revision_details.ordinal +_pdbx_audit_revision_details.revision_ordinal +_pdbx_audit_revision_details.data_content_type +_pdbx_audit_revision_details.provider +_pdbx_audit_revision_details.type +_pdbx_audit_revision_details.description +_pdbx_audit_revision_details.details +1 1 'Structure model' repository 'Initial release' ? ? +2 5 'Structure model' repository Remediation 'Carbohydrate remediation' ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Non-polymer description' +3 3 'Structure model' 'Version format compliance' +4 4 'Structure model' 'Source and taxonomy' +5 5 'Structure model' 'Data collection' +6 5 'Structure model' 'Derived calculations' +7 5 'Structure model' 'Structure summary' +8 6 'Structure model' 'Data collection' +9 6 'Structure model' 'Database references' +10 6 'Structure model' 'Refinement description' +11 6 'Structure model' 'Structure summary' +12 7 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 5 'Structure model' chem_comp +2 5 'Structure model' entity +3 5 'Structure model' pdbx_chem_comp_identifier +4 5 'Structure model' pdbx_entity_nonpoly +5 5 'Structure model' struct_conn +6 5 'Structure model' struct_site +7 5 'Structure model' struct_site_gen +8 6 'Structure model' chem_comp +9 6 'Structure model' chem_comp_atom +10 6 'Structure model' chem_comp_bond +11 6 'Structure model' database_2 +12 6 'Structure model' pdbx_initial_refinement_model +13 7 'Structure model' pdbx_entry_details +14 7 'Structure model' pdbx_modification_feature +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 5 'Structure model' '_chem_comp.name' +2 5 'Structure model' '_chem_comp.type' +3 5 'Structure model' '_entity.pdbx_description' +4 5 'Structure model' '_pdbx_entity_nonpoly.name' +5 5 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +6 5 'Structure model' '_struct_conn.pdbx_role' +7 6 'Structure model' '_chem_comp.pdbx_synonyms' +8 6 'Structure model' '_database_2.pdbx_DOI' +9 6 'Structure model' '_database_2.pdbx_database_accession' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 1N8Z +_pdbx_database_status.recvd_initial_deposition_date 2002-11-21 +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.SG_entry . +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_pdbx_database_related.db_name +_pdbx_database_related.db_id +_pdbx_database_related.details +_pdbx_database_related.content_type +PDB 1N8Y 'rat HER2' unspecified +PDB 1M6B 'human HER3' unspecified +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Cho, H.-S.' 1 +'Mason, K.' 2 +'Ramyar, K.X.' 3 +'Stanley, A.M.' 4 +'Gabelli, S.B.' 5 +'Denney Jr., D.W.' 6 +'Leahy, D.J.' 7 +# +_citation.id primary +_citation.title 'Structure of the Extracellular Region of HER2 Alone and in Complex with the Herceptin Fab' +_citation.journal_abbrev Nature +_citation.journal_volume 421 +_citation.page_first 756 +_citation.page_last 760 +_citation.year 2003 +_citation.journal_id_ASTM NATUAS +_citation.country UK +_citation.journal_id_ISSN 0028-0836 +_citation.journal_id_CSD 0006 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed 12610629 +_citation.pdbx_database_id_DOI 10.1038/nature01392 +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Cho, H.-S.' 1 ? +primary 'Mason, K.' 2 ? +primary 'Ramyar, K.X.' 3 ? +primary 'Stanley, A.M.' 4 ? +primary 'Gabelli, S.B.' 5 ? +primary 'Denney Jr., D.W.' 6 ? +primary 'Leahy, D.J.' 7 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Herceptin Fab (antibody) - light chain' 23466.031 1 ? ? ? ? +2 polymer man 'Herceptin Fab (antibody) - heavy chain' 23425.180 1 ? ? ? ? +3 polymer man 'Receptor protein-tyrosine kinase erbB-2' 66989.109 1 2.7.1.112 ? 'extracellular domain' ? +4 non-polymer man 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208 2 ? ? ? ? +5 non-polymer syn 'SULFATE ION' 96.063 1 ? ? ? ? +6 water nat water 18.015 79 ? ? ? ? +# +_entity_name_com.entity_id 3 +_entity_name_com.name 'Tyrosine kinase-type cell surface receptor HER2' +# +loop_ +_entity_poly.entity_id +_entity_poly.type +_entity_poly.nstd_linkage +_entity_poly.nstd_monomer +_entity_poly.pdbx_seq_one_letter_code +_entity_poly.pdbx_seq_one_letter_code_can +_entity_poly.pdbx_strand_id +_entity_poly.pdbx_target_identifier +1 'polypeptide(L)' no no +;DIQMTQSPSSLSASVGDRVTITCRASQDVNTAVAWYQQKPGKAPKLLIYSASFLYSGVPSRFSGSRSGTDFTLTISSLQP +EDFATYYCQQHYTTPPTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ +ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC +; +;DIQMTQSPSSLSASVGDRVTITCRASQDVNTAVAWYQQKPGKAPKLLIYSASFLYSGVPSRFSGSRSGTDFTLTISSLQP +EDFATYYCQQHYTTPPTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ +ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC +; +A ? +2 'polypeptide(L)' no no +;EVQLVESGGGLVQPGGSLRLSCAASGFNIKDTYIHWVRQAPGKGLEWVARIYPTNGYTRYADSVKGRFTISADTSKNTAY +LQMNSLRAEDTAVYYCSRWGGDGFYAMDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVS +WNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEP +; +;EVQLVESGGGLVQPGGSLRLSCAASGFNIKDTYIHWVRQAPGKGLEWVARIYPTNGYTRYADSVKGRFTISADTSKNTAY +LQMNSLRAEDTAVYYCSRWGGDGFYAMDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVS +WNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEP +; +B ? +3 'polypeptide(L)' no no +;TQVCTGTDMKLRLPASPETHLDMLRHLYQGCQVVQGNLELTYLPTNASLSFLQDIQEVQGYVLIAHNQVRQVPLQRLRIV +RGTQLFEDNYALAVLDNGDPLNNTTPVTGASPGGLRELQLRSLTEILKGGVLIQRNPQLCYQDTILWKDIFHKNNQLALT +LIDTNRSRACHPCSPMCKGSRCWGESSEDCQSLTRTVCAGGCARCKGPLPTDCCHEQCAAGCTGPKHSDCLACLHFNHSG +ICELHCPALVTYNTDTFESMPNPEGRYTFGASCVTACPYNYLSTDVGSCTLVCPLHNQEVTAEDGTQRCEKCSKPCARVC +YGLGMEHLREVRAVTSANIQEFAGCKKIFGSLAFLPESFDGDPASNTAPLQPEQLQVFETLEEITGYLYISAWPDSLPDL +SVFQNLQVIRGRILHNGAYSLTLQGLGISWLGLRSLRELGSGLALIHHNTHLCFVHTVPWDQLFRNPHQALLHTANRPED +ECVGEGLACHQLCARGHCWGPGPTQCVNCSQFLRGQECVEECRVLQGLPREYVNARHCLPCHPECQPQNGSVTCFGPEAD +QCVACAHYKDPPFCVARCPSGVKPDLSYMPIWKFPDEEGACQPCPIN +; +;TQVCTGTDMKLRLPASPETHLDMLRHLYQGCQVVQGNLELTYLPTNASLSFLQDIQEVQGYVLIAHNQVRQVPLQRLRIV +RGTQLFEDNYALAVLDNGDPLNNTTPVTGASPGGLRELQLRSLTEILKGGVLIQRNPQLCYQDTILWKDIFHKNNQLALT +LIDTNRSRACHPCSPMCKGSRCWGESSEDCQSLTRTVCAGGCARCKGPLPTDCCHEQCAAGCTGPKHSDCLACLHFNHSG +ICELHCPALVTYNTDTFESMPNPEGRYTFGASCVTACPYNYLSTDVGSCTLVCPLHNQEVTAEDGTQRCEKCSKPCARVC +YGLGMEHLREVRAVTSANIQEFAGCKKIFGSLAFLPESFDGDPASNTAPLQPEQLQVFETLEEITGYLYISAWPDSLPDL +SVFQNLQVIRGRILHNGAYSLTLQGLGISWLGLRSLRELGSGLALIHHNTHLCFVHTVPWDQLFRNPHQALLHTANRPED +ECVGEGLACHQLCARGHCWGPGPTQCVNCSQFLRGQECVEECRVLQGLPREYVNARHCLPCHPECQPQNGSVTCFGPEAD +QCVACAHYKDPPFCVARCPSGVKPDLSYMPIWKFPDEEGACQPCPIN +; +C ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +4 2-acetamido-2-deoxy-beta-D-glucopyranose NAG +5 'SULFATE ION' SO4 +6 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 ASP n +1 2 ILE n +1 3 GLN n +1 4 MET n +1 5 THR n +1 6 GLN n +1 7 SER n +1 8 PRO n +1 9 SER n +1 10 SER n +1 11 LEU n +1 12 SER n +1 13 ALA n +1 14 SER n +1 15 VAL n +1 16 GLY n +1 17 ASP n +1 18 ARG n +1 19 VAL n +1 20 THR n +1 21 ILE n +1 22 THR n +1 23 CYS n +1 24 ARG n +1 25 ALA n +1 26 SER n +1 27 GLN n +1 28 ASP n +1 29 VAL n +1 30 ASN n +1 31 THR n +1 32 ALA n +1 33 VAL n +1 34 ALA n +1 35 TRP n +1 36 TYR n +1 37 GLN n +1 38 GLN n +1 39 LYS n +1 40 PRO n +1 41 GLY n +1 42 LYS n +1 43 ALA n +1 44 PRO n +1 45 LYS n +1 46 LEU n +1 47 LEU n +1 48 ILE n +1 49 TYR n +1 50 SER n +1 51 ALA n +1 52 SER n +1 53 PHE n +1 54 LEU n +1 55 TYR n +1 56 SER n +1 57 GLY n +1 58 VAL n +1 59 PRO n +1 60 SER n +1 61 ARG n +1 62 PHE n +1 63 SER n +1 64 GLY n +1 65 SER n +1 66 ARG n +1 67 SER n +1 68 GLY n +1 69 THR n +1 70 ASP n +1 71 PHE n +1 72 THR n +1 73 LEU n +1 74 THR n +1 75 ILE n +1 76 SER n +1 77 SER n +1 78 LEU n +1 79 GLN n +1 80 PRO n +1 81 GLU n +1 82 ASP n +1 83 PHE n +1 84 ALA n +1 85 THR n +1 86 TYR n +1 87 TYR n +1 88 CYS n +1 89 GLN n +1 90 GLN n +1 91 HIS n +1 92 TYR n +1 93 THR n +1 94 THR n +1 95 PRO n +1 96 PRO n +1 97 THR n +1 98 PHE n +1 99 GLY n +1 100 GLN n +1 101 GLY n +1 102 THR n +1 103 LYS n +1 104 VAL n +1 105 GLU n +1 106 ILE n +1 107 LYS n +1 108 ARG n +1 109 THR n +1 110 VAL n +1 111 ALA n +1 112 ALA n +1 113 PRO n +1 114 SER n +1 115 VAL n +1 116 PHE n +1 117 ILE n +1 118 PHE n +1 119 PRO n +1 120 PRO n +1 121 SER n +1 122 ASP n +1 123 GLU n +1 124 GLN n +1 125 LEU n +1 126 LYS n +1 127 SER n +1 128 GLY n +1 129 THR n +1 130 ALA n +1 131 SER n +1 132 VAL n +1 133 VAL n +1 134 CYS n +1 135 LEU n +1 136 LEU n +1 137 ASN n +1 138 ASN n +1 139 PHE n +1 140 TYR n +1 141 PRO n +1 142 ARG n +1 143 GLU n +1 144 ALA n +1 145 LYS n +1 146 VAL n +1 147 GLN n +1 148 TRP n +1 149 LYS n +1 150 VAL n +1 151 ASP n +1 152 ASN n +1 153 ALA n +1 154 LEU n +1 155 GLN n +1 156 SER n +1 157 GLY n +1 158 ASN n +1 159 SER n +1 160 GLN n +1 161 GLU n +1 162 SER n +1 163 VAL n +1 164 THR n +1 165 GLU n +1 166 GLN n +1 167 ASP n +1 168 SER n +1 169 LYS n +1 170 ASP n +1 171 SER n +1 172 THR n +1 173 TYR n +1 174 SER n +1 175 LEU n +1 176 SER n +1 177 SER n +1 178 THR n +1 179 LEU n +1 180 THR n +1 181 LEU n +1 182 SER n +1 183 LYS n +1 184 ALA n +1 185 ASP n +1 186 TYR n +1 187 GLU n +1 188 LYS n +1 189 HIS n +1 190 LYS n +1 191 VAL n +1 192 TYR n +1 193 ALA n +1 194 CYS n +1 195 GLU n +1 196 VAL n +1 197 THR n +1 198 HIS n +1 199 GLN n +1 200 GLY n +1 201 LEU n +1 202 SER n +1 203 SER n +1 204 PRO n +1 205 VAL n +1 206 THR n +1 207 LYS n +1 208 SER n +1 209 PHE n +1 210 ASN n +1 211 ARG n +1 212 GLY n +1 213 GLU n +1 214 CYS n +2 1 GLU n +2 2 VAL n +2 3 GLN n +2 4 LEU n +2 5 VAL n +2 6 GLU n +2 7 SER n +2 8 GLY n +2 9 GLY n +2 10 GLY n +2 11 LEU n +2 12 VAL n +2 13 GLN n +2 14 PRO n +2 15 GLY n +2 16 GLY n +2 17 SER n +2 18 LEU n +2 19 ARG n +2 20 LEU n +2 21 SER n +2 22 CYS n +2 23 ALA n +2 24 ALA n +2 25 SER n +2 26 GLY n +2 27 PHE n +2 28 ASN n +2 29 ILE n +2 30 LYS n +2 31 ASP n +2 32 THR n +2 33 TYR n +2 34 ILE n +2 35 HIS n +2 36 TRP n +2 37 VAL n +2 38 ARG n +2 39 GLN n +2 40 ALA n +2 41 PRO n +2 42 GLY n +2 43 LYS n +2 44 GLY n +2 45 LEU n +2 46 GLU n +2 47 TRP n +2 48 VAL n +2 49 ALA n +2 50 ARG n +2 51 ILE n +2 52 TYR n +2 53 PRO n +2 54 THR n +2 55 ASN n +2 56 GLY n +2 57 TYR n +2 58 THR n +2 59 ARG n +2 60 TYR n +2 61 ALA n +2 62 ASP n +2 63 SER n +2 64 VAL n +2 65 LYS n +2 66 GLY n +2 67 ARG n +2 68 PHE n +2 69 THR n +2 70 ILE n +2 71 SER n +2 72 ALA n +2 73 ASP n +2 74 THR n +2 75 SER n +2 76 LYS n +2 77 ASN n +2 78 THR n +2 79 ALA n +2 80 TYR n +2 81 LEU n +2 82 GLN n +2 83 MET n +2 84 ASN n +2 85 SER n +2 86 LEU n +2 87 ARG n +2 88 ALA n +2 89 GLU n +2 90 ASP n +2 91 THR n +2 92 ALA n +2 93 VAL n +2 94 TYR n +2 95 TYR n +2 96 CYS n +2 97 SER n +2 98 ARG n +2 99 TRP n +2 100 GLY n +2 101 GLY n +2 102 ASP n +2 103 GLY n +2 104 PHE n +2 105 TYR n +2 106 ALA n +2 107 MET n +2 108 ASP n +2 109 TYR n +2 110 TRP n +2 111 GLY n +2 112 GLN n +2 113 GLY n +2 114 THR n +2 115 LEU n +2 116 VAL n +2 117 THR n +2 118 VAL n +2 119 SER n +2 120 SER n +2 121 ALA n +2 122 SER n +2 123 THR n +2 124 LYS n +2 125 GLY n +2 126 PRO n +2 127 SER n +2 128 VAL n +2 129 PHE n +2 130 PRO n +2 131 LEU n +2 132 ALA n +2 133 PRO n +2 134 SER n +2 135 SER n +2 136 LYS n +2 137 SER n +2 138 THR n +2 139 SER n +2 140 GLY n +2 141 GLY n +2 142 THR n +2 143 ALA n +2 144 ALA n +2 145 LEU n +2 146 GLY n +2 147 CYS n +2 148 LEU n +2 149 VAL n +2 150 LYS n +2 151 ASP n +2 152 TYR n +2 153 PHE n +2 154 PRO n +2 155 GLU n +2 156 PRO n +2 157 VAL n +2 158 THR n +2 159 VAL n +2 160 SER n +2 161 TRP n +2 162 ASN n +2 163 SER n +2 164 GLY n +2 165 ALA n +2 166 LEU n +2 167 THR n +2 168 SER n +2 169 GLY n +2 170 VAL n +2 171 HIS n +2 172 THR n +2 173 PHE n +2 174 PRO n +2 175 ALA n +2 176 VAL n +2 177 LEU n +2 178 GLN n +2 179 SER n +2 180 SER n +2 181 GLY n +2 182 LEU n +2 183 TYR n +2 184 SER n +2 185 LEU n +2 186 SER n +2 187 SER n +2 188 VAL n +2 189 VAL n +2 190 THR n +2 191 VAL n +2 192 PRO n +2 193 SER n +2 194 SER n +2 195 SER n +2 196 LEU n +2 197 GLY n +2 198 THR n +2 199 GLN n +2 200 THR n +2 201 TYR n +2 202 ILE n +2 203 CYS n +2 204 ASN n +2 205 VAL n +2 206 ASN n +2 207 HIS n +2 208 LYS n +2 209 PRO n +2 210 SER n +2 211 ASN n +2 212 THR n +2 213 LYS n +2 214 VAL n +2 215 ASP n +2 216 LYS n +2 217 LYS n +2 218 VAL n +2 219 GLU n +2 220 PRO n +3 1 THR n +3 2 GLN n +3 3 VAL n +3 4 CYS n +3 5 THR n +3 6 GLY n +3 7 THR n +3 8 ASP n +3 9 MET n +3 10 LYS n +3 11 LEU n +3 12 ARG n +3 13 LEU n +3 14 PRO n +3 15 ALA n +3 16 SER n +3 17 PRO n +3 18 GLU n +3 19 THR n +3 20 HIS n +3 21 LEU n +3 22 ASP n +3 23 MET n +3 24 LEU n +3 25 ARG n +3 26 HIS n +3 27 LEU n +3 28 TYR n +3 29 GLN n +3 30 GLY n +3 31 CYS n +3 32 GLN n +3 33 VAL n +3 34 VAL n +3 35 GLN n +3 36 GLY n +3 37 ASN n +3 38 LEU n +3 39 GLU n +3 40 LEU n +3 41 THR n +3 42 TYR n +3 43 LEU n +3 44 PRO n +3 45 THR n +3 46 ASN n +3 47 ALA n +3 48 SER n +3 49 LEU n +3 50 SER n +3 51 PHE n +3 52 LEU n +3 53 GLN n +3 54 ASP n +3 55 ILE n +3 56 GLN n +3 57 GLU n +3 58 VAL n +3 59 GLN n +3 60 GLY n +3 61 TYR n +3 62 VAL n +3 63 LEU n +3 64 ILE n +3 65 ALA n +3 66 HIS n +3 67 ASN n +3 68 GLN n +3 69 VAL n +3 70 ARG n +3 71 GLN n +3 72 VAL n +3 73 PRO n +3 74 LEU n +3 75 GLN n +3 76 ARG n +3 77 LEU n +3 78 ARG n +3 79 ILE n +3 80 VAL n +3 81 ARG n +3 82 GLY n +3 83 THR n +3 84 GLN n +3 85 LEU n +3 86 PHE n +3 87 GLU n +3 88 ASP n +3 89 ASN n +3 90 TYR n +3 91 ALA n +3 92 LEU n +3 93 ALA n +3 94 VAL n +3 95 LEU n +3 96 ASP n +3 97 ASN n +3 98 GLY n +3 99 ASP n +3 100 PRO n +3 101 LEU n +3 102 ASN n +3 103 ASN n +3 104 THR n +3 105 THR n +3 106 PRO n +3 107 VAL n +3 108 THR n +3 109 GLY n +3 110 ALA n +3 111 SER n +3 112 PRO n +3 113 GLY n +3 114 GLY n +3 115 LEU n +3 116 ARG n +3 117 GLU n +3 118 LEU n +3 119 GLN n +3 120 LEU n +3 121 ARG n +3 122 SER n +3 123 LEU n +3 124 THR n +3 125 GLU n +3 126 ILE n +3 127 LEU n +3 128 LYS n +3 129 GLY n +3 130 GLY n +3 131 VAL n +3 132 LEU n +3 133 ILE n +3 134 GLN n +3 135 ARG n +3 136 ASN n +3 137 PRO n +3 138 GLN n +3 139 LEU n +3 140 CYS n +3 141 TYR n +3 142 GLN n +3 143 ASP n +3 144 THR n +3 145 ILE n +3 146 LEU n +3 147 TRP n +3 148 LYS n +3 149 ASP n +3 150 ILE n +3 151 PHE n +3 152 HIS n +3 153 LYS n +3 154 ASN n +3 155 ASN n +3 156 GLN n +3 157 LEU n +3 158 ALA n +3 159 LEU n +3 160 THR n +3 161 LEU n +3 162 ILE n +3 163 ASP n +3 164 THR n +3 165 ASN n +3 166 ARG n +3 167 SER n +3 168 ARG n +3 169 ALA n +3 170 CYS n +3 171 HIS n +3 172 PRO n +3 173 CYS n +3 174 SER n +3 175 PRO n +3 176 MET n +3 177 CYS n +3 178 LYS n +3 179 GLY n +3 180 SER n +3 181 ARG n +3 182 CYS n +3 183 TRP n +3 184 GLY n +3 185 GLU n +3 186 SER n +3 187 SER n +3 188 GLU n +3 189 ASP n +3 190 CYS n +3 191 GLN n +3 192 SER n +3 193 LEU n +3 194 THR n +3 195 ARG n +3 196 THR n +3 197 VAL n +3 198 CYS n +3 199 ALA n +3 200 GLY n +3 201 GLY n +3 202 CYS n +3 203 ALA n +3 204 ARG n +3 205 CYS n +3 206 LYS n +3 207 GLY n +3 208 PRO n +3 209 LEU n +3 210 PRO n +3 211 THR n +3 212 ASP n +3 213 CYS n +3 214 CYS n +3 215 HIS n +3 216 GLU n +3 217 GLN n +3 218 CYS n +3 219 ALA n +3 220 ALA n +3 221 GLY n +3 222 CYS n +3 223 THR n +3 224 GLY n +3 225 PRO n +3 226 LYS n +3 227 HIS n +3 228 SER n +3 229 ASP n +3 230 CYS n +3 231 LEU n +3 232 ALA n +3 233 CYS n +3 234 LEU n +3 235 HIS n +3 236 PHE n +3 237 ASN n +3 238 HIS n +3 239 SER n +3 240 GLY n +3 241 ILE n +3 242 CYS n +3 243 GLU n +3 244 LEU n +3 245 HIS n +3 246 CYS n +3 247 PRO n +3 248 ALA n +3 249 LEU n +3 250 VAL n +3 251 THR n +3 252 TYR n +3 253 ASN n +3 254 THR n +3 255 ASP n +3 256 THR n +3 257 PHE n +3 258 GLU n +3 259 SER n +3 260 MET n +3 261 PRO n +3 262 ASN n +3 263 PRO n +3 264 GLU n +3 265 GLY n +3 266 ARG n +3 267 TYR n +3 268 THR n +3 269 PHE n +3 270 GLY n +3 271 ALA n +3 272 SER n +3 273 CYS n +3 274 VAL n +3 275 THR n +3 276 ALA n +3 277 CYS n +3 278 PRO n +3 279 TYR n +3 280 ASN n +3 281 TYR n +3 282 LEU n +3 283 SER n +3 284 THR n +3 285 ASP n +3 286 VAL n +3 287 GLY n +3 288 SER n +3 289 CYS n +3 290 THR n +3 291 LEU n +3 292 VAL n +3 293 CYS n +3 294 PRO n +3 295 LEU n +3 296 HIS n +3 297 ASN n +3 298 GLN n +3 299 GLU n +3 300 VAL n +3 301 THR n +3 302 ALA n +3 303 GLU n +3 304 ASP n +3 305 GLY n +3 306 THR n +3 307 GLN n +3 308 ARG n +3 309 CYS n +3 310 GLU n +3 311 LYS n +3 312 CYS n +3 313 SER n +3 314 LYS n +3 315 PRO n +3 316 CYS n +3 317 ALA n +3 318 ARG n +3 319 VAL n +3 320 CYS n +3 321 TYR n +3 322 GLY n +3 323 LEU n +3 324 GLY n +3 325 MET n +3 326 GLU n +3 327 HIS n +3 328 LEU n +3 329 ARG n +3 330 GLU n +3 331 VAL n +3 332 ARG n +3 333 ALA n +3 334 VAL n +3 335 THR n +3 336 SER n +3 337 ALA n +3 338 ASN n +3 339 ILE n +3 340 GLN n +3 341 GLU n +3 342 PHE n +3 343 ALA n +3 344 GLY n +3 345 CYS n +3 346 LYS n +3 347 LYS n +3 348 ILE n +3 349 PHE n +3 350 GLY n +3 351 SER n +3 352 LEU n +3 353 ALA n +3 354 PHE n +3 355 LEU n +3 356 PRO n +3 357 GLU n +3 358 SER n +3 359 PHE n +3 360 ASP n +3 361 GLY n +3 362 ASP n +3 363 PRO n +3 364 ALA n +3 365 SER n +3 366 ASN n +3 367 THR n +3 368 ALA n +3 369 PRO n +3 370 LEU n +3 371 GLN n +3 372 PRO n +3 373 GLU n +3 374 GLN n +3 375 LEU n +3 376 GLN n +3 377 VAL n +3 378 PHE n +3 379 GLU n +3 380 THR n +3 381 LEU n +3 382 GLU n +3 383 GLU n +3 384 ILE n +3 385 THR n +3 386 GLY n +3 387 TYR n +3 388 LEU n +3 389 TYR n +3 390 ILE n +3 391 SER n +3 392 ALA n +3 393 TRP n +3 394 PRO n +3 395 ASP n +3 396 SER n +3 397 LEU n +3 398 PRO n +3 399 ASP n +3 400 LEU n +3 401 SER n +3 402 VAL n +3 403 PHE n +3 404 GLN n +3 405 ASN n +3 406 LEU n +3 407 GLN n +3 408 VAL n +3 409 ILE n +3 410 ARG n +3 411 GLY n +3 412 ARG n +3 413 ILE n +3 414 LEU n +3 415 HIS n +3 416 ASN n +3 417 GLY n +3 418 ALA n +3 419 TYR n +3 420 SER n +3 421 LEU n +3 422 THR n +3 423 LEU n +3 424 GLN n +3 425 GLY n +3 426 LEU n +3 427 GLY n +3 428 ILE n +3 429 SER n +3 430 TRP n +3 431 LEU n +3 432 GLY n +3 433 LEU n +3 434 ARG n +3 435 SER n +3 436 LEU n +3 437 ARG n +3 438 GLU n +3 439 LEU n +3 440 GLY n +3 441 SER n +3 442 GLY n +3 443 LEU n +3 444 ALA n +3 445 LEU n +3 446 ILE n +3 447 HIS n +3 448 HIS n +3 449 ASN n +3 450 THR n +3 451 HIS n +3 452 LEU n +3 453 CYS n +3 454 PHE n +3 455 VAL n +3 456 HIS n +3 457 THR n +3 458 VAL n +3 459 PRO n +3 460 TRP n +3 461 ASP n +3 462 GLN n +3 463 LEU n +3 464 PHE n +3 465 ARG n +3 466 ASN n +3 467 PRO n +3 468 HIS n +3 469 GLN n +3 470 ALA n +3 471 LEU n +3 472 LEU n +3 473 HIS n +3 474 THR n +3 475 ALA n +3 476 ASN n +3 477 ARG n +3 478 PRO n +3 479 GLU n +3 480 ASP n +3 481 GLU n +3 482 CYS n +3 483 VAL n +3 484 GLY n +3 485 GLU n +3 486 GLY n +3 487 LEU n +3 488 ALA n +3 489 CYS n +3 490 HIS n +3 491 GLN n +3 492 LEU n +3 493 CYS n +3 494 ALA n +3 495 ARG n +3 496 GLY n +3 497 HIS n +3 498 CYS n +3 499 TRP n +3 500 GLY n +3 501 PRO n +3 502 GLY n +3 503 PRO n +3 504 THR n +3 505 GLN n +3 506 CYS n +3 507 VAL n +3 508 ASN n +3 509 CYS n +3 510 SER n +3 511 GLN n +3 512 PHE n +3 513 LEU n +3 514 ARG n +3 515 GLY n +3 516 GLN n +3 517 GLU n +3 518 CYS n +3 519 VAL n +3 520 GLU n +3 521 GLU n +3 522 CYS n +3 523 ARG n +3 524 VAL n +3 525 LEU n +3 526 GLN n +3 527 GLY n +3 528 LEU n +3 529 PRO n +3 530 ARG n +3 531 GLU n +3 532 TYR n +3 533 VAL n +3 534 ASN n +3 535 ALA n +3 536 ARG n +3 537 HIS n +3 538 CYS n +3 539 LEU n +3 540 PRO n +3 541 CYS n +3 542 HIS n +3 543 PRO n +3 544 GLU n +3 545 CYS n +3 546 GLN n +3 547 PRO n +3 548 GLN n +3 549 ASN n +3 550 GLY n +3 551 SER n +3 552 VAL n +3 553 THR n +3 554 CYS n +3 555 PHE n +3 556 GLY n +3 557 PRO n +3 558 GLU n +3 559 ALA n +3 560 ASP n +3 561 GLN n +3 562 CYS n +3 563 VAL n +3 564 ALA n +3 565 CYS n +3 566 ALA n +3 567 HIS n +3 568 TYR n +3 569 LYS n +3 570 ASP n +3 571 PRO n +3 572 PRO n +3 573 PHE n +3 574 CYS n +3 575 VAL n +3 576 ALA n +3 577 ARG n +3 578 CYS n +3 579 PRO n +3 580 SER n +3 581 GLY n +3 582 VAL n +3 583 LYS n +3 584 PRO n +3 585 ASP n +3 586 LEU n +3 587 SER n +3 588 TYR n +3 589 MET n +3 590 PRO n +3 591 ILE n +3 592 TRP n +3 593 LYS n +3 594 PHE n +3 595 PRO n +3 596 ASP n +3 597 GLU n +3 598 GLU n +3 599 GLY n +3 600 ALA n +3 601 CYS n +3 602 GLN n +3 603 PRO n +3 604 CYS n +3 605 PRO n +3 606 ILE n +3 607 ASN n +# +loop_ +_entity_src_gen.entity_id +_entity_src_gen.pdbx_src_id +_entity_src_gen.pdbx_alt_source_flag +_entity_src_gen.pdbx_seq_type +_entity_src_gen.pdbx_beg_seq_num +_entity_src_gen.pdbx_end_seq_num +_entity_src_gen.gene_src_common_name +_entity_src_gen.gene_src_genus +_entity_src_gen.pdbx_gene_src_gene +_entity_src_gen.gene_src_species +_entity_src_gen.gene_src_strain +_entity_src_gen.gene_src_tissue +_entity_src_gen.gene_src_tissue_fraction +_entity_src_gen.gene_src_details +_entity_src_gen.pdbx_gene_src_fragment +_entity_src_gen.pdbx_gene_src_scientific_name +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id +_entity_src_gen.pdbx_gene_src_variant +_entity_src_gen.pdbx_gene_src_cell_line +_entity_src_gen.pdbx_gene_src_atcc +_entity_src_gen.pdbx_gene_src_organ +_entity_src_gen.pdbx_gene_src_organelle +_entity_src_gen.pdbx_gene_src_cell +_entity_src_gen.pdbx_gene_src_cellular_location +_entity_src_gen.host_org_common_name +_entity_src_gen.pdbx_host_org_scientific_name +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id +_entity_src_gen.host_org_genus +_entity_src_gen.pdbx_host_org_gene +_entity_src_gen.pdbx_host_org_organ +_entity_src_gen.host_org_species +_entity_src_gen.pdbx_host_org_tissue +_entity_src_gen.pdbx_host_org_tissue_fraction +_entity_src_gen.pdbx_host_org_strain +_entity_src_gen.pdbx_host_org_variant +_entity_src_gen.pdbx_host_org_cell_line +_entity_src_gen.pdbx_host_org_atcc +_entity_src_gen.pdbx_host_org_culture_collection +_entity_src_gen.pdbx_host_org_cell +_entity_src_gen.pdbx_host_org_organelle +_entity_src_gen.pdbx_host_org_cellular_location +_entity_src_gen.pdbx_host_org_vector_type +_entity_src_gen.pdbx_host_org_vector +_entity_src_gen.host_org_details +_entity_src_gen.expression_system_id +_entity_src_gen.plasmid_name +_entity_src_gen.plasmid_details +_entity_src_gen.pdbx_description +1 1 sample ? ? ? mouse/human ? ? ? ? ? ? ? ? 'Mus musculus, Homo sapiens' '10090, 9606' ? ? ? ? ? ? ? ? ? ? ? ? +? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +2 1 sample ? ? ? mouse/human ? ? ? ? ? ? ? ? 'Mus musculus, Homo sapiens' '10090, 9606' ? ? ? ? ? ? ? ? ? ? ? ? +? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +3 1 sample ? ? ? human Homo 'HER2(erbB2)' ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? +'Chinese hamster' 'Cricetulus griseus' 10029 Cricetulus ? ? ? ? ? 'CHO(Lec1)' ? ? ? ? ? ? ? plasmid ? ? ? pSGHV0 ? ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose +;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE +; +'C8 H15 N O6' 221.208 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_chem_comp_identifier.comp_id +_pdbx_chem_comp_identifier.type +_pdbx_chem_comp_identifier.program +_pdbx_chem_comp_identifier.program_version +_pdbx_chem_comp_identifier.identifier +NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DGlcpNAcb +NAG 'COMMON NAME' GMML 1.0 N-acetyl-b-D-glucopyranosamine +NAG 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 b-D-GlcpNAc +NAG 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 GlcNAc +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 ASP 1 1 1 ASP ASP A . n +A 1 2 ILE 2 2 2 ILE ILE A . n +A 1 3 GLN 3 3 3 GLN GLN A . n +A 1 4 MET 4 4 4 MET MET A . n +A 1 5 THR 5 5 5 THR THR A . n +A 1 6 GLN 6 6 6 GLN GLN A . n +A 1 7 SER 7 7 7 SER SER A . n +A 1 8 PRO 8 8 8 PRO PRO A . n +A 1 9 SER 9 9 9 SER SER A . n +A 1 10 SER 10 10 10 SER SER A . n +A 1 11 LEU 11 11 11 LEU LEU A . n +A 1 12 SER 12 12 12 SER SER A . n +A 1 13 ALA 13 13 13 ALA ALA A . n +A 1 14 SER 14 14 14 SER SER A . n +A 1 15 VAL 15 15 15 VAL VAL A . n +A 1 16 GLY 16 16 16 GLY GLY A . n +A 1 17 ASP 17 17 17 ASP ASP A . n +A 1 18 ARG 18 18 18 ARG ARG A . n +A 1 19 VAL 19 19 19 VAL VAL A . n +A 1 20 THR 20 20 20 THR THR A . n +A 1 21 ILE 21 21 21 ILE ILE A . n +A 1 22 THR 22 22 22 THR THR A . n +A 1 23 CYS 23 23 23 CYS CYS A . n +A 1 24 ARG 24 24 24 ARG ARG A . n +A 1 25 ALA 25 25 25 ALA ALA A . n +A 1 26 SER 26 26 26 SER SER A . n +A 1 27 GLN 27 27 27 GLN GLN A . n +A 1 28 ASP 28 28 28 ASP ASP A . n +A 1 29 VAL 29 29 29 VAL VAL A . n +A 1 30 ASN 30 30 30 ASN ASN A . n +A 1 31 THR 31 31 31 THR THR A . n +A 1 32 ALA 32 32 32 ALA ALA A . n +A 1 33 VAL 33 33 33 VAL VAL A . n +A 1 34 ALA 34 34 34 ALA ALA A . n +A 1 35 TRP 35 35 35 TRP TRP A . n +A 1 36 TYR 36 36 36 TYR TYR A . n +A 1 37 GLN 37 37 37 GLN GLN A . n +A 1 38 GLN 38 38 38 GLN GLN A . n +A 1 39 LYS 39 39 39 LYS LYS A . n +A 1 40 PRO 40 40 40 PRO PRO A . n +A 1 41 GLY 41 41 41 GLY GLY A . n +A 1 42 LYS 42 42 42 LYS LYS A . n +A 1 43 ALA 43 43 43 ALA ALA A . n +A 1 44 PRO 44 44 44 PRO PRO A . n +A 1 45 LYS 45 45 45 LYS LYS A . n +A 1 46 LEU 46 46 46 LEU LEU A . n +A 1 47 LEU 47 47 47 LEU LEU A . n +A 1 48 ILE 48 48 48 ILE ILE A . n +A 1 49 TYR 49 49 49 TYR TYR A . n +A 1 50 SER 50 50 50 SER SER A . n +A 1 51 ALA 51 51 51 ALA ALA A . n +A 1 52 SER 52 52 52 SER SER A . n +A 1 53 PHE 53 53 53 PHE PHE A . n +A 1 54 LEU 54 54 54 LEU LEU A . n +A 1 55 TYR 55 55 55 TYR TYR A . n +A 1 56 SER 56 56 56 SER SER A . n +A 1 57 GLY 57 57 57 GLY GLY A . n +A 1 58 VAL 58 58 58 VAL VAL A . n +A 1 59 PRO 59 59 59 PRO PRO A . n +A 1 60 SER 60 60 60 SER SER A . n +A 1 61 ARG 61 61 61 ARG ARG A . n +A 1 62 PHE 62 62 62 PHE PHE A . n +A 1 63 SER 63 63 63 SER SER A . n +A 1 64 GLY 64 64 64 GLY GLY A . n +A 1 65 SER 65 65 65 SER SER A . n +A 1 66 ARG 66 66 66 ARG ARG A . n +A 1 67 SER 67 67 67 SER SER A . n +A 1 68 GLY 68 68 68 GLY GLY A . n +A 1 69 THR 69 69 69 THR THR A . n +A 1 70 ASP 70 70 70 ASP ASP A . n +A 1 71 PHE 71 71 71 PHE PHE A . n +A 1 72 THR 72 72 72 THR THR A . n +A 1 73 LEU 73 73 73 LEU LEU A . n +A 1 74 THR 74 74 74 THR THR A . n +A 1 75 ILE 75 75 75 ILE ILE A . n +A 1 76 SER 76 76 76 SER SER A . n +A 1 77 SER 77 77 77 SER SER A . n +A 1 78 LEU 78 78 78 LEU LEU A . n +A 1 79 GLN 79 79 79 GLN GLN A . n +A 1 80 PRO 80 80 80 PRO PRO A . n +A 1 81 GLU 81 81 81 GLU GLU A . n +A 1 82 ASP 82 82 82 ASP ASP A . n +A 1 83 PHE 83 83 83 PHE PHE A . n +A 1 84 ALA 84 84 84 ALA ALA A . n +A 1 85 THR 85 85 85 THR THR A . n +A 1 86 TYR 86 86 86 TYR TYR A . n +A 1 87 TYR 87 87 87 TYR TYR A . n +A 1 88 CYS 88 88 88 CYS CYS A . n +A 1 89 GLN 89 89 89 GLN GLN A . n +A 1 90 GLN 90 90 90 GLN GLN A . n +A 1 91 HIS 91 91 91 HIS HIS A . n +A 1 92 TYR 92 92 92 TYR TYR A . n +A 1 93 THR 93 93 93 THR THR A . n +A 1 94 THR 94 94 94 THR THR A . n +A 1 95 PRO 95 95 95 PRO PRO A . n +A 1 96 PRO 96 96 96 PRO PRO A . n +A 1 97 THR 97 97 97 THR THR A . n +A 1 98 PHE 98 98 98 PHE PHE A . n +A 1 99 GLY 99 99 99 GLY GLY A . n +A 1 100 GLN 100 100 100 GLN GLN A . n +A 1 101 GLY 101 101 101 GLY GLY A . n +A 1 102 THR 102 102 102 THR THR A . n +A 1 103 LYS 103 103 103 LYS LYS A . n +A 1 104 VAL 104 104 104 VAL VAL A . n +A 1 105 GLU 105 105 105 GLU GLU A . n +A 1 106 ILE 106 106 106 ILE ILE A . n +A 1 107 LYS 107 107 107 LYS LYS A . n +A 1 108 ARG 108 108 108 ARG ARG A . n +A 1 109 THR 109 109 109 THR THR A . n +A 1 110 VAL 110 110 110 VAL VAL A . n +A 1 111 ALA 111 111 111 ALA ALA A . n +A 1 112 ALA 112 112 112 ALA ALA A . n +A 1 113 PRO 113 113 113 PRO PRO A . n +A 1 114 SER 114 114 114 SER SER A . n +A 1 115 VAL 115 115 115 VAL VAL A . n +A 1 116 PHE 116 116 116 PHE PHE A . n +A 1 117 ILE 117 117 117 ILE ILE A . n +A 1 118 PHE 118 118 118 PHE PHE A . n +A 1 119 PRO 119 119 119 PRO PRO A . n +A 1 120 PRO 120 120 120 PRO PRO A . n +A 1 121 SER 121 121 121 SER SER A . n +A 1 122 ASP 122 122 122 ASP ASP A . n +A 1 123 GLU 123 123 123 GLU GLU A . n +A 1 124 GLN 124 124 124 GLN GLN A . n +A 1 125 LEU 125 125 125 LEU LEU A . n +A 1 126 LYS 126 126 126 LYS LYS A . n +A 1 127 SER 127 127 127 SER SER A . n +A 1 128 GLY 128 128 128 GLY GLY A . n +A 1 129 THR 129 129 129 THR THR A . n +A 1 130 ALA 130 130 130 ALA ALA A . n +A 1 131 SER 131 131 131 SER SER A . n +A 1 132 VAL 132 132 132 VAL VAL A . n +A 1 133 VAL 133 133 133 VAL VAL A . n +A 1 134 CYS 134 134 134 CYS CYS A . n +A 1 135 LEU 135 135 135 LEU LEU A . n +A 1 136 LEU 136 136 136 LEU LEU A . n +A 1 137 ASN 137 137 137 ASN ASN A . n +A 1 138 ASN 138 138 138 ASN ASN A . n +A 1 139 PHE 139 139 139 PHE PHE A . n +A 1 140 TYR 140 140 140 TYR TYR A . n +A 1 141 PRO 141 141 141 PRO PRO A . n +A 1 142 ARG 142 142 142 ARG ARG A . n +A 1 143 GLU 143 143 143 GLU GLU A . n +A 1 144 ALA 144 144 144 ALA ALA A . n +A 1 145 LYS 145 145 145 LYS LYS A . n +A 1 146 VAL 146 146 146 VAL VAL A . n +A 1 147 GLN 147 147 147 GLN GLN A . n +A 1 148 TRP 148 148 148 TRP TRP A . n +A 1 149 LYS 149 149 149 LYS LYS A . n +A 1 150 VAL 150 150 150 VAL VAL A . n +A 1 151 ASP 151 151 151 ASP ASP A . n +A 1 152 ASN 152 152 152 ASN ASN A . n +A 1 153 ALA 153 153 153 ALA ALA A . n +A 1 154 LEU 154 154 154 LEU LEU A . n +A 1 155 GLN 155 155 155 GLN GLN A . n +A 1 156 SER 156 156 156 SER SER A . n +A 1 157 GLY 157 157 157 GLY GLY A . n +A 1 158 ASN 158 158 158 ASN ASN A . n +A 1 159 SER 159 159 159 SER SER A . n +A 1 160 GLN 160 160 160 GLN GLN A . n +A 1 161 GLU 161 161 161 GLU GLU A . n +A 1 162 SER 162 162 162 SER SER A . n +A 1 163 VAL 163 163 163 VAL VAL A . n +A 1 164 THR 164 164 164 THR THR A . n +A 1 165 GLU 165 165 165 GLU GLU A . n +A 1 166 GLN 166 166 166 GLN GLN A . n +A 1 167 ASP 167 167 167 ASP ASP A . n +A 1 168 SER 168 168 168 SER SER A . n +A 1 169 LYS 169 169 169 LYS LYS A . n +A 1 170 ASP 170 170 170 ASP ASP A . n +A 1 171 SER 171 171 171 SER SER A . n +A 1 172 THR 172 172 172 THR THR A . n +A 1 173 TYR 173 173 173 TYR TYR A . n +A 1 174 SER 174 174 174 SER SER A . n +A 1 175 LEU 175 175 175 LEU LEU A . n +A 1 176 SER 176 176 176 SER SER A . n +A 1 177 SER 177 177 177 SER SER A . n +A 1 178 THR 178 178 178 THR THR A . n +A 1 179 LEU 179 179 179 LEU LEU A . n +A 1 180 THR 180 180 180 THR THR A . n +A 1 181 LEU 181 181 181 LEU LEU A . n +A 1 182 SER 182 182 182 SER SER A . n +A 1 183 LYS 183 183 183 LYS LYS A . n +A 1 184 ALA 184 184 184 ALA ALA A . n +A 1 185 ASP 185 185 185 ASP ASP A . n +A 1 186 TYR 186 186 186 TYR TYR A . n +A 1 187 GLU 187 187 187 GLU GLU A . n +A 1 188 LYS 188 188 188 LYS LYS A . n +A 1 189 HIS 189 189 189 HIS HIS A . n +A 1 190 LYS 190 190 190 LYS ALA A . n +A 1 191 VAL 191 191 191 VAL VAL A . n +A 1 192 TYR 192 192 192 TYR TYR A . n +A 1 193 ALA 193 193 193 ALA ALA A . n +A 1 194 CYS 194 194 194 CYS CYS A . n +A 1 195 GLU 195 195 195 GLU GLU A . n +A 1 196 VAL 196 196 196 VAL VAL A . n +A 1 197 THR 197 197 197 THR THR A . n +A 1 198 HIS 198 198 198 HIS HIS A . n +A 1 199 GLN 199 199 199 GLN GLN A . n +A 1 200 GLY 200 200 200 GLY GLY A . n +A 1 201 LEU 201 201 201 LEU LEU A . n +A 1 202 SER 202 202 202 SER SER A . n +A 1 203 SER 203 203 203 SER SER A . n +A 1 204 PRO 204 204 204 PRO PRO A . n +A 1 205 VAL 205 205 205 VAL VAL A . n +A 1 206 THR 206 206 206 THR THR A . n +A 1 207 LYS 207 207 207 LYS LYS A . n +A 1 208 SER 208 208 208 SER SER A . n +A 1 209 PHE 209 209 209 PHE PHE A . n +A 1 210 ASN 210 210 210 ASN ASN A . n +A 1 211 ARG 211 211 211 ARG ARG A . n +A 1 212 GLY 212 212 212 GLY GLY A . n +A 1 213 GLU 213 213 213 GLU GLU A . n +A 1 214 CYS 214 214 214 CYS CYS A . n +B 2 1 GLU 1 1 1 GLU GLU B . n +B 2 2 VAL 2 2 2 VAL VAL B . n +B 2 3 GLN 3 3 3 GLN GLN B . n +B 2 4 LEU 4 4 4 LEU LEU B . n +B 2 5 VAL 5 5 5 VAL VAL B . n +B 2 6 GLU 6 6 6 GLU GLU B . n +B 2 7 SER 7 7 7 SER SER B . n +B 2 8 GLY 8 8 8 GLY GLY B . n +B 2 9 GLY 9 9 9 GLY GLY B . n +B 2 10 GLY 10 10 10 GLY GLY B . n +B 2 11 LEU 11 11 11 LEU LEU B . n +B 2 12 VAL 12 12 12 VAL VAL B . n +B 2 13 GLN 13 13 13 GLN GLN B . n +B 2 14 PRO 14 14 14 PRO PRO B . n +B 2 15 GLY 15 15 15 GLY GLY B . n +B 2 16 GLY 16 16 16 GLY GLY B . n +B 2 17 SER 17 17 17 SER SER B . n +B 2 18 LEU 18 18 18 LEU LEU B . n +B 2 19 ARG 19 19 19 ARG ARG B . n +B 2 20 LEU 20 20 20 LEU LEU B . n +B 2 21 SER 21 21 21 SER SER B . n +B 2 22 CYS 22 22 22 CYS CYS B . n +B 2 23 ALA 23 23 23 ALA ALA B . n +B 2 24 ALA 24 24 24 ALA ALA B . n +B 2 25 SER 25 25 25 SER SER B . n +B 2 26 GLY 26 26 26 GLY GLY B . n +B 2 27 PHE 27 27 27 PHE PHE B . n +B 2 28 ASN 28 28 28 ASN ASN B . n +B 2 29 ILE 29 29 29 ILE ILE B . n +B 2 30 LYS 30 30 30 LYS ALA B . n +B 2 31 ASP 31 31 31 ASP ASP B . n +B 2 32 THR 32 32 32 THR THR B . n +B 2 33 TYR 33 33 33 TYR TYR B . n +B 2 34 ILE 34 34 34 ILE ILE B . n +B 2 35 HIS 35 35 35 HIS HIS B . n +B 2 36 TRP 36 36 36 TRP TRP B . n +B 2 37 VAL 37 37 37 VAL VAL B . n +B 2 38 ARG 38 38 38 ARG ARG B . n +B 2 39 GLN 39 39 39 GLN GLN B . n +B 2 40 ALA 40 40 40 ALA ALA B . n +B 2 41 PRO 41 41 41 PRO PRO B . n +B 2 42 GLY 42 42 42 GLY GLY B . n +B 2 43 LYS 43 43 43 LYS LYS B . n +B 2 44 GLY 44 44 44 GLY GLY B . n +B 2 45 LEU 45 45 45 LEU LEU B . n +B 2 46 GLU 46 46 46 GLU GLU B . n +B 2 47 TRP 47 47 47 TRP TRP B . n +B 2 48 VAL 48 48 48 VAL VAL B . n +B 2 49 ALA 49 49 49 ALA ALA B . n +B 2 50 ARG 50 50 50 ARG ARG B . n +B 2 51 ILE 51 51 51 ILE ILE B . n +B 2 52 TYR 52 52 52 TYR TYR B . n +B 2 53 PRO 53 53 53 PRO PRO B . n +B 2 54 THR 54 54 54 THR THR B . n +B 2 55 ASN 55 55 55 ASN ASN B . n +B 2 56 GLY 56 56 56 GLY GLY B . n +B 2 57 TYR 57 57 57 TYR TYR B . n +B 2 58 THR 58 58 58 THR THR B . n +B 2 59 ARG 59 59 59 ARG ARG B . n +B 2 60 TYR 60 60 60 TYR TYR B . n +B 2 61 ALA 61 61 61 ALA ALA B . n +B 2 62 ASP 62 62 62 ASP ASP B . n +B 2 63 SER 63 63 63 SER SER B . n +B 2 64 VAL 64 64 64 VAL VAL B . n +B 2 65 LYS 65 65 65 LYS LYS B . n +B 2 66 GLY 66 66 66 GLY GLY B . n +B 2 67 ARG 67 67 67 ARG ARG B . n +B 2 68 PHE 68 68 68 PHE PHE B . n +B 2 69 THR 69 69 69 THR THR B . n +B 2 70 ILE 70 70 70 ILE ILE B . n +B 2 71 SER 71 71 71 SER SER B . n +B 2 72 ALA 72 72 72 ALA ALA B . n +B 2 73 ASP 73 73 73 ASP ASP B . n +B 2 74 THR 74 74 74 THR THR B . n +B 2 75 SER 75 75 75 SER SER B . n +B 2 76 LYS 76 76 76 LYS LYS B . n +B 2 77 ASN 77 77 77 ASN ASN B . n +B 2 78 THR 78 78 78 THR THR B . n +B 2 79 ALA 79 79 79 ALA ALA B . n +B 2 80 TYR 80 80 80 TYR TYR B . n +B 2 81 LEU 81 81 81 LEU LEU B . n +B 2 82 GLN 82 82 82 GLN GLN B . n +B 2 83 MET 83 83 83 MET MET B . n +B 2 84 ASN 84 84 84 ASN ASN B . n +B 2 85 SER 85 85 85 SER SER B . n +B 2 86 LEU 86 86 86 LEU LEU B . n +B 2 87 ARG 87 87 87 ARG ARG B . n +B 2 88 ALA 88 88 88 ALA ALA B . n +B 2 89 GLU 89 89 89 GLU GLU B . n +B 2 90 ASP 90 90 90 ASP ASP B . n +B 2 91 THR 91 91 91 THR THR B . n +B 2 92 ALA 92 92 92 ALA ALA B . n +B 2 93 VAL 93 93 93 VAL VAL B . n +B 2 94 TYR 94 94 94 TYR TYR B . n +B 2 95 TYR 95 95 95 TYR TYR B . n +B 2 96 CYS 96 96 96 CYS CYS B . n +B 2 97 SER 97 97 97 SER SER B . n +B 2 98 ARG 98 98 98 ARG ARG B . n +B 2 99 TRP 99 99 99 TRP TRP B . n +B 2 100 GLY 100 100 100 GLY GLY B . n +B 2 101 GLY 101 101 101 GLY GLY B . n +B 2 102 ASP 102 102 102 ASP ASP B . n +B 2 103 GLY 103 103 103 GLY GLY B . n +B 2 104 PHE 104 104 104 PHE PHE B . n +B 2 105 TYR 105 105 105 TYR TYR B . n +B 2 106 ALA 106 106 106 ALA ALA B . n +B 2 107 MET 107 107 107 MET MET B . n +B 2 108 ASP 108 108 108 ASP ASP B . n +B 2 109 TYR 109 109 109 TYR TYR B . n +B 2 110 TRP 110 110 110 TRP TRP B . n +B 2 111 GLY 111 111 111 GLY GLY B . n +B 2 112 GLN 112 112 112 GLN GLN B . n +B 2 113 GLY 113 113 113 GLY GLY B . n +B 2 114 THR 114 114 114 THR THR B . n +B 2 115 LEU 115 115 115 LEU LEU B . n +B 2 116 VAL 116 116 116 VAL VAL B . n +B 2 117 THR 117 117 117 THR THR B . n +B 2 118 VAL 118 118 118 VAL VAL B . n +B 2 119 SER 119 119 119 SER SER B . n +B 2 120 SER 120 120 120 SER SER B . n +B 2 121 ALA 121 121 121 ALA ALA B . n +B 2 122 SER 122 122 122 SER SER B . n +B 2 123 THR 123 123 123 THR THR B . n +B 2 124 LYS 124 124 124 LYS LYS B . n +B 2 125 GLY 125 125 125 GLY GLY B . n +B 2 126 PRO 126 126 126 PRO PRO B . n +B 2 127 SER 127 127 127 SER SER B . n +B 2 128 VAL 128 128 128 VAL VAL B . n +B 2 129 PHE 129 129 129 PHE PHE B . n +B 2 130 PRO 130 130 130 PRO PRO B . n +B 2 131 LEU 131 131 131 LEU LEU B . n +B 2 132 ALA 132 132 132 ALA ALA B . n +B 2 133 PRO 133 133 133 PRO PRO B . n +B 2 134 SER 134 134 134 SER SER B . n +B 2 135 SER 135 135 135 SER SER B . n +B 2 136 LYS 136 136 136 LYS LYS B . n +B 2 137 SER 137 137 137 SER SER B . n +B 2 138 THR 138 138 138 THR THR B . n +B 2 139 SER 139 139 139 SER SER B . n +B 2 140 GLY 140 140 140 GLY GLY B . n +B 2 141 GLY 141 141 141 GLY GLY B . n +B 2 142 THR 142 142 142 THR THR B . n +B 2 143 ALA 143 143 143 ALA ALA B . n +B 2 144 ALA 144 144 144 ALA ALA B . n +B 2 145 LEU 145 145 145 LEU LEU B . n +B 2 146 GLY 146 146 146 GLY GLY B . n +B 2 147 CYS 147 147 147 CYS CYS B . n +B 2 148 LEU 148 148 148 LEU LEU B . n +B 2 149 VAL 149 149 149 VAL VAL B . n +B 2 150 LYS 150 150 150 LYS LYS B . n +B 2 151 ASP 151 151 151 ASP ASP B . n +B 2 152 TYR 152 152 152 TYR TYR B . n +B 2 153 PHE 153 153 153 PHE PHE B . n +B 2 154 PRO 154 154 154 PRO PRO B . n +B 2 155 GLU 155 155 155 GLU GLU B . n +B 2 156 PRO 156 156 156 PRO PRO B . n +B 2 157 VAL 157 157 157 VAL VAL B . n +B 2 158 THR 158 158 158 THR THR B . n +B 2 159 VAL 159 159 159 VAL VAL B . n +B 2 160 SER 160 160 160 SER SER B . n +B 2 161 TRP 161 161 161 TRP TRP B . n +B 2 162 ASN 162 162 162 ASN ASN B . n +B 2 163 SER 163 163 163 SER SER B . n +B 2 164 GLY 164 164 164 GLY GLY B . n +B 2 165 ALA 165 165 165 ALA ALA B . n +B 2 166 LEU 166 166 166 LEU LEU B . n +B 2 167 THR 167 167 167 THR THR B . n +B 2 168 SER 168 168 168 SER SER B . n +B 2 169 GLY 169 169 169 GLY GLY B . n +B 2 170 VAL 170 170 170 VAL VAL B . n +B 2 171 HIS 171 171 171 HIS HIS B . n +B 2 172 THR 172 172 172 THR THR B . n +B 2 173 PHE 173 173 173 PHE PHE B . n +B 2 174 PRO 174 174 174 PRO PRO B . n +B 2 175 ALA 175 175 175 ALA ALA B . n +B 2 176 VAL 176 176 176 VAL VAL B . n +B 2 177 LEU 177 177 177 LEU LEU B . n +B 2 178 GLN 178 178 178 GLN GLN B . n +B 2 179 SER 179 179 179 SER SER B . n +B 2 180 SER 180 180 180 SER SER B . n +B 2 181 GLY 181 181 181 GLY GLY B . n +B 2 182 LEU 182 182 182 LEU LEU B . n +B 2 183 TYR 183 183 183 TYR TYR B . n +B 2 184 SER 184 184 184 SER SER B . n +B 2 185 LEU 185 185 185 LEU LEU B . n +B 2 186 SER 186 186 186 SER SER B . n +B 2 187 SER 187 187 187 SER SER B . n +B 2 188 VAL 188 188 188 VAL VAL B . n +B 2 189 VAL 189 189 189 VAL VAL B . n +B 2 190 THR 190 190 190 THR THR B . n +B 2 191 VAL 191 191 191 VAL VAL B . n +B 2 192 PRO 192 192 192 PRO PRO B . n +B 2 193 SER 193 193 193 SER SER B . n +B 2 194 SER 194 194 194 SER SER B . n +B 2 195 SER 195 195 195 SER SER B . n +B 2 196 LEU 196 196 196 LEU LEU B . n +B 2 197 GLY 197 197 197 GLY GLY B . n +B 2 198 THR 198 198 198 THR THR B . n +B 2 199 GLN 199 199 199 GLN GLN B . n +B 2 200 THR 200 200 200 THR THR B . n +B 2 201 TYR 201 201 201 TYR TYR B . n +B 2 202 ILE 202 202 202 ILE ILE B . n +B 2 203 CYS 203 203 203 CYS CYS B . n +B 2 204 ASN 204 204 204 ASN ASN B . n +B 2 205 VAL 205 205 205 VAL VAL B . n +B 2 206 ASN 206 206 206 ASN ASN B . n +B 2 207 HIS 207 207 207 HIS HIS B . n +B 2 208 LYS 208 208 208 LYS LYS B . n +B 2 209 PRO 209 209 209 PRO PRO B . n +B 2 210 SER 210 210 210 SER SER B . n +B 2 211 ASN 211 211 211 ASN ASN B . n +B 2 212 THR 212 212 212 THR THR B . n +B 2 213 LYS 213 213 213 LYS LYS B . n +B 2 214 VAL 214 214 214 VAL VAL B . n +B 2 215 ASP 215 215 215 ASP ASP B . n +B 2 216 LYS 216 216 216 LYS LYS B . n +B 2 217 LYS 217 217 217 LYS ALA B . n +B 2 218 VAL 218 218 218 VAL VAL B . n +B 2 219 GLU 219 219 219 GLU GLU B . n +B 2 220 PRO 220 220 220 PRO PRO B . n +C 3 1 THR 1 1 1 THR THR C . n +C 3 2 GLN 2 2 2 GLN GLN C . n +C 3 3 VAL 3 3 3 VAL VAL C . n +C 3 4 CYS 4 4 4 CYS CYS C . n +C 3 5 THR 5 5 5 THR THR C . n +C 3 6 GLY 6 6 6 GLY GLY C . n +C 3 7 THR 7 7 7 THR THR C . n +C 3 8 ASP 8 8 8 ASP ASP C . n +C 3 9 MET 9 9 9 MET MET C . n +C 3 10 LYS 10 10 10 LYS LYS C . n +C 3 11 LEU 11 11 11 LEU LEU C . n +C 3 12 ARG 12 12 12 ARG ARG C . n +C 3 13 LEU 13 13 13 LEU LEU C . n +C 3 14 PRO 14 14 14 PRO PRO C . n +C 3 15 ALA 15 15 15 ALA ALA C . n +C 3 16 SER 16 16 16 SER SER C . n +C 3 17 PRO 17 17 17 PRO PRO C . n +C 3 18 GLU 18 18 18 GLU GLU C . n +C 3 19 THR 19 19 19 THR THR C . n +C 3 20 HIS 20 20 20 HIS HIS C . n +C 3 21 LEU 21 21 21 LEU LEU C . n +C 3 22 ASP 22 22 22 ASP ASP C . n +C 3 23 MET 23 23 23 MET MET C . n +C 3 24 LEU 24 24 24 LEU LEU C . n +C 3 25 ARG 25 25 25 ARG ARG C . n +C 3 26 HIS 26 26 26 HIS HIS C . n +C 3 27 LEU 27 27 27 LEU LEU C . n +C 3 28 TYR 28 28 28 TYR TYR C . n +C 3 29 GLN 29 29 29 GLN GLN C . n +C 3 30 GLY 30 30 30 GLY GLY C . n +C 3 31 CYS 31 31 31 CYS CYS C . n +C 3 32 GLN 32 32 32 GLN GLN C . n +C 3 33 VAL 33 33 33 VAL VAL C . n +C 3 34 VAL 34 34 34 VAL VAL C . n +C 3 35 GLN 35 35 35 GLN GLN C . n +C 3 36 GLY 36 36 36 GLY GLY C . n +C 3 37 ASN 37 37 37 ASN ASN C . n +C 3 38 LEU 38 38 38 LEU LEU C . n +C 3 39 GLU 39 39 39 GLU GLU C . n +C 3 40 LEU 40 40 40 LEU LEU C . n +C 3 41 THR 41 41 41 THR THR C . n +C 3 42 TYR 42 42 42 TYR TYR C . n +C 3 43 LEU 43 43 43 LEU LEU C . n +C 3 44 PRO 44 44 44 PRO PRO C . n +C 3 45 THR 45 45 45 THR THR C . n +C 3 46 ASN 46 46 46 ASN ASN C . n +C 3 47 ALA 47 47 47 ALA ALA C . n +C 3 48 SER 48 48 48 SER SER C . n +C 3 49 LEU 49 49 49 LEU LEU C . n +C 3 50 SER 50 50 50 SER SER C . n +C 3 51 PHE 51 51 51 PHE PHE C . n +C 3 52 LEU 52 52 52 LEU LEU C . n +C 3 53 GLN 53 53 53 GLN GLN C . n +C 3 54 ASP 54 54 54 ASP ASP C . n +C 3 55 ILE 55 55 55 ILE ILE C . n +C 3 56 GLN 56 56 56 GLN GLN C . n +C 3 57 GLU 57 57 57 GLU GLU C . n +C 3 58 VAL 58 58 58 VAL VAL C . n +C 3 59 GLN 59 59 59 GLN GLN C . n +C 3 60 GLY 60 60 60 GLY GLY C . n +C 3 61 TYR 61 61 61 TYR TYR C . n +C 3 62 VAL 62 62 62 VAL VAL C . n +C 3 63 LEU 63 63 63 LEU LEU C . n +C 3 64 ILE 64 64 64 ILE ILE C . n +C 3 65 ALA 65 65 65 ALA ALA C . n +C 3 66 HIS 66 66 66 HIS HIS C . n +C 3 67 ASN 67 67 67 ASN ASN C . n +C 3 68 GLN 68 68 68 GLN GLN C . n +C 3 69 VAL 69 69 69 VAL VAL C . n +C 3 70 ARG 70 70 70 ARG ARG C . n +C 3 71 GLN 71 71 71 GLN GLN C . n +C 3 72 VAL 72 72 72 VAL VAL C . n +C 3 73 PRO 73 73 73 PRO PRO C . n +C 3 74 LEU 74 74 74 LEU LEU C . n +C 3 75 GLN 75 75 75 GLN GLN C . n +C 3 76 ARG 76 76 76 ARG ARG C . n +C 3 77 LEU 77 77 77 LEU LEU C . n +C 3 78 ARG 78 78 78 ARG ARG C . n +C 3 79 ILE 79 79 79 ILE ILE C . n +C 3 80 VAL 80 80 80 VAL VAL C . n +C 3 81 ARG 81 81 81 ARG ARG C . n +C 3 82 GLY 82 82 82 GLY GLY C . n +C 3 83 THR 83 83 83 THR THR C . n +C 3 84 GLN 84 84 84 GLN GLN C . n +C 3 85 LEU 85 85 85 LEU LEU C . n +C 3 86 PHE 86 86 86 PHE PHE C . n +C 3 87 GLU 87 87 87 GLU GLU C . n +C 3 88 ASP 88 88 88 ASP ASP C . n +C 3 89 ASN 89 89 89 ASN ASN C . n +C 3 90 TYR 90 90 90 TYR TYR C . n +C 3 91 ALA 91 91 91 ALA ALA C . n +C 3 92 LEU 92 92 92 LEU LEU C . n +C 3 93 ALA 93 93 93 ALA ALA C . n +C 3 94 VAL 94 94 94 VAL VAL C . n +C 3 95 LEU 95 95 95 LEU LEU C . n +C 3 96 ASP 96 96 96 ASP ASP C . n +C 3 97 ASN 97 97 97 ASN ASN C . n +C 3 98 GLY 98 98 98 GLY GLY C . n +C 3 99 ASP 99 99 99 ASP ASP C . n +C 3 100 PRO 100 100 100 PRO PRO C . n +C 3 101 LEU 101 101 101 LEU LEU C . n +C 3 102 ASN 102 102 ? ? ? C . n +C 3 103 ASN 103 103 ? ? ? C . n +C 3 104 THR 104 104 ? ? ? C . n +C 3 105 THR 105 105 ? ? ? C . n +C 3 106 PRO 106 106 ? ? ? C . n +C 3 107 VAL 107 107 ? ? ? C . n +C 3 108 THR 108 108 ? ? ? C . n +C 3 109 GLY 109 109 ? ? ? C . n +C 3 110 ALA 110 110 ? ? ? C . n +C 3 111 SER 111 111 111 SER SER C . n +C 3 112 PRO 112 112 112 PRO PRO C . n +C 3 113 GLY 113 113 113 GLY GLY C . n +C 3 114 GLY 114 114 114 GLY GLY C . n +C 3 115 LEU 115 115 115 LEU LEU C . n +C 3 116 ARG 116 116 116 ARG ARG C . n +C 3 117 GLU 117 117 117 GLU GLU C . n +C 3 118 LEU 118 118 118 LEU LEU C . n +C 3 119 GLN 119 119 119 GLN GLN C . n +C 3 120 LEU 120 120 120 LEU LEU C . n +C 3 121 ARG 121 121 121 ARG ARG C . n +C 3 122 SER 122 122 122 SER SER C . n +C 3 123 LEU 123 123 123 LEU LEU C . n +C 3 124 THR 124 124 124 THR THR C . n +C 3 125 GLU 125 125 125 GLU GLU C . n +C 3 126 ILE 126 126 126 ILE ILE C . n +C 3 127 LEU 127 127 127 LEU LEU C . n +C 3 128 LYS 128 128 128 LYS LYS C . n +C 3 129 GLY 129 129 129 GLY GLY C . n +C 3 130 GLY 130 130 130 GLY GLY C . n +C 3 131 VAL 131 131 131 VAL VAL C . n +C 3 132 LEU 132 132 132 LEU LEU C . n +C 3 133 ILE 133 133 133 ILE ILE C . n +C 3 134 GLN 134 134 134 GLN GLN C . n +C 3 135 ARG 135 135 135 ARG ARG C . n +C 3 136 ASN 136 136 136 ASN ASN C . n +C 3 137 PRO 137 137 137 PRO PRO C . n +C 3 138 GLN 138 138 138 GLN GLN C . n +C 3 139 LEU 139 139 139 LEU LEU C . n +C 3 140 CYS 140 140 140 CYS CYS C . n +C 3 141 TYR 141 141 141 TYR TYR C . n +C 3 142 GLN 142 142 142 GLN GLN C . n +C 3 143 ASP 143 143 143 ASP ASP C . n +C 3 144 THR 144 144 144 THR THR C . n +C 3 145 ILE 145 145 145 ILE ILE C . n +C 3 146 LEU 146 146 146 LEU LEU C . n +C 3 147 TRP 147 147 147 TRP TRP C . n +C 3 148 LYS 148 148 148 LYS LYS C . n +C 3 149 ASP 149 149 149 ASP ASP C . n +C 3 150 ILE 150 150 150 ILE ILE C . n +C 3 151 PHE 151 151 151 PHE PHE C . n +C 3 152 HIS 152 152 152 HIS HIS C . n +C 3 153 LYS 153 153 153 LYS LYS C . n +C 3 154 ASN 154 154 154 ASN ASN C . n +C 3 155 ASN 155 155 155 ASN ASN C . n +C 3 156 GLN 156 156 156 GLN GLN C . n +C 3 157 LEU 157 157 157 LEU LEU C . n +C 3 158 ALA 158 158 158 ALA ALA C . n +C 3 159 LEU 159 159 159 LEU LEU C . n +C 3 160 THR 160 160 160 THR THR C . n +C 3 161 LEU 161 161 161 LEU LEU C . n +C 3 162 ILE 162 162 162 ILE ILE C . n +C 3 163 ASP 163 163 163 ASP ASP C . n +C 3 164 THR 164 164 164 THR THR C . n +C 3 165 ASN 165 165 165 ASN ASN C . n +C 3 166 ARG 166 166 166 ARG ARG C . n +C 3 167 SER 167 167 167 SER SER C . n +C 3 168 ARG 168 168 168 ARG ARG C . n +C 3 169 ALA 169 169 169 ALA ALA C . n +C 3 170 CYS 170 170 170 CYS CYS C . n +C 3 171 HIS 171 171 171 HIS HIS C . n +C 3 172 PRO 172 172 172 PRO PRO C . n +C 3 173 CYS 173 173 173 CYS CYS C . n +C 3 174 SER 174 174 174 SER SER C . n +C 3 175 PRO 175 175 175 PRO PRO C . n +C 3 176 MET 176 176 176 MET MET C . n +C 3 177 CYS 177 177 177 CYS CYS C . n +C 3 178 LYS 178 178 178 LYS LYS C . n +C 3 179 GLY 179 179 179 GLY GLY C . n +C 3 180 SER 180 180 180 SER SER C . n +C 3 181 ARG 181 181 181 ARG ARG C . n +C 3 182 CYS 182 182 182 CYS CYS C . n +C 3 183 TRP 183 183 183 TRP TRP C . n +C 3 184 GLY 184 184 184 GLY GLY C . n +C 3 185 GLU 185 185 185 GLU GLU C . n +C 3 186 SER 186 186 186 SER SER C . n +C 3 187 SER 187 187 187 SER SER C . n +C 3 188 GLU 188 188 188 GLU GLU C . n +C 3 189 ASP 189 189 189 ASP ASP C . n +C 3 190 CYS 190 190 190 CYS CYS C . n +C 3 191 GLN 191 191 191 GLN GLN C . n +C 3 192 SER 192 192 192 SER SER C . n +C 3 193 LEU 193 193 193 LEU LEU C . n +C 3 194 THR 194 194 194 THR THR C . n +C 3 195 ARG 195 195 195 ARG ARG C . n +C 3 196 THR 196 196 196 THR THR C . n +C 3 197 VAL 197 197 197 VAL VAL C . n +C 3 198 CYS 198 198 198 CYS CYS C . n +C 3 199 ALA 199 199 199 ALA ALA C . n +C 3 200 GLY 200 200 200 GLY GLY C . n +C 3 201 GLY 201 201 201 GLY GLY C . n +C 3 202 CYS 202 202 202 CYS CYS C . n +C 3 203 ALA 203 203 203 ALA ALA C . n +C 3 204 ARG 204 204 204 ARG ARG C . n +C 3 205 CYS 205 205 205 CYS CYS C . n +C 3 206 LYS 206 206 206 LYS LYS C . n +C 3 207 GLY 207 207 207 GLY GLY C . n +C 3 208 PRO 208 208 208 PRO PRO C . n +C 3 209 LEU 209 209 209 LEU LEU C . n +C 3 210 PRO 210 210 210 PRO PRO C . n +C 3 211 THR 211 211 211 THR THR C . n +C 3 212 ASP 212 212 212 ASP ASP C . n +C 3 213 CYS 213 213 213 CYS CYS C . n +C 3 214 CYS 214 214 214 CYS CYS C . n +C 3 215 HIS 215 215 215 HIS HIS C . n +C 3 216 GLU 216 216 216 GLU GLU C . n +C 3 217 GLN 217 217 217 GLN GLN C . n +C 3 218 CYS 218 218 218 CYS CYS C . n +C 3 219 ALA 219 219 219 ALA ALA C . n +C 3 220 ALA 220 220 220 ALA ALA C . n +C 3 221 GLY 221 221 221 GLY GLY C . n +C 3 222 CYS 222 222 222 CYS CYS C . n +C 3 223 THR 223 223 223 THR THR C . n +C 3 224 GLY 224 224 224 GLY GLY C . n +C 3 225 PRO 225 225 225 PRO PRO C . n +C 3 226 LYS 226 226 226 LYS LYS C . n +C 3 227 HIS 227 227 227 HIS HIS C . n +C 3 228 SER 228 228 228 SER SER C . n +C 3 229 ASP 229 229 229 ASP ASP C . n +C 3 230 CYS 230 230 230 CYS CYS C . n +C 3 231 LEU 231 231 231 LEU LEU C . n +C 3 232 ALA 232 232 232 ALA ALA C . n +C 3 233 CYS 233 233 233 CYS CYS C . n +C 3 234 LEU 234 234 234 LEU LEU C . n +C 3 235 HIS 235 235 235 HIS HIS C . n +C 3 236 PHE 236 236 236 PHE PHE C . n +C 3 237 ASN 237 237 237 ASN ASN C . n +C 3 238 HIS 238 238 238 HIS HIS C . n +C 3 239 SER 239 239 239 SER SER C . n +C 3 240 GLY 240 240 240 GLY GLY C . n +C 3 241 ILE 241 241 241 ILE ILE C . n +C 3 242 CYS 242 242 242 CYS CYS C . n +C 3 243 GLU 243 243 243 GLU GLU C . n +C 3 244 LEU 244 244 244 LEU LEU C . n +C 3 245 HIS 245 245 245 HIS HIS C . n +C 3 246 CYS 246 246 246 CYS CYS C . n +C 3 247 PRO 247 247 247 PRO PRO C . n +C 3 248 ALA 248 248 248 ALA ALA C . n +C 3 249 LEU 249 249 249 LEU LEU C . n +C 3 250 VAL 250 250 250 VAL VAL C . n +C 3 251 THR 251 251 251 THR THR C . n +C 3 252 TYR 252 252 252 TYR TYR C . n +C 3 253 ASN 253 253 253 ASN ASN C . n +C 3 254 THR 254 254 254 THR THR C . n +C 3 255 ASP 255 255 255 ASP ASP C . n +C 3 256 THR 256 256 256 THR THR C . n +C 3 257 PHE 257 257 257 PHE PHE C . n +C 3 258 GLU 258 258 258 GLU GLU C . n +C 3 259 SER 259 259 259 SER SER C . n +C 3 260 MET 260 260 260 MET MET C . n +C 3 261 PRO 261 261 261 PRO PRO C . n +C 3 262 ASN 262 262 262 ASN ASN C . n +C 3 263 PRO 263 263 263 PRO PRO C . n +C 3 264 GLU 264 264 264 GLU GLU C . n +C 3 265 GLY 265 265 265 GLY GLY C . n +C 3 266 ARG 266 266 266 ARG ARG C . n +C 3 267 TYR 267 267 267 TYR TYR C . n +C 3 268 THR 268 268 268 THR THR C . n +C 3 269 PHE 269 269 269 PHE PHE C . n +C 3 270 GLY 270 270 270 GLY GLY C . n +C 3 271 ALA 271 271 271 ALA ALA C . n +C 3 272 SER 272 272 272 SER SER C . n +C 3 273 CYS 273 273 273 CYS CYS C . n +C 3 274 VAL 274 274 274 VAL VAL C . n +C 3 275 THR 275 275 275 THR THR C . n +C 3 276 ALA 276 276 276 ALA ALA C . n +C 3 277 CYS 277 277 277 CYS CYS C . n +C 3 278 PRO 278 278 278 PRO PRO C . n +C 3 279 TYR 279 279 279 TYR TYR C . n +C 3 280 ASN 280 280 280 ASN ASN C . n +C 3 281 TYR 281 281 281 TYR TYR C . n +C 3 282 LEU 282 282 282 LEU LEU C . n +C 3 283 SER 283 283 283 SER SER C . n +C 3 284 THR 284 284 284 THR THR C . n +C 3 285 ASP 285 285 285 ASP ASP C . n +C 3 286 VAL 286 286 286 VAL VAL C . n +C 3 287 GLY 287 287 287 GLY GLY C . n +C 3 288 SER 288 288 288 SER SER C . n +C 3 289 CYS 289 289 289 CYS CYS C . n +C 3 290 THR 290 290 290 THR THR C . n +C 3 291 LEU 291 291 291 LEU LEU C . n +C 3 292 VAL 292 292 292 VAL VAL C . n +C 3 293 CYS 293 293 293 CYS CYS C . n +C 3 294 PRO 294 294 294 PRO PRO C . n +C 3 295 LEU 295 295 295 LEU LEU C . n +C 3 296 HIS 296 296 296 HIS HIS C . n +C 3 297 ASN 297 297 297 ASN ASN C . n +C 3 298 GLN 298 298 298 GLN GLN C . n +C 3 299 GLU 299 299 299 GLU GLU C . n +C 3 300 VAL 300 300 300 VAL VAL C . n +C 3 301 THR 301 301 301 THR THR C . n +C 3 302 ALA 302 302 302 ALA ALA C . n +C 3 303 GLU 303 303 ? ? ? C . n +C 3 304 ASP 304 304 ? ? ? C . n +C 3 305 GLY 305 305 ? ? ? C . n +C 3 306 THR 306 306 306 THR THR C . n +C 3 307 GLN 307 307 307 GLN GLN C . n +C 3 308 ARG 308 308 308 ARG ARG C . n +C 3 309 CYS 309 309 309 CYS CYS C . n +C 3 310 GLU 310 310 310 GLU GLU C . n +C 3 311 LYS 311 311 311 LYS LYS C . n +C 3 312 CYS 312 312 312 CYS CYS C . n +C 3 313 SER 313 313 313 SER SER C . n +C 3 314 LYS 314 314 314 LYS LYS C . n +C 3 315 PRO 315 315 315 PRO PRO C . n +C 3 316 CYS 316 316 316 CYS CYS C . n +C 3 317 ALA 317 317 317 ALA ALA C . n +C 3 318 ARG 318 318 318 ARG ARG C . n +C 3 319 VAL 319 319 319 VAL VAL C . n +C 3 320 CYS 320 320 320 CYS CYS C . n +C 3 321 TYR 321 321 321 TYR TYR C . n +C 3 322 GLY 322 322 322 GLY GLY C . n +C 3 323 LEU 323 323 323 LEU LEU C . n +C 3 324 GLY 324 324 324 GLY GLY C . n +C 3 325 MET 325 325 325 MET MET C . n +C 3 326 GLU 326 326 326 GLU GLU C . n +C 3 327 HIS 327 327 327 HIS HIS C . n +C 3 328 LEU 328 328 328 LEU LEU C . n +C 3 329 ARG 329 329 329 ARG ARG C . n +C 3 330 GLU 330 330 330 GLU GLU C . n +C 3 331 VAL 331 331 331 VAL VAL C . n +C 3 332 ARG 332 332 332 ARG ARG C . n +C 3 333 ALA 333 333 333 ALA ALA C . n +C 3 334 VAL 334 334 334 VAL VAL C . n +C 3 335 THR 335 335 335 THR THR C . n +C 3 336 SER 336 336 336 SER SER C . n +C 3 337 ALA 337 337 337 ALA ALA C . n +C 3 338 ASN 338 338 338 ASN ASN C . n +C 3 339 ILE 339 339 339 ILE ILE C . n +C 3 340 GLN 340 340 340 GLN GLN C . n +C 3 341 GLU 341 341 341 GLU GLU C . n +C 3 342 PHE 342 342 342 PHE PHE C . n +C 3 343 ALA 343 343 343 ALA ALA C . n +C 3 344 GLY 344 344 344 GLY GLY C . n +C 3 345 CYS 345 345 345 CYS CYS C . n +C 3 346 LYS 346 346 346 LYS LYS C . n +C 3 347 LYS 347 347 347 LYS LYS C . n +C 3 348 ILE 348 348 348 ILE ILE C . n +C 3 349 PHE 349 349 349 PHE PHE C . n +C 3 350 GLY 350 350 350 GLY GLY C . n +C 3 351 SER 351 351 351 SER SER C . n +C 3 352 LEU 352 352 352 LEU LEU C . n +C 3 353 ALA 353 353 353 ALA ALA C . n +C 3 354 PHE 354 354 354 PHE PHE C . n +C 3 355 LEU 355 355 355 LEU LEU C . n +C 3 356 PRO 356 356 356 PRO PRO C . n +C 3 357 GLU 357 357 357 GLU GLU C . n +C 3 358 SER 358 358 358 SER SER C . n +C 3 359 PHE 359 359 359 PHE PHE C . n +C 3 360 ASP 360 360 360 ASP ASP C . n +C 3 361 GLY 361 361 ? ? ? C . n +C 3 362 ASP 362 362 ? ? ? C . n +C 3 363 PRO 363 363 ? ? ? C . n +C 3 364 ALA 364 364 ? ? ? C . n +C 3 365 SER 365 365 365 SER SER C . n +C 3 366 ASN 366 366 366 ASN ASN C . n +C 3 367 THR 367 367 367 THR THR C . n +C 3 368 ALA 368 368 368 ALA ALA C . n +C 3 369 PRO 369 369 369 PRO PRO C . n +C 3 370 LEU 370 370 370 LEU LEU C . n +C 3 371 GLN 371 371 371 GLN GLN C . n +C 3 372 PRO 372 372 372 PRO PRO C . n +C 3 373 GLU 373 373 373 GLU GLU C . n +C 3 374 GLN 374 374 374 GLN GLN C . n +C 3 375 LEU 375 375 375 LEU LEU C . n +C 3 376 GLN 376 376 376 GLN GLN C . n +C 3 377 VAL 377 377 377 VAL VAL C . n +C 3 378 PHE 378 378 378 PHE PHE C . n +C 3 379 GLU 379 379 379 GLU GLU C . n +C 3 380 THR 380 380 380 THR THR C . n +C 3 381 LEU 381 381 381 LEU LEU C . n +C 3 382 GLU 382 382 382 GLU GLU C . n +C 3 383 GLU 383 383 383 GLU GLU C . n +C 3 384 ILE 384 384 384 ILE ILE C . n +C 3 385 THR 385 385 385 THR THR C . n +C 3 386 GLY 386 386 386 GLY GLY C . n +C 3 387 TYR 387 387 387 TYR TYR C . n +C 3 388 LEU 388 388 388 LEU LEU C . n +C 3 389 TYR 389 389 389 TYR TYR C . n +C 3 390 ILE 390 390 390 ILE ILE C . n +C 3 391 SER 391 391 391 SER SER C . n +C 3 392 ALA 392 392 392 ALA ALA C . n +C 3 393 TRP 393 393 393 TRP TRP C . n +C 3 394 PRO 394 394 394 PRO PRO C . n +C 3 395 ASP 395 395 395 ASP ASP C . n +C 3 396 SER 396 396 396 SER SER C . n +C 3 397 LEU 397 397 397 LEU LEU C . n +C 3 398 PRO 398 398 398 PRO PRO C . n +C 3 399 ASP 399 399 399 ASP ASP C . n +C 3 400 LEU 400 400 400 LEU LEU C . n +C 3 401 SER 401 401 401 SER SER C . n +C 3 402 VAL 402 402 402 VAL VAL C . n +C 3 403 PHE 403 403 403 PHE PHE C . n +C 3 404 GLN 404 404 404 GLN GLN C . n +C 3 405 ASN 405 405 405 ASN ASN C . n +C 3 406 LEU 406 406 406 LEU LEU C . n +C 3 407 GLN 407 407 407 GLN GLN C . n +C 3 408 VAL 408 408 408 VAL VAL C . n +C 3 409 ILE 409 409 409 ILE ILE C . n +C 3 410 ARG 410 410 410 ARG ARG C . n +C 3 411 GLY 411 411 411 GLY GLY C . n +C 3 412 ARG 412 412 412 ARG ARG C . n +C 3 413 ILE 413 413 413 ILE ILE C . n +C 3 414 LEU 414 414 414 LEU LEU C . n +C 3 415 HIS 415 415 415 HIS HIS C . n +C 3 416 ASN 416 416 416 ASN ASN C . n +C 3 417 GLY 417 417 417 GLY GLY C . n +C 3 418 ALA 418 418 418 ALA ALA C . n +C 3 419 TYR 419 419 419 TYR TYR C . n +C 3 420 SER 420 420 420 SER SER C . n +C 3 421 LEU 421 421 421 LEU LEU C . n +C 3 422 THR 422 422 422 THR THR C . n +C 3 423 LEU 423 423 423 LEU LEU C . n +C 3 424 GLN 424 424 424 GLN GLN C . n +C 3 425 GLY 425 425 425 GLY GLY C . n +C 3 426 LEU 426 426 426 LEU LEU C . n +C 3 427 GLY 427 427 427 GLY GLY C . n +C 3 428 ILE 428 428 428 ILE ILE C . n +C 3 429 SER 429 429 429 SER SER C . n +C 3 430 TRP 430 430 430 TRP TRP C . n +C 3 431 LEU 431 431 431 LEU LEU C . n +C 3 432 GLY 432 432 432 GLY GLY C . n +C 3 433 LEU 433 433 433 LEU LEU C . n +C 3 434 ARG 434 434 434 ARG ARG C . n +C 3 435 SER 435 435 435 SER SER C . n +C 3 436 LEU 436 436 436 LEU LEU C . n +C 3 437 ARG 437 437 437 ARG ARG C . n +C 3 438 GLU 438 438 438 GLU GLU C . n +C 3 439 LEU 439 439 439 LEU LEU C . n +C 3 440 GLY 440 440 440 GLY GLY C . n +C 3 441 SER 441 441 441 SER SER C . n +C 3 442 GLY 442 442 442 GLY GLY C . n +C 3 443 LEU 443 443 443 LEU LEU C . n +C 3 444 ALA 444 444 444 ALA ALA C . n +C 3 445 LEU 445 445 445 LEU LEU C . n +C 3 446 ILE 446 446 446 ILE ILE C . n +C 3 447 HIS 447 447 447 HIS HIS C . n +C 3 448 HIS 448 448 448 HIS HIS C . n +C 3 449 ASN 449 449 449 ASN ASN C . n +C 3 450 THR 450 450 450 THR THR C . n +C 3 451 HIS 451 451 451 HIS HIS C . n +C 3 452 LEU 452 452 452 LEU LEU C . n +C 3 453 CYS 453 453 453 CYS CYS C . n +C 3 454 PHE 454 454 454 PHE PHE C . n +C 3 455 VAL 455 455 455 VAL VAL C . n +C 3 456 HIS 456 456 456 HIS HIS C . n +C 3 457 THR 457 457 457 THR THR C . n +C 3 458 VAL 458 458 458 VAL VAL C . n +C 3 459 PRO 459 459 459 PRO PRO C . n +C 3 460 TRP 460 460 460 TRP TRP C . n +C 3 461 ASP 461 461 461 ASP ASP C . n +C 3 462 GLN 462 462 462 GLN GLN C . n +C 3 463 LEU 463 463 463 LEU LEU C . n +C 3 464 PHE 464 464 464 PHE PHE C . n +C 3 465 ARG 465 465 465 ARG ARG C . n +C 3 466 ASN 466 466 466 ASN ASN C . n +C 3 467 PRO 467 467 467 PRO PRO C . n +C 3 468 HIS 468 468 468 HIS HIS C . n +C 3 469 GLN 469 469 469 GLN GLN C . n +C 3 470 ALA 470 470 470 ALA ALA C . n +C 3 471 LEU 471 471 471 LEU LEU C . n +C 3 472 LEU 472 472 472 LEU LEU C . n +C 3 473 HIS 473 473 473 HIS HIS C . n +C 3 474 THR 474 474 474 THR THR C . n +C 3 475 ALA 475 475 475 ALA ALA C . n +C 3 476 ASN 476 476 476 ASN ASN C . n +C 3 477 ARG 477 477 477 ARG ARG C . n +C 3 478 PRO 478 478 478 PRO PRO C . n +C 3 479 GLU 479 479 479 GLU GLU C . n +C 3 480 ASP 480 480 480 ASP ASP C . n +C 3 481 GLU 481 481 481 GLU GLU C . n +C 3 482 CYS 482 482 482 CYS CYS C . n +C 3 483 VAL 483 483 483 VAL VAL C . n +C 3 484 GLY 484 484 484 GLY GLY C . n +C 3 485 GLU 485 485 485 GLU GLU C . n +C 3 486 GLY 486 486 486 GLY GLY C . n +C 3 487 LEU 487 487 487 LEU LEU C . n +C 3 488 ALA 488 488 488 ALA ALA C . n +C 3 489 CYS 489 489 489 CYS CYS C . n +C 3 490 HIS 490 490 490 HIS HIS C . n +C 3 491 GLN 491 491 491 GLN GLN C . n +C 3 492 LEU 492 492 492 LEU LEU C . n +C 3 493 CYS 493 493 493 CYS CYS C . n +C 3 494 ALA 494 494 494 ALA ALA C . n +C 3 495 ARG 495 495 495 ARG ARG C . n +C 3 496 GLY 496 496 496 GLY GLY C . n +C 3 497 HIS 497 497 497 HIS HIS C . n +C 3 498 CYS 498 498 498 CYS CYS C . n +C 3 499 TRP 499 499 499 TRP TRP C . n +C 3 500 GLY 500 500 500 GLY GLY C . n +C 3 501 PRO 501 501 501 PRO PRO C . n +C 3 502 GLY 502 502 502 GLY GLY C . n +C 3 503 PRO 503 503 503 PRO PRO C . n +C 3 504 THR 504 504 504 THR THR C . n +C 3 505 GLN 505 505 505 GLN GLN C . n +C 3 506 CYS 506 506 506 CYS CYS C . n +C 3 507 VAL 507 507 507 VAL VAL C . n +C 3 508 ASN 508 508 508 ASN ASN C . n +C 3 509 CYS 509 509 509 CYS CYS C . n +C 3 510 SER 510 510 510 SER SER C . n +C 3 511 GLN 511 511 511 GLN GLN C . n +C 3 512 PHE 512 512 512 PHE PHE C . n +C 3 513 LEU 513 513 513 LEU LEU C . n +C 3 514 ARG 514 514 514 ARG ARG C . n +C 3 515 GLY 515 515 515 GLY GLY C . n +C 3 516 GLN 516 516 516 GLN GLN C . n +C 3 517 GLU 517 517 517 GLU GLU C . n +C 3 518 CYS 518 518 518 CYS CYS C . n +C 3 519 VAL 519 519 519 VAL VAL C . n +C 3 520 GLU 520 520 520 GLU GLU C . n +C 3 521 GLU 521 521 521 GLU GLU C . n +C 3 522 CYS 522 522 522 CYS CYS C . n +C 3 523 ARG 523 523 523 ARG ARG C . n +C 3 524 VAL 524 524 524 VAL VAL C . n +C 3 525 LEU 525 525 525 LEU LEU C . n +C 3 526 GLN 526 526 526 GLN GLN C . n +C 3 527 GLY 527 527 527 GLY GLY C . n +C 3 528 LEU 528 528 528 LEU LEU C . n +C 3 529 PRO 529 529 529 PRO PRO C . n +C 3 530 ARG 530 530 530 ARG ARG C . n +C 3 531 GLU 531 531 531 GLU GLU C . n +C 3 532 TYR 532 532 532 TYR TYR C . n +C 3 533 VAL 533 533 533 VAL VAL C . n +C 3 534 ASN 534 534 534 ASN ASN C . n +C 3 535 ALA 535 535 535 ALA ALA C . n +C 3 536 ARG 536 536 536 ARG ARG C . n +C 3 537 HIS 537 537 537 HIS HIS C . n +C 3 538 CYS 538 538 538 CYS CYS C . n +C 3 539 LEU 539 539 539 LEU LEU C . n +C 3 540 PRO 540 540 540 PRO PRO C . n +C 3 541 CYS 541 541 541 CYS CYS C . n +C 3 542 HIS 542 542 542 HIS HIS C . n +C 3 543 PRO 543 543 543 PRO PRO C . n +C 3 544 GLU 544 544 544 GLU GLU C . n +C 3 545 CYS 545 545 545 CYS CYS C . n +C 3 546 GLN 546 546 546 GLN GLN C . n +C 3 547 PRO 547 547 547 PRO PRO C . n +C 3 548 GLN 548 548 548 GLN GLN C . n +C 3 549 ASN 549 549 549 ASN ASN C . n +C 3 550 GLY 550 550 550 GLY GLY C . n +C 3 551 SER 551 551 551 SER SER C . n +C 3 552 VAL 552 552 552 VAL VAL C . n +C 3 553 THR 553 553 553 THR THR C . n +C 3 554 CYS 554 554 554 CYS CYS C . n +C 3 555 PHE 555 555 555 PHE PHE C . n +C 3 556 GLY 556 556 556 GLY GLY C . n +C 3 557 PRO 557 557 557 PRO PRO C . n +C 3 558 GLU 558 558 558 GLU GLU C . n +C 3 559 ALA 559 559 559 ALA ALA C . n +C 3 560 ASP 560 560 560 ASP ASP C . n +C 3 561 GLN 561 561 561 GLN GLN C . n +C 3 562 CYS 562 562 562 CYS CYS C . n +C 3 563 VAL 563 563 563 VAL VAL C . n +C 3 564 ALA 564 564 564 ALA ALA C . n +C 3 565 CYS 565 565 565 CYS CYS C . n +C 3 566 ALA 566 566 566 ALA ALA C . n +C 3 567 HIS 567 567 567 HIS HIS C . n +C 3 568 TYR 568 568 568 TYR TYR C . n +C 3 569 LYS 569 569 569 LYS LYS C . n +C 3 570 ASP 570 570 570 ASP ASP C . n +C 3 571 PRO 571 571 571 PRO PRO C . n +C 3 572 PRO 572 572 572 PRO PRO C . n +C 3 573 PHE 573 573 573 PHE PHE C . n +C 3 574 CYS 574 574 574 CYS CYS C . n +C 3 575 VAL 575 575 575 VAL VAL C . n +C 3 576 ALA 576 576 576 ALA ALA C . n +C 3 577 ARG 577 577 577 ARG ARG C . n +C 3 578 CYS 578 578 578 CYS CYS C . n +C 3 579 PRO 579 579 579 PRO PRO C . n +C 3 580 SER 580 580 580 SER SER C . n +C 3 581 GLY 581 581 ? ? ? C . n +C 3 582 VAL 582 582 ? ? ? C . n +C 3 583 LYS 583 583 ? ? ? C . n +C 3 584 PRO 584 584 ? ? ? C . n +C 3 585 ASP 585 585 ? ? ? C . n +C 3 586 LEU 586 586 ? ? ? C . n +C 3 587 SER 587 587 ? ? ? C . n +C 3 588 TYR 588 588 ? ? ? C . n +C 3 589 MET 589 589 ? ? ? C . n +C 3 590 PRO 590 590 ? ? ? C . n +C 3 591 ILE 591 591 591 ILE ILE C . n +C 3 592 TRP 592 592 592 TRP TRP C . n +C 3 593 LYS 593 593 593 LYS LYS C . n +C 3 594 PHE 594 594 594 PHE PHE C . n +C 3 595 PRO 595 595 595 PRO PRO C . n +C 3 596 ASP 596 596 596 ASP ASP C . n +C 3 597 GLU 597 597 597 GLU GLU C . n +C 3 598 GLU 598 598 598 GLU GLU C . n +C 3 599 GLY 599 599 599 GLY GLY C . n +C 3 600 ALA 600 600 600 ALA ALA C . n +C 3 601 CYS 601 601 601 CYS CYS C . n +C 3 602 GLN 602 602 602 GLN GLN C . n +C 3 603 PRO 603 603 603 PRO PRO C . n +C 3 604 CYS 604 604 604 CYS CYS C . n +C 3 605 PRO 605 605 605 PRO PRO C . n +C 3 606 ILE 606 606 606 ILE ILE C . n +C 3 607 ASN 607 607 607 ASN ASN C . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +D 4 NAG 1 766 165 NAG NAG C . +E 4 NAG 1 738 237 NAG NAG C . +F 5 SO4 1 1001 1001 SO4 SO4 C . +G 6 HOH 1 215 26 HOH HOH A . +G 6 HOH 2 216 32 HOH HOH A . +G 6 HOH 3 217 34 HOH HOH A . +G 6 HOH 4 218 35 HOH HOH A . +G 6 HOH 5 219 44 HOH HOH A . +G 6 HOH 6 220 47 HOH HOH A . +G 6 HOH 7 221 51 HOH HOH A . +G 6 HOH 8 222 56 HOH HOH A . +G 6 HOH 9 223 57 HOH HOH A . +G 6 HOH 10 224 58 HOH HOH A . +G 6 HOH 11 225 71 HOH HOH A . +G 6 HOH 12 226 73 HOH HOH A . +G 6 HOH 13 227 74 HOH HOH A . +G 6 HOH 14 228 75 HOH HOH A . +G 6 HOH 15 229 82 HOH HOH A . +G 6 HOH 16 230 83 HOH HOH A . +G 6 HOH 17 231 84 HOH HOH A . +G 6 HOH 18 232 85 HOH HOH A . +G 6 HOH 19 233 86 HOH HOH A . +H 6 HOH 1 221 4 HOH HOH B . +H 6 HOH 2 222 10 HOH HOH B . +H 6 HOH 3 223 19 HOH HOH B . +H 6 HOH 4 224 27 HOH HOH B . +H 6 HOH 5 225 33 HOH HOH B . +H 6 HOH 6 226 36 HOH HOH B . +H 6 HOH 7 227 38 HOH HOH B . +H 6 HOH 8 228 45 HOH HOH B . +H 6 HOH 9 229 52 HOH HOH B . +H 6 HOH 10 230 53 HOH HOH B . +H 6 HOH 11 231 69 HOH HOH B . +H 6 HOH 12 232 70 HOH HOH B . +H 6 HOH 13 233 88 HOH HOH B . +I 6 HOH 1 1002 41 HOH HOH C . +I 6 HOH 2 1003 1 HOH HOH C . +I 6 HOH 3 1004 2 HOH HOH C . +I 6 HOH 4 1005 3 HOH HOH C . +I 6 HOH 5 1006 6 HOH HOH C . +I 6 HOH 6 1007 7 HOH HOH C . +I 6 HOH 7 1008 8 HOH HOH C . +I 6 HOH 8 1009 9 HOH HOH C . +I 6 HOH 9 1010 11 HOH HOH C . +I 6 HOH 10 1011 13 HOH HOH C . +I 6 HOH 11 1012 14 HOH HOH C . +I 6 HOH 12 1013 15 HOH HOH C . +I 6 HOH 13 1014 16 HOH HOH C . +I 6 HOH 14 1015 17 HOH HOH C . +I 6 HOH 15 1016 20 HOH HOH C . +I 6 HOH 16 1017 22 HOH HOH C . +I 6 HOH 17 1018 23 HOH HOH C . +I 6 HOH 18 1019 24 HOH HOH C . +I 6 HOH 19 1020 25 HOH HOH C . +I 6 HOH 20 1021 28 HOH HOH C . +I 6 HOH 21 1022 29 HOH HOH C . +I 6 HOH 22 1023 30 HOH HOH C . +I 6 HOH 23 1024 31 HOH HOH C . +I 6 HOH 24 1025 37 HOH HOH C . +I 6 HOH 25 1026 39 HOH HOH C . +I 6 HOH 26 1027 46 HOH HOH C . +I 6 HOH 27 1028 48 HOH HOH C . +I 6 HOH 28 1029 49 HOH HOH C . +I 6 HOH 29 1030 50 HOH HOH C . +I 6 HOH 30 1031 55 HOH HOH C . +I 6 HOH 31 1032 59 HOH HOH C . +I 6 HOH 32 1033 60 HOH HOH C . +I 6 HOH 33 1034 61 HOH HOH C . +I 6 HOH 34 1035 62 HOH HOH C . +I 6 HOH 35 1036 63 HOH HOH C . +I 6 HOH 36 1037 64 HOH HOH C . +I 6 HOH 37 1038 65 HOH HOH C . +I 6 HOH 38 1039 66 HOH HOH C . +I 6 HOH 39 1040 67 HOH HOH C . +I 6 HOH 40 1041 68 HOH HOH C . +I 6 HOH 41 1042 72 HOH HOH C . +I 6 HOH 42 1043 76 HOH HOH C . +I 6 HOH 43 1044 77 HOH HOH C . +I 6 HOH 44 1045 78 HOH HOH C . +I 6 HOH 45 1046 80 HOH HOH C . +I 6 HOH 46 1047 81 HOH HOH C . +I 6 HOH 47 1048 89 HOH HOH C . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A LYS 190 ? CG ? A LYS 190 CG +2 1 Y 1 A LYS 190 ? CD ? A LYS 190 CD +3 1 Y 1 A LYS 190 ? CE ? A LYS 190 CE +4 1 Y 1 A LYS 190 ? NZ ? A LYS 190 NZ +5 1 Y 1 B LYS 30 ? CG ? B LYS 30 CG +6 1 Y 1 B LYS 30 ? CD ? B LYS 30 CD +7 1 Y 1 B LYS 30 ? CE ? B LYS 30 CE +8 1 Y 1 B LYS 30 ? NZ ? B LYS 30 NZ +9 1 Y 1 B LYS 217 ? CG ? B LYS 217 CG +10 1 Y 1 B LYS 217 ? CD ? B LYS 217 CD +11 1 Y 1 B LYS 217 ? CE ? B LYS 217 CE +12 1 Y 1 B LYS 217 ? NZ ? B LYS 217 NZ +# +loop_ +_software.name +_software.classification +_software.version +_software.citation_id +_software.pdbx_ordinal +DENZO 'data reduction' . ? 1 +SCALEPACK 'data scaling' . ? 2 +MOLREP phasing . ? 3 +REFMAC refinement 5.1.19 ? 4 +# +_cell.entry_id 1N8Z +_cell.length_a 66.17 +_cell.length_b 109.770 +_cell.length_c 175.140 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 90.00 +_cell.Z_PDB 4 +_cell.pdbx_unique_axis ? +_cell.length_a_esd ? +_cell.length_b_esd ? +_cell.length_c_esd ? +_cell.angle_alpha_esd ? +_cell.angle_beta_esd ? +_cell.angle_gamma_esd ? +# +_symmetry.entry_id 1N8Z +_symmetry.space_group_name_H-M 'P 21 21 21' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 19 +_symmetry.space_group_name_Hall ? +# +_exptl.entry_id 1N8Z +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number 1 +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.89 +_exptl_crystal.density_percent_sol 57.13 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.preparation ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' +_exptl_crystal_grow.temp 298 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pH 6.5 +_exptl_crystal_grow.pdbx_details +'20-30% PEG 5000 MME, 0.1M MES pH6.5, 0.2M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 298K' +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.id 1 +_diffrn.ambient_temp 110 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'ADSC QUANTUM 4' +_diffrn_detector.pdbx_collection_date ? +_diffrn_detector.details ? +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength . +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'NSLS BEAMLINE X4A' +_diffrn_source.pdbx_synchrotron_site NSLS +_diffrn_source.pdbx_synchrotron_beamline X4A +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_wavelength_list ? +# +_reflns.entry_id 1N8Z +_reflns.observed_criterion_sigma_F 1 +_reflns.observed_criterion_sigma_I 1 +_reflns.d_resolution_high 2.5 +_reflns.d_resolution_low 20 +_reflns.number_all 44400 +_reflns.number_obs 42223 +_reflns.percent_possible_obs 96.4 +_reflns.pdbx_Rmerge_I_obs ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_sigmaI ? +_reflns.B_iso_Wilson_estimate ? +_reflns.pdbx_redundancy 3.9 +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_ordinal 1 +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +# +_reflns_shell.d_res_high 2.52 +_reflns_shell.d_res_low 2.58 +_reflns_shell.percent_possible_all 90 +_reflns_shell.Rmerge_I_obs ? +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.meanI_over_sigI_obs ? +_reflns_shell.pdbx_redundancy ? +_reflns_shell.percent_possible_obs ? +_reflns_shell.number_unique_all ? +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.number_measured_all ? +_reflns_shell.number_measured_obs ? +_reflns_shell.number_unique_obs ? +_reflns_shell.pdbx_chi_squared ? +# +_refine.entry_id 1N8Z +_refine.ls_number_reflns_obs 37518 +_refine.ls_number_reflns_all 42223 +_refine.pdbx_ls_sigma_I 1 +_refine.pdbx_ls_sigma_F 1 +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.ls_d_res_low 20.00 +_refine.ls_d_res_high 2.52 +_refine.ls_percent_reflns_obs 92.88 +_refine.ls_R_factor_obs 0.22521 +_refine.ls_R_factor_all 0.226 +_refine.ls_R_factor_R_work 0.22205 +_refine.ls_R_factor_R_free 0.28425 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free 4.8 +_refine.ls_number_reflns_R_free 1871 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.correlation_coeff_Fo_to_Fc 0.926 +_refine.correlation_coeff_Fo_to_Fc_free 0.871 +_refine.B_iso_mean 16.813 +_refine.aniso_B[1][1] -2.69 +_refine.aniso_B[2][2] -0.37 +_refine.aniso_B[3][3] 3.07 +_refine.aniso_B[1][2] 0.00 +_refine.aniso_B[1][3] 0.00 +_refine.aniso_B[2][3] 0.00 +_refine.solvent_model_details 'BABINET MODEL WITH MASK' +_refine.solvent_model_param_ksol ? +_refine.solvent_model_param_bsol ? +_refine.pdbx_solvent_vdw_probe_radii 1.40 +_refine.pdbx_solvent_ion_probe_radii 0.80 +_refine.pdbx_solvent_shrinkage_radii 0.80 +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.details ? +_refine.pdbx_starting_model 'PDB 1M6B' +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_overall_ESU_R_Free 0.342 +_refine.overall_SU_B 13.011 +_refine.ls_redundancy_reflns_obs ? +_refine.B_iso_min ? +_refine.B_iso_max ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_SU_ML 0.279 +_refine.pdbx_overall_ESU_R 0.671 +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_overall_phase_error ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 7778 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 33 +_refine_hist.number_atoms_solvent 79 +_refine_hist.number_atoms_total 7890 +_refine_hist.d_res_high 2.52 +_refine_hist.d_res_low 20.00 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +r_bond_refined_d 0.016 0.021 ? 8023 'X-RAY DIFFRACTION' ? +r_bond_other_d ? ? ? ? 'X-RAY DIFFRACTION' ? +r_angle_refined_deg 1.786 1.956 ? 10938 'X-RAY DIFFRACTION' ? +r_angle_other_deg ? ? ? ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_1_deg 7.713 5.000 ? 1008 'X-RAY DIFFRACTION' ? +r_dihedral_angle_2_deg ? ? ? ? 'X-RAY DIFFRACTION' ? +r_chiral_restr 0.111 0.200 ? 1216 'X-RAY DIFFRACTION' ? +r_gen_planes_refined 0.006 0.020 ? 6128 'X-RAY DIFFRACTION' ? +r_gen_planes_other ? ? ? ? 'X-RAY DIFFRACTION' ? +r_nbd_refined 0.248 0.200 ? 3505 'X-RAY DIFFRACTION' ? +r_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? +r_nbtor_other ? ? ? ? 'X-RAY DIFFRACTION' ? +r_xyhbond_nbd_refined 0.153 0.200 ? 319 'X-RAY DIFFRACTION' ? +r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? +r_symmetry_vdw_refined 0.280 0.200 ? 56 'X-RAY DIFFRACTION' ? +r_symmetry_vdw_other ? ? ? ? 'X-RAY DIFFRACTION' ? +r_symmetry_hbond_refined 0.096 0.200 ? 2 'X-RAY DIFFRACTION' ? +r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? +r_mcbond_it 0.654 1.500 ? 5057 'X-RAY DIFFRACTION' ? +r_mcangle_it 1.283 2.000 ? 8164 'X-RAY DIFFRACTION' ? +r_scbond_it 2.193 3.000 ? 2966 'X-RAY DIFFRACTION' ? +r_scangle_it 3.610 4.500 ? 2774 'X-RAY DIFFRACTION' ? +r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? +r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? +r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_shell.pdbx_total_number_of_bins_used 20 +_refine_ls_shell.d_res_high 2.521 +_refine_ls_shell.d_res_low 2.586 +_refine_ls_shell.number_reflns_R_work 2058 +_refine_ls_shell.R_factor_R_work 0.336 +_refine_ls_shell.percent_reflns_obs ? +_refine_ls_shell.R_factor_R_free ? +_refine_ls_shell.R_factor_R_free_error ? +_refine_ls_shell.percent_reflns_R_free ? +_refine_ls_shell.number_reflns_R_free 0 +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.number_reflns_all ? +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.R_factor_all ? +# +_database_PDB_matrix.entry_id 1N8Z +_database_PDB_matrix.origx[1][1] 1.000000 +_database_PDB_matrix.origx[1][2] 0.000000 +_database_PDB_matrix.origx[1][3] 0.000000 +_database_PDB_matrix.origx[2][1] 0.000000 +_database_PDB_matrix.origx[2][2] 1.000000 +_database_PDB_matrix.origx[2][3] 0.000000 +_database_PDB_matrix.origx[3][1] 0.000000 +_database_PDB_matrix.origx[3][2] 0.000000 +_database_PDB_matrix.origx[3][3] 1.000000 +_database_PDB_matrix.origx_vector[1] 0.00000 +_database_PDB_matrix.origx_vector[2] 0.00000 +_database_PDB_matrix.origx_vector[3] 0.00000 +# +_struct.entry_id 1N8Z +_struct.title 'Crystal structure of extracellular domain of human HER2 complexed with Herceptin Fab' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 1N8Z +_struct_keywords.pdbx_keywords TRANSFERASE +_struct_keywords.text 'tyrosin kinase receptor, cell surface receptor, TRANSFERASE' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 3 ? +D N N 4 ? +E N N 4 ? +F N N 5 ? +G N N 6 ? +H N N 6 ? +I N N 6 ? +# +loop_ +_struct_ref.id +_struct_ref.db_name +_struct_ref.db_code +_struct_ref.pdbx_db_accession +_struct_ref.entity_id +_struct_ref.pdbx_seq_one_letter_code +_struct_ref.pdbx_align_begin +_struct_ref.pdbx_db_isoform +1 UNP ERBB2_HUMAN P04626 3 +;TQVCTGTDMKLRLPASPETHLDMLRHLYQGCQVVQGNLELTYLPTNASLSFLQDIQEVQGYVLIAHNQVRQVPLQRLRIV +RGTQLFEDNYALAVLDNGDPLNNTTPVTGASPGGLRELQLRSLTEILKGGVLIQRNPQLCYQDTILWKDIFHKNNQLALT +LIDTNRSRACHPCSPMCKGSRCWGESSEDCQSLTRTVCAGGCARCKGPLPTDCCHEQCAAGCTGPKHSDCLACLHFNHSG +ICELHCPALVTYNTDTFESMPNPEGRYTFGASCVTACPYNYLSTDVGSCTLVCPLHNQEVTAEDGTQRCEKCSKPCARVC +YGLGMEHLREVRAVTSANIQEFAGCKKIFGSLAFLPESFDGDPASNTAPLQPEQLQVFETLEEITGYLYISAWPDSLPDL +SVFQNLQVIRGRILHNGAYSLTLQGLGISWLGLRSLRELGSGLALIHHNTHLCFVHTVPWDQLFRNPHQALLHTANRPED +ECVGEGLACHQLCARGHCWGPGPTQCVNCSQFLRGQECVEECRVLQGLPREYVNARHCLPCHPECQPQNGSVTCFGPEAD +QCVACAHYKDPPFCVARCPSGVKPDLSYMPIWKFPDEEGACQPCPIN +; +23 ? +2 PDB 1N8Z 1N8Z 1 ? ? ? +3 PDB 1N8Z 1N8Z 2 ? ? ? +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 1N8Z C 1 ? 607 ? P04626 23 ? 629 ? 1 607 +2 2 1N8Z A 1 ? 214 ? 1N8Z 1 ? 214 ? 1 214 +3 3 1N8Z B 1 ? 220 ? 1N8Z 1 ? 220 ? 1 220 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details trimeric +_pdbx_struct_assembly.oligomeric_count 3 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_struct_biol.id 1 +_struct_biol.pdbx_parent_biol_id ? +_struct_biol.details ? +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 GLN A 79 ? PHE A 83 ? GLN A 79 PHE A 83 5 ? 5 +HELX_P HELX_P2 2 SER A 121 ? LYS A 126 ? SER A 121 LYS A 126 1 ? 6 +HELX_P HELX_P3 3 VAL A 150 ? ALA A 153 ? VAL A 150 ALA A 153 5 ? 4 +HELX_P HELX_P4 4 LYS A 183 ? LYS A 188 ? LYS A 183 LYS A 188 1 ? 6 +HELX_P HELX_P5 5 ASN B 28 ? THR B 32 ? ASN B 28 THR B 32 5 ? 5 +HELX_P HELX_P6 6 ARG B 87 ? THR B 91 ? ARG B 87 THR B 91 5 ? 5 +HELX_P HELX_P7 7 SER B 134 ? LYS B 136 ? SER B 134 LYS B 136 5 ? 3 +HELX_P HELX_P8 8 SER B 163 ? ALA B 165 ? SER B 163 ALA B 165 5 ? 3 +HELX_P HELX_P9 9 SER B 194 ? LEU B 196 ? SER B 194 LEU B 196 5 ? 3 +HELX_P HELX_P10 10 LYS B 208 ? ASN B 211 ? LYS B 208 ASN B 211 5 ? 4 +HELX_P HELX_P11 11 SER C 16 ? GLN C 29 ? SER C 16 GLN C 29 1 ? 14 +HELX_P HELX_P12 12 LEU C 49 ? GLN C 53 ? LEU C 49 GLN C 53 5 ? 5 +HELX_P HELX_P13 13 LEU C 85 ? ASP C 88 ? LEU C 85 ASP C 88 5 ? 4 +HELX_P HELX_P14 14 LEU C 146 ? PHE C 151 ? LEU C 146 PHE C 151 1 ? 6 +HELX_P HELX_P15 15 HIS C 152 ? GLN C 156 ? HIS C 152 GLN C 156 5 ? 5 +HELX_P HELX_P16 16 LEU C 209 ? CYS C 213 ? LEU C 209 CYS C 213 5 ? 5 +HELX_P HELX_P17 17 MET C 325 ? ARG C 329 ? MET C 325 ARG C 329 5 ? 5 +HELX_P HELX_P18 18 ASN C 338 ? ALA C 343 ? ASN C 338 ALA C 343 5 ? 6 +HELX_P HELX_P19 19 LEU C 355 ? PHE C 359 ? LEU C 355 PHE C 359 5 ? 5 +HELX_P HELX_P20 20 GLU C 373 ? LEU C 381 ? GLU C 373 LEU C 381 5 ? 9 +HELX_P HELX_P21 21 LEU C 400 ? GLN C 404 ? LEU C 400 GLN C 404 5 ? 5 +HELX_P HELX_P22 22 LEU C 414 ? GLY C 417 ? LEU C 414 GLY C 417 5 ? 4 +HELX_P HELX_P23 23 PRO C 459 ? PHE C 464 ? PRO C 459 PHE C 464 1 ? 6 +HELX_P HELX_P24 24 PRO C 478 ? GLU C 485 ? PRO C 478 GLU C 485 1 ? 8 +HELX_P HELX_P25 25 CYS C 493 ? HIS C 497 ? CYS C 493 HIS C 497 5 ? 5 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +disulf1 disulf ? ? A CYS 23 SG ? ? ? 1_555 A CYS 88 SG ? ? A CYS 23 A CYS 88 1_555 ? ? ? ? ? ? ? 2.090 ? ? +disulf2 disulf ? ? A CYS 134 SG ? ? ? 1_555 A CYS 194 SG ? ? A CYS 134 A CYS 194 1_555 ? ? ? ? ? ? ? 2.001 ? ? +disulf3 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 96 SG ? ? B CYS 22 B CYS 96 1_555 ? ? ? ? ? ? ? 2.039 ? ? +disulf4 disulf ? ? B CYS 147 SG ? ? ? 1_555 B CYS 203 SG ? ? B CYS 147 B CYS 203 1_555 ? ? ? ? ? ? ? 2.051 ? ? +disulf5 disulf ? ? C CYS 4 SG ? ? ? 1_555 C CYS 31 SG ? ? C CYS 4 C CYS 31 1_555 ? ? ? ? ? ? ? 2.045 ? ? +disulf6 disulf ? ? C CYS 140 SG ? ? ? 1_555 C CYS 170 SG ? ? C CYS 140 C CYS 170 1_555 ? ? ? ? ? ? ? 2.021 ? ? +disulf7 disulf ? ? C CYS 173 SG ? ? ? 1_555 C CYS 182 SG ? ? C CYS 173 C CYS 182 1_555 ? ? ? ? ? ? ? 2.078 ? ? +disulf8 disulf ? ? C CYS 177 SG ? ? ? 1_555 C CYS 190 SG ? ? C CYS 177 C CYS 190 1_555 ? ? ? ? ? ? ? 2.059 ? ? +disulf9 disulf ? ? C CYS 198 SG ? ? ? 1_555 C CYS 205 SG ? ? C CYS 198 C CYS 205 1_555 ? ? ? ? ? ? ? 2.055 ? ? +disulf10 disulf ? ? C CYS 202 SG ? ? ? 1_555 C CYS 213 SG ? ? C CYS 202 C CYS 213 1_555 ? ? ? ? ? ? ? 2.058 ? ? +disulf11 disulf ? ? C CYS 214 SG ? ? ? 1_555 C CYS 222 SG ? ? C CYS 214 C CYS 222 1_555 ? ? ? ? ? ? ? 2.049 ? ? +disulf12 disulf ? ? C CYS 218 SG ? ? ? 1_555 C CYS 230 SG ? ? C CYS 218 C CYS 230 1_555 ? ? ? ? ? ? ? 2.033 ? ? +disulf13 disulf ? ? C CYS 233 SG ? ? ? 1_555 C CYS 242 SG ? ? C CYS 233 C CYS 242 1_555 ? ? ? ? ? ? ? 2.061 ? ? +disulf14 disulf ? ? C CYS 246 SG ? ? ? 1_555 C CYS 273 SG ? ? C CYS 246 C CYS 273 1_555 ? ? ? ? ? ? ? 2.078 ? ? +disulf15 disulf ? ? C CYS 277 SG ? ? ? 1_555 C CYS 289 SG ? ? C CYS 277 C CYS 289 1_555 ? ? ? ? ? ? ? 2.024 ? ? +disulf16 disulf ? ? C CYS 293 SG ? ? ? 1_555 C CYS 309 SG ? ? C CYS 293 C CYS 309 1_555 ? ? ? ? ? ? ? 2.053 ? ? +disulf17 disulf ? ? C CYS 312 SG ? ? ? 1_555 C CYS 316 SG ? ? C CYS 312 C CYS 316 1_555 ? ? ? ? ? ? ? 2.054 ? ? +disulf18 disulf ? ? C CYS 320 SG ? ? ? 1_555 C CYS 345 SG ? ? C CYS 320 C CYS 345 1_555 ? ? ? ? ? ? ? 2.070 ? ? +disulf19 disulf ? ? C CYS 453 SG ? ? ? 1_555 C CYS 482 SG ? ? C CYS 453 C CYS 482 1_555 ? ? ? ? ? ? ? 2.055 ? ? +disulf20 disulf ? ? C CYS 489 SG ? ? ? 1_555 C CYS 498 SG ? ? C CYS 489 C CYS 498 1_555 ? ? ? ? ? ? ? 2.037 ? ? +disulf21 disulf ? ? C CYS 493 SG ? ? ? 1_555 C CYS 506 SG ? ? C CYS 493 C CYS 506 1_555 ? ? ? ? ? ? ? 2.048 ? ? +disulf22 disulf ? ? C CYS 509 SG ? ? ? 1_555 C CYS 518 SG ? ? C CYS 509 C CYS 518 1_555 ? ? ? ? ? ? ? 2.047 ? ? +disulf23 disulf ? ? C CYS 522 SG ? ? ? 1_555 C CYS 538 SG ? ? C CYS 522 C CYS 538 1_555 ? ? ? ? ? ? ? 2.024 ? ? +disulf24 disulf ? ? C CYS 541 SG ? ? ? 1_555 C CYS 554 SG ? ? C CYS 541 C CYS 554 1_555 ? ? ? ? ? ? ? 2.044 ? ? +disulf25 disulf ? ? C CYS 545 SG ? ? ? 1_555 C CYS 562 SG ? ? C CYS 545 C CYS 562 1_555 ? ? ? ? ? ? ? 2.059 ? ? +disulf26 disulf ? ? C CYS 565 SG ? ? ? 1_555 C CYS 574 SG ? ? C CYS 565 C CYS 574 1_555 ? ? ? ? ? ? ? 2.052 ? ? +disulf27 disulf ? ? C CYS 578 SG ? ? ? 1_555 C CYS 601 SG ? ? C CYS 578 C CYS 601 1_555 ? ? ? ? ? ? ? 2.896 ? ? +covale1 covale one ? C ASN 165 ND2 ? ? ? 1_555 D NAG . C1 ? ? C ASN 165 C NAG 766 1_555 ? ? ? ? ? ? ? 1.439 ? N-Glycosylation +covale2 covale one ? C ASN 237 ND2 ? ? ? 1_555 E NAG . C1 ? ? C ASN 237 C NAG 738 1_555 ? ? ? ? ? ? ? 1.436 ? N-Glycosylation +# +loop_ +_struct_conn_type.id +_struct_conn_type.criteria +_struct_conn_type.reference +disulf ? ? +covale ? ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 NAG D . ? ASN C 165 ? NAG C 766 ? 1_555 ASN C 165 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +2 NAG E . ? ASN C 237 ? NAG C 738 ? 1_555 ASN C 237 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +3 CYS A 23 ? CYS A 88 ? CYS A 23 ? 1_555 CYS A 88 ? 1_555 SG SG . . . None 'Disulfide bridge' +4 CYS A 134 ? CYS A 194 ? CYS A 134 ? 1_555 CYS A 194 ? 1_555 SG SG . . . None 'Disulfide bridge' +5 CYS B 22 ? CYS B 96 ? CYS B 22 ? 1_555 CYS B 96 ? 1_555 SG SG . . . None 'Disulfide bridge' +6 CYS B 147 ? CYS B 203 ? CYS B 147 ? 1_555 CYS B 203 ? 1_555 SG SG . . . None 'Disulfide bridge' +7 CYS C 4 ? CYS C 31 ? CYS C 4 ? 1_555 CYS C 31 ? 1_555 SG SG . . . None 'Disulfide bridge' +8 CYS C 140 ? CYS C 170 ? CYS C 140 ? 1_555 CYS C 170 ? 1_555 SG SG . . . None 'Disulfide bridge' +9 CYS C 173 ? CYS C 182 ? CYS C 173 ? 1_555 CYS C 182 ? 1_555 SG SG . . . None 'Disulfide bridge' +10 CYS C 177 ? CYS C 190 ? CYS C 177 ? 1_555 CYS C 190 ? 1_555 SG SG . . . None 'Disulfide bridge' +11 CYS C 198 ? CYS C 205 ? CYS C 198 ? 1_555 CYS C 205 ? 1_555 SG SG . . . None 'Disulfide bridge' +12 CYS C 202 ? CYS C 213 ? CYS C 202 ? 1_555 CYS C 213 ? 1_555 SG SG . . . None 'Disulfide bridge' +13 CYS C 214 ? CYS C 222 ? CYS C 214 ? 1_555 CYS C 222 ? 1_555 SG SG . . . None 'Disulfide bridge' +14 CYS C 218 ? CYS C 230 ? CYS C 218 ? 1_555 CYS C 230 ? 1_555 SG SG . . . None 'Disulfide bridge' +15 CYS C 233 ? CYS C 242 ? CYS C 233 ? 1_555 CYS C 242 ? 1_555 SG SG . . . None 'Disulfide bridge' +16 CYS C 246 ? CYS C 273 ? CYS C 246 ? 1_555 CYS C 273 ? 1_555 SG SG . . . None 'Disulfide bridge' +17 CYS C 277 ? CYS C 289 ? CYS C 277 ? 1_555 CYS C 289 ? 1_555 SG SG . . . None 'Disulfide bridge' +18 CYS C 293 ? CYS C 309 ? CYS C 293 ? 1_555 CYS C 309 ? 1_555 SG SG . . . None 'Disulfide bridge' +19 CYS C 312 ? CYS C 316 ? CYS C 312 ? 1_555 CYS C 316 ? 1_555 SG SG . . . None 'Disulfide bridge' +20 CYS C 320 ? CYS C 345 ? CYS C 320 ? 1_555 CYS C 345 ? 1_555 SG SG . . . None 'Disulfide bridge' +21 CYS C 453 ? CYS C 482 ? CYS C 453 ? 1_555 CYS C 482 ? 1_555 SG SG . . . None 'Disulfide bridge' +22 CYS C 489 ? CYS C 498 ? CYS C 489 ? 1_555 CYS C 498 ? 1_555 SG SG . . . None 'Disulfide bridge' +23 CYS C 493 ? CYS C 506 ? CYS C 493 ? 1_555 CYS C 506 ? 1_555 SG SG . . . None 'Disulfide bridge' +24 CYS C 509 ? CYS C 518 ? CYS C 509 ? 1_555 CYS C 518 ? 1_555 SG SG . . . None 'Disulfide bridge' +25 CYS C 522 ? CYS C 538 ? CYS C 522 ? 1_555 CYS C 538 ? 1_555 SG SG . . . None 'Disulfide bridge' +26 CYS C 541 ? CYS C 554 ? CYS C 541 ? 1_555 CYS C 554 ? 1_555 SG SG . . . None 'Disulfide bridge' +27 CYS C 545 ? CYS C 562 ? CYS C 545 ? 1_555 CYS C 562 ? 1_555 SG SG . . . None 'Disulfide bridge' +28 CYS C 565 ? CYS C 574 ? CYS C 565 ? 1_555 CYS C 574 ? 1_555 SG SG . . . None 'Disulfide bridge' +29 CYS C 578 ? CYS C 601 ? CYS C 578 ? 1_555 CYS C 601 ? 1_555 SG SG . . . None 'Disulfide bridge' +# +loop_ +_struct_mon_prot_cis.pdbx_id +_struct_mon_prot_cis.label_comp_id +_struct_mon_prot_cis.label_seq_id +_struct_mon_prot_cis.label_asym_id +_struct_mon_prot_cis.label_alt_id +_struct_mon_prot_cis.pdbx_PDB_ins_code +_struct_mon_prot_cis.auth_comp_id +_struct_mon_prot_cis.auth_seq_id +_struct_mon_prot_cis.auth_asym_id +_struct_mon_prot_cis.pdbx_label_comp_id_2 +_struct_mon_prot_cis.pdbx_label_seq_id_2 +_struct_mon_prot_cis.pdbx_label_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 +_struct_mon_prot_cis.pdbx_auth_comp_id_2 +_struct_mon_prot_cis.pdbx_auth_seq_id_2 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_model_num +_struct_mon_prot_cis.pdbx_omega_angle +1 SER 7 A . ? SER 7 A PRO 8 A ? PRO 8 A 1 -2.43 +2 THR 94 A . ? THR 94 A PRO 95 A ? PRO 95 A 1 -3.63 +3 TYR 140 A . ? TYR 140 A PRO 141 A ? PRO 141 A 1 -2.94 +4 PHE 153 B . ? PHE 153 B PRO 154 B ? PRO 154 B 1 -13.62 +5 GLU 155 B . ? GLU 155 B PRO 156 B ? PRO 156 B 1 1.54 +6 SER 111 C . ? SER 111 C PRO 112 C ? PRO 112 C 1 -20.77 +7 PRO 571 C . ? PRO 571 C PRO 572 C ? PRO 572 C 1 9.45 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +A ? 4 ? +B ? 8 ? +C ? 4 ? +D ? 3 ? +E ? 4 ? +F ? 8 ? +G ? 8 ? +H ? 3 ? +I ? 5 ? +J ? 5 ? +K ? 2 ? +L ? 2 ? +M ? 2 ? +N ? 2 ? +O ? 2 ? +P ? 4 ? +Q ? 5 ? +R ? 2 ? +S ? 2 ? +T ? 2 ? +U ? 2 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? anti-parallel +B 1 2 ? parallel +B 2 3 ? anti-parallel +B 3 4 ? anti-parallel +B 4 5 ? anti-parallel +B 5 6 ? anti-parallel +B 6 7 ? anti-parallel +B 7 8 ? anti-parallel +C 1 2 ? anti-parallel +C 2 3 ? anti-parallel +C 3 4 ? anti-parallel +D 1 2 ? anti-parallel +D 2 3 ? anti-parallel +E 1 2 ? anti-parallel +E 2 3 ? anti-parallel +E 3 4 ? anti-parallel +F 1 2 ? parallel +F 2 3 ? anti-parallel +F 3 4 ? anti-parallel +F 4 5 ? anti-parallel +F 5 6 ? anti-parallel +F 6 7 ? anti-parallel +F 7 8 ? anti-parallel +G 1 2 ? anti-parallel +G 2 3 ? anti-parallel +G 3 4 ? anti-parallel +G 4 5 ? anti-parallel +G 5 6 ? anti-parallel +G 6 7 ? anti-parallel +G 7 8 ? anti-parallel +H 1 2 ? anti-parallel +H 2 3 ? anti-parallel +I 1 2 ? parallel +I 2 3 ? parallel +I 3 4 ? parallel +I 4 5 ? parallel +J 1 2 ? parallel +J 2 3 ? parallel +J 3 4 ? parallel +J 4 5 ? parallel +K 1 2 ? anti-parallel +L 1 2 ? anti-parallel +M 1 2 ? anti-parallel +N 1 2 ? anti-parallel +O 1 2 ? anti-parallel +P 1 2 ? parallel +P 2 3 ? parallel +P 3 4 ? parallel +Q 1 2 ? parallel +Q 2 3 ? parallel +Q 3 4 ? parallel +Q 4 5 ? parallel +R 1 2 ? anti-parallel +S 1 2 ? anti-parallel +T 1 2 ? anti-parallel +U 1 2 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 MET A 4 ? SER A 7 ? MET A 4 SER A 7 +A 2 VAL A 19 ? ALA A 25 ? VAL A 19 ALA A 25 +A 3 ASP A 70 ? ILE A 75 ? ASP A 70 ILE A 75 +A 4 PHE A 62 ? SER A 67 ? PHE A 62 SER A 67 +B 1 SER A 10 ? ALA A 13 ? SER A 10 ALA A 13 +B 2 THR A 102 ? ILE A 106 ? THR A 102 ILE A 106 +B 3 ALA A 84 ? GLN A 90 ? ALA A 84 GLN A 90 +B 4 THR A 97 ? PHE A 98 ? THR A 97 PHE A 98 +B 5 ALA A 84 ? GLN A 90 ? ALA A 84 GLN A 90 +B 6 VAL A 33 ? GLN A 38 ? VAL A 33 GLN A 38 +B 7 LYS A 45 ? TYR A 49 ? LYS A 45 TYR A 49 +B 8 PHE A 53 ? LEU A 54 ? PHE A 53 LEU A 54 +C 1 SER A 114 ? PHE A 118 ? SER A 114 PHE A 118 +C 2 THR A 129 ? PHE A 139 ? THR A 129 PHE A 139 +C 3 TYR A 173 ? SER A 182 ? TYR A 173 SER A 182 +C 4 SER A 159 ? VAL A 163 ? SER A 159 VAL A 163 +D 1 ALA A 144 ? TRP A 148 ? ALA A 144 TRP A 148 +D 2 VAL A 191 ? HIS A 198 ? VAL A 191 HIS A 198 +D 3 VAL A 205 ? ASN A 210 ? VAL A 205 ASN A 210 +E 1 GLN B 3 ? SER B 7 ? GLN B 3 SER B 7 +E 2 LEU B 18 ? SER B 25 ? LEU B 18 SER B 25 +E 3 THR B 78 ? MET B 83 ? THR B 78 MET B 83 +E 4 PHE B 68 ? ASP B 73 ? PHE B 68 ASP B 73 +F 1 GLY B 10 ? VAL B 12 ? GLY B 10 VAL B 12 +F 2 THR B 114 ? VAL B 118 ? THR B 114 VAL B 118 +F 3 ALA B 92 ? ARG B 98 ? ALA B 92 ARG B 98 +F 4 TYR B 109 ? TRP B 110 ? TYR B 109 TRP B 110 +F 5 ALA B 92 ? ARG B 98 ? ALA B 92 ARG B 98 +F 6 ILE B 34 ? GLN B 39 ? ILE B 34 GLN B 39 +F 7 GLU B 46 ? ILE B 51 ? GLU B 46 ILE B 51 +F 8 THR B 58 ? TYR B 60 ? THR B 58 TYR B 60 +G 1 SER B 127 ? LEU B 131 ? SER B 127 LEU B 131 +G 2 THR B 142 ? TYR B 152 ? THR B 142 TYR B 152 +G 3 THR B 138 ? SER B 139 ? THR B 138 SER B 139 +G 4 THR B 142 ? TYR B 152 ? THR B 142 TYR B 152 +G 5 TYR B 183 ? PRO B 192 ? TYR B 183 PRO B 192 +G 6 VAL B 176 ? LEU B 177 ? VAL B 176 LEU B 177 +G 7 TYR B 183 ? PRO B 192 ? TYR B 183 PRO B 192 +G 8 VAL B 170 ? THR B 172 ? VAL B 170 THR B 172 +H 1 THR B 158 ? TRP B 161 ? THR B 158 TRP B 161 +H 2 ILE B 202 ? HIS B 207 ? ILE B 202 HIS B 207 +H 3 THR B 212 ? LYS B 217 ? THR B 212 LYS B 217 +I 1 VAL C 3 ? THR C 5 ? VAL C 3 THR C 5 +I 2 VAL C 33 ? GLN C 35 ? VAL C 33 GLN C 35 +I 3 GLU C 57 ? VAL C 58 ? GLU C 57 VAL C 58 +I 4 ILE C 79 ? VAL C 80 ? ILE C 79 VAL C 80 +I 5 GLU C 125 ? ILE C 126 ? GLU C 125 ILE C 126 +J 1 LEU C 38 ? THR C 41 ? LEU C 38 THR C 41 +J 2 VAL C 62 ? ALA C 65 ? VAL C 62 ALA C 65 +J 3 TYR C 90 ? LEU C 95 ? TYR C 90 LEU C 95 +J 4 GLY C 130 ? GLN C 134 ? GLY C 130 GLN C 134 +J 5 THR C 160 ? ILE C 162 ? THR C 160 ILE C 162 +K 1 PHE C 236 ? HIS C 238 ? PHE C 236 HIS C 238 +K 2 ILE C 241 ? GLU C 243 ? ILE C 241 GLU C 243 +L 1 VAL C 250 ? TYR C 252 ? VAL C 250 TYR C 252 +L 2 SER C 259 ? PRO C 261 ? SER C 259 PRO C 261 +M 1 TYR C 267 ? PHE C 269 ? TYR C 267 PHE C 269 +M 2 SER C 272 ? VAL C 274 ? SER C 272 VAL C 274 +N 1 LEU C 282 ? SER C 283 ? LEU C 282 SER C 283 +N 2 CYS C 289 ? THR C 290 ? CYS C 289 THR C 290 +O 1 ASN C 297 ? THR C 301 ? ASN C 297 THR C 301 +O 2 GLN C 307 ? LYS C 311 ? GLN C 307 LYS C 311 +P 1 LYS C 347 ? ILE C 348 ? LYS C 347 ILE C 348 +P 2 GLU C 383 ? ILE C 384 ? GLU C 383 ILE C 384 +P 3 VAL C 408 ? ILE C 409 ? VAL C 408 ILE C 409 +P 4 GLU C 438 ? LEU C 439 ? GLU C 438 LEU C 439 +Q 1 LEU C 352 ? PHE C 354 ? LEU C 352 PHE C 354 +Q 2 LEU C 388 ? ILE C 390 ? LEU C 388 ILE C 390 +Q 3 TYR C 419 ? GLN C 424 ? TYR C 419 GLN C 424 +Q 4 LEU C 443 ? HIS C 447 ? LEU C 443 HIS C 447 +Q 5 LEU C 471 ? THR C 474 ? LEU C 471 THR C 474 +R 1 PHE C 512 ? ARG C 514 ? PHE C 512 ARG C 514 +R 2 GLU C 517 ? VAL C 519 ? GLU C 517 VAL C 519 +S 1 GLU C 531 ? ASN C 534 ? GLU C 531 ASN C 534 +S 2 HIS C 537 ? PRO C 540 ? HIS C 537 PRO C 540 +T 1 TYR C 568 ? ASP C 570 ? TYR C 568 ASP C 570 +T 2 PHE C 573 ? VAL C 575 ? PHE C 573 VAL C 575 +U 1 LYS C 593 ? PRO C 595 ? LYS C 593 PRO C 595 +U 2 CYS C 601 ? PRO C 603 ? CYS C 601 PRO C 603 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 O SER A 7 ? O SER A 7 N THR A 22 ? N THR A 22 +A 2 3 O CYS A 23 ? O CYS A 23 N PHE A 71 ? N PHE A 71 +A 3 4 N THR A 74 ? N THR A 74 O SER A 63 ? O SER A 63 +B 1 2 N LEU A 11 ? N LEU A 11 O LYS A 103 ? O LYS A 103 +B 2 3 N VAL A 104 ? N VAL A 104 O ALA A 84 ? O ALA A 84 +B 3 4 N GLN A 90 ? N GLN A 90 O THR A 97 ? O THR A 97 +B 4 5 O THR A 97 ? O THR A 97 N GLN A 90 ? N GLN A 90 +B 5 6 O GLN A 89 ? O GLN A 89 N ALA A 34 ? N ALA A 34 +B 6 7 N GLN A 37 ? N GLN A 37 O LYS A 45 ? O LYS A 45 +B 7 8 O TYR A 49 ? O TYR A 49 N PHE A 53 ? N PHE A 53 +C 1 2 N PHE A 118 ? N PHE A 118 O VAL A 133 ? O VAL A 133 +C 2 3 O PHE A 139 ? O PHE A 139 N TYR A 173 ? N TYR A 173 +C 3 4 N THR A 178 ? N THR A 178 O GLN A 160 ? O GLN A 160 +D 1 2 O GLN A 147 ? O GLN A 147 N GLU A 195 ? N GLU A 195 +D 2 3 N VAL A 196 ? N VAL A 196 O VAL A 205 ? O VAL A 205 +E 1 2 O SER B 7 ? O SER B 7 N SER B 21 ? N SER B 21 +E 2 3 O CYS B 22 ? O CYS B 22 N ALA B 79 ? N ALA B 79 +E 3 4 N GLN B 82 ? N GLN B 82 O THR B 69 ? O THR B 69 +F 1 2 N GLY B 10 ? N GLY B 10 O LEU B 115 ? O LEU B 115 +F 2 3 N VAL B 116 ? N VAL B 116 O ALA B 92 ? O ALA B 92 +F 3 4 N ARG B 98 ? N ARG B 98 O TYR B 109 ? O TYR B 109 +F 4 5 O TYR B 109 ? O TYR B 109 N ARG B 98 ? N ARG B 98 +F 5 6 O SER B 97 ? O SER B 97 N HIS B 35 ? N HIS B 35 +F 6 7 N ARG B 38 ? N ARG B 38 O GLU B 46 ? O GLU B 46 +F 7 8 N ARG B 50 ? N ARG B 50 O ARG B 59 ? O ARG B 59 +G 1 2 N LEU B 131 ? N LEU B 131 O GLY B 146 ? O GLY B 146 +G 2 3 O THR B 142 ? O THR B 142 N SER B 139 ? N SER B 139 +G 3 4 N SER B 139 ? N SER B 139 O THR B 142 ? O THR B 142 +G 4 5 O TYR B 152 ? O TYR B 152 N TYR B 183 ? N TYR B 183 +G 5 6 O SER B 184 ? O SER B 184 N VAL B 176 ? N VAL B 176 +G 6 7 N VAL B 176 ? N VAL B 176 O SER B 184 ? O SER B 184 +G 7 8 N VAL B 188 ? N VAL B 188 O HIS B 171 ? O HIS B 171 +H 1 2 O SER B 160 ? O SER B 160 N ASN B 204 ? N ASN B 204 +H 2 3 N HIS B 207 ? N HIS B 207 O THR B 212 ? O THR B 212 +I 1 2 N CYS C 4 ? N CYS C 4 O VAL C 33 ? O VAL C 33 +I 2 3 N VAL C 34 ? N VAL C 34 O GLU C 57 ? O GLU C 57 +I 3 4 N VAL C 58 ? N VAL C 58 O ILE C 79 ? O ILE C 79 +I 4 5 N VAL C 80 ? N VAL C 80 O GLU C 125 ? O GLU C 125 +J 1 2 N LEU C 40 ? N LEU C 40 O LEU C 63 ? O LEU C 63 +J 2 3 N VAL C 62 ? N VAL C 62 O ALA C 91 ? O ALA C 91 +J 3 4 N ALA C 91 ? N ALA C 91 O GLY C 130 ? O GLY C 130 +J 4 5 O VAL C 131 ? O VAL C 131 N LEU C 161 ? N LEU C 161 +K 1 2 N HIS C 238 ? N HIS C 238 O ILE C 241 ? O ILE C 241 +L 1 2 N THR C 251 ? N THR C 251 O MET C 260 ? O MET C 260 +M 1 2 N PHE C 269 ? N PHE C 269 O SER C 272 ? O SER C 272 +N 1 2 N LEU C 282 ? N LEU C 282 O THR C 290 ? O THR C 290 +O 1 2 O VAL C 300 ? O VAL C 300 N ARG C 308 ? N ARG C 308 +P 1 2 N ILE C 348 ? N ILE C 348 O GLU C 383 ? O GLU C 383 +P 2 3 N ILE C 384 ? N ILE C 384 O VAL C 408 ? O VAL C 408 +P 3 4 N ILE C 409 ? N ILE C 409 O GLU C 438 ? O GLU C 438 +Q 1 2 N PHE C 354 ? N PHE C 354 O TYR C 389 ? O TYR C 389 +Q 2 3 N LEU C 388 ? N LEU C 388 O SER C 420 ? O SER C 420 +Q 3 4 N SER C 420 ? N SER C 420 O LEU C 443 ? O LEU C 443 +Q 4 5 N ILE C 446 ? N ILE C 446 O LEU C 472 ? O LEU C 472 +R 1 2 N ARG C 514 ? N ARG C 514 O GLU C 517 ? O GLU C 517 +S 1 2 O ASN C 534 ? O ASN C 534 N HIS C 537 ? N HIS C 537 +T 1 2 N ASP C 570 ? N ASP C 570 O PHE C 573 ? O PHE C 573 +U 1 2 N PHE C 594 ? N PHE C 594 O GLN C 602 ? O GLN C 602 +# +_pdbx_entry_details.entry_id 1N8Z +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 O A ASP 1 ? ? NE2 A GLN 3 ? ? 2.05 +2 1 CG2 C THR 457 ? ? O C CYS 498 ? ? 2.15 +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 CB A ASP 151 ? ? CG A ASP 151 ? ? OD2 A ASP 151 ? ? 124.03 118.30 5.73 0.90 N +2 1 CB B ASP 215 ? ? CG B ASP 215 ? ? OD2 B ASP 215 ? ? 125.40 118.30 7.10 0.90 N +3 1 CB C ASP 22 ? ? CG C ASP 22 ? ? OD2 C ASP 22 ? ? 124.40 118.30 6.10 0.90 N +4 1 CB C ASP 54 ? ? CG C ASP 54 ? ? OD2 C ASP 54 ? ? 123.81 118.30 5.51 0.90 N +5 1 CB C ASP 395 ? ? CG C ASP 395 ? ? OD2 C ASP 395 ? ? 123.82 118.30 5.52 0.90 N +6 1 NE C ARG 477 ? ? CZ C ARG 477 ? ? NH2 C ARG 477 ? ? 117.15 120.30 -3.15 0.50 N +7 1 CB C ASP 560 ? ? CG C ASP 560 ? ? OD2 C ASP 560 ? ? 124.86 118.30 6.56 0.90 N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 ASN A 30 ? ? 50.39 -113.95 +2 1 ALA A 32 ? ? -66.58 56.69 +3 1 PRO A 40 ? ? -30.23 121.06 +4 1 ALA A 51 ? ? 71.08 -39.85 +5 1 SER A 52 ? ? -143.56 10.17 +6 1 ALA A 84 ? ? 175.34 165.17 +7 1 ARG A 108 ? ? -113.62 -166.83 +8 1 LYS A 126 ? ? -66.31 1.42 +9 1 ASN A 138 ? ? 62.64 60.88 +10 1 ASP A 151 ? ? 26.14 35.94 +11 1 ASN A 152 ? ? 90.44 14.61 +12 1 GLN A 199 ? ? -54.63 -9.02 +13 1 PRO A 204 ? ? -32.16 135.58 +14 1 SER A 208 ? ? -170.38 137.18 +15 1 GLU A 213 ? ? -87.13 32.98 +16 1 TRP B 99 ? ? -98.71 46.78 +17 1 SER B 134 ? ? -171.34 -178.21 +18 1 ASP B 151 ? ? 67.04 64.25 +19 1 HIS B 207 ? ? -117.78 76.86 +20 1 ASP C 8 ? ? -145.81 50.51 +21 1 LYS C 10 ? ? 45.98 -123.35 +22 1 GLU C 87 ? ? 36.02 39.06 +23 1 ASP C 88 ? ? 59.93 0.57 +24 1 ASP C 99 ? ? -48.70 151.60 +25 1 ARG C 135 ? ? 37.70 57.12 +26 1 TYR C 141 ? ? 84.97 -18.23 +27 1 LEU C 157 ? ? -64.05 2.14 +28 1 ARG C 166 ? ? -128.50 -126.60 +29 1 SER C 167 ? ? 155.98 -7.37 +30 1 SER C 187 ? ? -48.52 -12.07 +31 1 ARG C 195 ? ? -131.08 -37.77 +32 1 HIS C 215 ? ? -45.36 151.08 +33 1 HIS C 235 ? ? -132.10 -76.60 +34 1 PHE C 257 ? ? 85.19 25.52 +35 1 ALA C 271 ? ? -95.67 36.77 +36 1 LEU C 295 ? ? -41.66 150.01 +37 1 HIS C 296 ? ? 26.98 55.63 +38 1 SER C 313 ? ? -66.67 -74.79 +39 1 GLU C 326 ? ? 54.22 -134.16 +40 1 GLU C 341 ? ? -55.97 -9.90 +41 1 PHE C 359 ? ? -118.82 -118.64 +42 1 TRP C 393 ? ? -175.98 134.93 +43 1 LEU C 400 ? ? -97.27 34.09 +44 1 ASN C 416 ? ? 55.24 13.00 +45 1 ALA C 475 ? ? 45.18 29.08 +46 1 LEU C 487 ? ? -108.74 66.70 +47 1 VAL C 507 ? ? -71.21 -70.35 +48 1 GLN C 511 ? ? -117.56 -103.64 +49 1 LEU C 528 ? ? -52.48 -71.51 +50 1 ALA C 535 ? ? 34.46 59.21 +51 1 HIS C 567 ? ? -133.51 -90.29 +52 1 ASP C 596 ? ? -54.11 170.79 +# +_pdbx_validate_peptide_omega.id 1 +_pdbx_validate_peptide_omega.PDB_model_num 1 +_pdbx_validate_peptide_omega.auth_comp_id_1 SER +_pdbx_validate_peptide_omega.auth_asym_id_1 C +_pdbx_validate_peptide_omega.auth_seq_id_1 180 +_pdbx_validate_peptide_omega.PDB_ins_code_1 ? +_pdbx_validate_peptide_omega.label_alt_id_1 ? +_pdbx_validate_peptide_omega.auth_comp_id_2 ARG +_pdbx_validate_peptide_omega.auth_asym_id_2 C +_pdbx_validate_peptide_omega.auth_seq_id_2 181 +_pdbx_validate_peptide_omega.PDB_ins_code_2 ? +_pdbx_validate_peptide_omega.label_alt_id_2 ? +_pdbx_validate_peptide_omega.omega -147.04 +# +loop_ +_pdbx_struct_mod_residue.id +_pdbx_struct_mod_residue.label_asym_id +_pdbx_struct_mod_residue.label_comp_id +_pdbx_struct_mod_residue.label_seq_id +_pdbx_struct_mod_residue.auth_asym_id +_pdbx_struct_mod_residue.auth_comp_id +_pdbx_struct_mod_residue.auth_seq_id +_pdbx_struct_mod_residue.PDB_ins_code +_pdbx_struct_mod_residue.parent_comp_id +_pdbx_struct_mod_residue.details +1 C ASN 165 C ASN 165 ? ASN 'GLYCOSYLATION SITE' +2 C ASN 237 C ASN 237 ? ASN 'GLYCOSYLATION SITE' +# +_pdbx_database_remark.id 999 +_pdbx_database_remark.text +;SEQUENCE +The sequences of Herseptin Fab light chain (molecule A) +and heavy chain (molecule B) were not deposited into +any database. +; +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 C ASN 102 ? C ASN 102 +2 1 Y 1 C ASN 103 ? C ASN 103 +3 1 Y 1 C THR 104 ? C THR 104 +4 1 Y 1 C THR 105 ? C THR 105 +5 1 Y 1 C PRO 106 ? C PRO 106 +6 1 Y 1 C VAL 107 ? C VAL 107 +7 1 Y 1 C THR 108 ? C THR 108 +8 1 Y 1 C GLY 109 ? C GLY 109 +9 1 Y 1 C ALA 110 ? C ALA 110 +10 1 Y 1 C GLU 303 ? C GLU 303 +11 1 Y 1 C ASP 304 ? C ASP 304 +12 1 Y 1 C GLY 305 ? C GLY 305 +13 1 Y 1 C GLY 361 ? C GLY 361 +14 1 Y 1 C ASP 362 ? C ASP 362 +15 1 Y 1 C PRO 363 ? C PRO 363 +16 1 Y 1 C ALA 364 ? C ALA 364 +17 1 Y 1 C GLY 581 ? C GLY 581 +18 1 Y 1 C VAL 582 ? C VAL 582 +19 1 Y 1 C LYS 583 ? C LYS 583 +20 1 Y 1 C PRO 584 ? C PRO 584 +21 1 Y 1 C ASP 585 ? C ASP 585 +22 1 Y 1 C LEU 586 ? C LEU 586 +23 1 Y 1 C SER 587 ? C SER 587 +24 1 Y 1 C TYR 588 ? C TYR 588 +25 1 Y 1 C MET 589 ? C MET 589 +26 1 Y 1 C PRO 590 ? C PRO 590 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +GLN N N N N 88 +GLN CA C N S 89 +GLN C C N N 90 +GLN O O N N 91 +GLN CB C N N 92 +GLN CG C N N 93 +GLN CD C N N 94 +GLN OE1 O N N 95 +GLN NE2 N N N 96 +GLN OXT O N N 97 +GLN H H N N 98 +GLN H2 H N N 99 +GLN HA H N N 100 +GLN HB2 H N N 101 +GLN HB3 H N N 102 +GLN HG2 H N N 103 +GLN HG3 H N N 104 +GLN HE21 H N N 105 +GLN HE22 H N N 106 +GLN HXT H N N 107 +GLU N N N N 108 +GLU CA C N S 109 +GLU C C N N 110 +GLU O O N N 111 +GLU CB C N N 112 +GLU CG C N N 113 +GLU CD C N N 114 +GLU OE1 O N N 115 +GLU OE2 O N N 116 +GLU OXT O N N 117 +GLU H H N N 118 +GLU H2 H N N 119 +GLU HA H N N 120 +GLU HB2 H N N 121 +GLU HB3 H N N 122 +GLU HG2 H N N 123 +GLU HG3 H N N 124 +GLU HE2 H N N 125 +GLU HXT H N N 126 +GLY N N N N 127 +GLY CA C N N 128 +GLY C C N N 129 +GLY O O N N 130 +GLY OXT O N N 131 +GLY H H N N 132 +GLY H2 H N N 133 +GLY HA2 H N N 134 +GLY HA3 H N N 135 +GLY HXT H N N 136 +HIS N N N N 137 +HIS CA C N S 138 +HIS C C N N 139 +HIS O O N N 140 +HIS CB C N N 141 +HIS CG C Y N 142 +HIS ND1 N Y N 143 +HIS CD2 C Y N 144 +HIS CE1 C Y N 145 +HIS NE2 N Y N 146 +HIS OXT O N N 147 +HIS H H N N 148 +HIS H2 H N N 149 +HIS HA H N N 150 +HIS HB2 H N N 151 +HIS HB3 H N N 152 +HIS HD1 H N N 153 +HIS HD2 H N N 154 +HIS HE1 H N N 155 +HIS HE2 H N N 156 +HIS HXT H N N 157 +HOH O O N N 158 +HOH H1 H N N 159 +HOH H2 H N N 160 +ILE N N N N 161 +ILE CA C N S 162 +ILE C C N N 163 +ILE O O N N 164 +ILE CB C N S 165 +ILE CG1 C N N 166 +ILE CG2 C N N 167 +ILE CD1 C N N 168 +ILE OXT O N N 169 +ILE H H N N 170 +ILE H2 H N N 171 +ILE HA H N N 172 +ILE HB H N N 173 +ILE HG12 H N N 174 +ILE HG13 H N N 175 +ILE HG21 H N N 176 +ILE HG22 H N N 177 +ILE HG23 H N N 178 +ILE HD11 H N N 179 +ILE HD12 H N N 180 +ILE HD13 H N N 181 +ILE HXT H N N 182 +LEU N N N N 183 +LEU CA C N S 184 +LEU C C N N 185 +LEU O O N N 186 +LEU CB C N N 187 +LEU CG C N N 188 +LEU CD1 C N N 189 +LEU CD2 C N N 190 +LEU OXT O N N 191 +LEU H H N N 192 +LEU H2 H N N 193 +LEU HA H N N 194 +LEU HB2 H N N 195 +LEU HB3 H N N 196 +LEU HG H N N 197 +LEU HD11 H N N 198 +LEU HD12 H N N 199 +LEU HD13 H N N 200 +LEU HD21 H N N 201 +LEU HD22 H N N 202 +LEU HD23 H N N 203 +LEU HXT H N N 204 +LYS N N N N 205 +LYS CA C N S 206 +LYS C C N N 207 +LYS O O N N 208 +LYS CB C N N 209 +LYS CG C N N 210 +LYS CD C N N 211 +LYS CE C N N 212 +LYS NZ N N N 213 +LYS OXT O N N 214 +LYS H H N N 215 +LYS H2 H N N 216 +LYS HA H N N 217 +LYS HB2 H N N 218 +LYS HB3 H N N 219 +LYS HG2 H N N 220 +LYS HG3 H N N 221 +LYS HD2 H N N 222 +LYS HD3 H N N 223 +LYS HE2 H N N 224 +LYS HE3 H N N 225 +LYS HZ1 H N N 226 +LYS HZ2 H N N 227 +LYS HZ3 H N N 228 +LYS HXT H N N 229 +MET N N N N 230 +MET CA C N S 231 +MET C C N N 232 +MET O O N N 233 +MET CB C N N 234 +MET CG C N N 235 +MET SD S N N 236 +MET CE C N N 237 +MET OXT O N N 238 +MET H H N N 239 +MET H2 H N N 240 +MET HA H N N 241 +MET HB2 H N N 242 +MET HB3 H N N 243 +MET HG2 H N N 244 +MET HG3 H N N 245 +MET HE1 H N N 246 +MET HE2 H N N 247 +MET HE3 H N N 248 +MET HXT H N N 249 +NAG C1 C N R 250 +NAG C2 C N R 251 +NAG C3 C N R 252 +NAG C4 C N S 253 +NAG C5 C N R 254 +NAG C6 C N N 255 +NAG C7 C N N 256 +NAG C8 C N N 257 +NAG N2 N N N 258 +NAG O1 O N N 259 +NAG O3 O N N 260 +NAG O4 O N N 261 +NAG O5 O N N 262 +NAG O6 O N N 263 +NAG O7 O N N 264 +NAG H1 H N N 265 +NAG H2 H N N 266 +NAG H3 H N N 267 +NAG H4 H N N 268 +NAG H5 H N N 269 +NAG H61 H N N 270 +NAG H62 H N N 271 +NAG H81 H N N 272 +NAG H82 H N N 273 +NAG H83 H N N 274 +NAG HN2 H N N 275 +NAG HO1 H N N 276 +NAG HO3 H N N 277 +NAG HO4 H N N 278 +NAG HO6 H N N 279 +PHE N N N N 280 +PHE CA C N S 281 +PHE C C N N 282 +PHE O O N N 283 +PHE CB C N N 284 +PHE CG C Y N 285 +PHE CD1 C Y N 286 +PHE CD2 C Y N 287 +PHE CE1 C Y N 288 +PHE CE2 C Y N 289 +PHE CZ C Y N 290 +PHE OXT O N N 291 +PHE H H N N 292 +PHE H2 H N N 293 +PHE HA H N N 294 +PHE HB2 H N N 295 +PHE HB3 H N N 296 +PHE HD1 H N N 297 +PHE HD2 H N N 298 +PHE HE1 H N N 299 +PHE HE2 H N N 300 +PHE HZ H N N 301 +PHE HXT H N N 302 +PRO N N N N 303 +PRO CA C N S 304 +PRO C C N N 305 +PRO O O N N 306 +PRO CB C N N 307 +PRO CG C N N 308 +PRO CD C N N 309 +PRO OXT O N N 310 +PRO H H N N 311 +PRO HA H N N 312 +PRO HB2 H N N 313 +PRO HB3 H N N 314 +PRO HG2 H N N 315 +PRO HG3 H N N 316 +PRO HD2 H N N 317 +PRO HD3 H N N 318 +PRO HXT H N N 319 +SER N N N N 320 +SER CA C N S 321 +SER C C N N 322 +SER O O N N 323 +SER CB C N N 324 +SER OG O N N 325 +SER OXT O N N 326 +SER H H N N 327 +SER H2 H N N 328 +SER HA H N N 329 +SER HB2 H N N 330 +SER HB3 H N N 331 +SER HG H N N 332 +SER HXT H N N 333 +SO4 S S N N 334 +SO4 O1 O N N 335 +SO4 O2 O N N 336 +SO4 O3 O N N 337 +SO4 O4 O N N 338 +THR N N N N 339 +THR CA C N S 340 +THR C C N N 341 +THR O O N N 342 +THR CB C N R 343 +THR OG1 O N N 344 +THR CG2 C N N 345 +THR OXT O N N 346 +THR H H N N 347 +THR H2 H N N 348 +THR HA H N N 349 +THR HB H N N 350 +THR HG1 H N N 351 +THR HG21 H N N 352 +THR HG22 H N N 353 +THR HG23 H N N 354 +THR HXT H N N 355 +TRP N N N N 356 +TRP CA C N S 357 +TRP C C N N 358 +TRP O O N N 359 +TRP CB C N N 360 +TRP CG C Y N 361 +TRP CD1 C Y N 362 +TRP CD2 C Y N 363 +TRP NE1 N Y N 364 +TRP CE2 C Y N 365 +TRP CE3 C Y N 366 +TRP CZ2 C Y N 367 +TRP CZ3 C Y N 368 +TRP CH2 C Y N 369 +TRP OXT O N N 370 +TRP H H N N 371 +TRP H2 H N N 372 +TRP HA H N N 373 +TRP HB2 H N N 374 +TRP HB3 H N N 375 +TRP HD1 H N N 376 +TRP HE1 H N N 377 +TRP HE3 H N N 378 +TRP HZ2 H N N 379 +TRP HZ3 H N N 380 +TRP HH2 H N N 381 +TRP HXT H N N 382 +TYR N N N N 383 +TYR CA C N S 384 +TYR C C N N 385 +TYR O O N N 386 +TYR CB C N N 387 +TYR CG C Y N 388 +TYR CD1 C Y N 389 +TYR CD2 C Y N 390 +TYR CE1 C Y N 391 +TYR CE2 C Y N 392 +TYR CZ C Y N 393 +TYR OH O N N 394 +TYR OXT O N N 395 +TYR H H N N 396 +TYR H2 H N N 397 +TYR HA H N N 398 +TYR HB2 H N N 399 +TYR HB3 H N N 400 +TYR HD1 H N N 401 +TYR HD2 H N N 402 +TYR HE1 H N N 403 +TYR HE2 H N N 404 +TYR HH H N N 405 +TYR HXT H N N 406 +VAL N N N N 407 +VAL CA C N S 408 +VAL C C N N 409 +VAL O O N N 410 +VAL CB C N N 411 +VAL CG1 C N N 412 +VAL CG2 C N N 413 +VAL OXT O N N 414 +VAL H H N N 415 +VAL H2 H N N 416 +VAL HA H N N 417 +VAL HB H N N 418 +VAL HG11 H N N 419 +VAL HG12 H N N 420 +VAL HG13 H N N 421 +VAL HG21 H N N 422 +VAL HG22 H N N 423 +VAL HG23 H N N 424 +VAL HXT H N N 425 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +GLN N CA sing N N 83 +GLN N H sing N N 84 +GLN N H2 sing N N 85 +GLN CA C sing N N 86 +GLN CA CB sing N N 87 +GLN CA HA sing N N 88 +GLN C O doub N N 89 +GLN C OXT sing N N 90 +GLN CB CG sing N N 91 +GLN CB HB2 sing N N 92 +GLN CB HB3 sing N N 93 +GLN CG CD sing N N 94 +GLN CG HG2 sing N N 95 +GLN CG HG3 sing N N 96 +GLN CD OE1 doub N N 97 +GLN CD NE2 sing N N 98 +GLN NE2 HE21 sing N N 99 +GLN NE2 HE22 sing N N 100 +GLN OXT HXT sing N N 101 +GLU N CA sing N N 102 +GLU N H sing N N 103 +GLU N H2 sing N N 104 +GLU CA C sing N N 105 +GLU CA CB sing N N 106 +GLU CA HA sing N N 107 +GLU C O doub N N 108 +GLU C OXT sing N N 109 +GLU CB CG sing N N 110 +GLU CB HB2 sing N N 111 +GLU CB HB3 sing N N 112 +GLU CG CD sing N N 113 +GLU CG HG2 sing N N 114 +GLU CG HG3 sing N N 115 +GLU CD OE1 doub N N 116 +GLU CD OE2 sing N N 117 +GLU OE2 HE2 sing N N 118 +GLU OXT HXT sing N N 119 +GLY N CA sing N N 120 +GLY N H sing N N 121 +GLY N H2 sing N N 122 +GLY CA C sing N N 123 +GLY CA HA2 sing N N 124 +GLY CA HA3 sing N N 125 +GLY C O doub N N 126 +GLY C OXT sing N N 127 +GLY OXT HXT sing N N 128 +HIS N CA sing N N 129 +HIS N H sing N N 130 +HIS N H2 sing N N 131 +HIS CA C sing N N 132 +HIS CA CB sing N N 133 +HIS CA HA sing N N 134 +HIS C O doub N N 135 +HIS C OXT sing N N 136 +HIS CB CG sing N N 137 +HIS CB HB2 sing N N 138 +HIS CB HB3 sing N N 139 +HIS CG ND1 sing Y N 140 +HIS CG CD2 doub Y N 141 +HIS ND1 CE1 doub Y N 142 +HIS ND1 HD1 sing N N 143 +HIS CD2 NE2 sing Y N 144 +HIS CD2 HD2 sing N N 145 +HIS CE1 NE2 sing Y N 146 +HIS CE1 HE1 sing N N 147 +HIS NE2 HE2 sing N N 148 +HIS OXT HXT sing N N 149 +HOH O H1 sing N N 150 +HOH O H2 sing N N 151 +ILE N CA sing N N 152 +ILE N H sing N N 153 +ILE N H2 sing N N 154 +ILE CA C sing N N 155 +ILE CA CB sing N N 156 +ILE CA HA sing N N 157 +ILE C O doub N N 158 +ILE C OXT sing N N 159 +ILE CB CG1 sing N N 160 +ILE CB CG2 sing N N 161 +ILE CB HB sing N N 162 +ILE CG1 CD1 sing N N 163 +ILE CG1 HG12 sing N N 164 +ILE CG1 HG13 sing N N 165 +ILE CG2 HG21 sing N N 166 +ILE CG2 HG22 sing N N 167 +ILE CG2 HG23 sing N N 168 +ILE CD1 HD11 sing N N 169 +ILE CD1 HD12 sing N N 170 +ILE CD1 HD13 sing N N 171 +ILE OXT HXT sing N N 172 +LEU N CA sing N N 173 +LEU N H sing N N 174 +LEU N H2 sing N N 175 +LEU CA C sing N N 176 +LEU CA CB sing N N 177 +LEU CA HA sing N N 178 +LEU C O doub N N 179 +LEU C OXT sing N N 180 +LEU CB CG sing N N 181 +LEU CB HB2 sing N N 182 +LEU CB HB3 sing N N 183 +LEU CG CD1 sing N N 184 +LEU CG CD2 sing N N 185 +LEU CG HG sing N N 186 +LEU CD1 HD11 sing N N 187 +LEU CD1 HD12 sing N N 188 +LEU CD1 HD13 sing N N 189 +LEU CD2 HD21 sing N N 190 +LEU CD2 HD22 sing N N 191 +LEU CD2 HD23 sing N N 192 +LEU OXT HXT sing N N 193 +LYS N CA sing N N 194 +LYS N H sing N N 195 +LYS N H2 sing N N 196 +LYS CA C sing N N 197 +LYS CA CB sing N N 198 +LYS CA HA sing N N 199 +LYS C O doub N N 200 +LYS C OXT sing N N 201 +LYS CB CG sing N N 202 +LYS CB HB2 sing N N 203 +LYS CB HB3 sing N N 204 +LYS CG CD sing N N 205 +LYS CG HG2 sing N N 206 +LYS CG HG3 sing N N 207 +LYS CD CE sing N N 208 +LYS CD HD2 sing N N 209 +LYS CD HD3 sing N N 210 +LYS CE NZ sing N N 211 +LYS CE HE2 sing N N 212 +LYS CE HE3 sing N N 213 +LYS NZ HZ1 sing N N 214 +LYS NZ HZ2 sing N N 215 +LYS NZ HZ3 sing N N 216 +LYS OXT HXT sing N N 217 +MET N CA sing N N 218 +MET N H sing N N 219 +MET N H2 sing N N 220 +MET CA C sing N N 221 +MET CA CB sing N N 222 +MET CA HA sing N N 223 +MET C O doub N N 224 +MET C OXT sing N N 225 +MET CB CG sing N N 226 +MET CB HB2 sing N N 227 +MET CB HB3 sing N N 228 +MET CG SD sing N N 229 +MET CG HG2 sing N N 230 +MET CG HG3 sing N N 231 +MET SD CE sing N N 232 +MET CE HE1 sing N N 233 +MET CE HE2 sing N N 234 +MET CE HE3 sing N N 235 +MET OXT HXT sing N N 236 +NAG C1 C2 sing N N 237 +NAG C1 O1 sing N N 238 +NAG C1 O5 sing N N 239 +NAG C1 H1 sing N N 240 +NAG C2 C3 sing N N 241 +NAG C2 N2 sing N N 242 +NAG C2 H2 sing N N 243 +NAG C3 C4 sing N N 244 +NAG C3 O3 sing N N 245 +NAG C3 H3 sing N N 246 +NAG C4 C5 sing N N 247 +NAG C4 O4 sing N N 248 +NAG C4 H4 sing N N 249 +NAG C5 C6 sing N N 250 +NAG C5 O5 sing N N 251 +NAG C5 H5 sing N N 252 +NAG C6 O6 sing N N 253 +NAG C6 H61 sing N N 254 +NAG C6 H62 sing N N 255 +NAG C7 C8 sing N N 256 +NAG C7 N2 sing N N 257 +NAG C7 O7 doub N N 258 +NAG C8 H81 sing N N 259 +NAG C8 H82 sing N N 260 +NAG C8 H83 sing N N 261 +NAG N2 HN2 sing N N 262 +NAG O1 HO1 sing N N 263 +NAG O3 HO3 sing N N 264 +NAG O4 HO4 sing N N 265 +NAG O6 HO6 sing N N 266 +PHE N CA sing N N 267 +PHE N H sing N N 268 +PHE N H2 sing N N 269 +PHE CA C sing N N 270 +PHE CA CB sing N N 271 +PHE CA HA sing N N 272 +PHE C O doub N N 273 +PHE C OXT sing N N 274 +PHE CB CG sing N N 275 +PHE CB HB2 sing N N 276 +PHE CB HB3 sing N N 277 +PHE CG CD1 doub Y N 278 +PHE CG CD2 sing Y N 279 +PHE CD1 CE1 sing Y N 280 +PHE CD1 HD1 sing N N 281 +PHE CD2 CE2 doub Y N 282 +PHE CD2 HD2 sing N N 283 +PHE CE1 CZ doub Y N 284 +PHE CE1 HE1 sing N N 285 +PHE CE2 CZ sing Y N 286 +PHE CE2 HE2 sing N N 287 +PHE CZ HZ sing N N 288 +PHE OXT HXT sing N N 289 +PRO N CA sing N N 290 +PRO N CD sing N N 291 +PRO N H sing N N 292 +PRO CA C sing N N 293 +PRO CA CB sing N N 294 +PRO CA HA sing N N 295 +PRO C O doub N N 296 +PRO C OXT sing N N 297 +PRO CB CG sing N N 298 +PRO CB HB2 sing N N 299 +PRO CB HB3 sing N N 300 +PRO CG CD sing N N 301 +PRO CG HG2 sing N N 302 +PRO CG HG3 sing N N 303 +PRO CD HD2 sing N N 304 +PRO CD HD3 sing N N 305 +PRO OXT HXT sing N N 306 +SER N CA sing N N 307 +SER N H sing N N 308 +SER N H2 sing N N 309 +SER CA C sing N N 310 +SER CA CB sing N N 311 +SER CA HA sing N N 312 +SER C O doub N N 313 +SER C OXT sing N N 314 +SER CB OG sing N N 315 +SER CB HB2 sing N N 316 +SER CB HB3 sing N N 317 +SER OG HG sing N N 318 +SER OXT HXT sing N N 319 +SO4 S O1 doub N N 320 +SO4 S O2 doub N N 321 +SO4 S O3 sing N N 322 +SO4 S O4 sing N N 323 +THR N CA sing N N 324 +THR N H sing N N 325 +THR N H2 sing N N 326 +THR CA C sing N N 327 +THR CA CB sing N N 328 +THR CA HA sing N N 329 +THR C O doub N N 330 +THR C OXT sing N N 331 +THR CB OG1 sing N N 332 +THR CB CG2 sing N N 333 +THR CB HB sing N N 334 +THR OG1 HG1 sing N N 335 +THR CG2 HG21 sing N N 336 +THR CG2 HG22 sing N N 337 +THR CG2 HG23 sing N N 338 +THR OXT HXT sing N N 339 +TRP N CA sing N N 340 +TRP N H sing N N 341 +TRP N H2 sing N N 342 +TRP CA C sing N N 343 +TRP CA CB sing N N 344 +TRP CA HA sing N N 345 +TRP C O doub N N 346 +TRP C OXT sing N N 347 +TRP CB CG sing N N 348 +TRP CB HB2 sing N N 349 +TRP CB HB3 sing N N 350 +TRP CG CD1 doub Y N 351 +TRP CG CD2 sing Y N 352 +TRP CD1 NE1 sing Y N 353 +TRP CD1 HD1 sing N N 354 +TRP CD2 CE2 doub Y N 355 +TRP CD2 CE3 sing Y N 356 +TRP NE1 CE2 sing Y N 357 +TRP NE1 HE1 sing N N 358 +TRP CE2 CZ2 sing Y N 359 +TRP CE3 CZ3 doub Y N 360 +TRP CE3 HE3 sing N N 361 +TRP CZ2 CH2 doub Y N 362 +TRP CZ2 HZ2 sing N N 363 +TRP CZ3 CH2 sing Y N 364 +TRP CZ3 HZ3 sing N N 365 +TRP CH2 HH2 sing N N 366 +TRP OXT HXT sing N N 367 +TYR N CA sing N N 368 +TYR N H sing N N 369 +TYR N H2 sing N N 370 +TYR CA C sing N N 371 +TYR CA CB sing N N 372 +TYR CA HA sing N N 373 +TYR C O doub N N 374 +TYR C OXT sing N N 375 +TYR CB CG sing N N 376 +TYR CB HB2 sing N N 377 +TYR CB HB3 sing N N 378 +TYR CG CD1 doub Y N 379 +TYR CG CD2 sing Y N 380 +TYR CD1 CE1 sing Y N 381 +TYR CD1 HD1 sing N N 382 +TYR CD2 CE2 doub Y N 383 +TYR CD2 HD2 sing N N 384 +TYR CE1 CZ doub Y N 385 +TYR CE1 HE1 sing N N 386 +TYR CE2 CZ sing Y N 387 +TYR CE2 HE2 sing N N 388 +TYR CZ OH sing N N 389 +TYR OH HH sing N N 390 +TYR OXT HXT sing N N 391 +VAL N CA sing N N 392 +VAL N H sing N N 393 +VAL N H2 sing N N 394 +VAL CA C sing N N 395 +VAL CA CB sing N N 396 +VAL CA HA sing N N 397 +VAL C O doub N N 398 +VAL C OXT sing N N 399 +VAL CB CG1 sing N N 400 +VAL CB CG2 sing N N 401 +VAL CB HB sing N N 402 +VAL CG1 HG11 sing N N 403 +VAL CG1 HG12 sing N N 404 +VAL CG1 HG13 sing N N 405 +VAL CG2 HG21 sing N N 406 +VAL CG2 HG22 sing N N 407 +VAL CG2 HG23 sing N N 408 +VAL OXT HXT sing N N 409 +# +_pdbx_initial_refinement_model.id 1 +_pdbx_initial_refinement_model.entity_id_list ? +_pdbx_initial_refinement_model.type 'experimental model' +_pdbx_initial_refinement_model.source_name PDB +_pdbx_initial_refinement_model.accession_code 1M6B +_pdbx_initial_refinement_model.details 'PDB 1M6B' +# +_atom_sites.entry_id 1N8Z +_atom_sites.fract_transf_matrix[1][1] 0.015113 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.009110 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.005710 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . ASP A 1 1 ? 34.539 88.752 88.298 1.00 30.87 ? 1 ASP A N 1 +ATOM 2 C CA . ASP A 1 1 ? 34.791 87.461 89.035 1.00 30.75 ? 1 ASP A CA 1 +ATOM 3 C C . ASP A 1 1 ? 35.907 86.779 88.254 1.00 29.03 ? 1 ASP A C 1 +ATOM 4 O O . ASP A 1 1 ? 35.694 86.356 87.114 1.00 29.42 ? 1 ASP A O 1 +ATOM 5 C CB . ASP A 1 1 ? 33.536 86.583 89.061 1.00 30.97 ? 1 ASP A CB 1 +ATOM 6 C CG . ASP A 1 1 ? 33.394 85.795 90.340 1.00 33.98 ? 1 ASP A CG 1 +ATOM 7 O OD1 . ASP A 1 1 ? 34.124 84.785 90.560 1.00 37.66 ? 1 ASP A OD1 1 +ATOM 8 O OD2 . ASP A 1 1 ? 32.524 86.084 91.184 1.00 38.04 ? 1 ASP A OD2 1 +ATOM 9 N N . ILE A 1 2 ? 37.101 86.698 88.840 1.00 26.30 ? 2 ILE A N 1 +ATOM 10 C CA . ILE A 1 2 ? 38.253 86.374 88.028 1.00 22.98 ? 2 ILE A CA 1 +ATOM 11 C C . ILE A 1 2 ? 38.245 84.918 87.617 1.00 21.67 ? 2 ILE A C 1 +ATOM 12 O O . ILE A 1 2 ? 38.057 84.017 88.417 1.00 20.42 ? 2 ILE A O 1 +ATOM 13 C CB . ILE A 1 2 ? 39.542 86.849 88.674 1.00 22.50 ? 2 ILE A CB 1 +ATOM 14 C CG1 . ILE A 1 2 ? 39.474 88.365 88.817 1.00 21.74 ? 2 ILE A CG1 1 +ATOM 15 C CG2 . ILE A 1 2 ? 40.727 86.441 87.836 1.00 21.48 ? 2 ILE A CG2 1 +ATOM 16 C CD1 . ILE A 1 2 ? 40.678 89.023 89.498 1.00 23.80 ? 2 ILE A CD1 1 +ATOM 17 N N . GLN A 1 3 ? 38.398 84.735 86.319 1.00 20.83 ? 3 GLN A N 1 +ATOM 18 C CA . GLN A 1 3 ? 38.371 83.435 85.699 1.00 20.08 ? 3 GLN A CA 1 +ATOM 19 C C . GLN A 1 3 ? 39.807 83.097 85.415 1.00 18.56 ? 3 GLN A C 1 +ATOM 20 O O . GLN A 1 3 ? 40.621 83.999 85.160 1.00 18.76 ? 3 GLN A O 1 +ATOM 21 C CB . GLN A 1 3 ? 37.512 83.476 84.419 1.00 20.92 ? 3 GLN A CB 1 +ATOM 22 C CG . GLN A 1 3 ? 35.974 83.870 84.654 1.00 23.86 ? 3 GLN A CG 1 +ATOM 23 C CD . GLN A 1 3 ? 35.604 85.325 84.173 1.00 29.74 ? 3 GLN A CD 1 +ATOM 24 O OE1 . GLN A 1 3 ? 35.635 85.652 82.968 1.00 30.18 ? 3 GLN A OE1 1 +ATOM 25 N NE2 . GLN A 1 3 ? 35.251 86.179 85.124 1.00 33.10 ? 3 GLN A NE2 1 +ATOM 26 N N . MET A 1 4 ? 40.122 81.810 85.511 1.00 16.52 ? 4 MET A N 1 +ATOM 27 C CA . MET A 1 4 ? 41.454 81.275 85.277 1.00 15.09 ? 4 MET A CA 1 +ATOM 28 C C . MET A 1 4 ? 41.365 80.194 84.245 1.00 14.61 ? 4 MET A C 1 +ATOM 29 O O . MET A 1 4 ? 40.836 79.114 84.545 1.00 15.71 ? 4 MET A O 1 +ATOM 30 C CB . MET A 1 4 ? 41.997 80.639 86.560 1.00 14.90 ? 4 MET A CB 1 +ATOM 31 C CG . MET A 1 4 ? 42.219 81.649 87.695 1.00 15.39 ? 4 MET A CG 1 +ATOM 32 S SD . MET A 1 4 ? 43.724 82.677 87.583 1.00 15.99 ? 4 MET A SD 1 +ATOM 33 C CE . MET A 1 4 ? 44.416 82.208 86.203 1.00 20.31 ? 4 MET A CE 1 +ATOM 34 N N . THR A 1 5 ? 41.879 80.439 83.046 1.00 13.30 ? 5 THR A N 1 +ATOM 35 C CA . THR A 1 5 ? 41.751 79.468 81.964 1.00 13.22 ? 5 THR A CA 1 +ATOM 36 C C . THR A 1 5 ? 42.990 78.638 81.886 1.00 13.35 ? 5 THR A C 1 +ATOM 37 O O . THR A 1 5 ? 44.067 79.119 81.500 1.00 12.65 ? 5 THR A O 1 +ATOM 38 C CB . THR A 1 5 ? 41.591 80.160 80.639 1.00 13.63 ? 5 THR A CB 1 +ATOM 39 O OG1 . THR A 1 5 ? 40.473 81.044 80.717 1.00 16.67 ? 5 THR A OG1 1 +ATOM 40 C CG2 . THR A 1 5 ? 41.261 79.156 79.497 1.00 11.66 ? 5 THR A CG2 1 +ATOM 41 N N . GLN A 1 6 ? 42.823 77.353 82.183 1.00 14.17 ? 6 GLN A N 1 +ATOM 42 C CA . GLN A 1 6 ? 43.963 76.464 82.316 1.00 14.17 ? 6 GLN A CA 1 +ATOM 43 C C . GLN A 1 6 ? 44.100 75.660 81.057 1.00 14.86 ? 6 GLN A C 1 +ATOM 44 O O . GLN A 1 6 ? 43.144 75.021 80.632 1.00 14.78 ? 6 GLN A O 1 +ATOM 45 C CB . GLN A 1 6 ? 43.763 75.545 83.507 1.00 13.40 ? 6 GLN A CB 1 +ATOM 46 C CG . GLN A 1 6 ? 45.034 75.138 84.059 1.00 13.93 ? 6 GLN A CG 1 +ATOM 47 C CD . GLN A 1 6 ? 44.963 74.368 85.330 1.00 13.05 ? 6 GLN A CD 1 +ATOM 48 O OE1 . GLN A 1 6 ? 45.815 73.551 85.560 1.00 17.74 ? 6 GLN A OE1 1 +ATOM 49 N NE2 . GLN A 1 6 ? 44.021 74.661 86.183 1.00 11.59 ? 6 GLN A NE2 1 +ATOM 50 N N . SER A 1 7 ? 45.284 75.671 80.462 1.00 15.40 ? 7 SER A N 1 +ATOM 51 C CA . SER A 1 7 ? 45.530 74.737 79.389 1.00 16.30 ? 7 SER A CA 1 +ATOM 52 C C . SER A 1 7 ? 46.906 74.085 79.472 1.00 15.74 ? 7 SER A C 1 +ATOM 53 O O . SER A 1 7 ? 47.801 74.654 80.114 1.00 16.51 ? 7 SER A O 1 +ATOM 54 C CB . SER A 1 7 ? 45.293 75.410 78.040 1.00 17.40 ? 7 SER A CB 1 +ATOM 55 O OG . SER A 1 7 ? 46.331 76.302 77.753 1.00 20.36 ? 7 SER A OG 1 +ATOM 56 N N . PRO A 1 8 ? 47.063 72.886 78.884 1.00 14.47 ? 8 PRO A N 1 +ATOM 57 C CA . PRO A 1 8 ? 45.964 72.185 78.230 1.00 13.73 ? 8 PRO A CA 1 +ATOM 58 C C . PRO A 1 8 ? 45.193 71.428 79.277 1.00 14.34 ? 8 PRO A C 1 +ATOM 59 O O . PRO A 1 8 ? 45.633 71.345 80.425 1.00 14.63 ? 8 PRO A O 1 +ATOM 60 C CB . PRO A 1 8 ? 46.671 71.196 77.343 1.00 12.94 ? 8 PRO A CB 1 +ATOM 61 C CG . PRO A 1 8 ? 47.882 70.864 78.067 1.00 13.01 ? 8 PRO A CG 1 +ATOM 62 C CD . PRO A 1 8 ? 48.305 72.096 78.835 1.00 14.04 ? 8 PRO A CD 1 +ATOM 63 N N . SER A 1 9 ? 44.063 70.864 78.883 1.00 14.12 ? 9 SER A N 1 +ATOM 64 C CA . SER A 1 9 ? 43.270 70.148 79.838 1.00 14.21 ? 9 SER A CA 1 +ATOM 65 C C . SER A 1 9 ? 43.915 68.800 80.176 1.00 13.42 ? 9 SER A C 1 +ATOM 66 O O . SER A 1 9 ? 43.683 68.257 81.267 1.00 12.87 ? 9 SER A O 1 +ATOM 67 C CB . SER A 1 9 ? 41.841 70.009 79.316 1.00 14.51 ? 9 SER A CB 1 +ATOM 68 O OG . SER A 1 9 ? 41.838 69.194 78.181 1.00 16.53 ? 9 SER A OG 1 +ATOM 69 N N . SER A 1 10 ? 44.719 68.266 79.258 1.00 12.04 ? 10 SER A N 1 +ATOM 70 C CA . SER A 1 10 ? 45.483 67.075 79.573 1.00 12.20 ? 10 SER A CA 1 +ATOM 71 C C . SER A 1 10 ? 46.730 66.957 78.703 1.00 12.74 ? 10 SER A C 1 +ATOM 72 O O . SER A 1 10 ? 46.746 67.449 77.580 1.00 12.71 ? 10 SER A O 1 +ATOM 73 C CB . SER A 1 10 ? 44.623 65.824 79.474 1.00 11.85 ? 10 SER A CB 1 +ATOM 74 O OG . SER A 1 10 ? 44.604 65.325 78.150 1.00 12.91 ? 10 SER A OG 1 +ATOM 75 N N . LEU A 1 11 ? 47.782 66.335 79.237 1.00 12.34 ? 11 LEU A N 1 +ATOM 76 C CA . LEU A 1 11 ? 49.004 66.174 78.472 1.00 13.21 ? 11 LEU A CA 1 +ATOM 77 C C . LEU A 1 11 ? 49.680 64.836 78.738 1.00 13.08 ? 11 LEU A C 1 +ATOM 78 O O . LEU A 1 11 ? 49.494 64.242 79.784 1.00 13.27 ? 11 LEU A O 1 +ATOM 79 C CB . LEU A 1 11 ? 49.980 67.372 78.647 1.00 13.46 ? 11 LEU A CB 1 +ATOM 80 C CG . LEU A 1 11 ? 50.615 67.641 80.027 1.00 15.99 ? 11 LEU A CG 1 +ATOM 81 C CD1 . LEU A 1 11 ? 51.812 66.704 80.282 1.00 15.38 ? 11 LEU A CD1 1 +ATOM 82 C CD2 . LEU A 1 11 ? 51.005 69.118 80.253 1.00 13.61 ? 11 LEU A CD2 1 +ATOM 83 N N . SER A 1 12 ? 50.437 64.365 77.757 1.00 13.10 ? 12 SER A N 1 +ATOM 84 C CA . SER A 1 12 ? 51.230 63.159 77.887 1.00 13.49 ? 12 SER A CA 1 +ATOM 85 C C . SER A 1 12 ? 52.681 63.564 77.822 1.00 12.78 ? 12 SER A C 1 +ATOM 86 O O . SER A 1 12 ? 53.126 64.256 76.884 1.00 12.65 ? 12 SER A O 1 +ATOM 87 C CB . SER A 1 12 ? 50.923 62.214 76.722 1.00 14.27 ? 12 SER A CB 1 +ATOM 88 O OG . SER A 1 12 ? 50.295 61.023 77.197 1.00 18.11 ? 12 SER A OG 1 +ATOM 89 N N . ALA A 1 13 ? 53.435 63.193 78.834 1.00 11.97 ? 13 ALA A N 1 +ATOM 90 C CA . ALA A 1 13 ? 54.879 63.379 78.749 1.00 11.69 ? 13 ALA A CA 1 +ATOM 91 C C . ALA A 1 13 ? 55.565 62.110 79.239 1.00 11.56 ? 13 ALA A C 1 +ATOM 92 O O . ALA A 1 13 ? 54.920 61.288 79.893 1.00 12.89 ? 13 ALA A O 1 +ATOM 93 C CB . ALA A 1 13 ? 55.290 64.564 79.523 1.00 9.72 ? 13 ALA A CB 1 +ATOM 94 N N . SER A 1 14 ? 56.846 61.937 78.926 1.00 10.83 ? 14 SER A N 1 +ATOM 95 C CA . SER A 1 14 ? 57.629 60.860 79.522 1.00 10.30 ? 14 SER A CA 1 +ATOM 96 C C . SER A 1 14 ? 58.595 61.300 80.641 1.00 10.70 ? 14 SER A C 1 +ATOM 97 O O . SER A 1 14 ? 58.937 62.460 80.779 1.00 10.27 ? 14 SER A O 1 +ATOM 98 C CB . SER A 1 14 ? 58.418 60.166 78.442 1.00 10.33 ? 14 SER A CB 1 +ATOM 99 O OG . SER A 1 14 ? 57.569 59.555 77.498 1.00 9.39 ? 14 SER A OG 1 +ATOM 100 N N . VAL A 1 15 ? 59.072 60.325 81.410 1.00 11.55 ? 15 VAL A N 1 +ATOM 101 C CA . VAL A 1 15 ? 60.074 60.533 82.451 1.00 10.98 ? 15 VAL A CA 1 +ATOM 102 C C . VAL A 1 15 ? 61.237 61.299 81.850 1.00 11.39 ? 15 VAL A C 1 +ATOM 103 O O . VAL A 1 15 ? 61.706 60.992 80.757 1.00 12.57 ? 15 VAL A O 1 +ATOM 104 C CB . VAL A 1 15 ? 60.570 59.150 83.038 1.00 10.64 ? 15 VAL A CB 1 +ATOM 105 C CG1 . VAL A 1 15 ? 61.714 59.341 84.025 1.00 10.01 ? 15 VAL A CG1 1 +ATOM 106 C CG2 . VAL A 1 15 ? 59.445 58.459 83.730 1.00 8.46 ? 15 VAL A CG2 1 +ATOM 107 N N . GLY A 1 16 ? 61.712 62.279 82.578 1.00 11.20 ? 16 GLY A N 1 +ATOM 108 C CA . GLY A 1 16 ? 62.817 63.092 82.131 1.00 11.26 ? 16 GLY A CA 1 +ATOM 109 C C . GLY A 1 16 ? 62.346 64.353 81.472 1.00 11.50 ? 16 GLY A C 1 +ATOM 110 O O . GLY A 1 16 ? 63.110 65.275 81.323 1.00 11.42 ? 16 GLY A O 1 +ATOM 111 N N . ASP A 1 17 ? 61.087 64.387 81.064 1.00 12.30 ? 17 ASP A N 1 +ATOM 112 C CA . ASP A 1 17 ? 60.572 65.521 80.307 1.00 13.40 ? 17 ASP A CA 1 +ATOM 113 C C . ASP A 1 17 ? 60.418 66.860 81.073 1.00 13.60 ? 17 ASP A C 1 +ATOM 114 O O . ASP A 1 17 ? 60.404 66.940 82.302 1.00 13.10 ? 17 ASP A O 1 +ATOM 115 C CB . ASP A 1 17 ? 59.265 65.127 79.634 1.00 13.33 ? 17 ASP A CB 1 +ATOM 116 C CG . ASP A 1 17 ? 59.400 65.079 78.128 1.00 16.59 ? 17 ASP A CG 1 +ATOM 117 O OD1 . ASP A 1 17 ? 58.834 64.130 77.481 1.00 12.90 ? 17 ASP A OD1 1 +ATOM 118 O OD2 . ASP A 1 17 ? 60.073 65.975 77.526 1.00 20.18 ? 17 ASP A OD2 1 +ATOM 119 N N . ARG A 1 18 ? 60.292 67.925 80.314 1.00 14.34 ? 18 ARG A N 1 +ATOM 120 C CA . ARG A 1 18 ? 60.125 69.251 80.874 1.00 14.57 ? 18 ARG A CA 1 +ATOM 121 C C . ARG A 1 18 ? 58.705 69.594 80.507 1.00 14.43 ? 18 ARG A C 1 +ATOM 122 O O . ARG A 1 18 ? 58.412 69.831 79.359 1.00 14.86 ? 18 ARG A O 1 +ATOM 123 C CB . ARG A 1 18 ? 61.120 70.172 80.200 1.00 13.90 ? 18 ARG A CB 1 +ATOM 124 C CG . ARG A 1 18 ? 60.993 71.654 80.504 1.00 18.57 ? 18 ARG A CG 1 +ATOM 125 C CD . ARG A 1 18 ? 62.152 72.489 79.916 1.00 22.02 ? 18 ARG A CD 1 +ATOM 126 N NE . ARG A 1 18 ? 62.370 73.727 80.668 1.00 25.09 ? 18 ARG A NE 1 +ATOM 127 C CZ . ARG A 1 18 ? 61.607 74.817 80.540 1.00 26.51 ? 18 ARG A CZ 1 +ATOM 128 N NH1 . ARG A 1 18 ? 60.547 74.828 79.705 1.00 24.55 ? 18 ARG A NH1 1 +ATOM 129 N NH2 . ARG A 1 18 ? 61.901 75.900 81.248 1.00 26.39 ? 18 ARG A NH2 1 +ATOM 130 N N . VAL A 1 19 ? 57.808 69.582 81.472 1.00 15.05 ? 19 VAL A N 1 +ATOM 131 C CA . VAL A 1 19 ? 56.398 69.769 81.190 1.00 15.89 ? 19 VAL A CA 1 +ATOM 132 C C . VAL A 1 19 ? 56.006 71.148 81.591 1.00 16.19 ? 19 VAL A C 1 +ATOM 133 O O . VAL A 1 19 ? 56.511 71.627 82.556 1.00 17.02 ? 19 VAL A O 1 +ATOM 134 C CB . VAL A 1 19 ? 55.578 68.800 82.007 1.00 16.35 ? 19 VAL A CB 1 +ATOM 135 C CG1 . VAL A 1 19 ? 54.143 69.172 81.953 1.00 16.00 ? 19 VAL A CG1 1 +ATOM 136 C CG2 . VAL A 1 19 ? 55.784 67.365 81.481 1.00 17.14 ? 19 VAL A CG2 1 +ATOM 137 N N . THR A 1 20 ? 55.069 71.758 80.873 1.00 17.41 ? 20 THR A N 1 +ATOM 138 C CA . THR A 1 20 ? 54.636 73.150 81.051 1.00 18.16 ? 20 THR A CA 1 +ATOM 139 C C . THR A 1 20 ? 53.112 73.223 81.202 1.00 17.74 ? 20 THR A C 1 +ATOM 140 O O . THR A 1 20 ? 52.402 72.607 80.446 1.00 18.50 ? 20 THR A O 1 +ATOM 141 C CB . THR A 1 20 ? 55.144 73.968 79.810 1.00 18.59 ? 20 THR A CB 1 +ATOM 142 O OG1 . THR A 1 20 ? 56.429 74.496 80.125 1.00 22.60 ? 20 THR A OG1 1 +ATOM 143 C CG2 . THR A 1 20 ? 54.367 75.264 79.555 1.00 20.36 ? 20 THR A CG2 1 +ATOM 144 N N . ILE A 1 21 ? 52.583 73.941 82.179 1.00 17.53 ? 21 ILE A N 1 +ATOM 145 C CA . ILE A 1 21 ? 51.134 74.037 82.289 1.00 17.17 ? 21 ILE A CA 1 +ATOM 146 C C . ILE A 1 21 ? 50.792 75.502 82.428 1.00 18.02 ? 21 ILE A C 1 +ATOM 147 O O . ILE A 1 21 ? 51.337 76.182 83.304 1.00 18.81 ? 21 ILE A O 1 +ATOM 148 C CB . ILE A 1 21 ? 50.620 73.218 83.471 1.00 16.88 ? 21 ILE A CB 1 +ATOM 149 C CG1 . ILE A 1 21 ? 50.638 71.735 83.129 1.00 16.87 ? 21 ILE A CG1 1 +ATOM 150 C CG2 . ILE A 1 21 ? 49.197 73.621 83.827 1.00 17.53 ? 21 ILE A CG2 1 +ATOM 151 C CD1 . ILE A 1 21 ? 50.610 70.783 84.280 1.00 14.13 ? 21 ILE A CD1 1 +ATOM 152 N N . THR A 1 22 ? 49.927 76.015 81.557 1.00 18.36 ? 22 THR A N 1 +ATOM 153 C CA . THR A 1 22 ? 49.630 77.441 81.598 1.00 18.92 ? 22 THR A CA 1 +ATOM 154 C C . THR A 1 22 ? 48.266 77.733 82.178 1.00 18.76 ? 22 THR A C 1 +ATOM 155 O O . THR A 1 22 ? 47.419 76.873 82.295 1.00 17.69 ? 22 THR A O 1 +ATOM 156 C CB . THR A 1 22 ? 49.805 78.078 80.213 1.00 19.27 ? 22 THR A CB 1 +ATOM 157 O OG1 . THR A 1 22 ? 51.169 77.934 79.845 1.00 22.39 ? 22 THR A OG1 1 +ATOM 158 C CG2 . THR A 1 22 ? 49.700 79.626 80.272 1.00 19.33 ? 22 THR A CG2 1 +ATOM 159 N N . CYS A 1 23 ? 48.060 78.980 82.522 1.00 19.34 ? 23 CYS A N 1 +ATOM 160 C CA . CYS A 1 23 ? 46.792 79.369 83.045 1.00 21.34 ? 23 CYS A CA 1 +ATOM 161 C C . CYS A 1 23 ? 46.733 80.859 82.933 1.00 20.70 ? 23 CYS A C 1 +ATOM 162 O O . CYS A 1 23 ? 47.606 81.555 83.459 1.00 21.85 ? 23 CYS A O 1 +ATOM 163 C CB . CYS A 1 23 ? 46.728 78.917 84.491 1.00 22.14 ? 23 CYS A CB 1 +ATOM 164 S SG . CYS A 1 23 ? 45.393 79.547 85.491 1.00 29.34 ? 23 CYS A SG 1 +ATOM 165 N N . ARG A 1 24 ? 45.747 81.342 82.191 1.00 19.88 ? 24 ARG A N 1 +ATOM 166 C CA . ARG A 1 24 ? 45.566 82.767 81.969 1.00 19.34 ? 24 ARG A CA 1 +ATOM 167 C C . ARG A 1 24 ? 44.514 83.313 82.881 1.00 18.34 ? 24 ARG A C 1 +ATOM 168 O O . ARG A 1 24 ? 43.483 82.694 83.101 1.00 19.15 ? 24 ARG A O 1 +ATOM 169 C CB . ARG A 1 24 ? 45.198 83.078 80.530 1.00 19.50 ? 24 ARG A CB 1 +ATOM 170 C CG . ARG A 1 24 ? 45.428 84.560 80.192 1.00 22.36 ? 24 ARG A CG 1 +ATOM 171 C CD . ARG A 1 24 ? 45.429 84.905 78.705 1.00 27.55 ? 24 ARG A CD 1 +ATOM 172 N NE . ARG A 1 24 ? 45.409 83.681 77.905 1.00 32.88 ? 24 ARG A NE 1 +ATOM 173 C CZ . ARG A 1 24 ? 45.838 83.564 76.645 1.00 33.56 ? 24 ARG A CZ 1 +ATOM 174 N NH1 . ARG A 1 24 ? 46.319 84.624 75.993 1.00 31.93 ? 24 ARG A NH1 1 +ATOM 175 N NH2 . ARG A 1 24 ? 45.754 82.371 76.039 1.00 31.60 ? 24 ARG A NH2 1 +ATOM 176 N N . ALA A 1 25 ? 44.784 84.467 83.453 1.00 16.94 ? 25 ALA A N 1 +ATOM 177 C CA . ALA A 1 25 ? 43.795 85.088 84.294 1.00 15.82 ? 25 ALA A CA 1 +ATOM 178 C C . ALA A 1 25 ? 42.984 86.041 83.427 1.00 14.74 ? 25 ALA A C 1 +ATOM 179 O O . ALA A 1 25 ? 43.514 86.601 82.488 1.00 14.55 ? 25 ALA A O 1 +ATOM 180 C CB . ALA A 1 25 ? 44.462 85.759 85.507 1.00 14.79 ? 25 ALA A CB 1 +ATOM 181 N N . SER A 1 26 ? 41.687 86.167 83.691 1.00 14.96 ? 26 SER A N 1 +ATOM 182 C CA . SER A 1 26 ? 40.815 87.008 82.854 1.00 15.34 ? 26 SER A CA 1 +ATOM 183 C C . SER A 1 26 ? 41.156 88.474 83.070 1.00 16.33 ? 26 SER A C 1 +ATOM 184 O O . SER A 1 26 ? 40.989 89.321 82.174 1.00 16.14 ? 26 SER A O 1 +ATOM 185 C CB . SER A 1 26 ? 39.327 86.783 83.152 1.00 14.97 ? 26 SER A CB 1 +ATOM 186 O OG . SER A 1 26 ? 39.000 87.101 84.505 1.00 15.68 ? 26 SER A OG 1 +ATOM 187 N N . GLN A 1 27 ? 41.606 88.782 84.283 1.00 16.83 ? 27 GLN A N 1 +ATOM 188 C CA . GLN A 1 27 ? 42.035 90.128 84.588 1.00 17.52 ? 27 GLN A CA 1 +ATOM 189 C C . GLN A 1 27 ? 43.238 90.048 85.469 1.00 17.20 ? 27 GLN A C 1 +ATOM 190 O O . GLN A 1 27 ? 43.621 88.946 85.921 1.00 16.06 ? 27 GLN A O 1 +ATOM 191 C CB . GLN A 1 27 ? 40.973 90.921 85.331 1.00 17.71 ? 27 GLN A CB 1 +ATOM 192 C CG . GLN A 1 27 ? 39.546 90.646 84.962 1.00 21.67 ? 27 GLN A CG 1 +ATOM 193 C CD . GLN A 1 27 ? 38.629 91.025 86.090 1.00 24.32 ? 27 GLN A CD 1 +ATOM 194 O OE1 . GLN A 1 27 ? 39.036 91.782 86.987 1.00 25.52 ? 27 GLN A OE1 1 +ATOM 195 N NE2 . GLN A 1 27 ? 37.399 90.498 86.076 1.00 24.24 ? 27 GLN A NE2 1 +ATOM 196 N N . ASP A 1 28 ? 43.811 91.233 85.728 1.00 16.80 ? 28 ASP A N 1 +ATOM 197 C CA . ASP A 1 28 ? 44.992 91.334 86.567 1.00 16.46 ? 28 ASP A CA 1 +ATOM 198 C C . ASP A 1 28 ? 44.807 90.767 87.948 1.00 15.86 ? 28 ASP A C 1 +ATOM 199 O O . ASP A 1 28 ? 43.867 91.111 88.677 1.00 15.43 ? 28 ASP A O 1 +ATOM 200 C CB . ASP A 1 28 ? 45.536 92.743 86.707 1.00 16.91 ? 28 ASP A CB 1 +ATOM 201 C CG . ASP A 1 28 ? 46.784 92.758 87.542 1.00 18.06 ? 28 ASP A CG 1 +ATOM 202 O OD1 . ASP A 1 28 ? 46.655 92.973 88.770 1.00 17.54 ? 28 ASP A OD1 1 +ATOM 203 O OD2 . ASP A 1 28 ? 47.917 92.478 87.065 1.00 20.78 ? 28 ASP A OD2 1 +ATOM 204 N N . VAL A 1 29 ? 45.789 89.943 88.295 1.00 15.17 ? 29 VAL A N 1 +ATOM 205 C CA . VAL A 1 29 ? 45.774 89.107 89.468 1.00 14.28 ? 29 VAL A CA 1 +ATOM 206 C C . VAL A 1 29 ? 47.124 89.273 90.206 1.00 13.66 ? 29 VAL A C 1 +ATOM 207 O O . VAL A 1 29 ? 47.410 88.569 91.169 1.00 13.85 ? 29 VAL A O 1 +ATOM 208 C CB . VAL A 1 29 ? 45.510 87.686 88.984 1.00 14.13 ? 29 VAL A CB 1 +ATOM 209 C CG1 . VAL A 1 29 ? 46.081 86.667 89.882 1.00 17.00 ? 29 VAL A CG1 1 +ATOM 210 C CG2 . VAL A 1 29 ? 44.052 87.494 88.899 1.00 15.17 ? 29 VAL A CG2 1 +ATOM 211 N N . ASN A 1 30 ? 47.935 90.233 89.749 1.00 12.74 ? 30 ASN A N 1 +ATOM 212 C CA . ASN A 1 30 ? 49.256 90.468 90.298 1.00 11.55 ? 30 ASN A CA 1 +ATOM 213 C C . ASN A 1 30 ? 49.993 89.143 90.340 1.00 11.40 ? 30 ASN A C 1 +ATOM 214 O O . ASN A 1 30 ? 50.232 88.525 89.305 1.00 11.05 ? 30 ASN A O 1 +ATOM 215 C CB . ASN A 1 30 ? 49.177 91.113 91.689 1.00 11.27 ? 30 ASN A CB 1 +ATOM 216 C CG . ASN A 1 30 ? 50.515 91.700 92.153 1.00 10.86 ? 30 ASN A CG 1 +ATOM 217 O OD1 . ASN A 1 30 ? 50.884 92.834 91.798 1.00 9.89 ? 30 ASN A OD1 1 +ATOM 218 N ND2 . ASN A 1 30 ? 51.223 90.950 92.983 1.00 6.92 ? 30 ASN A ND2 1 +ATOM 219 N N . THR A 1 31 ? 50.276 88.678 91.551 1.00 11.08 ? 31 THR A N 1 +ATOM 220 C CA . THR A 1 31 ? 51.136 87.539 91.801 1.00 10.12 ? 31 THR A CA 1 +ATOM 221 C C . THR A 1 31 ? 50.353 86.533 92.662 1.00 10.35 ? 31 THR A C 1 +ATOM 222 O O . THR A 1 31 ? 50.792 85.428 92.942 1.00 9.57 ? 31 THR A O 1 +ATOM 223 C CB . THR A 1 31 ? 52.387 88.104 92.457 1.00 10.26 ? 31 THR A CB 1 +ATOM 224 O OG1 . THR A 1 31 ? 53.505 87.934 91.588 1.00 8.20 ? 31 THR A OG1 1 +ATOM 225 C CG2 . THR A 1 31 ? 52.737 87.444 93.778 1.00 10.15 ? 31 THR A CG2 1 +ATOM 226 N N . ALA A 1 32 ? 49.129 86.915 92.991 1.00 11.20 ? 32 ALA A N 1 +ATOM 227 C CA . ALA A 1 32 ? 48.213 86.130 93.821 1.00 12.51 ? 32 ALA A CA 1 +ATOM 228 C C . ALA A 1 32 ? 47.706 84.785 93.202 1.00 12.80 ? 32 ALA A C 1 +ATOM 229 O O . ALA A 1 32 ? 46.482 84.530 93.046 1.00 13.07 ? 32 ALA A O 1 +ATOM 230 C CB . ALA A 1 32 ? 47.046 87.021 94.229 1.00 11.99 ? 32 ALA A CB 1 +ATOM 231 N N . VAL A 1 33 ? 48.662 83.940 92.844 1.00 12.01 ? 33 VAL A N 1 +ATOM 232 C CA . VAL A 1 33 ? 48.359 82.720 92.125 1.00 11.01 ? 33 VAL A CA 1 +ATOM 233 C C . VAL A 1 33 ? 49.066 81.557 92.788 1.00 11.03 ? 33 VAL A C 1 +ATOM 234 O O . VAL A 1 33 ? 50.221 81.677 93.211 1.00 10.43 ? 33 VAL A O 1 +ATOM 235 C CB . VAL A 1 33 ? 48.793 82.818 90.647 1.00 11.67 ? 33 VAL A CB 1 +ATOM 236 C CG1 . VAL A 1 33 ? 48.726 81.399 89.950 1.00 11.18 ? 33 VAL A CG1 1 +ATOM 237 C CG2 . VAL A 1 33 ? 47.945 83.800 89.931 1.00 6.18 ? 33 VAL A CG2 1 +ATOM 238 N N . ALA A 1 34 ? 48.362 80.440 92.890 1.00 10.90 ? 34 ALA A N 1 +ATOM 239 C CA . ALA A 1 34 ? 48.898 79.252 93.556 1.00 10.98 ? 34 ALA A CA 1 +ATOM 240 C C . ALA A 1 34 ? 48.782 78.011 92.654 1.00 11.44 ? 34 ALA A C 1 +ATOM 241 O O . ALA A 1 34 ? 47.902 77.959 91.783 1.00 11.17 ? 34 ALA A O 1 +ATOM 242 C CB . ALA A 1 34 ? 48.168 79.024 94.858 1.00 10.40 ? 34 ALA A CB 1 +ATOM 243 N N . TRP A 1 35 ? 49.659 77.018 92.843 1.00 12.16 ? 35 TRP A N 1 +ATOM 244 C CA . TRP A 1 35 ? 49.501 75.757 92.117 1.00 13.08 ? 35 TRP A CA 1 +ATOM 245 C C . TRP A 1 35 ? 49.404 74.541 93.001 1.00 13.16 ? 35 TRP A C 1 +ATOM 246 O O . TRP A 1 35 ? 50.245 74.332 93.869 1.00 14.74 ? 35 TRP A O 1 +ATOM 247 C CB . TRP A 1 35 ? 50.634 75.538 91.133 1.00 12.69 ? 35 TRP A CB 1 +ATOM 248 C CG . TRP A 1 35 ? 50.697 76.460 90.012 1.00 12.90 ? 35 TRP A CG 1 +ATOM 249 C CD1 . TRP A 1 35 ? 51.405 77.618 89.962 1.00 14.54 ? 35 TRP A CD1 1 +ATOM 250 C CD2 . TRP A 1 35 ? 50.117 76.284 88.709 1.00 13.72 ? 35 TRP A CD2 1 +ATOM 251 N NE1 . TRP A 1 35 ? 51.282 78.197 88.724 1.00 14.49 ? 35 TRP A NE1 1 +ATOM 252 C CE2 . TRP A 1 35 ? 50.486 77.401 87.933 1.00 14.40 ? 35 TRP A CE2 1 +ATOM 253 C CE3 . TRP A 1 35 ? 49.287 75.316 88.129 1.00 13.68 ? 35 TRP A CE3 1 +ATOM 254 C CZ2 . TRP A 1 35 ? 50.065 77.569 86.598 1.00 10.38 ? 35 TRP A CZ2 1 +ATOM 255 C CZ3 . TRP A 1 35 ? 48.870 75.487 86.830 1.00 10.94 ? 35 TRP A CZ3 1 +ATOM 256 C CH2 . TRP A 1 35 ? 49.275 76.607 86.073 1.00 11.82 ? 35 TRP A CH2 1 +ATOM 257 N N . TYR A 1 36 ? 48.413 73.713 92.724 1.00 13.10 ? 36 TYR A N 1 +ATOM 258 C CA . TYR A 1 36 ? 48.121 72.507 93.497 1.00 13.31 ? 36 TYR A CA 1 +ATOM 259 C C . TYR A 1 36 ? 48.311 71.201 92.714 1.00 13.88 ? 36 TYR A C 1 +ATOM 260 O O . TYR A 1 36 ? 48.153 71.153 91.506 1.00 14.98 ? 36 TYR A O 1 +ATOM 261 C CB . TYR A 1 36 ? 46.679 72.590 94.022 1.00 13.24 ? 36 TYR A CB 1 +ATOM 262 C CG . TYR A 1 36 ? 46.459 73.786 94.904 1.00 12.48 ? 36 TYR A CG 1 +ATOM 263 C CD1 . TYR A 1 36 ? 46.126 75.016 94.360 1.00 11.84 ? 36 TYR A CD1 1 +ATOM 264 C CD2 . TYR A 1 36 ? 46.632 73.697 96.286 1.00 12.56 ? 36 TYR A CD2 1 +ATOM 265 C CE1 . TYR A 1 36 ? 45.967 76.119 95.152 1.00 10.55 ? 36 TYR A CE1 1 +ATOM 266 C CE2 . TYR A 1 36 ? 46.444 74.811 97.105 1.00 14.30 ? 36 TYR A CE2 1 +ATOM 267 C CZ . TYR A 1 36 ? 46.125 76.020 96.503 1.00 14.33 ? 36 TYR A CZ 1 +ATOM 268 O OH . TYR A 1 36 ? 45.934 77.140 97.269 1.00 20.40 ? 36 TYR A OH 1 +ATOM 269 N N . GLN A 1 37 ? 48.640 70.128 93.401 1.00 14.20 ? 37 GLN A N 1 +ATOM 270 C CA . GLN A 1 37 ? 48.730 68.848 92.745 1.00 14.51 ? 37 GLN A CA 1 +ATOM 271 C C . GLN A 1 37 ? 47.698 67.912 93.372 1.00 14.94 ? 37 GLN A C 1 +ATOM 272 O O . GLN A 1 37 ? 47.690 67.727 94.562 1.00 15.68 ? 37 GLN A O 1 +ATOM 273 C CB . GLN A 1 37 ? 50.162 68.319 92.879 1.00 14.63 ? 37 GLN A CB 1 +ATOM 274 C CG . GLN A 1 37 ? 50.386 66.929 92.356 1.00 14.17 ? 37 GLN A CG 1 +ATOM 275 C CD . GLN A 1 37 ? 51.704 66.367 92.782 1.00 15.43 ? 37 GLN A CD 1 +ATOM 276 O OE1 . GLN A 1 37 ? 51.904 66.068 93.955 1.00 20.82 ? 37 GLN A OE1 1 +ATOM 277 N NE2 . GLN A 1 37 ? 52.602 66.197 91.845 1.00 13.42 ? 37 GLN A NE2 1 +ATOM 278 N N . GLN A 1 38 ? 46.781 67.373 92.587 1.00 16.14 ? 38 GLN A N 1 +ATOM 279 C CA . GLN A 1 38 ? 45.879 66.342 93.098 1.00 17.45 ? 38 GLN A CA 1 +ATOM 280 C C . GLN A 1 38 ? 46.138 64.985 92.456 1.00 18.36 ? 38 GLN A C 1 +ATOM 281 O O . GLN A 1 38 ? 46.163 64.837 91.233 1.00 18.26 ? 38 GLN A O 1 +ATOM 282 C CB . GLN A 1 38 ? 44.425 66.720 92.867 1.00 17.18 ? 38 GLN A CB 1 +ATOM 283 C CG . GLN A 1 38 ? 43.473 65.986 93.785 1.00 18.33 ? 38 GLN A CG 1 +ATOM 284 C CD . GLN A 1 38 ? 42.027 66.443 93.610 1.00 20.85 ? 38 GLN A CD 1 +ATOM 285 O OE1 . GLN A 1 38 ? 41.657 66.879 92.531 1.00 23.84 ? 38 GLN A OE1 1 +ATOM 286 N NE2 . GLN A 1 38 ? 41.218 66.340 94.657 1.00 19.00 ? 38 GLN A NE2 1 +ATOM 287 N N . LYS A 1 39 ? 46.304 63.995 93.312 1.00 20.48 ? 39 LYS A N 1 +ATOM 288 C CA . LYS A 1 39 ? 46.538 62.598 92.928 1.00 21.33 ? 39 LYS A CA 1 +ATOM 289 C C . LYS A 1 39 ? 45.305 61.790 93.187 1.00 21.91 ? 39 LYS A C 1 +ATOM 290 O O . LYS A 1 39 ? 44.547 62.098 94.087 1.00 22.15 ? 39 LYS A O 1 +ATOM 291 C CB . LYS A 1 39 ? 47.760 62.051 93.672 1.00 20.96 ? 39 LYS A CB 1 +ATOM 292 C CG . LYS A 1 39 ? 49.023 62.442 92.909 1.00 21.61 ? 39 LYS A CG 1 +ATOM 293 C CD . LYS A 1 39 ? 50.252 61.880 93.470 1.00 23.98 ? 39 LYS A CD 1 +ATOM 294 C CE . LYS A 1 39 ? 51.299 62.951 93.617 1.00 26.11 ? 39 LYS A CE 1 +ATOM 295 N NZ . LYS A 1 39 ? 52.722 62.374 93.524 1.00 28.30 ? 39 LYS A NZ 1 +ATOM 296 N N . PRO A 1 40 ? 45.062 60.780 92.361 1.00 24.06 ? 40 PRO A N 1 +ATOM 297 C CA . PRO A 1 40 ? 43.898 59.895 92.505 1.00 24.16 ? 40 PRO A CA 1 +ATOM 298 C C . PRO A 1 40 ? 43.441 59.727 93.947 1.00 24.49 ? 40 PRO A C 1 +ATOM 299 O O . PRO A 1 40 ? 44.217 59.297 94.813 1.00 23.88 ? 40 PRO A O 1 +ATOM 300 C CB . PRO A 1 40 ? 44.442 58.572 91.974 1.00 24.19 ? 40 PRO A CB 1 +ATOM 301 C CG . PRO A 1 40 ? 45.341 58.996 90.871 1.00 23.65 ? 40 PRO A CG 1 +ATOM 302 C CD . PRO A 1 40 ? 45.874 60.376 91.191 1.00 24.61 ? 40 PRO A CD 1 +ATOM 303 N N . GLY A 1 41 ? 42.186 60.097 94.190 1.00 24.84 ? 41 GLY A N 1 +ATOM 304 C CA . GLY A 1 41 ? 41.578 59.973 95.509 1.00 24.34 ? 41 GLY A CA 1 +ATOM 305 C C . GLY A 1 41 ? 42.420 60.574 96.619 1.00 23.86 ? 41 GLY A C 1 +ATOM 306 O O . GLY A 1 41 ? 42.562 59.936 97.656 1.00 24.12 ? 41 GLY A O 1 +ATOM 307 N N . LYS A 1 42 ? 42.989 61.765 96.392 1.00 22.51 ? 42 LYS A N 1 +ATOM 308 C CA . LYS A 1 42 ? 43.704 62.497 97.437 1.00 21.94 ? 42 LYS A CA 1 +ATOM 309 C C . LYS A 1 42 ? 43.273 63.956 97.480 1.00 21.28 ? 42 LYS A C 1 +ATOM 310 O O . LYS A 1 42 ? 42.663 64.456 96.531 1.00 21.91 ? 42 LYS A O 1 +ATOM 311 C CB . LYS A 1 42 ? 45.209 62.453 97.195 1.00 22.59 ? 42 LYS A CB 1 +ATOM 312 C CG . LYS A 1 42 ? 45.900 61.119 97.427 1.00 22.31 ? 42 LYS A CG 1 +ATOM 313 C CD . LYS A 1 42 ? 45.475 60.487 98.694 1.00 24.04 ? 42 LYS A CD 1 +ATOM 314 C CE . LYS A 1 42 ? 46.150 59.136 98.816 1.00 27.78 ? 42 LYS A CE 1 +ATOM 315 N NZ . LYS A 1 42 ? 45.136 58.031 98.723 1.00 27.68 ? 42 LYS A NZ 1 +ATOM 316 N N . ALA A 1 43 ? 43.598 64.650 98.568 1.00 19.84 ? 43 ALA A N 1 +ATOM 317 C CA . ALA A 1 43 ? 43.404 66.097 98.633 1.00 18.44 ? 43 ALA A CA 1 +ATOM 318 C C . ALA A 1 43 ? 44.450 66.746 97.764 1.00 17.65 ? 43 ALA A C 1 +ATOM 319 O O . ALA A 1 43 ? 45.543 66.230 97.634 1.00 17.88 ? 43 ALA A O 1 +ATOM 320 C CB . ALA A 1 43 ? 43.576 66.576 100.035 1.00 18.21 ? 43 ALA A CB 1 +ATOM 321 N N . PRO A 1 44 ? 44.165 67.909 97.204 1.00 17.37 ? 44 PRO A N 1 +ATOM 322 C CA . PRO A 1 44 ? 45.185 68.619 96.445 1.00 16.08 ? 44 PRO A CA 1 +ATOM 323 C C . PRO A 1 44 ? 46.265 69.000 97.432 1.00 15.22 ? 44 PRO A C 1 +ATOM 324 O O . PRO A 1 44 ? 45.970 69.171 98.622 1.00 13.86 ? 44 PRO A O 1 +ATOM 325 C CB . PRO A 1 44 ? 44.452 69.854 95.961 1.00 15.85 ? 44 PRO A CB 1 +ATOM 326 C CG . PRO A 1 44 ? 43.074 69.496 96.047 1.00 17.69 ? 44 PRO A CG 1 +ATOM 327 C CD . PRO A 1 44 ? 42.911 68.673 97.269 1.00 17.54 ? 44 PRO A CD 1 +ATOM 328 N N . LYS A 1 45 ? 47.505 69.072 96.963 1.00 14.49 ? 45 LYS A N 1 +ATOM 329 C CA . LYS A 1 45 ? 48.569 69.581 97.806 1.00 14.80 ? 45 LYS A CA 1 +ATOM 330 C C . LYS A 1 45 ? 49.193 70.772 97.127 1.00 14.43 ? 45 LYS A C 1 +ATOM 331 O O . LYS A 1 45 ? 49.318 70.785 95.891 1.00 14.74 ? 45 LYS A O 1 +ATOM 332 C CB . LYS A 1 45 ? 49.609 68.529 98.051 1.00 14.29 ? 45 LYS A CB 1 +ATOM 333 C CG . LYS A 1 45 ? 49.027 67.297 98.612 1.00 17.03 ? 45 LYS A CG 1 +ATOM 334 C CD . LYS A 1 45 ? 50.110 66.260 98.765 1.00 20.61 ? 45 LYS A CD 1 +ATOM 335 C CE . LYS A 1 45 ? 49.713 65.309 99.835 1.00 21.40 ? 45 LYS A CE 1 +ATOM 336 N NZ . LYS A 1 45 ? 50.881 65.203 100.728 1.00 26.38 ? 45 LYS A NZ 1 +ATOM 337 N N . LEU A 1 46 ? 49.581 71.755 97.929 1.00 12.88 ? 46 LEU A N 1 +ATOM 338 C CA . LEU A 1 46 ? 50.149 72.987 97.410 1.00 13.00 ? 46 LEU A CA 1 +ATOM 339 C C . LEU A 1 46 ? 51.588 72.779 96.939 1.00 13.48 ? 46 LEU A C 1 +ATOM 340 O O . LEU A 1 46 ? 52.395 72.234 97.661 1.00 15.14 ? 46 LEU A O 1 +ATOM 341 C CB . LEU A 1 46 ? 50.047 74.069 98.475 1.00 12.53 ? 46 LEU A CB 1 +ATOM 342 C CG . LEU A 1 46 ? 50.809 75.394 98.423 1.00 12.58 ? 46 LEU A CG 1 +ATOM 343 C CD1 . LEU A 1 46 ? 50.173 76.327 97.369 1.00 12.97 ? 46 LEU A CD1 1 +ATOM 344 C CD2 . LEU A 1 46 ? 50.846 76.063 99.803 1.00 6.79 ? 46 LEU A CD2 1 +ATOM 345 N N . LEU A 1 47 ? 51.885 73.200 95.715 1.00 13.35 ? 47 LEU A N 1 +ATOM 346 C CA . LEU A 1 47 ? 53.208 73.194 95.121 1.00 11.83 ? 47 LEU A CA 1 +ATOM 347 C C . LEU A 1 47 ? 53.825 74.619 95.098 1.00 12.20 ? 47 LEU A C 1 +ATOM 348 O O . LEU A 1 47 ? 54.964 74.862 95.546 1.00 12.42 ? 47 LEU A O 1 +ATOM 349 C CB . LEU A 1 47 ? 53.050 72.718 93.669 1.00 11.86 ? 47 LEU A CB 1 +ATOM 350 C CG . LEU A 1 47 ? 52.511 71.296 93.385 1.00 10.61 ? 47 LEU A CG 1 +ATOM 351 C CD1 . LEU A 1 47 ? 52.301 71.083 91.945 1.00 9.68 ? 47 LEU A CD1 1 +ATOM 352 C CD2 . LEU A 1 47 ? 53.442 70.223 93.793 1.00 8.81 ? 47 LEU A CD2 1 +ATOM 353 N N . ILE A 1 48 ? 53.099 75.575 94.531 1.00 11.99 ? 48 ILE A N 1 +ATOM 354 C CA . ILE A 1 48 ? 53.660 76.890 94.349 1.00 11.49 ? 48 ILE A CA 1 +ATOM 355 C C . ILE A 1 48 ? 52.717 77.948 94.846 1.00 11.51 ? 48 ILE A C 1 +ATOM 356 O O . ILE A 1 48 ? 51.530 77.825 94.686 1.00 12.40 ? 48 ILE A O 1 +ATOM 357 C CB . ILE A 1 48 ? 54.002 77.114 92.886 1.00 11.80 ? 48 ILE A CB 1 +ATOM 358 C CG1 . ILE A 1 48 ? 55.319 76.412 92.571 1.00 13.59 ? 48 ILE A CG1 1 +ATOM 359 C CG2 . ILE A 1 48 ? 54.149 78.642 92.587 1.00 8.66 ? 48 ILE A CG2 1 +ATOM 360 C CD1 . ILE A 1 48 ? 55.263 75.752 91.284 1.00 24.37 ? 48 ILE A CD1 1 +ATOM 361 N N . TYR A 1 49 ? 53.258 78.994 95.441 1.00 11.23 ? 49 TYR A N 1 +ATOM 362 C CA . TYR A 1 49 ? 52.455 80.107 95.899 1.00 10.97 ? 49 TYR A CA 1 +ATOM 363 C C . TYR A 1 49 ? 53.052 81.448 95.503 1.00 10.52 ? 49 TYR A C 1 +ATOM 364 O O . TYR A 1 49 ? 54.215 81.521 95.149 1.00 10.79 ? 49 TYR A O 1 +ATOM 365 C CB . TYR A 1 49 ? 52.296 80.051 97.412 1.00 11.62 ? 49 TYR A CB 1 +ATOM 366 C CG . TYR A 1 49 ? 53.567 80.345 98.143 1.00 11.05 ? 49 TYR A CG 1 +ATOM 367 C CD1 . TYR A 1 49 ? 53.822 81.606 98.660 1.00 10.59 ? 49 TYR A CD1 1 +ATOM 368 C CD2 . TYR A 1 49 ? 54.528 79.349 98.303 1.00 12.67 ? 49 TYR A CD2 1 +ATOM 369 C CE1 . TYR A 1 49 ? 55.028 81.864 99.335 1.00 12.90 ? 49 TYR A CE1 1 +ATOM 370 C CE2 . TYR A 1 49 ? 55.705 79.585 98.980 1.00 13.53 ? 49 TYR A CE2 1 +ATOM 371 C CZ . TYR A 1 49 ? 55.952 80.837 99.482 1.00 13.92 ? 49 TYR A CZ 1 +ATOM 372 O OH . TYR A 1 49 ? 57.143 81.043 100.131 1.00 18.24 ? 49 TYR A OH 1 +ATOM 373 N N . SER A 1 50 ? 52.239 82.506 95.585 1.00 10.49 ? 50 SER A N 1 +ATOM 374 C CA . SER A 1 50 ? 52.625 83.830 95.128 1.00 10.76 ? 50 SER A CA 1 +ATOM 375 C C . SER A 1 50 ? 53.335 83.728 93.783 1.00 11.66 ? 50 SER A C 1 +ATOM 376 O O . SER A 1 50 ? 54.391 84.344 93.590 1.00 11.47 ? 50 SER A O 1 +ATOM 377 C CB . SER A 1 50 ? 53.470 84.557 96.174 1.00 10.45 ? 50 SER A CB 1 +ATOM 378 O OG . SER A 1 50 ? 52.745 84.624 97.421 1.00 11.94 ? 50 SER A OG 1 +ATOM 379 N N . ALA A 1 51 ? 52.739 82.928 92.873 1.00 11.86 ? 51 ALA A N 1 +ATOM 380 C CA . ALA A 1 51 ? 53.229 82.682 91.490 1.00 13.04 ? 51 ALA A CA 1 +ATOM 381 C C . ALA A 1 51 ? 54.488 81.843 91.313 1.00 14.02 ? 51 ALA A C 1 +ATOM 382 O O . ALA A 1 51 ? 54.549 81.046 90.386 1.00 14.26 ? 51 ALA A O 1 +ATOM 383 C CB . ALA A 1 51 ? 53.374 83.961 90.660 1.00 11.95 ? 51 ALA A CB 1 +ATOM 384 N N . SER A 1 52 ? 55.498 82.015 92.168 1.00 15.05 ? 52 SER A N 1 +ATOM 385 C CA . SER A 1 52 ? 56.802 81.477 91.797 1.00 15.20 ? 52 SER A CA 1 +ATOM 386 C C . SER A 1 52 ? 57.586 80.923 92.943 1.00 15.40 ? 52 SER A C 1 +ATOM 387 O O . SER A 1 52 ? 58.758 80.603 92.781 1.00 15.87 ? 52 SER A O 1 +ATOM 388 C CB . SER A 1 52 ? 57.628 82.554 91.060 1.00 15.73 ? 52 SER A CB 1 +ATOM 389 O OG . SER A 1 52 ? 58.207 83.512 91.937 1.00 15.37 ? 52 SER A OG 1 +ATOM 390 N N . PHE A 1 53 ? 56.953 80.788 94.099 1.00 15.42 ? 53 PHE A N 1 +ATOM 391 C CA . PHE A 1 53 ? 57.681 80.362 95.284 1.00 15.40 ? 53 PHE A CA 1 +ATOM 392 C C . PHE A 1 53 ? 57.406 78.905 95.589 1.00 15.62 ? 53 PHE A C 1 +ATOM 393 O O . PHE A 1 53 ? 56.268 78.539 95.857 1.00 15.85 ? 53 PHE A O 1 +ATOM 394 C CB . PHE A 1 53 ? 57.333 81.265 96.475 1.00 15.57 ? 53 PHE A CB 1 +ATOM 395 C CG . PHE A 1 53 ? 58.004 82.594 96.423 1.00 14.78 ? 53 PHE A CG 1 +ATOM 396 C CD1 . PHE A 1 53 ? 57.507 83.600 95.622 1.00 13.96 ? 53 PHE A CD1 1 +ATOM 397 C CD2 . PHE A 1 53 ? 59.160 82.829 97.156 1.00 15.75 ? 53 PHE A CD2 1 +ATOM 398 C CE1 . PHE A 1 53 ? 58.135 84.826 95.552 1.00 15.01 ? 53 PHE A CE1 1 +ATOM 399 C CE2 . PHE A 1 53 ? 59.805 84.068 97.107 1.00 16.86 ? 53 PHE A CE2 1 +ATOM 400 C CZ . PHE A 1 53 ? 59.302 85.061 96.310 1.00 16.73 ? 53 PHE A CZ 1 +ATOM 401 N N . LEU A 1 54 ? 58.458 78.084 95.510 1.00 15.63 ? 54 LEU A N 1 +ATOM 402 C CA . LEU A 1 54 ? 58.438 76.673 95.892 1.00 15.69 ? 54 LEU A CA 1 +ATOM 403 C C . LEU A 1 54 ? 57.926 76.446 97.313 1.00 16.47 ? 54 LEU A C 1 +ATOM 404 O O . LEU A 1 54 ? 58.542 76.910 98.264 1.00 17.70 ? 54 LEU A O 1 +ATOM 405 C CB . LEU A 1 54 ? 59.859 76.116 95.806 1.00 15.01 ? 54 LEU A CB 1 +ATOM 406 C CG . LEU A 1 54 ? 59.971 74.822 95.002 1.00 14.24 ? 54 LEU A CG 1 +ATOM 407 C CD1 . LEU A 1 54 ? 60.971 73.836 95.588 1.00 11.60 ? 54 LEU A CD1 1 +ATOM 408 C CD2 . LEU A 1 54 ? 58.611 74.210 94.872 1.00 12.13 ? 54 LEU A CD2 1 +ATOM 409 N N . TYR A 1 55 ? 56.831 75.716 97.489 1.00 16.76 ? 55 TYR A N 1 +ATOM 410 C CA . TYR A 1 55 ? 56.338 75.486 98.854 1.00 17.08 ? 55 TYR A CA 1 +ATOM 411 C C . TYR A 1 55 ? 57.256 74.540 99.639 1.00 16.95 ? 55 TYR A C 1 +ATOM 412 O O . TYR A 1 55 ? 57.992 73.788 99.036 1.00 17.66 ? 55 TYR A O 1 +ATOM 413 C CB . TYR A 1 55 ? 54.910 74.978 98.797 1.00 17.09 ? 55 TYR A CB 1 +ATOM 414 C CG . TYR A 1 55 ? 54.265 74.671 100.151 1.00 19.18 ? 55 TYR A CG 1 +ATOM 415 C CD1 . TYR A 1 55 ? 54.213 75.614 101.197 1.00 17.02 ? 55 TYR A CD1 1 +ATOM 416 C CD2 . TYR A 1 55 ? 53.700 73.418 100.376 1.00 18.64 ? 55 TYR A CD2 1 +ATOM 417 C CE1 . TYR A 1 55 ? 53.616 75.275 102.403 1.00 14.97 ? 55 TYR A CE1 1 +ATOM 418 C CE2 . TYR A 1 55 ? 53.129 73.096 101.563 1.00 15.78 ? 55 TYR A CE2 1 +ATOM 419 C CZ . TYR A 1 55 ? 53.077 74.004 102.558 1.00 14.29 ? 55 TYR A CZ 1 +ATOM 420 O OH . TYR A 1 55 ? 52.462 73.563 103.705 1.00 15.79 ? 55 TYR A OH 1 +ATOM 421 N N . SER A 1 56 ? 57.231 74.573 100.968 1.00 17.35 ? 56 SER A N 1 +ATOM 422 C CA . SER A 1 56 ? 58.113 73.712 101.780 1.00 17.59 ? 56 SER A CA 1 +ATOM 423 C C . SER A 1 56 ? 58.045 72.208 101.454 1.00 17.83 ? 56 SER A C 1 +ATOM 424 O O . SER A 1 56 ? 56.960 71.620 101.359 1.00 18.37 ? 56 SER A O 1 +ATOM 425 C CB . SER A 1 56 ? 57.882 73.948 103.269 1.00 17.33 ? 56 SER A CB 1 +ATOM 426 O OG . SER A 1 56 ? 59.044 73.617 104.043 1.00 19.39 ? 56 SER A OG 1 +ATOM 427 N N . GLY A 1 57 ? 59.212 71.595 101.248 1.00 18.09 ? 57 GLY A N 1 +ATOM 428 C CA . GLY A 1 57 ? 59.293 70.184 100.896 1.00 18.26 ? 57 GLY A CA 1 +ATOM 429 C C . GLY A 1 57 ? 58.666 69.762 99.572 1.00 19.02 ? 57 GLY A C 1 +ATOM 430 O O . GLY A 1 57 ? 58.256 68.616 99.430 1.00 19.85 ? 57 GLY A O 1 +ATOM 431 N N . VAL A 1 58 ? 58.558 70.667 98.601 1.00 18.95 ? 58 VAL A N 1 +ATOM 432 C CA . VAL A 1 58 ? 58.164 70.274 97.234 1.00 18.48 ? 58 VAL A CA 1 +ATOM 433 C C . VAL A 1 58 ? 59.479 70.119 96.459 1.00 18.19 ? 58 VAL A C 1 +ATOM 434 O O . VAL A 1 58 ? 60.438 70.861 96.696 1.00 18.80 ? 58 VAL A O 1 +ATOM 435 C CB . VAL A 1 58 ? 57.176 71.311 96.579 1.00 18.70 ? 58 VAL A CB 1 +ATOM 436 C CG1 . VAL A 1 58 ? 56.813 70.996 95.048 1.00 18.71 ? 58 VAL A CG1 1 +ATOM 437 C CG2 . VAL A 1 58 ? 55.925 71.443 97.397 1.00 16.77 ? 58 VAL A CG2 1 +ATOM 438 N N . PRO A 1 59 ? 59.594 69.098 95.626 1.00 17.82 ? 59 PRO A N 1 +ATOM 439 C CA . PRO A 1 59 ? 60.836 68.904 94.887 1.00 17.87 ? 59 PRO A CA 1 +ATOM 440 C C . PRO A 1 59 ? 61.170 70.119 94.038 1.00 17.94 ? 59 PRO A C 1 +ATOM 441 O O . PRO A 1 59 ? 60.316 70.728 93.414 1.00 18.15 ? 59 PRO A O 1 +ATOM 442 C CB . PRO A 1 59 ? 60.540 67.663 94.052 1.00 18.23 ? 59 PRO A CB 1 +ATOM 443 C CG . PRO A 1 59 ? 59.538 66.934 94.888 1.00 17.31 ? 59 PRO A CG 1 +ATOM 444 C CD . PRO A 1 59 ? 58.635 68.014 95.361 1.00 17.59 ? 59 PRO A CD 1 +ATOM 445 N N . SER A 1 60 ? 62.435 70.495 94.032 1.00 18.85 ? 60 SER A N 1 +ATOM 446 C CA . SER A 1 60 ? 62.830 71.698 93.307 1.00 19.52 ? 60 SER A CA 1 +ATOM 447 C C . SER A 1 60 ? 62.540 71.576 91.832 1.00 18.82 ? 60 SER A C 1 +ATOM 448 O O . SER A 1 60 ? 62.575 72.572 91.141 1.00 20.05 ? 60 SER A O 1 +ATOM 449 C CB . SER A 1 60 ? 64.296 72.053 93.552 1.00 19.47 ? 60 SER A CB 1 +ATOM 450 O OG . SER A 1 60 ? 65.117 71.002 93.080 1.00 23.18 ? 60 SER A OG 1 +ATOM 451 N N . ARG A 1 61 ? 62.210 70.373 91.371 1.00 18.20 ? 61 ARG A N 1 +ATOM 452 C CA . ARG A 1 61 ? 61.821 70.126 89.984 1.00 17.94 ? 61 ARG A CA 1 +ATOM 453 C C . ARG A 1 61 ? 60.591 70.900 89.522 1.00 17.66 ? 61 ARG A C 1 +ATOM 454 O O . ARG A 1 61 ? 60.438 71.190 88.324 1.00 18.93 ? 61 ARG A O 1 +ATOM 455 C CB . ARG A 1 61 ? 61.749 68.616 89.701 1.00 18.64 ? 61 ARG A CB 1 +ATOM 456 C CG . ARG A 1 61 ? 60.405 67.935 89.537 1.00 19.53 ? 61 ARG A CG 1 +ATOM 457 C CD . ARG A 1 61 ? 60.615 66.428 89.292 1.00 20.54 ? 61 ARG A CD 1 +ATOM 458 N NE . ARG A 1 61 ? 59.669 65.543 89.939 1.00 18.05 ? 61 ARG A NE 1 +ATOM 459 C CZ . ARG A 1 61 ? 59.829 65.079 91.167 1.00 20.32 ? 61 ARG A CZ 1 +ATOM 460 N NH1 . ARG A 1 61 ? 60.887 65.433 91.904 1.00 23.05 ? 61 ARG A NH1 1 +ATOM 461 N NH2 . ARG A 1 61 ? 58.939 64.253 91.675 1.00 18.50 ? 61 ARG A NH2 1 +ATOM 462 N N . PHE A 1 62 ? 59.754 71.273 90.485 1.00 16.56 ? 62 PHE A N 1 +ATOM 463 C CA . PHE A 1 62 ? 58.612 72.148 90.264 1.00 15.02 ? 62 PHE A CA 1 +ATOM 464 C C . PHE A 1 62 ? 58.998 73.628 90.359 1.00 16.02 ? 62 PHE A C 1 +ATOM 465 O O . PHE A 1 62 ? 59.697 74.084 91.274 1.00 16.16 ? 62 PHE A O 1 +ATOM 466 C CB . PHE A 1 62 ? 57.522 71.830 91.283 1.00 14.16 ? 62 PHE A CB 1 +ATOM 467 C CG . PHE A 1 62 ? 56.910 70.462 91.113 1.00 10.49 ? 62 PHE A CG 1 +ATOM 468 C CD1 . PHE A 1 62 ? 55.819 70.271 90.266 1.00 7.23 ? 62 PHE A CD1 1 +ATOM 469 C CD2 . PHE A 1 62 ? 57.445 69.358 91.792 1.00 7.43 ? 62 PHE A CD2 1 +ATOM 470 C CE1 . PHE A 1 62 ? 55.272 69.002 90.099 1.00 9.78 ? 62 PHE A CE1 1 +ATOM 471 C CE2 . PHE A 1 62 ? 56.895 68.079 91.646 1.00 5.46 ? 62 PHE A CE2 1 +ATOM 472 C CZ . PHE A 1 62 ? 55.814 67.897 90.813 1.00 6.61 ? 62 PHE A CZ 1 +ATOM 473 N N . SER A 1 63 ? 58.512 74.398 89.403 1.00 16.41 ? 63 SER A N 1 +ATOM 474 C CA . SER A 1 63 ? 58.847 75.803 89.321 1.00 15.94 ? 63 SER A CA 1 +ATOM 475 C C . SER A 1 63 ? 57.584 76.516 88.827 1.00 15.86 ? 63 SER A C 1 +ATOM 476 O O . SER A 1 63 ? 56.744 75.928 88.118 1.00 16.27 ? 63 SER A O 1 +ATOM 477 C CB . SER A 1 63 ? 60.038 75.968 88.370 1.00 15.76 ? 63 SER A CB 1 +ATOM 478 O OG . SER A 1 63 ? 60.118 77.255 87.785 1.00 16.80 ? 63 SER A OG 1 +ATOM 479 N N . GLY A 1 64 ? 57.420 77.764 89.229 1.00 15.29 ? 64 GLY A N 1 +ATOM 480 C CA . GLY A 1 64 ? 56.323 78.560 88.734 1.00 14.98 ? 64 GLY A CA 1 +ATOM 481 C C . GLY A 1 64 ? 56.822 79.875 88.159 1.00 15.80 ? 64 GLY A C 1 +ATOM 482 O O . GLY A 1 64 ? 57.767 80.458 88.711 1.00 15.01 ? 64 GLY A O 1 +ATOM 483 N N . SER A 1 65 ? 56.208 80.350 87.065 1.00 16.11 ? 65 SER A N 1 +ATOM 484 C CA . SER A 1 65 ? 56.444 81.734 86.623 1.00 17.61 ? 65 SER A CA 1 +ATOM 485 C C . SER A 1 65 ? 55.191 82.539 86.178 1.00 18.16 ? 65 SER A C 1 +ATOM 486 O O . SER A 1 65 ? 54.110 81.983 85.963 1.00 19.10 ? 65 SER A O 1 +ATOM 487 C CB . SER A 1 65 ? 57.566 81.818 85.577 1.00 16.81 ? 65 SER A CB 1 +ATOM 488 O OG . SER A 1 65 ? 57.393 80.844 84.567 1.00 19.73 ? 65 SER A OG 1 +ATOM 489 N N . ARG A 1 66 ? 55.352 83.850 86.063 1.00 18.37 ? 66 ARG A N 1 +ATOM 490 C CA . ARG A 1 66 ? 54.307 84.723 85.597 1.00 18.78 ? 66 ARG A CA 1 +ATOM 491 C C . ARG A 1 66 ? 54.809 85.470 84.381 1.00 18.95 ? 66 ARG A C 1 +ATOM 492 O O . ARG A 1 66 ? 55.993 85.745 84.276 1.00 19.68 ? 66 ARG A O 1 +ATOM 493 C CB . ARG A 1 66 ? 53.927 85.665 86.729 1.00 19.33 ? 66 ARG A CB 1 +ATOM 494 C CG . ARG A 1 66 ? 53.848 87.126 86.376 1.00 20.54 ? 66 ARG A CG 1 +ATOM 495 C CD . ARG A 1 66 ? 52.570 87.767 86.802 1.00 20.33 ? 66 ARG A CD 1 +ATOM 496 N NE . ARG A 1 66 ? 52.772 89.086 87.398 1.00 21.76 ? 66 ARG A NE 1 +ATOM 497 C CZ . ARG A 1 66 ? 51.802 89.997 87.518 1.00 23.13 ? 66 ARG A CZ 1 +ATOM 498 N NH1 . ARG A 1 66 ? 50.573 89.709 87.079 1.00 24.22 ? 66 ARG A NH1 1 +ATOM 499 N NH2 . ARG A 1 66 ? 52.042 91.178 88.100 1.00 22.76 ? 66 ARG A NH2 1 +ATOM 500 N N . SER A 1 67 ? 53.925 85.770 83.436 1.00 19.41 ? 67 SER A N 1 +ATOM 501 C CA . SER A 1 67 ? 54.292 86.558 82.257 1.00 19.55 ? 67 SER A CA 1 +ATOM 502 C C . SER A 1 67 ? 53.032 87.332 81.890 1.00 20.32 ? 67 SER A C 1 +ATOM 503 O O . SER A 1 67 ? 52.233 86.921 81.039 1.00 20.20 ? 67 SER A O 1 +ATOM 504 C CB . SER A 1 67 ? 54.781 85.650 81.125 1.00 19.35 ? 67 SER A CB 1 +ATOM 505 O OG . SER A 1 67 ? 54.927 86.348 79.882 1.00 20.94 ? 67 SER A OG 1 +ATOM 506 N N . GLY A 1 68 ? 52.845 88.454 82.583 1.00 21.06 ? 68 GLY A N 1 +ATOM 507 C CA . GLY A 1 68 ? 51.605 89.210 82.520 1.00 20.80 ? 68 GLY A CA 1 +ATOM 508 C C . GLY A 1 68 ? 50.474 88.515 83.254 1.00 20.61 ? 68 GLY A C 1 +ATOM 509 O O . GLY A 1 68 ? 50.512 88.359 84.480 1.00 20.69 ? 68 GLY A O 1 +ATOM 510 N N . THR A 1 69 ? 49.459 88.097 82.503 1.00 20.45 ? 69 THR A N 1 +ATOM 511 C CA . THR A 1 69 ? 48.311 87.395 83.088 1.00 20.14 ? 69 THR A CA 1 +ATOM 512 C C . THR A 1 69 ? 48.433 85.899 82.845 1.00 20.06 ? 69 THR A C 1 +ATOM 513 O O . THR A 1 69 ? 47.560 85.140 83.276 1.00 20.07 ? 69 THR A O 1 +ATOM 514 C CB . THR A 1 69 ? 46.966 87.877 82.505 1.00 19.91 ? 69 THR A CB 1 +ATOM 515 O OG1 . THR A 1 69 ? 47.020 87.793 81.069 1.00 20.01 ? 69 THR A OG1 1 +ATOM 516 C CG2 . THR A 1 69 ? 46.734 89.341 82.809 1.00 19.64 ? 69 THR A CG2 1 +ATOM 517 N N . ASP A 1 70 ? 49.498 85.475 82.158 1.00 19.55 ? 70 ASP A N 1 +ATOM 518 C CA . ASP A 1 70 ? 49.737 84.046 81.948 1.00 19.63 ? 70 ASP A CA 1 +ATOM 519 C C . ASP A 1 70 ? 50.685 83.506 82.992 1.00 18.44 ? 70 ASP A C 1 +ATOM 520 O O . ASP A 1 70 ? 51.725 84.106 83.245 1.00 18.65 ? 70 ASP A O 1 +ATOM 521 C CB . ASP A 1 70 ? 50.304 83.804 80.576 1.00 20.48 ? 70 ASP A CB 1 +ATOM 522 C CG . ASP A 1 70 ? 49.230 83.654 79.545 1.00 25.54 ? 70 ASP A CG 1 +ATOM 523 O OD1 . ASP A 1 70 ? 48.741 82.499 79.348 1.00 31.90 ? 70 ASP A OD1 1 +ATOM 524 O OD2 . ASP A 1 70 ? 48.796 84.632 78.891 1.00 30.06 ? 70 ASP A OD2 1 +ATOM 525 N N . PHE A 1 71 ? 50.326 82.376 83.586 1.00 16.72 ? 71 PHE A N 1 +ATOM 526 C CA . PHE A 1 71 ? 51.059 81.827 84.722 1.00 15.21 ? 71 PHE A CA 1 +ATOM 527 C C . PHE A 1 71 ? 51.484 80.417 84.359 1.00 14.57 ? 71 PHE A C 1 +ATOM 528 O O . PHE A 1 71 ? 50.695 79.663 83.827 1.00 15.17 ? 71 PHE A O 1 +ATOM 529 C CB . PHE A 1 71 ? 50.169 81.813 85.972 1.00 15.14 ? 71 PHE A CB 1 +ATOM 530 C CG . PHE A 1 71 ? 49.981 83.183 86.589 1.00 14.07 ? 71 PHE A CG 1 +ATOM 531 C CD1 . PHE A 1 71 ? 48.969 84.012 86.160 1.00 11.60 ? 71 PHE A CD1 1 +ATOM 532 C CD2 . PHE A 1 71 ? 50.834 83.637 87.594 1.00 13.56 ? 71 PHE A CD2 1 +ATOM 533 C CE1 . PHE A 1 71 ? 48.804 85.298 86.694 1.00 12.46 ? 71 PHE A CE1 1 +ATOM 534 C CE2 . PHE A 1 71 ? 50.675 84.919 88.149 1.00 14.51 ? 71 PHE A CE2 1 +ATOM 535 C CZ . PHE A 1 71 ? 49.653 85.747 87.709 1.00 12.01 ? 71 PHE A CZ 1 +ATOM 536 N N . THR A 1 72 ? 52.726 80.063 84.624 1.00 13.48 ? 72 THR A N 1 +ATOM 537 C CA . THR A 1 72 ? 53.220 78.792 84.181 1.00 13.48 ? 72 THR A CA 1 +ATOM 538 C C . THR A 1 72 ? 53.811 77.989 85.307 1.00 13.73 ? 72 THR A C 1 +ATOM 539 O O . THR A 1 72 ? 54.668 78.477 86.026 1.00 13.76 ? 72 THR A O 1 +ATOM 540 C CB . THR A 1 72 ? 54.269 78.988 83.082 1.00 13.99 ? 72 THR A CB 1 +ATOM 541 O OG1 . THR A 1 72 ? 53.700 79.757 81.991 1.00 12.46 ? 72 THR A OG1 1 +ATOM 542 C CG2 . THR A 1 72 ? 54.632 77.639 82.493 1.00 12.31 ? 72 THR A CG2 1 +ATOM 543 N N . LEU A 1 73 ? 53.327 76.752 85.426 1.00 14.49 ? 73 LEU A N 1 +ATOM 544 C CA . LEU A 1 73 ? 53.918 75.683 86.254 1.00 14.05 ? 73 LEU A CA 1 +ATOM 545 C C . LEU A 1 73 ? 54.827 74.880 85.358 1.00 13.80 ? 73 LEU A C 1 +ATOM 546 O O . LEU A 1 73 ? 54.412 74.481 84.272 1.00 13.40 ? 73 LEU A O 1 +ATOM 547 C CB . LEU A 1 73 ? 52.829 74.751 86.832 1.00 13.27 ? 73 LEU A CB 1 +ATOM 548 C CG . LEU A 1 73 ? 53.291 73.563 87.714 1.00 12.02 ? 73 LEU A CG 1 +ATOM 549 C CD1 . LEU A 1 73 ? 53.888 74.028 89.093 1.00 11.64 ? 73 LEU A CD1 1 +ATOM 550 C CD2 . LEU A 1 73 ? 52.180 72.534 87.951 1.00 10.60 ? 73 LEU A CD2 1 +ATOM 551 N N . THR A 1 74 ? 56.057 74.651 85.804 1.00 14.14 ? 74 THR A N 1 +ATOM 552 C CA . THR A 1 74 ? 56.995 73.823 85.060 1.00 15.06 ? 74 THR A CA 1 +ATOM 553 C C . THR A 1 74 ? 57.454 72.680 85.932 1.00 16.14 ? 74 THR A C 1 +ATOM 554 O O . THR A 1 74 ? 57.901 72.882 87.037 1.00 17.18 ? 74 THR A O 1 +ATOM 555 C CB . THR A 1 74 ? 58.183 74.658 84.529 1.00 15.74 ? 74 THR A CB 1 +ATOM 556 O OG1 . THR A 1 74 ? 57.724 75.545 83.490 1.00 16.74 ? 74 THR A OG1 1 +ATOM 557 C CG2 . THR A 1 74 ? 59.252 73.781 83.828 1.00 13.80 ? 74 THR A CG2 1 +ATOM 558 N N . ILE A 1 75 ? 57.264 71.466 85.442 1.00 17.22 ? 75 ILE A N 1 +ATOM 559 C CA . ILE A 1 75 ? 57.902 70.286 85.992 1.00 18.24 ? 75 ILE A CA 1 +ATOM 560 C C . ILE A 1 75 ? 59.126 70.070 85.106 1.00 18.68 ? 75 ILE A C 1 +ATOM 561 O O . ILE A 1 75 ? 58.989 69.891 83.899 1.00 19.79 ? 75 ILE A O 1 +ATOM 562 C CB . ILE A 1 75 ? 56.905 69.142 85.922 1.00 17.96 ? 75 ILE A CB 1 +ATOM 563 C CG1 . ILE A 1 75 ? 55.627 69.587 86.637 1.00 19.85 ? 75 ILE A CG1 1 +ATOM 564 C CG2 . ILE A 1 75 ? 57.427 67.949 86.627 1.00 18.60 ? 75 ILE A CG2 1 +ATOM 565 C CD1 . ILE A 1 75 ? 54.485 68.632 86.619 1.00 22.47 ? 75 ILE A CD1 1 +ATOM 566 N N . SER A 1 76 ? 60.329 70.184 85.649 1.00 18.71 ? 76 SER A N 1 +ATOM 567 C CA . SER A 1 76 ? 61.490 70.230 84.762 1.00 18.63 ? 76 SER A CA 1 +ATOM 568 C C . SER A 1 76 ? 62.063 68.874 84.385 1.00 18.75 ? 76 SER A C 1 +ATOM 569 O O . SER A 1 76 ? 62.688 68.717 83.287 1.00 21.09 ? 76 SER A O 1 +ATOM 570 C CB . SER A 1 76 ? 62.596 71.115 85.320 1.00 18.88 ? 76 SER A CB 1 +ATOM 571 O OG . SER A 1 76 ? 63.335 70.421 86.302 1.00 19.34 ? 76 SER A OG 1 +ATOM 572 N N . SER A 1 77 ? 61.906 67.888 85.250 1.00 16.97 ? 77 SER A N 1 +ATOM 573 C CA . SER A 1 77 ? 62.280 66.541 84.820 1.00 16.26 ? 77 SER A CA 1 +ATOM 574 C C . SER A 1 77 ? 61.236 65.573 85.345 1.00 15.58 ? 77 SER A C 1 +ATOM 575 O O . SER A 1 77 ? 61.323 65.115 86.481 1.00 15.85 ? 77 SER A O 1 +ATOM 576 C CB . SER A 1 77 ? 63.702 66.188 85.249 1.00 16.18 ? 77 SER A CB 1 +ATOM 577 O OG . SER A 1 77 ? 63.755 64.861 85.698 1.00 18.15 ? 77 SER A OG 1 +ATOM 578 N N . LEU A 1 78 ? 60.221 65.314 84.513 1.00 14.29 ? 78 LEU A N 1 +ATOM 579 C CA . LEU A 1 78 ? 59.026 64.625 84.927 1.00 12.58 ? 78 LEU A CA 1 +ATOM 580 C C . LEU A 1 78 ? 59.436 63.297 85.506 1.00 11.94 ? 78 LEU A C 1 +ATOM 581 O O . LEU A 1 78 ? 60.256 62.591 84.927 1.00 11.73 ? 78 LEU A O 1 +ATOM 582 C CB . LEU A 1 78 ? 58.127 64.412 83.719 1.00 12.59 ? 78 LEU A CB 1 +ATOM 583 C CG . LEU A 1 78 ? 56.684 63.930 83.879 1.00 11.11 ? 78 LEU A CG 1 +ATOM 584 C CD1 . LEU A 1 78 ? 55.809 65.098 84.247 1.00 10.37 ? 78 LEU A CD1 1 +ATOM 585 C CD2 . LEU A 1 78 ? 56.201 63.324 82.585 1.00 9.79 ? 78 LEU A CD2 1 +ATOM 586 N N . GLN A 1 79 ? 58.870 62.981 86.662 1.00 11.03 ? 79 GLN A N 1 +ATOM 587 C CA . GLN A 1 79 ? 59.045 61.701 87.327 1.00 9.90 ? 79 GLN A CA 1 +ATOM 588 C C . GLN A 1 79 ? 57.698 60.925 87.385 1.00 10.08 ? 79 GLN A C 1 +ATOM 589 O O . GLN A 1 79 ? 56.617 61.514 87.425 1.00 9.92 ? 79 GLN A O 1 +ATOM 590 C CB . GLN A 1 79 ? 59.550 61.941 88.750 1.00 9.77 ? 79 GLN A CB 1 +ATOM 591 C CG . GLN A 1 79 ? 60.932 62.563 88.891 1.00 10.35 ? 79 GLN A CG 1 +ATOM 592 C CD . GLN A 1 79 ? 61.959 61.944 87.965 1.00 15.98 ? 79 GLN A CD 1 +ATOM 593 O OE1 . GLN A 1 79 ? 62.283 60.720 88.049 1.00 17.27 ? 79 GLN A OE1 1 +ATOM 594 N NE2 . GLN A 1 79 ? 62.475 62.764 87.060 1.00 15.69 ? 79 GLN A NE2 1 +ATOM 595 N N . PRO A 1 80 ? 57.738 59.608 87.501 1.00 10.29 ? 80 PRO A N 1 +ATOM 596 C CA . PRO A 1 80 ? 56.501 58.847 87.608 1.00 10.45 ? 80 PRO A CA 1 +ATOM 597 C C . PRO A 1 80 ? 55.505 59.369 88.692 1.00 11.47 ? 80 PRO A C 1 +ATOM 598 O O . PRO A 1 80 ? 54.294 59.374 88.443 1.00 12.23 ? 80 PRO A O 1 +ATOM 599 C CB . PRO A 1 80 ? 57.009 57.450 87.937 1.00 10.27 ? 80 PRO A CB 1 +ATOM 600 C CG . PRO A 1 80 ? 58.345 57.401 87.276 1.00 9.98 ? 80 PRO A CG 1 +ATOM 601 C CD . PRO A 1 80 ? 58.928 58.741 87.633 1.00 10.10 ? 80 PRO A CD 1 +ATOM 602 N N . GLU A 1 81 ? 55.984 59.805 89.847 1.00 11.73 ? 81 GLU A N 1 +ATOM 603 C CA . GLU A 1 81 ? 55.108 60.236 90.957 1.00 12.72 ? 81 GLU A CA 1 +ATOM 604 C C . GLU A 1 81 ? 54.360 61.514 90.596 1.00 12.46 ? 81 GLU A C 1 +ATOM 605 O O . GLU A 1 81 ? 53.526 61.994 91.350 1.00 11.58 ? 81 GLU A O 1 +ATOM 606 C CB . GLU A 1 81 ? 55.957 60.484 92.229 1.00 13.16 ? 81 GLU A CB 1 +ATOM 607 C CG . GLU A 1 81 ? 57.380 59.871 92.173 1.00 19.66 ? 81 GLU A CG 1 +ATOM 608 C CD . GLU A 1 81 ? 58.525 60.883 92.176 1.00 26.12 ? 81 GLU A CD 1 +ATOM 609 O OE1 . GLU A 1 81 ? 58.345 62.034 92.639 1.00 30.88 ? 81 GLU A OE1 1 +ATOM 610 O OE2 . GLU A 1 81 ? 59.638 60.527 91.735 1.00 29.41 ? 81 GLU A OE2 1 +ATOM 611 N N . ASP A 1 82 ? 54.703 62.088 89.447 1.00 12.56 ? 82 ASP A N 1 +ATOM 612 C CA . ASP A 1 82 ? 54.169 63.379 89.046 1.00 12.65 ? 82 ASP A CA 1 +ATOM 613 C C . ASP A 1 82 ? 52.893 63.193 88.268 1.00 12.94 ? 82 ASP A C 1 +ATOM 614 O O . ASP A 1 82 ? 52.352 64.172 87.733 1.00 11.86 ? 82 ASP A O 1 +ATOM 615 C CB . ASP A 1 82 ? 55.179 64.138 88.185 1.00 12.39 ? 82 ASP A CB 1 +ATOM 616 C CG . ASP A 1 82 ? 56.395 64.572 88.985 1.00 14.08 ? 82 ASP A CG 1 +ATOM 617 O OD1 . ASP A 1 82 ? 56.231 64.687 90.236 1.00 12.60 ? 82 ASP A OD1 1 +ATOM 618 O OD2 . ASP A 1 82 ? 57.526 64.825 88.459 1.00 14.71 ? 82 ASP A OD2 1 +ATOM 619 N N . PHE A 1 83 ? 52.460 61.929 88.161 1.00 11.75 ? 83 PHE A N 1 +ATOM 620 C CA . PHE A 1 83 ? 51.191 61.607 87.560 1.00 11.90 ? 83 PHE A CA 1 +ATOM 621 C C . PHE A 1 83 ? 50.154 62.218 88.473 1.00 12.16 ? 83 PHE A C 1 +ATOM 622 O O . PHE A 1 83 ? 50.132 61.884 89.666 1.00 12.97 ? 83 PHE A O 1 +ATOM 623 C CB . PHE A 1 83 ? 51.000 60.079 87.474 1.00 11.72 ? 83 PHE A CB 1 +ATOM 624 C CG . PHE A 1 83 ? 49.581 59.667 87.240 1.00 12.66 ? 83 PHE A CG 1 +ATOM 625 C CD1 . PHE A 1 83 ? 49.039 59.683 85.935 1.00 13.78 ? 83 PHE A CD1 1 +ATOM 626 C CD2 . PHE A 1 83 ? 48.764 59.310 88.319 1.00 12.92 ? 83 PHE A CD2 1 +ATOM 627 C CE1 . PHE A 1 83 ? 47.725 59.307 85.686 1.00 10.98 ? 83 PHE A CE1 1 +ATOM 628 C CE2 . PHE A 1 83 ? 47.445 58.984 88.107 1.00 12.95 ? 83 PHE A CE2 1 +ATOM 629 C CZ . PHE A 1 83 ? 46.925 58.963 86.770 1.00 15.29 ? 83 PHE A CZ 1 +ATOM 630 N N . ALA A 1 84 ? 49.306 63.097 87.922 1.00 11.65 ? 84 ALA A N 1 +ATOM 631 C CA . ALA A 1 84 ? 48.358 63.908 88.705 1.00 11.41 ? 84 ALA A CA 1 +ATOM 632 C C . ALA A 1 84 ? 47.557 64.933 87.883 1.00 12.15 ? 84 ALA A C 1 +ATOM 633 O O . ALA A 1 84 ? 47.881 65.206 86.703 1.00 12.87 ? 84 ALA A O 1 +ATOM 634 C CB . ALA A 1 84 ? 49.068 64.612 89.811 1.00 10.99 ? 84 ALA A CB 1 +ATOM 635 N N . THR A 1 85 ? 46.492 65.456 88.491 1.00 12.06 ? 85 THR A N 1 +ATOM 636 C CA . THR A 1 85 ? 45.899 66.706 88.042 1.00 12.77 ? 85 THR A CA 1 +ATOM 637 C C . THR A 1 85 ? 46.506 67.912 88.762 1.00 13.01 ? 85 THR A C 1 +ATOM 638 O O . THR A 1 85 ? 46.709 67.898 90.001 1.00 13.36 ? 85 THR A O 1 +ATOM 639 C CB . THR A 1 85 ? 44.384 66.723 88.248 1.00 12.58 ? 85 THR A CB 1 +ATOM 640 O OG1 . THR A 1 85 ? 43.821 65.524 87.733 1.00 13.24 ? 85 THR A OG1 1 +ATOM 641 C CG2 . THR A 1 85 ? 43.736 67.770 87.317 1.00 12.39 ? 85 THR A CG2 1 +ATOM 642 N N . TYR A 1 86 ? 46.755 68.957 87.979 1.00 12.66 ? 86 TYR A N 1 +ATOM 643 C CA . TYR A 1 86 ? 47.376 70.191 88.442 1.00 12.49 ? 86 TYR A CA 1 +ATOM 644 C C . TYR A 1 86 ? 46.385 71.353 88.215 1.00 13.72 ? 86 TYR A C 1 +ATOM 645 O O . TYR A 1 86 ? 45.672 71.379 87.182 1.00 13.35 ? 86 TYR A O 1 +ATOM 646 C CB . TYR A 1 86 ? 48.709 70.424 87.703 1.00 11.67 ? 86 TYR A CB 1 +ATOM 647 C CG . TYR A 1 86 ? 49.749 69.396 87.998 1.00 10.84 ? 86 TYR A CG 1 +ATOM 648 C CD1 . TYR A 1 86 ? 50.625 69.550 89.050 1.00 9.77 ? 86 TYR A CD1 1 +ATOM 649 C CD2 . TYR A 1 86 ? 49.828 68.214 87.239 1.00 15.39 ? 86 TYR A CD2 1 +ATOM 650 C CE1 . TYR A 1 86 ? 51.566 68.560 89.353 1.00 13.16 ? 86 TYR A CE1 1 +ATOM 651 C CE2 . TYR A 1 86 ? 50.767 67.217 87.512 1.00 11.83 ? 86 TYR A CE2 1 +ATOM 652 C CZ . TYR A 1 86 ? 51.639 67.390 88.576 1.00 14.89 ? 86 TYR A CZ 1 +ATOM 653 O OH . TYR A 1 86 ? 52.575 66.395 88.863 1.00 14.08 ? 86 TYR A OH 1 +ATOM 654 N N . TYR A 1 87 ? 46.342 72.289 89.178 1.00 14.92 ? 87 TYR A N 1 +ATOM 655 C CA . TYR A 1 87 ? 45.332 73.360 89.235 1.00 16.71 ? 87 TYR A CA 1 +ATOM 656 C C . TYR A 1 87 ? 46.018 74.676 89.608 1.00 18.17 ? 87 TYR A C 1 +ATOM 657 O O . TYR A 1 87 ? 46.713 74.743 90.661 1.00 19.12 ? 87 TYR A O 1 +ATOM 658 C CB . TYR A 1 87 ? 44.296 73.049 90.340 1.00 16.51 ? 87 TYR A CB 1 +ATOM 659 C CG . TYR A 1 87 ? 43.366 71.874 90.075 1.00 14.66 ? 87 TYR A CG 1 +ATOM 660 C CD1 . TYR A 1 87 ? 43.607 70.626 90.640 1.00 13.99 ? 87 TYR A CD1 1 +ATOM 661 C CD2 . TYR A 1 87 ? 42.263 72.016 89.262 1.00 13.10 ? 87 TYR A CD2 1 +ATOM 662 C CE1 . TYR A 1 87 ? 42.769 69.552 90.389 1.00 15.72 ? 87 TYR A CE1 1 +ATOM 663 C CE2 . TYR A 1 87 ? 41.409 70.957 89.009 1.00 14.53 ? 87 TYR A CE2 1 +ATOM 664 C CZ . TYR A 1 87 ? 41.668 69.711 89.566 1.00 17.40 ? 87 TYR A CZ 1 +ATOM 665 O OH . TYR A 1 87 ? 40.820 68.627 89.301 1.00 19.26 ? 87 TYR A OH 1 +ATOM 666 N N . CYS A 1 88 ? 45.875 75.699 88.776 1.00 17.68 ? 88 CYS A N 1 +ATOM 667 C CA . CYS A 1 88 ? 46.208 77.049 89.224 1.00 19.18 ? 88 CYS A CA 1 +ATOM 668 C C . CYS A 1 88 ? 45.021 77.563 90.043 1.00 18.54 ? 88 CYS A C 1 +ATOM 669 O O . CYS A 1 88 ? 43.879 77.087 89.898 1.00 19.07 ? 88 CYS A O 1 +ATOM 670 C CB . CYS A 1 88 ? 46.468 78.007 88.059 1.00 19.19 ? 88 CYS A CB 1 +ATOM 671 S SG . CYS A 1 88 ? 45.049 78.057 86.915 1.00 28.00 ? 88 CYS A SG 1 +ATOM 672 N N . GLN A 1 89 ? 45.284 78.526 90.913 1.00 17.00 ? 89 GLN A N 1 +ATOM 673 C CA . GLN A 1 89 ? 44.218 79.168 91.661 1.00 15.72 ? 89 GLN A CA 1 +ATOM 674 C C . GLN A 1 89 ? 44.630 80.610 91.743 1.00 14.27 ? 89 GLN A C 1 +ATOM 675 O O . GLN A 1 89 ? 45.817 80.887 91.896 1.00 13.82 ? 89 GLN A O 1 +ATOM 676 C CB . GLN A 1 89 ? 44.144 78.574 93.072 1.00 16.40 ? 89 GLN A CB 1 +ATOM 677 C CG . GLN A 1 89 ? 43.041 79.178 93.961 1.00 16.78 ? 89 GLN A CG 1 +ATOM 678 C CD . GLN A 1 89 ? 43.251 78.935 95.442 1.00 16.92 ? 89 GLN A CD 1 +ATOM 679 O OE1 . GLN A 1 89 ? 42.283 78.704 96.154 1.00 21.50 ? 89 GLN A OE1 1 +ATOM 680 N NE2 . GLN A 1 89 ? 44.491 78.991 95.915 1.00 11.91 ? 89 GLN A NE2 1 +ATOM 681 N N . GLN A 1 90 ? 43.679 81.523 91.605 1.00 13.13 ? 90 GLN A N 1 +ATOM 682 C CA . GLN A 1 90 ? 43.938 82.934 91.925 1.00 12.56 ? 90 GLN A CA 1 +ATOM 683 C C . GLN A 1 90 ? 43.297 83.378 93.264 1.00 11.48 ? 90 GLN A C 1 +ATOM 684 O O . GLN A 1 90 ? 42.149 83.103 93.507 1.00 11.14 ? 90 GLN A O 1 +ATOM 685 C CB . GLN A 1 90 ? 43.560 83.874 90.759 1.00 11.96 ? 90 GLN A CB 1 +ATOM 686 C CG . GLN A 1 90 ? 42.057 84.136 90.541 1.00 12.35 ? 90 GLN A CG 1 +ATOM 687 C CD . GLN A 1 90 ? 41.459 85.106 91.528 1.00 13.88 ? 90 GLN A CD 1 +ATOM 688 O OE1 . GLN A 1 90 ? 42.157 85.918 92.100 1.00 18.45 ? 90 GLN A OE1 1 +ATOM 689 N NE2 . GLN A 1 90 ? 40.178 84.983 91.774 1.00 16.21 ? 90 GLN A NE2 1 +ATOM 690 N N . HIS A 1 91 ? 44.038 84.083 94.110 1.00 11.28 ? 91 HIS A N 1 +ATOM 691 C CA . HIS A 1 91 ? 43.433 84.663 95.322 1.00 10.80 ? 91 HIS A CA 1 +ATOM 692 C C . HIS A 1 91 ? 43.568 86.195 95.369 1.00 10.89 ? 91 HIS A C 1 +ATOM 693 O O . HIS A 1 91 ? 43.637 86.801 96.443 1.00 11.00 ? 91 HIS A O 1 +ATOM 694 C CB . HIS A 1 91 ? 43.992 84.003 96.580 1.00 10.27 ? 91 HIS A CB 1 +ATOM 695 C CG . HIS A 1 91 ? 45.445 84.264 96.783 1.00 9.83 ? 91 HIS A CG 1 +ATOM 696 N ND1 . HIS A 1 91 ? 46.418 83.427 96.294 1.00 12.10 ? 91 HIS A ND1 1 +ATOM 697 C CD2 . HIS A 1 91 ? 46.095 85.300 97.363 1.00 9.45 ? 91 HIS A CD2 1 +ATOM 698 C CE1 . HIS A 1 91 ? 47.607 83.930 96.579 1.00 11.08 ? 91 HIS A CE1 1 +ATOM 699 N NE2 . HIS A 1 91 ? 47.436 85.067 97.221 1.00 9.39 ? 91 HIS A NE2 1 +ATOM 700 N N . TYR A 1 92 ? 43.602 86.823 94.199 1.00 11.33 ? 92 TYR A N 1 +ATOM 701 C CA . TYR A 1 92 ? 43.702 88.286 94.103 1.00 11.54 ? 92 TYR A CA 1 +ATOM 702 C C . TYR A 1 92 ? 42.471 89.017 94.624 1.00 12.47 ? 92 TYR A C 1 +ATOM 703 O O . TYR A 1 92 ? 42.587 90.040 95.306 1.00 12.06 ? 92 TYR A O 1 +ATOM 704 C CB . TYR A 1 92 ? 43.935 88.712 92.673 1.00 11.29 ? 92 TYR A CB 1 +ATOM 705 C CG . TYR A 1 92 ? 44.214 90.166 92.622 1.00 10.98 ? 92 TYR A CG 1 +ATOM 706 C CD1 . TYR A 1 92 ? 45.440 90.662 93.066 1.00 11.78 ? 92 TYR A CD1 1 +ATOM 707 C CD2 . TYR A 1 92 ? 43.250 91.069 92.190 1.00 7.96 ? 92 TYR A CD2 1 +ATOM 708 C CE1 . TYR A 1 92 ? 45.715 92.045 93.050 1.00 9.43 ? 92 TYR A CE1 1 +ATOM 709 C CE2 . TYR A 1 92 ? 43.512 92.452 92.184 1.00 10.72 ? 92 TYR A CE2 1 +ATOM 710 C CZ . TYR A 1 92 ? 44.744 92.924 92.615 1.00 10.43 ? 92 TYR A CZ 1 +ATOM 711 O OH . TYR A 1 92 ? 45.008 94.273 92.612 1.00 11.41 ? 92 TYR A OH 1 +ATOM 712 N N . THR A 1 93 ? 41.305 88.491 94.253 1.00 12.85 ? 93 THR A N 1 +ATOM 713 C CA . THR A 1 93 ? 40.031 88.881 94.822 1.00 14.32 ? 93 THR A CA 1 +ATOM 714 C C . THR A 1 93 ? 39.343 87.653 95.443 1.00 15.18 ? 93 THR A C 1 +ATOM 715 O O . THR A 1 93 ? 39.740 86.505 95.205 1.00 14.21 ? 93 THR A O 1 +ATOM 716 C CB . THR A 1 93 ? 39.062 89.354 93.706 1.00 15.09 ? 93 THR A CB 1 +ATOM 717 O OG1 . THR A 1 93 ? 38.805 88.232 92.826 1.00 13.50 ? 93 THR A OG1 1 +ATOM 718 C CG2 . THR A 1 93 ? 39.665 90.540 92.820 1.00 13.16 ? 93 THR A CG2 1 +ATOM 719 N N . THR A 1 94 ? 38.287 87.934 96.217 1.00 15.61 ? 94 THR A N 1 +ATOM 720 C CA . THR A 1 94 ? 37.367 86.923 96.686 1.00 15.99 ? 94 THR A CA 1 +ATOM 721 C C . THR A 1 94 ? 36.107 86.970 95.795 1.00 16.43 ? 94 THR A C 1 +ATOM 722 O O . THR A 1 94 ? 35.645 88.053 95.429 1.00 15.70 ? 94 THR A O 1 +ATOM 723 C CB . THR A 1 94 ? 37.053 87.139 98.187 1.00 16.29 ? 94 THR A CB 1 +ATOM 724 O OG1 . THR A 1 94 ? 38.226 86.872 98.976 1.00 16.62 ? 94 THR A OG1 1 +ATOM 725 C CG2 . THR A 1 94 ? 36.077 86.074 98.696 1.00 16.22 ? 94 THR A CG2 1 +ATOM 726 N N . PRO A 1 95 ? 35.560 85.823 95.398 1.00 16.70 ? 95 PRO A N 1 +ATOM 727 C CA . PRO A 1 95 ? 36.083 84.471 95.664 1.00 17.20 ? 95 PRO A CA 1 +ATOM 728 C C . PRO A 1 95 ? 37.394 84.060 94.957 1.00 17.42 ? 95 PRO A C 1 +ATOM 729 O O . PRO A 1 95 ? 37.664 84.521 93.838 1.00 17.71 ? 95 PRO A O 1 +ATOM 730 C CB . PRO A 1 95 ? 34.957 83.585 95.148 1.00 16.80 ? 95 PRO A CB 1 +ATOM 731 C CG . PRO A 1 95 ? 34.281 84.427 94.110 1.00 18.22 ? 95 PRO A CG 1 +ATOM 732 C CD . PRO A 1 95 ? 34.296 85.794 94.654 1.00 16.83 ? 95 PRO A CD 1 +ATOM 733 N N . PRO A 1 96 ? 38.170 83.167 95.580 1.00 17.65 ? 96 PRO A N 1 +ATOM 734 C CA . PRO A 1 96 ? 39.366 82.622 94.927 1.00 18.22 ? 96 PRO A CA 1 +ATOM 735 C C . PRO A 1 96 ? 38.868 81.672 93.857 1.00 19.11 ? 96 PRO A C 1 +ATOM 736 O O . PRO A 1 96 ? 37.833 81.049 94.079 1.00 19.49 ? 96 PRO A O 1 +ATOM 737 C CB . PRO A 1 96 ? 40.062 81.828 96.038 1.00 17.34 ? 96 PRO A CB 1 +ATOM 738 C CG . PRO A 1 96 ? 38.998 81.468 96.965 1.00 17.57 ? 96 PRO A CG 1 +ATOM 739 C CD . PRO A 1 96 ? 37.946 82.557 96.900 1.00 17.09 ? 96 PRO A CD 1 +ATOM 740 N N . THR A 1 97 ? 39.527 81.594 92.703 1.00 19.00 ? 97 THR A N 1 +ATOM 741 C CA . THR A 1 97 ? 39.071 80.653 91.698 1.00 17.74 ? 97 THR A CA 1 +ATOM 742 C C . THR A 1 97 ? 40.103 79.697 91.177 1.00 17.37 ? 97 THR A C 1 +ATOM 743 O O . THR A 1 97 ? 41.268 80.045 91.005 1.00 18.95 ? 97 THR A O 1 +ATOM 744 C CB . THR A 1 97 ? 38.426 81.361 90.542 1.00 17.66 ? 97 THR A CB 1 +ATOM 745 O OG1 . THR A 1 97 ? 39.161 82.559 90.283 1.00 18.33 ? 97 THR A OG1 1 +ATOM 746 C CG2 . THR A 1 97 ? 37.041 81.817 90.970 1.00 16.51 ? 97 THR A CG2 1 +ATOM 747 N N . PHE A 1 98 ? 39.621 78.501 90.882 1.00 16.22 ? 98 PHE A N 1 +ATOM 748 C CA . PHE A 1 98 ? 40.395 77.440 90.335 1.00 15.67 ? 98 PHE A CA 1 +ATOM 749 C C . PHE A 1 98 ? 40.376 77.387 88.802 1.00 15.25 ? 98 PHE A C 1 +ATOM 750 O O . PHE A 1 98 ? 39.346 77.603 88.180 1.00 15.17 ? 98 PHE A O 1 +ATOM 751 C CB . PHE A 1 98 ? 39.881 76.151 90.935 1.00 15.53 ? 98 PHE A CB 1 +ATOM 752 C CG . PHE A 1 98 ? 40.315 75.950 92.361 1.00 16.29 ? 98 PHE A CG 1 +ATOM 753 C CD1 . PHE A 1 98 ? 41.682 75.812 92.679 1.00 17.19 ? 98 PHE A CD1 1 +ATOM 754 C CD2 . PHE A 1 98 ? 39.374 75.864 93.387 1.00 14.25 ? 98 PHE A CD2 1 +ATOM 755 C CE1 . PHE A 1 98 ? 42.109 75.616 94.030 1.00 18.46 ? 98 PHE A CE1 1 +ATOM 756 C CE2 . PHE A 1 98 ? 39.783 75.670 94.705 1.00 18.75 ? 98 PHE A CE2 1 +ATOM 757 C CZ . PHE A 1 98 ? 41.159 75.544 95.035 1.00 17.58 ? 98 PHE A CZ 1 +ATOM 758 N N . GLY A 1 99 ? 41.522 77.107 88.195 1.00 14.45 ? 99 GLY A N 1 +ATOM 759 C CA . GLY A 1 99 ? 41.511 76.620 86.821 1.00 15.75 ? 99 GLY A CA 1 +ATOM 760 C C . GLY A 1 99 ? 40.837 75.239 86.726 1.00 16.21 ? 99 GLY A C 1 +ATOM 761 O O . GLY A 1 99 ? 40.630 74.563 87.749 1.00 16.92 ? 99 GLY A O 1 +ATOM 762 N N . GLN A 1 100 ? 40.481 74.837 85.514 1.00 16.39 ? 100 GLN A N 1 +ATOM 763 C CA . GLN A 1 100 ? 39.846 73.540 85.226 1.00 17.80 ? 100 GLN A CA 1 +ATOM 764 C C . GLN A 1 100 ? 40.713 72.309 85.562 1.00 16.82 ? 100 GLN A C 1 +ATOM 765 O O . GLN A 1 100 ? 40.218 71.189 85.584 1.00 16.60 ? 100 GLN A O 1 +ATOM 766 C CB . GLN A 1 100 ? 39.478 73.434 83.747 1.00 17.61 ? 100 GLN A CB 1 +ATOM 767 C CG . GLN A 1 100 ? 38.639 74.550 83.219 1.00 24.77 ? 100 GLN A CG 1 +ATOM 768 C CD . GLN A 1 100 ? 38.429 74.450 81.682 1.00 34.03 ? 100 GLN A CD 1 +ATOM 769 O OE1 . GLN A 1 100 ? 39.238 73.808 80.949 1.00 36.20 ? 100 GLN A OE1 1 +ATOM 770 N NE2 . GLN A 1 100 ? 37.335 75.057 81.198 1.00 33.63 ? 100 GLN A NE2 1 +ATOM 771 N N . GLY A 1 101 ? 42.002 72.536 85.775 1.00 16.60 ? 101 GLY A N 1 +ATOM 772 C CA . GLY A 1 101 ? 42.963 71.496 86.049 1.00 16.15 ? 101 GLY A CA 1 +ATOM 773 C C . GLY A 1 101 ? 43.487 70.935 84.760 1.00 16.56 ? 101 GLY A C 1 +ATOM 774 O O . GLY A 1 101 ? 42.818 70.936 83.726 1.00 15.56 ? 101 GLY A O 1 +ATOM 775 N N . THR A 1 102 ? 44.710 70.442 84.819 1.00 18.01 ? 102 THR A N 1 +ATOM 776 C CA . THR A 1 102 ? 45.276 69.752 83.666 1.00 18.53 ? 102 THR A CA 1 +ATOM 777 C C . THR A 1 102 ? 45.933 68.470 84.090 1.00 18.47 ? 102 THR A C 1 +ATOM 778 O O . THR A 1 102 ? 46.827 68.478 84.919 1.00 19.17 ? 102 THR A O 1 +ATOM 779 C CB . THR A 1 102 ? 46.255 70.640 82.899 1.00 18.29 ? 102 THR A CB 1 +ATOM 780 O OG1 . THR A 1 102 ? 47.402 69.863 82.548 1.00 19.27 ? 102 THR A OG1 1 +ATOM 781 C CG2 . THR A 1 102 ? 46.793 71.657 83.765 1.00 19.37 ? 102 THR A CG2 1 +ATOM 782 N N . LYS A 1 103 ? 45.455 67.383 83.502 1.00 18.35 ? 103 LYS A N 1 +ATOM 783 C CA . LYS A 1 103 ? 45.871 66.021 83.791 1.00 18.25 ? 103 LYS A CA 1 +ATOM 784 C C . LYS A 1 103 ? 47.209 65.683 83.120 1.00 17.63 ? 103 LYS A C 1 +ATOM 785 O O . LYS A 1 103 ? 47.350 65.822 81.917 1.00 18.49 ? 103 LYS A O 1 +ATOM 786 C CB . LYS A 1 103 ? 44.776 65.064 83.299 1.00 18.39 ? 103 LYS A CB 1 +ATOM 787 C CG . LYS A 1 103 ? 44.360 63.966 84.322 1.00 22.50 ? 103 LYS A CG 1 +ATOM 788 C CD . LYS A 1 103 ? 45.443 62.781 84.491 1.00 24.67 ? 103 LYS A CD 1 +ATOM 789 C CE . LYS A 1 103 ? 44.810 61.422 84.055 1.00 24.70 ? 103 LYS A CE 1 +ATOM 790 N NZ . LYS A 1 103 ? 45.637 60.674 83.051 1.00 22.87 ? 103 LYS A NZ 1 +ATOM 791 N N . VAL A 1 104 ? 48.204 65.275 83.903 1.00 16.91 ? 104 VAL A N 1 +ATOM 792 C CA . VAL A 1 104 ? 49.484 64.875 83.361 1.00 14.99 ? 104 VAL A CA 1 +ATOM 793 C C . VAL A 1 104 ? 49.535 63.357 83.309 1.00 15.85 ? 104 VAL A C 1 +ATOM 794 O O . VAL A 1 104 ? 49.429 62.679 84.332 1.00 16.40 ? 104 VAL A O 1 +ATOM 795 C CB . VAL A 1 104 ? 50.615 65.436 84.199 1.00 14.45 ? 104 VAL A CB 1 +ATOM 796 C CG1 . VAL A 1 104 ? 51.927 64.803 83.874 1.00 11.69 ? 104 VAL A CG1 1 +ATOM 797 C CG2 . VAL A 1 104 ? 50.736 66.897 83.932 1.00 15.19 ? 104 VAL A CG2 1 +ATOM 798 N N . GLU A 1 105 ? 49.668 62.810 82.119 1.00 15.50 ? 105 GLU A N 1 +ATOM 799 C CA . GLU A 1 105 ? 49.787 61.376 82.005 1.00 17.57 ? 105 GLU A CA 1 +ATOM 800 C C . GLU A 1 105 ? 51.215 61.039 81.630 1.00 16.96 ? 105 GLU A C 1 +ATOM 801 O O . GLU A 1 105 ? 51.883 61.819 81.006 1.00 16.92 ? 105 GLU A O 1 +ATOM 802 C CB . GLU A 1 105 ? 48.804 60.862 80.966 1.00 18.30 ? 105 GLU A CB 1 +ATOM 803 C CG . GLU A 1 105 ? 47.618 61.813 80.841 1.00 25.15 ? 105 GLU A CG 1 +ATOM 804 C CD . GLU A 1 105 ? 46.588 61.358 79.837 1.00 33.01 ? 105 GLU A CD 1 +ATOM 805 O OE1 . GLU A 1 105 ? 46.836 61.546 78.601 1.00 33.22 ? 105 GLU A OE1 1 +ATOM 806 O OE2 . GLU A 1 105 ? 45.534 60.820 80.305 1.00 36.90 ? 105 GLU A OE2 1 +ATOM 807 N N . ILE A 1 106 ? 51.691 59.874 82.030 1.00 17.11 ? 106 ILE A N 1 +ATOM 808 C CA . ILE A 1 106 ? 53.060 59.512 81.741 1.00 16.64 ? 106 ILE A CA 1 +ATOM 809 C C . ILE A 1 106 ? 53.133 58.480 80.641 1.00 16.23 ? 106 ILE A C 1 +ATOM 810 O O . ILE A 1 106 ? 52.469 57.445 80.715 1.00 16.84 ? 106 ILE A O 1 +ATOM 811 C CB . ILE A 1 106 ? 53.741 59.096 83.013 1.00 16.80 ? 106 ILE A CB 1 +ATOM 812 C CG1 . ILE A 1 106 ? 54.096 60.385 83.774 1.00 19.77 ? 106 ILE A CG1 1 +ATOM 813 C CG2 . ILE A 1 106 ? 55.017 58.359 82.710 1.00 16.41 ? 106 ILE A CG2 1 +ATOM 814 C CD1 . ILE A 1 106 ? 53.568 60.436 85.123 1.00 22.75 ? 106 ILE A CD1 1 +ATOM 815 N N . LYS A 1 107 ? 53.895 58.790 79.595 1.00 15.64 ? 107 LYS A N 1 +ATOM 816 C CA . LYS A 1 107 ? 54.126 57.841 78.497 1.00 15.93 ? 107 LYS A CA 1 +ATOM 817 C C . LYS A 1 107 ? 55.336 57.001 78.846 1.00 14.55 ? 107 LYS A C 1 +ATOM 818 O O . LYS A 1 107 ? 56.446 57.520 78.966 1.00 14.92 ? 107 LYS A O 1 +ATOM 819 C CB . LYS A 1 107 ? 54.377 58.558 77.144 1.00 16.17 ? 107 LYS A CB 1 +ATOM 820 C CG . LYS A 1 107 ? 53.309 58.331 76.086 1.00 19.62 ? 107 LYS A CG 1 +ATOM 821 C CD . LYS A 1 107 ? 53.546 59.135 74.777 1.00 23.99 ? 107 LYS A CD 1 +ATOM 822 C CE . LYS A 1 107 ? 52.931 60.562 74.824 1.00 24.82 ? 107 LYS A CE 1 +ATOM 823 N NZ . LYS A 1 107 ? 53.888 61.674 74.457 1.00 23.33 ? 107 LYS A NZ 1 +ATOM 824 N N . ARG A 1 108 ? 55.123 55.704 79.011 1.00 13.51 ? 108 ARG A N 1 +ATOM 825 C CA . ARG A 1 108 ? 56.225 54.778 79.213 1.00 12.17 ? 108 ARG A CA 1 +ATOM 826 C C . ARG A 1 108 ? 56.369 53.812 78.043 1.00 12.07 ? 108 ARG A C 1 +ATOM 827 O O . ARG A 1 108 ? 55.795 53.984 76.980 1.00 10.99 ? 108 ARG A O 1 +ATOM 828 C CB . ARG A 1 108 ? 56.114 54.025 80.563 1.00 11.07 ? 108 ARG A CB 1 +ATOM 829 C CG . ARG A 1 108 ? 54.774 53.317 80.827 1.00 10.61 ? 108 ARG A CG 1 +ATOM 830 C CD . ARG A 1 108 ? 54.847 52.019 81.682 1.00 6.58 ? 108 ARG A CD 1 +ATOM 831 N NE . ARG A 1 108 ? 55.862 51.105 81.146 1.00 5.66 ? 108 ARG A NE 1 +ATOM 832 C CZ . ARG A 1 108 ? 56.603 50.262 81.862 1.00 5.56 ? 108 ARG A CZ 1 +ATOM 833 N NH1 . ARG A 1 108 ? 56.450 50.131 83.174 1.00 6.03 ? 108 ARG A NH1 1 +ATOM 834 N NH2 . ARG A 1 108 ? 57.509 49.536 81.252 1.00 8.23 ? 108 ARG A NH2 1 +ATOM 835 N N . THR A 1 109 ? 57.162 52.788 78.289 1.00 13.18 ? 109 THR A N 1 +ATOM 836 C CA . THR A 1 109 ? 57.438 51.712 77.383 1.00 13.24 ? 109 THR A CA 1 +ATOM 837 C C . THR A 1 109 ? 56.276 50.741 77.452 1.00 12.87 ? 109 THR A C 1 +ATOM 838 O O . THR A 1 109 ? 55.588 50.680 78.476 1.00 12.74 ? 109 THR A O 1 +ATOM 839 C CB . THR A 1 109 ? 58.774 51.097 77.843 1.00 13.74 ? 109 THR A CB 1 +ATOM 840 O OG1 . THR A 1 109 ? 59.824 51.827 77.197 1.00 13.46 ? 109 THR A OG1 1 +ATOM 841 C CG2 . THR A 1 109 ? 58.990 49.683 77.322 1.00 16.47 ? 109 THR A CG2 1 +ATOM 842 N N . VAL A 1 110 ? 56.045 50.023 76.343 1.00 12.58 ? 110 VAL A N 1 +ATOM 843 C CA . VAL A 1 110 ? 54.988 49.013 76.232 1.00 12.06 ? 110 VAL A CA 1 +ATOM 844 C C . VAL A 1 110 ? 55.179 47.968 77.345 1.00 12.01 ? 110 VAL A C 1 +ATOM 845 O O . VAL A 1 110 ? 56.314 47.659 77.756 1.00 12.08 ? 110 VAL A O 1 +ATOM 846 C CB . VAL A 1 110 ? 54.886 48.398 74.769 1.00 12.18 ? 110 VAL A CB 1 +ATOM 847 C CG1 . VAL A 1 110 ? 54.017 47.150 74.707 1.00 11.74 ? 110 VAL A CG1 1 +ATOM 848 C CG2 . VAL A 1 110 ? 54.341 49.418 73.770 1.00 12.00 ? 110 VAL A CG2 1 +ATOM 849 N N . ALA A 1 111 ? 54.062 47.495 77.886 1.00 11.49 ? 111 ALA A N 1 +ATOM 850 C CA . ALA A 1 111 ? 54.098 46.496 78.941 1.00 11.31 ? 111 ALA A CA 1 +ATOM 851 C C . ALA A 1 111 ? 52.969 45.501 78.736 1.00 11.32 ? 111 ALA A C 1 +ATOM 852 O O . ALA A 1 111 ? 51.807 45.858 78.868 1.00 10.80 ? 111 ALA A O 1 +ATOM 853 C CB . ALA A 1 111 ? 54.016 47.135 80.290 1.00 10.80 ? 111 ALA A CB 1 +ATOM 854 N N . ALA A 1 112 ? 53.344 44.275 78.339 1.00 11.41 ? 112 ALA A N 1 +ATOM 855 C CA . ALA A 1 112 ? 52.422 43.169 78.159 1.00 11.21 ? 112 ALA A CA 1 +ATOM 856 C C . ALA A 1 112 ? 51.760 43.018 79.502 1.00 11.00 ? 112 ALA A C 1 +ATOM 857 O O . ALA A 1 112 ? 52.437 43.172 80.513 1.00 11.29 ? 112 ALA A O 1 +ATOM 858 C CB . ALA A 1 112 ? 53.184 41.897 77.802 1.00 11.22 ? 112 ALA A CB 1 +ATOM 859 N N . PRO A 1 113 ? 50.445 42.820 79.523 1.00 10.56 ? 113 PRO A N 1 +ATOM 860 C CA . PRO A 1 113 ? 49.740 42.497 80.769 1.00 10.75 ? 113 PRO A CA 1 +ATOM 861 C C . PRO A 1 113 ? 49.896 41.038 81.179 1.00 11.11 ? 113 PRO A C 1 +ATOM 862 O O . PRO A 1 113 ? 50.012 40.160 80.316 1.00 12.00 ? 113 PRO A O 1 +ATOM 863 C CB . PRO A 1 113 ? 48.272 42.760 80.428 1.00 10.69 ? 113 PRO A CB 1 +ATOM 864 C CG . PRO A 1 113 ? 48.185 42.551 78.925 1.00 10.39 ? 113 PRO A CG 1 +ATOM 865 C CD . PRO A 1 113 ? 49.534 42.959 78.373 1.00 10.22 ? 113 PRO A CD 1 +ATOM 866 N N . SER A 1 114 ? 49.915 40.799 82.484 1.00 11.12 ? 114 SER A N 1 +ATOM 867 C CA . SER A 1 114 ? 49.637 39.491 83.036 1.00 11.24 ? 114 SER A CA 1 +ATOM 868 C C . SER A 1 114 ? 48.130 39.284 83.123 1.00 11.49 ? 114 SER A C 1 +ATOM 869 O O . SER A 1 114 ? 47.401 40.123 83.660 1.00 10.97 ? 114 SER A O 1 +ATOM 870 C CB . SER A 1 114 ? 50.299 39.349 84.388 1.00 10.81 ? 114 SER A CB 1 +ATOM 871 O OG . SER A 1 114 ? 51.685 39.515 84.205 1.00 12.25 ? 114 SER A OG 1 +ATOM 872 N N . VAL A 1 115 ? 47.671 38.169 82.570 1.00 12.09 ? 115 VAL A N 1 +ATOM 873 C CA . VAL A 1 115 ? 46.244 37.888 82.483 1.00 12.82 ? 115 VAL A CA 1 +ATOM 874 C C . VAL A 1 115 ? 45.901 36.758 83.437 1.00 13.41 ? 115 VAL A C 1 +ATOM 875 O O . VAL A 1 115 ? 46.627 35.751 83.477 1.00 13.92 ? 115 VAL A O 1 +ATOM 876 C CB . VAL A 1 115 ? 45.839 37.477 81.065 1.00 12.61 ? 115 VAL A CB 1 +ATOM 877 C CG1 . VAL A 1 115 ? 44.322 37.297 80.961 1.00 12.60 ? 115 VAL A CG1 1 +ATOM 878 C CG2 . VAL A 1 115 ? 46.346 38.493 80.030 1.00 12.81 ? 115 VAL A CG2 1 +ATOM 879 N N . PHE A 1 116 ? 44.808 36.939 84.193 1.00 13.24 ? 116 PHE A N 1 +ATOM 880 C CA . PHE A 1 116 ? 44.323 35.976 85.176 1.00 13.41 ? 116 PHE A CA 1 +ATOM 881 C C . PHE A 1 116 ? 42.808 35.821 85.154 1.00 13.40 ? 116 PHE A C 1 +ATOM 882 O O . PHE A 1 116 ? 42.083 36.799 85.012 1.00 14.27 ? 116 PHE A O 1 +ATOM 883 C CB . PHE A 1 116 ? 44.672 36.419 86.573 1.00 13.16 ? 116 PHE A CB 1 +ATOM 884 C CG . PHE A 1 116 ? 46.069 36.855 86.732 1.00 15.87 ? 116 PHE A CG 1 +ATOM 885 C CD1 . PHE A 1 116 ? 47.107 35.940 86.676 1.00 18.83 ? 116 PHE A CD1 1 +ATOM 886 C CD2 . PHE A 1 116 ? 46.364 38.192 86.972 1.00 16.25 ? 116 PHE A CD2 1 +ATOM 887 C CE1 . PHE A 1 116 ? 48.421 36.359 86.861 1.00 19.77 ? 116 PHE A CE1 1 +ATOM 888 C CE2 . PHE A 1 116 ? 47.652 38.603 87.150 1.00 15.84 ? 116 PHE A CE2 1 +ATOM 889 C CZ . PHE A 1 116 ? 48.686 37.692 87.090 1.00 17.62 ? 116 PHE A CZ 1 +ATOM 890 N N . ILE A 1 117 ? 42.344 34.599 85.360 1.00 12.55 ? 117 ILE A N 1 +ATOM 891 C CA . ILE A 1 117 ? 40.935 34.304 85.332 1.00 12.66 ? 117 ILE A CA 1 +ATOM 892 C C . ILE A 1 117 ? 40.494 33.834 86.738 1.00 13.12 ? 117 ILE A C 1 +ATOM 893 O O . ILE A 1 117 ? 41.240 33.153 87.456 1.00 12.92 ? 117 ILE A O 1 +ATOM 894 C CB . ILE A 1 117 ? 40.649 33.306 84.162 1.00 12.61 ? 117 ILE A CB 1 +ATOM 895 C CG1 . ILE A 1 117 ? 39.386 33.660 83.355 1.00 12.44 ? 117 ILE A CG1 1 +ATOM 896 C CG2 . ILE A 1 117 ? 40.721 31.868 84.591 1.00 13.19 ? 117 ILE A CG2 1 +ATOM 897 C CD1 . ILE A 1 117 ? 38.145 33.880 84.140 1.00 10.91 ? 117 ILE A CD1 1 +ATOM 898 N N . PHE A 1 118 ? 39.308 34.281 87.153 1.00 13.61 ? 118 PHE A N 1 +ATOM 899 C CA . PHE A 1 118 ? 38.746 33.962 88.457 1.00 13.84 ? 118 PHE A CA 1 +ATOM 900 C C . PHE A 1 118 ? 37.313 33.473 88.294 1.00 13.99 ? 118 PHE A C 1 +ATOM 901 O O . PHE A 1 118 ? 36.439 34.241 87.904 1.00 13.97 ? 118 PHE A O 1 +ATOM 902 C CB . PHE A 1 118 ? 38.725 35.194 89.338 1.00 13.92 ? 118 PHE A CB 1 +ATOM 903 C CG . PHE A 1 118 ? 40.063 35.622 89.817 1.00 14.31 ? 118 PHE A CG 1 +ATOM 904 C CD1 . PHE A 1 118 ? 40.688 34.942 90.861 1.00 15.02 ? 118 PHE A CD1 1 +ATOM 905 C CD2 . PHE A 1 118 ? 40.684 36.739 89.264 1.00 11.74 ? 118 PHE A CD2 1 +ATOM 906 C CE1 . PHE A 1 118 ? 41.940 35.358 91.318 1.00 16.25 ? 118 PHE A CE1 1 +ATOM 907 C CE2 . PHE A 1 118 ? 41.922 37.157 89.713 1.00 13.01 ? 118 PHE A CE2 1 +ATOM 908 C CZ . PHE A 1 118 ? 42.561 36.471 90.745 1.00 14.22 ? 118 PHE A CZ 1 +ATOM 909 N N . PRO A 1 119 ? 37.053 32.209 88.594 1.00 14.14 ? 119 PRO A N 1 +ATOM 910 C CA . PRO A 1 119 ? 35.667 31.742 88.639 1.00 14.25 ? 119 PRO A CA 1 +ATOM 911 C C . PRO A 1 119 ? 34.932 32.413 89.803 1.00 14.20 ? 119 PRO A C 1 +ATOM 912 O O . PRO A 1 119 ? 35.577 32.922 90.734 1.00 13.74 ? 119 PRO A O 1 +ATOM 913 C CB . PRO A 1 119 ? 35.807 30.235 88.890 1.00 14.20 ? 119 PRO A CB 1 +ATOM 914 C CG . PRO A 1 119 ? 37.162 30.072 89.541 1.00 14.62 ? 119 PRO A CG 1 +ATOM 915 C CD . PRO A 1 119 ? 38.017 31.143 88.925 1.00 14.20 ? 119 PRO A CD 1 +ATOM 916 N N . PRO A 1 120 ? 33.607 32.443 89.731 1.00 14.44 ? 120 PRO A N 1 +ATOM 917 C CA . PRO A 1 120 ? 32.775 32.696 90.905 1.00 15.24 ? 120 PRO A CA 1 +ATOM 918 C C . PRO A 1 120 ? 33.186 31.839 92.097 1.00 16.15 ? 120 PRO A C 1 +ATOM 919 O O . PRO A 1 120 ? 33.548 30.661 91.924 1.00 16.11 ? 120 PRO A O 1 +ATOM 920 C CB . PRO A 1 120 ? 31.380 32.289 90.444 1.00 14.73 ? 120 PRO A CB 1 +ATOM 921 C CG . PRO A 1 120 ? 31.534 31.775 89.077 1.00 14.46 ? 120 PRO A CG 1 +ATOM 922 C CD . PRO A 1 120 ? 32.794 32.314 88.515 1.00 14.79 ? 120 PRO A CD 1 +ATOM 923 N N . SER A 1 121 ? 33.171 32.452 93.284 1.00 16.73 ? 121 SER A N 1 +ATOM 924 C CA . SER A 1 121 ? 33.322 31.722 94.531 1.00 17.31 ? 121 SER A CA 1 +ATOM 925 C C . SER A 1 121 ? 32.037 30.929 94.808 1.00 17.40 ? 121 SER A C 1 +ATOM 926 O O . SER A 1 121 ? 30.958 31.330 94.367 1.00 16.62 ? 121 SER A O 1 +ATOM 927 C CB . SER A 1 121 ? 33.544 32.709 95.651 1.00 17.53 ? 121 SER A CB 1 +ATOM 928 O OG . SER A 1 121 ? 32.401 33.530 95.791 1.00 19.57 ? 121 SER A OG 1 +ATOM 929 N N . ASP A 1 122 ? 32.156 29.808 95.528 1.00 17.57 ? 122 ASP A N 1 +ATOM 930 C CA . ASP A 1 122 ? 30.981 29.032 95.933 1.00 17.60 ? 122 ASP A CA 1 +ATOM 931 C C . ASP A 1 122 ? 29.959 29.861 96.720 1.00 17.25 ? 122 ASP A C 1 +ATOM 932 O O . ASP A 1 122 ? 28.750 29.628 96.624 1.00 16.89 ? 122 ASP A O 1 +ATOM 933 C CB . ASP A 1 122 ? 31.398 27.815 96.752 1.00 17.95 ? 122 ASP A CB 1 +ATOM 934 C CG . ASP A 1 122 ? 31.986 26.726 95.890 1.00 20.15 ? 122 ASP A CG 1 +ATOM 935 O OD1 . ASP A 1 122 ? 31.219 25.870 95.386 1.00 22.37 ? 122 ASP A OD1 1 +ATOM 936 O OD2 . ASP A 1 122 ? 33.209 26.659 95.634 1.00 22.76 ? 122 ASP A OD2 1 +ATOM 937 N N . GLU A 1 123 ? 30.444 30.839 97.484 1.00 17.22 ? 123 GLU A N 1 +ATOM 938 C CA . GLU A 1 123 ? 29.555 31.665 98.302 1.00 16.58 ? 123 GLU A CA 1 +ATOM 939 C C . GLU A 1 123 ? 28.582 32.520 97.487 1.00 16.01 ? 123 GLU A C 1 +ATOM 940 O O . GLU A 1 123 ? 27.387 32.571 97.795 1.00 15.14 ? 123 GLU A O 1 +ATOM 941 C CB . GLU A 1 123 ? 30.338 32.503 99.312 1.00 16.69 ? 123 GLU A CB 1 +ATOM 942 C CG . GLU A 1 123 ? 29.505 32.974 100.485 1.00 17.03 ? 123 GLU A CG 1 +ATOM 943 C CD . GLU A 1 123 ? 28.584 31.895 101.078 1.00 20.94 ? 123 GLU A CD 1 +ATOM 944 O OE1 . GLU A 1 123 ? 29.056 30.753 101.385 1.00 20.98 ? 123 GLU A OE1 1 +ATOM 945 O OE2 . GLU A 1 123 ? 27.370 32.203 101.270 1.00 21.29 ? 123 GLU A OE2 1 +ATOM 946 N N . GLN A 1 124 ? 29.093 33.178 96.450 1.00 15.99 ? 124 GLN A N 1 +ATOM 947 C CA . GLN A 1 124 ? 28.238 33.952 95.560 1.00 16.00 ? 124 GLN A CA 1 +ATOM 948 C C . GLN A 1 124 ? 27.276 33.023 94.852 1.00 16.04 ? 124 GLN A C 1 +ATOM 949 O O . GLN A 1 124 ? 26.091 33.320 94.759 1.00 16.25 ? 124 GLN A O 1 +ATOM 950 C CB . GLN A 1 124 ? 29.059 34.742 94.543 1.00 16.10 ? 124 GLN A CB 1 +ATOM 951 C CG . GLN A 1 124 ? 28.272 35.780 93.754 1.00 15.61 ? 124 GLN A CG 1 +ATOM 952 C CD . GLN A 1 124 ? 29.074 36.386 92.609 1.00 17.10 ? 124 GLN A CD 1 +ATOM 953 O OE1 . GLN A 1 124 ? 30.051 35.801 92.122 1.00 17.88 ? 124 GLN A OE1 1 +ATOM 954 N NE2 . GLN A 1 124 ? 28.663 37.565 92.179 1.00 18.46 ? 124 GLN A NE2 1 +ATOM 955 N N . LEU A 1 125 ? 27.785 31.885 94.384 1.00 16.40 ? 125 LEU A N 1 +ATOM 956 C CA . LEU A 1 125 ? 26.976 30.938 93.603 1.00 16.91 ? 125 LEU A CA 1 +ATOM 957 C C . LEU A 1 125 ? 25.653 30.646 94.271 1.00 17.25 ? 125 LEU A C 1 +ATOM 958 O O . LEU A 1 125 ? 24.627 30.872 93.659 1.00 17.40 ? 125 LEU A O 1 +ATOM 959 C CB . LEU A 1 125 ? 27.744 29.661 93.210 1.00 16.38 ? 125 LEU A CB 1 +ATOM 960 C CG . LEU A 1 125 ? 28.723 29.955 92.059 1.00 16.41 ? 125 LEU A CG 1 +ATOM 961 C CD1 . LEU A 1 125 ? 29.681 28.809 91.752 1.00 15.54 ? 125 LEU A CD1 1 +ATOM 962 C CD2 . LEU A 1 125 ? 27.998 30.437 90.780 1.00 15.46 ? 125 LEU A CD2 1 +ATOM 963 N N . LYS A 1 126 ? 25.683 30.224 95.536 1.00 18.16 ? 126 LYS A N 1 +ATOM 964 C CA . LYS A 1 126 ? 24.460 29.914 96.293 1.00 19.30 ? 126 LYS A CA 1 +ATOM 965 C C . LYS A 1 126 ? 23.517 31.093 96.612 1.00 19.85 ? 126 LYS A C 1 +ATOM 966 O O . LYS A 1 126 ? 22.477 30.897 97.238 1.00 20.22 ? 126 LYS A O 1 +ATOM 967 C CB . LYS A 1 126 ? 24.758 29.059 97.551 1.00 19.63 ? 126 LYS A CB 1 +ATOM 968 C CG . LYS A 1 126 ? 25.677 29.666 98.633 1.00 20.56 ? 126 LYS A CG 1 +ATOM 969 C CD . LYS A 1 126 ? 25.482 28.952 99.988 1.00 24.53 ? 126 LYS A CD 1 +ATOM 970 C CE . LYS A 1 126 ? 26.357 27.687 100.145 1.00 26.73 ? 126 LYS A CE 1 +ATOM 971 N NZ . LYS A 1 126 ? 27.743 27.990 100.630 1.00 29.23 ? 126 LYS A NZ 1 +ATOM 972 N N . SER A 1 127 ? 23.863 32.298 96.155 1.00 20.43 ? 127 SER A N 1 +ATOM 973 C CA . SER A 1 127 ? 22.989 33.473 96.274 1.00 21.06 ? 127 SER A CA 1 +ATOM 974 C C . SER A 1 127 ? 22.384 33.901 94.918 1.00 20.63 ? 127 SER A C 1 +ATOM 975 O O . SER A 1 127 ? 21.793 34.989 94.794 1.00 20.72 ? 127 SER A O 1 +ATOM 976 C CB . SER A 1 127 ? 23.774 34.648 96.890 1.00 21.93 ? 127 SER A CB 1 +ATOM 977 O OG . SER A 1 127 ? 23.024 35.275 97.919 1.00 24.23 ? 127 SER A OG 1 +ATOM 978 N N . GLY A 1 128 ? 22.572 33.075 93.889 1.00 19.92 ? 128 GLY A N 1 +ATOM 979 C CA . GLY A 1 128 ? 21.868 33.261 92.624 1.00 18.69 ? 128 GLY A CA 1 +ATOM 980 C C . GLY A 1 128 ? 22.590 34.001 91.516 1.00 17.44 ? 128 GLY A C 1 +ATOM 981 O O . GLY A 1 128 ? 22.096 34.089 90.393 1.00 17.22 ? 128 GLY A O 1 +ATOM 982 N N . THR A 1 129 ? 23.770 34.521 91.821 1.00 16.79 ? 129 THR A N 1 +ATOM 983 C CA . THR A 1 129 ? 24.505 35.351 90.872 1.00 15.61 ? 129 THR A CA 1 +ATOM 984 C C . THR A 1 129 ? 25.917 34.794 90.749 1.00 15.07 ? 129 THR A C 1 +ATOM 985 O O . THR A 1 129 ? 26.370 34.058 91.614 1.00 14.78 ? 129 THR A O 1 +ATOM 986 C CB . THR A 1 129 ? 24.451 36.860 91.314 1.00 15.80 ? 129 THR A CB 1 +ATOM 987 O OG1 . THR A 1 129 ? 23.196 37.447 90.905 1.00 14.87 ? 129 THR A OG1 1 +ATOM 988 C CG2 . THR A 1 129 ? 25.476 37.721 90.579 1.00 14.85 ? 129 THR A CG2 1 +ATOM 989 N N . ALA A 1 130 ? 26.583 35.095 89.645 1.00 14.30 ? 130 ALA A N 1 +ATOM 990 C CA . ALA A 1 130 ? 27.951 34.677 89.451 1.00 13.60 ? 130 ALA A CA 1 +ATOM 991 C C . ALA A 1 130 ? 28.713 35.781 88.758 1.00 13.69 ? 130 ALA A C 1 +ATOM 992 O O . ALA A 1 130 ? 28.292 36.266 87.692 1.00 13.89 ? 130 ALA A O 1 +ATOM 993 C CB . ALA A 1 130 ? 28.002 33.451 88.622 1.00 13.84 ? 130 ALA A CB 1 +ATOM 994 N N . SER A 1 131 ? 29.826 36.186 89.363 1.00 12.53 ? 131 SER A N 1 +ATOM 995 C CA . SER A 1 131 ? 30.747 37.075 88.697 1.00 11.61 ? 131 SER A CA 1 +ATOM 996 C C . SER A 1 131 ? 32.011 36.307 88.311 1.00 10.72 ? 131 SER A C 1 +ATOM 997 O O . SER A 1 131 ? 32.716 35.775 89.171 1.00 10.31 ? 131 SER A O 1 +ATOM 998 C CB . SER A 1 131 ? 31.063 38.270 89.590 1.00 11.94 ? 131 SER A CB 1 +ATOM 999 O OG . SER A 1 131 ? 29.857 38.815 90.098 1.00 12.02 ? 131 SER A OG 1 +ATOM 1000 N N . VAL A 1 132 ? 32.256 36.221 87.005 1.00 9.56 ? 132 VAL A N 1 +ATOM 1001 C CA . VAL A 1 132 ? 33.517 35.745 86.483 1.00 8.39 ? 132 VAL A CA 1 +ATOM 1002 C C . VAL A 1 132 ? 34.389 36.987 86.341 1.00 8.48 ? 132 VAL A C 1 +ATOM 1003 O O . VAL A 1 132 ? 33.950 38.028 85.856 1.00 8.55 ? 132 VAL A O 1 +ATOM 1004 C CB . VAL A 1 132 ? 33.367 35.031 85.130 1.00 8.51 ? 132 VAL A CB 1 +ATOM 1005 C CG1 . VAL A 1 132 ? 34.636 34.282 84.784 1.00 7.94 ? 132 VAL A CG1 1 +ATOM 1006 C CG2 . VAL A 1 132 ? 32.195 34.061 85.139 1.00 7.85 ? 132 VAL A CG2 1 +ATOM 1007 N N . VAL A 1 133 ? 35.620 36.886 86.806 1.00 7.88 ? 133 VAL A N 1 +ATOM 1008 C CA . VAL A 1 133 ? 36.482 38.033 86.865 1.00 7.48 ? 133 VAL A CA 1 +ATOM 1009 C C . VAL A 1 133 ? 37.770 37.729 86.137 1.00 8.26 ? 133 VAL A C 1 +ATOM 1010 O O . VAL A 1 133 ? 38.358 36.644 86.287 1.00 6.72 ? 133 VAL A O 1 +ATOM 1011 C CB . VAL A 1 133 ? 36.743 38.445 88.327 1.00 6.88 ? 133 VAL A CB 1 +ATOM 1012 C CG1 . VAL A 1 133 ? 37.854 39.498 88.413 1.00 6.60 ? 133 VAL A CG1 1 +ATOM 1013 C CG2 . VAL A 1 133 ? 35.482 38.964 88.935 1.00 5.81 ? 133 VAL A CG2 1 +ATOM 1014 N N . CYS A 1 134 ? 38.205 38.710 85.362 1.00 9.38 ? 134 CYS A N 1 +ATOM 1015 C CA . CYS A 1 134 ? 39.373 38.544 84.502 1.00 11.64 ? 134 CYS A CA 1 +ATOM 1016 C C . CYS A 1 134 ? 40.279 39.729 84.658 1.00 11.73 ? 134 CYS A C 1 +ATOM 1017 O O . CYS A 1 134 ? 39.874 40.860 84.417 1.00 12.79 ? 134 CYS A O 1 +ATOM 1018 C CB . CYS A 1 134 ? 38.946 38.404 83.046 1.00 11.95 ? 134 CYS A CB 1 +ATOM 1019 S SG . CYS A 1 134 ? 40.267 38.652 81.843 1.00 15.15 ? 134 CYS A SG 1 +ATOM 1020 N N . LEU A 1 135 ? 41.498 39.489 85.105 1.00 12.36 ? 135 LEU A N 1 +ATOM 1021 C CA . LEU A 1 135 ? 42.362 40.600 85.463 1.00 12.39 ? 135 LEU A CA 1 +ATOM 1022 C C . LEU A 1 135 ? 43.562 40.675 84.563 1.00 12.83 ? 135 LEU A C 1 +ATOM 1023 O O . LEU A 1 135 ? 44.162 39.646 84.215 1.00 12.83 ? 135 LEU A O 1 +ATOM 1024 C CB . LEU A 1 135 ? 42.806 40.502 86.908 1.00 12.81 ? 135 LEU A CB 1 +ATOM 1025 C CG . LEU A 1 135 ? 44.081 41.205 87.370 1.00 12.71 ? 135 LEU A CG 1 +ATOM 1026 C CD1 . LEU A 1 135 ? 43.754 42.654 87.779 1.00 10.35 ? 135 LEU A CD1 1 +ATOM 1027 C CD2 . LEU A 1 135 ? 44.630 40.422 88.550 1.00 12.99 ? 135 LEU A CD2 1 +ATOM 1028 N N . LEU A 1 136 ? 43.870 41.914 84.176 1.00 12.89 ? 136 LEU A N 1 +ATOM 1029 C CA . LEU A 1 136 ? 45.037 42.252 83.394 1.00 12.93 ? 136 LEU A CA 1 +ATOM 1030 C C . LEU A 1 136 ? 45.872 43.189 84.251 1.00 13.32 ? 136 LEU A C 1 +ATOM 1031 O O . LEU A 1 136 ? 45.474 44.304 84.529 1.00 13.40 ? 136 LEU A O 1 +ATOM 1032 C CB . LEU A 1 136 ? 44.636 42.958 82.104 1.00 12.86 ? 136 LEU A CB 1 +ATOM 1033 C CG . LEU A 1 136 ? 43.556 42.396 81.191 1.00 12.77 ? 136 LEU A CG 1 +ATOM 1034 C CD1 . LEU A 1 136 ? 42.183 42.425 81.882 1.00 10.94 ? 136 LEU A CD1 1 +ATOM 1035 C CD2 . LEU A 1 136 ? 43.553 43.276 79.995 1.00 11.84 ? 136 LEU A CD2 1 +ATOM 1036 N N . ASN A 1 137 ? 47.041 42.718 84.654 1.00 13.78 ? 137 ASN A N 1 +ATOM 1037 C CA . ASN A 1 137 ? 47.838 43.378 85.645 1.00 13.46 ? 137 ASN A CA 1 +ATOM 1038 C C . ASN A 1 137 ? 49.052 44.012 85.013 1.00 13.52 ? 137 ASN A C 1 +ATOM 1039 O O . ASN A 1 137 ? 49.782 43.348 84.263 1.00 12.96 ? 137 ASN A O 1 +ATOM 1040 C CB . ASN A 1 137 ? 48.267 42.343 86.674 1.00 13.99 ? 137 ASN A CB 1 +ATOM 1041 C CG . ASN A 1 137 ? 48.165 42.858 88.074 1.00 16.90 ? 137 ASN A CG 1 +ATOM 1042 O OD1 . ASN A 1 137 ? 49.072 42.660 88.896 1.00 20.89 ? 137 ASN A OD1 1 +ATOM 1043 N ND2 . ASN A 1 137 ? 47.076 43.564 88.360 1.00 16.51 ? 137 ASN A ND2 1 +ATOM 1044 N N . ASN A 1 138 ? 49.243 45.307 85.305 1.00 13.48 ? 138 ASN A N 1 +ATOM 1045 C CA . ASN A 1 138 ? 50.462 46.053 85.004 1.00 12.80 ? 138 ASN A CA 1 +ATOM 1046 C C . ASN A 1 138 ? 50.825 46.197 83.545 1.00 12.85 ? 138 ASN A C 1 +ATOM 1047 O O . ASN A 1 138 ? 51.909 45.801 83.113 1.00 13.03 ? 138 ASN A O 1 +ATOM 1048 C CB . ASN A 1 138 ? 51.642 45.485 85.779 1.00 12.83 ? 138 ASN A CB 1 +ATOM 1049 C CG . ASN A 1 138 ? 51.366 45.441 87.264 1.00 15.50 ? 138 ASN A CG 1 +ATOM 1050 O OD1 . ASN A 1 138 ? 51.262 46.468 87.907 1.00 17.09 ? 138 ASN A OD1 1 +ATOM 1051 N ND2 . ASN A 1 138 ? 51.215 44.240 87.806 1.00 19.14 ? 138 ASN A ND2 1 +ATOM 1052 N N . PHE A 1 139 ? 49.951 46.825 82.786 1.00 11.93 ? 139 PHE A N 1 +ATOM 1053 C CA . PHE A 1 139 ? 50.242 47.012 81.397 1.00 10.78 ? 139 PHE A CA 1 +ATOM 1054 C C . PHE A 1 139 ? 50.239 48.474 81.028 1.00 10.81 ? 139 PHE A C 1 +ATOM 1055 O O . PHE A 1 139 ? 49.630 49.295 81.733 1.00 10.87 ? 139 PHE A O 1 +ATOM 1056 C CB . PHE A 1 139 ? 49.210 46.266 80.567 1.00 11.21 ? 139 PHE A CB 1 +ATOM 1057 C CG . PHE A 1 139 ? 47.800 46.755 80.754 1.00 10.14 ? 139 PHE A CG 1 +ATOM 1058 C CD1 . PHE A 1 139 ? 47.224 47.618 79.824 1.00 11.61 ? 139 PHE A CD1 1 +ATOM 1059 C CD2 . PHE A 1 139 ? 47.043 46.324 81.813 1.00 8.32 ? 139 PHE A CD2 1 +ATOM 1060 C CE1 . PHE A 1 139 ? 45.916 48.062 79.974 1.00 12.07 ? 139 PHE A CE1 1 +ATOM 1061 C CE2 . PHE A 1 139 ? 45.743 46.773 81.981 1.00 11.09 ? 139 PHE A CE2 1 +ATOM 1062 C CZ . PHE A 1 139 ? 45.174 47.646 81.056 1.00 10.07 ? 139 PHE A CZ 1 +ATOM 1063 N N . TYR A 1 140 ? 50.914 48.767 79.910 1.00 10.45 ? 140 TYR A N 1 +ATOM 1064 C CA . TYR A 1 140 ? 50.886 50.039 79.197 1.00 9.79 ? 140 TYR A CA 1 +ATOM 1065 C C . TYR A 1 140 ? 50.987 49.805 77.687 1.00 10.39 ? 140 TYR A C 1 +ATOM 1066 O O . TYR A 1 140 ? 51.750 48.922 77.251 1.00 9.64 ? 140 TYR A O 1 +ATOM 1067 C CB . TYR A 1 140 ? 52.044 50.915 79.645 1.00 9.28 ? 140 TYR A CB 1 +ATOM 1068 C CG . TYR A 1 140 ? 51.875 52.366 79.225 1.00 8.76 ? 140 TYR A CG 1 +ATOM 1069 C CD1 . TYR A 1 140 ? 51.203 53.290 80.052 1.00 7.04 ? 140 TYR A CD1 1 +ATOM 1070 C CD2 . TYR A 1 140 ? 52.369 52.818 77.996 1.00 5.17 ? 140 TYR A CD2 1 +ATOM 1071 C CE1 . TYR A 1 140 ? 51.037 54.647 79.647 1.00 8.00 ? 140 TYR A CE1 1 +ATOM 1072 C CE2 . TYR A 1 140 ? 52.189 54.137 77.584 1.00 6.42 ? 140 TYR A CE2 1 +ATOM 1073 C CZ . TYR A 1 140 ? 51.531 55.044 78.406 1.00 7.89 ? 140 TYR A CZ 1 +ATOM 1074 O OH . TYR A 1 140 ? 51.390 56.348 77.980 1.00 10.88 ? 140 TYR A OH 1 +ATOM 1075 N N . PRO A 1 141 ? 50.278 50.594 76.866 1.00 11.46 ? 141 PRO A N 1 +ATOM 1076 C CA . PRO A 1 141 ? 49.343 51.651 77.286 1.00 12.42 ? 141 PRO A CA 1 +ATOM 1077 C C . PRO A 1 141 ? 47.976 51.160 77.711 1.00 13.96 ? 141 PRO A C 1 +ATOM 1078 O O . PRO A 1 141 ? 47.738 49.953 77.691 1.00 13.63 ? 141 PRO A O 1 +ATOM 1079 C CB . PRO A 1 141 ? 49.179 52.477 76.005 1.00 12.21 ? 141 PRO A CB 1 +ATOM 1080 C CG . PRO A 1 141 ? 49.331 51.499 74.944 1.00 10.81 ? 141 PRO A CG 1 +ATOM 1081 C CD . PRO A 1 141 ? 50.410 50.559 75.394 1.00 11.11 ? 141 PRO A CD 1 +ATOM 1082 N N . ARG A 1 142 ? 47.094 52.120 78.019 1.00 16.25 ? 142 ARG A N 1 +ATOM 1083 C CA . ARG A 1 142 ? 45.791 51.918 78.692 1.00 18.38 ? 142 ARG A CA 1 +ATOM 1084 C C . ARG A 1 142 ? 44.747 51.165 77.890 1.00 18.83 ? 142 ARG A C 1 +ATOM 1085 O O . ARG A 1 142 ? 43.793 50.641 78.471 1.00 19.18 ? 142 ARG A O 1 +ATOM 1086 C CB . ARG A 1 142 ? 45.200 53.276 79.098 1.00 18.66 ? 142 ARG A CB 1 +ATOM 1087 C CG . ARG A 1 142 ? 44.032 53.254 80.082 1.00 22.27 ? 142 ARG A CG 1 +ATOM 1088 C CD . ARG A 1 142 ? 42.966 54.352 79.806 1.00 28.87 ? 142 ARG A CD 1 +ATOM 1089 N NE . ARG A 1 142 ? 42.218 54.795 81.001 1.00 33.76 ? 142 ARG A NE 1 +ATOM 1090 C CZ . ARG A 1 142 ? 40.905 54.546 81.239 1.00 36.58 ? 142 ARG A CZ 1 +ATOM 1091 N NH1 . ARG A 1 142 ? 40.170 53.832 80.379 1.00 36.19 ? 142 ARG A NH1 1 +ATOM 1092 N NH2 . ARG A 1 142 ? 40.322 55.008 82.349 1.00 36.34 ? 142 ARG A NH2 1 +ATOM 1093 N N . GLU A 1 143 ? 44.922 51.123 76.575 1.00 19.52 ? 143 GLU A N 1 +ATOM 1094 C CA . GLU A 1 143 ? 43.867 50.681 75.681 1.00 20.94 ? 143 GLU A CA 1 +ATOM 1095 C C . GLU A 1 143 ? 44.039 49.196 75.414 1.00 21.44 ? 143 GLU A C 1 +ATOM 1096 O O . GLU A 1 143 ? 45.073 48.776 74.878 1.00 21.93 ? 143 GLU A O 1 +ATOM 1097 C CB . GLU A 1 143 ? 43.884 51.487 74.358 1.00 21.26 ? 143 GLU A CB 1 +ATOM 1098 C CG . GLU A 1 143 ? 42.576 52.211 74.013 1.00 22.67 ? 143 GLU A CG 1 +ATOM 1099 C CD . GLU A 1 143 ? 41.970 51.831 72.639 1.00 24.79 ? 143 GLU A CD 1 +ATOM 1100 O OE1 . GLU A 1 143 ? 41.143 50.876 72.605 1.00 24.63 ? 143 GLU A OE1 1 +ATOM 1101 O OE2 . GLU A 1 143 ? 42.285 52.497 71.594 1.00 22.37 ? 143 GLU A OE2 1 +ATOM 1102 N N . ALA A 1 144 ? 43.025 48.416 75.804 1.00 21.98 ? 144 ALA A N 1 +ATOM 1103 C CA . ALA A 1 144 ? 42.956 46.964 75.554 1.00 22.16 ? 144 ALA A CA 1 +ATOM 1104 C C . ALA A 1 144 ? 41.526 46.477 75.268 1.00 22.29 ? 144 ALA A C 1 +ATOM 1105 O O . ALA A 1 144 ? 40.547 47.078 75.724 1.00 22.72 ? 144 ALA A O 1 +ATOM 1106 C CB . ALA A 1 144 ? 43.517 46.197 76.726 1.00 21.96 ? 144 ALA A CB 1 +ATOM 1107 N N . LYS A 1 145 ? 41.421 45.370 74.538 1.00 22.10 ? 145 LYS A N 1 +ATOM 1108 C CA . LYS A 1 145 ? 40.133 44.769 74.203 1.00 22.00 ? 145 LYS A CA 1 +ATOM 1109 C C . LYS A 1 145 ? 39.966 43.477 75.000 1.00 22.03 ? 145 LYS A C 1 +ATOM 1110 O O . LYS A 1 145 ? 40.838 42.597 74.963 1.00 21.98 ? 145 LYS A O 1 +ATOM 1111 C CB . LYS A 1 145 ? 40.027 44.557 72.670 1.00 22.07 ? 145 LYS A CB 1 +ATOM 1112 C CG . LYS A 1 145 ? 39.250 43.327 72.175 1.00 21.08 ? 145 LYS A CG 1 +ATOM 1113 C CD . LYS A 1 145 ? 40.100 42.499 71.212 1.00 19.88 ? 145 LYS A CD 1 +ATOM 1114 C CE . LYS A 1 145 ? 39.664 42.677 69.756 1.00 18.73 ? 145 LYS A CE 1 +ATOM 1115 N NZ . LYS A 1 145 ? 40.808 42.457 68.841 1.00 17.84 ? 145 LYS A NZ 1 +ATOM 1116 N N . VAL A 1 146 ? 38.867 43.386 75.748 1.00 21.91 ? 146 VAL A N 1 +ATOM 1117 C CA . VAL A 1 146 ? 38.606 42.204 76.568 1.00 21.74 ? 146 VAL A CA 1 +ATOM 1118 C C . VAL A 1 146 ? 37.300 41.593 76.178 1.00 21.63 ? 146 VAL A C 1 +ATOM 1119 O O . VAL A 1 146 ? 36.250 42.181 76.433 1.00 21.97 ? 146 VAL A O 1 +ATOM 1120 C CB . VAL A 1 146 ? 38.489 42.507 78.058 1.00 21.56 ? 146 VAL A CB 1 +ATOM 1121 C CG1 . VAL A 1 146 ? 38.688 41.229 78.844 1.00 22.05 ? 146 VAL A CG1 1 +ATOM 1122 C CG2 . VAL A 1 146 ? 39.520 43.522 78.498 1.00 22.61 ? 146 VAL A CG2 1 +ATOM 1123 N N . GLN A 1 147 ? 37.372 40.411 75.566 1.00 21.32 ? 147 GLN A N 1 +ATOM 1124 C CA . GLN A 1 147 ? 36.184 39.649 75.199 1.00 20.56 ? 147 GLN A CA 1 +ATOM 1125 C C . GLN A 1 147 ? 36.159 38.285 75.900 1.00 20.19 ? 147 GLN A C 1 +ATOM 1126 O O . GLN A 1 147 ? 37.211 37.654 76.076 1.00 19.62 ? 147 GLN A O 1 +ATOM 1127 C CB . GLN A 1 147 ? 36.081 39.493 73.678 1.00 20.84 ? 147 GLN A CB 1 +ATOM 1128 C CG . GLN A 1 147 ? 37.383 39.691 72.898 1.00 21.23 ? 147 GLN A CG 1 +ATOM 1129 C CD . GLN A 1 147 ? 37.270 39.262 71.422 1.00 22.00 ? 147 GLN A CD 1 +ATOM 1130 O OE1 . GLN A 1 147 ? 36.169 39.226 70.861 1.00 21.75 ? 147 GLN A OE1 1 +ATOM 1131 N NE2 . GLN A 1 147 ? 38.412 38.957 70.794 1.00 21.39 ? 147 GLN A NE2 1 +ATOM 1132 N N . TRP A 1 148 ? 34.953 37.857 76.299 1.00 19.75 ? 148 TRP A N 1 +ATOM 1133 C CA . TRP A 1 148 ? 34.713 36.573 76.978 1.00 19.65 ? 148 TRP A CA 1 +ATOM 1134 C C . TRP A 1 148 ? 34.231 35.436 76.048 1.00 19.66 ? 148 TRP A C 1 +ATOM 1135 O O . TRP A 1 148 ? 33.407 35.670 75.159 1.00 19.72 ? 148 TRP A O 1 +ATOM 1136 C CB . TRP A 1 148 ? 33.651 36.764 78.048 1.00 19.60 ? 148 TRP A CB 1 +ATOM 1137 C CG . TRP A 1 148 ? 34.048 37.632 79.127 1.00 19.67 ? 148 TRP A CG 1 +ATOM 1138 C CD1 . TRP A 1 148 ? 33.870 38.974 79.197 1.00 19.57 ? 148 TRP A CD1 1 +ATOM 1139 C CD2 . TRP A 1 148 ? 34.708 37.247 80.334 1.00 20.67 ? 148 TRP A CD2 1 +ATOM 1140 N NE1 . TRP A 1 148 ? 34.374 39.458 80.381 1.00 19.58 ? 148 TRP A NE1 1 +ATOM 1141 C CE2 . TRP A 1 148 ? 34.897 38.415 81.098 1.00 20.00 ? 148 TRP A CE2 1 +ATOM 1142 C CE3 . TRP A 1 148 ? 35.155 36.024 80.856 1.00 21.15 ? 148 TRP A CE3 1 +ATOM 1143 C CZ2 . TRP A 1 148 ? 35.511 38.402 82.350 1.00 21.14 ? 148 TRP A CZ2 1 +ATOM 1144 C CZ3 . TRP A 1 148 ? 35.763 36.011 82.100 1.00 20.55 ? 148 TRP A CZ3 1 +ATOM 1145 C CH2 . TRP A 1 148 ? 35.930 37.192 82.835 1.00 21.63 ? 148 TRP A CH2 1 +ATOM 1146 N N . LYS A 1 149 ? 34.692 34.205 76.282 1.00 19.49 ? 149 LYS A N 1 +ATOM 1147 C CA . LYS A 1 149 ? 34.358 33.102 75.372 1.00 19.92 ? 149 LYS A CA 1 +ATOM 1148 C C . LYS A 1 149 ? 33.615 31.915 76.027 1.00 19.96 ? 149 LYS A C 1 +ATOM 1149 O O . LYS A 1 149 ? 34.052 30.754 75.928 1.00 20.00 ? 149 LYS A O 1 +ATOM 1150 C CB . LYS A 1 149 ? 35.608 32.637 74.603 1.00 19.84 ? 149 LYS A CB 1 +ATOM 1151 C CG . LYS A 1 149 ? 35.496 32.762 73.103 1.00 20.12 ? 149 LYS A CG 1 +ATOM 1152 C CD . LYS A 1 149 ? 36.418 33.835 72.546 1.00 20.97 ? 149 LYS A CD 1 +ATOM 1153 C CE . LYS A 1 149 ? 36.140 34.060 71.059 1.00 22.84 ? 149 LYS A CE 1 +ATOM 1154 N NZ . LYS A 1 149 ? 37.322 34.600 70.329 1.00 23.06 ? 149 LYS A NZ 1 +ATOM 1155 N N . VAL A 1 150 ? 32.477 32.213 76.656 1.00 19.68 ? 150 VAL A N 1 +ATOM 1156 C CA . VAL A 1 150 ? 31.659 31.212 77.351 1.00 19.29 ? 150 VAL A CA 1 +ATOM 1157 C C . VAL A 1 150 ? 31.337 29.999 76.472 1.00 19.23 ? 150 VAL A C 1 +ATOM 1158 O O . VAL A 1 150 ? 30.759 30.132 75.390 1.00 18.95 ? 150 VAL A O 1 +ATOM 1159 C CB . VAL A 1 150 ? 30.368 31.839 77.929 1.00 19.32 ? 150 VAL A CB 1 +ATOM 1160 C CG1 . VAL A 1 150 ? 29.719 30.904 78.936 1.00 19.45 ? 150 VAL A CG1 1 +ATOM 1161 C CG2 . VAL A 1 150 ? 30.677 33.154 78.600 1.00 19.07 ? 150 VAL A CG2 1 +ATOM 1162 N N . ASP A 1 151 ? 31.718 28.821 76.960 1.00 19.23 ? 151 ASP A N 1 +ATOM 1163 C CA . ASP A 1 151 ? 31.812 27.607 76.145 1.00 19.93 ? 151 ASP A CA 1 +ATOM 1164 C C . ASP A 1 151 ? 32.065 27.849 74.631 1.00 20.17 ? 151 ASP A C 1 +ATOM 1165 O O . ASP A 1 151 ? 31.561 27.100 73.779 1.00 20.38 ? 151 ASP A O 1 +ATOM 1166 C CB . ASP A 1 151 ? 30.651 26.617 76.424 1.00 19.84 ? 151 ASP A CB 1 +ATOM 1167 C CG . ASP A 1 151 ? 29.287 27.156 76.013 1.00 20.16 ? 151 ASP A CG 1 +ATOM 1168 O OD1 . ASP A 1 151 ? 28.294 26.391 76.100 1.00 22.29 ? 151 ASP A OD1 1 +ATOM 1169 O OD2 . ASP A 1 151 ? 29.090 28.320 75.599 1.00 20.65 ? 151 ASP A OD2 1 +ATOM 1170 N N . ASN A 1 152 ? 32.867 28.887 74.339 1.00 20.19 ? 152 ASN A N 1 +ATOM 1171 C CA . ASN A 1 152 ? 33.353 29.276 72.993 1.00 20.31 ? 152 ASN A CA 1 +ATOM 1172 C C . ASN A 1 152 ? 32.477 30.276 72.201 1.00 19.99 ? 152 ASN A C 1 +ATOM 1173 O O . ASN A 1 152 ? 32.662 30.449 70.992 1.00 19.87 ? 152 ASN A O 1 +ATOM 1174 C CB . ASN A 1 152 ? 33.777 28.061 72.120 1.00 20.63 ? 152 ASN A CB 1 +ATOM 1175 C CG . ASN A 1 152 ? 35.073 27.384 72.613 1.00 21.18 ? 152 ASN A CG 1 +ATOM 1176 O OD1 . ASN A 1 152 ? 35.058 26.215 73.000 1.00 21.97 ? 152 ASN A OD1 1 +ATOM 1177 N ND2 . ASN A 1 152 ? 36.189 28.115 72.589 1.00 20.15 ? 152 ASN A ND2 1 +ATOM 1178 N N . ALA A 1 153 ? 31.541 30.928 72.885 1.00 19.78 ? 153 ALA A N 1 +ATOM 1179 C CA . ALA A 1 153 ? 30.704 31.959 72.262 1.00 19.83 ? 153 ALA A CA 1 +ATOM 1180 C C . ALA A 1 153 ? 30.921 33.357 72.867 1.00 19.89 ? 153 ALA A C 1 +ATOM 1181 O O . ALA A 1 153 ? 31.058 33.509 74.092 1.00 19.83 ? 153 ALA A O 1 +ATOM 1182 C CB . ALA A 1 153 ? 29.225 31.565 72.316 1.00 19.72 ? 153 ALA A CB 1 +ATOM 1183 N N . LEU A 1 154 ? 30.948 34.367 71.993 1.00 19.73 ? 154 LEU A N 1 +ATOM 1184 C CA . LEU A 1 154 ? 31.138 35.772 72.375 1.00 19.44 ? 154 LEU A CA 1 +ATOM 1185 C C . LEU A 1 154 ? 30.075 36.263 73.365 1.00 19.21 ? 154 LEU A C 1 +ATOM 1186 O O . LEU A 1 154 ? 29.016 35.645 73.504 1.00 19.17 ? 154 LEU A O 1 +ATOM 1187 C CB . LEU A 1 154 ? 31.149 36.651 71.115 1.00 19.43 ? 154 LEU A CB 1 +ATOM 1188 C CG . LEU A 1 154 ? 31.162 38.186 71.208 1.00 20.04 ? 154 LEU A CG 1 +ATOM 1189 C CD1 . LEU A 1 154 ? 32.468 38.766 71.830 1.00 19.57 ? 154 LEU A CD1 1 +ATOM 1190 C CD2 . LEU A 1 154 ? 30.832 38.821 69.837 1.00 19.76 ? 154 LEU A CD2 1 +ATOM 1191 N N . GLN A 1 155 ? 30.360 37.362 74.064 1.00 18.90 ? 155 GLN A N 1 +ATOM 1192 C CA . GLN A 1 155 ? 29.367 37.973 74.951 1.00 18.73 ? 155 GLN A CA 1 +ATOM 1193 C C . GLN A 1 155 ? 29.157 39.491 74.713 1.00 18.64 ? 155 GLN A C 1 +ATOM 1194 O O . GLN A 1 155 ? 30.044 40.184 74.217 1.00 18.61 ? 155 GLN A O 1 +ATOM 1195 C CB . GLN A 1 155 ? 29.661 37.629 76.426 1.00 18.93 ? 155 GLN A CB 1 +ATOM 1196 C CG . GLN A 1 155 ? 29.969 36.128 76.726 1.00 18.51 ? 155 GLN A CG 1 +ATOM 1197 C CD . GLN A 1 155 ? 28.735 35.198 76.702 1.00 19.50 ? 155 GLN A CD 1 +ATOM 1198 O OE1 . GLN A 1 155 ? 27.791 35.380 77.481 1.00 20.16 ? 155 GLN A OE1 1 +ATOM 1199 N NE2 . GLN A 1 155 ? 28.764 34.187 75.828 1.00 17.27 ? 155 GLN A NE2 1 +ATOM 1200 N N . SER A 1 156 ? 27.957 39.976 75.034 1.00 18.70 ? 156 SER A N 1 +ATOM 1201 C CA . SER A 1 156 ? 27.552 41.374 74.820 1.00 18.98 ? 156 SER A CA 1 +ATOM 1202 C C . SER A 1 156 ? 26.564 41.830 75.896 1.00 19.24 ? 156 SER A C 1 +ATOM 1203 O O . SER A 1 156 ? 25.586 41.126 76.200 1.00 19.36 ? 156 SER A O 1 +ATOM 1204 C CB . SER A 1 156 ? 26.877 41.558 73.450 1.00 18.87 ? 156 SER A CB 1 +ATOM 1205 O OG . SER A 1 156 ? 27.654 41.023 72.401 1.00 18.13 ? 156 SER A OG 1 +ATOM 1206 N N . GLY A 1 157 ? 26.808 43.013 76.456 1.00 19.37 ? 157 GLY A N 1 +ATOM 1207 C CA . GLY A 1 157 ? 25.921 43.582 77.462 1.00 19.55 ? 157 GLY A CA 1 +ATOM 1208 C C . GLY A 1 157 ? 26.021 42.999 78.867 1.00 19.73 ? 157 GLY A C 1 +ATOM 1209 O O . GLY A 1 157 ? 25.362 43.492 79.786 1.00 20.11 ? 157 GLY A O 1 +ATOM 1210 N N . ASN A 1 158 ? 26.845 41.971 79.058 1.00 19.48 ? 158 ASN A N 1 +ATOM 1211 C CA . ASN A 1 158 ? 26.895 41.275 80.351 1.00 19.66 ? 158 ASN A CA 1 +ATOM 1212 C C . ASN A 1 158 ? 28.255 41.388 81.079 1.00 19.69 ? 158 ASN A C 1 +ATOM 1213 O O . ASN A 1 158 ? 28.566 40.610 81.982 1.00 19.59 ? 158 ASN A O 1 +ATOM 1214 C CB . ASN A 1 158 ? 26.484 39.806 80.162 1.00 19.09 ? 158 ASN A CB 1 +ATOM 1215 C CG . ASN A 1 158 ? 27.387 39.074 79.186 1.00 18.61 ? 158 ASN A CG 1 +ATOM 1216 O OD1 . ASN A 1 158 ? 28.264 39.680 78.547 1.00 18.00 ? 158 ASN A OD1 1 +ATOM 1217 N ND2 . ASN A 1 158 ? 27.193 37.766 79.071 1.00 17.67 ? 158 ASN A ND2 1 +ATOM 1218 N N . SER A 1 159 ? 29.034 42.392 80.685 1.00 20.05 ? 159 SER A N 1 +ATOM 1219 C CA . SER A 1 159 ? 30.451 42.487 81.003 1.00 19.66 ? 159 SER A CA 1 +ATOM 1220 C C . SER A 1 159 ? 30.802 43.930 81.308 1.00 19.64 ? 159 SER A C 1 +ATOM 1221 O O . SER A 1 159 ? 30.394 44.842 80.587 1.00 19.49 ? 159 SER A O 1 +ATOM 1222 C CB . SER A 1 159 ? 31.232 42.054 79.769 1.00 19.64 ? 159 SER A CB 1 +ATOM 1223 O OG . SER A 1 159 ? 32.413 41.401 80.137 1.00 20.15 ? 159 SER A OG 1 +ATOM 1224 N N . GLN A 1 160 ? 31.570 44.164 82.358 1.00 19.61 ? 160 GLN A N 1 +ATOM 1225 C CA . GLN A 1 160 ? 31.991 45.539 82.631 1.00 19.69 ? 160 GLN A CA 1 +ATOM 1226 C C . GLN A 1 160 ? 33.481 45.668 82.953 1.00 19.20 ? 160 GLN A C 1 +ATOM 1227 O O . GLN A 1 160 ? 34.063 44.826 83.644 1.00 19.50 ? 160 GLN A O 1 +ATOM 1228 C CB . GLN A 1 160 ? 31.104 46.182 83.712 1.00 19.68 ? 160 GLN A CB 1 +ATOM 1229 C CG . GLN A 1 160 ? 29.795 46.698 83.167 1.00 21.02 ? 160 GLN A CG 1 +ATOM 1230 C CD . GLN A 1 160 ? 28.869 47.245 84.228 1.00 23.82 ? 160 GLN A CD 1 +ATOM 1231 O OE1 . GLN A 1 160 ? 28.780 46.708 85.330 1.00 25.84 ? 160 GLN A OE1 1 +ATOM 1232 N NE2 . GLN A 1 160 ? 28.161 48.321 83.891 1.00 25.88 ? 160 GLN A NE2 1 +ATOM 1233 N N . GLU A 1 161 ? 34.093 46.729 82.450 1.00 18.47 ? 161 GLU A N 1 +ATOM 1234 C CA . GLU A 1 161 ? 35.516 46.931 82.662 1.00 18.09 ? 161 GLU A CA 1 +ATOM 1235 C C . GLU A 1 161 ? 35.719 47.995 83.691 1.00 17.40 ? 161 GLU A C 1 +ATOM 1236 O O . GLU A 1 161 ? 34.913 48.917 83.809 1.00 17.06 ? 161 GLU A O 1 +ATOM 1237 C CB . GLU A 1 161 ? 36.210 47.376 81.382 1.00 18.42 ? 161 GLU A CB 1 +ATOM 1238 C CG . GLU A 1 161 ? 36.490 46.276 80.384 1.00 20.09 ? 161 GLU A CG 1 +ATOM 1239 C CD . GLU A 1 161 ? 37.198 46.798 79.160 1.00 24.58 ? 161 GLU A CD 1 +ATOM 1240 O OE1 . GLU A 1 161 ? 37.646 47.983 79.173 1.00 26.98 ? 161 GLU A OE1 1 +ATOM 1241 O OE2 . GLU A 1 161 ? 37.302 46.028 78.174 1.00 27.07 ? 161 GLU A OE2 1 +ATOM 1242 N N . SER A 1 162 ? 36.820 47.855 84.420 1.00 16.99 ? 162 SER A N 1 +ATOM 1243 C CA . SER A 1 162 ? 37.274 48.837 85.403 1.00 16.38 ? 162 SER A CA 1 +ATOM 1244 C C . SER A 1 162 ? 38.770 48.951 85.301 1.00 15.00 ? 162 SER A C 1 +ATOM 1245 O O . SER A 1 162 ? 39.466 47.950 85.258 1.00 13.95 ? 162 SER A O 1 +ATOM 1246 C CB . SER A 1 162 ? 36.938 48.396 86.821 1.00 16.47 ? 162 SER A CB 1 +ATOM 1247 O OG . SER A 1 162 ? 37.467 49.358 87.712 1.00 17.98 ? 162 SER A OG 1 +ATOM 1248 N N . VAL A 1 163 ? 39.267 50.172 85.271 1.00 14.69 ? 163 VAL A N 1 +ATOM 1249 C CA . VAL A 1 163 ? 40.699 50.368 85.056 1.00 14.46 ? 163 VAL A CA 1 +ATOM 1250 C C . VAL A 1 163 ? 41.234 51.368 86.049 1.00 14.19 ? 163 VAL A C 1 +ATOM 1251 O O . VAL A 1 163 ? 40.737 52.450 86.135 1.00 13.89 ? 163 VAL A O 1 +ATOM 1252 C CB . VAL A 1 163 ? 41.000 50.704 83.567 1.00 13.55 ? 163 VAL A CB 1 +ATOM 1253 C CG1 . VAL A 1 163 ? 39.971 51.635 83.042 1.00 15.58 ? 163 VAL A CG1 1 +ATOM 1254 C CG2 . VAL A 1 163 ? 42.378 51.234 83.370 1.00 12.17 ? 163 VAL A CG2 1 +ATOM 1255 N N . THR A 1 164 ? 42.203 50.936 86.839 1.00 14.99 ? 164 THR A N 1 +ATOM 1256 C CA . THR A 1 164 ? 42.908 51.766 87.816 1.00 16.50 ? 164 THR A CA 1 +ATOM 1257 C C . THR A 1 164 ? 43.551 53.036 87.203 1.00 17.48 ? 164 THR A C 1 +ATOM 1258 O O . THR A 1 164 ? 43.714 53.160 85.966 1.00 17.67 ? 164 THR A O 1 +ATOM 1259 C CB . THR A 1 164 ? 44.048 50.964 88.427 1.00 15.70 ? 164 THR A CB 1 +ATOM 1260 O OG1 . THR A 1 164 ? 44.961 50.672 87.382 1.00 17.78 ? 164 THR A OG1 1 +ATOM 1261 C CG2 . THR A 1 164 ? 43.625 49.586 88.833 1.00 13.58 ? 164 THR A CG2 1 +ATOM 1262 N N . GLU A 1 165 ? 43.941 53.960 88.078 1.00 18.28 ? 165 GLU A N 1 +ATOM 1263 C CA . GLU A 1 165 ? 44.725 55.106 87.641 1.00 19.63 ? 165 GLU A CA 1 +ATOM 1264 C C . GLU A 1 165 ? 46.175 54.675 87.377 1.00 19.02 ? 165 GLU A C 1 +ATOM 1265 O O . GLU A 1 165 ? 46.655 53.740 87.958 1.00 19.78 ? 165 GLU A O 1 +ATOM 1266 C CB . GLU A 1 165 ? 44.634 56.250 88.658 1.00 19.80 ? 165 GLU A CB 1 +ATOM 1267 C CG . GLU A 1 165 ? 43.262 56.932 88.713 1.00 23.94 ? 165 GLU A CG 1 +ATOM 1268 C CD . GLU A 1 165 ? 42.922 57.790 87.494 1.00 30.55 ? 165 GLU A CD 1 +ATOM 1269 O OE1 . GLU A 1 165 ? 43.833 58.396 86.872 1.00 33.24 ? 165 GLU A OE1 1 +ATOM 1270 O OE2 . GLU A 1 165 ? 41.713 57.888 87.148 1.00 34.27 ? 165 GLU A OE2 1 +ATOM 1271 N N . GLN A 1 166 ? 46.858 55.348 86.478 1.00 19.16 ? 166 GLN A N 1 +ATOM 1272 C CA . GLN A 1 166 ? 48.275 55.106 86.246 1.00 19.48 ? 166 GLN A CA 1 +ATOM 1273 C C . GLN A 1 166 ? 49.036 54.950 87.558 1.00 19.44 ? 166 GLN A C 1 +ATOM 1274 O O . GLN A 1 166 ? 48.940 55.803 88.456 1.00 20.20 ? 166 GLN A O 1 +ATOM 1275 C CB . GLN A 1 166 ? 48.825 56.300 85.455 1.00 20.08 ? 166 GLN A CB 1 +ATOM 1276 C CG . GLN A 1 166 ? 50.264 56.242 84.944 1.00 19.50 ? 166 GLN A CG 1 +ATOM 1277 C CD . GLN A 1 166 ? 50.377 56.671 83.485 1.00 17.91 ? 166 GLN A CD 1 +ATOM 1278 O OE1 . GLN A 1 166 ? 49.428 57.184 82.912 1.00 21.51 ? 166 GLN A OE1 1 +ATOM 1279 N NE2 . GLN A 1 166 ? 51.531 56.455 82.889 1.00 17.13 ? 166 GLN A NE2 1 +ATOM 1280 N N . ASP A 1 167 ? 49.792 53.861 87.675 1.00 18.90 ? 167 ASP A N 1 +ATOM 1281 C CA . ASP A 1 167 ? 50.624 53.626 88.852 1.00 17.68 ? 167 ASP A CA 1 +ATOM 1282 C C . ASP A 1 167 ? 51.723 54.665 89.030 1.00 17.12 ? 167 ASP A C 1 +ATOM 1283 O O . ASP A 1 167 ? 52.456 55.008 88.099 1.00 17.53 ? 167 ASP A O 1 +ATOM 1284 C CB . ASP A 1 167 ? 51.269 52.264 88.789 1.00 17.61 ? 167 ASP A CB 1 +ATOM 1285 C CG . ASP A 1 167 ? 51.986 51.905 90.082 1.00 18.13 ? 167 ASP A CG 1 +ATOM 1286 O OD1 . ASP A 1 167 ? 53.211 52.078 90.156 1.00 17.95 ? 167 ASP A OD1 1 +ATOM 1287 O OD2 . ASP A 1 167 ? 51.405 51.433 91.079 1.00 20.39 ? 167 ASP A OD2 1 +ATOM 1288 N N . SER A 1 168 ? 51.864 55.119 90.260 1.00 16.43 ? 168 SER A N 1 +ATOM 1289 C CA . SER A 1 168 ? 52.728 56.246 90.574 1.00 15.62 ? 168 SER A CA 1 +ATOM 1290 C C . SER A 1 168 ? 54.189 55.863 90.540 1.00 14.82 ? 168 SER A C 1 +ATOM 1291 O O . SER A 1 168 ? 55.055 56.733 90.441 1.00 14.24 ? 168 SER A O 1 +ATOM 1292 C CB . SER A 1 168 ? 52.338 56.880 91.918 1.00 15.17 ? 168 SER A CB 1 +ATOM 1293 O OG . SER A 1 168 ? 53.180 56.404 92.949 1.00 16.78 ? 168 SER A OG 1 +ATOM 1294 N N . LYS A 1 169 ? 54.474 54.566 90.604 1.00 15.14 ? 169 LYS A N 1 +ATOM 1295 C CA . LYS A 1 169 ? 55.880 54.114 90.516 1.00 15.43 ? 169 LYS A CA 1 +ATOM 1296 C C . LYS A 1 169 ? 56.292 53.628 89.150 1.00 14.59 ? 169 LYS A C 1 +ATOM 1297 O O . LYS A 1 169 ? 57.275 54.121 88.606 1.00 15.69 ? 169 LYS A O 1 +ATOM 1298 C CB . LYS A 1 169 ? 56.210 53.092 91.577 1.00 15.83 ? 169 LYS A CB 1 +ATOM 1299 C CG . LYS A 1 169 ? 55.983 53.638 92.988 1.00 20.58 ? 169 LYS A CG 1 +ATOM 1300 C CD . LYS A 1 169 ? 57.226 53.579 93.900 1.00 26.26 ? 169 LYS A CD 1 +ATOM 1301 C CE . LYS A 1 169 ? 56.942 52.729 95.190 1.00 27.23 ? 169 LYS A CE 1 +ATOM 1302 N NZ . LYS A 1 169 ? 55.506 52.674 95.533 1.00 25.32 ? 169 LYS A NZ 1 +ATOM 1303 N N . ASP A 1 170 ? 55.517 52.717 88.573 1.00 13.58 ? 170 ASP A N 1 +ATOM 1304 C CA . ASP A 1 170 ? 55.860 52.092 87.293 1.00 12.54 ? 170 ASP A CA 1 +ATOM 1305 C C . ASP A 1 170 ? 54.949 52.518 86.130 1.00 10.78 ? 170 ASP A C 1 +ATOM 1306 O O . ASP A 1 170 ? 55.104 52.028 85.024 1.00 10.19 ? 170 ASP A O 1 +ATOM 1307 C CB . ASP A 1 170 ? 55.872 50.549 87.428 1.00 13.09 ? 170 ASP A CB 1 +ATOM 1308 C CG . ASP A 1 170 ? 54.462 49.939 87.487 1.00 15.53 ? 170 ASP A CG 1 +ATOM 1309 O OD1 . ASP A 1 170 ? 53.485 50.566 86.984 1.00 17.82 ? 170 ASP A OD1 1 +ATOM 1310 O OD2 . ASP A 1 170 ? 54.227 48.811 88.008 1.00 21.83 ? 170 ASP A OD2 1 +ATOM 1311 N N . SER A 1 171 ? 53.981 53.388 86.403 1.00 9.39 ? 171 SER A N 1 +ATOM 1312 C CA . SER A 1 171 ? 53.183 54.069 85.359 1.00 7.97 ? 171 SER A CA 1 +ATOM 1313 C C . SER A 1 171 ? 52.240 53.205 84.552 1.00 7.83 ? 171 SER A C 1 +ATOM 1314 O O . SER A 1 171 ? 51.710 53.665 83.539 1.00 6.04 ? 171 SER A O 1 +ATOM 1315 C CB . SER A 1 171 ? 54.064 54.828 84.402 1.00 6.99 ? 171 SER A CB 1 +ATOM 1316 O OG . SER A 1 171 ? 54.723 55.854 85.085 1.00 7.06 ? 171 SER A OG 1 +ATOM 1317 N N . THR A 1 172 ? 52.029 51.961 84.995 1.00 8.08 ? 172 THR A N 1 +ATOM 1318 C CA . THR A 1 172 ? 51.146 51.060 84.264 1.00 8.69 ? 172 THR A CA 1 +ATOM 1319 C C . THR A 1 172 ? 49.716 51.197 84.766 1.00 9.92 ? 172 THR A C 1 +ATOM 1320 O O . THR A 1 172 ? 49.459 51.864 85.768 1.00 9.12 ? 172 THR A O 1 +ATOM 1321 C CB . THR A 1 172 ? 51.624 49.576 84.378 1.00 8.60 ? 172 THR A CB 1 +ATOM 1322 O OG1 . THR A 1 172 ? 51.792 49.243 85.756 1.00 8.57 ? 172 THR A OG1 1 +ATOM 1323 C CG2 . THR A 1 172 ? 53.022 49.395 83.802 1.00 6.96 ? 172 THR A CG2 1 +ATOM 1324 N N . TYR A 1 173 ? 48.787 50.566 84.036 1.00 11.65 ? 173 TYR A N 1 +ATOM 1325 C CA . TYR A 1 173 ? 47.396 50.423 84.441 1.00 11.66 ? 173 TYR A CA 1 +ATOM 1326 C C . TYR A 1 173 ? 47.150 48.942 84.723 1.00 12.53 ? 173 TYR A C 1 +ATOM 1327 O O . TYR A 1 173 ? 47.922 48.046 84.322 1.00 11.38 ? 173 TYR A O 1 +ATOM 1328 C CB . TYR A 1 173 ? 46.451 50.905 83.325 1.00 11.98 ? 173 TYR A CB 1 +ATOM 1329 C CG . TYR A 1 173 ? 46.728 52.310 82.784 1.00 13.13 ? 173 TYR A CG 1 +ATOM 1330 C CD1 . TYR A 1 173 ? 46.117 53.429 83.353 1.00 15.83 ? 173 TYR A CD1 1 +ATOM 1331 C CD2 . TYR A 1 173 ? 47.568 52.515 81.697 1.00 12.21 ? 173 TYR A CD2 1 +ATOM 1332 C CE1 . TYR A 1 173 ? 46.349 54.705 82.859 1.00 15.76 ? 173 TYR A CE1 1 +ATOM 1333 C CE2 . TYR A 1 173 ? 47.798 53.780 81.201 1.00 12.60 ? 173 TYR A CE2 1 +ATOM 1334 C CZ . TYR A 1 173 ? 47.193 54.869 81.784 1.00 15.24 ? 173 TYR A CZ 1 +ATOM 1335 O OH . TYR A 1 173 ? 47.432 56.153 81.316 1.00 18.81 ? 173 TYR A OH 1 +ATOM 1336 N N . SER A 1 174 ? 46.063 48.698 85.440 1.00 13.70 ? 174 SER A N 1 +ATOM 1337 C CA . SER A 1 174 ? 45.590 47.364 85.666 1.00 14.53 ? 174 SER A CA 1 +ATOM 1338 C C . SER A 1 174 ? 44.123 47.424 85.371 1.00 14.88 ? 174 SER A C 1 +ATOM 1339 O O . SER A 1 174 ? 43.485 48.428 85.637 1.00 16.25 ? 174 SER A O 1 +ATOM 1340 C CB . SER A 1 174 ? 45.846 46.987 87.103 1.00 14.65 ? 174 SER A CB 1 +ATOM 1341 O OG . SER A 1 174 ? 47.072 46.287 87.194 1.00 15.29 ? 174 SER A OG 1 +ATOM 1342 N N . LEU A 1 175 ? 43.597 46.385 84.759 1.00 14.78 ? 175 LEU A N 1 +ATOM 1343 C CA . LEU A 1 175 ? 42.211 46.387 84.326 1.00 14.04 ? 175 LEU A CA 1 +ATOM 1344 C C . LEU A 1 175 ? 41.478 45.136 84.828 1.00 14.44 ? 175 LEU A C 1 +ATOM 1345 O O . LEU A 1 175 ? 42.027 44.035 84.890 1.00 13.63 ? 175 LEU A O 1 +ATOM 1346 C CB . LEU A 1 175 ? 42.130 46.497 82.813 1.00 13.41 ? 175 LEU A CB 1 +ATOM 1347 C CG . LEU A 1 175 ? 40.769 46.613 82.127 1.00 12.41 ? 175 LEU A CG 1 +ATOM 1348 C CD1 . LEU A 1 175 ? 40.861 47.547 80.951 1.00 9.98 ? 175 LEU A CD1 1 +ATOM 1349 C CD2 . LEU A 1 175 ? 40.365 45.247 81.651 1.00 12.93 ? 175 LEU A CD2 1 +ATOM 1350 N N . SER A 1 176 ? 40.215 45.325 85.164 1.00 15.09 ? 176 SER A N 1 +ATOM 1351 C CA . SER A 1 176 ? 39.403 44.246 85.641 1.00 15.74 ? 176 SER A CA 1 +ATOM 1352 C C . SER A 1 176 ? 38.145 44.116 84.780 1.00 16.55 ? 176 SER A C 1 +ATOM 1353 O O . SER A 1 176 ? 37.450 45.108 84.505 1.00 17.27 ? 176 SER A O 1 +ATOM 1354 C CB . SER A 1 176 ? 39.073 44.506 87.090 1.00 14.99 ? 176 SER A CB 1 +ATOM 1355 O OG . SER A 1 176 ? 37.761 44.135 87.326 1.00 16.01 ? 176 SER A OG 1 +ATOM 1356 N N . SER A 1 177 ? 37.873 42.891 84.334 1.00 16.42 ? 177 SER A N 1 +ATOM 1357 C CA . SER A 1 177 ? 36.716 42.620 83.488 1.00 15.93 ? 177 SER A CA 1 +ATOM 1358 C C . SER A 1 177 ? 35.788 41.637 84.186 1.00 16.34 ? 177 SER A C 1 +ATOM 1359 O O . SER A 1 177 ? 36.167 40.490 84.474 1.00 16.74 ? 177 SER A O 1 +ATOM 1360 C CB . SER A 1 177 ? 37.151 42.095 82.107 1.00 15.68 ? 177 SER A CB 1 +ATOM 1361 O OG . SER A 1 177 ? 36.069 42.098 81.201 1.00 12.44 ? 177 SER A OG 1 +ATOM 1362 N N . THR A 1 178 ? 34.567 42.085 84.459 1.00 16.19 ? 178 THR A N 1 +ATOM 1363 C CA . THR A 1 178 ? 33.622 41.236 85.168 1.00 15.71 ? 178 THR A CA 1 +ATOM 1364 C C . THR A 1 178 ? 32.368 40.781 84.377 1.00 14.91 ? 178 THR A C 1 +ATOM 1365 O O . THR A 1 178 ? 31.494 41.562 84.015 1.00 15.34 ? 178 THR A O 1 +ATOM 1366 C CB . THR A 1 178 ? 33.313 41.794 86.587 1.00 15.57 ? 178 THR A CB 1 +ATOM 1367 O OG1 . THR A 1 178 ? 32.485 40.846 87.264 1.00 17.49 ? 178 THR A OG1 1 +ATOM 1368 C CG2 . THR A 1 178 ? 32.443 43.065 86.559 1.00 15.84 ? 178 THR A CG2 1 +ATOM 1369 N N . LEU A 1 179 ? 32.311 39.485 84.112 1.00 14.38 ? 179 LEU A N 1 +ATOM 1370 C CA . LEU A 1 179 ? 31.173 38.869 83.453 1.00 13.74 ? 179 LEU A CA 1 +ATOM 1371 C C . LEU A 1 179 ? 30.125 38.500 84.490 1.00 13.81 ? 179 LEU A C 1 +ATOM 1372 O O . LEU A 1 179 ? 30.384 37.693 85.386 1.00 13.90 ? 179 LEU A O 1 +ATOM 1373 C CB . LEU A 1 179 ? 31.616 37.637 82.664 1.00 13.29 ? 179 LEU A CB 1 +ATOM 1374 C CG . LEU A 1 179 ? 30.561 36.915 81.815 1.00 12.51 ? 179 LEU A CG 1 +ATOM 1375 C CD1 . LEU A 1 179 ? 30.002 37.784 80.728 1.00 11.15 ? 179 LEU A CD1 1 +ATOM 1376 C CD2 . LEU A 1 179 ? 31.139 35.675 81.199 1.00 11.23 ? 179 LEU A CD2 1 +ATOM 1377 N N . THR A 1 180 ? 28.949 39.110 84.373 1.00 13.93 ? 180 THR A N 1 +ATOM 1378 C CA . THR A 1 180 ? 27.882 38.920 85.354 1.00 14.18 ? 180 THR A CA 1 +ATOM 1379 C C . THR A 1 180 ? 26.732 38.072 84.805 1.00 13.58 ? 180 THR A C 1 +ATOM 1380 O O . THR A 1 180 ? 26.050 38.420 83.829 1.00 13.27 ? 180 THR A O 1 +ATOM 1381 C CB . THR A 1 180 ? 27.392 40.275 85.948 1.00 14.60 ? 180 THR A CB 1 +ATOM 1382 O OG1 . THR A 1 180 ? 28.365 40.745 86.892 1.00 15.53 ? 180 THR A OG1 1 +ATOM 1383 C CG2 . THR A 1 180 ? 26.115 40.087 86.802 1.00 14.56 ? 180 THR A CG2 1 +ATOM 1384 N N . LEU A 1 181 ? 26.553 36.937 85.465 1.00 12.67 ? 181 LEU A N 1 +ATOM 1385 C CA . LEU A 1 181 ? 25.528 35.984 85.107 1.00 11.63 ? 181 LEU A CA 1 +ATOM 1386 C C . LEU A 1 181 ? 24.702 35.597 86.324 1.00 10.83 ? 181 LEU A C 1 +ATOM 1387 O O . LEU A 1 181 ? 25.147 35.719 87.472 1.00 10.41 ? 181 LEU A O 1 +ATOM 1388 C CB . LEU A 1 181 ? 26.165 34.750 84.474 1.00 11.46 ? 181 LEU A CB 1 +ATOM 1389 C CG . LEU A 1 181 ? 26.853 35.006 83.135 1.00 11.42 ? 181 LEU A CG 1 +ATOM 1390 C CD1 . LEU A 1 181 ? 27.493 33.734 82.620 1.00 10.66 ? 181 LEU A CD1 1 +ATOM 1391 C CD2 . LEU A 1 181 ? 25.863 35.585 82.122 1.00 12.41 ? 181 LEU A CD2 1 +ATOM 1392 N N . SER A 1 182 ? 23.480 35.162 86.049 1.00 10.19 ? 182 SER A N 1 +ATOM 1393 C CA . SER A 1 182 ? 22.665 34.471 87.034 1.00 9.56 ? 182 SER A CA 1 +ATOM 1394 C C . SER A 1 182 ? 23.255 33.084 87.212 1.00 8.97 ? 182 SER A C 1 +ATOM 1395 O O . SER A 1 182 ? 23.781 32.502 86.249 1.00 8.41 ? 182 SER A O 1 +ATOM 1396 C CB . SER A 1 182 ? 21.240 34.334 86.525 1.00 9.28 ? 182 SER A CB 1 +ATOM 1397 O OG . SER A 1 182 ? 21.185 33.310 85.550 1.00 8.97 ? 182 SER A OG 1 +ATOM 1398 N N . LYS A 1 183 ? 23.174 32.578 88.441 1.00 8.50 ? 183 LYS A N 1 +ATOM 1399 C CA . LYS A 1 183 ? 23.492 31.185 88.751 1.00 8.26 ? 183 LYS A CA 1 +ATOM 1400 C C . LYS A 1 183 ? 23.101 30.271 87.612 1.00 7.93 ? 183 LYS A C 1 +ATOM 1401 O O . LYS A 1 183 ? 23.922 29.499 87.150 1.00 8.07 ? 183 LYS A O 1 +ATOM 1402 C CB . LYS A 1 183 ? 22.766 30.739 90.022 1.00 8.36 ? 183 LYS A CB 1 +ATOM 1403 C CG . LYS A 1 183 ? 23.318 29.504 90.687 1.00 8.82 ? 183 LYS A CG 1 +ATOM 1404 C CD . LYS A 1 183 ? 22.643 29.280 92.018 1.00 11.87 ? 183 LYS A CD 1 +ATOM 1405 C CE . LYS A 1 183 ? 22.698 27.801 92.435 1.00 16.61 ? 183 LYS A CE 1 +ATOM 1406 N NZ . LYS A 1 183 ? 23.338 27.554 93.785 1.00 17.72 ? 183 LYS A NZ 1 +ATOM 1407 N N . ALA A 1 184 ? 21.860 30.390 87.142 1.00 8.06 ? 184 ALA A N 1 +ATOM 1408 C CA . ALA A 1 184 ? 21.302 29.476 86.138 1.00 8.09 ? 184 ALA A CA 1 +ATOM 1409 C C . ALA A 1 184 ? 21.906 29.611 84.720 1.00 8.12 ? 184 ALA A C 1 +ATOM 1410 O O . ALA A 1 184 ? 22.236 28.616 84.087 1.00 8.34 ? 184 ALA A O 1 +ATOM 1411 C CB . ALA A 1 184 ? 19.757 29.563 86.122 1.00 7.99 ? 184 ALA A CB 1 +ATOM 1412 N N . ASP A 1 185 ? 22.056 30.831 84.223 1.00 8.38 ? 185 ASP A N 1 +ATOM 1413 C CA . ASP A 1 185 ? 22.770 31.056 82.964 1.00 8.73 ? 185 ASP A CA 1 +ATOM 1414 C C . ASP A 1 185 ? 24.219 30.515 82.998 1.00 8.74 ? 185 ASP A C 1 +ATOM 1415 O O . ASP A 1 185 ? 24.703 29.936 82.015 1.00 8.28 ? 185 ASP A O 1 +ATOM 1416 C CB . ASP A 1 185 ? 22.747 32.551 82.597 1.00 8.97 ? 185 ASP A CB 1 +ATOM 1417 C CG . ASP A 1 185 ? 21.554 32.928 81.700 1.00 9.55 ? 185 ASP A CG 1 +ATOM 1418 O OD1 . ASP A 1 185 ? 20.626 32.106 81.497 1.00 9.73 ? 185 ASP A OD1 1 +ATOM 1419 O OD2 . ASP A 1 185 ? 21.465 34.041 81.144 1.00 10.37 ? 185 ASP A OD2 1 +ATOM 1420 N N . TYR A 1 186 ? 24.889 30.707 84.136 1.00 8.99 ? 186 TYR A N 1 +ATOM 1421 C CA . TYR A 1 186 ? 26.251 30.212 84.370 1.00 9.45 ? 186 TYR A CA 1 +ATOM 1422 C C . TYR A 1 186 ? 26.390 28.688 84.376 1.00 9.80 ? 186 TYR A C 1 +ATOM 1423 O O . TYR A 1 186 ? 27.304 28.153 83.738 1.00 9.76 ? 186 TYR A O 1 +ATOM 1424 C CB . TYR A 1 186 ? 26.776 30.759 85.693 1.00 9.82 ? 186 TYR A CB 1 +ATOM 1425 C CG . TYR A 1 186 ? 28.117 30.200 86.168 1.00 10.54 ? 186 TYR A CG 1 +ATOM 1426 C CD1 . TYR A 1 186 ? 29.306 30.568 85.546 1.00 9.58 ? 186 TYR A CD1 1 +ATOM 1427 C CD2 . TYR A 1 186 ? 28.188 29.331 87.260 1.00 10.08 ? 186 TYR A CD2 1 +ATOM 1428 C CE1 . TYR A 1 186 ? 30.521 30.079 85.974 1.00 10.21 ? 186 TYR A CE1 1 +ATOM 1429 C CE2 . TYR A 1 186 ? 29.404 28.841 87.702 1.00 10.11 ? 186 TYR A CE2 1 +ATOM 1430 C CZ . TYR A 1 186 ? 30.570 29.221 87.054 1.00 11.12 ? 186 TYR A CZ 1 +ATOM 1431 O OH . TYR A 1 186 ? 31.797 28.759 87.491 1.00 12.52 ? 186 TYR A OH 1 +ATOM 1432 N N . GLU A 1 187 ? 25.505 28.004 85.115 1.00 9.75 ? 187 GLU A N 1 +ATOM 1433 C CA . GLU A 1 187 ? 25.519 26.540 85.220 1.00 9.90 ? 187 GLU A CA 1 +ATOM 1434 C C . GLU A 1 187 ? 25.323 25.857 83.869 1.00 9.63 ? 187 GLU A C 1 +ATOM 1435 O O . GLU A 1 187 ? 25.626 24.675 83.732 1.00 9.56 ? 187 GLU A O 1 +ATOM 1436 C CB . GLU A 1 187 ? 24.447 26.019 86.195 1.00 10.21 ? 187 GLU A CB 1 +ATOM 1437 C CG . GLU A 1 187 ? 24.428 26.657 87.580 1.00 11.51 ? 187 GLU A CG 1 +ATOM 1438 C CD . GLU A 1 187 ? 25.071 25.797 88.658 1.00 13.25 ? 187 GLU A CD 1 +ATOM 1439 O OE1 . GLU A 1 187 ? 24.456 24.785 89.078 1.00 12.46 ? 187 GLU A OE1 1 +ATOM 1440 O OE2 . GLU A 1 187 ? 26.199 26.145 89.090 1.00 14.35 ? 187 GLU A OE2 1 +ATOM 1441 N N . LYS A 1 188 ? 24.814 26.602 82.887 1.00 9.41 ? 188 LYS A N 1 +ATOM 1442 C CA . LYS A 1 188 ? 24.509 26.063 81.566 1.00 9.51 ? 188 LYS A CA 1 +ATOM 1443 C C . LYS A 1 188 ? 25.757 25.611 80.844 1.00 9.64 ? 188 LYS A C 1 +ATOM 1444 O O . LYS A 1 188 ? 25.715 24.666 80.084 1.00 9.86 ? 188 LYS A O 1 +ATOM 1445 C CB . LYS A 1 188 ? 23.791 27.095 80.692 1.00 9.36 ? 188 LYS A CB 1 +ATOM 1446 C CG . LYS A 1 188 ? 22.295 27.216 80.915 1.00 9.35 ? 188 LYS A CG 1 +ATOM 1447 C CD . LYS A 1 188 ? 21.723 28.407 80.153 1.00 9.54 ? 188 LYS A CD 1 +ATOM 1448 C CE . LYS A 1 188 ? 20.278 28.148 79.747 1.00 10.74 ? 188 LYS A CE 1 +ATOM 1449 N NZ . LYS A 1 188 ? 19.403 29.329 79.980 1.00 11.17 ? 188 LYS A NZ 1 +ATOM 1450 N N . HIS A 1 189 ? 26.874 26.277 81.094 1.00 10.28 ? 189 HIS A N 1 +ATOM 1451 C CA . HIS A 1 189 ? 28.034 26.139 80.222 1.00 10.74 ? 189 HIS A CA 1 +ATOM 1452 C C . HIS A 1 189 ? 29.301 25.653 80.937 1.00 10.96 ? 189 HIS A C 1 +ATOM 1453 O O . HIS A 1 189 ? 29.499 25.933 82.121 1.00 11.23 ? 189 HIS A O 1 +ATOM 1454 C CB . HIS A 1 189 ? 28.275 27.458 79.477 1.00 10.77 ? 189 HIS A CB 1 +ATOM 1455 C CG . HIS A 1 189 ? 27.027 28.079 78.912 1.00 11.60 ? 189 HIS A CG 1 +ATOM 1456 N ND1 . HIS A 1 189 ? 26.150 27.391 78.097 1.00 11.61 ? 189 HIS A ND1 1 +ATOM 1457 C CD2 . HIS A 1 189 ? 26.514 29.326 79.045 1.00 12.26 ? 189 HIS A CD2 1 +ATOM 1458 C CE1 . HIS A 1 189 ? 25.154 28.186 77.752 1.00 11.89 ? 189 HIS A CE1 1 +ATOM 1459 N NE2 . HIS A 1 189 ? 25.353 29.367 78.310 1.00 12.81 ? 189 HIS A NE2 1 +ATOM 1460 N N . LYS A 1 190 ? 30.148 24.929 80.204 1.00 11.22 ? 190 LYS A N 1 +ATOM 1461 C CA . LYS A 1 190 ? 31.384 24.356 80.745 1.00 11.36 ? 190 LYS A CA 1 +ATOM 1462 C C . LYS A 1 190 ? 32.575 25.332 80.728 1.00 11.59 ? 190 LYS A C 1 +ATOM 1463 O O . LYS A 1 190 ? 33.024 25.791 81.783 1.00 11.52 ? 190 LYS A O 1 +ATOM 1464 C CB . LYS A 1 190 ? 31.739 23.042 80.008 1.00 11.44 ? 190 LYS A CB 1 +ATOM 1465 N N . VAL A 1 191 ? 33.074 25.662 79.537 1.00 11.57 ? 191 VAL A N 1 +ATOM 1466 C CA . VAL A 1 191 ? 34.366 26.353 79.431 1.00 11.99 ? 191 VAL A CA 1 +ATOM 1467 C C . VAL A 1 191 ? 34.275 27.900 79.519 1.00 11.64 ? 191 VAL A C 1 +ATOM 1468 O O . VAL A 1 191 ? 33.516 28.533 78.786 1.00 12.02 ? 191 VAL A O 1 +ATOM 1469 C CB . VAL A 1 191 ? 35.247 25.796 78.221 1.00 11.85 ? 191 VAL A CB 1 +ATOM 1470 C CG1 . VAL A 1 191 ? 34.547 24.628 77.514 1.00 12.03 ? 191 VAL A CG1 1 +ATOM 1471 C CG2 . VAL A 1 191 ? 35.665 26.886 77.227 1.00 11.59 ? 191 VAL A CG2 1 +ATOM 1472 N N . TYR A 1 192 ? 35.031 28.490 80.439 1.00 11.16 ? 192 TYR A N 1 +ATOM 1473 C CA . TYR A 1 192 ? 34.976 29.947 80.641 1.00 10.96 ? 192 TYR A CA 1 +ATOM 1474 C C . TYR A 1 192 ? 36.275 30.647 80.254 1.00 11.30 ? 192 TYR A C 1 +ATOM 1475 O O . TYR A 1 192 ? 37.324 30.403 80.846 1.00 10.52 ? 192 TYR A O 1 +ATOM 1476 C CB . TYR A 1 192 ? 34.541 30.303 82.065 1.00 10.39 ? 192 TYR A CB 1 +ATOM 1477 C CG . TYR A 1 192 ? 33.054 30.218 82.230 1.00 8.60 ? 192 TYR A CG 1 +ATOM 1478 C CD1 . TYR A 1 192 ? 32.428 28.972 82.330 1.00 8.64 ? 192 TYR A CD1 1 +ATOM 1479 C CD2 . TYR A 1 192 ? 32.264 31.360 82.234 1.00 5.96 ? 192 TYR A CD2 1 +ATOM 1480 C CE1 . TYR A 1 192 ? 31.052 28.850 82.447 1.00 7.44 ? 192 TYR A CE1 1 +ATOM 1481 C CE2 . TYR A 1 192 ? 30.876 31.261 82.373 1.00 7.09 ? 192 TYR A CE2 1 +ATOM 1482 C CZ . TYR A 1 192 ? 30.272 29.988 82.468 1.00 7.26 ? 192 TYR A CZ 1 +ATOM 1483 O OH . TYR A 1 192 ? 28.905 29.830 82.589 1.00 5.36 ? 192 TYR A OH 1 +ATOM 1484 N N . ALA A 1 193 ? 36.188 31.493 79.233 1.00 12.04 ? 193 ALA A N 1 +ATOM 1485 C CA . ALA A 1 193 ? 37.376 32.086 78.644 1.00 13.09 ? 193 ALA A CA 1 +ATOM 1486 C C . ALA A 1 193 ? 37.357 33.610 78.649 1.00 13.73 ? 193 ALA A C 1 +ATOM 1487 O O . ALA A 1 193 ? 36.310 34.250 78.521 1.00 13.51 ? 193 ALA A O 1 +ATOM 1488 C CB . ALA A 1 193 ? 37.599 31.559 77.251 1.00 12.77 ? 193 ALA A CB 1 +ATOM 1489 N N . CYS A 1 194 ? 38.540 34.178 78.817 1.00 14.77 ? 194 CYS A N 1 +ATOM 1490 C CA . CYS A 1 194 ? 38.706 35.622 78.808 1.00 16.14 ? 194 CYS A CA 1 +ATOM 1491 C C . CYS A 1 194 ? 39.825 35.880 77.818 1.00 16.43 ? 194 CYS A C 1 +ATOM 1492 O O . CYS A 1 194 ? 40.949 35.424 78.030 1.00 16.83 ? 194 CYS A O 1 +ATOM 1493 C CB . CYS A 1 194 ? 39.050 36.150 80.198 1.00 15.42 ? 194 CYS A CB 1 +ATOM 1494 S SG . CYS A 1 194 ? 39.654 37.848 80.116 1.00 19.92 ? 194 CYS A SG 1 +ATOM 1495 N N . GLU A 1 195 ? 39.509 36.554 76.712 1.00 17.07 ? 195 GLU A N 1 +ATOM 1496 C CA . GLU A 1 195 ? 40.511 36.815 75.672 1.00 17.57 ? 195 GLU A CA 1 +ATOM 1497 C C . GLU A 1 195 ? 40.908 38.277 75.676 1.00 17.85 ? 195 GLU A C 1 +ATOM 1498 O O . GLU A 1 195 ? 40.054 39.164 75.526 1.00 17.69 ? 195 GLU A O 1 +ATOM 1499 C CB . GLU A 1 195 ? 40.026 36.393 74.275 1.00 17.61 ? 195 GLU A CB 1 +ATOM 1500 C CG . GLU A 1 195 ? 41.061 35.644 73.441 1.00 17.71 ? 195 GLU A CG 1 +ATOM 1501 C CD . GLU A 1 195 ? 40.857 35.779 71.925 1.00 19.60 ? 195 GLU A CD 1 +ATOM 1502 O OE1 . GLU A 1 195 ? 41.487 35.001 71.170 1.00 18.80 ? 195 GLU A OE1 1 +ATOM 1503 O OE2 . GLU A 1 195 ? 40.088 36.664 71.468 1.00 20.00 ? 195 GLU A OE2 1 +ATOM 1504 N N . VAL A 1 196 ? 42.199 38.525 75.876 1.00 18.21 ? 196 VAL A N 1 +ATOM 1505 C CA . VAL A 1 196 ? 42.703 39.882 75.746 1.00 19.09 ? 196 VAL A CA 1 +ATOM 1506 C C . VAL A 1 196 ? 43.706 40.089 74.619 1.00 19.77 ? 196 VAL A C 1 +ATOM 1507 O O . VAL A 1 196 ? 44.661 39.312 74.435 1.00 19.39 ? 196 VAL A O 1 +ATOM 1508 C CB . VAL A 1 196 ? 43.291 40.458 77.037 1.00 19.30 ? 196 VAL A CB 1 +ATOM 1509 C CG1 . VAL A 1 196 ? 42.733 41.853 77.234 1.00 19.06 ? 196 VAL A CG1 1 +ATOM 1510 C CG2 . VAL A 1 196 ? 43.013 39.549 78.258 1.00 18.96 ? 196 VAL A CG2 1 +ATOM 1511 N N . THR A 1 197 ? 43.444 41.147 73.860 1.00 20.55 ? 197 THR A N 1 +ATOM 1512 C CA . THR A 1 197 ? 44.410 41.699 72.928 1.00 21.35 ? 197 THR A CA 1 +ATOM 1513 C C . THR A 1 197 ? 44.849 43.062 73.415 1.00 21.18 ? 197 THR A C 1 +ATOM 1514 O O . THR A 1 197 ? 44.034 43.881 73.842 1.00 21.32 ? 197 THR A O 1 +ATOM 1515 C CB . THR A 1 197 ? 43.823 41.801 71.540 1.00 21.47 ? 197 THR A CB 1 +ATOM 1516 O OG1 . THR A 1 197 ? 43.151 40.570 71.235 1.00 22.85 ? 197 THR A OG1 1 +ATOM 1517 C CG2 . THR A 1 197 ? 44.962 41.893 70.488 1.00 22.45 ? 197 THR A CG2 1 +ATOM 1518 N N . HIS A 1 198 ? 46.156 43.277 73.351 1.00 21.10 ? 198 HIS A N 1 +ATOM 1519 C CA . HIS A 1 198 ? 46.791 44.493 73.835 1.00 20.46 ? 198 HIS A CA 1 +ATOM 1520 C C . HIS A 1 198 ? 48.027 44.740 72.978 1.00 20.67 ? 198 HIS A C 1 +ATOM 1521 O O . HIS A 1 198 ? 48.697 43.794 72.560 1.00 20.39 ? 198 HIS A O 1 +ATOM 1522 C CB . HIS A 1 198 ? 47.183 44.342 75.311 1.00 19.73 ? 198 HIS A CB 1 +ATOM 1523 C CG . HIS A 1 198 ? 47.975 45.491 75.840 1.00 17.92 ? 198 HIS A CG 1 +ATOM 1524 N ND1 . HIS A 1 198 ? 49.350 45.493 75.867 1.00 17.35 ? 198 HIS A ND1 1 +ATOM 1525 C CD2 . HIS A 1 198 ? 47.590 46.688 76.335 1.00 17.06 ? 198 HIS A CD2 1 +ATOM 1526 C CE1 . HIS A 1 198 ? 49.782 46.636 76.364 1.00 16.19 ? 198 HIS A CE1 1 +ATOM 1527 N NE2 . HIS A 1 198 ? 48.732 47.379 76.659 1.00 16.71 ? 198 HIS A NE2 1 +ATOM 1528 N N . GLN A 1 199 ? 48.329 46.013 72.746 1.00 20.91 ? 199 GLN A N 1 +ATOM 1529 C CA . GLN A 1 199 ? 49.460 46.435 71.923 1.00 21.60 ? 199 GLN A CA 1 +ATOM 1530 C C . GLN A 1 199 ? 50.809 45.852 72.360 1.00 21.02 ? 199 GLN A C 1 +ATOM 1531 O O . GLN A 1 199 ? 51.799 45.998 71.649 1.00 20.28 ? 199 GLN A O 1 +ATOM 1532 C CB . GLN A 1 199 ? 49.517 47.964 71.913 1.00 22.40 ? 199 GLN A CB 1 +ATOM 1533 C CG . GLN A 1 199 ? 48.393 48.584 72.785 1.00 25.31 ? 199 GLN A CG 1 +ATOM 1534 C CD . GLN A 1 199 ? 47.885 49.934 72.267 1.00 28.97 ? 199 GLN A CD 1 +ATOM 1535 O OE1 . GLN A 1 199 ? 48.316 50.415 71.202 1.00 27.29 ? 199 GLN A OE1 1 +ATOM 1536 N NE2 . GLN A 1 199 ? 46.965 50.551 73.030 1.00 29.63 ? 199 GLN A NE2 1 +ATOM 1537 N N . GLY A 1 200 ? 50.835 45.194 73.524 1.00 20.80 ? 200 GLY A N 1 +ATOM 1538 C CA . GLY A 1 200 ? 52.045 44.585 74.074 1.00 20.66 ? 200 GLY A CA 1 +ATOM 1539 C C . GLY A 1 200 ? 52.223 43.067 73.986 1.00 20.60 ? 200 GLY A C 1 +ATOM 1540 O O . GLY A 1 200 ? 53.314 42.536 74.233 1.00 20.42 ? 200 GLY A O 1 +ATOM 1541 N N . LEU A 1 201 ? 51.160 42.351 73.650 1.00 20.62 ? 201 LEU A N 1 +ATOM 1542 C CA . LEU A 1 201 ? 51.266 40.902 73.526 1.00 20.50 ? 201 LEU A CA 1 +ATOM 1543 C C . LEU A 1 201 ? 51.469 40.543 72.077 1.00 20.97 ? 201 LEU A C 1 +ATOM 1544 O O . LEU A 1 201 ? 50.835 41.149 71.195 1.00 20.76 ? 201 LEU A O 1 +ATOM 1545 C CB . LEU A 1 201 ? 50.021 40.212 74.079 1.00 20.41 ? 201 LEU A CB 1 +ATOM 1546 C CG . LEU A 1 201 ? 49.789 40.362 75.593 1.00 18.86 ? 201 LEU A CG 1 +ATOM 1547 C CD1 . LEU A 1 201 ? 48.309 40.396 75.899 1.00 15.70 ? 201 LEU A CD1 1 +ATOM 1548 C CD2 . LEU A 1 201 ? 50.513 39.247 76.361 1.00 18.34 ? 201 LEU A CD2 1 +ATOM 1549 N N . SER A 1 202 ? 52.349 39.565 71.834 1.00 21.37 ? 202 SER A N 1 +ATOM 1550 C CA . SER A 1 202 ? 52.647 39.104 70.464 1.00 22.20 ? 202 SER A CA 1 +ATOM 1551 C C . SER A 1 202 ? 51.401 38.493 69.825 1.00 22.04 ? 202 SER A C 1 +ATOM 1552 O O . SER A 1 202 ? 50.928 38.953 68.775 1.00 22.32 ? 202 SER A O 1 +ATOM 1553 C CB . SER A 1 202 ? 53.841 38.127 70.432 1.00 22.18 ? 202 SER A CB 1 +ATOM 1554 O OG . SER A 1 202 ? 54.658 38.269 71.594 1.00 23.33 ? 202 SER A OG 1 +ATOM 1555 N N . SER A 1 203 ? 50.863 37.471 70.482 1.00 21.81 ? 203 SER A N 1 +ATOM 1556 C CA . SER A 1 203 ? 49.576 36.914 70.112 1.00 21.45 ? 203 SER A CA 1 +ATOM 1557 C C . SER A 1 203 ? 48.579 37.125 71.263 1.00 21.42 ? 203 SER A C 1 +ATOM 1558 O O . SER A 1 203 ? 48.914 36.858 72.425 1.00 20.91 ? 203 SER A O 1 +ATOM 1559 C CB . SER A 1 203 ? 49.721 35.434 69.776 1.00 21.23 ? 203 SER A CB 1 +ATOM 1560 O OG . SER A 1 203 ? 48.750 35.047 68.826 1.00 20.90 ? 203 SER A OG 1 +ATOM 1561 N N . PRO A 1 204 ? 47.382 37.644 70.947 1.00 21.35 ? 204 PRO A N 1 +ATOM 1562 C CA . PRO A 1 204 ? 46.264 37.673 71.899 1.00 21.07 ? 204 PRO A CA 1 +ATOM 1563 C C . PRO A 1 204 ? 46.262 36.481 72.867 1.00 20.94 ? 204 PRO A C 1 +ATOM 1564 O O . PRO A 1 204 ? 46.519 35.346 72.459 1.00 20.57 ? 204 PRO A O 1 +ATOM 1565 C CB . PRO A 1 204 ? 45.036 37.669 70.982 1.00 20.86 ? 204 PRO A CB 1 +ATOM 1566 C CG . PRO A 1 204 ? 45.486 38.448 69.764 1.00 21.09 ? 204 PRO A CG 1 +ATOM 1567 C CD . PRO A 1 204 ? 47.008 38.288 69.668 1.00 21.51 ? 204 PRO A CD 1 +ATOM 1568 N N . VAL A 1 205 ? 46.023 36.767 74.150 1.00 21.00 ? 205 VAL A N 1 +ATOM 1569 C CA . VAL A 1 205 ? 46.077 35.754 75.204 1.00 20.65 ? 205 VAL A CA 1 +ATOM 1570 C C . VAL A 1 205 ? 44.671 35.431 75.675 1.00 20.65 ? 205 VAL A C 1 +ATOM 1571 O O . VAL A 1 205 ? 43.908 36.339 76.060 1.00 20.40 ? 205 VAL A O 1 +ATOM 1572 C CB . VAL A 1 205 ? 46.970 36.193 76.406 1.00 20.42 ? 205 VAL A CB 1 +ATOM 1573 C CG1 . VAL A 1 205 ? 46.719 35.346 77.630 1.00 19.44 ? 205 VAL A CG1 1 +ATOM 1574 C CG2 . VAL A 1 205 ? 48.431 36.088 76.034 1.00 21.23 ? 205 VAL A CG2 1 +ATOM 1575 N N . THR A 1 206 ? 44.344 34.135 75.607 1.00 20.33 ? 206 THR A N 1 +ATOM 1576 C CA . THR A 1 206 ? 43.118 33.577 76.181 1.00 19.97 ? 206 THR A CA 1 +ATOM 1577 C C . THR A 1 206 ? 43.394 32.973 77.568 1.00 19.53 ? 206 THR A C 1 +ATOM 1578 O O . THR A 1 206 ? 44.330 32.189 77.738 1.00 19.58 ? 206 THR A O 1 +ATOM 1579 C CB . THR A 1 206 ? 42.466 32.543 75.206 1.00 20.11 ? 206 THR A CB 1 +ATOM 1580 O OG1 . THR A 1 206 ? 41.309 31.955 75.813 1.00 20.14 ? 206 THR A OG1 1 +ATOM 1581 C CG2 . THR A 1 206 ? 43.389 31.339 74.920 1.00 20.27 ? 206 THR A CG2 1 +ATOM 1582 N N . LYS A 1 207 ? 42.610 33.382 78.560 1.00 18.81 ? 207 LYS A N 1 +ATOM 1583 C CA . LYS A 1 207 ? 42.696 32.826 79.905 1.00 18.44 ? 207 LYS A CA 1 +ATOM 1584 C C . LYS A 1 207 ? 41.340 32.223 80.184 1.00 18.37 ? 207 LYS A C 1 +ATOM 1585 O O . LYS A 1 207 ? 40.323 32.805 79.810 1.00 18.45 ? 207 LYS A O 1 +ATOM 1586 C CB . LYS A 1 207 ? 43.014 33.914 80.920 1.00 18.37 ? 207 LYS A CB 1 +ATOM 1587 C CG . LYS A 1 207 ? 44.428 33.847 81.472 1.00 18.99 ? 207 LYS A CG 1 +ATOM 1588 C CD . LYS A 1 207 ? 44.648 32.609 82.338 1.00 20.44 ? 207 LYS A CD 1 +ATOM 1589 C CE . LYS A 1 207 ? 45.865 31.816 81.867 1.00 20.63 ? 207 LYS A CE 1 +ATOM 1590 N NZ . LYS A 1 207 ? 47.143 32.396 82.394 1.00 18.69 ? 207 LYS A NZ 1 +ATOM 1591 N N . SER A 1 208 ? 41.308 31.057 80.820 1.00 18.06 ? 208 SER A N 1 +ATOM 1592 C CA . SER A 1 208 ? 40.111 30.223 80.741 1.00 17.75 ? 208 SER A CA 1 +ATOM 1593 C C . SER A 1 208 ? 40.118 29.034 81.694 1.00 17.58 ? 208 SER A C 1 +ATOM 1594 O O . SER A 1 208 ? 41.128 28.348 81.836 1.00 17.34 ? 208 SER A O 1 +ATOM 1595 C CB . SER A 1 208 ? 39.902 29.761 79.285 1.00 17.62 ? 208 SER A CB 1 +ATOM 1596 O OG . SER A 1 208 ? 39.734 28.368 79.188 1.00 17.22 ? 208 SER A OG 1 +ATOM 1597 N N . PHE A 1 209 ? 38.978 28.793 82.332 1.00 17.48 ? 209 PHE A N 1 +ATOM 1598 C CA . PHE A 1 209 ? 38.849 27.692 83.277 1.00 17.67 ? 209 PHE A CA 1 +ATOM 1599 C C . PHE A 1 209 ? 37.627 26.809 82.983 1.00 17.73 ? 209 PHE A C 1 +ATOM 1600 O O . PHE A 1 209 ? 36.695 27.218 82.284 1.00 17.67 ? 209 PHE A O 1 +ATOM 1601 C CB . PHE A 1 209 ? 38.776 28.233 84.699 1.00 17.47 ? 209 PHE A CB 1 +ATOM 1602 C CG . PHE A 1 209 ? 37.468 28.905 85.020 1.00 18.48 ? 209 PHE A CG 1 +ATOM 1603 C CD1 . PHE A 1 209 ? 36.340 28.140 85.385 1.00 18.88 ? 209 PHE A CD1 1 +ATOM 1604 C CD2 . PHE A 1 209 ? 37.346 30.292 84.942 1.00 16.55 ? 209 PHE A CD2 1 +ATOM 1605 C CE1 . PHE A 1 209 ? 35.117 28.752 85.673 1.00 18.86 ? 209 PHE A CE1 1 +ATOM 1606 C CE2 . PHE A 1 209 ? 36.134 30.915 85.231 1.00 17.38 ? 209 PHE A CE2 1 +ATOM 1607 C CZ . PHE A 1 209 ? 35.014 30.151 85.598 1.00 18.68 ? 209 PHE A CZ 1 +ATOM 1608 N N . ASN A 1 210 ? 37.640 25.599 83.526 1.00 17.71 ? 210 ASN A N 1 +ATOM 1609 C CA . ASN A 1 210 ? 36.489 24.731 83.427 1.00 18.18 ? 210 ASN A CA 1 +ATOM 1610 C C . ASN A 1 210 ? 35.602 24.830 84.660 1.00 18.84 ? 210 ASN A C 1 +ATOM 1611 O O . ASN A 1 210 ? 36.069 24.733 85.794 1.00 19.02 ? 210 ASN A O 1 +ATOM 1612 C CB . ASN A 1 210 ? 36.923 23.288 83.168 1.00 18.03 ? 210 ASN A CB 1 +ATOM 1613 C CG . ASN A 1 210 ? 36.846 22.920 81.701 1.00 17.12 ? 210 ASN A CG 1 +ATOM 1614 O OD1 . ASN A 1 210 ? 37.243 23.699 80.829 1.00 14.76 ? 210 ASN A OD1 1 +ATOM 1615 N ND2 . ASN A 1 210 ? 36.316 21.736 81.417 1.00 16.93 ? 210 ASN A ND2 1 +ATOM 1616 N N . ARG A 1 211 ? 34.314 25.043 84.422 1.00 19.69 ? 211 ARG A N 1 +ATOM 1617 C CA . ARG A 1 211 ? 33.333 25.173 85.491 1.00 20.44 ? 211 ARG A CA 1 +ATOM 1618 C C . ARG A 1 211 ? 33.276 23.908 86.357 1.00 21.75 ? 211 ARG A C 1 +ATOM 1619 O O . ARG A 1 211 ? 33.043 22.800 85.857 1.00 20.72 ? 211 ARG A O 1 +ATOM 1620 C CB . ARG A 1 211 ? 31.955 25.495 84.897 1.00 20.15 ? 211 ARG A CB 1 +ATOM 1621 C CG . ARG A 1 211 ? 30.889 25.897 85.906 1.00 17.81 ? 211 ARG A CG 1 +ATOM 1622 C CD . ARG A 1 211 ? 29.483 25.751 85.365 1.00 14.22 ? 211 ARG A CD 1 +ATOM 1623 N NE . ARG A 1 211 ? 28.671 24.904 86.222 1.00 12.44 ? 211 ARG A NE 1 +ATOM 1624 C CZ . ARG A 1 211 ? 28.332 23.652 85.945 1.00 11.70 ? 211 ARG A CZ 1 +ATOM 1625 N NH1 . ARG A 1 211 ? 28.731 23.089 84.816 1.00 11.37 ? 211 ARG A NH1 1 +ATOM 1626 N NH2 . ARG A 1 211 ? 27.584 22.960 86.796 1.00 10.49 ? 211 ARG A NH2 1 +ATOM 1627 N N . GLY A 1 212 ? 33.512 24.090 87.657 1.00 23.40 ? 212 GLY A N 1 +ATOM 1628 C CA . GLY A 1 212 ? 33.398 23.001 88.614 1.00 25.32 ? 212 GLY A CA 1 +ATOM 1629 C C . GLY A 1 212 ? 34.564 22.019 88.668 1.00 26.57 ? 212 GLY A C 1 +ATOM 1630 O O . GLY A 1 212 ? 34.575 21.141 89.538 1.00 26.52 ? 212 GLY A O 1 +ATOM 1631 N N . GLU A 1 213 ? 35.537 22.152 87.759 1.00 27.84 ? 213 GLU A N 1 +ATOM 1632 C CA . GLU A 1 213 ? 36.763 21.344 87.834 1.00 29.06 ? 213 GLU A CA 1 +ATOM 1633 C C . GLU A 1 213 ? 37.851 21.973 88.718 1.00 30.01 ? 213 GLU A C 1 +ATOM 1634 O O . GLU A 1 213 ? 39.044 21.842 88.442 1.00 30.08 ? 213 GLU A O 1 +ATOM 1635 C CB . GLU A 1 213 ? 37.292 20.977 86.445 1.00 28.99 ? 213 GLU A CB 1 +ATOM 1636 C CG . GLU A 1 213 ? 37.086 19.505 86.095 1.00 28.96 ? 213 GLU A CG 1 +ATOM 1637 C CD . GLU A 1 213 ? 37.479 19.173 84.663 1.00 29.89 ? 213 GLU A CD 1 +ATOM 1638 O OE1 . GLU A 1 213 ? 37.932 20.096 83.944 1.00 31.28 ? 213 GLU A OE1 1 +ATOM 1639 O OE2 . GLU A 1 213 ? 37.347 17.994 84.252 1.00 28.33 ? 213 GLU A OE2 1 +ATOM 1640 N N . CYS A 1 214 ? 37.402 22.674 89.764 1.00 31.35 ? 214 CYS A N 1 +ATOM 1641 C CA . CYS A 1 214 ? 38.182 22.932 90.979 1.00 32.46 ? 214 CYS A CA 1 +ATOM 1642 C C . CYS A 1 214 ? 39.222 24.005 90.804 1.00 32.62 ? 214 CYS A C 1 +ATOM 1643 O O . CYS A 1 214 ? 38.928 25.160 91.106 1.00 33.14 ? 214 CYS A O 1 +ATOM 1644 C CB . CYS A 1 214 ? 38.852 21.639 91.475 1.00 32.84 ? 214 CYS A CB 1 +ATOM 1645 S SG . CYS A 1 214 ? 38.344 21.129 93.128 1.00 35.43 ? 214 CYS A SG 1 +ATOM 1646 N N . GLU B 2 1 ? 52.046 67.181 112.713 1.00 32.18 ? 1 GLU B N 1 +ATOM 1647 C CA . GLU B 2 1 ? 51.585 67.843 111.470 1.00 32.48 ? 1 GLU B CA 1 +ATOM 1648 C C . GLU B 2 1 ? 50.219 68.491 111.702 1.00 31.92 ? 1 GLU B C 1 +ATOM 1649 O O . GLU B 2 1 ? 49.427 68.004 112.515 1.00 32.22 ? 1 GLU B O 1 +ATOM 1650 C CB . GLU B 2 1 ? 51.503 66.821 110.321 1.00 33.04 ? 1 GLU B CB 1 +ATOM 1651 C CG . GLU B 2 1 ? 52.171 67.252 109.015 1.00 35.19 ? 1 GLU B CG 1 +ATOM 1652 C CD . GLU B 2 1 ? 51.569 66.576 107.788 1.00 39.72 ? 1 GLU B CD 1 +ATOM 1653 O OE1 . GLU B 2 1 ? 51.860 66.990 106.634 1.00 40.25 ? 1 GLU B OE1 1 +ATOM 1654 O OE2 . GLU B 2 1 ? 50.789 65.617 107.973 1.00 42.30 ? 1 GLU B OE2 1 +ATOM 1655 N N . VAL B 2 2 ? 49.959 69.600 111.010 1.00 30.85 ? 2 VAL B N 1 +ATOM 1656 C CA . VAL B 2 2 ? 48.607 70.138 110.904 1.00 30.21 ? 2 VAL B CA 1 +ATOM 1657 C C . VAL B 2 2 ? 47.736 69.058 110.257 1.00 29.76 ? 2 VAL B C 1 +ATOM 1658 O O . VAL B 2 2 ? 48.217 68.233 109.454 1.00 30.01 ? 2 VAL B O 1 +ATOM 1659 C CB . VAL B 2 2 ? 48.554 71.415 110.020 1.00 30.36 ? 2 VAL B CB 1 +ATOM 1660 C CG1 . VAL B 2 2 ? 47.118 71.797 109.710 1.00 30.19 ? 2 VAL B CG1 1 +ATOM 1661 C CG2 . VAL B 2 2 ? 49.298 72.571 110.669 1.00 30.21 ? 2 VAL B CG2 1 +ATOM 1662 N N . GLN B 2 3 ? 46.451 69.082 110.582 1.00 28.62 ? 3 GLN B N 1 +ATOM 1663 C CA . GLN B 2 3 ? 45.550 68.011 110.192 1.00 27.16 ? 3 GLN B CA 1 +ATOM 1664 C C . GLN B 2 3 ? 44.151 68.587 110.141 1.00 25.79 ? 3 GLN B C 1 +ATOM 1665 O O . GLN B 2 3 ? 43.750 69.337 111.028 1.00 24.79 ? 3 GLN B O 1 +ATOM 1666 C CB . GLN B 2 3 ? 45.618 66.905 111.247 1.00 27.74 ? 3 GLN B CB 1 +ATOM 1667 C CG . GLN B 2 3 ? 44.803 65.662 110.955 1.00 29.34 ? 3 GLN B CG 1 +ATOM 1668 C CD . GLN B 2 3 ? 45.631 64.578 110.294 1.00 31.63 ? 3 GLN B CD 1 +ATOM 1669 O OE1 . GLN B 2 3 ? 45.232 64.043 109.264 1.00 32.01 ? 3 GLN B OE1 1 +ATOM 1670 N NE2 . GLN B 2 3 ? 46.791 64.258 110.878 1.00 30.72 ? 3 GLN B NE2 1 +ATOM 1671 N N . LEU B 2 4 ? 43.412 68.244 109.096 1.00 24.41 ? 4 LEU B N 1 +ATOM 1672 C CA . LEU B 2 4 ? 42.028 68.645 108.991 1.00 23.26 ? 4 LEU B CA 1 +ATOM 1673 C C . LEU B 2 4 ? 41.183 67.436 108.635 1.00 23.19 ? 4 LEU B C 1 +ATOM 1674 O O . LEU B 2 4 ? 41.374 66.832 107.583 1.00 23.32 ? 4 LEU B O 1 +ATOM 1675 C CB . LEU B 2 4 ? 41.870 69.708 107.924 1.00 22.89 ? 4 LEU B CB 1 +ATOM 1676 C CG . LEU B 2 4 ? 42.553 71.062 108.094 1.00 22.07 ? 4 LEU B CG 1 +ATOM 1677 C CD1 . LEU B 2 4 ? 42.893 71.575 106.695 1.00 23.31 ? 4 LEU B CD1 1 +ATOM 1678 C CD2 . LEU B 2 4 ? 41.678 72.045 108.816 1.00 19.85 ? 4 LEU B CD2 1 +ATOM 1679 N N . VAL B 2 5 ? 40.251 67.080 109.516 1.00 22.80 ? 5 VAL B N 1 +ATOM 1680 C CA . VAL B 2 5 ? 39.414 65.909 109.287 1.00 22.27 ? 5 VAL B CA 1 +ATOM 1681 C C . VAL B 2 5 ? 37.946 66.261 109.056 1.00 21.60 ? 5 VAL B C 1 +ATOM 1682 O O . VAL B 2 5 ? 37.258 66.794 109.930 1.00 20.95 ? 5 VAL B O 1 +ATOM 1683 C CB . VAL B 2 5 ? 39.530 64.829 110.400 1.00 22.45 ? 5 VAL B CB 1 +ATOM 1684 C CG1 . VAL B 2 5 ? 39.392 63.445 109.799 1.00 22.87 ? 5 VAL B CG1 1 +ATOM 1685 C CG2 . VAL B 2 5 ? 40.846 64.937 111.175 1.00 22.92 ? 5 VAL B CG2 1 +ATOM 1686 N N . GLU B 2 6 ? 37.504 65.958 107.838 1.00 21.17 ? 6 GLU B N 1 +ATOM 1687 C CA . GLU B 2 6 ? 36.111 66.035 107.442 1.00 20.70 ? 6 GLU B CA 1 +ATOM 1688 C C . GLU B 2 6 ? 35.317 64.872 108.032 1.00 20.16 ? 6 GLU B C 1 +ATOM 1689 O O . GLU B 2 6 ? 35.854 63.767 108.189 1.00 19.81 ? 6 GLU B O 1 +ATOM 1690 C CB . GLU B 2 6 ? 36.026 65.958 105.924 1.00 21.01 ? 6 GLU B CB 1 +ATOM 1691 C CG . GLU B 2 6 ? 36.612 67.145 105.166 1.00 22.63 ? 6 GLU B CG 1 +ATOM 1692 C CD . GLU B 2 6 ? 38.039 66.893 104.724 1.00 25.73 ? 6 GLU B CD 1 +ATOM 1693 O OE1 . GLU B 2 6 ? 38.538 67.691 103.906 1.00 22.91 ? 6 GLU B OE1 1 +ATOM 1694 O OE2 . GLU B 2 6 ? 38.670 65.892 105.200 1.00 27.25 ? 6 GLU B OE2 1 +ATOM 1695 N N . SER B 2 7 ? 34.051 65.131 108.361 1.00 19.46 ? 7 SER B N 1 +ATOM 1696 C CA . SER B 2 7 ? 33.074 64.075 108.678 1.00 19.36 ? 7 SER B CA 1 +ATOM 1697 C C . SER B 2 7 ? 31.629 64.488 108.363 1.00 18.64 ? 7 SER B C 1 +ATOM 1698 O O . SER B 2 7 ? 31.339 65.659 108.133 1.00 18.84 ? 7 SER B O 1 +ATOM 1699 C CB . SER B 2 7 ? 33.203 63.574 110.131 1.00 19.39 ? 7 SER B CB 1 +ATOM 1700 O OG . SER B 2 7 ? 33.732 64.571 110.986 1.00 20.60 ? 7 SER B OG 1 +ATOM 1701 N N . GLY B 2 8 ? 30.731 63.516 108.332 1.00 18.00 ? 8 GLY B N 1 +ATOM 1702 C CA . GLY B 2 8 ? 29.336 63.778 108.065 1.00 17.99 ? 8 GLY B CA 1 +ATOM 1703 C C . GLY B 2 8 ? 28.919 63.418 106.652 1.00 18.34 ? 8 GLY B C 1 +ATOM 1704 O O . GLY B 2 8 ? 27.756 63.585 106.288 1.00 18.95 ? 8 GLY B O 1 +ATOM 1705 N N . GLY B 2 9 ? 29.851 62.915 105.848 1.00 18.10 ? 9 GLY B N 1 +ATOM 1706 C CA . GLY B 2 9 ? 29.531 62.511 104.492 1.00 17.45 ? 9 GLY B CA 1 +ATOM 1707 C C . GLY B 2 9 ? 28.528 61.380 104.455 1.00 17.13 ? 9 GLY B C 1 +ATOM 1708 O O . GLY B 2 9 ? 28.313 60.705 105.453 1.00 17.74 ? 9 GLY B O 1 +ATOM 1709 N N . GLY B 2 10 ? 27.909 61.161 103.303 1.00 16.81 ? 10 GLY B N 1 +ATOM 1710 C CA . GLY B 2 10 ? 27.028 60.021 103.124 1.00 15.80 ? 10 GLY B CA 1 +ATOM 1711 C C . GLY B 2 10 ? 25.861 60.367 102.239 1.00 15.05 ? 10 GLY B C 1 +ATOM 1712 O O . GLY B 2 10 ? 25.842 61.444 101.674 1.00 15.57 ? 10 GLY B O 1 +ATOM 1713 N N . LEU B 2 11 ? 24.899 59.455 102.134 1.00 14.22 ? 11 LEU B N 1 +ATOM 1714 C CA . LEU B 2 11 ? 23.716 59.633 101.318 1.00 13.40 ? 11 LEU B CA 1 +ATOM 1715 C C . LEU B 2 11 ? 22.804 60.753 101.845 1.00 13.79 ? 11 LEU B C 1 +ATOM 1716 O O . LEU B 2 11 ? 22.467 60.789 103.034 1.00 14.37 ? 11 LEU B O 1 +ATOM 1717 C CB . LEU B 2 11 ? 22.936 58.320 101.303 1.00 12.73 ? 11 LEU B CB 1 +ATOM 1718 C CG . LEU B 2 11 ? 21.967 57.924 100.187 1.00 10.89 ? 11 LEU B CG 1 +ATOM 1719 C CD1 . LEU B 2 11 ? 22.675 57.689 98.869 1.00 8.45 ? 11 LEU B CD1 1 +ATOM 1720 C CD2 . LEU B 2 11 ? 21.219 56.673 100.600 1.00 8.53 ? 11 LEU B CD2 1 +ATOM 1721 N N . VAL B 2 12 ? 22.392 61.657 100.960 1.00 13.34 ? 12 VAL B N 1 +ATOM 1722 C CA . VAL B 2 12 ? 21.289 62.561 101.260 1.00 12.94 ? 12 VAL B CA 1 +ATOM 1723 C C . VAL B 2 12 ? 20.176 62.351 100.256 1.00 12.61 ? 12 VAL B C 1 +ATOM 1724 O O . VAL B 2 12 ? 20.408 62.124 99.082 1.00 12.72 ? 12 VAL B O 1 +ATOM 1725 C CB . VAL B 2 12 ? 21.698 64.032 101.186 1.00 12.98 ? 12 VAL B CB 1 +ATOM 1726 C CG1 . VAL B 2 12 ? 20.558 64.920 101.651 1.00 14.32 ? 12 VAL B CG1 1 +ATOM 1727 C CG2 . VAL B 2 12 ? 22.933 64.306 102.022 1.00 13.81 ? 12 VAL B CG2 1 +ATOM 1728 N N . GLN B 2 13 ? 18.954 62.449 100.732 1.00 12.95 ? 13 GLN B N 1 +ATOM 1729 C CA . GLN B 2 13 ? 17.797 62.519 99.866 1.00 13.50 ? 13 GLN B CA 1 +ATOM 1730 C C . GLN B 2 13 ? 17.780 63.887 99.179 1.00 13.26 ? 13 GLN B C 1 +ATOM 1731 O O . GLN B 2 13 ? 18.166 64.891 99.783 1.00 12.69 ? 13 GLN B O 1 +ATOM 1732 C CB . GLN B 2 13 ? 16.546 62.296 100.709 1.00 13.60 ? 13 GLN B CB 1 +ATOM 1733 C CG . GLN B 2 13 ? 15.241 62.581 100.011 1.00 16.24 ? 13 GLN B CG 1 +ATOM 1734 C CD . GLN B 2 13 ? 14.172 61.605 100.424 1.00 19.23 ? 13 GLN B CD 1 +ATOM 1735 O OE1 . GLN B 2 13 ? 14.427 60.393 100.454 1.00 19.33 ? 13 GLN B OE1 1 +ATOM 1736 N NE2 . GLN B 2 13 ? 12.975 62.118 100.764 1.00 19.16 ? 13 GLN B NE2 1 +ATOM 1737 N N . PRO B 2 14 ? 17.374 63.938 97.911 1.00 13.44 ? 14 PRO B N 1 +ATOM 1738 C CA . PRO B 2 14 ? 17.234 65.228 97.225 1.00 13.45 ? 14 PRO B CA 1 +ATOM 1739 C C . PRO B 2 14 ? 16.255 66.124 97.987 1.00 12.95 ? 14 PRO B C 1 +ATOM 1740 O O . PRO B 2 14 ? 15.202 65.666 98.424 1.00 12.99 ? 14 PRO B O 1 +ATOM 1741 C CB . PRO B 2 14 ? 16.679 64.832 95.850 1.00 13.75 ? 14 PRO B CB 1 +ATOM 1742 C CG . PRO B 2 14 ? 17.145 63.397 95.652 1.00 13.80 ? 14 PRO B CG 1 +ATOM 1743 C CD . PRO B 2 14 ? 17.023 62.804 97.031 1.00 13.48 ? 14 PRO B CD 1 +ATOM 1744 N N . GLY B 2 15 ? 16.620 67.377 98.183 1.00 12.59 ? 15 GLY B N 1 +ATOM 1745 C CA . GLY B 2 15 ? 15.803 68.279 98.975 1.00 12.92 ? 15 GLY B CA 1 +ATOM 1746 C C . GLY B 2 15 ? 16.288 68.334 100.409 1.00 13.25 ? 15 GLY B C 1 +ATOM 1747 O O . GLY B 2 15 ? 15.935 69.237 101.165 1.00 12.17 ? 15 GLY B O 1 +ATOM 1748 N N . GLY B 2 16 ? 17.134 67.373 100.767 1.00 13.90 ? 16 GLY B N 1 +ATOM 1749 C CA . GLY B 2 16 ? 17.479 67.141 102.158 1.00 15.12 ? 16 GLY B CA 1 +ATOM 1750 C C . GLY B 2 16 ? 18.593 68.021 102.667 1.00 15.83 ? 16 GLY B C 1 +ATOM 1751 O O . GLY B 2 16 ? 19.212 68.757 101.897 1.00 16.05 ? 16 GLY B O 1 +ATOM 1752 N N . SER B 2 17 ? 18.842 67.940 103.970 1.00 16.46 ? 17 SER B N 1 +ATOM 1753 C CA . SER B 2 17 ? 19.921 68.675 104.599 1.00 17.32 ? 17 SER B CA 1 +ATOM 1754 C C . SER B 2 17 ? 21.014 67.714 104.997 1.00 17.55 ? 17 SER B C 1 +ATOM 1755 O O . SER B 2 17 ? 20.840 66.500 104.916 1.00 17.70 ? 17 SER B O 1 +ATOM 1756 C CB . SER B 2 17 ? 19.416 69.417 105.819 1.00 17.52 ? 17 SER B CB 1 +ATOM 1757 O OG . SER B 2 17 ? 18.471 70.404 105.417 1.00 21.40 ? 17 SER B OG 1 +ATOM 1758 N N . LEU B 2 18 ? 22.156 68.268 105.393 1.00 17.74 ? 18 LEU B N 1 +ATOM 1759 C CA . LEU B 2 18 ? 23.291 67.493 105.861 1.00 17.62 ? 18 LEU B CA 1 +ATOM 1760 C C . LEU B 2 18 ? 24.272 68.468 106.468 1.00 17.64 ? 18 LEU B C 1 +ATOM 1761 O O . LEU B 2 18 ? 24.392 69.615 106.023 1.00 17.17 ? 18 LEU B O 1 +ATOM 1762 C CB . LEU B 2 18 ? 23.961 66.743 104.713 1.00 17.98 ? 18 LEU B CB 1 +ATOM 1763 C CG . LEU B 2 18 ? 25.112 65.791 105.090 1.00 19.03 ? 18 LEU B CG 1 +ATOM 1764 C CD1 . LEU B 2 18 ? 24.643 64.673 106.078 1.00 18.91 ? 18 LEU B CD1 1 +ATOM 1765 C CD2 . LEU B 2 18 ? 25.708 65.207 103.860 1.00 17.21 ? 18 LEU B CD2 1 +ATOM 1766 N N . ARG B 2 19 ? 24.959 68.020 107.509 1.00 17.51 ? 19 ARG B N 1 +ATOM 1767 C CA . ARG B 2 19 ? 25.958 68.865 108.114 1.00 17.31 ? 19 ARG B CA 1 +ATOM 1768 C C . ARG B 2 19 ? 27.298 68.198 108.085 1.00 16.58 ? 19 ARG B C 1 +ATOM 1769 O O . ARG B 2 19 ? 27.506 67.176 108.729 1.00 16.78 ? 19 ARG B O 1 +ATOM 1770 C CB . ARG B 2 19 ? 25.583 69.260 109.537 1.00 17.44 ? 19 ARG B CB 1 +ATOM 1771 C CG . ARG B 2 19 ? 26.619 70.171 110.145 1.00 18.83 ? 19 ARG B CG 1 +ATOM 1772 C CD . ARG B 2 19 ? 26.633 70.150 111.639 1.00 22.67 ? 19 ARG B CD 1 +ATOM 1773 N NE . ARG B 2 19 ? 26.399 71.502 112.126 1.00 26.25 ? 19 ARG B NE 1 +ATOM 1774 C CZ . ARG B 2 19 ? 26.602 71.904 113.371 1.00 26.34 ? 19 ARG B CZ 1 +ATOM 1775 N NH1 . ARG B 2 19 ? 27.051 71.048 114.282 1.00 26.10 ? 19 ARG B NH1 1 +ATOM 1776 N NH2 . ARG B 2 19 ? 26.359 73.170 113.695 1.00 26.09 ? 19 ARG B NH2 1 +ATOM 1777 N N . LEU B 2 20 ? 28.190 68.804 107.314 1.00 16.15 ? 20 LEU B N 1 +ATOM 1778 C CA . LEU B 2 20 ? 29.584 68.426 107.247 1.00 15.52 ? 20 LEU B CA 1 +ATOM 1779 C C . LEU B 2 20 ? 30.348 69.095 108.359 1.00 15.22 ? 20 LEU B C 1 +ATOM 1780 O O . LEU B 2 20 ? 30.009 70.184 108.824 1.00 14.58 ? 20 LEU B O 1 +ATOM 1781 C CB . LEU B 2 20 ? 30.195 68.807 105.893 1.00 15.52 ? 20 LEU B CB 1 +ATOM 1782 C CG . LEU B 2 20 ? 29.567 68.075 104.706 1.00 15.79 ? 20 LEU B CG 1 +ATOM 1783 C CD1 . LEU B 2 20 ? 30.335 68.385 103.455 1.00 15.22 ? 20 LEU B CD1 1 +ATOM 1784 C CD2 . LEU B 2 20 ? 29.482 66.558 104.938 1.00 17.09 ? 20 LEU B CD2 1 +ATOM 1785 N N . SER B 2 21 ? 31.397 68.428 108.791 1.00 15.36 ? 21 SER B N 1 +ATOM 1786 C CA . SER B 2 21 ? 32.156 68.937 109.901 1.00 16.27 ? 21 SER B CA 1 +ATOM 1787 C C . SER B 2 21 ? 33.631 68.852 109.552 1.00 16.10 ? 21 SER B C 1 +ATOM 1788 O O . SER B 2 21 ? 34.030 67.933 108.843 1.00 17.07 ? 21 SER B O 1 +ATOM 1789 C CB . SER B 2 21 ? 31.776 68.144 111.154 1.00 16.02 ? 21 SER B CB 1 +ATOM 1790 O OG . SER B 2 21 ? 32.567 68.548 112.240 1.00 18.88 ? 21 SER B OG 1 +ATOM 1791 N N . CYS B 2 22 ? 34.427 69.823 109.997 1.00 16.32 ? 22 CYS B N 1 +ATOM 1792 C CA . CYS B 2 22 ? 35.882 69.822 109.786 1.00 16.78 ? 22 CYS B CA 1 +ATOM 1793 C C . CYS B 2 22 ? 36.576 70.131 111.086 1.00 16.53 ? 22 CYS B C 1 +ATOM 1794 O O . CYS B 2 22 ? 36.613 71.310 111.486 1.00 16.37 ? 22 CYS B O 1 +ATOM 1795 C CB . CYS B 2 22 ? 36.269 70.922 108.816 1.00 17.62 ? 22 CYS B CB 1 +ATOM 1796 S SG . CYS B 2 22 ? 38.042 70.984 108.419 1.00 22.12 ? 22 CYS B SG 1 +ATOM 1797 N N . ALA B 2 23 ? 37.094 69.096 111.758 1.00 15.72 ? 23 ALA B N 1 +ATOM 1798 C CA . ALA B 2 23 ? 37.848 69.250 113.000 1.00 14.70 ? 23 ALA B CA 1 +ATOM 1799 C C . ALA B 2 23 ? 39.307 69.545 112.671 1.00 14.88 ? 23 ALA B C 1 +ATOM 1800 O O . ALA B 2 23 ? 39.991 68.749 112.018 1.00 15.80 ? 23 ALA B O 1 +ATOM 1801 C CB . ALA B 2 23 ? 37.740 67.994 113.843 1.00 14.86 ? 23 ALA B CB 1 +ATOM 1802 N N . ALA B 2 24 ? 39.787 70.704 113.095 1.00 14.43 ? 24 ALA B N 1 +ATOM 1803 C CA . ALA B 2 24 ? 41.183 71.048 112.888 1.00 13.76 ? 24 ALA B CA 1 +ATOM 1804 C C . ALA B 2 24 ? 41.981 70.652 114.109 1.00 13.58 ? 24 ALA B C 1 +ATOM 1805 O O . ALA B 2 24 ? 41.503 70.730 115.266 1.00 13.15 ? 24 ALA B O 1 +ATOM 1806 C CB . ALA B 2 24 ? 41.346 72.519 112.598 1.00 13.82 ? 24 ALA B CB 1 +ATOM 1807 N N . SER B 2 25 ? 43.211 70.249 113.826 1.00 13.26 ? 25 SER B N 1 +ATOM 1808 C CA . SER B 2 25 ? 44.088 69.637 114.787 1.00 13.90 ? 25 SER B CA 1 +ATOM 1809 C C . SER B 2 25 ? 45.493 70.126 114.467 1.00 14.07 ? 25 SER B C 1 +ATOM 1810 O O . SER B 2 25 ? 45.951 70.007 113.349 1.00 14.37 ? 25 SER B O 1 +ATOM 1811 C CB . SER B 2 25 ? 43.933 68.111 114.682 1.00 13.95 ? 25 SER B CB 1 +ATOM 1812 O OG . SER B 2 25 ? 45.033 67.388 115.200 1.00 15.75 ? 25 SER B OG 1 +ATOM 1813 N N . GLY B 2 26 ? 46.169 70.719 115.443 1.00 15.25 ? 26 GLY B N 1 +ATOM 1814 C CA . GLY B 2 26 ? 47.506 71.251 115.202 1.00 15.33 ? 26 GLY B CA 1 +ATOM 1815 C C . GLY B 2 26 ? 47.635 72.744 114.892 1.00 15.54 ? 26 GLY B C 1 +ATOM 1816 O O . GLY B 2 26 ? 48.762 73.211 114.678 1.00 15.68 ? 26 GLY B O 1 +ATOM 1817 N N . PHE B 2 27 ? 46.516 73.480 114.858 1.00 14.69 ? 27 PHE B N 1 +ATOM 1818 C CA . PHE B 2 27 ? 46.543 74.939 114.753 1.00 14.61 ? 27 PHE B CA 1 +ATOM 1819 C C . PHE B 2 27 ? 45.206 75.464 115.221 1.00 15.11 ? 27 PHE B C 1 +ATOM 1820 O O . PHE B 2 27 ? 44.255 74.696 115.316 1.00 15.84 ? 27 PHE B O 1 +ATOM 1821 C CB . PHE B 2 27 ? 46.799 75.386 113.318 1.00 14.42 ? 27 PHE B CB 1 +ATOM 1822 C CG . PHE B 2 27 ? 45.651 75.118 112.393 1.00 13.48 ? 27 PHE B CG 1 +ATOM 1823 C CD1 . PHE B 2 27 ? 44.759 76.124 112.078 1.00 13.56 ? 27 PHE B CD1 1 +ATOM 1824 C CD2 . PHE B 2 27 ? 45.469 73.854 111.839 1.00 13.15 ? 27 PHE B CD2 1 +ATOM 1825 C CE1 . PHE B 2 27 ? 43.694 75.887 111.243 1.00 14.07 ? 27 PHE B CE1 1 +ATOM 1826 C CE2 . PHE B 2 27 ? 44.423 73.586 111.007 1.00 13.58 ? 27 PHE B CE2 1 +ATOM 1827 C CZ . PHE B 2 27 ? 43.522 74.611 110.690 1.00 16.31 ? 27 PHE B CZ 1 +ATOM 1828 N N . ASN B 2 28 ? 45.100 76.754 115.523 1.00 15.27 ? 28 ASN B N 1 +ATOM 1829 C CA . ASN B 2 28 ? 43.788 77.276 115.928 1.00 15.62 ? 28 ASN B CA 1 +ATOM 1830 C C . ASN B 2 28 ? 43.050 77.914 114.745 1.00 16.23 ? 28 ASN B C 1 +ATOM 1831 O O . ASN B 2 28 ? 43.634 78.676 113.974 1.00 16.15 ? 28 ASN B O 1 +ATOM 1832 C CB . ASN B 2 28 ? 43.899 78.230 117.110 1.00 15.29 ? 28 ASN B CB 1 +ATOM 1833 C CG . ASN B 2 28 ? 44.747 77.659 118.259 1.00 15.43 ? 28 ASN B CG 1 +ATOM 1834 O OD1 . ASN B 2 28 ? 44.633 76.479 118.616 1.00 15.66 ? 28 ASN B OD1 1 +ATOM 1835 N ND2 . ASN B 2 28 ? 45.595 78.504 118.845 1.00 15.15 ? 28 ASN B ND2 1 +ATOM 1836 N N . ILE B 2 29 ? 41.781 77.569 114.571 1.00 16.49 ? 29 ILE B N 1 +ATOM 1837 C CA . ILE B 2 29 ? 41.058 78.048 113.418 1.00 17.14 ? 29 ILE B CA 1 +ATOM 1838 C C . ILE B 2 29 ? 40.812 79.561 113.514 1.00 18.22 ? 29 ILE B C 1 +ATOM 1839 O O . ILE B 2 29 ? 40.680 80.257 112.480 1.00 18.92 ? 29 ILE B O 1 +ATOM 1840 C CB . ILE B 2 29 ? 39.738 77.254 113.176 1.00 17.28 ? 29 ILE B CB 1 +ATOM 1841 C CG1 . ILE B 2 29 ? 38.759 77.380 114.352 1.00 16.27 ? 29 ILE B CG1 1 +ATOM 1842 C CG2 . ILE B 2 29 ? 40.026 75.803 112.759 1.00 16.70 ? 29 ILE B CG2 1 +ATOM 1843 C CD1 . ILE B 2 29 ? 37.338 77.056 113.953 1.00 14.65 ? 29 ILE B CD1 1 +ATOM 1844 N N . LYS B 2 30 ? 40.769 80.062 114.746 1.00 18.46 ? 30 LYS B N 1 +ATOM 1845 C CA . LYS B 2 30 ? 40.734 81.488 114.995 1.00 18.97 ? 30 LYS B CA 1 +ATOM 1846 C C . LYS B 2 30 ? 41.872 82.254 114.296 1.00 19.22 ? 30 LYS B C 1 +ATOM 1847 O O . LYS B 2 30 ? 41.672 83.410 113.918 1.00 20.46 ? 30 LYS B O 1 +ATOM 1848 C CB . LYS B 2 30 ? 40.748 81.765 116.491 1.00 19.34 ? 30 LYS B CB 1 +ATOM 1849 N N . ASP B 2 31 ? 43.038 81.623 114.117 1.00 18.44 ? 31 ASP B N 1 +ATOM 1850 C CA . ASP B 2 31 ? 44.192 82.255 113.446 1.00 18.00 ? 31 ASP B CA 1 +ATOM 1851 C C . ASP B 2 31 ? 44.125 82.289 111.884 1.00 17.11 ? 31 ASP B C 1 +ATOM 1852 O O . ASP B 2 31 ? 45.078 82.723 111.220 1.00 17.01 ? 31 ASP B O 1 +ATOM 1853 C CB . ASP B 2 31 ? 45.555 81.620 113.876 1.00 18.32 ? 31 ASP B CB 1 +ATOM 1854 C CG . ASP B 2 31 ? 45.657 81.250 115.406 1.00 21.24 ? 31 ASP B CG 1 +ATOM 1855 O OD1 . ASP B 2 31 ? 45.140 81.990 116.292 1.00 21.88 ? 31 ASP B OD1 1 +ATOM 1856 O OD2 . ASP B 2 31 ? 46.302 80.229 115.807 1.00 22.31 ? 31 ASP B OD2 1 +ATOM 1857 N N . THR B 2 32 ? 43.054 81.788 111.275 1.00 16.36 ? 32 THR B N 1 +ATOM 1858 C CA . THR B 2 32 ? 42.972 81.811 109.794 1.00 15.83 ? 32 THR B CA 1 +ATOM 1859 C C . THR B 2 32 ? 41.593 81.646 109.194 1.00 14.35 ? 32 THR B C 1 +ATOM 1860 O O . THR B 2 32 ? 40.598 81.487 109.892 1.00 14.47 ? 32 THR B O 1 +ATOM 1861 C CB . THR B 2 32 ? 43.850 80.714 109.167 1.00 16.72 ? 32 THR B CB 1 +ATOM 1862 O OG1 . THR B 2 32 ? 44.902 80.380 110.078 1.00 17.24 ? 32 THR B OG1 1 +ATOM 1863 C CG2 . THR B 2 32 ? 44.559 81.245 107.860 1.00 16.71 ? 32 THR B CG2 1 +ATOM 1864 N N . TYR B 2 33 ? 41.570 81.634 107.877 1.00 12.45 ? 33 TYR B N 1 +ATOM 1865 C CA . TYR B 2 33 ? 40.356 81.400 107.139 1.00 11.26 ? 33 TYR B CA 1 +ATOM 1866 C C . TYR B 2 33 ? 40.267 79.923 106.859 1.00 12.11 ? 33 TYR B C 1 +ATOM 1867 O O . TYR B 2 33 ? 41.302 79.240 106.620 1.00 11.68 ? 33 TYR B O 1 +ATOM 1868 C CB . TYR B 2 33 ? 40.401 82.191 105.844 1.00 10.32 ? 33 TYR B CB 1 +ATOM 1869 C CG . TYR B 2 33 ? 40.511 83.655 106.117 1.00 7.81 ? 33 TYR B CG 1 +ATOM 1870 C CD1 . TYR B 2 33 ? 41.740 84.226 106.400 1.00 6.26 ? 33 TYR B CD1 1 +ATOM 1871 C CD2 . TYR B 2 33 ? 39.382 84.459 106.156 1.00 6.14 ? 33 TYR B CD2 1 +ATOM 1872 C CE1 . TYR B 2 33 ? 41.858 85.559 106.705 1.00 5.28 ? 33 TYR B CE1 1 +ATOM 1873 C CE2 . TYR B 2 33 ? 39.481 85.792 106.441 1.00 6.83 ? 33 TYR B CE2 1 +ATOM 1874 C CZ . TYR B 2 33 ? 40.733 86.339 106.726 1.00 8.03 ? 33 TYR B CZ 1 +ATOM 1875 O OH . TYR B 2 33 ? 40.862 87.678 107.017 1.00 9.83 ? 33 TYR B OH 1 +ATOM 1876 N N . ILE B 2 34 ? 39.034 79.425 106.913 1.00 12.04 ? 34 ILE B N 1 +ATOM 1877 C CA . ILE B 2 34 ? 38.742 78.029 106.644 1.00 11.71 ? 34 ILE B CA 1 +ATOM 1878 C C . ILE B 2 34 ? 37.814 78.047 105.437 1.00 12.46 ? 34 ILE B C 1 +ATOM 1879 O O . ILE B 2 34 ? 36.845 78.784 105.421 1.00 13.47 ? 34 ILE B O 1 +ATOM 1880 C CB . ILE B 2 34 ? 38.065 77.390 107.875 1.00 10.86 ? 34 ILE B CB 1 +ATOM 1881 C CG1 . ILE B 2 34 ? 38.994 77.416 109.093 1.00 9.95 ? 34 ILE B CG1 1 +ATOM 1882 C CG2 . ILE B 2 34 ? 37.638 75.992 107.583 1.00 10.69 ? 34 ILE B CG2 1 +ATOM 1883 C CD1 . ILE B 2 34 ? 40.176 76.485 109.023 1.00 7.37 ? 34 ILE B CD1 1 +ATOM 1884 N N . HIS B 2 35 ? 38.129 77.277 104.412 1.00 12.35 ? 35 HIS B N 1 +ATOM 1885 C CA . HIS B 2 35 ? 37.257 77.197 103.278 1.00 12.47 ? 35 HIS B CA 1 +ATOM 1886 C C . HIS B 2 35 ? 36.745 75.783 103.176 1.00 12.92 ? 35 HIS B C 1 +ATOM 1887 O O . HIS B 2 35 ? 37.326 74.872 103.725 1.00 13.71 ? 35 HIS B O 1 +ATOM 1888 C CB . HIS B 2 35 ? 37.990 77.548 101.983 1.00 12.03 ? 35 HIS B CB 1 +ATOM 1889 C CG . HIS B 2 35 ? 38.918 78.713 102.098 1.00 11.18 ? 35 HIS B CG 1 +ATOM 1890 N ND1 . HIS B 2 35 ? 38.671 79.925 101.479 1.00 11.19 ? 35 HIS B ND1 1 +ATOM 1891 C CD2 . HIS B 2 35 ? 40.104 78.850 102.740 1.00 7.88 ? 35 HIS B CD2 1 +ATOM 1892 C CE1 . HIS B 2 35 ? 39.662 80.761 101.739 1.00 10.90 ? 35 HIS B CE1 1 +ATOM 1893 N NE2 . HIS B 2 35 ? 40.546 80.132 102.502 1.00 12.10 ? 35 HIS B NE2 1 +ATOM 1894 N N . TRP B 2 36 ? 35.633 75.609 102.481 1.00 12.99 ? 36 TRP B N 1 +ATOM 1895 C CA . TRP B 2 36 ? 35.206 74.293 102.037 1.00 12.45 ? 36 TRP B CA 1 +ATOM 1896 C C . TRP B 2 36 ? 35.359 74.329 100.523 1.00 12.56 ? 36 TRP B C 1 +ATOM 1897 O O . TRP B 2 36 ? 35.011 75.306 99.869 1.00 13.25 ? 36 TRP B O 1 +ATOM 1898 C CB . TRP B 2 36 ? 33.755 74.076 102.397 1.00 11.75 ? 36 TRP B CB 1 +ATOM 1899 C CG . TRP B 2 36 ? 33.537 73.716 103.811 1.00 13.27 ? 36 TRP B CG 1 +ATOM 1900 C CD1 . TRP B 2 36 ? 33.194 74.552 104.824 1.00 13.55 ? 36 TRP B CD1 1 +ATOM 1901 C CD2 . TRP B 2 36 ? 33.609 72.398 104.385 1.00 12.89 ? 36 TRP B CD2 1 +ATOM 1902 N NE1 . TRP B 2 36 ? 33.043 73.846 105.997 1.00 14.29 ? 36 TRP B NE1 1 +ATOM 1903 C CE2 . TRP B 2 36 ? 33.289 72.521 105.758 1.00 13.28 ? 36 TRP B CE2 1 +ATOM 1904 C CE3 . TRP B 2 36 ? 33.900 71.124 103.873 1.00 10.15 ? 36 TRP B CE3 1 +ATOM 1905 C CZ2 . TRP B 2 36 ? 33.286 71.421 106.645 1.00 15.10 ? 36 TRP B CZ2 1 +ATOM 1906 C CZ3 . TRP B 2 36 ? 33.879 70.020 104.757 1.00 16.07 ? 36 TRP B CZ3 1 +ATOM 1907 C CH2 . TRP B 2 36 ? 33.582 70.179 106.126 1.00 14.75 ? 36 TRP B CH2 1 +ATOM 1908 N N . VAL B 2 37 ? 35.915 73.286 99.967 1.00 12.43 ? 37 VAL B N 1 +ATOM 1909 C CA . VAL B 2 37 ? 36.073 73.212 98.543 1.00 12.88 ? 37 VAL B CA 1 +ATOM 1910 C C . VAL B 2 37 ? 35.556 71.844 98.169 1.00 13.06 ? 37 VAL B C 1 +ATOM 1911 O O . VAL B 2 37 ? 35.795 70.852 98.880 1.00 12.95 ? 37 VAL B O 1 +ATOM 1912 C CB . VAL B 2 37 ? 37.557 73.391 98.075 1.00 13.50 ? 37 VAL B CB 1 +ATOM 1913 C CG1 . VAL B 2 37 ? 37.643 73.339 96.546 1.00 14.48 ? 37 VAL B CG1 1 +ATOM 1914 C CG2 . VAL B 2 37 ? 38.120 74.717 98.539 1.00 12.43 ? 37 VAL B CG2 1 +ATOM 1915 N N . ARG B 2 38 ? 34.838 71.803 97.058 1.00 12.86 ? 38 ARG B N 1 +ATOM 1916 C CA . ARG B 2 38 ? 34.179 70.605 96.633 1.00 12.91 ? 38 ARG B CA 1 +ATOM 1917 C C . ARG B 2 38 ? 34.560 70.232 95.231 1.00 13.49 ? 38 ARG B C 1 +ATOM 1918 O O . ARG B 2 38 ? 34.891 71.086 94.409 1.00 14.04 ? 38 ARG B O 1 +ATOM 1919 C CB . ARG B 2 38 ? 32.684 70.822 96.718 1.00 13.20 ? 38 ARG B CB 1 +ATOM 1920 C CG . ARG B 2 38 ? 32.011 71.417 95.502 1.00 12.66 ? 38 ARG B CG 1 +ATOM 1921 C CD . ARG B 2 38 ? 30.541 71.590 95.738 1.00 11.20 ? 38 ARG B CD 1 +ATOM 1922 N NE . ARG B 2 38 ? 29.863 72.370 94.726 1.00 12.97 ? 38 ARG B NE 1 +ATOM 1923 C CZ . ARG B 2 38 ? 28.542 72.491 94.659 1.00 12.81 ? 38 ARG B CZ 1 +ATOM 1924 N NH1 . ARG B 2 38 ? 27.776 71.847 95.536 1.00 14.41 ? 38 ARG B NH1 1 +ATOM 1925 N NH2 . ARG B 2 38 ? 27.985 73.237 93.714 1.00 9.49 ? 38 ARG B NH2 1 +ATOM 1926 N N . GLN B 2 39 ? 34.444 68.942 94.962 1.00 13.31 ? 39 GLN B N 1 +ATOM 1927 C CA . GLN B 2 39 ? 34.826 68.341 93.701 1.00 12.63 ? 39 GLN B CA 1 +ATOM 1928 C C . GLN B 2 39 ? 33.763 67.320 93.241 1.00 12.40 ? 39 GLN B C 1 +ATOM 1929 O O . GLN B 2 39 ? 33.743 66.199 93.725 1.00 12.14 ? 39 GLN B O 1 +ATOM 1930 C CB . GLN B 2 39 ? 36.191 67.660 93.904 1.00 11.87 ? 39 GLN B CB 1 +ATOM 1931 C CG . GLN B 2 39 ? 36.806 67.044 92.667 1.00 13.38 ? 39 GLN B CG 1 +ATOM 1932 C CD . GLN B 2 39 ? 38.327 66.918 92.741 1.00 16.40 ? 39 GLN B CD 1 +ATOM 1933 O OE1 . GLN B 2 39 ? 38.861 66.471 93.770 1.00 18.28 ? 39 GLN B OE1 1 +ATOM 1934 N NE2 . GLN B 2 39 ? 39.032 67.345 91.661 1.00 13.42 ? 39 GLN B NE2 1 +ATOM 1935 N N . ALA B 2 40 ? 32.874 67.694 92.325 1.00 12.43 ? 40 ALA B N 1 +ATOM 1936 C CA . ALA B 2 40 ? 31.969 66.696 91.738 1.00 12.89 ? 40 ALA B CA 1 +ATOM 1937 C C . ALA B 2 40 ? 32.805 65.540 91.147 1.00 14.25 ? 40 ALA B C 1 +ATOM 1938 O O . ALA B 2 40 ? 33.977 65.740 90.841 1.00 15.21 ? 40 ALA B O 1 +ATOM 1939 C CB . ALA B 2 40 ? 31.105 67.316 90.697 1.00 11.37 ? 40 ALA B CB 1 +ATOM 1940 N N . PRO B 2 41 ? 32.250 64.331 91.028 1.00 15.30 ? 41 PRO B N 1 +ATOM 1941 C CA . PRO B 2 41 ? 32.984 63.208 90.430 1.00 16.10 ? 41 PRO B CA 1 +ATOM 1942 C C . PRO B 2 41 ? 33.574 63.463 89.028 1.00 17.47 ? 41 PRO B C 1 +ATOM 1943 O O . PRO B 2 41 ? 32.861 63.639 88.027 1.00 17.46 ? 41 PRO B O 1 +ATOM 1944 C CB . PRO B 2 41 ? 31.927 62.071 90.408 1.00 15.84 ? 41 PRO B CB 1 +ATOM 1945 C CG . PRO B 2 41 ? 31.055 62.380 91.543 1.00 15.09 ? 41 PRO B CG 1 +ATOM 1946 C CD . PRO B 2 41 ? 30.913 63.902 91.498 1.00 15.56 ? 41 PRO B CD 1 +ATOM 1947 N N . GLY B 2 42 ? 34.907 63.467 88.981 1.00 19.43 ? 42 GLY B N 1 +ATOM 1948 C CA . GLY B 2 42 ? 35.662 63.581 87.743 1.00 20.52 ? 42 GLY B CA 1 +ATOM 1949 C C . GLY B 2 42 ? 35.655 64.988 87.171 1.00 21.55 ? 42 GLY B C 1 +ATOM 1950 O O . GLY B 2 42 ? 35.769 65.170 85.940 1.00 22.32 ? 42 GLY B O 1 +ATOM 1951 N N . LYS B 2 43 ? 35.525 65.978 88.058 1.00 21.12 ? 43 LYS B N 1 +ATOM 1952 C CA . LYS B 2 43 ? 35.441 67.369 87.666 1.00 20.31 ? 43 LYS B CA 1 +ATOM 1953 C C . LYS B 2 43 ? 36.413 68.165 88.529 1.00 20.01 ? 43 LYS B C 1 +ATOM 1954 O O . LYS B 2 43 ? 37.026 67.611 89.463 1.00 20.52 ? 43 LYS B O 1 +ATOM 1955 C CB . LYS B 2 43 ? 34.025 67.895 87.871 1.00 20.70 ? 43 LYS B CB 1 +ATOM 1956 C CG . LYS B 2 43 ? 32.913 66.969 87.428 1.00 22.22 ? 43 LYS B CG 1 +ATOM 1957 C CD . LYS B 2 43 ? 32.337 67.418 86.103 1.00 26.33 ? 43 LYS B CD 1 +ATOM 1958 C CE . LYS B 2 43 ? 32.345 66.265 85.087 1.00 28.54 ? 43 LYS B CE 1 +ATOM 1959 N NZ . LYS B 2 43 ? 31.072 66.245 84.328 1.00 30.10 ? 43 LYS B NZ 1 +ATOM 1960 N N . GLY B 2 44 ? 36.547 69.463 88.245 1.00 18.62 ? 44 GLY B N 1 +ATOM 1961 C CA . GLY B 2 44 ? 37.515 70.276 88.936 1.00 17.34 ? 44 GLY B CA 1 +ATOM 1962 C C . GLY B 2 44 ? 37.198 70.613 90.378 1.00 17.14 ? 44 GLY B C 1 +ATOM 1963 O O . GLY B 2 44 ? 36.232 70.147 90.966 1.00 17.13 ? 44 GLY B O 1 +ATOM 1964 N N . LEU B 2 45 ? 38.067 71.428 90.956 1.00 16.72 ? 45 LEU B N 1 +ATOM 1965 C CA . LEU B 2 45 ? 37.925 71.910 92.301 1.00 15.95 ? 45 LEU B CA 1 +ATOM 1966 C C . LEU B 2 45 ? 37.035 73.182 92.250 1.00 15.69 ? 45 LEU B C 1 +ATOM 1967 O O . LEU B 2 45 ? 37.251 74.038 91.433 1.00 15.68 ? 45 LEU B O 1 +ATOM 1968 C CB . LEU B 2 45 ? 39.316 72.238 92.818 1.00 14.82 ? 45 LEU B CB 1 +ATOM 1969 C CG . LEU B 2 45 ? 40.320 71.129 93.099 1.00 16.51 ? 45 LEU B CG 1 +ATOM 1970 C CD1 . LEU B 2 45 ? 41.604 71.713 93.702 1.00 17.64 ? 45 LEU B CD1 1 +ATOM 1971 C CD2 . LEU B 2 45 ? 39.779 70.031 94.028 1.00 15.94 ? 45 LEU B CD2 1 +ATOM 1972 N N . GLU B 2 46 ? 36.039 73.277 93.121 1.00 15.90 ? 46 GLU B N 1 +ATOM 1973 C CA . GLU B 2 46 ? 35.132 74.433 93.210 1.00 15.67 ? 46 GLU B CA 1 +ATOM 1974 C C . GLU B 2 46 ? 35.084 74.974 94.651 1.00 15.21 ? 46 GLU B C 1 +ATOM 1975 O O . GLU B 2 46 ? 34.638 74.280 95.595 1.00 14.90 ? 46 GLU B O 1 +ATOM 1976 C CB . GLU B 2 46 ? 33.739 74.019 92.758 1.00 15.88 ? 46 GLU B CB 1 +ATOM 1977 C CG . GLU B 2 46 ? 32.848 75.140 92.261 1.00 18.95 ? 46 GLU B CG 1 +ATOM 1978 C CD . GLU B 2 46 ? 31.358 74.826 92.422 1.00 22.13 ? 46 GLU B CD 1 +ATOM 1979 O OE1 . GLU B 2 46 ? 31.040 73.630 92.684 1.00 24.92 ? 46 GLU B OE1 1 +ATOM 1980 O OE2 . GLU B 2 46 ? 30.508 75.763 92.294 1.00 19.16 ? 46 GLU B OE2 1 +ATOM 1981 N N . TRP B 2 47 ? 35.556 76.203 94.823 1.00 14.74 ? 47 TRP B N 1 +ATOM 1982 C CA . TRP B 2 47 ? 35.501 76.875 96.105 1.00 15.49 ? 47 TRP B CA 1 +ATOM 1983 C C . TRP B 2 47 ? 34.050 77.112 96.467 1.00 16.63 ? 47 TRP B C 1 +ATOM 1984 O O . TRP B 2 47 ? 33.288 77.682 95.673 1.00 17.11 ? 47 TRP B O 1 +ATOM 1985 C CB . TRP B 2 47 ? 36.245 78.190 96.039 1.00 15.04 ? 47 TRP B CB 1 +ATOM 1986 C CG . TRP B 2 47 ? 36.172 78.999 97.288 1.00 15.02 ? 47 TRP B CG 1 +ATOM 1987 C CD1 . TRP B 2 47 ? 36.972 78.897 98.382 1.00 14.04 ? 47 TRP B CD1 1 +ATOM 1988 C CD2 . TRP B 2 47 ? 35.251 80.062 97.566 1.00 14.21 ? 47 TRP B CD2 1 +ATOM 1989 N NE1 . TRP B 2 47 ? 36.604 79.823 99.331 1.00 12.57 ? 47 TRP B NE1 1 +ATOM 1990 C CE2 . TRP B 2 47 ? 35.551 80.551 98.859 1.00 13.17 ? 47 TRP B CE2 1 +ATOM 1991 C CE3 . TRP B 2 47 ? 34.198 80.651 96.849 1.00 13.57 ? 47 TRP B CE3 1 +ATOM 1992 C CZ2 . TRP B 2 47 ? 34.848 81.605 99.452 1.00 14.64 ? 47 TRP B CZ2 1 +ATOM 1993 C CZ3 . TRP B 2 47 ? 33.495 81.716 97.436 1.00 16.02 ? 47 TRP B CZ3 1 +ATOM 1994 C CH2 . TRP B 2 47 ? 33.831 82.179 98.729 1.00 13.85 ? 47 TRP B CH2 1 +ATOM 1995 N N . VAL B 2 48 ? 33.673 76.675 97.661 1.00 17.15 ? 48 VAL B N 1 +ATOM 1996 C CA . VAL B 2 48 ? 32.293 76.813 98.152 1.00 17.57 ? 48 VAL B CA 1 +ATOM 1997 C C . VAL B 2 48 ? 32.059 77.983 99.103 1.00 16.42 ? 48 VAL B C 1 +ATOM 1998 O O . VAL B 2 48 ? 31.125 78.759 98.926 1.00 17.18 ? 48 VAL B O 1 +ATOM 1999 C CB . VAL B 2 48 ? 31.808 75.491 98.826 1.00 17.51 ? 48 VAL B CB 1 +ATOM 2000 C CG1 . VAL B 2 48 ? 30.561 75.719 99.606 1.00 18.88 ? 48 VAL B CG1 1 +ATOM 2001 C CG2 . VAL B 2 48 ? 31.535 74.462 97.763 1.00 20.25 ? 48 VAL B CG2 1 +ATOM 2002 N N . ALA B 2 49 ? 32.878 78.096 100.136 1.00 15.74 ? 49 ALA B N 1 +ATOM 2003 C CA . ALA B 2 49 ? 32.589 79.026 101.228 1.00 15.19 ? 49 ALA B CA 1 +ATOM 2004 C C . ALA B 2 49 ? 33.868 79.289 101.968 1.00 15.00 ? 49 ALA B C 1 +ATOM 2005 O O . ALA B 2 49 ? 34.802 78.507 101.866 1.00 16.39 ? 49 ALA B O 1 +ATOM 2006 C CB . ALA B 2 49 ? 31.564 78.441 102.174 1.00 14.61 ? 49 ALA B CB 1 +ATOM 2007 N N . ARG B 2 50 ? 33.925 80.384 102.702 1.00 13.78 ? 50 ARG B N 1 +ATOM 2008 C CA . ARG B 2 50 ? 34.991 80.544 103.655 1.00 12.51 ? 50 ARG B CA 1 +ATOM 2009 C C . ARG B 2 50 ? 34.438 81.166 104.919 1.00 11.99 ? 50 ARG B C 1 +ATOM 2010 O O . ARG B 2 50 ? 33.416 81.846 104.876 1.00 12.58 ? 50 ARG B O 1 +ATOM 2011 C CB . ARG B 2 50 ? 36.112 81.374 103.035 1.00 12.29 ? 50 ARG B CB 1 +ATOM 2012 C CG . ARG B 2 50 ? 36.383 82.667 103.688 1.00 9.73 ? 50 ARG B CG 1 +ATOM 2013 C CD . ARG B 2 50 ? 37.794 83.025 103.644 1.00 6.39 ? 50 ARG B CD 1 +ATOM 2014 N NE . ARG B 2 50 ? 38.081 84.245 102.886 1.00 12.08 ? 50 ARG B NE 1 +ATOM 2015 C CZ . ARG B 2 50 ? 37.479 85.436 103.007 1.00 9.14 ? 50 ARG B CZ 1 +ATOM 2016 N NH1 . ARG B 2 50 ? 36.488 85.641 103.874 1.00 11.34 ? 50 ARG B NH1 1 +ATOM 2017 N NH2 . ARG B 2 50 ? 37.919 86.436 102.268 1.00 8.35 ? 50 ARG B NH2 1 +ATOM 2018 N N . ILE B 2 51 ? 35.100 80.931 106.036 1.00 11.18 ? 51 ILE B N 1 +ATOM 2019 C CA . ILE B 2 51 ? 34.730 81.577 107.298 1.00 11.21 ? 51 ILE B CA 1 +ATOM 2020 C C . ILE B 2 51 ? 35.974 82.035 108.008 1.00 11.43 ? 51 ILE B C 1 +ATOM 2021 O O . ILE B 2 51 ? 37.023 81.437 107.885 1.00 12.83 ? 51 ILE B O 1 +ATOM 2022 C CB . ILE B 2 51 ? 33.968 80.621 108.207 1.00 10.35 ? 51 ILE B CB 1 +ATOM 2023 C CG1 . ILE B 2 51 ? 33.548 81.322 109.487 1.00 10.24 ? 51 ILE B CG1 1 +ATOM 2024 C CG2 . ILE B 2 51 ? 34.797 79.407 108.508 1.00 11.19 ? 51 ILE B CG2 1 +ATOM 2025 C CD1 . ILE B 2 51 ? 32.498 80.608 110.192 1.00 7.08 ? 51 ILE B CD1 1 +ATOM 2026 N N . TYR B 2 52 ? 35.855 83.111 108.740 1.00 11.16 ? 52 TYR B N 1 +ATOM 2027 C CA . TYR B 2 52 ? 36.944 83.597 109.510 1.00 11.23 ? 52 TYR B CA 1 +ATOM 2028 C C . TYR B 2 52 ? 36.476 83.511 110.955 1.00 10.88 ? 52 TYR B C 1 +ATOM 2029 O O . TYR B 2 52 ? 35.686 84.325 111.381 1.00 10.72 ? 52 TYR B O 1 +ATOM 2030 C CB . TYR B 2 52 ? 37.188 85.020 109.121 1.00 11.20 ? 52 TYR B CB 1 +ATOM 2031 C CG . TYR B 2 52 ? 38.421 85.571 109.736 1.00 14.23 ? 52 TYR B CG 1 +ATOM 2032 C CD1 . TYR B 2 52 ? 39.580 84.820 109.789 1.00 16.15 ? 52 TYR B CD1 1 +ATOM 2033 C CD2 . TYR B 2 52 ? 38.435 86.854 110.273 1.00 15.83 ? 52 TYR B CD2 1 +ATOM 2034 C CE1 . TYR B 2 52 ? 40.729 85.337 110.370 1.00 18.01 ? 52 TYR B CE1 1 +ATOM 2035 C CE2 . TYR B 2 52 ? 39.574 87.378 110.834 1.00 16.72 ? 52 TYR B CE2 1 +ATOM 2036 C CZ . TYR B 2 52 ? 40.718 86.618 110.875 1.00 16.44 ? 52 TYR B CZ 1 +ATOM 2037 O OH . TYR B 2 52 ? 41.859 87.138 111.420 1.00 16.77 ? 52 TYR B OH 1 +ATOM 2038 N N . PRO B 2 53 ? 36.919 82.497 111.690 1.00 11.01 ? 53 PRO B N 1 +ATOM 2039 C CA . PRO B 2 53 ? 36.324 82.190 112.990 1.00 11.14 ? 53 PRO B CA 1 +ATOM 2040 C C . PRO B 2 53 ? 36.424 83.281 114.051 1.00 11.82 ? 53 PRO B C 1 +ATOM 2041 O O . PRO B 2 53 ? 35.477 83.374 114.833 1.00 11.53 ? 53 PRO B O 1 +ATOM 2042 C CB . PRO B 2 53 ? 37.055 80.917 113.411 1.00 11.52 ? 53 PRO B CB 1 +ATOM 2043 C CG . PRO B 2 53 ? 37.541 80.320 112.093 1.00 10.55 ? 53 PRO B CG 1 +ATOM 2044 C CD . PRO B 2 53 ? 37.958 81.517 111.315 1.00 10.55 ? 53 PRO B CD 1 +ATOM 2045 N N . THR B 2 54 ? 37.484 84.101 114.056 1.00 12.45 ? 54 THR B N 1 +ATOM 2046 C CA . THR B 2 54 ? 37.598 85.211 115.024 1.00 13.02 ? 54 THR B CA 1 +ATOM 2047 C C . THR B 2 54 ? 36.347 86.051 115.112 1.00 12.99 ? 54 THR B C 1 +ATOM 2048 O O . THR B 2 54 ? 35.926 86.413 116.222 1.00 13.07 ? 54 THR B O 1 +ATOM 2049 C CB . THR B 2 54 ? 38.770 86.172 114.747 1.00 13.14 ? 54 THR B CB 1 +ATOM 2050 O OG1 . THR B 2 54 ? 39.775 85.546 113.941 1.00 15.77 ? 54 THR B OG1 1 +ATOM 2051 C CG2 . THR B 2 54 ? 39.503 86.506 116.078 1.00 14.37 ? 54 THR B CG2 1 +ATOM 2052 N N . ASN B 2 55 ? 35.763 86.365 113.954 1.00 12.51 ? 55 ASN B N 1 +ATOM 2053 C CA . ASN B 2 55 ? 34.534 87.150 113.907 1.00 12.77 ? 55 ASN B CA 1 +ATOM 2054 C C . ASN B 2 55 ? 33.348 86.505 113.186 1.00 12.77 ? 55 ASN B C 1 +ATOM 2055 O O . ASN B 2 55 ? 32.317 87.135 112.990 1.00 12.76 ? 55 ASN B O 1 +ATOM 2056 C CB . ASN B 2 55 ? 34.792 88.555 113.358 1.00 12.65 ? 55 ASN B CB 1 +ATOM 2057 C CG . ASN B 2 55 ? 35.699 88.557 112.164 1.00 13.85 ? 55 ASN B CG 1 +ATOM 2058 O OD1 . ASN B 2 55 ? 35.556 87.729 111.244 1.00 14.46 ? 55 ASN B OD1 1 +ATOM 2059 N ND2 . ASN B 2 55 ? 36.649 89.484 112.158 1.00 11.80 ? 55 ASN B ND2 1 +ATOM 2060 N N . GLY B 2 56 ? 33.475 85.245 112.812 1.00 12.96 ? 56 GLY B N 1 +ATOM 2061 C CA . GLY B 2 56 ? 32.402 84.586 112.079 1.00 13.54 ? 56 GLY B CA 1 +ATOM 2062 C C . GLY B 2 56 ? 32.014 85.202 110.730 1.00 13.54 ? 56 GLY B C 1 +ATOM 2063 O O . GLY B 2 56 ? 30.981 84.822 110.177 1.00 13.70 ? 56 GLY B O 1 +ATOM 2064 N N . TYR B 2 57 ? 32.808 86.144 110.214 1.00 13.18 ? 57 TYR B N 1 +ATOM 2065 C CA . TYR B 2 57 ? 32.599 86.678 108.865 1.00 13.39 ? 57 TYR B CA 1 +ATOM 2066 C C . TYR B 2 57 ? 32.695 85.576 107.795 1.00 13.26 ? 57 TYR B C 1 +ATOM 2067 O O . TYR B 2 57 ? 33.698 84.849 107.739 1.00 12.88 ? 57 TYR B O 1 +ATOM 2068 C CB . TYR B 2 57 ? 33.613 87.785 108.529 1.00 13.22 ? 57 TYR B CB 1 +ATOM 2069 C CG . TYR B 2 57 ? 33.391 89.107 109.232 1.00 11.99 ? 57 TYR B CG 1 +ATOM 2070 C CD1 . TYR B 2 57 ? 34.456 90.001 109.425 1.00 10.02 ? 57 TYR B CD1 1 +ATOM 2071 C CD2 . TYR B 2 57 ? 32.129 89.475 109.688 1.00 11.95 ? 57 TYR B CD2 1 +ATOM 2072 C CE1 . TYR B 2 57 ? 34.273 91.219 110.068 1.00 8.57 ? 57 TYR B CE1 1 +ATOM 2073 C CE2 . TYR B 2 57 ? 31.924 90.714 110.329 1.00 10.98 ? 57 TYR B CE2 1 +ATOM 2074 C CZ . TYR B 2 57 ? 33.011 91.573 110.520 1.00 8.84 ? 57 TYR B CZ 1 +ATOM 2075 O OH . TYR B 2 57 ? 32.819 92.785 111.143 1.00 6.70 ? 57 TYR B OH 1 +ATOM 2076 N N . THR B 2 58 ? 31.664 85.475 106.943 1.00 13.10 ? 58 THR B N 1 +ATOM 2077 C CA . THR B 2 58 ? 31.620 84.436 105.914 1.00 13.47 ? 58 THR B CA 1 +ATOM 2078 C C . THR B 2 58 ? 31.613 84.996 104.513 1.00 13.49 ? 58 THR B C 1 +ATOM 2079 O O . THR B 2 58 ? 31.285 86.163 104.308 1.00 14.45 ? 58 THR B O 1 +ATOM 2080 C CB . THR B 2 58 ? 30.413 83.515 106.104 1.00 13.86 ? 58 THR B CB 1 +ATOM 2081 O OG1 . THR B 2 58 ? 29.226 84.290 106.041 1.00 14.14 ? 58 THR B OG1 1 +ATOM 2082 C CG2 . THR B 2 58 ? 30.381 82.942 107.526 1.00 14.05 ? 58 THR B CG2 1 +ATOM 2083 N N . ARG B 2 59 ? 32.021 84.177 103.553 1.00 13.05 ? 59 ARG B N 1 +ATOM 2084 C CA . ARG B 2 59 ? 31.821 84.464 102.128 1.00 13.10 ? 59 ARG B CA 1 +ATOM 2085 C C . ARG B 2 59 ? 31.396 83.181 101.462 1.00 13.62 ? 59 ARG B C 1 +ATOM 2086 O O . ARG B 2 59 ? 31.716 82.088 101.978 1.00 14.83 ? 59 ARG B O 1 +ATOM 2087 C CB . ARG B 2 59 ? 33.082 85.005 101.475 1.00 12.26 ? 59 ARG B CB 1 +ATOM 2088 C CG . ARG B 2 59 ? 33.644 86.225 102.185 1.00 11.97 ? 59 ARG B CG 1 +ATOM 2089 C CD . ARG B 2 59 ? 32.926 87.536 101.907 1.00 7.68 ? 59 ARG B CD 1 +ATOM 2090 N NE . ARG B 2 59 ? 32.516 87.710 100.524 1.00 8.39 ? 59 ARG B NE 1 +ATOM 2091 C CZ . ARG B 2 59 ? 33.249 88.335 99.583 1.00 11.90 ? 59 ARG B CZ 1 +ATOM 2092 N NH1 . ARG B 2 59 ? 34.449 88.829 99.873 1.00 12.80 ? 59 ARG B NH1 1 +ATOM 2093 N NH2 . ARG B 2 59 ? 32.788 88.460 98.346 1.00 10.07 ? 59 ARG B NH2 1 +ATOM 2094 N N . TYR B 2 60 ? 30.666 83.304 100.349 1.00 13.71 ? 60 TYR B N 1 +ATOM 2095 C CA . TYR B 2 60 ? 30.029 82.149 99.670 1.00 13.88 ? 60 TYR B CA 1 +ATOM 2096 C C . TYR B 2 60 ? 30.115 82.198 98.114 1.00 15.18 ? 60 TYR B C 1 +ATOM 2097 O O . TYR B 2 60 ? 30.104 83.293 97.493 1.00 15.77 ? 60 TYR B O 1 +ATOM 2098 C CB . TYR B 2 60 ? 28.567 82.015 100.093 1.00 12.22 ? 60 TYR B CB 1 +ATOM 2099 C CG . TYR B 2 60 ? 28.315 81.715 101.562 1.00 11.17 ? 60 TYR B CG 1 +ATOM 2100 C CD1 . TYR B 2 60 ? 28.303 80.397 102.036 1.00 11.48 ? 60 TYR B CD1 1 +ATOM 2101 C CD2 . TYR B 2 60 ? 28.020 82.733 102.474 1.00 11.07 ? 60 TYR B CD2 1 +ATOM 2102 C CE1 . TYR B 2 60 ? 27.999 80.100 103.380 1.00 8.97 ? 60 TYR B CE1 1 +ATOM 2103 C CE2 . TYR B 2 60 ? 27.740 82.446 103.829 1.00 8.93 ? 60 TYR B CE2 1 +ATOM 2104 C CZ . TYR B 2 60 ? 27.741 81.132 104.263 1.00 10.65 ? 60 TYR B CZ 1 +ATOM 2105 O OH . TYR B 2 60 ? 27.482 80.824 105.573 1.00 11.93 ? 60 TYR B OH 1 +ATOM 2106 N N . ALA B 2 61 ? 30.229 81.026 97.489 1.00 15.05 ? 61 ALA B N 1 +ATOM 2107 C CA . ALA B 2 61 ? 30.130 80.934 96.037 1.00 15.00 ? 61 ALA B CA 1 +ATOM 2108 C C . ALA B 2 61 ? 28.691 81.063 95.669 1.00 15.29 ? 61 ALA B C 1 +ATOM 2109 O O . ALA B 2 61 ? 27.812 80.642 96.429 1.00 15.59 ? 61 ALA B O 1 +ATOM 2110 C CB . ALA B 2 61 ? 30.626 79.599 95.559 1.00 15.00 ? 61 ALA B CB 1 +ATOM 2111 N N . ASP B 2 62 ? 28.446 81.611 94.485 1.00 16.19 ? 62 ASP B N 1 +ATOM 2112 C CA . ASP B 2 62 ? 27.086 81.863 93.991 1.00 16.08 ? 62 ASP B CA 1 +ATOM 2113 C C . ASP B 2 62 ? 26.235 80.616 93.876 1.00 16.14 ? 62 ASP B C 1 +ATOM 2114 O O . ASP B 2 62 ? 25.018 80.700 93.853 1.00 17.17 ? 62 ASP B O 1 +ATOM 2115 C CB . ASP B 2 62 ? 27.149 82.517 92.620 1.00 16.34 ? 62 ASP B CB 1 +ATOM 2116 C CG . ASP B 2 62 ? 27.284 84.028 92.704 1.00 18.65 ? 62 ASP B CG 1 +ATOM 2117 O OD1 . ASP B 2 62 ? 27.572 84.669 91.653 1.00 17.90 ? 62 ASP B OD1 1 +ATOM 2118 O OD2 . ASP B 2 62 ? 27.107 84.652 93.786 1.00 20.19 ? 62 ASP B OD2 1 +ATOM 2119 N N . SER B 2 63 ? 26.870 79.453 93.805 1.00 15.96 ? 63 SER B N 1 +ATOM 2120 C CA . SER B 2 63 ? 26.170 78.223 93.459 1.00 15.25 ? 63 SER B CA 1 +ATOM 2121 C C . SER B 2 63 ? 25.580 77.596 94.701 1.00 15.47 ? 63 SER B C 1 +ATOM 2122 O O . SER B 2 63 ? 24.857 76.571 94.623 1.00 15.14 ? 63 SER B O 1 +ATOM 2123 C CB . SER B 2 63 ? 27.154 77.251 92.820 1.00 15.40 ? 63 SER B CB 1 +ATOM 2124 O OG . SER B 2 63 ? 28.242 77.000 93.704 1.00 15.23 ? 63 SER B OG 1 +ATOM 2125 N N . VAL B 2 64 ? 25.917 78.201 95.843 1.00 15.57 ? 64 VAL B N 1 +ATOM 2126 C CA . VAL B 2 64 ? 25.488 77.724 97.141 1.00 15.93 ? 64 VAL B CA 1 +ATOM 2127 C C . VAL B 2 64 ? 24.832 78.764 98.035 1.00 16.68 ? 64 VAL B C 1 +ATOM 2128 O O . VAL B 2 64 ? 24.133 78.406 98.970 1.00 16.62 ? 64 VAL B O 1 +ATOM 2129 C CB . VAL B 2 64 ? 26.622 76.997 97.907 1.00 16.00 ? 64 VAL B CB 1 +ATOM 2130 C CG1 . VAL B 2 64 ? 27.342 76.017 97.012 1.00 15.70 ? 64 VAL B CG1 1 +ATOM 2131 C CG2 . VAL B 2 64 ? 27.592 77.960 98.571 1.00 16.22 ? 64 VAL B CG2 1 +ATOM 2132 N N . LYS B 2 65 ? 25.026 80.050 97.747 1.00 18.16 ? 65 LYS B N 1 +ATOM 2133 C CA . LYS B 2 65 ? 24.572 81.096 98.674 1.00 19.24 ? 65 LYS B CA 1 +ATOM 2134 C C . LYS B 2 65 ? 23.103 80.891 98.970 1.00 18.46 ? 65 LYS B C 1 +ATOM 2135 O O . LYS B 2 65 ? 22.344 80.541 98.072 1.00 18.63 ? 65 LYS B O 1 +ATOM 2136 C CB . LYS B 2 65 ? 24.838 82.510 98.123 1.00 20.66 ? 65 LYS B CB 1 +ATOM 2137 C CG . LYS B 2 65 ? 24.975 83.603 99.233 1.00 24.17 ? 65 LYS B CG 1 +ATOM 2138 C CD . LYS B 2 65 ? 25.795 84.838 98.815 1.00 28.10 ? 65 LYS B CD 1 +ATOM 2139 C CE . LYS B 2 65 ? 24.951 86.128 99.084 1.00 32.19 ? 65 LYS B CE 1 +ATOM 2140 N NZ . LYS B 2 65 ? 25.724 87.339 99.518 1.00 32.73 ? 65 LYS B NZ 1 +ATOM 2141 N N . GLY B 2 66 ? 22.720 81.037 100.235 1.00 17.61 ? 66 GLY B N 1 +ATOM 2142 C CA . GLY B 2 66 ? 21.351 80.779 100.639 1.00 16.37 ? 66 GLY B CA 1 +ATOM 2143 C C . GLY B 2 66 ? 21.019 79.339 101.005 1.00 16.10 ? 66 GLY B C 1 +ATOM 2144 O O . GLY B 2 66 ? 20.020 79.089 101.654 1.00 15.42 ? 66 GLY B O 1 +ATOM 2145 N N . ARG B 2 67 ? 21.827 78.373 100.588 1.00 16.05 ? 67 ARG B N 1 +ATOM 2146 C CA . ARG B 2 67 ? 21.536 76.992 100.943 1.00 15.90 ? 67 ARG B CA 1 +ATOM 2147 C C . ARG B 2 67 ? 22.502 76.529 102.016 1.00 16.27 ? 67 ARG B C 1 +ATOM 2148 O O . ARG B 2 67 ? 22.115 76.132 103.118 1.00 16.99 ? 67 ARG B O 1 +ATOM 2149 C CB . ARG B 2 67 ? 21.614 76.099 99.712 1.00 15.64 ? 67 ARG B CB 1 +ATOM 2150 C CG . ARG B 2 67 ? 20.621 76.452 98.617 1.00 14.36 ? 67 ARG B CG 1 +ATOM 2151 C CD . ARG B 2 67 ? 20.557 75.431 97.498 1.00 14.12 ? 67 ARG B CD 1 +ATOM 2152 N NE . ARG B 2 67 ? 21.831 75.368 96.790 1.00 15.67 ? 67 ARG B NE 1 +ATOM 2153 C CZ . ARG B 2 67 ? 22.420 74.252 96.344 1.00 15.01 ? 67 ARG B CZ 1 +ATOM 2154 N NH1 . ARG B 2 67 ? 21.856 73.051 96.513 1.00 10.45 ? 67 ARG B NH1 1 +ATOM 2155 N NH2 . ARG B 2 67 ? 23.587 74.355 95.706 1.00 11.54 ? 67 ARG B NH2 1 +ATOM 2156 N N . PHE B 2 68 ? 23.779 76.618 101.692 1.00 16.93 ? 68 PHE B N 1 +ATOM 2157 C CA . PHE B 2 68 ? 24.868 76.157 102.554 1.00 16.85 ? 68 PHE B CA 1 +ATOM 2158 C C . PHE B 2 68 ? 25.194 77.194 103.626 1.00 16.89 ? 68 PHE B C 1 +ATOM 2159 O O . PHE B 2 68 ? 25.117 78.405 103.390 1.00 16.80 ? 68 PHE B O 1 +ATOM 2160 C CB . PHE B 2 68 ? 26.083 75.868 101.683 1.00 16.45 ? 68 PHE B CB 1 +ATOM 2161 C CG . PHE B 2 68 ? 25.893 74.691 100.769 1.00 16.18 ? 68 PHE B CG 1 +ATOM 2162 C CD1 . PHE B 2 68 ? 24.631 74.136 100.573 1.00 15.58 ? 68 PHE B CD1 1 +ATOM 2163 C CD2 . PHE B 2 68 ? 26.980 74.113 100.133 1.00 16.04 ? 68 PHE B CD2 1 +ATOM 2164 C CE1 . PHE B 2 68 ? 24.447 73.044 99.730 1.00 17.19 ? 68 PHE B CE1 1 +ATOM 2165 C CE2 . PHE B 2 68 ? 26.818 72.998 99.297 1.00 17.01 ? 68 PHE B CE2 1 +ATOM 2166 C CZ . PHE B 2 68 ? 25.544 72.463 99.091 1.00 17.15 ? 68 PHE B CZ 1 +ATOM 2167 N N . THR B 2 69 ? 25.534 76.733 104.820 1.00 16.70 ? 69 THR B N 1 +ATOM 2168 C CA . THR B 2 69 ? 25.962 77.695 105.826 1.00 16.68 ? 69 THR B CA 1 +ATOM 2169 C C . THR B 2 69 ? 27.264 77.269 106.466 1.00 16.34 ? 69 THR B C 1 +ATOM 2170 O O . THR B 2 69 ? 27.360 76.168 107.036 1.00 16.06 ? 69 THR B O 1 +ATOM 2171 C CB . THR B 2 69 ? 24.866 77.997 106.870 1.00 16.20 ? 69 THR B CB 1 +ATOM 2172 O OG1 . THR B 2 69 ? 23.650 78.291 106.187 1.00 16.84 ? 69 THR B OG1 1 +ATOM 2173 C CG2 . THR B 2 69 ? 25.156 79.312 107.547 1.00 16.33 ? 69 THR B CG2 1 +ATOM 2174 N N . ILE B 2 70 ? 28.256 78.149 106.345 1.00 15.88 ? 70 ILE B N 1 +ATOM 2175 C CA . ILE B 2 70 ? 29.533 77.921 106.963 1.00 16.44 ? 70 ILE B CA 1 +ATOM 2176 C C . ILE B 2 70 ? 29.503 78.500 108.359 1.00 17.26 ? 70 ILE B C 1 +ATOM 2177 O O . ILE B 2 70 ? 28.861 79.503 108.615 1.00 17.90 ? 70 ILE B O 1 +ATOM 2178 C CB . ILE B 2 70 ? 30.704 78.442 106.086 1.00 15.83 ? 70 ILE B CB 1 +ATOM 2179 C CG1 . ILE B 2 70 ? 31.734 77.336 105.893 1.00 14.24 ? 70 ILE B CG1 1 +ATOM 2180 C CG2 . ILE B 2 70 ? 31.367 79.600 106.713 1.00 17.72 ? 70 ILE B CG2 1 +ATOM 2181 C CD1 . ILE B 2 70 ? 33.123 77.719 106.174 1.00 9.69 ? 70 ILE B CD1 1 +ATOM 2182 N N . SER B 2 71 ? 30.161 77.825 109.280 1.00 18.40 ? 71 SER B N 1 +ATOM 2183 C CA . SER B 2 71 ? 30.236 78.318 110.634 1.00 19.49 ? 71 SER B CA 1 +ATOM 2184 C C . SER B 2 71 ? 31.431 77.679 111.307 1.00 19.98 ? 71 SER B C 1 +ATOM 2185 O O . SER B 2 71 ? 32.020 76.730 110.798 1.00 20.15 ? 71 SER B O 1 +ATOM 2186 C CB . SER B 2 71 ? 28.952 78.016 111.390 1.00 19.41 ? 71 SER B CB 1 +ATOM 2187 O OG . SER B 2 71 ? 28.586 76.665 111.167 1.00 19.80 ? 71 SER B OG 1 +ATOM 2188 N N . ALA B 2 72 ? 31.783 78.228 112.455 1.00 21.08 ? 72 ALA B N 1 +ATOM 2189 C CA . ALA B 2 72 ? 32.910 77.755 113.216 1.00 21.24 ? 72 ALA B CA 1 +ATOM 2190 C C . ALA B 2 72 ? 32.458 77.550 114.634 1.00 21.71 ? 72 ALA B C 1 +ATOM 2191 O O . ALA B 2 72 ? 31.553 78.242 115.131 1.00 22.22 ? 72 ALA B O 1 +ATOM 2192 C CB . ALA B 2 72 ? 34.011 78.774 113.172 1.00 21.29 ? 72 ALA B CB 1 +ATOM 2193 N N . ASP B 2 73 ? 33.087 76.584 115.286 1.00 21.71 ? 73 ASP B N 1 +ATOM 2194 C CA . ASP B 2 73 ? 33.027 76.488 116.731 1.00 21.25 ? 73 ASP B CA 1 +ATOM 2195 C C . ASP B 2 73 ? 34.464 76.472 117.265 1.00 21.38 ? 73 ASP B C 1 +ATOM 2196 O O . ASP B 2 73 ? 35.084 75.421 117.377 1.00 21.55 ? 73 ASP B O 1 +ATOM 2197 C CB . ASP B 2 73 ? 32.253 75.248 117.143 1.00 20.84 ? 73 ASP B CB 1 +ATOM 2198 C CG . ASP B 2 73 ? 32.105 75.126 118.641 1.00 21.05 ? 73 ASP B CG 1 +ATOM 2199 O OD1 . ASP B 2 73 ? 32.896 75.756 119.389 1.00 19.86 ? 73 ASP B OD1 1 +ATOM 2200 O OD2 . ASP B 2 73 ? 31.225 74.397 119.158 1.00 21.18 ? 73 ASP B OD2 1 +ATOM 2201 N N . THR B 2 74 ? 34.983 77.659 117.563 1.00 21.51 ? 74 THR B N 1 +ATOM 2202 C CA . THR B 2 74 ? 36.293 77.870 118.188 1.00 21.38 ? 74 THR B CA 1 +ATOM 2203 C C . THR B 2 74 ? 36.656 76.972 119.410 1.00 21.07 ? 74 THR B C 1 +ATOM 2204 O O . THR B 2 74 ? 37.793 76.461 119.495 1.00 20.99 ? 74 THR B O 1 +ATOM 2205 C CB . THR B 2 74 ? 36.416 79.382 118.504 1.00 21.68 ? 74 THR B CB 1 +ATOM 2206 O OG1 . THR B 2 74 ? 37.344 79.963 117.584 1.00 22.15 ? 74 THR B OG1 1 +ATOM 2207 C CG2 . THR B 2 74 ? 37.022 79.674 119.891 1.00 23.09 ? 74 THR B CG2 1 +ATOM 2208 N N . SER B 2 75 ? 35.728 76.763 120.348 1.00 20.18 ? 75 SER B N 1 +ATOM 2209 C CA . SER B 2 75 ? 36.035 75.840 121.445 1.00 19.46 ? 75 SER B CA 1 +ATOM 2210 C C . SER B 2 75 ? 36.353 74.421 120.920 1.00 18.91 ? 75 SER B C 1 +ATOM 2211 O O . SER B 2 75 ? 37.399 73.843 121.250 1.00 19.30 ? 75 SER B O 1 +ATOM 2212 C CB . SER B 2 75 ? 34.953 75.835 122.530 1.00 19.67 ? 75 SER B CB 1 +ATOM 2213 O OG . SER B 2 75 ? 33.673 75.523 122.012 1.00 20.42 ? 75 SER B OG 1 +ATOM 2214 N N . LYS B 2 76 ? 35.494 73.873 120.067 1.00 17.60 ? 76 LYS B N 1 +ATOM 2215 C CA . LYS B 2 76 ? 35.773 72.556 119.485 1.00 16.76 ? 76 LYS B CA 1 +ATOM 2216 C C . LYS B 2 76 ? 36.889 72.546 118.406 1.00 16.27 ? 76 LYS B C 1 +ATOM 2217 O O . LYS B 2 76 ? 37.262 71.492 117.881 1.00 16.41 ? 76 LYS B O 1 +ATOM 2218 C CB . LYS B 2 76 ? 34.484 71.912 118.953 1.00 16.44 ? 76 LYS B CB 1 +ATOM 2219 C CG . LYS B 2 76 ? 33.318 71.963 119.911 1.00 15.41 ? 76 LYS B CG 1 +ATOM 2220 C CD . LYS B 2 76 ? 32.752 70.572 120.238 1.00 14.58 ? 76 LYS B CD 1 +ATOM 2221 C CE . LYS B 2 76 ? 31.369 70.673 120.898 1.00 13.20 ? 76 LYS B CE 1 +ATOM 2222 N NZ . LYS B 2 76 ? 30.275 70.771 119.881 1.00 11.10 ? 76 LYS B NZ 1 +ATOM 2223 N N . ASN B 2 77 ? 37.442 73.715 118.106 1.00 15.81 ? 77 ASN B N 1 +ATOM 2224 C CA . ASN B 2 77 ? 38.354 73.897 116.955 1.00 15.26 ? 77 ASN B CA 1 +ATOM 2225 C C . ASN B 2 77 ? 37.850 73.291 115.641 1.00 15.26 ? 77 ASN B C 1 +ATOM 2226 O O . ASN B 2 77 ? 38.592 72.693 114.853 1.00 15.11 ? 77 ASN B O 1 +ATOM 2227 C CB . ASN B 2 77 ? 39.783 73.450 117.282 1.00 14.65 ? 77 ASN B CB 1 +ATOM 2228 C CG . ASN B 2 77 ? 40.820 74.417 116.731 1.00 13.69 ? 77 ASN B CG 1 +ATOM 2229 O OD1 . ASN B 2 77 ? 40.535 75.614 116.532 1.00 10.37 ? 77 ASN B OD1 1 +ATOM 2230 N ND2 . ASN B 2 77 ? 42.026 73.907 116.473 1.00 10.61 ? 77 ASN B ND2 1 +ATOM 2231 N N . THR B 2 78 ? 36.562 73.461 115.411 1.00 15.25 ? 78 THR B N 1 +ATOM 2232 C CA . THR B 2 78 ? 35.904 72.734 114.352 1.00 15.66 ? 78 THR B CA 1 +ATOM 2233 C C . THR B 2 78 ? 35.146 73.697 113.424 1.00 14.94 ? 78 THR B C 1 +ATOM 2234 O O . THR B 2 78 ? 34.500 74.630 113.876 1.00 14.87 ? 78 THR B O 1 +ATOM 2235 C CB . THR B 2 78 ? 35.017 71.632 115.003 1.00 15.97 ? 78 THR B CB 1 +ATOM 2236 O OG1 . THR B 2 78 ? 35.865 70.741 115.754 1.00 17.65 ? 78 THR B OG1 1 +ATOM 2237 C CG2 . THR B 2 78 ? 34.416 70.698 113.963 1.00 17.16 ? 78 THR B CG2 1 +ATOM 2238 N N . ALA B 2 79 ? 35.284 73.506 112.122 1.00 14.45 ? 79 ALA B N 1 +ATOM 2239 C CA . ALA B 2 79 ? 34.447 74.239 111.177 1.00 14.15 ? 79 ALA B CA 1 +ATOM 2240 C C . ALA B 2 79 ? 33.299 73.360 110.666 1.00 14.30 ? 79 ALA B C 1 +ATOM 2241 O O . ALA B 2 79 ? 33.374 72.117 110.714 1.00 13.73 ? 79 ALA B O 1 +ATOM 2242 C CB . ALA B 2 79 ? 35.252 74.754 110.048 1.00 13.90 ? 79 ALA B CB 1 +ATOM 2243 N N . TYR B 2 80 ? 32.240 74.012 110.190 1.00 13.94 ? 80 TYR B N 1 +ATOM 2244 C CA . TYR B 2 80 ? 31.071 73.300 109.696 1.00 14.16 ? 80 TYR B CA 1 +ATOM 2245 C C . TYR B 2 80 ? 30.575 73.810 108.340 1.00 14.06 ? 80 TYR B C 1 +ATOM 2246 O O . TYR B 2 80 ? 30.757 74.976 107.988 1.00 14.25 ? 80 TYR B O 1 +ATOM 2247 C CB . TYR B 2 80 ? 29.951 73.397 110.714 1.00 14.02 ? 80 TYR B CB 1 +ATOM 2248 C CG . TYR B 2 80 ? 30.341 72.905 112.078 1.00 16.37 ? 80 TYR B CG 1 +ATOM 2249 C CD1 . TYR B 2 80 ? 30.469 71.534 112.326 1.00 19.30 ? 80 TYR B CD1 1 +ATOM 2250 C CD2 . TYR B 2 80 ? 30.570 73.792 113.134 1.00 17.63 ? 80 TYR B CD2 1 +ATOM 2251 C CE1 . TYR B 2 80 ? 30.818 71.065 113.566 1.00 18.81 ? 80 TYR B CE1 1 +ATOM 2252 C CE2 . TYR B 2 80 ? 30.917 73.319 114.396 1.00 17.22 ? 80 TYR B CE2 1 +ATOM 2253 C CZ . TYR B 2 80 ? 31.042 71.960 114.582 1.00 18.51 ? 80 TYR B CZ 1 +ATOM 2254 O OH . TYR B 2 80 ? 31.398 71.450 115.784 1.00 22.24 ? 80 TYR B OH 1 +ATOM 2255 N N . LEU B 2 81 ? 29.953 72.922 107.577 1.00 13.42 ? 81 LEU B N 1 +ATOM 2256 C CA . LEU B 2 81 ? 29.171 73.341 106.444 1.00 12.91 ? 81 LEU B CA 1 +ATOM 2257 C C . LEU B 2 81 ? 27.813 72.712 106.647 1.00 13.41 ? 81 LEU B C 1 +ATOM 2258 O O . LEU B 2 81 ? 27.690 71.488 106.704 1.00 14.05 ? 81 LEU B O 1 +ATOM 2259 C CB . LEU B 2 81 ? 29.814 72.889 105.137 1.00 12.88 ? 81 LEU B CB 1 +ATOM 2260 C CG . LEU B 2 81 ? 29.281 73.389 103.793 1.00 11.07 ? 81 LEU B CG 1 +ATOM 2261 C CD1 . LEU B 2 81 ? 29.576 74.846 103.629 1.00 10.36 ? 81 LEU B CD1 1 +ATOM 2262 C CD2 . LEU B 2 81 ? 29.888 72.598 102.619 1.00 10.97 ? 81 LEU B CD2 1 +ATOM 2263 N N . GLN B 2 82 ? 26.811 73.570 106.818 1.00 13.46 ? 82 GLN B N 1 +ATOM 2264 C CA . GLN B 2 82 ? 25.426 73.175 106.995 1.00 13.62 ? 82 GLN B CA 1 +ATOM 2265 C C . GLN B 2 82 ? 24.835 73.279 105.626 1.00 13.43 ? 82 GLN B C 1 +ATOM 2266 O O . GLN B 2 82 ? 24.720 74.373 105.085 1.00 13.93 ? 82 GLN B O 1 +ATOM 2267 C CB . GLN B 2 82 ? 24.743 74.145 107.941 1.00 13.75 ? 82 GLN B CB 1 +ATOM 2268 C CG . GLN B 2 82 ? 23.307 73.868 108.232 1.00 15.32 ? 82 GLN B CG 1 +ATOM 2269 C CD . GLN B 2 82 ? 23.093 72.467 108.660 1.00 18.72 ? 82 GLN B CD 1 +ATOM 2270 O OE1 . GLN B 2 82 ? 23.510 72.073 109.751 1.00 19.65 ? 82 GLN B OE1 1 +ATOM 2271 N NE2 . GLN B 2 82 ? 22.447 71.689 107.805 1.00 20.46 ? 82 GLN B NE2 1 +ATOM 2272 N N . MET B 2 83 ? 24.506 72.140 105.043 1.00 13.09 ? 83 MET B N 1 +ATOM 2273 C CA . MET B 2 83 ? 24.165 72.109 103.646 1.00 13.14 ? 83 MET B CA 1 +ATOM 2274 C C . MET B 2 83 ? 22.717 71.851 103.531 1.00 12.96 ? 83 MET B C 1 +ATOM 2275 O O . MET B 2 83 ? 22.283 70.728 103.736 1.00 12.79 ? 83 MET B O 1 +ATOM 2276 C CB . MET B 2 83 ? 24.904 70.995 102.920 1.00 13.43 ? 83 MET B CB 1 +ATOM 2277 C CG . MET B 2 83 ? 26.332 71.318 102.541 1.00 15.37 ? 83 MET B CG 1 +ATOM 2278 S SD . MET B 2 83 ? 27.089 69.843 101.903 1.00 19.30 ? 83 MET B SD 1 +ATOM 2279 C CE . MET B 2 83 ? 26.550 68.674 103.040 1.00 19.08 ? 83 MET B CE 1 +ATOM 2280 N N . ASN B 2 84 ? 21.968 72.885 103.167 1.00 13.17 ? 84 ASN B N 1 +ATOM 2281 C CA . ASN B 2 84 ? 20.540 72.759 103.064 1.00 13.34 ? 84 ASN B CA 1 +ATOM 2282 C C . ASN B 2 84 ? 20.105 72.642 101.637 1.00 13.71 ? 84 ASN B C 1 +ATOM 2283 O O . ASN B 2 84 ? 20.789 73.088 100.750 1.00 14.14 ? 84 ASN B O 1 +ATOM 2284 C CB . ASN B 2 84 ? 19.873 73.951 103.725 1.00 13.42 ? 84 ASN B CB 1 +ATOM 2285 C CG . ASN B 2 84 ? 19.654 73.735 105.201 1.00 13.75 ? 84 ASN B CG 1 +ATOM 2286 O OD1 . ASN B 2 84 ? 19.200 72.663 105.608 1.00 14.10 ? 84 ASN B OD1 1 +ATOM 2287 N ND2 . ASN B 2 84 ? 19.977 74.745 106.019 1.00 11.58 ? 84 ASN B ND2 1 +ATOM 2288 N N . SER B 2 85 ? 18.952 72.024 101.426 1.00 14.78 ? 85 SER B N 1 +ATOM 2289 C CA . SER B 2 85 ? 18.268 72.015 100.133 1.00 15.08 ? 85 SER B CA 1 +ATOM 2290 C C . SER B 2 85 ? 19.218 71.527 99.027 1.00 15.15 ? 85 SER B C 1 +ATOM 2291 O O . SER B 2 85 ? 19.492 72.231 98.059 1.00 15.45 ? 85 SER B O 1 +ATOM 2292 C CB . SER B 2 85 ? 17.609 73.395 99.864 1.00 14.99 ? 85 SER B CB 1 +ATOM 2293 O OG . SER B 2 85 ? 17.359 73.614 98.491 1.00 14.82 ? 85 SER B OG 1 +ATOM 2294 N N . LEU B 2 86 ? 19.710 70.304 99.213 1.00 15.39 ? 86 LEU B N 1 +ATOM 2295 C CA . LEU B 2 86 ? 20.683 69.676 98.328 1.00 15.51 ? 86 LEU B CA 1 +ATOM 2296 C C . LEU B 2 86 ? 20.026 69.081 97.104 1.00 15.52 ? 86 LEU B C 1 +ATOM 2297 O O . LEU B 2 86 ? 18.846 68.773 97.128 1.00 15.99 ? 86 LEU B O 1 +ATOM 2298 C CB . LEU B 2 86 ? 21.452 68.580 99.066 1.00 15.44 ? 86 LEU B CB 1 +ATOM 2299 C CG . LEU B 2 86 ? 22.385 69.045 100.180 1.00 15.46 ? 86 LEU B CG 1 +ATOM 2300 C CD1 . LEU B 2 86 ? 22.542 67.908 101.124 1.00 17.08 ? 86 LEU B CD1 1 +ATOM 2301 C CD2 . LEU B 2 86 ? 23.743 69.487 99.666 1.00 15.74 ? 86 LEU B CD2 1 +ATOM 2302 N N . ARG B 2 87 ? 20.808 68.924 96.042 1.00 15.39 ? 87 ARG B N 1 +ATOM 2303 C CA . ARG B 2 87 ? 20.324 68.468 94.752 1.00 15.46 ? 87 ARG B CA 1 +ATOM 2304 C C . ARG B 2 87 ? 21.440 67.632 94.168 1.00 15.12 ? 87 ARG B C 1 +ATOM 2305 O O . ARG B 2 87 ? 22.526 67.539 94.749 1.00 14.98 ? 87 ARG B O 1 +ATOM 2306 C CB . ARG B 2 87 ? 20.036 69.645 93.811 1.00 15.98 ? 87 ARG B CB 1 +ATOM 2307 C CG . ARG B 2 87 ? 19.470 70.923 94.442 1.00 18.92 ? 87 ARG B CG 1 +ATOM 2308 C CD . ARG B 2 87 ? 17.931 70.884 94.696 1.00 24.74 ? 87 ARG B CD 1 +ATOM 2309 N NE . ARG B 2 87 ? 17.295 72.218 94.705 1.00 27.69 ? 87 ARG B NE 1 +ATOM 2310 C CZ . ARG B 2 87 ? 16.240 72.558 95.459 1.00 28.60 ? 87 ARG B CZ 1 +ATOM 2311 N NH1 . ARG B 2 87 ? 15.699 71.659 96.290 1.00 27.14 ? 87 ARG B NH1 1 +ATOM 2312 N NH2 . ARG B 2 87 ? 15.733 73.801 95.390 1.00 28.22 ? 87 ARG B NH2 1 +ATOM 2313 N N . ALA B 2 88 ? 21.193 67.033 93.014 1.00 14.55 ? 88 ALA B N 1 +ATOM 2314 C CA . ALA B 2 88 ? 22.161 66.109 92.460 1.00 14.76 ? 88 ALA B CA 1 +ATOM 2315 C C . ALA B 2 88 ? 23.407 66.836 91.970 1.00 14.98 ? 88 ALA B C 1 +ATOM 2316 O O . ALA B 2 88 ? 24.467 66.238 91.980 1.00 14.74 ? 88 ALA B O 1 +ATOM 2317 C CB . ALA B 2 88 ? 21.543 65.231 91.362 1.00 14.48 ? 88 ALA B CB 1 +ATOM 2318 N N . GLU B 2 89 ? 23.271 68.110 91.557 1.00 15.15 ? 89 GLU B N 1 +ATOM 2319 C CA . GLU B 2 89 ? 24.413 68.975 91.221 1.00 15.76 ? 89 GLU B CA 1 +ATOM 2320 C C . GLU B 2 89 ? 25.453 68.968 92.360 1.00 14.85 ? 89 GLU B C 1 +ATOM 2321 O O . GLU B 2 89 ? 26.637 69.150 92.117 1.00 15.12 ? 89 GLU B O 1 +ATOM 2322 C CB . GLU B 2 89 ? 23.964 70.455 91.032 1.00 16.93 ? 89 GLU B CB 1 +ATOM 2323 C CG . GLU B 2 89 ? 23.634 70.945 89.621 1.00 21.20 ? 89 GLU B CG 1 +ATOM 2324 C CD . GLU B 2 89 ? 22.411 71.883 89.615 1.00 29.31 ? 89 GLU B CD 1 +ATOM 2325 O OE1 . GLU B 2 89 ? 22.325 72.711 90.546 1.00 31.90 ? 89 GLU B OE1 1 +ATOM 2326 O OE2 . GLU B 2 89 ? 21.503 71.804 88.716 1.00 30.71 ? 89 GLU B OE2 1 +ATOM 2327 N N . ASP B 2 90 ? 24.989 68.790 93.599 1.00 13.69 ? 90 ASP B N 1 +ATOM 2328 C CA . ASP B 2 90 ? 25.802 68.927 94.797 1.00 12.75 ? 90 ASP B CA 1 +ATOM 2329 C C . ASP B 2 90 ? 26.573 67.684 95.219 1.00 12.87 ? 90 ASP B C 1 +ATOM 2330 O O . ASP B 2 90 ? 27.349 67.739 96.180 1.00 12.55 ? 90 ASP B O 1 +ATOM 2331 C CB . ASP B 2 90 ? 24.911 69.355 95.935 1.00 12.53 ? 90 ASP B CB 1 +ATOM 2332 C CG . ASP B 2 90 ? 24.310 70.691 95.690 1.00 14.21 ? 90 ASP B CG 1 +ATOM 2333 O OD1 . ASP B 2 90 ? 23.069 70.777 95.556 1.00 17.17 ? 90 ASP B OD1 1 +ATOM 2334 O OD2 . ASP B 2 90 ? 25.007 71.721 95.585 1.00 13.42 ? 90 ASP B OD2 1 +ATOM 2335 N N . THR B 2 91 ? 26.326 66.564 94.534 1.00 12.69 ? 91 THR B N 1 +ATOM 2336 C CA . THR B 2 91 ? 27.044 65.340 94.771 1.00 12.66 ? 91 THR B CA 1 +ATOM 2337 C C . THR B 2 91 ? 28.499 65.609 94.428 1.00 12.77 ? 91 THR B C 1 +ATOM 2338 O O . THR B 2 91 ? 28.798 65.894 93.277 1.00 12.97 ? 91 THR B O 1 +ATOM 2339 C CB . THR B 2 91 ? 26.555 64.252 93.853 1.00 12.38 ? 91 THR B CB 1 +ATOM 2340 O OG1 . THR B 2 91 ? 25.191 63.940 94.145 1.00 14.62 ? 91 THR B OG1 1 +ATOM 2341 C CG2 . THR B 2 91 ? 27.294 62.992 94.168 1.00 11.97 ? 91 THR B CG2 1 +ATOM 2342 N N . ALA B 2 92 ? 29.380 65.493 95.423 1.00 12.51 ? 92 ALA B N 1 +ATOM 2343 C CA . ALA B 2 92 ? 30.784 65.865 95.313 1.00 12.95 ? 92 ALA B CA 1 +ATOM 2344 C C . ALA B 2 92 ? 31.551 65.394 96.551 1.00 13.01 ? 92 ALA B C 1 +ATOM 2345 O O . ALA B 2 92 ? 30.940 64.958 97.541 1.00 12.70 ? 92 ALA B O 1 +ATOM 2346 C CB . ALA B 2 92 ? 30.933 67.413 95.169 1.00 13.08 ? 92 ALA B CB 1 +ATOM 2347 N N . VAL B 2 93 ? 32.886 65.494 96.474 1.00 12.29 ? 93 VAL B N 1 +ATOM 2348 C CA . VAL B 2 93 ? 33.762 65.321 97.625 1.00 11.30 ? 93 VAL B CA 1 +ATOM 2349 C C . VAL B 2 93 ? 33.957 66.735 98.176 1.00 11.70 ? 93 VAL B C 1 +ATOM 2350 O O . VAL B 2 93 ? 34.220 67.690 97.438 1.00 12.47 ? 93 VAL B O 1 +ATOM 2351 C CB . VAL B 2 93 ? 35.113 64.633 97.244 1.00 11.15 ? 93 VAL B CB 1 +ATOM 2352 C CG1 . VAL B 2 93 ? 36.125 64.689 98.378 1.00 7.34 ? 93 VAL B CG1 1 +ATOM 2353 C CG2 . VAL B 2 93 ? 34.882 63.180 96.817 1.00 8.91 ? 93 VAL B CG2 1 +ATOM 2354 N N . TYR B 2 94 ? 33.770 66.872 99.468 1.00 11.25 ? 94 TYR B N 1 +ATOM 2355 C CA . TYR B 2 94 ? 33.900 68.159 100.097 1.00 11.88 ? 94 TYR B CA 1 +ATOM 2356 C C . TYR B 2 94 ? 35.180 68.154 100.917 1.00 12.82 ? 94 TYR B C 1 +ATOM 2357 O O . TYR B 2 94 ? 35.319 67.388 101.868 1.00 13.52 ? 94 TYR B O 1 +ATOM 2358 C CB . TYR B 2 94 ? 32.669 68.455 100.971 1.00 10.33 ? 94 TYR B CB 1 +ATOM 2359 C CG . TYR B 2 94 ? 31.474 68.786 100.136 1.00 7.95 ? 94 TYR B CG 1 +ATOM 2360 C CD1 . TYR B 2 94 ? 30.678 67.787 99.585 1.00 8.25 ? 94 TYR B CD1 1 +ATOM 2361 C CD2 . TYR B 2 94 ? 31.151 70.099 99.857 1.00 5.63 ? 94 TYR B CD2 1 +ATOM 2362 C CE1 . TYR B 2 94 ? 29.552 68.110 98.780 1.00 9.03 ? 94 TYR B CE1 1 +ATOM 2363 C CE2 . TYR B 2 94 ? 30.057 70.427 99.069 1.00 5.44 ? 94 TYR B CE2 1 +ATOM 2364 C CZ . TYR B 2 94 ? 29.256 69.444 98.540 1.00 7.51 ? 94 TYR B CZ 1 +ATOM 2365 O OH . TYR B 2 94 ? 28.192 69.807 97.746 1.00 8.14 ? 94 TYR B OH 1 +ATOM 2366 N N . TYR B 2 95 ? 36.115 69.007 100.532 1.00 13.74 ? 95 TYR B N 1 +ATOM 2367 C CA . TYR B 2 95 ? 37.300 69.215 101.337 1.00 14.66 ? 95 TYR B CA 1 +ATOM 2368 C C . TYR B 2 95 ? 37.174 70.476 102.147 1.00 15.88 ? 95 TYR B C 1 +ATOM 2369 O O . TYR B 2 95 ? 36.329 71.336 101.899 1.00 16.30 ? 95 TYR B O 1 +ATOM 2370 C CB . TYR B 2 95 ? 38.556 69.356 100.493 1.00 13.80 ? 95 TYR B CB 1 +ATOM 2371 C CG . TYR B 2 95 ? 38.788 68.259 99.517 1.00 12.55 ? 95 TYR B CG 1 +ATOM 2372 C CD1 . TYR B 2 95 ? 39.484 67.107 99.899 1.00 13.65 ? 95 TYR B CD1 1 +ATOM 2373 C CD2 . TYR B 2 95 ? 38.336 68.373 98.204 1.00 8.70 ? 95 TYR B CD2 1 +ATOM 2374 C CE1 . TYR B 2 95 ? 39.747 66.106 99.005 1.00 13.39 ? 95 TYR B CE1 1 +ATOM 2375 C CE2 . TYR B 2 95 ? 38.576 67.379 97.294 1.00 11.08 ? 95 TYR B CE2 1 +ATOM 2376 C CZ . TYR B 2 95 ? 39.294 66.250 97.700 1.00 14.02 ? 95 TYR B CZ 1 +ATOM 2377 O OH . TYR B 2 95 ? 39.516 65.240 96.817 1.00 15.41 ? 95 TYR B OH 1 +ATOM 2378 N N . CYS B 2 96 ? 38.085 70.585 103.093 1.00 16.56 ? 96 CYS B N 1 +ATOM 2379 C CA . CYS B 2 96 ? 38.123 71.674 104.004 1.00 17.42 ? 96 CYS B CA 1 +ATOM 2380 C C . CYS B 2 96 ? 39.569 72.010 103.884 1.00 15.96 ? 96 CYS B C 1 +ATOM 2381 O O . CYS B 2 96 ? 40.389 71.124 103.704 1.00 14.75 ? 96 CYS B O 1 +ATOM 2382 C CB . CYS B 2 96 ? 37.791 71.122 105.382 1.00 18.75 ? 96 CYS B CB 1 +ATOM 2383 S SG . CYS B 2 96 ? 38.119 72.208 106.790 1.00 26.61 ? 96 CYS B SG 1 +ATOM 2384 N N . SER B 2 97 ? 39.872 73.291 103.939 1.00 15.63 ? 97 SER B N 1 +ATOM 2385 C CA . SER B 2 97 ? 41.228 73.773 103.768 1.00 15.61 ? 97 SER B CA 1 +ATOM 2386 C C . SER B 2 97 ? 41.428 75.078 104.502 1.00 16.22 ? 97 SER B C 1 +ATOM 2387 O O . SER B 2 97 ? 40.478 75.802 104.822 1.00 16.00 ? 97 SER B O 1 +ATOM 2388 C CB . SER B 2 97 ? 41.544 73.973 102.285 1.00 16.22 ? 97 SER B CB 1 +ATOM 2389 O OG . SER B 2 97 ? 41.202 75.267 101.851 1.00 14.09 ? 97 SER B OG 1 +ATOM 2390 N N . ARG B 2 98 ? 42.676 75.390 104.774 1.00 16.62 ? 98 ARG B N 1 +ATOM 2391 C CA . ARG B 2 98 ? 42.948 76.650 105.398 1.00 17.11 ? 98 ARG B CA 1 +ATOM 2392 C C . ARG B 2 98 ? 43.899 77.413 104.559 1.00 18.50 ? 98 ARG B C 1 +ATOM 2393 O O . ARG B 2 98 ? 44.549 76.860 103.661 1.00 18.19 ? 98 ARG B O 1 +ATOM 2394 C CB . ARG B 2 98 ? 43.544 76.463 106.781 1.00 16.43 ? 98 ARG B CB 1 +ATOM 2395 C CG . ARG B 2 98 ? 44.841 75.765 106.781 1.00 15.10 ? 98 ARG B CG 1 +ATOM 2396 C CD . ARG B 2 98 ? 45.579 75.826 108.065 1.00 11.80 ? 98 ARG B CD 1 +ATOM 2397 N NE . ARG B 2 98 ? 46.969 76.056 107.750 1.00 13.13 ? 98 ARG B NE 1 +ATOM 2398 C CZ . ARG B 2 98 ? 47.935 76.095 108.645 1.00 17.33 ? 98 ARG B CZ 1 +ATOM 2399 N NH1 . ARG B 2 98 ? 47.669 75.885 109.932 1.00 17.39 ? 98 ARG B NH1 1 +ATOM 2400 N NH2 . ARG B 2 98 ? 49.182 76.324 108.252 1.00 17.59 ? 98 ARG B NH2 1 +ATOM 2401 N N . TRP B 2 99 ? 43.978 78.699 104.881 1.00 20.34 ? 99 TRP B N 1 +ATOM 2402 C CA . TRP B 2 99 ? 44.969 79.589 104.329 1.00 21.91 ? 99 TRP B CA 1 +ATOM 2403 C C . TRP B 2 99 ? 46.070 79.709 105.332 1.00 23.95 ? 99 TRP B C 1 +ATOM 2404 O O . TRP B 2 99 ? 46.513 80.806 105.658 1.00 26.60 ? 99 TRP B O 1 +ATOM 2405 C CB . TRP B 2 99 ? 44.355 80.949 104.123 1.00 20.66 ? 99 TRP B CB 1 +ATOM 2406 C CG . TRP B 2 99 ? 43.794 81.098 102.789 1.00 19.36 ? 99 TRP B CG 1 +ATOM 2407 C CD1 . TRP B 2 99 ? 43.956 80.251 101.737 1.00 15.79 ? 99 TRP B CD1 1 +ATOM 2408 C CD2 . TRP B 2 99 ? 42.977 82.166 102.328 1.00 16.50 ? 99 TRP B CD2 1 +ATOM 2409 N NE1 . TRP B 2 99 ? 43.306 80.740 100.636 1.00 15.17 ? 99 TRP B NE1 1 +ATOM 2410 C CE2 . TRP B 2 99 ? 42.684 81.912 100.973 1.00 16.09 ? 99 TRP B CE2 1 +ATOM 2411 C CE3 . TRP B 2 99 ? 42.477 83.328 102.916 1.00 15.46 ? 99 TRP B CE3 1 +ATOM 2412 C CZ2 . TRP B 2 99 ? 41.892 82.758 100.206 1.00 14.30 ? 99 TRP B CZ2 1 +ATOM 2413 C CZ3 . TRP B 2 99 ? 41.694 84.171 102.154 1.00 17.42 ? 99 TRP B CZ3 1 +ATOM 2414 C CH2 . TRP B 2 99 ? 41.415 83.885 100.807 1.00 15.84 ? 99 TRP B CH2 1 +ATOM 2415 N N . GLY B 2 100 ? 46.515 78.597 105.865 1.00 25.12 ? 100 GLY B N 1 +ATOM 2416 C CA . GLY B 2 100 ? 47.428 78.673 106.986 1.00 26.64 ? 100 GLY B CA 1 +ATOM 2417 C C . GLY B 2 100 ? 48.336 79.871 106.937 1.00 26.59 ? 100 GLY B C 1 +ATOM 2418 O O . GLY B 2 100 ? 49.087 80.015 105.995 1.00 27.67 ? 100 GLY B O 1 +ATOM 2419 N N . GLY B 2 101 ? 48.250 80.734 107.928 1.00 26.46 ? 101 GLY B N 1 +ATOM 2420 C CA . GLY B 2 101 ? 49.172 81.850 108.030 1.00 26.94 ? 101 GLY B CA 1 +ATOM 2421 C C . GLY B 2 101 ? 48.536 83.185 107.680 1.00 26.53 ? 101 GLY B C 1 +ATOM 2422 O O . GLY B 2 101 ? 47.625 83.251 106.849 1.00 25.79 ? 101 GLY B O 1 +ATOM 2423 N N . ASP B 2 102 ? 49.079 84.244 108.278 1.00 26.25 ? 102 ASP B N 1 +ATOM 2424 C CA . ASP B 2 102 ? 48.510 85.577 108.132 1.00 26.56 ? 102 ASP B CA 1 +ATOM 2425 C C . ASP B 2 102 ? 48.956 86.451 106.956 1.00 25.86 ? 102 ASP B C 1 +ATOM 2426 O O . ASP B 2 102 ? 48.384 87.533 106.760 1.00 27.49 ? 102 ASP B O 1 +ATOM 2427 C CB . ASP B 2 102 ? 48.550 86.380 109.447 1.00 26.55 ? 102 ASP B CB 1 +ATOM 2428 C CG . ASP B 2 102 ? 47.150 86.633 110.002 1.00 29.11 ? 102 ASP B CG 1 +ATOM 2429 O OD1 . ASP B 2 102 ? 46.165 86.116 109.363 1.00 32.01 ? 102 ASP B OD1 1 +ATOM 2430 O OD2 . ASP B 2 102 ? 46.926 87.323 111.040 1.00 27.98 ? 102 ASP B OD2 1 +ATOM 2431 N N . GLY B 2 103 ? 49.948 86.034 106.190 1.00 23.64 ? 103 GLY B N 1 +ATOM 2432 C CA . GLY B 2 103 ? 50.222 86.715 104.940 1.00 21.95 ? 103 GLY B CA 1 +ATOM 2433 C C . GLY B 2 103 ? 50.504 85.649 103.910 1.00 21.39 ? 103 GLY B C 1 +ATOM 2434 O O . GLY B 2 103 ? 51.449 85.713 103.112 1.00 21.11 ? 103 GLY B O 1 +ATOM 2435 N N . PHE B 2 104 ? 49.690 84.612 103.982 1.00 20.59 ? 104 PHE B N 1 +ATOM 2436 C CA . PHE B 2 104 ? 49.879 83.452 103.169 1.00 19.82 ? 104 PHE B CA 1 +ATOM 2437 C C . PHE B 2 104 ? 48.485 83.014 102.765 1.00 18.96 ? 104 PHE B C 1 +ATOM 2438 O O . PHE B 2 104 ? 47.811 82.326 103.508 1.00 19.13 ? 104 PHE B O 1 +ATOM 2439 C CB . PHE B 2 104 ? 50.581 82.399 103.993 1.00 20.05 ? 104 PHE B CB 1 +ATOM 2440 C CG . PHE B 2 104 ? 51.098 81.247 103.193 1.00 21.70 ? 104 PHE B CG 1 +ATOM 2441 C CD1 . PHE B 2 104 ? 52.221 81.390 102.379 1.00 23.21 ? 104 PHE B CD1 1 +ATOM 2442 C CD2 . PHE B 2 104 ? 50.482 80.019 103.262 1.00 22.58 ? 104 PHE B CD2 1 +ATOM 2443 C CE1 . PHE B 2 104 ? 52.717 80.327 101.649 1.00 24.01 ? 104 PHE B CE1 1 +ATOM 2444 C CE2 . PHE B 2 104 ? 50.980 78.942 102.542 1.00 25.09 ? 104 PHE B CE2 1 +ATOM 2445 C CZ . PHE B 2 104 ? 52.102 79.108 101.720 1.00 25.38 ? 104 PHE B CZ 1 +ATOM 2446 N N . TYR B 2 105 ? 48.031 83.465 101.609 1.00 17.63 ? 105 TYR B N 1 +ATOM 2447 C CA . TYR B 2 105 ? 46.645 83.234 101.257 1.00 17.31 ? 105 TYR B CA 1 +ATOM 2448 C C . TYR B 2 105 ? 46.495 82.196 100.175 1.00 17.68 ? 105 TYR B C 1 +ATOM 2449 O O . TYR B 2 105 ? 45.580 82.265 99.356 1.00 19.54 ? 105 TYR B O 1 +ATOM 2450 C CB . TYR B 2 105 ? 45.913 84.552 100.971 1.00 16.44 ? 105 TYR B CB 1 +ATOM 2451 C CG . TYR B 2 105 ? 46.058 85.550 102.156 1.00 15.78 ? 105 TYR B CG 1 +ATOM 2452 C CD1 . TYR B 2 105 ? 46.621 86.798 101.970 1.00 11.63 ? 105 TYR B CD1 1 +ATOM 2453 C CD2 . TYR B 2 105 ? 45.630 85.212 103.455 1.00 12.08 ? 105 TYR B CD2 1 +ATOM 2454 C CE1 . TYR B 2 105 ? 46.739 87.680 103.012 1.00 13.49 ? 105 TYR B CE1 1 +ATOM 2455 C CE2 . TYR B 2 105 ? 45.741 86.090 104.504 1.00 11.33 ? 105 TYR B CE2 1 +ATOM 2456 C CZ . TYR B 2 105 ? 46.303 87.334 104.299 1.00 13.27 ? 105 TYR B CZ 1 +ATOM 2457 O OH . TYR B 2 105 ? 46.462 88.253 105.360 1.00 9.68 ? 105 TYR B OH 1 +ATOM 2458 N N . ALA B 2 106 ? 47.389 81.213 100.230 1.00 17.17 ? 106 ALA B N 1 +ATOM 2459 C CA . ALA B 2 106 ? 47.309 79.977 99.482 1.00 16.70 ? 106 ALA B CA 1 +ATOM 2460 C C . ALA B 2 106 ? 46.903 78.877 100.463 1.00 16.99 ? 106 ALA B C 1 +ATOM 2461 O O . ALA B 2 106 ? 47.159 78.967 101.670 1.00 15.88 ? 106 ALA B O 1 +ATOM 2462 C CB . ALA B 2 106 ? 48.660 79.657 98.884 1.00 16.33 ? 106 ALA B CB 1 +ATOM 2463 N N . MET B 2 107 ? 46.278 77.832 99.935 1.00 17.12 ? 107 MET B N 1 +ATOM 2464 C CA . MET B 2 107 ? 45.690 76.814 100.781 1.00 17.31 ? 107 MET B CA 1 +ATOM 2465 C C . MET B 2 107 ? 46.714 75.737 101.025 1.00 17.11 ? 107 MET B C 1 +ATOM 2466 O O . MET B 2 107 ? 46.908 74.857 100.192 1.00 18.15 ? 107 MET B O 1 +ATOM 2467 C CB . MET B 2 107 ? 44.400 76.266 100.147 1.00 17.12 ? 107 MET B CB 1 +ATOM 2468 C CG . MET B 2 107 ? 43.303 77.305 100.041 1.00 16.93 ? 107 MET B CG 1 +ATOM 2469 S SD . MET B 2 107 ? 41.861 76.854 99.038 1.00 22.16 ? 107 MET B SD 1 +ATOM 2470 C CE . MET B 2 107 ? 40.926 78.458 99.059 1.00 20.82 ? 107 MET B CE 1 +ATOM 2471 N N . ASP B 2 108 ? 47.370 75.802 102.169 1.00 17.16 ? 108 ASP B N 1 +ATOM 2472 C CA . ASP B 2 108 ? 48.480 74.898 102.448 1.00 17.66 ? 108 ASP B CA 1 +ATOM 2473 C C . ASP B 2 108 ? 48.077 73.532 102.998 1.00 18.09 ? 108 ASP B C 1 +ATOM 2474 O O . ASP B 2 108 ? 48.793 72.565 102.797 1.00 18.87 ? 108 ASP B O 1 +ATOM 2475 C CB . ASP B 2 108 ? 49.509 75.559 103.355 1.00 17.37 ? 108 ASP B CB 1 +ATOM 2476 C CG . ASP B 2 108 ? 48.924 76.040 104.664 1.00 19.03 ? 108 ASP B CG 1 +ATOM 2477 O OD1 . ASP B 2 108 ? 47.689 75.982 104.836 1.00 20.42 ? 108 ASP B OD1 1 +ATOM 2478 O OD2 . ASP B 2 108 ? 49.627 76.481 105.599 1.00 19.62 ? 108 ASP B OD2 1 +ATOM 2479 N N . TYR B 2 109 ? 46.941 73.451 103.684 1.00 17.92 ? 109 TYR B N 1 +ATOM 2480 C CA . TYR B 2 109 ? 46.467 72.176 104.210 1.00 17.72 ? 109 TYR B CA 1 +ATOM 2481 C C . TYR B 2 109 ? 45.064 71.882 103.775 1.00 17.28 ? 109 TYR B C 1 +ATOM 2482 O O . TYR B 2 109 ? 44.265 72.785 103.592 1.00 17.23 ? 109 TYR B O 1 +ATOM 2483 C CB . TYR B 2 109 ? 46.577 72.104 105.734 1.00 17.99 ? 109 TYR B CB 1 +ATOM 2484 C CG . TYR B 2 109 ? 47.990 72.006 106.185 1.00 17.44 ? 109 TYR B CG 1 +ATOM 2485 C CD1 . TYR B 2 109 ? 48.688 73.137 106.515 1.00 20.06 ? 109 TYR B CD1 1 +ATOM 2486 C CD2 . TYR B 2 109 ? 48.637 70.784 106.268 1.00 18.63 ? 109 TYR B CD2 1 +ATOM 2487 C CE1 . TYR B 2 109 ? 50.013 73.073 106.938 1.00 20.60 ? 109 TYR B CE1 1 +ATOM 2488 C CE2 . TYR B 2 109 ? 49.965 70.699 106.664 1.00 19.97 ? 109 TYR B CE2 1 +ATOM 2489 C CZ . TYR B 2 109 ? 50.651 71.858 107.003 1.00 19.74 ? 109 TYR B CZ 1 +ATOM 2490 O OH . TYR B 2 109 ? 51.973 71.830 107.406 1.00 19.49 ? 109 TYR B OH 1 +ATOM 2491 N N . TRP B 2 110 ? 44.780 70.600 103.588 1.00 17.01 ? 110 TRP B N 1 +ATOM 2492 C CA . TRP B 2 110 ? 43.457 70.180 103.175 1.00 16.52 ? 110 TRP B CA 1 +ATOM 2493 C C . TRP B 2 110 ? 43.130 68.899 103.891 1.00 16.04 ? 110 TRP B C 1 +ATOM 2494 O O . TRP B 2 110 ? 43.970 68.084 104.045 1.00 15.23 ? 110 TRP B O 1 +ATOM 2495 C CB . TRP B 2 110 ? 43.431 69.877 101.688 1.00 16.21 ? 110 TRP B CB 1 +ATOM 2496 C CG . TRP B 2 110 ? 43.763 70.973 100.791 1.00 14.53 ? 110 TRP B CG 1 +ATOM 2497 C CD1 . TRP B 2 110 ? 44.927 71.671 100.742 1.00 15.84 ? 110 TRP B CD1 1 +ATOM 2498 C CD2 . TRP B 2 110 ? 42.955 71.463 99.733 1.00 12.31 ? 110 TRP B CD2 1 +ATOM 2499 N NE1 . TRP B 2 110 ? 44.890 72.584 99.718 1.00 14.68 ? 110 TRP B NE1 1 +ATOM 2500 C CE2 . TRP B 2 110 ? 43.681 72.484 99.088 1.00 13.44 ? 110 TRP B CE2 1 +ATOM 2501 C CE3 . TRP B 2 110 ? 41.674 71.156 99.272 1.00 12.78 ? 110 TRP B CE3 1 +ATOM 2502 C CZ2 . TRP B 2 110 ? 43.169 73.219 98.019 1.00 13.57 ? 110 TRP B CZ2 1 +ATOM 2503 C CZ3 . TRP B 2 110 ? 41.169 71.856 98.174 1.00 14.89 ? 110 TRP B CZ3 1 +ATOM 2504 C CH2 . TRP B 2 110 ? 41.922 72.886 97.568 1.00 15.01 ? 110 TRP B CH2 1 +ATOM 2505 N N . GLY B 2 111 ? 41.882 68.706 104.267 1.00 16.91 ? 111 GLY B N 1 +ATOM 2506 C CA . GLY B 2 111 ? 41.426 67.424 104.763 1.00 17.89 ? 111 GLY B CA 1 +ATOM 2507 C C . GLY B 2 111 ? 41.402 66.341 103.698 1.00 18.82 ? 111 GLY B C 1 +ATOM 2508 O O . GLY B 2 111 ? 41.697 66.594 102.552 1.00 17.92 ? 111 GLY B O 1 +ATOM 2509 N N . GLN B 2 112 ? 41.059 65.117 104.089 1.00 20.16 ? 112 GLN B N 1 +ATOM 2510 C CA . GLN B 2 112 ? 41.087 63.986 103.153 1.00 20.90 ? 112 GLN B CA 1 +ATOM 2511 C C . GLN B 2 112 ? 39.900 64.006 102.187 1.00 20.52 ? 112 GLN B C 1 +ATOM 2512 O O . GLN B 2 112 ? 39.989 63.433 101.128 1.00 20.68 ? 112 GLN B O 1 +ATOM 2513 C CB . GLN B 2 112 ? 41.132 62.669 103.929 1.00 21.38 ? 112 GLN B CB 1 +ATOM 2514 C CG . GLN B 2 112 ? 39.760 62.169 104.479 1.00 25.35 ? 112 GLN B CG 1 +ATOM 2515 C CD . GLN B 2 112 ? 39.299 62.873 105.779 1.00 30.68 ? 112 GLN B CD 1 +ATOM 2516 O OE1 . GLN B 2 112 ? 40.126 63.411 106.529 1.00 34.59 ? 112 GLN B OE1 1 +ATOM 2517 N NE2 . GLN B 2 112 ? 37.979 62.858 106.045 1.00 30.79 ? 112 GLN B NE2 1 +ATOM 2518 N N . GLY B 2 113 ? 38.812 64.680 102.584 1.00 20.63 ? 113 GLY B N 1 +ATOM 2519 C CA . GLY B 2 113 ? 37.545 64.783 101.864 1.00 20.11 ? 113 GLY B CA 1 +ATOM 2520 C C . GLY B 2 113 ? 36.448 63.853 102.383 1.00 20.40 ? 113 GLY B C 1 +ATOM 2521 O O . GLY B 2 113 ? 36.770 62.748 102.853 1.00 20.61 ? 113 GLY B O 1 +ATOM 2522 N N . THR B 2 114 ? 35.173 64.280 102.311 1.00 19.74 ? 114 THR B N 1 +ATOM 2523 C CA . THR B 2 114 ? 34.013 63.387 102.529 1.00 19.09 ? 114 THR B CA 1 +ATOM 2524 C C . THR B 2 114 ? 33.124 63.454 101.320 1.00 18.55 ? 114 THR B C 1 +ATOM 2525 O O . THR B 2 114 ? 32.743 64.548 100.900 1.00 18.49 ? 114 THR B O 1 +ATOM 2526 C CB . THR B 2 114 ? 33.096 63.754 103.749 1.00 19.23 ? 114 THR B CB 1 +ATOM 2527 O OG1 . THR B 2 114 ? 33.574 64.903 104.448 1.00 19.57 ? 114 THR B OG1 1 +ATOM 2528 C CG2 . THR B 2 114 ? 33.098 62.650 104.803 1.00 21.19 ? 114 THR B CG2 1 +ATOM 2529 N N . LEU B 2 115 ? 32.746 62.287 100.800 1.00 17.76 ? 115 LEU B N 1 +ATOM 2530 C CA . LEU B 2 115 ? 31.814 62.201 99.678 1.00 16.74 ? 115 LEU B CA 1 +ATOM 2531 C C . LEU B 2 115 ? 30.381 62.458 100.151 1.00 16.19 ? 115 LEU B C 1 +ATOM 2532 O O . LEU B 2 115 ? 29.885 61.742 101.041 1.00 17.22 ? 115 LEU B O 1 +ATOM 2533 C CB . LEU B 2 115 ? 31.913 60.824 99.001 1.00 16.36 ? 115 LEU B CB 1 +ATOM 2534 C CG . LEU B 2 115 ? 31.029 60.563 97.765 1.00 16.75 ? 115 LEU B CG 1 +ATOM 2535 C CD1 . LEU B 2 115 ? 31.330 61.480 96.581 1.00 16.68 ? 115 LEU B CD1 1 +ATOM 2536 C CD2 . LEU B 2 115 ? 31.082 59.114 97.309 1.00 17.13 ? 115 LEU B CD2 1 +ATOM 2537 N N . VAL B 2 116 ? 29.719 63.459 99.574 1.00 14.35 ? 116 VAL B N 1 +ATOM 2538 C CA . VAL B 2 116 ? 28.291 63.648 99.796 1.00 13.38 ? 116 VAL B CA 1 +ATOM 2539 C C . VAL B 2 116 ? 27.567 63.089 98.593 1.00 12.70 ? 116 VAL B C 1 +ATOM 2540 O O . VAL B 2 116 ? 27.848 63.468 97.487 1.00 13.45 ? 116 VAL B O 1 +ATOM 2541 C CB . VAL B 2 116 ? 27.915 65.133 99.966 1.00 12.88 ? 116 VAL B CB 1 +ATOM 2542 C CG1 . VAL B 2 116 ? 26.415 65.298 100.089 1.00 13.52 ? 116 VAL B CG1 1 +ATOM 2543 C CG2 . VAL B 2 116 ? 28.546 65.710 101.208 1.00 13.90 ? 116 VAL B CG2 1 +ATOM 2544 N N . THR B 2 117 ? 26.631 62.190 98.757 1.00 11.92 ? 117 THR B N 1 +ATOM 2545 C CA . THR B 2 117 ? 25.993 61.736 97.532 1.00 11.96 ? 117 THR B CA 1 +ATOM 2546 C C . THR B 2 117 ? 24.486 61.989 97.556 1.00 11.75 ? 117 THR B C 1 +ATOM 2547 O O . THR B 2 117 ? 23.762 61.385 98.344 1.00 11.82 ? 117 THR B O 1 +ATOM 2548 C CB . THR B 2 117 ? 26.428 60.274 97.081 1.00 12.10 ? 117 THR B CB 1 +ATOM 2549 O OG1 . THR B 2 117 ? 25.267 59.446 96.906 1.00 12.99 ? 117 THR B OG1 1 +ATOM 2550 C CG2 . THR B 2 117 ? 27.298 59.526 98.142 1.00 10.64 ? 117 THR B CG2 1 +ATOM 2551 N N . VAL B 2 118 ? 24.027 62.900 96.704 1.00 11.44 ? 118 VAL B N 1 +ATOM 2552 C CA . VAL B 2 118 ? 22.636 63.343 96.751 1.00 11.57 ? 118 VAL B CA 1 +ATOM 2553 C C . VAL B 2 118 ? 21.788 62.490 95.816 1.00 11.94 ? 118 VAL B C 1 +ATOM 2554 O O . VAL B 2 118 ? 21.995 62.472 94.604 1.00 12.12 ? 118 VAL B O 1 +ATOM 2555 C CB . VAL B 2 118 ? 22.528 64.837 96.443 1.00 11.55 ? 118 VAL B CB 1 +ATOM 2556 C CG1 . VAL B 2 118 ? 21.146 65.312 96.706 1.00 11.15 ? 118 VAL B CG1 1 +ATOM 2557 C CG2 . VAL B 2 118 ? 23.540 65.637 97.305 1.00 10.48 ? 118 VAL B CG2 1 +ATOM 2558 N N . SER B 2 119 ? 20.869 61.740 96.402 1.00 12.19 ? 119 SER B N 1 +ATOM 2559 C CA . SER B 2 119 ? 20.159 60.682 95.678 1.00 12.87 ? 119 SER B CA 1 +ATOM 2560 C C . SER B 2 119 ? 18.899 60.148 96.405 1.00 12.85 ? 119 SER B C 1 +ATOM 2561 O O . SER B 2 119 ? 18.835 60.145 97.639 1.00 12.78 ? 119 SER B O 1 +ATOM 2562 C CB . SER B 2 119 ? 21.113 59.536 95.341 1.00 12.47 ? 119 SER B CB 1 +ATOM 2563 O OG . SER B 2 119 ? 20.425 58.548 94.604 1.00 13.74 ? 119 SER B OG 1 +ATOM 2564 N N . SER B 2 120 ? 17.904 59.712 95.628 1.00 13.13 ? 120 SER B N 1 +ATOM 2565 C CA . SER B 2 120 ? 16.627 59.234 96.181 1.00 13.26 ? 120 SER B CA 1 +ATOM 2566 C C . SER B 2 120 ? 16.659 57.754 96.551 1.00 13.39 ? 120 SER B C 1 +ATOM 2567 O O . SER B 2 120 ? 15.846 57.296 97.345 1.00 13.86 ? 120 SER B O 1 +ATOM 2568 C CB . SER B 2 120 ? 15.437 59.577 95.258 1.00 13.16 ? 120 SER B CB 1 +ATOM 2569 O OG . SER B 2 120 ? 15.478 58.847 94.046 1.00 12.24 ? 120 SER B OG 1 +ATOM 2570 N N . ALA B 2 121 ? 17.616 57.029 95.979 1.00 13.79 ? 121 ALA B N 1 +ATOM 2571 C CA . ALA B 2 121 ? 17.906 55.629 96.299 1.00 13.97 ? 121 ALA B CA 1 +ATOM 2572 C C . ALA B 2 121 ? 18.300 55.450 97.758 1.00 14.10 ? 121 ALA B C 1 +ATOM 2573 O O . ALA B 2 121 ? 18.601 56.423 98.448 1.00 14.37 ? 121 ALA B O 1 +ATOM 2574 C CB . ALA B 2 121 ? 19.039 55.125 95.402 1.00 13.81 ? 121 ALA B CB 1 +ATOM 2575 N N . SER B 2 122 ? 18.322 54.205 98.226 1.00 14.33 ? 122 SER B N 1 +ATOM 2576 C CA . SER B 2 122 ? 18.747 53.949 99.603 1.00 14.36 ? 122 SER B CA 1 +ATOM 2577 C C . SER B 2 122 ? 19.970 53.039 99.764 1.00 13.75 ? 122 SER B C 1 +ATOM 2578 O O . SER B 2 122 ? 20.413 52.355 98.819 1.00 13.59 ? 122 SER B O 1 +ATOM 2579 C CB . SER B 2 122 ? 17.577 53.483 100.473 1.00 14.98 ? 122 SER B CB 1 +ATOM 2580 O OG . SER B 2 122 ? 17.515 52.082 100.492 1.00 16.66 ? 122 SER B OG 1 +ATOM 2581 N N . THR B 2 123 ? 20.518 53.079 100.978 1.00 12.87 ? 123 THR B N 1 +ATOM 2582 C CA . THR B 2 123 ? 21.747 52.403 101.326 1.00 11.74 ? 123 THR B CA 1 +ATOM 2583 C C . THR B 2 123 ? 21.558 50.910 101.160 1.00 11.98 ? 123 THR B C 1 +ATOM 2584 O O . THR B 2 123 ? 20.512 50.371 101.541 1.00 12.24 ? 123 THR B O 1 +ATOM 2585 C CB . THR B 2 123 ? 22.143 52.750 102.778 1.00 11.81 ? 123 THR B CB 1 +ATOM 2586 O OG1 . THR B 2 123 ? 22.278 54.177 102.928 1.00 9.98 ? 123 THR B OG1 1 +ATOM 2587 C CG2 . THR B 2 123 ? 23.543 52.181 103.132 1.00 10.92 ? 123 THR B CG2 1 +ATOM 2588 N N . LYS B 2 124 ? 22.560 50.276 100.545 1.00 11.88 ? 124 LYS B N 1 +ATOM 2589 C CA . LYS B 2 124 ? 22.697 48.835 100.443 1.00 12.18 ? 124 LYS B CA 1 +ATOM 2590 C C . LYS B 2 124 ? 24.149 48.493 100.738 1.00 12.72 ? 124 LYS B C 1 +ATOM 2591 O O . LYS B 2 124 ? 25.058 48.908 100.019 1.00 12.90 ? 124 LYS B O 1 +ATOM 2592 C CB . LYS B 2 124 ? 22.355 48.378 99.033 1.00 12.04 ? 124 LYS B CB 1 +ATOM 2593 C CG . LYS B 2 124 ? 22.013 46.906 98.876 1.00 13.36 ? 124 LYS B CG 1 +ATOM 2594 C CD . LYS B 2 124 ? 20.801 46.734 97.938 1.00 17.53 ? 124 LYS B CD 1 +ATOM 2595 C CE . LYS B 2 124 ? 20.220 45.316 98.019 1.00 21.07 ? 124 LYS B CE 1 +ATOM 2596 N NZ . LYS B 2 124 ? 18.742 45.331 98.312 1.00 21.77 ? 124 LYS B NZ 1 +ATOM 2597 N N . GLY B 2 125 ? 24.381 47.736 101.800 1.00 13.51 ? 125 GLY B N 1 +ATOM 2598 C CA . GLY B 2 125 ? 25.711 47.208 102.056 1.00 13.81 ? 125 GLY B CA 1 +ATOM 2599 C C . GLY B 2 125 ? 26.108 46.098 101.099 1.00 14.42 ? 125 GLY B C 1 +ATOM 2600 O O . GLY B 2 125 ? 25.225 45.378 100.550 1.00 14.31 ? 125 GLY B O 1 +ATOM 2601 N N . PRO B 2 126 ? 27.428 45.933 100.927 1.00 14.38 ? 126 PRO B N 1 +ATOM 2602 C CA . PRO B 2 126 ? 27.980 44.987 99.951 1.00 14.27 ? 126 PRO B CA 1 +ATOM 2603 C C . PRO B 2 126 ? 28.073 43.569 100.478 1.00 14.11 ? 126 PRO B C 1 +ATOM 2604 O O . PRO B 2 126 ? 28.211 43.364 101.663 1.00 14.56 ? 126 PRO B O 1 +ATOM 2605 C CB . PRO B 2 126 ? 29.403 45.504 99.726 1.00 13.82 ? 126 PRO B CB 1 +ATOM 2606 C CG . PRO B 2 126 ? 29.725 46.397 100.875 1.00 12.54 ? 126 PRO B CG 1 +ATOM 2607 C CD . PRO B 2 126 ? 28.498 46.599 101.697 1.00 14.23 ? 126 PRO B CD 1 +ATOM 2608 N N . SER B 2 127 ? 27.984 42.608 99.576 1.00 14.67 ? 127 SER B N 1 +ATOM 2609 C CA . SER B 2 127 ? 28.457 41.256 99.808 1.00 14.91 ? 127 SER B CA 1 +ATOM 2610 C C . SER B 2 127 ? 29.923 41.276 99.386 1.00 15.18 ? 127 SER B C 1 +ATOM 2611 O O . SER B 2 127 ? 30.285 41.990 98.430 1.00 16.17 ? 127 SER B O 1 +ATOM 2612 C CB . SER B 2 127 ? 27.701 40.266 98.919 1.00 15.20 ? 127 SER B CB 1 +ATOM 2613 O OG . SER B 2 127 ? 26.303 40.536 98.862 1.00 16.21 ? 127 SER B OG 1 +ATOM 2614 N N . VAL B 2 128 ? 30.765 40.520 100.094 1.00 14.26 ? 128 VAL B N 1 +ATOM 2615 C CA . VAL B 2 128 ? 32.184 40.448 99.778 1.00 13.18 ? 128 VAL B CA 1 +ATOM 2616 C C . VAL B 2 128 ? 32.540 39.001 99.524 1.00 12.55 ? 128 VAL B C 1 +ATOM 2617 O O . VAL B 2 128 ? 32.328 38.153 100.372 1.00 13.01 ? 128 VAL B O 1 +ATOM 2618 C CB . VAL B 2 128 ? 33.083 41.057 100.907 1.00 13.86 ? 128 VAL B CB 1 +ATOM 2619 C CG1 . VAL B 2 128 ? 34.570 41.187 100.454 1.00 12.65 ? 128 VAL B CG1 1 +ATOM 2620 C CG2 . VAL B 2 128 ? 32.536 42.425 101.367 1.00 11.81 ? 128 VAL B CG2 1 +ATOM 2621 N N . PHE B 2 129 ? 33.062 38.739 98.331 1.00 11.80 ? 129 PHE B N 1 +ATOM 2622 C CA . PHE B 2 129 ? 33.360 37.396 97.850 1.00 10.84 ? 129 PHE B CA 1 +ATOM 2623 C C . PHE B 2 129 ? 34.852 37.254 97.515 1.00 10.43 ? 129 PHE B C 1 +ATOM 2624 O O . PHE B 2 129 ? 35.497 38.208 97.087 1.00 10.22 ? 129 PHE B O 1 +ATOM 2625 C CB . PHE B 2 129 ? 32.541 37.095 96.589 1.00 11.13 ? 129 PHE B CB 1 +ATOM 2626 C CG . PHE B 2 129 ? 31.053 37.262 96.746 1.00 9.80 ? 129 PHE B CG 1 +ATOM 2627 C CD1 . PHE B 2 129 ? 30.369 38.176 95.966 1.00 8.25 ? 129 PHE B CD1 1 +ATOM 2628 C CD2 . PHE B 2 129 ? 30.325 36.463 97.619 1.00 11.15 ? 129 PHE B CD2 1 +ATOM 2629 C CE1 . PHE B 2 129 ? 28.991 38.330 96.085 1.00 8.40 ? 129 PHE B CE1 1 +ATOM 2630 C CE2 . PHE B 2 129 ? 28.928 36.616 97.735 1.00 10.16 ? 129 PHE B CE2 1 +ATOM 2631 C CZ . PHE B 2 129 ? 28.273 37.550 96.960 1.00 7.75 ? 129 PHE B CZ 1 +ATOM 2632 N N . PRO B 2 130 ? 35.428 36.079 97.710 1.00 10.12 ? 130 PRO B N 1 +ATOM 2633 C CA . PRO B 2 130 ? 36.862 35.958 97.502 1.00 10.03 ? 130 PRO B CA 1 +ATOM 2634 C C . PRO B 2 130 ? 37.160 35.631 96.047 1.00 10.01 ? 130 PRO B C 1 +ATOM 2635 O O . PRO B 2 130 ? 36.404 34.925 95.368 1.00 9.22 ? 130 PRO B O 1 +ATOM 2636 C CB . PRO B 2 130 ? 37.254 34.802 98.456 1.00 9.71 ? 130 PRO B CB 1 +ATOM 2637 C CG . PRO B 2 130 ? 36.078 33.902 98.428 1.00 9.39 ? 130 PRO B CG 1 +ATOM 2638 C CD . PRO B 2 130 ? 34.843 34.795 98.142 1.00 9.90 ? 130 PRO B CD 1 +ATOM 2639 N N . LEU B 2 131 ? 38.277 36.162 95.584 1.00 10.26 ? 131 LEU B N 1 +ATOM 2640 C CA . LEU B 2 131 ? 38.792 35.798 94.299 1.00 10.92 ? 131 LEU B CA 1 +ATOM 2641 C C . LEU B 2 131 ? 39.951 34.860 94.595 1.00 11.16 ? 131 LEU B C 1 +ATOM 2642 O O . LEU B 2 131 ? 41.050 35.278 94.944 1.00 10.77 ? 131 LEU B O 1 +ATOM 2643 C CB . LEU B 2 131 ? 39.256 37.048 93.583 1.00 11.73 ? 131 LEU B CB 1 +ATOM 2644 C CG . LEU B 2 131 ? 38.192 38.079 93.211 1.00 12.19 ? 131 LEU B CG 1 +ATOM 2645 C CD1 . LEU B 2 131 ? 38.905 39.382 92.841 1.00 12.35 ? 131 LEU B CD1 1 +ATOM 2646 C CD2 . LEU B 2 131 ? 37.342 37.601 92.058 1.00 11.29 ? 131 LEU B CD2 1 +ATOM 2647 N N . ALA B 2 132 ? 39.679 33.571 94.480 1.00 11.62 ? 132 ALA B N 1 +ATOM 2648 C CA . ALA B 2 132 ? 40.589 32.581 94.998 1.00 11.98 ? 132 ALA B CA 1 +ATOM 2649 C C . ALA B 2 132 ? 41.766 32.462 94.061 1.00 12.88 ? 132 ALA B C 1 +ATOM 2650 O O . ALA B 2 132 ? 41.564 32.405 92.841 1.00 13.37 ? 132 ALA B O 1 +ATOM 2651 C CB . ALA B 2 132 ? 39.889 31.268 95.147 1.00 11.29 ? 132 ALA B CB 1 +ATOM 2652 N N . PRO B 2 133 ? 42.988 32.465 94.615 1.00 13.60 ? 133 PRO B N 1 +ATOM 2653 C CA . PRO B 2 133 ? 44.195 32.121 93.849 1.00 14.06 ? 133 PRO B CA 1 +ATOM 2654 C C . PRO B 2 133 ? 44.196 30.649 93.426 1.00 14.98 ? 133 PRO B C 1 +ATOM 2655 O O . PRO B 2 133 ? 43.648 29.787 94.137 1.00 14.74 ? 133 PRO B O 1 +ATOM 2656 C CB . PRO B 2 133 ? 45.319 32.375 94.848 1.00 14.03 ? 133 PRO B CB 1 +ATOM 2657 C CG . PRO B 2 133 ? 44.671 32.185 96.178 1.00 13.16 ? 133 PRO B CG 1 +ATOM 2658 C CD . PRO B 2 133 ? 43.315 32.804 96.013 1.00 13.30 ? 133 PRO B CD 1 +ATOM 2659 N N . SER B 2 134 ? 44.803 30.377 92.272 1.00 16.12 ? 134 SER B N 1 +ATOM 2660 C CA . SER B 2 134 ? 44.869 29.025 91.704 1.00 17.43 ? 134 SER B CA 1 +ATOM 2661 C C . SER B 2 134 ? 45.810 29.048 90.508 1.00 17.93 ? 134 SER B C 1 +ATOM 2662 O O . SER B 2 134 ? 46.370 30.107 90.186 1.00 17.77 ? 134 SER B O 1 +ATOM 2663 C CB . SER B 2 134 ? 43.479 28.573 91.236 1.00 17.69 ? 134 SER B CB 1 +ATOM 2664 O OG . SER B 2 134 ? 42.944 29.484 90.274 1.00 18.75 ? 134 SER B OG 1 +ATOM 2665 N N . SER B 2 135 ? 45.961 27.895 89.840 1.00 18.71 ? 135 SER B N 1 +ATOM 2666 C CA . SER B 2 135 ? 46.751 27.790 88.595 1.00 19.18 ? 135 SER B CA 1 +ATOM 2667 C C . SER B 2 135 ? 46.411 28.878 87.533 1.00 19.68 ? 135 SER B C 1 +ATOM 2668 O O . SER B 2 135 ? 47.298 29.409 86.856 1.00 19.33 ? 135 SER B O 1 +ATOM 2669 C CB . SER B 2 135 ? 46.600 26.401 87.991 1.00 18.78 ? 135 SER B CB 1 +ATOM 2670 O OG . SER B 2 135 ? 45.311 26.247 87.422 1.00 18.69 ? 135 SER B OG 1 +ATOM 2671 N N . LYS B 2 136 ? 45.127 29.219 87.425 1.00 20.53 ? 136 LYS B N 1 +ATOM 2672 C CA . LYS B 2 136 ? 44.635 30.134 86.394 1.00 21.17 ? 136 LYS B CA 1 +ATOM 2673 C C . LYS B 2 136 ? 44.836 31.607 86.792 1.00 21.88 ? 136 LYS B C 1 +ATOM 2674 O O . LYS B 2 136 ? 44.574 32.526 86.004 1.00 21.65 ? 136 LYS B O 1 +ATOM 2675 C CB . LYS B 2 136 ? 43.164 29.815 86.063 1.00 21.30 ? 136 LYS B CB 1 +ATOM 2676 C CG . LYS B 2 136 ? 42.893 28.364 85.596 1.00 20.88 ? 136 LYS B CG 1 +ATOM 2677 C CD . LYS B 2 136 ? 42.760 28.277 84.091 1.00 21.21 ? 136 LYS B CD 1 +ATOM 2678 C CE . LYS B 2 136 ? 43.623 27.165 83.507 1.00 23.01 ? 136 LYS B CE 1 +ATOM 2679 N NZ . LYS B 2 136 ? 44.781 27.699 82.722 1.00 22.66 ? 136 LYS B NZ 1 +ATOM 2680 N N . SER B 2 137 ? 45.316 31.821 88.016 1.00 22.63 ? 137 SER B N 1 +ATOM 2681 C CA . SER B 2 137 ? 45.788 33.134 88.435 1.00 23.85 ? 137 SER B CA 1 +ATOM 2682 C C . SER B 2 137 ? 47.249 33.119 88.906 1.00 24.06 ? 137 SER B C 1 +ATOM 2683 O O . SER B 2 137 ? 47.642 33.928 89.754 1.00 24.47 ? 137 SER B O 1 +ATOM 2684 C CB . SER B 2 137 ? 44.851 33.798 89.477 1.00 24.10 ? 137 SER B CB 1 +ATOM 2685 O OG . SER B 2 137 ? 44.785 33.076 90.701 1.00 26.10 ? 137 SER B OG 1 +ATOM 2686 N N . THR B 2 138 ? 48.052 32.209 88.349 1.00 24.04 ? 138 THR B N 1 +ATOM 2687 C CA . THR B 2 138 ? 49.495 32.216 88.604 1.00 24.00 ? 138 THR B CA 1 +ATOM 2688 C C . THR B 2 138 ? 50.328 32.301 87.322 1.00 23.71 ? 138 THR B C 1 +ATOM 2689 O O . THR B 2 138 ? 50.144 31.518 86.408 1.00 23.93 ? 138 THR B O 1 +ATOM 2690 C CB . THR B 2 138 ? 49.954 31.022 89.508 1.00 23.91 ? 138 THR B CB 1 +ATOM 2691 O OG1 . THR B 2 138 ? 49.575 29.773 88.920 1.00 24.50 ? 138 THR B OG1 1 +ATOM 2692 C CG2 . THR B 2 138 ? 49.220 31.022 90.847 1.00 24.16 ? 138 THR B CG2 1 +ATOM 2693 N N . SER B 2 139 ? 51.217 33.286 87.264 1.00 23.73 ? 139 SER B N 1 +ATOM 2694 C CA . SER B 2 139 ? 52.205 33.409 86.184 1.00 23.56 ? 139 SER B CA 1 +ATOM 2695 C C . SER B 2 139 ? 53.588 33.588 86.805 1.00 22.72 ? 139 SER B C 1 +ATOM 2696 O O . SER B 2 139 ? 53.813 34.520 87.595 1.00 22.76 ? 139 SER B O 1 +ATOM 2697 C CB . SER B 2 139 ? 51.888 34.605 85.262 1.00 23.70 ? 139 SER B CB 1 +ATOM 2698 O OG . SER B 2 139 ? 51.482 35.747 86.014 1.00 24.74 ? 139 SER B OG 1 +ATOM 2699 N N . GLY B 2 140 ? 54.510 32.701 86.448 1.00 21.77 ? 140 GLY B N 1 +ATOM 2700 C CA . GLY B 2 140 ? 55.816 32.681 87.078 1.00 20.47 ? 140 GLY B CA 1 +ATOM 2701 C C . GLY B 2 140 ? 55.662 32.262 88.532 1.00 19.59 ? 140 GLY B C 1 +ATOM 2702 O O . GLY B 2 140 ? 54.858 31.370 88.853 1.00 19.56 ? 140 GLY B O 1 +ATOM 2703 N N . GLY B 2 141 ? 56.404 32.913 89.425 1.00 18.24 ? 141 GLY B N 1 +ATOM 2704 C CA . GLY B 2 141 ? 56.323 32.562 90.835 1.00 16.48 ? 141 GLY B CA 1 +ATOM 2705 C C . GLY B 2 141 ? 55.258 33.340 91.575 1.00 14.91 ? 141 GLY B C 1 +ATOM 2706 O O . GLY B 2 141 ? 55.360 33.532 92.782 1.00 14.77 ? 141 GLY B O 1 +ATOM 2707 N N . THR B 2 142 ? 54.233 33.777 90.850 1.00 13.66 ? 142 THR B N 1 +ATOM 2708 C CA . THR B 2 142 ? 53.310 34.784 91.356 1.00 12.51 ? 142 THR B CA 1 +ATOM 2709 C C . THR B 2 142 ? 51.821 34.469 91.267 1.00 11.36 ? 142 THR B C 1 +ATOM 2710 O O . THR B 2 142 ? 51.317 34.075 90.216 1.00 10.92 ? 142 THR B O 1 +ATOM 2711 C CB . THR B 2 142 ? 53.588 36.104 90.665 1.00 12.60 ? 142 THR B CB 1 +ATOM 2712 O OG1 . THR B 2 142 ? 54.752 36.661 91.259 1.00 13.83 ? 142 THR B OG1 1 +ATOM 2713 C CG2 . THR B 2 142 ? 52.497 37.127 91.014 1.00 12.36 ? 142 THR B CG2 1 +ATOM 2714 N N . ALA B 2 143 ? 51.126 34.692 92.374 1.00 10.02 ? 143 ALA B N 1 +ATOM 2715 C CA . ALA B 2 143 ? 49.703 34.450 92.420 1.00 10.00 ? 143 ALA B CA 1 +ATOM 2716 C C . ALA B 2 143 ? 48.924 35.756 92.547 1.00 9.67 ? 143 ALA B C 1 +ATOM 2717 O O . ALA B 2 143 ? 49.334 36.675 93.233 1.00 10.66 ? 143 ALA B O 1 +ATOM 2718 C CB . ALA B 2 143 ? 49.352 33.481 93.552 1.00 8.88 ? 143 ALA B CB 1 +ATOM 2719 N N . ALA B 2 144 ? 47.794 35.829 91.877 1.00 9.39 ? 144 ALA B N 1 +ATOM 2720 C CA . ALA B 2 144 ? 46.914 36.962 92.039 1.00 9.96 ? 144 ALA B CA 1 +ATOM 2721 C C . ALA B 2 144 ? 45.739 36.460 92.798 1.00 10.15 ? 144 ALA B C 1 +ATOM 2722 O O . ALA B 2 144 ? 45.249 35.342 92.526 1.00 10.82 ? 144 ALA B O 1 +ATOM 2723 C CB . ALA B 2 144 ? 46.460 37.517 90.676 1.00 9.53 ? 144 ALA B CB 1 +ATOM 2724 N N . LEU B 2 145 ? 45.300 37.276 93.749 1.00 9.88 ? 145 LEU B N 1 +ATOM 2725 C CA . LEU B 2 145 ? 44.086 37.024 94.491 1.00 10.04 ? 145 LEU B CA 1 +ATOM 2726 C C . LEU B 2 145 ? 43.457 38.366 94.814 1.00 10.40 ? 145 LEU B C 1 +ATOM 2727 O O . LEU B 2 145 ? 44.026 39.406 94.518 1.00 9.72 ? 145 LEU B O 1 +ATOM 2728 C CB . LEU B 2 145 ? 44.401 36.252 95.767 1.00 11.16 ? 145 LEU B CB 1 +ATOM 2729 C CG . LEU B 2 145 ? 45.475 36.695 96.788 1.00 11.00 ? 145 LEU B CG 1 +ATOM 2730 C CD1 . LEU B 2 145 ? 44.988 37.827 97.630 1.00 10.40 ? 145 LEU B CD1 1 +ATOM 2731 C CD2 . LEU B 2 145 ? 45.778 35.542 97.693 1.00 11.59 ? 145 LEU B CD2 1 +ATOM 2732 N N . GLY B 2 146 ? 42.273 38.343 95.420 1.00 11.17 ? 146 GLY B N 1 +ATOM 2733 C CA . GLY B 2 146 ? 41.526 39.559 95.627 1.00 11.66 ? 146 GLY B CA 1 +ATOM 2734 C C . GLY B 2 146 ? 40.159 39.310 96.217 1.00 12.80 ? 146 GLY B C 1 +ATOM 2735 O O . GLY B 2 146 ? 39.827 38.184 96.606 1.00 12.62 ? 146 GLY B O 1 +ATOM 2736 N N . CYS B 2 147 ? 39.380 40.387 96.281 1.00 13.11 ? 147 CYS B N 1 +ATOM 2737 C CA . CYS B 2 147 ? 38.042 40.385 96.828 1.00 14.37 ? 147 CYS B CA 1 +ATOM 2738 C C . CYS B 2 147 ? 37.124 41.101 95.863 1.00 13.93 ? 147 CYS B C 1 +ATOM 2739 O O . CYS B 2 147 ? 37.471 42.128 95.305 1.00 14.66 ? 147 CYS B O 1 +ATOM 2740 C CB . CYS B 2 147 ? 38.004 41.098 98.192 1.00 15.30 ? 147 CYS B CB 1 +ATOM 2741 S SG . CYS B 2 147 ? 38.520 39.974 99.525 1.00 20.09 ? 147 CYS B SG 1 +ATOM 2742 N N . LEU B 2 148 ? 35.946 40.544 95.665 1.00 13.19 ? 148 LEU B N 1 +ATOM 2743 C CA . LEU B 2 148 ? 34.911 41.208 94.926 1.00 12.23 ? 148 LEU B CA 1 +ATOM 2744 C C . LEU B 2 148 ? 33.979 41.824 95.976 1.00 12.09 ? 148 LEU B C 1 +ATOM 2745 O O . LEU B 2 148 ? 33.594 41.197 96.987 1.00 11.44 ? 148 LEU B O 1 +ATOM 2746 C CB . LEU B 2 148 ? 34.190 40.206 94.023 1.00 11.92 ? 148 LEU B CB 1 +ATOM 2747 C CG . LEU B 2 148 ? 32.998 40.599 93.163 1.00 11.23 ? 148 LEU B CG 1 +ATOM 2748 C CD1 . LEU B 2 148 ? 33.408 41.308 91.950 1.00 11.51 ? 148 LEU B CD1 1 +ATOM 2749 C CD2 . LEU B 2 148 ? 32.255 39.364 92.771 1.00 13.51 ? 148 LEU B CD2 1 +ATOM 2750 N N . VAL B 2 149 ? 33.639 43.069 95.746 1.00 11.04 ? 149 VAL B N 1 +ATOM 2751 C CA . VAL B 2 149 ? 32.819 43.758 96.698 1.00 11.16 ? 149 VAL B CA 1 +ATOM 2752 C C . VAL B 2 149 ? 31.623 44.114 95.880 1.00 11.82 ? 149 VAL B C 1 +ATOM 2753 O O . VAL B 2 149 ? 31.688 45.022 95.081 1.00 11.90 ? 149 VAL B O 1 +ATOM 2754 C CB . VAL B 2 149 ? 33.527 45.006 97.259 1.00 10.64 ? 149 VAL B CB 1 +ATOM 2755 C CG1 . VAL B 2 149 ? 32.593 45.769 98.178 1.00 9.36 ? 149 VAL B CG1 1 +ATOM 2756 C CG2 . VAL B 2 149 ? 34.831 44.612 97.982 1.00 7.97 ? 149 VAL B CG2 1 +ATOM 2757 N N . LYS B 2 150 ? 30.551 43.353 96.054 1.00 12.54 ? 150 LYS B N 1 +ATOM 2758 C CA . LYS B 2 150 ? 29.405 43.439 95.169 1.00 13.19 ? 150 LYS B CA 1 +ATOM 2759 C C . LYS B 2 150 ? 28.224 44.101 95.844 1.00 13.68 ? 150 LYS B C 1 +ATOM 2760 O O . LYS B 2 150 ? 28.012 43.929 97.038 1.00 14.09 ? 150 LYS B O 1 +ATOM 2761 C CB . LYS B 2 150 ? 28.990 42.032 94.729 1.00 12.84 ? 150 LYS B CB 1 +ATOM 2762 C CG . LYS B 2 150 ? 28.839 41.895 93.240 1.00 13.39 ? 150 LYS B CG 1 +ATOM 2763 C CD . LYS B 2 150 ? 27.487 41.345 92.869 1.00 14.96 ? 150 LYS B CD 1 +ATOM 2764 C CE . LYS B 2 150 ? 27.264 41.434 91.354 1.00 16.57 ? 150 LYS B CE 1 +ATOM 2765 N NZ . LYS B 2 150 ? 25.825 41.252 90.979 1.00 18.41 ? 150 LYS B NZ 1 +ATOM 2766 N N . ASP B 2 151 ? 27.462 44.848 95.055 1.00 14.21 ? 151 ASP B N 1 +ATOM 2767 C CA . ASP B 2 151 ? 26.097 45.265 95.377 1.00 14.36 ? 151 ASP B CA 1 +ATOM 2768 C C . ASP B 2 151 ? 25.967 46.241 96.550 1.00 14.23 ? 151 ASP B C 1 +ATOM 2769 O O . ASP B 2 151 ? 25.339 45.922 97.589 1.00 13.81 ? 151 ASP B O 1 +ATOM 2770 C CB . ASP B 2 151 ? 25.192 44.049 95.566 1.00 14.83 ? 151 ASP B CB 1 +ATOM 2771 C CG . ASP B 2 151 ? 24.884 43.341 94.258 1.00 17.46 ? 151 ASP B CG 1 +ATOM 2772 O OD1 . ASP B 2 151 ? 25.020 43.978 93.176 1.00 20.66 ? 151 ASP B OD1 1 +ATOM 2773 O OD2 . ASP B 2 151 ? 24.497 42.146 94.221 1.00 18.13 ? 151 ASP B OD2 1 +ATOM 2774 N N . TYR B 2 152 ? 26.533 47.437 96.365 1.00 13.46 ? 152 TYR B N 1 +ATOM 2775 C CA . TYR B 2 152 ? 26.479 48.445 97.407 1.00 12.64 ? 152 TYR B CA 1 +ATOM 2776 C C . TYR B 2 152 ? 26.149 49.816 96.868 1.00 12.48 ? 152 TYR B C 1 +ATOM 2777 O O . TYR B 2 152 ? 26.530 50.174 95.769 1.00 12.49 ? 152 TYR B O 1 +ATOM 2778 C CB . TYR B 2 152 ? 27.787 48.468 98.210 1.00 12.74 ? 152 TYR B CB 1 +ATOM 2779 C CG . TYR B 2 152 ? 28.940 49.081 97.464 1.00 10.59 ? 152 TYR B CG 1 +ATOM 2780 C CD1 . TYR B 2 152 ? 29.189 50.436 97.555 1.00 8.68 ? 152 TYR B CD1 1 +ATOM 2781 C CD2 . TYR B 2 152 ? 29.784 48.302 96.674 1.00 10.67 ? 152 TYR B CD2 1 +ATOM 2782 C CE1 . TYR B 2 152 ? 30.212 51.019 96.861 1.00 8.94 ? 152 TYR B CE1 1 +ATOM 2783 C CE2 . TYR B 2 152 ? 30.839 48.876 95.976 1.00 10.99 ? 152 TYR B CE2 1 +ATOM 2784 C CZ . TYR B 2 152 ? 31.038 50.254 96.071 1.00 9.95 ? 152 TYR B CZ 1 +ATOM 2785 O OH . TYR B 2 152 ? 32.082 50.882 95.415 1.00 10.97 ? 152 TYR B OH 1 +ATOM 2786 N N . PHE B 2 153 ? 25.430 50.580 97.670 1.00 12.19 ? 153 PHE B N 1 +ATOM 2787 C CA . PHE B 2 153 ? 25.148 51.953 97.371 1.00 12.32 ? 153 PHE B CA 1 +ATOM 2788 C C . PHE B 2 153 ? 25.185 52.644 98.710 1.00 12.47 ? 153 PHE B C 1 +ATOM 2789 O O . PHE B 2 153 ? 24.820 52.017 99.702 1.00 12.93 ? 153 PHE B O 1 +ATOM 2790 C CB . PHE B 2 153 ? 23.751 52.082 96.762 1.00 12.61 ? 153 PHE B CB 1 +ATOM 2791 C CG . PHE B 2 153 ? 23.492 53.425 96.144 1.00 13.15 ? 153 PHE B CG 1 +ATOM 2792 C CD1 . PHE B 2 153 ? 22.940 54.452 96.891 1.00 14.27 ? 153 PHE B CD1 1 +ATOM 2793 C CD2 . PHE B 2 153 ? 23.847 53.671 94.825 1.00 14.29 ? 153 PHE B CD2 1 +ATOM 2794 C CE1 . PHE B 2 153 ? 22.715 55.714 96.321 1.00 16.47 ? 153 PHE B CE1 1 +ATOM 2795 C CE2 . PHE B 2 153 ? 23.640 54.914 94.240 1.00 15.91 ? 153 PHE B CE2 1 +ATOM 2796 C CZ . PHE B 2 153 ? 23.064 55.949 94.986 1.00 17.23 ? 153 PHE B CZ 1 +ATOM 2797 N N . PRO B 2 154 ? 25.651 53.893 98.784 1.00 12.16 ? 154 PRO B N 1 +ATOM 2798 C CA . PRO B 2 154 ? 26.394 54.564 97.726 1.00 12.17 ? 154 PRO B CA 1 +ATOM 2799 C C . PRO B 2 154 ? 27.901 54.362 97.895 1.00 12.86 ? 154 PRO B C 1 +ATOM 2800 O O . PRO B 2 154 ? 28.326 53.555 98.698 1.00 12.38 ? 154 PRO B O 1 +ATOM 2801 C CB . PRO B 2 154 ? 26.087 56.019 98.022 1.00 12.06 ? 154 PRO B CB 1 +ATOM 2802 C CG . PRO B 2 154 ? 26.102 56.070 99.521 1.00 10.98 ? 154 PRO B CG 1 +ATOM 2803 C CD . PRO B 2 154 ? 25.431 54.793 99.931 1.00 12.11 ? 154 PRO B CD 1 +ATOM 2804 N N . GLU B 2 155 ? 28.689 55.128 97.151 1.00 13.75 ? 155 GLU B N 1 +ATOM 2805 C CA . GLU B 2 155 ? 30.142 55.180 97.293 1.00 15.28 ? 155 GLU B CA 1 +ATOM 2806 C C . GLU B 2 155 ? 30.429 55.856 98.660 1.00 14.39 ? 155 GLU B C 1 +ATOM 2807 O O . GLU B 2 155 ? 29.551 56.512 99.183 1.00 14.30 ? 155 GLU B O 1 +ATOM 2808 C CB . GLU B 2 155 ? 30.676 55.954 96.067 1.00 15.55 ? 155 GLU B CB 1 +ATOM 2809 C CG . GLU B 2 155 ? 32.071 55.604 95.483 1.00 23.36 ? 155 GLU B CG 1 +ATOM 2810 C CD . GLU B 2 155 ? 32.427 54.111 95.426 1.00 28.15 ? 155 GLU B CD 1 +ATOM 2811 O OE1 . GLU B 2 155 ? 31.527 53.302 95.192 1.00 31.97 ? 155 GLU B OE1 1 +ATOM 2812 O OE2 . GLU B 2 155 ? 33.610 53.740 95.626 1.00 31.52 ? 155 GLU B OE2 1 +ATOM 2813 N N . PRO B 2 156 ? 31.598 55.701 99.279 1.00 14.64 ? 156 PRO B N 1 +ATOM 2814 C CA . PRO B 2 156 ? 32.733 54.940 98.774 1.00 15.52 ? 156 PRO B CA 1 +ATOM 2815 C C . PRO B 2 156 ? 32.950 53.609 99.529 1.00 16.39 ? 156 PRO B C 1 +ATOM 2816 O O . PRO B 2 156 ? 32.432 53.391 100.613 1.00 16.78 ? 156 PRO B O 1 +ATOM 2817 C CB . PRO B 2 156 ? 33.882 55.885 99.099 1.00 14.82 ? 156 PRO B CB 1 +ATOM 2818 C CG . PRO B 2 156 ? 33.471 56.446 100.464 1.00 14.06 ? 156 PRO B CG 1 +ATOM 2819 C CD . PRO B 2 156 ? 31.954 56.338 100.560 1.00 14.47 ? 156 PRO B CD 1 +ATOM 2820 N N . VAL B 2 157 ? 33.746 52.722 98.961 1.00 17.37 ? 157 VAL B N 1 +ATOM 2821 C CA . VAL B 2 157 ? 34.140 51.536 99.704 1.00 17.64 ? 157 VAL B CA 1 +ATOM 2822 C C . VAL B 2 157 ? 35.616 51.683 100.051 1.00 17.18 ? 157 VAL B C 1 +ATOM 2823 O O . VAL B 2 157 ? 36.333 52.423 99.413 1.00 17.84 ? 157 VAL B O 1 +ATOM 2824 C CB . VAL B 2 157 ? 33.799 50.247 98.938 1.00 17.12 ? 157 VAL B CB 1 +ATOM 2825 C CG1 . VAL B 2 157 ? 34.820 49.188 99.186 1.00 19.18 ? 157 VAL B CG1 1 +ATOM 2826 C CG2 . VAL B 2 157 ? 32.462 49.736 99.422 1.00 17.39 ? 157 VAL B CG2 1 +ATOM 2827 N N . THR B 2 158 ? 36.047 51.040 101.108 1.00 17.11 ? 158 THR B N 1 +ATOM 2828 C CA . THR B 2 158 ? 37.443 51.050 101.454 1.00 17.11 ? 158 THR B CA 1 +ATOM 2829 C C . THR B 2 158 ? 37.897 49.577 101.561 1.00 16.72 ? 158 THR B C 1 +ATOM 2830 O O . THR B 2 158 ? 37.305 48.775 102.324 1.00 16.66 ? 158 THR B O 1 +ATOM 2831 C CB . THR B 2 158 ? 37.579 51.893 102.739 1.00 17.36 ? 158 THR B CB 1 +ATOM 2832 O OG1 . THR B 2 158 ? 38.185 53.159 102.407 1.00 17.74 ? 158 THR B OG1 1 +ATOM 2833 C CG2 . THR B 2 158 ? 38.528 51.288 103.733 1.00 19.45 ? 158 THR B CG2 1 +ATOM 2834 N N . VAL B 2 159 ? 38.890 49.193 100.766 1.00 15.27 ? 159 VAL B N 1 +ATOM 2835 C CA . VAL B 2 159 ? 39.499 47.864 100.943 1.00 14.44 ? 159 VAL B CA 1 +ATOM 2836 C C . VAL B 2 159 ? 40.942 48.014 101.368 1.00 14.41 ? 159 VAL B C 1 +ATOM 2837 O O . VAL B 2 159 ? 41.672 48.803 100.780 1.00 14.73 ? 159 VAL B O 1 +ATOM 2838 C CB . VAL B 2 159 ? 39.474 46.996 99.658 1.00 13.86 ? 159 VAL B CB 1 +ATOM 2839 C CG1 . VAL B 2 159 ? 40.138 45.727 99.910 1.00 11.85 ? 159 VAL B CG1 1 +ATOM 2840 C CG2 . VAL B 2 159 ? 38.068 46.702 99.230 1.00 14.15 ? 159 VAL B CG2 1 +ATOM 2841 N N . SER B 2 160 ? 41.365 47.252 102.370 1.00 14.02 ? 160 SER B N 1 +ATOM 2842 C CA . SER B 2 160 ? 42.794 47.074 102.630 1.00 13.67 ? 160 SER B CA 1 +ATOM 2843 C C . SER B 2 160 ? 43.107 45.585 102.732 1.00 13.44 ? 160 SER B C 1 +ATOM 2844 O O . SER B 2 160 ? 42.191 44.750 102.696 1.00 14.32 ? 160 SER B O 1 +ATOM 2845 C CB . SER B 2 160 ? 43.208 47.779 103.916 1.00 13.67 ? 160 SER B CB 1 +ATOM 2846 O OG . SER B 2 160 ? 42.298 47.470 104.943 1.00 16.81 ? 160 SER B OG 1 +ATOM 2847 N N . TRP B 2 161 ? 44.391 45.253 102.896 1.00 12.35 ? 161 TRP B N 1 +ATOM 2848 C CA . TRP B 2 161 ? 44.819 43.864 102.934 1.00 11.00 ? 161 TRP B CA 1 +ATOM 2849 C C . TRP B 2 161 ? 45.640 43.588 104.157 1.00 10.46 ? 161 TRP B C 1 +ATOM 2850 O O . TRP B 2 161 ? 46.591 44.308 104.417 1.00 11.28 ? 161 TRP B O 1 +ATOM 2851 C CB . TRP B 2 161 ? 45.620 43.518 101.681 1.00 11.16 ? 161 TRP B CB 1 +ATOM 2852 C CG . TRP B 2 161 ? 44.723 43.368 100.575 1.00 9.43 ? 161 TRP B CG 1 +ATOM 2853 C CD1 . TRP B 2 161 ? 44.311 44.335 99.722 1.00 7.56 ? 161 TRP B CD1 1 +ATOM 2854 C CD2 . TRP B 2 161 ? 44.032 42.187 100.226 1.00 7.72 ? 161 TRP B CD2 1 +ATOM 2855 N NE1 . TRP B 2 161 ? 43.403 43.817 98.827 1.00 9.68 ? 161 TRP B NE1 1 +ATOM 2856 C CE2 . TRP B 2 161 ? 43.217 42.488 99.120 1.00 9.60 ? 161 TRP B CE2 1 +ATOM 2857 C CE3 . TRP B 2 161 ? 44.057 40.882 100.699 1.00 7.73 ? 161 TRP B CE3 1 +ATOM 2858 C CZ2 . TRP B 2 161 ? 42.415 41.532 98.499 1.00 9.60 ? 161 TRP B CZ2 1 +ATOM 2859 C CZ3 . TRP B 2 161 ? 43.265 39.933 100.081 1.00 9.23 ? 161 TRP B CZ3 1 +ATOM 2860 C CH2 . TRP B 2 161 ? 42.462 40.259 98.993 1.00 8.92 ? 161 TRP B CH2 1 +ATOM 2861 N N . ASN B 2 162 ? 45.295 42.536 104.893 1.00 8.98 ? 162 ASN B N 1 +ATOM 2862 C CA . ASN B 2 162 ? 46.014 42.209 106.101 1.00 8.68 ? 162 ASN B CA 1 +ATOM 2863 C C . ASN B 2 162 ? 46.193 43.436 106.956 1.00 8.95 ? 162 ASN B C 1 +ATOM 2864 O O . ASN B 2 162 ? 47.296 43.727 107.419 1.00 8.79 ? 162 ASN B O 1 +ATOM 2865 C CB . ASN B 2 162 ? 47.365 41.625 105.766 1.00 8.01 ? 162 ASN B CB 1 +ATOM 2866 C CG . ASN B 2 162 ? 47.253 40.303 105.097 1.00 7.07 ? 162 ASN B CG 1 +ATOM 2867 O OD1 . ASN B 2 162 ? 46.165 39.892 104.711 1.00 8.02 ? 162 ASN B OD1 1 +ATOM 2868 N ND2 . ASN B 2 162 ? 48.374 39.606 104.967 1.00 4.48 ? 162 ASN B ND2 1 +ATOM 2869 N N . SER B 2 163 ? 45.092 44.157 107.122 1.00 9.23 ? 163 SER B N 1 +ATOM 2870 C CA . SER B 2 163 ? 45.014 45.308 107.992 1.00 10.23 ? 163 SER B CA 1 +ATOM 2871 C C . SER B 2 163 ? 46.020 46.406 107.645 1.00 10.46 ? 163 SER B C 1 +ATOM 2872 O O . SER B 2 163 ? 46.403 47.166 108.505 1.00 11.69 ? 163 SER B O 1 +ATOM 2873 C CB . SER B 2 163 ? 45.131 44.869 109.461 1.00 9.72 ? 163 SER B CB 1 +ATOM 2874 O OG . SER B 2 163 ? 44.214 43.818 109.728 1.00 10.76 ? 163 SER B OG 1 +ATOM 2875 N N . GLY B 2 164 ? 46.436 46.497 106.393 1.00 10.42 ? 164 GLY B N 1 +ATOM 2876 C CA . GLY B 2 164 ? 47.319 47.570 105.963 1.00 10.94 ? 164 GLY B CA 1 +ATOM 2877 C C . GLY B 2 164 ? 48.788 47.167 105.807 1.00 11.68 ? 164 GLY B C 1 +ATOM 2878 O O . GLY B 2 164 ? 49.597 47.946 105.281 1.00 11.44 ? 164 GLY B O 1 +ATOM 2879 N N . ALA B 2 165 ? 49.140 45.958 106.271 1.00 11.71 ? 165 ALA B N 1 +ATOM 2880 C CA . ALA B 2 165 ? 50.508 45.476 106.210 1.00 11.15 ? 165 ALA B CA 1 +ATOM 2881 C C . ALA B 2 165 ? 50.917 45.224 104.775 1.00 11.82 ? 165 ALA B C 1 +ATOM 2882 O O . ALA B 2 165 ? 52.094 45.359 104.431 1.00 11.81 ? 165 ALA B O 1 +ATOM 2883 C CB . ALA B 2 165 ? 50.673 44.245 107.027 1.00 10.83 ? 165 ALA B CB 1 +ATOM 2884 N N . LEU B 2 166 ? 49.937 44.886 103.938 1.00 12.39 ? 166 LEU B N 1 +ATOM 2885 C CA . LEU B 2 166 ? 50.188 44.542 102.554 1.00 12.68 ? 166 LEU B CA 1 +ATOM 2886 C C . LEU B 2 166 ? 49.632 45.595 101.600 1.00 13.23 ? 166 LEU B C 1 +ATOM 2887 O O . LEU B 2 166 ? 48.441 45.715 101.423 1.00 12.94 ? 166 LEU B O 1 +ATOM 2888 C CB . LEU B 2 166 ? 49.625 43.153 102.239 1.00 12.61 ? 166 LEU B CB 1 +ATOM 2889 C CG . LEU B 2 166 ? 49.398 42.685 100.810 1.00 12.67 ? 166 LEU B CG 1 +ATOM 2890 C CD1 . LEU B 2 166 ? 50.727 42.357 100.149 1.00 13.23 ? 166 LEU B CD1 1 +ATOM 2891 C CD2 . LEU B 2 166 ? 48.584 41.451 100.900 1.00 14.25 ? 166 LEU B CD2 1 +ATOM 2892 N N . THR B 2 167 ? 50.529 46.341 100.971 1.00 14.27 ? 167 THR B N 1 +ATOM 2893 C CA . THR B 2 167 ? 50.112 47.391 100.074 1.00 15.49 ? 167 THR B CA 1 +ATOM 2894 C C . THR B 2 167 ? 50.702 47.218 98.677 1.00 16.20 ? 167 THR B C 1 +ATOM 2895 O O . THR B 2 167 ? 50.062 47.605 97.692 1.00 16.51 ? 167 THR B O 1 +ATOM 2896 C CB . THR B 2 167 ? 50.454 48.765 100.651 1.00 15.51 ? 167 THR B CB 1 +ATOM 2897 O OG1 . THR B 2 167 ? 51.809 48.764 101.110 1.00 16.32 ? 167 THR B OG1 1 +ATOM 2898 C CG2 . THR B 2 167 ? 49.656 49.023 101.923 1.00 14.59 ? 167 THR B CG2 1 +ATOM 2899 N N . SER B 2 168 ? 51.892 46.619 98.581 1.00 16.90 ? 168 SER B N 1 +ATOM 2900 C CA . SER B 2 168 ? 52.554 46.467 97.289 1.00 17.65 ? 168 SER B CA 1 +ATOM 2901 C C . SER B 2 168 ? 51.886 45.434 96.404 1.00 17.86 ? 168 SER B C 1 +ATOM 2902 O O . SER B 2 168 ? 51.655 44.263 96.799 1.00 19.02 ? 168 SER B O 1 +ATOM 2903 C CB . SER B 2 168 ? 54.031 46.118 97.422 1.00 17.68 ? 168 SER B CB 1 +ATOM 2904 O OG . SER B 2 168 ? 54.715 47.189 98.045 1.00 21.20 ? 168 SER B OG 1 +ATOM 2905 N N . GLY B 2 169 ? 51.618 45.849 95.178 1.00 16.88 ? 169 GLY B N 1 +ATOM 2906 C CA . GLY B 2 169 ? 50.984 44.960 94.245 1.00 15.58 ? 169 GLY B CA 1 +ATOM 2907 C C . GLY B 2 169 ? 49.498 44.973 94.492 1.00 15.28 ? 169 GLY B C 1 +ATOM 2908 O O . GLY B 2 169 ? 48.860 44.038 94.039 1.00 15.16 ? 169 GLY B O 1 +ATOM 2909 N N . VAL B 2 170 ? 48.965 45.990 95.205 1.00 13.95 ? 170 VAL B N 1 +ATOM 2910 C CA . VAL B 2 170 ? 47.520 46.128 95.377 1.00 13.50 ? 170 VAL B CA 1 +ATOM 2911 C C . VAL B 2 170 ? 46.903 47.061 94.340 1.00 14.88 ? 170 VAL B C 1 +ATOM 2912 O O . VAL B 2 170 ? 47.495 48.069 93.969 1.00 16.83 ? 170 VAL B O 1 +ATOM 2913 C CB . VAL B 2 170 ? 47.072 46.608 96.784 1.00 13.12 ? 170 VAL B CB 1 +ATOM 2914 C CG1 . VAL B 2 170 ? 45.535 46.592 96.879 1.00 11.44 ? 170 VAL B CG1 1 +ATOM 2915 C CG2 . VAL B 2 170 ? 47.603 45.727 97.864 1.00 10.73 ? 170 VAL B CG2 1 +ATOM 2916 N N . HIS B 2 171 ? 45.723 46.693 93.860 1.00 14.30 ? 171 HIS B N 1 +ATOM 2917 C CA . HIS B 2 171 ? 44.971 47.476 92.932 1.00 13.37 ? 171 HIS B CA 1 +ATOM 2918 C C . HIS B 2 171 ? 43.546 47.345 93.343 1.00 13.56 ? 171 HIS B C 1 +ATOM 2919 O O . HIS B 2 171 ? 42.996 46.261 93.236 1.00 14.40 ? 171 HIS B O 1 +ATOM 2920 C CB . HIS B 2 171 ? 45.101 46.883 91.546 1.00 13.70 ? 171 HIS B CB 1 +ATOM 2921 C CG . HIS B 2 171 ? 46.456 47.044 90.966 1.00 13.05 ? 171 HIS B CG 1 +ATOM 2922 N ND1 . HIS B 2 171 ? 47.072 48.269 90.872 1.00 13.91 ? 171 HIS B ND1 1 +ATOM 2923 C CD2 . HIS B 2 171 ? 47.318 46.140 90.456 1.00 12.93 ? 171 HIS B CD2 1 +ATOM 2924 C CE1 . HIS B 2 171 ? 48.262 48.113 90.324 1.00 13.77 ? 171 HIS B CE1 1 +ATOM 2925 N NE2 . HIS B 2 171 ? 48.438 46.827 90.068 1.00 14.79 ? 171 HIS B NE2 1 +ATOM 2926 N N . THR B 2 172 ? 42.945 48.429 93.817 1.00 13.50 ? 172 THR B N 1 +ATOM 2927 C CA . THR B 2 172 ? 41.542 48.421 94.158 1.00 13.64 ? 172 THR B CA 1 +ATOM 2928 C C . THR B 2 172 ? 40.928 49.178 93.028 1.00 14.66 ? 172 THR B C 1 +ATOM 2929 O O . THR B 2 172 ? 41.398 50.258 92.664 1.00 15.07 ? 172 THR B O 1 +ATOM 2930 C CB . THR B 2 172 ? 41.344 49.096 95.519 1.00 14.28 ? 172 THR B CB 1 +ATOM 2931 O OG1 . THR B 2 172 ? 41.898 48.236 96.547 1.00 14.10 ? 172 THR B OG1 1 +ATOM 2932 C CG2 . THR B 2 172 ? 39.848 49.281 95.878 1.00 12.50 ? 172 THR B CG2 1 +ATOM 2933 N N . PHE B 2 173 ? 39.916 48.598 92.396 1.00 15.24 ? 173 PHE B N 1 +ATOM 2934 C CA . PHE B 2 173 ? 39.452 49.167 91.133 1.00 14.86 ? 173 PHE B CA 1 +ATOM 2935 C C . PHE B 2 173 ? 38.378 50.206 91.352 1.00 15.65 ? 173 PHE B C 1 +ATOM 2936 O O . PHE B 2 173 ? 37.644 50.111 92.337 1.00 16.01 ? 173 PHE B O 1 +ATOM 2937 C CB . PHE B 2 173 ? 38.988 48.059 90.224 1.00 13.97 ? 173 PHE B CB 1 +ATOM 2938 C CG . PHE B 2 173 ? 40.099 47.336 89.568 1.00 11.77 ? 173 PHE B CG 1 +ATOM 2939 C CD1 . PHE B 2 173 ? 40.624 47.792 88.369 1.00 9.54 ? 173 PHE B CD1 1 +ATOM 2940 C CD2 . PHE B 2 173 ? 40.628 46.201 90.133 1.00 10.87 ? 173 PHE B CD2 1 +ATOM 2941 C CE1 . PHE B 2 173 ? 41.650 47.122 87.733 1.00 8.33 ? 173 PHE B CE1 1 +ATOM 2942 C CE2 . PHE B 2 173 ? 41.684 45.536 89.513 1.00 10.50 ? 173 PHE B CE2 1 +ATOM 2943 C CZ . PHE B 2 173 ? 42.191 45.997 88.318 1.00 10.38 ? 173 PHE B CZ 1 +ATOM 2944 N N . PRO B 2 174 ? 38.302 51.225 90.492 1.00 16.16 ? 174 PRO B N 1 +ATOM 2945 C CA . PRO B 2 174 ? 37.226 52.215 90.614 1.00 16.39 ? 174 PRO B CA 1 +ATOM 2946 C C . PRO B 2 174 ? 35.921 51.473 90.526 1.00 16.78 ? 174 PRO B C 1 +ATOM 2947 O O . PRO B 2 174 ? 35.808 50.608 89.674 1.00 18.27 ? 174 PRO B O 1 +ATOM 2948 C CB . PRO B 2 174 ? 37.417 53.102 89.391 1.00 15.79 ? 174 PRO B CB 1 +ATOM 2949 C CG . PRO B 2 174 ? 38.857 52.964 89.038 1.00 15.81 ? 174 PRO B CG 1 +ATOM 2950 C CD . PRO B 2 174 ? 39.227 51.553 89.385 1.00 16.80 ? 174 PRO B CD 1 +ATOM 2951 N N . ALA B 2 175 ? 34.989 51.742 91.427 1.00 16.23 ? 175 ALA B N 1 +ATOM 2952 C CA . ALA B 2 175 ? 33.673 51.136 91.373 1.00 15.80 ? 175 ALA B CA 1 +ATOM 2953 C C . ALA B 2 175 ? 32.999 51.251 90.004 1.00 16.59 ? 175 ALA B C 1 +ATOM 2954 O O . ALA B 2 175 ? 33.017 52.305 89.380 1.00 16.66 ? 175 ALA B O 1 +ATOM 2955 C CB . ALA B 2 175 ? 32.811 51.772 92.413 1.00 15.85 ? 175 ALA B CB 1 +ATOM 2956 N N . VAL B 2 176 ? 32.384 50.169 89.540 1.00 17.43 ? 176 VAL B N 1 +ATOM 2957 C CA . VAL B 2 176 ? 31.465 50.296 88.425 1.00 17.96 ? 176 VAL B CA 1 +ATOM 2958 C C . VAL B 2 176 ? 30.044 50.318 88.913 1.00 18.33 ? 176 VAL B C 1 +ATOM 2959 O O . VAL B 2 176 ? 29.668 49.574 89.809 1.00 18.58 ? 176 VAL B O 1 +ATOM 2960 C CB . VAL B 2 176 ? 31.653 49.248 87.306 1.00 18.32 ? 176 VAL B CB 1 +ATOM 2961 C CG1 . VAL B 2 176 ? 32.877 49.594 86.483 1.00 17.56 ? 176 VAL B CG1 1 +ATOM 2962 C CG2 . VAL B 2 176 ? 31.706 47.814 87.858 1.00 18.22 ? 176 VAL B CG2 1 +ATOM 2963 N N . LEU B 2 177 ? 29.277 51.221 88.321 1.00 19.19 ? 177 LEU B N 1 +ATOM 2964 C CA . LEU B 2 177 ? 27.851 51.333 88.554 1.00 20.12 ? 177 LEU B CA 1 +ATOM 2965 C C . LEU B 2 177 ? 27.183 50.237 87.728 1.00 20.70 ? 177 LEU B C 1 +ATOM 2966 O O . LEU B 2 177 ? 27.495 50.077 86.547 1.00 21.47 ? 177 LEU B O 1 +ATOM 2967 C CB . LEU B 2 177 ? 27.385 52.707 88.093 1.00 19.65 ? 177 LEU B CB 1 +ATOM 2968 C CG . LEU B 2 177 ? 25.943 53.190 88.155 1.00 19.58 ? 177 LEU B CG 1 +ATOM 2969 C CD1 . LEU B 2 177 ? 25.622 53.853 89.484 1.00 18.52 ? 177 LEU B CD1 1 +ATOM 2970 C CD2 . LEU B 2 177 ? 25.812 54.197 87.032 1.00 21.64 ? 177 LEU B CD2 1 +ATOM 2971 N N . GLN B 2 178 ? 26.290 49.468 88.337 1.00 20.46 ? 178 GLN B N 1 +ATOM 2972 C CA . GLN B 2 178 ? 25.603 48.444 87.586 1.00 20.37 ? 178 GLN B CA 1 +ATOM 2973 C C . GLN B 2 178 ? 24.217 48.954 87.227 1.00 20.42 ? 178 GLN B C 1 +ATOM 2974 O O . GLN B 2 178 ? 23.695 49.885 87.856 1.00 20.35 ? 178 GLN B O 1 +ATOM 2975 C CB . GLN B 2 178 ? 25.527 47.153 88.383 1.00 20.77 ? 178 GLN B CB 1 +ATOM 2976 C CG . GLN B 2 178 ? 26.868 46.460 88.612 1.00 21.43 ? 178 GLN B CG 1 +ATOM 2977 C CD . GLN B 2 178 ? 26.695 45.207 89.438 1.00 23.76 ? 178 GLN B CD 1 +ATOM 2978 O OE1 . GLN B 2 178 ? 26.808 45.242 90.677 1.00 24.21 ? 178 GLN B OE1 1 +ATOM 2979 N NE2 . GLN B 2 178 ? 26.369 44.094 88.762 1.00 24.67 ? 178 GLN B NE2 1 +ATOM 2980 N N . SER B 2 179 ? 23.628 48.367 86.193 1.00 20.01 ? 179 SER B N 1 +ATOM 2981 C CA . SER B 2 179 ? 22.312 48.788 85.760 1.00 19.81 ? 179 SER B CA 1 +ATOM 2982 C C . SER B 2 179 ? 21.284 48.517 86.868 1.00 19.33 ? 179 SER B C 1 +ATOM 2983 O O . SER B 2 179 ? 20.122 48.926 86.766 1.00 19.75 ? 179 SER B O 1 +ATOM 2984 C CB . SER B 2 179 ? 21.933 48.098 84.450 1.00 20.13 ? 179 SER B CB 1 +ATOM 2985 O OG . SER B 2 179 ? 22.677 46.897 84.284 1.00 21.40 ? 179 SER B OG 1 +ATOM 2986 N N . SER B 2 180 ? 21.715 47.855 87.937 1.00 18.35 ? 180 SER B N 1 +ATOM 2987 C CA . SER B 2 180 ? 20.875 47.720 89.124 1.00 17.73 ? 180 SER B CA 1 +ATOM 2988 C C . SER B 2 180 ? 20.769 49.031 89.927 1.00 17.34 ? 180 SER B C 1 +ATOM 2989 O O . SER B 2 180 ? 19.909 49.178 90.796 1.00 17.00 ? 180 SER B O 1 +ATOM 2990 C CB . SER B 2 180 ? 21.377 46.576 90.011 1.00 17.59 ? 180 SER B CB 1 +ATOM 2991 O OG . SER B 2 180 ? 22.710 46.788 90.445 1.00 17.00 ? 180 SER B OG 1 +ATOM 2992 N N . GLY B 2 181 ? 21.650 49.978 89.632 1.00 16.83 ? 181 GLY B N 1 +ATOM 2993 C CA . GLY B 2 181 ? 21.793 51.158 90.452 1.00 16.54 ? 181 GLY B CA 1 +ATOM 2994 C C . GLY B 2 181 ? 22.819 50.957 91.549 1.00 16.61 ? 181 GLY B C 1 +ATOM 2995 O O . GLY B 2 181 ? 23.235 51.930 92.171 1.00 17.01 ? 181 GLY B O 1 +ATOM 2996 N N . LEU B 2 182 ? 23.232 49.708 91.779 1.00 16.21 ? 182 LEU B N 1 +ATOM 2997 C CA . LEU B 2 182 ? 24.205 49.375 92.814 1.00 16.32 ? 182 LEU B CA 1 +ATOM 2998 C C . LEU B 2 182 ? 25.640 49.357 92.271 1.00 16.37 ? 182 LEU B C 1 +ATOM 2999 O O . LEU B 2 182 ? 25.846 49.036 91.101 1.00 16.44 ? 182 LEU B O 1 +ATOM 3000 C CB . LEU B 2 182 ? 23.868 48.004 93.425 1.00 16.68 ? 182 LEU B CB 1 +ATOM 3001 C CG . LEU B 2 182 ? 22.522 47.830 94.139 1.00 16.53 ? 182 LEU B CG 1 +ATOM 3002 C CD1 . LEU B 2 182 ? 22.204 46.365 94.448 1.00 13.13 ? 182 LEU B CD1 1 +ATOM 3003 C CD2 . LEU B 2 182 ? 22.512 48.679 95.403 1.00 17.18 ? 182 LEU B CD2 1 +ATOM 3004 N N . TYR B 2 183 ? 26.628 49.683 93.113 1.00 16.52 ? 183 TYR B N 1 +ATOM 3005 C CA . TYR B 2 183 ? 28.030 49.698 92.679 1.00 17.21 ? 183 TYR B CA 1 +ATOM 3006 C C . TYR B 2 183 ? 28.687 48.374 92.944 1.00 18.01 ? 183 TYR B C 1 +ATOM 3007 O O . TYR B 2 183 ? 28.230 47.594 93.789 1.00 18.37 ? 183 TYR B O 1 +ATOM 3008 C CB . TYR B 2 183 ? 28.875 50.787 93.355 1.00 17.44 ? 183 TYR B CB 1 +ATOM 3009 C CG . TYR B 2 183 ? 28.528 52.227 92.991 1.00 16.79 ? 183 TYR B CG 1 +ATOM 3010 C CD1 . TYR B 2 183 ? 27.672 52.965 93.800 1.00 17.57 ? 183 TYR B CD1 1 +ATOM 3011 C CD2 . TYR B 2 183 ? 29.072 52.849 91.879 1.00 16.37 ? 183 TYR B CD2 1 +ATOM 3012 C CE1 . TYR B 2 183 ? 27.342 54.286 93.511 1.00 18.45 ? 183 TYR B CE1 1 +ATOM 3013 C CE2 . TYR B 2 183 ? 28.754 54.200 91.569 1.00 18.38 ? 183 TYR B CE2 1 +ATOM 3014 C CZ . TYR B 2 183 ? 27.876 54.910 92.402 1.00 19.41 ? 183 TYR B CZ 1 +ATOM 3015 O OH . TYR B 2 183 ? 27.497 56.231 92.165 1.00 21.75 ? 183 TYR B OH 1 +ATOM 3016 N N . SER B 2 184 ? 29.769 48.132 92.215 1.00 18.54 ? 184 SER B N 1 +ATOM 3017 C CA . SER B 2 184 ? 30.552 46.926 92.366 1.00 18.82 ? 184 SER B CA 1 +ATOM 3018 C C . SER B 2 184 ? 32.015 47.232 92.073 1.00 19.03 ? 184 SER B C 1 +ATOM 3019 O O . SER B 2 184 ? 32.333 47.804 91.038 1.00 19.23 ? 184 SER B O 1 +ATOM 3020 C CB . SER B 2 184 ? 30.038 45.854 91.406 1.00 19.27 ? 184 SER B CB 1 +ATOM 3021 O OG . SER B 2 184 ? 30.688 44.608 91.625 1.00 21.22 ? 184 SER B OG 1 +ATOM 3022 N N . LEU B 2 185 ? 32.902 46.864 92.992 1.00 19.26 ? 185 LEU B N 1 +ATOM 3023 C CA . LEU B 2 185 ? 34.349 46.940 92.745 1.00 19.30 ? 185 LEU B CA 1 +ATOM 3024 C C . LEU B 2 185 ? 35.091 45.635 93.010 1.00 19.36 ? 185 LEU B C 1 +ATOM 3025 O O . LEU B 2 185 ? 34.516 44.668 93.485 1.00 20.33 ? 185 LEU B O 1 +ATOM 3026 C CB . LEU B 2 185 ? 35.005 48.112 93.493 1.00 18.50 ? 185 LEU B CB 1 +ATOM 3027 C CG . LEU B 2 185 ? 35.322 48.189 94.979 1.00 17.93 ? 185 LEU B CG 1 +ATOM 3028 C CD1 . LEU B 2 185 ? 36.272 47.121 95.463 1.00 16.39 ? 185 LEU B CD1 1 +ATOM 3029 C CD2 . LEU B 2 185 ? 35.911 49.568 95.258 1.00 17.98 ? 185 LEU B CD2 1 +ATOM 3030 N N . SER B 2 186 ? 36.366 45.605 92.670 1.00 19.22 ? 186 SER B N 1 +ATOM 3031 C CA . SER B 2 186 ? 37.196 44.489 93.057 1.00 19.21 ? 186 SER B CA 1 +ATOM 3032 C C . SER B 2 186 ? 38.540 44.996 93.571 1.00 19.10 ? 186 SER B C 1 +ATOM 3033 O O . SER B 2 186 ? 39.085 45.972 93.042 1.00 19.54 ? 186 SER B O 1 +ATOM 3034 C CB . SER B 2 186 ? 37.418 43.621 91.862 1.00 19.78 ? 186 SER B CB 1 +ATOM 3035 O OG . SER B 2 186 ? 37.595 42.309 92.294 1.00 22.34 ? 186 SER B OG 1 +ATOM 3036 N N . SER B 2 187 ? 39.068 44.387 94.626 1.00 18.23 ? 187 SER B N 1 +ATOM 3037 C CA . SER B 2 187 ? 40.433 44.710 95.014 1.00 17.33 ? 187 SER B CA 1 +ATOM 3038 C C . SER B 2 187 ? 41.254 43.481 94.748 1.00 15.97 ? 187 SER B C 1 +ATOM 3039 O O . SER B 2 187 ? 40.810 42.373 94.992 1.00 15.75 ? 187 SER B O 1 +ATOM 3040 C CB . SER B 2 187 ? 40.509 45.097 96.481 1.00 18.14 ? 187 SER B CB 1 +ATOM 3041 O OG . SER B 2 187 ? 41.862 45.235 96.890 1.00 20.08 ? 187 SER B OG 1 +ATOM 3042 N N . VAL B 2 188 ? 42.449 43.660 94.229 1.00 15.13 ? 188 VAL B N 1 +ATOM 3043 C CA . VAL B 2 188 ? 43.274 42.504 93.921 1.00 14.36 ? 188 VAL B CA 1 +ATOM 3044 C C . VAL B 2 188 ? 44.703 42.748 94.333 1.00 14.59 ? 188 VAL B C 1 +ATOM 3045 O O . VAL B 2 188 ? 45.168 43.911 94.422 1.00 13.53 ? 188 VAL B O 1 +ATOM 3046 C CB . VAL B 2 188 ? 43.282 42.165 92.435 1.00 14.16 ? 188 VAL B CB 1 +ATOM 3047 C CG1 . VAL B 2 188 ? 41.925 41.753 91.968 1.00 12.68 ? 188 VAL B CG1 1 +ATOM 3048 C CG2 . VAL B 2 188 ? 43.820 43.344 91.628 1.00 15.03 ? 188 VAL B CG2 1 +ATOM 3049 N N . VAL B 2 189 ? 45.414 41.639 94.533 1.00 14.67 ? 189 VAL B N 1 +ATOM 3050 C CA . VAL B 2 189 ? 46.810 41.707 94.924 1.00 14.74 ? 189 VAL B CA 1 +ATOM 3051 C C . VAL B 2 189 ? 47.610 40.554 94.363 1.00 15.23 ? 189 VAL B C 1 +ATOM 3052 O O . VAL B 2 189 ? 47.081 39.431 94.198 1.00 15.77 ? 189 VAL B O 1 +ATOM 3053 C CB . VAL B 2 189 ? 46.993 41.799 96.466 1.00 14.66 ? 189 VAL B CB 1 +ATOM 3054 C CG1 . VAL B 2 189 ? 46.469 40.563 97.187 1.00 12.55 ? 189 VAL B CG1 1 +ATOM 3055 C CG2 . VAL B 2 189 ? 48.458 41.967 96.789 1.00 15.10 ? 189 VAL B CG2 1 +ATOM 3056 N N . THR B 2 190 ? 48.888 40.829 94.092 1.00 14.91 ? 190 THR B N 1 +ATOM 3057 C CA . THR B 2 190 ? 49.835 39.809 93.642 1.00 14.75 ? 190 THR B CA 1 +ATOM 3058 C C . THR B 2 190 ? 50.741 39.355 94.781 1.00 13.95 ? 190 THR B C 1 +ATOM 3059 O O . THR B 2 190 ? 51.250 40.189 95.533 1.00 14.23 ? 190 THR B O 1 +ATOM 3060 C CB . THR B 2 190 ? 50.661 40.351 92.531 1.00 14.33 ? 190 THR B CB 1 +ATOM 3061 O OG1 . THR B 2 190 ? 49.835 41.189 91.725 1.00 17.68 ? 190 THR B OG1 1 +ATOM 3062 C CG2 . THR B 2 190 ? 50.939 39.266 91.583 1.00 17.50 ? 190 THR B CG2 1 +ATOM 3063 N N . VAL B 2 191 ? 50.928 38.046 94.918 1.00 12.52 ? 191 VAL B N 1 +ATOM 3064 C CA . VAL B 2 191 ? 51.759 37.523 95.988 1.00 12.41 ? 191 VAL B CA 1 +ATOM 3065 C C . VAL B 2 191 ? 52.686 36.416 95.509 1.00 12.68 ? 191 VAL B C 1 +ATOM 3066 O O . VAL B 2 191 ? 52.411 35.783 94.491 1.00 13.59 ? 191 VAL B O 1 +ATOM 3067 C CB . VAL B 2 191 ? 50.955 37.000 97.187 1.00 12.09 ? 191 VAL B CB 1 +ATOM 3068 C CG1 . VAL B 2 191 ? 50.261 38.139 97.893 1.00 11.25 ? 191 VAL B CG1 1 +ATOM 3069 C CG2 . VAL B 2 191 ? 49.988 35.879 96.778 1.00 12.13 ? 191 VAL B CG2 1 +ATOM 3070 N N . PRO B 2 192 ? 53.781 36.171 96.223 1.00 12.28 ? 192 PRO B N 1 +ATOM 3071 C CA . PRO B 2 192 ? 54.597 35.016 95.893 1.00 12.32 ? 192 PRO B CA 1 +ATOM 3072 C C . PRO B 2 192 ? 53.671 33.844 96.124 1.00 12.33 ? 192 PRO B C 1 +ATOM 3073 O O . PRO B 2 192 ? 52.962 33.837 97.140 1.00 11.47 ? 192 PRO B O 1 +ATOM 3074 C CB . PRO B 2 192 ? 55.706 35.035 96.950 1.00 12.42 ? 192 PRO B CB 1 +ATOM 3075 C CG . PRO B 2 192 ? 55.694 36.400 97.500 1.00 13.85 ? 192 PRO B CG 1 +ATOM 3076 C CD . PRO B 2 192 ? 54.299 36.911 97.389 1.00 12.37 ? 192 PRO B CD 1 +ATOM 3077 N N . SER B 2 193 ? 53.634 32.905 95.180 1.00 12.56 ? 193 SER B N 1 +ATOM 3078 C CA . SER B 2 193 ? 52.792 31.727 95.329 1.00 13.07 ? 193 SER B CA 1 +ATOM 3079 C C . SER B 2 193 ? 53.360 30.791 96.364 1.00 12.83 ? 193 SER B C 1 +ATOM 3080 O O . SER B 2 193 ? 52.623 29.990 96.899 1.00 13.53 ? 193 SER B O 1 +ATOM 3081 C CB . SER B 2 193 ? 52.567 31.012 93.998 1.00 12.94 ? 193 SER B CB 1 +ATOM 3082 O OG . SER B 2 193 ? 53.781 30.865 93.299 1.00 15.77 ? 193 SER B OG 1 +ATOM 3083 N N . SER B 2 194 ? 54.658 30.916 96.645 1.00 12.99 ? 194 SER B N 1 +ATOM 3084 C CA . SER B 2 194 ? 55.342 30.187 97.711 1.00 13.58 ? 194 SER B CA 1 +ATOM 3085 C C . SER B 2 194 ? 54.686 30.418 99.065 1.00 14.25 ? 194 SER B C 1 +ATOM 3086 O O . SER B 2 194 ? 54.552 29.493 99.878 1.00 14.37 ? 194 SER B O 1 +ATOM 3087 C CB . SER B 2 194 ? 56.788 30.654 97.806 1.00 13.52 ? 194 SER B CB 1 +ATOM 3088 O OG . SER B 2 194 ? 56.826 32.039 98.104 1.00 14.17 ? 194 SER B OG 1 +ATOM 3089 N N . SER B 2 195 ? 54.307 31.669 99.290 1.00 14.90 ? 195 SER B N 1 +ATOM 3090 C CA . SER B 2 195 ? 53.573 32.127 100.467 1.00 15.51 ? 195 SER B CA 1 +ATOM 3091 C C . SER B 2 195 ? 52.176 31.532 100.664 1.00 16.31 ? 195 SER B C 1 +ATOM 3092 O O . SER B 2 195 ? 51.693 31.493 101.791 1.00 16.95 ? 195 SER B O 1 +ATOM 3093 C CB . SER B 2 195 ? 53.402 33.647 100.394 1.00 15.72 ? 195 SER B CB 1 +ATOM 3094 O OG . SER B 2 195 ? 52.211 33.972 99.694 1.00 13.98 ? 195 SER B OG 1 +ATOM 3095 N N . LEU B 2 196 ? 51.498 31.123 99.595 1.00 16.75 ? 196 LEU B N 1 +ATOM 3096 C CA . LEU B 2 196 ? 50.151 30.553 99.742 1.00 17.43 ? 196 LEU B CA 1 +ATOM 3097 C C . LEU B 2 196 ? 50.057 29.453 100.823 1.00 18.07 ? 196 LEU B C 1 +ATOM 3098 O O . LEU B 2 196 ? 50.905 28.535 100.908 1.00 18.02 ? 196 LEU B O 1 +ATOM 3099 C CB . LEU B 2 196 ? 49.634 30.034 98.399 1.00 17.26 ? 196 LEU B CB 1 +ATOM 3100 C CG . LEU B 2 196 ? 48.913 30.962 97.400 1.00 17.89 ? 196 LEU B CG 1 +ATOM 3101 C CD1 . LEU B 2 196 ? 49.051 32.466 97.679 1.00 15.45 ? 196 LEU B CD1 1 +ATOM 3102 C CD2 . LEU B 2 196 ? 49.333 30.619 95.977 1.00 17.34 ? 196 LEU B CD2 1 +ATOM 3103 N N . GLY B 2 197 ? 49.040 29.553 101.669 1.00 18.54 ? 197 GLY B N 1 +ATOM 3104 C CA . GLY B 2 197 ? 48.877 28.568 102.728 1.00 19.91 ? 197 GLY B CA 1 +ATOM 3105 C C . GLY B 2 197 ? 49.935 28.596 103.827 1.00 20.41 ? 197 GLY B C 1 +ATOM 3106 O O . GLY B 2 197 ? 49.773 27.901 104.833 1.00 20.74 ? 197 GLY B O 1 +ATOM 3107 N N . THR B 2 198 ? 51.016 29.360 103.622 1.00 20.64 ? 198 THR B N 1 +ATOM 3108 C CA . THR B 2 198 ? 51.927 29.793 104.705 1.00 20.67 ? 198 THR B CA 1 +ATOM 3109 C C . THR B 2 198 ? 51.410 31.100 105.357 1.00 21.11 ? 198 THR B C 1 +ATOM 3110 O O . THR B 2 198 ? 51.170 31.137 106.575 1.00 20.98 ? 198 THR B O 1 +ATOM 3111 C CB . THR B 2 198 ? 53.399 29.952 104.183 1.00 20.50 ? 198 THR B CB 1 +ATOM 3112 O OG1 . THR B 2 198 ? 54.208 28.901 104.712 1.00 20.28 ? 198 THR B OG1 1 +ATOM 3113 C CG2 . THR B 2 198 ? 54.098 31.225 104.712 1.00 19.22 ? 198 THR B CG2 1 +ATOM 3114 N N . GLN B 2 199 ? 51.237 32.144 104.529 1.00 21.23 ? 199 GLN B N 1 +ATOM 3115 C CA . GLN B 2 199 ? 50.745 33.470 104.934 1.00 21.37 ? 199 GLN B CA 1 +ATOM 3116 C C . GLN B 2 199 ? 49.248 33.528 104.691 1.00 20.63 ? 199 GLN B C 1 +ATOM 3117 O O . GLN B 2 199 ? 48.745 33.093 103.646 1.00 20.56 ? 199 GLN B O 1 +ATOM 3118 C CB . GLN B 2 199 ? 51.447 34.590 104.137 1.00 21.76 ? 199 GLN B CB 1 +ATOM 3119 C CG . GLN B 2 199 ? 52.150 35.666 105.006 1.00 25.48 ? 199 GLN B CG 1 +ATOM 3120 C CD . GLN B 2 199 ? 53.085 36.640 104.215 1.00 31.03 ? 199 GLN B CD 1 +ATOM 3121 O OE1 . GLN B 2 199 ? 53.154 37.832 104.544 1.00 33.54 ? 199 GLN B OE1 1 +ATOM 3122 N NE2 . GLN B 2 199 ? 53.804 36.129 103.202 1.00 31.68 ? 199 GLN B NE2 1 +ATOM 3123 N N . THR B 2 200 ? 48.522 34.054 105.660 1.00 20.11 ? 200 THR B N 1 +ATOM 3124 C CA . THR B 2 200 ? 47.097 34.242 105.480 1.00 19.42 ? 200 THR B CA 1 +ATOM 3125 C C . THR B 2 200 ? 46.823 35.619 104.828 1.00 18.74 ? 200 THR B C 1 +ATOM 3126 O O . THR B 2 200 ? 47.581 36.595 105.011 1.00 18.23 ? 200 THR B O 1 +ATOM 3127 C CB . THR B 2 200 ? 46.341 33.955 106.816 1.00 19.97 ? 200 THR B CB 1 +ATOM 3128 O OG1 . THR B 2 200 ? 45.001 34.463 106.754 1.00 20.82 ? 200 THR B OG1 1 +ATOM 3129 C CG2 . THR B 2 200 ? 46.968 34.697 107.965 1.00 20.56 ? 200 THR B CG2 1 +ATOM 3130 N N . TYR B 2 201 ? 45.798 35.679 103.985 1.00 17.85 ? 201 TYR B N 1 +ATOM 3131 C CA . TYR B 2 201 ? 45.513 36.921 103.248 1.00 16.92 ? 201 TYR B CA 1 +ATOM 3132 C C . TYR B 2 201 ? 44.079 37.303 103.462 1.00 16.33 ? 201 TYR B C 1 +ATOM 3133 O O . TYR B 2 201 ? 43.185 36.495 103.195 1.00 16.32 ? 201 TYR B O 1 +ATOM 3134 C CB . TYR B 2 201 ? 45.792 36.768 101.754 1.00 16.49 ? 201 TYR B CB 1 +ATOM 3135 C CG . TYR B 2 201 ? 47.267 36.653 101.437 1.00 17.20 ? 201 TYR B CG 1 +ATOM 3136 C CD1 . TYR B 2 201 ? 47.840 35.426 101.066 1.00 16.62 ? 201 TYR B CD1 1 +ATOM 3137 C CD2 . TYR B 2 201 ? 48.098 37.769 101.516 1.00 16.96 ? 201 TYR B CD2 1 +ATOM 3138 C CE1 . TYR B 2 201 ? 49.204 35.330 100.782 1.00 15.70 ? 201 TYR B CE1 1 +ATOM 3139 C CE2 . TYR B 2 201 ? 49.457 37.678 101.243 1.00 16.38 ? 201 TYR B CE2 1 +ATOM 3140 C CZ . TYR B 2 201 ? 50.001 36.466 100.869 1.00 16.20 ? 201 TYR B CZ 1 +ATOM 3141 O OH . TYR B 2 201 ? 51.348 36.419 100.580 1.00 14.99 ? 201 TYR B OH 1 +ATOM 3142 N N . ILE B 2 202 ? 43.863 38.524 103.949 1.00 15.54 ? 202 ILE B N 1 +ATOM 3143 C CA . ILE B 2 202 ? 42.543 38.963 104.379 1.00 14.57 ? 202 ILE B CA 1 +ATOM 3144 C C . ILE B 2 202 ? 42.333 40.306 103.761 1.00 14.52 ? 202 ILE B C 1 +ATOM 3145 O O . ILE B 2 202 ? 43.143 41.190 103.967 1.00 13.74 ? 202 ILE B O 1 +ATOM 3146 C CB . ILE B 2 202 ? 42.473 39.042 105.974 1.00 15.05 ? 202 ILE B CB 1 +ATOM 3147 C CG1 . ILE B 2 202 ? 42.609 37.658 106.619 1.00 13.09 ? 202 ILE B CG1 1 +ATOM 3148 C CG2 . ILE B 2 202 ? 41.213 39.771 106.507 1.00 13.15 ? 202 ILE B CG2 1 +ATOM 3149 C CD1 . ILE B 2 202 ? 43.008 37.743 108.065 1.00 13.97 ? 202 ILE B CD1 1 +ATOM 3150 N N . CYS B 2 203 ? 41.273 40.460 102.977 1.00 14.94 ? 203 CYS B N 1 +ATOM 3151 C CA . CYS B 2 203 ? 40.831 41.801 102.630 1.00 16.64 ? 203 CYS B CA 1 +ATOM 3152 C C . CYS B 2 203 ? 39.953 42.375 103.729 1.00 16.09 ? 203 CYS B C 1 +ATOM 3153 O O . CYS B 2 203 ? 39.201 41.652 104.414 1.00 15.38 ? 203 CYS B O 1 +ATOM 3154 C CB . CYS B 2 203 ? 40.094 41.852 101.297 1.00 17.52 ? 203 CYS B CB 1 +ATOM 3155 S SG . CYS B 2 203 ? 38.534 40.956 101.326 1.00 24.99 ? 203 CYS B SG 1 +ATOM 3156 N N . ASN B 2 204 ? 40.090 43.681 103.922 1.00 15.76 ? 204 ASN B N 1 +ATOM 3157 C CA . ASN B 2 204 ? 39.315 44.370 104.939 1.00 15.38 ? 204 ASN B CA 1 +ATOM 3158 C C . ASN B 2 204 ? 38.511 45.343 104.172 1.00 14.71 ? 204 ASN B C 1 +ATOM 3159 O O . ASN B 2 204 ? 39.045 46.304 103.641 1.00 16.40 ? 204 ASN B O 1 +ATOM 3160 C CB . ASN B 2 204 ? 40.212 45.070 105.964 1.00 14.91 ? 204 ASN B CB 1 +ATOM 3161 C CG . ASN B 2 204 ? 41.439 44.232 106.331 1.00 16.08 ? 204 ASN B CG 1 +ATOM 3162 O OD1 . ASN B 2 204 ? 41.342 43.216 107.025 1.00 16.10 ? 204 ASN B OD1 1 +ATOM 3163 N ND2 . ASN B 2 204 ? 42.594 44.651 105.844 1.00 15.95 ? 204 ASN B ND2 1 +ATOM 3164 N N . VAL B 2 205 ? 37.233 45.061 104.052 1.00 13.77 ? 205 VAL B N 1 +ATOM 3165 C CA . VAL B 2 205 ? 36.347 45.918 103.302 1.00 12.90 ? 205 VAL B CA 1 +ATOM 3166 C C . VAL B 2 205 ? 35.497 46.722 104.254 1.00 13.35 ? 205 VAL B C 1 +ATOM 3167 O O . VAL B 2 205 ? 34.989 46.194 105.230 1.00 13.98 ? 205 VAL B O 1 +ATOM 3168 C CB . VAL B 2 205 ? 35.471 45.104 102.346 1.00 12.86 ? 205 VAL B CB 1 +ATOM 3169 C CG1 . VAL B 2 205 ? 34.530 46.012 101.564 1.00 10.13 ? 205 VAL B CG1 1 +ATOM 3170 C CG2 . VAL B 2 205 ? 36.355 44.259 101.408 1.00 11.31 ? 205 VAL B CG2 1 +ATOM 3171 N N . ASN B 2 206 ? 35.324 47.996 103.962 1.00 13.32 ? 206 ASN B N 1 +ATOM 3172 C CA . ASN B 2 206 ? 34.545 48.855 104.819 1.00 14.17 ? 206 ASN B CA 1 +ATOM 3173 C C . ASN B 2 206 ? 33.572 49.734 103.992 1.00 14.17 ? 206 ASN B C 1 +ATOM 3174 O O . ASN B 2 206 ? 33.973 50.461 103.080 1.00 14.74 ? 206 ASN B O 1 +ATOM 3175 C CB . ASN B 2 206 ? 35.512 49.656 105.700 1.00 14.36 ? 206 ASN B CB 1 +ATOM 3176 C CG . ASN B 2 206 ? 34.875 50.173 106.969 1.00 18.60 ? 206 ASN B CG 1 +ATOM 3177 O OD1 . ASN B 2 206 ? 33.666 49.974 107.235 1.00 22.22 ? 206 ASN B OD1 1 +ATOM 3178 N ND2 . ASN B 2 206 ? 35.681 50.866 107.775 1.00 22.28 ? 206 ASN B ND2 1 +ATOM 3179 N N . HIS B 2 207 ? 32.274 49.628 104.257 1.00 14.52 ? 207 HIS B N 1 +ATOM 3180 C CA . HIS B 2 207 ? 31.307 50.502 103.570 1.00 14.28 ? 207 HIS B CA 1 +ATOM 3181 C C . HIS B 2 207 ? 30.592 51.372 104.594 1.00 14.44 ? 207 HIS B C 1 +ATOM 3182 O O . HIS B 2 207 ? 29.444 51.112 104.952 1.00 13.51 ? 207 HIS B O 1 +ATOM 3183 C CB . HIS B 2 207 ? 30.326 49.676 102.724 1.00 14.05 ? 207 HIS B CB 1 +ATOM 3184 C CG . HIS B 2 207 ? 29.188 50.464 102.143 1.00 13.47 ? 207 HIS B CG 1 +ATOM 3185 N ND1 . HIS B 2 207 ? 29.368 51.622 101.410 1.00 10.55 ? 207 HIS B ND1 1 +ATOM 3186 C CD2 . HIS B 2 207 ? 27.850 50.243 102.177 1.00 11.66 ? 207 HIS B CD2 1 +ATOM 3187 C CE1 . HIS B 2 207 ? 28.189 52.077 101.024 1.00 10.89 ? 207 HIS B CE1 1 +ATOM 3188 N NE2 . HIS B 2 207 ? 27.251 51.257 101.471 1.00 9.19 ? 207 HIS B NE2 1 +ATOM 3189 N N . LYS B 2 208 ? 31.310 52.404 105.053 1.00 14.96 ? 208 LYS B N 1 +ATOM 3190 C CA . LYS B 2 208 ? 30.857 53.302 106.106 1.00 15.91 ? 208 LYS B CA 1 +ATOM 3191 C C . LYS B 2 208 ? 29.326 53.592 106.097 1.00 15.84 ? 208 LYS B C 1 +ATOM 3192 O O . LYS B 2 208 ? 28.667 53.440 107.139 1.00 15.35 ? 208 LYS B O 1 +ATOM 3193 C CB . LYS B 2 208 ? 31.706 54.582 106.108 1.00 16.28 ? 208 LYS B CB 1 +ATOM 3194 C CG . LYS B 2 208 ? 31.530 55.481 107.337 1.00 19.31 ? 208 LYS B CG 1 +ATOM 3195 C CD . LYS B 2 208 ? 31.103 56.915 106.927 1.00 23.16 ? 208 LYS B CD 1 +ATOM 3196 C CE . LYS B 2 208 ? 29.859 57.415 107.678 1.00 24.13 ? 208 LYS B CE 1 +ATOM 3197 N NZ . LYS B 2 208 ? 29.869 58.918 107.827 1.00 24.35 ? 208 LYS B NZ 1 +ATOM 3198 N N . PRO B 2 209 ? 28.753 53.974 104.948 1.00 16.05 ? 209 PRO B N 1 +ATOM 3199 C CA . PRO B 2 209 ? 27.303 54.269 104.866 1.00 16.59 ? 209 PRO B CA 1 +ATOM 3200 C C . PRO B 2 209 ? 26.380 53.161 105.409 1.00 17.37 ? 209 PRO B C 1 +ATOM 3201 O O . PRO B 2 209 ? 25.275 53.433 105.872 1.00 17.39 ? 209 PRO B O 1 +ATOM 3202 C CB . PRO B 2 209 ? 27.073 54.421 103.357 1.00 16.40 ? 209 PRO B CB 1 +ATOM 3203 C CG . PRO B 2 209 ? 28.408 54.787 102.783 1.00 15.13 ? 209 PRO B CG 1 +ATOM 3204 C CD . PRO B 2 209 ? 29.426 54.195 103.656 1.00 15.22 ? 209 PRO B CD 1 +ATOM 3205 N N . SER B 2 210 ? 26.867 51.924 105.330 1.00 18.35 ? 210 SER B N 1 +ATOM 3206 C CA . SER B 2 210 ? 26.147 50.692 105.634 1.00 18.62 ? 210 SER B CA 1 +ATOM 3207 C C . SER B 2 210 ? 26.525 50.146 106.997 1.00 19.03 ? 210 SER B C 1 +ATOM 3208 O O . SER B 2 210 ? 25.944 49.144 107.468 1.00 19.14 ? 210 SER B O 1 +ATOM 3209 C CB . SER B 2 210 ? 26.590 49.637 104.628 1.00 18.33 ? 210 SER B CB 1 +ATOM 3210 O OG . SER B 2 210 ? 25.511 49.207 103.830 1.00 19.62 ? 210 SER B OG 1 +ATOM 3211 N N . ASN B 2 211 ? 27.522 50.785 107.609 1.00 19.26 ? 211 ASN B N 1 +ATOM 3212 C CA . ASN B 2 211 ? 28.249 50.219 108.743 1.00 19.46 ? 211 ASN B CA 1 +ATOM 3213 C C . ASN B 2 211 ? 28.663 48.762 108.496 1.00 18.73 ? 211 ASN B C 1 +ATOM 3214 O O . ASN B 2 211 ? 28.658 47.936 109.397 1.00 18.75 ? 211 ASN B O 1 +ATOM 3215 C CB . ASN B 2 211 ? 27.459 50.389 110.048 1.00 19.38 ? 211 ASN B CB 1 +ATOM 3216 C CG . ASN B 2 211 ? 28.312 50.963 111.165 1.00 21.56 ? 211 ASN B CG 1 +ATOM 3217 O OD1 . ASN B 2 211 ? 28.204 50.538 112.312 1.00 24.47 ? 211 ASN B OD1 1 +ATOM 3218 N ND2 . ASN B 2 211 ? 29.173 51.931 110.835 1.00 22.95 ? 211 ASN B ND2 1 +ATOM 3219 N N . THR B 2 212 ? 28.997 48.462 107.249 1.00 18.32 ? 212 THR B N 1 +ATOM 3220 C CA . THR B 2 212 ? 29.539 47.162 106.880 1.00 17.93 ? 212 THR B CA 1 +ATOM 3221 C C . THR B 2 212 ? 31.071 47.117 107.052 1.00 17.26 ? 212 THR B C 1 +ATOM 3222 O O . THR B 2 212 ? 31.801 47.975 106.519 1.00 16.80 ? 212 THR B O 1 +ATOM 3223 C CB . THR B 2 212 ? 29.130 46.816 105.443 1.00 17.98 ? 212 THR B CB 1 +ATOM 3224 O OG1 . THR B 2 212 ? 27.716 46.936 105.303 1.00 17.46 ? 212 THR B OG1 1 +ATOM 3225 C CG2 . THR B 2 212 ? 29.324 45.326 105.178 1.00 21.08 ? 212 THR B CG2 1 +ATOM 3226 N N . LYS B 2 213 ? 31.542 46.146 107.833 1.00 16.54 ? 213 LYS B N 1 +ATOM 3227 C CA . LYS B 2 213 ? 32.977 45.887 107.980 1.00 16.58 ? 213 LYS B CA 1 +ATOM 3228 C C . LYS B 2 213 ? 33.138 44.408 107.777 1.00 15.54 ? 213 LYS B C 1 +ATOM 3229 O O . LYS B 2 213 ? 32.649 43.616 108.579 1.00 15.92 ? 213 LYS B O 1 +ATOM 3230 C CB . LYS B 2 213 ? 33.521 46.244 109.377 1.00 16.82 ? 213 LYS B CB 1 +ATOM 3231 C CG . LYS B 2 213 ? 33.574 47.735 109.718 1.00 19.68 ? 213 LYS B CG 1 +ATOM 3232 C CD . LYS B 2 213 ? 33.730 47.999 111.241 1.00 23.48 ? 213 LYS B CD 1 +ATOM 3233 C CE . LYS B 2 213 ? 32.799 49.146 111.751 1.00 25.30 ? 213 LYS B CE 1 +ATOM 3234 N NZ . LYS B 2 213 ? 31.815 48.684 112.804 1.00 26.91 ? 213 LYS B NZ 1 +ATOM 3235 N N . VAL B 2 214 ? 33.819 44.029 106.708 1.00 14.38 ? 214 VAL B N 1 +ATOM 3236 C CA . VAL B 2 214 ? 34.061 42.624 106.433 1.00 13.00 ? 214 VAL B CA 1 +ATOM 3237 C C . VAL B 2 214 ? 35.560 42.366 106.426 1.00 13.63 ? 214 VAL B C 1 +ATOM 3238 O O . VAL B 2 214 ? 36.338 43.120 105.834 1.00 13.00 ? 214 VAL B O 1 +ATOM 3239 C CB . VAL B 2 214 ? 33.429 42.201 105.096 1.00 12.88 ? 214 VAL B CB 1 +ATOM 3240 C CG1 . VAL B 2 214 ? 34.039 40.870 104.588 1.00 11.86 ? 214 VAL B CG1 1 +ATOM 3241 C CG2 . VAL B 2 214 ? 31.896 42.172 105.203 1.00 8.42 ? 214 VAL B CG2 1 +ATOM 3242 N N . ASP B 2 215 ? 35.971 41.327 107.139 1.00 14.18 ? 215 ASP B N 1 +ATOM 3243 C CA . ASP B 2 215 ? 37.314 40.811 106.974 1.00 14.83 ? 215 ASP B CA 1 +ATOM 3244 C C . ASP B 2 215 ? 37.154 39.433 106.355 1.00 15.02 ? 215 ASP B C 1 +ATOM 3245 O O . ASP B 2 215 ? 36.512 38.554 106.942 1.00 15.59 ? 215 ASP B O 1 +ATOM 3246 C CB . ASP B 2 215 ? 38.045 40.734 108.313 1.00 15.45 ? 215 ASP B CB 1 +ATOM 3247 C CG . ASP B 2 215 ? 38.276 42.116 108.963 1.00 17.55 ? 215 ASP B CG 1 +ATOM 3248 O OD1 . ASP B 2 215 ? 38.196 42.172 110.218 1.00 21.72 ? 215 ASP B OD1 1 +ATOM 3249 O OD2 . ASP B 2 215 ? 38.549 43.177 108.343 1.00 16.41 ? 215 ASP B OD2 1 +ATOM 3250 N N . LYS B 2 216 ? 37.702 39.244 105.158 1.00 15.03 ? 216 LYS B N 1 +ATOM 3251 C CA . LYS B 2 216 ? 37.507 37.994 104.437 1.00 15.02 ? 216 LYS B CA 1 +ATOM 3252 C C . LYS B 2 216 ? 38.844 37.336 104.152 1.00 13.94 ? 216 LYS B C 1 +ATOM 3253 O O . LYS B 2 216 ? 39.656 37.912 103.484 1.00 13.91 ? 216 LYS B O 1 +ATOM 3254 C CB . LYS B 2 216 ? 36.727 38.270 103.139 1.00 15.64 ? 216 LYS B CB 1 +ATOM 3255 C CG . LYS B 2 216 ? 36.241 37.038 102.404 1.00 18.18 ? 216 LYS B CG 1 +ATOM 3256 C CD . LYS B 2 216 ? 34.889 36.577 102.939 1.00 23.78 ? 216 LYS B CD 1 +ATOM 3257 C CE . LYS B 2 216 ? 34.722 35.044 102.849 1.00 27.49 ? 216 LYS B CE 1 +ATOM 3258 N NZ . LYS B 2 216 ? 33.272 34.607 102.967 1.00 28.61 ? 216 LYS B NZ 1 +ATOM 3259 N N . LYS B 2 217 ? 39.078 36.136 104.674 1.00 13.96 ? 217 LYS B N 1 +ATOM 3260 C CA . LYS B 2 217 ? 40.269 35.385 104.294 1.00 13.77 ? 217 LYS B CA 1 +ATOM 3261 C C . LYS B 2 217 ? 40.112 34.855 102.871 1.00 13.71 ? 217 LYS B C 1 +ATOM 3262 O O . LYS B 2 217 ? 39.078 34.300 102.515 1.00 13.44 ? 217 LYS B O 1 +ATOM 3263 C CB . LYS B 2 217 ? 40.552 34.256 105.272 1.00 13.97 ? 217 LYS B CB 1 +ATOM 3264 N N . VAL B 2 218 ? 41.125 35.063 102.045 1.00 13.66 ? 218 VAL B N 1 +ATOM 3265 C CA . VAL B 2 218 ? 41.122 34.519 100.695 1.00 14.30 ? 218 VAL B CA 1 +ATOM 3266 C C . VAL B 2 218 ? 42.177 33.425 100.629 1.00 15.11 ? 218 VAL B C 1 +ATOM 3267 O O . VAL B 2 218 ? 43.321 33.633 101.016 1.00 15.34 ? 218 VAL B O 1 +ATOM 3268 C CB . VAL B 2 218 ? 41.384 35.602 99.620 1.00 13.55 ? 218 VAL B CB 1 +ATOM 3269 C CG1 . VAL B 2 218 ? 41.365 35.004 98.251 1.00 13.05 ? 218 VAL B CG1 1 +ATOM 3270 C CG2 . VAL B 2 218 ? 40.324 36.667 99.673 1.00 14.63 ? 218 VAL B CG2 1 +ATOM 3271 N N . GLU B 2 219 ? 41.787 32.240 100.175 1.00 16.35 ? 219 GLU B N 1 +ATOM 3272 C CA . GLU B 2 219 ? 42.693 31.074 100.211 1.00 17.07 ? 219 GLU B CA 1 +ATOM 3273 C C . GLU B 2 219 ? 42.338 30.081 99.111 1.00 16.61 ? 219 GLU B C 1 +ATOM 3274 O O . GLU B 2 219 ? 41.177 30.006 98.720 1.00 17.42 ? 219 GLU B O 1 +ATOM 3275 C CB . GLU B 2 219 ? 42.674 30.418 101.592 1.00 16.82 ? 219 GLU B CB 1 +ATOM 3276 C CG . GLU B 2 219 ? 41.363 29.749 101.935 1.00 20.57 ? 219 GLU B CG 1 +ATOM 3277 C CD . GLU B 2 219 ? 41.222 29.419 103.411 1.00 25.45 ? 219 GLU B CD 1 +ATOM 3278 O OE1 . GLU B 2 219 ? 42.167 28.843 104.008 1.00 24.38 ? 219 GLU B OE1 1 +ATOM 3279 O OE2 . GLU B 2 219 ? 40.140 29.737 103.969 1.00 29.09 ? 219 GLU B OE2 1 +ATOM 3280 N N . PRO B 2 220 ? 43.323 29.366 98.569 1.00 16.61 ? 220 PRO B N 1 +ATOM 3281 C CA . PRO B 2 220 ? 43.071 28.375 97.505 1.00 16.56 ? 220 PRO B CA 1 +ATOM 3282 C C . PRO B 2 220 ? 41.859 27.460 97.721 1.00 16.55 ? 220 PRO B C 1 +ATOM 3283 O O . PRO B 2 220 ? 41.703 26.816 98.757 1.00 16.12 ? 220 PRO B O 1 +ATOM 3284 C CB . PRO B 2 220 ? 44.369 27.593 97.479 1.00 16.50 ? 220 PRO B CB 1 +ATOM 3285 C CG . PRO B 2 220 ? 45.392 28.683 97.768 1.00 15.80 ? 220 PRO B CG 1 +ATOM 3286 C CD . PRO B 2 220 ? 44.767 29.477 98.870 1.00 16.34 ? 220 PRO B CD 1 +ATOM 3287 O OXT . PRO B 2 220 ? 40.991 27.384 96.843 1.00 16.81 ? 220 PRO B OXT 1 +ATOM 3288 N N . THR C 3 1 ? -14.081 82.809 118.886 1.00 25.94 ? 1 THR C N 1 +ATOM 3289 C CA . THR C 3 1 ? -13.448 83.309 120.146 1.00 26.06 ? 1 THR C CA 1 +ATOM 3290 C C . THR C 3 1 ? -14.468 83.170 121.263 1.00 26.07 ? 1 THR C C 1 +ATOM 3291 O O . THR C 3 1 ? -14.732 84.086 122.069 1.00 26.12 ? 1 THR C O 1 +ATOM 3292 C CB . THR C 3 1 ? -12.892 84.742 120.026 1.00 25.95 ? 1 THR C CB 1 +ATOM 3293 O OG1 . THR C 3 1 ? -11.926 84.785 118.973 1.00 26.47 ? 1 THR C OG1 1 +ATOM 3294 C CG2 . THR C 3 1 ? -12.047 85.063 121.228 1.00 25.68 ? 1 THR C CG2 1 +ATOM 3295 N N . GLN C 3 2 ? -15.021 81.964 121.270 1.00 25.46 ? 2 GLN C N 1 +ATOM 3296 C CA . GLN C 3 2 ? -15.849 81.450 122.314 1.00 24.33 ? 2 GLN C CA 1 +ATOM 3297 C C . GLN C 3 2 ? -15.045 81.291 123.597 1.00 23.54 ? 2 GLN C C 1 +ATOM 3298 O O . GLN C 3 2 ? -15.623 81.068 124.630 1.00 23.35 ? 2 GLN C O 1 +ATOM 3299 C CB . GLN C 3 2 ? -16.380 80.083 121.859 1.00 25.07 ? 2 GLN C CB 1 +ATOM 3300 C CG . GLN C 3 2 ? -15.324 79.134 121.243 1.00 25.27 ? 2 GLN C CG 1 +ATOM 3301 C CD . GLN C 3 2 ? -15.856 78.308 120.086 1.00 28.39 ? 2 GLN C CD 1 +ATOM 3302 O OE1 . GLN C 3 2 ? -15.113 77.534 119.476 1.00 30.46 ? 2 GLN C OE1 1 +ATOM 3303 N NE2 . GLN C 3 2 ? -17.134 78.474 119.767 1.00 29.54 ? 2 GLN C NE2 1 +ATOM 3304 N N . VAL C 3 3 ? -13.717 81.397 123.534 1.00 23.20 ? 3 VAL C N 1 +ATOM 3305 C CA . VAL C 3 3 ? -12.851 81.118 124.696 1.00 23.23 ? 3 VAL C CA 1 +ATOM 3306 C C . VAL C 3 3 ? -11.940 82.256 125.260 1.00 23.40 ? 3 VAL C C 1 +ATOM 3307 O O . VAL C 3 3 ? -11.086 82.812 124.562 1.00 23.01 ? 3 VAL C O 1 +ATOM 3308 C CB . VAL C 3 3 ? -11.979 79.837 124.491 1.00 23.26 ? 3 VAL C CB 1 +ATOM 3309 C CG1 . VAL C 3 3 ? -11.898 79.090 125.789 1.00 24.35 ? 3 VAL C CG1 1 +ATOM 3310 C CG2 . VAL C 3 3 ? -12.540 78.909 123.417 1.00 22.46 ? 3 VAL C CG2 1 +ATOM 3311 N N . CYS C 3 4 ? -12.127 82.572 126.540 1.00 23.19 ? 4 CYS C N 1 +ATOM 3312 C CA . CYS C 3 4 ? -11.268 83.517 127.256 1.00 23.22 ? 4 CYS C CA 1 +ATOM 3313 C C . CYS C 3 4 ? -10.648 82.883 128.516 1.00 22.80 ? 4 CYS C C 1 +ATOM 3314 O O . CYS C 3 4 ? -10.997 81.781 128.912 1.00 22.36 ? 4 CYS C O 1 +ATOM 3315 C CB . CYS C 3 4 ? -12.083 84.740 127.655 1.00 23.71 ? 4 CYS C CB 1 +ATOM 3316 S SG . CYS C 3 4 ? -13.544 84.330 128.685 1.00 25.67 ? 4 CYS C SG 1 +ATOM 3317 N N . THR C 3 5 ? -9.703 83.566 129.131 1.00 22.77 ? 5 THR C N 1 +ATOM 3318 C CA . THR C 3 5 ? -9.210 83.118 130.419 1.00 23.31 ? 5 THR C CA 1 +ATOM 3319 C C . THR C 3 5 ? -9.865 83.993 131.440 1.00 23.05 ? 5 THR C C 1 +ATOM 3320 O O . THR C 3 5 ? -10.317 85.087 131.113 1.00 24.35 ? 5 THR C O 1 +ATOM 3321 C CB . THR C 3 5 ? -7.692 83.206 130.498 1.00 23.74 ? 5 THR C CB 1 +ATOM 3322 O OG1 . THR C 3 5 ? -7.134 82.373 129.461 1.00 25.62 ? 5 THR C OG1 1 +ATOM 3323 C CG2 . THR C 3 5 ? -7.191 82.549 131.798 1.00 23.90 ? 5 THR C CG2 1 +ATOM 3324 N N . GLY C 3 6 ? -9.984 83.510 132.664 1.00 22.05 ? 6 GLY C N 1 +ATOM 3325 C CA . GLY C 3 6 ? -10.590 84.321 133.690 1.00 20.36 ? 6 GLY C CA 1 +ATOM 3326 C C . GLY C 3 6 ? -9.480 85.071 134.371 1.00 19.75 ? 6 GLY C C 1 +ATOM 3327 O O . GLY C 3 6 ? -8.418 85.343 133.776 1.00 19.01 ? 6 GLY C O 1 +ATOM 3328 N N . THR C 3 7 ? -9.728 85.395 135.630 1.00 18.74 ? 7 THR C N 1 +ATOM 3329 C CA . THR C 3 7 ? -8.796 86.188 136.410 1.00 18.53 ? 7 THR C CA 1 +ATOM 3330 C C . THR C 3 7 ? -8.448 85.415 137.675 1.00 18.58 ? 7 THR C C 1 +ATOM 3331 O O . THR C 3 7 ? -8.940 84.308 137.877 1.00 18.85 ? 7 THR C O 1 +ATOM 3332 C CB . THR C 3 7 ? -9.425 87.514 136.725 1.00 18.24 ? 7 THR C CB 1 +ATOM 3333 O OG1 . THR C 3 7 ? -10.699 87.270 137.322 1.00 19.72 ? 7 THR C OG1 1 +ATOM 3334 C CG2 . THR C 3 7 ? -9.779 88.234 135.429 1.00 16.72 ? 7 THR C CG2 1 +ATOM 3335 N N . ASP C 3 8 ? -7.578 85.960 138.509 1.00 18.38 ? 8 ASP C N 1 +ATOM 3336 C CA . ASP C 3 8 ? -7.181 85.257 139.725 1.00 18.91 ? 8 ASP C CA 1 +ATOM 3337 C C . ASP C 3 8 ? -6.941 86.277 140.807 1.00 18.62 ? 8 ASP C C 1 +ATOM 3338 O O . ASP C 3 8 ? -5.906 86.287 141.469 1.00 19.39 ? 8 ASP C O 1 +ATOM 3339 C CB . ASP C 3 8 ? -5.938 84.397 139.493 1.00 19.41 ? 8 ASP C CB 1 +ATOM 3340 C CG . ASP C 3 8 ? -5.834 83.249 140.480 1.00 22.09 ? 8 ASP C CG 1 +ATOM 3341 O OD1 . ASP C 3 8 ? -6.445 83.342 141.572 1.00 23.90 ? 8 ASP C OD1 1 +ATOM 3342 O OD2 . ASP C 3 8 ? -5.175 82.199 140.243 1.00 24.58 ? 8 ASP C OD2 1 +ATOM 3343 N N . MET C 3 9 ? -7.921 87.147 140.968 1.00 18.92 ? 9 MET C N 1 +ATOM 3344 C CA . MET C 3 9 ? -7.827 88.282 141.872 1.00 18.80 ? 9 MET C CA 1 +ATOM 3345 C C . MET C 3 9 ? -8.477 88.052 143.224 1.00 18.56 ? 9 MET C C 1 +ATOM 3346 O O . MET C 3 9 ? -8.220 88.798 144.152 1.00 19.19 ? 9 MET C O 1 +ATOM 3347 C CB . MET C 3 9 ? -8.453 89.514 141.228 1.00 18.88 ? 9 MET C CB 1 +ATOM 3348 C CG . MET C 3 9 ? -9.908 89.375 140.823 1.00 19.28 ? 9 MET C CG 1 +ATOM 3349 S SD . MET C 3 9 ? -10.460 90.913 140.024 1.00 22.29 ? 9 MET C SD 1 +ATOM 3350 C CE . MET C 3 9 ? -9.590 90.835 138.474 1.00 23.97 ? 9 MET C CE 1 +ATOM 3351 N N . LYS C 3 10 ? -9.318 87.035 143.339 1.00 18.30 ? 10 LYS C N 1 +ATOM 3352 C CA . LYS C 3 10 ? -10.090 86.831 144.554 1.00 18.45 ? 10 LYS C CA 1 +ATOM 3353 C C . LYS C 3 10 ? -10.728 88.154 145.040 1.00 17.85 ? 10 LYS C C 1 +ATOM 3354 O O . LYS C 3 10 ? -11.437 88.828 144.294 1.00 17.96 ? 10 LYS C O 1 +ATOM 3355 C CB . LYS C 3 10 ? -9.242 86.159 145.659 1.00 18.11 ? 10 LYS C CB 1 +ATOM 3356 C CG . LYS C 3 10 ? -8.778 84.756 145.302 1.00 20.70 ? 10 LYS C CG 1 +ATOM 3357 C CD . LYS C 3 10 ? -7.296 84.506 145.689 1.00 25.01 ? 10 LYS C CD 1 +ATOM 3358 C CE . LYS C 3 10 ? -7.005 82.990 145.929 1.00 26.47 ? 10 LYS C CE 1 +ATOM 3359 N NZ . LYS C 3 10 ? -5.560 82.649 146.253 1.00 24.24 ? 10 LYS C NZ 1 +ATOM 3360 N N . LEU C 3 11 ? -10.431 88.534 146.278 1.00 17.36 ? 11 LEU C N 1 +ATOM 3361 C CA . LEU C 3 11 ? -11.154 89.607 146.945 1.00 16.57 ? 11 LEU C CA 1 +ATOM 3362 C C . LEU C 3 11 ? -10.399 90.922 146.950 1.00 16.19 ? 11 LEU C C 1 +ATOM 3363 O O . LEU C 3 11 ? -10.750 91.848 147.670 1.00 15.69 ? 11 LEU C O 1 +ATOM 3364 C CB . LEU C 3 11 ? -11.498 89.181 148.367 1.00 16.39 ? 11 LEU C CB 1 +ATOM 3365 C CG . LEU C 3 11 ? -12.694 88.239 148.483 1.00 15.97 ? 11 LEU C CG 1 +ATOM 3366 C CD1 . LEU C 3 11 ? -13.103 88.027 149.960 1.00 17.55 ? 11 LEU C CD1 1 +ATOM 3367 C CD2 . LEU C 3 11 ? -13.856 88.784 147.699 1.00 15.21 ? 11 LEU C CD2 1 +ATOM 3368 N N . ARG C 3 12 ? -9.387 91.003 146.100 1.00 16.21 ? 12 ARG C N 1 +ATOM 3369 C CA . ARG C 3 12 ? -8.514 92.160 146.021 1.00 16.44 ? 12 ARG C CA 1 +ATOM 3370 C C . ARG C 3 12 ? -9.147 93.362 145.336 1.00 15.61 ? 12 ARG C C 1 +ATOM 3371 O O . ARG C 3 12 ? -9.745 93.246 144.285 1.00 16.09 ? 12 ARG C O 1 +ATOM 3372 C CB . ARG C 3 12 ? -7.256 91.761 145.281 1.00 16.74 ? 12 ARG C CB 1 +ATOM 3373 C CG . ARG C 3 12 ? -6.238 91.159 146.182 1.00 19.62 ? 12 ARG C CG 1 +ATOM 3374 C CD . ARG C 3 12 ? -5.068 90.551 145.458 1.00 24.76 ? 12 ARG C CD 1 +ATOM 3375 N NE . ARG C 3 12 ? -5.019 89.124 145.735 1.00 30.17 ? 12 ARG C NE 1 +ATOM 3376 C CZ . ARG C 3 12 ? -4.434 88.226 144.960 1.00 33.80 ? 12 ARG C CZ 1 +ATOM 3377 N NH1 . ARG C 3 12 ? -3.838 88.600 143.826 1.00 34.44 ? 12 ARG C NH1 1 +ATOM 3378 N NH2 . ARG C 3 12 ? -4.453 86.945 145.325 1.00 36.35 ? 12 ARG C NH2 1 +ATOM 3379 N N . LEU C 3 13 ? -8.995 94.527 145.925 1.00 15.21 ? 13 LEU C N 1 +ATOM 3380 C CA . LEU C 3 13 ? -9.552 95.733 145.348 1.00 15.01 ? 13 LEU C CA 1 +ATOM 3381 C C . LEU C 3 13 ? -8.766 96.014 144.081 1.00 14.86 ? 13 LEU C C 1 +ATOM 3382 O O . LEU C 3 13 ? -7.556 95.945 144.111 1.00 15.38 ? 13 LEU C O 1 +ATOM 3383 C CB . LEU C 3 13 ? -9.435 96.873 146.362 1.00 14.98 ? 13 LEU C CB 1 +ATOM 3384 C CG . LEU C 3 13 ? -9.511 98.342 145.957 1.00 15.81 ? 13 LEU C CG 1 +ATOM 3385 C CD1 . LEU C 3 13 ? -10.915 98.872 146.003 1.00 16.95 ? 13 LEU C CD1 1 +ATOM 3386 C CD2 . LEU C 3 13 ? -8.660 99.130 146.901 1.00 17.40 ? 13 LEU C CD2 1 +ATOM 3387 N N . PRO C 3 14 ? -9.444 96.256 142.960 1.00 14.90 ? 14 PRO C N 1 +ATOM 3388 C CA . PRO C 3 14 ? -8.803 96.783 141.747 1.00 14.58 ? 14 PRO C CA 1 +ATOM 3389 C C . PRO C 3 14 ? -8.135 98.118 142.003 1.00 14.75 ? 14 PRO C C 1 +ATOM 3390 O O . PRO C 3 14 ? -8.705 98.979 142.673 1.00 15.24 ? 14 PRO C O 1 +ATOM 3391 C CB . PRO C 3 14 ? -9.977 97.019 140.826 1.00 14.24 ? 14 PRO C CB 1 +ATOM 3392 C CG . PRO C 3 14 ? -10.971 95.995 141.268 1.00 15.02 ? 14 PRO C CG 1 +ATOM 3393 C CD . PRO C 3 14 ? -10.881 96.000 142.751 1.00 15.05 ? 14 PRO C CD 1 +ATOM 3394 N N . ALA C 3 15 ? -6.932 98.298 141.474 1.00 14.84 ? 15 ALA C N 1 +ATOM 3395 C CA . ALA C 3 15 ? -6.228 99.564 141.655 1.00 14.44 ? 15 ALA C CA 1 +ATOM 3396 C C . ALA C 3 15 ? -7.000 100.715 141.038 1.00 14.25 ? 15 ALA C C 1 +ATOM 3397 O O . ALA C 3 15 ? -6.813 101.848 141.436 1.00 14.51 ? 15 ALA C O 1 +ATOM 3398 C CB . ALA C 3 15 ? -4.815 99.502 141.106 1.00 14.23 ? 15 ALA C CB 1 +ATOM 3399 N N . SER C 3 16 ? -7.863 100.446 140.070 1.00 13.99 ? 16 SER C N 1 +ATOM 3400 C CA . SER C 3 16 ? -8.757 101.500 139.608 1.00 14.25 ? 16 SER C CA 1 +ATOM 3401 C C . SER C 3 16 ? -9.989 100.949 138.941 1.00 14.65 ? 16 SER C C 1 +ATOM 3402 O O . SER C 3 16 ? -9.907 100.186 137.972 1.00 14.05 ? 16 SER C O 1 +ATOM 3403 C CB . SER C 3 16 ? -8.059 102.511 138.699 1.00 14.63 ? 16 SER C CB 1 +ATOM 3404 O OG . SER C 3 16 ? -8.085 102.086 137.360 1.00 13.51 ? 16 SER C OG 1 +ATOM 3405 N N . PRO C 3 17 ? -11.134 101.341 139.494 1.00 14.97 ? 17 PRO C N 1 +ATOM 3406 C CA . PRO C 3 17 ? -12.430 100.794 139.089 1.00 14.92 ? 17 PRO C CA 1 +ATOM 3407 C C . PRO C 3 17 ? -12.720 101.068 137.609 1.00 15.27 ? 17 PRO C C 1 +ATOM 3408 O O . PRO C 3 17 ? -13.111 100.154 136.875 1.00 15.88 ? 17 PRO C O 1 +ATOM 3409 C CB . PRO C 3 17 ? -13.416 101.530 140.006 1.00 15.00 ? 17 PRO C CB 1 +ATOM 3410 C CG . PRO C 3 17 ? -12.585 102.014 141.160 1.00 14.83 ? 17 PRO C CG 1 +ATOM 3411 C CD . PRO C 3 17 ? -11.253 102.345 140.572 1.00 14.67 ? 17 PRO C CD 1 +ATOM 3412 N N . GLU C 3 18 ? -12.517 102.309 137.186 1.00 15.38 ? 18 GLU C N 1 +ATOM 3413 C CA . GLU C 3 18 ? -12.681 102.739 135.804 1.00 15.80 ? 18 GLU C CA 1 +ATOM 3414 C C . GLU C 3 18 ? -12.150 101.672 134.835 1.00 15.69 ? 18 GLU C C 1 +ATOM 3415 O O . GLU C 3 18 ? -12.859 101.171 133.957 1.00 15.73 ? 18 GLU C O 1 +ATOM 3416 C CB . GLU C 3 18 ? -11.961 104.083 135.638 1.00 16.54 ? 18 GLU C CB 1 +ATOM 3417 C CG . GLU C 3 18 ? -11.908 104.903 136.953 1.00 18.64 ? 18 GLU C CG 1 +ATOM 3418 C CD . GLU C 3 18 ? -10.756 105.924 137.035 1.00 21.00 ? 18 GLU C CD 1 +ATOM 3419 O OE1 . GLU C 3 18 ? -9.699 105.632 137.667 1.00 21.13 ? 18 GLU C OE1 1 +ATOM 3420 O OE2 . GLU C 3 18 ? -10.914 107.038 136.490 1.00 20.33 ? 18 GLU C OE2 1 +ATOM 3421 N N . THR C 3 19 ? -10.908 101.284 135.054 1.00 15.32 ? 19 THR C N 1 +ATOM 3422 C CA . THR C 3 19 ? -10.214 100.282 134.260 1.00 15.32 ? 19 THR C CA 1 +ATOM 3423 C C . THR C 3 19 ? -10.643 98.854 134.526 1.00 14.68 ? 19 THR C C 1 +ATOM 3424 O O . THR C 3 19 ? -10.486 97.996 133.663 1.00 14.04 ? 19 THR C O 1 +ATOM 3425 C CB . THR C 3 19 ? -8.767 100.376 134.614 1.00 15.47 ? 19 THR C CB 1 +ATOM 3426 O OG1 . THR C 3 19 ? -8.504 101.705 135.072 1.00 18.76 ? 19 THR C OG1 1 +ATOM 3427 C CG2 . THR C 3 19 ? -7.929 100.311 133.380 1.00 17.56 ? 19 THR C CG2 1 +ATOM 3428 N N . HIS C 3 20 ? -11.140 98.611 135.743 1.00 14.23 ? 20 HIS C N 1 +ATOM 3429 C CA . HIS C 3 20 ? -11.609 97.312 136.179 1.00 13.43 ? 20 HIS C CA 1 +ATOM 3430 C C . HIS C 3 20 ? -12.787 96.913 135.324 1.00 13.08 ? 20 HIS C C 1 +ATOM 3431 O O . HIS C 3 20 ? -12.891 95.767 134.923 1.00 13.19 ? 20 HIS C O 1 +ATOM 3432 C CB . HIS C 3 20 ? -12.004 97.331 137.669 1.00 13.43 ? 20 HIS C CB 1 +ATOM 3433 C CG . HIS C 3 20 ? -12.487 96.010 138.190 1.00 13.84 ? 20 HIS C CG 1 +ATOM 3434 N ND1 . HIS C 3 20 ? -11.680 94.894 138.263 1.00 13.67 ? 20 HIS C ND1 1 +ATOM 3435 C CD2 . HIS C 3 20 ? -13.704 95.619 138.642 1.00 14.82 ? 20 HIS C CD2 1 +ATOM 3436 C CE1 . HIS C 3 20 ? -12.374 93.880 138.749 1.00 14.37 ? 20 HIS C CE1 1 +ATOM 3437 N NE2 . HIS C 3 20 ? -13.608 94.290 138.979 1.00 13.98 ? 20 HIS C NE2 1 +ATOM 3438 N N . LEU C 3 21 ? -13.671 97.858 135.040 1.00 12.56 ? 21 LEU C N 1 +ATOM 3439 C CA . LEU C 3 21 ? -14.836 97.544 134.241 1.00 12.14 ? 21 LEU C CA 1 +ATOM 3440 C C . LEU C 3 21 ? -14.456 97.253 132.799 1.00 12.29 ? 21 LEU C C 1 +ATOM 3441 O O . LEU C 3 21 ? -14.928 96.264 132.197 1.00 12.29 ? 21 LEU C O 1 +ATOM 3442 C CB . LEU C 3 21 ? -15.834 98.668 134.294 1.00 12.03 ? 21 LEU C CB 1 +ATOM 3443 C CG . LEU C 3 21 ? -17.148 98.243 134.889 1.00 12.63 ? 21 LEU C CG 1 +ATOM 3444 C CD1 . LEU C 3 21 ? -18.001 99.486 134.984 1.00 15.82 ? 21 LEU C CD1 1 +ATOM 3445 C CD2 . LEU C 3 21 ? -17.803 97.154 134.034 1.00 11.82 ? 21 LEU C CD2 1 +ATOM 3446 N N . ASP C 3 22 ? -13.582 98.098 132.253 1.00 12.15 ? 22 ASP C N 1 +ATOM 3447 C CA . ASP C 3 22 ? -13.067 97.890 130.906 1.00 11.94 ? 22 ASP C CA 1 +ATOM 3448 C C . ASP C 3 22 ? -12.370 96.536 130.723 1.00 12.07 ? 22 ASP C C 1 +ATOM 3449 O O . ASP C 3 22 ? -12.586 95.864 129.710 1.00 12.75 ? 22 ASP C O 1 +ATOM 3450 C CB . ASP C 3 22 ? -12.188 99.034 130.501 1.00 11.60 ? 22 ASP C CB 1 +ATOM 3451 C CG . ASP C 3 22 ? -12.965 100.318 130.345 1.00 12.49 ? 22 ASP C CG 1 +ATOM 3452 O OD1 . ASP C 3 22 ? -12.417 101.361 130.736 1.00 14.58 ? 22 ASP C OD1 1 +ATOM 3453 O OD2 . ASP C 3 22 ? -14.107 100.397 129.835 1.00 11.44 ? 22 ASP C OD2 1 +ATOM 3454 N N . MET C 3 23 ? -11.587 96.114 131.708 1.00 11.79 ? 23 MET C N 1 +ATOM 3455 C CA . MET C 3 23 ? -10.907 94.834 131.628 1.00 12.04 ? 23 MET C CA 1 +ATOM 3456 C C . MET C 3 23 ? -11.938 93.700 131.584 1.00 12.48 ? 23 MET C C 1 +ATOM 3457 O O . MET C 3 23 ? -11.950 92.893 130.669 1.00 12.29 ? 23 MET C O 1 +ATOM 3458 C CB . MET C 3 23 ? -9.944 94.686 132.797 1.00 11.65 ? 23 MET C CB 1 +ATOM 3459 C CG . MET C 3 23 ? -9.251 93.362 132.875 1.00 10.48 ? 23 MET C CG 1 +ATOM 3460 S SD . MET C 3 23 ? -10.296 92.168 133.649 1.00 7.57 ? 23 MET C SD 1 +ATOM 3461 C CE . MET C 3 23 ? -10.269 92.701 135.318 1.00 8.77 ? 23 MET C CE 1 +ATOM 3462 N N . LEU C 3 24 ? -12.829 93.686 132.560 1.00 13.14 ? 24 LEU C N 1 +ATOM 3463 C CA . LEU C 3 24 ? -13.938 92.741 132.613 1.00 13.38 ? 24 LEU C CA 1 +ATOM 3464 C C . LEU C 3 24 ? -14.661 92.616 131.258 1.00 13.73 ? 24 LEU C C 1 +ATOM 3465 O O . LEU C 3 24 ? -14.946 91.507 130.801 1.00 15.53 ? 24 LEU C O 1 +ATOM 3466 C CB . LEU C 3 24 ? -14.890 93.193 133.707 1.00 12.77 ? 24 LEU C CB 1 +ATOM 3467 C CG . LEU C 3 24 ? -14.998 92.411 135.000 1.00 13.70 ? 24 LEU C CG 1 +ATOM 3468 C CD1 . LEU C 3 24 ? -13.786 91.565 135.325 1.00 15.64 ? 24 LEU C CD1 1 +ATOM 3469 C CD2 . LEU C 3 24 ? -15.341 93.278 136.172 1.00 14.31 ? 24 LEU C CD2 1 +ATOM 3470 N N . ARG C 3 25 ? -14.931 93.744 130.608 1.00 13.29 ? 25 ARG C N 1 +ATOM 3471 C CA . ARG C 3 25 ? -15.630 93.772 129.321 1.00 12.95 ? 25 ARG C CA 1 +ATOM 3472 C C . ARG C 3 25 ? -14.813 93.176 128.201 1.00 12.66 ? 25 ARG C C 1 +ATOM 3473 O O . ARG C 3 25 ? -15.297 92.306 127.479 1.00 13.79 ? 25 ARG C O 1 +ATOM 3474 C CB . ARG C 3 25 ? -15.985 95.212 128.942 1.00 13.22 ? 25 ARG C CB 1 +ATOM 3475 C CG . ARG C 3 25 ? -16.654 95.362 127.569 1.00 14.28 ? 25 ARG C CG 1 +ATOM 3476 C CD . ARG C 3 25 ? -17.344 96.708 127.366 1.00 17.01 ? 25 ARG C CD 1 +ATOM 3477 N NE . ARG C 3 25 ? -16.403 97.822 127.476 1.00 18.77 ? 25 ARG C NE 1 +ATOM 3478 C CZ . ARG C 3 25 ? -15.432 98.075 126.587 1.00 21.99 ? 25 ARG C CZ 1 +ATOM 3479 N NH1 . ARG C 3 25 ? -15.271 97.285 125.517 1.00 22.75 ? 25 ARG C NH1 1 +ATOM 3480 N NH2 . ARG C 3 25 ? -14.615 99.115 126.762 1.00 19.99 ? 25 ARG C NH2 1 +ATOM 3481 N N . HIS C 3 26 ? -13.587 93.674 128.043 1.00 11.11 ? 26 HIS C N 1 +ATOM 3482 C CA . HIS C 3 26 ? -12.606 93.126 127.126 1.00 9.74 ? 26 HIS C CA 1 +ATOM 3483 C C . HIS C 3 26 ? -12.355 91.634 127.283 1.00 10.35 ? 26 HIS C C 1 +ATOM 3484 O O . HIS C 3 26 ? -12.106 90.925 126.317 1.00 10.34 ? 26 HIS C O 1 +ATOM 3485 C CB . HIS C 3 26 ? -11.294 93.798 127.416 1.00 9.61 ? 26 HIS C CB 1 +ATOM 3486 C CG . HIS C 3 26 ? -11.118 95.103 126.727 1.00 5.60 ? 26 HIS C CG 1 +ATOM 3487 N ND1 . HIS C 3 26 ? -10.939 95.199 125.370 1.00 4.90 ? 26 HIS C ND1 1 +ATOM 3488 C CD2 . HIS C 3 26 ? -11.089 96.365 127.203 1.00 4.03 ? 26 HIS C CD2 1 +ATOM 3489 C CE1 . HIS C 3 26 ? -10.798 96.469 125.031 1.00 5.53 ? 26 HIS C CE1 1 +ATOM 3490 N NE2 . HIS C 3 26 ? -10.884 97.199 126.127 1.00 6.89 ? 26 HIS C NE2 1 +ATOM 3491 N N . LEU C 3 27 ? -12.391 91.172 128.523 1.00 11.21 ? 27 LEU C N 1 +ATOM 3492 C CA . LEU C 3 27 ? -12.054 89.824 128.860 1.00 11.76 ? 27 LEU C CA 1 +ATOM 3493 C C . LEU C 3 27 ? -13.190 88.951 128.451 1.00 12.67 ? 27 LEU C C 1 +ATOM 3494 O O . LEU C 3 27 ? -12.983 87.906 127.829 1.00 12.27 ? 27 LEU C O 1 +ATOM 3495 C CB . LEU C 3 27 ? -11.888 89.720 130.355 1.00 11.97 ? 27 LEU C CB 1 +ATOM 3496 C CG . LEU C 3 27 ? -11.033 88.611 130.948 1.00 14.24 ? 27 LEU C CG 1 +ATOM 3497 C CD1 . LEU C 3 27 ? -10.081 87.960 129.906 1.00 16.63 ? 27 LEU C CD1 1 +ATOM 3498 C CD2 . LEU C 3 27 ? -10.246 89.201 132.087 1.00 14.62 ? 27 LEU C CD2 1 +ATOM 3499 N N . TYR C 3 28 ? -14.410 89.390 128.782 1.00 13.84 ? 28 TYR C N 1 +ATOM 3500 C CA . TYR C 3 28 ? -15.584 88.527 128.600 1.00 14.21 ? 28 TYR C CA 1 +ATOM 3501 C C . TYR C 3 28 ? -16.477 88.768 127.395 1.00 14.08 ? 28 TYR C C 1 +ATOM 3502 O O . TYR C 3 28 ? -17.241 87.888 127.046 1.00 13.74 ? 28 TYR C O 1 +ATOM 3503 C CB . TYR C 3 28 ? -16.415 88.479 129.878 1.00 14.27 ? 28 TYR C CB 1 +ATOM 3504 C CG . TYR C 3 28 ? -15.628 87.899 131.000 1.00 14.80 ? 28 TYR C CG 1 +ATOM 3505 C CD1 . TYR C 3 28 ? -15.321 88.664 132.121 1.00 13.56 ? 28 TYR C CD1 1 +ATOM 3506 C CD2 . TYR C 3 28 ? -15.149 86.581 130.938 1.00 14.39 ? 28 TYR C CD2 1 +ATOM 3507 C CE1 . TYR C 3 28 ? -14.590 88.138 133.168 1.00 9.82 ? 28 TYR C CE1 1 +ATOM 3508 C CE2 . TYR C 3 28 ? -14.418 86.045 132.001 1.00 13.50 ? 28 TYR C CE2 1 +ATOM 3509 C CZ . TYR C 3 28 ? -14.135 86.849 133.095 1.00 11.05 ? 28 TYR C CZ 1 +ATOM 3510 O OH . TYR C 3 28 ? -13.393 86.351 134.131 1.00 15.83 ? 28 TYR C OH 1 +ATOM 3511 N N . GLN C 3 29 ? -16.393 89.925 126.748 1.00 14.78 ? 29 GLN C N 1 +ATOM 3512 C CA . GLN C 3 29 ? -17.347 90.171 125.690 1.00 15.94 ? 29 GLN C CA 1 +ATOM 3513 C C . GLN C 3 29 ? -17.184 89.149 124.609 1.00 16.22 ? 29 GLN C C 1 +ATOM 3514 O O . GLN C 3 29 ? -16.090 88.959 124.108 1.00 16.65 ? 29 GLN C O 1 +ATOM 3515 C CB . GLN C 3 29 ? -17.301 91.575 125.090 1.00 16.23 ? 29 GLN C CB 1 +ATOM 3516 C CG . GLN C 3 29 ? -18.731 91.943 124.646 1.00 18.04 ? 29 GLN C CG 1 +ATOM 3517 C CD . GLN C 3 29 ? -18.783 92.941 123.556 1.00 23.53 ? 29 GLN C CD 1 +ATOM 3518 O OE1 . GLN C 3 29 ? -17.803 93.658 123.312 1.00 26.15 ? 29 GLN C OE1 1 +ATOM 3519 N NE2 . GLN C 3 29 ? -19.931 93.023 122.887 1.00 24.43 ? 29 GLN C NE2 1 +ATOM 3520 N N . GLY C 3 30 ? -18.286 88.487 124.280 1.00 16.65 ? 30 GLY C N 1 +ATOM 3521 C CA . GLY C 3 30 ? -18.320 87.494 123.227 1.00 17.04 ? 30 GLY C CA 1 +ATOM 3522 C C . GLY C 3 30 ? -17.899 86.124 123.717 1.00 17.27 ? 30 GLY C C 1 +ATOM 3523 O O . GLY C 3 30 ? -17.958 85.158 122.956 1.00 17.73 ? 30 GLY C O 1 +ATOM 3524 N N . CYS C 3 31 ? -17.483 86.045 124.972 1.00 17.00 ? 31 CYS C N 1 +ATOM 3525 C CA . CYS C 3 31 ? -16.875 84.847 125.517 1.00 18.19 ? 31 CYS C CA 1 +ATOM 3526 C C . CYS C 3 31 ? -17.950 83.859 125.880 1.00 17.87 ? 31 CYS C C 1 +ATOM 3527 O O . CYS C 3 31 ? -18.966 84.247 126.460 1.00 19.87 ? 31 CYS C O 1 +ATOM 3528 C CB . CYS C 3 31 ? -16.064 85.203 126.770 1.00 18.69 ? 31 CYS C CB 1 +ATOM 3529 S SG . CYS C 3 31 ? -15.146 83.827 127.518 1.00 23.50 ? 31 CYS C SG 1 +ATOM 3530 N N . GLN C 3 32 ? -17.732 82.587 125.573 1.00 16.83 ? 32 GLN C N 1 +ATOM 3531 C CA . GLN C 3 32 ? -18.625 81.512 126.031 1.00 16.20 ? 32 GLN C CA 1 +ATOM 3532 C C . GLN C 3 32 ? -17.996 80.525 127.026 1.00 15.17 ? 32 GLN C C 1 +ATOM 3533 O O . GLN C 3 32 ? -18.712 79.933 127.828 1.00 15.56 ? 32 GLN C O 1 +ATOM 3534 C CB . GLN C 3 32 ? -19.166 80.751 124.851 1.00 16.31 ? 32 GLN C CB 1 +ATOM 3535 C CG . GLN C 3 32 ? -19.698 81.700 123.852 1.00 19.52 ? 32 GLN C CG 1 +ATOM 3536 C CD . GLN C 3 32 ? -20.291 81.054 122.645 1.00 20.91 ? 32 GLN C CD 1 +ATOM 3537 O OE1 . GLN C 3 32 ? -19.593 80.407 121.839 1.00 19.16 ? 32 GLN C OE1 1 +ATOM 3538 N NE2 . GLN C 3 32 ? -21.599 81.245 122.491 1.00 22.95 ? 32 GLN C NE2 1 +ATOM 3539 N N . VAL C 3 33 ? -16.671 80.375 127.000 1.00 13.27 ? 33 VAL C N 1 +ATOM 3540 C CA . VAL C 3 33 ? -16.003 79.409 127.856 1.00 12.40 ? 33 VAL C CA 1 +ATOM 3541 C C . VAL C 3 33 ? -14.885 80.121 128.593 1.00 12.45 ? 33 VAL C C 1 +ATOM 3542 O O . VAL C 3 33 ? -13.939 80.615 127.965 1.00 12.24 ? 33 VAL C O 1 +ATOM 3543 C CB . VAL C 3 33 ? -15.432 78.208 127.039 1.00 11.72 ? 33 VAL C CB 1 +ATOM 3544 C CG1 . VAL C 3 33 ? -14.573 77.315 127.905 1.00 11.71 ? 33 VAL C CG1 1 +ATOM 3545 C CG2 . VAL C 3 33 ? -16.548 77.410 126.436 1.00 10.90 ? 33 VAL C CG2 1 +ATOM 3546 N N . VAL C 3 34 ? -14.983 80.170 129.913 1.00 12.11 ? 34 VAL C N 1 +ATOM 3547 C CA . VAL C 3 34 ? -13.960 80.834 130.686 1.00 13.40 ? 34 VAL C CA 1 +ATOM 3548 C C . VAL C 3 34 ? -12.993 79.772 131.180 1.00 14.60 ? 34 VAL C C 1 +ATOM 3549 O O . VAL C 3 34 ? -13.402 78.857 131.884 1.00 15.22 ? 34 VAL C O 1 +ATOM 3550 C CB . VAL C 3 34 ? -14.569 81.644 131.875 1.00 13.08 ? 34 VAL C CB 1 +ATOM 3551 C CG1 . VAL C 3 34 ? -13.487 82.342 132.677 1.00 12.53 ? 34 VAL C CG1 1 +ATOM 3552 C CG2 . VAL C 3 34 ? -15.577 82.668 131.365 1.00 12.91 ? 34 VAL C CG2 1 +ATOM 3553 N N . GLN C 3 35 ? -11.727 79.884 130.796 1.00 15.80 ? 35 GLN C N 1 +ATOM 3554 C CA . GLN C 3 35 ? -10.684 78.986 131.280 1.00 17.73 ? 35 GLN C CA 1 +ATOM 3555 C C . GLN C 3 35 ? -10.137 79.630 132.502 1.00 17.72 ? 35 GLN C C 1 +ATOM 3556 O O . GLN C 3 35 ? -9.561 80.698 132.405 1.00 19.59 ? 35 GLN C O 1 +ATOM 3557 C CB . GLN C 3 35 ? -9.544 78.886 130.279 1.00 18.52 ? 35 GLN C CB 1 +ATOM 3558 C CG . GLN C 3 35 ? -9.953 78.476 128.863 1.00 21.46 ? 35 GLN C CG 1 +ATOM 3559 C CD . GLN C 3 35 ? -10.055 76.968 128.696 1.00 24.95 ? 35 GLN C CD 1 +ATOM 3560 O OE1 . GLN C 3 35 ? -9.648 76.201 129.585 1.00 26.47 ? 35 GLN C OE1 1 +ATOM 3561 N NE2 . GLN C 3 35 ? -10.610 76.537 127.563 1.00 26.10 ? 35 GLN C NE2 1 +ATOM 3562 N N . GLY C 3 36 ? -10.291 79.005 133.656 1.00 17.48 ? 36 GLY C N 1 +ATOM 3563 C CA . GLY C 3 36 ? -9.952 79.677 134.899 1.00 15.39 ? 36 GLY C CA 1 +ATOM 3564 C C . GLY C 3 36 ? -11.208 80.236 135.514 1.00 14.67 ? 36 GLY C C 1 +ATOM 3565 O O . GLY C 3 36 ? -12.273 79.635 135.407 1.00 13.90 ? 36 GLY C O 1 +ATOM 3566 N N . ASN C 3 37 ? -11.094 81.389 136.154 1.00 14.17 ? 37 ASN C N 1 +ATOM 3567 C CA . ASN C 3 37 ? -12.104 81.802 137.097 1.00 13.59 ? 37 ASN C CA 1 +ATOM 3568 C C . ASN C 3 37 ? -12.891 83.020 136.677 1.00 14.44 ? 37 ASN C C 1 +ATOM 3569 O O . ASN C 3 37 ? -12.330 84.043 136.260 1.00 15.34 ? 37 ASN C O 1 +ATOM 3570 C CB . ASN C 3 37 ? -11.441 82.092 138.420 1.00 13.56 ? 37 ASN C CB 1 +ATOM 3571 C CG . ASN C 3 37 ? -10.659 80.935 138.936 1.00 13.68 ? 37 ASN C CG 1 +ATOM 3572 O OD1 . ASN C 3 37 ? -11.057 79.783 138.806 1.00 15.26 ? 37 ASN C OD1 1 +ATOM 3573 N ND2 . ASN C 3 37 ? -9.526 81.225 139.529 1.00 15.50 ? 37 ASN C ND2 1 +ATOM 3574 N N . LEU C 3 38 ? -14.204 82.939 136.817 1.00 14.36 ? 38 LEU C N 1 +ATOM 3575 C CA . LEU C 3 38 ? -15.023 84.093 136.520 1.00 13.72 ? 38 LEU C CA 1 +ATOM 3576 C C . LEU C 3 38 ? -15.282 84.849 137.827 1.00 13.77 ? 38 LEU C C 1 +ATOM 3577 O O . LEU C 3 38 ? -16.010 84.377 138.718 1.00 14.63 ? 38 LEU C O 1 +ATOM 3578 C CB . LEU C 3 38 ? -16.293 83.665 135.839 1.00 12.40 ? 38 LEU C CB 1 +ATOM 3579 C CG . LEU C 3 38 ? -17.344 84.737 135.807 1.00 14.70 ? 38 LEU C CG 1 +ATOM 3580 C CD1 . LEU C 3 38 ? -16.994 85.869 134.833 1.00 14.38 ? 38 LEU C CD1 1 +ATOM 3581 C CD2 . LEU C 3 38 ? -18.734 84.099 135.498 1.00 17.50 ? 38 LEU C CD2 1 +ATOM 3582 N N . GLU C 3 39 ? -14.650 86.013 137.954 1.00 13.31 ? 39 GLU C N 1 +ATOM 3583 C CA . GLU C 3 39 ? -14.673 86.768 139.205 1.00 12.21 ? 39 GLU C CA 1 +ATOM 3584 C C . GLU C 3 39 ? -15.253 88.125 138.959 1.00 11.84 ? 39 GLU C C 1 +ATOM 3585 O O . GLU C 3 39 ? -14.729 88.887 138.186 1.00 11.10 ? 39 GLU C O 1 +ATOM 3586 C CB . GLU C 3 39 ? -13.267 86.955 139.754 1.00 11.43 ? 39 GLU C CB 1 +ATOM 3587 C CG . GLU C 3 39 ? -12.571 85.685 140.116 1.00 11.93 ? 39 GLU C CG 1 +ATOM 3588 C CD . GLU C 3 39 ? -11.132 85.910 140.554 1.00 16.44 ? 39 GLU C CD 1 +ATOM 3589 O OE1 . GLU C 3 39 ? -10.387 86.640 139.862 1.00 17.14 ? 39 GLU C OE1 1 +ATOM 3590 O OE2 . GLU C 3 39 ? -10.733 85.341 141.602 1.00 17.69 ? 39 GLU C OE2 1 +ATOM 3591 N N . LEU C 3 40 ? -16.332 88.435 139.647 1.00 12.16 ? 40 LEU C N 1 +ATOM 3592 C CA . LEU C 3 40 ? -17.034 89.677 139.402 1.00 11.85 ? 40 LEU C CA 1 +ATOM 3593 C C . LEU C 3 40 ? -17.143 90.379 140.708 1.00 12.49 ? 40 LEU C C 1 +ATOM 3594 O O . LEU C 3 40 ? -17.974 90.024 141.562 1.00 13.04 ? 40 LEU C O 1 +ATOM 3595 C CB . LEU C 3 40 ? -18.399 89.405 138.816 1.00 11.30 ? 40 LEU C CB 1 +ATOM 3596 C CG . LEU C 3 40 ? -18.246 88.601 137.526 1.00 11.47 ? 40 LEU C CG 1 +ATOM 3597 C CD1 . LEU C 3 40 ? -19.525 87.896 137.248 1.00 10.65 ? 40 LEU C CD1 1 +ATOM 3598 C CD2 . LEU C 3 40 ? -17.817 89.476 136.356 1.00 11.55 ? 40 LEU C CD2 1 +ATOM 3599 N N . THR C 3 41 ? -16.273 91.366 140.876 1.00 12.28 ? 41 THR C N 1 +ATOM 3600 C CA . THR C 3 41 ? -16.106 92.020 142.156 1.00 12.09 ? 41 THR C CA 1 +ATOM 3601 C C . THR C 3 41 ? -15.982 93.514 142.002 1.00 12.48 ? 41 THR C C 1 +ATOM 3602 O O . THR C 3 41 ? -15.451 93.995 141.001 1.00 12.61 ? 41 THR C O 1 +ATOM 3603 C CB . THR C 3 41 ? -14.828 91.564 142.806 1.00 11.93 ? 41 THR C CB 1 +ATOM 3604 O OG1 . THR C 3 41 ? -13.744 91.875 141.912 1.00 10.23 ? 41 THR C OG1 1 +ATOM 3605 C CG2 . THR C 3 41 ? -14.814 90.047 143.005 1.00 11.58 ? 41 THR C CG2 1 +ATOM 3606 N N . TYR C 3 42 ? -16.426 94.222 143.045 1.00 12.57 ? 42 TYR C N 1 +ATOM 3607 C CA . TYR C 3 42 ? -16.338 95.677 143.162 1.00 12.77 ? 42 TYR C CA 1 +ATOM 3608 C C . TYR C 3 42 ? -17.024 96.439 142.031 1.00 12.64 ? 42 TYR C C 1 +ATOM 3609 O O . TYR C 3 42 ? -16.642 97.547 141.703 1.00 12.95 ? 42 TYR C O 1 +ATOM 3610 C CB . TYR C 3 42 ? -14.893 96.138 143.374 1.00 12.58 ? 42 TYR C CB 1 +ATOM 3611 C CG . TYR C 3 42 ? -14.281 95.561 144.619 1.00 12.99 ? 42 TYR C CG 1 +ATOM 3612 C CD1 . TYR C 3 42 ? -13.524 94.394 144.562 1.00 12.58 ? 42 TYR C CD1 1 +ATOM 3613 C CD2 . TYR C 3 42 ? -14.469 96.171 145.862 1.00 13.13 ? 42 TYR C CD2 1 +ATOM 3614 C CE1 . TYR C 3 42 ? -12.968 93.855 145.701 1.00 13.37 ? 42 TYR C CE1 1 +ATOM 3615 C CE2 . TYR C 3 42 ? -13.906 95.633 147.026 1.00 13.80 ? 42 TYR C CE2 1 +ATOM 3616 C CZ . TYR C 3 42 ? -13.156 94.476 146.931 1.00 14.11 ? 42 TYR C CZ 1 +ATOM 3617 O OH . TYR C 3 42 ? -12.589 93.927 148.056 1.00 15.23 ? 42 TYR C OH 1 +ATOM 3618 N N . LEU C 3 43 ? -18.074 95.842 141.494 1.00 12.77 ? 43 LEU C N 1 +ATOM 3619 C CA . LEU C 3 43 ? -18.848 96.438 140.415 1.00 13.26 ? 43 LEU C CA 1 +ATOM 3620 C C . LEU C 3 43 ? -19.921 97.409 140.942 1.00 13.27 ? 43 LEU C C 1 +ATOM 3621 O O . LEU C 3 43 ? -20.738 97.055 141.806 1.00 12.89 ? 43 LEU C O 1 +ATOM 3622 C CB . LEU C 3 43 ? -19.472 95.337 139.536 1.00 12.79 ? 43 LEU C CB 1 +ATOM 3623 C CG . LEU C 3 43 ? -18.497 94.290 138.996 1.00 12.40 ? 43 LEU C CG 1 +ATOM 3624 C CD1 . LEU C 3 43 ? -19.238 93.119 138.299 1.00 12.92 ? 43 LEU C CD1 1 +ATOM 3625 C CD2 . LEU C 3 43 ? -17.511 94.953 138.066 1.00 9.04 ? 43 LEU C CD2 1 +ATOM 3626 N N . PRO C 3 44 ? -19.916 98.628 140.409 1.00 13.91 ? 44 PRO C N 1 +ATOM 3627 C CA . PRO C 3 44 ? -20.820 99.686 140.874 1.00 14.23 ? 44 PRO C CA 1 +ATOM 3628 C C . PRO C 3 44 ? -22.271 99.428 140.478 1.00 15.48 ? 44 PRO C C 1 +ATOM 3629 O O . PRO C 3 44 ? -22.585 98.478 139.727 1.00 16.53 ? 44 PRO C O 1 +ATOM 3630 C CB . PRO C 3 44 ? -20.302 100.922 140.144 1.00 14.06 ? 44 PRO C CB 1 +ATOM 3631 C CG . PRO C 3 44 ? -19.686 100.395 138.906 1.00 13.79 ? 44 PRO C CG 1 +ATOM 3632 C CD . PRO C 3 44 ? -19.049 99.086 139.304 1.00 13.61 ? 44 PRO C CD 1 +ATOM 3633 N N . THR C 3 45 ? -23.147 100.295 140.976 1.00 16.22 ? 45 THR C N 1 +ATOM 3634 C CA . THR C 3 45 ? -24.582 100.202 140.775 1.00 16.59 ? 45 THR C CA 1 +ATOM 3635 C C . THR C 3 45 ? -24.949 100.377 139.311 1.00 17.64 ? 45 THR C C 1 +ATOM 3636 O O . THR C 3 45 ? -25.823 99.696 138.776 1.00 18.32 ? 45 THR C O 1 +ATOM 3637 C CB . THR C 3 45 ? -25.298 101.196 141.735 1.00 16.15 ? 45 THR C CB 1 +ATOM 3638 O OG1 . THR C 3 45 ? -26.219 100.448 142.524 1.00 15.07 ? 45 THR C OG1 1 +ATOM 3639 C CG2 . THR C 3 45 ? -26.187 102.252 141.020 1.00 16.10 ? 45 THR C CG2 1 +ATOM 3640 N N . ASN C 3 46 ? -24.214 101.247 138.658 1.00 18.60 ? 46 ASN C N 1 +ATOM 3641 C CA . ASN C 3 46 ? -24.515 101.666 137.308 1.00 20.13 ? 46 ASN C CA 1 +ATOM 3642 C C . ASN C 3 46 ? -23.900 100.779 136.206 1.00 19.89 ? 46 ASN C C 1 +ATOM 3643 O O . ASN C 3 46 ? -23.932 101.160 135.016 1.00 19.92 ? 46 ASN C O 1 +ATOM 3644 C CB . ASN C 3 46 ? -23.996 103.095 137.154 1.00 20.81 ? 46 ASN C CB 1 +ATOM 3645 C CG . ASN C 3 46 ? -22.686 103.327 137.931 1.00 23.82 ? 46 ASN C CG 1 +ATOM 3646 O OD1 . ASN C 3 46 ? -22.623 103.160 139.178 1.00 25.05 ? 46 ASN C OD1 1 +ATOM 3647 N ND2 . ASN C 3 46 ? -21.636 103.723 137.202 1.00 26.62 ? 46 ASN C ND2 1 +ATOM 3648 N N . ALA C 3 47 ? -23.353 99.616 136.588 1.00 19.11 ? 47 ALA C N 1 +ATOM 3649 C CA . ALA C 3 47 ? -22.546 98.816 135.655 1.00 18.35 ? 47 ALA C CA 1 +ATOM 3650 C C . ALA C 3 47 ? -23.342 98.020 134.604 1.00 18.07 ? 47 ALA C C 1 +ATOM 3651 O O . ALA C 3 47 ? -24.266 97.273 134.928 1.00 17.91 ? 47 ALA C O 1 +ATOM 3652 C CB . ALA C 3 47 ? -21.601 97.945 136.394 1.00 18.01 ? 47 ALA C CB 1 +ATOM 3653 N N . SER C 3 48 ? -22.985 98.201 133.337 1.00 18.15 ? 48 SER C N 1 +ATOM 3654 C CA . SER C 3 48 ? -23.579 97.407 132.267 1.00 18.23 ? 48 SER C CA 1 +ATOM 3655 C C . SER C 3 48 ? -22.725 96.193 132.059 1.00 18.13 ? 48 SER C C 1 +ATOM 3656 O O . SER C 3 48 ? -21.577 96.265 131.611 1.00 18.48 ? 48 SER C O 1 +ATOM 3657 C CB . SER C 3 48 ? -23.714 98.190 130.974 1.00 18.20 ? 48 SER C CB 1 +ATOM 3658 O OG . SER C 3 48 ? -22.554 98.937 130.789 1.00 18.56 ? 48 SER C OG 1 +ATOM 3659 N N . LEU C 3 49 ? -23.302 95.070 132.443 1.00 17.82 ? 49 LEU C N 1 +ATOM 3660 C CA . LEU C 3 49 ? -22.659 93.795 132.318 1.00 16.67 ? 49 LEU C CA 1 +ATOM 3661 C C . LEU C 3 49 ? -23.218 92.953 131.167 1.00 16.38 ? 49 LEU C C 1 +ATOM 3662 O O . LEU C 3 49 ? -23.196 91.744 131.243 1.00 16.98 ? 49 LEU C O 1 +ATOM 3663 C CB . LEU C 3 49 ? -22.816 93.075 133.638 1.00 16.23 ? 49 LEU C CB 1 +ATOM 3664 C CG . LEU C 3 49 ? -22.229 93.892 134.769 1.00 14.71 ? 49 LEU C CG 1 +ATOM 3665 C CD1 . LEU C 3 49 ? -22.880 93.452 136.014 1.00 12.80 ? 49 LEU C CD1 1 +ATOM 3666 C CD2 . LEU C 3 49 ? -20.707 93.692 134.849 1.00 14.12 ? 49 LEU C CD2 1 +ATOM 3667 N N . SER C 3 50 ? -23.680 93.559 130.081 1.00 15.84 ? 50 SER C N 1 +ATOM 3668 C CA . SER C 3 50 ? -24.279 92.731 129.043 1.00 16.14 ? 50 SER C CA 1 +ATOM 3669 C C . SER C 3 50 ? -23.206 91.859 128.393 1.00 16.12 ? 50 SER C C 1 +ATOM 3670 O O . SER C 3 50 ? -23.469 90.722 128.037 1.00 15.72 ? 50 SER C O 1 +ATOM 3671 C CB . SER C 3 50 ? -25.114 93.526 128.027 1.00 16.02 ? 50 SER C CB 1 +ATOM 3672 O OG . SER C 3 50 ? -24.295 94.214 127.119 1.00 16.01 ? 50 SER C OG 1 +ATOM 3673 N N . PHE C 3 51 ? -21.985 92.376 128.306 1.00 15.72 ? 51 PHE C N 1 +ATOM 3674 C CA . PHE C 3 51 ? -20.850 91.560 127.886 1.00 15.62 ? 51 PHE C CA 1 +ATOM 3675 C C . PHE C 3 51 ? -20.768 90.156 128.549 1.00 15.87 ? 51 PHE C C 1 +ATOM 3676 O O . PHE C 3 51 ? -20.143 89.242 128.008 1.00 16.30 ? 51 PHE C O 1 +ATOM 3677 C CB . PHE C 3 51 ? -19.525 92.350 127.988 1.00 15.40 ? 51 PHE C CB 1 +ATOM 3678 C CG . PHE C 3 51 ? -19.124 92.723 129.394 1.00 14.04 ? 51 PHE C CG 1 +ATOM 3679 C CD1 . PHE C 3 51 ? -18.479 91.799 130.227 1.00 12.22 ? 51 PHE C CD1 1 +ATOM 3680 C CD2 . PHE C 3 51 ? -19.349 93.990 129.869 1.00 11.53 ? 51 PHE C CD2 1 +ATOM 3681 C CE1 . PHE C 3 51 ? -18.119 92.119 131.499 1.00 9.21 ? 51 PHE C CE1 1 +ATOM 3682 C CE2 . PHE C 3 51 ? -18.980 94.314 131.165 1.00 11.85 ? 51 PHE C CE2 1 +ATOM 3683 C CZ . PHE C 3 51 ? -18.370 93.392 131.969 1.00 9.61 ? 51 PHE C CZ 1 +ATOM 3684 N N . LEU C 3 52 ? -21.425 89.971 129.687 1.00 15.94 ? 52 LEU C N 1 +ATOM 3685 C CA . LEU C 3 52 ? -21.408 88.682 130.379 1.00 16.21 ? 52 LEU C CA 1 +ATOM 3686 C C . LEU C 3 52 ? -22.399 87.629 129.808 1.00 16.93 ? 52 LEU C C 1 +ATOM 3687 O O . LEU C 3 52 ? -22.295 86.440 130.111 1.00 16.49 ? 52 LEU C O 1 +ATOM 3688 C CB . LEU C 3 52 ? -21.661 88.897 131.873 1.00 15.65 ? 52 LEU C CB 1 +ATOM 3689 C CG . LEU C 3 52 ? -20.534 89.409 132.774 1.00 15.43 ? 52 LEU C CG 1 +ATOM 3690 C CD1 . LEU C 3 52 ? -20.990 89.331 134.205 1.00 14.60 ? 52 LEU C CD1 1 +ATOM 3691 C CD2 . LEU C 3 52 ? -19.212 88.663 132.640 1.00 14.64 ? 52 LEU C CD2 1 +ATOM 3692 N N . GLN C 3 53 ? -23.343 88.084 128.979 1.00 18.25 ? 53 GLN C N 1 +ATOM 3693 C CA . GLN C 3 53 ? -24.527 87.317 128.545 1.00 19.39 ? 53 GLN C CA 1 +ATOM 3694 C C . GLN C 3 53 ? -24.246 85.939 128.014 1.00 19.31 ? 53 GLN C C 1 +ATOM 3695 O O . GLN C 3 53 ? -25.081 85.060 128.146 1.00 19.42 ? 53 GLN C O 1 +ATOM 3696 C CB . GLN C 3 53 ? -25.180 87.998 127.348 1.00 19.98 ? 53 GLN C CB 1 +ATOM 3697 C CG . GLN C 3 53 ? -26.148 89.116 127.603 1.00 23.30 ? 53 GLN C CG 1 +ATOM 3698 C CD . GLN C 3 53 ? -26.309 89.944 126.342 1.00 25.82 ? 53 GLN C CD 1 +ATOM 3699 O OE1 . GLN C 3 53 ? -25.435 89.921 125.462 1.00 25.93 ? 53 GLN C OE1 1 +ATOM 3700 N NE2 . GLN C 3 53 ? -27.426 90.650 126.230 1.00 27.61 ? 53 GLN C NE2 1 +ATOM 3701 N N . ASP C 3 54 ? -23.115 85.804 127.319 1.00 19.52 ? 54 ASP C N 1 +ATOM 3702 C CA . ASP C 3 54 ? -22.824 84.670 126.458 1.00 19.31 ? 54 ASP C CA 1 +ATOM 3703 C C . ASP C 3 54 ? -22.092 83.540 127.187 1.00 19.04 ? 54 ASP C C 1 +ATOM 3704 O O . ASP C 3 54 ? -21.883 82.469 126.617 1.00 19.58 ? 54 ASP C O 1 +ATOM 3705 C CB . ASP C 3 54 ? -21.949 85.138 125.304 1.00 20.08 ? 54 ASP C CB 1 +ATOM 3706 C CG . ASP C 3 54 ? -22.750 85.590 124.086 1.00 23.01 ? 54 ASP C CG 1 +ATOM 3707 O OD1 . ASP C 3 54 ? -23.571 84.793 123.581 1.00 28.18 ? 54 ASP C OD1 1 +ATOM 3708 O OD2 . ASP C 3 54 ? -22.612 86.708 123.536 1.00 23.17 ? 54 ASP C OD2 1 +ATOM 3709 N N . ILE C 3 55 ? -21.685 83.773 128.431 1.00 18.19 ? 55 ILE C N 1 +ATOM 3710 C CA . ILE C 3 55 ? -20.941 82.773 129.206 1.00 17.31 ? 55 ILE C CA 1 +ATOM 3711 C C . ILE C 3 55 ? -21.772 81.510 129.479 1.00 17.26 ? 55 ILE C C 1 +ATOM 3712 O O . ILE C 3 55 ? -22.838 81.604 130.091 1.00 17.51 ? 55 ILE C O 1 +ATOM 3713 C CB . ILE C 3 55 ? -20.422 83.415 130.518 1.00 16.67 ? 55 ILE C CB 1 +ATOM 3714 C CG1 . ILE C 3 55 ? -19.575 84.646 130.149 1.00 17.37 ? 55 ILE C CG1 1 +ATOM 3715 C CG2 . ILE C 3 55 ? -19.657 82.400 131.349 1.00 15.13 ? 55 ILE C CG2 1 +ATOM 3716 C CD1 . ILE C 3 55 ? -18.744 85.247 131.212 1.00 17.07 ? 55 ILE C CD1 1 +ATOM 3717 N N . GLN C 3 56 ? -21.305 80.346 129.013 1.00 16.39 ? 56 GLN C N 1 +ATOM 3718 C CA . GLN C 3 56 ? -22.023 79.090 129.276 1.00 16.49 ? 56 GLN C CA 1 +ATOM 3719 C C . GLN C 3 56 ? -21.221 78.173 130.175 1.00 15.95 ? 56 GLN C C 1 +ATOM 3720 O O . GLN C 3 56 ? -21.769 77.240 130.802 1.00 16.36 ? 56 GLN C O 1 +ATOM 3721 C CB . GLN C 3 56 ? -22.325 78.294 128.008 1.00 16.47 ? 56 GLN C CB 1 +ATOM 3722 C CG . GLN C 3 56 ? -22.642 79.098 126.790 1.00 18.89 ? 56 GLN C CG 1 +ATOM 3723 C CD . GLN C 3 56 ? -22.993 78.225 125.556 1.00 21.47 ? 56 GLN C CD 1 +ATOM 3724 O OE1 . GLN C 3 56 ? -23.027 76.960 125.612 1.00 18.02 ? 56 GLN C OE1 1 +ATOM 3725 N NE2 . GLN C 3 56 ? -23.242 78.910 124.438 1.00 19.59 ? 56 GLN C NE2 1 +ATOM 3726 N N . GLU C 3 57 ? -19.925 78.423 130.236 1.00 14.63 ? 57 GLU C N 1 +ATOM 3727 C CA . GLU C 3 57 ? -19.037 77.465 130.840 1.00 14.19 ? 57 GLU C CA 1 +ATOM 3728 C C . GLU C 3 57 ? -17.992 78.150 131.680 1.00 13.47 ? 57 GLU C C 1 +ATOM 3729 O O . GLU C 3 57 ? -17.372 79.128 131.245 1.00 13.62 ? 57 GLU C O 1 +ATOM 3730 C CB . GLU C 3 57 ? -18.402 76.619 129.741 1.00 14.36 ? 57 GLU C CB 1 +ATOM 3731 C CG . GLU C 3 57 ? -18.675 75.148 129.949 1.00 16.45 ? 57 GLU C CG 1 +ATOM 3732 C CD . GLU C 3 57 ? -18.301 74.262 128.791 1.00 17.38 ? 57 GLU C CD 1 +ATOM 3733 O OE1 . GLU C 3 57 ? -19.194 73.892 127.990 1.00 17.59 ? 57 GLU C OE1 1 +ATOM 3734 O OE2 . GLU C 3 57 ? -17.115 73.912 128.712 1.00 19.11 ? 57 GLU C OE2 1 +ATOM 3735 N N . VAL C 3 58 ? -17.816 77.682 132.903 1.00 13.10 ? 58 VAL C N 1 +ATOM 3736 C CA . VAL C 3 58 ? -16.713 78.188 133.722 1.00 12.68 ? 58 VAL C CA 1 +ATOM 3737 C C . VAL C 3 58 ? -15.845 77.044 134.200 1.00 12.41 ? 58 VAL C C 1 +ATOM 3738 O O . VAL C 3 58 ? -16.325 76.179 134.903 1.00 12.26 ? 58 VAL C O 1 +ATOM 3739 C CB . VAL C 3 58 ? -17.180 79.092 134.901 1.00 12.13 ? 58 VAL C CB 1 +ATOM 3740 C CG1 . VAL C 3 58 ? -16.029 79.402 135.749 1.00 12.62 ? 58 VAL C CG1 1 +ATOM 3741 C CG2 . VAL C 3 58 ? -17.672 80.381 134.419 1.00 9.53 ? 58 VAL C CG2 1 +ATOM 3742 N N . GLN C 3 59 ? -14.578 77.033 133.799 1.00 13.11 ? 59 GLN C N 1 +ATOM 3743 C CA . GLN C 3 59 ? -13.654 75.956 134.185 1.00 14.43 ? 59 GLN C CA 1 +ATOM 3744 C C . GLN C 3 59 ? -13.249 75.951 135.683 1.00 14.57 ? 59 GLN C C 1 +ATOM 3745 O O . GLN C 3 59 ? -13.153 74.883 136.318 1.00 15.59 ? 59 GLN C O 1 +ATOM 3746 C CB . GLN C 3 59 ? -12.419 75.981 133.303 1.00 14.69 ? 59 GLN C CB 1 +ATOM 3747 C CG . GLN C 3 59 ? -11.671 74.624 133.122 1.00 18.57 ? 59 GLN C CG 1 +ATOM 3748 C CD . GLN C 3 59 ? -10.210 74.837 132.630 1.00 23.90 ? 59 GLN C CD 1 +ATOM 3749 O OE1 . GLN C 3 59 ? -9.546 75.793 133.059 1.00 26.73 ? 59 GLN C OE1 1 +ATOM 3750 N NE2 . GLN C 3 59 ? -9.727 73.969 131.728 1.00 24.55 ? 59 GLN C NE2 1 +ATOM 3751 N N . GLY C 3 60 ? -13.030 77.124 136.258 1.00 13.51 ? 60 GLY C N 1 +ATOM 3752 C CA . GLY C 3 60 ? -12.622 77.182 137.637 1.00 13.01 ? 60 GLY C CA 1 +ATOM 3753 C C . GLY C 3 60 ? -13.836 77.415 138.504 1.00 13.25 ? 60 GLY C C 1 +ATOM 3754 O O . GLY C 3 60 ? -14.772 76.618 138.461 1.00 14.13 ? 60 GLY C O 1 +ATOM 3755 N N . TYR C 3 61 ? -13.804 78.491 139.294 1.00 12.00 ? 61 TYR C N 1 +ATOM 3756 C CA . TYR C 3 61 ? -14.854 78.839 140.223 1.00 10.96 ? 61 TYR C CA 1 +ATOM 3757 C C . TYR C 3 61 ? -15.486 80.124 139.737 1.00 10.80 ? 61 TYR C C 1 +ATOM 3758 O O . TYR C 3 61 ? -14.936 80.832 138.901 1.00 11.25 ? 61 TYR C O 1 +ATOM 3759 C CB . TYR C 3 61 ? -14.335 78.964 141.689 1.00 10.45 ? 61 TYR C CB 1 +ATOM 3760 C CG . TYR C 3 61 ? -13.247 80.016 141.908 1.00 8.87 ? 61 TYR C CG 1 +ATOM 3761 C CD1 . TYR C 3 61 ? -13.562 81.376 141.963 1.00 7.98 ? 61 TYR C CD1 1 +ATOM 3762 C CD2 . TYR C 3 61 ? -11.894 79.646 142.034 1.00 10.49 ? 61 TYR C CD2 1 +ATOM 3763 C CE1 . TYR C 3 61 ? -12.584 82.349 142.125 1.00 7.94 ? 61 TYR C CE1 1 +ATOM 3764 C CE2 . TYR C 3 61 ? -10.899 80.610 142.212 1.00 10.84 ? 61 TYR C CE2 1 +ATOM 3765 C CZ . TYR C 3 61 ? -11.265 81.962 142.256 1.00 11.31 ? 61 TYR C CZ 1 +ATOM 3766 O OH . TYR C 3 61 ? -10.311 82.924 142.420 1.00 13.56 ? 61 TYR C OH 1 +ATOM 3767 N N . VAL C 3 62 ? -16.669 80.408 140.252 1.00 11.02 ? 62 VAL C N 1 +ATOM 3768 C CA . VAL C 3 62 ? -17.360 81.636 139.946 1.00 10.73 ? 62 VAL C CA 1 +ATOM 3769 C C . VAL C 3 62 ? -17.407 82.387 141.270 1.00 11.10 ? 62 VAL C C 1 +ATOM 3770 O O . VAL C 3 62 ? -17.768 81.784 142.284 1.00 10.73 ? 62 VAL C O 1 +ATOM 3771 C CB . VAL C 3 62 ? -18.773 81.374 139.457 1.00 10.58 ? 62 VAL C CB 1 +ATOM 3772 C CG1 . VAL C 3 62 ? -19.565 82.681 139.482 1.00 10.88 ? 62 VAL C CG1 1 +ATOM 3773 C CG2 . VAL C 3 62 ? -18.729 80.832 138.083 1.00 6.57 ? 62 VAL C CG2 1 +ATOM 3774 N N . LEU C 3 63 ? -16.998 83.661 141.256 1.00 10.63 ? 63 LEU C N 1 +ATOM 3775 C CA . LEU C 3 63 ? -17.046 84.489 142.465 1.00 11.37 ? 63 LEU C CA 1 +ATOM 3776 C C . LEU C 3 63 ? -17.630 85.871 142.142 1.00 11.82 ? 63 LEU C C 1 +ATOM 3777 O O . LEU C 3 63 ? -17.111 86.598 141.255 1.00 12.40 ? 63 LEU C O 1 +ATOM 3778 C CB . LEU C 3 63 ? -15.667 84.620 143.071 1.00 11.31 ? 63 LEU C CB 1 +ATOM 3779 C CG . LEU C 3 63 ? -15.521 85.723 144.094 1.00 12.10 ? 63 LEU C CG 1 +ATOM 3780 C CD1 . LEU C 3 63 ? -15.818 85.158 145.471 1.00 13.44 ? 63 LEU C CD1 1 +ATOM 3781 C CD2 . LEU C 3 63 ? -14.125 86.282 144.048 1.00 12.87 ? 63 LEU C CD2 1 +ATOM 3782 N N . ILE C 3 64 ? -18.725 86.196 142.831 1.00 11.08 ? 64 ILE C N 1 +ATOM 3783 C CA . ILE C 3 64 ? -19.460 87.438 142.664 1.00 11.16 ? 64 ILE C CA 1 +ATOM 3784 C C . ILE C 3 64 ? -19.374 88.070 144.016 1.00 12.04 ? 64 ILE C C 1 +ATOM 3785 O O . ILE C 3 64 ? -20.020 87.619 144.949 1.00 13.26 ? 64 ILE C O 1 +ATOM 3786 C CB . ILE C 3 64 ? -20.919 87.132 142.304 1.00 11.22 ? 64 ILE C CB 1 +ATOM 3787 C CG1 . ILE C 3 64 ? -20.976 86.615 140.876 1.00 11.64 ? 64 ILE C CG1 1 +ATOM 3788 C CG2 . ILE C 3 64 ? -21.803 88.351 142.460 1.00 9.67 ? 64 ILE C CG2 1 +ATOM 3789 C CD1 . ILE C 3 64 ? -21.988 85.602 140.650 1.00 12.20 ? 64 ILE C CD1 1 +ATOM 3790 N N . ALA C 3 65 ? -18.521 89.071 144.158 1.00 12.60 ? 65 ALA C N 1 +ATOM 3791 C CA . ALA C 3 65 ? -18.229 89.596 145.467 1.00 13.08 ? 65 ALA C CA 1 +ATOM 3792 C C . ALA C 3 65 ? -18.070 91.119 145.507 1.00 14.09 ? 65 ALA C C 1 +ATOM 3793 O O . ALA C 3 65 ? -17.759 91.749 144.495 1.00 13.77 ? 65 ALA C O 1 +ATOM 3794 C CB . ALA C 3 65 ? -17.002 88.932 145.984 1.00 13.51 ? 65 ALA C CB 1 +ATOM 3795 N N . HIS C 3 66 ? -18.300 91.699 146.686 1.00 15.10 ? 66 HIS C N 1 +ATOM 3796 C CA . HIS C 3 66 ? -18.150 93.130 146.912 1.00 15.80 ? 66 HIS C CA 1 +ATOM 3797 C C . HIS C 3 66 ? -18.759 93.997 145.820 1.00 16.28 ? 66 HIS C C 1 +ATOM 3798 O O . HIS C 3 66 ? -18.147 94.981 145.392 1.00 16.14 ? 66 HIS C O 1 +ATOM 3799 C CB . HIS C 3 66 ? -16.676 93.450 147.069 1.00 15.78 ? 66 HIS C CB 1 +ATOM 3800 C CG . HIS C 3 66 ? -16.116 93.008 148.377 1.00 17.47 ? 66 HIS C CG 1 +ATOM 3801 N ND1 . HIS C 3 66 ? -16.441 93.620 149.570 1.00 20.01 ? 66 HIS C ND1 1 +ATOM 3802 C CD2 . HIS C 3 66 ? -15.276 91.995 148.687 1.00 17.59 ? 66 HIS C CD2 1 +ATOM 3803 C CE1 . HIS C 3 66 ? -15.811 93.009 150.558 1.00 19.27 ? 66 HIS C CE1 1 +ATOM 3804 N NE2 . HIS C 3 66 ? -15.097 92.022 150.046 1.00 19.07 ? 66 HIS C NE2 1 +ATOM 3805 N N . ASN C 3 67 ? -19.956 93.621 145.367 1.00 17.10 ? 67 ASN C N 1 +ATOM 3806 C CA . ASN C 3 67 ? -20.650 94.348 144.301 1.00 17.86 ? 67 ASN C CA 1 +ATOM 3807 C C . ASN C 3 67 ? -21.880 95.093 144.760 1.00 17.69 ? 67 ASN C C 1 +ATOM 3808 O O . ASN C 3 67 ? -22.629 94.608 145.605 1.00 16.82 ? 67 ASN C O 1 +ATOM 3809 C CB . ASN C 3 67 ? -21.098 93.413 143.193 1.00 17.93 ? 67 ASN C CB 1 +ATOM 3810 C CG . ASN C 3 67 ? -19.984 92.638 142.629 1.00 21.42 ? 67 ASN C CG 1 +ATOM 3811 O OD1 . ASN C 3 67 ? -19.076 93.198 142.011 1.00 25.96 ? 67 ASN C OD1 1 +ATOM 3812 N ND2 . ASN C 3 67 ? -20.018 91.329 142.835 1.00 23.18 ? 67 ASN C ND2 1 +ATOM 3813 N N . GLN C 3 68 ? -22.098 96.240 144.122 1.00 17.99 ? 68 GLN C N 1 +ATOM 3814 C CA . GLN C 3 68 ? -23.296 97.037 144.310 1.00 19.04 ? 68 GLN C CA 1 +ATOM 3815 C C . GLN C 3 68 ? -24.303 96.850 143.174 1.00 19.05 ? 68 GLN C C 1 +ATOM 3816 O O . GLN C 3 68 ? -25.379 97.435 143.229 1.00 18.83 ? 68 GLN C O 1 +ATOM 3817 C CB . GLN C 3 68 ? -22.938 98.541 144.469 1.00 19.29 ? 68 GLN C CB 1 +ATOM 3818 C CG . GLN C 3 68 ? -22.075 98.880 145.675 1.00 20.93 ? 68 GLN C CG 1 +ATOM 3819 C CD . GLN C 3 68 ? -20.779 99.635 145.279 1.00 27.54 ? 68 GLN C CD 1 +ATOM 3820 O OE1 . GLN C 3 68 ? -19.972 99.131 144.476 1.00 28.63 ? 68 GLN C OE1 1 +ATOM 3821 N NE2 . GLN C 3 68 ? -20.570 100.843 145.859 1.00 29.55 ? 68 GLN C NE2 1 +ATOM 3822 N N . VAL C 3 69 ? -23.959 96.064 142.142 1.00 19.90 ? 69 VAL C N 1 +ATOM 3823 C CA . VAL C 3 69 ? -24.877 95.818 141.009 1.00 19.87 ? 69 VAL C CA 1 +ATOM 3824 C C . VAL C 3 69 ? -26.058 95.053 141.518 1.00 20.17 ? 69 VAL C C 1 +ATOM 3825 O O . VAL C 3 69 ? -25.930 94.201 142.398 1.00 20.11 ? 69 VAL C O 1 +ATOM 3826 C CB . VAL C 3 69 ? -24.280 94.968 139.841 1.00 19.70 ? 69 VAL C CB 1 +ATOM 3827 C CG1 . VAL C 3 69 ? -24.450 95.671 138.512 1.00 19.32 ? 69 VAL C CG1 1 +ATOM 3828 C CG2 . VAL C 3 69 ? -22.865 94.623 140.077 1.00 20.45 ? 69 VAL C CG2 1 +ATOM 3829 N N . ARG C 3 70 ? -27.227 95.354 140.980 1.00 21.28 ? 70 ARG C N 1 +ATOM 3830 C CA . ARG C 3 70 ? -28.418 94.669 141.458 1.00 21.62 ? 70 ARG C CA 1 +ATOM 3831 C C . ARG C 3 70 ? -28.529 93.322 140.786 1.00 22.13 ? 70 ARG C C 1 +ATOM 3832 O O . ARG C 3 70 ? -29.169 92.423 141.299 1.00 22.71 ? 70 ARG C O 1 +ATOM 3833 C CB . ARG C 3 70 ? -29.629 95.532 141.239 1.00 21.08 ? 70 ARG C CB 1 +ATOM 3834 C CG . ARG C 3 70 ? -29.366 96.991 141.619 1.00 21.82 ? 70 ARG C CG 1 +ATOM 3835 C CD . ARG C 3 70 ? -30.556 97.673 142.270 1.00 23.27 ? 70 ARG C CD 1 +ATOM 3836 N NE . ARG C 3 70 ? -30.367 99.084 142.632 1.00 23.74 ? 70 ARG C NE 1 +ATOM 3837 C CZ . ARG C 3 70 ? -29.793 100.007 141.869 1.00 25.14 ? 70 ARG C CZ 1 +ATOM 3838 N NH1 . ARG C 3 70 ? -29.301 99.684 140.672 1.00 25.21 ? 70 ARG C NH1 1 +ATOM 3839 N NH2 . ARG C 3 70 ? -29.707 101.261 142.316 1.00 24.53 ? 70 ARG C NH2 1 +ATOM 3840 N N . GLN C 3 71 ? -27.860 93.184 139.646 1.00 23.11 ? 71 GLN C N 1 +ATOM 3841 C CA . GLN C 3 71 ? -27.853 91.941 138.877 1.00 23.95 ? 71 GLN C CA 1 +ATOM 3842 C C . GLN C 3 71 ? -26.665 91.803 137.931 1.00 23.67 ? 71 GLN C C 1 +ATOM 3843 O O . GLN C 3 71 ? -26.109 92.800 137.440 1.00 23.46 ? 71 GLN C O 1 +ATOM 3844 C CB . GLN C 3 71 ? -29.158 91.750 138.096 1.00 25.16 ? 71 GLN C CB 1 +ATOM 3845 C CG . GLN C 3 71 ? -29.728 92.991 137.423 1.00 27.43 ? 71 GLN C CG 1 +ATOM 3846 C CD . GLN C 3 71 ? -30.667 92.621 136.286 1.00 35.34 ? 71 GLN C CD 1 +ATOM 3847 O OE1 . GLN C 3 71 ? -31.922 92.669 136.428 1.00 35.05 ? 71 GLN C OE1 1 +ATOM 3848 N NE2 . GLN C 3 71 ? -30.068 92.221 135.139 1.00 38.61 ? 71 GLN C NE2 1 +ATOM 3849 N N . VAL C 3 72 ? -26.294 90.541 137.719 1.00 23.09 ? 72 VAL C N 1 +ATOM 3850 C CA . VAL C 3 72 ? -25.246 90.103 136.808 1.00 22.59 ? 72 VAL C CA 1 +ATOM 3851 C C . VAL C 3 72 ? -25.897 89.058 135.922 1.00 21.59 ? 72 VAL C C 1 +ATOM 3852 O O . VAL C 3 72 ? -26.385 88.063 136.425 1.00 22.12 ? 72 VAL C O 1 +ATOM 3853 C CB . VAL C 3 72 ? -24.064 89.444 137.558 1.00 22.75 ? 72 VAL C CB 1 +ATOM 3854 C CG1 . VAL C 3 72 ? -23.167 90.494 138.128 1.00 23.50 ? 72 VAL C CG1 1 +ATOM 3855 C CG2 . VAL C 3 72 ? -24.546 88.547 138.678 1.00 24.47 ? 72 VAL C CG2 1 +ATOM 3856 N N . PRO C 3 73 ? -25.995 89.332 134.628 1.00 20.70 ? 73 PRO C N 1 +ATOM 3857 C CA . PRO C 3 73 ? -26.663 88.435 133.687 1.00 19.55 ? 73 PRO C CA 1 +ATOM 3858 C C . PRO C 3 73 ? -25.875 87.187 133.259 1.00 19.00 ? 73 PRO C C 1 +ATOM 3859 O O . PRO C 3 73 ? -25.368 87.086 132.131 1.00 18.78 ? 73 PRO C O 1 +ATOM 3860 C CB . PRO C 3 73 ? -26.939 89.334 132.491 1.00 19.13 ? 73 PRO C CB 1 +ATOM 3861 C CG . PRO C 3 73 ? -25.938 90.391 132.574 1.00 19.46 ? 73 PRO C CG 1 +ATOM 3862 C CD . PRO C 3 73 ? -25.566 90.587 133.986 1.00 20.84 ? 73 PRO C CD 1 +ATOM 3863 N N . LEU C 3 74 ? -25.858 86.206 134.154 1.00 17.56 ? 74 LEU C N 1 +ATOM 3864 C CA . LEU C 3 74 ? -25.258 84.939 133.886 1.00 15.97 ? 74 LEU C CA 1 +ATOM 3865 C C . LEU C 3 74 ? -26.323 83.902 133.619 1.00 15.51 ? 74 LEU C C 1 +ATOM 3866 O O . LEU C 3 74 ? -26.157 82.725 133.974 1.00 15.60 ? 74 LEU C O 1 +ATOM 3867 C CB . LEU C 3 74 ? -24.386 84.541 135.075 1.00 16.37 ? 74 LEU C CB 1 +ATOM 3868 C CG . LEU C 3 74 ? -23.242 85.495 135.395 1.00 14.91 ? 74 LEU C CG 1 +ATOM 3869 C CD1 . LEU C 3 74 ? -22.491 85.001 136.610 1.00 14.98 ? 74 LEU C CD1 1 +ATOM 3870 C CD2 . LEU C 3 74 ? -22.308 85.647 134.192 1.00 11.17 ? 74 LEU C CD2 1 +ATOM 3871 N N . GLN C 3 75 ? -27.418 84.322 132.985 1.00 14.86 ? 75 GLN C N 1 +ATOM 3872 C CA . GLN C 3 75 ? -28.547 83.414 132.747 1.00 14.27 ? 75 GLN C CA 1 +ATOM 3873 C C . GLN C 3 75 ? -28.201 82.210 131.920 1.00 13.57 ? 75 GLN C C 1 +ATOM 3874 O O . GLN C 3 75 ? -28.943 81.211 131.930 1.00 12.25 ? 75 GLN C O 1 +ATOM 3875 C CB . GLN C 3 75 ? -29.724 84.111 132.096 1.00 14.15 ? 75 GLN C CB 1 +ATOM 3876 C CG . GLN C 3 75 ? -30.542 84.861 133.089 1.00 16.97 ? 75 GLN C CG 1 +ATOM 3877 C CD . GLN C 3 75 ? -30.021 86.259 133.266 1.00 19.85 ? 75 GLN C CD 1 +ATOM 3878 O OE1 . GLN C 3 75 ? -29.146 86.682 132.516 1.00 20.15 ? 75 GLN C OE1 1 +ATOM 3879 N NE2 . GLN C 3 75 ? -30.548 86.984 134.258 1.00 21.53 ? 75 GLN C NE2 1 +ATOM 3880 N N . ARG C 3 76 ? -27.083 82.313 131.199 1.00 13.20 ? 76 ARG C N 1 +ATOM 3881 C CA . ARG C 3 76 ? -26.710 81.263 130.284 1.00 13.00 ? 76 ARG C CA 1 +ATOM 3882 C C . ARG C 3 76 ? -25.638 80.384 130.893 1.00 12.26 ? 76 ARG C C 1 +ATOM 3883 O O . ARG C 3 76 ? -25.257 79.407 130.285 1.00 12.99 ? 76 ARG C O 1 +ATOM 3884 C CB . ARG C 3 76 ? -26.231 81.853 128.958 1.00 13.41 ? 76 ARG C CB 1 +ATOM 3885 C CG . ARG C 3 76 ? -27.300 82.215 127.921 1.00 15.57 ? 76 ARG C CG 1 +ATOM 3886 C CD . ARG C 3 76 ? -26.653 82.444 126.545 1.00 21.23 ? 76 ARG C CD 1 +ATOM 3887 N NE . ARG C 3 76 ? -27.547 82.278 125.393 1.00 27.64 ? 76 ARG C NE 1 +ATOM 3888 C CZ . ARG C 3 76 ? -28.188 83.303 124.795 1.00 32.24 ? 76 ARG C CZ 1 +ATOM 3889 N NH1 . ARG C 3 76 ? -28.038 84.544 125.270 1.00 33.25 ? 76 ARG C NH1 1 +ATOM 3890 N NH2 . ARG C 3 76 ? -28.985 83.102 123.736 1.00 32.51 ? 76 ARG C NH2 1 +ATOM 3891 N N . LEU C 3 77 ? -25.120 80.734 132.067 1.00 12.08 ? 77 LEU C N 1 +ATOM 3892 C CA . LEU C 3 77 ? -24.095 79.890 132.711 1.00 12.43 ? 77 LEU C CA 1 +ATOM 3893 C C . LEU C 3 77 ? -24.640 78.496 132.990 1.00 12.66 ? 77 LEU C C 1 +ATOM 3894 O O . LEU C 3 77 ? -25.579 78.313 133.784 1.00 12.73 ? 77 LEU C O 1 +ATOM 3895 C CB . LEU C 3 77 ? -23.600 80.480 134.003 1.00 11.82 ? 77 LEU C CB 1 +ATOM 3896 C CG . LEU C 3 77 ? -22.247 80.098 134.628 1.00 12.41 ? 77 LEU C CG 1 +ATOM 3897 C CD1 . LEU C 3 77 ? -22.383 79.914 136.156 1.00 10.04 ? 77 LEU C CD1 1 +ATOM 3898 C CD2 . LEU C 3 77 ? -21.535 78.941 133.980 1.00 12.13 ? 77 LEU C CD2 1 +ATOM 3899 N N . ARG C 3 78 ? -24.043 77.531 132.310 1.00 12.41 ? 78 ARG C N 1 +ATOM 3900 C CA . ARG C 3 78 ? -24.549 76.162 132.320 1.00 13.00 ? 78 ARG C CA 1 +ATOM 3901 C C . ARG C 3 78 ? -23.814 75.243 133.306 1.00 12.37 ? 78 ARG C C 1 +ATOM 3902 O O . ARG C 3 78 ? -24.434 74.412 133.974 1.00 12.58 ? 78 ARG C O 1 +ATOM 3903 C CB . ARG C 3 78 ? -24.453 75.586 130.930 1.00 11.76 ? 78 ARG C CB 1 +ATOM 3904 C CG . ARG C 3 78 ? -25.188 74.362 130.815 1.00 15.41 ? 78 ARG C CG 1 +ATOM 3905 C CD . ARG C 3 78 ? -26.546 74.536 130.156 1.00 22.17 ? 78 ARG C CD 1 +ATOM 3906 N NE . ARG C 3 78 ? -27.578 74.438 131.181 1.00 25.82 ? 78 ARG C NE 1 +ATOM 3907 C CZ . ARG C 3 78 ? -28.861 74.722 130.996 1.00 29.20 ? 78 ARG C CZ 1 +ATOM 3908 N NH1 . ARG C 3 78 ? -29.323 75.123 129.808 1.00 27.18 ? 78 ARG C NH1 1 +ATOM 3909 N NH2 . ARG C 3 78 ? -29.689 74.612 132.026 1.00 31.22 ? 78 ARG C NH2 1 +ATOM 3910 N N . ILE C 3 79 ? -22.499 75.384 133.377 1.00 11.39 ? 79 ILE C N 1 +ATOM 3911 C CA . ILE C 3 79 ? -21.716 74.465 134.154 1.00 11.75 ? 79 ILE C CA 1 +ATOM 3912 C C . ILE C 3 79 ? -20.498 75.189 134.684 1.00 12.68 ? 79 ILE C C 1 +ATOM 3913 O O . ILE C 3 79 ? -19.898 76.004 133.974 1.00 13.61 ? 79 ILE C O 1 +ATOM 3914 C CB . ILE C 3 79 ? -21.299 73.284 133.285 1.00 11.78 ? 79 ILE C CB 1 +ATOM 3915 C CG1 . ILE C 3 79 ? -20.248 72.407 133.972 1.00 10.89 ? 79 ILE C CG1 1 +ATOM 3916 C CG2 . ILE C 3 79 ? -20.794 73.759 131.950 1.00 11.57 ? 79 ILE C CG2 1 +ATOM 3917 C CD1 . ILE C 3 79 ? -19.910 71.119 133.216 1.00 7.29 ? 79 ILE C CD1 1 +ATOM 3918 N N . VAL C 3 80 ? -20.148 74.915 135.929 1.00 12.16 ? 80 VAL C N 1 +ATOM 3919 C CA . VAL C 3 80 ? -18.884 75.338 136.416 1.00 13.05 ? 80 VAL C CA 1 +ATOM 3920 C C . VAL C 3 80 ? -18.209 74.080 136.854 1.00 13.13 ? 80 VAL C C 1 +ATOM 3921 O O . VAL C 3 80 ? -18.844 73.239 137.473 1.00 14.25 ? 80 VAL C O 1 +ATOM 3922 C CB . VAL C 3 80 ? -19.018 76.394 137.534 1.00 14.04 ? 80 VAL C CB 1 +ATOM 3923 C CG1 . VAL C 3 80 ? -20.382 77.098 137.485 1.00 12.70 ? 80 VAL C CG1 1 +ATOM 3924 C CG2 . VAL C 3 80 ? -18.716 75.819 138.876 1.00 14.84 ? 80 VAL C CG2 1 +ATOM 3925 N N . ARG C 3 81 ? -16.936 73.935 136.515 1.00 12.85 ? 81 ARG C N 1 +ATOM 3926 C CA . ARG C 3 81 ? -16.251 72.649 136.589 1.00 12.62 ? 81 ARG C CA 1 +ATOM 3927 C C . ARG C 3 81 ? -15.419 72.520 137.833 1.00 12.77 ? 81 ARG C C 1 +ATOM 3928 O O . ARG C 3 81 ? -15.024 71.424 138.207 1.00 13.99 ? 81 ARG C O 1 +ATOM 3929 C CB . ARG C 3 81 ? -15.312 72.458 135.373 1.00 13.10 ? 81 ARG C CB 1 +ATOM 3930 C CG . ARG C 3 81 ? -15.963 71.955 134.088 1.00 12.14 ? 81 ARG C CG 1 +ATOM 3931 C CD . ARG C 3 81 ? -15.074 71.956 132.828 1.00 7.86 ? 81 ARG C CD 1 +ATOM 3932 N NE . ARG C 3 81 ? -15.905 71.959 131.621 1.00 8.56 ? 81 ARG C NE 1 +ATOM 3933 C CZ . ARG C 3 81 ? -16.546 70.883 131.152 1.00 10.37 ? 81 ARG C CZ 1 +ATOM 3934 N NH1 . ARG C 3 81 ? -16.420 69.704 131.771 1.00 10.41 ? 81 ARG C NH1 1 +ATOM 3935 N NH2 . ARG C 3 81 ? -17.286 70.966 130.049 1.00 9.09 ? 81 ARG C NH2 1 +ATOM 3936 N N . GLY C 3 82 ? -15.075 73.640 138.439 1.00 13.36 ? 82 GLY C N 1 +ATOM 3937 C CA . GLY C 3 82 ? -14.480 73.628 139.766 1.00 13.62 ? 82 GLY C CA 1 +ATOM 3938 C C . GLY C 3 82 ? -13.046 73.154 139.810 1.00 13.53 ? 82 GLY C C 1 +ATOM 3939 O O . GLY C 3 82 ? -12.512 72.813 140.867 1.00 13.70 ? 82 GLY C O 1 +ATOM 3940 N N . THR C 3 83 ? -12.458 73.097 138.629 1.00 13.92 ? 83 THR C N 1 +ATOM 3941 C CA . THR C 3 83 ? -11.033 72.859 138.395 1.00 14.11 ? 83 THR C CA 1 +ATOM 3942 C C . THR C 3 83 ? -10.142 73.540 139.477 1.00 14.36 ? 83 THR C C 1 +ATOM 3943 O O . THR C 3 83 ? -9.264 72.906 140.066 1.00 13.13 ? 83 THR C O 1 +ATOM 3944 C CB . THR C 3 83 ? -10.778 73.413 136.970 1.00 14.10 ? 83 THR C CB 1 +ATOM 3945 O OG1 . THR C 3 83 ? -10.920 72.346 136.021 1.00 14.44 ? 83 THR C OG1 1 +ATOM 3946 C CG2 . THR C 3 83 ? -9.372 73.957 136.775 1.00 15.01 ? 83 THR C CG2 1 +ATOM 3947 N N . GLN C 3 84 ? -10.392 74.835 139.725 1.00 14.48 ? 84 GLN C N 1 +ATOM 3948 C CA . GLN C 3 84 ? -9.882 75.491 140.905 1.00 14.79 ? 84 GLN C CA 1 +ATOM 3949 C C . GLN C 3 84 ? -11.060 75.943 141.758 1.00 14.21 ? 84 GLN C C 1 +ATOM 3950 O O . GLN C 3 84 ? -12.121 76.303 141.222 1.00 15.13 ? 84 GLN C O 1 +ATOM 3951 C CB . GLN C 3 84 ? -9.054 76.726 140.592 1.00 15.30 ? 84 GLN C CB 1 +ATOM 3952 C CG . GLN C 3 84 ? -8.161 76.760 139.390 1.00 18.53 ? 84 GLN C CG 1 +ATOM 3953 C CD . GLN C 3 84 ? -7.784 78.220 139.071 1.00 23.65 ? 84 GLN C CD 1 +ATOM 3954 O OE1 . GLN C 3 84 ? -7.259 78.940 139.958 1.00 25.31 ? 84 GLN C OE1 1 +ATOM 3955 N NE2 . GLN C 3 84 ? -8.109 78.679 137.849 1.00 22.62 ? 84 GLN C NE2 1 +ATOM 3956 N N . LEU C 3 85 ? -10.854 75.982 143.067 1.00 12.46 ? 85 LEU C N 1 +ATOM 3957 C CA . LEU C 3 85 ? -11.906 76.384 143.988 1.00 11.89 ? 85 LEU C CA 1 +ATOM 3958 C C . LEU C 3 85 ? -11.537 77.597 144.862 1.00 11.79 ? 85 LEU C C 1 +ATOM 3959 O O . LEU C 3 85 ? -10.429 77.693 145.368 1.00 10.46 ? 85 LEU C O 1 +ATOM 3960 C CB . LEU C 3 85 ? -12.331 75.192 144.881 1.00 11.44 ? 85 LEU C CB 1 +ATOM 3961 C CG . LEU C 3 85 ? -12.662 73.914 144.111 1.00 10.49 ? 85 LEU C CG 1 +ATOM 3962 C CD1 . LEU C 3 85 ? -12.768 72.782 145.067 1.00 7.56 ? 85 LEU C CD1 1 +ATOM 3963 C CD2 . LEU C 3 85 ? -13.942 74.079 143.294 1.00 7.66 ? 85 LEU C CD2 1 +ATOM 3964 N N . PHE C 3 86 ? -12.505 78.490 145.049 1.00 11.83 ? 86 PHE C N 1 +ATOM 3965 C CA . PHE C 3 86 ? -12.387 79.566 145.998 1.00 12.75 ? 86 PHE C CA 1 +ATOM 3966 C C . PHE C 3 86 ? -12.275 79.024 147.433 1.00 14.10 ? 86 PHE C C 1 +ATOM 3967 O O . PHE C 3 86 ? -12.939 78.045 147.808 1.00 12.97 ? 86 PHE C O 1 +ATOM 3968 C CB . PHE C 3 86 ? -13.581 80.503 145.887 1.00 12.54 ? 86 PHE C CB 1 +ATOM 3969 C CG . PHE C 3 86 ? -13.438 81.736 146.708 1.00 12.86 ? 86 PHE C CG 1 +ATOM 3970 C CD1 . PHE C 3 86 ? -12.483 82.724 146.354 1.00 13.23 ? 86 PHE C CD1 1 +ATOM 3971 C CD2 . PHE C 3 86 ? -14.225 81.921 147.844 1.00 10.85 ? 86 PHE C CD2 1 +ATOM 3972 C CE1 . PHE C 3 86 ? -12.333 83.885 147.121 1.00 13.56 ? 86 PHE C CE1 1 +ATOM 3973 C CE2 . PHE C 3 86 ? -14.087 83.087 148.632 1.00 10.91 ? 86 PHE C CE2 1 +ATOM 3974 C CZ . PHE C 3 86 ? -13.152 84.073 148.270 1.00 12.11 ? 86 PHE C CZ 1 +ATOM 3975 N N . GLU C 3 87 ? -11.405 79.674 148.213 1.00 16.00 ? 87 GLU C N 1 +ATOM 3976 C CA . GLU C 3 87 ? -11.020 79.205 149.538 1.00 17.70 ? 87 GLU C CA 1 +ATOM 3977 C C . GLU C 3 87 ? -10.944 77.676 149.571 1.00 18.46 ? 87 GLU C C 1 +ATOM 3978 O O . GLU C 3 87 ? -11.359 77.038 150.559 1.00 18.94 ? 87 GLU C O 1 +ATOM 3979 C CB . GLU C 3 87 ? -11.987 79.723 150.600 1.00 18.37 ? 87 GLU C CB 1 +ATOM 3980 C CG . GLU C 3 87 ? -11.757 81.158 151.041 1.00 20.21 ? 87 GLU C CG 1 +ATOM 3981 C CD . GLU C 3 87 ? -12.704 81.560 152.156 1.00 25.81 ? 87 GLU C CD 1 +ATOM 3982 O OE1 . GLU C 3 87 ? -12.905 80.764 153.130 1.00 27.63 ? 87 GLU C OE1 1 +ATOM 3983 O OE2 . GLU C 3 87 ? -13.251 82.684 152.054 1.00 28.31 ? 87 GLU C OE2 1 +ATOM 3984 N N . ASP C 3 88 ? -10.427 77.109 148.471 1.00 18.95 ? 88 ASP C N 1 +ATOM 3985 C CA . ASP C 3 88 ? -10.184 75.670 148.315 1.00 19.36 ? 88 ASP C CA 1 +ATOM 3986 C C . ASP C 3 88 ? -11.404 74.754 148.432 1.00 18.67 ? 88 ASP C C 1 +ATOM 3987 O O . ASP C 3 88 ? -11.264 73.536 148.335 1.00 18.67 ? 88 ASP C O 1 +ATOM 3988 C CB . ASP C 3 88 ? -9.144 75.204 149.327 1.00 19.98 ? 88 ASP C CB 1 +ATOM 3989 C CG . ASP C 3 88 ? -7.799 75.899 149.146 1.00 23.57 ? 88 ASP C CG 1 +ATOM 3990 O OD1 . ASP C 3 88 ? -7.589 76.504 148.048 1.00 25.28 ? 88 ASP C OD1 1 +ATOM 3991 O OD2 . ASP C 3 88 ? -6.907 75.871 150.057 1.00 24.38 ? 88 ASP C OD2 1 +ATOM 3992 N N . ASN C 3 89 ? -12.585 75.329 148.653 1.00 17.89 ? 89 ASN C N 1 +ATOM 3993 C CA . ASN C 3 89 ? -13.790 74.542 148.879 1.00 16.94 ? 89 ASN C CA 1 +ATOM 3994 C C . ASN C 3 89 ? -14.950 74.812 147.936 1.00 15.83 ? 89 ASN C C 1 +ATOM 3995 O O . ASN C 3 89 ? -15.803 73.942 147.805 1.00 15.16 ? 89 ASN C O 1 +ATOM 3996 C CB . ASN C 3 89 ? -14.308 74.724 150.303 1.00 17.62 ? 89 ASN C CB 1 +ATOM 3997 C CG . ASN C 3 89 ? -13.404 74.118 151.338 1.00 20.30 ? 89 ASN C CG 1 +ATOM 3998 O OD1 . ASN C 3 89 ? -12.259 73.769 151.054 1.00 23.84 ? 89 ASN C OD1 1 +ATOM 3999 N ND2 . ASN C 3 89 ? -13.907 74.005 152.575 1.00 23.63 ? 89 ASN C ND2 1 +ATOM 4000 N N . TYR C 3 90 ? -14.969 75.982 147.287 1.00 14.70 ? 90 TYR C N 1 +ATOM 4001 C CA . TYR C 3 90 ? -16.183 76.548 146.700 1.00 13.93 ? 90 TYR C CA 1 +ATOM 4002 C C . TYR C 3 90 ? -16.100 76.817 145.205 1.00 13.64 ? 90 TYR C C 1 +ATOM 4003 O O . TYR C 3 90 ? -15.181 77.483 144.740 1.00 13.66 ? 90 TYR C O 1 +ATOM 4004 C CB . TYR C 3 90 ? -16.530 77.864 147.415 1.00 13.96 ? 90 TYR C CB 1 +ATOM 4005 C CG . TYR C 3 90 ? -16.735 77.701 148.913 1.00 15.49 ? 90 TYR C CG 1 +ATOM 4006 C CD1 . TYR C 3 90 ? -15.800 78.227 149.836 1.00 14.68 ? 90 TYR C CD1 1 +ATOM 4007 C CD2 . TYR C 3 90 ? -17.844 77.012 149.422 1.00 13.82 ? 90 TYR C CD2 1 +ATOM 4008 C CE1 . TYR C 3 90 ? -15.974 78.082 151.188 1.00 13.72 ? 90 TYR C CE1 1 +ATOM 4009 C CE2 . TYR C 3 90 ? -18.009 76.857 150.801 1.00 13.56 ? 90 TYR C CE2 1 +ATOM 4010 C CZ . TYR C 3 90 ? -17.075 77.397 151.668 1.00 13.98 ? 90 TYR C CZ 1 +ATOM 4011 O OH . TYR C 3 90 ? -17.223 77.242 153.028 1.00 16.93 ? 90 TYR C OH 1 +ATOM 4012 N N . ALA C 3 91 ? -17.097 76.333 144.466 1.00 13.59 ? 91 ALA C N 1 +ATOM 4013 C CA . ALA C 3 91 ? -17.168 76.469 143.001 1.00 12.82 ? 91 ALA C CA 1 +ATOM 4014 C C . ALA C 3 91 ? -17.959 77.701 142.636 1.00 13.16 ? 91 ALA C C 1 +ATOM 4015 O O . ALA C 3 91 ? -17.822 78.231 141.533 1.00 13.61 ? 91 ALA C O 1 +ATOM 4016 C CB . ALA C 3 91 ? -17.832 75.285 142.418 1.00 11.84 ? 91 ALA C CB 1 +ATOM 4017 N N . LEU C 3 92 ? -18.792 78.122 143.581 1.00 12.83 ? 92 LEU C N 1 +ATOM 4018 C CA . LEU C 3 92 ? -19.652 79.276 143.487 1.00 13.30 ? 92 LEU C CA 1 +ATOM 4019 C C . LEU C 3 92 ? -19.617 79.988 144.839 1.00 13.77 ? 92 LEU C C 1 +ATOM 4020 O O . LEU C 3 92 ? -19.963 79.404 145.870 1.00 13.40 ? 92 LEU C O 1 +ATOM 4021 C CB . LEU C 3 92 ? -21.082 78.856 143.173 1.00 12.86 ? 92 LEU C CB 1 +ATOM 4022 C CG . LEU C 3 92 ? -22.040 80.036 143.239 1.00 13.30 ? 92 LEU C CG 1 +ATOM 4023 C CD1 . LEU C 3 92 ? -21.561 81.076 142.264 1.00 12.64 ? 92 LEU C CD1 1 +ATOM 4024 C CD2 . LEU C 3 92 ? -23.492 79.635 142.902 1.00 11.90 ? 92 LEU C CD2 1 +ATOM 4025 N N . ALA C 3 93 ? -19.165 81.244 144.820 1.00 14.13 ? 93 ALA C N 1 +ATOM 4026 C CA . ALA C 3 93 ? -19.084 82.072 146.017 1.00 13.50 ? 93 ALA C CA 1 +ATOM 4027 C C . ALA C 3 93 ? -19.667 83.448 145.686 1.00 13.99 ? 93 ALA C C 1 +ATOM 4028 O O . ALA C 3 93 ? -19.303 84.089 144.691 1.00 12.64 ? 93 ALA C O 1 +ATOM 4029 C CB . ALA C 3 93 ? -17.675 82.165 146.515 1.00 12.59 ? 93 ALA C CB 1 +ATOM 4030 N N . VAL C 3 94 ? -20.630 83.844 146.524 1.00 14.95 ? 94 VAL C N 1 +ATOM 4031 C CA . VAL C 3 94 ? -21.424 85.050 146.353 1.00 14.54 ? 94 VAL C CA 1 +ATOM 4032 C C . VAL C 3 94 ? -21.356 85.692 147.710 1.00 15.99 ? 94 VAL C C 1 +ATOM 4033 O O . VAL C 3 94 ? -21.890 85.141 148.669 1.00 16.85 ? 94 VAL C O 1 +ATOM 4034 C CB . VAL C 3 94 ? -22.853 84.698 145.984 1.00 13.78 ? 94 VAL C CB 1 +ATOM 4035 C CG1 . VAL C 3 94 ? -23.682 85.925 145.800 1.00 11.90 ? 94 VAL C CG1 1 +ATOM 4036 C CG2 . VAL C 3 94 ? -22.865 83.902 144.689 1.00 13.68 ? 94 VAL C CG2 1 +ATOM 4037 N N . LEU C 3 95 ? -20.648 86.823 147.805 1.00 16.67 ? 95 LEU C N 1 +ATOM 4038 C CA . LEU C 3 95 ? -20.231 87.369 149.097 1.00 17.00 ? 95 LEU C CA 1 +ATOM 4039 C C . LEU C 3 95 ? -20.263 88.878 149.159 1.00 16.85 ? 95 LEU C C 1 +ATOM 4040 O O . LEU C 3 95 ? -19.759 89.566 148.263 1.00 16.44 ? 95 LEU C O 1 +ATOM 4041 C CB . LEU C 3 95 ? -18.815 86.917 149.483 1.00 17.22 ? 95 LEU C CB 1 +ATOM 4042 C CG . LEU C 3 95 ? -18.230 85.581 149.036 1.00 19.93 ? 95 LEU C CG 1 +ATOM 4043 C CD1 . LEU C 3 95 ? -16.809 85.477 149.518 1.00 19.39 ? 95 LEU C CD1 1 +ATOM 4044 C CD2 . LEU C 3 95 ? -19.039 84.432 149.603 1.00 24.40 ? 95 LEU C CD2 1 +ATOM 4045 N N . ASP C 3 96 ? -20.830 89.375 150.248 1.00 16.51 ? 96 ASP C N 1 +ATOM 4046 C CA . ASP C 3 96 ? -20.766 90.772 150.570 1.00 17.38 ? 96 ASP C CA 1 +ATOM 4047 C C . ASP C 3 96 ? -21.213 91.623 149.416 1.00 17.74 ? 96 ASP C C 1 +ATOM 4048 O O . ASP C 3 96 ? -20.546 92.580 149.059 1.00 17.58 ? 96 ASP C O 1 +ATOM 4049 C CB . ASP C 3 96 ? -19.338 91.162 150.959 1.00 17.52 ? 96 ASP C CB 1 +ATOM 4050 C CG . ASP C 3 96 ? -18.866 90.466 152.188 1.00 17.25 ? 96 ASP C CG 1 +ATOM 4051 O OD1 . ASP C 3 96 ? -19.128 90.967 153.304 1.00 18.71 ? 96 ASP C OD1 1 +ATOM 4052 O OD2 . ASP C 3 96 ? -18.219 89.411 152.132 1.00 17.70 ? 96 ASP C OD2 1 +ATOM 4053 N N . ASN C 3 97 ? -22.343 91.273 148.832 1.00 18.94 ? 97 ASN C N 1 +ATOM 4054 C CA . ASN C 3 97 ? -22.896 92.055 147.752 1.00 20.41 ? 97 ASN C CA 1 +ATOM 4055 C C . ASN C 3 97 ? -23.947 93.026 148.269 1.00 22.45 ? 97 ASN C C 1 +ATOM 4056 O O . ASN C 3 97 ? -25.151 92.837 148.081 1.00 22.98 ? 97 ASN C O 1 +ATOM 4057 C CB . ASN C 3 97 ? -23.455 91.142 146.687 1.00 19.69 ? 97 ASN C CB 1 +ATOM 4058 C CG . ASN C 3 97 ? -22.389 90.365 145.998 1.00 19.07 ? 97 ASN C CG 1 +ATOM 4059 O OD1 . ASN C 3 97 ? -21.483 90.951 145.393 1.00 19.83 ? 97 ASN C OD1 1 +ATOM 4060 N ND2 . ASN C 3 97 ? -22.469 89.033 146.076 1.00 15.90 ? 97 ASN C ND2 1 +ATOM 4061 N N . GLY C 3 98 ? -23.471 94.067 148.935 1.00 24.56 ? 98 GLY C N 1 +ATOM 4062 C CA . GLY C 3 98 ? -24.327 95.068 149.532 1.00 27.62 ? 98 GLY C CA 1 +ATOM 4063 C C . GLY C 3 98 ? -23.478 96.283 149.782 1.00 30.03 ? 98 GLY C C 1 +ATOM 4064 O O . GLY C 3 98 ? -22.241 96.194 149.808 1.00 30.60 ? 98 GLY C O 1 +ATOM 4065 N N . ASP C 3 99 ? -24.154 97.410 149.973 1.00 32.09 ? 99 ASP C N 1 +ATOM 4066 C CA . ASP C 3 99 ? -23.545 98.744 150.063 1.00 34.24 ? 99 ASP C CA 1 +ATOM 4067 C C . ASP C 3 99 ? -22.334 98.877 151.015 1.00 35.02 ? 99 ASP C C 1 +ATOM 4068 O O . ASP C 3 99 ? -22.228 98.111 151.980 1.00 34.83 ? 99 ASP C O 1 +ATOM 4069 C CB . ASP C 3 99 ? -24.637 99.778 150.446 1.00 34.65 ? 99 ASP C CB 1 +ATOM 4070 C CG . ASP C 3 99 ? -25.552 100.156 149.258 1.00 36.11 ? 99 ASP C CG 1 +ATOM 4071 O OD1 . ASP C 3 99 ? -25.083 100.124 148.085 1.00 37.82 ? 99 ASP C OD1 1 +ATOM 4072 O OD2 . ASP C 3 99 ? -26.753 100.499 149.407 1.00 36.74 ? 99 ASP C OD2 1 +ATOM 4073 N N . PRO C 3 100 ? -21.420 99.822 150.715 1.00 36.22 ? 100 PRO C N 1 +ATOM 4074 C CA . PRO C 3 100 ? -20.390 100.291 151.675 1.00 36.77 ? 100 PRO C CA 1 +ATOM 4075 C C . PRO C 3 100 ? -20.922 100.697 153.046 1.00 36.98 ? 100 PRO C C 1 +ATOM 4076 O O . PRO C 3 100 ? -22.074 101.119 153.146 1.00 37.33 ? 100 PRO C O 1 +ATOM 4077 C CB . PRO C 3 100 ? -19.810 101.543 150.984 1.00 36.90 ? 100 PRO C CB 1 +ATOM 4078 C CG . PRO C 3 100 ? -19.921 101.233 149.504 1.00 36.99 ? 100 PRO C CG 1 +ATOM 4079 C CD . PRO C 3 100 ? -21.250 100.463 149.389 1.00 36.47 ? 100 PRO C CD 1 +ATOM 4080 N N . LEU C 3 101 ? -20.093 100.577 154.084 1.00 37.23 ? 101 LEU C N 1 +ATOM 4081 C CA . LEU C 3 101 ? -20.405 101.210 155.370 1.00 37.54 ? 101 LEU C CA 1 +ATOM 4082 C C . LEU C 3 101 ? -20.281 102.737 155.210 1.00 37.70 ? 101 LEU C C 1 +ATOM 4083 O O . LEU C 3 101 ? -20.148 103.259 154.090 1.00 37.64 ? 101 LEU C O 1 +ATOM 4084 C CB . LEU C 3 101 ? -19.516 100.668 156.516 1.00 37.46 ? 101 LEU C CB 1 +ATOM 4085 C CG . LEU C 3 101 ? -18.939 101.603 157.605 1.00 38.16 ? 101 LEU C CG 1 +ATOM 4086 C CD1 . LEU C 3 101 ? -19.512 101.328 159.014 1.00 37.70 ? 101 LEU C CD1 1 +ATOM 4087 C CD2 . LEU C 3 101 ? -17.392 101.571 157.613 1.00 37.60 ? 101 LEU C CD2 1 +ATOM 4088 N N . SER C 3 111 ? -32.341 102.440 144.354 1.00 23.71 ? 111 SER C N 1 +ATOM 4089 C CA . SER C 3 111 ? -32.095 102.261 145.782 1.00 23.35 ? 111 SER C CA 1 +ATOM 4090 C C . SER C 3 111 ? -32.603 100.880 146.266 1.00 23.11 ? 111 SER C C 1 +ATOM 4091 O O . SER C 3 111 ? -33.634 100.401 145.765 1.00 23.41 ? 111 SER C O 1 +ATOM 4092 C CB . SER C 3 111 ? -32.781 103.396 146.578 1.00 23.45 ? 111 SER C CB 1 +ATOM 4093 O OG . SER C 3 111 ? -32.600 104.673 145.970 1.00 22.67 ? 111 SER C OG 1 +ATOM 4094 N N . PRO C 3 112 ? -31.882 100.218 147.187 1.00 22.19 ? 112 PRO C N 1 +ATOM 4095 C CA . PRO C 3 112 ? -30.464 100.470 147.454 1.00 21.08 ? 112 PRO C CA 1 +ATOM 4096 C C . PRO C 3 112 ? -29.587 99.542 146.603 1.00 20.09 ? 112 PRO C C 1 +ATOM 4097 O O . PRO C 3 112 ? -30.089 98.953 145.651 1.00 20.73 ? 112 PRO C O 1 +ATOM 4098 C CB . PRO C 3 112 ? -30.333 100.146 148.953 1.00 21.47 ? 112 PRO C CB 1 +ATOM 4099 C CG . PRO C 3 112 ? -31.503 99.211 149.298 1.00 21.59 ? 112 PRO C CG 1 +ATOM 4100 C CD . PRO C 3 112 ? -32.440 99.214 148.118 1.00 22.42 ? 112 PRO C CD 1 +ATOM 4101 N N . GLY C 3 113 ? -28.302 99.421 146.921 1.00 18.32 ? 113 GLY C N 1 +ATOM 4102 C CA . GLY C 3 113 ? -27.394 98.611 146.133 1.00 15.83 ? 113 GLY C CA 1 +ATOM 4103 C C . GLY C 3 113 ? -27.324 97.191 146.656 1.00 14.67 ? 113 GLY C C 1 +ATOM 4104 O O . GLY C 3 113 ? -27.725 96.936 147.796 1.00 14.94 ? 113 GLY C O 1 +ATOM 4105 N N . GLY C 3 114 ? -26.826 96.268 145.831 1.00 13.13 ? 114 GLY C N 1 +ATOM 4106 C CA . GLY C 3 114 ? -26.766 94.867 146.202 1.00 12.18 ? 114 GLY C CA 1 +ATOM 4107 C C . GLY C 3 114 ? -27.555 93.909 145.328 1.00 11.53 ? 114 GLY C C 1 +ATOM 4108 O O . GLY C 3 114 ? -28.624 94.243 144.821 1.00 10.91 ? 114 GLY C O 1 +ATOM 4109 N N . LEU C 3 115 ? -27.035 92.687 145.212 1.00 11.37 ? 115 LEU C N 1 +ATOM 4110 C CA . LEU C 3 115 ? -27.466 91.730 144.209 1.00 10.83 ? 115 LEU C CA 1 +ATOM 4111 C C . LEU C 3 115 ? -28.709 91.096 144.715 1.00 11.70 ? 115 LEU C C 1 +ATOM 4112 O O . LEU C 3 115 ? -28.787 90.704 145.859 1.00 12.01 ? 115 LEU C O 1 +ATOM 4113 C CB . LEU C 3 115 ? -26.391 90.679 144.006 1.00 11.02 ? 115 LEU C CB 1 +ATOM 4114 C CG . LEU C 3 115 ? -26.776 89.464 143.174 1.00 9.97 ? 115 LEU C CG 1 +ATOM 4115 C CD1 . LEU C 3 115 ? -26.666 89.746 141.670 1.00 5.88 ? 115 LEU C CD1 1 +ATOM 4116 C CD2 . LEU C 3 115 ? -25.889 88.322 143.597 1.00 10.58 ? 115 LEU C CD2 1 +ATOM 4117 N N . ARG C 3 116 ? -29.708 91.001 143.862 1.00 12.78 ? 116 ARG C N 1 +ATOM 4118 C CA . ARG C 3 116 ? -31.036 90.687 144.348 1.00 13.62 ? 116 ARG C CA 1 +ATOM 4119 C C . ARG C 3 116 ? -31.444 89.229 144.143 1.00 14.05 ? 116 ARG C C 1 +ATOM 4120 O O . ARG C 3 116 ? -32.254 88.685 144.887 1.00 13.31 ? 116 ARG C O 1 +ATOM 4121 C CB . ARG C 3 116 ? -32.031 91.593 143.649 1.00 13.64 ? 116 ARG C CB 1 +ATOM 4122 C CG . ARG C 3 116 ? -31.798 93.054 143.866 1.00 13.32 ? 116 ARG C CG 1 +ATOM 4123 C CD . ARG C 3 116 ? -32.897 93.896 143.260 1.00 14.85 ? 116 ARG C CD 1 +ATOM 4124 N NE . ARG C 3 116 ? -33.718 94.505 144.287 1.00 17.78 ? 116 ARG C NE 1 +ATOM 4125 C CZ . ARG C 3 116 ? -35.036 94.401 144.354 1.00 18.91 ? 116 ARG C CZ 1 +ATOM 4126 N NH1 . ARG C 3 116 ? -35.697 93.678 143.445 1.00 18.84 ? 116 ARG C NH1 1 +ATOM 4127 N NH2 . ARG C 3 116 ? -35.690 95.013 145.339 1.00 16.63 ? 116 ARG C NH2 1 +ATOM 4128 N N . GLU C 3 117 ? -30.876 88.620 143.110 1.00 15.04 ? 117 GLU C N 1 +ATOM 4129 C CA . GLU C 3 117 ? -31.333 87.340 142.604 1.00 16.08 ? 117 GLU C CA 1 +ATOM 4130 C C . GLU C 3 117 ? -30.139 86.806 141.887 1.00 16.14 ? 117 GLU C C 1 +ATOM 4131 O O . GLU C 3 117 ? -29.533 87.534 141.114 1.00 16.71 ? 117 GLU C O 1 +ATOM 4132 C CB . GLU C 3 117 ? -32.497 87.532 141.611 1.00 15.57 ? 117 GLU C CB 1 +ATOM 4133 C CG . GLU C 3 117 ? -33.809 87.928 142.269 1.00 17.26 ? 117 GLU C CG 1 +ATOM 4134 C CD . GLU C 3 117 ? -34.929 88.345 141.288 1.00 21.43 ? 117 GLU C CD 1 +ATOM 4135 O OE1 . GLU C 3 117 ? -34.737 88.254 140.048 1.00 22.23 ? 117 GLU C OE1 1 +ATOM 4136 O OE2 . GLU C 3 117 ? -36.016 88.781 141.774 1.00 21.40 ? 117 GLU C OE2 1 +ATOM 4137 N N . LEU C 3 118 ? -29.797 85.547 142.135 1.00 16.58 ? 118 LEU C N 1 +ATOM 4138 C CA . LEU C 3 118 ? -28.647 84.922 141.475 1.00 16.40 ? 118 LEU C CA 1 +ATOM 4139 C C . LEU C 3 118 ? -28.870 84.746 139.965 1.00 17.73 ? 118 LEU C C 1 +ATOM 4140 O O . LEU C 3 118 ? -27.916 84.698 139.187 1.00 17.74 ? 118 LEU C O 1 +ATOM 4141 C CB . LEU C 3 118 ? -28.333 83.585 142.119 1.00 15.70 ? 118 LEU C CB 1 +ATOM 4142 C CG . LEU C 3 118 ? -27.652 83.620 143.473 1.00 13.56 ? 118 LEU C CG 1 +ATOM 4143 C CD1 . LEU C 3 118 ? -27.791 82.270 144.204 1.00 14.27 ? 118 LEU C CD1 1 +ATOM 4144 C CD2 . LEU C 3 118 ? -26.219 83.948 143.256 1.00 12.02 ? 118 LEU C CD2 1 +ATOM 4145 N N . GLN C 3 119 ? -30.129 84.640 139.550 1.00 18.92 ? 119 GLN C N 1 +ATOM 4146 C CA . GLN C 3 119 ? -30.469 84.562 138.114 1.00 20.04 ? 119 GLN C CA 1 +ATOM 4147 C C . GLN C 3 119 ? -29.729 83.446 137.325 1.00 19.23 ? 119 GLN C C 1 +ATOM 4148 O O . GLN C 3 119 ? -29.606 83.497 136.094 1.00 19.86 ? 119 GLN C O 1 +ATOM 4149 C CB . GLN C 3 119 ? -30.256 85.919 137.427 1.00 20.32 ? 119 GLN C CB 1 +ATOM 4150 C CG . GLN C 3 119 ? -31.238 86.990 137.811 1.00 24.27 ? 119 GLN C CG 1 +ATOM 4151 C CD . GLN C 3 119 ? -32.504 86.979 136.975 1.00 31.85 ? 119 GLN C CD 1 +ATOM 4152 O OE1 . GLN C 3 119 ? -32.949 85.900 136.528 1.00 35.10 ? 119 GLN C OE1 1 +ATOM 4153 N NE2 . GLN C 3 119 ? -33.109 88.179 136.762 1.00 31.12 ? 119 GLN C NE2 1 +ATOM 4154 N N . LEU C 3 120 ? -29.271 82.426 138.029 1.00 17.81 ? 120 LEU C N 1 +ATOM 4155 C CA . LEU C 3 120 ? -28.525 81.368 137.383 1.00 16.71 ? 120 LEU C CA 1 +ATOM 4156 C C . LEU C 3 120 ? -29.404 80.278 136.717 1.00 16.20 ? 120 LEU C C 1 +ATOM 4157 O O . LEU C 3 120 ? -29.173 79.088 136.909 1.00 15.83 ? 120 LEU C O 1 +ATOM 4158 C CB . LEU C 3 120 ? -27.521 80.789 138.387 1.00 16.64 ? 120 LEU C CB 1 +ATOM 4159 C CG . LEU C 3 120 ? -26.469 81.828 138.785 1.00 14.16 ? 120 LEU C CG 1 +ATOM 4160 C CD1 . LEU C 3 120 ? -25.673 81.373 139.960 1.00 14.49 ? 120 LEU C CD1 1 +ATOM 4161 C CD2 . LEU C 3 120 ? -25.558 82.080 137.641 1.00 13.83 ? 120 LEU C CD2 1 +ATOM 4162 N N . ARG C 3 121 ? -30.360 80.683 135.875 1.00 15.62 ? 121 ARG C N 1 +ATOM 4163 C CA . ARG C 3 121 ? -31.367 79.738 135.389 1.00 15.61 ? 121 ARG C CA 1 +ATOM 4164 C C . ARG C 3 121 ? -30.872 78.548 134.589 1.00 15.32 ? 121 ARG C C 1 +ATOM 4165 O O . ARG C 3 121 ? -31.582 77.559 134.497 1.00 15.79 ? 121 ARG C O 1 +ATOM 4166 C CB . ARG C 3 121 ? -32.505 80.410 134.625 1.00 15.78 ? 121 ARG C CB 1 +ATOM 4167 C CG . ARG C 3 121 ? -32.280 81.820 134.267 1.00 17.18 ? 121 ARG C CG 1 +ATOM 4168 C CD . ARG C 3 121 ? -33.369 82.377 133.383 1.00 16.84 ? 121 ARG C CD 1 +ATOM 4169 N NE . ARG C 3 121 ? -34.087 83.466 134.043 1.00 18.27 ? 121 ARG C NE 1 +ATOM 4170 C CZ . ARG C 3 121 ? -34.756 84.409 133.383 1.00 20.83 ? 121 ARG C CZ 1 +ATOM 4171 N NH1 . ARG C 3 121 ? -34.758 84.390 132.047 1.00 21.30 ? 121 ARG C NH1 1 +ATOM 4172 N NH2 . ARG C 3 121 ? -35.419 85.361 134.047 1.00 19.58 ? 121 ARG C NH2 1 +ATOM 4173 N N . SER C 3 122 ? -29.702 78.647 133.968 1.00 15.10 ? 122 SER C N 1 +ATOM 4174 C CA . SER C 3 122 ? -29.153 77.498 133.237 1.00 14.01 ? 122 SER C CA 1 +ATOM 4175 C C . SER C 3 122 ? -28.130 76.726 134.040 1.00 14.00 ? 122 SER C C 1 +ATOM 4176 O O . SER C 3 122 ? -27.605 75.733 133.538 1.00 14.10 ? 122 SER C O 1 +ATOM 4177 C CB . SER C 3 122 ? -28.480 77.911 131.941 1.00 13.02 ? 122 SER C CB 1 +ATOM 4178 O OG . SER C 3 122 ? -29.276 78.805 131.238 1.00 11.54 ? 122 SER C OG 1 +ATOM 4179 N N . LEU C 3 123 ? -27.810 77.189 135.251 1.00 13.45 ? 123 LEU C N 1 +ATOM 4180 C CA . LEU C 3 123 ? -26.679 76.604 135.975 1.00 12.76 ? 123 LEU C CA 1 +ATOM 4181 C C . LEU C 3 123 ? -27.066 75.233 136.468 1.00 12.90 ? 123 LEU C C 1 +ATOM 4182 O O . LEU C 3 123 ? -27.804 75.064 137.424 1.00 14.00 ? 123 LEU C O 1 +ATOM 4183 C CB . LEU C 3 123 ? -26.160 77.504 137.089 1.00 11.97 ? 123 LEU C CB 1 +ATOM 4184 C CG . LEU C 3 123 ? -25.032 76.905 137.906 1.00 12.28 ? 123 LEU C CG 1 +ATOM 4185 C CD1 . LEU C 3 123 ? -23.843 76.486 137.062 1.00 12.05 ? 123 LEU C CD1 1 +ATOM 4186 C CD2 . LEU C 3 123 ? -24.626 77.838 138.996 1.00 15.46 ? 123 LEU C CD2 1 +ATOM 4187 N N . THR C 3 124 ? -26.598 74.229 135.780 1.00 12.25 ? 124 THR C N 1 +ATOM 4188 C CA . THR C 3 124 ? -27.276 72.979 135.960 1.00 12.44 ? 124 THR C CA 1 +ATOM 4189 C C . THR C 3 124 ? -26.289 71.880 136.350 1.00 12.86 ? 124 THR C C 1 +ATOM 4190 O O . THR C 3 124 ? -26.727 70.809 136.703 1.00 13.10 ? 124 THR C O 1 +ATOM 4191 C CB . THR C 3 124 ? -28.094 72.725 134.664 1.00 12.93 ? 124 THR C CB 1 +ATOM 4192 O OG1 . THR C 3 124 ? -29.517 72.629 134.952 1.00 13.40 ? 124 THR C OG1 1 +ATOM 4193 C CG2 . THR C 3 124 ? -27.712 71.507 133.990 1.00 10.05 ? 124 THR C CG2 1 +ATOM 4194 N N . GLU C 3 125 ? -24.979 72.197 136.340 1.00 11.97 ? 125 GLU C N 1 +ATOM 4195 C CA . GLU C 3 125 ? -23.889 71.303 136.692 1.00 11.76 ? 125 GLU C CA 1 +ATOM 4196 C C . GLU C 3 125 ? -22.701 71.987 137.444 1.00 11.89 ? 125 GLU C C 1 +ATOM 4197 O O . GLU C 3 125 ? -22.108 72.924 136.934 1.00 13.26 ? 125 GLU C O 1 +ATOM 4198 C CB . GLU C 3 125 ? -23.352 70.716 135.399 1.00 12.19 ? 125 GLU C CB 1 +ATOM 4199 C CG . GLU C 3 125 ? -22.253 69.686 135.527 1.00 12.34 ? 125 GLU C CG 1 +ATOM 4200 C CD . GLU C 3 125 ? -22.712 68.418 136.219 1.00 16.00 ? 125 GLU C CD 1 +ATOM 4201 O OE1 . GLU C 3 125 ? -23.031 67.369 135.571 1.00 13.71 ? 125 GLU C OE1 1 +ATOM 4202 O OE2 . GLU C 3 125 ? -22.737 68.472 137.461 1.00 19.84 ? 125 GLU C OE2 1 +ATOM 4203 N N . ILE C 3 126 ? -22.346 71.524 138.631 1.00 10.41 ? 126 ILE C N 1 +ATOM 4204 C CA . ILE C 3 126 ? -21.065 71.878 139.234 1.00 9.57 ? 126 ILE C CA 1 +ATOM 4205 C C . ILE C 3 126 ? -20.248 70.589 139.404 1.00 8.91 ? 126 ILE C C 1 +ATOM 4206 O O . ILE C 3 126 ? -20.673 69.658 140.048 1.00 7.64 ? 126 ILE C O 1 +ATOM 4207 C CB . ILE C 3 126 ? -21.256 72.615 140.594 1.00 10.15 ? 126 ILE C CB 1 +ATOM 4208 C CG1 . ILE C 3 126 ? -21.998 73.966 140.406 1.00 11.85 ? 126 ILE C CG1 1 +ATOM 4209 C CG2 . ILE C 3 126 ? -19.930 72.866 141.250 1.00 8.66 ? 126 ILE C CG2 1 +ATOM 4210 C CD1 . ILE C 3 126 ? -22.383 74.682 141.734 1.00 8.25 ? 126 ILE C CD1 1 +ATOM 4211 N N . LEU C 3 127 ? -19.081 70.498 138.792 1.00 9.11 ? 127 LEU C N 1 +ATOM 4212 C CA . LEU C 3 127 ? -18.442 69.182 138.772 1.00 8.75 ? 127 LEU C CA 1 +ATOM 4213 C C . LEU C 3 127 ? -17.764 68.927 140.111 1.00 9.06 ? 127 LEU C C 1 +ATOM 4214 O O . LEU C 3 127 ? -17.883 67.854 140.641 1.00 7.80 ? 127 LEU C O 1 +ATOM 4215 C CB . LEU C 3 127 ? -17.471 69.012 137.589 1.00 7.73 ? 127 LEU C CB 1 +ATOM 4216 C CG . LEU C 3 127 ? -17.984 69.077 136.151 1.00 6.52 ? 127 LEU C CG 1 +ATOM 4217 C CD1 . LEU C 3 127 ? -16.878 68.652 135.236 1.00 5.68 ? 127 LEU C CD1 1 +ATOM 4218 C CD2 . LEU C 3 127 ? -19.193 68.211 135.918 1.00 4.10 ? 127 LEU C CD2 1 +ATOM 4219 N N . LYS C 3 128 ? -17.076 69.942 140.637 1.00 9.81 ? 128 LYS C N 1 +ATOM 4220 C CA . LYS C 3 128 ? -16.329 69.850 141.881 1.00 10.91 ? 128 LYS C CA 1 +ATOM 4221 C C . LYS C 3 128 ? -16.540 71.108 142.719 1.00 10.91 ? 128 LYS C C 1 +ATOM 4222 O O . LYS C 3 128 ? -16.716 72.186 142.172 1.00 10.25 ? 128 LYS C O 1 +ATOM 4223 C CB . LYS C 3 128 ? -14.841 69.642 141.586 1.00 11.77 ? 128 LYS C CB 1 +ATOM 4224 C CG . LYS C 3 128 ? -14.538 68.213 141.039 1.00 15.58 ? 128 LYS C CG 1 +ATOM 4225 C CD . LYS C 3 128 ? -13.055 67.964 140.730 1.00 21.58 ? 128 LYS C CD 1 +ATOM 4226 C CE . LYS C 3 128 ? -12.851 67.108 139.445 1.00 24.83 ? 128 LYS C CE 1 +ATOM 4227 N NZ . LYS C 3 128 ? -11.706 67.644 138.586 1.00 27.58 ? 128 LYS C NZ 1 +ATOM 4228 N N . GLY C 3 129 ? -16.544 70.966 144.050 1.00 11.31 ? 129 GLY C N 1 +ATOM 4229 C CA . GLY C 3 129 ? -16.601 72.116 144.947 1.00 10.91 ? 129 GLY C CA 1 +ATOM 4230 C C . GLY C 3 129 ? -18.012 72.567 145.245 1.00 10.76 ? 129 GLY C C 1 +ATOM 4231 O O . GLY C 3 129 ? -18.920 72.254 144.484 1.00 11.98 ? 129 GLY C O 1 +ATOM 4232 N N . GLY C 3 130 ? -18.204 73.287 146.347 1.00 10.13 ? 130 GLY C N 1 +ATOM 4233 C CA . GLY C 3 130 ? -19.512 73.737 146.775 1.00 10.06 ? 130 GLY C CA 1 +ATOM 4234 C C . GLY C 3 130 ? -19.876 75.192 146.495 1.00 11.34 ? 130 GLY C C 1 +ATOM 4235 O O . GLY C 3 130 ? -19.382 75.817 145.541 1.00 10.75 ? 130 GLY C O 1 +ATOM 4236 N N . VAL C 3 131 ? -20.756 75.719 147.352 1.00 12.20 ? 131 VAL C N 1 +ATOM 4237 C CA . VAL C 3 131 ? -21.418 77.001 147.182 1.00 12.86 ? 131 VAL C CA 1 +ATOM 4238 C C . VAL C 3 131 ? -21.321 77.840 148.468 1.00 13.69 ? 131 VAL C C 1 +ATOM 4239 O O . VAL C 3 131 ? -21.612 77.369 149.582 1.00 14.01 ? 131 VAL C O 1 +ATOM 4240 C CB . VAL C 3 131 ? -22.884 76.760 146.844 1.00 13.70 ? 131 VAL C CB 1 +ATOM 4241 C CG1 . VAL C 3 131 ? -23.700 78.065 146.897 1.00 15.00 ? 131 VAL C CG1 1 +ATOM 4242 C CG2 . VAL C 3 131 ? -23.013 76.095 145.446 1.00 14.16 ? 131 VAL C CG2 1 +ATOM 4243 N N . LEU C 3 132 ? -20.892 79.084 148.336 1.00 13.94 ? 132 LEU C N 1 +ATOM 4244 C CA . LEU C 3 132 ? -20.703 79.912 149.505 1.00 14.40 ? 132 LEU C CA 1 +ATOM 4245 C C . LEU C 3 132 ? -21.389 81.233 149.268 1.00 14.87 ? 132 LEU C C 1 +ATOM 4246 O O . LEU C 3 132 ? -20.900 82.076 148.477 1.00 16.22 ? 132 LEU C O 1 +ATOM 4247 C CB . LEU C 3 132 ? -19.222 80.123 149.802 1.00 13.89 ? 132 LEU C CB 1 +ATOM 4248 C CG . LEU C 3 132 ? -18.913 81.042 150.991 1.00 14.53 ? 132 LEU C CG 1 +ATOM 4249 C CD1 . LEU C 3 132 ? -19.374 80.456 152.347 1.00 14.54 ? 132 LEU C CD1 1 +ATOM 4250 C CD2 . LEU C 3 132 ? -17.445 81.393 151.059 1.00 12.77 ? 132 LEU C CD2 1 +ATOM 4251 N N . ILE C 3 133 ? -22.528 81.394 149.933 1.00 13.94 ? 133 ILE C N 1 +ATOM 4252 C CA . ILE C 3 133 ? -23.341 82.589 149.802 1.00 13.41 ? 133 ILE C CA 1 +ATOM 4253 C C . ILE C 3 133 ? -23.479 83.235 151.193 1.00 13.33 ? 133 ILE C C 1 +ATOM 4254 O O . ILE C 3 133 ? -24.219 82.722 152.037 1.00 12.59 ? 133 ILE C O 1 +ATOM 4255 C CB . ILE C 3 133 ? -24.697 82.202 149.192 1.00 13.16 ? 133 ILE C CB 1 +ATOM 4256 C CG1 . ILE C 3 133 ? -24.512 81.742 147.750 1.00 12.86 ? 133 ILE C CG1 1 +ATOM 4257 C CG2 . ILE C 3 133 ? -25.653 83.330 149.249 1.00 12.41 ? 133 ILE C CG2 1 +ATOM 4258 C CD1 . ILE C 3 133 ? -25.684 80.934 147.196 1.00 11.99 ? 133 ILE C CD1 1 +ATOM 4259 N N . GLN C 3 134 ? -22.731 84.321 151.430 1.00 12.94 ? 134 GLN C N 1 +ATOM 4260 C CA . GLN C 3 134 ? -22.766 85.041 152.712 1.00 13.24 ? 134 GLN C CA 1 +ATOM 4261 C C . GLN C 3 134 ? -22.888 86.559 152.535 1.00 13.12 ? 134 GLN C C 1 +ATOM 4262 O O . GLN C 3 134 ? -22.613 87.074 151.476 1.00 12.12 ? 134 GLN C O 1 +ATOM 4263 C CB . GLN C 3 134 ? -21.563 84.715 153.634 1.00 13.40 ? 134 GLN C CB 1 +ATOM 4264 C CG . GLN C 3 134 ? -21.140 83.249 153.701 1.00 12.93 ? 134 GLN C CG 1 +ATOM 4265 C CD . GLN C 3 134 ? -21.943 82.443 154.680 1.00 13.61 ? 134 GLN C CD 1 +ATOM 4266 O OE1 . GLN C 3 134 ? -21.756 82.569 155.864 1.00 15.94 ? 134 GLN C OE1 1 +ATOM 4267 N NE2 . GLN C 3 134 ? -22.827 81.599 154.185 1.00 15.10 ? 134 GLN C NE2 1 +ATOM 4268 N N . ARG C 3 135 ? -23.328 87.253 153.595 1.00 13.61 ? 135 ARG C N 1 +ATOM 4269 C CA . ARG C 3 135 ? -23.495 88.715 153.608 1.00 13.34 ? 135 ARG C CA 1 +ATOM 4270 C C . ARG C 3 135 ? -24.025 89.344 152.285 1.00 12.82 ? 135 ARG C C 1 +ATOM 4271 O O . ARG C 3 135 ? -23.391 90.212 151.697 1.00 12.63 ? 135 ARG C O 1 +ATOM 4272 C CB . ARG C 3 135 ? -22.200 89.419 154.062 1.00 13.78 ? 135 ARG C CB 1 +ATOM 4273 C CG . ARG C 3 135 ? -21.357 88.742 155.160 1.00 15.27 ? 135 ARG C CG 1 +ATOM 4274 C CD . ARG C 3 135 ? -19.812 88.954 154.948 1.00 18.67 ? 135 ARG C CD 1 +ATOM 4275 N NE . ARG C 3 135 ? -19.018 87.726 154.869 1.00 18.86 ? 135 ARG C NE 1 +ATOM 4276 C CZ . ARG C 3 135 ? -19.141 86.729 155.744 1.00 25.17 ? 135 ARG C CZ 1 +ATOM 4277 N NH1 . ARG C 3 135 ? -20.033 86.800 156.744 1.00 25.69 ? 135 ARG C NH1 1 +ATOM 4278 N NH2 . ARG C 3 135 ? -18.373 85.649 155.633 1.00 29.11 ? 135 ARG C NH2 1 +ATOM 4279 N N . ASN C 3 136 ? -25.190 88.882 151.842 1.00 12.25 ? 136 ASN C N 1 +ATOM 4280 C CA . ASN C 3 136 ? -25.907 89.408 150.686 1.00 10.96 ? 136 ASN C CA 1 +ATOM 4281 C C . ASN C 3 136 ? -27.300 89.981 151.102 1.00 10.82 ? 136 ASN C C 1 +ATOM 4282 O O . ASN C 3 136 ? -28.313 89.280 151.078 1.00 11.09 ? 136 ASN C O 1 +ATOM 4283 C CB . ASN C 3 136 ? -26.059 88.310 149.665 1.00 9.60 ? 136 ASN C CB 1 +ATOM 4284 C CG . ASN C 3 136 ? -24.713 87.805 149.130 1.00 11.28 ? 136 ASN C CG 1 +ATOM 4285 O OD1 . ASN C 3 136 ? -23.895 88.581 148.627 1.00 8.84 ? 136 ASN C OD1 1 +ATOM 4286 N ND2 . ASN C 3 136 ? -24.488 86.476 149.219 1.00 10.38 ? 136 ASN C ND2 1 +ATOM 4287 N N . PRO C 3 137 ? -27.345 91.255 151.477 1.00 10.02 ? 137 PRO C N 1 +ATOM 4288 C CA . PRO C 3 137 ? -28.512 91.851 152.144 1.00 9.86 ? 137 PRO C CA 1 +ATOM 4289 C C . PRO C 3 137 ? -29.785 91.940 151.301 1.00 9.66 ? 137 PRO C C 1 +ATOM 4290 O O . PRO C 3 137 ? -30.855 92.025 151.883 1.00 8.34 ? 137 PRO C O 1 +ATOM 4291 C CB . PRO C 3 137 ? -28.021 93.275 152.477 1.00 9.52 ? 137 PRO C CB 1 +ATOM 4292 C CG . PRO C 3 137 ? -26.598 93.173 152.518 1.00 8.35 ? 137 PRO C CG 1 +ATOM 4293 C CD . PRO C 3 137 ? -26.276 92.247 151.335 1.00 10.49 ? 137 PRO C CD 1 +ATOM 4294 N N . GLN C 3 138 ? -29.665 91.926 149.975 1.00 9.68 ? 138 GLN C N 1 +ATOM 4295 C CA . GLN C 3 138 ? -30.810 92.174 149.114 1.00 9.75 ? 138 GLN C CA 1 +ATOM 4296 C C . GLN C 3 138 ? -31.114 90.914 148.363 1.00 10.12 ? 138 GLN C C 1 +ATOM 4297 O O . GLN C 3 138 ? -31.994 90.880 147.509 1.00 10.78 ? 138 GLN C O 1 +ATOM 4298 C CB . GLN C 3 138 ? -30.490 93.257 148.096 1.00 9.75 ? 138 GLN C CB 1 +ATOM 4299 C CG . GLN C 3 138 ? -30.090 94.583 148.652 1.00 9.99 ? 138 GLN C CG 1 +ATOM 4300 C CD . GLN C 3 138 ? -31.163 95.173 149.501 1.00 12.51 ? 138 GLN C CD 1 +ATOM 4301 O OE1 . GLN C 3 138 ? -30.998 95.293 150.730 1.00 14.16 ? 138 GLN C OE1 1 +ATOM 4302 N NE2 . GLN C 3 138 ? -32.283 95.538 148.872 1.00 11.16 ? 138 GLN C NE2 1 +ATOM 4303 N N . LEU C 3 139 ? -30.365 89.872 148.672 1.00 10.44 ? 139 LEU C N 1 +ATOM 4304 C CA . LEU C 3 139 ? -30.437 88.650 147.903 1.00 10.89 ? 139 LEU C CA 1 +ATOM 4305 C C . LEU C 3 139 ? -31.528 87.698 148.429 1.00 11.67 ? 139 LEU C C 1 +ATOM 4306 O O . LEU C 3 139 ? -31.555 87.358 149.628 1.00 11.99 ? 139 LEU C O 1 +ATOM 4307 C CB . LEU C 3 139 ? -29.053 88.003 147.858 1.00 9.87 ? 139 LEU C CB 1 +ATOM 4308 C CG . LEU C 3 139 ? -29.001 86.638 147.181 1.00 10.41 ? 139 LEU C CG 1 +ATOM 4309 C CD1 . LEU C 3 139 ? -29.183 86.763 145.670 1.00 7.95 ? 139 LEU C CD1 1 +ATOM 4310 C CD2 . LEU C 3 139 ? -27.696 85.871 147.584 1.00 8.40 ? 139 LEU C CD2 1 +ATOM 4311 N N . CYS C 3 140 ? -32.428 87.294 147.529 1.00 12.05 ? 140 CYS C N 1 +ATOM 4312 C CA . CYS C 3 140 ? -33.530 86.369 147.844 1.00 12.96 ? 140 CYS C CA 1 +ATOM 4313 C C . CYS C 3 140 ? -33.367 85.096 147.058 1.00 13.04 ? 140 CYS C C 1 +ATOM 4314 O O . CYS C 3 140 ? -32.662 85.081 146.060 1.00 13.95 ? 140 CYS C O 1 +ATOM 4315 C CB . CYS C 3 140 ? -34.846 86.954 147.378 1.00 13.11 ? 140 CYS C CB 1 +ATOM 4316 S SG . CYS C 3 140 ? -35.340 88.497 148.141 1.00 16.37 ? 140 CYS C SG 1 +ATOM 4317 N N . TYR C 3 141 ? -34.063 84.041 147.456 1.00 13.05 ? 141 TYR C N 1 +ATOM 4318 C CA . TYR C 3 141 ? -34.150 82.821 146.647 1.00 13.16 ? 141 TYR C CA 1 +ATOM 4319 C C . TYR C 3 141 ? -33.007 81.817 146.822 1.00 13.90 ? 141 TYR C C 1 +ATOM 4320 O O . TYR C 3 141 ? -33.165 80.613 146.490 1.00 13.75 ? 141 TYR C O 1 +ATOM 4321 C CB . TYR C 3 141 ? -34.390 83.135 145.152 1.00 12.39 ? 141 TYR C CB 1 +ATOM 4322 C CG . TYR C 3 141 ? -35.619 84.013 144.971 1.00 12.91 ? 141 TYR C CG 1 +ATOM 4323 C CD1 . TYR C 3 141 ? -35.509 85.290 144.449 1.00 12.12 ? 141 TYR C CD1 1 +ATOM 4324 C CD2 . TYR C 3 141 ? -36.885 83.577 145.386 1.00 11.80 ? 141 TYR C CD2 1 +ATOM 4325 C CE1 . TYR C 3 141 ? -36.617 86.126 144.334 1.00 12.30 ? 141 TYR C CE1 1 +ATOM 4326 C CE2 . TYR C 3 141 ? -37.991 84.384 145.252 1.00 13.79 ? 141 TYR C CE2 1 +ATOM 4327 C CZ . TYR C 3 141 ? -37.854 85.676 144.722 1.00 13.96 ? 141 TYR C CZ 1 +ATOM 4328 O OH . TYR C 3 141 ? -38.960 86.515 144.584 1.00 14.53 ? 141 TYR C OH 1 +ATOM 4329 N N . GLN C 3 142 ? -31.884 82.272 147.373 1.00 13.76 ? 142 GLN C N 1 +ATOM 4330 C CA . GLN C 3 142 ? -30.693 81.454 147.279 1.00 14.43 ? 142 GLN C CA 1 +ATOM 4331 C C . GLN C 3 142 ? -30.894 80.135 148.005 1.00 15.16 ? 142 GLN C C 1 +ATOM 4332 O O . GLN C 3 142 ? -30.207 79.178 147.698 1.00 15.61 ? 142 GLN C O 1 +ATOM 4333 C CB . GLN C 3 142 ? -29.438 82.207 147.732 1.00 14.19 ? 142 GLN C CB 1 +ATOM 4334 C CG . GLN C 3 142 ? -29.435 82.658 149.218 1.00 14.08 ? 142 GLN C CG 1 +ATOM 4335 C CD . GLN C 3 142 ? -30.192 83.942 149.430 1.00 15.87 ? 142 GLN C CD 1 +ATOM 4336 O OE1 . GLN C 3 142 ? -31.253 84.145 148.826 1.00 17.12 ? 142 GLN C OE1 1 +ATOM 4337 N NE2 . GLN C 3 142 ? -29.665 84.820 150.279 1.00 15.75 ? 142 GLN C NE2 1 +ATOM 4338 N N . ASP C 3 143 ? -31.876 80.086 148.911 1.00 15.80 ? 143 ASP C N 1 +ATOM 4339 C CA . ASP C 3 143 ? -32.081 78.987 149.878 1.00 16.67 ? 143 ASP C CA 1 +ATOM 4340 C C . ASP C 3 143 ? -33.210 78.058 149.446 1.00 16.62 ? 143 ASP C C 1 +ATOM 4341 O O . ASP C 3 143 ? -33.700 77.183 150.175 1.00 15.90 ? 143 ASP C O 1 +ATOM 4342 C CB . ASP C 3 143 ? -32.488 79.598 151.208 1.00 17.56 ? 143 ASP C CB 1 +ATOM 4343 C CG . ASP C 3 143 ? -33.787 80.405 151.108 1.00 19.96 ? 143 ASP C CG 1 +ATOM 4344 O OD1 . ASP C 3 143 ? -33.847 81.374 150.298 1.00 19.13 ? 143 ASP C OD1 1 +ATOM 4345 O OD2 . ASP C 3 143 ? -34.801 80.133 151.821 1.00 24.51 ? 143 ASP C OD2 1 +ATOM 4346 N N . THR C 3 144 ? -33.599 78.296 148.215 1.00 16.84 ? 144 THR C N 1 +ATOM 4347 C CA . THR C 3 144 ? -34.731 77.717 147.560 1.00 16.02 ? 144 THR C CA 1 +ATOM 4348 C C . THR C 3 144 ? -34.187 76.671 146.572 1.00 15.50 ? 144 THR C C 1 +ATOM 4349 O O . THR C 3 144 ? -34.880 75.718 146.204 1.00 15.78 ? 144 THR C O 1 +ATOM 4350 C CB . THR C 3 144 ? -35.328 78.909 146.829 1.00 16.46 ? 144 THR C CB 1 +ATOM 4351 O OG1 . THR C 3 144 ? -36.585 79.254 147.408 1.00 16.79 ? 144 THR C OG1 1 +ATOM 4352 C CG2 . THR C 3 144 ? -35.585 78.641 145.366 1.00 15.88 ? 144 THR C CG2 1 +ATOM 4353 N N . ILE C 3 145 ? -32.940 76.849 146.162 1.00 13.69 ? 145 ILE C N 1 +ATOM 4354 C CA . ILE C 3 145 ? -32.342 75.990 145.166 1.00 14.19 ? 145 ILE C CA 1 +ATOM 4355 C C . ILE C 3 145 ? -31.980 74.625 145.756 1.00 13.95 ? 145 ILE C C 1 +ATOM 4356 O O . ILE C 3 145 ? -31.485 74.552 146.879 1.00 13.74 ? 145 ILE C O 1 +ATOM 4357 C CB . ILE C 3 145 ? -31.098 76.687 144.524 1.00 13.69 ? 145 ILE C CB 1 +ATOM 4358 C CG1 . ILE C 3 145 ? -31.533 77.840 143.649 1.00 13.37 ? 145 ILE C CG1 1 +ATOM 4359 C CG2 . ILE C 3 145 ? -30.224 75.691 143.753 1.00 14.31 ? 145 ILE C CG2 1 +ATOM 4360 C CD1 . ILE C 3 145 ? -32.554 77.440 142.557 1.00 16.15 ? 145 ILE C CD1 1 +ATOM 4361 N N . LEU C 3 146 ? -32.240 73.560 144.994 1.00 14.26 ? 146 LEU C N 1 +ATOM 4362 C CA . LEU C 3 146 ? -31.839 72.213 145.378 1.00 14.92 ? 146 LEU C CA 1 +ATOM 4363 C C . LEU C 3 146 ? -30.438 71.992 144.866 1.00 15.73 ? 146 LEU C C 1 +ATOM 4364 O O . LEU C 3 146 ? -30.257 71.405 143.796 1.00 15.83 ? 146 LEU C O 1 +ATOM 4365 C CB . LEU C 3 146 ? -32.758 71.177 144.753 1.00 14.67 ? 146 LEU C CB 1 +ATOM 4366 C CG . LEU C 3 146 ? -33.116 69.856 145.474 1.00 15.98 ? 146 LEU C CG 1 +ATOM 4367 C CD1 . LEU C 3 146 ? -32.592 68.720 144.674 1.00 17.21 ? 146 LEU C CD1 1 +ATOM 4368 C CD2 . LEU C 3 146 ? -32.656 69.696 146.934 1.00 17.08 ? 146 LEU C CD2 1 +ATOM 4369 N N . TRP C 3 147 ? -29.446 72.476 145.616 1.00 16.03 ? 147 TRP C N 1 +ATOM 4370 C CA . TRP C 3 147 ? -28.042 72.348 145.221 1.00 16.22 ? 147 TRP C CA 1 +ATOM 4371 C C . TRP C 3 147 ? -27.666 70.918 144.924 1.00 15.69 ? 147 TRP C C 1 +ATOM 4372 O O . TRP C 3 147 ? -26.954 70.670 143.961 1.00 16.18 ? 147 TRP C O 1 +ATOM 4373 C CB . TRP C 3 147 ? -27.123 72.961 146.278 1.00 16.61 ? 147 TRP C CB 1 +ATOM 4374 C CG . TRP C 3 147 ? -27.469 74.379 146.482 1.00 16.89 ? 147 TRP C CG 1 +ATOM 4375 C CD1 . TRP C 3 147 ? -28.210 74.898 147.498 1.00 15.16 ? 147 TRP C CD1 1 +ATOM 4376 C CD2 . TRP C 3 147 ? -27.165 75.472 145.591 1.00 16.04 ? 147 TRP C CD2 1 +ATOM 4377 N NE1 . TRP C 3 147 ? -28.381 76.248 147.301 1.00 17.44 ? 147 TRP C NE1 1 +ATOM 4378 C CE2 . TRP C 3 147 ? -27.739 76.633 146.149 1.00 14.50 ? 147 TRP C CE2 1 +ATOM 4379 C CE3 . TRP C 3 147 ? -26.445 75.586 144.388 1.00 17.08 ? 147 TRP C CE3 1 +ATOM 4380 C CZ2 . TRP C 3 147 ? -27.604 77.899 145.569 1.00 12.81 ? 147 TRP C CZ2 1 +ATOM 4381 C CZ3 . TRP C 3 147 ? -26.330 76.860 143.784 1.00 15.46 ? 147 TRP C CZ3 1 +ATOM 4382 C CH2 . TRP C 3 147 ? -26.905 77.995 144.386 1.00 13.45 ? 147 TRP C CH2 1 +ATOM 4383 N N . LYS C 3 148 ? -28.185 70.004 145.747 1.00 15.32 ? 148 LYS C N 1 +ATOM 4384 C CA . LYS C 3 148 ? -28.169 68.559 145.520 1.00 14.79 ? 148 LYS C CA 1 +ATOM 4385 C C . LYS C 3 148 ? -28.269 68.211 144.049 1.00 13.58 ? 148 LYS C C 1 +ATOM 4386 O O . LYS C 3 148 ? -27.503 67.418 143.560 1.00 13.26 ? 148 LYS C O 1 +ATOM 4387 C CB . LYS C 3 148 ? -29.344 67.897 146.264 1.00 15.70 ? 148 LYS C CB 1 +ATOM 4388 C CG . LYS C 3 148 ? -28.948 66.708 147.130 1.00 16.96 ? 148 LYS C CG 1 +ATOM 4389 C CD . LYS C 3 148 ? -30.127 66.078 147.854 1.00 20.40 ? 148 LYS C CD 1 +ATOM 4390 C CE . LYS C 3 148 ? -30.624 64.795 147.136 1.00 24.86 ? 148 LYS C CE 1 +ATOM 4391 N NZ . LYS C 3 148 ? -30.263 63.481 147.796 1.00 23.00 ? 148 LYS C NZ 1 +ATOM 4392 N N . ASP C 3 149 ? -29.207 68.819 143.336 1.00 12.83 ? 149 ASP C N 1 +ATOM 4393 C CA . ASP C 3 149 ? -29.341 68.608 141.882 1.00 11.74 ? 149 ASP C CA 1 +ATOM 4394 C C . ASP C 3 149 ? -28.180 69.140 141.027 1.00 11.05 ? 149 ASP C C 1 +ATOM 4395 O O . ASP C 3 149 ? -27.784 68.511 140.037 1.00 11.75 ? 149 ASP C O 1 +ATOM 4396 C CB . ASP C 3 149 ? -30.644 69.235 141.404 1.00 11.95 ? 149 ASP C CB 1 +ATOM 4397 C CG . ASP C 3 149 ? -31.154 68.635 140.130 1.00 11.82 ? 149 ASP C CG 1 +ATOM 4398 O OD1 . ASP C 3 149 ? -30.968 69.271 139.073 1.00 12.80 ? 149 ASP C OD1 1 +ATOM 4399 O OD2 . ASP C 3 149 ? -31.783 67.559 140.085 1.00 13.76 ? 149 ASP C OD2 1 +ATOM 4400 N N . ILE C 3 150 ? -27.636 70.291 141.379 1.00 9.77 ? 150 ILE C N 1 +ATOM 4401 C CA . ILE C 3 150 ? -26.711 70.962 140.485 1.00 9.48 ? 150 ILE C CA 1 +ATOM 4402 C C . ILE C 3 150 ? -25.330 70.293 140.603 1.00 10.65 ? 150 ILE C C 1 +ATOM 4403 O O . ILE C 3 150 ? -24.666 69.984 139.599 1.00 9.07 ? 150 ILE C O 1 +ATOM 4404 C CB . ILE C 3 150 ? -26.683 72.489 140.827 1.00 10.31 ? 150 ILE C CB 1 +ATOM 4405 C CG1 . ILE C 3 150 ? -28.054 73.151 140.494 1.00 7.32 ? 150 ILE C CG1 1 +ATOM 4406 C CG2 . ILE C 3 150 ? -25.449 73.208 140.173 1.00 7.84 ? 150 ILE C CG2 1 +ATOM 4407 C CD1 . ILE C 3 150 ? -28.121 74.618 140.816 1.00 8.39 ? 150 ILE C CD1 1 +ATOM 4408 N N . PHE C 3 151 ? -24.930 70.029 141.847 1.00 11.14 ? 151 PHE C N 1 +ATOM 4409 C CA . PHE C 3 151 ? -23.727 69.275 142.116 1.00 12.36 ? 151 PHE C CA 1 +ATOM 4410 C C . PHE C 3 151 ? -23.735 67.937 141.366 1.00 12.90 ? 151 PHE C C 1 +ATOM 4411 O O . PHE C 3 151 ? -24.751 67.212 141.357 1.00 12.78 ? 151 PHE C O 1 +ATOM 4412 C CB . PHE C 3 151 ? -23.618 68.974 143.625 1.00 12.88 ? 151 PHE C CB 1 +ATOM 4413 C CG . PHE C 3 151 ? -23.431 70.187 144.503 1.00 12.71 ? 151 PHE C CG 1 +ATOM 4414 C CD1 . PHE C 3 151 ? -23.859 70.156 145.813 1.00 13.88 ? 151 PHE C CD1 1 +ATOM 4415 C CD2 . PHE C 3 151 ? -22.821 71.323 144.034 1.00 13.33 ? 151 PHE C CD2 1 +ATOM 4416 C CE1 . PHE C 3 151 ? -23.702 71.238 146.632 1.00 14.91 ? 151 PHE C CE1 1 +ATOM 4417 C CE2 . PHE C 3 151 ? -22.650 72.404 144.841 1.00 14.56 ? 151 PHE C CE2 1 +ATOM 4418 C CZ . PHE C 3 151 ? -23.087 72.365 146.144 1.00 15.90 ? 151 PHE C CZ 1 +ATOM 4419 N N . HIS C 3 152 ? -22.588 67.587 140.801 1.00 13.06 ? 152 HIS C N 1 +ATOM 4420 C CA . HIS C 3 152 ? -22.398 66.315 140.111 1.00 14.08 ? 152 HIS C CA 1 +ATOM 4421 C C . HIS C 3 152 ? -22.584 65.094 141.028 1.00 15.76 ? 152 HIS C C 1 +ATOM 4422 O O . HIS C 3 152 ? -22.442 65.209 142.239 1.00 16.06 ? 152 HIS C O 1 +ATOM 4423 C CB . HIS C 3 152 ? -21.013 66.301 139.498 1.00 13.22 ? 152 HIS C CB 1 +ATOM 4424 C CG . HIS C 3 152 ? -20.745 65.128 138.615 1.00 11.81 ? 152 HIS C CG 1 +ATOM 4425 N ND1 . HIS C 3 152 ? -19.986 64.056 139.018 1.00 10.97 ? 152 HIS C ND1 1 +ATOM 4426 C CD2 . HIS C 3 152 ? -21.096 64.878 137.336 1.00 12.29 ? 152 HIS C CD2 1 +ATOM 4427 C CE1 . HIS C 3 152 ? -19.889 63.186 138.031 1.00 11.29 ? 152 HIS C CE1 1 +ATOM 4428 N NE2 . HIS C 3 152 ? -20.556 63.662 136.998 1.00 12.40 ? 152 HIS C NE2 1 +ATOM 4429 N N . LYS C 3 153 ? -22.882 63.930 140.448 1.00 17.39 ? 153 LYS C N 1 +ATOM 4430 C CA . LYS C 3 153 ? -23.003 62.682 141.221 1.00 19.46 ? 153 LYS C CA 1 +ATOM 4431 C C . LYS C 3 153 ? -21.822 62.431 142.180 1.00 20.53 ? 153 LYS C C 1 +ATOM 4432 O O . LYS C 3 153 ? -21.997 61.860 143.259 1.00 20.99 ? 153 LYS C O 1 +ATOM 4433 C CB . LYS C 3 153 ? -23.191 61.472 140.276 1.00 19.89 ? 153 LYS C CB 1 +ATOM 4434 C CG . LYS C 3 153 ? -23.325 60.061 140.937 1.00 19.66 ? 153 LYS C CG 1 +ATOM 4435 C CD . LYS C 3 153 ? -23.650 58.990 139.871 1.00 19.55 ? 153 LYS C CD 1 +ATOM 4436 C CE . LYS C 3 153 ? -23.680 57.586 140.440 1.00 20.58 ? 153 LYS C CE 1 +ATOM 4437 N NZ . LYS C 3 153 ? -22.932 56.626 139.576 1.00 18.34 ? 153 LYS C NZ 1 +ATOM 4438 N N . ASN C 3 154 ? -20.628 62.855 141.795 1.00 21.65 ? 154 ASN C N 1 +ATOM 4439 C CA . ASN C 3 154 ? -19.457 62.539 142.584 1.00 22.97 ? 154 ASN C CA 1 +ATOM 4440 C C . ASN C 3 154 ? -19.013 63.767 143.353 1.00 24.37 ? 154 ASN C C 1 +ATOM 4441 O O . ASN C 3 154 ? -17.849 63.904 143.710 1.00 24.80 ? 154 ASN C O 1 +ATOM 4442 C CB . ASN C 3 154 ? -18.365 61.902 141.704 1.00 22.59 ? 154 ASN C CB 1 +ATOM 4443 C CG . ASN C 3 154 ? -18.824 60.553 141.075 1.00 22.36 ? 154 ASN C CG 1 +ATOM 4444 O OD1 . ASN C 3 154 ? -19.335 59.651 141.774 1.00 22.47 ? 154 ASN C OD1 1 +ATOM 4445 N ND2 . ASN C 3 154 ? -18.652 60.423 139.758 1.00 20.11 ? 154 ASN C ND2 1 +ATOM 4446 N N . ASN C 3 155 ? -20.000 64.618 143.662 1.00 25.97 ? 155 ASN C N 1 +ATOM 4447 C CA . ASN C 3 155 ? -19.819 65.934 144.306 1.00 27.16 ? 155 ASN C CA 1 +ATOM 4448 C C . ASN C 3 155 ? -20.924 66.240 145.412 1.00 28.43 ? 155 ASN C C 1 +ATOM 4449 O O . ASN C 3 155 ? -21.047 67.399 145.903 1.00 28.13 ? 155 ASN C O 1 +ATOM 4450 C CB . ASN C 3 155 ? -19.766 67.007 143.169 1.00 26.54 ? 155 ASN C CB 1 +ATOM 4451 C CG . ASN C 3 155 ? -19.329 68.408 143.641 1.00 26.08 ? 155 ASN C CG 1 +ATOM 4452 O OD1 . ASN C 3 155 ? -18.261 68.578 144.219 1.00 27.16 ? 155 ASN C OD1 1 +ATOM 4453 N ND2 . ASN C 3 155 ? -20.141 69.417 143.338 1.00 22.55 ? 155 ASN C ND2 1 +ATOM 4454 N N . GLN C 3 156 ? -21.718 65.220 145.808 1.00 29.15 ? 156 GLN C N 1 +ATOM 4455 C CA . GLN C 3 156 ? -22.769 65.410 146.852 1.00 29.96 ? 156 GLN C CA 1 +ATOM 4456 C C . GLN C 3 156 ? -22.187 65.817 148.184 1.00 30.27 ? 156 GLN C C 1 +ATOM 4457 O O . GLN C 3 156 ? -22.789 66.623 148.907 1.00 30.17 ? 156 GLN C O 1 +ATOM 4458 C CB . GLN C 3 156 ? -23.698 64.187 147.043 1.00 29.96 ? 156 GLN C CB 1 +ATOM 4459 C CG . GLN C 3 156 ? -24.903 64.263 146.127 1.00 31.20 ? 156 GLN C CG 1 +ATOM 4460 C CD . GLN C 3 156 ? -24.424 64.642 144.740 1.00 34.12 ? 156 GLN C CD 1 +ATOM 4461 O OE1 . GLN C 3 156 ? -23.472 64.021 144.253 1.00 37.57 ? 156 GLN C OE1 1 +ATOM 4462 N NE2 . GLN C 3 156 ? -25.001 65.689 144.133 1.00 31.36 ? 156 GLN C NE2 1 +ATOM 4463 N N . LEU C 3 157 ? -21.008 65.269 148.484 1.00 30.79 ? 157 LEU C N 1 +ATOM 4464 C CA . LEU C 3 157 ? -20.293 65.584 149.714 1.00 31.48 ? 157 LEU C CA 1 +ATOM 4465 C C . LEU C 3 157 ? -19.900 67.063 149.711 1.00 31.14 ? 157 LEU C C 1 +ATOM 4466 O O . LEU C 3 157 ? -19.258 67.549 150.647 1.00 31.26 ? 157 LEU C O 1 +ATOM 4467 C CB . LEU C 3 157 ? -19.055 64.673 149.883 1.00 31.95 ? 157 LEU C CB 1 +ATOM 4468 C CG . LEU C 3 157 ? -19.244 63.151 150.061 1.00 32.92 ? 157 LEU C CG 1 +ATOM 4469 C CD1 . LEU C 3 157 ? -17.927 62.384 149.830 1.00 31.60 ? 157 LEU C CD1 1 +ATOM 4470 C CD2 . LEU C 3 157 ? -19.862 62.799 151.434 1.00 34.07 ? 157 LEU C CD2 1 +ATOM 4471 N N . ALA C 3 158 ? -20.303 67.771 148.658 1.00 31.04 ? 158 ALA C N 1 +ATOM 4472 C CA . ALA C 3 158 ? -19.925 69.175 148.485 1.00 31.38 ? 158 ALA C CA 1 +ATOM 4473 C C . ALA C 3 158 ? -20.491 70.063 149.589 1.00 31.24 ? 158 ALA C C 1 +ATOM 4474 O O . ALA C 3 158 ? -21.691 69.975 149.924 1.00 31.26 ? 158 ALA C O 1 +ATOM 4475 C CB . ALA C 3 158 ? -20.351 69.683 147.133 1.00 31.51 ? 158 ALA C CB 1 +ATOM 4476 N N . LEU C 3 159 ? -19.597 70.885 150.155 1.00 30.53 ? 159 LEU C N 1 +ATOM 4477 C CA . LEU C 3 159 ? -19.931 71.896 151.165 1.00 29.33 ? 159 LEU C CA 1 +ATOM 4478 C C . LEU C 3 159 ? -20.880 72.971 150.650 1.00 28.26 ? 159 LEU C C 1 +ATOM 4479 O O . LEU C 3 159 ? -20.739 73.467 149.527 1.00 28.15 ? 159 LEU C O 1 +ATOM 4480 C CB . LEU C 3 159 ? -18.670 72.593 151.613 1.00 29.17 ? 159 LEU C CB 1 +ATOM 4481 C CG . LEU C 3 159 ? -18.183 72.107 152.943 1.00 30.21 ? 159 LEU C CG 1 +ATOM 4482 C CD1 . LEU C 3 159 ? -16.690 72.320 152.943 1.00 31.54 ? 159 LEU C CD1 1 +ATOM 4483 C CD2 . LEU C 3 159 ? -18.888 72.903 154.042 1.00 31.61 ? 159 LEU C CD2 1 +ATOM 4484 N N . THR C 3 160 ? -21.839 73.339 151.489 1.00 26.45 ? 160 THR C N 1 +ATOM 4485 C CA . THR C 3 160 ? -22.810 74.337 151.115 1.00 24.59 ? 160 THR C CA 1 +ATOM 4486 C C . THR C 3 160 ? -23.120 75.205 152.307 1.00 23.24 ? 160 THR C C 1 +ATOM 4487 O O . THR C 3 160 ? -23.602 74.758 153.320 1.00 23.29 ? 160 THR C O 1 +ATOM 4488 C CB . THR C 3 160 ? -24.036 73.654 150.527 1.00 24.64 ? 160 THR C CB 1 +ATOM 4489 O OG1 . THR C 3 160 ? -23.695 73.173 149.226 1.00 25.34 ? 160 THR C OG1 1 +ATOM 4490 C CG2 . THR C 3 160 ? -25.120 74.647 150.214 1.00 25.15 ? 160 THR C CG2 1 +ATOM 4491 N N . LEU C 3 161 ? -22.826 76.473 152.178 1.00 21.89 ? 161 LEU C N 1 +ATOM 4492 C CA . LEU C 3 161 ? -22.894 77.335 153.317 1.00 20.68 ? 161 LEU C CA 1 +ATOM 4493 C C . LEU C 3 161 ? -23.578 78.624 152.879 1.00 20.33 ? 161 LEU C C 1 +ATOM 4494 O O . LEU C 3 161 ? -22.947 79.579 152.381 1.00 19.64 ? 161 LEU C O 1 +ATOM 4495 C CB . LEU C 3 161 ? -21.488 77.581 153.803 1.00 20.46 ? 161 LEU C CB 1 +ATOM 4496 C CG . LEU C 3 161 ? -21.259 78.100 155.197 1.00 20.99 ? 161 LEU C CG 1 +ATOM 4497 C CD1 . LEU C 3 161 ? -22.509 77.921 156.098 1.00 21.83 ? 161 LEU C CD1 1 +ATOM 4498 C CD2 . LEU C 3 161 ? -20.041 77.351 155.710 1.00 20.78 ? 161 LEU C CD2 1 +ATOM 4499 N N . ILE C 3 162 ? -24.891 78.630 153.079 1.00 19.54 ? 162 ILE C N 1 +ATOM 4500 C CA . ILE C 3 162 ? -25.739 79.669 152.558 1.00 18.67 ? 162 ILE C CA 1 +ATOM 4501 C C . ILE C 3 162 ? -26.492 80.412 153.647 1.00 18.82 ? 162 ILE C C 1 +ATOM 4502 O O . ILE C 3 162 ? -27.195 79.826 154.480 1.00 18.99 ? 162 ILE C O 1 +ATOM 4503 C CB . ILE C 3 162 ? -26.646 79.055 151.560 1.00 18.49 ? 162 ILE C CB 1 +ATOM 4504 C CG1 . ILE C 3 162 ? -25.767 78.429 150.473 1.00 19.27 ? 162 ILE C CG1 1 +ATOM 4505 C CG2 . ILE C 3 162 ? -27.611 80.082 151.042 1.00 18.13 ? 162 ILE C CG2 1 +ATOM 4506 C CD1 . ILE C 3 162 ? -26.487 77.943 149.257 1.00 21.30 ? 162 ILE C CD1 1 +ATOM 4507 N N . ASP C 3 163 ? -26.312 81.727 153.611 1.00 18.63 ? 163 ASP C N 1 +ATOM 4508 C CA . ASP C 3 163 ? -26.756 82.668 154.615 1.00 17.49 ? 163 ASP C CA 1 +ATOM 4509 C C . ASP C 3 163 ? -27.949 83.330 153.972 1.00 17.69 ? 163 ASP C C 1 +ATOM 4510 O O . ASP C 3 163 ? -27.946 83.622 152.776 1.00 17.82 ? 163 ASP C O 1 +ATOM 4511 C CB . ASP C 3 163 ? -25.601 83.647 154.865 1.00 17.50 ? 163 ASP C CB 1 +ATOM 4512 C CG . ASP C 3 163 ? -26.018 84.936 155.538 1.00 17.38 ? 163 ASP C CG 1 +ATOM 4513 O OD1 . ASP C 3 163 ? -25.919 86.000 154.901 1.00 18.34 ? 163 ASP C OD1 1 +ATOM 4514 O OD2 . ASP C 3 163 ? -26.392 84.998 156.719 1.00 18.10 ? 163 ASP C OD2 1 +ATOM 4515 N N . THR C 3 164 ? -28.996 83.510 154.755 1.00 18.10 ? 164 THR C N 1 +ATOM 4516 C CA . THR C 3 164 ? -30.216 84.147 154.289 1.00 18.08 ? 164 THR C CA 1 +ATOM 4517 C C . THR C 3 164 ? -30.599 85.380 155.102 1.00 18.53 ? 164 THR C C 1 +ATOM 4518 O O . THR C 3 164 ? -31.708 85.903 154.935 1.00 18.47 ? 164 THR C O 1 +ATOM 4519 C CB . THR C 3 164 ? -31.394 83.162 154.316 1.00 18.36 ? 164 THR C CB 1 +ATOM 4520 O OG1 . THR C 3 164 ? -31.434 82.449 155.576 1.00 17.15 ? 164 THR C OG1 1 +ATOM 4521 C CG2 . THR C 3 164 ? -31.227 82.121 153.202 1.00 17.59 ? 164 THR C CG2 1 +ATOM 4522 N N . ASN C 3 165 ? -29.715 85.848 155.980 1.00 18.61 ? 165 ASN C N 1 +ATOM 4523 C CA . ASN C 3 165 ? -29.901 87.194 156.462 1.00 19.07 ? 165 ASN C CA 1 +ATOM 4524 C C . ASN C 3 165 ? -30.010 88.237 155.354 1.00 17.99 ? 165 ASN C C 1 +ATOM 4525 O O . ASN C 3 165 ? -29.209 88.259 154.428 1.00 19.06 ? 165 ASN C O 1 +ATOM 4526 C CB . ASN C 3 165 ? -28.887 87.613 157.493 1.00 19.99 ? 165 ASN C CB 1 +ATOM 4527 C CG . ASN C 3 165 ? -29.520 88.493 158.507 1.00 25.44 ? 165 ASN C CG 1 +ATOM 4528 O OD1 . ASN C 3 165 ? -30.054 88.005 159.481 1.00 27.86 ? 165 ASN C OD1 1 +ATOM 4529 N ND2 . ASN C 3 165 ? -29.671 89.761 158.176 1.00 35.34 ? 165 ASN C ND2 1 +ATOM 4530 N N . ARG C 3 166 ? -31.029 89.083 155.454 1.00 16.79 ? 166 ARG C N 1 +ATOM 4531 C CA . ARG C 3 166 ? -31.339 90.052 154.423 1.00 15.91 ? 166 ARG C CA 1 +ATOM 4532 C C . ARG C 3 166 ? -31.497 91.487 154.909 1.00 14.93 ? 166 ARG C C 1 +ATOM 4533 O O . ARG C 3 166 ? -30.599 92.018 155.539 1.00 15.77 ? 166 ARG C O 1 +ATOM 4534 C CB . ARG C 3 166 ? -32.574 89.624 153.673 1.00 16.01 ? 166 ARG C CB 1 +ATOM 4535 C CG . ARG C 3 166 ? -32.293 88.490 152.775 1.00 17.92 ? 166 ARG C CG 1 +ATOM 4536 C CD . ARG C 3 166 ? -33.532 87.767 152.386 1.00 19.17 ? 166 ARG C CD 1 +ATOM 4537 N NE . ARG C 3 166 ? -33.201 86.658 151.524 1.00 18.19 ? 166 ARG C NE 1 +ATOM 4538 C CZ . ARG C 3 166 ? -33.633 85.422 151.719 1.00 20.29 ? 166 ARG C CZ 1 +ATOM 4539 N NH1 . ARG C 3 166 ? -34.443 85.157 152.758 1.00 14.84 ? 166 ARG C NH1 1 +ATOM 4540 N NH2 . ARG C 3 166 ? -33.275 84.453 150.850 1.00 20.35 ? 166 ARG C NH2 1 +ATOM 4541 N N . SER C 3 167 ? -32.614 92.119 154.584 1.00 13.18 ? 167 SER C N 1 +ATOM 4542 C CA . SER C 3 167 ? -32.713 93.572 154.587 1.00 12.52 ? 167 SER C CA 1 +ATOM 4543 C C . SER C 3 167 ? -33.828 93.961 153.645 1.00 12.17 ? 167 SER C C 1 +ATOM 4544 O O . SER C 3 167 ? -34.174 95.141 153.531 1.00 12.98 ? 167 SER C O 1 +ATOM 4545 C CB . SER C 3 167 ? -31.404 94.261 154.141 1.00 12.40 ? 167 SER C CB 1 +ATOM 4546 O OG . SER C 3 167 ? -30.661 94.782 155.239 1.00 11.50 ? 167 SER C OG 1 +ATOM 4547 N N . ARG C 3 168 ? -34.344 92.972 152.935 1.00 11.31 ? 168 ARG C N 1 +ATOM 4548 C CA . ARG C 3 168 ? -35.648 93.076 152.310 1.00 11.81 ? 168 ARG C CA 1 +ATOM 4549 C C . ARG C 3 168 ? -36.395 91.782 152.539 1.00 12.33 ? 168 ARG C C 1 +ATOM 4550 O O . ARG C 3 168 ? -35.794 90.716 152.597 1.00 13.17 ? 168 ARG C O 1 +ATOM 4551 C CB . ARG C 3 168 ? -35.566 93.406 150.821 1.00 11.41 ? 168 ARG C CB 1 +ATOM 4552 C CG . ARG C 3 168 ? -34.964 92.345 149.913 1.00 10.75 ? 168 ARG C CG 1 +ATOM 4553 C CD . ARG C 3 168 ? -35.158 92.713 148.460 1.00 10.60 ? 168 ARG C CD 1 +ATOM 4554 N NE . ARG C 3 168 ? -34.536 91.771 147.534 1.00 8.62 ? 168 ARG C NE 1 +ATOM 4555 C CZ . ARG C 3 168 ? -35.167 91.222 146.499 1.00 7.25 ? 168 ARG C CZ 1 +ATOM 4556 N NH1 . ARG C 3 168 ? -36.429 91.512 146.265 1.00 4.37 ? 168 ARG C NH1 1 +ATOM 4557 N NH2 . ARG C 3 168 ? -34.536 90.372 145.705 1.00 7.68 ? 168 ARG C NH2 1 +ATOM 4558 N N . ALA C 3 169 ? -37.701 91.888 152.688 1.00 12.99 ? 169 ALA C N 1 +ATOM 4559 C CA . ALA C 3 169 ? -38.545 90.731 152.889 1.00 13.57 ? 169 ALA C CA 1 +ATOM 4560 C C . ALA C 3 169 ? -38.764 90.098 151.534 1.00 14.30 ? 169 ALA C C 1 +ATOM 4561 O O . ALA C 3 169 ? -39.141 90.778 150.580 1.00 14.64 ? 169 ALA C O 1 +ATOM 4562 C CB . ALA C 3 169 ? -39.851 91.154 153.483 1.00 13.27 ? 169 ALA C CB 1 +ATOM 4563 N N . CYS C 3 170 ? -38.506 88.801 151.433 1.00 14.76 ? 170 CYS C N 1 +ATOM 4564 C CA . CYS C 3 170 ? -38.667 88.121 150.163 1.00 15.25 ? 170 CYS C CA 1 +ATOM 4565 C C . CYS C 3 170 ? -40.032 87.443 150.042 1.00 14.81 ? 170 CYS C C 1 +ATOM 4566 O O . CYS C 3 170 ? -40.559 86.882 151.009 1.00 14.35 ? 170 CYS C O 1 +ATOM 4567 C CB . CYS C 3 170 ? -37.534 87.117 149.959 1.00 15.85 ? 170 CYS C CB 1 +ATOM 4568 S SG . CYS C 3 170 ? -35.882 87.894 149.992 1.00 21.07 ? 170 CYS C SG 1 +ATOM 4569 N N . HIS C 3 171 ? -40.607 87.523 148.843 1.00 14.77 ? 171 HIS C N 1 +ATOM 4570 C CA . HIS C 3 171 ? -41.816 86.776 148.503 1.00 14.67 ? 171 HIS C CA 1 +ATOM 4571 C C . HIS C 3 171 ? -41.414 85.374 148.080 1.00 13.90 ? 171 HIS C C 1 +ATOM 4572 O O . HIS C 3 171 ? -40.272 85.157 147.689 1.00 13.51 ? 171 HIS C O 1 +ATOM 4573 C CB . HIS C 3 171 ? -42.581 87.478 147.386 1.00 15.12 ? 171 HIS C CB 1 +ATOM 4574 C CG . HIS C 3 171 ? -43.029 88.860 147.743 1.00 17.86 ? 171 HIS C CG 1 +ATOM 4575 N ND1 . HIS C 3 171 ? -44.245 89.118 148.343 1.00 18.61 ? 171 HIS C ND1 1 +ATOM 4576 C CD2 . HIS C 3 171 ? -42.415 90.060 147.597 1.00 20.27 ? 171 HIS C CD2 1 +ATOM 4577 C CE1 . HIS C 3 171 ? -44.365 90.419 148.540 1.00 20.52 ? 171 HIS C CE1 1 +ATOM 4578 N NE2 . HIS C 3 171 ? -43.267 91.014 148.103 1.00 20.99 ? 171 HIS C NE2 1 +ATOM 4579 N N . PRO C 3 172 ? -42.337 84.423 148.148 1.00 13.69 ? 172 PRO C N 1 +ATOM 4580 C CA . PRO C 3 172 ? -42.030 83.040 147.765 1.00 13.64 ? 172 PRO C CA 1 +ATOM 4581 C C . PRO C 3 172 ? -41.766 82.972 146.266 1.00 13.84 ? 172 PRO C C 1 +ATOM 4582 O O . PRO C 3 172 ? -42.099 83.940 145.568 1.00 14.43 ? 172 PRO C O 1 +ATOM 4583 C CB . PRO C 3 172 ? -43.314 82.286 148.091 1.00 13.68 ? 172 PRO C CB 1 +ATOM 4584 C CG . PRO C 3 172 ? -44.071 83.217 149.006 1.00 14.46 ? 172 PRO C CG 1 +ATOM 4585 C CD . PRO C 3 172 ? -43.742 84.599 148.558 1.00 13.58 ? 172 PRO C CD 1 +ATOM 4586 N N . CYS C 3 173 ? -41.167 81.882 145.788 1.00 12.98 ? 173 CYS C N 1 +ATOM 4587 C CA . CYS C 3 173 ? -41.066 81.610 144.360 1.00 12.73 ? 173 CYS C CA 1 +ATOM 4588 C C . CYS C 3 173 ? -42.410 81.621 143.665 1.00 11.73 ? 173 CYS C C 1 +ATOM 4589 O O . CYS C 3 173 ? -43.440 81.346 144.291 1.00 11.90 ? 173 CYS C O 1 +ATOM 4590 C CB . CYS C 3 173 ? -40.485 80.223 144.163 1.00 13.18 ? 173 CYS C CB 1 +ATOM 4591 S SG . CYS C 3 173 ? -38.705 80.127 144.448 1.00 17.81 ? 173 CYS C SG 1 +ATOM 4592 N N . SER C 3 174 ? -42.397 81.935 142.369 1.00 10.56 ? 174 SER C N 1 +ATOM 4593 C CA . SER C 3 174 ? -43.590 81.813 141.501 1.00 9.14 ? 174 SER C CA 1 +ATOM 4594 C C . SER C 3 174 ? -44.285 80.487 141.726 1.00 8.84 ? 174 SER C C 1 +ATOM 4595 O O . SER C 3 174 ? -43.615 79.452 141.767 1.00 9.25 ? 174 SER C O 1 +ATOM 4596 C CB . SER C 3 174 ? -43.179 81.891 140.021 1.00 8.59 ? 174 SER C CB 1 +ATOM 4597 O OG . SER C 3 174 ? -44.305 81.838 139.170 1.00 5.86 ? 174 SER C OG 1 +ATOM 4598 N N . PRO C 3 175 ? -45.606 80.502 141.858 1.00 8.67 ? 175 PRO C N 1 +ATOM 4599 C CA . PRO C 3 175 ? -46.398 79.271 142.033 1.00 8.88 ? 175 PRO C CA 1 +ATOM 4600 C C . PRO C 3 175 ? -46.140 78.275 140.919 1.00 9.41 ? 175 PRO C C 1 +ATOM 4601 O O . PRO C 3 175 ? -46.442 77.100 141.008 1.00 10.31 ? 175 PRO C O 1 +ATOM 4602 C CB . PRO C 3 175 ? -47.832 79.768 141.898 1.00 8.43 ? 175 PRO C CB 1 +ATOM 4603 C CG . PRO C 3 175 ? -47.773 81.195 142.297 1.00 8.24 ? 175 PRO C CG 1 +ATOM 4604 C CD . PRO C 3 175 ? -46.455 81.706 141.833 1.00 8.59 ? 175 PRO C CD 1 +ATOM 4605 N N . MET C 3 176 ? -45.578 78.798 139.853 1.00 9.96 ? 176 MET C N 1 +ATOM 4606 C CA . MET C 3 176 ? -45.335 78.127 138.607 1.00 10.49 ? 176 MET C CA 1 +ATOM 4607 C C . MET C 3 176 ? -44.103 77.196 138.685 1.00 11.37 ? 176 MET C C 1 +ATOM 4608 O O . MET C 3 176 ? -43.938 76.295 137.861 1.00 11.07 ? 176 MET C O 1 +ATOM 4609 C CB . MET C 3 176 ? -45.101 79.264 137.622 1.00 10.44 ? 176 MET C CB 1 +ATOM 4610 C CG . MET C 3 176 ? -44.933 78.903 136.210 1.00 11.10 ? 176 MET C CG 1 +ATOM 4611 S SD . MET C 3 176 ? -46.494 79.048 135.475 1.00 9.88 ? 176 MET C SD 1 +ATOM 4612 C CE . MET C 3 176 ? -46.020 78.649 133.693 1.00 9.82 ? 176 MET C CE 1 +ATOM 4613 N N . CYS C 3 177 ? -43.241 77.440 139.679 1.00 12.63 ? 177 CYS C N 1 +ATOM 4614 C CA . CYS C 3 177 ? -42.040 76.661 139.955 1.00 13.28 ? 177 CYS C CA 1 +ATOM 4615 C C . CYS C 3 177 ? -42.351 75.365 140.683 1.00 13.81 ? 177 CYS C C 1 +ATOM 4616 O O . CYS C 3 177 ? -42.923 75.411 141.757 1.00 13.34 ? 177 CYS C O 1 +ATOM 4617 C CB . CYS C 3 177 ? -41.093 77.516 140.788 1.00 13.28 ? 177 CYS C CB 1 +ATOM 4618 S SG . CYS C 3 177 ? -40.466 78.948 139.870 1.00 16.66 ? 177 CYS C SG 1 +ATOM 4619 N N . LYS C 3 178 ? -41.948 74.226 140.104 1.00 15.19 ? 178 LYS C N 1 +ATOM 4620 C CA . LYS C 3 178 ? -42.386 72.885 140.545 1.00 16.91 ? 178 LYS C CA 1 +ATOM 4621 C C . LYS C 3 178 ? -42.322 72.543 142.042 1.00 17.77 ? 178 LYS C C 1 +ATOM 4622 O O . LYS C 3 178 ? -43.285 71.962 142.600 1.00 19.58 ? 178 LYS C O 1 +ATOM 4623 C CB . LYS C 3 178 ? -41.710 71.775 139.721 1.00 17.45 ? 178 LYS C CB 1 +ATOM 4624 C CG . LYS C 3 178 ? -42.197 70.329 140.071 1.00 18.78 ? 178 LYS C CG 1 +ATOM 4625 C CD . LYS C 3 178 ? -43.373 69.850 139.221 1.00 18.95 ? 178 LYS C CD 1 +ATOM 4626 C CE . LYS C 3 178 ? -44.062 68.629 139.853 1.00 20.84 ? 178 LYS C CE 1 +ATOM 4627 N NZ . LYS C 3 178 ? -45.549 68.555 139.557 1.00 20.02 ? 178 LYS C NZ 1 +ATOM 4628 N N . GLY C 3 179 ? -41.212 72.858 142.694 1.00 18.20 ? 179 GLY C N 1 +ATOM 4629 C CA . GLY C 3 179 ? -41.173 72.769 144.146 1.00 18.63 ? 179 GLY C CA 1 +ATOM 4630 C C . GLY C 3 179 ? -40.975 74.181 144.639 1.00 19.43 ? 179 GLY C C 1 +ATOM 4631 O O . GLY C 3 179 ? -41.341 75.161 143.976 1.00 19.25 ? 179 GLY C O 1 +ATOM 4632 N N . SER C 3 180 ? -40.336 74.335 145.778 1.00 20.18 ? 180 SER C N 1 +ATOM 4633 C CA . SER C 3 180 ? -40.133 75.702 146.255 1.00 20.98 ? 180 SER C CA 1 +ATOM 4634 C C . SER C 3 180 ? -39.099 76.527 145.425 1.00 20.49 ? 180 SER C C 1 +ATOM 4635 O O . SER C 3 180 ? -38.766 77.644 145.806 1.00 21.51 ? 180 SER C O 1 +ATOM 4636 C CB . SER C 3 180 ? -39.782 75.683 147.762 1.00 21.75 ? 180 SER C CB 1 +ATOM 4637 O OG . SER C 3 180 ? -38.432 75.265 148.013 1.00 22.69 ? 180 SER C OG 1 +ATOM 4638 N N . ARG C 3 181 ? -38.675 76.028 144.262 1.00 19.45 ? 181 ARG C N 1 +ATOM 4639 C CA . ARG C 3 181 ? -37.318 76.253 143.753 1.00 18.03 ? 181 ARG C CA 1 +ATOM 4640 C C . ARG C 3 181 ? -37.131 77.236 142.574 1.00 17.74 ? 181 ARG C C 1 +ATOM 4641 O O . ARG C 3 181 ? -37.576 76.940 141.460 1.00 18.71 ? 181 ARG C O 1 +ATOM 4642 C CB . ARG C 3 181 ? -36.706 74.873 143.396 1.00 18.38 ? 181 ARG C CB 1 +ATOM 4643 C CG . ARG C 3 181 ? -36.231 74.012 144.577 1.00 17.64 ? 181 ARG C CG 1 +ATOM 4644 C CD . ARG C 3 181 ? -36.498 72.533 144.435 1.00 19.04 ? 181 ARG C CD 1 +ATOM 4645 N NE . ARG C 3 181 ? -36.354 71.790 145.706 1.00 24.23 ? 181 ARG C NE 1 +ATOM 4646 C CZ . ARG C 3 181 ? -36.957 70.602 145.977 1.00 25.92 ? 181 ARG C CZ 1 +ATOM 4647 N NH1 . ARG C 3 181 ? -37.750 70.012 145.057 1.00 26.79 ? 181 ARG C NH1 1 +ATOM 4648 N NH2 . ARG C 3 181 ? -36.765 69.997 147.155 1.00 21.99 ? 181 ARG C NH2 1 +ATOM 4649 N N . CYS C 3 182 ? -36.408 78.348 142.777 1.00 16.07 ? 182 CYS C N 1 +ATOM 4650 C CA . CYS C 3 182 ? -36.187 79.329 141.706 1.00 15.23 ? 182 CYS C CA 1 +ATOM 4651 C C . CYS C 3 182 ? -34.921 80.181 141.816 1.00 15.31 ? 182 CYS C C 1 +ATOM 4652 O O . CYS C 3 182 ? -34.305 80.255 142.866 1.00 15.78 ? 182 CYS C O 1 +ATOM 4653 C CB . CYS C 3 182 ? -37.355 80.277 141.636 1.00 15.41 ? 182 CYS C CB 1 +ATOM 4654 S SG . CYS C 3 182 ? -37.525 81.243 143.151 1.00 15.73 ? 182 CYS C SG 1 +ATOM 4655 N N . TRP C 3 183 ? -34.554 80.855 140.728 1.00 14.62 ? 183 TRP C N 1 +ATOM 4656 C CA . TRP C 3 183 ? -33.387 81.742 140.710 1.00 13.77 ? 183 TRP C CA 1 +ATOM 4657 C C . TRP C 3 183 ? -33.737 83.241 140.796 1.00 13.71 ? 183 TRP C C 1 +ATOM 4658 O O . TRP C 3 183 ? -32.881 84.120 140.635 1.00 14.85 ? 183 TRP C O 1 +ATOM 4659 C CB . TRP C 3 183 ? -32.611 81.498 139.424 1.00 13.26 ? 183 TRP C CB 1 +ATOM 4660 C CG . TRP C 3 183 ? -31.987 80.149 139.348 1.00 13.32 ? 183 TRP C CG 1 +ATOM 4661 C CD1 . TRP C 3 183 ? -32.427 79.086 138.636 1.00 11.98 ? 183 TRP C CD1 1 +ATOM 4662 C CD2 . TRP C 3 183 ? -30.811 79.722 140.022 1.00 15.11 ? 183 TRP C CD2 1 +ATOM 4663 N NE1 . TRP C 3 183 ? -31.599 78.010 138.834 1.00 13.36 ? 183 TRP C NE1 1 +ATOM 4664 C CE2 . TRP C 3 183 ? -30.593 78.386 139.680 1.00 15.81 ? 183 TRP C CE2 1 +ATOM 4665 C CE3 . TRP C 3 183 ? -29.929 80.335 140.926 1.00 20.61 ? 183 TRP C CE3 1 +ATOM 4666 C CZ2 . TRP C 3 183 ? -29.527 77.655 140.183 1.00 18.63 ? 183 TRP C CZ2 1 +ATOM 4667 C CZ3 . TRP C 3 183 ? -28.867 79.614 141.422 1.00 20.88 ? 183 TRP C CZ3 1 +ATOM 4668 C CH2 . TRP C 3 183 ? -28.678 78.289 141.047 1.00 21.32 ? 183 TRP C CH2 1 +ATOM 4669 N N . GLY C 3 184 ? -34.996 83.537 141.048 1.00 13.09 ? 184 GLY C N 1 +ATOM 4670 C CA . GLY C 3 184 ? -35.517 84.875 140.866 1.00 12.28 ? 184 GLY C CA 1 +ATOM 4671 C C . GLY C 3 184 ? -37.008 84.786 140.999 1.00 11.72 ? 184 GLY C C 1 +ATOM 4672 O O . GLY C 3 184 ? -37.510 83.734 141.328 1.00 12.05 ? 184 GLY C O 1 +ATOM 4673 N N . GLU C 3 185 ? -37.711 85.881 140.779 1.00 12.05 ? 185 GLU C N 1 +ATOM 4674 C CA . GLU C 3 185 ? -39.147 85.942 141.062 1.00 12.20 ? 185 GLU C CA 1 +ATOM 4675 C C . GLU C 3 185 ? -40.002 85.398 139.928 1.00 11.76 ? 185 GLU C C 1 +ATOM 4676 O O . GLU C 3 185 ? -41.086 84.863 140.167 1.00 12.25 ? 185 GLU C O 1 +ATOM 4677 C CB . GLU C 3 185 ? -39.572 87.383 141.407 1.00 12.48 ? 185 GLU C CB 1 +ATOM 4678 C CG . GLU C 3 185 ? -39.646 88.353 140.239 1.00 14.82 ? 185 GLU C CG 1 +ATOM 4679 C CD . GLU C 3 185 ? -40.056 89.761 140.650 1.00 20.32 ? 185 GLU C CD 1 +ATOM 4680 O OE1 . GLU C 3 185 ? -40.816 89.938 141.636 1.00 22.18 ? 185 GLU C OE1 1 +ATOM 4681 O OE2 . GLU C 3 185 ? -39.631 90.710 139.959 1.00 23.05 ? 185 GLU C OE2 1 +ATOM 4682 N N . SER C 3 186 ? -39.499 85.551 138.703 1.00 11.60 ? 186 SER C N 1 +ATOM 4683 C CA . SER C 3 186 ? -40.219 85.272 137.458 1.00 11.36 ? 186 SER C CA 1 +ATOM 4684 C C . SER C 3 186 ? -40.547 83.796 137.217 1.00 11.68 ? 186 SER C C 1 +ATOM 4685 O O . SER C 3 186 ? -39.740 82.908 137.486 1.00 11.09 ? 186 SER C O 1 +ATOM 4686 C CB . SER C 3 186 ? -39.392 85.783 136.289 1.00 10.98 ? 186 SER C CB 1 +ATOM 4687 O OG . SER C 3 186 ? -40.153 86.032 135.141 1.00 12.09 ? 186 SER C OG 1 +ATOM 4688 N N . SER C 3 187 ? -41.737 83.558 136.676 1.00 12.32 ? 187 SER C N 1 +ATOM 4689 C CA . SER C 3 187 ? -42.096 82.263 136.140 1.00 13.07 ? 187 SER C CA 1 +ATOM 4690 C C . SER C 3 187 ? -41.011 81.717 135.211 1.00 14.41 ? 187 SER C C 1 +ATOM 4691 O O . SER C 3 187 ? -41.043 80.544 134.868 1.00 15.54 ? 187 SER C O 1 +ATOM 4692 C CB . SER C 3 187 ? -43.466 82.315 135.437 1.00 13.13 ? 187 SER C CB 1 +ATOM 4693 O OG . SER C 3 187 ? -43.430 82.979 134.187 1.00 13.27 ? 187 SER C OG 1 +ATOM 4694 N N . GLU C 3 188 ? -40.050 82.560 134.828 1.00 14.67 ? 188 GLU C N 1 +ATOM 4695 C CA . GLU C 3 188 ? -38.930 82.170 133.982 1.00 15.25 ? 188 GLU C CA 1 +ATOM 4696 C C . GLU C 3 188 ? -37.668 81.790 134.760 1.00 15.00 ? 188 GLU C C 1 +ATOM 4697 O O . GLU C 3 188 ? -36.601 81.632 134.180 1.00 14.31 ? 188 GLU C O 1 +ATOM 4698 C CB . GLU C 3 188 ? -38.567 83.339 133.071 1.00 15.83 ? 188 GLU C CB 1 +ATOM 4699 C CG . GLU C 3 188 ? -39.726 83.860 132.259 1.00 19.71 ? 188 GLU C CG 1 +ATOM 4700 C CD . GLU C 3 188 ? -39.814 83.167 130.919 1.00 25.23 ? 188 GLU C CD 1 +ATOM 4701 O OE1 . GLU C 3 188 ? -39.265 83.730 129.937 1.00 27.14 ? 188 GLU C OE1 1 +ATOM 4702 O OE2 . GLU C 3 188 ? -40.404 82.058 130.855 1.00 27.10 ? 188 GLU C OE2 1 +ATOM 4703 N N . ASP C 3 189 ? -37.783 81.635 136.070 1.00 15.03 ? 189 ASP C N 1 +ATOM 4704 C CA . ASP C 3 189 ? -36.604 81.587 136.895 1.00 14.26 ? 189 ASP C CA 1 +ATOM 4705 C C . ASP C 3 189 ? -36.498 80.309 137.660 1.00 13.71 ? 189 ASP C C 1 +ATOM 4706 O O . ASP C 3 189 ? -35.568 80.123 138.472 1.00 13.38 ? 189 ASP C O 1 +ATOM 4707 C CB . ASP C 3 189 ? -36.671 82.744 137.875 1.00 15.43 ? 189 ASP C CB 1 +ATOM 4708 C CG . ASP C 3 189 ? -36.313 84.075 137.238 1.00 16.04 ? 189 ASP C CG 1 +ATOM 4709 O OD1 . ASP C 3 189 ? -36.943 85.098 137.600 1.00 17.42 ? 189 ASP C OD1 1 +ATOM 4710 O OD2 . ASP C 3 189 ? -35.398 84.198 136.404 1.00 17.55 ? 189 ASP C OD2 1 +ATOM 4711 N N . CYS C 3 190 ? -37.462 79.434 137.419 1.00 13.40 ? 190 CYS C N 1 +ATOM 4712 C CA . CYS C 3 190 ? -37.533 78.141 138.078 1.00 14.32 ? 190 CYS C CA 1 +ATOM 4713 C C . CYS C 3 190 ? -36.292 77.286 137.869 1.00 13.67 ? 190 CYS C C 1 +ATOM 4714 O O . CYS C 3 190 ? -35.729 77.241 136.788 1.00 13.35 ? 190 CYS C O 1 +ATOM 4715 C CB . CYS C 3 190 ? -38.801 77.396 137.633 1.00 15.18 ? 190 CYS C CB 1 +ATOM 4716 S SG . CYS C 3 190 ? -40.278 78.439 137.884 1.00 19.17 ? 190 CYS C SG 1 +ATOM 4717 N N . GLN C 3 191 ? -35.847 76.630 138.934 1.00 13.94 ? 191 GLN C N 1 +ATOM 4718 C CA . GLN C 3 191 ? -34.768 75.673 138.803 1.00 13.23 ? 191 GLN C CA 1 +ATOM 4719 C C . GLN C 3 191 ? -35.280 74.504 137.965 1.00 13.83 ? 191 GLN C C 1 +ATOM 4720 O O . GLN C 3 191 ? -36.313 73.929 138.270 1.00 13.91 ? 191 GLN C O 1 +ATOM 4721 C CB . GLN C 3 191 ? -34.322 75.191 140.160 1.00 12.24 ? 191 GLN C CB 1 +ATOM 4722 C CG . GLN C 3 191 ? -33.182 74.222 140.068 1.00 11.78 ? 191 GLN C CG 1 +ATOM 4723 C CD . GLN C 3 191 ? -32.647 73.741 141.390 1.00 11.00 ? 191 GLN C CD 1 +ATOM 4724 O OE1 . GLN C 3 191 ? -33.239 73.964 142.459 1.00 11.62 ? 191 GLN C OE1 1 +ATOM 4725 N NE2 . GLN C 3 191 ? -31.511 73.069 141.326 1.00 10.55 ? 191 GLN C NE2 1 +ATOM 4726 N N . SER C 3 192 ? -34.592 74.167 136.882 1.00 14.93 ? 192 SER C N 1 +ATOM 4727 C CA . SER C 3 192 ? -34.945 72.921 136.224 1.00 15.95 ? 192 SER C CA 1 +ATOM 4728 C C . SER C 3 192 ? -34.005 71.863 136.759 1.00 16.01 ? 192 SER C C 1 +ATOM 4729 O O . SER C 3 192 ? -32.817 72.088 136.902 1.00 16.80 ? 192 SER C O 1 +ATOM 4730 C CB . SER C 3 192 ? -34.976 73.024 134.680 1.00 16.87 ? 192 SER C CB 1 +ATOM 4731 O OG . SER C 3 192 ? -33.730 73.389 134.103 1.00 16.01 ? 192 SER C OG 1 +ATOM 4732 N N . LEU C 3 193 ? -34.569 70.734 137.125 1.00 16.28 ? 193 LEU C N 1 +ATOM 4733 C CA . LEU C 3 193 ? -33.842 69.695 137.810 1.00 16.20 ? 193 LEU C CA 1 +ATOM 4734 C C . LEU C 3 193 ? -33.381 68.703 136.782 1.00 15.97 ? 193 LEU C C 1 +ATOM 4735 O O . LEU C 3 193 ? -34.106 68.377 135.846 1.00 16.05 ? 193 LEU C O 1 +ATOM 4736 C CB . LEU C 3 193 ? -34.745 69.004 138.832 1.00 16.56 ? 193 LEU C CB 1 +ATOM 4737 C CG . LEU C 3 193 ? -35.293 69.911 139.956 1.00 18.40 ? 193 LEU C CG 1 +ATOM 4738 C CD1 . LEU C 3 193 ? -36.142 69.107 140.977 1.00 19.41 ? 193 LEU C CD1 1 +ATOM 4739 C CD2 . LEU C 3 193 ? -34.191 70.700 140.670 1.00 17.41 ? 193 LEU C CD2 1 +ATOM 4740 N N . THR C 3 194 ? -32.176 68.195 136.967 1.00 15.70 ? 194 THR C N 1 +ATOM 4741 C CA . THR C 3 194 ? -31.577 67.378 135.938 1.00 15.14 ? 194 THR C CA 1 +ATOM 4742 C C . THR C 3 194 ? -30.952 66.059 136.448 1.00 14.45 ? 194 THR C C 1 +ATOM 4743 O O . THR C 3 194 ? -30.432 65.272 135.650 1.00 14.12 ? 194 THR C O 1 +ATOM 4744 C CB . THR C 3 194 ? -30.572 68.293 135.159 1.00 15.59 ? 194 THR C CB 1 +ATOM 4745 O OG1 . THR C 3 194 ? -31.304 69.380 134.564 1.00 13.75 ? 194 THR C OG1 1 +ATOM 4746 C CG2 . THR C 3 194 ? -30.065 67.591 133.952 1.00 17.23 ? 194 THR C CG2 1 +ATOM 4747 N N . ARG C 3 195 ? -31.017 65.810 137.763 1.00 13.66 ? 195 ARG C N 1 +ATOM 4748 C CA . ARG C 3 195 ? -30.291 64.688 138.368 1.00 12.86 ? 195 ARG C CA 1 +ATOM 4749 C C . ARG C 3 195 ? -31.116 63.810 139.286 1.00 13.24 ? 195 ARG C C 1 +ATOM 4750 O O . ARG C 3 195 ? -30.939 62.593 139.330 1.00 13.78 ? 195 ARG C O 1 +ATOM 4751 C CB . ARG C 3 195 ? -29.098 65.194 139.167 1.00 12.44 ? 195 ARG C CB 1 +ATOM 4752 C CG . ARG C 3 195 ? -27.971 64.175 139.192 1.00 11.68 ? 195 ARG C CG 1 +ATOM 4753 C CD . ARG C 3 195 ? -26.655 64.646 139.797 1.00 9.19 ? 195 ARG C CD 1 +ATOM 4754 N NE . ARG C 3 195 ? -26.782 64.862 141.224 1.00 9.80 ? 195 ARG C NE 1 +ATOM 4755 C CZ . ARG C 3 195 ? -27.066 63.924 142.109 1.00 10.37 ? 195 ARG C CZ 1 +ATOM 4756 N NH1 . ARG C 3 195 ? -27.246 62.664 141.727 1.00 11.90 ? 195 ARG C NH1 1 +ATOM 4757 N NH2 . ARG C 3 195 ? -27.178 64.244 143.389 1.00 10.58 ? 195 ARG C NH2 1 +ATOM 4758 N N . THR C 3 196 ? -31.999 64.444 140.035 1.00 13.16 ? 196 THR C N 1 +ATOM 4759 C CA . THR C 3 196 ? -32.809 63.800 141.050 1.00 13.00 ? 196 THR C CA 1 +ATOM 4760 C C . THR C 3 196 ? -34.154 63.340 140.476 1.00 13.62 ? 196 THR C C 1 +ATOM 4761 O O . THR C 3 196 ? -34.993 62.747 141.174 1.00 14.26 ? 196 THR C O 1 +ATOM 4762 C CB . THR C 3 196 ? -33.036 64.828 142.160 1.00 12.96 ? 196 THR C CB 1 +ATOM 4763 O OG1 . THR C 3 196 ? -33.380 66.098 141.574 1.00 11.04 ? 196 THR C OG1 1 +ATOM 4764 C CG2 . THR C 3 196 ? -31.718 65.121 142.861 1.00 12.59 ? 196 THR C CG2 1 +ATOM 4765 N N . VAL C 3 197 ? -34.321 63.593 139.188 1.00 14.04 ? 197 VAL C N 1 +ATOM 4766 C CA . VAL C 3 197 ? -35.605 63.582 138.515 1.00 14.85 ? 197 VAL C CA 1 +ATOM 4767 C C . VAL C 3 197 ? -35.603 62.584 137.320 1.00 15.60 ? 197 VAL C C 1 +ATOM 4768 O O . VAL C 3 197 ? -36.498 62.601 136.463 1.00 14.93 ? 197 VAL C O 1 +ATOM 4769 C CB . VAL C 3 197 ? -35.923 65.065 138.126 1.00 14.87 ? 197 VAL C CB 1 +ATOM 4770 C CG1 . VAL C 3 197 ? -35.905 65.312 136.618 1.00 15.28 ? 197 VAL C CG1 1 +ATOM 4771 C CG2 . VAL C 3 197 ? -37.215 65.585 138.817 1.00 14.88 ? 197 VAL C CG2 1 +ATOM 4772 N N . CYS C 3 198 ? -34.601 61.694 137.315 1.00 16.67 ? 198 CYS C N 1 +ATOM 4773 C CA . CYS C 3 198 ? -34.289 60.835 136.179 1.00 18.13 ? 198 CYS C CA 1 +ATOM 4774 C C . CYS C 3 198 ? -34.635 59.363 136.390 1.00 19.22 ? 198 CYS C C 1 +ATOM 4775 O O . CYS C 3 198 ? -34.895 58.939 137.522 1.00 19.82 ? 198 CYS C O 1 +ATOM 4776 C CB . CYS C 3 198 ? -32.819 60.958 135.843 1.00 17.95 ? 198 CYS C CB 1 +ATOM 4777 S SG . CYS C 3 198 ? -32.284 62.616 135.325 1.00 19.78 ? 198 CYS C SG 1 +ATOM 4778 N N . ALA C 3 199 ? -34.633 58.595 135.292 1.00 20.04 ? 199 ALA C N 1 +ATOM 4779 C CA . ALA C 3 199 ? -35.065 57.190 135.277 1.00 20.64 ? 199 ALA C CA 1 +ATOM 4780 C C . ALA C 3 199 ? -33.905 56.236 135.495 1.00 21.48 ? 199 ALA C C 1 +ATOM 4781 O O . ALA C 3 199 ? -32.903 56.299 134.771 1.00 21.74 ? 199 ALA C O 1 +ATOM 4782 C CB . ALA C 3 199 ? -35.767 56.855 133.955 1.00 20.27 ? 199 ALA C CB 1 +ATOM 4783 N N . GLY C 3 200 ? -34.056 55.337 136.475 1.00 22.41 ? 200 GLY C N 1 +ATOM 4784 C CA . GLY C 3 200 ? -33.031 54.349 136.800 1.00 22.85 ? 200 GLY C CA 1 +ATOM 4785 C C . GLY C 3 200 ? -31.719 55.014 137.193 1.00 23.19 ? 200 GLY C C 1 +ATOM 4786 O O . GLY C 3 200 ? -31.714 56.134 137.729 1.00 23.02 ? 200 GLY C O 1 +ATOM 4787 N N . GLY C 3 201 ? -30.604 54.341 136.921 1.00 23.30 ? 201 GLY C N 1 +ATOM 4788 C CA . GLY C 3 201 ? -29.306 54.872 137.313 1.00 23.60 ? 201 GLY C CA 1 +ATOM 4789 C C . GLY C 3 201 ? -28.766 55.887 136.316 1.00 23.49 ? 201 GLY C C 1 +ATOM 4790 O O . GLY C 3 201 ? -27.803 55.582 135.593 1.00 23.99 ? 201 GLY C O 1 +ATOM 4791 N N . CYS C 3 202 ? -29.373 57.079 136.275 1.00 22.60 ? 202 CYS C N 1 +ATOM 4792 C CA . CYS C 3 202 ? -29.082 58.076 135.228 1.00 21.82 ? 202 CYS C CA 1 +ATOM 4793 C C . CYS C 3 202 ? -28.440 59.301 135.821 1.00 20.36 ? 202 CYS C C 1 +ATOM 4794 O O . CYS C 3 202 ? -28.953 59.872 136.787 1.00 20.77 ? 202 CYS C O 1 +ATOM 4795 C CB . CYS C 3 202 ? -30.383 58.510 134.555 1.00 22.12 ? 202 CYS C CB 1 +ATOM 4796 S SG . CYS C 3 202 ? -30.289 58.635 132.767 1.00 24.92 ? 202 CYS C SG 1 +ATOM 4797 N N . ALA C 3 203 ? -27.338 59.738 135.245 1.00 18.58 ? 203 ALA C N 1 +ATOM 4798 C CA . ALA C 3 203 ? -26.626 60.878 135.824 1.00 16.75 ? 203 ALA C CA 1 +ATOM 4799 C C . ALA C 3 203 ? -27.325 62.174 135.515 1.00 15.86 ? 203 ALA C C 1 +ATOM 4800 O O . ALA C 3 203 ? -27.383 63.064 136.368 1.00 15.68 ? 203 ALA C O 1 +ATOM 4801 C CB . ALA C 3 203 ? -25.176 60.924 135.352 1.00 15.95 ? 203 ALA C CB 1 +ATOM 4802 N N . ARG C 3 204 ? -27.831 62.279 134.283 1.00 15.36 ? 204 ARG C N 1 +ATOM 4803 C CA . ARG C 3 204 ? -28.501 63.481 133.794 1.00 14.39 ? 204 ARG C CA 1 +ATOM 4804 C C . ARG C 3 204 ? -29.669 63.236 132.815 1.00 14.22 ? 204 ARG C C 1 +ATOM 4805 O O . ARG C 3 204 ? -29.684 62.246 132.054 1.00 12.39 ? 204 ARG C O 1 +ATOM 4806 C CB . ARG C 3 204 ? -27.486 64.434 133.187 1.00 14.03 ? 204 ARG C CB 1 +ATOM 4807 C CG . ARG C 3 204 ? -26.477 64.976 134.174 1.00 13.40 ? 204 ARG C CG 1 +ATOM 4808 C CD . ARG C 3 204 ? -26.923 66.221 134.982 1.00 13.85 ? 204 ARG C CD 1 +ATOM 4809 N NE . ARG C 3 204 ? -26.011 66.468 136.107 1.00 12.65 ? 204 ARG C NE 1 +ATOM 4810 C CZ . ARG C 3 204 ? -26.173 67.391 137.036 1.00 11.07 ? 204 ARG C CZ 1 +ATOM 4811 N NH1 . ARG C 3 204 ? -27.237 68.181 137.017 1.00 13.26 ? 204 ARG C NH1 1 +ATOM 4812 N NH2 . ARG C 3 204 ? -25.282 67.504 138.007 1.00 8.34 ? 204 ARG C NH2 1 +ATOM 4813 N N . CYS C 3 205 ? -30.649 64.151 132.866 1.00 14.24 ? 205 CYS C N 1 +ATOM 4814 C CA . CYS C 3 205 ? -31.807 64.102 131.967 1.00 14.62 ? 205 CYS C CA 1 +ATOM 4815 C C . CYS C 3 205 ? -32.413 65.419 131.492 1.00 15.02 ? 205 CYS C C 1 +ATOM 4816 O O . CYS C 3 205 ? -31.946 66.543 131.808 1.00 15.44 ? 205 CYS C O 1 +ATOM 4817 C CB . CYS C 3 205 ? -32.929 63.222 132.522 1.00 14.49 ? 205 CYS C CB 1 +ATOM 4818 S SG . CYS C 3 205 ? -33.558 63.697 134.128 1.00 14.54 ? 205 CYS C SG 1 +ATOM 4819 N N . LYS C 3 206 ? -33.454 65.247 130.684 1.00 15.14 ? 206 LYS C N 1 +ATOM 4820 C CA . LYS C 3 206 ? -34.285 66.356 130.253 1.00 15.59 ? 206 LYS C CA 1 +ATOM 4821 C C . LYS C 3 206 ? -35.746 66.160 130.688 1.00 15.17 ? 206 LYS C C 1 +ATOM 4822 O O . LYS C 3 206 ? -36.628 66.903 130.262 1.00 15.31 ? 206 LYS C O 1 +ATOM 4823 C CB . LYS C 3 206 ? -34.149 66.589 128.735 1.00 15.83 ? 206 LYS C CB 1 +ATOM 4824 C CG . LYS C 3 206 ? -34.622 65.458 127.825 1.00 16.72 ? 206 LYS C CG 1 +ATOM 4825 C CD . LYS C 3 206 ? -34.429 65.846 126.368 1.00 19.06 ? 206 LYS C CD 1 +ATOM 4826 C CE . LYS C 3 206 ? -35.712 65.662 125.585 1.00 21.93 ? 206 LYS C CE 1 +ATOM 4827 N NZ . LYS C 3 206 ? -35.698 64.320 124.954 1.00 24.07 ? 206 LYS C NZ 1 +ATOM 4828 N N . GLY C 3 207 ? -35.988 65.175 131.547 1.00 14.46 ? 207 GLY C N 1 +ATOM 4829 C CA . GLY C 3 207 ? -37.343 64.812 131.923 1.00 14.31 ? 207 GLY C CA 1 +ATOM 4830 C C . GLY C 3 207 ? -37.389 63.409 132.515 1.00 14.05 ? 207 GLY C C 1 +ATOM 4831 O O . GLY C 3 207 ? -36.385 62.679 132.475 1.00 13.79 ? 207 GLY C O 1 +ATOM 4832 N N . PRO C 3 208 ? -38.556 63.027 133.032 1.00 13.66 ? 208 PRO C N 1 +ATOM 4833 C CA . PRO C 3 208 ? -38.693 61.869 133.929 1.00 13.45 ? 208 PRO C CA 1 +ATOM 4834 C C . PRO C 3 208 ? -38.533 60.514 133.256 1.00 13.39 ? 208 PRO C C 1 +ATOM 4835 O O . PRO C 3 208 ? -38.435 59.521 133.974 1.00 13.05 ? 208 PRO C O 1 +ATOM 4836 C CB . PRO C 3 208 ? -40.122 62.008 134.451 1.00 13.26 ? 208 PRO C CB 1 +ATOM 4837 C CG . PRO C 3 208 ? -40.849 62.714 133.362 1.00 13.38 ? 208 PRO C CG 1 +ATOM 4838 C CD . PRO C 3 208 ? -39.851 63.675 132.764 1.00 13.91 ? 208 PRO C CD 1 +ATOM 4839 N N . LEU C 3 209 ? -38.500 60.481 131.924 1.00 13.58 ? 209 LEU C N 1 +ATOM 4840 C CA . LEU C 3 209 ? -38.484 59.224 131.165 1.00 14.09 ? 209 LEU C CA 1 +ATOM 4841 C C . LEU C 3 209 ? -37.074 58.708 130.827 1.00 14.56 ? 209 LEU C C 1 +ATOM 4842 O O . LEU C 3 209 ? -36.105 59.495 130.804 1.00 14.59 ? 209 LEU C O 1 +ATOM 4843 C CB . LEU C 3 209 ? -39.361 59.329 129.889 1.00 13.95 ? 209 LEU C CB 1 +ATOM 4844 C CG . LEU C 3 209 ? -40.852 59.684 130.065 1.00 13.21 ? 209 LEU C CG 1 +ATOM 4845 C CD1 . LEU C 3 209 ? -41.588 59.824 128.727 1.00 12.05 ? 209 LEU C CD1 1 +ATOM 4846 C CD2 . LEU C 3 209 ? -41.563 58.699 130.995 1.00 11.17 ? 209 LEU C CD2 1 +ATOM 4847 N N . PRO C 3 210 ? -36.963 57.388 130.603 1.00 14.89 ? 210 PRO C N 1 +ATOM 4848 C CA . PRO C 3 210 ? -35.744 56.774 130.062 1.00 15.11 ? 210 PRO C CA 1 +ATOM 4849 C C . PRO C 3 210 ? -35.264 57.485 128.801 1.00 15.60 ? 210 PRO C C 1 +ATOM 4850 O O . PRO C 3 210 ? -34.070 57.677 128.608 1.00 15.85 ? 210 PRO C O 1 +ATOM 4851 C CB . PRO C 3 210 ? -36.202 55.362 129.712 1.00 15.13 ? 210 PRO C CB 1 +ATOM 4852 C CG . PRO C 3 210 ? -37.291 55.078 130.659 1.00 14.95 ? 210 PRO C CG 1 +ATOM 4853 C CD . PRO C 3 210 ? -38.000 56.376 130.889 1.00 14.90 ? 210 PRO C CD 1 +ATOM 4854 N N . THR C 3 211 ? -36.202 57.891 127.959 1.00 16.39 ? 211 THR C N 1 +ATOM 4855 C CA . THR C 3 211 ? -35.893 58.535 126.688 1.00 17.23 ? 211 THR C CA 1 +ATOM 4856 C C . THR C 3 211 ? -35.396 59.947 126.919 1.00 17.54 ? 211 THR C C 1 +ATOM 4857 O O . THR C 3 211 ? -34.729 60.522 126.063 1.00 18.13 ? 211 THR C O 1 +ATOM 4858 C CB . THR C 3 211 ? -37.144 58.575 125.779 1.00 17.52 ? 211 THR C CB 1 +ATOM 4859 O OG1 . THR C 3 211 ? -38.186 59.331 126.425 1.00 18.19 ? 211 THR C OG1 1 +ATOM 4860 C CG2 . THR C 3 211 ? -37.734 57.166 125.594 1.00 17.50 ? 211 THR C CG2 1 +ATOM 4861 N N . ASP C 3 212 ? -35.749 60.490 128.081 1.00 17.61 ? 212 ASP C N 1 +ATOM 4862 C CA . ASP C 3 212 ? -35.280 61.780 128.553 1.00 17.49 ? 212 ASP C CA 1 +ATOM 4863 C C . ASP C 3 212 ? -33.843 61.728 129.096 1.00 17.20 ? 212 ASP C C 1 +ATOM 4864 O O . ASP C 3 212 ? -33.244 62.763 129.379 1.00 16.63 ? 212 ASP C O 1 +ATOM 4865 C CB . ASP C 3 212 ? -36.207 62.255 129.668 1.00 17.86 ? 212 ASP C CB 1 +ATOM 4866 C CG . ASP C 3 212 ? -37.573 62.679 129.165 1.00 19.63 ? 212 ASP C CG 1 +ATOM 4867 O OD1 . ASP C 3 212 ? -38.593 62.253 129.767 1.00 21.67 ? 212 ASP C OD1 1 +ATOM 4868 O OD2 . ASP C 3 212 ? -37.729 63.453 128.191 1.00 21.53 ? 212 ASP C OD2 1 +ATOM 4869 N N . CYS C 3 213 ? -33.307 60.524 129.264 1.00 17.19 ? 213 CYS C N 1 +ATOM 4870 C CA . CYS C 3 213 ? -31.966 60.326 129.806 1.00 17.47 ? 213 CYS C CA 1 +ATOM 4871 C C . CYS C 3 213 ? -30.877 60.826 128.857 1.00 16.55 ? 213 CYS C C 1 +ATOM 4872 O O . CYS C 3 213 ? -30.934 60.589 127.643 1.00 16.52 ? 213 CYS C O 1 +ATOM 4873 C CB . CYS C 3 213 ? -31.752 58.841 130.100 1.00 17.89 ? 213 CYS C CB 1 +ATOM 4874 S SG . CYS C 3 213 ? -32.089 58.347 131.812 1.00 22.04 ? 213 CYS C SG 1 +ATOM 4875 N N . CYS C 3 214 ? -29.901 61.536 129.410 1.00 15.67 ? 214 CYS C N 1 +ATOM 4876 C CA . CYS C 3 214 ? -28.758 62.000 128.624 1.00 14.74 ? 214 CYS C CA 1 +ATOM 4877 C C . CYS C 3 214 ? -27.727 60.900 128.457 1.00 14.97 ? 214 CYS C C 1 +ATOM 4878 O O . CYS C 3 214 ? -27.584 60.021 129.310 1.00 14.58 ? 214 CYS C O 1 +ATOM 4879 C CB . CYS C 3 214 ? -28.098 63.206 129.276 1.00 14.12 ? 214 CYS C CB 1 +ATOM 4880 S SG . CYS C 3 214 ? -29.216 64.602 129.502 1.00 12.65 ? 214 CYS C SG 1 +ATOM 4881 N N . HIS C 3 215 ? -27.022 60.949 127.339 1.00 14.94 ? 215 HIS C N 1 +ATOM 4882 C CA . HIS C 3 215 ? -25.794 60.209 127.190 1.00 15.63 ? 215 HIS C CA 1 +ATOM 4883 C C . HIS C 3 215 ? -24.911 60.362 128.428 1.00 16.04 ? 215 HIS C C 1 +ATOM 4884 O O . HIS C 3 215 ? -24.955 61.398 129.128 1.00 15.92 ? 215 HIS C O 1 +ATOM 4885 C CB . HIS C 3 215 ? -25.031 60.739 125.987 1.00 15.57 ? 215 HIS C CB 1 +ATOM 4886 C CG . HIS C 3 215 ? -24.074 59.754 125.426 1.00 16.59 ? 215 HIS C CG 1 +ATOM 4887 N ND1 . HIS C 3 215 ? -24.429 58.854 124.441 1.00 18.26 ? 215 HIS C ND1 1 +ATOM 4888 C CD2 . HIS C 3 215 ? -22.790 59.478 125.754 1.00 17.14 ? 215 HIS C CD2 1 +ATOM 4889 C CE1 . HIS C 3 215 ? -23.387 58.090 124.160 1.00 20.15 ? 215 HIS C CE1 1 +ATOM 4890 N NE2 . HIS C 3 215 ? -22.382 58.447 124.946 1.00 19.37 ? 215 HIS C NE2 1 +ATOM 4891 N N . GLU C 3 216 ? -24.110 59.330 128.678 1.00 16.45 ? 216 GLU C N 1 +ATOM 4892 C CA . GLU C 3 216 ? -23.240 59.240 129.847 1.00 17.20 ? 216 GLU C CA 1 +ATOM 4893 C C . GLU C 3 216 ? -22.059 60.205 129.755 1.00 16.54 ? 216 GLU C C 1 +ATOM 4894 O O . GLU C 3 216 ? -21.405 60.471 130.751 1.00 16.77 ? 216 GLU C O 1 +ATOM 4895 C CB . GLU C 3 216 ? -22.794 57.771 130.039 1.00 18.18 ? 216 GLU C CB 1 +ATOM 4896 C CG . GLU C 3 216 ? -21.300 57.486 130.239 1.00 22.82 ? 216 GLU C CG 1 +ATOM 4897 C CD . GLU C 3 216 ? -20.764 56.463 129.240 1.00 30.22 ? 216 GLU C CD 1 +ATOM 4898 O OE1 . GLU C 3 216 ? -20.474 56.885 128.078 1.00 32.80 ? 216 GLU C OE1 1 +ATOM 4899 O OE2 . GLU C 3 216 ? -20.631 55.239 129.601 1.00 30.23 ? 216 GLU C OE2 1 +ATOM 4900 N N . GLN C 3 217 ? -21.809 60.722 128.551 1.00 15.85 ? 217 GLN C N 1 +ATOM 4901 C CA . GLN C 3 217 ? -20.735 61.674 128.278 1.00 15.08 ? 217 GLN C CA 1 +ATOM 4902 C C . GLN C 3 217 ? -21.164 63.131 128.409 1.00 14.50 ? 217 GLN C C 1 +ATOM 4903 O O . GLN C 3 217 ? -20.324 64.026 128.356 1.00 13.92 ? 217 GLN C O 1 +ATOM 4904 C CB . GLN C 3 217 ? -20.214 61.468 126.858 1.00 14.47 ? 217 GLN C CB 1 +ATOM 4905 C CG . GLN C 3 217 ? -19.007 60.540 126.707 1.00 15.59 ? 217 GLN C CG 1 +ATOM 4906 C CD . GLN C 3 217 ? -18.153 60.368 127.961 1.00 14.01 ? 217 GLN C CD 1 +ATOM 4907 O OE1 . GLN C 3 217 ? -18.072 59.285 128.501 1.00 12.07 ? 217 GLN C OE1 1 +ATOM 4908 N NE2 . GLN C 3 217 ? -17.510 61.431 128.395 1.00 14.42 ? 217 GLN C NE2 1 +ATOM 4909 N N . CYS C 3 218 ? -22.468 63.355 128.539 1.00 14.13 ? 218 CYS C N 1 +ATOM 4910 C CA . CYS C 3 218 ? -23.018 64.665 128.814 1.00 14.57 ? 218 CYS C CA 1 +ATOM 4911 C C . CYS C 3 218 ? -22.739 65.077 130.226 1.00 14.59 ? 218 CYS C C 1 +ATOM 4912 O O . CYS C 3 218 ? -22.727 64.232 131.108 1.00 15.16 ? 218 CYS C O 1 +ATOM 4913 C CB . CYS C 3 218 ? -24.510 64.621 128.726 1.00 13.83 ? 218 CYS C CB 1 +ATOM 4914 S SG . CYS C 3 218 ? -25.047 64.378 127.083 1.00 17.05 ? 218 CYS C SG 1 +ATOM 4915 N N . ALA C 3 219 ? -22.602 66.386 130.433 1.00 14.47 ? 219 ALA C N 1 +ATOM 4916 C CA . ALA C 3 219 ? -22.505 66.967 131.758 1.00 14.34 ? 219 ALA C CA 1 +ATOM 4917 C C . ALA C 3 219 ? -23.710 67.774 132.322 1.00 14.18 ? 219 ALA C C 1 +ATOM 4918 O O . ALA C 3 219 ? -23.931 67.753 133.530 1.00 15.55 ? 219 ALA C O 1 +ATOM 4919 C CB . ALA C 3 219 ? -21.223 67.787 131.880 1.00 14.96 ? 219 ALA C CB 1 +ATOM 4920 N N . ALA C 3 220 ? -24.484 68.529 131.568 1.00 13.13 ? 220 ALA C N 1 +ATOM 4921 C CA . ALA C 3 220 ? -25.446 69.344 132.360 1.00 12.33 ? 220 ALA C CA 1 +ATOM 4922 C C . ALA C 3 220 ? -26.942 69.067 132.108 1.00 12.02 ? 220 ALA C C 1 +ATOM 4923 O O . ALA C 3 220 ? -27.805 69.664 132.741 1.00 12.16 ? 220 ALA C O 1 +ATOM 4924 C CB . ALA C 3 220 ? -25.133 70.865 132.239 1.00 12.04 ? 220 ALA C CB 1 +ATOM 4925 N N . GLY C 3 221 ? -27.237 68.156 131.193 1.00 10.82 ? 221 GLY C N 1 +ATOM 4926 C CA . GLY C 3 221 ? -28.574 67.967 130.704 1.00 9.64 ? 221 GLY C CA 1 +ATOM 4927 C C . GLY C 3 221 ? -28.345 67.732 129.252 1.00 8.68 ? 221 GLY C C 1 +ATOM 4928 O O . GLY C 3 221 ? -27.228 67.668 128.831 1.00 8.93 ? 221 GLY C O 1 +ATOM 4929 N N . CYS C 3 222 ? -29.399 67.604 128.483 1.00 8.70 ? 222 CYS C N 1 +ATOM 4930 C CA . CYS C 3 222 ? -29.262 67.397 127.060 1.00 8.48 ? 222 CYS C CA 1 +ATOM 4931 C C . CYS C 3 222 ? -30.557 67.783 126.450 1.00 8.45 ? 222 CYS C C 1 +ATOM 4932 O O . CYS C 3 222 ? -31.516 68.081 127.159 1.00 8.53 ? 222 CYS C O 1 +ATOM 4933 C CB . CYS C 3 222 ? -29.048 65.930 126.778 1.00 8.61 ? 222 CYS C CB 1 +ATOM 4934 S SG . CYS C 3 222 ? -30.189 64.949 127.732 1.00 10.10 ? 222 CYS C SG 1 +ATOM 4935 N N . THR C 3 223 ? -30.581 67.768 125.129 1.00 8.68 ? 223 THR C N 1 +ATOM 4936 C CA . THR C 3 223 ? -31.777 68.082 124.376 1.00 9.39 ? 223 THR C CA 1 +ATOM 4937 C C . THR C 3 223 ? -32.224 66.865 123.618 1.00 9.92 ? 223 THR C C 1 +ATOM 4938 O O . THR C 3 223 ? -33.200 66.910 122.880 1.00 10.60 ? 223 THR C O 1 +ATOM 4939 C CB . THR C 3 223 ? -31.481 69.166 123.373 1.00 9.63 ? 223 THR C CB 1 +ATOM 4940 O OG1 . THR C 3 223 ? -30.366 68.748 122.566 1.00 9.87 ? 223 THR C OG1 1 +ATOM 4941 C CG2 . THR C 3 223 ? -31.041 70.448 124.081 1.00 7.92 ? 223 THR C CG2 1 +ATOM 4942 N N . GLY C 3 224 ? -31.491 65.781 123.799 1.00 10.36 ? 224 GLY C N 1 +ATOM 4943 C CA . GLY C 3 224 ? -31.804 64.529 123.165 1.00 11.55 ? 224 GLY C CA 1 +ATOM 4944 C C . GLY C 3 224 ? -30.919 63.458 123.746 1.00 12.43 ? 224 GLY C C 1 +ATOM 4945 O O . GLY C 3 224 ? -30.081 63.732 124.618 1.00 12.82 ? 224 GLY C O 1 +ATOM 4946 N N . PRO C 3 225 ? -31.060 62.253 123.221 1.00 12.47 ? 225 PRO C N 1 +ATOM 4947 C CA . PRO C 3 225 ? -30.496 61.069 123.865 1.00 13.12 ? 225 PRO C CA 1 +ATOM 4948 C C . PRO C 3 225 ? -29.019 60.821 123.555 1.00 13.44 ? 225 PRO C C 1 +ATOM 4949 O O . PRO C 3 225 ? -28.386 59.967 124.187 1.00 13.57 ? 225 PRO C O 1 +ATOM 4950 C CB . PRO C 3 225 ? -31.357 59.925 123.296 1.00 13.15 ? 225 PRO C CB 1 +ATOM 4951 C CG . PRO C 3 225 ? -31.875 60.449 121.941 1.00 13.15 ? 225 PRO C CG 1 +ATOM 4952 C CD . PRO C 3 225 ? -31.732 61.954 121.944 1.00 12.24 ? 225 PRO C CD 1 +ATOM 4953 N N . LYS C 3 226 ? -28.470 61.531 122.584 1.00 14.02 ? 226 LYS C N 1 +ATOM 4954 C CA . LYS C 3 226 ? -27.164 61.131 122.059 1.00 14.33 ? 226 LYS C CA 1 +ATOM 4955 C C . LYS C 3 226 ? -26.039 62.140 122.316 1.00 14.49 ? 226 LYS C C 1 +ATOM 4956 O O . LYS C 3 226 ? -26.309 63.282 122.685 1.00 13.35 ? 226 LYS C O 1 +ATOM 4957 C CB . LYS C 3 226 ? -27.246 60.704 120.581 1.00 14.42 ? 226 LYS C CB 1 +ATOM 4958 C CG . LYS C 3 226 ? -28.195 61.495 119.666 1.00 14.93 ? 226 LYS C CG 1 +ATOM 4959 C CD . LYS C 3 226 ? -27.667 61.481 118.228 1.00 15.36 ? 226 LYS C CD 1 +ATOM 4960 C CE . LYS C 3 226 ? -28.768 61.514 117.225 1.00 16.65 ? 226 LYS C CE 1 +ATOM 4961 N NZ . LYS C 3 226 ? -29.071 60.150 116.722 1.00 16.32 ? 226 LYS C NZ 1 +ATOM 4962 N N . HIS C 3 227 ? -24.788 61.680 122.132 1.00 15.01 ? 227 HIS C N 1 +ATOM 4963 C CA . HIS C 3 227 ? -23.573 62.415 122.535 1.00 15.75 ? 227 HIS C CA 1 +ATOM 4964 C C . HIS C 3 227 ? -23.349 63.729 121.768 1.00 15.45 ? 227 HIS C C 1 +ATOM 4965 O O . HIS C 3 227 ? -22.409 64.470 122.046 1.00 15.87 ? 227 HIS C O 1 +ATOM 4966 C CB . HIS C 3 227 ? -22.320 61.516 122.460 1.00 15.63 ? 227 HIS C CB 1 +ATOM 4967 C CG . HIS C 3 227 ? -22.054 60.960 121.090 1.00 17.56 ? 227 HIS C CG 1 +ATOM 4968 N ND1 . HIS C 3 227 ? -21.294 59.827 120.879 1.00 17.63 ? 227 HIS C ND1 1 +ATOM 4969 C CD2 . HIS C 3 227 ? -22.459 61.374 119.867 1.00 18.40 ? 227 HIS C CD2 1 +ATOM 4970 C CE1 . HIS C 3 227 ? -21.243 59.571 119.586 1.00 20.16 ? 227 HIS C CE1 1 +ATOM 4971 N NE2 . HIS C 3 227 ? -21.931 60.501 118.948 1.00 20.76 ? 227 HIS C NE2 1 +ATOM 4972 N N . SER C 3 228 ? -24.222 63.985 120.804 1.00 14.94 ? 228 SER C N 1 +ATOM 4973 C CA . SER C 3 228 ? -24.258 65.223 120.061 1.00 14.37 ? 228 SER C CA 1 +ATOM 4974 C C . SER C 3 228 ? -25.305 66.222 120.624 1.00 14.20 ? 228 SER C C 1 +ATOM 4975 O O . SER C 3 228 ? -25.454 67.338 120.103 1.00 14.40 ? 228 SER C O 1 +ATOM 4976 C CB . SER C 3 228 ? -24.609 64.877 118.611 1.00 15.06 ? 228 SER C CB 1 +ATOM 4977 O OG . SER C 3 228 ? -25.851 64.167 118.547 1.00 14.50 ? 228 SER C OG 1 +ATOM 4978 N N . ASP C 3 229 ? -26.038 65.818 121.664 1.00 13.37 ? 229 ASP C N 1 +ATOM 4979 C CA . ASP C 3 229 ? -27.163 66.602 122.193 1.00 13.05 ? 229 ASP C CA 1 +ATOM 4980 C C . ASP C 3 229 ? -26.936 67.179 123.588 1.00 13.22 ? 229 ASP C C 1 +ATOM 4981 O O . ASP C 3 229 ? -27.867 67.713 124.186 1.00 13.62 ? 229 ASP C O 1 +ATOM 4982 C CB . ASP C 3 229 ? -28.415 65.742 122.287 1.00 13.06 ? 229 ASP C CB 1 +ATOM 4983 C CG . ASP C 3 229 ? -28.965 65.333 120.934 1.00 13.75 ? 229 ASP C CG 1 +ATOM 4984 O OD1 . ASP C 3 229 ? -28.934 66.156 119.976 1.00 14.19 ? 229 ASP C OD1 1 +ATOM 4985 O OD2 . ASP C 3 229 ? -29.458 64.194 120.756 1.00 13.12 ? 229 ASP C OD2 1 +ATOM 4986 N N . CYS C 3 230 ? -25.725 67.051 124.120 1.00 12.76 ? 230 CYS C N 1 +ATOM 4987 C CA . CYS C 3 230 ? -25.437 67.522 125.450 1.00 12.36 ? 230 CYS C CA 1 +ATOM 4988 C C . CYS C 3 230 ? -25.491 69.065 125.563 1.00 12.59 ? 230 CYS C C 1 +ATOM 4989 O O . CYS C 3 230 ? -25.138 69.821 124.640 1.00 11.21 ? 230 CYS C O 1 +ATOM 4990 C CB . CYS C 3 230 ? -24.062 67.053 125.874 1.00 12.33 ? 230 CYS C CB 1 +ATOM 4991 S SG . CYS C 3 230 ? -23.773 65.301 125.796 1.00 13.74 ? 230 CYS C SG 1 +ATOM 4992 N N . LEU C 3 231 ? -25.941 69.504 126.737 1.00 12.58 ? 231 LEU C N 1 +ATOM 4993 C CA . LEU C 3 231 ? -25.831 70.891 127.166 1.00 11.99 ? 231 LEU C CA 1 +ATOM 4994 C C . LEU C 3 231 ? -24.370 71.265 127.462 1.00 11.92 ? 231 LEU C C 1 +ATOM 4995 O O . LEU C 3 231 ? -24.000 72.416 127.315 1.00 12.78 ? 231 LEU C O 1 +ATOM 4996 C CB . LEU C 3 231 ? -26.750 71.148 128.374 1.00 10.87 ? 231 LEU C CB 1 +ATOM 4997 C CG . LEU C 3 231 ? -28.216 71.098 127.971 1.00 11.58 ? 231 LEU C CG 1 +ATOM 4998 C CD1 . LEU C 3 231 ? -29.260 71.327 129.117 1.00 10.92 ? 231 LEU C CD1 1 +ATOM 4999 C CD2 . LEU C 3 231 ? -28.430 72.070 126.803 1.00 10.43 ? 231 LEU C CD2 1 +ATOM 5000 N N . ALA C 3 232 ? -23.575 70.295 127.915 1.00 12.20 ? 232 ALA C N 1 +ATOM 5001 C CA . ALA C 3 232 ? -22.126 70.433 128.116 1.00 12.26 ? 232 ALA C CA 1 +ATOM 5002 C C . ALA C 3 232 ? -21.459 69.037 128.100 1.00 13.21 ? 232 ALA C C 1 +ATOM 5003 O O . ALA C 3 232 ? -22.130 68.007 128.216 1.00 13.24 ? 232 ALA C O 1 +ATOM 5004 C CB . ALA C 3 232 ? -21.830 71.138 129.384 1.00 12.19 ? 232 ALA C CB 1 +ATOM 5005 N N . CYS C 3 233 ? -20.141 69.006 127.945 1.00 13.37 ? 233 CYS C N 1 +ATOM 5006 C CA . CYS C 3 233 ? -19.407 67.760 127.956 1.00 13.84 ? 233 CYS C CA 1 +ATOM 5007 C C . CYS C 3 233 ? -18.892 67.328 129.363 1.00 13.41 ? 233 CYS C C 1 +ATOM 5008 O O . CYS C 3 233 ? -18.536 68.148 130.203 1.00 12.63 ? 233 CYS C O 1 +ATOM 5009 C CB . CYS C 3 233 ? -18.294 67.876 126.919 1.00 14.09 ? 233 CYS C CB 1 +ATOM 5010 S SG . CYS C 3 233 ? -18.964 68.003 125.220 1.00 18.78 ? 233 CYS C SG 1 +ATOM 5011 N N . LEU C 3 234 ? -18.859 66.026 129.651 1.00 13.91 ? 234 LEU C N 1 +ATOM 5012 C CA . LEU C 3 234 ? -18.357 65.627 130.968 1.00 13.96 ? 234 LEU C CA 1 +ATOM 5013 C C . LEU C 3 234 ? -16.872 65.922 131.000 1.00 13.85 ? 234 LEU C C 1 +ATOM 5014 O O . LEU C 3 234 ? -16.309 66.328 131.992 1.00 13.79 ? 234 LEU C O 1 +ATOM 5015 C CB . LEU C 3 234 ? -18.590 64.161 131.203 1.00 12.85 ? 234 LEU C CB 1 +ATOM 5016 C CG . LEU C 3 234 ? -19.071 63.815 132.593 1.00 13.61 ? 234 LEU C CG 1 +ATOM 5017 C CD1 . LEU C 3 234 ? -18.753 62.336 132.943 1.00 10.92 ? 234 LEU C CD1 1 +ATOM 5018 C CD2 . LEU C 3 234 ? -18.545 64.807 133.668 1.00 12.15 ? 234 LEU C CD2 1 +ATOM 5019 N N . HIS C 3 235 ? -16.260 65.707 129.856 1.00 14.30 ? 235 HIS C N 1 +ATOM 5020 C CA . HIS C 3 235 ? -14.834 65.691 129.738 1.00 14.73 ? 235 HIS C CA 1 +ATOM 5021 C C . HIS C 3 235 ? -14.471 66.553 128.559 1.00 14.51 ? 235 HIS C C 1 +ATOM 5022 O O . HIS C 3 235 ? -14.061 67.688 128.741 1.00 13.70 ? 235 HIS C O 1 +ATOM 5023 C CB . HIS C 3 235 ? -14.368 64.246 129.527 1.00 14.94 ? 235 HIS C CB 1 +ATOM 5024 C CG . HIS C 3 235 ? -14.711 63.337 130.654 1.00 15.38 ? 235 HIS C CG 1 +ATOM 5025 N ND1 . HIS C 3 235 ? -14.111 63.434 131.894 1.00 16.40 ? 235 HIS C ND1 1 +ATOM 5026 C CD2 . HIS C 3 235 ? -15.589 62.309 130.735 1.00 16.34 ? 235 HIS C CD2 1 +ATOM 5027 C CE1 . HIS C 3 235 ? -14.598 62.495 132.689 1.00 16.34 ? 235 HIS C CE1 1 +ATOM 5028 N NE2 . HIS C 3 235 ? -15.495 61.798 132.010 1.00 17.80 ? 235 HIS C NE2 1 +ATOM 5029 N N . PHE C 3 236 ? -14.660 66.030 127.347 1.00 14.67 ? 236 PHE C N 1 +ATOM 5030 C CA . PHE C 3 236 ? -14.121 66.722 126.179 1.00 15.17 ? 236 PHE C CA 1 +ATOM 5031 C C . PHE C 3 236 ? -15.090 66.844 125.040 1.00 14.73 ? 236 PHE C C 1 +ATOM 5032 O O . PHE C 3 236 ? -15.817 65.915 124.715 1.00 15.02 ? 236 PHE C O 1 +ATOM 5033 C CB . PHE C 3 236 ? -12.841 66.036 125.668 1.00 15.48 ? 236 PHE C CB 1 +ATOM 5034 C CG . PHE C 3 236 ? -11.714 66.082 126.635 1.00 16.38 ? 236 PHE C CG 1 +ATOM 5035 C CD1 . PHE C 3 236 ? -11.458 64.989 127.471 1.00 14.91 ? 236 PHE C CD1 1 +ATOM 5036 C CD2 . PHE C 3 236 ? -10.911 67.221 126.734 1.00 16.48 ? 236 PHE C CD2 1 +ATOM 5037 C CE1 . PHE C 3 236 ? -10.427 65.036 128.413 1.00 15.06 ? 236 PHE C CE1 1 +ATOM 5038 C CE2 . PHE C 3 236 ? -9.841 67.256 127.677 1.00 17.35 ? 236 PHE C CE2 1 +ATOM 5039 C CZ . PHE C 3 236 ? -9.613 66.174 128.507 1.00 15.55 ? 236 PHE C CZ 1 +ATOM 5040 N N . ASN C 3 237 ? -15.046 67.994 124.413 1.00 14.80 ? 237 ASN C N 1 +ATOM 5041 C CA . ASN C 3 237 ? -15.881 68.307 123.291 1.00 15.92 ? 237 ASN C CA 1 +ATOM 5042 C C . ASN C 3 237 ? -15.070 68.095 122.023 1.00 15.41 ? 237 ASN C C 1 +ATOM 5043 O O . ASN C 3 237 ? -14.225 68.915 121.665 1.00 16.43 ? 237 ASN C O 1 +ATOM 5044 C CB . ASN C 3 237 ? -16.318 69.765 123.399 1.00 15.94 ? 237 ASN C CB 1 +ATOM 5045 C CG . ASN C 3 237 ? -17.217 70.201 122.240 1.00 21.27 ? 237 ASN C CG 1 +ATOM 5046 O OD1 . ASN C 3 237 ? -17.381 69.478 121.233 1.00 23.32 ? 237 ASN C OD1 1 +ATOM 5047 N ND2 . ASN C 3 237 ? -17.830 71.387 122.394 1.00 27.82 ? 237 ASN C ND2 1 +ATOM 5048 N N . HIS C 3 238 ? -15.325 66.992 121.349 1.00 14.78 ? 238 HIS C N 1 +ATOM 5049 C CA . HIS C 3 238 ? -14.572 66.647 120.165 1.00 14.05 ? 238 HIS C CA 1 +ATOM 5050 C C . HIS C 3 238 ? -15.435 66.946 118.975 1.00 13.96 ? 238 HIS C C 1 +ATOM 5051 O O . HIS C 3 238 ? -16.271 66.138 118.584 1.00 14.29 ? 238 HIS C O 1 +ATOM 5052 C CB . HIS C 3 238 ? -14.159 65.166 120.181 1.00 13.87 ? 238 HIS C CB 1 +ATOM 5053 C CG . HIS C 3 238 ? -13.451 64.728 118.937 1.00 11.91 ? 238 HIS C CG 1 +ATOM 5054 N ND1 . HIS C 3 238 ? -12.975 65.620 118.005 1.00 8.22 ? 238 HIS C ND1 1 +ATOM 5055 C CD2 . HIS C 3 238 ? -13.124 63.498 118.478 1.00 11.20 ? 238 HIS C CD2 1 +ATOM 5056 C CE1 . HIS C 3 238 ? -12.396 64.963 117.017 1.00 8.72 ? 238 HIS C CE1 1 +ATOM 5057 N NE2 . HIS C 3 238 ? -12.489 63.672 117.271 1.00 11.30 ? 238 HIS C NE2 1 +ATOM 5058 N N . SER C 3 239 ? -15.235 68.125 118.414 1.00 14.10 ? 239 SER C N 1 +ATOM 5059 C CA . SER C 3 239 ? -15.946 68.562 117.222 1.00 14.74 ? 239 SER C CA 1 +ATOM 5060 C C . SER C 3 239 ? -17.484 68.492 117.374 1.00 14.50 ? 239 SER C C 1 +ATOM 5061 O O . SER C 3 239 ? -18.193 68.061 116.482 1.00 14.75 ? 239 SER C O 1 +ATOM 5062 C CB . SER C 3 239 ? -15.421 67.818 115.973 1.00 15.33 ? 239 SER C CB 1 +ATOM 5063 O OG . SER C 3 239 ? -15.214 68.714 114.868 1.00 16.39 ? 239 SER C OG 1 +ATOM 5064 N N . GLY C 3 240 ? -17.988 68.947 118.518 1.00 14.83 ? 240 GLY C N 1 +ATOM 5065 C CA . GLY C 3 240 ? -19.416 68.942 118.794 1.00 14.69 ? 240 GLY C CA 1 +ATOM 5066 C C . GLY C 3 240 ? -19.989 67.639 119.325 1.00 14.00 ? 240 GLY C C 1 +ATOM 5067 O O . GLY C 3 240 ? -21.207 67.458 119.329 1.00 13.79 ? 240 GLY C O 1 +ATOM 5068 N N . ILE C 3 241 ? -19.109 66.752 119.771 1.00 13.38 ? 241 ILE C N 1 +ATOM 5069 C CA . ILE C 3 241 ? -19.479 65.434 120.237 1.00 13.31 ? 241 ILE C CA 1 +ATOM 5070 C C . ILE C 3 241 ? -18.733 65.207 121.524 1.00 13.16 ? 241 ILE C C 1 +ATOM 5071 O O . ILE C 3 241 ? -17.517 65.288 121.551 1.00 12.27 ? 241 ILE C O 1 +ATOM 5072 C CB . ILE C 3 241 ? -19.103 64.389 119.179 1.00 13.71 ? 241 ILE C CB 1 +ATOM 5073 C CG1 . ILE C 3 241 ? -20.192 64.335 118.094 1.00 15.09 ? 241 ILE C CG1 1 +ATOM 5074 C CG2 . ILE C 3 241 ? -18.939 63.031 119.790 1.00 13.04 ? 241 ILE C CG2 1 +ATOM 5075 C CD1 . ILE C 3 241 ? -19.675 64.166 116.699 1.00 16.88 ? 241 ILE C CD1 1 +ATOM 5076 N N . CYS C 3 242 ? -19.474 64.965 122.601 1.00 13.28 ? 242 CYS C N 1 +ATOM 5077 C CA . CYS C 3 242 ? -18.882 64.796 123.907 1.00 13.46 ? 242 CYS C CA 1 +ATOM 5078 C C . CYS C 3 242 ? -18.208 63.450 124.047 1.00 13.47 ? 242 CYS C C 1 +ATOM 5079 O O . CYS C 3 242 ? -18.814 62.423 123.793 1.00 13.70 ? 242 CYS C O 1 +ATOM 5080 C CB . CYS C 3 242 ? -19.939 64.987 124.959 1.00 13.70 ? 242 CYS C CB 1 +ATOM 5081 S SG . CYS C 3 242 ? -20.524 66.689 124.925 1.00 16.45 ? 242 CYS C SG 1 +ATOM 5082 N N . GLU C 3 243 ? -16.935 63.459 124.432 1.00 13.30 ? 243 GLU C N 1 +ATOM 5083 C CA . GLU C 3 243 ? -16.141 62.239 124.496 1.00 12.98 ? 243 GLU C CA 1 +ATOM 5084 C C . GLU C 3 243 ? -15.265 62.200 125.746 1.00 12.53 ? 243 GLU C C 1 +ATOM 5085 O O . GLU C 3 243 ? -14.805 63.233 126.236 1.00 12.77 ? 243 GLU C O 1 +ATOM 5086 C CB . GLU C 3 243 ? -15.276 62.115 123.242 1.00 12.79 ? 243 GLU C CB 1 +ATOM 5087 C CG . GLU C 3 243 ? -16.083 62.220 121.973 1.00 17.28 ? 243 GLU C CG 1 +ATOM 5088 C CD . GLU C 3 243 ? -15.523 61.399 120.825 1.00 26.14 ? 243 GLU C CD 1 +ATOM 5089 O OE1 . GLU C 3 243 ? -15.798 60.170 120.798 1.00 29.79 ? 243 GLU C OE1 1 +ATOM 5090 O OE2 . GLU C 3 243 ? -14.826 61.982 119.942 1.00 28.20 ? 243 GLU C OE2 1 +ATOM 5091 N N . LEU C 3 244 ? -15.017 60.989 126.231 1.00 11.91 ? 244 LEU C N 1 +ATOM 5092 C CA . LEU C 3 244 ? -14.204 60.774 127.384 1.00 11.55 ? 244 LEU C CA 1 +ATOM 5093 C C . LEU C 3 244 ? -12.850 61.412 127.226 1.00 12.27 ? 244 LEU C C 1 +ATOM 5094 O O . LEU C 3 244 ? -12.324 61.976 128.191 1.00 12.62 ? 244 LEU C O 1 +ATOM 5095 C CB . LEU C 3 244 ? -14.021 59.272 127.622 1.00 11.27 ? 244 LEU C CB 1 +ATOM 5096 C CG . LEU C 3 244 ? -13.205 58.824 128.840 1.00 9.93 ? 244 LEU C CG 1 +ATOM 5097 C CD1 . LEU C 3 244 ? -13.603 59.507 130.129 1.00 9.97 ? 244 LEU C CD1 1 +ATOM 5098 C CD2 . LEU C 3 244 ? -13.404 57.367 129.012 1.00 12.78 ? 244 LEU C CD2 1 +ATOM 5099 N N . HIS C 3 245 ? -12.263 61.254 126.033 1.00 12.51 ? 245 HIS C N 1 +ATOM 5100 C CA . HIS C 3 245 ? -10.902 61.736 125.726 1.00 12.62 ? 245 HIS C CA 1 +ATOM 5101 C C . HIS C 3 245 ? -10.770 62.101 124.240 1.00 11.89 ? 245 HIS C C 1 +ATOM 5102 O O . HIS C 3 245 ? -11.548 61.614 123.433 1.00 12.14 ? 245 HIS C O 1 +ATOM 5103 C CB . HIS C 3 245 ? -9.834 60.692 126.138 1.00 12.33 ? 245 HIS C CB 1 +ATOM 5104 C CG . HIS C 3 245 ? -9.862 59.447 125.301 1.00 13.51 ? 245 HIS C CG 1 +ATOM 5105 N ND1 . HIS C 3 245 ? -10.213 58.210 125.808 1.00 13.99 ? 245 HIS C ND1 1 +ATOM 5106 C CD2 . HIS C 3 245 ? -9.591 59.250 123.988 1.00 13.15 ? 245 HIS C CD2 1 +ATOM 5107 C CE1 . HIS C 3 245 ? -10.145 57.304 124.847 1.00 13.18 ? 245 HIS C CE1 1 +ATOM 5108 N NE2 . HIS C 3 245 ? -9.771 57.910 123.733 1.00 13.98 ? 245 HIS C NE2 1 +ATOM 5109 N N . CYS C 3 246 ? -9.811 62.982 123.909 1.00 11.37 ? 246 CYS C N 1 +ATOM 5110 C CA . CYS C 3 246 ? -9.489 63.388 122.535 1.00 10.59 ? 246 CYS C CA 1 +ATOM 5111 C C . CYS C 3 246 ? -8.738 62.272 121.832 1.00 9.44 ? 246 CYS C C 1 +ATOM 5112 O O . CYS C 3 246 ? -8.165 61.399 122.490 1.00 9.58 ? 246 CYS C O 1 +ATOM 5113 C CB . CYS C 3 246 ? -8.597 64.616 122.568 1.00 11.04 ? 246 CYS C CB 1 +ATOM 5114 S SG . CYS C 3 246 ? -9.386 66.071 123.310 1.00 18.31 ? 246 CYS C SG 1 +ATOM 5115 N N . PRO C 3 247 ? -8.736 62.268 120.504 1.00 8.52 ? 247 PRO C N 1 +ATOM 5116 C CA . PRO C 3 247 ? -7.931 61.303 119.764 1.00 8.73 ? 247 PRO C CA 1 +ATOM 5117 C C . PRO C 3 247 ? -6.414 61.521 119.975 1.00 9.44 ? 247 PRO C C 1 +ATOM 5118 O O . PRO C 3 247 ? -5.918 62.658 119.964 1.00 9.60 ? 247 PRO C O 1 +ATOM 5119 C CB . PRO C 3 247 ? -8.342 61.582 118.323 1.00 8.68 ? 247 PRO C CB 1 +ATOM 5120 C CG . PRO C 3 247 ? -9.652 62.281 118.447 1.00 6.58 ? 247 PRO C CG 1 +ATOM 5121 C CD . PRO C 3 247 ? -9.500 63.133 119.591 1.00 7.95 ? 247 PRO C CD 1 +ATOM 5122 N N . ALA C 3 248 ? -5.689 60.432 120.199 1.00 10.05 ? 248 ALA C N 1 +ATOM 5123 C CA . ALA C 3 248 ? -4.261 60.498 120.490 1.00 10.73 ? 248 ALA C CA 1 +ATOM 5124 C C . ALA C 3 248 ? -3.497 61.121 119.337 1.00 11.58 ? 248 ALA C C 1 +ATOM 5125 O O . ALA C 3 248 ? -3.850 60.940 118.177 1.00 11.78 ? 248 ALA C O 1 +ATOM 5126 C CB . ALA C 3 248 ? -3.741 59.122 120.776 1.00 10.96 ? 248 ALA C CB 1 +ATOM 5127 N N . LEU C 3 249 ? -2.451 61.870 119.651 1.00 12.22 ? 249 LEU C N 1 +ATOM 5128 C CA . LEU C 3 249 ? -1.706 62.552 118.609 1.00 12.57 ? 249 LEU C CA 1 +ATOM 5129 C C . LEU C 3 249 ? -0.990 61.517 117.735 1.00 12.44 ? 249 LEU C C 1 +ATOM 5130 O O . LEU C 3 249 ? -0.516 61.805 116.632 1.00 12.76 ? 249 LEU C O 1 +ATOM 5131 C CB . LEU C 3 249 ? -0.712 63.514 119.244 1.00 12.35 ? 249 LEU C CB 1 +ATOM 5132 C CG . LEU C 3 249 ? -1.210 64.919 119.565 1.00 14.01 ? 249 LEU C CG 1 +ATOM 5133 C CD1 . LEU C 3 249 ? 0.001 65.738 120.062 1.00 14.20 ? 249 LEU C CD1 1 +ATOM 5134 C CD2 . LEU C 3 249 ? -1.914 65.589 118.338 1.00 12.47 ? 249 LEU C CD2 1 +ATOM 5135 N N . VAL C 3 250 ? -0.964 60.301 118.236 1.00 12.34 ? 250 VAL C N 1 +ATOM 5136 C CA . VAL C 3 250 ? -0.175 59.243 117.644 1.00 12.72 ? 250 VAL C CA 1 +ATOM 5137 C C . VAL C 3 250 ? -0.915 57.876 117.688 1.00 12.89 ? 250 VAL C C 1 +ATOM 5138 O O . VAL C 3 250 ? -1.729 57.618 118.573 1.00 13.42 ? 250 VAL C O 1 +ATOM 5139 C CB . VAL C 3 250 ? 1.189 59.199 118.374 1.00 12.73 ? 250 VAL C CB 1 +ATOM 5140 C CG1 . VAL C 3 250 ? 1.289 58.010 119.306 1.00 11.17 ? 250 VAL C CG1 1 +ATOM 5141 C CG2 . VAL C 3 250 ? 2.353 59.276 117.401 1.00 13.24 ? 250 VAL C CG2 1 +ATOM 5142 N N . THR C 3 251 ? -0.668 57.050 116.685 1.00 12.86 ? 251 THR C N 1 +ATOM 5143 C CA . THR C 3 251 ? -1.070 55.663 116.663 1.00 13.07 ? 251 THR C CA 1 +ATOM 5144 C C . THR C 3 251 ? 0.237 54.905 116.771 1.00 12.76 ? 251 THR C C 1 +ATOM 5145 O O . THR C 3 251 ? 1.311 55.440 116.460 1.00 13.01 ? 251 THR C O 1 +ATOM 5146 C CB . THR C 3 251 ? -1.743 55.264 115.309 1.00 13.42 ? 251 THR C CB 1 +ATOM 5147 O OG1 . THR C 3 251 ? -2.407 56.381 114.714 1.00 14.51 ? 251 THR C OG1 1 +ATOM 5148 C CG2 . THR C 3 251 ? -2.892 54.238 115.527 1.00 15.01 ? 251 THR C CG2 1 +ATOM 5149 N N . TYR C 3 252 ? 0.168 53.649 117.177 1.00 11.81 ? 252 TYR C N 1 +ATOM 5150 C CA . TYR C 3 252 ? 1.382 52.897 117.291 1.00 10.89 ? 252 TYR C CA 1 +ATOM 5151 C C . TYR C 3 252 ? 1.406 51.841 116.179 1.00 11.26 ? 252 TYR C C 1 +ATOM 5152 O O . TYR C 3 252 ? 0.353 51.363 115.742 1.00 11.56 ? 252 TYR C O 1 +ATOM 5153 C CB . TYR C 3 252 ? 1.548 52.350 118.728 1.00 10.50 ? 252 TYR C CB 1 +ATOM 5154 C CG . TYR C 3 252 ? 1.713 53.460 119.747 1.00 9.19 ? 252 TYR C CG 1 +ATOM 5155 C CD1 . TYR C 3 252 ? 0.669 53.794 120.614 1.00 8.08 ? 252 TYR C CD1 1 +ATOM 5156 C CD2 . TYR C 3 252 ? 2.892 54.225 119.803 1.00 7.92 ? 252 TYR C CD2 1 +ATOM 5157 C CE1 . TYR C 3 252 ? 0.798 54.842 121.530 1.00 6.84 ? 252 TYR C CE1 1 +ATOM 5158 C CE2 . TYR C 3 252 ? 3.036 55.275 120.713 1.00 6.23 ? 252 TYR C CE2 1 +ATOM 5159 C CZ . TYR C 3 252 ? 1.984 55.571 121.575 1.00 7.59 ? 252 TYR C CZ 1 +ATOM 5160 O OH . TYR C 3 252 ? 2.094 56.603 122.474 1.00 8.26 ? 252 TYR C OH 1 +ATOM 5161 N N . ASN C 3 253 ? 2.600 51.541 115.674 1.00 10.81 ? 253 ASN C N 1 +ATOM 5162 C CA . ASN C 3 253 ? 2.771 50.447 114.760 1.00 10.96 ? 253 ASN C CA 1 +ATOM 5163 C C . ASN C 3 253 ? 2.337 49.195 115.534 1.00 10.75 ? 253 ASN C C 1 +ATOM 5164 O O . ASN C 3 253 ? 2.805 48.948 116.640 1.00 10.34 ? 253 ASN C O 1 +ATOM 5165 C CB . ASN C 3 253 ? 4.242 50.389 114.319 1.00 11.22 ? 253 ASN C CB 1 +ATOM 5166 C CG . ASN C 3 253 ? 4.509 49.375 113.201 1.00 11.86 ? 253 ASN C CG 1 +ATOM 5167 O OD1 . ASN C 3 253 ? 5.043 49.733 112.141 1.00 11.83 ? 253 ASN C OD1 1 +ATOM 5168 N ND2 . ASN C 3 253 ? 4.184 48.103 113.448 1.00 11.58 ? 253 ASN C ND2 1 +ATOM 5169 N N . THR C 3 254 ? 1.414 48.435 114.957 1.00 10.87 ? 254 THR C N 1 +ATOM 5170 C CA . THR C 3 254 ? 0.878 47.210 115.571 1.00 10.80 ? 254 THR C CA 1 +ATOM 5171 C C . THR C 3 254 ? 1.907 46.063 115.783 1.00 10.90 ? 254 THR C C 1 +ATOM 5172 O O . THR C 3 254 ? 1.746 45.244 116.683 1.00 10.78 ? 254 THR C O 1 +ATOM 5173 C CB . THR C 3 254 ? -0.400 46.765 114.788 1.00 10.88 ? 254 THR C CB 1 +ATOM 5174 O OG1 . THR C 3 254 ? -1.521 47.540 115.253 1.00 9.45 ? 254 THR C OG1 1 +ATOM 5175 C CG2 . THR C 3 254 ? -0.789 45.305 115.056 1.00 9.69 ? 254 THR C CG2 1 +ATOM 5176 N N . ASP C 3 255 ? 2.968 46.024 114.984 1.00 10.96 ? 255 ASP C N 1 +ATOM 5177 C CA . ASP C 3 255 ? 4.059 45.087 115.253 1.00 11.32 ? 255 ASP C CA 1 +ATOM 5178 C C . ASP C 3 255 ? 5.227 45.711 116.015 1.00 11.38 ? 255 ASP C C 1 +ATOM 5179 O O . ASP C 3 255 ? 5.663 45.162 117.021 1.00 11.61 ? 255 ASP C O 1 +ATOM 5180 C CB . ASP C 3 255 ? 4.572 44.434 113.966 1.00 11.30 ? 255 ASP C CB 1 +ATOM 5181 C CG . ASP C 3 255 ? 3.660 43.341 113.468 1.00 11.62 ? 255 ASP C CG 1 +ATOM 5182 O OD1 . ASP C 3 255 ? 3.932 42.137 113.736 1.00 11.50 ? 255 ASP C OD1 1 +ATOM 5183 O OD2 . ASP C 3 255 ? 2.640 43.607 112.796 1.00 12.01 ? 255 ASP C OD2 1 +ATOM 5184 N N . THR C 3 256 ? 5.727 46.849 115.532 1.00 11.65 ? 256 THR C N 1 +ATOM 5185 C CA . THR C 3 256 ? 6.959 47.471 116.052 1.00 11.80 ? 256 THR C CA 1 +ATOM 5186 C C . THR C 3 256 ? 6.731 48.384 117.267 1.00 11.31 ? 256 THR C C 1 +ATOM 5187 O O . THR C 3 256 ? 7.507 48.366 118.226 1.00 11.07 ? 256 THR C O 1 +ATOM 5188 C CB . THR C 3 256 ? 7.718 48.243 114.908 1.00 12.08 ? 256 THR C CB 1 +ATOM 5189 O OG1 . THR C 3 256 ? 8.004 47.346 113.828 1.00 12.46 ? 256 THR C OG1 1 +ATOM 5190 C CG2 . THR C 3 256 ? 9.131 48.663 115.343 1.00 12.32 ? 256 THR C CG2 1 +ATOM 5191 N N . PHE C 3 257 ? 5.666 49.172 117.197 1.00 10.74 ? 257 PHE C N 1 +ATOM 5192 C CA . PHE C 3 257 ? 5.292 50.155 118.213 1.00 10.66 ? 257 PHE C CA 1 +ATOM 5193 C C . PHE C 3 257 ? 5.972 51.516 118.073 1.00 11.20 ? 257 PHE C C 1 +ATOM 5194 O O . PHE C 3 257 ? 6.090 52.293 119.038 1.00 11.02 ? 257 PHE C O 1 +ATOM 5195 C CB . PHE C 3 257 ? 5.295 49.569 119.639 1.00 10.27 ? 257 PHE C CB 1 +ATOM 5196 C CG . PHE C 3 257 ? 4.002 48.896 119.978 1.00 8.02 ? 257 PHE C CG 1 +ATOM 5197 C CD1 . PHE C 3 257 ? 3.767 47.585 119.577 1.00 5.16 ? 257 PHE C CD1 1 +ATOM 5198 C CD2 . PHE C 3 257 ? 2.979 49.600 120.616 1.00 5.42 ? 257 PHE C CD2 1 +ATOM 5199 C CE1 . PHE C 3 257 ? 2.553 46.988 119.826 1.00 4.07 ? 257 PHE C CE1 1 +ATOM 5200 C CE2 . PHE C 3 257 ? 1.766 48.993 120.889 1.00 2.41 ? 257 PHE C CE2 1 +ATOM 5201 C CZ . PHE C 3 257 ? 1.547 47.699 120.487 1.00 2.15 ? 257 PHE C CZ 1 +ATOM 5202 N N . GLU C 3 258 ? 6.358 51.807 116.830 1.00 11.87 ? 258 GLU C N 1 +ATOM 5203 C CA . GLU C 3 258 ? 6.799 53.142 116.429 1.00 12.44 ? 258 GLU C CA 1 +ATOM 5204 C C . GLU C 3 258 ? 5.623 54.092 116.412 1.00 12.40 ? 258 GLU C C 1 +ATOM 5205 O O . GLU C 3 258 ? 4.503 53.710 116.106 1.00 11.89 ? 258 GLU C O 1 +ATOM 5206 C CB . GLU C 3 258 ? 7.478 53.140 115.050 1.00 12.23 ? 258 GLU C CB 1 +ATOM 5207 C CG . GLU C 3 258 ? 8.609 52.134 114.889 1.00 13.87 ? 258 GLU C CG 1 +ATOM 5208 C CD . GLU C 3 258 ? 9.639 52.169 116.019 1.00 15.02 ? 258 GLU C CD 1 +ATOM 5209 O OE1 . GLU C 3 258 ? 10.849 52.331 115.719 1.00 15.33 ? 258 GLU C OE1 1 +ATOM 5210 O OE2 . GLU C 3 258 ? 9.248 52.018 117.203 1.00 14.10 ? 258 GLU C OE2 1 +ATOM 5211 N N . SER C 3 259 ? 5.911 55.337 116.749 1.00 13.12 ? 259 SER C N 1 +ATOM 5212 C CA . SER C 3 259 ? 4.935 56.393 116.701 1.00 14.06 ? 259 SER C CA 1 +ATOM 5213 C C . SER C 3 259 ? 4.590 56.712 115.244 1.00 14.57 ? 259 SER C C 1 +ATOM 5214 O O . SER C 3 259 ? 5.470 56.912 114.403 1.00 14.35 ? 259 SER C O 1 +ATOM 5215 C CB . SER C 3 259 ? 5.466 57.616 117.460 1.00 14.23 ? 259 SER C CB 1 +ATOM 5216 O OG . SER C 3 259 ? 5.579 57.323 118.851 1.00 14.33 ? 259 SER C OG 1 +ATOM 5217 N N . MET C 3 260 ? 3.290 56.690 114.969 1.00 15.28 ? 260 MET C N 1 +ATOM 5218 C CA . MET C 3 260 ? 2.706 57.123 113.710 1.00 16.04 ? 260 MET C CA 1 +ATOM 5219 C C . MET C 3 260 ? 1.805 58.320 113.992 1.00 16.14 ? 260 MET C C 1 +ATOM 5220 O O . MET C 3 260 ? 0.947 58.249 114.882 1.00 16.02 ? 260 MET C O 1 +ATOM 5221 C CB . MET C 3 260 ? 1.805 56.022 113.168 1.00 16.43 ? 260 MET C CB 1 +ATOM 5222 C CG . MET C 3 260 ? 2.355 55.231 112.031 1.00 18.75 ? 260 MET C CG 1 +ATOM 5223 S SD . MET C 3 260 ? 2.101 53.502 112.411 1.00 21.75 ? 260 MET C SD 1 +ATOM 5224 C CE . MET C 3 260 ? 3.590 52.726 111.467 1.00 19.70 ? 260 MET C CE 1 +ATOM 5225 N N . PRO C 3 261 ? 1.944 59.411 113.246 1.00 16.01 ? 261 PRO C N 1 +ATOM 5226 C CA . PRO C 3 261 ? 1.019 60.538 113.444 1.00 15.96 ? 261 PRO C CA 1 +ATOM 5227 C C . PRO C 3 261 ? -0.448 60.118 113.185 1.00 15.92 ? 261 PRO C C 1 +ATOM 5228 O O . PRO C 3 261 ? -0.775 59.466 112.173 1.00 15.51 ? 261 PRO C O 1 +ATOM 5229 C CB . PRO C 3 261 ? 1.504 61.585 112.423 1.00 16.23 ? 261 PRO C CB 1 +ATOM 5230 C CG . PRO C 3 261 ? 2.897 61.143 112.040 1.00 15.90 ? 261 PRO C CG 1 +ATOM 5231 C CD . PRO C 3 261 ? 2.939 59.665 112.190 1.00 15.31 ? 261 PRO C CD 1 +ATOM 5232 N N . ASN C 3 262 ? -1.325 60.450 114.125 1.00 15.75 ? 262 ASN C N 1 +ATOM 5233 C CA . ASN C 3 262 ? -2.745 60.336 113.865 1.00 15.67 ? 262 ASN C CA 1 +ATOM 5234 C C . ASN C 3 262 ? -3.184 61.609 113.141 1.00 16.62 ? 262 ASN C C 1 +ATOM 5235 O O . ASN C 3 262 ? -2.958 62.744 113.627 1.00 16.69 ? 262 ASN C O 1 +ATOM 5236 C CB . ASN C 3 262 ? -3.527 60.134 115.155 1.00 15.23 ? 262 ASN C CB 1 +ATOM 5237 C CG . ASN C 3 262 ? -4.978 59.721 114.922 1.00 14.96 ? 262 ASN C CG 1 +ATOM 5238 O OD1 . ASN C 3 262 ? -5.451 59.645 113.792 1.00 17.15 ? 262 ASN C OD1 1 +ATOM 5239 N ND2 . ASN C 3 262 ? -5.695 59.459 116.010 1.00 14.31 ? 262 ASN C ND2 1 +ATOM 5240 N N . PRO C 3 263 ? -3.787 61.436 111.964 1.00 17.03 ? 263 PRO C N 1 +ATOM 5241 C CA . PRO C 3 263 ? -4.414 62.568 111.261 1.00 17.14 ? 263 PRO C CA 1 +ATOM 5242 C C . PRO C 3 263 ? -5.625 63.043 112.044 1.00 17.11 ? 263 PRO C C 1 +ATOM 5243 O O . PRO C 3 263 ? -5.836 64.232 112.122 1.00 17.58 ? 263 PRO C O 1 +ATOM 5244 C CB . PRO C 3 263 ? -4.832 61.973 109.922 1.00 17.47 ? 263 PRO C CB 1 +ATOM 5245 C CG . PRO C 3 263 ? -4.061 60.669 109.832 1.00 17.20 ? 263 PRO C CG 1 +ATOM 5246 C CD . PRO C 3 263 ? -3.922 60.163 111.228 1.00 16.62 ? 263 PRO C CD 1 +ATOM 5247 N N . GLU C 3 264 ? -6.382 62.140 112.648 1.00 17.34 ? 264 GLU C N 1 +ATOM 5248 C CA . GLU C 3 264 ? -7.412 62.545 113.605 1.00 18.19 ? 264 GLU C CA 1 +ATOM 5249 C C . GLU C 3 264 ? -6.892 63.032 114.986 1.00 17.45 ? 264 GLU C C 1 +ATOM 5250 O O . GLU C 3 264 ? -7.694 63.428 115.830 1.00 17.71 ? 264 GLU C O 1 +ATOM 5251 C CB . GLU C 3 264 ? -8.394 61.401 113.857 1.00 18.88 ? 264 GLU C CB 1 +ATOM 5252 C CG . GLU C 3 264 ? -9.132 60.841 112.651 1.00 23.47 ? 264 GLU C CG 1 +ATOM 5253 C CD . GLU C 3 264 ? -9.799 59.493 112.983 1.00 30.73 ? 264 GLU C CD 1 +ATOM 5254 O OE1 . GLU C 3 264 ? -10.476 59.382 114.060 1.00 33.25 ? 264 GLU C OE1 1 +ATOM 5255 O OE2 . GLU C 3 264 ? -9.640 58.526 112.184 1.00 31.83 ? 264 GLU C OE2 1 +ATOM 5256 N N . GLY C 3 265 ? -5.582 62.996 115.240 1.00 16.43 ? 265 GLY C N 1 +ATOM 5257 C CA . GLY C 3 265 ? -5.072 63.326 116.564 1.00 15.41 ? 265 GLY C CA 1 +ATOM 5258 C C . GLY C 3 265 ? -5.390 64.749 116.970 1.00 14.90 ? 265 GLY C C 1 +ATOM 5259 O O . GLY C 3 265 ? -5.530 65.585 116.092 1.00 15.44 ? 265 GLY C O 1 +ATOM 5260 N N . ARG C 3 266 ? -5.512 65.031 118.272 1.00 13.89 ? 266 ARG C N 1 +ATOM 5261 C CA . ARG C 3 266 ? -5.890 66.359 118.750 1.00 13.26 ? 266 ARG C CA 1 +ATOM 5262 C C . ARG C 3 266 ? -5.399 66.589 120.156 1.00 13.29 ? 266 ARG C C 1 +ATOM 5263 O O . ARG C 3 266 ? -5.221 65.651 120.935 1.00 14.21 ? 266 ARG C O 1 +ATOM 5264 C CB . ARG C 3 266 ? -7.404 66.578 118.722 1.00 13.60 ? 266 ARG C CB 1 +ATOM 5265 C CG . ARG C 3 266 ? -8.045 66.511 117.310 1.00 13.57 ? 266 ARG C CG 1 +ATOM 5266 C CD . ARG C 3 266 ? -9.122 67.547 117.054 1.00 14.18 ? 266 ARG C CD 1 +ATOM 5267 N NE . ARG C 3 266 ? -9.666 67.492 115.699 1.00 14.64 ? 266 ARG C NE 1 +ATOM 5268 C CZ . ARG C 3 266 ? -9.025 67.031 114.624 1.00 12.98 ? 266 ARG C CZ 1 +ATOM 5269 N NH1 . ARG C 3 266 ? -7.796 66.561 114.696 1.00 11.98 ? 266 ARG C NH1 1 +ATOM 5270 N NH2 . ARG C 3 266 ? -9.640 67.035 113.461 1.00 13.78 ? 266 ARG C NH2 1 +ATOM 5271 N N . TYR C 3 267 ? -5.184 67.852 120.478 1.00 12.48 ? 267 TYR C N 1 +ATOM 5272 C CA . TYR C 3 267 ? -4.625 68.257 121.751 1.00 11.81 ? 267 TYR C CA 1 +ATOM 5273 C C . TYR C 3 267 ? -5.771 68.603 122.647 1.00 11.17 ? 267 TYR C C 1 +ATOM 5274 O O . TYR C 3 267 ? -6.804 69.060 122.181 1.00 9.94 ? 267 TYR C O 1 +ATOM 5275 C CB . TYR C 3 267 ? -3.820 69.523 121.551 1.00 12.04 ? 267 TYR C CB 1 +ATOM 5276 C CG . TYR C 3 267 ? -2.532 69.334 120.792 1.00 13.01 ? 267 TYR C CG 1 +ATOM 5277 C CD1 . TYR C 3 267 ? -2.494 69.314 119.389 1.00 11.77 ? 267 TYR C CD1 1 +ATOM 5278 C CD2 . TYR C 3 267 ? -1.341 69.191 121.486 1.00 14.03 ? 267 TYR C CD2 1 +ATOM 5279 C CE1 . TYR C 3 267 ? -1.282 69.159 118.714 1.00 13.42 ? 267 TYR C CE1 1 +ATOM 5280 C CE2 . TYR C 3 267 ? -0.141 69.037 120.829 1.00 14.44 ? 267 TYR C CE2 1 +ATOM 5281 C CZ . TYR C 3 267 ? -0.107 69.019 119.459 1.00 13.89 ? 267 TYR C CZ 1 +ATOM 5282 O OH . TYR C 3 267 ? 1.122 68.858 118.881 1.00 14.24 ? 267 TYR C OH 1 +ATOM 5283 N N . THR C 3 268 ? -5.606 68.417 123.941 1.00 11.23 ? 268 THR C N 1 +ATOM 5284 C CA . THR C 3 268 ? -6.696 68.795 124.816 1.00 11.94 ? 268 THR C CA 1 +ATOM 5285 C C . THR C 3 268 ? -6.451 70.195 125.347 1.00 12.06 ? 268 THR C C 1 +ATOM 5286 O O . THR C 3 268 ? -5.440 70.433 125.978 1.00 13.16 ? 268 THR C O 1 +ATOM 5287 C CB . THR C 3 268 ? -6.835 67.824 125.959 1.00 11.94 ? 268 THR C CB 1 +ATOM 5288 O OG1 . THR C 3 268 ? -5.695 67.959 126.813 1.00 12.39 ? 268 THR C OG1 1 +ATOM 5289 C CG2 . THR C 3 268 ? -6.819 66.387 125.445 1.00 9.73 ? 268 THR C CG2 1 +ATOM 5290 N N . PHE C 3 269 ? -7.372 71.103 125.073 1.00 11.52 ? 269 PHE C N 1 +ATOM 5291 C CA . PHE C 3 269 ? -7.310 72.455 125.570 1.00 11.70 ? 269 PHE C CA 1 +ATOM 5292 C C . PHE C 3 269 ? -8.571 72.643 126.351 1.00 11.92 ? 269 PHE C C 1 +ATOM 5293 O O . PHE C 3 269 ? -9.657 72.610 125.776 1.00 11.20 ? 269 PHE C O 1 +ATOM 5294 C CB . PHE C 3 269 ? -7.269 73.434 124.412 1.00 11.55 ? 269 PHE C CB 1 +ATOM 5295 C CG . PHE C 3 269 ? -7.342 74.850 124.818 1.00 12.49 ? 269 PHE C CG 1 +ATOM 5296 C CD1 . PHE C 3 269 ? -6.459 75.369 125.742 1.00 14.61 ? 269 PHE C CD1 1 +ATOM 5297 C CD2 . PHE C 3 269 ? -8.286 75.699 124.238 1.00 16.06 ? 269 PHE C CD2 1 +ATOM 5298 C CE1 . PHE C 3 269 ? -6.525 76.730 126.101 1.00 16.14 ? 269 PHE C CE1 1 +ATOM 5299 C CE2 . PHE C 3 269 ? -8.366 77.048 124.577 1.00 15.93 ? 269 PHE C CE2 1 +ATOM 5300 C CZ . PHE C 3 269 ? -7.487 77.564 125.511 1.00 16.98 ? 269 PHE C CZ 1 +ATOM 5301 N N . GLY C 3 270 ? -8.435 72.837 127.661 1.00 12.28 ? 270 GLY C N 1 +ATOM 5302 C CA . GLY C 3 270 ? -9.594 72.864 128.527 1.00 13.05 ? 270 GLY C CA 1 +ATOM 5303 C C . GLY C 3 270 ? -10.459 71.646 128.294 1.00 14.01 ? 270 GLY C C 1 +ATOM 5304 O O . GLY C 3 270 ? -9.981 70.512 128.164 1.00 14.62 ? 270 GLY C O 1 +ATOM 5305 N N . ALA C 3 271 ? -11.757 71.851 128.206 1.00 14.73 ? 271 ALA C N 1 +ATOM 5306 C CA . ALA C 3 271 ? -12.617 70.702 127.975 1.00 15.10 ? 271 ALA C CA 1 +ATOM 5307 C C . ALA C 3 271 ? -12.951 70.513 126.479 1.00 15.70 ? 271 ALA C C 1 +ATOM 5308 O O . ALA C 3 271 ? -14.049 70.085 126.133 1.00 16.84 ? 271 ALA C O 1 +ATOM 5309 C CB . ALA C 3 271 ? -13.860 70.804 128.840 1.00 14.92 ? 271 ALA C CB 1 +ATOM 5310 N N . SER C 3 272 ? -11.975 70.794 125.616 1.00 15.54 ? 272 SER C N 1 +ATOM 5311 C CA . SER C 3 272 ? -12.128 70.835 124.163 1.00 15.80 ? 272 SER C CA 1 +ATOM 5312 C C . SER C 3 272 ? -11.026 70.069 123.455 1.00 15.30 ? 272 SER C C 1 +ATOM 5313 O O . SER C 3 272 ? -9.946 69.846 124.004 1.00 13.86 ? 272 SER C O 1 +ATOM 5314 C CB . SER C 3 272 ? -11.998 72.285 123.674 1.00 16.36 ? 272 SER C CB 1 +ATOM 5315 O OG . SER C 3 272 ? -13.267 72.899 123.571 1.00 19.82 ? 272 SER C OG 1 +ATOM 5316 N N . CYS C 3 273 ? -11.296 69.694 122.207 1.00 15.72 ? 273 CYS C N 1 +ATOM 5317 C CA . CYS C 3 273 ? -10.309 68.985 121.398 1.00 15.99 ? 273 CYS C CA 1 +ATOM 5318 C C . CYS C 3 273 ? -10.045 69.861 120.268 1.00 15.38 ? 273 CYS C C 1 +ATOM 5319 O O . CYS C 3 273 ? -10.957 70.257 119.552 1.00 16.95 ? 273 CYS C O 1 +ATOM 5320 C CB . CYS C 3 273 ? -10.805 67.649 120.859 1.00 16.40 ? 273 CYS C CB 1 +ATOM 5321 S SG . CYS C 3 273 ? -11.078 66.489 122.178 1.00 18.66 ? 273 CYS C SG 1 +ATOM 5322 N N . VAL C 3 274 ? -8.772 70.094 120.053 1.00 14.36 ? 274 VAL C N 1 +ATOM 5323 C CA . VAL C 3 274 ? -8.343 71.208 119.261 1.00 13.09 ? 274 VAL C CA 1 +ATOM 5324 C C . VAL C 3 274 ? -7.282 70.610 118.326 1.00 12.59 ? 274 VAL C C 1 +ATOM 5325 O O . VAL C 3 274 ? -6.658 69.625 118.685 1.00 12.82 ? 274 VAL C O 1 +ATOM 5326 C CB . VAL C 3 274 ? -7.891 72.268 120.301 1.00 12.86 ? 274 VAL C CB 1 +ATOM 5327 C CG1 . VAL C 3 274 ? -6.499 72.764 120.078 1.00 12.29 ? 274 VAL C CG1 1 +ATOM 5328 C CG2 . VAL C 3 274 ? -8.943 73.376 120.449 1.00 11.48 ? 274 VAL C CG2 1 +ATOM 5329 N N . THR C 3 275 ? -7.141 71.140 117.121 1.00 12.18 ? 275 THR C N 1 +ATOM 5330 C CA . THR C 3 275 ? -6.150 70.667 116.150 1.00 12.52 ? 275 THR C CA 1 +ATOM 5331 C C . THR C 3 275 ? -4.749 71.222 116.444 1.00 11.72 ? 275 THR C C 1 +ATOM 5332 O O . THR C 3 275 ? -3.729 70.707 115.988 1.00 10.90 ? 275 THR C O 1 +ATOM 5333 C CB . THR C 3 275 ? -6.579 71.078 114.701 1.00 13.15 ? 275 THR C CB 1 +ATOM 5334 O OG1 . THR C 3 275 ? -7.883 70.544 114.411 1.00 14.14 ? 275 THR C OG1 1 +ATOM 5335 C CG2 . THR C 3 275 ? -5.676 70.407 113.627 1.00 14.99 ? 275 THR C CG2 1 +ATOM 5336 N N . ALA C 3 276 ? -4.723 72.303 117.200 1.00 11.40 ? 276 ALA C N 1 +ATOM 5337 C CA . ALA C 3 276 ? -3.501 73.057 117.470 1.00 10.92 ? 276 ALA C CA 1 +ATOM 5338 C C . ALA C 3 276 ? -3.781 73.860 118.698 1.00 10.02 ? 276 ALA C C 1 +ATOM 5339 O O . ALA C 3 276 ? -4.862 74.454 118.831 1.00 9.61 ? 276 ALA C O 1 +ATOM 5340 C CB . ALA C 3 276 ? -3.152 74.000 116.304 1.00 10.38 ? 276 ALA C CB 1 +ATOM 5341 N N . CYS C 3 277 ? -2.809 73.870 119.590 1.00 9.49 ? 277 CYS C N 1 +ATOM 5342 C CA . CYS C 3 277 ? -2.844 74.752 120.735 1.00 9.53 ? 277 CYS C CA 1 +ATOM 5343 C C . CYS C 3 277 ? -3.080 76.184 120.325 1.00 9.03 ? 277 CYS C C 1 +ATOM 5344 O O . CYS C 3 277 ? -2.536 76.674 119.316 1.00 8.38 ? 277 CYS C O 1 +ATOM 5345 C CB . CYS C 3 277 ? -1.565 74.618 121.548 1.00 9.71 ? 277 CYS C CB 1 +ATOM 5346 S SG . CYS C 3 277 ? -1.614 72.999 122.312 1.00 11.85 ? 277 CYS C SG 1 +ATOM 5347 N N . PRO C 3 278 ? -3.930 76.839 121.112 1.00 8.93 ? 278 PRO C N 1 +ATOM 5348 C CA . PRO C 3 278 ? -4.184 78.270 120.964 1.00 8.38 ? 278 PRO C CA 1 +ATOM 5349 C C . PRO C 3 278 ? -2.864 79.006 121.047 1.00 8.03 ? 278 PRO C C 1 +ATOM 5350 O O . PRO C 3 278 ? -1.955 78.579 121.758 1.00 7.52 ? 278 PRO C O 1 +ATOM 5351 C CB . PRO C 3 278 ? -5.041 78.615 122.181 1.00 8.04 ? 278 PRO C CB 1 +ATOM 5352 C CG . PRO C 3 278 ? -5.586 77.352 122.669 1.00 8.90 ? 278 PRO C CG 1 +ATOM 5353 C CD . PRO C 3 278 ? -4.683 76.245 122.232 1.00 8.87 ? 278 PRO C CD 1 +ATOM 5354 N N . TYR C 3 279 ? -2.788 80.130 120.353 1.00 8.38 ? 279 TYR C N 1 +ATOM 5355 C CA . TYR C 3 279 ? -1.537 80.862 120.190 1.00 8.34 ? 279 TYR C CA 1 +ATOM 5356 C C . TYR C 3 279 ? -0.535 80.837 121.342 1.00 8.99 ? 279 TYR C C 1 +ATOM 5357 O O . TYR C 3 279 ? 0.655 80.602 121.086 1.00 9.78 ? 279 TYR C O 1 +ATOM 5358 C CB . TYR C 3 279 ? -1.773 82.315 119.809 1.00 7.04 ? 279 TYR C CB 1 +ATOM 5359 C CG . TYR C 3 279 ? -0.483 83.071 119.719 1.00 6.55 ? 279 TYR C CG 1 +ATOM 5360 C CD1 . TYR C 3 279 ? 0.395 82.856 118.648 1.00 5.73 ? 279 TYR C CD1 1 +ATOM 5361 C CD2 . TYR C 3 279 ? -0.117 83.994 120.700 1.00 5.21 ? 279 TYR C CD2 1 +ATOM 5362 C CE1 . TYR C 3 279 ? 1.581 83.536 118.553 1.00 3.22 ? 279 TYR C CE1 1 +ATOM 5363 C CE2 . TYR C 3 279 ? 1.074 84.679 120.608 1.00 3.98 ? 279 TYR C CE2 1 +ATOM 5364 C CZ . TYR C 3 279 ? 1.918 84.447 119.529 1.00 3.43 ? 279 TYR C CZ 1 +ATOM 5365 O OH . TYR C 3 279 ? 3.107 85.137 119.412 1.00 3.15 ? 279 TYR C OH 1 +ATOM 5366 N N . ASN C 3 280 ? -0.950 81.137 122.575 1.00 8.51 ? 280 ASN C N 1 +ATOM 5367 C CA . ASN C 3 280 ? 0.090 81.437 123.567 1.00 8.42 ? 280 ASN C CA 1 +ATOM 5368 C C . ASN C 3 280 ? 0.364 80.295 124.528 1.00 8.35 ? 280 ASN C C 1 +ATOM 5369 O O . ASN C 3 280 ? 1.069 80.450 125.520 1.00 8.12 ? 280 ASN C O 1 +ATOM 5370 C CB . ASN C 3 280 ? -0.194 82.772 124.286 1.00 8.60 ? 280 ASN C CB 1 +ATOM 5371 C CG . ASN C 3 280 ? 0.976 83.268 125.111 1.00 7.40 ? 280 ASN C CG 1 +ATOM 5372 O OD1 . ASN C 3 280 ? 2.080 83.458 124.599 1.00 6.43 ? 280 ASN C OD1 1 +ATOM 5373 N ND2 . ASN C 3 280 ? 0.737 83.474 126.405 1.00 5.28 ? 280 ASN C ND2 1 +ATOM 5374 N N . TYR C 3 281 ? -0.179 79.135 124.192 1.00 8.74 ? 281 TYR C N 1 +ATOM 5375 C CA . TYR C 3 281 ? -0.033 77.922 124.978 1.00 8.66 ? 281 TYR C CA 1 +ATOM 5376 C C . TYR C 3 281 ? 1.068 76.989 124.431 1.00 8.86 ? 281 TYR C C 1 +ATOM 5377 O O . TYR C 3 281 ? 1.408 77.015 123.253 1.00 8.06 ? 281 TYR C O 1 +ATOM 5378 C CB . TYR C 3 281 ? -1.366 77.193 124.993 1.00 9.06 ? 281 TYR C CB 1 +ATOM 5379 C CG . TYR C 3 281 ? -2.395 77.803 125.907 1.00 9.79 ? 281 TYR C CG 1 +ATOM 5380 C CD1 . TYR C 3 281 ? -3.128 78.916 125.523 1.00 9.90 ? 281 TYR C CD1 1 +ATOM 5381 C CD2 . TYR C 3 281 ? -2.649 77.240 127.155 1.00 11.22 ? 281 TYR C CD2 1 +ATOM 5382 C CE1 . TYR C 3 281 ? -4.066 79.481 126.369 1.00 12.01 ? 281 TYR C CE1 1 +ATOM 5383 C CE2 . TYR C 3 281 ? -3.586 77.786 128.012 1.00 13.44 ? 281 TYR C CE2 1 +ATOM 5384 C CZ . TYR C 3 281 ? -4.290 78.909 127.626 1.00 13.55 ? 281 TYR C CZ 1 +ATOM 5385 O OH . TYR C 3 281 ? -5.220 79.441 128.504 1.00 14.63 ? 281 TYR C OH 1 +ATOM 5386 N N . LEU C 3 282 ? 1.609 76.150 125.305 1.00 9.27 ? 282 LEU C N 1 +ATOM 5387 C CA . LEU C 3 282 ? 2.626 75.192 124.927 1.00 8.96 ? 282 LEU C CA 1 +ATOM 5388 C C . LEU C 3 282 ? 2.023 73.832 124.627 1.00 9.54 ? 282 LEU C C 1 +ATOM 5389 O O . LEU C 3 282 ? 1.190 73.331 125.375 1.00 9.43 ? 282 LEU C O 1 +ATOM 5390 C CB . LEU C 3 282 ? 3.635 75.041 126.041 1.00 8.73 ? 282 LEU C CB 1 +ATOM 5391 C CG . LEU C 3 282 ? 4.341 76.253 126.625 1.00 7.81 ? 282 LEU C CG 1 +ATOM 5392 C CD1 . LEU C 3 282 ? 4.798 75.934 128.042 1.00 6.96 ? 282 LEU C CD1 1 +ATOM 5393 C CD2 . LEU C 3 282 ? 5.517 76.607 125.786 1.00 6.90 ? 282 LEU C CD2 1 +ATOM 5394 N N . SER C 3 283 ? 2.473 73.243 123.524 1.00 10.87 ? 283 SER C N 1 +ATOM 5395 C CA . SER C 3 283 ? 2.070 71.918 123.087 1.00 12.32 ? 283 SER C CA 1 +ATOM 5396 C C . SER C 3 283 ? 2.855 70.878 123.823 1.00 13.24 ? 283 SER C C 1 +ATOM 5397 O O . SER C 3 283 ? 4.046 71.029 124.030 1.00 14.09 ? 283 SER C O 1 +ATOM 5398 C CB . SER C 3 283 ? 2.338 71.768 121.601 1.00 12.11 ? 283 SER C CB 1 +ATOM 5399 O OG . SER C 3 283 ? 1.297 72.389 120.884 1.00 14.72 ? 283 SER C OG 1 +ATOM 5400 N N . THR C 3 284 ? 2.194 69.803 124.199 1.00 14.85 ? 284 THR C N 1 +ATOM 5401 C CA . THR C 3 284 ? 2.833 68.745 124.970 1.00 16.33 ? 284 THR C CA 1 +ATOM 5402 C C . THR C 3 284 ? 3.044 67.541 124.092 1.00 17.06 ? 284 THR C C 1 +ATOM 5403 O O . THR C 3 284 ? 2.323 67.342 123.128 1.00 16.45 ? 284 THR C O 1 +ATOM 5404 C CB . THR C 3 284 ? 1.915 68.380 126.138 1.00 16.32 ? 284 THR C CB 1 +ATOM 5405 O OG1 . THR C 3 284 ? 2.053 69.379 127.153 1.00 17.04 ? 284 THR C OG1 1 +ATOM 5406 C CG2 . THR C 3 284 ? 2.363 67.143 126.811 1.00 16.84 ? 284 THR C CG2 1 +ATOM 5407 N N . ASP C 3 285 ? 4.046 66.746 124.432 1.00 19.27 ? 285 ASP C N 1 +ATOM 5408 C CA . ASP C 3 285 ? 4.284 65.453 123.783 1.00 21.22 ? 285 ASP C CA 1 +ATOM 5409 C C . ASP C 3 285 ? 3.083 64.522 123.977 1.00 21.39 ? 285 ASP C C 1 +ATOM 5410 O O . ASP C 3 285 ? 2.690 63.783 123.062 1.00 21.41 ? 285 ASP C O 1 +ATOM 5411 C CB . ASP C 3 285 ? 5.563 64.824 124.348 1.00 22.10 ? 285 ASP C CB 1 +ATOM 5412 C CG . ASP C 3 285 ? 6.319 63.988 123.311 1.00 25.23 ? 285 ASP C CG 1 +ATOM 5413 O OD1 . ASP C 3 285 ? 5.769 63.803 122.187 1.00 27.30 ? 285 ASP C OD1 1 +ATOM 5414 O OD2 . ASP C 3 285 ? 7.456 63.469 123.546 1.00 28.46 ? 285 ASP C OD2 1 +ATOM 5415 N N . VAL C 3 286 ? 2.488 64.632 125.168 1.00 21.77 ? 286 VAL C N 1 +ATOM 5416 C CA . VAL C 3 286 ? 1.305 63.903 125.629 1.00 21.92 ? 286 VAL C CA 1 +ATOM 5417 C C . VAL C 3 286 ? -0.026 64.338 124.943 1.00 22.21 ? 286 VAL C C 1 +ATOM 5418 O O . VAL C 3 286 ? -1.132 63.892 125.319 1.00 23.03 ? 286 VAL C O 1 +ATOM 5419 C CB . VAL C 3 286 ? 1.227 64.082 127.196 1.00 22.18 ? 286 VAL C CB 1 +ATOM 5420 C CG1 . VAL C 3 286 ? -0.102 64.692 127.670 1.00 21.88 ? 286 VAL C CG1 1 +ATOM 5421 C CG2 . VAL C 3 286 ? 1.548 62.806 127.928 1.00 22.35 ? 286 VAL C CG2 1 +ATOM 5422 N N . GLY C 3 287 ? 0.060 65.215 123.951 1.00 21.53 ? 287 GLY C N 1 +ATOM 5423 C CA . GLY C 3 287 ? -1.136 65.711 123.286 1.00 20.46 ? 287 GLY C CA 1 +ATOM 5424 C C . GLY C 3 287 ? -2.002 66.687 124.069 1.00 19.87 ? 287 GLY C C 1 +ATOM 5425 O O . GLY C 3 287 ? -3.207 66.685 123.863 1.00 21.14 ? 287 GLY C O 1 +ATOM 5426 N N . SER C 3 288 ? -1.416 67.515 124.939 1.00 18.84 ? 288 SER C N 1 +ATOM 5427 C CA . SER C 3 288 ? -2.150 68.534 125.708 1.00 17.95 ? 288 SER C CA 1 +ATOM 5428 C C . SER C 3 288 ? -1.594 69.934 125.521 1.00 17.44 ? 288 SER C C 1 +ATOM 5429 O O . SER C 3 288 ? -0.500 70.126 124.995 1.00 17.59 ? 288 SER C O 1 +ATOM 5430 C CB . SER C 3 288 ? -2.164 68.206 127.196 1.00 18.12 ? 288 SER C CB 1 +ATOM 5431 O OG . SER C 3 288 ? -0.848 67.961 127.673 1.00 18.60 ? 288 SER C OG 1 +ATOM 5432 N N . CYS C 3 289 ? -2.355 70.919 125.967 1.00 16.87 ? 289 CYS C N 1 +ATOM 5433 C CA . CYS C 3 289 ? -1.986 72.316 125.790 1.00 16.27 ? 289 CYS C CA 1 +ATOM 5434 C C . CYS C 3 289 ? -1.944 72.936 127.138 1.00 16.58 ? 289 CYS C C 1 +ATOM 5435 O O . CYS C 3 289 ? -2.972 72.924 127.819 1.00 17.54 ? 289 CYS C O 1 +ATOM 5436 C CB . CYS C 3 289 ? -3.089 73.040 125.062 1.00 15.87 ? 289 CYS C CB 1 +ATOM 5437 S SG . CYS C 3 289 ? -3.290 72.581 123.366 1.00 14.80 ? 289 CYS C SG 1 +ATOM 5438 N N . THR C 3 290 ? -0.807 73.496 127.535 1.00 16.30 ? 290 THR C N 1 +ATOM 5439 C CA . THR C 3 290 ? -0.691 74.049 128.884 1.00 16.79 ? 290 THR C CA 1 +ATOM 5440 C C . THR C 3 290 ? 0.083 75.341 128.888 1.00 16.43 ? 290 THR C C 1 +ATOM 5441 O O . THR C 3 290 ? 0.260 75.948 127.847 1.00 16.54 ? 290 THR C O 1 +ATOM 5442 C CB . THR C 3 290 ? -0.064 73.024 129.880 1.00 16.98 ? 290 THR C CB 1 +ATOM 5443 O OG1 . THR C 3 290 ? 1.159 72.499 129.352 1.00 17.28 ? 290 THR C OG1 1 +ATOM 5444 C CG2 . THR C 3 290 ? -0.947 71.786 130.011 1.00 18.35 ? 290 THR C CG2 1 +ATOM 5445 N N . LEU C 3 291 ? 0.549 75.747 130.064 1.00 16.41 ? 291 LEU C N 1 +ATOM 5446 C CA . LEU C 3 291 ? 1.187 77.053 130.251 1.00 16.42 ? 291 LEU C CA 1 +ATOM 5447 C C . LEU C 3 291 ? 2.457 76.930 131.067 1.00 16.83 ? 291 LEU C C 1 +ATOM 5448 O O . LEU C 3 291 ? 3.246 77.873 131.176 1.00 16.72 ? 291 LEU C O 1 +ATOM 5449 C CB . LEU C 3 291 ? 0.224 78.032 130.918 1.00 15.76 ? 291 LEU C CB 1 +ATOM 5450 C CG . LEU C 3 291 ? -1.005 78.474 130.118 1.00 14.26 ? 291 LEU C CG 1 +ATOM 5451 C CD1 . LEU C 3 291 ? -2.061 79.003 131.050 1.00 10.73 ? 291 LEU C CD1 1 +ATOM 5452 C CD2 . LEU C 3 291 ? -0.641 79.518 129.029 1.00 13.36 ? 291 LEU C CD2 1 +ATOM 5453 N N . VAL C 3 292 ? 2.619 75.754 131.662 1.00 17.68 ? 292 VAL C N 1 +ATOM 5454 C CA . VAL C 3 292 ? 3.861 75.353 132.303 1.00 18.39 ? 292 VAL C CA 1 +ATOM 5455 C C . VAL C 3 292 ? 4.056 73.955 131.805 1.00 18.61 ? 292 VAL C C 1 +ATOM 5456 O O . VAL C 3 292 ? 3.083 73.234 131.628 1.00 19.04 ? 292 VAL C O 1 +ATOM 5457 C CB . VAL C 3 292 ? 3.736 75.337 133.830 1.00 18.21 ? 292 VAL C CB 1 +ATOM 5458 C CG1 . VAL C 3 292 ? 5.089 75.058 134.470 1.00 18.38 ? 292 VAL C CG1 1 +ATOM 5459 C CG2 . VAL C 3 292 ? 3.172 76.666 134.335 1.00 18.78 ? 292 VAL C CG2 1 +ATOM 5460 N N . CYS C 3 293 ? 5.293 73.574 131.547 1.00 19.38 ? 293 CYS C N 1 +ATOM 5461 C CA . CYS C 3 293 ? 5.567 72.232 131.047 1.00 20.74 ? 293 CYS C CA 1 +ATOM 5462 C C . CYS C 3 293 ? 5.259 71.160 132.120 1.00 21.55 ? 293 CYS C C 1 +ATOM 5463 O O . CYS C 3 293 ? 5.138 71.486 133.311 1.00 21.73 ? 293 CYS C O 1 +ATOM 5464 C CB . CYS C 3 293 ? 7.012 72.145 130.546 1.00 20.55 ? 293 CYS C CB 1 +ATOM 5465 S SG . CYS C 3 293 ? 7.241 72.742 128.833 1.00 22.00 ? 293 CYS C SG 1 +ATOM 5466 N N . PRO C 3 294 ? 5.074 69.902 131.712 1.00 22.10 ? 294 PRO C N 1 +ATOM 5467 C CA . PRO C 3 294 ? 4.909 68.810 132.683 1.00 22.33 ? 294 PRO C CA 1 +ATOM 5468 C C . PRO C 3 294 ? 6.275 68.353 133.195 1.00 22.64 ? 294 PRO C C 1 +ATOM 5469 O O . PRO C 3 294 ? 7.273 68.747 132.590 1.00 22.56 ? 294 PRO C O 1 +ATOM 5470 C CB . PRO C 3 294 ? 4.229 67.704 131.863 1.00 22.58 ? 294 PRO C CB 1 +ATOM 5471 C CG . PRO C 3 294 ? 3.949 68.327 130.479 1.00 22.56 ? 294 PRO C CG 1 +ATOM 5472 C CD . PRO C 3 294 ? 4.971 69.418 130.322 1.00 22.24 ? 294 PRO C CD 1 +ATOM 5473 N N . LEU C 3 295 ? 6.307 67.559 134.275 1.00 22.76 ? 295 LEU C N 1 +ATOM 5474 C CA . LEU C 3 295 ? 7.546 67.059 134.907 1.00 22.81 ? 295 LEU C CA 1 +ATOM 5475 C C . LEU C 3 295 ? 8.633 66.600 133.909 1.00 22.75 ? 295 LEU C C 1 +ATOM 5476 O O . LEU C 3 295 ? 8.305 66.110 132.821 1.00 22.74 ? 295 LEU C O 1 +ATOM 5477 C CB . LEU C 3 295 ? 7.211 65.919 135.893 1.00 22.95 ? 295 LEU C CB 1 +ATOM 5478 C CG . LEU C 3 295 ? 7.845 65.799 137.291 1.00 22.46 ? 295 LEU C CG 1 +ATOM 5479 C CD1 . LEU C 3 295 ? 9.284 65.269 137.253 1.00 22.62 ? 295 LEU C CD1 1 +ATOM 5480 C CD2 . LEU C 3 295 ? 7.752 67.092 138.100 1.00 22.62 ? 295 LEU C CD2 1 +ATOM 5481 N N . HIS C 3 296 ? 9.907 66.728 134.301 1.00 22.25 ? 296 HIS C N 1 +ATOM 5482 C CA . HIS C 3 296 ? 11.069 66.516 133.406 1.00 22.43 ? 296 HIS C CA 1 +ATOM 5483 C C . HIS C 3 296 ? 10.792 66.775 131.908 1.00 21.92 ? 296 HIS C C 1 +ATOM 5484 O O . HIS C 3 296 ? 11.015 65.913 131.051 1.00 21.93 ? 296 HIS C O 1 +ATOM 5485 C CB . HIS C 3 296 ? 11.858 65.194 133.659 1.00 22.71 ? 296 HIS C CB 1 +ATOM 5486 C CG . HIS C 3 296 ? 11.021 64.014 134.074 1.00 24.24 ? 296 HIS C CG 1 +ATOM 5487 N ND1 . HIS C 3 296 ? 11.571 62.897 134.672 1.00 24.70 ? 296 HIS C ND1 1 +ATOM 5488 C CD2 . HIS C 3 296 ? 9.692 63.761 133.962 1.00 24.83 ? 296 HIS C CD2 1 +ATOM 5489 C CE1 . HIS C 3 296 ? 10.617 62.017 134.926 1.00 25.49 ? 296 HIS C CE1 1 +ATOM 5490 N NE2 . HIS C 3 296 ? 9.465 62.519 134.508 1.00 25.54 ? 296 HIS C NE2 1 +ATOM 5491 N N . ASN C 3 297 ? 10.309 67.984 131.627 1.00 21.62 ? 297 ASN C N 1 +ATOM 5492 C CA . ASN C 3 297 ? 9.950 68.443 130.287 1.00 21.15 ? 297 ASN C CA 1 +ATOM 5493 C C . ASN C 3 297 ? 10.326 69.915 130.172 1.00 20.32 ? 297 ASN C C 1 +ATOM 5494 O O . ASN C 3 297 ? 9.977 70.709 131.044 1.00 20.48 ? 297 ASN C O 1 +ATOM 5495 C CB . ASN C 3 297 ? 8.436 68.287 130.051 1.00 21.71 ? 297 ASN C CB 1 +ATOM 5496 C CG . ASN C 3 297 ? 8.082 67.128 129.107 1.00 23.04 ? 297 ASN C CG 1 +ATOM 5497 O OD1 . ASN C 3 297 ? 8.819 66.138 128.995 1.00 23.22 ? 297 ASN C OD1 1 +ATOM 5498 N ND2 . ASN C 3 297 ? 6.926 67.247 128.434 1.00 25.66 ? 297 ASN C ND2 1 +ATOM 5499 N N . GLN C 3 298 ? 11.039 70.271 129.106 1.00 19.33 ? 298 GLN C N 1 +ATOM 5500 C CA . GLN C 3 298 ? 11.498 71.640 128.880 1.00 18.35 ? 298 GLN C CA 1 +ATOM 5501 C C . GLN C 3 298 ? 10.849 72.226 127.632 1.00 17.92 ? 298 GLN C C 1 +ATOM 5502 O O . GLN C 3 298 ? 10.306 71.488 126.804 1.00 17.80 ? 298 GLN C O 1 +ATOM 5503 C CB . GLN C 3 298 ? 13.003 71.647 128.712 1.00 18.34 ? 298 GLN C CB 1 +ATOM 5504 C CG . GLN C 3 298 ? 13.480 70.710 127.635 1.00 18.49 ? 298 GLN C CG 1 +ATOM 5505 C CD . GLN C 3 298 ? 14.973 70.719 127.487 1.00 20.54 ? 298 GLN C CD 1 +ATOM 5506 O OE1 . GLN C 3 298 ? 15.481 70.878 126.378 1.00 22.17 ? 298 GLN C OE1 1 +ATOM 5507 N NE2 . GLN C 3 298 ? 15.693 70.555 128.600 1.00 20.71 ? 298 GLN C NE2 1 +ATOM 5508 N N . GLU C 3 299 ? 10.900 73.548 127.495 1.00 17.36 ? 299 GLU C N 1 +ATOM 5509 C CA . GLU C 3 299 ? 10.306 74.198 126.328 1.00 16.91 ? 299 GLU C CA 1 +ATOM 5510 C C . GLU C 3 299 ? 11.342 74.340 125.215 1.00 16.88 ? 299 GLU C C 1 +ATOM 5511 O O . GLU C 3 299 ? 12.516 74.517 125.479 1.00 16.02 ? 299 GLU C O 1 +ATOM 5512 C CB . GLU C 3 299 ? 9.704 75.574 126.660 1.00 16.56 ? 299 GLU C CB 1 +ATOM 5513 C CG . GLU C 3 299 ? 9.269 75.811 128.100 1.00 16.40 ? 299 GLU C CG 1 +ATOM 5514 C CD . GLU C 3 299 ? 8.537 77.136 128.291 1.00 16.32 ? 299 GLU C CD 1 +ATOM 5515 O OE1 . GLU C 3 299 ? 7.909 77.340 129.352 1.00 15.86 ? 299 GLU C OE1 1 +ATOM 5516 O OE2 . GLU C 3 299 ? 8.586 77.986 127.381 1.00 17.30 ? 299 GLU C OE2 1 +ATOM 5517 N N . VAL C 3 300 ? 10.893 74.238 123.970 1.00 17.29 ? 300 VAL C N 1 +ATOM 5518 C CA . VAL C 3 300 ? 11.729 74.569 122.831 1.00 17.86 ? 300 VAL C CA 1 +ATOM 5519 C C . VAL C 3 300 ? 10.889 75.322 121.809 1.00 18.56 ? 300 VAL C C 1 +ATOM 5520 O O . VAL C 3 300 ? 9.665 75.329 121.892 1.00 18.50 ? 300 VAL C O 1 +ATOM 5521 C CB . VAL C 3 300 ? 12.392 73.318 122.203 1.00 17.66 ? 300 VAL C CB 1 +ATOM 5522 C CG1 . VAL C 3 300 ? 12.733 72.295 123.265 1.00 18.04 ? 300 VAL C CG1 1 +ATOM 5523 C CG2 . VAL C 3 300 ? 11.519 72.689 121.136 1.00 17.84 ? 300 VAL C CG2 1 +ATOM 5524 N N . THR C 3 301 ? 11.553 75.949 120.847 1.00 19.71 ? 301 THR C N 1 +ATOM 5525 C CA . THR C 3 301 ? 10.875 76.706 119.806 1.00 20.87 ? 301 THR C CA 1 +ATOM 5526 C C . THR C 3 301 ? 11.000 75.990 118.455 1.00 21.36 ? 301 THR C C 1 +ATOM 5527 O O . THR C 3 301 ? 12.112 75.761 117.979 1.00 21.71 ? 301 THR C O 1 +ATOM 5528 C CB . THR C 3 301 ? 11.465 78.137 119.751 1.00 21.01 ? 301 THR C CB 1 +ATOM 5529 O OG1 . THR C 3 301 ? 11.553 78.667 121.084 1.00 21.73 ? 301 THR C OG1 1 +ATOM 5530 C CG2 . THR C 3 301 ? 10.513 79.105 119.048 1.00 21.50 ? 301 THR C CG2 1 +ATOM 5531 N N . ALA C 3 302 ? 9.866 75.627 117.851 1.00 22.01 ? 302 ALA C N 1 +ATOM 5532 C CA . ALA C 3 302 ? 9.863 74.929 116.552 1.00 22.56 ? 302 ALA C CA 1 +ATOM 5533 C C . ALA C 3 302 ? 9.283 75.778 115.405 1.00 22.80 ? 302 ALA C C 1 +ATOM 5534 O O . ALA C 3 302 ? 10.024 76.420 114.644 1.00 23.15 ? 302 ALA C O 1 +ATOM 5535 C CB . ALA C 3 302 ? 9.127 73.586 116.661 1.00 22.57 ? 302 ALA C CB 1 +ATOM 5536 N N . THR C 3 306 ? 6.944 78.887 117.161 1.00 24.42 ? 306 THR C N 1 +ATOM 5537 C CA . THR C 3 306 ? 5.971 78.180 118.000 1.00 25.07 ? 306 THR C CA 1 +ATOM 5538 C C . THR C 3 306 ? 6.679 77.407 119.110 1.00 24.55 ? 306 THR C C 1 +ATOM 5539 O O . THR C 3 306 ? 7.847 77.044 118.973 1.00 24.83 ? 306 THR C O 1 +ATOM 5540 C CB . THR C 3 306 ? 5.122 77.194 117.145 1.00 25.39 ? 306 THR C CB 1 +ATOM 5541 O OG1 . THR C 3 306 ? 5.317 77.492 115.751 1.00 26.97 ? 306 THR C OG1 1 +ATOM 5542 C CG2 . THR C 3 306 ? 3.615 77.387 117.384 1.00 24.59 ? 306 THR C CG2 1 +ATOM 5543 N N . GLN C 3 307 ? 5.958 77.107 120.181 1.00 23.64 ? 307 GLN C N 1 +ATOM 5544 C CA . GLN C 3 307 ? 6.609 76.658 121.393 1.00 22.75 ? 307 GLN C CA 1 +ATOM 5545 C C . GLN C 3 307 ? 6.090 75.321 121.866 1.00 22.36 ? 307 GLN C C 1 +ATOM 5546 O O . GLN C 3 307 ? 4.924 75.206 122.202 1.00 22.32 ? 307 GLN C O 1 +ATOM 5547 C CB . GLN C 3 307 ? 6.408 77.709 122.469 1.00 22.49 ? 307 GLN C CB 1 +ATOM 5548 C CG . GLN C 3 307 ? 7.560 77.845 123.383 1.00 22.06 ? 307 GLN C CG 1 +ATOM 5549 C CD . GLN C 3 307 ? 8.234 79.191 123.274 1.00 22.49 ? 307 GLN C CD 1 +ATOM 5550 O OE1 . GLN C 3 307 ? 7.815 80.149 123.929 1.00 21.10 ? 307 GLN C OE1 1 +ATOM 5551 N NE2 . GLN C 3 307 ? 9.301 79.266 122.465 1.00 21.83 ? 307 GLN C NE2 1 +ATOM 5552 N N . ARG C 3 308 ? 6.962 74.317 121.898 1.00 22.11 ? 308 ARG C N 1 +ATOM 5553 C CA . ARG C 3 308 ? 6.587 72.963 122.323 1.00 22.03 ? 308 ARG C CA 1 +ATOM 5554 C C . ARG C 3 308 ? 7.179 72.598 123.691 1.00 21.15 ? 308 ARG C C 1 +ATOM 5555 O O . ARG C 3 308 ? 8.094 73.264 124.179 1.00 20.83 ? 308 ARG C O 1 +ATOM 5556 C CB . ARG C 3 308 ? 7.029 71.932 121.267 1.00 22.60 ? 308 ARG C CB 1 +ATOM 5557 C CG . ARG C 3 308 ? 5.883 71.333 120.435 1.00 25.30 ? 308 ARG C CG 1 +ATOM 5558 C CD . ARG C 3 308 ? 6.069 69.860 119.987 1.00 29.66 ? 308 ARG C CD 1 +ATOM 5559 N NE . ARG C 3 308 ? 7.045 69.665 118.889 1.00 32.65 ? 308 ARG C NE 1 +ATOM 5560 C CZ . ARG C 3 308 ? 6.814 69.867 117.571 1.00 34.03 ? 308 ARG C CZ 1 +ATOM 5561 N NH1 . ARG C 3 308 ? 5.629 70.305 117.129 1.00 35.15 ? 308 ARG C NH1 1 +ATOM 5562 N NH2 . ARG C 3 308 ? 7.786 69.648 116.688 1.00 33.17 ? 308 ARG C NH2 1 +ATOM 5563 N N . CYS C 3 309 ? 6.638 71.551 124.305 1.00 20.29 ? 309 CYS C N 1 +ATOM 5564 C CA . CYS C 3 309 ? 7.261 70.912 125.450 1.00 20.00 ? 309 CYS C CA 1 +ATOM 5565 C C . CYS C 3 309 ? 7.769 69.562 124.999 1.00 20.37 ? 309 CYS C C 1 +ATOM 5566 O O . CYS C 3 309 ? 7.007 68.774 124.427 1.00 20.48 ? 309 CYS C O 1 +ATOM 5567 C CB . CYS C 3 309 ? 6.251 70.666 126.558 1.00 19.45 ? 309 CYS C CB 1 +ATOM 5568 S SG . CYS C 3 309 ? 5.803 72.116 127.508 1.00 19.12 ? 309 CYS C SG 1 +ATOM 5569 N N . GLU C 3 310 ? 9.041 69.270 125.256 1.00 20.76 ? 310 GLU C N 1 +ATOM 5570 C CA . GLU C 3 310 ? 9.518 67.904 125.031 1.00 21.35 ? 310 GLU C CA 1 +ATOM 5571 C C . GLU C 3 310 ? 10.180 67.282 126.244 1.00 21.84 ? 310 GLU C C 1 +ATOM 5572 O O . GLU C 3 310 ? 10.339 67.944 127.262 1.00 21.90 ? 310 GLU C O 1 +ATOM 5573 C CB . GLU C 3 310 ? 10.423 67.783 123.809 1.00 20.99 ? 310 GLU C CB 1 +ATOM 5574 C CG . GLU C 3 310 ? 10.863 69.078 123.179 1.00 20.59 ? 310 GLU C CG 1 +ATOM 5575 C CD . GLU C 3 310 ? 11.585 68.820 121.876 1.00 20.05 ? 310 GLU C CD 1 +ATOM 5576 O OE1 . GLU C 3 310 ? 10.899 68.563 120.856 1.00 20.09 ? 310 GLU C OE1 1 +ATOM 5577 O OE2 . GLU C 3 310 ? 12.835 68.853 121.882 1.00 18.59 ? 310 GLU C OE2 1 +ATOM 5578 N N . LYS C 3 311 ? 10.522 65.994 126.125 1.00 22.71 ? 311 LYS C N 1 +ATOM 5579 C CA . LYS C 3 311 ? 11.282 65.258 127.141 1.00 23.34 ? 311 LYS C CA 1 +ATOM 5580 C C . LYS C 3 311 ? 12.711 65.707 127.042 1.00 23.23 ? 311 LYS C C 1 +ATOM 5581 O O . LYS C 3 311 ? 13.260 65.794 125.940 1.00 23.12 ? 311 LYS C O 1 +ATOM 5582 C CB . LYS C 3 311 ? 11.216 63.733 126.911 1.00 23.68 ? 311 LYS C CB 1 +ATOM 5583 C CG . LYS C 3 311 ? 10.535 62.927 128.075 1.00 25.43 ? 311 LYS C CG 1 +ATOM 5584 C CD . LYS C 3 311 ? 10.068 61.528 127.582 1.00 27.04 ? 311 LYS C CD 1 +ATOM 5585 C CE . LYS C 3 311 ? 8.552 61.525 127.212 1.00 26.89 ? 311 LYS C CE 1 +ATOM 5586 N NZ . LYS C 3 311 ? 7.975 60.144 127.235 1.00 26.02 ? 311 LYS C NZ 1 +ATOM 5587 N N . CYS C 3 312 ? 13.305 65.995 128.193 1.00 23.36 ? 312 CYS C N 1 +ATOM 5588 C CA . CYS C 3 312 ? 14.726 66.315 128.262 1.00 23.66 ? 312 CYS C CA 1 +ATOM 5589 C C . CYS C 3 312 ? 15.573 65.051 128.020 1.00 23.49 ? 312 CYS C C 1 +ATOM 5590 O O . CYS C 3 312 ? 15.404 64.038 128.703 1.00 23.27 ? 312 CYS C O 1 +ATOM 5591 C CB . CYS C 3 312 ? 15.078 67.000 129.602 1.00 23.83 ? 312 CYS C CB 1 +ATOM 5592 S SG . CYS C 3 312 ? 13.659 67.457 130.642 1.00 24.38 ? 312 CYS C SG 1 +ATOM 5593 N N . SER C 3 313 ? 16.458 65.125 127.025 1.00 23.56 ? 313 SER C N 1 +ATOM 5594 C CA . SER C 3 313 ? 17.326 64.010 126.630 1.00 23.53 ? 313 SER C CA 1 +ATOM 5595 C C . SER C 3 313 ? 18.328 63.701 127.745 1.00 23.61 ? 313 SER C C 1 +ATOM 5596 O O . SER C 3 313 ? 18.192 62.697 128.456 1.00 23.77 ? 313 SER C O 1 +ATOM 5597 C CB . SER C 3 313 ? 18.057 64.328 125.313 1.00 23.61 ? 313 SER C CB 1 +ATOM 5598 O OG . SER C 3 313 ? 17.189 64.926 124.359 1.00 22.92 ? 313 SER C OG 1 +ATOM 5599 N N . LYS C 3 314 ? 19.336 64.565 127.876 1.00 23.43 ? 314 LYS C N 1 +ATOM 5600 C CA . LYS C 3 314 ? 20.133 64.683 129.094 1.00 22.95 ? 314 LYS C CA 1 +ATOM 5601 C C . LYS C 3 314 ? 19.199 65.222 130.207 1.00 22.90 ? 314 LYS C C 1 +ATOM 5602 O O . LYS C 3 314 ? 18.156 65.820 129.887 1.00 22.77 ? 314 LYS C O 1 +ATOM 5603 C CB . LYS C 3 314 ? 21.320 65.617 128.835 1.00 22.78 ? 314 LYS C CB 1 +ATOM 5604 C CG . LYS C 3 314 ? 22.567 64.898 128.300 1.00 22.83 ? 314 LYS C CG 1 +ATOM 5605 C CD . LYS C 3 314 ? 22.897 65.251 126.841 1.00 22.03 ? 314 LYS C CD 1 +ATOM 5606 C CE . LYS C 3 314 ? 24.369 65.683 126.667 1.00 21.65 ? 314 LYS C CE 1 +ATOM 5607 N NZ . LYS C 3 314 ? 25.355 64.560 126.662 1.00 19.77 ? 314 LYS C NZ 1 +ATOM 5608 N N . PRO C 3 315 ? 19.530 65.015 131.492 1.00 22.77 ? 315 PRO C N 1 +ATOM 5609 C CA . PRO C 3 315 ? 18.617 65.398 132.584 1.00 22.69 ? 315 PRO C CA 1 +ATOM 5610 C C . PRO C 3 315 ? 18.258 66.877 132.507 1.00 22.54 ? 315 PRO C C 1 +ATOM 5611 O O . PRO C 3 315 ? 19.115 67.685 132.151 1.00 22.88 ? 315 PRO C O 1 +ATOM 5612 C CB . PRO C 3 315 ? 19.438 65.117 133.850 1.00 22.48 ? 315 PRO C CB 1 +ATOM 5613 C CG . PRO C 3 315 ? 20.397 64.099 133.437 1.00 22.56 ? 315 PRO C CG 1 +ATOM 5614 C CD . PRO C 3 315 ? 20.779 64.434 132.019 1.00 22.75 ? 315 PRO C CD 1 +ATOM 5615 N N . CYS C 3 316 ? 17.019 67.221 132.839 1.00 22.32 ? 316 CYS C N 1 +ATOM 5616 C CA . CYS C 3 316 ? 16.499 68.562 132.586 1.00 22.06 ? 316 CYS C CA 1 +ATOM 5617 C C . CYS C 3 316 ? 17.452 69.711 132.920 1.00 21.63 ? 316 CYS C C 1 +ATOM 5618 O O . CYS C 3 316 ? 17.896 69.849 134.064 1.00 21.62 ? 316 CYS C O 1 +ATOM 5619 C CB . CYS C 3 316 ? 15.163 68.734 133.271 1.00 21.97 ? 316 CYS C CB 1 +ATOM 5620 S SG . CYS C 3 316 ? 13.895 68.956 132.027 1.00 23.73 ? 316 CYS C SG 1 +ATOM 5621 N N . ALA C 3 317 ? 17.769 70.515 131.900 1.00 21.08 ? 317 ALA C N 1 +ATOM 5622 C CA . ALA C 3 317 ? 18.750 71.598 132.014 1.00 20.56 ? 317 ALA C CA 1 +ATOM 5623 C C . ALA C 3 317 ? 18.199 72.745 132.841 1.00 20.17 ? 317 ALA C C 1 +ATOM 5624 O O . ALA C 3 317 ? 17.146 73.293 132.527 1.00 20.21 ? 317 ALA C O 1 +ATOM 5625 C CB . ALA C 3 317 ? 19.173 72.087 130.639 1.00 20.55 ? 317 ALA C CB 1 +ATOM 5626 N N . ARG C 3 318 ? 18.929 73.100 133.893 1.00 19.74 ? 318 ARG C N 1 +ATOM 5627 C CA . ARG C 3 318 ? 18.471 74.061 134.889 1.00 19.38 ? 318 ARG C CA 1 +ATOM 5628 C C . ARG C 3 318 ? 18.066 75.400 134.295 1.00 19.10 ? 318 ARG C C 1 +ATOM 5629 O O . ARG C 3 318 ? 18.545 75.797 133.240 1.00 18.78 ? 318 ARG C O 1 +ATOM 5630 C CB . ARG C 3 318 ? 19.541 74.259 135.963 1.00 19.75 ? 318 ARG C CB 1 +ATOM 5631 C CG . ARG C 3 318 ? 19.572 73.161 137.019 1.00 20.14 ? 318 ARG C CG 1 +ATOM 5632 C CD . ARG C 3 318 ? 19.638 73.675 138.444 1.00 20.33 ? 318 ARG C CD 1 +ATOM 5633 N NE . ARG C 3 318 ? 19.932 72.599 139.383 1.00 20.68 ? 318 ARG C NE 1 +ATOM 5634 C CZ . ARG C 3 318 ? 20.212 72.781 140.668 1.00 21.33 ? 318 ARG C CZ 1 +ATOM 5635 N NH1 . ARG C 3 318 ? 20.240 74.002 141.186 1.00 21.22 ? 318 ARG C NH1 1 +ATOM 5636 N NH2 . ARG C 3 318 ? 20.471 71.737 141.444 1.00 22.39 ? 318 ARG C NH2 1 +ATOM 5637 N N . VAL C 3 319 ? 17.172 76.084 134.997 1.00 19.27 ? 319 VAL C N 1 +ATOM 5638 C CA . VAL C 3 319 ? 16.561 77.336 134.521 1.00 19.85 ? 319 VAL C CA 1 +ATOM 5639 C C . VAL C 3 319 ? 16.391 78.449 135.572 1.00 19.95 ? 319 VAL C C 1 +ATOM 5640 O O . VAL C 3 319 ? 16.464 78.235 136.778 1.00 19.49 ? 319 VAL C O 1 +ATOM 5641 C CB . VAL C 3 319 ? 15.167 77.093 133.861 1.00 19.60 ? 319 VAL C CB 1 +ATOM 5642 C CG1 . VAL C 3 319 ? 14.469 78.402 133.723 1.00 21.37 ? 319 VAL C CG1 1 +ATOM 5643 C CG2 . VAL C 3 319 ? 15.317 76.489 132.468 1.00 19.03 ? 319 VAL C CG2 1 +ATOM 5644 N N . CYS C 3 320 ? 16.108 79.644 135.084 1.00 20.54 ? 320 CYS C N 1 +ATOM 5645 C CA . CYS C 3 320 ? 15.965 80.803 135.940 1.00 21.89 ? 320 CYS C CA 1 +ATOM 5646 C C . CYS C 3 320 ? 14.500 81.172 136.280 1.00 21.30 ? 320 CYS C C 1 +ATOM 5647 O O . CYS C 3 320 ? 13.704 81.524 135.400 1.00 21.59 ? 320 CYS C O 1 +ATOM 5648 C CB . CYS C 3 320 ? 16.653 81.932 135.225 1.00 21.86 ? 320 CYS C CB 1 +ATOM 5649 S SG . CYS C 3 320 ? 16.738 83.439 136.164 1.00 29.54 ? 320 CYS C SG 1 +ATOM 5650 N N . TYR C 3 321 ? 14.142 81.110 137.555 1.00 20.49 ? 321 TYR C N 1 +ATOM 5651 C CA . TYR C 3 321 ? 12.741 81.271 137.940 1.00 19.89 ? 321 TYR C CA 1 +ATOM 5652 C C . TYR C 3 321 ? 12.342 82.665 138.402 1.00 19.89 ? 321 TYR C C 1 +ATOM 5653 O O . TYR C 3 321 ? 13.089 83.340 139.110 1.00 20.86 ? 321 TYR C O 1 +ATOM 5654 C CB . TYR C 3 321 ? 12.382 80.224 138.981 1.00 20.17 ? 321 TYR C CB 1 +ATOM 5655 C CG . TYR C 3 321 ? 12.161 78.859 138.351 1.00 19.94 ? 321 TYR C CG 1 +ATOM 5656 C CD1 . TYR C 3 321 ? 11.028 78.621 137.572 1.00 20.19 ? 321 TYR C CD1 1 +ATOM 5657 C CD2 . TYR C 3 321 ? 13.095 77.816 138.497 1.00 20.01 ? 321 TYR C CD2 1 +ATOM 5658 C CE1 . TYR C 3 321 ? 10.794 77.375 136.970 1.00 20.34 ? 321 TYR C CE1 1 +ATOM 5659 C CE2 . TYR C 3 321 ? 12.881 76.542 137.887 1.00 19.97 ? 321 TYR C CE2 1 +ATOM 5660 C CZ . TYR C 3 321 ? 11.715 76.345 137.127 1.00 19.55 ? 321 TYR C CZ 1 +ATOM 5661 O OH . TYR C 3 321 ? 11.427 75.158 136.515 1.00 16.31 ? 321 TYR C OH 1 +ATOM 5662 N N . GLY C 3 322 ? 11.175 83.120 137.971 1.00 19.09 ? 322 GLY C N 1 +ATOM 5663 C CA . GLY C 3 322 ? 10.646 84.389 138.435 1.00 17.84 ? 322 GLY C CA 1 +ATOM 5664 C C . GLY C 3 322 ? 9.638 84.160 139.538 1.00 17.48 ? 322 GLY C C 1 +ATOM 5665 O O . GLY C 3 322 ? 9.457 83.038 139.969 1.00 17.02 ? 322 GLY C O 1 +ATOM 5666 N N . LEU C 3 323 ? 8.976 85.213 139.999 1.00 17.56 ? 323 LEU C N 1 +ATOM 5667 C CA . LEU C 3 323 ? 7.976 85.063 141.054 1.00 17.83 ? 323 LEU C CA 1 +ATOM 5668 C C . LEU C 3 323 ? 6.842 84.184 140.580 1.00 17.80 ? 323 LEU C C 1 +ATOM 5669 O O . LEU C 3 323 ? 6.469 84.220 139.403 1.00 18.23 ? 323 LEU C O 1 +ATOM 5670 C CB . LEU C 3 323 ? 7.419 86.413 141.470 1.00 17.61 ? 323 LEU C CB 1 +ATOM 5671 C CG . LEU C 3 323 ? 8.532 87.421 141.696 1.00 18.01 ? 323 LEU C CG 1 +ATOM 5672 C CD1 . LEU C 3 323 ? 7.893 88.791 141.892 1.00 17.82 ? 323 LEU C CD1 1 +ATOM 5673 C CD2 . LEU C 3 323 ? 9.392 86.956 142.891 1.00 16.38 ? 323 LEU C CD2 1 +ATOM 5674 N N . GLY C 3 324 ? 6.300 83.396 141.496 1.00 17.30 ? 324 GLY C N 1 +ATOM 5675 C CA . GLY C 3 324 ? 5.208 82.509 141.169 1.00 17.60 ? 324 GLY C CA 1 +ATOM 5676 C C . GLY C 3 324 ? 5.713 81.123 140.839 1.00 17.65 ? 324 GLY C C 1 +ATOM 5677 O O . GLY C 3 324 ? 4.939 80.197 140.637 1.00 17.01 ? 324 GLY C O 1 +ATOM 5678 N N . MET C 3 325 ? 7.023 80.967 140.788 1.00 17.88 ? 325 MET C N 1 +ATOM 5679 C CA . MET C 3 325 ? 7.553 79.658 140.476 1.00 18.67 ? 325 MET C CA 1 +ATOM 5680 C C . MET C 3 325 ? 8.649 79.193 141.408 1.00 18.54 ? 325 MET C C 1 +ATOM 5681 O O . MET C 3 325 ? 9.462 79.990 141.903 1.00 18.05 ? 325 MET C O 1 +ATOM 5682 C CB . MET C 3 325 ? 8.025 79.603 139.025 1.00 19.22 ? 325 MET C CB 1 +ATOM 5683 C CG . MET C 3 325 ? 7.562 78.352 138.346 1.00 20.77 ? 325 MET C CG 1 +ATOM 5684 S SD . MET C 3 325 ? 6.168 78.795 137.412 1.00 24.97 ? 325 MET C SD 1 +ATOM 5685 C CE . MET C 3 325 ? 6.734 78.177 135.749 1.00 26.30 ? 325 MET C CE 1 +ATOM 5686 N N . GLU C 3 326 ? 8.643 77.882 141.625 1.00 18.84 ? 326 GLU C N 1 +ATOM 5687 C CA . GLU C 3 326 ? 9.643 77.183 142.423 1.00 19.40 ? 326 GLU C CA 1 +ATOM 5688 C C . GLU C 3 326 ? 9.785 77.784 143.822 1.00 19.19 ? 326 GLU C C 1 +ATOM 5689 O O . GLU C 3 326 ? 8.770 78.052 144.466 1.00 19.56 ? 326 GLU C O 1 +ATOM 5690 C CB . GLU C 3 326 ? 10.970 77.120 141.673 1.00 19.37 ? 326 GLU C CB 1 +ATOM 5691 C CG . GLU C 3 326 ? 10.928 76.105 140.548 1.00 21.28 ? 326 GLU C CG 1 +ATOM 5692 C CD . GLU C 3 326 ? 10.797 74.661 141.031 1.00 24.04 ? 326 GLU C CD 1 +ATOM 5693 O OE1 . GLU C 3 326 ? 9.712 74.057 140.826 1.00 24.56 ? 326 GLU C OE1 1 +ATOM 5694 O OE2 . GLU C 3 326 ? 11.775 74.125 141.610 1.00 23.58 ? 326 GLU C OE2 1 +ATOM 5695 N N . HIS C 3 327 ? 11.020 77.997 144.280 1.00 18.59 ? 327 HIS C N 1 +ATOM 5696 C CA . HIS C 3 327 ? 11.273 78.620 145.588 1.00 18.35 ? 327 HIS C CA 1 +ATOM 5697 C C . HIS C 3 327 ? 10.667 80.022 145.710 1.00 17.07 ? 327 HIS C C 1 +ATOM 5698 O O . HIS C 3 327 ? 10.529 80.534 146.815 1.00 16.94 ? 327 HIS C O 1 +ATOM 5699 C CB . HIS C 3 327 ? 12.776 78.659 145.922 1.00 18.68 ? 327 HIS C CB 1 +ATOM 5700 C CG . HIS C 3 327 ? 13.586 79.425 144.924 1.00 21.11 ? 327 HIS C CG 1 +ATOM 5701 N ND1 . HIS C 3 327 ? 13.942 78.901 143.696 1.00 21.83 ? 327 HIS C ND1 1 +ATOM 5702 C CD2 . HIS C 3 327 ? 14.069 80.691 144.951 1.00 22.90 ? 327 HIS C CD2 1 +ATOM 5703 C CE1 . HIS C 3 327 ? 14.632 79.803 143.021 1.00 23.12 ? 327 HIS C CE1 1 +ATOM 5704 N NE2 . HIS C 3 327 ? 14.722 80.898 143.757 1.00 24.40 ? 327 HIS C NE2 1 +ATOM 5705 N N . LEU C 3 328 ? 10.293 80.628 144.585 1.00 16.21 ? 328 LEU C N 1 +ATOM 5706 C CA . LEU C 3 328 ? 9.636 81.932 144.606 1.00 15.36 ? 328 LEU C CA 1 +ATOM 5707 C C . LEU C 3 328 ? 8.128 81.882 144.423 1.00 16.11 ? 328 LEU C C 1 +ATOM 5708 O O . LEU C 3 328 ? 7.536 82.899 144.129 1.00 16.29 ? 328 LEU C O 1 +ATOM 5709 C CB . LEU C 3 328 ? 10.248 82.872 143.565 1.00 14.39 ? 328 LEU C CB 1 +ATOM 5710 C CG . LEU C 3 328 ? 11.755 83.157 143.641 1.00 12.50 ? 328 LEU C CG 1 +ATOM 5711 C CD1 . LEU C 3 328 ? 12.211 83.995 142.485 1.00 5.18 ? 328 LEU C CD1 1 +ATOM 5712 C CD2 . LEU C 3 328 ? 12.134 83.813 144.976 1.00 8.12 ? 328 LEU C CD2 1 +ATOM 5713 N N . ARG C 3 329 ? 7.498 80.720 144.599 1.00 17.40 ? 329 ARG C N 1 +ATOM 5714 C CA . ARG C 3 329 ? 6.041 80.592 144.382 1.00 19.27 ? 329 ARG C CA 1 +ATOM 5715 C C . ARG C 3 329 ? 5.174 81.546 145.238 1.00 19.37 ? 329 ARG C C 1 +ATOM 5716 O O . ARG C 3 329 ? 4.317 82.251 144.704 1.00 19.94 ? 329 ARG C O 1 +ATOM 5717 C CB . ARG C 3 329 ? 5.542 79.124 144.479 1.00 19.74 ? 329 ARG C CB 1 +ATOM 5718 C CG . ARG C 3 329 ? 6.086 78.313 145.664 1.00 23.14 ? 329 ARG C CG 1 +ATOM 5719 C CD . ARG C 3 329 ? 5.214 77.116 146.059 1.00 28.06 ? 329 ARG C CD 1 +ATOM 5720 N NE . ARG C 3 329 ? 5.978 76.068 146.750 1.00 30.20 ? 329 ARG C NE 1 +ATOM 5721 C CZ . ARG C 3 329 ? 6.708 75.127 146.146 1.00 30.50 ? 329 ARG C CZ 1 +ATOM 5722 N NH1 . ARG C 3 329 ? 6.787 75.087 144.817 1.00 31.53 ? 329 ARG C NH1 1 +ATOM 5723 N NH2 . ARG C 3 329 ? 7.359 74.222 146.871 1.00 29.72 ? 329 ARG C NH2 1 +ATOM 5724 N N . GLU C 3 330 ? 5.427 81.593 146.541 1.00 19.25 ? 330 GLU C N 1 +ATOM 5725 C CA . GLU C 3 330 ? 4.676 82.469 147.437 1.00 19.78 ? 330 GLU C CA 1 +ATOM 5726 C C . GLU C 3 330 ? 5.465 83.751 147.747 1.00 18.84 ? 330 GLU C C 1 +ATOM 5727 O O . GLU C 3 330 ? 5.260 84.363 148.771 1.00 17.96 ? 330 GLU C O 1 +ATOM 5728 C CB . GLU C 3 330 ? 4.251 81.715 148.750 1.00 20.44 ? 330 GLU C CB 1 +ATOM 5729 C CG . GLU C 3 330 ? 3.025 80.787 148.638 1.00 22.78 ? 330 GLU C CG 1 +ATOM 5730 C CD . GLU C 3 330 ? 2.242 80.622 149.957 1.00 27.66 ? 330 GLU C CD 1 +ATOM 5731 O OE1 . GLU C 3 330 ? 2.389 79.574 150.648 1.00 27.79 ? 330 GLU C OE1 1 +ATOM 5732 O OE2 . GLU C 3 330 ? 1.449 81.535 150.317 1.00 29.06 ? 330 GLU C OE2 1 +ATOM 5733 N N . VAL C 3 331 ? 6.371 84.154 146.857 1.00 19.23 ? 331 VAL C N 1 +ATOM 5734 C CA . VAL C 3 331 ? 7.163 85.394 147.064 1.00 18.38 ? 331 VAL C CA 1 +ATOM 5735 C C . VAL C 3 331 ? 6.518 86.628 146.399 1.00 18.46 ? 331 VAL C C 1 +ATOM 5736 O O . VAL C 3 331 ? 6.186 86.621 145.207 1.00 17.92 ? 331 VAL C O 1 +ATOM 5737 C CB . VAL C 3 331 ? 8.661 85.223 146.673 1.00 17.95 ? 331 VAL C CB 1 +ATOM 5738 C CG1 . VAL C 3 331 ? 9.432 86.550 146.772 1.00 16.30 ? 331 VAL C CG1 1 +ATOM 5739 C CG2 . VAL C 3 331 ? 9.316 84.173 147.548 1.00 16.14 ? 331 VAL C CG2 1 +ATOM 5740 N N . ARG C 3 332 ? 6.340 87.667 147.209 1.00 18.77 ? 332 ARG C N 1 +ATOM 5741 C CA . ARG C 3 332 ? 5.599 88.878 146.846 1.00 18.92 ? 332 ARG C CA 1 +ATOM 5742 C C . ARG C 3 332 ? 6.234 89.673 145.721 1.00 18.40 ? 332 ARG C C 1 +ATOM 5743 O O . ARG C 3 332 ? 5.616 89.912 144.686 1.00 18.30 ? 332 ARG C O 1 +ATOM 5744 C CB . ARG C 3 332 ? 5.500 89.793 148.091 1.00 19.93 ? 332 ARG C CB 1 +ATOM 5745 C CG . ARG C 3 332 ? 4.625 89.268 149.242 1.00 21.43 ? 332 ARG C CG 1 +ATOM 5746 C CD . ARG C 3 332 ? 4.410 90.252 150.411 1.00 26.10 ? 332 ARG C CD 1 +ATOM 5747 N NE . ARG C 3 332 ? 3.855 91.543 149.987 1.00 30.43 ? 332 ARG C NE 1 +ATOM 5748 C CZ . ARG C 3 332 ? 2.600 91.750 149.566 1.00 33.71 ? 332 ARG C CZ 1 +ATOM 5749 N NH1 . ARG C 3 332 ? 1.723 90.749 149.504 1.00 35.05 ? 332 ARG C NH1 1 +ATOM 5750 N NH2 . ARG C 3 332 ? 2.216 92.972 149.197 1.00 34.83 ? 332 ARG C NH2 1 +ATOM 5751 N N . ALA C 3 333 ? 7.488 90.063 145.935 1.00 18.27 ? 333 ALA C N 1 +ATOM 5752 C CA . ALA C 3 333 ? 8.133 91.141 145.194 1.00 18.01 ? 333 ALA C CA 1 +ATOM 5753 C C . ALA C 3 333 ? 9.613 90.884 144.972 1.00 18.00 ? 333 ALA C C 1 +ATOM 5754 O O . ALA C 3 333 ? 10.218 90.045 145.645 1.00 18.77 ? 333 ALA C O 1 +ATOM 5755 C CB . ALA C 3 333 ? 7.969 92.430 145.956 1.00 17.85 ? 333 ALA C CB 1 +ATOM 5756 N N . VAL C 3 334 ? 10.212 91.627 144.055 1.00 17.12 ? 334 VAL C N 1 +ATOM 5757 C CA . VAL C 3 334 ? 11.620 91.476 143.825 1.00 17.06 ? 334 VAL C CA 1 +ATOM 5758 C C . VAL C 3 334 ? 12.215 92.380 144.868 1.00 17.46 ? 334 VAL C C 1 +ATOM 5759 O O . VAL C 3 334 ? 11.786 93.524 145.015 1.00 18.00 ? 334 VAL C O 1 +ATOM 5760 C CB . VAL C 3 334 ? 12.054 91.911 142.387 1.00 17.66 ? 334 VAL C CB 1 +ATOM 5761 C CG1 . VAL C 3 334 ? 13.575 91.940 142.284 1.00 17.11 ? 334 VAL C CG1 1 +ATOM 5762 C CG2 . VAL C 3 334 ? 11.472 90.978 141.312 1.00 17.21 ? 334 VAL C CG2 1 +ATOM 5763 N N . THR C 3 335 ? 13.179 91.857 145.626 1.00 17.56 ? 335 THR C N 1 +ATOM 5764 C CA . THR C 3 335 ? 13.757 92.558 146.763 1.00 16.44 ? 335 THR C CA 1 +ATOM 5765 C C . THR C 3 335 ? 15.233 92.311 146.761 1.00 15.94 ? 335 THR C C 1 +ATOM 5766 O O . THR C 3 335 ? 15.734 91.506 145.968 1.00 15.98 ? 335 THR C O 1 +ATOM 5767 C CB . THR C 3 335 ? 13.211 92.013 148.091 1.00 16.95 ? 335 THR C CB 1 +ATOM 5768 O OG1 . THR C 3 335 ? 13.499 90.609 148.187 1.00 16.71 ? 335 THR C OG1 1 +ATOM 5769 C CG2 . THR C 3 335 ? 11.679 92.119 148.160 1.00 17.71 ? 335 THR C CG2 1 +ATOM 5770 N N . SER C 3 336 ? 15.915 92.966 147.697 1.00 14.88 ? 336 SER C N 1 +ATOM 5771 C CA . SER C 3 336 ? 17.354 92.940 147.777 1.00 14.04 ? 336 SER C CA 1 +ATOM 5772 C C . SER C 3 336 ? 17.849 91.573 148.186 1.00 14.14 ? 336 SER C C 1 +ATOM 5773 O O . SER C 3 336 ? 19.055 91.306 148.125 1.00 14.87 ? 336 SER C O 1 +ATOM 5774 C CB . SER C 3 336 ? 17.852 94.033 148.728 1.00 13.79 ? 336 SER C CB 1 +ATOM 5775 O OG . SER C 3 336 ? 17.448 93.817 150.077 1.00 13.10 ? 336 SER C OG 1 +ATOM 5776 N N . ALA C 3 337 ? 16.919 90.714 148.597 1.00 13.78 ? 337 ALA C N 1 +ATOM 5777 C CA . ALA C 3 337 ? 17.228 89.339 148.996 1.00 13.78 ? 337 ALA C CA 1 +ATOM 5778 C C . ALA C 3 337 ? 17.187 88.322 147.824 1.00 13.96 ? 337 ALA C C 1 +ATOM 5779 O O . ALA C 3 337 ? 17.672 87.183 147.949 1.00 14.37 ? 337 ALA C O 1 +ATOM 5780 C CB . ALA C 3 337 ? 16.292 88.902 150.076 1.00 13.13 ? 337 ALA C CB 1 +ATOM 5781 N N . ASN C 3 338 ? 16.601 88.716 146.708 1.00 13.02 ? 338 ASN C N 1 +ATOM 5782 C CA . ASN C 3 338 ? 16.395 87.770 145.628 1.00 13.56 ? 338 ASN C CA 1 +ATOM 5783 C C . ASN C 3 338 ? 16.764 88.285 144.217 1.00 13.68 ? 338 ASN C C 1 +ATOM 5784 O O . ASN C 3 338 ? 16.865 87.487 143.297 1.00 13.16 ? 338 ASN C O 1 +ATOM 5785 C CB . ASN C 3 338 ? 14.959 87.221 145.663 1.00 13.42 ? 338 ASN C CB 1 +ATOM 5786 C CG . ASN C 3 338 ? 13.910 88.309 145.586 1.00 12.75 ? 338 ASN C CG 1 +ATOM 5787 O OD1 . ASN C 3 338 ? 14.000 89.208 144.755 1.00 10.25 ? 338 ASN C OD1 1 +ATOM 5788 N ND2 . ASN C 3 338 ? 12.901 88.231 146.464 1.00 12.67 ? 338 ASN C ND2 1 +ATOM 5789 N N . ILE C 3 339 ? 16.987 89.603 144.102 1.00 13.50 ? 339 ILE C N 1 +ATOM 5790 C CA . ILE C 3 339 ? 17.311 90.284 142.860 1.00 13.51 ? 339 ILE C CA 1 +ATOM 5791 C C . ILE C 3 339 ? 18.541 89.711 142.166 1.00 14.93 ? 339 ILE C C 1 +ATOM 5792 O O . ILE C 3 339 ? 18.595 89.670 140.941 1.00 15.32 ? 339 ILE C O 1 +ATOM 5793 C CB . ILE C 3 339 ? 17.464 91.833 143.063 1.00 13.33 ? 339 ILE C CB 1 +ATOM 5794 C CG1 . ILE C 3 339 ? 17.701 92.515 141.727 1.00 12.07 ? 339 ILE C CG1 1 +ATOM 5795 C CG2 . ILE C 3 339 ? 18.625 92.199 144.011 1.00 12.24 ? 339 ILE C CG2 1 +ATOM 5796 C CD1 . ILE C 3 339 ? 16.581 93.322 141.248 1.00 9.19 ? 339 ILE C CD1 1 +ATOM 5797 N N . GLN C 3 340 ? 19.525 89.261 142.931 1.00 15.64 ? 340 GLN C N 1 +ATOM 5798 C CA . GLN C 3 340 ? 20.715 88.767 142.289 1.00 16.76 ? 340 GLN C CA 1 +ATOM 5799 C C . GLN C 3 340 ? 20.446 87.350 141.783 1.00 16.64 ? 340 GLN C C 1 +ATOM 5800 O O . GLN C 3 340 ? 21.143 86.846 140.894 1.00 16.61 ? 340 GLN C O 1 +ATOM 5801 C CB . GLN C 3 340 ? 21.966 88.973 143.163 1.00 17.14 ? 340 GLN C CB 1 +ATOM 5802 C CG . GLN C 3 340 ? 22.087 90.498 143.687 1.00 22.23 ? 340 GLN C CG 1 +ATOM 5803 C CD . GLN C 3 340 ? 23.152 91.439 142.960 1.00 27.01 ? 340 GLN C CD 1 +ATOM 5804 O OE1 . GLN C 3 340 ? 23.251 91.482 141.709 1.00 28.81 ? 340 GLN C OE1 1 +ATOM 5805 N NE2 . GLN C 3 340 ? 23.901 92.206 143.764 1.00 24.76 ? 340 GLN C NE2 1 +ATOM 5806 N N . GLU C 3 341 ? 19.351 86.761 142.256 1.00 16.53 ? 341 GLU C N 1 +ATOM 5807 C CA . GLU C 3 341 ? 18.882 85.488 141.725 1.00 16.85 ? 341 GLU C CA 1 +ATOM 5808 C C . GLU C 3 341 ? 18.654 85.537 140.214 1.00 16.89 ? 341 GLU C C 1 +ATOM 5809 O O . GLU C 3 341 ? 18.452 84.492 139.572 1.00 16.32 ? 341 GLU C O 1 +ATOM 5810 C CB . GLU C 3 341 ? 17.614 85.060 142.430 1.00 16.74 ? 341 GLU C CB 1 +ATOM 5811 C CG . GLU C 3 341 ? 17.894 84.418 143.774 1.00 19.63 ? 341 GLU C CG 1 +ATOM 5812 C CD . GLU C 3 341 ? 16.647 84.099 144.585 1.00 21.10 ? 341 GLU C CD 1 +ATOM 5813 O OE1 . GLU C 3 341 ? 15.662 83.574 144.012 1.00 22.29 ? 341 GLU C OE1 1 +ATOM 5814 O OE2 . GLU C 3 341 ? 16.678 84.345 145.811 1.00 22.26 ? 341 GLU C OE2 1 +ATOM 5815 N N . PHE C 3 342 ? 18.713 86.753 139.664 1.00 16.89 ? 342 PHE C N 1 +ATOM 5816 C CA . PHE C 3 342 ? 18.437 87.001 138.245 1.00 17.39 ? 342 PHE C CA 1 +ATOM 5817 C C . PHE C 3 342 ? 19.660 87.382 137.455 1.00 16.70 ? 342 PHE C C 1 +ATOM 5818 O O . PHE C 3 342 ? 19.570 87.595 136.262 1.00 16.82 ? 342 PHE C O 1 +ATOM 5819 C CB . PHE C 3 342 ? 17.322 88.061 138.088 1.00 17.72 ? 342 PHE C CB 1 +ATOM 5820 C CG . PHE C 3 342 ? 16.067 87.670 138.792 1.00 19.10 ? 342 PHE C CG 1 +ATOM 5821 C CD1 . PHE C 3 342 ? 15.702 88.285 139.976 1.00 18.53 ? 342 PHE C CD1 1 +ATOM 5822 C CD2 . PHE C 3 342 ? 15.304 86.610 138.318 1.00 19.21 ? 342 PHE C CD2 1 +ATOM 5823 C CE1 . PHE C 3 342 ? 14.559 87.893 140.648 1.00 19.82 ? 342 PHE C CE1 1 +ATOM 5824 C CE2 . PHE C 3 342 ? 14.169 86.197 138.999 1.00 20.69 ? 342 PHE C CE2 1 +ATOM 5825 C CZ . PHE C 3 342 ? 13.788 86.850 140.166 1.00 20.18 ? 342 PHE C CZ 1 +ATOM 5826 N N . ALA C 3 343 ? 20.802 87.476 138.127 1.00 16.88 ? 343 ALA C N 1 +ATOM 5827 C CA . ALA C 3 343 ? 22.055 87.766 137.448 1.00 16.06 ? 343 ALA C CA 1 +ATOM 5828 C C . ALA C 3 343 ? 22.296 86.774 136.307 1.00 15.97 ? 343 ALA C C 1 +ATOM 5829 O O . ALA C 3 343 ? 22.364 85.555 136.528 1.00 15.24 ? 343 ALA C O 1 +ATOM 5830 C CB . ALA C 3 343 ? 23.177 87.740 138.421 1.00 15.58 ? 343 ALA C CB 1 +ATOM 5831 N N . GLY C 3 344 ? 22.377 87.322 135.089 1.00 16.04 ? 344 GLY C N 1 +ATOM 5832 C CA . GLY C 3 344 ? 22.832 86.590 133.920 1.00 16.31 ? 344 GLY C CA 1 +ATOM 5833 C C . GLY C 3 344 ? 21.720 85.925 133.141 1.00 16.48 ? 344 GLY C C 1 +ATOM 5834 O O . GLY C 3 344 ? 21.956 85.336 132.103 1.00 16.05 ? 344 GLY C O 1 +ATOM 5835 N N . CYS C 3 345 ? 20.503 86.052 133.644 1.00 16.90 ? 345 CYS C N 1 +ATOM 5836 C CA . CYS C 3 345 ? 19.342 85.379 133.091 1.00 18.16 ? 345 CYS C CA 1 +ATOM 5837 C C . CYS C 3 345 ? 18.767 85.994 131.784 1.00 18.00 ? 345 CYS C C 1 +ATOM 5838 O O . CYS C 3 345 ? 18.326 87.141 131.778 1.00 17.77 ? 345 CYS C O 1 +ATOM 5839 C CB . CYS C 3 345 ? 18.267 85.300 134.196 1.00 18.50 ? 345 CYS C CB 1 +ATOM 5840 S SG . CYS C 3 345 ? 18.604 84.031 135.492 1.00 21.88 ? 345 CYS C SG 1 +ATOM 5841 N N . LYS C 3 346 ? 18.777 85.233 130.686 1.00 17.67 ? 346 LYS C N 1 +ATOM 5842 C CA . LYS C 3 346 ? 18.122 85.659 129.433 1.00 17.83 ? 346 LYS C CA 1 +ATOM 5843 C C . LYS C 3 346 ? 16.611 85.532 129.477 1.00 16.82 ? 346 LYS C C 1 +ATOM 5844 O O . LYS C 3 346 ? 15.907 86.209 128.771 1.00 17.01 ? 346 LYS C O 1 +ATOM 5845 C CB . LYS C 3 346 ? 18.588 84.820 128.238 1.00 18.79 ? 346 LYS C CB 1 +ATOM 5846 C CG . LYS C 3 346 ? 19.957 85.173 127.645 1.00 22.03 ? 346 LYS C CG 1 +ATOM 5847 C CD . LYS C 3 346 ? 20.041 84.739 126.152 1.00 27.20 ? 346 LYS C CD 1 +ATOM 5848 C CE . LYS C 3 346 ? 21.425 84.175 125.801 1.00 30.15 ? 346 LYS C CE 1 +ATOM 5849 N NZ . LYS C 3 346 ? 22.160 83.764 127.046 1.00 30.24 ? 346 LYS C NZ 1 +ATOM 5850 N N . LYS C 3 347 ? 16.109 84.621 130.288 1.00 16.55 ? 347 LYS C N 1 +ATOM 5851 C CA . LYS C 3 347 ? 14.700 84.237 130.238 1.00 15.17 ? 347 LYS C CA 1 +ATOM 5852 C C . LYS C 3 347 ? 14.308 83.819 131.634 1.00 13.99 ? 347 LYS C C 1 +ATOM 5853 O O . LYS C 3 347 ? 14.969 82.967 132.231 1.00 13.14 ? 347 LYS C O 1 +ATOM 5854 C CB . LYS C 3 347 ? 14.508 83.083 129.243 1.00 15.07 ? 347 LYS C CB 1 +ATOM 5855 C CG . LYS C 3 347 ? 13.098 82.545 129.098 1.00 15.90 ? 347 LYS C CG 1 +ATOM 5856 C CD . LYS C 3 347 ? 13.086 81.274 128.223 1.00 16.91 ? 347 LYS C CD 1 +ATOM 5857 C CE . LYS C 3 347 ? 11.661 80.923 127.766 1.00 17.50 ? 347 LYS C CE 1 +ATOM 5858 N NZ . LYS C 3 347 ? 11.533 79.655 126.934 1.00 18.48 ? 347 LYS C NZ 1 +ATOM 5859 N N . ILE C 3 348 ? 13.257 84.458 132.140 1.00 13.34 ? 348 ILE C N 1 +ATOM 5860 C CA . ILE C 3 348 ? 12.738 84.200 133.470 1.00 13.41 ? 348 ILE C CA 1 +ATOM 5861 C C . ILE C 3 348 ? 11.396 83.465 133.326 1.00 14.15 ? 348 ILE C C 1 +ATOM 5862 O O . ILE C 3 348 ? 10.486 83.922 132.617 1.00 14.31 ? 348 ILE C O 1 +ATOM 5863 C CB . ILE C 3 348 ? 12.586 85.519 134.270 1.00 13.30 ? 348 ILE C CB 1 +ATOM 5864 C CG1 . ILE C 3 348 ? 13.953 86.142 134.563 1.00 12.47 ? 348 ILE C CG1 1 +ATOM 5865 C CG2 . ILE C 3 348 ? 11.853 85.281 135.581 1.00 11.56 ? 348 ILE C CG2 1 +ATOM 5866 C CD1 . ILE C 3 348 ? 13.897 87.552 135.146 1.00 11.95 ? 348 ILE C CD1 1 +ATOM 5867 N N . PHE C 3 349 ? 11.318 82.301 133.959 1.00 14.25 ? 349 PHE C N 1 +ATOM 5868 C CA . PHE C 3 349 ? 10.128 81.470 133.968 1.00 14.17 ? 349 PHE C CA 1 +ATOM 5869 C C . PHE C 3 349 ? 9.300 81.887 135.162 1.00 13.95 ? 349 PHE C C 1 +ATOM 5870 O O . PHE C 3 349 ? 9.573 81.474 136.277 1.00 14.02 ? 349 PHE C O 1 +ATOM 5871 C CB . PHE C 3 349 ? 10.540 80.011 134.099 1.00 13.97 ? 349 PHE C CB 1 +ATOM 5872 C CG . PHE C 3 349 ? 11.129 79.443 132.832 1.00 14.66 ? 349 PHE C CG 1 +ATOM 5873 C CD1 . PHE C 3 349 ? 12.407 79.843 132.391 1.00 11.25 ? 349 PHE C CD1 1 +ATOM 5874 C CD2 . PHE C 3 349 ? 10.401 78.525 132.060 1.00 12.26 ? 349 PHE C CD2 1 +ATOM 5875 C CE1 . PHE C 3 349 ? 12.947 79.317 131.211 1.00 11.30 ? 349 PHE C CE1 1 +ATOM 5876 C CE2 . PHE C 3 349 ? 10.935 78.007 130.871 1.00 12.64 ? 349 PHE C CE2 1 +ATOM 5877 C CZ . PHE C 3 349 ? 12.215 78.393 130.444 1.00 10.22 ? 349 PHE C CZ 1 +ATOM 5878 N N . GLY C 3 350 ? 8.295 82.719 134.926 1.00 13.96 ? 350 GLY C N 1 +ATOM 5879 C CA . GLY C 3 350 ? 7.508 83.276 136.007 1.00 14.02 ? 350 GLY C CA 1 +ATOM 5880 C C . GLY C 3 350 ? 7.531 84.767 135.838 1.00 14.20 ? 350 GLY C C 1 +ATOM 5881 O O . GLY C 3 350 ? 7.721 85.243 134.712 1.00 14.17 ? 350 GLY C O 1 +ATOM 5882 N N . SER C 3 351 ? 7.402 85.500 136.942 1.00 14.76 ? 351 SER C N 1 +ATOM 5883 C CA . SER C 3 351 ? 7.182 86.936 136.875 1.00 15.65 ? 351 SER C CA 1 +ATOM 5884 C C . SER C 3 351 ? 8.185 87.808 137.602 1.00 16.55 ? 351 SER C C 1 +ATOM 5885 O O . SER C 3 351 ? 9.179 87.333 138.203 1.00 17.37 ? 351 SER C O 1 +ATOM 5886 C CB . SER C 3 351 ? 5.828 87.252 137.446 1.00 16.20 ? 351 SER C CB 1 +ATOM 5887 O OG . SER C 3 351 ? 4.821 86.509 136.787 1.00 18.91 ? 351 SER C OG 1 +ATOM 5888 N N . LEU C 3 352 ? 7.912 89.104 137.521 1.00 16.14 ? 352 LEU C N 1 +ATOM 5889 C CA . LEU C 3 352 ? 8.640 90.103 138.248 1.00 15.63 ? 352 LEU C CA 1 +ATOM 5890 C C . LEU C 3 352 ? 7.691 91.203 138.706 1.00 15.75 ? 352 LEU C C 1 +ATOM 5891 O O . LEU C 3 352 ? 6.906 91.750 137.940 1.00 15.53 ? 352 LEU C O 1 +ATOM 5892 C CB . LEU C 3 352 ? 9.730 90.692 137.375 1.00 16.11 ? 352 LEU C CB 1 +ATOM 5893 C CG . LEU C 3 352 ? 10.936 89.865 136.943 1.00 15.29 ? 352 LEU C CG 1 +ATOM 5894 C CD1 . LEU C 3 352 ? 11.780 90.779 136.129 1.00 10.81 ? 352 LEU C CD1 1 +ATOM 5895 C CD2 . LEU C 3 352 ? 11.702 89.267 138.129 1.00 13.66 ? 352 LEU C CD2 1 +ATOM 5896 N N . ALA C 3 353 ? 7.762 91.512 139.980 1.00 16.06 ? 353 ALA C N 1 +ATOM 5897 C CA . ALA C 3 353 ? 6.926 92.530 140.534 1.00 16.16 ? 353 ALA C CA 1 +ATOM 5898 C C . ALA C 3 353 ? 7.800 93.415 141.421 1.00 16.41 ? 353 ALA C C 1 +ATOM 5899 O O . ALA C 3 353 ? 8.611 92.924 142.223 1.00 16.37 ? 353 ALA C O 1 +ATOM 5900 C CB . ALA C 3 353 ? 5.802 91.916 141.303 1.00 15.88 ? 353 ALA C CB 1 +ATOM 5901 N N . PHE C 3 354 ? 7.664 94.723 141.221 1.00 15.90 ? 354 PHE C N 1 +ATOM 5902 C CA . PHE C 3 354 ? 8.280 95.678 142.078 1.00 15.13 ? 354 PHE C CA 1 +ATOM 5903 C C . PHE C 3 354 ? 7.191 96.478 142.750 1.00 16.13 ? 354 PHE C C 1 +ATOM 5904 O O . PHE C 3 354 ? 6.378 97.113 142.090 1.00 17.00 ? 354 PHE C O 1 +ATOM 5905 C CB . PHE C 3 354 ? 9.150 96.536 141.223 1.00 15.12 ? 354 PHE C CB 1 +ATOM 5906 C CG . PHE C 3 354 ? 10.144 95.748 140.421 1.00 13.58 ? 354 PHE C CG 1 +ATOM 5907 C CD1 . PHE C 3 354 ? 9.783 95.179 139.225 1.00 9.37 ? 354 PHE C CD1 1 +ATOM 5908 C CD2 . PHE C 3 354 ? 11.456 95.568 140.881 1.00 12.93 ? 354 PHE C CD2 1 +ATOM 5909 C CE1 . PHE C 3 354 ? 10.692 94.432 138.497 1.00 10.71 ? 354 PHE C CE1 1 +ATOM 5910 C CE2 . PHE C 3 354 ? 12.382 94.817 140.136 1.00 9.91 ? 354 PHE C CE2 1 +ATOM 5911 C CZ . PHE C 3 354 ? 12.003 94.274 138.949 1.00 9.87 ? 354 PHE C CZ 1 +ATOM 5912 N N . LEU C 3 355 ? 7.186 96.423 144.080 1.00 16.67 ? 355 LEU C N 1 +ATOM 5913 C CA . LEU C 3 355 ? 6.176 97.035 144.946 1.00 16.16 ? 355 LEU C CA 1 +ATOM 5914 C C . LEU C 3 355 ? 6.912 97.972 145.881 1.00 17.09 ? 355 LEU C C 1 +ATOM 5915 O O . LEU C 3 355 ? 8.131 97.896 145.970 1.00 16.97 ? 355 LEU C O 1 +ATOM 5916 C CB . LEU C 3 355 ? 5.463 95.938 145.762 1.00 15.27 ? 355 LEU C CB 1 +ATOM 5917 C CG . LEU C 3 355 ? 4.466 95.019 145.050 1.00 12.69 ? 355 LEU C CG 1 +ATOM 5918 C CD1 . LEU C 3 355 ? 5.148 94.101 144.010 1.00 14.48 ? 355 LEU C CD1 1 +ATOM 5919 C CD2 . LEU C 3 355 ? 3.797 94.189 146.016 1.00 11.08 ? 355 LEU C CD2 1 +ATOM 5920 N N . PRO C 3 356 ? 6.205 98.876 146.560 1.00 17.77 ? 356 PRO C N 1 +ATOM 5921 C CA . PRO C 3 356 ? 6.861 99.785 147.508 1.00 18.29 ? 356 PRO C CA 1 +ATOM 5922 C C . PRO C 3 356 ? 7.943 99.073 148.333 1.00 18.85 ? 356 PRO C C 1 +ATOM 5923 O O . PRO C 3 356 ? 9.087 99.505 148.352 1.00 19.12 ? 356 PRO C O 1 +ATOM 5924 C CB . PRO C 3 356 ? 5.707 100.273 148.413 1.00 17.99 ? 356 PRO C CB 1 +ATOM 5925 C CG . PRO C 3 356 ? 4.458 99.995 147.669 1.00 18.41 ? 356 PRO C CG 1 +ATOM 5926 C CD . PRO C 3 356 ? 4.758 99.141 146.444 1.00 17.75 ? 356 PRO C CD 1 +ATOM 5927 N N . GLU C 3 357 ? 7.578 97.973 148.979 1.00 19.62 ? 357 GLU C N 1 +ATOM 5928 C CA . GLU C 3 357 ? 8.493 97.187 149.804 1.00 20.04 ? 357 GLU C CA 1 +ATOM 5929 C C . GLU C 3 357 ? 9.792 96.762 149.113 1.00 19.36 ? 357 GLU C C 1 +ATOM 5930 O O . GLU C 3 357 ? 10.741 96.329 149.779 1.00 18.70 ? 357 GLU C O 1 +ATOM 5931 C CB . GLU C 3 357 ? 7.762 95.946 150.321 1.00 20.88 ? 357 GLU C CB 1 +ATOM 5932 C CG . GLU C 3 357 ? 7.274 95.025 149.222 1.00 23.81 ? 357 GLU C CG 1 +ATOM 5933 C CD . GLU C 3 357 ? 5.911 94.437 149.524 1.00 29.96 ? 357 GLU C CD 1 +ATOM 5934 O OE1 . GLU C 3 357 ? 5.884 93.240 149.934 1.00 31.77 ? 357 GLU C OE1 1 +ATOM 5935 O OE2 . GLU C 3 357 ? 4.882 95.164 149.336 1.00 30.51 ? 357 GLU C OE2 1 +ATOM 5936 N N . SER C 3 358 ? 9.817 96.858 147.784 1.00 19.03 ? 358 SER C N 1 +ATOM 5937 C CA . SER C 3 358 ? 11.037 96.638 146.993 1.00 18.86 ? 358 SER C CA 1 +ATOM 5938 C C . SER C 3 358 ? 12.076 97.746 147.252 1.00 19.38 ? 358 SER C C 1 +ATOM 5939 O O . SER C 3 358 ? 13.279 97.496 147.268 1.00 18.81 ? 358 SER C O 1 +ATOM 5940 C CB . SER C 3 358 ? 10.689 96.563 145.502 1.00 18.58 ? 358 SER C CB 1 +ATOM 5941 O OG . SER C 3 358 ? 9.872 95.431 145.172 1.00 17.02 ? 358 SER C OG 1 +ATOM 5942 N N . PHE C 3 359 ? 11.595 98.964 147.486 1.00 20.71 ? 359 PHE C N 1 +ATOM 5943 C CA . PHE C 3 359 ? 12.455 100.123 147.727 1.00 22.43 ? 359 PHE C CA 1 +ATOM 5944 C C . PHE C 3 359 ? 12.151 100.665 149.136 1.00 24.03 ? 359 PHE C C 1 +ATOM 5945 O O . PHE C 3 359 ? 12.328 99.912 150.094 1.00 24.46 ? 359 PHE C O 1 +ATOM 5946 C CB . PHE C 3 359 ? 12.293 101.105 146.562 1.00 22.25 ? 359 PHE C CB 1 +ATOM 5947 C CG . PHE C 3 359 ? 12.408 100.427 145.204 1.00 21.17 ? 359 PHE C CG 1 +ATOM 5948 C CD1 . PHE C 3 359 ? 11.274 100.035 144.495 1.00 21.12 ? 359 PHE C CD1 1 +ATOM 5949 C CD2 . PHE C 3 359 ? 13.650 100.129 144.665 1.00 20.76 ? 359 PHE C CD2 1 +ATOM 5950 C CE1 . PHE C 3 359 ? 11.382 99.378 143.245 1.00 19.88 ? 359 PHE C CE1 1 +ATOM 5951 C CE2 . PHE C 3 359 ? 13.768 99.461 143.412 1.00 21.57 ? 359 PHE C CE2 1 +ATOM 5952 C CZ . PHE C 3 359 ? 12.636 99.087 142.712 1.00 19.46 ? 359 PHE C CZ 1 +ATOM 5953 N N . ASP C 3 360 ? 11.684 101.908 149.307 1.00 26.02 ? 360 ASP C N 1 +ATOM 5954 C CA . ASP C 3 360 ? 11.138 102.320 150.627 1.00 27.64 ? 360 ASP C CA 1 +ATOM 5955 C C . ASP C 3 360 ? 9.605 102.375 150.640 1.00 27.83 ? 360 ASP C C 1 +ATOM 5956 O O . ASP C 3 360 ? 8.947 101.806 151.525 1.00 28.38 ? 360 ASP C O 1 +ATOM 5957 C CB . ASP C 3 360 ? 11.732 103.641 151.192 1.00 28.35 ? 360 ASP C CB 1 +ATOM 5958 C CG . ASP C 3 360 ? 12.694 104.364 150.217 1.00 30.77 ? 360 ASP C CG 1 +ATOM 5959 O OD1 . ASP C 3 360 ? 12.884 103.916 149.051 1.00 31.43 ? 360 ASP C OD1 1 +ATOM 5960 O OD2 . ASP C 3 360 ? 13.309 105.414 150.565 1.00 33.57 ? 360 ASP C OD2 1 +ATOM 5961 N N . SER C 3 365 ? 8.602 97.222 156.676 1.00 17.79 ? 365 SER C N 1 +ATOM 5962 C CA . SER C 3 365 ? 9.694 96.398 156.153 1.00 17.54 ? 365 SER C CA 1 +ATOM 5963 C C . SER C 3 365 ? 11.052 96.856 156.669 1.00 17.64 ? 365 SER C C 1 +ATOM 5964 O O . SER C 3 365 ? 11.522 97.937 156.305 1.00 17.70 ? 365 SER C O 1 +ATOM 5965 C CB . SER C 3 365 ? 9.697 96.364 154.607 1.00 17.74 ? 365 SER C CB 1 +ATOM 5966 O OG . SER C 3 365 ? 10.634 97.275 154.040 1.00 16.67 ? 365 SER C OG 1 +ATOM 5967 N N . ASN C 3 366 ? 11.680 96.034 157.510 1.00 17.36 ? 366 ASN C N 1 +ATOM 5968 C CA . ASN C 3 366 ? 13.072 96.273 157.898 1.00 17.22 ? 366 ASN C CA 1 +ATOM 5969 C C . ASN C 3 366 ? 14.097 95.877 156.806 1.00 16.32 ? 366 ASN C C 1 +ATOM 5970 O O . ASN C 3 366 ? 15.292 96.092 156.946 1.00 16.72 ? 366 ASN C O 1 +ATOM 5971 C CB . ASN C 3 366 ? 13.373 95.602 159.237 1.00 17.33 ? 366 ASN C CB 1 +ATOM 5972 C CG . ASN C 3 366 ? 12.772 96.359 160.387 1.00 19.84 ? 366 ASN C CG 1 +ATOM 5973 O OD1 . ASN C 3 366 ? 12.180 97.417 160.177 1.00 22.65 ? 366 ASN C OD1 1 +ATOM 5974 N ND2 . ASN C 3 366 ? 12.916 95.840 161.613 1.00 22.07 ? 366 ASN C ND2 1 +ATOM 5975 N N . THR C 3 367 ? 13.606 95.337 155.713 1.00 14.57 ? 367 THR C N 1 +ATOM 5976 C CA . THR C 3 367 ? 14.430 94.749 154.683 1.00 14.10 ? 367 THR C CA 1 +ATOM 5977 C C . THR C 3 367 ? 15.134 95.773 153.790 1.00 13.63 ? 367 THR C C 1 +ATOM 5978 O O . THR C 3 367 ? 14.461 96.566 153.132 1.00 14.07 ? 367 THR C O 1 +ATOM 5979 C CB . THR C 3 367 ? 13.502 93.873 153.834 1.00 14.13 ? 367 THR C CB 1 +ATOM 5980 O OG1 . THR C 3 367 ? 12.998 92.829 154.672 1.00 14.14 ? 367 THR C OG1 1 +ATOM 5981 C CG2 . THR C 3 367 ? 14.248 93.158 152.725 1.00 12.88 ? 367 THR C CG2 1 +ATOM 5982 N N . ALA C 3 368 ? 16.470 95.709 153.726 1.00 12.19 ? 368 ALA C N 1 +ATOM 5983 C CA . ALA C 3 368 ? 17.280 96.610 152.901 1.00 10.85 ? 368 ALA C CA 1 +ATOM 5984 C C . ALA C 3 368 ? 16.691 96.880 151.508 1.00 10.68 ? 368 ALA C C 1 +ATOM 5985 O O . ALA C 3 368 ? 16.340 95.936 150.786 1.00 10.07 ? 368 ALA C O 1 +ATOM 5986 C CB . ALA C 3 368 ? 18.655 96.061 152.766 1.00 10.91 ? 368 ALA C CB 1 +ATOM 5987 N N . PRO C 3 369 ? 16.585 98.161 151.131 1.00 10.41 ? 369 PRO C N 1 +ATOM 5988 C CA . PRO C 3 369 ? 16.007 98.547 149.830 1.00 10.58 ? 369 PRO C CA 1 +ATOM 5989 C C . PRO C 3 369 ? 16.865 98.243 148.589 1.00 11.13 ? 369 PRO C C 1 +ATOM 5990 O O . PRO C 3 369 ? 18.066 98.409 148.609 1.00 10.93 ? 369 PRO C O 1 +ATOM 5991 C CB . PRO C 3 369 ? 15.786 100.066 149.973 1.00 10.30 ? 369 PRO C CB 1 +ATOM 5992 C CG . PRO C 3 369 ? 16.694 100.514 151.065 1.00 9.32 ? 369 PRO C CG 1 +ATOM 5993 C CD . PRO C 3 369 ? 16.991 99.333 151.931 1.00 9.88 ? 369 PRO C CD 1 +ATOM 5994 N N . LEU C 3 370 ? 16.222 97.808 147.512 1.00 12.52 ? 370 LEU C N 1 +ATOM 5995 C CA . LEU C 3 370 ? 16.827 97.818 146.173 1.00 13.76 ? 370 LEU C CA 1 +ATOM 5996 C C . LEU C 3 370 ? 17.379 99.184 145.788 1.00 14.16 ? 370 LEU C C 1 +ATOM 5997 O O . LEU C 3 370 ? 16.616 100.148 145.628 1.00 14.59 ? 370 LEU C O 1 +ATOM 5998 C CB . LEU C 3 370 ? 15.774 97.472 145.129 1.00 13.55 ? 370 LEU C CB 1 +ATOM 5999 C CG . LEU C 3 370 ? 15.790 96.127 144.424 1.00 15.33 ? 370 LEU C CG 1 +ATOM 6000 C CD1 . LEU C 3 370 ? 16.171 95.061 145.385 1.00 18.52 ? 370 LEU C CD1 1 +ATOM 6001 C CD2 . LEU C 3 370 ? 14.388 95.833 143.870 1.00 16.77 ? 370 LEU C CD2 1 +ATOM 6002 N N . GLN C 3 371 ? 18.692 99.271 145.634 1.00 14.42 ? 371 GLN C N 1 +ATOM 6003 C CA . GLN C 3 371 ? 19.285 100.459 145.048 1.00 14.97 ? 371 GLN C CA 1 +ATOM 6004 C C . GLN C 3 371 ? 19.161 100.372 143.541 1.00 14.59 ? 371 GLN C C 1 +ATOM 6005 O O . GLN C 3 371 ? 19.298 99.310 142.976 1.00 14.34 ? 371 GLN C O 1 +ATOM 6006 C CB . GLN C 3 371 ? 20.742 100.581 145.465 1.00 15.32 ? 371 GLN C CB 1 +ATOM 6007 C CG . GLN C 3 371 ? 20.966 100.345 146.953 1.00 17.41 ? 371 GLN C CG 1 +ATOM 6008 C CD . GLN C 3 371 ? 20.434 101.483 147.852 1.00 20.25 ? 371 GLN C CD 1 +ATOM 6009 O OE1 . GLN C 3 371 ? 19.828 102.456 147.369 1.00 19.65 ? 371 GLN C OE1 1 +ATOM 6010 N NE2 . GLN C 3 371 ? 20.679 101.356 149.164 1.00 20.35 ? 371 GLN C NE2 1 +ATOM 6011 N N . PRO C 3 372 ? 18.930 101.487 142.874 1.00 14.92 ? 372 PRO C N 1 +ATOM 6012 C CA . PRO C 3 372 ? 18.660 101.465 141.426 1.00 15.26 ? 372 PRO C CA 1 +ATOM 6013 C C . PRO C 3 372 ? 19.665 100.672 140.573 1.00 15.77 ? 372 PRO C C 1 +ATOM 6014 O O . PRO C 3 372 ? 19.280 100.148 139.530 1.00 15.79 ? 372 PRO C O 1 +ATOM 6015 C CB . PRO C 3 372 ? 18.699 102.940 141.048 1.00 14.95 ? 372 PRO C CB 1 +ATOM 6016 C CG . PRO C 3 372 ? 18.330 103.633 142.298 1.00 15.25 ? 372 PRO C CG 1 +ATOM 6017 C CD . PRO C 3 372 ? 18.958 102.854 143.415 1.00 14.77 ? 372 PRO C CD 1 +ATOM 6018 N N . GLU C 3 373 ? 20.922 100.592 141.004 1.00 16.33 ? 373 GLU C N 1 +ATOM 6019 C CA . GLU C 3 373 ? 21.975 99.960 140.194 1.00 17.46 ? 373 GLU C CA 1 +ATOM 6020 C C . GLU C 3 373 ? 21.906 98.425 140.231 1.00 17.18 ? 373 GLU C C 1 +ATOM 6021 O O . GLU C 3 373 ? 22.383 97.745 139.322 1.00 17.17 ? 373 GLU C O 1 +ATOM 6022 C CB . GLU C 3 373 ? 23.378 100.471 140.585 1.00 17.01 ? 373 GLU C CB 1 +ATOM 6023 C CG . GLU C 3 373 ? 23.537 100.755 142.079 1.00 20.31 ? 373 GLU C CG 1 +ATOM 6024 C CD . GLU C 3 373 ? 23.344 102.237 142.454 1.00 23.05 ? 373 GLU C CD 1 +ATOM 6025 O OE1 . GLU C 3 373 ? 24.370 102.911 142.777 1.00 24.16 ? 373 GLU C OE1 1 +ATOM 6026 O OE2 . GLU C 3 373 ? 22.173 102.721 142.439 1.00 20.48 ? 373 GLU C OE2 1 +ATOM 6027 N N . GLN C 3 374 ? 21.311 97.887 141.289 1.00 16.90 ? 374 GLN C N 1 +ATOM 6028 C CA . GLN C 3 374 ? 21.120 96.456 141.394 1.00 16.45 ? 374 GLN C CA 1 +ATOM 6029 C C . GLN C 3 374 ? 20.222 96.029 140.270 1.00 16.32 ? 374 GLN C C 1 +ATOM 6030 O O . GLN C 3 374 ? 20.419 94.950 139.691 1.00 16.15 ? 374 GLN C O 1 +ATOM 6031 C CB . GLN C 3 374 ? 20.535 96.075 142.756 1.00 16.34 ? 374 GLN C CB 1 +ATOM 6032 C CG . GLN C 3 374 ? 21.641 95.634 143.732 1.00 16.92 ? 374 GLN C CG 1 +ATOM 6033 C CD . GLN C 3 374 ? 21.212 95.647 145.170 1.00 16.37 ? 374 GLN C CD 1 +ATOM 6034 O OE1 . GLN C 3 374 ? 20.596 96.599 145.607 1.00 17.69 ? 374 GLN C OE1 1 +ATOM 6035 N NE2 . GLN C 3 374 ? 21.544 94.587 145.916 1.00 17.71 ? 374 GLN C NE2 1 +ATOM 6036 N N . LEU C 3 375 ? 19.274 96.913 139.941 1.00 15.88 ? 375 LEU C N 1 +ATOM 6037 C CA . LEU C 3 375 ? 18.275 96.677 138.910 1.00 15.67 ? 375 LEU C CA 1 +ATOM 6038 C C . LEU C 3 375 ? 18.899 96.336 137.580 1.00 15.54 ? 375 LEU C C 1 +ATOM 6039 O O . LEU C 3 375 ? 18.326 95.623 136.765 1.00 16.14 ? 375 LEU C O 1 +ATOM 6040 C CB . LEU C 3 375 ? 17.367 97.883 138.744 1.00 15.82 ? 375 LEU C CB 1 +ATOM 6041 C CG . LEU C 3 375 ? 16.440 98.163 139.917 1.00 15.65 ? 375 LEU C CG 1 +ATOM 6042 C CD1 . LEU C 3 375 ? 15.579 99.411 139.714 1.00 13.48 ? 375 LEU C CD1 1 +ATOM 6043 C CD2 . LEU C 3 375 ? 15.574 96.944 140.101 1.00 14.66 ? 375 LEU C CD2 1 +ATOM 6044 N N . GLN C 3 376 ? 20.095 96.823 137.366 1.00 15.35 ? 376 GLN C N 1 +ATOM 6045 C CA . GLN C 3 376 ? 20.798 96.500 136.148 1.00 15.33 ? 376 GLN C CA 1 +ATOM 6046 C C . GLN C 3 376 ? 20.917 95.003 135.865 1.00 14.64 ? 376 GLN C C 1 +ATOM 6047 O O . GLN C 3 376 ? 21.234 94.654 134.744 1.00 14.88 ? 376 GLN C O 1 +ATOM 6048 C CB . GLN C 3 376 ? 22.178 97.188 136.104 1.00 15.74 ? 376 GLN C CB 1 +ATOM 6049 C CG . GLN C 3 376 ? 22.120 98.639 135.613 1.00 17.44 ? 376 GLN C CG 1 +ATOM 6050 C CD . GLN C 3 376 ? 23.229 99.482 136.207 1.00 22.54 ? 376 GLN C CD 1 +ATOM 6051 O OE1 . GLN C 3 376 ? 24.359 99.001 136.397 1.00 22.59 ? 376 GLN C OE1 1 +ATOM 6052 N NE2 . GLN C 3 376 ? 22.914 100.744 136.523 1.00 23.98 ? 376 GLN C NE2 1 +ATOM 6053 N N . VAL C 3 377 ? 20.667 94.115 136.832 1.00 14.02 ? 377 VAL C N 1 +ATOM 6054 C CA . VAL C 3 377 ? 20.763 92.680 136.536 1.00 13.76 ? 377 VAL C CA 1 +ATOM 6055 C C . VAL C 3 377 ? 19.917 92.316 135.326 1.00 13.86 ? 377 VAL C C 1 +ATOM 6056 O O . VAL C 3 377 ? 20.217 91.352 134.623 1.00 15.45 ? 377 VAL C O 1 +ATOM 6057 C CB . VAL C 3 377 ? 20.249 91.749 137.652 1.00 13.63 ? 377 VAL C CB 1 +ATOM 6058 C CG1 . VAL C 3 377 ? 21.346 91.355 138.577 1.00 14.12 ? 377 VAL C CG1 1 +ATOM 6059 C CG2 . VAL C 3 377 ? 19.065 92.341 138.372 1.00 13.53 ? 377 VAL C CG2 1 +ATOM 6060 N N . PHE C 3 378 ? 18.874 93.087 135.083 1.00 13.14 ? 378 PHE C N 1 +ATOM 6061 C CA . PHE C 3 378 ? 17.848 92.745 134.107 1.00 13.36 ? 378 PHE C CA 1 +ATOM 6062 C C . PHE C 3 378 ? 18.225 93.074 132.690 1.00 13.83 ? 378 PHE C C 1 +ATOM 6063 O O . PHE C 3 378 ? 17.443 92.857 131.761 1.00 12.47 ? 378 PHE C O 1 +ATOM 6064 C CB . PHE C 3 378 ? 16.549 93.439 134.482 1.00 12.71 ? 378 PHE C CB 1 +ATOM 6065 C CG . PHE C 3 378 ? 15.957 92.901 135.730 1.00 13.97 ? 378 PHE C CG 1 +ATOM 6066 C CD1 . PHE C 3 378 ? 15.735 93.738 136.826 1.00 11.88 ? 378 PHE C CD1 1 +ATOM 6067 C CD2 . PHE C 3 378 ? 15.681 91.513 135.837 1.00 12.67 ? 378 PHE C CD2 1 +ATOM 6068 C CE1 . PHE C 3 378 ? 15.210 93.235 137.997 1.00 11.59 ? 378 PHE C CE1 1 +ATOM 6069 C CE2 . PHE C 3 378 ? 15.157 90.987 136.990 1.00 12.80 ? 378 PHE C CE2 1 +ATOM 6070 C CZ . PHE C 3 378 ? 14.914 91.853 138.091 1.00 14.79 ? 378 PHE C CZ 1 +ATOM 6071 N N . GLU C 3 379 ? 19.425 93.621 132.541 1.00 14.99 ? 379 GLU C N 1 +ATOM 6072 C CA . GLU C 3 379 ? 19.921 94.050 131.246 1.00 17.10 ? 379 GLU C CA 1 +ATOM 6073 C C . GLU C 3 379 ? 19.925 92.888 130.214 1.00 17.34 ? 379 GLU C C 1 +ATOM 6074 O O . GLU C 3 379 ? 19.557 93.097 129.064 1.00 16.98 ? 379 GLU C O 1 +ATOM 6075 C CB . GLU C 3 379 ? 21.282 94.726 131.420 1.00 17.38 ? 379 GLU C CB 1 +ATOM 6076 C CG . GLU C 3 379 ? 22.332 94.441 130.354 1.00 22.52 ? 379 GLU C CG 1 +ATOM 6077 C CD . GLU C 3 379 ? 23.772 94.764 130.814 1.00 28.50 ? 379 GLU C CD 1 +ATOM 6078 O OE1 . GLU C 3 379 ? 24.583 95.226 129.956 1.00 29.07 ? 379 GLU C OE1 1 +ATOM 6079 O OE2 . GLU C 3 379 ? 24.103 94.543 132.023 1.00 30.23 ? 379 GLU C OE2 1 +ATOM 6080 N N . THR C 3 380 ? 20.285 91.671 130.651 1.00 17.77 ? 380 THR C N 1 +ATOM 6081 C CA . THR C 3 380 ? 20.266 90.487 129.788 1.00 17.83 ? 380 THR C CA 1 +ATOM 6082 C C . THR C 3 380 ? 18.891 89.885 129.549 1.00 17.82 ? 380 THR C C 1 +ATOM 6083 O O . THR C 3 380 ? 18.762 88.992 128.717 1.00 19.18 ? 380 THR C O 1 +ATOM 6084 C CB . THR C 3 380 ? 21.117 89.356 130.380 1.00 17.99 ? 380 THR C CB 1 +ATOM 6085 O OG1 . THR C 3 380 ? 20.545 88.963 131.625 1.00 18.68 ? 380 THR C OG1 1 +ATOM 6086 C CG2 . THR C 3 380 ? 22.484 89.839 130.767 1.00 18.27 ? 380 THR C CG2 1 +ATOM 6087 N N . LEU C 3 381 ? 17.884 90.325 130.286 1.00 17.05 ? 381 LEU C N 1 +ATOM 6088 C CA . LEU C 3 381 ? 16.554 89.748 130.184 1.00 16.89 ? 381 LEU C CA 1 +ATOM 6089 C C . LEU C 3 381 ? 15.883 89.968 128.830 1.00 17.21 ? 381 LEU C C 1 +ATOM 6090 O O . LEU C 3 381 ? 15.671 91.093 128.418 1.00 17.33 ? 381 LEU C O 1 +ATOM 6091 C CB . LEU C 3 381 ? 15.640 90.292 131.299 1.00 16.44 ? 381 LEU C CB 1 +ATOM 6092 C CG . LEU C 3 381 ? 14.359 89.475 131.481 1.00 16.29 ? 381 LEU C CG 1 +ATOM 6093 C CD1 . LEU C 3 381 ? 14.652 88.046 131.913 1.00 15.51 ? 381 LEU C CD1 1 +ATOM 6094 C CD2 . LEU C 3 381 ? 13.398 90.115 132.399 1.00 15.31 ? 381 LEU C CD2 1 +ATOM 6095 N N . GLU C 3 382 ? 15.482 88.890 128.177 1.00 17.43 ? 382 GLU C N 1 +ATOM 6096 C CA . GLU C 3 382 ? 14.792 89.011 126.896 1.00 18.18 ? 382 GLU C CA 1 +ATOM 6097 C C . GLU C 3 382 ? 13.319 88.568 126.895 1.00 18.03 ? 382 GLU C C 1 +ATOM 6098 O O . GLU C 3 382 ? 12.505 89.098 126.141 1.00 17.95 ? 382 GLU C O 1 +ATOM 6099 C CB . GLU C 3 382 ? 15.569 88.259 125.844 1.00 18.12 ? 382 GLU C CB 1 +ATOM 6100 C CG . GLU C 3 382 ? 16.849 88.956 125.473 1.00 19.69 ? 382 GLU C CG 1 +ATOM 6101 C CD . GLU C 3 382 ? 17.659 88.095 124.582 1.00 23.28 ? 382 GLU C CD 1 +ATOM 6102 O OE1 . GLU C 3 382 ? 17.023 87.240 123.947 1.00 27.10 ? 382 GLU C OE1 1 +ATOM 6103 O OE2 . GLU C 3 382 ? 18.897 88.246 124.528 1.00 25.60 ? 382 GLU C OE2 1 +ATOM 6104 N N . GLU C 3 383 ? 13.001 87.609 127.757 1.00 17.60 ? 383 GLU C N 1 +ATOM 6105 C CA . GLU C 3 383 ? 11.682 87.031 127.858 1.00 16.81 ? 383 GLU C CA 1 +ATOM 6106 C C . GLU C 3 383 ? 11.277 86.848 129.308 1.00 15.36 ? 383 GLU C C 1 +ATOM 6107 O O . GLU C 3 383 ? 12.016 86.298 130.103 1.00 15.27 ? 383 GLU C O 1 +ATOM 6108 C CB . GLU C 3 383 ? 11.667 85.672 127.162 1.00 17.42 ? 383 GLU C CB 1 +ATOM 6109 C CG . GLU C 3 383 ? 10.307 84.971 127.224 1.00 21.45 ? 383 GLU C CG 1 +ATOM 6110 C CD . GLU C 3 383 ? 10.158 83.764 126.285 1.00 28.49 ? 383 GLU C CD 1 +ATOM 6111 O OE1 . GLU C 3 383 ? 9.920 82.645 126.799 1.00 30.11 ? 383 GLU C OE1 1 +ATOM 6112 O OE2 . GLU C 3 383 ? 10.237 83.913 125.027 1.00 32.44 ? 383 GLU C OE2 1 +ATOM 6113 N N . ILE C 3 384 ? 10.088 87.309 129.652 1.00 14.78 ? 384 ILE C N 1 +ATOM 6114 C CA . ILE C 3 384 ? 9.437 86.899 130.888 1.00 14.32 ? 384 ILE C CA 1 +ATOM 6115 C C . ILE C 3 384 ? 8.293 85.960 130.507 1.00 13.53 ? 384 ILE C C 1 +ATOM 6116 O O . ILE C 3 384 ? 7.489 86.314 129.689 1.00 14.41 ? 384 ILE C O 1 +ATOM 6117 C CB . ILE C 3 384 ? 8.915 88.115 131.637 1.00 14.29 ? 384 ILE C CB 1 +ATOM 6118 C CG1 . ILE C 3 384 ? 10.113 88.957 132.102 1.00 15.75 ? 384 ILE C CG1 1 +ATOM 6119 C CG2 . ILE C 3 384 ? 8.007 87.667 132.782 1.00 12.48 ? 384 ILE C CG2 1 +ATOM 6120 C CD1 . ILE C 3 384 ? 9.777 90.376 132.548 1.00 19.40 ? 384 ILE C CD1 1 +ATOM 6121 N N . THR C 3 385 ? 8.216 84.758 131.046 1.00 12.57 ? 385 THR C N 1 +ATOM 6122 C CA . THR C 3 385 ? 7.071 83.921 130.654 1.00 12.15 ? 385 THR C CA 1 +ATOM 6123 C C . THR C 3 385 ? 5.807 84.320 131.399 1.00 12.89 ? 385 THR C C 1 +ATOM 6124 O O . THR C 3 385 ? 4.688 83.974 130.980 1.00 13.13 ? 385 THR C O 1 +ATOM 6125 C CB . THR C 3 385 ? 7.334 82.384 130.798 1.00 11.17 ? 385 THR C CB 1 +ATOM 6126 O OG1 . THR C 3 385 ? 7.380 82.025 132.180 1.00 10.19 ? 385 THR C OG1 1 +ATOM 6127 C CG2 . THR C 3 385 ? 8.685 81.984 130.245 1.00 7.01 ? 385 THR C CG2 1 +ATOM 6128 N N . GLY C 3 386 ? 5.991 85.046 132.504 1.00 13.57 ? 386 GLY C N 1 +ATOM 6129 C CA . GLY C 3 386 ? 4.883 85.458 133.358 1.00 14.13 ? 386 GLY C CA 1 +ATOM 6130 C C . GLY C 3 386 ? 4.403 86.857 133.085 1.00 14.46 ? 386 GLY C C 1 +ATOM 6131 O O . GLY C 3 386 ? 4.028 87.166 131.948 1.00 13.86 ? 386 GLY C O 1 +ATOM 6132 N N . TYR C 3 387 ? 4.404 87.708 134.113 1.00 15.19 ? 387 TYR C N 1 +ATOM 6133 C CA . TYR C 3 387 ? 4.029 89.119 133.894 1.00 16.23 ? 387 TYR C CA 1 +ATOM 6134 C C . TYR C 3 387 ? 5.091 90.064 134.448 1.00 17.11 ? 387 TYR C C 1 +ATOM 6135 O O . TYR C 3 387 ? 6.031 89.632 135.116 1.00 17.09 ? 387 TYR C O 1 +ATOM 6136 C CB . TYR C 3 387 ? 2.653 89.455 134.515 1.00 15.59 ? 387 TYR C CB 1 +ATOM 6137 C CG . TYR C 3 387 ? 2.663 89.217 135.991 1.00 14.22 ? 387 TYR C CG 1 +ATOM 6138 C CD1 . TYR C 3 387 ? 3.217 90.164 136.849 1.00 12.91 ? 387 TYR C CD1 1 +ATOM 6139 C CD2 . TYR C 3 387 ? 2.191 88.014 136.531 1.00 7.74 ? 387 TYR C CD2 1 +ATOM 6140 C CE1 . TYR C 3 387 ? 3.279 89.923 138.229 1.00 12.41 ? 387 TYR C CE1 1 +ATOM 6141 C CE2 . TYR C 3 387 ? 2.252 87.760 137.892 1.00 5.96 ? 387 TYR C CE2 1 +ATOM 6142 C CZ . TYR C 3 387 ? 2.813 88.721 138.729 1.00 10.04 ? 387 TYR C CZ 1 +ATOM 6143 O OH . TYR C 3 387 ? 2.908 88.531 140.077 1.00 10.26 ? 387 TYR C OH 1 +ATOM 6144 N N . LEU C 3 388 ? 4.893 91.351 134.168 1.00 17.80 ? 388 LEU C N 1 +ATOM 6145 C CA . LEU C 3 388 ? 5.713 92.426 134.675 1.00 18.16 ? 388 LEU C CA 1 +ATOM 6146 C C . LEU C 3 388 ? 4.809 93.474 135.327 1.00 19.10 ? 388 LEU C C 1 +ATOM 6147 O O . LEU C 3 388 ? 3.921 94.072 134.678 1.00 19.04 ? 388 LEU C O 1 +ATOM 6148 C CB . LEU C 3 388 ? 6.525 93.045 133.544 1.00 17.53 ? 388 LEU C CB 1 +ATOM 6149 C CG . LEU C 3 388 ? 7.487 94.129 134.028 1.00 17.31 ? 388 LEU C CG 1 +ATOM 6150 C CD1 . LEU C 3 388 ? 8.544 93.522 134.973 1.00 17.90 ? 388 LEU C CD1 1 +ATOM 6151 C CD2 . LEU C 3 388 ? 8.158 94.878 132.853 1.00 15.39 ? 388 LEU C CD2 1 +ATOM 6152 N N . TYR C 3 389 ? 5.061 93.692 136.616 1.00 19.20 ? 389 TYR C N 1 +ATOM 6153 C CA . TYR C 3 389 ? 4.235 94.532 137.455 1.00 19.58 ? 389 TYR C CA 1 +ATOM 6154 C C . TYR C 3 389 ? 5.151 95.540 138.162 1.00 19.82 ? 389 TYR C C 1 +ATOM 6155 O O . TYR C 3 389 ? 6.090 95.123 138.894 1.00 19.64 ? 389 TYR C O 1 +ATOM 6156 C CB . TYR C 3 389 ? 3.518 93.662 138.489 1.00 19.44 ? 389 TYR C CB 1 +ATOM 6157 C CG . TYR C 3 389 ? 2.734 94.387 139.586 1.00 20.55 ? 389 TYR C CG 1 +ATOM 6158 C CD1 . TYR C 3 389 ? 1.357 94.518 139.495 1.00 21.31 ? 389 TYR C CD1 1 +ATOM 6159 C CD2 . TYR C 3 389 ? 3.354 94.869 140.740 1.00 21.35 ? 389 TYR C CD2 1 +ATOM 6160 C CE1 . TYR C 3 389 ? 0.606 95.138 140.498 1.00 21.49 ? 389 TYR C CE1 1 +ATOM 6161 C CE2 . TYR C 3 389 ? 2.600 95.503 141.756 1.00 20.61 ? 389 TYR C CE2 1 +ATOM 6162 C CZ . TYR C 3 389 ? 1.216 95.623 141.620 1.00 21.55 ? 389 TYR C CZ 1 +ATOM 6163 O OH . TYR C 3 389 ? 0.408 96.247 142.578 1.00 23.48 ? 389 TYR C OH 1 +ATOM 6164 N N . ILE C 3 390 ? 4.860 96.837 137.958 1.00 18.72 ? 390 ILE C N 1 +ATOM 6165 C CA . ILE C 3 390 ? 5.628 97.890 138.572 1.00 18.38 ? 390 ILE C CA 1 +ATOM 6166 C C . ILE C 3 390 ? 4.767 98.969 139.285 1.00 19.16 ? 390 ILE C C 1 +ATOM 6167 O O . ILE C 3 390 ? 4.087 99.792 138.671 1.00 19.40 ? 390 ILE C O 1 +ATOM 6168 C CB . ILE C 3 390 ? 6.681 98.466 137.591 1.00 18.01 ? 390 ILE C CB 1 +ATOM 6169 C CG1 . ILE C 3 390 ? 7.353 97.341 136.797 1.00 16.34 ? 390 ILE C CG1 1 +ATOM 6170 C CG2 . ILE C 3 390 ? 7.752 99.226 138.362 1.00 16.09 ? 390 ILE C CG2 1 +ATOM 6171 C CD1 . ILE C 3 390 ? 8.377 97.778 135.798 1.00 13.10 ? 390 ILE C CD1 1 +ATOM 6172 N N . SER C 3 391 ? 4.817 98.950 140.609 1.00 18.92 ? 391 SER C N 1 +ATOM 6173 C CA . SER C 3 391 ? 3.948 99.801 141.398 1.00 19.40 ? 391 SER C CA 1 +ATOM 6174 C C . SER C 3 391 ? 4.791 100.641 142.346 1.00 19.17 ? 391 SER C C 1 +ATOM 6175 O O . SER C 3 391 ? 4.280 101.413 143.181 1.00 19.47 ? 391 SER C O 1 +ATOM 6176 C CB . SER C 3 391 ? 2.927 98.962 142.149 1.00 19.46 ? 391 SER C CB 1 +ATOM 6177 O OG . SER C 3 391 ? 3.567 98.155 143.104 1.00 21.32 ? 391 SER C OG 1 +ATOM 6178 N N . ALA C 3 392 ? 6.101 100.476 142.187 1.00 18.43 ? 392 ALA C N 1 +ATOM 6179 C CA . ALA C 3 392 ? 7.099 101.328 142.810 1.00 17.71 ? 392 ALA C CA 1 +ATOM 6180 C C . ALA C 3 392 ? 8.355 101.180 141.983 1.00 17.08 ? 392 ALA C C 1 +ATOM 6181 O O . ALA C 3 392 ? 8.563 100.174 141.343 1.00 16.74 ? 392 ALA C O 1 +ATOM 6182 C CB . ALA C 3 392 ? 7.321 100.944 144.278 1.00 17.25 ? 392 ALA C CB 1 +ATOM 6183 N N . TRP C 3 393 ? 9.179 102.203 141.970 1.00 17.15 ? 393 TRP C N 1 +ATOM 6184 C CA . TRP C 3 393 ? 10.277 102.239 141.040 1.00 17.48 ? 393 TRP C CA 1 +ATOM 6185 C C . TRP C 3 393 ? 11.057 103.507 141.388 1.00 17.97 ? 393 TRP C C 1 +ATOM 6186 O O . TRP C 3 393 ? 10.464 104.568 141.606 1.00 17.74 ? 393 TRP C O 1 +ATOM 6187 C CB . TRP C 3 393 ? 9.766 102.268 139.584 1.00 17.43 ? 393 TRP C CB 1 +ATOM 6188 C CG . TRP C 3 393 ? 10.836 102.052 138.501 1.00 17.97 ? 393 TRP C CG 1 +ATOM 6189 C CD1 . TRP C 3 393 ? 11.433 103.010 137.702 1.00 17.24 ? 393 TRP C CD1 1 +ATOM 6190 C CD2 . TRP C 3 393 ? 11.434 100.804 138.126 1.00 18.78 ? 393 TRP C CD2 1 +ATOM 6191 N NE1 . TRP C 3 393 ? 12.337 102.422 136.846 1.00 16.39 ? 393 TRP C NE1 1 +ATOM 6192 C CE2 . TRP C 3 393 ? 12.369 101.075 137.091 1.00 16.89 ? 393 TRP C CE2 1 +ATOM 6193 C CE3 . TRP C 3 393 ? 11.286 99.472 138.573 1.00 18.59 ? 393 TRP C CE3 1 +ATOM 6194 C CZ2 . TRP C 3 393 ? 13.135 100.085 136.508 1.00 16.88 ? 393 TRP C CZ2 1 +ATOM 6195 C CZ3 . TRP C 3 393 ? 12.034 98.485 137.976 1.00 17.31 ? 393 TRP C CZ3 1 +ATOM 6196 C CH2 . TRP C 3 393 ? 12.945 98.797 136.941 1.00 19.03 ? 393 TRP C CH2 1 +ATOM 6197 N N . PRO C 3 394 ? 12.388 103.375 141.446 1.00 18.32 ? 394 PRO C N 1 +ATOM 6198 C CA . PRO C 3 394 ? 13.291 104.483 141.811 1.00 18.11 ? 394 PRO C CA 1 +ATOM 6199 C C . PRO C 3 394 ? 13.049 105.815 141.083 1.00 18.22 ? 394 PRO C C 1 +ATOM 6200 O O . PRO C 3 394 ? 13.260 105.937 139.882 1.00 18.57 ? 394 PRO C O 1 +ATOM 6201 C CB . PRO C 3 394 ? 14.680 103.932 141.451 1.00 17.52 ? 394 PRO C CB 1 +ATOM 6202 C CG . PRO C 3 394 ? 14.540 102.446 141.543 1.00 17.77 ? 394 PRO C CG 1 +ATOM 6203 C CD . PRO C 3 394 ? 13.121 102.117 141.166 1.00 17.64 ? 394 PRO C CD 1 +ATOM 6204 N N . ASP C 3 395 ? 12.627 106.813 141.839 1.00 18.55 ? 395 ASP C N 1 +ATOM 6205 C CA . ASP C 3 395 ? 12.563 108.208 141.380 1.00 18.91 ? 395 ASP C CA 1 +ATOM 6206 C C . ASP C 3 395 ? 13.690 108.671 140.462 1.00 18.41 ? 395 ASP C C 1 +ATOM 6207 O O . ASP C 3 395 ? 13.463 109.401 139.502 1.00 18.51 ? 395 ASP C O 1 +ATOM 6208 C CB . ASP C 3 395 ? 12.543 109.127 142.605 1.00 18.82 ? 395 ASP C CB 1 +ATOM 6209 C CG . ASP C 3 395 ? 11.341 108.891 143.473 1.00 20.62 ? 395 ASP C CG 1 +ATOM 6210 O OD1 . ASP C 3 395 ? 10.264 108.633 142.899 1.00 21.79 ? 395 ASP C OD1 1 +ATOM 6211 O OD2 . ASP C 3 395 ? 11.365 108.937 144.725 1.00 24.17 ? 395 ASP C OD2 1 +ATOM 6212 N N . SER C 3 396 ? 14.911 108.285 140.795 1.00 17.87 ? 396 SER C N 1 +ATOM 6213 C CA . SER C 3 396 ? 16.062 108.707 140.035 1.00 17.49 ? 396 SER C CA 1 +ATOM 6214 C C . SER C 3 396 ? 16.085 108.155 138.594 1.00 17.72 ? 396 SER C C 1 +ATOM 6215 O O . SER C 3 396 ? 16.812 108.697 137.743 1.00 17.82 ? 396 SER C O 1 +ATOM 6216 C CB . SER C 3 396 ? 17.347 108.364 140.801 1.00 17.48 ? 396 SER C CB 1 +ATOM 6217 O OG . SER C 3 396 ? 17.757 107.023 140.577 1.00 16.85 ? 396 SER C OG 1 +ATOM 6218 N N . LEU C 3 397 ? 15.279 107.119 138.309 1.00 17.12 ? 397 LEU C N 1 +ATOM 6219 C CA . LEU C 3 397 ? 15.300 106.460 136.996 1.00 16.85 ? 397 LEU C CA 1 +ATOM 6220 C C . LEU C 3 397 ? 14.124 106.919 136.173 1.00 16.92 ? 397 LEU C C 1 +ATOM 6221 O O . LEU C 3 397 ? 13.014 106.765 136.620 1.00 17.90 ? 397 LEU C O 1 +ATOM 6222 C CB . LEU C 3 397 ? 15.242 104.931 137.133 1.00 15.94 ? 397 LEU C CB 1 +ATOM 6223 C CG . LEU C 3 397 ? 16.364 104.178 137.863 1.00 15.20 ? 397 LEU C CG 1 +ATOM 6224 C CD1 . LEU C 3 397 ? 16.041 102.713 137.961 1.00 12.23 ? 397 LEU C CD1 1 +ATOM 6225 C CD2 . LEU C 3 397 ? 17.717 104.372 137.216 1.00 12.77 ? 397 LEU C CD2 1 +ATOM 6226 N N . PRO C 3 398 ? 14.350 107.451 134.970 1.00 17.15 ? 398 PRO C N 1 +ATOM 6227 C CA . PRO C 3 398 ? 13.288 108.088 134.189 1.00 17.12 ? 398 PRO C CA 1 +ATOM 6228 C C . PRO C 3 398 ? 12.471 107.136 133.347 1.00 17.94 ? 398 PRO C C 1 +ATOM 6229 O O . PRO C 3 398 ? 11.441 107.559 132.806 1.00 18.42 ? 398 PRO C O 1 +ATOM 6230 C CB . PRO C 3 398 ? 14.051 109.032 133.269 1.00 16.49 ? 398 PRO C CB 1 +ATOM 6231 C CG . PRO C 3 398 ? 15.454 108.847 133.577 1.00 16.76 ? 398 PRO C CG 1 +ATOM 6232 C CD . PRO C 3 398 ? 15.632 107.519 134.260 1.00 17.27 ? 398 PRO C CD 1 +ATOM 6233 N N . ASP C 3 399 ? 12.915 105.883 133.231 1.00 18.24 ? 399 ASP C N 1 +ATOM 6234 C CA . ASP C 3 399 ? 12.242 104.895 132.395 1.00 17.91 ? 399 ASP C CA 1 +ATOM 6235 C C . ASP C 3 399 ? 12.463 103.463 132.875 1.00 17.50 ? 399 ASP C C 1 +ATOM 6236 O O . ASP C 3 399 ? 13.089 103.213 133.931 1.00 17.44 ? 399 ASP C O 1 +ATOM 6237 C CB . ASP C 3 399 ? 12.748 105.002 130.967 1.00 18.42 ? 399 ASP C CB 1 +ATOM 6238 C CG . ASP C 3 399 ? 14.224 104.658 130.834 1.00 22.39 ? 399 ASP C CG 1 +ATOM 6239 O OD1 . ASP C 3 399 ? 14.929 104.471 131.854 1.00 25.91 ? 399 ASP C OD1 1 +ATOM 6240 O OD2 . ASP C 3 399 ? 14.790 104.580 129.724 1.00 28.03 ? 399 ASP C OD2 1 +ATOM 6241 N N . LEU C 3 400 ? 11.996 102.515 132.067 1.00 16.36 ? 400 LEU C N 1 +ATOM 6242 C CA . LEU C 3 400 ? 12.273 101.116 132.347 1.00 15.59 ? 400 LEU C CA 1 +ATOM 6243 C C . LEU C 3 400 ? 13.462 100.615 131.535 1.00 15.25 ? 400 LEU C C 1 +ATOM 6244 O O . LEU C 3 400 ? 13.510 99.460 131.151 1.00 15.52 ? 400 LEU C O 1 +ATOM 6245 C CB . LEU C 3 400 ? 11.028 100.292 132.103 1.00 15.23 ? 400 LEU C CB 1 +ATOM 6246 C CG . LEU C 3 400 ? 9.850 100.879 132.882 1.00 15.99 ? 400 LEU C CG 1 +ATOM 6247 C CD1 . LEU C 3 400 ? 8.566 100.128 132.579 1.00 18.23 ? 400 LEU C CD1 1 +ATOM 6248 C CD2 . LEU C 3 400 ? 10.109 100.940 134.410 1.00 14.40 ? 400 LEU C CD2 1 +ATOM 6249 N N . SER C 3 401 ? 14.453 101.455 131.281 1.00 14.35 ? 401 SER C N 1 +ATOM 6250 C CA . SER C 3 401 ? 15.427 100.984 130.310 1.00 13.44 ? 401 SER C CA 1 +ATOM 6251 C C . SER C 3 401 ? 16.257 99.810 130.798 1.00 13.60 ? 401 SER C C 1 +ATOM 6252 O O . SER C 3 401 ? 16.961 99.181 130.005 1.00 13.71 ? 401 SER C O 1 +ATOM 6253 C CB . SER C 3 401 ? 16.293 102.099 129.757 1.00 12.51 ? 401 SER C CB 1 +ATOM 6254 O OG . SER C 3 401 ? 17.195 102.469 130.736 1.00 11.27 ? 401 SER C OG 1 +ATOM 6255 N N . VAL C 3 402 ? 16.172 99.472 132.078 1.00 13.96 ? 402 VAL C N 1 +ATOM 6256 C CA . VAL C 3 402 ? 16.787 98.208 132.486 1.00 14.71 ? 402 VAL C CA 1 +ATOM 6257 C C . VAL C 3 402 ? 16.180 96.989 131.724 1.00 14.40 ? 402 VAL C C 1 +ATOM 6258 O O . VAL C 3 402 ? 16.844 95.950 131.569 1.00 13.81 ? 402 VAL C O 1 +ATOM 6259 C CB . VAL C 3 402 ? 16.743 97.957 134.000 1.00 14.49 ? 402 VAL C CB 1 +ATOM 6260 C CG1 . VAL C 3 402 ? 17.071 99.213 134.768 1.00 16.56 ? 402 VAL C CG1 1 +ATOM 6261 C CG2 . VAL C 3 402 ? 15.449 97.425 134.388 1.00 13.54 ? 402 VAL C CG2 1 +ATOM 6262 N N . PHE C 3 403 ? 14.956 97.169 131.233 1.00 14.14 ? 403 PHE C N 1 +ATOM 6263 C CA . PHE C 3 403 ? 14.235 96.173 130.431 1.00 14.96 ? 403 PHE C CA 1 +ATOM 6264 C C . PHE C 3 403 ? 14.344 96.383 128.938 1.00 15.15 ? 403 PHE C C 1 +ATOM 6265 O O . PHE C 3 403 ? 13.592 95.787 128.178 1.00 16.14 ? 403 PHE C O 1 +ATOM 6266 C CB . PHE C 3 403 ? 12.751 96.135 130.848 1.00 14.85 ? 403 PHE C CB 1 +ATOM 6267 C CG . PHE C 3 403 ? 12.562 95.669 132.247 1.00 14.53 ? 403 PHE C CG 1 +ATOM 6268 C CD1 . PHE C 3 403 ? 12.149 96.549 133.228 1.00 12.05 ? 403 PHE C CD1 1 +ATOM 6269 C CD2 . PHE C 3 403 ? 12.922 94.361 132.610 1.00 15.68 ? 403 PHE C CD2 1 +ATOM 6270 C CE1 . PHE C 3 403 ? 12.012 96.133 134.551 1.00 12.46 ? 403 PHE C CE1 1 +ATOM 6271 C CE2 . PHE C 3 403 ? 12.808 93.934 133.943 1.00 14.16 ? 403 PHE C CE2 1 +ATOM 6272 C CZ . PHE C 3 403 ? 12.329 94.837 134.910 1.00 13.07 ? 403 PHE C CZ 1 +ATOM 6273 N N . GLN C 3 404 ? 15.258 97.247 128.530 1.00 15.32 ? 404 GLN C N 1 +ATOM 6274 C CA . GLN C 3 404 ? 15.492 97.602 127.135 1.00 16.52 ? 404 GLN C CA 1 +ATOM 6275 C C . GLN C 3 404 ? 15.566 96.431 126.138 1.00 17.19 ? 404 GLN C C 1 +ATOM 6276 O O . GLN C 3 404 ? 15.345 96.624 124.942 1.00 17.50 ? 404 GLN C O 1 +ATOM 6277 C CB . GLN C 3 404 ? 16.884 98.230 127.059 1.00 17.29 ? 404 GLN C CB 1 +ATOM 6278 C CG . GLN C 3 404 ? 16.920 99.702 126.998 1.00 18.11 ? 404 GLN C CG 1 +ATOM 6279 C CD . GLN C 3 404 ? 18.298 100.203 126.725 1.00 18.52 ? 404 GLN C CD 1 +ATOM 6280 O OE1 . GLN C 3 404 ? 19.308 99.553 127.050 1.00 15.57 ? 404 GLN C OE1 1 +ATOM 6281 N NE2 . GLN C 3 404 ? 18.357 101.376 126.133 1.00 19.86 ? 404 GLN C NE2 1 +ATOM 6282 N N . ASN C 3 405 ? 16.001 95.259 126.612 1.00 17.26 ? 405 ASN C N 1 +ATOM 6283 C CA . ASN C 3 405 ? 16.193 94.085 125.780 1.00 16.60 ? 405 ASN C CA 1 +ATOM 6284 C C . ASN C 3 405 ? 15.117 93.086 126.156 1.00 16.84 ? 405 ASN C C 1 +ATOM 6285 O O . ASN C 3 405 ? 15.200 91.886 125.851 1.00 17.73 ? 405 ASN C O 1 +ATOM 6286 C CB . ASN C 3 405 ? 17.551 93.471 126.034 1.00 16.47 ? 405 ASN C CB 1 +ATOM 6287 C CG . ASN C 3 405 ? 18.693 94.460 125.865 1.00 18.52 ? 405 ASN C CG 1 +ATOM 6288 O OD1 . ASN C 3 405 ? 19.657 94.422 126.617 1.00 21.01 ? 405 ASN C OD1 1 +ATOM 6289 N ND2 . ASN C 3 405 ? 18.608 95.326 124.871 1.00 17.12 ? 405 ASN C ND2 1 +ATOM 6290 N N . LEU C 3 406 ? 14.108 93.548 126.874 1.00 15.78 ? 406 LEU C N 1 +ATOM 6291 C CA . LEU C 3 406 ? 12.988 92.669 127.081 1.00 15.17 ? 406 LEU C CA 1 +ATOM 6292 C C . LEU C 3 406 ? 12.206 92.708 125.773 1.00 15.16 ? 406 LEU C C 1 +ATOM 6293 O O . LEU C 3 406 ? 11.759 93.780 125.370 1.00 15.74 ? 406 LEU C O 1 +ATOM 6294 C CB . LEU C 3 406 ? 12.146 93.114 128.259 1.00 14.03 ? 406 LEU C CB 1 +ATOM 6295 C CG . LEU C 3 406 ? 10.895 92.301 128.500 1.00 12.88 ? 406 LEU C CG 1 +ATOM 6296 C CD1 . LEU C 3 406 ? 11.239 90.850 128.781 1.00 10.23 ? 406 LEU C CD1 1 +ATOM 6297 C CD2 . LEU C 3 406 ? 10.126 92.928 129.650 1.00 12.80 ? 406 LEU C CD2 1 +ATOM 6298 N N . GLN C 3 407 ? 12.072 91.541 125.134 1.00 14.62 ? 407 GLN C N 1 +ATOM 6299 C CA . GLN C 3 407 ? 11.447 91.375 123.825 1.00 14.39 ? 407 GLN C CA 1 +ATOM 6300 C C . GLN C 3 407 ? 10.014 90.913 123.912 1.00 15.58 ? 407 GLN C C 1 +ATOM 6301 O O . GLN C 3 407 ? 9.221 91.213 122.999 1.00 16.04 ? 407 GLN C O 1 +ATOM 6302 C CB . GLN C 3 407 ? 12.205 90.331 122.988 1.00 13.54 ? 407 GLN C CB 1 +ATOM 6303 C CG . GLN C 3 407 ? 13.602 90.753 122.530 1.00 13.32 ? 407 GLN C CG 1 +ATOM 6304 C CD . GLN C 3 407 ? 14.276 89.697 121.685 1.00 14.64 ? 407 GLN C CD 1 +ATOM 6305 O OE1 . GLN C 3 407 ? 13.653 89.139 120.779 1.00 18.26 ? 407 GLN C OE1 1 +ATOM 6306 N NE2 . GLN C 3 407 ? 15.531 89.401 121.978 1.00 13.13 ? 407 GLN C NE2 1 +ATOM 6307 N N . VAL C 3 408 ? 9.688 90.142 124.961 1.00 16.19 ? 408 VAL C N 1 +ATOM 6308 C CA . VAL C 3 408 ? 8.398 89.429 125.055 1.00 17.51 ? 408 VAL C CA 1 +ATOM 6309 C C . VAL C 3 408 ? 8.036 89.070 126.500 1.00 17.71 ? 408 VAL C C 1 +ATOM 6310 O O . VAL C 3 408 ? 8.757 88.292 127.151 1.00 18.17 ? 408 VAL C O 1 +ATOM 6311 C CB . VAL C 3 408 ? 8.400 88.091 124.272 1.00 17.78 ? 408 VAL C CB 1 +ATOM 6312 C CG1 . VAL C 3 408 ? 8.515 88.316 122.762 1.00 20.60 ? 408 VAL C CG1 1 +ATOM 6313 C CG2 . VAL C 3 408 ? 9.568 87.264 124.684 1.00 18.48 ? 408 VAL C CG2 1 +ATOM 6314 N N . ILE C 3 409 ? 6.934 89.653 126.990 1.00 16.79 ? 409 ILE C N 1 +ATOM 6315 C CA . ILE C 3 409 ? 6.274 89.205 128.196 1.00 15.66 ? 409 ILE C CA 1 +ATOM 6316 C C . ILE C 3 409 ? 5.157 88.332 127.661 1.00 16.29 ? 409 ILE C C 1 +ATOM 6317 O O . ILE C 3 409 ? 4.298 88.817 126.955 1.00 18.24 ? 409 ILE C O 1 +ATOM 6318 C CB . ILE C 3 409 ? 5.694 90.408 128.993 1.00 15.15 ? 409 ILE C CB 1 +ATOM 6319 C CG1 . ILE C 3 409 ? 6.811 91.363 129.400 1.00 12.05 ? 409 ILE C CG1 1 +ATOM 6320 C CG2 . ILE C 3 409 ? 4.974 89.943 130.251 1.00 13.47 ? 409 ILE C CG2 1 +ATOM 6321 C CD1 . ILE C 3 409 ? 6.368 92.748 129.578 1.00 8.52 ? 409 ILE C CD1 1 +ATOM 6322 N N . ARG C 3 410 ? 5.172 87.050 127.969 1.00 15.97 ? 410 ARG C N 1 +ATOM 6323 C CA . ARG C 3 410 ? 4.231 86.106 127.403 1.00 15.22 ? 410 ARG C CA 1 +ATOM 6324 C C . ARG C 3 410 ? 2.890 86.103 128.089 1.00 15.26 ? 410 ARG C C 1 +ATOM 6325 O O . ARG C 3 410 ? 1.881 85.859 127.447 1.00 15.72 ? 410 ARG C O 1 +ATOM 6326 C CB . ARG C 3 410 ? 4.812 84.718 127.501 1.00 15.28 ? 410 ARG C CB 1 +ATOM 6327 C CG . ARG C 3 410 ? 6.090 84.594 126.780 1.00 15.08 ? 410 ARG C CG 1 +ATOM 6328 C CD . ARG C 3 410 ? 6.350 83.217 126.349 1.00 15.99 ? 410 ARG C CD 1 +ATOM 6329 N NE . ARG C 3 410 ? 7.256 83.137 125.220 1.00 17.55 ? 410 ARG C NE 1 +ATOM 6330 C CZ . ARG C 3 410 ? 6.979 83.624 124.029 1.00 20.87 ? 410 ARG C CZ 1 +ATOM 6331 N NH1 . ARG C 3 410 ? 5.822 84.264 123.842 1.00 24.66 ? 410 ARG C NH1 1 +ATOM 6332 N NH2 . ARG C 3 410 ? 7.849 83.489 123.032 1.00 19.02 ? 410 ARG C NH2 1 +ATOM 6333 N N . GLY C 3 411 ? 2.875 86.375 129.390 1.00 15.30 ? 411 GLY C N 1 +ATOM 6334 C CA . GLY C 3 411 ? 1.654 86.342 130.178 1.00 14.54 ? 411 GLY C CA 1 +ATOM 6335 C C . GLY C 3 411 ? 0.985 84.987 130.255 1.00 14.30 ? 411 GLY C C 1 +ATOM 6336 O O . GLY C 3 411 ? -0.204 84.891 130.017 1.00 15.14 ? 411 GLY C O 1 +ATOM 6337 N N . ARG C 3 412 ? 1.741 83.940 130.543 1.00 13.85 ? 412 ARG C N 1 +ATOM 6338 C CA . ARG C 3 412 ? 1.154 82.642 130.810 1.00 13.85 ? 412 ARG C CA 1 +ATOM 6339 C C . ARG C 3 412 ? 0.762 82.650 132.279 1.00 14.37 ? 412 ARG C C 1 +ATOM 6340 O O . ARG C 3 412 ? 0.188 81.666 132.784 1.00 14.69 ? 412 ARG C O 1 +ATOM 6341 C CB . ARG C 3 412 ? 2.185 81.559 130.621 1.00 13.79 ? 412 ARG C CB 1 +ATOM 6342 C CG . ARG C 3 412 ? 2.900 81.612 129.312 1.00 15.16 ? 412 ARG C CG 1 +ATOM 6343 C CD . ARG C 3 412 ? 2.953 80.275 128.629 1.00 16.68 ? 412 ARG C CD 1 +ATOM 6344 N NE . ARG C 3 412 ? 3.876 80.267 127.500 1.00 17.61 ? 412 ARG C NE 1 +ATOM 6345 C CZ . ARG C 3 412 ? 5.185 80.030 127.606 1.00 16.97 ? 412 ARG C CZ 1 +ATOM 6346 N NH1 . ARG C 3 412 ? 5.737 79.780 128.803 1.00 15.09 ? 412 ARG C NH1 1 +ATOM 6347 N NH2 . ARG C 3 412 ? 5.930 80.029 126.507 1.00 14.95 ? 412 ARG C NH2 1 +ATOM 6348 N N . ILE C 3 413 ? 1.154 83.723 132.973 1.00 13.04 ? 413 ILE C N 1 +ATOM 6349 C CA . ILE C 3 413 ? 0.751 83.985 134.319 1.00 13.04 ? 413 ILE C CA 1 +ATOM 6350 C C . ILE C 3 413 ? 0.490 85.442 134.346 1.00 12.55 ? 413 ILE C C 1 +ATOM 6351 O O . ILE C 3 413 ? 1.301 86.220 133.898 1.00 12.83 ? 413 ILE C O 1 +ATOM 6352 C CB . ILE C 3 413 ? 1.865 83.762 135.338 1.00 14.28 ? 413 ILE C CB 1 +ATOM 6353 C CG1 . ILE C 3 413 ? 2.497 82.369 135.218 1.00 16.73 ? 413 ILE C CG1 1 +ATOM 6354 C CG2 . ILE C 3 413 ? 1.289 84.001 136.752 1.00 11.54 ? 413 ILE C CG2 1 +ATOM 6355 C CD1 . ILE C 3 413 ? 3.784 82.227 136.046 1.00 20.45 ? 413 ILE C CD1 1 +ATOM 6356 N N . LEU C 3 414 ? -0.596 85.832 134.968 1.00 12.54 ? 414 LEU C N 1 +ATOM 6357 C CA . LEU C 3 414 ? -1.053 87.190 134.831 1.00 12.97 ? 414 LEU C CA 1 +ATOM 6358 C C . LEU C 3 414 ? -1.239 87.862 136.168 1.00 13.10 ? 414 LEU C C 1 +ATOM 6359 O O . LEU C 3 414 ? -1.697 87.254 137.134 1.00 11.61 ? 414 LEU C O 1 +ATOM 6360 C CB . LEU C 3 414 ? -2.354 87.181 134.024 1.00 13.32 ? 414 LEU C CB 1 +ATOM 6361 C CG . LEU C 3 414 ? -2.184 86.765 132.550 1.00 12.41 ? 414 LEU C CG 1 +ATOM 6362 C CD1 . LEU C 3 414 ? -3.577 86.638 131.868 1.00 11.29 ? 414 LEU C CD1 1 +ATOM 6363 C CD2 . LEU C 3 414 ? -1.277 87.765 131.827 1.00 9.34 ? 414 LEU C CD2 1 +ATOM 6364 N N . HIS C 3 415 ? -0.859 89.124 136.260 1.00 14.66 ? 415 HIS C N 1 +ATOM 6365 C CA . HIS C 3 415 ? -1.059 89.760 137.553 1.00 15.52 ? 415 HIS C CA 1 +ATOM 6366 C C . HIS C 3 415 ? -2.558 89.786 137.772 1.00 16.37 ? 415 HIS C C 1 +ATOM 6367 O O . HIS C 3 415 ? -3.334 90.082 136.851 1.00 17.64 ? 415 HIS C O 1 +ATOM 6368 C CB . HIS C 3 415 ? -0.436 91.129 137.659 1.00 15.26 ? 415 HIS C CB 1 +ATOM 6369 C CG . HIS C 3 415 ? -0.556 91.695 139.027 1.00 16.49 ? 415 HIS C CG 1 +ATOM 6370 N ND1 . HIS C 3 415 ? -1.393 92.746 139.320 1.00 17.53 ? 415 HIS C ND1 1 +ATOM 6371 C CD2 . HIS C 3 415 ? -0.010 91.299 140.206 1.00 15.79 ? 415 HIS C CD2 1 +ATOM 6372 C CE1 . HIS C 3 415 ? -1.344 92.983 140.622 1.00 17.56 ? 415 HIS C CE1 1 +ATOM 6373 N NE2 . HIS C 3 415 ? -0.507 92.123 141.179 1.00 14.15 ? 415 HIS C NE2 1 +ATOM 6374 N N . ASN C 3 416 ? -2.982 89.396 138.963 1.00 16.60 ? 416 ASN C N 1 +ATOM 6375 C CA . ASN C 3 416 ? -4.405 89.213 139.231 1.00 16.36 ? 416 ASN C CA 1 +ATOM 6376 C C . ASN C 3 416 ? -5.162 88.256 138.291 1.00 16.50 ? 416 ASN C C 1 +ATOM 6377 O O . ASN C 3 416 ? -6.402 88.213 138.296 1.00 16.32 ? 416 ASN C O 1 +ATOM 6378 C CB . ASN C 3 416 ? -5.058 90.565 139.212 1.00 16.17 ? 416 ASN C CB 1 +ATOM 6379 C CG . ASN C 3 416 ? -4.970 91.227 140.521 1.00 16.23 ? 416 ASN C CG 1 +ATOM 6380 O OD1 . ASN C 3 416 ? -4.491 90.641 141.500 1.00 13.51 ? 416 ASN C OD1 1 +ATOM 6381 N ND2 . ASN C 3 416 ? -5.420 92.465 140.569 1.00 17.06 ? 416 ASN C ND2 1 +ATOM 6382 N N . GLY C 3 417 ? -4.410 87.489 137.504 1.00 16.42 ? 417 GLY C N 1 +ATOM 6383 C CA . GLY C 3 417 ? -4.954 86.744 136.387 1.00 16.63 ? 417 GLY C CA 1 +ATOM 6384 C C . GLY C 3 417 ? -5.422 87.574 135.192 1.00 16.69 ? 417 GLY C C 1 +ATOM 6385 O O . GLY C 3 417 ? -6.050 87.018 134.308 1.00 17.11 ? 417 GLY C O 1 +ATOM 6386 N N . ALA C 3 418 ? -5.116 88.873 135.139 1.00 16.61 ? 418 ALA C N 1 +ATOM 6387 C CA . ALA C 3 418 ? -5.654 89.728 134.075 1.00 16.47 ? 418 ALA C CA 1 +ATOM 6388 C C . ALA C 3 418 ? -4.643 90.496 133.257 1.00 16.88 ? 418 ALA C C 1 +ATOM 6389 O O . ALA C 3 418 ? -4.880 90.704 132.056 1.00 18.03 ? 418 ALA C O 1 +ATOM 6390 C CB . ALA C 3 418 ? -6.664 90.679 134.618 1.00 16.61 ? 418 ALA C CB 1 +ATOM 6391 N N . TYR C 3 419 ? -3.541 90.930 133.883 1.00 16.70 ? 419 TYR C N 1 +ATOM 6392 C CA . TYR C 3 419 ? -2.606 91.910 133.281 1.00 16.29 ? 419 TYR C CA 1 +ATOM 6393 C C . TYR C 3 419 ? -1.163 91.391 133.199 1.00 16.00 ? 419 TYR C C 1 +ATOM 6394 O O . TYR C 3 419 ? -0.618 90.865 134.169 1.00 16.47 ? 419 TYR C O 1 +ATOM 6395 C CB . TYR C 3 419 ? -2.606 93.218 134.084 1.00 15.94 ? 419 TYR C CB 1 +ATOM 6396 C CG . TYR C 3 419 ? -3.985 93.790 134.377 1.00 17.48 ? 419 TYR C CG 1 +ATOM 6397 C CD1 . TYR C 3 419 ? -4.644 93.505 135.576 1.00 15.95 ? 419 TYR C CD1 1 +ATOM 6398 C CD2 . TYR C 3 419 ? -4.614 94.622 133.461 1.00 15.14 ? 419 TYR C CD2 1 +ATOM 6399 C CE1 . TYR C 3 419 ? -5.875 94.036 135.846 1.00 18.94 ? 419 TYR C CE1 1 +ATOM 6400 C CE2 . TYR C 3 419 ? -5.849 95.159 133.715 1.00 17.80 ? 419 TYR C CE2 1 +ATOM 6401 C CZ . TYR C 3 419 ? -6.488 94.874 134.909 1.00 20.44 ? 419 TYR C CZ 1 +ATOM 6402 O OH . TYR C 3 419 ? -7.735 95.423 135.163 1.00 17.68 ? 419 TYR C OH 1 +ATOM 6403 N N . SER C 3 420 ? -0.550 91.542 132.044 1.00 14.94 ? 420 SER C N 1 +ATOM 6404 C CA . SER C 3 420 ? 0.755 90.974 131.821 1.00 14.93 ? 420 SER C CA 1 +ATOM 6405 C C . SER C 3 420 ? 1.782 92.091 131.890 1.00 15.43 ? 420 SER C C 1 +ATOM 6406 O O . SER C 3 420 ? 2.936 91.856 132.203 1.00 14.66 ? 420 SER C O 1 +ATOM 6407 C CB . SER C 3 420 ? 0.806 90.274 130.475 1.00 14.18 ? 420 SER C CB 1 +ATOM 6408 O OG . SER C 3 420 ? 0.611 91.192 129.420 1.00 15.36 ? 420 SER C OG 1 +ATOM 6409 N N . LEU C 3 421 ? 1.345 93.316 131.615 1.00 16.09 ? 421 LEU C N 1 +ATOM 6410 C CA . LEU C 3 421 ? 2.144 94.455 131.976 1.00 16.64 ? 421 LEU C CA 1 +ATOM 6411 C C . LEU C 3 421 ? 1.297 95.386 132.838 1.00 17.32 ? 421 LEU C C 1 +ATOM 6412 O O . LEU C 3 421 ? 0.161 95.715 132.476 1.00 17.94 ? 421 LEU C O 1 +ATOM 6413 C CB . LEU C 3 421 ? 2.705 95.134 130.728 1.00 16.52 ? 421 LEU C CB 1 +ATOM 6414 C CG . LEU C 3 421 ? 3.567 96.368 130.990 1.00 17.21 ? 421 LEU C CG 1 +ATOM 6415 C CD1 . LEU C 3 421 ? 4.747 96.061 131.900 1.00 14.07 ? 421 LEU C CD1 1 +ATOM 6416 C CD2 . LEU C 3 421 ? 4.062 96.968 129.662 1.00 18.05 ? 421 LEU C CD2 1 +ATOM 6417 N N . THR C 3 422 ? 1.848 95.778 133.991 1.00 17.42 ? 422 THR C N 1 +ATOM 6418 C CA . THR C 3 422 ? 1.225 96.734 134.891 1.00 16.81 ? 422 THR C CA 1 +ATOM 6419 C C . THR C 3 422 ? 2.233 97.792 135.278 1.00 17.00 ? 422 THR C C 1 +ATOM 6420 O O . THR C 3 422 ? 3.335 97.478 135.689 1.00 17.44 ? 422 THR C O 1 +ATOM 6421 C CB . THR C 3 422 ? 0.733 95.994 136.136 1.00 17.31 ? 422 THR C CB 1 +ATOM 6422 O OG1 . THR C 3 422 ? -0.189 94.987 135.718 1.00 18.28 ? 422 THR C OG1 1 +ATOM 6423 C CG2 . THR C 3 422 ? -0.123 96.878 137.062 1.00 15.94 ? 422 THR C CG2 1 +ATOM 6424 N N . LEU C 3 423 ? 1.844 99.053 135.126 1.00 17.09 ? 423 LEU C N 1 +ATOM 6425 C CA . LEU C 3 423 ? 2.629 100.203 135.516 1.00 16.59 ? 423 LEU C CA 1 +ATOM 6426 C C . LEU C 3 423 ? 1.705 101.228 136.221 1.00 17.32 ? 423 LEU C C 1 +ATOM 6427 O O . LEU C 3 423 ? 0.798 101.845 135.608 1.00 17.28 ? 423 LEU C O 1 +ATOM 6428 C CB . LEU C 3 423 ? 3.254 100.815 134.293 1.00 16.28 ? 423 LEU C CB 1 +ATOM 6429 C CG . LEU C 3 423 ? 4.294 99.984 133.531 1.00 18.79 ? 423 LEU C CG 1 +ATOM 6430 C CD1 . LEU C 3 423 ? 4.607 100.612 132.136 1.00 14.11 ? 423 LEU C CD1 1 +ATOM 6431 C CD2 . LEU C 3 423 ? 5.576 99.746 134.367 1.00 18.97 ? 423 LEU C CD2 1 +ATOM 6432 N N . GLN C 3 424 ? 1.907 101.393 137.521 1.00 17.38 ? 424 GLN C N 1 +ATOM 6433 C CA . GLN C 3 424 ? 1.037 102.258 138.279 1.00 17.87 ? 424 GLN C CA 1 +ATOM 6434 C C . GLN C 3 424 ? 1.792 102.961 139.366 1.00 17.87 ? 424 GLN C C 1 +ATOM 6435 O O . GLN C 3 424 ? 2.575 102.316 140.077 1.00 18.89 ? 424 GLN C O 1 +ATOM 6436 C CB . GLN C 3 424 ? -0.117 101.468 138.848 1.00 17.91 ? 424 GLN C CB 1 +ATOM 6437 C CG . GLN C 3 424 ? 0.242 100.168 139.492 1.00 20.15 ? 424 GLN C CG 1 +ATOM 6438 C CD . GLN C 3 424 ? -0.966 99.573 140.182 1.00 23.93 ? 424 GLN C CD 1 +ATOM 6439 O OE1 . GLN C 3 424 ? -1.372 100.090 141.183 1.00 22.26 ? 424 GLN C OE1 1 +ATOM 6440 N NE2 . GLN C 3 424 ? -1.564 98.516 139.621 1.00 27.00 ? 424 GLN C NE2 1 +ATOM 6441 N N . GLY C 3 425 ? 1.604 104.285 139.443 1.00 17.54 ? 425 GLY C N 1 +ATOM 6442 C CA . GLY C 3 425 ? 2.119 105.141 140.523 1.00 16.75 ? 425 GLY C CA 1 +ATOM 6443 C C . GLY C 3 425 ? 3.626 105.347 140.607 1.00 16.11 ? 425 GLY C C 1 +ATOM 6444 O O . GLY C 3 425 ? 4.182 105.318 141.710 1.00 14.78 ? 425 GLY C O 1 +ATOM 6445 N N . LEU C 3 426 ? 4.268 105.620 139.461 1.00 16.57 ? 426 LEU C N 1 +ATOM 6446 C CA . LEU C 3 426 ? 5.698 105.346 139.275 1.00 16.53 ? 426 LEU C CA 1 +ATOM 6447 C C . LEU C 3 426 ? 6.711 106.481 139.224 1.00 17.49 ? 426 LEU C C 1 +ATOM 6448 O O . LEU C 3 426 ? 7.962 106.254 139.407 1.00 19.74 ? 426 LEU C O 1 +ATOM 6449 C CB . LEU C 3 426 ? 5.896 104.551 138.009 1.00 16.03 ? 426 LEU C CB 1 +ATOM 6450 C CG . LEU C 3 426 ? 5.458 103.103 138.060 1.00 17.06 ? 426 LEU C CG 1 +ATOM 6451 C CD1 . LEU C 3 426 ? 6.010 102.395 136.831 1.00 13.86 ? 426 LEU C CD1 1 +ATOM 6452 C CD2 . LEU C 3 426 ? 6.001 102.521 139.371 1.00 18.43 ? 426 LEU C CD2 1 +ATOM 6453 N N . GLY C 3 427 ? 6.298 107.691 138.898 1.00 16.37 ? 427 GLY C N 1 +ATOM 6454 C CA . GLY C 3 427 ? 7.380 108.666 138.692 1.00 14.49 ? 427 GLY C CA 1 +ATOM 6455 C C . GLY C 3 427 ? 8.103 108.635 137.339 1.00 13.22 ? 427 GLY C C 1 +ATOM 6456 O O . GLY C 3 427 ? 8.587 109.674 136.935 1.00 14.45 ? 427 GLY C O 1 +ATOM 6457 N N . ILE C 3 428 ? 8.186 107.499 136.644 1.00 11.82 ? 428 ILE C N 1 +ATOM 6458 C CA . ILE C 3 428 ? 8.885 107.417 135.329 1.00 11.86 ? 428 ILE C CA 1 +ATOM 6459 C C . ILE C 3 428 ? 8.412 108.435 134.287 1.00 11.68 ? 428 ILE C C 1 +ATOM 6460 O O . ILE C 3 428 ? 7.266 108.825 134.272 1.00 13.04 ? 428 ILE C O 1 +ATOM 6461 C CB . ILE C 3 428 ? 8.823 105.994 134.699 1.00 10.98 ? 428 ILE C CB 1 +ATOM 6462 C CG1 . ILE C 3 428 ? 7.376 105.539 134.498 1.00 10.86 ? 428 ILE C CG1 1 +ATOM 6463 C CG2 . ILE C 3 428 ? 9.644 105.038 135.524 1.00 10.91 ? 428 ILE C CG2 1 +ATOM 6464 C CD1 . ILE C 3 428 ? 7.189 104.187 133.768 1.00 12.45 ? 428 ILE C CD1 1 +ATOM 6465 N N . SER C 3 429 ? 9.286 108.858 133.408 1.00 10.99 ? 429 SER C N 1 +ATOM 6466 C CA . SER C 3 429 ? 8.895 109.876 132.456 1.00 11.41 ? 429 SER C CA 1 +ATOM 6467 C C . SER C 3 429 ? 8.541 109.282 131.059 1.00 11.99 ? 429 SER C C 1 +ATOM 6468 O O . SER C 3 429 ? 7.709 109.822 130.320 1.00 12.06 ? 429 SER C O 1 +ATOM 6469 C CB . SER C 3 429 ? 9.979 110.969 132.382 1.00 11.13 ? 429 SER C CB 1 +ATOM 6470 O OG . SER C 3 429 ? 10.068 111.703 133.598 1.00 9.86 ? 429 SER C OG 1 +ATOM 6471 N N . TRP C 3 430 ? 9.180 108.170 130.715 1.00 12.00 ? 430 TRP C N 1 +ATOM 6472 C CA . TRP C 3 430 ? 8.798 107.365 129.557 1.00 12.35 ? 430 TRP C CA 1 +ATOM 6473 C C . TRP C 3 430 ? 9.031 105.863 129.856 1.00 12.52 ? 430 TRP C C 1 +ATOM 6474 O O . TRP C 3 430 ? 9.565 105.524 130.921 1.00 11.82 ? 430 TRP C O 1 +ATOM 6475 C CB . TRP C 3 430 ? 9.590 107.796 128.345 1.00 11.94 ? 430 TRP C CB 1 +ATOM 6476 C CG . TRP C 3 430 ? 11.081 107.687 128.544 1.00 10.98 ? 430 TRP C CG 1 +ATOM 6477 C CD1 . TRP C 3 430 ? 11.856 106.631 128.235 1.00 12.71 ? 430 TRP C CD1 1 +ATOM 6478 C CD2 . TRP C 3 430 ? 11.960 108.693 129.041 1.00 9.02 ? 430 TRP C CD2 1 +ATOM 6479 N NE1 . TRP C 3 430 ? 13.174 106.901 128.510 1.00 11.61 ? 430 TRP C NE1 1 +ATOM 6480 C CE2 . TRP C 3 430 ? 13.260 108.165 129.017 1.00 9.43 ? 430 TRP C CE2 1 +ATOM 6481 C CE3 . TRP C 3 430 ? 11.779 109.992 129.517 1.00 7.76 ? 430 TRP C CE3 1 +ATOM 6482 C CZ2 . TRP C 3 430 ? 14.364 108.877 129.443 1.00 8.46 ? 430 TRP C CZ2 1 +ATOM 6483 C CZ3 . TRP C 3 430 ? 12.868 110.692 129.950 1.00 7.31 ? 430 TRP C CZ3 1 +ATOM 6484 C CH2 . TRP C 3 430 ? 14.146 110.141 129.912 1.00 8.02 ? 430 TRP C CH2 1 +ATOM 6485 N N . LEU C 3 431 ? 8.625 104.993 128.932 1.00 12.22 ? 431 LEU C N 1 +ATOM 6486 C CA . LEU C 3 431 ? 8.731 103.542 129.123 1.00 12.14 ? 431 LEU C CA 1 +ATOM 6487 C C . LEU C 3 431 ? 10.103 102.967 128.791 1.00 12.17 ? 431 LEU C C 1 +ATOM 6488 O O . LEU C 3 431 ? 10.736 102.301 129.616 1.00 12.08 ? 431 LEU C O 1 +ATOM 6489 C CB . LEU C 3 431 ? 7.653 102.819 128.328 1.00 11.90 ? 431 LEU C CB 1 +ATOM 6490 C CG . LEU C 3 431 ? 6.236 103.156 128.790 1.00 13.08 ? 431 LEU C CG 1 +ATOM 6491 C CD1 . LEU C 3 431 ? 5.161 102.845 127.711 1.00 14.39 ? 431 LEU C CD1 1 +ATOM 6492 C CD2 . LEU C 3 431 ? 5.915 102.407 130.055 1.00 12.65 ? 431 LEU C CD2 1 +ATOM 6493 N N . GLY C 3 432 ? 10.585 103.244 127.586 1.00 13.00 ? 432 GLY C N 1 +ATOM 6494 C CA . GLY C 3 432 ? 11.880 102.747 127.161 1.00 13.12 ? 432 GLY C CA 1 +ATOM 6495 C C . GLY C 3 432 ? 11.940 101.239 126.974 1.00 13.45 ? 432 GLY C C 1 +ATOM 6496 O O . GLY C 3 432 ? 13.000 100.647 126.977 1.00 14.11 ? 432 GLY C O 1 +ATOM 6497 N N . LEU C 3 433 ? 10.800 100.605 126.771 1.00 14.12 ? 433 LEU C N 1 +ATOM 6498 C CA . LEU C 3 433 ? 10.792 99.162 126.581 1.00 14.28 ? 433 LEU C CA 1 +ATOM 6499 C C . LEU C 3 433 ? 11.010 98.922 125.119 1.00 14.76 ? 433 LEU C C 1 +ATOM 6500 O O . LEU C 3 433 ? 10.206 98.275 124.468 1.00 14.91 ? 433 LEU C O 1 +ATOM 6501 C CB . LEU C 3 433 ? 9.465 98.570 126.986 1.00 13.41 ? 433 LEU C CB 1 +ATOM 6502 C CG . LEU C 3 433 ? 9.175 98.640 128.460 1.00 12.44 ? 433 LEU C CG 1 +ATOM 6503 C CD1 . LEU C 3 433 ? 7.705 98.366 128.733 1.00 10.83 ? 433 LEU C CD1 1 +ATOM 6504 C CD2 . LEU C 3 433 ? 10.012 97.542 129.029 1.00 13.68 ? 433 LEU C CD2 1 +ATOM 6505 N N . ARG C 3 434 ? 12.108 99.454 124.612 1.00 14.98 ? 434 ARG C N 1 +ATOM 6506 C CA . ARG C 3 434 ? 12.268 99.612 123.182 1.00 15.47 ? 434 ARG C CA 1 +ATOM 6507 C C . ARG C 3 434 ? 12.488 98.304 122.444 1.00 16.27 ? 434 ARG C C 1 +ATOM 6508 O O . ARG C 3 434 ? 12.482 98.290 121.204 1.00 16.53 ? 434 ARG C O 1 +ATOM 6509 C CB . ARG C 3 434 ? 13.417 100.525 122.912 1.00 15.22 ? 434 ARG C CB 1 +ATOM 6510 C CG . ARG C 3 434 ? 14.712 99.949 123.344 1.00 14.34 ? 434 ARG C CG 1 +ATOM 6511 C CD . ARG C 3 434 ? 15.837 100.769 122.831 1.00 19.02 ? 434 ARG C CD 1 +ATOM 6512 N NE . ARG C 3 434 ? 17.151 100.213 123.100 1.00 22.32 ? 434 ARG C NE 1 +ATOM 6513 C CZ . ARG C 3 434 ? 18.246 100.930 122.991 1.00 25.61 ? 434 ARG C CZ 1 +ATOM 6514 N NH1 . ARG C 3 434 ? 18.171 102.210 122.626 1.00 26.65 ? 434 ARG C NH1 1 +ATOM 6515 N NH2 . ARG C 3 434 ? 19.424 100.392 123.257 1.00 30.25 ? 434 ARG C NH2 1 +ATOM 6516 N N . SER C 3 435 ? 12.687 97.208 123.183 1.00 16.27 ? 435 SER C N 1 +ATOM 6517 C CA . SER C 3 435 ? 12.761 95.911 122.517 1.00 15.85 ? 435 SER C CA 1 +ATOM 6518 C C . SER C 3 435 ? 11.458 95.130 122.566 1.00 16.09 ? 435 SER C C 1 +ATOM 6519 O O . SER C 3 435 ? 11.358 94.092 121.915 1.00 17.02 ? 435 SER C O 1 +ATOM 6520 C CB . SER C 3 435 ? 13.880 95.053 123.068 1.00 15.18 ? 435 SER C CB 1 +ATOM 6521 O OG . SER C 3 435 ? 15.096 95.620 122.743 1.00 12.81 ? 435 SER C OG 1 +ATOM 6522 N N . LEU C 3 436 ? 10.472 95.601 123.315 1.00 16.05 ? 436 LEU C N 1 +ATOM 6523 C CA . LEU C 3 436 ? 9.305 94.769 123.579 1.00 16.56 ? 436 LEU C CA 1 +ATOM 6524 C C . LEU C 3 436 ? 8.391 94.747 122.376 1.00 17.27 ? 436 LEU C C 1 +ATOM 6525 O O . LEU C 3 436 ? 7.847 95.774 121.996 1.00 18.44 ? 436 LEU C O 1 +ATOM 6526 C CB . LEU C 3 436 ? 8.585 95.216 124.847 1.00 16.07 ? 436 LEU C CB 1 +ATOM 6527 C CG . LEU C 3 436 ? 7.253 94.571 125.177 1.00 16.98 ? 436 LEU C CG 1 +ATOM 6528 C CD1 . LEU C 3 436 ? 7.493 93.130 125.576 1.00 16.99 ? 436 LEU C CD1 1 +ATOM 6529 C CD2 . LEU C 3 436 ? 6.559 95.334 126.305 1.00 15.36 ? 436 LEU C CD2 1 +ATOM 6530 N N . ARG C 3 437 ? 8.244 93.572 121.783 1.00 17.06 ? 437 ARG C N 1 +ATOM 6531 C CA . ARG C 3 437 ? 7.436 93.381 120.592 1.00 18.07 ? 437 ARG C CA 1 +ATOM 6532 C C . ARG C 3 437 ? 6.209 92.494 120.792 1.00 16.92 ? 437 ARG C C 1 +ATOM 6533 O O . ARG C 3 437 ? 5.394 92.379 119.913 1.00 15.91 ? 437 ARG C O 1 +ATOM 6534 C CB . ARG C 3 437 ? 8.283 92.781 119.474 1.00 19.17 ? 437 ARG C CB 1 +ATOM 6535 C CG . ARG C 3 437 ? 8.825 91.408 119.838 1.00 24.10 ? 437 ARG C CG 1 +ATOM 6536 C CD . ARG C 3 437 ? 9.872 90.818 118.877 1.00 34.48 ? 437 ARG C CD 1 +ATOM 6537 N NE . ARG C 3 437 ? 10.175 89.437 119.285 1.00 41.57 ? 437 ARG C NE 1 +ATOM 6538 C CZ . ARG C 3 437 ? 9.293 88.425 119.241 1.00 45.62 ? 437 ARG C CZ 1 +ATOM 6539 N NH1 . ARG C 3 437 ? 8.047 88.605 118.771 1.00 45.85 ? 437 ARG C NH1 1 +ATOM 6540 N NH2 . ARG C 3 437 ? 9.672 87.220 119.650 1.00 47.61 ? 437 ARG C NH2 1 +ATOM 6541 N N . GLU C 3 438 ? 6.099 91.841 121.941 1.00 17.31 ? 438 GLU C N 1 +ATOM 6542 C CA . GLU C 3 438 ? 4.968 90.964 122.208 1.00 16.81 ? 438 GLU C CA 1 +ATOM 6543 C C . GLU C 3 438 ? 4.474 91.015 123.632 1.00 16.54 ? 438 GLU C C 1 +ATOM 6544 O O . GLU C 3 438 ? 5.235 90.899 124.584 1.00 16.71 ? 438 GLU C O 1 +ATOM 6545 C CB . GLU C 3 438 ? 5.307 89.517 121.856 1.00 17.22 ? 438 GLU C CB 1 +ATOM 6546 C CG . GLU C 3 438 ? 4.171 88.512 122.051 1.00 17.98 ? 438 GLU C CG 1 +ATOM 6547 C CD . GLU C 3 438 ? 4.398 87.211 121.282 1.00 21.87 ? 438 GLU C CD 1 +ATOM 6548 O OE1 . GLU C 3 438 ? 4.943 87.245 120.151 1.00 20.09 ? 438 GLU C OE1 1 +ATOM 6549 O OE2 . GLU C 3 438 ? 4.025 86.129 121.809 1.00 25.94 ? 438 GLU C OE2 1 +ATOM 6550 N N . LEU C 3 439 ? 3.164 91.153 123.758 1.00 16.38 ? 439 LEU C N 1 +ATOM 6551 C CA . LEU C 3 439 ? 2.486 90.799 124.985 1.00 15.78 ? 439 LEU C CA 1 +ATOM 6552 C C . LEU C 3 439 ? 1.612 89.555 124.697 1.00 15.81 ? 439 LEU C C 1 +ATOM 6553 O O . LEU C 3 439 ? 0.467 89.662 124.277 1.00 15.47 ? 439 LEU C O 1 +ATOM 6554 C CB . LEU C 3 439 ? 1.720 92.010 125.516 1.00 16.49 ? 439 LEU C CB 1 +ATOM 6555 C CG . LEU C 3 439 ? 2.682 93.176 125.826 1.00 15.32 ? 439 LEU C CG 1 +ATOM 6556 C CD1 . LEU C 3 439 ? 1.904 94.406 126.204 1.00 17.78 ? 439 LEU C CD1 1 +ATOM 6557 C CD2 . LEU C 3 439 ? 3.560 92.780 126.978 1.00 16.00 ? 439 LEU C CD2 1 +ATOM 6558 N N . GLY C 3 440 ? 2.213 88.378 124.905 1.00 15.71 ? 440 GLY C N 1 +ATOM 6559 C CA . GLY C 3 440 ? 1.657 87.090 124.563 1.00 15.14 ? 440 GLY C CA 1 +ATOM 6560 C C . GLY C 3 440 ? 0.194 86.981 124.836 1.00 15.29 ? 440 GLY C C 1 +ATOM 6561 O O . GLY C 3 440 ? -0.560 86.514 124.019 1.00 15.83 ? 440 GLY C O 1 +ATOM 6562 N N . SER C 3 441 ? -0.216 87.448 125.999 1.00 15.99 ? 441 SER C N 1 +ATOM 6563 C CA . SER C 3 441 ? -1.610 87.498 126.345 1.00 15.43 ? 441 SER C CA 1 +ATOM 6564 C C . SER C 3 441 ? -1.698 88.398 127.583 1.00 15.55 ? 441 SER C C 1 +ATOM 6565 O O . SER C 3 441 ? -0.693 88.926 128.025 1.00 15.93 ? 441 SER C O 1 +ATOM 6566 C CB . SER C 3 441 ? -2.112 86.072 126.559 1.00 14.96 ? 441 SER C CB 1 +ATOM 6567 O OG . SER C 3 441 ? -2.392 85.800 127.894 1.00 17.02 ? 441 SER C OG 1 +ATOM 6568 N N . GLY C 3 442 ? -2.889 88.596 128.126 1.00 15.46 ? 442 GLY C N 1 +ATOM 6569 C CA . GLY C 3 442 ? -3.049 89.510 129.243 1.00 15.89 ? 442 GLY C CA 1 +ATOM 6570 C C . GLY C 3 442 ? -3.269 90.929 128.782 1.00 15.34 ? 442 GLY C C 1 +ATOM 6571 O O . GLY C 3 442 ? -3.043 91.237 127.620 1.00 15.48 ? 442 GLY C O 1 +ATOM 6572 N N . LEU C 3 443 ? -3.690 91.785 129.697 1.00 14.55 ? 443 LEU C N 1 +ATOM 6573 C CA . LEU C 3 443 ? -3.892 93.188 129.376 1.00 14.37 ? 443 LEU C CA 1 +ATOM 6574 C C . LEU C 3 443 ? -2.732 94.095 129.867 1.00 14.48 ? 443 LEU C C 1 +ATOM 6575 O O . LEU C 3 443 ? -1.863 93.675 130.633 1.00 15.18 ? 443 LEU C O 1 +ATOM 6576 C CB . LEU C 3 443 ? -5.211 93.640 129.971 1.00 14.18 ? 443 LEU C CB 1 +ATOM 6577 C CG . LEU C 3 443 ? -6.377 92.983 129.278 1.00 14.75 ? 443 LEU C CG 1 +ATOM 6578 C CD1 . LEU C 3 443 ? -7.596 93.689 129.578 1.00 15.09 ? 443 LEU C CD1 1 +ATOM 6579 C CD2 . LEU C 3 443 ? -6.041 93.190 127.870 1.00 17.72 ? 443 LEU C CD2 1 +ATOM 6580 N N . ALA C 3 444 ? -2.696 95.325 129.396 1.00 13.76 ? 444 ALA C N 1 +ATOM 6581 C CA . ALA C 3 444 ? -1.671 96.236 129.855 1.00 14.03 ? 444 ALA C CA 1 +ATOM 6582 C C . ALA C 3 444 ? -2.437 97.289 130.593 1.00 13.82 ? 444 ALA C C 1 +ATOM 6583 O O . ALA C 3 444 ? -3.510 97.710 130.165 1.00 14.12 ? 444 ALA C O 1 +ATOM 6584 C CB . ALA C 3 444 ? -0.914 96.822 128.716 1.00 13.39 ? 444 ALA C CB 1 +ATOM 6585 N N . LEU C 3 445 ? -1.920 97.648 131.749 1.00 13.88 ? 445 LEU C N 1 +ATOM 6586 C CA . LEU C 3 445 ? -2.601 98.557 132.622 1.00 14.17 ? 445 LEU C CA 1 +ATOM 6587 C C . LEU C 3 445 ? -1.571 99.582 133.049 1.00 14.45 ? 445 LEU C C 1 +ATOM 6588 O O . LEU C 3 445 ? -0.668 99.288 133.833 1.00 14.74 ? 445 LEU C O 1 +ATOM 6589 C CB . LEU C 3 445 ? -3.207 97.805 133.809 1.00 13.58 ? 445 LEU C CB 1 +ATOM 6590 C CG . LEU C 3 445 ? -3.775 98.694 134.928 1.00 14.65 ? 445 LEU C CG 1 +ATOM 6591 C CD1 . LEU C 3 445 ? -4.963 99.493 134.458 1.00 12.33 ? 445 LEU C CD1 1 +ATOM 6592 C CD2 . LEU C 3 445 ? -4.168 97.877 136.146 1.00 16.36 ? 445 LEU C CD2 1 +ATOM 6593 N N . ILE C 3 446 ? -1.683 100.770 132.486 1.00 14.87 ? 446 ILE C N 1 +ATOM 6594 C CA . ILE C 3 446 ? -0.767 101.852 132.828 1.00 15.99 ? 446 ILE C CA 1 +ATOM 6595 C C . ILE C 3 446 ? -1.557 103.010 133.426 1.00 16.18 ? 446 ILE C C 1 +ATOM 6596 O O . ILE C 3 446 ? -2.139 103.808 132.708 1.00 16.97 ? 446 ILE C O 1 +ATOM 6597 C CB . ILE C 3 446 ? 0.046 102.265 131.585 1.00 15.65 ? 446 ILE C CB 1 +ATOM 6598 C CG1 . ILE C 3 446 ? 0.698 101.005 130.967 1.00 17.04 ? 446 ILE C CG1 1 +ATOM 6599 C CG2 . ILE C 3 446 ? 1.131 103.243 131.971 1.00 15.32 ? 446 ILE C CG2 1 +ATOM 6600 C CD1 . ILE C 3 446 ? 1.621 101.238 129.726 1.00 16.66 ? 446 ILE C CD1 1 +ATOM 6601 N N . HIS C 3 447 ? -1.630 103.083 134.745 1.00 16.36 ? 447 HIS C N 1 +ATOM 6602 C CA . HIS C 3 447 ? -2.406 104.166 135.355 1.00 16.21 ? 447 HIS C CA 1 +ATOM 6603 C C . HIS C 3 447 ? -1.608 104.943 136.396 1.00 15.67 ? 447 HIS C C 1 +ATOM 6604 O O . HIS C 3 447 ? -0.622 104.460 136.913 1.00 15.32 ? 447 HIS C O 1 +ATOM 6605 C CB . HIS C 3 447 ? -3.746 103.666 135.918 1.00 15.52 ? 447 HIS C CB 1 +ATOM 6606 C CG . HIS C 3 447 ? -3.603 102.798 137.124 1.00 17.52 ? 447 HIS C CG 1 +ATOM 6607 N ND1 . HIS C 3 447 ? -3.037 101.535 137.073 1.00 19.22 ? 447 HIS C ND1 1 +ATOM 6608 C CD2 . HIS C 3 447 ? -3.936 103.011 138.422 1.00 17.74 ? 447 HIS C CD2 1 +ATOM 6609 C CE1 . HIS C 3 447 ? -3.031 101.010 138.286 1.00 18.44 ? 447 HIS C CE1 1 +ATOM 6610 N NE2 . HIS C 3 447 ? -3.567 101.887 139.122 1.00 18.78 ? 447 HIS C NE2 1 +ATOM 6611 N N . HIS C 3 448 ? -2.041 106.167 136.668 1.00 15.81 ? 448 HIS C N 1 +ATOM 6612 C CA . HIS C 3 448 ? -1.574 106.937 137.818 1.00 15.42 ? 448 HIS C CA 1 +ATOM 6613 C C . HIS C 3 448 ? -0.080 107.178 137.817 1.00 15.55 ? 448 HIS C C 1 +ATOM 6614 O O . HIS C 3 448 ? 0.594 107.178 138.863 1.00 16.15 ? 448 HIS C O 1 +ATOM 6615 C CB . HIS C 3 448 ? -2.097 106.325 139.106 1.00 15.31 ? 448 HIS C CB 1 +ATOM 6616 C CG . HIS C 3 448 ? -3.570 106.503 139.261 1.00 15.68 ? 448 HIS C CG 1 +ATOM 6617 N ND1 . HIS C 3 448 ? -4.121 107.533 139.994 1.00 13.92 ? 448 HIS C ND1 1 +ATOM 6618 C CD2 . HIS C 3 448 ? -4.608 105.841 138.701 1.00 16.30 ? 448 HIS C CD2 1 +ATOM 6619 C CE1 . HIS C 3 448 ? -5.436 107.484 139.893 1.00 15.17 ? 448 HIS C CE1 1 +ATOM 6620 N NE2 . HIS C 3 448 ? -5.759 106.464 139.118 1.00 16.09 ? 448 HIS C NE2 1 +ATOM 6621 N N . ASN C 3 449 ? 0.432 107.432 136.618 1.00 14.92 ? 449 ASN C N 1 +ATOM 6622 C CA . ASN C 3 449 ? 1.835 107.812 136.478 1.00 13.95 ? 449 ASN C CA 1 +ATOM 6623 C C . ASN C 3 449 ? 1.995 109.278 136.110 1.00 12.87 ? 449 ASN C C 1 +ATOM 6624 O O . ASN C 3 449 ? 2.103 109.634 134.941 1.00 11.58 ? 449 ASN C O 1 +ATOM 6625 C CB . ASN C 3 449 ? 2.568 106.840 135.547 1.00 13.99 ? 449 ASN C CB 1 +ATOM 6626 C CG . ASN C 3 449 ? 2.423 105.413 136.012 1.00 14.34 ? 449 ASN C CG 1 +ATOM 6627 O OD1 . ASN C 3 449 ? 2.931 105.047 137.076 1.00 15.73 ? 449 ASN C OD1 1 +ATOM 6628 N ND2 . ASN C 3 449 ? 1.658 104.614 135.264 1.00 12.41 ? 449 ASN C ND2 1 +ATOM 6629 N N . THR C 3 450 ? 1.979 110.110 137.148 1.00 12.22 ? 450 THR C N 1 +ATOM 6630 C CA . THR C 3 450 ? 2.004 111.575 137.009 1.00 12.52 ? 450 THR C CA 1 +ATOM 6631 C C . THR C 3 450 ? 2.758 112.139 135.801 1.00 11.98 ? 450 THR C C 1 +ATOM 6632 O O . THR C 3 450 ? 2.232 113.026 135.113 1.00 10.66 ? 450 THR C O 1 +ATOM 6633 C CB . THR C 3 450 ? 2.576 112.240 138.282 1.00 12.58 ? 450 THR C CB 1 +ATOM 6634 O OG1 . THR C 3 450 ? 1.901 111.745 139.436 1.00 14.33 ? 450 THR C OG1 1 +ATOM 6635 C CG2 . THR C 3 450 ? 2.256 113.747 138.297 1.00 13.80 ? 450 THR C CG2 1 +ATOM 6636 N N . HIS C 3 451 ? 3.984 111.641 135.565 1.00 12.13 ? 451 HIS C N 1 +ATOM 6637 C CA . HIS C 3 451 ? 4.905 112.310 134.635 1.00 12.29 ? 451 HIS C CA 1 +ATOM 6638 C C . HIS C 3 451 ? 5.148 111.552 133.355 1.00 12.93 ? 451 HIS C C 1 +ATOM 6639 O O . HIS C 3 451 ? 5.907 112.023 132.458 1.00 13.79 ? 451 HIS C O 1 +ATOM 6640 C CB . HIS C 3 451 ? 6.287 112.580 135.244 1.00 11.62 ? 451 HIS C CB 1 +ATOM 6641 C CG . HIS C 3 451 ? 6.268 113.060 136.650 1.00 8.69 ? 451 HIS C CG 1 +ATOM 6642 N ND1 . HIS C 3 451 ? 6.559 112.233 137.710 1.00 7.14 ? 451 HIS C ND1 1 +ATOM 6643 C CD2 . HIS C 3 451 ? 6.078 114.290 137.170 1.00 8.57 ? 451 HIS C CD2 1 +ATOM 6644 C CE1 . HIS C 3 451 ? 6.513 112.923 138.831 1.00 8.43 ? 451 HIS C CE1 1 +ATOM 6645 N NE2 . HIS C 3 451 ? 6.224 114.176 138.533 1.00 10.03 ? 451 HIS C NE2 1 +ATOM 6646 N N . LEU C 3 452 ? 4.541 110.382 133.283 1.00 12.61 ? 452 LEU C N 1 +ATOM 6647 C CA . LEU C 3 452 ? 4.732 109.477 132.161 1.00 12.84 ? 452 LEU C CA 1 +ATOM 6648 C C . LEU C 3 452 ? 4.041 109.906 130.840 1.00 13.21 ? 452 LEU C C 1 +ATOM 6649 O O . LEU C 3 452 ? 2.817 109.853 130.720 1.00 13.60 ? 452 LEU C O 1 +ATOM 6650 C CB . LEU C 3 452 ? 4.275 108.081 132.597 1.00 11.86 ? 452 LEU C CB 1 +ATOM 6651 C CG . LEU C 3 452 ? 4.239 106.990 131.554 1.00 11.74 ? 452 LEU C CG 1 +ATOM 6652 C CD1 . LEU C 3 452 ? 5.659 106.455 131.276 1.00 12.99 ? 452 LEU C CD1 1 +ATOM 6653 C CD2 . LEU C 3 452 ? 3.379 105.918 132.109 1.00 12.76 ? 452 LEU C CD2 1 +ATOM 6654 N N . CYS C 3 453 ? 4.833 110.367 129.880 1.00 14.08 ? 453 CYS C N 1 +ATOM 6655 C CA . CYS C 3 453 ? 4.417 110.488 128.486 1.00 15.22 ? 453 CYS C CA 1 +ATOM 6656 C C . CYS C 3 453 ? 4.834 109.233 127.762 1.00 15.67 ? 453 CYS C C 1 +ATOM 6657 O O . CYS C 3 453 ? 5.354 108.302 128.383 1.00 15.51 ? 453 CYS C O 1 +ATOM 6658 C CB . CYS C 3 453 ? 5.185 111.605 127.831 1.00 15.63 ? 453 CYS C CB 1 +ATOM 6659 S SG . CYS C 3 453 ? 4.927 113.204 128.574 1.00 19.43 ? 453 CYS C SG 1 +ATOM 6660 N N . PHE C 3 454 ? 4.652 109.239 126.438 1.00 16.34 ? 454 PHE C N 1 +ATOM 6661 C CA . PHE C 3 454 ? 5.084 108.159 125.544 1.00 16.63 ? 454 PHE C CA 1 +ATOM 6662 C C . PHE C 3 454 ? 4.464 106.837 125.880 1.00 17.58 ? 454 PHE C C 1 +ATOM 6663 O O . PHE C 3 454 ? 5.179 105.833 125.974 1.00 18.26 ? 454 PHE C O 1 +ATOM 6664 C CB . PHE C 3 454 ? 6.603 108.005 125.514 1.00 16.36 ? 454 PHE C CB 1 +ATOM 6665 C CG . PHE C 3 454 ? 7.315 109.229 125.047 1.00 15.62 ? 454 PHE C CG 1 +ATOM 6666 C CD1 . PHE C 3 454 ? 7.731 110.186 125.957 1.00 15.84 ? 454 PHE C CD1 1 +ATOM 6667 C CD2 . PHE C 3 454 ? 7.536 109.446 123.694 1.00 14.49 ? 454 PHE C CD2 1 +ATOM 6668 C CE1 . PHE C 3 454 ? 8.381 111.343 125.518 1.00 16.57 ? 454 PHE C CE1 1 +ATOM 6669 C CE2 . PHE C 3 454 ? 8.174 110.589 123.245 1.00 14.99 ? 454 PHE C CE2 1 +ATOM 6670 C CZ . PHE C 3 454 ? 8.605 111.543 124.153 1.00 16.42 ? 454 PHE C CZ 1 +ATOM 6671 N N . VAL C 3 455 ? 3.145 106.858 126.068 1.00 17.70 ? 455 VAL C N 1 +ATOM 6672 C CA . VAL C 3 455 ? 2.333 105.676 126.263 1.00 18.21 ? 455 VAL C CA 1 +ATOM 6673 C C . VAL C 3 455 ? 1.446 105.467 125.034 1.00 18.02 ? 455 VAL C C 1 +ATOM 6674 O O . VAL C 3 455 ? 1.287 104.339 124.568 1.00 17.80 ? 455 VAL C O 1 +ATOM 6675 C CB . VAL C 3 455 ? 1.479 105.799 127.571 1.00 19.01 ? 455 VAL C CB 1 +ATOM 6676 C CG1 . VAL C 3 455 ? 0.204 104.938 127.555 1.00 18.39 ? 455 VAL C CG1 1 +ATOM 6677 C CG2 . VAL C 3 455 ? 2.314 105.426 128.784 1.00 20.78 ? 455 VAL C CG2 1 +ATOM 6678 N N . HIS C 3 456 ? 0.888 106.563 124.511 1.00 17.98 ? 456 HIS C N 1 +ATOM 6679 C CA . HIS C 3 456 ? -0.023 106.531 123.347 1.00 18.00 ? 456 HIS C CA 1 +ATOM 6680 C C . HIS C 3 456 ? 0.721 106.711 122.029 1.00 17.26 ? 456 HIS C C 1 +ATOM 6681 O O . HIS C 3 456 ? 0.179 107.037 120.969 1.00 16.20 ? 456 HIS C O 1 +ATOM 6682 C CB . HIS C 3 456 ? -1.142 107.518 123.589 1.00 18.18 ? 456 HIS C CB 1 +ATOM 6683 C CG . HIS C 3 456 ? -1.803 107.282 124.908 1.00 20.36 ? 456 HIS C CG 1 +ATOM 6684 N ND1 . HIS C 3 456 ? -2.654 106.219 125.125 1.00 21.23 ? 456 HIS C ND1 1 +ATOM 6685 C CD2 . HIS C 3 456 ? -1.637 107.886 126.108 1.00 21.22 ? 456 HIS C CD2 1 +ATOM 6686 C CE1 . HIS C 3 456 ? -3.044 106.226 126.385 1.00 22.14 ? 456 HIS C CE1 1 +ATOM 6687 N NE2 . HIS C 3 456 ? -2.434 107.224 127.004 1.00 23.16 ? 456 HIS C NE2 1 +ATOM 6688 N N . THR C 3 457 ? 1.987 106.366 122.186 1.00 17.39 ? 457 THR C N 1 +ATOM 6689 C CA . THR C 3 457 ? 3.122 106.518 121.316 1.00 17.06 ? 457 THR C CA 1 +ATOM 6690 C C . THR C 3 457 ? 3.503 105.080 120.928 1.00 15.95 ? 457 THR C C 1 +ATOM 6691 O O . THR C 3 457 ? 4.017 104.828 119.856 1.00 16.74 ? 457 THR C O 1 +ATOM 6692 C CB . THR C 3 457 ? 4.185 107.152 122.259 1.00 17.49 ? 457 THR C CB 1 +ATOM 6693 O OG1 . THR C 3 457 ? 4.266 108.555 122.018 1.00 19.91 ? 457 THR C OG1 1 +ATOM 6694 C CG2 . THR C 3 457 ? 5.558 106.674 122.025 1.00 16.93 ? 457 THR C CG2 1 +ATOM 6695 N N . VAL C 3 458 ? 3.255 104.138 121.819 1.00 14.37 ? 458 VAL C N 1 +ATOM 6696 C CA . VAL C 3 458 ? 3.537 102.767 121.543 1.00 14.78 ? 458 VAL C CA 1 +ATOM 6697 C C . VAL C 3 458 ? 2.360 102.154 120.746 1.00 15.13 ? 458 VAL C C 1 +ATOM 6698 O O . VAL C 3 458 ? 1.208 102.266 121.165 1.00 15.29 ? 458 VAL C O 1 +ATOM 6699 C CB . VAL C 3 458 ? 3.712 101.991 122.861 1.00 15.57 ? 458 VAL C CB 1 +ATOM 6700 C CG1 . VAL C 3 458 ? 3.904 100.454 122.589 1.00 15.72 ? 458 VAL C CG1 1 +ATOM 6701 C CG2 . VAL C 3 458 ? 4.857 102.578 123.729 1.00 14.09 ? 458 VAL C CG2 1 +ATOM 6702 N N . PRO C 3 459 ? 2.622 101.466 119.631 1.00 14.67 ? 459 PRO C N 1 +ATOM 6703 C CA . PRO C 3 459 ? 1.528 100.860 118.861 1.00 14.45 ? 459 PRO C CA 1 +ATOM 6704 C C . PRO C 3 459 ? 1.125 99.568 119.564 1.00 14.32 ? 459 PRO C C 1 +ATOM 6705 O O . PRO C 3 459 ? 1.514 98.467 119.162 1.00 14.62 ? 459 PRO C O 1 +ATOM 6706 C CB . PRO C 3 459 ? 2.177 100.576 117.509 1.00 13.87 ? 459 PRO C CB 1 +ATOM 6707 C CG . PRO C 3 459 ? 3.582 100.256 117.869 1.00 14.84 ? 459 PRO C CG 1 +ATOM 6708 C CD . PRO C 3 459 ? 3.937 101.154 119.044 1.00 14.48 ? 459 PRO C CD 1 +ATOM 6709 N N . TRP C 3 460 ? 0.393 99.714 120.662 1.00 14.11 ? 460 TRP C N 1 +ATOM 6710 C CA . TRP C 3 460 ? -0.044 98.565 121.445 1.00 13.79 ? 460 TRP C CA 1 +ATOM 6711 C C . TRP C 3 460 ? -0.597 97.429 120.564 1.00 14.33 ? 460 TRP C C 1 +ATOM 6712 O O . TRP C 3 460 ? -0.233 96.273 120.768 1.00 14.32 ? 460 TRP C O 1 +ATOM 6713 C CB . TRP C 3 460 ? -0.993 99.024 122.550 1.00 12.52 ? 460 TRP C CB 1 +ATOM 6714 C CG . TRP C 3 460 ? -0.234 99.880 123.526 1.00 11.38 ? 460 TRP C CG 1 +ATOM 6715 C CD1 . TRP C 3 460 ? -0.305 101.244 123.664 1.00 10.94 ? 460 TRP C CD1 1 +ATOM 6716 C CD2 . TRP C 3 460 ? 0.731 99.441 124.486 1.00 8.85 ? 460 TRP C CD2 1 +ATOM 6717 N NE1 . TRP C 3 460 ? 0.559 101.678 124.644 1.00 10.45 ? 460 TRP C NE1 1 +ATOM 6718 C CE2 . TRP C 3 460 ? 1.204 100.590 125.170 1.00 10.47 ? 460 TRP C CE2 1 +ATOM 6719 C CE3 . TRP C 3 460 ? 1.235 98.196 124.851 1.00 7.81 ? 460 TRP C CE3 1 +ATOM 6720 C CZ2 . TRP C 3 460 ? 2.158 100.525 126.182 1.00 10.21 ? 460 TRP C CZ2 1 +ATOM 6721 C CZ3 . TRP C 3 460 ? 2.196 98.125 125.847 1.00 12.42 ? 460 TRP C CZ3 1 +ATOM 6722 C CH2 . TRP C 3 460 ? 2.656 99.294 126.502 1.00 9.56 ? 460 TRP C CH2 1 +ATOM 6723 N N . ASP C 3 461 ? -1.422 97.799 119.583 1.00 15.43 ? 461 ASP C N 1 +ATOM 6724 C CA . ASP C 3 461 ? -1.977 96.957 118.506 1.00 17.28 ? 461 ASP C CA 1 +ATOM 6725 C C . ASP C 3 461 ? -0.983 95.865 118.118 1.00 16.89 ? 461 ASP C C 1 +ATOM 6726 O O . ASP C 3 461 ? -1.340 94.702 118.000 1.00 16.61 ? 461 ASP C O 1 +ATOM 6727 C CB . ASP C 3 461 ? -2.201 97.868 117.274 1.00 18.80 ? 461 ASP C CB 1 +ATOM 6728 C CG . ASP C 3 461 ? -3.429 97.474 116.397 1.00 23.23 ? 461 ASP C CG 1 +ATOM 6729 O OD1 . ASP C 3 461 ? -3.334 96.506 115.574 1.00 27.10 ? 461 ASP C OD1 1 +ATOM 6730 O OD2 . ASP C 3 461 ? -4.514 98.125 116.403 1.00 25.60 ? 461 ASP C OD2 1 +ATOM 6731 N N . GLN C 3 462 ? 0.274 96.255 117.921 1.00 16.58 ? 462 GLN C N 1 +ATOM 6732 C CA . GLN C 3 462 ? 1.312 95.344 117.464 1.00 16.34 ? 462 GLN C CA 1 +ATOM 6733 C C . GLN C 3 462 ? 1.828 94.394 118.547 1.00 15.96 ? 462 GLN C C 1 +ATOM 6734 O O . GLN C 3 462 ? 2.223 93.272 118.240 1.00 16.34 ? 462 GLN C O 1 +ATOM 6735 C CB . GLN C 3 462 ? 2.470 96.125 116.869 1.00 16.24 ? 462 GLN C CB 1 +ATOM 6736 C CG . GLN C 3 462 ? 2.339 96.321 115.394 1.00 19.04 ? 462 GLN C CG 1 +ATOM 6737 C CD . GLN C 3 462 ? 2.857 97.675 114.964 1.00 22.10 ? 462 GLN C CD 1 +ATOM 6738 O OE1 . GLN C 3 462 ? 4.082 97.911 114.949 1.00 22.35 ? 462 GLN C OE1 1 +ATOM 6739 N NE2 . GLN C 3 462 ? 1.934 98.580 114.623 1.00 23.09 ? 462 GLN C NE2 1 +ATOM 6740 N N . LEU C 3 463 ? 1.829 94.807 119.807 1.00 14.96 ? 463 LEU C N 1 +ATOM 6741 C CA . LEU C 3 463 ? 2.260 93.869 120.812 1.00 14.42 ? 463 LEU C CA 1 +ATOM 6742 C C . LEU C 3 463 ? 1.197 92.815 121.106 1.00 13.98 ? 463 LEU C C 1 +ATOM 6743 O O . LEU C 3 463 ? 1.541 91.720 121.551 1.00 14.65 ? 463 LEU C O 1 +ATOM 6744 C CB . LEU C 3 463 ? 2.704 94.557 122.107 1.00 14.52 ? 463 LEU C CB 1 +ATOM 6745 C CG . LEU C 3 463 ? 3.771 95.665 122.162 1.00 15.35 ? 463 LEU C CG 1 +ATOM 6746 C CD1 . LEU C 3 463 ? 4.703 95.758 121.005 1.00 9.03 ? 463 LEU C CD1 1 +ATOM 6747 C CD2 . LEU C 3 463 ? 3.058 96.958 122.298 1.00 19.11 ? 463 LEU C CD2 1 +ATOM 6748 N N . PHE C 3 464 ? -0.080 93.111 120.888 1.00 13.07 ? 464 PHE C N 1 +ATOM 6749 C CA . PHE C 3 464 ? -1.092 92.175 121.347 1.00 13.16 ? 464 PHE C CA 1 +ATOM 6750 C C . PHE C 3 464 ? -1.188 90.995 120.403 1.00 14.05 ? 464 PHE C C 1 +ATOM 6751 O O . PHE C 3 464 ? -0.796 91.083 119.237 1.00 14.57 ? 464 PHE C O 1 +ATOM 6752 C CB . PHE C 3 464 ? -2.421 92.868 121.557 1.00 12.98 ? 464 PHE C CB 1 +ATOM 6753 C CG . PHE C 3 464 ? -2.400 93.885 122.680 1.00 13.75 ? 464 PHE C CG 1 +ATOM 6754 C CD1 . PHE C 3 464 ? -3.012 95.122 122.529 1.00 13.26 ? 464 PHE C CD1 1 +ATOM 6755 C CD2 . PHE C 3 464 ? -1.753 93.606 123.895 1.00 13.66 ? 464 PHE C CD2 1 +ATOM 6756 C CE1 . PHE C 3 464 ? -2.973 96.064 123.565 1.00 12.90 ? 464 PHE C CE1 1 +ATOM 6757 C CE2 . PHE C 3 464 ? -1.710 94.543 124.916 1.00 13.40 ? 464 PHE C CE2 1 +ATOM 6758 C CZ . PHE C 3 464 ? -2.324 95.776 124.743 1.00 13.12 ? 464 PHE C CZ 1 +ATOM 6759 N N . ARG C 3 465 ? -1.664 89.863 120.899 1.00 14.49 ? 465 ARG C N 1 +ATOM 6760 C CA . ARG C 3 465 ? -1.747 88.682 120.057 1.00 14.37 ? 465 ARG C CA 1 +ATOM 6761 C C . ARG C 3 465 ? -3.136 88.045 120.077 1.00 15.21 ? 465 ARG C C 1 +ATOM 6762 O O . ARG C 3 465 ? -3.388 87.093 119.314 1.00 14.71 ? 465 ARG C O 1 +ATOM 6763 C CB . ARG C 3 465 ? -0.661 87.658 120.417 1.00 14.65 ? 465 ARG C CB 1 +ATOM 6764 C CG . ARG C 3 465 ? 0.830 88.036 120.077 1.00 14.19 ? 465 ARG C CG 1 +ATOM 6765 C CD . ARG C 3 465 ? 1.174 88.416 118.606 1.00 15.09 ? 465 ARG C CD 1 +ATOM 6766 N NE . ARG C 3 465 ? 2.133 89.528 118.635 1.00 17.13 ? 465 ARG C NE 1 +ATOM 6767 C CZ . ARG C 3 465 ? 3.411 89.434 118.282 1.00 19.30 ? 465 ARG C CZ 1 +ATOM 6768 N NH1 . ARG C 3 465 ? 3.901 88.298 117.783 1.00 20.18 ? 465 ARG C NH1 1 +ATOM 6769 N NH2 . ARG C 3 465 ? 4.211 90.478 118.416 1.00 17.68 ? 465 ARG C NH2 1 +ATOM 6770 N N . ASN C 3 466 ? -4.038 88.546 120.932 1.00 15.63 ? 466 ASN C N 1 +ATOM 6771 C CA . ASN C 3 466 ? -5.452 88.148 120.843 1.00 16.78 ? 466 ASN C CA 1 +ATOM 6772 C C . ASN C 3 466 ? -6.393 89.341 120.991 1.00 16.86 ? 466 ASN C C 1 +ATOM 6773 O O . ASN C 3 466 ? -5.979 90.371 121.498 1.00 17.80 ? 466 ASN C O 1 +ATOM 6774 C CB . ASN C 3 466 ? -5.815 86.912 121.714 1.00 16.74 ? 466 ASN C CB 1 +ATOM 6775 C CG . ASN C 3 466 ? -5.878 87.214 123.200 1.00 19.53 ? 466 ASN C CG 1 +ATOM 6776 O OD1 . ASN C 3 466 ? -5.128 86.647 123.999 1.00 20.09 ? 466 ASN C OD1 1 +ATOM 6777 N ND2 . ASN C 3 466 ? -6.780 88.105 123.582 1.00 21.64 ? 466 ASN C ND2 1 +ATOM 6778 N N . PRO C 3 467 ? -7.620 89.242 120.481 1.00 16.82 ? 467 PRO C N 1 +ATOM 6779 C CA . PRO C 3 467 ? -8.570 90.358 120.553 1.00 17.07 ? 467 PRO C CA 1 +ATOM 6780 C C . PRO C 3 467 ? -9.112 90.678 121.956 1.00 17.01 ? 467 PRO C C 1 +ATOM 6781 O O . PRO C 3 467 ? -9.809 91.697 122.108 1.00 17.75 ? 467 PRO C O 1 +ATOM 6782 C CB . PRO C 3 467 ? -9.710 89.922 119.618 1.00 16.97 ? 467 PRO C CB 1 +ATOM 6783 C CG . PRO C 3 467 ? -9.628 88.446 119.567 1.00 16.97 ? 467 PRO C CG 1 +ATOM 6784 C CD . PRO C 3 467 ? -8.175 88.097 119.744 1.00 16.98 ? 467 PRO C CD 1 +ATOM 6785 N N . HIS C 3 468 ? -8.824 89.830 122.943 1.00 16.32 ? 468 HIS C N 1 +ATOM 6786 C CA . HIS C 3 468 ? -9.232 90.092 124.326 1.00 15.11 ? 468 HIS C CA 1 +ATOM 6787 C C . HIS C 3 468 ? -8.239 91.048 124.988 1.00 14.45 ? 468 HIS C C 1 +ATOM 6788 O O . HIS C 3 468 ? -8.336 91.322 126.179 1.00 14.72 ? 468 HIS C O 1 +ATOM 6789 C CB . HIS C 3 468 ? -9.348 88.790 125.141 1.00 14.40 ? 468 HIS C CB 1 +ATOM 6790 C CG . HIS C 3 468 ? -10.564 87.988 124.826 1.00 15.22 ? 468 HIS C CG 1 +ATOM 6791 N ND1 . HIS C 3 468 ? -11.825 88.359 125.241 1.00 15.96 ? 468 HIS C ND1 1 +ATOM 6792 C CD2 . HIS C 3 468 ? -10.719 86.838 124.126 1.00 15.22 ? 468 HIS C CD2 1 +ATOM 6793 C CE1 . HIS C 3 468 ? -12.707 87.479 124.801 1.00 16.37 ? 468 HIS C CE1 1 +ATOM 6794 N NE2 . HIS C 3 468 ? -12.062 86.545 124.125 1.00 16.62 ? 468 HIS C NE2 1 +ATOM 6795 N N . GLN C 3 469 ? -7.273 91.547 124.234 1.00 13.46 ? 469 GLN C N 1 +ATOM 6796 C CA . GLN C 3 469 ? -6.234 92.378 124.857 1.00 12.33 ? 469 GLN C CA 1 +ATOM 6797 C C . GLN C 3 469 ? -6.393 93.862 124.552 1.00 12.12 ? 469 GLN C C 1 +ATOM 6798 O O . GLN C 3 469 ? -6.899 94.247 123.517 1.00 12.44 ? 469 GLN C O 1 +ATOM 6799 C CB . GLN C 3 469 ? -4.859 91.931 124.415 1.00 11.86 ? 469 GLN C CB 1 +ATOM 6800 C CG . GLN C 3 469 ? -4.512 90.539 124.747 1.00 12.28 ? 469 GLN C CG 1 +ATOM 6801 C CD . GLN C 3 469 ? -3.130 90.213 124.276 1.00 14.68 ? 469 GLN C CD 1 +ATOM 6802 O OE1 . GLN C 3 469 ? -2.951 89.852 123.113 1.00 15.29 ? 469 GLN C OE1 1 +ATOM 6803 N NE2 . GLN C 3 469 ? -2.132 90.391 125.146 1.00 14.95 ? 469 GLN C NE2 1 +ATOM 6804 N N . ALA C 3 470 ? -5.940 94.708 125.449 1.00 12.41 ? 470 ALA C N 1 +ATOM 6805 C CA . ALA C 3 470 ? -6.016 96.136 125.210 1.00 13.05 ? 470 ALA C CA 1 +ATOM 6806 C C . ALA C 3 470 ? -5.150 96.840 126.202 1.00 13.49 ? 470 ALA C C 1 +ATOM 6807 O O . ALA C 3 470 ? -4.571 96.225 127.113 1.00 12.62 ? 470 ALA C O 1 +ATOM 6808 C CB . ALA C 3 470 ? -7.482 96.676 125.300 1.00 12.15 ? 470 ALA C CB 1 +ATOM 6809 N N . LEU C 3 471 ? -5.072 98.153 126.006 1.00 14.45 ? 471 LEU C N 1 +ATOM 6810 C CA . LEU C 3 471 ? -4.331 98.997 126.905 1.00 15.10 ? 471 LEU C CA 1 +ATOM 6811 C C . LEU C 3 471 ? -5.319 99.822 127.698 1.00 15.99 ? 471 LEU C C 1 +ATOM 6812 O O . LEU C 3 471 ? -6.202 100.517 127.139 1.00 16.17 ? 471 LEU C O 1 +ATOM 6813 C CB . LEU C 3 471 ? -3.370 99.867 126.124 1.00 15.49 ? 471 LEU C CB 1 +ATOM 6814 C CG . LEU C 3 471 ? -2.320 100.713 126.838 1.00 14.71 ? 471 LEU C CG 1 +ATOM 6815 C CD1 . LEU C 3 471 ? -2.737 102.140 126.754 1.00 10.70 ? 471 LEU C CD1 1 +ATOM 6816 C CD2 . LEU C 3 471 ? -2.055 100.250 128.270 1.00 15.29 ? 471 LEU C CD2 1 +ATOM 6817 N N . LEU C 3 472 ? -5.198 99.684 129.014 1.00 16.02 ? 472 LEU C N 1 +ATOM 6818 C CA . LEU C 3 472 ? -6.090 100.343 129.936 1.00 15.82 ? 472 LEU C CA 1 +ATOM 6819 C C . LEU C 3 472 ? -5.231 101.393 130.605 1.00 16.03 ? 472 LEU C C 1 +ATOM 6820 O O . LEU C 3 472 ? -4.098 101.103 131.023 1.00 15.89 ? 472 LEU C O 1 +ATOM 6821 C CB . LEU C 3 472 ? -6.613 99.331 130.926 1.00 15.77 ? 472 LEU C CB 1 +ATOM 6822 C CG . LEU C 3 472 ? -7.422 98.195 130.311 1.00 15.21 ? 472 LEU C CG 1 +ATOM 6823 C CD1 . LEU C 3 472 ? -7.911 97.304 131.420 1.00 15.18 ? 472 LEU C CD1 1 +ATOM 6824 C CD2 . LEU C 3 472 ? -8.566 98.705 129.501 1.00 14.16 ? 472 LEU C CD2 1 +ATOM 6825 N N . HIS C 3 473 ? -5.742 102.620 130.666 1.00 15.77 ? 473 HIS C N 1 +ATOM 6826 C CA . HIS C 3 473 ? -4.875 103.759 130.916 1.00 16.06 ? 473 HIS C CA 1 +ATOM 6827 C C . HIS C 3 473 ? -5.647 104.959 131.408 1.00 15.83 ? 473 HIS C C 1 +ATOM 6828 O O . HIS C 3 473 ? -6.593 105.423 130.769 1.00 15.86 ? 473 HIS C O 1 +ATOM 6829 C CB . HIS C 3 473 ? -4.097 104.125 129.637 1.00 15.93 ? 473 HIS C CB 1 +ATOM 6830 C CG . HIS C 3 473 ? -4.980 104.634 128.541 1.00 16.65 ? 473 HIS C CG 1 +ATOM 6831 N ND1 . HIS C 3 473 ? -5.547 105.891 128.570 1.00 16.72 ? 473 HIS C ND1 1 +ATOM 6832 C CD2 . HIS C 3 473 ? -5.439 104.037 127.419 1.00 14.96 ? 473 HIS C CD2 1 +ATOM 6833 C CE1 . HIS C 3 473 ? -6.301 106.053 127.498 1.00 18.29 ? 473 HIS C CE1 1 +ATOM 6834 N NE2 . HIS C 3 473 ? -6.245 104.945 126.779 1.00 18.00 ? 473 HIS C NE2 1 +ATOM 6835 N N . THR C 3 474 ? -5.206 105.478 132.543 1.00 16.21 ? 474 THR C N 1 +ATOM 6836 C CA . THR C 3 474 ? -5.791 106.691 133.130 1.00 16.25 ? 474 THR C CA 1 +ATOM 6837 C C . THR C 3 474 ? -4.755 107.392 134.033 1.00 16.08 ? 474 THR C C 1 +ATOM 6838 O O . THR C 3 474 ? -3.691 106.805 134.312 1.00 16.53 ? 474 THR C O 1 +ATOM 6839 C CB . THR C 3 474 ? -7.166 106.352 133.806 1.00 16.21 ? 474 THR C CB 1 +ATOM 6840 O OG1 . THR C 3 474 ? -7.824 107.548 134.211 1.00 16.82 ? 474 THR C OG1 1 +ATOM 6841 C CG2 . THR C 3 474 ? -7.036 105.496 135.086 1.00 15.12 ? 474 THR C CG2 1 +ATOM 6842 N N . ALA C 3 475 ? -5.007 108.648 134.409 1.00 15.78 ? 475 ALA C N 1 +ATOM 6843 C CA . ALA C 3 475 ? -4.091 109.415 135.284 1.00 15.38 ? 475 ALA C CA 1 +ATOM 6844 C C . ALA C 3 475 ? -2.576 109.348 134.953 1.00 15.76 ? 475 ALA C C 1 +ATOM 6845 O O . ALA C 3 475 ? -1.732 109.453 135.845 1.00 16.19 ? 475 ALA C O 1 +ATOM 6846 C CB . ALA C 3 475 ? -4.333 109.049 136.761 1.00 14.93 ? 475 ALA C CB 1 +ATOM 6847 N N . ASN C 3 476 ? -2.213 109.156 133.689 1.00 15.81 ? 476 ASN C N 1 +ATOM 6848 C CA . ASN C 3 476 ? -0.822 109.347 133.300 1.00 16.25 ? 476 ASN C CA 1 +ATOM 6849 C C . ASN C 3 476 ? -0.747 110.749 132.753 1.00 16.34 ? 476 ASN C C 1 +ATOM 6850 O O . ASN C 3 476 ? -1.792 111.380 132.622 1.00 17.49 ? 476 ASN C O 1 +ATOM 6851 C CB . ASN C 3 476 ? -0.387 108.349 132.246 1.00 16.04 ? 476 ASN C CB 1 +ATOM 6852 C CG . ASN C 3 476 ? -0.631 106.910 132.664 1.00 18.80 ? 476 ASN C CG 1 +ATOM 6853 O OD1 . ASN C 3 476 ? -1.020 106.078 131.839 1.00 19.23 ? 476 ASN C OD1 1 +ATOM 6854 N ND2 . ASN C 3 476 ? -0.393 106.602 133.939 1.00 22.01 ? 476 ASN C ND2 1 +ATOM 6855 N N . ARG C 3 477 ? 0.455 111.240 132.429 1.00 15.81 ? 477 ARG C N 1 +ATOM 6856 C CA . ARG C 3 477 ? 0.609 112.601 131.946 1.00 14.71 ? 477 ARG C CA 1 +ATOM 6857 C C . ARG C 3 477 ? -0.262 112.888 130.741 1.00 15.39 ? 477 ARG C C 1 +ATOM 6858 O O . ARG C 3 477 ? -0.156 112.203 129.742 1.00 14.52 ? 477 ARG C O 1 +ATOM 6859 C CB . ARG C 3 477 ? 2.045 112.903 131.611 1.00 14.22 ? 477 ARG C CB 1 +ATOM 6860 C CG . ARG C 3 477 ? 2.446 114.150 132.223 1.00 11.65 ? 477 ARG C CG 1 +ATOM 6861 C CD . ARG C 3 477 ? 3.686 114.738 131.684 1.00 10.12 ? 477 ARG C CD 1 +ATOM 6862 N NE . ARG C 3 477 ? 3.725 116.111 132.169 1.00 7.56 ? 477 ARG C NE 1 +ATOM 6863 C CZ . ARG C 3 477 ? 4.550 117.057 131.795 1.00 2.00 ? 477 ARG C CZ 1 +ATOM 6864 N NH1 . ARG C 3 477 ? 5.512 116.860 130.929 1.00 2.00 ? 477 ARG C NH1 1 +ATOM 6865 N NH2 . ARG C 3 477 ? 4.396 118.220 132.334 1.00 2.20 ? 477 ARG C NH2 1 +ATOM 6866 N N . PRO C 3 478 ? -1.137 113.896 130.875 1.00 16.77 ? 478 PRO C N 1 +ATOM 6867 C CA . PRO C 3 478 ? -2.101 114.273 129.834 1.00 17.78 ? 478 PRO C CA 1 +ATOM 6868 C C . PRO C 3 478 ? -1.388 114.584 128.542 1.00 19.02 ? 478 PRO C C 1 +ATOM 6869 O O . PRO C 3 478 ? -0.402 115.310 128.573 1.00 19.06 ? 478 PRO C O 1 +ATOM 6870 C CB . PRO C 3 478 ? -2.712 115.564 130.385 1.00 17.76 ? 478 PRO C CB 1 +ATOM 6871 C CG . PRO C 3 478 ? -2.533 115.484 131.843 1.00 16.96 ? 478 PRO C CG 1 +ATOM 6872 C CD . PRO C 3 478 ? -1.268 114.758 132.071 1.00 16.59 ? 478 PRO C CD 1 +ATOM 6873 N N . GLU C 3 479 ? -1.901 114.064 127.433 1.00 20.55 ? 479 GLU C N 1 +ATOM 6874 C CA . GLU C 3 479 ? -1.168 114.029 126.170 1.00 22.23 ? 479 GLU C CA 1 +ATOM 6875 C C . GLU C 3 479 ? -0.913 115.403 125.586 1.00 21.99 ? 479 GLU C C 1 +ATOM 6876 O O . GLU C 3 479 ? 0.173 115.661 125.087 1.00 22.62 ? 479 GLU C O 1 +ATOM 6877 C CB . GLU C 3 479 ? -1.877 113.121 125.146 1.00 23.04 ? 479 GLU C CB 1 +ATOM 6878 C CG . GLU C 3 479 ? -1.148 112.979 123.813 1.00 26.06 ? 479 GLU C CG 1 +ATOM 6879 C CD . GLU C 3 479 ? -1.990 113.418 122.608 1.00 30.36 ? 479 GLU C CD 1 +ATOM 6880 O OE1 . GLU C 3 479 ? -2.923 114.258 122.751 1.00 30.91 ? 479 GLU C OE1 1 +ATOM 6881 O OE2 . GLU C 3 479 ? -1.712 112.913 121.495 1.00 32.19 ? 479 GLU C OE2 1 +ATOM 6882 N N . ASP C 3 480 ? -1.901 116.287 125.637 1.00 22.32 ? 480 ASP C N 1 +ATOM 6883 C CA . ASP C 3 480 ? -1.682 117.665 125.166 1.00 22.34 ? 480 ASP C CA 1 +ATOM 6884 C C . ASP C 3 480 ? -0.532 118.347 125.923 1.00 21.88 ? 480 ASP C C 1 +ATOM 6885 O O . ASP C 3 480 ? 0.138 119.200 125.384 1.00 21.96 ? 480 ASP C O 1 +ATOM 6886 C CB . ASP C 3 480 ? -2.971 118.508 125.221 1.00 22.28 ? 480 ASP C CB 1 +ATOM 6887 C CG . ASP C 3 480 ? -3.775 118.290 126.505 1.00 23.55 ? 480 ASP C CG 1 +ATOM 6888 O OD1 . ASP C 3 480 ? -4.026 117.105 126.866 1.00 24.89 ? 480 ASP C OD1 1 +ATOM 6889 O OD2 . ASP C 3 480 ? -4.215 119.242 127.202 1.00 22.93 ? 480 ASP C OD2 1 +ATOM 6890 N N . GLU C 3 481 ? -0.315 117.937 127.168 1.00 22.06 ? 481 GLU C N 1 +ATOM 6891 C CA . GLU C 3 481 ? 0.704 118.490 128.059 1.00 22.06 ? 481 GLU C CA 1 +ATOM 6892 C C . GLU C 3 481 ? 2.072 118.016 127.657 1.00 22.51 ? 481 GLU C C 1 +ATOM 6893 O O . GLU C 3 481 ? 3.057 118.760 127.755 1.00 22.63 ? 481 GLU C O 1 +ATOM 6894 C CB . GLU C 3 481 ? 0.469 117.997 129.473 1.00 21.85 ? 481 GLU C CB 1 +ATOM 6895 C CG . GLU C 3 481 ? -0.386 118.897 130.314 1.00 22.22 ? 481 GLU C CG 1 +ATOM 6896 C CD . GLU C 3 481 ? 0.434 119.537 131.388 1.00 23.82 ? 481 GLU C CD 1 +ATOM 6897 O OE1 . GLU C 3 481 ? 1.033 118.772 132.183 1.00 24.09 ? 481 GLU C OE1 1 +ATOM 6898 O OE2 . GLU C 3 481 ? 0.505 120.791 131.407 1.00 24.25 ? 481 GLU C OE2 1 +ATOM 6899 N N . CYS C 3 482 ? 2.128 116.751 127.252 1.00 22.76 ? 482 CYS C N 1 +ATOM 6900 C CA . CYS C 3 482 ? 3.327 116.163 126.668 1.00 23.37 ? 482 CYS C CA 1 +ATOM 6901 C C . CYS C 3 482 ? 3.724 116.925 125.402 1.00 23.94 ? 482 CYS C C 1 +ATOM 6902 O O . CYS C 3 482 ? 4.880 117.357 125.279 1.00 23.82 ? 482 CYS C O 1 +ATOM 6903 C CB . CYS C 3 482 ? 3.112 114.670 126.395 1.00 22.83 ? 482 CYS C CB 1 +ATOM 6904 S SG . CYS C 3 482 ? 3.039 113.699 127.931 1.00 23.74 ? 482 CYS C SG 1 +ATOM 6905 N N . VAL C 3 483 ? 2.760 117.124 124.492 1.00 24.72 ? 483 VAL C N 1 +ATOM 6906 C CA . VAL C 3 483 ? 2.995 117.926 123.285 1.00 25.50 ? 483 VAL C CA 1 +ATOM 6907 C C . VAL C 3 483 ? 3.230 119.415 123.609 1.00 25.63 ? 483 VAL C C 1 +ATOM 6908 O O . VAL C 3 483 ? 4.033 120.079 122.944 1.00 25.92 ? 483 VAL C O 1 +ATOM 6909 C CB . VAL C 3 483 ? 1.909 117.699 122.156 1.00 25.86 ? 483 VAL C CB 1 +ATOM 6910 C CG1 . VAL C 3 483 ? 0.630 118.558 122.367 1.00 26.08 ? 483 VAL C CG1 1 +ATOM 6911 C CG2 . VAL C 3 483 ? 2.513 117.979 120.755 1.00 26.25 ? 483 VAL C CG2 1 +ATOM 6912 N N . GLY C 3 484 ? 2.561 119.922 124.644 1.00 25.68 ? 484 GLY C N 1 +ATOM 6913 C CA . GLY C 3 484 ? 2.716 121.307 125.076 1.00 26.03 ? 484 GLY C CA 1 +ATOM 6914 C C . GLY C 3 484 ? 4.122 121.620 125.563 1.00 26.08 ? 484 GLY C C 1 +ATOM 6915 O O . GLY C 3 484 ? 4.580 122.763 125.468 1.00 25.90 ? 484 GLY C O 1 +ATOM 6916 N N . GLU C 3 485 ? 4.797 120.594 126.087 1.00 26.19 ? 485 GLU C N 1 +ATOM 6917 C CA . GLU C 3 485 ? 6.204 120.691 126.456 1.00 26.34 ? 485 GLU C CA 1 +ATOM 6918 C C . GLU C 3 485 ? 7.088 120.282 125.265 1.00 25.93 ? 485 GLU C C 1 +ATOM 6919 O O . GLU C 3 485 ? 8.312 120.422 125.311 1.00 26.13 ? 485 GLU C O 1 +ATOM 6920 C CB . GLU C 3 485 ? 6.497 119.839 127.701 1.00 26.55 ? 485 GLU C CB 1 +ATOM 6921 C CG . GLU C 3 485 ? 7.745 120.253 128.493 1.00 27.37 ? 485 GLU C CG 1 +ATOM 6922 C CD . GLU C 3 485 ? 8.391 119.080 129.240 1.00 28.44 ? 485 GLU C CD 1 +ATOM 6923 O OE1 . GLU C 3 485 ? 7.771 118.564 130.211 1.00 28.78 ? 485 GLU C OE1 1 +ATOM 6924 O OE2 . GLU C 3 485 ? 9.514 118.659 128.859 1.00 27.32 ? 485 GLU C OE2 1 +ATOM 6925 N N . GLY C 3 486 ? 6.457 119.793 124.197 1.00 25.26 ? 486 GLY C N 1 +ATOM 6926 C CA . GLY C 3 486 ? 7.161 119.391 122.986 1.00 24.22 ? 486 GLY C CA 1 +ATOM 6927 C C . GLY C 3 486 ? 7.812 118.018 123.067 1.00 23.39 ? 486 GLY C C 1 +ATOM 6928 O O . GLY C 3 486 ? 8.949 117.847 122.605 1.00 23.44 ? 486 GLY C O 1 +ATOM 6929 N N . LEU C 3 487 ? 7.090 117.046 123.640 1.00 22.43 ? 487 LEU C N 1 +ATOM 6930 C CA . LEU C 3 487 ? 7.593 115.679 123.848 1.00 21.08 ? 487 LEU C CA 1 +ATOM 6931 C C . LEU C 3 487 ? 6.949 114.624 122.937 1.00 21.03 ? 487 LEU C C 1 +ATOM 6932 O O . LEU C 3 487 ? 6.247 113.735 123.418 1.00 21.15 ? 487 LEU C O 1 +ATOM 6933 C CB . LEU C 3 487 ? 7.412 115.255 125.312 1.00 20.58 ? 487 LEU C CB 1 +ATOM 6934 C CG . LEU C 3 487 ? 8.389 115.644 126.425 1.00 19.19 ? 487 LEU C CG 1 +ATOM 6935 C CD1 . LEU C 3 487 ? 8.172 114.765 127.641 1.00 18.37 ? 487 LEU C CD1 1 +ATOM 6936 C CD2 . LEU C 3 487 ? 9.827 115.549 125.983 1.00 18.91 ? 487 LEU C CD2 1 +ATOM 6937 N N . ALA C 3 488 ? 7.207 114.714 121.630 1.00 20.88 ? 488 ALA C N 1 +ATOM 6938 C CA . ALA C 3 488 ? 6.785 113.687 120.651 1.00 20.74 ? 488 ALA C CA 1 +ATOM 6939 C C . ALA C 3 488 ? 7.857 112.602 120.346 1.00 20.11 ? 488 ALA C C 1 +ATOM 6940 O O . ALA C 3 488 ? 8.946 112.592 120.924 1.00 19.57 ? 488 ALA C O 1 +ATOM 6941 C CB . ALA C 3 488 ? 6.352 114.369 119.341 1.00 21.15 ? 488 ALA C CB 1 +ATOM 6942 N N . CYS C 3 489 ? 7.539 111.698 119.427 1.00 19.32 ? 489 CYS C N 1 +ATOM 6943 C CA . CYS C 3 489 ? 8.558 110.831 118.866 1.00 19.35 ? 489 CYS C CA 1 +ATOM 6944 C C . CYS C 3 489 ? 9.493 111.614 117.990 1.00 19.16 ? 489 CYS C C 1 +ATOM 6945 O O . CYS C 3 489 ? 9.106 112.635 117.438 1.00 19.16 ? 489 CYS C O 1 +ATOM 6946 C CB . CYS C 3 489 ? 7.951 109.725 118.039 1.00 18.43 ? 489 CYS C CB 1 +ATOM 6947 S SG . CYS C 3 489 ? 7.217 108.529 119.126 1.00 21.30 ? 489 CYS C SG 1 +ATOM 6948 N N . HIS C 3 490 ? 10.716 111.108 117.859 1.00 19.35 ? 490 HIS C N 1 +ATOM 6949 C CA . HIS C 3 490 ? 11.700 111.670 116.960 1.00 19.89 ? 490 HIS C CA 1 +ATOM 6950 C C . HIS C 3 490 ? 11.206 111.591 115.518 1.00 19.71 ? 490 HIS C C 1 +ATOM 6951 O O . HIS C 3 490 ? 10.343 110.785 115.218 1.00 19.64 ? 490 HIS C O 1 +ATOM 6952 C CB . HIS C 3 490 ? 13.027 110.929 117.129 1.00 19.86 ? 490 HIS C CB 1 +ATOM 6953 C CG . HIS C 3 490 ? 14.205 111.708 116.641 1.00 21.36 ? 490 HIS C CG 1 +ATOM 6954 N ND1 . HIS C 3 490 ? 14.812 111.459 115.428 1.00 22.27 ? 490 HIS C ND1 1 +ATOM 6955 C CD2 . HIS C 3 490 ? 14.864 112.758 117.184 1.00 21.54 ? 490 HIS C CD2 1 +ATOM 6956 C CE1 . HIS C 3 490 ? 15.809 112.307 115.257 1.00 22.42 ? 490 HIS C CE1 1 +ATOM 6957 N NE2 . HIS C 3 490 ? 15.860 113.108 116.304 1.00 22.55 ? 490 HIS C NE2 1 +ATOM 6958 N N . GLN C 3 491 ? 11.745 112.447 114.648 1.00 20.57 ? 491 GLN C N 1 +ATOM 6959 C CA . GLN C 3 491 ? 11.483 112.423 113.193 1.00 21.15 ? 491 GLN C CA 1 +ATOM 6960 C C . GLN C 3 491 ? 11.728 111.053 112.577 1.00 20.24 ? 491 GLN C C 1 +ATOM 6961 O O . GLN C 3 491 ? 10.897 110.526 111.830 1.00 20.08 ? 491 GLN C O 1 +ATOM 6962 C CB . GLN C 3 491 ? 12.423 113.396 112.446 1.00 21.97 ? 491 GLN C CB 1 +ATOM 6963 C CG . GLN C 3 491 ? 12.109 114.885 112.563 1.00 26.32 ? 491 GLN C CG 1 +ATOM 6964 C CD . GLN C 3 491 ? 10.711 115.266 112.068 1.00 31.86 ? 491 GLN C CD 1 +ATOM 6965 O OE1 . GLN C 3 491 ? 9.772 114.451 112.125 1.00 35.26 ? 491 GLN C OE1 1 +ATOM 6966 N NE2 . GLN C 3 491 ? 10.565 116.513 111.603 1.00 32.62 ? 491 GLN C NE2 1 +ATOM 6967 N N . LEU C 3 492 ? 12.904 110.514 112.877 1.00 19.08 ? 492 LEU C N 1 +ATOM 6968 C CA . LEU C 3 492 ? 13.407 109.292 112.263 1.00 18.70 ? 492 LEU C CA 1 +ATOM 6969 C C . LEU C 3 492 ? 12.622 108.018 112.603 1.00 18.15 ? 492 LEU C C 1 +ATOM 6970 O O . LEU C 3 492 ? 12.972 106.943 112.142 1.00 17.69 ? 492 LEU C O 1 +ATOM 6971 C CB . LEU C 3 492 ? 14.876 109.109 112.664 1.00 18.53 ? 492 LEU C CB 1 +ATOM 6972 C CG . LEU C 3 492 ? 15.941 109.628 111.693 1.00 19.88 ? 492 LEU C CG 1 +ATOM 6973 C CD1 . LEU C 3 492 ? 15.340 110.010 110.331 1.00 18.28 ? 492 LEU C CD1 1 +ATOM 6974 C CD2 . LEU C 3 492 ? 16.735 110.799 112.309 1.00 18.95 ? 492 LEU C CD2 1 +ATOM 6975 N N . CYS C 3 493 ? 11.579 108.133 113.419 1.00 17.44 ? 493 CYS C N 1 +ATOM 6976 C CA . CYS C 3 493 ? 10.809 106.968 113.823 1.00 17.37 ? 493 CYS C CA 1 +ATOM 6977 C C . CYS C 3 493 ? 9.684 106.671 112.837 1.00 16.91 ? 493 CYS C C 1 +ATOM 6978 O O . CYS C 3 493 ? 8.837 107.528 112.607 1.00 17.44 ? 493 CYS C O 1 +ATOM 6979 C CB . CYS C 3 493 ? 10.213 107.209 115.213 1.00 17.64 ? 493 CYS C CB 1 +ATOM 6980 S SG . CYS C 3 493 ? 11.377 107.238 116.614 1.00 18.52 ? 493 CYS C SG 1 +ATOM 6981 N N . ALA C 3 494 ? 9.642 105.465 112.277 1.00 15.99 ? 494 ALA C N 1 +ATOM 6982 C CA . ALA C 3 494 ? 8.537 105.099 111.385 1.00 15.54 ? 494 ALA C CA 1 +ATOM 6983 C C . ALA C 3 494 ? 7.174 105.267 112.051 1.00 15.42 ? 494 ALA C C 1 +ATOM 6984 O O . ALA C 3 494 ? 6.991 104.853 113.202 1.00 16.12 ? 494 ALA C O 1 +ATOM 6985 C CB . ALA C 3 494 ? 8.702 103.686 110.886 1.00 15.38 ? 494 ALA C CB 1 +ATOM 6986 N N . ARG C 3 495 ? 6.234 105.895 111.340 1.00 14.83 ? 495 ARG C N 1 +ATOM 6987 C CA . ARG C 3 495 ? 4.811 105.960 111.747 1.00 14.14 ? 495 ARG C CA 1 +ATOM 6988 C C . ARG C 3 495 ? 4.512 106.617 113.105 1.00 12.85 ? 495 ARG C C 1 +ATOM 6989 O O . ARG C 3 495 ? 3.489 106.328 113.732 1.00 13.04 ? 495 ARG C O 1 +ATOM 6990 C CB . ARG C 3 495 ? 4.175 104.557 111.701 1.00 14.80 ? 495 ARG C CB 1 +ATOM 6991 C CG . ARG C 3 495 ? 4.483 103.737 110.440 1.00 17.56 ? 495 ARG C CG 1 +ATOM 6992 C CD . ARG C 3 495 ? 3.323 103.639 109.465 1.00 23.45 ? 495 ARG C CD 1 +ATOM 6993 N NE . ARG C 3 495 ? 3.765 103.684 108.063 1.00 27.39 ? 495 ARG C NE 1 +ATOM 6994 C CZ . ARG C 3 495 ? 2.978 103.998 107.024 1.00 28.44 ? 495 ARG C CZ 1 +ATOM 6995 N NH1 . ARG C 3 495 ? 1.692 104.311 107.208 1.00 26.65 ? 495 ARG C NH1 1 +ATOM 6996 N NH2 . ARG C 3 495 ? 3.486 104.000 105.793 1.00 28.64 ? 495 ARG C NH2 1 +ATOM 6997 N N . GLY C 3 496 ? 5.397 107.495 113.562 1.00 11.76 ? 496 GLY C N 1 +ATOM 6998 C CA . GLY C 3 496 ? 5.254 108.149 114.861 1.00 10.24 ? 496 GLY C CA 1 +ATOM 6999 C C . GLY C 3 496 ? 5.176 107.249 116.100 1.00 9.39 ? 496 GLY C C 1 +ATOM 7000 O O . GLY C 3 496 ? 4.539 107.600 117.071 1.00 9.68 ? 496 GLY C O 1 +ATOM 7001 N N . HIS C 3 497 ? 5.825 106.093 116.081 1.00 8.43 ? 497 HIS C N 1 +ATOM 7002 C CA . HIS C 3 497 ? 5.675 105.115 117.153 1.00 7.53 ? 497 HIS C CA 1 +ATOM 7003 C C . HIS C 3 497 ? 6.961 104.998 117.934 1.00 6.64 ? 497 HIS C C 1 +ATOM 7004 O O . HIS C 3 497 ? 7.983 104.645 117.353 1.00 6.63 ? 497 HIS C O 1 +ATOM 7005 C CB . HIS C 3 497 ? 5.367 103.749 116.546 1.00 7.66 ? 497 HIS C CB 1 +ATOM 7006 C CG . HIS C 3 497 ? 3.998 103.636 115.944 1.00 9.20 ? 497 HIS C CG 1 +ATOM 7007 N ND1 . HIS C 3 497 ? 2.876 104.210 116.513 1.00 9.50 ? 497 HIS C ND1 1 +ATOM 7008 C CD2 . HIS C 3 497 ? 3.570 102.995 114.831 1.00 9.09 ? 497 HIS C CD2 1 +ATOM 7009 C CE1 . HIS C 3 497 ? 1.818 103.926 115.779 1.00 9.39 ? 497 HIS C CE1 1 +ATOM 7010 N NE2 . HIS C 3 497 ? 2.213 103.195 114.751 1.00 10.80 ? 497 HIS C NE2 1 +ATOM 7011 N N . CYS C 3 498 ? 6.935 105.263 119.238 1.00 5.56 ? 498 CYS C N 1 +ATOM 7012 C CA . CYS C 3 498 ? 8.148 105.091 120.041 1.00 5.40 ? 498 CYS C CA 1 +ATOM 7013 C C . CYS C 3 498 ? 7.956 104.812 121.521 1.00 3.92 ? 498 CYS C C 1 +ATOM 7014 O O . CYS C 3 498 ? 6.887 104.984 122.054 1.00 3.51 ? 498 CYS C O 1 +ATOM 7015 C CB . CYS C 3 498 ? 9.085 106.286 119.880 1.00 6.25 ? 498 CYS C CB 1 +ATOM 7016 S SG . CYS C 3 498 ? 8.411 107.779 120.596 1.00 10.19 ? 498 CYS C SG 1 +ATOM 7017 N N . TRP C 3 499 ? 9.030 104.416 122.186 1.00 3.31 ? 499 TRP C N 1 +ATOM 7018 C CA . TRP C 3 499 ? 8.957 104.064 123.576 1.00 2.72 ? 499 TRP C CA 1 +ATOM 7019 C C . TRP C 3 499 ? 9.400 105.142 124.533 1.00 3.28 ? 499 TRP C C 1 +ATOM 7020 O O . TRP C 3 499 ? 9.371 104.932 125.754 1.00 2.89 ? 499 TRP C O 1 +ATOM 7021 C CB . TRP C 3 499 ? 9.763 102.819 123.816 1.00 3.21 ? 499 TRP C CB 1 +ATOM 7022 C CG . TRP C 3 499 ? 9.189 101.631 123.206 1.00 2.00 ? 499 TRP C CG 1 +ATOM 7023 C CD1 . TRP C 3 499 ? 9.475 101.136 121.983 1.00 2.00 ? 499 TRP C CD1 1 +ATOM 7024 C CD2 . TRP C 3 499 ? 8.223 100.758 123.785 1.00 2.00 ? 499 TRP C CD2 1 +ATOM 7025 N NE1 . TRP C 3 499 ? 8.744 99.995 121.755 1.00 2.27 ? 499 TRP C NE1 1 +ATOM 7026 C CE2 . TRP C 3 499 ? 7.956 99.750 122.847 1.00 2.00 ? 499 TRP C CE2 1 +ATOM 7027 C CE3 . TRP C 3 499 ? 7.537 100.732 125.003 1.00 3.01 ? 499 TRP C CE3 1 +ATOM 7028 C CZ2 . TRP C 3 499 ? 7.060 98.727 123.090 1.00 2.00 ? 499 TRP C CZ2 1 +ATOM 7029 C CZ3 . TRP C 3 499 ? 6.641 99.709 125.242 1.00 2.00 ? 499 TRP C CZ3 1 +ATOM 7030 C CH2 . TRP C 3 499 ? 6.417 98.725 124.295 1.00 2.00 ? 499 TRP C CH2 1 +ATOM 7031 N N . GLY C 3 500 ? 9.745 106.315 123.995 1.00 4.17 ? 500 GLY C N 1 +ATOM 7032 C CA . GLY C 3 500 ? 10.332 107.409 124.768 1.00 5.30 ? 500 GLY C CA 1 +ATOM 7033 C C . GLY C 3 500 ? 10.962 108.421 123.818 1.00 6.24 ? 500 GLY C C 1 +ATOM 7034 O O . GLY C 3 500 ? 10.836 108.231 122.627 1.00 6.76 ? 500 GLY C O 1 +ATOM 7035 N N . PRO C 3 501 ? 11.612 109.483 124.311 1.00 6.83 ? 501 PRO C N 1 +ATOM 7036 C CA . PRO C 3 501 ? 12.151 110.545 123.447 1.00 7.04 ? 501 PRO C CA 1 +ATOM 7037 C C . PRO C 3 501 ? 13.401 110.157 122.663 1.00 7.93 ? 501 PRO C C 1 +ATOM 7038 O O . PRO C 3 501 ? 14.174 109.304 123.092 1.00 8.72 ? 501 PRO C O 1 +ATOM 7039 C CB . PRO C 3 501 ? 12.507 111.632 124.438 1.00 7.06 ? 501 PRO C CB 1 +ATOM 7040 C CG . PRO C 3 501 ? 12.774 110.929 125.734 1.00 6.78 ? 501 PRO C CG 1 +ATOM 7041 C CD . PRO C 3 501 ? 11.869 109.756 125.739 1.00 7.17 ? 501 PRO C CD 1 +ATOM 7042 N N . GLY C 3 502 ? 13.593 110.738 121.493 1.00 8.00 ? 502 GLY C N 1 +ATOM 7043 C CA . GLY C 3 502 ? 14.887 110.614 120.856 1.00 8.97 ? 502 GLY C CA 1 +ATOM 7044 C C . GLY C 3 502 ? 15.157 109.433 119.941 1.00 10.07 ? 502 GLY C C 1 +ATOM 7045 O O . GLY C 3 502 ? 14.414 108.437 119.892 1.00 10.27 ? 502 GLY C O 1 +ATOM 7046 N N . PRO C 3 503 ? 16.256 109.539 119.206 1.00 10.48 ? 503 PRO C N 1 +ATOM 7047 C CA . PRO C 3 503 ? 16.505 108.627 118.086 1.00 10.79 ? 503 PRO C CA 1 +ATOM 7048 C C . PRO C 3 503 ? 16.877 107.206 118.471 1.00 11.08 ? 503 PRO C C 1 +ATOM 7049 O O . PRO C 3 503 ? 17.161 106.449 117.564 1.00 11.61 ? 503 PRO C O 1 +ATOM 7050 C CB . PRO C 3 503 ? 17.655 109.313 117.350 1.00 10.79 ? 503 PRO C CB 1 +ATOM 7051 C CG . PRO C 3 503 ? 18.421 110.026 118.479 1.00 11.35 ? 503 PRO C CG 1 +ATOM 7052 C CD . PRO C 3 503 ? 17.325 110.557 119.360 1.00 10.11 ? 503 PRO C CD 1 +ATOM 7053 N N . THR C 3 504 ? 16.891 106.851 119.757 1.00 11.92 ? 504 THR C N 1 +ATOM 7054 C CA . THR C 3 504 ? 17.205 105.474 120.206 1.00 12.34 ? 504 THR C CA 1 +ATOM 7055 C C . THR C 3 504 ? 15.977 104.719 120.662 1.00 12.58 ? 504 THR C C 1 +ATOM 7056 O O . THR C 3 504 ? 16.079 103.535 120.996 1.00 13.58 ? 504 THR C O 1 +ATOM 7057 C CB . THR C 3 504 ? 18.149 105.459 121.430 1.00 12.92 ? 504 THR C CB 1 +ATOM 7058 O OG1 . THR C 3 504 ? 17.492 106.109 122.537 1.00 14.13 ? 504 THR C OG1 1 +ATOM 7059 C CG2 . THR C 3 504 ? 19.466 106.285 121.185 1.00 12.73 ? 504 THR C CG2 1 +ATOM 7060 N N . GLN C 3 505 ? 14.830 105.398 120.708 1.00 12.18 ? 505 GLN C N 1 +ATOM 7061 C CA . GLN C 3 505 ? 13.595 104.830 121.248 1.00 11.63 ? 505 GLN C CA 1 +ATOM 7062 C C . GLN C 3 505 ? 12.520 104.467 120.230 1.00 11.98 ? 505 GLN C C 1 +ATOM 7063 O O . GLN C 3 505 ? 11.402 104.126 120.641 1.00 12.39 ? 505 GLN C O 1 +ATOM 7064 C CB . GLN C 3 505 ? 12.956 105.787 122.256 1.00 11.10 ? 505 GLN C CB 1 +ATOM 7065 C CG . GLN C 3 505 ? 13.822 106.132 123.389 1.00 9.61 ? 505 GLN C CG 1 +ATOM 7066 C CD . GLN C 3 505 ? 14.035 104.999 124.349 1.00 9.29 ? 505 GLN C CD 1 +ATOM 7067 O OE1 . GLN C 3 505 ? 13.212 104.082 124.463 1.00 11.01 ? 505 GLN C OE1 1 +ATOM 7068 N NE2 . GLN C 3 505 ? 15.141 105.057 125.056 1.00 9.79 ? 505 GLN C NE2 1 +ATOM 7069 N N . CYS C 3 506 ? 12.823 104.568 118.937 1.00 11.70 ? 506 CYS C N 1 +ATOM 7070 C CA . CYS C 3 506 ? 11.866 104.229 117.897 1.00 12.75 ? 506 CYS C CA 1 +ATOM 7071 C C . CYS C 3 506 ? 11.411 102.802 117.986 1.00 13.70 ? 506 CYS C C 1 +ATOM 7072 O O . CYS C 3 506 ? 12.183 101.934 118.415 1.00 14.30 ? 506 CYS C O 1 +ATOM 7073 C CB . CYS C 3 506 ? 12.513 104.391 116.547 1.00 12.68 ? 506 CYS C CB 1 +ATOM 7074 S SG . CYS C 3 506 ? 13.033 106.056 116.379 1.00 13.41 ? 506 CYS C SG 1 +ATOM 7075 N N . VAL C 3 507 ? 10.178 102.545 117.555 1.00 14.36 ? 507 VAL C N 1 +ATOM 7076 C CA . VAL C 3 507 ? 9.706 101.176 117.456 1.00 15.53 ? 507 VAL C CA 1 +ATOM 7077 C C . VAL C 3 507 ? 10.443 100.538 116.288 1.00 17.24 ? 507 VAL C C 1 +ATOM 7078 O O . VAL C 3 507 ? 11.305 99.689 116.482 1.00 17.07 ? 507 VAL C O 1 +ATOM 7079 C CB . VAL C 3 507 ? 8.196 101.137 117.269 1.00 14.97 ? 507 VAL C CB 1 +ATOM 7080 C CG1 . VAL C 3 507 ? 7.728 99.759 116.789 1.00 13.42 ? 507 VAL C CG1 1 +ATOM 7081 C CG2 . VAL C 3 507 ? 7.539 101.527 118.568 1.00 14.46 ? 507 VAL C CG2 1 +ATOM 7082 N N . ASN C 3 508 ? 10.100 100.974 115.078 1.00 19.44 ? 508 ASN C N 1 +ATOM 7083 C CA . ASN C 3 508 ? 10.867 100.673 113.879 1.00 21.04 ? 508 ASN C CA 1 +ATOM 7084 C C . ASN C 3 508 ? 11.535 101.970 113.411 1.00 20.89 ? 508 ASN C C 1 +ATOM 7085 O O . ASN C 3 508 ? 10.914 103.036 113.343 1.00 21.35 ? 508 ASN C O 1 +ATOM 7086 C CB . ASN C 3 508 ? 9.969 100.062 112.792 1.00 21.95 ? 508 ASN C CB 1 +ATOM 7087 C CG . ASN C 3 508 ? 9.925 98.508 112.859 1.00 26.08 ? 508 ASN C CG 1 +ATOM 7088 O OD1 . ASN C 3 508 ? 10.931 97.825 112.581 1.00 27.39 ? 508 ASN C OD1 1 +ATOM 7089 N ND2 . ASN C 3 508 ? 8.757 97.953 113.239 1.00 28.91 ? 508 ASN C ND2 1 +ATOM 7090 N N . CYS C 3 509 ? 12.827 101.883 113.148 1.00 20.67 ? 509 CYS C N 1 +ATOM 7091 C CA . CYS C 3 509 ? 13.586 102.993 112.593 1.00 19.82 ? 509 CYS C CA 1 +ATOM 7092 C C . CYS C 3 509 ? 13.159 103.197 111.140 1.00 18.21 ? 509 CYS C C 1 +ATOM 7093 O O . CYS C 3 509 ? 12.898 102.242 110.413 1.00 17.46 ? 509 CYS C O 1 +ATOM 7094 C CB . CYS C 3 509 ? 15.053 102.653 112.700 1.00 20.46 ? 509 CYS C CB 1 +ATOM 7095 S SG . CYS C 3 509 ? 16.133 103.803 111.905 1.00 25.41 ? 509 CYS C SG 1 +ATOM 7096 N N . SER C 3 510 ? 13.035 104.450 110.729 1.00 16.60 ? 510 SER C N 1 +ATOM 7097 C CA . SER C 3 510 ? 12.416 104.740 109.443 1.00 15.23 ? 510 SER C CA 1 +ATOM 7098 C C . SER C 3 510 ? 13.460 104.796 108.378 1.00 13.99 ? 510 SER C C 1 +ATOM 7099 O O . SER C 3 510 ? 13.166 104.636 107.225 1.00 13.72 ? 510 SER C O 1 +ATOM 7100 C CB . SER C 3 510 ? 11.624 106.043 109.477 1.00 14.91 ? 510 SER C CB 1 +ATOM 7101 O OG . SER C 3 510 ? 12.507 107.141 109.475 1.00 16.70 ? 510 SER C OG 1 +ATOM 7102 N N . GLN C 3 511 ? 14.691 105.023 108.788 1.00 13.79 ? 511 GLN C N 1 +ATOM 7103 C CA . GLN C 3 511 ? 15.820 105.057 107.875 1.00 13.94 ? 511 GLN C CA 1 +ATOM 7104 C C . GLN C 3 511 ? 16.817 103.957 108.206 1.00 13.25 ? 511 GLN C C 1 +ATOM 7105 O O . GLN C 3 511 ? 16.569 102.781 107.914 1.00 14.07 ? 511 GLN C O 1 +ATOM 7106 C CB . GLN C 3 511 ? 16.496 106.414 107.961 1.00 14.12 ? 511 GLN C CB 1 +ATOM 7107 C CG . GLN C 3 511 ? 15.525 107.531 107.764 1.00 17.02 ? 511 GLN C CG 1 +ATOM 7108 C CD . GLN C 3 511 ? 15.196 107.747 106.301 1.00 18.71 ? 511 GLN C CD 1 +ATOM 7109 O OE1 . GLN C 3 511 ? 15.976 107.378 105.415 1.00 19.07 ? 511 GLN C OE1 1 +ATOM 7110 N NE2 . GLN C 3 511 ? 14.052 108.349 106.048 1.00 17.24 ? 511 GLN C NE2 1 +ATOM 7111 N N . PHE C 3 512 ? 17.923 104.335 108.837 1.00 12.51 ? 512 PHE C N 1 +ATOM 7112 C CA . PHE C 3 512 ? 18.997 103.420 109.115 1.00 12.44 ? 512 PHE C CA 1 +ATOM 7113 C C . PHE C 3 512 ? 19.374 103.468 110.571 1.00 13.17 ? 512 PHE C C 1 +ATOM 7114 O O . PHE C 3 512 ? 19.083 104.451 111.266 1.00 14.24 ? 512 PHE C O 1 +ATOM 7115 C CB . PHE C 3 512 ? 20.172 103.724 108.216 1.00 12.28 ? 512 PHE C CB 1 +ATOM 7116 C CG . PHE C 3 512 ? 19.835 103.674 106.752 1.00 12.92 ? 512 PHE C CG 1 +ATOM 7117 C CD1 . PHE C 3 512 ? 19.401 104.816 106.081 1.00 13.04 ? 512 PHE C CD1 1 +ATOM 7118 C CD2 . PHE C 3 512 ? 19.960 102.488 106.034 1.00 13.40 ? 512 PHE C CD2 1 +ATOM 7119 C CE1 . PHE C 3 512 ? 19.093 104.780 104.719 1.00 12.34 ? 512 PHE C CE1 1 +ATOM 7120 C CE2 . PHE C 3 512 ? 19.638 102.435 104.662 1.00 13.27 ? 512 PHE C CE2 1 +ATOM 7121 C CZ . PHE C 3 512 ? 19.201 103.581 104.009 1.00 12.08 ? 512 PHE C CZ 1 +ATOM 7122 N N . LEU C 3 513 ? 19.978 102.397 111.055 1.00 13.31 ? 513 LEU C N 1 +ATOM 7123 C CA . LEU C 3 513 ? 20.389 102.348 112.432 1.00 14.58 ? 513 LEU C CA 1 +ATOM 7124 C C . LEU C 3 513 ? 21.875 102.241 112.471 1.00 15.08 ? 513 LEU C C 1 +ATOM 7125 O O . LEU C 3 513 ? 22.457 101.433 111.780 1.00 16.18 ? 513 LEU C O 1 +ATOM 7126 C CB . LEU C 3 513 ? 19.819 101.135 113.134 1.00 15.43 ? 513 LEU C CB 1 +ATOM 7127 C CG . LEU C 3 513 ? 18.388 101.172 113.680 1.00 17.49 ? 513 LEU C CG 1 +ATOM 7128 C CD1 . LEU C 3 513 ? 17.722 99.805 113.465 1.00 15.58 ? 513 LEU C CD1 1 +ATOM 7129 C CD2 . LEU C 3 513 ? 18.286 101.639 115.153 1.00 16.22 ? 513 LEU C CD2 1 +ATOM 7130 N N . ARG C 3 514 ? 22.497 103.095 113.247 1.00 15.86 ? 514 ARG C N 1 +ATOM 7131 C CA . ARG C 3 514 ? 23.869 102.895 113.567 1.00 16.70 ? 514 ARG C CA 1 +ATOM 7132 C C . ARG C 3 514 ? 23.879 102.594 115.062 1.00 17.44 ? 514 ARG C C 1 +ATOM 7133 O O . ARG C 3 514 ? 23.429 103.411 115.878 1.00 16.88 ? 514 ARG C O 1 +ATOM 7134 C CB . ARG C 3 514 ? 24.725 104.102 113.212 1.00 16.06 ? 514 ARG C CB 1 +ATOM 7135 C CG . ARG C 3 514 ? 26.203 103.894 113.533 1.00 15.00 ? 514 ARG C CG 1 +ATOM 7136 C CD . ARG C 3 514 ? 27.102 104.724 112.661 1.00 15.81 ? 514 ARG C CD 1 +ATOM 7137 N NE . ARG C 3 514 ? 26.587 106.077 112.672 1.00 19.22 ? 514 ARG C NE 1 +ATOM 7138 C CZ . ARG C 3 514 ? 26.224 106.766 111.618 1.00 17.82 ? 514 ARG C CZ 1 +ATOM 7139 N NH1 . ARG C 3 514 ? 26.364 106.263 110.397 1.00 16.48 ? 514 ARG C NH1 1 +ATOM 7140 N NH2 . ARG C 3 514 ? 25.748 107.991 111.801 1.00 17.80 ? 514 ARG C NH2 1 +ATOM 7141 N N . GLY C 3 515 ? 24.360 101.401 115.402 1.00 17.97 ? 515 GLY C N 1 +ATOM 7142 C CA . GLY C 3 515 ? 24.231 100.916 116.755 1.00 19.69 ? 515 GLY C CA 1 +ATOM 7143 C C . GLY C 3 515 ? 22.744 100.863 117.064 1.00 21.31 ? 515 GLY C C 1 +ATOM 7144 O O . GLY C 3 515 ? 21.987 100.145 116.382 1.00 21.61 ? 515 GLY C O 1 +ATOM 7145 N N . GLN C 3 516 ? 22.325 101.649 118.059 1.00 21.75 ? 516 GLN C N 1 +ATOM 7146 C CA . GLN C 3 516 ? 20.915 101.748 118.450 1.00 22.41 ? 516 GLN C CA 1 +ATOM 7147 C C . GLN C 3 516 ? 20.384 103.185 118.228 1.00 22.06 ? 516 GLN C C 1 +ATOM 7148 O O . GLN C 3 516 ? 19.409 103.628 118.847 1.00 21.78 ? 516 GLN C O 1 +ATOM 7149 C CB . GLN C 3 516 ? 20.749 101.355 119.915 1.00 22.52 ? 516 GLN C CB 1 +ATOM 7150 C CG . GLN C 3 516 ? 21.483 100.100 120.300 1.00 25.81 ? 516 GLN C CG 1 +ATOM 7151 C CD . GLN C 3 516 ? 20.732 98.853 119.877 1.00 30.23 ? 516 GLN C CD 1 +ATOM 7152 O OE1 . GLN C 3 516 ? 19.559 98.677 120.241 1.00 31.76 ? 516 GLN C OE1 1 +ATOM 7153 N NE2 . GLN C 3 516 ? 21.397 97.984 119.108 1.00 29.60 ? 516 GLN C NE2 1 +ATOM 7154 N N . GLU C 3 517 ? 21.039 103.925 117.358 1.00 21.29 ? 517 GLU C N 1 +ATOM 7155 C CA . GLU C 3 517 ? 20.587 105.266 117.104 1.00 21.26 ? 517 GLU C CA 1 +ATOM 7156 C C . GLU C 3 517 ? 20.018 105.221 115.720 1.00 21.16 ? 517 GLU C C 1 +ATOM 7157 O O . GLU C 3 517 ? 20.683 104.769 114.766 1.00 20.44 ? 517 GLU C O 1 +ATOM 7158 C CB . GLU C 3 517 ? 21.748 106.231 117.184 1.00 21.19 ? 517 GLU C CB 1 +ATOM 7159 C CG . GLU C 3 517 ? 21.367 107.577 117.742 1.00 23.73 ? 517 GLU C CG 1 +ATOM 7160 C CD . GLU C 3 517 ? 22.145 108.717 117.095 1.00 25.56 ? 517 GLU C CD 1 +ATOM 7161 O OE1 . GLU C 3 517 ? 21.538 109.549 116.371 1.00 23.16 ? 517 GLU C OE1 1 +ATOM 7162 O OE2 . GLU C 3 517 ? 23.377 108.768 117.321 1.00 29.26 ? 517 GLU C OE2 1 +ATOM 7163 N N . CYS C 3 518 ? 18.767 105.633 115.613 1.00 21.01 ? 518 CYS C N 1 +ATOM 7164 C CA . CYS C 3 518 ? 18.140 105.685 114.327 1.00 22.17 ? 518 CYS C CA 1 +ATOM 7165 C C . CYS C 3 518 ? 18.674 106.927 113.633 1.00 21.55 ? 518 CYS C C 1 +ATOM 7166 O O . CYS C 3 518 ? 18.646 108.001 114.214 1.00 21.30 ? 518 CYS C O 1 +ATOM 7167 C CB . CYS C 3 518 ? 16.629 105.699 114.459 1.00 22.65 ? 518 CYS C CB 1 +ATOM 7168 S SG . CYS C 3 518 ? 15.855 105.618 112.809 1.00 30.40 ? 518 CYS C SG 1 +ATOM 7169 N N . VAL C 3 519 ? 19.226 106.764 112.425 1.00 21.09 ? 519 VAL C N 1 +ATOM 7170 C CA . VAL C 3 519 ? 19.902 107.863 111.738 1.00 20.27 ? 519 VAL C CA 1 +ATOM 7171 C C . VAL C 3 519 ? 19.396 108.128 110.336 1.00 20.95 ? 519 VAL C C 1 +ATOM 7172 O O . VAL C 3 519 ? 18.700 107.317 109.747 1.00 20.93 ? 519 VAL C O 1 +ATOM 7173 C CB . VAL C 3 519 ? 21.417 107.702 111.696 1.00 19.92 ? 519 VAL C CB 1 +ATOM 7174 C CG1 . VAL C 3 519 ? 21.992 107.691 113.122 1.00 19.51 ? 519 VAL C CG1 1 +ATOM 7175 C CG2 . VAL C 3 519 ? 21.810 106.462 110.893 1.00 20.27 ? 519 VAL C CG2 1 +ATOM 7176 N N . GLU C 3 520 ? 19.767 109.278 109.805 1.00 21.93 ? 520 GLU C N 1 +ATOM 7177 C CA . GLU C 3 520 ? 19.235 109.746 108.547 1.00 22.94 ? 520 GLU C CA 1 +ATOM 7178 C C . GLU C 3 520 ? 19.890 109.021 107.389 1.00 22.95 ? 520 GLU C C 1 +ATOM 7179 O O . GLU C 3 520 ? 19.189 108.558 106.511 1.00 23.66 ? 520 GLU C O 1 +ATOM 7180 C CB . GLU C 3 520 ? 19.389 111.260 108.431 1.00 23.09 ? 520 GLU C CB 1 +ATOM 7181 C CG . GLU C 3 520 ? 18.849 111.867 107.147 1.00 26.34 ? 520 GLU C CG 1 +ATOM 7182 C CD . GLU C 3 520 ? 17.372 111.587 106.937 1.00 30.07 ? 520 GLU C CD 1 +ATOM 7183 O OE1 . GLU C 3 520 ? 16.644 111.445 107.939 1.00 31.75 ? 520 GLU C OE1 1 +ATOM 7184 O OE2 . GLU C 3 520 ? 16.933 111.516 105.766 1.00 31.58 ? 520 GLU C OE2 1 +ATOM 7185 N N . GLU C 3 521 ? 21.216 108.917 107.389 1.00 22.93 ? 521 GLU C N 1 +ATOM 7186 C CA . GLU C 3 521 ? 21.933 108.218 106.337 1.00 23.43 ? 521 GLU C CA 1 +ATOM 7187 C C . GLU C 3 521 ? 23.132 107.558 106.979 1.00 23.08 ? 521 GLU C C 1 +ATOM 7188 O O . GLU C 3 521 ? 23.674 108.079 107.949 1.00 23.50 ? 521 GLU C O 1 +ATOM 7189 C CB . GLU C 3 521 ? 22.459 109.161 105.237 1.00 23.79 ? 521 GLU C CB 1 +ATOM 7190 C CG . GLU C 3 521 ? 21.446 109.970 104.414 1.00 27.77 ? 521 GLU C CG 1 +ATOM 7191 C CD . GLU C 3 521 ? 20.488 109.160 103.515 1.00 33.29 ? 521 GLU C CD 1 +ATOM 7192 O OE1 . GLU C 3 521 ? 20.724 107.937 103.259 1.00 35.74 ? 521 GLU C OE1 1 +ATOM 7193 O OE2 . GLU C 3 521 ? 19.471 109.767 103.049 1.00 32.74 ? 521 GLU C OE2 1 +ATOM 7194 N N . CYS C 3 522 ? 23.531 106.405 106.446 1.00 21.92 ? 522 CYS C N 1 +ATOM 7195 C CA . CYS C 3 522 ? 24.836 105.843 106.720 1.00 21.25 ? 522 CYS C CA 1 +ATOM 7196 C C . CYS C 3 522 ? 25.913 106.519 105.892 1.00 19.78 ? 522 CYS C C 1 +ATOM 7197 O O . CYS C 3 522 ? 25.661 106.975 104.780 1.00 19.56 ? 522 CYS C O 1 +ATOM 7198 C CB . CYS C 3 522 ? 24.841 104.367 106.357 1.00 21.43 ? 522 CYS C CB 1 +ATOM 7199 S SG . CYS C 3 522 ? 23.580 103.480 107.244 1.00 25.65 ? 522 CYS C SG 1 +ATOM 7200 N N . ARG C 3 523 ? 27.139 106.492 106.401 1.00 18.64 ? 523 ARG C N 1 +ATOM 7201 C CA . ARG C 3 523 ? 28.247 107.166 105.743 1.00 17.50 ? 523 ARG C CA 1 +ATOM 7202 C C . ARG C 3 523 ? 28.750 106.385 104.546 1.00 16.19 ? 523 ARG C C 1 +ATOM 7203 O O . ARG C 3 523 ? 29.899 105.945 104.496 1.00 16.38 ? 523 ARG C O 1 +ATOM 7204 C CB . ARG C 3 523 ? 29.362 107.434 106.738 1.00 18.26 ? 523 ARG C CB 1 +ATOM 7205 C CG . ARG C 3 523 ? 29.009 108.491 107.774 1.00 19.08 ? 523 ARG C CG 1 +ATOM 7206 C CD . ARG C 3 523 ? 30.067 108.594 108.850 1.00 22.43 ? 523 ARG C CD 1 +ATOM 7207 N NE . ARG C 3 523 ? 29.519 109.021 110.139 1.00 23.71 ? 523 ARG C NE 1 +ATOM 7208 C CZ . ARG C 3 523 ? 29.544 108.266 111.227 1.00 23.44 ? 523 ARG C CZ 1 +ATOM 7209 N NH1 . ARG C 3 523 ? 30.086 107.032 111.175 1.00 21.96 ? 523 ARG C NH1 1 +ATOM 7210 N NH2 . ARG C 3 523 ? 29.038 108.750 112.365 1.00 21.73 ? 523 ARG C NH2 1 +ATOM 7211 N N . VAL C 3 524 ? 27.879 106.211 103.569 1.00 15.11 ? 524 VAL C N 1 +ATOM 7212 C CA . VAL C 3 524 ? 28.200 105.355 102.433 1.00 14.33 ? 524 VAL C CA 1 +ATOM 7213 C C . VAL C 3 524 ? 28.917 106.205 101.394 1.00 14.68 ? 524 VAL C C 1 +ATOM 7214 O O . VAL C 3 524 ? 29.864 105.758 100.764 1.00 14.53 ? 524 VAL C O 1 +ATOM 7215 C CB . VAL C 3 524 ? 26.926 104.673 101.862 1.00 13.49 ? 524 VAL C CB 1 +ATOM 7216 C CG1 . VAL C 3 524 ? 27.169 104.083 100.484 1.00 13.96 ? 524 VAL C CG1 1 +ATOM 7217 C CG2 . VAL C 3 524 ? 26.480 103.620 102.754 1.00 10.54 ? 524 VAL C CG2 1 +ATOM 7218 N N . LEU C 3 525 ? 28.493 107.454 101.268 1.00 15.40 ? 525 LEU C N 1 +ATOM 7219 C CA . LEU C 3 525 ? 29.035 108.333 100.263 1.00 16.22 ? 525 LEU C CA 1 +ATOM 7220 C C . LEU C 3 525 ? 29.901 109.430 100.844 1.00 17.32 ? 525 LEU C C 1 +ATOM 7221 O O . LEU C 3 525 ? 30.709 110.036 100.126 1.00 18.67 ? 525 LEU C O 1 +ATOM 7222 C CB . LEU C 3 525 ? 27.882 108.932 99.440 1.00 16.01 ? 525 LEU C CB 1 +ATOM 7223 C CG . LEU C 3 525 ? 27.220 107.872 98.537 1.00 15.94 ? 525 LEU C CG 1 +ATOM 7224 C CD1 . LEU C 3 525 ? 26.233 108.492 97.609 1.00 13.27 ? 525 LEU C CD1 1 +ATOM 7225 C CD2 . LEU C 3 525 ? 28.256 107.021 97.761 1.00 13.20 ? 525 LEU C CD2 1 +ATOM 7226 N N . GLN C 3 526 ? 29.724 109.703 102.138 1.00 18.33 ? 526 GLN C N 1 +ATOM 7227 C CA . GLN C 3 526 ? 30.305 110.891 102.800 1.00 18.67 ? 526 GLN C CA 1 +ATOM 7228 C C . GLN C 3 526 ? 30.510 110.547 104.247 1.00 18.89 ? 526 GLN C C 1 +ATOM 7229 O O . GLN C 3 526 ? 29.822 109.671 104.763 1.00 19.49 ? 526 GLN C O 1 +ATOM 7230 C CB . GLN C 3 526 ? 29.322 112.037 102.807 1.00 17.93 ? 526 GLN C CB 1 +ATOM 7231 C CG . GLN C 3 526 ? 29.246 112.847 101.553 1.00 20.34 ? 526 GLN C CG 1 +ATOM 7232 C CD . GLN C 3 526 ? 27.959 113.694 101.519 1.00 22.78 ? 526 GLN C CD 1 +ATOM 7233 O OE1 . GLN C 3 526 ? 27.906 114.753 100.874 1.00 23.33 ? 526 GLN C OE1 1 +ATOM 7234 N NE2 . GLN C 3 526 ? 26.927 113.226 102.222 1.00 23.08 ? 526 GLN C NE2 1 +ATOM 7235 N N . GLY C 3 527 ? 31.416 111.248 104.915 1.00 18.56 ? 527 GLY C N 1 +ATOM 7236 C CA . GLY C 3 527 ? 31.556 111.071 106.336 1.00 18.76 ? 527 GLY C CA 1 +ATOM 7237 C C . GLY C 3 527 ? 32.749 110.250 106.785 1.00 19.21 ? 527 GLY C C 1 +ATOM 7238 O O . GLY C 3 527 ? 33.173 109.296 106.138 1.00 17.19 ? 527 GLY C O 1 +ATOM 7239 N N . LEU C 3 528 ? 33.199 110.627 107.983 1.00 20.84 ? 528 LEU C N 1 +ATOM 7240 C CA . LEU C 3 528 ? 34.551 110.419 108.479 1.00 21.85 ? 528 LEU C CA 1 +ATOM 7241 C C . LEU C 3 528 ? 34.975 108.960 108.357 1.00 21.45 ? 528 LEU C C 1 +ATOM 7242 O O . LEU C 3 528 ? 35.827 108.702 107.479 1.00 22.64 ? 528 LEU C O 1 +ATOM 7243 C CB . LEU C 3 528 ? 34.783 111.082 109.886 1.00 23.33 ? 528 LEU C CB 1 +ATOM 7244 C CG . LEU C 3 528 ? 34.872 112.640 110.127 1.00 24.49 ? 528 LEU C CG 1 +ATOM 7245 C CD1 . LEU C 3 528 ? 34.857 113.088 111.644 1.00 25.51 ? 528 LEU C CD1 1 +ATOM 7246 C CD2 . LEU C 3 528 ? 36.065 113.338 109.394 1.00 25.76 ? 528 LEU C CD2 1 +ATOM 7247 N N . PRO C 3 529 ? 34.437 108.016 109.164 1.00 19.65 ? 529 PRO C N 1 +ATOM 7248 C CA . PRO C 3 529 ? 34.632 106.575 108.877 1.00 18.31 ? 529 PRO C CA 1 +ATOM 7249 C C . PRO C 3 529 ? 33.511 105.993 107.988 1.00 17.00 ? 529 PRO C C 1 +ATOM 7250 O O . PRO C 3 529 ? 32.364 105.920 108.416 1.00 16.67 ? 529 PRO C O 1 +ATOM 7251 C CB . PRO C 3 529 ? 34.658 105.922 110.279 1.00 18.27 ? 529 PRO C CB 1 +ATOM 7252 C CG . PRO C 3 529 ? 33.853 106.822 111.157 1.00 17.78 ? 529 PRO C CG 1 +ATOM 7253 C CD . PRO C 3 529 ? 33.694 108.209 110.422 1.00 19.51 ? 529 PRO C CD 1 +ATOM 7254 N N . ARG C 3 530 ? 33.849 105.614 106.754 1.00 16.27 ? 530 ARG C N 1 +ATOM 7255 C CA . ARG C 3 530 ? 32.867 105.106 105.766 1.00 15.19 ? 530 ARG C CA 1 +ATOM 7256 C C . ARG C 3 530 ? 32.239 103.793 106.188 1.00 14.72 ? 530 ARG C C 1 +ATOM 7257 O O . ARG C 3 530 ? 32.753 103.107 107.059 1.00 14.98 ? 530 ARG C O 1 +ATOM 7258 C CB . ARG C 3 530 ? 33.487 104.905 104.384 1.00 14.61 ? 530 ARG C CB 1 +ATOM 7259 C CG . ARG C 3 530 ? 33.952 106.149 103.719 1.00 12.93 ? 530 ARG C CG 1 +ATOM 7260 C CD . ARG C 3 530 ? 32.885 106.847 102.952 1.00 13.48 ? 530 ARG C CD 1 +ATOM 7261 N NE . ARG C 3 530 ? 33.126 108.256 103.188 1.00 17.73 ? 530 ARG C NE 1 +ATOM 7262 C CZ . ARG C 3 530 ? 33.646 109.085 102.307 1.00 13.58 ? 530 ARG C CZ 1 +ATOM 7263 N NH1 . ARG C 3 530 ? 33.910 108.693 101.084 1.00 13.61 ? 530 ARG C NH1 1 +ATOM 7264 N NH2 . ARG C 3 530 ? 33.858 110.316 102.646 1.00 14.00 ? 530 ARG C NH2 1 +ATOM 7265 N N . GLU C 3 531 ? 31.138 103.442 105.542 1.00 14.19 ? 531 GLU C N 1 +ATOM 7266 C CA . GLU C 3 531 ? 30.261 102.425 106.067 1.00 14.40 ? 531 GLU C CA 1 +ATOM 7267 C C . GLU C 3 531 ? 29.615 101.786 104.888 1.00 14.69 ? 531 GLU C C 1 +ATOM 7268 O O . GLU C 3 531 ? 29.636 102.349 103.803 1.00 16.15 ? 531 GLU C O 1 +ATOM 7269 C CB . GLU C 3 531 ? 29.172 103.045 106.957 1.00 14.09 ? 531 GLU C CB 1 +ATOM 7270 C CG . GLU C 3 531 ? 29.518 103.193 108.439 1.00 13.81 ? 531 GLU C CG 1 +ATOM 7271 C CD . GLU C 3 531 ? 28.616 104.197 109.170 1.00 17.03 ? 531 GLU C CD 1 +ATOM 7272 O OE1 . GLU C 3 531 ? 28.895 104.513 110.362 1.00 18.63 ? 531 GLU C OE1 1 +ATOM 7273 O OE2 . GLU C 3 531 ? 27.636 104.710 108.562 1.00 16.12 ? 531 GLU C OE2 1 +ATOM 7274 N N . TYR C 3 532 ? 29.063 100.601 105.096 1.00 13.99 ? 532 TYR C N 1 +ATOM 7275 C CA . TYR C 3 532 ? 28.147 100.017 104.166 1.00 13.59 ? 532 TYR C CA 1 +ATOM 7276 C C . TYR C 3 532 ? 26.869 99.707 104.925 1.00 13.11 ? 532 TYR C C 1 +ATOM 7277 O O . TYR C 3 532 ? 26.823 99.833 106.109 1.00 12.61 ? 532 TYR C O 1 +ATOM 7278 C CB . TYR C 3 532 ? 28.742 98.735 103.592 1.00 14.06 ? 532 TYR C CB 1 +ATOM 7279 C CG . TYR C 3 532 ? 28.935 97.647 104.612 1.00 15.33 ? 532 TYR C CG 1 +ATOM 7280 C CD1 . TYR C 3 532 ? 28.086 96.534 104.642 1.00 13.56 ? 532 TYR C CD1 1 +ATOM 7281 C CD2 . TYR C 3 532 ? 29.953 97.742 105.564 1.00 16.07 ? 532 TYR C CD2 1 +ATOM 7282 C CE1 . TYR C 3 532 ? 28.272 95.547 105.586 1.00 15.33 ? 532 TYR C CE1 1 +ATOM 7283 C CE2 . TYR C 3 532 ? 30.129 96.763 106.540 1.00 17.06 ? 532 TYR C CE2 1 +ATOM 7284 C CZ . TYR C 3 532 ? 29.296 95.673 106.540 1.00 16.57 ? 532 TYR C CZ 1 +ATOM 7285 O OH . TYR C 3 532 ? 29.484 94.697 107.486 1.00 16.78 ? 532 TYR C OH 1 +ATOM 7286 N N . VAL C 3 533 ? 25.853 99.246 104.217 1.00 14.31 ? 533 VAL C N 1 +ATOM 7287 C CA . VAL C 3 533 ? 24.539 98.947 104.768 1.00 14.44 ? 533 VAL C CA 1 +ATOM 7288 C C . VAL C 3 533 ? 24.183 97.480 104.680 1.00 15.10 ? 533 VAL C C 1 +ATOM 7289 O O . VAL C 3 533 ? 24.017 96.918 103.603 1.00 14.72 ? 533 VAL C O 1 +ATOM 7290 C CB . VAL C 3 533 ? 23.429 99.749 104.036 1.00 14.11 ? 533 VAL C CB 1 +ATOM 7291 C CG1 . VAL C 3 533 ? 22.038 99.346 104.552 1.00 13.55 ? 533 VAL C CG1 1 +ATOM 7292 C CG2 . VAL C 3 533 ? 23.665 101.229 104.251 1.00 14.23 ? 533 VAL C CG2 1 +ATOM 7293 N N . ASN C 3 534 ? 24.029 96.872 105.833 1.00 16.18 ? 534 ASN C N 1 +ATOM 7294 C CA . ASN C 3 534 ? 23.451 95.563 105.877 1.00 17.57 ? 534 ASN C CA 1 +ATOM 7295 C C . ASN C 3 534 ? 22.086 95.607 106.519 1.00 18.28 ? 534 ASN C C 1 +ATOM 7296 O O . ASN C 3 534 ? 21.973 96.001 107.681 1.00 18.56 ? 534 ASN C O 1 +ATOM 7297 C CB . ASN C 3 534 ? 24.337 94.602 106.647 1.00 18.26 ? 534 ASN C CB 1 +ATOM 7298 C CG . ASN C 3 534 ? 23.876 93.181 106.500 1.00 17.29 ? 534 ASN C CG 1 +ATOM 7299 O OD1 . ASN C 3 534 ? 22.926 92.729 107.144 1.00 16.13 ? 534 ASN C OD1 1 +ATOM 7300 N ND2 . ASN C 3 534 ? 24.500 92.489 105.596 1.00 21.63 ? 534 ASN C ND2 1 +ATOM 7301 N N . ALA C 3 535 ? 21.062 95.177 105.772 1.00 19.12 ? 535 ALA C N 1 +ATOM 7302 C CA . ALA C 3 535 ? 19.679 95.259 106.226 1.00 19.41 ? 535 ALA C CA 1 +ATOM 7303 C C . ALA C 3 535 ? 19.486 96.518 107.067 1.00 20.21 ? 535 ALA C C 1 +ATOM 7304 O O . ALA C 3 535 ? 19.136 96.443 108.241 1.00 20.88 ? 535 ALA C O 1 +ATOM 7305 C CB . ALA C 3 535 ? 19.309 94.031 107.031 1.00 18.69 ? 535 ALA C CB 1 +ATOM 7306 N N . ARG C 3 536 ? 19.748 97.676 106.483 1.00 20.95 ? 536 ARG C N 1 +ATOM 7307 C CA . ARG C 3 536 ? 19.403 98.937 107.141 1.00 22.11 ? 536 ARG C CA 1 +ATOM 7308 C C . ARG C 3 536 ? 20.269 99.236 108.391 1.00 21.96 ? 536 ARG C C 1 +ATOM 7309 O O . ARG C 3 536 ? 20.067 100.244 109.069 1.00 21.84 ? 536 ARG C O 1 +ATOM 7310 C CB . ARG C 3 536 ? 17.912 98.973 107.498 1.00 22.11 ? 536 ARG C CB 1 +ATOM 7311 C CG . ARG C 3 536 ? 16.972 98.994 106.291 1.00 25.72 ? 536 ARG C CG 1 +ATOM 7312 C CD . ARG C 3 536 ? 15.503 99.361 106.623 1.00 30.34 ? 536 ARG C CD 1 +ATOM 7313 N NE . ARG C 3 536 ? 14.550 98.875 105.617 1.00 34.77 ? 536 ARG C NE 1 +ATOM 7314 C CZ . ARG C 3 536 ? 13.213 98.844 105.777 1.00 37.97 ? 536 ARG C CZ 1 +ATOM 7315 N NH1 . ARG C 3 536 ? 12.660 99.272 106.918 1.00 39.31 ? 536 ARG C NH1 1 +ATOM 7316 N NH2 . ARG C 3 536 ? 12.422 98.380 104.799 1.00 37.02 ? 536 ARG C NH2 1 +ATOM 7317 N N . HIS C 3 537 ? 21.231 98.371 108.691 1.00 21.53 ? 537 HIS C N 1 +ATOM 7318 C CA . HIS C 3 537 ? 22.230 98.705 109.702 1.00 21.44 ? 537 HIS C CA 1 +ATOM 7319 C C . HIS C 3 537 ? 23.451 99.360 109.045 1.00 20.64 ? 537 HIS C C 1 +ATOM 7320 O O . HIS C 3 537 ? 23.889 98.913 107.962 1.00 20.26 ? 537 HIS C O 1 +ATOM 7321 C CB . HIS C 3 537 ? 22.622 97.442 110.454 1.00 21.83 ? 537 HIS C CB 1 +ATOM 7322 C CG . HIS C 3 537 ? 21.535 96.920 111.335 1.00 24.12 ? 537 HIS C CG 1 +ATOM 7323 N ND1 . HIS C 3 537 ? 21.419 97.279 112.667 1.00 26.50 ? 537 HIS C ND1 1 +ATOM 7324 C CD2 . HIS C 3 537 ? 20.493 96.093 111.069 1.00 24.53 ? 537 HIS C CD2 1 +ATOM 7325 C CE1 . HIS C 3 537 ? 20.361 96.674 113.185 1.00 27.56 ? 537 HIS C CE1 1 +ATOM 7326 N NE2 . HIS C 3 537 ? 19.779 95.955 112.235 1.00 26.57 ? 537 HIS C NE2 1 +ATOM 7327 N N . CYS C 3 538 ? 23.964 100.434 109.646 1.00 19.05 ? 538 CYS C N 1 +ATOM 7328 C CA . CYS C 3 538 ? 25.213 101.037 109.168 1.00 18.80 ? 538 CYS C CA 1 +ATOM 7329 C C . CYS C 3 538 ? 26.353 100.294 109.849 1.00 18.56 ? 538 CYS C C 1 +ATOM 7330 O O . CYS C 3 538 ? 26.451 100.296 111.082 1.00 18.92 ? 538 CYS C O 1 +ATOM 7331 C CB . CYS C 3 538 ? 25.360 102.501 109.591 1.00 18.69 ? 538 CYS C CB 1 +ATOM 7332 S SG . CYS C 3 538 ? 24.007 103.597 109.219 1.00 19.88 ? 538 CYS C SG 1 +ATOM 7333 N N . LEU C 3 539 ? 27.229 99.691 109.070 1.00 17.60 ? 539 LEU C N 1 +ATOM 7334 C CA . LEU C 3 539 ? 28.332 98.963 109.643 1.00 17.77 ? 539 LEU C CA 1 +ATOM 7335 C C . LEU C 3 539 ? 29.579 99.538 109.075 1.00 17.87 ? 539 LEU C C 1 +ATOM 7336 O O . LEU C 3 539 ? 29.550 100.073 107.991 1.00 18.14 ? 539 LEU C O 1 +ATOM 7337 C CB . LEU C 3 539 ? 28.188 97.467 109.324 1.00 18.69 ? 539 LEU C CB 1 +ATOM 7338 C CG . LEU C 3 539 ? 26.832 96.944 109.825 1.00 18.33 ? 539 LEU C CG 1 +ATOM 7339 C CD1 . LEU C 3 539 ? 26.459 95.710 109.100 1.00 19.50 ? 539 LEU C CD1 1 +ATOM 7340 C CD2 . LEU C 3 539 ? 26.827 96.725 111.315 1.00 15.36 ? 539 LEU C CD2 1 +ATOM 7341 N N . PRO C 3 540 ? 30.697 99.427 109.779 1.00 18.91 ? 540 PRO C N 1 +ATOM 7342 C CA . PRO C 3 540 ? 31.920 100.139 109.370 1.00 18.43 ? 540 PRO C CA 1 +ATOM 7343 C C . PRO C 3 540 ? 32.588 99.413 108.213 1.00 18.08 ? 540 PRO C C 1 +ATOM 7344 O O . PRO C 3 540 ? 32.745 98.175 108.283 1.00 18.35 ? 540 PRO C O 1 +ATOM 7345 C CB . PRO C 3 540 ? 32.832 99.982 110.585 1.00 18.29 ? 540 PRO C CB 1 +ATOM 7346 C CG . PRO C 3 540 ? 32.003 99.335 111.630 1.00 19.05 ? 540 PRO C CG 1 +ATOM 7347 C CD . PRO C 3 540 ? 30.937 98.547 110.944 1.00 19.14 ? 540 PRO C CD 1 +ATOM 7348 N N . CYS C 3 541 ? 32.930 100.143 107.154 1.00 17.14 ? 541 CYS C N 1 +ATOM 7349 C CA . CYS C 3 541 ? 33.983 99.677 106.252 1.00 16.59 ? 541 CYS C CA 1 +ATOM 7350 C C . CYS C 3 541 ? 35.254 99.380 107.066 1.00 16.34 ? 541 CYS C C 1 +ATOM 7351 O O . CYS C 3 541 ? 35.551 100.116 108.032 1.00 16.43 ? 541 CYS C O 1 +ATOM 7352 C CB . CYS C 3 541 ? 34.298 100.722 105.216 1.00 15.60 ? 541 CYS C CB 1 +ATOM 7353 S SG . CYS C 3 541 ? 33.070 100.737 103.883 1.00 17.46 ? 541 CYS C SG 1 +ATOM 7354 N N . HIS C 3 542 ? 35.954 98.290 106.702 1.00 15.59 ? 542 HIS C N 1 +ATOM 7355 C CA . HIS C 3 542 ? 37.293 97.972 107.207 1.00 14.89 ? 542 HIS C CA 1 +ATOM 7356 C C . HIS C 3 542 ? 38.149 99.228 107.088 1.00 14.74 ? 542 HIS C C 1 +ATOM 7357 O O . HIS C 3 542 ? 38.093 99.882 106.056 1.00 16.03 ? 542 HIS C O 1 +ATOM 7358 C CB . HIS C 3 542 ? 37.946 96.813 106.428 1.00 13.86 ? 542 HIS C CB 1 +ATOM 7359 C CG . HIS C 3 542 ? 39.304 96.417 106.937 1.00 14.54 ? 542 HIS C CG 1 +ATOM 7360 N ND1 . HIS C 3 542 ? 39.527 95.264 107.667 1.00 15.57 ? 542 HIS C ND1 1 +ATOM 7361 C CD2 . HIS C 3 542 ? 40.511 97.026 106.832 1.00 11.37 ? 542 HIS C CD2 1 +ATOM 7362 C CE1 . HIS C 3 542 ? 40.803 95.190 107.995 1.00 12.12 ? 542 HIS C CE1 1 +ATOM 7363 N NE2 . HIS C 3 542 ? 41.425 96.232 107.476 1.00 9.30 ? 542 HIS C NE2 1 +ATOM 7364 N N . PRO C 3 543 ? 38.930 99.561 108.119 1.00 13.88 ? 543 PRO C N 1 +ATOM 7365 C CA . PRO C 3 543 ? 39.756 100.775 108.085 1.00 13.75 ? 543 PRO C CA 1 +ATOM 7366 C C . PRO C 3 543 ? 40.743 100.853 106.933 1.00 13.26 ? 543 PRO C C 1 +ATOM 7367 O O . PRO C 3 543 ? 41.291 101.914 106.742 1.00 13.76 ? 543 PRO C O 1 +ATOM 7368 C CB . PRO C 3 543 ? 40.523 100.754 109.445 1.00 12.69 ? 543 PRO C CB 1 +ATOM 7369 C CG . PRO C 3 543 ? 39.695 99.887 110.322 1.00 13.94 ? 543 PRO C CG 1 +ATOM 7370 C CD . PRO C 3 543 ? 39.101 98.820 109.385 1.00 13.68 ? 543 PRO C CD 1 +ATOM 7371 N N . GLU C 3 544 ? 40.972 99.790 106.183 1.00 13.54 ? 544 GLU C N 1 +ATOM 7372 C CA . GLU C 3 544 ? 41.961 99.855 105.123 1.00 13.79 ? 544 GLU C CA 1 +ATOM 7373 C C . GLU C 3 544 ? 41.383 100.113 103.728 1.00 14.40 ? 544 GLU C C 1 +ATOM 7374 O O . GLU C 3 544 ? 42.135 100.228 102.770 1.00 15.65 ? 544 GLU C O 1 +ATOM 7375 C CB . GLU C 3 544 ? 42.902 98.644 105.159 1.00 14.11 ? 544 GLU C CB 1 +ATOM 7376 C CG . GLU C 3 544 ? 43.850 98.634 106.352 1.00 13.46 ? 544 GLU C CG 1 +ATOM 7377 C CD . GLU C 3 544 ? 44.809 99.826 106.389 1.00 16.39 ? 544 GLU C CD 1 +ATOM 7378 O OE1 . GLU C 3 544 ? 45.311 100.259 105.318 1.00 13.96 ? 544 GLU C OE1 1 +ATOM 7379 O OE2 . GLU C 3 544 ? 45.084 100.328 107.514 1.00 18.48 ? 544 GLU C OE2 1 +ATOM 7380 N N . CYS C 3 545 ? 40.057 100.197 103.605 1.00 14.58 ? 545 CYS C N 1 +ATOM 7381 C CA . CYS C 3 545 ? 39.404 100.711 102.390 1.00 14.92 ? 545 CYS C CA 1 +ATOM 7382 C C . CYS C 3 545 ? 39.627 102.213 102.238 1.00 13.87 ? 545 CYS C C 1 +ATOM 7383 O O . CYS C 3 545 ? 39.375 102.938 103.161 1.00 14.11 ? 545 CYS C O 1 +ATOM 7384 C CB . CYS C 3 545 ? 37.905 100.479 102.476 1.00 14.52 ? 545 CYS C CB 1 +ATOM 7385 S SG . CYS C 3 545 ? 37.508 98.759 102.711 1.00 20.89 ? 545 CYS C SG 1 +ATOM 7386 N N . GLN C 3 546 ? 40.096 102.640 101.074 1.00 13.50 ? 546 GLN C N 1 +ATOM 7387 C CA . GLN C 3 546 ? 40.242 104.036 100.719 1.00 14.31 ? 546 GLN C CA 1 +ATOM 7388 C C . GLN C 3 546 ? 38.867 104.627 100.567 1.00 14.00 ? 546 GLN C C 1 +ATOM 7389 O O . GLN C 3 546 ? 38.081 104.174 99.747 1.00 14.43 ? 546 GLN C O 1 +ATOM 7390 C CB . GLN C 3 546 ? 40.949 104.140 99.379 1.00 14.64 ? 546 GLN C CB 1 +ATOM 7391 C CG . GLN C 3 546 ? 41.276 105.568 98.874 1.00 16.87 ? 546 GLN C CG 1 +ATOM 7392 C CD . GLN C 3 546 ? 42.058 105.500 97.541 1.00 21.12 ? 546 GLN C CD 1 +ATOM 7393 O OE1 . GLN C 3 546 ? 43.272 105.659 97.526 1.00 23.09 ? 546 GLN C OE1 1 +ATOM 7394 N NE2 . GLN C 3 546 ? 41.368 105.181 96.451 1.00 21.41 ? 546 GLN C NE2 1 +ATOM 7395 N N . PRO C 3 547 ? 38.528 105.605 101.392 1.00 14.21 ? 547 PRO C N 1 +ATOM 7396 C CA . PRO C 3 547 ? 37.211 106.252 101.253 1.00 13.63 ? 547 PRO C CA 1 +ATOM 7397 C C . PRO C 3 547 ? 37.133 106.740 99.833 1.00 12.74 ? 547 PRO C C 1 +ATOM 7398 O O . PRO C 3 547 ? 38.120 107.276 99.384 1.00 12.61 ? 547 PRO C O 1 +ATOM 7399 C CB . PRO C 3 547 ? 37.264 107.429 102.245 1.00 13.22 ? 547 PRO C CB 1 +ATOM 7400 C CG . PRO C 3 547 ? 38.640 107.467 102.755 1.00 13.95 ? 547 PRO C CG 1 +ATOM 7401 C CD . PRO C 3 547 ? 39.297 106.117 102.539 1.00 13.15 ? 547 PRO C CD 1 +ATOM 7402 N N . GLN C 3 548 ? 36.027 106.529 99.136 1.00 12.42 ? 548 GLN C N 1 +ATOM 7403 C CA . GLN C 3 548 ? 35.934 106.938 97.728 1.00 12.18 ? 548 GLN C CA 1 +ATOM 7404 C C . GLN C 3 548 ? 35.172 108.202 97.513 1.00 11.93 ? 548 GLN C C 1 +ATOM 7405 O O . GLN C 3 548 ? 34.339 108.542 98.302 1.00 11.93 ? 548 GLN C O 1 +ATOM 7406 C CB . GLN C 3 548 ? 35.278 105.839 96.906 1.00 11.36 ? 548 GLN C CB 1 +ATOM 7407 C CG . GLN C 3 548 ? 36.074 104.590 96.932 1.00 10.26 ? 548 GLN C CG 1 +ATOM 7408 C CD . GLN C 3 548 ? 37.442 104.800 96.362 1.00 9.65 ? 548 GLN C CD 1 +ATOM 7409 O OE1 . GLN C 3 548 ? 37.589 105.024 95.139 1.00 11.34 ? 548 GLN C OE1 1 +ATOM 7410 N NE2 . GLN C 3 548 ? 38.457 104.735 97.218 1.00 4.73 ? 548 GLN C NE2 1 +ATOM 7411 N N . ASN C 3 549 ? 35.421 108.866 96.400 1.00 12.79 ? 549 ASN C N 1 +ATOM 7412 C CA . ASN C 3 549 ? 34.705 110.092 96.067 1.00 13.66 ? 549 ASN C CA 1 +ATOM 7413 C C . ASN C 3 549 ? 33.696 109.821 94.961 1.00 13.45 ? 549 ASN C C 1 +ATOM 7414 O O . ASN C 3 549 ? 34.063 109.418 93.853 1.00 13.46 ? 549 ASN C O 1 +ATOM 7415 C CB . ASN C 3 549 ? 35.692 111.205 95.657 1.00 14.26 ? 549 ASN C CB 1 +ATOM 7416 C CG . ASN C 3 549 ? 36.320 111.917 96.868 1.00 16.94 ? 549 ASN C CG 1 +ATOM 7417 O OD1 . ASN C 3 549 ? 35.884 111.709 98.014 1.00 15.34 ? 549 ASN C OD1 1 +ATOM 7418 N ND2 . ASN C 3 549 ? 37.334 112.793 96.612 1.00 19.23 ? 549 ASN C ND2 1 +ATOM 7419 N N . GLY C 3 550 ? 32.423 110.012 95.281 1.00 13.49 ? 550 GLY C N 1 +ATOM 7420 C CA . GLY C 3 550 ? 31.334 109.794 94.337 1.00 13.64 ? 550 GLY C CA 1 +ATOM 7421 C C . GLY C 3 550 ? 30.967 108.330 94.060 1.00 13.20 ? 550 GLY C C 1 +ATOM 7422 O O . GLY C 3 550 ? 30.159 108.041 93.177 1.00 14.36 ? 550 GLY C O 1 +ATOM 7423 N N . SER C 3 551 ? 31.575 107.406 94.785 1.00 12.07 ? 551 SER C N 1 +ATOM 7424 C CA . SER C 3 551 ? 31.236 106.024 94.679 1.00 11.37 ? 551 SER C CA 1 +ATOM 7425 C C . SER C 3 551 ? 31.215 105.450 96.064 1.00 11.15 ? 551 SER C C 1 +ATOM 7426 O O . SER C 3 551 ? 31.702 106.031 97.014 1.00 11.26 ? 551 SER C O 1 +ATOM 7427 C CB . SER C 3 551 ? 32.269 105.292 93.826 1.00 11.67 ? 551 SER C CB 1 +ATOM 7428 O OG . SER C 3 551 ? 32.546 103.978 94.343 1.00 12.44 ? 551 SER C OG 1 +ATOM 7429 N N . VAL C 3 552 ? 30.687 104.253 96.173 1.00 11.23 ? 552 VAL C N 1 +ATOM 7430 C CA . VAL C 3 552 ? 30.665 103.546 97.430 1.00 10.97 ? 552 VAL C CA 1 +ATOM 7431 C C . VAL C 3 552 ? 32.101 103.216 97.882 1.00 10.24 ? 552 VAL C C 1 +ATOM 7432 O O . VAL C 3 552 ? 32.983 103.187 97.064 1.00 10.02 ? 552 VAL C O 1 +ATOM 7433 C CB . VAL C 3 552 ? 29.734 102.359 97.197 1.00 10.94 ? 552 VAL C CB 1 +ATOM 7434 C CG1 . VAL C 3 552 ? 30.326 101.021 97.613 1.00 12.62 ? 552 VAL C CG1 1 +ATOM 7435 C CG2 . VAL C 3 552 ? 28.383 102.665 97.827 1.00 12.89 ? 552 VAL C CG2 1 +ATOM 7436 N N . THR C 3 553 ? 32.335 103.023 99.178 1.00 10.82 ? 553 THR C N 1 +ATOM 7437 C CA . THR C 3 553 ? 33.656 102.654 99.716 1.00 10.94 ? 553 THR C CA 1 +ATOM 7438 C C . THR C 3 553 ? 33.859 101.121 99.975 1.00 11.49 ? 553 THR C C 1 +ATOM 7439 O O . THR C 3 553 ? 34.944 100.586 99.727 1.00 11.84 ? 553 THR C O 1 +ATOM 7440 C CB . THR C 3 553 ? 33.980 103.494 100.951 1.00 10.56 ? 553 THR C CB 1 +ATOM 7441 O OG1 . THR C 3 553 ? 34.445 104.773 100.538 1.00 10.26 ? 553 THR C OG1 1 +ATOM 7442 C CG2 . THR C 3 553 ? 35.176 102.934 101.717 1.00 10.64 ? 553 THR C CG2 1 +ATOM 7443 N N . CYS C 3 554 ? 32.831 100.394 100.395 1.00 12.02 ? 554 CYS C N 1 +ATOM 7444 C CA . CYS C 3 554 ? 32.995 98.946 100.439 1.00 13.28 ? 554 CYS C CA 1 +ATOM 7445 C C . CYS C 3 554 ? 31.700 98.191 100.196 1.00 14.10 ? 554 CYS C C 1 +ATOM 7446 O O . CYS C 3 554 ? 30.653 98.800 100.149 1.00 14.93 ? 554 CYS C O 1 +ATOM 7447 C CB . CYS C 3 554 ? 33.586 98.518 101.789 1.00 13.61 ? 554 CYS C CB 1 +ATOM 7448 S SG . CYS C 3 554 ? 32.476 98.913 103.177 1.00 13.34 ? 554 CYS C SG 1 +ATOM 7449 N N . PHE C 3 555 ? 31.796 96.860 100.106 1.00 14.57 ? 555 PHE C N 1 +ATOM 7450 C CA . PHE C 3 555 ? 30.674 95.973 99.869 1.00 15.17 ? 555 PHE C CA 1 +ATOM 7451 C C . PHE C 3 555 ? 30.341 95.132 101.087 1.00 15.74 ? 555 PHE C C 1 +ATOM 7452 O O . PHE C 3 555 ? 29.324 94.406 101.081 1.00 15.29 ? 555 PHE C O 1 +ATOM 7453 C CB . PHE C 3 555 ? 30.974 95.012 98.706 1.00 15.48 ? 555 PHE C CB 1 +ATOM 7454 C CG . PHE C 3 555 ? 31.690 95.651 97.547 1.00 16.37 ? 555 PHE C CG 1 +ATOM 7455 C CD1 . PHE C 3 555 ? 31.007 96.499 96.670 1.00 16.88 ? 555 PHE C CD1 1 +ATOM 7456 C CD2 . PHE C 3 555 ? 33.026 95.414 97.337 1.00 13.94 ? 555 PHE C CD2 1 +ATOM 7457 C CE1 . PHE C 3 555 ? 31.640 97.103 95.605 1.00 16.22 ? 555 PHE C CE1 1 +ATOM 7458 C CE2 . PHE C 3 555 ? 33.662 96.010 96.283 1.00 17.32 ? 555 PHE C CE2 1 +ATOM 7459 C CZ . PHE C 3 555 ? 32.969 96.886 95.414 1.00 16.81 ? 555 PHE C CZ 1 +ATOM 7460 N N . GLY C 3 556 ? 31.215 95.182 102.099 1.00 15.98 ? 556 GLY C N 1 +ATOM 7461 C CA . GLY C 3 556 ? 30.966 94.545 103.379 1.00 15.63 ? 556 GLY C CA 1 +ATOM 7462 C C . GLY C 3 556 ? 32.072 94.853 104.372 1.00 16.41 ? 556 GLY C C 1 +ATOM 7463 O O . GLY C 3 556 ? 32.876 95.735 104.157 1.00 17.02 ? 556 GLY C O 1 +ATOM 7464 N N . PRO C 3 557 ? 32.160 94.090 105.452 1.00 17.01 ? 557 PRO C N 1 +ATOM 7465 C CA . PRO C 3 557 ? 33.063 94.446 106.560 1.00 17.19 ? 557 PRO C CA 1 +ATOM 7466 C C . PRO C 3 557 ? 34.559 94.135 106.367 1.00 17.73 ? 557 PRO C C 1 +ATOM 7467 O O . PRO C 3 557 ? 35.404 94.839 106.931 1.00 19.35 ? 557 PRO C O 1 +ATOM 7468 C CB . PRO C 3 557 ? 32.539 93.592 107.686 1.00 17.89 ? 557 PRO C CB 1 +ATOM 7469 C CG . PRO C 3 557 ? 32.038 92.278 106.928 1.00 18.24 ? 557 PRO C CG 1 +ATOM 7470 C CD . PRO C 3 557 ? 31.418 92.823 105.671 1.00 16.34 ? 557 PRO C CD 1 +ATOM 7471 N N . GLU C 3 558 ? 34.892 93.079 105.634 1.00 17.61 ? 558 GLU C N 1 +ATOM 7472 C CA . GLU C 3 558 ? 36.294 92.622 105.476 1.00 16.89 ? 558 GLU C CA 1 +ATOM 7473 C C . GLU C 3 558 ? 37.202 93.460 104.553 1.00 15.90 ? 558 GLU C C 1 +ATOM 7474 O O . GLU C 3 558 ? 36.730 94.142 103.641 1.00 16.26 ? 558 GLU C O 1 +ATOM 7475 C CB . GLU C 3 558 ? 36.341 91.151 105.067 1.00 16.00 ? 558 GLU C CB 1 +ATOM 7476 C CG . GLU C 3 558 ? 35.642 90.249 106.063 1.00 17.62 ? 558 GLU C CG 1 +ATOM 7477 C CD . GLU C 3 558 ? 35.484 88.827 105.556 1.00 20.70 ? 558 GLU C CD 1 +ATOM 7478 O OE1 . GLU C 3 558 ? 36.278 87.948 105.984 1.00 22.79 ? 558 GLU C OE1 1 +ATOM 7479 O OE2 . GLU C 3 558 ? 34.573 88.588 104.720 1.00 21.83 ? 558 GLU C OE2 1 +ATOM 7480 N N . ALA C 3 559 ? 38.507 93.386 104.819 1.00 15.04 ? 559 ALA C N 1 +ATOM 7481 C CA . ALA C 3 559 ? 39.542 94.116 104.077 1.00 13.72 ? 559 ALA C CA 1 +ATOM 7482 C C . ALA C 3 559 ? 39.743 93.663 102.613 1.00 13.14 ? 559 ALA C C 1 +ATOM 7483 O O . ALA C 3 559 ? 40.559 94.254 101.915 1.00 12.64 ? 559 ALA C O 1 +ATOM 7484 C CB . ALA C 3 559 ? 40.864 94.120 104.838 1.00 11.57 ? 559 ALA C CB 1 +ATOM 7485 N N . ASP C 3 560 ? 39.020 92.628 102.174 1.00 12.95 ? 560 ASP C N 1 +ATOM 7486 C CA . ASP C 3 560 ? 39.007 92.227 100.772 1.00 13.86 ? 560 ASP C CA 1 +ATOM 7487 C C . ASP C 3 560 ? 37.683 92.626 100.135 1.00 14.69 ? 560 ASP C C 1 +ATOM 7488 O O . ASP C 3 560 ? 37.295 92.111 99.075 1.00 14.08 ? 560 ASP C O 1 +ATOM 7489 C CB . ASP C 3 560 ? 39.180 90.723 100.608 1.00 14.11 ? 560 ASP C CB 1 +ATOM 7490 C CG . ASP C 3 560 ? 38.000 89.971 101.131 1.00 14.85 ? 560 ASP C CG 1 +ATOM 7491 O OD1 . ASP C 3 560 ? 37.106 90.661 101.666 1.00 18.09 ? 560 ASP C OD1 1 +ATOM 7492 O OD2 . ASP C 3 560 ? 37.855 88.739 101.061 1.00 14.94 ? 560 ASP C OD2 1 +ATOM 7493 N N . GLN C 3 561 ? 36.977 93.543 100.792 1.00 15.70 ? 561 GLN C N 1 +ATOM 7494 C CA . GLN C 3 561 ? 35.696 94.001 100.285 1.00 15.43 ? 561 GLN C CA 1 +ATOM 7495 C C . GLN C 3 561 ? 35.746 95.483 99.988 1.00 16.11 ? 561 GLN C C 1 +ATOM 7496 O O . GLN C 3 561 ? 34.704 96.103 99.856 1.00 17.45 ? 561 GLN C O 1 +ATOM 7497 C CB . GLN C 3 561 ? 34.578 93.664 101.284 1.00 15.39 ? 561 GLN C CB 1 +ATOM 7498 C CG . GLN C 3 561 ? 33.872 92.376 101.019 1.00 11.31 ? 561 GLN C CG 1 +ATOM 7499 C CD . GLN C 3 561 ? 33.107 91.883 102.236 1.00 14.44 ? 561 GLN C CD 1 +ATOM 7500 O OE1 . GLN C 3 561 ? 33.525 92.136 103.387 1.00 13.45 ? 561 GLN C OE1 1 +ATOM 7501 N NE2 . GLN C 3 561 ? 32.007 91.131 102.005 1.00 9.70 ? 561 GLN C NE2 1 +ATOM 7502 N N . CYS C 3 562 ? 36.952 96.050 99.874 1.00 16.82 ? 562 CYS C N 1 +ATOM 7503 C CA . CYS C 3 562 ? 37.159 97.481 99.562 1.00 16.60 ? 562 CYS C CA 1 +ATOM 7504 C C . CYS C 3 562 ? 37.085 97.708 98.091 1.00 16.39 ? 562 CYS C C 1 +ATOM 7505 O O . CYS C 3 562 ? 37.398 96.808 97.321 1.00 16.06 ? 562 CYS C O 1 +ATOM 7506 C CB . CYS C 3 562 ? 38.545 97.931 99.990 1.00 16.44 ? 562 CYS C CB 1 +ATOM 7507 S SG . CYS C 3 562 ? 38.867 97.576 101.715 1.00 18.67 ? 562 CYS C SG 1 +ATOM 7508 N N . VAL C 3 563 ? 36.746 98.928 97.670 1.00 16.48 ? 563 VAL C N 1 +ATOM 7509 C CA . VAL C 3 563 ? 36.915 99.200 96.247 1.00 16.05 ? 563 VAL C CA 1 +ATOM 7510 C C . VAL C 3 563 ? 38.392 99.465 95.959 1.00 16.77 ? 563 VAL C C 1 +ATOM 7511 O O . VAL C 3 563 ? 38.889 99.170 94.878 1.00 18.55 ? 563 VAL C O 1 +ATOM 7512 C CB . VAL C 3 563 ? 35.882 100.227 95.617 1.00 16.35 ? 563 VAL C CB 1 +ATOM 7513 C CG1 . VAL C 3 563 ? 34.655 100.431 96.526 1.00 14.79 ? 563 VAL C CG1 1 +ATOM 7514 C CG2 . VAL C 3 563 ? 36.555 101.541 95.131 1.00 13.86 ? 563 VAL C CG2 1 +ATOM 7515 N N . ALA C 3 564 ? 39.110 100.001 96.929 1.00 16.55 ? 564 ALA C N 1 +ATOM 7516 C CA . ALA C 3 564 ? 40.496 100.352 96.705 1.00 16.28 ? 564 ALA C CA 1 +ATOM 7517 C C . ALA C 3 564 ? 41.193 100.458 98.045 1.00 16.52 ? 564 ALA C C 1 +ATOM 7518 O O . ALA C 3 564 ? 40.584 100.861 99.051 1.00 17.26 ? 564 ALA C O 1 +ATOM 7519 C CB . ALA C 3 564 ? 40.592 101.649 95.951 1.00 16.20 ? 564 ALA C CB 1 +ATOM 7520 N N . CYS C 3 565 ? 42.474 100.108 98.053 1.00 16.23 ? 565 CYS C N 1 +ATOM 7521 C CA . CYS C 3 565 ? 43.241 100.031 99.270 1.00 15.64 ? 565 CYS C CA 1 +ATOM 7522 C C . CYS C 3 565 ? 43.745 101.422 99.637 1.00 15.27 ? 565 CYS C C 1 +ATOM 7523 O O . CYS C 3 565 ? 44.178 102.221 98.786 1.00 15.22 ? 565 CYS C O 1 +ATOM 7524 C CB . CYS C 3 565 ? 44.361 99.007 99.109 1.00 15.26 ? 565 CYS C CB 1 +ATOM 7525 S SG . CYS C 3 565 ? 43.731 97.266 98.984 1.00 22.03 ? 565 CYS C SG 1 +ATOM 7526 N N . ALA C 3 566 ? 43.640 101.716 100.922 1.00 14.11 ? 566 ALA C N 1 +ATOM 7527 C CA . ALA C 3 566 ? 44.117 102.946 101.472 1.00 13.27 ? 566 ALA C CA 1 +ATOM 7528 C C . ALA C 3 566 ? 45.642 102.930 101.410 1.00 12.66 ? 566 ALA C C 1 +ATOM 7529 O O . ALA C 3 566 ? 46.292 103.962 101.254 1.00 12.48 ? 566 ALA C O 1 +ATOM 7530 C CB . ALA C 3 566 ? 43.615 103.077 102.898 1.00 13.30 ? 566 ALA C CB 1 +ATOM 7531 N N . HIS C 3 567 ? 46.226 101.751 101.497 1.00 11.20 ? 567 HIS C N 1 +ATOM 7532 C CA . HIS C 3 567 ? 47.665 101.727 101.588 1.00 10.83 ? 567 HIS C CA 1 +ATOM 7533 C C . HIS C 3 567 ? 48.262 100.716 100.655 1.00 9.96 ? 567 HIS C C 1 +ATOM 7534 O O . HIS C 3 567 ? 48.552 101.053 99.519 1.00 9.44 ? 567 HIS C O 1 +ATOM 7535 C CB . HIS C 3 567 ? 48.102 101.523 103.033 1.00 10.56 ? 567 HIS C CB 1 +ATOM 7536 C CG . HIS C 3 567 ? 47.619 102.601 103.950 1.00 11.93 ? 567 HIS C CG 1 +ATOM 7537 N ND1 . HIS C 3 567 ? 48.256 103.820 104.069 1.00 12.91 ? 567 HIS C ND1 1 +ATOM 7538 C CD2 . HIS C 3 567 ? 46.553 102.652 104.781 1.00 12.24 ? 567 HIS C CD2 1 +ATOM 7539 C CE1 . HIS C 3 567 ? 47.609 104.571 104.941 1.00 13.56 ? 567 HIS C CE1 1 +ATOM 7540 N NE2 . HIS C 3 567 ? 46.573 103.884 105.390 1.00 14.47 ? 567 HIS C NE2 1 +ATOM 7541 N N . TYR C 3 568 ? 48.435 99.489 101.145 1.00 9.69 ? 568 TYR C N 1 +ATOM 7542 C CA . TYR C 3 568 ? 48.904 98.367 100.336 1.00 9.30 ? 568 TYR C CA 1 +ATOM 7543 C C . TYR C 3 568 ? 47.889 97.236 100.302 1.00 8.86 ? 568 TYR C C 1 +ATOM 7544 O O . TYR C 3 568 ? 46.858 97.247 100.998 1.00 8.10 ? 568 TYR C O 1 +ATOM 7545 C CB . TYR C 3 568 ? 50.270 97.838 100.840 1.00 9.74 ? 568 TYR C CB 1 +ATOM 7546 C CG . TYR C 3 568 ? 51.333 98.913 100.922 1.00 11.03 ? 568 TYR C CG 1 +ATOM 7547 C CD1 . TYR C 3 568 ? 51.582 99.603 102.120 1.00 12.05 ? 568 TYR C CD1 1 +ATOM 7548 C CD2 . TYR C 3 568 ? 52.072 99.259 99.794 1.00 12.45 ? 568 TYR C CD2 1 +ATOM 7549 C CE1 . TYR C 3 568 ? 52.560 100.621 102.180 1.00 13.62 ? 568 TYR C CE1 1 +ATOM 7550 C CE2 . TYR C 3 568 ? 53.028 100.266 99.840 1.00 13.89 ? 568 TYR C CE2 1 +ATOM 7551 C CZ . TYR C 3 568 ? 53.266 100.937 101.028 1.00 14.38 ? 568 TYR C CZ 1 +ATOM 7552 O OH . TYR C 3 568 ? 54.228 101.899 101.030 1.00 15.65 ? 568 TYR C OH 1 +ATOM 7553 N N . LYS C 3 569 ? 48.194 96.259 99.465 1.00 8.54 ? 569 LYS C N 1 +ATOM 7554 C CA . LYS C 3 569 ? 47.339 95.124 99.321 1.00 9.56 ? 569 LYS C CA 1 +ATOM 7555 C C . LYS C 3 569 ? 48.154 93.860 99.426 1.00 9.22 ? 569 LYS C C 1 +ATOM 7556 O O . LYS C 3 569 ? 49.088 93.649 98.655 1.00 8.98 ? 569 LYS C O 1 +ATOM 7557 C CB . LYS C 3 569 ? 46.590 95.161 97.993 1.00 9.58 ? 569 LYS C CB 1 +ATOM 7558 C CG . LYS C 3 569 ? 45.460 94.132 97.983 1.00 13.78 ? 569 LYS C CG 1 +ATOM 7559 C CD . LYS C 3 569 ? 44.722 93.978 96.620 1.00 17.38 ? 569 LYS C CD 1 +ATOM 7560 C CE . LYS C 3 569 ? 43.805 95.153 96.308 1.00 18.53 ? 569 LYS C CE 1 +ATOM 7561 N NZ . LYS C 3 569 ? 43.324 95.132 94.886 1.00 19.40 ? 569 LYS C NZ 1 +ATOM 7562 N N . ASP C 3 570 ? 47.823 93.035 100.407 1.00 9.18 ? 570 ASP C N 1 +ATOM 7563 C CA . ASP C 3 570 ? 48.308 91.674 100.376 1.00 9.48 ? 570 ASP C CA 1 +ATOM 7564 C C . ASP C 3 570 ? 47.147 90.775 99.926 1.00 9.59 ? 570 ASP C C 1 +ATOM 7565 O O . ASP C 3 570 ? 46.358 90.305 100.735 1.00 9.63 ? 570 ASP C O 1 +ATOM 7566 C CB . ASP C 3 570 ? 48.921 91.241 101.702 1.00 9.44 ? 570 ASP C CB 1 +ATOM 7567 C CG . ASP C 3 570 ? 49.668 89.902 101.580 1.00 11.75 ? 570 ASP C CG 1 +ATOM 7568 O OD1 . ASP C 3 570 ? 49.568 89.214 100.526 1.00 14.83 ? 570 ASP C OD1 1 +ATOM 7569 O OD2 . ASP C 3 570 ? 50.363 89.435 102.491 1.00 13.24 ? 570 ASP C OD2 1 +ATOM 7570 N N . PRO C 3 571 ? 47.051 90.534 98.626 1.00 9.49 ? 571 PRO C N 1 +ATOM 7571 C CA . PRO C 3 571 ? 45.813 90.029 98.026 1.00 9.65 ? 571 PRO C CA 1 +ATOM 7572 C C . PRO C 3 571 ? 45.322 88.718 98.678 1.00 11.11 ? 571 PRO C C 1 +ATOM 7573 O O . PRO C 3 571 ? 46.120 87.782 98.839 1.00 11.46 ? 571 PRO C O 1 +ATOM 7574 C CB . PRO C 3 571 ? 46.231 89.755 96.577 1.00 8.94 ? 571 PRO C CB 1 +ATOM 7575 C CG . PRO C 3 571 ? 47.440 90.533 96.334 1.00 6.55 ? 571 PRO C CG 1 +ATOM 7576 C CD . PRO C 3 571 ? 48.149 90.621 97.643 1.00 9.16 ? 571 PRO C CD 1 +ATOM 7577 N N . PRO C 3 572 ? 44.021 88.601 98.949 1.00 11.73 ? 572 PRO C N 1 +ATOM 7578 C CA . PRO C 3 572 ? 42.995 89.555 98.487 1.00 12.29 ? 572 PRO C CA 1 +ATOM 7579 C C . PRO C 3 572 ? 42.749 90.788 99.365 1.00 13.36 ? 572 PRO C C 1 +ATOM 7580 O O . PRO C 3 572 ? 41.803 91.558 99.045 1.00 13.33 ? 572 PRO C O 1 +ATOM 7581 C CB . PRO C 3 572 ? 41.745 88.696 98.527 1.00 12.50 ? 572 PRO C CB 1 +ATOM 7582 C CG . PRO C 3 572 ? 41.984 87.851 99.752 1.00 11.91 ? 572 PRO C CG 1 +ATOM 7583 C CD . PRO C 3 572 ? 43.426 87.461 99.659 1.00 11.06 ? 572 PRO C CD 1 +ATOM 7584 N N . PHE C 3 573 ? 43.559 90.961 100.427 1.00 13.34 ? 573 PHE C N 1 +ATOM 7585 C CA . PHE C 3 573 ? 43.360 92.008 101.445 1.00 12.63 ? 573 PHE C CA 1 +ATOM 7586 C C . PHE C 3 573 ? 44.151 93.298 101.342 1.00 12.63 ? 573 PHE C C 1 +ATOM 7587 O O . PHE C 3 573 ? 45.377 93.285 101.127 1.00 12.10 ? 573 PHE C O 1 +ATOM 7588 C CB . PHE C 3 573 ? 43.645 91.455 102.818 1.00 12.01 ? 573 PHE C CB 1 +ATOM 7589 C CG . PHE C 3 573 ? 42.875 90.228 103.123 1.00 12.51 ? 573 PHE C CG 1 +ATOM 7590 C CD1 . PHE C 3 573 ? 43.516 88.986 103.139 1.00 7.76 ? 573 PHE C CD1 1 +ATOM 7591 C CD2 . PHE C 3 573 ? 41.497 90.305 103.387 1.00 9.69 ? 573 PHE C CD2 1 +ATOM 7592 C CE1 . PHE C 3 573 ? 42.814 87.859 103.403 1.00 7.91 ? 573 PHE C CE1 1 +ATOM 7593 C CE2 . PHE C 3 573 ? 40.790 89.166 103.653 1.00 8.53 ? 573 PHE C CE2 1 +ATOM 7594 C CZ . PHE C 3 573 ? 41.443 87.942 103.661 1.00 9.40 ? 573 PHE C CZ 1 +ATOM 7595 N N . CYS C 3 574 ? 43.434 94.405 101.561 1.00 11.87 ? 574 CYS C N 1 +ATOM 7596 C CA . CYS C 3 574 ? 44.057 95.669 101.837 1.00 11.55 ? 574 CYS C CA 1 +ATOM 7597 C C . CYS C 3 574 ? 44.684 95.627 103.216 1.00 12.45 ? 574 CYS C C 1 +ATOM 7598 O O . CYS C 3 574 ? 44.047 95.203 104.179 1.00 13.15 ? 574 CYS C O 1 +ATOM 7599 C CB . CYS C 3 574 ? 42.989 96.714 101.881 1.00 12.31 ? 574 CYS C CB 1 +ATOM 7600 S SG . CYS C 3 574 ? 42.208 96.911 100.312 1.00 9.30 ? 574 CYS C SG 1 +ATOM 7601 N N . VAL C 3 575 ? 45.923 96.085 103.349 1.00 12.62 ? 575 VAL C N 1 +ATOM 7602 C CA . VAL C 3 575 ? 46.551 96.072 104.653 1.00 12.58 ? 575 VAL C CA 1 +ATOM 7603 C C . VAL C 3 575 ? 47.327 97.360 104.879 1.00 13.83 ? 575 VAL C C 1 +ATOM 7604 O O . VAL C 3 575 ? 47.824 97.975 103.911 1.00 14.44 ? 575 VAL C O 1 +ATOM 7605 C CB . VAL C 3 575 ? 47.488 94.857 104.842 1.00 12.24 ? 575 VAL C CB 1 +ATOM 7606 C CG1 . VAL C 3 575 ? 46.702 93.582 104.986 1.00 11.34 ? 575 VAL C CG1 1 +ATOM 7607 C CG2 . VAL C 3 575 ? 48.484 94.760 103.717 1.00 11.66 ? 575 VAL C CG2 1 +ATOM 7608 N N . ALA C 3 576 ? 47.430 97.759 106.143 1.00 13.89 ? 576 ALA C N 1 +ATOM 7609 C CA . ALA C 3 576 ? 48.300 98.855 106.527 1.00 15.52 ? 576 ALA C CA 1 +ATOM 7610 C C . ALA C 3 576 ? 49.741 98.635 106.049 1.00 16.51 ? 576 ALA C C 1 +ATOM 7611 O O . ALA C 3 576 ? 50.242 99.353 105.183 1.00 16.90 ? 576 ALA C O 1 +ATOM 7612 C CB . ALA C 3 576 ? 48.246 99.049 108.045 1.00 15.41 ? 576 ALA C CB 1 +ATOM 7613 N N . ARG C 3 577 ? 50.399 97.618 106.585 1.00 17.82 ? 577 ARG C N 1 +ATOM 7614 C CA . ARG C 3 577 ? 51.783 97.349 106.228 1.00 19.28 ? 577 ARG C CA 1 +ATOM 7615 C C . ARG C 3 577 ? 51.937 96.017 105.481 1.00 19.82 ? 577 ARG C C 1 +ATOM 7616 O O . ARG C 3 577 ? 51.118 95.100 105.638 1.00 20.14 ? 577 ARG C O 1 +ATOM 7617 C CB . ARG C 3 577 ? 52.653 97.325 107.488 1.00 19.63 ? 577 ARG C CB 1 +ATOM 7618 C CG . ARG C 3 577 ? 52.504 98.539 108.418 1.00 23.17 ? 577 ARG C CG 1 +ATOM 7619 C CD . ARG C 3 577 ? 53.614 98.670 109.477 1.00 27.54 ? 577 ARG C CD 1 +ATOM 7620 N NE . ARG C 3 577 ? 53.359 99.769 110.423 1.00 30.04 ? 577 ARG C NE 1 +ATOM 7621 C CZ . ARG C 3 577 ? 54.284 100.282 111.243 1.00 31.14 ? 577 ARG C CZ 1 +ATOM 7622 N NH1 . ARG C 3 577 ? 55.523 99.797 111.233 1.00 32.75 ? 577 ARG C NH1 1 +ATOM 7623 N NH2 . ARG C 3 577 ? 53.985 101.281 112.073 1.00 31.06 ? 577 ARG C NH2 1 +ATOM 7624 N N . CYS C 3 578 ? 52.980 95.915 104.662 1.00 20.32 ? 578 CYS C N 1 +ATOM 7625 C CA . CYS C 3 578 ? 53.492 94.609 104.253 1.00 21.57 ? 578 CYS C CA 1 +ATOM 7626 C C . CYS C 3 578 ? 53.979 93.838 105.493 1.00 21.02 ? 578 CYS C C 1 +ATOM 7627 O O . CYS C 3 578 ? 54.621 94.426 106.366 1.00 21.14 ? 578 CYS C O 1 +ATOM 7628 C CB . CYS C 3 578 ? 54.647 94.768 103.254 1.00 21.78 ? 578 CYS C CB 1 +ATOM 7629 S SG . CYS C 3 578 ? 54.080 95.114 101.569 1.00 25.63 ? 578 CYS C SG 1 +ATOM 7630 N N . PRO C 3 579 ? 53.640 92.552 105.594 1.00 20.84 ? 579 PRO C N 1 +ATOM 7631 C CA . PRO C 3 579 ? 54.069 91.716 106.730 1.00 20.71 ? 579 PRO C CA 1 +ATOM 7632 C C . PRO C 3 579 ? 55.576 91.554 106.827 1.00 21.03 ? 579 PRO C C 1 +ATOM 7633 O O . PRO C 3 579 ? 56.217 91.234 105.822 1.00 20.71 ? 579 PRO C O 1 +ATOM 7634 C CB . PRO C 3 579 ? 53.415 90.361 106.451 1.00 20.56 ? 579 PRO C CB 1 +ATOM 7635 C CG . PRO C 3 579 ? 52.325 90.653 105.474 1.00 20.75 ? 579 PRO C CG 1 +ATOM 7636 C CD . PRO C 3 579 ? 52.773 91.819 104.654 1.00 20.51 ? 579 PRO C CD 1 +ATOM 7637 N N . SER C 3 580 ? 56.119 91.789 108.026 1.00 21.51 ? 580 SER C N 1 +ATOM 7638 C CA . SER C 3 580 ? 57.553 91.642 108.287 1.00 22.12 ? 580 SER C CA 1 +ATOM 7639 C C . SER C 3 580 ? 57.830 91.261 109.739 1.00 22.31 ? 580 SER C C 1 +ATOM 7640 O O . SER C 3 580 ? 57.000 90.631 110.396 1.00 22.59 ? 580 SER C O 1 +ATOM 7641 C CB . SER C 3 580 ? 58.309 92.925 107.926 1.00 22.19 ? 580 SER C CB 1 +ATOM 7642 O OG . SER C 3 580 ? 57.508 94.068 108.179 1.00 22.76 ? 580 SER C OG 1 +ATOM 7643 N N . ILE C 3 591 ? 57.266 84.313 106.889 1.00 22.81 ? 591 ILE C N 1 +ATOM 7644 C CA . ILE C 3 591 ? 56.507 85.392 106.242 1.00 22.62 ? 591 ILE C CA 1 +ATOM 7645 C C . ILE C 3 591 ? 57.183 86.774 106.326 1.00 22.39 ? 591 ILE C C 1 +ATOM 7646 O O . ILE C 3 591 ? 57.017 87.507 107.302 1.00 22.98 ? 591 ILE C O 1 +ATOM 7647 C CB . ILE C 3 591 ? 55.049 85.487 106.792 1.00 22.90 ? 591 ILE C CB 1 +ATOM 7648 C CG1 . ILE C 3 591 ? 54.556 84.142 107.358 1.00 23.02 ? 591 ILE C CG1 1 +ATOM 7649 C CG2 . ILE C 3 591 ? 54.108 86.073 105.722 1.00 22.50 ? 591 ILE C CG2 1 +ATOM 7650 C CD1 . ILE C 3 591 ? 54.641 84.039 108.902 1.00 23.64 ? 591 ILE C CD1 1 +ATOM 7651 N N . TRP C 3 592 ? 57.938 87.122 105.293 1.00 21.76 ? 592 TRP C N 1 +ATOM 7652 C CA . TRP C 3 592 ? 58.471 88.469 105.131 1.00 21.13 ? 592 TRP C CA 1 +ATOM 7653 C C . TRP C 3 592 ? 58.118 88.957 103.731 1.00 19.90 ? 592 TRP C C 1 +ATOM 7654 O O . TRP C 3 592 ? 58.497 88.330 102.730 1.00 19.94 ? 592 TRP C O 1 +ATOM 7655 C CB . TRP C 3 592 ? 59.988 88.484 105.302 1.00 21.63 ? 592 TRP C CB 1 +ATOM 7656 C CG . TRP C 3 592 ? 60.457 87.986 106.608 1.00 24.21 ? 592 TRP C CG 1 +ATOM 7657 C CD1 . TRP C 3 592 ? 60.712 86.692 106.939 1.00 26.61 ? 592 TRP C CD1 1 +ATOM 7658 C CD2 . TRP C 3 592 ? 60.757 88.767 107.774 1.00 27.26 ? 592 TRP C CD2 1 +ATOM 7659 N NE1 . TRP C 3 592 ? 61.149 86.610 108.241 1.00 28.69 ? 592 TRP C NE1 1 +ATOM 7660 C CE2 . TRP C 3 592 ? 61.187 87.869 108.781 1.00 28.23 ? 592 TRP C CE2 1 +ATOM 7661 C CE3 . TRP C 3 592 ? 60.704 90.138 108.077 1.00 28.42 ? 592 TRP C CE3 1 +ATOM 7662 C CZ2 . TRP C 3 592 ? 61.563 88.293 110.067 1.00 28.92 ? 592 TRP C CZ2 1 +ATOM 7663 C CZ3 . TRP C 3 592 ? 61.072 90.562 109.359 1.00 29.39 ? 592 TRP C CZ3 1 +ATOM 7664 C CH2 . TRP C 3 592 ? 61.499 89.638 110.336 1.00 29.69 ? 592 TRP C CH2 1 +ATOM 7665 N N . LYS C 3 593 ? 57.408 90.077 103.653 1.00 18.18 ? 593 LYS C N 1 +ATOM 7666 C CA . LYS C 3 593 ? 56.968 90.592 102.362 1.00 16.72 ? 593 LYS C CA 1 +ATOM 7667 C C . LYS C 3 593 ? 57.314 92.059 102.157 1.00 16.16 ? 593 LYS C C 1 +ATOM 7668 O O . LYS C 3 593 ? 57.558 92.776 103.127 1.00 15.59 ? 593 LYS C O 1 +ATOM 7669 C CB . LYS C 3 593 ? 55.469 90.387 102.212 1.00 16.62 ? 593 LYS C CB 1 +ATOM 7670 C CG . LYS C 3 593 ? 55.075 88.952 101.951 1.00 15.74 ? 593 LYS C CG 1 +ATOM 7671 C CD . LYS C 3 593 ? 53.629 88.720 102.327 1.00 13.18 ? 593 LYS C CD 1 +ATOM 7672 C CE . LYS C 3 593 ? 52.878 88.157 101.159 1.00 11.24 ? 593 LYS C CE 1 +ATOM 7673 N NZ . LYS C 3 593 ? 51.612 87.630 101.649 1.00 10.50 ? 593 LYS C NZ 1 +ATOM 7674 N N . PHE C 3 594 ? 57.334 92.489 100.896 1.00 15.61 ? 594 PHE C N 1 +ATOM 7675 C CA . PHE C 3 594 ? 57.690 93.858 100.529 1.00 15.48 ? 594 PHE C CA 1 +ATOM 7676 C C . PHE C 3 594 ? 56.732 94.451 99.489 1.00 16.35 ? 594 PHE C C 1 +ATOM 7677 O O . PHE C 3 594 ? 56.157 93.728 98.688 1.00 15.94 ? 594 PHE C O 1 +ATOM 7678 C CB . PHE C 3 594 ? 59.147 93.943 100.054 1.00 14.65 ? 594 PHE C CB 1 +ATOM 7679 C CG . PHE C 3 594 ? 59.362 93.466 98.654 1.00 13.21 ? 594 PHE C CG 1 +ATOM 7680 C CD1 . PHE C 3 594 ? 59.336 94.357 97.585 1.00 12.62 ? 594 PHE C CD1 1 +ATOM 7681 C CD2 . PHE C 3 594 ? 59.603 92.122 98.391 1.00 12.76 ? 594 PHE C CD2 1 +ATOM 7682 C CE1 . PHE C 3 594 ? 59.519 93.914 96.271 1.00 9.75 ? 594 PHE C CE1 1 +ATOM 7683 C CE2 . PHE C 3 594 ? 59.814 91.672 97.085 1.00 10.76 ? 594 PHE C CE2 1 +ATOM 7684 C CZ . PHE C 3 594 ? 59.766 92.570 96.026 1.00 10.73 ? 594 PHE C CZ 1 +ATOM 7685 N N . PRO C 3 595 ? 56.530 95.766 99.542 1.00 17.53 ? 595 PRO C N 1 +ATOM 7686 C CA . PRO C 3 595 ? 55.698 96.480 98.578 1.00 18.55 ? 595 PRO C CA 1 +ATOM 7687 C C . PRO C 3 595 ? 56.168 96.335 97.150 1.00 20.11 ? 595 PRO C C 1 +ATOM 7688 O O . PRO C 3 595 ? 57.308 96.677 96.837 1.00 20.44 ? 595 PRO C O 1 +ATOM 7689 C CB . PRO C 3 595 ? 55.911 97.934 98.972 1.00 18.54 ? 595 PRO C CB 1 +ATOM 7690 C CG . PRO C 3 595 ? 56.301 97.898 100.381 1.00 17.78 ? 595 PRO C CG 1 +ATOM 7691 C CD . PRO C 3 595 ? 57.047 96.665 100.585 1.00 17.44 ? 595 PRO C CD 1 +ATOM 7692 N N . ASP C 3 596 ? 55.284 95.824 96.305 1.00 21.96 ? 596 ASP C N 1 +ATOM 7693 C CA . ASP C 3 596 ? 55.330 95.973 94.847 1.00 23.62 ? 596 ASP C CA 1 +ATOM 7694 C C . ASP C 3 596 ? 55.413 97.442 94.493 1.00 23.74 ? 596 ASP C C 1 +ATOM 7695 O O . ASP C 3 596 ? 55.155 98.289 95.351 1.00 24.05 ? 596 ASP C O 1 +ATOM 7696 C CB . ASP C 3 596 ? 53.956 95.556 94.328 1.00 24.42 ? 596 ASP C CB 1 +ATOM 7697 C CG . ASP C 3 596 ? 54.009 94.933 92.986 1.00 27.58 ? 596 ASP C CG 1 +ATOM 7698 O OD1 . ASP C 3 596 ? 55.101 94.423 92.638 1.00 31.83 ? 596 ASP C OD1 1 +ATOM 7699 O OD2 . ASP C 3 596 ? 53.008 94.889 92.224 1.00 30.07 ? 596 ASP C OD2 1 +ATOM 7700 N N . GLU C 3 597 ? 55.652 97.747 93.219 1.00 23.95 ? 597 GLU C N 1 +ATOM 7701 C CA . GLU C 3 597 ? 55.429 99.108 92.725 1.00 24.72 ? 597 GLU C CA 1 +ATOM 7702 C C . GLU C 3 597 ? 53.953 99.522 92.622 1.00 24.47 ? 597 GLU C C 1 +ATOM 7703 O O . GLU C 3 597 ? 53.619 100.705 92.713 1.00 24.65 ? 597 GLU C O 1 +ATOM 7704 C CB . GLU C 3 597 ? 56.104 99.332 91.390 1.00 25.00 ? 597 GLU C CB 1 +ATOM 7705 C CG . GLU C 3 597 ? 56.888 100.631 91.393 1.00 29.69 ? 597 GLU C CG 1 +ATOM 7706 C CD . GLU C 3 597 ? 56.495 101.598 90.278 1.00 33.91 ? 597 GLU C CD 1 +ATOM 7707 O OE1 . GLU C 3 597 ? 56.340 101.122 89.109 1.00 35.10 ? 597 GLU C OE1 1 +ATOM 7708 O OE2 . GLU C 3 597 ? 56.374 102.828 90.577 1.00 32.12 ? 597 GLU C OE2 1 +ATOM 7709 N N . GLU C 3 598 ? 53.065 98.557 92.427 1.00 24.28 ? 598 GLU C N 1 +ATOM 7710 C CA . GLU C 3 598 ? 51.640 98.849 92.344 1.00 24.15 ? 598 GLU C CA 1 +ATOM 7711 C C . GLU C 3 598 ? 51.021 98.913 93.737 1.00 22.63 ? 598 GLU C C 1 +ATOM 7712 O O . GLU C 3 598 ? 49.828 99.161 93.867 1.00 22.50 ? 598 GLU C O 1 +ATOM 7713 C CB . GLU C 3 598 ? 50.925 97.760 91.537 1.00 25.50 ? 598 GLU C CB 1 +ATOM 7714 C CG . GLU C 3 598 ? 51.140 97.790 90.019 1.00 29.59 ? 598 GLU C CG 1 +ATOM 7715 C CD . GLU C 3 598 ? 50.480 96.589 89.357 1.00 35.53 ? 598 GLU C CD 1 +ATOM 7716 O OE1 . GLU C 3 598 ? 49.907 95.769 90.118 1.00 39.82 ? 598 GLU C OE1 1 +ATOM 7717 O OE2 . GLU C 3 598 ? 50.516 96.447 88.106 1.00 36.66 ? 598 GLU C OE2 1 +ATOM 7718 N N . GLY C 3 599 ? 51.831 98.678 94.767 1.00 21.24 ? 599 GLY C N 1 +ATOM 7719 C CA . GLY C 3 599 ? 51.362 98.606 96.134 1.00 19.70 ? 599 GLY C CA 1 +ATOM 7720 C C . GLY C 3 599 ? 50.978 97.227 96.662 1.00 19.29 ? 599 GLY C C 1 +ATOM 7721 O O . GLY C 3 599 ? 50.442 97.133 97.757 1.00 19.58 ? 599 GLY C O 1 +ATOM 7722 N N . ALA C 3 600 ? 51.258 96.151 95.930 1.00 18.18 ? 600 ALA C N 1 +ATOM 7723 C CA . ALA C 3 600 ? 50.916 94.827 96.434 1.00 17.67 ? 600 ALA C CA 1 +ATOM 7724 C C . ALA C 3 600 ? 52.100 94.037 97.001 1.00 16.86 ? 600 ALA C C 1 +ATOM 7725 O O . ALA C 3 600 ? 53.144 93.958 96.398 1.00 17.24 ? 600 ALA C O 1 +ATOM 7726 C CB . ALA C 3 600 ? 50.164 94.010 95.361 1.00 17.79 ? 600 ALA C CB 1 +ATOM 7727 N N . CYS C 3 601 ? 51.916 93.426 98.157 1.00 16.04 ? 601 CYS C N 1 +ATOM 7728 C CA . CYS C 3 601 ? 53.000 92.730 98.825 1.00 15.16 ? 601 CYS C CA 1 +ATOM 7729 C C . CYS C 3 601 ? 53.457 91.478 98.089 1.00 14.79 ? 601 CYS C C 1 +ATOM 7730 O O . CYS C 3 601 ? 52.666 90.542 97.877 1.00 14.02 ? 601 CYS C O 1 +ATOM 7731 C CB . CYS C 3 601 ? 52.577 92.350 100.226 1.00 15.21 ? 601 CYS C CB 1 +ATOM 7732 S SG . CYS C 3 601 ? 51.639 93.640 101.062 1.00 16.38 ? 601 CYS C SG 1 +ATOM 7733 N N . GLN C 3 602 ? 54.735 91.491 97.692 1.00 14.07 ? 602 GLN C N 1 +ATOM 7734 C CA . GLN C 3 602 ? 55.430 90.312 97.178 1.00 13.62 ? 602 GLN C CA 1 +ATOM 7735 C C . GLN C 3 602 ? 56.232 89.734 98.310 1.00 13.49 ? 602 GLN C C 1 +ATOM 7736 O O . GLN C 3 602 ? 56.551 90.448 99.232 1.00 13.71 ? 602 GLN C O 1 +ATOM 7737 C CB . GLN C 3 602 ? 56.387 90.663 96.045 1.00 13.22 ? 602 GLN C CB 1 +ATOM 7738 C CG . GLN C 3 602 ? 55.835 91.568 94.959 1.00 12.23 ? 602 GLN C CG 1 +ATOM 7739 C CD . GLN C 3 602 ? 54.414 91.242 94.541 1.00 9.83 ? 602 GLN C CD 1 +ATOM 7740 O OE1 . GLN C 3 602 ? 54.139 90.133 94.081 1.00 7.30 ? 602 GLN C OE1 1 +ATOM 7741 N NE2 . GLN C 3 602 ? 53.509 92.218 94.686 1.00 5.78 ? 602 GLN C NE2 1 +ATOM 7742 N N . PRO C 3 603 ? 56.525 88.441 98.269 1.00 13.72 ? 603 PRO C N 1 +ATOM 7743 C CA . PRO C 3 603 ? 57.368 87.802 99.287 1.00 14.10 ? 603 PRO C CA 1 +ATOM 7744 C C . PRO C 3 603 ? 58.835 88.124 99.054 1.00 14.27 ? 603 PRO C C 1 +ATOM 7745 O O . PRO C 3 603 ? 59.251 88.253 97.895 1.00 14.22 ? 603 PRO C O 1 +ATOM 7746 C CB . PRO C 3 603 ? 57.114 86.302 99.061 1.00 14.27 ? 603 PRO C CB 1 +ATOM 7747 C CG . PRO C 3 603 ? 55.912 86.278 98.209 1.00 14.14 ? 603 PRO C CG 1 +ATOM 7748 C CD . PRO C 3 603 ? 56.027 87.464 97.292 1.00 13.58 ? 603 PRO C CD 1 +ATOM 7749 N N . CYS C 3 604 ? 59.601 88.251 100.136 1.00 14.51 ? 604 CYS C N 1 +ATOM 7750 C CA . CYS C 3 604 ? 61.011 88.585 100.018 1.00 14.53 ? 604 CYS C CA 1 +ATOM 7751 C C . CYS C 3 604 ? 61.629 87.334 99.480 1.00 15.83 ? 604 CYS C C 1 +ATOM 7752 O O . CYS C 3 604 ? 61.231 86.241 99.897 1.00 16.04 ? 604 CYS C O 1 +ATOM 7753 C CB . CYS C 3 604 ? 61.613 88.966 101.370 1.00 14.18 ? 604 CYS C CB 1 +ATOM 7754 S SG . CYS C 3 604 ? 61.240 90.655 101.929 1.00 12.07 ? 604 CYS C SG 1 +ATOM 7755 N N . PRO C 3 605 ? 62.550 87.476 98.520 1.00 16.92 ? 605 PRO C N 1 +ATOM 7756 C CA . PRO C 3 605 ? 63.204 86.317 97.906 1.00 17.63 ? 605 PRO C CA 1 +ATOM 7757 C C . PRO C 3 605 ? 64.218 85.703 98.846 1.00 18.34 ? 605 PRO C C 1 +ATOM 7758 O O . PRO C 3 605 ? 64.581 84.540 98.651 1.00 18.35 ? 605 PRO C O 1 +ATOM 7759 C CB . PRO C 3 605 ? 63.881 86.905 96.659 1.00 17.54 ? 605 PRO C CB 1 +ATOM 7760 C CG . PRO C 3 605 ? 63.228 88.264 96.487 1.00 17.53 ? 605 PRO C CG 1 +ATOM 7761 C CD . PRO C 3 605 ? 63.014 88.736 97.910 1.00 17.02 ? 605 PRO C CD 1 +ATOM 7762 N N . ILE C 3 606 ? 64.657 86.453 99.853 1.00 19.13 ? 606 ILE C N 1 +ATOM 7763 C CA . ILE C 3 606 ? 65.597 85.886 100.826 1.00 20.02 ? 606 ILE C CA 1 +ATOM 7764 C C . ILE C 3 606 ? 64.904 85.543 102.160 1.00 20.52 ? 606 ILE C C 1 +ATOM 7765 O O . ILE C 3 606 ? 64.034 86.290 102.650 1.00 20.26 ? 606 ILE C O 1 +ATOM 7766 C CB . ILE C 3 606 ? 66.911 86.741 100.954 1.00 20.02 ? 606 ILE C CB 1 +ATOM 7767 C CG1 . ILE C 3 606 ? 67.839 86.465 99.755 1.00 19.84 ? 606 ILE C CG1 1 +ATOM 7768 C CG2 . ILE C 3 606 ? 67.639 86.486 102.286 1.00 20.01 ? 606 ILE C CG2 1 +ATOM 7769 C CD1 . ILE C 3 606 ? 68.954 87.497 99.543 1.00 20.24 ? 606 ILE C CD1 1 +ATOM 7770 N N . ASN C 3 607 ? 65.325 84.404 102.716 1.00 21.10 ? 607 ASN C N 1 +ATOM 7771 C CA . ASN C 3 607 ? 64.550 83.606 103.676 1.00 21.66 ? 607 ASN C CA 1 +ATOM 7772 C C . ASN C 3 607 ? 64.108 84.278 104.987 1.00 21.66 ? 607 ASN C C 1 +ATOM 7773 O O . ASN C 3 607 ? 64.896 84.564 105.900 1.00 21.49 ? 607 ASN C O 1 +ATOM 7774 C CB . ASN C 3 607 ? 65.271 82.260 103.949 1.00 21.71 ? 607 ASN C CB 1 +ATOM 7775 C CG . ASN C 3 607 ? 64.547 81.060 103.319 1.00 22.18 ? 607 ASN C CG 1 +ATOM 7776 O OD1 . ASN C 3 607 ? 63.315 80.933 103.407 1.00 24.13 ? 607 ASN C OD1 1 +ATOM 7777 N ND2 . ASN C 3 607 ? 65.306 80.182 102.685 1.00 20.94 ? 607 ASN C ND2 1 +ATOM 7778 O OXT . ASN C 3 607 ? 62.914 84.542 105.150 1.00 21.82 ? 607 ASN C OXT 1 +HETATM 7779 C C1 . NAG D 4 . ? -28.886 90.757 158.857 1.00 48.95 ? 766 NAG C C1 1 +HETATM 7780 C C2 . NAG D 4 . ? -29.560 92.088 159.238 1.00 54.02 ? 766 NAG C C2 1 +HETATM 7781 C C3 . NAG D 4 . ? -28.564 93.196 159.593 1.00 55.27 ? 766 NAG C C3 1 +HETATM 7782 C C4 . NAG D 4 . ? -27.515 92.618 160.561 1.00 55.75 ? 766 NAG C C4 1 +HETATM 7783 C C5 . NAG D 4 . ? -26.885 91.398 159.842 1.00 57.25 ? 766 NAG C C5 1 +HETATM 7784 C C6 . NAG D 4 . ? -25.479 90.895 160.269 1.00 58.86 ? 766 NAG C C6 1 +HETATM 7785 C C7 . NAG D 4 . ? -31.586 92.693 158.177 1.00 56.43 ? 766 NAG C C7 1 +HETATM 7786 C C8 . NAG D 4 . ? -32.456 91.559 157.696 1.00 54.14 ? 766 NAG C C8 1 +HETATM 7787 N N2 . NAG D 4 . ? -30.285 92.550 158.088 1.00 54.78 ? 766 NAG C N2 1 +HETATM 7788 O O3 . NAG D 4 . ? -29.241 94.396 159.987 1.00 55.40 ? 766 NAG C O3 1 +HETATM 7789 O O4 . NAG D 4 . ? -26.553 93.585 160.887 1.00 57.53 ? 766 NAG C O4 1 +HETATM 7790 O O5 . NAG D 4 . ? -27.884 90.372 159.801 1.00 55.28 ? 766 NAG C O5 1 +HETATM 7791 O O6 . NAG D 4 . ? -25.574 89.744 161.078 1.00 59.23 ? 766 NAG C O6 1 +HETATM 7792 O O7 . NAG D 4 . ? -32.030 93.720 158.658 1.00 58.65 ? 766 NAG C O7 1 +HETATM 7793 C C1 . NAG E 4 . ? -18.607 71.766 121.248 1.00 37.69 ? 738 NAG C C1 1 +HETATM 7794 C C2 . NAG E 4 . ? -19.883 72.341 121.855 1.00 40.66 ? 738 NAG C C2 1 +HETATM 7795 C C3 . NAG E 4 . ? -20.813 72.808 120.729 1.00 44.83 ? 738 NAG C C3 1 +HETATM 7796 C C4 . NAG E 4 . ? -20.110 73.531 119.564 1.00 46.04 ? 738 NAG C C4 1 +HETATM 7797 C C5 . NAG E 4 . ? -18.673 73.073 119.260 1.00 44.89 ? 738 NAG C C5 1 +HETATM 7798 C C6 . NAG E 4 . ? -17.875 74.139 118.506 1.00 46.16 ? 738 NAG C C6 1 +HETATM 7799 C C7 . NAG E 4 . ? -20.950 71.452 123.860 1.00 38.48 ? 738 NAG C C7 1 +HETATM 7800 C C8 . NAG E 4 . ? -21.803 70.345 124.404 1.00 33.52 ? 738 NAG C C8 1 +HETATM 7801 N N2 . NAG E 4 . ? -20.618 71.327 122.580 1.00 37.72 ? 738 NAG C N2 1 +HETATM 7802 O O3 . NAG E 4 . ? -21.812 73.649 121.283 1.00 44.11 ? 738 NAG C O3 1 +HETATM 7803 O O4 . NAG E 4 . ? -20.936 73.335 118.437 1.00 46.95 ? 738 NAG C O4 1 +HETATM 7804 O O5 . NAG E 4 . ? -17.951 72.751 120.444 1.00 43.03 ? 738 NAG C O5 1 +HETATM 7805 O O6 . NAG E 4 . ? -16.507 73.737 118.505 1.00 47.78 ? 738 NAG C O6 1 +HETATM 7806 O O7 . NAG E 4 . ? -20.599 72.396 124.590 1.00 40.20 ? 738 NAG C O7 1 +HETATM 7807 S S . SO4 F 5 . ? -3.826 108.773 129.959 1.00 61.34 ? 1001 SO4 C S 1 +HETATM 7808 O O1 . SO4 F 5 . ? -3.390 107.376 129.931 1.00 61.32 ? 1001 SO4 C O1 1 +HETATM 7809 O O2 . SO4 F 5 . ? -5.256 108.840 130.191 1.00 62.92 ? 1001 SO4 C O2 1 +HETATM 7810 O O3 . SO4 F 5 . ? -3.275 109.461 131.119 1.00 60.67 ? 1001 SO4 C O3 1 +HETATM 7811 O O4 . SO4 F 5 . ? -3.508 109.393 128.659 1.00 59.03 ? 1001 SO4 C O4 1 +HETATM 7812 O O . HOH G 6 . ? 49.267 70.929 100.565 1.00 29.62 ? 215 HOH A O 1 +HETATM 7813 O O . HOH G 6 . ? 54.949 64.650 92.534 1.00 34.60 ? 216 HOH A O 1 +HETATM 7814 O O . HOH G 6 . ? 37.527 52.571 85.088 1.00 52.15 ? 217 HOH A O 1 +HETATM 7815 O O . HOH G 6 . ? 53.774 82.162 82.165 1.00 28.15 ? 218 HOH A O 1 +HETATM 7816 O O . HOH G 6 . ? 55.140 66.635 94.787 1.00 35.96 ? 219 HOH A O 1 +HETATM 7817 O O . HOH G 6 . ? 58.991 46.840 82.930 1.00 47.15 ? 220 HOH A O 1 +HETATM 7818 O O . HOH G 6 . ? 47.267 64.858 96.023 1.00 37.10 ? 221 HOH A O 1 +HETATM 7819 O O . HOH G 6 . ? 64.521 68.097 95.278 1.00 39.62 ? 222 HOH A O 1 +HETATM 7820 O O . HOH G 6 . ? 33.752 29.938 98.369 1.00 28.02 ? 223 HOH A O 1 +HETATM 7821 O O . HOH G 6 . ? 54.000 67.196 96.978 1.00 30.83 ? 224 HOH A O 1 +HETATM 7822 O O . HOH G 6 . ? 47.244 68.759 100.920 1.00 42.17 ? 225 HOH A O 1 +HETATM 7823 O O . HOH G 6 . ? 60.945 79.252 95.597 1.00 42.76 ? 226 HOH A O 1 +HETATM 7824 O O . HOH G 6 . ? 57.495 63.499 75.603 1.00 26.48 ? 227 HOH A O 1 +HETATM 7825 O O . HOH G 6 . ? 63.309 67.592 92.179 1.00 40.17 ? 228 HOH A O 1 +HETATM 7826 O O . HOH G 6 . ? 41.346 65.928 89.632 1.00 39.10 ? 229 HOH A O 1 +HETATM 7827 O O . HOH G 6 . ? 44.454 63.524 101.024 1.00 39.41 ? 230 HOH A O 1 +HETATM 7828 O O . HOH G 6 . ? 48.973 63.246 102.091 1.00 42.31 ? 231 HOH A O 1 +HETATM 7829 O O . HOH G 6 . ? 43.673 80.457 97.933 1.00 45.83 ? 232 HOH A O 1 +HETATM 7830 O O . HOH G 6 . ? 41.836 31.976 89.527 1.00 80.12 ? 233 HOH A O 1 +HETATM 7831 O O . HOH H 6 . ? 29.128 85.831 100.031 1.00 25.25 ? 221 HOH B O 1 +HETATM 7832 O O . HOH H 6 . ? 42.868 49.805 98.128 1.00 26.32 ? 222 HOH B O 1 +HETATM 7833 O O . HOH H 6 . ? 40.482 51.315 99.172 1.00 22.49 ? 223 HOH B O 1 +HETATM 7834 O O . HOH H 6 . ? 33.380 79.222 93.468 1.00 30.75 ? 224 HOH B O 1 +HETATM 7835 O O . HOH H 6 . ? 24.176 81.031 102.831 1.00 49.31 ? 225 HOH B O 1 +HETATM 7836 O O . HOH H 6 . ? 37.949 52.084 94.352 1.00 31.40 ? 226 HOH B O 1 +HETATM 7837 O O . HOH H 6 . ? 27.633 57.390 94.957 1.00 41.93 ? 227 HOH B O 1 +HETATM 7838 O O . HOH H 6 . ? 43.902 41.032 108.609 1.00 27.69 ? 228 HOH B O 1 +HETATM 7839 O O . HOH H 6 . ? 33.577 33.361 105.473 1.00 33.15 ? 229 HOH B O 1 +HETATM 7840 O O . HOH H 6 . ? 18.189 60.646 92.581 1.00 42.05 ? 230 HOH B O 1 +HETATM 7841 O O . HOH H 6 . ? 26.798 82.929 106.987 1.00 37.25 ? 231 HOH B O 1 +HETATM 7842 O O . HOH H 6 . ? 32.858 53.733 103.266 1.00 38.46 ? 232 HOH B O 1 +HETATM 7843 O O . HOH H 6 . ? 34.229 59.929 102.856 1.00 45.60 ? 233 HOH B O 1 +HETATM 7844 O O . HOH I 6 . ? 12.300 53.530 120.312 1.00 58.15 ? 1002 HOH C O 1 +HETATM 7845 O O . HOH I 6 . ? -44.622 72.938 145.108 1.00 35.58 ? 1003 HOH C O 1 +HETATM 7846 O O . HOH I 6 . ? -13.918 91.259 139.102 1.00 30.87 ? 1004 HOH C O 1 +HETATM 7847 O O . HOH I 6 . ? -29.664 71.172 148.467 1.00 33.67 ? 1005 HOH C O 1 +HETATM 7848 O O . HOH I 6 . ? -37.562 87.306 154.041 1.00 30.13 ? 1006 HOH C O 1 +HETATM 7849 O O . HOH I 6 . ? 32.208 106.119 99.619 1.00 29.33 ? 1007 HOH C O 1 +HETATM 7850 O O . HOH I 6 . ? -6.846 57.996 120.831 1.00 22.88 ? 1008 HOH C O 1 +HETATM 7851 O O . HOH I 6 . ? 5.012 108.779 136.379 1.00 28.22 ? 1009 HOH C O 1 +HETATM 7852 O O . HOH I 6 . ? -12.698 69.483 113.999 1.00 25.89 ? 1010 HOH C O 1 +HETATM 7853 O O . HOH I 6 . ? -7.458 63.413 125.591 1.00 30.05 ? 1011 HOH C O 1 +HETATM 7854 O O . HOH I 6 . ? 29.271 108.159 115.042 1.00 39.01 ? 1012 HOH C O 1 +HETATM 7855 O O . HOH I 6 . ? -4.735 69.750 128.826 1.00 28.33 ? 1013 HOH C O 1 +HETATM 7856 O O . HOH I 6 . ? -8.778 95.760 137.489 1.00 27.35 ? 1014 HOH C O 1 +HETATM 7857 O O . HOH I 6 . ? -12.383 67.650 131.308 1.00 32.39 ? 1015 HOH C O 1 +HETATM 7858 O O . HOH I 6 . ? 30.173 89.898 103.586 1.00 28.72 ? 1016 HOH C O 1 +HETATM 7859 O O . HOH I 6 . ? 1.757 102.216 143.522 1.00 28.40 ? 1017 HOH C O 1 +HETATM 7860 O O . HOH I 6 . ? -3.303 83.896 129.898 1.00 33.95 ? 1018 HOH C O 1 +HETATM 7861 O O . HOH I 6 . ? -27.936 97.731 139.013 1.00 27.07 ? 1019 HOH C O 1 +HETATM 7862 O O . HOH I 6 . ? 16.852 108.135 126.378 1.00 44.78 ? 1020 HOH C O 1 +HETATM 7863 O O . HOH I 6 . ? 7.680 118.507 132.694 1.00 53.94 ? 1021 HOH C O 1 +HETATM 7864 O O . HOH I 6 . ? 16.089 93.542 129.825 1.00 28.23 ? 1022 HOH C O 1 +HETATM 7865 O O . HOH I 6 . ? -2.418 95.831 142.655 1.00 36.93 ? 1023 HOH C O 1 +HETATM 7866 O O . HOH I 6 . ? 24.517 110.104 111.021 1.00 37.72 ? 1024 HOH C O 1 +HETATM 7867 O O . HOH I 6 . ? 16.298 107.051 144.040 1.00 34.18 ? 1025 HOH C O 1 +HETATM 7868 O O . HOH I 6 . ? 54.020 93.775 89.425 1.00 49.99 ? 1026 HOH C O 1 +HETATM 7869 O O . HOH I 6 . ? -5.178 87.608 126.957 1.00 35.22 ? 1027 HOH C O 1 +HETATM 7870 O O . HOH I 6 . ? 19.105 97.627 103.661 1.00 35.25 ? 1028 HOH C O 1 +HETATM 7871 O O . HOH I 6 . ? -27.366 91.329 148.176 1.00 38.70 ? 1029 HOH C O 1 +HETATM 7872 O O . HOH I 6 . ? -17.309 64.316 127.979 1.00 32.17 ? 1030 HOH C O 1 +HETATM 7873 O O . HOH I 6 . ? 0.691 99.619 143.913 1.00 43.46 ? 1031 HOH C O 1 +HETATM 7874 O O . HOH I 6 . ? 18.679 81.944 130.784 1.00 41.80 ? 1032 HOH C O 1 +HETATM 7875 O O . HOH I 6 . ? 13.631 110.183 137.123 1.00 34.45 ? 1033 HOH C O 1 +HETATM 7876 O O . HOH I 6 . ? 15.741 96.356 119.587 1.00 42.93 ? 1034 HOH C O 1 +HETATM 7877 O O . HOH I 6 . ? -7.937 98.243 138.424 1.00 40.06 ? 1035 HOH C O 1 +HETATM 7878 O O . HOH I 6 . ? -24.740 59.045 120.826 1.00 38.32 ? 1036 HOH C O 1 +HETATM 7879 O O . HOH I 6 . ? -29.077 86.883 151.692 1.00 53.14 ? 1037 HOH C O 1 +HETATM 7880 O O . HOH I 6 . ? 8.891 46.404 118.543 1.00 42.08 ? 1038 HOH C O 1 +HETATM 7881 O O . HOH I 6 . ? -5.776 73.145 129.383 1.00 48.26 ? 1039 HOH C O 1 +HETATM 7882 O O . HOH I 6 . ? -18.993 71.437 127.170 1.00 27.64 ? 1040 HOH C O 1 +HETATM 7883 O O . HOH I 6 . ? -31.594 81.316 143.836 1.00 33.69 ? 1041 HOH C O 1 +HETATM 7884 O O . HOH I 6 . ? -14.247 72.418 120.859 1.00 41.56 ? 1042 HOH C O 1 +HETATM 7885 O O . HOH I 6 . ? 41.950 93.057 109.943 1.00 47.13 ? 1043 HOH C O 1 +HETATM 7886 O O . HOH I 6 . ? 11.857 112.728 120.704 1.00 26.05 ? 1044 HOH C O 1 +HETATM 7887 O O . HOH I 6 . ? 48.015 94.256 90.391 1.00 41.43 ? 1045 HOH C O 1 +HETATM 7888 O O . HOH I 6 . ? -10.424 64.005 114.857 1.00 38.99 ? 1046 HOH C O 1 +HETATM 7889 O O . HOH I 6 . ? 22.370 111.120 109.211 1.00 43.67 ? 1047 HOH C O 1 +HETATM 7890 O O . HOH I 6 . ? -8.677 87.855 148.931 1.00 42.40 ? 1048 HOH C O 1 +# diff --git a/tests/resources/1qys.cif b/tests/resources/1qys.cif new file mode 100644 index 0000000..b794d9a --- /dev/null +++ b/tests/resources/1qys.cif @@ -0,0 +1,2514 @@ +data_1QYS +# +_entry.id 1QYS +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.397 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 1QYS pdb_00001qys 10.2210/pdb1qys/pdb +RCSB RCSB020233 ? ? +WWPDB D_1000020233 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2003-11-25 +2 'Structure model' 1 1 2008-04-29 +3 'Structure model' 1 2 2011-07-13 +4 'Structure model' 1 3 2024-10-30 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Version format compliance' +3 4 'Structure model' 'Data collection' +4 4 'Structure model' 'Database references' +5 4 'Structure model' 'Derived calculations' +6 4 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 4 'Structure model' chem_comp_atom +2 4 'Structure model' chem_comp_bond +3 4 'Structure model' database_2 +4 4 'Structure model' pdbx_entry_details +5 4 'Structure model' pdbx_modification_feature +6 4 'Structure model' struct_conn +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 4 'Structure model' '_database_2.pdbx_DOI' +2 4 'Structure model' '_database_2.pdbx_database_accession' +3 4 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 1QYS +_pdbx_database_status.recvd_initial_deposition_date 2003-09-11 +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.SG_entry . +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.status_code_nmr_data ? +_pdbx_database_status.methods_development_category ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Kuhlman, B.' 1 +'Dantas, G.' 2 +'Ireton, G.C.' 3 +'Varani, G.' 4 +'Stoddard, B.L.' 5 +'Baker, D.' 6 +# +_citation.id primary +_citation.title 'Design of a Novel Globular Protein Fold with Atomic-Level Accuracy' +_citation.journal_abbrev Science +_citation.journal_volume 302 +_citation.page_first 1364 +_citation.page_last 1368 +_citation.year 2003 +_citation.journal_id_ASTM SCIEAS +_citation.country US +_citation.journal_id_ISSN 0036-8075 +_citation.journal_id_CSD 0038 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed 14631033 +_citation.pdbx_database_id_DOI 10.1126/science.1089427 +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Kuhlman, B.' 1 ? +primary 'Dantas, G.' 2 ? +primary 'Ireton, G.C.' 3 ? +primary 'Varani, G.' 4 ? +primary 'Stoddard, B.L.' 5 ? +primary 'Baker, D.' 6 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man TOP7 12130.249 1 ? ? ? ? +2 water nat water 18.015 7 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer yes +_entity_poly.pdbx_seq_one_letter_code +;(MSE)GDIQVQVNIDDNGKNFDYTYTVTTESELQKVLNEL(MSE)DYIKKQGAKRVRISITARTKKEAEKFAAILIKVFA +ELGYNDINVTFDGDTVTVEGQLEGGSLEHHHHHH +; +_entity_poly.pdbx_seq_one_letter_code_can +;MGDIQVQVNIDDNGKNFDYTYTVTTESELQKVLNELMDYIKKQGAKRVRISITARTKKEAEKFAAILIKVFAELGYNDIN +VTFDGDTVTVEGQLEGGSLEHHHHHH +; +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier ? +# +_pdbx_entity_nonpoly.entity_id 2 +_pdbx_entity_nonpoly.name water +_pdbx_entity_nonpoly.comp_id HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 MSE n +1 2 GLY n +1 3 ASP n +1 4 ILE n +1 5 GLN n +1 6 VAL n +1 7 GLN n +1 8 VAL n +1 9 ASN n +1 10 ILE n +1 11 ASP n +1 12 ASP n +1 13 ASN n +1 14 GLY n +1 15 LYS n +1 16 ASN n +1 17 PHE n +1 18 ASP n +1 19 TYR n +1 20 THR n +1 21 TYR n +1 22 THR n +1 23 VAL n +1 24 THR n +1 25 THR n +1 26 GLU n +1 27 SER n +1 28 GLU n +1 29 LEU n +1 30 GLN n +1 31 LYS n +1 32 VAL n +1 33 LEU n +1 34 ASN n +1 35 GLU n +1 36 LEU n +1 37 MSE n +1 38 ASP n +1 39 TYR n +1 40 ILE n +1 41 LYS n +1 42 LYS n +1 43 GLN n +1 44 GLY n +1 45 ALA n +1 46 LYS n +1 47 ARG n +1 48 VAL n +1 49 ARG n +1 50 ILE n +1 51 SER n +1 52 ILE n +1 53 THR n +1 54 ALA n +1 55 ARG n +1 56 THR n +1 57 LYS n +1 58 LYS n +1 59 GLU n +1 60 ALA n +1 61 GLU n +1 62 LYS n +1 63 PHE n +1 64 ALA n +1 65 ALA n +1 66 ILE n +1 67 LEU n +1 68 ILE n +1 69 LYS n +1 70 VAL n +1 71 PHE n +1 72 ALA n +1 73 GLU n +1 74 LEU n +1 75 GLY n +1 76 TYR n +1 77 ASN n +1 78 ASP n +1 79 ILE n +1 80 ASN n +1 81 VAL n +1 82 THR n +1 83 PHE n +1 84 ASP n +1 85 GLY n +1 86 ASP n +1 87 THR n +1 88 VAL n +1 89 THR n +1 90 VAL n +1 91 GLU n +1 92 GLY n +1 93 GLN n +1 94 LEU n +1 95 GLU n +1 96 GLY n +1 97 GLY n +1 98 SER n +1 99 LEU n +1 100 GLU n +1 101 HIS n +1 102 HIS n +1 103 HIS n +1 104 HIS n +1 105 HIS n +1 106 HIS n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Computationally Designed Sequence' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id ? +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 +_entity_src_gen.host_org_genus Escherichia +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain 'BL21(DE3) pLysS' +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type PLASMID +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name 'pet29b(+)' +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MSE 'L-peptide linking' n SELENOMETHIONINE ? 'C5 H11 N O2 Se' 196.106 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 MSE 1 1 ? ? ? A . n +A 1 2 GLY 2 2 ? ? ? A . n +A 1 3 ASP 3 3 3 ASP ASP A . n +A 1 4 ILE 4 4 4 ILE ILE A . n +A 1 5 GLN 5 5 5 GLN GLN A . n +A 1 6 VAL 6 6 6 VAL VAL A . n +A 1 7 GLN 7 7 7 GLN GLN A . n +A 1 8 VAL 8 8 8 VAL VAL A . n +A 1 9 ASN 9 9 9 ASN ASN A . n +A 1 10 ILE 10 10 10 ILE ILE A . n +A 1 11 ASP 11 11 11 ASP ASP A . n +A 1 12 ASP 12 12 12 ASP ASP A . n +A 1 13 ASN 13 13 13 ASN ASN A . n +A 1 14 GLY 14 14 14 GLY GLY A . n +A 1 15 LYS 15 15 15 LYS LYS A . n +A 1 16 ASN 16 16 16 ASN ASN A . n +A 1 17 PHE 17 17 17 PHE PHE A . n +A 1 18 ASP 18 18 18 ASP ASP A . n +A 1 19 TYR 19 19 19 TYR TYR A . n +A 1 20 THR 20 20 20 THR THR A . n +A 1 21 TYR 21 21 21 TYR TYR A . n +A 1 22 THR 22 22 22 THR THR A . n +A 1 23 VAL 23 23 23 VAL VAL A . n +A 1 24 THR 24 24 24 THR THR A . n +A 1 25 THR 25 25 25 THR THR A . n +A 1 26 GLU 26 26 26 GLU GLU A . n +A 1 27 SER 27 27 27 SER SER A . n +A 1 28 GLU 28 28 28 GLU GLU A . n +A 1 29 LEU 29 29 29 LEU LEU A . n +A 1 30 GLN 30 30 30 GLN GLN A . n +A 1 31 LYS 31 31 31 LYS LYS A . n +A 1 32 VAL 32 32 32 VAL VAL A . n +A 1 33 LEU 33 33 33 LEU LEU A . n +A 1 34 ASN 34 34 34 ASN ASN A . n +A 1 35 GLU 35 35 35 GLU GLU A . n +A 1 36 LEU 36 36 36 LEU LEU A . n +A 1 37 MSE 37 37 37 MSE MSE A . n +A 1 38 ASP 38 38 38 ASP ASP A . n +A 1 39 TYR 39 39 39 TYR TYR A . n +A 1 40 ILE 40 40 40 ILE ILE A . n +A 1 41 LYS 41 41 41 LYS LYS A . n +A 1 42 LYS 42 42 42 LYS LYS A . n +A 1 43 GLN 43 43 43 GLN GLN A . n +A 1 44 GLY 44 44 44 GLY GLY A . n +A 1 45 ALA 45 45 45 ALA ALA A . n +A 1 46 LYS 46 46 46 LYS LYS A . n +A 1 47 ARG 47 47 47 ARG ARG A . n +A 1 48 VAL 48 48 48 VAL VAL A . n +A 1 49 ARG 49 49 49 ARG ARG A . n +A 1 50 ILE 50 50 50 ILE ILE A . n +A 1 51 SER 51 51 51 SER SER A . n +A 1 52 ILE 52 52 52 ILE ILE A . n +A 1 53 THR 53 53 53 THR THR A . n +A 1 54 ALA 54 54 54 ALA ALA A . n +A 1 55 ARG 55 55 55 ARG ARG A . n +A 1 56 THR 56 56 56 THR THR A . n +A 1 57 LYS 57 57 57 LYS LYS A . n +A 1 58 LYS 58 58 58 LYS LYS A . n +A 1 59 GLU 59 59 59 GLU GLU A . n +A 1 60 ALA 60 60 60 ALA ALA A . n +A 1 61 GLU 61 61 61 GLU GLU A . n +A 1 62 LYS 62 62 62 LYS LYS A . n +A 1 63 PHE 63 63 63 PHE PHE A . n +A 1 64 ALA 64 64 64 ALA ALA A . n +A 1 65 ALA 65 65 65 ALA ALA A . n +A 1 66 ILE 66 66 66 ILE ILE A . n +A 1 67 LEU 67 67 67 LEU LEU A . n +A 1 68 ILE 68 68 68 ILE ILE A . n +A 1 69 LYS 69 69 69 LYS LYS A . n +A 1 70 VAL 70 70 70 VAL VAL A . n +A 1 71 PHE 71 71 71 PHE PHE A . n +A 1 72 ALA 72 72 72 ALA ALA A . n +A 1 73 GLU 73 73 73 GLU GLU A . n +A 1 74 LEU 74 74 74 LEU LEU A . n +A 1 75 GLY 75 75 75 GLY GLY A . n +A 1 76 TYR 76 76 76 TYR TYR A . n +A 1 77 ASN 77 77 77 ASN ASN A . n +A 1 78 ASP 78 78 78 ASP ASP A . n +A 1 79 ILE 79 79 79 ILE ILE A . n +A 1 80 ASN 80 80 80 ASN ASN A . n +A 1 81 VAL 81 81 81 VAL VAL A . n +A 1 82 THR 82 82 82 THR THR A . n +A 1 83 PHE 83 83 83 PHE PHE A . n +A 1 84 ASP 84 84 84 ASP ASP A . n +A 1 85 GLY 85 85 85 GLY GLY A . n +A 1 86 ASP 86 86 86 ASP ASP A . n +A 1 87 THR 87 87 87 THR THR A . n +A 1 88 VAL 88 88 88 VAL VAL A . n +A 1 89 THR 89 89 89 THR THR A . n +A 1 90 VAL 90 90 90 VAL VAL A . n +A 1 91 GLU 91 91 91 GLU GLU A . n +A 1 92 GLY 92 92 92 GLY GLY A . n +A 1 93 GLN 93 93 93 GLN GLN A . n +A 1 94 LEU 94 94 94 LEU LEU A . n +A 1 95 GLU 95 95 ? ? ? A . n +A 1 96 GLY 96 96 ? ? ? A . n +A 1 97 GLY 97 97 ? ? ? A . n +A 1 98 SER 98 98 ? ? ? A . n +A 1 99 LEU 99 99 ? ? ? A . n +A 1 100 GLU 100 100 ? ? ? A . n +A 1 101 HIS 101 101 ? ? ? A . n +A 1 102 HIS 102 102 ? ? ? A . n +A 1 103 HIS 103 103 ? ? ? A . n +A 1 104 HIS 104 104 ? ? ? A . n +A 1 105 HIS 105 105 ? ? ? A . n +A 1 106 HIS 106 106 ? ? ? A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +B 2 HOH 1 107 1 HOH WAT A . +B 2 HOH 2 108 2 HOH WAT A . +B 2 HOH 3 109 3 HOH WAT A . +B 2 HOH 4 110 4 HOH WAT A . +B 2 HOH 5 111 5 HOH WAT A . +B 2 HOH 6 112 6 HOH WAT A . +B 2 HOH 7 113 7 HOH WAT A . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A LYS 15 ? CG ? A LYS 15 CG +2 1 Y 1 A LYS 15 ? CD ? A LYS 15 CD +3 1 Y 1 A LYS 15 ? CE ? A LYS 15 CE +4 1 Y 1 A LYS 15 ? NZ ? A LYS 15 NZ +5 1 Y 1 A PHE 17 ? CG ? A PHE 17 CG +6 1 Y 1 A PHE 17 ? CD1 ? A PHE 17 CD1 +7 1 Y 1 A PHE 17 ? CD2 ? A PHE 17 CD2 +8 1 Y 1 A PHE 17 ? CE1 ? A PHE 17 CE1 +9 1 Y 1 A PHE 17 ? CE2 ? A PHE 17 CE2 +10 1 Y 1 A PHE 17 ? CZ ? A PHE 17 CZ +11 1 Y 1 A SER 27 ? OG ? A SER 27 OG +12 1 Y 1 A GLN 30 ? CG ? A GLN 30 CG +13 1 Y 1 A GLN 30 ? CD ? A GLN 30 CD +14 1 Y 1 A GLN 30 ? OE1 ? A GLN 30 OE1 +15 1 Y 1 A GLN 30 ? NE2 ? A GLN 30 NE2 +16 1 Y 1 A LYS 31 ? CG ? A LYS 31 CG +17 1 Y 1 A LYS 31 ? CD ? A LYS 31 CD +18 1 Y 1 A LYS 31 ? CE ? A LYS 31 CE +19 1 Y 1 A LYS 31 ? NZ ? A LYS 31 NZ +20 1 Y 1 A ASN 34 ? CG ? A ASN 34 CG +21 1 Y 1 A ASN 34 ? OD1 ? A ASN 34 OD1 +22 1 Y 1 A ASN 34 ? ND2 ? A ASN 34 ND2 +23 1 Y 1 A LEU 36 ? CG ? A LEU 36 CG +24 1 Y 1 A LEU 36 ? CD1 ? A LEU 36 CD1 +25 1 Y 1 A LEU 36 ? CD2 ? A LEU 36 CD2 +26 1 Y 1 A LYS 46 ? CG ? A LYS 46 CG +27 1 Y 1 A LYS 46 ? CD ? A LYS 46 CD +28 1 Y 1 A LYS 46 ? CE ? A LYS 46 CE +29 1 Y 1 A LYS 46 ? NZ ? A LYS 46 NZ +30 1 Y 1 A ARG 47 ? CG ? A ARG 47 CG +31 1 Y 1 A ARG 47 ? CD ? A ARG 47 CD +32 1 Y 1 A ARG 47 ? NE ? A ARG 47 NE +33 1 Y 1 A ARG 47 ? CZ ? A ARG 47 CZ +34 1 Y 1 A ARG 47 ? NH1 ? A ARG 47 NH1 +35 1 Y 1 A ARG 47 ? NH2 ? A ARG 47 NH2 +36 1 Y 1 A ARG 55 ? CG ? A ARG 55 CG +37 1 Y 1 A ARG 55 ? CD ? A ARG 55 CD +38 1 Y 1 A ARG 55 ? NE ? A ARG 55 NE +39 1 Y 1 A ARG 55 ? CZ ? A ARG 55 CZ +40 1 Y 1 A ARG 55 ? NH1 ? A ARG 55 NH1 +41 1 Y 1 A ARG 55 ? NH2 ? A ARG 55 NH2 +42 1 Y 1 A LYS 62 ? CG ? A LYS 62 CG +43 1 Y 1 A LYS 62 ? CD ? A LYS 62 CD +44 1 Y 1 A LYS 62 ? CE ? A LYS 62 CE +45 1 Y 1 A LYS 62 ? NZ ? A LYS 62 NZ +46 1 Y 1 A GLU 73 ? CG ? A GLU 73 CG +47 1 Y 1 A GLU 73 ? CD ? A GLU 73 CD +48 1 Y 1 A GLU 73 ? OE1 ? A GLU 73 OE1 +49 1 Y 1 A GLU 73 ? OE2 ? A GLU 73 OE2 +# +loop_ +_software.name +_software.classification +_software.version +_software.citation_id +_software.pdbx_ordinal +CNS refinement 1.1 ? 1 +HKL-2000 'data reduction' . ? 2 +SCALEPACK 'data scaling' . ? 3 +CNS phasing . ? 4 +# +_cell.entry_id 1QYS +_cell.length_a 35.900 +_cell.length_b 35.900 +_cell.length_c 140.554 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 120.00 +_cell.Z_PDB 6 +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 1QYS +_symmetry.space_group_name_H-M 'P 32 2 1' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 154 +# +_exptl.entry_id 1QYS +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number 1 +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.16 +_exptl_crystal.density_percent_sol 42.94 +_exptl_crystal.description ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP, STREAK SEEDING' +_exptl_crystal_grow.temp 298 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pH 6.6 +_exptl_crystal_grow.pdbx_details +'15-20% PEG3350 250mM Ammonium Formate, pH 6.6, VAPOR DIFFUSION, HANGING DROP, STREAK SEEDING, temperature 298K' +_exptl_crystal_grow.pdbx_pH_range . +# +_diffrn.id 1 +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'ADSC QUANTUM 210' +_diffrn_detector.pdbx_collection_date 2003-03-24 +_diffrn_detector.details ? +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator 'DOUBLE CRYSTAL Si(111)' +_diffrn_radiation.pdbx_diffrn_protocol SAD +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 0.9793 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'ALS BEAMLINE 8.2.1' +_diffrn_source.pdbx_synchrotron_site ALS +_diffrn_source.pdbx_synchrotron_beamline 8.2.1 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_wavelength_list 0.9793 +# +_reflns.entry_id 1QYS +_reflns.observed_criterion_sigma_I 0.0 +_reflns.observed_criterion_sigma_F 0.0 +_reflns.d_resolution_low 50.0 +_reflns.d_resolution_high 2.5 +_reflns.number_obs 6979 +_reflns.number_all ? +_reflns.percent_possible_obs 100 +_reflns.pdbx_Rmerge_I_obs 0.045 +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_sigmaI 37.8 +_reflns.B_iso_Wilson_estimate 30.2 +_reflns.pdbx_redundancy ? +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +# +_reflns_shell.d_res_high 2.5 +_reflns_shell.d_res_low 2.59 +_reflns_shell.percent_possible_all 100 +_reflns_shell.Rmerge_I_obs 0.344 +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.meanI_over_sigI_obs 5.0 +_reflns_shell.pdbx_redundancy ? +_reflns_shell.percent_possible_obs ? +_reflns_shell.number_unique_all ? +_reflns_shell.pdbx_diffrn_id ? +_reflns_shell.pdbx_ordinal 1 +# +_refine.entry_id 1QYS +_refine.ls_number_reflns_obs 6736 +_refine.ls_number_reflns_all 6736 +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 0.0 +_refine.pdbx_data_cutoff_high_absF 1873860.40 +_refine.pdbx_data_cutoff_low_absF 0 +_refine.pdbx_data_cutoff_high_rms_absF 1873860.40 +_refine.ls_d_res_low 18.71 +_refine.ls_d_res_high 2.50 +_refine.ls_percent_reflns_obs 96.1 +_refine.ls_R_factor_obs 0.268 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work 0.268 +_refine.ls_R_factor_R_free 0.293 +_refine.ls_R_factor_R_free_error 0.016 +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free 5.1 +_refine.ls_number_reflns_R_free 346 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.B_iso_mean 65.5 +_refine.aniso_B[1][1] 10.54 +_refine.aniso_B[2][2] 10.54 +_refine.aniso_B[3][3] -21.07 +_refine.aniso_B[1][2] 9.56 +_refine.aniso_B[1][3] 0.00 +_refine.aniso_B[2][3] 0.00 +_refine.solvent_model_details 'FLAT MODEL' +_refine.solvent_model_param_ksol 0.300247 +_refine.solvent_model_param_bsol 55.2431 +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.details ? +_refine.pdbx_starting_model ? +_refine.pdbx_method_to_determine_struct SAD +_refine.pdbx_isotropic_thermal_model GROUP +_refine.pdbx_stereochemistry_target_values 'Engh & Huber' +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.overall_SU_B ? +_refine.ls_redundancy_reflns_obs ? +_refine.B_iso_min ? +_refine.B_iso_max ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_overall_phase_error ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_analyze.entry_id 1QYS +_refine_analyze.Luzzati_coordinate_error_obs 0.42 +_refine_analyze.Luzzati_sigma_a_obs 0.47 +_refine_analyze.Luzzati_d_res_low_obs 5 +_refine_analyze.Luzzati_coordinate_error_free 0.46 +_refine_analyze.Luzzati_sigma_a_free 0.45 +_refine_analyze.Luzzati_d_res_low_free ? +_refine_analyze.number_disordered_residues ? +_refine_analyze.occupancy_sum_hydrogen ? +_refine_analyze.occupancy_sum_non_hydrogen ? +_refine_analyze.pdbx_Luzzati_d_res_high_obs ? +_refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 685 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 0 +_refine_hist.number_atoms_solvent 7 +_refine_hist.number_atoms_total 692 +_refine_hist.d_res_high 2.50 +_refine_hist.d_res_low 18.71 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +c_bond_d 0.008 ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg 1.4 ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d 26.3 ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d 0.73 ? ? ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_shell.pdbx_total_number_of_bins_used 6 +_refine_ls_shell.d_res_high 2.50 +_refine_ls_shell.d_res_low 2.66 +_refine_ls_shell.number_reflns_R_work 1009 +_refine_ls_shell.R_factor_R_work 0.353 +_refine_ls_shell.percent_reflns_obs 91.3 +_refine_ls_shell.R_factor_R_free 0.37 +_refine_ls_shell.R_factor_R_free_error 0.055 +_refine_ls_shell.percent_reflns_R_free 4.3 +_refine_ls_shell.number_reflns_R_free 45 +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.number_reflns_all ? +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.R_factor_all ? +# +loop_ +_pdbx_xplor_file.serial_no +_pdbx_xplor_file.param_file +_pdbx_xplor_file.topol_file +_pdbx_xplor_file.pdbx_refine_id +1 PROTEIN_REP.PARAM PROTEIN.TOP 'X-RAY DIFFRACTION' +2 WATER_REP.PARAM WATER.TOP 'X-RAY DIFFRACTION' +# +_database_PDB_matrix.entry_id 1QYS +_database_PDB_matrix.origx[1][1] 1.000000 +_database_PDB_matrix.origx[1][2] 0.000000 +_database_PDB_matrix.origx[1][3] 0.000000 +_database_PDB_matrix.origx[2][1] 0.000000 +_database_PDB_matrix.origx[2][2] 1.000000 +_database_PDB_matrix.origx[2][3] 0.000000 +_database_PDB_matrix.origx[3][1] 0.000000 +_database_PDB_matrix.origx[3][2] 0.000000 +_database_PDB_matrix.origx[3][3] 1.000000 +_database_PDB_matrix.origx_vector[1] 0.00000 +_database_PDB_matrix.origx_vector[2] 0.00000 +_database_PDB_matrix.origx_vector[3] 0.00000 +# +_struct.entry_id 1QYS +_struct.title 'Crystal structure of Top7: A computationally designed protein with a novel fold' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 1QYS +_struct_keywords.pdbx_keywords 'DE NOVO PROTEIN' +_struct_keywords.text 'alpha-beta, computationally designed, novel fold, DE NOVO PROTEIN' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +# +_struct_ref.id 1 +_struct_ref.entity_id 1 +_struct_ref.db_name PDB +_struct_ref.db_code 1QYS +_struct_ref.pdbx_db_accession 1QYS +_struct_ref.pdbx_db_isoform ? +_struct_ref.pdbx_seq_one_letter_code ? +_struct_ref.pdbx_align_begin ? +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 1QYS +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 1 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 106 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession 1QYS +_struct_ref_seq.db_align_beg 1 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 106 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 1 +_struct_ref_seq.pdbx_auth_seq_align_end 106 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 SER A 27 ? GLY A 44 ? SER A 27 GLY A 44 1 ? 18 +HELX_P HELX_P2 2 THR A 56 ? LEU A 74 ? THR A 56 LEU A 74 1 ? 19 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +covale1 covale both ? A LEU 36 C ? ? ? 1_555 A MSE 37 N ? ? A LEU 36 A MSE 37 1_555 ? ? ? ? ? ? ? 1.328 ? ? +covale2 covale both ? A MSE 37 C ? ? ? 1_555 A ASP 38 N ? ? A MSE 37 A ASP 38 1_555 ? ? ? ? ? ? ? 1.327 ? ? +# +_struct_conn_type.id covale +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +_pdbx_modification_feature.ordinal 1 +_pdbx_modification_feature.label_comp_id MSE +_pdbx_modification_feature.label_asym_id A +_pdbx_modification_feature.label_seq_id 37 +_pdbx_modification_feature.label_alt_id ? +_pdbx_modification_feature.modified_residue_label_comp_id . +_pdbx_modification_feature.modified_residue_label_asym_id . +_pdbx_modification_feature.modified_residue_label_seq_id . +_pdbx_modification_feature.modified_residue_label_alt_id . +_pdbx_modification_feature.auth_comp_id MSE +_pdbx_modification_feature.auth_asym_id A +_pdbx_modification_feature.auth_seq_id 37 +_pdbx_modification_feature.PDB_ins_code ? +_pdbx_modification_feature.symmetry 1_555 +_pdbx_modification_feature.modified_residue_auth_comp_id . +_pdbx_modification_feature.modified_residue_auth_asym_id . +_pdbx_modification_feature.modified_residue_auth_seq_id . +_pdbx_modification_feature.modified_residue_PDB_ins_code . +_pdbx_modification_feature.modified_residue_symmetry . +_pdbx_modification_feature.comp_id_linking_atom . +_pdbx_modification_feature.modified_residue_id_linking_atom . +_pdbx_modification_feature.modified_residue_id MET +_pdbx_modification_feature.ref_pcm_id 1 +_pdbx_modification_feature.ref_comp_id MSE +_pdbx_modification_feature.type Selenomethionine +_pdbx_modification_feature.category 'Named protein modification' +# +_struct_sheet.id A +_struct_sheet.type ? +_struct_sheet.number_strands 5 +_struct_sheet.details ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? anti-parallel +A 4 5 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 ASN A 16 ? VAL A 23 ? ASN A 16 VAL A 23 +A 2 ILE A 4 ? ASP A 11 ? ILE A 4 ASP A 11 +A 3 ARG A 47 ? THR A 53 ? ARG A 47 THR A 53 +A 4 THR A 87 ? GLN A 93 ? THR A 87 GLN A 93 +A 5 ASP A 78 ? ASP A 84 ? ASP A 78 ASP A 84 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 O TYR A 19 ? O TYR A 19 N VAL A 8 ? N VAL A 8 +A 2 3 N ASN A 9 ? N ASN A 9 O ARG A 49 ? O ARG A 49 +A 3 4 N VAL A 48 ? N VAL A 48 O GLY A 92 ? O GLY A 92 +A 4 5 O THR A 89 ? O THR A 89 N THR A 82 ? N THR A 82 +# +_pdbx_entry_details.entry_id 1QYS +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_symm_contact.id +_pdbx_validate_symm_contact.PDB_model_num +_pdbx_validate_symm_contact.auth_atom_id_1 +_pdbx_validate_symm_contact.auth_asym_id_1 +_pdbx_validate_symm_contact.auth_comp_id_1 +_pdbx_validate_symm_contact.auth_seq_id_1 +_pdbx_validate_symm_contact.PDB_ins_code_1 +_pdbx_validate_symm_contact.label_alt_id_1 +_pdbx_validate_symm_contact.site_symmetry_1 +_pdbx_validate_symm_contact.auth_atom_id_2 +_pdbx_validate_symm_contact.auth_asym_id_2 +_pdbx_validate_symm_contact.auth_comp_id_2 +_pdbx_validate_symm_contact.auth_seq_id_2 +_pdbx_validate_symm_contact.PDB_ins_code_2 +_pdbx_validate_symm_contact.label_alt_id_2 +_pdbx_validate_symm_contact.site_symmetry_2 +_pdbx_validate_symm_contact.dist +1 1 ND2 A ASN 80 ? ? 1_555 ND2 A ASN 80 ? ? 4_555 1.96 +2 1 CD1 A ILE 68 ? ? 1_555 CD1 A ILE 68 ? ? 4_555 1.98 +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 ASP A 12 ? ? -168.83 80.22 +2 1 ASN A 13 ? ? 43.86 102.49 +3 1 THR A 24 ? ? -158.71 81.00 +4 1 THR A 25 ? ? -176.78 -36.94 +5 1 GLU A 26 ? ? 68.87 -7.45 +# +_pdbx_struct_mod_residue.id 1 +_pdbx_struct_mod_residue.label_asym_id A +_pdbx_struct_mod_residue.label_comp_id MSE +_pdbx_struct_mod_residue.label_seq_id 37 +_pdbx_struct_mod_residue.auth_asym_id A +_pdbx_struct_mod_residue.auth_comp_id MSE +_pdbx_struct_mod_residue.auth_seq_id 37 +_pdbx_struct_mod_residue.PDB_ins_code ? +_pdbx_struct_mod_residue.parent_comp_id MET +_pdbx_struct_mod_residue.details SELENOMETHIONINE +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A MSE 1 ? A MSE 1 +2 1 Y 1 A GLY 2 ? A GLY 2 +3 1 Y 1 A GLU 95 ? A GLU 95 +4 1 Y 1 A GLY 96 ? A GLY 96 +5 1 Y 1 A GLY 97 ? A GLY 97 +6 1 Y 1 A SER 98 ? A SER 98 +7 1 Y 1 A LEU 99 ? A LEU 99 +8 1 Y 1 A GLU 100 ? A GLU 100 +9 1 Y 1 A HIS 101 ? A HIS 101 +10 1 Y 1 A HIS 102 ? A HIS 102 +11 1 Y 1 A HIS 103 ? A HIS 103 +12 1 Y 1 A HIS 104 ? A HIS 104 +13 1 Y 1 A HIS 105 ? A HIS 105 +14 1 Y 1 A HIS 106 ? A HIS 106 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +GLN N N N N 74 +GLN CA C N S 75 +GLN C C N N 76 +GLN O O N N 77 +GLN CB C N N 78 +GLN CG C N N 79 +GLN CD C N N 80 +GLN OE1 O N N 81 +GLN NE2 N N N 82 +GLN OXT O N N 83 +GLN H H N N 84 +GLN H2 H N N 85 +GLN HA H N N 86 +GLN HB2 H N N 87 +GLN HB3 H N N 88 +GLN HG2 H N N 89 +GLN HG3 H N N 90 +GLN HE21 H N N 91 +GLN HE22 H N N 92 +GLN HXT H N N 93 +GLU N N N N 94 +GLU CA C N S 95 +GLU C C N N 96 +GLU O O N N 97 +GLU CB C N N 98 +GLU CG C N N 99 +GLU CD C N N 100 +GLU OE1 O N N 101 +GLU OE2 O N N 102 +GLU OXT O N N 103 +GLU H H N N 104 +GLU H2 H N N 105 +GLU HA H N N 106 +GLU HB2 H N N 107 +GLU HB3 H N N 108 +GLU HG2 H N N 109 +GLU HG3 H N N 110 +GLU HE2 H N N 111 +GLU HXT H N N 112 +GLY N N N N 113 +GLY CA C N N 114 +GLY C C N N 115 +GLY O O N N 116 +GLY OXT O N N 117 +GLY H H N N 118 +GLY H2 H N N 119 +GLY HA2 H N N 120 +GLY HA3 H N N 121 +GLY HXT H N N 122 +HIS N N N N 123 +HIS CA C N S 124 +HIS C C N N 125 +HIS O O N N 126 +HIS CB C N N 127 +HIS CG C Y N 128 +HIS ND1 N Y N 129 +HIS CD2 C Y N 130 +HIS CE1 C Y N 131 +HIS NE2 N Y N 132 +HIS OXT O N N 133 +HIS H H N N 134 +HIS H2 H N N 135 +HIS HA H N N 136 +HIS HB2 H N N 137 +HIS HB3 H N N 138 +HIS HD1 H N N 139 +HIS HD2 H N N 140 +HIS HE1 H N N 141 +HIS HE2 H N N 142 +HIS HXT H N N 143 +HOH O O N N 144 +HOH H1 H N N 145 +HOH H2 H N N 146 +ILE N N N N 147 +ILE CA C N S 148 +ILE C C N N 149 +ILE O O N N 150 +ILE CB C N S 151 +ILE CG1 C N N 152 +ILE CG2 C N N 153 +ILE CD1 C N N 154 +ILE OXT O N N 155 +ILE H H N N 156 +ILE H2 H N N 157 +ILE HA H N N 158 +ILE HB H N N 159 +ILE HG12 H N N 160 +ILE HG13 H N N 161 +ILE HG21 H N N 162 +ILE HG22 H N N 163 +ILE HG23 H N N 164 +ILE HD11 H N N 165 +ILE HD12 H N N 166 +ILE HD13 H N N 167 +ILE HXT H N N 168 +LEU N N N N 169 +LEU CA C N S 170 +LEU C C N N 171 +LEU O O N N 172 +LEU CB C N N 173 +LEU CG C N N 174 +LEU CD1 C N N 175 +LEU CD2 C N N 176 +LEU OXT O N N 177 +LEU H H N N 178 +LEU H2 H N N 179 +LEU HA H N N 180 +LEU HB2 H N N 181 +LEU HB3 H N N 182 +LEU HG H N N 183 +LEU HD11 H N N 184 +LEU HD12 H N N 185 +LEU HD13 H N N 186 +LEU HD21 H N N 187 +LEU HD22 H N N 188 +LEU HD23 H N N 189 +LEU HXT H N N 190 +LYS N N N N 191 +LYS CA C N S 192 +LYS C C N N 193 +LYS O O N N 194 +LYS CB C N N 195 +LYS CG C N N 196 +LYS CD C N N 197 +LYS CE C N N 198 +LYS NZ N N N 199 +LYS OXT O N N 200 +LYS H H N N 201 +LYS H2 H N N 202 +LYS HA H N N 203 +LYS HB2 H N N 204 +LYS HB3 H N N 205 +LYS HG2 H N N 206 +LYS HG3 H N N 207 +LYS HD2 H N N 208 +LYS HD3 H N N 209 +LYS HE2 H N N 210 +LYS HE3 H N N 211 +LYS HZ1 H N N 212 +LYS HZ2 H N N 213 +LYS HZ3 H N N 214 +LYS HXT H N N 215 +MSE N N N N 216 +MSE CA C N S 217 +MSE C C N N 218 +MSE O O N N 219 +MSE OXT O N N 220 +MSE CB C N N 221 +MSE CG C N N 222 +MSE SE SE N N 223 +MSE CE C N N 224 +MSE H H N N 225 +MSE H2 H N N 226 +MSE HA H N N 227 +MSE HXT H N N 228 +MSE HB2 H N N 229 +MSE HB3 H N N 230 +MSE HG2 H N N 231 +MSE HG3 H N N 232 +MSE HE1 H N N 233 +MSE HE2 H N N 234 +MSE HE3 H N N 235 +PHE N N N N 236 +PHE CA C N S 237 +PHE C C N N 238 +PHE O O N N 239 +PHE CB C N N 240 +PHE CG C Y N 241 +PHE CD1 C Y N 242 +PHE CD2 C Y N 243 +PHE CE1 C Y N 244 +PHE CE2 C Y N 245 +PHE CZ C Y N 246 +PHE OXT O N N 247 +PHE H H N N 248 +PHE H2 H N N 249 +PHE HA H N N 250 +PHE HB2 H N N 251 +PHE HB3 H N N 252 +PHE HD1 H N N 253 +PHE HD2 H N N 254 +PHE HE1 H N N 255 +PHE HE2 H N N 256 +PHE HZ H N N 257 +PHE HXT H N N 258 +SER N N N N 259 +SER CA C N S 260 +SER C C N N 261 +SER O O N N 262 +SER CB C N N 263 +SER OG O N N 264 +SER OXT O N N 265 +SER H H N N 266 +SER H2 H N N 267 +SER HA H N N 268 +SER HB2 H N N 269 +SER HB3 H N N 270 +SER HG H N N 271 +SER HXT H N N 272 +THR N N N N 273 +THR CA C N S 274 +THR C C N N 275 +THR O O N N 276 +THR CB C N R 277 +THR OG1 O N N 278 +THR CG2 C N N 279 +THR OXT O N N 280 +THR H H N N 281 +THR H2 H N N 282 +THR HA H N N 283 +THR HB H N N 284 +THR HG1 H N N 285 +THR HG21 H N N 286 +THR HG22 H N N 287 +THR HG23 H N N 288 +THR HXT H N N 289 +TYR N N N N 290 +TYR CA C N S 291 +TYR C C N N 292 +TYR O O N N 293 +TYR CB C N N 294 +TYR CG C Y N 295 +TYR CD1 C Y N 296 +TYR CD2 C Y N 297 +TYR CE1 C Y N 298 +TYR CE2 C Y N 299 +TYR CZ C Y N 300 +TYR OH O N N 301 +TYR OXT O N N 302 +TYR H H N N 303 +TYR H2 H N N 304 +TYR HA H N N 305 +TYR HB2 H N N 306 +TYR HB3 H N N 307 +TYR HD1 H N N 308 +TYR HD2 H N N 309 +TYR HE1 H N N 310 +TYR HE2 H N N 311 +TYR HH H N N 312 +TYR HXT H N N 313 +VAL N N N N 314 +VAL CA C N S 315 +VAL C C N N 316 +VAL O O N N 317 +VAL CB C N N 318 +VAL CG1 C N N 319 +VAL CG2 C N N 320 +VAL OXT O N N 321 +VAL H H N N 322 +VAL H2 H N N 323 +VAL HA H N N 324 +VAL HB H N N 325 +VAL HG11 H N N 326 +VAL HG12 H N N 327 +VAL HG13 H N N 328 +VAL HG21 H N N 329 +VAL HG22 H N N 330 +VAL HG23 H N N 331 +VAL HXT H N N 332 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +GLN N CA sing N N 70 +GLN N H sing N N 71 +GLN N H2 sing N N 72 +GLN CA C sing N N 73 +GLN CA CB sing N N 74 +GLN CA HA sing N N 75 +GLN C O doub N N 76 +GLN C OXT sing N N 77 +GLN CB CG sing N N 78 +GLN CB HB2 sing N N 79 +GLN CB HB3 sing N N 80 +GLN CG CD sing N N 81 +GLN CG HG2 sing N N 82 +GLN CG HG3 sing N N 83 +GLN CD OE1 doub N N 84 +GLN CD NE2 sing N N 85 +GLN NE2 HE21 sing N N 86 +GLN NE2 HE22 sing N N 87 +GLN OXT HXT sing N N 88 +GLU N CA sing N N 89 +GLU N H sing N N 90 +GLU N H2 sing N N 91 +GLU CA C sing N N 92 +GLU CA CB sing N N 93 +GLU CA HA sing N N 94 +GLU C O doub N N 95 +GLU C OXT sing N N 96 +GLU CB CG sing N N 97 +GLU CB HB2 sing N N 98 +GLU CB HB3 sing N N 99 +GLU CG CD sing N N 100 +GLU CG HG2 sing N N 101 +GLU CG HG3 sing N N 102 +GLU CD OE1 doub N N 103 +GLU CD OE2 sing N N 104 +GLU OE2 HE2 sing N N 105 +GLU OXT HXT sing N N 106 +GLY N CA sing N N 107 +GLY N H sing N N 108 +GLY N H2 sing N N 109 +GLY CA C sing N N 110 +GLY CA HA2 sing N N 111 +GLY CA HA3 sing N N 112 +GLY C O doub N N 113 +GLY C OXT sing N N 114 +GLY OXT HXT sing N N 115 +HIS N CA sing N N 116 +HIS N H sing N N 117 +HIS N H2 sing N N 118 +HIS CA C sing N N 119 +HIS CA CB sing N N 120 +HIS CA HA sing N N 121 +HIS C O doub N N 122 +HIS C OXT sing N N 123 +HIS CB CG sing N N 124 +HIS CB HB2 sing N N 125 +HIS CB HB3 sing N N 126 +HIS CG ND1 sing Y N 127 +HIS CG CD2 doub Y N 128 +HIS ND1 CE1 doub Y N 129 +HIS ND1 HD1 sing N N 130 +HIS CD2 NE2 sing Y N 131 +HIS CD2 HD2 sing N N 132 +HIS CE1 NE2 sing Y N 133 +HIS CE1 HE1 sing N N 134 +HIS NE2 HE2 sing N N 135 +HIS OXT HXT sing N N 136 +HOH O H1 sing N N 137 +HOH O H2 sing N N 138 +ILE N CA sing N N 139 +ILE N H sing N N 140 +ILE N H2 sing N N 141 +ILE CA C sing N N 142 +ILE CA CB sing N N 143 +ILE CA HA sing N N 144 +ILE C O doub N N 145 +ILE C OXT sing N N 146 +ILE CB CG1 sing N N 147 +ILE CB CG2 sing N N 148 +ILE CB HB sing N N 149 +ILE CG1 CD1 sing N N 150 +ILE CG1 HG12 sing N N 151 +ILE CG1 HG13 sing N N 152 +ILE CG2 HG21 sing N N 153 +ILE CG2 HG22 sing N N 154 +ILE CG2 HG23 sing N N 155 +ILE CD1 HD11 sing N N 156 +ILE CD1 HD12 sing N N 157 +ILE CD1 HD13 sing N N 158 +ILE OXT HXT sing N N 159 +LEU N CA sing N N 160 +LEU N H sing N N 161 +LEU N H2 sing N N 162 +LEU CA C sing N N 163 +LEU CA CB sing N N 164 +LEU CA HA sing N N 165 +LEU C O doub N N 166 +LEU C OXT sing N N 167 +LEU CB CG sing N N 168 +LEU CB HB2 sing N N 169 +LEU CB HB3 sing N N 170 +LEU CG CD1 sing N N 171 +LEU CG CD2 sing N N 172 +LEU CG HG sing N N 173 +LEU CD1 HD11 sing N N 174 +LEU CD1 HD12 sing N N 175 +LEU CD1 HD13 sing N N 176 +LEU CD2 HD21 sing N N 177 +LEU CD2 HD22 sing N N 178 +LEU CD2 HD23 sing N N 179 +LEU OXT HXT sing N N 180 +LYS N CA sing N N 181 +LYS N H sing N N 182 +LYS N H2 sing N N 183 +LYS CA C sing N N 184 +LYS CA CB sing N N 185 +LYS CA HA sing N N 186 +LYS C O doub N N 187 +LYS C OXT sing N N 188 +LYS CB CG sing N N 189 +LYS CB HB2 sing N N 190 +LYS CB HB3 sing N N 191 +LYS CG CD sing N N 192 +LYS CG HG2 sing N N 193 +LYS CG HG3 sing N N 194 +LYS CD CE sing N N 195 +LYS CD HD2 sing N N 196 +LYS CD HD3 sing N N 197 +LYS CE NZ sing N N 198 +LYS CE HE2 sing N N 199 +LYS CE HE3 sing N N 200 +LYS NZ HZ1 sing N N 201 +LYS NZ HZ2 sing N N 202 +LYS NZ HZ3 sing N N 203 +LYS OXT HXT sing N N 204 +MSE N CA sing N N 205 +MSE N H sing N N 206 +MSE N H2 sing N N 207 +MSE CA C sing N N 208 +MSE CA CB sing N N 209 +MSE CA HA sing N N 210 +MSE C O doub N N 211 +MSE C OXT sing N N 212 +MSE OXT HXT sing N N 213 +MSE CB CG sing N N 214 +MSE CB HB2 sing N N 215 +MSE CB HB3 sing N N 216 +MSE CG SE sing N N 217 +MSE CG HG2 sing N N 218 +MSE CG HG3 sing N N 219 +MSE SE CE sing N N 220 +MSE CE HE1 sing N N 221 +MSE CE HE2 sing N N 222 +MSE CE HE3 sing N N 223 +PHE N CA sing N N 224 +PHE N H sing N N 225 +PHE N H2 sing N N 226 +PHE CA C sing N N 227 +PHE CA CB sing N N 228 +PHE CA HA sing N N 229 +PHE C O doub N N 230 +PHE C OXT sing N N 231 +PHE CB CG sing N N 232 +PHE CB HB2 sing N N 233 +PHE CB HB3 sing N N 234 +PHE CG CD1 doub Y N 235 +PHE CG CD2 sing Y N 236 +PHE CD1 CE1 sing Y N 237 +PHE CD1 HD1 sing N N 238 +PHE CD2 CE2 doub Y N 239 +PHE CD2 HD2 sing N N 240 +PHE CE1 CZ doub Y N 241 +PHE CE1 HE1 sing N N 242 +PHE CE2 CZ sing Y N 243 +PHE CE2 HE2 sing N N 244 +PHE CZ HZ sing N N 245 +PHE OXT HXT sing N N 246 +SER N CA sing N N 247 +SER N H sing N N 248 +SER N H2 sing N N 249 +SER CA C sing N N 250 +SER CA CB sing N N 251 +SER CA HA sing N N 252 +SER C O doub N N 253 +SER C OXT sing N N 254 +SER CB OG sing N N 255 +SER CB HB2 sing N N 256 +SER CB HB3 sing N N 257 +SER OG HG sing N N 258 +SER OXT HXT sing N N 259 +THR N CA sing N N 260 +THR N H sing N N 261 +THR N H2 sing N N 262 +THR CA C sing N N 263 +THR CA CB sing N N 264 +THR CA HA sing N N 265 +THR C O doub N N 266 +THR C OXT sing N N 267 +THR CB OG1 sing N N 268 +THR CB CG2 sing N N 269 +THR CB HB sing N N 270 +THR OG1 HG1 sing N N 271 +THR CG2 HG21 sing N N 272 +THR CG2 HG22 sing N N 273 +THR CG2 HG23 sing N N 274 +THR OXT HXT sing N N 275 +TYR N CA sing N N 276 +TYR N H sing N N 277 +TYR N H2 sing N N 278 +TYR CA C sing N N 279 +TYR CA CB sing N N 280 +TYR CA HA sing N N 281 +TYR C O doub N N 282 +TYR C OXT sing N N 283 +TYR CB CG sing N N 284 +TYR CB HB2 sing N N 285 +TYR CB HB3 sing N N 286 +TYR CG CD1 doub Y N 287 +TYR CG CD2 sing Y N 288 +TYR CD1 CE1 sing Y N 289 +TYR CD1 HD1 sing N N 290 +TYR CD2 CE2 doub Y N 291 +TYR CD2 HD2 sing N N 292 +TYR CE1 CZ doub Y N 293 +TYR CE1 HE1 sing N N 294 +TYR CE2 CZ sing Y N 295 +TYR CE2 HE2 sing N N 296 +TYR CZ OH sing N N 297 +TYR OH HH sing N N 298 +TYR OXT HXT sing N N 299 +VAL N CA sing N N 300 +VAL N H sing N N 301 +VAL N H2 sing N N 302 +VAL CA C sing N N 303 +VAL CA CB sing N N 304 +VAL CA HA sing N N 305 +VAL C O doub N N 306 +VAL C OXT sing N N 307 +VAL CB CG1 sing N N 308 +VAL CB CG2 sing N N 309 +VAL CB HB sing N N 310 +VAL CG1 HG11 sing N N 311 +VAL CG1 HG12 sing N N 312 +VAL CG1 HG13 sing N N 313 +VAL CG2 HG21 sing N N 314 +VAL CG2 HG22 sing N N 315 +VAL CG2 HG23 sing N N 316 +VAL OXT HXT sing N N 317 +# +_atom_sites.entry_id 1QYS +_atom_sites.fract_transf_matrix[1][1] 0.027855 +_atom_sites.fract_transf_matrix[1][2] 0.016082 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.032164 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.007115 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +SE +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . ASP A 1 3 ? -4.522 18.306 17.409 1.00 174.51 ? 3 ASP A N 1 +ATOM 2 C CA . ASP A 1 3 ? -3.061 18.228 17.122 1.00 174.51 ? 3 ASP A CA 1 +ATOM 3 C C . ASP A 1 3 ? -2.664 16.993 16.324 1.00 174.51 ? 3 ASP A C 1 +ATOM 4 O O . ASP A 1 3 ? -3.515 16.306 15.754 1.00 174.51 ? 3 ASP A O 1 +ATOM 5 C CB . ASP A 1 3 ? -2.261 18.246 18.422 1.00 83.84 ? 3 ASP A CB 1 +ATOM 6 C CG . ASP A 1 3 ? -1.658 19.600 18.711 1.00 83.84 ? 3 ASP A CG 1 +ATOM 7 O OD1 . ASP A 1 3 ? -1.169 20.249 17.760 1.00 83.84 ? 3 ASP A OD1 1 +ATOM 8 O OD2 . ASP A 1 3 ? -1.654 20.007 19.892 1.00 83.84 ? 3 ASP A OD2 1 +ATOM 9 N N . ILE A 1 4 ? -1.360 16.714 16.297 1.00 57.73 ? 4 ILE A N 1 +ATOM 10 C CA . ILE A 1 4 ? -0.823 15.562 15.568 1.00 57.73 ? 4 ILE A CA 1 +ATOM 11 C C . ILE A 1 4 ? -0.721 14.309 16.433 1.00 57.73 ? 4 ILE A C 1 +ATOM 12 O O . ILE A 1 4 ? 0.091 14.222 17.355 1.00 57.73 ? 4 ILE A O 1 +ATOM 13 C CB . ILE A 1 4 ? 0.555 15.888 14.980 1.00 57.14 ? 4 ILE A CB 1 +ATOM 14 C CG1 . ILE A 1 4 ? 0.425 17.108 14.058 1.00 57.14 ? 4 ILE A CG1 1 +ATOM 15 C CG2 . ILE A 1 4 ? 1.097 14.674 14.218 1.00 57.14 ? 4 ILE A CG2 1 +ATOM 16 C CD1 . ILE A 1 4 ? 1.737 17.831 13.766 1.00 57.14 ? 4 ILE A CD1 1 +ATOM 17 N N . GLN A 1 5 ? -1.567 13.342 16.105 1.00 49.21 ? 5 GLN A N 1 +ATOM 18 C CA . GLN A 1 5 ? -1.632 12.078 16.814 1.00 49.21 ? 5 GLN A CA 1 +ATOM 19 C C . GLN A 1 5 ? -0.907 10.950 16.066 1.00 49.21 ? 5 GLN A C 1 +ATOM 20 O O . GLN A 1 5 ? -1.306 10.567 14.965 1.00 84.12 ? 5 GLN A O 1 +ATOM 21 C CB . GLN A 1 5 ? -3.095 11.691 17.017 1.00 87.59 ? 5 GLN A CB 1 +ATOM 22 C CG . GLN A 1 5 ? -3.284 10.472 17.883 1.00 87.59 ? 5 GLN A CG 1 +ATOM 23 C CD . GLN A 1 5 ? -2.740 10.671 19.282 1.00 87.59 ? 5 GLN A CD 1 +ATOM 24 O OE1 . GLN A 1 5 ? -2.801 9.770 20.107 1.00 87.59 ? 5 GLN A OE1 1 +ATOM 25 N NE2 . GLN A 1 5 ? -2.209 11.857 19.556 1.00 87.59 ? 5 GLN A NE2 1 +ATOM 26 N N . VAL A 1 6 ? 0.151 10.426 16.683 1.00 61.01 ? 6 VAL A N 1 +ATOM 27 C CA . VAL A 1 6 ? 0.937 9.342 16.107 1.00 61.01 ? 6 VAL A CA 1 +ATOM 28 C C . VAL A 1 6 ? 0.671 8.008 16.803 1.00 61.01 ? 6 VAL A C 1 +ATOM 29 O O . VAL A 1 6 ? 0.957 7.837 17.983 1.00 61.01 ? 6 VAL A O 1 +ATOM 30 C CB . VAL A 1 6 ? 2.439 9.624 16.196 1.00 50.93 ? 6 VAL A CB 1 +ATOM 31 C CG1 . VAL A 1 6 ? 3.199 8.503 15.531 1.00 50.93 ? 6 VAL A CG1 1 +ATOM 32 C CG2 . VAL A 1 6 ? 2.772 10.922 15.516 1.00 50.93 ? 6 VAL A CG2 1 +ATOM 33 N N . GLN A 1 7 ? 0.118 7.066 16.055 1.00 44.88 ? 7 GLN A N 1 +ATOM 34 C CA . GLN A 1 7 ? -0.196 5.735 16.561 1.00 44.88 ? 7 GLN A CA 1 +ATOM 35 C C . GLN A 1 7 ? 0.719 4.713 15.881 1.00 44.88 ? 7 GLN A C 1 +ATOM 36 O O . GLN A 1 7 ? 0.658 4.513 14.674 1.00 44.88 ? 7 GLN A O 1 +ATOM 37 C CB . GLN A 1 7 ? -1.658 5.390 16.264 1.00 83.92 ? 7 GLN A CB 1 +ATOM 38 C CG . GLN A 1 7 ? -2.534 5.302 17.485 1.00 83.92 ? 7 GLN A CG 1 +ATOM 39 C CD . GLN A 1 7 ? -2.119 4.173 18.412 1.00 83.92 ? 7 GLN A CD 1 +ATOM 40 O OE1 . GLN A 1 7 ? -0.990 4.138 18.905 1.00 83.92 ? 7 GLN A OE1 1 +ATOM 41 N NE2 . GLN A 1 7 ? -3.031 3.241 18.653 1.00 83.92 ? 7 GLN A NE2 1 +ATOM 42 N N . VAL A 1 8 ? 1.578 4.084 16.673 1.00 45.42 ? 8 VAL A N 1 +ATOM 43 C CA . VAL A 1 8 ? 2.499 3.068 16.186 1.00 45.42 ? 8 VAL A CA 1 +ATOM 44 C C . VAL A 1 8 ? 2.103 1.700 16.756 1.00 45.42 ? 8 VAL A C 1 +ATOM 45 O O . VAL A 1 8 ? 2.114 1.508 17.966 1.00 45.42 ? 8 VAL A O 1 +ATOM 46 C CB . VAL A 1 8 ? 3.945 3.377 16.613 1.00 41.58 ? 8 VAL A CB 1 +ATOM 47 C CG1 . VAL A 1 8 ? 4.867 2.293 16.086 1.00 41.58 ? 8 VAL A CG1 1 +ATOM 48 C CG2 . VAL A 1 8 ? 4.375 4.731 16.083 1.00 41.58 ? 8 VAL A CG2 1 +ATOM 49 N N . ASN A 1 9 ? 1.746 0.755 15.891 1.00 56.60 ? 9 ASN A N 1 +ATOM 50 C CA . ASN A 1 9 ? 1.357 -0.569 16.361 1.00 56.60 ? 9 ASN A CA 1 +ATOM 51 C C . ASN A 1 9 ? 2.224 -1.684 15.748 1.00 56.60 ? 9 ASN A C 1 +ATOM 52 O O . ASN A 1 9 ? 2.140 -1.992 14.559 1.00 56.60 ? 9 ASN A O 1 +ATOM 53 C CB . ASN A 1 9 ? -0.119 -0.818 16.065 1.00 105.47 ? 9 ASN A CB 1 +ATOM 54 C CG . ASN A 1 9 ? -0.823 -1.519 17.208 1.00 105.47 ? 9 ASN A CG 1 +ATOM 55 O OD1 . ASN A 1 9 ? -1.281 -0.879 18.165 1.00 105.47 ? 9 ASN A OD1 1 +ATOM 56 N ND2 . ASN A 1 9 ? -0.887 -2.850 17.133 1.00 105.47 ? 9 ASN A ND2 1 +ATOM 57 N N . ILE A 1 10 ? 3.073 -2.269 16.587 1.00 40.88 ? 10 ILE A N 1 +ATOM 58 C CA . ILE A 1 10 ? 3.976 -3.337 16.187 1.00 40.88 ? 10 ILE A CA 1 +ATOM 59 C C . ILE A 1 10 ? 3.531 -4.697 16.730 1.00 40.88 ? 10 ILE A C 1 +ATOM 60 O O . ILE A 1 10 ? 3.465 -4.900 17.944 1.00 70.73 ? 10 ILE A O 1 +ATOM 61 C CB . ILE A 1 10 ? 5.399 -3.068 16.702 1.00 61.80 ? 10 ILE A CB 1 +ATOM 62 C CG1 . ILE A 1 10 ? 5.870 -1.693 16.253 1.00 61.80 ? 10 ILE A CG1 1 +ATOM 63 C CG2 . ILE A 1 10 ? 6.343 -4.127 16.180 1.00 61.80 ? 10 ILE A CG2 1 +ATOM 64 C CD1 . ILE A 1 10 ? 7.241 -1.341 16.788 1.00 61.80 ? 10 ILE A CD1 1 +ATOM 65 N N . ASP A 1 11 ? 3.225 -5.621 15.824 1.00 68.81 ? 11 ASP A N 1 +ATOM 66 C CA . ASP A 1 11 ? 2.802 -6.960 16.220 1.00 68.81 ? 11 ASP A CA 1 +ATOM 67 C C . ASP A 1 11 ? 3.892 -7.970 15.878 1.00 68.81 ? 11 ASP A C 1 +ATOM 68 O O . ASP A 1 11 ? 4.569 -7.850 14.850 1.00 68.81 ? 11 ASP A O 1 +ATOM 69 C CB . ASP A 1 11 ? 1.498 -7.342 15.537 1.00 114.14 ? 11 ASP A CB 1 +ATOM 70 C CG . ASP A 1 11 ? 0.590 -8.125 16.449 1.00 114.14 ? 11 ASP A CG 1 +ATOM 71 O OD1 . ASP A 1 11 ? 1.008 -9.205 16.916 1.00 114.14 ? 11 ASP A OD1 1 +ATOM 72 O OD2 . ASP A 1 11 ? -0.534 -7.651 16.712 1.00 114.14 ? 11 ASP A OD2 1 +ATOM 73 N N . ASP A 1 12 ? 4.055 -8.971 16.737 1.00 70.35 ? 12 ASP A N 1 +ATOM 74 C CA . ASP A 1 12 ? 5.107 -9.950 16.527 1.00 70.35 ? 12 ASP A CA 1 +ATOM 75 C C . ASP A 1 12 ? 4.970 -11.157 17.446 1.00 70.35 ? 12 ASP A C 1 +ATOM 76 O O . ASP A 1 12 ? 5.649 -11.243 18.468 1.00 70.35 ? 12 ASP A O 1 +ATOM 77 C CB . ASP A 1 12 ? 6.462 -9.264 16.752 1.00 53.31 ? 12 ASP A CB 1 +ATOM 78 C CG . ASP A 1 12 ? 7.632 -10.096 16.286 1.00 53.31 ? 12 ASP A CG 1 +ATOM 79 O OD1 . ASP A 1 12 ? 7.496 -10.774 15.243 1.00 53.31 ? 12 ASP A OD1 1 +ATOM 80 O OD2 . ASP A 1 12 ? 8.697 -10.045 16.944 1.00 53.31 ? 12 ASP A OD2 1 +ATOM 81 N N . ASN A 1 13 ? 4.090 -12.081 17.079 1.00 96.17 ? 13 ASN A N 1 +ATOM 82 C CA . ASN A 1 13 ? 3.876 -13.307 17.848 1.00 96.17 ? 13 ASN A CA 1 +ATOM 83 C C . ASN A 1 13 ? 3.792 -13.129 19.361 1.00 96.17 ? 13 ASN A C 1 +ATOM 84 O O . ASN A 1 13 ? 4.817 -12.980 20.028 1.00 96.17 ? 13 ASN A O 1 +ATOM 85 C CB . ASN A 1 13 ? 4.988 -14.315 17.550 1.00 100.93 ? 13 ASN A CB 1 +ATOM 86 C CG . ASN A 1 13 ? 5.349 -14.363 16.087 1.00 100.93 ? 13 ASN A CG 1 +ATOM 87 O OD1 . ASN A 1 13 ? 5.977 -13.444 15.562 1.00 100.93 ? 13 ASN A OD1 1 +ATOM 88 N ND2 . ASN A 1 13 ? 4.947 -15.434 15.413 1.00 100.93 ? 13 ASN A ND2 1 +ATOM 89 N N . GLY A 1 14 ? 2.572 -13.164 19.895 1.00 130.92 ? 14 GLY A N 1 +ATOM 90 C CA . GLY A 1 14 ? 2.371 -13.029 21.330 1.00 130.92 ? 14 GLY A CA 1 +ATOM 91 C C . GLY A 1 14 ? 2.938 -11.774 21.965 1.00 130.92 ? 14 GLY A C 1 +ATOM 92 O O . GLY A 1 14 ? 3.099 -11.711 23.185 1.00 130.92 ? 14 GLY A O 1 +ATOM 93 N N . LYS A 1 15 ? 3.245 -10.775 21.143 1.00 68.27 ? 15 LYS A N 1 +ATOM 94 C CA . LYS A 1 15 ? 3.790 -9.520 21.640 1.00 68.27 ? 15 LYS A CA 1 +ATOM 95 C C . LYS A 1 15 ? 3.313 -8.363 20.774 1.00 68.27 ? 15 LYS A C 1 +ATOM 96 O O . LYS A 1 15 ? 3.754 -8.207 19.639 1.00 68.27 ? 15 LYS A O 1 +ATOM 97 C CB . LYS A 1 15 ? 5.329 -9.570 21.663 1.00 55.99 ? 15 LYS A CB 1 +ATOM 98 N N . ASN A 1 16 ? 2.400 -7.560 21.313 1.00 54.52 ? 16 ASN A N 1 +ATOM 99 C CA . ASN A 1 16 ? 1.872 -6.404 20.600 1.00 54.52 ? 16 ASN A CA 1 +ATOM 100 C C . ASN A 1 16 ? 2.268 -5.109 21.338 1.00 54.52 ? 16 ASN A C 1 +ATOM 101 O O . ASN A 1 16 ? 2.022 -4.958 22.538 1.00 54.52 ? 16 ASN A O 1 +ATOM 102 C CB . ASN A 1 16 ? 0.347 -6.516 20.481 1.00 102.09 ? 16 ASN A CB 1 +ATOM 103 C CG . ASN A 1 16 ? -0.260 -5.401 19.643 1.00 102.09 ? 16 ASN A CG 1 +ATOM 104 O OD1 . ASN A 1 16 ? 0.179 -5.140 18.522 1.00 102.09 ? 16 ASN A OD1 1 +ATOM 105 N ND2 . ASN A 1 16 ? -1.284 -4.745 20.181 1.00 102.09 ? 16 ASN A ND2 1 +ATOM 106 N N . PHE A 1 17 ? 2.902 -4.187 20.617 1.00 42.25 ? 17 PHE A N 1 +ATOM 107 C CA . PHE A 1 17 ? 3.318 -2.920 21.197 1.00 42.25 ? 17 PHE A CA 1 +ATOM 108 C C . PHE A 1 17 ? 2.488 -1.820 20.560 1.00 42.25 ? 17 PHE A C 1 +ATOM 109 O O . PHE A 1 17 ? 2.326 -1.787 19.346 1.00 42.25 ? 17 PHE A O 1 +ATOM 110 C CB . PHE A 1 17 ? 4.810 -2.682 20.947 1.00 34.85 ? 17 PHE A CB 1 +ATOM 111 N N . ASP A 1 18 ? 1.947 -0.934 21.394 1.00 45.89 ? 18 ASP A N 1 +ATOM 112 C CA . ASP A 1 18 ? 1.124 0.181 20.939 1.00 45.89 ? 18 ASP A CA 1 +ATOM 113 C C . ASP A 1 18 ? 1.671 1.527 21.481 1.00 45.89 ? 18 ASP A C 1 +ATOM 114 O O . ASP A 1 18 ? 1.496 1.855 22.652 1.00 45.89 ? 18 ASP A O 1 +ATOM 115 C CB . ASP A 1 18 ? -0.310 -0.037 21.406 1.00 89.81 ? 18 ASP A CB 1 +ATOM 116 C CG . ASP A 1 18 ? -1.254 0.966 20.813 1.00 89.81 ? 18 ASP A CG 1 +ATOM 117 O OD1 . ASP A 1 18 ? -1.419 0.953 19.573 1.00 89.81 ? 18 ASP A OD1 1 +ATOM 118 O OD2 . ASP A 1 18 ? -1.816 1.782 21.577 1.00 89.81 ? 18 ASP A OD2 1 +ATOM 119 N N . TYR A 1 19 ? 2.343 2.290 20.623 1.00 43.94 ? 19 TYR A N 1 +ATOM 120 C CA . TYR A 1 19 ? 2.936 3.578 20.999 1.00 43.94 ? 19 TYR A CA 1 +ATOM 121 C C . TYR A 1 19 ? 2.048 4.728 20.530 1.00 43.94 ? 19 TYR A C 1 +ATOM 122 O O . TYR A 1 19 ? 1.694 4.814 19.360 1.00 78.71 ? 19 TYR A O 1 +ATOM 123 C CB . TYR A 1 19 ? 4.329 3.734 20.373 1.00 87.94 ? 19 TYR A CB 1 +ATOM 124 C CG . TYR A 1 19 ? 5.347 2.679 20.778 1.00 87.94 ? 19 TYR A CG 1 +ATOM 125 C CD1 . TYR A 1 19 ? 6.083 2.805 21.954 1.00 87.94 ? 19 TYR A CD1 1 +ATOM 126 C CD2 . TYR A 1 19 ? 5.578 1.553 19.977 1.00 87.94 ? 19 TYR A CD2 1 +ATOM 127 C CE1 . TYR A 1 19 ? 7.029 1.837 22.327 1.00 87.94 ? 19 TYR A CE1 1 +ATOM 128 C CE2 . TYR A 1 19 ? 6.521 0.577 20.342 1.00 87.94 ? 19 TYR A CE2 1 +ATOM 129 C CZ . TYR A 1 19 ? 7.243 0.728 21.518 1.00 87.94 ? 19 TYR A CZ 1 +ATOM 130 O OH . TYR A 1 19 ? 8.180 -0.218 21.886 1.00 87.94 ? 19 TYR A OH 1 +ATOM 131 N N . THR A 1 20 ? 1.691 5.609 21.457 1.00 50.11 ? 20 THR A N 1 +ATOM 132 C CA . THR A 1 20 ? 0.857 6.756 21.147 1.00 50.11 ? 20 THR A CA 1 +ATOM 133 C C . THR A 1 20 ? 1.589 8.007 21.589 1.00 50.11 ? 20 THR A C 1 +ATOM 134 O O . THR A 1 20 ? 1.996 8.119 22.746 1.00 50.11 ? 20 THR A O 1 +ATOM 135 C CB . THR A 1 20 ? -0.458 6.683 21.889 1.00 57.60 ? 20 THR A CB 1 +ATOM 136 O OG1 . THR A 1 20 ? -0.954 5.345 21.830 1.00 57.60 ? 20 THR A OG1 1 +ATOM 137 C CG2 . THR A 1 20 ? -1.468 7.592 21.246 1.00 57.60 ? 20 THR A CG2 1 +ATOM 138 N N . TYR A 1 21 ? 1.784 8.929 20.649 1.00 57.65 ? 21 TYR A N 1 +ATOM 139 C CA . TYR A 1 21 ? 2.468 10.196 20.916 1.00 57.65 ? 21 TYR A CA 1 +ATOM 140 C C . TYR A 1 21 ? 1.581 11.325 20.413 1.00 57.65 ? 21 TYR A C 1 +ATOM 141 O O . TYR A 1 21 ? 0.683 11.120 19.599 1.00 57.65 ? 21 TYR A O 1 +ATOM 142 C CB . TYR A 1 21 ? 3.799 10.331 20.154 1.00 63.74 ? 21 TYR A CB 1 +ATOM 143 C CG . TYR A 1 21 ? 4.810 9.204 20.258 1.00 63.74 ? 21 TYR A CG 1 +ATOM 144 C CD1 . TYR A 1 21 ? 4.560 7.953 19.684 1.00 63.74 ? 21 TYR A CD1 1 +ATOM 145 C CD2 . TYR A 1 21 ? 6.060 9.422 20.845 1.00 63.74 ? 21 TYR A CD2 1 +ATOM 146 C CE1 . TYR A 1 21 ? 5.525 6.959 19.691 1.00 63.74 ? 21 TYR A CE1 1 +ATOM 147 C CE2 . TYR A 1 21 ? 7.031 8.434 20.854 1.00 63.74 ? 21 TYR A CE2 1 +ATOM 148 C CZ . TYR A 1 21 ? 6.759 7.209 20.271 1.00 63.74 ? 21 TYR A CZ 1 +ATOM 149 O OH . TYR A 1 21 ? 7.735 6.240 20.243 1.00 63.74 ? 21 TYR A OH 1 +ATOM 150 N N . THR A 1 22 ? 1.867 12.525 20.893 1.00 67.33 ? 22 THR A N 1 +ATOM 151 C CA . THR A 1 22 ? 1.136 13.706 20.489 1.00 67.33 ? 22 THR A CA 1 +ATOM 152 C C . THR A 1 22 ? 2.205 14.758 20.356 1.00 67.33 ? 22 THR A C 1 +ATOM 153 O O . THR A 1 22 ? 2.833 15.129 21.342 1.00 67.33 ? 22 THR A O 1 +ATOM 154 C CB . THR A 1 22 ? 0.144 14.146 21.558 1.00 65.03 ? 22 THR A CB 1 +ATOM 155 O OG1 . THR A 1 22 ? -0.589 13.007 22.026 1.00 65.03 ? 22 THR A OG1 1 +ATOM 156 C CG2 . THR A 1 22 ? -0.826 15.159 20.984 1.00 65.03 ? 22 THR A CG2 1 +ATOM 157 N N . VAL A 1 23 ? 2.444 15.212 19.135 1.00 71.70 ? 23 VAL A N 1 +ATOM 158 C CA . VAL A 1 23 ? 3.462 16.223 18.921 1.00 71.70 ? 23 VAL A CA 1 +ATOM 159 C C . VAL A 1 23 ? 2.881 17.499 18.343 1.00 71.70 ? 23 VAL A C 1 +ATOM 160 O O . VAL A 1 23 ? 1.714 17.547 17.935 1.00 71.70 ? 23 VAL A O 1 +ATOM 161 C CB . VAL A 1 23 ? 4.574 15.719 17.970 1.00 70.78 ? 23 VAL A CB 1 +ATOM 162 C CG1 . VAL A 1 23 ? 5.298 14.540 18.591 1.00 70.78 ? 23 VAL A CG1 1 +ATOM 163 C CG2 . VAL A 1 23 ? 3.976 15.342 16.638 1.00 70.78 ? 23 VAL A CG2 1 +ATOM 164 N N . THR A 1 24 ? 3.717 18.531 18.327 1.00 83.96 ? 24 THR A N 1 +ATOM 165 C CA . THR A 1 24 ? 3.369 19.839 17.793 1.00 83.96 ? 24 THR A CA 1 +ATOM 166 C C . THR A 1 24 ? 4.686 20.523 17.473 1.00 83.96 ? 24 THR A C 1 +ATOM 167 O O . THR A 1 24 ? 5.175 21.315 18.270 1.00 83.96 ? 24 THR A O 1 +ATOM 168 C CB . THR A 1 24 ? 2.604 20.696 18.831 1.00 95.26 ? 24 THR A CB 1 +ATOM 169 O OG1 . THR A 1 24 ? 1.323 20.110 19.084 1.00 95.26 ? 24 THR A OG1 1 +ATOM 170 C CG2 . THR A 1 24 ? 2.399 22.114 18.317 1.00 95.26 ? 24 THR A CG2 1 +ATOM 171 N N . THR A 1 25 ? 5.280 20.203 16.327 1.00 136.13 ? 25 THR A N 1 +ATOM 172 C CA . THR A 1 25 ? 6.552 20.818 15.953 1.00 136.13 ? 25 THR A CA 1 +ATOM 173 C C . THR A 1 25 ? 7.033 20.385 14.576 1.00 136.13 ? 25 THR A C 1 +ATOM 174 O O . THR A 1 25 ? 7.608 21.179 13.834 1.00 136.13 ? 25 THR A O 1 +ATOM 175 C CB . THR A 1 25 ? 7.703 20.449 16.943 1.00 146.88 ? 25 THR A CB 1 +ATOM 176 O OG1 . THR A 1 25 ? 7.172 20.180 18.244 1.00 146.88 ? 25 THR A OG1 1 +ATOM 177 C CG2 . THR A 1 25 ? 8.697 21.598 17.058 1.00 146.88 ? 25 THR A CG2 1 +ATOM 178 N N . GLU A 1 26 ? 6.796 19.119 14.247 1.00 187.15 ? 26 GLU A N 1 +ATOM 179 C CA . GLU A 1 26 ? 7.267 18.538 12.994 1.00 187.15 ? 26 GLU A CA 1 +ATOM 180 C C . GLU A 1 26 ? 8.782 18.481 13.170 1.00 187.15 ? 26 GLU A C 1 +ATOM 181 O O . GLU A 1 26 ? 9.508 17.917 12.351 1.00 187.15 ? 26 GLU A O 1 +ATOM 182 C CB . GLU A 1 26 ? 6.892 19.396 11.781 1.00 134.71 ? 26 GLU A CB 1 +ATOM 183 C CG . GLU A 1 26 ? 7.383 18.807 10.458 1.00 97.04 ? 26 GLU A CG 1 +ATOM 184 C CD . GLU A 1 26 ? 6.713 19.422 9.243 1.00 97.04 ? 26 GLU A CD 1 +ATOM 185 O OE1 . GLU A 1 26 ? 6.740 20.662 9.115 1.00 97.04 ? 26 GLU A OE1 1 +ATOM 186 O OE2 . GLU A 1 26 ? 6.165 18.662 8.416 1.00 97.04 ? 26 GLU A OE2 1 +ATOM 187 N N . SER A 1 27 ? 9.234 19.085 14.266 1.00 114.54 ? 27 SER A N 1 +ATOM 188 C CA . SER A 1 27 ? 10.637 19.110 14.647 1.00 114.54 ? 27 SER A CA 1 +ATOM 189 C C . SER A 1 27 ? 10.764 18.025 15.711 1.00 114.54 ? 27 SER A C 1 +ATOM 190 O O . SER A 1 27 ? 11.634 17.158 15.624 1.00 114.54 ? 27 SER A O 1 +ATOM 191 C CB . SER A 1 27 ? 11.008 20.463 15.229 1.00 116.53 ? 27 SER A CB 1 +ATOM 192 N N . GLU A 1 28 ? 9.885 18.071 16.713 1.00 113.18 ? 28 GLU A N 1 +ATOM 193 C CA . GLU A 1 28 ? 9.900 17.055 17.762 1.00 113.18 ? 28 GLU A CA 1 +ATOM 194 C C . GLU A 1 28 ? 9.258 15.810 17.168 1.00 113.18 ? 28 GLU A C 1 +ATOM 195 O O . GLU A 1 28 ? 9.094 14.794 17.842 1.00 200.03 ? 28 GLU A O 1 +ATOM 196 C CB . GLU A 1 28 ? 9.116 17.505 19.003 1.00 112.19 ? 28 GLU A CB 1 +ATOM 197 C CG . GLU A 1 28 ? 7.596 17.557 18.841 1.00 112.19 ? 28 GLU A CG 1 +ATOM 198 C CD . GLU A 1 28 ? 6.879 17.960 20.129 1.00 112.19 ? 28 GLU A CD 1 +ATOM 199 O OE1 . GLU A 1 28 ? 5.778 18.547 20.047 1.00 112.19 ? 28 GLU A OE1 1 +ATOM 200 O OE2 . GLU A 1 28 ? 7.407 17.679 21.226 1.00 112.19 ? 28 GLU A OE2 1 +ATOM 201 N N . LEU A 1 29 ? 8.883 15.919 15.895 1.00 97.20 ? 29 LEU A N 1 +ATOM 202 C CA . LEU A 1 29 ? 8.286 14.820 15.147 1.00 97.20 ? 29 LEU A CA 1 +ATOM 203 C C . LEU A 1 29 ? 9.475 14.012 14.649 1.00 97.20 ? 29 LEU A C 1 +ATOM 204 O O . LEU A 1 29 ? 9.456 12.784 14.643 1.00 97.20 ? 29 LEU A O 1 +ATOM 205 C CB . LEU A 1 29 ? 7.493 15.350 13.947 1.00 66.59 ? 29 LEU A CB 1 +ATOM 206 C CG . LEU A 1 29 ? 6.452 14.423 13.296 1.00 66.59 ? 29 LEU A CG 1 +ATOM 207 C CD1 . LEU A 1 29 ? 6.087 14.961 11.915 1.00 66.59 ? 29 LEU A CD1 1 +ATOM 208 C CD2 . LEU A 1 29 ? 6.997 13.012 13.162 1.00 66.59 ? 29 LEU A CD2 1 +ATOM 209 N N . GLN A 1 30 ? 10.512 14.723 14.225 1.00 113.13 ? 30 GLN A N 1 +ATOM 210 C CA . GLN A 1 30 ? 11.724 14.081 13.747 1.00 113.13 ? 30 GLN A CA 1 +ATOM 211 C C . GLN A 1 30 ? 12.310 13.296 14.916 1.00 113.13 ? 30 GLN A C 1 +ATOM 212 O O . GLN A 1 30 ? 13.031 12.315 14.725 1.00 113.13 ? 30 GLN A O 1 +ATOM 213 C CB . GLN A 1 30 ? 12.718 15.135 13.256 1.00 67.53 ? 30 GLN A CB 1 +ATOM 214 N N . LYS A 1 31 ? 11.984 13.738 16.128 1.00 75.23 ? 31 LYS A N 1 +ATOM 215 C CA . LYS A 1 31 ? 12.465 13.094 17.348 1.00 75.23 ? 31 LYS A CA 1 +ATOM 216 C C . LYS A 1 31 ? 11.731 11.776 17.556 1.00 75.23 ? 31 LYS A C 1 +ATOM 217 O O . LYS A 1 31 ? 12.331 10.751 17.887 1.00 75.23 ? 31 LYS A O 1 +ATOM 218 C CB . LYS A 1 31 ? 12.247 14.016 18.550 1.00 80.64 ? 31 LYS A CB 1 +ATOM 219 N N . VAL A 1 32 ? 10.420 11.824 17.360 1.00 56.38 ? 32 VAL A N 1 +ATOM 220 C CA . VAL A 1 32 ? 9.562 10.658 17.497 1.00 56.38 ? 32 VAL A CA 1 +ATOM 221 C C . VAL A 1 32 ? 9.898 9.703 16.364 1.00 56.38 ? 32 VAL A C 1 +ATOM 222 O O . VAL A 1 32 ? 10.051 8.496 16.569 1.00 56.38 ? 32 VAL A O 1 +ATOM 223 C CB . VAL A 1 32 ? 8.090 11.065 17.376 1.00 46.58 ? 32 VAL A CB 1 +ATOM 224 C CG1 . VAL A 1 32 ? 7.202 9.830 17.366 1.00 46.58 ? 32 VAL A CG1 1 +ATOM 225 C CG2 . VAL A 1 32 ? 7.725 12.000 18.532 1.00 46.58 ? 32 VAL A CG2 1 +ATOM 226 N N . LEU A 1 33 ? 10.016 10.262 15.162 1.00 55.92 ? 33 LEU A N 1 +ATOM 227 C CA . LEU A 1 33 ? 10.340 9.470 13.992 1.00 55.92 ? 33 LEU A CA 1 +ATOM 228 C C . LEU A 1 33 ? 11.608 8.685 14.235 1.00 55.92 ? 33 LEU A C 1 +ATOM 229 O O . LEU A 1 33 ? 11.579 7.454 14.286 1.00 55.92 ? 33 LEU A O 1 +ATOM 230 C CB . LEU A 1 33 ? 10.523 10.363 12.773 1.00 52.98 ? 33 LEU A CB 1 +ATOM 231 C CG . LEU A 1 33 ? 9.242 10.835 12.080 1.00 52.98 ? 33 LEU A CG 1 +ATOM 232 C CD1 . LEU A 1 33 ? 9.641 11.471 10.750 1.00 52.98 ? 33 LEU A CD1 1 +ATOM 233 C CD2 . LEU A 1 33 ? 8.273 9.666 11.846 1.00 52.98 ? 33 LEU A CD2 1 +ATOM 234 N N . ASN A 1 34 ? 12.719 9.404 14.389 1.00 69.48 ? 34 ASN A N 1 +ATOM 235 C CA . ASN A 1 34 ? 14.011 8.779 14.631 1.00 69.48 ? 34 ASN A CA 1 +ATOM 236 C C . ASN A 1 34 ? 13.870 7.727 15.722 1.00 69.48 ? 34 ASN A C 1 +ATOM 237 O O . ASN A 1 34 ? 14.350 6.605 15.584 1.00 69.48 ? 34 ASN A O 1 +ATOM 238 C CB . ASN A 1 34 ? 15.039 9.844 15.038 1.00 46.71 ? 34 ASN A CB 1 +ATOM 239 N N . GLU A 1 35 ? 13.180 8.098 16.795 1.00 62.44 ? 35 GLU A N 1 +ATOM 240 C CA . GLU A 1 35 ? 12.972 7.212 17.938 1.00 62.44 ? 35 GLU A CA 1 +ATOM 241 C C . GLU A 1 35 ? 12.233 5.917 17.574 1.00 62.44 ? 35 GLU A C 1 +ATOM 242 O O . GLU A 1 35 ? 12.580 4.830 18.057 1.00 62.44 ? 35 GLU A O 1 +ATOM 243 C CB . GLU A 1 35 ? 12.207 7.956 19.039 1.00 129.81 ? 35 GLU A CB 1 +ATOM 244 C CG . GLU A 1 35 ? 11.750 7.084 20.206 1.00 114.46 ? 35 GLU A CG 1 +ATOM 245 C CD . GLU A 1 35 ? 11.028 7.870 21.289 1.00 114.46 ? 35 GLU A CD 1 +ATOM 246 O OE1 . GLU A 1 35 ? 10.356 7.237 22.131 1.00 114.46 ? 35 GLU A OE1 1 +ATOM 247 O OE2 . GLU A 1 35 ? 11.141 9.116 21.298 1.00 114.46 ? 35 GLU A OE2 1 +ATOM 248 N N . LEU A 1 36 ? 11.213 6.021 16.730 1.00 59.14 ? 36 LEU A N 1 +ATOM 249 C CA . LEU A 1 36 ? 10.469 4.828 16.342 1.00 59.14 ? 36 LEU A CA 1 +ATOM 250 C C . LEU A 1 36 ? 11.321 3.923 15.466 1.00 59.14 ? 36 LEU A C 1 +ATOM 251 O O . LEU A 1 36 ? 11.229 2.702 15.544 1.00 59.14 ? 36 LEU A O 1 +ATOM 252 C CB . LEU A 1 36 ? 9.217 5.227 15.613 1.00 61.28 ? 36 LEU A CB 1 +HETATM 253 N N . MSE A 1 37 ? 12.136 4.544 14.621 1.00 45.85 ? 37 MSE A N 1 +HETATM 254 C CA . MSE A 1 37 ? 13.021 3.824 13.725 1.00 45.85 ? 37 MSE A CA 1 +HETATM 255 C C . MSE A 1 37 ? 13.869 2.835 14.511 1.00 45.85 ? 37 MSE A C 1 +HETATM 256 O O . MSE A 1 37 ? 14.082 1.700 14.085 1.00 45.85 ? 37 MSE A O 1 +HETATM 257 C CB . MSE A 1 37 ? 13.922 4.804 12.968 1.00 57.27 ? 37 MSE A CB 1 +HETATM 258 C CG . MSE A 1 37 ? 13.203 5.576 11.873 1.00 57.27 ? 37 MSE A CG 1 +HETATM 259 SE SE . MSE A 1 37 ? 14.347 6.471 10.802 1.00 57.27 ? 37 MSE A SE 1 +HETATM 260 C CE . MSE A 1 37 ? 14.638 5.266 9.472 1.00 57.27 ? 37 MSE A CE 1 +ATOM 261 N N . ASP A 1 38 ? 14.338 3.255 15.679 1.00 56.30 ? 38 ASP A N 1 +ATOM 262 C CA . ASP A 1 38 ? 15.156 2.372 16.497 1.00 56.30 ? 38 ASP A CA 1 +ATOM 263 C C . ASP A 1 38 ? 14.343 1.250 17.135 1.00 56.30 ? 38 ASP A C 1 +ATOM 264 O O . ASP A 1 38 ? 14.695 0.070 17.008 1.00 56.30 ? 38 ASP A O 1 +ATOM 265 C CB . ASP A 1 38 ? 15.901 3.179 17.556 1.00 94.79 ? 38 ASP A CB 1 +ATOM 266 C CG . ASP A 1 38 ? 16.859 4.191 16.942 1.00 94.79 ? 38 ASP A CG 1 +ATOM 267 O OD1 . ASP A 1 38 ? 17.680 3.809 16.079 1.00 94.79 ? 38 ASP A OD1 1 +ATOM 268 O OD2 . ASP A 1 38 ? 16.791 5.377 17.317 1.00 94.79 ? 38 ASP A OD2 1 +ATOM 269 N N . TYR A 1 39 ? 13.249 1.597 17.806 1.00 57.17 ? 39 TYR A N 1 +ATOM 270 C CA . TYR A 1 39 ? 12.420 0.561 18.424 1.00 57.17 ? 39 TYR A CA 1 +ATOM 271 C C . TYR A 1 39 ? 12.126 -0.564 17.425 1.00 57.17 ? 39 TYR A C 1 +ATOM 272 O O . TYR A 1 39 ? 12.195 -1.745 17.771 1.00 104.80 ? 39 TYR A O 1 +ATOM 273 C CB . TYR A 1 39 ? 11.086 1.135 18.915 1.00 92.26 ? 39 TYR A CB 1 +ATOM 274 C CG . TYR A 1 39 ? 11.163 2.049 20.123 1.00 92.26 ? 39 TYR A CG 1 +ATOM 275 C CD1 . TYR A 1 39 ? 11.708 1.607 21.333 1.00 92.26 ? 39 TYR A CD1 1 +ATOM 276 C CD2 . TYR A 1 39 ? 10.645 3.346 20.069 1.00 92.26 ? 39 TYR A CD2 1 +ATOM 277 C CE1 . TYR A 1 39 ? 11.732 2.439 22.460 1.00 92.26 ? 39 TYR A CE1 1 +ATOM 278 C CE2 . TYR A 1 39 ? 10.661 4.179 21.186 1.00 92.26 ? 39 TYR A CE2 1 +ATOM 279 C CZ . TYR A 1 39 ? 11.204 3.724 22.373 1.00 92.26 ? 39 TYR A CZ 1 +ATOM 280 O OH . TYR A 1 39 ? 11.218 4.565 23.462 1.00 92.26 ? 39 TYR A OH 1 +ATOM 281 N N . ILE A 1 40 ? 11.805 -0.192 16.186 1.00 75.79 ? 40 ILE A N 1 +ATOM 282 C CA . ILE A 1 40 ? 11.467 -1.188 15.177 1.00 75.79 ? 40 ILE A CA 1 +ATOM 283 C C . ILE A 1 40 ? 12.677 -1.933 14.605 1.00 75.79 ? 40 ILE A C 1 +ATOM 284 O O . ILE A 1 40 ? 12.570 -3.121 14.295 1.00 75.79 ? 40 ILE A O 1 +ATOM 285 C CB . ILE A 1 40 ? 10.603 -0.569 14.031 1.00 76.70 ? 40 ILE A CB 1 +ATOM 286 C CG1 . ILE A 1 40 ? 11.482 0.006 12.931 1.00 76.70 ? 40 ILE A CG1 1 +ATOM 287 C CG2 . ILE A 1 40 ? 9.709 0.512 14.582 1.00 76.70 ? 40 ILE A CG2 1 +ATOM 288 C CD1 . ILE A 1 40 ? 11.700 -0.961 11.782 1.00 76.70 ? 40 ILE A CD1 1 +ATOM 289 N N . LYS A 1 41 ? 13.817 -1.255 14.454 1.00 65.22 ? 41 LYS A N 1 +ATOM 290 C CA . LYS A 1 41 ? 15.015 -1.937 13.960 1.00 65.22 ? 41 LYS A CA 1 +ATOM 291 C C . LYS A 1 41 ? 15.238 -3.089 14.927 1.00 65.22 ? 41 LYS A C 1 +ATOM 292 O O . LYS A 1 41 ? 15.336 -4.253 14.534 1.00 65.22 ? 41 LYS A O 1 +ATOM 293 C CB . LYS A 1 41 ? 16.245 -1.024 13.999 1.00 66.42 ? 41 LYS A CB 1 +ATOM 294 C CG . LYS A 1 41 ? 16.441 -0.159 12.762 1.00 66.42 ? 41 LYS A CG 1 +ATOM 295 C CD . LYS A 1 41 ? 17.635 0.777 12.923 1.00 66.42 ? 41 LYS A CD 1 +ATOM 296 C CE . LYS A 1 41 ? 17.801 1.692 11.713 1.00 66.42 ? 41 LYS A CE 1 +ATOM 297 N NZ . LYS A 1 41 ? 18.856 2.725 11.913 1.00 66.42 ? 41 LYS A NZ 1 +ATOM 298 N N . LYS A 1 42 ? 15.287 -2.736 16.207 1.00 55.06 ? 42 LYS A N 1 +ATOM 299 C CA . LYS A 1 42 ? 15.498 -3.693 17.278 1.00 55.06 ? 42 LYS A CA 1 +ATOM 300 C C . LYS A 1 42 ? 14.502 -4.852 17.267 1.00 55.06 ? 42 LYS A C 1 +ATOM 301 O O . LYS A 1 42 ? 14.892 -6.013 17.198 1.00 55.06 ? 42 LYS A O 1 +ATOM 302 C CB . LYS A 1 42 ? 15.437 -2.966 18.625 1.00 200.03 ? 42 LYS A CB 1 +ATOM 303 C CG . LYS A 1 42 ? 15.692 -3.852 19.830 1.00 186.63 ? 42 LYS A CG 1 +ATOM 304 C CD . LYS A 1 42 ? 15.652 -3.051 21.117 1.00 186.63 ? 42 LYS A CD 1 +ATOM 305 C CE . LYS A 1 42 ? 15.900 -3.945 22.320 1.00 139.05 ? 42 LYS A CE 1 +ATOM 306 N NZ . LYS A 1 42 ? 17.216 -4.640 22.230 1.00 139.05 ? 42 LYS A NZ 1 +ATOM 307 N N . GLN A 1 43 ? 13.214 -4.548 17.331 1.00 78.34 ? 43 GLN A N 1 +ATOM 308 C CA . GLN A 1 43 ? 12.211 -5.606 17.359 1.00 78.34 ? 43 GLN A CA 1 +ATOM 309 C C . GLN A 1 43 ? 12.149 -6.428 16.073 1.00 78.34 ? 43 GLN A C 1 +ATOM 310 O O . GLN A 1 43 ? 11.838 -7.621 16.111 1.00 78.34 ? 43 GLN A O 1 +ATOM 311 C CB . GLN A 1 43 ? 10.832 -5.013 17.677 1.00 126.98 ? 43 GLN A CB 1 +ATOM 312 C CG . GLN A 1 43 ? 10.169 -5.609 18.919 1.00 126.98 ? 43 GLN A CG 1 +ATOM 313 C CD . GLN A 1 43 ? 9.832 -7.084 18.758 1.00 126.98 ? 43 GLN A CD 1 +ATOM 314 O OE1 . GLN A 1 43 ? 8.990 -7.452 17.940 1.00 126.98 ? 43 GLN A OE1 1 +ATOM 315 N NE2 . GLN A 1 43 ? 10.495 -7.935 19.537 1.00 126.98 ? 43 GLN A NE2 1 +ATOM 316 N N . GLY A 1 44 ? 12.452 -5.789 14.942 1.00 55.22 ? 44 GLY A N 1 +ATOM 317 C CA . GLY A 1 44 ? 12.412 -6.472 13.661 1.00 55.22 ? 44 GLY A CA 1 +ATOM 318 C C . GLY A 1 44 ? 11.154 -7.305 13.501 1.00 55.22 ? 44 GLY A C 1 +ATOM 319 O O . GLY A 1 44 ? 11.230 -8.524 13.317 1.00 55.22 ? 44 GLY A O 1 +ATOM 320 N N . ALA A 1 45 ? 9.991 -6.650 13.567 1.00 48.70 ? 45 ALA A N 1 +ATOM 321 C CA . ALA A 1 45 ? 8.706 -7.334 13.446 1.00 48.70 ? 45 ALA A CA 1 +ATOM 322 C C . ALA A 1 45 ? 8.267 -7.491 12.002 1.00 48.70 ? 45 ALA A C 1 +ATOM 323 O O . ALA A 1 45 ? 8.625 -6.691 11.135 1.00 48.70 ? 45 ALA A O 1 +ATOM 324 C CB . ALA A 1 45 ? 7.651 -6.587 14.227 1.00 42.35 ? 45 ALA A CB 1 +ATOM 325 N N . LYS A 1 46 ? 7.482 -8.527 11.748 1.00 60.45 ? 46 LYS A N 1 +ATOM 326 C CA . LYS A 1 46 ? 7.002 -8.787 10.405 1.00 60.45 ? 46 LYS A CA 1 +ATOM 327 C C . LYS A 1 46 ? 6.082 -7.662 9.961 1.00 60.45 ? 46 LYS A C 1 +ATOM 328 O O . LYS A 1 46 ? 6.256 -7.102 8.881 1.00 60.45 ? 46 LYS A O 1 +ATOM 329 C CB . LYS A 1 46 ? 6.266 -10.122 10.362 1.00 100.71 ? 46 LYS A CB 1 +ATOM 330 N N . ARG A 1 47 ? 5.116 -7.324 10.808 1.00 55.30 ? 47 ARG A N 1 +ATOM 331 C CA . ARG A 1 47 ? 4.160 -6.279 10.484 1.00 55.30 ? 47 ARG A CA 1 +ATOM 332 C C . ARG A 1 47 ? 4.244 -5.060 11.406 1.00 55.30 ? 47 ARG A C 1 +ATOM 333 O O . ARG A 1 47 ? 4.294 -5.187 12.625 1.00 55.30 ? 47 ARG A O 1 +ATOM 334 C CB . ARG A 1 47 ? 2.747 -6.860 10.497 1.00 49.32 ? 47 ARG A CB 1 +ATOM 335 N N . VAL A 1 48 ? 4.257 -3.875 10.796 1.00 43.03 ? 48 VAL A N 1 +ATOM 336 C CA . VAL A 1 48 ? 4.320 -2.600 11.511 1.00 43.03 ? 48 VAL A CA 1 +ATOM 337 C C . VAL A 1 48 ? 3.326 -1.588 10.915 1.00 43.03 ? 48 VAL A C 1 +ATOM 338 O O . VAL A 1 48 ? 3.297 -1.359 9.715 1.00 43.03 ? 48 VAL A O 1 +ATOM 339 C CB . VAL A 1 48 ? 5.742 -2.008 11.457 1.00 31.14 ? 48 VAL A CB 1 +ATOM 340 C CG1 . VAL A 1 48 ? 5.702 -0.529 11.831 1.00 31.14 ? 48 VAL A CG1 1 +ATOM 341 C CG2 . VAL A 1 48 ? 6.653 -2.775 12.414 1.00 31.14 ? 48 VAL A CG2 1 +ATOM 342 N N . ARG A 1 49 ? 2.520 -0.975 11.776 1.00 36.65 ? 49 ARG A N 1 +ATOM 343 C CA . ARG A 1 49 ? 1.516 -0.009 11.362 1.00 36.65 ? 49 ARG A CA 1 +ATOM 344 C C . ARG A 1 49 ? 1.740 1.333 12.036 1.00 36.65 ? 49 ARG A C 1 +ATOM 345 O O . ARG A 1 49 ? 2.013 1.414 13.231 1.00 36.65 ? 49 ARG A O 1 +ATOM 346 C CB . ARG A 1 49 ? 0.124 -0.512 11.726 1.00 83.41 ? 49 ARG A CB 1 +ATOM 347 C CG . ARG A 1 49 ? -1.002 0.196 10.999 1.00 73.04 ? 49 ARG A CG 1 +ATOM 348 C CD . ARG A 1 49 ? -2.287 0.153 11.807 1.00 73.04 ? 49 ARG A CD 1 +ATOM 349 N NE . ARG A 1 49 ? -2.459 -1.126 12.495 1.00 73.04 ? 49 ARG A NE 1 +ATOM 350 C CZ . ARG A 1 49 ? -3.229 -1.302 13.569 1.00 73.04 ? 49 ARG A CZ 1 +ATOM 351 N NH1 . ARG A 1 49 ? -3.910 -0.278 14.083 1.00 73.04 ? 49 ARG A NH1 1 +ATOM 352 N NH2 . ARG A 1 49 ? -3.304 -2.499 14.147 1.00 73.04 ? 49 ARG A NH2 1 +ATOM 353 N N . ILE A 1 50 ? 1.630 2.395 11.252 1.00 31.16 ? 50 ILE A N 1 +ATOM 354 C CA . ILE A 1 50 ? 1.776 3.725 11.785 1.00 31.16 ? 50 ILE A CA 1 +ATOM 355 C C . ILE A 1 50 ? 0.705 4.599 11.157 1.00 31.16 ? 50 ILE A C 1 +ATOM 356 O O . ILE A 1 50 ? 0.578 4.660 9.933 1.00 31.16 ? 50 ILE A O 1 +ATOM 357 C CB . ILE A 1 50 ? 3.147 4.316 11.465 1.00 26.84 ? 50 ILE A CB 1 +ATOM 358 C CG1 . ILE A 1 50 ? 4.236 3.406 12.024 1.00 26.84 ? 50 ILE A CG1 1 +ATOM 359 C CG2 . ILE A 1 50 ? 3.254 5.722 12.079 1.00 26.84 ? 50 ILE A CG2 1 +ATOM 360 C CD1 . ILE A 1 50 ? 5.611 4.014 11.978 1.00 26.84 ? 50 ILE A CD1 1 +ATOM 361 N N . SER A 1 51 ? -0.093 5.239 12.002 1.00 37.07 ? 51 SER A N 1 +ATOM 362 C CA . SER A 1 51 ? -1.128 6.139 11.519 1.00 37.07 ? 51 SER A CA 1 +ATOM 363 C C . SER A 1 51 ? -0.951 7.489 12.205 1.00 37.07 ? 51 SER A C 1 +ATOM 364 O O . SER A 1 51 ? -0.674 7.573 13.402 1.00 37.07 ? 51 SER A O 1 +ATOM 365 C CB . SER A 1 51 ? -2.522 5.559 11.757 1.00 38.78 ? 51 SER A CB 1 +ATOM 366 O OG . SER A 1 51 ? -2.672 5.197 13.104 1.00 38.78 ? 51 SER A OG 1 +ATOM 367 N N . ILE A 1 52 ? -1.067 8.538 11.408 1.00 47.52 ? 52 ILE A N 1 +ATOM 368 C CA . ILE A 1 52 ? -0.899 9.893 11.887 1.00 47.52 ? 52 ILE A CA 1 +ATOM 369 C C . ILE A 1 52 ? -2.116 10.712 11.531 1.00 47.52 ? 52 ILE A C 1 +ATOM 370 O O . ILE A 1 52 ? -2.486 10.825 10.359 1.00 47.52 ? 52 ILE A O 1 +ATOM 371 C CB . ILE A 1 52 ? 0.341 10.536 11.257 1.00 41.87 ? 52 ILE A CB 1 +ATOM 372 C CG1 . ILE A 1 52 ? 1.592 9.886 11.839 1.00 41.87 ? 52 ILE A CG1 1 +ATOM 373 C CG2 . ILE A 1 52 ? 0.336 12.039 11.479 1.00 41.87 ? 52 ILE A CG2 1 +ATOM 374 C CD1 . ILE A 1 52 ? 2.843 10.297 11.141 1.00 41.87 ? 52 ILE A CD1 1 +ATOM 375 N N . THR A 1 53 ? -2.753 11.261 12.556 1.00 55.53 ? 53 THR A N 1 +ATOM 376 C CA . THR A 1 53 ? -3.922 12.081 12.351 1.00 55.53 ? 53 THR A CA 1 +ATOM 377 C C . THR A 1 53 ? -3.415 13.493 12.189 1.00 55.53 ? 53 THR A C 1 +ATOM 378 O O . THR A 1 53 ? -2.919 14.098 13.139 1.00 55.53 ? 53 THR A O 1 +ATOM 379 C CB . THR A 1 53 ? -4.866 12.023 13.538 1.00 54.19 ? 53 THR A CB 1 +ATOM 380 O OG1 . THR A 1 53 ? -5.409 10.702 13.658 1.00 54.19 ? 53 THR A OG1 1 +ATOM 381 C CG2 . THR A 1 53 ? -5.997 13.003 13.334 1.00 54.19 ? 53 THR A CG2 1 +ATOM 382 N N . ALA A 1 54 ? -3.523 13.994 10.965 1.00 53.46 ? 54 ALA A N 1 +ATOM 383 C CA . ALA A 1 54 ? -3.079 15.335 10.624 1.00 53.46 ? 54 ALA A CA 1 +ATOM 384 C C . ALA A 1 54 ? -4.249 16.316 10.700 1.00 53.46 ? 54 ALA A C 1 +ATOM 385 O O . ALA A 1 54 ? -5.389 15.916 10.939 1.00 53.46 ? 54 ALA A O 1 +ATOM 386 C CB . ALA A 1 54 ? -2.488 15.331 9.219 1.00 54.30 ? 54 ALA A CB 1 +ATOM 387 N N . ARG A 1 55 ? -3.960 17.596 10.490 1.00 74.08 ? 55 ARG A N 1 +ATOM 388 C CA . ARG A 1 55 ? -4.983 18.636 10.528 1.00 74.08 ? 55 ARG A CA 1 +ATOM 389 C C . ARG A 1 55 ? -5.731 18.711 9.197 1.00 74.08 ? 55 ARG A C 1 +ATOM 390 O O . ARG A 1 55 ? -6.929 18.979 9.170 1.00 74.08 ? 55 ARG A O 1 +ATOM 391 C CB . ARG A 1 55 ? -4.344 19.985 10.857 1.00 53.00 ? 55 ARG A CB 1 +ATOM 392 N N . THR A 1 56 ? -5.017 18.477 8.098 1.00 61.37 ? 56 THR A N 1 +ATOM 393 C CA . THR A 1 56 ? -5.615 18.505 6.762 1.00 61.37 ? 56 THR A CA 1 +ATOM 394 C C . THR A 1 56 ? -5.102 17.346 5.926 1.00 61.37 ? 56 THR A C 1 +ATOM 395 O O . THR A 1 56 ? -3.968 16.892 6.107 1.00 61.37 ? 56 THR A O 1 +ATOM 396 C CB . THR A 1 56 ? -5.281 19.807 6.003 1.00 61.95 ? 56 THR A CB 1 +ATOM 397 O OG1 . THR A 1 56 ? -3.861 19.944 5.857 1.00 61.95 ? 56 THR A OG1 1 +ATOM 398 C CG2 . THR A 1 56 ? -5.818 20.995 6.750 1.00 61.95 ? 56 THR A CG2 1 +ATOM 399 N N . LYS A 1 57 ? -5.929 16.874 4.998 1.00 79.80 ? 57 LYS A N 1 +ATOM 400 C CA . LYS A 1 57 ? -5.522 15.766 4.148 1.00 79.80 ? 57 LYS A CA 1 +ATOM 401 C C . LYS A 1 57 ? -4.219 16.045 3.395 1.00 79.80 ? 57 LYS A C 1 +ATOM 402 O O . LYS A 1 57 ? -3.422 15.135 3.192 1.00 79.80 ? 57 LYS A O 1 +ATOM 403 C CB . LYS A 1 57 ? -6.635 15.394 3.164 1.00 56.21 ? 57 LYS A CB 1 +ATOM 404 C CG . LYS A 1 57 ? -6.161 14.470 2.051 1.00 52.05 ? 57 LYS A CG 1 +ATOM 405 C CD . LYS A 1 57 ? -7.236 13.507 1.571 1.00 52.05 ? 57 LYS A CD 1 +ATOM 406 C CE . LYS A 1 57 ? -6.718 12.676 0.392 1.00 52.05 ? 57 LYS A CE 1 +ATOM 407 N NZ . LYS A 1 57 ? -7.658 11.597 -0.067 1.00 52.05 ? 57 LYS A NZ 1 +ATOM 408 N N . LYS A 1 58 ? -3.990 17.291 2.986 1.00 61.25 ? 58 LYS A N 1 +ATOM 409 C CA . LYS A 1 58 ? -2.758 17.624 2.269 1.00 61.25 ? 58 LYS A CA 1 +ATOM 410 C C . LYS A 1 58 ? -1.566 17.464 3.204 1.00 61.25 ? 58 LYS A C 1 +ATOM 411 O O . LYS A 1 58 ? -0.433 17.274 2.764 1.00 61.25 ? 58 LYS A O 1 +ATOM 412 C CB . LYS A 1 58 ? -2.802 19.055 1.719 1.00 120.41 ? 58 LYS A CB 1 +ATOM 413 C CG . LYS A 1 58 ? -3.869 19.283 0.655 1.00 90.99 ? 58 LYS A CG 1 +ATOM 414 C CD . LYS A 1 58 ? -3.473 20.388 -0.316 1.00 90.99 ? 58 LYS A CD 1 +ATOM 415 C CE . LYS A 1 58 ? -2.310 19.959 -1.211 1.00 90.99 ? 58 LYS A CE 1 +ATOM 416 N NZ . LYS A 1 58 ? -2.662 18.828 -2.130 1.00 90.99 ? 58 LYS A NZ 1 +ATOM 417 N N . GLU A 1 59 ? -1.831 17.546 4.500 1.00 55.60 ? 59 GLU A N 1 +ATOM 418 C CA . GLU A 1 59 ? -0.786 17.378 5.496 1.00 55.60 ? 59 GLU A CA 1 +ATOM 419 C C . GLU A 1 59 ? -0.515 15.871 5.628 1.00 55.60 ? 59 GLU A C 1 +ATOM 420 O O . GLU A 1 59 ? 0.633 15.424 5.622 1.00 55.60 ? 59 GLU A O 1 +ATOM 421 C CB . GLU A 1 59 ? -1.254 17.956 6.835 1.00 68.19 ? 59 GLU A CB 1 +ATOM 422 C CG . GLU A 1 59 ? -0.299 17.742 7.985 1.00 68.19 ? 59 GLU A CG 1 +ATOM 423 C CD . GLU A 1 59 ? -0.721 18.494 9.232 1.00 68.19 ? 59 GLU A CD 1 +ATOM 424 O OE1 . GLU A 1 59 ? -1.867 18.296 9.694 1.00 68.19 ? 59 GLU A OE1 1 +ATOM 425 O OE2 . GLU A 1 59 ? 0.098 19.287 9.750 1.00 68.19 ? 59 GLU A OE2 1 +ATOM 426 N N . ALA A 1 60 ? -1.595 15.104 5.738 1.00 49.39 ? 60 ALA A N 1 +ATOM 427 C CA . ALA A 1 60 ? -1.528 13.653 5.853 1.00 49.39 ? 60 ALA A CA 1 +ATOM 428 C C . ALA A 1 60 ? -0.674 13.071 4.736 1.00 49.39 ? 60 ALA A C 1 +ATOM 429 O O . ALA A 1 60 ? -0.023 12.038 4.910 1.00 49.39 ? 60 ALA A O 1 +ATOM 430 C CB . ALA A 1 60 ? -2.920 13.069 5.769 1.00 34.98 ? 60 ALA A CB 1 +ATOM 431 N N . GLU A 1 61 ? -0.698 13.742 3.588 1.00 62.75 ? 61 GLU A N 1 +ATOM 432 C CA . GLU A 1 61 ? 0.058 13.318 2.423 1.00 62.75 ? 61 GLU A CA 1 +ATOM 433 C C . GLU A 1 61 ? 1.541 13.547 2.665 1.00 62.75 ? 61 GLU A C 1 +ATOM 434 O O . GLU A 1 61 ? 2.357 12.657 2.427 1.00 62.75 ? 61 GLU A O 1 +ATOM 435 C CB . GLU A 1 61 ? -0.412 14.092 1.189 1.00 78.01 ? 61 GLU A CB 1 +ATOM 436 C CG . GLU A 1 61 ? -1.853 13.778 0.793 1.00 51.13 ? 61 GLU A CG 1 +ATOM 437 C CD . GLU A 1 61 ? -2.387 14.677 -0.316 1.00 51.13 ? 61 GLU A CD 1 +ATOM 438 O OE1 . GLU A 1 61 ? -1.632 15.550 -0.805 1.00 51.13 ? 61 GLU A OE1 1 +ATOM 439 O OE2 . GLU A 1 61 ? -3.567 14.506 -0.695 1.00 51.13 ? 61 GLU A OE2 1 +ATOM 440 N N . LYS A 1 62 ? 1.894 14.733 3.151 1.00 51.31 ? 62 LYS A N 1 +ATOM 441 C CA . LYS A 1 62 ? 3.292 15.029 3.420 1.00 51.31 ? 62 LYS A CA 1 +ATOM 442 C C . LYS A 1 62 ? 3.824 13.998 4.406 1.00 51.31 ? 62 LYS A C 1 +ATOM 443 O O . LYS A 1 62 ? 4.972 13.578 4.315 1.00 51.31 ? 62 LYS A O 1 +ATOM 444 C CB . LYS A 1 62 ? 3.446 16.445 3.996 1.00 31.92 ? 62 LYS A CB 1 +ATOM 445 N N . PHE A 1 63 ? 2.977 13.589 5.346 1.00 47.90 ? 63 PHE A N 1 +ATOM 446 C CA . PHE A 1 63 ? 3.366 12.610 6.358 1.00 47.90 ? 63 PHE A CA 1 +ATOM 447 C C . PHE A 1 63 ? 3.498 11.225 5.770 1.00 47.90 ? 63 PHE A C 1 +ATOM 448 O O . PHE A 1 63 ? 4.373 10.463 6.164 1.00 47.90 ? 63 PHE A O 1 +ATOM 449 C CB . PHE A 1 63 ? 2.343 12.577 7.500 1.00 46.25 ? 63 PHE A CB 1 +ATOM 450 C CG . PHE A 1 63 ? 2.434 13.748 8.420 1.00 46.25 ? 63 PHE A CG 1 +ATOM 451 C CD1 . PHE A 1 63 ? 1.319 14.174 9.130 1.00 46.25 ? 63 PHE A CD1 1 +ATOM 452 C CD2 . PHE A 1 63 ? 3.638 14.420 8.591 1.00 46.25 ? 63 PHE A CD2 1 +ATOM 453 C CE1 . PHE A 1 63 ? 1.406 15.259 10.007 1.00 46.25 ? 63 PHE A CE1 1 +ATOM 454 C CE2 . PHE A 1 63 ? 3.740 15.496 9.455 1.00 46.25 ? 63 PHE A CE2 1 +ATOM 455 C CZ . PHE A 1 63 ? 2.628 15.922 10.166 1.00 46.25 ? 63 PHE A CZ 1 +ATOM 456 N N . ALA A 1 64 ? 2.610 10.899 4.839 1.00 43.04 ? 64 ALA A N 1 +ATOM 457 C CA . ALA A 1 64 ? 2.651 9.602 4.194 1.00 43.04 ? 64 ALA A CA 1 +ATOM 458 C C . ALA A 1 64 ? 3.960 9.509 3.414 1.00 43.04 ? 64 ALA A C 1 +ATOM 459 O O . ALA A 1 64 ? 4.578 8.457 3.367 1.00 43.04 ? 64 ALA A O 1 +ATOM 460 C CB . ALA A 1 64 ? 1.441 9.419 3.260 1.00 29.61 ? 64 ALA A CB 1 +ATOM 461 N N . ALA A 1 65 ? 4.388 10.612 2.815 1.00 46.89 ? 65 ALA A N 1 +ATOM 462 C CA . ALA A 1 65 ? 5.642 10.619 2.076 1.00 46.89 ? 65 ALA A CA 1 +ATOM 463 C C . ALA A 1 65 ? 6.791 10.351 3.055 1.00 46.89 ? 65 ALA A C 1 +ATOM 464 O O . ALA A 1 65 ? 7.737 9.629 2.737 1.00 46.89 ? 65 ALA A O 1 +ATOM 465 C CB . ALA A 1 65 ? 5.839 11.968 1.367 1.00 31.68 ? 65 ALA A CB 1 +ATOM 466 N N . ILE A 1 66 ? 6.703 10.929 4.248 1.00 45.51 ? 66 ILE A N 1 +ATOM 467 C CA . ILE A 1 66 ? 7.722 10.737 5.275 1.00 45.51 ? 66 ILE A CA 1 +ATOM 468 C C . ILE A 1 66 ? 7.762 9.285 5.741 1.00 45.51 ? 66 ILE A C 1 +ATOM 469 O O . ILE A 1 66 ? 8.816 8.652 5.778 1.00 45.51 ? 66 ILE A O 1 +ATOM 470 C CB . ILE A 1 66 ? 7.444 11.631 6.508 1.00 53.42 ? 66 ILE A CB 1 +ATOM 471 C CG1 . ILE A 1 66 ? 7.884 13.069 6.215 1.00 53.42 ? 66 ILE A CG1 1 +ATOM 472 C CG2 . ILE A 1 66 ? 8.153 11.075 7.746 1.00 53.42 ? 66 ILE A CG2 1 +ATOM 473 C CD1 . ILE A 1 66 ? 7.671 14.034 7.377 1.00 53.42 ? 66 ILE A CD1 1 +ATOM 474 N N . LEU A 1 67 ? 6.599 8.766 6.103 1.00 37.91 ? 67 LEU A N 1 +ATOM 475 C CA . LEU A 1 67 ? 6.501 7.412 6.591 1.00 37.91 ? 67 LEU A CA 1 +ATOM 476 C C . LEU A 1 67 ? 6.912 6.387 5.551 1.00 37.91 ? 67 LEU A C 1 +ATOM 477 O O . LEU A 1 67 ? 7.378 5.299 5.887 1.00 37.91 ? 67 LEU A O 1 +ATOM 478 C CB . LEU A 1 67 ? 5.079 7.144 7.071 1.00 24.44 ? 67 LEU A CB 1 +ATOM 479 C CG . LEU A 1 67 ? 4.659 8.016 8.260 1.00 24.44 ? 67 LEU A CG 1 +ATOM 480 C CD1 . LEU A 1 67 ? 3.226 7.626 8.711 1.00 24.44 ? 67 LEU A CD1 1 +ATOM 481 C CD2 . LEU A 1 67 ? 5.658 7.854 9.394 1.00 24.44 ? 67 LEU A CD2 1 +ATOM 482 N N . ILE A 1 68 ? 6.748 6.723 4.282 1.00 32.01 ? 68 ILE A N 1 +ATOM 483 C CA . ILE A 1 68 ? 7.119 5.776 3.255 1.00 32.01 ? 68 ILE A CA 1 +ATOM 484 C C . ILE A 1 68 ? 8.615 5.568 3.244 1.00 32.01 ? 68 ILE A C 1 +ATOM 485 O O . ILE A 1 68 ? 9.074 4.433 3.201 1.00 32.01 ? 68 ILE A O 1 +ATOM 486 C CB . ILE A 1 68 ? 6.622 6.217 1.869 1.00 44.65 ? 68 ILE A CB 1 +ATOM 487 C CG1 . ILE A 1 68 ? 5.223 5.656 1.656 1.00 44.65 ? 68 ILE A CG1 1 +ATOM 488 C CG2 . ILE A 1 68 ? 7.533 5.705 0.786 1.00 44.65 ? 68 ILE A CG2 1 +ATOM 489 C CD1 . ILE A 1 68 ? 4.580 6.096 0.373 1.00 44.65 ? 68 ILE A CD1 1 +ATOM 490 N N . LYS A 1 69 ? 9.366 6.661 3.310 1.00 46.37 ? 69 LYS A N 1 +ATOM 491 C CA . LYS A 1 69 ? 10.819 6.592 3.311 1.00 46.37 ? 69 LYS A CA 1 +ATOM 492 C C . LYS A 1 69 ? 11.296 5.881 4.574 1.00 46.37 ? 69 LYS A C 1 +ATOM 493 O O . LYS A 1 69 ? 12.268 5.125 4.533 1.00 46.37 ? 69 LYS A O 1 +ATOM 494 C CB . LYS A 1 69 ? 11.401 8.001 3.201 1.00 60.80 ? 69 LYS A CB 1 +ATOM 495 C CG . LYS A 1 69 ? 10.814 8.757 2.008 1.00 54.72 ? 69 LYS A CG 1 +ATOM 496 C CD . LYS A 1 69 ? 11.461 10.116 1.760 1.00 54.72 ? 69 LYS A CD 1 +ATOM 497 C CE . LYS A 1 69 ? 10.804 10.803 0.552 1.00 54.72 ? 69 LYS A CE 1 +ATOM 498 N NZ . LYS A 1 69 ? 11.330 12.176 0.230 1.00 54.72 ? 69 LYS A NZ 1 +ATOM 499 N N . VAL A 1 70 ? 10.601 6.102 5.689 1.00 46.67 ? 70 VAL A N 1 +ATOM 500 C CA . VAL A 1 70 ? 10.959 5.442 6.942 1.00 46.67 ? 70 VAL A CA 1 +ATOM 501 C C . VAL A 1 70 ? 10.872 3.920 6.791 1.00 46.67 ? 70 VAL A C 1 +ATOM 502 O O . VAL A 1 70 ? 11.842 3.216 7.044 1.00 46.67 ? 70 VAL A O 1 +ATOM 503 C CB . VAL A 1 70 ? 10.034 5.890 8.104 1.00 45.21 ? 70 VAL A CB 1 +ATOM 504 C CG1 . VAL A 1 70 ? 10.161 4.929 9.292 1.00 45.21 ? 70 VAL A CG1 1 +ATOM 505 C CG2 . VAL A 1 70 ? 10.405 7.301 8.539 1.00 45.21 ? 70 VAL A CG2 1 +ATOM 506 N N . PHE A 1 71 ? 9.705 3.425 6.385 1.00 47.43 ? 71 PHE A N 1 +ATOM 507 C CA . PHE A 1 71 ? 9.472 1.995 6.184 1.00 47.43 ? 71 PHE A CA 1 +ATOM 508 C C . PHE A 1 71 ? 10.400 1.397 5.132 1.00 47.43 ? 71 PHE A C 1 +ATOM 509 O O . PHE A 1 71 ? 10.869 0.265 5.276 1.00 47.43 ? 71 PHE A O 1 +ATOM 510 C CB . PHE A 1 71 ? 8.043 1.749 5.717 1.00 37.02 ? 71 PHE A CB 1 +ATOM 511 C CG . PHE A 1 71 ? 7.046 1.645 6.819 1.00 37.02 ? 71 PHE A CG 1 +ATOM 512 C CD1 . PHE A 1 71 ? 6.882 0.462 7.510 1.00 37.02 ? 71 PHE A CD1 1 +ATOM 513 C CD2 . PHE A 1 71 ? 6.236 2.722 7.146 1.00 37.02 ? 71 PHE A CD2 1 +ATOM 514 C CE1 . PHE A 1 71 ? 5.912 0.350 8.513 1.00 37.02 ? 71 PHE A CE1 1 +ATOM 515 C CE2 . PHE A 1 71 ? 5.276 2.619 8.138 1.00 37.02 ? 71 PHE A CE2 1 +ATOM 516 C CZ . PHE A 1 71 ? 5.110 1.440 8.820 1.00 37.02 ? 71 PHE A CZ 1 +ATOM 517 N N . ALA A 1 72 ? 10.631 2.143 4.058 1.00 53.65 ? 72 ALA A N 1 +ATOM 518 C CA . ALA A 1 72 ? 11.491 1.668 2.986 1.00 53.65 ? 72 ALA A CA 1 +ATOM 519 C C . ALA A 1 72 ? 12.911 1.486 3.508 1.00 53.65 ? 72 ALA A C 1 +ATOM 520 O O . ALA A 1 72 ? 13.481 0.397 3.410 1.00 53.65 ? 72 ALA A O 1 +ATOM 521 C CB . ALA A 1 72 ? 11.476 2.654 1.832 1.00 41.89 ? 72 ALA A CB 1 +ATOM 522 N N . GLU A 1 73 ? 13.474 2.552 4.070 1.00 50.89 ? 73 GLU A N 1 +ATOM 523 C CA . GLU A 1 73 ? 14.818 2.483 4.606 1.00 50.89 ? 73 GLU A CA 1 +ATOM 524 C C . GLU A 1 73 ? 14.914 1.282 5.565 1.00 50.89 ? 73 GLU A C 1 +ATOM 525 O O . GLU A 1 73 ? 15.805 0.457 5.434 1.00 50.89 ? 73 GLU A O 1 +ATOM 526 C CB . GLU A 1 73 ? 15.186 3.805 5.314 1.00 20.48 ? 73 GLU A CB 1 +ATOM 527 N N . LEU A 1 74 ? 13.978 1.145 6.496 1.00 43.89 ? 74 LEU A N 1 +ATOM 528 C CA . LEU A 1 74 ? 14.025 0.022 7.431 1.00 43.89 ? 74 LEU A CA 1 +ATOM 529 C C . LEU A 1 74 ? 13.690 -1.342 6.817 1.00 43.89 ? 74 LEU A C 1 +ATOM 530 O O . LEU A 1 74 ? 13.367 -2.282 7.535 1.00 43.89 ? 74 LEU A O 1 +ATOM 531 C CB . LEU A 1 74 ? 13.100 0.287 8.621 1.00 51.78 ? 74 LEU A CB 1 +ATOM 532 C CG . LEU A 1 74 ? 13.297 1.686 9.215 1.00 51.78 ? 74 LEU A CG 1 +ATOM 533 C CD1 . LEU A 1 74 ? 12.449 1.868 10.462 1.00 51.78 ? 74 LEU A CD1 1 +ATOM 534 C CD2 . LEU A 1 74 ? 14.769 1.889 9.525 1.00 51.78 ? 74 LEU A CD2 1 +ATOM 535 N N . GLY A 1 75 ? 13.731 -1.453 5.492 1.00 38.15 ? 75 GLY A N 1 +ATOM 536 C CA . GLY A 1 75 ? 13.465 -2.739 4.875 1.00 38.15 ? 75 GLY A CA 1 +ATOM 537 C C . GLY A 1 75 ? 12.039 -3.207 4.697 1.00 38.15 ? 75 GLY A C 1 +ATOM 538 O O . GLY A 1 75 ? 11.810 -4.287 4.152 1.00 38.15 ? 75 GLY A O 1 +ATOM 539 N N . TYR A 1 76 ? 11.063 -2.447 5.168 1.00 50.24 ? 76 TYR A N 1 +ATOM 540 C CA . TYR A 1 76 ? 9.685 -2.857 4.949 1.00 50.24 ? 76 TYR A CA 1 +ATOM 541 C C . TYR A 1 76 ? 9.433 -2.436 3.506 1.00 50.24 ? 76 TYR A C 1 +ATOM 542 O O . TYR A 1 76 ? 9.581 -1.257 3.162 1.00 50.24 ? 76 TYR A O 1 +ATOM 543 C CB . TYR A 1 76 ? 8.781 -2.137 5.932 1.00 36.14 ? 76 TYR A CB 1 +ATOM 544 C CG . TYR A 1 76 ? 9.004 -2.635 7.338 1.00 36.14 ? 76 TYR A CG 1 +ATOM 545 C CD1 . TYR A 1 76 ? 8.162 -3.598 7.898 1.00 36.14 ? 76 TYR A CD1 1 +ATOM 546 C CD2 . TYR A 1 76 ? 10.128 -2.235 8.070 1.00 36.14 ? 76 TYR A CD2 1 +ATOM 547 C CE1 . TYR A 1 76 ? 8.438 -4.166 9.150 1.00 36.14 ? 76 TYR A CE1 1 +ATOM 548 C CE2 . TYR A 1 76 ? 10.413 -2.802 9.322 1.00 36.14 ? 76 TYR A CE2 1 +ATOM 549 C CZ . TYR A 1 76 ? 9.567 -3.770 9.848 1.00 36.14 ? 76 TYR A CZ 1 +ATOM 550 O OH . TYR A 1 76 ? 9.881 -4.392 11.036 1.00 36.14 ? 76 TYR A OH 1 +ATOM 551 N N . ASN A 1 77 ? 9.073 -3.396 2.657 1.00 50.62 ? 77 ASN A N 1 +ATOM 552 C CA . ASN A 1 77 ? 8.890 -3.090 1.246 1.00 50.62 ? 77 ASN A CA 1 +ATOM 553 C C . ASN A 1 77 ? 7.535 -3.320 0.577 1.00 50.62 ? 77 ASN A C 1 +ATOM 554 O O . ASN A 1 77 ? 7.395 -3.014 -0.605 1.00 50.62 ? 77 ASN A O 1 +ATOM 555 C CB . ASN A 1 77 ? 9.985 -3.784 0.428 1.00 96.49 ? 77 ASN A CB 1 +ATOM 556 C CG . ASN A 1 77 ? 11.391 -3.387 0.875 1.00 96.49 ? 77 ASN A CG 1 +ATOM 557 O OD1 . ASN A 1 77 ? 11.710 -2.200 0.989 1.00 96.49 ? 77 ASN A OD1 1 +ATOM 558 N ND2 . ASN A 1 77 ? 12.240 -4.384 1.122 1.00 96.49 ? 77 ASN A ND2 1 +ATOM 559 N N . ASP A 1 78 ? 6.556 -3.874 1.285 1.00 72.36 ? 78 ASP A N 1 +ATOM 560 C CA . ASP A 1 78 ? 5.219 -4.028 0.700 1.00 72.36 ? 78 ASP A CA 1 +ATOM 561 C C . ASP A 1 78 ? 4.327 -3.171 1.600 1.00 72.36 ? 78 ASP A C 1 +ATOM 562 O O . ASP A 1 78 ? 3.796 -3.643 2.609 1.00 72.36 ? 78 ASP A O 1 +ATOM 563 C CB . ASP A 1 78 ? 4.745 -5.479 0.716 1.00 108.13 ? 78 ASP A CB 1 +ATOM 564 C CG . ASP A 1 78 ? 3.377 -5.644 0.065 1.00 108.13 ? 78 ASP A CG 1 +ATOM 565 O OD1 . ASP A 1 78 ? 3.225 -5.258 -1.112 1.00 108.13 ? 78 ASP A OD1 1 +ATOM 566 O OD2 . ASP A 1 78 ? 2.448 -6.153 0.728 1.00 108.13 ? 78 ASP A OD2 1 +ATOM 567 N N . ILE A 1 79 ? 4.163 -1.910 1.214 1.00 35.39 ? 79 ILE A N 1 +ATOM 568 C CA . ILE A 1 79 ? 3.425 -0.943 2.015 1.00 35.39 ? 79 ILE A CA 1 +ATOM 569 C C . ILE A 1 79 ? 2.025 -0.548 1.563 1.00 35.39 ? 79 ILE A C 1 +ATOM 570 O O . ILE A 1 79 ? 1.779 -0.336 0.382 1.00 35.39 ? 79 ILE A O 1 +ATOM 571 C CB . ILE A 1 79 ? 4.260 0.326 2.122 1.00 28.47 ? 79 ILE A CB 1 +ATOM 572 C CG1 . ILE A 1 79 ? 5.672 -0.058 2.552 1.00 28.47 ? 79 ILE A CG1 1 +ATOM 573 C CG2 . ILE A 1 79 ? 3.630 1.303 3.070 1.00 28.47 ? 79 ILE A CG2 1 +ATOM 574 C CD1 . ILE A 1 79 ? 6.681 1.064 2.358 1.00 28.47 ? 79 ILE A CD1 1 +ATOM 575 N N . ASN A 1 80 ? 1.120 -0.449 2.537 1.00 32.25 ? 80 ASN A N 1 +ATOM 576 C CA . ASN A 1 80 ? -0.255 -0.026 2.299 1.00 32.25 ? 80 ASN A CA 1 +ATOM 577 C C . ASN A 1 80 ? -0.386 1.364 2.884 1.00 32.25 ? 80 ASN A C 1 +ATOM 578 O O . ASN A 1 80 ? -0.009 1.599 4.028 1.00 32.25 ? 80 ASN A O 1 +ATOM 579 C CB . ASN A 1 80 ? -1.256 -0.953 2.983 1.00 68.24 ? 80 ASN A CB 1 +ATOM 580 C CG . ASN A 1 80 ? -1.409 -2.275 2.265 1.00 68.24 ? 80 ASN A CG 1 +ATOM 581 O OD1 . ASN A 1 80 ? -1.410 -3.341 2.885 1.00 68.24 ? 80 ASN A OD1 1 +ATOM 582 N ND2 . ASN A 1 80 ? -1.552 -2.215 0.949 1.00 68.24 ? 80 ASN A ND2 1 +ATOM 583 N N . VAL A 1 81 ? -0.875 2.291 2.074 1.00 31.42 ? 81 VAL A N 1 +ATOM 584 C CA . VAL A 1 81 ? -1.090 3.651 2.511 1.00 31.42 ? 81 VAL A CA 1 +ATOM 585 C C . VAL A 1 81 ? -2.586 3.842 2.393 1.00 31.42 ? 81 VAL A C 1 +ATOM 586 O O . VAL A 1 81 ? -3.154 3.663 1.319 1.00 31.42 ? 81 VAL A O 1 +ATOM 587 C CB . VAL A 1 81 ? -0.418 4.651 1.595 1.00 27.86 ? 81 VAL A CB 1 +ATOM 588 C CG1 . VAL A 1 81 ? -0.828 6.027 1.980 1.00 27.86 ? 81 VAL A CG1 1 +ATOM 589 C CG2 . VAL A 1 81 ? 1.089 4.522 1.694 1.00 27.86 ? 81 VAL A CG2 1 +ATOM 590 N N . THR A 1 82 ? -3.226 4.180 3.499 1.00 39.50 ? 82 THR A N 1 +ATOM 591 C CA . THR A 1 82 ? -4.666 4.392 3.515 1.00 39.50 ? 82 THR A CA 1 +ATOM 592 C C . THR A 1 82 ? -5.000 5.729 4.145 1.00 39.50 ? 82 THR A C 1 +ATOM 593 O O . THR A 1 82 ? -4.520 6.055 5.233 1.00 39.50 ? 82 THR A O 1 +ATOM 594 C CB . THR A 1 82 ? -5.398 3.315 4.339 1.00 46.66 ? 82 THR A CB 1 +ATOM 595 O OG1 . THR A 1 82 ? -5.223 2.023 3.741 1.00 46.66 ? 82 THR A OG1 1 +ATOM 596 C CG2 . THR A 1 82 ? -6.867 3.630 4.400 1.00 46.66 ? 82 THR A CG2 1 +ATOM 597 N N . PHE A 1 83 ? -5.802 6.522 3.457 1.00 57.37 ? 83 PHE A N 1 +ATOM 598 C CA . PHE A 1 83 ? -6.197 7.793 4.034 1.00 57.37 ? 83 PHE A CA 1 +ATOM 599 C C . PHE A 1 83 ? -7.634 7.636 4.481 1.00 57.37 ? 83 PHE A C 1 +ATOM 600 O O . PHE A 1 83 ? -8.448 7.043 3.776 1.00 57.37 ? 83 PHE A O 1 +ATOM 601 C CB . PHE A 1 83 ? -6.097 8.935 3.025 1.00 35.09 ? 83 PHE A CB 1 +ATOM 602 C CG . PHE A 1 83 ? -4.709 9.189 2.529 1.00 35.09 ? 83 PHE A CG 1 +ATOM 603 C CD1 . PHE A 1 83 ? -4.182 8.445 1.477 1.00 35.09 ? 83 PHE A CD1 1 +ATOM 604 C CD2 . PHE A 1 83 ? -3.930 10.179 3.103 1.00 35.09 ? 83 PHE A CD2 1 +ATOM 605 C CE1 . PHE A 1 83 ? -2.893 8.688 0.998 1.00 35.09 ? 83 PHE A CE1 1 +ATOM 606 C CE2 . PHE A 1 83 ? -2.643 10.433 2.638 1.00 35.09 ? 83 PHE A CE2 1 +ATOM 607 C CZ . PHE A 1 83 ? -2.123 9.681 1.578 1.00 35.09 ? 83 PHE A CZ 1 +ATOM 608 N N . ASP A 1 84 ? -7.924 8.130 5.676 1.00 57.44 ? 84 ASP A N 1 +ATOM 609 C CA . ASP A 1 84 ? -9.270 8.081 6.224 1.00 57.44 ? 84 ASP A CA 1 +ATOM 610 C C . ASP A 1 84 ? -9.498 9.482 6.767 1.00 57.44 ? 84 ASP A C 1 +ATOM 611 O O . ASP A 1 84 ? -9.176 9.781 7.915 1.00 57.44 ? 84 ASP A O 1 +ATOM 612 C CB . ASP A 1 84 ? -9.365 7.052 7.349 1.00 115.57 ? 84 ASP A CB 1 +ATOM 613 C CG . ASP A 1 84 ? -10.794 6.628 7.625 1.00 115.57 ? 84 ASP A CG 1 +ATOM 614 O OD1 . ASP A 1 84 ? -11.645 7.511 7.866 1.00 115.57 ? 84 ASP A OD1 1 +ATOM 615 O OD2 . ASP A 1 84 ? -11.068 5.410 7.597 1.00 115.57 ? 84 ASP A OD2 1 +ATOM 616 N N . GLY A 1 85 ? -10.026 10.352 5.924 1.00 51.12 ? 85 GLY A N 1 +ATOM 617 C CA . GLY A 1 85 ? -10.250 11.713 6.358 1.00 51.12 ? 85 GLY A CA 1 +ATOM 618 C C . GLY A 1 85 ? -8.911 12.403 6.503 1.00 51.12 ? 85 GLY A C 1 +ATOM 619 O O . GLY A 1 85 ? -8.212 12.608 5.510 1.00 51.12 ? 85 GLY A O 1 +ATOM 620 N N . ASP A 1 86 ? -8.545 12.754 7.733 1.00 53.00 ? 86 ASP A N 1 +ATOM 621 C CA . ASP A 1 86 ? -7.275 13.427 7.979 1.00 53.00 ? 86 ASP A CA 1 +ATOM 622 C C . ASP A 1 86 ? -6.266 12.493 8.617 1.00 53.00 ? 86 ASP A C 1 +ATOM 623 O O . ASP A 1 86 ? -5.171 12.907 9.004 1.00 53.00 ? 86 ASP A O 1 +ATOM 624 C CB . ASP A 1 86 ? -7.497 14.652 8.856 1.00 84.41 ? 86 ASP A CB 1 +ATOM 625 C CG . ASP A 1 86 ? -7.893 15.864 8.047 1.00 84.41 ? 86 ASP A CG 1 +ATOM 626 O OD1 . ASP A 1 86 ? -8.499 16.790 8.622 1.00 84.41 ? 86 ASP A OD1 1 +ATOM 627 O OD2 . ASP A 1 86 ? -7.589 15.892 6.833 1.00 84.41 ? 86 ASP A OD2 1 +ATOM 628 N N . THR A 1 87 ? -6.652 11.227 8.713 1.00 54.91 ? 87 THR A N 1 +ATOM 629 C CA . THR A 1 87 ? -5.799 10.202 9.280 1.00 54.91 ? 87 THR A CA 1 +ATOM 630 C C . THR A 1 87 ? -5.142 9.365 8.190 1.00 54.91 ? 87 THR A C 1 +ATOM 631 O O . THR A 1 87 ? -5.826 8.797 7.346 1.00 54.91 ? 87 THR A O 1 +ATOM 632 C CB . THR A 1 87 ? -6.600 9.245 10.167 1.00 59.15 ? 87 THR A CB 1 +ATOM 633 O OG1 . THR A 1 87 ? -7.103 9.953 11.304 1.00 59.15 ? 87 THR A OG1 1 +ATOM 634 C CG2 . THR A 1 87 ? -5.728 8.095 10.628 1.00 59.15 ? 87 THR A CG2 1 +ATOM 635 N N . VAL A 1 88 ? -3.816 9.303 8.191 1.00 36.77 ? 88 VAL A N 1 +ATOM 636 C CA . VAL A 1 88 ? -3.125 8.459 7.218 1.00 36.77 ? 88 VAL A CA 1 +ATOM 637 C C . VAL A 1 88 ? -2.580 7.225 7.935 1.00 36.77 ? 88 VAL A C 1 +ATOM 638 O O . VAL A 1 88 ? -1.997 7.316 9.019 1.00 36.77 ? 88 VAL A O 1 +ATOM 639 C CB . VAL A 1 88 ? -1.953 9.176 6.533 1.00 32.82 ? 88 VAL A CB 1 +ATOM 640 C CG1 . VAL A 1 88 ? -0.849 9.457 7.518 1.00 32.82 ? 88 VAL A CG1 1 +ATOM 641 C CG2 . VAL A 1 88 ? -1.459 8.320 5.381 1.00 32.82 ? 88 VAL A CG2 1 +ATOM 642 N N . THR A 1 89 ? -2.790 6.067 7.330 1.00 49.29 ? 89 THR A N 1 +ATOM 643 C CA . THR A 1 89 ? -2.314 4.826 7.917 1.00 49.29 ? 89 THR A CA 1 +ATOM 644 C C . THR A 1 89 ? -1.395 4.069 6.971 1.00 49.29 ? 89 THR A C 1 +ATOM 645 O O . THR A 1 89 ? -1.844 3.485 5.978 1.00 49.29 ? 89 THR A O 1 +ATOM 646 C CB . THR A 1 89 ? -3.476 3.934 8.283 1.00 51.33 ? 89 THR A CB 1 +ATOM 647 O OG1 . THR A 1 89 ? -4.392 4.694 9.073 1.00 51.33 ? 89 THR A OG1 1 +ATOM 648 C CG2 . THR A 1 89 ? -2.999 2.722 9.060 1.00 51.33 ? 89 THR A CG2 1 +ATOM 649 N N . VAL A 1 90 ? -0.101 4.112 7.284 1.00 33.06 ? 90 VAL A N 1 +ATOM 650 C CA . VAL A 1 90 ? 0.909 3.414 6.508 1.00 33.06 ? 90 VAL A CA 1 +ATOM 651 C C . VAL A 1 90 ? 1.260 2.131 7.257 1.00 33.06 ? 90 VAL A C 1 +ATOM 652 O O . VAL A 1 90 ? 1.736 2.164 8.392 1.00 33.06 ? 90 VAL A O 1 +ATOM 653 C CB . VAL A 1 90 ? 2.156 4.280 6.343 1.00 31.66 ? 90 VAL A CB 1 +ATOM 654 C CG1 . VAL A 1 90 ? 3.173 3.579 5.443 1.00 31.66 ? 90 VAL A CG1 1 +ATOM 655 C CG2 . VAL A 1 90 ? 1.762 5.626 5.741 1.00 31.66 ? 90 VAL A CG2 1 +ATOM 656 N N . GLU A 1 91 ? 0.969 0.996 6.638 1.00 39.68 ? 91 GLU A N 1 +ATOM 657 C CA . GLU A 1 91 ? 1.283 -0.296 7.233 1.00 39.68 ? 91 GLU A CA 1 +ATOM 658 C C . GLU A 1 91 ? 2.266 -1.019 6.321 1.00 39.68 ? 91 GLU A C 1 +ATOM 659 O O . GLU A 1 91 ? 2.032 -1.166 5.114 1.00 39.68 ? 91 GLU A O 1 +ATOM 660 C CB . GLU A 1 91 ? 0.045 -1.172 7.391 1.00 115.49 ? 91 GLU A CB 1 +ATOM 661 C CG . GLU A 1 91 ? 0.407 -2.556 7.905 1.00 111.17 ? 91 GLU A CG 1 +ATOM 662 C CD . GLU A 1 91 ? -0.442 -3.656 7.308 1.00 111.17 ? 91 GLU A CD 1 +ATOM 663 O OE1 . GLU A 1 91 ? -1.618 -3.782 7.708 1.00 111.17 ? 91 GLU A OE1 1 +ATOM 664 O OE2 . GLU A 1 91 ? 0.066 -4.394 6.432 1.00 111.17 ? 91 GLU A OE2 1 +ATOM 665 N N . GLY A 1 92 ? 3.369 -1.469 6.897 1.00 57.29 ? 92 GLY A N 1 +ATOM 666 C CA . GLY A 1 92 ? 4.345 -2.181 6.106 1.00 57.29 ? 92 GLY A CA 1 +ATOM 667 C C . GLY A 1 92 ? 4.665 -3.567 6.629 1.00 57.29 ? 92 GLY A C 1 +ATOM 668 O O . GLY A 1 92 ? 4.434 -3.886 7.799 1.00 57.29 ? 92 GLY A O 1 +ATOM 669 N N . GLN A 1 93 ? 5.184 -4.402 5.733 1.00 51.61 ? 93 GLN A N 1 +ATOM 670 C CA . GLN A 1 93 ? 5.609 -5.756 6.069 1.00 51.61 ? 93 GLN A CA 1 +ATOM 671 C C . GLN A 1 93 ? 7.071 -5.898 5.659 1.00 51.61 ? 93 GLN A C 1 +ATOM 672 O O . GLN A 1 93 ? 7.498 -5.373 4.628 1.00 51.61 ? 93 GLN A O 1 +ATOM 673 C CB . GLN A 1 93 ? 4.724 -6.792 5.376 1.00 87.10 ? 93 GLN A CB 1 +ATOM 674 C CG . GLN A 1 93 ? 3.505 -7.152 6.212 1.00 87.10 ? 93 GLN A CG 1 +ATOM 675 C CD . GLN A 1 93 ? 2.449 -7.895 5.433 1.00 87.10 ? 93 GLN A CD 1 +ATOM 676 O OE1 . GLN A 1 93 ? 1.866 -7.357 4.489 1.00 87.10 ? 93 GLN A OE1 1 +ATOM 677 N NE2 . GLN A 1 93 ? 2.189 -9.139 5.823 1.00 87.10 ? 93 GLN A NE2 1 +ATOM 678 N N . LEU A 1 94 ? 7.836 -6.589 6.494 1.00 78.23 ? 94 LEU A N 1 +ATOM 679 C CA . LEU A 1 94 ? 9.264 -6.783 6.273 1.00 78.23 ? 94 LEU A CA 1 +ATOM 680 C C . LEU A 1 94 ? 9.604 -7.603 5.021 1.00 78.23 ? 94 LEU A C 1 +ATOM 681 O O . LEU A 1 94 ? 10.488 -7.171 4.243 1.00 78.23 ? 94 LEU A O 1 +ATOM 682 C CB . LEU A 1 94 ? 9.865 -7.422 7.524 1.00 64.38 ? 94 LEU A CB 1 +ATOM 683 C CG . LEU A 1 94 ? 11.295 -7.028 7.888 1.00 64.38 ? 94 LEU A CG 1 +ATOM 684 C CD1 . LEU A 1 94 ? 11.525 -5.554 7.645 1.00 64.38 ? 94 LEU A CD1 1 +ATOM 685 C CD2 . LEU A 1 94 ? 11.541 -7.378 9.338 1.00 64.38 ? 94 LEU A CD2 1 +HETATM 686 O O . HOH B 2 . ? 10.102 -4.251 13.943 1.00 44.75 ? 107 HOH A O 1 +HETATM 687 O O . HOH B 2 . ? 1.041 -4.800 4.090 1.00 52.54 ? 108 HOH A O 1 +HETATM 688 O O . HOH B 2 . ? -0.433 3.575 23.826 1.00 38.09 ? 109 HOH A O 1 +HETATM 689 O O . HOH B 2 . ? 2.878 19.537 9.279 1.00 61.82 ? 110 HOH A O 1 +HETATM 690 O O . HOH B 2 . ? 18.925 5.360 10.377 1.00 60.69 ? 111 HOH A O 1 +HETATM 691 O O . HOH B 2 . ? -3.917 2.311 13.588 1.00 49.83 ? 112 HOH A O 1 +HETATM 692 O O . HOH B 2 . ? 4.748 12.641 22.041 1.00 58.74 ? 113 HOH A O 1 +# diff --git a/tests/resources/1shg.cif b/tests/resources/1shg.cif new file mode 100644 index 0000000..ad839c7 --- /dev/null +++ b/tests/resources/1shg.cif @@ -0,0 +1,1983 @@ +data_1SHG +# +_entry.id 1SHG +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.386 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 1SHG pdb_00001shg 10.2210/pdb1shg/pdb +WWPDB D_1000176374 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 1993-10-31 +2 'Structure model' 1 1 2008-03-24 +3 'Structure model' 1 2 2011-07-13 +4 'Structure model' 1 3 2019-07-17 +5 'Structure model' 1 4 2019-08-14 +6 'Structure model' 1 5 2024-02-14 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Version format compliance' +3 4 'Structure model' 'Data collection' +4 4 'Structure model' Other +5 4 'Structure model' 'Refinement description' +6 5 'Structure model' 'Data collection' +7 5 'Structure model' 'Refinement description' +8 6 'Structure model' 'Data collection' +9 6 'Structure model' 'Database references' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 4 'Structure model' pdbx_database_status +2 4 'Structure model' software +3 5 'Structure model' software +4 6 'Structure model' chem_comp_atom +5 6 'Structure model' chem_comp_bond +6 6 'Structure model' database_2 +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 4 'Structure model' '_pdbx_database_status.process_site' +2 4 'Structure model' '_software.classification' +3 5 'Structure model' '_software.classification' +4 6 'Structure model' '_database_2.pdbx_DOI' +5 6 'Structure model' '_database_2.pdbx_database_accession' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 1SHG +_pdbx_database_status.recvd_initial_deposition_date 1993-05-19 +_pdbx_database_status.deposit_site ? +_pdbx_database_status.process_site BNL +_pdbx_database_status.SG_entry . +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.status_code_sf ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Noble, M.' 1 +'Pauptit, R.' 2 +'Musacchio, A.' 3 +'Saraste, M.' 4 +'Wierenga, R.K.' 5 +# +_citation.id primary +_citation.title 'Crystal structure of a Src-homology 3 (SH3) domain.' +_citation.journal_abbrev Nature +_citation.journal_volume 359 +_citation.page_first 851 +_citation.page_last 855 +_citation.year 1992 +_citation.journal_id_ASTM NATUAS +_citation.country UK +_citation.journal_id_ISSN 0028-0836 +_citation.journal_id_CSD 0006 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed 1279434 +_citation.pdbx_database_id_DOI 10.1038/359851a0 +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Musacchio, A.' 1 ? +primary 'Noble, M.' 2 ? +primary 'Pauptit, R.' 3 ? +primary 'Wierenga, R.' 4 ? +primary 'Saraste, M.' 5 ? +# +_entity.id 1 +_entity.type polymer +_entity.src_method man +_entity.pdbx_description 'ALPHA-SPECTRIN SH3 DOMAIN' +_entity.formula_weight 7229.244 +_entity.pdbx_number_of_molecules 1 +_entity.pdbx_ec ? +_entity.pdbx_mutation ? +_entity.pdbx_fragment ? +_entity.details ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer no +_entity_poly.pdbx_seq_one_letter_code MDETGKELVLALYDYQEKSPREVTMKKGDILTLLNSTNKDWWKVEVNDRQGFVPAAYVKKLD +_entity_poly.pdbx_seq_one_letter_code_can MDETGKELVLALYDYQEKSPREVTMKKGDILTLLNSTNKDWWKVEVNDRQGFVPAAYVKKLD +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier ? +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 MET n +1 2 ASP n +1 3 GLU n +1 4 THR n +1 5 GLY n +1 6 LYS n +1 7 GLU n +1 8 LEU n +1 9 VAL n +1 10 LEU n +1 11 ALA n +1 12 LEU n +1 13 TYR n +1 14 ASP n +1 15 TYR n +1 16 GLN n +1 17 GLU n +1 18 LYS n +1 19 SER n +1 20 PRO n +1 21 ARG n +1 22 GLU n +1 23 VAL n +1 24 THR n +1 25 MET n +1 26 LYS n +1 27 LYS n +1 28 GLY n +1 29 ASP n +1 30 ILE n +1 31 LEU n +1 32 THR n +1 33 LEU n +1 34 LEU n +1 35 ASN n +1 36 SER n +1 37 THR n +1 38 ASN n +1 39 LYS n +1 40 ASP n +1 41 TRP n +1 42 TRP n +1 43 LYS n +1 44 VAL n +1 45 GLU n +1 46 VAL n +1 47 ASN n +1 48 ASP n +1 49 ARG n +1 50 GLN n +1 51 GLY n +1 52 PHE n +1 53 VAL n +1 54 PRO n +1 55 ALA n +1 56 ALA n +1 57 TYR n +1 58 VAL n +1 59 LYS n +1 60 LYS n +1 61 LEU n +1 62 ASP n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name chicken +_entity_src_gen.gene_src_genus Gallus +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Gallus gallus' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9031 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name ? +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id ? +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain ? +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type ? +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name ? +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 MET 1 1 ? ? ? A . n +A 1 2 ASP 2 2 ? ? ? A . n +A 1 3 GLU 3 3 ? ? ? A . n +A 1 4 THR 4 4 ? ? ? A . n +A 1 5 GLY 5 5 ? ? ? A . n +A 1 6 LYS 6 6 6 LYS LYS A . n +A 1 7 GLU 7 7 7 GLU GLU A . n +A 1 8 LEU 8 8 8 LEU LEU A . n +A 1 9 VAL 9 9 9 VAL VAL A . n +A 1 10 LEU 10 10 10 LEU LEU A . n +A 1 11 ALA 11 11 11 ALA ALA A . n +A 1 12 LEU 12 12 12 LEU LEU A . n +A 1 13 TYR 13 13 13 TYR TYR A . n +A 1 14 ASP 14 14 14 ASP ASP A . n +A 1 15 TYR 15 15 15 TYR TYR A . n +A 1 16 GLN 16 16 16 GLN GLN A . n +A 1 17 GLU 17 17 17 GLU GLU A . n +A 1 18 LYS 18 18 18 LYS LYS A . n +A 1 19 SER 19 19 19 SER SER A . n +A 1 20 PRO 20 20 20 PRO PRO A . n +A 1 21 ARG 21 21 21 ARG ARG A . n +A 1 22 GLU 22 22 22 GLU GLU A . n +A 1 23 VAL 23 23 23 VAL VAL A . n +A 1 24 THR 24 24 24 THR THR A . n +A 1 25 MET 25 25 25 MET MET A . n +A 1 26 LYS 26 26 26 LYS LYS A . n +A 1 27 LYS 27 27 27 LYS LYS A . n +A 1 28 GLY 28 28 28 GLY GLY A . n +A 1 29 ASP 29 29 29 ASP ASP A . n +A 1 30 ILE 30 30 30 ILE ILE A . n +A 1 31 LEU 31 31 31 LEU LEU A . n +A 1 32 THR 32 32 32 THR THR A . n +A 1 33 LEU 33 33 33 LEU LEU A . n +A 1 34 LEU 34 34 34 LEU LEU A . n +A 1 35 ASN 35 35 35 ASN ASN A . n +A 1 36 SER 36 36 36 SER SER A . n +A 1 37 THR 37 37 37 THR THR A . n +A 1 38 ASN 38 38 38 ASN ASN A . n +A 1 39 LYS 39 39 39 LYS LYS A . n +A 1 40 ASP 40 40 40 ASP ASP A . n +A 1 41 TRP 41 41 41 TRP TRP A . n +A 1 42 TRP 42 42 42 TRP TRP A . n +A 1 43 LYS 43 43 43 LYS LYS A . n +A 1 44 VAL 44 44 44 VAL VAL A . n +A 1 45 GLU 45 45 45 GLU GLU A . n +A 1 46 VAL 46 46 46 VAL VAL A . n +A 1 47 ASN 47 47 47 ASN ASN A . n +A 1 48 ASP 48 48 48 ASP ASP A . n +A 1 49 ARG 49 49 49 ARG ARG A . n +A 1 50 GLN 50 50 50 GLN GLN A . n +A 1 51 GLY 51 51 51 GLY GLY A . n +A 1 52 PHE 52 52 52 PHE PHE A . n +A 1 53 VAL 53 53 53 VAL VAL A . n +A 1 54 PRO 54 54 54 PRO PRO A . n +A 1 55 ALA 55 55 55 ALA ALA A . n +A 1 56 ALA 56 56 56 ALA ALA A . n +A 1 57 TYR 57 57 57 TYR TYR A . n +A 1 58 VAL 58 58 58 VAL VAL A . n +A 1 59 LYS 59 59 59 LYS LYS A . n +A 1 60 LYS 60 60 60 LYS LYS A . n +A 1 61 LEU 61 61 61 LEU LEU A . n +A 1 62 ASP 62 62 62 ASP ASP A . n +# +loop_ +_software.name +_software.classification +_software.version +_software.citation_id +_software.pdbx_ordinal +X-PLOR 'model building' . ? 1 +TNT refinement . ? 2 +X-PLOR refinement . ? 3 +X-PLOR phasing . ? 4 +# +_cell.entry_id 1SHG +_cell.length_a 34.000 +_cell.length_b 42.270 +_cell.length_c 49.850 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 90.00 +_cell.Z_PDB 4 +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 1SHG +_symmetry.space_group_name_H-M 'P 21 21 21' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 19 +# +_exptl.entry_id 1SHG +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number ? +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.48 +_exptl_crystal.density_percent_sol 50.34 +_exptl_crystal.description ? +# +_refine.entry_id 1SHG +_refine.ls_number_reflns_obs ? +_refine.ls_number_reflns_all ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_d_res_low ? +_refine.ls_d_res_high 1.8 +_refine.ls_percent_reflns_obs ? +_refine.ls_R_factor_obs 0.1950000 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work 0.1950000 +_refine.ls_R_factor_R_free 0.2770000 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free ? +_refine.ls_number_reflns_R_free ? +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.B_iso_mean ? +_refine.aniso_B[1][1] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[3][3] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][3] ? +_refine.solvent_model_details ? +_refine.solvent_model_param_ksol ? +_refine.solvent_model_param_bsol ? +_refine.pdbx_ls_cross_valid_method ? +_refine.details ? +_refine.pdbx_starting_model ? +_refine.pdbx_method_to_determine_struct ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details ? +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.overall_SU_B ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_overall_phase_error ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 472 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 0 +_refine_hist.number_atoms_solvent 0 +_refine_hist.number_atoms_total 472 +_refine_hist.d_res_high 1.8 +_refine_hist.d_res_low . +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +x_bond_d 0.017 ? ? ? 'X-RAY DIFFRACTION' ? +x_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_deg 2.7 ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_dihedral_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +x_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_improper_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +x_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +x_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +x_mcbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? +x_mcangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? +x_scbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? +x_scangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? +# +_database_PDB_matrix.entry_id 1SHG +_database_PDB_matrix.origx[1][1] 1.000000 +_database_PDB_matrix.origx[1][2] 0.000000 +_database_PDB_matrix.origx[1][3] 0.000000 +_database_PDB_matrix.origx[2][1] 0.000000 +_database_PDB_matrix.origx[2][2] 1.000000 +_database_PDB_matrix.origx[2][3] 0.000000 +_database_PDB_matrix.origx[3][1] 0.000000 +_database_PDB_matrix.origx[3][2] 0.000000 +_database_PDB_matrix.origx[3][3] 1.000000 +_database_PDB_matrix.origx_vector[1] 0.00000 +_database_PDB_matrix.origx_vector[2] 0.00000 +_database_PDB_matrix.origx_vector[3] 0.00000 +# +_struct.entry_id 1SHG +_struct.title 'CRYSTAL STRUCTURE OF A SRC-HOMOLOGY 3 (SH3) DOMAIN' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 1SHG +_struct_keywords.pdbx_keywords CYTOSKELETON +_struct_keywords.text CYTOSKELETON +# +_struct_asym.id A +_struct_asym.pdbx_blank_PDB_chainid_flag N +_struct_asym.pdbx_modified N +_struct_asym.entity_id 1 +_struct_asym.details ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code SPTA2_CHICK +_struct_ref.entity_id 1 +_struct_ref.pdbx_db_accession P07751 +_struct_ref.pdbx_align_begin 1 +_struct_ref.pdbx_seq_one_letter_code +;MDPSGVKVLETAEDIQERRQQVLDRYHRFKELSSLRRQKLEDSYRFQFFQRDADELGKWIQEKLQIASDENYKDPSNLQG +KLQKHQAFEAEVQANSGAIVKLDETGNQMINEGHFASETIRTRLQELHRLWELLLEKMREKGVKLLQAQKLVQFLRECED +VMDWINDKEAIVTSEELGQDLEHVEVLQKKFEEFQTDLAAHEERVNEVNQFAGKLIQEQHPEEELIKSKQDEVNASWQRL +KGLAQQRQGKLFGAAEVQRFNRDVDETISWIKEKGQLMASDDFGRDLASVQALLRKHEGLERDLAAFHHKVKALCAEADR +LQQSHPINASQIQVKREELIANWEQIRTLAAERHARLNDSYRLQRFLADFRDLTSWVTEMKALINADELANDVAGAEALL +DRHQEHKGEIDAHEDSFRSADESGQALLAAGHYASDEVKEKLTILSDERSALLELWELRRQQYEQCMDLQLFYRDTEQVD +NWMSKQEAFLLNEDLGDSLDSVEALLKKHEDFEKSLSAQEEKITALDEFATKLIQNNHYAMDDVATRRDALLSRRNALHE +RAMKRRAQLADSFHLQQFFRDSDELKSWVNEKMKTATDEAYKDPSNLQGKVQKHQAFEAELSANQSRIDALEKAGQKLID +VNHYASDEVAARMNEVISLWKKLLEATELKGIKLREANQQQQFNRNVEDIELWLYEVEGHLASDDYGKDLTSVQNLQKKH +ALLEADVAAHQDPIDGITIQARQFQDAGHFDADNIKKKQEALVARYEALKDPMVARKQKLADSLRLQQLFRDIEDEETWI +REKEPIAASTNRGKDLIGVQNLLKKHQALQAEIAGHEPRIKAVTQKGNAMVEEGHFAAEDVKIKLNELNQKWDSLKAKAS +QRRQDLEDSLQAQQYFADANEAQSWMREKEPIVGSTDYGKDEDSAEALLKKHEALMSDLSAYGSSIQALREQAQSCRQQV +APTDDETGKELVLALYDYQEKSPREVTMKKGDILTLLNSTNKDWWKVEVNDRQGFVPAAYVKKLDPAQSASRENLLEEQG +SIALRQEQIDNQTLITKEVGSVSLRMKQVEELYHSLLELGEKRKGMLEKSCKKFMLFREANELQQWINEKEAALTNEEVG +ADLEQVEVLQKKFDDFQKDLKANESRLKDINKVANDLESEGLMAEEVQAVEHQEVYGMMPRDETDSKTVSPWKSARMMVH +TVATFNSIKELNERWRSLQQLAEERSQLLGSADEVQRFHRDADETKEWIEEKNQALNTDNYGHDLASVQALQRNDEGFER +DLAALGDKVNSLGETAQRLIQSHPELAEDLQEKCTELNQAWSSLGKRADQRKEKLGDSHDLQRFLSDFRDLMSWINGIRG +LVSSDELAKDVTGAEALLERHQEHRTEIDARAGTFQAFEQFGQQLLARGHYASPEIKEKLDILDQERTDLEKAWVQRRMM +LDQCLELQLFHRDCEQAENWMAAREAFLNTEDKGDSLDSVEALIKKHEDFDKAINVQEEKIAVLQSFADQLIAADHYAKG +VIANRRNEVLDRWRRLKAQMIEKRSKLGESQTLQQFSRDVDEIEAWISEKLQTASDESYKDPTNIQLSKLLSKHQKHQAF +EAELHANADRIRGVIEMGNPLIERGACAGSEDAVKARLAALADQWEFLVQKSSEKSQKLKEANKQQNFNTGIKDFDFWLS +EVEALLASEDYGKDLASVNNLLKKHQLLEADISAHEDRLKDLNSQADSLMTSSAFDTSQVKDKRETINGRFQRIKSMAAA +RRAKLNESHRLHQFFRDMDDEESWIKEKKLLVSSEDYGRDLTGVQNLRKKHKRLEAELAAHEPAIQGVLDTGKKLSDDNT +IGKEEIQQRLAQFVDHWKELKQLAAARGQRLEESLEYQQFVANVEEEEAWINEKMTLVASEDYGDTLAAIQGLLKKHEAF +ETDFTVHKDRVNDVCANGEDLIKKNNHHVENITAKMKGLKGKVSDLEKAAAQRKAKLDENSAFLQFNWKADVVESWIGEK +ENSLKTDDYGRDLSSVQTLLTKQETFDAGLQAFQQEGIANITALKDQLLAAKHIQSKAIEVRHASLMKRWNQLLANSAAR +KKKLLEAQEHFRKVEDLFLTFAKKASAFNSWFENAEEDLTDPVRCNSLEEIKALREAHDAFRSSLSSAQADFNQLAELDR +QIKSFRVASNPYTWFTMEALEETWRNLQKIIKERELELQKEQRRQEENDKLRQEFAQHANAFHQWIQETRTYLLDGSCMV +EESGTLESQLEATKRKHQEIRAMRSQLKKIEDLGAAMEEALILDNKYTEHSTVGLAQQWDQLDQLGMRMQHNLEQQIQAR +NTTGVTEEALKEFSMMFKHFDKDKSGRLNHQEFKSCLRSLGYDLPMVEEGEPDPEFESILDTVDPNRDGHVSLQEYMAFM +ISRETENVKSSEEIESAFRALSSERKPYVTKEELYQNLTREQADYCISHMKPYMDGKGRELPSAYDYIEFTRSLFVN +; +_struct_ref.pdbx_db_isoform ? +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 1SHG +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 2 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 62 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession P07751 +_struct_ref_seq.db_align_beg 965 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 1025 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 2 +_struct_ref_seq.pdbx_auth_seq_align_end 62 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_struct_biol.id 1 +# +_struct_sheet.id A +_struct_sheet.type ? +_struct_sheet.number_strands 5 +_struct_sheet.details ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? anti-parallel +A 4 5 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 ARG A 49 ? PRO A 54 ? ARG A 49 PRO A 54 +A 2 TRP A 41 ? VAL A 46 ? TRP A 41 VAL A 46 +A 3 ILE A 30 ? ASN A 35 ? ILE A 30 ASN A 35 +A 4 LEU A 8 ? ALA A 11 ? LEU A 8 ALA A 11 +A 5 VAL A 58 ? LEU A 61 ? VAL A 58 LEU A 61 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 O VAL A 53 ? O VAL A 53 N TRP A 42 ? N TRP A 42 +A 2 3 N GLU A 45 ? N GLU A 45 O THR A 32 ? O THR A 32 +A 3 4 N LEU A 31 ? N LEU A 31 O VAL A 9 ? O VAL A 9 +A 4 5 N LEU A 10 ? N LEU A 10 O LYS A 59 ? O LYS A 59 +# +_pdbx_validate_rmsd_bond.id 1 +_pdbx_validate_rmsd_bond.PDB_model_num 1 +_pdbx_validate_rmsd_bond.auth_atom_id_1 CD +_pdbx_validate_rmsd_bond.auth_asym_id_1 A +_pdbx_validate_rmsd_bond.auth_comp_id_1 GLU +_pdbx_validate_rmsd_bond.auth_seq_id_1 17 +_pdbx_validate_rmsd_bond.PDB_ins_code_1 ? +_pdbx_validate_rmsd_bond.label_alt_id_1 ? +_pdbx_validate_rmsd_bond.auth_atom_id_2 OE1 +_pdbx_validate_rmsd_bond.auth_asym_id_2 A +_pdbx_validate_rmsd_bond.auth_comp_id_2 GLU +_pdbx_validate_rmsd_bond.auth_seq_id_2 17 +_pdbx_validate_rmsd_bond.PDB_ins_code_2 ? +_pdbx_validate_rmsd_bond.label_alt_id_2 ? +_pdbx_validate_rmsd_bond.bond_value 1.323 +_pdbx_validate_rmsd_bond.bond_target_value 1.252 +_pdbx_validate_rmsd_bond.bond_deviation 0.071 +_pdbx_validate_rmsd_bond.bond_standard_deviation 0.011 +_pdbx_validate_rmsd_bond.linker_flag N +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 CB A ASP 14 ? ? CG A ASP 14 ? ? OD2 A ASP 14 ? ? 110.78 118.30 -7.52 0.90 N +2 1 N A ASP 48 ? ? CA A ASP 48 ? ? CB A ASP 48 ? ? 99.73 110.60 -10.87 1.80 N +3 1 CB A ASP 48 ? ? CG A ASP 48 ? ? OD1 A ASP 48 ? ? 124.97 118.30 6.67 0.90 N +4 1 CB A ASP 48 ? ? CG A ASP 48 ? ? OD2 A ASP 48 ? ? 110.48 118.30 -7.82 0.90 N +5 1 CB A ASP 62 ? ? CG A ASP 62 ? ? OD2 A ASP 62 ? ? 124.84 118.30 6.54 0.90 N +# +_pdbx_validate_torsion.id 1 +_pdbx_validate_torsion.PDB_model_num 1 +_pdbx_validate_torsion.auth_comp_id ASN +_pdbx_validate_torsion.auth_asym_id A +_pdbx_validate_torsion.auth_seq_id 47 +_pdbx_validate_torsion.PDB_ins_code ? +_pdbx_validate_torsion.label_alt_id ? +_pdbx_validate_torsion.phi 43.36 +_pdbx_validate_torsion.psi -90.10 +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A MET 1 ? A MET 1 +2 1 Y 1 A ASP 2 ? A ASP 2 +3 1 Y 1 A GLU 3 ? A GLU 3 +4 1 Y 1 A THR 4 ? A THR 4 +5 1 Y 1 A GLY 5 ? A GLY 5 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +GLN N N N N 74 +GLN CA C N S 75 +GLN C C N N 76 +GLN O O N N 77 +GLN CB C N N 78 +GLN CG C N N 79 +GLN CD C N N 80 +GLN OE1 O N N 81 +GLN NE2 N N N 82 +GLN OXT O N N 83 +GLN H H N N 84 +GLN H2 H N N 85 +GLN HA H N N 86 +GLN HB2 H N N 87 +GLN HB3 H N N 88 +GLN HG2 H N N 89 +GLN HG3 H N N 90 +GLN HE21 H N N 91 +GLN HE22 H N N 92 +GLN HXT H N N 93 +GLU N N N N 94 +GLU CA C N S 95 +GLU C C N N 96 +GLU O O N N 97 +GLU CB C N N 98 +GLU CG C N N 99 +GLU CD C N N 100 +GLU OE1 O N N 101 +GLU OE2 O N N 102 +GLU OXT O N N 103 +GLU H H N N 104 +GLU H2 H N N 105 +GLU HA H N N 106 +GLU HB2 H N N 107 +GLU HB3 H N N 108 +GLU HG2 H N N 109 +GLU HG3 H N N 110 +GLU HE2 H N N 111 +GLU HXT H N N 112 +GLY N N N N 113 +GLY CA C N N 114 +GLY C C N N 115 +GLY O O N N 116 +GLY OXT O N N 117 +GLY H H N N 118 +GLY H2 H N N 119 +GLY HA2 H N N 120 +GLY HA3 H N N 121 +GLY HXT H N N 122 +ILE N N N N 123 +ILE CA C N S 124 +ILE C C N N 125 +ILE O O N N 126 +ILE CB C N S 127 +ILE CG1 C N N 128 +ILE CG2 C N N 129 +ILE CD1 C N N 130 +ILE OXT O N N 131 +ILE H H N N 132 +ILE H2 H N N 133 +ILE HA H N N 134 +ILE HB H N N 135 +ILE HG12 H N N 136 +ILE HG13 H N N 137 +ILE HG21 H N N 138 +ILE HG22 H N N 139 +ILE HG23 H N N 140 +ILE HD11 H N N 141 +ILE HD12 H N N 142 +ILE HD13 H N N 143 +ILE HXT H N N 144 +LEU N N N N 145 +LEU CA C N S 146 +LEU C C N N 147 +LEU O O N N 148 +LEU CB C N N 149 +LEU CG C N N 150 +LEU CD1 C N N 151 +LEU CD2 C N N 152 +LEU OXT O N N 153 +LEU H H N N 154 +LEU H2 H N N 155 +LEU HA H N N 156 +LEU HB2 H N N 157 +LEU HB3 H N N 158 +LEU HG H N N 159 +LEU HD11 H N N 160 +LEU HD12 H N N 161 +LEU HD13 H N N 162 +LEU HD21 H N N 163 +LEU HD22 H N N 164 +LEU HD23 H N N 165 +LEU HXT H N N 166 +LYS N N N N 167 +LYS CA C N S 168 +LYS C C N N 169 +LYS O O N N 170 +LYS CB C N N 171 +LYS CG C N N 172 +LYS CD C N N 173 +LYS CE C N N 174 +LYS NZ N N N 175 +LYS OXT O N N 176 +LYS H H N N 177 +LYS H2 H N N 178 +LYS HA H N N 179 +LYS HB2 H N N 180 +LYS HB3 H N N 181 +LYS HG2 H N N 182 +LYS HG3 H N N 183 +LYS HD2 H N N 184 +LYS HD3 H N N 185 +LYS HE2 H N N 186 +LYS HE3 H N N 187 +LYS HZ1 H N N 188 +LYS HZ2 H N N 189 +LYS HZ3 H N N 190 +LYS HXT H N N 191 +MET N N N N 192 +MET CA C N S 193 +MET C C N N 194 +MET O O N N 195 +MET CB C N N 196 +MET CG C N N 197 +MET SD S N N 198 +MET CE C N N 199 +MET OXT O N N 200 +MET H H N N 201 +MET H2 H N N 202 +MET HA H N N 203 +MET HB2 H N N 204 +MET HB3 H N N 205 +MET HG2 H N N 206 +MET HG3 H N N 207 +MET HE1 H N N 208 +MET HE2 H N N 209 +MET HE3 H N N 210 +MET HXT H N N 211 +PHE N N N N 212 +PHE CA C N S 213 +PHE C C N N 214 +PHE O O N N 215 +PHE CB C N N 216 +PHE CG C Y N 217 +PHE CD1 C Y N 218 +PHE CD2 C Y N 219 +PHE CE1 C Y N 220 +PHE CE2 C Y N 221 +PHE CZ C Y N 222 +PHE OXT O N N 223 +PHE H H N N 224 +PHE H2 H N N 225 +PHE HA H N N 226 +PHE HB2 H N N 227 +PHE HB3 H N N 228 +PHE HD1 H N N 229 +PHE HD2 H N N 230 +PHE HE1 H N N 231 +PHE HE2 H N N 232 +PHE HZ H N N 233 +PHE HXT H N N 234 +PRO N N N N 235 +PRO CA C N S 236 +PRO C C N N 237 +PRO O O N N 238 +PRO CB C N N 239 +PRO CG C N N 240 +PRO CD C N N 241 +PRO OXT O N N 242 +PRO H H N N 243 +PRO HA H N N 244 +PRO HB2 H N N 245 +PRO HB3 H N N 246 +PRO HG2 H N N 247 +PRO HG3 H N N 248 +PRO HD2 H N N 249 +PRO HD3 H N N 250 +PRO HXT H N N 251 +SER N N N N 252 +SER CA C N S 253 +SER C C N N 254 +SER O O N N 255 +SER CB C N N 256 +SER OG O N N 257 +SER OXT O N N 258 +SER H H N N 259 +SER H2 H N N 260 +SER HA H N N 261 +SER HB2 H N N 262 +SER HB3 H N N 263 +SER HG H N N 264 +SER HXT H N N 265 +THR N N N N 266 +THR CA C N S 267 +THR C C N N 268 +THR O O N N 269 +THR CB C N R 270 +THR OG1 O N N 271 +THR CG2 C N N 272 +THR OXT O N N 273 +THR H H N N 274 +THR H2 H N N 275 +THR HA H N N 276 +THR HB H N N 277 +THR HG1 H N N 278 +THR HG21 H N N 279 +THR HG22 H N N 280 +THR HG23 H N N 281 +THR HXT H N N 282 +TRP N N N N 283 +TRP CA C N S 284 +TRP C C N N 285 +TRP O O N N 286 +TRP CB C N N 287 +TRP CG C Y N 288 +TRP CD1 C Y N 289 +TRP CD2 C Y N 290 +TRP NE1 N Y N 291 +TRP CE2 C Y N 292 +TRP CE3 C Y N 293 +TRP CZ2 C Y N 294 +TRP CZ3 C Y N 295 +TRP CH2 C Y N 296 +TRP OXT O N N 297 +TRP H H N N 298 +TRP H2 H N N 299 +TRP HA H N N 300 +TRP HB2 H N N 301 +TRP HB3 H N N 302 +TRP HD1 H N N 303 +TRP HE1 H N N 304 +TRP HE3 H N N 305 +TRP HZ2 H N N 306 +TRP HZ3 H N N 307 +TRP HH2 H N N 308 +TRP HXT H N N 309 +TYR N N N N 310 +TYR CA C N S 311 +TYR C C N N 312 +TYR O O N N 313 +TYR CB C N N 314 +TYR CG C Y N 315 +TYR CD1 C Y N 316 +TYR CD2 C Y N 317 +TYR CE1 C Y N 318 +TYR CE2 C Y N 319 +TYR CZ C Y N 320 +TYR OH O N N 321 +TYR OXT O N N 322 +TYR H H N N 323 +TYR H2 H N N 324 +TYR HA H N N 325 +TYR HB2 H N N 326 +TYR HB3 H N N 327 +TYR HD1 H N N 328 +TYR HD2 H N N 329 +TYR HE1 H N N 330 +TYR HE2 H N N 331 +TYR HH H N N 332 +TYR HXT H N N 333 +VAL N N N N 334 +VAL CA C N S 335 +VAL C C N N 336 +VAL O O N N 337 +VAL CB C N N 338 +VAL CG1 C N N 339 +VAL CG2 C N N 340 +VAL OXT O N N 341 +VAL H H N N 342 +VAL H2 H N N 343 +VAL HA H N N 344 +VAL HB H N N 345 +VAL HG11 H N N 346 +VAL HG12 H N N 347 +VAL HG13 H N N 348 +VAL HG21 H N N 349 +VAL HG22 H N N 350 +VAL HG23 H N N 351 +VAL HXT H N N 352 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +GLN N CA sing N N 70 +GLN N H sing N N 71 +GLN N H2 sing N N 72 +GLN CA C sing N N 73 +GLN CA CB sing N N 74 +GLN CA HA sing N N 75 +GLN C O doub N N 76 +GLN C OXT sing N N 77 +GLN CB CG sing N N 78 +GLN CB HB2 sing N N 79 +GLN CB HB3 sing N N 80 +GLN CG CD sing N N 81 +GLN CG HG2 sing N N 82 +GLN CG HG3 sing N N 83 +GLN CD OE1 doub N N 84 +GLN CD NE2 sing N N 85 +GLN NE2 HE21 sing N N 86 +GLN NE2 HE22 sing N N 87 +GLN OXT HXT sing N N 88 +GLU N CA sing N N 89 +GLU N H sing N N 90 +GLU N H2 sing N N 91 +GLU CA C sing N N 92 +GLU CA CB sing N N 93 +GLU CA HA sing N N 94 +GLU C O doub N N 95 +GLU C OXT sing N N 96 +GLU CB CG sing N N 97 +GLU CB HB2 sing N N 98 +GLU CB HB3 sing N N 99 +GLU CG CD sing N N 100 +GLU CG HG2 sing N N 101 +GLU CG HG3 sing N N 102 +GLU CD OE1 doub N N 103 +GLU CD OE2 sing N N 104 +GLU OE2 HE2 sing N N 105 +GLU OXT HXT sing N N 106 +GLY N CA sing N N 107 +GLY N H sing N N 108 +GLY N H2 sing N N 109 +GLY CA C sing N N 110 +GLY CA HA2 sing N N 111 +GLY CA HA3 sing N N 112 +GLY C O doub N N 113 +GLY C OXT sing N N 114 +GLY OXT HXT sing N N 115 +ILE N CA sing N N 116 +ILE N H sing N N 117 +ILE N H2 sing N N 118 +ILE CA C sing N N 119 +ILE CA CB sing N N 120 +ILE CA HA sing N N 121 +ILE C O doub N N 122 +ILE C OXT sing N N 123 +ILE CB CG1 sing N N 124 +ILE CB CG2 sing N N 125 +ILE CB HB sing N N 126 +ILE CG1 CD1 sing N N 127 +ILE CG1 HG12 sing N N 128 +ILE CG1 HG13 sing N N 129 +ILE CG2 HG21 sing N N 130 +ILE CG2 HG22 sing N N 131 +ILE CG2 HG23 sing N N 132 +ILE CD1 HD11 sing N N 133 +ILE CD1 HD12 sing N N 134 +ILE CD1 HD13 sing N N 135 +ILE OXT HXT sing N N 136 +LEU N CA sing N N 137 +LEU N H sing N N 138 +LEU N H2 sing N N 139 +LEU CA C sing N N 140 +LEU CA CB sing N N 141 +LEU CA HA sing N N 142 +LEU C O doub N N 143 +LEU C OXT sing N N 144 +LEU CB CG sing N N 145 +LEU CB HB2 sing N N 146 +LEU CB HB3 sing N N 147 +LEU CG CD1 sing N N 148 +LEU CG CD2 sing N N 149 +LEU CG HG sing N N 150 +LEU CD1 HD11 sing N N 151 +LEU CD1 HD12 sing N N 152 +LEU CD1 HD13 sing N N 153 +LEU CD2 HD21 sing N N 154 +LEU CD2 HD22 sing N N 155 +LEU CD2 HD23 sing N N 156 +LEU OXT HXT sing N N 157 +LYS N CA sing N N 158 +LYS N H sing N N 159 +LYS N H2 sing N N 160 +LYS CA C sing N N 161 +LYS CA CB sing N N 162 +LYS CA HA sing N N 163 +LYS C O doub N N 164 +LYS C OXT sing N N 165 +LYS CB CG sing N N 166 +LYS CB HB2 sing N N 167 +LYS CB HB3 sing N N 168 +LYS CG CD sing N N 169 +LYS CG HG2 sing N N 170 +LYS CG HG3 sing N N 171 +LYS CD CE sing N N 172 +LYS CD HD2 sing N N 173 +LYS CD HD3 sing N N 174 +LYS CE NZ sing N N 175 +LYS CE HE2 sing N N 176 +LYS CE HE3 sing N N 177 +LYS NZ HZ1 sing N N 178 +LYS NZ HZ2 sing N N 179 +LYS NZ HZ3 sing N N 180 +LYS OXT HXT sing N N 181 +MET N CA sing N N 182 +MET N H sing N N 183 +MET N H2 sing N N 184 +MET CA C sing N N 185 +MET CA CB sing N N 186 +MET CA HA sing N N 187 +MET C O doub N N 188 +MET C OXT sing N N 189 +MET CB CG sing N N 190 +MET CB HB2 sing N N 191 +MET CB HB3 sing N N 192 +MET CG SD sing N N 193 +MET CG HG2 sing N N 194 +MET CG HG3 sing N N 195 +MET SD CE sing N N 196 +MET CE HE1 sing N N 197 +MET CE HE2 sing N N 198 +MET CE HE3 sing N N 199 +MET OXT HXT sing N N 200 +PHE N CA sing N N 201 +PHE N H sing N N 202 +PHE N H2 sing N N 203 +PHE CA C sing N N 204 +PHE CA CB sing N N 205 +PHE CA HA sing N N 206 +PHE C O doub N N 207 +PHE C OXT sing N N 208 +PHE CB CG sing N N 209 +PHE CB HB2 sing N N 210 +PHE CB HB3 sing N N 211 +PHE CG CD1 doub Y N 212 +PHE CG CD2 sing Y N 213 +PHE CD1 CE1 sing Y N 214 +PHE CD1 HD1 sing N N 215 +PHE CD2 CE2 doub Y N 216 +PHE CD2 HD2 sing N N 217 +PHE CE1 CZ doub Y N 218 +PHE CE1 HE1 sing N N 219 +PHE CE2 CZ sing Y N 220 +PHE CE2 HE2 sing N N 221 +PHE CZ HZ sing N N 222 +PHE OXT HXT sing N N 223 +PRO N CA sing N N 224 +PRO N CD sing N N 225 +PRO N H sing N N 226 +PRO CA C sing N N 227 +PRO CA CB sing N N 228 +PRO CA HA sing N N 229 +PRO C O doub N N 230 +PRO C OXT sing N N 231 +PRO CB CG sing N N 232 +PRO CB HB2 sing N N 233 +PRO CB HB3 sing N N 234 +PRO CG CD sing N N 235 +PRO CG HG2 sing N N 236 +PRO CG HG3 sing N N 237 +PRO CD HD2 sing N N 238 +PRO CD HD3 sing N N 239 +PRO OXT HXT sing N N 240 +SER N CA sing N N 241 +SER N H sing N N 242 +SER N H2 sing N N 243 +SER CA C sing N N 244 +SER CA CB sing N N 245 +SER CA HA sing N N 246 +SER C O doub N N 247 +SER C OXT sing N N 248 +SER CB OG sing N N 249 +SER CB HB2 sing N N 250 +SER CB HB3 sing N N 251 +SER OG HG sing N N 252 +SER OXT HXT sing N N 253 +THR N CA sing N N 254 +THR N H sing N N 255 +THR N H2 sing N N 256 +THR CA C sing N N 257 +THR CA CB sing N N 258 +THR CA HA sing N N 259 +THR C O doub N N 260 +THR C OXT sing N N 261 +THR CB OG1 sing N N 262 +THR CB CG2 sing N N 263 +THR CB HB sing N N 264 +THR OG1 HG1 sing N N 265 +THR CG2 HG21 sing N N 266 +THR CG2 HG22 sing N N 267 +THR CG2 HG23 sing N N 268 +THR OXT HXT sing N N 269 +TRP N CA sing N N 270 +TRP N H sing N N 271 +TRP N H2 sing N N 272 +TRP CA C sing N N 273 +TRP CA CB sing N N 274 +TRP CA HA sing N N 275 +TRP C O doub N N 276 +TRP C OXT sing N N 277 +TRP CB CG sing N N 278 +TRP CB HB2 sing N N 279 +TRP CB HB3 sing N N 280 +TRP CG CD1 doub Y N 281 +TRP CG CD2 sing Y N 282 +TRP CD1 NE1 sing Y N 283 +TRP CD1 HD1 sing N N 284 +TRP CD2 CE2 doub Y N 285 +TRP CD2 CE3 sing Y N 286 +TRP NE1 CE2 sing Y N 287 +TRP NE1 HE1 sing N N 288 +TRP CE2 CZ2 sing Y N 289 +TRP CE3 CZ3 doub Y N 290 +TRP CE3 HE3 sing N N 291 +TRP CZ2 CH2 doub Y N 292 +TRP CZ2 HZ2 sing N N 293 +TRP CZ3 CH2 sing Y N 294 +TRP CZ3 HZ3 sing N N 295 +TRP CH2 HH2 sing N N 296 +TRP OXT HXT sing N N 297 +TYR N CA sing N N 298 +TYR N H sing N N 299 +TYR N H2 sing N N 300 +TYR CA C sing N N 301 +TYR CA CB sing N N 302 +TYR CA HA sing N N 303 +TYR C O doub N N 304 +TYR C OXT sing N N 305 +TYR CB CG sing N N 306 +TYR CB HB2 sing N N 307 +TYR CB HB3 sing N N 308 +TYR CG CD1 doub Y N 309 +TYR CG CD2 sing Y N 310 +TYR CD1 CE1 sing Y N 311 +TYR CD1 HD1 sing N N 312 +TYR CD2 CE2 doub Y N 313 +TYR CD2 HD2 sing N N 314 +TYR CE1 CZ doub Y N 315 +TYR CE1 HE1 sing N N 316 +TYR CE2 CZ sing Y N 317 +TYR CE2 HE2 sing N N 318 +TYR CZ OH sing N N 319 +TYR OH HH sing N N 320 +TYR OXT HXT sing N N 321 +VAL N CA sing N N 322 +VAL N H sing N N 323 +VAL N H2 sing N N 324 +VAL CA C sing N N 325 +VAL CA CB sing N N 326 +VAL CA HA sing N N 327 +VAL C O doub N N 328 +VAL C OXT sing N N 329 +VAL CB CG1 sing N N 330 +VAL CB CG2 sing N N 331 +VAL CB HB sing N N 332 +VAL CG1 HG11 sing N N 333 +VAL CG1 HG12 sing N N 334 +VAL CG1 HG13 sing N N 335 +VAL CG2 HG21 sing N N 336 +VAL CG2 HG22 sing N N 337 +VAL CG2 HG23 sing N N 338 +VAL OXT HXT sing N N 339 +# +_atom_sites.entry_id 1SHG +_atom_sites.fract_transf_matrix[1][1] 0.029412 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.023657 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.020060 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . LYS A 1 6 ? 17.546 22.857 3.744 1.00 78.76 ? 6 LYS A N 1 +ATOM 2 C CA . LYS A 1 6 ? 17.059 21.556 4.196 1.00 76.30 ? 6 LYS A CA 1 +ATOM 3 C C . LYS A 1 6 ? 15.974 21.754 5.234 1.00 65.62 ? 6 LYS A C 1 +ATOM 4 O O . LYS A 1 6 ? 15.949 22.802 5.886 1.00 77.26 ? 6 LYS A O 1 +ATOM 5 C CB . LYS A 1 6 ? 18.161 20.746 4.864 1.00 81.62 ? 6 LYS A CB 1 +ATOM 6 C CG . LYS A 1 6 ? 18.652 19.550 4.078 1.00 87.15 ? 6 LYS A CG 1 +ATOM 7 C CD . LYS A 1 6 ? 20.167 19.434 4.200 1.00 95.44 ? 6 LYS A CD 1 +ATOM 8 C CE . LYS A 1 6 ? 20.882 20.786 4.192 1.00 100.00 ? 6 LYS A CE 1 +ATOM 9 N NZ . LYS A 1 6 ? 22.180 20.797 4.905 1.00 100.00 ? 6 LYS A NZ 1 +ATOM 10 N N . GLU A 1 7 ? 15.191 20.705 5.471 1.00 38.83 ? 7 GLU A N 1 +ATOM 11 C CA . GLU A 1 7 ? 14.162 20.730 6.475 1.00 33.15 ? 7 GLU A CA 1 +ATOM 12 C C . GLU A 1 7 ? 14.746 21.133 7.820 1.00 20.72 ? 7 GLU A C 1 +ATOM 13 O O . GLU A 1 7 ? 15.901 20.827 8.122 1.00 26.02 ? 7 GLU A O 1 +ATOM 14 C CB . GLU A 1 7 ? 13.444 19.393 6.637 1.00 52.26 ? 7 GLU A CB 1 +ATOM 15 C CG . GLU A 1 7 ? 12.288 19.204 5.638 1.00 76.68 ? 7 GLU A CG 1 +ATOM 16 C CD . GLU A 1 7 ? 11.081 18.459 6.172 1.00 94.38 ? 7 GLU A CD 1 +ATOM 17 O OE1 . GLU A 1 7 ? 10.244 18.948 6.919 1.00 100.00 ? 7 GLU A OE1 1 +ATOM 18 O OE2 . GLU A 1 7 ? 10.981 17.244 5.682 1.00 100.00 ? 7 GLU A OE2 1 +ATOM 19 N N . LEU A 1 8 ? 13.967 21.964 8.495 1.00 21.34 ? 8 LEU A N 1 +ATOM 20 C CA . LEU A 1 8 ? 14.317 22.428 9.805 1.00 25.70 ? 8 LEU A CA 1 +ATOM 21 C C . LEU A 1 8 ? 13.339 21.843 10.805 1.00 25.57 ? 8 LEU A C 1 +ATOM 22 O O . LEU A 1 8 ? 12.147 21.718 10.524 1.00 29.88 ? 8 LEU A O 1 +ATOM 23 C CB . LEU A 1 8 ? 14.219 23.962 9.879 1.00 26.56 ? 8 LEU A CB 1 +ATOM 24 C CG . LEU A 1 8 ? 15.045 24.619 8.784 1.00 27.51 ? 8 LEU A CG 1 +ATOM 25 C CD1 . LEU A 1 8 ? 14.895 26.138 8.875 1.00 30.70 ? 8 LEU A CD1 1 +ATOM 26 C CD2 . LEU A 1 8 ? 16.493 24.215 8.999 1.00 29.29 ? 8 LEU A CD2 1 +ATOM 27 N N . VAL A 1 9 ? 13.805 21.618 12.040 1.00 24.23 ? 9 VAL A N 1 +ATOM 28 C CA . VAL A 1 9 ? 12.854 21.230 13.058 1.00 20.73 ? 9 VAL A CA 1 +ATOM 29 C C . VAL A 1 9 ? 13.140 22.108 14.267 1.00 15.52 ? 9 VAL A C 1 +ATOM 30 O O . VAL A 1 9 ? 14.263 22.567 14.493 1.00 22.32 ? 9 VAL A O 1 +ATOM 31 C CB . VAL A 1 9 ? 13.012 19.745 13.457 1.00 27.00 ? 9 VAL A CB 1 +ATOM 32 C CG1 . VAL A 1 9 ? 12.514 18.881 12.312 1.00 26.59 ? 9 VAL A CG1 1 +ATOM 33 C CG2 . VAL A 1 9 ? 14.446 19.389 13.823 1.00 21.87 ? 9 VAL A CG2 1 +ATOM 34 N N . LEU A 1 10 ? 12.141 22.214 15.051 1.00 19.27 ? 10 LEU A N 1 +ATOM 35 C CA . LEU A 1 10 ? 12.275 22.955 16.291 1.00 21.59 ? 10 LEU A CA 1 +ATOM 36 C C . LEU A 1 10 ? 12.384 21.921 17.422 1.00 21.66 ? 10 LEU A C 1 +ATOM 37 O O . LEU A 1 10 ? 11.508 21.069 17.525 1.00 21.74 ? 10 LEU A O 1 +ATOM 38 C CB . LEU A 1 10 ? 10.922 23.734 16.486 1.00 22.58 ? 10 LEU A CB 1 +ATOM 39 C CG . LEU A 1 10 ? 10.653 24.229 17.915 1.00 20.72 ? 10 LEU A CG 1 +ATOM 40 C CD1 . LEU A 1 10 ? 11.702 25.247 18.284 1.00 23.17 ? 10 LEU A CD1 1 +ATOM 41 C CD2 . LEU A 1 10 ? 9.287 24.890 17.997 1.00 23.93 ? 10 LEU A CD2 1 +ATOM 42 N N . ALA A 1 11 ? 13.282 22.168 18.353 1.00 19.76 ? 11 ALA A N 1 +ATOM 43 C CA . ALA A 1 11 ? 13.421 21.354 19.556 1.00 21.71 ? 11 ALA A CA 1 +ATOM 44 C C . ALA A 1 11 ? 12.266 21.667 20.517 1.00 28.80 ? 11 ALA A C 1 +ATOM 45 O O . ALA A 1 11 ? 12.090 22.828 20.949 1.00 29.01 ? 11 ALA A O 1 +ATOM 46 C CB . ALA A 1 11 ? 14.800 21.605 20.236 1.00 24.04 ? 11 ALA A CB 1 +ATOM 47 N N . LEU A 1 12 ? 11.422 20.689 20.795 1.00 20.59 ? 12 LEU A N 1 +ATOM 48 C CA . LEU A 1 12 ? 10.373 20.966 21.742 1.00 24.62 ? 12 LEU A CA 1 +ATOM 49 C C . LEU A 1 12 ? 10.832 20.813 23.207 1.00 28.81 ? 12 LEU A C 1 +ATOM 50 O O . LEU A 1 12 ? 10.221 21.351 24.133 1.00 28.22 ? 12 LEU A O 1 +ATOM 51 C CB . LEU A 1 12 ? 9.112 20.143 21.463 1.00 21.00 ? 12 LEU A CB 1 +ATOM 52 C CG . LEU A 1 12 ? 8.680 20.155 20.013 1.00 26.95 ? 12 LEU A CG 1 +ATOM 53 C CD1 . LEU A 1 12 ? 7.602 19.120 19.771 1.00 27.87 ? 12 LEU A CD1 1 +ATOM 54 C CD2 . LEU A 1 12 ? 8.070 21.491 19.607 1.00 31.27 ? 12 LEU A CD2 1 +ATOM 55 N N . TYR A 1 13 ? 11.900 20.079 23.453 1.00 22.02 ? 13 TYR A N 1 +ATOM 56 C CA . TYR A 1 13 ? 12.375 19.814 24.803 1.00 20.27 ? 13 TYR A CA 1 +ATOM 57 C C . TYR A 1 13 ? 13.837 19.737 24.803 1.00 22.60 ? 13 TYR A C 1 +ATOM 58 O O . TYR A 1 13 ? 14.459 19.447 23.769 1.00 28.30 ? 13 TYR A O 1 +ATOM 59 C CB . TYR A 1 13 ? 11.895 18.427 25.409 1.00 23.21 ? 13 TYR A CB 1 +ATOM 60 C CG . TYR A 1 13 ? 10.402 18.242 25.397 1.00 23.31 ? 13 TYR A CG 1 +ATOM 61 C CD1 . TYR A 1 13 ? 9.576 18.698 26.429 1.00 24.57 ? 13 TYR A CD1 1 +ATOM 62 C CD2 . TYR A 1 13 ? 9.797 17.671 24.281 1.00 26.07 ? 13 TYR A CD2 1 +ATOM 63 C CE1 . TYR A 1 13 ? 8.187 18.699 26.288 1.00 25.36 ? 13 TYR A CE1 1 +ATOM 64 C CE2 . TYR A 1 13 ? 8.415 17.507 24.202 1.00 32.70 ? 13 TYR A CE2 1 +ATOM 65 C CZ . TYR A 1 13 ? 7.601 18.079 25.182 1.00 33.30 ? 13 TYR A CZ 1 +ATOM 66 O OH . TYR A 1 13 ? 6.228 17.955 25.054 1.00 38.03 ? 13 TYR A OH 1 +ATOM 67 N N . ASP A 1 14 ? 14.403 19.906 25.988 1.00 22.45 ? 14 ASP A N 1 +ATOM 68 C CA . ASP A 1 14 ? 15.823 19.633 26.189 1.00 27.23 ? 14 ASP A CA 1 +ATOM 69 C C . ASP A 1 14 ? 16.070 18.134 25.990 1.00 33.32 ? 14 ASP A C 1 +ATOM 70 O O . ASP A 1 14 ? 15.151 17.325 26.257 1.00 34.92 ? 14 ASP A O 1 +ATOM 71 C CB . ASP A 1 14 ? 16.185 19.844 27.647 1.00 34.52 ? 14 ASP A CB 1 +ATOM 72 C CG . ASP A 1 14 ? 16.424 21.271 27.924 1.00 47.69 ? 14 ASP A CG 1 +ATOM 73 O OD1 . ASP A 1 14 ? 16.149 22.157 27.128 1.00 39.55 ? 14 ASP A OD1 1 +ATOM 74 O OD2 . ASP A 1 14 ? 16.994 21.428 29.090 1.00 63.64 ? 14 ASP A OD2 1 +ATOM 75 N N . TYR A 1 15 ? 17.230 17.797 25.445 1.00 26.10 ? 15 TYR A N 1 +ATOM 76 C CA . TYR A 1 15 ? 17.596 16.393 25.263 1.00 27.53 ? 15 TYR A CA 1 +ATOM 77 C C . TYR A 1 15 ? 19.078 16.241 25.413 1.00 27.14 ? 15 TYR A C 1 +ATOM 78 O O . TYR A 1 15 ? 19.848 16.802 24.637 1.00 27.90 ? 15 TYR A O 1 +ATOM 79 C CB . TYR A 1 15 ? 17.125 15.737 23.959 1.00 27.01 ? 15 TYR A CB 1 +ATOM 80 C CG . TYR A 1 15 ? 17.353 14.238 23.946 1.00 24.48 ? 15 TYR A CG 1 +ATOM 81 C CD1 . TYR A 1 15 ? 16.505 13.385 24.652 1.00 25.83 ? 15 TYR A CD1 1 +ATOM 82 C CD2 . TYR A 1 15 ? 18.480 13.711 23.311 1.00 24.05 ? 15 TYR A CD2 1 +ATOM 83 C CE1 . TYR A 1 15 ? 16.857 12.039 24.780 1.00 27.74 ? 15 TYR A CE1 1 +ATOM 84 C CE2 . TYR A 1 15 ? 18.834 12.365 23.408 1.00 27.51 ? 15 TYR A CE2 1 +ATOM 85 C CZ . TYR A 1 15 ? 17.990 11.527 24.142 1.00 29.08 ? 15 TYR A CZ 1 +ATOM 86 O OH . TYR A 1 15 ? 18.301 10.188 24.263 1.00 29.68 ? 15 TYR A OH 1 +ATOM 87 N N . GLN A 1 16 ? 19.511 15.464 26.421 1.00 24.45 ? 16 GLN A N 1 +ATOM 88 C CA . GLN A 1 16 ? 20.928 15.243 26.628 1.00 29.10 ? 16 GLN A CA 1 +ATOM 89 C C . GLN A 1 16 ? 21.321 13.870 26.066 1.00 23.76 ? 16 GLN A C 1 +ATOM 90 O O . GLN A 1 16 ? 20.746 12.825 26.346 1.00 26.46 ? 16 GLN A O 1 +ATOM 91 C CB . GLN A 1 16 ? 21.256 15.401 28.135 1.00 43.80 ? 16 GLN A CB 1 +ATOM 92 C CG . GLN A 1 16 ? 20.734 16.732 28.789 1.00 63.80 ? 16 GLN A CG 1 +ATOM 93 C CD . GLN A 1 16 ? 19.206 16.968 28.865 1.00 78.09 ? 16 GLN A CD 1 +ATOM 94 O OE1 . GLN A 1 16 ? 18.375 16.025 28.926 1.00 86.37 ? 16 GLN A OE1 1 +ATOM 95 N NE2 . GLN A 1 16 ? 18.801 18.247 28.883 1.00 72.70 ? 16 GLN A NE2 1 +ATOM 96 N N . GLU A 1 17 ? 22.350 13.856 25.311 1.00 21.29 ? 17 GLU A N 1 +ATOM 97 C CA . GLU A 1 17 ? 22.640 12.650 24.646 1.00 27.73 ? 17 GLU A CA 1 +ATOM 98 C C . GLU A 1 17 ? 22.943 11.555 25.629 1.00 31.21 ? 17 GLU A C 1 +ATOM 99 O O . GLU A 1 17 ? 23.593 11.818 26.636 1.00 29.02 ? 17 GLU A O 1 +ATOM 100 C CB . GLU A 1 17 ? 23.791 12.819 23.670 1.00 22.30 ? 17 GLU A CB 1 +ATOM 101 C CG . GLU A 1 17 ? 25.088 13.141 24.401 1.00 23.84 ? 17 GLU A CG 1 +ATOM 102 C CD . GLU A 1 17 ? 25.923 13.944 23.451 1.00 38.42 ? 17 GLU A CD 1 +ATOM 103 O OE1 . GLU A 1 17 ? 25.353 15.104 23.170 1.00 45.10 ? 17 GLU A OE1 1 +ATOM 104 O OE2 . GLU A 1 17 ? 26.924 13.504 22.894 1.00 37.47 ? 17 GLU A OE2 1 +ATOM 105 N N . LYS A 1 18 ? 22.565 10.342 25.278 1.00 23.90 ? 18 LYS A N 1 +ATOM 106 C CA . LYS A 1 18 ? 22.881 9.226 26.183 1.00 35.09 ? 18 LYS A CA 1 +ATOM 107 C C . LYS A 1 18 ? 23.654 8.054 25.526 1.00 37.11 ? 18 LYS A C 1 +ATOM 108 O O . LYS A 1 18 ? 23.916 7.005 26.095 1.00 31.61 ? 18 LYS A O 1 +ATOM 109 C CB . LYS A 1 18 ? 21.626 8.802 26.927 1.00 39.56 ? 18 LYS A CB 1 +ATOM 110 C CG . LYS A 1 18 ? 21.295 9.747 28.075 1.00 52.91 ? 18 LYS A CG 1 +ATOM 111 C CD . LYS A 1 18 ? 19.832 9.656 28.521 1.00 65.34 ? 18 LYS A CD 1 +ATOM 112 C CE . LYS A 1 18 ? 19.291 10.915 29.234 1.00 73.13 ? 18 LYS A CE 1 +ATOM 113 N NZ . LYS A 1 18 ? 18.240 11.648 28.483 1.00 71.54 ? 18 LYS A NZ 1 +ATOM 114 N N . SER A 1 19 ? 24.053 8.226 24.285 1.00 30.36 ? 19 SER A N 1 +ATOM 115 C CA . SER A 1 19 ? 24.660 7.160 23.549 1.00 26.36 ? 19 SER A CA 1 +ATOM 116 C C . SER A 1 19 ? 25.535 7.779 22.477 1.00 29.48 ? 19 SER A C 1 +ATOM 117 O O . SER A 1 19 ? 25.418 8.972 22.153 1.00 23.67 ? 19 SER A O 1 +ATOM 118 C CB . SER A 1 19 ? 23.565 6.236 22.973 1.00 25.45 ? 19 SER A CB 1 +ATOM 119 O OG . SER A 1 19 ? 23.649 6.293 21.578 1.00 31.09 ? 19 SER A OG 1 +ATOM 120 N N . PRO A 1 20 ? 26.456 6.984 21.932 1.00 31.40 ? 20 PRO A N 1 +ATOM 121 C CA . PRO A 1 20 ? 27.390 7.519 20.994 1.00 25.88 ? 20 PRO A CA 1 +ATOM 122 C C . PRO A 1 20 ? 26.810 8.235 19.795 1.00 26.13 ? 20 PRO A C 1 +ATOM 123 O O . PRO A 1 20 ? 27.408 9.205 19.263 1.00 31.93 ? 20 PRO A O 1 +ATOM 124 C CB . PRO A 1 20 ? 28.310 6.370 20.602 1.00 27.00 ? 20 PRO A CB 1 +ATOM 125 C CG . PRO A 1 20 ? 28.266 5.440 21.786 1.00 30.20 ? 20 PRO A CG 1 +ATOM 126 C CD . PRO A 1 20 ? 27.123 5.869 22.666 1.00 34.89 ? 20 PRO A CD 1 +ATOM 127 N N . ARG A 1 21 ? 25.707 7.704 19.328 1.00 25.29 ? 21 ARG A N 1 +ATOM 128 C CA . ARG A 1 21 ? 25.254 8.256 18.107 1.00 26.36 ? 21 ARG A CA 1 +ATOM 129 C C . ARG A 1 21 ? 24.305 9.396 18.344 1.00 22.09 ? 21 ARG A C 1 +ATOM 130 O O . ARG A 1 21 ? 23.679 9.820 17.374 1.00 22.07 ? 21 ARG A O 1 +ATOM 131 C CB . ARG A 1 21 ? 24.598 7.159 17.285 1.00 32.00 ? 21 ARG A CB 1 +ATOM 132 C CG . ARG A 1 21 ? 23.540 6.529 18.149 1.00 37.45 ? 21 ARG A CG 1 +ATOM 133 C CD . ARG A 1 21 ? 22.755 5.434 17.456 1.00 40.80 ? 21 ARG A CD 1 +ATOM 134 N NE . ARG A 1 21 ? 21.685 4.964 18.326 1.00 47.00 ? 21 ARG A NE 1 +ATOM 135 C CZ . ARG A 1 21 ? 21.517 3.704 18.728 1.00 51.61 ? 21 ARG A CZ 1 +ATOM 136 N NH1 . ARG A 1 21 ? 22.257 2.694 18.273 1.00 46.57 ? 21 ARG A NH1 1 +ATOM 137 N NH2 . ARG A 1 21 ? 20.474 3.429 19.505 1.00 53.29 ? 21 ARG A NH2 1 +ATOM 138 N N . GLU A 1 22 ? 24.084 9.763 19.615 1.00 18.27 ? 22 GLU A N 1 +ATOM 139 C CA . GLU A 1 22 ? 23.074 10.778 19.941 1.00 18.98 ? 22 GLU A CA 1 +ATOM 140 C C . GLU A 1 22 ? 23.633 12.202 20.015 1.00 23.65 ? 22 GLU A C 1 +ATOM 141 O O . GLU A 1 22 ? 24.811 12.408 20.231 1.00 25.60 ? 22 GLU A O 1 +ATOM 142 C CB . GLU A 1 22 ? 22.440 10.442 21.291 1.00 18.01 ? 22 GLU A CB 1 +ATOM 143 C CG . GLU A 1 22 ? 21.416 9.335 21.113 1.00 22.13 ? 22 GLU A CG 1 +ATOM 144 C CD . GLU A 1 22 ? 20.829 8.900 22.408 1.00 24.46 ? 22 GLU A CD 1 +ATOM 145 O OE1 . GLU A 1 22 ? 20.827 9.564 23.428 1.00 26.36 ? 22 GLU A OE1 1 +ATOM 146 O OE2 . GLU A 1 22 ? 20.379 7.698 22.322 1.00 25.98 ? 22 GLU A OE2 1 +ATOM 147 N N . VAL A 1 23 ? 22.795 13.219 19.887 1.00 21.31 ? 23 VAL A N 1 +ATOM 148 C CA . VAL A 1 23 ? 23.332 14.573 20.104 1.00 24.39 ? 23 VAL A CA 1 +ATOM 149 C C . VAL A 1 23 ? 22.542 15.272 21.192 1.00 23.00 ? 23 VAL A C 1 +ATOM 150 O O . VAL A 1 23 ? 21.449 14.848 21.522 1.00 25.58 ? 23 VAL A O 1 +ATOM 151 C CB . VAL A 1 23 ? 23.534 15.406 18.819 1.00 19.52 ? 23 VAL A CB 1 +ATOM 152 C CG1 . VAL A 1 23 ? 24.462 14.571 17.981 1.00 25.33 ? 23 VAL A CG1 1 +ATOM 153 C CG2 . VAL A 1 23 ? 22.219 15.422 18.085 1.00 18.80 ? 23 VAL A CG2 1 +ATOM 154 N N . THR A 1 24 ? 23.046 16.341 21.748 1.00 23.53 ? 24 THR A N 1 +ATOM 155 C CA . THR A 1 24 ? 22.281 17.030 22.776 1.00 21.27 ? 24 THR A CA 1 +ATOM 156 C C . THR A 1 24 ? 21.601 18.204 22.143 1.00 19.50 ? 24 THR A C 1 +ATOM 157 O O . THR A 1 24 ? 22.216 18.838 21.304 1.00 25.38 ? 24 THR A O 1 +ATOM 158 C CB . THR A 1 24 ? 23.273 17.514 23.863 1.00 24.80 ? 24 THR A CB 1 +ATOM 159 O OG1 . THR A 1 24 ? 23.737 16.370 24.556 1.00 25.78 ? 24 THR A OG1 1 +ATOM 160 C CG2 . THR A 1 24 ? 22.564 18.409 24.861 1.00 23.25 ? 24 THR A CG2 1 +ATOM 161 N N . MET A 1 25 ? 20.443 18.579 22.596 1.00 16.57 ? 25 MET A N 1 +ATOM 162 C CA . MET A 1 25 ? 19.806 19.795 22.088 1.00 18.58 ? 25 MET A CA 1 +ATOM 163 C C . MET A 1 25 ? 19.086 20.447 23.230 1.00 27.89 ? 25 MET A C 1 +ATOM 164 O O . MET A 1 25 ? 18.811 19.749 24.211 1.00 30.55 ? 25 MET A O 1 +ATOM 165 C CB . MET A 1 25 ? 18.822 19.591 20.904 1.00 17.76 ? 25 MET A CB 1 +ATOM 166 C CG . MET A 1 25 ? 17.571 18.888 21.354 1.00 22.20 ? 25 MET A CG 1 +ATOM 167 S SD . MET A 1 25 ? 16.560 18.173 20.072 1.00 23.66 ? 25 MET A SD 1 +ATOM 168 C CE . MET A 1 25 ? 15.265 17.384 21.026 1.00 18.97 ? 25 MET A CE 1 +ATOM 169 N N . LYS A 1 26 ? 18.716 21.739 23.067 1.00 24.47 ? 26 LYS A N 1 +ATOM 170 C CA . LYS A 1 26 ? 17.963 22.548 24.037 1.00 27.96 ? 26 LYS A CA 1 +ATOM 171 C C . LYS A 1 26 ? 16.670 22.962 23.422 1.00 24.11 ? 26 LYS A C 1 +ATOM 172 O O . LYS A 1 26 ? 16.625 23.335 22.246 1.00 25.47 ? 26 LYS A O 1 +ATOM 173 C CB . LYS A 1 26 ? 18.634 23.883 24.403 1.00 35.83 ? 26 LYS A CB 1 +ATOM 174 C CG . LYS A 1 26 ? 20.011 23.768 25.032 1.00 54.60 ? 26 LYS A CG 1 +ATOM 175 C CD . LYS A 1 26 ? 20.162 24.606 26.306 1.00 67.86 ? 26 LYS A CD 1 +ATOM 176 C CE . LYS A 1 26 ? 21.126 25.796 26.215 1.00 70.67 ? 26 LYS A CE 1 +ATOM 177 N NZ . LYS A 1 26 ? 20.430 27.100 26.268 1.00 71.42 ? 26 LYS A NZ 1 +ATOM 178 N N . LYS A 1 27 ? 15.681 23.041 24.282 1.00 18.98 ? 27 LYS A N 1 +ATOM 179 C CA . LYS A 1 27 ? 14.385 23.489 23.934 1.00 18.98 ? 27 LYS A CA 1 +ATOM 180 C C . LYS A 1 27 ? 14.488 24.821 23.179 1.00 24.14 ? 27 LYS A C 1 +ATOM 181 O O . LYS A 1 27 ? 15.187 25.714 23.605 1.00 23.32 ? 27 LYS A O 1 +ATOM 182 C CB . LYS A 1 27 ? 13.621 23.663 25.196 1.00 22.50 ? 27 LYS A CB 1 +ATOM 183 C CG . LYS A 1 27 ? 12.194 23.949 24.909 1.00 29.66 ? 27 LYS A CG 1 +ATOM 184 C CD . LYS A 1 27 ? 11.389 24.090 26.206 1.00 45.01 ? 27 LYS A CD 1 +ATOM 185 C CE . LYS A 1 27 ? 9.933 24.557 26.008 1.00 61.36 ? 27 LYS A CE 1 +ATOM 186 N NZ . LYS A 1 27 ? 8.912 23.571 26.435 1.00 70.77 ? 27 LYS A NZ 1 +ATOM 187 N N . GLY A 1 28 ? 13.828 24.924 22.028 1.00 23.85 ? 28 GLY A N 1 +ATOM 188 C CA . GLY A 1 28 ? 13.869 26.116 21.192 1.00 24.94 ? 28 GLY A CA 1 +ATOM 189 C C . GLY A 1 28 ? 14.977 26.119 20.153 1.00 27.69 ? 28 GLY A C 1 +ATOM 190 O O . GLY A 1 28 ? 14.986 27.002 19.293 1.00 29.78 ? 28 GLY A O 1 +ATOM 191 N N . ASP A 1 29 ? 15.914 25.160 20.207 1.00 23.52 ? 29 ASP A N 1 +ATOM 192 C CA . ASP A 1 29 ? 16.903 25.004 19.144 1.00 17.61 ? 29 ASP A CA 1 +ATOM 193 C C . ASP A 1 29 ? 16.222 24.746 17.802 1.00 17.32 ? 29 ASP A C 1 +ATOM 194 O O . ASP A 1 29 ? 15.226 24.041 17.687 1.00 21.89 ? 29 ASP A O 1 +ATOM 195 C CB . ASP A 1 29 ? 18.013 23.952 19.383 1.00 14.00 ? 29 ASP A CB 1 +ATOM 196 C CG . ASP A 1 29 ? 18.935 24.348 20.434 1.00 24.56 ? 29 ASP A CG 1 +ATOM 197 O OD1 . ASP A 1 29 ? 19.013 25.488 20.818 1.00 33.65 ? 29 ASP A OD1 1 +ATOM 198 O OD2 . ASP A 1 29 ? 19.790 23.416 20.753 1.00 25.71 ? 29 ASP A OD2 1 +ATOM 199 N N . ILE A 1 30 ? 16.813 25.339 16.743 1.00 19.71 ? 30 ILE A N 1 +ATOM 200 C CA . ILE A 1 30 ? 16.363 25.131 15.380 1.00 20.57 ? 30 ILE A CA 1 +ATOM 201 C C . ILE A 1 30 ? 17.413 24.181 14.758 1.00 20.68 ? 30 ILE A C 1 +ATOM 202 O O . ILE A 1 30 ? 18.607 24.503 14.588 1.00 19.70 ? 30 ILE A O 1 +ATOM 203 C CB . ILE A 1 30 ? 16.271 26.405 14.525 1.00 19.60 ? 30 ILE A CB 1 +ATOM 204 C CG1 . ILE A 1 30 ? 15.298 27.386 15.160 1.00 23.84 ? 30 ILE A CG1 1 +ATOM 205 C CG2 . ILE A 1 30 ? 15.726 26.047 13.149 1.00 18.43 ? 30 ILE A CG2 1 +ATOM 206 C CD1 . ILE A 1 30 ? 13.977 26.763 15.530 1.00 22.41 ? 30 ILE A CD1 1 +ATOM 207 N N . LEU A 1 31 ? 16.958 22.964 14.420 1.00 19.90 ? 31 LEU A N 1 +ATOM 208 C CA . LEU A 1 31 ? 17.940 21.959 13.964 1.00 19.22 ? 31 LEU A CA 1 +ATOM 209 C C . LEU A 1 31 ? 17.727 21.723 12.490 1.00 17.32 ? 31 LEU A C 1 +ATOM 210 O O . LEU A 1 31 ? 16.595 21.885 12.016 1.00 23.56 ? 31 LEU A O 1 +ATOM 211 C CB . LEU A 1 31 ? 17.715 20.579 14.676 1.00 20.14 ? 31 LEU A CB 1 +ATOM 212 C CG . LEU A 1 31 ? 17.681 20.782 16.185 1.00 30.04 ? 31 LEU A CG 1 +ATOM 213 C CD1 . LEU A 1 31 ? 17.214 19.599 17.032 1.00 33.73 ? 31 LEU A CD1 1 +ATOM 214 C CD2 . LEU A 1 31 ? 19.076 21.165 16.559 1.00 30.10 ? 31 LEU A CD2 1 +ATOM 215 N N . THR A 1 32 ? 18.776 21.229 11.841 1.00 20.95 ? 32 THR A N 1 +ATOM 216 C CA . THR A 1 32 ? 18.601 20.822 10.426 1.00 21.70 ? 32 THR A CA 1 +ATOM 217 C C . THR A 1 32 ? 18.334 19.307 10.412 1.00 22.58 ? 32 THR A C 1 +ATOM 218 O O . THR A 1 32 ? 19.113 18.551 11.045 1.00 21.07 ? 32 THR A O 1 +ATOM 219 C CB . THR A 1 32 ? 19.892 21.093 9.658 1.00 29.57 ? 32 THR A CB 1 +ATOM 220 O OG1 . THR A 1 32 ? 20.091 22.514 9.650 1.00 24.81 ? 32 THR A OG1 1 +ATOM 221 C CG2 . THR A 1 32 ? 19.826 20.440 8.258 1.00 28.54 ? 32 THR A CG2 1 +ATOM 222 N N . LEU A 1 33 ? 17.218 18.921 9.830 1.00 20.65 ? 33 LEU A N 1 +ATOM 223 C CA . LEU A 1 33 ? 16.856 17.508 9.753 1.00 19.57 ? 33 LEU A CA 1 +ATOM 224 C C . LEU A 1 33 ? 17.676 16.823 8.663 1.00 25.82 ? 33 LEU A C 1 +ATOM 225 O O . LEU A 1 33 ? 17.687 17.275 7.487 1.00 29.71 ? 33 LEU A O 1 +ATOM 226 C CB . LEU A 1 33 ? 15.373 17.449 9.467 1.00 24.88 ? 33 LEU A CB 1 +ATOM 227 C CG . LEU A 1 33 ? 14.716 16.047 9.445 1.00 23.19 ? 33 LEU A CG 1 +ATOM 228 C CD1 . LEU A 1 33 ? 15.030 15.262 10.741 1.00 21.98 ? 33 LEU A CD1 1 +ATOM 229 C CD2 . LEU A 1 33 ? 13.201 16.180 9.214 1.00 22.39 ? 33 LEU A CD2 1 +ATOM 230 N N . LEU A 1 34 ? 18.453 15.795 9.072 1.00 19.75 ? 34 LEU A N 1 +ATOM 231 C CA . LEU A 1 34 ? 19.272 14.972 8.153 1.00 17.63 ? 34 LEU A CA 1 +ATOM 232 C C . LEU A 1 34 ? 18.569 13.716 7.673 1.00 24.96 ? 34 LEU A C 1 +ATOM 233 O O . LEU A 1 34 ? 18.598 13.369 6.490 1.00 27.53 ? 34 LEU A O 1 +ATOM 234 C CB . LEU A 1 34 ? 20.648 14.592 8.666 1.00 17.76 ? 34 LEU A CB 1 +ATOM 235 C CG . LEU A 1 34 ? 21.517 15.767 9.049 1.00 31.74 ? 34 LEU A CG 1 +ATOM 236 C CD1 . LEU A 1 34 ? 22.937 15.264 9.319 1.00 33.77 ? 34 LEU A CD1 1 +ATOM 237 C CD2 . LEU A 1 34 ? 21.498 16.770 7.894 1.00 36.62 ? 34 LEU A CD2 1 +ATOM 238 N N . ASN A 1 35 ? 17.872 13.027 8.561 1.00 18.74 ? 35 ASN A N 1 +ATOM 239 C CA . ASN A 1 35 ? 17.237 11.813 8.070 1.00 19.06 ? 35 ASN A CA 1 +ATOM 240 C C . ASN A 1 35 ? 16.107 11.526 8.987 1.00 17.85 ? 35 ASN A C 1 +ATOM 241 O O . ASN A 1 35 ? 16.337 11.365 10.180 1.00 23.31 ? 35 ASN A O 1 +ATOM 242 C CB . ASN A 1 35 ? 18.312 10.650 8.188 1.00 19.72 ? 35 ASN A CB 1 +ATOM 243 C CG . ASN A 1 35 ? 17.814 9.356 7.589 1.00 20.66 ? 35 ASN A CG 1 +ATOM 244 O OD1 . ASN A 1 35 ? 16.726 8.884 7.883 1.00 23.58 ? 35 ASN A OD1 1 +ATOM 245 N ND2 . ASN A 1 35 ? 18.684 8.726 6.848 1.00 26.29 ? 35 ASN A ND2 1 +ATOM 246 N N . SER A 1 36 ? 14.916 11.358 8.445 1.00 15.68 ? 36 SER A N 1 +ATOM 247 C CA . SER A 1 36 ? 13.783 11.070 9.288 1.00 21.65 ? 36 SER A CA 1 +ATOM 248 C C . SER A 1 36 ? 13.107 9.754 8.883 1.00 18.87 ? 36 SER A C 1 +ATOM 249 O O . SER A 1 36 ? 11.910 9.617 9.027 1.00 20.10 ? 36 SER A O 1 +ATOM 250 C CB . SER A 1 36 ? 12.807 12.245 9.193 1.00 33.61 ? 36 SER A CB 1 +ATOM 251 O OG . SER A 1 36 ? 12.538 12.495 7.815 1.00 30.09 ? 36 SER A OG 1 +ATOM 252 N N . THR A 1 37 ? 13.894 8.826 8.320 1.00 18.63 ? 37 THR A N 1 +ATOM 253 C CA . THR A 1 37 ? 13.325 7.539 7.914 1.00 26.46 ? 37 THR A CA 1 +ATOM 254 C C . THR A 1 37 ? 12.855 6.652 9.087 1.00 23.26 ? 37 THR A C 1 +ATOM 255 O O . THR A 1 37 ? 11.930 5.880 8.953 1.00 24.23 ? 37 THR A O 1 +ATOM 256 C CB . THR A 1 37 ? 14.322 6.770 7.022 1.00 19.42 ? 37 THR A CB 1 +ATOM 257 O OG1 . THR A 1 37 ? 15.511 6.523 7.756 1.00 21.19 ? 37 THR A OG1 1 +ATOM 258 C CG2 . THR A 1 37 ? 14.620 7.560 5.742 1.00 18.81 ? 37 THR A CG2 1 +ATOM 259 N N . ASN A 1 38 ? 13.554 6.720 10.234 1.00 19.03 ? 38 ASN A N 1 +ATOM 260 C CA . ASN A 1 38 ? 13.170 5.979 11.440 1.00 21.95 ? 38 ASN A CA 1 +ATOM 261 C C . ASN A 1 38 ? 12.043 6.665 12.197 1.00 27.42 ? 38 ASN A C 1 +ATOM 262 O O . ASN A 1 38 ? 12.029 7.886 12.370 1.00 26.11 ? 38 ASN A O 1 +ATOM 263 C CB . ASN A 1 38 ? 14.381 5.826 12.351 1.00 20.80 ? 38 ASN A CB 1 +ATOM 264 C CG . ASN A 1 38 ? 14.110 4.825 13.435 1.00 24.53 ? 38 ASN A CG 1 +ATOM 265 O OD1 . ASN A 1 38 ? 13.532 5.217 14.438 1.00 24.89 ? 38 ASN A OD1 1 +ATOM 266 N ND2 . ASN A 1 38 ? 14.469 3.555 13.193 1.00 18.39 ? 38 ASN A ND2 1 +ATOM 267 N N . LYS A 1 39 ? 11.064 5.906 12.610 1.00 22.82 ? 39 LYS A N 1 +ATOM 268 C CA . LYS A 1 39 ? 9.934 6.491 13.294 1.00 26.59 ? 39 LYS A CA 1 +ATOM 269 C C . LYS A 1 39 ? 10.283 6.988 14.687 1.00 20.95 ? 39 LYS A C 1 +ATOM 270 O O . LYS A 1 39 ? 9.691 7.896 15.212 1.00 24.99 ? 39 LYS A O 1 +ATOM 271 C CB . LYS A 1 39 ? 8.770 5.549 13.367 1.00 38.24 ? 39 LYS A CB 1 +ATOM 272 C CG . LYS A 1 39 ? 8.239 5.381 14.767 1.00 58.65 ? 39 LYS A CG 1 +ATOM 273 C CD . LYS A 1 39 ? 7.495 4.058 14.983 1.00 70.43 ? 39 LYS A CD 1 +ATOM 274 C CE . LYS A 1 39 ? 7.466 3.625 16.452 1.00 69.17 ? 39 LYS A CE 1 +ATOM 275 N NZ . LYS A 1 39 ? 8.130 2.338 16.693 1.00 61.26 ? 39 LYS A NZ 1 +ATOM 276 N N . ASP A 1 40 ? 11.312 6.499 15.276 1.00 19.91 ? 40 ASP A N 1 +ATOM 277 C CA . ASP A 1 40 ? 11.516 6.952 16.607 1.00 22.98 ? 40 ASP A CA 1 +ATOM 278 C C . ASP A 1 40 ? 12.640 7.919 16.792 1.00 23.88 ? 40 ASP A C 1 +ATOM 279 O O . ASP A 1 40 ? 12.660 8.601 17.833 1.00 25.31 ? 40 ASP A O 1 +ATOM 280 C CB . ASP A 1 40 ? 11.732 5.771 17.570 1.00 30.47 ? 40 ASP A CB 1 +ATOM 281 C CG . ASP A 1 40 ? 10.493 4.876 17.618 1.00 36.12 ? 40 ASP A CG 1 +ATOM 282 O OD1 . ASP A 1 40 ? 9.317 5.470 17.809 1.00 29.40 ? 40 ASP A OD1 1 +ATOM 283 O OD2 . ASP A 1 40 ? 10.602 3.711 17.372 1.00 36.52 ? 40 ASP A OD2 1 +ATOM 284 N N . TRP A 1 41 ? 13.666 7.796 15.947 1.00 21.03 ? 41 TRP A N 1 +ATOM 285 C CA . TRP A 1 41 ? 14.919 8.509 16.131 1.00 17.56 ? 41 TRP A CA 1 +ATOM 286 C C . TRP A 1 41 ? 15.221 9.260 14.878 1.00 25.16 ? 41 TRP A C 1 +ATOM 287 O O . TRP A 1 41 ? 15.397 8.631 13.867 1.00 25.42 ? 41 TRP A O 1 +ATOM 288 C CB . TRP A 1 41 ? 16.159 7.657 16.436 1.00 15.16 ? 41 TRP A CB 1 +ATOM 289 C CG . TRP A 1 41 ? 16.036 7.062 17.810 1.00 21.31 ? 41 TRP A CG 1 +ATOM 290 C CD1 . TRP A 1 41 ? 15.263 6.025 18.153 1.00 24.29 ? 41 TRP A CD1 1 +ATOM 291 C CD2 . TRP A 1 41 ? 16.468 7.657 19.043 1.00 22.41 ? 41 TRP A CD2 1 +ATOM 292 N NE1 . TRP A 1 41 ? 15.378 5.802 19.512 1.00 23.72 ? 41 TRP A NE1 1 +ATOM 293 C CE2 . TRP A 1 41 ? 16.139 6.766 20.079 1.00 26.45 ? 41 TRP A CE2 1 +ATOM 294 C CE3 . TRP A 1 41 ? 17.097 8.867 19.377 1.00 24.15 ? 41 TRP A CE3 1 +ATOM 295 C CZ2 . TRP A 1 41 ? 16.434 7.050 21.428 1.00 31.55 ? 41 TRP A CZ2 1 +ATOM 296 C CZ3 . TRP A 1 41 ? 17.453 9.102 20.705 1.00 32.15 ? 41 TRP A CZ3 1 +ATOM 297 C CH2 . TRP A 1 41 ? 17.132 8.209 21.742 1.00 29.98 ? 41 TRP A CH2 1 +ATOM 298 N N . TRP A 1 42 ? 15.428 10.572 14.967 1.00 21.81 ? 42 TRP A N 1 +ATOM 299 C CA . TRP A 1 42 ? 15.782 11.379 13.799 1.00 18.18 ? 42 TRP A CA 1 +ATOM 300 C C . TRP A 1 42 ? 17.204 11.875 13.838 1.00 17.51 ? 42 TRP A C 1 +ATOM 301 O O . TRP A 1 42 ? 17.682 12.285 14.907 1.00 20.24 ? 42 TRP A O 1 +ATOM 302 C CB . TRP A 1 42 ? 14.735 12.529 13.607 1.00 19.65 ? 42 TRP A CB 1 +ATOM 303 C CG . TRP A 1 42 ? 13.386 12.108 13.114 1.00 21.19 ? 42 TRP A CG 1 +ATOM 304 C CD1 . TRP A 1 42 ? 12.961 10.844 12.716 1.00 18.08 ? 42 TRP A CD1 1 +ATOM 305 C CD2 . TRP A 1 42 ? 12.322 13.010 12.857 1.00 21.79 ? 42 TRP A CD2 1 +ATOM 306 N NE1 . TRP A 1 42 ? 11.655 10.909 12.319 1.00 19.36 ? 42 TRP A NE1 1 +ATOM 307 C CE2 . TRP A 1 42 ? 11.254 12.234 12.342 1.00 22.66 ? 42 TRP A CE2 1 +ATOM 308 C CE3 . TRP A 1 42 ? 12.185 14.389 13.052 1.00 23.32 ? 42 TRP A CE3 1 +ATOM 309 C CZ2 . TRP A 1 42 ? 10.069 12.846 11.975 1.00 24.71 ? 42 TRP A CZ2 1 +ATOM 310 C CZ3 . TRP A 1 42 ? 10.998 14.996 12.715 1.00 24.36 ? 42 TRP A CZ3 1 +ATOM 311 C CH2 . TRP A 1 42 ? 9.952 14.203 12.215 1.00 28.11 ? 42 TRP A CH2 1 +ATOM 312 N N . LYS A 1 43 ? 17.903 11.835 12.687 1.00 16.77 ? 43 LYS A N 1 +ATOM 313 C CA . LYS A 1 43 ? 19.243 12.379 12.667 1.00 17.83 ? 43 LYS A CA 1 +ATOM 314 C C . LYS A 1 43 ? 19.183 13.856 12.270 1.00 23.21 ? 43 LYS A C 1 +ATOM 315 O O . LYS A 1 43 ? 18.499 14.201 11.300 1.00 20.36 ? 43 LYS A O 1 +ATOM 316 C CB . LYS A 1 43 ? 20.109 11.743 11.626 1.00 20.64 ? 43 LYS A CB 1 +ATOM 317 C CG . LYS A 1 43 ? 21.573 11.885 11.957 1.00 23.72 ? 43 LYS A CG 1 +ATOM 318 C CD . LYS A 1 43 ? 22.453 11.402 10.802 1.00 31.82 ? 43 LYS A CD 1 +ATOM 319 C CE . LYS A 1 43 ? 23.896 11.146 11.214 1.00 39.48 ? 43 LYS A CE 1 +ATOM 320 N NZ . LYS A 1 43 ? 24.864 11.162 10.110 1.00 47.06 ? 43 LYS A NZ 1 +ATOM 321 N N . VAL A 1 44 ? 19.833 14.671 13.079 1.00 20.55 ? 44 VAL A N 1 +ATOM 322 C CA . VAL A 1 44 ? 19.850 16.128 12.946 1.00 24.71 ? 44 VAL A CA 1 +ATOM 323 C C . VAL A 1 44 ? 21.268 16.669 13.110 1.00 27.17 ? 44 VAL A C 1 +ATOM 324 O O . VAL A 1 44 ? 22.276 16.024 13.443 1.00 24.18 ? 44 VAL A O 1 +ATOM 325 C CB . VAL A 1 44 ? 19.019 16.768 14.067 1.00 20.23 ? 44 VAL A CB 1 +ATOM 326 C CG1 . VAL A 1 44 ? 17.508 16.399 13.963 1.00 17.59 ? 44 VAL A CG1 1 +ATOM 327 C CG2 . VAL A 1 44 ? 19.692 16.405 15.435 1.00 23.34 ? 44 VAL A CG2 1 +ATOM 328 N N . GLU A 1 45 ? 21.353 17.936 12.812 1.00 26.15 ? 45 GLU A N 1 +ATOM 329 C CA . GLU A 1 45 ? 22.589 18.734 12.934 1.00 27.87 ? 45 GLU A CA 1 +ATOM 330 C C . GLU A 1 45 ? 22.230 19.883 13.877 1.00 20.48 ? 45 GLU A C 1 +ATOM 331 O O . GLU A 1 45 ? 21.181 20.529 13.719 1.00 22.67 ? 45 GLU A O 1 +ATOM 332 C CB . GLU A 1 45 ? 23.047 19.289 11.571 1.00 25.60 ? 45 GLU A CB 1 +ATOM 333 C CG . GLU A 1 45 ? 24.354 20.067 11.663 1.00 36.22 ? 45 GLU A CG 1 +ATOM 334 C CD . GLU A 1 45 ? 24.858 20.427 10.284 1.00 46.63 ? 45 GLU A CD 1 +ATOM 335 O OE1 . GLU A 1 45 ? 24.182 21.032 9.438 1.00 45.83 ? 45 GLU A OE1 1 +ATOM 336 O OE2 . GLU A 1 45 ? 26.084 20.000 10.104 1.00 47.84 ? 45 GLU A OE2 1 +ATOM 337 N N . VAL A 1 46 ? 23.039 19.980 14.906 1.00 24.61 ? 46 VAL A N 1 +ATOM 338 C CA . VAL A 1 46 ? 22.782 20.856 16.053 1.00 31.67 ? 46 VAL A CA 1 +ATOM 339 C C . VAL A 1 46 ? 24.009 21.661 16.117 1.00 32.03 ? 46 VAL A C 1 +ATOM 340 O O . VAL A 1 46 ? 25.112 21.119 16.328 1.00 31.19 ? 46 VAL A O 1 +ATOM 341 C CB . VAL A 1 46 ? 22.613 20.126 17.395 1.00 34.63 ? 46 VAL A CB 1 +ATOM 342 C CG1 . VAL A 1 46 ? 22.292 21.191 18.454 1.00 38.86 ? 46 VAL A CG1 1 +ATOM 343 C CG2 . VAL A 1 46 ? 21.460 19.108 17.341 1.00 33.35 ? 46 VAL A CG2 1 +ATOM 344 N N . ASN A 1 47 ? 23.771 22.900 15.699 1.00 48.79 ? 47 ASN A N 1 +ATOM 345 C CA . ASN A 1 47 ? 24.781 23.775 15.193 1.00 56.59 ? 47 ASN A CA 1 +ATOM 346 C C . ASN A 1 47 ? 25.715 23.019 14.239 1.00 50.54 ? 47 ASN A C 1 +ATOM 347 O O . ASN A 1 47 ? 25.473 22.844 13.040 1.00 52.42 ? 47 ASN A O 1 +ATOM 348 C CB . ASN A 1 47 ? 25.615 24.569 16.205 1.00 64.81 ? 47 ASN A CB 1 +ATOM 349 C CG . ASN A 1 47 ? 26.231 25.717 15.413 1.00 74.08 ? 47 ASN A CG 1 +ATOM 350 O OD1 . ASN A 1 47 ? 27.411 25.685 14.973 1.00 74.78 ? 47 ASN A OD1 1 +ATOM 351 N ND2 . ASN A 1 47 ? 25.333 26.632 15.023 1.00 76.53 ? 47 ASN A ND2 1 +ATOM 352 N N . ASP A 1 48 ? 26.737 22.490 14.884 1.00 47.89 ? 48 ASP A N 1 +ATOM 353 C CA . ASP A 1 48 ? 27.910 21.858 14.351 1.00 46.94 ? 48 ASP A CA 1 +ATOM 354 C C . ASP A 1 48 ? 27.959 20.354 14.547 1.00 52.47 ? 48 ASP A C 1 +ATOM 355 O O . ASP A 1 48 ? 28.943 19.730 14.187 1.00 47.28 ? 48 ASP A O 1 +ATOM 356 C CB . ASP A 1 48 ? 28.946 22.355 15.349 1.00 59.88 ? 48 ASP A CB 1 +ATOM 357 C CG . ASP A 1 48 ? 28.330 22.263 16.731 1.00 65.82 ? 48 ASP A CG 1 +ATOM 358 O OD1 . ASP A 1 48 ? 27.117 22.373 16.979 1.00 53.99 ? 48 ASP A OD1 1 +ATOM 359 O OD2 . ASP A 1 48 ? 29.250 21.970 17.627 1.00 79.29 ? 48 ASP A OD2 1 +ATOM 360 N N . ARG A 1 49 ? 27.062 19.785 15.348 1.00 50.21 ? 49 ARG A N 1 +ATOM 361 C CA . ARG A 1 49 ? 27.171 18.356 15.617 1.00 44.41 ? 49 ARG A CA 1 +ATOM 362 C C . ARG A 1 49 ? 26.041 17.603 14.904 1.00 31.87 ? 49 ARG A C 1 +ATOM 363 O O . ARG A 1 49 ? 24.953 18.201 14.792 1.00 33.55 ? 49 ARG A O 1 +ATOM 364 C CB . ARG A 1 49 ? 27.079 18.155 17.137 1.00 53.48 ? 49 ARG A CB 1 +ATOM 365 C CG . ARG A 1 49 ? 28.433 18.248 17.849 1.00 63.42 ? 49 ARG A CG 1 +ATOM 366 C CD . ARG A 1 49 ? 28.389 17.869 19.335 1.00 70.27 ? 49 ARG A CD 1 +ATOM 367 N NE . ARG A 1 49 ? 28.579 16.420 19.603 1.00 70.57 ? 49 ARG A NE 1 +ATOM 368 C CZ . ARG A 1 49 ? 27.883 15.652 20.465 1.00 54.85 ? 49 ARG A CZ 1 +ATOM 369 N NH1 . ARG A 1 49 ? 26.871 16.131 21.219 1.00 45.00 ? 49 ARG A NH1 1 +ATOM 370 N NH2 . ARG A 1 49 ? 28.198 14.358 20.523 1.00 50.56 ? 49 ARG A NH2 1 +ATOM 371 N N . GLN A 1 50 ? 26.264 16.323 14.471 1.00 27.26 ? 50 GLN A N 1 +ATOM 372 C CA . GLN A 1 50 ? 25.194 15.509 13.832 1.00 28.99 ? 50 GLN A CA 1 +ATOM 373 C C . GLN A 1 50 ? 24.830 14.275 14.656 1.00 29.78 ? 50 GLN A C 1 +ATOM 374 O O . GLN A 1 50 ? 25.693 13.640 15.162 1.00 32.14 ? 50 GLN A O 1 +ATOM 375 C CB . GLN A 1 50 ? 25.615 14.940 12.480 1.00 33.37 ? 50 GLN A CB 1 +ATOM 376 C CG . GLN A 1 50 ? 26.211 15.948 11.489 1.00 45.14 ? 50 GLN A CG 1 +ATOM 377 C CD . GLN A 1 50 ? 26.246 15.354 10.097 1.00 52.46 ? 50 GLN A CD 1 +ATOM 378 O OE1 . GLN A 1 50 ? 26.153 14.117 9.915 1.00 55.85 ? 50 GLN A OE1 1 +ATOM 379 N NE2 . GLN A 1 50 ? 26.234 16.246 9.120 1.00 54.92 ? 50 GLN A NE2 1 +ATOM 380 N N . GLY A 1 51 ? 23.611 13.820 14.693 1.00 24.18 ? 51 GLY A N 1 +ATOM 381 C CA . GLY A 1 51 ? 23.385 12.634 15.491 1.00 25.02 ? 51 GLY A CA 1 +ATOM 382 C C . GLY A 1 51 ? 21.903 12.427 15.723 1.00 24.07 ? 51 GLY A C 1 +ATOM 383 O O . GLY A 1 51 ? 21.098 13.186 15.180 1.00 23.07 ? 51 GLY A O 1 +ATOM 384 N N . PHE A 1 52 ? 21.507 11.413 16.525 1.00 20.03 ? 52 PHE A N 1 +ATOM 385 C CA . PHE A 1 52 ? 20.100 11.193 16.741 1.00 16.79 ? 52 PHE A CA 1 +ATOM 386 C C . PHE A 1 52 ? 19.491 11.842 18.005 1.00 18.56 ? 52 PHE A C 1 +ATOM 387 O O . PHE A 1 52 ? 20.174 12.069 18.993 1.00 22.51 ? 52 PHE A O 1 +ATOM 388 C CB . PHE A 1 52 ? 19.764 9.710 16.733 1.00 23.47 ? 52 PHE A CB 1 +ATOM 389 C CG . PHE A 1 52 ? 20.178 9.096 15.428 1.00 28.60 ? 52 PHE A CG 1 +ATOM 390 C CD1 . PHE A 1 52 ? 21.507 8.667 15.252 1.00 30.30 ? 52 PHE A CD1 1 +ATOM 391 C CD2 . PHE A 1 52 ? 19.216 8.946 14.417 1.00 22.20 ? 52 PHE A CD2 1 +ATOM 392 C CE1 . PHE A 1 52 ? 21.924 8.099 14.045 1.00 24.01 ? 52 PHE A CE1 1 +ATOM 393 C CE2 . PHE A 1 52 ? 19.601 8.304 13.233 1.00 23.44 ? 52 PHE A CE2 1 +ATOM 394 C CZ . PHE A 1 52 ? 20.943 7.941 13.056 1.00 25.26 ? 52 PHE A CZ 1 +ATOM 395 N N . VAL A 1 53 ? 18.248 12.263 17.856 1.00 19.05 ? 53 VAL A N 1 +ATOM 396 C CA . VAL A 1 53 ? 17.405 12.684 18.923 1.00 18.00 ? 53 VAL A CA 1 +ATOM 397 C C . VAL A 1 53 ? 16.087 11.988 18.740 1.00 17.64 ? 53 VAL A C 1 +ATOM 398 O O . VAL A 1 53 ? 15.775 11.552 17.627 1.00 21.28 ? 53 VAL A O 1 +ATOM 399 C CB . VAL A 1 53 ? 17.274 14.200 19.004 1.00 20.16 ? 53 VAL A CB 1 +ATOM 400 C CG1 . VAL A 1 53 ? 18.666 14.824 19.087 1.00 17.99 ? 53 VAL A CG1 1 +ATOM 401 C CG2 . VAL A 1 53 ? 16.514 14.735 17.789 1.00 22.24 ? 53 VAL A CG2 1 +ATOM 402 N N . PRO A 1 54 ? 15.257 11.875 19.793 1.00 19.53 ? 54 PRO A N 1 +ATOM 403 C CA . PRO A 1 54 ? 13.910 11.311 19.621 1.00 18.70 ? 54 PRO A CA 1 +ATOM 404 C C . PRO A 1 54 ? 13.015 12.192 18.676 1.00 27.03 ? 54 PRO A C 1 +ATOM 405 O O . PRO A 1 54 ? 12.837 13.416 18.844 1.00 21.49 ? 54 PRO A O 1 +ATOM 406 C CB . PRO A 1 54 ? 13.302 11.227 21.023 1.00 25.24 ? 54 PRO A CB 1 +ATOM 407 C CG . PRO A 1 54 ? 14.437 11.469 22.019 1.00 25.46 ? 54 PRO A CG 1 +ATOM 408 C CD . PRO A 1 54 ? 15.516 12.244 21.233 1.00 26.14 ? 54 PRO A CD 1 +ATOM 409 N N . ALA A 1 55 ? 12.415 11.521 17.680 1.00 19.74 ? 55 ALA A N 1 +ATOM 410 C CA . ALA A 1 55 ? 11.545 12.130 16.742 1.00 15.92 ? 55 ALA A CA 1 +ATOM 411 C C . ALA A 1 55 ? 10.503 12.876 17.483 1.00 22.95 ? 55 ALA A C 1 +ATOM 412 O O . ALA A 1 55 ? 9.978 13.833 16.912 1.00 25.64 ? 55 ALA A O 1 +ATOM 413 C CB . ALA A 1 55 ? 10.840 11.174 15.772 1.00 17.54 ? 55 ALA A CB 1 +ATOM 414 N N . ALA A 1 56 ? 10.063 12.361 18.632 1.00 20.92 ? 56 ALA A N 1 +ATOM 415 C CA . ALA A 1 56 ? 8.945 13.037 19.290 1.00 26.86 ? 56 ALA A CA 1 +ATOM 416 C C . ALA A 1 56 ? 9.370 14.369 19.926 1.00 23.49 ? 56 ALA A C 1 +ATOM 417 O O . ALA A 1 56 ? 8.562 15.212 20.287 1.00 27.45 ? 56 ALA A O 1 +ATOM 418 C CB . ALA A 1 56 ? 8.184 12.180 20.326 1.00 27.06 ? 56 ALA A CB 1 +ATOM 419 N N . TYR A 1 57 ? 10.628 14.579 20.123 1.00 21.59 ? 57 TYR A N 1 +ATOM 420 C CA . TYR A 1 57 ? 10.841 15.802 20.847 1.00 22.58 ? 57 TYR A CA 1 +ATOM 421 C C . TYR A 1 57 ? 11.035 16.963 19.890 1.00 26.95 ? 57 TYR A C 1 +ATOM 422 O O . TYR A 1 57 ? 11.554 17.981 20.323 1.00 25.37 ? 57 TYR A O 1 +ATOM 423 C CB . TYR A 1 57 ? 12.144 15.597 21.610 1.00 21.44 ? 57 TYR A CB 1 +ATOM 424 C CG . TYR A 1 57 ? 12.023 14.644 22.776 1.00 19.99 ? 57 TYR A CG 1 +ATOM 425 C CD1 . TYR A 1 57 ? 10.870 13.870 22.906 1.00 22.17 ? 57 TYR A CD1 1 +ATOM 426 C CD2 . TYR A 1 57 ? 13.031 14.581 23.740 1.00 26.13 ? 57 TYR A CD2 1 +ATOM 427 C CE1 . TYR A 1 57 ? 10.778 12.961 23.961 1.00 25.03 ? 57 TYR A CE1 1 +ATOM 428 C CE2 . TYR A 1 57 ? 12.941 13.665 24.792 1.00 30.80 ? 57 TYR A CE2 1 +ATOM 429 C CZ . TYR A 1 57 ? 11.824 12.836 24.871 1.00 25.23 ? 57 TYR A CZ 1 +ATOM 430 O OH . TYR A 1 57 ? 11.669 11.970 25.923 1.00 31.82 ? 57 TYR A OH 1 +ATOM 431 N N . VAL A 1 58 ? 10.811 16.713 18.580 1.00 23.94 ? 58 VAL A N 1 +ATOM 432 C CA . VAL A 1 58 ? 11.047 17.731 17.574 1.00 25.72 ? 58 VAL A CA 1 +ATOM 433 C C . VAL A 1 58 ? 9.831 17.962 16.786 1.00 31.40 ? 58 VAL A C 1 +ATOM 434 O O . VAL A 1 58 ? 8.999 17.093 16.702 1.00 26.03 ? 58 VAL A O 1 +ATOM 435 C CB . VAL A 1 58 ? 12.254 17.567 16.657 1.00 20.72 ? 58 VAL A CB 1 +ATOM 436 C CG1 . VAL A 1 58 ? 13.442 17.383 17.575 1.00 26.39 ? 58 VAL A CG1 1 +ATOM 437 C CG2 . VAL A 1 58 ? 12.157 16.366 15.730 1.00 24.52 ? 58 VAL A CG2 1 +ATOM 438 N N . LYS A 1 59 ? 9.749 19.177 16.255 1.00 28.84 ? 59 LYS A N 1 +ATOM 439 C CA . LYS A 1 59 ? 8.657 19.554 15.393 1.00 28.37 ? 59 LYS A CA 1 +ATOM 440 C C . LYS A 1 59 ? 9.170 20.091 14.060 1.00 32.13 ? 59 LYS A C 1 +ATOM 441 O O . LYS A 1 59 ? 9.981 21.021 14.008 1.00 27.49 ? 59 LYS A O 1 +ATOM 442 C CB . LYS A 1 59 ? 7.687 20.531 16.036 1.00 24.44 ? 59 LYS A CB 1 +ATOM 443 C CG . LYS A 1 59 ? 6.635 20.991 15.034 1.00 37.24 ? 59 LYS A CG 1 +ATOM 444 C CD . LYS A 1 59 ? 6.239 22.469 15.218 1.00 59.62 ? 59 LYS A CD 1 +ATOM 445 C CE . LYS A 1 59 ? 5.244 23.064 14.206 1.00 68.83 ? 59 LYS A CE 1 +ATOM 446 N NZ . LYS A 1 59 ? 4.908 22.130 13.121 1.00 77.40 ? 59 LYS A NZ 1 +ATOM 447 N N . LYS A 1 60 ? 8.734 19.441 12.971 1.00 35.86 ? 60 LYS A N 1 +ATOM 448 C CA . LYS A 1 60 ? 9.058 19.851 11.602 1.00 37.76 ? 60 LYS A CA 1 +ATOM 449 C C . LYS A 1 60 ? 8.540 21.267 11.266 1.00 34.19 ? 60 LYS A C 1 +ATOM 450 O O . LYS A 1 60 ? 7.441 21.607 11.662 1.00 33.96 ? 60 LYS A O 1 +ATOM 451 C CB . LYS A 1 60 ? 8.389 18.877 10.661 1.00 42.85 ? 60 LYS A CB 1 +ATOM 452 C CG . LYS A 1 60 ? 9.097 18.724 9.343 1.00 53.20 ? 60 LYS A CG 1 +ATOM 453 C CD . LYS A 1 60 ? 9.468 17.276 9.085 1.00 58.79 ? 60 LYS A CD 1 +ATOM 454 C CE . LYS A 1 60 ? 8.478 16.526 8.216 1.00 63.77 ? 60 LYS A CE 1 +ATOM 455 N NZ . LYS A 1 60 ? 8.859 15.113 8.027 1.00 71.14 ? 60 LYS A NZ 1 +ATOM 456 N N . LEU A 1 61 ? 9.365 22.161 10.707 1.00 38.53 ? 61 LEU A N 1 +ATOM 457 C CA . LEU A 1 61 ? 8.886 23.469 10.226 1.00 43.78 ? 61 LEU A CA 1 +ATOM 458 C C . LEU A 1 61 ? 8.984 23.478 8.675 1.00 50.96 ? 61 LEU A C 1 +ATOM 459 O O . LEU A 1 61 ? 10.096 23.392 8.126 1.00 56.76 ? 61 LEU A O 1 +ATOM 460 C CB . LEU A 1 61 ? 9.810 24.558 10.767 1.00 40.90 ? 61 LEU A CB 1 +ATOM 461 C CG . LEU A 1 61 ? 10.226 24.406 12.207 1.00 36.85 ? 61 LEU A CG 1 +ATOM 462 C CD1 . LEU A 1 61 ? 11.359 25.391 12.501 1.00 31.08 ? 61 LEU A CD1 1 +ATOM 463 C CD2 . LEU A 1 61 ? 9.048 24.648 13.135 1.00 33.62 ? 61 LEU A CD2 1 +ATOM 464 N N . ASP A 1 62 ? 7.875 23.383 7.946 1.00 55.41 ? 62 ASP A N 1 +ATOM 465 C CA . ASP A 1 62 ? 7.968 23.167 6.491 1.00 72.97 ? 62 ASP A CA 1 +ATOM 466 C C . ASP A 1 62 ? 7.898 24.426 5.632 1.00 84.36 ? 62 ASP A C 1 +ATOM 467 O O . ASP A 1 62 ? 6.947 25.223 5.804 1.00 86.10 ? 62 ASP A O 1 +ATOM 468 C CB . ASP A 1 62 ? 7.084 22.027 5.907 1.00 84.34 ? 62 ASP A CB 1 +ATOM 469 C CG . ASP A 1 62 ? 5.635 22.429 5.586 1.00 98.42 ? 62 ASP A CG 1 +ATOM 470 O OD1 . ASP A 1 62 ? 5.159 23.367 6.381 1.00 100.00 ? 62 ASP A OD1 1 +ATOM 471 O OD2 . ASP A 1 62 ? 4.953 21.947 4.671 1.00 100.00 ? 62 ASP A OD2 1 +ATOM 472 O OXT . ASP A 1 62 ? 8.789 24.590 4.765 1.00 89.86 ? 62 ASP A OXT 1 +# diff --git a/tests/resources/2g3n.cif b/tests/resources/2g3n.cif new file mode 100644 index 0000000..340dc10 --- /dev/null +++ b/tests/resources/2g3n.cif @@ -0,0 +1,43266 @@ +data_2G3N +# +_entry.id 2G3N +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.377 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 2G3N pdb_00002g3n 10.2210/pdb2g3n/pdb +RCSB RCSB036647 ? ? +WWPDB D_1000036647 ? ? +# +_pdbx_database_related.db_name PDB +_pdbx_database_related.db_id 2g3m +_pdbx_database_related.details . +_pdbx_database_related.content_type unspecified +# +_pdbx_database_status.entry_id 2G3N +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.recvd_initial_deposition_date 2006-02-20 +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.SG_entry N +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.status_code_nmr_data ? +_pdbx_database_status.methods_development_category ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Ernst, H.A.' 1 +'Lo Leggio, L.' 2 +'Willemoes, M.' 3 +'Leonard, G.' 4 +'Blum, P.' 5 +'Larsen, S.' 6 +# +loop_ +_citation.id +_citation.title +_citation.journal_abbrev +_citation.journal_volume +_citation.page_first +_citation.page_last +_citation.year +_citation.journal_id_ASTM +_citation.country +_citation.journal_id_ISSN +_citation.journal_id_CSD +_citation.book_publisher +_citation.pdbx_database_id_PubMed +_citation.pdbx_database_id_DOI +primary +'Structure of the Sulfolobus solfataricus alpha-Glucosidase: Implications for Domain Conservation and Substrate Recognition in GH31.' +J.Mol.Biol. 358 1106 1124 2006 JMOBAK UK 0022-2836 0070 ? 16580018 10.1016/j.jmb.2006.02.056 +1 'Characterization of different crystal forms of the alpha-glucosidase MalA from Sulfolobus solfataricus' +'Acta Crystallogr.,Sect.F' 61 1039 1042 2006 ? DK 1744-3091 ? ? ? ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Ernst, H.A.' 1 ? +primary 'Lo Leggio, L.' 2 ? +primary 'Willemoes, M.' 3 ? +primary 'Leonard, G.' 4 ? +primary 'Blum, P.' 5 ? +primary 'Larsen, S.' 6 ? +1 'Ernst, H.A.' 7 ? +1 'Willemoes, M.' 8 ? +1 'Lo Leggio, L.' 9 ? +1 'Leonard, G.' 10 ? +1 'Blum, P.' 11 ? +1 'Larsen, S.' 12 ? +# +_cell.entry_id 2G3N +_cell.length_a 100.090 +_cell.length_b 174.430 +_cell.length_c 144.030 +_cell.angle_alpha 90.00 +_cell.angle_beta 109.05 +_cell.angle_gamma 90.00 +_cell.Z_PDB 12 +_cell.pdbx_unique_axis ? +_cell.length_a_esd ? +_cell.length_b_esd ? +_cell.length_c_esd ? +_cell.angle_alpha_esd ? +_cell.angle_beta_esd ? +_cell.angle_gamma_esd ? +# +_symmetry.entry_id 2G3N +_symmetry.space_group_name_H-M 'P 1 21 1' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 4 +_symmetry.space_group_name_Hall ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man Alpha-glucosidase 80580.195 6 3.2.1.20 ? ? ? +2 non-polymer man 'octyl beta-D-glucopyranoside' 292.369 6 ? ? ? ? +3 water nat water 18.015 615 ? ? ? ? +# +_entity_name_com.entity_id 1 +_entity_name_com.name Maltase +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer no +_entity_poly.pdbx_seq_one_letter_code +;MRILKIYENKGVYKVVIGEPFPPIEFPLEQKISSNKSLSELGLTIVQQGNKVIVEKSLDLKEHIIGLGEKAFELDRKRKR +YVMYNVDAGAYKKYQDPLYVSIPLFISVKDGVATGYFFNSASKVIFDVGLEEYDKVIVTIPEDSVEFYVIEGPRIEDVLE +KYTELTGKPFLPPMWAFGYMISRYSYYPQDKVVELVDIMQKEGFRVAGVFLDIHYMDSYKLFTWHPYRFPEPKKLIDELH +KRNVKLITIVDHGIRVDQNYSPFLSGMGKFCEIESGELFVGKMWPGTTVYPDFFREDTREWWAGLISEWLSQGVDGIWLD +MNEPTDFSRAIEIRDVLSSLPVQFRDDRLVTTFPDNVVHYLRGKRVKHEKVRNAYPLYEAMATFKGFRTSHRNEIFILSR +AGYAGIQRYAFIWTGDNTPSWDDLKLQLQLVLGLSISGVPFVGCDIGGFQGRNFAEIDNSMDLLVKYYALALFFPFYRSH +KATDGIDTEPVFLPDYYKEKVKEIVELRYKFLPYIYSLALEASEKGHPVIRPLFYEFQDDDDMYRIEDEYMVGKYLLYAP +IVSKEESRLVTLPRGKWYNYWNGEIINGKSVVKSTHELPIYLREGSIIPLEGDELIVYGETSFKRYDNAEITSSSNEIKF +SREIYVSKLTITSEKPVSKIIVDDSKEIQVEKTMQNTYVAKINQKIRGKINLE +; +_entity_poly.pdbx_seq_one_letter_code_can +;MRILKIYENKGVYKVVIGEPFPPIEFPLEQKISSNKSLSELGLTIVQQGNKVIVEKSLDLKEHIIGLGEKAFELDRKRKR +YVMYNVDAGAYKKYQDPLYVSIPLFISVKDGVATGYFFNSASKVIFDVGLEEYDKVIVTIPEDSVEFYVIEGPRIEDVLE +KYTELTGKPFLPPMWAFGYMISRYSYYPQDKVVELVDIMQKEGFRVAGVFLDIHYMDSYKLFTWHPYRFPEPKKLIDELH +KRNVKLITIVDHGIRVDQNYSPFLSGMGKFCEIESGELFVGKMWPGTTVYPDFFREDTREWWAGLISEWLSQGVDGIWLD +MNEPTDFSRAIEIRDVLSSLPVQFRDDRLVTTFPDNVVHYLRGKRVKHEKVRNAYPLYEAMATFKGFRTSHRNEIFILSR +AGYAGIQRYAFIWTGDNTPSWDDLKLQLQLVLGLSISGVPFVGCDIGGFQGRNFAEIDNSMDLLVKYYALALFFPFYRSH +KATDGIDTEPVFLPDYYKEKVKEIVELRYKFLPYIYSLALEASEKGHPVIRPLFYEFQDDDDMYRIEDEYMVGKYLLYAP +IVSKEESRLVTLPRGKWYNYWNGEIINGKSVVKSTHELPIYLREGSIIPLEGDELIVYGETSFKRYDNAEITSSSNEIKF +SREIYVSKLTITSEKPVSKIIVDDSKEIQVEKTMQNTYVAKINQKIRGKINLE +; +_entity_poly.pdbx_strand_id A,B,C,D,E,F +_entity_poly.pdbx_target_identifier ? +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 MET n +1 2 ARG n +1 3 ILE n +1 4 LEU n +1 5 LYS n +1 6 ILE n +1 7 TYR n +1 8 GLU n +1 9 ASN n +1 10 LYS n +1 11 GLY n +1 12 VAL n +1 13 TYR n +1 14 LYS n +1 15 VAL n +1 16 VAL n +1 17 ILE n +1 18 GLY n +1 19 GLU n +1 20 PRO n +1 21 PHE n +1 22 PRO n +1 23 PRO n +1 24 ILE n +1 25 GLU n +1 26 PHE n +1 27 PRO n +1 28 LEU n +1 29 GLU n +1 30 GLN n +1 31 LYS n +1 32 ILE n +1 33 SER n +1 34 SER n +1 35 ASN n +1 36 LYS n +1 37 SER n +1 38 LEU n +1 39 SER n +1 40 GLU n +1 41 LEU n +1 42 GLY n +1 43 LEU n +1 44 THR n +1 45 ILE n +1 46 VAL n +1 47 GLN n +1 48 GLN n +1 49 GLY n +1 50 ASN n +1 51 LYS n +1 52 VAL n +1 53 ILE n +1 54 VAL n +1 55 GLU n +1 56 LYS n +1 57 SER n +1 58 LEU n +1 59 ASP n +1 60 LEU n +1 61 LYS n +1 62 GLU n +1 63 HIS n +1 64 ILE n +1 65 ILE n +1 66 GLY n +1 67 LEU n +1 68 GLY n +1 69 GLU n +1 70 LYS n +1 71 ALA n +1 72 PHE n +1 73 GLU n +1 74 LEU n +1 75 ASP n +1 76 ARG n +1 77 LYS n +1 78 ARG n +1 79 LYS n +1 80 ARG n +1 81 TYR n +1 82 VAL n +1 83 MET n +1 84 TYR n +1 85 ASN n +1 86 VAL n +1 87 ASP n +1 88 ALA n +1 89 GLY n +1 90 ALA n +1 91 TYR n +1 92 LYS n +1 93 LYS n +1 94 TYR n +1 95 GLN n +1 96 ASP n +1 97 PRO n +1 98 LEU n +1 99 TYR n +1 100 VAL n +1 101 SER n +1 102 ILE n +1 103 PRO n +1 104 LEU n +1 105 PHE n +1 106 ILE n +1 107 SER n +1 108 VAL n +1 109 LYS n +1 110 ASP n +1 111 GLY n +1 112 VAL n +1 113 ALA n +1 114 THR n +1 115 GLY n +1 116 TYR n +1 117 PHE n +1 118 PHE n +1 119 ASN n +1 120 SER n +1 121 ALA n +1 122 SER n +1 123 LYS n +1 124 VAL n +1 125 ILE n +1 126 PHE n +1 127 ASP n +1 128 VAL n +1 129 GLY n +1 130 LEU n +1 131 GLU n +1 132 GLU n +1 133 TYR n +1 134 ASP n +1 135 LYS n +1 136 VAL n +1 137 ILE n +1 138 VAL n +1 139 THR n +1 140 ILE n +1 141 PRO n +1 142 GLU n +1 143 ASP n +1 144 SER n +1 145 VAL n +1 146 GLU n +1 147 PHE n +1 148 TYR n +1 149 VAL n +1 150 ILE n +1 151 GLU n +1 152 GLY n +1 153 PRO n +1 154 ARG n +1 155 ILE n +1 156 GLU n +1 157 ASP n +1 158 VAL n +1 159 LEU n +1 160 GLU n +1 161 LYS n +1 162 TYR n +1 163 THR n +1 164 GLU n +1 165 LEU n +1 166 THR n +1 167 GLY n +1 168 LYS n +1 169 PRO n +1 170 PHE n +1 171 LEU n +1 172 PRO n +1 173 PRO n +1 174 MET n +1 175 TRP n +1 176 ALA n +1 177 PHE n +1 178 GLY n +1 179 TYR n +1 180 MET n +1 181 ILE n +1 182 SER n +1 183 ARG n +1 184 TYR n +1 185 SER n +1 186 TYR n +1 187 TYR n +1 188 PRO n +1 189 GLN n +1 190 ASP n +1 191 LYS n +1 192 VAL n +1 193 VAL n +1 194 GLU n +1 195 LEU n +1 196 VAL n +1 197 ASP n +1 198 ILE n +1 199 MET n +1 200 GLN n +1 201 LYS n +1 202 GLU n +1 203 GLY n +1 204 PHE n +1 205 ARG n +1 206 VAL n +1 207 ALA n +1 208 GLY n +1 209 VAL n +1 210 PHE n +1 211 LEU n +1 212 ASP n +1 213 ILE n +1 214 HIS n +1 215 TYR n +1 216 MET n +1 217 ASP n +1 218 SER n +1 219 TYR n +1 220 LYS n +1 221 LEU n +1 222 PHE n +1 223 THR n +1 224 TRP n +1 225 HIS n +1 226 PRO n +1 227 TYR n +1 228 ARG n +1 229 PHE n +1 230 PRO n +1 231 GLU n +1 232 PRO n +1 233 LYS n +1 234 LYS n +1 235 LEU n +1 236 ILE n +1 237 ASP n +1 238 GLU n +1 239 LEU n +1 240 HIS n +1 241 LYS n +1 242 ARG n +1 243 ASN n +1 244 VAL n +1 245 LYS n +1 246 LEU n +1 247 ILE n +1 248 THR n +1 249 ILE n +1 250 VAL n +1 251 ASP n +1 252 HIS n +1 253 GLY n +1 254 ILE n +1 255 ARG n +1 256 VAL n +1 257 ASP n +1 258 GLN n +1 259 ASN n +1 260 TYR n +1 261 SER n +1 262 PRO n +1 263 PHE n +1 264 LEU n +1 265 SER n +1 266 GLY n +1 267 MET n +1 268 GLY n +1 269 LYS n +1 270 PHE n +1 271 CYS n +1 272 GLU n +1 273 ILE n +1 274 GLU n +1 275 SER n +1 276 GLY n +1 277 GLU n +1 278 LEU n +1 279 PHE n +1 280 VAL n +1 281 GLY n +1 282 LYS n +1 283 MET n +1 284 TRP n +1 285 PRO n +1 286 GLY n +1 287 THR n +1 288 THR n +1 289 VAL n +1 290 TYR n +1 291 PRO n +1 292 ASP n +1 293 PHE n +1 294 PHE n +1 295 ARG n +1 296 GLU n +1 297 ASP n +1 298 THR n +1 299 ARG n +1 300 GLU n +1 301 TRP n +1 302 TRP n +1 303 ALA n +1 304 GLY n +1 305 LEU n +1 306 ILE n +1 307 SER n +1 308 GLU n +1 309 TRP n +1 310 LEU n +1 311 SER n +1 312 GLN n +1 313 GLY n +1 314 VAL n +1 315 ASP n +1 316 GLY n +1 317 ILE n +1 318 TRP n +1 319 LEU n +1 320 ASP n +1 321 MET n +1 322 ASN n +1 323 GLU n +1 324 PRO n +1 325 THR n +1 326 ASP n +1 327 PHE n +1 328 SER n +1 329 ARG n +1 330 ALA n +1 331 ILE n +1 332 GLU n +1 333 ILE n +1 334 ARG n +1 335 ASP n +1 336 VAL n +1 337 LEU n +1 338 SER n +1 339 SER n +1 340 LEU n +1 341 PRO n +1 342 VAL n +1 343 GLN n +1 344 PHE n +1 345 ARG n +1 346 ASP n +1 347 ASP n +1 348 ARG n +1 349 LEU n +1 350 VAL n +1 351 THR n +1 352 THR n +1 353 PHE n +1 354 PRO n +1 355 ASP n +1 356 ASN n +1 357 VAL n +1 358 VAL n +1 359 HIS n +1 360 TYR n +1 361 LEU n +1 362 ARG n +1 363 GLY n +1 364 LYS n +1 365 ARG n +1 366 VAL n +1 367 LYS n +1 368 HIS n +1 369 GLU n +1 370 LYS n +1 371 VAL n +1 372 ARG n +1 373 ASN n +1 374 ALA n +1 375 TYR n +1 376 PRO n +1 377 LEU n +1 378 TYR n +1 379 GLU n +1 380 ALA n +1 381 MET n +1 382 ALA n +1 383 THR n +1 384 PHE n +1 385 LYS n +1 386 GLY n +1 387 PHE n +1 388 ARG n +1 389 THR n +1 390 SER n +1 391 HIS n +1 392 ARG n +1 393 ASN n +1 394 GLU n +1 395 ILE n +1 396 PHE n +1 397 ILE n +1 398 LEU n +1 399 SER n +1 400 ARG n +1 401 ALA n +1 402 GLY n +1 403 TYR n +1 404 ALA n +1 405 GLY n +1 406 ILE n +1 407 GLN n +1 408 ARG n +1 409 TYR n +1 410 ALA n +1 411 PHE n +1 412 ILE n +1 413 TRP n +1 414 THR n +1 415 GLY n +1 416 ASP n +1 417 ASN n +1 418 THR n +1 419 PRO n +1 420 SER n +1 421 TRP n +1 422 ASP n +1 423 ASP n +1 424 LEU n +1 425 LYS n +1 426 LEU n +1 427 GLN n +1 428 LEU n +1 429 GLN n +1 430 LEU n +1 431 VAL n +1 432 LEU n +1 433 GLY n +1 434 LEU n +1 435 SER n +1 436 ILE n +1 437 SER n +1 438 GLY n +1 439 VAL n +1 440 PRO n +1 441 PHE n +1 442 VAL n +1 443 GLY n +1 444 CYS n +1 445 ASP n +1 446 ILE n +1 447 GLY n +1 448 GLY n +1 449 PHE n +1 450 GLN n +1 451 GLY n +1 452 ARG n +1 453 ASN n +1 454 PHE n +1 455 ALA n +1 456 GLU n +1 457 ILE n +1 458 ASP n +1 459 ASN n +1 460 SER n +1 461 MET n +1 462 ASP n +1 463 LEU n +1 464 LEU n +1 465 VAL n +1 466 LYS n +1 467 TYR n +1 468 TYR n +1 469 ALA n +1 470 LEU n +1 471 ALA n +1 472 LEU n +1 473 PHE n +1 474 PHE n +1 475 PRO n +1 476 PHE n +1 477 TYR n +1 478 ARG n +1 479 SER n +1 480 HIS n +1 481 LYS n +1 482 ALA n +1 483 THR n +1 484 ASP n +1 485 GLY n +1 486 ILE n +1 487 ASP n +1 488 THR n +1 489 GLU n +1 490 PRO n +1 491 VAL n +1 492 PHE n +1 493 LEU n +1 494 PRO n +1 495 ASP n +1 496 TYR n +1 497 TYR n +1 498 LYS n +1 499 GLU n +1 500 LYS n +1 501 VAL n +1 502 LYS n +1 503 GLU n +1 504 ILE n +1 505 VAL n +1 506 GLU n +1 507 LEU n +1 508 ARG n +1 509 TYR n +1 510 LYS n +1 511 PHE n +1 512 LEU n +1 513 PRO n +1 514 TYR n +1 515 ILE n +1 516 TYR n +1 517 SER n +1 518 LEU n +1 519 ALA n +1 520 LEU n +1 521 GLU n +1 522 ALA n +1 523 SER n +1 524 GLU n +1 525 LYS n +1 526 GLY n +1 527 HIS n +1 528 PRO n +1 529 VAL n +1 530 ILE n +1 531 ARG n +1 532 PRO n +1 533 LEU n +1 534 PHE n +1 535 TYR n +1 536 GLU n +1 537 PHE n +1 538 GLN n +1 539 ASP n +1 540 ASP n +1 541 ASP n +1 542 ASP n +1 543 MET n +1 544 TYR n +1 545 ARG n +1 546 ILE n +1 547 GLU n +1 548 ASP n +1 549 GLU n +1 550 TYR n +1 551 MET n +1 552 VAL n +1 553 GLY n +1 554 LYS n +1 555 TYR n +1 556 LEU n +1 557 LEU n +1 558 TYR n +1 559 ALA n +1 560 PRO n +1 561 ILE n +1 562 VAL n +1 563 SER n +1 564 LYS n +1 565 GLU n +1 566 GLU n +1 567 SER n +1 568 ARG n +1 569 LEU n +1 570 VAL n +1 571 THR n +1 572 LEU n +1 573 PRO n +1 574 ARG n +1 575 GLY n +1 576 LYS n +1 577 TRP n +1 578 TYR n +1 579 ASN n +1 580 TYR n +1 581 TRP n +1 582 ASN n +1 583 GLY n +1 584 GLU n +1 585 ILE n +1 586 ILE n +1 587 ASN n +1 588 GLY n +1 589 LYS n +1 590 SER n +1 591 VAL n +1 592 VAL n +1 593 LYS n +1 594 SER n +1 595 THR n +1 596 HIS n +1 597 GLU n +1 598 LEU n +1 599 PRO n +1 600 ILE n +1 601 TYR n +1 602 LEU n +1 603 ARG n +1 604 GLU n +1 605 GLY n +1 606 SER n +1 607 ILE n +1 608 ILE n +1 609 PRO n +1 610 LEU n +1 611 GLU n +1 612 GLY n +1 613 ASP n +1 614 GLU n +1 615 LEU n +1 616 ILE n +1 617 VAL n +1 618 TYR n +1 619 GLY n +1 620 GLU n +1 621 THR n +1 622 SER n +1 623 PHE n +1 624 LYS n +1 625 ARG n +1 626 TYR n +1 627 ASP n +1 628 ASN n +1 629 ALA n +1 630 GLU n +1 631 ILE n +1 632 THR n +1 633 SER n +1 634 SER n +1 635 SER n +1 636 ASN n +1 637 GLU n +1 638 ILE n +1 639 LYS n +1 640 PHE n +1 641 SER n +1 642 ARG n +1 643 GLU n +1 644 ILE n +1 645 TYR n +1 646 VAL n +1 647 SER n +1 648 LYS n +1 649 LEU n +1 650 THR n +1 651 ILE n +1 652 THR n +1 653 SER n +1 654 GLU n +1 655 LYS n +1 656 PRO n +1 657 VAL n +1 658 SER n +1 659 LYS n +1 660 ILE n +1 661 ILE n +1 662 VAL n +1 663 ASP n +1 664 ASP n +1 665 SER n +1 666 LYS n +1 667 GLU n +1 668 ILE n +1 669 GLN n +1 670 VAL n +1 671 GLU n +1 672 LYS n +1 673 THR n +1 674 MET n +1 675 GLN n +1 676 ASN n +1 677 THR n +1 678 TYR n +1 679 VAL n +1 680 ALA n +1 681 LYS n +1 682 ILE n +1 683 ASN n +1 684 GLN n +1 685 LYS n +1 686 ILE n +1 687 ARG n +1 688 GLY n +1 689 LYS n +1 690 ILE n +1 691 ASN n +1 692 LEU n +1 693 GLU n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus Sulfolobus +_entity_src_gen.pdbx_gene_src_gene malA +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain 98-2 +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Sulfolobus solfataricus' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 2287 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 +_entity_src_gen.host_org_genus Escherichia +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain NF1830 +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type plasmid +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name pMW800 +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code AGLU_SULSO +_struct_ref.pdbx_db_accession O59645 +_struct_ref.entity_id 1 +_struct_ref.pdbx_align_begin 5 +_struct_ref.pdbx_db_isoform ? +_struct_ref.pdbx_seq_one_letter_code ? +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 2G3N A 5 ? 693 ? O59645 5 ? 693 ? 5 693 +2 1 2G3N B 5 ? 693 ? O59645 5 ? 693 ? 5 693 +3 1 2G3N C 5 ? 693 ? O59645 5 ? 693 ? 5 693 +4 1 2G3N D 5 ? 693 ? O59645 5 ? 693 ? 5 693 +5 1 2G3N E 5 ? 693 ? O59645 5 ? 693 ? 5 693 +6 1 2G3N F 5 ? 693 ? O59645 5 ? 693 ? 5 693 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +1 2G3N MET A 1 ? UNP O59645 ? ? 'cloning artifact' 1 1 +1 2G3N ARG A 2 ? UNP O59645 ? ? 'cloning artifact' 2 2 +1 2G3N ILE A 3 ? UNP O59645 ? ? 'cloning artifact' 3 3 +1 2G3N LEU A 4 ? UNP O59645 ? ? 'cloning artifact' 4 4 +2 2G3N MET B 1 ? UNP O59645 ? ? 'cloning artifact' 1 5 +2 2G3N ARG B 2 ? UNP O59645 ? ? 'cloning artifact' 2 6 +2 2G3N ILE B 3 ? UNP O59645 ? ? 'cloning artifact' 3 7 +2 2G3N LEU B 4 ? UNP O59645 ? ? 'cloning artifact' 4 8 +3 2G3N MET C 1 ? UNP O59645 ? ? 'cloning artifact' 1 9 +3 2G3N ARG C 2 ? UNP O59645 ? ? 'cloning artifact' 2 10 +3 2G3N ILE C 3 ? UNP O59645 ? ? 'cloning artifact' 3 11 +3 2G3N LEU C 4 ? UNP O59645 ? ? 'cloning artifact' 4 12 +4 2G3N MET D 1 ? UNP O59645 ? ? 'cloning artifact' 1 13 +4 2G3N ARG D 2 ? UNP O59645 ? ? 'cloning artifact' 2 14 +4 2G3N ILE D 3 ? UNP O59645 ? ? 'cloning artifact' 3 15 +4 2G3N LEU D 4 ? UNP O59645 ? ? 'cloning artifact' 4 16 +5 2G3N MET E 1 ? UNP O59645 ? ? 'cloning artifact' 1 17 +5 2G3N ARG E 2 ? UNP O59645 ? ? 'cloning artifact' 2 18 +5 2G3N ILE E 3 ? UNP O59645 ? ? 'cloning artifact' 3 19 +5 2G3N LEU E 4 ? UNP O59645 ? ? 'cloning artifact' 4 20 +6 2G3N MET F 1 ? UNP O59645 ? ? 'cloning artifact' 1 21 +6 2G3N ARG F 2 ? UNP O59645 ? ? 'cloning artifact' 2 22 +6 2G3N ILE F 3 ? UNP O59645 ? ? 'cloning artifact' 3 23 +6 2G3N LEU F 4 ? UNP O59645 ? ? 'cloning artifact' 4 24 +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +BOG D-saccharide n 'octyl beta-D-glucopyranoside' +'Beta-Octylglucoside; octyl beta-D-glucoside; octyl D-glucoside; octyl glucoside' 'C14 H28 O6' 292.369 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +_exptl.entry_id 2G3N +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number 1 +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.46 +_exptl_crystal.density_percent_sol 49.94 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.preparation ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' +_exptl_crystal_grow.temp 298 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pH 4.2 +_exptl_crystal_grow.pdbx_details +;10 % PEG 4000, 0.2 M sodium citrate, 0.1 M sodium acetate, 0.5 % beta-octyl-glucopyranoside, microseeding, pH 4.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K +; +_exptl_crystal_grow.pdbx_pH_range . +# +_diffrn.id 1 +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'ADSC QUANTUM 4' +_diffrn_detector.pdbx_collection_date 2004-11-27 +_diffrn_detector.details ? +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 0.9340 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'ESRF BEAMLINE ID14-1' +_diffrn_source.pdbx_synchrotron_site ESRF +_diffrn_source.pdbx_synchrotron_beamline ID14-1 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_wavelength_list 0.9340 +# +_reflns.entry_id 2G3N +_reflns.observed_criterion_sigma_I 0 +_reflns.observed_criterion_sigma_F 0 +_reflns.d_resolution_low 24.2 +_reflns.d_resolution_high 2.500 +_reflns.number_obs 154885 +_reflns.number_all ? +_reflns.percent_possible_obs 95.200 +_reflns.pdbx_Rmerge_I_obs 0.065 +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_sigmaI 11.670 +_reflns.B_iso_Wilson_estimate 34.5 +_reflns.pdbx_redundancy 2.6 +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +# +_reflns_shell.d_res_high 2.50 +_reflns_shell.d_res_low 2.63 +_reflns_shell.percent_possible_all ? +_reflns_shell.Rmerge_I_obs 0.29 +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.meanI_over_sigI_obs 5.3 +_reflns_shell.pdbx_redundancy 2.3 +_reflns_shell.percent_possible_obs ? +_reflns_shell.number_unique_all ? +_reflns_shell.number_measured_all ? +_reflns_shell.number_measured_obs ? +_reflns_shell.number_unique_obs ? +_reflns_shell.pdbx_chi_squared ? +_reflns_shell.pdbx_diffrn_id ? +_reflns_shell.pdbx_ordinal 1 +# +_refine.entry_id 2G3N +_refine.ls_number_reflns_obs 145907 +_refine.ls_number_reflns_all 154885 +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F .0 +_refine.pdbx_data_cutoff_high_absF 3189066.23 +_refine.pdbx_data_cutoff_low_absF .000000 +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_d_res_low 24.16 +_refine.ls_d_res_high 2.55 +_refine.ls_percent_reflns_obs 96.3 +_refine.ls_R_factor_obs 0.191 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work 0.191 +_refine.ls_R_factor_R_free 0.213 +_refine.ls_R_factor_R_free_error .002 +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free 5.0 +_refine.ls_number_reflns_R_free 7300 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.B_iso_mean 43.2 +_refine.aniso_B[1][1] 16.62 +_refine.aniso_B[2][2] -5.30 +_refine.aniso_B[3][3] -11.32 +_refine.aniso_B[1][2] .00 +_refine.aniso_B[1][3] 7.90 +_refine.aniso_B[2][3] .00 +_refine.solvent_model_details 'FLAT MODEL' +_refine.solvent_model_param_ksol .382443 +_refine.solvent_model_param_bsol 33.366 +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.details ? +_refine.pdbx_starting_model 'A trimmed version of the trimer in PDB code 2G3M' +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_isotropic_thermal_model RESTRAINED +_refine.pdbx_stereochemistry_target_values 'maximum likelihood' +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.overall_SU_B ? +_refine.ls_redundancy_reflns_obs ? +_refine.B_iso_min ? +_refine.B_iso_max ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_overall_phase_error ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_analyze.entry_id 2G3N +_refine_analyze.Luzzati_coordinate_error_obs .28 +_refine_analyze.Luzzati_sigma_a_obs .34 +_refine_analyze.Luzzati_d_res_low_obs 5.00 +_refine_analyze.Luzzati_coordinate_error_free .32 +_refine_analyze.Luzzati_sigma_a_free .40 +_refine_analyze.Luzzati_d_res_low_free ? +_refine_analyze.number_disordered_residues ? +_refine_analyze.occupancy_sum_hydrogen ? +_refine_analyze.occupancy_sum_non_hydrogen ? +_refine_analyze.pdbx_Luzzati_d_res_high_obs ? +_refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 34098 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 84 +_refine_hist.number_atoms_solvent 615 +_refine_hist.number_atoms_total 34797 +_refine_hist.d_res_high 2.55 +_refine_hist.d_res_low 24.16 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +c_bond_d .007 ? ? ? 'X-RAY DIFFRACTION' ? +c_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg 1.3 ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d 23.8 ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d .78 ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_mcbond_it 1.20 1.50 ? ? 'X-RAY DIFFRACTION' ? +c_mcangle_it 2.00 2.00 ? ? 'X-RAY DIFFRACTION' ? +c_scbond_it 1.96 2.00 ? ? 'X-RAY DIFFRACTION' ? +c_scangle_it 3.07 2.50 ? ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_restr_ncs.dom_id 1 +_refine_ls_restr_ncs.ncs_model_details RESTRAINED +_refine_ls_restr_ncs.rms_dev_position ? +_refine_ls_restr_ncs.weight_position ? +_refine_ls_restr_ncs.rms_dev_B_iso ? +_refine_ls_restr_ncs.weight_B_iso ? +_refine_ls_restr_ncs.pdbx_type . +_refine_ls_restr_ncs.pdbx_auth_asym_id . +_refine_ls_restr_ncs.pdbx_ens_id 1 +_refine_ls_restr_ncs.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_restr_ncs.pdbx_ordinal 1 +_refine_ls_restr_ncs.pdbx_number ? +_refine_ls_restr_ncs.pdbx_asym_id ? +_refine_ls_restr_ncs.pdbx_rms ? +_refine_ls_restr_ncs.pdbx_weight ? +# +_refine_ls_shell.pdbx_total_number_of_bins_used 6 +_refine_ls_shell.d_res_high 2.55 +_refine_ls_shell.d_res_low 2.71 +_refine_ls_shell.number_reflns_R_work 23650 +_refine_ls_shell.R_factor_R_work 0.265 +_refine_ls_shell.percent_reflns_obs 98.6 +_refine_ls_shell.R_factor_R_free 0.301 +_refine_ls_shell.R_factor_R_free_error .009 +_refine_ls_shell.percent_reflns_R_free 4.9 +_refine_ls_shell.number_reflns_R_free 1228 +_refine_ls_shell.number_reflns_all ? +_refine_ls_shell.R_factor_all ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +# +loop_ +_pdbx_xplor_file.serial_no +_pdbx_xplor_file.param_file +_pdbx_xplor_file.topol_file +_pdbx_xplor_file.pdbx_refine_id +1 protein_rep.param protein_nohydrogen.top 'X-RAY DIFFRACTION' +2 water_rep.param water.top 'X-RAY DIFFRACTION' +3 cis_peptide.param BOG_trunc.top 'X-RAY DIFFRACTION' +4 BOG_trunc.param ? 'X-RAY DIFFRACTION' +# +_struct_ncs_dom.id 1 +_struct_ncs_dom.pdbx_ens_id 1 +_struct_ncs_dom.details ? +# +_struct_ncs_ens.id 1 +_struct_ncs_ens.details ? +# +_struct.entry_id 2G3N +_struct.title +'Crystal structure of the Sulfolobus solfataricus alpha-glucosidase MalA in complex with beta-octyl-glucopyranoside' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.text +;hydrolase, alpha-glucosidase, enzyme-carbohydrate complex, glycoside hydrolase family 31, multidomain protein, (beta/alpha)8 barrel, retaining mechanism +; +_struct_keywords.entry_id 2G3N +_struct_keywords.pdbx_keywords HYDROLASE +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 1 ? +C N N 1 ? +D N N 1 ? +E N N 1 ? +F N N 1 ? +G N N 2 ? +H N N 2 ? +I N N 2 ? +J N N 2 ? +K N N 2 ? +L N N 2 ? +M N N 3 ? +N N N 3 ? +O N N 3 ? +P N N 3 ? +Q N N 3 ? +R N N 3 ? +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 ARG A 154 ? GLY A 167 ? ARG A 154 GLY A 167 1 ? 14 +HELX_P HELX_P2 2 PRO A 173 ? PHE A 177 ? PRO A 173 PHE A 177 5 ? 5 +HELX_P HELX_P3 3 PRO A 188 ? GLU A 202 ? PRO A 188 GLU A 202 1 ? 15 +HELX_P HELX_P4 4 ASP A 212 ? MET A 216 ? ASP A 212 MET A 216 5 ? 5 +HELX_P HELX_P5 5 GLU A 231 ? ARG A 242 ? GLU A 231 ARG A 242 1 ? 12 +HELX_P HELX_P6 6 TYR A 260 ? MET A 267 ? TYR A 260 MET A 267 1 ? 8 +HELX_P HELX_P7 7 ARG A 295 ? SER A 311 ? ARG A 295 SER A 311 1 ? 17 +HELX_P HELX_P8 8 PHE A 327 ? LEU A 337 ? PHE A 327 LEU A 337 1 ? 11 +HELX_P HELX_P9 9 ASP A 347 ? THR A 352 ? ASP A 347 THR A 352 5 ? 6 +HELX_P HELX_P10 10 HIS A 368 ? ARG A 372 ? HIS A 368 ARG A 372 1 ? 5 +HELX_P HELX_P11 11 ALA A 374 ? SER A 390 ? ALA A 374 SER A 390 1 ? 17 +HELX_P HELX_P12 12 GLY A 405 ? TYR A 409 ? GLY A 405 TYR A 409 5 ? 5 +HELX_P HELX_P13 13 SER A 420 ? ILE A 436 ? SER A 420 ILE A 436 1 ? 17 +HELX_P HELX_P14 14 SER A 460 ? ALA A 471 ? SER A 460 ALA A 471 1 ? 12 +HELX_P HELX_P15 15 GLU A 489 ? LEU A 493 ? GLU A 489 LEU A 493 5 ? 5 +HELX_P HELX_P16 16 PRO A 494 ? GLY A 526 ? PRO A 494 GLY A 526 1 ? 33 +HELX_P HELX_P17 17 PRO A 532 ? PHE A 537 ? PRO A 532 PHE A 537 1 ? 6 +HELX_P HELX_P18 18 ASP A 540 ? ILE A 546 ? ASP A 540 ILE A 546 5 ? 7 +HELX_P HELX_P19 19 SER B 37 ? GLY B 42 ? SER B 37 GLY B 42 1 ? 6 +HELX_P HELX_P20 20 ARG B 154 ? GLY B 167 ? ARG B 154 GLY B 167 1 ? 14 +HELX_P HELX_P21 21 PRO B 173 ? PHE B 177 ? PRO B 173 PHE B 177 5 ? 5 +HELX_P HELX_P22 22 PRO B 188 ? GLU B 202 ? PRO B 188 GLU B 202 1 ? 15 +HELX_P HELX_P23 23 ASP B 212 ? MET B 216 ? ASP B 212 MET B 216 5 ? 5 +HELX_P HELX_P24 24 GLU B 231 ? ARG B 242 ? GLU B 231 ARG B 242 1 ? 12 +HELX_P HELX_P25 25 TYR B 260 ? MET B 267 ? TYR B 260 MET B 267 1 ? 8 +HELX_P HELX_P26 26 ARG B 295 ? SER B 311 ? ARG B 295 SER B 311 1 ? 17 +HELX_P HELX_P27 27 PHE B 327 ? SER B 338 ? PHE B 327 SER B 338 1 ? 12 +HELX_P HELX_P28 28 ASP B 347 ? THR B 352 ? ASP B 347 THR B 352 5 ? 6 +HELX_P HELX_P29 29 HIS B 368 ? ARG B 372 ? HIS B 368 ARG B 372 1 ? 5 +HELX_P HELX_P30 30 ALA B 374 ? SER B 390 ? ALA B 374 SER B 390 1 ? 17 +HELX_P HELX_P31 31 GLY B 405 ? TYR B 409 ? GLY B 405 TYR B 409 5 ? 5 +HELX_P HELX_P32 32 SER B 420 ? ILE B 436 ? SER B 420 ILE B 436 1 ? 17 +HELX_P HELX_P33 33 SER B 460 ? ALA B 471 ? SER B 460 ALA B 471 1 ? 12 +HELX_P HELX_P34 34 GLU B 489 ? LEU B 493 ? GLU B 489 LEU B 493 5 ? 5 +HELX_P HELX_P35 35 PRO B 494 ? GLY B 526 ? PRO B 494 GLY B 526 1 ? 33 +HELX_P HELX_P36 36 PRO B 532 ? PHE B 537 ? PRO B 532 PHE B 537 1 ? 6 +HELX_P HELX_P37 37 ASP B 540 ? ILE B 546 ? ASP B 540 ILE B 546 5 ? 7 +HELX_P HELX_P38 38 SER C 37 ? GLY C 42 ? SER C 37 GLY C 42 1 ? 6 +HELX_P HELX_P39 39 ARG C 154 ? GLY C 167 ? ARG C 154 GLY C 167 1 ? 14 +HELX_P HELX_P40 40 PRO C 173 ? PHE C 177 ? PRO C 173 PHE C 177 5 ? 5 +HELX_P HELX_P41 41 PRO C 188 ? GLU C 202 ? PRO C 188 GLU C 202 1 ? 15 +HELX_P HELX_P42 42 ASP C 212 ? MET C 216 ? ASP C 212 MET C 216 5 ? 5 +HELX_P HELX_P43 43 GLU C 231 ? ARG C 242 ? GLU C 231 ARG C 242 1 ? 12 +HELX_P HELX_P44 44 TYR C 260 ? MET C 267 ? TYR C 260 MET C 267 1 ? 8 +HELX_P HELX_P45 45 ARG C 295 ? SER C 311 ? ARG C 295 SER C 311 1 ? 17 +HELX_P HELX_P46 46 PHE C 327 ? LEU C 337 ? PHE C 327 LEU C 337 1 ? 11 +HELX_P HELX_P47 47 ASP C 347 ? THR C 352 ? ASP C 347 THR C 352 5 ? 6 +HELX_P HELX_P48 48 HIS C 368 ? ARG C 372 ? HIS C 368 ARG C 372 1 ? 5 +HELX_P HELX_P49 49 ALA C 374 ? SER C 390 ? ALA C 374 SER C 390 1 ? 17 +HELX_P HELX_P50 50 GLY C 405 ? TYR C 409 ? GLY C 405 TYR C 409 5 ? 5 +HELX_P HELX_P51 51 SER C 420 ? ILE C 436 ? SER C 420 ILE C 436 1 ? 17 +HELX_P HELX_P52 52 SER C 460 ? ALA C 471 ? SER C 460 ALA C 471 1 ? 12 +HELX_P HELX_P53 53 GLU C 489 ? LEU C 493 ? GLU C 489 LEU C 493 5 ? 5 +HELX_P HELX_P54 54 PRO C 494 ? GLY C 526 ? PRO C 494 GLY C 526 1 ? 33 +HELX_P HELX_P55 55 PRO C 532 ? PHE C 537 ? PRO C 532 PHE C 537 1 ? 6 +HELX_P HELX_P56 56 ASP C 540 ? ILE C 546 ? ASP C 540 ILE C 546 5 ? 7 +HELX_P HELX_P57 57 SER D 37 ? GLY D 42 ? SER D 37 GLY D 42 1 ? 6 +HELX_P HELX_P58 58 ARG D 154 ? GLY D 167 ? ARG D 154 GLY D 167 1 ? 14 +HELX_P HELX_P59 59 PRO D 173 ? PHE D 177 ? PRO D 173 PHE D 177 5 ? 5 +HELX_P HELX_P60 60 PRO D 188 ? GLU D 202 ? PRO D 188 GLU D 202 1 ? 15 +HELX_P HELX_P61 61 ASP D 212 ? MET D 216 ? ASP D 212 MET D 216 5 ? 5 +HELX_P HELX_P62 62 GLU D 231 ? ARG D 242 ? GLU D 231 ARG D 242 1 ? 12 +HELX_P HELX_P63 63 TYR D 260 ? MET D 267 ? TYR D 260 MET D 267 1 ? 8 +HELX_P HELX_P64 64 ARG D 295 ? SER D 311 ? ARG D 295 SER D 311 1 ? 17 +HELX_P HELX_P65 65 PHE D 327 ? LEU D 337 ? PHE D 327 LEU D 337 1 ? 11 +HELX_P HELX_P66 66 ASP D 347 ? THR D 352 ? ASP D 347 THR D 352 5 ? 6 +HELX_P HELX_P67 67 HIS D 368 ? ARG D 372 ? HIS D 368 ARG D 372 1 ? 5 +HELX_P HELX_P68 68 ALA D 374 ? SER D 390 ? ALA D 374 SER D 390 1 ? 17 +HELX_P HELX_P69 69 GLY D 405 ? TYR D 409 ? GLY D 405 TYR D 409 5 ? 5 +HELX_P HELX_P70 70 SER D 420 ? ILE D 436 ? SER D 420 ILE D 436 1 ? 17 +HELX_P HELX_P71 71 SER D 460 ? ALA D 471 ? SER D 460 ALA D 471 1 ? 12 +HELX_P HELX_P72 72 GLU D 489 ? LEU D 493 ? GLU D 489 LEU D 493 5 ? 5 +HELX_P HELX_P73 73 PRO D 494 ? GLY D 526 ? PRO D 494 GLY D 526 1 ? 33 +HELX_P HELX_P74 74 PRO D 532 ? PHE D 537 ? PRO D 532 PHE D 537 1 ? 6 +HELX_P HELX_P75 75 ASP D 540 ? ILE D 546 ? ASP D 540 ILE D 546 5 ? 7 +HELX_P HELX_P76 76 LEU E 38 ? GLY E 42 ? LEU E 38 GLY E 42 5 ? 5 +HELX_P HELX_P77 77 ARG E 154 ? GLY E 167 ? ARG E 154 GLY E 167 1 ? 14 +HELX_P HELX_P78 78 PRO E 173 ? PHE E 177 ? PRO E 173 PHE E 177 5 ? 5 +HELX_P HELX_P79 79 PRO E 188 ? GLU E 202 ? PRO E 188 GLU E 202 1 ? 15 +HELX_P HELX_P80 80 ASP E 212 ? MET E 216 ? ASP E 212 MET E 216 5 ? 5 +HELX_P HELX_P81 81 GLU E 231 ? ARG E 242 ? GLU E 231 ARG E 242 1 ? 12 +HELX_P HELX_P82 82 TYR E 260 ? MET E 267 ? TYR E 260 MET E 267 1 ? 8 +HELX_P HELX_P83 83 ARG E 295 ? SER E 311 ? ARG E 295 SER E 311 1 ? 17 +HELX_P HELX_P84 84 PHE E 327 ? LEU E 337 ? PHE E 327 LEU E 337 1 ? 11 +HELX_P HELX_P85 85 ASP E 347 ? THR E 352 ? ASP E 347 THR E 352 5 ? 6 +HELX_P HELX_P86 86 HIS E 368 ? ARG E 372 ? HIS E 368 ARG E 372 1 ? 5 +HELX_P HELX_P87 87 ALA E 374 ? SER E 390 ? ALA E 374 SER E 390 1 ? 17 +HELX_P HELX_P88 88 GLY E 405 ? TYR E 409 ? GLY E 405 TYR E 409 5 ? 5 +HELX_P HELX_P89 89 SER E 420 ? ILE E 436 ? SER E 420 ILE E 436 1 ? 17 +HELX_P HELX_P90 90 SER E 460 ? ALA E 471 ? SER E 460 ALA E 471 1 ? 12 +HELX_P HELX_P91 91 GLU E 489 ? LEU E 493 ? GLU E 489 LEU E 493 5 ? 5 +HELX_P HELX_P92 92 PRO E 494 ? GLY E 526 ? PRO E 494 GLY E 526 1 ? 33 +HELX_P HELX_P93 93 PRO E 532 ? PHE E 537 ? PRO E 532 PHE E 537 1 ? 6 +HELX_P HELX_P94 94 ASP E 540 ? ILE E 546 ? ASP E 540 ILE E 546 5 ? 7 +HELX_P HELX_P95 95 SER F 37 ? GLY F 42 ? SER F 37 GLY F 42 1 ? 6 +HELX_P HELX_P96 96 ARG F 154 ? GLY F 167 ? ARG F 154 GLY F 167 1 ? 14 +HELX_P HELX_P97 97 PRO F 173 ? PHE F 177 ? PRO F 173 PHE F 177 5 ? 5 +HELX_P HELX_P98 98 PRO F 188 ? GLU F 202 ? PRO F 188 GLU F 202 1 ? 15 +HELX_P HELX_P99 99 ASP F 212 ? MET F 216 ? ASP F 212 MET F 216 5 ? 5 +HELX_P HELX_P100 100 GLU F 231 ? ARG F 242 ? GLU F 231 ARG F 242 1 ? 12 +HELX_P HELX_P101 101 TYR F 260 ? MET F 267 ? TYR F 260 MET F 267 1 ? 8 +HELX_P HELX_P102 102 ARG F 295 ? SER F 311 ? ARG F 295 SER F 311 1 ? 17 +HELX_P HELX_P103 103 PHE F 327 ? LEU F 337 ? PHE F 327 LEU F 337 1 ? 11 +HELX_P HELX_P104 104 ASP F 347 ? THR F 352 ? ASP F 347 THR F 352 5 ? 6 +HELX_P HELX_P105 105 HIS F 368 ? ARG F 372 ? HIS F 368 ARG F 372 1 ? 5 +HELX_P HELX_P106 106 ALA F 374 ? SER F 390 ? ALA F 374 SER F 390 1 ? 17 +HELX_P HELX_P107 107 GLY F 405 ? TYR F 409 ? GLY F 405 TYR F 409 5 ? 5 +HELX_P HELX_P108 108 SER F 420 ? ILE F 436 ? SER F 420 ILE F 436 1 ? 17 +HELX_P HELX_P109 109 SER F 460 ? ALA F 471 ? SER F 460 ALA F 471 1 ? 12 +HELX_P HELX_P110 110 GLU F 489 ? LEU F 493 ? GLU F 489 LEU F 493 5 ? 5 +HELX_P HELX_P111 111 PRO F 494 ? GLY F 526 ? PRO F 494 GLY F 526 1 ? 33 +HELX_P HELX_P112 112 PRO F 532 ? PHE F 537 ? PRO F 532 PHE F 537 1 ? 6 +HELX_P HELX_P113 113 ASP F 540 ? ILE F 546 ? ASP F 540 ILE F 546 5 ? 7 +HELX_P HELX_P114 114 GLU F 611 ? ASP F 613 ? GLU F 611 ASP F 613 5 ? 3 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_mon_prot_cis.pdbx_id +_struct_mon_prot_cis.label_comp_id +_struct_mon_prot_cis.label_seq_id +_struct_mon_prot_cis.label_asym_id +_struct_mon_prot_cis.label_alt_id +_struct_mon_prot_cis.pdbx_PDB_ins_code +_struct_mon_prot_cis.auth_comp_id +_struct_mon_prot_cis.auth_seq_id +_struct_mon_prot_cis.auth_asym_id +_struct_mon_prot_cis.pdbx_label_comp_id_2 +_struct_mon_prot_cis.pdbx_label_seq_id_2 +_struct_mon_prot_cis.pdbx_label_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 +_struct_mon_prot_cis.pdbx_auth_comp_id_2 +_struct_mon_prot_cis.pdbx_auth_seq_id_2 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_model_num +_struct_mon_prot_cis.pdbx_omega_angle +1 ASP 96 A . ? ASP 96 A PRO 97 A ? PRO 97 A 1 -0.78 +2 GLY 152 A . ? GLY 152 A PRO 153 A ? PRO 153 A 1 0.60 +3 TYR 184 A . ? TYR 184 A SER 185 A ? SER 185 A 1 0.22 +4 TYR 187 A . ? TYR 187 A PRO 188 A ? PRO 188 A 1 -1.15 +5 GLU 323 A . ? GLU 323 A PRO 324 A ? PRO 324 A 1 -0.14 +6 ASP 96 B . ? ASP 96 B PRO 97 B ? PRO 97 B 1 -0.55 +7 GLY 152 B . ? GLY 152 B PRO 153 B ? PRO 153 B 1 0.00 +8 TYR 184 B . ? TYR 184 B SER 185 B ? SER 185 B 1 0.22 +9 TYR 187 B . ? TYR 187 B PRO 188 B ? PRO 188 B 1 -0.61 +10 GLU 323 B . ? GLU 323 B PRO 324 B ? PRO 324 B 1 0.27 +11 ASP 96 C . ? ASP 96 C PRO 97 C ? PRO 97 C 1 -0.17 +12 GLY 152 C . ? GLY 152 C PRO 153 C ? PRO 153 C 1 0.09 +13 TYR 184 C . ? TYR 184 C SER 185 C ? SER 185 C 1 0.07 +14 TYR 187 C . ? TYR 187 C PRO 188 C ? PRO 188 C 1 -0.64 +15 GLU 323 C . ? GLU 323 C PRO 324 C ? PRO 324 C 1 0.72 +16 ASP 96 D . ? ASP 96 D PRO 97 D ? PRO 97 D 1 -0.28 +17 GLY 152 D . ? GLY 152 D PRO 153 D ? PRO 153 D 1 0.19 +18 TYR 184 D . ? TYR 184 D SER 185 D ? SER 185 D 1 0.61 +19 TYR 187 D . ? TYR 187 D PRO 188 D ? PRO 188 D 1 -0.82 +20 GLU 323 D . ? GLU 323 D PRO 324 D ? PRO 324 D 1 0.51 +21 ASP 96 E . ? ASP 96 E PRO 97 E ? PRO 97 E 1 -0.31 +22 GLY 152 E . ? GLY 152 E PRO 153 E ? PRO 153 E 1 -0.34 +23 TYR 184 E . ? TYR 184 E SER 185 E ? SER 185 E 1 0.32 +24 TYR 187 E . ? TYR 187 E PRO 188 E ? PRO 188 E 1 -0.83 +25 GLU 323 E . ? GLU 323 E PRO 324 E ? PRO 324 E 1 0.67 +26 ASP 96 F . ? ASP 96 F PRO 97 F ? PRO 97 F 1 -0.60 +27 GLY 152 F . ? GLY 152 F PRO 153 F ? PRO 153 F 1 0.00 +28 TYR 184 F . ? TYR 184 F SER 185 F ? SER 185 F 1 0.24 +29 TYR 187 F . ? TYR 187 F PRO 188 F ? PRO 188 F 1 -1.01 +30 GLU 323 F . ? GLU 323 F PRO 324 F ? PRO 324 F 1 0.29 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +A ? 6 ? +B ? 5 ? +C ? 2 ? +D ? 9 ? +E ? 3 ? +F ? 3 ? +G ? 6 ? +H ? 2 ? +I ? 5 ? +J ? 6 ? +K ? 7 ? +L ? 5 ? +M ? 2 ? +N ? 9 ? +O ? 3 ? +P ? 3 ? +Q ? 6 ? +R ? 2 ? +S ? 5 ? +T ? 6 ? +U ? 6 ? +V ? 5 ? +W ? 2 ? +X ? 9 ? +Y ? 3 ? +Z ? 3 ? +AA ? 6 ? +AB ? 2 ? +AC ? 10 ? +AD ? 7 ? +AE ? 5 ? +AF ? 2 ? +AG ? 9 ? +AH ? 3 ? +AI ? 3 ? +AJ ? 6 ? +AK ? 2 ? +AL ? 10 ? +AM ? 7 ? +AN ? 5 ? +AO ? 2 ? +AP ? 9 ? +AQ ? 3 ? +AR ? 3 ? +AS ? 6 ? +AT ? 2 ? +AU ? 5 ? +AV ? 6 ? +AW ? 6 ? +AX ? 5 ? +AY ? 2 ? +AZ ? 9 ? +BA ? 3 ? +BB ? 3 ? +BC ? 6 ? +BD ? 2 ? +BE ? 5 ? +BF ? 6 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? anti-parallel +A 4 5 ? anti-parallel +A 5 6 ? anti-parallel +B 1 2 ? anti-parallel +B 2 3 ? anti-parallel +B 3 4 ? anti-parallel +B 4 5 ? anti-parallel +C 1 2 ? parallel +D 1 2 ? parallel +D 2 3 ? parallel +D 3 4 ? parallel +D 4 5 ? parallel +D 5 6 ? parallel +D 6 7 ? parallel +D 7 8 ? parallel +D 8 9 ? parallel +E 1 2 ? anti-parallel +E 2 3 ? anti-parallel +F 1 2 ? anti-parallel +F 2 3 ? anti-parallel +G 1 2 ? anti-parallel +G 2 3 ? anti-parallel +G 3 4 ? anti-parallel +G 4 5 ? anti-parallel +G 5 6 ? anti-parallel +H 1 2 ? anti-parallel +I 1 2 ? anti-parallel +I 2 3 ? parallel +I 3 4 ? anti-parallel +I 4 5 ? anti-parallel +J 1 2 ? anti-parallel +J 2 3 ? anti-parallel +J 3 4 ? anti-parallel +J 4 5 ? anti-parallel +J 5 6 ? anti-parallel +K 1 2 ? anti-parallel +K 2 3 ? anti-parallel +K 3 4 ? anti-parallel +K 4 5 ? anti-parallel +K 5 6 ? anti-parallel +K 6 7 ? anti-parallel +L 1 2 ? anti-parallel +L 2 3 ? anti-parallel +L 3 4 ? anti-parallel +L 4 5 ? anti-parallel +M 1 2 ? parallel +N 1 2 ? parallel +N 2 3 ? parallel +N 3 4 ? parallel +N 4 5 ? parallel +N 5 6 ? parallel +N 6 7 ? parallel +N 7 8 ? parallel +N 8 9 ? parallel +O 1 2 ? anti-parallel +O 2 3 ? anti-parallel +P 1 2 ? anti-parallel +P 2 3 ? anti-parallel +Q 1 2 ? anti-parallel +Q 2 3 ? anti-parallel +Q 3 4 ? anti-parallel +Q 4 5 ? anti-parallel +Q 5 6 ? anti-parallel +R 1 2 ? anti-parallel +S 1 2 ? anti-parallel +S 2 3 ? parallel +S 3 4 ? anti-parallel +S 4 5 ? anti-parallel +T 1 2 ? anti-parallel +T 2 3 ? anti-parallel +T 3 4 ? anti-parallel +T 4 5 ? anti-parallel +T 5 6 ? anti-parallel +U 1 2 ? anti-parallel +U 2 3 ? anti-parallel +U 3 4 ? anti-parallel +U 4 5 ? anti-parallel +U 5 6 ? anti-parallel +V 1 2 ? anti-parallel +V 2 3 ? anti-parallel +V 3 4 ? anti-parallel +V 4 5 ? anti-parallel +W 1 2 ? parallel +X 1 2 ? parallel +X 2 3 ? parallel +X 3 4 ? parallel +X 4 5 ? parallel +X 5 6 ? parallel +X 6 7 ? parallel +X 7 8 ? parallel +X 8 9 ? parallel +Y 1 2 ? anti-parallel +Y 2 3 ? anti-parallel +Z 1 2 ? anti-parallel +Z 2 3 ? anti-parallel +AA 1 2 ? anti-parallel +AA 2 3 ? anti-parallel +AA 3 4 ? anti-parallel +AA 4 5 ? anti-parallel +AA 5 6 ? anti-parallel +AB 1 2 ? anti-parallel +AC 1 2 ? anti-parallel +AC 2 3 ? parallel +AC 3 4 ? anti-parallel +AC 4 5 ? anti-parallel +AC 5 6 ? anti-parallel +AC 6 7 ? anti-parallel +AC 7 8 ? anti-parallel +AC 8 9 ? anti-parallel +AC 9 10 ? anti-parallel +AD 1 2 ? anti-parallel +AD 2 3 ? anti-parallel +AD 3 4 ? anti-parallel +AD 4 5 ? anti-parallel +AD 5 6 ? anti-parallel +AD 6 7 ? anti-parallel +AE 1 2 ? anti-parallel +AE 2 3 ? anti-parallel +AE 3 4 ? anti-parallel +AE 4 5 ? anti-parallel +AF 1 2 ? parallel +AG 1 2 ? parallel +AG 2 3 ? parallel +AG 3 4 ? parallel +AG 4 5 ? parallel +AG 5 6 ? parallel +AG 6 7 ? parallel +AG 7 8 ? parallel +AG 8 9 ? parallel +AH 1 2 ? anti-parallel +AH 2 3 ? anti-parallel +AI 1 2 ? anti-parallel +AI 2 3 ? anti-parallel +AJ 1 2 ? anti-parallel +AJ 2 3 ? anti-parallel +AJ 3 4 ? anti-parallel +AJ 4 5 ? anti-parallel +AJ 5 6 ? anti-parallel +AK 1 2 ? anti-parallel +AL 1 2 ? anti-parallel +AL 2 3 ? parallel +AL 3 4 ? anti-parallel +AL 4 5 ? anti-parallel +AL 5 6 ? anti-parallel +AL 6 7 ? anti-parallel +AL 7 8 ? anti-parallel +AL 8 9 ? anti-parallel +AL 9 10 ? anti-parallel +AM 1 2 ? anti-parallel +AM 2 3 ? anti-parallel +AM 3 4 ? anti-parallel +AM 4 5 ? anti-parallel +AM 5 6 ? anti-parallel +AM 6 7 ? anti-parallel +AN 1 2 ? anti-parallel +AN 2 3 ? anti-parallel +AN 3 4 ? anti-parallel +AN 4 5 ? anti-parallel +AO 1 2 ? parallel +AP 1 2 ? parallel +AP 2 3 ? parallel +AP 3 4 ? parallel +AP 4 5 ? parallel +AP 5 6 ? parallel +AP 6 7 ? parallel +AP 7 8 ? parallel +AP 8 9 ? parallel +AQ 1 2 ? anti-parallel +AQ 2 3 ? anti-parallel +AR 1 2 ? anti-parallel +AR 2 3 ? anti-parallel +AS 1 2 ? anti-parallel +AS 2 3 ? anti-parallel +AS 3 4 ? anti-parallel +AS 4 5 ? anti-parallel +AS 5 6 ? anti-parallel +AT 1 2 ? anti-parallel +AU 1 2 ? anti-parallel +AU 2 3 ? parallel +AU 3 4 ? anti-parallel +AU 4 5 ? anti-parallel +AV 1 2 ? anti-parallel +AV 2 3 ? anti-parallel +AV 3 4 ? anti-parallel +AV 4 5 ? anti-parallel +AV 5 6 ? anti-parallel +AW 1 2 ? anti-parallel +AW 2 3 ? anti-parallel +AW 3 4 ? anti-parallel +AW 4 5 ? anti-parallel +AW 5 6 ? anti-parallel +AX 1 2 ? anti-parallel +AX 2 3 ? anti-parallel +AX 3 4 ? anti-parallel +AX 4 5 ? anti-parallel +AY 1 2 ? parallel +AZ 1 2 ? parallel +AZ 2 3 ? parallel +AZ 3 4 ? parallel +AZ 4 5 ? parallel +AZ 5 6 ? parallel +AZ 6 7 ? parallel +AZ 7 8 ? parallel +AZ 8 9 ? parallel +BA 1 2 ? anti-parallel +BA 2 3 ? anti-parallel +BB 1 2 ? anti-parallel +BB 2 3 ? anti-parallel +BC 1 2 ? anti-parallel +BC 2 3 ? anti-parallel +BC 3 4 ? anti-parallel +BC 4 5 ? anti-parallel +BC 5 6 ? anti-parallel +BD 1 2 ? anti-parallel +BE 1 2 ? anti-parallel +BE 2 3 ? parallel +BE 3 4 ? anti-parallel +BE 4 5 ? anti-parallel +BF 1 2 ? anti-parallel +BF 2 3 ? anti-parallel +BF 3 4 ? anti-parallel +BF 4 5 ? anti-parallel +BF 5 6 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 LEU A 4 ? GLU A 8 ? LEU A 4 GLU A 8 +A 2 VAL A 12 ? ILE A 17 ? VAL A 12 ILE A 17 +A 3 VAL A 145 ? GLU A 151 ? VAL A 145 GLU A 151 +A 4 VAL A 112 ? PHE A 118 ? VAL A 112 PHE A 118 +A 5 LEU A 104 ? LYS A 109 ? LEU A 104 LYS A 109 +A 6 HIS A 63 ? GLY A 66 ? HIS A 63 GLY A 66 +B 1 LEU A 43 ? GLN A 48 ? LEU A 43 GLN A 48 +B 2 LYS A 51 ? SER A 57 ? LYS A 51 SER A 57 +B 3 LYS A 135 ? ILE A 140 ? LYS A 135 ILE A 140 +B 4 VAL A 124 ? VAL A 128 ? VAL A 124 VAL A 128 +B 5 LYS A 79 ? MET A 83 ? LYS A 79 MET A 83 +C 1 VAL A 100 ? SER A 101 ? VAL A 100 SER A 101 +C 2 GLY A 402 ? TYR A 403 ? GLY A 402 TYR A 403 +D 1 TYR A 179 ? ILE A 181 ? TYR A 179 ILE A 181 +D 2 GLY A 208 ? LEU A 211 ? GLY A 208 LEU A 211 +D 3 LYS A 245 ? VAL A 250 ? LYS A 245 VAL A 250 +D 4 GLY A 316 ? LEU A 319 ? GLY A 316 LEU A 319 +D 5 ILE A 397 ? SER A 399 ? ILE A 397 SER A 399 +D 6 PHE A 411 ? TRP A 413 ? PHE A 411 TRP A 413 +D 7 VAL A 442 ? ILE A 446 ? VAL A 442 ILE A 446 +D 8 PHE A 476 ? SER A 479 ? PHE A 476 SER A 479 +D 9 TYR A 179 ? ILE A 181 ? TYR A 179 ILE A 181 +E 1 ILE A 254 ? ARG A 255 ? ILE A 254 ARG A 255 +E 2 GLY A 286 ? VAL A 289 ? GLY A 286 VAL A 289 +E 3 GLY A 281 ? MET A 283 ? GLY A 281 MET A 283 +F 1 GLU A 272 ? ILE A 273 ? GLU A 272 ILE A 273 +F 2 VAL A 357 ? LEU A 361 ? VAL A 357 LEU A 361 +F 3 LYS A 364 ? LYS A 367 ? LYS A 364 LYS A 367 +G 1 ILE A 530 ? ARG A 531 ? ILE A 530 ARG A 531 +G 2 TYR A 550 ? VAL A 552 ? TYR A 550 VAL A 552 +G 3 LEU A 556 ? TYR A 558 ? LEU A 556 TYR A 558 +G 4 ILE A 600 ? ARG A 603 ? ILE A 600 ARG A 603 +G 5 LYS A 576 ? ASN A 579 ? LYS A 576 ASN A 579 +G 6 ILE A 585 ? ASN A 587 ? ILE A 585 ASN A 587 +H 1 LEU A 569 ? LEU A 572 ? LEU A 569 LEU A 572 +H 2 SER A 590 ? LYS A 593 ? SER A 590 LYS A 593 +I 1 SER A 606 ? LEU A 610 ? SER A 606 LEU A 610 +I 2 GLU A 614 ? TYR A 618 ? GLU A 614 TYR A 618 +I 3 ILE A 644 ? THR A 652 ? ILE A 644 THR A 652 +I 4 THR A 677 ? ILE A 686 ? THR A 677 ILE A 686 +I 5 GLU A 671 ? MET A 674 ? GLU A 671 MET A 674 +J 1 THR A 621 ? LYS A 624 ? THR A 621 LYS A 624 +J 2 GLU A 630 ? SER A 633 ? GLU A 630 SER A 633 +J 3 GLU A 637 ? PHE A 640 ? GLU A 637 PHE A 640 +J 4 LYS A 689 ? GLU A 693 ? LYS A 689 GLU A 693 +J 5 LYS A 659 ? VAL A 662 ? LYS A 659 VAL A 662 +J 6 GLU A 667 ? GLN A 669 ? GLU A 667 GLN A 669 +K 1 ILE B 32 ? SER B 33 ? ILE B 32 SER B 33 +K 2 LEU B 4 ? GLU B 8 ? LEU B 4 GLU B 8 +K 3 VAL B 12 ? ILE B 17 ? VAL B 12 ILE B 17 +K 4 VAL B 145 ? GLU B 151 ? VAL B 145 GLU B 151 +K 5 VAL B 112 ? PHE B 118 ? VAL B 112 PHE B 118 +K 6 LEU B 104 ? LYS B 109 ? LEU B 104 LYS B 109 +K 7 HIS B 63 ? GLY B 66 ? HIS B 63 GLY B 66 +L 1 THR B 44 ? GLN B 48 ? THR B 44 GLN B 48 +L 2 LYS B 51 ? SER B 57 ? LYS B 51 SER B 57 +L 3 LYS B 135 ? ILE B 140 ? LYS B 135 ILE B 140 +L 4 VAL B 124 ? VAL B 128 ? VAL B 124 VAL B 128 +L 5 LYS B 79 ? MET B 83 ? LYS B 79 MET B 83 +M 1 VAL B 100 ? SER B 101 ? VAL B 100 SER B 101 +M 2 GLY B 402 ? TYR B 403 ? GLY B 402 TYR B 403 +N 1 TYR B 179 ? ILE B 181 ? TYR B 179 ILE B 181 +N 2 GLY B 208 ? LEU B 211 ? GLY B 208 LEU B 211 +N 3 LYS B 245 ? VAL B 250 ? LYS B 245 VAL B 250 +N 4 GLY B 316 ? LEU B 319 ? GLY B 316 LEU B 319 +N 5 ILE B 397 ? SER B 399 ? ILE B 397 SER B 399 +N 6 PHE B 411 ? TRP B 413 ? PHE B 411 TRP B 413 +N 7 VAL B 442 ? ILE B 446 ? VAL B 442 ILE B 446 +N 8 PHE B 476 ? SER B 479 ? PHE B 476 SER B 479 +N 9 TYR B 179 ? ILE B 181 ? TYR B 179 ILE B 181 +O 1 ILE B 254 ? ARG B 255 ? ILE B 254 ARG B 255 +O 2 GLY B 286 ? VAL B 289 ? GLY B 286 VAL B 289 +O 3 GLY B 281 ? MET B 283 ? GLY B 281 MET B 283 +P 1 GLU B 272 ? ILE B 273 ? GLU B 272 ILE B 273 +P 2 VAL B 357 ? LEU B 361 ? VAL B 357 LEU B 361 +P 3 LYS B 364 ? LYS B 367 ? LYS B 364 LYS B 367 +Q 1 ILE B 530 ? ARG B 531 ? ILE B 530 ARG B 531 +Q 2 TYR B 550 ? VAL B 552 ? TYR B 550 VAL B 552 +Q 3 LEU B 556 ? TYR B 558 ? LEU B 556 TYR B 558 +Q 4 ILE B 600 ? ARG B 603 ? ILE B 600 ARG B 603 +Q 5 LYS B 576 ? ASN B 579 ? LYS B 576 ASN B 579 +Q 6 ILE B 585 ? ASN B 587 ? ILE B 585 ASN B 587 +R 1 LEU B 569 ? LEU B 572 ? LEU B 569 LEU B 572 +R 2 SER B 590 ? LYS B 593 ? SER B 590 LYS B 593 +S 1 SER B 606 ? LEU B 610 ? SER B 606 LEU B 610 +S 2 GLU B 614 ? TYR B 618 ? GLU B 614 TYR B 618 +S 3 ILE B 644 ? THR B 652 ? ILE B 644 THR B 652 +S 4 THR B 677 ? ILE B 686 ? THR B 677 ILE B 686 +S 5 GLU B 671 ? MET B 674 ? GLU B 671 MET B 674 +T 1 THR B 621 ? LYS B 624 ? THR B 621 LYS B 624 +T 2 GLU B 630 ? SER B 633 ? GLU B 630 SER B 633 +T 3 GLU B 637 ? PHE B 640 ? GLU B 637 PHE B 640 +T 4 LYS B 689 ? GLU B 693 ? LYS B 689 GLU B 693 +T 5 LYS B 659 ? VAL B 662 ? LYS B 659 VAL B 662 +T 6 GLU B 667 ? GLN B 669 ? GLU B 667 GLN B 669 +U 1 LEU C 4 ? ASN C 9 ? LEU C 4 ASN C 9 +U 2 VAL C 12 ? ILE C 17 ? VAL C 12 ILE C 17 +U 3 VAL C 145 ? GLU C 151 ? VAL C 145 GLU C 151 +U 4 VAL C 112 ? PHE C 118 ? VAL C 112 PHE C 118 +U 5 LEU C 104 ? LYS C 109 ? LEU C 104 LYS C 109 +U 6 HIS C 63 ? GLY C 66 ? HIS C 63 GLY C 66 +V 1 LEU C 43 ? GLN C 48 ? LEU C 43 GLN C 48 +V 2 LYS C 51 ? SER C 57 ? LYS C 51 SER C 57 +V 3 LYS C 135 ? ILE C 140 ? LYS C 135 ILE C 140 +V 4 VAL C 124 ? VAL C 128 ? VAL C 124 VAL C 128 +V 5 LYS C 79 ? MET C 83 ? LYS C 79 MET C 83 +W 1 VAL C 100 ? SER C 101 ? VAL C 100 SER C 101 +W 2 GLY C 402 ? TYR C 403 ? GLY C 402 TYR C 403 +X 1 TYR C 179 ? ILE C 181 ? TYR C 179 ILE C 181 +X 2 GLY C 208 ? LEU C 211 ? GLY C 208 LEU C 211 +X 3 LYS C 245 ? VAL C 250 ? LYS C 245 VAL C 250 +X 4 GLY C 316 ? LEU C 319 ? GLY C 316 LEU C 319 +X 5 ILE C 397 ? SER C 399 ? ILE C 397 SER C 399 +X 6 PHE C 411 ? TRP C 413 ? PHE C 411 TRP C 413 +X 7 VAL C 442 ? ILE C 446 ? VAL C 442 ILE C 446 +X 8 PHE C 476 ? SER C 479 ? PHE C 476 SER C 479 +X 9 TYR C 179 ? ILE C 181 ? TYR C 179 ILE C 181 +Y 1 ILE C 254 ? ARG C 255 ? ILE C 254 ARG C 255 +Y 2 GLY C 286 ? VAL C 289 ? GLY C 286 VAL C 289 +Y 3 GLY C 281 ? MET C 283 ? GLY C 281 MET C 283 +Z 1 GLU C 272 ? ILE C 273 ? GLU C 272 ILE C 273 +Z 2 VAL C 357 ? LEU C 361 ? VAL C 357 LEU C 361 +Z 3 LYS C 364 ? LYS C 367 ? LYS C 364 LYS C 367 +AA 1 ILE C 530 ? ARG C 531 ? ILE C 530 ARG C 531 +AA 2 TYR C 550 ? VAL C 552 ? TYR C 550 VAL C 552 +AA 3 LEU C 556 ? TYR C 558 ? LEU C 556 TYR C 558 +AA 4 ILE C 600 ? ARG C 603 ? ILE C 600 ARG C 603 +AA 5 LYS C 576 ? ASN C 579 ? LYS C 576 ASN C 579 +AA 6 ILE C 585 ? ASN C 587 ? ILE C 585 ASN C 587 +AB 1 LEU C 569 ? LEU C 572 ? LEU C 569 LEU C 572 +AB 2 SER C 590 ? LYS C 593 ? SER C 590 LYS C 593 +AC 1 SER C 606 ? LEU C 610 ? SER C 606 LEU C 610 +AC 2 GLU C 614 ? TYR C 618 ? GLU C 614 TYR C 618 +AC 3 ILE C 644 ? THR C 652 ? ILE C 644 THR C 652 +AC 4 THR C 677 ? ILE C 686 ? THR C 677 ILE C 686 +AC 5 GLU C 667 ? MET C 674 ? GLU C 667 MET C 674 +AC 6 LYS C 659 ? VAL C 662 ? LYS C 659 VAL C 662 +AC 7 LYS C 689 ? GLU C 693 ? LYS C 689 GLU C 693 +AC 8 GLU C 637 ? PHE C 640 ? GLU C 637 PHE C 640 +AC 9 GLU C 630 ? SER C 634 ? GLU C 630 SER C 634 +AC 10 THR C 621 ? LYS C 624 ? THR C 621 LYS C 624 +AD 1 ILE D 32 ? SER D 33 ? ILE D 32 SER D 33 +AD 2 LEU D 4 ? GLU D 8 ? LEU D 4 GLU D 8 +AD 3 VAL D 12 ? ILE D 17 ? VAL D 12 ILE D 17 +AD 4 VAL D 145 ? GLU D 151 ? VAL D 145 GLU D 151 +AD 5 VAL D 112 ? PHE D 118 ? VAL D 112 PHE D 118 +AD 6 LEU D 104 ? LYS D 109 ? LEU D 104 LYS D 109 +AD 7 HIS D 63 ? GLY D 66 ? HIS D 63 GLY D 66 +AE 1 THR D 44 ? GLN D 48 ? THR D 44 GLN D 48 +AE 2 LYS D 51 ? SER D 57 ? LYS D 51 SER D 57 +AE 3 LYS D 135 ? ILE D 140 ? LYS D 135 ILE D 140 +AE 4 VAL D 124 ? VAL D 128 ? VAL D 124 VAL D 128 +AE 5 LYS D 79 ? MET D 83 ? LYS D 79 MET D 83 +AF 1 VAL D 100 ? SER D 101 ? VAL D 100 SER D 101 +AF 2 GLY D 402 ? TYR D 403 ? GLY D 402 TYR D 403 +AG 1 TYR D 179 ? ILE D 181 ? TYR D 179 ILE D 181 +AG 2 GLY D 208 ? LEU D 211 ? GLY D 208 LEU D 211 +AG 3 LYS D 245 ? VAL D 250 ? LYS D 245 VAL D 250 +AG 4 GLY D 316 ? LEU D 319 ? GLY D 316 LEU D 319 +AG 5 ILE D 397 ? SER D 399 ? ILE D 397 SER D 399 +AG 6 PHE D 411 ? TRP D 413 ? PHE D 411 TRP D 413 +AG 7 VAL D 442 ? ILE D 446 ? VAL D 442 ILE D 446 +AG 8 PHE D 476 ? SER D 479 ? PHE D 476 SER D 479 +AG 9 TYR D 179 ? ILE D 181 ? TYR D 179 ILE D 181 +AH 1 ILE D 254 ? ARG D 255 ? ILE D 254 ARG D 255 +AH 2 GLY D 286 ? VAL D 289 ? GLY D 286 VAL D 289 +AH 3 GLY D 281 ? MET D 283 ? GLY D 281 MET D 283 +AI 1 GLU D 272 ? ILE D 273 ? GLU D 272 ILE D 273 +AI 2 VAL D 357 ? LEU D 361 ? VAL D 357 LEU D 361 +AI 3 LYS D 364 ? LYS D 367 ? LYS D 364 LYS D 367 +AJ 1 ILE D 530 ? ARG D 531 ? ILE D 530 ARG D 531 +AJ 2 TYR D 550 ? VAL D 552 ? TYR D 550 VAL D 552 +AJ 3 LEU D 556 ? TYR D 558 ? LEU D 556 TYR D 558 +AJ 4 ILE D 600 ? ARG D 603 ? ILE D 600 ARG D 603 +AJ 5 LYS D 576 ? ASN D 579 ? LYS D 576 ASN D 579 +AJ 6 ILE D 585 ? ASN D 587 ? ILE D 585 ASN D 587 +AK 1 LEU D 569 ? LEU D 572 ? LEU D 569 LEU D 572 +AK 2 SER D 590 ? LYS D 593 ? SER D 590 LYS D 593 +AL 1 SER D 606 ? LEU D 610 ? SER D 606 LEU D 610 +AL 2 GLU D 614 ? TYR D 618 ? GLU D 614 TYR D 618 +AL 3 ILE D 644 ? THR D 652 ? ILE D 644 THR D 652 +AL 4 THR D 677 ? ILE D 686 ? THR D 677 ILE D 686 +AL 5 LYS D 666 ? MET D 674 ? LYS D 666 MET D 674 +AL 6 LYS D 659 ? VAL D 662 ? LYS D 659 VAL D 662 +AL 7 LYS D 689 ? GLU D 693 ? LYS D 689 GLU D 693 +AL 8 GLU D 637 ? PHE D 640 ? GLU D 637 PHE D 640 +AL 9 GLU D 630 ? SER D 633 ? GLU D 630 SER D 633 +AL 10 THR D 621 ? LYS D 624 ? THR D 621 LYS D 624 +AM 1 ILE E 32 ? SER E 33 ? ILE E 32 SER E 33 +AM 2 LEU E 4 ? GLU E 8 ? LEU E 4 GLU E 8 +AM 3 VAL E 12 ? ILE E 17 ? VAL E 12 ILE E 17 +AM 4 VAL E 145 ? GLU E 151 ? VAL E 145 GLU E 151 +AM 5 VAL E 112 ? PHE E 118 ? VAL E 112 PHE E 118 +AM 6 LEU E 104 ? LYS E 109 ? LEU E 104 LYS E 109 +AM 7 HIS E 63 ? GLY E 66 ? HIS E 63 GLY E 66 +AN 1 THR E 44 ? GLN E 48 ? THR E 44 GLN E 48 +AN 2 LYS E 51 ? SER E 57 ? LYS E 51 SER E 57 +AN 3 LYS E 135 ? ILE E 140 ? LYS E 135 ILE E 140 +AN 4 VAL E 124 ? VAL E 128 ? VAL E 124 VAL E 128 +AN 5 LYS E 79 ? MET E 83 ? LYS E 79 MET E 83 +AO 1 VAL E 100 ? SER E 101 ? VAL E 100 SER E 101 +AO 2 GLY E 402 ? TYR E 403 ? GLY E 402 TYR E 403 +AP 1 TYR E 179 ? ILE E 181 ? TYR E 179 ILE E 181 +AP 2 GLY E 208 ? LEU E 211 ? GLY E 208 LEU E 211 +AP 3 LYS E 245 ? VAL E 250 ? LYS E 245 VAL E 250 +AP 4 GLY E 316 ? LEU E 319 ? GLY E 316 LEU E 319 +AP 5 ILE E 397 ? SER E 399 ? ILE E 397 SER E 399 +AP 6 PHE E 411 ? TRP E 413 ? PHE E 411 TRP E 413 +AP 7 VAL E 442 ? ILE E 446 ? VAL E 442 ILE E 446 +AP 8 PHE E 476 ? SER E 479 ? PHE E 476 SER E 479 +AP 9 TYR E 179 ? ILE E 181 ? TYR E 179 ILE E 181 +AQ 1 ILE E 254 ? ARG E 255 ? ILE E 254 ARG E 255 +AQ 2 GLY E 286 ? VAL E 289 ? GLY E 286 VAL E 289 +AQ 3 GLY E 281 ? MET E 283 ? GLY E 281 MET E 283 +AR 1 GLU E 272 ? ILE E 273 ? GLU E 272 ILE E 273 +AR 2 VAL E 357 ? LEU E 361 ? VAL E 357 LEU E 361 +AR 3 LYS E 364 ? LYS E 367 ? LYS E 364 LYS E 367 +AS 1 ILE E 530 ? ARG E 531 ? ILE E 530 ARG E 531 +AS 2 TYR E 550 ? VAL E 552 ? TYR E 550 VAL E 552 +AS 3 LEU E 556 ? TYR E 558 ? LEU E 556 TYR E 558 +AS 4 ILE E 600 ? ARG E 603 ? ILE E 600 ARG E 603 +AS 5 LYS E 576 ? ASN E 579 ? LYS E 576 ASN E 579 +AS 6 ILE E 585 ? ASN E 587 ? ILE E 585 ASN E 587 +AT 1 LEU E 569 ? LEU E 572 ? LEU E 569 LEU E 572 +AT 2 SER E 590 ? LYS E 593 ? SER E 590 LYS E 593 +AU 1 SER E 606 ? LEU E 610 ? SER E 606 LEU E 610 +AU 2 GLU E 614 ? TYR E 618 ? GLU E 614 TYR E 618 +AU 3 ILE E 644 ? THR E 652 ? ILE E 644 THR E 652 +AU 4 THR E 677 ? ILE E 686 ? THR E 677 ILE E 686 +AU 5 GLU E 671 ? MET E 674 ? GLU E 671 MET E 674 +AV 1 THR E 621 ? LYS E 624 ? THR E 621 LYS E 624 +AV 2 GLU E 630 ? SER E 634 ? GLU E 630 SER E 634 +AV 3 GLU E 637 ? PHE E 640 ? GLU E 637 PHE E 640 +AV 4 LYS E 689 ? GLU E 693 ? LYS E 689 GLU E 693 +AV 5 LYS E 659 ? VAL E 662 ? LYS E 659 VAL E 662 +AV 6 LYS E 666 ? GLN E 669 ? LYS E 666 GLN E 669 +AW 1 LEU F 4 ? TYR F 7 ? LEU F 4 TYR F 7 +AW 2 VAL F 12 ? ILE F 17 ? VAL F 12 ILE F 17 +AW 3 VAL F 145 ? GLU F 151 ? VAL F 145 GLU F 151 +AW 4 VAL F 112 ? PHE F 118 ? VAL F 112 PHE F 118 +AW 5 LEU F 104 ? LYS F 109 ? LEU F 104 LYS F 109 +AW 6 HIS F 63 ? GLY F 66 ? HIS F 63 GLY F 66 +AX 1 THR F 44 ? GLN F 48 ? THR F 44 GLN F 48 +AX 2 LYS F 51 ? SER F 57 ? LYS F 51 SER F 57 +AX 3 LYS F 135 ? ILE F 140 ? LYS F 135 ILE F 140 +AX 4 VAL F 124 ? VAL F 128 ? VAL F 124 VAL F 128 +AX 5 LYS F 79 ? MET F 83 ? LYS F 79 MET F 83 +AY 1 VAL F 100 ? SER F 101 ? VAL F 100 SER F 101 +AY 2 GLY F 402 ? TYR F 403 ? GLY F 402 TYR F 403 +AZ 1 TYR F 179 ? ILE F 181 ? TYR F 179 ILE F 181 +AZ 2 GLY F 208 ? LEU F 211 ? GLY F 208 LEU F 211 +AZ 3 LYS F 245 ? VAL F 250 ? LYS F 245 VAL F 250 +AZ 4 GLY F 316 ? LEU F 319 ? GLY F 316 LEU F 319 +AZ 5 ILE F 397 ? SER F 399 ? ILE F 397 SER F 399 +AZ 6 PHE F 411 ? TRP F 413 ? PHE F 411 TRP F 413 +AZ 7 VAL F 442 ? ILE F 446 ? VAL F 442 ILE F 446 +AZ 8 PHE F 476 ? SER F 479 ? PHE F 476 SER F 479 +AZ 9 TYR F 179 ? ILE F 181 ? TYR F 179 ILE F 181 +BA 1 ILE F 254 ? ARG F 255 ? ILE F 254 ARG F 255 +BA 2 GLY F 286 ? VAL F 289 ? GLY F 286 VAL F 289 +BA 3 GLY F 281 ? MET F 283 ? GLY F 281 MET F 283 +BB 1 GLU F 272 ? ILE F 273 ? GLU F 272 ILE F 273 +BB 2 VAL F 357 ? LEU F 361 ? VAL F 357 LEU F 361 +BB 3 LYS F 364 ? LYS F 367 ? LYS F 364 LYS F 367 +BC 1 ILE F 530 ? ARG F 531 ? ILE F 530 ARG F 531 +BC 2 TYR F 550 ? VAL F 552 ? TYR F 550 VAL F 552 +BC 3 LEU F 556 ? TYR F 558 ? LEU F 556 TYR F 558 +BC 4 ILE F 600 ? ARG F 603 ? ILE F 600 ARG F 603 +BC 5 LYS F 576 ? ASN F 579 ? LYS F 576 ASN F 579 +BC 6 ILE F 585 ? ASN F 587 ? ILE F 585 ASN F 587 +BD 1 LEU F 569 ? LEU F 572 ? LEU F 569 LEU F 572 +BD 2 SER F 590 ? LYS F 593 ? SER F 590 LYS F 593 +BE 1 SER F 606 ? LEU F 610 ? SER F 606 LEU F 610 +BE 2 GLU F 614 ? TYR F 618 ? GLU F 614 TYR F 618 +BE 3 ILE F 644 ? THR F 652 ? ILE F 644 THR F 652 +BE 4 THR F 677 ? ILE F 686 ? THR F 677 ILE F 686 +BE 5 GLU F 671 ? MET F 674 ? GLU F 671 MET F 674 +BF 1 THR F 621 ? LYS F 624 ? THR F 621 LYS F 624 +BF 2 GLU F 630 ? SER F 634 ? GLU F 630 SER F 634 +BF 3 GLU F 637 ? PHE F 640 ? GLU F 637 PHE F 640 +BF 4 LYS F 689 ? GLU F 693 ? LYS F 689 GLU F 693 +BF 5 LYS F 659 ? VAL F 662 ? LYS F 659 VAL F 662 +BF 6 LYS F 666 ? GLN F 669 ? LYS F 666 GLN F 669 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 N LYS A 5 ? N LYS A 5 O VAL A 16 ? O VAL A 16 +A 2 3 N TYR A 13 ? N TYR A 13 O VAL A 149 ? O VAL A 149 +A 3 4 O ILE A 150 ? O ILE A 150 N GLY A 115 ? N GLY A 115 +A 4 5 O THR A 114 ? O THR A 114 N SER A 107 ? N SER A 107 +A 5 6 O ILE A 106 ? O ILE A 106 N ILE A 65 ? N ILE A 65 +B 1 2 N THR A 44 ? N THR A 44 O GLU A 55 ? O GLU A 55 +B 2 3 N VAL A 54 ? N VAL A 54 O VAL A 138 ? O VAL A 138 +B 3 4 O ILE A 137 ? O ILE A 137 N ASP A 127 ? N ASP A 127 +B 4 5 O PHE A 126 ? O PHE A 126 N TYR A 81 ? N TYR A 81 +C 1 2 N SER A 101 ? N SER A 101 O GLY A 402 ? O GLY A 402 +D 1 2 N ILE A 181 ? N ILE A 181 O GLY A 208 ? O GLY A 208 +D 2 3 N LEU A 211 ? N LEU A 211 O ILE A 247 ? O ILE A 247 +D 3 4 N VAL A 250 ? N VAL A 250 O TRP A 318 ? O TRP A 318 +D 4 5 N LEU A 319 ? N LEU A 319 O LEU A 398 ? O LEU A 398 +D 5 6 N ILE A 397 ? N ILE A 397 O PHE A 411 ? O PHE A 411 +D 6 7 N ILE A 412 ? N ILE A 412 O GLY A 443 ? O GLY A 443 +D 7 8 N ILE A 446 ? N ILE A 446 O ARG A 478 ? O ARG A 478 +D 8 9 O SER A 479 ? O SER A 479 N MET A 180 ? N MET A 180 +E 1 2 N ILE A 254 ? N ILE A 254 O VAL A 289 ? O VAL A 289 +E 2 3 O THR A 288 ? O THR A 288 N GLY A 281 ? N GLY A 281 +F 1 2 N GLU A 272 ? N GLU A 272 O VAL A 358 ? O VAL A 358 +F 2 3 N LEU A 361 ? N LEU A 361 O LYS A 364 ? O LYS A 364 +G 1 2 N ARG A 531 ? N ARG A 531 O MET A 551 ? O MET A 551 +G 2 3 N VAL A 552 ? N VAL A 552 O LEU A 556 ? O LEU A 556 +G 3 4 N LEU A 557 ? N LEU A 557 O TYR A 601 ? O TYR A 601 +G 4 5 O LEU A 602 ? O LEU A 602 N TYR A 578 ? N TYR A 578 +G 5 6 N TRP A 577 ? N TRP A 577 O ILE A 586 ? O ILE A 586 +H 1 2 N VAL A 570 ? N VAL A 570 O VAL A 592 ? O VAL A 592 +I 1 2 N SER A 606 ? N SER A 606 O TYR A 618 ? O TYR A 618 +I 2 3 N LEU A 615 ? N LEU A 615 O THR A 650 ? O THR A 650 +I 3 4 N ILE A 651 ? N ILE A 651 O TYR A 678 ? O TYR A 678 +I 4 5 O VAL A 679 ? O VAL A 679 N GLU A 671 ? N GLU A 671 +J 1 2 N PHE A 623 ? N PHE A 623 O ILE A 631 ? O ILE A 631 +J 2 3 N THR A 632 ? N THR A 632 O LYS A 639 ? O LYS A 639 +J 3 4 N ILE A 638 ? N ILE A 638 O ILE A 690 ? O ILE A 690 +J 4 5 O GLU A 693 ? O GLU A 693 N LYS A 659 ? N LYS A 659 +J 5 6 N ILE A 660 ? N ILE A 660 O ILE A 668 ? O ILE A 668 +K 1 2 O ILE B 32 ? O ILE B 32 N GLU B 8 ? N GLU B 8 +K 2 3 N LYS B 5 ? N LYS B 5 O VAL B 16 ? O VAL B 16 +K 3 4 N ILE B 17 ? N ILE B 17 O VAL B 145 ? O VAL B 145 +K 4 5 O ILE B 150 ? O ILE B 150 N GLY B 115 ? N GLY B 115 +K 5 6 O THR B 114 ? O THR B 114 N SER B 107 ? N SER B 107 +K 6 7 O ILE B 106 ? O ILE B 106 N ILE B 65 ? N ILE B 65 +L 1 2 N VAL B 46 ? N VAL B 46 O ILE B 53 ? O ILE B 53 +L 2 3 N VAL B 54 ? N VAL B 54 O VAL B 138 ? O VAL B 138 +L 3 4 O ILE B 137 ? O ILE B 137 N ASP B 127 ? N ASP B 127 +L 4 5 O PHE B 126 ? O PHE B 126 N TYR B 81 ? N TYR B 81 +M 1 2 N SER B 101 ? N SER B 101 O GLY B 402 ? O GLY B 402 +N 1 2 N ILE B 181 ? N ILE B 181 O GLY B 208 ? O GLY B 208 +N 2 3 N LEU B 211 ? N LEU B 211 O ILE B 247 ? O ILE B 247 +N 3 4 N VAL B 250 ? N VAL B 250 O TRP B 318 ? O TRP B 318 +N 4 5 N LEU B 319 ? N LEU B 319 O LEU B 398 ? O LEU B 398 +N 5 6 N ILE B 397 ? N ILE B 397 O PHE B 411 ? O PHE B 411 +N 6 7 N ILE B 412 ? N ILE B 412 O GLY B 443 ? O GLY B 443 +N 7 8 N ILE B 446 ? N ILE B 446 O ARG B 478 ? O ARG B 478 +N 8 9 O TYR B 477 ? O TYR B 477 N MET B 180 ? N MET B 180 +O 1 2 N ILE B 254 ? N ILE B 254 O VAL B 289 ? O VAL B 289 +O 2 3 O THR B 288 ? O THR B 288 N GLY B 281 ? N GLY B 281 +P 1 2 N GLU B 272 ? N GLU B 272 O VAL B 358 ? O VAL B 358 +P 2 3 N LEU B 361 ? N LEU B 361 O LYS B 364 ? O LYS B 364 +Q 1 2 N ARG B 531 ? N ARG B 531 O MET B 551 ? O MET B 551 +Q 2 3 N VAL B 552 ? N VAL B 552 O LEU B 556 ? O LEU B 556 +Q 3 4 N LEU B 557 ? N LEU B 557 O TYR B 601 ? O TYR B 601 +Q 4 5 O LEU B 602 ? O LEU B 602 N TYR B 578 ? N TYR B 578 +Q 5 6 N TRP B 577 ? N TRP B 577 O ILE B 586 ? O ILE B 586 +R 1 2 N VAL B 570 ? N VAL B 570 O VAL B 592 ? O VAL B 592 +S 1 2 N SER B 606 ? N SER B 606 O TYR B 618 ? O TYR B 618 +S 2 3 N LEU B 615 ? N LEU B 615 O THR B 650 ? O THR B 650 +S 3 4 N ILE B 651 ? N ILE B 651 O TYR B 678 ? O TYR B 678 +S 4 5 O THR B 677 ? O THR B 677 N MET B 674 ? N MET B 674 +T 1 2 N PHE B 623 ? N PHE B 623 O ILE B 631 ? O ILE B 631 +T 2 3 N THR B 632 ? N THR B 632 O LYS B 639 ? O LYS B 639 +T 3 4 N ILE B 638 ? N ILE B 638 O ILE B 690 ? O ILE B 690 +T 4 5 O GLU B 693 ? O GLU B 693 N LYS B 659 ? N LYS B 659 +T 5 6 N ILE B 660 ? N ILE B 660 O ILE B 668 ? O ILE B 668 +U 1 2 N LYS C 5 ? N LYS C 5 O VAL C 16 ? O VAL C 16 +U 2 3 N TYR C 13 ? N TYR C 13 O VAL C 149 ? O VAL C 149 +U 3 4 O ILE C 150 ? O ILE C 150 N GLY C 115 ? N GLY C 115 +U 4 5 O THR C 114 ? O THR C 114 N SER C 107 ? N SER C 107 +U 5 6 O ILE C 106 ? O ILE C 106 N ILE C 65 ? N ILE C 65 +V 1 2 N THR C 44 ? N THR C 44 O GLU C 55 ? O GLU C 55 +V 2 3 N VAL C 54 ? N VAL C 54 O VAL C 138 ? O VAL C 138 +V 3 4 O ILE C 137 ? O ILE C 137 N ASP C 127 ? N ASP C 127 +V 4 5 O PHE C 126 ? O PHE C 126 N TYR C 81 ? N TYR C 81 +W 1 2 N SER C 101 ? N SER C 101 O GLY C 402 ? O GLY C 402 +X 1 2 N ILE C 181 ? N ILE C 181 O GLY C 208 ? O GLY C 208 +X 2 3 N LEU C 211 ? N LEU C 211 O ILE C 247 ? O ILE C 247 +X 3 4 N VAL C 250 ? N VAL C 250 O TRP C 318 ? O TRP C 318 +X 4 5 N LEU C 319 ? N LEU C 319 O LEU C 398 ? O LEU C 398 +X 5 6 N ILE C 397 ? N ILE C 397 O PHE C 411 ? O PHE C 411 +X 6 7 N ILE C 412 ? N ILE C 412 O GLY C 443 ? O GLY C 443 +X 7 8 N ILE C 446 ? N ILE C 446 O ARG C 478 ? O ARG C 478 +X 8 9 O TYR C 477 ? O TYR C 477 N MET C 180 ? N MET C 180 +Y 1 2 N ILE C 254 ? N ILE C 254 O VAL C 289 ? O VAL C 289 +Y 2 3 O THR C 288 ? O THR C 288 N GLY C 281 ? N GLY C 281 +Z 1 2 N GLU C 272 ? N GLU C 272 O VAL C 358 ? O VAL C 358 +Z 2 3 N LEU C 361 ? N LEU C 361 O LYS C 364 ? O LYS C 364 +AA 1 2 N ARG C 531 ? N ARG C 531 O MET C 551 ? O MET C 551 +AA 2 3 N VAL C 552 ? N VAL C 552 O LEU C 556 ? O LEU C 556 +AA 3 4 N LEU C 557 ? N LEU C 557 O TYR C 601 ? O TYR C 601 +AA 4 5 O LEU C 602 ? O LEU C 602 N TYR C 578 ? N TYR C 578 +AA 5 6 N TRP C 577 ? N TRP C 577 O ILE C 586 ? O ILE C 586 +AB 1 2 N VAL C 570 ? N VAL C 570 O VAL C 592 ? O VAL C 592 +AC 1 2 N SER C 606 ? N SER C 606 O TYR C 618 ? O TYR C 618 +AC 2 3 N LEU C 615 ? N LEU C 615 O THR C 650 ? O THR C 650 +AC 3 4 N ILE C 651 ? N ILE C 651 O TYR C 678 ? O TYR C 678 +AC 4 5 O VAL C 679 ? O VAL C 679 N GLU C 671 ? N GLU C 671 +AC 5 6 O ILE C 668 ? O ILE C 668 N ILE C 660 ? N ILE C 660 +AC 6 7 N LYS C 659 ? N LYS C 659 O GLU C 693 ? O GLU C 693 +AC 7 8 O ILE C 690 ? O ILE C 690 N ILE C 638 ? N ILE C 638 +AC 8 9 O LYS C 639 ? O LYS C 639 N THR C 632 ? N THR C 632 +AC 9 10 O ILE C 631 ? O ILE C 631 N PHE C 623 ? N PHE C 623 +AD 1 2 O ILE D 32 ? O ILE D 32 N GLU D 8 ? N GLU D 8 +AD 2 3 N LYS D 5 ? N LYS D 5 O VAL D 16 ? O VAL D 16 +AD 3 4 N VAL D 15 ? N VAL D 15 O PHE D 147 ? O PHE D 147 +AD 4 5 O ILE D 150 ? O ILE D 150 N GLY D 115 ? N GLY D 115 +AD 5 6 O THR D 114 ? O THR D 114 N SER D 107 ? N SER D 107 +AD 6 7 O ILE D 106 ? O ILE D 106 N ILE D 65 ? N ILE D 65 +AE 1 2 N THR D 44 ? N THR D 44 O GLU D 55 ? O GLU D 55 +AE 2 3 N VAL D 54 ? N VAL D 54 O VAL D 138 ? O VAL D 138 +AE 3 4 O ILE D 137 ? O ILE D 137 N ASP D 127 ? N ASP D 127 +AE 4 5 O PHE D 126 ? O PHE D 126 N TYR D 81 ? N TYR D 81 +AF 1 2 N SER D 101 ? N SER D 101 O GLY D 402 ? O GLY D 402 +AG 1 2 N ILE D 181 ? N ILE D 181 O GLY D 208 ? O GLY D 208 +AG 2 3 N LEU D 211 ? N LEU D 211 O ILE D 247 ? O ILE D 247 +AG 3 4 N VAL D 250 ? N VAL D 250 O TRP D 318 ? O TRP D 318 +AG 4 5 N LEU D 319 ? N LEU D 319 O LEU D 398 ? O LEU D 398 +AG 5 6 N ILE D 397 ? N ILE D 397 O PHE D 411 ? O PHE D 411 +AG 6 7 N ILE D 412 ? N ILE D 412 O GLY D 443 ? O GLY D 443 +AG 7 8 N ILE D 446 ? N ILE D 446 O ARG D 478 ? O ARG D 478 +AG 8 9 O TYR D 477 ? O TYR D 477 N MET D 180 ? N MET D 180 +AH 1 2 N ILE D 254 ? N ILE D 254 O VAL D 289 ? O VAL D 289 +AH 2 3 O THR D 288 ? O THR D 288 N GLY D 281 ? N GLY D 281 +AI 1 2 N GLU D 272 ? N GLU D 272 O VAL D 358 ? O VAL D 358 +AI 2 3 N LEU D 361 ? N LEU D 361 O LYS D 364 ? O LYS D 364 +AJ 1 2 N ARG D 531 ? N ARG D 531 O MET D 551 ? O MET D 551 +AJ 2 3 N VAL D 552 ? N VAL D 552 O LEU D 556 ? O LEU D 556 +AJ 3 4 N LEU D 557 ? N LEU D 557 O TYR D 601 ? O TYR D 601 +AJ 4 5 O LEU D 602 ? O LEU D 602 N TYR D 578 ? N TYR D 578 +AJ 5 6 N TRP D 577 ? N TRP D 577 O ILE D 586 ? O ILE D 586 +AK 1 2 N VAL D 570 ? N VAL D 570 O VAL D 592 ? O VAL D 592 +AL 1 2 N SER D 606 ? N SER D 606 O TYR D 618 ? O TYR D 618 +AL 2 3 N LEU D 615 ? N LEU D 615 O THR D 650 ? O THR D 650 +AL 3 4 N ILE D 651 ? N ILE D 651 O TYR D 678 ? O TYR D 678 +AL 4 5 O VAL D 679 ? O VAL D 679 N GLU D 671 ? N GLU D 671 +AL 5 6 O LYS D 666 ? O LYS D 666 N VAL D 662 ? N VAL D 662 +AL 6 7 N LYS D 659 ? N LYS D 659 O GLU D 693 ? O GLU D 693 +AL 7 8 O ILE D 690 ? O ILE D 690 N ILE D 638 ? N ILE D 638 +AL 8 9 O LYS D 639 ? O LYS D 639 N THR D 632 ? N THR D 632 +AL 9 10 O ILE D 631 ? O ILE D 631 N PHE D 623 ? N PHE D 623 +AM 1 2 O ILE E 32 ? O ILE E 32 N GLU E 8 ? N GLU E 8 +AM 2 3 N LYS E 5 ? N LYS E 5 O VAL E 16 ? O VAL E 16 +AM 3 4 N VAL E 15 ? N VAL E 15 O PHE E 147 ? O PHE E 147 +AM 4 5 O ILE E 150 ? O ILE E 150 N GLY E 115 ? N GLY E 115 +AM 5 6 O THR E 114 ? O THR E 114 N SER E 107 ? N SER E 107 +AM 6 7 O ILE E 106 ? O ILE E 106 N ILE E 65 ? N ILE E 65 +AN 1 2 N THR E 44 ? N THR E 44 O GLU E 55 ? O GLU E 55 +AN 2 3 N VAL E 54 ? N VAL E 54 O VAL E 138 ? O VAL E 138 +AN 3 4 O ILE E 137 ? O ILE E 137 N ASP E 127 ? N ASP E 127 +AN 4 5 O PHE E 126 ? O PHE E 126 N TYR E 81 ? N TYR E 81 +AO 1 2 N SER E 101 ? N SER E 101 O GLY E 402 ? O GLY E 402 +AP 1 2 N ILE E 181 ? N ILE E 181 O GLY E 208 ? O GLY E 208 +AP 2 3 N LEU E 211 ? N LEU E 211 O ILE E 247 ? O ILE E 247 +AP 3 4 N VAL E 250 ? N VAL E 250 O TRP E 318 ? O TRP E 318 +AP 4 5 N LEU E 319 ? N LEU E 319 O LEU E 398 ? O LEU E 398 +AP 5 6 N ILE E 397 ? N ILE E 397 O PHE E 411 ? O PHE E 411 +AP 6 7 N ILE E 412 ? N ILE E 412 O GLY E 443 ? O GLY E 443 +AP 7 8 N ILE E 446 ? N ILE E 446 O ARG E 478 ? O ARG E 478 +AP 8 9 O SER E 479 ? O SER E 479 N MET E 180 ? N MET E 180 +AQ 1 2 N ILE E 254 ? N ILE E 254 O VAL E 289 ? O VAL E 289 +AQ 2 3 O THR E 288 ? O THR E 288 N GLY E 281 ? N GLY E 281 +AR 1 2 N GLU E 272 ? N GLU E 272 O VAL E 358 ? O VAL E 358 +AR 2 3 N LEU E 361 ? N LEU E 361 O LYS E 364 ? O LYS E 364 +AS 1 2 N ARG E 531 ? N ARG E 531 O MET E 551 ? O MET E 551 +AS 2 3 N VAL E 552 ? N VAL E 552 O LEU E 556 ? O LEU E 556 +AS 3 4 N LEU E 557 ? N LEU E 557 O TYR E 601 ? O TYR E 601 +AS 4 5 O LEU E 602 ? O LEU E 602 N TYR E 578 ? N TYR E 578 +AS 5 6 N TRP E 577 ? N TRP E 577 O ILE E 586 ? O ILE E 586 +AT 1 2 N VAL E 570 ? N VAL E 570 O VAL E 592 ? O VAL E 592 +AU 1 2 N SER E 606 ? N SER E 606 O TYR E 618 ? O TYR E 618 +AU 2 3 N LEU E 615 ? N LEU E 615 O THR E 650 ? O THR E 650 +AU 3 4 N ILE E 651 ? N ILE E 651 O TYR E 678 ? O TYR E 678 +AU 4 5 O VAL E 679 ? O VAL E 679 N GLU E 671 ? N GLU E 671 +AV 1 2 N PHE E 623 ? N PHE E 623 O ILE E 631 ? O ILE E 631 +AV 2 3 N SER E 634 ? N SER E 634 O GLU E 637 ? O GLU E 637 +AV 3 4 N ILE E 638 ? N ILE E 638 O ILE E 690 ? O ILE E 690 +AV 4 5 O ASN E 691 ? O ASN E 691 N ILE E 661 ? N ILE E 661 +AV 5 6 N VAL E 662 ? N VAL E 662 O LYS E 666 ? O LYS E 666 +AW 1 2 N LYS F 5 ? N LYS F 5 O VAL F 16 ? O VAL F 16 +AW 2 3 N VAL F 15 ? N VAL F 15 O PHE F 147 ? O PHE F 147 +AW 3 4 O ILE F 150 ? O ILE F 150 N GLY F 115 ? N GLY F 115 +AW 4 5 O THR F 114 ? O THR F 114 N SER F 107 ? N SER F 107 +AW 5 6 O ILE F 106 ? O ILE F 106 N ILE F 65 ? N ILE F 65 +AX 1 2 N THR F 44 ? N THR F 44 O GLU F 55 ? O GLU F 55 +AX 2 3 N VAL F 54 ? N VAL F 54 O VAL F 138 ? O VAL F 138 +AX 3 4 O ILE F 137 ? O ILE F 137 N ASP F 127 ? N ASP F 127 +AX 4 5 O PHE F 126 ? O PHE F 126 N TYR F 81 ? N TYR F 81 +AY 1 2 N SER F 101 ? N SER F 101 O GLY F 402 ? O GLY F 402 +AZ 1 2 N ILE F 181 ? N ILE F 181 O GLY F 208 ? O GLY F 208 +AZ 2 3 N LEU F 211 ? N LEU F 211 O ILE F 247 ? O ILE F 247 +AZ 3 4 N VAL F 250 ? N VAL F 250 O TRP F 318 ? O TRP F 318 +AZ 4 5 N LEU F 319 ? N LEU F 319 O LEU F 398 ? O LEU F 398 +AZ 5 6 N ILE F 397 ? N ILE F 397 O PHE F 411 ? O PHE F 411 +AZ 6 7 N ILE F 412 ? N ILE F 412 O GLY F 443 ? O GLY F 443 +AZ 7 8 N ILE F 446 ? N ILE F 446 O ARG F 478 ? O ARG F 478 +AZ 8 9 O TYR F 477 ? O TYR F 477 N MET F 180 ? N MET F 180 +BA 1 2 N ILE F 254 ? N ILE F 254 O VAL F 289 ? O VAL F 289 +BA 2 3 O THR F 288 ? O THR F 288 N GLY F 281 ? N GLY F 281 +BB 1 2 N GLU F 272 ? N GLU F 272 O VAL F 358 ? O VAL F 358 +BB 2 3 N LEU F 361 ? N LEU F 361 O LYS F 364 ? O LYS F 364 +BC 1 2 N ARG F 531 ? N ARG F 531 O MET F 551 ? O MET F 551 +BC 2 3 N VAL F 552 ? N VAL F 552 O LEU F 556 ? O LEU F 556 +BC 3 4 N LEU F 557 ? N LEU F 557 O TYR F 601 ? O TYR F 601 +BC 4 5 O LEU F 602 ? O LEU F 602 N TYR F 578 ? N TYR F 578 +BC 5 6 N TRP F 577 ? N TRP F 577 O ILE F 586 ? O ILE F 586 +BD 1 2 N VAL F 570 ? N VAL F 570 O VAL F 592 ? O VAL F 592 +BE 1 2 N SER F 606 ? N SER F 606 O TYR F 618 ? O TYR F 618 +BE 2 3 N LEU F 615 ? N LEU F 615 O THR F 650 ? O THR F 650 +BE 3 4 N ILE F 651 ? N ILE F 651 O TYR F 678 ? O TYR F 678 +BE 4 5 O VAL F 679 ? O VAL F 679 N GLU F 671 ? N GLU F 671 +BF 1 2 N PHE F 623 ? N PHE F 623 O ILE F 631 ? O ILE F 631 +BF 2 3 N THR F 632 ? N THR F 632 O LYS F 639 ? O LYS F 639 +BF 3 4 N ILE F 638 ? N ILE F 638 O ILE F 690 ? O ILE F 690 +BF 4 5 O GLU F 693 ? O GLU F 693 N LYS F 659 ? N LYS F 659 +BF 5 6 N ILE F 660 ? N ILE F 660 O ILE F 668 ? O ILE F 668 +# +_atom_sites.entry_id 2G3N +_atom_sites.fract_transf_matrix[1][1] 0.009991 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.003450 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.005733 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.007345 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . ILE A 1 3 ? 35.058 33.678 74.275 1.00 64.46 ? 3 ILE A N 1 +ATOM 2 C CA . ILE A 1 3 ? 34.669 34.863 75.092 1.00 65.43 ? 3 ILE A CA 1 +ATOM 3 C C . ILE A 1 3 ? 34.098 34.440 76.445 1.00 66.13 ? 3 ILE A C 1 +ATOM 4 O O . ILE A 1 3 ? 33.249 33.551 76.521 1.00 66.90 ? 3 ILE A O 1 +ATOM 5 C CB . ILE A 1 3 ? 33.600 35.708 74.378 1.00 65.51 ? 3 ILE A CB 1 +ATOM 6 C CG1 . ILE A 1 3 ? 34.092 36.113 72.994 1.00 65.69 ? 3 ILE A CG1 1 +ATOM 7 C CG2 . ILE A 1 3 ? 33.278 36.948 75.202 1.00 65.39 ? 3 ILE A CG2 1 +ATOM 8 C CD1 . ILE A 1 3 ? 33.069 36.905 72.207 1.00 67.36 ? 3 ILE A CD1 1 +ATOM 9 N N . LEU A 1 4 ? 34.569 35.087 77.507 1.00 66.43 ? 4 LEU A N 1 +ATOM 10 C CA . LEU A 1 4 ? 34.114 34.808 78.869 1.00 66.25 ? 4 LEU A CA 1 +ATOM 11 C C . LEU A 1 4 ? 34.419 35.985 79.773 1.00 66.01 ? 4 LEU A C 1 +ATOM 12 O O . LEU A 1 4 ? 35.576 36.261 80.080 1.00 66.96 ? 4 LEU A O 1 +ATOM 13 C CB . LEU A 1 4 ? 34.790 33.556 79.431 1.00 66.55 ? 4 LEU A CB 1 +ATOM 14 C CG . LEU A 1 4 ? 34.800 33.388 80.963 1.00 67.90 ? 4 LEU A CG 1 +ATOM 15 C CD1 . LEU A 1 4 ? 33.405 33.566 81.561 1.00 67.61 ? 4 LEU A CD1 1 +ATOM 16 C CD2 . LEU A 1 4 ? 35.353 32.011 81.297 1.00 67.78 ? 4 LEU A CD2 1 +ATOM 17 N N . LYS A 1 5 ? 33.369 36.677 80.193 1.00 65.72 ? 5 LYS A N 1 +ATOM 18 C CA . LYS A 1 5 ? 33.513 37.828 81.063 1.00 65.24 ? 5 LYS A CA 1 +ATOM 19 C C . LYS A 1 5 ? 32.775 37.553 82.359 1.00 64.28 ? 5 LYS A C 1 +ATOM 20 O O . LYS A 1 5 ? 31.636 37.105 82.344 1.00 64.90 ? 5 LYS A O 1 +ATOM 21 C CB . LYS A 1 5 ? 32.923 39.071 80.400 1.00 65.79 ? 5 LYS A CB 1 +ATOM 22 C CG . LYS A 1 5 ? 33.504 39.388 79.034 1.00 66.98 ? 5 LYS A CG 1 +ATOM 23 C CD . LYS A 1 5 ? 32.893 40.670 78.469 1.00 67.85 ? 5 LYS A CD 1 +ATOM 24 C CE . LYS A 1 5 ? 33.381 40.953 77.052 1.00 68.67 ? 5 LYS A CE 1 +ATOM 25 N NZ . LYS A 1 5 ? 32.938 39.911 76.077 1.00 68.58 ? 5 LYS A NZ 1 +ATOM 26 N N . ILE A 1 6 ? 33.428 37.813 83.481 1.00 63.33 ? 6 ILE A N 1 +ATOM 27 C CA . ILE A 1 6 ? 32.805 37.592 84.772 1.00 62.63 ? 6 ILE A CA 1 +ATOM 28 C C . ILE A 1 6 ? 32.675 38.915 85.511 1.00 63.00 ? 6 ILE A C 1 +ATOM 29 O O . ILE A 1 6 ? 33.651 39.645 85.677 1.00 62.82 ? 6 ILE A O 1 +ATOM 30 C CB . ILE A 1 6 ? 33.627 36.610 85.635 1.00 61.75 ? 6 ILE A CB 1 +ATOM 31 C CG1 . ILE A 1 6 ? 33.834 35.294 84.878 1.00 61.32 ? 6 ILE A CG1 1 +ATOM 32 C CG2 . ILE A 1 6 ? 32.905 36.347 86.948 1.00 62.37 ? 6 ILE A CG2 1 +ATOM 33 C CD1 . ILE A 1 6 ? 34.621 34.247 85.645 1.00 60.32 ? 6 ILE A CD1 1 +ATOM 34 N N . TYR A 1 7 ? 31.457 39.220 85.941 1.00 63.46 ? 7 TYR A N 1 +ATOM 35 C CA . TYR A 1 7 ? 31.173 40.445 86.671 1.00 64.21 ? 7 TYR A CA 1 +ATOM 36 C C . TYR A 1 7 ? 30.800 40.064 88.096 1.00 65.74 ? 7 TYR A C 1 +ATOM 37 O O . TYR A 1 7 ? 30.543 38.893 88.382 1.00 65.97 ? 7 TYR A O 1 +ATOM 38 C CB . TYR A 1 7 ? 30.027 41.209 86.001 1.00 63.18 ? 7 TYR A CB 1 +ATOM 39 C CG . TYR A 1 7 ? 30.300 41.556 84.554 1.00 64.14 ? 7 TYR A CG 1 +ATOM 40 C CD1 . TYR A 1 7 ? 30.383 40.564 83.583 1.00 65.24 ? 7 TYR A CD1 1 +ATOM 41 C CD2 . TYR A 1 7 ? 30.501 42.872 84.160 1.00 66.21 ? 7 TYR A CD2 1 +ATOM 42 C CE1 . TYR A 1 7 ? 30.659 40.870 82.254 1.00 66.49 ? 7 TYR A CE1 1 +ATOM 43 C CE2 . TYR A 1 7 ? 30.780 43.195 82.830 1.00 67.43 ? 7 TYR A CE2 1 +ATOM 44 C CZ . TYR A 1 7 ? 30.857 42.188 81.882 1.00 67.57 ? 7 TYR A CZ 1 +ATOM 45 O OH . TYR A 1 7 ? 31.131 42.500 80.564 1.00 68.23 ? 7 TYR A OH 1 +ATOM 46 N N . GLU A 1 8 ? 30.778 41.048 88.988 1.00 67.84 ? 8 GLU A N 1 +ATOM 47 C CA . GLU A 1 8 ? 30.454 40.812 90.394 1.00 69.80 ? 8 GLU A CA 1 +ATOM 48 C C . GLU A 1 8 ? 29.934 42.114 91.000 1.00 69.89 ? 8 GLU A C 1 +ATOM 49 O O . GLU A 1 8 ? 30.590 43.151 90.921 1.00 70.01 ? 8 GLU A O 1 +ATOM 50 C CB . GLU A 1 8 ? 31.710 40.330 91.125 1.00 72.12 ? 8 GLU A CB 1 +ATOM 51 C CG . GLU A 1 8 ? 31.566 40.137 92.622 1.00 75.17 ? 8 GLU A CG 1 +ATOM 52 C CD . GLU A 1 8 ? 32.869 39.678 93.278 1.00 77.14 ? 8 GLU A CD 1 +ATOM 53 O OE1 . GLU A 1 8 ? 33.945 40.256 92.968 1.00 76.28 ? 8 GLU A OE1 1 +ATOM 54 O OE2 . GLU A 1 8 ? 32.811 38.744 94.111 1.00 77.60 ? 8 GLU A OE2 1 +ATOM 55 N N . ASN A 1 9 ? 28.754 42.058 91.607 1.00 70.63 ? 9 ASN A N 1 +ATOM 56 C CA . ASN A 1 9 ? 28.154 43.255 92.174 1.00 71.04 ? 9 ASN A CA 1 +ATOM 57 C C . ASN A 1 9 ? 27.042 42.995 93.194 1.00 69.92 ? 9 ASN A C 1 +ATOM 58 O O . ASN A 1 9 ? 25.935 42.595 92.834 1.00 70.13 ? 9 ASN A O 1 +ATOM 59 C CB . ASN A 1 9 ? 27.622 44.122 91.028 1.00 73.32 ? 9 ASN A CB 1 +ATOM 60 C CG . ASN A 1 9 ? 26.693 45.217 91.505 1.00 76.77 ? 9 ASN A CG 1 +ATOM 61 O OD1 . ASN A 1 9 ? 27.040 46.002 92.399 1.00 77.29 ? 9 ASN A OD1 1 +ATOM 62 N ND2 . ASN A 1 9 ? 25.500 45.282 90.908 1.00 76.63 ? 9 ASN A ND2 1 +ATOM 63 N N . LYS A 1 10 ? 27.348 43.237 94.465 1.00 68.60 ? 10 LYS A N 1 +ATOM 64 C CA . LYS A 1 10 ? 26.395 43.056 95.559 1.00 66.93 ? 10 LYS A CA 1 +ATOM 65 C C . LYS A 1 10 ? 25.956 41.609 95.761 1.00 65.02 ? 10 LYS A C 1 +ATOM 66 O O . LYS A 1 10 ? 24.761 41.324 95.876 1.00 65.10 ? 10 LYS A O 1 +ATOM 67 C CB . LYS A 1 10 ? 25.153 43.922 95.340 1.00 68.33 ? 10 LYS A CB 1 +ATOM 68 C CG . LYS A 1 10 ? 25.447 45.359 94.947 1.00 70.56 ? 10 LYS A CG 1 +ATOM 69 C CD . LYS A 1 10 ? 24.159 46.172 94.783 1.00 72.06 ? 10 LYS A CD 1 +ATOM 70 C CE . LYS A 1 10 ? 23.090 45.426 93.965 1.00 73.32 ? 10 LYS A CE 1 +ATOM 71 N NZ . LYS A 1 10 ? 23.558 44.941 92.626 1.00 72.99 ? 10 LYS A NZ 1 +ATOM 72 N N . GLY A 1 11 ? 26.925 40.700 95.809 1.00 63.12 ? 11 GLY A N 1 +ATOM 73 C CA . GLY A 1 11 ? 26.622 39.295 96.019 1.00 60.54 ? 11 GLY A CA 1 +ATOM 74 C C . GLY A 1 11 ? 26.177 38.535 94.782 1.00 59.07 ? 11 GLY A C 1 +ATOM 75 O O . GLY A 1 11 ? 25.901 37.340 94.858 1.00 60.24 ? 11 GLY A O 1 +ATOM 76 N N . VAL A 1 12 ? 26.122 39.218 93.643 1.00 57.23 ? 12 VAL A N 1 +ATOM 77 C CA . VAL A 1 12 ? 25.691 38.602 92.393 1.00 54.76 ? 12 VAL A CA 1 +ATOM 78 C C . VAL A 1 12 ? 26.727 38.628 91.269 1.00 54.20 ? 12 VAL A C 1 +ATOM 79 O O . VAL A 1 12 ? 27.028 39.681 90.704 1.00 54.10 ? 12 VAL A O 1 +ATOM 80 C CB . VAL A 1 12 ? 24.408 39.281 91.880 1.00 54.26 ? 12 VAL A CB 1 +ATOM 81 C CG1 . VAL A 1 12 ? 23.985 38.675 90.550 1.00 54.14 ? 12 VAL A CG1 1 +ATOM 82 C CG2 . VAL A 1 12 ? 23.308 39.140 92.915 1.00 53.30 ? 12 VAL A CG2 1 +ATOM 83 N N . TYR A 1 13 ? 27.270 37.464 90.940 1.00 52.60 ? 13 TYR A N 1 +ATOM 84 C CA . TYR A 1 13 ? 28.230 37.378 89.855 1.00 52.00 ? 13 TYR A CA 1 +ATOM 85 C C . TYR A 1 13 ? 27.446 37.196 88.544 1.00 51.28 ? 13 TYR A C 1 +ATOM 86 O O . TYR A 1 13 ? 26.538 36.364 88.480 1.00 52.08 ? 13 TYR A O 1 +ATOM 87 C CB . TYR A 1 13 ? 29.135 36.153 90.020 1.00 55.60 ? 13 TYR A CB 1 +ATOM 88 C CG . TYR A 1 13 ? 30.127 36.160 91.168 1.00 59.06 ? 13 TYR A CG 1 +ATOM 89 C CD1 . TYR A 1 13 ? 29.728 35.871 92.481 1.00 59.55 ? 13 TYR A CD1 1 +ATOM 90 C CD2 . TYR A 1 13 ? 31.492 36.366 90.921 1.00 59.65 ? 13 TYR A CD2 1 +ATOM 91 C CE1 . TYR A 1 13 ? 30.674 35.775 93.521 1.00 60.66 ? 13 TYR A CE1 1 +ATOM 92 C CE2 . TYR A 1 13 ? 32.439 36.274 91.944 1.00 60.49 ? 13 TYR A CE2 1 +ATOM 93 C CZ . TYR A 1 13 ? 32.032 35.976 93.237 1.00 61.62 ? 13 TYR A CZ 1 +ATOM 94 O OH . TYR A 1 13 ? 32.991 35.857 94.224 1.00 62.00 ? 13 TYR A OH 1 +ATOM 95 N N . LYS A 1 14 ? 27.766 37.974 87.512 1.00 48.62 ? 14 LYS A N 1 +ATOM 96 C CA . LYS A 1 14 ? 27.117 37.802 86.219 1.00 45.15 ? 14 LYS A CA 1 +ATOM 97 C C . LYS A 1 14 ? 28.172 37.208 85.296 1.00 44.82 ? 14 LYS A C 1 +ATOM 98 O O . LYS A 1 14 ? 29.154 37.863 84.969 1.00 45.67 ? 14 LYS A O 1 +ATOM 99 C CB . LYS A 1 14 ? 26.620 39.127 85.642 1.00 44.13 ? 14 LYS A CB 1 +ATOM 100 C CG . LYS A 1 14 ? 26.002 38.964 84.259 1.00 43.77 ? 14 LYS A CG 1 +ATOM 101 C CD . LYS A 1 14 ? 25.391 40.252 83.735 1.00 43.99 ? 14 LYS A CD 1 +ATOM 102 C CE . LYS A 1 14 ? 24.733 40.011 82.381 1.00 45.00 ? 14 LYS A CE 1 +ATOM 103 N NZ . LYS A 1 14 ? 24.002 41.211 81.870 1.00 45.85 ? 14 LYS A NZ 1 +ATOM 104 N N . VAL A 1 15 ? 27.982 35.954 84.896 1.00 44.33 ? 15 VAL A N 1 +ATOM 105 C CA . VAL A 1 15 ? 28.926 35.282 84.006 1.00 42.71 ? 15 VAL A CA 1 +ATOM 106 C C . VAL A 1 15 ? 28.398 35.315 82.578 1.00 43.65 ? 15 VAL A C 1 +ATOM 107 O O . VAL A 1 15 ? 27.296 34.836 82.303 1.00 44.87 ? 15 VAL A O 1 +ATOM 108 C CB . VAL A 1 15 ? 29.137 33.817 84.427 1.00 42.57 ? 15 VAL A CB 1 +ATOM 109 C CG1 . VAL A 1 15 ? 30.151 33.146 83.509 1.00 40.51 ? 15 VAL A CG1 1 +ATOM 110 C CG2 . VAL A 1 15 ? 29.611 33.761 85.884 1.00 40.76 ? 15 VAL A CG2 1 +ATOM 111 N N . VAL A 1 16 ? 29.182 35.895 81.675 1.00 43.75 ? 16 VAL A N 1 +ATOM 112 C CA . VAL A 1 16 ? 28.794 36.002 80.276 1.00 43.22 ? 16 VAL A CA 1 +ATOM 113 C C . VAL A 1 16 ? 29.672 35.120 79.397 1.00 45.05 ? 16 VAL A C 1 +ATOM 114 O O . VAL A 1 16 ? 30.893 35.283 79.359 1.00 45.64 ? 16 VAL A O 1 +ATOM 115 C CB . VAL A 1 16 ? 28.904 37.454 79.783 1.00 42.59 ? 16 VAL A CB 1 +ATOM 116 C CG1 . VAL A 1 16 ? 28.469 37.544 78.330 1.00 42.09 ? 16 VAL A CG1 1 +ATOM 117 C CG2 . VAL A 1 16 ? 28.054 38.369 80.657 1.00 40.92 ? 16 VAL A CG2 1 +ATOM 118 N N . ILE A 1 17 ? 29.044 34.177 78.700 1.00 46.03 ? 17 ILE A N 1 +ATOM 119 C CA . ILE A 1 17 ? 29.759 33.276 77.809 1.00 46.53 ? 17 ILE A CA 1 +ATOM 120 C C . ILE A 1 17 ? 29.432 33.679 76.377 1.00 47.76 ? 17 ILE A C 1 +ATOM 121 O O . ILE A 1 17 ? 28.274 33.632 75.972 1.00 48.06 ? 17 ILE A O 1 +ATOM 122 C CB . ILE A 1 17 ? 29.321 31.819 78.020 1.00 47.04 ? 17 ILE A CB 1 +ATOM 123 C CG1 . ILE A 1 17 ? 29.498 31.431 79.486 1.00 47.92 ? 17 ILE A CG1 1 +ATOM 124 C CG2 . ILE A 1 17 ? 30.150 30.891 77.143 1.00 45.60 ? 17 ILE A CG2 1 +ATOM 125 C CD1 . ILE A 1 17 ? 30.925 31.551 79.984 1.00 49.86 ? 17 ILE A CD1 1 +ATOM 126 N N . GLY A 1 18 ? 30.453 34.073 75.619 1.00 48.58 ? 18 GLY A N 1 +ATOM 127 C CA . GLY A 1 18 ? 30.242 34.490 74.246 1.00 49.10 ? 18 GLY A CA 1 +ATOM 128 C C . GLY A 1 18 ? 29.535 35.828 74.192 1.00 50.80 ? 18 GLY A C 1 +ATOM 129 O O . GLY A 1 18 ? 29.799 36.715 75.004 1.00 51.69 ? 18 GLY A O 1 +ATOM 130 N N . GLU A 1 19 ? 28.630 35.976 73.233 1.00 52.62 ? 19 GLU A N 1 +ATOM 131 C CA . GLU A 1 19 ? 27.870 37.210 73.072 1.00 55.22 ? 19 GLU A CA 1 +ATOM 132 C C . GLU A 1 19 ? 26.383 36.881 73.150 1.00 54.66 ? 19 GLU A C 1 +ATOM 133 O O . GLU A 1 19 ? 25.698 36.789 72.133 1.00 56.50 ? 19 GLU A O 1 +ATOM 134 C CB . GLU A 1 19 ? 28.220 37.853 71.732 1.00 58.09 ? 19 GLU A CB 1 +ATOM 135 C CG . GLU A 1 19 ? 29.697 38.231 71.644 1.00 64.98 ? 19 GLU A CG 1 +ATOM 136 C CD . GLU A 1 19 ? 30.155 38.541 70.231 1.00 68.39 ? 19 GLU A CD 1 +ATOM 137 O OE1 . GLU A 1 19 ? 30.088 37.630 69.372 1.00 69.85 ? 19 GLU A OE1 1 +ATOM 138 O OE2 . GLU A 1 19 ? 30.584 39.693 69.986 1.00 70.32 ? 19 GLU A OE2 1 +ATOM 139 N N . PRO A 1 20 ? 25.868 36.703 74.374 1.00 53.41 ? 20 PRO A N 1 +ATOM 140 C CA . PRO A 1 20 ? 24.467 36.372 74.656 1.00 52.13 ? 20 PRO A CA 1 +ATOM 141 C C . PRO A 1 20 ? 23.427 37.385 74.195 1.00 51.50 ? 20 PRO A C 1 +ATOM 142 O O . PRO A 1 20 ? 23.684 38.590 74.138 1.00 52.49 ? 20 PRO A O 1 +ATOM 143 C CB . PRO A 1 20 ? 24.443 36.215 76.177 1.00 52.57 ? 20 PRO A CB 1 +ATOM 144 C CG . PRO A 1 20 ? 25.871 35.882 76.524 1.00 53.13 ? 20 PRO A CG 1 +ATOM 145 C CD . PRO A 1 20 ? 26.636 36.804 75.625 1.00 52.46 ? 20 PRO A CD 1 +ATOM 146 N N . PHE A 1 21 ? 22.248 36.867 73.868 1.00 50.00 ? 21 PHE A N 1 +ATOM 147 C CA . PHE A 1 21 ? 21.108 37.674 73.451 1.00 47.63 ? 21 PHE A CA 1 +ATOM 148 C C . PHE A 1 21 ? 19.985 37.118 74.331 1.00 47.04 ? 21 PHE A C 1 +ATOM 149 O O . PHE A 1 21 ? 19.188 36.289 73.894 1.00 48.23 ? 21 PHE A O 1 +ATOM 150 C CB . PHE A 1 21 ? 20.795 37.434 71.977 1.00 46.00 ? 21 PHE A CB 1 +ATOM 151 C CG . PHE A 1 21 ? 19.830 38.424 71.398 1.00 46.85 ? 21 PHE A CG 1 +ATOM 152 C CD1 . PHE A 1 21 ? 20.230 39.732 71.138 1.00 46.54 ? 21 PHE A CD1 1 +ATOM 153 C CD2 . PHE A 1 21 ? 18.508 38.062 71.143 1.00 46.99 ? 21 PHE A CD2 1 +ATOM 154 C CE1 . PHE A 1 21 ? 19.329 40.672 70.635 1.00 46.48 ? 21 PHE A CE1 1 +ATOM 155 C CE2 . PHE A 1 21 ? 17.593 38.995 70.640 1.00 46.99 ? 21 PHE A CE2 1 +ATOM 156 C CZ . PHE A 1 21 ? 18.005 40.303 70.386 1.00 47.76 ? 21 PHE A CZ 1 +ATOM 157 N N . PRO A 1 22 ? 19.921 37.563 75.595 1.00 45.51 ? 22 PRO A N 1 +ATOM 158 C CA . PRO A 1 22 ? 18.925 37.132 76.583 1.00 43.86 ? 22 PRO A CA 1 +ATOM 159 C C . PRO A 1 22 ? 17.480 37.283 76.126 1.00 42.03 ? 22 PRO A C 1 +ATOM 160 O O . PRO A 1 22 ? 17.157 38.190 75.361 1.00 40.87 ? 22 PRO A O 1 +ATOM 161 C CB . PRO A 1 22 ? 19.216 38.028 77.793 1.00 44.74 ? 22 PRO A CB 1 +ATOM 162 C CG . PRO A 1 22 ? 20.625 38.482 77.579 1.00 45.29 ? 22 PRO A CG 1 +ATOM 163 C CD . PRO A 1 22 ? 20.681 38.715 76.104 1.00 44.99 ? 22 PRO A CD 1 +ATOM 164 N N . PRO A 1 23 ? 16.590 36.396 76.603 1.00 41.78 ? 23 PRO A N 1 +ATOM 165 C CA . PRO A 1 23 ? 15.173 36.458 76.230 1.00 41.39 ? 23 PRO A CA 1 +ATOM 166 C C . PRO A 1 23 ? 14.596 37.764 76.765 1.00 42.35 ? 23 PRO A C 1 +ATOM 167 O O . PRO A 1 23 ? 13.644 38.325 76.227 1.00 41.81 ? 23 PRO A O 1 +ATOM 168 C CB . PRO A 1 23 ? 14.588 35.229 76.915 1.00 41.65 ? 23 PRO A CB 1 +ATOM 169 C CG . PRO A 1 23 ? 15.459 35.072 78.131 1.00 40.92 ? 23 PRO A CG 1 +ATOM 170 C CD . PRO A 1 23 ? 16.832 35.299 77.558 1.00 40.88 ? 23 PRO A CD 1 +ATOM 171 N N . ILE A 1 24 ? 15.195 38.234 77.850 1.00 44.46 ? 24 ILE A N 1 +ATOM 172 C CA . ILE A 1 24 ? 14.804 39.486 78.476 1.00 44.47 ? 24 ILE A CA 1 +ATOM 173 C C . ILE A 1 24 ? 16.042 40.000 79.185 1.00 45.24 ? 24 ILE A C 1 +ATOM 174 O O . ILE A 1 24 ? 16.834 39.216 79.705 1.00 44.03 ? 24 ILE A O 1 +ATOM 175 C CB . ILE A 1 24 ? 13.659 39.290 79.493 1.00 43.73 ? 24 ILE A CB 1 +ATOM 176 C CG1 . ILE A 1 24 ? 13.320 40.627 80.143 1.00 41.90 ? 24 ILE A CG1 1 +ATOM 177 C CG2 . ILE A 1 24 ? 14.056 38.257 80.541 1.00 44.55 ? 24 ILE A CG2 1 +ATOM 178 C CD1 . ILE A 1 24 ? 12.063 40.600 80.980 1.00 43.11 ? 24 ILE A CD1 1 +ATOM 179 N N . GLU A 1 25 ? 16.221 41.315 79.180 1.00 48.08 ? 25 GLU A N 1 +ATOM 180 C CA . GLU A 1 25 ? 17.378 41.912 79.828 1.00 51.05 ? 25 GLU A CA 1 +ATOM 181 C C . GLU A 1 25 ? 17.074 42.371 81.245 1.00 51.71 ? 25 GLU A C 1 +ATOM 182 O O . GLU A 1 25 ? 16.133 43.132 81.484 1.00 51.05 ? 25 GLU A O 1 +ATOM 183 C CB . GLU A 1 25 ? 17.891 43.093 79.009 1.00 53.11 ? 25 GLU A CB 1 +ATOM 184 C CG . GLU A 1 25 ? 18.422 42.697 77.645 1.00 56.83 ? 25 GLU A CG 1 +ATOM 185 C CD . GLU A 1 25 ? 18.947 43.884 76.860 1.00 59.26 ? 25 GLU A CD 1 +ATOM 186 O OE1 . GLU A 1 25 ? 18.156 44.825 76.598 1.00 60.56 ? 25 GLU A OE1 1 +ATOM 187 O OE2 . GLU A 1 25 ? 20.149 43.874 76.505 1.00 59.24 ? 25 GLU A OE2 1 +ATOM 188 N N . PHE A 1 26 ? 17.876 41.888 82.185 1.00 53.45 ? 26 PHE A N 1 +ATOM 189 C CA . PHE A 1 26 ? 17.717 42.258 83.582 1.00 56.00 ? 26 PHE A CA 1 +ATOM 190 C C . PHE A 1 26 ? 18.802 43.267 83.942 1.00 59.64 ? 26 PHE A C 1 +ATOM 191 O O . PHE A 1 26 ? 20.000 42.952 83.918 1.00 58.33 ? 26 PHE A O 1 +ATOM 192 C CB . PHE A 1 26 ? 17.818 41.019 84.473 1.00 52.94 ? 26 PHE A CB 1 +ATOM 193 C CG . PHE A 1 26 ? 16.694 40.051 84.280 1.00 50.68 ? 26 PHE A CG 1 +ATOM 194 C CD1 . PHE A 1 26 ? 15.382 40.441 84.533 1.00 49.73 ? 26 PHE A CD1 1 +ATOM 195 C CD2 . PHE A 1 26 ? 16.938 38.754 83.838 1.00 49.49 ? 26 PHE A CD2 1 +ATOM 196 C CE1 . PHE A 1 26 ? 14.323 39.558 84.352 1.00 48.97 ? 26 PHE A CE1 1 +ATOM 197 C CE2 . PHE A 1 26 ? 15.886 37.861 83.653 1.00 50.55 ? 26 PHE A CE2 1 +ATOM 198 C CZ . PHE A 1 26 ? 14.572 38.266 83.912 1.00 49.46 ? 26 PHE A CZ 1 +ATOM 199 N N . PRO A 1 27 ? 18.389 44.511 84.252 1.00 63.56 ? 27 PRO A N 1 +ATOM 200 C CA . PRO A 1 27 ? 19.312 45.590 84.620 1.00 66.22 ? 27 PRO A CA 1 +ATOM 201 C C . PRO A 1 27 ? 20.201 45.120 85.764 1.00 68.48 ? 27 PRO A C 1 +ATOM 202 O O . PRO A 1 27 ? 19.712 44.765 86.838 1.00 68.09 ? 27 PRO A O 1 +ATOM 203 C CB . PRO A 1 27 ? 18.372 46.717 85.044 1.00 66.13 ? 27 PRO A CB 1 +ATOM 204 C CG . PRO A 1 27 ? 17.160 46.481 84.192 1.00 66.01 ? 27 PRO A CG 1 +ATOM 205 C CD . PRO A 1 27 ? 16.993 44.982 84.296 1.00 64.81 ? 27 PRO A CD 1 +ATOM 206 N N . LEU A 1 28 ? 21.506 45.100 85.524 1.00 71.23 ? 28 LEU A N 1 +ATOM 207 C CA . LEU A 1 28 ? 22.445 44.658 86.541 1.00 74.02 ? 28 LEU A CA 1 +ATOM 208 C C . LEU A 1 28 ? 23.204 45.869 87.067 1.00 76.26 ? 28 LEU A C 1 +ATOM 209 O O . LEU A 1 28 ? 24.292 46.176 86.585 1.00 76.90 ? 28 LEU A O 1 +ATOM 210 C CB . LEU A 1 28 ? 23.403 43.623 85.937 1.00 73.22 ? 28 LEU A CB 1 +ATOM 211 C CG . LEU A 1 28 ? 24.280 42.748 86.843 1.00 72.99 ? 28 LEU A CG 1 +ATOM 212 C CD1 . LEU A 1 28 ? 25.509 43.518 87.280 1.00 73.45 ? 28 LEU A CD1 1 +ATOM 213 C CD2 . LEU A 1 28 ? 23.472 42.261 88.036 1.00 71.30 ? 28 LEU A CD2 1 +ATOM 214 N N . GLU A 1 29 ? 22.596 46.554 88.041 1.00 79.25 ? 29 GLU A N 1 +ATOM 215 C CA . GLU A 1 29 ? 23.153 47.752 88.692 1.00 82.22 ? 29 GLU A CA 1 +ATOM 216 C C . GLU A 1 29 ? 24.388 48.356 88.024 1.00 82.77 ? 29 GLU A C 1 +ATOM 217 O O . GLU A 1 29 ? 24.287 49.256 87.184 1.00 82.66 ? 29 GLU A O 1 +ATOM 218 C CB . GLU A 1 29 ? 23.489 47.441 90.155 1.00 83.87 ? 29 GLU A CB 1 +ATOM 219 C CG . GLU A 1 29 ? 22.350 47.670 91.128 1.00 86.35 ? 29 GLU A CG 1 +ATOM 220 C CD . GLU A 1 29 ? 22.059 49.146 91.335 1.00 88.13 ? 29 GLU A CD 1 +ATOM 221 O OE1 . GLU A 1 29 ? 23.000 49.894 91.694 1.00 88.39 ? 29 GLU A OE1 1 +ATOM 222 O OE2 . GLU A 1 29 ? 20.892 49.555 91.143 1.00 88.31 ? 29 GLU A OE2 1 +ATOM 223 N N . GLN A 1 30 ? 25.553 47.854 88.428 1.00 83.01 ? 30 GLN A N 1 +ATOM 224 C CA . GLN A 1 30 ? 26.832 48.300 87.895 1.00 82.82 ? 30 GLN A CA 1 +ATOM 225 C C . GLN A 1 30 ? 27.544 47.096 87.301 1.00 81.25 ? 30 GLN A C 1 +ATOM 226 O O . GLN A 1 30 ? 27.423 45.985 87.812 1.00 81.08 ? 30 GLN A O 1 +ATOM 227 C CB . GLN A 1 30 ? 27.691 48.880 89.017 1.00 84.74 ? 30 GLN A CB 1 +ATOM 228 C CG . GLN A 1 30 ? 27.031 49.999 89.797 1.00 87.19 ? 30 GLN A CG 1 +ATOM 229 C CD . GLN A 1 30 ? 27.789 50.332 91.064 1.00 88.52 ? 30 GLN A CD 1 +ATOM 230 O OE1 . GLN A 1 30 ? 28.994 50.603 91.030 1.00 89.14 ? 30 GLN A OE1 1 +ATOM 231 N NE2 . GLN A 1 30 ? 27.088 50.313 92.194 1.00 89.12 ? 30 GLN A NE2 1 +ATOM 232 N N . LYS A 1 31 ? 28.283 47.308 86.222 1.00 80.18 ? 31 LYS A N 1 +ATOM 233 C CA . LYS A 1 31 ? 29.011 46.208 85.609 1.00 79.66 ? 31 LYS A CA 1 +ATOM 234 C C . LYS A 1 31 ? 30.453 46.156 86.118 1.00 77.89 ? 31 LYS A C 1 +ATOM 235 O O . LYS A 1 31 ? 31.397 46.432 85.376 1.00 77.47 ? 31 LYS A O 1 +ATOM 236 C CB . LYS A 1 31 ? 28.989 46.334 84.082 1.00 81.39 ? 31 LYS A CB 1 +ATOM 237 C CG . LYS A 1 31 ? 27.954 45.439 83.395 1.00 82.96 ? 31 LYS A CG 1 +ATOM 238 C CD . LYS A 1 31 ? 26.524 45.800 83.789 1.00 84.39 ? 31 LYS A CD 1 +ATOM 239 C CE . LYS A 1 31 ? 25.525 44.800 83.211 1.00 85.16 ? 31 LYS A CE 1 +ATOM 240 N NZ . LYS A 1 31 ? 25.620 44.689 81.726 1.00 84.75 ? 31 LYS A NZ 1 +ATOM 241 N N . ILE A 1 32 ? 30.610 45.797 87.392 1.00 75.75 ? 32 ILE A N 1 +ATOM 242 C CA . ILE A 1 32 ? 31.926 45.701 88.023 1.00 72.91 ? 32 ILE A CA 1 +ATOM 243 C C . ILE A 1 32 ? 32.593 44.384 87.629 1.00 71.12 ? 32 ILE A C 1 +ATOM 244 O O . ILE A 1 32 ? 32.023 43.311 87.827 1.00 70.47 ? 32 ILE A O 1 +ATOM 245 C CB . ILE A 1 32 ? 31.828 45.717 89.572 1.00 72.95 ? 32 ILE A CB 1 +ATOM 246 C CG1 . ILE A 1 32 ? 30.801 46.746 90.048 1.00 72.60 ? 32 ILE A CG1 1 +ATOM 247 C CG2 . ILE A 1 32 ? 33.186 46.053 90.165 1.00 72.64 ? 32 ILE A CG2 1 +ATOM 248 C CD1 . ILE A 1 32 ? 30.543 46.695 91.554 1.00 70.42 ? 32 ILE A CD1 1 +ATOM 249 N N . SER A 1 33 ? 33.801 44.464 87.082 1.00 69.05 ? 33 SER A N 1 +ATOM 250 C CA . SER A 1 33 ? 34.528 43.263 86.684 1.00 67.27 ? 33 SER A CA 1 +ATOM 251 C C . SER A 1 33 ? 35.009 42.514 87.925 1.00 66.64 ? 33 SER A C 1 +ATOM 252 O O . SER A 1 33 ? 35.314 43.126 88.945 1.00 66.76 ? 33 SER A O 1 +ATOM 253 C CB . SER A 1 33 ? 35.720 43.646 85.816 1.00 66.10 ? 33 SER A CB 1 +ATOM 254 O OG . SER A 1 33 ? 35.297 44.464 84.744 1.00 65.83 ? 33 SER A OG 1 +ATOM 255 N N . SER A 1 34 ? 35.084 41.192 87.841 1.00 65.87 ? 34 SER A N 1 +ATOM 256 C CA . SER A 1 34 ? 35.515 40.393 88.983 1.00 64.56 ? 34 SER A CA 1 +ATOM 257 C C . SER A 1 34 ? 36.887 39.752 88.813 1.00 63.72 ? 34 SER A C 1 +ATOM 258 O O . SER A 1 34 ? 37.368 39.547 87.697 1.00 63.45 ? 34 SER A O 1 +ATOM 259 C CB . SER A 1 34 ? 34.488 39.300 89.271 1.00 64.68 ? 34 SER A CB 1 +ATOM 260 O OG . SER A 1 34 ? 34.955 38.428 90.283 1.00 64.60 ? 34 SER A OG 1 +ATOM 261 N N . ASN A 1 35 ? 37.514 39.442 89.941 1.00 62.49 ? 35 ASN A N 1 +ATOM 262 C CA . ASN A 1 35 ? 38.823 38.807 89.941 1.00 62.03 ? 35 ASN A CA 1 +ATOM 263 C C . ASN A 1 35 ? 38.594 37.306 89.965 1.00 62.10 ? 35 ASN A C 1 +ATOM 264 O O . ASN A 1 35 ? 39.474 36.520 89.610 1.00 62.07 ? 35 ASN A O 1 +ATOM 265 C CB . ASN A 1 35 ? 39.611 39.207 91.189 1.00 59.65 ? 35 ASN A CB 1 +ATOM 266 C CG . ASN A 1 35 ? 39.008 38.643 92.461 1.00 58.12 ? 35 ASN A CG 1 +ATOM 267 O OD1 . ASN A 1 35 ? 37.958 39.098 92.924 1.00 57.90 ? 35 ASN A OD1 1 +ATOM 268 N ND2 . ASN A 1 35 ? 39.664 37.637 93.029 1.00 55.87 ? 35 ASN A ND2 1 +ATOM 269 N N . LYS A 1 36 ? 37.395 36.932 90.399 1.00 63.19 ? 36 LYS A N 1 +ATOM 270 C CA . LYS A 1 36 ? 36.977 35.542 90.514 1.00 64.88 ? 36 LYS A CA 1 +ATOM 271 C C . LYS A 1 36 ? 36.972 34.836 89.160 1.00 64.89 ? 36 LYS A C 1 +ATOM 272 O O . LYS A 1 36 ? 36.543 35.394 88.147 1.00 63.77 ? 36 LYS A O 1 +ATOM 273 C CB . LYS A 1 36 ? 35.575 35.483 91.126 1.00 66.91 ? 36 LYS A CB 1 +ATOM 274 C CG . LYS A 1 36 ? 35.254 34.208 91.883 1.00 69.52 ? 36 LYS A CG 1 +ATOM 275 C CD . LYS A 1 36 ? 35.786 34.270 93.308 1.00 71.88 ? 36 LYS A CD 1 +ATOM 276 C CE . LYS A 1 36 ? 35.327 33.066 94.121 1.00 73.35 ? 36 LYS A CE 1 +ATOM 277 N NZ . LYS A 1 36 ? 35.827 33.117 95.525 1.00 74.22 ? 36 LYS A NZ 1 +ATOM 278 N N . SER A 1 37 ? 37.458 33.601 89.156 1.00 66.02 ? 37 SER A N 1 +ATOM 279 C CA . SER A 1 37 ? 37.508 32.792 87.943 1.00 66.39 ? 37 SER A CA 1 +ATOM 280 C C . SER A 1 37 ? 36.483 31.667 88.062 1.00 65.57 ? 37 SER A C 1 +ATOM 281 O O . SER A 1 37 ? 35.914 31.448 89.132 1.00 65.36 ? 37 SER A O 1 +ATOM 282 C CB . SER A 1 37 ? 38.903 32.178 87.763 1.00 66.27 ? 37 SER A CB 1 +ATOM 283 O OG . SER A 1 37 ? 39.100 31.079 88.641 1.00 66.06 ? 37 SER A OG 1 +ATOM 284 N N . LEU A 1 38 ? 36.248 30.963 86.961 1.00 65.00 ? 38 LEU A N 1 +ATOM 285 C CA . LEU A 1 38 ? 35.311 29.850 86.961 1.00 64.78 ? 38 LEU A CA 1 +ATOM 286 C C . LEU A 1 38 ? 35.757 28.840 88.008 1.00 64.48 ? 38 LEU A C 1 +ATOM 287 O O . LEU A 1 38 ? 34.963 28.395 88.838 1.00 64.85 ? 38 LEU A O 1 +ATOM 288 C CB . LEU A 1 38 ? 35.286 29.176 85.586 1.00 65.27 ? 38 LEU A CB 1 +ATOM 289 C CG . LEU A 1 38 ? 34.345 29.725 84.512 1.00 65.53 ? 38 LEU A CG 1 +ATOM 290 C CD1 . LEU A 1 38 ? 34.359 31.241 84.511 1.00 65.97 ? 38 LEU A CD1 1 +ATOM 291 C CD2 . LEU A 1 38 ? 34.770 29.169 83.161 1.00 65.16 ? 38 LEU A CD2 1 +ATOM 292 N N . SER A 1 39 ? 37.040 28.492 87.961 1.00 63.50 ? 39 SER A N 1 +ATOM 293 C CA . SER A 1 39 ? 37.626 27.526 88.882 1.00 62.25 ? 39 SER A CA 1 +ATOM 294 C C . SER A 1 39 ? 37.380 27.893 90.347 1.00 61.11 ? 39 SER A C 1 +ATOM 295 O O . SER A 1 39 ? 37.109 27.016 91.169 1.00 60.47 ? 39 SER A O 1 +ATOM 296 C CB . SER A 1 39 ? 39.130 27.407 88.611 1.00 62.16 ? 39 SER A CB 1 +ATOM 297 O OG . SER A 1 39 ? 39.658 26.235 89.200 1.00 63.07 ? 39 SER A OG 1 +ATOM 298 N N . GLU A 1 40 ? 37.478 29.187 90.662 1.00 60.22 ? 40 GLU A N 1 +ATOM 299 C CA . GLU A 1 40 ? 37.251 29.697 92.020 1.00 59.56 ? 40 GLU A CA 1 +ATOM 300 C C . GLU A 1 40 ? 35.758 29.628 92.389 1.00 58.05 ? 40 GLU A C 1 +ATOM 301 O O . GLU A 1 40 ? 35.393 29.214 93.492 1.00 58.35 ? 40 GLU A O 1 +ATOM 302 C CB . GLU A 1 40 ? 37.732 31.145 92.121 1.00 61.23 ? 40 GLU A CB 1 +ATOM 303 C CG . GLU A 1 40 ? 39.241 31.335 92.054 1.00 62.02 ? 40 GLU A CG 1 +ATOM 304 C CD . GLU A 1 40 ? 39.612 32.803 91.920 1.00 63.20 ? 40 GLU A CD 1 +ATOM 305 O OE1 . GLU A 1 40 ? 39.033 33.627 92.671 1.00 63.17 ? 40 GLU A OE1 1 +ATOM 306 O OE2 . GLU A 1 40 ? 40.474 33.132 91.068 1.00 61.60 ? 40 GLU A OE2 1 +ATOM 307 N N . LEU A 1 41 ? 34.912 30.074 91.463 1.00 55.82 ? 41 LEU A N 1 +ATOM 308 C CA . LEU A 1 41 ? 33.454 30.041 91.597 1.00 53.89 ? 41 LEU A CA 1 +ATOM 309 C C . LEU A 1 41 ? 33.000 28.574 91.590 1.00 53.18 ? 41 LEU A C 1 +ATOM 310 O O . LEU A 1 41 ? 31.820 28.272 91.772 1.00 52.68 ? 41 LEU A O 1 +ATOM 311 C CB . LEU A 1 41 ? 32.830 30.785 90.413 1.00 52.11 ? 41 LEU A CB 1 +ATOM 312 C CG . LEU A 1 41 ? 31.880 31.953 90.670 1.00 50.55 ? 41 LEU A CG 1 +ATOM 313 C CD1 . LEU A 1 41 ? 32.268 32.698 91.924 1.00 50.97 ? 41 LEU A CD1 1 +ATOM 314 C CD2 . LEU A 1 41 ? 31.904 32.872 89.467 1.00 49.18 ? 41 LEU A CD2 1 +ATOM 315 N N . GLY A 1 42 ? 33.957 27.674 91.366 1.00 53.30 ? 42 GLY A N 1 +ATOM 316 C CA . GLY A 1 42 ? 33.680 26.246 91.341 1.00 52.01 ? 42 GLY A CA 1 +ATOM 317 C C . GLY A 1 42 ? 32.921 25.778 90.111 1.00 52.26 ? 42 GLY A C 1 +ATOM 318 O O . GLY A 1 42 ? 32.186 24.786 90.165 1.00 52.90 ? 42 GLY A O 1 +ATOM 319 N N . LEU A 1 43 ? 33.105 26.480 88.997 1.00 50.58 ? 43 LEU A N 1 +ATOM 320 C CA . LEU A 1 43 ? 32.423 26.134 87.761 1.00 49.72 ? 43 LEU A CA 1 +ATOM 321 C C . LEU A 1 43 ? 33.373 25.765 86.634 1.00 51.06 ? 43 LEU A C 1 +ATOM 322 O O . LEU A 1 43 ? 34.513 26.216 86.580 1.00 52.90 ? 43 LEU A O 1 +ATOM 323 C CB . LEU A 1 43 ? 31.551 27.300 87.297 1.00 47.25 ? 43 LEU A CB 1 +ATOM 324 C CG . LEU A 1 43 ? 30.510 27.791 88.295 1.00 47.11 ? 43 LEU A CG 1 +ATOM 325 C CD1 . LEU A 1 43 ? 29.818 29.012 87.727 1.00 45.78 ? 43 LEU A CD1 1 +ATOM 326 C CD2 . LEU A 1 43 ? 29.517 26.678 88.591 1.00 45.56 ? 43 LEU A CD2 1 +ATOM 327 N N . THR A 1 44 ? 32.879 24.929 85.733 1.00 51.96 ? 44 THR A N 1 +ATOM 328 C CA . THR A 1 44 ? 33.623 24.499 84.561 1.00 52.23 ? 44 THR A CA 1 +ATOM 329 C C . THR A 1 44 ? 32.687 24.820 83.409 1.00 53.36 ? 44 THR A C 1 +ATOM 330 O O . THR A 1 44 ? 31.481 24.581 83.502 1.00 52.53 ? 44 THR A O 1 +ATOM 331 C CB . THR A 1 44 ? 33.886 22.989 84.579 1.00 53.53 ? 44 THR A CB 1 +ATOM 332 O OG1 . THR A 1 44 ? 34.825 22.679 85.620 1.00 54.12 ? 44 THR A OG1 1 +ATOM 333 C CG2 . THR A 1 44 ? 34.434 22.526 83.231 1.00 52.02 ? 44 THR A CG2 1 +ATOM 334 N N . ILE A 1 45 ? 33.227 25.369 82.330 1.00 53.85 ? 45 ILE A N 1 +ATOM 335 C CA . ILE A 1 45 ? 32.389 25.725 81.201 1.00 54.09 ? 45 ILE A CA 1 +ATOM 336 C C . ILE A 1 45 ? 32.958 25.216 79.892 1.00 55.02 ? 45 ILE A C 1 +ATOM 337 O O . ILE A 1 45 ? 34.161 25.250 79.665 1.00 55.41 ? 45 ILE A O 1 +ATOM 338 C CB . ILE A 1 45 ? 32.195 27.246 81.140 1.00 53.91 ? 45 ILE A CB 1 +ATOM 339 C CG1 . ILE A 1 45 ? 31.487 27.709 82.419 1.00 54.41 ? 45 ILE A CG1 1 +ATOM 340 C CG2 . ILE A 1 45 ? 31.397 27.632 79.901 1.00 53.99 ? 45 ILE A CG2 1 +ATOM 341 C CD1 . ILE A 1 45 ? 31.228 29.203 82.482 1.00 54.64 ? 45 ILE A CD1 1 +ATOM 342 N N . VAL A 1 46 ? 32.068 24.727 79.037 1.00 57.00 ? 46 VAL A N 1 +ATOM 343 C CA . VAL A 1 46 ? 32.449 24.193 77.737 1.00 57.81 ? 46 VAL A CA 1 +ATOM 344 C C . VAL A 1 46 ? 31.513 24.702 76.648 1.00 59.20 ? 46 VAL A C 1 +ATOM 345 O O . VAL A 1 46 ? 30.299 24.760 76.838 1.00 59.40 ? 46 VAL A O 1 +ATOM 346 C CB . VAL A 1 46 ? 32.403 22.650 77.739 1.00 56.92 ? 46 VAL A CB 1 +ATOM 347 C CG1 . VAL A 1 46 ? 32.673 22.118 76.344 1.00 56.00 ? 46 VAL A CG1 1 +ATOM 348 C CG2 . VAL A 1 46 ? 33.420 22.106 78.725 1.00 56.52 ? 46 VAL A CG2 1 +ATOM 349 N N . GLN A 1 47 ? 32.089 25.084 75.514 1.00 61.62 ? 47 GLN A N 1 +ATOM 350 C CA . GLN A 1 47 ? 31.316 25.568 74.381 1.00 64.14 ? 47 GLN A CA 1 +ATOM 351 C C . GLN A 1 47 ? 31.509 24.597 73.235 1.00 65.93 ? 47 GLN A C 1 +ATOM 352 O O . GLN A 1 47 ? 32.634 24.348 72.813 1.00 66.97 ? 47 GLN A O 1 +ATOM 353 C CB . GLN A 1 47 ? 31.784 26.956 73.956 1.00 65.01 ? 47 GLN A CB 1 +ATOM 354 C CG . GLN A 1 47 ? 31.188 28.087 74.768 1.00 67.26 ? 47 GLN A CG 1 +ATOM 355 C CD . GLN A 1 47 ? 31.640 29.453 74.276 1.00 68.83 ? 47 GLN A CD 1 +ATOM 356 O OE1 . GLN A 1 47 ? 32.790 29.850 74.479 1.00 69.85 ? 47 GLN A OE1 1 +ATOM 357 N NE2 . GLN A 1 47 ? 30.738 30.174 73.616 1.00 68.94 ? 47 GLN A NE2 1 +ATOM 358 N N . GLN A 1 48 ? 30.412 24.039 72.738 1.00 67.92 ? 48 GLN A N 1 +ATOM 359 C CA . GLN A 1 48 ? 30.484 23.085 71.643 1.00 69.18 ? 48 GLN A CA 1 +ATOM 360 C C . GLN A 1 48 ? 29.544 23.440 70.500 1.00 69.42 ? 48 GLN A C 1 +ATOM 361 O O . GLN A 1 48 ? 29.309 24.618 70.209 1.00 69.35 ? 48 GLN A O 1 +ATOM 362 C CB . GLN A 1 48 ? 30.161 21.680 72.151 1.00 70.42 ? 48 GLN A CB 1 +ATOM 363 C CG . GLN A 1 48 ? 31.191 21.123 73.109 1.00 72.85 ? 48 GLN A CG 1 +ATOM 364 C CD . GLN A 1 48 ? 30.812 19.750 73.635 1.00 74.46 ? 48 GLN A CD 1 +ATOM 365 O OE1 . GLN A 1 48 ? 31.557 19.141 74.404 1.00 75.54 ? 48 GLN A OE1 1 +ATOM 366 N NE2 . GLN A 1 48 ? 29.646 19.258 73.226 1.00 75.21 ? 48 GLN A NE2 1 +ATOM 367 N N . GLY A 1 49 ? 29.015 22.406 69.854 1.00 69.15 ? 49 GLY A N 1 +ATOM 368 C CA . GLY A 1 49 ? 28.110 22.609 68.741 1.00 68.76 ? 49 GLY A CA 1 +ATOM 369 C C . GLY A 1 49 ? 26.889 23.413 69.128 1.00 67.98 ? 49 GLY A C 1 +ATOM 370 O O . GLY A 1 49 ? 25.829 22.845 69.390 1.00 69.22 ? 49 GLY A O 1 +ATOM 371 N N . ASN A 1 50 ? 27.035 24.735 69.166 1.00 65.92 ? 50 ASN A N 1 +ATOM 372 C CA . ASN A 1 50 ? 25.930 25.615 69.519 1.00 64.06 ? 50 ASN A CA 1 +ATOM 373 C C . ASN A 1 50 ? 25.334 25.300 70.882 1.00 61.57 ? 50 ASN A C 1 +ATOM 374 O O . ASN A 1 50 ? 24.133 25.472 71.093 1.00 61.01 ? 50 ASN A O 1 +ATOM 375 C CB . ASN A 1 50 ? 24.830 25.539 68.460 1.00 66.01 ? 50 ASN A CB 1 +ATOM 376 C CG . ASN A 1 50 ? 25.207 26.251 67.177 1.00 67.84 ? 50 ASN A CG 1 +ATOM 377 O OD1 . ASN A 1 50 ? 25.372 27.475 67.156 1.00 68.10 ? 50 ASN A OD1 1 +ATOM 378 N ND2 . ASN A 1 50 ? 25.347 25.488 66.098 1.00 69.14 ? 50 ASN A ND2 1 +ATOM 379 N N . LYS A 1 51 ? 26.170 24.829 71.801 1.00 58.74 ? 51 LYS A N 1 +ATOM 380 C CA . LYS A 1 51 ? 25.718 24.522 73.152 1.00 55.26 ? 51 LYS A CA 1 +ATOM 381 C C . LYS A 1 51 ? 26.741 24.959 74.192 1.00 52.32 ? 51 LYS A C 1 +ATOM 382 O O . LYS A 1 51 ? 27.942 25.017 73.923 1.00 50.86 ? 51 LYS A O 1 +ATOM 383 C CB . LYS A 1 51 ? 25.448 23.026 73.306 1.00 56.28 ? 51 LYS A CB 1 +ATOM 384 C CG . LYS A 1 51 ? 24.314 22.514 72.429 1.00 59.33 ? 51 LYS A CG 1 +ATOM 385 C CD . LYS A 1 51 ? 23.880 21.093 72.798 1.00 61.35 ? 51 LYS A CD 1 +ATOM 386 C CE . LYS A 1 51 ? 24.987 20.071 72.562 1.00 63.11 ? 51 LYS A CE 1 +ATOM 387 N NZ . LYS A 1 51 ? 26.166 20.284 73.454 1.00 64.93 ? 51 LYS A NZ 1 +ATOM 388 N N . VAL A 1 52 ? 26.249 25.284 75.379 1.00 49.29 ? 52 VAL A N 1 +ATOM 389 C CA . VAL A 1 52 ? 27.108 25.685 76.477 1.00 46.30 ? 52 VAL A CA 1 +ATOM 390 C C . VAL A 1 52 ? 26.819 24.738 77.628 1.00 45.00 ? 52 VAL A C 1 +ATOM 391 O O . VAL A 1 52 ? 25.671 24.575 78.033 1.00 46.01 ? 52 VAL A O 1 +ATOM 392 C CB . VAL A 1 52 ? 26.827 27.136 76.925 1.00 45.27 ? 52 VAL A CB 1 +ATOM 393 C CG1 . VAL A 1 52 ? 27.649 27.463 78.165 1.00 44.04 ? 52 VAL A CG1 1 +ATOM 394 C CG2 . VAL A 1 52 ? 27.170 28.098 75.801 1.00 44.71 ? 52 VAL A CG2 1 +ATOM 395 N N . ILE A 1 53 ? 27.857 24.092 78.137 1.00 43.57 ? 53 ILE A N 1 +ATOM 396 C CA . ILE A 1 53 ? 27.696 23.168 79.248 1.00 43.13 ? 53 ILE A CA 1 +ATOM 397 C C . ILE A 1 53 ? 28.398 23.742 80.476 1.00 44.28 ? 53 ILE A C 1 +ATOM 398 O O . ILE A 1 53 ? 29.592 24.050 80.427 1.00 45.65 ? 53 ILE A O 1 +ATOM 399 C CB . ILE A 1 53 ? 28.306 21.808 78.911 1.00 42.30 ? 53 ILE A CB 1 +ATOM 400 C CG1 . ILE A 1 53 ? 27.685 21.279 77.619 1.00 42.08 ? 53 ILE A CG1 1 +ATOM 401 C CG2 . ILE A 1 53 ? 28.073 20.829 80.048 1.00 40.16 ? 53 ILE A CG2 1 +ATOM 402 C CD1 . ILE A 1 53 ? 28.334 20.009 77.110 1.00 43.54 ? 53 ILE A CD1 1 +ATOM 403 N N . VAL A 1 54 ? 27.655 23.898 81.566 1.00 44.13 ? 54 VAL A N 1 +ATOM 404 C CA . VAL A 1 54 ? 28.212 24.436 82.800 1.00 43.78 ? 54 VAL A CA 1 +ATOM 405 C C . VAL A 1 54 ? 28.168 23.353 83.870 1.00 45.02 ? 54 VAL A C 1 +ATOM 406 O O . VAL A 1 54 ? 27.103 22.815 84.174 1.00 46.11 ? 54 VAL A O 1 +ATOM 407 C CB . VAL A 1 54 ? 27.418 25.660 83.272 1.00 42.38 ? 54 VAL A CB 1 +ATOM 408 C CG1 . VAL A 1 54 ? 27.986 26.173 84.571 1.00 41.71 ? 54 VAL A CG1 1 +ATOM 409 C CG2 . VAL A 1 54 ? 27.463 26.744 82.204 1.00 40.47 ? 54 VAL A CG2 1 +ATOM 410 N N . GLU A 1 55 ? 29.330 23.028 84.429 1.00 45.62 ? 55 GLU A N 1 +ATOM 411 C CA . GLU A 1 55 ? 29.431 21.997 85.459 1.00 45.80 ? 55 GLU A CA 1 +ATOM 412 C C . GLU A 1 55 ? 29.812 22.525 86.833 1.00 44.67 ? 55 GLU A C 1 +ATOM 413 O O . GLU A 1 55 ? 30.549 23.502 86.966 1.00 45.46 ? 55 GLU A O 1 +ATOM 414 C CB . GLU A 1 55 ? 30.451 20.939 85.050 1.00 47.41 ? 55 GLU A CB 1 +ATOM 415 C CG . GLU A 1 55 ? 29.965 19.990 83.992 1.00 53.64 ? 55 GLU A CG 1 +ATOM 416 C CD . GLU A 1 55 ? 31.034 18.987 83.585 1.00 58.52 ? 55 GLU A CD 1 +ATOM 417 O OE1 . GLU A 1 55 ? 31.770 18.497 84.481 1.00 59.77 ? 55 GLU A OE1 1 +ATOM 418 O OE2 . GLU A 1 55 ? 31.126 18.684 82.369 1.00 60.10 ? 55 GLU A OE2 1 +ATOM 419 N N . LYS A 1 56 ? 29.311 21.842 87.851 1.00 43.40 ? 56 LYS A N 1 +ATOM 420 C CA . LYS A 1 56 ? 29.569 22.181 89.238 1.00 42.74 ? 56 LYS A CA 1 +ATOM 421 C C . LYS A 1 56 ? 29.632 20.836 89.937 1.00 43.80 ? 56 LYS A C 1 +ATOM 422 O O . LYS A 1 56 ? 28.956 19.893 89.524 1.00 44.24 ? 56 LYS A O 1 +ATOM 423 C CB . LYS A 1 56 ? 28.410 22.991 89.809 1.00 42.82 ? 56 LYS A CB 1 +ATOM 424 C CG . LYS A 1 56 ? 28.731 23.701 91.105 1.00 43.66 ? 56 LYS A CG 1 +ATOM 425 C CD . LYS A 1 56 ? 27.495 24.366 91.693 1.00 43.20 ? 56 LYS A CD 1 +ATOM 426 C CE . LYS A 1 56 ? 26.761 23.407 92.602 1.00 44.82 ? 56 LYS A CE 1 +ATOM 427 N NZ . LYS A 1 56 ? 27.635 23.002 93.748 1.00 45.96 ? 56 LYS A NZ 1 +ATOM 428 N N . SER A 1 57 ? 30.435 20.724 90.986 1.00 43.84 ? 57 SER A N 1 +ATOM 429 C CA . SER A 1 57 ? 30.516 19.451 91.678 1.00 45.00 ? 57 SER A CA 1 +ATOM 430 C C . SER A 1 57 ? 29.283 19.346 92.563 1.00 44.66 ? 57 SER A C 1 +ATOM 431 O O . SER A 1 57 ? 28.606 20.341 92.822 1.00 45.23 ? 57 SER A O 1 +ATOM 432 C CB . SER A 1 57 ? 31.779 19.380 92.534 1.00 46.46 ? 57 SER A CB 1 +ATOM 433 O OG . SER A 1 57 ? 31.669 20.256 93.650 1.00 51.10 ? 57 SER A OG 1 +ATOM 434 N N . LEU A 1 58 ? 28.995 18.136 93.021 1.00 44.82 ? 58 LEU A N 1 +ATOM 435 C CA . LEU A 1 58 ? 27.846 17.897 93.881 1.00 45.62 ? 58 LEU A CA 1 +ATOM 436 C C . LEU A 1 58 ? 28.271 16.930 94.972 1.00 47.20 ? 58 LEU A C 1 +ATOM 437 O O . LEU A 1 58 ? 28.621 15.784 94.678 1.00 49.40 ? 58 LEU A O 1 +ATOM 438 C CB . LEU A 1 58 ? 26.702 17.288 93.065 1.00 43.43 ? 58 LEU A CB 1 +ATOM 439 C CG . LEU A 1 58 ? 25.395 17.002 93.803 1.00 42.36 ? 58 LEU A CG 1 +ATOM 440 C CD1 . LEU A 1 58 ? 24.708 18.320 94.143 1.00 40.51 ? 58 LEU A CD1 1 +ATOM 441 C CD2 . LEU A 1 58 ? 24.499 16.130 92.929 1.00 41.86 ? 58 LEU A CD2 1 +ATOM 442 N N . ASP A 1 59 ? 28.255 17.385 96.222 1.00 48.29 ? 59 ASP A N 1 +ATOM 443 C CA . ASP A 1 59 ? 28.651 16.531 97.339 1.00 49.90 ? 59 ASP A CA 1 +ATOM 444 C C . ASP A 1 59 ? 27.487 15.687 97.832 1.00 50.12 ? 59 ASP A C 1 +ATOM 445 O O . ASP A 1 59 ? 26.325 16.032 97.604 1.00 50.59 ? 59 ASP A O 1 +ATOM 446 C CB . ASP A 1 59 ? 29.188 17.379 98.492 1.00 53.23 ? 59 ASP A CB 1 +ATOM 447 C CG . ASP A 1 59 ? 30.394 18.208 98.089 1.00 59.01 ? 59 ASP A CG 1 +ATOM 448 O OD1 . ASP A 1 59 ? 31.296 17.663 97.411 1.00 61.31 ? 59 ASP A OD1 1 +ATOM 449 O OD2 . ASP A 1 59 ? 30.447 19.404 98.454 1.00 62.74 ? 59 ASP A OD2 1 +ATOM 450 N N . LEU A 1 60 ? 27.803 14.589 98.515 1.00 49.46 ? 60 LEU A N 1 +ATOM 451 C CA . LEU A 1 60 ? 26.783 13.691 99.042 1.00 49.68 ? 60 LEU A CA 1 +ATOM 452 C C . LEU A 1 60 ? 25.728 14.386 99.897 1.00 50.49 ? 60 LEU A C 1 +ATOM 453 O O . LEU A 1 60 ? 24.535 14.106 99.767 1.00 50.13 ? 60 LEU A O 1 +ATOM 454 C CB . LEU A 1 60 ? 27.428 12.584 99.876 1.00 50.43 ? 60 LEU A CB 1 +ATOM 455 C CG . LEU A 1 60 ? 28.144 11.463 99.135 1.00 51.25 ? 60 LEU A CG 1 +ATOM 456 C CD1 . LEU A 1 60 ? 28.701 10.472 100.153 1.00 52.08 ? 60 LEU A CD1 1 +ATOM 457 C CD2 . LEU A 1 60 ? 27.173 10.772 98.193 1.00 49.72 ? 60 LEU A CD2 1 +ATOM 458 N N . LYS A 1 61 ? 26.169 15.281 100.775 1.00 50.26 ? 61 LYS A N 1 +ATOM 459 C CA . LYS A 1 61 ? 25.255 15.991 101.665 1.00 51.86 ? 61 LYS A CA 1 +ATOM 460 C C . LYS A 1 61 ? 24.696 17.293 101.083 1.00 50.65 ? 61 LYS A C 1 +ATOM 461 O O . LYS A 1 61 ? 23.888 17.966 101.722 1.00 51.90 ? 61 LYS A O 1 +ATOM 462 C CB . LYS A 1 61 ? 25.960 16.296 102.994 1.00 54.74 ? 61 LYS A CB 1 +ATOM 463 C CG . LYS A 1 61 ? 26.355 15.070 103.819 1.00 57.53 ? 61 LYS A CG 1 +ATOM 464 C CD . LYS A 1 61 ? 25.153 14.437 104.503 1.00 60.86 ? 61 LYS A CD 1 +ATOM 465 C CE . LYS A 1 61 ? 25.598 13.465 105.586 1.00 63.95 ? 61 LYS A CE 1 +ATOM 466 N NZ . LYS A 1 61 ? 24.449 12.873 106.344 1.00 67.19 ? 61 LYS A NZ 1 +ATOM 467 N N . GLU A 1 62 ? 25.119 17.644 99.875 1.00 48.76 ? 62 GLU A N 1 +ATOM 468 C CA . GLU A 1 62 ? 24.660 18.876 99.229 1.00 46.99 ? 62 GLU A CA 1 +ATOM 469 C C . GLU A 1 62 ? 23.192 18.809 98.782 1.00 46.17 ? 62 GLU A C 1 +ATOM 470 O O . GLU A 1 62 ? 22.742 17.801 98.241 1.00 46.26 ? 62 GLU A O 1 +ATOM 471 C CB . GLU A 1 62 ? 25.558 19.168 98.027 1.00 47.46 ? 62 GLU A CB 1 +ATOM 472 C CG . GLU A 1 62 ? 25.290 20.483 97.334 1.00 47.97 ? 62 GLU A CG 1 +ATOM 473 C CD . GLU A 1 62 ? 26.374 20.825 96.331 1.00 49.77 ? 62 GLU A CD 1 +ATOM 474 O OE1 . GLU A 1 62 ? 27.367 20.057 96.222 1.00 49.45 ? 62 GLU A OE1 1 +ATOM 475 O OE2 . GLU A 1 62 ? 26.237 21.868 95.655 1.00 50.88 ? 62 GLU A OE2 1 +ATOM 476 N N . HIS A 1 63 ? 22.447 19.886 99.007 1.00 44.92 ? 63 HIS A N 1 +ATOM 477 C CA . HIS A 1 63 ? 21.037 19.932 98.621 1.00 42.81 ? 63 HIS A CA 1 +ATOM 478 C C . HIS A 1 63 ? 20.856 20.841 97.416 1.00 41.87 ? 63 HIS A C 1 +ATOM 479 O O . HIS A 1 63 ? 21.521 21.866 97.298 1.00 43.40 ? 63 HIS A O 1 +ATOM 480 C CB . HIS A 1 63 ? 20.168 20.467 99.768 1.00 41.83 ? 63 HIS A CB 1 +ATOM 481 C CG . HIS A 1 63 ? 20.345 19.733 101.057 1.00 42.50 ? 63 HIS A CG 1 +ATOM 482 N ND1 . HIS A 1 63 ? 19.975 18.414 101.222 1.00 43.30 ? 63 HIS A ND1 1 +ATOM 483 C CD2 . HIS A 1 63 ? 20.890 20.122 102.234 1.00 42.36 ? 63 HIS A CD2 1 +ATOM 484 C CE1 . HIS A 1 63 ? 20.287 18.021 102.444 1.00 41.96 ? 63 HIS A CE1 1 +ATOM 485 N NE2 . HIS A 1 63 ? 20.844 19.037 103.078 1.00 43.76 ? 63 HIS A NE2 1 +ATOM 486 N N . ILE A 1 64 ? 19.953 20.453 96.523 1.00 40.21 ? 64 ILE A N 1 +ATOM 487 C CA . ILE A 1 64 ? 19.655 21.238 95.331 1.00 36.99 ? 64 ILE A CA 1 +ATOM 488 C C . ILE A 1 64 ? 18.150 21.474 95.346 1.00 36.62 ? 64 ILE A C 1 +ATOM 489 O O . ILE A 1 64 ? 17.359 20.530 95.377 1.00 36.02 ? 64 ILE A O 1 +ATOM 490 C CB . ILE A 1 64 ? 20.038 20.487 94.043 1.00 36.23 ? 64 ILE A CB 1 +ATOM 491 C CG1 . ILE A 1 64 ? 21.533 20.128 94.065 1.00 35.22 ? 64 ILE A CG1 1 +ATOM 492 C CG2 . ILE A 1 64 ? 19.712 21.350 92.823 1.00 34.07 ? 64 ILE A CG2 1 +ATOM 493 C CD1 . ILE A 1 64 ? 22.479 21.316 94.048 1.00 33.20 ? 64 ILE A CD1 1 +ATOM 494 N N . ILE A 1 65 ? 17.758 22.738 95.342 1.00 35.70 ? 65 ILE A N 1 +ATOM 495 C CA . ILE A 1 65 ? 16.352 23.088 95.381 1.00 34.79 ? 65 ILE A CA 1 +ATOM 496 C C . ILE A 1 65 ? 16.042 24.087 94.282 1.00 36.03 ? 65 ILE A C 1 +ATOM 497 O O . ILE A 1 65 ? 16.959 24.652 93.674 1.00 36.35 ? 65 ILE A O 1 +ATOM 498 C CB . ILE A 1 65 ? 15.984 23.697 96.745 1.00 35.00 ? 65 ILE A CB 1 +ATOM 499 C CG1 . ILE A 1 65 ? 16.768 24.996 96.969 1.00 34.91 ? 65 ILE A CG1 1 +ATOM 500 C CG2 . ILE A 1 65 ? 16.290 22.695 97.850 1.00 34.65 ? 65 ILE A CG2 1 +ATOM 501 C CD1 . ILE A 1 65 ? 16.544 25.625 98.321 1.00 34.23 ? 65 ILE A CD1 1 +ATOM 502 N N . GLY A 1 66 ? 14.752 24.294 94.017 1.00 35.46 ? 66 GLY A N 1 +ATOM 503 C CA . GLY A 1 66 ? 14.362 25.231 92.984 1.00 35.40 ? 66 GLY A CA 1 +ATOM 504 C C . GLY A 1 66 ? 13.842 24.575 91.716 1.00 36.67 ? 66 GLY A C 1 +ATOM 505 O O . GLY A 1 66 ? 13.175 23.536 91.759 1.00 36.62 ? 66 GLY A O 1 +ATOM 506 N N . LEU A 1 67 ? 14.155 25.197 90.584 1.00 36.11 ? 67 LEU A N 1 +ATOM 507 C CA . LEU A 1 67 ? 13.731 24.736 89.269 1.00 36.87 ? 67 LEU A CA 1 +ATOM 508 C C . LEU A 1 67 ? 12.235 24.937 89.062 1.00 37.48 ? 67 LEU A C 1 +ATOM 509 O O . LEU A 1 67 ? 11.650 24.424 88.111 1.00 40.31 ? 67 LEU A O 1 +ATOM 510 C CB . LEU A 1 67 ? 14.111 23.273 89.048 1.00 35.17 ? 67 LEU A CB 1 +ATOM 511 C CG . LEU A 1 67 ? 15.615 23.007 89.054 1.00 36.12 ? 67 LEU A CG 1 +ATOM 512 C CD1 . LEU A 1 67 ? 15.867 21.571 88.656 1.00 36.75 ? 67 LEU A CD1 1 +ATOM 513 C CD2 . LEU A 1 67 ? 16.321 23.952 88.098 1.00 36.72 ? 67 LEU A CD2 1 +ATOM 514 N N . GLY A 1 68 ? 11.620 25.684 89.968 1.00 37.00 ? 68 GLY A N 1 +ATOM 515 C CA . GLY A 1 68 ? 10.207 25.990 89.849 1.00 36.77 ? 68 GLY A CA 1 +ATOM 516 C C . GLY A 1 68 ? 9.189 24.873 89.966 1.00 36.54 ? 68 GLY A C 1 +ATOM 517 O O . GLY A 1 68 ? 9.220 24.062 90.882 1.00 36.62 ? 68 GLY A O 1 +ATOM 518 N N . GLU A 1 69 ? 8.272 24.849 89.011 1.00 36.81 ? 69 GLU A N 1 +ATOM 519 C CA . GLU A 1 69 ? 7.191 23.880 88.982 1.00 37.71 ? 69 GLU A CA 1 +ATOM 520 C C . GLU A 1 69 ? 7.621 22.476 88.530 1.00 37.02 ? 69 GLU A C 1 +ATOM 521 O O . GLU A 1 69 ? 7.592 22.167 87.346 1.00 37.60 ? 69 GLU A O 1 +ATOM 522 C CB . GLU A 1 69 ? 6.098 24.424 88.062 1.00 38.59 ? 69 GLU A CB 1 +ATOM 523 C CG . GLU A 1 69 ? 4.740 23.782 88.195 1.00 40.87 ? 69 GLU A CG 1 +ATOM 524 C CD . GLU A 1 69 ? 3.738 24.418 87.255 1.00 43.28 ? 69 GLU A CD 1 +ATOM 525 O OE1 . GLU A 1 69 ? 3.871 24.240 86.022 1.00 45.72 ? 69 GLU A OE1 1 +ATOM 526 O OE2 . GLU A 1 69 ? 2.824 25.114 87.743 1.00 44.10 ? 69 GLU A OE2 1 +ATOM 527 N N . LYS A 1 70 ? 8.001 21.623 89.478 1.00 35.34 ? 70 LYS A N 1 +ATOM 528 C CA . LYS A 1 70 ? 8.428 20.269 89.147 1.00 33.52 ? 70 LYS A CA 1 +ATOM 529 C C . LYS A 1 70 ? 7.628 19.224 89.920 1.00 32.78 ? 70 LYS A C 1 +ATOM 530 O O . LYS A 1 70 ? 7.438 19.334 91.134 1.00 31.29 ? 70 LYS A O 1 +ATOM 531 C CB . LYS A 1 70 ? 9.920 20.091 89.439 1.00 32.57 ? 70 LYS A CB 1 +ATOM 532 C CG . LYS A 1 70 ? 10.827 20.949 88.577 1.00 34.07 ? 70 LYS A CG 1 +ATOM 533 C CD . LYS A 1 70 ? 10.593 20.672 87.104 1.00 34.32 ? 70 LYS A CD 1 +ATOM 534 C CE . LYS A 1 70 ? 11.480 21.527 86.224 1.00 34.56 ? 70 LYS A CE 1 +ATOM 535 N NZ . LYS A 1 70 ? 11.130 21.345 84.783 1.00 36.92 ? 70 LYS A NZ 1 +ATOM 536 N N . ALA A 1 71 ? 7.160 18.204 89.210 1.00 31.41 ? 71 ALA A N 1 +ATOM 537 C CA . ALA A 1 71 ? 6.386 17.148 89.839 1.00 32.15 ? 71 ALA A CA 1 +ATOM 538 C C . ALA A 1 71 ? 7.332 16.162 90.541 1.00 32.16 ? 71 ALA A C 1 +ATOM 539 O O . ALA A 1 71 ? 7.236 14.949 90.350 1.00 31.49 ? 71 ALA A O 1 +ATOM 540 C CB . ALA A 1 71 ? 5.553 16.432 88.788 1.00 30.77 ? 71 ALA A CB 1 +ATOM 541 N N . PHE A 1 72 ? 8.242 16.696 91.353 1.00 32.09 ? 72 PHE A N 1 +ATOM 542 C CA . PHE A 1 72 ? 9.228 15.880 92.061 1.00 31.86 ? 72 PHE A CA 1 +ATOM 543 C C . PHE A 1 72 ? 9.494 16.376 93.478 1.00 33.34 ? 72 PHE A C 1 +ATOM 544 O O . PHE A 1 72 ? 9.060 17.465 93.874 1.00 35.33 ? 72 PHE A O 1 +ATOM 545 C CB . PHE A 1 72 ? 10.565 15.883 91.313 1.00 30.29 ? 72 PHE A CB 1 +ATOM 546 C CG . PHE A 1 72 ? 10.534 15.178 89.987 1.00 30.66 ? 72 PHE A CG 1 +ATOM 547 C CD1 . PHE A 1 72 ? 9.993 15.795 88.871 1.00 30.24 ? 72 PHE A CD1 1 +ATOM 548 C CD2 . PHE A 1 72 ? 11.034 13.877 89.863 1.00 30.99 ? 72 PHE A CD2 1 +ATOM 549 C CE1 . PHE A 1 72 ? 9.942 15.131 87.639 1.00 32.00 ? 72 PHE A CE1 1 +ATOM 550 C CE2 . PHE A 1 72 ? 10.992 13.199 88.642 1.00 29.96 ? 72 PHE A CE2 1 +ATOM 551 C CZ . PHE A 1 72 ? 10.443 13.827 87.525 1.00 30.81 ? 72 PHE A CZ 1 +ATOM 552 N N . GLU A 1 73 ? 10.222 15.569 94.238 1.00 33.34 ? 73 GLU A N 1 +ATOM 553 C CA . GLU A 1 73 ? 10.606 15.933 95.594 1.00 34.38 ? 73 GLU A CA 1 +ATOM 554 C C . GLU A 1 73 ? 11.345 17.286 95.561 1.00 34.95 ? 73 GLU A C 1 +ATOM 555 O O . GLU A 1 73 ? 12.037 17.610 94.590 1.00 32.79 ? 73 GLU A O 1 +ATOM 556 C CB . GLU A 1 73 ? 11.539 14.861 96.172 1.00 33.68 ? 73 GLU A CB 1 +ATOM 557 C CG . GLU A 1 73 ? 10.889 13.506 96.481 1.00 36.00 ? 73 GLU A CG 1 +ATOM 558 C CD . GLU A 1 73 ? 10.427 12.733 95.240 1.00 38.46 ? 73 GLU A CD 1 +ATOM 559 O OE1 . GLU A 1 73 ? 10.985 12.951 94.141 1.00 37.10 ? 73 GLU A OE1 1 +ATOM 560 O OE2 . GLU A 1 73 ? 9.510 11.886 95.373 1.00 39.56 ? 73 GLU A OE2 1 +ATOM 561 N N . LEU A 1 74 ? 11.207 18.068 96.627 1.00 37.26 ? 74 LEU A N 1 +ATOM 562 C CA . LEU A 1 74 ? 11.854 19.379 96.718 1.00 38.20 ? 74 LEU A CA 1 +ATOM 563 C C . LEU A 1 74 ? 13.379 19.340 96.571 1.00 38.73 ? 74 LEU A C 1 +ATOM 564 O O . LEU A 1 74 ? 13.962 20.269 96.014 1.00 39.18 ? 74 LEU A O 1 +ATOM 565 C CB . LEU A 1 74 ? 11.450 20.066 98.023 1.00 38.16 ? 74 LEU A CB 1 +ATOM 566 C CG . LEU A 1 74 ? 10.296 21.082 97.956 1.00 38.19 ? 74 LEU A CG 1 +ATOM 567 C CD1 . LEU A 1 74 ? 9.484 20.930 96.685 1.00 36.50 ? 74 LEU A CD1 1 +ATOM 568 C CD2 . LEU A 1 74 ? 9.424 20.911 99.187 1.00 36.72 ? 74 LEU A CD2 1 +ATOM 569 N N . ASP A 1 75 ? 14.028 18.290 97.073 1.00 39.50 ? 75 ASP A N 1 +ATOM 570 C CA . ASP A 1 75 ? 15.477 18.168 96.894 1.00 40.86 ? 75 ASP A CA 1 +ATOM 571 C C . ASP A 1 75 ? 15.559 17.494 95.523 1.00 39.65 ? 75 ASP A C 1 +ATOM 572 O O . ASP A 1 75 ? 15.191 16.329 95.375 1.00 40.77 ? 75 ASP A O 1 +ATOM 573 C CB . ASP A 1 75 ? 16.105 17.261 97.958 1.00 43.86 ? 75 ASP A CB 1 +ATOM 574 C CG . ASP A 1 75 ? 17.629 17.348 97.974 1.00 47.84 ? 75 ASP A CG 1 +ATOM 575 O OD1 . ASP A 1 75 ? 18.250 17.360 96.885 1.00 48.40 ? 75 ASP A OD1 1 +ATOM 576 O OD2 . ASP A 1 75 ? 18.210 17.395 99.081 1.00 52.76 ? 75 ASP A OD2 1 +ATOM 577 N N . ARG A 1 76 ? 16.051 18.226 94.532 1.00 37.95 ? 76 ARG A N 1 +ATOM 578 C CA . ARG A 1 76 ? 16.111 17.748 93.151 1.00 36.58 ? 76 ARG A CA 1 +ATOM 579 C C . ARG A 1 76 ? 17.176 16.745 92.681 1.00 37.01 ? 76 ARG A C 1 +ATOM 580 O O . ARG A 1 76 ? 17.213 16.408 91.497 1.00 38.70 ? 76 ARG A O 1 +ATOM 581 C CB . ARG A 1 76 ? 16.174 18.960 92.219 1.00 35.01 ? 76 ARG A CB 1 +ATOM 582 C CG . ARG A 1 76 ? 15.211 20.094 92.567 1.00 34.69 ? 76 ARG A CG 1 +ATOM 583 C CD . ARG A 1 76 ? 13.752 19.650 92.582 1.00 33.24 ? 76 ARG A CD 1 +ATOM 584 N NE . ARG A 1 76 ? 12.867 20.798 92.419 1.00 32.71 ? 76 ARG A NE 1 +ATOM 585 C CZ . ARG A 1 76 ? 11.549 20.782 92.602 1.00 32.87 ? 76 ARG A CZ 1 +ATOM 586 N NH1 . ARG A 1 76 ? 10.926 19.666 92.965 1.00 31.89 ? 76 ARG A NH1 1 +ATOM 587 N NH2 . ARG A 1 76 ? 10.853 21.897 92.421 1.00 31.62 ? 76 ARG A NH2 1 +ATOM 588 N N . LYS A 1 77 ? 18.030 16.250 93.563 1.00 36.88 ? 77 LYS A N 1 +ATOM 589 C CA . LYS A 1 77 ? 19.077 15.326 93.122 1.00 38.63 ? 77 LYS A CA 1 +ATOM 590 C C . LYS A 1 77 ? 18.595 14.034 92.459 1.00 38.04 ? 77 LYS A C 1 +ATOM 591 O O . LYS A 1 77 ? 17.508 13.530 92.745 1.00 38.46 ? 77 LYS A O 1 +ATOM 592 C CB . LYS A 1 77 ? 19.998 14.975 94.297 1.00 40.57 ? 77 LYS A CB 1 +ATOM 593 C CG . LYS A 1 77 ? 20.755 16.174 94.849 1.00 44.90 ? 77 LYS A CG 1 +ATOM 594 C CD . LYS A 1 77 ? 21.294 15.915 96.244 1.00 46.97 ? 77 LYS A CD 1 +ATOM 595 C CE . LYS A 1 77 ? 22.454 14.947 96.220 1.00 50.94 ? 77 LYS A CE 1 +ATOM 596 N NZ . LYS A 1 77 ? 22.981 14.737 97.600 1.00 52.60 ? 77 LYS A NZ 1 +ATOM 597 N N . ARG A 1 78 ? 19.430 13.517 91.564 1.00 36.42 ? 78 ARG A N 1 +ATOM 598 C CA . ARG A 1 78 ? 19.184 12.273 90.843 1.00 37.51 ? 78 ARG A CA 1 +ATOM 599 C C . ARG A 1 78 ? 18.076 12.337 89.799 1.00 37.52 ? 78 ARG A C 1 +ATOM 600 O O . ARG A 1 78 ? 17.235 11.441 89.716 1.00 36.93 ? 78 ARG A O 1 +ATOM 601 C CB . ARG A 1 78 ? 18.880 11.132 91.823 1.00 38.00 ? 78 ARG A CB 1 +ATOM 602 C CG . ARG A 1 78 ? 19.792 11.088 93.036 1.00 38.53 ? 78 ARG A CG 1 +ATOM 603 C CD . ARG A 1 78 ? 21.263 11.196 92.667 1.00 39.69 ? 78 ARG A CD 1 +ATOM 604 N NE . ARG A 1 78 ? 22.078 11.363 93.871 1.00 42.51 ? 78 ARG A NE 1 +ATOM 605 C CZ . ARG A 1 78 ? 23.329 11.815 93.877 1.00 42.80 ? 78 ARG A CZ 1 +ATOM 606 N NH1 . ARG A 1 78 ? 23.923 12.148 92.737 1.00 41.33 ? 78 ARG A NH1 1 +ATOM 607 N NH2 . ARG A 1 78 ? 23.981 11.945 95.028 1.00 43.34 ? 78 ARG A NH2 1 +ATOM 608 N N . LYS A 1 79 ? 18.087 13.387 88.991 1.00 36.86 ? 79 LYS A N 1 +ATOM 609 C CA . LYS A 1 79 ? 17.090 13.535 87.955 1.00 35.04 ? 79 LYS A CA 1 +ATOM 610 C C . LYS A 1 79 ? 17.619 14.500 86.920 1.00 35.25 ? 79 LYS A C 1 +ATOM 611 O O . LYS A 1 79 ? 18.391 15.403 87.238 1.00 36.21 ? 79 LYS A O 1 +ATOM 612 C CB . LYS A 1 79 ? 15.784 14.071 88.544 1.00 38.08 ? 79 LYS A CB 1 +ATOM 613 C CG . LYS A 1 79 ? 14.604 14.006 87.588 1.00 41.19 ? 79 LYS A CG 1 +ATOM 614 C CD . LYS A 1 79 ? 14.273 12.555 87.264 1.00 45.19 ? 79 LYS A CD 1 +ATOM 615 C CE . LYS A 1 79 ? 13.363 12.437 86.044 1.00 49.25 ? 79 LYS A CE 1 +ATOM 616 N NZ . LYS A 1 79 ? 13.020 11.002 85.753 1.00 50.54 ? 79 LYS A NZ 1 +ATOM 617 N N . ARG A 1 80 ? 17.206 14.297 85.677 1.00 34.60 ? 80 ARG A N 1 +ATOM 618 C CA . ARG A 1 80 ? 17.600 15.152 84.566 1.00 33.63 ? 80 ARG A CA 1 +ATOM 619 C C . ARG A 1 80 ? 16.344 15.972 84.221 1.00 33.81 ? 80 ARG A C 1 +ATOM 620 O O . ARG A 1 80 ? 15.404 15.442 83.652 1.00 34.29 ? 80 ARG A O 1 +ATOM 621 C CB A ARG A 1 80 ? 18.044 14.284 83.382 0.50 32.30 ? 80 ARG A CB 1 +ATOM 622 C CB B ARG A 1 80 ? 18.014 14.272 83.382 0.50 33.10 ? 80 ARG A CB 1 +ATOM 623 C CG A ARG A 1 80 ? 18.664 15.029 82.199 0.50 31.59 ? 80 ARG A CG 1 +ATOM 624 C CG B ARG A 1 80 ? 18.223 14.989 82.052 0.50 33.48 ? 80 ARG A CG 1 +ATOM 625 C CD A ARG A 1 80 ? 19.047 14.030 81.110 0.50 30.88 ? 80 ARG A CD 1 +ATOM 626 C CD B ARG A 1 80 ? 18.511 13.966 80.959 0.50 33.36 ? 80 ARG A CD 1 +ATOM 627 N NE A ARG A 1 80 ? 19.469 14.655 79.855 0.50 30.94 ? 80 ARG A NE 1 +ATOM 628 N NE B ARG A 1 80 ? 18.753 14.569 79.648 0.50 34.86 ? 80 ARG A NE 1 +ATOM 629 C CZ A ARG A 1 80 ? 20.635 15.261 79.667 0.50 30.80 ? 80 ARG A CZ 1 +ATOM 630 C CZ B ARG A 1 80 ? 17.808 15.073 78.858 0.50 34.61 ? 80 ARG A CZ 1 +ATOM 631 N NH1 A ARG A 1 80 ? 21.515 15.332 80.664 0.50 32.20 ? 80 ARG A NH1 1 +ATOM 632 N NH1 B ARG A 1 80 ? 16.536 15.055 79.235 0.50 33.62 ? 80 ARG A NH1 1 +ATOM 633 N NH2 A ARG A 1 80 ? 20.927 15.786 78.483 0.50 27.37 ? 80 ARG A NH2 1 +ATOM 634 N NH2 B ARG A 1 80 ? 18.141 15.595 77.685 0.50 35.13 ? 80 ARG A NH2 1 +ATOM 635 N N . TYR A 1 81 ? 16.323 17.253 84.581 1.00 34.29 ? 81 TYR A N 1 +ATOM 636 C CA . TYR A 1 81 ? 15.161 18.098 84.302 1.00 33.57 ? 81 TYR A CA 1 +ATOM 637 C C . TYR A 1 81 ? 15.262 18.858 82.993 1.00 34.98 ? 81 TYR A C 1 +ATOM 638 O O . TYR A 1 81 ? 16.349 19.264 82.576 1.00 36.21 ? 81 TYR A O 1 +ATOM 639 C CB . TYR A 1 81 ? 14.943 19.114 85.422 1.00 31.92 ? 81 TYR A CB 1 +ATOM 640 C CG . TYR A 1 81 ? 14.841 18.492 86.788 1.00 30.94 ? 81 TYR A CG 1 +ATOM 641 C CD1 . TYR A 1 81 ? 15.985 18.179 87.520 1.00 30.62 ? 81 TYR A CD1 1 +ATOM 642 C CD2 . TYR A 1 81 ? 13.600 18.184 87.339 1.00 31.52 ? 81 TYR A CD2 1 +ATOM 643 C CE1 . TYR A 1 81 ? 15.893 17.576 88.771 1.00 31.00 ? 81 TYR A CE1 1 +ATOM 644 C CE2 . TYR A 1 81 ? 13.496 17.583 88.579 1.00 31.96 ? 81 TYR A CE2 1 +ATOM 645 C CZ . TYR A 1 81 ? 14.647 17.282 89.289 1.00 31.29 ? 81 TYR A CZ 1 +ATOM 646 O OH . TYR A 1 81 ? 14.543 16.677 90.515 1.00 34.70 ? 81 TYR A OH 1 +ATOM 647 N N . VAL A 1 82 ? 14.112 19.053 82.355 1.00 34.97 ? 82 VAL A N 1 +ATOM 648 C CA . VAL A 1 82 ? 14.031 19.789 81.098 1.00 35.00 ? 82 VAL A CA 1 +ATOM 649 C C . VAL A 1 82 ? 13.204 21.044 81.351 1.00 34.87 ? 82 VAL A C 1 +ATOM 650 O O . VAL A 1 82 ? 12.133 20.975 81.949 1.00 36.52 ? 82 VAL A O 1 +ATOM 651 C CB . VAL A 1 82 ? 13.337 18.930 79.995 1.00 35.99 ? 82 VAL A CB 1 +ATOM 652 C CG1 . VAL A 1 82 ? 13.089 19.757 78.762 1.00 35.82 ? 82 VAL A CG1 1 +ATOM 653 C CG2 . VAL A 1 82 ? 14.193 17.738 79.650 1.00 34.52 ? 82 VAL A CG2 1 +ATOM 654 N N . MET A 1 83 ? 13.704 22.196 80.925 1.00 36.10 ? 83 MET A N 1 +ATOM 655 C CA . MET A 1 83 ? 12.952 23.433 81.108 1.00 37.72 ? 83 MET A CA 1 +ATOM 656 C C . MET A 1 83 ? 12.336 23.809 79.760 1.00 36.86 ? 83 MET A C 1 +ATOM 657 O O . MET A 1 83 ? 12.991 24.420 78.919 1.00 37.54 ? 83 MET A O 1 +ATOM 658 C CB . MET A 1 83 ? 13.865 24.566 81.584 1.00 41.19 ? 83 MET A CB 1 +ATOM 659 C CG . MET A 1 83 ? 14.658 24.270 82.858 1.00 45.96 ? 83 MET A CG 1 +ATOM 660 S SD . MET A 1 83 ? 13.636 23.920 84.322 1.00 51.48 ? 83 MET A SD 1 +ATOM 661 C CE . MET A 1 83 ? 12.949 25.541 84.608 1.00 47.99 ? 83 MET A CE 1 +ATOM 662 N N . TYR A 1 84 ? 11.083 23.430 79.547 1.00 34.49 ? 84 TYR A N 1 +ATOM 663 C CA . TYR A 1 84 ? 10.405 23.741 78.291 1.00 32.73 ? 84 TYR A CA 1 +ATOM 664 C C . TYR A 1 84 ? 8.908 23.784 78.558 1.00 31.63 ? 84 TYR A C 1 +ATOM 665 O O . TYR A 1 84 ? 8.290 22.737 78.751 1.00 32.01 ? 84 TYR A O 1 +ATOM 666 C CB . TYR A 1 84 ? 10.714 22.663 77.260 1.00 33.00 ? 84 TYR A CB 1 +ATOM 667 C CG . TYR A 1 84 ? 10.726 23.159 75.840 1.00 35.34 ? 84 TYR A CG 1 +ATOM 668 C CD1 . TYR A 1 84 ? 11.567 24.203 75.458 1.00 36.23 ? 84 TYR A CD1 1 +ATOM 669 C CD2 . TYR A 1 84 ? 9.918 22.568 74.865 1.00 37.50 ? 84 TYR A CD2 1 +ATOM 670 C CE1 . TYR A 1 84 ? 11.609 24.645 74.144 1.00 39.51 ? 84 TYR A CE1 1 +ATOM 671 C CE2 . TYR A 1 84 ? 9.947 23.002 73.542 1.00 37.39 ? 84 TYR A CE2 1 +ATOM 672 C CZ . TYR A 1 84 ? 10.793 24.040 73.189 1.00 40.24 ? 84 TYR A CZ 1 +ATOM 673 O OH . TYR A 1 84 ? 10.811 24.492 71.890 1.00 42.10 ? 84 TYR A OH 1 +ATOM 674 N N . ASN A 1 85 ? 8.335 24.986 78.587 1.00 29.45 ? 85 ASN A N 1 +ATOM 675 C CA . ASN A 1 85 ? 6.911 25.157 78.851 1.00 30.20 ? 85 ASN A CA 1 +ATOM 676 C C . ASN A 1 85 ? 6.091 24.230 77.969 1.00 30.20 ? 85 ASN A C 1 +ATOM 677 O O . ASN A 1 85 ? 6.248 24.233 76.751 1.00 29.19 ? 85 ASN A O 1 +ATOM 678 C CB . ASN A 1 85 ? 6.481 26.597 78.561 1.00 32.72 ? 85 ASN A CB 1 +ATOM 679 C CG . ASN A 1 85 ? 7.073 27.598 79.523 1.00 32.25 ? 85 ASN A CG 1 +ATOM 680 O OD1 . ASN A 1 85 ? 7.836 27.250 80.424 1.00 32.53 ? 85 ASN A OD1 1 +ATOM 681 N ND2 . ASN A 1 85 ? 6.715 28.861 79.337 1.00 32.96 ? 85 ASN A ND2 1 +ATOM 682 N N . VAL A 1 86 ? 5.209 23.447 78.576 1.00 30.07 ? 86 VAL A N 1 +ATOM 683 C CA . VAL A 1 86 ? 4.393 22.539 77.793 1.00 31.67 ? 86 VAL A CA 1 +ATOM 684 C C . VAL A 1 86 ? 3.037 22.299 78.448 1.00 33.26 ? 86 VAL A C 1 +ATOM 685 O O . VAL A 1 86 ? 2.913 22.312 79.681 1.00 33.66 ? 86 VAL A O 1 +ATOM 686 C CB . VAL A 1 86 ? 5.110 21.166 77.604 1.00 31.58 ? 86 VAL A CB 1 +ATOM 687 C CG1 . VAL A 1 86 ? 5.054 20.364 78.888 1.00 31.25 ? 86 VAL A CG1 1 +ATOM 688 C CG2 . VAL A 1 86 ? 4.466 20.380 76.480 1.00 33.66 ? 86 VAL A CG2 1 +ATOM 689 N N . ASP A 1 87 ? 2.017 22.103 77.617 1.00 33.93 ? 87 ASP A N 1 +ATOM 690 C CA . ASP A 1 87 ? 0.675 21.800 78.097 1.00 33.92 ? 87 ASP A CA 1 +ATOM 691 C C . ASP A 1 87 ? 0.782 20.353 78.589 1.00 33.80 ? 87 ASP A C 1 +ATOM 692 O O . ASP A 1 87 ? 0.792 19.420 77.793 1.00 32.73 ? 87 ASP A O 1 +ATOM 693 C CB . ASP A 1 87 ? -0.323 21.886 76.946 1.00 36.95 ? 87 ASP A CB 1 +ATOM 694 C CG . ASP A 1 87 ? -1.733 21.558 77.381 1.00 39.69 ? 87 ASP A CG 1 +ATOM 695 O OD1 . ASP A 1 87 ? -1.923 20.530 78.057 1.00 43.61 ? 87 ASP A OD1 1 +ATOM 696 O OD2 . ASP A 1 87 ? -2.657 22.321 77.047 1.00 44.25 ? 87 ASP A OD2 1 +ATOM 697 N N . ALA A 1 88 ? 0.867 20.172 79.903 1.00 33.80 ? 88 ALA A N 1 +ATOM 698 C CA . ALA A 1 88 ? 1.038 18.845 80.475 1.00 35.07 ? 88 ALA A CA 1 +ATOM 699 C C . ALA A 1 88 ? -0.185 17.922 80.443 1.00 35.48 ? 88 ALA A C 1 +ATOM 700 O O . ALA A 1 88 ? -0.066 16.723 80.705 1.00 34.95 ? 88 ALA A O 1 +ATOM 701 C CB . ALA A 1 88 ? 1.561 18.978 81.909 1.00 35.05 ? 88 ALA A CB 1 +ATOM 702 N N . GLY A 1 89 ? -1.352 18.468 80.118 1.00 34.69 ? 89 GLY A N 1 +ATOM 703 C CA . GLY A 1 89 ? -2.544 17.643 80.097 1.00 33.22 ? 89 GLY A CA 1 +ATOM 704 C C . GLY A 1 89 ? -2.871 17.182 81.504 1.00 32.90 ? 89 GLY A C 1 +ATOM 705 O O . GLY A 1 89 ? -2.679 17.931 82.465 1.00 32.57 ? 89 GLY A O 1 +ATOM 706 N N . ALA A 1 90 ? -3.366 15.955 81.629 1.00 31.98 ? 90 ALA A N 1 +ATOM 707 C CA . ALA A 1 90 ? -3.710 15.403 82.930 1.00 33.62 ? 90 ALA A CA 1 +ATOM 708 C C . ALA A 1 90 ? -2.428 14.826 83.532 1.00 34.76 ? 90 ALA A C 1 +ATOM 709 O O . ALA A 1 90 ? -2.251 13.606 83.608 1.00 37.02 ? 90 ALA A O 1 +ATOM 710 C CB . ALA A 1 90 ? -4.779 14.316 82.765 1.00 29.82 ? 90 ALA A CB 1 +ATOM 711 N N . TYR A 1 91 ? -1.536 15.711 83.960 1.00 34.38 ? 91 TYR A N 1 +ATOM 712 C CA . TYR A 1 91 ? -0.250 15.305 84.512 1.00 33.75 ? 91 TYR A CA 1 +ATOM 713 C C . TYR A 1 91 ? -0.308 14.462 85.774 1.00 34.09 ? 91 TYR A C 1 +ATOM 714 O O . TYR A 1 91 ? -1.221 14.576 86.584 1.00 31.99 ? 91 TYR A O 1 +ATOM 715 C CB . TYR A 1 91 ? 0.623 16.538 84.761 1.00 33.18 ? 91 TYR A CB 1 +ATOM 716 C CG . TYR A 1 91 ? 0.116 17.475 85.838 1.00 32.56 ? 91 TYR A CG 1 +ATOM 717 C CD1 . TYR A 1 91 ? 0.416 17.254 87.188 1.00 33.05 ? 91 TYR A CD1 1 +ATOM 718 C CD2 . TYR A 1 91 ? -0.645 18.599 85.507 1.00 32.32 ? 91 TYR A CD2 1 +ATOM 719 C CE1 . TYR A 1 91 ? -0.029 18.140 88.183 1.00 32.61 ? 91 TYR A CE1 1 +ATOM 720 C CE2 . TYR A 1 91 ? -1.091 19.484 86.486 1.00 33.49 ? 91 TYR A CE2 1 +ATOM 721 C CZ . TYR A 1 91 ? -0.779 19.251 87.821 1.00 33.36 ? 91 TYR A CZ 1 +ATOM 722 O OH . TYR A 1 91 ? -1.212 20.143 88.780 1.00 35.29 ? 91 TYR A OH 1 +ATOM 723 N N . LYS A 1 92 ? 0.701 13.613 85.923 1.00 36.48 ? 92 LYS A N 1 +ATOM 724 C CA . LYS A 1 92 ? 0.824 12.728 87.075 1.00 38.02 ? 92 LYS A CA 1 +ATOM 725 C C . LYS A 1 92 ? 2.172 13.028 87.706 1.00 36.51 ? 92 LYS A C 1 +ATOM 726 O O . LYS A 1 92 ? 2.973 13.774 87.133 1.00 35.28 ? 92 LYS A O 1 +ATOM 727 C CB . LYS A 1 92 ? 0.792 11.271 86.616 1.00 41.42 ? 92 LYS A CB 1 +ATOM 728 C CG . LYS A 1 92 ? -0.439 10.911 85.792 1.00 45.82 ? 92 LYS A CG 1 +ATOM 729 C CD . LYS A 1 92 ? -0.331 9.498 85.227 1.00 49.99 ? 92 LYS A CD 1 +ATOM 730 C CE . LYS A 1 92 ? -1.509 9.174 84.328 1.00 52.94 ? 92 LYS A CE 1 +ATOM 731 N NZ . LYS A 1 92 ? -1.365 7.818 83.718 1.00 56.99 ? 92 LYS A NZ 1 +ATOM 732 N N . LYS A 1 93 ? 2.450 12.451 88.869 1.00 35.87 ? 93 LYS A N 1 +ATOM 733 C CA . LYS A 1 93 ? 3.736 12.741 89.474 1.00 35.68 ? 93 LYS A CA 1 +ATOM 734 C C . LYS A 1 93 ? 4.876 12.162 88.651 1.00 33.22 ? 93 LYS A C 1 +ATOM 735 O O . LYS A 1 93 ? 4.714 11.176 87.944 1.00 34.22 ? 93 LYS A O 1 +ATOM 736 C CB . LYS A 1 93 ? 3.797 12.267 90.926 1.00 36.50 ? 93 LYS A CB 1 +ATOM 737 C CG . LYS A 1 93 ? 3.771 10.799 91.170 1.00 39.63 ? 93 LYS A CG 1 +ATOM 738 C CD . LYS A 1 93 ? 4.095 10.573 92.641 1.00 41.26 ? 93 LYS A CD 1 +ATOM 739 C CE . LYS A 1 93 ? 4.043 9.107 93.024 1.00 44.68 ? 93 LYS A CE 1 +ATOM 740 N NZ . LYS A 1 93 ? 4.400 8.938 94.466 1.00 49.31 ? 93 LYS A NZ 1 +ATOM 741 N N . TYR A 1 94 ? 6.018 12.828 88.729 1.00 32.71 ? 94 TYR A N 1 +ATOM 742 C CA . TYR A 1 94 ? 7.233 12.471 88.006 1.00 30.17 ? 94 TYR A CA 1 +ATOM 743 C C . TYR A 1 94 ? 7.140 12.771 86.524 1.00 31.92 ? 94 TYR A C 1 +ATOM 744 O O . TYR A 1 94 ? 7.977 12.329 85.739 1.00 33.64 ? 94 TYR A O 1 +ATOM 745 C CB . TYR A 1 94 ? 7.619 11.010 88.248 1.00 28.82 ? 94 TYR A CB 1 +ATOM 746 C CG . TYR A 1 94 ? 7.871 10.707 89.715 1.00 28.12 ? 94 TYR A CG 1 +ATOM 747 C CD1 . TYR A 1 94 ? 8.371 11.689 90.570 1.00 29.36 ? 94 TYR A CD1 1 +ATOM 748 C CD2 . TYR A 1 94 ? 7.593 9.460 90.250 1.00 28.17 ? 94 TYR A CD2 1 +ATOM 749 C CE1 . TYR A 1 94 ? 8.580 11.439 91.915 1.00 28.36 ? 94 TYR A CE1 1 +ATOM 750 C CE2 . TYR A 1 94 ? 7.802 9.194 91.599 1.00 29.16 ? 94 TYR A CE2 1 +ATOM 751 C CZ . TYR A 1 94 ? 8.293 10.191 92.425 1.00 29.66 ? 94 TYR A CZ 1 +ATOM 752 O OH . TYR A 1 94 ? 8.492 9.943 93.763 1.00 31.17 ? 94 TYR A OH 1 +ATOM 753 N N . GLN A 1 95 ? 6.129 13.539 86.130 1.00 33.04 ? 95 GLN A N 1 +ATOM 754 C CA . GLN A 1 95 ? 6.008 13.927 84.731 1.00 33.40 ? 95 GLN A CA 1 +ATOM 755 C C . GLN A 1 95 ? 6.805 15.219 84.579 1.00 33.70 ? 95 GLN A C 1 +ATOM 756 O O . GLN A 1 95 ? 6.755 16.082 85.443 1.00 33.70 ? 95 GLN A O 1 +ATOM 757 C CB . GLN A 1 95 ? 4.553 14.173 84.360 1.00 33.17 ? 95 GLN A CB 1 +ATOM 758 C CG . GLN A 1 95 ? 4.369 14.446 82.882 1.00 33.40 ? 95 GLN A CG 1 +ATOM 759 C CD . GLN A 1 95 ? 2.915 14.579 82.497 1.00 34.16 ? 95 GLN A CD 1 +ATOM 760 O OE1 . GLN A 1 95 ? 2.068 13.811 82.965 1.00 33.52 ? 95 GLN A OE1 1 +ATOM 761 N NE2 . GLN A 1 95 ? 2.616 15.549 81.628 1.00 34.22 ? 95 GLN A NE2 1 +ATOM 762 N N . ASP A 1 96 ? 7.533 15.355 83.477 1.00 36.06 ? 96 ASP A N 1 +ATOM 763 C CA . ASP A 1 96 ? 8.361 16.537 83.231 1.00 37.40 ? 96 ASP A CA 1 +ATOM 764 C C . ASP A 1 96 ? 8.493 16.677 81.719 1.00 36.96 ? 96 ASP A C 1 +ATOM 765 O O . ASP A 1 96 ? 8.575 15.679 81.005 1.00 37.28 ? 96 ASP A O 1 +ATOM 766 C CB . ASP A 1 96 ? 9.749 16.330 83.879 1.00 40.53 ? 96 ASP A CB 1 +ATOM 767 C CG . ASP A 1 96 ? 10.649 17.572 83.807 1.00 45.07 ? 96 ASP A CG 1 +ATOM 768 O OD1 . ASP A 1 96 ? 10.253 18.659 84.295 1.00 46.09 ? 96 ASP A OD1 1 +ATOM 769 O OD2 . ASP A 1 96 ? 11.775 17.452 83.270 1.00 49.27 ? 96 ASP A OD2 1 +ATOM 770 N N . PRO A 1 97 ? 8.478 17.916 81.202 1.00 36.74 ? 97 PRO A N 1 +ATOM 771 C CA . PRO A 1 97 ? 8.330 19.168 81.948 1.00 34.76 ? 97 PRO A CA 1 +ATOM 772 C C . PRO A 1 97 ? 6.863 19.528 82.125 1.00 35.06 ? 97 PRO A C 1 +ATOM 773 O O . PRO A 1 97 ? 5.980 18.828 81.639 1.00 34.88 ? 97 PRO A O 1 +ATOM 774 C CB . PRO A 1 97 ? 9.051 20.166 81.062 1.00 35.21 ? 97 PRO A CB 1 +ATOM 775 C CG . PRO A 1 97 ? 8.638 19.703 79.681 1.00 35.70 ? 97 PRO A CG 1 +ATOM 776 C CD . PRO A 1 97 ? 8.769 18.182 79.777 1.00 35.88 ? 97 PRO A CD 1 +ATOM 777 N N . LEU A 1 98 ? 6.608 20.628 82.824 1.00 35.87 ? 98 LEU A N 1 +ATOM 778 C CA . LEU A 1 98 ? 5.248 21.088 83.039 1.00 33.54 ? 98 LEU A CA 1 +ATOM 779 C C . LEU A 1 98 ? 5.059 22.466 82.404 1.00 33.64 ? 98 LEU A C 1 +ATOM 780 O O . LEU A 1 98 ? 5.758 22.810 81.450 1.00 33.69 ? 98 LEU A O 1 +ATOM 781 C CB . LEU A 1 98 ? 4.928 21.115 84.533 1.00 33.41 ? 98 LEU A CB 1 +ATOM 782 C CG . LEU A 1 98 ? 5.010 19.747 85.219 1.00 34.54 ? 98 LEU A CG 1 +ATOM 783 C CD1 . LEU A 1 98 ? 4.765 19.925 86.700 1.00 36.07 ? 98 LEU A CD1 1 +ATOM 784 C CD2 . LEU A 1 98 ? 3.996 18.778 84.621 1.00 34.40 ? 98 LEU A CD2 1 +ATOM 785 N N . TYR A 1 99 ? 4.129 23.253 82.937 1.00 33.50 ? 99 TYR A N 1 +ATOM 786 C CA . TYR A 1 99 ? 3.798 24.566 82.375 1.00 33.30 ? 99 TYR A CA 1 +ATOM 787 C C . TYR A 1 99 ? 4.781 25.718 82.565 1.00 33.44 ? 99 TYR A C 1 +ATOM 788 O O . TYR A 1 99 ? 4.900 26.585 81.690 1.00 32.51 ? 99 TYR A O 1 +ATOM 789 C CB . TYR A 1 99 ? 2.454 25.035 82.927 1.00 32.73 ? 99 TYR A CB 1 +ATOM 790 C CG . TYR A 1 99 ? 1.360 23.999 82.933 1.00 33.08 ? 99 TYR A CG 1 +ATOM 791 C CD1 . TYR A 1 99 ? 0.604 23.731 81.779 1.00 32.52 ? 99 TYR A CD1 1 +ATOM 792 C CD2 . TYR A 1 99 ? 1.029 23.332 84.110 1.00 32.52 ? 99 TYR A CD2 1 +ATOM 793 C CE1 . TYR A 1 99 ? -0.467 22.829 81.815 1.00 31.26 ? 99 TYR A CE1 1 +ATOM 794 C CE2 . TYR A 1 99 ? -0.032 22.430 84.153 1.00 32.99 ? 99 TYR A CE2 1 +ATOM 795 C CZ . TYR A 1 99 ? -0.775 22.188 83.009 1.00 32.50 ? 99 TYR A CZ 1 +ATOM 796 O OH . TYR A 1 99 ? -1.835 21.322 83.088 1.00 34.40 ? 99 TYR A OH 1 +ATOM 797 N N . VAL A 1 100 ? 5.464 25.739 83.706 1.00 33.67 ? 100 VAL A N 1 +ATOM 798 C CA . VAL A 1 100 ? 6.381 26.830 84.033 1.00 33.73 ? 100 VAL A CA 1 +ATOM 799 C C . VAL A 1 100 ? 7.856 26.470 84.040 1.00 34.57 ? 100 VAL A C 1 +ATOM 800 O O . VAL A 1 100 ? 8.233 25.390 84.480 1.00 36.95 ? 100 VAL A O 1 +ATOM 801 C CB . VAL A 1 100 ? 6.022 27.426 85.409 1.00 32.40 ? 100 VAL A CB 1 +ATOM 802 C CG1 . VAL A 1 100 ? 6.963 28.558 85.744 1.00 33.74 ? 100 VAL A CG1 1 +ATOM 803 C CG2 . VAL A 1 100 ? 4.574 27.903 85.405 1.00 30.54 ? 100 VAL A CG2 1 +ATOM 804 N N . SER A 1 101 ? 8.687 27.395 83.567 1.00 35.24 ? 101 SER A N 1 +ATOM 805 C CA . SER A 1 101 ? 10.133 27.191 83.510 1.00 35.78 ? 101 SER A CA 1 +ATOM 806 C C . SER A 1 101 ? 10.942 28.297 84.192 1.00 35.95 ? 101 SER A C 1 +ATOM 807 O O . SER A 1 101 ? 11.141 29.357 83.609 1.00 38.35 ? 101 SER A O 1 +ATOM 808 C CB . SER A 1 101 ? 10.603 27.099 82.057 1.00 36.13 ? 101 SER A CB 1 +ATOM 809 O OG . SER A 1 101 ? 10.046 25.984 81.395 1.00 37.19 ? 101 SER A OG 1 +ATOM 810 N N . ILE A 1 102 ? 11.405 28.049 85.414 1.00 34.42 ? 102 ILE A N 1 +ATOM 811 C CA . ILE A 1 102 ? 12.238 29.004 86.145 1.00 32.96 ? 102 ILE A CA 1 +ATOM 812 C C . ILE A 1 102 ? 13.629 28.340 86.235 1.00 33.18 ? 102 ILE A C 1 +ATOM 813 O O . ILE A 1 102 ? 13.864 27.494 87.103 1.00 33.36 ? 102 ILE A O 1 +ATOM 814 C CB . ILE A 1 102 ? 11.731 29.236 87.590 1.00 33.46 ? 102 ILE A CB 1 +ATOM 815 C CG1 . ILE A 1 102 ? 10.214 29.461 87.619 1.00 34.45 ? 102 ILE A CG1 1 +ATOM 816 C CG2 . ILE A 1 102 ? 12.450 30.436 88.185 1.00 34.30 ? 102 ILE A CG2 1 +ATOM 817 C CD1 . ILE A 1 102 ? 9.757 30.759 87.008 1.00 34.97 ? 102 ILE A CD1 1 +ATOM 818 N N . PRO A 1 103 ? 14.564 28.711 85.346 1.00 32.94 ? 103 PRO A N 1 +ATOM 819 C CA . PRO A 1 103 ? 15.927 28.157 85.309 1.00 34.88 ? 103 PRO A CA 1 +ATOM 820 C C . PRO A 1 103 ? 16.820 28.616 86.467 1.00 35.53 ? 103 PRO A C 1 +ATOM 821 O O . PRO A 1 103 ? 17.932 29.104 86.251 1.00 35.12 ? 103 PRO A O 1 +ATOM 822 C CB . PRO A 1 103 ? 16.482 28.650 83.970 1.00 34.01 ? 103 PRO A CB 1 +ATOM 823 C CG . PRO A 1 103 ? 15.288 29.287 83.262 1.00 35.82 ? 103 PRO A CG 1 +ATOM 824 C CD . PRO A 1 103 ? 14.435 29.797 84.369 1.00 34.07 ? 103 PRO A CD 1 +ATOM 825 N N . LEU A 1 104 ? 16.327 28.445 87.684 1.00 35.50 ? 104 LEU A N 1 +ATOM 826 C CA . LEU A 1 104 ? 17.045 28.840 88.884 1.00 35.45 ? 104 LEU A CA 1 +ATOM 827 C C . LEU A 1 104 ? 17.128 27.692 89.869 1.00 36.53 ? 104 LEU A C 1 +ATOM 828 O O . LEU A 1 104 ? 16.130 27.026 90.137 1.00 38.04 ? 104 LEU A O 1 +ATOM 829 C CB . LEU A 1 104 ? 16.323 30.001 89.571 1.00 34.96 ? 104 LEU A CB 1 +ATOM 830 C CG . LEU A 1 104 ? 16.667 30.236 91.051 1.00 36.71 ? 104 LEU A CG 1 +ATOM 831 C CD1 . LEU A 1 104 ? 18.072 30.803 91.175 1.00 37.28 ? 104 LEU A CD1 1 +ATOM 832 C CD2 . LEU A 1 104 ? 15.667 31.203 91.677 1.00 37.59 ? 104 LEU A CD2 1 +ATOM 833 N N . PHE A 1 105 ? 18.315 27.436 90.397 1.00 36.21 ? 105 PHE A N 1 +ATOM 834 C CA . PHE A 1 105 ? 18.428 26.406 91.411 1.00 36.13 ? 105 PHE A CA 1 +ATOM 835 C C . PHE A 1 105 ? 19.355 26.908 92.498 1.00 36.40 ? 105 PHE A C 1 +ATOM 836 O O . PHE A 1 105 ? 20.286 27.671 92.237 1.00 36.80 ? 105 PHE A O 1 +ATOM 837 C CB . PHE A 1 105 ? 18.894 25.067 90.821 1.00 36.18 ? 105 PHE A CB 1 +ATOM 838 C CG . PHE A 1 105 ? 20.372 24.968 90.539 1.00 35.87 ? 105 PHE A CG 1 +ATOM 839 C CD1 . PHE A 1 105 ? 21.276 24.698 91.566 1.00 36.52 ? 105 PHE A CD1 1 +ATOM 840 C CD2 . PHE A 1 105 ? 20.845 25.040 89.232 1.00 34.97 ? 105 PHE A CD2 1 +ATOM 841 C CE1 . PHE A 1 105 ? 22.630 24.491 91.297 1.00 35.34 ? 105 PHE A CE1 1 +ATOM 842 C CE2 . PHE A 1 105 ? 22.189 24.836 88.947 1.00 36.28 ? 105 PHE A CE2 1 +ATOM 843 C CZ . PHE A 1 105 ? 23.089 24.556 89.986 1.00 36.84 ? 105 PHE A CZ 1 +ATOM 844 N N . ILE A 1 106 ? 19.064 26.512 93.729 1.00 36.66 ? 106 ILE A N 1 +ATOM 845 C CA . ILE A 1 106 ? 19.870 26.925 94.854 1.00 36.93 ? 106 ILE A CA 1 +ATOM 846 C C . ILE A 1 106 ? 20.570 25.729 95.470 1.00 39.09 ? 106 ILE A C 1 +ATOM 847 O O . ILE A 1 106 ? 19.966 24.674 95.705 1.00 38.63 ? 106 ILE A O 1 +ATOM 848 C CB . ILE A 1 106 ? 19.020 27.616 95.923 1.00 36.43 ? 106 ILE A CB 1 +ATOM 849 C CG1 . ILE A 1 106 ? 18.370 28.864 95.326 1.00 35.45 ? 106 ILE A CG1 1 +ATOM 850 C CG2 . ILE A 1 106 ? 19.894 28.007 97.111 1.00 36.19 ? 106 ILE A CG2 1 +ATOM 851 C CD1 . ILE A 1 106 ? 17.363 29.533 96.240 1.00 36.40 ? 106 ILE A CD1 1 +ATOM 852 N N . SER A 1 107 ? 21.864 25.898 95.707 1.00 39.29 ? 107 SER A N 1 +ATOM 853 C CA . SER A 1 107 ? 22.665 24.849 96.305 1.00 39.98 ? 107 SER A CA 1 +ATOM 854 C C . SER A 1 107 ? 22.880 25.194 97.774 1.00 40.28 ? 107 SER A C 1 +ATOM 855 O O . SER A 1 107 ? 23.165 26.343 98.115 1.00 40.02 ? 107 SER A O 1 +ATOM 856 C CB . SER A 1 107 ? 24.009 24.759 95.584 1.00 40.44 ? 107 SER A CB 1 +ATOM 857 O OG . SER A 1 107 ? 24.933 24.004 96.345 1.00 45.32 ? 107 SER A OG 1 +ATOM 858 N N . VAL A 1 108 ? 22.708 24.211 98.648 1.00 40.75 ? 108 VAL A N 1 +ATOM 859 C CA . VAL A 1 108 ? 22.927 24.426 100.069 1.00 41.51 ? 108 VAL A CA 1 +ATOM 860 C C . VAL A 1 108 ? 23.965 23.410 100.486 1.00 43.36 ? 108 VAL A C 1 +ATOM 861 O O . VAL A 1 108 ? 23.681 22.220 100.577 1.00 43.29 ? 108 VAL A O 1 +ATOM 862 C CB . VAL A 1 108 ? 21.654 24.216 100.902 1.00 40.10 ? 108 VAL A CB 1 +ATOM 863 C CG1 . VAL A 1 108 ? 21.938 24.566 102.362 1.00 40.81 ? 108 VAL A CG1 1 +ATOM 864 C CG2 . VAL A 1 108 ? 20.543 25.087 100.376 1.00 39.35 ? 108 VAL A CG2 1 +ATOM 865 N N . LYS A 1 109 ? 25.180 23.890 100.711 1.00 46.55 ? 109 LYS A N 1 +ATOM 866 C CA . LYS A 1 109 ? 26.291 23.033 101.098 1.00 48.82 ? 109 LYS A CA 1 +ATOM 867 C C . LYS A 1 109 ? 26.880 23.546 102.415 1.00 49.83 ? 109 LYS A C 1 +ATOM 868 O O . LYS A 1 109 ? 27.179 24.741 102.561 1.00 49.91 ? 109 LYS A O 1 +ATOM 869 C CB . LYS A 1 109 ? 27.339 23.048 99.981 1.00 49.71 ? 109 LYS A CB 1 +ATOM 870 C CG . LYS A 1 109 ? 28.475 22.060 100.160 1.00 53.85 ? 109 LYS A CG 1 +ATOM 871 C CD . LYS A 1 109 ? 29.316 21.939 98.891 1.00 53.56 ? 109 LYS A CD 1 +ATOM 872 C CE . LYS A 1 109 ? 29.909 23.270 98.466 1.00 54.98 ? 109 LYS A CE 1 +ATOM 873 N NZ . LYS A 1 109 ? 30.897 23.092 97.365 1.00 55.44 ? 109 LYS A NZ 1 +ATOM 874 N N . ASP A 1 110 ? 27.035 22.642 103.377 1.00 50.47 ? 110 ASP A N 1 +ATOM 875 C CA . ASP A 1 110 ? 27.570 23.006 104.682 1.00 50.86 ? 110 ASP A CA 1 +ATOM 876 C C . ASP A 1 110 ? 26.715 24.125 105.278 1.00 49.93 ? 110 ASP A C 1 +ATOM 877 O O . ASP A 1 110 ? 27.235 25.035 105.934 1.00 50.89 ? 110 ASP A O 1 +ATOM 878 C CB . ASP A 1 110 ? 29.028 23.478 104.553 1.00 53.60 ? 110 ASP A CB 1 +ATOM 879 C CG . ASP A 1 110 ? 29.956 22.393 104.012 1.00 56.81 ? 110 ASP A CG 1 +ATOM 880 O OD1 . ASP A 1 110 ? 29.955 21.268 104.566 1.00 57.59 ? 110 ASP A OD1 1 +ATOM 881 O OD2 . ASP A 1 110 ? 30.695 22.671 103.037 1.00 58.21 ? 110 ASP A OD2 1 +ATOM 882 N N . GLY A 1 111 ? 25.408 24.063 105.031 1.00 48.13 ? 111 GLY A N 1 +ATOM 883 C CA . GLY A 1 111 ? 24.495 25.075 105.546 1.00 43.81 ? 111 GLY A CA 1 +ATOM 884 C C . GLY A 1 111 ? 24.494 26.408 104.807 1.00 41.89 ? 111 GLY A C 1 +ATOM 885 O O . GLY A 1 111 ? 23.708 27.294 105.128 1.00 42.06 ? 111 GLY A O 1 +ATOM 886 N N . VAL A 1 112 ? 25.357 26.553 103.809 1.00 39.94 ? 112 VAL A N 1 +ATOM 887 C CA . VAL A 1 112 ? 25.436 27.800 103.056 1.00 39.82 ? 112 VAL A CA 1 +ATOM 888 C C . VAL A 1 112 ? 24.754 27.685 101.692 1.00 40.71 ? 112 VAL A C 1 +ATOM 889 O O . VAL A 1 112 ? 25.009 26.742 100.923 1.00 39.06 ? 112 VAL A O 1 +ATOM 890 C CB . VAL A 1 112 ? 26.915 28.230 102.847 1.00 39.66 ? 112 VAL A CB 1 +ATOM 891 C CG1 . VAL A 1 112 ? 26.979 29.498 102.010 1.00 37.36 ? 112 VAL A CG1 1 +ATOM 892 C CG2 . VAL A 1 112 ? 27.586 28.453 104.211 1.00 38.21 ? 112 VAL A CG2 1 +ATOM 893 N N . ALA A 1 113 ? 23.904 28.662 101.386 1.00 39.84 ? 113 ALA A N 1 +ATOM 894 C CA . ALA A 1 113 ? 23.175 28.655 100.129 1.00 39.76 ? 113 ALA A CA 1 +ATOM 895 C C . ALA A 1 113 ? 23.789 29.543 99.067 1.00 40.48 ? 113 ALA A C 1 +ATOM 896 O O . ALA A 1 113 ? 24.294 30.627 99.364 1.00 43.30 ? 113 ALA A O 1 +ATOM 897 C CB . ALA A 1 113 ? 21.729 29.072 100.371 1.00 38.95 ? 113 ALA A CB 1 +ATOM 898 N N . THR A 1 114 ? 23.727 29.075 97.826 1.00 39.93 ? 114 THR A N 1 +ATOM 899 C CA . THR A 1 114 ? 24.239 29.813 96.678 1.00 40.88 ? 114 THR A CA 1 +ATOM 900 C C . THR A 1 114 ? 23.256 29.587 95.533 1.00 40.61 ? 114 THR A C 1 +ATOM 901 O O . THR A 1 114 ? 22.795 28.469 95.318 1.00 41.36 ? 114 THR A O 1 +ATOM 902 C CB . THR A 1 114 ? 25.631 29.303 96.246 1.00 40.44 ? 114 THR A CB 1 +ATOM 903 O OG1 . THR A 1 114 ? 26.509 29.311 97.376 1.00 40.99 ? 114 THR A OG1 1 +ATOM 904 C CG2 . THR A 1 114 ? 26.208 30.199 95.154 1.00 38.72 ? 114 THR A CG2 1 +ATOM 905 N N . GLY A 1 115 ? 22.930 30.646 94.804 1.00 40.72 ? 115 GLY A N 1 +ATOM 906 C CA . GLY A 1 115 ? 21.999 30.502 93.706 1.00 40.22 ? 115 GLY A CA 1 +ATOM 907 C C . GLY A 1 115 ? 22.647 30.507 92.337 1.00 40.59 ? 115 GLY A C 1 +ATOM 908 O O . GLY A 1 115 ? 23.711 31.103 92.133 1.00 41.27 ? 115 GLY A O 1 +ATOM 909 N N . TYR A 1 116 ? 22.003 29.828 91.393 1.00 40.13 ? 116 TYR A N 1 +ATOM 910 C CA . TYR A 1 116 ? 22.483 29.775 90.015 1.00 38.94 ? 116 TYR A CA 1 +ATOM 911 C C . TYR A 1 116 ? 21.294 29.992 89.091 1.00 38.18 ? 116 TYR A C 1 +ATOM 912 O O . TYR A 1 116 ? 20.391 29.161 89.022 1.00 38.57 ? 116 TYR A O 1 +ATOM 913 C CB . TYR A 1 116 ? 23.140 28.435 89.725 1.00 37.74 ? 116 TYR A CB 1 +ATOM 914 C CG . TYR A 1 116 ? 24.319 28.157 90.619 1.00 39.25 ? 116 TYR A CG 1 +ATOM 915 C CD1 . TYR A 1 116 ? 24.138 27.606 91.888 1.00 39.32 ? 116 TYR A CD1 1 +ATOM 916 C CD2 . TYR A 1 116 ? 25.620 28.483 90.215 1.00 39.05 ? 116 TYR A CD2 1 +ATOM 917 C CE1 . TYR A 1 116 ? 25.221 27.384 92.739 1.00 39.45 ? 116 TYR A CE1 1 +ATOM 918 C CE2 . TYR A 1 116 ? 26.713 28.269 91.053 1.00 38.50 ? 116 TYR A CE2 1 +ATOM 919 C CZ . TYR A 1 116 ? 26.507 27.718 92.317 1.00 40.33 ? 116 TYR A CZ 1 +ATOM 920 O OH . TYR A 1 116 ? 27.576 27.496 93.163 1.00 39.82 ? 116 TYR A OH 1 +ATOM 921 N N . PHE A 1 117 ? 21.293 31.125 88.398 1.00 37.03 ? 117 PHE A N 1 +ATOM 922 C CA . PHE A 1 117 ? 20.213 31.478 87.492 1.00 34.83 ? 117 PHE A CA 1 +ATOM 923 C C . PHE A 1 117 ? 20.711 31.600 86.062 1.00 35.40 ? 117 PHE A C 1 +ATOM 924 O O . PHE A 1 117 ? 21.531 32.456 85.750 1.00 36.83 ? 117 PHE A O 1 +ATOM 925 C CB . PHE A 1 117 ? 19.585 32.789 87.964 1.00 34.49 ? 117 PHE A CB 1 +ATOM 926 C CG . PHE A 1 117 ? 18.663 33.425 86.969 1.00 33.65 ? 117 PHE A CG 1 +ATOM 927 C CD1 . PHE A 1 117 ? 17.671 32.678 86.332 1.00 34.43 ? 117 PHE A CD1 1 +ATOM 928 C CD2 . PHE A 1 117 ? 18.766 34.784 86.689 1.00 33.16 ? 117 PHE A CD2 1 +ATOM 929 C CE1 . PHE A 1 117 ? 16.787 33.275 85.426 1.00 32.50 ? 117 PHE A CE1 1 +ATOM 930 C CE2 . PHE A 1 117 ? 17.892 35.398 85.786 1.00 34.90 ? 117 PHE A CE2 1 +ATOM 931 C CZ . PHE A 1 117 ? 16.896 34.635 85.151 1.00 34.14 ? 117 PHE A CZ 1 +ATOM 932 N N . PHE A 1 118 ? 20.226 30.728 85.187 1.00 35.99 ? 118 PHE A N 1 +ATOM 933 C CA . PHE A 1 118 ? 20.634 30.773 83.790 1.00 36.00 ? 118 PHE A CA 1 +ATOM 934 C C . PHE A 1 118 ? 19.569 31.489 82.984 1.00 37.10 ? 118 PHE A C 1 +ATOM 935 O O . PHE A 1 118 ? 18.490 30.954 82.754 1.00 39.29 ? 118 PHE A O 1 +ATOM 936 C CB . PHE A 1 118 ? 20.853 29.358 83.276 1.00 33.13 ? 118 PHE A CB 1 +ATOM 937 C CG . PHE A 1 118 ? 21.901 28.613 84.040 1.00 33.97 ? 118 PHE A CG 1 +ATOM 938 C CD1 . PHE A 1 118 ? 21.617 28.094 85.300 1.00 34.42 ? 118 PHE A CD1 1 +ATOM 939 C CD2 . PHE A 1 118 ? 23.196 28.483 83.537 1.00 33.03 ? 118 PHE A CD2 1 +ATOM 940 C CE1 . PHE A 1 118 ? 22.613 27.454 86.056 1.00 33.11 ? 118 PHE A CE1 1 +ATOM 941 C CE2 . PHE A 1 118 ? 24.194 27.850 84.282 1.00 33.29 ? 118 PHE A CE2 1 +ATOM 942 C CZ . PHE A 1 118 ? 23.901 27.335 85.544 1.00 31.85 ? 118 PHE A CZ 1 +ATOM 943 N N . ASN A 1 119 ? 19.871 32.708 82.556 1.00 38.87 ? 119 ASN A N 1 +ATOM 944 C CA . ASN A 1 119 ? 18.900 33.496 81.805 1.00 39.13 ? 119 ASN A CA 1 +ATOM 945 C C . ASN A 1 119 ? 18.746 33.109 80.341 1.00 38.92 ? 119 ASN A C 1 +ATOM 946 O O . ASN A 1 119 ? 19.122 33.855 79.441 1.00 40.17 ? 119 ASN A O 1 +ATOM 947 C CB . ASN A 1 119 ? 19.229 34.988 81.918 1.00 39.72 ? 119 ASN A CB 1 +ATOM 948 C CG . ASN A 1 119 ? 18.113 35.866 81.380 1.00 40.70 ? 119 ASN A CG 1 +ATOM 949 O OD1 . ASN A 1 119 ? 16.948 35.462 81.359 1.00 38.24 ? 119 ASN A OD1 1 +ATOM 950 N ND2 . ASN A 1 119 ? 18.458 37.082 80.963 1.00 42.10 ? 119 ASN A ND2 1 +ATOM 951 N N . SER A 1 120 ? 18.188 31.925 80.118 1.00 39.56 ? 120 SER A N 1 +ATOM 952 C CA . SER A 1 120 ? 17.922 31.418 78.776 1.00 38.35 ? 120 SER A CA 1 +ATOM 953 C C . SER A 1 120 ? 16.516 30.810 78.792 1.00 37.90 ? 120 SER A C 1 +ATOM 954 O O . SER A 1 120 ? 16.176 30.049 79.698 1.00 37.75 ? 120 SER A O 1 +ATOM 955 C CB . SER A 1 120 ? 18.932 30.350 78.385 1.00 38.30 ? 120 SER A CB 1 +ATOM 956 O OG . SER A 1 120 ? 18.590 29.827 77.111 1.00 40.64 ? 120 SER A OG 1 +ATOM 957 N N . ALA A 1 121 ? 15.698 31.157 77.804 1.00 36.43 ? 121 ALA A N 1 +ATOM 958 C CA . ALA A 1 121 ? 14.337 30.642 77.736 1.00 34.47 ? 121 ALA A CA 1 +ATOM 959 C C . ALA A 1 121 ? 14.240 29.483 76.740 1.00 34.95 ? 121 ALA A C 1 +ATOM 960 O O . ALA A 1 121 ? 13.144 29.099 76.316 1.00 35.28 ? 121 ALA A O 1 +ATOM 961 C CB . ALA A 1 121 ? 13.383 31.754 77.346 1.00 33.55 ? 121 ALA A CB 1 +ATOM 962 N N . SER A 1 122 ? 15.392 28.933 76.370 1.00 33.18 ? 122 SER A N 1 +ATOM 963 C CA . SER A 1 122 ? 15.449 27.813 75.449 1.00 31.96 ? 122 SER A CA 1 +ATOM 964 C C . SER A 1 122 ? 15.267 26.531 76.261 1.00 32.28 ? 122 SER A C 1 +ATOM 965 O O . SER A 1 122 ? 15.045 26.588 77.470 1.00 32.70 ? 122 SER A O 1 +ATOM 966 C CB . SER A 1 122 ? 16.801 27.791 74.741 1.00 32.90 ? 122 SER A CB 1 +ATOM 967 O OG . SER A 1 122 ? 17.854 27.565 75.670 1.00 35.17 ? 122 SER A OG 1 +ATOM 968 N N . LYS A 1 123 ? 15.372 25.377 75.609 1.00 32.39 ? 123 LYS A N 1 +ATOM 969 C CA . LYS A 1 123 ? 15.196 24.102 76.301 1.00 33.55 ? 123 LYS A CA 1 +ATOM 970 C C . LYS A 1 123 ? 16.431 23.730 77.122 1.00 33.05 ? 123 LYS A C 1 +ATOM 971 O O . LYS A 1 123 ? 17.235 22.888 76.722 1.00 33.83 ? 123 LYS A O 1 +ATOM 972 C CB . LYS A 1 123 ? 14.875 22.985 75.294 1.00 34.16 ? 123 LYS A CB 1 +ATOM 973 C CG . LYS A 1 123 ? 14.615 21.638 75.948 1.00 37.05 ? 123 LYS A CG 1 +ATOM 974 C CD . LYS A 1 123 ? 14.367 20.523 74.939 1.00 39.52 ? 123 LYS A CD 1 +ATOM 975 C CE . LYS A 1 123 ? 12.989 20.635 74.325 1.00 43.37 ? 123 LYS A CE 1 +ATOM 976 N NZ . LYS A 1 123 ? 12.653 19.452 73.487 1.00 46.68 ? 123 LYS A NZ 1 +ATOM 977 N N . VAL A 1 124 ? 16.564 24.364 78.279 1.00 33.90 ? 124 VAL A N 1 +ATOM 978 C CA . VAL A 1 124 ? 17.691 24.134 79.177 1.00 34.56 ? 124 VAL A CA 1 +ATOM 979 C C . VAL A 1 124 ? 17.562 22.820 79.941 1.00 35.89 ? 124 VAL A C 1 +ATOM 980 O O . VAL A 1 124 ? 16.491 22.493 80.469 1.00 36.76 ? 124 VAL A O 1 +ATOM 981 C CB . VAL A 1 124 ? 17.810 25.270 80.194 1.00 33.08 ? 124 VAL A CB 1 +ATOM 982 C CG1 . VAL A 1 124 ? 18.935 24.967 81.178 1.00 32.28 ? 124 VAL A CG1 1 +ATOM 983 C CG2 . VAL A 1 124 ? 18.051 26.586 79.462 1.00 33.93 ? 124 VAL A CG2 1 +ATOM 984 N N . ILE A 1 125 ? 18.661 22.076 80.010 1.00 35.19 ? 125 ILE A N 1 +ATOM 985 C CA . ILE A 1 125 ? 18.671 20.803 80.720 1.00 36.23 ? 125 ILE A CA 1 +ATOM 986 C C . ILE A 1 125 ? 19.458 20.890 82.024 1.00 37.22 ? 125 ILE A C 1 +ATOM 987 O O . ILE A 1 125 ? 20.615 21.311 82.023 1.00 38.52 ? 125 ILE A O 1 +ATOM 988 C CB . ILE A 1 125 ? 19.338 19.698 79.890 1.00 37.09 ? 125 ILE A CB 1 +ATOM 989 C CG1 . ILE A 1 125 ? 18.747 19.667 78.475 1.00 37.47 ? 125 ILE A CG1 1 +ATOM 990 C CG2 . ILE A 1 125 ? 19.184 18.358 80.614 1.00 36.17 ? 125 ILE A CG2 1 +ATOM 991 C CD1 . ILE A 1 125 ? 17.241 19.448 78.435 1.00 37.09 ? 125 ILE A CD1 1 +ATOM 992 N N . PHE A 1 126 ? 18.833 20.501 83.128 1.00 37.08 ? 126 PHE A N 1 +ATOM 993 C CA . PHE A 1 126 ? 19.507 20.497 84.415 1.00 36.62 ? 126 PHE A CA 1 +ATOM 994 C C . PHE A 1 126 ? 19.695 19.055 84.841 1.00 36.95 ? 126 PHE A C 1 +ATOM 995 O O . PHE A 1 126 ? 18.776 18.432 85.375 1.00 36.84 ? 126 PHE A O 1 +ATOM 996 C CB . PHE A 1 126 ? 18.696 21.231 85.492 1.00 36.35 ? 126 PHE A CB 1 +ATOM 997 C CG . PHE A 1 126 ? 18.709 22.722 85.352 1.00 37.04 ? 126 PHE A CG 1 +ATOM 998 C CD1 . PHE A 1 126 ? 17.825 23.360 84.492 1.00 36.11 ? 126 PHE A CD1 1 +ATOM 999 C CD2 . PHE A 1 126 ? 19.615 23.495 86.080 1.00 37.65 ? 126 PHE A CD2 1 +ATOM 1000 C CE1 . PHE A 1 126 ? 17.838 24.749 84.356 1.00 36.94 ? 126 PHE A CE1 1 +ATOM 1001 C CE2 . PHE A 1 126 ? 19.639 24.893 85.951 1.00 36.20 ? 126 PHE A CE2 1 +ATOM 1002 C CZ . PHE A 1 126 ? 18.751 25.520 85.089 1.00 35.82 ? 126 PHE A CZ 1 +ATOM 1003 N N . ASP A 1 127 ? 20.880 18.517 84.589 1.00 37.49 ? 127 ASP A N 1 +ATOM 1004 C CA . ASP A 1 127 ? 21.170 17.147 84.985 1.00 40.36 ? 127 ASP A CA 1 +ATOM 1005 C C . ASP A 1 127 ? 21.770 17.193 86.400 1.00 40.32 ? 127 ASP A C 1 +ATOM 1006 O O . ASP A 1 127 ? 22.969 17.434 86.579 1.00 40.59 ? 127 ASP A O 1 +ATOM 1007 C CB . ASP A 1 127 ? 22.148 16.521 84.002 1.00 42.37 ? 127 ASP A CB 1 +ATOM 1008 C CG . ASP A 1 127 ? 22.267 15.036 84.189 1.00 48.03 ? 127 ASP A CG 1 +ATOM 1009 O OD1 . ASP A 1 127 ? 22.692 14.624 85.289 1.00 51.72 ? 127 ASP A OD1 1 +ATOM 1010 O OD2 . ASP A 1 127 ? 21.928 14.276 83.247 1.00 51.62 ? 127 ASP A OD2 1 +ATOM 1011 N N . VAL A 1 128 ? 20.922 16.964 87.399 1.00 38.18 ? 128 VAL A N 1 +ATOM 1012 C CA . VAL A 1 128 ? 21.344 17.032 88.795 1.00 35.86 ? 128 VAL A CA 1 +ATOM 1013 C C . VAL A 1 128 ? 21.811 15.713 89.404 1.00 36.39 ? 128 VAL A C 1 +ATOM 1014 O O . VAL A 1 128 ? 21.042 15.009 90.060 1.00 35.43 ? 128 VAL A O 1 +ATOM 1015 C CB . VAL A 1 128 ? 20.205 17.616 89.655 1.00 33.61 ? 128 VAL A CB 1 +ATOM 1016 C CG1 . VAL A 1 128 ? 20.708 17.945 91.052 1.00 33.20 ? 128 VAL A CG1 1 +ATOM 1017 C CG2 . VAL A 1 128 ? 19.653 18.864 88.984 1.00 32.19 ? 128 VAL A CG2 1 +ATOM 1018 N N . GLY A 1 129 ? 23.082 15.391 89.186 1.00 37.49 ? 129 GLY A N 1 +ATOM 1019 C CA . GLY A 1 129 ? 23.646 14.170 89.732 1.00 37.43 ? 129 GLY A CA 1 +ATOM 1020 C C . GLY A 1 129 ? 23.098 12.901 89.124 1.00 38.54 ? 129 GLY A C 1 +ATOM 1021 O O . GLY A 1 129 ? 22.990 11.886 89.816 1.00 39.93 ? 129 GLY A O 1 +ATOM 1022 N N . LEU A 1 130 ? 22.771 12.944 87.833 1.00 38.56 ? 130 LEU A N 1 +ATOM 1023 C CA . LEU A 1 130 ? 22.219 11.783 87.133 1.00 39.77 ? 130 LEU A CA 1 +ATOM 1024 C C . LEU A 1 130 ? 23.232 11.262 86.113 1.00 40.90 ? 130 LEU A C 1 +ATOM 1025 O O . LEU A 1 130 ? 23.581 10.086 86.118 1.00 41.26 ? 130 LEU A O 1 +ATOM 1026 C CB . LEU A 1 130 ? 20.905 12.183 86.449 1.00 39.94 ? 130 LEU A CB 1 +ATOM 1027 C CG . LEU A 1 130 ? 19.855 11.165 85.978 1.00 39.64 ? 130 LEU A CG 1 +ATOM 1028 C CD1 . LEU A 1 130 ? 20.026 10.854 84.514 1.00 39.60 ? 130 LEU A CD1 1 +ATOM 1029 C CD2 . LEU A 1 130 ? 19.935 9.917 86.824 1.00 40.24 ? 130 LEU A CD2 1 +ATOM 1030 N N . GLU A 1 131 ? 23.699 12.141 85.234 1.00 41.95 ? 131 GLU A N 1 +ATOM 1031 C CA . GLU A 1 131 ? 24.696 11.754 84.243 1.00 44.07 ? 131 GLU A CA 1 +ATOM 1032 C C . GLU A 1 131 ? 25.971 11.411 85.022 1.00 43.37 ? 131 GLU A C 1 +ATOM 1033 O O . GLU A 1 131 ? 26.599 10.380 84.793 1.00 44.08 ? 131 GLU A O 1 +ATOM 1034 C CB . GLU A 1 131 ? 24.953 12.916 83.280 1.00 45.27 ? 131 GLU A CB 1 +ATOM 1035 C CG . GLU A 1 131 ? 25.835 12.559 82.101 1.00 49.56 ? 131 GLU A CG 1 +ATOM 1036 C CD . GLU A 1 131 ? 26.157 13.774 81.247 1.00 53.81 ? 131 GLU A CD 1 +ATOM 1037 O OE1 . GLU A 1 131 ? 25.205 14.459 80.801 1.00 55.75 ? 131 GLU A OE1 1 +ATOM 1038 O OE2 . GLU A 1 131 ? 27.360 14.050 81.022 1.00 56.77 ? 131 GLU A OE2 1 +ATOM 1039 N N . GLU A 1 132 ? 26.344 12.293 85.944 1.00 42.14 ? 132 GLU A N 1 +ATOM 1040 C CA . GLU A 1 132 ? 27.504 12.071 86.794 1.00 41.31 ? 132 GLU A CA 1 +ATOM 1041 C C . GLU A 1 132 ? 27.019 12.252 88.232 1.00 39.91 ? 132 GLU A C 1 +ATOM 1042 O O . GLU A 1 132 ? 26.623 13.344 88.639 1.00 39.75 ? 132 GLU A O 1 +ATOM 1043 C CB . GLU A 1 132 ? 28.624 13.068 86.470 1.00 42.24 ? 132 GLU A CB 1 +ATOM 1044 C CG . GLU A 1 132 ? 29.313 12.865 85.115 1.00 44.63 ? 132 GLU A CG 1 +ATOM 1045 C CD . GLU A 1 132 ? 29.838 11.442 84.901 1.00 48.40 ? 132 GLU A CD 1 +ATOM 1046 O OE1 . GLU A 1 132 ? 30.424 10.859 85.843 1.00 50.17 ? 132 GLU A OE1 1 +ATOM 1047 O OE2 . GLU A 1 132 ? 29.673 10.904 83.778 1.00 49.27 ? 132 GLU A OE2 1 +ATOM 1048 N N . TYR A 1 133 ? 27.036 11.165 88.988 1.00 39.19 ? 133 TYR A N 1 +ATOM 1049 C CA . TYR A 1 133 ? 26.589 11.153 90.379 1.00 38.97 ? 133 TYR A CA 1 +ATOM 1050 C C . TYR A 1 133 ? 27.114 12.306 91.241 1.00 39.84 ? 133 TYR A C 1 +ATOM 1051 O O . TYR A 1 133 ? 26.436 12.762 92.163 1.00 38.87 ? 133 TYR A O 1 +ATOM 1052 C CB . TYR A 1 133 ? 27.001 9.823 91.018 1.00 38.64 ? 133 TYR A CB 1 +ATOM 1053 C CG . TYR A 1 133 ? 26.370 9.534 92.368 1.00 39.05 ? 133 TYR A CG 1 +ATOM 1054 C CD1 . TYR A 1 133 ? 25.073 9.027 92.463 1.00 38.33 ? 133 TYR A CD1 1 +ATOM 1055 C CD2 . TYR A 1 133 ? 27.077 9.759 93.553 1.00 39.45 ? 133 TYR A CD2 1 +ATOM 1056 C CE1 . TYR A 1 133 ? 24.492 8.749 93.700 1.00 38.53 ? 133 TYR A CE1 1 +ATOM 1057 C CE2 . TYR A 1 133 ? 26.508 9.485 94.798 1.00 39.17 ? 133 TYR A CE2 1 +ATOM 1058 C CZ . TYR A 1 133 ? 25.215 8.980 94.865 1.00 40.62 ? 133 TYR A CZ 1 +ATOM 1059 O OH . TYR A 1 133 ? 24.643 8.703 96.091 1.00 41.18 ? 133 TYR A OH 1 +ATOM 1060 N N . ASP A 1 134 ? 28.321 12.776 90.939 1.00 40.30 ? 134 ASP A N 1 +ATOM 1061 C CA . ASP A 1 134 ? 28.938 13.840 91.721 1.00 41.94 ? 134 ASP A CA 1 +ATOM 1062 C C . ASP A 1 134 ? 28.989 15.182 91.006 1.00 41.41 ? 134 ASP A C 1 +ATOM 1063 O O . ASP A 1 134 ? 29.846 16.018 91.298 1.00 40.76 ? 134 ASP A O 1 +ATOM 1064 C CB . ASP A 1 134 ? 30.356 13.417 92.106 1.00 44.44 ? 134 ASP A CB 1 +ATOM 1065 C CG . ASP A 1 134 ? 31.264 13.279 90.895 1.00 48.40 ? 134 ASP A CG 1 +ATOM 1066 O OD1 . ASP A 1 134 ? 30.767 12.834 89.832 1.00 50.31 ? 134 ASP A OD1 1 +ATOM 1067 O OD2 . ASP A 1 134 ? 32.467 13.609 91.002 1.00 50.35 ? 134 ASP A OD2 1 +ATOM 1068 N N . LYS A 1 135 ? 28.069 15.396 90.077 1.00 41.08 ? 135 LYS A N 1 +ATOM 1069 C CA . LYS A 1 135 ? 28.047 16.647 89.342 1.00 40.17 ? 135 LYS A CA 1 +ATOM 1070 C C . LYS A 1 135 ? 26.658 17.143 88.989 1.00 39.77 ? 135 LYS A C 1 +ATOM 1071 O O . LYS A 1 135 ? 25.706 16.370 88.900 1.00 39.88 ? 135 LYS A O 1 +ATOM 1072 C CB . LYS A 1 135 ? 28.844 16.507 88.047 1.00 42.11 ? 135 LYS A CB 1 +ATOM 1073 C CG . LYS A 1 135 ? 30.344 16.580 88.210 1.00 45.05 ? 135 LYS A CG 1 +ATOM 1074 C CD . LYS A 1 135 ? 31.041 16.298 86.896 1.00 48.24 ? 135 LYS A CD 1 +ATOM 1075 C CE . LYS A 1 135 ? 32.513 16.645 86.989 1.00 51.59 ? 135 LYS A CE 1 +ATOM 1076 N NZ . LYS A 1 135 ? 33.071 16.193 88.301 1.00 55.18 ? 135 LYS A NZ 1 +ATOM 1077 N N . VAL A 1 136 ? 26.564 18.454 88.806 1.00 38.09 ? 136 VAL A N 1 +ATOM 1078 C CA . VAL A 1 136 ? 25.344 19.101 88.379 1.00 35.45 ? 136 VAL A CA 1 +ATOM 1079 C C . VAL A 1 136 ? 25.780 19.649 87.029 1.00 37.23 ? 136 VAL A C 1 +ATOM 1080 O O . VAL A 1 136 ? 26.663 20.510 86.963 1.00 38.27 ? 136 VAL A O 1 +ATOM 1081 C CB . VAL A 1 136 ? 24.952 20.283 89.271 1.00 36.00 ? 136 VAL A CB 1 +ATOM 1082 C CG1 . VAL A 1 136 ? 23.714 20.959 88.697 1.00 34.61 ? 136 VAL A CG1 1 +ATOM 1083 C CG2 . VAL A 1 136 ? 24.678 19.811 90.691 1.00 35.21 ? 136 VAL A CG2 1 +ATOM 1084 N N . ILE A 1 137 ? 25.194 19.134 85.952 1.00 36.08 ? 137 ILE A N 1 +ATOM 1085 C CA . ILE A 1 137 ? 25.550 19.588 84.612 1.00 35.31 ? 137 ILE A CA 1 +ATOM 1086 C C . ILE A 1 137 ? 24.373 20.329 83.996 1.00 35.71 ? 137 ILE A C 1 +ATOM 1087 O O . ILE A 1 137 ? 23.264 19.808 83.936 1.00 36.52 ? 137 ILE A O 1 +ATOM 1088 C CB . ILE A 1 137 ? 25.936 18.389 83.715 1.00 35.26 ? 137 ILE A CB 1 +ATOM 1089 C CG1 . ILE A 1 137 ? 27.074 17.607 84.376 1.00 34.80 ? 137 ILE A CG1 1 +ATOM 1090 C CG2 . ILE A 1 137 ? 26.364 18.869 82.338 1.00 31.75 ? 137 ILE A CG2 1 +ATOM 1091 C CD1 . ILE A 1 137 ? 27.419 16.317 83.667 1.00 34.08 ? 137 ILE A CD1 1 +ATOM 1092 N N . VAL A 1 138 ? 24.612 21.557 83.560 1.00 35.74 ? 138 VAL A N 1 +ATOM 1093 C CA . VAL A 1 138 ? 23.570 22.361 82.954 1.00 34.80 ? 138 VAL A CA 1 +ATOM 1094 C C . VAL A 1 138 ? 23.934 22.559 81.500 1.00 36.66 ? 138 VAL A C 1 +ATOM 1095 O O . VAL A 1 138 ? 25.026 23.022 81.193 1.00 39.43 ? 138 VAL A O 1 +ATOM 1096 C CB . VAL A 1 138 ? 23.453 23.739 83.636 1.00 35.65 ? 138 VAL A CB 1 +ATOM 1097 C CG1 . VAL A 1 138 ? 22.388 24.584 82.940 1.00 34.96 ? 138 VAL A CG1 1 +ATOM 1098 C CG2 . VAL A 1 138 ? 23.102 23.565 85.101 1.00 34.22 ? 138 VAL A CG2 1 +ATOM 1099 N N . THR A 1 139 ? 23.017 22.203 80.606 1.00 37.95 ? 139 THR A N 1 +ATOM 1100 C CA . THR A 1 139 ? 23.244 22.344 79.168 1.00 38.04 ? 139 THR A CA 1 +ATOM 1101 C C . THR A 1 139 ? 22.278 23.366 78.576 1.00 38.07 ? 139 THR A C 1 +ATOM 1102 O O . THR A 1 139 ? 21.060 23.203 78.674 1.00 39.15 ? 139 THR A O 1 +ATOM 1103 C CB . THR A 1 139 ? 23.020 21.004 78.430 1.00 38.48 ? 139 THR A CB 1 +ATOM 1104 O OG1 . THR A 1 139 ? 23.799 19.977 79.048 1.00 39.89 ? 139 THR A OG1 1 +ATOM 1105 C CG2 . THR A 1 139 ? 23.437 21.123 76.973 1.00 38.73 ? 139 THR A CG2 1 +ATOM 1106 N N . ILE A 1 140 ? 22.817 24.421 77.976 1.00 38.68 ? 140 ILE A N 1 +ATOM 1107 C CA . ILE A 1 140 ? 21.977 25.439 77.356 1.00 38.87 ? 140 ILE A CA 1 +ATOM 1108 C C . ILE A 1 140 ? 22.142 25.266 75.860 1.00 40.15 ? 140 ILE A C 1 +ATOM 1109 O O . ILE A 1 140 ? 23.246 25.371 75.336 1.00 41.01 ? 140 ILE A O 1 +ATOM 1110 C CB . ILE A 1 140 ? 22.399 26.870 77.733 1.00 37.55 ? 140 ILE A CB 1 +ATOM 1111 C CG1 . ILE A 1 140 ? 22.319 27.071 79.246 1.00 38.54 ? 140 ILE A CG1 1 +ATOM 1112 C CG2 . ILE A 1 140 ? 21.490 27.869 77.052 1.00 37.37 ? 140 ILE A CG2 1 +ATOM 1113 C CD1 . ILE A 1 140 ? 23.530 26.542 80.001 1.00 39.11 ? 140 ILE A CD1 1 +ATOM 1114 N N . PRO A 1 141 ? 21.045 24.977 75.150 1.00 41.84 ? 141 PRO A N 1 +ATOM 1115 C CA . PRO A 1 141 ? 21.109 24.790 73.697 1.00 42.78 ? 141 PRO A CA 1 +ATOM 1116 C C . PRO A 1 141 ? 21.304 26.082 72.901 1.00 43.96 ? 141 PRO A C 1 +ATOM 1117 O O . PRO A 1 141 ? 20.508 26.410 72.025 1.00 45.21 ? 141 PRO A O 1 +ATOM 1118 C CB . PRO A 1 141 ? 19.784 24.101 73.388 1.00 41.27 ? 141 PRO A CB 1 +ATOM 1119 C CG . PRO A 1 141 ? 18.859 24.735 74.376 1.00 42.47 ? 141 PRO A CG 1 +ATOM 1120 C CD . PRO A 1 141 ? 19.682 24.726 75.653 1.00 41.59 ? 141 PRO A CD 1 +ATOM 1121 N N . GLU A 1 142 ? 22.359 26.820 73.226 1.00 46.39 ? 142 GLU A N 1 +ATOM 1122 C CA . GLU A 1 142 ? 22.697 28.060 72.529 1.00 47.92 ? 142 GLU A CA 1 +ATOM 1123 C C . GLU A 1 142 ? 24.217 28.186 72.591 1.00 49.03 ? 142 GLU A C 1 +ATOM 1124 O O . GLU A 1 142 ? 24.852 27.593 73.468 1.00 49.24 ? 142 GLU A O 1 +ATOM 1125 C CB . GLU A 1 142 ? 22.042 29.268 73.204 1.00 48.75 ? 142 GLU A CB 1 +ATOM 1126 C CG . GLU A 1 142 ? 20.544 29.137 73.399 1.00 53.60 ? 142 GLU A CG 1 +ATOM 1127 C CD . GLU A 1 142 ? 19.869 30.475 73.696 1.00 58.68 ? 142 GLU A CD 1 +ATOM 1128 O OE1 . GLU A 1 142 ? 19.735 31.300 72.759 1.00 59.60 ? 142 GLU A OE1 1 +ATOM 1129 O OE2 . GLU A 1 142 ? 19.476 30.711 74.866 1.00 61.82 ? 142 GLU A OE2 1 +ATOM 1130 N N . ASP A 1 143 ? 24.806 28.939 71.668 1.00 50.74 ? 143 ASP A N 1 +ATOM 1131 C CA . ASP A 1 143 ? 26.259 29.108 71.658 1.00 52.17 ? 143 ASP A CA 1 +ATOM 1132 C C . ASP A 1 143 ? 26.740 30.125 72.697 1.00 52.14 ? 143 ASP A C 1 +ATOM 1133 O O . ASP A 1 143 ? 27.914 30.136 73.062 1.00 53.08 ? 143 ASP A O 1 +ATOM 1134 C CB . ASP A 1 143 ? 26.750 29.522 70.263 1.00 54.78 ? 143 ASP A CB 1 +ATOM 1135 C CG . ASP A 1 143 ? 26.098 30.807 69.758 1.00 58.32 ? 143 ASP A CG 1 +ATOM 1136 O OD1 . ASP A 1 143 ? 26.096 31.822 70.488 1.00 59.55 ? 143 ASP A OD1 1 +ATOM 1137 O OD2 . ASP A 1 143 ? 25.592 30.807 68.615 1.00 61.62 ? 143 ASP A OD2 1 +ATOM 1138 N N . SER A 1 144 ? 25.830 30.971 73.172 1.00 50.93 ? 144 SER A N 1 +ATOM 1139 C CA . SER A 1 144 ? 26.156 31.988 74.165 1.00 50.28 ? 144 SER A CA 1 +ATOM 1140 C C . SER A 1 144 ? 25.112 31.969 75.265 1.00 50.01 ? 144 SER A C 1 +ATOM 1141 O O . SER A 1 144 ? 23.991 31.497 75.062 1.00 51.67 ? 144 SER A O 1 +ATOM 1142 C CB . SER A 1 144 ? 26.168 33.380 73.527 1.00 51.46 ? 144 SER A CB 1 +ATOM 1143 O OG . SER A 1 144 ? 27.185 33.489 72.548 1.00 53.00 ? 144 SER A OG 1 +ATOM 1144 N N . VAL A 1 145 ? 25.465 32.491 76.431 1.00 47.95 ? 145 VAL A N 1 +ATOM 1145 C CA . VAL A 1 145 ? 24.517 32.520 77.528 1.00 45.06 ? 145 VAL A CA 1 +ATOM 1146 C C . VAL A 1 145 ? 25.029 33.346 78.690 1.00 45.07 ? 145 VAL A C 1 +ATOM 1147 O O . VAL A 1 145 ? 26.235 33.482 78.889 1.00 45.08 ? 145 VAL A O 1 +ATOM 1148 C CB . VAL A 1 145 ? 24.218 31.092 78.038 1.00 43.24 ? 145 VAL A CB 1 +ATOM 1149 C CG1 . VAL A 1 145 ? 25.453 30.504 78.681 1.00 43.09 ? 145 VAL A CG1 1 +ATOM 1150 C CG2 . VAL A 1 145 ? 23.057 31.117 79.020 1.00 43.02 ? 145 VAL A CG2 1 +ATOM 1151 N N . GLU A 1 146 ? 24.101 33.912 79.447 1.00 44.84 ? 146 GLU A N 1 +ATOM 1152 C CA . GLU A 1 146 ? 24.463 34.680 80.614 1.00 45.79 ? 146 GLU A CA 1 +ATOM 1153 C C . GLU A 1 146 ? 23.755 34.049 81.806 1.00 45.77 ? 146 GLU A C 1 +ATOM 1154 O O . GLU A 1 146 ? 22.550 33.800 81.758 1.00 46.57 ? 146 GLU A O 1 +ATOM 1155 C CB . GLU A 1 146 ? 24.037 36.151 80.476 1.00 46.32 ? 146 GLU A CB 1 +ATOM 1156 C CG . GLU A 1 146 ? 22.539 36.391 80.319 1.00 48.72 ? 146 GLU A CG 1 +ATOM 1157 C CD . GLU A 1 146 ? 22.158 37.867 80.457 1.00 51.51 ? 146 GLU A CD 1 +ATOM 1158 O OE1 . GLU A 1 146 ? 22.812 38.721 79.813 1.00 53.35 ? 146 GLU A OE1 1 +ATOM 1159 O OE2 . GLU A 1 146 ? 21.197 38.175 81.201 1.00 51.53 ? 146 GLU A OE2 1 +ATOM 1160 N N . PHE A 1 147 ? 24.509 33.739 82.854 1.00 44.35 ? 147 PHE A N 1 +ATOM 1161 C CA . PHE A 1 147 ? 23.905 33.200 84.059 1.00 42.78 ? 147 PHE A CA 1 +ATOM 1162 C C . PHE A 1 147 ? 24.471 33.948 85.254 1.00 42.87 ? 147 PHE A C 1 +ATOM 1163 O O . PHE A 1 147 ? 25.468 34.656 85.139 1.00 43.33 ? 147 PHE A O 1 +ATOM 1164 C CB . PHE A 1 147 ? 24.118 31.689 84.191 1.00 41.67 ? 147 PHE A CB 1 +ATOM 1165 C CG . PHE A 1 147 ? 25.553 31.263 84.284 1.00 41.58 ? 147 PHE A CG 1 +ATOM 1166 C CD1 . PHE A 1 147 ? 26.345 31.174 83.149 1.00 40.91 ? 147 PHE A CD1 1 +ATOM 1167 C CD2 . PHE A 1 147 ? 26.093 30.883 85.514 1.00 41.99 ? 147 PHE A CD2 1 +ATOM 1168 C CE1 . PHE A 1 147 ? 27.657 30.704 83.231 1.00 41.80 ? 147 PHE A CE1 1 +ATOM 1169 C CE2 . PHE A 1 147 ? 27.398 30.415 85.611 1.00 40.96 ? 147 PHE A CE2 1 +ATOM 1170 C CZ . PHE A 1 147 ? 28.184 30.322 84.467 1.00 41.98 ? 147 PHE A CZ 1 +ATOM 1171 N N . TYR A 1 148 ? 23.829 33.806 86.402 1.00 42.35 ? 148 TYR A N 1 +ATOM 1172 C CA . TYR A 1 148 ? 24.266 34.518 87.581 1.00 42.37 ? 148 TYR A CA 1 +ATOM 1173 C C . TYR A 1 148 ? 24.522 33.599 88.758 1.00 43.06 ? 148 TYR A C 1 +ATOM 1174 O O . TYR A 1 148 ? 23.803 32.621 88.958 1.00 43.75 ? 148 TYR A O 1 +ATOM 1175 C CB . TYR A 1 148 ? 23.203 35.538 87.990 1.00 42.60 ? 148 TYR A CB 1 +ATOM 1176 C CG . TYR A 1 148 ? 22.764 36.469 86.887 1.00 42.20 ? 148 TYR A CG 1 +ATOM 1177 C CD1 . TYR A 1 148 ? 22.014 35.999 85.808 1.00 42.29 ? 148 TYR A CD1 1 +ATOM 1178 C CD2 . TYR A 1 148 ? 23.094 37.825 86.924 1.00 41.71 ? 148 TYR A CD2 1 +ATOM 1179 C CE1 . TYR A 1 148 ? 21.602 36.866 84.789 1.00 43.32 ? 148 TYR A CE1 1 +ATOM 1180 C CE2 . TYR A 1 148 ? 22.693 38.696 85.919 1.00 41.79 ? 148 TYR A CE2 1 +ATOM 1181 C CZ . TYR A 1 148 ? 21.946 38.215 84.855 1.00 43.00 ? 148 TYR A CZ 1 +ATOM 1182 O OH . TYR A 1 148 ? 21.540 39.084 83.866 1.00 44.63 ? 148 TYR A OH 1 +ATOM 1183 N N . VAL A 1 149 ? 25.558 33.910 89.529 1.00 42.00 ? 149 VAL A N 1 +ATOM 1184 C CA . VAL A 1 149 ? 25.857 33.145 90.732 1.00 40.76 ? 149 VAL A CA 1 +ATOM 1185 C C . VAL A 1 149 ? 25.447 34.117 91.837 1.00 40.79 ? 149 VAL A C 1 +ATOM 1186 O O . VAL A 1 149 ? 25.988 35.219 91.944 1.00 40.40 ? 149 VAL A O 1 +ATOM 1187 C CB . VAL A 1 149 ? 27.342 32.805 90.823 1.00 40.38 ? 149 VAL A CB 1 +ATOM 1188 C CG1 . VAL A 1 149 ? 27.603 31.929 92.045 1.00 38.48 ? 149 VAL A CG1 1 +ATOM 1189 C CG2 . VAL A 1 149 ? 27.772 32.094 89.557 1.00 37.61 ? 149 VAL A CG2 1 +ATOM 1190 N N . ILE A 1 150 ? 24.465 33.716 92.633 1.00 40.93 ? 150 ILE A N 1 +ATOM 1191 C CA . ILE A 1 150 ? 23.930 34.571 93.682 1.00 42.88 ? 150 ILE A CA 1 +ATOM 1192 C C . ILE A 1 150 ? 24.305 34.087 95.077 1.00 45.85 ? 150 ILE A C 1 +ATOM 1193 O O . ILE A 1 150 ? 23.811 33.051 95.535 1.00 47.15 ? 150 ILE A O 1 +ATOM 1194 C CB . ILE A 1 150 ? 22.394 34.637 93.561 1.00 41.92 ? 150 ILE A CB 1 +ATOM 1195 C CG1 . ILE A 1 150 ? 22.015 34.935 92.102 1.00 41.61 ? 150 ILE A CG1 1 +ATOM 1196 C CG2 . ILE A 1 150 ? 21.836 35.706 94.480 1.00 40.61 ? 150 ILE A CG2 1 +ATOM 1197 C CD1 . ILE A 1 150 ? 20.543 34.813 91.803 1.00 38.99 ? 150 ILE A CD1 1 +ATOM 1198 N N . GLU A 1 151 ? 25.176 34.842 95.748 1.00 46.68 ? 151 GLU A N 1 +ATOM 1199 C CA . GLU A 1 151 ? 25.623 34.486 97.086 1.00 47.79 ? 151 GLU A CA 1 +ATOM 1200 C C . GLU A 1 151 ? 24.491 34.586 98.107 1.00 46.80 ? 151 GLU A C 1 +ATOM 1201 O O . GLU A 1 151 ? 23.542 35.362 97.941 1.00 46.27 ? 151 GLU A O 1 +ATOM 1202 C CB . GLU A 1 151 ? 26.792 35.382 97.514 1.00 51.06 ? 151 GLU A CB 1 +ATOM 1203 C CG . GLU A 1 151 ? 28.038 35.250 96.646 1.00 56.30 ? 151 GLU A CG 1 +ATOM 1204 C CD . GLU A 1 151 ? 28.506 33.802 96.495 1.00 60.79 ? 151 GLU A CD 1 +ATOM 1205 O OE1 . GLU A 1 151 ? 28.719 33.115 97.522 1.00 63.31 ? 151 GLU A OE1 1 +ATOM 1206 O OE2 . GLU A 1 151 ? 28.671 33.345 95.342 1.00 63.01 ? 151 GLU A OE2 1 +ATOM 1207 N N . GLY A 1 152 ? 24.602 33.785 99.160 1.00 45.76 ? 152 GLY A N 1 +ATOM 1208 C CA . GLY A 1 152 ? 23.596 33.785 100.202 1.00 45.98 ? 152 GLY A CA 1 +ATOM 1209 C C . GLY A 1 152 ? 24.035 34.629 101.383 1.00 45.98 ? 152 GLY A C 1 +ATOM 1210 O O . GLY A 1 152 ? 24.057 35.860 101.280 1.00 47.51 ? 152 GLY A O 1 +ATOM 1211 N N . PRO A 1 153 ? 24.414 34.004 102.514 1.00 44.51 ? 153 PRO A N 1 +ATOM 1212 C CA . PRO A 1 153 ? 24.457 32.553 102.718 1.00 44.33 ? 153 PRO A CA 1 +ATOM 1213 C C . PRO A 1 153 ? 23.104 31.919 103.043 1.00 44.42 ? 153 PRO A C 1 +ATOM 1214 O O . PRO A 1 153 ? 22.962 30.701 102.974 1.00 44.93 ? 153 PRO A O 1 +ATOM 1215 C CB . PRO A 1 153 ? 25.453 32.399 103.863 1.00 42.68 ? 153 PRO A CB 1 +ATOM 1216 C CG . PRO A 1 153 ? 25.133 33.586 104.709 1.00 41.30 ? 153 PRO A CG 1 +ATOM 1217 C CD . PRO A 1 153 ? 24.999 34.704 103.674 1.00 44.66 ? 153 PRO A CD 1 +ATOM 1218 N N . ARG A 1 154 ? 22.116 32.720 103.422 1.00 45.68 ? 154 ARG A N 1 +ATOM 1219 C CA . ARG A 1 154 ? 20.794 32.159 103.715 1.00 46.33 ? 154 ARG A CA 1 +ATOM 1220 C C . ARG A 1 154 ? 20.014 32.029 102.415 1.00 45.86 ? 154 ARG A C 1 +ATOM 1221 O O . ARG A 1 154 ? 20.239 32.782 101.457 1.00 44.80 ? 154 ARG A O 1 +ATOM 1222 C CB . ARG A 1 154 ? 19.989 33.060 104.649 1.00 48.83 ? 154 ARG A CB 1 +ATOM 1223 C CG . ARG A 1 154 ? 20.212 32.857 106.134 1.00 53.45 ? 154 ARG A CG 1 +ATOM 1224 C CD . ARG A 1 154 ? 19.240 33.752 106.893 1.00 57.25 ? 154 ARG A CD 1 +ATOM 1225 N NE . ARG A 1 154 ? 19.318 35.143 106.431 1.00 60.05 ? 154 ARG A NE 1 +ATOM 1226 C CZ . ARG A 1 154 ? 18.263 35.935 106.240 1.00 60.73 ? 154 ARG A CZ 1 +ATOM 1227 N NH1 . ARG A 1 154 ? 17.036 35.477 106.470 1.00 61.00 ? 154 ARG A NH1 1 +ATOM 1228 N NH2 . ARG A 1 154 ? 18.430 37.185 105.820 1.00 59.60 ? 154 ARG A NH2 1 +ATOM 1229 N N . ILE A 1 155 ? 19.082 31.084 102.387 1.00 43.81 ? 155 ILE A N 1 +ATOM 1230 C CA . ILE A 1 155 ? 18.269 30.891 101.199 1.00 42.20 ? 155 ILE A CA 1 +ATOM 1231 C C . ILE A 1 155 ? 17.505 32.184 100.949 1.00 41.45 ? 155 ILE A C 1 +ATOM 1232 O O . ILE A 1 155 ? 17.353 32.610 99.806 1.00 41.60 ? 155 ILE A O 1 +ATOM 1233 C CB . ILE A 1 155 ? 17.280 29.711 101.381 1.00 41.68 ? 155 ILE A CB 1 +ATOM 1234 C CG1 . ILE A 1 155 ? 18.056 28.397 101.458 1.00 39.41 ? 155 ILE A CG1 1 +ATOM 1235 C CG2 . ILE A 1 155 ? 16.301 29.662 100.224 1.00 39.50 ? 155 ILE A CG2 1 +ATOM 1236 C CD1 . ILE A 1 155 ? 17.194 27.206 101.813 1.00 40.10 ? 155 ILE A CD1 1 +ATOM 1237 N N . GLU A 1 156 ? 17.045 32.818 102.025 1.00 41.65 ? 156 GLU A N 1 +ATOM 1238 C CA . GLU A 1 156 ? 16.310 34.072 101.900 1.00 43.14 ? 156 GLU A CA 1 +ATOM 1239 C C . GLU A 1 156 ? 17.170 35.155 101.249 1.00 43.29 ? 156 GLU A C 1 +ATOM 1240 O O . GLU A 1 156 ? 16.658 36.003 100.516 1.00 43.34 ? 156 GLU A O 1 +ATOM 1241 C CB . GLU A 1 156 ? 15.818 34.552 103.269 1.00 43.79 ? 156 GLU A CB 1 +ATOM 1242 C CG . GLU A 1 156 ? 14.943 35.795 103.184 1.00 46.74 ? 156 GLU A CG 1 +ATOM 1243 C CD . GLU A 1 156 ? 14.211 36.098 104.479 1.00 49.19 ? 156 GLU A CD 1 +ATOM 1244 O OE1 . GLU A 1 156 ? 14.855 36.578 105.446 1.00 51.04 ? 156 GLU A OE1 1 +ATOM 1245 O OE2 . GLU A 1 156 ? 12.985 35.848 104.527 1.00 49.29 ? 156 GLU A OE2 1 +ATOM 1246 N N . ASP A 1 157 ? 18.471 35.133 101.510 1.00 44.76 ? 157 ASP A N 1 +ATOM 1247 C CA . ASP A 1 157 ? 19.350 36.130 100.910 1.00 46.87 ? 157 ASP A CA 1 +ATOM 1248 C C . ASP A 1 157 ? 19.363 35.947 99.408 1.00 45.02 ? 157 ASP A C 1 +ATOM 1249 O O . ASP A 1 157 ? 19.210 36.914 98.656 1.00 45.43 ? 157 ASP A O 1 +ATOM 1250 C CB . ASP A 1 157 ? 20.776 36.007 101.455 1.00 50.62 ? 157 ASP A CB 1 +ATOM 1251 C CG . ASP A 1 157 ? 20.896 36.508 102.879 1.00 55.29 ? 157 ASP A CG 1 +ATOM 1252 O OD1 . ASP A 1 157 ? 20.651 37.721 103.106 1.00 57.72 ? 157 ASP A OD1 1 +ATOM 1253 O OD2 . ASP A 1 157 ? 21.227 35.690 103.768 1.00 57.43 ? 157 ASP A OD2 1 +ATOM 1254 N N . VAL A 1 158 ? 19.543 34.699 98.980 1.00 42.71 ? 158 VAL A N 1 +ATOM 1255 C CA . VAL A 1 158 ? 19.575 34.373 97.560 1.00 41.02 ? 158 VAL A CA 1 +ATOM 1256 C C . VAL A 1 158 ? 18.317 34.886 96.863 1.00 40.01 ? 158 VAL A C 1 +ATOM 1257 O O . VAL A 1 158 ? 18.405 35.543 95.825 1.00 39.45 ? 158 VAL A O 1 +ATOM 1258 C CB . VAL A 1 158 ? 19.678 32.850 97.332 1.00 40.87 ? 158 VAL A CB 1 +ATOM 1259 C CG1 . VAL A 1 158 ? 19.639 32.554 95.839 1.00 42.21 ? 158 VAL A CG1 1 +ATOM 1260 C CG2 . VAL A 1 158 ? 20.969 32.311 97.935 1.00 41.33 ? 158 VAL A CG2 1 +ATOM 1261 N N . LEU A 1 159 ? 17.153 34.600 97.444 1.00 39.31 ? 159 LEU A N 1 +ATOM 1262 C CA . LEU A 1 159 ? 15.887 35.036 96.858 1.00 41.06 ? 159 LEU A CA 1 +ATOM 1263 C C . LEU A 1 159 ? 15.716 36.546 96.809 1.00 41.22 ? 159 LEU A C 1 +ATOM 1264 O O . LEU A 1 159 ? 15.116 37.065 95.872 1.00 41.72 ? 159 LEU A O 1 +ATOM 1265 C CB . LEU A 1 159 ? 14.701 34.392 97.589 1.00 41.18 ? 159 LEU A CB 1 +ATOM 1266 C CG . LEU A 1 159 ? 14.610 32.878 97.351 1.00 41.94 ? 159 LEU A CG 1 +ATOM 1267 C CD1 . LEU A 1 159 ? 13.407 32.306 98.054 1.00 42.38 ? 159 LEU A CD1 1 +ATOM 1268 C CD2 . LEU A 1 159 ? 14.512 32.603 95.856 1.00 42.62 ? 159 LEU A CD2 1 +ATOM 1269 N N . GLU A 1 160 ? 16.236 37.259 97.807 1.00 42.22 ? 160 GLU A N 1 +ATOM 1270 C CA . GLU A 1 160 ? 16.132 38.717 97.800 1.00 41.58 ? 160 GLU A CA 1 +ATOM 1271 C C . GLU A 1 160 ? 16.936 39.243 96.623 1.00 40.95 ? 160 GLU A C 1 +ATOM 1272 O O . GLU A 1 160 ? 16.449 40.069 95.852 1.00 41.84 ? 160 GLU A O 1 +ATOM 1273 C CB . GLU A 1 160 ? 16.682 39.325 99.088 1.00 43.02 ? 160 GLU A CB 1 +ATOM 1274 C CG . GLU A 1 160 ? 15.895 38.992 100.338 1.00 48.61 ? 160 GLU A CG 1 +ATOM 1275 C CD . GLU A 1 160 ? 16.421 39.709 101.584 1.00 51.16 ? 160 GLU A CD 1 +ATOM 1276 O OE1 . GLU A 1 160 ? 17.662 39.832 101.731 1.00 52.51 ? 160 GLU A OE1 1 +ATOM 1277 O OE2 . GLU A 1 160 ? 15.591 40.133 102.423 1.00 51.84 ? 160 GLU A OE2 1 +ATOM 1278 N N . LYS A 1 161 ? 18.166 38.759 96.481 1.00 39.18 ? 161 LYS A N 1 +ATOM 1279 C CA . LYS A 1 161 ? 19.012 39.208 95.384 1.00 40.20 ? 161 LYS A CA 1 +ATOM 1280 C C . LYS A 1 161 ? 18.391 38.810 94.051 1.00 40.03 ? 161 LYS A C 1 +ATOM 1281 O O . LYS A 1 161 ? 18.345 39.610 93.117 1.00 39.83 ? 161 LYS A O 1 +ATOM 1282 C CB . LYS A 1 161 ? 20.420 38.607 95.500 1.00 40.81 ? 161 LYS A CB 1 +ATOM 1283 C CG . LYS A 1 161 ? 21.199 39.057 96.736 1.00 41.86 ? 161 LYS A CG 1 +ATOM 1284 C CD . LYS A 1 161 ? 22.649 38.599 96.644 1.00 42.76 ? 161 LYS A CD 1 +ATOM 1285 C CE . LYS A 1 161 ? 23.429 38.920 97.903 1.00 43.03 ? 161 LYS A CE 1 +ATOM 1286 N NZ . LYS A 1 161 ? 22.966 38.122 99.075 1.00 43.62 ? 161 LYS A NZ 1 +ATOM 1287 N N . TYR A 1 162 ? 17.918 37.567 93.969 1.00 39.65 ? 162 TYR A N 1 +ATOM 1288 C CA . TYR A 1 162 ? 17.290 37.073 92.751 1.00 38.32 ? 162 TYR A CA 1 +ATOM 1289 C C . TYR A 1 162 ? 16.099 37.950 92.382 1.00 38.33 ? 162 TYR A C 1 +ATOM 1290 O O . TYR A 1 162 ? 15.946 38.339 91.227 1.00 37.82 ? 162 TYR A O 1 +ATOM 1291 C CB . TYR A 1 162 ? 16.817 35.627 92.941 1.00 37.85 ? 162 TYR A CB 1 +ATOM 1292 C CG . TYR A 1 162 ? 15.961 35.131 91.801 1.00 34.57 ? 162 TYR A CG 1 +ATOM 1293 C CD1 . TYR A 1 162 ? 16.526 34.789 90.572 1.00 32.85 ? 162 TYR A CD1 1 +ATOM 1294 C CD2 . TYR A 1 162 ? 14.570 35.081 91.931 1.00 36.31 ? 162 TYR A CD2 1 +ATOM 1295 C CE1 . TYR A 1 162 ? 15.727 34.413 89.495 1.00 34.81 ? 162 TYR A CE1 1 +ATOM 1296 C CE2 . TYR A 1 162 ? 13.758 34.709 90.866 1.00 36.57 ? 162 TYR A CE2 1 +ATOM 1297 C CZ . TYR A 1 162 ? 14.342 34.377 89.653 1.00 36.56 ? 162 TYR A CZ 1 +ATOM 1298 O OH . TYR A 1 162 ? 13.528 34.015 88.611 1.00 38.95 ? 162 TYR A OH 1 +ATOM 1299 N N . THR A 1 163 ? 15.262 38.254 93.370 1.00 39.07 ? 163 THR A N 1 +ATOM 1300 C CA . THR A 1 163 ? 14.086 39.090 93.152 1.00 41.04 ? 163 THR A CA 1 +ATOM 1301 C C . THR A 1 163 ? 14.490 40.509 92.768 1.00 42.82 ? 163 THR A C 1 +ATOM 1302 O O . THR A 1 163 ? 13.809 41.172 91.982 1.00 43.02 ? 163 THR A O 1 +ATOM 1303 C CB . THR A 1 163 ? 13.210 39.147 94.412 1.00 41.40 ? 163 THR A CB 1 +ATOM 1304 O OG1 . THR A 1 163 ? 12.734 37.831 94.716 1.00 43.60 ? 163 THR A OG1 1 +ATOM 1305 C CG2 . THR A 1 163 ? 12.019 40.062 94.191 1.00 41.16 ? 163 THR A CG2 1 +ATOM 1306 N N . GLU A 1 164 ? 15.596 40.973 93.337 1.00 44.15 ? 164 GLU A N 1 +ATOM 1307 C CA . GLU A 1 164 ? 16.095 42.301 93.039 1.00 46.52 ? 164 GLU A CA 1 +ATOM 1308 C C . GLU A 1 164 ? 16.450 42.307 91.552 1.00 45.32 ? 164 GLU A C 1 +ATOM 1309 O O . GLU A 1 164 ? 16.150 43.261 90.818 1.00 45.92 ? 164 GLU A O 1 +ATOM 1310 C CB . GLU A 1 164 ? 17.348 42.591 93.880 1.00 51.31 ? 164 GLU A CB 1 +ATOM 1311 C CG . GLU A 1 164 ? 18.020 43.927 93.580 1.00 58.03 ? 164 GLU A CG 1 +ATOM 1312 C CD . GLU A 1 164 ? 17.370 45.087 94.315 1.00 63.94 ? 164 GLU A CD 1 +ATOM 1313 O OE1 . GLU A 1 164 ? 16.122 45.100 94.429 1.00 66.06 ? 164 GLU A OE1 1 +ATOM 1314 O OE2 . GLU A 1 164 ? 18.110 45.991 94.776 1.00 67.65 ? 164 GLU A OE2 1 +ATOM 1315 N N . LEU A 1 165 ? 17.069 41.216 91.115 1.00 42.50 ? 165 LEU A N 1 +ATOM 1316 C CA . LEU A 1 165 ? 17.502 41.068 89.730 1.00 41.92 ? 165 LEU A CA 1 +ATOM 1317 C C . LEU A 1 165 ? 16.364 40.925 88.700 1.00 41.08 ? 165 LEU A C 1 +ATOM 1318 O O . LEU A 1 165 ? 16.308 41.668 87.721 1.00 41.88 ? 165 LEU A O 1 +ATOM 1319 C CB . LEU A 1 165 ? 18.429 39.853 89.615 1.00 40.15 ? 165 LEU A CB 1 +ATOM 1320 C CG . LEU A 1 165 ? 19.540 39.822 88.561 1.00 40.62 ? 165 LEU A CG 1 +ATOM 1321 C CD1 . LEU A 1 165 ? 19.708 38.393 88.076 1.00 41.50 ? 165 LEU A CD1 1 +ATOM 1322 C CD2 . LEU A 1 165 ? 19.216 40.719 87.396 1.00 41.99 ? 165 LEU A CD2 1 +ATOM 1323 N N . THR A 1 166 ? 15.463 39.974 88.920 1.00 39.82 ? 166 THR A N 1 +ATOM 1324 C CA . THR A 1 166 ? 14.385 39.732 87.966 1.00 39.49 ? 166 THR A CA 1 +ATOM 1325 C C . THR A 1 166 ? 13.100 40.531 88.156 1.00 39.65 ? 166 THR A C 1 +ATOM 1326 O O . THR A 1 166 ? 12.304 40.647 87.223 1.00 39.43 ? 166 THR A O 1 +ATOM 1327 C CB . THR A 1 166 ? 14.042 38.223 87.899 1.00 38.61 ? 166 THR A CB 1 +ATOM 1328 O OG1 . THR A 1 166 ? 13.569 37.767 89.176 1.00 38.23 ? 166 THR A OG1 1 +ATOM 1329 C CG2 . THR A 1 166 ? 15.290 37.422 87.517 1.00 36.81 ? 166 THR A CG2 1 +ATOM 1330 N N . GLY A 1 167 ? 12.897 41.087 89.349 1.00 39.81 ? 167 GLY A N 1 +ATOM 1331 C CA . GLY A 1 167 ? 11.702 41.875 89.595 1.00 39.46 ? 167 GLY A CA 1 +ATOM 1332 C C . GLY A 1 167 ? 10.933 41.495 90.847 1.00 40.98 ? 167 GLY A C 1 +ATOM 1333 O O . GLY A 1 167 ? 10.734 40.320 91.141 1.00 41.41 ? 167 GLY A O 1 +ATOM 1334 N N . LYS A 1 168 ? 10.508 42.499 91.601 1.00 41.96 ? 168 LYS A N 1 +ATOM 1335 C CA . LYS A 1 168 ? 9.744 42.258 92.813 1.00 43.47 ? 168 LYS A CA 1 +ATOM 1336 C C . LYS A 1 168 ? 8.309 41.906 92.418 1.00 43.27 ? 168 LYS A C 1 +ATOM 1337 O O . LYS A 1 168 ? 7.786 42.389 91.414 1.00 43.56 ? 168 LYS A O 1 +ATOM 1338 C CB . LYS A 1 168 ? 9.715 43.514 93.697 1.00 44.86 ? 168 LYS A CB 1 +ATOM 1339 C CG . LYS A 1 168 ? 11.069 44.030 94.170 1.00 48.24 ? 168 LYS A CG 1 +ATOM 1340 C CD . LYS A 1 168 ? 11.712 43.099 95.190 1.00 51.91 ? 168 LYS A CD 1 +ATOM 1341 C CE . LYS A 1 168 ? 13.063 43.641 95.678 1.00 53.32 ? 168 LYS A CE 1 +ATOM 1342 N NZ . LYS A 1 168 ? 13.791 42.670 96.557 1.00 54.98 ? 168 LYS A NZ 1 +ATOM 1343 N N . PRO A 1 169 ? 7.657 41.044 93.196 1.00 42.53 ? 169 PRO A N 1 +ATOM 1344 C CA . PRO A 1 169 ? 6.275 40.671 92.887 1.00 42.78 ? 169 PRO A CA 1 +ATOM 1345 C C . PRO A 1 169 ? 5.385 41.906 93.029 1.00 43.37 ? 169 PRO A C 1 +ATOM 1346 O O . PRO A 1 169 ? 5.602 42.727 93.921 1.00 44.56 ? 169 PRO A O 1 +ATOM 1347 C CB . PRO A 1 169 ? 5.952 39.628 93.956 1.00 42.37 ? 169 PRO A CB 1 +ATOM 1348 C CG . PRO A 1 169 ? 7.285 39.007 94.239 1.00 43.62 ? 169 PRO A CG 1 +ATOM 1349 C CD . PRO A 1 169 ? 8.213 40.200 94.266 1.00 42.90 ? 169 PRO A CD 1 +ATOM 1350 N N . PHE A 1 170 ? 4.393 42.053 92.157 1.00 43.67 ? 170 PHE A N 1 +ATOM 1351 C CA . PHE A 1 170 ? 3.484 43.191 92.260 1.00 43.30 ? 170 PHE A CA 1 +ATOM 1352 C C . PHE A 1 170 ? 2.646 42.961 93.506 1.00 43.29 ? 170 PHE A C 1 +ATOM 1353 O O . PHE A 1 170 ? 2.540 41.827 93.983 1.00 43.54 ? 170 PHE A O 1 +ATOM 1354 C CB . PHE A 1 170 ? 2.556 43.284 91.043 1.00 43.39 ? 170 PHE A CB 1 +ATOM 1355 C CG . PHE A 1 170 ? 1.488 42.214 90.991 1.00 44.89 ? 170 PHE A CG 1 +ATOM 1356 C CD1 . PHE A 1 170 ? 1.823 40.874 90.793 1.00 45.68 ? 170 PHE A CD1 1 +ATOM 1357 C CD2 . PHE A 1 170 ? 0.142 42.553 91.110 1.00 45.33 ? 170 PHE A CD2 1 +ATOM 1358 C CE1 . PHE A 1 170 ? 0.835 39.891 90.709 1.00 45.02 ? 170 PHE A CE1 1 +ATOM 1359 C CE2 . PHE A 1 170 ? -0.856 41.575 91.028 1.00 45.14 ? 170 PHE A CE2 1 +ATOM 1360 C CZ . PHE A 1 170 ? -0.507 40.243 90.826 1.00 45.46 ? 170 PHE A CZ 1 +ATOM 1361 N N . LEU A 1 171 ? 2.062 44.026 94.041 1.00 42.99 ? 171 LEU A N 1 +ATOM 1362 C CA . LEU A 1 171 ? 1.227 43.890 95.227 1.00 43.31 ? 171 LEU A CA 1 +ATOM 1363 C C . LEU A 1 171 ? -0.217 43.857 94.769 1.00 41.94 ? 171 LEU A C 1 +ATOM 1364 O O . LEU A 1 171 ? -0.745 44.856 94.303 1.00 42.64 ? 171 LEU A O 1 +ATOM 1365 C CB . LEU A 1 171 ? 1.433 45.064 96.191 1.00 43.79 ? 171 LEU A CB 1 +ATOM 1366 C CG . LEU A 1 171 ? 0.537 45.031 97.437 1.00 44.29 ? 171 LEU A CG 1 +ATOM 1367 C CD1 . LEU A 1 171 ? 0.831 43.767 98.264 1.00 46.22 ? 171 LEU A CD1 1 +ATOM 1368 C CD2 . LEU A 1 171 ? 0.782 46.278 98.265 1.00 44.38 ? 171 LEU A CD2 1 +ATOM 1369 N N . PRO A 1 172 ? -0.868 42.696 94.879 1.00 41.59 ? 172 PRO A N 1 +ATOM 1370 C CA . PRO A 1 172 ? -2.267 42.589 94.457 1.00 40.18 ? 172 PRO A CA 1 +ATOM 1371 C C . PRO A 1 172 ? -3.228 43.042 95.547 1.00 39.73 ? 172 PRO A C 1 +ATOM 1372 O O . PRO A 1 172 ? -2.833 43.244 96.691 1.00 41.40 ? 172 PRO A O 1 +ATOM 1373 C CB . PRO A 1 172 ? -2.406 41.105 94.133 1.00 40.02 ? 172 PRO A CB 1 +ATOM 1374 C CG . PRO A 1 172 ? -1.524 40.469 95.153 1.00 41.38 ? 172 PRO A CG 1 +ATOM 1375 C CD . PRO A 1 172 ? -0.298 41.368 95.181 1.00 41.67 ? 172 PRO A CD 1 +ATOM 1376 N N . PRO A 1 173 ? -4.505 43.227 95.200 1.00 39.02 ? 173 PRO A N 1 +ATOM 1377 C CA . PRO A 1 173 ? -5.493 43.656 96.191 1.00 38.66 ? 173 PRO A CA 1 +ATOM 1378 C C . PRO A 1 173 ? -5.784 42.516 97.163 1.00 40.01 ? 173 PRO A C 1 +ATOM 1379 O O . PRO A 1 173 ? -5.605 41.345 96.831 1.00 40.57 ? 173 PRO A O 1 +ATOM 1380 C CB . PRO A 1 173 ? -6.703 44.014 95.331 1.00 37.44 ? 173 PRO A CB 1 +ATOM 1381 C CG . PRO A 1 173 ? -6.587 43.040 94.194 1.00 37.94 ? 173 PRO A CG 1 +ATOM 1382 C CD . PRO A 1 173 ? -5.117 43.095 93.867 1.00 38.29 ? 173 PRO A CD 1 +ATOM 1383 N N . MET A 1 174 ? -6.239 42.856 98.359 1.00 40.16 ? 174 MET A N 1 +ATOM 1384 C CA . MET A 1 174 ? -6.537 41.842 99.343 1.00 40.30 ? 174 MET A CA 1 +ATOM 1385 C C . MET A 1 174 ? -7.591 40.846 98.863 1.00 39.88 ? 174 MET A C 1 +ATOM 1386 O O . MET A 1 174 ? -7.529 39.670 99.216 1.00 41.37 ? 174 MET A O 1 +ATOM 1387 C CB . MET A 1 174 ? -6.981 42.495 100.655 1.00 42.14 ? 174 MET A CB 1 +ATOM 1388 C CG . MET A 1 174 ? -7.263 41.503 101.768 1.00 47.30 ? 174 MET A CG 1 +ATOM 1389 S SD . MET A 1 174 ? -7.438 42.272 103.387 1.00 54.47 ? 174 MET A SD 1 +ATOM 1390 C CE . MET A 1 174 ? -6.156 41.422 104.323 1.00 53.17 ? 174 MET A CE 1 +ATOM 1391 N N . TRP A 1 175 ? -8.552 41.284 98.053 1.00 38.84 ? 175 TRP A N 1 +ATOM 1392 C CA . TRP A 1 175 ? -9.579 40.344 97.598 1.00 38.31 ? 175 TRP A CA 1 +ATOM 1393 C C . TRP A 1 175 ? -9.034 39.232 96.688 1.00 38.00 ? 175 TRP A C 1 +ATOM 1394 O O . TRP A 1 175 ? -9.690 38.212 96.477 1.00 38.40 ? 175 TRP A O 1 +ATOM 1395 C CB . TRP A 1 175 ? -10.740 41.076 96.899 1.00 37.91 ? 175 TRP A CB 1 +ATOM 1396 C CG . TRP A 1 175 ? -10.371 41.926 95.707 1.00 39.14 ? 175 TRP A CG 1 +ATOM 1397 C CD1 . TRP A 1 175 ? -10.203 43.280 95.688 1.00 37.92 ? 175 TRP A CD1 1 +ATOM 1398 C CD2 . TRP A 1 175 ? -10.184 41.480 94.357 1.00 38.45 ? 175 TRP A CD2 1 +ATOM 1399 N NE1 . TRP A 1 175 ? -9.934 43.709 94.412 1.00 38.67 ? 175 TRP A NE1 1 +ATOM 1400 C CE2 . TRP A 1 175 ? -9.916 42.625 93.574 1.00 39.19 ? 175 TRP A CE2 1 +ATOM 1401 C CE3 . TRP A 1 175 ? -10.220 40.226 93.733 1.00 37.91 ? 175 TRP A CE3 1 +ATOM 1402 C CZ2 . TRP A 1 175 ? -9.686 42.555 92.191 1.00 39.96 ? 175 TRP A CZ2 1 +ATOM 1403 C CZ3 . TRP A 1 175 ? -9.992 40.154 92.356 1.00 37.99 ? 175 TRP A CZ3 1 +ATOM 1404 C CH2 . TRP A 1 175 ? -9.729 41.314 91.602 1.00 39.44 ? 175 TRP A CH2 1 +ATOM 1405 N N . ALA A 1 176 ? -7.830 39.419 96.162 1.00 36.76 ? 176 ALA A N 1 +ATOM 1406 C CA . ALA A 1 176 ? -7.234 38.422 95.292 1.00 35.58 ? 176 ALA A CA 1 +ATOM 1407 C C . ALA A 1 176 ? -6.875 37.169 96.086 1.00 36.65 ? 176 ALA A C 1 +ATOM 1408 O O . ALA A 1 176 ? -6.630 36.105 95.503 1.00 35.47 ? 176 ALA A O 1 +ATOM 1409 C CB . ALA A 1 176 ? -5.994 38.989 94.627 1.00 35.14 ? 176 ALA A CB 1 +ATOM 1410 N N . PHE A 1 177 ? -6.852 37.292 97.412 1.00 35.58 ? 177 PHE A N 1 +ATOM 1411 C CA . PHE A 1 177 ? -6.511 36.165 98.267 1.00 35.41 ? 177 PHE A CA 1 +ATOM 1412 C C . PHE A 1 177 ? -7.739 35.554 98.914 1.00 35.49 ? 177 PHE A C 1 +ATOM 1413 O O . PHE A 1 177 ? -7.630 34.675 99.775 1.00 36.38 ? 177 PHE A O 1 +ATOM 1414 C CB . PHE A 1 177 ? -5.518 36.588 99.350 1.00 35.16 ? 177 PHE A CB 1 +ATOM 1415 C CG . PHE A 1 177 ? -4.230 37.138 98.807 1.00 37.34 ? 177 PHE A CG 1 +ATOM 1416 C CD1 . PHE A 1 177 ? -4.166 38.442 98.330 1.00 38.50 ? 177 PHE A CD1 1 +ATOM 1417 C CD2 . PHE A 1 177 ? -3.081 36.350 98.757 1.00 38.37 ? 177 PHE A CD2 1 +ATOM 1418 C CE1 . PHE A 1 177 ? -2.972 38.959 97.810 1.00 38.86 ? 177 PHE A CE1 1 +ATOM 1419 C CE2 . PHE A 1 177 ? -1.882 36.853 98.240 1.00 39.45 ? 177 PHE A CE2 1 +ATOM 1420 C CZ . PHE A 1 177 ? -1.828 38.163 97.766 1.00 39.54 ? 177 PHE A CZ 1 +ATOM 1421 N N . GLY A 1 178 ? -8.911 36.010 98.491 1.00 35.13 ? 178 GLY A N 1 +ATOM 1422 C CA . GLY A 1 178 ? -10.141 35.480 99.049 1.00 34.45 ? 178 GLY A CA 1 +ATOM 1423 C C . GLY A 1 178 ? -10.568 34.193 98.371 1.00 35.17 ? 178 GLY A C 1 +ATOM 1424 O O . GLY A 1 178 ? -9.863 33.669 97.509 1.00 34.56 ? 178 GLY A O 1 +ATOM 1425 N N . TYR A 1 179 ? -11.735 33.691 98.756 1.00 35.20 ? 179 TYR A N 1 +ATOM 1426 C CA . TYR A 1 179 ? -12.271 32.458 98.199 1.00 35.96 ? 179 TYR A CA 1 +ATOM 1427 C C . TYR A 1 179 ? -12.879 32.689 96.810 1.00 36.87 ? 179 TYR A C 1 +ATOM 1428 O O . TYR A 1 179 ? -13.844 33.443 96.657 1.00 37.72 ? 179 TYR A O 1 +ATOM 1429 C CB . TYR A 1 179 ? -13.311 31.895 99.170 1.00 35.61 ? 179 TYR A CB 1 +ATOM 1430 C CG . TYR A 1 179 ? -14.008 30.634 98.723 1.00 35.34 ? 179 TYR A CG 1 +ATOM 1431 C CD1 . TYR A 1 179 ? -13.305 29.595 98.107 1.00 35.38 ? 179 TYR A CD1 1 +ATOM 1432 C CD2 . TYR A 1 179 ? -15.372 30.463 98.953 1.00 35.63 ? 179 TYR A CD2 1 +ATOM 1433 C CE1 . TYR A 1 179 ? -13.946 28.415 97.730 1.00 36.42 ? 179 TYR A CE1 1 +ATOM 1434 C CE2 . TYR A 1 179 ? -16.025 29.284 98.585 1.00 37.67 ? 179 TYR A CE2 1 +ATOM 1435 C CZ . TYR A 1 179 ? -15.311 28.265 97.976 1.00 37.76 ? 179 TYR A CZ 1 +ATOM 1436 O OH . TYR A 1 179 ? -15.966 27.100 97.631 1.00 39.01 ? 179 TYR A OH 1 +ATOM 1437 N N . MET A 1 180 ? -12.305 32.034 95.804 1.00 35.42 ? 180 MET A N 1 +ATOM 1438 C CA . MET A 1 180 ? -12.769 32.166 94.430 1.00 36.85 ? 180 MET A CA 1 +ATOM 1439 C C . MET A 1 180 ? -13.467 30.895 93.958 1.00 37.46 ? 180 MET A C 1 +ATOM 1440 O O . MET A 1 180 ? -12.985 29.783 94.201 1.00 37.96 ? 180 MET A O 1 +ATOM 1441 C CB . MET A 1 180 ? -11.588 32.418 93.491 1.00 37.96 ? 180 MET A CB 1 +ATOM 1442 C CG . MET A 1 180 ? -10.631 33.495 93.939 1.00 41.55 ? 180 MET A CG 1 +ATOM 1443 S SD . MET A 1 180 ? -11.318 35.127 93.758 1.00 45.60 ? 180 MET A SD 1 +ATOM 1444 C CE . MET A 1 180 ? -9.806 36.111 93.625 1.00 46.27 ? 180 MET A CE 1 +ATOM 1445 N N . ILE A 1 181 ? -14.600 31.047 93.287 1.00 36.46 ? 181 ILE A N 1 +ATOM 1446 C CA . ILE A 1 181 ? -15.287 29.887 92.758 1.00 35.88 ? 181 ILE A CA 1 +ATOM 1447 C C . ILE A 1 181 ? -15.135 29.962 91.250 1.00 36.00 ? 181 ILE A C 1 +ATOM 1448 O O . ILE A 1 181 ? -15.135 31.045 90.662 1.00 35.23 ? 181 ILE A O 1 +ATOM 1449 C CB . ILE A 1 181 ? -16.775 29.843 93.143 1.00 35.68 ? 181 ILE A CB 1 +ATOM 1450 C CG1 . ILE A 1 181 ? -17.512 31.060 92.603 1.00 35.07 ? 181 ILE A CG1 1 +ATOM 1451 C CG2 . ILE A 1 181 ? -16.900 29.753 94.649 1.00 36.39 ? 181 ILE A CG2 1 +ATOM 1452 C CD1 . ILE A 1 181 ? -18.996 30.994 92.850 1.00 35.37 ? 181 ILE A CD1 1 +ATOM 1453 N N . SER A 1 182 ? -14.992 28.802 90.627 1.00 35.54 ? 182 SER A N 1 +ATOM 1454 C CA . SER A 1 182 ? -14.794 28.746 89.196 1.00 34.33 ? 182 SER A CA 1 +ATOM 1455 C C . SER A 1 182 ? -15.211 27.382 88.673 1.00 34.48 ? 182 SER A C 1 +ATOM 1456 O O . SER A 1 182 ? -15.413 26.437 89.430 1.00 34.52 ? 182 SER A O 1 +ATOM 1457 C CB . SER A 1 182 ? -13.314 28.995 88.894 1.00 34.27 ? 182 SER A CB 1 +ATOM 1458 O OG . SER A 1 182 ? -12.999 28.735 87.540 1.00 35.60 ? 182 SER A OG 1 +ATOM 1459 N N . ARG A 1 183 ? -15.350 27.291 87.366 1.00 34.46 ? 183 ARG A N 1 +ATOM 1460 C CA . ARG A 1 183 ? -15.714 26.047 86.738 1.00 35.40 ? 183 ARG A CA 1 +ATOM 1461 C C . ARG A 1 183 ? -15.506 26.237 85.254 1.00 36.37 ? 183 ARG A C 1 +ATOM 1462 O O . ARG A 1 183 ? -15.354 27.351 84.773 1.00 38.04 ? 183 ARG A O 1 +ATOM 1463 C CB . ARG A 1 183 ? -17.173 25.673 87.009 1.00 35.52 ? 183 ARG A CB 1 +ATOM 1464 C CG . ARG A 1 183 ? -17.505 24.253 86.542 1.00 36.78 ? 183 ARG A CG 1 +ATOM 1465 C CD . ARG A 1 183 ? -18.971 23.876 86.726 1.00 38.36 ? 183 ARG A CD 1 +ATOM 1466 N NE . ARG A 1 183 ? -19.275 22.607 86.060 1.00 38.19 ? 183 ARG A NE 1 +ATOM 1467 C CZ . ARG A 1 183 ? -19.128 21.404 86.612 1.00 39.16 ? 183 ARG A CZ 1 +ATOM 1468 N NH1 . ARG A 1 183 ? -18.690 21.286 87.857 1.00 39.40 ? 183 ARG A NH1 1 +ATOM 1469 N NH2 . ARG A 1 183 ? -19.409 20.310 85.913 1.00 38.19 ? 183 ARG A NH2 1 +ATOM 1470 N N . TYR A 1 184 ? -15.487 25.133 84.532 1.00 36.94 ? 184 TYR A N 1 +ATOM 1471 C CA . TYR A 1 184 ? -15.305 25.163 83.100 1.00 36.32 ? 184 TYR A CA 1 +ATOM 1472 C C . TYR A 1 184 ? -16.563 24.542 82.500 1.00 36.61 ? 184 TYR A C 1 +ATOM 1473 O O . TYR A 1 184 ? -16.565 23.363 82.154 1.00 35.48 ? 184 TYR A O 1 +ATOM 1474 C CB . TYR A 1 184 ? -14.047 24.359 82.760 1.00 36.71 ? 184 TYR A CB 1 +ATOM 1475 C CG . TYR A 1 184 ? -13.844 24.025 81.303 1.00 38.99 ? 184 TYR A CG 1 +ATOM 1476 C CD1 . TYR A 1 184 ? -14.302 24.871 80.299 1.00 39.02 ? 184 TYR A CD1 1 +ATOM 1477 C CD2 . TYR A 1 184 ? -13.156 22.866 80.930 1.00 39.65 ? 184 TYR A CD2 1 +ATOM 1478 C CE1 . TYR A 1 184 ? -14.083 24.579 78.960 1.00 40.90 ? 184 TYR A CE1 1 +ATOM 1479 C CE2 . TYR A 1 184 ? -12.927 22.564 79.593 1.00 40.09 ? 184 TYR A CE2 1 +ATOM 1480 C CZ . TYR A 1 184 ? -13.392 23.425 78.609 1.00 42.25 ? 184 TYR A CZ 1 +ATOM 1481 O OH . TYR A 1 184 ? -13.168 23.142 77.273 1.00 42.54 ? 184 TYR A OH 1 +ATOM 1482 N N . SER A 1 185 ? -17.648 25.317 82.394 1.00 37.90 ? 185 SER A N 1 +ATOM 1483 C CA . SER A 1 185 ? -17.725 26.724 82.806 1.00 37.91 ? 185 SER A CA 1 +ATOM 1484 C C . SER A 1 185 ? -19.079 27.011 83.477 1.00 38.60 ? 185 SER A C 1 +ATOM 1485 O O . SER A 1 185 ? -19.957 26.150 83.529 1.00 39.00 ? 185 SER A O 1 +ATOM 1486 C CB . SER A 1 185 ? -17.611 27.644 81.581 1.00 37.45 ? 185 SER A CB 1 +ATOM 1487 O OG . SER A 1 185 ? -16.489 27.332 80.778 1.00 38.94 ? 185 SER A OG 1 +ATOM 1488 N N . TYR A 1 186 ? -19.238 28.232 83.987 1.00 39.00 ? 186 TYR A N 1 +ATOM 1489 C CA . TYR A 1 186 ? -20.495 28.658 84.596 1.00 38.59 ? 186 TYR A CA 1 +ATOM 1490 C C . TYR A 1 186 ? -21.244 29.493 83.553 1.00 40.01 ? 186 TYR A C 1 +ATOM 1491 O O . TYR A 1 186 ? -20.679 30.436 82.996 1.00 41.76 ? 186 TYR A O 1 +ATOM 1492 C CB . TYR A 1 186 ? -20.241 29.531 85.822 1.00 37.90 ? 186 TYR A CB 1 +ATOM 1493 C CG . TYR A 1 186 ? -19.794 28.786 87.058 1.00 37.41 ? 186 TYR A CG 1 +ATOM 1494 C CD1 . TYR A 1 186 ? -20.450 27.627 87.479 1.00 36.53 ? 186 TYR A CD1 1 +ATOM 1495 C CD2 . TYR A 1 186 ? -18.741 29.268 87.836 1.00 36.91 ? 186 TYR A CD2 1 +ATOM 1496 C CE1 . TYR A 1 186 ? -20.072 26.971 88.641 1.00 37.14 ? 186 TYR A CE1 1 +ATOM 1497 C CE2 . TYR A 1 186 ? -18.352 28.619 89.004 1.00 36.69 ? 186 TYR A CE2 1 +ATOM 1498 C CZ . TYR A 1 186 ? -19.020 27.475 89.401 1.00 37.83 ? 186 TYR A CZ 1 +ATOM 1499 O OH . TYR A 1 186 ? -18.633 26.851 90.566 1.00 38.48 ? 186 TYR A OH 1 +ATOM 1500 N N . TYR A 1 187 ? -22.501 29.147 83.286 1.00 39.31 ? 187 TYR A N 1 +ATOM 1501 C CA . TYR A 1 187 ? -23.307 29.875 82.314 1.00 39.97 ? 187 TYR A CA 1 +ATOM 1502 C C . TYR A 1 187 ? -24.690 29.245 82.238 1.00 40.15 ? 187 TYR A C 1 +ATOM 1503 O O . TYR A 1 187 ? -24.887 28.131 82.704 1.00 42.06 ? 187 TYR A O 1 +ATOM 1504 C CB . TYR A 1 187 ? -22.648 29.826 80.934 1.00 41.62 ? 187 TYR A CB 1 +ATOM 1505 C CG . TYR A 1 187 ? -22.497 28.427 80.380 1.00 43.53 ? 187 TYR A CG 1 +ATOM 1506 C CD1 . TYR A 1 187 ? -21.534 27.553 80.891 1.00 44.58 ? 187 TYR A CD1 1 +ATOM 1507 C CD2 . TYR A 1 187 ? -23.322 27.969 79.349 1.00 43.20 ? 187 TYR A CD2 1 +ATOM 1508 C CE1 . TYR A 1 187 ? -21.395 26.256 80.385 1.00 44.92 ? 187 TYR A CE1 1 +ATOM 1509 C CE2 . TYR A 1 187 ? -23.193 26.679 78.836 1.00 43.32 ? 187 TYR A CE2 1 +ATOM 1510 C CZ . TYR A 1 187 ? -22.229 25.830 79.356 1.00 44.81 ? 187 TYR A CZ 1 +ATOM 1511 O OH . TYR A 1 187 ? -22.085 24.562 78.843 1.00 45.87 ? 187 TYR A OH 1 +ATOM 1512 N N . PRO A 1 188 ? -25.680 29.961 81.683 1.00 40.20 ? 188 PRO A N 1 +ATOM 1513 C CA . PRO A 1 188 ? -25.618 31.321 81.141 1.00 38.75 ? 188 PRO A CA 1 +ATOM 1514 C C . PRO A 1 188 ? -25.507 32.326 82.292 1.00 39.25 ? 188 PRO A C 1 +ATOM 1515 O O . PRO A 1 188 ? -25.476 31.931 83.459 1.00 40.18 ? 188 PRO A O 1 +ATOM 1516 C CB . PRO A 1 188 ? -26.928 31.434 80.374 1.00 38.90 ? 188 PRO A CB 1 +ATOM 1517 C CG . PRO A 1 188 ? -27.859 30.620 81.210 1.00 38.96 ? 188 PRO A CG 1 +ATOM 1518 C CD . PRO A 1 188 ? -27.036 29.399 81.537 1.00 38.55 ? 188 PRO A CD 1 +ATOM 1519 N N . GLN A 1 189 ? -25.470 33.617 81.982 1.00 39.46 ? 189 GLN A N 1 +ATOM 1520 C CA . GLN A 1 189 ? -25.311 34.627 83.027 1.00 39.10 ? 189 GLN A CA 1 +ATOM 1521 C C . GLN A 1 189 ? -26.260 34.570 84.221 1.00 39.93 ? 189 GLN A C 1 +ATOM 1522 O O . GLN A 1 189 ? -25.840 34.861 85.348 1.00 39.66 ? 189 GLN A O 1 +ATOM 1523 C CB . GLN A 1 189 ? -25.315 36.032 82.421 1.00 38.12 ? 189 GLN A CB 1 +ATOM 1524 C CG . GLN A 1 189 ? -26.630 36.522 81.860 1.00 38.65 ? 189 GLN A CG 1 +ATOM 1525 C CD . GLN A 1 189 ? -26.478 37.895 81.231 1.00 39.12 ? 189 GLN A CD 1 +ATOM 1526 O OE1 . GLN A 1 189 ? -26.008 38.024 80.096 1.00 39.28 ? 189 GLN A OE1 1 +ATOM 1527 N NE2 . GLN A 1 189 ? -26.848 38.933 81.979 1.00 40.48 ? 189 GLN A NE2 1 +ATOM 1528 N N . ASP A 1 190 ? -27.522 34.200 84.011 1.00 40.68 ? 190 ASP A N 1 +ATOM 1529 C CA . ASP A 1 190 ? -28.444 34.126 85.145 1.00 42.53 ? 190 ASP A CA 1 +ATOM 1530 C C . ASP A 1 190 ? -28.015 33.047 86.147 1.00 42.49 ? 190 ASP A C 1 +ATOM 1531 O O . ASP A 1 190 ? -28.184 33.211 87.357 1.00 40.99 ? 190 ASP A O 1 +ATOM 1532 C CB . ASP A 1 190 ? -29.872 33.847 84.683 1.00 46.67 ? 190 ASP A CB 1 +ATOM 1533 C CG . ASP A 1 190 ? -30.481 35.018 83.920 1.00 54.41 ? 190 ASP A CG 1 +ATOM 1534 O OD1 . ASP A 1 190 ? -30.114 36.185 84.213 1.00 55.92 ? 190 ASP A OD1 1 +ATOM 1535 O OD2 . ASP A 1 190 ? -31.340 34.770 83.035 1.00 56.77 ? 190 ASP A OD2 1 +ATOM 1536 N N . LYS A 1 191 ? -27.458 31.947 85.643 1.00 41.44 ? 191 LYS A N 1 +ATOM 1537 C CA . LYS A 1 191 ? -27.004 30.869 86.507 1.00 40.96 ? 191 LYS A CA 1 +ATOM 1538 C C . LYS A 1 191 ? -25.805 31.301 87.343 1.00 40.32 ? 191 LYS A C 1 +ATOM 1539 O O . LYS A 1 191 ? -25.644 30.862 88.483 1.00 39.75 ? 191 LYS A O 1 +ATOM 1540 C CB . LYS A 1 191 ? -26.646 29.635 85.682 1.00 42.10 ? 191 LYS A CB 1 +ATOM 1541 C CG . LYS A 1 191 ? -27.851 28.814 85.252 1.00 42.70 ? 191 LYS A CG 1 +ATOM 1542 C CD . LYS A 1 191 ? -28.452 28.073 86.426 1.00 44.03 ? 191 LYS A CD 1 +ATOM 1543 C CE . LYS A 1 191 ? -29.680 27.269 86.018 1.00 45.91 ? 191 LYS A CE 1 +ATOM 1544 N NZ . LYS A 1 191 ? -30.821 28.143 85.608 1.00 48.54 ? 191 LYS A NZ 1 +ATOM 1545 N N . VAL A 1 192 ? -24.969 32.165 86.781 1.00 39.13 ? 192 VAL A N 1 +ATOM 1546 C CA . VAL A 1 192 ? -23.801 32.655 87.505 1.00 39.74 ? 192 VAL A CA 1 +ATOM 1547 C C . VAL A 1 192 ? -24.257 33.395 88.755 1.00 40.94 ? 192 VAL A C 1 +ATOM 1548 O O . VAL A 1 192 ? -23.737 33.175 89.846 1.00 41.77 ? 192 VAL A O 1 +ATOM 1549 C CB . VAL A 1 192 ? -22.968 33.611 86.629 1.00 39.01 ? 192 VAL A CB 1 +ATOM 1550 C CG1 . VAL A 1 192 ? -21.835 34.203 87.431 1.00 36.91 ? 192 VAL A CG1 1 +ATOM 1551 C CG2 . VAL A 1 192 ? -22.433 32.860 85.425 1.00 38.49 ? 192 VAL A CG2 1 +ATOM 1552 N N . VAL A 1 193 ? -25.252 34.259 88.594 1.00 41.72 ? 193 VAL A N 1 +ATOM 1553 C CA . VAL A 1 193 ? -25.770 35.030 89.709 1.00 41.24 ? 193 VAL A CA 1 +ATOM 1554 C C . VAL A 1 193 ? -26.518 34.146 90.691 1.00 40.75 ? 193 VAL A C 1 +ATOM 1555 O O . VAL A 1 193 ? -26.404 34.330 91.897 1.00 41.35 ? 193 VAL A O 1 +ATOM 1556 C CB . VAL A 1 193 ? -26.695 36.165 89.210 1.00 41.12 ? 193 VAL A CB 1 +ATOM 1557 C CG1 . VAL A 1 193 ? -27.180 36.999 90.384 1.00 40.86 ? 193 VAL A CG1 1 +ATOM 1558 C CG2 . VAL A 1 193 ? -25.939 37.040 88.220 1.00 38.98 ? 193 VAL A CG2 1 +ATOM 1559 N N . GLU A 1 194 ? -27.281 33.187 90.180 1.00 41.39 ? 194 GLU A N 1 +ATOM 1560 C CA . GLU A 1 194 ? -28.030 32.283 91.051 1.00 43.95 ? 194 GLU A CA 1 +ATOM 1561 C C . GLU A 1 194 ? -27.084 31.531 91.986 1.00 43.75 ? 194 GLU A C 1 +ATOM 1562 O O . GLU A 1 194 ? -27.338 31.407 93.187 1.00 43.26 ? 194 GLU A O 1 +ATOM 1563 C CB . GLU A 1 194 ? -28.821 31.271 90.227 1.00 47.02 ? 194 GLU A CB 1 +ATOM 1564 C CG . GLU A 1 194 ? -30.018 31.848 89.475 1.00 54.71 ? 194 GLU A CG 1 +ATOM 1565 C CD . GLU A 1 194 ? -30.630 30.847 88.494 1.00 59.36 ? 194 GLU A CD 1 +ATOM 1566 O OE1 . GLU A 1 194 ? -30.793 29.662 88.874 1.00 61.88 ? 194 GLU A OE1 1 +ATOM 1567 O OE2 . GLU A 1 194 ? -30.954 31.242 87.349 1.00 60.83 ? 194 GLU A OE2 1 +ATOM 1568 N N . LEU A 1 195 ? -25.989 31.033 91.427 1.00 42.60 ? 195 LEU A N 1 +ATOM 1569 C CA . LEU A 1 195 ? -25.020 30.293 92.209 1.00 41.89 ? 195 LEU A CA 1 +ATOM 1570 C C . LEU A 1 195 ? -24.370 31.176 93.266 1.00 42.57 ? 195 LEU A C 1 +ATOM 1571 O O . LEU A 1 195 ? -24.234 30.766 94.421 1.00 42.62 ? 195 LEU A O 1 +ATOM 1572 C CB . LEU A 1 195 ? -23.950 29.688 91.297 1.00 41.84 ? 195 LEU A CB 1 +ATOM 1573 C CG . LEU A 1 195 ? -22.885 28.868 92.027 1.00 41.57 ? 195 LEU A CG 1 +ATOM 1574 C CD1 . LEU A 1 195 ? -23.542 27.736 92.793 1.00 41.24 ? 195 LEU A CD1 1 +ATOM 1575 C CD2 . LEU A 1 195 ? -21.890 28.321 91.034 1.00 41.59 ? 195 LEU A CD2 1 +ATOM 1576 N N . VAL A 1 196 ? -23.966 32.385 92.880 1.00 42.03 ? 196 VAL A N 1 +ATOM 1577 C CA . VAL A 1 196 ? -23.350 33.298 93.834 1.00 41.34 ? 196 VAL A CA 1 +ATOM 1578 C C . VAL A 1 196 ? -24.324 33.592 94.979 1.00 41.99 ? 196 VAL A C 1 +ATOM 1579 O O . VAL A 1 196 ? -23.920 33.641 96.146 1.00 41.42 ? 196 VAL A O 1 +ATOM 1580 C CB . VAL A 1 196 ? -22.923 34.628 93.160 1.00 40.43 ? 196 VAL A CB 1 +ATOM 1581 C CG1 . VAL A 1 196 ? -22.534 35.652 94.216 1.00 39.72 ? 196 VAL A CG1 1 +ATOM 1582 C CG2 . VAL A 1 196 ? -21.742 34.381 92.234 1.00 38.92 ? 196 VAL A CG2 1 +ATOM 1583 N N . ASP A 1 197 ? -25.603 33.776 94.651 1.00 42.29 ? 197 ASP A N 1 +ATOM 1584 C CA . ASP A 1 197 ? -26.603 34.049 95.676 1.00 43.04 ? 197 ASP A CA 1 +ATOM 1585 C C . ASP A 1 197 ? -26.726 32.896 96.666 1.00 43.84 ? 197 ASP A C 1 +ATOM 1586 O O . ASP A 1 197 ? -26.756 33.111 97.876 1.00 43.36 ? 197 ASP A O 1 +ATOM 1587 C CB . ASP A 1 197 ? -27.970 34.332 95.052 1.00 44.51 ? 197 ASP A CB 1 +ATOM 1588 C CG . ASP A 1 197 ? -28.123 35.778 94.623 1.00 49.10 ? 197 ASP A CG 1 +ATOM 1589 O OD1 . ASP A 1 197 ? -27.486 36.653 95.255 1.00 51.04 ? 197 ASP A OD1 1 +ATOM 1590 O OD2 . ASP A 1 197 ? -28.891 36.050 93.670 1.00 52.05 ? 197 ASP A OD2 1 +ATOM 1591 N N . ILE A 1 198 ? -26.800 31.670 96.158 1.00 44.20 ? 198 ILE A N 1 +ATOM 1592 C CA . ILE A 1 198 ? -26.915 30.513 97.035 1.00 44.85 ? 198 ILE A CA 1 +ATOM 1593 C C . ILE A 1 198 ? -25.682 30.400 97.929 1.00 44.43 ? 198 ILE A C 1 +ATOM 1594 O O . ILE A 1 198 ? -25.799 30.135 99.124 1.00 44.63 ? 198 ILE A O 1 +ATOM 1595 C CB . ILE A 1 198 ? -27.084 29.209 96.231 1.00 45.99 ? 198 ILE A CB 1 +ATOM 1596 C CG1 . ILE A 1 198 ? -28.316 29.314 95.332 1.00 46.39 ? 198 ILE A CG1 1 +ATOM 1597 C CG2 . ILE A 1 198 ? -27.260 28.027 97.186 1.00 46.57 ? 198 ILE A CG2 1 +ATOM 1598 C CD1 . ILE A 1 198 ? -28.545 28.097 94.463 1.00 46.60 ? 198 ILE A CD1 1 +ATOM 1599 N N . MET A 1 199 ? -24.501 30.602 97.349 1.00 44.54 ? 199 MET A N 1 +ATOM 1600 C CA . MET A 1 199 ? -23.259 30.543 98.116 1.00 44.82 ? 199 MET A CA 1 +ATOM 1601 C C . MET A 1 199 ? -23.291 31.540 99.276 1.00 44.83 ? 199 MET A C 1 +ATOM 1602 O O . MET A 1 199 ? -23.014 31.183 100.420 1.00 44.92 ? 199 MET A O 1 +ATOM 1603 C CB . MET A 1 199 ? -22.053 30.859 97.223 1.00 45.40 ? 199 MET A CB 1 +ATOM 1604 C CG . MET A 1 199 ? -21.638 29.742 96.282 1.00 45.51 ? 199 MET A CG 1 +ATOM 1605 S SD . MET A 1 199 ? -20.846 28.351 97.138 1.00 49.33 ? 199 MET A SD 1 +ATOM 1606 C CE . MET A 1 199 ? -19.167 28.920 97.286 1.00 46.11 ? 199 MET A CE 1 +ATOM 1607 N N . GLN A 1 200 ? -23.626 32.792 98.977 1.00 45.25 ? 200 GLN A N 1 +ATOM 1608 C CA . GLN A 1 200 ? -23.681 33.826 100.007 1.00 45.59 ? 200 GLN A CA 1 +ATOM 1609 C C . GLN A 1 200 ? -24.780 33.557 101.035 1.00 46.00 ? 200 GLN A C 1 +ATOM 1610 O O . GLN A 1 200 ? -24.575 33.721 102.235 1.00 46.36 ? 200 GLN A O 1 +ATOM 1611 C CB . GLN A 1 200 ? -23.884 35.198 99.363 1.00 43.59 ? 200 GLN A CB 1 +ATOM 1612 C CG . GLN A 1 200 ? -22.773 35.573 98.401 1.00 44.46 ? 200 GLN A CG 1 +ATOM 1613 C CD . GLN A 1 200 ? -22.876 37.002 97.913 1.00 43.78 ? 200 GLN A CD 1 +ATOM 1614 O OE1 . GLN A 1 200 ? -23.940 37.445 97.489 1.00 45.56 ? 200 GLN A OE1 1 +ATOM 1615 N NE2 . GLN A 1 200 ? -21.766 37.730 97.966 1.00 41.55 ? 200 GLN A NE2 1 +ATOM 1616 N N . LYS A 1 201 ? -25.943 33.136 100.566 1.00 46.81 ? 201 LYS A N 1 +ATOM 1617 C CA . LYS A 1 201 ? -27.045 32.851 101.465 1.00 49.22 ? 201 LYS A CA 1 +ATOM 1618 C C . LYS A 1 201 ? -26.675 31.752 102.460 1.00 50.18 ? 201 LYS A C 1 +ATOM 1619 O O . LYS A 1 201 ? -27.100 31.786 103.616 1.00 49.83 ? 201 LYS A O 1 +ATOM 1620 C CB . LYS A 1 201 ? -28.278 32.433 100.667 1.00 51.21 ? 201 LYS A CB 1 +ATOM 1621 C CG . LYS A 1 201 ? -29.475 32.085 101.526 1.00 55.20 ? 201 LYS A CG 1 +ATOM 1622 C CD . LYS A 1 201 ? -30.678 31.707 100.676 1.00 58.00 ? 201 LYS A CD 1 +ATOM 1623 C CE . LYS A 1 201 ? -31.864 31.324 101.548 1.00 60.05 ? 201 LYS A CE 1 +ATOM 1624 N NZ . LYS A 1 201 ? -31.559 30.134 102.396 1.00 61.56 ? 201 LYS A NZ 1 +ATOM 1625 N N . GLU A 1 202 ? -25.883 30.776 102.021 1.00 50.12 ? 202 GLU A N 1 +ATOM 1626 C CA . GLU A 1 202 ? -25.490 29.696 102.917 1.00 49.91 ? 202 GLU A CA 1 +ATOM 1627 C C . GLU A 1 202 ? -24.235 29.991 103.731 1.00 48.12 ? 202 GLU A C 1 +ATOM 1628 O O . GLU A 1 202 ? -23.667 29.100 104.359 1.00 46.86 ? 202 GLU A O 1 +ATOM 1629 C CB . GLU A 1 202 ? -25.355 28.378 102.147 1.00 52.14 ? 202 GLU A CB 1 +ATOM 1630 C CG . GLU A 1 202 ? -26.720 27.777 101.795 1.00 57.95 ? 202 GLU A CG 1 +ATOM 1631 C CD . GLU A 1 202 ? -26.648 26.342 101.288 1.00 62.13 ? 202 GLU A CD 1 +ATOM 1632 O OE1 . GLU A 1 202 ? -25.836 25.564 101.834 1.00 65.35 ? 202 GLU A OE1 1 +ATOM 1633 O OE2 . GLU A 1 202 ? -27.415 25.982 100.361 1.00 62.95 ? 202 GLU A OE2 1 +ATOM 1634 N N . GLY A 1 203 ? -23.806 31.249 103.715 1.00 47.28 ? 203 GLY A N 1 +ATOM 1635 C CA . GLY A 1 203 ? -22.660 31.646 104.508 1.00 46.47 ? 203 GLY A CA 1 +ATOM 1636 C C . GLY A 1 203 ? -21.270 31.637 103.913 1.00 47.63 ? 203 GLY A C 1 +ATOM 1637 O O . GLY A 1 203 ? -20.298 31.865 104.631 1.00 50.23 ? 203 GLY A O 1 +ATOM 1638 N N . PHE A 1 204 ? -21.138 31.381 102.621 1.00 46.83 ? 204 PHE A N 1 +ATOM 1639 C CA . PHE A 1 204 ? -19.811 31.388 102.036 1.00 45.04 ? 204 PHE A CA 1 +ATOM 1640 C C . PHE A 1 204 ? -19.471 32.750 101.478 1.00 44.94 ? 204 PHE A C 1 +ATOM 1641 O O . PHE A 1 204 ? -20.185 33.288 100.640 1.00 46.99 ? 204 PHE A O 1 +ATOM 1642 C CB . PHE A 1 204 ? -19.692 30.329 100.944 1.00 44.39 ? 204 PHE A CB 1 +ATOM 1643 C CG . PHE A 1 204 ? -19.817 28.927 101.459 1.00 44.16 ? 204 PHE A CG 1 +ATOM 1644 C CD1 . PHE A 1 204 ? -21.063 28.321 101.565 1.00 43.19 ? 204 PHE A CD1 1 +ATOM 1645 C CD2 . PHE A 1 204 ? -18.691 28.234 101.886 1.00 43.06 ? 204 PHE A CD2 1 +ATOM 1646 C CE1 . PHE A 1 204 ? -21.189 27.049 102.089 1.00 44.56 ? 204 PHE A CE1 1 +ATOM 1647 C CE2 . PHE A 1 204 ? -18.804 26.961 102.413 1.00 44.39 ? 204 PHE A CE2 1 +ATOM 1648 C CZ . PHE A 1 204 ? -20.054 26.362 102.518 1.00 45.01 ? 204 PHE A CZ 1 +ATOM 1649 N N . ARG A 1 205 ? -18.373 33.308 101.959 1.00 44.67 ? 205 ARG A N 1 +ATOM 1650 C CA . ARG A 1 205 ? -17.923 34.605 101.511 1.00 44.62 ? 205 ARG A CA 1 +ATOM 1651 C C . ARG A 1 205 ? -17.120 34.419 100.216 1.00 43.95 ? 205 ARG A C 1 +ATOM 1652 O O . ARG A 1 205 ? -15.968 33.976 100.231 1.00 43.55 ? 205 ARG A O 1 +ATOM 1653 C CB . ARG A 1 205 ? -17.075 35.239 102.612 1.00 46.85 ? 205 ARG A CB 1 +ATOM 1654 C CG . ARG A 1 205 ? -16.620 36.650 102.337 1.00 51.26 ? 205 ARG A CG 1 +ATOM 1655 C CD . ARG A 1 205 ? -15.879 37.188 103.547 1.00 54.59 ? 205 ARG A CD 1 +ATOM 1656 N NE . ARG A 1 205 ? -15.147 38.416 103.248 1.00 57.78 ? 205 ARG A NE 1 +ATOM 1657 C CZ . ARG A 1 205 ? -14.351 39.038 104.116 1.00 60.52 ? 205 ARG A CZ 1 +ATOM 1658 N NH1 . ARG A 1 205 ? -14.181 38.551 105.347 1.00 59.66 ? 205 ARG A NH1 1 +ATOM 1659 N NH2 . ARG A 1 205 ? -13.712 40.146 103.752 1.00 61.74 ? 205 ARG A NH2 1 +ATOM 1660 N N . VAL A 1 206 ? -17.754 34.747 99.094 1.00 42.13 ? 206 VAL A N 1 +ATOM 1661 C CA . VAL A 1 206 ? -17.136 34.623 97.786 1.00 39.75 ? 206 VAL A CA 1 +ATOM 1662 C C . VAL A 1 206 ? -16.520 35.947 97.346 1.00 39.30 ? 206 VAL A C 1 +ATOM 1663 O O . VAL A 1 206 ? -17.214 36.954 97.252 1.00 39.98 ? 206 VAL A O 1 +ATOM 1664 C CB . VAL A 1 206 ? -18.178 34.183 96.739 1.00 40.01 ? 206 VAL A CB 1 +ATOM 1665 C CG1 . VAL A 1 206 ? -17.534 34.076 95.364 1.00 39.49 ? 206 VAL A CG1 1 +ATOM 1666 C CG2 . VAL A 1 206 ? -18.777 32.850 97.142 1.00 39.61 ? 206 VAL A CG2 1 +ATOM 1667 N N . ALA A 1 207 ? -15.219 35.929 97.067 1.00 38.30 ? 207 ALA A N 1 +ATOM 1668 C CA . ALA A 1 207 ? -14.487 37.114 96.639 1.00 37.31 ? 207 ALA A CA 1 +ATOM 1669 C C . ALA A 1 207 ? -14.651 37.385 95.148 1.00 37.93 ? 207 ALA A C 1 +ATOM 1670 O O . ALA A 1 207 ? -14.726 38.538 94.724 1.00 40.26 ? 207 ALA A O 1 +ATOM 1671 C CB . ALA A 1 207 ? -13.002 36.959 96.975 1.00 35.90 ? 207 ALA A CB 1 +ATOM 1672 N N . GLY A 1 208 ? -14.695 36.322 94.352 1.00 38.76 ? 208 GLY A N 1 +ATOM 1673 C CA . GLY A 1 208 ? -14.849 36.480 92.915 1.00 37.11 ? 208 GLY A CA 1 +ATOM 1674 C C . GLY A 1 208 ? -15.217 35.190 92.207 1.00 36.31 ? 208 GLY A C 1 +ATOM 1675 O O . GLY A 1 208 ? -15.086 34.101 92.770 1.00 35.00 ? 208 GLY A O 1 +ATOM 1676 N N . VAL A 1 209 ? -15.704 35.317 90.977 1.00 35.02 ? 209 VAL A N 1 +ATOM 1677 C CA . VAL A 1 209 ? -16.069 34.159 90.188 1.00 33.91 ? 209 VAL A CA 1 +ATOM 1678 C C . VAL A 1 209 ? -15.294 34.233 88.887 1.00 32.32 ? 209 VAL A C 1 +ATOM 1679 O O . VAL A 1 209 ? -15.094 35.313 88.339 1.00 32.50 ? 209 VAL A O 1 +ATOM 1680 C CB . VAL A 1 209 ? -17.587 34.112 89.896 1.00 33.42 ? 209 VAL A CB 1 +ATOM 1681 C CG1 . VAL A 1 209 ? -18.358 34.230 91.186 1.00 34.12 ? 209 VAL A CG1 1 +ATOM 1682 C CG2 . VAL A 1 209 ? -17.977 35.206 88.959 1.00 35.19 ? 209 VAL A CG2 1 +ATOM 1683 N N . PHE A 1 210 ? -14.828 33.084 88.416 1.00 32.13 ? 210 PHE A N 1 +ATOM 1684 C CA . PHE A 1 210 ? -14.072 33.024 87.173 1.00 32.22 ? 210 PHE A CA 1 +ATOM 1685 C C . PHE A 1 210 ? -14.972 32.538 86.052 1.00 33.52 ? 210 PHE A C 1 +ATOM 1686 O O . PHE A 1 210 ? -15.748 31.596 86.228 1.00 34.87 ? 210 PHE A O 1 +ATOM 1687 C CB . PHE A 1 210 ? -12.882 32.076 87.317 1.00 31.34 ? 210 PHE A CB 1 +ATOM 1688 C CG . PHE A 1 210 ? -11.762 32.632 88.135 1.00 30.53 ? 210 PHE A CG 1 +ATOM 1689 C CD1 . PHE A 1 210 ? -11.968 33.013 89.456 1.00 29.54 ? 210 PHE A CD1 1 +ATOM 1690 C CD2 . PHE A 1 210 ? -10.495 32.790 87.578 1.00 31.06 ? 210 PHE A CD2 1 +ATOM 1691 C CE1 . PHE A 1 210 ? -10.933 33.548 90.212 1.00 31.04 ? 210 PHE A CE1 1 +ATOM 1692 C CE2 . PHE A 1 210 ? -9.441 33.325 88.328 1.00 31.84 ? 210 PHE A CE2 1 +ATOM 1693 C CZ . PHE A 1 210 ? -9.659 33.706 89.647 1.00 30.64 ? 210 PHE A CZ 1 +ATOM 1694 N N . LEU A 1 211 ? -14.870 33.189 84.902 1.00 33.52 ? 211 LEU A N 1 +ATOM 1695 C CA . LEU A 1 211 ? -15.669 32.817 83.744 1.00 33.60 ? 211 LEU A CA 1 +ATOM 1696 C C . LEU A 1 211 ? -14.731 32.157 82.745 1.00 33.85 ? 211 LEU A C 1 +ATOM 1697 O O . LEU A 1 211 ? -13.809 32.805 82.240 1.00 32.19 ? 211 LEU A O 1 +ATOM 1698 C CB . LEU A 1 211 ? -16.309 34.061 83.133 1.00 34.16 ? 211 LEU A CB 1 +ATOM 1699 C CG . LEU A 1 211 ? -17.833 34.171 83.136 1.00 35.71 ? 211 LEU A CG 1 +ATOM 1700 C CD1 . LEU A 1 211 ? -18.407 33.719 84.469 1.00 35.83 ? 211 LEU A CD1 1 +ATOM 1701 C CD2 . LEU A 1 211 ? -18.218 35.612 82.840 1.00 37.21 ? 211 LEU A CD2 1 +ATOM 1702 N N . ASP A 1 212 ? -14.954 30.866 82.484 1.00 34.30 ? 212 ASP A N 1 +ATOM 1703 C CA . ASP A 1 212 ? -14.123 30.119 81.547 1.00 34.48 ? 212 ASP A CA 1 +ATOM 1704 C C . ASP A 1 212 ? -14.632 30.344 80.116 1.00 34.41 ? 212 ASP A C 1 +ATOM 1705 O O . ASP A 1 212 ? -15.639 31.019 79.911 1.00 33.47 ? 212 ASP A O 1 +ATOM 1706 C CB . ASP A 1 212 ? -14.113 28.621 81.900 1.00 35.30 ? 212 ASP A CB 1 +ATOM 1707 C CG . ASP A 1 212 ? -12.783 27.945 81.544 1.00 37.99 ? 212 ASP A CG 1 +ATOM 1708 O OD1 . ASP A 1 212 ? -12.239 28.215 80.444 1.00 37.41 ? 212 ASP A OD1 1 +ATOM 1709 O OD2 . ASP A 1 212 ? -12.278 27.136 82.362 1.00 39.56 ? 212 ASP A OD2 1 +ATOM 1710 N N . ILE A 1 213 ? -13.947 29.751 79.140 1.00 34.10 ? 213 ILE A N 1 +ATOM 1711 C CA . ILE A 1 213 ? -14.253 29.950 77.728 1.00 33.04 ? 213 ILE A CA 1 +ATOM 1712 C C . ILE A 1 213 ? -15.676 29.849 77.182 1.00 33.97 ? 213 ILE A C 1 +ATOM 1713 O O . ILE A 1 213 ? -15.919 30.289 76.061 1.00 34.33 ? 213 ILE A O 1 +ATOM 1714 C CB . ILE A 1 213 ? -13.341 29.073 76.844 1.00 33.02 ? 213 ILE A CB 1 +ATOM 1715 C CG1 . ILE A 1 213 ? -13.651 27.588 77.050 1.00 30.60 ? 213 ILE A CG1 1 +ATOM 1716 C CG2 . ILE A 1 213 ? -11.880 29.374 77.159 1.00 32.08 ? 213 ILE A CG2 1 +ATOM 1717 C CD1 . ILE A 1 213 ? -12.815 26.676 76.158 1.00 30.38 ? 213 ILE A CD1 1 +ATOM 1718 N N . HIS A 1 214 ? -16.615 29.289 77.937 1.00 33.90 ? 214 HIS A N 1 +ATOM 1719 C CA . HIS A 1 214 ? -17.986 29.193 77.438 1.00 35.08 ? 214 HIS A CA 1 +ATOM 1720 C C . HIS A 1 214 ? -18.668 30.559 77.338 1.00 36.25 ? 214 HIS A C 1 +ATOM 1721 O O . HIS A 1 214 ? -19.713 30.687 76.697 1.00 36.49 ? 214 HIS A O 1 +ATOM 1722 C CB . HIS A 1 214 ? -18.852 28.297 78.328 1.00 35.69 ? 214 HIS A CB 1 +ATOM 1723 C CG . HIS A 1 214 ? -18.606 26.830 78.152 1.00 39.69 ? 214 HIS A CG 1 +ATOM 1724 N ND1 . HIS A 1 214 ? -17.538 26.177 78.729 1.00 39.68 ? 214 HIS A ND1 1 +ATOM 1725 C CD2 . HIS A 1 214 ? -19.307 25.883 77.484 1.00 40.46 ? 214 HIS A CD2 1 +ATOM 1726 C CE1 . HIS A 1 214 ? -17.593 24.892 78.428 1.00 39.97 ? 214 HIS A CE1 1 +ATOM 1727 N NE2 . HIS A 1 214 ? -18.658 24.687 77.674 1.00 39.97 ? 214 HIS A NE2 1 +ATOM 1728 N N . TYR A 1 215 ? -18.090 31.578 77.966 1.00 36.06 ? 215 TYR A N 1 +ATOM 1729 C CA . TYR A 1 215 ? -18.706 32.908 77.927 1.00 37.37 ? 215 TYR A CA 1 +ATOM 1730 C C . TYR A 1 215 ? -18.481 33.625 76.596 1.00 36.83 ? 215 TYR A C 1 +ATOM 1731 O O . TYR A 1 215 ? -19.225 34.539 76.249 1.00 35.94 ? 215 TYR A O 1 +ATOM 1732 C CB . TYR A 1 215 ? -18.191 33.787 79.086 1.00 34.80 ? 215 TYR A CB 1 +ATOM 1733 C CG . TYR A 1 215 ? -16.849 34.466 78.846 1.00 33.70 ? 215 TYR A CG 1 +ATOM 1734 C CD1 . TYR A 1 215 ? -16.732 35.539 77.965 1.00 31.92 ? 215 TYR A CD1 1 +ATOM 1735 C CD2 . TYR A 1 215 ? -15.697 34.040 79.519 1.00 33.42 ? 215 TYR A CD2 1 +ATOM 1736 C CE1 . TYR A 1 215 ? -15.506 36.174 77.759 1.00 32.62 ? 215 TYR A CE1 1 +ATOM 1737 C CE2 . TYR A 1 215 ? -14.467 34.669 79.323 1.00 31.36 ? 215 TYR A CE2 1 +ATOM 1738 C CZ . TYR A 1 215 ? -14.382 35.736 78.441 1.00 32.58 ? 215 TYR A CZ 1 +ATOM 1739 O OH . TYR A 1 215 ? -13.183 36.376 78.248 1.00 31.54 ? 215 TYR A OH 1 +ATOM 1740 N N . MET A 1 216 ? -17.450 33.208 75.867 1.00 36.55 ? 216 MET A N 1 +ATOM 1741 C CA . MET A 1 216 ? -17.123 33.817 74.584 1.00 38.14 ? 216 MET A CA 1 +ATOM 1742 C C . MET A 1 216 ? -18.044 33.381 73.449 1.00 38.62 ? 216 MET A C 1 +ATOM 1743 O O . MET A 1 216 ? -18.768 32.392 73.547 1.00 39.39 ? 216 MET A O 1 +ATOM 1744 C CB . MET A 1 216 ? -15.684 33.478 74.187 1.00 37.72 ? 216 MET A CB 1 +ATOM 1745 C CG . MET A 1 216 ? -14.629 34.030 75.109 1.00 40.52 ? 216 MET A CG 1 +ATOM 1746 S SD . MET A 1 216 ? -12.964 33.505 74.628 1.00 42.27 ? 216 MET A SD 1 +ATOM 1747 C CE . MET A 1 216 ? -12.570 32.429 75.929 1.00 44.31 ? 216 MET A CE 1 +ATOM 1748 N N . ASP A 1 217 ? -18.002 34.133 72.361 1.00 40.11 ? 217 ASP A N 1 +ATOM 1749 C CA . ASP A 1 217 ? -18.793 33.816 71.187 1.00 40.83 ? 217 ASP A CA 1 +ATOM 1750 C C . ASP A 1 217 ? -17.884 32.962 70.305 1.00 40.53 ? 217 ASP A C 1 +ATOM 1751 O O . ASP A 1 217 ? -16.928 33.464 69.717 1.00 40.13 ? 217 ASP A O 1 +ATOM 1752 C CB . ASP A 1 217 ? -19.198 35.112 70.482 1.00 43.37 ? 217 ASP A CB 1 +ATOM 1753 C CG . ASP A 1 217 ? -19.806 34.876 69.112 1.00 45.78 ? 217 ASP A CG 1 +ATOM 1754 O OD1 . ASP A 1 217 ? -20.367 33.783 68.880 1.00 46.85 ? 217 ASP A OD1 1 +ATOM 1755 O OD2 . ASP A 1 217 ? -19.732 35.805 68.273 1.00 47.64 ? 217 ASP A OD2 1 +ATOM 1756 N N . SER A 1 218 ? -18.165 31.663 70.249 1.00 41.14 ? 218 SER A N 1 +ATOM 1757 C CA . SER A 1 218 ? -17.362 30.737 69.451 1.00 42.02 ? 218 SER A CA 1 +ATOM 1758 C C . SER A 1 218 ? -15.894 30.774 69.854 1.00 41.97 ? 218 SER A C 1 +ATOM 1759 O O . SER A 1 218 ? -15.015 30.633 69.000 1.00 41.24 ? 218 SER A O 1 +ATOM 1760 C CB . SER A 1 218 ? -17.463 31.084 67.962 1.00 43.20 ? 218 SER A CB 1 +ATOM 1761 O OG . SER A 1 218 ? -18.789 30.947 67.497 1.00 45.15 ? 218 SER A OG 1 +ATOM 1762 N N . TYR A 1 219 ? -15.636 30.982 71.146 1.00 42.19 ? 219 TYR A N 1 +ATOM 1763 C CA . TYR A 1 219 ? -14.272 31.041 71.684 1.00 40.91 ? 219 TYR A CA 1 +ATOM 1764 C C . TYR A 1 219 ? -13.456 32.229 71.181 1.00 40.77 ? 219 TYR A C 1 +ATOM 1765 O O . TYR A 1 219 ? -12.225 32.218 71.263 1.00 40.35 ? 219 TYR A O 1 +ATOM 1766 C CB . TYR A 1 219 ? -13.535 29.738 71.372 1.00 40.36 ? 219 TYR A CB 1 +ATOM 1767 C CG . TYR A 1 219 ? -14.301 28.521 71.822 1.00 41.74 ? 219 TYR A CG 1 +ATOM 1768 C CD1 . TYR A 1 219 ? -14.542 28.293 73.171 1.00 41.77 ? 219 TYR A CD1 1 +ATOM 1769 C CD2 . TYR A 1 219 ? -14.846 27.635 70.894 1.00 41.24 ? 219 TYR A CD2 1 +ATOM 1770 C CE1 . TYR A 1 219 ? -15.315 27.215 73.593 1.00 43.89 ? 219 TYR A CE1 1 +ATOM 1771 C CE2 . TYR A 1 219 ? -15.621 26.555 71.300 1.00 42.48 ? 219 TYR A CE2 1 +ATOM 1772 C CZ . TYR A 1 219 ? -15.854 26.352 72.651 1.00 45.76 ? 219 TYR A CZ 1 +ATOM 1773 O OH . TYR A 1 219 ? -16.644 25.299 73.058 1.00 47.58 ? 219 TYR A OH 1 +ATOM 1774 N N . LYS A 1 220 ? -14.132 33.250 70.656 1.00 40.63 ? 220 LYS A N 1 +ATOM 1775 C CA . LYS A 1 220 ? -13.428 34.434 70.169 1.00 41.34 ? 220 LYS A CA 1 +ATOM 1776 C C . LYS A 1 220 ? -13.086 35.373 71.324 1.00 39.35 ? 220 LYS A C 1 +ATOM 1777 O O . LYS A 1 220 ? -13.971 35.804 72.063 1.00 38.07 ? 220 LYS A O 1 +ATOM 1778 C CB . LYS A 1 220 ? -14.277 35.178 69.131 1.00 43.37 ? 220 LYS A CB 1 +ATOM 1779 C CG . LYS A 1 220 ? -14.315 34.490 67.782 1.00 46.61 ? 220 LYS A CG 1 +ATOM 1780 C CD . LYS A 1 220 ? -15.062 35.294 66.735 1.00 48.25 ? 220 LYS A CD 1 +ATOM 1781 C CE . LYS A 1 220 ? -16.558 35.232 66.964 1.00 49.81 ? 220 LYS A CE 1 +ATOM 1782 N NZ . LYS A 1 220 ? -17.290 35.695 65.752 1.00 52.72 ? 220 LYS A NZ 1 +ATOM 1783 N N . LEU A 1 221 ? -11.802 35.680 71.479 1.00 38.57 ? 221 LEU A N 1 +ATOM 1784 C CA . LEU A 1 221 ? -11.374 36.575 72.548 1.00 38.87 ? 221 LEU A CA 1 +ATOM 1785 C C . LEU A 1 221 ? -12.111 37.912 72.492 1.00 38.07 ? 221 LEU A C 1 +ATOM 1786 O O . LEU A 1 221 ? -12.437 38.418 71.417 1.00 38.45 ? 221 LEU A O 1 +ATOM 1787 C CB . LEU A 1 221 ? -9.867 36.837 72.474 1.00 37.50 ? 221 LEU A CB 1 +ATOM 1788 C CG . LEU A 1 221 ? -8.951 35.617 72.478 1.00 39.07 ? 221 LEU A CG 1 +ATOM 1789 C CD1 . LEU A 1 221 ? -7.517 36.084 72.607 1.00 39.50 ? 221 LEU A CD1 1 +ATOM 1790 C CD2 . LEU A 1 221 ? -9.313 34.677 73.625 1.00 39.21 ? 221 LEU A CD2 1 +ATOM 1791 N N . PHE A 1 222 ? -12.386 38.459 73.667 1.00 36.82 ? 222 PHE A N 1 +ATOM 1792 C CA . PHE A 1 222 ? -13.040 39.748 73.789 1.00 36.56 ? 222 PHE A CA 1 +ATOM 1793 C C . PHE A 1 222 ? -14.421 39.838 73.156 1.00 35.87 ? 222 PHE A C 1 +ATOM 1794 O O . PHE A 1 222 ? -14.758 40.846 72.529 1.00 35.86 ? 222 PHE A O 1 +ATOM 1795 C CB . PHE A 1 222 ? -12.124 40.837 73.221 1.00 34.41 ? 222 PHE A CB 1 +ATOM 1796 C CG . PHE A 1 222 ? -10.720 40.759 73.732 1.00 33.64 ? 222 PHE A CG 1 +ATOM 1797 C CD1 . PHE A 1 222 ? -10.460 40.844 75.092 1.00 33.43 ? 222 PHE A CD1 1 +ATOM 1798 C CD2 . PHE A 1 222 ? -9.657 40.565 72.854 1.00 34.38 ? 222 PHE A CD2 1 +ATOM 1799 C CE1 . PHE A 1 222 ? -9.155 40.736 75.582 1.00 33.51 ? 222 PHE A CE1 1 +ATOM 1800 C CE2 . PHE A 1 222 ? -8.349 40.455 73.328 1.00 34.27 ? 222 PHE A CE2 1 +ATOM 1801 C CZ . PHE A 1 222 ? -8.100 40.540 74.700 1.00 34.89 ? 222 PHE A CZ 1 +ATOM 1802 N N . THR A 1 223 ? -15.212 38.785 73.319 1.00 33.99 ? 223 THR A N 1 +ATOM 1803 C CA . THR A 1 223 ? -16.581 38.778 72.815 1.00 33.56 ? 223 THR A CA 1 +ATOM 1804 C C . THR A 1 223 ? -17.436 38.091 73.861 1.00 33.74 ? 223 THR A C 1 +ATOM 1805 O O . THR A 1 223 ? -16.918 37.402 74.735 1.00 36.22 ? 223 THR A O 1 +ATOM 1806 C CB . THR A 1 223 ? -16.731 37.997 71.489 1.00 34.81 ? 223 THR A CB 1 +ATOM 1807 O OG1 . THR A 1 223 ? -16.555 36.590 71.729 1.00 34.42 ? 223 THR A OG1 1 +ATOM 1808 C CG2 . THR A 1 223 ? -15.715 38.484 70.472 1.00 31.90 ? 223 THR A CG2 1 +ATOM 1809 N N . TRP A 1 224 ? -18.742 38.285 73.782 1.00 34.13 ? 224 TRP A N 1 +ATOM 1810 C CA . TRP A 1 224 ? -19.654 37.659 74.719 1.00 33.96 ? 224 TRP A CA 1 +ATOM 1811 C C . TRP A 1 224 ? -20.592 36.789 73.920 1.00 35.36 ? 224 TRP A C 1 +ATOM 1812 O O . TRP A 1 224 ? -21.069 37.191 72.861 1.00 37.19 ? 224 TRP A O 1 +ATOM 1813 C CB . TRP A 1 224 ? -20.467 38.705 75.479 1.00 34.17 ? 224 TRP A CB 1 +ATOM 1814 C CG . TRP A 1 224 ? -19.673 39.497 76.471 1.00 34.47 ? 224 TRP A CG 1 +ATOM 1815 C CD1 . TRP A 1 224 ? -19.161 40.753 76.303 1.00 32.84 ? 224 TRP A CD1 1 +ATOM 1816 C CD2 . TRP A 1 224 ? -19.332 39.099 77.804 1.00 33.76 ? 224 TRP A CD2 1 +ATOM 1817 N NE1 . TRP A 1 224 ? -18.532 41.166 77.452 1.00 31.96 ? 224 TRP A NE1 1 +ATOM 1818 C CE2 . TRP A 1 224 ? -18.621 40.172 78.390 1.00 33.34 ? 224 TRP A CE2 1 +ATOM 1819 C CE3 . TRP A 1 224 ? -19.560 37.940 78.561 1.00 32.91 ? 224 TRP A CE3 1 +ATOM 1820 C CZ2 . TRP A 1 224 ? -18.136 40.123 79.701 1.00 33.67 ? 224 TRP A CZ2 1 +ATOM 1821 C CZ3 . TRP A 1 224 ? -19.078 37.889 79.869 1.00 33.60 ? 224 TRP A CZ3 1 +ATOM 1822 C CH2 . TRP A 1 224 ? -18.375 38.979 80.424 1.00 33.44 ? 224 TRP A CH2 1 +ATOM 1823 N N . HIS A 1 225 ? -20.848 35.589 74.419 1.00 36.32 ? 225 HIS A N 1 +ATOM 1824 C CA . HIS A 1 225 ? -21.745 34.674 73.745 1.00 36.79 ? 225 HIS A CA 1 +ATOM 1825 C C . HIS A 1 225 ? -23.125 35.344 73.701 1.00 37.12 ? 225 HIS A C 1 +ATOM 1826 O O . HIS A 1 225 ? -23.703 35.650 74.738 1.00 35.54 ? 225 HIS A O 1 +ATOM 1827 C CB . HIS A 1 225 ? -21.798 33.361 74.513 1.00 35.38 ? 225 HIS A CB 1 +ATOM 1828 C CG . HIS A 1 225 ? -22.510 32.267 73.784 1.00 37.28 ? 225 HIS A CG 1 +ATOM 1829 N ND1 . HIS A 1 225 ? -23.878 32.250 73.613 1.00 36.80 ? 225 HIS A ND1 1 +ATOM 1830 C CD2 . HIS A 1 225 ? -22.040 31.150 73.181 1.00 36.33 ? 225 HIS A CD2 1 +ATOM 1831 C CE1 . HIS A 1 225 ? -24.220 31.169 72.937 1.00 35.30 ? 225 HIS A CE1 1 +ATOM 1832 N NE2 . HIS A 1 225 ? -23.124 30.485 72.663 1.00 35.58 ? 225 HIS A NE2 1 +ATOM 1833 N N . PRO A 1 226 ? -23.659 35.578 72.490 1.00 38.10 ? 226 PRO A N 1 +ATOM 1834 C CA . PRO A 1 226 ? -24.964 36.219 72.281 1.00 39.32 ? 226 PRO A CA 1 +ATOM 1835 C C . PRO A 1 226 ? -26.161 35.581 72.979 1.00 39.25 ? 226 PRO A C 1 +ATOM 1836 O O . PRO A 1 226 ? -27.155 36.256 73.248 1.00 40.44 ? 226 PRO A O 1 +ATOM 1837 C CB . PRO A 1 226 ? -25.110 36.224 70.758 1.00 39.63 ? 226 PRO A CB 1 +ATOM 1838 C CG . PRO A 1 226 ? -24.347 35.006 70.341 1.00 40.81 ? 226 PRO A CG 1 +ATOM 1839 C CD . PRO A 1 226 ? -23.104 35.101 71.209 1.00 39.08 ? 226 PRO A CD 1 +ATOM 1840 N N . TYR A 1 227 ? -26.060 34.294 73.293 1.00 39.93 ? 227 TYR A N 1 +ATOM 1841 C CA . TYR A 1 227 ? -27.150 33.571 73.949 1.00 40.93 ? 227 TYR A CA 1 +ATOM 1842 C C . TYR A 1 227 ? -26.959 33.295 75.444 1.00 39.48 ? 227 TYR A C 1 +ATOM 1843 O O . TYR A 1 227 ? -27.909 33.365 76.216 1.00 38.38 ? 227 TYR A O 1 +ATOM 1844 C CB . TYR A 1 227 ? -27.410 32.257 73.210 1.00 44.24 ? 227 TYR A CB 1 +ATOM 1845 C CG . TYR A 1 227 ? -28.031 32.441 71.842 1.00 48.13 ? 227 TYR A CG 1 +ATOM 1846 C CD1 . TYR A 1 227 ? -29.396 32.677 71.706 1.00 51.82 ? 227 TYR A CD1 1 +ATOM 1847 C CD2 . TYR A 1 227 ? -27.253 32.385 70.681 1.00 51.36 ? 227 TYR A CD2 1 +ATOM 1848 C CE1 . TYR A 1 227 ? -29.981 32.851 70.445 1.00 55.40 ? 227 TYR A CE1 1 +ATOM 1849 C CE2 . TYR A 1 227 ? -27.822 32.561 69.413 1.00 53.93 ? 227 TYR A CE2 1 +ATOM 1850 C CZ . TYR A 1 227 ? -29.190 32.793 69.305 1.00 56.72 ? 227 TYR A CZ 1 +ATOM 1851 O OH . TYR A 1 227 ? -29.774 32.979 68.068 1.00 60.27 ? 227 TYR A OH 1 +ATOM 1852 N N . ARG A 1 228 ? -25.742 32.987 75.866 1.00 39.29 ? 228 ARG A N 1 +ATOM 1853 C CA . ARG A 1 228 ? -25.510 32.726 77.283 1.00 38.48 ? 228 ARG A CA 1 +ATOM 1854 C C . ARG A 1 228 ? -25.241 34.008 78.057 1.00 38.17 ? 228 ARG A C 1 +ATOM 1855 O O . ARG A 1 228 ? -25.574 34.104 79.234 1.00 37.90 ? 228 ARG A O 1 +ATOM 1856 C CB . ARG A 1 228 ? -24.320 31.793 77.462 1.00 39.17 ? 228 ARG A CB 1 +ATOM 1857 C CG . ARG A 1 228 ? -24.510 30.427 76.859 1.00 36.58 ? 228 ARG A CG 1 +ATOM 1858 C CD . ARG A 1 228 ? -23.163 29.840 76.525 1.00 36.90 ? 228 ARG A CD 1 +ATOM 1859 N NE . ARG A 1 228 ? -23.299 28.513 75.949 1.00 37.40 ? 228 ARG A NE 1 +ATOM 1860 C CZ . ARG A 1 228 ? -22.339 27.903 75.266 1.00 37.36 ? 228 ARG A CZ 1 +ATOM 1861 N NH1 . ARG A 1 228 ? -21.167 28.508 75.079 1.00 35.50 ? 228 ARG A NH1 1 +ATOM 1862 N NH2 . ARG A 1 228 ? -22.565 26.700 74.758 1.00 35.62 ? 228 ARG A NH2 1 +ATOM 1863 N N . PHE A 1 229 ? -24.614 34.978 77.396 1.00 38.15 ? 229 PHE A N 1 +ATOM 1864 C CA . PHE A 1 229 ? -24.286 36.268 78.017 1.00 38.19 ? 229 PHE A CA 1 +ATOM 1865 C C . PHE A 1 229 ? -24.703 37.445 77.129 1.00 38.11 ? 229 PHE A C 1 +ATOM 1866 O O . PHE A 1 229 ? -23.862 38.225 76.670 1.00 36.83 ? 229 PHE A O 1 +ATOM 1867 C CB . PHE A 1 229 ? -22.786 36.350 78.307 1.00 36.44 ? 229 PHE A CB 1 +ATOM 1868 C CG . PHE A 1 229 ? -22.310 35.320 79.281 1.00 36.18 ? 229 PHE A CG 1 +ATOM 1869 C CD1 . PHE A 1 229 ? -21.970 34.039 78.850 1.00 35.67 ? 229 PHE A CD1 1 +ATOM 1870 C CD2 . PHE A 1 229 ? -22.241 35.615 80.640 1.00 35.36 ? 229 PHE A CD2 1 +ATOM 1871 C CE1 . PHE A 1 229 ? -21.569 33.064 79.761 1.00 34.57 ? 229 PHE A CE1 1 +ATOM 1872 C CE2 . PHE A 1 229 ? -21.840 34.643 81.563 1.00 36.31 ? 229 PHE A CE2 1 +ATOM 1873 C CZ . PHE A 1 229 ? -21.504 33.364 81.120 1.00 34.77 ? 229 PHE A CZ 1 +ATOM 1874 N N . PRO A 1 230 ? -26.017 37.583 76.886 1.00 38.17 ? 230 PRO A N 1 +ATOM 1875 C CA . PRO A 1 230 ? -26.578 38.647 76.057 1.00 37.67 ? 230 PRO A CA 1 +ATOM 1876 C C . PRO A 1 230 ? -26.496 40.010 76.732 1.00 38.01 ? 230 PRO A C 1 +ATOM 1877 O O . PRO A 1 230 ? -26.494 41.040 76.067 1.00 37.82 ? 230 PRO A O 1 +ATOM 1878 C CB . PRO A 1 230 ? -28.012 38.187 75.859 1.00 38.19 ? 230 PRO A CB 1 +ATOM 1879 C CG . PRO A 1 230 ? -28.329 37.550 77.181 1.00 36.79 ? 230 PRO A CG 1 +ATOM 1880 C CD . PRO A 1 230 ? -27.092 36.739 77.451 1.00 37.44 ? 230 PRO A CD 1 +ATOM 1881 N N . GLU A 1 231 ? -26.416 40.010 78.056 1.00 38.09 ? 231 GLU A N 1 +ATOM 1882 C CA . GLU A 1 231 ? -26.351 41.257 78.805 1.00 39.76 ? 231 GLU A CA 1 +ATOM 1883 C C . GLU A 1 231 ? -25.189 41.278 79.801 1.00 38.48 ? 231 GLU A C 1 +ATOM 1884 O O . GLU A 1 231 ? -25.381 41.304 81.012 1.00 36.94 ? 231 GLU A O 1 +ATOM 1885 C CB . GLU A 1 231 ? -27.688 41.464 79.508 1.00 41.74 ? 231 GLU A CB 1 +ATOM 1886 C CG . GLU A 1 231 ? -28.834 41.464 78.506 1.00 48.90 ? 231 GLU A CG 1 +ATOM 1887 C CD . GLU A 1 231 ? -30.198 41.444 79.157 1.00 54.00 ? 231 GLU A CD 1 +ATOM 1888 O OE1 . GLU A 1 231 ? -30.520 42.419 79.877 1.00 56.50 ? 231 GLU A OE1 1 +ATOM 1889 O OE2 . GLU A 1 231 ? -30.947 40.453 78.950 1.00 56.82 ? 231 GLU A OE2 1 +ATOM 1890 N N . PRO A 1 232 ? -23.959 41.290 79.290 1.00 38.22 ? 232 PRO A N 1 +ATOM 1891 C CA . PRO A 1 232 ? -22.798 41.304 80.180 1.00 39.56 ? 232 PRO A CA 1 +ATOM 1892 C C . PRO A 1 232 ? -22.797 42.395 81.259 1.00 41.17 ? 232 PRO A C 1 +ATOM 1893 O O . PRO A 1 232 ? -22.395 42.140 82.404 1.00 40.98 ? 232 PRO A O 1 +ATOM 1894 C CB . PRO A 1 232 ? -21.611 41.386 79.210 1.00 39.97 ? 232 PRO A CB 1 +ATOM 1895 C CG . PRO A 1 232 ? -22.198 41.978 77.963 1.00 40.08 ? 232 PRO A CG 1 +ATOM 1896 C CD . PRO A 1 232 ? -23.557 41.347 77.875 1.00 38.01 ? 232 PRO A CD 1 +ATOM 1897 N N . LYS A 1 233 ? -23.256 43.598 80.923 1.00 41.61 ? 233 LYS A N 1 +ATOM 1898 C CA . LYS A 1 233 ? -23.280 44.664 81.917 1.00 41.89 ? 233 LYS A CA 1 +ATOM 1899 C C . LYS A 1 233 ? -24.188 44.296 83.088 1.00 41.61 ? 233 LYS A C 1 +ATOM 1900 O O . LYS A 1 233 ? -23.845 44.525 84.248 1.00 40.67 ? 233 LYS A O 1 +ATOM 1901 C CB . LYS A 1 233 ? -23.741 45.987 81.304 1.00 44.23 ? 233 LYS A CB 1 +ATOM 1902 C CG . LYS A 1 233 ? -23.593 47.154 82.267 1.00 46.46 ? 233 LYS A CG 1 +ATOM 1903 C CD . LYS A 1 233 ? -23.774 48.493 81.589 1.00 48.99 ? 233 LYS A CD 1 +ATOM 1904 C CE . LYS A 1 233 ? -23.531 49.624 82.575 1.00 50.57 ? 233 LYS A CE 1 +ATOM 1905 N NZ . LYS A 1 233 ? -24.389 49.480 83.789 1.00 51.06 ? 233 LYS A NZ 1 +ATOM 1906 N N . LYS A 1 234 ? -25.345 43.720 82.786 1.00 41.05 ? 234 LYS A N 1 +ATOM 1907 C CA . LYS A 1 234 ? -26.267 43.311 83.833 1.00 41.19 ? 234 LYS A CA 1 +ATOM 1908 C C . LYS A 1 234 ? -25.591 42.313 84.791 1.00 41.66 ? 234 LYS A C 1 +ATOM 1909 O O . LYS A 1 234 ? -25.730 42.424 86.008 1.00 42.05 ? 234 LYS A O 1 +ATOM 1910 C CB . LYS A 1 234 ? -27.507 42.678 83.214 1.00 42.19 ? 234 LYS A CB 1 +ATOM 1911 C CG . LYS A 1 234 ? -28.460 42.087 84.228 1.00 45.97 ? 234 LYS A CG 1 +ATOM 1912 C CD . LYS A 1 234 ? -29.692 41.526 83.559 1.00 48.33 ? 234 LYS A CD 1 +ATOM 1913 C CE . LYS A 1 234 ? -30.612 40.901 84.585 1.00 52.01 ? 234 LYS A CE 1 +ATOM 1914 N NZ . LYS A 1 234 ? -31.867 40.396 83.957 1.00 54.74 ? 234 LYS A NZ 1 +ATOM 1915 N N . LEU A 1 235 ? -24.864 41.344 84.238 1.00 40.28 ? 235 LEU A N 1 +ATOM 1916 C CA . LEU A 1 235 ? -24.168 40.342 85.041 1.00 39.78 ? 235 LEU A CA 1 +ATOM 1917 C C . LEU A 1 235 ? -23.142 41.006 85.953 1.00 39.19 ? 235 LEU A C 1 +ATOM 1918 O O . LEU A 1 235 ? -23.165 40.823 87.173 1.00 38.06 ? 235 LEU A O 1 +ATOM 1919 C CB . LEU A 1 235 ? -23.463 39.325 84.126 1.00 40.12 ? 235 LEU A CB 1 +ATOM 1920 C CG . LEU A 1 235 ? -22.386 38.403 84.719 1.00 38.86 ? 235 LEU A CG 1 +ATOM 1921 C CD1 . LEU A 1 235 ? -22.994 37.466 85.741 1.00 37.95 ? 235 LEU A CD1 1 +ATOM 1922 C CD2 . LEU A 1 235 ? -21.737 37.605 83.601 1.00 39.34 ? 235 LEU A CD2 1 +ATOM 1923 N N . ILE A 1 236 ? -22.248 41.784 85.352 1.00 39.37 ? 236 ILE A N 1 +ATOM 1924 C CA . ILE A 1 236 ? -21.205 42.482 86.100 1.00 40.27 ? 236 ILE A CA 1 +ATOM 1925 C C . ILE A 1 236 ? -21.784 43.341 87.226 1.00 41.03 ? 236 ILE A C 1 +ATOM 1926 O O . ILE A 1 236 ? -21.232 43.396 88.331 1.00 41.87 ? 236 ILE A O 1 +ATOM 1927 C CB . ILE A 1 236 ? -20.362 43.373 85.168 1.00 39.89 ? 236 ILE A CB 1 +ATOM 1928 C CG1 . ILE A 1 236 ? -19.794 42.527 84.031 1.00 39.37 ? 236 ILE A CG1 1 +ATOM 1929 C CG2 . ILE A 1 236 ? -19.212 44.012 85.946 1.00 42.58 ? 236 ILE A CG2 1 +ATOM 1930 C CD1 . ILE A 1 236 ? -18.990 43.308 83.023 1.00 40.58 ? 236 ILE A CD1 1 +ATOM 1931 N N . ASP A 1 237 ? -22.897 44.008 86.941 1.00 40.85 ? 237 ASP A N 1 +ATOM 1932 C CA . ASP A 1 237 ? -23.546 44.848 87.930 1.00 39.98 ? 237 ASP A CA 1 +ATOM 1933 C C . ASP A 1 237 ? -24.115 43.990 89.048 1.00 38.13 ? 237 ASP A C 1 +ATOM 1934 O O . ASP A 1 237 ? -23.994 44.339 90.218 1.00 37.03 ? 237 ASP A O 1 +ATOM 1935 C CB . ASP A 1 237 ? -24.652 45.691 87.272 1.00 43.47 ? 237 ASP A CB 1 +ATOM 1936 C CG . ASP A 1 237 ? -24.095 46.910 86.497 1.00 47.22 ? 237 ASP A CG 1 +ATOM 1937 O OD1 . ASP A 1 237 ? -22.854 47.089 86.433 1.00 46.00 ? 237 ASP A OD1 1 +ATOM 1938 O OD2 . ASP A 1 237 ? -24.908 47.696 85.951 1.00 49.63 ? 237 ASP A OD2 1 +ATOM 1939 N N . GLU A 1 238 ? -24.720 42.862 88.689 1.00 38.71 ? 238 GLU A N 1 +ATOM 1940 C CA . GLU A 1 238 ? -25.296 41.947 89.679 1.00 38.95 ? 238 GLU A CA 1 +ATOM 1941 C C . GLU A 1 238 ? -24.200 41.413 90.606 1.00 37.74 ? 238 GLU A C 1 +ATOM 1942 O O . GLU A 1 238 ? -24.381 41.338 91.827 1.00 36.73 ? 238 GLU A O 1 +ATOM 1943 C CB . GLU A 1 238 ? -25.997 40.782 88.982 1.00 40.69 ? 238 GLU A CB 1 +ATOM 1944 C CG . GLU A 1 238 ? -27.141 41.203 88.073 1.00 47.35 ? 238 GLU A CG 1 +ATOM 1945 C CD . GLU A 1 238 ? -28.472 40.557 88.447 1.00 52.06 ? 238 GLU A CD 1 +ATOM 1946 O OE1 . GLU A 1 238 ? -28.916 40.724 89.614 1.00 55.90 ? 238 GLU A OE1 1 +ATOM 1947 O OE2 . GLU A 1 238 ? -29.074 39.887 87.573 1.00 52.07 ? 238 GLU A OE2 1 +ATOM 1948 N N . LEU A 1 239 ? -23.062 41.048 90.026 1.00 36.33 ? 239 LEU A N 1 +ATOM 1949 C CA . LEU A 1 239 ? -21.944 40.546 90.815 1.00 36.88 ? 239 LEU A CA 1 +ATOM 1950 C C . LEU A 1 239 ? -21.349 41.646 91.687 1.00 37.68 ? 239 LEU A C 1 +ATOM 1951 O O . LEU A 1 239 ? -21.037 41.417 92.858 1.00 36.53 ? 239 LEU A O 1 +ATOM 1952 C CB . LEU A 1 239 ? -20.857 39.967 89.905 1.00 36.07 ? 239 LEU A CB 1 +ATOM 1953 C CG . LEU A 1 239 ? -21.233 38.668 89.190 1.00 36.04 ? 239 LEU A CG 1 +ATOM 1954 C CD1 . LEU A 1 239 ? -20.155 38.299 88.186 1.00 35.13 ? 239 LEU A CD1 1 +ATOM 1955 C CD2 . LEU A 1 239 ? -21.445 37.567 90.217 1.00 33.27 ? 239 LEU A CD2 1 +ATOM 1956 N N . HIS A 1 240 ? -21.190 42.840 91.122 1.00 38.70 ? 240 HIS A N 1 +ATOM 1957 C CA . HIS A 1 240 ? -20.630 43.942 91.891 1.00 40.09 ? 240 HIS A CA 1 +ATOM 1958 C C . HIS A 1 240 ? -21.556 44.351 93.035 1.00 40.37 ? 240 HIS A C 1 +ATOM 1959 O O . HIS A 1 240 ? -21.101 44.673 94.132 1.00 39.67 ? 240 HIS A O 1 +ATOM 1960 C CB . HIS A 1 240 ? -20.325 45.128 90.978 1.00 40.93 ? 240 HIS A CB 1 +ATOM 1961 C CG . HIS A 1 240 ? -19.045 44.977 90.213 1.00 42.68 ? 240 HIS A CG 1 +ATOM 1962 N ND1 . HIS A 1 240 ? -18.515 45.986 89.438 1.00 43.35 ? 240 HIS A ND1 1 +ATOM 1963 C CD2 . HIS A 1 240 ? -18.190 43.932 90.105 1.00 43.18 ? 240 HIS A CD2 1 +ATOM 1964 C CE1 . HIS A 1 240 ? -17.389 45.571 88.885 1.00 42.44 ? 240 HIS A CE1 1 +ATOM 1965 N NE2 . HIS A 1 240 ? -17.170 44.327 89.273 1.00 45.25 ? 240 HIS A NE2 1 +ATOM 1966 N N . LYS A 1 241 ? -22.858 44.322 92.783 1.00 40.71 ? 241 LYS A N 1 +ATOM 1967 C CA . LYS A 1 241 ? -23.822 44.654 93.816 1.00 41.32 ? 241 LYS A CA 1 +ATOM 1968 C C . LYS A 1 241 ? -23.628 43.709 95.008 1.00 42.40 ? 241 LYS A C 1 +ATOM 1969 O O . LYS A 1 241 ? -23.807 44.101 96.161 1.00 43.92 ? 241 LYS A O 1 +ATOM 1970 C CB . LYS A 1 241 ? -25.231 44.501 93.269 1.00 42.01 ? 241 LYS A CB 1 +ATOM 1971 C CG . LYS A 1 241 ? -26.325 44.581 94.305 1.00 44.09 ? 241 LYS A CG 1 +ATOM 1972 C CD . LYS A 1 241 ? -27.629 44.096 93.694 1.00 48.28 ? 241 LYS A CD 1 +ATOM 1973 C CE . LYS A 1 241 ? -28.752 44.059 94.717 1.00 49.98 ? 241 LYS A CE 1 +ATOM 1974 N NZ . LYS A 1 241 ? -29.987 43.470 94.114 1.00 52.20 ? 241 LYS A NZ 1 +ATOM 1975 N N . ARG A 1 242 ? -23.260 42.462 94.726 1.00 42.28 ? 242 ARG A N 1 +ATOM 1976 C CA . ARG A 1 242 ? -23.052 41.470 95.777 1.00 40.48 ? 242 ARG A CA 1 +ATOM 1977 C C . ARG A 1 242 ? -21.602 41.450 96.243 1.00 40.02 ? 242 ARG A C 1 +ATOM 1978 O O . ARG A 1 242 ? -21.173 40.546 96.947 1.00 40.09 ? 242 ARG A O 1 +ATOM 1979 C CB . ARG A 1 242 ? -23.482 40.099 95.268 1.00 40.01 ? 242 ARG A CB 1 +ATOM 1980 C CG . ARG A 1 242 ? -24.949 40.065 94.872 1.00 40.44 ? 242 ARG A CG 1 +ATOM 1981 C CD . ARG A 1 242 ? -25.298 38.795 94.134 1.00 41.18 ? 242 ARG A CD 1 +ATOM 1982 N NE . ARG A 1 242 ? -26.730 38.677 93.864 1.00 42.36 ? 242 ARG A NE 1 +ATOM 1983 C CZ . ARG A 1 242 ? -27.421 39.465 93.043 1.00 42.26 ? 242 ARG A CZ 1 +ATOM 1984 N NH1 . ARG A 1 242 ? -26.825 40.456 92.386 1.00 41.87 ? 242 ARG A NH1 1 +ATOM 1985 N NH2 . ARG A 1 242 ? -28.719 39.256 92.877 1.00 43.11 ? 242 ARG A NH2 1 +ATOM 1986 N N . ASN A 1 243 ? -20.855 42.473 95.851 1.00 39.83 ? 243 ASN A N 1 +ATOM 1987 C CA . ASN A 1 243 ? -19.458 42.602 96.232 1.00 39.43 ? 243 ASN A CA 1 +ATOM 1988 C C . ASN A 1 243 ? -18.639 41.386 95.814 1.00 37.95 ? 243 ASN A C 1 +ATOM 1989 O O . ASN A 1 243 ? -17.843 40.857 96.591 1.00 37.86 ? 243 ASN A O 1 +ATOM 1990 C CB . ASN A 1 243 ? -19.341 42.807 97.743 1.00 40.89 ? 243 ASN A CB 1 +ATOM 1991 C CG . ASN A 1 243 ? -17.969 43.314 98.155 1.00 43.10 ? 243 ASN A CG 1 +ATOM 1992 O OD1 . ASN A 1 243 ? -17.535 43.115 99.291 1.00 45.25 ? 243 ASN A OD1 1 +ATOM 1993 N ND2 . ASN A 1 243 ? -17.280 43.984 97.233 1.00 41.93 ? 243 ASN A ND2 1 +ATOM 1994 N N . VAL A 1 244 ? -18.849 40.944 94.580 1.00 37.30 ? 244 VAL A N 1 +ATOM 1995 C CA . VAL A 1 244 ? -18.130 39.803 94.032 1.00 34.26 ? 244 VAL A CA 1 +ATOM 1996 C C . VAL A 1 244 ? -17.407 40.237 92.778 1.00 33.31 ? 244 VAL A C 1 +ATOM 1997 O O . VAL A 1 244 ? -18.016 40.820 91.891 1.00 34.12 ? 244 VAL A O 1 +ATOM 1998 C CB . VAL A 1 244 ? -19.102 38.656 93.694 1.00 34.62 ? 244 VAL A CB 1 +ATOM 1999 C CG1 . VAL A 1 244 ? -18.381 37.558 92.920 1.00 31.80 ? 244 VAL A CG1 1 +ATOM 2000 C CG2 . VAL A 1 244 ? -19.695 38.103 94.983 1.00 31.41 ? 244 VAL A CG2 1 +ATOM 2001 N N . LYS A 1 245 ? -16.106 39.969 92.716 1.00 33.20 ? 245 LYS A N 1 +ATOM 2002 C CA . LYS A 1 245 ? -15.304 40.337 91.555 1.00 34.47 ? 245 LYS A CA 1 +ATOM 2003 C C . LYS A 1 245 ? -15.548 39.380 90.399 1.00 34.55 ? 245 LYS A C 1 +ATOM 2004 O O . LYS A 1 245 ? -15.965 38.243 90.611 1.00 35.83 ? 245 LYS A O 1 +ATOM 2005 C CB . LYS A 1 245 ? -13.820 40.307 91.912 1.00 35.80 ? 245 LYS A CB 1 +ATOM 2006 C CG . LYS A 1 245 ? -13.451 41.173 93.087 1.00 36.52 ? 245 LYS A CG 1 +ATOM 2007 C CD . LYS A 1 245 ? -13.651 42.634 92.769 1.00 37.43 ? 245 LYS A CD 1 +ATOM 2008 C CE . LYS A 1 245 ? -13.410 43.473 94.002 1.00 40.10 ? 245 LYS A CE 1 +ATOM 2009 N NZ . LYS A 1 245 ? -13.525 44.934 93.706 1.00 44.79 ? 245 LYS A NZ 1 +ATOM 2010 N N . LEU A 1 246 ? -15.291 39.841 89.177 1.00 34.83 ? 246 LEU A N 1 +ATOM 2011 C CA . LEU A 1 246 ? -15.466 39.009 87.989 1.00 33.70 ? 246 LEU A CA 1 +ATOM 2012 C C . LEU A 1 246 ? -14.137 38.889 87.260 1.00 34.16 ? 246 LEU A C 1 +ATOM 2013 O O . LEU A 1 246 ? -13.557 39.892 86.845 1.00 34.46 ? 246 LEU A O 1 +ATOM 2014 C CB . LEU A 1 246 ? -16.499 39.614 87.036 1.00 35.16 ? 246 LEU A CB 1 +ATOM 2015 C CG . LEU A 1 246 ? -16.617 38.884 85.684 1.00 35.81 ? 246 LEU A CG 1 +ATOM 2016 C CD1 . LEU A 1 246 ? -17.172 37.479 85.918 1.00 37.15 ? 246 LEU A CD1 1 +ATOM 2017 C CD2 . LEU A 1 246 ? -17.516 39.649 84.739 1.00 33.97 ? 246 LEU A CD2 1 +ATOM 2018 N N . ILE A 1 247 ? -13.646 37.659 87.125 1.00 34.10 ? 247 ILE A N 1 +ATOM 2019 C CA . ILE A 1 247 ? -12.383 37.413 86.433 1.00 33.66 ? 247 ILE A CA 1 +ATOM 2020 C C . ILE A 1 247 ? -12.709 36.612 85.175 1.00 33.73 ? 247 ILE A C 1 +ATOM 2021 O O . ILE A 1 247 ? -13.409 35.605 85.239 1.00 34.02 ? 247 ILE A O 1 +ATOM 2022 C CB . ILE A 1 247 ? -11.391 36.618 87.311 1.00 32.13 ? 247 ILE A CB 1 +ATOM 2023 C CG1 . ILE A 1 247 ? -11.007 37.430 88.558 1.00 31.94 ? 247 ILE A CG1 1 +ATOM 2024 C CG2 . ILE A 1 247 ? -10.146 36.307 86.522 1.00 30.35 ? 247 ILE A CG2 1 +ATOM 2025 C CD1 . ILE A 1 247 ? -12.000 37.334 89.696 1.00 32.70 ? 247 ILE A CD1 1 +ATOM 2026 N N . THR A 1 248 ? -12.219 37.072 84.031 1.00 33.15 ? 248 THR A N 1 +ATOM 2027 C CA . THR A 1 248 ? -12.501 36.408 82.768 1.00 31.24 ? 248 THR A CA 1 +ATOM 2028 C C . THR A 1 248 ? -11.248 35.810 82.150 1.00 31.99 ? 248 THR A C 1 +ATOM 2029 O O . THR A 1 248 ? -10.177 36.421 82.145 1.00 30.45 ? 248 THR A O 1 +ATOM 2030 C CB . THR A 1 248 ? -13.127 37.381 81.742 1.00 31.31 ? 248 THR A CB 1 +ATOM 2031 O OG1 . THR A 1 248 ? -12.230 38.472 81.503 1.00 31.68 ? 248 THR A OG1 1 +ATOM 2032 C CG2 . THR A 1 248 ? -14.454 37.922 82.248 1.00 31.82 ? 248 THR A CG2 1 +ATOM 2033 N N . ILE A 1 249 ? -11.393 34.601 81.627 1.00 32.71 ? 249 ILE A N 1 +ATOM 2034 C CA . ILE A 1 249 ? -10.279 33.927 81.000 1.00 33.07 ? 249 ILE A CA 1 +ATOM 2035 C C . ILE A 1 249 ? -10.012 34.560 79.637 1.00 33.82 ? 249 ILE A C 1 +ATOM 2036 O O . ILE A 1 249 ? -10.928 35.007 78.945 1.00 33.05 ? 249 ILE A O 1 +ATOM 2037 C CB . ILE A 1 249 ? -10.573 32.423 80.834 1.00 34.21 ? 249 ILE A CB 1 +ATOM 2038 C CG1 . ILE A 1 249 ? -9.281 31.684 80.491 1.00 34.23 ? 249 ILE A CG1 1 +ATOM 2039 C CG2 . ILE A 1 249 ? -11.619 32.200 79.740 1.00 31.47 ? 249 ILE A CG2 1 +ATOM 2040 C CD1 . ILE A 1 249 ? -9.424 30.178 80.540 1.00 36.37 ? 249 ILE A CD1 1 +ATOM 2041 N N . VAL A 1 250 ? -8.743 34.613 79.270 1.00 34.17 ? 250 VAL A N 1 +ATOM 2042 C CA . VAL A 1 250 ? -8.336 35.171 77.999 1.00 36.05 ? 250 VAL A CA 1 +ATOM 2043 C C . VAL A 1 250 ? -7.226 34.278 77.454 1.00 37.90 ? 250 VAL A C 1 +ATOM 2044 O O . VAL A 1 250 ? -6.150 34.182 78.050 1.00 38.90 ? 250 VAL A O 1 +ATOM 2045 C CB . VAL A 1 250 ? -7.785 36.616 78.169 1.00 35.61 ? 250 VAL A CB 1 +ATOM 2046 C CG1 . VAL A 1 250 ? -7.270 37.147 76.841 1.00 35.59 ? 250 VAL A CG1 1 +ATOM 2047 C CG2 . VAL A 1 250 ? -8.868 37.525 78.711 1.00 36.35 ? 250 VAL A CG2 1 +ATOM 2048 N N . ASP A 1 251 ? -7.484 33.609 76.338 1.00 38.40 ? 251 ASP A N 1 +ATOM 2049 C CA . ASP A 1 251 ? -6.455 32.762 75.754 1.00 40.61 ? 251 ASP A CA 1 +ATOM 2050 C C . ASP A 1 251 ? -5.546 33.626 74.887 1.00 40.46 ? 251 ASP A C 1 +ATOM 2051 O O . ASP A 1 251 ? -5.692 34.845 74.855 1.00 39.84 ? 251 ASP A O 1 +ATOM 2052 C CB . ASP A 1 251 ? -7.091 31.651 74.930 1.00 42.13 ? 251 ASP A CB 1 +ATOM 2053 C CG . ASP A 1 251 ? -8.031 30.799 75.748 1.00 44.22 ? 251 ASP A CG 1 +ATOM 2054 O OD1 . ASP A 1 251 ? -7.559 30.134 76.693 1.00 46.37 ? 251 ASP A OD1 1 +ATOM 2055 O OD2 . ASP A 1 251 ? -9.245 30.799 75.457 1.00 46.55 ? 251 ASP A OD2 1 +ATOM 2056 N N . HIS A 1 252 ? -4.616 32.996 74.179 1.00 40.87 ? 252 HIS A N 1 +ATOM 2057 C CA . HIS A 1 252 ? -3.669 33.732 73.342 1.00 41.06 ? 252 HIS A CA 1 +ATOM 2058 C C . HIS A 1 252 ? -3.930 33.556 71.844 1.00 40.38 ? 252 HIS A C 1 +ATOM 2059 O O . HIS A 1 252 ? -3.223 34.129 71.015 1.00 41.27 ? 252 HIS A O 1 +ATOM 2060 C CB . HIS A 1 252 ? -2.251 33.261 73.662 1.00 40.83 ? 252 HIS A CB 1 +ATOM 2061 C CG . HIS A 1 252 ? -2.019 31.820 73.340 1.00 41.35 ? 252 HIS A CG 1 +ATOM 2062 N ND1 . HIS A 1 252 ? -2.945 30.838 73.625 1.00 42.68 ? 252 HIS A ND1 1 +ATOM 2063 C CD2 . HIS A 1 252 ? -0.978 31.192 72.742 1.00 41.50 ? 252 HIS A CD2 1 +ATOM 2064 C CE1 . HIS A 1 252 ? -2.487 29.669 73.213 1.00 41.82 ? 252 HIS A CE1 1 +ATOM 2065 N NE2 . HIS A 1 252 ? -1.295 29.855 72.675 1.00 41.42 ? 252 HIS A NE2 1 +ATOM 2066 N N . GLY A 1 253 ? -4.940 32.765 71.500 1.00 38.35 ? 253 GLY A N 1 +ATOM 2067 C CA . GLY A 1 253 ? -5.232 32.525 70.100 1.00 35.88 ? 253 GLY A CA 1 +ATOM 2068 C C . GLY A 1 253 ? -6.227 33.473 69.466 1.00 34.96 ? 253 GLY A C 1 +ATOM 2069 O O . GLY A 1 253 ? -7.336 33.665 69.964 1.00 34.97 ? 253 GLY A O 1 +ATOM 2070 N N . ILE A 1 254 ? -5.820 34.065 68.350 1.00 33.82 ? 254 ILE A N 1 +ATOM 2071 C CA . ILE A 1 254 ? -6.671 34.989 67.618 1.00 33.33 ? 254 ILE A CA 1 +ATOM 2072 C C . ILE A 1 254 ? -7.254 34.255 66.415 1.00 32.09 ? 254 ILE A C 1 +ATOM 2073 O O . ILE A 1 254 ? -6.523 33.781 65.549 1.00 30.45 ? 254 ILE A O 1 +ATOM 2074 C CB . ILE A 1 254 ? -5.869 36.212 67.129 1.00 33.76 ? 254 ILE A CB 1 +ATOM 2075 C CG1 . ILE A 1 254 ? -5.310 36.989 68.332 1.00 32.03 ? 254 ILE A CG1 1 +ATOM 2076 C CG2 . ILE A 1 254 ? -6.761 37.100 66.264 1.00 33.26 ? 254 ILE A CG2 1 +ATOM 2077 C CD1 . ILE A 1 254 ? -6.368 37.633 69.196 1.00 30.47 ? 254 ILE A CD1 1 +ATOM 2078 N N . ARG A 1 255 ? -8.576 34.162 66.372 1.00 31.75 ? 255 ARG A N 1 +ATOM 2079 C CA . ARG A 1 255 ? -9.245 33.469 65.288 1.00 31.95 ? 255 ARG A CA 1 +ATOM 2080 C C . ARG A 1 255 ? -9.016 34.098 63.909 1.00 31.93 ? 255 ARG A C 1 +ATOM 2081 O O . ARG A 1 255 ? -9.181 35.302 63.725 1.00 31.98 ? 255 ARG A O 1 +ATOM 2082 C CB . ARG A 1 255 ? -10.743 33.381 65.591 1.00 32.43 ? 255 ARG A CB 1 +ATOM 2083 C CG . ARG A 1 255 ? -11.527 32.584 64.564 1.00 35.08 ? 255 ARG A CG 1 +ATOM 2084 C CD . ARG A 1 255 ? -12.798 32.023 65.162 1.00 37.24 ? 255 ARG A CD 1 +ATOM 2085 N NE . ARG A 1 255 ? -13.953 32.344 64.337 1.00 39.92 ? 255 ARG A NE 1 +ATOM 2086 C CZ . ARG A 1 255 ? -14.863 31.460 63.944 1.00 40.45 ? 255 ARG A CZ 1 +ATOM 2087 N NH1 . ARG A 1 255 ? -14.756 30.188 64.299 1.00 38.66 ? 255 ARG A NH1 1 +ATOM 2088 N NH2 . ARG A 1 255 ? -15.885 31.855 63.199 1.00 42.16 ? 255 ARG A NH2 1 +ATOM 2089 N N . VAL A 1 256 ? -8.617 33.277 62.940 1.00 31.85 ? 256 VAL A N 1 +ATOM 2090 C CA . VAL A 1 256 ? -8.402 33.751 61.575 1.00 31.28 ? 256 VAL A CA 1 +ATOM 2091 C C . VAL A 1 256 ? -9.793 33.883 60.964 1.00 32.49 ? 256 VAL A C 1 +ATOM 2092 O O . VAL A 1 256 ? -10.266 33.008 60.246 1.00 30.89 ? 256 VAL A O 1 +ATOM 2093 C CB . VAL A 1 256 ? -7.552 32.753 60.758 1.00 29.44 ? 256 VAL A CB 1 +ATOM 2094 C CG1 . VAL A 1 256 ? -7.375 33.251 59.347 1.00 26.33 ? 256 VAL A CG1 1 +ATOM 2095 C CG2 . VAL A 1 256 ? -6.194 32.577 61.413 1.00 27.46 ? 256 VAL A CG2 1 +ATOM 2096 N N . ASP A 1 257 ? -10.429 35.006 61.280 1.00 34.16 ? 257 ASP A N 1 +ATOM 2097 C CA . ASP A 1 257 ? -11.783 35.316 60.862 1.00 36.64 ? 257 ASP A CA 1 +ATOM 2098 C C . ASP A 1 257 ? -11.790 36.681 60.160 1.00 37.61 ? 257 ASP A C 1 +ATOM 2099 O O . ASP A 1 257 ? -11.370 37.691 60.726 1.00 37.29 ? 257 ASP A O 1 +ATOM 2100 C CB . ASP A 1 257 ? -12.667 35.343 62.119 1.00 38.87 ? 257 ASP A CB 1 +ATOM 2101 C CG . ASP A 1 257 ? -14.130 35.468 61.808 1.00 39.89 ? 257 ASP A CG 1 +ATOM 2102 O OD1 . ASP A 1 257 ? -14.485 36.300 60.945 1.00 41.10 ? 257 ASP A OD1 1 +ATOM 2103 O OD2 . ASP A 1 257 ? -14.925 34.739 62.448 1.00 43.66 ? 257 ASP A OD2 1 +ATOM 2104 N N . GLN A 1 258 ? -12.276 36.691 58.927 1.00 38.07 ? 258 GLN A N 1 +ATOM 2105 C CA . GLN A 1 258 ? -12.353 37.886 58.096 1.00 39.32 ? 258 GLN A CA 1 +ATOM 2106 C C . GLN A 1 258 ? -13.118 39.056 58.697 1.00 41.13 ? 258 GLN A C 1 +ATOM 2107 O O . GLN A 1 258 ? -12.846 40.218 58.370 1.00 40.84 ? 258 GLN A O 1 +ATOM 2108 C CB . GLN A 1 258 ? -13.010 37.528 56.769 1.00 39.59 ? 258 GLN A CB 1 +ATOM 2109 C CG . GLN A 1 258 ? -12.050 37.474 55.630 1.00 39.55 ? 258 GLN A CG 1 +ATOM 2110 C CD . GLN A 1 258 ? -12.663 36.855 54.401 1.00 37.48 ? 258 GLN A CD 1 +ATOM 2111 O OE1 . GLN A 1 258 ? -12.070 36.895 53.329 1.00 37.51 ? 258 GLN A OE1 1 +ATOM 2112 N NE2 . GLN A 1 258 ? -13.849 36.265 54.547 1.00 34.76 ? 258 GLN A NE2 1 +ATOM 2113 N N . ASN A 1 259 ? -14.080 38.753 59.560 1.00 41.48 ? 259 ASN A N 1 +ATOM 2114 C CA . ASN A 1 259 ? -14.895 39.798 60.167 1.00 43.11 ? 259 ASN A CA 1 +ATOM 2115 C C . ASN A 1 259 ? -14.708 39.915 61.670 1.00 42.56 ? 259 ASN A C 1 +ATOM 2116 O O . ASN A 1 259 ? -15.566 40.450 62.368 1.00 44.25 ? 259 ASN A O 1 +ATOM 2117 C CB . ASN A 1 259 ? -16.360 39.531 59.840 1.00 44.03 ? 259 ASN A CB 1 +ATOM 2118 C CG . ASN A 1 259 ? -16.616 39.520 58.349 1.00 46.26 ? 259 ASN A CG 1 +ATOM 2119 O OD1 . ASN A 1 259 ? -17.213 38.583 57.815 1.00 48.11 ? 259 ASN A OD1 1 +ATOM 2120 N ND2 . ASN A 1 259 ? -16.156 40.566 57.661 1.00 45.00 ? 259 ASN A ND2 1 +ATOM 2121 N N . TYR A 1 260 ? -13.580 39.413 62.158 1.00 40.81 ? 260 TYR A N 1 +ATOM 2122 C CA . TYR A 1 260 ? -13.262 39.444 63.573 1.00 38.83 ? 260 TYR A CA 1 +ATOM 2123 C C . TYR A 1 260 ? -12.257 40.580 63.788 1.00 39.06 ? 260 TYR A C 1 +ATOM 2124 O O . TYR A 1 260 ? -11.102 40.524 63.347 1.00 38.49 ? 260 TYR A O 1 +ATOM 2125 C CB . TYR A 1 260 ? -12.688 38.087 63.981 1.00 37.72 ? 260 TYR A CB 1 +ATOM 2126 C CG . TYR A 1 260 ? -12.273 37.976 65.427 1.00 37.86 ? 260 TYR A CG 1 +ATOM 2127 C CD1 . TYR A 1 260 ? -13.146 38.326 66.454 1.00 36.78 ? 260 TYR A CD1 1 +ATOM 2128 C CD2 . TYR A 1 260 ? -11.004 37.506 65.767 1.00 36.62 ? 260 TYR A CD2 1 +ATOM 2129 C CE1 . TYR A 1 260 ? -12.765 38.213 67.780 1.00 38.35 ? 260 TYR A CE1 1 +ATOM 2130 C CE2 . TYR A 1 260 ? -10.613 37.388 67.089 1.00 37.29 ? 260 TYR A CE2 1 +ATOM 2131 C CZ . TYR A 1 260 ? -11.494 37.743 68.092 1.00 38.53 ? 260 TYR A CZ 1 +ATOM 2132 O OH . TYR A 1 260 ? -11.100 37.635 69.407 1.00 40.14 ? 260 TYR A OH 1 +ATOM 2133 N N . SER A 1 261 ? -12.719 41.618 64.469 1.00 38.36 ? 261 SER A N 1 +ATOM 2134 C CA . SER A 1 261 ? -11.922 42.808 64.727 1.00 38.27 ? 261 SER A CA 1 +ATOM 2135 C C . SER A 1 261 ? -10.471 42.622 65.199 1.00 37.07 ? 261 SER A C 1 +ATOM 2136 O O . SER A 1 261 ? -9.552 43.187 64.609 1.00 37.06 ? 261 SER A O 1 +ATOM 2137 C CB . SER A 1 261 ? -12.677 43.698 65.710 1.00 39.76 ? 261 SER A CB 1 +ATOM 2138 O OG . SER A 1 261 ? -11.969 44.897 65.929 1.00 44.05 ? 261 SER A OG 1 +ATOM 2139 N N . PRO A 1 262 ? -10.243 41.844 66.273 1.00 35.89 ? 262 PRO A N 1 +ATOM 2140 C CA . PRO A 1 262 ? -8.872 41.641 66.756 1.00 34.75 ? 262 PRO A CA 1 +ATOM 2141 C C . PRO A 1 262 ? -7.923 41.104 65.689 1.00 35.35 ? 262 PRO A C 1 +ATOM 2142 O O . PRO A 1 262 ? -6.739 41.457 65.663 1.00 34.61 ? 262 PRO A O 1 +ATOM 2143 C CB . PRO A 1 262 ? -9.057 40.663 67.908 1.00 34.91 ? 262 PRO A CB 1 +ATOM 2144 C CG . PRO A 1 262 ? -10.393 41.030 68.436 1.00 34.04 ? 262 PRO A CG 1 +ATOM 2145 C CD . PRO A 1 262 ? -11.207 41.183 67.168 1.00 35.63 ? 262 PRO A CD 1 +ATOM 2146 N N . PHE A 1 263 ? -8.443 40.246 64.815 1.00 35.05 ? 263 PHE A N 1 +ATOM 2147 C CA . PHE A 1 263 ? -7.640 39.675 63.744 1.00 34.36 ? 263 PHE A CA 1 +ATOM 2148 C C . PHE A 1 263 ? -7.205 40.780 62.788 1.00 34.83 ? 263 PHE A C 1 +ATOM 2149 O O . PHE A 1 263 ? -6.034 40.870 62.407 1.00 34.72 ? 263 PHE A O 1 +ATOM 2150 C CB . PHE A 1 263 ? -8.447 38.618 62.979 1.00 34.04 ? 263 PHE A CB 1 +ATOM 2151 C CG . PHE A 1 263 ? -7.710 38.023 61.805 1.00 33.82 ? 263 PHE A CG 1 +ATOM 2152 C CD1 . PHE A 1 263 ? -6.479 37.393 61.980 1.00 33.50 ? 263 PHE A CD1 1 +ATOM 2153 C CD2 . PHE A 1 263 ? -8.251 38.086 60.527 1.00 34.20 ? 263 PHE A CD2 1 +ATOM 2154 C CE1 . PHE A 1 263 ? -5.799 36.835 60.896 1.00 33.34 ? 263 PHE A CE1 1 +ATOM 2155 C CE2 . PHE A 1 263 ? -7.580 37.530 59.435 1.00 34.46 ? 263 PHE A CE2 1 +ATOM 2156 C CZ . PHE A 1 263 ? -6.352 36.904 59.623 1.00 33.85 ? 263 PHE A CZ 1 +ATOM 2157 N N . LEU A 1 264 ? -8.158 41.617 62.401 1.00 35.07 ? 264 LEU A N 1 +ATOM 2158 C CA . LEU A 1 264 ? -7.883 42.723 61.488 1.00 36.55 ? 264 LEU A CA 1 +ATOM 2159 C C . LEU A 1 264 ? -6.973 43.803 62.100 1.00 37.08 ? 264 LEU A C 1 +ATOM 2160 O O . LEU A 1 264 ? -6.052 44.282 61.442 1.00 36.72 ? 264 LEU A O 1 +ATOM 2161 C CB . LEU A 1 264 ? -9.203 43.351 61.028 1.00 36.02 ? 264 LEU A CB 1 +ATOM 2162 C CG . LEU A 1 264 ? -10.191 42.375 60.375 1.00 36.40 ? 264 LEU A CG 1 +ATOM 2163 C CD1 . LEU A 1 264 ? -11.493 43.083 60.057 1.00 34.05 ? 264 LEU A CD1 1 +ATOM 2164 C CD2 . LEU A 1 264 ? -9.575 41.782 59.115 1.00 35.12 ? 264 LEU A CD2 1 +ATOM 2165 N N . SER A 1 265 ? -7.212 44.175 63.357 1.00 36.69 ? 265 SER A N 1 +ATOM 2166 C CA . SER A 1 265 ? -6.389 45.200 63.994 1.00 36.96 ? 265 SER A CA 1 +ATOM 2167 C C . SER A 1 265 ? -5.020 44.684 64.429 1.00 38.33 ? 265 SER A C 1 +ATOM 2168 O O . SER A 1 265 ? -4.058 45.452 64.528 1.00 38.86 ? 265 SER A O 1 +ATOM 2169 C CB . SER A 1 265 ? -7.110 45.799 65.201 1.00 36.11 ? 265 SER A CB 1 +ATOM 2170 O OG . SER A 1 265 ? -7.094 44.916 66.305 1.00 38.94 ? 265 SER A OG 1 +ATOM 2171 N N . GLY A 1 266 ? -4.923 43.385 64.688 1.00 38.05 ? 266 GLY A N 1 +ATOM 2172 C CA . GLY A 1 266 ? -3.651 42.830 65.105 1.00 36.65 ? 266 GLY A CA 1 +ATOM 2173 C C . GLY A 1 266 ? -2.737 42.532 63.932 1.00 36.86 ? 266 GLY A C 1 +ATOM 2174 O O . GLY A 1 266 ? -1.539 42.278 64.113 1.00 36.43 ? 266 GLY A O 1 +ATOM 2175 N N . MET A 1 267 ? -3.290 42.578 62.724 1.00 35.81 ? 267 MET A N 1 +ATOM 2176 C CA . MET A 1 267 ? -2.509 42.274 61.539 1.00 37.19 ? 267 MET A CA 1 +ATOM 2177 C C . MET A 1 267 ? -1.199 43.044 61.539 1.00 37.75 ? 267 MET A C 1 +ATOM 2178 O O . MET A 1 267 ? -1.177 44.249 61.766 1.00 39.95 ? 267 MET A O 1 +ATOM 2179 C CB . MET A 1 267 ? -3.313 42.588 60.278 1.00 37.91 ? 267 MET A CB 1 +ATOM 2180 C CG . MET A 1 267 ? -2.766 41.935 59.013 1.00 39.06 ? 267 MET A CG 1 +ATOM 2181 S SD . MET A 1 267 ? -2.597 40.131 59.151 1.00 42.60 ? 267 MET A SD 1 +ATOM 2182 C CE . MET A 1 267 ? -4.313 39.616 59.036 1.00 42.84 ? 267 MET A CE 1 +ATOM 2183 N N . GLY A 1 268 ? -0.103 42.336 61.295 1.00 38.09 ? 268 GLY A N 1 +ATOM 2184 C CA . GLY A 1 268 ? 1.201 42.970 61.281 1.00 35.11 ? 268 GLY A CA 1 +ATOM 2185 C C . GLY A 1 268 ? 1.951 42.661 62.558 1.00 35.85 ? 268 GLY A C 1 +ATOM 2186 O O . GLY A 1 268 ? 3.180 42.739 62.591 1.00 36.60 ? 268 GLY A O 1 +ATOM 2187 N N . LYS A 1 269 ? 1.220 42.274 63.604 1.00 35.40 ? 269 LYS A N 1 +ATOM 2188 C CA . LYS A 1 269 ? 1.843 41.984 64.896 1.00 36.28 ? 269 LYS A CA 1 +ATOM 2189 C C . LYS A 1 269 ? 1.774 40.520 65.359 1.00 34.79 ? 269 LYS A C 1 +ATOM 2190 O O . LYS A 1 269 ? 2.007 40.221 66.533 1.00 35.45 ? 269 LYS A O 1 +ATOM 2191 C CB . LYS A 1 269 ? 1.227 42.911 65.956 1.00 37.16 ? 269 LYS A CB 1 +ATOM 2192 C CG . LYS A 1 269 ? 1.499 44.391 65.673 1.00 37.86 ? 269 LYS A CG 1 +ATOM 2193 C CD . LYS A 1 269 ? 0.652 45.317 66.529 1.00 39.85 ? 269 LYS A CD 1 +ATOM 2194 C CE . LYS A 1 269 ? -0.810 45.297 66.092 1.00 40.18 ? 269 LYS A CE 1 +ATOM 2195 N NZ . LYS A 1 269 ? -0.974 45.795 64.698 1.00 39.37 ? 269 LYS A NZ 1 +ATOM 2196 N N . PHE A 1 270 ? 1.482 39.614 64.431 1.00 32.45 ? 270 PHE A N 1 +ATOM 2197 C CA . PHE A 1 270 ? 1.370 38.195 64.744 1.00 30.22 ? 270 PHE A CA 1 +ATOM 2198 C C . PHE A 1 270 ? 2.671 37.448 64.493 1.00 31.32 ? 270 PHE A C 1 +ATOM 2199 O O . PHE A 1 270 ? 3.536 37.937 63.775 1.00 30.82 ? 270 PHE A O 1 +ATOM 2200 C CB . PHE A 1 270 ? 0.267 37.570 63.896 1.00 28.36 ? 270 PHE A CB 1 +ATOM 2201 C CG . PHE A 1 270 ? -1.091 38.183 64.110 1.00 27.65 ? 270 PHE A CG 1 +ATOM 2202 C CD1 . PHE A 1 270 ? -1.659 38.224 65.375 1.00 25.43 ? 270 PHE A CD1 1 +ATOM 2203 C CD2 . PHE A 1 270 ? -1.820 38.681 63.034 1.00 25.57 ? 270 PHE A CD2 1 +ATOM 2204 C CE1 . PHE A 1 270 ? -2.936 38.746 65.559 1.00 26.15 ? 270 PHE A CE1 1 +ATOM 2205 C CE2 . PHE A 1 270 ? -3.096 39.204 63.218 1.00 23.08 ? 270 PHE A CE2 1 +ATOM 2206 C CZ . PHE A 1 270 ? -3.651 39.234 64.480 1.00 23.82 ? 270 PHE A CZ 1 +ATOM 2207 N N . CYS A 1 271 ? 2.797 36.260 65.088 1.00 32.60 ? 271 CYS A N 1 +ATOM 2208 C CA . CYS A 1 271 ? 3.977 35.420 64.909 1.00 34.39 ? 271 CYS A CA 1 +ATOM 2209 C C . CYS A 1 271 ? 4.067 34.910 63.470 1.00 34.43 ? 271 CYS A C 1 +ATOM 2210 O O . CYS A 1 271 ? 3.049 34.677 62.823 1.00 31.54 ? 271 CYS A O 1 +ATOM 2211 C CB . CYS A 1 271 ? 3.916 34.213 65.846 1.00 36.68 ? 271 CYS A CB 1 +ATOM 2212 S SG . CYS A 1 271 ? 3.960 34.614 67.606 1.00 45.79 ? 271 CYS A SG 1 +ATOM 2213 N N . GLU A 1 272 ? 5.293 34.721 62.986 1.00 35.06 ? 272 GLU A N 1 +ATOM 2214 C CA . GLU A 1 272 ? 5.516 34.224 61.635 1.00 36.00 ? 272 GLU A CA 1 +ATOM 2215 C C . GLU A 1 272 ? 6.342 32.944 61.689 1.00 36.32 ? 272 GLU A C 1 +ATOM 2216 O O . GLU A 1 272 ? 6.735 32.497 62.763 1.00 36.50 ? 272 GLU A O 1 +ATOM 2217 C CB . GLU A 1 272 ? 6.280 35.261 60.806 1.00 36.55 ? 272 GLU A CB 1 +ATOM 2218 C CG . GLU A 1 272 ? 5.629 36.624 60.743 1.00 40.39 ? 272 GLU A CG 1 +ATOM 2219 C CD . GLU A 1 272 ? 6.465 37.640 59.969 1.00 45.21 ? 272 GLU A CD 1 +ATOM 2220 O OE1 . GLU A 1 272 ? 7.711 37.486 59.924 1.00 47.37 ? 272 GLU A OE1 1 +ATOM 2221 O OE2 . GLU A 1 272 ? 5.882 38.608 59.421 1.00 46.77 ? 272 GLU A OE2 1 +ATOM 2222 N N . ILE A 1 273 ? 6.585 32.353 60.523 1.00 35.89 ? 273 ILE A N 1 +ATOM 2223 C CA . ILE A 1 273 ? 7.420 31.167 60.438 1.00 36.60 ? 273 ILE A CA 1 +ATOM 2224 C C . ILE A 1 273 ? 8.646 31.554 59.604 1.00 37.65 ? 273 ILE A C 1 +ATOM 2225 O O . ILE A 1 273 ? 8.643 32.567 58.904 1.00 37.63 ? 273 ILE A O 1 +ATOM 2226 C CB . ILE A 1 273 ? 6.677 29.969 59.777 1.00 36.37 ? 273 ILE A CB 1 +ATOM 2227 C CG1 . ILE A 1 273 ? 6.096 30.380 58.420 1.00 36.02 ? 273 ILE A CG1 1 +ATOM 2228 C CG2 . ILE A 1 273 ? 5.565 29.473 60.697 1.00 35.30 ? 273 ILE A CG2 1 +ATOM 2229 C CD1 . ILE A 1 273 ? 5.525 29.207 57.633 1.00 32.36 ? 273 ILE A CD1 1 +ATOM 2230 N N . GLU A 1 274 ? 9.703 30.761 59.701 1.00 39.79 ? 274 GLU A N 1 +ATOM 2231 C CA . GLU A 1 274 ? 10.934 31.025 58.964 1.00 42.53 ? 274 GLU A CA 1 +ATOM 2232 C C . GLU A 1 274 ? 10.740 31.609 57.564 1.00 41.83 ? 274 GLU A C 1 +ATOM 2233 O O . GLU A 1 274 ? 11.331 32.625 57.225 1.00 41.87 ? 274 GLU A O 1 +ATOM 2234 C CB . GLU A 1 274 ? 11.762 29.738 58.848 1.00 46.40 ? 274 GLU A CB 1 +ATOM 2235 C CG . GLU A 1 274 ? 12.833 29.553 59.911 1.00 54.71 ? 274 GLU A CG 1 +ATOM 2236 C CD . GLU A 1 274 ? 13.902 30.639 59.850 1.00 59.85 ? 274 GLU A CD 1 +ATOM 2237 O OE1 . GLU A 1 274 ? 14.257 31.061 58.724 1.00 61.87 ? 274 GLU A OE1 1 +ATOM 2238 O OE2 . GLU A 1 274 ? 14.395 31.061 60.925 1.00 62.86 ? 274 GLU A OE2 1 +ATOM 2239 N N . SER A 1 275 ? 9.912 30.967 56.749 1.00 42.07 ? 275 SER A N 1 +ATOM 2240 C CA . SER A 1 275 ? 9.706 31.413 55.374 1.00 40.61 ? 275 SER A CA 1 +ATOM 2241 C C . SER A 1 275 ? 8.967 32.733 55.170 1.00 40.94 ? 275 SER A C 1 +ATOM 2242 O O . SER A 1 275 ? 8.822 33.189 54.033 1.00 41.52 ? 275 SER A O 1 +ATOM 2243 C CB . SER A 1 275 ? 9.033 30.298 54.565 1.00 40.20 ? 275 SER A CB 1 +ATOM 2244 O OG . SER A 1 275 ? 7.955 29.718 55.274 1.00 41.90 ? 275 SER A OG 1 +ATOM 2245 N N . GLY A 1 276 ? 8.493 33.352 56.247 1.00 40.05 ? 276 GLY A N 1 +ATOM 2246 C CA . GLY A 1 276 ? 7.822 34.632 56.094 1.00 38.34 ? 276 GLY A CA 1 +ATOM 2247 C C . GLY A 1 276 ? 6.312 34.727 56.213 1.00 39.13 ? 276 GLY A C 1 +ATOM 2248 O O . GLY A 1 276 ? 5.795 35.825 56.430 1.00 39.73 ? 276 GLY A O 1 +ATOM 2249 N N . GLU A 1 277 ? 5.584 33.622 56.057 1.00 38.84 ? 277 GLU A N 1 +ATOM 2250 C CA . GLU A 1 277 ? 4.127 33.693 56.184 1.00 37.62 ? 277 GLU A CA 1 +ATOM 2251 C C . GLU A 1 277 ? 3.767 33.757 57.661 1.00 35.98 ? 277 GLU A C 1 +ATOM 2252 O O . GLU A 1 277 ? 4.630 33.608 58.528 1.00 36.09 ? 277 GLU A O 1 +ATOM 2253 C CB . GLU A 1 277 ? 3.443 32.456 55.587 1.00 40.50 ? 277 GLU A CB 1 +ATOM 2254 C CG . GLU A 1 277 ? 3.935 31.991 54.224 1.00 43.55 ? 277 GLU A CG 1 +ATOM 2255 C CD . GLU A 1 277 ? 5.018 30.929 54.342 1.00 47.69 ? 277 GLU A CD 1 +ATOM 2256 O OE1 . GLU A 1 277 ? 6.144 31.288 54.762 1.00 47.55 ? 277 GLU A OE1 1 +ATOM 2257 O OE2 . GLU A 1 277 ? 4.738 29.738 54.030 1.00 47.53 ? 277 GLU A OE2 1 +ATOM 2258 N N . LEU A 1 278 ? 2.490 33.969 57.946 1.00 34.36 ? 278 LEU A N 1 +ATOM 2259 C CA . LEU A 1 278 ? 2.030 33.995 59.327 1.00 33.41 ? 278 LEU A CA 1 +ATOM 2260 C C . LEU A 1 278 ? 2.042 32.564 59.844 1.00 32.98 ? 278 LEU A C 1 +ATOM 2261 O O . LEU A 1 278 ? 1.905 31.610 59.060 1.00 32.17 ? 278 LEU A O 1 +ATOM 2262 C CB . LEU A 1 278 ? 0.590 34.499 59.423 1.00 32.69 ? 278 LEU A CB 1 +ATOM 2263 C CG . LEU A 1 278 ? 0.290 35.966 59.152 1.00 33.92 ? 278 LEU A CG 1 +ATOM 2264 C CD1 . LEU A 1 278 ? -1.194 36.229 59.397 1.00 32.78 ? 278 LEU A CD1 1 +ATOM 2265 C CD2 . LEU A 1 278 ? 1.138 36.831 60.060 1.00 31.89 ? 278 LEU A CD2 1 +ATOM 2266 N N . PHE A 1 279 ? 2.206 32.406 61.152 1.00 29.89 ? 279 PHE A N 1 +ATOM 2267 C CA . PHE A 1 279 ? 2.157 31.082 61.715 1.00 28.02 ? 279 PHE A CA 1 +ATOM 2268 C C . PHE A 1 279 ? 0.676 30.843 61.981 1.00 29.29 ? 279 PHE A C 1 +ATOM 2269 O O . PHE A 1 279 ? 0.097 31.465 62.871 1.00 28.81 ? 279 PHE A O 1 +ATOM 2270 C CB . PHE A 1 279 ? 2.947 30.998 63.024 1.00 26.63 ? 279 PHE A CB 1 +ATOM 2271 C CG . PHE A 1 279 ? 2.613 29.777 63.853 1.00 27.68 ? 279 PHE A CG 1 +ATOM 2272 C CD1 . PHE A 1 279 ? 2.514 28.518 63.256 1.00 27.38 ? 279 PHE A CD1 1 +ATOM 2273 C CD2 . PHE A 1 279 ? 2.375 29.887 65.223 1.00 26.71 ? 279 PHE A CD2 1 +ATOM 2274 C CE1 . PHE A 1 279 ? 2.181 27.392 64.009 1.00 26.76 ? 279 PHE A CE1 1 +ATOM 2275 C CE2 . PHE A 1 279 ? 2.043 28.771 65.983 1.00 26.38 ? 279 PHE A CE2 1 +ATOM 2276 C CZ . PHE A 1 279 ? 1.944 27.520 65.377 1.00 26.97 ? 279 PHE A CZ 1 +ATOM 2277 N N . VAL A 1 280 ? 0.059 29.968 61.188 1.00 29.46 ? 280 VAL A N 1 +ATOM 2278 C CA . VAL A 1 280 ? -1.346 29.647 61.374 1.00 30.39 ? 280 VAL A CA 1 +ATOM 2279 C C . VAL A 1 280 ? -1.439 28.287 62.053 1.00 32.59 ? 280 VAL A C 1 +ATOM 2280 O O . VAL A 1 280 ? -0.895 27.298 61.559 1.00 32.95 ? 280 VAL A O 1 +ATOM 2281 C CB . VAL A 1 280 ? -2.086 29.587 60.038 1.00 31.30 ? 280 VAL A CB 1 +ATOM 2282 C CG1 . VAL A 1 280 ? -3.553 29.240 60.280 1.00 29.68 ? 280 VAL A CG1 1 +ATOM 2283 C CG2 . VAL A 1 280 ? -1.966 30.925 59.325 1.00 29.59 ? 280 VAL A CG2 1 +ATOM 2284 N N . GLY A 1 281 ? -2.121 28.247 63.191 1.00 33.16 ? 281 GLY A N 1 +ATOM 2285 C CA . GLY A 1 281 ? -2.252 27.010 63.930 1.00 33.51 ? 281 GLY A CA 1 +ATOM 2286 C C . GLY A 1 281 ? -3.681 26.674 64.291 1.00 33.84 ? 281 GLY A C 1 +ATOM 2287 O O . GLY A 1 281 ? -4.612 27.092 63.615 1.00 35.71 ? 281 GLY A O 1 +ATOM 2288 N N . LYS A 1 282 ? -3.847 25.914 65.365 1.00 35.40 ? 282 LYS A N 1 +ATOM 2289 C CA . LYS A 1 282 ? -5.161 25.481 65.825 1.00 35.42 ? 282 LYS A CA 1 +ATOM 2290 C C . LYS A 1 282 ? -5.263 25.634 67.333 1.00 35.33 ? 282 LYS A C 1 +ATOM 2291 O O . LYS A 1 282 ? -4.350 25.259 68.070 1.00 35.11 ? 282 LYS A O 1 +ATOM 2292 C CB . LYS A 1 282 ? -5.373 24.013 65.451 1.00 37.10 ? 282 LYS A CB 1 +ATOM 2293 C CG . LYS A 1 282 ? -5.573 23.761 63.963 1.00 41.01 ? 282 LYS A CG 1 +ATOM 2294 C CD . LYS A 1 282 ? -7.020 24.041 63.568 1.00 45.52 ? 282 LYS A CD 1 +ATOM 2295 C CE . LYS A 1 282 ? -7.283 23.746 62.100 1.00 47.19 ? 282 LYS A CE 1 +ATOM 2296 N NZ . LYS A 1 282 ? -6.630 24.751 61.216 1.00 51.29 ? 282 LYS A NZ 1 +ATOM 2297 N N . MET A 1 283 ? -6.384 26.183 67.784 1.00 35.24 ? 283 MET A N 1 +ATOM 2298 C CA . MET A 1 283 ? -6.643 26.387 69.202 1.00 35.70 ? 283 MET A CA 1 +ATOM 2299 C C . MET A 1 283 ? -8.153 26.402 69.368 1.00 36.12 ? 283 MET A C 1 +ATOM 2300 O O . MET A 1 283 ? -8.864 26.132 68.402 1.00 36.54 ? 283 MET A O 1 +ATOM 2301 C CB . MET A 1 283 ? -6.041 27.710 69.669 1.00 36.81 ? 283 MET A CB 1 +ATOM 2302 C CG . MET A 1 283 ? -5.027 27.550 70.802 1.00 39.85 ? 283 MET A CG 1 +ATOM 2303 S SD . MET A 1 283 ? -5.746 26.998 72.386 1.00 41.48 ? 283 MET A SD 1 +ATOM 2304 C CE . MET A 1 283 ? -6.287 28.584 73.066 1.00 38.41 ? 283 MET A CE 1 +ATOM 2305 N N . TRP A 1 284 ? -8.645 26.725 70.564 1.00 34.59 ? 284 TRP A N 1 +ATOM 2306 C CA . TRP A 1 284 ? -10.090 26.727 70.823 1.00 36.59 ? 284 TRP A CA 1 +ATOM 2307 C C . TRP A 1 284 ? -10.973 27.324 69.723 1.00 36.04 ? 284 TRP A C 1 +ATOM 2308 O O . TRP A 1 284 ? -11.956 26.711 69.317 1.00 36.50 ? 284 TRP A O 1 +ATOM 2309 C CB . TRP A 1 284 ? -10.394 27.444 72.138 1.00 39.12 ? 284 TRP A CB 1 +ATOM 2310 C CG . TRP A 1 284 ? -9.706 26.873 73.345 1.00 41.55 ? 284 TRP A CG 1 +ATOM 2311 C CD1 . TRP A 1 284 ? -9.344 27.552 74.469 1.00 41.27 ? 284 TRP A CD1 1 +ATOM 2312 C CD2 . TRP A 1 284 ? -9.316 25.511 73.556 1.00 43.07 ? 284 TRP A CD2 1 +ATOM 2313 N NE1 . TRP A 1 284 ? -8.751 26.702 75.367 1.00 44.18 ? 284 TRP A NE1 1 +ATOM 2314 C CE2 . TRP A 1 284 ? -8.721 25.441 74.834 1.00 44.43 ? 284 TRP A CE2 1 +ATOM 2315 C CE3 . TRP A 1 284 ? -9.411 24.341 72.789 1.00 45.68 ? 284 TRP A CE3 1 +ATOM 2316 C CZ2 . TRP A 1 284 ? -8.221 24.246 75.369 1.00 46.04 ? 284 TRP A CZ2 1 +ATOM 2317 C CZ3 . TRP A 1 284 ? -8.912 23.147 73.319 1.00 46.71 ? 284 TRP A CZ3 1 +ATOM 2318 C CH2 . TRP A 1 284 ? -8.324 23.113 74.599 1.00 47.70 ? 284 TRP A CH2 1 +ATOM 2319 N N . PRO A 1 285 ? -10.644 28.531 69.228 1.00 36.20 ? 285 PRO A N 1 +ATOM 2320 C CA . PRO A 1 285 ? -11.487 29.119 68.173 1.00 37.02 ? 285 PRO A CA 1 +ATOM 2321 C C . PRO A 1 285 ? -11.320 28.525 66.766 1.00 36.67 ? 285 PRO A C 1 +ATOM 2322 O O . PRO A 1 285 ? -11.938 29.000 65.813 1.00 36.77 ? 285 PRO A O 1 +ATOM 2323 C CB . PRO A 1 285 ? -11.118 30.601 68.221 1.00 36.53 ? 285 PRO A CB 1 +ATOM 2324 C CG . PRO A 1 285 ? -9.660 30.559 68.621 1.00 35.63 ? 285 PRO A CG 1 +ATOM 2325 C CD . PRO A 1 285 ? -9.622 29.491 69.690 1.00 34.48 ? 285 PRO A CD 1 +ATOM 2326 N N . GLY A 1 286 ? -10.499 27.483 66.649 1.00 36.18 ? 286 GLY A N 1 +ATOM 2327 C CA . GLY A 1 286 ? -10.261 26.852 65.360 1.00 33.65 ? 286 GLY A CA 1 +ATOM 2328 C C . GLY A 1 286 ? -8.957 27.344 64.766 1.00 32.62 ? 286 GLY A C 1 +ATOM 2329 O O . GLY A 1 286 ? -7.946 27.441 65.463 1.00 33.80 ? 286 GLY A O 1 +ATOM 2330 N N . THR A 1 287 ? -8.964 27.657 63.478 1.00 31.50 ? 287 THR A N 1 +ATOM 2331 C CA . THR A 1 287 ? -7.765 28.164 62.826 1.00 31.19 ? 287 THR A CA 1 +ATOM 2332 C C . THR A 1 287 ? -7.405 29.478 63.526 1.00 31.89 ? 287 THR A C 1 +ATOM 2333 O O . THR A 1 287 ? -8.246 30.368 63.665 1.00 29.82 ? 287 THR A O 1 +ATOM 2334 C CB . THR A 1 287 ? -8.026 28.411 61.341 1.00 31.28 ? 287 THR A CB 1 +ATOM 2335 O OG1 . THR A 1 287 ? -8.471 27.192 60.735 1.00 34.56 ? 287 THR A OG1 1 +ATOM 2336 C CG2 . THR A 1 287 ? -6.765 28.865 60.638 1.00 29.60 ? 287 THR A CG2 1 +ATOM 2337 N N . THR A 1 288 ? -6.157 29.608 63.959 1.00 31.54 ? 288 THR A N 1 +ATOM 2338 C CA . THR A 1 288 ? -5.760 30.797 64.691 1.00 32.18 ? 288 THR A CA 1 +ATOM 2339 C C . THR A 1 288 ? -4.341 31.275 64.427 1.00 31.77 ? 288 THR A C 1 +ATOM 2340 O O . THR A 1 288 ? -3.495 30.522 63.943 1.00 33.10 ? 288 THR A O 1 +ATOM 2341 C CB . THR A 1 288 ? -5.863 30.551 66.222 1.00 33.56 ? 288 THR A CB 1 +ATOM 2342 O OG1 . THR A 1 288 ? -4.901 29.558 66.607 1.00 36.04 ? 288 THR A OG1 1 +ATOM 2343 C CG2 . THR A 1 288 ? -7.238 30.060 66.605 1.00 33.07 ? 288 THR A CG2 1 +ATOM 2344 N N . VAL A 1 289 ? -4.095 32.546 64.742 1.00 29.72 ? 289 VAL A N 1 +ATOM 2345 C CA . VAL A 1 289 ? -2.764 33.126 64.638 1.00 28.93 ? 289 VAL A CA 1 +ATOM 2346 C C . VAL A 1 289 ? -2.444 33.586 66.064 1.00 29.01 ? 289 VAL A C 1 +ATOM 2347 O O . VAL A 1 289 ? -3.338 33.669 66.918 1.00 27.72 ? 289 VAL A O 1 +ATOM 2348 C CB . VAL A 1 289 ? -2.689 34.325 63.652 1.00 28.08 ? 289 VAL A CB 1 +ATOM 2349 C CG1 . VAL A 1 289 ? -2.726 33.819 62.233 1.00 27.38 ? 289 VAL A CG1 1 +ATOM 2350 C CG2 . VAL A 1 289 ? -3.820 35.292 63.902 1.00 27.74 ? 289 VAL A CG2 1 +ATOM 2351 N N . TYR A 1 290 ? -1.183 33.874 66.337 1.00 28.80 ? 290 TYR A N 1 +ATOM 2352 C CA . TYR A 1 290 ? -0.821 34.272 67.686 1.00 30.37 ? 290 TYR A CA 1 +ATOM 2353 C C . TYR A 1 290 ? -0.047 35.571 67.724 1.00 30.54 ? 290 TYR A C 1 +ATOM 2354 O O . TYR A 1 290 ? 0.769 35.846 66.847 1.00 31.74 ? 290 TYR A O 1 +ATOM 2355 C CB . TYR A 1 290 ? 0.005 33.163 68.357 1.00 31.43 ? 290 TYR A CB 1 +ATOM 2356 C CG . TYR A 1 290 ? -0.665 31.803 68.345 1.00 31.85 ? 290 TYR A CG 1 +ATOM 2357 C CD1 . TYR A 1 290 ? -0.519 30.934 67.257 1.00 33.17 ? 290 TYR A CD1 1 +ATOM 2358 C CD2 . TYR A 1 290 ? -1.470 31.397 69.405 1.00 32.53 ? 290 TYR A CD2 1 +ATOM 2359 C CE1 . TYR A 1 290 ? -1.164 29.690 67.231 1.00 33.00 ? 290 TYR A CE1 1 +ATOM 2360 C CE2 . TYR A 1 290 ? -2.123 30.157 69.390 1.00 33.18 ? 290 TYR A CE2 1 +ATOM 2361 C CZ . TYR A 1 290 ? -1.964 29.314 68.305 1.00 33.87 ? 290 TYR A CZ 1 +ATOM 2362 O OH . TYR A 1 290 ? -2.607 28.101 68.314 1.00 34.60 ? 290 TYR A OH 1 +ATOM 2363 N N . PRO A 1 291 ? -0.295 36.394 68.750 1.00 31.01 ? 291 PRO A N 1 +ATOM 2364 C CA . PRO A 1 291 ? 0.396 37.674 68.887 1.00 31.43 ? 291 PRO A CA 1 +ATOM 2365 C C . PRO A 1 291 ? 1.858 37.440 69.209 1.00 32.58 ? 291 PRO A C 1 +ATOM 2366 O O . PRO A 1 291 ? 2.174 36.589 70.040 1.00 33.69 ? 291 PRO A O 1 +ATOM 2367 C CB . PRO A 1 291 ? -0.325 38.338 70.065 1.00 31.45 ? 291 PRO A CB 1 +ATOM 2368 C CG . PRO A 1 291 ? -1.655 37.676 70.112 1.00 31.16 ? 291 PRO A CG 1 +ATOM 2369 C CD . PRO A 1 291 ? -1.312 36.239 69.805 1.00 32.65 ? 291 PRO A CD 1 +ATOM 2370 N N . ASP A 1 292 ? 2.752 38.172 68.547 1.00 34.81 ? 292 ASP A N 1 +ATOM 2371 C CA . ASP A 1 292 ? 4.181 38.049 68.845 1.00 36.33 ? 292 ASP A CA 1 +ATOM 2372 C C . ASP A 1 292 ? 4.477 39.012 70.009 1.00 35.41 ? 292 ASP A C 1 +ATOM 2373 O O . ASP A 1 292 ? 4.953 40.126 69.795 1.00 35.96 ? 292 ASP A O 1 +ATOM 2374 C CB . ASP A 1 292 ? 5.030 38.431 67.633 1.00 37.91 ? 292 ASP A CB 1 +ATOM 2375 C CG . ASP A 1 292 ? 6.532 38.283 67.904 1.00 42.91 ? 292 ASP A CG 1 +ATOM 2376 O OD1 . ASP A 1 292 ? 6.903 37.858 69.032 1.00 44.12 ? 292 ASP A OD1 1 +ATOM 2377 O OD2 . ASP A 1 292 ? 7.341 38.585 66.992 1.00 41.44 ? 292 ASP A OD2 1 +ATOM 2378 N N . PHE A 1 293 ? 4.179 38.575 71.230 1.00 34.29 ? 293 PHE A N 1 +ATOM 2379 C CA . PHE A 1 293 ? 4.371 39.392 72.423 1.00 35.32 ? 293 PHE A CA 1 +ATOM 2380 C C . PHE A 1 293 ? 5.795 39.885 72.687 1.00 35.54 ? 293 PHE A C 1 +ATOM 2381 O O . PHE A 1 293 ? 6.009 40.711 73.570 1.00 36.34 ? 293 PHE A O 1 +ATOM 2382 C CB . PHE A 1 293 ? 3.851 38.639 73.650 1.00 33.96 ? 293 PHE A CB 1 +ATOM 2383 C CG . PHE A 1 293 ? 2.362 38.457 73.658 1.00 34.44 ? 293 PHE A CG 1 +ATOM 2384 C CD1 . PHE A 1 293 ? 1.516 39.554 73.730 1.00 33.93 ? 293 PHE A CD1 1 +ATOM 2385 C CD2 . PHE A 1 293 ? 1.805 37.186 73.597 1.00 35.38 ? 293 PHE A CD2 1 +ATOM 2386 C CE1 . PHE A 1 293 ? 0.127 39.389 73.743 1.00 35.88 ? 293 PHE A CE1 1 +ATOM 2387 C CE2 . PHE A 1 293 ? 0.418 37.004 73.608 1.00 35.65 ? 293 PHE A CE2 1 +ATOM 2388 C CZ . PHE A 1 293 ? -0.424 38.109 73.683 1.00 35.81 ? 293 PHE A CZ 1 +ATOM 2389 N N . PHE A 1 294 ? 6.766 39.378 71.939 1.00 36.37 ? 294 PHE A N 1 +ATOM 2390 C CA . PHE A 1 294 ? 8.145 39.810 72.120 1.00 38.72 ? 294 PHE A CA 1 +ATOM 2391 C C . PHE A 1 294 ? 8.341 41.224 71.560 1.00 40.83 ? 294 PHE A C 1 +ATOM 2392 O O . PHE A 1 294 ? 9.311 41.911 71.895 1.00 40.90 ? 294 PHE A O 1 +ATOM 2393 C CB . PHE A 1 294 ? 9.098 38.836 71.430 1.00 37.35 ? 294 PHE A CB 1 +ATOM 2394 C CG . PHE A 1 294 ? 9.176 37.499 72.098 1.00 38.91 ? 294 PHE A CG 1 +ATOM 2395 C CD1 . PHE A 1 294 ? 9.889 37.340 73.284 1.00 38.07 ? 294 PHE A CD1 1 +ATOM 2396 C CD2 . PHE A 1 294 ? 8.515 36.398 71.562 1.00 38.17 ? 294 PHE A CD2 1 +ATOM 2397 C CE1 . PHE A 1 294 ? 9.944 36.106 73.924 1.00 37.80 ? 294 PHE A CE1 1 +ATOM 2398 C CE2 . PHE A 1 294 ? 8.567 35.160 72.199 1.00 38.11 ? 294 PHE A CE2 1 +ATOM 2399 C CZ . PHE A 1 294 ? 9.284 35.015 73.383 1.00 37.39 ? 294 PHE A CZ 1 +ATOM 2400 N N . ARG A 1 295 ? 7.407 41.656 70.718 1.00 41.12 ? 295 ARG A N 1 +ATOM 2401 C CA . ARG A 1 295 ? 7.472 42.978 70.114 1.00 41.69 ? 295 ARG A CA 1 +ATOM 2402 C C . ARG A 1 295 ? 6.747 44.016 70.963 1.00 42.69 ? 295 ARG A C 1 +ATOM 2403 O O . ARG A 1 295 ? 5.695 43.739 71.536 1.00 43.14 ? 295 ARG A O 1 +ATOM 2404 C CB . ARG A 1 295 ? 6.856 42.934 68.720 1.00 42.56 ? 295 ARG A CB 1 +ATOM 2405 C CG . ARG A 1 295 ? 7.576 41.995 67.779 1.00 44.16 ? 295 ARG A CG 1 +ATOM 2406 C CD . ARG A 1 295 ? 6.760 41.738 66.544 1.00 44.37 ? 295 ARG A CD 1 +ATOM 2407 N NE . ARG A 1 295 ? 6.375 42.974 65.881 1.00 47.49 ? 295 ARG A NE 1 +ATOM 2408 C CZ . ARG A 1 295 ? 5.745 43.021 64.711 1.00 49.84 ? 295 ARG A CZ 1 +ATOM 2409 N NH1 . ARG A 1 295 ? 5.434 41.894 64.077 1.00 49.67 ? 295 ARG A NH1 1 +ATOM 2410 N NH2 . ARG A 1 295 ? 5.424 44.194 64.174 1.00 49.37 ? 295 ARG A NH2 1 +ATOM 2411 N N . GLU A 1 296 ? 7.301 45.222 71.027 1.00 43.64 ? 296 GLU A N 1 +ATOM 2412 C CA . GLU A 1 296 ? 6.711 46.290 71.817 1.00 43.40 ? 296 GLU A CA 1 +ATOM 2413 C C . GLU A 1 296 ? 5.351 46.742 71.258 1.00 42.23 ? 296 GLU A C 1 +ATOM 2414 O O . GLU A 1 296 ? 4.406 46.999 72.009 1.00 39.15 ? 296 GLU A O 1 +ATOM 2415 C CB . GLU A 1 296 ? 7.692 47.460 71.872 1.00 47.33 ? 296 GLU A CB 1 +ATOM 2416 C CG . GLU A 1 296 ? 7.310 48.573 72.842 1.00 54.88 ? 296 GLU A CG 1 +ATOM 2417 C CD . GLU A 1 296 ? 8.403 49.640 72.987 1.00 58.63 ? 296 GLU A CD 1 +ATOM 2418 O OE1 . GLU A 1 296 ? 9.551 49.277 73.349 1.00 60.09 ? 296 GLU A OE1 1 +ATOM 2419 O OE2 . GLU A 1 296 ? 8.109 50.838 72.746 1.00 59.94 ? 296 GLU A OE2 1 +ATOM 2420 N N . ASP A 1 297 ? 5.253 46.830 69.936 1.00 42.13 ? 297 ASP A N 1 +ATOM 2421 C CA . ASP A 1 297 ? 4.013 47.247 69.292 1.00 42.92 ? 297 ASP A CA 1 +ATOM 2422 C C . ASP A 1 297 ? 2.855 46.284 69.571 1.00 42.29 ? 297 ASP A C 1 +ATOM 2423 O O . ASP A 1 297 ? 1.712 46.714 69.755 1.00 40.43 ? 297 ASP A O 1 +ATOM 2424 C CB . ASP A 1 297 ? 4.218 47.376 67.784 1.00 44.84 ? 297 ASP A CB 1 +ATOM 2425 C CG . ASP A 1 297 ? 4.934 46.180 67.193 1.00 49.58 ? 297 ASP A CG 1 +ATOM 2426 O OD1 . ASP A 1 297 ? 4.830 45.078 67.777 1.00 50.97 ? 297 ASP A OD1 1 +ATOM 2427 O OD2 . ASP A 1 297 ? 5.595 46.335 66.138 1.00 52.06 ? 297 ASP A OD2 1 +ATOM 2428 N N . THR A 1 298 ? 3.156 44.986 69.591 1.00 40.18 ? 298 THR A N 1 +ATOM 2429 C CA . THR A 1 298 ? 2.152 43.961 69.855 1.00 37.85 ? 298 THR A CA 1 +ATOM 2430 C C . THR A 1 298 ? 1.708 44.142 71.296 1.00 37.83 ? 298 THR A C 1 +ATOM 2431 O O . THR A 1 298 ? 0.515 44.070 71.623 1.00 36.51 ? 298 THR A O 1 +ATOM 2432 C CB . THR A 1 298 ? 2.745 42.541 69.693 1.00 37.69 ? 298 THR A CB 1 +ATOM 2433 O OG1 . THR A 1 298 ? 3.364 42.422 68.406 1.00 36.20 ? 298 THR A OG1 1 +ATOM 2434 C CG2 . THR A 1 298 ? 1.648 41.482 69.818 1.00 36.94 ? 298 THR A CG2 1 +ATOM 2435 N N . ARG A 1 299 ? 2.687 44.375 72.163 1.00 37.50 ? 299 ARG A N 1 +ATOM 2436 C CA . ARG A 1 299 ? 2.405 44.584 73.572 1.00 37.47 ? 299 ARG A CA 1 +ATOM 2437 C C . ARG A 1 299 ? 1.457 45.773 73.736 1.00 37.30 ? 299 ARG A C 1 +ATOM 2438 O O . ARG A 1 299 ? 0.486 45.695 74.489 1.00 38.36 ? 299 ARG A O 1 +ATOM 2439 C CB . ARG A 1 299 ? 3.710 44.812 74.335 1.00 37.97 ? 299 ARG A CB 1 +ATOM 2440 C CG . ARG A 1 299 ? 4.009 43.742 75.368 1.00 38.31 ? 299 ARG A CG 1 +ATOM 2441 C CD . ARG A 1 299 ? 5.393 43.150 75.179 1.00 38.88 ? 299 ARG A CD 1 +ATOM 2442 N NE . ARG A 1 299 ? 6.454 44.110 75.450 1.00 37.95 ? 299 ARG A NE 1 +ATOM 2443 C CZ . ARG A 1 299 ? 7.693 43.989 74.985 1.00 39.94 ? 299 ARG A CZ 1 +ATOM 2444 N NH1 . ARG A 1 299 ? 8.016 42.943 74.227 1.00 40.14 ? 299 ARG A NH1 1 +ATOM 2445 N NH2 . ARG A 1 299 ? 8.607 44.913 75.263 1.00 36.93 ? 299 ARG A NH2 1 +ATOM 2446 N N . GLU A 1 300 ? 1.721 46.864 73.020 1.00 37.72 ? 300 GLU A N 1 +ATOM 2447 C CA . GLU A 1 300 ? 0.858 48.046 73.104 1.00 39.27 ? 300 GLU A CA 1 +ATOM 2448 C C . GLU A 1 300 ? -0.547 47.748 72.561 1.00 37.06 ? 300 GLU A C 1 +ATOM 2449 O O . GLU A 1 300 ? -1.549 48.175 73.140 1.00 36.98 ? 300 GLU A O 1 +ATOM 2450 C CB . GLU A 1 300 ? 1.485 49.229 72.347 1.00 43.24 ? 300 GLU A CB 1 +ATOM 2451 C CG . GLU A 1 300 ? 0.702 50.539 72.494 1.00 52.63 ? 300 GLU A CG 1 +ATOM 2452 C CD . GLU A 1 300 ? 1.352 51.722 71.770 1.00 58.73 ? 300 GLU A CD 1 +ATOM 2453 O OE1 . GLU A 1 300 ? 2.531 52.032 72.070 1.00 61.81 ? 300 GLU A OE1 1 +ATOM 2454 O OE2 . GLU A 1 300 ? 0.684 52.345 70.905 1.00 60.17 ? 300 GLU A OE2 1 +ATOM 2455 N N . TRP A 1 301 ? -0.615 47.005 71.458 1.00 35.96 ? 301 TRP A N 1 +ATOM 2456 C CA . TRP A 1 301 ? -1.887 46.610 70.844 1.00 34.84 ? 301 TRP A CA 1 +ATOM 2457 C C . TRP A 1 301 ? -2.700 45.748 71.821 1.00 34.49 ? 301 TRP A C 1 +ATOM 2458 O O . TRP A 1 301 ? -3.892 45.972 72.039 1.00 35.14 ? 301 TRP A O 1 +ATOM 2459 C CB . TRP A 1 301 ? -1.606 45.827 69.553 1.00 34.64 ? 301 TRP A CB 1 +ATOM 2460 C CG . TRP A 1 301 ? -2.797 45.096 68.993 1.00 36.78 ? 301 TRP A CG 1 +ATOM 2461 C CD1 . TRP A 1 301 ? -3.849 45.634 68.302 1.00 34.79 ? 301 TRP A CD1 1 +ATOM 2462 C CD2 . TRP A 1 301 ? -3.051 43.686 69.079 1.00 35.67 ? 301 TRP A CD2 1 +ATOM 2463 N NE1 . TRP A 1 301 ? -4.734 44.644 67.952 1.00 37.55 ? 301 TRP A NE1 1 +ATOM 2464 C CE2 . TRP A 1 301 ? -4.268 43.439 68.415 1.00 35.87 ? 301 TRP A CE2 1 +ATOM 2465 C CE3 . TRP A 1 301 ? -2.364 42.610 69.651 1.00 35.32 ? 301 TRP A CE3 1 +ATOM 2466 C CZ2 . TRP A 1 301 ? -4.815 42.155 68.305 1.00 36.22 ? 301 TRP A CZ2 1 +ATOM 2467 C CZ3 . TRP A 1 301 ? -2.910 41.334 69.542 1.00 37.36 ? 301 TRP A CZ3 1 +ATOM 2468 C CH2 . TRP A 1 301 ? -4.123 41.120 68.873 1.00 35.14 ? 301 TRP A CH2 1 +ATOM 2469 N N . TRP A 1 302 ? -2.041 44.762 72.415 1.00 34.62 ? 302 TRP A N 1 +ATOM 2470 C CA . TRP A 1 302 ? -2.698 43.869 73.367 1.00 35.36 ? 302 TRP A CA 1 +ATOM 2471 C C . TRP A 1 302 ? -3.178 44.639 74.594 1.00 35.44 ? 302 TRP A C 1 +ATOM 2472 O O . TRP A 1 302 ? -4.315 44.453 75.054 1.00 35.60 ? 302 TRP A O 1 +ATOM 2473 C CB . TRP A 1 302 ? -1.728 42.755 73.783 1.00 36.14 ? 302 TRP A CB 1 +ATOM 2474 C CG . TRP A 1 302 ? -2.306 41.759 74.741 1.00 35.71 ? 302 TRP A CG 1 +ATOM 2475 C CD1 . TRP A 1 302 ? -2.139 41.727 76.096 1.00 33.64 ? 302 TRP A CD1 1 +ATOM 2476 C CD2 . TRP A 1 302 ? -3.130 40.633 74.409 1.00 35.64 ? 302 TRP A CD2 1 +ATOM 2477 N NE1 . TRP A 1 302 ? -2.802 40.648 76.629 1.00 33.91 ? 302 TRP A NE1 1 +ATOM 2478 C CE2 . TRP A 1 302 ? -3.417 39.956 75.616 1.00 36.20 ? 302 TRP A CE2 1 +ATOM 2479 C CE3 . TRP A 1 302 ? -3.650 40.129 73.207 1.00 35.52 ? 302 TRP A CE3 1 +ATOM 2480 C CZ2 . TRP A 1 302 ? -4.204 38.791 75.658 1.00 37.00 ? 302 TRP A CZ2 1 +ATOM 2481 C CZ3 . TRP A 1 302 ? -4.436 38.970 73.245 1.00 37.26 ? 302 TRP A CZ3 1 +ATOM 2482 C CH2 . TRP A 1 302 ? -4.702 38.314 74.466 1.00 38.22 ? 302 TRP A CH2 1 +ATOM 2483 N N . ALA A 1 303 ? -2.311 45.504 75.124 1.00 34.62 ? 303 ALA A N 1 +ATOM 2484 C CA . ALA A 1 303 ? -2.675 46.316 76.290 1.00 33.81 ? 303 ALA A CA 1 +ATOM 2485 C C . ALA A 1 303 ? -3.959 47.095 75.991 1.00 33.44 ? 303 ALA A C 1 +ATOM 2486 O O . ALA A 1 303 ? -4.817 47.249 76.859 1.00 33.93 ? 303 ALA A O 1 +ATOM 2487 C CB . ALA A 1 303 ? -1.552 47.277 76.634 1.00 32.01 ? 303 ALA A CB 1 +ATOM 2488 N N . GLY A 1 304 ? -4.089 47.569 74.752 1.00 32.80 ? 304 GLY A N 1 +ATOM 2489 C CA . GLY A 1 304 ? -5.269 48.312 74.366 1.00 31.15 ? 304 GLY A CA 1 +ATOM 2490 C C . GLY A 1 304 ? -6.525 47.475 74.443 1.00 32.91 ? 304 GLY A C 1 +ATOM 2491 O O . GLY A 1 304 ? -7.530 47.930 74.987 1.00 33.15 ? 304 GLY A O 1 +ATOM 2492 N N . LEU A 1 305 ? -6.477 46.252 73.910 1.00 33.44 ? 305 LEU A N 1 +ATOM 2493 C CA . LEU A 1 305 ? -7.645 45.366 73.935 1.00 32.39 ? 305 LEU A CA 1 +ATOM 2494 C C . LEU A 1 305 ? -7.990 45.001 75.367 1.00 32.33 ? 305 LEU A C 1 +ATOM 2495 O O . LEU A 1 305 ? -9.161 44.953 75.744 1.00 31.60 ? 305 LEU A O 1 +ATOM 2496 C CB . LEU A 1 305 ? -7.369 44.089 73.140 1.00 33.27 ? 305 LEU A CB 1 +ATOM 2497 C CG . LEU A 1 305 ? -7.103 44.251 71.641 1.00 33.96 ? 305 LEU A CG 1 +ATOM 2498 C CD1 . LEU A 1 305 ? -6.695 42.913 71.051 1.00 35.50 ? 305 LEU A CD1 1 +ATOM 2499 C CD2 . LEU A 1 305 ? -8.349 44.781 70.956 1.00 31.57 ? 305 LEU A CD2 1 +ATOM 2500 N N . ILE A 1 306 ? -6.964 44.737 76.167 1.00 33.05 ? 306 ILE A N 1 +ATOM 2501 C CA . ILE A 1 306 ? -7.182 44.383 77.567 1.00 35.00 ? 306 ILE A CA 1 +ATOM 2502 C C . ILE A 1 306 ? -7.853 45.538 78.288 1.00 35.82 ? 306 ILE A C 1 +ATOM 2503 O O . ILE A 1 306 ? -8.868 45.357 78.966 1.00 36.11 ? 306 ILE A O 1 +ATOM 2504 C CB . ILE A 1 306 ? -5.850 44.065 78.289 1.00 33.78 ? 306 ILE A CB 1 +ATOM 2505 C CG1 . ILE A 1 306 ? -5.302 42.715 77.810 1.00 33.16 ? 306 ILE A CG1 1 +ATOM 2506 C CG2 . ILE A 1 306 ? -6.063 44.065 79.801 1.00 33.00 ? 306 ILE A CG2 1 +ATOM 2507 C CD1 . ILE A 1 306 ? -6.213 41.532 78.131 1.00 31.09 ? 306 ILE A CD1 1 +ATOM 2508 N N . SER A 1 307 ? -7.277 46.726 78.130 1.00 36.30 ? 307 SER A N 1 +ATOM 2509 C CA . SER A 1 307 ? -7.800 47.934 78.764 1.00 38.31 ? 307 SER A CA 1 +ATOM 2510 C C . SER A 1 307 ? -9.276 48.126 78.406 1.00 37.84 ? 307 SER A C 1 +ATOM 2511 O O . SER A 1 307 ? -10.123 48.365 79.270 1.00 36.24 ? 307 SER A O 1 +ATOM 2512 C CB . SER A 1 307 ? -6.987 49.142 78.306 1.00 38.92 ? 307 SER A CB 1 +ATOM 2513 O OG . SER A 1 307 ? -7.315 50.280 79.071 1.00 42.14 ? 307 SER A OG 1 +ATOM 2514 N N . GLU A 1 308 ? -9.574 48.005 77.118 1.00 38.69 ? 308 GLU A N 1 +ATOM 2515 C CA . GLU A 1 308 ? -10.937 48.148 76.629 1.00 40.42 ? 308 GLU A CA 1 +ATOM 2516 C C . GLU A 1 308 ? -11.835 47.093 77.280 1.00 39.27 ? 308 GLU A C 1 +ATOM 2517 O O . GLU A 1 308 ? -12.984 47.370 77.640 1.00 39.51 ? 308 GLU A O 1 +ATOM 2518 C CB . GLU A 1 308 ? -10.939 47.986 75.113 1.00 43.55 ? 308 GLU A CB 1 +ATOM 2519 C CG . GLU A 1 308 ? -12.245 48.324 74.430 1.00 51.61 ? 308 GLU A CG 1 +ATOM 2520 C CD . GLU A 1 308 ? -12.232 47.903 72.965 1.00 57.77 ? 308 GLU A CD 1 +ATOM 2521 O OE1 . GLU A 1 308 ? -11.251 48.252 72.258 1.00 60.36 ? 308 GLU A OE1 1 +ATOM 2522 O OE2 . GLU A 1 308 ? -13.193 47.221 72.524 1.00 60.24 ? 308 GLU A OE2 1 +ATOM 2523 N N . TRP A 1 309 ? -11.293 45.886 77.451 1.00 37.34 ? 309 TRP A N 1 +ATOM 2524 C CA . TRP A 1 309 ? -12.037 44.783 78.048 1.00 34.90 ? 309 TRP A CA 1 +ATOM 2525 C C . TRP A 1 309 ? -12.307 45.025 79.529 1.00 34.71 ? 309 TRP A C 1 +ATOM 2526 O O . TRP A 1 309 ? -13.394 44.723 80.036 1.00 33.18 ? 309 TRP A O 1 +ATOM 2527 C CB . TRP A 1 309 ? -11.259 43.480 77.848 1.00 34.68 ? 309 TRP A CB 1 +ATOM 2528 C CG . TRP A 1 309 ? -11.991 42.255 78.310 1.00 33.64 ? 309 TRP A CG 1 +ATOM 2529 C CD1 . TRP A 1 309 ? -11.702 41.498 79.404 1.00 32.31 ? 309 TRP A CD1 1 +ATOM 2530 C CD2 . TRP A 1 309 ? -13.159 41.667 77.707 1.00 31.81 ? 309 TRP A CD2 1 +ATOM 2531 N NE1 . TRP A 1 309 ? -12.618 40.477 79.523 1.00 33.21 ? 309 TRP A NE1 1 +ATOM 2532 C CE2 . TRP A 1 309 ? -13.522 40.560 78.496 1.00 31.12 ? 309 TRP A CE2 1 +ATOM 2533 C CE3 . TRP A 1 309 ? -13.932 41.975 76.578 1.00 32.84 ? 309 TRP A CE3 1 +ATOM 2534 C CZ2 . TRP A 1 309 ? -14.626 39.753 78.195 1.00 31.98 ? 309 TRP A CZ2 1 +ATOM 2535 C CZ3 . TRP A 1 309 ? -15.033 41.170 76.277 1.00 30.95 ? 309 TRP A CZ3 1 +ATOM 2536 C CH2 . TRP A 1 309 ? -15.367 40.076 77.084 1.00 31.92 ? 309 TRP A CH2 1 +ATOM 2537 N N . LEU A 1 310 ? -11.315 45.580 80.216 1.00 34.53 ? 310 LEU A N 1 +ATOM 2538 C CA . LEU A 1 310 ? -11.436 45.884 81.638 1.00 34.50 ? 310 LEU A CA 1 +ATOM 2539 C C . LEU A 1 310 ? -12.446 47.002 81.904 1.00 35.57 ? 310 LEU A C 1 +ATOM 2540 O O . LEU A 1 310 ? -13.090 47.034 82.957 1.00 34.93 ? 310 LEU A O 1 +ATOM 2541 C CB . LEU A 1 310 ? -10.075 46.303 82.200 1.00 32.78 ? 310 LEU A CB 1 +ATOM 2542 C CG . LEU A 1 310 ? -9.028 45.212 82.392 1.00 33.00 ? 310 LEU A CG 1 +ATOM 2543 C CD1 . LEU A 1 310 ? -7.718 45.819 82.886 1.00 33.67 ? 310 LEU A CD1 1 +ATOM 2544 C CD2 . LEU A 1 310 ? -9.556 44.200 83.411 1.00 32.77 ? 310 LEU A CD2 1 +ATOM 2545 N N . SER A 1 311 ? -12.588 47.908 80.942 1.00 36.27 ? 311 SER A N 1 +ATOM 2546 C CA . SER A 1 311 ? -13.484 49.046 81.106 1.00 39.28 ? 311 SER A CA 1 +ATOM 2547 C C . SER A 1 311 ? -14.960 48.700 81.270 1.00 39.63 ? 311 SER A C 1 +ATOM 2548 O O . SER A 1 311 ? -15.741 49.556 81.686 1.00 40.94 ? 311 SER A O 1 +ATOM 2549 C CB . SER A 1 311 ? -13.312 50.029 79.941 1.00 39.66 ? 311 SER A CB 1 +ATOM 2550 O OG . SER A 1 311 ? -13.997 49.567 78.790 1.00 44.36 ? 311 SER A OG 1 +ATOM 2551 N N . GLN A 1 312 ? -15.361 47.472 80.945 1.00 39.61 ? 312 GLN A N 1 +ATOM 2552 C CA . GLN A 1 312 ? -16.771 47.108 81.112 1.00 39.97 ? 312 GLN A CA 1 +ATOM 2553 C C . GLN A 1 312 ? -17.028 46.838 82.579 1.00 39.02 ? 312 GLN A C 1 +ATOM 2554 O O . GLN A 1 312 ? -18.182 46.733 83.004 1.00 37.39 ? 312 GLN A O 1 +ATOM 2555 C CB . GLN A 1 312 ? -17.144 45.825 80.378 1.00 41.48 ? 312 GLN A CB 1 +ATOM 2556 C CG . GLN A 1 312 ? -16.270 45.423 79.230 1.00 45.28 ? 312 GLN A CG 1 +ATOM 2557 C CD . GLN A 1 312 ? -16.541 43.987 78.814 1.00 46.20 ? 312 GLN A CD 1 +ATOM 2558 O OE1 . GLN A 1 312 ? -17.655 43.643 78.418 1.00 46.18 ? 312 GLN A OE1 1 +ATOM 2559 N NE2 . GLN A 1 312 ? -15.522 43.137 78.918 1.00 47.28 ? 312 GLN A NE2 1 +ATOM 2560 N N . GLY A 1 313 ? -15.946 46.686 83.338 1.00 37.75 ? 313 GLY A N 1 +ATOM 2561 C CA . GLY A 1 313 ? -16.079 46.398 84.752 1.00 37.99 ? 313 GLY A CA 1 +ATOM 2562 C C . GLY A 1 313 ? -15.466 45.060 85.144 1.00 39.04 ? 313 GLY A C 1 +ATOM 2563 O O . GLY A 1 313 ? -15.603 44.615 86.284 1.00 41.60 ? 313 GLY A O 1 +ATOM 2564 N N . VAL A 1 314 ? -14.799 44.399 84.205 1.00 37.88 ? 314 VAL A N 1 +ATOM 2565 C CA . VAL A 1 314 ? -14.153 43.124 84.497 1.00 35.66 ? 314 VAL A CA 1 +ATOM 2566 C C . VAL A 1 314 ? -13.025 43.451 85.473 1.00 34.98 ? 314 VAL A C 1 +ATOM 2567 O O . VAL A 1 314 ? -12.259 44.380 85.247 1.00 33.01 ? 314 VAL A O 1 +ATOM 2568 C CB . VAL A 1 314 ? -13.579 42.486 83.207 1.00 36.32 ? 314 VAL A CB 1 +ATOM 2569 C CG1 . VAL A 1 314 ? -12.657 41.332 83.549 1.00 34.85 ? 314 VAL A CG1 1 +ATOM 2570 C CG2 . VAL A 1 314 ? -14.722 42.008 82.318 1.00 33.81 ? 314 VAL A CG2 1 +ATOM 2571 N N . ASP A 1 315 ? -12.918 42.670 86.543 1.00 34.58 ? 315 ASP A N 1 +ATOM 2572 C CA . ASP A 1 315 ? -11.929 42.908 87.590 1.00 33.90 ? 315 ASP A CA 1 +ATOM 2573 C C . ASP A 1 315 ? -10.580 42.214 87.467 1.00 34.24 ? 315 ASP A C 1 +ATOM 2574 O O . ASP A 1 315 ? -9.599 42.666 88.056 1.00 34.66 ? 315 ASP A O 1 +ATOM 2575 C CB . ASP A 1 315 ? -12.556 42.555 88.938 1.00 34.46 ? 315 ASP A CB 1 +ATOM 2576 C CG . ASP A 1 315 ? -13.862 43.307 89.185 1.00 36.92 ? 315 ASP A CG 1 +ATOM 2577 O OD1 . ASP A 1 315 ? -13.797 44.535 89.421 1.00 39.64 ? 315 ASP A OD1 1 +ATOM 2578 O OD2 . ASP A 1 315 ? -14.950 42.684 89.128 1.00 34.99 ? 315 ASP A OD2 1 +ATOM 2579 N N . GLY A 1 316 ? -10.516 41.124 86.711 1.00 34.03 ? 316 GLY A N 1 +ATOM 2580 C CA . GLY A 1 316 ? -9.252 40.417 86.585 1.00 32.98 ? 316 GLY A CA 1 +ATOM 2581 C C . GLY A 1 316 ? -9.108 39.633 85.297 1.00 33.70 ? 316 GLY A C 1 +ATOM 2582 O O . GLY A 1 316 ? -10.095 39.305 84.629 1.00 34.57 ? 316 GLY A O 1 +ATOM 2583 N N . ILE A 1 317 ? -7.865 39.338 84.942 1.00 32.40 ? 317 ILE A N 1 +ATOM 2584 C CA . ILE A 1 317 ? -7.579 38.585 83.734 1.00 31.87 ? 317 ILE A CA 1 +ATOM 2585 C C . ILE A 1 317 ? -6.924 37.245 84.073 1.00 32.78 ? 317 ILE A C 1 +ATOM 2586 O O . ILE A 1 317 ? -5.989 37.171 84.876 1.00 32.05 ? 317 ILE A O 1 +ATOM 2587 C CB . ILE A 1 317 ? -6.644 39.373 82.802 1.00 31.40 ? 317 ILE A CB 1 +ATOM 2588 C CG1 . ILE A 1 317 ? -7.277 40.722 82.452 1.00 31.91 ? 317 ILE A CG1 1 +ATOM 2589 C CG2 . ILE A 1 317 ? -6.384 38.576 81.530 1.00 29.26 ? 317 ILE A CG2 1 +ATOM 2590 C CD1 . ILE A 1 317 ? -8.574 40.616 81.667 1.00 32.97 ? 317 ILE A CD1 1 +ATOM 2591 N N . TRP A 1 318 ? -7.438 36.184 83.460 1.00 34.03 ? 318 TRP A N 1 +ATOM 2592 C CA . TRP A 1 318 ? -6.926 34.836 83.658 1.00 32.66 ? 318 TRP A CA 1 +ATOM 2593 C C . TRP A 1 318 ? -6.347 34.385 82.327 1.00 32.14 ? 318 TRP A C 1 +ATOM 2594 O O . TRP A 1 318 ? -7.082 34.089 81.401 1.00 32.12 ? 318 TRP A O 1 +ATOM 2595 C CB . TRP A 1 318 ? -8.076 33.940 84.110 1.00 32.53 ? 318 TRP A CB 1 +ATOM 2596 C CG . TRP A 1 318 ? -7.817 32.465 84.107 1.00 34.01 ? 318 TRP A CG 1 +ATOM 2597 C CD1 . TRP A 1 318 ? -6.609 31.834 84.103 1.00 34.09 ? 318 TRP A CD1 1 +ATOM 2598 C CD2 . TRP A 1 318 ? -8.809 31.434 84.167 1.00 33.76 ? 318 TRP A CD2 1 +ATOM 2599 N NE1 . TRP A 1 318 ? -6.786 30.471 84.159 1.00 33.11 ? 318 TRP A NE1 1 +ATOM 2600 C CE2 . TRP A 1 318 ? -8.126 30.199 84.201 1.00 33.34 ? 318 TRP A CE2 1 +ATOM 2601 C CE3 . TRP A 1 318 ? -10.212 31.437 84.201 1.00 35.26 ? 318 TRP A CE3 1 +ATOM 2602 C CZ2 . TRP A 1 318 ? -8.794 28.975 84.268 1.00 34.15 ? 318 TRP A CZ2 1 +ATOM 2603 C CZ3 . TRP A 1 318 ? -10.883 30.215 84.270 1.00 34.98 ? 318 TRP A CZ3 1 +ATOM 2604 C CH2 . TRP A 1 318 ? -10.167 29.000 84.303 1.00 36.11 ? 318 TRP A CH2 1 +ATOM 2605 N N . LEU A 1 319 ? -5.020 34.373 82.240 1.00 32.46 ? 319 LEU A N 1 +ATOM 2606 C CA . LEU A 1 319 ? -4.307 33.974 81.031 1.00 32.97 ? 319 LEU A CA 1 +ATOM 2607 C C . LEU A 1 319 ? -4.092 32.458 81.003 1.00 33.93 ? 319 LEU A C 1 +ATOM 2608 O O . LEU A 1 319 ? -3.420 31.904 81.870 1.00 35.15 ? 319 LEU A O 1 +ATOM 2609 C CB . LEU A 1 319 ? -2.954 34.684 80.971 1.00 31.26 ? 319 LEU A CB 1 +ATOM 2610 C CG . LEU A 1 319 ? -2.969 36.219 80.950 1.00 33.27 ? 319 LEU A CG 1 +ATOM 2611 C CD1 . LEU A 1 319 ? -1.532 36.760 80.965 1.00 31.77 ? 319 LEU A CD1 1 +ATOM 2612 C CD2 . LEU A 1 319 ? -3.705 36.712 79.707 1.00 31.96 ? 319 LEU A CD2 1 +ATOM 2613 N N . ASP A 1 320 ? -4.648 31.793 79.996 1.00 34.98 ? 320 ASP A N 1 +ATOM 2614 C CA . ASP A 1 320 ? -4.526 30.344 79.886 1.00 35.58 ? 320 ASP A CA 1 +ATOM 2615 C C . ASP A 1 320 ? -3.913 29.889 78.560 1.00 35.09 ? 320 ASP A C 1 +ATOM 2616 O O . ASP A 1 320 ? -3.875 30.649 77.595 1.00 35.53 ? 320 ASP A O 1 +ATOM 2617 C CB . ASP A 1 320 ? -5.910 29.719 80.073 1.00 36.90 ? 320 ASP A CB 1 +ATOM 2618 C CG . ASP A 1 320 ? -5.852 28.221 80.276 1.00 41.94 ? 320 ASP A CG 1 +ATOM 2619 O OD1 . ASP A 1 320 ? -4.866 27.736 80.885 1.00 45.19 ? 320 ASP A OD1 1 +ATOM 2620 O OD2 . ASP A 1 320 ? -6.803 27.524 79.846 1.00 44.57 ? 320 ASP A OD2 1 +ATOM 2621 N N . MET A 1 321 ? -3.418 28.653 78.529 1.00 34.05 ? 321 MET A N 1 +ATOM 2622 C CA . MET A 1 321 ? -2.826 28.073 77.319 1.00 34.30 ? 321 MET A CA 1 +ATOM 2623 C C . MET A 1 321 ? -1.623 28.858 76.803 1.00 34.60 ? 321 MET A C 1 +ATOM 2624 O O . MET A 1 321 ? -1.172 28.647 75.669 1.00 33.02 ? 321 MET A O 1 +ATOM 2625 C CB . MET A 1 321 ? -3.877 28.018 76.201 1.00 34.44 ? 321 MET A CB 1 +ATOM 2626 C CG . MET A 1 321 ? -5.236 27.445 76.616 1.00 36.19 ? 321 MET A CG 1 +ATOM 2627 S SD . MET A 1 321 ? -5.148 25.767 77.306 1.00 40.78 ? 321 MET A SD 1 +ATOM 2628 C CE . MET A 1 321 ? -4.450 24.857 75.909 1.00 39.32 ? 321 MET A CE 1 +ATOM 2629 N N . ASN A 1 322 ? -1.096 29.752 77.632 1.00 34.06 ? 322 ASN A N 1 +ATOM 2630 C CA . ASN A 1 322 ? 0.008 30.597 77.215 1.00 33.96 ? 322 ASN A CA 1 +ATOM 2631 C C . ASN A 1 322 ? 1.431 30.038 77.337 1.00 33.71 ? 322 ASN A C 1 +ATOM 2632 O O . ASN A 1 322 ? 2.364 30.795 77.568 1.00 34.66 ? 322 ASN A O 1 +ATOM 2633 C CB . ASN A 1 322 ? -0.100 31.935 77.953 1.00 35.55 ? 322 ASN A CB 1 +ATOM 2634 C CG . ASN A 1 322 ? 0.042 31.791 79.458 1.00 36.99 ? 322 ASN A CG 1 +ATOM 2635 O OD1 . ASN A 1 322 ? -0.238 30.730 80.026 1.00 37.17 ? 322 ASN A OD1 1 +ATOM 2636 N ND2 . ASN A 1 322 ? 0.467 32.870 80.117 1.00 37.68 ? 322 ASN A ND2 1 +ATOM 2637 N N . GLU A 1 323 ? 1.600 28.730 77.151 1.00 32.71 ? 323 GLU A N 1 +ATOM 2638 C CA . GLU A 1 323 ? 2.916 28.109 77.242 1.00 32.92 ? 323 GLU A CA 1 +ATOM 2639 C C . GLU A 1 323 ? 3.978 28.618 76.267 1.00 33.90 ? 323 GLU A C 1 +ATOM 2640 O O . GLU A 1 323 ? 5.151 28.711 76.636 1.00 37.38 ? 323 GLU A O 1 +ATOM 2641 C CB . GLU A 1 323 ? 2.812 26.591 77.095 1.00 34.29 ? 323 GLU A CB 1 +ATOM 2642 C CG . GLU A 1 323 ? 2.255 25.876 78.314 1.00 36.54 ? 323 GLU A CG 1 +ATOM 2643 C CD . GLU A 1 323 ? 0.825 26.284 78.641 1.00 39.34 ? 323 GLU A CD 1 +ATOM 2644 O OE1 . GLU A 1 323 ? -0.016 26.335 77.720 1.00 38.10 ? 323 GLU A OE1 1 +ATOM 2645 O OE2 . GLU A 1 323 ? 0.537 26.543 79.831 1.00 42.00 ? 323 GLU A OE2 1 +ATOM 2646 N N . PRO A 1 324 ? 3.610 28.937 75.010 1.00 31.96 ? 324 PRO A N 1 +ATOM 2647 C CA . PRO A 1 324 ? 2.303 28.885 74.351 1.00 30.46 ? 324 PRO A CA 1 +ATOM 2648 C C . PRO A 1 324 ? 1.976 27.513 73.751 1.00 31.40 ? 324 PRO A C 1 +ATOM 2649 O O . PRO A 1 324 ? 2.857 26.789 73.269 1.00 29.18 ? 324 PRO A O 1 +ATOM 2650 C CB . PRO A 1 324 ? 2.423 29.964 73.290 1.00 28.84 ? 324 PRO A CB 1 +ATOM 2651 C CG . PRO A 1 324 ? 3.823 29.781 72.823 1.00 30.82 ? 324 PRO A CG 1 +ATOM 2652 C CD . PRO A 1 324 ? 4.609 29.558 74.119 1.00 31.08 ? 324 PRO A CD 1 +ATOM 2653 N N . THR A 1 325 ? 0.689 27.181 73.773 1.00 32.46 ? 325 THR A N 1 +ATOM 2654 C CA . THR A 1 325 ? 0.207 25.911 73.268 1.00 32.88 ? 325 THR A CA 1 +ATOM 2655 C C . THR A 1 325 ? -0.446 26.030 71.905 1.00 33.58 ? 325 THR A C 1 +ATOM 2656 O O . THR A 1 325 ? -1.044 27.056 71.578 1.00 35.38 ? 325 THR A O 1 +ATOM 2657 C CB . THR A 1 325 ? -0.794 25.308 74.268 1.00 31.92 ? 325 THR A CB 1 +ATOM 2658 O OG1 . THR A 1 325 ? -0.092 24.953 75.465 1.00 34.68 ? 325 THR A OG1 1 +ATOM 2659 C CG2 . THR A 1 325 ? -1.465 24.067 73.695 1.00 32.76 ? 325 THR A CG2 1 +ATOM 2660 N N . ASP A 1 326 ? -0.313 24.977 71.107 1.00 33.84 ? 326 ASP A N 1 +ATOM 2661 C CA . ASP A 1 326 ? -0.913 24.907 69.775 1.00 34.15 ? 326 ASP A CA 1 +ATOM 2662 C C . ASP A 1 326 ? -1.293 23.450 69.486 1.00 35.04 ? 326 ASP A C 1 +ATOM 2663 O O . ASP A 1 326 ? -0.553 22.532 69.825 1.00 36.16 ? 326 ASP A O 1 +ATOM 2664 C CB . ASP A 1 326 ? 0.057 25.399 68.708 1.00 35.29 ? 326 ASP A CB 1 +ATOM 2665 C CG . ASP A 1 326 ? -0.501 25.231 67.291 1.00 37.23 ? 326 ASP A CG 1 +ATOM 2666 O OD1 . ASP A 1 326 ? -1.530 25.869 66.957 1.00 34.54 ? 326 ASP A OD1 1 +ATOM 2667 O OD2 . ASP A 1 326 ? 0.093 24.449 66.517 1.00 37.63 ? 326 ASP A OD2 1 +ATOM 2668 N N . PHE A 1 327 ? -2.433 23.239 68.838 1.00 35.52 ? 327 PHE A N 1 +ATOM 2669 C CA . PHE A 1 327 ? -2.897 21.886 68.571 1.00 35.10 ? 327 PHE A CA 1 +ATOM 2670 C C . PHE A 1 327 ? -2.864 21.434 67.121 1.00 36.00 ? 327 PHE A C 1 +ATOM 2671 O O . PHE A 1 327 ? -3.342 20.342 66.800 1.00 36.65 ? 327 PHE A O 1 +ATOM 2672 C CB . PHE A 1 327 ? -4.312 21.726 69.123 1.00 35.09 ? 327 PHE A CB 1 +ATOM 2673 C CG . PHE A 1 327 ? -4.384 21.815 70.623 1.00 36.84 ? 327 PHE A CG 1 +ATOM 2674 C CD1 . PHE A 1 327 ? -3.793 20.830 71.426 1.00 37.06 ? 327 PHE A CD1 1 +ATOM 2675 C CD2 . PHE A 1 327 ? -5.033 22.879 71.235 1.00 36.18 ? 327 PHE A CD2 1 +ATOM 2676 C CE1 . PHE A 1 327 ? -3.851 20.912 72.817 1.00 37.06 ? 327 PHE A CE1 1 +ATOM 2677 C CE2 . PHE A 1 327 ? -5.098 22.972 72.618 1.00 36.91 ? 327 PHE A CE2 1 +ATOM 2678 C CZ . PHE A 1 327 ? -4.505 21.985 73.415 1.00 38.31 ? 327 PHE A CZ 1 +ATOM 2679 N N . SER A 1 328 ? -2.286 22.241 66.241 1.00 35.92 ? 328 SER A N 1 +ATOM 2680 C CA . SER A 1 328 ? -2.253 21.851 64.841 1.00 37.12 ? 328 SER A CA 1 +ATOM 2681 C C . SER A 1 328 ? -1.505 20.545 64.584 1.00 37.73 ? 328 SER A C 1 +ATOM 2682 O O . SER A 1 328 ? -1.933 19.754 63.754 1.00 38.87 ? 328 SER A O 1 +ATOM 2683 C CB . SER A 1 328 ? -1.681 22.980 63.975 1.00 36.19 ? 328 SER A CB 1 +ATOM 2684 O OG . SER A 1 328 ? -0.366 23.318 64.350 1.00 37.50 ? 328 SER A OG 1 +ATOM 2685 N N . ARG A 1 329 ? -0.397 20.305 65.282 1.00 39.68 ? 329 ARG A N 1 +ATOM 2686 C CA . ARG A 1 329 ? 0.348 19.056 65.078 1.00 40.28 ? 329 ARG A CA 1 +ATOM 2687 C C . ARG A 1 329 ? -0.464 17.849 65.556 1.00 39.62 ? 329 ARG A C 1 +ATOM 2688 O O . ARG A 1 329 ? -0.546 16.833 64.874 1.00 39.54 ? 329 ARG A O 1 +ATOM 2689 C CB . ARG A 1 329 ? 1.684 19.081 65.824 1.00 42.38 ? 329 ARG A CB 1 +ATOM 2690 C CG . ARG A 1 329 ? 2.912 19.143 64.926 1.00 45.04 ? 329 ARG A CG 1 +ATOM 2691 C CD . ARG A 1 329 ? 3.566 20.517 64.937 1.00 46.06 ? 329 ARG A CD 1 +ATOM 2692 N NE . ARG A 1 329 ? 3.949 20.951 66.285 1.00 48.83 ? 329 ARG A NE 1 +ATOM 2693 C CZ . ARG A 1 329 ? 4.925 20.412 67.015 1.00 49.48 ? 329 ARG A CZ 1 +ATOM 2694 N NH1 . ARG A 1 329 ? 5.645 19.405 66.544 1.00 49.56 ? 329 ARG A NH1 1 +ATOM 2695 N NH2 . ARG A 1 329 ? 5.179 20.880 68.232 1.00 50.63 ? 329 ARG A NH2 1 +ATOM 2696 N N . ALA A 1 330 ? -1.059 17.963 66.734 1.00 39.33 ? 330 ALA A N 1 +ATOM 2697 C CA . ALA A 1 330 ? -1.857 16.876 67.277 1.00 40.02 ? 330 ALA A CA 1 +ATOM 2698 C C . ALA A 1 330 ? -3.023 16.550 66.342 1.00 41.62 ? 330 ALA A C 1 +ATOM 2699 O O . ALA A 1 330 ? -3.289 15.386 66.042 1.00 40.58 ? 330 ALA A O 1 +ATOM 2700 C CB . ALA A 1 330 ? -2.384 17.255 68.645 1.00 37.08 ? 330 ALA A CB 1 +ATOM 2701 N N . ILE A 1 331 ? -3.713 17.591 65.886 1.00 42.60 ? 331 ILE A N 1 +ATOM 2702 C CA . ILE A 1 331 ? -4.859 17.428 65.011 1.00 42.98 ? 331 ILE A CA 1 +ATOM 2703 C C . ILE A 1 331 ? -4.462 16.844 63.664 1.00 44.48 ? 331 ILE A C 1 +ATOM 2704 O O . ILE A 1 331 ? -5.201 16.068 63.061 1.00 42.79 ? 331 ILE A O 1 +ATOM 2705 C CB . ILE A 1 331 ? -5.579 18.776 64.838 1.00 42.49 ? 331 ILE A CB 1 +ATOM 2706 C CG1 . ILE A 1 331 ? -6.397 19.058 66.103 1.00 41.73 ? 331 ILE A CG1 1 +ATOM 2707 C CG2 . ILE A 1 331 ? -6.459 18.766 63.598 1.00 40.10 ? 331 ILE A CG2 1 +ATOM 2708 C CD1 . ILE A 1 331 ? -7.055 20.415 66.128 1.00 43.28 ? 331 ILE A CD1 1 +ATOM 2709 N N . GLU A 1 332 ? -3.278 17.209 63.203 1.00 46.76 ? 332 GLU A N 1 +ATOM 2710 C CA . GLU A 1 332 ? -2.764 16.711 61.936 1.00 49.10 ? 332 GLU A CA 1 +ATOM 2711 C C . GLU A 1 332 ? -2.602 15.187 62.034 1.00 49.61 ? 332 GLU A C 1 +ATOM 2712 O O . GLU A 1 332 ? -2.984 14.447 61.129 1.00 49.55 ? 332 GLU A O 1 +ATOM 2713 C CB . GLU A 1 332 ? -1.429 17.390 61.660 1.00 50.99 ? 332 GLU A CB 1 +ATOM 2714 C CG . GLU A 1 332 ? -0.809 17.122 60.316 1.00 56.93 ? 332 GLU A CG 1 +ATOM 2715 C CD . GLU A 1 332 ? 0.354 18.074 60.025 1.00 61.53 ? 332 GLU A CD 1 +ATOM 2716 O OE1 . GLU A 1 332 ? 1.280 18.166 60.868 1.00 62.77 ? 332 GLU A OE1 1 +ATOM 2717 O OE2 . GLU A 1 332 ? 0.344 18.733 58.957 1.00 63.16 ? 332 GLU A OE2 1 +ATOM 2718 N N . ILE A 1 333 ? -2.050 14.727 63.152 1.00 49.98 ? 333 ILE A N 1 +ATOM 2719 C CA . ILE A 1 333 ? -1.844 13.302 63.395 1.00 50.24 ? 333 ILE A CA 1 +ATOM 2720 C C . ILE A 1 333 ? -3.182 12.580 63.508 1.00 51.82 ? 333 ILE A C 1 +ATOM 2721 O O . ILE A 1 333 ? -3.372 11.500 62.952 1.00 53.25 ? 333 ILE A O 1 +ATOM 2722 C CB . ILE A 1 333 ? -1.055 13.081 64.707 1.00 49.18 ? 333 ILE A CB 1 +ATOM 2723 C CG1 . ILE A 1 333 ? 0.371 13.604 64.547 1.00 46.71 ? 333 ILE A CG1 1 +ATOM 2724 C CG2 . ILE A 1 333 ? -1.058 11.611 65.089 1.00 47.11 ? 333 ILE A CG2 1 +ATOM 2725 C CD1 . ILE A 1 333 ? 1.139 13.643 65.851 1.00 45.82 ? 333 ILE A CD1 1 +ATOM 2726 N N . ARG A 1 334 ? -4.108 13.181 64.236 1.00 53.56 ? 334 ARG A N 1 +ATOM 2727 C CA . ARG A 1 334 ? -5.420 12.593 64.430 1.00 56.71 ? 334 ARG A CA 1 +ATOM 2728 C C . ARG A 1 334 ? -6.219 12.482 63.124 1.00 58.08 ? 334 ARG A C 1 +ATOM 2729 O O . ARG A 1 334 ? -7.058 11.599 62.989 1.00 58.80 ? 334 ARG A O 1 +ATOM 2730 C CB . ARG A 1 334 ? -6.189 13.401 65.486 1.00 58.71 ? 334 ARG A CB 1 +ATOM 2731 C CG . ARG A 1 334 ? -7.607 12.923 65.755 1.00 62.66 ? 334 ARG A CG 1 +ATOM 2732 C CD . ARG A 1 334 ? -8.625 13.805 65.038 1.00 65.29 ? 334 ARG A CD 1 +ATOM 2733 N NE . ARG A 1 334 ? -8.963 15.002 65.808 1.00 67.80 ? 334 ARG A NE 1 +ATOM 2734 C CZ . ARG A 1 334 ? -9.615 16.052 65.313 1.00 69.07 ? 334 ARG A CZ 1 +ATOM 2735 N NH1 . ARG A 1 334 ? -9.996 16.062 64.041 1.00 69.67 ? 334 ARG A NH1 1 +ATOM 2736 N NH2 . ARG A 1 334 ? -9.904 17.085 66.094 1.00 69.06 ? 334 ARG A NH2 1 +ATOM 2737 N N . ASP A 1 335 ? -5.957 13.360 62.160 1.00 59.00 ? 335 ASP A N 1 +ATOM 2738 C CA . ASP A 1 335 ? -6.672 13.306 60.886 1.00 59.33 ? 335 ASP A CA 1 +ATOM 2739 C C . ASP A 1 335 ? -6.125 12.216 59.973 1.00 59.22 ? 335 ASP A C 1 +ATOM 2740 O O . ASP A 1 335 ? -6.884 11.535 59.287 1.00 59.94 ? 335 ASP A O 1 +ATOM 2741 C CB . ASP A 1 335 ? -6.585 14.640 60.135 1.00 60.70 ? 335 ASP A CB 1 +ATOM 2742 C CG . ASP A 1 335 ? -7.372 15.755 60.807 1.00 64.01 ? 335 ASP A CG 1 +ATOM 2743 O OD1 . ASP A 1 335 ? -8.300 15.450 61.595 1.00 64.26 ? 335 ASP A OD1 1 +ATOM 2744 O OD2 . ASP A 1 335 ? -7.067 16.942 60.530 1.00 64.15 ? 335 ASP A OD2 1 +ATOM 2745 N N . VAL A 1 336 ? -4.805 12.064 59.957 1.00 57.54 ? 336 VAL A N 1 +ATOM 2746 C CA . VAL A 1 336 ? -4.164 11.071 59.110 1.00 56.23 ? 336 VAL A CA 1 +ATOM 2747 C C . VAL A 1 336 ? -4.292 9.635 59.618 1.00 56.95 ? 336 VAL A C 1 +ATOM 2748 O O . VAL A 1 336 ? -4.451 8.714 58.822 1.00 56.86 ? 336 VAL A O 1 +ATOM 2749 C CB . VAL A 1 336 ? -2.669 11.410 58.916 1.00 54.96 ? 336 VAL A CB 1 +ATOM 2750 C CG1 . VAL A 1 336 ? -1.981 10.331 58.093 1.00 53.29 ? 336 VAL A CG1 1 +ATOM 2751 C CG2 . VAL A 1 336 ? -2.535 12.757 58.233 1.00 52.97 ? 336 VAL A CG2 1 +ATOM 2752 N N . LEU A 1 337 ? -4.235 9.439 60.933 1.00 57.94 ? 337 LEU A N 1 +ATOM 2753 C CA . LEU A 1 337 ? -4.326 8.094 61.501 1.00 58.94 ? 337 LEU A CA 1 +ATOM 2754 C C . LEU A 1 337 ? -5.604 7.854 62.302 1.00 60.41 ? 337 LEU A C 1 +ATOM 2755 O O . LEU A 1 337 ? -5.705 6.882 63.052 1.00 59.50 ? 337 LEU A O 1 +ATOM 2756 C CB . LEU A 1 337 ? -3.111 7.832 62.388 1.00 58.39 ? 337 LEU A CB 1 +ATOM 2757 C CG . LEU A 1 337 ? -1.756 8.127 61.747 1.00 57.14 ? 337 LEU A CG 1 +ATOM 2758 C CD1 . LEU A 1 337 ? -0.655 7.937 62.775 1.00 57.15 ? 337 LEU A CD1 1 +ATOM 2759 C CD2 . LEU A 1 337 ? -1.545 7.219 60.556 1.00 56.58 ? 337 LEU A CD2 1 +ATOM 2760 N N . SER A 1 338 ? -6.568 8.754 62.144 1.00 61.86 ? 338 SER A N 1 +ATOM 2761 C CA . SER A 1 338 ? -7.842 8.658 62.843 1.00 64.00 ? 338 SER A CA 1 +ATOM 2762 C C . SER A 1 338 ? -8.454 7.272 62.701 1.00 64.93 ? 338 SER A C 1 +ATOM 2763 O O . SER A 1 338 ? -8.916 6.681 63.678 1.00 64.80 ? 338 SER A O 1 +ATOM 2764 C CB . SER A 1 338 ? -8.814 9.695 62.282 1.00 64.72 ? 338 SER A CB 1 +ATOM 2765 O OG . SER A 1 338 ? -8.770 9.707 60.861 1.00 65.84 ? 338 SER A OG 1 +ATOM 2766 N N . SER A 1 339 ? -8.446 6.769 61.470 1.00 66.07 ? 339 SER A N 1 +ATOM 2767 C CA . SER A 1 339 ? -9.008 5.465 61.130 1.00 67.34 ? 339 SER A CA 1 +ATOM 2768 C C . SER A 1 339 ? -8.396 4.261 61.854 1.00 67.58 ? 339 SER A C 1 +ATOM 2769 O O . SER A 1 339 ? -9.123 3.420 62.392 1.00 67.04 ? 339 SER A O 1 +ATOM 2770 C CB . SER A 1 339 ? -8.911 5.256 59.617 1.00 68.43 ? 339 SER A CB 1 +ATOM 2771 O OG . SER A 1 339 ? -7.597 5.517 59.135 1.00 69.80 ? 339 SER A OG 1 +ATOM 2772 N N . LEU A 1 340 ? -7.067 4.180 61.857 1.00 67.77 ? 340 LEU A N 1 +ATOM 2773 C CA . LEU A 1 340 ? -6.355 3.081 62.503 1.00 68.15 ? 340 LEU A CA 1 +ATOM 2774 C C . LEU A 1 340 ? -6.836 2.751 63.908 1.00 68.43 ? 340 LEU A C 1 +ATOM 2775 O O . LEU A 1 340 ? -6.897 3.614 64.784 1.00 68.21 ? 340 LEU A O 1 +ATOM 2776 C CB . LEU A 1 340 ? -4.853 3.367 62.533 1.00 68.15 ? 340 LEU A CB 1 +ATOM 2777 C CG . LEU A 1 340 ? -4.099 2.895 61.290 1.00 68.50 ? 340 LEU A CG 1 +ATOM 2778 C CD1 . LEU A 1 340 ? -4.054 1.375 61.285 1.00 68.85 ? 340 LEU A CD1 1 +ATOM 2779 C CD2 . LEU A 1 340 ? -4.781 3.417 60.027 1.00 69.43 ? 340 LEU A CD2 1 +ATOM 2780 N N . PRO A 1 341 ? -7.177 1.477 64.139 1.00 69.23 ? 341 PRO A N 1 +ATOM 2781 C CA . PRO A 1 341 ? -7.660 0.978 65.430 1.00 69.92 ? 341 PRO A CA 1 +ATOM 2782 C C . PRO A 1 341 ? -6.564 1.054 66.489 1.00 70.88 ? 341 PRO A C 1 +ATOM 2783 O O . PRO A 1 341 ? -6.708 0.538 67.600 1.00 71.60 ? 341 PRO A O 1 +ATOM 2784 C CB . PRO A 1 341 ? -8.044 -0.457 65.106 1.00 69.73 ? 341 PRO A CB 1 +ATOM 2785 C CG . PRO A 1 341 ? -7.014 -0.834 64.066 1.00 69.17 ? 341 PRO A CG 1 +ATOM 2786 C CD . PRO A 1 341 ? -7.018 0.373 63.173 1.00 68.42 ? 341 PRO A CD 1 +ATOM 2787 N N . VAL A 1 342 ? -5.470 1.710 66.122 1.00 71.29 ? 342 VAL A N 1 +ATOM 2788 C CA . VAL A 1 342 ? -4.307 1.869 66.979 1.00 71.07 ? 342 VAL A CA 1 +ATOM 2789 C C . VAL A 1 342 ? -4.387 3.048 67.953 1.00 71.49 ? 342 VAL A C 1 +ATOM 2790 O O . VAL A 1 342 ? -5.110 4.020 67.726 1.00 71.68 ? 342 VAL A O 1 +ATOM 2791 C CB . VAL A 1 342 ? -3.052 2.000 66.103 1.00 70.94 ? 342 VAL A CB 1 +ATOM 2792 C CG1 . VAL A 1 342 ? -1.884 2.503 66.912 1.00 70.81 ? 342 VAL A CG1 1 +ATOM 2793 C CG2 . VAL A 1 342 ? -2.739 0.655 65.475 1.00 70.29 ? 342 VAL A CG2 1 +ATOM 2794 N N . GLN A 1 343 ? -3.632 2.938 69.042 1.00 71.82 ? 343 GLN A N 1 +ATOM 2795 C CA . GLN A 1 343 ? -3.581 3.955 70.086 1.00 72.46 ? 343 GLN A CA 1 +ATOM 2796 C C . GLN A 1 343 ? -2.297 4.785 70.019 1.00 72.81 ? 343 GLN A C 1 +ATOM 2797 O O . GLN A 1 343 ? -1.200 4.246 69.851 1.00 71.96 ? 343 GLN A O 1 +ATOM 2798 C CB . GLN A 1 343 ? -3.684 3.279 71.446 1.00 72.94 ? 343 GLN A CB 1 +ATOM 2799 C CG . GLN A 1 343 ? -3.505 4.201 72.620 1.00 73.79 ? 343 GLN A CG 1 +ATOM 2800 C CD . GLN A 1 343 ? -3.597 3.455 73.925 1.00 74.10 ? 343 GLN A CD 1 +ATOM 2801 O OE1 . GLN A 1 343 ? -4.638 2.884 74.254 1.00 73.53 ? 343 GLN A OE1 1 +ATOM 2802 N NE2 . GLN A 1 343 ? -2.501 3.442 74.676 1.00 75.11 ? 343 GLN A NE2 1 +ATOM 2803 N N . PHE A 1 344 ? -2.445 6.098 70.170 1.00 73.13 ? 344 PHE A N 1 +ATOM 2804 C CA . PHE A 1 344 ? -1.314 7.015 70.109 1.00 73.59 ? 344 PHE A CA 1 +ATOM 2805 C C . PHE A 1 344 ? -0.624 7.200 71.446 1.00 73.95 ? 344 PHE A C 1 +ATOM 2806 O O . PHE A 1 344 ? -1.256 7.151 72.501 1.00 73.86 ? 344 PHE A O 1 +ATOM 2807 C CB . PHE A 1 344 ? -1.771 8.384 69.607 1.00 73.88 ? 344 PHE A CB 1 +ATOM 2808 C CG . PHE A 1 344 ? -2.500 8.335 68.300 1.00 75.26 ? 344 PHE A CG 1 +ATOM 2809 C CD1 . PHE A 1 344 ? -1.879 7.827 67.161 1.00 75.54 ? 344 PHE A CD1 1 +ATOM 2810 C CD2 . PHE A 1 344 ? -3.817 8.780 68.209 1.00 75.84 ? 344 PHE A CD2 1 +ATOM 2811 C CE1 . PHE A 1 344 ? -2.562 7.758 65.945 1.00 76.18 ? 344 PHE A CE1 1 +ATOM 2812 C CE2 . PHE A 1 344 ? -4.511 8.718 67.000 1.00 76.27 ? 344 PHE A CE2 1 +ATOM 2813 C CZ . PHE A 1 344 ? -3.882 8.206 65.865 1.00 76.62 ? 344 PHE A CZ 1 +ATOM 2814 N N . ARG A 1 345 ? 0.684 7.408 71.393 1.00 74.67 ? 345 ARG A N 1 +ATOM 2815 C CA . ARG A 1 345 ? 1.455 7.642 72.601 1.00 76.05 ? 345 ARG A CA 1 +ATOM 2816 C C . ARG A 1 345 ? 1.164 9.092 72.945 1.00 75.32 ? 345 ARG A C 1 +ATOM 2817 O O . ARG A 1 345 ? 0.894 9.899 72.056 1.00 74.75 ? 345 ARG A O 1 +ATOM 2818 C CB . ARG A 1 345 ? 2.948 7.451 72.334 1.00 78.05 ? 345 ARG A CB 1 +ATOM 2819 C CG . ARG A 1 345 ? 3.514 8.423 71.320 1.00 80.82 ? 345 ARG A CG 1 +ATOM 2820 C CD . ARG A 1 345 ? 4.927 8.050 70.916 1.00 83.19 ? 345 ARG A CD 1 +ATOM 2821 N NE . ARG A 1 345 ? 5.454 8.995 69.939 1.00 85.75 ? 345 ARG A NE 1 +ATOM 2822 C CZ . ARG A 1 345 ? 6.577 8.815 69.253 1.00 86.99 ? 345 ARG A CZ 1 +ATOM 2823 N NH1 . ARG A 1 345 ? 7.299 7.716 69.436 1.00 87.47 ? 345 ARG A NH1 1 +ATOM 2824 N NH2 . ARG A 1 345 ? 6.976 9.732 68.380 1.00 87.04 ? 345 ARG A NH2 1 +ATOM 2825 N N . ASP A 1 346 ? 1.209 9.430 74.225 1.00 74.96 ? 346 ASP A N 1 +ATOM 2826 C CA . ASP A 1 346 ? 0.918 10.799 74.624 1.00 74.27 ? 346 ASP A CA 1 +ATOM 2827 C C . ASP A 1 346 ? 2.180 11.637 74.775 1.00 71.76 ? 346 ASP A C 1 +ATOM 2828 O O . ASP A 1 346 ? 2.694 11.803 75.883 1.00 72.40 ? 346 ASP A O 1 +ATOM 2829 C CB . ASP A 1 346 ? 0.123 10.816 75.937 1.00 76.74 ? 346 ASP A CB 1 +ATOM 2830 C CG . ASP A 1 346 ? -0.419 12.196 76.272 1.00 79.05 ? 346 ASP A CG 1 +ATOM 2831 O OD1 . ASP A 1 346 ? 0.384 13.154 76.332 1.00 81.28 ? 346 ASP A OD1 1 +ATOM 2832 O OD2 . ASP A 1 346 ? -1.648 12.324 76.476 1.00 79.47 ? 346 ASP A OD2 1 +ATOM 2833 N N . ASP A 1 347 ? 2.686 12.152 73.659 1.00 68.05 ? 347 ASP A N 1 +ATOM 2834 C CA . ASP A 1 347 ? 3.872 12.994 73.695 1.00 64.00 ? 347 ASP A CA 1 +ATOM 2835 C C . ASP A 1 347 ? 3.401 14.439 73.793 1.00 59.68 ? 347 ASP A C 1 +ATOM 2836 O O . ASP A 1 347 ? 2.939 15.026 72.815 1.00 58.20 ? 347 ASP A O 1 +ATOM 2837 C CB . ASP A 1 347 ? 4.730 12.791 72.443 1.00 66.26 ? 347 ASP A CB 1 +ATOM 2838 C CG . ASP A 1 347 ? 5.924 13.739 72.393 1.00 69.60 ? 347 ASP A CG 1 +ATOM 2839 O OD1 . ASP A 1 347 ? 6.505 14.035 73.467 1.00 71.61 ? 347 ASP A OD1 1 +ATOM 2840 O OD2 . ASP A 1 347 ? 6.288 14.182 71.281 1.00 70.79 ? 347 ASP A OD2 1 +ATOM 2841 N N . ARG A 1 348 ? 3.516 14.996 74.991 1.00 54.62 ? 348 ARG A N 1 +ATOM 2842 C CA . ARG A 1 348 ? 3.083 16.357 75.262 1.00 50.81 ? 348 ARG A CA 1 +ATOM 2843 C C . ARG A 1 348 ? 3.819 17.416 74.449 1.00 48.56 ? 348 ARG A C 1 +ATOM 2844 O O . ARG A 1 348 ? 3.259 18.471 74.161 1.00 47.53 ? 348 ARG A O 1 +ATOM 2845 C CB . ARG A 1 348 ? 3.225 16.641 76.756 1.00 50.01 ? 348 ARG A CB 1 +ATOM 2846 C CG . ARG A 1 348 ? 2.275 15.831 77.630 1.00 48.41 ? 348 ARG A CG 1 +ATOM 2847 C CD . ARG A 1 348 ? 0.938 16.524 77.747 1.00 48.50 ? 348 ARG A CD 1 +ATOM 2848 N NE . ARG A 1 348 ? -0.088 16.003 76.852 1.00 46.86 ? 348 ARG A NE 1 +ATOM 2849 C CZ . ARG A 1 348 ? -1.198 16.667 76.532 1.00 47.63 ? 348 ARG A CZ 1 +ATOM 2850 N NH1 . ARG A 1 348 ? -1.426 17.881 77.015 1.00 45.86 ? 348 ARG A NH1 1 +ATOM 2851 N NH2 . ARG A 1 348 ? -2.104 16.101 75.753 1.00 50.13 ? 348 ARG A NH2 1 +ATOM 2852 N N . LEU A 1 349 ? 5.063 17.136 74.073 1.00 46.11 ? 349 LEU A N 1 +ATOM 2853 C CA . LEU A 1 349 ? 5.838 18.085 73.289 1.00 44.95 ? 349 LEU A CA 1 +ATOM 2854 C C . LEU A 1 349 ? 5.187 18.402 71.950 1.00 43.19 ? 349 LEU A C 1 +ATOM 2855 O O . LEU A 1 349 ? 5.535 19.386 71.297 1.00 42.98 ? 349 LEU A O 1 +ATOM 2856 C CB . LEU A 1 349 ? 7.250 17.554 73.059 1.00 46.76 ? 349 LEU A CB 1 +ATOM 2857 C CG . LEU A 1 349 ? 8.118 17.509 74.320 1.00 48.72 ? 349 LEU A CG 1 +ATOM 2858 C CD1 . LEU A 1 349 ? 9.470 16.884 73.982 1.00 48.66 ? 349 LEU A CD1 1 +ATOM 2859 C CD2 . LEU A 1 349 ? 8.295 18.918 74.879 1.00 46.83 ? 349 LEU A CD2 1 +ATOM 2860 N N . VAL A 1 350 ? 4.233 17.576 71.540 1.00 42.11 ? 350 VAL A N 1 +ATOM 2861 C CA . VAL A 1 350 ? 3.540 17.800 70.276 1.00 40.58 ? 350 VAL A CA 1 +ATOM 2862 C C . VAL A 1 350 ? 2.636 19.032 70.347 1.00 39.35 ? 350 VAL A C 1 +ATOM 2863 O O . VAL A 1 350 ? 2.268 19.584 69.313 1.00 39.59 ? 350 VAL A O 1 +ATOM 2864 C CB . VAL A 1 350 ? 2.670 16.583 69.872 1.00 41.63 ? 350 VAL A CB 1 +ATOM 2865 C CG1 . VAL A 1 350 ? 1.435 16.496 70.767 1.00 41.72 ? 350 VAL A CG1 1 +ATOM 2866 C CG2 . VAL A 1 350 ? 2.250 16.706 68.414 1.00 41.68 ? 350 VAL A CG2 1 +ATOM 2867 N N . THR A 1 351 ? 2.275 19.458 71.559 1.00 38.52 ? 351 THR A N 1 +ATOM 2868 C CA . THR A 1 351 ? 1.416 20.635 71.731 1.00 38.02 ? 351 THR A CA 1 +ATOM 2869 C C . THR A 1 351 ? 2.178 21.969 71.798 1.00 38.14 ? 351 THR A C 1 +ATOM 2870 O O . THR A 1 351 ? 1.569 23.021 72.005 1.00 38.00 ? 351 THR A O 1 +ATOM 2871 C CB . THR A 1 351 ? 0.543 20.538 73.004 1.00 39.31 ? 351 THR A CB 1 +ATOM 2872 O OG1 . THR A 1 351 ? 1.375 20.629 74.172 1.00 41.08 ? 351 THR A OG1 1 +ATOM 2873 C CG2 . THR A 1 351 ? -0.228 19.223 73.027 1.00 39.10 ? 351 THR A CG2 1 +ATOM 2874 N N . THR A 1 352 ? 3.500 21.938 71.646 1.00 36.20 ? 352 THR A N 1 +ATOM 2875 C CA . THR A 1 352 ? 4.260 23.182 71.669 1.00 36.65 ? 352 THR A CA 1 +ATOM 2876 C C . THR A 1 352 ? 4.267 23.752 70.254 1.00 37.13 ? 352 THR A C 1 +ATOM 2877 O O . THR A 1 352 ? 3.848 23.080 69.310 1.00 38.62 ? 352 THR A O 1 +ATOM 2878 C CB . THR A 1 352 ? 5.729 22.964 72.092 1.00 36.05 ? 352 THR A CB 1 +ATOM 2879 O OG1 . THR A 1 352 ? 6.400 22.194 71.093 1.00 36.54 ? 352 THR A OG1 1 +ATOM 2880 C CG2 . THR A 1 352 ? 5.802 22.239 73.423 1.00 35.53 ? 352 THR A CG2 1 +ATOM 2881 N N . PHE A 1 353 ? 4.742 24.986 70.100 1.00 36.68 ? 353 PHE A N 1 +ATOM 2882 C CA . PHE A 1 353 ? 4.806 25.599 68.780 1.00 36.20 ? 353 PHE A CA 1 +ATOM 2883 C C . PHE A 1 353 ? 5.776 24.809 67.915 1.00 37.82 ? 353 PHE A C 1 +ATOM 2884 O O . PHE A 1 353 ? 6.719 24.206 68.423 1.00 38.84 ? 353 PHE A O 1 +ATOM 2885 C CB . PHE A 1 353 ? 5.293 27.049 68.873 1.00 33.41 ? 353 PHE A CB 1 +ATOM 2886 C CG . PHE A 1 353 ? 4.195 28.061 69.102 1.00 34.02 ? 353 PHE A CG 1 +ATOM 2887 C CD1 . PHE A 1 353 ? 2.932 27.669 69.540 1.00 32.04 ? 353 PHE A CD1 1 +ATOM 2888 C CD2 . PHE A 1 353 ? 4.439 29.419 68.907 1.00 33.47 ? 353 PHE A CD2 1 +ATOM 2889 C CE1 . PHE A 1 353 ? 1.934 28.615 69.781 1.00 32.98 ? 353 PHE A CE1 1 +ATOM 2890 C CE2 . PHE A 1 353 ? 3.445 30.371 69.146 1.00 33.05 ? 353 PHE A CE2 1 +ATOM 2891 C CZ . PHE A 1 353 ? 2.190 29.966 69.585 1.00 32.63 ? 353 PHE A CZ 1 +ATOM 2892 N N . PRO A 1 354 ? 5.543 24.780 66.594 1.00 38.77 ? 354 PRO A N 1 +ATOM 2893 C CA . PRO A 1 354 ? 6.430 24.055 65.683 1.00 40.12 ? 354 PRO A CA 1 +ATOM 2894 C C . PRO A 1 354 ? 7.821 24.680 65.733 1.00 42.68 ? 354 PRO A C 1 +ATOM 2895 O O . PRO A 1 354 ? 8.004 25.764 66.299 1.00 44.27 ? 354 PRO A O 1 +ATOM 2896 C CB . PRO A 1 354 ? 5.760 24.254 64.326 1.00 39.61 ? 354 PRO A CB 1 +ATOM 2897 C CG . PRO A 1 354 ? 4.314 24.337 64.675 1.00 38.84 ? 354 PRO A CG 1 +ATOM 2898 C CD . PRO A 1 354 ? 4.328 25.232 65.894 1.00 38.83 ? 354 PRO A CD 1 +ATOM 2899 N N . ASP A 1 355 ? 8.803 24.021 65.131 1.00 45.75 ? 355 ASP A N 1 +ATOM 2900 C CA . ASP A 1 355 ? 10.168 24.547 65.146 1.00 47.86 ? 355 ASP A CA 1 +ATOM 2901 C C . ASP A 1 355 ? 10.461 25.702 64.192 1.00 46.03 ? 355 ASP A C 1 +ATOM 2902 O O . ASP A 1 355 ? 11.405 26.466 64.410 1.00 46.40 ? 355 ASP A O 1 +ATOM 2903 C CB . ASP A 1 355 ? 11.158 23.417 64.893 1.00 52.68 ? 355 ASP A CB 1 +ATOM 2904 C CG . ASP A 1 355 ? 11.375 22.560 66.127 1.00 60.02 ? 355 ASP A CG 1 +ATOM 2905 O OD1 . ASP A 1 355 ? 11.873 23.106 67.152 1.00 61.15 ? 355 ASP A OD1 1 +ATOM 2906 O OD2 . ASP A 1 355 ? 11.042 21.348 66.071 1.00 62.89 ? 355 ASP A OD2 1 +ATOM 2907 N N . ASN A 1 356 ? 9.653 25.845 63.149 1.00 42.74 ? 356 ASN A N 1 +ATOM 2908 C CA . ASN A 1 356 ? 9.879 26.905 62.181 1.00 40.29 ? 356 ASN A CA 1 +ATOM 2909 C C . ASN A 1 356 ? 9.268 28.263 62.552 1.00 38.88 ? 356 ASN A C 1 +ATOM 2910 O O . ASN A 1 356 ? 9.286 29.189 61.744 1.00 39.71 ? 356 ASN A O 1 +ATOM 2911 C CB . ASN A 1 356 ? 9.375 26.455 60.808 1.00 39.68 ? 356 ASN A CB 1 +ATOM 2912 C CG . ASN A 1 356 ? 7.881 26.190 60.796 1.00 40.40 ? 356 ASN A CG 1 +ATOM 2913 O OD1 . ASN A 1 356 ? 7.295 25.818 61.814 1.00 39.42 ? 356 ASN A OD1 1 +ATOM 2914 N ND2 . ASN A 1 356 ? 7.262 26.361 59.637 1.00 39.56 ? 356 ASN A ND2 1 +ATOM 2915 N N . VAL A 1 357 ? 8.740 28.392 63.767 1.00 37.16 ? 357 VAL A N 1 +ATOM 2916 C CA . VAL A 1 357 ? 8.139 29.653 64.211 1.00 35.39 ? 357 VAL A CA 1 +ATOM 2917 C C . VAL A 1 357 ? 9.194 30.656 64.677 1.00 36.23 ? 357 VAL A C 1 +ATOM 2918 O O . VAL A 1 357 ? 10.131 30.302 65.388 1.00 37.33 ? 357 VAL A O 1 +ATOM 2919 C CB . VAL A 1 357 ? 7.128 29.432 65.365 1.00 35.05 ? 357 VAL A CB 1 +ATOM 2920 C CG1 . VAL A 1 357 ? 6.674 30.782 65.926 1.00 31.24 ? 357 VAL A CG1 1 +ATOM 2921 C CG2 . VAL A 1 357 ? 5.909 28.638 64.864 1.00 33.37 ? 357 VAL A CG2 1 +ATOM 2922 N N . VAL A 1 358 ? 9.036 31.913 64.279 1.00 36.13 ? 358 VAL A N 1 +ATOM 2923 C CA . VAL A 1 358 ? 9.995 32.946 64.649 1.00 37.77 ? 358 VAL A CA 1 +ATOM 2924 C C . VAL A 1 358 ? 9.348 34.161 65.303 1.00 38.09 ? 358 VAL A C 1 +ATOM 2925 O O . VAL A 1 358 ? 8.159 34.427 65.127 1.00 39.16 ? 358 VAL A O 1 +ATOM 2926 C CB . VAL A 1 358 ? 10.805 33.437 63.417 1.00 37.33 ? 358 VAL A CB 1 +ATOM 2927 C CG1 . VAL A 1 358 ? 11.579 32.286 62.807 1.00 35.43 ? 358 VAL A CG1 1 +ATOM 2928 C CG2 . VAL A 1 358 ? 9.871 34.051 62.393 1.00 35.91 ? 358 VAL A CG2 1 +ATOM 2929 N N . HIS A 1 359 ? 10.151 34.897 66.059 1.00 37.96 ? 359 HIS A N 1 +ATOM 2930 C CA . HIS A 1 359 ? 9.685 36.091 66.755 1.00 38.32 ? 359 HIS A CA 1 +ATOM 2931 C C . HIS A 1 359 ? 10.693 37.214 66.532 1.00 38.37 ? 359 HIS A C 1 +ATOM 2932 O O . HIS A 1 359 ? 11.808 36.982 66.058 1.00 37.13 ? 359 HIS A O 1 +ATOM 2933 C CB . HIS A 1 359 ? 9.597 35.832 68.265 1.00 38.18 ? 359 HIS A CB 1 +ATOM 2934 C CG . HIS A 1 359 ? 8.695 34.700 68.645 1.00 38.22 ? 359 HIS A CG 1 +ATOM 2935 N ND1 . HIS A 1 359 ? 7.321 34.820 68.690 1.00 37.00 ? 359 HIS A ND1 1 +ATOM 2936 C CD2 . HIS A 1 359 ? 8.976 33.435 69.034 1.00 34.79 ? 359 HIS A CD2 1 +ATOM 2937 C CE1 . HIS A 1 359 ? 6.797 33.679 69.097 1.00 34.99 ? 359 HIS A CE1 1 +ATOM 2938 N NE2 . HIS A 1 359 ? 7.779 32.823 69.312 1.00 35.12 ? 359 HIS A NE2 1 +ATOM 2939 N N . TYR A 1 360 ? 10.295 38.431 66.876 1.00 39.86 ? 360 TYR A N 1 +ATOM 2940 C CA . TYR A 1 360 ? 11.190 39.578 66.772 1.00 41.36 ? 360 TYR A CA 1 +ATOM 2941 C C . TYR A 1 360 ? 11.429 40.090 68.179 1.00 40.03 ? 360 TYR A C 1 +ATOM 2942 O O . TYR A 1 360 ? 10.570 40.720 68.781 1.00 40.67 ? 360 TYR A O 1 +ATOM 2943 C CB . TYR A 1 360 ? 10.596 40.684 65.894 1.00 42.30 ? 360 TYR A CB 1 +ATOM 2944 C CG . TYR A 1 360 ? 10.607 40.322 64.430 1.00 47.52 ? 360 TYR A CG 1 +ATOM 2945 C CD1 . TYR A 1 360 ? 9.550 39.604 63.862 1.00 50.74 ? 360 TYR A CD1 1 +ATOM 2946 C CD2 . TYR A 1 360 ? 11.706 40.638 63.617 1.00 49.14 ? 360 TYR A CD2 1 +ATOM 2947 C CE1 . TYR A 1 360 ? 9.582 39.204 62.514 1.00 53.17 ? 360 TYR A CE1 1 +ATOM 2948 C CE2 . TYR A 1 360 ? 11.752 40.243 62.275 1.00 51.42 ? 360 TYR A CE2 1 +ATOM 2949 C CZ . TYR A 1 360 ? 10.687 39.527 61.732 1.00 53.23 ? 360 TYR A CZ 1 +ATOM 2950 O OH . TYR A 1 360 ? 10.724 39.127 60.415 1.00 56.39 ? 360 TYR A OH 1 +ATOM 2951 N N . LEU A 1 361 ? 12.600 39.779 68.714 1.00 40.04 ? 361 LEU A N 1 +ATOM 2952 C CA . LEU A 1 361 ? 12.958 40.204 70.056 1.00 39.24 ? 361 LEU A CA 1 +ATOM 2953 C C . LEU A 1 361 ? 13.956 41.355 69.941 1.00 39.21 ? 361 LEU A C 1 +ATOM 2954 O O . LEU A 1 361 ? 15.025 41.211 69.334 1.00 38.89 ? 361 LEU A O 1 +ATOM 2955 C CB . LEU A 1 361 ? 13.576 39.034 70.822 1.00 37.80 ? 361 LEU A CB 1 +ATOM 2956 C CG . LEU A 1 361 ? 14.047 39.332 72.247 1.00 39.02 ? 361 LEU A CG 1 +ATOM 2957 C CD1 . LEU A 1 361 ? 12.879 39.813 73.097 1.00 36.68 ? 361 LEU A CD1 1 +ATOM 2958 C CD2 . LEU A 1 361 ? 14.668 38.080 72.838 1.00 38.37 ? 361 LEU A CD2 1 +ATOM 2959 N N . ARG A 1 362 ? 13.594 42.499 70.512 1.00 39.16 ? 362 ARG A N 1 +ATOM 2960 C CA . ARG A 1 362 ? 14.446 43.683 70.467 1.00 40.52 ? 362 ARG A CA 1 +ATOM 2961 C C . ARG A 1 362 ? 14.967 43.913 69.042 1.00 41.53 ? 362 ARG A C 1 +ATOM 2962 O O . ARG A 1 362 ? 16.161 44.123 68.820 1.00 41.40 ? 362 ARG A O 1 +ATOM 2963 C CB . ARG A 1 362 ? 15.615 43.543 71.463 1.00 38.71 ? 362 ARG A CB 1 +ATOM 2964 C CG . ARG A 1 362 ? 15.156 43.461 72.917 1.00 37.65 ? 362 ARG A CG 1 +ATOM 2965 C CD . ARG A 1 362 ? 16.296 43.615 73.911 1.00 36.37 ? 362 ARG A CD 1 +ATOM 2966 N NE . ARG A 1 362 ? 17.314 42.576 73.795 1.00 37.50 ? 362 ARG A NE 1 +ATOM 2967 C CZ . ARG A 1 362 ? 17.175 41.333 74.241 1.00 37.80 ? 362 ARG A CZ 1 +ATOM 2968 N NH1 . ARG A 1 362 ? 16.052 40.960 74.845 1.00 38.33 ? 362 ARG A NH1 1 +ATOM 2969 N NH2 . ARG A 1 362 ? 18.160 40.458 74.070 1.00 37.37 ? 362 ARG A NH2 1 +ATOM 2970 N N . GLY A 1 363 ? 14.052 43.848 68.080 1.00 42.41 ? 363 GLY A N 1 +ATOM 2971 C CA . GLY A 1 363 ? 14.410 44.068 66.690 1.00 43.85 ? 363 GLY A CA 1 +ATOM 2972 C C . GLY A 1 363 ? 15.074 42.916 65.956 1.00 45.48 ? 363 GLY A C 1 +ATOM 2973 O O . GLY A 1 363 ? 15.209 42.954 64.733 1.00 45.39 ? 363 GLY A O 1 +ATOM 2974 N N . LYS A 1 364 ? 15.485 41.886 66.685 1.00 46.61 ? 364 LYS A N 1 +ATOM 2975 C CA . LYS A 1 364 ? 16.153 40.752 66.059 1.00 46.92 ? 364 LYS A CA 1 +ATOM 2976 C C . LYS A 1 364 ? 15.207 39.571 65.852 1.00 46.29 ? 364 LYS A C 1 +ATOM 2977 O O . LYS A 1 364 ? 14.346 39.294 66.689 1.00 45.79 ? 364 LYS A O 1 +ATOM 2978 C CB . LYS A 1 364 ? 17.353 40.333 66.913 1.00 47.59 ? 364 LYS A CB 1 +ATOM 2979 C CG . LYS A 1 364 ? 18.162 39.186 66.349 1.00 50.38 ? 364 LYS A CG 1 +ATOM 2980 C CD . LYS A 1 364 ? 19.330 38.851 67.269 1.00 53.53 ? 364 LYS A CD 1 +ATOM 2981 C CE . LYS A 1 364 ? 20.223 37.768 66.672 1.00 54.91 ? 364 LYS A CE 1 +ATOM 2982 N NZ . LYS A 1 364 ? 21.394 37.481 67.549 1.00 56.24 ? 364 LYS A NZ 1 +ATOM 2983 N N . ARG A 1 365 ? 15.374 38.891 64.723 1.00 46.22 ? 365 ARG A N 1 +ATOM 2984 C CA . ARG A 1 365 ? 14.561 37.729 64.368 1.00 46.01 ? 365 ARG A CA 1 +ATOM 2985 C C . ARG A 1 365 ? 15.167 36.493 65.027 1.00 44.42 ? 365 ARG A C 1 +ATOM 2986 O O . ARG A 1 365 ? 16.325 36.154 64.769 1.00 44.95 ? 365 ARG A O 1 +ATOM 2987 C CB . ARG A 1 365 ? 14.556 37.583 62.849 1.00 47.78 ? 365 ARG A CB 1 +ATOM 2988 C CG . ARG A 1 365 ? 13.524 36.649 62.265 1.00 50.41 ? 365 ARG A CG 1 +ATOM 2989 C CD . ARG A 1 365 ? 13.224 37.102 60.839 1.00 54.26 ? 365 ARG A CD 1 +ATOM 2990 N NE . ARG A 1 365 ? 12.595 36.064 60.031 1.00 57.67 ? 365 ARG A NE 1 +ATOM 2991 C CZ . ARG A 1 365 ? 13.192 34.925 59.691 1.00 59.58 ? 365 ARG A CZ 1 +ATOM 2992 N NH1 . ARG A 1 365 ? 14.437 34.674 60.091 1.00 59.56 ? 365 ARG A NH1 1 +ATOM 2993 N NH2 . ARG A 1 365 ? 12.544 34.037 58.949 1.00 59.83 ? 365 ARG A NH2 1 +ATOM 2994 N N . VAL A 1 366 ? 14.390 35.830 65.881 1.00 42.76 ? 366 VAL A N 1 +ATOM 2995 C CA . VAL A 1 366 ? 14.870 34.642 66.589 1.00 42.15 ? 366 VAL A CA 1 +ATOM 2996 C C . VAL A 1 366 ? 13.923 33.445 66.494 1.00 40.79 ? 366 VAL A C 1 +ATOM 2997 O O . VAL A 1 366 ? 12.715 33.597 66.321 1.00 39.09 ? 366 VAL A O 1 +ATOM 2998 C CB . VAL A 1 366 ? 15.098 34.949 68.093 1.00 42.17 ? 366 VAL A CB 1 +ATOM 2999 C CG1 . VAL A 1 366 ? 16.140 36.045 68.253 1.00 42.74 ? 366 VAL A CG1 1 +ATOM 3000 C CG2 . VAL A 1 366 ? 13.788 35.379 68.738 1.00 41.26 ? 366 VAL A CG2 1 +ATOM 3001 N N . LYS A 1 367 ? 14.485 32.248 66.617 1.00 41.01 ? 367 LYS A N 1 +ATOM 3002 C CA . LYS A 1 367 ? 13.691 31.029 66.566 1.00 40.41 ? 367 LYS A CA 1 +ATOM 3003 C C . LYS A 1 367 ? 12.900 30.856 67.855 1.00 39.15 ? 367 LYS A C 1 +ATOM 3004 O O . LYS A 1 367 ? 13.385 31.158 68.949 1.00 39.22 ? 367 LYS A O 1 +ATOM 3005 C CB . LYS A 1 367 ? 14.592 29.810 66.362 1.00 42.12 ? 367 LYS A CB 1 +ATOM 3006 C CG . LYS A 1 367 ? 15.211 29.706 64.984 1.00 45.13 ? 367 LYS A CG 1 +ATOM 3007 C CD . LYS A 1 367 ? 16.015 28.420 64.874 1.00 49.40 ? 367 LYS A CD 1 +ATOM 3008 C CE . LYS A 1 367 ? 16.577 28.232 63.474 1.00 52.89 ? 367 LYS A CE 1 +ATOM 3009 N NZ . LYS A 1 367 ? 17.258 26.905 63.336 1.00 56.18 ? 367 LYS A NZ 1 +ATOM 3010 N N . HIS A 1 368 ? 11.679 30.356 67.722 1.00 38.38 ? 368 HIS A N 1 +ATOM 3011 C CA . HIS A 1 368 ? 10.823 30.139 68.873 1.00 35.84 ? 368 HIS A CA 1 +ATOM 3012 C C . HIS A 1 368 ? 11.476 29.253 69.939 1.00 36.83 ? 368 HIS A C 1 +ATOM 3013 O O . HIS A 1 368 ? 11.299 29.485 71.137 1.00 36.04 ? 368 HIS A O 1 +ATOM 3014 C CB . HIS A 1 368 ? 9.507 29.513 68.433 1.00 34.19 ? 368 HIS A CB 1 +ATOM 3015 C CG . HIS A 1 368 ? 8.591 29.193 69.569 1.00 33.48 ? 368 HIS A CG 1 +ATOM 3016 N ND1 . HIS A 1 368 ? 7.869 30.160 70.231 1.00 32.47 ? 368 HIS A ND1 1 +ATOM 3017 C CD2 . HIS A 1 368 ? 8.339 28.027 70.211 1.00 32.12 ? 368 HIS A CD2 1 +ATOM 3018 C CE1 . HIS A 1 368 ? 7.211 29.606 71.234 1.00 34.03 ? 368 HIS A CE1 1 +ATOM 3019 N NE2 . HIS A 1 368 ? 7.481 28.312 71.244 1.00 33.36 ? 368 HIS A NE2 1 +ATOM 3020 N N . GLU A 1 369 ? 12.232 28.246 69.509 1.00 37.65 ? 369 GLU A N 1 +ATOM 3021 C CA . GLU A 1 369 ? 12.873 27.336 70.452 1.00 40.61 ? 369 GLU A CA 1 +ATOM 3022 C C . GLU A 1 369 ? 13.954 27.990 71.306 1.00 39.96 ? 369 GLU A C 1 +ATOM 3023 O O . GLU A 1 369 ? 14.341 27.444 72.334 1.00 39.92 ? 369 GLU A O 1 +ATOM 3024 C CB . GLU A 1 369 ? 13.467 26.130 69.717 1.00 43.34 ? 369 GLU A CB 1 +ATOM 3025 C CG . GLU A 1 369 ? 14.529 26.488 68.705 1.00 50.95 ? 369 GLU A CG 1 +ATOM 3026 C CD . GLU A 1 369 ? 14.976 25.284 67.887 1.00 56.24 ? 369 GLU A CD 1 +ATOM 3027 O OE1 . GLU A 1 369 ? 15.763 24.454 68.405 1.00 57.90 ? 369 GLU A OE1 1 +ATOM 3028 O OE2 . GLU A 1 369 ? 14.525 25.163 66.722 1.00 59.78 ? 369 GLU A OE2 1 +ATOM 3029 N N . LYS A 1 370 ? 14.440 29.151 70.884 1.00 39.85 ? 370 LYS A N 1 +ATOM 3030 C CA . LYS A 1 370 ? 15.466 29.849 71.641 1.00 40.12 ? 370 LYS A CA 1 +ATOM 3031 C C . LYS A 1 370 ? 14.857 30.691 72.753 1.00 39.28 ? 370 LYS A C 1 +ATOM 3032 O O . LYS A 1 370 ? 15.483 30.892 73.793 1.00 40.02 ? 370 LYS A O 1 +ATOM 3033 C CB . LYS A 1 370 ? 16.287 30.768 70.729 1.00 42.77 ? 370 LYS A CB 1 +ATOM 3034 C CG . LYS A 1 370 ? 17.116 30.054 69.664 1.00 47.90 ? 370 LYS A CG 1 +ATOM 3035 C CD . LYS A 1 370 ? 18.218 29.195 70.280 1.00 52.31 ? 370 LYS A CD 1 +ATOM 3036 C CE . LYS A 1 370 ? 19.094 28.569 69.199 1.00 55.62 ? 370 LYS A CE 1 +ATOM 3037 N NZ . LYS A 1 370 ? 18.294 27.709 68.267 1.00 58.45 ? 370 LYS A NZ 1 +ATOM 3038 N N . VAL A 1 371 ? 13.634 31.167 72.544 1.00 36.49 ? 371 VAL A N 1 +ATOM 3039 C CA . VAL A 1 371 ? 12.989 32.037 73.519 1.00 34.88 ? 371 VAL A CA 1 +ATOM 3040 C C . VAL A 1 371 ? 11.610 31.596 74.003 1.00 34.70 ? 371 VAL A C 1 +ATOM 3041 O O . VAL A 1 371 ? 10.929 32.351 74.705 1.00 35.99 ? 371 VAL A O 1 +ATOM 3042 C CB . VAL A 1 371 ? 12.844 33.460 72.926 1.00 36.36 ? 371 VAL A CB 1 +ATOM 3043 C CG1 . VAL A 1 371 ? 14.202 33.981 72.487 1.00 35.45 ? 371 VAL A CG1 1 +ATOM 3044 C CG2 . VAL A 1 371 ? 11.882 33.433 71.725 1.00 36.26 ? 371 VAL A CG2 1 +ATOM 3045 N N . ARG A 1 372 ? 11.204 30.383 73.642 1.00 33.25 ? 372 ARG A N 1 +ATOM 3046 C CA . ARG A 1 372 ? 9.888 29.872 74.002 1.00 31.14 ? 372 ARG A CA 1 +ATOM 3047 C C . ARG A 1 372 ? 9.353 30.174 75.394 1.00 31.94 ? 372 ARG A C 1 +ATOM 3048 O O . ARG A 1 372 ? 8.257 30.737 75.536 1.00 30.65 ? 372 ARG A O 1 +ATOM 3049 C CB . ARG A 1 372 ? 9.824 28.357 73.799 1.00 31.52 ? 372 ARG A CB 1 +ATOM 3050 C CG . ARG A 1 372 ? 8.493 27.751 74.256 1.00 29.36 ? 372 ARG A CG 1 +ATOM 3051 C CD . ARG A 1 372 ? 8.365 26.269 73.915 1.00 31.82 ? 372 ARG A CD 1 +ATOM 3052 N NE . ARG A 1 372 ? 7.138 25.712 74.483 1.00 31.43 ? 372 ARG A NE 1 +ATOM 3053 C CZ . ARG A 1 372 ? 5.917 25.867 73.966 1.00 31.96 ? 372 ARG A CZ 1 +ATOM 3054 N NH1 . ARG A 1 372 ? 5.735 26.554 72.842 1.00 30.86 ? 372 ARG A NH1 1 +ATOM 3055 N NH2 . ARG A 1 372 ? 4.865 25.366 74.603 1.00 29.01 ? 372 ARG A NH2 1 +ATOM 3056 N N . ASN A 1 373 ? 10.113 29.800 76.418 1.00 31.01 ? 373 ASN A N 1 +ATOM 3057 C CA . ASN A 1 373 ? 9.651 29.970 77.781 1.00 30.57 ? 373 ASN A CA 1 +ATOM 3058 C C . ASN A 1 373 ? 9.318 31.378 78.231 1.00 31.53 ? 373 ASN A C 1 +ATOM 3059 O O . ASN A 1 373 ? 8.541 31.563 79.173 1.00 31.98 ? 373 ASN A O 1 +ATOM 3060 C CB . ASN A 1 373 ? 10.642 29.318 78.740 1.00 32.55 ? 373 ASN A CB 1 +ATOM 3061 C CG . ASN A 1 373 ? 10.848 27.850 78.425 1.00 35.18 ? 373 ASN A CG 1 +ATOM 3062 O OD1 . ASN A 1 373 ? 9.928 27.179 77.951 1.00 37.28 ? 373 ASN A OD1 1 +ATOM 3063 N ND2 . ASN A 1 373 ? 12.046 27.339 78.688 1.00 34.77 ? 373 ASN A ND2 1 +ATOM 3064 N N . ALA A 1 374 ? 9.869 32.378 77.556 1.00 31.16 ? 374 ALA A N 1 +ATOM 3065 C CA . ALA A 1 374 ? 9.594 33.751 77.941 1.00 31.33 ? 374 ALA A CA 1 +ATOM 3066 C C . ALA A 1 374 ? 8.294 34.287 77.339 1.00 31.88 ? 374 ALA A C 1 +ATOM 3067 O O . ALA A 1 374 ? 7.849 35.378 77.695 1.00 32.12 ? 374 ALA A O 1 +ATOM 3068 C CB . ALA A 1 374 ? 10.769 34.644 77.549 1.00 31.78 ? 374 ALA A CB 1 +ATOM 3069 N N . TYR A 1 375 ? 7.676 33.519 76.445 1.00 31.27 ? 375 TYR A N 1 +ATOM 3070 C CA . TYR A 1 375 ? 6.433 33.952 75.806 1.00 32.12 ? 375 TYR A CA 1 +ATOM 3071 C C . TYR A 1 375 ? 5.365 34.369 76.820 1.00 32.32 ? 375 TYR A C 1 +ATOM 3072 O O . TYR A 1 375 ? 4.809 35.463 76.737 1.00 32.08 ? 375 TYR A O 1 +ATOM 3073 C CB . TYR A 1 375 ? 5.884 32.844 74.902 1.00 32.92 ? 375 TYR A CB 1 +ATOM 3074 C CG . TYR A 1 375 ? 4.704 33.258 74.049 1.00 31.22 ? 375 TYR A CG 1 +ATOM 3075 C CD1 . TYR A 1 375 ? 4.889 33.810 72.783 1.00 32.87 ? 375 TYR A CD1 1 +ATOM 3076 C CD2 . TYR A 1 375 ? 3.403 33.082 74.505 1.00 32.51 ? 375 TYR A CD2 1 +ATOM 3077 C CE1 . TYR A 1 375 ? 3.798 34.172 71.987 1.00 32.90 ? 375 TYR A CE1 1 +ATOM 3078 C CE2 . TYR A 1 375 ? 2.310 33.439 73.728 1.00 32.75 ? 375 TYR A CE2 1 +ATOM 3079 C CZ . TYR A 1 375 ? 2.509 33.979 72.471 1.00 33.80 ? 375 TYR A CZ 1 +ATOM 3080 O OH . TYR A 1 375 ? 1.411 34.307 71.700 1.00 35.73 ? 375 TYR A OH 1 +ATOM 3081 N N . PRO A 1 376 ? 5.049 33.498 77.786 1.00 33.33 ? 376 PRO A N 1 +ATOM 3082 C CA . PRO A 1 376 ? 4.028 33.886 78.770 1.00 33.80 ? 376 PRO A CA 1 +ATOM 3083 C C . PRO A 1 376 ? 4.431 35.122 79.584 1.00 34.65 ? 376 PRO A C 1 +ATOM 3084 O O . PRO A 1 376 ? 3.567 35.890 80.026 1.00 34.86 ? 376 PRO A O 1 +ATOM 3085 C CB . PRO A 1 376 ? 3.897 32.640 79.641 1.00 32.34 ? 376 PRO A CB 1 +ATOM 3086 C CG . PRO A 1 376 ? 5.287 32.047 79.578 1.00 32.82 ? 376 PRO A CG 1 +ATOM 3087 C CD . PRO A 1 376 ? 5.609 32.172 78.104 1.00 32.99 ? 376 PRO A CD 1 +ATOM 3088 N N . LEU A 1 377 ? 5.737 35.311 79.785 1.00 34.23 ? 377 LEU A N 1 +ATOM 3089 C CA . LEU A 1 377 ? 6.213 36.469 80.545 1.00 34.30 ? 377 LEU A CA 1 +ATOM 3090 C C . LEU A 1 377 ? 5.825 37.765 79.827 1.00 33.05 ? 377 LEU A C 1 +ATOM 3091 O O . LEU A 1 377 ? 5.297 38.690 80.448 1.00 32.89 ? 377 LEU A O 1 +ATOM 3092 C CB . LEU A 1 377 ? 7.735 36.417 80.729 1.00 34.07 ? 377 LEU A CB 1 +ATOM 3093 C CG . LEU A 1 377 ? 8.380 37.682 81.320 1.00 35.18 ? 377 LEU A CG 1 +ATOM 3094 C CD1 . LEU A 1 377 ? 7.916 37.875 82.750 1.00 34.71 ? 377 LEU A CD1 1 +ATOM 3095 C CD2 . LEU A 1 377 ? 9.905 37.562 81.264 1.00 35.52 ? 377 LEU A CD2 1 +ATOM 3096 N N . TYR A 1 378 ? 6.076 37.819 78.523 1.00 31.87 ? 378 TYR A N 1 +ATOM 3097 C CA . TYR A 1 378 ? 5.749 38.998 77.734 1.00 33.71 ? 378 TYR A CA 1 +ATOM 3098 C C . TYR A 1 378 ? 4.247 39.208 77.576 1.00 34.43 ? 378 TYR A C 1 +ATOM 3099 O O . TYR A 1 378 ? 3.788 40.342 77.458 1.00 35.64 ? 378 TYR A O 1 +ATOM 3100 C CB . TYR A 1 378 ? 6.439 38.931 76.370 1.00 33.25 ? 378 TYR A CB 1 +ATOM 3101 C CG . TYR A 1 378 ? 7.914 39.276 76.451 1.00 34.77 ? 378 TYR A CG 1 +ATOM 3102 C CD1 . TYR A 1 378 ? 8.331 40.599 76.605 1.00 36.33 ? 378 TYR A CD1 1 +ATOM 3103 C CD2 . TYR A 1 378 ? 8.887 38.285 76.412 1.00 35.07 ? 378 TYR A CD2 1 +ATOM 3104 C CE1 . TYR A 1 378 ? 9.678 40.925 76.721 1.00 36.70 ? 378 TYR A CE1 1 +ATOM 3105 C CE2 . TYR A 1 378 ? 10.236 38.593 76.528 1.00 36.80 ? 378 TYR A CE2 1 +ATOM 3106 C CZ . TYR A 1 378 ? 10.628 39.915 76.686 1.00 37.81 ? 378 TYR A CZ 1 +ATOM 3107 O OH . TYR A 1 378 ? 11.965 40.213 76.829 1.00 37.02 ? 378 TYR A OH 1 +ATOM 3108 N N . GLU A 1 379 ? 3.473 38.128 77.592 1.00 34.97 ? 379 GLU A N 1 +ATOM 3109 C CA . GLU A 1 379 ? 2.030 38.269 77.476 1.00 35.61 ? 379 GLU A CA 1 +ATOM 3110 C C . GLU A 1 379 ? 1.516 38.870 78.779 1.00 34.88 ? 379 GLU A C 1 +ATOM 3111 O O . GLU A 1 379 ? 0.650 39.751 78.770 1.00 34.97 ? 379 GLU A O 1 +ATOM 3112 C CB . GLU A 1 379 ? 1.351 36.914 77.234 1.00 37.32 ? 379 GLU A CB 1 +ATOM 3113 C CG . GLU A 1 379 ? -0.176 37.009 77.231 1.00 40.12 ? 379 GLU A CG 1 +ATOM 3114 C CD . GLU A 1 379 ? -0.867 35.652 77.303 1.00 44.14 ? 379 GLU A CD 1 +ATOM 3115 O OE1 . GLU A 1 379 ? -0.374 34.766 78.040 1.00 46.51 ? 379 GLU A OE1 1 +ATOM 3116 O OE2 . GLU A 1 379 ? -1.916 35.471 76.637 1.00 44.88 ? 379 GLU A OE2 1 +ATOM 3117 N N . ALA A 1 380 ? 2.046 38.390 79.901 1.00 33.64 ? 380 ALA A N 1 +ATOM 3118 C CA . ALA A 1 380 ? 1.628 38.902 81.208 1.00 33.84 ? 380 ALA A CA 1 +ATOM 3119 C C . ALA A 1 380 ? 2.023 40.371 81.320 1.00 34.22 ? 380 ALA A C 1 +ATOM 3120 O O . ALA A 1 380 ? 1.270 41.184 81.854 1.00 34.79 ? 380 ALA A O 1 +ATOM 3121 C CB . ALA A 1 380 ? 2.274 38.093 82.335 1.00 30.90 ? 380 ALA A CB 1 +ATOM 3122 N N . MET A 1 381 ? 3.210 40.694 80.813 1.00 33.73 ? 381 MET A N 1 +ATOM 3123 C CA . MET A 1 381 ? 3.724 42.060 80.827 1.00 34.90 ? 381 MET A CA 1 +ATOM 3124 C C . MET A 1 381 ? 2.746 43.001 80.108 1.00 34.43 ? 381 MET A C 1 +ATOM 3125 O O . MET A 1 381 ? 2.381 44.059 80.629 1.00 35.89 ? 381 MET A O 1 +ATOM 3126 C CB . MET A 1 381 ? 5.090 42.093 80.132 1.00 35.95 ? 381 MET A CB 1 +ATOM 3127 C CG . MET A 1 381 ? 5.762 43.446 80.124 1.00 36.80 ? 381 MET A CG 1 +ATOM 3128 S SD . MET A 1 381 ? 7.292 43.402 79.185 1.00 42.35 ? 381 MET A SD 1 +ATOM 3129 C CE . MET A 1 381 ? 8.340 42.319 80.238 1.00 40.06 ? 381 MET A CE 1 +ATOM 3130 N N . ALA A 1 382 ? 2.322 42.604 78.912 1.00 33.68 ? 382 ALA A N 1 +ATOM 3131 C CA . ALA A 1 382 ? 1.387 43.394 78.120 1.00 33.24 ? 382 ALA A CA 1 +ATOM 3132 C C . ALA A 1 382 ? 0.034 43.487 78.800 1.00 33.33 ? 382 ALA A C 1 +ATOM 3133 O O . ALA A 1 382 ? -0.648 44.502 78.721 1.00 33.36 ? 382 ALA A O 1 +ATOM 3134 C CB . ALA A 1 382 ? 1.225 42.781 76.743 1.00 33.94 ? 382 ALA A CB 1 +ATOM 3135 N N . THR A 1 383 ? -0.358 42.422 79.479 1.00 33.93 ? 383 THR A N 1 +ATOM 3136 C CA . THR A 1 383 ? -1.645 42.416 80.155 1.00 34.22 ? 383 THR A CA 1 +ATOM 3137 C C . THR A 1 383 ? -1.604 43.334 81.371 1.00 34.83 ? 383 THR A C 1 +ATOM 3138 O O . THR A 1 383 ? -2.590 43.998 81.686 1.00 33.73 ? 383 THR A O 1 +ATOM 3139 C CB . THR A 1 383 ? -2.025 40.987 80.573 1.00 33.02 ? 383 THR A CB 1 +ATOM 3140 O OG1 . THR A 1 383 ? -2.042 40.153 79.406 1.00 34.32 ? 383 THR A OG1 1 +ATOM 3141 C CG2 . THR A 1 383 ? -3.398 40.958 81.217 1.00 31.43 ? 383 THR A CG2 1 +ATOM 3142 N N . PHE A 1 384 ? -0.458 43.363 82.046 1.00 35.30 ? 384 PHE A N 1 +ATOM 3143 C CA . PHE A 1 384 ? -0.267 44.208 83.223 1.00 37.46 ? 384 PHE A CA 1 +ATOM 3144 C C . PHE A 1 384 ? -0.338 45.659 82.745 1.00 38.33 ? 384 PHE A C 1 +ATOM 3145 O O . PHE A 1 384 ? -0.944 46.515 83.384 1.00 36.73 ? 384 PHE A O 1 +ATOM 3146 C CB . PHE A 1 384 ? 1.111 43.945 83.840 1.00 37.90 ? 384 PHE A CB 1 +ATOM 3147 C CG . PHE A 1 384 ? 1.300 44.558 85.196 1.00 36.91 ? 384 PHE A CG 1 +ATOM 3148 C CD1 . PHE A 1 384 ? 0.880 43.892 86.340 1.00 37.82 ? 384 PHE A CD1 1 +ATOM 3149 C CD2 . PHE A 1 384 ? 1.920 45.793 85.331 1.00 38.00 ? 384 PHE A CD2 1 +ATOM 3150 C CE1 . PHE A 1 384 ? 1.080 44.446 87.609 1.00 38.67 ? 384 PHE A CE1 1 +ATOM 3151 C CE2 . PHE A 1 384 ? 2.124 46.357 86.592 1.00 38.03 ? 384 PHE A CE2 1 +ATOM 3152 C CZ . PHE A 1 384 ? 1.704 45.681 87.732 1.00 37.20 ? 384 PHE A CZ 1 +ATOM 3153 N N . LYS A 1 385 ? 0.302 45.916 81.607 1.00 40.47 ? 385 LYS A N 1 +ATOM 3154 C CA . LYS A 1 385 ? 0.315 47.243 81.003 1.00 41.39 ? 385 LYS A CA 1 +ATOM 3155 C C . LYS A 1 385 ? -1.129 47.642 80.675 1.00 41.49 ? 385 LYS A C 1 +ATOM 3156 O O . LYS A 1 385 ? -1.478 48.819 80.675 1.00 42.66 ? 385 LYS A O 1 +ATOM 3157 C CB . LYS A 1 385 ? 1.169 47.211 79.738 1.00 42.49 ? 385 LYS A CB 1 +ATOM 3158 C CG . LYS A 1 385 ? 1.222 48.504 78.959 1.00 45.30 ? 385 LYS A CG 1 +ATOM 3159 C CD . LYS A 1 385 ? 2.007 48.293 77.664 1.00 48.63 ? 385 LYS A CD 1 +ATOM 3160 C CE . LYS A 1 385 ? 1.994 49.544 76.788 1.00 52.80 ? 385 LYS A CE 1 +ATOM 3161 N NZ . LYS A 1 385 ? 2.612 50.734 77.465 1.00 54.44 ? 385 LYS A NZ 1 +ATOM 3162 N N . GLY A 1 386 ? -1.969 46.650 80.409 1.00 39.74 ? 386 GLY A N 1 +ATOM 3163 C CA . GLY A 1 386 ? -3.357 46.930 80.107 1.00 39.06 ? 386 GLY A CA 1 +ATOM 3164 C C . GLY A 1 386 ? -4.090 47.463 81.328 1.00 39.30 ? 386 GLY A C 1 +ATOM 3165 O O . GLY A 1 386 ? -5.032 48.250 81.205 1.00 38.99 ? 386 GLY A O 1 +ATOM 3166 N N . PHE A 1 387 ? -3.678 47.022 82.512 1.00 39.00 ? 387 PHE A N 1 +ATOM 3167 C CA . PHE A 1 387 ? -4.307 47.490 83.740 1.00 40.31 ? 387 PHE A CA 1 +ATOM 3168 C C . PHE A 1 387 ? -3.897 48.938 83.995 1.00 41.84 ? 387 PHE A C 1 +ATOM 3169 O O . PHE A 1 387 ? -4.712 49.748 84.432 1.00 40.52 ? 387 PHE A O 1 +ATOM 3170 C CB . PHE A 1 387 ? -3.905 46.615 84.938 1.00 37.90 ? 387 PHE A CB 1 +ATOM 3171 C CG . PHE A 1 387 ? -4.767 45.393 85.117 1.00 36.99 ? 387 PHE A CG 1 +ATOM 3172 C CD1 . PHE A 1 387 ? -4.620 44.287 84.284 1.00 35.63 ? 387 PHE A CD1 1 +ATOM 3173 C CD2 . PHE A 1 387 ? -5.755 45.364 86.094 1.00 35.06 ? 387 PHE A CD2 1 +ATOM 3174 C CE1 . PHE A 1 387 ? -5.445 43.176 84.423 1.00 34.21 ? 387 PHE A CE1 1 +ATOM 3175 C CE2 . PHE A 1 387 ? -6.584 44.257 86.243 1.00 35.38 ? 387 PHE A CE2 1 +ATOM 3176 C CZ . PHE A 1 387 ? -6.430 43.159 85.404 1.00 35.07 ? 387 PHE A CZ 1 +ATOM 3177 N N . ARG A 1 388 ? -2.629 49.249 83.714 1.00 43.36 ? 388 ARG A N 1 +ATOM 3178 C CA . ARG A 1 388 ? -2.097 50.597 83.890 1.00 45.72 ? 388 ARG A CA 1 +ATOM 3179 C C . ARG A 1 388 ? -2.836 51.554 82.966 1.00 47.10 ? 388 ARG A C 1 +ATOM 3180 O O . ARG A 1 388 ? -3.251 52.635 83.381 1.00 48.58 ? 388 ARG A O 1 +ATOM 3181 C CB . ARG A 1 388 ? -0.605 50.636 83.554 1.00 46.34 ? 388 ARG A CB 1 +ATOM 3182 C CG . ARG A 1 388 ? 0.290 49.832 84.488 1.00 48.60 ? 388 ARG A CG 1 +ATOM 3183 C CD . ARG A 1 388 ? 0.124 50.272 85.932 1.00 51.68 ? 388 ARG A CD 1 +ATOM 3184 N NE . ARG A 1 388 ? 1.259 49.878 86.762 1.00 52.45 ? 388 ARG A NE 1 +ATOM 3185 C CZ . ARG A 1 388 ? 1.203 49.721 88.083 1.00 53.88 ? 388 ARG A CZ 1 +ATOM 3186 N NH1 . ARG A 1 388 ? 0.061 49.921 88.738 1.00 53.30 ? 388 ARG A NH1 1 +ATOM 3187 N NH2 . ARG A 1 388 ? 2.292 49.360 88.752 1.00 54.71 ? 388 ARG A NH2 1 +ATOM 3188 N N . THR A 1 389 ? -2.993 51.146 81.710 1.00 47.89 ? 389 THR A N 1 +ATOM 3189 C CA . THR A 1 389 ? -3.689 51.945 80.707 1.00 47.63 ? 389 THR A CA 1 +ATOM 3190 C C . THR A 1 389 ? -5.099 52.284 81.162 1.00 47.62 ? 389 THR A C 1 +ATOM 3191 O O . THR A 1 389 ? -5.671 53.276 80.728 1.00 49.15 ? 389 THR A O 1 +ATOM 3192 C CB . THR A 1 389 ? -3.765 51.192 79.370 1.00 47.77 ? 389 THR A CB 1 +ATOM 3193 O OG1 . THR A 1 389 ? -2.438 51.004 78.864 1.00 48.94 ? 389 THR A OG1 1 +ATOM 3194 C CG2 . THR A 1 389 ? -4.592 51.967 78.357 1.00 46.16 ? 389 THR A CG2 1 +ATOM 3195 N N . SER A 1 390 ? -5.658 51.455 82.036 1.00 47.54 ? 390 SER A N 1 +ATOM 3196 C CA . SER A 1 390 ? -7.003 51.683 82.550 1.00 48.88 ? 390 SER A CA 1 +ATOM 3197 C C . SER A 1 390 ? -6.969 52.380 83.901 1.00 50.01 ? 390 SER A C 1 +ATOM 3198 O O . SER A 1 390 ? -8.012 52.572 84.530 1.00 49.32 ? 390 SER A O 1 +ATOM 3199 C CB . SER A 1 390 ? -7.755 50.357 82.697 1.00 48.41 ? 390 SER A CB 1 +ATOM 3200 O OG . SER A 1 390 ? -7.995 49.768 81.435 1.00 49.20 ? 390 SER A OG 1 +ATOM 3201 N N . HIS A 1 391 ? -5.772 52.756 84.347 1.00 51.60 ? 391 HIS A N 1 +ATOM 3202 C CA . HIS A 1 391 ? -5.611 53.424 85.636 1.00 53.31 ? 391 HIS A CA 1 +ATOM 3203 C C . HIS A 1 391 ? -6.257 52.568 86.717 1.00 52.89 ? 391 HIS A C 1 +ATOM 3204 O O . HIS A 1 391 ? -6.910 53.074 87.632 1.00 53.20 ? 391 HIS A O 1 +ATOM 3205 C CB . HIS A 1 391 ? -6.270 54.806 85.608 1.00 55.65 ? 391 HIS A CB 1 +ATOM 3206 C CG . HIS A 1 391 ? -5.748 55.696 84.525 1.00 58.70 ? 391 HIS A CG 1 +ATOM 3207 N ND1 . HIS A 1 391 ? -4.421 56.058 84.436 1.00 60.21 ? 391 HIS A ND1 1 +ATOM 3208 C CD2 . HIS A 1 391 ? -6.368 56.272 83.468 1.00 60.24 ? 391 HIS A CD2 1 +ATOM 3209 C CE1 . HIS A 1 391 ? -4.244 56.817 83.369 1.00 61.03 ? 391 HIS A CE1 1 +ATOM 3210 N NE2 . HIS A 1 391 ? -5.410 56.962 82.764 1.00 61.82 ? 391 HIS A NE2 1 +ATOM 3211 N N . ARG A 1 392 ? -6.074 51.259 86.588 1.00 51.64 ? 392 ARG A N 1 +ATOM 3212 C CA . ARG A 1 392 ? -6.622 50.297 87.532 1.00 50.34 ? 392 ARG A CA 1 +ATOM 3213 C C . ARG A 1 392 ? -5.527 49.983 88.548 1.00 50.40 ? 392 ARG A C 1 +ATOM 3214 O O . ARG A 1 392 ? -4.501 49.409 88.197 1.00 51.59 ? 392 ARG A O 1 +ATOM 3215 C CB . ARG A 1 392 ? -7.020 49.035 86.772 1.00 49.41 ? 392 ARG A CB 1 +ATOM 3216 C CG . ARG A 1 392 ? -7.975 48.140 87.492 1.00 47.00 ? 392 ARG A CG 1 +ATOM 3217 C CD . ARG A 1 392 ? -9.322 48.795 87.611 1.00 45.60 ? 392 ARG A CD 1 +ATOM 3218 N NE . ARG A 1 392 ? -10.374 47.822 87.367 1.00 46.78 ? 392 ARG A NE 1 +ATOM 3219 C CZ . ARG A 1 392 ? -11.004 47.677 86.211 1.00 45.36 ? 392 ARG A CZ 1 +ATOM 3220 N NH1 . ARG A 1 392 ? -10.697 48.450 85.190 1.00 49.12 ? 392 ARG A NH1 1 +ATOM 3221 N NH2 . ARG A 1 392 ? -11.938 46.755 86.074 1.00 47.70 ? 392 ARG A NH2 1 +ATOM 3222 N N . ASN A 1 393 ? -5.735 50.364 89.801 1.00 50.54 ? 393 ASN A N 1 +ATOM 3223 C CA . ASN A 1 393 ? -4.730 50.118 90.832 1.00 51.25 ? 393 ASN A CA 1 +ATOM 3224 C C . ASN A 1 393 ? -4.787 48.695 91.385 1.00 49.50 ? 393 ASN A C 1 +ATOM 3225 O O . ASN A 1 393 ? -3.759 48.127 91.766 1.00 48.16 ? 393 ASN A O 1 +ATOM 3226 C CB . ASN A 1 393 ? -4.892 51.127 91.969 1.00 54.80 ? 393 ASN A CB 1 +ATOM 3227 C CG . ASN A 1 393 ? -4.873 52.558 91.470 1.00 58.36 ? 393 ASN A CG 1 +ATOM 3228 O OD1 . ASN A 1 393 ? -3.894 53.001 90.858 1.00 59.53 ? 393 ASN A OD1 1 +ATOM 3229 N ND2 . ASN A 1 393 ? -5.961 53.289 91.717 1.00 58.87 ? 393 ASN A ND2 1 +ATOM 3230 N N . GLU A 1 394 ? -5.990 48.132 91.442 1.00 47.06 ? 394 GLU A N 1 +ATOM 3231 C CA . GLU A 1 394 ? -6.163 46.773 91.925 1.00 45.74 ? 394 GLU A CA 1 +ATOM 3232 C C . GLU A 1 394 ? -5.990 45.860 90.719 1.00 44.47 ? 394 GLU A C 1 +ATOM 3233 O O . GLU A 1 394 ? -6.882 45.728 89.877 1.00 42.55 ? 394 GLU A O 1 +ATOM 3234 C CB . GLU A 1 394 ? -7.555 46.585 92.535 1.00 47.58 ? 394 GLU A CB 1 +ATOM 3235 C CG . GLU A 1 394 ? -7.900 47.608 93.602 1.00 49.29 ? 394 GLU A CG 1 +ATOM 3236 C CD . GLU A 1 394 ? -9.053 47.172 94.484 1.00 51.59 ? 394 GLU A CD 1 +ATOM 3237 O OE1 . GLU A 1 394 ? -10.074 46.691 93.950 1.00 52.73 ? 394 GLU A OE1 1 +ATOM 3238 O OE2 . GLU A 1 394 ? -8.941 47.317 95.721 1.00 54.26 ? 394 GLU A OE2 1 +ATOM 3239 N N . ILE A 1 395 ? -4.820 45.243 90.637 1.00 43.46 ? 395 ILE A N 1 +ATOM 3240 C CA . ILE A 1 395 ? -4.492 44.359 89.531 1.00 41.98 ? 395 ILE A CA 1 +ATOM 3241 C C . ILE A 1 395 ? -4.548 42.876 89.901 1.00 41.01 ? 395 ILE A C 1 +ATOM 3242 O O . ILE A 1 395 ? -4.056 42.461 90.957 1.00 40.90 ? 395 ILE A O 1 +ATOM 3243 C CB . ILE A 1 395 ? -3.087 44.674 89.002 1.00 41.00 ? 395 ILE A CB 1 +ATOM 3244 C CG1 . ILE A 1 395 ? -3.035 46.138 88.553 1.00 40.93 ? 395 ILE A CG1 1 +ATOM 3245 C CG2 . ILE A 1 395 ? -2.718 43.712 87.881 1.00 39.74 ? 395 ILE A CG2 1 +ATOM 3246 C CD1 . ILE A 1 395 ? -1.658 46.601 88.092 1.00 39.83 ? 395 ILE A CD1 1 +ATOM 3247 N N . PHE A 1 396 ? -5.177 42.090 89.036 1.00 39.44 ? 396 PHE A N 1 +ATOM 3248 C CA . PHE A 1 396 ? -5.254 40.651 89.238 1.00 38.23 ? 396 PHE A CA 1 +ATOM 3249 C C . PHE A 1 396 ? -5.060 39.914 87.927 1.00 36.92 ? 396 PHE A C 1 +ATOM 3250 O O . PHE A 1 396 ? -5.879 40.014 87.004 1.00 34.70 ? 396 PHE A O 1 +ATOM 3251 C CB . PHE A 1 396 ? -6.584 40.201 89.832 1.00 40.06 ? 396 PHE A CB 1 +ATOM 3252 C CG . PHE A 1 396 ? -6.643 38.722 90.048 1.00 40.12 ? 396 PHE A CG 1 +ATOM 3253 C CD1 . PHE A 1 396 ? -5.940 38.135 91.094 1.00 40.45 ? 396 PHE A CD1 1 +ATOM 3254 C CD2 . PHE A 1 396 ? -7.289 37.900 89.134 1.00 42.11 ? 396 PHE A CD2 1 +ATOM 3255 C CE1 . PHE A 1 396 ? -5.874 36.749 91.223 1.00 40.50 ? 396 PHE A CE1 1 +ATOM 3256 C CE2 . PHE A 1 396 ? -7.228 36.511 89.251 1.00 40.99 ? 396 PHE A CE2 1 +ATOM 3257 C CZ . PHE A 1 396 ? -6.515 35.937 90.299 1.00 40.54 ? 396 PHE A CZ 1 +ATOM 3258 N N . ILE A 1 397 ? -3.959 39.178 87.851 1.00 35.85 ? 397 ILE A N 1 +ATOM 3259 C CA . ILE A 1 397 ? -3.646 38.403 86.663 1.00 33.77 ? 397 ILE A CA 1 +ATOM 3260 C C . ILE A 1 397 ? -3.210 36.998 87.082 1.00 34.96 ? 397 ILE A C 1 +ATOM 3261 O O . ILE A 1 397 ? -2.363 36.825 87.963 1.00 33.58 ? 397 ILE A O 1 +ATOM 3262 C CB . ILE A 1 397 ? -2.529 39.060 85.847 1.00 31.82 ? 397 ILE A CB 1 +ATOM 3263 C CG1 . ILE A 1 397 ? -2.950 40.476 85.441 1.00 29.79 ? 397 ILE A CG1 1 +ATOM 3264 C CG2 . ILE A 1 397 ? -2.214 38.211 84.623 1.00 30.85 ? 397 ILE A CG2 1 +ATOM 3265 C CD1 . ILE A 1 397 ? -1.884 41.228 84.679 1.00 27.57 ? 397 ILE A CD1 1 +ATOM 3266 N N . LEU A 1 398 ? -3.826 36.001 86.457 1.00 35.17 ? 398 LEU A N 1 +ATOM 3267 C CA . LEU A 1 398 ? -3.536 34.601 86.721 1.00 34.03 ? 398 LEU A CA 1 +ATOM 3268 C C . LEU A 1 398 ? -2.939 34.072 85.430 1.00 33.78 ? 398 LEU A C 1 +ATOM 3269 O O . LEU A 1 398 ? -3.464 34.342 84.350 1.00 33.89 ? 398 LEU A O 1 +ATOM 3270 C CB . LEU A 1 398 ? -4.832 33.851 87.013 1.00 35.19 ? 398 LEU A CB 1 +ATOM 3271 C CG . LEU A 1 398 ? -4.875 32.713 88.046 1.00 39.33 ? 398 LEU A CG 1 +ATOM 3272 C CD1 . LEU A 1 398 ? -5.962 31.712 87.624 1.00 38.00 ? 398 LEU A CD1 1 +ATOM 3273 C CD2 . LEU A 1 398 ? -3.529 32.002 88.156 1.00 37.18 ? 398 LEU A CD2 1 +ATOM 3274 N N . SER A 1 399 ? -1.836 33.340 85.528 1.00 33.60 ? 399 SER A N 1 +ATOM 3275 C CA . SER A 1 399 ? -1.206 32.771 84.343 1.00 31.26 ? 399 SER A CA 1 +ATOM 3276 C C . SER A 1 399 ? -0.912 31.288 84.583 1.00 32.95 ? 399 SER A C 1 +ATOM 3277 O O . SER A 1 399 ? -0.689 30.860 85.725 1.00 33.22 ? 399 SER A O 1 +ATOM 3278 C CB . SER A 1 399 ? 0.085 33.508 84.024 1.00 30.82 ? 399 SER A CB 1 +ATOM 3279 O OG . SER A 1 399 ? 0.719 32.956 82.881 1.00 32.34 ? 399 SER A OG 1 +ATOM 3280 N N . ARG A 1 400 ? -0.933 30.495 83.516 1.00 32.46 ? 400 ARG A N 1 +ATOM 3281 C CA . ARG A 1 400 ? -0.644 29.080 83.667 1.00 32.48 ? 400 ARG A CA 1 +ATOM 3282 C C . ARG A 1 400 ? 0.849 28.838 83.476 1.00 32.60 ? 400 ARG A C 1 +ATOM 3283 O O . ARG A 1 400 ? 1.476 28.120 84.257 1.00 32.89 ? 400 ARG A O 1 +ATOM 3284 C CB . ARG A 1 400 ? -1.434 28.250 82.664 1.00 33.27 ? 400 ARG A CB 1 +ATOM 3285 C CG . ARG A 1 400 ? -1.411 26.772 82.992 1.00 34.00 ? 400 ARG A CG 1 +ATOM 3286 C CD . ARG A 1 400 ? -2.448 25.993 82.186 1.00 36.80 ? 400 ARG A CD 1 +ATOM 3287 N NE . ARG A 1 400 ? -2.029 25.802 80.803 1.00 38.63 ? 400 ARG A NE 1 +ATOM 3288 C CZ . ARG A 1 400 ? -2.636 24.985 79.948 1.00 41.05 ? 400 ARG A CZ 1 +ATOM 3289 N NH1 . ARG A 1 400 ? -3.698 24.283 80.337 1.00 39.33 ? 400 ARG A NH1 1 +ATOM 3290 N NH2 . ARG A 1 400 ? -2.169 24.856 78.706 1.00 41.06 ? 400 ARG A NH2 1 +ATOM 3291 N N . ALA A 1 401 ? 1.417 29.444 82.441 1.00 30.76 ? 401 ALA A N 1 +ATOM 3292 C CA . ALA A 1 401 ? 2.831 29.285 82.162 1.00 31.12 ? 401 ALA A CA 1 +ATOM 3293 C C . ALA A 1 401 ? 3.634 30.465 82.709 1.00 32.43 ? 401 ALA A C 1 +ATOM 3294 O O . ALA A 1 401 ? 3.071 31.458 83.176 1.00 32.83 ? 401 ALA A O 1 +ATOM 3295 C CB . ALA A 1 401 ? 3.052 29.165 80.669 1.00 30.55 ? 401 ALA A CB 1 +ATOM 3296 N N . GLY A 1 402 ? 4.955 30.355 82.644 1.00 32.10 ? 402 GLY A N 1 +ATOM 3297 C CA . GLY A 1 402 ? 5.783 31.429 83.135 1.00 32.38 ? 402 GLY A CA 1 +ATOM 3298 C C . GLY A 1 402 ? 7.261 31.205 82.918 1.00 32.50 ? 402 GLY A C 1 +ATOM 3299 O O . GLY A 1 402 ? 7.698 30.152 82.448 1.00 32.72 ? 402 GLY A O 1 +ATOM 3300 N N . TYR A 1 403 ? 8.027 32.229 83.265 1.00 33.06 ? 403 TYR A N 1 +ATOM 3301 C CA . TYR A 1 403 ? 9.479 32.225 83.149 1.00 33.17 ? 403 TYR A CA 1 +ATOM 3302 C C . TYR A 1 403 ? 9.962 33.144 84.265 1.00 33.89 ? 403 TYR A C 1 +ATOM 3303 O O . TYR A 1 403 ? 9.147 33.814 84.915 1.00 32.26 ? 403 TYR A O 1 +ATOM 3304 C CB . TYR A 1 403 ? 9.893 32.790 81.792 1.00 30.95 ? 403 TYR A CB 1 +ATOM 3305 C CG . TYR A 1 403 ? 11.378 32.863 81.574 1.00 29.23 ? 403 TYR A CG 1 +ATOM 3306 C CD1 . TYR A 1 403 ? 12.150 31.710 81.510 1.00 31.01 ? 403 TYR A CD1 1 +ATOM 3307 C CD2 . TYR A 1 403 ? 12.016 34.085 81.444 1.00 30.24 ? 403 TYR A CD2 1 +ATOM 3308 C CE1 . TYR A 1 403 ? 13.528 31.769 81.326 1.00 30.75 ? 403 TYR A CE1 1 +ATOM 3309 C CE2 . TYR A 1 403 ? 13.394 34.160 81.255 1.00 31.08 ? 403 TYR A CE2 1 +ATOM 3310 C CZ . TYR A 1 403 ? 14.144 33.001 81.199 1.00 31.50 ? 403 TYR A CZ 1 +ATOM 3311 O OH . TYR A 1 403 ? 15.510 33.067 81.029 1.00 33.50 ? 403 TYR A OH 1 +ATOM 3312 N N . ALA A 1 404 ? 11.270 33.171 84.500 1.00 35.26 ? 404 ALA A N 1 +ATOM 3313 C CA . ALA A 1 404 ? 11.822 34.048 85.533 1.00 36.91 ? 404 ALA A CA 1 +ATOM 3314 C C . ALA A 1 404 ? 11.294 35.470 85.303 1.00 37.46 ? 404 ALA A C 1 +ATOM 3315 O O . ALA A 1 404 ? 11.301 35.972 84.176 1.00 39.29 ? 404 ALA A O 1 +ATOM 3316 C CB . ALA A 1 404 ? 13.343 34.034 85.469 1.00 37.19 ? 404 ALA A CB 1 +ATOM 3317 N N . GLY A 1 405 ? 10.817 36.109 86.363 1.00 37.51 ? 405 GLY A N 1 +ATOM 3318 C CA . GLY A 1 405 ? 10.289 37.456 86.228 1.00 36.48 ? 405 GLY A CA 1 +ATOM 3319 C C . GLY A 1 405 ? 8.772 37.509 86.172 1.00 36.60 ? 405 GLY A C 1 +ATOM 3320 O O . GLY A 1 405 ? 8.173 38.570 86.369 1.00 35.80 ? 405 GLY A O 1 +ATOM 3321 N N . ILE A 1 406 ? 8.144 36.366 85.912 1.00 36.49 ? 406 ILE A N 1 +ATOM 3322 C CA . ILE A 1 406 ? 6.689 36.310 85.821 1.00 35.81 ? 406 ILE A CA 1 +ATOM 3323 C C . ILE A 1 406 ? 6.049 36.843 87.107 1.00 35.74 ? 406 ILE A C 1 +ATOM 3324 O O . ILE A 1 406 ? 4.916 37.342 87.082 1.00 33.74 ? 406 ILE A O 1 +ATOM 3325 C CB . ILE A 1 406 ? 6.194 34.851 85.549 1.00 36.64 ? 406 ILE A CB 1 +ATOM 3326 C CG1 . ILE A 1 406 ? 4.696 34.849 85.242 1.00 35.85 ? 406 ILE A CG1 1 +ATOM 3327 C CG2 . ILE A 1 406 ? 6.459 33.962 86.757 1.00 34.62 ? 406 ILE A CG2 1 +ATOM 3328 C CD1 . ILE A 1 406 ? 4.345 35.480 83.928 1.00 34.18 ? 406 ILE A CD1 1 +ATOM 3329 N N . GLN A 1 407 ? 6.779 36.762 88.224 1.00 34.98 ? 407 GLN A N 1 +ATOM 3330 C CA . GLN A 1 407 ? 6.242 37.241 89.507 1.00 34.17 ? 407 GLN A CA 1 +ATOM 3331 C C . GLN A 1 407 ? 5.931 38.739 89.495 1.00 33.74 ? 407 GLN A C 1 +ATOM 3332 O O . GLN A 1 407 ? 5.157 39.212 90.329 1.00 33.64 ? 407 GLN A O 1 +ATOM 3333 C CB . GLN A 1 407 ? 7.191 36.911 90.677 1.00 33.66 ? 407 GLN A CB 1 +ATOM 3334 C CG . GLN A 1 407 ? 8.501 37.687 90.704 1.00 34.66 ? 407 GLN A CG 1 +ATOM 3335 C CD . GLN A 1 407 ? 9.567 37.088 89.816 1.00 35.77 ? 407 GLN A CD 1 +ATOM 3336 O OE1 . GLN A 1 407 ? 9.319 36.133 89.084 1.00 39.41 ? 407 GLN A OE1 1 +ATOM 3337 N NE2 . GLN A 1 407 ? 10.763 37.650 89.875 1.00 36.26 ? 407 GLN A NE2 1 +ATOM 3338 N N . ARG A 1 408 ? 6.525 39.479 88.552 1.00 33.54 ? 408 ARG A N 1 +ATOM 3339 C CA . ARG A 1 408 ? 6.266 40.917 88.430 1.00 33.62 ? 408 ARG A CA 1 +ATOM 3340 C C . ARG A 1 408 ? 4.820 41.165 88.045 1.00 35.25 ? 408 ARG A C 1 +ATOM 3341 O O . ARG A 1 408 ? 4.251 42.189 88.401 1.00 37.88 ? 408 ARG A O 1 +ATOM 3342 C CB . ARG A 1 408 ? 7.061 41.573 87.294 1.00 31.05 ? 408 ARG A CB 1 +ATOM 3343 C CG . ARG A 1 408 ? 8.555 41.482 87.307 1.00 32.26 ? 408 ARG A CG 1 +ATOM 3344 C CD . ARG A 1 408 ? 9.049 42.011 85.973 1.00 32.55 ? 408 ARG A CD 1 +ATOM 3345 N NE . ARG A 1 408 ? 10.502 42.066 85.864 1.00 33.22 ? 408 ARG A NE 1 +ATOM 3346 C CZ . ARG A 1 408 ? 11.143 42.523 84.791 1.00 35.09 ? 408 ARG A CZ 1 +ATOM 3347 N NH1 . ARG A 1 408 ? 10.454 42.963 83.735 1.00 33.49 ? 408 ARG A NH1 1 +ATOM 3348 N NH2 . ARG A 1 408 ? 12.471 42.544 84.769 1.00 34.25 ? 408 ARG A NH2 1 +ATOM 3349 N N . TYR A 1 409 ? 4.228 40.235 87.299 1.00 36.28 ? 409 TYR A N 1 +ATOM 3350 C CA . TYR A 1 409 ? 2.887 40.464 86.788 1.00 35.72 ? 409 TYR A CA 1 +ATOM 3351 C C . TYR A 1 409 ? 1.754 39.528 87.117 1.00 36.07 ? 409 TYR A C 1 +ATOM 3352 O O . TYR A 1 409 ? 0.598 39.890 86.882 1.00 37.48 ? 409 TYR A O 1 +ATOM 3353 C CB . TYR A 1 409 ? 2.954 40.565 85.267 1.00 35.27 ? 409 TYR A CB 1 +ATOM 3354 C CG . TYR A 1 409 ? 4.156 41.311 84.747 1.00 35.28 ? 409 TYR A CG 1 +ATOM 3355 C CD1 . TYR A 1 409 ? 4.296 42.686 84.961 1.00 35.70 ? 409 TYR A CD1 1 +ATOM 3356 C CD2 . TYR A 1 409 ? 5.163 40.643 84.047 1.00 33.72 ? 409 TYR A CD2 1 +ATOM 3357 C CE1 . TYR A 1 409 ? 5.411 43.378 84.490 1.00 35.25 ? 409 TYR A CE1 1 +ATOM 3358 C CE2 . TYR A 1 409 ? 6.279 41.326 83.572 1.00 35.40 ? 409 TYR A CE2 1 +ATOM 3359 C CZ . TYR A 1 409 ? 6.396 42.695 83.800 1.00 35.66 ? 409 TYR A CZ 1 +ATOM 3360 O OH . TYR A 1 409 ? 7.504 43.373 83.345 1.00 38.81 ? 409 TYR A OH 1 +ATOM 3361 N N . ALA A 1 410 ? 2.025 38.341 87.647 1.00 36.21 ? 410 ALA A N 1 +ATOM 3362 C CA . ALA A 1 410 ? 0.896 37.459 87.877 1.00 35.88 ? 410 ALA A CA 1 +ATOM 3363 C C . ALA A 1 410 ? 0.995 36.362 88.910 1.00 35.88 ? 410 ALA A C 1 +ATOM 3364 O O . ALA A 1 410 ? 2.070 36.013 89.383 1.00 35.58 ? 410 ALA A O 1 +ATOM 3365 C CB . ALA A 1 410 ? 0.487 36.833 86.535 1.00 35.39 ? 410 ALA A CB 1 +ATOM 3366 N N . PHE A 1 411 ? -0.179 35.830 89.240 1.00 36.29 ? 411 PHE A N 1 +ATOM 3367 C CA . PHE A 1 411 ? -0.334 34.695 90.137 1.00 36.13 ? 411 PHE A CA 1 +ATOM 3368 C C . PHE A 1 411 ? -0.152 33.503 89.194 1.00 35.04 ? 411 PHE A C 1 +ATOM 3369 O O . PHE A 1 411 ? -0.348 33.620 87.983 1.00 33.60 ? 411 PHE A O 1 +ATOM 3370 C CB . PHE A 1 411 ? -1.765 34.603 90.672 1.00 37.18 ? 411 PHE A CB 1 +ATOM 3371 C CG . PHE A 1 411 ? -2.036 35.425 91.885 1.00 39.29 ? 411 PHE A CG 1 +ATOM 3372 C CD1 . PHE A 1 411 ? -1.836 36.799 91.881 1.00 40.15 ? 411 PHE A CD1 1 +ATOM 3373 C CD2 . PHE A 1 411 ? -2.547 34.822 93.033 1.00 42.41 ? 411 PHE A CD2 1 +ATOM 3374 C CE1 . PHE A 1 411 ? -2.145 37.564 93.006 1.00 40.58 ? 411 PHE A CE1 1 +ATOM 3375 C CE2 . PHE A 1 411 ? -2.860 35.583 94.166 1.00 43.16 ? 411 PHE A CE2 1 +ATOM 3376 C CZ . PHE A 1 411 ? -2.657 36.956 94.149 1.00 40.53 ? 411 PHE A CZ 1 +ATOM 3377 N N . ILE A 1 412 ? 0.208 32.356 89.743 1.00 35.85 ? 412 ILE A N 1 +ATOM 3378 C CA . ILE A 1 412 ? 0.343 31.156 88.936 1.00 34.94 ? 412 ILE A CA 1 +ATOM 3379 C C . ILE A 1 412 ? -0.367 30.034 89.669 1.00 35.50 ? 412 ILE A C 1 +ATOM 3380 O O . ILE A 1 412 ? -0.209 29.881 90.887 1.00 36.41 ? 412 ILE A O 1 +ATOM 3381 C CB . ILE A 1 412 ? 1.819 30.777 88.707 1.00 34.47 ? 412 ILE A CB 1 +ATOM 3382 C CG1 . ILE A 1 412 ? 2.436 31.743 87.698 1.00 36.35 ? 412 ILE A CG1 1 +ATOM 3383 C CG2 . ILE A 1 412 ? 1.929 29.355 88.191 1.00 33.28 ? 412 ILE A CG2 1 +ATOM 3384 C CD1 . ILE A 1 412 ? 3.804 31.350 87.226 1.00 37.51 ? 412 ILE A CD1 1 +ATOM 3385 N N . TRP A 1 413 ? -1.191 29.283 88.947 1.00 34.26 ? 413 TRP A N 1 +ATOM 3386 C CA . TRP A 1 413 ? -1.867 28.148 89.557 1.00 34.00 ? 413 TRP A CA 1 +ATOM 3387 C C . TRP A 1 413 ? -1.316 26.923 88.821 1.00 33.96 ? 413 TRP A C 1 +ATOM 3388 O O . TRP A 1 413 ? -0.854 27.032 87.677 1.00 32.85 ? 413 TRP A O 1 +ATOM 3389 C CB . TRP A 1 413 ? -3.396 28.294 89.449 1.00 33.04 ? 413 TRP A CB 1 +ATOM 3390 C CG . TRP A 1 413 ? -4.050 27.543 88.343 1.00 35.39 ? 413 TRP A CG 1 +ATOM 3391 C CD1 . TRP A 1 413 ? -4.693 26.340 88.434 1.00 34.10 ? 413 TRP A CD1 1 +ATOM 3392 C CD2 . TRP A 1 413 ? -4.150 27.954 86.977 1.00 34.07 ? 413 TRP A CD2 1 +ATOM 3393 N NE1 . TRP A 1 413 ? -5.192 25.981 87.206 1.00 35.38 ? 413 TRP A NE1 1 +ATOM 3394 C CE2 . TRP A 1 413 ? -4.871 26.954 86.294 1.00 34.92 ? 413 TRP A CE2 1 +ATOM 3395 C CE3 . TRP A 1 413 ? -3.697 29.072 86.264 1.00 35.30 ? 413 TRP A CE3 1 +ATOM 3396 C CZ2 . TRP A 1 413 ? -5.153 27.036 84.928 1.00 36.14 ? 413 TRP A CZ2 1 +ATOM 3397 C CZ3 . TRP A 1 413 ? -3.975 29.157 84.904 1.00 36.83 ? 413 TRP A CZ3 1 +ATOM 3398 C CH2 . TRP A 1 413 ? -4.699 28.142 84.250 1.00 36.16 ? 413 TRP A CH2 1 +ATOM 3399 N N . THR A 1 414 ? -1.352 25.768 89.477 1.00 34.30 ? 414 THR A N 1 +ATOM 3400 C CA . THR A 1 414 ? -0.779 24.541 88.923 1.00 34.29 ? 414 THR A CA 1 +ATOM 3401 C C . THR A 1 414 ? -1.509 23.771 87.822 1.00 34.22 ? 414 THR A C 1 +ATOM 3402 O O . THR A 1 414 ? -1.300 22.570 87.670 1.00 34.79 ? 414 THR A O 1 +ATOM 3403 C CB . THR A 1 414 ? -0.456 23.568 90.057 1.00 34.49 ? 414 THR A CB 1 +ATOM 3404 O OG1 . THR A 1 414 ? -1.663 23.245 90.756 1.00 35.58 ? 414 THR A OG1 1 +ATOM 3405 C CG2 . THR A 1 414 ? 0.514 24.211 91.034 1.00 31.49 ? 414 THR A CG2 1 +ATOM 3406 N N . GLY A 1 415 ? -2.357 24.445 87.059 1.00 33.62 ? 415 GLY A N 1 +ATOM 3407 C CA . GLY A 1 415 ? -3.038 23.776 85.966 1.00 35.17 ? 415 GLY A CA 1 +ATOM 3408 C C . GLY A 1 415 ? -4.041 22.674 86.250 1.00 36.15 ? 415 GLY A C 1 +ATOM 3409 O O . GLY A 1 415 ? -4.677 22.652 87.303 1.00 35.99 ? 415 GLY A O 1 +ATOM 3410 N N . ASP A 1 416 ? -4.152 21.745 85.296 1.00 37.32 ? 416 ASP A N 1 +ATOM 3411 C CA . ASP A 1 416 ? -5.109 20.630 85.343 1.00 37.68 ? 416 ASP A CA 1 +ATOM 3412 C C . ASP A 1 416 ? -4.775 19.408 86.209 1.00 37.48 ? 416 ASP A C 1 +ATOM 3413 O O . ASP A 1 416 ? -4.501 18.326 85.688 1.00 38.86 ? 416 ASP A O 1 +ATOM 3414 C CB . ASP A 1 416 ? -5.395 20.148 83.913 1.00 39.06 ? 416 ASP A CB 1 +ATOM 3415 C CG . ASP A 1 416 ? -5.780 21.288 82.967 1.00 41.00 ? 416 ASP A CG 1 +ATOM 3416 O OD1 . ASP A 1 416 ? -6.263 22.349 83.428 1.00 40.29 ? 416 ASP A OD1 1 +ATOM 3417 O OD2 . ASP A 1 416 ? -5.610 21.110 81.745 1.00 43.15 ? 416 ASP A OD2 1 +ATOM 3418 N N . ASN A 1 417 ? -4.840 19.563 87.523 1.00 35.32 ? 417 ASN A N 1 +ATOM 3419 C CA . ASN A 1 417 ? -4.545 18.451 88.409 1.00 35.09 ? 417 ASN A CA 1 +ATOM 3420 C C . ASN A 1 417 ? -5.700 17.444 88.466 1.00 34.34 ? 417 ASN A C 1 +ATOM 3421 O O . ASN A 1 417 ? -6.829 17.748 88.075 1.00 31.40 ? 417 ASN A O 1 +ATOM 3422 C CB . ASN A 1 417 ? -4.212 18.976 89.815 1.00 35.05 ? 417 ASN A CB 1 +ATOM 3423 C CG . ASN A 1 417 ? -5.379 19.704 90.465 1.00 36.40 ? 417 ASN A CG 1 +ATOM 3424 O OD1 . ASN A 1 417 ? -6.165 20.369 89.794 1.00 38.24 ? 417 ASN A OD1 1 +ATOM 3425 N ND2 . ASN A 1 417 ? -5.480 19.596 91.780 1.00 38.20 ? 417 ASN A ND2 1 +ATOM 3426 N N . THR A 1 418 ? -5.390 16.244 88.957 1.00 34.74 ? 418 THR A N 1 +ATOM 3427 C CA . THR A 1 418 ? -6.350 15.154 89.083 1.00 33.72 ? 418 THR A CA 1 +ATOM 3428 C C . THR A 1 418 ? -6.680 14.887 90.550 1.00 34.58 ? 418 THR A C 1 +ATOM 3429 O O . THR A 1 418 ? -5.783 14.674 91.360 1.00 35.17 ? 418 THR A O 1 +ATOM 3430 C CB . THR A 1 418 ? -5.785 13.834 88.493 1.00 33.26 ? 418 THR A CB 1 +ATOM 3431 O OG1 . THR A 1 418 ? -5.540 13.987 87.090 1.00 32.90 ? 418 THR A OG1 1 +ATOM 3432 C CG2 . THR A 1 418 ? -6.760 12.690 88.708 1.00 32.32 ? 418 THR A CG2 1 +ATOM 3433 N N . PRO A 1 419 ? -7.976 14.873 90.904 1.00 33.50 ? 419 PRO A N 1 +ATOM 3434 C CA . PRO A 1 419 ? -8.387 14.619 92.287 1.00 33.43 ? 419 PRO A CA 1 +ATOM 3435 C C . PRO A 1 419 ? -7.965 13.216 92.735 1.00 34.22 ? 419 PRO A C 1 +ATOM 3436 O O . PRO A 1 419 ? -8.342 12.216 92.116 1.00 34.03 ? 419 PRO A O 1 +ATOM 3437 C CB . PRO A 1 419 ? -9.914 14.733 92.234 1.00 31.87 ? 419 PRO A CB 1 +ATOM 3438 C CG . PRO A 1 419 ? -10.174 15.557 91.018 1.00 34.39 ? 419 PRO A CG 1 +ATOM 3439 C CD . PRO A 1 419 ? -9.143 15.097 90.036 1.00 33.30 ? 419 PRO A CD 1 +ATOM 3440 N N . SER A 1 420 ? -7.191 13.144 93.807 1.00 34.75 ? 420 SER A N 1 +ATOM 3441 C CA . SER A 1 420 ? -6.754 11.861 94.356 1.00 35.93 ? 420 SER A CA 1 +ATOM 3442 C C . SER A 1 420 ? -5.946 12.128 95.609 1.00 36.21 ? 420 SER A C 1 +ATOM 3443 O O . SER A 1 420 ? -5.390 13.216 95.775 1.00 36.47 ? 420 SER A O 1 +ATOM 3444 C CB . SER A 1 420 ? -5.882 11.096 93.360 1.00 36.03 ? 420 SER A CB 1 +ATOM 3445 O OG . SER A 1 420 ? -4.547 11.574 93.377 1.00 37.74 ? 420 SER A OG 1 +ATOM 3446 N N . TRP A 1 421 ? -5.873 11.140 96.492 1.00 36.98 ? 421 TRP A N 1 +ATOM 3447 C CA . TRP A 1 421 ? -5.116 11.317 97.720 1.00 38.26 ? 421 TRP A CA 1 +ATOM 3448 C C . TRP A 1 421 ? -3.644 11.615 97.446 1.00 40.16 ? 421 TRP A C 1 +ATOM 3449 O O . TRP A 1 421 ? -3.033 12.424 98.141 1.00 42.47 ? 421 TRP A O 1 +ATOM 3450 C CB . TRP A 1 421 ? -5.278 10.102 98.632 1.00 35.23 ? 421 TRP A CB 1 +ATOM 3451 C CG . TRP A 1 421 ? -6.654 10.035 99.208 1.00 35.18 ? 421 TRP A CG 1 +ATOM 3452 C CD1 . TRP A 1 421 ? -7.727 9.363 98.696 1.00 36.14 ? 421 TRP A CD1 1 +ATOM 3453 C CD2 . TRP A 1 421 ? -7.136 10.738 100.359 1.00 34.63 ? 421 TRP A CD2 1 +ATOM 3454 N NE1 . TRP A 1 421 ? -8.849 9.606 99.456 1.00 34.48 ? 421 TRP A NE1 1 +ATOM 3455 C CE2 . TRP A 1 421 ? -8.515 10.444 100.483 1.00 32.71 ? 421 TRP A CE2 1 +ATOM 3456 C CE3 . TRP A 1 421 ? -6.538 11.589 101.297 1.00 35.33 ? 421 TRP A CE3 1 +ATOM 3457 C CZ2 . TRP A 1 421 ? -9.307 10.967 101.507 1.00 33.32 ? 421 TRP A CZ2 1 +ATOM 3458 C CZ3 . TRP A 1 421 ? -7.329 12.113 102.324 1.00 36.07 ? 421 TRP A CZ3 1 +ATOM 3459 C CH2 . TRP A 1 421 ? -8.702 11.796 102.417 1.00 34.89 ? 421 TRP A CH2 1 +ATOM 3460 N N . ASP A 1 422 ? -3.076 10.990 96.424 1.00 40.92 ? 422 ASP A N 1 +ATOM 3461 C CA . ASP A 1 422 ? -1.685 11.252 96.105 1.00 43.12 ? 422 ASP A CA 1 +ATOM 3462 C C . ASP A 1 422 ? -1.500 12.684 95.604 1.00 42.77 ? 422 ASP A C 1 +ATOM 3463 O O . ASP A 1 422 ? -0.460 13.297 95.843 1.00 44.43 ? 422 ASP A O 1 +ATOM 3464 C CB . ASP A 1 422 ? -1.174 10.269 95.047 1.00 46.48 ? 422 ASP A CB 1 +ATOM 3465 C CG . ASP A 1 422 ? -1.177 8.832 95.534 1.00 51.35 ? 422 ASP A CG 1 +ATOM 3466 O OD1 . ASP A 1 422 ? -0.871 8.604 96.727 1.00 53.72 ? 422 ASP A OD1 1 +ATOM 3467 O OD2 . ASP A 1 422 ? -1.470 7.924 94.723 1.00 54.69 ? 422 ASP A OD2 1 +ATOM 3468 N N . ASP A 1 423 ? -2.499 13.221 94.911 1.00 40.80 ? 423 ASP A N 1 +ATOM 3469 C CA . ASP A 1 423 ? -2.390 14.581 94.393 1.00 40.06 ? 423 ASP A CA 1 +ATOM 3470 C C . ASP A 1 423 ? -2.199 15.612 95.512 1.00 39.09 ? 423 ASP A C 1 +ATOM 3471 O O . ASP A 1 423 ? -1.626 16.681 95.282 1.00 37.08 ? 423 ASP A O 1 +ATOM 3472 C CB . ASP A 1 423 ? -3.623 14.948 93.551 1.00 40.40 ? 423 ASP A CB 1 +ATOM 3473 C CG . ASP A 1 423 ? -3.451 16.278 92.811 1.00 42.50 ? 423 ASP A CG 1 +ATOM 3474 O OD1 . ASP A 1 423 ? -2.438 16.425 92.078 1.00 44.70 ? 423 ASP A OD1 1 +ATOM 3475 O OD2 . ASP A 1 423 ? -4.317 17.174 92.957 1.00 39.54 ? 423 ASP A OD2 1 +ATOM 3476 N N . LEU A 1 424 ? -2.681 15.303 96.715 1.00 38.57 ? 424 LEU A N 1 +ATOM 3477 C CA . LEU A 1 424 ? -2.512 16.231 97.828 1.00 38.81 ? 424 LEU A CA 1 +ATOM 3478 C C . LEU A 1 424 ? -1.024 16.517 98.036 1.00 38.32 ? 424 LEU A C 1 +ATOM 3479 O O . LEU A 1 424 ? -0.615 17.668 98.176 1.00 38.95 ? 424 LEU A O 1 +ATOM 3480 C CB . LEU A 1 424 ? -3.115 15.661 99.116 1.00 37.26 ? 424 LEU A CB 1 +ATOM 3481 C CG . LEU A 1 424 ? -4.635 15.485 99.144 1.00 37.85 ? 424 LEU A CG 1 +ATOM 3482 C CD1 . LEU A 1 424 ? -5.036 14.968 100.520 1.00 35.78 ? 424 LEU A CD1 1 +ATOM 3483 C CD2 . LEU A 1 424 ? -5.342 16.812 98.838 1.00 34.90 ? 424 LEU A CD2 1 +ATOM 3484 N N . LYS A 1 425 ? -0.214 15.468 98.040 1.00 38.13 ? 425 LYS A N 1 +ATOM 3485 C CA . LYS A 1 425 ? 1.218 15.641 98.227 1.00 38.87 ? 425 LYS A CA 1 +ATOM 3486 C C . LYS A 1 425 ? 1.852 16.296 97.013 1.00 38.02 ? 425 LYS A C 1 +ATOM 3487 O O . LYS A 1 425 ? 2.758 17.119 97.145 1.00 39.16 ? 425 LYS A O 1 +ATOM 3488 C CB . LYS A 1 425 ? 1.894 14.293 98.481 1.00 41.63 ? 425 LYS A CB 1 +ATOM 3489 C CG . LYS A 1 425 ? 1.552 13.648 99.812 1.00 45.76 ? 425 LYS A CG 1 +ATOM 3490 C CD . LYS A 1 425 ? 2.484 12.474 100.085 1.00 50.29 ? 425 LYS A CD 1 +ATOM 3491 C CE . LYS A 1 425 ? 2.189 11.821 101.427 1.00 53.04 ? 425 LYS A CE 1 +ATOM 3492 N NZ . LYS A 1 425 ? 0.821 11.225 101.453 1.00 55.75 ? 425 LYS A NZ 1 +ATOM 3493 N N . LEU A 1 426 ? 1.383 15.925 95.826 1.00 36.49 ? 426 LEU A N 1 +ATOM 3494 C CA . LEU A 1 426 ? 1.923 16.487 94.597 1.00 35.15 ? 426 LEU A CA 1 +ATOM 3495 C C . LEU A 1 426 ? 1.722 18.002 94.541 1.00 33.88 ? 426 LEU A C 1 +ATOM 3496 O O . LEU A 1 426 ? 2.658 18.744 94.248 1.00 34.37 ? 426 LEU A O 1 +ATOM 3497 C CB . LEU A 1 426 ? 1.255 15.848 93.382 1.00 34.87 ? 426 LEU A CB 1 +ATOM 3498 C CG . LEU A 1 426 ? 2.092 15.614 92.116 1.00 36.72 ? 426 LEU A CG 1 +ATOM 3499 C CD1 . LEU A 1 426 ? 1.181 15.765 90.898 1.00 36.79 ? 426 LEU A CD1 1 +ATOM 3500 C CD2 . LEU A 1 426 ? 3.256 16.587 92.026 1.00 35.33 ? 426 LEU A CD2 1 +ATOM 3501 N N . GLN A 1 427 ? 0.504 18.461 94.818 1.00 33.75 ? 427 GLN A N 1 +ATOM 3502 C CA . GLN A 1 427 ? 0.211 19.893 94.775 1.00 34.51 ? 427 GLN A CA 1 +ATOM 3503 C C . GLN A 1 427 ? 1.104 20.691 95.717 1.00 35.25 ? 427 GLN A C 1 +ATOM 3504 O O . GLN A 1 427 ? 1.522 21.804 95.405 1.00 34.85 ? 427 GLN A O 1 +ATOM 3505 C CB . GLN A 1 427 ? -1.259 20.136 95.110 1.00 33.59 ? 427 GLN A CB 1 +ATOM 3506 C CG . GLN A 1 427 ? -2.187 19.644 94.024 1.00 35.64 ? 427 GLN A CG 1 +ATOM 3507 C CD . GLN A 1 427 ? -1.700 20.061 92.645 1.00 34.92 ? 427 GLN A CD 1 +ATOM 3508 O OE1 . GLN A 1 427 ? -1.410 21.230 92.408 1.00 35.67 ? 427 GLN A OE1 1 +ATOM 3509 N NE2 . GLN A 1 427 ? -1.603 19.107 91.737 1.00 34.46 ? 427 GLN A NE2 1 +ATOM 3510 N N . LEU A 1 428 ? 1.405 20.105 96.869 1.00 36.93 ? 428 LEU A N 1 +ATOM 3511 C CA . LEU A 1 428 ? 2.254 20.750 97.854 1.00 36.71 ? 428 LEU A CA 1 +ATOM 3512 C C . LEU A 1 428 ? 3.676 20.932 97.310 1.00 37.14 ? 428 LEU A C 1 +ATOM 3513 O O . LEU A 1 428 ? 4.296 21.972 97.523 1.00 37.33 ? 428 LEU A O 1 +ATOM 3514 C CB . LEU A 1 428 ? 2.258 19.912 99.127 1.00 38.84 ? 428 LEU A CB 1 +ATOM 3515 C CG . LEU A 1 428 ? 2.417 20.656 100.449 1.00 41.27 ? 428 LEU A CG 1 +ATOM 3516 C CD1 . LEU A 1 428 ? 1.649 21.965 100.426 1.00 41.10 ? 428 LEU A CD1 1 +ATOM 3517 C CD2 . LEU A 1 428 ? 1.913 19.756 101.567 1.00 41.93 ? 428 LEU A CD2 1 +ATOM 3518 N N . GLN A 1 429 ? 4.189 19.936 96.594 1.00 36.66 ? 429 GLN A N 1 +ATOM 3519 C CA . GLN A 1 429 ? 5.533 20.037 96.023 1.00 36.62 ? 429 GLN A CA 1 +ATOM 3520 C C . GLN A 1 429 ? 5.544 21.070 94.911 1.00 36.33 ? 429 GLN A C 1 +ATOM 3521 O O . GLN A 1 429 ? 6.518 21.802 94.742 1.00 36.39 ? 429 GLN A O 1 +ATOM 3522 C CB . GLN A 1 429 ? 5.985 18.699 95.433 1.00 37.70 ? 429 GLN A CB 1 +ATOM 3523 C CG . GLN A 1 429 ? 6.055 17.557 96.422 1.00 42.15 ? 429 GLN A CG 1 +ATOM 3524 C CD . GLN A 1 429 ? 6.380 16.238 95.742 1.00 44.49 ? 429 GLN A CD 1 +ATOM 3525 O OE1 . GLN A 1 429 ? 5.733 15.855 94.762 1.00 44.89 ? 429 GLN A OE1 1 +ATOM 3526 N NE2 . GLN A 1 429 ? 7.383 15.533 96.260 1.00 45.91 ? 429 GLN A NE2 1 +ATOM 3527 N N . LEU A 1 430 ? 4.458 21.108 94.141 1.00 35.23 ? 430 LEU A N 1 +ATOM 3528 C CA . LEU A 1 430 ? 4.341 22.039 93.029 1.00 34.46 ? 430 LEU A CA 1 +ATOM 3529 C C . LEU A 1 430 ? 4.336 23.483 93.493 1.00 33.15 ? 430 LEU A C 1 +ATOM 3530 O O . LEU A 1 430 ? 5.133 24.283 93.025 1.00 32.75 ? 430 LEU A O 1 +ATOM 3531 C CB . LEU A 1 430 ? 3.064 21.749 92.223 1.00 34.48 ? 430 LEU A CB 1 +ATOM 3532 C CG . LEU A 1 430 ? 3.141 20.985 90.889 1.00 34.33 ? 430 LEU A CG 1 +ATOM 3533 C CD1 . LEU A 1 430 ? 4.458 20.264 90.725 1.00 31.40 ? 430 LEU A CD1 1 +ATOM 3534 C CD2 . LEU A 1 430 ? 1.971 20.024 90.820 1.00 33.09 ? 430 LEU A CD2 1 +ATOM 3535 N N . VAL A 1 431 ? 3.443 23.825 94.415 1.00 33.39 ? 431 VAL A N 1 +ATOM 3536 C CA . VAL A 1 431 ? 3.378 25.206 94.877 1.00 33.88 ? 431 VAL A CA 1 +ATOM 3537 C C . VAL A 1 431 ? 4.627 25.620 95.656 1.00 33.97 ? 431 VAL A C 1 +ATOM 3538 O O . VAL A 1 431 ? 5.076 26.764 95.543 1.00 32.84 ? 431 VAL A O 1 +ATOM 3539 C CB . VAL A 1 431 ? 2.107 25.471 95.727 1.00 33.88 ? 431 VAL A CB 1 +ATOM 3540 C CG1 . VAL A 1 431 ? 0.877 25.139 94.914 1.00 32.35 ? 431 VAL A CG1 1 +ATOM 3541 C CG2 . VAL A 1 431 ? 2.143 24.664 97.008 1.00 34.11 ? 431 VAL A CG2 1 +ATOM 3542 N N . LEU A 1 432 ? 5.199 24.697 96.428 1.00 34.27 ? 432 LEU A N 1 +ATOM 3543 C CA . LEU A 1 432 ? 6.406 25.011 97.187 1.00 34.33 ? 432 LEU A CA 1 +ATOM 3544 C C . LEU A 1 432 ? 7.614 25.161 96.271 1.00 35.41 ? 432 LEU A C 1 +ATOM 3545 O O . LEU A 1 432 ? 8.504 25.971 96.534 1.00 36.94 ? 432 LEU A O 1 +ATOM 3546 C CB . LEU A 1 432 ? 6.684 23.940 98.239 1.00 34.00 ? 432 LEU A CB 1 +ATOM 3547 C CG . LEU A 1 432 ? 5.709 23.913 99.417 1.00 33.93 ? 432 LEU A CG 1 +ATOM 3548 C CD1 . LEU A 1 432 ? 6.194 22.916 100.454 1.00 32.73 ? 432 LEU A CD1 1 +ATOM 3549 C CD2 . LEU A 1 432 ? 5.605 25.309 100.029 1.00 34.41 ? 432 LEU A CD2 1 +ATOM 3550 N N . GLY A 1 433 ? 7.655 24.389 95.192 1.00 36.21 ? 433 GLY A N 1 +ATOM 3551 C CA . GLY A 1 433 ? 8.772 24.507 94.269 1.00 36.93 ? 433 GLY A CA 1 +ATOM 3552 C C . GLY A 1 433 ? 8.739 25.857 93.562 1.00 38.19 ? 433 GLY A C 1 +ATOM 3553 O O . GLY A 1 433 ? 9.772 26.489 93.320 1.00 39.92 ? 433 GLY A O 1 +ATOM 3554 N N . LEU A 1 434 ? 7.534 26.297 93.229 1.00 37.66 ? 434 LEU A N 1 +ATOM 3555 C CA . LEU A 1 434 ? 7.312 27.568 92.551 1.00 38.16 ? 434 LEU A CA 1 +ATOM 3556 C C . LEU A 1 434 ? 7.683 28.697 93.508 1.00 38.98 ? 434 LEU A C 1 +ATOM 3557 O O . LEU A 1 434 ? 8.374 29.652 93.156 1.00 37.67 ? 434 LEU A O 1 +ATOM 3558 C CB . LEU A 1 434 ? 5.829 27.669 92.190 1.00 37.44 ? 434 LEU A CB 1 +ATOM 3559 C CG . LEU A 1 434 ? 5.360 27.974 90.770 1.00 39.27 ? 434 LEU A CG 1 +ATOM 3560 C CD1 . LEU A 1 434 ? 6.392 27.573 89.736 1.00 38.64 ? 434 LEU A CD1 1 +ATOM 3561 C CD2 . LEU A 1 434 ? 4.048 27.239 90.557 1.00 38.21 ? 434 LEU A CD2 1 +ATOM 3562 N N . SER A 1 435 ? 7.199 28.560 94.734 1.00 40.07 ? 435 SER A N 1 +ATOM 3563 C CA . SER A 1 435 ? 7.419 29.534 95.786 1.00 40.47 ? 435 SER A CA 1 +ATOM 3564 C C . SER A 1 435 ? 8.897 29.743 96.118 1.00 40.53 ? 435 SER A C 1 +ATOM 3565 O O . SER A 1 435 ? 9.350 30.877 96.278 1.00 40.82 ? 435 SER A O 1 +ATOM 3566 C CB . SER A 1 435 ? 6.656 29.081 97.029 1.00 41.52 ? 435 SER A CB 1 +ATOM 3567 O OG . SER A 1 435 ? 6.673 30.079 98.022 1.00 47.59 ? 435 SER A OG 1 +ATOM 3568 N N . ILE A 1 436 ? 9.648 28.652 96.218 1.00 40.25 ? 436 ILE A N 1 +ATOM 3569 C CA . ILE A 1 436 ? 11.062 28.739 96.539 1.00 39.98 ? 436 ILE A CA 1 +ATOM 3570 C C . ILE A 1 436 ? 11.845 29.220 95.329 1.00 39.64 ? 436 ILE A C 1 +ATOM 3571 O O . ILE A 1 436 ? 13.038 29.487 95.416 1.00 41.79 ? 436 ILE A O 1 +ATOM 3572 C CB . ILE A 1 436 ? 11.607 27.353 97.007 1.00 41.85 ? 436 ILE A CB 1 +ATOM 3573 C CG1 . ILE A 1 436 ? 12.901 27.537 97.790 1.00 43.84 ? 436 ILE A CG1 1 +ATOM 3574 C CG2 . ILE A 1 436 ? 11.860 26.441 95.822 1.00 40.73 ? 436 ILE A CG2 1 +ATOM 3575 C CD1 . ILE A 1 436 ? 12.704 28.272 99.103 1.00 44.59 ? 436 ILE A CD1 1 +ATOM 3576 N N . SER A 1 437 ? 11.167 29.340 94.196 1.00 39.68 ? 437 SER A N 1 +ATOM 3577 C CA . SER A 1 437 ? 11.816 29.775 92.957 1.00 39.31 ? 437 SER A CA 1 +ATOM 3578 C C . SER A 1 437 ? 11.464 31.198 92.530 1.00 39.95 ? 437 SER A C 1 +ATOM 3579 O O . SER A 1 437 ? 11.596 31.546 91.353 1.00 41.31 ? 437 SER A O 1 +ATOM 3580 C CB . SER A 1 437 ? 11.476 28.811 91.812 1.00 38.36 ? 437 SER A CB 1 +ATOM 3581 O OG . SER A 1 437 ? 11.983 27.504 92.057 1.00 38.48 ? 437 SER A OG 1 +ATOM 3582 N N . GLY A 1 438 ? 10.989 32.013 93.470 1.00 39.90 ? 438 GLY A N 1 +ATOM 3583 C CA . GLY A 1 438 ? 10.674 33.392 93.141 1.00 38.68 ? 438 GLY A CA 1 +ATOM 3584 C C . GLY A 1 438 ? 9.246 33.752 92.789 1.00 39.17 ? 438 GLY A C 1 +ATOM 3585 O O . GLY A 1 438 ? 8.951 34.930 92.561 1.00 39.49 ? 438 GLY A O 1 +ATOM 3586 N N . VAL A 1 439 ? 8.355 32.769 92.726 1.00 37.90 ? 439 VAL A N 1 +ATOM 3587 C CA . VAL A 1 439 ? 6.964 33.063 92.409 1.00 36.63 ? 439 VAL A CA 1 +ATOM 3588 C C . VAL A 1 439 ? 6.168 32.816 93.676 1.00 36.73 ? 439 VAL A C 1 +ATOM 3589 O O . VAL A 1 439 ? 5.805 31.689 93.984 1.00 39.13 ? 439 VAL A O 1 +ATOM 3590 C CB . VAL A 1 439 ? 6.441 32.165 91.278 1.00 37.07 ? 439 VAL A CB 1 +ATOM 3591 C CG1 . VAL A 1 439 ? 5.053 32.628 90.861 1.00 38.28 ? 439 VAL A CG1 1 +ATOM 3592 C CG2 . VAL A 1 439 ? 7.400 32.212 90.092 1.00 35.61 ? 439 VAL A CG2 1 +ATOM 3593 N N . PRO A 1 440 ? 5.884 33.880 94.432 1.00 37.15 ? 440 PRO A N 1 +ATOM 3594 C CA . PRO A 1 440 ? 5.137 33.814 95.693 1.00 36.36 ? 440 PRO A CA 1 +ATOM 3595 C C . PRO A 1 440 ? 3.623 33.587 95.660 1.00 36.41 ? 440 PRO A C 1 +ATOM 3596 O O . PRO A 1 440 ? 3.083 32.872 96.509 1.00 36.84 ? 440 PRO A O 1 +ATOM 3597 C CB . PRO A 1 440 ? 5.487 35.138 96.351 1.00 36.24 ? 440 PRO A CB 1 +ATOM 3598 C CG . PRO A 1 440 ? 5.508 36.067 95.165 1.00 37.51 ? 440 PRO A CG 1 +ATOM 3599 C CD . PRO A 1 440 ? 6.291 35.269 94.135 1.00 36.44 ? 440 PRO A CD 1 +ATOM 3600 N N . PHE A 1 441 ? 2.929 34.198 94.711 1.00 35.21 ? 441 PHE A N 1 +ATOM 3601 C CA . PHE A 1 441 ? 1.485 34.038 94.664 1.00 35.65 ? 441 PHE A CA 1 +ATOM 3602 C C . PHE A 1 441 ? 1.070 32.850 93.809 1.00 36.82 ? 441 PHE A C 1 +ATOM 3603 O O . PHE A 1 441 ? 0.937 32.947 92.588 1.00 37.31 ? 441 PHE A O 1 +ATOM 3604 C CB . PHE A 1 441 ? 0.861 35.343 94.185 1.00 36.68 ? 441 PHE A CB 1 +ATOM 3605 C CG . PHE A 1 441 ? 1.356 36.540 94.946 1.00 37.09 ? 441 PHE A CG 1 +ATOM 3606 C CD1 . PHE A 1 441 ? 1.574 36.455 96.317 1.00 36.81 ? 441 PHE A CD1 1 +ATOM 3607 C CD2 . PHE A 1 441 ? 1.635 37.737 94.299 1.00 38.35 ? 441 PHE A CD2 1 +ATOM 3608 C CE1 . PHE A 1 441 ? 2.066 37.540 97.032 1.00 38.50 ? 441 PHE A CE1 1 +ATOM 3609 C CE2 . PHE A 1 441 ? 2.131 38.840 95.011 1.00 37.92 ? 441 PHE A CE2 1 +ATOM 3610 C CZ . PHE A 1 441 ? 2.346 38.738 96.378 1.00 37.77 ? 441 PHE A CZ 1 +ATOM 3611 N N . VAL A 1 442 ? 0.865 31.724 94.484 1.00 36.38 ? 442 VAL A N 1 +ATOM 3612 C CA . VAL A 1 442 ? 0.514 30.476 93.833 1.00 37.24 ? 442 VAL A CA 1 +ATOM 3613 C C . VAL A 1 442 ? -0.627 29.742 94.535 1.00 38.24 ? 442 VAL A C 1 +ATOM 3614 O O . VAL A 1 442 ? -1.021 30.082 95.654 1.00 37.18 ? 442 VAL A O 1 +ATOM 3615 C CB . VAL A 1 442 ? 1.738 29.548 93.803 1.00 37.97 ? 442 VAL A CB 1 +ATOM 3616 C CG1 . VAL A 1 442 ? 2.867 30.204 93.022 1.00 38.18 ? 442 VAL A CG1 1 +ATOM 3617 C CG2 . VAL A 1 442 ? 2.209 29.276 95.236 1.00 37.87 ? 442 VAL A CG2 1 +ATOM 3618 N N . GLY A 1 443 ? -1.146 28.730 93.851 1.00 39.51 ? 443 GLY A N 1 +ATOM 3619 C CA . GLY A 1 443 ? -2.230 27.924 94.382 1.00 39.80 ? 443 GLY A CA 1 +ATOM 3620 C C . GLY A 1 443 ? -2.515 26.777 93.430 1.00 40.55 ? 443 GLY A C 1 +ATOM 3621 O O . GLY A 1 443 ? -1.830 26.607 92.424 1.00 40.47 ? 443 GLY A O 1 +ATOM 3622 N N . CYS A 1 444 ? -3.522 25.979 93.748 1.00 41.97 ? 444 CYS A N 1 +ATOM 3623 C CA . CYS A 1 444 ? -3.897 24.860 92.901 1.00 42.92 ? 444 CYS A CA 1 +ATOM 3624 C C . CYS A 1 444 ? -5.420 24.824 92.889 1.00 43.91 ? 444 CYS A C 1 +ATOM 3625 O O . CYS A 1 444 ? -6.062 25.487 93.710 1.00 44.28 ? 444 CYS A O 1 +ATOM 3626 C CB . CYS A 1 444 ? -3.351 23.553 93.475 1.00 44.10 ? 444 CYS A CB 1 +ATOM 3627 S SG . CYS A 1 444 ? -4.166 23.022 95.005 1.00 48.59 ? 444 CYS A SG 1 +ATOM 3628 N N . ASP A 1 445 ? -6.000 24.069 91.958 1.00 44.02 ? 445 ASP A N 1 +ATOM 3629 C CA . ASP A 1 445 ? -7.450 23.967 91.892 1.00 43.94 ? 445 ASP A CA 1 +ATOM 3630 C C . ASP A 1 445 ? -7.928 23.079 93.039 1.00 42.54 ? 445 ASP A C 1 +ATOM 3631 O O . ASP A 1 445 ? -7.640 21.878 93.079 1.00 42.14 ? 445 ASP A O 1 +ATOM 3632 C CB . ASP A 1 445 ? -7.926 23.376 90.547 1.00 45.47 ? 445 ASP A CB 1 +ATOM 3633 C CG . ASP A 1 445 ? -7.719 24.327 89.369 1.00 49.53 ? 445 ASP A CG 1 +ATOM 3634 O OD1 . ASP A 1 445 ? -7.768 25.564 89.565 1.00 52.58 ? 445 ASP A OD1 1 +ATOM 3635 O OD2 . ASP A 1 445 ? -7.526 23.838 88.232 1.00 49.53 ? 445 ASP A OD2 1 +ATOM 3636 N N . ILE A 1 446 ? -8.652 23.679 93.977 1.00 40.96 ? 446 ILE A N 1 +ATOM 3637 C CA . ILE A 1 446 ? -9.183 22.941 95.113 1.00 39.55 ? 446 ILE A CA 1 +ATOM 3638 C C . ILE A 1 446 ? -10.213 21.943 94.596 1.00 38.98 ? 446 ILE A C 1 +ATOM 3639 O O . ILE A 1 446 ? -11.159 22.311 93.903 1.00 38.31 ? 446 ILE A O 1 +ATOM 3640 C CB . ILE A 1 446 ? -9.835 23.895 96.121 1.00 38.71 ? 446 ILE A CB 1 +ATOM 3641 C CG1 . ILE A 1 446 ? -8.778 24.859 96.657 1.00 37.34 ? 446 ILE A CG1 1 +ATOM 3642 C CG2 . ILE A 1 446 ? -10.501 23.109 97.238 1.00 37.60 ? 446 ILE A CG2 1 +ATOM 3643 C CD1 . ILE A 1 446 ? -9.340 25.959 97.521 1.00 37.84 ? 446 ILE A CD1 1 +ATOM 3644 N N . GLY A 1 447 ? -10.003 20.673 94.921 1.00 39.08 ? 447 GLY A N 1 +ATOM 3645 C CA . GLY A 1 447 ? -10.911 19.635 94.480 1.00 38.13 ? 447 GLY A CA 1 +ATOM 3646 C C . GLY A 1 447 ? -10.442 18.982 93.194 1.00 38.10 ? 447 GLY A C 1 +ATOM 3647 O O . GLY A 1 447 ? -11.038 18.007 92.729 1.00 38.60 ? 447 GLY A O 1 +ATOM 3648 N N . GLY A 1 448 ? -9.375 19.517 92.610 1.00 36.91 ? 448 GLY A N 1 +ATOM 3649 C CA . GLY A 1 448 ? -8.861 18.957 91.372 1.00 35.67 ? 448 GLY A CA 1 +ATOM 3650 C C . GLY A 1 448 ? -9.663 19.349 90.140 1.00 35.73 ? 448 GLY A C 1 +ATOM 3651 O O . GLY A 1 448 ? -10.901 19.377 90.158 1.00 36.08 ? 448 GLY A O 1 +ATOM 3652 N N . PHE A 1 449 ? -8.954 19.635 89.055 1.00 34.11 ? 449 PHE A N 1 +ATOM 3653 C CA . PHE A 1 449 ? -9.597 20.032 87.817 1.00 33.41 ? 449 PHE A CA 1 +ATOM 3654 C C . PHE A 1 449 ? -10.338 18.909 87.069 1.00 33.46 ? 449 PHE A C 1 +ATOM 3655 O O . PHE A 1 449 ? -11.516 19.057 86.737 1.00 32.02 ? 449 PHE A O 1 +ATOM 3656 C CB . PHE A 1 449 ? -8.570 20.664 86.882 1.00 32.05 ? 449 PHE A CB 1 +ATOM 3657 C CG . PHE A 1 449 ? -9.097 20.919 85.496 1.00 32.21 ? 449 PHE A CG 1 +ATOM 3658 C CD1 . PHE A 1 449 ? -9.971 21.979 85.250 1.00 32.17 ? 449 PHE A CD1 1 +ATOM 3659 C CD2 . PHE A 1 449 ? -8.737 20.087 84.441 1.00 30.54 ? 449 PHE A CD2 1 +ATOM 3660 C CE1 . PHE A 1 449 ? -10.476 22.202 83.962 1.00 33.39 ? 449 PHE A CE1 1 +ATOM 3661 C CE2 . PHE A 1 449 ? -9.235 20.301 83.153 1.00 31.02 ? 449 PHE A CE2 1 +ATOM 3662 C CZ . PHE A 1 449 ? -10.106 21.360 82.912 1.00 31.25 ? 449 PHE A CZ 1 +ATOM 3663 N N . GLN A 1 450 ? -9.646 17.801 86.804 1.00 33.61 ? 450 GLN A N 1 +ATOM 3664 C CA . GLN A 1 450 ? -10.222 16.674 86.067 1.00 33.37 ? 450 GLN A CA 1 +ATOM 3665 C C . GLN A 1 450 ? -11.592 16.222 86.577 1.00 34.13 ? 450 GLN A C 1 +ATOM 3666 O O . GLN A 1 450 ? -11.821 16.099 87.781 1.00 33.60 ? 450 GLN A O 1 +ATOM 3667 C CB . GLN A 1 450 ? -9.249 15.494 86.074 1.00 33.62 ? 450 GLN A CB 1 +ATOM 3668 C CG . GLN A 1 450 ? -7.853 15.806 85.542 1.00 31.98 ? 450 GLN A CG 1 +ATOM 3669 C CD . GLN A 1 450 ? -7.830 16.264 84.094 1.00 34.31 ? 450 GLN A CD 1 +ATOM 3670 O OE1 . GLN A 1 450 ? -8.690 15.893 83.292 1.00 36.50 ? 450 GLN A OE1 1 +ATOM 3671 N NE2 . GLN A 1 450 ? -6.820 17.059 83.744 1.00 33.93 ? 450 GLN A NE2 1 +ATOM 3672 N N . GLY A 1 451 ? -12.498 15.968 85.640 1.00 35.94 ? 451 GLY A N 1 +ATOM 3673 C CA . GLY A 1 451 ? -13.850 15.568 85.991 1.00 37.80 ? 451 GLY A CA 1 +ATOM 3674 C C . GLY A 1 451 ? -14.108 14.076 86.065 1.00 38.98 ? 451 GLY A C 1 +ATOM 3675 O O . GLY A 1 451 ? -13.868 13.458 87.101 1.00 39.93 ? 451 GLY A O 1 +ATOM 3676 N N . ARG A 1 452 ? -14.622 13.499 84.981 1.00 38.30 ? 452 ARG A N 1 +ATOM 3677 C CA . ARG A 1 452 ? -14.901 12.068 84.942 1.00 38.09 ? 452 ARG A CA 1 +ATOM 3678 C C . ARG A 1 452 ? -14.633 11.498 83.557 1.00 39.73 ? 452 ARG A C 1 +ATOM 3679 O O . ARG A 1 452 ? -15.413 10.691 83.049 1.00 40.41 ? 452 ARG A O 1 +ATOM 3680 C CB . ARG A 1 452 ? -16.352 11.796 85.317 1.00 36.46 ? 452 ARG A CB 1 +ATOM 3681 C CG . ARG A 1 452 ? -16.705 12.169 86.735 1.00 37.17 ? 452 ARG A CG 1 +ATOM 3682 C CD . ARG A 1 452 ? -17.856 13.126 86.732 1.00 36.32 ? 452 ARG A CD 1 +ATOM 3683 N NE . ARG A 1 452 ? -19.076 12.511 87.215 1.00 38.91 ? 452 ARG A NE 1 +ATOM 3684 C CZ . ARG A 1 452 ? -20.299 12.973 86.966 1.00 39.24 ? 452 ARG A CZ 1 +ATOM 3685 N NH1 . ARG A 1 452 ? -20.470 14.063 86.220 1.00 36.65 ? 452 ARG A NH1 1 +ATOM 3686 N NH2 . ARG A 1 452 ? -21.353 12.346 87.476 1.00 37.73 ? 452 ARG A NH2 1 +ATOM 3687 N N . ASN A 1 453 ? -13.532 11.915 82.942 1.00 40.62 ? 453 ASN A N 1 +ATOM 3688 C CA . ASN A 1 453 ? -13.201 11.430 81.613 1.00 41.57 ? 453 ASN A CA 1 +ATOM 3689 C C . ASN A 1 453 ? -12.258 10.229 81.647 1.00 40.47 ? 453 ASN A C 1 +ATOM 3690 O O . ASN A 1 453 ? -11.852 9.733 80.609 1.00 39.18 ? 453 ASN A O 1 +ATOM 3691 C CB . ASN A 1 453 ? -12.632 12.566 80.744 1.00 43.78 ? 453 ASN A CB 1 +ATOM 3692 C CG . ASN A 1 453 ? -11.503 13.320 81.421 1.00 47.18 ? 453 ASN A CG 1 +ATOM 3693 O OD1 . ASN A 1 453 ? -11.647 13.811 82.548 1.00 48.29 ? 453 ASN A OD1 1 +ATOM 3694 N ND2 . ASN A 1 453 ? -10.371 13.430 80.729 1.00 48.69 ? 453 ASN A ND2 1 +ATOM 3695 N N . PHE A 1 454 ? -11.910 9.774 82.849 1.00 40.18 ? 454 PHE A N 1 +ATOM 3696 C CA . PHE A 1 454 ? -11.076 8.587 83.019 1.00 39.22 ? 454 PHE A CA 1 +ATOM 3697 C C . PHE A 1 454 ? -11.183 8.045 84.445 1.00 39.43 ? 454 PHE A C 1 +ATOM 3698 O O . PHE A 1 454 ? -11.383 8.795 85.399 1.00 39.43 ? 454 PHE A O 1 +ATOM 3699 C CB . PHE A 1 454 ? -9.610 8.832 82.583 1.00 38.78 ? 454 PHE A CB 1 +ATOM 3700 C CG . PHE A 1 454 ? -8.876 9.868 83.383 1.00 38.49 ? 454 PHE A CG 1 +ATOM 3701 C CD1 . PHE A 1 454 ? -8.184 9.514 84.539 1.00 37.61 ? 454 PHE A CD1 1 +ATOM 3702 C CD2 . PHE A 1 454 ? -8.845 11.201 82.962 1.00 38.78 ? 454 PHE A CD2 1 +ATOM 3703 C CE1 . PHE A 1 454 ? -7.465 10.470 85.272 1.00 36.66 ? 454 PHE A CE1 1 +ATOM 3704 C CE2 . PHE A 1 454 ? -8.129 12.167 83.685 1.00 38.34 ? 454 PHE A CE2 1 +ATOM 3705 C CZ . PHE A 1 454 ? -7.438 11.795 84.845 1.00 37.16 ? 454 PHE A CZ 1 +ATOM 3706 N N . ALA A 1 455 ? -11.066 6.724 84.559 1.00 40.82 ? 455 ALA A N 1 +ATOM 3707 C CA . ALA A 1 455 ? -11.210 5.971 85.808 1.00 41.32 ? 455 ALA A CA 1 +ATOM 3708 C C . ALA A 1 455 ? -10.422 6.362 87.048 1.00 42.43 ? 455 ALA A C 1 +ATOM 3709 O O . ALA A 1 455 ? -10.940 6.286 88.161 1.00 42.90 ? 455 ALA A O 1 +ATOM 3710 C CB . ALA A 1 455 ? -10.974 4.491 85.522 1.00 39.30 ? 455 ALA A CB 1 +ATOM 3711 N N . GLU A 1 456 ? -9.172 6.760 86.869 1.00 44.09 ? 456 GLU A N 1 +ATOM 3712 C CA . GLU A 1 456 ? -8.322 7.111 88.000 1.00 46.27 ? 456 GLU A CA 1 +ATOM 3713 C C . GLU A 1 456 ? -8.591 8.480 88.616 1.00 46.25 ? 456 GLU A C 1 +ATOM 3714 O O . GLU A 1 456 ? -7.654 9.212 88.924 1.00 48.78 ? 456 GLU A O 1 +ATOM 3715 C CB . GLU A 1 456 ? -6.849 7.023 87.587 1.00 47.88 ? 456 GLU A CB 1 +ATOM 3716 C CG . GLU A 1 456 ? -6.416 5.660 87.031 1.00 52.00 ? 456 GLU A CG 1 +ATOM 3717 C CD . GLU A 1 456 ? -7.108 5.290 85.712 1.00 55.23 ? 456 GLU A CD 1 +ATOM 3718 O OE1 . GLU A 1 456 ? -7.286 6.186 84.854 1.00 54.51 ? 456 GLU A OE1 1 +ATOM 3719 O OE2 . GLU A 1 456 ? -7.457 4.097 85.528 1.00 57.68 ? 456 GLU A OE2 1 +ATOM 3720 N N . ILE A 1 457 ? -9.861 8.824 88.796 1.00 44.89 ? 457 ILE A N 1 +ATOM 3721 C CA . ILE A 1 457 ? -10.236 10.103 89.389 1.00 43.29 ? 457 ILE A CA 1 +ATOM 3722 C C . ILE A 1 457 ? -11.063 9.816 90.634 1.00 43.47 ? 457 ILE A C 1 +ATOM 3723 O O . ILE A 1 457 ? -12.017 9.037 90.586 1.00 43.26 ? 457 ILE A O 1 +ATOM 3724 C CB . ILE A 1 457 ? -11.077 10.960 88.415 1.00 43.60 ? 457 ILE A CB 1 +ATOM 3725 C CG1 . ILE A 1 457 ? -10.271 11.264 87.152 1.00 43.68 ? 457 ILE A CG1 1 +ATOM 3726 C CG2 . ILE A 1 457 ? -11.481 12.263 89.082 1.00 43.07 ? 457 ILE A CG2 1 +ATOM 3727 C CD1 . ILE A 1 457 ? -11.026 12.102 86.132 1.00 43.37 ? 457 ILE A CD1 1 +ATOM 3728 N N . ASP A 1 458 ? -10.699 10.450 91.747 1.00 43.03 ? 458 ASP A N 1 +ATOM 3729 C CA . ASP A 1 458 ? -11.392 10.236 93.015 1.00 42.30 ? 458 ASP A CA 1 +ATOM 3730 C C . ASP A 1 458 ? -12.218 11.452 93.404 1.00 41.21 ? 458 ASP A C 1 +ATOM 3731 O O . ASP A 1 458 ? -11.664 12.469 93.808 1.00 39.72 ? 458 ASP A O 1 +ATOM 3732 C CB . ASP A 1 458 ? -10.366 9.950 94.112 1.00 44.43 ? 458 ASP A CB 1 +ATOM 3733 C CG . ASP A 1 458 ? -11.005 9.525 95.412 1.00 46.16 ? 458 ASP A CG 1 +ATOM 3734 O OD1 . ASP A 1 458 ? -12.186 9.873 95.639 1.00 47.59 ? 458 ASP A OD1 1 +ATOM 3735 O OD2 . ASP A 1 458 ? -10.316 8.854 96.211 1.00 46.97 ? 458 ASP A OD2 1 +ATOM 3736 N N . ASN A 1 459 ? -13.540 11.342 93.295 1.00 41.21 ? 459 ASN A N 1 +ATOM 3737 C CA . ASN A 1 459 ? -14.423 12.456 93.627 1.00 41.62 ? 459 ASN A CA 1 +ATOM 3738 C C . ASN A 1 459 ? -15.114 12.330 94.980 1.00 41.45 ? 459 ASN A C 1 +ATOM 3739 O O . ASN A 1 459 ? -16.189 12.894 95.186 1.00 42.40 ? 459 ASN A O 1 +ATOM 3740 C CB . ASN A 1 459 ? -15.480 12.632 92.532 1.00 42.68 ? 459 ASN A CB 1 +ATOM 3741 C CG . ASN A 1 459 ? -14.886 13.112 91.229 1.00 44.04 ? 459 ASN A CG 1 +ATOM 3742 O OD1 . ASN A 1 459 ? -14.279 14.185 91.161 1.00 46.09 ? 459 ASN A OD1 1 +ATOM 3743 N ND2 . ASN A 1 459 ? -15.052 12.320 90.183 1.00 45.16 ? 459 ASN A ND2 1 +ATOM 3744 N N . SER A 1 460 ? -14.510 11.598 95.907 1.00 40.69 ? 460 SER A N 1 +ATOM 3745 C CA . SER A 1 460 ? -15.116 11.447 97.222 1.00 41.60 ? 460 SER A CA 1 +ATOM 3746 C C . SER A 1 460 ? -15.126 12.804 97.942 1.00 40.77 ? 460 SER A C 1 +ATOM 3747 O O . SER A 1 460 ? -14.227 13.629 97.747 1.00 39.32 ? 460 SER A O 1 +ATOM 3748 C CB . SER A 1 460 ? -14.347 10.412 98.040 1.00 41.82 ? 460 SER A CB 1 +ATOM 3749 O OG . SER A 1 460 ? -13.022 10.845 98.265 1.00 44.48 ? 460 SER A OG 1 +ATOM 3750 N N . MET A 1 461 ? -16.139 13.024 98.778 1.00 40.14 ? 461 MET A N 1 +ATOM 3751 C CA . MET A 1 461 ? -16.284 14.288 99.486 1.00 39.47 ? 461 MET A CA 1 +ATOM 3752 C C . MET A 1 461 ? -15.287 14.542 100.599 1.00 39.56 ? 461 MET A C 1 +ATOM 3753 O O . MET A 1 461 ? -14.938 15.690 100.864 1.00 39.89 ? 461 MET A O 1 +ATOM 3754 C CB . MET A 1 461 ? -17.703 14.416 100.015 1.00 39.58 ? 461 MET A CB 1 +ATOM 3755 C CG . MET A 1 461 ? -18.722 14.447 98.895 1.00 42.19 ? 461 MET A CG 1 +ATOM 3756 S SD . MET A 1 461 ? -20.421 14.431 99.482 1.00 44.29 ? 461 MET A SD 1 +ATOM 3757 C CE . MET A 1 461 ? -20.610 12.702 99.956 1.00 43.38 ? 461 MET A CE 1 +ATOM 3758 N N . ASP A 1 462 ? -14.809 13.495 101.253 1.00 38.99 ? 462 ASP A N 1 +ATOM 3759 C CA . ASP A 1 462 ? -13.838 13.724 102.310 1.00 41.55 ? 462 ASP A CA 1 +ATOM 3760 C C . ASP A 1 462 ? -12.485 14.129 101.708 1.00 39.67 ? 462 ASP A C 1 +ATOM 3761 O O . ASP A 1 462 ? -11.699 14.824 102.345 1.00 40.80 ? 462 ASP A O 1 +ATOM 3762 C CB . ASP A 1 462 ? -13.716 12.489 103.209 1.00 45.32 ? 462 ASP A CB 1 +ATOM 3763 C CG . ASP A 1 462 ? -13.188 11.284 102.480 1.00 52.48 ? 462 ASP A CG 1 +ATOM 3764 O OD1 . ASP A 1 462 ? -13.624 11.040 101.328 1.00 58.47 ? 462 ASP A OD1 1 +ATOM 3765 O OD2 . ASP A 1 462 ? -12.343 10.566 103.062 1.00 55.96 ? 462 ASP A OD2 1 +ATOM 3766 N N . LEU A 1 463 ? -12.224 13.715 100.473 1.00 37.03 ? 463 LEU A N 1 +ATOM 3767 C CA . LEU A 1 463 ? -10.984 14.090 99.799 1.00 35.85 ? 463 LEU A CA 1 +ATOM 3768 C C . LEU A 1 463 ? -11.119 15.578 99.437 1.00 35.71 ? 463 LEU A C 1 +ATOM 3769 O O . LEU A 1 463 ? -10.164 16.348 99.548 1.00 36.21 ? 463 LEU A O 1 +ATOM 3770 C CB . LEU A 1 463 ? -10.795 13.281 98.513 1.00 33.86 ? 463 LEU A CB 1 +ATOM 3771 C CG . LEU A 1 463 ? -9.394 13.111 97.910 1.00 34.43 ? 463 LEU A CG 1 +ATOM 3772 C CD1 . LEU A 1 463 ? -9.526 12.910 96.407 1.00 35.01 ? 463 LEU A CD1 1 +ATOM 3773 C CD2 . LEU A 1 463 ? -8.513 14.313 98.190 1.00 33.96 ? 463 LEU A CD2 1 +ATOM 3774 N N . LEU A 1 464 ? -12.312 15.967 98.994 1.00 33.46 ? 464 LEU A N 1 +ATOM 3775 C CA . LEU A 1 464 ? -12.578 17.348 98.626 1.00 32.84 ? 464 LEU A CA 1 +ATOM 3776 C C . LEU A 1 464 ? -12.325 18.240 99.842 1.00 32.41 ? 464 LEU A C 1 +ATOM 3777 O O . LEU A 1 464 ? -11.703 19.300 99.738 1.00 31.97 ? 464 LEU A O 1 +ATOM 3778 C CB . LEU A 1 464 ? -14.031 17.498 98.156 1.00 31.08 ? 464 LEU A CB 1 +ATOM 3779 C CG . LEU A 1 464 ? -14.499 18.929 97.892 1.00 30.71 ? 464 LEU A CG 1 +ATOM 3780 C CD1 . LEU A 1 464 ? -13.663 19.552 96.773 1.00 29.94 ? 464 LEU A CD1 1 +ATOM 3781 C CD2 . LEU A 1 464 ? -15.977 18.916 97.521 1.00 31.00 ? 464 LEU A CD2 1 +ATOM 3782 N N . VAL A 1 465 ? -12.807 17.805 100.999 1.00 32.12 ? 465 VAL A N 1 +ATOM 3783 C CA . VAL A 1 465 ? -12.606 18.567 102.220 1.00 31.77 ? 465 VAL A CA 1 +ATOM 3784 C C . VAL A 1 465 ? -11.114 18.705 102.511 1.00 32.23 ? 465 VAL A C 1 +ATOM 3785 O O . VAL A 1 465 ? -10.659 19.757 102.955 1.00 34.14 ? 465 VAL A O 1 +ATOM 3786 C CB . VAL A 1 465 ? -13.307 17.903 103.415 1.00 31.62 ? 465 VAL A CB 1 +ATOM 3787 C CG1 . VAL A 1 465 ? -12.901 18.580 104.698 1.00 28.98 ? 465 VAL A CG1 1 +ATOM 3788 C CG2 . VAL A 1 465 ? -14.826 18.012 103.248 1.00 33.24 ? 465 VAL A CG2 1 +ATOM 3789 N N . LYS A 1 466 ? -10.347 17.658 102.243 1.00 31.27 ? 466 LYS A N 1 +ATOM 3790 C CA . LYS A 1 466 ? -8.910 17.705 102.478 1.00 32.15 ? 466 LYS A CA 1 +ATOM 3791 C C . LYS A 1 466 ? -8.218 18.705 101.561 1.00 32.00 ? 466 LYS A C 1 +ATOM 3792 O O . LYS A 1 466 ? -7.180 19.270 101.918 1.00 31.58 ? 466 LYS A O 1 +ATOM 3793 C CB . LYS A 1 466 ? -8.280 16.316 102.291 1.00 35.19 ? 466 LYS A CB 1 +ATOM 3794 C CG . LYS A 1 466 ? -8.663 15.314 103.363 1.00 35.79 ? 466 LYS A CG 1 +ATOM 3795 C CD . LYS A 1 466 ? -8.361 15.857 104.741 1.00 39.60 ? 466 LYS A CD 1 +ATOM 3796 C CE . LYS A 1 466 ? -8.683 14.830 105.813 1.00 42.79 ? 466 LYS A CE 1 +ATOM 3797 N NZ . LYS A 1 466 ? -8.493 15.410 107.171 1.00 46.58 ? 466 LYS A NZ 1 +ATOM 3798 N N . TYR A 1 467 ? -8.769 18.911 100.369 1.00 32.16 ? 467 TYR A N 1 +ATOM 3799 C CA . TYR A 1 467 ? -8.190 19.880 99.439 1.00 32.82 ? 467 TYR A CA 1 +ATOM 3800 C C . TYR A 1 467 ? -8.353 21.282 100.021 1.00 32.18 ? 467 TYR A C 1 +ATOM 3801 O O . TYR A 1 467 ? -7.411 22.072 100.036 1.00 31.35 ? 467 TYR A O 1 +ATOM 3802 C CB . TYR A 1 467 ? -8.888 19.806 98.085 1.00 32.95 ? 467 TYR A CB 1 +ATOM 3803 C CG . TYR A 1 467 ? -8.192 18.932 97.079 1.00 34.06 ? 467 TYR A CG 1 +ATOM 3804 C CD1 . TYR A 1 467 ? -7.073 19.389 96.377 1.00 33.42 ? 467 TYR A CD1 1 +ATOM 3805 C CD2 . TYR A 1 467 ? -8.654 17.639 96.822 1.00 35.75 ? 467 TYR A CD2 1 +ATOM 3806 C CE1 . TYR A 1 467 ? -6.434 18.571 95.436 1.00 33.92 ? 467 TYR A CE1 1 +ATOM 3807 C CE2 . TYR A 1 467 ? -8.023 16.816 95.892 1.00 35.02 ? 467 TYR A CE2 1 +ATOM 3808 C CZ . TYR A 1 467 ? -6.919 17.288 95.204 1.00 34.14 ? 467 TYR A CZ 1 +ATOM 3809 O OH . TYR A 1 467 ? -6.316 16.464 94.291 1.00 36.34 ? 467 TYR A OH 1 +ATOM 3810 N N . TYR A 1 468 ? -9.556 21.576 100.506 1.00 31.91 ? 468 TYR A N 1 +ATOM 3811 C CA . TYR A 1 468 ? -9.840 22.874 101.101 1.00 33.17 ? 468 TYR A CA 1 +ATOM 3812 C C . TYR A 1 468 ? -8.890 23.126 102.258 1.00 33.09 ? 468 TYR A C 1 +ATOM 3813 O O . TYR A 1 468 ? -8.364 24.229 102.423 1.00 31.85 ? 468 TYR A O 1 +ATOM 3814 C CB . TYR A 1 468 ? -11.293 22.928 101.589 1.00 32.64 ? 468 TYR A CB 1 +ATOM 3815 C CG . TYR A 1 468 ? -12.274 23.382 100.521 1.00 33.73 ? 468 TYR A CG 1 +ATOM 3816 C CD1 . TYR A 1 468 ? -12.461 24.738 100.251 1.00 34.30 ? 468 TYR A CD1 1 +ATOM 3817 C CD2 . TYR A 1 468 ? -12.996 22.456 99.771 1.00 33.07 ? 468 TYR A CD2 1 +ATOM 3818 C CE1 . TYR A 1 468 ? -13.346 25.157 99.264 1.00 35.00 ? 468 TYR A CE1 1 +ATOM 3819 C CE2 . TYR A 1 468 ? -13.878 22.861 98.783 1.00 33.36 ? 468 TYR A CE2 1 +ATOM 3820 C CZ . TYR A 1 468 ? -14.053 24.216 98.534 1.00 35.56 ? 468 TYR A CZ 1 +ATOM 3821 O OH . TYR A 1 468 ? -14.956 24.634 97.575 1.00 37.90 ? 468 TYR A OH 1 +ATOM 3822 N N . ALA A 1 469 ? -8.662 22.084 103.048 1.00 33.79 ? 469 ALA A N 1 +ATOM 3823 C CA . ALA A 1 469 ? -7.783 22.177 104.207 1.00 33.08 ? 469 ALA A CA 1 +ATOM 3824 C C . ALA A 1 469 ? -6.307 22.278 103.805 1.00 33.32 ? 469 ALA A C 1 +ATOM 3825 O O . ALA A 1 469 ? -5.523 22.974 104.446 1.00 34.86 ? 469 ALA A O 1 +ATOM 3826 C CB . ALA A 1 469 ? -8.009 20.973 105.114 1.00 31.13 ? 469 ALA A CB 1 +ATOM 3827 N N . LEU A 1 470 ? -5.931 21.586 102.741 1.00 32.35 ? 470 LEU A N 1 +ATOM 3828 C CA . LEU A 1 470 ? -4.555 21.612 102.278 1.00 32.90 ? 470 LEU A CA 1 +ATOM 3829 C C . LEU A 1 470 ? -4.098 23.009 101.876 1.00 33.56 ? 470 LEU A C 1 +ATOM 3830 O O . LEU A 1 470 ? -3.001 23.443 102.231 1.00 34.48 ? 470 LEU A O 1 +ATOM 3831 C CB . LEU A 1 470 ? -4.386 20.684 101.073 1.00 33.08 ? 470 LEU A CB 1 +ATOM 3832 C CG . LEU A 1 470 ? -2.994 20.755 100.437 1.00 33.76 ? 470 LEU A CG 1 +ATOM 3833 C CD1 . LEU A 1 470 ? -2.007 20.026 101.335 1.00 33.61 ? 470 LEU A CD1 1 +ATOM 3834 C CD2 . LEU A 1 470 ? -3.012 20.137 99.034 1.00 34.77 ? 470 LEU A CD2 1 +ATOM 3835 N N . ALA A 1 471 ? -4.947 23.700 101.123 1.00 34.22 ? 471 ALA A N 1 +ATOM 3836 C CA . ALA A 1 471 ? -4.651 25.032 100.619 1.00 33.11 ? 471 ALA A CA 1 +ATOM 3837 C C . ALA A 1 471 ? -5.081 26.150 101.563 1.00 33.73 ? 471 ALA A C 1 +ATOM 3838 O O . ALA A 1 471 ? -5.125 27.317 101.162 1.00 33.53 ? 471 ALA A O 1 +ATOM 3839 C CB . ALA A 1 471 ? -5.324 25.214 99.254 1.00 34.14 ? 471 ALA A CB 1 +ATOM 3840 N N . LEU A 1 472 ? -5.399 25.795 102.806 1.00 34.23 ? 472 LEU A N 1 +ATOM 3841 C CA . LEU A 1 472 ? -5.828 26.767 103.813 1.00 34.95 ? 472 LEU A CA 1 +ATOM 3842 C C . LEU A 1 472 ? -5.001 28.048 103.803 1.00 36.10 ? 472 LEU A C 1 +ATOM 3843 O O . LEU A 1 472 ? -5.550 29.149 103.903 1.00 35.65 ? 472 LEU A O 1 +ATOM 3844 C CB . LEU A 1 472 ? -5.756 26.145 105.208 1.00 35.55 ? 472 LEU A CB 1 +ATOM 3845 C CG . LEU A 1 472 ? -6.077 27.072 106.381 1.00 34.47 ? 472 LEU A CG 1 +ATOM 3846 C CD1 . LEU A 1 472 ? -7.460 27.668 106.187 1.00 35.18 ? 472 LEU A CD1 1 +ATOM 3847 C CD2 . LEU A 1 472 ? -6.006 26.282 107.688 1.00 33.34 ? 472 LEU A CD2 1 +ATOM 3848 N N . PHE A 1 473 ? -3.683 27.906 103.679 1.00 36.26 ? 473 PHE A N 1 +ATOM 3849 C CA . PHE A 1 473 ? -2.802 29.067 103.668 1.00 37.19 ? 473 PHE A CA 1 +ATOM 3850 C C . PHE A 1 473 ? -2.140 29.388 102.328 1.00 37.75 ? 473 PHE A C 1 +ATOM 3851 O O . PHE A 1 473 ? -1.255 30.238 102.272 1.00 38.92 ? 473 PHE A O 1 +ATOM 3852 C CB . PHE A 1 473 ? -1.728 28.913 104.742 1.00 37.63 ? 473 PHE A CB 1 +ATOM 3853 C CG . PHE A 1 473 ? -2.280 28.855 106.135 1.00 38.33 ? 473 PHE A CG 1 +ATOM 3854 C CD1 . PHE A 1 473 ? -2.783 29.998 106.740 1.00 38.40 ? 473 PHE A CD1 1 +ATOM 3855 C CD2 . PHE A 1 473 ? -2.317 27.655 106.835 1.00 37.19 ? 473 PHE A CD2 1 +ATOM 3856 C CE1 . PHE A 1 473 ? -3.317 29.948 108.028 1.00 39.59 ? 473 PHE A CE1 1 +ATOM 3857 C CE2 . PHE A 1 473 ? -2.846 27.596 108.119 1.00 38.34 ? 473 PHE A CE2 1 +ATOM 3858 C CZ . PHE A 1 473 ? -3.348 28.744 108.718 1.00 37.89 ? 473 PHE A CZ 1 +ATOM 3859 N N . PHE A 1 474 ? -2.543 28.715 101.255 1.00 36.57 ? 474 PHE A N 1 +ATOM 3860 C CA . PHE A 1 474 ? -1.974 29.029 99.948 1.00 36.98 ? 474 PHE A CA 1 +ATOM 3861 C C . PHE A 1 474 ? -2.423 30.454 99.592 1.00 37.81 ? 474 PHE A C 1 +ATOM 3862 O O . PHE A 1 474 ? -3.522 30.885 99.962 1.00 38.89 ? 474 PHE A O 1 +ATOM 3863 C CB . PHE A 1 474 ? -2.496 28.074 98.864 1.00 35.68 ? 474 PHE A CB 1 +ATOM 3864 C CG . PHE A 1 474 ? -1.946 26.678 98.946 1.00 35.25 ? 474 PHE A CG 1 +ATOM 3865 C CD1 . PHE A 1 474 ? -1.091 26.298 99.973 1.00 35.05 ? 474 PHE A CD1 1 +ATOM 3866 C CD2 . PHE A 1 474 ? -2.303 25.733 97.993 1.00 35.98 ? 474 PHE A CD2 1 +ATOM 3867 C CE1 . PHE A 1 474 ? -0.604 24.994 100.046 1.00 36.04 ? 474 PHE A CE1 1 +ATOM 3868 C CE2 . PHE A 1 474 ? -1.819 24.422 98.057 1.00 35.74 ? 474 PHE A CE2 1 +ATOM 3869 C CZ . PHE A 1 474 ? -0.970 24.055 99.083 1.00 34.66 ? 474 PHE A CZ 1 +ATOM 3870 N N . PRO A 1 475 ? -1.573 31.210 98.886 1.00 37.47 ? 475 PRO A N 1 +ATOM 3871 C CA . PRO A 1 475 ? -1.949 32.575 98.507 1.00 38.36 ? 475 PRO A CA 1 +ATOM 3872 C C . PRO A 1 475 ? -3.210 32.595 97.634 1.00 39.61 ? 475 PRO A C 1 +ATOM 3873 O O . PRO A 1 475 ? -4.154 33.349 97.895 1.00 40.02 ? 475 PRO A O 1 +ATOM 3874 C CB . PRO A 1 475 ? -0.717 33.066 97.759 1.00 37.69 ? 475 PRO A CB 1 +ATOM 3875 C CG . PRO A 1 475 ? 0.395 32.386 98.512 1.00 36.94 ? 475 PRO A CG 1 +ATOM 3876 C CD . PRO A 1 475 ? -0.134 30.981 98.665 1.00 36.13 ? 475 PRO A CD 1 +ATOM 3877 N N . PHE A 1 476 ? -3.217 31.759 96.599 1.00 39.36 ? 476 PHE A N 1 +ATOM 3878 C CA . PHE A 1 476 ? -4.353 31.675 95.683 1.00 38.29 ? 476 PHE A CA 1 +ATOM 3879 C C . PHE A 1 476 ? -5.259 30.513 96.111 1.00 38.48 ? 476 PHE A C 1 +ATOM 3880 O O . PHE A 1 476 ? -4.838 29.345 96.109 1.00 37.25 ? 476 PHE A O 1 +ATOM 3881 C CB . PHE A 1 476 ? -3.839 31.475 94.257 1.00 38.03 ? 476 PHE A CB 1 +ATOM 3882 C CG . PHE A 1 476 ? -4.908 31.578 93.212 1.00 38.25 ? 476 PHE A CG 1 +ATOM 3883 C CD1 . PHE A 1 476 ? -5.695 32.725 93.112 1.00 36.41 ? 476 PHE A CD1 1 +ATOM 3884 C CD2 . PHE A 1 476 ? -5.137 30.528 92.335 1.00 36.27 ? 476 PHE A CD2 1 +ATOM 3885 C CE1 . PHE A 1 476 ? -6.696 32.822 92.152 1.00 35.35 ? 476 PHE A CE1 1 +ATOM 3886 C CE2 . PHE A 1 476 ? -6.136 30.617 91.371 1.00 38.28 ? 476 PHE A CE2 1 +ATOM 3887 C CZ . PHE A 1 476 ? -6.919 31.773 91.281 1.00 36.13 ? 476 PHE A CZ 1 +ATOM 3888 N N . TYR A 1 477 ? -6.504 30.847 96.464 1.00 37.23 ? 477 TYR A N 1 +ATOM 3889 C CA . TYR A 1 477 ? -7.485 29.879 96.960 1.00 34.81 ? 477 TYR A CA 1 +ATOM 3890 C C . TYR A 1 477 ? -8.712 29.794 96.043 1.00 36.21 ? 477 TYR A C 1 +ATOM 3891 O O . TYR A 1 477 ? -9.719 30.474 96.269 1.00 35.63 ? 477 TYR A O 1 +ATOM 3892 C CB . TYR A 1 477 ? -7.919 30.316 98.360 1.00 31.45 ? 477 TYR A CB 1 +ATOM 3893 C CG . TYR A 1 477 ? -8.492 29.239 99.246 1.00 31.61 ? 477 TYR A CG 1 +ATOM 3894 C CD1 . TYR A 1 477 ? -7.667 28.278 99.839 1.00 30.45 ? 477 TYR A CD1 1 +ATOM 3895 C CD2 . TYR A 1 477 ? -9.858 29.201 99.530 1.00 31.73 ? 477 TYR A CD2 1 +ATOM 3896 C CE1 . TYR A 1 477 ? -8.187 27.309 100.696 1.00 29.96 ? 477 TYR A CE1 1 +ATOM 3897 C CE2 . TYR A 1 477 ? -10.390 28.236 100.387 1.00 31.36 ? 477 TYR A CE2 1 +ATOM 3898 C CZ . TYR A 1 477 ? -9.548 27.295 100.966 1.00 32.82 ? 477 TYR A CZ 1 +ATOM 3899 O OH . TYR A 1 477 ? -10.075 26.357 101.827 1.00 34.80 ? 477 TYR A OH 1 +ATOM 3900 N N . ARG A 1 478 ? -8.639 28.934 95.032 1.00 37.22 ? 478 ARG A N 1 +ATOM 3901 C CA . ARG A 1 478 ? -9.736 28.785 94.086 1.00 36.93 ? 478 ARG A CA 1 +ATOM 3902 C C . ARG A 1 478 ? -10.209 27.350 93.850 1.00 38.40 ? 478 ARG A C 1 +ATOM 3903 O O . ARG A 1 478 ? -9.408 26.416 93.774 1.00 37.92 ? 478 ARG A O 1 +ATOM 3904 C CB . ARG A 1 478 ? -9.333 29.387 92.743 1.00 36.59 ? 478 ARG A CB 1 +ATOM 3905 C CG . ARG A 1 478 ? -10.406 29.260 91.676 1.00 40.09 ? 478 ARG A CG 1 +ATOM 3906 C CD . ARG A 1 478 ? -9.948 29.764 90.304 1.00 41.06 ? 478 ARG A CD 1 +ATOM 3907 N NE . ARG A 1 478 ? -8.949 28.883 89.703 1.00 42.70 ? 478 ARG A NE 1 +ATOM 3908 C CZ . ARG A 1 478 ? -8.741 28.774 88.393 1.00 43.55 ? 478 ARG A CZ 1 +ATOM 3909 N NH1 . ARG A 1 478 ? -9.466 29.492 87.542 1.00 43.77 ? 478 ARG A NH1 1 +ATOM 3910 N NH2 . ARG A 1 478 ? -7.812 27.942 87.932 1.00 43.72 ? 478 ARG A NH2 1 +ATOM 3911 N N . SER A 1 479 ? -11.525 27.195 93.731 1.00 38.78 ? 479 SER A N 1 +ATOM 3912 C CA . SER A 1 479 ? -12.145 25.911 93.442 1.00 38.35 ? 479 SER A CA 1 +ATOM 3913 C C . SER A 1 479 ? -12.451 25.956 91.946 1.00 39.59 ? 479 SER A C 1 +ATOM 3914 O O . SER A 1 479 ? -13.141 26.865 91.478 1.00 40.95 ? 479 SER A O 1 +ATOM 3915 C CB . SER A 1 479 ? -13.444 25.774 94.214 1.00 40.14 ? 479 SER A CB 1 +ATOM 3916 O OG . SER A 1 479 ? -14.157 24.628 93.785 1.00 46.00 ? 479 SER A OG 1 +ATOM 3917 N N . HIS A 1 480 ? -11.937 24.991 91.193 1.00 39.19 ? 480 HIS A N 1 +ATOM 3918 C CA . HIS A 1 480 ? -12.147 24.951 89.746 1.00 38.38 ? 480 HIS A CA 1 +ATOM 3919 C C . HIS A 1 480 ? -12.351 23.494 89.345 1.00 38.86 ? 480 HIS A C 1 +ATOM 3920 O O . HIS A 1 480 ? -11.684 22.598 89.873 1.00 39.74 ? 480 HIS A O 1 +ATOM 3921 C CB . HIS A 1 480 ? -10.922 25.548 89.034 1.00 38.05 ? 480 HIS A CB 1 +ATOM 3922 C CG . HIS A 1 480 ? -11.074 25.677 87.549 1.00 38.39 ? 480 HIS A CG 1 +ATOM 3923 N ND1 . HIS A 1 480 ? -12.174 26.261 86.960 1.00 39.00 ? 480 HIS A ND1 1 +ATOM 3924 C CD2 . HIS A 1 480 ? -10.240 25.339 86.535 1.00 38.02 ? 480 HIS A CD2 1 +ATOM 3925 C CE1 . HIS A 1 480 ? -12.011 26.279 85.648 1.00 38.92 ? 480 HIS A CE1 1 +ATOM 3926 N NE2 . HIS A 1 480 ? -10.844 25.725 85.364 1.00 37.97 ? 480 HIS A NE2 1 +ATOM 3927 N N . LYS A 1 481 ? -13.265 23.255 88.410 1.00 37.74 ? 481 LYS A N 1 +ATOM 3928 C CA . LYS A 1 481 ? -13.569 21.895 87.985 1.00 36.58 ? 481 LYS A CA 1 +ATOM 3929 C C . LYS A 1 481 ? -13.882 21.830 86.492 1.00 35.29 ? 481 LYS A C 1 +ATOM 3930 O O . LYS A 1 481 ? -14.400 22.787 85.924 1.00 36.02 ? 481 LYS A O 1 +ATOM 3931 C CB . LYS A 1 481 ? -14.757 21.379 88.809 1.00 36.69 ? 481 LYS A CB 1 +ATOM 3932 C CG . LYS A 1 481 ? -15.291 20.009 88.407 1.00 38.22 ? 481 LYS A CG 1 +ATOM 3933 C CD . LYS A 1 481 ? -14.283 18.883 88.649 1.00 39.34 ? 481 LYS A CD 1 +ATOM 3934 C CE . LYS A 1 481 ? -14.070 18.603 90.127 1.00 40.66 ? 481 LYS A CE 1 +ATOM 3935 N NZ . LYS A 1 481 ? -13.172 17.428 90.331 1.00 42.66 ? 481 LYS A NZ 1 +ATOM 3936 N N . ALA A 1 482 ? -13.559 20.701 85.866 1.00 32.71 ? 482 ALA A N 1 +ATOM 3937 C CA . ALA A 1 482 ? -13.804 20.504 84.441 1.00 31.48 ? 482 ALA A CA 1 +ATOM 3938 C C . ALA A 1 482 ? -15.297 20.342 84.139 1.00 31.37 ? 482 ALA A C 1 +ATOM 3939 O O . ALA A 1 482 ? -16.099 20.069 85.031 1.00 29.94 ? 482 ALA A O 1 +ATOM 3940 C CB . ALA A 1 482 ? -13.035 19.296 83.942 1.00 29.19 ? 482 ALA A CB 1 +ATOM 3941 N N . THR A 1 483 ? -15.652 20.492 82.867 1.00 31.70 ? 483 THR A N 1 +ATOM 3942 C CA . THR A 1 483 ? -17.038 20.415 82.428 1.00 33.96 ? 483 THR A CA 1 +ATOM 3943 C C . THR A 1 483 ? -17.836 19.202 82.860 1.00 34.51 ? 483 THR A C 1 +ATOM 3944 O O . THR A 1 483 ? -18.966 19.342 83.309 1.00 34.41 ? 483 THR A O 1 +ATOM 3945 C CB . THR A 1 483 ? -17.138 20.508 80.903 1.00 33.18 ? 483 THR A CB 1 +ATOM 3946 O OG1 . THR A 1 483 ? -16.128 21.400 80.413 1.00 33.61 ? 483 THR A OG1 1 +ATOM 3947 C CG2 . THR A 1 483 ? -18.501 21.055 80.511 1.00 33.53 ? 483 THR A CG2 1 +ATOM 3948 N N . ASP A 1 484 ? -17.259 18.013 82.725 1.00 37.75 ? 484 ASP A N 1 +ATOM 3949 C CA . ASP A 1 484 ? -17.974 16.792 83.089 1.00 39.67 ? 484 ASP A CA 1 +ATOM 3950 C C . ASP A 1 484 ? -17.746 16.321 84.518 1.00 39.60 ? 484 ASP A C 1 +ATOM 3951 O O . ASP A 1 484 ? -18.099 15.193 84.863 1.00 39.36 ? 484 ASP A O 1 +ATOM 3952 C CB . ASP A 1 484 ? -17.630 15.667 82.108 1.00 41.90 ? 484 ASP A CB 1 +ATOM 3953 C CG . ASP A 1 484 ? -16.222 15.106 82.313 1.00 47.31 ? 484 ASP A CG 1 +ATOM 3954 O OD1 . ASP A 1 484 ? -15.319 15.871 82.731 1.00 48.80 ? 484 ASP A OD1 1 +ATOM 3955 O OD2 . ASP A 1 484 ? -16.019 13.894 82.035 1.00 48.23 ? 484 ASP A OD2 1 +ATOM 3956 N N . GLY A 1 485 ? -17.163 17.182 85.348 1.00 39.73 ? 485 GLY A N 1 +ATOM 3957 C CA . GLY A 1 485 ? -16.931 16.818 86.732 1.00 40.96 ? 485 GLY A CA 1 +ATOM 3958 C C . GLY A 1 485 ? -18.170 17.113 87.554 1.00 42.54 ? 485 GLY A C 1 +ATOM 3959 O O . GLY A 1 485 ? -18.990 17.948 87.171 1.00 42.53 ? 485 GLY A O 1 +ATOM 3960 N N . ILE A 1 486 ? -18.323 16.428 88.681 1.00 44.89 ? 486 ILE A N 1 +ATOM 3961 C CA . ILE A 1 486 ? -19.480 16.651 89.542 1.00 46.42 ? 486 ILE A CA 1 +ATOM 3962 C C . ILE A 1 486 ? -19.416 18.092 90.035 1.00 46.40 ? 486 ILE A C 1 +ATOM 3963 O O . ILE A 1 486 ? -18.353 18.709 89.998 1.00 44.67 ? 486 ILE A O 1 +ATOM 3964 C CB . ILE A 1 486 ? -19.453 15.707 90.769 1.00 47.56 ? 486 ILE A CB 1 +ATOM 3965 C CG1 . ILE A 1 486 ? -18.138 15.897 91.530 1.00 48.70 ? 486 ILE A CG1 1 +ATOM 3966 C CG2 . ILE A 1 486 ? -19.612 14.253 90.326 1.00 46.96 ? 486 ILE A CG2 1 +ATOM 3967 C CD1 . ILE A 1 486 ? -18.037 15.075 92.795 1.00 51.24 ? 486 ILE A CD1 1 +ATOM 3968 N N . ASP A 1 487 ? -20.551 18.632 90.474 1.00 47.50 ? 487 ASP A N 1 +ATOM 3969 C CA . ASP A 1 487 ? -20.582 19.997 91.004 1.00 49.31 ? 487 ASP A CA 1 +ATOM 3970 C C . ASP A 1 487 ? -19.850 19.964 92.340 1.00 48.97 ? 487 ASP A C 1 +ATOM 3971 O O . ASP A 1 487 ? -20.217 19.206 93.232 1.00 50.00 ? 487 ASP A O 1 +ATOM 3972 C CB . ASP A 1 487 ? -22.027 20.469 91.212 1.00 51.09 ? 487 ASP A CB 1 +ATOM 3973 C CG . ASP A 1 487 ? -22.741 20.770 89.899 1.00 54.81 ? 487 ASP A CG 1 +ATOM 3974 O OD1 . ASP A 1 487 ? -22.282 21.677 89.160 1.00 56.65 ? 487 ASP A OD1 1 +ATOM 3975 O OD2 . ASP A 1 487 ? -23.758 20.100 89.606 1.00 55.79 ? 487 ASP A OD2 1 +ATOM 3976 N N . THR A 1 488 ? -18.813 20.780 92.480 1.00 48.93 ? 488 THR A N 1 +ATOM 3977 C CA . THR A 1 488 ? -18.040 20.784 93.713 1.00 48.96 ? 488 THR A CA 1 +ATOM 3978 C C . THR A 1 488 ? -18.240 21.995 94.619 1.00 49.34 ? 488 THR A C 1 +ATOM 3979 O O . THR A 1 488 ? -17.527 22.140 95.614 1.00 49.55 ? 488 THR A O 1 +ATOM 3980 C CB . THR A 1 488 ? -16.531 20.636 93.424 1.00 48.96 ? 488 THR A CB 1 +ATOM 3981 O OG1 . THR A 1 488 ? -16.089 21.710 92.576 1.00 48.35 ? 488 THR A OG1 1 +ATOM 3982 C CG2 . THR A 1 488 ? -16.251 19.290 92.756 1.00 47.93 ? 488 THR A CG2 1 +ATOM 3983 N N . GLU A 1 489 ? -19.189 22.866 94.284 1.00 49.31 ? 489 GLU A N 1 +ATOM 3984 C CA . GLU A 1 489 ? -19.445 24.028 95.128 1.00 49.33 ? 489 GLU A CA 1 +ATOM 3985 C C . GLU A 1 489 ? -19.954 23.487 96.465 1.00 48.12 ? 489 GLU A C 1 +ATOM 3986 O O . GLU A 1 489 ? -20.736 22.539 96.505 1.00 46.57 ? 489 GLU A O 1 +ATOM 3987 C CB . GLU A 1 489 ? -20.506 24.944 94.513 1.00 51.51 ? 489 GLU A CB 1 +ATOM 3988 C CG . GLU A 1 489 ? -20.159 25.528 93.147 1.00 55.68 ? 489 GLU A CG 1 +ATOM 3989 C CD . GLU A 1 489 ? -20.077 24.473 92.048 1.00 57.38 ? 489 GLU A CD 1 +ATOM 3990 O OE1 . GLU A 1 489 ? -20.949 23.578 92.003 1.00 57.52 ? 489 GLU A OE1 1 +ATOM 3991 O OE2 . GLU A 1 489 ? -19.144 24.551 91.220 1.00 58.05 ? 489 GLU A OE2 1 +ATOM 3992 N N . PRO A 1 490 ? -19.509 24.085 97.576 1.00 47.31 ? 490 PRO A N 1 +ATOM 3993 C CA . PRO A 1 490 ? -19.895 23.687 98.931 1.00 46.76 ? 490 PRO A CA 1 +ATOM 3994 C C . PRO A 1 490 ? -21.405 23.598 99.164 1.00 46.71 ? 490 PRO A C 1 +ATOM 3995 O O . PRO A 1 490 ? -21.872 22.735 99.910 1.00 46.98 ? 490 PRO A O 1 +ATOM 3996 C CB . PRO A 1 490 ? -19.246 24.759 99.792 1.00 47.65 ? 490 PRO A CB 1 +ATOM 3997 C CG . PRO A 1 490 ? -18.036 25.130 99.001 1.00 48.49 ? 490 PRO A CG 1 +ATOM 3998 C CD . PRO A 1 490 ? -18.579 25.224 97.614 1.00 47.84 ? 490 PRO A CD 1 +ATOM 3999 N N . VAL A 1 491 ? -22.166 24.487 98.533 1.00 45.58 ? 491 VAL A N 1 +ATOM 4000 C CA . VAL A 1 491 ? -23.611 24.488 98.708 1.00 45.96 ? 491 VAL A CA 1 +ATOM 4001 C C . VAL A 1 491 ? -24.282 23.204 98.237 1.00 45.83 ? 491 VAL A C 1 +ATOM 4002 O O . VAL A 1 491 ? -25.440 22.959 98.564 1.00 46.74 ? 491 VAL A O 1 +ATOM 4003 C CB . VAL A 1 491 ? -24.270 25.684 97.978 1.00 46.39 ? 491 VAL A CB 1 +ATOM 4004 C CG1 . VAL A 1 491 ? -23.845 26.985 98.634 1.00 48.49 ? 491 VAL A CG1 1 +ATOM 4005 C CG2 . VAL A 1 491 ? -23.888 25.681 96.509 1.00 47.34 ? 491 VAL A CG2 1 +ATOM 4006 N N . PHE A 1 492 ? -23.561 22.385 97.475 1.00 45.66 ? 492 PHE A N 1 +ATOM 4007 C CA . PHE A 1 492 ? -24.125 21.132 96.966 1.00 45.35 ? 492 PHE A CA 1 +ATOM 4008 C C . PHE A 1 492 ? -23.708 19.914 97.781 1.00 44.22 ? 492 PHE A C 1 +ATOM 4009 O O . PHE A 1 492 ? -24.031 18.779 97.433 1.00 45.50 ? 492 PHE A O 1 +ATOM 4010 C CB . PHE A 1 492 ? -23.727 20.916 95.501 1.00 44.12 ? 492 PHE A CB 1 +ATOM 4011 C CG . PHE A 1 492 ? -24.233 21.980 94.572 1.00 45.58 ? 492 PHE A CG 1 +ATOM 4012 C CD1 . PHE A 1 492 ? -25.598 22.220 94.441 1.00 46.28 ? 492 PHE A CD1 1 +ATOM 4013 C CD2 . PHE A 1 492 ? -23.344 22.746 93.825 1.00 45.88 ? 492 PHE A CD2 1 +ATOM 4014 C CE1 . PHE A 1 492 ? -26.068 23.208 93.579 1.00 46.73 ? 492 PHE A CE1 1 +ATOM 4015 C CE2 . PHE A 1 492 ? -23.805 23.735 92.960 1.00 46.15 ? 492 PHE A CE2 1 +ATOM 4016 C CZ . PHE A 1 492 ? -25.168 23.966 92.837 1.00 46.40 ? 492 PHE A CZ 1 +ATOM 4017 N N . LEU A 1 493 ? -23.001 20.154 98.874 1.00 42.84 ? 493 LEU A N 1 +ATOM 4018 C CA . LEU A 1 493 ? -22.540 19.077 99.735 1.00 42.42 ? 493 LEU A CA 1 +ATOM 4019 C C . LEU A 1 493 ? -23.512 18.770 100.877 1.00 43.11 ? 493 LEU A C 1 +ATOM 4020 O O . LEU A 1 493 ? -24.269 19.637 101.308 1.00 43.15 ? 493 LEU A O 1 +ATOM 4021 C CB . LEU A 1 493 ? -21.190 19.457 100.345 1.00 42.09 ? 493 LEU A CB 1 +ATOM 4022 C CG . LEU A 1 493 ? -19.950 19.554 99.461 1.00 41.28 ? 493 LEU A CG 1 +ATOM 4023 C CD1 . LEU A 1 493 ? -18.827 20.203 100.245 1.00 39.21 ? 493 LEU A CD1 1 +ATOM 4024 C CD2 . LEU A 1 493 ? -19.555 18.162 98.989 1.00 40.51 ? 493 LEU A CD2 1 +ATOM 4025 N N . PRO A 1 494 ? -23.514 17.519 101.369 1.00 43.85 ? 494 PRO A N 1 +ATOM 4026 C CA . PRO A 1 494 ? -24.412 17.174 102.481 1.00 44.38 ? 494 PRO A CA 1 +ATOM 4027 C C . PRO A 1 494 ? -23.973 18.054 103.653 1.00 45.30 ? 494 PRO A C 1 +ATOM 4028 O O . PRO A 1 494 ? -22.788 18.391 103.758 1.00 45.34 ? 494 PRO A O 1 +ATOM 4029 C CB . PRO A 1 494 ? -24.104 15.701 102.731 1.00 42.89 ? 494 PRO A CB 1 +ATOM 4030 C CG . PRO A 1 494 ? -23.751 15.205 101.368 1.00 44.60 ? 494 PRO A CG 1 +ATOM 4031 C CD . PRO A 1 494 ? -22.871 16.314 100.821 1.00 43.14 ? 494 PRO A CD 1 +ATOM 4032 N N . ASP A 1 495 ? -24.907 18.426 104.522 1.00 45.79 ? 495 ASP A N 1 +ATOM 4033 C CA . ASP A 1 495 ? -24.585 19.291 105.653 1.00 47.63 ? 495 ASP A CA 1 +ATOM 4034 C C . ASP A 1 495 ? -23.287 18.936 106.373 1.00 45.90 ? 495 ASP A C 1 +ATOM 4035 O O . ASP A 1 495 ? -22.503 19.815 106.705 1.00 44.74 ? 495 ASP A O 1 +ATOM 4036 C CB . ASP A 1 495 ? -25.748 19.310 106.648 1.00 52.11 ? 495 ASP A CB 1 +ATOM 4037 C CG . ASP A 1 495 ? -27.003 19.954 106.064 1.00 57.44 ? 495 ASP A CG 1 +ATOM 4038 O OD1 . ASP A 1 495 ? -26.911 21.110 105.587 1.00 60.37 ? 495 ASP A OD1 1 +ATOM 4039 O OD2 . ASP A 1 495 ? -28.081 19.310 106.080 1.00 60.50 ? 495 ASP A OD2 1 +ATOM 4040 N N . TYR A 1 496 ? -23.053 17.648 106.600 1.00 45.13 ? 496 TYR A N 1 +ATOM 4041 C CA . TYR A 1 496 ? -21.841 17.206 107.281 1.00 43.77 ? 496 TYR A CA 1 +ATOM 4042 C C . TYR A 1 496 ? -20.566 17.768 106.651 1.00 42.96 ? 496 TYR A C 1 +ATOM 4043 O O . TYR A 1 496 ? -19.722 18.324 107.343 1.00 42.79 ? 496 TYR A O 1 +ATOM 4044 C CB . TYR A 1 496 ? -21.766 15.679 107.285 1.00 43.61 ? 496 TYR A CB 1 +ATOM 4045 C CG . TYR A 1 496 ? -20.519 15.144 107.955 1.00 43.16 ? 496 TYR A CG 1 +ATOM 4046 C CD1 . TYR A 1 496 ? -20.402 15.125 109.345 1.00 42.91 ? 496 TYR A CD1 1 +ATOM 4047 C CD2 . TYR A 1 496 ? -19.442 14.693 107.197 1.00 42.28 ? 496 TYR A CD2 1 +ATOM 4048 C CE1 . TYR A 1 496 ? -19.239 14.669 109.958 1.00 42.78 ? 496 TYR A CE1 1 +ATOM 4049 C CE2 . TYR A 1 496 ? -18.280 14.241 107.794 1.00 43.14 ? 496 TYR A CE2 1 +ATOM 4050 C CZ . TYR A 1 496 ? -18.180 14.231 109.173 1.00 44.32 ? 496 TYR A CZ 1 +ATOM 4051 O OH . TYR A 1 496 ? -17.010 13.787 109.755 1.00 45.31 ? 496 TYR A OH 1 +ATOM 4052 N N . TYR A 1 497 ? -20.432 17.615 105.338 1.00 43.22 ? 497 TYR A N 1 +ATOM 4053 C CA . TYR A 1 497 ? -19.256 18.101 104.618 1.00 42.34 ? 497 TYR A CA 1 +ATOM 4054 C C . TYR A 1 497 ? -19.302 19.603 104.366 1.00 41.50 ? 497 TYR A C 1 +ATOM 4055 O O . TYR A 1 497 ? -18.278 20.280 104.409 1.00 40.12 ? 497 TYR A O 1 +ATOM 4056 C CB . TYR A 1 497 ? -19.112 17.348 103.293 1.00 41.94 ? 497 TYR A CB 1 +ATOM 4057 C CG . TYR A 1 497 ? -18.783 15.892 103.486 1.00 43.29 ? 497 TYR A CG 1 +ATOM 4058 C CD1 . TYR A 1 497 ? -17.538 15.501 103.972 1.00 44.50 ? 497 TYR A CD1 1 +ATOM 4059 C CD2 . TYR A 1 497 ? -19.727 14.904 103.229 1.00 44.17 ? 497 TYR A CD2 1 +ATOM 4060 C CE1 . TYR A 1 497 ? -17.243 14.164 104.198 1.00 43.72 ? 497 TYR A CE1 1 +ATOM 4061 C CE2 . TYR A 1 497 ? -19.441 13.564 103.455 1.00 44.53 ? 497 TYR A CE2 1 +ATOM 4062 C CZ . TYR A 1 497 ? -18.197 13.203 103.939 1.00 45.15 ? 497 TYR A CZ 1 +ATOM 4063 O OH . TYR A 1 497 ? -17.902 11.873 104.160 1.00 49.16 ? 497 TYR A OH 1 +ATOM 4064 N N . LYS A 1 498 ? -20.495 20.117 104.099 1.00 41.94 ? 498 LYS A N 1 +ATOM 4065 C CA . LYS A 1 498 ? -20.661 21.537 103.844 1.00 41.93 ? 498 LYS A CA 1 +ATOM 4066 C C . LYS A 1 498 ? -20.174 22.352 105.034 1.00 41.96 ? 498 LYS A C 1 +ATOM 4067 O O . LYS A 1 498 ? -19.497 23.364 104.862 1.00 42.15 ? 498 LYS A O 1 +ATOM 4068 C CB . LYS A 1 498 ? -22.130 21.855 103.551 1.00 42.68 ? 498 LYS A CB 1 +ATOM 4069 C CG . LYS A 1 498 ? -22.430 23.343 103.423 1.00 45.09 ? 498 LYS A CG 1 +ATOM 4070 C CD . LYS A 1 498 ? -23.762 23.594 102.738 1.00 47.00 ? 498 LYS A CD 1 +ATOM 4071 C CE . LYS A 1 498 ? -24.916 22.960 103.487 1.00 48.69 ? 498 LYS A CE 1 +ATOM 4072 N NZ . LYS A 1 498 ? -26.204 23.096 102.741 1.00 52.80 ? 498 LYS A NZ 1 +ATOM 4073 N N . GLU A 1 499 ? -20.512 21.911 106.242 1.00 42.40 ? 499 GLU A N 1 +ATOM 4074 C CA . GLU A 1 499 ? -20.093 22.623 107.440 1.00 42.87 ? 499 GLU A CA 1 +ATOM 4075 C C . GLU A 1 499 ? -18.581 22.631 107.584 1.00 42.21 ? 499 GLU A C 1 +ATOM 4076 O O . GLU A 1 499 ? -18.001 23.627 108.018 1.00 42.56 ? 499 GLU A O 1 +ATOM 4077 C CB . GLU A 1 499 ? -20.720 22.014 108.694 1.00 44.83 ? 499 GLU A CB 1 +ATOM 4078 C CG . GLU A 1 499 ? -21.861 22.838 109.270 1.00 52.14 ? 499 GLU A CG 1 +ATOM 4079 C CD . GLU A 1 499 ? -21.488 24.314 109.510 1.00 55.99 ? 499 GLU A CD 1 +ATOM 4080 O OE1 . GLU A 1 499 ? -20.532 24.587 110.277 1.00 57.34 ? 499 GLU A OE1 1 +ATOM 4081 O OE2 . GLU A 1 499 ? -22.160 25.202 108.930 1.00 57.79 ? 499 GLU A OE2 1 +ATOM 4082 N N . LYS A 1 500 ? -17.937 21.525 107.226 1.00 40.93 ? 500 LYS A N 1 +ATOM 4083 C CA . LYS A 1 500 ? -16.482 21.461 107.322 1.00 40.32 ? 500 LYS A CA 1 +ATOM 4084 C C . LYS A 1 500 ? -15.806 22.439 106.379 1.00 38.80 ? 500 LYS A C 1 +ATOM 4085 O O . LYS A 1 500 ? -14.839 23.101 106.760 1.00 39.85 ? 500 LYS A O 1 +ATOM 4086 C CB . LYS A 1 500 ? -15.976 20.046 107.049 1.00 40.61 ? 500 LYS A CB 1 +ATOM 4087 C CG . LYS A 1 500 ? -16.220 19.079 108.199 1.00 41.27 ? 500 LYS A CG 1 +ATOM 4088 C CD . LYS A 1 500 ? -15.614 17.720 107.904 1.00 45.40 ? 500 LYS A CD 1 +ATOM 4089 C CE . LYS A 1 500 ? -15.935 16.712 108.991 1.00 47.36 ? 500 LYS A CE 1 +ATOM 4090 N NZ . LYS A 1 500 ? -15.436 17.168 110.322 1.00 50.24 ? 500 LYS A NZ 1 +ATOM 4091 N N . VAL A 1 501 ? -16.310 22.542 105.153 1.00 39.00 ? 501 VAL A N 1 +ATOM 4092 C CA . VAL A 1 501 ? -15.729 23.468 104.184 1.00 38.85 ? 501 VAL A CA 1 +ATOM 4093 C C . VAL A 1 501 ? -15.960 24.900 104.652 1.00 39.42 ? 501 VAL A C 1 +ATOM 4094 O O . VAL A 1 501 ? -15.072 25.747 104.553 1.00 39.50 ? 501 VAL A O 1 +ATOM 4095 C CB . VAL A 1 501 ? -16.345 23.276 102.777 1.00 39.12 ? 501 VAL A CB 1 +ATOM 4096 C CG1 . VAL A 1 501 ? -15.799 24.348 101.807 1.00 36.16 ? 501 VAL A CG1 1 +ATOM 4097 C CG2 . VAL A 1 501 ? -16.009 21.878 102.255 1.00 36.96 ? 501 VAL A CG2 1 +ATOM 4098 N N . LYS A 1 502 ? -17.155 25.150 105.179 1.00 40.36 ? 502 LYS A N 1 +ATOM 4099 C CA . LYS A 1 502 ? -17.542 26.464 105.685 1.00 41.37 ? 502 LYS A CA 1 +ATOM 4100 C C . LYS A 1 502 ? -16.591 26.915 106.797 1.00 42.34 ? 502 LYS A C 1 +ATOM 4101 O O . LYS A 1 502 ? -16.135 28.060 106.811 1.00 43.01 ? 502 LYS A O 1 +ATOM 4102 C CB . LYS A 1 502 ? -18.976 26.393 106.217 1.00 42.80 ? 502 LYS A CB 1 +ATOM 4103 C CG . LYS A 1 502 ? -19.650 27.715 106.526 1.00 44.06 ? 502 LYS A CG 1 +ATOM 4104 C CD . LYS A 1 502 ? -21.124 27.459 106.866 1.00 46.50 ? 502 LYS A CD 1 +ATOM 4105 C CE . LYS A 1 502 ? -21.900 28.748 107.083 1.00 48.48 ? 502 LYS A CE 1 +ATOM 4106 N NZ . LYS A 1 502 ? -21.376 29.535 108.233 1.00 51.39 ? 502 LYS A NZ 1 +ATOM 4107 N N . GLU A 1 503 ? -16.281 26.018 107.725 1.00 41.85 ? 503 GLU A N 1 +ATOM 4108 C CA . GLU A 1 503 ? -15.386 26.375 108.816 1.00 43.31 ? 503 GLU A CA 1 +ATOM 4109 C C . GLU A 1 503 ? -13.950 26.589 108.343 1.00 41.93 ? 503 GLU A C 1 +ATOM 4110 O O . GLU A 1 503 ? -13.226 27.414 108.899 1.00 42.76 ? 503 GLU A O 1 +ATOM 4111 C CB . GLU A 1 503 ? -15.428 25.303 109.903 1.00 46.56 ? 503 GLU A CB 1 +ATOM 4112 C CG . GLU A 1 503 ? -16.839 25.045 110.404 1.00 53.23 ? 503 GLU A CG 1 +ATOM 4113 C CD . GLU A 1 503 ? -16.904 24.017 111.528 1.00 58.16 ? 503 GLU A CD 1 +ATOM 4114 O OE1 . GLU A 1 503 ? -16.170 22.997 111.474 1.00 59.31 ? 503 GLU A OE1 1 +ATOM 4115 O OE2 . GLU A 1 503 ? -17.711 24.227 112.463 1.00 60.51 ? 503 GLU A OE2 1 +ATOM 4116 N N . ILE A 1 504 ? -13.536 25.854 107.316 1.00 39.72 ? 504 ILE A N 1 +ATOM 4117 C CA . ILE A 1 504 ? -12.183 26.005 106.796 1.00 37.34 ? 504 ILE A CA 1 +ATOM 4118 C C . ILE A 1 504 ? -12.043 27.364 106.107 1.00 36.95 ? 504 ILE A C 1 +ATOM 4119 O O . ILE A 1 504 ? -11.046 28.065 106.298 1.00 36.78 ? 504 ILE A O 1 +ATOM 4120 C CB . ILE A 1 504 ? -11.847 24.877 105.799 1.00 36.38 ? 504 ILE A CB 1 +ATOM 4121 C CG1 . ILE A 1 504 ? -11.745 23.545 106.549 1.00 34.15 ? 504 ILE A CG1 1 +ATOM 4122 C CG2 . ILE A 1 504 ? -10.557 25.201 105.049 1.00 34.39 ? 504 ILE A CG2 1 +ATOM 4123 C CD1 . ILE A 1 504 ? -11.654 22.338 105.654 1.00 31.89 ? 504 ILE A CD1 1 +ATOM 4124 N N . VAL A 1 505 ? -13.046 27.738 105.317 1.00 35.95 ? 505 VAL A N 1 +ATOM 4125 C CA . VAL A 1 505 ? -13.015 29.016 104.612 1.00 36.69 ? 505 VAL A CA 1 +ATOM 4126 C C . VAL A 1 505 ? -13.065 30.177 105.611 1.00 36.38 ? 505 VAL A C 1 +ATOM 4127 O O . VAL A 1 505 ? -12.394 31.200 105.433 1.00 36.03 ? 505 VAL A O 1 +ATOM 4128 C CB . VAL A 1 505 ? -14.198 29.129 103.598 1.00 37.33 ? 505 VAL A CB 1 +ATOM 4129 C CG1 . VAL A 1 505 ? -14.219 30.514 102.955 1.00 35.39 ? 505 VAL A CG1 1 +ATOM 4130 C CG2 . VAL A 1 505 ? -14.059 28.064 102.520 1.00 34.62 ? 505 VAL A CG2 1 +ATOM 4131 N N . GLU A 1 506 ? -13.856 30.023 106.665 1.00 37.57 ? 506 GLU A N 1 +ATOM 4132 C CA . GLU A 1 506 ? -13.939 31.070 107.676 1.00 39.29 ? 506 GLU A CA 1 +ATOM 4133 C C . GLU A 1 506 ? -12.592 31.209 108.368 1.00 37.89 ? 506 GLU A C 1 +ATOM 4134 O O . GLU A 1 506 ? -12.164 32.317 108.676 1.00 39.15 ? 506 GLU A O 1 +ATOM 4135 C CB . GLU A 1 506 ? -15.031 30.756 108.696 1.00 40.19 ? 506 GLU A CB 1 +ATOM 4136 C CG . GLU A 1 506 ? -16.409 30.722 108.071 1.00 46.08 ? 506 GLU A CG 1 +ATOM 4137 C CD . GLU A 1 506 ? -17.514 30.358 109.057 1.00 51.94 ? 506 GLU A CD 1 +ATOM 4138 O OE1 . GLU A 1 506 ? -17.268 29.521 109.961 1.00 54.96 ? 506 GLU A OE1 1 +ATOM 4139 O OE2 . GLU A 1 506 ? -18.641 30.893 108.914 1.00 54.54 ? 506 GLU A OE2 1 +ATOM 4140 N N . LEU A 1 507 ? -11.910 30.089 108.589 1.00 37.07 ? 507 LEU A N 1 +ATOM 4141 C CA . LEU A 1 507 ? -10.611 30.132 109.239 1.00 36.49 ? 507 LEU A CA 1 +ATOM 4142 C C . LEU A 1 507 ? -9.602 30.820 108.332 1.00 36.86 ? 507 LEU A C 1 +ATOM 4143 O O . LEU A 1 507 ? -8.686 31.486 108.807 1.00 37.79 ? 507 LEU A O 1 +ATOM 4144 C CB . LEU A 1 507 ? -10.130 28.724 109.583 1.00 36.68 ? 507 LEU A CB 1 +ATOM 4145 C CG . LEU A 1 507 ? -8.821 28.668 110.383 1.00 38.23 ? 507 LEU A CG 1 +ATOM 4146 C CD1 . LEU A 1 507 ? -9.034 29.313 111.755 1.00 37.98 ? 507 LEU A CD1 1 +ATOM 4147 C CD2 . LEU A 1 507 ? -8.368 27.223 110.544 1.00 36.80 ? 507 LEU A CD2 1 +ATOM 4148 N N . ARG A 1 508 ? -9.765 30.671 107.022 1.00 36.88 ? 508 ARG A N 1 +ATOM 4149 C CA . ARG A 1 508 ? -8.845 31.317 106.098 1.00 37.13 ? 508 ARG A CA 1 +ATOM 4150 C C . ARG A 1 508 ? -9.020 32.828 106.194 1.00 37.88 ? 508 ARG A C 1 +ATOM 4151 O O . ARG A 1 508 ? -8.037 33.574 106.282 1.00 37.89 ? 508 ARG A O 1 +ATOM 4152 C CB . ARG A 1 508 ? -9.101 30.883 104.654 1.00 36.99 ? 508 ARG A CB 1 +ATOM 4153 C CG . ARG A 1 508 ? -8.151 31.557 103.659 1.00 36.36 ? 508 ARG A CG 1 +ATOM 4154 C CD . ARG A 1 508 ? -8.555 31.314 102.220 1.00 34.83 ? 508 ARG A CD 1 +ATOM 4155 N NE . ARG A 1 508 ? -7.736 32.087 101.292 1.00 34.86 ? 508 ARG A NE 1 +ATOM 4156 C CZ . ARG A 1 508 ? -6.450 31.856 101.049 1.00 33.92 ? 508 ARG A CZ 1 +ATOM 4157 N NH1 . ARG A 1 508 ? -5.828 30.862 101.669 1.00 33.37 ? 508 ARG A NH1 1 +ATOM 4158 N NH2 . ARG A 1 508 ? -5.792 32.617 100.178 1.00 31.09 ? 508 ARG A NH2 1 +ATOM 4159 N N . TYR A 1 509 ? -10.270 33.282 106.161 1.00 37.16 ? 509 TYR A N 1 +ATOM 4160 C CA . TYR A 1 509 ? -10.543 34.712 106.253 1.00 37.95 ? 509 TYR A CA 1 +ATOM 4161 C C . TYR A 1 509 ? -10.066 35.278 107.587 1.00 39.78 ? 509 TYR A C 1 +ATOM 4162 O O . TYR A 1 509 ? -9.707 36.450 107.680 1.00 41.00 ? 509 TYR A O 1 +ATOM 4163 C CB . TYR A 1 509 ? -12.035 34.986 106.061 1.00 37.70 ? 509 TYR A CB 1 +ATOM 4164 C CG . TYR A 1 509 ? -12.440 35.047 104.599 1.00 39.80 ? 509 TYR A CG 1 +ATOM 4165 C CD1 . TYR A 1 509 ? -12.022 36.103 103.782 1.00 38.36 ? 509 TYR A CD1 1 +ATOM 4166 C CD2 . TYR A 1 509 ? -13.207 34.029 104.019 1.00 39.28 ? 509 TYR A CD2 1 +ATOM 4167 C CE1 . TYR A 1 509 ? -12.358 36.142 102.428 1.00 38.33 ? 509 TYR A CE1 1 +ATOM 4168 C CE2 . TYR A 1 509 ? -13.543 34.061 102.663 1.00 38.62 ? 509 TYR A CE2 1 +ATOM 4169 C CZ . TYR A 1 509 ? -13.117 35.115 101.877 1.00 38.03 ? 509 TYR A CZ 1 +ATOM 4170 O OH . TYR A 1 509 ? -13.447 35.127 100.540 1.00 37.52 ? 509 TYR A OH 1 +ATOM 4171 N N . LYS A 1 510 ? -10.049 34.443 108.620 1.00 40.08 ? 510 LYS A N 1 +ATOM 4172 C CA . LYS A 1 510 ? -9.589 34.881 109.925 1.00 40.29 ? 510 LYS A CA 1 +ATOM 4173 C C . LYS A 1 510 ? -8.087 35.166 109.899 1.00 41.24 ? 510 LYS A C 1 +ATOM 4174 O O . LYS A 1 510 ? -7.598 36.033 110.631 1.00 41.69 ? 510 LYS A O 1 +ATOM 4175 C CB . LYS A 1 510 ? -9.894 33.814 110.972 1.00 41.76 ? 510 LYS A CB 1 +ATOM 4176 C CG . LYS A 1 510 ? -9.398 34.171 112.357 1.00 44.23 ? 510 LYS A CG 1 +ATOM 4177 C CD . LYS A 1 510 ? -9.939 33.218 113.399 1.00 45.34 ? 510 LYS A CD 1 +ATOM 4178 C CE . LYS A 1 510 ? -9.517 33.662 114.785 1.00 47.69 ? 510 LYS A CE 1 +ATOM 4179 N NZ . LYS A 1 510 ? -10.166 32.834 115.838 1.00 50.05 ? 510 LYS A NZ 1 +ATOM 4180 N N . PHE A 1 511 ? -7.361 34.437 109.052 1.00 40.71 ? 511 PHE A N 1 +ATOM 4181 C CA . PHE A 1 511 ? -5.918 34.604 108.921 1.00 38.79 ? 511 PHE A CA 1 +ATOM 4182 C C . PHE A 1 511 ? -5.532 35.482 107.739 1.00 39.48 ? 511 PHE A C 1 +ATOM 4183 O O . PHE A 1 511 ? -4.343 35.746 107.515 1.00 40.43 ? 511 PHE A O 1 +ATOM 4184 C CB . PHE A 1 511 ? -5.253 33.238 108.764 1.00 39.38 ? 511 PHE A CB 1 +ATOM 4185 C CG . PHE A 1 511 ? -4.948 32.558 110.065 1.00 39.05 ? 511 PHE A CG 1 +ATOM 4186 C CD1 . PHE A 1 511 ? -3.764 32.833 110.745 1.00 38.56 ? 511 PHE A CD1 1 +ATOM 4187 C CD2 . PHE A 1 511 ? -5.853 31.668 110.625 1.00 39.51 ? 511 PHE A CD2 1 +ATOM 4188 C CE1 . PHE A 1 511 ? -3.486 32.234 111.961 1.00 39.00 ? 511 PHE A CE1 1 +ATOM 4189 C CE2 . PHE A 1 511 ? -5.589 31.058 111.848 1.00 40.10 ? 511 PHE A CE2 1 +ATOM 4190 C CZ . PHE A 1 511 ? -4.400 31.343 112.518 1.00 40.05 ? 511 PHE A CZ 1 +ATOM 4191 N N . LEU A 1 512 ? -6.522 35.945 106.982 1.00 38.89 ? 512 LEU A N 1 +ATOM 4192 C CA . LEU A 1 512 ? -6.221 36.762 105.815 1.00 39.83 ? 512 LEU A CA 1 +ATOM 4193 C C . LEU A 1 512 ? -5.273 37.934 106.098 1.00 39.97 ? 512 LEU A C 1 +ATOM 4194 O O . LEU A 1 512 ? -4.350 38.195 105.318 1.00 41.31 ? 512 LEU A O 1 +ATOM 4195 C CB . LEU A 1 512 ? -7.513 37.275 105.178 1.00 41.61 ? 512 LEU A CB 1 +ATOM 4196 C CG . LEU A 1 512 ? -7.346 37.698 103.713 1.00 42.56 ? 512 LEU A CG 1 +ATOM 4197 C CD1 . LEU A 1 512 ? -6.902 36.488 102.890 1.00 42.39 ? 512 LEU A CD1 1 +ATOM 4198 C CD2 . LEU A 1 512 ? -8.658 38.254 103.183 1.00 43.15 ? 512 LEU A CD2 1 +ATOM 4199 N N . PRO A 1 513 ? -5.493 38.668 107.206 1.00 39.68 ? 513 PRO A N 1 +ATOM 4200 C CA . PRO A 1 513 ? -4.619 39.801 107.538 1.00 37.70 ? 513 PRO A CA 1 +ATOM 4201 C C . PRO A 1 513 ? -3.140 39.418 107.598 1.00 37.85 ? 513 PRO A C 1 +ATOM 4202 O O . PRO A 1 513 ? -2.278 40.174 107.144 1.00 37.90 ? 513 PRO A O 1 +ATOM 4203 C CB . PRO A 1 513 ? -5.151 40.254 108.885 1.00 37.65 ? 513 PRO A CB 1 +ATOM 4204 C CG . PRO A 1 513 ? -6.617 39.997 108.752 1.00 37.74 ? 513 PRO A CG 1 +ATOM 4205 C CD . PRO A 1 513 ? -6.652 38.623 108.118 1.00 38.72 ? 513 PRO A CD 1 +ATOM 4206 N N . TYR A 1 514 ? -2.848 38.244 108.153 1.00 37.57 ? 514 TYR A N 1 +ATOM 4207 C CA . TYR A 1 514 ? -1.471 37.775 108.258 1.00 36.80 ? 514 TYR A CA 1 +ATOM 4208 C C . TYR A 1 514 ? -0.957 37.424 106.869 1.00 37.90 ? 514 TYR A C 1 +ATOM 4209 O O . TYR A 1 514 ? 0.150 37.823 106.486 1.00 37.69 ? 514 TYR A O 1 +ATOM 4210 C CB . TYR A 1 514 ? -1.403 36.555 109.182 1.00 36.58 ? 514 TYR A CB 1 +ATOM 4211 C CG . TYR A 1 514 ? -0.034 35.913 109.272 1.00 36.31 ? 514 TYR A CG 1 +ATOM 4212 C CD1 . TYR A 1 514 ? 1.090 36.670 109.600 1.00 35.08 ? 514 TYR A CD1 1 +ATOM 4213 C CD2 . TYR A 1 514 ? 0.138 34.545 109.032 1.00 33.38 ? 514 TYR A CD2 1 +ATOM 4214 C CE1 . TYR A 1 514 ? 2.358 36.077 109.691 1.00 35.50 ? 514 TYR A CE1 1 +ATOM 4215 C CE2 . TYR A 1 514 ? 1.392 33.948 109.118 1.00 34.44 ? 514 TYR A CE2 1 +ATOM 4216 C CZ . TYR A 1 514 ? 2.500 34.718 109.449 1.00 34.97 ? 514 TYR A CZ 1 +ATOM 4217 O OH . TYR A 1 514 ? 3.745 34.137 109.548 1.00 36.41 ? 514 TYR A OH 1 +ATOM 4218 N N . ILE A 1 515 ? -1.773 36.691 106.111 1.00 38.00 ? 515 ILE A N 1 +ATOM 4219 C CA . ILE A 1 515 ? -1.400 36.293 104.757 1.00 37.77 ? 515 ILE A CA 1 +ATOM 4220 C C . ILE A 1 515 ? -1.130 37.524 103.899 1.00 37.67 ? 515 ILE A C 1 +ATOM 4221 O O . ILE A 1 515 ? -0.124 37.592 103.183 1.00 37.92 ? 515 ILE A O 1 +ATOM 4222 C CB . ILE A 1 515 ? -2.513 35.445 104.098 1.00 38.58 ? 515 ILE A CB 1 +ATOM 4223 C CG1 . ILE A 1 515 ? -2.629 34.095 104.811 1.00 39.06 ? 515 ILE A CG1 1 +ATOM 4224 C CG2 . ILE A 1 515 ? -2.210 35.228 102.625 1.00 38.23 ? 515 ILE A CG2 1 +ATOM 4225 C CD1 . ILE A 1 515 ? -3.859 33.298 104.411 1.00 38.86 ? 515 ILE A CD1 1 +ATOM 4226 N N . TYR A 1 516 ? -2.016 38.511 103.976 1.00 37.66 ? 516 TYR A N 1 +ATOM 4227 C CA . TYR A 1 516 ? -1.830 39.715 103.173 1.00 38.10 ? 516 TYR A CA 1 +ATOM 4228 C C . TYR A 1 516 ? -0.582 40.507 103.582 1.00 37.68 ? 516 TYR A C 1 +ATOM 4229 O O . TYR A 1 516 ? 0.079 41.118 102.736 1.00 37.25 ? 516 TYR A O 1 +ATOM 4230 C CB . TYR A 1 516 ? -3.060 40.610 103.250 1.00 37.88 ? 516 TYR A CB 1 +ATOM 4231 C CG . TYR A 1 516 ? -3.092 41.625 102.136 1.00 39.29 ? 516 TYR A CG 1 +ATOM 4232 C CD1 . TYR A 1 516 ? -2.905 41.231 100.812 1.00 39.94 ? 516 TYR A CD1 1 +ATOM 4233 C CD2 . TYR A 1 516 ? -3.314 42.978 102.398 1.00 38.87 ? 516 TYR A CD2 1 +ATOM 4234 C CE1 . TYR A 1 516 ? -2.936 42.160 99.775 1.00 40.75 ? 516 TYR A CE1 1 +ATOM 4235 C CE2 . TYR A 1 516 ? -3.351 43.913 101.371 1.00 38.50 ? 516 TYR A CE2 1 +ATOM 4236 C CZ . TYR A 1 516 ? -3.160 43.498 100.064 1.00 40.74 ? 516 TYR A CZ 1 +ATOM 4237 O OH . TYR A 1 516 ? -3.187 44.414 99.042 1.00 42.00 ? 516 TYR A OH 1 +ATOM 4238 N N . SER A 1 517 ? -0.260 40.496 104.872 1.00 36.75 ? 517 SER A N 1 +ATOM 4239 C CA . SER A 1 517 ? 0.930 41.194 105.344 1.00 36.24 ? 517 SER A CA 1 +ATOM 4240 C C . SER A 1 517 ? 2.154 40.513 104.737 1.00 36.12 ? 517 SER A C 1 +ATOM 4241 O O . SER A 1 517 ? 3.127 41.175 104.383 1.00 36.01 ? 517 SER A O 1 +ATOM 4242 C CB . SER A 1 517 ? 1.019 41.148 106.871 1.00 36.97 ? 517 SER A CB 1 +ATOM 4243 O OG . SER A 1 517 ? -0.094 41.787 107.466 1.00 35.74 ? 517 SER A OG 1 +ATOM 4244 N N . LEU A 1 518 ? 2.102 39.186 104.617 1.00 36.40 ? 518 LEU A N 1 +ATOM 4245 C CA . LEU A 1 518 ? 3.207 38.434 104.025 1.00 35.09 ? 518 LEU A CA 1 +ATOM 4246 C C . LEU A 1 518 ? 3.277 38.747 102.539 1.00 34.60 ? 518 LEU A C 1 +ATOM 4247 O O . LEU A 1 518 ? 4.357 38.734 101.940 1.00 35.64 ? 518 LEU A O 1 +ATOM 4248 C CB . LEU A 1 518 ? 3.006 36.934 104.249 1.00 35.38 ? 518 LEU A CB 1 +ATOM 4249 C CG . LEU A 1 518 ? 3.117 36.482 105.711 1.00 35.82 ? 518 LEU A CG 1 +ATOM 4250 C CD1 . LEU A 1 518 ? 2.701 35.015 105.835 1.00 37.43 ? 518 LEU A CD1 1 +ATOM 4251 C CD2 . LEU A 1 518 ? 4.549 36.687 106.203 1.00 33.62 ? 518 LEU A CD2 1 +ATOM 4252 N N . ALA A 1 519 ? 2.123 39.043 101.948 1.00 35.17 ? 519 ALA A N 1 +ATOM 4253 C CA . ALA A 1 519 ? 2.070 39.385 100.531 1.00 36.78 ? 519 ALA A CA 1 +ATOM 4254 C C . ALA A 1 519 ? 2.787 40.711 100.340 1.00 36.88 ? 519 ALA A C 1 +ATOM 4255 O O . ALA A 1 519 ? 3.517 40.889 99.356 1.00 38.17 ? 519 ALA A O 1 +ATOM 4256 C CB . ALA A 1 519 ? 0.622 39.496 100.059 1.00 35.83 ? 519 ALA A CB 1 +ATOM 4257 N N . LEU A 1 520 ? 2.574 41.642 101.275 1.00 37.12 ? 520 LEU A N 1 +ATOM 4258 C CA . LEU A 1 520 ? 3.232 42.951 101.211 1.00 37.69 ? 520 LEU A CA 1 +ATOM 4259 C C . LEU A 1 520 ? 4.738 42.743 101.325 1.00 38.21 ? 520 LEU A C 1 +ATOM 4260 O O . LEU A 1 520 ? 5.520 43.349 100.600 1.00 39.64 ? 520 LEU A O 1 +ATOM 4261 C CB . LEU A 1 520 ? 2.760 43.858 102.351 1.00 38.22 ? 520 LEU A CB 1 +ATOM 4262 C CG . LEU A 1 520 ? 3.524 45.190 102.508 1.00 39.99 ? 520 LEU A CG 1 +ATOM 4263 C CD1 . LEU A 1 520 ? 3.358 46.069 101.258 1.00 37.49 ? 520 LEU A CD1 1 +ATOM 4264 C CD2 . LEU A 1 520 ? 3.019 45.920 103.743 1.00 38.82 ? 520 LEU A CD2 1 +ATOM 4265 N N . GLU A 1 521 ? 5.134 41.870 102.242 1.00 39.47 ? 521 GLU A N 1 +ATOM 4266 C CA . GLU A 1 521 ? 6.536 41.552 102.457 1.00 41.81 ? 521 GLU A CA 1 +ATOM 4267 C C . GLU A 1 521 ? 7.128 40.976 101.170 1.00 41.96 ? 521 GLU A C 1 +ATOM 4268 O O . GLU A 1 521 ? 8.263 41.284 100.800 1.00 43.00 ? 521 GLU A O 1 +ATOM 4269 C CB . GLU A 1 521 ? 6.655 40.537 103.599 1.00 43.70 ? 521 GLU A CB 1 +ATOM 4270 C CG . GLU A 1 521 ? 8.078 40.218 104.046 1.00 48.01 ? 521 GLU A CG 1 +ATOM 4271 C CD . GLU A 1 521 ? 8.128 39.056 105.047 1.00 52.90 ? 521 GLU A CD 1 +ATOM 4272 O OE1 . GLU A 1 521 ? 7.371 39.088 106.050 1.00 55.33 ? 521 GLU A OE1 1 +ATOM 4273 O OE2 . GLU A 1 521 ? 8.924 38.107 104.832 1.00 55.05 ? 521 GLU A OE2 1 +ATOM 4274 N N . ALA A 1 522 ? 6.354 40.136 100.490 1.00 41.78 ? 522 ALA A N 1 +ATOM 4275 C CA . ALA A 1 522 ? 6.804 39.531 99.240 1.00 41.44 ? 522 ALA A CA 1 +ATOM 4276 C C . ALA A 1 522 ? 7.063 40.598 98.180 1.00 41.27 ? 522 ALA A C 1 +ATOM 4277 O O . ALA A 1 522 ? 8.106 40.596 97.525 1.00 40.11 ? 522 ALA A O 1 +ATOM 4278 C CB . ALA A 1 522 ? 5.756 38.539 98.734 1.00 41.43 ? 522 ALA A CB 1 +ATOM 4279 N N . SER A 1 523 ? 6.114 41.515 98.022 1.00 41.37 ? 523 SER A N 1 +ATOM 4280 C CA . SER A 1 523 ? 6.249 42.578 97.031 1.00 45.03 ? 523 SER A CA 1 +ATOM 4281 C C . SER A 1 523 ? 7.334 43.595 97.365 1.00 46.00 ? 523 SER A C 1 +ATOM 4282 O O . SER A 1 523 ? 7.801 44.320 96.486 1.00 45.21 ? 523 SER A O 1 +ATOM 4283 C CB . SER A 1 523 ? 4.919 43.314 96.860 1.00 45.98 ? 523 SER A CB 1 +ATOM 4284 O OG . SER A 1 523 ? 4.590 44.023 98.041 1.00 50.31 ? 523 SER A OG 1 +ATOM 4285 N N . GLU A 1 524 ? 7.735 43.654 98.631 1.00 48.63 ? 524 GLU A N 1 +ATOM 4286 C CA . GLU A 1 524 ? 8.760 44.606 99.040 1.00 50.73 ? 524 GLU A CA 1 +ATOM 4287 C C . GLU A 1 524 ? 10.151 44.000 99.124 1.00 50.89 ? 524 GLU A C 1 +ATOM 4288 O O . GLU A 1 524 ? 11.132 44.643 98.755 1.00 51.02 ? 524 GLU A O 1 +ATOM 4289 C CB . GLU A 1 524 ? 8.411 45.223 100.397 1.00 52.74 ? 524 GLU A CB 1 +ATOM 4290 C CG . GLU A 1 524 ? 7.100 45.983 100.434 1.00 56.44 ? 524 GLU A CG 1 +ATOM 4291 C CD . GLU A 1 524 ? 6.886 46.711 101.756 1.00 60.40 ? 524 GLU A CD 1 +ATOM 4292 O OE1 . GLU A 1 524 ? 7.046 46.068 102.823 1.00 62.97 ? 524 GLU A OE1 1 +ATOM 4293 O OE2 . GLU A 1 524 ? 6.555 47.923 101.729 1.00 60.87 ? 524 GLU A OE2 1 +ATOM 4294 N N . LYS A 1 525 ? 10.242 42.762 99.599 1.00 50.65 ? 525 LYS A N 1 +ATOM 4295 C CA . LYS A 1 525 ? 11.547 42.135 99.750 1.00 51.54 ? 525 LYS A CA 1 +ATOM 4296 C C . LYS A 1 525 ? 11.740 40.858 98.945 1.00 50.87 ? 525 LYS A C 1 +ATOM 4297 O O . LYS A 1 525 ? 12.854 40.337 98.855 1.00 50.75 ? 525 LYS A O 1 +ATOM 4298 C CB . LYS A 1 525 ? 11.805 41.866 101.235 1.00 53.60 ? 525 LYS A CB 1 +ATOM 4299 C CG . LYS A 1 525 ? 11.720 43.125 102.095 1.00 55.45 ? 525 LYS A CG 1 +ATOM 4300 C CD . LYS A 1 525 ? 11.918 42.819 103.572 1.00 58.41 ? 525 LYS A CD 1 +ATOM 4301 C CE . LYS A 1 525 ? 11.923 44.096 104.413 1.00 60.09 ? 525 LYS A CE 1 +ATOM 4302 N NZ . LYS A 1 525 ? 10.661 44.890 104.257 1.00 62.36 ? 525 LYS A NZ 1 +ATOM 4303 N N . GLY A 1 526 ? 10.662 40.349 98.366 1.00 49.75 ? 526 GLY A N 1 +ATOM 4304 C CA . GLY A 1 526 ? 10.783 39.138 97.577 1.00 49.23 ? 526 GLY A CA 1 +ATOM 4305 C C . GLY A 1 526 ? 10.813 37.862 98.394 1.00 48.74 ? 526 GLY A C 1 +ATOM 4306 O O . GLY A 1 526 ? 11.341 36.845 97.944 1.00 49.20 ? 526 GLY A O 1 +ATOM 4307 N N . HIS A 1 527 ? 10.256 37.908 99.599 1.00 47.69 ? 527 HIS A N 1 +ATOM 4308 C CA . HIS A 1 527 ? 10.205 36.725 100.446 1.00 46.94 ? 527 HIS A CA 1 +ATOM 4309 C C . HIS A 1 527 ? 8.935 35.971 100.083 1.00 45.93 ? 527 HIS A C 1 +ATOM 4310 O O . HIS A 1 527 ? 7.874 36.571 99.940 1.00 47.19 ? 527 HIS A O 1 +ATOM 4311 C CB . HIS A 1 527 ? 10.143 37.124 101.923 1.00 47.59 ? 527 HIS A CB 1 +ATOM 4312 C CG . HIS A 1 527 ? 11.355 37.859 102.408 1.00 48.87 ? 527 HIS A CG 1 +ATOM 4313 N ND1 . HIS A 1 527 ? 11.394 38.499 103.628 1.00 48.07 ? 527 HIS A ND1 1 +ATOM 4314 C CD2 . HIS A 1 527 ? 12.576 38.037 101.848 1.00 48.46 ? 527 HIS A CD2 1 +ATOM 4315 C CE1 . HIS A 1 527 ? 12.587 39.041 103.799 1.00 48.03 ? 527 HIS A CE1 1 +ATOM 4316 N NE2 . HIS A 1 527 ? 13.323 38.775 102.735 1.00 48.85 ? 527 HIS A NE2 1 +ATOM 4317 N N . PRO A 1 528 ? 9.022 34.648 99.907 1.00 45.06 ? 528 PRO A N 1 +ATOM 4318 C CA . PRO A 1 528 ? 7.799 33.913 99.564 1.00 43.45 ? 528 PRO A CA 1 +ATOM 4319 C C . PRO A 1 528 ? 6.806 33.847 100.727 1.00 42.48 ? 528 PRO A C 1 +ATOM 4320 O O . PRO A 1 528 ? 7.196 33.887 101.897 1.00 43.49 ? 528 PRO A O 1 +ATOM 4321 C CB . PRO A 1 528 ? 8.324 32.535 99.166 1.00 44.18 ? 528 PRO A CB 1 +ATOM 4322 C CG . PRO A 1 528 ? 9.591 32.401 99.980 1.00 45.29 ? 528 PRO A CG 1 +ATOM 4323 C CD . PRO A 1 528 ? 10.208 33.772 99.859 1.00 45.06 ? 528 PRO A CD 1 +ATOM 4324 N N . VAL A 1 529 ? 5.522 33.753 100.403 1.00 40.97 ? 529 VAL A N 1 +ATOM 4325 C CA . VAL A 1 529 ? 4.480 33.672 101.425 1.00 38.93 ? 529 VAL A CA 1 +ATOM 4326 C C . VAL A 1 529 ? 4.498 32.300 102.101 1.00 38.68 ? 529 VAL A C 1 +ATOM 4327 O O . VAL A 1 529 ? 4.647 32.216 103.321 1.00 40.70 ? 529 VAL A O 1 +ATOM 4328 C CB . VAL A 1 529 ? 3.086 33.936 100.820 1.00 38.74 ? 529 VAL A CB 1 +ATOM 4329 C CG1 . VAL A 1 529 ? 2.019 33.795 101.884 1.00 36.94 ? 529 VAL A CG1 1 +ATOM 4330 C CG2 . VAL A 1 529 ? 3.048 35.331 100.215 1.00 37.22 ? 529 VAL A CG2 1 +ATOM 4331 N N . ILE A 1 530 ? 4.333 31.226 101.331 1.00 36.75 ? 530 ILE A N 1 +ATOM 4332 C CA . ILE A 1 530 ? 4.384 29.892 101.921 1.00 34.71 ? 530 ILE A CA 1 +ATOM 4333 C C . ILE A 1 530 ? 5.790 29.373 101.673 1.00 34.95 ? 530 ILE A C 1 +ATOM 4334 O O . ILE A 1 530 ? 6.381 29.650 100.634 1.00 33.98 ? 530 ILE A O 1 +ATOM 4335 C CB . ILE A 1 530 ? 3.340 28.941 101.309 1.00 35.70 ? 530 ILE A CB 1 +ATOM 4336 C CG1 . ILE A 1 530 ? 3.507 28.871 99.792 1.00 34.47 ? 530 ILE A CG1 1 +ATOM 4337 C CG2 . ILE A 1 530 ? 1.927 29.410 101.693 1.00 34.73 ? 530 ILE A CG2 1 +ATOM 4338 C CD1 . ILE A 1 530 ? 2.629 27.820 99.157 1.00 36.93 ? 530 ILE A CD1 1 +ATOM 4339 N N . ARG A 1 531 ? 6.339 28.632 102.630 1.00 35.51 ? 531 ARG A N 1 +ATOM 4340 C CA . ARG A 1 531 ? 7.707 28.152 102.490 1.00 36.25 ? 531 ARG A CA 1 +ATOM 4341 C C . ARG A 1 531 ? 7.935 26.747 102.984 1.00 36.71 ? 531 ARG A C 1 +ATOM 4342 O O . ARG A 1 531 ? 7.278 26.284 103.924 1.00 36.24 ? 531 ARG A O 1 +ATOM 4343 C CB . ARG A 1 531 ? 8.650 29.063 103.274 1.00 37.79 ? 531 ARG A CB 1 +ATOM 4344 C CG . ARG A 1 531 ? 8.263 30.517 103.205 1.00 41.27 ? 531 ARG A CG 1 +ATOM 4345 C CD . ARG A 1 531 ? 8.845 31.344 104.342 1.00 41.68 ? 531 ARG A CD 1 +ATOM 4346 N NE . ARG A 1 531 ? 8.490 32.747 104.151 1.00 41.73 ? 531 ARG A NE 1 +ATOM 4347 C CZ . ARG A 1 531 ? 8.926 33.742 104.909 1.00 41.40 ? 531 ARG A CZ 1 +ATOM 4348 N NH1 . ARG A 1 531 ? 9.742 33.491 105.925 1.00 42.31 ? 531 ARG A NH1 1 +ATOM 4349 N NH2 . ARG A 1 531 ? 8.552 34.988 104.639 1.00 39.22 ? 531 ARG A NH2 1 +ATOM 4350 N N . PRO A 1 532 ? 8.872 26.038 102.345 1.00 36.42 ? 532 PRO A N 1 +ATOM 4351 C CA . PRO A 1 532 ? 9.165 24.674 102.782 1.00 36.84 ? 532 PRO A CA 1 +ATOM 4352 C C . PRO A 1 532 ? 9.944 24.857 104.088 1.00 37.97 ? 532 PRO A C 1 +ATOM 4353 O O . PRO A 1 532 ? 10.529 25.912 104.316 1.00 38.39 ? 532 PRO A O 1 +ATOM 4354 C CB . PRO A 1 532 ? 10.019 24.120 101.639 1.00 36.55 ? 532 PRO A CB 1 +ATOM 4355 C CG . PRO A 1 532 ? 10.677 25.348 101.074 1.00 36.44 ? 532 PRO A CG 1 +ATOM 4356 C CD . PRO A 1 532 ? 9.561 26.358 101.084 1.00 35.53 ? 532 PRO A CD 1 +ATOM 4357 N N . LEU A 1 533 ? 9.952 23.850 104.950 1.00 39.90 ? 533 LEU A N 1 +ATOM 4358 C CA . LEU A 1 533 ? 10.651 23.974 106.219 1.00 40.13 ? 533 LEU A CA 1 +ATOM 4359 C C . LEU A 1 533 ? 12.132 24.307 106.086 1.00 42.00 ? 533 LEU A C 1 +ATOM 4360 O O . LEU A 1 533 ? 12.673 25.063 106.905 1.00 43.48 ? 533 LEU A O 1 +ATOM 4361 C CB . LEU A 1 533 ? 10.497 22.700 107.052 1.00 38.94 ? 533 LEU A CB 1 +ATOM 4362 C CG . LEU A 1 533 ? 9.070 22.250 107.386 1.00 39.49 ? 533 LEU A CG 1 +ATOM 4363 C CD1 . LEU A 1 533 ? 9.109 21.296 108.565 1.00 38.28 ? 533 LEU A CD1 1 +ATOM 4364 C CD2 . LEU A 1 533 ? 8.201 23.447 107.706 1.00 39.10 ? 533 LEU A CD2 1 +ATOM 4365 N N . PHE A 1 534 ? 12.798 23.768 105.070 1.00 40.43 ? 534 PHE A N 1 +ATOM 4366 C CA . PHE A 1 534 ? 14.219 24.050 104.942 1.00 40.70 ? 534 PHE A CA 1 +ATOM 4367 C C . PHE A 1 534 ? 14.516 25.513 104.656 1.00 41.39 ? 534 PHE A C 1 +ATOM 4368 O O . PHE A 1 534 ? 15.660 25.945 104.757 1.00 43.40 ? 534 PHE A O 1 +ATOM 4369 C CB . PHE A 1 534 ? 14.877 23.144 103.886 1.00 39.26 ? 534 PHE A CB 1 +ATOM 4370 C CG . PHE A 1 534 ? 14.310 23.283 102.504 1.00 37.63 ? 534 PHE A CG 1 +ATOM 4371 C CD1 . PHE A 1 534 ? 14.548 24.422 101.748 1.00 37.11 ? 534 PHE A CD1 1 +ATOM 4372 C CD2 . PHE A 1 534 ? 13.561 22.254 101.945 1.00 38.28 ? 534 PHE A CD2 1 +ATOM 4373 C CE1 . PHE A 1 534 ? 14.049 24.535 100.448 1.00 37.99 ? 534 PHE A CE1 1 +ATOM 4374 C CE2 . PHE A 1 534 ? 13.058 22.358 100.642 1.00 37.15 ? 534 PHE A CE2 1 +ATOM 4375 C CZ . PHE A 1 534 ? 13.305 23.501 99.896 1.00 36.63 ? 534 PHE A CZ 1 +ATOM 4376 N N . TYR A 1 535 ? 13.495 26.289 104.315 1.00 41.08 ? 535 TYR A N 1 +ATOM 4377 C CA . TYR A 1 535 ? 13.732 27.697 104.034 1.00 41.49 ? 535 TYR A CA 1 +ATOM 4378 C C . TYR A 1 535 ? 14.084 28.447 105.323 1.00 42.72 ? 535 TYR A C 1 +ATOM 4379 O O . TYR A 1 535 ? 14.970 29.305 105.329 1.00 44.22 ? 535 TYR A O 1 +ATOM 4380 C CB . TYR A 1 535 ? 12.505 28.318 103.367 1.00 39.91 ? 535 TYR A CB 1 +ATOM 4381 C CG . TYR A 1 535 ? 12.608 29.818 103.138 1.00 39.84 ? 535 TYR A CG 1 +ATOM 4382 C CD1 . TYR A 1 535 ? 12.344 30.721 104.167 1.00 37.85 ? 535 TYR A CD1 1 +ATOM 4383 C CD2 . TYR A 1 535 ? 12.938 30.330 101.882 1.00 39.25 ? 535 TYR A CD2 1 +ATOM 4384 C CE1 . TYR A 1 535 ? 12.397 32.094 103.954 1.00 37.78 ? 535 TYR A CE1 1 +ATOM 4385 C CE2 . TYR A 1 535 ? 12.995 31.707 101.658 1.00 39.48 ? 535 TYR A CE2 1 +ATOM 4386 C CZ . TYR A 1 535 ? 12.721 32.583 102.698 1.00 38.95 ? 535 TYR A CZ 1 +ATOM 4387 O OH . TYR A 1 535 ? 12.748 33.945 102.476 1.00 38.88 ? 535 TYR A OH 1 +ATOM 4388 N N . GLU A 1 536 ? 13.391 28.114 106.409 1.00 43.31 ? 536 GLU A N 1 +ATOM 4389 C CA . GLU A 1 536 ? 13.630 28.743 107.706 1.00 43.80 ? 536 GLU A CA 1 +ATOM 4390 C C . GLU A 1 536 ? 14.703 28.001 108.516 1.00 43.43 ? 536 GLU A C 1 +ATOM 4391 O O . GLU A 1 536 ? 15.303 28.574 109.425 1.00 44.04 ? 536 GLU A O 1 +ATOM 4392 C CB . GLU A 1 536 ? 12.332 28.775 108.521 1.00 45.17 ? 536 GLU A CB 1 +ATOM 4393 C CG . GLU A 1 536 ? 11.315 29.799 108.055 1.00 48.12 ? 536 GLU A CG 1 +ATOM 4394 C CD . GLU A 1 536 ? 11.840 31.216 108.182 1.00 51.44 ? 536 GLU A CD 1 +ATOM 4395 O OE1 . GLU A 1 536 ? 12.441 31.529 109.236 1.00 53.34 ? 536 GLU A OE1 1 +ATOM 4396 O OE2 . GLU A 1 536 ? 11.649 32.019 107.239 1.00 52.58 ? 536 GLU A OE2 1 +ATOM 4397 N N . PHE A 1 537 ? 14.933 26.733 108.186 1.00 41.94 ? 537 PHE A N 1 +ATOM 4398 C CA . PHE A 1 537 ? 15.906 25.914 108.896 1.00 41.56 ? 537 PHE A CA 1 +ATOM 4399 C C . PHE A 1 537 ? 16.793 25.180 107.907 1.00 42.21 ? 537 PHE A C 1 +ATOM 4400 O O . PHE A 1 537 ? 16.876 23.951 107.932 1.00 42.86 ? 537 PHE A O 1 +ATOM 4401 C CB . PHE A 1 537 ? 15.178 24.901 109.785 1.00 41.24 ? 537 PHE A CB 1 +ATOM 4402 C CG . PHE A 1 537 ? 14.090 25.513 110.624 1.00 41.62 ? 537 PHE A CG 1 +ATOM 4403 C CD1 . PHE A 1 537 ? 12.796 25.643 110.123 1.00 42.08 ? 537 PHE A CD1 1 +ATOM 4404 C CD2 . PHE A 1 537 ? 14.374 26.019 111.894 1.00 40.71 ? 537 PHE A CD2 1 +ATOM 4405 C CE1 . PHE A 1 537 ? 11.792 26.275 110.875 1.00 42.61 ? 537 PHE A CE1 1 +ATOM 4406 C CE2 . PHE A 1 537 ? 13.383 26.653 112.656 1.00 40.47 ? 537 PHE A CE2 1 +ATOM 4407 C CZ . PHE A 1 537 ? 12.091 26.784 112.148 1.00 42.20 ? 537 PHE A CZ 1 +ATOM 4408 N N . GLN A 1 538 ? 17.473 25.946 107.057 1.00 42.31 ? 538 GLN A N 1 +ATOM 4409 C CA . GLN A 1 538 ? 18.336 25.393 106.018 1.00 43.38 ? 538 GLN A CA 1 +ATOM 4410 C C . GLN A 1 538 ? 19.541 24.606 106.498 1.00 45.62 ? 538 GLN A C 1 +ATOM 4411 O O . GLN A 1 538 ? 20.152 23.868 105.720 1.00 46.61 ? 538 GLN A O 1 +ATOM 4412 C CB . GLN A 1 538 ? 18.818 26.512 105.094 1.00 41.65 ? 538 GLN A CB 1 +ATOM 4413 C CG . GLN A 1 538 ? 19.766 27.494 105.742 1.00 39.65 ? 538 GLN A CG 1 +ATOM 4414 C CD . GLN A 1 538 ? 20.175 28.597 104.787 1.00 40.08 ? 538 GLN A CD 1 +ATOM 4415 O OE1 . GLN A 1 538 ? 19.378 29.476 104.465 1.00 42.47 ? 538 GLN A OE1 1 +ATOM 4416 N NE2 . GLN A 1 538 ? 21.417 28.549 104.316 1.00 38.89 ? 538 GLN A NE2 1 +ATOM 4417 N N . ASP A 1 539 ? 19.882 24.750 107.773 1.00 47.77 ? 539 ASP A N 1 +ATOM 4418 C CA . ASP A 1 539 ? 21.047 24.060 108.328 1.00 50.83 ? 539 ASP A CA 1 +ATOM 4419 C C . ASP A 1 539 ? 20.765 22.642 108.834 1.00 50.49 ? 539 ASP A C 1 +ATOM 4420 O O . ASP A 1 539 ? 21.683 21.916 109.207 1.00 51.43 ? 539 ASP A O 1 +ATOM 4421 C CB . ASP A 1 539 ? 21.643 24.904 109.459 1.00 54.19 ? 539 ASP A CB 1 +ATOM 4422 C CG . ASP A 1 539 ? 20.656 25.134 110.596 1.00 58.86 ? 539 ASP A CG 1 +ATOM 4423 O OD1 . ASP A 1 539 ? 19.501 25.551 110.323 1.00 60.21 ? 539 ASP A OD1 1 +ATOM 4424 O OD2 . ASP A 1 539 ? 21.036 24.898 111.768 1.00 61.93 ? 539 ASP A OD2 1 +ATOM 4425 N N . ASP A 1 540 ? 19.498 22.250 108.845 1.00 50.50 ? 540 ASP A N 1 +ATOM 4426 C CA . ASP A 1 540 ? 19.116 20.920 109.307 1.00 50.46 ? 540 ASP A CA 1 +ATOM 4427 C C . ASP A 1 540 ? 18.735 20.030 108.122 1.00 50.50 ? 540 ASP A C 1 +ATOM 4428 O O . ASP A 1 540 ? 17.675 20.210 107.517 1.00 51.56 ? 540 ASP A O 1 +ATOM 4429 C CB . ASP A 1 540 ? 17.948 21.046 110.291 1.00 51.97 ? 540 ASP A CB 1 +ATOM 4430 C CG . ASP A 1 540 ? 17.414 19.693 110.759 1.00 56.38 ? 540 ASP A CG 1 +ATOM 4431 O OD1 . ASP A 1 540 ? 18.153 18.678 110.685 1.00 57.33 ? 540 ASP A OD1 1 +ATOM 4432 O OD2 . ASP A 1 540 ? 16.247 19.648 111.224 1.00 58.21 ? 540 ASP A OD2 1 +ATOM 4433 N N . ASP A 1 541 ? 19.602 19.072 107.793 1.00 49.68 ? 541 ASP A N 1 +ATOM 4434 C CA . ASP A 1 541 ? 19.366 18.166 106.670 1.00 49.86 ? 541 ASP A CA 1 +ATOM 4435 C C . ASP A 1 541 ? 18.003 17.467 106.679 1.00 49.74 ? 541 ASP A C 1 +ATOM 4436 O O . ASP A 1 541 ? 17.423 17.219 105.618 1.00 50.43 ? 541 ASP A O 1 +ATOM 4437 C CB . ASP A 1 541 ? 20.483 17.120 106.583 1.00 49.86 ? 541 ASP A CB 1 +ATOM 4438 C CG . ASP A 1 541 ? 21.842 17.740 106.294 1.00 53.37 ? 541 ASP A CG 1 +ATOM 4439 O OD1 . ASP A 1 541 ? 21.880 18.855 105.721 1.00 54.21 ? 541 ASP A OD1 1 +ATOM 4440 O OD2 . ASP A 1 541 ? 22.876 17.109 106.627 1.00 54.67 ? 541 ASP A OD2 1 +ATOM 4441 N N . ASP A 1 542 ? 17.495 17.148 107.865 1.00 49.40 ? 542 ASP A N 1 +ATOM 4442 C CA . ASP A 1 542 ? 16.191 16.492 108.000 1.00 49.79 ? 542 ASP A CA 1 +ATOM 4443 C C . ASP A 1 542 ? 15.092 17.257 107.262 1.00 48.35 ? 542 ASP A C 1 +ATOM 4444 O O . ASP A 1 542 ? 14.218 16.666 106.625 1.00 47.83 ? 542 ASP A O 1 +ATOM 4445 C CB . ASP A 1 542 ? 15.806 16.396 109.480 1.00 51.18 ? 542 ASP A CB 1 +ATOM 4446 C CG . ASP A 1 542 ? 16.538 15.280 110.209 1.00 54.33 ? 542 ASP A CG 1 +ATOM 4447 O OD1 . ASP A 1 542 ? 17.726 15.033 109.895 1.00 55.75 ? 542 ASP A OD1 1 +ATOM 4448 O OD2 . ASP A 1 542 ? 15.925 14.659 111.110 1.00 54.79 ? 542 ASP A OD2 1 +ATOM 4449 N N . MET A 1 543 ? 15.151 18.578 107.367 1.00 46.61 ? 543 MET A N 1 +ATOM 4450 C CA . MET A 1 543 ? 14.169 19.458 106.761 1.00 45.25 ? 543 MET A CA 1 +ATOM 4451 C C . MET A 1 543 ? 13.970 19.296 105.258 1.00 44.32 ? 543 MET A C 1 +ATOM 4452 O O . MET A 1 543 ? 12.894 19.600 104.743 1.00 45.11 ? 543 MET A O 1 +ATOM 4453 C CB . MET A 1 543 ? 14.532 20.912 107.077 1.00 46.41 ? 543 MET A CB 1 +ATOM 4454 C CG . MET A 1 543 ? 14.618 21.215 108.570 1.00 48.54 ? 543 MET A CG 1 +ATOM 4455 S SD . MET A 1 543 ? 13.046 20.950 109.443 1.00 51.16 ? 543 MET A SD 1 +ATOM 4456 C CE . MET A 1 543 ? 13.304 19.305 110.143 1.00 49.60 ? 543 MET A CE 1 +ATOM 4457 N N . TYR A 1 544 ? 14.989 18.821 104.552 1.00 42.43 ? 544 TYR A N 1 +ATOM 4458 C CA . TYR A 1 544 ? 14.872 18.661 103.113 1.00 42.05 ? 544 TYR A CA 1 +ATOM 4459 C C . TYR A 1 544 ? 14.107 17.418 102.697 1.00 43.07 ? 544 TYR A C 1 +ATOM 4460 O O . TYR A 1 544 ? 13.943 17.161 101.510 1.00 42.92 ? 544 TYR A O 1 +ATOM 4461 C CB . TYR A 1 544 ? 16.255 18.663 102.464 1.00 41.04 ? 544 TYR A CB 1 +ATOM 4462 C CG . TYR A 1 544 ? 16.986 19.968 102.661 1.00 40.68 ? 544 TYR A CG 1 +ATOM 4463 C CD1 . TYR A 1 544 ? 17.605 20.265 103.876 1.00 38.96 ? 544 TYR A CD1 1 +ATOM 4464 C CD2 . TYR A 1 544 ? 17.033 20.923 101.644 1.00 39.55 ? 544 TYR A CD2 1 +ATOM 4465 C CE1 . TYR A 1 544 ? 18.255 21.478 104.074 1.00 38.50 ? 544 TYR A CE1 1 +ATOM 4466 C CE2 . TYR A 1 544 ? 17.680 22.143 101.835 1.00 39.87 ? 544 TYR A CE2 1 +ATOM 4467 C CZ . TYR A 1 544 ? 18.292 22.409 103.054 1.00 37.97 ? 544 TYR A CZ 1 +ATOM 4468 O OH . TYR A 1 544 ? 18.966 23.591 103.231 1.00 38.63 ? 544 TYR A OH 1 +ATOM 4469 N N . ARG A 1 545 ? 13.636 16.648 103.670 1.00 44.81 ? 545 ARG A N 1 +ATOM 4470 C CA . ARG A 1 545 ? 12.873 15.444 103.369 1.00 46.83 ? 545 ARG A CA 1 +ATOM 4471 C C . ARG A 1 545 ? 11.432 15.602 103.831 1.00 47.72 ? 545 ARG A C 1 +ATOM 4472 O O . ARG A 1 545 ? 10.602 14.723 103.611 1.00 48.23 ? 545 ARG A O 1 +ATOM 4473 C CB . ARG A 1 545 ? 13.495 14.220 104.045 1.00 48.17 ? 545 ARG A CB 1 +ATOM 4474 C CG . ARG A 1 545 ? 14.882 13.843 103.528 1.00 50.55 ? 545 ARG A CG 1 +ATOM 4475 C CD . ARG A 1 545 ? 14.881 13.622 102.028 1.00 51.25 ? 545 ARG A CD 1 +ATOM 4476 N NE . ARG A 1 545 ? 14.057 12.485 101.611 1.00 54.28 ? 545 ARG A NE 1 +ATOM 4477 C CZ . ARG A 1 545 ? 14.414 11.206 101.722 1.00 54.34 ? 545 ARG A CZ 1 +ATOM 4478 N NH1 . ARG A 1 545 ? 15.589 10.885 102.244 1.00 54.67 ? 545 ARG A NH1 1 +ATOM 4479 N NH2 . ARG A 1 545 ? 13.599 10.247 101.295 1.00 53.64 ? 545 ARG A NH2 1 +ATOM 4480 N N . ILE A 1 546 ? 11.137 16.719 104.485 1.00 48.44 ? 546 ILE A N 1 +ATOM 4481 C CA . ILE A 1 546 ? 9.779 16.966 104.960 1.00 49.89 ? 546 ILE A CA 1 +ATOM 4482 C C . ILE A 1 546 ? 9.027 17.699 103.855 1.00 50.06 ? 546 ILE A C 1 +ATOM 4483 O O . ILE A 1 546 ? 9.370 18.828 103.505 1.00 50.12 ? 546 ILE A O 1 +ATOM 4484 C CB . ILE A 1 546 ? 9.778 17.823 106.261 1.00 50.36 ? 546 ILE A CB 1 +ATOM 4485 C CG1 . ILE A 1 546 ? 10.035 16.940 107.490 1.00 51.52 ? 546 ILE A CG1 1 +ATOM 4486 C CG2 . ILE A 1 546 ? 8.427 18.497 106.441 1.00 50.52 ? 546 ILE A CG2 1 +ATOM 4487 C CD1 . ILE A 1 546 ? 11.248 16.026 107.394 1.00 52.47 ? 546 ILE A CD1 1 +ATOM 4488 N N . GLU A 1 547 ? 8.002 17.060 103.301 1.00 50.46 ? 547 GLU A N 1 +ATOM 4489 C CA . GLU A 1 547 ? 7.250 17.689 102.218 1.00 51.06 ? 547 GLU A CA 1 +ATOM 4490 C C . GLU A 1 547 ? 5.743 17.783 102.405 1.00 49.02 ? 547 GLU A C 1 +ATOM 4491 O O . GLU A 1 547 ? 5.059 18.348 101.556 1.00 50.49 ? 547 GLU A O 1 +ATOM 4492 C CB . GLU A 1 547 ? 7.549 16.983 100.898 1.00 53.24 ? 547 GLU A CB 1 +ATOM 4493 C CG . GLU A 1 547 ? 9.031 16.841 100.625 1.00 57.46 ? 547 GLU A CG 1 +ATOM 4494 C CD . GLU A 1 547 ? 9.317 16.465 99.194 1.00 59.66 ? 547 GLU A CD 1 +ATOM 4495 O OE1 . GLU A 1 547 ? 8.715 15.481 98.701 1.00 60.47 ? 547 GLU A OE1 1 +ATOM 4496 O OE2 . GLU A 1 547 ? 10.146 17.158 98.567 1.00 60.95 ? 547 GLU A OE2 1 +ATOM 4497 N N . ASP A 1 548 ? 5.219 17.227 103.493 1.00 46.10 ? 548 ASP A N 1 +ATOM 4498 C CA . ASP A 1 548 ? 3.789 17.313 103.753 1.00 43.31 ? 548 ASP A CA 1 +ATOM 4499 C C . ASP A 1 548 ? 3.523 18.348 104.843 1.00 41.58 ? 548 ASP A C 1 +ATOM 4500 O O . ASP A 1 548 ? 2.504 18.306 105.531 1.00 40.95 ? 548 ASP A O 1 +ATOM 4501 C CB . ASP A 1 548 ? 3.220 15.956 104.163 1.00 45.29 ? 548 ASP A CB 1 +ATOM 4502 C CG . ASP A 1 548 ? 4.074 15.244 105.191 1.00 47.56 ? 548 ASP A CG 1 +ATOM 4503 O OD1 . ASP A 1 548 ? 4.870 15.914 105.894 1.00 46.20 ? 548 ASP A OD1 1 +ATOM 4504 O OD2 . ASP A 1 548 ? 3.933 14.004 105.299 1.00 50.24 ? 548 ASP A OD2 1 +ATOM 4505 N N . GLU A 1 549 ? 4.465 19.275 104.991 1.00 39.85 ? 549 GLU A N 1 +ATOM 4506 C CA . GLU A 1 549 ? 4.371 20.356 105.971 1.00 37.69 ? 549 GLU A CA 1 +ATOM 4507 C C . GLU A 1 549 ? 4.917 21.610 105.318 1.00 35.30 ? 549 GLU A C 1 +ATOM 4508 O O . GLU A 1 549 ? 5.782 21.536 104.447 1.00 33.24 ? 549 GLU A O 1 +ATOM 4509 C CB . GLU A 1 549 ? 5.220 20.063 107.210 1.00 38.24 ? 549 GLU A CB 1 +ATOM 4510 C CG . GLU A 1 549 ? 4.675 18.993 108.141 1.00 41.48 ? 549 GLU A CG 1 +ATOM 4511 C CD . GLU A 1 549 ? 5.645 18.683 109.274 1.00 43.21 ? 549 GLU A CD 1 +ATOM 4512 O OE1 . GLU A 1 549 ? 6.210 19.644 109.843 1.00 44.02 ? 549 GLU A OE1 1 +ATOM 4513 O OE2 . GLU A 1 549 ? 5.839 17.487 109.596 1.00 43.77 ? 549 GLU A OE2 1 +ATOM 4514 N N . TYR A 1 550 ? 4.401 22.762 105.716 1.00 33.62 ? 550 TYR A N 1 +ATOM 4515 C CA . TYR A 1 550 ? 4.919 23.999 105.173 1.00 33.58 ? 550 TYR A CA 1 +ATOM 4516 C C . TYR A 1 550 ? 4.754 25.161 106.140 1.00 34.88 ? 550 TYR A C 1 +ATOM 4517 O O . TYR A 1 550 ? 3.890 25.143 107.021 1.00 34.88 ? 550 TYR A O 1 +ATOM 4518 C CB . TYR A 1 550 ? 4.292 24.331 103.809 1.00 32.64 ? 550 TYR A CB 1 +ATOM 4519 C CG . TYR A 1 550 ? 2.804 24.629 103.780 1.00 31.60 ? 550 TYR A CG 1 +ATOM 4520 C CD1 . TYR A 1 550 ? 1.865 23.604 103.667 1.00 30.14 ? 550 TYR A CD1 1 +ATOM 4521 C CD2 . TYR A 1 550 ? 2.345 25.942 103.761 1.00 32.11 ? 550 TYR A CD2 1 +ATOM 4522 C CE1 . TYR A 1 550 ? 0.500 23.884 103.519 1.00 31.46 ? 550 TYR A CE1 1 +ATOM 4523 C CE2 . TYR A 1 550 ? 0.980 26.236 103.618 1.00 33.76 ? 550 TYR A CE2 1 +ATOM 4524 C CZ . TYR A 1 550 ? 0.064 25.202 103.494 1.00 34.01 ? 550 TYR A CZ 1 +ATOM 4525 O OH . TYR A 1 550 ? -1.277 25.501 103.339 1.00 33.21 ? 550 TYR A OH 1 +ATOM 4526 N N . MET A 1 551 ? 5.622 26.157 105.986 1.00 36.24 ? 551 MET A N 1 +ATOM 4527 C CA . MET A 1 551 ? 5.598 27.355 106.820 1.00 37.00 ? 551 MET A CA 1 +ATOM 4528 C C . MET A 1 551 ? 4.816 28.442 106.100 1.00 36.02 ? 551 MET A C 1 +ATOM 4529 O O . MET A 1 551 ? 4.914 28.581 104.880 1.00 35.03 ? 551 MET A O 1 +ATOM 4530 C CB . MET A 1 551 ? 7.012 27.901 107.047 1.00 39.99 ? 551 MET A CB 1 +ATOM 4531 C CG . MET A 1 551 ? 7.986 26.961 107.724 1.00 44.12 ? 551 MET A CG 1 +ATOM 4532 S SD . MET A 1 551 ? 7.688 26.861 109.475 1.00 49.98 ? 551 MET A SD 1 +ATOM 4533 C CE . MET A 1 551 ? 8.291 28.493 110.025 1.00 45.55 ? 551 MET A CE 1 +ATOM 4534 N N . VAL A 1 552 ? 4.043 29.204 106.863 1.00 34.67 ? 552 VAL A N 1 +ATOM 4535 C CA . VAL A 1 552 ? 3.296 30.319 106.319 1.00 33.92 ? 552 VAL A CA 1 +ATOM 4536 C C . VAL A 1 552 ? 4.021 31.498 106.953 1.00 35.06 ? 552 VAL A C 1 +ATOM 4537 O O . VAL A 1 552 ? 3.860 31.789 108.142 1.00 33.69 ? 552 VAL A O 1 +ATOM 4538 C CB . VAL A 1 552 ? 1.824 30.307 106.761 1.00 33.50 ? 552 VAL A CB 1 +ATOM 4539 C CG1 . VAL A 1 552 ? 1.097 31.512 106.166 1.00 32.14 ? 552 VAL A CG1 1 +ATOM 4540 C CG2 . VAL A 1 552 ? 1.162 29.019 106.317 1.00 32.60 ? 552 VAL A CG2 1 +ATOM 4541 N N . GLY A 1 553 ? 4.846 32.160 106.156 1.00 36.50 ? 553 GLY A N 1 +ATOM 4542 C CA . GLY A 1 553 ? 5.607 33.263 106.686 1.00 38.18 ? 553 GLY A CA 1 +ATOM 4543 C C . GLY A 1 553 ? 6.714 32.659 107.528 1.00 40.14 ? 553 GLY A C 1 +ATOM 4544 O O . GLY A 1 553 ? 7.118 31.512 107.326 1.00 41.24 ? 553 GLY A O 1 +ATOM 4545 N N . LYS A 1 554 ? 7.184 33.419 108.501 1.00 41.17 ? 554 LYS A N 1 +ATOM 4546 C CA . LYS A 1 554 ? 8.268 32.976 109.361 1.00 41.73 ? 554 LYS A CA 1 +ATOM 4547 C C . LYS A 1 554 ? 7.766 32.356 110.667 1.00 41.68 ? 554 LYS A C 1 +ATOM 4548 O O . LYS A 1 554 ? 8.491 31.606 111.334 1.00 42.36 ? 554 LYS A O 1 +ATOM 4549 C CB . LYS A 1 554 ? 9.148 34.191 109.663 1.00 42.52 ? 554 LYS A CB 1 +ATOM 4550 C CG . LYS A 1 554 ? 10.457 33.906 110.340 1.00 45.47 ? 554 LYS A CG 1 +ATOM 4551 C CD . LYS A 1 554 ? 11.277 35.189 110.418 1.00 47.46 ? 554 LYS A CD 1 +ATOM 4552 C CE . LYS A 1 554 ? 12.657 34.942 111.036 1.00 50.39 ? 554 LYS A CE 1 +ATOM 4553 N NZ . LYS A 1 554 ? 13.506 34.046 110.186 1.00 51.19 ? 554 LYS A NZ 1 +ATOM 4554 N N . TYR A 1 555 ? 6.510 32.633 110.999 1.00 40.26 ? 555 TYR A N 1 +ATOM 4555 C CA . TYR A 1 555 ? 5.936 32.185 112.259 1.00 39.48 ? 555 TYR A CA 1 +ATOM 4556 C C . TYR A 1 555 ? 5.017 30.980 112.345 1.00 39.46 ? 555 TYR A C 1 +ATOM 4557 O O . TYR A 1 555 ? 4.921 30.362 113.405 1.00 39.40 ? 555 TYR A O 1 +ATOM 4558 C CB . TYR A 1 555 ? 5.167 33.341 112.892 1.00 39.75 ? 555 TYR A CB 1 +ATOM 4559 C CG . TYR A 1 555 ? 5.867 34.676 112.859 1.00 39.88 ? 555 TYR A CG 1 +ATOM 4560 C CD1 . TYR A 1 555 ? 7.231 34.787 113.163 1.00 39.89 ? 555 TYR A CD1 1 +ATOM 4561 C CD2 . TYR A 1 555 ? 5.152 35.845 112.587 1.00 38.32 ? 555 TYR A CD2 1 +ATOM 4562 C CE1 . TYR A 1 555 ? 7.863 36.034 113.198 1.00 38.66 ? 555 TYR A CE1 1 +ATOM 4563 C CE2 . TYR A 1 555 ? 5.769 37.092 112.627 1.00 39.05 ? 555 TYR A CE2 1 +ATOM 4564 C CZ . TYR A 1 555 ? 7.123 37.180 112.933 1.00 39.98 ? 555 TYR A CZ 1 +ATOM 4565 O OH . TYR A 1 555 ? 7.726 38.417 112.979 1.00 42.20 ? 555 TYR A OH 1 +ATOM 4566 N N . LEU A 1 556 ? 4.330 30.644 111.261 1.00 39.36 ? 556 LEU A N 1 +ATOM 4567 C CA . LEU A 1 556 ? 3.362 29.556 111.337 1.00 37.73 ? 556 LEU A CA 1 +ATOM 4568 C C . LEU A 1 556 ? 3.702 28.267 110.604 1.00 37.15 ? 556 LEU A C 1 +ATOM 4569 O O . LEU A 1 556 ? 4.017 28.283 109.417 1.00 37.22 ? 556 LEU A O 1 +ATOM 4570 C CB . LEU A 1 556 ? 2.011 30.107 110.873 1.00 37.69 ? 556 LEU A CB 1 +ATOM 4571 C CG . LEU A 1 556 ? 0.728 29.318 111.109 1.00 38.80 ? 556 LEU A CG 1 +ATOM 4572 C CD1 . LEU A 1 556 ? -0.456 30.273 111.029 1.00 37.85 ? 556 LEU A CD1 1 +ATOM 4573 C CD2 . LEU A 1 556 ? 0.606 28.199 110.083 1.00 38.79 ? 556 LEU A CD2 1 +ATOM 4574 N N . LEU A 1 557 ? 3.651 27.150 111.330 1.00 37.07 ? 557 LEU A N 1 +ATOM 4575 C CA . LEU A 1 557 ? 3.924 25.846 110.742 1.00 37.09 ? 557 LEU A CA 1 +ATOM 4576 C C . LEU A 1 557 ? 2.601 25.110 110.577 1.00 37.43 ? 557 LEU A C 1 +ATOM 4577 O O . LEU A 1 557 ? 1.847 24.936 111.539 1.00 37.66 ? 557 LEU A O 1 +ATOM 4578 C CB . LEU A 1 557 ? 4.866 25.016 111.621 1.00 37.78 ? 557 LEU A CB 1 +ATOM 4579 C CG . LEU A 1 557 ? 5.334 23.695 110.979 1.00 39.91 ? 557 LEU A CG 1 +ATOM 4580 C CD1 . LEU A 1 557 ? 6.595 23.199 111.650 1.00 41.27 ? 557 LEU A CD1 1 +ATOM 4581 C CD2 . LEU A 1 557 ? 4.251 22.648 111.082 1.00 40.55 ? 557 LEU A CD2 1 +ATOM 4582 N N . TYR A 1 558 ? 2.319 24.685 109.351 1.00 36.70 ? 558 TYR A N 1 +ATOM 4583 C CA . TYR A 1 558 ? 1.085 23.964 109.070 1.00 35.68 ? 558 TYR A CA 1 +ATOM 4584 C C . TYR A 1 558 ? 1.400 22.572 108.533 1.00 34.79 ? 558 TYR A C 1 +ATOM 4585 O O . TYR A 1 558 ? 2.149 22.422 107.564 1.00 34.14 ? 558 TYR A O 1 +ATOM 4586 C CB . TYR A 1 558 ? 0.245 24.751 108.058 1.00 35.38 ? 558 TYR A CB 1 +ATOM 4587 C CG . TYR A 1 558 ? -1.086 24.118 107.711 1.00 35.23 ? 558 TYR A CG 1 +ATOM 4588 C CD1 . TYR A 1 558 ? -1.897 23.561 108.699 1.00 36.01 ? 558 TYR A CD1 1 +ATOM 4589 C CD2 . TYR A 1 558 ? -1.548 24.102 106.397 1.00 34.92 ? 558 TYR A CD2 1 +ATOM 4590 C CE1 . TYR A 1 558 ? -3.137 23.000 108.382 1.00 35.67 ? 558 TYR A CE1 1 +ATOM 4591 C CE2 . TYR A 1 558 ? -2.788 23.549 106.072 1.00 34.03 ? 558 TYR A CE2 1 +ATOM 4592 C CZ . TYR A 1 558 ? -3.572 22.999 107.067 1.00 35.76 ? 558 TYR A CZ 1 +ATOM 4593 O OH . TYR A 1 558 ? -4.790 22.432 106.760 1.00 37.70 ? 558 TYR A OH 1 +ATOM 4594 N N . ALA A 1 559 ? 0.841 21.556 109.182 1.00 34.41 ? 559 ALA A N 1 +ATOM 4595 C CA . ALA A 1 559 ? 1.041 20.175 108.763 1.00 34.94 ? 559 ALA A CA 1 +ATOM 4596 C C . ALA A 1 559 ? -0.316 19.616 108.357 1.00 34.99 ? 559 ALA A C 1 +ATOM 4597 O O . ALA A 1 559 ? -0.988 18.936 109.137 1.00 35.84 ? 559 ALA A O 1 +ATOM 4598 C CB . ALA A 1 559 ? 1.636 19.354 109.909 1.00 34.77 ? 559 ALA A CB 1 +ATOM 4599 N N . PRO A 1 560 ? -0.746 19.906 107.124 1.00 35.95 ? 560 PRO A N 1 +ATOM 4600 C CA . PRO A 1 560 ? -2.048 19.402 106.672 1.00 36.32 ? 560 PRO A CA 1 +ATOM 4601 C C . PRO A 1 560 ? -2.143 17.873 106.656 1.00 37.51 ? 560 PRO A C 1 +ATOM 4602 O O . PRO A 1 560 ? -1.164 17.165 106.396 1.00 35.35 ? 560 PRO A O 1 +ATOM 4603 C CB . PRO A 1 560 ? -2.189 20.014 105.276 1.00 35.08 ? 560 PRO A CB 1 +ATOM 4604 C CG . PRO A 1 560 ? -0.764 20.093 104.798 1.00 36.79 ? 560 PRO A CG 1 +ATOM 4605 C CD . PRO A 1 560 ? -0.031 20.595 106.033 1.00 35.22 ? 560 PRO A CD 1 +ATOM 4606 N N . ILE A 1 561 ? -3.333 17.373 106.958 1.00 39.47 ? 561 ILE A N 1 +ATOM 4607 C CA . ILE A 1 561 ? -3.578 15.945 106.948 1.00 42.14 ? 561 ILE A CA 1 +ATOM 4608 C C . ILE A 1 561 ? -3.825 15.533 105.499 1.00 43.54 ? 561 ILE A C 1 +ATOM 4609 O O . ILE A 1 561 ? -4.837 15.900 104.902 1.00 44.51 ? 561 ILE A O 1 +ATOM 4610 C CB . ILE A 1 561 ? -4.789 15.607 107.815 1.00 43.04 ? 561 ILE A CB 1 +ATOM 4611 C CG1 . ILE A 1 561 ? -4.431 15.872 109.284 1.00 44.54 ? 561 ILE A CG1 1 +ATOM 4612 C CG2 . ILE A 1 561 ? -5.207 14.168 107.587 1.00 42.54 ? 561 ILE A CG2 1 +ATOM 4613 C CD1 . ILE A 1 561 ? -5.555 15.622 110.262 1.00 46.15 ? 561 ILE A CD1 1 +ATOM 4614 N N . VAL A 1 562 ? -2.882 14.782 104.939 1.00 43.81 ? 562 VAL A N 1 +ATOM 4615 C CA . VAL A 1 562 ? -2.974 14.346 103.559 1.00 44.86 ? 562 VAL A CA 1 +ATOM 4616 C C . VAL A 1 562 ? -3.246 12.851 103.403 1.00 47.83 ? 562 VAL A C 1 +ATOM 4617 O O . VAL A 1 562 ? -2.779 12.224 102.453 1.00 48.21 ? 562 VAL A O 1 +ATOM 4618 C CB . VAL A 1 562 ? -1.689 14.714 102.792 1.00 43.76 ? 562 VAL A CB 1 +ATOM 4619 C CG1 . VAL A 1 562 ? -1.509 16.221 102.789 1.00 43.28 ? 562 VAL A CG1 1 +ATOM 4620 C CG2 . VAL A 1 562 ? -0.486 14.049 103.430 1.00 41.19 ? 562 VAL A CG2 1 +ATOM 4621 N N . SER A 1 563 ? -4.005 12.290 104.338 1.00 50.78 ? 563 SER A N 1 +ATOM 4622 C CA . SER A 1 563 ? -4.367 10.879 104.297 1.00 54.22 ? 563 SER A CA 1 +ATOM 4623 C C . SER A 1 563 ? -5.750 10.722 104.932 1.00 56.64 ? 563 SER A C 1 +ATOM 4624 O O . SER A 1 563 ? -6.336 11.696 105.404 1.00 56.66 ? 563 SER A O 1 +ATOM 4625 C CB . SER A 1 563 ? -3.350 10.041 105.064 1.00 54.58 ? 563 SER A CB 1 +ATOM 4626 O OG . SER A 1 563 ? -3.461 10.269 106.461 1.00 56.47 ? 563 SER A OG 1 +ATOM 4627 N N . LYS A 1 564 ? -6.266 9.498 104.947 1.00 59.54 ? 564 LYS A N 1 +ATOM 4628 C CA . LYS A 1 564 ? -7.582 9.241 105.515 1.00 62.23 ? 564 LYS A CA 1 +ATOM 4629 C C . LYS A 1 564 ? -7.553 9.200 107.041 1.00 63.71 ? 564 LYS A C 1 +ATOM 4630 O O . LYS A 1 564 ? -8.599 9.279 107.690 1.00 64.48 ? 564 LYS A O 1 +ATOM 4631 C CB . LYS A 1 564 ? -8.155 7.927 104.967 1.00 62.00 ? 564 LYS A CB 1 +ATOM 4632 C CG . LYS A 1 564 ? -8.406 7.919 103.455 1.00 63.82 ? 564 LYS A CG 1 +ATOM 4633 C CD . LYS A 1 564 ? -7.259 7.274 102.649 1.00 64.32 ? 564 LYS A CD 1 +ATOM 4634 C CE . LYS A 1 564 ? -5.964 8.090 102.687 1.00 63.42 ? 564 LYS A CE 1 +ATOM 4635 N NZ . LYS A 1 564 ? -4.878 7.518 101.834 1.00 63.51 ? 564 LYS A NZ 1 +ATOM 4636 N N . GLU A 1 565 ? -6.357 9.083 107.611 1.00 64.94 ? 565 GLU A N 1 +ATOM 4637 C CA . GLU A 1 565 ? -6.201 9.034 109.065 1.00 66.04 ? 565 GLU A CA 1 +ATOM 4638 C C . GLU A 1 565 ? -6.882 10.214 109.743 1.00 65.64 ? 565 GLU A C 1 +ATOM 4639 O O . GLU A 1 565 ? -7.244 11.200 109.095 1.00 65.86 ? 565 GLU A O 1 +ATOM 4640 C CB . GLU A 1 565 ? -4.724 9.061 109.456 1.00 68.71 ? 565 GLU A CB 1 +ATOM 4641 C CG . GLU A 1 565 ? -3.886 7.884 108.993 1.00 72.52 ? 565 GLU A CG 1 +ATOM 4642 C CD . GLU A 1 565 ? -2.446 7.995 109.486 1.00 75.37 ? 565 GLU A CD 1 +ATOM 4643 O OE1 . GLU A 1 565 ? -1.771 9.002 109.151 1.00 74.70 ? 565 GLU A OE1 1 +ATOM 4644 O OE2 . GLU A 1 565 ? -1.995 7.080 110.216 1.00 76.53 ? 565 GLU A OE2 1 +ATOM 4645 N N . GLU A 1 566 ? -7.033 10.115 111.059 1.00 65.19 ? 566 GLU A N 1 +ATOM 4646 C CA . GLU A 1 566 ? -7.664 11.171 111.840 1.00 64.93 ? 566 GLU A CA 1 +ATOM 4647 C C . GLU A 1 566 ? -6.590 12.078 112.438 1.00 62.34 ? 566 GLU A C 1 +ATOM 4648 O O . GLU A 1 566 ? -6.855 13.224 112.814 1.00 62.40 ? 566 GLU A O 1 +ATOM 4649 C CB . GLU A 1 566 ? -8.523 10.558 112.947 1.00 67.57 ? 566 GLU A CB 1 +ATOM 4650 C CG . GLU A 1 566 ? -9.418 11.558 113.660 1.00 72.36 ? 566 GLU A CG 1 +ATOM 4651 C CD . GLU A 1 566 ? -10.449 10.884 114.545 1.00 76.32 ? 566 GLU A CD 1 +ATOM 4652 O OE1 . GLU A 1 566 ? -10.047 10.150 115.479 1.00 77.50 ? 566 GLU A OE1 1 +ATOM 4653 O OE2 . GLU A 1 566 ? -11.664 11.086 114.302 1.00 77.70 ? 566 GLU A OE2 1 +ATOM 4654 N N . SER A 1 567 ? -5.373 11.553 112.521 1.00 58.47 ? 567 SER A N 1 +ATOM 4655 C CA . SER A 1 567 ? -4.243 12.304 113.048 1.00 54.88 ? 567 SER A CA 1 +ATOM 4656 C C . SER A 1 567 ? -3.010 11.890 112.266 1.00 51.23 ? 567 SER A C 1 +ATOM 4657 O O . SER A 1 567 ? -3.033 10.893 111.550 1.00 52.41 ? 567 SER A O 1 +ATOM 4658 C CB . SER A 1 567 ? -4.033 12.000 114.531 1.00 55.57 ? 567 SER A CB 1 +ATOM 4659 O OG . SER A 1 567 ? -3.588 10.669 114.709 1.00 57.43 ? 567 SER A OG 1 +ATOM 4660 N N . ARG A 1 568 ? -1.935 12.651 112.401 1.00 46.28 ? 568 ARG A N 1 +ATOM 4661 C CA . ARG A 1 568 ? -0.709 12.342 111.682 1.00 42.63 ? 568 ARG A CA 1 +ATOM 4662 C C . ARG A 1 568 ? 0.514 12.680 112.527 1.00 41.85 ? 568 ARG A C 1 +ATOM 4663 O O . ARG A 1 568 ? 0.408 13.311 113.579 1.00 41.15 ? 568 ARG A O 1 +ATOM 4664 C CB . ARG A 1 568 ? -0.640 13.158 110.395 1.00 38.97 ? 568 ARG A CB 1 +ATOM 4665 C CG . ARG A 1 568 ? -0.750 14.648 110.657 1.00 37.24 ? 568 ARG A CG 1 +ATOM 4666 C CD . ARG A 1 568 ? -0.246 15.471 109.501 1.00 36.13 ? 568 ARG A CD 1 +ATOM 4667 N NE . ARG A 1 568 ? 1.201 15.379 109.374 1.00 35.22 ? 568 ARG A NE 1 +ATOM 4668 C CZ . ARG A 1 568 ? 1.898 15.915 108.375 1.00 37.52 ? 568 ARG A CZ 1 +ATOM 4669 N NH1 . ARG A 1 568 ? 1.268 16.587 107.408 1.00 37.58 ? 568 ARG A NH1 1 +ATOM 4670 N NH2 . ARG A 1 568 ? 3.225 15.785 108.334 1.00 35.79 ? 568 ARG A NH2 1 +ATOM 4671 N N . LEU A 1 569 ? 1.677 12.257 112.053 1.00 40.75 ? 569 LEU A N 1 +ATOM 4672 C CA . LEU A 1 569 ? 2.913 12.556 112.740 1.00 39.51 ? 569 LEU A CA 1 +ATOM 4673 C C . LEU A 1 569 ? 3.376 13.896 112.193 1.00 38.95 ? 569 LEU A C 1 +ATOM 4674 O O . LEU A 1 569 ? 3.389 14.110 110.983 1.00 38.22 ? 569 LEU A O 1 +ATOM 4675 C CB . LEU A 1 569 ? 3.961 11.478 112.456 1.00 41.26 ? 569 LEU A CB 1 +ATOM 4676 C CG . LEU A 1 569 ? 3.728 10.103 113.097 1.00 43.29 ? 569 LEU A CG 1 +ATOM 4677 C CD1 . LEU A 1 569 ? 4.883 9.172 112.753 1.00 43.72 ? 569 LEU A CD1 1 +ATOM 4678 C CD2 . LEU A 1 569 ? 3.619 10.253 114.617 1.00 44.24 ? 569 LEU A CD2 1 +ATOM 4679 N N . VAL A 1 570 ? 3.740 14.804 113.088 1.00 38.05 ? 570 VAL A N 1 +ATOM 4680 C CA . VAL A 1 570 ? 4.202 16.125 112.693 1.00 37.49 ? 570 VAL A CA 1 +ATOM 4681 C C . VAL A 1 570 ? 5.651 16.311 113.113 1.00 39.07 ? 570 VAL A C 1 +ATOM 4682 O O . VAL A 1 570 ? 5.997 16.123 114.278 1.00 40.17 ? 570 VAL A O 1 +ATOM 4683 C CB . VAL A 1 570 ? 3.366 17.228 113.363 1.00 36.82 ? 570 VAL A CB 1 +ATOM 4684 C CG1 . VAL A 1 570 ? 3.928 18.594 113.012 1.00 34.13 ? 570 VAL A CG1 1 +ATOM 4685 C CG2 . VAL A 1 570 ? 1.911 17.108 112.931 1.00 37.51 ? 570 VAL A CG2 1 +ATOM 4686 N N . THR A 1 571 ? 6.500 16.673 112.162 1.00 39.95 ? 571 THR A N 1 +ATOM 4687 C CA . THR A 1 571 ? 7.904 16.894 112.461 1.00 41.07 ? 571 THR A CA 1 +ATOM 4688 C C . THR A 1 571 ? 8.096 18.374 112.755 1.00 42.22 ? 571 THR A C 1 +ATOM 4689 O O . THR A 1 571 ? 7.789 19.228 111.928 1.00 43.13 ? 571 THR A O 1 +ATOM 4690 C CB . THR A 1 571 ? 8.805 16.487 111.279 1.00 41.23 ? 571 THR A CB 1 +ATOM 4691 O OG1 . THR A 1 571 ? 8.703 15.075 111.076 1.00 42.77 ? 571 THR A OG1 1 +ATOM 4692 C CG2 . THR A 1 571 ? 10.258 16.835 111.559 1.00 41.53 ? 571 THR A CG2 1 +ATOM 4693 N N . LEU A 1 572 ? 8.597 18.676 113.946 1.00 42.56 ? 572 LEU A N 1 +ATOM 4694 C CA . LEU A 1 572 ? 8.822 20.058 114.338 1.00 42.52 ? 572 LEU A CA 1 +ATOM 4695 C C . LEU A 1 572 ? 10.297 20.409 114.273 1.00 43.07 ? 572 LEU A C 1 +ATOM 4696 O O . LEU A 1 572 ? 11.145 19.661 114.750 1.00 44.61 ? 572 LEU A O 1 +ATOM 4697 C CB . LEU A 1 572 ? 8.319 20.286 115.756 1.00 42.87 ? 572 LEU A CB 1 +ATOM 4698 C CG . LEU A 1 572 ? 6.828 20.084 116.026 1.00 42.38 ? 572 LEU A CG 1 +ATOM 4699 C CD1 . LEU A 1 572 ? 6.591 20.177 117.519 1.00 43.42 ? 572 LEU A CD1 1 +ATOM 4700 C CD2 . LEU A 1 572 ? 6.008 21.135 115.285 1.00 40.50 ? 572 LEU A CD2 1 +ATOM 4701 N N . PRO A 1 573 ? 10.628 21.551 113.662 1.00 43.78 ? 573 PRO A N 1 +ATOM 4702 C CA . PRO A 1 573 ? 12.030 21.972 113.562 1.00 44.85 ? 573 PRO A CA 1 +ATOM 4703 C C . PRO A 1 573 ? 12.555 22.417 114.936 1.00 46.64 ? 573 PRO A C 1 +ATOM 4704 O O . PRO A 1 573 ? 11.816 22.459 115.920 1.00 45.37 ? 573 PRO A O 1 +ATOM 4705 C CB . PRO A 1 573 ? 11.976 23.144 112.580 1.00 43.42 ? 573 PRO A CB 1 +ATOM 4706 C CG . PRO A 1 573 ? 10.757 22.859 111.760 1.00 44.72 ? 573 PRO A CG 1 +ATOM 4707 C CD . PRO A 1 573 ? 9.772 22.385 112.805 1.00 43.79 ? 573 PRO A CD 1 +ATOM 4708 N N . ARG A 1 574 ? 13.835 22.758 114.985 1.00 49.30 ? 574 ARG A N 1 +ATOM 4709 C CA . ARG A 1 574 ? 14.475 23.225 116.212 1.00 51.51 ? 574 ARG A CA 1 +ATOM 4710 C C . ARG A 1 574 ? 13.705 24.421 116.791 1.00 49.81 ? 574 ARG A C 1 +ATOM 4711 O O . ARG A 1 574 ? 13.131 25.216 116.048 1.00 50.69 ? 574 ARG A O 1 +ATOM 4712 C CB . ARG A 1 574 ? 15.916 23.625 115.888 1.00 54.90 ? 574 ARG A CB 1 +ATOM 4713 C CG . ARG A 1 574 ? 16.780 23.959 117.079 1.00 61.36 ? 574 ARG A CG 1 +ATOM 4714 C CD . ARG A 1 574 ? 18.228 24.153 116.634 1.00 66.47 ? 574 ARG A CD 1 +ATOM 4715 N NE . ARG A 1 574 ? 19.089 24.611 117.725 1.00 71.51 ? 574 ARG A NE 1 +ATOM 4716 C CZ . ARG A 1 574 ? 20.393 24.858 117.600 1.00 74.19 ? 574 ARG A CZ 1 +ATOM 4717 N NH1 . ARG A 1 574 ? 21.001 24.689 116.426 1.00 74.55 ? 574 ARG A NH1 1 +ATOM 4718 N NH2 . ARG A 1 574 ? 21.091 25.282 118.649 1.00 74.93 ? 574 ARG A NH2 1 +ATOM 4719 N N . GLY A 1 575 ? 13.677 24.538 118.115 1.00 47.91 ? 575 GLY A N 1 +ATOM 4720 C CA . GLY A 1 575 ? 12.970 25.650 118.736 1.00 46.02 ? 575 GLY A CA 1 +ATOM 4721 C C . GLY A 1 575 ? 11.681 25.232 119.406 1.00 45.51 ? 575 GLY A C 1 +ATOM 4722 O O . GLY A 1 575 ? 11.317 24.066 119.374 1.00 45.29 ? 575 GLY A O 1 +ATOM 4723 N N . LYS A 1 576 ? 10.976 26.171 120.019 1.00 45.49 ? 576 LYS A N 1 +ATOM 4724 C CA . LYS A 1 576 ? 9.725 25.826 120.684 1.00 46.00 ? 576 LYS A CA 1 +ATOM 4725 C C . LYS A 1 576 ? 8.520 26.122 119.806 1.00 44.97 ? 576 LYS A C 1 +ATOM 4726 O O . LYS A 1 576 ? 8.509 27.103 119.057 1.00 44.43 ? 576 LYS A O 1 +ATOM 4727 C CB . LYS A 1 576 ? 9.598 26.582 122.007 1.00 48.41 ? 576 LYS A CB 1 +ATOM 4728 C CG . LYS A 1 576 ? 10.514 26.060 123.094 1.00 52.23 ? 576 LYS A CG 1 +ATOM 4729 C CD . LYS A 1 576 ? 10.326 26.832 124.391 1.00 55.08 ? 576 LYS A CD 1 +ATOM 4730 C CE . LYS A 1 576 ? 11.144 26.214 125.516 1.00 56.63 ? 576 LYS A CE 1 +ATOM 4731 N NZ . LYS A 1 576 ? 11.011 27.006 126.773 1.00 58.98 ? 576 LYS A NZ 1 +ATOM 4732 N N . TRP A 1 577 ? 7.502 25.272 119.908 1.00 43.91 ? 577 TRP A N 1 +ATOM 4733 C CA . TRP A 1 577 ? 6.296 25.444 119.116 1.00 41.36 ? 577 TRP A CA 1 +ATOM 4734 C C . TRP A 1 577 ? 5.040 25.400 119.962 1.00 41.03 ? 577 TRP A C 1 +ATOM 4735 O O . TRP A 1 577 ? 4.899 24.579 120.875 1.00 40.75 ? 577 TRP A O 1 +ATOM 4736 C CB . TRP A 1 577 ? 6.245 24.380 118.019 1.00 40.85 ? 577 TRP A CB 1 +ATOM 4737 C CG . TRP A 1 577 ? 7.428 24.462 117.119 1.00 39.36 ? 577 TRP A CG 1 +ATOM 4738 C CD1 . TRP A 1 577 ? 8.652 23.889 117.321 1.00 39.71 ? 577 TRP A CD1 1 +ATOM 4739 C CD2 . TRP A 1 577 ? 7.529 25.211 115.901 1.00 38.87 ? 577 TRP A CD2 1 +ATOM 4740 N NE1 . TRP A 1 577 ? 9.513 24.237 116.302 1.00 40.72 ? 577 TRP A NE1 1 +ATOM 4741 C CE2 . TRP A 1 577 ? 8.847 25.047 115.417 1.00 39.29 ? 577 TRP A CE2 1 +ATOM 4742 C CE3 . TRP A 1 577 ? 6.635 26.005 115.173 1.00 39.26 ? 577 TRP A CE3 1 +ATOM 4743 C CZ2 . TRP A 1 577 ? 9.292 25.649 114.235 1.00 38.95 ? 577 TRP A CZ2 1 +ATOM 4744 C CZ3 . TRP A 1 577 ? 7.079 26.607 113.996 1.00 38.39 ? 577 TRP A CZ3 1 +ATOM 4745 C CH2 . TRP A 1 577 ? 8.397 26.423 113.541 1.00 39.10 ? 577 TRP A CH2 1 +ATOM 4746 N N . TYR A 1 578 ? 4.127 26.304 119.645 1.00 41.01 ? 578 TYR A N 1 +ATOM 4747 C CA . TYR A 1 578 ? 2.863 26.431 120.360 1.00 42.39 ? 578 TYR A CA 1 +ATOM 4748 C C . TYR A 1 578 ? 1.704 25.855 119.542 1.00 43.38 ? 578 TYR A C 1 +ATOM 4749 O O . TYR A 1 578 ? 1.526 26.209 118.378 1.00 44.21 ? 578 TYR A O 1 +ATOM 4750 C CB . TYR A 1 578 ? 2.624 27.916 120.643 1.00 40.72 ? 578 TYR A CB 1 +ATOM 4751 C CG . TYR A 1 578 ? 1.251 28.267 121.150 1.00 40.54 ? 578 TYR A CG 1 +ATOM 4752 C CD1 . TYR A 1 578 ? 0.888 28.029 122.473 1.00 40.36 ? 578 TYR A CD1 1 +ATOM 4753 C CD2 . TYR A 1 578 ? 0.311 28.855 120.304 1.00 41.32 ? 578 TYR A CD2 1 +ATOM 4754 C CE1 . TYR A 1 578 ? -0.387 28.373 122.944 1.00 40.83 ? 578 TYR A CE1 1 +ATOM 4755 C CE2 . TYR A 1 578 ? -0.960 29.201 120.759 1.00 40.92 ? 578 TYR A CE2 1 +ATOM 4756 C CZ . TYR A 1 578 ? -1.303 28.960 122.078 1.00 41.42 ? 578 TYR A CZ 1 +ATOM 4757 O OH . TYR A 1 578 ? -2.555 29.325 122.529 1.00 41.98 ? 578 TYR A OH 1 +ATOM 4758 N N . ASN A 1 579 ? 0.909 24.987 120.155 1.00 45.85 ? 579 ASN A N 1 +ATOM 4759 C CA . ASN A 1 579 ? -0.237 24.383 119.478 1.00 47.87 ? 579 ASN A CA 1 +ATOM 4760 C C . ASN A 1 579 ? -1.404 25.368 119.466 1.00 48.87 ? 579 ASN A C 1 +ATOM 4761 O O . ASN A 1 579 ? -2.025 25.622 120.497 1.00 50.55 ? 579 ASN A O 1 +ATOM 4762 C CB . ASN A 1 579 ? -0.662 23.102 120.197 1.00 48.87 ? 579 ASN A CB 1 +ATOM 4763 C CG . ASN A 1 579 ? -1.843 22.426 119.533 1.00 50.25 ? 579 ASN A CG 1 +ATOM 4764 O OD1 . ASN A 1 579 ? -2.833 23.073 119.185 1.00 51.46 ? 579 ASN A OD1 1 +ATOM 4765 N ND2 . ASN A 1 579 ? -1.752 21.113 119.366 1.00 50.22 ? 579 ASN A ND2 1 +ATOM 4766 N N . TYR A 1 580 ? -1.701 25.911 118.294 1.00 48.98 ? 580 TYR A N 1 +ATOM 4767 C CA . TYR A 1 580 ? -2.780 26.874 118.139 1.00 49.41 ? 580 TYR A CA 1 +ATOM 4768 C C . TYR A 1 580 ? -4.114 26.440 118.728 1.00 49.82 ? 580 TYR A C 1 +ATOM 4769 O O . TYR A 1 580 ? -4.878 27.281 119.196 1.00 50.05 ? 580 TYR A O 1 +ATOM 4770 C CB . TYR A 1 580 ? -2.990 27.198 116.657 1.00 49.80 ? 580 TYR A CB 1 +ATOM 4771 C CG . TYR A 1 580 ? -4.138 28.153 116.384 1.00 49.32 ? 580 TYR A CG 1 +ATOM 4772 C CD1 . TYR A 1 580 ? -4.019 29.521 116.660 1.00 49.07 ? 580 TYR A CD1 1 +ATOM 4773 C CD2 . TYR A 1 580 ? -5.346 27.689 115.858 1.00 49.32 ? 580 TYR A CD2 1 +ATOM 4774 C CE1 . TYR A 1 580 ? -5.077 30.404 116.418 1.00 48.98 ? 580 TYR A CE1 1 +ATOM 4775 C CE2 . TYR A 1 580 ? -6.412 28.564 115.614 1.00 50.18 ? 580 TYR A CE2 1 +ATOM 4776 C CZ . TYR A 1 580 ? -6.269 29.919 115.897 1.00 50.16 ? 580 TYR A CZ 1 +ATOM 4777 O OH . TYR A 1 580 ? -7.322 30.779 115.669 1.00 51.01 ? 580 TYR A OH 1 +ATOM 4778 N N . TRP A 1 581 ? -4.408 25.144 118.716 1.00 50.15 ? 581 TRP A N 1 +ATOM 4779 C CA . TRP A 1 581 ? -5.701 24.697 119.229 1.00 52.38 ? 581 TRP A CA 1 +ATOM 4780 C C . TRP A 1 581 ? -5.832 24.337 120.721 1.00 53.88 ? 581 TRP A C 1 +ATOM 4781 O O . TRP A 1 581 ? -6.885 24.599 121.317 1.00 54.12 ? 581 TRP A O 1 +ATOM 4782 C CB . TRP A 1 581 ? -6.239 23.544 118.365 1.00 52.46 ? 581 TRP A CB 1 +ATOM 4783 C CG . TRP A 1 581 ? -6.374 23.909 116.906 1.00 53.22 ? 581 TRP A CG 1 +ATOM 4784 C CD1 . TRP A 1 581 ? -5.473 23.658 115.911 1.00 53.61 ? 581 TRP A CD1 1 +ATOM 4785 C CD2 . TRP A 1 581 ? -7.434 24.666 116.300 1.00 53.93 ? 581 TRP A CD2 1 +ATOM 4786 N NE1 . TRP A 1 581 ? -5.898 24.213 114.727 1.00 52.46 ? 581 TRP A NE1 1 +ATOM 4787 C CE2 . TRP A 1 581 ? -7.098 24.838 114.936 1.00 52.94 ? 581 TRP A CE2 1 +ATOM 4788 C CE3 . TRP A 1 581 ? -8.633 25.220 116.777 1.00 53.82 ? 581 TRP A CE3 1 +ATOM 4789 C CZ2 . TRP A 1 581 ? -7.916 25.540 114.045 1.00 51.75 ? 581 TRP A CZ2 1 +ATOM 4790 C CZ3 . TRP A 1 581 ? -9.447 25.920 115.888 1.00 52.07 ? 581 TRP A CZ3 1 +ATOM 4791 C CH2 . TRP A 1 581 ? -9.081 26.072 114.539 1.00 52.43 ? 581 TRP A CH2 1 +ATOM 4792 N N . ASN A 1 582 ? -4.797 23.752 121.331 1.00 53.57 ? 582 ASN A N 1 +ATOM 4793 C CA . ASN A 1 582 ? -4.889 23.390 122.752 1.00 53.13 ? 582 ASN A CA 1 +ATOM 4794 C C . ASN A 1 582 ? -3.846 24.045 123.662 1.00 55.05 ? 582 ASN A C 1 +ATOM 4795 O O . ASN A 1 582 ? -3.760 23.716 124.850 1.00 55.15 ? 582 ASN A O 1 +ATOM 4796 C CB . ASN A 1 582 ? -4.839 21.866 122.942 1.00 48.58 ? 582 ASN A CB 1 +ATOM 4797 C CG . ASN A 1 582 ? -3.494 21.260 122.566 1.00 45.96 ? 582 ASN A CG 1 +ATOM 4798 O OD1 . ASN A 1 582 ? -2.476 21.950 122.495 1.00 42.83 ? 582 ASN A OD1 1 +ATOM 4799 N ND2 . ASN A 1 582 ? -3.485 19.950 122.344 1.00 44.71 ? 582 ASN A ND2 1 +ATOM 4800 N N . GLY A 1 583 ? -3.048 24.953 123.102 1.00 55.90 ? 583 GLY A N 1 +ATOM 4801 C CA . GLY A 1 583 ? -2.051 25.662 123.889 1.00 56.99 ? 583 GLY A CA 1 +ATOM 4802 C C . GLY A 1 583 ? -0.730 24.992 124.232 1.00 58.10 ? 583 GLY A C 1 +ATOM 4803 O O . GLY A 1 583 ? 0.243 25.676 124.569 1.00 58.73 ? 583 GLY A O 1 +ATOM 4804 N N . GLU A 1 584 ? -0.684 23.668 124.165 1.00 58.37 ? 584 GLU A N 1 +ATOM 4805 C CA . GLU A 1 584 ? 0.528 22.921 124.479 1.00 58.83 ? 584 GLU A CA 1 +ATOM 4806 C C . GLU A 1 584 ? 1.762 23.468 123.761 1.00 58.21 ? 584 GLU A C 1 +ATOM 4807 O O . GLU A 1 584 ? 1.722 23.755 122.575 1.00 59.71 ? 584 GLU A O 1 +ATOM 4808 C CB . GLU A 1 584 ? 0.318 21.452 124.115 1.00 60.97 ? 584 GLU A CB 1 +ATOM 4809 C CG . GLU A 1 584 ? 1.545 20.562 124.240 1.00 64.66 ? 584 GLU A CG 1 +ATOM 4810 C CD . GLU A 1 584 ? 1.212 19.092 123.999 1.00 67.91 ? 584 GLU A CD 1 +ATOM 4811 O OE1 . GLU A 1 584 ? 0.457 18.801 123.037 1.00 69.69 ? 584 GLU A OE1 1 +ATOM 4812 O OE2 . GLU A 1 584 ? 1.705 18.229 124.764 1.00 68.65 ? 584 GLU A OE2 1 +ATOM 4813 N N . ILE A 1 585 ? 2.857 23.628 124.487 1.00 58.00 ? 585 ILE A N 1 +ATOM 4814 C CA . ILE A 1 585 ? 4.092 24.118 123.889 1.00 57.72 ? 585 ILE A CA 1 +ATOM 4815 C C . ILE A 1 585 ? 5.065 22.948 123.848 1.00 58.49 ? 585 ILE A C 1 +ATOM 4816 O O . ILE A 1 585 ? 5.284 22.280 124.863 1.00 58.10 ? 585 ILE A O 1 +ATOM 4817 C CB . ILE A 1 585 ? 4.705 25.264 124.713 1.00 57.32 ? 585 ILE A CB 1 +ATOM 4818 C CG1 . ILE A 1 585 ? 3.749 26.461 124.725 1.00 56.21 ? 585 ILE A CG1 1 +ATOM 4819 C CG2 . ILE A 1 585 ? 6.055 25.651 124.133 1.00 57.41 ? 585 ILE A CG2 1 +ATOM 4820 C CD1 . ILE A 1 585 ? 4.291 27.688 125.424 1.00 56.56 ? 585 ILE A CD1 1 +ATOM 4821 N N . ILE A 1 586 ? 5.642 22.697 122.675 1.00 58.34 ? 586 ILE A N 1 +ATOM 4822 C CA . ILE A 1 586 ? 6.562 21.580 122.507 1.00 58.28 ? 586 ILE A CA 1 +ATOM 4823 C C . ILE A 1 586 ? 7.952 22.012 122.070 1.00 58.39 ? 586 ILE A C 1 +ATOM 4824 O O . ILE A 1 586 ? 8.111 23.037 121.409 1.00 57.77 ? 586 ILE A O 1 +ATOM 4825 C CB . ILE A 1 586 ? 6.022 20.574 121.465 1.00 58.90 ? 586 ILE A CB 1 +ATOM 4826 C CG1 . ILE A 1 586 ? 4.636 20.082 121.878 1.00 59.11 ? 586 ILE A CG1 1 +ATOM 4827 C CG2 . ILE A 1 586 ? 6.966 19.378 121.348 1.00 58.89 ? 586 ILE A CG2 1 +ATOM 4828 C CD1 . ILE A 1 586 ? 4.636 19.255 123.145 1.00 60.44 ? 586 ILE A CD1 1 +ATOM 4829 N N . ASN A 1 587 ? 8.952 21.208 122.436 1.00 58.45 ? 587 ASN A N 1 +ATOM 4830 C CA . ASN A 1 587 ? 10.334 21.492 122.081 1.00 58.52 ? 587 ASN A CA 1 +ATOM 4831 C C . ASN A 1 587 ? 10.688 20.930 120.723 1.00 59.03 ? 587 ASN A C 1 +ATOM 4832 O O . ASN A 1 587 ? 10.438 19.760 120.415 1.00 59.34 ? 587 ASN A O 1 +ATOM 4833 C CB . ASN A 1 587 ? 11.285 20.943 123.136 1.00 60.47 ? 587 ASN A CB 1 +ATOM 4834 C CG . ASN A 1 587 ? 11.416 21.868 124.321 1.00 61.83 ? 587 ASN A CG 1 +ATOM 4835 O OD1 . ASN A 1 587 ? 11.851 23.013 124.176 1.00 63.73 ? 587 ASN A OD1 1 +ATOM 4836 N ND2 . ASN A 1 587 ? 11.032 21.386 125.500 1.00 62.19 ? 587 ASN A ND2 1 +ATOM 4837 N N . GLY A 1 588 ? 11.289 21.790 119.916 1.00 59.29 ? 588 GLY A N 1 +ATOM 4838 C CA . GLY A 1 588 ? 11.666 21.434 118.567 1.00 59.60 ? 588 GLY A CA 1 +ATOM 4839 C C . GLY A 1 588 ? 12.610 20.271 118.376 1.00 59.91 ? 588 GLY A C 1 +ATOM 4840 O O . GLY A 1 588 ? 13.267 19.799 119.303 1.00 59.87 ? 588 GLY A O 1 +ATOM 4841 N N . LYS A 1 589 ? 12.677 19.832 117.124 1.00 60.17 ? 589 LYS A N 1 +ATOM 4842 C CA . LYS A 1 589 ? 13.512 18.724 116.725 1.00 57.84 ? 589 LYS A CA 1 +ATOM 4843 C C . LYS A 1 589 ? 12.911 17.507 117.391 1.00 56.38 ? 589 LYS A C 1 +ATOM 4844 O O . LYS A 1 589 ? 13.537 16.847 118.219 1.00 57.39 ? 589 LYS A O 1 +ATOM 4845 C CB . LYS A 1 589 ? 14.954 18.953 117.176 1.00 59.63 ? 589 LYS A CB 1 +ATOM 4846 C CG . LYS A 1 589 ? 15.959 18.116 116.411 1.00 62.67 ? 589 LYS A CG 1 +ATOM 4847 C CD . LYS A 1 589 ? 15.799 18.311 114.909 1.00 64.35 ? 589 LYS A CD 1 +ATOM 4848 C CE . LYS A 1 589 ? 16.712 17.375 114.127 1.00 65.09 ? 589 LYS A CE 1 +ATOM 4849 N NZ . LYS A 1 589 ? 16.390 17.414 112.677 1.00 65.23 ? 589 LYS A NZ 1 +ATOM 4850 N N . SER A 1 590 ? 11.664 17.233 117.030 1.00 53.58 ? 590 SER A N 1 +ATOM 4851 C CA . SER A 1 590 ? 10.937 16.093 117.566 1.00 50.42 ? 590 SER A CA 1 +ATOM 4852 C C . SER A 1 590 ? 9.759 15.779 116.660 1.00 48.49 ? 590 SER A C 1 +ATOM 4853 O O . SER A 1 590 ? 9.424 16.549 115.764 1.00 47.79 ? 590 SER A O 1 +ATOM 4854 C CB . SER A 1 590 ? 10.426 16.399 118.977 1.00 50.29 ? 590 SER A CB 1 +ATOM 4855 O OG . SER A 1 590 ? 9.488 17.460 118.958 1.00 50.57 ? 590 SER A OG 1 +ATOM 4856 N N . VAL A 1 591 ? 9.133 14.639 116.903 1.00 47.00 ? 591 VAL A N 1 +ATOM 4857 C CA . VAL A 1 591 ? 7.991 14.225 116.121 1.00 46.38 ? 591 VAL A CA 1 +ATOM 4858 C C . VAL A 1 591 ? 6.827 14.042 117.080 1.00 47.12 ? 591 VAL A C 1 +ATOM 4859 O O . VAL A 1 591 ? 6.947 13.348 118.087 1.00 48.57 ? 591 VAL A O 1 +ATOM 4860 C CB . VAL A 1 591 ? 8.278 12.900 115.376 1.00 45.15 ? 591 VAL A CB 1 +ATOM 4861 C CG1 . VAL A 1 591 ? 7.024 12.419 114.665 1.00 46.00 ? 591 VAL A CG1 1 +ATOM 4862 C CG2 . VAL A 1 591 ? 9.401 13.107 114.367 1.00 42.89 ? 591 VAL A CG2 1 +ATOM 4863 N N . VAL A 1 592 ? 5.704 14.681 116.778 1.00 46.82 ? 592 VAL A N 1 +ATOM 4864 C CA . VAL A 1 592 ? 4.525 14.574 117.628 1.00 46.62 ? 592 VAL A CA 1 +ATOM 4865 C C . VAL A 1 592 ? 3.291 14.226 116.812 1.00 46.45 ? 592 VAL A C 1 +ATOM 4866 O O . VAL A 1 592 ? 3.274 14.361 115.594 1.00 46.50 ? 592 VAL A O 1 +ATOM 4867 C CB . VAL A 1 592 ? 4.254 15.895 118.385 1.00 47.05 ? 592 VAL A CB 1 +ATOM 4868 C CG1 . VAL A 1 592 ? 5.488 16.295 119.181 1.00 47.72 ? 592 VAL A CG1 1 +ATOM 4869 C CG2 . VAL A 1 592 ? 3.880 17.002 117.399 1.00 46.74 ? 592 VAL A CG2 1 +ATOM 4870 N N . LYS A 1 593 ? 2.255 13.781 117.500 1.00 47.46 ? 593 LYS A N 1 +ATOM 4871 C CA . LYS A 1 593 ? 1.010 13.411 116.857 1.00 49.05 ? 593 LYS A CA 1 +ATOM 4872 C C . LYS A 1 593 ? 0.103 14.648 116.846 1.00 48.71 ? 593 LYS A C 1 +ATOM 4873 O O . LYS A 1 593 ? 0.063 15.395 117.820 1.00 47.92 ? 593 LYS A O 1 +ATOM 4874 C CB . LYS A 1 593 ? 0.372 12.260 117.643 1.00 50.01 ? 593 LYS A CB 1 +ATOM 4875 C CG . LYS A 1 593 ? -0.839 11.618 117.000 1.00 56.37 ? 593 LYS A CG 1 +ATOM 4876 C CD . LYS A 1 593 ? -1.383 10.499 117.894 1.00 60.49 ? 593 LYS A CD 1 +ATOM 4877 C CE . LYS A 1 593 ? -2.668 9.882 117.333 1.00 62.60 ? 593 LYS A CE 1 +ATOM 4878 N NZ . LYS A 1 593 ? -3.204 8.788 118.198 1.00 63.86 ? 593 LYS A NZ 1 +ATOM 4879 N N . SER A 1 594 ? -0.603 14.878 115.742 1.00 48.79 ? 594 SER A N 1 +ATOM 4880 C CA . SER A 1 594 ? -1.505 16.025 115.636 1.00 49.27 ? 594 SER A CA 1 +ATOM 4881 C C . SER A 1 594 ? -2.657 15.906 116.633 1.00 50.28 ? 594 SER A C 1 +ATOM 4882 O O . SER A 1 594 ? -2.975 14.808 117.082 1.00 50.16 ? 594 SER A O 1 +ATOM 4883 C CB . SER A 1 594 ? -2.058 16.128 114.213 1.00 47.80 ? 594 SER A CB 1 +ATOM 4884 O OG . SER A 1 594 ? -2.526 14.874 113.743 1.00 47.53 ? 594 SER A OG 1 +ATOM 4885 N N . THR A 1 595 ? -3.282 17.034 116.972 1.00 51.62 ? 595 THR A N 1 +ATOM 4886 C CA . THR A 1 595 ? -4.386 17.045 117.934 1.00 52.52 ? 595 THR A CA 1 +ATOM 4887 C C . THR A 1 595 ? -5.667 17.667 117.380 1.00 53.75 ? 595 THR A C 1 +ATOM 4888 O O . THR A 1 595 ? -6.704 17.672 118.047 1.00 54.14 ? 595 THR A O 1 +ATOM 4889 C CB . THR A 1 595 ? -4.010 17.832 119.200 1.00 51.99 ? 595 THR A CB 1 +ATOM 4890 O OG1 . THR A 1 595 ? -4.107 19.238 118.934 1.00 53.11 ? 595 THR A OG1 1 +ATOM 4891 C CG2 . THR A 1 595 ? -2.586 17.509 119.619 1.00 52.26 ? 595 THR A CG2 1 +ATOM 4892 N N . HIS A 1 596 ? -5.592 18.198 116.168 1.00 54.69 ? 596 HIS A N 1 +ATOM 4893 C CA . HIS A 1 596 ? -6.745 18.833 115.540 1.00 55.72 ? 596 HIS A CA 1 +ATOM 4894 C C . HIS A 1 596 ? -6.754 18.469 114.056 1.00 55.39 ? 596 HIS A C 1 +ATOM 4895 O O . HIS A 1 596 ? -5.722 18.094 113.494 1.00 54.82 ? 596 HIS A O 1 +ATOM 4896 C CB . HIS A 1 596 ? -6.649 20.359 115.701 1.00 57.95 ? 596 HIS A CB 1 +ATOM 4897 C CG . HIS A 1 596 ? -7.873 21.104 115.256 1.00 60.19 ? 596 HIS A CG 1 +ATOM 4898 N ND1 . HIS A 1 596 ? -8.854 21.517 116.133 1.00 61.61 ? 596 HIS A ND1 1 +ATOM 4899 C CD2 . HIS A 1 596 ? -8.279 21.500 114.026 1.00 60.85 ? 596 HIS A CD2 1 +ATOM 4900 C CE1 . HIS A 1 596 ? -9.812 22.134 115.463 1.00 61.40 ? 596 HIS A CE1 1 +ATOM 4901 N NE2 . HIS A 1 596 ? -9.488 22.137 114.182 1.00 61.99 ? 596 HIS A NE2 1 +ATOM 4902 N N . GLU A 1 597 ? -7.916 18.579 113.423 1.00 54.23 ? 597 GLU A N 1 +ATOM 4903 C CA . GLU A 1 597 ? -8.016 18.269 112.006 1.00 53.57 ? 597 GLU A CA 1 +ATOM 4904 C C . GLU A 1 597 ? -7.100 19.178 111.197 1.00 51.28 ? 597 GLU A C 1 +ATOM 4905 O O . GLU A 1 597 ? -6.645 18.800 110.121 1.00 51.66 ? 597 GLU A O 1 +ATOM 4906 C CB . GLU A 1 597 ? -9.455 18.431 111.519 1.00 56.64 ? 597 GLU A CB 1 +ATOM 4907 C CG . GLU A 1 597 ? -10.428 17.435 112.122 1.00 62.67 ? 597 GLU A CG 1 +ATOM 4908 C CD . GLU A 1 597 ? -11.829 17.546 111.528 1.00 68.00 ? 597 GLU A CD 1 +ATOM 4909 O OE1 . GLU A 1 597 ? -12.006 17.194 110.334 1.00 69.89 ? 597 GLU A OE1 1 +ATOM 4910 O OE2 . GLU A 1 597 ? -12.751 17.990 112.259 1.00 70.34 ? 597 GLU A OE2 1 +ATOM 4911 N N . LEU A 1 598 ? -6.835 20.375 111.722 1.00 48.82 ? 598 LEU A N 1 +ATOM 4912 C CA . LEU A 1 598 ? -5.959 21.347 111.059 1.00 46.83 ? 598 LEU A CA 1 +ATOM 4913 C C . LEU A 1 598 ? -4.755 21.637 111.965 1.00 45.50 ? 598 LEU A C 1 +ATOM 4914 O O . LEU A 1 598 ? -4.774 22.583 112.755 1.00 46.48 ? 598 LEU A O 1 +ATOM 4915 C CB . LEU A 1 598 ? -6.724 22.647 110.782 1.00 44.39 ? 598 LEU A CB 1 +ATOM 4916 C CG . LEU A 1 598 ? -8.074 22.520 110.064 1.00 43.69 ? 598 LEU A CG 1 +ATOM 4917 C CD1 . LEU A 1 598 ? -8.735 23.882 110.019 1.00 42.59 ? 598 LEU A CD1 1 +ATOM 4918 C CD2 . LEU A 1 598 ? -7.895 21.966 108.661 1.00 42.51 ? 598 LEU A CD2 1 +ATOM 4919 N N . PRO A 1 599 ? -3.690 20.823 111.856 1.00 43.94 ? 599 PRO A N 1 +ATOM 4920 C CA . PRO A 1 599 ? -2.456 20.949 112.654 1.00 41.82 ? 599 PRO A CA 1 +ATOM 4921 C C . PRO A 1 599 ? -1.670 22.240 112.438 1.00 40.54 ? 599 PRO A C 1 +ATOM 4922 O O . PRO A 1 599 ? -0.836 22.329 111.534 1.00 40.92 ? 599 PRO A O 1 +ATOM 4923 C CB . PRO A 1 599 ? -1.648 19.714 112.247 1.00 42.38 ? 599 PRO A CB 1 +ATOM 4924 C CG . PRO A 1 599 ? -2.708 18.732 111.771 1.00 42.84 ? 599 PRO A CG 1 +ATOM 4925 C CD . PRO A 1 599 ? -3.631 19.633 110.990 1.00 43.24 ? 599 PRO A CD 1 +ATOM 4926 N N . ILE A 1 600 ? -1.931 23.232 113.284 1.00 39.45 ? 600 ILE A N 1 +ATOM 4927 C CA . ILE A 1 600 ? -1.254 24.526 113.205 1.00 38.94 ? 600 ILE A CA 1 +ATOM 4928 C C . ILE A 1 600 ? -0.383 24.787 114.438 1.00 39.25 ? 600 ILE A C 1 +ATOM 4929 O O . ILE A 1 600 ? -0.828 24.595 115.576 1.00 39.06 ? 600 ILE A O 1 +ATOM 4930 C CB . ILE A 1 600 ? -2.281 25.656 113.090 1.00 38.66 ? 600 ILE A CB 1 +ATOM 4931 C CG1 . ILE A 1 600 ? -3.078 25.491 111.799 1.00 38.48 ? 600 ILE A CG1 1 +ATOM 4932 C CG2 . ILE A 1 600 ? -1.582 27.001 113.103 1.00 39.22 ? 600 ILE A CG2 1 +ATOM 4933 C CD1 . ILE A 1 600 ? -4.322 26.332 111.746 1.00 38.03 ? 600 ILE A CD1 1 +ATOM 4934 N N . TYR A 1 601 ? 0.850 25.228 114.213 1.00 38.04 ? 601 TYR A N 1 +ATOM 4935 C CA . TYR A 1 601 ? 1.766 25.500 115.315 1.00 38.59 ? 601 TYR A CA 1 +ATOM 4936 C C . TYR A 1 601 ? 2.442 26.854 115.155 1.00 40.41 ? 601 TYR A C 1 +ATOM 4937 O O . TYR A 1 601 ? 2.892 27.206 114.061 1.00 41.33 ? 601 TYR A O 1 +ATOM 4938 C CB . TYR A 1 601 ? 2.849 24.420 115.395 1.00 37.28 ? 601 TYR A CB 1 +ATOM 4939 C CG . TYR A 1 601 ? 2.310 23.022 115.565 1.00 37.77 ? 601 TYR A CG 1 +ATOM 4940 C CD1 . TYR A 1 601 ? 1.804 22.313 114.478 1.00 37.06 ? 601 TYR A CD1 1 +ATOM 4941 C CD2 . TYR A 1 601 ? 2.279 22.411 116.825 1.00 37.59 ? 601 TYR A CD2 1 +ATOM 4942 C CE1 . TYR A 1 601 ? 1.279 21.030 114.634 1.00 37.57 ? 601 TYR A CE1 1 +ATOM 4943 C CE2 . TYR A 1 601 ? 1.750 21.126 116.993 1.00 37.78 ? 601 TYR A CE2 1 +ATOM 4944 C CZ . TYR A 1 601 ? 1.252 20.446 115.891 1.00 38.51 ? 601 TYR A CZ 1 +ATOM 4945 O OH . TYR A 1 601 ? 0.707 19.191 116.048 1.00 41.79 ? 601 TYR A OH 1 +ATOM 4946 N N . LEU A 1 602 ? 2.519 27.613 116.247 1.00 41.30 ? 602 LEU A N 1 +ATOM 4947 C CA . LEU A 1 602 ? 3.168 28.922 116.200 1.00 42.53 ? 602 LEU A CA 1 +ATOM 4948 C C . LEU A 1 602 ? 4.562 28.826 116.785 1.00 42.50 ? 602 LEU A C 1 +ATOM 4949 O O . LEU A 1 602 ? 4.771 28.215 117.830 1.00 44.27 ? 602 LEU A O 1 +ATOM 4950 C CB . LEU A 1 602 ? 2.362 29.965 116.974 1.00 42.18 ? 602 LEU A CB 1 +ATOM 4951 C CG . LEU A 1 602 ? 0.926 30.157 116.494 1.00 44.02 ? 602 LEU A CG 1 +ATOM 4952 C CD1 . LEU A 1 602 ? 0.304 31.343 117.212 1.00 44.36 ? 602 LEU A CD1 1 +ATOM 4953 C CD2 . LEU A 1 602 ? 0.919 30.385 114.991 1.00 43.92 ? 602 LEU A CD2 1 +ATOM 4954 N N . ARG A 1 603 ? 5.508 29.441 116.092 1.00 43.83 ? 603 ARG A N 1 +ATOM 4955 C CA . ARG A 1 603 ? 6.916 29.461 116.474 1.00 45.63 ? 603 ARG A CA 1 +ATOM 4956 C C . ARG A 1 603 ? 7.140 30.487 117.604 1.00 47.50 ? 603 ARG A C 1 +ATOM 4957 O O . ARG A 1 603 ? 6.489 31.525 117.621 1.00 48.10 ? 603 ARG A O 1 +ATOM 4958 C CB . ARG A 1 603 ? 7.718 29.855 115.236 1.00 44.03 ? 603 ARG A CB 1 +ATOM 4959 C CG . ARG A 1 603 ? 9.201 29.766 115.355 1.00 43.46 ? 603 ARG A CG 1 +ATOM 4960 C CD . ARG A 1 603 ? 9.792 30.300 114.079 1.00 44.15 ? 603 ARG A CD 1 +ATOM 4961 N NE . ARG A 1 603 ? 11.235 30.122 113.999 1.00 44.85 ? 603 ARG A NE 1 +ATOM 4962 C CZ . ARG A 1 603 ? 11.949 30.407 112.914 1.00 46.29 ? 603 ARG A CZ 1 +ATOM 4963 N NH1 . ARG A 1 603 ? 11.343 30.886 111.829 1.00 46.27 ? 603 ARG A NH1 1 +ATOM 4964 N NH2 . ARG A 1 603 ? 13.262 30.207 112.908 1.00 46.52 ? 603 ARG A NH2 1 +ATOM 4965 N N . GLU A 1 604 ? 8.038 30.218 118.551 1.00 48.88 ? 604 GLU A N 1 +ATOM 4966 C CA . GLU A 1 604 ? 8.288 31.178 119.633 1.00 49.78 ? 604 GLU A CA 1 +ATOM 4967 C C . GLU A 1 604 ? 8.918 32.395 118.975 1.00 49.30 ? 604 GLU A C 1 +ATOM 4968 O O . GLU A 1 604 ? 9.969 32.281 118.341 1.00 50.18 ? 604 GLU A O 1 +ATOM 4969 C CB . GLU A 1 604 ? 9.240 30.587 120.686 1.00 51.30 ? 604 GLU A CB 1 +ATOM 4970 C CG . GLU A 1 604 ? 9.487 31.486 121.895 1.00 54.64 ? 604 GLU A CG 1 +ATOM 4971 C CD . GLU A 1 604 ? 10.316 30.798 122.980 1.00 58.94 ? 604 GLU A CD 1 +ATOM 4972 O OE1 . GLU A 1 604 ? 11.445 30.340 122.678 1.00 59.85 ? 604 GLU A OE1 1 +ATOM 4973 O OE2 . GLU A 1 604 ? 9.834 30.714 124.136 1.00 60.77 ? 604 GLU A OE2 1 +ATOM 4974 N N . GLY A 1 605 ? 8.271 33.551 119.126 1.00 48.60 ? 605 GLY A N 1 +ATOM 4975 C CA . GLY A 1 605 ? 8.754 34.776 118.510 1.00 47.70 ? 605 GLY A CA 1 +ATOM 4976 C C . GLY A 1 605 ? 7.848 35.068 117.328 1.00 48.10 ? 605 GLY A C 1 +ATOM 4977 O O . GLY A 1 605 ? 8.316 35.209 116.193 1.00 48.63 ? 605 GLY A O 1 +ATOM 4978 N N . SER A 1 606 ? 6.543 35.155 117.599 1.00 47.12 ? 606 SER A N 1 +ATOM 4979 C CA . SER A 1 606 ? 5.546 35.397 116.559 1.00 45.70 ? 606 SER A CA 1 +ATOM 4980 C C . SER A 1 606 ? 4.540 36.481 116.894 1.00 45.41 ? 606 SER A C 1 +ATOM 4981 O O . SER A 1 606 ? 4.169 36.683 118.053 1.00 46.98 ? 606 SER A O 1 +ATOM 4982 C CB . SER A 1 606 ? 4.752 34.115 116.272 1.00 45.29 ? 606 SER A CB 1 +ATOM 4983 O OG . SER A 1 606 ? 5.594 33.030 115.922 1.00 46.22 ? 606 SER A OG 1 +ATOM 4984 N N . ILE A 1 607 ? 4.089 37.164 115.854 1.00 44.16 ? 607 ILE A N 1 +ATOM 4985 C CA . ILE A 1 607 ? 3.070 38.189 115.980 1.00 42.98 ? 607 ILE A CA 1 +ATOM 4986 C C . ILE A 1 607 ? 2.130 37.934 114.810 1.00 41.69 ? 607 ILE A C 1 +ATOM 4987 O O . ILE A 1 607 ? 2.519 38.026 113.650 1.00 41.75 ? 607 ILE A O 1 +ATOM 4988 C CB . ILE A 1 607 ? 3.661 39.605 115.875 1.00 44.07 ? 607 ILE A CB 1 +ATOM 4989 C CG1 . ILE A 1 607 ? 4.553 39.878 117.092 1.00 44.29 ? 607 ILE A CG1 1 +ATOM 4990 C CG2 . ILE A 1 607 ? 2.527 40.633 115.768 1.00 42.56 ? 607 ILE A CG2 1 +ATOM 4991 C CD1 . ILE A 1 607 ? 5.282 41.213 117.041 1.00 45.77 ? 607 ILE A CD1 1 +ATOM 4992 N N . ILE A 1 608 ? 0.888 37.601 115.112 1.00 41.23 ? 608 ILE A N 1 +ATOM 4993 C CA . ILE A 1 608 ? -0.045 37.313 114.049 1.00 40.73 ? 608 ILE A CA 1 +ATOM 4994 C C . ILE A 1 608 ? -1.316 38.130 114.104 1.00 40.48 ? 608 ILE A C 1 +ATOM 4995 O O . ILE A 1 608 ? -2.092 38.032 115.059 1.00 40.90 ? 608 ILE A O 1 +ATOM 4996 C CB . ILE A 1 608 ? -0.386 35.802 114.041 1.00 40.62 ? 608 ILE A CB 1 +ATOM 4997 C CG1 . ILE A 1 608 ? 0.889 35.009 113.749 1.00 41.07 ? 608 ILE A CG1 1 +ATOM 4998 C CG2 . ILE A 1 608 ? -1.445 35.488 112.987 1.00 38.86 ? 608 ILE A CG2 1 +ATOM 4999 C CD1 . ILE A 1 608 ? 0.729 33.523 113.914 1.00 43.77 ? 608 ILE A CD1 1 +ATOM 5000 N N . PRO A 1 609 ? -1.532 38.977 113.084 1.00 39.59 ? 609 PRO A N 1 +ATOM 5001 C CA . PRO A 1 609 ? -2.737 39.805 113.029 1.00 39.64 ? 609 PRO A CA 1 +ATOM 5002 C C . PRO A 1 609 ? -3.876 38.956 112.462 1.00 40.40 ? 609 PRO A C 1 +ATOM 5003 O O . PRO A 1 609 ? -3.706 38.261 111.460 1.00 40.06 ? 609 PRO A O 1 +ATOM 5004 C CB . PRO A 1 609 ? -2.328 40.942 112.096 1.00 38.89 ? 609 PRO A CB 1 +ATOM 5005 C CG . PRO A 1 609 ? -1.397 40.268 111.152 1.00 39.32 ? 609 PRO A CG 1 +ATOM 5006 C CD . PRO A 1 609 ? -0.560 39.392 112.057 1.00 38.58 ? 609 PRO A CD 1 +ATOM 5007 N N . LEU A 1 610 ? -5.026 39.000 113.113 1.00 40.77 ? 610 LEU A N 1 +ATOM 5008 C CA . LEU A 1 610 ? -6.166 38.226 112.667 1.00 42.54 ? 610 LEU A CA 1 +ATOM 5009 C C . LEU A 1 610 ? -7.333 39.126 112.288 1.00 43.84 ? 610 LEU A C 1 +ATOM 5010 O O . LEU A 1 610 ? -7.325 40.329 112.547 1.00 44.02 ? 610 LEU A O 1 +ATOM 5011 C CB . LEU A 1 610 ? -6.600 37.252 113.768 1.00 42.74 ? 610 LEU A CB 1 +ATOM 5012 C CG . LEU A 1 610 ? -5.557 36.225 114.241 1.00 43.44 ? 610 LEU A CG 1 +ATOM 5013 C CD1 . LEU A 1 610 ? -6.134 35.425 115.408 1.00 43.25 ? 610 LEU A CD1 1 +ATOM 5014 C CD2 . LEU A 1 610 ? -5.166 35.295 113.094 1.00 42.33 ? 610 LEU A CD2 1 +ATOM 5015 N N . GLU A 1 611 ? -8.337 38.530 111.662 1.00 45.53 ? 611 GLU A N 1 +ATOM 5016 C CA . GLU A 1 611 ? -9.528 39.254 111.239 1.00 47.06 ? 611 GLU A CA 1 +ATOM 5017 C C . GLU A 1 611 ? -10.174 39.984 112.416 1.00 47.98 ? 611 GLU A C 1 +ATOM 5018 O O . GLU A 1 611 ? -10.177 39.485 113.548 1.00 47.96 ? 611 GLU A O 1 +ATOM 5019 C CB . GLU A 1 611 ? -10.521 38.264 110.637 1.00 48.26 ? 611 GLU A CB 1 +ATOM 5020 C CG . GLU A 1 611 ? -11.852 38.847 110.218 1.00 51.49 ? 611 GLU A CG 1 +ATOM 5021 C CD . GLU A 1 611 ? -12.739 37.805 109.549 1.00 53.80 ? 611 GLU A CD 1 +ATOM 5022 O OE1 . GLU A 1 611 ? -12.912 36.707 110.125 1.00 54.69 ? 611 GLU A OE1 1 +ATOM 5023 O OE2 . GLU A 1 611 ? -13.264 38.081 108.447 1.00 56.82 ? 611 GLU A OE2 1 +ATOM 5024 N N . GLY A 1 612 ? -10.718 41.166 112.142 1.00 48.43 ? 612 GLY A N 1 +ATOM 5025 C CA . GLY A 1 612 ? -11.377 41.939 113.182 1.00 48.72 ? 612 GLY A CA 1 +ATOM 5026 C C . GLY A 1 612 ? -10.425 42.545 114.198 1.00 49.98 ? 612 GLY A C 1 +ATOM 5027 O O . GLY A 1 612 ? -10.735 42.615 115.387 1.00 50.04 ? 612 GLY A O 1 +ATOM 5028 N N . ASP A 1 613 ? -9.256 42.967 113.729 1.00 50.58 ? 613 ASP A N 1 +ATOM 5029 C CA . ASP A 1 613 ? -8.256 43.587 114.589 1.00 50.53 ? 613 ASP A CA 1 +ATOM 5030 C C . ASP A 1 613 ? -7.773 42.732 115.763 1.00 50.23 ? 613 ASP A C 1 +ATOM 5031 O O . ASP A 1 613 ? -7.254 43.269 116.747 1.00 49.34 ? 613 ASP A O 1 +ATOM 5032 C CB . ASP A 1 613 ? -8.789 44.921 115.108 1.00 52.27 ? 613 ASP A CB 1 +ATOM 5033 C CG . ASP A 1 613 ? -9.068 45.910 113.991 1.00 53.73 ? 613 ASP A CG 1 +ATOM 5034 O OD1 . ASP A 1 613 ? -8.098 46.396 113.361 1.00 54.69 ? 613 ASP A OD1 1 +ATOM 5035 O OD2 . ASP A 1 613 ? -10.259 46.197 113.740 1.00 54.53 ? 613 ASP A OD2 1 +ATOM 5036 N N . GLU A 1 614 ? -7.952 41.414 115.671 1.00 49.81 ? 614 GLU A N 1 +ATOM 5037 C CA . GLU A 1 614 ? -7.479 40.521 116.723 1.00 48.87 ? 614 GLU A CA 1 +ATOM 5038 C C . GLU A 1 614 ? -5.966 40.469 116.574 1.00 48.06 ? 614 GLU A C 1 +ATOM 5039 O O . GLU A 1 614 ? -5.437 40.833 115.520 1.00 48.08 ? 614 GLU A O 1 +ATOM 5040 C CB . GLU A 1 614 ? -8.053 39.116 116.559 1.00 51.49 ? 614 GLU A CB 1 +ATOM 5041 C CG . GLU A 1 614 ? -9.249 38.806 117.449 1.00 56.34 ? 614 GLU A CG 1 +ATOM 5042 C CD . GLU A 1 614 ? -9.596 37.307 117.484 1.00 60.98 ? 614 GLU A CD 1 +ATOM 5043 O OE1 . GLU A 1 614 ? -8.696 36.479 117.795 1.00 62.13 ? 614 GLU A OE1 1 +ATOM 5044 O OE2 . GLU A 1 614 ? -10.771 36.958 117.211 1.00 61.79 ? 614 GLU A OE2 1 +ATOM 5045 N N . LEU A 1 615 ? -5.268 40.022 117.615 1.00 46.69 ? 615 LEU A N 1 +ATOM 5046 C CA . LEU A 1 615 ? -3.818 39.954 117.563 1.00 45.67 ? 615 LEU A CA 1 +ATOM 5047 C C . LEU A 1 615 ? -3.290 38.855 118.486 1.00 46.45 ? 615 LEU A C 1 +ATOM 5048 O O . LEU A 1 615 ? -3.734 38.733 119.629 1.00 46.18 ? 615 LEU A O 1 +ATOM 5049 C CB . LEU A 1 615 ? -3.242 41.308 117.967 1.00 46.48 ? 615 LEU A CB 1 +ATOM 5050 C CG . LEU A 1 615 ? -1.768 41.585 117.673 1.00 47.61 ? 615 LEU A CG 1 +ATOM 5051 C CD1 . LEU A 1 615 ? -1.553 41.661 116.180 1.00 47.49 ? 615 LEU A CD1 1 +ATOM 5052 C CD2 . LEU A 1 615 ? -1.364 42.903 118.314 1.00 49.36 ? 615 LEU A CD2 1 +ATOM 5053 N N . ILE A 1 616 ? -2.360 38.046 117.979 1.00 45.63 ? 616 ILE A N 1 +ATOM 5054 C CA . ILE A 1 616 ? -1.758 36.970 118.762 1.00 45.01 ? 616 ILE A CA 1 +ATOM 5055 C C . ILE A 1 616 ? -0.272 37.260 118.890 1.00 44.45 ? 616 ILE A C 1 +ATOM 5056 O O . ILE A 1 616 ? 0.405 37.525 117.896 1.00 44.00 ? 616 ILE A O 1 +ATOM 5057 C CB . ILE A 1 616 ? -1.859 35.589 118.078 1.00 45.99 ? 616 ILE A CB 1 +ATOM 5058 C CG1 . ILE A 1 616 ? -3.303 35.241 117.755 1.00 48.06 ? 616 ILE A CG1 1 +ATOM 5059 C CG2 . ILE A 1 616 ? -1.290 34.524 118.997 1.00 45.65 ? 616 ILE A CG2 1 +ATOM 5060 C CD1 . ILE A 1 616 ? -3.424 33.909 117.026 1.00 48.57 ? 616 ILE A CD1 1 +ATOM 5061 N N . VAL A 1 617 ? 0.242 37.194 120.108 1.00 44.18 ? 617 VAL A N 1 +ATOM 5062 C CA . VAL A 1 617 ? 1.655 37.448 120.319 1.00 42.59 ? 617 VAL A CA 1 +ATOM 5063 C C . VAL A 1 617 ? 2.270 36.336 121.138 1.00 43.53 ? 617 VAL A C 1 +ATOM 5064 O O . VAL A 1 617 ? 1.714 35.915 122.156 1.00 45.09 ? 617 VAL A O 1 +ATOM 5065 C CB . VAL A 1 617 ? 1.888 38.789 121.038 1.00 40.81 ? 617 VAL A CB 1 +ATOM 5066 C CG1 . VAL A 1 617 ? 3.380 39.021 121.229 1.00 40.39 ? 617 VAL A CG1 1 +ATOM 5067 C CG2 . VAL A 1 617 ? 1.295 39.917 120.225 1.00 40.69 ? 617 VAL A CG2 1 +ATOM 5068 N N . TYR A 1 618 ? 3.418 35.851 120.679 1.00 43.48 ? 618 TYR A N 1 +ATOM 5069 C CA . TYR A 1 618 ? 4.132 34.787 121.367 1.00 43.96 ? 618 TYR A CA 1 +ATOM 5070 C C . TYR A 1 618 ? 5.619 35.056 121.248 1.00 45.99 ? 618 TYR A C 1 +ATOM 5071 O O . TYR A 1 618 ? 6.206 34.876 120.173 1.00 46.56 ? 618 TYR A O 1 +ATOM 5072 C CB . TYR A 1 618 ? 3.801 33.428 120.748 1.00 43.40 ? 618 TYR A CB 1 +ATOM 5073 C CG . TYR A 1 618 ? 4.617 32.268 121.287 1.00 44.75 ? 618 TYR A CG 1 +ATOM 5074 C CD1 . TYR A 1 618 ? 5.200 32.316 122.560 1.00 45.10 ? 618 TYR A CD1 1 +ATOM 5075 C CD2 . TYR A 1 618 ? 4.760 31.092 120.546 1.00 45.44 ? 618 TYR A CD2 1 +ATOM 5076 C CE1 . TYR A 1 618 ? 5.902 31.216 123.079 1.00 45.22 ? 618 TYR A CE1 1 +ATOM 5077 C CE2 . TYR A 1 618 ? 5.459 29.989 121.057 1.00 45.60 ? 618 TYR A CE2 1 +ATOM 5078 C CZ . TYR A 1 618 ? 6.023 30.059 122.319 1.00 45.07 ? 618 TYR A CZ 1 +ATOM 5079 O OH . TYR A 1 618 ? 6.698 28.969 122.813 1.00 46.98 ? 618 TYR A OH 1 +ATOM 5080 N N . GLY A 1 619 ? 6.221 35.502 122.348 1.00 45.57 ? 619 GLY A N 1 +ATOM 5081 C CA . GLY A 1 619 ? 7.644 35.782 122.345 1.00 47.14 ? 619 GLY A CA 1 +ATOM 5082 C C . GLY A 1 619 ? 8.008 37.145 121.795 1.00 48.91 ? 619 GLY A C 1 +ATOM 5083 O O . GLY A 1 619 ? 7.152 38.025 121.657 1.00 49.81 ? 619 GLY A O 1 +ATOM 5084 N N . GLU A 1 620 ? 9.285 37.312 121.464 1.00 50.21 ? 620 GLU A N 1 +ATOM 5085 C CA . GLU A 1 620 ? 9.784 38.577 120.946 1.00 52.26 ? 620 GLU A CA 1 +ATOM 5086 C C . GLU A 1 620 ? 10.112 38.555 119.458 1.00 52.21 ? 620 GLU A C 1 +ATOM 5087 O O . GLU A 1 620 ? 10.824 37.672 118.966 1.00 52.72 ? 620 GLU A O 1 +ATOM 5088 C CB . GLU A 1 620 ? 11.030 38.983 121.726 1.00 55.13 ? 620 GLU A CB 1 +ATOM 5089 C CG . GLU A 1 620 ? 10.835 38.961 123.235 1.00 60.77 ? 620 GLU A CG 1 +ATOM 5090 C CD . GLU A 1 620 ? 12.137 39.178 123.992 1.00 64.46 ? 620 GLU A CD 1 +ATOM 5091 O OE1 . GLU A 1 620 ? 13.070 38.360 123.822 1.00 66.18 ? 620 GLU A OE1 1 +ATOM 5092 O OE2 . GLU A 1 620 ? 12.229 40.169 124.756 1.00 67.50 ? 620 GLU A OE2 1 +ATOM 5093 N N . THR A 1 621 ? 9.595 39.546 118.743 1.00 51.47 ? 621 THR A N 1 +ATOM 5094 C CA . THR A 1 621 ? 9.839 39.661 117.312 1.00 51.34 ? 621 THR A CA 1 +ATOM 5095 C C . THR A 1 621 ? 9.288 41.002 116.847 1.00 50.90 ? 621 THR A C 1 +ATOM 5096 O O . THR A 1 621 ? 8.723 41.757 117.639 1.00 51.11 ? 621 THR A O 1 +ATOM 5097 C CB . THR A 1 621 ? 9.149 38.495 116.516 1.00 51.10 ? 621 THR A CB 1 +ATOM 5098 O OG1 . THR A 1 621 ? 9.520 38.568 115.133 1.00 49.39 ? 621 THR A OG1 1 +ATOM 5099 C CG2 . THR A 1 621 ? 7.627 38.579 116.633 1.00 51.22 ? 621 THR A CG2 1 +ATOM 5100 N N . SER A 1 622 ? 9.476 41.297 115.568 1.00 50.28 ? 622 SER A N 1 +ATOM 5101 C CA . SER A 1 622 ? 8.980 42.529 114.984 1.00 50.33 ? 622 SER A CA 1 +ATOM 5102 C C . SER A 1 622 ? 8.209 42.132 113.719 1.00 50.14 ? 622 SER A C 1 +ATOM 5103 O O . SER A 1 622 ? 8.645 41.262 112.961 1.00 48.55 ? 622 SER A O 1 +ATOM 5104 C CB . SER A 1 622 ? 10.143 43.457 114.642 1.00 51.49 ? 622 SER A CB 1 +ATOM 5105 O OG . SER A 1 622 ? 9.664 44.747 114.304 1.00 55.71 ? 622 SER A OG 1 +ATOM 5106 N N . PHE A 1 623 ? 7.065 42.770 113.495 1.00 50.10 ? 623 PHE A N 1 +ATOM 5107 C CA . PHE A 1 623 ? 6.223 42.441 112.354 1.00 49.15 ? 623 PHE A CA 1 +ATOM 5108 C C . PHE A 1 623 ? 5.535 43.659 111.755 1.00 48.64 ? 623 PHE A C 1 +ATOM 5109 O O . PHE A 1 623 ? 5.002 44.502 112.473 1.00 48.58 ? 623 PHE A O 1 +ATOM 5110 C CB . PHE A 1 623 ? 5.162 41.427 112.792 1.00 49.69 ? 623 PHE A CB 1 +ATOM 5111 C CG . PHE A 1 623 ? 4.238 40.996 111.692 1.00 50.14 ? 623 PHE A CG 1 +ATOM 5112 C CD1 . PHE A 1 623 ? 4.692 40.165 110.673 1.00 50.01 ? 623 PHE A CD1 1 +ATOM 5113 C CD2 . PHE A 1 623 ? 2.912 41.424 111.676 1.00 50.75 ? 623 PHE A CD2 1 +ATOM 5114 C CE1 . PHE A 1 623 ? 3.836 39.759 109.646 1.00 51.54 ? 623 PHE A CE1 1 +ATOM 5115 C CE2 . PHE A 1 623 ? 2.048 41.028 110.659 1.00 51.89 ? 623 PHE A CE2 1 +ATOM 5116 C CZ . PHE A 1 623 ? 2.511 40.191 109.638 1.00 51.54 ? 623 PHE A CZ 1 +ATOM 5117 N N . LYS A 1 624 ? 5.531 43.733 110.429 1.00 48.61 ? 624 LYS A N 1 +ATOM 5118 C CA . LYS A 1 624 ? 4.900 44.842 109.726 1.00 48.14 ? 624 LYS A CA 1 +ATOM 5119 C C . LYS A 1 624 ? 3.551 44.398 109.144 1.00 48.02 ? 624 LYS A C 1 +ATOM 5120 O O . LYS A 1 624 ? 3.493 43.529 108.275 1.00 47.41 ? 624 LYS A O 1 +ATOM 5121 C CB . LYS A 1 624 ? 5.831 45.329 108.612 1.00 47.17 ? 624 LYS A CB 1 +ATOM 5122 C CG . LYS A 1 624 ? 5.329 46.535 107.856 1.00 49.10 ? 624 LYS A CG 1 +ATOM 5123 C CD . LYS A 1 624 ? 6.347 46.962 106.819 1.00 50.27 ? 624 LYS A CD 1 +ATOM 5124 C CE . LYS A 1 624 ? 5.852 48.158 106.035 1.00 51.96 ? 624 LYS A CE 1 +ATOM 5125 N NZ . LYS A 1 624 ? 6.885 48.625 105.070 1.00 53.17 ? 624 LYS A NZ 1 +ATOM 5126 N N . ARG A 1 625 ? 2.465 44.981 109.637 1.00 48.20 ? 625 ARG A N 1 +ATOM 5127 C CA . ARG A 1 625 ? 1.146 44.629 109.133 1.00 49.88 ? 625 ARG A CA 1 +ATOM 5128 C C . ARG A 1 625 ? 0.955 45.257 107.751 1.00 50.38 ? 625 ARG A C 1 +ATOM 5129 O O . ARG A 1 625 ? 1.620 46.238 107.413 1.00 50.96 ? 625 ARG A O 1 +ATOM 5130 C CB . ARG A 1 625 ? 0.064 45.104 110.098 1.00 50.19 ? 625 ARG A CB 1 +ATOM 5131 C CG . ARG A 1 625 ? -1.231 44.337 109.954 1.00 52.73 ? 625 ARG A CG 1 +ATOM 5132 C CD . ARG A 1 625 ? -2.163 44.605 111.120 1.00 53.76 ? 625 ARG A CD 1 +ATOM 5133 N NE . ARG A 1 625 ? -2.522 46.014 111.215 1.00 54.54 ? 625 ARG A NE 1 +ATOM 5134 C CZ . ARG A 1 625 ? -3.397 46.499 112.087 1.00 54.87 ? 625 ARG A CZ 1 +ATOM 5135 N NH1 . ARG A 1 625 ? -4.004 45.687 112.942 1.00 54.71 ? 625 ARG A NH1 1 +ATOM 5136 N NH2 . ARG A 1 625 ? -3.669 47.793 112.100 1.00 55.08 ? 625 ARG A NH2 1 +ATOM 5137 N N . TYR A 1 626 ? 0.053 44.687 106.955 1.00 51.00 ? 626 TYR A N 1 +ATOM 5138 C CA . TYR A 1 626 ? -0.190 45.165 105.595 1.00 50.80 ? 626 TYR A CA 1 +ATOM 5139 C C . TYR A 1 626 ? -0.560 46.641 105.481 1.00 52.81 ? 626 TYR A C 1 +ATOM 5140 O O . TYR A 1 626 ? -0.308 47.268 104.449 1.00 52.68 ? 626 TYR A O 1 +ATOM 5141 C CB . TYR A 1 626 ? -1.273 44.315 104.926 1.00 47.97 ? 626 TYR A CB 1 +ATOM 5142 C CG . TYR A 1 626 ? -2.670 44.539 105.449 1.00 45.56 ? 626 TYR A CG 1 +ATOM 5143 C CD1 . TYR A 1 626 ? -3.446 45.602 104.994 1.00 43.58 ? 626 TYR A CD1 1 +ATOM 5144 C CD2 . TYR A 1 626 ? -3.228 43.672 106.386 1.00 46.55 ? 626 TYR A CD2 1 +ATOM 5145 C CE1 . TYR A 1 626 ? -4.745 45.792 105.456 1.00 44.66 ? 626 TYR A CE1 1 +ATOM 5146 C CE2 . TYR A 1 626 ? -4.529 43.855 106.857 1.00 45.86 ? 626 TYR A CE2 1 +ATOM 5147 C CZ . TYR A 1 626 ? -5.281 44.914 106.387 1.00 45.21 ? 626 TYR A CZ 1 +ATOM 5148 O OH . TYR A 1 626 ? -6.568 45.085 106.849 1.00 46.96 ? 626 TYR A OH 1 +ATOM 5149 N N . ASP A 1 627 ? -1.165 47.195 106.527 1.00 54.70 ? 627 ASP A N 1 +ATOM 5150 C CA . ASP A 1 627 ? -1.557 48.600 106.503 1.00 56.58 ? 627 ASP A CA 1 +ATOM 5151 C C . ASP A 1 627 ? -0.405 49.480 106.981 1.00 57.31 ? 627 ASP A C 1 +ATOM 5152 O O . ASP A 1 627 ? -0.606 50.625 107.385 1.00 57.67 ? 627 ASP A O 1 +ATOM 5153 C CB . ASP A 1 627 ? -2.814 48.821 107.358 1.00 57.21 ? 627 ASP A CB 1 +ATOM 5154 C CG . ASP A 1 627 ? -2.579 48.556 108.834 1.00 59.16 ? 627 ASP A CG 1 +ATOM 5155 O OD1 . ASP A 1 627 ? -1.620 47.826 109.174 1.00 60.19 ? 627 ASP A OD1 1 +ATOM 5156 O OD2 . ASP A 1 627 ? -3.372 49.072 109.654 1.00 60.38 ? 627 ASP A OD2 1 +ATOM 5157 N N . ASN A 1 628 ? 0.805 48.926 106.930 1.00 58.32 ? 628 ASN A N 1 +ATOM 5158 C CA . ASN A 1 628 ? 2.015 49.642 107.320 1.00 59.31 ? 628 ASN A CA 1 +ATOM 5159 C C . ASN A 1 628 ? 2.299 49.752 108.827 1.00 58.71 ? 628 ASN A C 1 +ATOM 5160 O O . ASN A 1 628 ? 3.396 50.147 109.227 1.00 58.93 ? 628 ASN A O 1 +ATOM 5161 C CB . ASN A 1 628 ? 1.999 51.030 106.676 1.00 62.58 ? 628 ASN A CB 1 +ATOM 5162 C CG . ASN A 1 628 ? 2.717 52.068 107.508 1.00 66.75 ? 628 ASN A CG 1 +ATOM 5163 O OD1 . ASN A 1 628 ? 2.228 52.478 108.570 1.00 68.60 ? 628 ASN A OD1 1 +ATOM 5164 N ND2 . ASN A 1 628 ? 3.890 52.498 107.039 1.00 68.12 ? 628 ASN A ND2 1 +ATOM 5165 N N . ALA A 1 629 ? 1.328 49.401 109.666 1.00 57.72 ? 629 ALA A N 1 +ATOM 5166 C CA . ALA A 1 629 ? 1.526 49.467 111.113 1.00 55.84 ? 629 ALA A CA 1 +ATOM 5167 C C . ALA A 1 629 ? 2.525 48.402 111.572 1.00 56.09 ? 629 ALA A C 1 +ATOM 5168 O O . ALA A 1 629 ? 2.306 47.210 111.368 1.00 56.29 ? 629 ALA A O 1 +ATOM 5169 C CB . ALA A 1 629 ? 0.198 49.275 111.831 1.00 53.79 ? 629 ALA A CB 1 +ATOM 5170 N N . GLU A 1 630 ? 3.625 48.831 112.186 1.00 55.91 ? 630 GLU A N 1 +ATOM 5171 C CA . GLU A 1 630 ? 4.635 47.896 112.676 1.00 56.52 ? 630 GLU A CA 1 +ATOM 5172 C C . GLU A 1 630 ? 4.399 47.578 114.151 1.00 55.07 ? 630 GLU A C 1 +ATOM 5173 O O . GLU A 1 630 ? 4.124 48.467 114.950 1.00 55.30 ? 630 GLU A O 1 +ATOM 5174 C CB . GLU A 1 630 ? 6.028 48.484 112.481 1.00 59.25 ? 630 GLU A CB 1 +ATOM 5175 C CG . GLU A 1 630 ? 6.358 48.744 111.020 1.00 65.42 ? 630 GLU A CG 1 +ATOM 5176 C CD . GLU A 1 630 ? 7.546 49.680 110.834 1.00 68.81 ? 630 GLU A CD 1 +ATOM 5177 O OE1 . GLU A 1 630 ? 8.655 49.341 111.310 1.00 70.35 ? 630 GLU A OE1 1 +ATOM 5178 O OE2 . GLU A 1 630 ? 7.368 50.755 110.210 1.00 70.36 ? 630 GLU A OE2 1 +ATOM 5179 N N . ILE A 1 631 ? 4.498 46.302 114.501 1.00 53.45 ? 631 ILE A N 1 +ATOM 5180 C CA . ILE A 1 631 ? 4.277 45.858 115.869 1.00 52.46 ? 631 ILE A CA 1 +ATOM 5181 C C . ILE A 1 631 ? 5.537 45.170 116.366 1.00 53.18 ? 631 ILE A C 1 +ATOM 5182 O O . ILE A 1 631 ? 6.125 44.356 115.655 1.00 53.56 ? 631 ILE A O 1 +ATOM 5183 C CB . ILE A 1 631 ? 3.103 44.859 115.940 1.00 51.49 ? 631 ILE A CB 1 +ATOM 5184 C CG1 . ILE A 1 631 ? 1.861 45.470 115.290 1.00 50.99 ? 631 ILE A CG1 1 +ATOM 5185 C CG2 . ILE A 1 631 ? 2.812 44.498 117.384 1.00 50.80 ? 631 ILE A CG2 1 +ATOM 5186 C CD1 . ILE A 1 631 ? 0.690 44.520 115.202 1.00 49.68 ? 631 ILE A CD1 1 +ATOM 5187 N N . THR A 1 632 ? 5.955 45.496 117.582 1.00 53.27 ? 632 THR A N 1 +ATOM 5188 C CA . THR A 1 632 ? 7.159 44.890 118.131 1.00 54.74 ? 632 THR A CA 1 +ATOM 5189 C C . THR A 1 632 ? 6.945 44.372 119.545 1.00 55.94 ? 632 THR A C 1 +ATOM 5190 O O . THR A 1 632 ? 6.318 45.033 120.371 1.00 56.28 ? 632 THR A O 1 +ATOM 5191 C CB . THR A 1 632 ? 8.332 45.894 118.152 1.00 54.62 ? 632 THR A CB 1 +ATOM 5192 O OG1 . THR A 1 632 ? 8.488 46.485 116.850 1.00 54.04 ? 632 THR A OG1 1 +ATOM 5193 C CG2 . THR A 1 632 ? 9.629 45.181 118.555 1.00 52.86 ? 632 THR A CG2 1 +ATOM 5194 N N . SER A 1 633 ? 7.457 43.178 119.816 1.00 57.36 ? 633 SER A N 1 +ATOM 5195 C CA . SER A 1 633 ? 7.328 42.595 121.141 1.00 60.14 ? 633 SER A CA 1 +ATOM 5196 C C . SER A 1 633 ? 8.725 42.317 121.694 1.00 62.53 ? 633 SER A C 1 +ATOM 5197 O O . SER A 1 633 ? 9.591 41.777 121.002 1.00 61.48 ? 633 SER A O 1 +ATOM 5198 C CB . SER A 1 633 ? 6.506 41.298 121.091 1.00 59.15 ? 633 SER A CB 1 +ATOM 5199 O OG . SER A 1 633 ? 7.207 40.262 120.424 1.00 58.74 ? 633 SER A OG 1 +ATOM 5200 N N . SER A 1 634 ? 8.938 42.717 122.941 1.00 67.02 ? 634 SER A N 1 +ATOM 5201 C CA . SER A 1 634 ? 10.214 42.528 123.618 1.00 71.88 ? 634 SER A CA 1 +ATOM 5202 C C . SER A 1 634 ? 9.911 42.124 125.059 1.00 74.49 ? 634 SER A C 1 +ATOM 5203 O O . SER A 1 634 ? 8.860 41.527 125.321 1.00 75.66 ? 634 SER A O 1 +ATOM 5204 C CB . SER A 1 634 ? 11.024 43.831 123.586 1.00 72.00 ? 634 SER A CB 1 +ATOM 5205 O OG . SER A 1 634 ? 10.263 44.923 124.088 1.00 73.50 ? 634 SER A OG 1 +ATOM 5206 N N . SER A 1 635 ? 10.829 42.446 125.974 1.00 76.54 ? 635 SER A N 1 +ATOM 5207 C CA . SER A 1 635 ? 10.692 42.146 127.408 1.00 77.67 ? 635 SER A CA 1 +ATOM 5208 C C . SER A 1 635 ? 9.290 41.661 127.796 1.00 77.88 ? 635 SER A C 1 +ATOM 5209 O O . SER A 1 635 ? 9.029 40.458 127.883 1.00 78.35 ? 635 SER A O 1 +ATOM 5210 C CB . SER A 1 635 ? 11.030 43.399 128.227 1.00 78.41 ? 635 SER A CB 1 +ATOM 5211 O OG . SER A 1 635 ? 10.136 44.466 127.928 1.00 77.31 ? 635 SER A OG 1 +ATOM 5212 N N . ASN A 1 636 ? 8.402 42.620 128.031 1.00 77.44 ? 636 ASN A N 1 +ATOM 5213 C CA . ASN A 1 636 ? 7.015 42.356 128.396 1.00 77.00 ? 636 ASN A CA 1 +ATOM 5214 C C . ASN A 1 636 ? 6.277 43.562 127.851 1.00 75.32 ? 636 ASN A C 1 +ATOM 5215 O O . ASN A 1 636 ? 5.305 44.044 128.437 1.00 74.91 ? 636 ASN A O 1 +ATOM 5216 C CB . ASN A 1 636 ? 6.866 42.302 129.913 1.00 79.21 ? 636 ASN A CB 1 +ATOM 5217 C CG . ASN A 1 636 ? 7.914 41.427 130.565 1.00 81.89 ? 636 ASN A CG 1 +ATOM 5218 O OD1 . ASN A 1 636 ? 7.923 40.204 130.385 1.00 83.41 ? 636 ASN A OD1 1 +ATOM 5219 N ND2 . ASN A 1 636 ? 8.818 42.052 131.317 1.00 82.33 ? 636 ASN A ND2 1 +ATOM 5220 N N . GLU A 1 637 ? 6.765 44.043 126.713 1.00 73.12 ? 637 GLU A N 1 +ATOM 5221 C CA . GLU A 1 637 ? 6.204 45.219 126.069 1.00 71.88 ? 637 GLU A CA 1 +ATOM 5222 C C . GLU A 1 637 ? 5.927 45.023 124.576 1.00 69.42 ? 637 GLU A C 1 +ATOM 5223 O O . GLU A 1 637 ? 6.735 44.442 123.845 1.00 69.11 ? 637 GLU A O 1 +ATOM 5224 C CB . GLU A 1 637 ? 7.167 46.391 126.273 1.00 74.09 ? 637 GLU A CB 1 +ATOM 5225 C CG . GLU A 1 637 ? 6.715 47.720 125.688 1.00 78.76 ? 637 GLU A CG 1 +ATOM 5226 C CD . GLU A 1 637 ? 7.715 48.838 125.965 1.00 81.79 ? 637 GLU A CD 1 +ATOM 5227 O OE1 . GLU A 1 637 ? 8.903 48.685 125.587 1.00 83.07 ? 637 GLU A OE1 1 +ATOM 5228 O OE2 . GLU A 1 637 ? 7.314 49.865 126.560 1.00 83.40 ? 637 GLU A OE2 1 +ATOM 5229 N N . ILE A 1 638 ? 4.773 45.511 124.137 1.00 66.21 ? 638 ILE A N 1 +ATOM 5230 C CA . ILE A 1 638 ? 4.384 45.425 122.738 1.00 63.67 ? 638 ILE A CA 1 +ATOM 5231 C C . ILE A 1 638 ? 4.262 46.855 122.223 1.00 63.40 ? 638 ILE A C 1 +ATOM 5232 O O . ILE A 1 638 ? 3.340 47.577 122.597 1.00 63.25 ? 638 ILE A O 1 +ATOM 5233 C CB . ILE A 1 638 ? 3.022 44.709 122.571 1.00 62.48 ? 638 ILE A CB 1 +ATOM 5234 C CG1 . ILE A 1 638 ? 3.088 43.313 123.190 1.00 60.36 ? 638 ILE A CG1 1 +ATOM 5235 C CG2 . ILE A 1 638 ? 2.664 44.604 121.093 1.00 61.23 ? 638 ILE A CG2 1 +ATOM 5236 C CD1 . ILE A 1 638 ? 1.771 42.596 123.190 1.00 59.16 ? 638 ILE A CD1 1 +ATOM 5237 N N . LYS A 1 639 ? 5.202 47.265 121.378 1.00 62.99 ? 639 LYS A N 1 +ATOM 5238 C CA . LYS A 1 639 ? 5.194 48.612 120.818 1.00 63.15 ? 639 LYS A CA 1 +ATOM 5239 C C . LYS A 1 639 ? 4.477 48.667 119.469 1.00 62.62 ? 639 LYS A C 1 +ATOM 5240 O O . LYS A 1 639 ? 4.469 47.690 118.716 1.00 62.44 ? 639 LYS A O 1 +ATOM 5241 C CB . LYS A 1 639 ? 6.629 49.113 120.641 1.00 64.73 ? 639 LYS A CB 1 +ATOM 5242 C CG . LYS A 1 639 ? 7.431 49.197 121.930 1.00 67.72 ? 639 LYS A CG 1 +ATOM 5243 C CD . LYS A 1 639 ? 8.893 49.548 121.646 1.00 69.88 ? 639 LYS A CD 1 +ATOM 5244 C CE . LYS A 1 639 ? 9.714 49.690 122.937 1.00 71.09 ? 639 LYS A CE 1 +ATOM 5245 N NZ . LYS A 1 639 ? 9.247 50.814 123.816 1.00 70.91 ? 639 LYS A NZ 1 +ATOM 5246 N N . PHE A 1 640 ? 3.879 49.819 119.172 1.00 61.94 ? 640 PHE A N 1 +ATOM 5247 C CA . PHE A 1 640 ? 3.168 50.033 117.913 1.00 60.58 ? 640 PHE A CA 1 +ATOM 5248 C C . PHE A 1 640 ? 3.719 51.290 117.241 1.00 60.61 ? 640 PHE A C 1 +ATOM 5249 O O . PHE A 1 640 ? 3.817 52.343 117.873 1.00 61.75 ? 640 PHE A O 1 +ATOM 5250 C CB . PHE A 1 640 ? 1.662 50.201 118.160 1.00 60.34 ? 640 PHE A CB 1 +ATOM 5251 C CG . PHE A 1 640 ? 1.000 48.978 118.734 1.00 61.31 ? 640 PHE A CG 1 +ATOM 5252 C CD1 . PHE A 1 640 ? 1.236 48.594 120.052 1.00 62.24 ? 640 PHE A CD1 1 +ATOM 5253 C CD2 . PHE A 1 640 ? 0.155 48.197 117.951 1.00 60.92 ? 640 PHE A CD2 1 +ATOM 5254 C CE1 . PHE A 1 640 ? 0.637 47.445 120.583 1.00 62.75 ? 640 PHE A CE1 1 +ATOM 5255 C CE2 . PHE A 1 640 ? -0.449 47.050 118.467 1.00 61.36 ? 640 PHE A CE2 1 +ATOM 5256 C CZ . PHE A 1 640 ? -0.209 46.671 119.784 1.00 62.11 ? 640 PHE A CZ 1 +ATOM 5257 N N . SER A 1 641 ? 4.079 51.177 115.964 1.00 60.02 ? 641 SER A N 1 +ATOM 5258 C CA . SER A 1 641 ? 4.629 52.307 115.216 1.00 59.10 ? 641 SER A CA 1 +ATOM 5259 C C . SER A 1 641 ? 3.631 53.446 115.085 1.00 58.21 ? 641 SER A C 1 +ATOM 5260 O O . SER A 1 641 ? 4.011 54.571 114.771 1.00 58.02 ? 641 SER A O 1 +ATOM 5261 C CB . SER A 1 641 ? 5.074 51.866 113.814 1.00 59.84 ? 641 SER A CB 1 +ATOM 5262 O OG . SER A 1 641 ? 3.963 51.563 112.983 1.00 60.26 ? 641 SER A OG 1 +ATOM 5263 N N . ARG A 1 642 ? 2.355 53.151 115.308 1.00 58.00 ? 642 ARG A N 1 +ATOM 5264 C CA . ARG A 1 642 ? 1.324 54.173 115.226 1.00 58.94 ? 642 ARG A CA 1 +ATOM 5265 C C . ARG A 1 642 ? 0.037 53.700 115.868 1.00 59.00 ? 642 ARG A C 1 +ATOM 5266 O O . ARG A 1 642 ? -0.164 52.509 116.072 1.00 59.99 ? 642 ARG A O 1 +ATOM 5267 C CB . ARG A 1 642 ? 1.072 54.576 113.771 1.00 60.25 ? 642 ARG A CB 1 +ATOM 5268 C CG . ARG A 1 642 ? 0.424 53.521 112.897 1.00 62.15 ? 642 ARG A CG 1 +ATOM 5269 C CD . ARG A 1 642 ? 0.351 54.033 111.460 1.00 65.06 ? 642 ARG A CD 1 +ATOM 5270 N NE . ARG A 1 642 ? -0.283 53.079 110.553 1.00 66.89 ? 642 ARG A NE 1 +ATOM 5271 C CZ . ARG A 1 642 ? -1.561 52.722 110.619 1.00 67.61 ? 642 ARG A CZ 1 +ATOM 5272 N NH1 . ARG A 1 642 ? -2.353 53.238 111.550 1.00 67.65 ? 642 ARG A NH1 1 +ATOM 5273 N NH2 . ARG A 1 642 ? -2.049 51.844 109.753 1.00 68.10 ? 642 ARG A NH2 1 +ATOM 5274 N N . GLU A 1 643 ? -0.831 54.644 116.198 1.00 59.69 ? 643 GLU A N 1 +ATOM 5275 C CA . GLU A 1 643 ? -2.097 54.323 116.843 1.00 60.65 ? 643 GLU A CA 1 +ATOM 5276 C C . GLU A 1 643 ? -2.959 53.393 116.001 1.00 59.28 ? 643 GLU A C 1 +ATOM 5277 O O . GLU A 1 643 ? -3.247 53.683 114.839 1.00 58.79 ? 643 GLU A O 1 +ATOM 5278 C CB . GLU A 1 643 ? -2.872 55.612 117.141 1.00 63.23 ? 643 GLU A CB 1 +ATOM 5279 C CG . GLU A 1 643 ? -4.237 55.392 117.787 1.00 67.48 ? 643 GLU A CG 1 +ATOM 5280 C CD . GLU A 1 643 ? -5.017 56.690 117.971 1.00 70.99 ? 643 GLU A CD 1 +ATOM 5281 O OE1 . GLU A 1 643 ? -4.552 57.571 118.738 1.00 72.97 ? 643 GLU A OE1 1 +ATOM 5282 O OE2 . GLU A 1 643 ? -6.094 56.827 117.344 1.00 71.53 ? 643 GLU A OE2 1 +ATOM 5283 N N . ILE A 1 644 ? -3.364 52.272 116.595 1.00 58.33 ? 644 ILE A N 1 +ATOM 5284 C CA . ILE A 1 644 ? -4.217 51.302 115.909 1.00 56.98 ? 644 ILE A CA 1 +ATOM 5285 C C . ILE A 1 644 ? -5.230 50.667 116.855 1.00 55.21 ? 644 ILE A C 1 +ATOM 5286 O O . ILE A 1 644 ? -4.970 50.508 118.048 1.00 55.69 ? 644 ILE A O 1 +ATOM 5287 C CB . ILE A 1 644 ? -3.402 50.144 115.267 1.00 57.00 ? 644 ILE A CB 1 +ATOM 5288 C CG1 . ILE A 1 644 ? -2.778 49.276 116.355 1.00 56.04 ? 644 ILE A CG1 1 +ATOM 5289 C CG2 . ILE A 1 644 ? -2.332 50.700 114.340 1.00 55.82 ? 644 ILE A CG2 1 +ATOM 5290 C CD1 . ILE A 1 644 ? -2.284 47.949 115.832 1.00 56.80 ? 644 ILE A CD1 1 +ATOM 5291 N N . TYR A 1 645 ? -6.383 50.294 116.313 1.00 53.60 ? 645 TYR A N 1 +ATOM 5292 C CA . TYR A 1 645 ? -7.423 49.657 117.109 1.00 51.91 ? 645 TYR A CA 1 +ATOM 5293 C C . TYR A 1 645 ? -7.035 48.209 117.366 1.00 50.61 ? 645 TYR A C 1 +ATOM 5294 O O . TYR A 1 645 ? -6.417 47.564 116.522 1.00 50.80 ? 645 TYR A O 1 +ATOM 5295 C CB . TYR A 1 645 ? -8.756 49.682 116.370 1.00 50.84 ? 645 TYR A CB 1 +ATOM 5296 C CG . TYR A 1 645 ? -9.911 49.177 117.197 1.00 51.39 ? 645 TYR A CG 1 +ATOM 5297 C CD1 . TYR A 1 645 ? -10.526 49.992 118.150 1.00 52.29 ? 645 TYR A CD1 1 +ATOM 5298 C CD2 . TYR A 1 645 ? -10.392 47.888 117.030 1.00 52.02 ? 645 TYR A CD2 1 +ATOM 5299 C CE1 . TYR A 1 645 ? -11.603 49.528 118.916 1.00 52.27 ? 645 TYR A CE1 1 +ATOM 5300 C CE2 . TYR A 1 645 ? -11.462 47.411 117.789 1.00 53.26 ? 645 TYR A CE2 1 +ATOM 5301 C CZ . TYR A 1 645 ? -12.065 48.234 118.729 1.00 53.74 ? 645 TYR A CZ 1 +ATOM 5302 O OH . TYR A 1 645 ? -13.133 47.761 119.470 1.00 54.78 ? 645 TYR A OH 1 +ATOM 5303 N N . VAL A 1 646 ? -7.392 47.705 118.539 1.00 49.63 ? 646 VAL A N 1 +ATOM 5304 C CA . VAL A 1 646 ? -7.099 46.323 118.897 1.00 48.69 ? 646 VAL A CA 1 +ATOM 5305 C C . VAL A 1 646 ? -8.302 45.756 119.634 1.00 50.26 ? 646 VAL A C 1 +ATOM 5306 O O . VAL A 1 646 ? -8.696 46.267 120.684 1.00 51.77 ? 646 VAL A O 1 +ATOM 5307 C CB . VAL A 1 646 ? -5.862 46.214 119.809 1.00 46.43 ? 646 VAL A CB 1 +ATOM 5308 C CG1 . VAL A 1 646 ? -5.683 44.776 120.255 1.00 45.88 ? 646 VAL A CG1 1 +ATOM 5309 C CG2 . VAL A 1 646 ? -4.619 46.692 119.069 1.00 45.58 ? 646 VAL A CG2 1 +ATOM 5310 N N . SER A 1 647 ? -8.903 44.710 119.079 1.00 50.83 ? 647 SER A N 1 +ATOM 5311 C CA . SER A 1 647 ? -10.065 44.109 119.713 1.00 49.95 ? 647 SER A CA 1 +ATOM 5312 C C . SER A 1 647 ? -9.610 43.114 120.764 1.00 50.55 ? 647 SER A C 1 +ATOM 5313 O O . SER A 1 647 ? -9.438 43.471 121.926 1.00 52.71 ? 647 SER A O 1 +ATOM 5314 C CB . SER A 1 647 ? -10.956 43.414 118.672 1.00 49.78 ? 647 SER A CB 1 +ATOM 5315 O OG . SER A 1 647 ? -10.258 42.409 117.955 1.00 49.30 ? 647 SER A OG 1 +ATOM 5316 N N . LYS A 1 648 ? -9.397 41.872 120.349 1.00 50.41 ? 648 LYS A N 1 +ATOM 5317 C CA . LYS A 1 648 ? -8.975 40.807 121.253 1.00 50.78 ? 648 LYS A CA 1 +ATOM 5318 C C . LYS A 1 648 ? -7.474 40.527 121.137 1.00 50.22 ? 648 LYS A C 1 +ATOM 5319 O O . LYS A 1 648 ? -6.960 40.334 120.039 1.00 50.14 ? 648 LYS A O 1 +ATOM 5320 C CB . LYS A 1 648 ? -9.786 39.553 120.921 1.00 52.99 ? 648 LYS A CB 1 +ATOM 5321 C CG . LYS A 1 648 ? -9.515 38.310 121.750 1.00 55.87 ? 648 LYS A CG 1 +ATOM 5322 C CD . LYS A 1 648 ? -10.605 37.275 121.445 1.00 57.36 ? 648 LYS A CD 1 +ATOM 5323 C CE . LYS A 1 648 ? -10.268 35.885 121.966 1.00 59.97 ? 648 LYS A CE 1 +ATOM 5324 N NZ . LYS A 1 648 ? -9.166 35.234 121.189 1.00 61.16 ? 648 LYS A NZ 1 +ATOM 5325 N N . LEU A 1 649 ? -6.772 40.524 122.269 1.00 49.43 ? 649 LEU A N 1 +ATOM 5326 C CA . LEU A 1 649 ? -5.334 40.259 122.275 1.00 48.63 ? 649 LEU A CA 1 +ATOM 5327 C C . LEU A 1 649 ? -5.052 38.923 122.951 1.00 49.38 ? 649 LEU A C 1 +ATOM 5328 O O . LEU A 1 649 ? -5.501 38.679 124.067 1.00 51.19 ? 649 LEU A O 1 +ATOM 5329 C CB . LEU A 1 649 ? -4.575 41.361 123.015 1.00 47.51 ? 649 LEU A CB 1 +ATOM 5330 C CG . LEU A 1 649 ? -3.095 41.059 123.292 1.00 48.00 ? 649 LEU A CG 1 +ATOM 5331 C CD1 . LEU A 1 649 ? -2.334 40.938 121.978 1.00 48.12 ? 649 LEU A CD1 1 +ATOM 5332 C CD2 . LEU A 1 649 ? -2.490 42.158 124.144 1.00 48.05 ? 649 LEU A CD2 1 +ATOM 5333 N N . THR A 1 650 ? -4.318 38.047 122.275 1.00 49.28 ? 650 THR A N 1 +ATOM 5334 C CA . THR A 1 650 ? -4.002 36.752 122.853 1.00 48.26 ? 650 THR A CA 1 +ATOM 5335 C C . THR A 1 650 ? -2.501 36.671 123.034 1.00 50.03 ? 650 THR A C 1 +ATOM 5336 O O . THR A 1 650 ? -1.726 36.911 122.098 1.00 49.75 ? 650 THR A O 1 +ATOM 5337 C CB . THR A 1 650 ? -4.456 35.579 121.953 1.00 48.23 ? 650 THR A CB 1 +ATOM 5338 O OG1 . THR A 1 650 ? -5.873 35.651 121.739 1.00 48.92 ? 650 THR A OG1 1 +ATOM 5339 C CG2 . THR A 1 650 ? -4.116 34.237 122.610 1.00 46.50 ? 650 THR A CG2 1 +ATOM 5340 N N . ILE A 1 651 ? -2.099 36.342 124.254 1.00 50.98 ? 651 ILE A N 1 +ATOM 5341 C CA . ILE A 1 651 ? -0.694 36.219 124.587 1.00 51.30 ? 651 ILE A CA 1 +ATOM 5342 C C . ILE A 1 651 ? -0.423 34.793 125.029 1.00 51.46 ? 651 ILE A C 1 +ATOM 5343 O O . ILE A 1 651 ? -1.069 34.285 125.944 1.00 52.37 ? 651 ILE A O 1 +ATOM 5344 C CB . ILE A 1 651 ? -0.317 37.185 125.725 1.00 51.33 ? 651 ILE A CB 1 +ATOM 5345 C CG1 . ILE A 1 651 ? -0.611 38.621 125.280 1.00 52.77 ? 651 ILE A CG1 1 +ATOM 5346 C CG2 . ILE A 1 651 ? 1.155 37.006 126.105 1.00 49.32 ? 651 ILE A CG2 1 +ATOM 5347 C CD1 . ILE A 1 651 ? -0.388 39.666 126.365 1.00 55.81 ? 651 ILE A CD1 1 +ATOM 5348 N N . THR A 1 652 ? 0.505 34.129 124.358 1.00 51.96 ? 652 THR A N 1 +ATOM 5349 C CA . THR A 1 652 ? 0.838 32.771 124.751 1.00 52.75 ? 652 THR A CA 1 +ATOM 5350 C C . THR A 1 652 ? 2.125 32.953 125.549 1.00 53.51 ? 652 THR A C 1 +ATOM 5351 O O . THR A 1 652 ? 3.036 33.677 125.134 1.00 51.85 ? 652 THR A O 1 +ATOM 5352 C CB . THR A 1 652 ? 1.056 31.826 123.521 1.00 52.35 ? 652 THR A CB 1 +ATOM 5353 O OG1 . THR A 1 652 ? 2.392 31.964 123.027 1.00 53.58 ? 652 THR A OG1 1 +ATOM 5354 C CG2 . THR A 1 652 ? 0.079 32.167 122.399 1.00 51.11 ? 652 THR A CG2 1 +ATOM 5355 N N . SER A 1 653 ? 2.180 32.324 126.715 1.00 55.50 ? 653 SER A N 1 +ATOM 5356 C CA . SER A 1 653 ? 3.341 32.454 127.581 1.00 57.37 ? 653 SER A CA 1 +ATOM 5357 C C . SER A 1 653 ? 3.423 31.309 128.578 1.00 58.14 ? 653 SER A C 1 +ATOM 5358 O O . SER A 1 653 ? 2.402 30.836 129.084 1.00 58.40 ? 653 SER A O 1 +ATOM 5359 C CB . SER A 1 653 ? 3.261 33.787 128.339 1.00 57.98 ? 653 SER A CB 1 +ATOM 5360 O OG . SER A 1 653 ? 4.366 33.957 129.211 1.00 59.34 ? 653 SER A OG 1 +ATOM 5361 N N . GLU A 1 654 ? 4.640 30.859 128.852 1.00 59.66 ? 654 GLU A N 1 +ATOM 5362 C CA . GLU A 1 654 ? 4.841 29.788 129.817 1.00 62.20 ? 654 GLU A CA 1 +ATOM 5363 C C . GLU A 1 654 ? 4.723 30.383 131.226 1.00 63.24 ? 654 GLU A C 1 +ATOM 5364 O O . GLU A 1 654 ? 4.315 29.700 132.167 1.00 63.45 ? 654 GLU A O 1 +ATOM 5365 C CB . GLU A 1 654 ? 6.209 29.137 129.605 1.00 63.05 ? 654 GLU A CB 1 +ATOM 5366 C CG . GLU A 1 654 ? 6.338 28.464 128.239 1.00 65.96 ? 654 GLU A CG 1 +ATOM 5367 C CD . GLU A 1 654 ? 7.647 27.713 128.051 1.00 67.07 ? 654 GLU A CD 1 +ATOM 5368 O OE1 . GLU A 1 654 ? 7.867 26.705 128.758 1.00 67.79 ? 654 GLU A OE1 1 +ATOM 5369 O OE2 . GLU A 1 654 ? 8.455 28.129 127.188 1.00 68.87 ? 654 GLU A OE2 1 +ATOM 5370 N N . LYS A 1 655 ? 5.076 31.661 131.358 1.00 64.12 ? 655 LYS A N 1 +ATOM 5371 C CA . LYS A 1 655 ? 4.973 32.369 132.636 1.00 65.69 ? 655 LYS A CA 1 +ATOM 5372 C C . LYS A 1 655 ? 3.610 33.058 132.658 1.00 66.02 ? 655 LYS A C 1 +ATOM 5373 O O . LYS A 1 655 ? 3.192 33.661 131.666 1.00 66.89 ? 655 LYS A O 1 +ATOM 5374 C CB . LYS A 1 655 ? 6.091 33.407 132.771 1.00 66.11 ? 655 LYS A CB 1 +ATOM 5375 C CG . LYS A 1 655 ? 7.480 32.786 132.741 1.00 68.50 ? 655 LYS A CG 1 +ATOM 5376 C CD . LYS A 1 655 ? 8.581 33.807 132.964 1.00 69.34 ? 655 LYS A CD 1 +ATOM 5377 C CE . LYS A 1 655 ? 9.940 33.121 132.993 1.00 70.27 ? 655 LYS A CE 1 +ATOM 5378 N NZ . LYS A 1 655 ? 11.054 34.080 133.246 1.00 72.41 ? 655 LYS A NZ 1 +ATOM 5379 N N . PRO A 1 656 ? 2.899 32.981 133.790 1.00 65.76 ? 656 PRO A N 1 +ATOM 5380 C CA . PRO A 1 656 ? 1.573 33.601 133.906 1.00 65.27 ? 656 PRO A CA 1 +ATOM 5381 C C . PRO A 1 656 ? 1.525 35.106 133.653 1.00 65.10 ? 656 PRO A C 1 +ATOM 5382 O O . PRO A 1 656 ? 2.493 35.834 133.898 1.00 64.69 ? 656 PRO A O 1 +ATOM 5383 C CB . PRO A 1 656 ? 1.144 33.229 135.323 1.00 65.52 ? 656 PRO A CB 1 +ATOM 5384 C CG . PRO A 1 656 ? 2.457 33.181 136.059 1.00 65.56 ? 656 PRO A CG 1 +ATOM 5385 C CD . PRO A 1 656 ? 3.346 32.442 135.086 1.00 65.35 ? 656 PRO A CD 1 +ATOM 5386 N N . VAL A 1 657 ? 0.384 35.556 133.142 1.00 64.64 ? 657 VAL A N 1 +ATOM 5387 C CA . VAL A 1 657 ? 0.157 36.962 132.847 1.00 64.26 ? 657 VAL A CA 1 +ATOM 5388 C C . VAL A 1 657 ? -1.128 37.338 133.566 1.00 65.22 ? 657 VAL A C 1 +ATOM 5389 O O . VAL A 1 657 ? -2.207 36.859 133.224 1.00 65.52 ? 657 VAL A O 1 +ATOM 5390 C CB . VAL A 1 657 ? -0.029 37.195 131.333 1.00 64.54 ? 657 VAL A CB 1 +ATOM 5391 C CG1 . VAL A 1 657 ? -0.187 38.688 131.049 1.00 63.83 ? 657 VAL A CG1 1 +ATOM 5392 C CG2 . VAL A 1 657 ? 1.159 36.619 130.565 1.00 63.76 ? 657 VAL A CG2 1 +ATOM 5393 N N . SER A 1 658 ? -1.012 38.191 134.574 1.00 66.53 ? 658 SER A N 1 +ATOM 5394 C CA . SER A 1 658 ? -2.174 38.605 135.352 1.00 67.31 ? 658 SER A CA 1 +ATOM 5395 C C . SER A 1 658 ? -2.881 39.828 134.772 1.00 67.33 ? 658 SER A C 1 +ATOM 5396 O O . SER A 1 658 ? -4.101 39.966 134.886 1.00 67.41 ? 658 SER A O 1 +ATOM 5397 C CB . SER A 1 658 ? -1.747 38.897 136.791 1.00 67.99 ? 658 SER A CB 1 +ATOM 5398 O OG . SER A 1 658 ? -0.705 39.860 136.816 1.00 70.12 ? 658 SER A OG 1 +ATOM 5399 N N . LYS A 1 659 ? -2.117 40.714 134.145 1.00 67.10 ? 659 LYS A N 1 +ATOM 5400 C CA . LYS A 1 659 ? -2.704 41.918 133.582 1.00 67.59 ? 659 LYS A CA 1 +ATOM 5401 C C . LYS A 1 659 ? -1.813 42.591 132.541 1.00 67.27 ? 659 LYS A C 1 +ATOM 5402 O O . LYS A 1 659 ? -0.605 42.349 132.472 1.00 66.69 ? 659 LYS A O 1 +ATOM 5403 C CB . LYS A 1 659 ? -2.987 42.924 134.705 1.00 68.85 ? 659 LYS A CB 1 +ATOM 5404 C CG . LYS A 1 659 ? -1.716 43.445 135.392 1.00 69.79 ? 659 LYS A CG 1 +ATOM 5405 C CD . LYS A 1 659 ? -2.002 44.500 136.468 1.00 70.46 ? 659 LYS A CD 1 +ATOM 5406 C CE . LYS A 1 659 ? -2.688 43.914 137.705 1.00 70.70 ? 659 LYS A CE 1 +ATOM 5407 N NZ . LYS A 1 659 ? -4.075 43.422 137.447 1.00 71.16 ? 659 LYS A NZ 1 +ATOM 5408 N N . ILE A 1 660 ? -2.434 43.443 131.735 1.00 66.91 ? 660 ILE A N 1 +ATOM 5409 C CA . ILE A 1 660 ? -1.722 44.200 130.719 1.00 66.63 ? 660 ILE A CA 1 +ATOM 5410 C C . ILE A 1 660 ? -2.056 45.657 130.989 1.00 66.81 ? 660 ILE A C 1 +ATOM 5411 O O . ILE A 1 660 ? -3.088 45.960 131.593 1.00 67.32 ? 660 ILE A O 1 +ATOM 5412 C CB . ILE A 1 660 ? -2.189 43.845 129.285 1.00 67.01 ? 660 ILE A CB 1 +ATOM 5413 C CG1 . ILE A 1 660 ? -3.680 44.163 129.125 1.00 66.30 ? 660 ILE A CG1 1 +ATOM 5414 C CG2 . ILE A 1 660 ? -1.902 42.376 128.988 1.00 66.64 ? 660 ILE A CG2 1 +ATOM 5415 C CD1 . ILE A 1 660 ? -4.167 44.080 127.693 1.00 67.55 ? 660 ILE A CD1 1 +ATOM 5416 N N . ILE A 1 661 ? -1.187 46.559 130.548 1.00 66.51 ? 661 ILE A N 1 +ATOM 5417 C CA . ILE A 1 661 ? -1.413 47.983 130.751 1.00 66.53 ? 661 ILE A CA 1 +ATOM 5418 C C . ILE A 1 661 ? -1.306 48.734 129.429 1.00 66.74 ? 661 ILE A C 1 +ATOM 5419 O O . ILE A 1 661 ? -0.252 48.738 128.789 1.00 66.48 ? 661 ILE A O 1 +ATOM 5420 C CB . ILE A 1 661 ? -0.392 48.566 131.746 1.00 66.65 ? 661 ILE A CB 1 +ATOM 5421 C CG1 . ILE A 1 661 ? -0.461 47.791 133.066 1.00 67.18 ? 661 ILE A CG1 1 +ATOM 5422 C CG2 . ILE A 1 661 ? -0.682 50.045 131.984 1.00 65.21 ? 661 ILE A CG2 1 +ATOM 5423 C CD1 . ILE A 1 661 ? 0.675 48.101 134.024 1.00 66.23 ? 661 ILE A CD1 1 +ATOM 5424 N N . VAL A 1 662 ? -2.402 49.372 129.030 1.00 67.00 ? 662 VAL A N 1 +ATOM 5425 C CA . VAL A 1 662 ? -2.443 50.122 127.781 1.00 68.29 ? 662 VAL A CA 1 +ATOM 5426 C C . VAL A 1 662 ? -1.919 51.545 127.945 1.00 69.99 ? 662 VAL A C 1 +ATOM 5427 O O . VAL A 1 662 ? -2.507 52.355 128.663 1.00 70.12 ? 662 VAL A O 1 +ATOM 5428 C CB . VAL A 1 662 ? -3.884 50.195 127.219 1.00 67.68 ? 662 VAL A CB 1 +ATOM 5429 C CG1 . VAL A 1 662 ? -3.906 51.030 125.946 1.00 67.36 ? 662 VAL A CG1 1 +ATOM 5430 C CG2 . VAL A 1 662 ? -4.409 48.795 126.944 1.00 67.90 ? 662 VAL A CG2 1 +ATOM 5431 N N . ASP A 1 663 ? -0.809 51.837 127.270 1.00 72.25 ? 663 ASP A N 1 +ATOM 5432 C CA . ASP A 1 663 ? -0.184 53.162 127.303 1.00 74.94 ? 663 ASP A CA 1 +ATOM 5433 C C . ASP A 1 663 ? 0.051 53.694 128.717 1.00 77.10 ? 663 ASP A C 1 +ATOM 5434 O O . ASP A 1 663 ? -0.068 54.902 128.956 1.00 76.76 ? 663 ASP A O 1 +ATOM 5435 C CB . ASP A 1 663 ? -1.042 54.173 126.526 1.00 74.57 ? 663 ASP A CB 1 +ATOM 5436 C CG . ASP A 1 663 ? -1.230 53.788 125.064 1.00 75.31 ? 663 ASP A CG 1 +ATOM 5437 O OD1 . ASP A 1 663 ? -0.215 53.569 124.367 1.00 75.17 ? 663 ASP A OD1 1 +ATOM 5438 O OD2 . ASP A 1 663 ? -2.395 53.708 124.610 1.00 75.98 ? 663 ASP A OD2 1 +ATOM 5439 N N . ASP A 1 664 ? 0.382 52.798 129.646 1.00 80.65 ? 664 ASP A N 1 +ATOM 5440 C CA . ASP A 1 664 ? 0.629 53.182 131.037 1.00 83.57 ? 664 ASP A CA 1 +ATOM 5441 C C . ASP A 1 664 ? -0.664 53.703 131.675 1.00 84.41 ? 664 ASP A C 1 +ATOM 5442 O O . ASP A 1 664 ? -0.740 53.888 132.893 1.00 85.11 ? 664 ASP A O 1 +ATOM 5443 C CB . ASP A 1 664 ? 1.703 54.283 131.114 1.00 85.45 ? 664 ASP A CB 1 +ATOM 5444 C CG . ASP A 1 664 ? 2.956 53.953 130.309 1.00 87.24 ? 664 ASP A CG 1 +ATOM 5445 O OD1 . ASP A 1 664 ? 2.845 53.769 129.075 1.00 88.60 ? 664 ASP A OD1 1 +ATOM 5446 O OD2 . ASP A 1 664 ? 4.053 53.886 130.911 1.00 87.08 ? 664 ASP A OD2 1 +ATOM 5447 N N . SER A 1 665 ? -1.673 53.934 130.840 1.00 84.78 ? 665 SER A N 1 +ATOM 5448 C CA . SER A 1 665 ? -2.957 54.458 131.291 1.00 85.26 ? 665 SER A CA 1 +ATOM 5449 C C . SER A 1 665 ? -3.913 53.378 131.803 1.00 85.44 ? 665 SER A C 1 +ATOM 5450 O O . SER A 1 665 ? -3.775 52.894 132.928 1.00 85.75 ? 665 SER A O 1 +ATOM 5451 C CB . SER A 1 665 ? -3.623 55.240 130.150 1.00 85.93 ? 665 SER A CB 1 +ATOM 5452 O OG . SER A 1 665 ? -2.750 56.227 129.619 1.00 85.72 ? 665 SER A OG 1 +ATOM 5453 N N . LYS A 1 666 ? -4.882 53.003 130.973 1.00 85.39 ? 666 LYS A N 1 +ATOM 5454 C CA . LYS A 1 666 ? -5.872 52.001 131.354 1.00 84.92 ? 666 LYS A CA 1 +ATOM 5455 C C . LYS A 1 666 ? -5.266 50.650 131.680 1.00 85.02 ? 666 LYS A C 1 +ATOM 5456 O O . LYS A 1 666 ? -4.259 50.245 131.101 1.00 85.40 ? 666 LYS A O 1 +ATOM 5457 C CB . LYS A 1 666 ? -6.901 51.819 130.241 1.00 84.28 ? 666 LYS A CB 1 +ATOM 5458 C CG . LYS A 1 666 ? -8.096 50.980 130.647 1.00 83.58 ? 666 LYS A CG 1 +ATOM 5459 C CD . LYS A 1 666 ? -9.052 50.814 129.482 1.00 84.58 ? 666 LYS A CD 1 +ATOM 5460 C CE . LYS A 1 666 ? -10.448 50.447 129.950 1.00 84.17 ? 666 LYS A CE 1 +ATOM 5461 N NZ . LYS A 1 666 ? -11.068 51.568 130.707 1.00 84.61 ? 666 LYS A NZ 1 +ATOM 5462 N N . GLU A 1 667 ? -5.894 49.953 132.617 1.00 84.98 ? 667 GLU A N 1 +ATOM 5463 C CA . GLU A 1 667 ? -5.436 48.633 133.013 1.00 85.07 ? 667 GLU A CA 1 +ATOM 5464 C C . GLU A 1 667 ? -6.518 47.655 132.590 1.00 84.19 ? 667 GLU A C 1 +ATOM 5465 O O . GLU A 1 667 ? -7.670 47.779 133.006 1.00 84.42 ? 667 GLU A O 1 +ATOM 5466 C CB . GLU A 1 667 ? -5.232 48.561 134.531 1.00 86.40 ? 667 GLU A CB 1 +ATOM 5467 C CG . GLU A 1 667 ? -4.596 47.254 135.008 1.00 88.65 ? 667 GLU A CG 1 +ATOM 5468 C CD . GLU A 1 667 ? -4.457 47.170 136.523 1.00 89.74 ? 667 GLU A CD 1 +ATOM 5469 O OE1 . GLU A 1 667 ? -5.499 47.125 137.213 1.00 89.90 ? 667 GLU A OE1 1 +ATOM 5470 O OE2 . GLU A 1 667 ? -3.306 47.147 137.021 1.00 89.99 ? 667 GLU A OE2 1 +ATOM 5471 N N . ILE A 1 668 ? -6.154 46.698 131.744 1.00 82.69 ? 668 ILE A N 1 +ATOM 5472 C CA . ILE A 1 668 ? -7.110 45.705 131.283 1.00 81.31 ? 668 ILE A CA 1 +ATOM 5473 C C . ILE A 1 668 ? -6.795 44.375 131.952 1.00 80.53 ? 668 ILE A C 1 +ATOM 5474 O O . ILE A 1 668 ? -5.638 43.958 132.020 1.00 80.49 ? 668 ILE A O 1 +ATOM 5475 C CB . ILE A 1 668 ? -7.048 45.525 129.752 1.00 81.51 ? 668 ILE A CB 1 +ATOM 5476 C CG1 . ILE A 1 668 ? -7.256 46.872 129.044 1.00 81.25 ? 668 ILE A CG1 1 +ATOM 5477 C CG2 . ILE A 1 668 ? -8.118 44.534 129.311 1.00 81.79 ? 668 ILE A CG2 1 +ATOM 5478 C CD1 . ILE A 1 668 ? -8.694 47.365 129.030 1.00 80.45 ? 668 ILE A CD1 1 +ATOM 5479 N N . GLN A 1 669 ? -7.831 43.716 132.453 1.00 80.03 ? 669 GLN A N 1 +ATOM 5480 C CA . GLN A 1 669 ? -7.669 42.436 133.125 1.00 80.06 ? 669 GLN A CA 1 +ATOM 5481 C C . GLN A 1 669 ? -7.351 41.368 132.083 1.00 79.01 ? 669 GLN A C 1 +ATOM 5482 O O . GLN A 1 669 ? -7.629 41.558 130.900 1.00 79.50 ? 669 GLN A O 1 +ATOM 5483 C CB . GLN A 1 669 ? -8.958 42.074 133.864 1.00 81.48 ? 669 GLN A CB 1 +ATOM 5484 C CG . GLN A 1 669 ? -8.825 40.905 134.823 1.00 83.48 ? 669 GLN A CG 1 +ATOM 5485 C CD . GLN A 1 669 ? -10.140 40.177 135.026 1.00 85.14 ? 669 GLN A CD 1 +ATOM 5486 O OE1 . GLN A 1 669 ? -11.164 40.792 135.342 1.00 85.39 ? 669 GLN A OE1 1 +ATOM 5487 N NE2 . GLN A 1 669 ? -10.119 38.857 134.846 1.00 85.34 ? 669 GLN A NE2 1 +ATOM 5488 N N . VAL A 1 670 ? -6.774 40.251 132.523 1.00 77.29 ? 670 VAL A N 1 +ATOM 5489 C CA . VAL A 1 670 ? -6.420 39.153 131.623 1.00 75.29 ? 670 VAL A CA 1 +ATOM 5490 C C . VAL A 1 670 ? -7.019 37.829 132.094 1.00 74.62 ? 670 VAL A C 1 +ATOM 5491 O O . VAL A 1 670 ? -7.163 37.593 133.294 1.00 75.94 ? 670 VAL A O 1 +ATOM 5492 C CB . VAL A 1 670 ? -4.885 38.989 131.526 1.00 75.22 ? 670 VAL A CB 1 +ATOM 5493 C CG1 . VAL A 1 670 ? -4.538 37.805 130.640 1.00 74.20 ? 670 VAL A CG1 1 +ATOM 5494 C CG2 . VAL A 1 670 ? -4.260 40.267 130.977 1.00 75.50 ? 670 VAL A CG2 1 +ATOM 5495 N N . GLU A 1 671 ? -7.371 36.966 131.149 1.00 72.71 ? 671 GLU A N 1 +ATOM 5496 C CA . GLU A 1 671 ? -7.940 35.670 131.492 1.00 70.65 ? 671 GLU A CA 1 +ATOM 5497 C C . GLU A 1 671 ? -7.265 34.508 130.770 1.00 68.80 ? 671 GLU A C 1 +ATOM 5498 O O . GLU A 1 671 ? -7.093 34.521 129.548 1.00 68.68 ? 671 GLU A O 1 +ATOM 5499 C CB . GLU A 1 671 ? -9.440 35.644 131.194 1.00 71.42 ? 671 GLU A CB 1 +ATOM 5500 C CG . GLU A 1 671 ? -9.976 34.242 130.969 1.00 72.40 ? 671 GLU A CG 1 +ATOM 5501 C CD . GLU A 1 671 ? -11.476 34.212 130.804 1.00 74.56 ? 671 GLU A CD 1 +ATOM 5502 O OE1 . GLU A 1 671 ? -12.040 35.218 130.316 1.00 74.94 ? 671 GLU A OE1 1 +ATOM 5503 O OE2 . GLU A 1 671 ? -12.088 33.175 131.151 1.00 74.15 ? 671 GLU A OE2 1 +ATOM 5504 N N . LYS A 1 672 ? -6.889 33.501 131.546 1.00 65.86 ? 672 LYS A N 1 +ATOM 5505 C CA . LYS A 1 672 ? -6.252 32.314 131.009 1.00 63.41 ? 672 LYS A CA 1 +ATOM 5506 C C . LYS A 1 672 ? -7.371 31.436 130.457 1.00 61.18 ? 672 LYS A C 1 +ATOM 5507 O O . LYS A 1 672 ? -8.202 30.926 131.210 1.00 61.22 ? 672 LYS A O 1 +ATOM 5508 C CB . LYS A 1 672 ? -5.491 31.590 132.121 1.00 64.37 ? 672 LYS A CB 1 +ATOM 5509 C CG . LYS A 1 672 ? -4.635 30.434 131.653 1.00 64.92 ? 672 LYS A CG 1 +ATOM 5510 C CD . LYS A 1 672 ? -3.642 30.033 132.731 1.00 65.66 ? 672 LYS A CD 1 +ATOM 5511 C CE . LYS A 1 672 ? -2.677 28.975 132.230 1.00 66.35 ? 672 LYS A CE 1 +ATOM 5512 N NZ . LYS A 1 672 ? -1.606 28.703 133.219 1.00 66.47 ? 672 LYS A NZ 1 +ATOM 5513 N N . THR A 1 673 ? -7.398 31.282 129.136 1.00 57.00 ? 673 THR A N 1 +ATOM 5514 C CA . THR A 1 673 ? -8.423 30.483 128.466 1.00 53.31 ? 673 THR A CA 1 +ATOM 5515 C C . THR A 1 673 ? -8.041 29.004 128.404 1.00 51.72 ? 673 THR A C 1 +ATOM 5516 O O . THR A 1 673 ? -8.907 28.127 128.371 1.00 50.64 ? 673 THR A O 1 +ATOM 5517 C CB . THR A 1 673 ? -8.680 31.015 127.033 1.00 53.07 ? 673 THR A CB 1 +ATOM 5518 O OG1 . THR A 1 673 ? -7.442 31.090 126.310 1.00 53.05 ? 673 THR A OG1 1 +ATOM 5519 C CG2 . THR A 1 673 ? -9.304 32.408 127.092 1.00 51.67 ? 673 THR A CG2 1 +ATOM 5520 N N . MET A 1 674 ? -6.740 28.738 128.390 1.00 49.68 ? 674 MET A N 1 +ATOM 5521 C CA . MET A 1 674 ? -6.224 27.375 128.357 1.00 48.11 ? 674 MET A CA 1 +ATOM 5522 C C . MET A 1 674 ? -4.724 27.453 128.638 1.00 47.19 ? 674 MET A C 1 +ATOM 5523 O O . MET A 1 674 ? -4.158 28.547 128.728 1.00 46.26 ? 674 MET A O 1 +ATOM 5524 C CB . MET A 1 674 ? -6.499 26.718 126.994 1.00 49.21 ? 674 MET A CB 1 +ATOM 5525 C CG . MET A 1 674 ? -5.726 27.307 125.821 1.00 50.13 ? 674 MET A CG 1 +ATOM 5526 S SD . MET A 1 674 ? -6.214 26.543 124.251 1.00 53.75 ? 674 MET A SD 1 +ATOM 5527 C CE . MET A 1 674 ? -5.477 27.746 123.063 1.00 48.53 ? 674 MET A CE 1 +ATOM 5528 N N . GLN A 1 675 ? -4.077 26.302 128.775 1.00 46.22 ? 675 GLN A N 1 +ATOM 5529 C CA . GLN A 1 675 ? -2.654 26.282 129.087 1.00 46.12 ? 675 GLN A CA 1 +ATOM 5530 C C . GLN A 1 675 ? -1.840 27.246 128.230 1.00 46.13 ? 675 GLN A C 1 +ATOM 5531 O O . GLN A 1 675 ? -2.001 27.298 127.012 1.00 45.76 ? 675 GLN A O 1 +ATOM 5532 C CB . GLN A 1 675 ? -2.108 24.862 128.937 1.00 45.87 ? 675 GLN A CB 1 +ATOM 5533 C CG . GLN A 1 675 ? -2.012 24.373 127.510 1.00 45.72 ? 675 GLN A CG 1 +ATOM 5534 C CD . GLN A 1 675 ? -1.727 22.891 127.440 1.00 47.65 ? 675 GLN A CD 1 +ATOM 5535 O OE1 . GLN A 1 675 ? -0.890 22.374 128.182 1.00 49.36 ? 675 GLN A OE1 1 +ATOM 5536 N NE2 . GLN A 1 675 ? -2.419 22.192 126.539 1.00 47.87 ? 675 GLN A NE2 1 +ATOM 5537 N N . ASN A 1 676 ? -0.980 28.018 128.888 1.00 46.08 ? 676 ASN A N 1 +ATOM 5538 C CA . ASN A 1 676 ? -0.111 28.983 128.221 1.00 46.54 ? 676 ASN A CA 1 +ATOM 5539 C C . ASN A 1 676 ? -0.848 30.050 127.423 1.00 47.18 ? 676 ASN A C 1 +ATOM 5540 O O . ASN A 1 676 ? -0.210 30.841 126.719 1.00 48.44 ? 676 ASN A O 1 +ATOM 5541 C CB . ASN A 1 676 ? 0.852 28.259 127.277 1.00 46.96 ? 676 ASN A CB 1 +ATOM 5542 C CG . ASN A 1 676 ? 1.587 27.122 127.951 1.00 47.10 ? 676 ASN A CG 1 +ATOM 5543 O OD1 . ASN A 1 676 ? 2.347 27.327 128.898 1.00 48.86 ? 676 ASN A OD1 1 +ATOM 5544 N ND2 . ASN A 1 676 ? 1.368 25.911 127.461 1.00 47.27 ? 676 ASN A ND2 1 +ATOM 5545 N N . THR A 1 677 ? -2.173 30.099 127.541 1.00 46.80 ? 677 THR A N 1 +ATOM 5546 C CA . THR A 1 677 ? -2.944 31.068 126.767 1.00 47.70 ? 677 THR A CA 1 +ATOM 5547 C C . THR A 1 677 ? -3.696 32.117 127.587 1.00 48.93 ? 677 THR A C 1 +ATOM 5548 O O . THR A 1 677 ? -4.588 31.784 128.376 1.00 49.49 ? 677 THR A O 1 +ATOM 5549 C CB . THR A 1 677 ? -3.937 30.330 125.860 1.00 47.75 ? 677 THR A CB 1 +ATOM 5550 O OG1 . THR A 1 677 ? -3.266 29.228 125.229 1.00 47.46 ? 677 THR A OG1 1 +ATOM 5551 C CG2 . THR A 1 677 ? -4.491 31.270 124.796 1.00 45.90 ? 677 THR A CG2 1 +ATOM 5552 N N . TYR A 1 678 ? -3.345 33.386 127.372 1.00 49.75 ? 678 TYR A N 1 +ATOM 5553 C CA . TYR A 1 678 ? -3.965 34.503 128.087 1.00 50.47 ? 678 TYR A CA 1 +ATOM 5554 C C . TYR A 1 678 ? -4.639 35.483 127.133 1.00 50.20 ? 678 TYR A C 1 +ATOM 5555 O O . TYR A 1 678 ? -4.028 35.951 126.174 1.00 49.92 ? 678 TYR A O 1 +ATOM 5556 C CB . TYR A 1 678 ? -2.905 35.213 128.934 1.00 51.10 ? 678 TYR A CB 1 +ATOM 5557 C CG . TYR A 1 678 ? -2.241 34.272 129.916 1.00 52.73 ? 678 TYR A CG 1 +ATOM 5558 C CD1 . TYR A 1 678 ? -2.920 33.820 131.051 1.00 53.00 ? 678 TYR A CD1 1 +ATOM 5559 C CD2 . TYR A 1 678 ? -0.964 33.771 129.671 1.00 53.37 ? 678 TYR A CD2 1 +ATOM 5560 C CE1 . TYR A 1 678 ? -2.346 32.889 131.914 1.00 53.60 ? 678 TYR A CE1 1 +ATOM 5561 C CE2 . TYR A 1 678 ? -0.381 32.838 130.525 1.00 55.10 ? 678 TYR A CE2 1 +ATOM 5562 C CZ . TYR A 1 678 ? -1.077 32.397 131.643 1.00 55.63 ? 678 TYR A CZ 1 +ATOM 5563 O OH . TYR A 1 678 ? -0.506 31.447 132.468 1.00 57.35 ? 678 TYR A OH 1 +ATOM 5564 N N . VAL A 1 679 ? -5.903 35.788 127.415 1.00 50.24 ? 679 VAL A N 1 +ATOM 5565 C CA . VAL A 1 679 ? -6.694 36.684 126.580 1.00 50.38 ? 679 VAL A CA 1 +ATOM 5566 C C . VAL A 1 679 ? -7.124 37.988 127.254 1.00 51.53 ? 679 VAL A C 1 +ATOM 5567 O O . VAL A 1 679 ? -7.526 38.009 128.418 1.00 51.30 ? 679 VAL A O 1 +ATOM 5568 C CB . VAL A 1 679 ? -7.964 35.971 126.093 1.00 50.23 ? 679 VAL A CB 1 +ATOM 5569 C CG1 . VAL A 1 679 ? -8.808 36.923 125.251 1.00 49.82 ? 679 VAL A CG1 1 +ATOM 5570 C CG2 . VAL A 1 679 ? -7.580 34.724 125.308 1.00 49.49 ? 679 VAL A CG2 1 +ATOM 5571 N N . ALA A 1 680 ? -7.057 39.073 126.492 1.00 52.63 ? 680 ALA A N 1 +ATOM 5572 C CA . ALA A 1 680 ? -7.440 40.388 126.978 1.00 53.40 ? 680 ALA A CA 1 +ATOM 5573 C C . ALA A 1 680 ? -8.367 41.064 125.970 1.00 54.67 ? 680 ALA A C 1 +ATOM 5574 O O . ALA A 1 680 ? -7.975 41.310 124.824 1.00 54.89 ? 680 ALA A O 1 +ATOM 5575 C CB . ALA A 1 680 ? -6.200 41.237 127.197 1.00 51.94 ? 680 ALA A CB 1 +ATOM 5576 N N . LYS A 1 681 ? -9.598 41.345 126.395 1.00 55.68 ? 681 LYS A N 1 +ATOM 5577 C CA . LYS A 1 681 ? -10.573 42.010 125.534 1.00 57.12 ? 681 LYS A CA 1 +ATOM 5578 C C . LYS A 1 681 ? -10.303 43.513 125.626 1.00 57.24 ? 681 LYS A C 1 +ATOM 5579 O O . LYS A 1 681 ? -10.852 44.189 126.493 1.00 57.26 ? 681 LYS A O 1 +ATOM 5580 C CB . LYS A 1 681 ? -11.997 41.729 126.020 1.00 58.58 ? 681 LYS A CB 1 +ATOM 5581 C CG . LYS A 1 681 ? -12.341 40.257 126.239 1.00 61.25 ? 681 LYS A CG 1 +ATOM 5582 C CD . LYS A 1 681 ? -12.590 39.512 124.934 1.00 64.08 ? 681 LYS A CD 1 +ATOM 5583 C CE . LYS A 1 681 ? -13.223 38.140 125.202 1.00 66.17 ? 681 LYS A CE 1 +ATOM 5584 N NZ . LYS A 1 681 ? -13.573 37.393 123.945 1.00 68.08 ? 681 LYS A NZ 1 +ATOM 5585 N N . ILE A 1 682 ? -9.460 44.028 124.735 1.00 57.27 ? 682 ILE A N 1 +ATOM 5586 C CA . ILE A 1 682 ? -9.102 45.445 124.732 1.00 56.60 ? 682 ILE A CA 1 +ATOM 5587 C C . ILE A 1 682 ? -10.147 46.351 124.081 1.00 57.94 ? 682 ILE A C 1 +ATOM 5588 O O . ILE A 1 682 ? -10.583 47.331 124.683 1.00 58.14 ? 682 ILE A O 1 +ATOM 5589 C CB . ILE A 1 682 ? -7.748 45.649 124.036 1.00 55.30 ? 682 ILE A CB 1 +ATOM 5590 C CG1 . ILE A 1 682 ? -6.667 44.891 124.814 1.00 55.20 ? 682 ILE A CG1 1 +ATOM 5591 C CG2 . ILE A 1 682 ? -7.428 47.128 123.930 1.00 54.93 ? 682 ILE A CG2 1 +ATOM 5592 C CD1 . ILE A 1 682 ? -5.285 44.960 124.205 1.00 54.25 ? 682 ILE A CD1 1 +ATOM 5593 N N . ASN A 1 683 ? -10.540 46.027 122.852 1.00 59.37 ? 683 ASN A N 1 +ATOM 5594 C CA . ASN A 1 683 ? -11.545 46.799 122.107 1.00 60.14 ? 683 ASN A CA 1 +ATOM 5595 C C . ASN A 1 683 ? -11.408 48.321 122.198 1.00 60.65 ? 683 ASN A C 1 +ATOM 5596 O O . ASN A 1 683 ? -12.346 49.015 122.599 1.00 61.47 ? 683 ASN A O 1 +ATOM 5597 C CB . ASN A 1 683 ? -12.952 46.398 122.556 1.00 59.38 ? 683 ASN A CB 1 +ATOM 5598 C CG . ASN A 1 683 ? -13.214 44.918 122.382 1.00 60.95 ? 683 ASN A CG 1 +ATOM 5599 O OD1 . ASN A 1 683 ? -13.032 44.365 121.290 1.00 60.93 ? 683 ASN A OD1 1 +ATOM 5600 N ND2 . ASN A 1 683 ? -13.647 44.264 123.456 1.00 60.36 ? 683 ASN A ND2 1 +ATOM 5601 N N . GLN A 1 684 ? -10.243 48.839 121.818 1.00 61.17 ? 684 GLN A N 1 +ATOM 5602 C CA . GLN A 1 684 ? -10.007 50.280 121.850 1.00 61.24 ? 684 GLN A CA 1 +ATOM 5603 C C . GLN A 1 684 ? -8.689 50.594 121.161 1.00 61.36 ? 684 GLN A C 1 +ATOM 5604 O O . GLN A 1 684 ? -7.822 49.727 121.039 1.00 61.54 ? 684 GLN A O 1 +ATOM 5605 C CB . GLN A 1 684 ? -9.942 50.785 123.290 1.00 61.50 ? 684 GLN A CB 1 +ATOM 5606 C CG . GLN A 1 684 ? -8.672 50.376 124.020 1.00 62.75 ? 684 GLN A CG 1 +ATOM 5607 C CD . GLN A 1 684 ? -8.572 50.991 125.403 1.00 63.55 ? 684 GLN A CD 1 +ATOM 5608 O OE1 . GLN A 1 684 ? -9.394 50.714 126.280 1.00 63.06 ? 684 GLN A OE1 1 +ATOM 5609 N NE2 . GLN A 1 684 ? -7.562 51.834 125.604 1.00 63.41 ? 684 GLN A NE2 1 +ATOM 5610 N N . LYS A 1 685 ? -8.539 51.837 120.717 1.00 61.29 ? 685 LYS A N 1 +ATOM 5611 C CA . LYS A 1 685 ? -7.313 52.251 120.050 1.00 62.07 ? 685 LYS A CA 1 +ATOM 5612 C C . LYS A 1 685 ? -6.146 52.292 121.031 1.00 61.86 ? 685 LYS A C 1 +ATOM 5613 O O . LYS A 1 685 ? -6.334 52.523 122.222 1.00 62.21 ? 685 LYS A O 1 +ATOM 5614 C CB . LYS A 1 685 ? -7.497 53.626 119.399 1.00 63.04 ? 685 LYS A CB 1 +ATOM 5615 C CG . LYS A 1 685 ? -8.478 53.618 118.230 1.00 65.53 ? 685 LYS A CG 1 +ATOM 5616 C CD . LYS A 1 685 ? -8.403 54.896 117.405 1.00 66.39 ? 685 LYS A CD 1 +ATOM 5617 C CE . LYS A 1 685 ? -8.853 56.104 118.207 1.00 68.60 ? 685 LYS A CE 1 +ATOM 5618 N NZ . LYS A 1 685 ? -10.272 55.986 118.650 1.00 70.03 ? 685 LYS A NZ 1 +ATOM 5619 N N . ILE A 1 686 ? -4.943 52.055 120.525 1.00 62.12 ? 686 ILE A N 1 +ATOM 5620 C CA . ILE A 1 686 ? -3.747 52.066 121.358 1.00 62.57 ? 686 ILE A CA 1 +ATOM 5621 C C . ILE A 1 686 ? -2.747 53.048 120.767 1.00 63.85 ? 686 ILE A C 1 +ATOM 5622 O O . ILE A 1 686 ? -2.299 52.900 119.629 1.00 64.59 ? 686 ILE A O 1 +ATOM 5623 C CB . ILE A 1 686 ? -3.127 50.659 121.450 1.00 61.20 ? 686 ILE A CB 1 +ATOM 5624 C CG1 . ILE A 1 686 ? -4.118 49.718 122.136 1.00 60.57 ? 686 ILE A CG1 1 +ATOM 5625 C CG2 . ILE A 1 686 ? -1.816 50.711 122.216 1.00 60.94 ? 686 ILE A CG2 1 +ATOM 5626 C CD1 . ILE A 1 686 ? -3.653 48.292 122.225 1.00 60.63 ? 686 ILE A CD1 1 +ATOM 5627 N N . ARG A 1 687 ? -2.411 54.060 121.554 1.00 65.19 ? 687 ARG A N 1 +ATOM 5628 C CA . ARG A 1 687 ? -1.495 55.101 121.122 1.00 66.50 ? 687 ARG A CA 1 +ATOM 5629 C C . ARG A 1 687 ? -0.127 54.572 120.700 1.00 65.83 ? 687 ARG A C 1 +ATOM 5630 O O . ARG A 1 687 ? 0.352 54.881 119.605 1.00 66.06 ? 687 ARG A O 1 +ATOM 5631 C CB . ARG A 1 687 ? -1.331 56.138 122.241 1.00 69.20 ? 687 ARG A CB 1 +ATOM 5632 C CG . ARG A 1 687 ? -2.646 56.719 122.760 1.00 71.95 ? 687 ARG A CG 1 +ATOM 5633 C CD . ARG A 1 687 ? -3.343 57.597 121.728 1.00 74.73 ? 687 ARG A CD 1 +ATOM 5634 N NE . ARG A 1 687 ? -2.619 58.844 121.470 1.00 77.94 ? 687 ARG A NE 1 +ATOM 5635 C CZ . ARG A 1 687 ? -1.610 58.980 120.608 1.00 79.17 ? 687 ARG A CZ 1 +ATOM 5636 N NH1 . ARG A 1 687 ? -1.185 57.941 119.895 1.00 79.81 ? 687 ARG A NH1 1 +ATOM 5637 N NH2 . ARG A 1 687 ? -1.022 60.162 120.460 1.00 78.79 ? 687 ARG A NH2 1 +ATOM 5638 N N . GLY A 1 688 ? 0.503 53.777 121.560 1.00 64.03 ? 688 GLY A N 1 +ATOM 5639 C CA . GLY A 1 688 ? 1.817 53.270 121.219 1.00 62.88 ? 688 GLY A CA 1 +ATOM 5640 C C . GLY A 1 688 ? 2.354 52.040 121.932 1.00 62.58 ? 688 GLY A C 1 +ATOM 5641 O O . GLY A 1 688 ? 3.354 51.479 121.476 1.00 62.45 ? 688 GLY A O 1 +ATOM 5642 N N . LYS A 1 689 ? 1.734 51.603 123.028 1.00 62.02 ? 689 LYS A N 1 +ATOM 5643 C CA . LYS A 1 689 ? 2.265 50.422 123.707 1.00 62.29 ? 689 LYS A CA 1 +ATOM 5644 C C . LYS A 1 689 ? 1.382 49.711 124.734 1.00 61.84 ? 689 LYS A C 1 +ATOM 5645 O O . LYS A 1 689 ? 0.412 50.264 125.249 1.00 62.07 ? 689 LYS A O 1 +ATOM 5646 C CB . LYS A 1 689 ? 3.600 50.764 124.371 1.00 62.81 ? 689 LYS A CB 1 +ATOM 5647 C CG . LYS A 1 689 ? 3.471 51.451 125.717 1.00 64.09 ? 689 LYS A CG 1 +ATOM 5648 C CD . LYS A 1 689 ? 4.817 51.488 126.414 1.00 65.00 ? 689 LYS A CD 1 +ATOM 5649 C CE . LYS A 1 689 ? 4.674 51.888 127.872 1.00 66.05 ? 689 LYS A CE 1 +ATOM 5650 N NZ . LYS A 1 689 ? 5.992 51.869 128.574 1.00 66.41 ? 689 LYS A NZ 1 +ATOM 5651 N N . ILE A 1 690 ? 1.752 48.465 125.013 1.00 61.57 ? 690 ILE A N 1 +ATOM 5652 C CA . ILE A 1 690 ? 1.063 47.621 125.980 1.00 61.86 ? 690 ILE A CA 1 +ATOM 5653 C C . ILE A 1 690 ? 2.144 46.920 126.795 1.00 62.98 ? 690 ILE A C 1 +ATOM 5654 O O . ILE A 1 690 ? 3.151 46.468 126.239 1.00 63.15 ? 690 ILE A O 1 +ATOM 5655 C CB . ILE A 1 690 ? 0.207 46.527 125.292 1.00 61.11 ? 690 ILE A CB 1 +ATOM 5656 C CG1 . ILE A 1 690 ? -0.904 47.165 124.459 1.00 60.22 ? 690 ILE A CG1 1 +ATOM 5657 C CG2 . ILE A 1 690 ? -0.382 45.590 126.341 1.00 59.60 ? 690 ILE A CG2 1 +ATOM 5658 C CD1 . ILE A 1 690 ? -1.734 46.152 123.692 1.00 60.23 ? 690 ILE A CD1 1 +ATOM 5659 N N . ASN A 1 691 ? 1.944 46.840 128.107 1.00 64.21 ? 691 ASN A N 1 +ATOM 5660 C CA . ASN A 1 691 ? 2.904 46.168 128.977 1.00 65.69 ? 691 ASN A CA 1 +ATOM 5661 C C . ASN A 1 691 ? 2.251 44.962 129.628 1.00 66.68 ? 691 ASN A C 1 +ATOM 5662 O O . ASN A 1 691 ? 1.051 44.963 129.897 1.00 67.14 ? 691 ASN A O 1 +ATOM 5663 C CB . ASN A 1 691 ? 3.428 47.118 130.062 1.00 65.93 ? 691 ASN A CB 1 +ATOM 5664 C CG . ASN A 1 691 ? 4.310 48.222 129.499 1.00 66.78 ? 691 ASN A CG 1 +ATOM 5665 O OD1 . ASN A 1 691 ? 3.817 49.220 128.957 1.00 67.07 ? 691 ASN A OD1 1 +ATOM 5666 N ND2 . ASN A 1 691 ? 5.626 48.042 129.613 1.00 66.53 ? 691 ASN A ND2 1 +ATOM 5667 N N . LEU A 1 692 ? 3.044 43.929 129.875 1.00 68.71 ? 692 LEU A N 1 +ATOM 5668 C CA . LEU A 1 692 ? 2.531 42.719 130.498 1.00 71.80 ? 692 LEU A CA 1 +ATOM 5669 C C . LEU A 1 692 ? 3.063 42.573 131.918 1.00 73.93 ? 692 LEU A C 1 +ATOM 5670 O O . LEU A 1 692 ? 4.197 42.964 132.208 1.00 74.47 ? 692 LEU A O 1 +ATOM 5671 C CB . LEU A 1 692 ? 2.921 41.490 129.669 1.00 71.93 ? 692 LEU A CB 1 +ATOM 5672 C CG . LEU A 1 692 ? 2.178 41.229 128.350 1.00 72.63 ? 692 LEU A CG 1 +ATOM 5673 C CD1 . LEU A 1 692 ? 2.271 42.434 127.423 1.00 72.28 ? 692 LEU A CD1 1 +ATOM 5674 C CD2 . LEU A 1 692 ? 2.780 40.000 127.684 1.00 72.86 ? 692 LEU A CD2 1 +ATOM 5675 N N . GLU A 1 693 ? 2.235 42.014 132.800 1.00 75.94 ? 693 GLU A N 1 +ATOM 5676 C CA . GLU A 1 693 ? 2.615 41.805 134.193 1.00 77.80 ? 693 GLU A CA 1 +ATOM 5677 C C . GLU A 1 693 ? 2.057 40.489 134.731 1.00 78.30 ? 693 GLU A C 1 +ATOM 5678 O O . GLU A 1 693 ? 0.999 40.022 134.299 1.00 78.73 ? 693 GLU A O 1 +ATOM 5679 C CB . GLU A 1 693 ? 2.118 42.964 135.059 1.00 79.23 ? 693 GLU A CB 1 +ATOM 5680 C CG . GLU A 1 693 ? 2.606 44.326 134.601 1.00 82.68 ? 693 GLU A CG 1 +ATOM 5681 C CD . GLU A 1 693 ? 2.214 45.434 135.558 1.00 85.56 ? 693 GLU A CD 1 +ATOM 5682 O OE1 . GLU A 1 693 ? 1.012 45.517 135.904 1.00 87.91 ? 693 GLU A OE1 1 +ATOM 5683 O OE2 . GLU A 1 693 ? 3.103 46.221 135.960 1.00 85.62 ? 693 GLU A OE2 1 +ATOM 5684 N N . ILE B 1 3 ? 9.025 -45.458 72.893 1.00 62.28 ? 3 ILE B N 1 +ATOM 5685 C CA . ILE B 1 3 ? 10.192 -45.697 73.795 1.00 62.92 ? 3 ILE B CA 1 +ATOM 5686 C C . ILE B 1 3 ? 9.975 -45.109 75.190 1.00 61.97 ? 3 ILE B C 1 +ATOM 5687 O O . ILE B 1 3 ? 10.258 -43.936 75.426 1.00 62.34 ? 3 ILE B O 1 +ATOM 5688 C CB . ILE B 1 3 ? 11.488 -45.067 73.222 1.00 64.57 ? 3 ILE B CB 1 +ATOM 5689 C CG1 . ILE B 1 3 ? 11.806 -45.668 71.851 1.00 65.35 ? 3 ILE B CG1 1 +ATOM 5690 C CG2 . ILE B 1 3 ? 12.655 -45.281 74.195 1.00 63.68 ? 3 ILE B CG2 1 +ATOM 5691 C CD1 . ILE B 1 3 ? 12.992 -45.004 71.161 1.00 66.39 ? 3 ILE B CD1 1 +ATOM 5692 N N . LEU B 1 4 ? 9.468 -45.925 76.108 1.00 60.51 ? 4 LEU B N 1 +ATOM 5693 C CA . LEU B 1 4 ? 9.252 -45.489 77.485 1.00 58.49 ? 4 LEU B CA 1 +ATOM 5694 C C . LEU B 1 4 ? 10.108 -46.335 78.419 1.00 57.53 ? 4 LEU B C 1 +ATOM 5695 O O . LEU B 1 4 ? 10.114 -47.561 78.330 1.00 57.83 ? 4 LEU B O 1 +ATOM 5696 C CB . LEU B 1 4 ? 7.785 -45.632 77.886 1.00 58.26 ? 4 LEU B CB 1 +ATOM 5697 C CG . LEU B 1 4 ? 7.527 -45.459 79.387 1.00 57.95 ? 4 LEU B CG 1 +ATOM 5698 C CD1 . LEU B 1 4 ? 8.083 -44.133 79.856 1.00 58.39 ? 4 LEU B CD1 1 +ATOM 5699 C CD2 . LEU B 1 4 ? 6.047 -45.537 79.661 1.00 57.58 ? 4 LEU B CD2 1 +ATOM 5700 N N . LYS B 1 5 ? 10.837 -45.679 79.309 1.00 55.64 ? 5 LYS B N 1 +ATOM 5701 C CA . LYS B 1 5 ? 11.679 -46.391 80.251 1.00 54.44 ? 5 LYS B CA 1 +ATOM 5702 C C . LYS B 1 5 ? 11.593 -45.723 81.607 1.00 53.01 ? 5 LYS B C 1 +ATOM 5703 O O . LYS B 1 5 ? 11.717 -44.508 81.719 1.00 52.13 ? 5 LYS B O 1 +ATOM 5704 C CB . LYS B 1 5 ? 13.131 -46.416 79.767 1.00 55.76 ? 5 LYS B CB 1 +ATOM 5705 C CG . LYS B 1 5 ? 13.347 -47.286 78.541 1.00 57.81 ? 5 LYS B CG 1 +ATOM 5706 C CD . LYS B 1 5 ? 14.833 -47.462 78.208 1.00 60.25 ? 5 LYS B CD 1 +ATOM 5707 C CE . LYS B 1 5 ? 15.472 -46.193 77.649 1.00 60.43 ? 5 LYS B CE 1 +ATOM 5708 N NZ . LYS B 1 5 ? 15.607 -45.106 78.661 1.00 61.77 ? 5 LYS B NZ 1 +ATOM 5709 N N . ILE B 1 6 ? 11.368 -46.523 82.638 1.00 51.32 ? 6 ILE B N 1 +ATOM 5710 C CA . ILE B 1 6 ? 11.262 -45.993 83.978 1.00 51.17 ? 6 ILE B CA 1 +ATOM 5711 C C . ILE B 1 6 ? 12.298 -46.626 84.885 1.00 52.05 ? 6 ILE B C 1 +ATOM 5712 O O . ILE B 1 6 ? 12.354 -47.841 85.016 1.00 52.72 ? 6 ILE B O 1 +ATOM 5713 C CB . ILE B 1 6 ? 9.860 -46.246 84.554 1.00 49.72 ? 6 ILE B CB 1 +ATOM 5714 C CG1 . ILE B 1 6 ? 8.808 -45.692 83.592 1.00 50.44 ? 6 ILE B CG1 1 +ATOM 5715 C CG2 . ILE B 1 6 ? 9.726 -45.579 85.913 1.00 49.11 ? 6 ILE B CG2 1 +ATOM 5716 C CD1 . ILE B 1 6 ? 7.380 -45.796 84.102 1.00 51.50 ? 6 ILE B CD1 1 +ATOM 5717 N N . TYR B 1 7 ? 13.135 -45.795 85.492 1.00 54.11 ? 7 TYR B N 1 +ATOM 5718 C CA . TYR B 1 7 ? 14.156 -46.276 86.406 1.00 57.30 ? 7 TYR B CA 1 +ATOM 5719 C C . TYR B 1 7 ? 13.717 -45.886 87.806 1.00 59.57 ? 7 TYR B C 1 +ATOM 5720 O O . TYR B 1 7 ? 12.641 -45.314 87.983 1.00 59.96 ? 7 TYR B O 1 +ATOM 5721 C CB . TYR B 1 7 ? 15.514 -45.656 86.082 1.00 58.13 ? 7 TYR B CB 1 +ATOM 5722 C CG . TYR B 1 7 ? 15.929 -45.848 84.641 1.00 60.79 ? 7 TYR B CG 1 +ATOM 5723 C CD1 . TYR B 1 7 ? 15.543 -44.938 83.658 1.00 61.84 ? 7 TYR B CD1 1 +ATOM 5724 C CD2 . TYR B 1 7 ? 16.684 -46.953 84.251 1.00 61.41 ? 7 TYR B CD2 1 +ATOM 5725 C CE1 . TYR B 1 7 ? 15.902 -45.122 82.322 1.00 62.82 ? 7 TYR B CE1 1 +ATOM 5726 C CE2 . TYR B 1 7 ? 17.045 -47.149 82.915 1.00 61.55 ? 7 TYR B CE2 1 +ATOM 5727 C CZ . TYR B 1 7 ? 16.649 -46.230 81.958 1.00 62.86 ? 7 TYR B CZ 1 +ATOM 5728 O OH . TYR B 1 7 ? 16.984 -46.420 80.635 1.00 63.63 ? 7 TYR B OH 1 +ATOM 5729 N N . GLU B 1 8 ? 14.538 -46.191 88.803 1.00 61.94 ? 8 GLU B N 1 +ATOM 5730 C CA . GLU B 1 8 ? 14.181 -45.872 90.176 1.00 63.69 ? 8 GLU B CA 1 +ATOM 5731 C C . GLU B 1 8 ? 15.327 -46.059 91.146 1.00 63.76 ? 8 GLU B C 1 +ATOM 5732 O O . GLU B 1 8 ? 16.185 -46.912 90.955 1.00 64.68 ? 8 GLU B O 1 +ATOM 5733 C CB . GLU B 1 8 ? 12.991 -46.733 90.615 1.00 64.72 ? 8 GLU B CB 1 +ATOM 5734 C CG . GLU B 1 8 ? 12.859 -46.891 92.120 1.00 70.66 ? 8 GLU B CG 1 +ATOM 5735 C CD . GLU B 1 8 ? 11.498 -47.419 92.552 1.00 74.34 ? 8 GLU B CD 1 +ATOM 5736 O OE1 . GLU B 1 8 ? 11.004 -48.408 91.955 1.00 76.01 ? 8 GLU B OE1 1 +ATOM 5737 O OE2 . GLU B 1 8 ? 10.923 -46.844 93.504 1.00 76.78 ? 8 GLU B OE2 1 +ATOM 5738 N N . ASN B 1 9 ? 15.340 -45.239 92.186 1.00 63.98 ? 9 ASN B N 1 +ATOM 5739 C CA . ASN B 1 9 ? 16.357 -45.331 93.214 1.00 64.76 ? 9 ASN B CA 1 +ATOM 5740 C C . ASN B 1 9 ? 15.988 -44.442 94.387 1.00 64.48 ? 9 ASN B C 1 +ATOM 5741 O O . ASN B 1 9 ? 15.941 -43.219 94.262 1.00 64.49 ? 9 ASN B O 1 +ATOM 5742 C CB . ASN B 1 9 ? 17.730 -44.931 92.677 1.00 66.62 ? 9 ASN B CB 1 +ATOM 5743 C CG . ASN B 1 9 ? 18.853 -45.265 93.655 1.00 68.39 ? 9 ASN B CG 1 +ATOM 5744 O OD1 . ASN B 1 9 ? 19.994 -44.834 93.479 1.00 70.40 ? 9 ASN B OD1 1 +ATOM 5745 N ND2 . ASN B 1 9 ? 18.532 -46.045 94.688 1.00 68.46 ? 9 ASN B ND2 1 +ATOM 5746 N N . LYS B 1 10 ? 15.727 -45.087 95.522 1.00 64.45 ? 10 LYS B N 1 +ATOM 5747 C CA . LYS B 1 10 ? 15.346 -44.435 96.771 1.00 64.18 ? 10 LYS B CA 1 +ATOM 5748 C C . LYS B 1 10 ? 14.359 -43.283 96.647 1.00 62.77 ? 10 LYS B C 1 +ATOM 5749 O O . LYS B 1 10 ? 14.711 -42.123 96.865 1.00 63.15 ? 10 LYS B O 1 +ATOM 5750 C CB . LYS B 1 10 ? 16.595 -43.976 97.537 1.00 65.74 ? 10 LYS B CB 1 +ATOM 5751 C CG . LYS B 1 10 ? 17.534 -43.079 96.750 1.00 68.57 ? 10 LYS B CG 1 +ATOM 5752 C CD . LYS B 1 10 ? 18.929 -43.065 97.372 1.00 70.73 ? 10 LYS B CD 1 +ATOM 5753 C CE . LYS B 1 10 ? 19.551 -44.460 97.370 1.00 71.95 ? 10 LYS B CE 1 +ATOM 5754 N NZ . LYS B 1 10 ? 20.901 -44.486 98.005 1.00 72.40 ? 10 LYS B NZ 1 +ATOM 5755 N N . GLY B 1 11 ? 13.120 -43.621 96.300 1.00 60.83 ? 11 GLY B N 1 +ATOM 5756 C CA . GLY B 1 11 ? 12.064 -42.629 96.183 1.00 59.35 ? 11 GLY B CA 1 +ATOM 5757 C C . GLY B 1 11 ? 12.196 -41.585 95.091 1.00 58.02 ? 11 GLY B C 1 +ATOM 5758 O O . GLY B 1 11 ? 11.647 -40.488 95.210 1.00 59.05 ? 11 GLY B O 1 +ATOM 5759 N N . VAL B 1 12 ? 12.915 -41.917 94.025 1.00 56.08 ? 12 VAL B N 1 +ATOM 5760 C CA . VAL B 1 12 ? 13.100 -40.999 92.911 1.00 53.40 ? 12 VAL B CA 1 +ATOM 5761 C C . VAL B 1 12 ? 12.993 -41.758 91.589 1.00 52.63 ? 12 VAL B C 1 +ATOM 5762 O O . VAL B 1 12 ? 13.960 -42.380 91.145 1.00 52.84 ? 12 VAL B O 1 +ATOM 5763 C CB . VAL B 1 12 ? 14.481 -40.297 92.992 1.00 53.48 ? 12 VAL B CB 1 +ATOM 5764 C CG1 . VAL B 1 12 ? 14.647 -39.331 91.833 1.00 52.31 ? 12 VAL B CG1 1 +ATOM 5765 C CG2 . VAL B 1 12 ? 14.616 -39.558 94.321 1.00 51.21 ? 12 VAL B CG2 1 +ATOM 5766 N N . TYR B 1 13 ? 11.809 -41.722 90.975 1.00 50.80 ? 13 TYR B N 1 +ATOM 5767 C CA . TYR B 1 13 ? 11.588 -42.393 89.695 1.00 48.21 ? 13 TYR B CA 1 +ATOM 5768 C C . TYR B 1 13 ? 12.042 -41.491 88.561 1.00 46.73 ? 13 TYR B C 1 +ATOM 5769 O O . TYR B 1 13 ? 11.709 -40.313 88.534 1.00 47.08 ? 13 TYR B O 1 +ATOM 5770 C CB . TYR B 1 13 ? 10.109 -42.714 89.481 1.00 47.77 ? 13 TYR B CB 1 +ATOM 5771 C CG . TYR B 1 13 ? 9.521 -43.637 90.512 1.00 49.16 ? 13 TYR B CG 1 +ATOM 5772 C CD1 . TYR B 1 13 ? 9.125 -43.160 91.761 1.00 50.14 ? 13 TYR B CD1 1 +ATOM 5773 C CD2 . TYR B 1 13 ? 9.382 -44.999 90.252 1.00 49.27 ? 13 TYR B CD2 1 +ATOM 5774 C CE1 . TYR B 1 13 ? 8.606 -44.020 92.730 1.00 50.40 ? 13 TYR B CE1 1 +ATOM 5775 C CE2 . TYR B 1 13 ? 8.867 -45.868 91.211 1.00 50.00 ? 13 TYR B CE2 1 +ATOM 5776 C CZ . TYR B 1 13 ? 8.482 -45.374 92.447 1.00 50.90 ? 13 TYR B CZ 1 +ATOM 5777 O OH . TYR B 1 13 ? 7.982 -46.233 93.397 1.00 50.23 ? 13 TYR B OH 1 +ATOM 5778 N N . LYS B 1 14 ? 12.822 -42.039 87.638 1.00 44.96 ? 14 LYS B N 1 +ATOM 5779 C CA . LYS B 1 14 ? 13.278 -41.276 86.492 1.00 42.49 ? 14 LYS B CA 1 +ATOM 5780 C C . LYS B 1 14 ? 12.527 -41.812 85.283 1.00 42.57 ? 14 LYS B C 1 +ATOM 5781 O O . LYS B 1 14 ? 12.725 -42.956 84.888 1.00 43.52 ? 14 LYS B O 1 +ATOM 5782 C CB . LYS B 1 14 ? 14.779 -41.444 86.287 1.00 41.73 ? 14 LYS B CB 1 +ATOM 5783 C CG . LYS B 1 14 ? 15.281 -40.702 85.063 1.00 42.71 ? 14 LYS B CG 1 +ATOM 5784 C CD . LYS B 1 14 ? 16.786 -40.783 84.901 1.00 41.74 ? 14 LYS B CD 1 +ATOM 5785 C CE . LYS B 1 14 ? 17.224 -39.968 83.684 1.00 43.80 ? 14 LYS B CE 1 +ATOM 5786 N NZ . LYS B 1 14 ? 18.710 -39.885 83.532 1.00 44.10 ? 14 LYS B NZ 1 +ATOM 5787 N N . VAL B 1 15 ? 11.647 -40.996 84.713 1.00 41.35 ? 15 VAL B N 1 +ATOM 5788 C CA . VAL B 1 15 ? 10.864 -41.404 83.549 1.00 40.19 ? 15 VAL B CA 1 +ATOM 5789 C C . VAL B 1 15 ? 11.497 -40.836 82.292 1.00 40.10 ? 15 VAL B C 1 +ATOM 5790 O O . VAL B 1 15 ? 11.659 -39.631 82.165 1.00 41.56 ? 15 VAL B O 1 +ATOM 5791 C CB . VAL B 1 15 ? 9.403 -40.904 83.647 1.00 39.68 ? 15 VAL B CB 1 +ATOM 5792 C CG1 . VAL B 1 15 ? 8.604 -41.369 82.452 1.00 38.08 ? 15 VAL B CG1 1 +ATOM 5793 C CG2 . VAL B 1 15 ? 8.768 -41.417 84.927 1.00 38.31 ? 15 VAL B CG2 1 +ATOM 5794 N N . VAL B 1 16 ? 11.860 -41.713 81.367 1.00 40.60 ? 16 VAL B N 1 +ATOM 5795 C CA . VAL B 1 16 ? 12.486 -41.298 80.124 1.00 40.27 ? 16 VAL B CA 1 +ATOM 5796 C C . VAL B 1 16 ? 11.553 -41.554 78.946 1.00 41.18 ? 16 VAL B C 1 +ATOM 5797 O O . VAL B 1 16 ? 11.137 -42.682 78.704 1.00 40.05 ? 16 VAL B O 1 +ATOM 5798 C CB . VAL B 1 16 ? 13.806 -42.062 79.893 1.00 40.00 ? 16 VAL B CB 1 +ATOM 5799 C CG1 . VAL B 1 16 ? 14.456 -41.601 78.599 1.00 40.08 ? 16 VAL B CG1 1 +ATOM 5800 C CG2 . VAL B 1 16 ? 14.741 -41.859 81.071 1.00 38.01 ? 16 VAL B CG2 1 +ATOM 5801 N N . ILE B 1 17 ? 11.219 -40.492 78.221 1.00 43.96 ? 17 ILE B N 1 +ATOM 5802 C CA . ILE B 1 17 ? 10.349 -40.597 77.054 1.00 45.39 ? 17 ILE B CA 1 +ATOM 5803 C C . ILE B 1 17 ? 11.215 -40.390 75.821 1.00 46.58 ? 17 ILE B C 1 +ATOM 5804 O O . ILE B 1 17 ? 11.841 -39.340 75.670 1.00 47.99 ? 17 ILE B O 1 +ATOM 5805 C CB . ILE B 1 17 ? 9.260 -39.522 77.078 1.00 47.61 ? 17 ILE B CB 1 +ATOM 5806 C CG1 . ILE B 1 17 ? 8.478 -39.606 78.392 1.00 48.48 ? 17 ILE B CG1 1 +ATOM 5807 C CG2 . ILE B 1 17 ? 8.329 -39.694 75.887 1.00 46.61 ? 17 ILE B CG2 1 +ATOM 5808 C CD1 . ILE B 1 17 ? 7.796 -40.932 78.608 1.00 50.23 ? 17 ILE B CD1 1 +ATOM 5809 N N . GLY B 1 18 ? 11.262 -41.394 74.950 1.00 46.92 ? 18 GLY B N 1 +ATOM 5810 C CA . GLY B 1 18 ? 12.077 -41.296 73.753 1.00 48.11 ? 18 GLY B CA 1 +ATOM 5811 C C . GLY B 1 18 ? 13.556 -41.337 74.084 1.00 49.93 ? 18 GLY B C 1 +ATOM 5812 O O . GLY B 1 18 ? 13.976 -42.084 74.966 1.00 50.16 ? 18 GLY B O 1 +ATOM 5813 N N . GLU B 1 19 ? 14.346 -40.533 73.377 1.00 51.74 ? 19 GLU B N 1 +ATOM 5814 C CA . GLU B 1 19 ? 15.790 -40.474 73.600 1.00 54.39 ? 19 GLU B CA 1 +ATOM 5815 C C . GLU B 1 19 ? 16.173 -39.032 73.910 1.00 53.65 ? 19 GLU B C 1 +ATOM 5816 O O . GLU B 1 19 ? 16.664 -38.307 73.050 1.00 53.97 ? 19 GLU B O 1 +ATOM 5817 C CB . GLU B 1 19 ? 16.524 -40.978 72.359 1.00 57.71 ? 19 GLU B CB 1 +ATOM 5818 C CG . GLU B 1 19 ? 16.195 -42.433 72.045 1.00 64.36 ? 19 GLU B CG 1 +ATOM 5819 C CD . GLU B 1 19 ? 16.607 -42.854 70.643 1.00 68.46 ? 19 GLU B CD 1 +ATOM 5820 O OE1 . GLU B 1 19 ? 16.088 -42.266 69.663 1.00 69.88 ? 19 GLU B OE1 1 +ATOM 5821 O OE2 . GLU B 1 19 ? 17.445 -43.778 70.528 1.00 70.56 ? 19 GLU B OE2 1 +ATOM 5822 N N . PRO B 1 20 ? 15.949 -38.603 75.162 1.00 53.13 ? 20 PRO B N 1 +ATOM 5823 C CA . PRO B 1 20 ? 16.234 -37.255 75.657 1.00 51.66 ? 20 PRO B CA 1 +ATOM 5824 C C . PRO B 1 20 ? 17.687 -36.822 75.601 1.00 50.79 ? 20 PRO B C 1 +ATOM 5825 O O . PRO B 1 20 ? 18.602 -37.642 75.706 1.00 50.42 ? 20 PRO B O 1 +ATOM 5826 C CB . PRO B 1 20 ? 15.731 -37.300 77.100 1.00 51.66 ? 20 PRO B CB 1 +ATOM 5827 C CG . PRO B 1 20 ? 14.701 -38.391 77.083 1.00 52.95 ? 20 PRO B CG 1 +ATOM 5828 C CD . PRO B 1 20 ? 15.355 -39.427 76.228 1.00 52.93 ? 20 PRO B CD 1 +ATOM 5829 N N . PHE B 1 21 ? 17.875 -35.515 75.438 1.00 48.71 ? 21 PHE B N 1 +ATOM 5830 C CA . PHE B 1 21 ? 19.190 -34.893 75.416 1.00 46.90 ? 21 PHE B CA 1 +ATOM 5831 C C . PHE B 1 21 ? 19.001 -33.729 76.382 1.00 45.78 ? 21 PHE B C 1 +ATOM 5832 O O . PHE B 1 21 ? 18.756 -32.601 75.965 1.00 46.89 ? 21 PHE B O 1 +ATOM 5833 C CB . PHE B 1 21 ? 19.518 -34.366 74.019 1.00 46.58 ? 21 PHE B CB 1 +ATOM 5834 C CG . PHE B 1 21 ? 20.954 -33.967 73.847 1.00 45.81 ? 21 PHE B CG 1 +ATOM 5835 C CD1 . PHE B 1 21 ? 21.948 -34.936 73.749 1.00 45.50 ? 21 PHE B CD1 1 +ATOM 5836 C CD2 . PHE B 1 21 ? 21.317 -32.628 73.809 1.00 45.02 ? 21 PHE B CD2 1 +ATOM 5837 C CE1 . PHE B 1 21 ? 23.286 -34.576 73.616 1.00 44.75 ? 21 PHE B CE1 1 +ATOM 5838 C CE2 . PHE B 1 21 ? 22.651 -32.257 73.677 1.00 45.51 ? 21 PHE B CE2 1 +ATOM 5839 C CZ . PHE B 1 21 ? 23.637 -33.235 73.581 1.00 45.90 ? 21 PHE B CZ 1 +ATOM 5840 N N . PRO B 1 22 ? 19.104 -33.996 77.693 1.00 44.82 ? 22 PRO B N 1 +ATOM 5841 C CA . PRO B 1 22 ? 18.937 -33.006 78.768 1.00 43.78 ? 22 PRO B CA 1 +ATOM 5842 C C . PRO B 1 22 ? 19.841 -31.791 78.651 1.00 42.96 ? 22 PRO B C 1 +ATOM 5843 O O . PRO B 1 22 ? 20.956 -31.886 78.136 1.00 44.48 ? 22 PRO B O 1 +ATOM 5844 C CB . PRO B 1 22 ? 19.243 -33.805 80.039 1.00 43.79 ? 22 PRO B CB 1 +ATOM 5845 C CG . PRO B 1 22 ? 19.046 -35.234 79.631 1.00 45.03 ? 22 PRO B CG 1 +ATOM 5846 C CD . PRO B 1 22 ? 19.607 -35.264 78.240 1.00 44.15 ? 22 PRO B CD 1 +ATOM 5847 N N . PRO B 1 23 ? 19.373 -30.627 79.133 1.00 41.85 ? 23 PRO B N 1 +ATOM 5848 C CA . PRO B 1 23 ? 20.174 -29.399 79.075 1.00 41.47 ? 23 PRO B CA 1 +ATOM 5849 C C . PRO B 1 23 ? 21.409 -29.596 79.945 1.00 42.28 ? 23 PRO B C 1 +ATOM 5850 O O . PRO B 1 23 ? 22.461 -28.997 79.731 1.00 42.14 ? 23 PRO B O 1 +ATOM 5851 C CB . PRO B 1 23 ? 19.224 -28.345 79.636 1.00 41.28 ? 23 PRO B CB 1 +ATOM 5852 C CG . PRO B 1 23 ? 18.377 -29.129 80.592 1.00 39.95 ? 23 PRO B CG 1 +ATOM 5853 C CD . PRO B 1 23 ? 18.088 -30.386 79.814 1.00 40.63 ? 23 PRO B CD 1 +ATOM 5854 N N . ILE B 1 24 ? 21.253 -30.449 80.944 1.00 43.39 ? 24 ILE B N 1 +ATOM 5855 C CA . ILE B 1 24 ? 22.336 -30.780 81.852 1.00 45.31 ? 24 ILE B CA 1 +ATOM 5856 C C . ILE B 1 24 ? 22.036 -32.168 82.379 1.00 46.32 ? 24 ILE B C 1 +ATOM 5857 O O . ILE B 1 24 ? 20.872 -32.520 82.579 1.00 46.30 ? 24 ILE B O 1 +ATOM 5858 C CB . ILE B 1 24 ? 22.434 -29.787 83.032 1.00 45.71 ? 24 ILE B CB 1 +ATOM 5859 C CG1 . ILE B 1 24 ? 23.566 -30.220 83.973 1.00 44.51 ? 24 ILE B CG1 1 +ATOM 5860 C CG2 . ILE B 1 24 ? 21.096 -29.711 83.771 1.00 43.37 ? 24 ILE B CG2 1 +ATOM 5861 C CD1 . ILE B 1 24 ? 23.925 -29.195 85.018 1.00 44.43 ? 24 ILE B CD1 1 +ATOM 5862 N N . GLU B 1 25 ? 23.078 -32.963 82.588 1.00 48.43 ? 25 GLU B N 1 +ATOM 5863 C CA . GLU B 1 25 ? 22.881 -34.318 83.078 1.00 51.22 ? 25 GLU B CA 1 +ATOM 5864 C C . GLU B 1 25 ? 23.042 -34.406 84.580 1.00 52.07 ? 25 GLU B C 1 +ATOM 5865 O O . GLU B 1 25 ? 24.052 -33.976 85.140 1.00 52.42 ? 25 GLU B O 1 +ATOM 5866 C CB . GLU B 1 25 ? 23.852 -35.279 82.395 1.00 52.08 ? 25 GLU B CB 1 +ATOM 5867 C CG . GLU B 1 25 ? 23.623 -35.414 80.897 1.00 56.01 ? 25 GLU B CG 1 +ATOM 5868 C CD . GLU B 1 25 ? 24.592 -36.379 80.236 1.00 57.74 ? 25 GLU B CD 1 +ATOM 5869 O OE1 . GLU B 1 25 ? 25.822 -36.138 80.300 1.00 57.69 ? 25 GLU B OE1 1 +ATOM 5870 O OE2 . GLU B 1 25 ? 24.114 -37.379 79.653 1.00 59.09 ? 25 GLU B OE2 1 +ATOM 5871 N N . PHE B 1 26 ? 22.025 -34.957 85.228 1.00 53.53 ? 26 PHE B N 1 +ATOM 5872 C CA . PHE B 1 26 ? 22.038 -35.121 86.667 1.00 55.73 ? 26 PHE B CA 1 +ATOM 5873 C C . PHE B 1 26 ? 22.304 -36.578 86.990 1.00 59.35 ? 26 PHE B C 1 +ATOM 5874 O O . PHE B 1 26 ? 21.506 -37.458 86.656 1.00 59.21 ? 26 PHE B O 1 +ATOM 5875 C CB . PHE B 1 26 ? 20.704 -34.679 87.263 1.00 53.29 ? 26 PHE B CB 1 +ATOM 5876 C CG . PHE B 1 26 ? 20.455 -33.205 87.147 1.00 51.25 ? 26 PHE B CG 1 +ATOM 5877 C CD1 . PHE B 1 26 ? 21.328 -32.289 87.739 1.00 51.20 ? 26 PHE B CD1 1 +ATOM 5878 C CD2 . PHE B 1 26 ? 19.362 -32.728 86.433 1.00 49.73 ? 26 PHE B CD2 1 +ATOM 5879 C CE1 . PHE B 1 26 ? 21.115 -30.916 87.621 1.00 49.77 ? 26 PHE B CE1 1 +ATOM 5880 C CE2 . PHE B 1 26 ? 19.138 -31.360 86.306 1.00 49.59 ? 26 PHE B CE2 1 +ATOM 5881 C CZ . PHE B 1 26 ? 20.017 -30.451 86.902 1.00 49.98 ? 26 PHE B CZ 1 +ATOM 5882 N N . PRO B 1 27 ? 23.439 -36.845 87.654 1.00 63.34 ? 27 PRO B N 1 +ATOM 5883 C CA . PRO B 1 27 ? 23.894 -38.177 88.064 1.00 66.76 ? 27 PRO B CA 1 +ATOM 5884 C C . PRO B 1 27 ? 22.939 -38.873 89.026 1.00 69.67 ? 27 PRO B C 1 +ATOM 5885 O O . PRO B 1 27 ? 22.688 -38.376 90.124 1.00 70.45 ? 27 PRO B O 1 +ATOM 5886 C CB . PRO B 1 27 ? 25.244 -37.886 88.712 1.00 66.22 ? 27 PRO B CB 1 +ATOM 5887 C CG . PRO B 1 27 ? 25.025 -36.532 89.325 1.00 65.10 ? 27 PRO B CG 1 +ATOM 5888 C CD . PRO B 1 27 ? 24.332 -35.804 88.200 1.00 64.67 ? 27 PRO B CD 1 +ATOM 5889 N N . LEU B 1 28 ? 22.401 -40.016 88.612 1.00 72.62 ? 28 LEU B N 1 +ATOM 5890 C CA . LEU B 1 28 ? 21.495 -40.766 89.470 1.00 76.92 ? 28 LEU B CA 1 +ATOM 5891 C C . LEU B 1 28 ? 22.299 -41.898 90.116 1.00 79.82 ? 28 LEU B C 1 +ATOM 5892 O O . LEU B 1 28 ? 22.797 -42.782 89.415 1.00 80.53 ? 28 LEU B O 1 +ATOM 5893 C CB . LEU B 1 28 ? 20.331 -41.336 88.650 1.00 76.78 ? 28 LEU B CB 1 +ATOM 5894 C CG . LEU B 1 28 ? 19.124 -41.845 89.451 1.00 76.76 ? 28 LEU B CG 1 +ATOM 5895 C CD1 . LEU B 1 28 ? 18.477 -40.690 90.196 1.00 75.35 ? 28 LEU B CD1 1 +ATOM 5896 C CD2 . LEU B 1 28 ? 18.121 -42.493 88.516 1.00 76.56 ? 28 LEU B CD2 1 +ATOM 5897 N N . GLU B 1 29 ? 22.429 -41.851 91.446 1.00 82.75 ? 29 GLU B N 1 +ATOM 5898 C CA . GLU B 1 29 ? 23.181 -42.848 92.228 1.00 85.71 ? 29 GLU B CA 1 +ATOM 5899 C C . GLU B 1 29 ? 23.241 -44.213 91.540 1.00 86.55 ? 29 GLU B C 1 +ATOM 5900 O O . GLU B 1 29 ? 24.298 -44.641 91.067 1.00 86.94 ? 29 GLU B O 1 +ATOM 5901 C CB . GLU B 1 29 ? 22.554 -43.022 93.620 1.00 87.15 ? 29 GLU B CB 1 +ATOM 5902 C CG . GLU B 1 29 ? 22.205 -41.722 94.346 1.00 89.66 ? 29 GLU B CG 1 +ATOM 5903 C CD . GLU B 1 29 ? 23.417 -40.862 94.660 1.00 90.69 ? 29 GLU B CD 1 +ATOM 5904 O OE1 . GLU B 1 29 ? 24.060 -40.356 93.712 1.00 91.32 ? 29 GLU B OE1 1 +ATOM 5905 O OE2 . GLU B 1 29 ? 23.722 -40.691 95.861 1.00 90.84 ? 29 GLU B OE2 1 +ATOM 5906 N N . GLN B 1 30 ? 22.099 -44.894 91.506 1.00 87.01 ? 30 GLN B N 1 +ATOM 5907 C CA . GLN B 1 30 ? 21.992 -46.196 90.862 1.00 87.42 ? 30 GLN B CA 1 +ATOM 5908 C C . GLN B 1 30 ? 21.347 -45.999 89.499 1.00 86.62 ? 30 GLN B C 1 +ATOM 5909 O O . GLN B 1 30 ? 21.258 -44.882 88.990 1.00 86.65 ? 30 GLN B O 1 +ATOM 5910 C CB . GLN B 1 30 ? 21.113 -47.140 91.689 1.00 89.00 ? 30 GLN B CB 1 +ATOM 5911 C CG . GLN B 1 30 ? 21.680 -47.542 93.046 1.00 90.33 ? 30 GLN B CG 1 +ATOM 5912 C CD . GLN B 1 30 ? 22.839 -48.518 92.940 1.00 91.06 ? 30 GLN B CD 1 +ATOM 5913 O OE1 . GLN B 1 30 ? 23.315 -49.041 93.950 1.00 91.90 ? 30 GLN B OE1 1 +ATOM 5914 N NE2 . GLN B 1 30 ? 23.299 -48.768 91.718 1.00 90.81 ? 30 GLN B NE2 1 +ATOM 5915 N N . LYS B 1 31 ? 20.898 -47.099 88.915 1.00 85.96 ? 31 LYS B N 1 +ATOM 5916 C CA . LYS B 1 31 ? 20.231 -47.067 87.628 1.00 85.14 ? 31 LYS B CA 1 +ATOM 5917 C C . LYS B 1 31 ? 19.289 -48.258 87.639 1.00 84.54 ? 31 LYS B C 1 +ATOM 5918 O O . LYS B 1 31 ? 19.106 -48.946 86.633 1.00 84.38 ? 31 LYS B O 1 +ATOM 5919 C CB . LYS B 1 31 ? 21.247 -47.185 86.494 1.00 85.73 ? 31 LYS B CB 1 +ATOM 5920 C CG . LYS B 1 31 ? 20.666 -46.897 85.111 1.00 87.58 ? 31 LYS B CG 1 +ATOM 5921 C CD . LYS B 1 31 ? 19.885 -45.578 85.078 1.00 87.46 ? 31 LYS B CD 1 +ATOM 5922 C CE . LYS B 1 31 ? 20.747 -44.396 85.497 1.00 88.10 ? 31 LYS B CE 1 +ATOM 5923 N NZ . LYS B 1 31 ? 19.983 -43.117 85.516 1.00 88.37 ? 31 LYS B NZ 1 +ATOM 5924 N N . ILE B 1 32 ? 18.703 -48.487 88.812 1.00 83.43 ? 32 ILE B N 1 +ATOM 5925 C CA . ILE B 1 32 ? 17.770 -49.587 89.036 1.00 82.70 ? 32 ILE B CA 1 +ATOM 5926 C C . ILE B 1 32 ? 16.481 -49.385 88.244 1.00 81.27 ? 32 ILE B C 1 +ATOM 5927 O O . ILE B 1 32 ? 15.959 -48.273 88.185 1.00 81.79 ? 32 ILE B O 1 +ATOM 5928 C CB . ILE B 1 32 ? 17.382 -49.695 90.538 1.00 82.98 ? 32 ILE B CB 1 +ATOM 5929 C CG1 . ILE B 1 32 ? 18.635 -49.807 91.414 1.00 83.21 ? 32 ILE B CG1 1 +ATOM 5930 C CG2 . ILE B 1 32 ? 16.467 -50.891 90.748 1.00 83.04 ? 32 ILE B CG2 1 +ATOM 5931 C CD1 . ILE B 1 32 ? 18.337 -49.893 92.907 1.00 82.03 ? 32 ILE B CD1 1 +ATOM 5932 N N . SER B 1 33 ? 15.966 -50.454 87.641 1.00 79.14 ? 33 SER B N 1 +ATOM 5933 C CA . SER B 1 33 ? 14.718 -50.355 86.891 1.00 76.13 ? 33 SER B CA 1 +ATOM 5934 C C . SER B 1 33 ? 13.561 -50.374 87.892 1.00 74.71 ? 33 SER B C 1 +ATOM 5935 O O . SER B 1 33 ? 13.696 -50.895 89.003 1.00 74.24 ? 33 SER B O 1 +ATOM 5936 C CB . SER B 1 33 ? 14.585 -51.518 85.907 1.00 76.05 ? 33 SER B CB 1 +ATOM 5937 O OG . SER B 1 33 ? 13.365 -51.430 85.188 1.00 74.49 ? 33 SER B OG 1 +ATOM 5938 N N . SER B 1 34 ? 12.425 -49.808 87.499 1.00 72.47 ? 34 SER B N 1 +ATOM 5939 C CA . SER B 1 34 ? 11.267 -49.744 88.383 1.00 71.21 ? 34 SER B CA 1 +ATOM 5940 C C . SER B 1 34 ? 10.189 -50.789 88.132 1.00 70.65 ? 34 SER B C 1 +ATOM 5941 O O . SER B 1 34 ? 9.989 -51.243 87.005 1.00 69.60 ? 34 SER B O 1 +ATOM 5942 C CB . SER B 1 34 ? 10.633 -48.357 88.302 1.00 70.85 ? 34 SER B CB 1 +ATOM 5943 O OG . SER B 1 34 ? 9.305 -48.382 88.795 1.00 69.58 ? 34 SER B OG 1 +ATOM 5944 N N . ASN B 1 35 ? 9.492 -51.161 89.202 1.00 70.41 ? 35 ASN B N 1 +ATOM 5945 C CA . ASN B 1 35 ? 8.404 -52.129 89.116 1.00 71.42 ? 35 ASN B CA 1 +ATOM 5946 C C . ASN B 1 35 ? 7.088 -51.368 88.909 1.00 70.73 ? 35 ASN B C 1 +ATOM 5947 O O . ASN B 1 35 ? 6.015 -51.963 88.805 1.00 70.86 ? 35 ASN B O 1 +ATOM 5948 C CB . ASN B 1 35 ? 8.332 -52.963 90.401 1.00 71.66 ? 35 ASN B CB 1 +ATOM 5949 C CG . ASN B 1 35 ? 8.100 -52.114 91.635 1.00 73.51 ? 35 ASN B CG 1 +ATOM 5950 O OD1 . ASN B 1 35 ? 8.845 -51.167 91.901 1.00 75.29 ? 35 ASN B OD1 1 +ATOM 5951 N ND2 . ASN B 1 35 ? 7.064 -52.447 92.396 1.00 74.36 ? 35 ASN B ND2 1 +ATOM 5952 N N . LYS B 1 36 ? 7.185 -50.042 88.848 1.00 70.22 ? 36 LYS B N 1 +ATOM 5953 C CA . LYS B 1 36 ? 6.014 -49.199 88.654 1.00 68.77 ? 36 LYS B CA 1 +ATOM 5954 C C . LYS B 1 36 ? 5.826 -48.780 87.207 1.00 67.08 ? 36 LYS B C 1 +ATOM 5955 O O . LYS B 1 36 ? 6.789 -48.562 86.475 1.00 65.83 ? 36 LYS B O 1 +ATOM 5956 C CB . LYS B 1 36 ? 6.097 -47.953 89.537 1.00 69.63 ? 36 LYS B CB 1 +ATOM 5957 C CG . LYS B 1 36 ? 5.594 -48.157 90.963 1.00 71.59 ? 36 LYS B CG 1 +ATOM 5958 C CD . LYS B 1 36 ? 5.639 -46.849 91.752 1.00 73.28 ? 36 LYS B CD 1 +ATOM 5959 C CE . LYS B 1 36 ? 4.885 -46.950 93.079 1.00 74.99 ? 36 LYS B CE 1 +ATOM 5960 N NZ . LYS B 1 36 ? 5.370 -48.060 93.954 1.00 75.68 ? 36 LYS B NZ 1 +ATOM 5961 N N . SER B 1 37 ? 4.565 -48.680 86.808 1.00 66.54 ? 37 SER B N 1 +ATOM 5962 C CA . SER B 1 37 ? 4.190 -48.274 85.457 1.00 65.29 ? 37 SER B CA 1 +ATOM 5963 C C . SER B 1 37 ? 3.561 -46.884 85.550 1.00 64.40 ? 37 SER B C 1 +ATOM 5964 O O . SER B 1 37 ? 3.189 -46.447 86.644 1.00 64.94 ? 37 SER B O 1 +ATOM 5965 C CB . SER B 1 37 ? 3.170 -49.259 84.881 1.00 64.47 ? 37 SER B CB 1 +ATOM 5966 O OG . SER B 1 37 ? 1.958 -49.224 85.620 1.00 64.52 ? 37 SER B OG 1 +ATOM 5967 N N . LEU B 1 38 ? 3.443 -46.194 84.415 1.00 62.75 ? 38 LEU B N 1 +ATOM 5968 C CA . LEU B 1 38 ? 2.840 -44.862 84.400 1.00 61.59 ? 38 LEU B CA 1 +ATOM 5969 C C . LEU B 1 38 ? 1.481 -44.915 85.083 1.00 61.53 ? 38 LEU B C 1 +ATOM 5970 O O . LEU B 1 38 ? 1.134 -44.026 85.859 1.00 61.50 ? 38 LEU B O 1 +ATOM 5971 C CB . LEU B 1 38 ? 2.665 -44.357 82.967 1.00 60.61 ? 38 LEU B CB 1 +ATOM 5972 C CG . LEU B 1 38 ? 3.921 -44.025 82.164 1.00 59.62 ? 38 LEU B CG 1 +ATOM 5973 C CD1 . LEU B 1 38 ? 3.525 -43.712 80.741 1.00 58.16 ? 38 LEU B CD1 1 +ATOM 5974 C CD2 . LEU B 1 38 ? 4.648 -42.851 82.790 1.00 59.92 ? 38 LEU B CD2 1 +ATOM 5975 N N . SER B 1 39 ? 0.715 -45.963 84.794 1.00 61.19 ? 39 SER B N 1 +ATOM 5976 C CA . SER B 1 39 ? -0.600 -46.125 85.399 1.00 61.87 ? 39 SER B CA 1 +ATOM 5977 C C . SER B 1 39 ? -0.497 -46.025 86.911 1.00 61.41 ? 39 SER B C 1 +ATOM 5978 O O . SER B 1 39 ? -1.246 -45.283 87.544 1.00 61.60 ? 39 SER B O 1 +ATOM 5979 C CB . SER B 1 39 ? -1.201 -47.485 85.033 1.00 63.28 ? 39 SER B CB 1 +ATOM 5980 O OG . SER B 1 39 ? -1.523 -47.558 83.655 1.00 66.18 ? 39 SER B OG 1 +ATOM 5981 N N . GLU B 1 40 ? 0.441 -46.773 87.484 1.00 60.40 ? 40 GLU B N 1 +ATOM 5982 C CA . GLU B 1 40 ? 0.634 -46.785 88.930 1.00 59.37 ? 40 GLU B CA 1 +ATOM 5983 C C . GLU B 1 40 ? 1.089 -45.429 89.460 1.00 56.93 ? 40 GLU B C 1 +ATOM 5984 O O . GLU B 1 40 ? 0.758 -45.050 90.579 1.00 57.17 ? 40 GLU B O 1 +ATOM 5985 C CB . GLU B 1 40 ? 1.644 -47.878 89.312 1.00 61.80 ? 40 GLU B CB 1 +ATOM 5986 C CG . GLU B 1 40 ? 1.193 -49.299 88.924 1.00 66.58 ? 40 GLU B CG 1 +ATOM 5987 C CD . GLU B 1 40 ? 2.240 -50.382 89.209 1.00 69.72 ? 40 GLU B CD 1 +ATOM 5988 O OE1 . GLU B 1 40 ? 3.324 -50.366 88.578 1.00 71.02 ? 40 GLU B OE1 1 +ATOM 5989 O OE2 . GLU B 1 40 ? 1.976 -51.258 90.065 1.00 71.45 ? 40 GLU B OE2 1 +ATOM 5990 N N . LEU B 1 41 ? 1.826 -44.695 88.635 1.00 53.86 ? 41 LEU B N 1 +ATOM 5991 C CA . LEU B 1 41 ? 2.361 -43.385 88.988 1.00 51.31 ? 41 LEU B CA 1 +ATOM 5992 C C . LEU B 1 41 ? 1.317 -42.277 88.799 1.00 50.95 ? 41 LEU B C 1 +ATOM 5993 O O . LEU B 1 41 ? 1.555 -41.117 89.145 1.00 49.59 ? 41 LEU B O 1 +ATOM 5994 C CB . LEU B 1 41 ? 3.591 -43.111 88.122 1.00 50.09 ? 41 LEU B CB 1 +ATOM 5995 C CG . LEU B 1 41 ? 4.953 -42.895 88.779 1.00 49.16 ? 41 LEU B CG 1 +ATOM 5996 C CD1 . LEU B 1 41 ? 5.093 -43.717 90.041 1.00 49.29 ? 41 LEU B CD1 1 +ATOM 5997 C CD2 . LEU B 1 41 ? 6.033 -43.260 87.774 1.00 49.57 ? 41 LEU B CD2 1 +ATOM 5998 N N . GLY B 1 42 ? 0.162 -42.648 88.246 1.00 50.82 ? 42 GLY B N 1 +ATOM 5999 C CA . GLY B 1 42 ? -0.910 -41.692 88.017 1.00 49.43 ? 42 GLY B CA 1 +ATOM 6000 C C . GLY B 1 42 ? -0.629 -40.693 86.903 1.00 49.61 ? 42 GLY B C 1 +ATOM 6001 O O . GLY B 1 42 ? -1.127 -39.563 86.932 1.00 48.60 ? 42 GLY B O 1 +ATOM 6002 N N . LEU B 1 43 ? 0.162 -41.107 85.917 1.00 47.40 ? 43 LEU B N 1 +ATOM 6003 C CA . LEU B 1 43 ? 0.508 -40.234 84.810 1.00 47.28 ? 43 LEU B CA 1 +ATOM 6004 C C . LEU B 1 43 ? 0.051 -40.769 83.460 1.00 48.95 ? 43 LEU B C 1 +ATOM 6005 O O . LEU B 1 43 ? -0.079 -41.975 83.258 1.00 50.01 ? 43 LEU B O 1 +ATOM 6006 C CB . LEU B 1 43 ? 2.019 -40.020 84.764 1.00 46.04 ? 43 LEU B CB 1 +ATOM 6007 C CG . LEU B 1 43 ? 2.667 -39.431 86.010 1.00 45.68 ? 43 LEU B CG 1 +ATOM 6008 C CD1 . LEU B 1 43 ? 4.165 -39.363 85.804 1.00 44.97 ? 43 LEU B CD1 1 +ATOM 6009 C CD2 . LEU B 1 43 ? 2.096 -38.049 86.282 1.00 45.40 ? 43 LEU B CD2 1 +ATOM 6010 N N . THR B 1 44 ? -0.194 -39.847 82.539 1.00 49.53 ? 44 THR B N 1 +ATOM 6011 C CA . THR B 1 44 ? -0.601 -40.177 81.184 1.00 49.95 ? 44 THR B CA 1 +ATOM 6012 C C . THR B 1 44 ? 0.408 -39.434 80.328 1.00 50.69 ? 44 THR B C 1 +ATOM 6013 O O . THR B 1 44 ? 0.767 -38.300 80.633 1.00 51.36 ? 44 THR B O 1 +ATOM 6014 C CB . THR B 1 44 ? -2.012 -39.658 80.875 1.00 50.79 ? 44 THR B CB 1 +ATOM 6015 O OG1 . THR B 1 44 ? -2.970 -40.411 81.630 1.00 52.41 ? 44 THR B OG1 1 +ATOM 6016 C CG2 . THR B 1 44 ? -2.317 -39.784 79.392 1.00 50.23 ? 44 THR B CG2 1 +ATOM 6017 N N . ILE B 1 45 ? 0.886 -40.065 79.269 1.00 50.75 ? 45 ILE B N 1 +ATOM 6018 C CA . ILE B 1 45 ? 1.868 -39.415 78.425 1.00 51.38 ? 45 ILE B CA 1 +ATOM 6019 C C . ILE B 1 45 ? 1.517 -39.542 76.959 1.00 52.37 ? 45 ILE B C 1 +ATOM 6020 O O . ILE B 1 45 ? 1.070 -40.588 76.506 1.00 53.59 ? 45 ILE B O 1 +ATOM 6021 C CB . ILE B 1 45 ? 3.269 -39.996 78.684 1.00 51.47 ? 45 ILE B CB 1 +ATOM 6022 C CG1 . ILE B 1 45 ? 3.658 -39.727 80.139 1.00 51.00 ? 45 ILE B CG1 1 +ATOM 6023 C CG2 . ILE B 1 45 ? 4.284 -39.385 77.725 1.00 50.43 ? 45 ILE B CG2 1 +ATOM 6024 C CD1 . ILE B 1 45 ? 5.025 -40.240 80.516 1.00 52.49 ? 45 ILE B CD1 1 +ATOM 6025 N N . VAL B 1 46 ? 1.714 -38.455 76.227 1.00 53.87 ? 46 VAL B N 1 +ATOM 6026 C CA . VAL B 1 46 ? 1.421 -38.413 74.805 1.00 55.80 ? 46 VAL B CA 1 +ATOM 6027 C C . VAL B 1 46 ? 2.568 -37.759 74.042 1.00 57.82 ? 46 VAL B C 1 +ATOM 6028 O O . VAL B 1 46 ? 3.135 -36.761 74.485 1.00 57.58 ? 46 VAL B O 1 +ATOM 6029 C CB . VAL B 1 46 ? 0.128 -37.613 74.536 1.00 55.62 ? 46 VAL B CB 1 +ATOM 6030 C CG1 . VAL B 1 46 ? -0.092 -37.464 73.041 1.00 55.62 ? 46 VAL B CG1 1 +ATOM 6031 C CG2 . VAL B 1 46 ? -1.055 -38.308 75.183 1.00 54.61 ? 46 VAL B CG2 1 +ATOM 6032 N N . GLN B 1 47 ? 2.916 -38.342 72.901 1.00 60.87 ? 47 GLN B N 1 +ATOM 6033 C CA . GLN B 1 47 ? 3.971 -37.808 72.048 1.00 63.97 ? 47 GLN B CA 1 +ATOM 6034 C C . GLN B 1 47 ? 3.346 -37.391 70.725 1.00 65.30 ? 47 GLN B C 1 +ATOM 6035 O O . GLN B 1 47 ? 2.726 -38.204 70.045 1.00 66.35 ? 47 GLN B O 1 +ATOM 6036 C CB . GLN B 1 47 ? 5.049 -38.859 71.793 1.00 64.25 ? 47 GLN B CB 1 +ATOM 6037 C CG . GLN B 1 47 ? 6.071 -38.976 72.897 1.00 66.04 ? 47 GLN B CG 1 +ATOM 6038 C CD . GLN B 1 47 ? 7.144 -39.999 72.579 1.00 67.81 ? 47 GLN B CD 1 +ATOM 6039 O OE1 . GLN B 1 47 ? 6.899 -41.207 72.627 1.00 69.22 ? 47 GLN B OE1 1 +ATOM 6040 N NE2 . GLN B 1 47 ? 8.341 -39.521 72.239 1.00 67.69 ? 47 GLN B NE2 1 +ATOM 6041 N N . GLN B 1 48 ? 3.501 -36.123 70.366 1.00 67.05 ? 48 GLN B N 1 +ATOM 6042 C CA . GLN B 1 48 ? 2.938 -35.616 69.123 1.00 68.82 ? 48 GLN B CA 1 +ATOM 6043 C C . GLN B 1 48 ? 3.961 -34.876 68.272 1.00 69.11 ? 48 GLN B C 1 +ATOM 6044 O O . GLN B 1 48 ? 5.144 -35.231 68.243 1.00 69.47 ? 48 GLN B O 1 +ATOM 6045 C CB . GLN B 1 48 ? 1.761 -34.689 69.421 1.00 70.04 ? 48 GLN B CB 1 +ATOM 6046 C CG . GLN B 1 48 ? 0.572 -35.393 70.041 1.00 72.07 ? 48 GLN B CG 1 +ATOM 6047 C CD . GLN B 1 48 ? -0.551 -34.435 70.384 1.00 74.01 ? 48 GLN B CD 1 +ATOM 6048 O OE1 . GLN B 1 48 ? -1.612 -34.848 70.857 1.00 74.84 ? 48 GLN B OE1 1 +ATOM 6049 N NE2 . GLN B 1 48 ? -0.322 -33.145 70.151 1.00 74.68 ? 48 GLN B NE2 1 +ATOM 6050 N N . GLY B 1 49 ? 3.492 -33.845 67.578 1.00 68.30 ? 49 GLY B N 1 +ATOM 6051 C CA . GLY B 1 49 ? 4.369 -33.070 66.726 1.00 67.55 ? 49 GLY B CA 1 +ATOM 6052 C C . GLY B 1 49 ? 5.514 -32.447 67.491 1.00 67.16 ? 49 GLY B C 1 +ATOM 6053 O O . GLY B 1 49 ? 5.454 -31.274 67.858 1.00 67.86 ? 49 GLY B O 1 +ATOM 6054 N N . ASN B 1 50 ? 6.561 -33.230 67.731 1.00 65.89 ? 50 ASN B N 1 +ATOM 6055 C CA . ASN B 1 50 ? 7.728 -32.747 68.457 1.00 64.51 ? 50 ASN B CA 1 +ATOM 6056 C C . ASN B 1 50 ? 7.384 -32.201 69.839 1.00 62.20 ? 50 ASN B C 1 +ATOM 6057 O O . ASN B 1 50 ? 8.032 -31.270 70.321 1.00 62.64 ? 50 ASN B O 1 +ATOM 6058 C CB . ASN B 1 50 ? 8.442 -31.662 67.650 1.00 66.96 ? 50 ASN B CB 1 +ATOM 6059 C CG . ASN B 1 50 ? 9.208 -32.226 66.469 1.00 70.61 ? 50 ASN B CG 1 +ATOM 6060 O OD1 . ASN B 1 50 ? 10.182 -32.969 66.640 1.00 71.88 ? 50 ASN B OD1 1 +ATOM 6061 N ND2 . ASN B 1 50 ? 8.771 -31.881 65.259 1.00 72.32 ? 50 ASN B ND2 1 +ATOM 6062 N N . LYS B 1 51 ? 6.361 -32.770 70.468 1.00 58.16 ? 51 LYS B N 1 +ATOM 6063 C CA . LYS B 1 51 ? 5.965 -32.345 71.799 1.00 54.17 ? 51 LYS B CA 1 +ATOM 6064 C C . LYS B 1 51 ? 5.600 -33.533 72.678 1.00 51.65 ? 51 LYS B C 1 +ATOM 6065 O O . LYS B 1 51 ? 5.157 -34.572 72.192 1.00 50.73 ? 51 LYS B O 1 +ATOM 6066 C CB . LYS B 1 51 ? 4.779 -31.382 71.727 1.00 54.56 ? 51 LYS B CB 1 +ATOM 6067 C CG . LYS B 1 51 ? 5.096 -30.071 71.037 1.00 57.86 ? 51 LYS B CG 1 +ATOM 6068 C CD . LYS B 1 51 ? 3.995 -29.026 71.228 1.00 60.58 ? 51 LYS B CD 1 +ATOM 6069 C CE . LYS B 1 51 ? 2.676 -29.457 70.594 1.00 62.95 ? 51 LYS B CE 1 +ATOM 6070 N NZ . LYS B 1 51 ? 2.088 -30.653 71.263 1.00 64.20 ? 51 LYS B NZ 1 +ATOM 6071 N N . VAL B 1 52 ? 5.814 -33.381 73.978 1.00 49.13 ? 52 VAL B N 1 +ATOM 6072 C CA . VAL B 1 52 ? 5.467 -34.421 74.934 1.00 46.30 ? 52 VAL B CA 1 +ATOM 6073 C C . VAL B 1 52 ? 4.499 -33.794 75.932 1.00 45.47 ? 52 VAL B C 1 +ATOM 6074 O O . VAL B 1 52 ? 4.784 -32.742 76.508 1.00 45.48 ? 52 VAL B O 1 +ATOM 6075 C CB . VAL B 1 52 ? 6.708 -34.951 75.681 1.00 44.80 ? 52 VAL B CB 1 +ATOM 6076 C CG1 . VAL B 1 52 ? 6.286 -35.929 76.753 1.00 43.12 ? 52 VAL B CG1 1 +ATOM 6077 C CG2 . VAL B 1 52 ? 7.652 -35.628 74.704 1.00 43.73 ? 52 VAL B CG2 1 +ATOM 6078 N N . ILE B 1 53 ? 3.343 -34.426 76.109 1.00 43.25 ? 53 ILE B N 1 +ATOM 6079 C CA . ILE B 1 53 ? 2.342 -33.931 77.037 1.00 41.59 ? 53 ILE B CA 1 +ATOM 6080 C C . ILE B 1 53 ? 2.204 -34.925 78.174 1.00 42.59 ? 53 ILE B C 1 +ATOM 6081 O O . ILE B 1 53 ? 1.939 -36.099 77.940 1.00 43.97 ? 53 ILE B O 1 +ATOM 6082 C CB . ILE B 1 53 ? 0.986 -33.772 76.342 1.00 40.84 ? 53 ILE B CB 1 +ATOM 6083 C CG1 . ILE B 1 53 ? 1.143 -32.856 75.130 1.00 41.24 ? 53 ILE B CG1 1 +ATOM 6084 C CG2 . ILE B 1 53 ? -0.040 -33.205 77.302 1.00 38.47 ? 53 ILE B CG2 1 +ATOM 6085 C CD1 . ILE B 1 53 ? -0.104 -32.740 74.291 1.00 42.87 ? 53 ILE B CD1 1 +ATOM 6086 N N . VAL B 1 54 ? 2.394 -34.457 79.404 1.00 42.84 ? 54 VAL B N 1 +ATOM 6087 C CA . VAL B 1 54 ? 2.283 -35.308 80.584 1.00 41.37 ? 54 VAL B CA 1 +ATOM 6088 C C . VAL B 1 54 ? 1.105 -34.827 81.421 1.00 42.41 ? 54 VAL B C 1 +ATOM 6089 O O . VAL B 1 54 ? 1.057 -33.669 81.826 1.00 43.17 ? 54 VAL B O 1 +ATOM 6090 C CB . VAL B 1 54 ? 3.571 -35.254 81.427 1.00 40.45 ? 54 VAL B CB 1 +ATOM 6091 C CG1 . VAL B 1 54 ? 3.433 -36.126 82.650 1.00 39.34 ? 54 VAL B CG1 1 +ATOM 6092 C CG2 . VAL B 1 54 ? 4.747 -35.717 80.594 1.00 40.18 ? 54 VAL B CG2 1 +ATOM 6093 N N . GLU B 1 55 ? 0.154 -35.720 81.671 1.00 43.90 ? 55 GLU B N 1 +ATOM 6094 C CA . GLU B 1 55 ? -1.040 -35.395 82.442 1.00 44.64 ? 55 GLU B CA 1 +ATOM 6095 C C . GLU B 1 55 ? -1.121 -36.108 83.778 1.00 44.03 ? 55 GLU B C 1 +ATOM 6096 O O . GLU B 1 55 ? -0.658 -37.239 83.931 1.00 44.43 ? 55 GLU B O 1 +ATOM 6097 C CB . GLU B 1 55 ? -2.295 -35.730 81.643 1.00 46.98 ? 55 GLU B CB 1 +ATOM 6098 C CG . GLU B 1 55 ? -2.625 -34.735 80.569 1.00 54.52 ? 55 GLU B CG 1 +ATOM 6099 C CD . GLU B 1 55 ? -3.861 -35.135 79.772 1.00 59.95 ? 55 GLU B CD 1 +ATOM 6100 O OE1 . GLU B 1 55 ? -4.849 -35.604 80.396 1.00 61.43 ? 55 GLU B OE1 1 +ATOM 6101 O OE2 . GLU B 1 55 ? -3.845 -34.971 78.525 1.00 62.00 ? 55 GLU B OE2 1 +ATOM 6102 N N . LYS B 1 56 ? -1.737 -35.426 84.735 1.00 42.89 ? 56 LYS B N 1 +ATOM 6103 C CA . LYS B 1 56 ? -1.925 -35.936 86.081 1.00 42.67 ? 56 LYS B CA 1 +ATOM 6104 C C . LYS B 1 56 ? -3.281 -35.382 86.500 1.00 43.26 ? 56 LYS B C 1 +ATOM 6105 O O . LYS B 1 56 ? -3.675 -34.297 86.066 1.00 43.64 ? 56 LYS B O 1 +ATOM 6106 C CB . LYS B 1 56 ? -0.833 -35.394 87.009 1.00 41.88 ? 56 LYS B CB 1 +ATOM 6107 C CG . LYS B 1 56 ? -0.717 -36.130 88.322 1.00 43.41 ? 56 LYS B CG 1 +ATOM 6108 C CD . LYS B 1 56 ? 0.254 -35.444 89.263 1.00 44.50 ? 56 LYS B CD 1 +ATOM 6109 C CE . LYS B 1 56 ? -0.454 -34.419 90.107 1.00 45.46 ? 56 LYS B CE 1 +ATOM 6110 N NZ . LYS B 1 56 ? -1.485 -35.087 90.959 1.00 47.10 ? 56 LYS B NZ 1 +ATOM 6111 N N . SER B 1 57 ? -4.012 -36.116 87.323 1.00 42.92 ? 57 SER B N 1 +ATOM 6112 C CA . SER B 1 57 ? -5.303 -35.616 87.754 1.00 43.54 ? 57 SER B CA 1 +ATOM 6113 C C . SER B 1 57 ? -5.048 -34.587 88.836 1.00 43.44 ? 57 SER B C 1 +ATOM 6114 O O . SER B 1 57 ? -3.956 -34.527 89.411 1.00 43.26 ? 57 SER B O 1 +ATOM 6115 C CB . SER B 1 57 ? -6.163 -36.740 88.315 1.00 44.50 ? 57 SER B CB 1 +ATOM 6116 O OG . SER B 1 57 ? -5.653 -37.163 89.565 1.00 49.31 ? 57 SER B OG 1 +ATOM 6117 N N . LEU B 1 58 ? -6.060 -33.774 89.103 1.00 43.44 ? 58 LEU B N 1 +ATOM 6118 C CA . LEU B 1 58 ? -5.967 -32.740 90.117 1.00 43.63 ? 58 LEU B CA 1 +ATOM 6119 C C . LEU B 1 58 ? -7.271 -32.732 90.904 1.00 44.79 ? 58 LEU B C 1 +ATOM 6120 O O . LEU B 1 58 ? -8.330 -32.458 90.345 1.00 45.60 ? 58 LEU B O 1 +ATOM 6121 C CB . LEU B 1 58 ? -5.747 -31.382 89.452 1.00 41.69 ? 58 LEU B CB 1 +ATOM 6122 C CG . LEU B 1 58 ? -5.563 -30.179 90.374 1.00 40.47 ? 58 LEU B CG 1 +ATOM 6123 C CD1 . LEU B 1 58 ? -4.206 -30.267 91.079 1.00 37.52 ? 58 LEU B CD1 1 +ATOM 6124 C CD2 . LEU B 1 58 ? -5.677 -28.903 89.551 1.00 39.91 ? 58 LEU B CD2 1 +ATOM 6125 N N . ASP B 1 59 ? -7.195 -33.046 92.194 1.00 46.73 ? 59 ASP B N 1 +ATOM 6126 C CA . ASP B 1 59 ? -8.381 -33.067 93.041 1.00 49.23 ? 59 ASP B CA 1 +ATOM 6127 C C . ASP B 1 59 ? -8.692 -31.682 93.600 1.00 48.62 ? 59 ASP B C 1 +ATOM 6128 O O . ASP B 1 59 ? -7.812 -30.824 93.666 1.00 48.40 ? 59 ASP B O 1 +ATOM 6129 C CB . ASP B 1 59 ? -8.192 -34.055 94.195 1.00 52.45 ? 59 ASP B CB 1 +ATOM 6130 C CG . ASP B 1 59 ? -7.944 -35.476 93.715 1.00 57.94 ? 59 ASP B CG 1 +ATOM 6131 O OD1 . ASP B 1 59 ? -8.637 -35.928 92.772 1.00 59.79 ? 59 ASP B OD1 1 +ATOM 6132 O OD2 . ASP B 1 59 ? -7.060 -36.151 94.291 1.00 61.88 ? 59 ASP B OD2 1 +ATOM 6133 N N . LEU B 1 60 ? -9.946 -31.473 93.999 1.00 48.09 ? 60 LEU B N 1 +ATOM 6134 C CA . LEU B 1 60 ? -10.379 -30.195 94.555 1.00 48.58 ? 60 LEU B CA 1 +ATOM 6135 C C . LEU B 1 60 ? -9.520 -29.699 95.712 1.00 48.95 ? 60 LEU B C 1 +ATOM 6136 O O . LEU B 1 60 ? -9.180 -28.520 95.775 1.00 49.66 ? 60 LEU B O 1 +ATOM 6137 C CB . LEU B 1 60 ? -11.830 -30.285 95.031 1.00 48.47 ? 60 LEU B CB 1 +ATOM 6138 C CG . LEU B 1 60 ? -12.923 -30.286 93.969 1.00 48.40 ? 60 LEU B CG 1 +ATOM 6139 C CD1 . LEU B 1 60 ? -14.272 -30.362 94.647 1.00 48.45 ? 60 LEU B CD1 1 +ATOM 6140 C CD2 . LEU B 1 60 ? -12.827 -29.019 93.133 1.00 49.59 ? 60 LEU B CD2 1 +ATOM 6141 N N . LYS B 1 61 ? -9.176 -30.599 96.628 1.00 49.99 ? 61 LYS B N 1 +ATOM 6142 C CA . LYS B 1 61 ? -8.379 -30.241 97.801 1.00 50.42 ? 61 LYS B CA 1 +ATOM 6143 C C . LYS B 1 61 ? -6.873 -30.360 97.592 1.00 49.27 ? 61 LYS B C 1 +ATOM 6144 O O . LYS B 1 61 ? -6.100 -30.073 98.505 1.00 50.46 ? 61 LYS B O 1 +ATOM 6145 C CB . LYS B 1 61 ? -8.783 -31.118 98.988 1.00 52.97 ? 61 LYS B CB 1 +ATOM 6146 C CG . LYS B 1 61 ? -10.218 -30.922 99.482 1.00 57.21 ? 61 LYS B CG 1 +ATOM 6147 C CD . LYS B 1 61 ? -10.387 -29.625 100.265 1.00 59.75 ? 61 LYS B CD 1 +ATOM 6148 C CE . LYS B 1 61 ? -11.692 -29.637 101.061 1.00 62.37 ? 61 LYS B CE 1 +ATOM 6149 N NZ . LYS B 1 61 ? -11.862 -28.417 101.912 1.00 64.13 ? 61 LYS B NZ 1 +ATOM 6150 N N . GLU B 1 62 ? -6.457 -30.780 96.403 1.00 46.23 ? 62 GLU B N 1 +ATOM 6151 C CA . GLU B 1 62 ? -5.038 -30.943 96.100 1.00 44.72 ? 62 GLU B CA 1 +ATOM 6152 C C . GLU B 1 62 ? -4.302 -29.603 95.951 1.00 43.27 ? 62 GLU B C 1 +ATOM 6153 O O . GLU B 1 62 ? -4.816 -28.675 95.335 1.00 44.72 ? 62 GLU B O 1 +ATOM 6154 C CB . GLU B 1 62 ? -4.894 -31.771 94.822 1.00 44.86 ? 62 GLU B CB 1 +ATOM 6155 C CG . GLU B 1 62 ? -3.476 -32.131 94.446 1.00 46.44 ? 62 GLU B CG 1 +ATOM 6156 C CD . GLU B 1 62 ? -3.420 -33.156 93.318 1.00 48.46 ? 62 GLU B CD 1 +ATOM 6157 O OE1 . GLU B 1 62 ? -4.489 -33.660 92.900 1.00 49.13 ? 62 GLU B OE1 1 +ATOM 6158 O OE2 . GLU B 1 62 ? -2.302 -33.467 92.850 1.00 48.58 ? 62 GLU B OE2 1 +ATOM 6159 N N . HIS B 1 63 ? -3.104 -29.503 96.524 1.00 40.89 ? 63 HIS B N 1 +ATOM 6160 C CA . HIS B 1 63 ? -2.315 -28.275 96.436 1.00 39.16 ? 63 HIS B CA 1 +ATOM 6161 C C . HIS B 1 63 ? -1.141 -28.457 95.484 1.00 38.20 ? 63 HIS B C 1 +ATOM 6162 O O . HIS B 1 63 ? -0.523 -29.516 95.441 1.00 39.40 ? 63 HIS B O 1 +ATOM 6163 C CB . HIS B 1 63 ? -1.760 -27.873 97.805 1.00 38.93 ? 63 HIS B CB 1 +ATOM 6164 C CG . HIS B 1 63 ? -2.798 -27.794 98.877 1.00 41.05 ? 63 HIS B CG 1 +ATOM 6165 N ND1 . HIS B 1 63 ? -3.795 -26.842 98.876 1.00 42.20 ? 63 HIS B ND1 1 +ATOM 6166 C CD2 . HIS B 1 63 ? -3.021 -28.572 99.965 1.00 41.35 ? 63 HIS B CD2 1 +ATOM 6167 C CE1 . HIS B 1 63 ? -4.591 -27.040 99.914 1.00 42.02 ? 63 HIS B CE1 1 +ATOM 6168 N NE2 . HIS B 1 63 ? -4.144 -28.084 100.590 1.00 41.16 ? 63 HIS B NE2 1 +ATOM 6169 N N . ILE B 1 64 ? -0.838 -27.415 94.721 1.00 36.12 ? 64 ILE B N 1 +ATOM 6170 C CA . ILE B 1 64 ? 0.268 -27.450 93.789 1.00 34.16 ? 64 ILE B CA 1 +ATOM 6171 C C . ILE B 1 64 ? 1.157 -26.279 94.159 1.00 33.92 ? 64 ILE B C 1 +ATOM 6172 O O . ILE B 1 64 ? 0.703 -25.136 94.190 1.00 34.08 ? 64 ILE B O 1 +ATOM 6173 C CB . ILE B 1 64 ? -0.211 -27.286 92.327 1.00 34.24 ? 64 ILE B CB 1 +ATOM 6174 C CG1 . ILE B 1 64 ? -1.198 -28.401 91.970 1.00 32.25 ? 64 ILE B CG1 1 +ATOM 6175 C CG2 . ILE B 1 64 ? 1.001 -27.306 91.373 1.00 33.35 ? 64 ILE B CG2 1 +ATOM 6176 C CD1 . ILE B 1 64 ? -0.601 -29.795 92.005 1.00 32.73 ? 64 ILE B CD1 1 +ATOM 6177 N N . ILE B 1 65 ? 2.421 -26.564 94.447 1.00 32.82 ? 65 ILE B N 1 +ATOM 6178 C CA . ILE B 1 65 ? 3.355 -25.519 94.832 1.00 32.82 ? 65 ILE B CA 1 +ATOM 6179 C C . ILE B 1 65 ? 4.635 -25.635 94.028 1.00 33.27 ? 65 ILE B C 1 +ATOM 6180 O O . ILE B 1 65 ? 4.876 -26.649 93.386 1.00 35.22 ? 65 ILE B O 1 +ATOM 6181 C CB . ILE B 1 65 ? 3.683 -25.614 96.327 1.00 33.07 ? 65 ILE B CB 1 +ATOM 6182 C CG1 . ILE B 1 65 ? 4.371 -26.947 96.624 1.00 33.44 ? 65 ILE B CG1 1 +ATOM 6183 C CG2 . ILE B 1 65 ? 2.400 -25.498 97.144 1.00 31.52 ? 65 ILE B CG2 1 +ATOM 6184 C CD1 . ILE B 1 65 ? 4.664 -27.180 98.095 1.00 34.47 ? 65 ILE B CD1 1 +ATOM 6185 N N . GLY B 1 66 ? 5.448 -24.588 94.047 1.00 33.75 ? 66 GLY B N 1 +ATOM 6186 C CA . GLY B 1 66 ? 6.692 -24.629 93.306 1.00 34.92 ? 66 GLY B CA 1 +ATOM 6187 C C . GLY B 1 66 ? 6.718 -23.738 92.080 1.00 35.37 ? 66 GLY B C 1 +ATOM 6188 O O . GLY B 1 66 ? 6.155 -22.646 92.085 1.00 36.34 ? 66 GLY B O 1 +ATOM 6189 N N . LEU B 1 67 ? 7.384 -24.219 91.032 1.00 35.01 ? 67 LEU B N 1 +ATOM 6190 C CA . LEU B 1 67 ? 7.528 -23.505 89.769 1.00 35.77 ? 67 LEU B CA 1 +ATOM 6191 C C . LEU B 1 67 ? 8.443 -22.301 89.901 1.00 37.06 ? 67 LEU B C 1 +ATOM 6192 O O . LEU B 1 67 ? 8.516 -21.455 89.004 1.00 38.10 ? 67 LEU B O 1 +ATOM 6193 C CB . LEU B 1 67 ? 6.160 -23.079 89.221 1.00 34.21 ? 67 LEU B CB 1 +ATOM 6194 C CG . LEU B 1 67 ? 5.243 -24.250 88.873 1.00 34.69 ? 67 LEU B CG 1 +ATOM 6195 C CD1 . LEU B 1 67 ? 4.021 -23.719 88.178 1.00 36.14 ? 67 LEU B CD1 1 +ATOM 6196 C CD2 . LEU B 1 67 ? 5.964 -25.255 87.981 1.00 34.36 ? 67 LEU B CD2 1 +ATOM 6197 N N . GLY B 1 68 ? 9.131 -22.223 91.034 1.00 37.07 ? 68 GLY B N 1 +ATOM 6198 C CA . GLY B 1 68 ? 10.071 -21.140 91.257 1.00 37.74 ? 68 GLY B CA 1 +ATOM 6199 C C . GLY B 1 68 ? 9.555 -19.720 91.387 1.00 38.58 ? 68 GLY B C 1 +ATOM 6200 O O . GLY B 1 68 ? 8.608 -19.435 92.126 1.00 38.64 ? 68 GLY B O 1 +ATOM 6201 N N . GLU B 1 69 ? 10.200 -18.823 90.650 1.00 39.25 ? 69 GLU B N 1 +ATOM 6202 C CA . GLU B 1 69 ? 9.879 -17.398 90.674 1.00 39.54 ? 69 GLU B CA 1 +ATOM 6203 C C . GLU B 1 69 ? 8.612 -17.036 89.891 1.00 38.81 ? 69 GLU B C 1 +ATOM 6204 O O . GLU B 1 69 ? 8.681 -16.739 88.705 1.00 39.89 ? 69 GLU B O 1 +ATOM 6205 C CB . GLU B 1 69 ? 11.077 -16.632 90.114 1.00 39.99 ? 69 GLU B CB 1 +ATOM 6206 C CG . GLU B 1 69 ? 11.116 -15.160 90.387 1.00 41.31 ? 69 GLU B CG 1 +ATOM 6207 C CD . GLU B 1 69 ? 12.371 -14.526 89.794 1.00 45.00 ? 69 GLU B CD 1 +ATOM 6208 O OE1 . GLU B 1 69 ? 12.473 -14.447 88.550 1.00 46.06 ? 69 GLU B OE1 1 +ATOM 6209 O OE2 . GLU B 1 69 ? 13.268 -14.116 90.565 1.00 45.65 ? 69 GLU B OE2 1 +ATOM 6210 N N . LYS B 1 70 ? 7.462 -17.053 90.558 1.00 36.95 ? 70 LYS B N 1 +ATOM 6211 C CA . LYS B 1 70 ? 6.204 -16.708 89.905 1.00 35.00 ? 70 LYS B CA 1 +ATOM 6212 C C . LYS B 1 70 ? 5.498 -15.561 90.624 1.00 34.04 ? 70 LYS B C 1 +ATOM 6213 O O . LYS B 1 70 ? 5.396 -15.548 91.857 1.00 33.78 ? 70 LYS B O 1 +ATOM 6214 C CB . LYS B 1 70 ? 5.277 -17.922 89.852 1.00 34.22 ? 70 LYS B CB 1 +ATOM 6215 C CG . LYS B 1 70 ? 5.813 -19.059 89.000 1.00 35.74 ? 70 LYS B CG 1 +ATOM 6216 C CD . LYS B 1 70 ? 6.086 -18.596 87.589 1.00 35.14 ? 70 LYS B CD 1 +ATOM 6217 C CE . LYS B 1 70 ? 6.608 -19.716 86.720 1.00 35.32 ? 70 LYS B CE 1 +ATOM 6218 N NZ . LYS B 1 70 ? 6.962 -19.195 85.367 1.00 38.35 ? 70 LYS B NZ 1 +ATOM 6219 N N . ALA B 1 71 ? 5.017 -14.592 89.855 1.00 31.35 ? 71 ALA B N 1 +ATOM 6220 C CA . ALA B 1 71 ? 4.317 -13.458 90.446 1.00 31.09 ? 71 ALA B CA 1 +ATOM 6221 C C . ALA B 1 71 ? 2.863 -13.844 90.735 1.00 30.81 ? 71 ALA B C 1 +ATOM 6222 O O . ALA B 1 71 ? 1.936 -13.145 90.338 1.00 32.38 ? 71 ALA B O 1 +ATOM 6223 C CB . ALA B 1 71 ? 4.377 -12.265 89.504 1.00 29.93 ? 71 ALA B CB 1 +ATOM 6224 N N . PHE B 1 72 ? 2.679 -14.965 91.426 1.00 30.51 ? 72 PHE B N 1 +ATOM 6225 C CA . PHE B 1 72 ? 1.354 -15.471 91.766 1.00 31.57 ? 72 PHE B CA 1 +ATOM 6226 C C . PHE B 1 72 ? 1.296 -16.064 93.172 1.00 33.50 ? 72 PHE B C 1 +ATOM 6227 O O . PHE B 1 72 ? 2.317 -16.226 93.844 1.00 33.79 ? 72 PHE B O 1 +ATOM 6228 C CB . PHE B 1 72 ? 0.932 -16.562 90.782 1.00 30.53 ? 72 PHE B CB 1 +ATOM 6229 C CG . PHE B 1 72 ? 0.696 -16.065 89.388 1.00 31.72 ? 72 PHE B CG 1 +ATOM 6230 C CD1 . PHE B 1 72 ? 1.762 -15.784 88.545 1.00 29.15 ? 72 PHE B CD1 1 +ATOM 6231 C CD2 . PHE B 1 72 ? -0.604 -15.848 88.930 1.00 31.85 ? 72 PHE B CD2 1 +ATOM 6232 C CE1 . PHE B 1 72 ? 1.542 -15.290 87.262 1.00 31.26 ? 72 PHE B CE1 1 +ATOM 6233 C CE2 . PHE B 1 72 ? -0.839 -15.352 87.648 1.00 31.69 ? 72 PHE B CE2 1 +ATOM 6234 C CZ . PHE B 1 72 ? 0.234 -15.072 86.812 1.00 32.27 ? 72 PHE B CZ 1 +ATOM 6235 N N . GLU B 1 73 ? 0.083 -16.390 93.602 1.00 34.33 ? 73 GLU B N 1 +ATOM 6236 C CA . GLU B 1 73 ? -0.140 -17.012 94.899 1.00 35.24 ? 73 GLU B CA 1 +ATOM 6237 C C . GLU B 1 73 ? 0.685 -18.309 94.962 1.00 35.60 ? 73 GLU B C 1 +ATOM 6238 O O . GLU B 1 73 ? 0.911 -18.959 93.938 1.00 34.22 ? 73 GLU B O 1 +ATOM 6239 C CB . GLU B 1 73 ? -1.631 -17.341 95.073 1.00 34.73 ? 73 GLU B CB 1 +ATOM 6240 C CG . GLU B 1 73 ? -2.556 -16.141 95.265 1.00 37.13 ? 73 GLU B CG 1 +ATOM 6241 C CD . GLU B 1 73 ? -2.697 -15.263 94.019 1.00 40.20 ? 73 GLU B CD 1 +ATOM 6242 O OE1 . GLU B 1 73 ? -2.513 -15.780 92.894 1.00 39.11 ? 73 GLU B OE1 1 +ATOM 6243 O OE2 . GLU B 1 73 ? -3.016 -14.057 94.166 1.00 40.85 ? 73 GLU B OE2 1 +ATOM 6244 N N . LEU B 1 74 ? 1.123 -18.684 96.162 1.00 36.52 ? 74 LEU B N 1 +ATOM 6245 C CA . LEU B 1 74 ? 1.921 -19.895 96.355 1.00 36.94 ? 74 LEU B CA 1 +ATOM 6246 C C . LEU B 1 74 ? 1.222 -21.181 95.901 1.00 37.84 ? 74 LEU B C 1 +ATOM 6247 O O . LEU B 1 74 ? 1.878 -22.101 95.409 1.00 37.52 ? 74 LEU B O 1 +ATOM 6248 C CB . LEU B 1 74 ? 2.357 -19.992 97.816 1.00 36.63 ? 74 LEU B CB 1 +ATOM 6249 C CG . LEU B 1 74 ? 3.771 -19.490 98.166 1.00 36.86 ? 74 LEU B CG 1 +ATOM 6250 C CD1 . LEU B 1 74 ? 4.340 -18.606 97.073 1.00 35.02 ? 74 LEU B CD1 1 +ATOM 6251 C CD2 . LEU B 1 74 ? 3.720 -18.762 99.498 1.00 34.95 ? 74 LEU B CD2 1 +ATOM 6252 N N . ASP B 1 75 ? -0.098 -21.263 96.069 1.00 38.92 ? 75 ASP B N 1 +ATOM 6253 C CA . ASP B 1 75 ? -0.823 -22.440 95.584 1.00 40.29 ? 75 ASP B CA 1 +ATOM 6254 C C . ASP B 1 75 ? -1.081 -22.061 94.123 1.00 39.22 ? 75 ASP B C 1 +ATOM 6255 O O . ASP B 1 75 ? -1.853 -21.145 93.854 1.00 40.16 ? 75 ASP B O 1 +ATOM 6256 C CB . ASP B 1 75 ? -2.152 -22.630 96.320 1.00 44.21 ? 75 ASP B CB 1 +ATOM 6257 C CG . ASP B 1 75 ? -2.787 -24.005 96.043 1.00 49.69 ? 75 ASP B CG 1 +ATOM 6258 O OD1 . ASP B 1 75 ? -2.772 -24.462 94.871 1.00 51.47 ? 75 ASP B OD1 1 +ATOM 6259 O OD2 . ASP B 1 75 ? -3.313 -24.626 96.997 1.00 52.05 ? 75 ASP B OD2 1 +ATOM 6260 N N . ARG B 1 76 ? -0.437 -22.771 93.198 1.00 37.10 ? 76 ARG B N 1 +ATOM 6261 C CA . ARG B 1 76 ? -0.505 -22.468 91.773 1.00 35.89 ? 76 ARG B CA 1 +ATOM 6262 C C . ARG B 1 76 ? -1.720 -22.845 90.921 1.00 36.20 ? 76 ARG B C 1 +ATOM 6263 O O . ARG B 1 76 ? -1.721 -22.586 89.721 1.00 37.25 ? 76 ARG B O 1 +ATOM 6264 C CB . ARG B 1 76 ? 0.742 -23.034 91.089 1.00 34.03 ? 76 ARG B CB 1 +ATOM 6265 C CG . ARG B 1 76 ? 2.050 -22.774 91.820 1.00 32.84 ? 76 ARG B CG 1 +ATOM 6266 C CD . ARG B 1 76 ? 2.339 -21.299 92.034 1.00 31.12 ? 76 ARG B CD 1 +ATOM 6267 N NE . ARG B 1 76 ? 3.764 -21.092 92.269 1.00 31.94 ? 76 ARG B NE 1 +ATOM 6268 C CZ . ARG B 1 76 ? 4.313 -19.964 92.707 1.00 31.49 ? 76 ARG B CZ 1 +ATOM 6269 N NH1 . ARG B 1 76 ? 3.559 -18.907 92.979 1.00 31.95 ? 76 ARG B NH1 1 +ATOM 6270 N NH2 . ARG B 1 76 ? 5.627 -19.889 92.854 1.00 31.07 ? 76 ARG B NH2 1 +ATOM 6271 N N . LYS B 1 77 ? -2.753 -23.431 91.503 1.00 36.76 ? 77 LYS B N 1 +ATOM 6272 C CA . LYS B 1 77 ? -3.913 -23.827 90.698 1.00 37.80 ? 77 LYS B CA 1 +ATOM 6273 C C . LYS B 1 77 ? -4.613 -22.707 89.919 1.00 36.92 ? 77 LYS B C 1 +ATOM 6274 O O . LYS B 1 77 ? -4.594 -21.544 90.314 1.00 36.91 ? 77 LYS B O 1 +ATOM 6275 C CB . LYS B 1 77 ? -4.935 -24.549 91.583 1.00 39.67 ? 77 LYS B CB 1 +ATOM 6276 C CG . LYS B 1 77 ? -4.406 -25.849 92.166 1.00 43.69 ? 77 LYS B CG 1 +ATOM 6277 C CD . LYS B 1 77 ? -5.239 -26.318 93.346 1.00 48.16 ? 77 LYS B CD 1 +ATOM 6278 C CE . LYS B 1 77 ? -6.602 -26.800 92.914 1.00 50.20 ? 77 LYS B CE 1 +ATOM 6279 N NZ . LYS B 1 77 ? -7.375 -27.287 94.088 1.00 54.20 ? 77 LYS B NZ 1 +ATOM 6280 N N . ARG B 1 78 ? -5.223 -23.090 88.800 1.00 35.88 ? 78 ARG B N 1 +ATOM 6281 C CA . ARG B 1 78 ? -5.982 -22.200 87.925 1.00 35.48 ? 78 ARG B CA 1 +ATOM 6282 C C . ARG B 1 78 ? -5.162 -21.184 87.147 1.00 35.24 ? 78 ARG B C 1 +ATOM 6283 O O . ARG B 1 78 ? -5.538 -20.016 87.043 1.00 34.65 ? 78 ARG B O 1 +ATOM 6284 C CB . ARG B 1 78 ? -7.065 -21.460 88.721 1.00 36.67 ? 78 ARG B CB 1 +ATOM 6285 C CG . ARG B 1 78 ? -7.823 -22.328 89.702 1.00 38.08 ? 78 ARG B CG 1 +ATOM 6286 C CD . ARG B 1 78 ? -8.325 -23.622 89.068 1.00 39.33 ? 78 ARG B CD 1 +ATOM 6287 N NE . ARG B 1 78 ? -8.858 -24.519 90.094 1.00 40.89 ? 78 ARG B NE 1 +ATOM 6288 C CZ . ARG B 1 78 ? -9.051 -25.822 89.923 1.00 40.86 ? 78 ARG B CZ 1 +ATOM 6289 N NH1 . ARG B 1 78 ? -8.756 -26.396 88.759 1.00 40.77 ? 78 ARG B NH1 1 +ATOM 6290 N NH2 . ARG B 1 78 ? -9.538 -26.552 90.917 1.00 41.89 ? 78 ARG B NH2 1 +ATOM 6291 N N . LYS B 1 79 ? -4.051 -21.633 86.584 1.00 35.05 ? 79 LYS B N 1 +ATOM 6292 C CA . LYS B 1 79 ? -3.199 -20.753 85.815 1.00 34.72 ? 79 LYS B CA 1 +ATOM 6293 C C . LYS B 1 79 ? -2.334 -21.583 84.880 1.00 34.97 ? 79 LYS B C 1 +ATOM 6294 O O . LYS B 1 79 ? -1.970 -22.713 85.202 1.00 35.43 ? 79 LYS B O 1 +ATOM 6295 C CB . LYS B 1 79 ? -2.307 -19.933 86.750 1.00 37.45 ? 79 LYS B CB 1 +ATOM 6296 C CG . LYS B 1 79 ? -1.563 -18.814 86.041 1.00 42.10 ? 79 LYS B CG 1 +ATOM 6297 C CD . LYS B 1 79 ? -2.557 -17.778 85.517 1.00 46.02 ? 79 LYS B CD 1 +ATOM 6298 C CE . LYS B 1 79 ? -1.916 -16.815 84.522 1.00 48.69 ? 79 LYS B CE 1 +ATOM 6299 N NZ . LYS B 1 79 ? -2.893 -15.767 84.063 1.00 50.79 ? 79 LYS B NZ 1 +ATOM 6300 N N . ARG B 1 80 ? -2.012 -21.017 83.723 1.00 33.55 ? 80 ARG B N 1 +ATOM 6301 C CA . ARG B 1 80 ? -1.179 -21.671 82.720 1.00 31.78 ? 80 ARG B CA 1 +ATOM 6302 C C . ARG B 1 80 ? 0.185 -20.986 82.803 1.00 31.53 ? 80 ARG B C 1 +ATOM 6303 O O . ARG B 1 80 ? 0.324 -19.857 82.363 1.00 31.76 ? 80 ARG B O 1 +ATOM 6304 C CB A ARG B 1 80 ? -1.804 -21.475 81.333 0.50 31.33 ? 80 ARG B CB 1 +ATOM 6305 C CB B ARG B 1 80 ? -1.769 -21.443 81.326 0.50 30.58 ? 80 ARG B CB 1 +ATOM 6306 C CG A ARG B 1 80 ? -1.130 -22.237 80.190 0.50 31.53 ? 80 ARG B CG 1 +ATOM 6307 C CG B ARG B 1 80 ? -0.816 -21.752 80.165 0.50 29.72 ? 80 ARG B CG 1 +ATOM 6308 C CD A ARG B 1 80 ? -1.833 -21.945 78.868 0.50 30.72 ? 80 ARG B CD 1 +ATOM 6309 C CD B ARG B 1 80 ? -1.437 -21.356 78.835 0.50 28.47 ? 80 ARG B CD 1 +ATOM 6310 N NE A ARG B 1 80 ? -1.217 -22.600 77.714 0.50 30.14 ? 80 ARG B NE 1 +ATOM 6311 N NE B ARG B 1 80 ? -0.839 -22.040 77.689 0.50 28.13 ? 80 ARG B NE 1 +ATOM 6312 C CZ A ARG B 1 80 ? -1.300 -23.900 77.448 0.50 30.78 ? 80 ARG B CZ 1 +ATOM 6313 C CZ B ARG B 1 80 ? 0.236 -21.622 77.027 0.50 28.14 ? 80 ARG B CZ 1 +ATOM 6314 N NH1 A ARG B 1 80 ? -1.977 -24.705 78.257 0.50 29.81 ? 80 ARG B NH1 1 +ATOM 6315 N NH1 B ARG B 1 80 ? 0.854 -20.505 77.389 0.50 27.93 ? 80 ARG B NH1 1 +ATOM 6316 N NH2 A ARG B 1 80 ? -0.705 -24.398 76.365 0.50 30.59 ? 80 ARG B NH2 1 +ATOM 6317 N NH2 B ARG B 1 80 ? 0.684 -22.320 75.991 0.50 27.40 ? 80 ARG B NH2 1 +ATOM 6318 N N . TYR B 1 81 ? 1.185 -21.651 83.371 1.00 31.97 ? 81 TYR B N 1 +ATOM 6319 C CA . TYR B 1 81 ? 2.509 -21.047 83.493 1.00 31.39 ? 81 TYR B CA 1 +ATOM 6320 C C . TYR B 1 81 ? 3.455 -21.380 82.360 1.00 32.26 ? 81 TYR B C 1 +ATOM 6321 O O . TYR B 1 81 ? 3.442 -22.482 81.826 1.00 34.44 ? 81 TYR B O 1 +ATOM 6322 C CB . TYR B 1 81 ? 3.176 -21.457 84.806 1.00 30.96 ? 81 TYR B CB 1 +ATOM 6323 C CG . TYR B 1 81 ? 2.342 -21.166 86.027 1.00 31.17 ? 81 TYR B CG 1 +ATOM 6324 C CD1 . TYR B 1 81 ? 1.362 -22.058 86.445 1.00 28.52 ? 81 TYR B CD1 1 +ATOM 6325 C CD2 . TYR B 1 81 ? 2.514 -19.982 86.746 1.00 31.20 ? 81 TYR B CD2 1 +ATOM 6326 C CE1 . TYR B 1 81 ? 0.569 -21.787 87.551 1.00 28.99 ? 81 TYR B CE1 1 +ATOM 6327 C CE2 . TYR B 1 81 ? 1.728 -19.700 87.857 1.00 31.53 ? 81 TYR B CE2 1 +ATOM 6328 C CZ . TYR B 1 81 ? 0.756 -20.614 88.252 1.00 30.00 ? 81 TYR B CZ 1 +ATOM 6329 O OH . TYR B 1 81 ? -0.021 -20.361 89.353 1.00 31.51 ? 81 TYR B OH 1 +ATOM 6330 N N . VAL B 1 82 ? 4.291 -20.416 82.006 1.00 33.04 ? 82 VAL B N 1 +ATOM 6331 C CA . VAL B 1 82 ? 5.278 -20.605 80.953 1.00 35.21 ? 82 VAL B CA 1 +ATOM 6332 C C . VAL B 1 82 ? 6.661 -20.524 81.593 1.00 35.28 ? 82 VAL B C 1 +ATOM 6333 O O . VAL B 1 82 ? 6.931 -19.611 82.372 1.00 34.93 ? 82 VAL B O 1 +ATOM 6334 C CB . VAL B 1 82 ? 5.154 -19.496 79.869 1.00 37.35 ? 82 VAL B CB 1 +ATOM 6335 C CG1 . VAL B 1 82 ? 6.297 -19.594 78.883 1.00 37.49 ? 82 VAL B CG1 1 +ATOM 6336 C CG2 . VAL B 1 82 ? 3.827 -19.616 79.150 1.00 35.34 ? 82 VAL B CG2 1 +ATOM 6337 N N . MET B 1 83 ? 7.526 -21.486 81.293 1.00 36.87 ? 83 MET B N 1 +ATOM 6338 C CA . MET B 1 83 ? 8.879 -21.470 81.850 1.00 37.15 ? 83 MET B CA 1 +ATOM 6339 C C . MET B 1 83 ? 9.828 -21.011 80.750 1.00 36.34 ? 83 MET B C 1 +ATOM 6340 O O . MET B 1 83 ? 10.264 -21.810 79.927 1.00 36.08 ? 83 MET B O 1 +ATOM 6341 C CB . MET B 1 83 ? 9.297 -22.865 82.326 1.00 39.97 ? 83 MET B CB 1 +ATOM 6342 C CG . MET B 1 83 ? 8.358 -23.514 83.337 1.00 46.54 ? 83 MET B CG 1 +ATOM 6343 S SD . MET B 1 83 ? 8.163 -22.594 84.885 1.00 54.40 ? 83 MET B SD 1 +ATOM 6344 C CE . MET B 1 83 ? 9.766 -22.853 85.599 1.00 51.92 ? 83 MET B CE 1 +ATOM 6345 N N . TYR B 1 84 ? 10.143 -19.722 80.736 1.00 35.46 ? 84 TYR B N 1 +ATOM 6346 C CA . TYR B 1 84 ? 11.029 -19.172 79.724 1.00 34.33 ? 84 TYR B CA 1 +ATOM 6347 C C . TYR B 1 84 ? 11.683 -17.920 80.285 1.00 33.71 ? 84 TYR B C 1 +ATOM 6348 O O . TYR B 1 84 ? 11.034 -16.877 80.392 1.00 34.30 ? 84 TYR B O 1 +ATOM 6349 C CB . TYR B 1 84 ? 10.222 -18.824 78.462 1.00 35.90 ? 84 TYR B CB 1 +ATOM 6350 C CG . TYR B 1 84 ? 10.999 -18.949 77.171 1.00 36.56 ? 84 TYR B CG 1 +ATOM 6351 C CD1 . TYR B 1 84 ? 11.600 -20.153 76.822 1.00 36.61 ? 84 TYR B CD1 1 +ATOM 6352 C CD2 . TYR B 1 84 ? 11.123 -17.869 76.295 1.00 37.24 ? 84 TYR B CD2 1 +ATOM 6353 C CE1 . TYR B 1 84 ? 12.307 -20.285 75.635 1.00 39.48 ? 84 TYR B CE1 1 +ATOM 6354 C CE2 . TYR B 1 84 ? 11.829 -17.989 75.101 1.00 37.90 ? 84 TYR B CE2 1 +ATOM 6355 C CZ . TYR B 1 84 ? 12.420 -19.200 74.781 1.00 39.28 ? 84 TYR B CZ 1 +ATOM 6356 O OH . TYR B 1 84 ? 13.149 -19.326 73.623 1.00 42.79 ? 84 TYR B OH 1 +ATOM 6357 N N . ASN B 1 85 ? 12.960 -18.024 80.644 1.00 32.65 ? 85 ASN B N 1 +ATOM 6358 C CA . ASN B 1 85 ? 13.690 -16.888 81.211 1.00 33.05 ? 85 ASN B CA 1 +ATOM 6359 C C . ASN B 1 85 ? 13.507 -15.654 80.346 1.00 33.34 ? 85 ASN B C 1 +ATOM 6360 O O . ASN B 1 85 ? 13.761 -15.695 79.144 1.00 33.06 ? 85 ASN B O 1 +ATOM 6361 C CB . ASN B 1 85 ? 15.189 -17.184 81.299 1.00 33.24 ? 85 ASN B CB 1 +ATOM 6362 C CG . ASN B 1 85 ? 15.518 -18.296 82.275 1.00 33.38 ? 85 ASN B CG 1 +ATOM 6363 O OD1 . ASN B 1 85 ? 14.640 -18.870 82.925 1.00 30.80 ? 85 ASN B OD1 1 +ATOM 6364 N ND2 . ASN B 1 85 ? 16.803 -18.604 82.381 1.00 34.97 ? 85 ASN B ND2 1 +ATOM 6365 N N . VAL B 1 86 ? 13.086 -14.553 80.956 1.00 32.54 ? 86 VAL B N 1 +ATOM 6366 C CA . VAL B 1 86 ? 12.893 -13.330 80.204 1.00 32.87 ? 86 VAL B CA 1 +ATOM 6367 C C . VAL B 1 86 ? 13.138 -12.090 81.061 1.00 34.61 ? 86 VAL B C 1 +ATOM 6368 O O . VAL B 1 86 ? 12.867 -12.090 82.268 1.00 34.54 ? 86 VAL B O 1 +ATOM 6369 C CB . VAL B 1 86 ? 11.452 -13.260 79.623 1.00 34.07 ? 86 VAL B CB 1 +ATOM 6370 C CG1 . VAL B 1 86 ? 10.448 -12.956 80.721 1.00 32.36 ? 86 VAL B CG1 1 +ATOM 6371 C CG2 . VAL B 1 86 ? 11.383 -12.201 78.547 1.00 34.98 ? 86 VAL B CG2 1 +ATOM 6372 N N . ASP B 1 87 ? 13.669 -11.042 80.433 1.00 34.83 ? 87 ASP B N 1 +ATOM 6373 C CA . ASP B 1 87 ? 13.904 -9.777 81.119 1.00 35.18 ? 87 ASP B CA 1 +ATOM 6374 C C . ASP B 1 87 ? 12.505 -9.184 81.311 1.00 34.33 ? 87 ASP B C 1 +ATOM 6375 O O . ASP B 1 87 ? 11.928 -8.636 80.374 1.00 34.93 ? 87 ASP B O 1 +ATOM 6376 C CB . ASP B 1 87 ? 14.741 -8.858 80.241 1.00 36.12 ? 87 ASP B CB 1 +ATOM 6377 C CG . ASP B 1 87 ? 14.991 -7.526 80.888 1.00 39.61 ? 87 ASP B CG 1 +ATOM 6378 O OD1 . ASP B 1 87 ? 14.023 -6.917 81.387 1.00 42.51 ? 87 ASP B OD1 1 +ATOM 6379 O OD2 . ASP B 1 87 ? 16.155 -7.078 80.899 1.00 44.24 ? 87 ASP B OD2 1 +ATOM 6380 N N . ALA B 1 88 ? 11.967 -9.295 82.520 1.00 33.54 ? 88 ALA B N 1 +ATOM 6381 C CA . ALA B 1 88 ? 10.612 -8.834 82.802 1.00 34.63 ? 88 ALA B CA 1 +ATOM 6382 C C . ALA B 1 88 ? 10.393 -7.325 82.869 1.00 34.99 ? 88 ALA B C 1 +ATOM 6383 O O . ALA B 1 88 ? 9.245 -6.868 82.900 1.00 35.68 ? 88 ALA B O 1 +ATOM 6384 C CB . ALA B 1 88 ? 10.106 -9.495 84.089 1.00 32.97 ? 88 ALA B CB 1 +ATOM 6385 N N . GLY B 1 89 ? 11.477 -6.554 82.877 1.00 35.29 ? 89 GLY B N 1 +ATOM 6386 C CA . GLY B 1 89 ? 11.348 -5.109 82.957 1.00 34.13 ? 89 GLY B CA 1 +ATOM 6387 C C . GLY B 1 89 ? 10.733 -4.724 84.290 1.00 35.57 ? 89 GLY B C 1 +ATOM 6388 O O . GLY B 1 89 ? 11.020 -5.350 85.311 1.00 36.87 ? 89 GLY B O 1 +ATOM 6389 N N . ALA B 1 90 ? 9.881 -3.704 84.289 1.00 34.49 ? 90 ALA B N 1 +ATOM 6390 C CA . ALA B 1 90 ? 9.232 -3.257 85.515 1.00 34.30 ? 90 ALA B CA 1 +ATOM 6391 C C . ALA B 1 90 ? 8.002 -4.133 85.734 1.00 34.71 ? 90 ALA B C 1 +ATOM 6392 O O . ALA B 1 90 ? 6.867 -3.688 85.569 1.00 35.54 ? 90 ALA B O 1 +ATOM 6393 C CB . ALA B 1 90 ? 8.832 -1.789 85.387 1.00 31.61 ? 90 ALA B CB 1 +ATOM 6394 N N . TYR B 1 91 ? 8.238 -5.384 86.113 1.00 34.44 ? 91 TYR B N 1 +ATOM 6395 C CA . TYR B 1 91 ? 7.159 -6.340 86.307 1.00 33.33 ? 91 TYR B CA 1 +ATOM 6396 C C . TYR B 1 91 ? 6.155 -5.970 87.379 1.00 34.69 ? 91 TYR B C 1 +ATOM 6397 O O . TYR B 1 91 ? 6.479 -5.288 88.350 1.00 34.18 ? 91 TYR B O 1 +ATOM 6398 C CB . TYR B 1 91 ? 7.737 -7.727 86.602 1.00 32.67 ? 91 TYR B CB 1 +ATOM 6399 C CG . TYR B 1 91 ? 8.498 -7.841 87.910 1.00 30.51 ? 91 TYR B CG 1 +ATOM 6400 C CD1 . TYR B 1 91 ? 7.831 -8.112 89.107 1.00 29.11 ? 91 TYR B CD1 1 +ATOM 6401 C CD2 . TYR B 1 91 ? 9.890 -7.692 87.944 1.00 30.68 ? 91 TYR B CD2 1 +ATOM 6402 C CE1 . TYR B 1 91 ? 8.533 -8.240 90.318 1.00 30.97 ? 91 TYR B CE1 1 +ATOM 6403 C CE2 . TYR B 1 91 ? 10.601 -7.817 89.143 1.00 32.61 ? 91 TYR B CE2 1 +ATOM 6404 C CZ . TYR B 1 91 ? 9.915 -8.092 90.323 1.00 31.77 ? 91 TYR B CZ 1 +ATOM 6405 O OH . TYR B 1 91 ? 10.622 -8.227 91.492 1.00 34.52 ? 91 TYR B OH 1 +ATOM 6406 N N . LYS B 1 92 ? 4.930 -6.449 87.186 1.00 35.70 ? 92 LYS B N 1 +ATOM 6407 C CA . LYS B 1 92 ? 3.826 -6.212 88.108 1.00 36.67 ? 92 LYS B CA 1 +ATOM 6408 C C . LYS B 1 92 ? 3.304 -7.583 88.492 1.00 35.62 ? 92 LYS B C 1 +ATOM 6409 O O . LYS B 1 92 ? 3.734 -8.595 87.926 1.00 33.12 ? 92 LYS B O 1 +ATOM 6410 C CB . LYS B 1 92 ? 2.717 -5.421 87.411 1.00 40.61 ? 92 LYS B CB 1 +ATOM 6411 C CG . LYS B 1 92 ? 3.188 -4.108 86.786 1.00 45.18 ? 92 LYS B CG 1 +ATOM 6412 C CD . LYS B 1 92 ? 2.077 -3.452 85.978 1.00 49.13 ? 92 LYS B CD 1 +ATOM 6413 C CE . LYS B 1 92 ? 2.576 -2.198 85.277 1.00 52.28 ? 92 LYS B CE 1 +ATOM 6414 N NZ . LYS B 1 92 ? 1.515 -1.582 84.429 1.00 54.54 ? 92 LYS B NZ 1 +ATOM 6415 N N . LYS B 1 93 ? 2.372 -7.639 89.437 1.00 34.07 ? 93 LYS B N 1 +ATOM 6416 C CA . LYS B 1 93 ? 1.873 -8.941 89.816 1.00 33.41 ? 93 LYS B CA 1 +ATOM 6417 C C . LYS B 1 93 ? 1.072 -9.567 88.689 1.00 33.12 ? 93 LYS B C 1 +ATOM 6418 O O . LYS B 1 93 ? 0.488 -8.864 87.853 1.00 31.01 ? 93 LYS B O 1 +ATOM 6419 C CB . LYS B 1 93 ? 1.070 -8.883 91.119 1.00 34.38 ? 93 LYS B CB 1 +ATOM 6420 C CG . LYS B 1 93 ? -0.234 -8.148 91.096 1.00 35.74 ? 93 LYS B CG 1 +ATOM 6421 C CD . LYS B 1 93 ? -0.950 -8.447 92.402 1.00 38.18 ? 93 LYS B CD 1 +ATOM 6422 C CE . LYS B 1 93 ? -2.279 -7.733 92.519 1.00 40.09 ? 93 LYS B CE 1 +ATOM 6423 N NZ . LYS B 1 93 ? -2.961 -8.095 93.803 1.00 40.58 ? 93 LYS B NZ 1 +ATOM 6424 N N . TYR B 1 94 ? 1.097 -10.899 88.659 1.00 31.89 ? 94 TYR B N 1 +ATOM 6425 C CA . TYR B 1 94 ? 0.420 -11.701 87.649 1.00 30.66 ? 94 TYR B CA 1 +ATOM 6426 C C . TYR B 1 94 ? 1.103 -11.637 86.290 1.00 31.22 ? 94 TYR B C 1 +ATOM 6427 O O . TYR B 1 94 ? 0.555 -12.068 85.289 1.00 33.29 ? 94 TYR B O 1 +ATOM 6428 C CB . TYR B 1 94 ? -1.065 -11.322 87.542 1.00 28.28 ? 94 TYR B CB 1 +ATOM 6429 C CG . TYR B 1 94 ? -1.806 -11.518 88.843 1.00 28.32 ? 94 TYR B CG 1 +ATOM 6430 C CD1 . TYR B 1 94 ? -1.439 -12.530 89.726 1.00 29.39 ? 94 TYR B CD1 1 +ATOM 6431 C CD2 . TYR B 1 94 ? -2.863 -10.694 89.200 1.00 28.84 ? 94 TYR B CD2 1 +ATOM 6432 C CE1 . TYR B 1 94 ? -2.104 -12.713 90.934 1.00 30.44 ? 94 TYR B CE1 1 +ATOM 6433 C CE2 . TYR B 1 94 ? -3.537 -10.870 90.404 1.00 30.77 ? 94 TYR B CE2 1 +ATOM 6434 C CZ . TYR B 1 94 ? -3.153 -11.881 91.267 1.00 30.12 ? 94 TYR B CZ 1 +ATOM 6435 O OH . TYR B 1 94 ? -3.820 -12.064 92.455 1.00 31.83 ? 94 TYR B OH 1 +ATOM 6436 N N . GLN B 1 95 ? 2.311 -11.099 86.249 1.00 32.60 ? 95 GLN B N 1 +ATOM 6437 C CA . GLN B 1 95 ? 3.059 -11.075 84.999 1.00 32.67 ? 95 GLN B CA 1 +ATOM 6438 C C . GLN B 1 95 ? 3.848 -12.396 84.941 1.00 34.26 ? 95 GLN B C 1 +ATOM 6439 O O . GLN B 1 95 ? 4.401 -12.846 85.954 1.00 33.60 ? 95 GLN B O 1 +ATOM 6440 C CB . GLN B 1 95 ? 4.026 -9.901 84.977 1.00 33.38 ? 95 GLN B CB 1 +ATOM 6441 C CG . GLN B 1 95 ? 4.760 -9.765 83.659 1.00 33.81 ? 95 GLN B CG 1 +ATOM 6442 C CD . GLN B 1 95 ? 5.618 -8.520 83.603 1.00 33.68 ? 95 GLN B CD 1 +ATOM 6443 O OE1 . GLN B 1 95 ? 5.215 -7.457 84.071 1.00 35.70 ? 95 GLN B OE1 1 +ATOM 6444 N NE2 . GLN B 1 95 ? 6.800 -8.639 83.015 1.00 33.78 ? 95 GLN B NE2 1 +ATOM 6445 N N . ASP B 1 96 ? 3.909 -13.007 83.762 1.00 35.26 ? 96 ASP B N 1 +ATOM 6446 C CA . ASP B 1 96 ? 4.593 -14.286 83.576 1.00 35.46 ? 96 ASP B CA 1 +ATOM 6447 C C . ASP B 1 96 ? 5.036 -14.319 82.120 1.00 36.05 ? 96 ASP B C 1 +ATOM 6448 O O . ASP B 1 96 ? 4.333 -13.815 81.248 1.00 36.16 ? 96 ASP B O 1 +ATOM 6449 C CB . ASP B 1 96 ? 3.606 -15.427 83.864 1.00 38.53 ? 96 ASP B CB 1 +ATOM 6450 C CG . ASP B 1 96 ? 4.255 -16.814 83.853 1.00 42.13 ? 96 ASP B CG 1 +ATOM 6451 O OD1 . ASP B 1 96 ? 5.224 -17.046 84.609 1.00 45.08 ? 96 ASP B OD1 1 +ATOM 6452 O OD2 . ASP B 1 96 ? 3.774 -17.690 83.099 1.00 44.26 ? 96 ASP B OD2 1 +ATOM 6453 N N . PRO B 1 97 ? 6.224 -14.876 81.837 1.00 35.43 ? 97 PRO B N 1 +ATOM 6454 C CA . PRO B 1 97 ? 7.153 -15.453 82.807 1.00 34.23 ? 97 PRO B CA 1 +ATOM 6455 C C . PRO B 1 97 ? 8.088 -14.373 83.335 1.00 34.57 ? 97 PRO B C 1 +ATOM 6456 O O . PRO B 1 97 ? 8.008 -13.225 82.913 1.00 34.31 ? 97 PRO B O 1 +ATOM 6457 C CB . PRO B 1 97 ? 7.886 -16.491 81.976 1.00 34.29 ? 97 PRO B CB 1 +ATOM 6458 C CG . PRO B 1 97 ? 8.048 -15.775 80.668 1.00 35.28 ? 97 PRO B CG 1 +ATOM 6459 C CD . PRO B 1 97 ? 6.694 -15.114 80.458 1.00 34.39 ? 97 PRO B CD 1 +ATOM 6460 N N . LEU B 1 98 ? 8.967 -14.748 84.258 1.00 34.69 ? 98 LEU B N 1 +ATOM 6461 C CA . LEU B 1 98 ? 9.928 -13.816 84.823 1.00 33.90 ? 98 LEU B CA 1 +ATOM 6462 C C . LEU B 1 98 ? 11.355 -14.277 84.506 1.00 34.90 ? 98 LEU B C 1 +ATOM 6463 O O . LEU B 1 98 ? 11.576 -14.968 83.509 1.00 34.40 ? 98 LEU B O 1 +ATOM 6464 C CB . LEU B 1 98 ? 9.710 -13.678 86.330 1.00 35.58 ? 98 LEU B CB 1 +ATOM 6465 C CG . LEU B 1 98 ? 8.328 -13.137 86.737 1.00 35.52 ? 98 LEU B CG 1 +ATOM 6466 C CD1 . LEU B 1 98 ? 8.207 -13.130 88.245 1.00 36.36 ? 98 LEU B CD1 1 +ATOM 6467 C CD2 . LEU B 1 98 ? 8.133 -11.730 86.192 1.00 34.41 ? 98 LEU B CD2 1 +ATOM 6468 N N . TYR B 1 99 ? 12.314 -13.916 85.354 1.00 33.59 ? 99 TYR B N 1 +ATOM 6469 C CA . TYR B 1 99 ? 13.722 -14.229 85.113 1.00 32.49 ? 99 TYR B CA 1 +ATOM 6470 C C . TYR B 1 99 ? 14.198 -15.668 85.317 1.00 33.48 ? 99 TYR B C 1 +ATOM 6471 O O . TYR B 1 99 ? 15.113 -16.129 84.630 1.00 33.63 ? 99 TYR B O 1 +ATOM 6472 C CB . TYR B 1 99 ? 14.600 -13.344 85.994 1.00 33.13 ? 99 TYR B CB 1 +ATOM 6473 C CG . TYR B 1 99 ? 14.224 -11.886 86.039 1.00 33.44 ? 99 TYR B CG 1 +ATOM 6474 C CD1 . TYR B 1 99 ? 14.651 -10.998 85.047 1.00 32.75 ? 99 TYR B CD1 1 +ATOM 6475 C CD2 . TYR B 1 99 ? 13.484 -11.377 87.107 1.00 33.55 ? 99 TYR B CD2 1 +ATOM 6476 C CE1 . TYR B 1 99 ? 14.357 -9.633 85.123 1.00 32.56 ? 99 TYR B CE1 1 +ATOM 6477 C CE2 . TYR B 1 99 ? 13.184 -10.017 87.195 1.00 33.28 ? 99 TYR B CE2 1 +ATOM 6478 C CZ . TYR B 1 99 ? 13.628 -9.150 86.202 1.00 34.62 ? 99 TYR B CZ 1 +ATOM 6479 O OH . TYR B 1 99 ? 13.370 -7.795 86.307 1.00 37.50 ? 99 TYR B OH 1 +ATOM 6480 N N . VAL B 1 100 ? 13.596 -16.372 86.266 1.00 33.47 ? 100 VAL B N 1 +ATOM 6481 C CA . VAL B 1 100 ? 14.035 -17.722 86.592 1.00 33.53 ? 100 VAL B CA 1 +ATOM 6482 C C . VAL B 1 100 ? 13.049 -18.820 86.237 1.00 34.39 ? 100 VAL B C 1 +ATOM 6483 O O . VAL B 1 100 ? 11.843 -18.652 86.402 1.00 35.18 ? 100 VAL B O 1 +ATOM 6484 C CB . VAL B 1 100 ? 14.353 -17.828 88.115 1.00 31.66 ? 100 VAL B CB 1 +ATOM 6485 C CG1 . VAL B 1 100 ? 14.819 -19.228 88.455 1.00 32.34 ? 100 VAL B CG1 1 +ATOM 6486 C CG2 . VAL B 1 100 ? 15.415 -16.819 88.491 1.00 30.60 ? 100 VAL B CG2 1 +ATOM 6487 N N . SER B 1 101 ? 13.581 -19.957 85.787 1.00 35.09 ? 101 SER B N 1 +ATOM 6488 C CA . SER B 1 101 ? 12.758 -21.102 85.415 1.00 36.42 ? 101 SER B CA 1 +ATOM 6489 C C . SER B 1 101 ? 13.144 -22.405 86.115 1.00 36.40 ? 101 SER B C 1 +ATOM 6490 O O . SER B 1 101 ? 14.109 -23.054 85.718 1.00 38.79 ? 101 SER B O 1 +ATOM 6491 C CB . SER B 1 101 ? 12.828 -21.337 83.904 1.00 36.85 ? 101 SER B CB 1 +ATOM 6492 O OG . SER B 1 101 ? 12.301 -20.237 83.181 1.00 40.88 ? 101 SER B OG 1 +ATOM 6493 N N . ILE B 1 102 ? 12.395 -22.785 87.149 1.00 34.50 ? 102 ILE B N 1 +ATOM 6494 C CA . ILE B 1 102 ? 12.633 -24.046 87.857 1.00 33.69 ? 102 ILE B CA 1 +ATOM 6495 C C . ILE B 1 102 ? 11.409 -24.928 87.536 1.00 32.60 ? 102 ILE B C 1 +ATOM 6496 O O . ILE B 1 102 ? 10.363 -24.785 88.154 1.00 32.64 ? 102 ILE B O 1 +ATOM 6497 C CB . ILE B 1 102 ? 12.700 -23.853 89.396 1.00 33.70 ? 102 ILE B CB 1 +ATOM 6498 C CG1 . ILE B 1 102 ? 13.592 -22.660 89.767 1.00 34.69 ? 102 ILE B CG1 1 +ATOM 6499 C CG2 . ILE B 1 102 ? 13.236 -25.120 90.039 1.00 33.82 ? 102 ILE B CG2 1 +ATOM 6500 C CD1 . ILE B 1 102 ? 15.059 -22.849 89.483 1.00 34.32 ? 102 ILE B CD1 1 +ATOM 6501 N N . PRO B 1 103 ? 11.529 -25.849 86.563 1.00 33.27 ? 103 PRO B N 1 +ATOM 6502 C CA . PRO B 1 103 ? 10.442 -26.749 86.144 1.00 33.43 ? 103 PRO B CA 1 +ATOM 6503 C C . PRO B 1 103 ? 10.112 -27.844 87.155 1.00 35.53 ? 103 PRO B C 1 +ATOM 6504 O O . PRO B 1 103 ? 10.050 -29.031 86.807 1.00 36.40 ? 103 PRO B O 1 +ATOM 6505 C CB . PRO B 1 103 ? 10.959 -27.351 84.839 1.00 32.73 ? 103 PRO B CB 1 +ATOM 6506 C CG . PRO B 1 103 ? 12.221 -26.568 84.517 1.00 34.45 ? 103 PRO B CG 1 +ATOM 6507 C CD . PRO B 1 103 ? 12.764 -26.172 85.837 1.00 32.95 ? 103 PRO B CD 1 +ATOM 6508 N N . LEU B 1 104 ? 9.895 -27.442 88.401 1.00 35.29 ? 104 LEU B N 1 +ATOM 6509 C CA . LEU B 1 104 ? 9.587 -28.376 89.470 1.00 34.34 ? 104 LEU B CA 1 +ATOM 6510 C C . LEU B 1 104 ? 8.322 -27.963 90.193 1.00 35.87 ? 104 LEU B C 1 +ATOM 6511 O O . LEU B 1 104 ? 8.150 -26.785 90.525 1.00 37.38 ? 104 LEU B O 1 +ATOM 6512 C CB . LEU B 1 104 ? 10.730 -28.399 90.489 1.00 33.98 ? 104 LEU B CB 1 +ATOM 6513 C CG . LEU B 1 104 ? 10.397 -28.929 91.896 1.00 34.96 ? 104 LEU B CG 1 +ATOM 6514 C CD1 . LEU B 1 104 ? 10.164 -30.433 91.833 1.00 34.34 ? 104 LEU B CD1 1 +ATOM 6515 C CD2 . LEU B 1 104 ? 11.544 -28.608 92.872 1.00 34.62 ? 104 LEU B CD2 1 +ATOM 6516 N N . PHE B 1 105 ? 7.426 -28.913 90.430 1.00 34.70 ? 105 PHE B N 1 +ATOM 6517 C CA . PHE B 1 105 ? 6.240 -28.593 91.192 1.00 34.44 ? 105 PHE B CA 1 +ATOM 6518 C C . PHE B 1 105 ? 5.964 -29.733 92.141 1.00 35.04 ? 105 PHE B C 1 +ATOM 6519 O O . PHE B 1 105 ? 6.277 -30.883 91.853 1.00 36.37 ? 105 PHE B O 1 +ATOM 6520 C CB . PHE B 1 105 ? 5.039 -28.272 90.283 1.00 34.48 ? 105 PHE B CB 1 +ATOM 6521 C CG . PHE B 1 105 ? 4.341 -29.465 89.697 1.00 33.74 ? 105 PHE B CG 1 +ATOM 6522 C CD1 . PHE B 1 105 ? 3.431 -30.202 90.453 1.00 32.85 ? 105 PHE B CD1 1 +ATOM 6523 C CD2 . PHE B 1 105 ? 4.516 -29.794 88.356 1.00 33.13 ? 105 PHE B CD2 1 +ATOM 6524 C CE1 . PHE B 1 105 ? 2.699 -31.247 89.875 1.00 31.87 ? 105 PHE B CE1 1 +ATOM 6525 C CE2 . PHE B 1 105 ? 3.789 -30.836 87.776 1.00 33.14 ? 105 PHE B CE2 1 +ATOM 6526 C CZ . PHE B 1 105 ? 2.880 -31.560 88.538 1.00 30.86 ? 105 PHE B CZ 1 +ATOM 6527 N N . ILE B 1 106 ? 5.425 -29.402 93.304 1.00 34.79 ? 106 ILE B N 1 +ATOM 6528 C CA . ILE B 1 106 ? 5.130 -30.406 94.294 1.00 35.20 ? 106 ILE B CA 1 +ATOM 6529 C C . ILE B 1 106 ? 3.638 -30.463 94.525 1.00 37.08 ? 106 ILE B C 1 +ATOM 6530 O O . ILE B 1 106 ? 2.973 -29.435 94.672 1.00 36.86 ? 106 ILE B O 1 +ATOM 6531 C CB . ILE B 1 106 ? 5.836 -30.098 95.630 1.00 35.68 ? 106 ILE B CB 1 +ATOM 6532 C CG1 . ILE B 1 106 ? 7.357 -30.089 95.426 1.00 35.93 ? 106 ILE B CG1 1 +ATOM 6533 C CG2 . ILE B 1 106 ? 5.459 -31.138 96.661 1.00 35.28 ? 106 ILE B CG2 1 +ATOM 6534 C CD1 . ILE B 1 106 ? 8.137 -29.628 96.634 1.00 34.87 ? 106 ILE B CD1 1 +ATOM 6535 N N . SER B 1 107 ? 3.116 -31.682 94.536 1.00 37.87 ? 107 SER B N 1 +ATOM 6536 C CA . SER B 1 107 ? 1.706 -31.905 94.766 1.00 37.81 ? 107 SER B CA 1 +ATOM 6537 C C . SER B 1 107 ? 1.526 -32.398 96.195 1.00 39.00 ? 107 SER B C 1 +ATOM 6538 O O . SER B 1 107 ? 2.287 -33.244 96.662 1.00 39.29 ? 107 SER B O 1 +ATOM 6539 C CB . SER B 1 107 ? 1.183 -32.956 93.796 1.00 37.72 ? 107 SER B CB 1 +ATOM 6540 O OG . SER B 1 107 ? -0.075 -33.451 94.227 1.00 39.44 ? 107 SER B OG 1 +ATOM 6541 N N . VAL B 1 108 ? 0.544 -31.850 96.897 1.00 39.60 ? 108 VAL B N 1 +ATOM 6542 C CA . VAL B 1 108 ? 0.268 -32.281 98.256 1.00 40.62 ? 108 VAL B CA 1 +ATOM 6543 C C . VAL B 1 108 ? -1.186 -32.702 98.260 1.00 42.78 ? 108 VAL B C 1 +ATOM 6544 O O . VAL B 1 108 ? -2.092 -31.869 98.179 1.00 43.39 ? 108 VAL B O 1 +ATOM 6545 C CB . VAL B 1 108 ? 0.480 -31.158 99.283 1.00 40.90 ? 108 VAL B CB 1 +ATOM 6546 C CG1 . VAL B 1 108 ? 0.291 -31.716 100.692 1.00 39.68 ? 108 VAL B CG1 1 +ATOM 6547 C CG2 . VAL B 1 108 ? 1.870 -30.566 99.127 1.00 37.49 ? 108 VAL B CG2 1 +ATOM 6548 N N . LYS B 1 109 ? -1.399 -34.009 98.325 1.00 44.68 ? 109 LYS B N 1 +ATOM 6549 C CA . LYS B 1 109 ? -2.734 -34.575 98.310 1.00 46.85 ? 109 LYS B CA 1 +ATOM 6550 C C . LYS B 1 109 ? -2.902 -35.446 99.554 1.00 48.29 ? 109 LYS B C 1 +ATOM 6551 O O . LYS B 1 109 ? -2.043 -36.277 99.868 1.00 48.15 ? 109 LYS B O 1 +ATOM 6552 C CB . LYS B 1 109 ? -2.912 -35.392 97.031 1.00 47.24 ? 109 LYS B CB 1 +ATOM 6553 C CG . LYS B 1 109 ? -4.318 -35.897 96.806 1.00 51.84 ? 109 LYS B CG 1 +ATOM 6554 C CD . LYS B 1 109 ? -4.492 -36.452 95.393 1.00 53.28 ? 109 LYS B CD 1 +ATOM 6555 C CE . LYS B 1 109 ? -3.517 -37.576 95.093 1.00 55.15 ? 109 LYS B CE 1 +ATOM 6556 N NZ . LYS B 1 109 ? -3.855 -38.254 93.811 1.00 56.21 ? 109 LYS B NZ 1 +ATOM 6557 N N . ASP B 1 110 ? -4.002 -35.237 100.272 1.00 49.45 ? 110 ASP B N 1 +ATOM 6558 C CA . ASP B 1 110 ? -4.258 -35.988 101.495 1.00 50.30 ? 110 ASP B CA 1 +ATOM 6559 C C . ASP B 1 110 ? -3.068 -35.852 102.448 1.00 49.01 ? 110 ASP B C 1 +ATOM 6560 O O . ASP B 1 110 ? -2.714 -36.798 103.151 1.00 50.17 ? 110 ASP B O 1 +ATOM 6561 C CB . ASP B 1 110 ? -4.502 -37.468 101.175 1.00 53.61 ? 110 ASP B CB 1 +ATOM 6562 C CG . ASP B 1 110 ? -5.722 -37.686 100.274 1.00 58.04 ? 110 ASP B CG 1 +ATOM 6563 O OD1 . ASP B 1 110 ? -6.815 -37.163 100.607 1.00 58.78 ? 110 ASP B OD1 1 +ATOM 6564 O OD2 . ASP B 1 110 ? -5.590 -38.388 99.238 1.00 60.06 ? 110 ASP B OD2 1 +ATOM 6565 N N . GLY B 1 111 ? -2.451 -34.672 102.456 1.00 46.81 ? 111 GLY B N 1 +ATOM 6566 C CA . GLY B 1 111 ? -1.314 -34.424 103.327 1.00 43.83 ? 111 GLY B CA 1 +ATOM 6567 C C . GLY B 1 111 ? 0.011 -35.008 102.861 1.00 43.32 ? 111 GLY B C 1 +ATOM 6568 O O . GLY B 1 111 ? 1.036 -34.776 103.501 1.00 43.39 ? 111 GLY B O 1 +ATOM 6569 N N . VAL B 1 112 ? 0.002 -35.746 101.751 1.00 40.49 ? 112 VAL B N 1 +ATOM 6570 C CA . VAL B 1 112 ? 1.216 -36.362 101.238 1.00 39.37 ? 112 VAL B CA 1 +ATOM 6571 C C . VAL B 1 112 ? 1.778 -35.594 100.054 1.00 39.98 ? 112 VAL B C 1 +ATOM 6572 O O . VAL B 1 112 ? 1.051 -35.278 99.110 1.00 40.68 ? 112 VAL B O 1 +ATOM 6573 C CB . VAL B 1 112 ? 0.952 -37.831 100.812 1.00 39.91 ? 112 VAL B CB 1 +ATOM 6574 C CG1 . VAL B 1 112 ? 2.213 -38.445 100.213 1.00 37.31 ? 112 VAL B CG1 1 +ATOM 6575 C CG2 . VAL B 1 112 ? 0.479 -38.638 102.011 1.00 38.82 ? 112 VAL B CG2 1 +ATOM 6576 N N . ALA B 1 113 ? 3.078 -35.317 100.095 1.00 38.85 ? 113 ALA B N 1 +ATOM 6577 C CA . ALA B 1 113 ? 3.733 -34.572 99.031 1.00 38.34 ? 113 ALA B CA 1 +ATOM 6578 C C . ALA B 1 113 ? 4.479 -35.455 98.041 1.00 39.22 ? 113 ALA B C 1 +ATOM 6579 O O . ALA B 1 113 ? 5.077 -36.465 98.416 1.00 40.54 ? 113 ALA B O 1 +ATOM 6580 C CB . ALA B 1 113 ? 4.691 -33.547 99.629 1.00 36.83 ? 113 ALA B CB 1 +ATOM 6581 N N . THR B 1 114 ? 4.439 -35.058 96.773 1.00 39.00 ? 114 THR B N 1 +ATOM 6582 C CA . THR B 1 114 ? 5.115 -35.770 95.695 1.00 38.38 ? 114 THR B CA 1 +ATOM 6583 C C . THR B 1 114 ? 5.664 -34.721 94.741 1.00 38.92 ? 114 THR B C 1 +ATOM 6584 O O . THR B 1 114 ? 4.966 -33.773 94.389 1.00 39.52 ? 114 THR B O 1 +ATOM 6585 C CB . THR B 1 114 ? 4.142 -36.665 94.917 1.00 39.43 ? 114 THR B CB 1 +ATOM 6586 O OG1 . THR B 1 114 ? 3.449 -37.520 95.837 1.00 40.07 ? 114 THR B OG1 1 +ATOM 6587 C CG2 . THR B 1 114 ? 4.896 -37.505 93.878 1.00 36.03 ? 114 THR B CG2 1 +ATOM 6588 N N . GLY B 1 115 ? 6.913 -34.884 94.327 1.00 39.23 ? 115 GLY B N 1 +ATOM 6589 C CA . GLY B 1 115 ? 7.507 -33.918 93.426 1.00 38.76 ? 115 GLY B CA 1 +ATOM 6590 C C . GLY B 1 115 ? 7.569 -34.361 91.977 1.00 38.55 ? 115 GLY B C 1 +ATOM 6591 O O . GLY B 1 115 ? 7.632 -35.547 91.685 1.00 38.65 ? 115 GLY B O 1 +ATOM 6592 N N . TYR B 1 116 ? 7.543 -33.391 91.067 1.00 38.95 ? 116 TYR B N 1 +ATOM 6593 C CA . TYR B 1 116 ? 7.616 -33.656 89.635 1.00 36.69 ? 116 TYR B CA 1 +ATOM 6594 C C . TYR B 1 116 ? 8.571 -32.651 89.027 1.00 35.80 ? 116 TYR B C 1 +ATOM 6595 O O . TYR B 1 116 ? 8.287 -31.463 88.980 1.00 36.51 ? 116 TYR B O 1 +ATOM 6596 C CB . TYR B 1 116 ? 6.240 -33.523 88.995 1.00 37.09 ? 116 TYR B CB 1 +ATOM 6597 C CG . TYR B 1 116 ? 5.231 -34.479 89.567 1.00 37.30 ? 116 TYR B CG 1 +ATOM 6598 C CD1 . TYR B 1 116 ? 4.532 -34.168 90.728 1.00 37.12 ? 116 TYR B CD1 1 +ATOM 6599 C CD2 . TYR B 1 116 ? 5.005 -35.725 88.969 1.00 38.75 ? 116 TYR B CD2 1 +ATOM 6600 C CE1 . TYR B 1 116 ? 3.628 -35.075 91.288 1.00 38.19 ? 116 TYR B CE1 1 +ATOM 6601 C CE2 . TYR B 1 116 ? 4.106 -36.636 89.518 1.00 38.14 ? 116 TYR B CE2 1 +ATOM 6602 C CZ . TYR B 1 116 ? 3.423 -36.302 90.677 1.00 38.61 ? 116 TYR B CZ 1 +ATOM 6603 O OH . TYR B 1 116 ? 2.537 -37.193 91.227 1.00 41.75 ? 116 TYR B OH 1 +ATOM 6604 N N . PHE B 1 117 ? 9.714 -33.139 88.572 1.00 34.91 ? 117 PHE B N 1 +ATOM 6605 C CA . PHE B 1 117 ? 10.734 -32.291 87.989 1.00 33.65 ? 117 PHE B CA 1 +ATOM 6606 C C . PHE B 1 117 ? 10.967 -32.658 86.534 1.00 33.33 ? 117 PHE B C 1 +ATOM 6607 O O . PHE B 1 117 ? 11.368 -33.770 86.236 1.00 34.67 ? 117 PHE B O 1 +ATOM 6608 C CB . PHE B 1 117 ? 12.015 -32.444 88.810 1.00 33.41 ? 117 PHE B CB 1 +ATOM 6609 C CG . PHE B 1 117 ? 13.235 -31.873 88.160 1.00 33.95 ? 117 PHE B CG 1 +ATOM 6610 C CD1 . PHE B 1 117 ? 13.213 -30.596 87.599 1.00 34.31 ? 117 PHE B CD1 1 +ATOM 6611 C CD2 . PHE B 1 117 ? 14.421 -32.603 88.132 1.00 33.18 ? 117 PHE B CD2 1 +ATOM 6612 C CE1 . PHE B 1 117 ? 14.360 -30.052 87.013 1.00 34.34 ? 117 PHE B CE1 1 +ATOM 6613 C CE2 . PHE B 1 117 ? 15.581 -32.070 87.551 1.00 33.96 ? 117 PHE B CE2 1 +ATOM 6614 C CZ . PHE B 1 117 ? 15.549 -30.792 86.989 1.00 34.78 ? 117 PHE B CZ 1 +ATOM 6615 N N . PHE B 1 118 ? 10.709 -31.723 85.625 1.00 33.48 ? 118 PHE B N 1 +ATOM 6616 C CA . PHE B 1 118 ? 10.903 -31.986 84.205 1.00 33.48 ? 118 PHE B CA 1 +ATOM 6617 C C . PHE B 1 118 ? 12.204 -31.348 83.769 1.00 35.13 ? 118 PHE B C 1 +ATOM 6618 O O . PHE B 1 118 ? 12.302 -30.133 83.673 1.00 36.89 ? 118 PHE B O 1 +ATOM 6619 C CB . PHE B 1 118 ? 9.723 -31.443 83.399 1.00 32.18 ? 118 PHE B CB 1 +ATOM 6620 C CG . PHE B 1 118 ? 8.409 -32.038 83.796 1.00 30.14 ? 118 PHE B CG 1 +ATOM 6621 C CD1 . PHE B 1 118 ? 7.789 -31.653 84.976 1.00 30.90 ? 118 PHE B CD1 1 +ATOM 6622 C CD2 . PHE B 1 118 ? 7.820 -33.028 83.018 1.00 30.81 ? 118 PHE B CD2 1 +ATOM 6623 C CE1 . PHE B 1 118 ? 6.599 -32.250 85.383 1.00 32.35 ? 118 PHE B CE1 1 +ATOM 6624 C CE2 . PHE B 1 118 ? 6.636 -33.636 83.407 1.00 30.65 ? 118 PHE B CE2 1 +ATOM 6625 C CZ . PHE B 1 118 ? 6.022 -33.248 84.594 1.00 32.72 ? 118 PHE B CZ 1 +ATOM 6626 N N . ASN B 1 119 ? 13.212 -32.175 83.511 1.00 36.70 ? 119 ASN B N 1 +ATOM 6627 C CA . ASN B 1 119 ? 14.514 -31.662 83.131 1.00 36.71 ? 119 ASN B CA 1 +ATOM 6628 C C . ASN B 1 119 ? 14.632 -31.208 81.680 1.00 37.42 ? 119 ASN B C 1 +ATOM 6629 O O . ASN B 1 119 ? 15.331 -31.821 80.873 1.00 37.09 ? 119 ASN B O 1 +ATOM 6630 C CB . ASN B 1 119 ? 15.602 -32.688 83.455 1.00 36.12 ? 119 ASN B CB 1 +ATOM 6631 C CG . ASN B 1 119 ? 17.005 -32.110 83.314 1.00 37.84 ? 119 ASN B CG 1 +ATOM 6632 O OD1 . ASN B 1 119 ? 17.208 -30.899 83.439 1.00 36.20 ? 119 ASN B OD1 1 +ATOM 6633 N ND2 . ASN B 1 119 ? 17.981 -32.976 83.071 1.00 37.53 ? 119 ASN B ND2 1 +ATOM 6634 N N . SER B 1 120 ? 13.940 -30.116 81.363 1.00 37.82 ? 120 SER B N 1 +ATOM 6635 C CA . SER B 1 120 ? 13.977 -29.512 80.035 1.00 35.27 ? 120 SER B CA 1 +ATOM 6636 C C . SER B 1 120 ? 14.102 -28.007 80.233 1.00 33.68 ? 120 SER B C 1 +ATOM 6637 O O . SER B 1 120 ? 13.386 -27.422 81.035 1.00 34.18 ? 120 SER B O 1 +ATOM 6638 C CB . SER B 1 120 ? 12.700 -29.823 79.265 1.00 36.44 ? 120 SER B CB 1 +ATOM 6639 O OG . SER B 1 120 ? 12.721 -29.186 78.000 1.00 37.19 ? 120 SER B OG 1 +ATOM 6640 N N . ALA B 1 121 ? 15.024 -27.384 79.516 1.00 33.97 ? 121 ALA B N 1 +ATOM 6641 C CA . ALA B 1 121 ? 15.230 -25.946 79.631 1.00 33.97 ? 121 ALA B CA 1 +ATOM 6642 C C . ALA B 1 121 ? 14.548 -25.199 78.473 1.00 34.97 ? 121 ALA B C 1 +ATOM 6643 O O . ALA B 1 121 ? 14.857 -24.034 78.190 1.00 34.32 ? 121 ALA B O 1 +ATOM 6644 C CB . ALA B 1 121 ? 16.712 -25.646 79.650 1.00 33.09 ? 121 ALA B CB 1 +ATOM 6645 N N . SER B 1 122 ? 13.629 -25.887 77.799 1.00 34.05 ? 122 SER B N 1 +ATOM 6646 C CA . SER B 1 122 ? 12.893 -25.296 76.692 1.00 33.66 ? 122 SER B CA 1 +ATOM 6647 C C . SER B 1 122 ? 11.673 -24.591 77.276 1.00 33.43 ? 122 SER B C 1 +ATOM 6648 O O . SER B 1 122 ? 11.494 -24.565 78.495 1.00 30.95 ? 122 SER B O 1 +ATOM 6649 C CB . SER B 1 122 ? 12.448 -26.383 75.717 1.00 34.25 ? 122 SER B CB 1 +ATOM 6650 O OG . SER B 1 122 ? 11.547 -27.276 76.347 1.00 36.21 ? 122 SER B OG 1 +ATOM 6651 N N . LYS B 1 123 ? 10.835 -24.025 76.412 1.00 34.61 ? 123 LYS B N 1 +ATOM 6652 C CA . LYS B 1 123 ? 9.645 -23.311 76.876 1.00 35.07 ? 123 LYS B CA 1 +ATOM 6653 C C . LYS B 1 123 ? 8.554 -24.269 77.360 1.00 34.12 ? 123 LYS B C 1 +ATOM 6654 O O . LYS B 1 123 ? 7.566 -24.503 76.674 1.00 35.19 ? 123 LYS B O 1 +ATOM 6655 C CB . LYS B 1 123 ? 9.100 -22.399 75.769 1.00 34.33 ? 123 LYS B CB 1 +ATOM 6656 C CG . LYS B 1 123 ? 7.899 -21.574 76.214 1.00 38.50 ? 123 LYS B CG 1 +ATOM 6657 C CD . LYS B 1 123 ? 7.324 -20.711 75.096 1.00 40.93 ? 123 LYS B CD 1 +ATOM 6658 C CE . LYS B 1 123 ? 8.211 -19.522 74.796 1.00 45.22 ? 123 LYS B CE 1 +ATOM 6659 N NZ . LYS B 1 123 ? 7.543 -18.566 73.861 1.00 49.19 ? 123 LYS B NZ 1 +ATOM 6660 N N . VAL B 1 124 ? 8.745 -24.811 78.556 1.00 34.26 ? 124 VAL B N 1 +ATOM 6661 C CA . VAL B 1 124 ? 7.794 -25.743 79.153 1.00 34.13 ? 124 VAL B CA 1 +ATOM 6662 C C . VAL B 1 124 ? 6.540 -25.050 79.682 1.00 33.66 ? 124 VAL B C 1 +ATOM 6663 O O . VAL B 1 124 ? 6.627 -24.021 80.356 1.00 33.37 ? 124 VAL B O 1 +ATOM 6664 C CB . VAL B 1 124 ? 8.443 -26.518 80.322 1.00 33.24 ? 124 VAL B CB 1 +ATOM 6665 C CG1 . VAL B 1 124 ? 7.415 -27.444 80.971 1.00 32.19 ? 124 VAL B CG1 1 +ATOM 6666 C CG2 . VAL B 1 124 ? 9.637 -27.315 79.811 1.00 33.85 ? 124 VAL B CG2 1 +ATOM 6667 N N . ILE B 1 125 ? 5.381 -25.635 79.392 1.00 32.89 ? 125 ILE B N 1 +ATOM 6668 C CA . ILE B 1 125 ? 4.109 -25.080 79.843 1.00 33.36 ? 125 ILE B CA 1 +ATOM 6669 C C . ILE B 1 125 ? 3.486 -25.911 80.953 1.00 34.05 ? 125 ILE B C 1 +ATOM 6670 O O . ILE B 1 125 ? 3.310 -27.113 80.795 1.00 34.79 ? 125 ILE B O 1 +ATOM 6671 C CB . ILE B 1 125 ? 3.071 -25.033 78.703 1.00 34.90 ? 125 ILE B CB 1 +ATOM 6672 C CG1 . ILE B 1 125 ? 3.682 -24.381 77.454 1.00 33.98 ? 125 ILE B CG1 1 +ATOM 6673 C CG2 . ILE B 1 125 ? 1.811 -24.287 79.180 1.00 31.41 ? 125 ILE B CG2 1 +ATOM 6674 C CD1 . ILE B 1 125 ? 4.205 -22.983 77.688 1.00 34.60 ? 125 ILE B CD1 1 +ATOM 6675 N N . PHE B 1 126 ? 3.156 -25.277 82.073 1.00 34.22 ? 126 PHE B N 1 +ATOM 6676 C CA . PHE B 1 126 ? 2.508 -25.983 83.167 1.00 34.94 ? 126 PHE B CA 1 +ATOM 6677 C C . PHE B 1 126 ? 1.086 -25.464 83.274 1.00 36.27 ? 126 PHE B C 1 +ATOM 6678 O O . PHE B 1 126 ? 0.843 -24.396 83.839 1.00 38.05 ? 126 PHE B O 1 +ATOM 6679 C CB . PHE B 1 126 ? 3.221 -25.756 84.504 1.00 34.40 ? 126 PHE B CB 1 +ATOM 6680 C CG . PHE B 1 126 ? 4.524 -26.480 84.631 1.00 35.01 ? 126 PHE B CG 1 +ATOM 6681 C CD1 . PHE B 1 126 ? 5.692 -25.947 84.093 1.00 34.42 ? 126 PHE B CD1 1 +ATOM 6682 C CD2 . PHE B 1 126 ? 4.586 -27.695 85.290 1.00 33.76 ? 126 PHE B CD2 1 +ATOM 6683 C CE1 . PHE B 1 126 ? 6.902 -26.622 84.219 1.00 36.71 ? 126 PHE B CE1 1 +ATOM 6684 C CE2 . PHE B 1 126 ? 5.792 -28.378 85.418 1.00 34.87 ? 126 PHE B CE2 1 +ATOM 6685 C CZ . PHE B 1 126 ? 6.951 -27.846 84.886 1.00 34.06 ? 126 PHE B CZ 1 +ATOM 6686 N N . ASP B 1 127 ? 0.144 -26.211 82.719 1.00 36.52 ? 127 ASP B N 1 +ATOM 6687 C CA . ASP B 1 127 ? -1.250 -25.814 82.786 1.00 37.86 ? 127 ASP B CA 1 +ATOM 6688 C C . ASP B 1 127 ? -1.850 -26.472 84.023 1.00 37.01 ? 127 ASP B C 1 +ATOM 6689 O O . ASP B 1 127 ? -2.247 -27.635 83.995 1.00 39.54 ? 127 ASP B O 1 +ATOM 6690 C CB . ASP B 1 127 ? -1.975 -26.265 81.528 1.00 41.26 ? 127 ASP B CB 1 +ATOM 6691 C CG . ASP B 1 127 ? -3.345 -25.654 81.413 1.00 47.06 ? 127 ASP B CG 1 +ATOM 6692 O OD1 . ASP B 1 127 ? -4.171 -25.935 82.309 1.00 49.41 ? 127 ASP B OD1 1 +ATOM 6693 O OD2 . ASP B 1 127 ? -3.593 -24.891 80.442 1.00 49.23 ? 127 ASP B OD2 1 +ATOM 6694 N N . VAL B 1 128 ? -1.912 -25.720 85.112 1.00 35.41 ? 128 VAL B N 1 +ATOM 6695 C CA . VAL B 1 128 ? -2.406 -26.243 86.378 1.00 33.62 ? 128 VAL B CA 1 +ATOM 6696 C C . VAL B 1 128 ? -3.899 -26.043 86.615 1.00 33.89 ? 128 VAL B C 1 +ATOM 6697 O O . VAL B 1 128 ? -4.312 -25.079 87.251 1.00 34.41 ? 128 VAL B O 1 +ATOM 6698 C CB . VAL B 1 128 ? -1.600 -25.620 87.552 1.00 32.31 ? 128 VAL B CB 1 +ATOM 6699 C CG1 . VAL B 1 128 ? -1.912 -26.325 88.861 1.00 32.41 ? 128 VAL B CG1 1 +ATOM 6700 C CG2 . VAL B 1 128 ? -0.123 -25.705 87.249 1.00 30.76 ? 128 VAL B CG2 1 +ATOM 6701 N N . GLY B 1 129 ? -4.702 -26.971 86.105 1.00 35.09 ? 129 GLY B N 1 +ATOM 6702 C CA . GLY B 1 129 ? -6.139 -26.903 86.292 1.00 36.18 ? 129 GLY B CA 1 +ATOM 6703 C C . GLY B 1 129 ? -6.812 -25.734 85.607 1.00 37.35 ? 129 GLY B C 1 +ATOM 6704 O O . GLY B 1 129 ? -7.788 -25.191 86.120 1.00 38.02 ? 129 GLY B O 1 +ATOM 6705 N N . LEU B 1 130 ? -6.299 -25.358 84.440 1.00 39.02 ? 130 LEU B N 1 +ATOM 6706 C CA . LEU B 1 130 ? -6.837 -24.244 83.663 1.00 39.69 ? 130 LEU B CA 1 +ATOM 6707 C C . LEU B 1 130 ? -7.486 -24.787 82.384 1.00 40.49 ? 130 LEU B C 1 +ATOM 6708 O O . LEU B 1 130 ? -8.665 -24.533 82.125 1.00 41.12 ? 130 LEU B O 1 +ATOM 6709 C CB . LEU B 1 130 ? -5.704 -23.256 83.336 1.00 40.09 ? 130 LEU B CB 1 +ATOM 6710 C CG . LEU B 1 130 ? -5.973 -21.795 82.919 1.00 40.67 ? 130 LEU B CG 1 +ATOM 6711 C CD1 . LEU B 1 130 ? -5.968 -21.656 81.416 1.00 38.82 ? 130 LEU B CD1 1 +ATOM 6712 C CD2 . LEU B 1 130 ? -7.284 -21.319 83.520 1.00 38.67 ? 130 LEU B CD2 1 +ATOM 6713 N N . GLU B 1 131 ? -6.726 -25.540 81.592 1.00 40.28 ? 131 GLU B N 1 +ATOM 6714 C CA . GLU B 1 131 ? -7.260 -26.130 80.371 1.00 41.59 ? 131 GLU B CA 1 +ATOM 6715 C C . GLU B 1 131 ? -8.344 -27.127 80.796 1.00 42.49 ? 131 GLU B C 1 +ATOM 6716 O O . GLU B 1 131 ? -9.453 -27.147 80.251 1.00 41.39 ? 131 GLU B O 1 +ATOM 6717 C CB . GLU B 1 131 ? -6.159 -26.853 79.612 1.00 43.76 ? 131 GLU B CB 1 +ATOM 6718 C CG . GLU B 1 131 ? -6.565 -27.326 78.227 1.00 48.36 ? 131 GLU B CG 1 +ATOM 6719 C CD . GLU B 1 131 ? -5.460 -28.125 77.551 1.00 52.38 ? 131 GLU B CD 1 +ATOM 6720 O OE1 . GLU B 1 131 ? -4.324 -27.605 77.455 1.00 55.13 ? 131 GLU B OE1 1 +ATOM 6721 O OE2 . GLU B 1 131 ? -5.724 -29.272 77.120 1.00 54.17 ? 131 GLU B OE2 1 +ATOM 6722 N N . GLU B 1 132 ? -8.007 -27.959 81.776 1.00 41.83 ? 132 GLU B N 1 +ATOM 6723 C CA . GLU B 1 132 ? -8.944 -28.926 82.316 1.00 40.35 ? 132 GLU B CA 1 +ATOM 6724 C C . GLU B 1 132 ? -8.926 -28.722 83.828 1.00 39.57 ? 132 GLU B C 1 +ATOM 6725 O O . GLU B 1 132 ? -7.912 -28.944 84.480 1.00 38.78 ? 132 GLU B O 1 +ATOM 6726 C CB . GLU B 1 132 ? -8.529 -30.356 81.960 1.00 41.15 ? 132 GLU B CB 1 +ATOM 6727 C CG . GLU B 1 132 ? -8.675 -30.724 80.482 1.00 44.53 ? 132 GLU B CG 1 +ATOM 6728 C CD . GLU B 1 132 ? -10.083 -30.468 79.913 1.00 47.37 ? 132 GLU B CD 1 +ATOM 6729 O OE1 . GLU B 1 132 ? -11.093 -30.758 80.592 1.00 49.73 ? 132 GLU B OE1 1 +ATOM 6730 O OE2 . GLU B 1 132 ? -10.185 -29.985 78.767 1.00 48.40 ? 132 GLU B OE2 1 +ATOM 6731 N N . TYR B 1 133 ? -10.057 -28.279 84.365 1.00 38.50 ? 133 TYR B N 1 +ATOM 6732 C CA . TYR B 1 133 ? -10.221 -28.003 85.787 1.00 38.73 ? 133 TYR B CA 1 +ATOM 6733 C C . TYR B 1 133 ? -9.708 -29.102 86.729 1.00 38.60 ? 133 TYR B C 1 +ATOM 6734 O O . TYR B 1 133 ? -9.261 -28.810 87.835 1.00 38.67 ? 133 TYR B O 1 +ATOM 6735 C CB . TYR B 1 133 ? -11.706 -27.745 86.071 1.00 39.06 ? 133 TYR B CB 1 +ATOM 6736 C CG . TYR B 1 133 ? -12.010 -27.188 87.448 1.00 39.03 ? 133 TYR B CG 1 +ATOM 6737 C CD1 . TYR B 1 133 ? -11.876 -25.823 87.713 1.00 38.65 ? 133 TYR B CD1 1 +ATOM 6738 C CD2 . TYR B 1 133 ? -12.432 -28.023 88.486 1.00 39.22 ? 133 TYR B CD2 1 +ATOM 6739 C CE1 . TYR B 1 133 ? -12.155 -25.299 88.975 1.00 38.63 ? 133 TYR B CE1 1 +ATOM 6740 C CE2 . TYR B 1 133 ? -12.714 -27.515 89.753 1.00 39.98 ? 133 TYR B CE2 1 +ATOM 6741 C CZ . TYR B 1 133 ? -12.574 -26.151 89.991 1.00 41.28 ? 133 TYR B CZ 1 +ATOM 6742 O OH . TYR B 1 133 ? -12.862 -25.644 91.241 1.00 42.76 ? 133 TYR B OH 1 +ATOM 6743 N N . ASP B 1 134 ? -9.768 -30.356 86.288 1.00 38.98 ? 134 ASP B N 1 +ATOM 6744 C CA . ASP B 1 134 ? -9.353 -31.491 87.113 1.00 38.85 ? 134 ASP B CA 1 +ATOM 6745 C C . ASP B 1 134 ? -8.055 -32.141 86.657 1.00 38.88 ? 134 ASP B C 1 +ATOM 6746 O O . ASP B 1 134 ? -7.822 -33.325 86.925 1.00 36.87 ? 134 ASP B O 1 +ATOM 6747 C CB . ASP B 1 134 ? -10.461 -32.541 87.115 1.00 40.05 ? 134 ASP B CB 1 +ATOM 6748 C CG . ASP B 1 134 ? -10.686 -33.147 85.742 1.00 42.97 ? 134 ASP B CG 1 +ATOM 6749 O OD1 . ASP B 1 134 ? -10.558 -32.410 84.738 1.00 45.25 ? 134 ASP B OD1 1 +ATOM 6750 O OD2 . ASP B 1 134 ? -10.996 -34.357 85.662 1.00 46.03 ? 134 ASP B OD2 1 +ATOM 6751 N N . LYS B 1 135 ? -7.211 -31.371 85.979 1.00 38.26 ? 135 LYS B N 1 +ATOM 6752 C CA . LYS B 1 135 ? -5.946 -31.892 85.491 1.00 38.62 ? 135 LYS B CA 1 +ATOM 6753 C C . LYS B 1 135 ? -4.797 -30.909 85.515 1.00 37.98 ? 135 LYS B C 1 +ATOM 6754 O O . LYS B 1 135 ? -4.984 -29.693 85.481 1.00 37.93 ? 135 LYS B O 1 +ATOM 6755 C CB . LYS B 1 135 ? -6.098 -32.390 84.055 1.00 41.48 ? 135 LYS B CB 1 +ATOM 6756 C CG . LYS B 1 135 ? -6.765 -33.741 83.923 1.00 45.37 ? 135 LYS B CG 1 +ATOM 6757 C CD . LYS B 1 135 ? -7.024 -34.076 82.463 1.00 48.89 ? 135 LYS B CD 1 +ATOM 6758 C CE . LYS B 1 135 ? -7.436 -35.537 82.315 1.00 52.18 ? 135 LYS B CE 1 +ATOM 6759 N NZ . LYS B 1 135 ? -8.403 -35.931 83.381 1.00 53.73 ? 135 LYS B NZ 1 +ATOM 6760 N N . VAL B 1 136 ? -3.598 -31.467 85.589 1.00 36.76 ? 136 VAL B N 1 +ATOM 6761 C CA . VAL B 1 136 ? -2.375 -30.700 85.544 1.00 35.26 ? 136 VAL B CA 1 +ATOM 6762 C C . VAL B 1 136 ? -1.762 -31.221 84.255 1.00 35.56 ? 136 VAL B C 1 +ATOM 6763 O O . VAL B 1 136 ? -1.418 -32.395 84.159 1.00 36.41 ? 136 VAL B O 1 +ATOM 6764 C CB . VAL B 1 136 ? -1.425 -31.024 86.699 1.00 34.18 ? 136 VAL B CB 1 +ATOM 6765 C CG1 . VAL B 1 136 ? -0.129 -30.245 86.524 1.00 32.64 ? 136 VAL B CG1 1 +ATOM 6766 C CG2 . VAL B 1 136 ? -2.074 -30.679 88.015 1.00 33.41 ? 136 VAL B CG2 1 +ATOM 6767 N N . ILE B 1 137 ? -1.657 -30.361 83.252 1.00 34.98 ? 137 ILE B N 1 +ATOM 6768 C CA . ILE B 1 137 ? -1.093 -30.768 81.979 1.00 33.42 ? 137 ILE B CA 1 +ATOM 6769 C C . ILE B 1 137 ? 0.243 -30.070 81.757 1.00 33.24 ? 137 ILE B C 1 +ATOM 6770 O O . ILE B 1 137 ? 0.335 -28.851 81.825 1.00 33.65 ? 137 ILE B O 1 +ATOM 6771 C CB . ILE B 1 137 ? -2.056 -30.424 80.836 1.00 32.74 ? 137 ILE B CB 1 +ATOM 6772 C CG1 . ILE B 1 137 ? -3.415 -31.085 81.096 1.00 33.75 ? 137 ILE B CG1 1 +ATOM 6773 C CG2 . ILE B 1 137 ? -1.489 -30.907 79.509 1.00 32.06 ? 137 ILE B CG2 1 +ATOM 6774 C CD1 . ILE B 1 137 ? -4.500 -30.686 80.114 1.00 30.98 ? 137 ILE B CD1 1 +ATOM 6775 N N . VAL B 1 138 ? 1.285 -30.852 81.511 1.00 33.34 ? 138 VAL B N 1 +ATOM 6776 C CA . VAL B 1 138 ? 2.608 -30.293 81.279 1.00 33.39 ? 138 VAL B CA 1 +ATOM 6777 C C . VAL B 1 138 ? 2.987 -30.569 79.836 1.00 35.13 ? 138 VAL B C 1 +ATOM 6778 O O . VAL B 1 138 ? 2.958 -31.717 79.390 1.00 37.17 ? 138 VAL B O 1 +ATOM 6779 C CB . VAL B 1 138 ? 3.656 -30.931 82.206 1.00 32.88 ? 138 VAL B CB 1 +ATOM 6780 C CG1 . VAL B 1 138 ? 5.038 -30.361 81.904 1.00 31.87 ? 138 VAL B CG1 1 +ATOM 6781 C CG2 . VAL B 1 138 ? 3.278 -30.684 83.657 1.00 31.35 ? 138 VAL B CG2 1 +ATOM 6782 N N . THR B 1 139 ? 3.333 -29.518 79.103 1.00 35.14 ? 139 THR B N 1 +ATOM 6783 C CA . THR B 1 139 ? 3.713 -29.656 77.707 1.00 35.99 ? 139 THR B CA 1 +ATOM 6784 C C . THR B 1 139 ? 5.166 -29.279 77.524 1.00 35.58 ? 139 THR B C 1 +ATOM 6785 O O . THR B 1 139 ? 5.552 -28.168 77.848 1.00 36.99 ? 139 THR B O 1 +ATOM 6786 C CB . THR B 1 139 ? 2.870 -28.731 76.802 1.00 36.34 ? 139 THR B CB 1 +ATOM 6787 O OG1 . THR B 1 139 ? 1.481 -28.959 77.050 1.00 38.63 ? 139 THR B OG1 1 +ATOM 6788 C CG2 . THR B 1 139 ? 3.148 -29.020 75.334 1.00 35.97 ? 139 THR B CG2 1 +ATOM 6789 N N . ILE B 1 140 ? 5.972 -30.207 77.021 1.00 37.63 ? 140 ILE B N 1 +ATOM 6790 C CA . ILE B 1 140 ? 7.388 -29.935 76.775 1.00 38.18 ? 140 ILE B CA 1 +ATOM 6791 C C . ILE B 1 140 ? 7.553 -29.865 75.266 1.00 39.07 ? 140 ILE B C 1 +ATOM 6792 O O . ILE B 1 140 ? 7.285 -30.836 74.557 1.00 37.93 ? 140 ILE B O 1 +ATOM 6793 C CB . ILE B 1 140 ? 8.321 -31.051 77.316 1.00 37.95 ? 140 ILE B CB 1 +ATOM 6794 C CG1 . ILE B 1 140 ? 8.148 -31.210 78.830 1.00 38.13 ? 140 ILE B CG1 1 +ATOM 6795 C CG2 . ILE B 1 140 ? 9.767 -30.714 77.003 1.00 36.79 ? 140 ILE B CG2 1 +ATOM 6796 C CD1 . ILE B 1 140 ? 6.942 -32.031 79.219 1.00 37.60 ? 140 ILE B CD1 1 +ATOM 6797 N N . PRO B 1 141 ? 7.985 -28.705 74.750 1.00 40.57 ? 141 PRO B N 1 +ATOM 6798 C CA . PRO B 1 141 ? 8.172 -28.539 73.305 1.00 41.20 ? 141 PRO B CA 1 +ATOM 6799 C C . PRO B 1 141 ? 9.389 -29.277 72.737 1.00 42.86 ? 141 PRO B C 1 +ATOM 6800 O O . PRO B 1 141 ? 10.256 -28.670 72.114 1.00 43.59 ? 141 PRO B O 1 +ATOM 6801 C CB . PRO B 1 141 ? 8.278 -27.030 73.150 1.00 38.47 ? 141 PRO B CB 1 +ATOM 6802 C CG . PRO B 1 141 ? 8.989 -26.638 74.399 1.00 40.31 ? 141 PRO B CG 1 +ATOM 6803 C CD . PRO B 1 141 ? 8.282 -27.453 75.465 1.00 38.92 ? 141 PRO B CD 1 +ATOM 6804 N N . GLU B 1 142 ? 9.448 -30.586 72.970 1.00 45.21 ? 142 GLU B N 1 +ATOM 6805 C CA . GLU B 1 142 ? 10.529 -31.431 72.462 1.00 47.79 ? 142 GLU B CA 1 +ATOM 6806 C C . GLU B 1 142 ? 9.931 -32.814 72.242 1.00 48.41 ? 142 GLU B C 1 +ATOM 6807 O O . GLU B 1 142 ? 8.923 -33.152 72.861 1.00 48.75 ? 142 GLU B O 1 +ATOM 6808 C CB . GLU B 1 142 ? 11.685 -31.520 73.463 1.00 49.86 ? 142 GLU B CB 1 +ATOM 6809 C CG . GLU B 1 142 ? 12.208 -30.175 73.938 1.00 55.23 ? 142 GLU B CG 1 +ATOM 6810 C CD . GLU B 1 142 ? 13.575 -30.279 74.602 1.00 59.60 ? 142 GLU B CD 1 +ATOM 6811 O OE1 . GLU B 1 142 ? 14.573 -30.496 73.875 1.00 62.88 ? 142 GLU B OE1 1 +ATOM 6812 O OE2 . GLU B 1 142 ? 13.657 -30.151 75.847 1.00 61.86 ? 142 GLU B OE2 1 +ATOM 6813 N N . ASP B 1 143 ? 10.533 -33.609 71.363 1.00 49.58 ? 143 ASP B N 1 +ATOM 6814 C CA . ASP B 1 143 ? 10.010 -34.947 71.093 1.00 51.55 ? 143 ASP B CA 1 +ATOM 6815 C C . ASP B 1 143 ? 10.381 -35.952 72.175 1.00 50.51 ? 143 ASP B C 1 +ATOM 6816 O O . ASP B 1 143 ? 9.752 -36.999 72.291 1.00 51.53 ? 143 ASP B O 1 +ATOM 6817 C CB . ASP B 1 143 ? 10.491 -35.459 69.724 1.00 55.06 ? 143 ASP B CB 1 +ATOM 6818 C CG . ASP B 1 143 ? 12.012 -35.475 69.599 1.00 58.92 ? 143 ASP B CG 1 +ATOM 6819 O OD1 . ASP B 1 143 ? 12.691 -36.047 70.483 1.00 60.62 ? 143 ASP B OD1 1 +ATOM 6820 O OD2 . ASP B 1 143 ? 12.532 -34.919 68.606 1.00 61.55 ? 143 ASP B OD2 1 +ATOM 6821 N N . SER B 1 144 ? 11.405 -35.628 72.960 1.00 49.72 ? 144 SER B N 1 +ATOM 6822 C CA . SER B 1 144 ? 11.865 -36.495 74.041 1.00 47.93 ? 144 SER B CA 1 +ATOM 6823 C C . SER B 1 144 ? 12.048 -35.677 75.305 1.00 46.28 ? 144 SER B C 1 +ATOM 6824 O O . SER B 1 144 ? 12.216 -34.464 75.250 1.00 46.09 ? 144 SER B O 1 +ATOM 6825 C CB . SER B 1 144 ? 13.199 -37.149 73.675 1.00 48.76 ? 144 SER B CB 1 +ATOM 6826 O OG . SER B 1 144 ? 13.060 -38.009 72.559 1.00 51.58 ? 144 SER B OG 1 +ATOM 6827 N N . VAL B 1 145 ? 12.023 -36.341 76.450 1.00 45.12 ? 145 VAL B N 1 +ATOM 6828 C CA . VAL B 1 145 ? 12.201 -35.638 77.703 1.00 43.95 ? 145 VAL B CA 1 +ATOM 6829 C C . VAL B 1 145 ? 12.374 -36.598 78.866 1.00 43.89 ? 145 VAL B C 1 +ATOM 6830 O O . VAL B 1 145 ? 11.900 -37.733 78.834 1.00 43.57 ? 145 VAL B O 1 +ATOM 6831 C CB . VAL B 1 145 ? 10.987 -34.709 78.001 1.00 44.30 ? 145 VAL B CB 1 +ATOM 6832 C CG1 . VAL B 1 145 ? 9.735 -35.541 78.268 1.00 43.67 ? 145 VAL B CG1 1 +ATOM 6833 C CG2 . VAL B 1 145 ? 11.292 -33.812 79.185 1.00 42.58 ? 145 VAL B CG2 1 +ATOM 6834 N N . GLU B 1 146 ? 13.080 -36.138 79.888 1.00 44.06 ? 146 GLU B N 1 +ATOM 6835 C CA . GLU B 1 146 ? 13.270 -36.935 81.081 1.00 44.80 ? 146 GLU B CA 1 +ATOM 6836 C C . GLU B 1 146 ? 12.751 -36.117 82.259 1.00 43.60 ? 146 GLU B C 1 +ATOM 6837 O O . GLU B 1 146 ? 13.100 -34.943 82.415 1.00 42.75 ? 146 GLU B O 1 +ATOM 6838 C CB . GLU B 1 146 ? 14.755 -37.288 81.301 1.00 45.38 ? 146 GLU B CB 1 +ATOM 6839 C CG . GLU B 1 146 ? 15.688 -36.093 81.486 1.00 49.41 ? 146 GLU B CG 1 +ATOM 6840 C CD . GLU B 1 146 ? 17.083 -36.494 81.972 1.00 52.87 ? 146 GLU B CD 1 +ATOM 6841 O OE1 . GLU B 1 146 ? 17.671 -37.431 81.381 1.00 55.74 ? 146 GLU B OE1 1 +ATOM 6842 O OE2 . GLU B 1 146 ? 17.593 -35.869 82.939 1.00 52.04 ? 146 GLU B OE2 1 +ATOM 6843 N N . PHE B 1 147 ? 11.876 -36.716 83.058 1.00 41.71 ? 147 PHE B N 1 +ATOM 6844 C CA . PHE B 1 147 ? 11.392 -36.031 84.236 1.00 41.23 ? 147 PHE B CA 1 +ATOM 6845 C C . PHE B 1 147 ? 11.475 -36.994 85.412 1.00 40.88 ? 147 PHE B C 1 +ATOM 6846 O O . PHE B 1 147 ? 11.675 -38.187 85.221 1.00 40.56 ? 147 PHE B O 1 +ATOM 6847 C CB . PHE B 1 147 ? 9.967 -35.482 84.044 1.00 40.77 ? 147 PHE B CB 1 +ATOM 6848 C CG . PHE B 1 147 ? 8.922 -36.521 83.776 1.00 39.78 ? 147 PHE B CG 1 +ATOM 6849 C CD1 . PHE B 1 147 ? 8.758 -37.049 82.504 1.00 39.59 ? 147 PHE B CD1 1 +ATOM 6850 C CD2 . PHE B 1 147 ? 8.052 -36.923 84.791 1.00 40.78 ? 147 PHE B CD2 1 +ATOM 6851 C CE1 . PHE B 1 147 ? 7.732 -37.964 82.236 1.00 41.50 ? 147 PHE B CE1 1 +ATOM 6852 C CE2 . PHE B 1 147 ? 7.024 -37.836 84.540 1.00 40.51 ? 147 PHE B CE2 1 +ATOM 6853 C CZ . PHE B 1 147 ? 6.862 -38.357 83.259 1.00 41.02 ? 147 PHE B CZ 1 +ATOM 6854 N N . TYR B 1 148 ? 11.337 -36.475 86.625 1.00 39.70 ? 148 TYR B N 1 +ATOM 6855 C CA . TYR B 1 148 ? 11.433 -37.304 87.805 1.00 38.73 ? 148 TYR B CA 1 +ATOM 6856 C C . TYR B 1 148 ? 10.232 -37.180 88.724 1.00 39.55 ? 148 TYR B C 1 +ATOM 6857 O O . TYR B 1 148 ? 9.678 -36.100 88.899 1.00 40.14 ? 148 TYR B O 1 +ATOM 6858 C CB . TYR B 1 148 ? 12.684 -36.930 88.596 1.00 39.10 ? 148 TYR B CB 1 +ATOM 6859 C CG . TYR B 1 148 ? 13.961 -36.920 87.783 1.00 40.35 ? 148 TYR B CG 1 +ATOM 6860 C CD1 . TYR B 1 148 ? 14.184 -35.948 86.807 1.00 39.60 ? 148 TYR B CD1 1 +ATOM 6861 C CD2 . TYR B 1 148 ? 14.958 -37.873 88.004 1.00 39.53 ? 148 TYR B CD2 1 +ATOM 6862 C CE1 . TYR B 1 148 ? 15.369 -35.923 86.077 1.00 40.08 ? 148 TYR B CE1 1 +ATOM 6863 C CE2 . TYR B 1 148 ? 16.143 -37.857 87.277 1.00 40.11 ? 148 TYR B CE2 1 +ATOM 6864 C CZ . TYR B 1 148 ? 16.345 -36.881 86.316 1.00 40.51 ? 148 TYR B CZ 1 +ATOM 6865 O OH . TYR B 1 148 ? 17.518 -36.867 85.588 1.00 41.45 ? 148 TYR B OH 1 +ATOM 6866 N N . VAL B 1 149 ? 9.826 -38.299 89.310 1.00 39.21 ? 149 VAL B N 1 +ATOM 6867 C CA . VAL B 1 149 ? 8.731 -38.287 90.264 1.00 38.72 ? 149 VAL B CA 1 +ATOM 6868 C C . VAL B 1 149 ? 9.461 -38.509 91.582 1.00 39.12 ? 149 VAL B C 1 +ATOM 6869 O O . VAL B 1 149 ? 10.129 -39.520 91.765 1.00 39.56 ? 149 VAL B O 1 +ATOM 6870 C CB . VAL B 1 149 ? 7.740 -39.407 89.992 1.00 38.09 ? 149 VAL B CB 1 +ATOM 6871 C CG1 . VAL B 1 149 ? 6.567 -39.304 90.959 1.00 35.03 ? 149 VAL B CG1 1 +ATOM 6872 C CG2 . VAL B 1 149 ? 7.264 -39.316 88.553 1.00 37.13 ? 149 VAL B CG2 1 +ATOM 6873 N N . ILE B 1 150 ? 9.354 -37.543 92.482 1.00 39.76 ? 150 ILE B N 1 +ATOM 6874 C CA . ILE B 1 150 ? 10.059 -37.591 93.752 1.00 40.00 ? 150 ILE B CA 1 +ATOM 6875 C C . ILE B 1 150 ? 9.121 -37.793 94.931 1.00 41.60 ? 150 ILE B C 1 +ATOM 6876 O O . ILE B 1 150 ? 8.364 -36.894 95.296 1.00 41.23 ? 150 ILE B O 1 +ATOM 6877 C CB . ILE B 1 150 ? 10.853 -36.285 93.946 1.00 38.66 ? 150 ILE B CB 1 +ATOM 6878 C CG1 . ILE B 1 150 ? 11.643 -35.980 92.673 1.00 36.75 ? 150 ILE B CG1 1 +ATOM 6879 C CG2 . ILE B 1 150 ? 11.778 -36.401 95.140 1.00 39.02 ? 150 ILE B CG2 1 +ATOM 6880 C CD1 . ILE B 1 150 ? 12.304 -34.609 92.670 1.00 37.72 ? 150 ILE B CD1 1 +ATOM 6881 N N . GLU B 1 151 ? 9.184 -38.981 95.528 1.00 44.08 ? 151 GLU B N 1 +ATOM 6882 C CA . GLU B 1 151 ? 8.340 -39.313 96.666 1.00 45.38 ? 151 GLU B CA 1 +ATOM 6883 C C . GLU B 1 151 ? 8.687 -38.477 97.891 1.00 45.87 ? 151 GLU B C 1 +ATOM 6884 O O . GLU B 1 151 ? 9.830 -38.034 98.064 1.00 45.29 ? 151 GLU B O 1 +ATOM 6885 C CB . GLU B 1 151 ? 8.470 -40.798 97.007 1.00 48.42 ? 151 GLU B CB 1 +ATOM 6886 C CG . GLU B 1 151 ? 7.998 -41.740 95.904 1.00 56.10 ? 151 GLU B CG 1 +ATOM 6887 C CD . GLU B 1 151 ? 6.581 -41.418 95.397 1.00 61.11 ? 151 GLU B CD 1 +ATOM 6888 O OE1 . GLU B 1 151 ? 5.631 -41.355 96.215 1.00 63.44 ? 151 GLU B OE1 1 +ATOM 6889 O OE2 . GLU B 1 151 ? 6.415 -41.232 94.170 1.00 63.29 ? 151 GLU B OE2 1 +ATOM 6890 N N . GLY B 1 152 ? 7.685 -38.256 98.736 1.00 45.39 ? 152 GLY B N 1 +ATOM 6891 C CA . GLY B 1 152 ? 7.888 -37.480 99.945 1.00 45.48 ? 152 GLY B CA 1 +ATOM 6892 C C . GLY B 1 152 ? 8.096 -38.385 101.146 1.00 45.23 ? 152 GLY B C 1 +ATOM 6893 O O . GLY B 1 152 ? 9.168 -38.985 101.276 1.00 46.90 ? 152 GLY B O 1 +ATOM 6894 N N . PRO B 1 153 ? 7.096 -38.516 102.041 1.00 43.71 ? 153 PRO B N 1 +ATOM 6895 C CA . PRO B 1 153 ? 5.791 -37.853 101.968 1.00 42.93 ? 153 PRO B CA 1 +ATOM 6896 C C . PRO B 1 153 ? 5.789 -36.391 102.450 1.00 43.26 ? 153 PRO B C 1 +ATOM 6897 O O . PRO B 1 153 ? 4.838 -35.657 102.190 1.00 44.54 ? 153 PRO B O 1 +ATOM 6898 C CB . PRO B 1 153 ? 4.910 -38.753 102.828 1.00 42.40 ? 153 PRO B CB 1 +ATOM 6899 C CG . PRO B 1 153 ? 5.852 -39.138 103.924 1.00 42.25 ? 153 PRO B CG 1 +ATOM 6900 C CD . PRO B 1 153 ? 7.128 -39.474 103.162 1.00 42.66 ? 153 PRO B CD 1 +ATOM 6901 N N . ARG B 1 154 ? 6.831 -35.974 103.166 1.00 43.51 ? 154 ARG B N 1 +ATOM 6902 C CA . ARG B 1 154 ? 6.929 -34.593 103.647 1.00 43.32 ? 154 ARG B CA 1 +ATOM 6903 C C . ARG B 1 154 ? 7.491 -33.714 102.530 1.00 43.39 ? 154 ARG B C 1 +ATOM 6904 O O . ARG B 1 154 ? 8.273 -34.190 101.701 1.00 46.26 ? 154 ARG B O 1 +ATOM 6905 C CB . ARG B 1 154 ? 7.866 -34.501 104.852 1.00 44.83 ? 154 ARG B CB 1 +ATOM 6906 C CG . ARG B 1 154 ? 7.351 -35.133 106.145 1.00 47.40 ? 154 ARG B CG 1 +ATOM 6907 C CD . ARG B 1 154 ? 8.355 -34.910 107.284 1.00 49.39 ? 154 ARG B CD 1 +ATOM 6908 N NE . ARG B 1 154 ? 9.694 -35.393 106.929 1.00 52.68 ? 154 ARG B NE 1 +ATOM 6909 C CZ . ARG B 1 154 ? 10.826 -34.733 107.174 1.00 52.60 ? 154 ARG B CZ 1 +ATOM 6910 N NH1 . ARG B 1 154 ? 10.794 -33.551 107.788 1.00 51.92 ? 154 ARG B NH1 1 +ATOM 6911 N NH2 . ARG B 1 154 ? 11.988 -35.235 106.766 1.00 52.08 ? 154 ARG B NH2 1 +ATOM 6912 N N . ILE B 1 155 ? 7.103 -32.440 102.494 1.00 40.15 ? 155 ILE B N 1 +ATOM 6913 C CA . ILE B 1 155 ? 7.613 -31.545 101.462 1.00 37.62 ? 155 ILE B CA 1 +ATOM 6914 C C . ILE B 1 155 ? 9.129 -31.501 101.604 1.00 38.83 ? 155 ILE B C 1 +ATOM 6915 O O . ILE B 1 155 ? 9.852 -31.483 100.605 1.00 38.97 ? 155 ILE B O 1 +ATOM 6916 C CB . ILE B 1 155 ? 7.018 -30.116 101.603 1.00 37.10 ? 155 ILE B CB 1 +ATOM 6917 C CG1 . ILE B 1 155 ? 5.523 -30.144 101.273 1.00 35.68 ? 155 ILE B CG1 1 +ATOM 6918 C CG2 . ILE B 1 155 ? 7.742 -29.138 100.681 1.00 32.73 ? 155 ILE B CG2 1 +ATOM 6919 C CD1 . ILE B 1 155 ? 4.802 -28.845 101.572 1.00 35.27 ? 155 ILE B CD1 1 +ATOM 6920 N N . GLU B 1 156 ? 9.608 -31.504 102.847 1.00 39.30 ? 156 GLU B N 1 +ATOM 6921 C CA . GLU B 1 156 ? 11.040 -31.481 103.103 1.00 41.12 ? 156 GLU B CA 1 +ATOM 6922 C C . GLU B 1 156 ? 11.720 -32.717 102.503 1.00 41.88 ? 156 GLU B C 1 +ATOM 6923 O O . GLU B 1 156 ? 12.870 -32.638 102.057 1.00 42.11 ? 156 GLU B O 1 +ATOM 6924 C CB . GLU B 1 156 ? 11.325 -31.412 104.608 1.00 42.53 ? 156 GLU B CB 1 +ATOM 6925 C CG . GLU B 1 156 ? 12.807 -31.265 104.927 1.00 45.01 ? 156 GLU B CG 1 +ATOM 6926 C CD . GLU B 1 156 ? 13.075 -30.910 106.383 1.00 47.76 ? 156 GLU B CD 1 +ATOM 6927 O OE1 . GLU B 1 156 ? 12.951 -31.804 107.257 1.00 48.43 ? 156 GLU B OE1 1 +ATOM 6928 O OE2 . GLU B 1 156 ? 13.401 -29.729 106.650 1.00 47.51 ? 156 GLU B OE2 1 +ATOM 6929 N N . ASP B 1 157 ? 11.021 -33.852 102.492 1.00 42.86 ? 157 ASP B N 1 +ATOM 6930 C CA . ASP B 1 157 ? 11.591 -35.078 101.918 1.00 45.36 ? 157 ASP B CA 1 +ATOM 6931 C C . ASP B 1 157 ? 11.829 -34.854 100.428 1.00 45.50 ? 157 ASP B C 1 +ATOM 6932 O O . ASP B 1 157 ? 12.901 -35.170 99.895 1.00 46.20 ? 157 ASP B O 1 +ATOM 6933 C CB . ASP B 1 157 ? 10.643 -36.286 102.072 1.00 47.82 ? 157 ASP B CB 1 +ATOM 6934 C CG . ASP B 1 157 ? 10.502 -36.758 103.511 1.00 50.58 ? 157 ASP B CG 1 +ATOM 6935 O OD1 . ASP B 1 157 ? 11.519 -36.789 104.238 1.00 54.44 ? 157 ASP B OD1 1 +ATOM 6936 O OD2 . ASP B 1 157 ? 9.374 -37.119 103.913 1.00 51.46 ? 157 ASP B OD2 1 +ATOM 6937 N N . VAL B 1 158 ? 10.815 -34.308 99.761 1.00 43.43 ? 158 VAL B N 1 +ATOM 6938 C CA . VAL B 1 158 ? 10.900 -34.050 98.334 1.00 41.17 ? 158 VAL B CA 1 +ATOM 6939 C C . VAL B 1 158 ? 12.086 -33.164 98.013 1.00 40.31 ? 158 VAL B C 1 +ATOM 6940 O O . VAL B 1 158 ? 12.858 -33.467 97.104 1.00 42.07 ? 158 VAL B O 1 +ATOM 6941 C CB . VAL B 1 158 ? 9.620 -33.375 97.809 1.00 40.99 ? 158 VAL B CB 1 +ATOM 6942 C CG1 . VAL B 1 158 ? 9.783 -33.035 96.325 1.00 40.49 ? 158 VAL B CG1 1 +ATOM 6943 C CG2 . VAL B 1 158 ? 8.422 -34.299 98.022 1.00 39.84 ? 158 VAL B CG2 1 +ATOM 6944 N N . LEU B 1 159 ? 12.241 -32.077 98.762 1.00 39.45 ? 159 LEU B N 1 +ATOM 6945 C CA . LEU B 1 159 ? 13.342 -31.149 98.513 1.00 40.10 ? 159 LEU B CA 1 +ATOM 6946 C C . LEU B 1 159 ? 14.728 -31.736 98.771 1.00 40.10 ? 159 LEU B C 1 +ATOM 6947 O O . LEU B 1 159 ? 15.693 -31.377 98.097 1.00 39.92 ? 159 LEU B O 1 +ATOM 6948 C CB . LEU B 1 159 ? 13.147 -29.865 99.323 1.00 40.60 ? 159 LEU B CB 1 +ATOM 6949 C CG . LEU B 1 159 ? 11.961 -29.018 98.844 1.00 42.26 ? 159 LEU B CG 1 +ATOM 6950 C CD1 . LEU B 1 159 ? 11.869 -27.733 99.662 1.00 42.84 ? 159 LEU B CD1 1 +ATOM 6951 C CD2 . LEU B 1 159 ? 12.137 -28.682 97.365 1.00 41.64 ? 159 LEU B CD2 1 +ATOM 6952 N N . GLU B 1 160 ? 14.836 -32.634 99.744 1.00 41.05 ? 160 GLU B N 1 +ATOM 6953 C CA . GLU B 1 160 ? 16.121 -33.260 100.029 1.00 41.08 ? 160 GLU B CA 1 +ATOM 6954 C C . GLU B 1 160 ? 16.509 -34.108 98.822 1.00 40.40 ? 160 GLU B C 1 +ATOM 6955 O O . GLU B 1 160 ? 17.633 -34.015 98.315 1.00 39.39 ? 160 GLU B O 1 +ATOM 6956 C CB . GLU B 1 160 ? 16.040 -34.155 101.271 1.00 43.36 ? 160 GLU B CB 1 +ATOM 6957 C CG . GLU B 1 160 ? 15.803 -33.410 102.579 1.00 48.32 ? 160 GLU B CG 1 +ATOM 6958 C CD . GLU B 1 160 ? 15.852 -34.332 103.798 1.00 50.68 ? 160 GLU B CD 1 +ATOM 6959 O OE1 . GLU B 1 160 ? 15.374 -35.486 103.700 1.00 51.92 ? 160 GLU B OE1 1 +ATOM 6960 O OE2 . GLU B 1 160 ? 16.352 -33.896 104.858 1.00 51.01 ? 160 GLU B OE2 1 +ATOM 6961 N N . LYS B 1 161 ? 15.572 -34.931 98.357 1.00 39.03 ? 161 LYS B N 1 +ATOM 6962 C CA . LYS B 1 161 ? 15.843 -35.785 97.210 1.00 38.61 ? 161 LYS B CA 1 +ATOM 6963 C C . LYS B 1 161 ? 16.120 -34.935 95.975 1.00 38.91 ? 161 LYS B C 1 +ATOM 6964 O O . LYS B 1 161 ? 17.047 -35.221 95.208 1.00 38.22 ? 161 LYS B O 1 +ATOM 6965 C CB . LYS B 1 161 ? 14.665 -36.720 96.940 1.00 38.92 ? 161 LYS B CB 1 +ATOM 6966 C CG . LYS B 1 161 ? 14.373 -37.723 98.052 1.00 38.61 ? 161 LYS B CG 1 +ATOM 6967 C CD . LYS B 1 161 ? 13.329 -38.728 97.588 1.00 40.29 ? 161 LYS B CD 1 +ATOM 6968 C CE . LYS B 1 161 ? 12.903 -39.686 98.700 1.00 40.65 ? 161 LYS B CE 1 +ATOM 6969 N NZ . LYS B 1 161 ? 12.151 -39.005 99.788 1.00 42.33 ? 161 LYS B NZ 1 +ATOM 6970 N N . TYR B 1 162 ? 15.316 -33.890 95.784 1.00 37.74 ? 162 TYR B N 1 +ATOM 6971 C CA . TYR B 1 162 ? 15.491 -33.000 94.644 1.00 36.56 ? 162 TYR B CA 1 +ATOM 6972 C C . TYR B 1 162 ? 16.879 -32.376 94.696 1.00 36.91 ? 162 TYR B C 1 +ATOM 6973 O O . TYR B 1 162 ? 17.576 -32.329 93.690 1.00 37.15 ? 162 TYR B O 1 +ATOM 6974 C CB . TYR B 1 162 ? 14.430 -31.890 94.662 1.00 36.45 ? 162 TYR B CB 1 +ATOM 6975 C CG . TYR B 1 162 ? 14.693 -30.794 93.652 1.00 34.81 ? 162 TYR B CG 1 +ATOM 6976 C CD1 . TYR B 1 162 ? 14.450 -30.997 92.293 1.00 34.79 ? 162 TYR B CD1 1 +ATOM 6977 C CD2 . TYR B 1 162 ? 15.256 -29.580 94.050 1.00 33.77 ? 162 TYR B CD2 1 +ATOM 6978 C CE1 . TYR B 1 162 ? 14.760 -30.027 91.358 1.00 35.37 ? 162 TYR B CE1 1 +ATOM 6979 C CE2 . TYR B 1 162 ? 15.577 -28.602 93.123 1.00 34.24 ? 162 TYR B CE2 1 +ATOM 6980 C CZ . TYR B 1 162 ? 15.326 -28.832 91.777 1.00 36.09 ? 162 TYR B CZ 1 +ATOM 6981 O OH . TYR B 1 162 ? 15.651 -27.869 90.853 1.00 36.39 ? 162 TYR B OH 1 +ATOM 6982 N N . THR B 1 163 ? 17.267 -31.892 95.875 1.00 38.36 ? 163 THR B N 1 +ATOM 6983 C CA . THR B 1 163 ? 18.571 -31.265 96.060 1.00 42.22 ? 163 THR B CA 1 +ATOM 6984 C C . THR B 1 163 ? 19.702 -32.273 95.858 1.00 44.66 ? 163 THR B C 1 +ATOM 6985 O O . THR B 1 163 ? 20.778 -31.938 95.341 1.00 44.33 ? 163 THR B O 1 +ATOM 6986 C CB . THR B 1 163 ? 18.680 -30.650 97.453 1.00 42.97 ? 163 THR B CB 1 +ATOM 6987 O OG1 . THR B 1 163 ? 17.684 -29.623 97.588 1.00 45.57 ? 163 THR B OG1 1 +ATOM 6988 C CG2 . THR B 1 163 ? 20.061 -30.032 97.657 1.00 44.13 ? 163 THR B CG2 1 +ATOM 6989 N N . GLU B 1 164 ? 19.452 -33.507 96.280 1.00 46.37 ? 164 GLU B N 1 +ATOM 6990 C CA . GLU B 1 164 ? 20.420 -34.576 96.115 1.00 47.97 ? 164 GLU B CA 1 +ATOM 6991 C C . GLU B 1 164 ? 20.637 -34.758 94.607 1.00 46.69 ? 164 GLU B C 1 +ATOM 6992 O O . GLU B 1 164 ? 21.766 -34.918 94.137 1.00 47.11 ? 164 GLU B O 1 +ATOM 6993 C CB . GLU B 1 164 ? 19.864 -35.876 96.717 1.00 52.23 ? 164 GLU B CB 1 +ATOM 6994 C CG . GLU B 1 164 ? 20.762 -37.089 96.534 1.00 58.64 ? 164 GLU B CG 1 +ATOM 6995 C CD . GLU B 1 164 ? 21.859 -37.166 97.585 1.00 64.64 ? 164 GLU B CD 1 +ATOM 6996 O OE1 . GLU B 1 164 ? 22.415 -36.100 97.952 1.00 67.21 ? 164 GLU B OE1 1 +ATOM 6997 O OE2 . GLU B 1 164 ? 22.170 -38.297 98.038 1.00 67.31 ? 164 GLU B OE2 1 +ATOM 6998 N N . LEU B 1 165 ? 19.538 -34.709 93.858 1.00 44.47 ? 165 LEU B N 1 +ATOM 6999 C CA . LEU B 1 165 ? 19.565 -34.888 92.412 1.00 42.26 ? 165 LEU B CA 1 +ATOM 7000 C C . LEU B 1 165 ? 20.224 -33.749 91.627 1.00 41.86 ? 165 LEU B C 1 +ATOM 7001 O O . LEU B 1 165 ? 21.129 -33.987 90.825 1.00 41.17 ? 165 LEU B O 1 +ATOM 7002 C CB . LEU B 1 165 ? 18.135 -35.077 91.896 1.00 42.49 ? 165 LEU B CB 1 +ATOM 7003 C CG . LEU B 1 165 ? 17.868 -35.935 90.649 1.00 43.11 ? 165 LEU B CG 1 +ATOM 7004 C CD1 . LEU B 1 165 ? 16.690 -35.347 89.889 1.00 41.66 ? 165 LEU B CD1 1 +ATOM 7005 C CD2 . LEU B 1 165 ? 19.085 -35.984 89.757 1.00 41.87 ? 165 LEU B CD2 1 +ATOM 7006 N N . THR B 1 166 ? 19.779 -32.515 91.855 1.00 40.61 ? 166 THR B N 1 +ATOM 7007 C CA . THR B 1 166 ? 20.314 -31.380 91.110 1.00 39.61 ? 166 THR B CA 1 +ATOM 7008 C C . THR B 1 166 ? 21.525 -30.679 91.704 1.00 39.24 ? 166 THR B C 1 +ATOM 7009 O O . THR B 1 166 ? 22.205 -29.928 91.005 1.00 38.49 ? 166 THR B O 1 +ATOM 7010 C CB . THR B 1 166 ? 19.208 -30.330 90.845 1.00 40.65 ? 166 THR B CB 1 +ATOM 7011 O OG1 . THR B 1 166 ? 18.706 -29.823 92.089 1.00 40.96 ? 166 THR B OG1 1 +ATOM 7012 C CG2 . THR B 1 166 ? 18.057 -30.964 90.071 1.00 39.70 ? 166 THR B CG2 1 +ATOM 7013 N N . GLY B 1 167 ? 21.802 -30.919 92.984 1.00 39.76 ? 167 GLY B N 1 +ATOM 7014 C CA . GLY B 1 167 ? 22.950 -30.284 93.610 1.00 40.26 ? 167 GLY B CA 1 +ATOM 7015 C C . GLY B 1 167 ? 22.658 -29.529 94.898 1.00 42.05 ? 167 GLY B C 1 +ATOM 7016 O O . GLY B 1 167 ? 21.672 -28.789 95.005 1.00 42.08 ? 167 GLY B O 1 +ATOM 7017 N N . LYS B 1 168 ? 23.522 -29.718 95.890 1.00 42.10 ? 168 LYS B N 1 +ATOM 7018 C CA . LYS B 1 168 ? 23.360 -29.043 97.168 1.00 42.39 ? 168 LYS B CA 1 +ATOM 7019 C C . LYS B 1 168 ? 23.817 -27.592 97.018 1.00 41.70 ? 168 LYS B C 1 +ATOM 7020 O O . LYS B 1 168 ? 24.733 -27.286 96.251 1.00 39.99 ? 168 LYS B O 1 +ATOM 7021 C CB . LYS B 1 168 ? 24.214 -29.720 98.251 1.00 44.36 ? 168 LYS B CB 1 +ATOM 7022 C CG . LYS B 1 168 ? 23.901 -31.188 98.533 1.00 48.41 ? 168 LYS B CG 1 +ATOM 7023 C CD . LYS B 1 168 ? 22.548 -31.371 99.214 1.00 51.16 ? 168 LYS B CD 1 +ATOM 7024 C CE . LYS B 1 168 ? 22.260 -32.851 99.510 1.00 53.46 ? 168 LYS B CE 1 +ATOM 7025 N NZ . LYS B 1 168 ? 20.866 -33.083 100.029 1.00 54.00 ? 168 LYS B NZ 1 +ATOM 7026 N N . PRO B 1 169 ? 23.176 -26.674 97.743 1.00 40.60 ? 169 PRO B N 1 +ATOM 7027 C CA . PRO B 1 169 ? 23.570 -25.269 97.656 1.00 41.62 ? 169 PRO B CA 1 +ATOM 7028 C C . PRO B 1 169 ? 24.997 -25.119 98.202 1.00 43.14 ? 169 PRO B C 1 +ATOM 7029 O O . PRO B 1 169 ? 25.362 -25.791 99.166 1.00 43.93 ? 169 PRO B O 1 +ATOM 7030 C CB . PRO B 1 169 ? 22.557 -24.575 98.559 1.00 41.32 ? 169 PRO B CB 1 +ATOM 7031 C CG . PRO B 1 169 ? 21.353 -25.463 98.466 1.00 41.17 ? 169 PRO B CG 1 +ATOM 7032 C CD . PRO B 1 169 ? 21.934 -26.837 98.515 1.00 39.90 ? 169 PRO B CD 1 +ATOM 7033 N N . PHE B 1 170 ? 25.803 -24.256 97.592 1.00 43.63 ? 170 PHE B N 1 +ATOM 7034 C CA . PHE B 1 170 ? 27.159 -24.046 98.084 1.00 43.52 ? 170 PHE B CA 1 +ATOM 7035 C C . PHE B 1 170 ? 27.030 -23.314 99.409 1.00 43.75 ? 170 PHE B C 1 +ATOM 7036 O O . PHE B 1 170 ? 25.997 -22.702 99.684 1.00 44.80 ? 170 PHE B O 1 +ATOM 7037 C CB . PHE B 1 170 ? 27.981 -23.186 97.115 1.00 44.28 ? 170 PHE B CB 1 +ATOM 7038 C CG . PHE B 1 170 ? 27.575 -21.725 97.078 1.00 45.89 ? 170 PHE B CG 1 +ATOM 7039 C CD1 . PHE B 1 170 ? 26.330 -21.338 96.567 1.00 45.78 ? 170 PHE B CD1 1 +ATOM 7040 C CD2 . PHE B 1 170 ? 28.455 -20.734 97.524 1.00 45.23 ? 170 PHE B CD2 1 +ATOM 7041 C CE1 . PHE B 1 170 ? 25.976 -19.985 96.497 1.00 46.21 ? 170 PHE B CE1 1 +ATOM 7042 C CE2 . PHE B 1 170 ? 28.111 -19.379 97.460 1.00 46.31 ? 170 PHE B CE2 1 +ATOM 7043 C CZ . PHE B 1 170 ? 26.870 -19.001 96.944 1.00 46.67 ? 170 PHE B CZ 1 +ATOM 7044 N N . LEU B 1 171 ? 28.065 -23.386 100.236 1.00 43.72 ? 171 LEU B N 1 +ATOM 7045 C CA . LEU B 1 171 ? 28.041 -22.693 101.515 1.00 42.75 ? 171 LEU B CA 1 +ATOM 7046 C C . LEU B 1 171 ? 28.787 -21.379 101.349 1.00 41.50 ? 171 LEU B C 1 +ATOM 7047 O O . LEU B 1 171 ? 29.999 -21.353 101.162 1.00 42.63 ? 171 LEU B O 1 +ATOM 7048 C CB . LEU B 1 171 ? 28.704 -23.532 102.611 1.00 42.94 ? 171 LEU B CB 1 +ATOM 7049 C CG . LEU B 1 171 ? 28.754 -22.855 103.990 1.00 43.77 ? 171 LEU B CG 1 +ATOM 7050 C CD1 . LEU B 1 171 ? 27.341 -22.552 104.500 1.00 41.84 ? 171 LEU B CD1 1 +ATOM 7051 C CD2 . LEU B 1 171 ? 29.480 -23.773 104.958 1.00 43.68 ? 171 LEU B CD2 1 +ATOM 7052 N N . PRO B 1 172 ? 28.066 -20.262 101.391 1.00 40.46 ? 172 PRO B N 1 +ATOM 7053 C CA . PRO B 1 172 ? 28.736 -18.970 101.237 1.00 39.98 ? 172 PRO B CA 1 +ATOM 7054 C C . PRO B 1 172 ? 29.283 -18.458 102.563 1.00 38.73 ? 172 PRO B C 1 +ATOM 7055 O O . PRO B 1 172 ? 28.978 -19.005 103.621 1.00 38.27 ? 172 PRO B O 1 +ATOM 7056 C CB . PRO B 1 172 ? 27.626 -18.082 100.689 1.00 40.75 ? 172 PRO B CB 1 +ATOM 7057 C CG . PRO B 1 172 ? 26.417 -18.622 101.392 1.00 40.99 ? 172 PRO B CG 1 +ATOM 7058 C CD . PRO B 1 172 ? 26.601 -20.121 101.328 1.00 39.73 ? 172 PRO B CD 1 +ATOM 7059 N N . PRO B 1 173 ? 30.105 -17.404 102.521 1.00 38.41 ? 173 PRO B N 1 +ATOM 7060 C CA . PRO B 1 173 ? 30.676 -16.839 103.749 1.00 39.81 ? 173 PRO B CA 1 +ATOM 7061 C C . PRO B 1 173 ? 29.597 -16.108 104.535 1.00 40.93 ? 173 PRO B C 1 +ATOM 7062 O O . PRO B 1 173 ? 28.602 -15.658 103.967 1.00 41.33 ? 173 PRO B O 1 +ATOM 7063 C CB . PRO B 1 173 ? 31.758 -15.892 103.228 1.00 39.21 ? 173 PRO B CB 1 +ATOM 7064 C CG . PRO B 1 173 ? 31.169 -15.410 101.929 1.00 40.01 ? 173 PRO B CG 1 +ATOM 7065 C CD . PRO B 1 173 ? 30.602 -16.692 101.330 1.00 38.95 ? 173 PRO B CD 1 +ATOM 7066 N N . MET B 1 174 ? 29.796 -15.982 105.840 1.00 42.06 ? 174 MET B N 1 +ATOM 7067 C CA . MET B 1 174 ? 28.813 -15.318 106.674 1.00 42.61 ? 174 MET B CA 1 +ATOM 7068 C C . MET B 1 174 ? 28.563 -13.874 106.260 1.00 41.92 ? 174 MET B C 1 +ATOM 7069 O O . MET B 1 174 ? 27.440 -13.380 106.391 1.00 42.85 ? 174 MET B O 1 +ATOM 7070 C CB . MET B 1 174 ? 29.229 -15.383 108.144 1.00 44.82 ? 174 MET B CB 1 +ATOM 7071 C CG . MET B 1 174 ? 28.219 -14.757 109.093 1.00 49.89 ? 174 MET B CG 1 +ATOM 7072 S SD . MET B 1 174 ? 28.532 -15.129 110.844 1.00 55.14 ? 174 MET B SD 1 +ATOM 7073 C CE . MET B 1 174 ? 27.002 -15.915 111.307 1.00 53.00 ? 174 MET B CE 1 +ATOM 7074 N N . TRP B 1 175 ? 29.581 -13.191 105.742 1.00 40.90 ? 175 TRP B N 1 +ATOM 7075 C CA . TRP B 1 175 ? 29.378 -11.801 105.338 1.00 39.45 ? 175 TRP B CA 1 +ATOM 7076 C C . TRP B 1 175 ? 28.423 -11.643 104.153 1.00 39.31 ? 175 TRP B C 1 +ATOM 7077 O O . TRP B 1 175 ? 27.924 -10.549 103.896 1.00 40.47 ? 175 TRP B O 1 +ATOM 7078 C CB . TRP B 1 175 ? 30.709 -11.110 105.018 1.00 39.36 ? 175 TRP B CB 1 +ATOM 7079 C CG . TRP B 1 175 ? 31.554 -11.756 103.954 1.00 40.24 ? 175 TRP B CG 1 +ATOM 7080 C CD1 . TRP B 1 175 ? 32.635 -12.572 104.148 1.00 39.80 ? 175 TRP B CD1 1 +ATOM 7081 C CD2 . TRP B 1 175 ? 31.441 -11.571 102.535 1.00 40.73 ? 175 TRP B CD2 1 +ATOM 7082 N NE1 . TRP B 1 175 ? 33.210 -12.900 102.938 1.00 41.08 ? 175 TRP B NE1 1 +ATOM 7083 C CE2 . TRP B 1 175 ? 32.499 -12.300 101.932 1.00 40.53 ? 175 TRP B CE2 1 +ATOM 7084 C CE3 . TRP B 1 175 ? 30.551 -10.860 101.713 1.00 39.87 ? 175 TRP B CE3 1 +ATOM 7085 C CZ2 . TRP B 1 175 ? 32.693 -12.336 100.545 1.00 39.75 ? 175 TRP B CZ2 1 +ATOM 7086 C CZ3 . TRP B 1 175 ? 30.743 -10.897 100.325 1.00 38.75 ? 175 TRP B CZ3 1 +ATOM 7087 C CH2 . TRP B 1 175 ? 31.809 -11.631 99.760 1.00 40.38 ? 175 TRP B CH2 1 +ATOM 7088 N N . ALA B 1 176 ? 28.166 -12.730 103.435 1.00 39.33 ? 176 ALA B N 1 +ATOM 7089 C CA . ALA B 1 176 ? 27.263 -12.685 102.293 1.00 38.59 ? 176 ALA B CA 1 +ATOM 7090 C C . ALA B 1 176 ? 25.827 -12.449 102.758 1.00 39.40 ? 176 ALA B C 1 +ATOM 7091 O O . ALA B 1 176 ? 24.972 -12.055 101.970 1.00 40.26 ? 176 ALA B O 1 +ATOM 7092 C CB . ALA B 1 176 ? 27.353 -13.975 101.510 1.00 37.73 ? 176 ALA B CB 1 +ATOM 7093 N N . PHE B 1 177 ? 25.567 -12.677 104.041 1.00 39.03 ? 177 PHE B N 1 +ATOM 7094 C CA . PHE B 1 177 ? 24.232 -12.469 104.584 1.00 38.32 ? 177 PHE B CA 1 +ATOM 7095 C C . PHE B 1 177 ? 24.120 -11.150 105.341 1.00 38.43 ? 177 PHE B C 1 +ATOM 7096 O O . PHE B 1 177 ? 23.097 -10.877 105.980 1.00 39.86 ? 177 PHE B O 1 +ATOM 7097 C CB . PHE B 1 177 ? 23.850 -13.622 105.510 1.00 38.44 ? 177 PHE B CB 1 +ATOM 7098 C CG . PHE B 1 177 ? 23.873 -14.957 104.843 1.00 38.88 ? 177 PHE B CG 1 +ATOM 7099 C CD1 . PHE B 1 177 ? 25.076 -15.607 104.599 1.00 40.64 ? 177 PHE B CD1 1 +ATOM 7100 C CD2 . PHE B 1 177 ? 22.692 -15.559 104.428 1.00 40.74 ? 177 PHE B CD2 1 +ATOM 7101 C CE1 . PHE B 1 177 ? 25.105 -16.850 103.942 1.00 39.12 ? 177 PHE B CE1 1 +ATOM 7102 C CE2 . PHE B 1 177 ? 22.710 -16.799 103.771 1.00 41.21 ? 177 PHE B CE2 1 +ATOM 7103 C CZ . PHE B 1 177 ? 23.925 -17.442 103.531 1.00 38.97 ? 177 PHE B CZ 1 +ATOM 7104 N N . GLY B 1 178 ? 25.163 -10.330 105.264 1.00 37.38 ? 178 GLY B N 1 +ATOM 7105 C CA . GLY B 1 178 ? 25.137 -9.048 105.949 1.00 37.82 ? 178 GLY B CA 1 +ATOM 7106 C C . GLY B 1 178 ? 24.410 -7.978 105.153 1.00 38.72 ? 178 GLY B C 1 +ATOM 7107 O O . GLY B 1 178 ? 23.867 -8.247 104.084 1.00 39.37 ? 178 GLY B O 1 +ATOM 7108 N N . TYR B 1 179 ? 24.411 -6.758 105.671 1.00 38.52 ? 179 TYR B N 1 +ATOM 7109 C CA . TYR B 1 179 ? 23.747 -5.641 105.023 1.00 38.59 ? 179 TYR B CA 1 +ATOM 7110 C C . TYR B 1 179 ? 24.577 -5.108 103.862 1.00 38.54 ? 179 TYR B C 1 +ATOM 7111 O O . TYR B 1 179 ? 25.686 -4.629 104.055 1.00 41.26 ? 179 TYR B O 1 +ATOM 7112 C CB . TYR B 1 179 ? 23.502 -4.548 106.064 1.00 39.00 ? 179 TYR B CB 1 +ATOM 7113 C CG . TYR B 1 179 ? 22.881 -3.281 105.539 1.00 38.36 ? 179 TYR B CG 1 +ATOM 7114 C CD1 . TYR B 1 179 ? 21.835 -3.321 104.613 1.00 38.14 ? 179 TYR B CD1 1 +ATOM 7115 C CD2 . TYR B 1 179 ? 23.300 -2.038 106.010 1.00 38.03 ? 179 TYR B CD2 1 +ATOM 7116 C CE1 . TYR B 1 179 ? 21.220 -2.148 104.169 1.00 38.81 ? 179 TYR B CE1 1 +ATOM 7117 C CE2 . TYR B 1 179 ? 22.690 -0.858 105.576 1.00 39.91 ? 179 TYR B CE2 1 +ATOM 7118 C CZ . TYR B 1 179 ? 21.651 -0.923 104.654 1.00 39.36 ? 179 TYR B CZ 1 +ATOM 7119 O OH . TYR B 1 179 ? 21.052 0.234 104.216 1.00 41.68 ? 179 TYR B OH 1 +ATOM 7120 N N . MET B 1 180 ? 24.028 -5.190 102.654 1.00 39.15 ? 180 MET B N 1 +ATOM 7121 C CA . MET B 1 180 ? 24.715 -4.724 101.449 1.00 39.25 ? 180 MET B CA 1 +ATOM 7122 C C . MET B 1 180 ? 24.080 -3.452 100.906 1.00 39.50 ? 180 MET B C 1 +ATOM 7123 O O . MET B 1 180 ? 22.855 -3.345 100.839 1.00 40.90 ? 180 MET B O 1 +ATOM 7124 C CB . MET B 1 180 ? 24.625 -5.778 100.351 1.00 40.06 ? 180 MET B CB 1 +ATOM 7125 C CG . MET B 1 180 ? 24.986 -7.181 100.791 1.00 44.34 ? 180 MET B CG 1 +ATOM 7126 S SD . MET B 1 180 ? 26.754 -7.400 101.049 1.00 47.09 ? 180 MET B SD 1 +ATOM 7127 C CE . MET B 1 180 ? 26.885 -9.183 100.794 1.00 42.17 ? 180 MET B CE 1 +ATOM 7128 N N . ILE B 1 181 ? 24.900 -2.485 100.519 1.00 38.27 ? 181 ILE B N 1 +ATOM 7129 C CA . ILE B 1 181 ? 24.360 -1.269 99.934 1.00 37.84 ? 181 ILE B CA 1 +ATOM 7130 C C . ILE B 1 181 ? 24.744 -1.304 98.462 1.00 38.49 ? 181 ILE B C 1 +ATOM 7131 O O . ILE B 1 181 ? 25.824 -1.782 98.091 1.00 38.40 ? 181 ILE B O 1 +ATOM 7132 C CB . ILE B 1 181 ? 24.913 0.010 100.592 1.00 36.45 ? 181 ILE B CB 1 +ATOM 7133 C CG1 . ILE B 1 181 ? 26.427 0.086 100.432 1.00 36.31 ? 181 ILE B CG1 1 +ATOM 7134 C CG2 . ILE B 1 181 ? 24.524 0.032 102.046 1.00 37.29 ? 181 ILE B CG2 1 +ATOM 7135 C CD1 . ILE B 1 181 ? 27.013 1.372 100.976 1.00 37.06 ? 181 ILE B CD1 1 +ATOM 7136 N N . SER B 1 182 ? 23.853 -0.801 97.622 1.00 38.45 ? 182 SER B N 1 +ATOM 7137 C CA . SER B 1 182 ? 24.084 -0.823 96.191 1.00 36.86 ? 182 SER B CA 1 +ATOM 7138 C C . SER B 1 182 ? 23.258 0.254 95.537 1.00 36.66 ? 182 SER B C 1 +ATOM 7139 O O . SER B 1 182 ? 22.354 0.820 96.147 1.00 38.64 ? 182 SER B O 1 +ATOM 7140 C CB . SER B 1 182 ? 23.670 -2.193 95.641 1.00 36.32 ? 182 SER B CB 1 +ATOM 7141 O OG . SER B 1 182 ? 23.698 -2.227 94.228 1.00 35.85 ? 182 SER B OG 1 +ATOM 7142 N N . ARG B 1 183 ? 23.579 0.546 94.292 1.00 36.40 ? 183 ARG B N 1 +ATOM 7143 C CA . ARG B 1 183 ? 22.836 1.529 93.537 1.00 36.86 ? 183 ARG B CA 1 +ATOM 7144 C C . ARG B 1 183 ? 23.281 1.393 92.101 1.00 39.23 ? 183 ARG B C 1 +ATOM 7145 O O . ARG B 1 183 ? 24.294 0.755 91.802 1.00 42.13 ? 183 ARG B O 1 +ATOM 7146 C CB . ARG B 1 183 ? 23.110 2.949 94.031 1.00 36.49 ? 183 ARG B CB 1 +ATOM 7147 C CG . ARG B 1 183 ? 22.187 3.987 93.389 1.00 37.46 ? 183 ARG B CG 1 +ATOM 7148 C CD . ARG B 1 183 ? 22.497 5.415 93.784 1.00 35.56 ? 183 ARG B CD 1 +ATOM 7149 N NE . ARG B 1 183 ? 21.737 6.368 92.974 1.00 38.09 ? 183 ARG B NE 1 +ATOM 7150 C CZ . ARG B 1 183 ? 20.503 6.794 93.250 1.00 38.57 ? 183 ARG B CZ 1 +ATOM 7151 N NH1 . ARG B 1 183 ? 19.862 6.364 94.330 1.00 37.50 ? 183 ARG B NH1 1 +ATOM 7152 N NH2 . ARG B 1 183 ? 19.902 7.651 92.435 1.00 38.00 ? 183 ARG B NH2 1 +ATOM 7153 N N . TYR B 1 184 ? 22.511 1.985 91.207 1.00 40.28 ? 184 TYR B N 1 +ATOM 7154 C CA . TYR B 1 184 ? 22.815 1.947 89.796 1.00 40.18 ? 184 TYR B CA 1 +ATOM 7155 C C . TYR B 1 184 ? 23.024 3.389 89.359 1.00 39.85 ? 184 TYR B C 1 +ATOM 7156 O O . TYR B 1 184 ? 22.112 3.999 88.812 1.00 38.70 ? 184 TYR B O 1 +ATOM 7157 C CB . TYR B 1 184 ? 21.640 1.288 89.062 1.00 40.18 ? 184 TYR B CB 1 +ATOM 7158 C CG . TYR B 1 184 ? 21.647 1.397 87.557 1.00 40.49 ? 184 TYR B CG 1 +ATOM 7159 C CD1 . TYR B 1 184 ? 22.841 1.455 86.839 1.00 40.52 ? 184 TYR B CD1 1 +ATOM 7160 C CD2 . TYR B 1 184 ? 20.446 1.415 86.847 1.00 41.47 ? 184 TYR B CD2 1 +ATOM 7161 C CE1 . TYR B 1 184 ? 22.838 1.530 85.449 1.00 42.52 ? 184 TYR B CE1 1 +ATOM 7162 C CE2 . TYR B 1 184 ? 20.427 1.487 85.456 1.00 41.31 ? 184 TYR B CE2 1 +ATOM 7163 C CZ . TYR B 1 184 ? 21.624 1.545 84.764 1.00 42.65 ? 184 TYR B CZ 1 +ATOM 7164 O OH . TYR B 1 184 ? 21.612 1.622 83.392 1.00 43.00 ? 184 TYR B OH 1 +ATOM 7165 N N . SER B 1 185 ? 24.213 3.948 89.614 1.00 41.60 ? 185 SER B N 1 +ATOM 7166 C CA . SER B 1 185 ? 25.334 3.268 90.282 1.00 41.51 ? 185 SER B CA 1 +ATOM 7167 C C . SER B 1 185 ? 26.036 4.246 91.237 1.00 42.69 ? 185 SER B C 1 +ATOM 7168 O O . SER B 1 185 ? 25.701 5.438 91.285 1.00 42.55 ? 185 SER B O 1 +ATOM 7169 C CB . SER B 1 185 ? 26.374 2.810 89.250 1.00 42.87 ? 185 SER B CB 1 +ATOM 7170 O OG . SER B 1 185 ? 25.794 2.089 88.171 1.00 45.59 ? 185 SER B OG 1 +ATOM 7171 N N . TYR B 1 186 ? 27.015 3.736 91.988 1.00 41.83 ? 186 TYR B N 1 +ATOM 7172 C CA . TYR B 1 186 ? 27.805 4.570 92.893 1.00 40.22 ? 186 TYR B CA 1 +ATOM 7173 C C . TYR B 1 186 ? 29.114 4.890 92.183 1.00 39.63 ? 186 TYR B C 1 +ATOM 7174 O O . TYR B 1 186 ? 29.780 3.988 91.679 1.00 40.88 ? 186 TYR B O 1 +ATOM 7175 C CB . TYR B 1 186 ? 28.120 3.828 94.198 1.00 40.54 ? 186 TYR B CB 1 +ATOM 7176 C CG . TYR B 1 186 ? 26.955 3.693 95.158 1.00 38.74 ? 186 TYR B CG 1 +ATOM 7177 C CD1 . TYR B 1 186 ? 26.162 4.797 95.485 1.00 37.62 ? 186 TYR B CD1 1 +ATOM 7178 C CD2 . TYR B 1 186 ? 26.682 2.475 95.781 1.00 36.97 ? 186 TYR B CD2 1 +ATOM 7179 C CE1 . TYR B 1 186 ? 25.130 4.693 96.409 1.00 37.03 ? 186 TYR B CE1 1 +ATOM 7180 C CE2 . TYR B 1 186 ? 25.655 2.359 96.711 1.00 37.89 ? 186 TYR B CE2 1 +ATOM 7181 C CZ . TYR B 1 186 ? 24.883 3.472 97.022 1.00 38.74 ? 186 TYR B CZ 1 +ATOM 7182 O OH . TYR B 1 186 ? 23.878 3.365 97.956 1.00 40.19 ? 186 TYR B OH 1 +ATOM 7183 N N . TYR B 1 187 ? 29.477 6.165 92.140 1.00 39.31 ? 187 TYR B N 1 +ATOM 7184 C CA . TYR B 1 187 ? 30.717 6.592 91.499 1.00 40.00 ? 187 TYR B CA 1 +ATOM 7185 C C . TYR B 1 187 ? 30.834 8.110 91.592 1.00 39.89 ? 187 TYR B C 1 +ATOM 7186 O O . TYR B 1 187 ? 29.847 8.785 91.856 1.00 40.84 ? 187 TYR B O 1 +ATOM 7187 C CB . TYR B 1 187 ? 30.728 6.173 90.028 1.00 41.84 ? 187 TYR B CB 1 +ATOM 7188 C CG . TYR B 1 187 ? 29.613 6.785 89.213 1.00 42.77 ? 187 TYR B CG 1 +ATOM 7189 C CD1 . TYR B 1 187 ? 28.296 6.342 89.356 1.00 44.78 ? 187 TYR B CD1 1 +ATOM 7190 C CD2 . TYR B 1 187 ? 29.871 7.808 88.302 1.00 42.92 ? 187 TYR B CD2 1 +ATOM 7191 C CE1 . TYR B 1 187 ? 27.260 6.904 88.608 1.00 45.87 ? 187 TYR B CE1 1 +ATOM 7192 C CE2 . TYR B 1 187 ? 28.849 8.376 87.545 1.00 44.86 ? 187 TYR B CE2 1 +ATOM 7193 C CZ . TYR B 1 187 ? 27.541 7.917 87.702 1.00 46.68 ? 187 TYR B CZ 1 +ATOM 7194 O OH . TYR B 1 187 ? 26.518 8.458 86.946 1.00 47.86 ? 187 TYR B OH 1 +ATOM 7195 N N . PRO B 1 188 ? 32.044 8.668 91.397 1.00 39.43 ? 188 PRO B N 1 +ATOM 7196 C CA . PRO B 1 188 ? 33.311 7.990 91.109 1.00 39.51 ? 188 PRO B CA 1 +ATOM 7197 C C . PRO B 1 188 ? 33.819 7.292 92.372 1.00 40.75 ? 188 PRO B C 1 +ATOM 7198 O O . PRO B 1 188 ? 33.156 7.341 93.412 1.00 41.42 ? 188 PRO B O 1 +ATOM 7199 C CB . PRO B 1 188 ? 34.203 9.131 90.636 1.00 37.68 ? 188 PRO B CB 1 +ATOM 7200 C CG . PRO B 1 188 ? 33.730 10.260 91.455 1.00 38.41 ? 188 PRO B CG 1 +ATOM 7201 C CD . PRO B 1 188 ? 32.233 10.128 91.405 1.00 38.70 ? 188 PRO B CD 1 +ATOM 7202 N N . GLN B 1 189 ? 34.988 6.659 92.299 1.00 41.38 ? 189 GLN B N 1 +ATOM 7203 C CA . GLN B 1 189 ? 35.500 5.919 93.453 1.00 41.83 ? 189 GLN B CA 1 +ATOM 7204 C C . GLN B 1 189 ? 35.581 6.656 94.780 1.00 43.03 ? 189 GLN B C 1 +ATOM 7205 O O . GLN B 1 189 ? 35.368 6.048 95.833 1.00 43.97 ? 189 GLN B O 1 +ATOM 7206 C CB . GLN B 1 189 ? 36.854 5.278 93.134 1.00 41.47 ? 189 GLN B CB 1 +ATOM 7207 C CG . GLN B 1 189 ? 38.024 6.219 92.927 1.00 40.72 ? 189 GLN B CG 1 +ATOM 7208 C CD . GLN B 1 189 ? 39.281 5.443 92.556 1.00 42.16 ? 189 GLN B CD 1 +ATOM 7209 O OE1 . GLN B 1 189 ? 39.492 5.089 91.389 1.00 40.39 ? 189 GLN B OE1 1 +ATOM 7210 N NE2 . GLN B 1 189 ? 40.110 5.147 93.558 1.00 41.71 ? 189 GLN B NE2 1 +ATOM 7211 N N . ASP B 1 190 ? 35.871 7.951 94.760 1.00 44.28 ? 190 ASP B N 1 +ATOM 7212 C CA . ASP B 1 190 ? 35.954 8.677 96.024 1.00 45.92 ? 190 ASP B CA 1 +ATOM 7213 C C . ASP B 1 190 ? 34.596 8.736 96.711 1.00 46.00 ? 190 ASP B C 1 +ATOM 7214 O O . ASP B 1 190 ? 34.509 8.673 97.945 1.00 46.36 ? 190 ASP B O 1 +ATOM 7215 C CB . ASP B 1 190 ? 36.491 10.096 95.813 1.00 49.83 ? 190 ASP B CB 1 +ATOM 7216 C CG . ASP B 1 190 ? 37.960 10.111 95.419 1.00 55.25 ? 190 ASP B CG 1 +ATOM 7217 O OD1 . ASP B 1 190 ? 38.712 9.197 95.845 1.00 57.33 ? 190 ASP B OD1 1 +ATOM 7218 O OD2 . ASP B 1 190 ? 38.364 11.048 94.693 1.00 59.00 ? 190 ASP B OD2 1 +ATOM 7219 N N . LYS B 1 191 ? 33.533 8.852 95.915 1.00 44.46 ? 191 LYS B N 1 +ATOM 7220 C CA . LYS B 1 191 ? 32.185 8.920 96.462 1.00 42.82 ? 191 LYS B CA 1 +ATOM 7221 C C . LYS B 1 191 ? 31.788 7.606 97.110 1.00 41.28 ? 191 LYS B C 1 +ATOM 7222 O O . LYS B 1 191 ? 31.048 7.584 98.092 1.00 40.21 ? 191 LYS B O 1 +ATOM 7223 C CB . LYS B 1 191 ? 31.180 9.294 95.367 1.00 44.11 ? 191 LYS B CB 1 +ATOM 7224 C CG . LYS B 1 191 ? 31.156 10.781 95.038 1.00 44.48 ? 191 LYS B CG 1 +ATOM 7225 C CD . LYS B 1 191 ? 30.493 11.571 96.152 1.00 46.86 ? 191 LYS B CD 1 +ATOM 7226 C CE . LYS B 1 191 ? 30.480 13.064 95.860 1.00 47.01 ? 191 LYS B CE 1 +ATOM 7227 N NZ . LYS B 1 191 ? 31.856 13.637 95.835 1.00 49.27 ? 191 LYS B NZ 1 +ATOM 7228 N N . VAL B 1 192 ? 32.287 6.507 96.562 1.00 41.01 ? 192 VAL B N 1 +ATOM 7229 C CA . VAL B 1 192 ? 31.981 5.193 97.109 1.00 41.43 ? 192 VAL B CA 1 +ATOM 7230 C C . VAL B 1 192 ? 32.505 5.106 98.540 1.00 42.32 ? 192 VAL B C 1 +ATOM 7231 O O . VAL B 1 192 ? 31.803 4.656 99.448 1.00 41.96 ? 192 VAL B O 1 +ATOM 7232 C CB . VAL B 1 192 ? 32.624 4.079 96.263 1.00 40.96 ? 192 VAL B CB 1 +ATOM 7233 C CG1 . VAL B 1 192 ? 32.416 2.724 96.926 1.00 40.16 ? 192 VAL B CG1 1 +ATOM 7234 C CG2 . VAL B 1 192 ? 32.026 4.093 94.870 1.00 40.55 ? 192 VAL B CG2 1 +ATOM 7235 N N . VAL B 1 193 ? 33.738 5.557 98.738 1.00 43.18 ? 193 VAL B N 1 +ATOM 7236 C CA . VAL B 1 193 ? 34.351 5.523 100.058 1.00 43.24 ? 193 VAL B CA 1 +ATOM 7237 C C . VAL B 1 193 ? 33.696 6.526 100.999 1.00 43.23 ? 193 VAL B C 1 +ATOM 7238 O O . VAL B 1 193 ? 33.504 6.237 102.175 1.00 43.13 ? 193 VAL B O 1 +ATOM 7239 C CB . VAL B 1 193 ? 35.859 5.807 99.972 1.00 41.87 ? 193 VAL B CB 1 +ATOM 7240 C CG1 . VAL B 1 193 ? 36.485 5.685 101.346 1.00 42.38 ? 193 VAL B CG1 1 +ATOM 7241 C CG2 . VAL B 1 193 ? 36.504 4.825 99.013 1.00 42.20 ? 193 VAL B CG2 1 +ATOM 7242 N N . GLU B 1 194 ? 33.354 7.701 100.485 1.00 44.14 ? 194 GLU B N 1 +ATOM 7243 C CA . GLU B 1 194 ? 32.710 8.717 101.305 1.00 45.52 ? 194 GLU B CA 1 +ATOM 7244 C C . GLU B 1 194 ? 31.399 8.185 101.867 1.00 45.00 ? 194 GLU B C 1 +ATOM 7245 O O . GLU B 1 194 ? 31.099 8.354 103.051 1.00 45.51 ? 194 GLU B O 1 +ATOM 7246 C CB . GLU B 1 194 ? 32.423 9.969 100.481 1.00 49.12 ? 194 GLU B CB 1 +ATOM 7247 C CG . GLU B 1 194 ? 33.650 10.775 100.104 1.00 55.43 ? 194 GLU B CG 1 +ATOM 7248 C CD . GLU B 1 194 ? 33.330 11.887 99.107 1.00 61.18 ? 194 GLU B CD 1 +ATOM 7249 O OE1 . GLU B 1 194 ? 32.312 12.594 99.311 1.00 63.80 ? 194 GLU B OE1 1 +ATOM 7250 O OE2 . GLU B 1 194 ? 34.098 12.059 98.124 1.00 62.08 ? 194 GLU B OE2 1 +ATOM 7251 N N . LEU B 1 195 ? 30.619 7.531 101.015 1.00 44.58 ? 195 LEU B N 1 +ATOM 7252 C CA . LEU B 1 195 ? 29.334 6.992 101.441 1.00 44.01 ? 195 LEU B CA 1 +ATOM 7253 C C . LEU B 1 195 ? 29.511 5.909 102.489 1.00 43.76 ? 195 LEU B C 1 +ATOM 7254 O O . LEU B 1 195 ? 28.796 5.898 103.491 1.00 44.85 ? 195 LEU B O 1 +ATOM 7255 C CB . LEU B 1 195 ? 28.554 6.442 100.244 1.00 42.40 ? 195 LEU B CB 1 +ATOM 7256 C CG . LEU B 1 195 ? 27.182 5.862 100.598 1.00 43.42 ? 195 LEU B CG 1 +ATOM 7257 C CD1 . LEU B 1 195 ? 26.314 6.919 101.271 1.00 41.44 ? 195 LEU B CD1 1 +ATOM 7258 C CD2 . LEU B 1 195 ? 26.511 5.359 99.332 1.00 45.28 ? 195 LEU B CD2 1 +ATOM 7259 N N . VAL B 1 196 ? 30.457 4.998 102.265 1.00 43.78 ? 196 VAL B N 1 +ATOM 7260 C CA . VAL B 1 196 ? 30.701 3.926 103.221 1.00 42.67 ? 196 VAL B CA 1 +ATOM 7261 C C . VAL B 1 196 ? 31.099 4.518 104.569 1.00 43.53 ? 196 VAL B C 1 +ATOM 7262 O O . VAL B 1 196 ? 30.651 4.045 105.618 1.00 42.99 ? 196 VAL B O 1 +ATOM 7263 C CB . VAL B 1 196 ? 31.810 2.966 102.730 1.00 42.53 ? 196 VAL B CB 1 +ATOM 7264 C CG1 . VAL B 1 196 ? 32.216 2.021 103.857 1.00 43.78 ? 196 VAL B CG1 1 +ATOM 7265 C CG2 . VAL B 1 196 ? 31.303 2.145 101.556 1.00 41.69 ? 196 VAL B CG2 1 +ATOM 7266 N N . ASP B 1 197 ? 31.929 5.559 104.543 1.00 44.72 ? 197 ASP B N 1 +ATOM 7267 C CA . ASP B 1 197 ? 32.357 6.203 105.779 1.00 45.77 ? 197 ASP B CA 1 +ATOM 7268 C C . ASP B 1 197 ? 31.185 6.790 106.551 1.00 45.99 ? 197 ASP B C 1 +ATOM 7269 O O . ASP B 1 197 ? 31.074 6.595 107.766 1.00 46.29 ? 197 ASP B O 1 +ATOM 7270 C CB . ASP B 1 197 ? 33.385 7.301 105.502 1.00 47.61 ? 197 ASP B CB 1 +ATOM 7271 C CG . ASP B 1 197 ? 34.791 6.758 105.390 1.00 50.76 ? 197 ASP B CG 1 +ATOM 7272 O OD1 . ASP B 1 197 ? 35.067 5.730 106.045 1.00 54.00 ? 197 ASP B OD1 1 +ATOM 7273 O OD2 . ASP B 1 197 ? 35.622 7.358 104.670 1.00 53.06 ? 197 ASP B OD2 1 +ATOM 7274 N N . ILE B 1 198 ? 30.309 7.511 105.858 1.00 45.96 ? 198 ILE B N 1 +ATOM 7275 C CA . ILE B 1 198 ? 29.148 8.101 106.519 1.00 46.45 ? 198 ILE B CA 1 +ATOM 7276 C C . ILE B 1 198 ? 28.258 7.006 107.110 1.00 46.73 ? 198 ILE B C 1 +ATOM 7277 O O . ILE B 1 198 ? 27.788 7.129 108.240 1.00 47.42 ? 198 ILE B O 1 +ATOM 7278 C CB . ILE B 1 198 ? 28.320 8.961 105.549 1.00 46.12 ? 198 ILE B CB 1 +ATOM 7279 C CG1 . ILE B 1 198 ? 29.205 10.059 104.957 1.00 46.60 ? 198 ILE B CG1 1 +ATOM 7280 C CG2 . ILE B 1 198 ? 27.154 9.592 106.285 1.00 45.82 ? 198 ILE B CG2 1 +ATOM 7281 C CD1 . ILE B 1 198 ? 28.497 10.927 103.939 1.00 48.38 ? 198 ILE B CD1 1 +ATOM 7282 N N . MET B 1 199 ? 28.040 5.932 106.353 1.00 46.25 ? 199 MET B N 1 +ATOM 7283 C CA . MET B 1 199 ? 27.219 4.824 106.826 1.00 45.71 ? 199 MET B CA 1 +ATOM 7284 C C . MET B 1 199 ? 27.777 4.253 108.126 1.00 45.76 ? 199 MET B C 1 +ATOM 7285 O O . MET B 1 199 ? 27.047 4.068 109.104 1.00 45.12 ? 199 MET B O 1 +ATOM 7286 C CB . MET B 1 199 ? 27.161 3.707 105.777 1.00 45.78 ? 199 MET B CB 1 +ATOM 7287 C CG . MET B 1 199 ? 26.253 3.981 104.583 1.00 47.62 ? 199 MET B CG 1 +ATOM 7288 S SD . MET B 1 199 ? 24.484 3.926 105.002 1.00 50.37 ? 199 MET B SD 1 +ATOM 7289 C CE . MET B 1 199 ? 24.168 2.160 104.937 1.00 46.66 ? 199 MET B CE 1 +ATOM 7290 N N . GLN B 1 200 ? 29.075 3.967 108.134 1.00 46.74 ? 200 GLN B N 1 +ATOM 7291 C CA . GLN B 1 200 ? 29.707 3.398 109.318 1.00 47.16 ? 200 GLN B CA 1 +ATOM 7292 C C . GLN B 1 200 ? 29.710 4.388 110.480 1.00 47.46 ? 200 GLN B C 1 +ATOM 7293 O O . GLN B 1 200 ? 29.427 4.021 111.620 1.00 46.67 ? 200 GLN B O 1 +ATOM 7294 C CB . GLN B 1 200 ? 31.134 2.956 108.988 1.00 45.91 ? 200 GLN B CB 1 +ATOM 7295 C CG . GLN B 1 200 ? 31.190 1.899 107.905 1.00 46.99 ? 200 GLN B CG 1 +ATOM 7296 C CD . GLN B 1 200 ? 32.580 1.318 107.715 1.00 45.90 ? 200 GLN B CD 1 +ATOM 7297 O OE1 . GLN B 1 200 ? 33.564 2.052 107.595 1.00 46.78 ? 200 GLN B OE1 1 +ATOM 7298 N NE2 . GLN B 1 200 ? 32.664 -0.006 107.671 1.00 45.11 ? 200 GLN B NE2 1 +ATOM 7299 N N . LYS B 1 201 ? 30.011 5.646 110.184 1.00 47.98 ? 201 LYS B N 1 +ATOM 7300 C CA . LYS B 1 201 ? 30.048 6.660 111.220 1.00 49.95 ? 201 LYS B CA 1 +ATOM 7301 C C . LYS B 1 201 ? 28.694 6.794 111.913 1.00 51.37 ? 201 LYS B C 1 +ATOM 7302 O O . LYS B 1 201 ? 28.628 7.038 113.121 1.00 52.10 ? 201 LYS B O 1 +ATOM 7303 C CB . LYS B 1 201 ? 30.468 8.001 110.624 1.00 51.08 ? 201 LYS B CB 1 +ATOM 7304 C CG . LYS B 1 201 ? 30.508 9.128 111.631 1.00 54.97 ? 201 LYS B CG 1 +ATOM 7305 C CD . LYS B 1 201 ? 30.963 10.437 110.987 1.00 58.87 ? 201 LYS B CD 1 +ATOM 7306 C CE . LYS B 1 201 ? 30.958 11.589 111.995 1.00 60.95 ? 201 LYS B CE 1 +ATOM 7307 N NZ . LYS B 1 201 ? 29.594 11.848 112.547 1.00 62.73 ? 201 LYS B NZ 1 +ATOM 7308 N N . GLU B 1 202 ? 27.612 6.626 111.159 1.00 51.49 ? 202 GLU B N 1 +ATOM 7309 C CA . GLU B 1 202 ? 26.285 6.746 111.746 1.00 51.74 ? 202 GLU B CA 1 +ATOM 7310 C C . GLU B 1 202 ? 25.748 5.446 112.333 1.00 50.53 ? 202 GLU B C 1 +ATOM 7311 O O . GLU B 1 202 ? 24.565 5.342 112.667 1.00 50.52 ? 202 GLU B O 1 +ATOM 7312 C CB . GLU B 1 202 ? 25.299 7.344 110.734 1.00 53.60 ? 202 GLU B CB 1 +ATOM 7313 C CG . GLU B 1 202 ? 25.510 8.851 110.554 1.00 58.74 ? 202 GLU B CG 1 +ATOM 7314 C CD . GLU B 1 202 ? 24.385 9.542 109.793 1.00 61.64 ? 202 GLU B CD 1 +ATOM 7315 O OE1 . GLU B 1 202 ? 23.205 9.187 110.017 1.00 64.10 ? 202 GLU B OE1 1 +ATOM 7316 O OE2 . GLU B 1 202 ? 24.682 10.456 108.986 1.00 62.77 ? 202 GLU B OE2 1 +ATOM 7317 N N . GLY B 1 203 ? 26.622 4.454 112.460 1.00 49.52 ? 203 GLY B N 1 +ATOM 7318 C CA . GLY B 1 203 ? 26.214 3.198 113.063 1.00 48.32 ? 203 GLY B CA 1 +ATOM 7319 C C . GLY B 1 203 ? 25.710 2.054 112.201 1.00 48.15 ? 203 GLY B C 1 +ATOM 7320 O O . GLY B 1 203 ? 25.237 1.053 112.739 1.00 49.00 ? 203 GLY B O 1 +ATOM 7321 N N . PHE B 1 204 ? 25.789 2.173 110.881 1.00 47.01 ? 204 PHE B N 1 +ATOM 7322 C CA . PHE B 1 204 ? 25.330 1.073 110.038 1.00 44.95 ? 204 PHE B CA 1 +ATOM 7323 C C . PHE B 1 204 ? 26.483 0.155 109.674 1.00 44.15 ? 204 PHE B C 1 +ATOM 7324 O O . PHE B 1 204 ? 27.487 0.583 109.103 1.00 43.04 ? 204 PHE B O 1 +ATOM 7325 C CB . PHE B 1 204 ? 24.659 1.595 108.766 1.00 44.01 ? 204 PHE B CB 1 +ATOM 7326 C CG . PHE B 1 204 ? 23.396 2.350 109.027 1.00 43.53 ? 204 PHE B CG 1 +ATOM 7327 C CD1 . PHE B 1 204 ? 23.427 3.717 109.278 1.00 42.96 ? 204 PHE B CD1 1 +ATOM 7328 C CD2 . PHE B 1 204 ? 22.176 1.682 109.090 1.00 42.98 ? 204 PHE B CD2 1 +ATOM 7329 C CE1 . PHE B 1 204 ? 22.259 4.409 109.593 1.00 43.25 ? 204 PHE B CE1 1 +ATOM 7330 C CE2 . PHE B 1 204 ? 21.007 2.363 109.404 1.00 43.58 ? 204 PHE B CE2 1 +ATOM 7331 C CZ . PHE B 1 204 ? 21.050 3.731 109.657 1.00 42.62 ? 204 PHE B CZ 1 +ATOM 7332 N N . ARG B 1 205 ? 26.330 -1.111 110.024 1.00 44.33 ? 205 ARG B N 1 +ATOM 7333 C CA . ARG B 1 205 ? 27.339 -2.105 109.744 1.00 45.13 ? 205 ARG B CA 1 +ATOM 7334 C C . ARG B 1 205 ? 27.138 -2.593 108.307 1.00 45.45 ? 205 ARG B C 1 +ATOM 7335 O O . ARG B 1 205 ? 26.219 -3.370 108.013 1.00 45.67 ? 205 ARG B O 1 +ATOM 7336 C CB . ARG B 1 205 ? 27.201 -3.250 110.745 1.00 47.76 ? 205 ARG B CB 1 +ATOM 7337 C CG . ARG B 1 205 ? 28.266 -4.314 110.648 1.00 51.73 ? 205 ARG B CG 1 +ATOM 7338 C CD . ARG B 1 205 ? 28.079 -5.323 111.761 1.00 55.98 ? 205 ARG B CD 1 +ATOM 7339 N NE . ARG B 1 205 ? 28.867 -6.535 111.546 1.00 59.49 ? 205 ARG B NE 1 +ATOM 7340 C CZ . ARG B 1 205 ? 28.804 -7.609 112.329 1.00 61.29 ? 205 ARG B CZ 1 +ATOM 7341 N NH1 . ARG B 1 205 ? 27.989 -7.619 113.383 1.00 61.30 ? 205 ARG B NH1 1 +ATOM 7342 N NH2 . ARG B 1 205 ? 29.539 -8.680 112.048 1.00 62.38 ? 205 ARG B NH2 1 +ATOM 7343 N N . VAL B 1 206 ? 28.000 -2.119 107.414 1.00 44.30 ? 206 VAL B N 1 +ATOM 7344 C CA . VAL B 1 206 ? 27.941 -2.477 106.005 1.00 42.15 ? 206 VAL B CA 1 +ATOM 7345 C C . VAL B 1 206 ? 28.895 -3.625 105.687 1.00 42.11 ? 206 VAL B C 1 +ATOM 7346 O O . VAL B 1 206 ? 30.108 -3.512 105.884 1.00 43.04 ? 206 VAL B O 1 +ATOM 7347 C CB . VAL B 1 206 ? 28.310 -1.262 105.120 1.00 42.19 ? 206 VAL B CB 1 +ATOM 7348 C CG1 . VAL B 1 206 ? 28.280 -1.653 103.656 1.00 42.57 ? 206 VAL B CG1 1 +ATOM 7349 C CG2 . VAL B 1 206 ? 27.341 -0.121 105.377 1.00 41.59 ? 206 VAL B CG2 1 +ATOM 7350 N N . ALA B 1 207 ? 28.342 -4.723 105.179 1.00 40.93 ? 207 ALA B N 1 +ATOM 7351 C CA . ALA B 1 207 ? 29.128 -5.898 104.817 1.00 39.19 ? 207 ALA B CA 1 +ATOM 7352 C C . ALA B 1 207 ? 29.827 -5.739 103.467 1.00 39.63 ? 207 ALA B C 1 +ATOM 7353 O O . ALA B 1 207 ? 30.965 -6.184 103.296 1.00 39.73 ? 207 ALA B O 1 +ATOM 7354 C CB . ALA B 1 207 ? 28.237 -7.123 104.790 1.00 37.82 ? 207 ALA B CB 1 +ATOM 7355 N N . GLY B 1 208 ? 29.148 -5.106 102.512 1.00 39.70 ? 208 GLY B N 1 +ATOM 7356 C CA . GLY B 1 208 ? 29.733 -4.913 101.194 1.00 37.73 ? 208 GLY B CA 1 +ATOM 7357 C C . GLY B 1 208 ? 28.986 -3.903 100.344 1.00 37.75 ? 208 GLY B C 1 +ATOM 7358 O O . GLY B 1 208 ? 27.849 -3.534 100.641 1.00 39.30 ? 208 GLY B O 1 +ATOM 7359 N N . VAL B 1 209 ? 29.635 -3.432 99.289 1.00 37.89 ? 209 VAL B N 1 +ATOM 7360 C CA . VAL B 1 209 ? 29.009 -2.482 98.391 1.00 38.68 ? 209 VAL B CA 1 +ATOM 7361 C C . VAL B 1 209 ? 29.063 -3.072 96.989 1.00 38.43 ? 209 VAL B C 1 +ATOM 7362 O O . VAL B 1 209 ? 30.054 -3.716 96.607 1.00 37.63 ? 209 VAL B O 1 +ATOM 7363 C CB . VAL B 1 209 ? 29.725 -1.117 98.400 1.00 38.74 ? 209 VAL B CB 1 +ATOM 7364 C CG1 . VAL B 1 209 ? 29.852 -0.628 99.817 1.00 40.80 ? 209 VAL B CG1 1 +ATOM 7365 C CG2 . VAL B 1 209 ? 31.089 -1.227 97.760 1.00 40.72 ? 209 VAL B CG2 1 +ATOM 7366 N N . PHE B 1 210 ? 27.983 -2.867 96.237 1.00 37.37 ? 210 PHE B N 1 +ATOM 7367 C CA . PHE B 1 210 ? 27.894 -3.369 94.876 1.00 35.24 ? 210 PHE B CA 1 +ATOM 7368 C C . PHE B 1 210 ? 28.189 -2.252 93.892 1.00 35.55 ? 210 PHE B C 1 +ATOM 7369 O O . PHE B 1 210 ? 27.706 -1.128 94.036 1.00 36.50 ? 210 PHE B O 1 +ATOM 7370 C CB . PHE B 1 210 ? 26.497 -3.936 94.609 1.00 33.80 ? 210 PHE B CB 1 +ATOM 7371 C CG . PHE B 1 210 ? 26.241 -5.260 95.268 1.00 32.98 ? 210 PHE B CG 1 +ATOM 7372 C CD1 . PHE B 1 210 ? 26.315 -5.390 96.647 1.00 34.20 ? 210 PHE B CD1 1 +ATOM 7373 C CD2 . PHE B 1 210 ? 25.947 -6.389 94.504 1.00 33.62 ? 210 PHE B CD2 1 +ATOM 7374 C CE1 . PHE B 1 210 ? 26.101 -6.632 97.267 1.00 33.84 ? 210 PHE B CE1 1 +ATOM 7375 C CE2 . PHE B 1 210 ? 25.731 -7.637 95.109 1.00 34.51 ? 210 PHE B CE2 1 +ATOM 7376 C CZ . PHE B 1 210 ? 25.810 -7.757 96.497 1.00 33.36 ? 210 PHE B CZ 1 +ATOM 7377 N N . LEU B 1 211 ? 28.995 -2.566 92.890 1.00 35.38 ? 211 LEU B N 1 +ATOM 7378 C CA . LEU B 1 211 ? 29.343 -1.596 91.869 1.00 36.60 ? 211 LEU B CA 1 +ATOM 7379 C C . LEU B 1 211 ? 28.593 -1.984 90.596 1.00 37.38 ? 211 LEU B C 1 +ATOM 7380 O O . LEU B 1 211 ? 28.837 -3.063 90.036 1.00 37.53 ? 211 LEU B O 1 +ATOM 7381 C CB . LEU B 1 211 ? 30.857 -1.622 91.634 1.00 36.51 ? 211 LEU B CB 1 +ATOM 7382 C CG . LEU B 1 211 ? 31.656 -0.366 91.983 1.00 37.60 ? 211 LEU B CG 1 +ATOM 7383 C CD1 . LEU B 1 211 ? 31.187 0.226 93.307 1.00 34.99 ? 211 LEU B CD1 1 +ATOM 7384 C CD2 . LEU B 1 211 ? 33.127 -0.726 92.031 1.00 37.21 ? 211 LEU B CD2 1 +ATOM 7385 N N . ASP B 1 212 ? 27.678 -1.119 90.151 1.00 36.85 ? 212 ASP B N 1 +ATOM 7386 C CA . ASP B 1 212 ? 26.900 -1.392 88.946 1.00 36.57 ? 212 ASP B CA 1 +ATOM 7387 C C . ASP B 1 212 ? 27.688 -0.941 87.719 1.00 36.61 ? 212 ASP B C 1 +ATOM 7388 O O . ASP B 1 212 ? 28.773 -0.378 87.852 1.00 38.19 ? 212 ASP B O 1 +ATOM 7389 C CB . ASP B 1 212 ? 25.528 -0.698 89.002 1.00 36.70 ? 212 ASP B CB 1 +ATOM 7390 C CG . ASP B 1 212 ? 24.433 -1.497 88.279 1.00 36.57 ? 212 ASP B CG 1 +ATOM 7391 O OD1 . ASP B 1 212 ? 24.683 -1.998 87.160 1.00 35.41 ? 212 ASP B OD1 1 +ATOM 7392 O OD2 . ASP B 1 212 ? 23.311 -1.620 88.823 1.00 38.61 ? 212 ASP B OD2 1 +ATOM 7393 N N . ILE B 1 213 ? 27.126 -1.162 86.534 1.00 36.60 ? 213 ILE B N 1 +ATOM 7394 C CA . ILE B 1 213 ? 27.794 -0.871 85.268 1.00 35.57 ? 213 ILE B CA 1 +ATOM 7395 C C . ILE B 1 213 ? 28.504 0.450 85.009 1.00 36.14 ? 213 ILE B C 1 +ATOM 7396 O O . ILE B 1 213 ? 29.297 0.538 84.068 1.00 36.48 ? 213 ILE B O 1 +ATOM 7397 C CB . ILE B 1 213 ? 26.848 -1.153 84.072 1.00 35.95 ? 213 ILE B CB 1 +ATOM 7398 C CG1 . ILE B 1 213 ? 25.665 -0.184 84.074 1.00 36.67 ? 213 ILE B CG1 1 +ATOM 7399 C CG2 . ILE B 1 213 ? 26.343 -2.582 84.152 1.00 33.65 ? 213 ILE B CG2 1 +ATOM 7400 C CD1 . ILE B 1 213 ? 24.740 -0.364 82.878 1.00 36.49 ? 213 ILE B CD1 1 +ATOM 7401 N N . HIS B 1 214 ? 28.248 1.474 85.814 1.00 37.16 ? 214 HIS B N 1 +ATOM 7402 C CA . HIS B 1 214 ? 28.935 2.749 85.597 1.00 37.21 ? 214 HIS B CA 1 +ATOM 7403 C C . HIS B 1 214 ? 30.443 2.677 85.887 1.00 37.26 ? 214 HIS B C 1 +ATOM 7404 O O . HIS B 1 214 ? 31.189 3.578 85.501 1.00 38.16 ? 214 HIS B O 1 +ATOM 7405 C CB . HIS B 1 214 ? 28.337 3.853 86.469 1.00 37.84 ? 214 HIS B CB 1 +ATOM 7406 C CG . HIS B 1 214 ? 27.027 4.377 85.978 1.00 41.04 ? 214 HIS B CG 1 +ATOM 7407 N ND1 . HIS B 1 214 ? 25.835 3.719 86.191 1.00 41.35 ? 214 HIS B ND1 1 +ATOM 7408 C CD2 . HIS B 1 214 ? 26.716 5.514 85.312 1.00 42.17 ? 214 HIS B CD2 1 +ATOM 7409 C CE1 . HIS B 1 214 ? 24.845 4.430 85.682 1.00 41.89 ? 214 HIS B CE1 1 +ATOM 7410 N NE2 . HIS B 1 214 ? 25.353 5.523 85.143 1.00 42.69 ? 214 HIS B NE2 1 +ATOM 7411 N N . TYR B 1 215 ? 30.893 1.622 86.564 1.00 36.64 ? 215 TYR B N 1 +ATOM 7412 C CA . TYR B 1 215 ? 32.314 1.495 86.892 1.00 36.97 ? 215 TYR B CA 1 +ATOM 7413 C C . TYR B 1 215 ? 33.157 1.056 85.698 1.00 38.50 ? 215 TYR B C 1 +ATOM 7414 O O . TYR B 1 215 ? 34.371 1.264 85.677 1.00 38.82 ? 215 TYR B O 1 +ATOM 7415 C CB . TYR B 1 215 ? 32.510 0.513 88.054 1.00 35.58 ? 215 TYR B CB 1 +ATOM 7416 C CG . TYR B 1 215 ? 32.527 -0.955 87.681 1.00 33.40 ? 215 TYR B CG 1 +ATOM 7417 C CD1 . TYR B 1 215 ? 33.616 -1.514 87.015 1.00 33.54 ? 215 TYR B CD1 1 +ATOM 7418 C CD2 . TYR B 1 215 ? 31.476 -1.795 88.034 1.00 34.21 ? 215 TYR B CD2 1 +ATOM 7419 C CE1 . TYR B 1 215 ? 33.660 -2.872 86.711 1.00 32.11 ? 215 TYR B CE1 1 +ATOM 7420 C CE2 . TYR B 1 215 ? 31.510 -3.165 87.737 1.00 33.25 ? 215 TYR B CE2 1 +ATOM 7421 C CZ . TYR B 1 215 ? 32.608 -3.691 87.073 1.00 32.56 ? 215 TYR B CZ 1 +ATOM 7422 O OH . TYR B 1 215 ? 32.653 -5.035 86.756 1.00 31.56 ? 215 TYR B OH 1 +ATOM 7423 N N . MET B 1 216 ? 32.510 0.452 84.705 1.00 38.36 ? 216 MET B N 1 +ATOM 7424 C CA . MET B 1 216 ? 33.208 -0.024 83.520 1.00 39.82 ? 216 MET B CA 1 +ATOM 7425 C C . MET B 1 216 ? 33.551 1.086 82.543 1.00 40.30 ? 216 MET B C 1 +ATOM 7426 O O . MET B 1 216 ? 33.018 2.191 82.618 1.00 40.71 ? 216 MET B O 1 +ATOM 7427 C CB . MET B 1 216 ? 32.365 -1.068 82.782 1.00 40.39 ? 216 MET B CB 1 +ATOM 7428 C CG . MET B 1 216 ? 32.111 -2.347 83.557 1.00 43.98 ? 216 MET B CG 1 +ATOM 7429 S SD . MET B 1 216 ? 31.011 -3.501 82.656 1.00 48.77 ? 216 MET B SD 1 +ATOM 7430 C CE . MET B 1 216 ? 29.557 -3.402 83.628 1.00 47.68 ? 216 MET B CE 1 +ATOM 7431 N N . ASP B 1 217 ? 34.456 0.774 81.625 1.00 40.52 ? 217 ASP B N 1 +ATOM 7432 C CA . ASP B 1 217 ? 34.854 1.716 80.597 1.00 41.99 ? 217 ASP B CA 1 +ATOM 7433 C C . ASP B 1 217 ? 33.929 1.439 79.399 1.00 42.35 ? 217 ASP B C 1 +ATOM 7434 O O . ASP B 1 217 ? 34.078 0.428 78.708 1.00 41.38 ? 217 ASP B O 1 +ATOM 7435 C CB . ASP B 1 217 ? 36.327 1.484 80.232 1.00 42.64 ? 217 ASP B CB 1 +ATOM 7436 C CG . ASP B 1 217 ? 36.763 2.269 78.997 1.00 46.33 ? 217 ASP B CG 1 +ATOM 7437 O OD1 . ASP B 1 217 ? 36.139 3.308 78.679 1.00 46.63 ? 217 ASP B OD1 1 +ATOM 7438 O OD2 . ASP B 1 217 ? 37.750 1.850 78.349 1.00 48.16 ? 217 ASP B OD2 1 +ATOM 7439 N N . SER B 1 218 ? 32.961 2.325 79.175 1.00 42.68 ? 218 SER B N 1 +ATOM 7440 C CA . SER B 1 218 ? 32.011 2.154 78.069 1.00 43.97 ? 218 SER B CA 1 +ATOM 7441 C C . SER B 1 218 ? 31.269 0.818 78.176 1.00 42.72 ? 218 SER B C 1 +ATOM 7442 O O . SER B 1 218 ? 30.976 0.181 77.165 1.00 42.22 ? 218 SER B O 1 +ATOM 7443 C CB . SER B 1 218 ? 32.736 2.202 76.717 1.00 45.24 ? 218 SER B CB 1 +ATOM 7444 O OG . SER B 1 218 ? 33.368 3.454 76.506 1.00 49.69 ? 218 SER B OG 1 +ATOM 7445 N N . TYR B 1 219 ? 30.994 0.389 79.402 1.00 41.56 ? 219 TYR B N 1 +ATOM 7446 C CA . TYR B 1 219 ? 30.285 -0.863 79.642 1.00 41.28 ? 219 TYR B CA 1 +ATOM 7447 C C . TYR B 1 219 ? 31.041 -2.115 79.209 1.00 40.54 ? 219 TYR B C 1 +ATOM 7448 O O . TYR B 1 219 ? 30.440 -3.177 79.041 1.00 39.48 ? 219 TYR B O 1 +ATOM 7449 C CB . TYR B 1 219 ? 28.913 -0.825 78.957 1.00 41.70 ? 219 TYR B CB 1 +ATOM 7450 C CG . TYR B 1 219 ? 28.115 0.396 79.332 1.00 42.26 ? 219 TYR B CG 1 +ATOM 7451 C CD1 . TYR B 1 219 ? 27.671 0.588 80.640 1.00 42.88 ? 219 TYR B CD1 1 +ATOM 7452 C CD2 . TYR B 1 219 ? 27.864 1.397 78.396 1.00 43.18 ? 219 TYR B CD2 1 +ATOM 7453 C CE1 . TYR B 1 219 ? 27.002 1.758 81.013 1.00 45.35 ? 219 TYR B CE1 1 +ATOM 7454 C CE2 . TYR B 1 219 ? 27.193 2.569 78.754 1.00 44.90 ? 219 TYR B CE2 1 +ATOM 7455 C CZ . TYR B 1 219 ? 26.769 2.744 80.064 1.00 46.04 ? 219 TYR B CZ 1 +ATOM 7456 O OH . TYR B 1 219 ? 26.126 3.905 80.428 1.00 47.58 ? 219 TYR B OH 1 +ATOM 7457 N N . LYS B 1 220 ? 32.356 -1.995 79.028 1.00 41.32 ? 220 LYS B N 1 +ATOM 7458 C CA . LYS B 1 220 ? 33.173 -3.144 78.641 1.00 40.28 ? 220 LYS B CA 1 +ATOM 7459 C C . LYS B 1 220 ? 33.517 -4.003 79.861 1.00 39.31 ? 220 LYS B C 1 +ATOM 7460 O O . LYS B 1 220 ? 34.104 -3.522 80.831 1.00 39.55 ? 220 LYS B O 1 +ATOM 7461 C CB . LYS B 1 220 ? 34.461 -2.679 77.951 1.00 41.78 ? 220 LYS B CB 1 +ATOM 7462 C CG . LYS B 1 220 ? 34.240 -2.197 76.528 1.00 44.63 ? 220 LYS B CG 1 +ATOM 7463 C CD . LYS B 1 220 ? 35.537 -1.859 75.817 1.00 45.88 ? 220 LYS B CD 1 +ATOM 7464 C CE . LYS B 1 220 ? 36.115 -0.549 76.314 1.00 49.04 ? 220 LYS B CE 1 +ATOM 7465 N NZ . LYS B 1 220 ? 37.169 -0.036 75.379 1.00 50.46 ? 220 LYS B NZ 1 +ATOM 7466 N N . LEU B 1 221 ? 33.146 -5.276 79.814 1.00 37.36 ? 221 LEU B N 1 +ATOM 7467 C CA . LEU B 1 221 ? 33.435 -6.177 80.918 1.00 37.18 ? 221 LEU B CA 1 +ATOM 7468 C C . LEU B 1 221 ? 34.923 -6.199 81.254 1.00 36.20 ? 221 LEU B C 1 +ATOM 7469 O O . LEU B 1 221 ? 35.778 -6.074 80.379 1.00 35.79 ? 221 LEU B O 1 +ATOM 7470 C CB . LEU B 1 221 ? 32.981 -7.605 80.590 1.00 36.30 ? 221 LEU B CB 1 +ATOM 7471 C CG . LEU B 1 221 ? 31.519 -7.798 80.179 1.00 38.65 ? 221 LEU B CG 1 +ATOM 7472 C CD1 . LEU B 1 221 ? 31.207 -9.293 80.108 1.00 38.45 ? 221 LEU B CD1 1 +ATOM 7473 C CD2 . LEU B 1 221 ? 30.590 -7.109 81.180 1.00 37.75 ? 221 LEU B CD2 1 +ATOM 7474 N N . PHE B 1 222 ? 35.216 -6.343 82.541 1.00 36.09 ? 222 PHE B N 1 +ATOM 7475 C CA . PHE B 1 222 ? 36.584 -6.418 83.027 1.00 34.66 ? 222 PHE B CA 1 +ATOM 7476 C C . PHE B 1 222 ? 37.454 -5.214 82.703 1.00 35.60 ? 222 PHE B C 1 +ATOM 7477 O O . PHE B 1 222 ? 38.617 -5.363 82.313 1.00 36.11 ? 222 PHE B O 1 +ATOM 7478 C CB . PHE B 1 222 ? 37.231 -7.695 82.492 1.00 33.86 ? 222 PHE B CB 1 +ATOM 7479 C CG . PHE B 1 222 ? 36.376 -8.916 82.680 1.00 32.33 ? 222 PHE B CG 1 +ATOM 7480 C CD1 . PHE B 1 222 ? 35.967 -9.297 83.950 1.00 31.55 ? 222 PHE B CD1 1 +ATOM 7481 C CD2 . PHE B 1 222 ? 35.952 -9.666 81.586 1.00 32.70 ? 222 PHE B CD2 1 +ATOM 7482 C CE1 . PHE B 1 222 ? 35.139 -10.416 84.133 1.00 34.03 ? 222 PHE B CE1 1 +ATOM 7483 C CE2 . PHE B 1 222 ? 35.129 -10.778 81.754 1.00 32.26 ? 222 PHE B CE2 1 +ATOM 7484 C CZ . PHE B 1 222 ? 34.720 -11.156 83.032 1.00 31.48 ? 222 PHE B CZ 1 +ATOM 7485 N N . THR B 1 223 ? 36.888 -4.021 82.848 1.00 35.04 ? 223 THR B N 1 +ATOM 7486 C CA . THR B 1 223 ? 37.637 -2.791 82.626 1.00 35.24 ? 223 THR B CA 1 +ATOM 7487 C C . THR B 1 223 ? 37.170 -1.801 83.672 1.00 35.64 ? 223 THR B C 1 +ATOM 7488 O O . THR B 1 223 ? 36.100 -1.973 84.265 1.00 37.22 ? 223 THR B O 1 +ATOM 7489 C CB . THR B 1 223 ? 37.380 -2.159 81.240 1.00 37.06 ? 223 THR B CB 1 +ATOM 7490 O OG1 . THR B 1 223 ? 36.039 -1.645 81.187 1.00 38.68 ? 223 THR B OG1 1 +ATOM 7491 C CG2 . THR B 1 223 ? 37.597 -3.185 80.132 1.00 36.29 ? 223 THR B CG2 1 +ATOM 7492 N N . TRP B 1 224 ? 37.973 -0.771 83.908 1.00 35.02 ? 224 TRP B N 1 +ATOM 7493 C CA . TRP B 1 224 ? 37.615 0.258 84.866 1.00 35.07 ? 224 TRP B CA 1 +ATOM 7494 C C . TRP B 1 224 ? 37.510 1.580 84.132 1.00 36.34 ? 224 TRP B C 1 +ATOM 7495 O O . TRP B 1 224 ? 38.347 1.907 83.294 1.00 37.03 ? 224 TRP B O 1 +ATOM 7496 C CB . TRP B 1 224 ? 38.666 0.383 85.966 1.00 35.10 ? 224 TRP B CB 1 +ATOM 7497 C CG . TRP B 1 224 ? 38.727 -0.773 86.895 1.00 33.01 ? 224 TRP B CG 1 +ATOM 7498 C CD1 . TRP B 1 224 ? 39.611 -1.817 86.855 1.00 33.62 ? 224 TRP B CD1 1 +ATOM 7499 C CD2 . TRP B 1 224 ? 37.882 -1.000 88.026 1.00 31.33 ? 224 TRP B CD2 1 +ATOM 7500 N NE1 . TRP B 1 224 ? 39.369 -2.682 87.905 1.00 33.40 ? 224 TRP B NE1 1 +ATOM 7501 C CE2 . TRP B 1 224 ? 38.313 -2.204 88.635 1.00 32.37 ? 224 TRP B CE2 1 +ATOM 7502 C CE3 . TRP B 1 224 ? 36.802 -0.303 88.586 1.00 31.62 ? 224 TRP B CE3 1 +ATOM 7503 C CZ2 . TRP B 1 224 ? 37.699 -2.727 89.779 1.00 33.73 ? 224 TRP B CZ2 1 +ATOM 7504 C CZ3 . TRP B 1 224 ? 36.189 -0.820 89.723 1.00 32.46 ? 224 TRP B CZ3 1 +ATOM 7505 C CH2 . TRP B 1 224 ? 36.641 -2.025 90.308 1.00 34.06 ? 224 TRP B CH2 1 +ATOM 7506 N N . HIS B 1 225 ? 36.470 2.339 84.436 1.00 37.63 ? 225 HIS B N 1 +ATOM 7507 C CA . HIS B 1 225 ? 36.282 3.631 83.802 1.00 39.12 ? 225 HIS B CA 1 +ATOM 7508 C C . HIS B 1 225 ? 37.498 4.489 84.157 1.00 41.08 ? 225 HIS B C 1 +ATOM 7509 O O . HIS B 1 225 ? 37.771 4.742 85.334 1.00 41.32 ? 225 HIS B O 1 +ATOM 7510 C CB . HIS B 1 225 ? 34.993 4.266 84.327 1.00 39.09 ? 225 HIS B CB 1 +ATOM 7511 C CG . HIS B 1 225 ? 34.566 5.484 83.572 1.00 39.74 ? 225 HIS B CG 1 +ATOM 7512 N ND1 . HIS B 1 225 ? 35.220 6.692 83.675 1.00 40.29 ? 225 HIS B ND1 1 +ATOM 7513 C CD2 . HIS B 1 225 ? 33.543 5.682 82.707 1.00 38.62 ? 225 HIS B CD2 1 +ATOM 7514 C CE1 . HIS B 1 225 ? 34.618 7.584 82.908 1.00 38.01 ? 225 HIS B CE1 1 +ATOM 7515 N NE2 . HIS B 1 225 ? 33.597 6.996 82.311 1.00 39.76 ? 225 HIS B NE2 1 +ATOM 7516 N N . PRO B 1 226 ? 38.241 4.954 83.142 1.00 42.62 ? 226 PRO B N 1 +ATOM 7517 C CA . PRO B 1 226 ? 39.440 5.783 83.330 1.00 43.28 ? 226 PRO B CA 1 +ATOM 7518 C C . PRO B 1 226 ? 39.261 7.065 84.149 1.00 44.26 ? 226 PRO B C 1 +ATOM 7519 O O . PRO B 1 226 ? 40.232 7.591 84.696 1.00 43.97 ? 226 PRO B O 1 +ATOM 7520 C CB . PRO B 1 226 ? 39.900 6.054 81.895 1.00 43.06 ? 226 PRO B CB 1 +ATOM 7521 C CG . PRO B 1 226 ? 38.615 6.035 81.121 1.00 42.97 ? 226 PRO B CG 1 +ATOM 7522 C CD . PRO B 1 226 ? 37.908 4.835 81.713 1.00 43.10 ? 226 PRO B CD 1 +ATOM 7523 N N . TYR B 1 227 ? 38.022 7.547 84.261 1.00 45.93 ? 227 TYR B N 1 +ATOM 7524 C CA . TYR B 1 227 ? 37.722 8.770 85.020 1.00 47.24 ? 227 TYR B CA 1 +ATOM 7525 C C . TYR B 1 227 ? 37.035 8.541 86.363 1.00 47.39 ? 227 TYR B C 1 +ATOM 7526 O O . TYR B 1 227 ? 37.303 9.250 87.331 1.00 48.40 ? 227 TYR B O 1 +ATOM 7527 C CB . TYR B 1 227 ? 36.826 9.696 84.214 1.00 49.21 ? 227 TYR B CB 1 +ATOM 7528 C CG . TYR B 1 227 ? 37.493 10.350 83.042 1.00 53.26 ? 227 TYR B CG 1 +ATOM 7529 C CD1 . TYR B 1 227 ? 38.197 11.542 83.196 1.00 54.87 ? 227 TYR B CD1 1 +ATOM 7530 C CD2 . TYR B 1 227 ? 37.377 9.807 81.763 1.00 54.85 ? 227 TYR B CD2 1 +ATOM 7531 C CE1 . TYR B 1 227 ? 38.764 12.186 82.098 1.00 56.94 ? 227 TYR B CE1 1 +ATOM 7532 C CE2 . TYR B 1 227 ? 37.938 10.438 80.659 1.00 56.58 ? 227 TYR B CE2 1 +ATOM 7533 C CZ . TYR B 1 227 ? 38.626 11.629 80.831 1.00 57.85 ? 227 TYR B CZ 1 +ATOM 7534 O OH . TYR B 1 227 ? 39.156 12.273 79.736 1.00 60.46 ? 227 TYR B OH 1 +ATOM 7535 N N . ARG B 1 228 ? 36.122 7.579 86.416 1.00 46.30 ? 228 ARG B N 1 +ATOM 7536 C CA . ARG B 1 228 ? 35.403 7.298 87.650 1.00 44.64 ? 228 ARG B CA 1 +ATOM 7537 C C . ARG B 1 228 ? 36.219 6.408 88.557 1.00 44.38 ? 228 ARG B C 1 +ATOM 7538 O O . ARG B 1 228 ? 36.181 6.553 89.781 1.00 44.52 ? 228 ARG B O 1 +ATOM 7539 C CB . ARG B 1 228 ? 34.071 6.604 87.353 1.00 45.13 ? 228 ARG B CB 1 +ATOM 7540 C CG . ARG B 1 228 ? 33.083 7.468 86.616 1.00 44.16 ? 228 ARG B CG 1 +ATOM 7541 C CD . ARG B 1 228 ? 31.939 6.660 86.040 1.00 41.20 ? 228 ARG B CD 1 +ATOM 7542 N NE . ARG B 1 228 ? 31.156 7.510 85.153 1.00 41.70 ? 228 ARG B NE 1 +ATOM 7543 C CZ . ARG B 1 228 ? 30.311 7.069 84.226 1.00 40.06 ? 228 ARG B CZ 1 +ATOM 7544 N NH1 . ARG B 1 228 ? 30.121 5.769 84.052 1.00 36.91 ? 228 ARG B NH1 1 +ATOM 7545 N NH2 . ARG B 1 228 ? 29.668 7.941 83.461 1.00 38.64 ? 228 ARG B NH2 1 +ATOM 7546 N N . PHE B 1 229 ? 36.948 5.476 87.953 1.00 43.08 ? 229 PHE B N 1 +ATOM 7547 C CA . PHE B 1 229 ? 37.759 4.549 88.719 1.00 42.53 ? 229 PHE B CA 1 +ATOM 7548 C C . PHE B 1 229 ? 39.167 4.430 88.168 1.00 42.47 ? 229 PHE B C 1 +ATOM 7549 O O . PHE B 1 229 ? 39.596 3.352 87.750 1.00 41.47 ? 229 PHE B O 1 +ATOM 7550 C CB . PHE B 1 229 ? 37.082 3.175 88.758 1.00 42.65 ? 229 PHE B CB 1 +ATOM 7551 C CG . PHE B 1 229 ? 35.731 3.192 89.411 1.00 42.08 ? 229 PHE B CG 1 +ATOM 7552 C CD1 . PHE B 1 229 ? 34.613 3.638 88.718 1.00 41.82 ? 229 PHE B CD1 1 +ATOM 7553 C CD2 . PHE B 1 229 ? 35.581 2.802 90.738 1.00 42.62 ? 229 PHE B CD2 1 +ATOM 7554 C CE1 . PHE B 1 229 ? 33.368 3.696 89.336 1.00 41.45 ? 229 PHE B CE1 1 +ATOM 7555 C CE2 . PHE B 1 229 ? 34.337 2.857 91.363 1.00 41.79 ? 229 PHE B CE2 1 +ATOM 7556 C CZ . PHE B 1 229 ? 33.231 3.304 90.660 1.00 41.76 ? 229 PHE B CZ 1 +ATOM 7557 N N . PRO B 1 230 ? 39.911 5.545 88.165 1.00 43.98 ? 230 PRO B N 1 +ATOM 7558 C CA . PRO B 1 230 ? 41.284 5.555 87.661 1.00 45.08 ? 230 PRO B CA 1 +ATOM 7559 C C . PRO B 1 230 ? 42.228 4.755 88.555 1.00 47.51 ? 230 PRO B C 1 +ATOM 7560 O O . PRO B 1 230 ? 43.243 4.246 88.081 1.00 48.53 ? 230 PRO B O 1 +ATOM 7561 C CB . PRO B 1 230 ? 41.628 7.041 87.640 1.00 43.72 ? 230 PRO B CB 1 +ATOM 7562 C CG . PRO B 1 230 ? 40.866 7.563 88.807 1.00 43.65 ? 230 PRO B CG 1 +ATOM 7563 C CD . PRO B 1 230 ? 39.528 6.880 88.661 1.00 43.82 ? 230 PRO B CD 1 +ATOM 7564 N N . GLU B 1 231 ? 41.882 4.629 89.838 1.00 49.28 ? 231 GLU B N 1 +ATOM 7565 C CA . GLU B 1 231 ? 42.717 3.901 90.797 1.00 51.14 ? 231 GLU B CA 1 +ATOM 7566 C C . GLU B 1 231 ? 41.925 2.891 91.608 1.00 50.44 ? 231 GLU B C 1 +ATOM 7567 O O . GLU B 1 231 ? 41.779 3.032 92.823 1.00 49.72 ? 231 GLU B O 1 +ATOM 7568 C CB . GLU B 1 231 ? 43.400 4.881 91.753 1.00 53.71 ? 231 GLU B CB 1 +ATOM 7569 C CG . GLU B 1 231 ? 44.372 5.838 91.079 1.00 58.43 ? 231 GLU B CG 1 +ATOM 7570 C CD . GLU B 1 231 ? 44.963 6.846 92.051 1.00 61.99 ? 231 GLU B CD 1 +ATOM 7571 O OE1 . GLU B 1 231 ? 45.552 6.417 93.069 1.00 64.89 ? 231 GLU B OE1 1 +ATOM 7572 O OE2 . GLU B 1 231 ? 44.845 8.067 91.800 1.00 62.62 ? 231 GLU B OE2 1 +ATOM 7573 N N . PRO B 1 232 ? 41.416 1.844 90.945 1.00 50.40 ? 232 PRO B N 1 +ATOM 7574 C CA . PRO B 1 232 ? 40.628 0.795 91.602 1.00 50.66 ? 232 PRO B CA 1 +ATOM 7575 C C . PRO B 1 232 ? 41.324 0.064 92.753 1.00 52.27 ? 232 PRO B C 1 +ATOM 7576 O O . PRO B 1 232 ? 40.688 -0.295 93.754 1.00 51.97 ? 232 PRO B O 1 +ATOM 7577 C CB . PRO B 1 232 ? 40.268 -0.143 90.444 1.00 49.32 ? 232 PRO B CB 1 +ATOM 7578 C CG . PRO B 1 232 ? 41.389 0.066 89.462 1.00 48.44 ? 232 PRO B CG 1 +ATOM 7579 C CD . PRO B 1 232 ? 41.582 1.558 89.508 1.00 48.65 ? 232 PRO B CD 1 +ATOM 7580 N N . LYS B 1 233 ? 42.626 -0.163 92.610 1.00 53.50 ? 233 LYS B N 1 +ATOM 7581 C CA . LYS B 1 233 ? 43.385 -0.864 93.638 1.00 53.47 ? 233 LYS B CA 1 +ATOM 7582 C C . LYS B 1 233 ? 43.288 -0.073 94.938 1.00 51.93 ? 233 LYS B C 1 +ATOM 7583 O O . LYS B 1 233 ? 43.154 -0.643 96.023 1.00 50.32 ? 233 LYS B O 1 +ATOM 7584 C CB . LYS B 1 233 ? 44.843 -1.006 93.201 1.00 56.90 ? 233 LYS B CB 1 +ATOM 7585 C CG . LYS B 1 233 ? 45.527 -2.211 93.811 1.00 62.40 ? 233 LYS B CG 1 +ATOM 7586 C CD . LYS B 1 233 ? 46.974 -2.347 93.359 1.00 64.55 ? 233 LYS B CD 1 +ATOM 7587 C CE . LYS B 1 233 ? 47.603 -3.606 93.954 1.00 66.05 ? 233 LYS B CE 1 +ATOM 7588 N NZ . LYS B 1 233 ? 47.454 -3.652 95.442 1.00 67.27 ? 233 LYS B NZ 1 +ATOM 7589 N N . LYS B 1 234 ? 43.343 1.249 94.810 1.00 50.74 ? 234 LYS B N 1 +ATOM 7590 C CA . LYS B 1 234 ? 43.239 2.147 95.950 1.00 49.87 ? 234 LYS B CA 1 +ATOM 7591 C C . LYS B 1 234 ? 41.863 2.007 96.605 1.00 50.86 ? 234 LYS B C 1 +ATOM 7592 O O . LYS B 1 234 ? 41.746 1.972 97.830 1.00 51.54 ? 234 LYS B O 1 +ATOM 7593 C CB . LYS B 1 234 ? 43.446 3.590 95.493 1.00 48.50 ? 234 LYS B CB 1 +ATOM 7594 C CG . LYS B 1 234 ? 43.198 4.613 96.577 1.00 49.64 ? 234 LYS B CG 1 +ATOM 7595 C CD . LYS B 1 234 ? 43.331 6.035 96.064 1.00 50.38 ? 234 LYS B CD 1 +ATOM 7596 C CE . LYS B 1 234 ? 43.051 7.033 97.183 1.00 52.41 ? 234 LYS B CE 1 +ATOM 7597 N NZ . LYS B 1 234 ? 43.106 8.452 96.722 1.00 54.37 ? 234 LYS B NZ 1 +ATOM 7598 N N . LEU B 1 235 ? 40.823 1.935 95.777 1.00 51.25 ? 235 LEU B N 1 +ATOM 7599 C CA . LEU B 1 235 ? 39.454 1.795 96.259 1.00 50.49 ? 235 LEU B CA 1 +ATOM 7600 C C . LEU B 1 235 ? 39.279 0.509 97.041 1.00 50.45 ? 235 LEU B C 1 +ATOM 7601 O O . LEU B 1 235 ? 38.689 0.504 98.119 1.00 49.92 ? 235 LEU B O 1 +ATOM 7602 C CB . LEU B 1 235 ? 38.475 1.800 95.080 1.00 50.92 ? 235 LEU B CB 1 +ATOM 7603 C CG . LEU B 1 235 ? 37.056 1.272 95.334 1.00 49.58 ? 235 LEU B CG 1 +ATOM 7604 C CD1 . LEU B 1 235 ? 36.349 2.112 96.386 1.00 48.39 ? 235 LEU B CD1 1 +ATOM 7605 C CD2 . LEU B 1 235 ? 36.288 1.287 94.025 1.00 50.24 ? 235 LEU B CD2 1 +ATOM 7606 N N . ILE B 1 236 ? 39.785 -0.583 96.479 1.00 50.38 ? 236 ILE B N 1 +ATOM 7607 C CA . ILE B 1 236 ? 39.682 -1.890 97.113 1.00 51.86 ? 236 ILE B CA 1 +ATOM 7608 C C . ILE B 1 236 ? 40.382 -1.916 98.480 1.00 53.83 ? 236 ILE B C 1 +ATOM 7609 O O . ILE B 1 236 ? 39.900 -2.551 99.416 1.00 53.69 ? 236 ILE B O 1 +ATOM 7610 C CB . ILE B 1 236 ? 40.246 -2.993 96.170 1.00 50.88 ? 236 ILE B CB 1 +ATOM 7611 C CG1 . ILE B 1 236 ? 39.442 -2.993 94.857 1.00 49.76 ? 236 ILE B CG1 1 +ATOM 7612 C CG2 . ILE B 1 236 ? 40.172 -4.366 96.842 1.00 50.06 ? 236 ILE B CG2 1 +ATOM 7613 C CD1 . ILE B 1 236 ? 39.897 -3.998 93.820 1.00 46.24 ? 236 ILE B CD1 1 +ATOM 7614 N N . ASP B 1 237 ? 41.512 -1.224 98.603 1.00 55.96 ? 237 ASP B N 1 +ATOM 7615 C CA . ASP B 1 237 ? 42.214 -1.174 99.881 1.00 57.24 ? 237 ASP B CA 1 +ATOM 7616 C C . ASP B 1 237 ? 41.441 -0.279 100.844 1.00 56.65 ? 237 ASP B C 1 +ATOM 7617 O O . ASP B 1 237 ? 41.268 -0.622 102.013 1.00 56.28 ? 237 ASP B O 1 +ATOM 7618 C CB . ASP B 1 237 ? 43.647 -0.653 99.706 1.00 61.05 ? 237 ASP B CB 1 +ATOM 7619 C CG . ASP B 1 237 ? 44.538 -1.631 98.939 1.00 65.69 ? 237 ASP B CG 1 +ATOM 7620 O OD1 . ASP B 1 237 ? 44.524 -2.844 99.267 1.00 67.29 ? 237 ASP B OD1 1 +ATOM 7621 O OD2 . ASP B 1 237 ? 45.260 -1.187 98.013 1.00 67.98 ? 237 ASP B OD2 1 +ATOM 7622 N N . GLU B 1 238 ? 40.972 0.867 100.354 1.00 56.13 ? 238 GLU B N 1 +ATOM 7623 C CA . GLU B 1 238 ? 40.191 1.779 101.188 1.00 56.60 ? 238 GLU B CA 1 +ATOM 7624 C C . GLU B 1 238 ? 38.988 1.064 101.801 1.00 54.88 ? 238 GLU B C 1 +ATOM 7625 O O . GLU B 1 238 ? 38.674 1.266 102.969 1.00 54.75 ? 238 GLU B O 1 +ATOM 7626 C CB . GLU B 1 238 ? 39.702 2.979 100.370 1.00 58.92 ? 238 GLU B CB 1 +ATOM 7627 C CG . GLU B 1 238 ? 40.786 3.987 100.020 1.00 64.15 ? 238 GLU B CG 1 +ATOM 7628 C CD . GLU B 1 238 ? 40.309 5.061 99.040 1.00 68.54 ? 238 GLU B CD 1 +ATOM 7629 O OE1 . GLU B 1 238 ? 39.932 4.708 97.896 1.00 70.83 ? 238 GLU B OE1 1 +ATOM 7630 O OE2 . GLU B 1 238 ? 40.312 6.261 99.408 1.00 70.78 ? 238 GLU B OE2 1 +ATOM 7631 N N . LEU B 1 239 ? 38.323 0.221 101.014 1.00 54.45 ? 239 LEU B N 1 +ATOM 7632 C CA . LEU B 1 239 ? 37.150 -0.516 101.487 1.00 53.72 ? 239 LEU B CA 1 +ATOM 7633 C C . LEU B 1 239 ? 37.513 -1.696 102.371 1.00 53.11 ? 239 LEU B C 1 +ATOM 7634 O O . LEU B 1 239 ? 36.834 -1.962 103.363 1.00 52.34 ? 239 LEU B O 1 +ATOM 7635 C CB . LEU B 1 239 ? 36.312 -1.031 100.309 1.00 53.66 ? 239 LEU B CB 1 +ATOM 7636 C CG . LEU B 1 239 ? 35.582 -0.027 99.412 1.00 54.51 ? 239 LEU B CG 1 +ATOM 7637 C CD1 . LEU B 1 239 ? 34.946 -0.776 98.256 1.00 53.93 ? 239 LEU B CD1 1 +ATOM 7638 C CD2 . LEU B 1 239 ? 34.522 0.735 100.212 1.00 54.20 ? 239 LEU B CD2 1 +ATOM 7639 N N . HIS B 1 240 ? 38.565 -2.415 101.993 1.00 52.91 ? 240 HIS B N 1 +ATOM 7640 C CA . HIS B 1 240 ? 39.015 -3.577 102.758 1.00 54.15 ? 240 HIS B CA 1 +ATOM 7641 C C . HIS B 1 240 ? 39.550 -3.135 104.105 1.00 53.68 ? 240 HIS B C 1 +ATOM 7642 O O . HIS B 1 240 ? 39.479 -3.864 105.095 1.00 51.57 ? 240 HIS B O 1 +ATOM 7643 C CB . HIS B 1 240 ? 40.097 -4.338 101.987 1.00 54.32 ? 240 HIS B CB 1 +ATOM 7644 C CG . HIS B 1 240 ? 39.550 -5.352 101.032 1.00 56.24 ? 240 HIS B CG 1 +ATOM 7645 N ND1 . HIS B 1 240 ? 40.294 -5.881 100.000 1.00 56.35 ? 240 HIS B ND1 1 +ATOM 7646 C CD2 . HIS B 1 240 ? 38.333 -5.943 100.961 1.00 57.06 ? 240 HIS B CD2 1 +ATOM 7647 C CE1 . HIS B 1 240 ? 39.559 -6.753 99.333 1.00 56.81 ? 240 HIS B CE1 1 +ATOM 7648 N NE2 . HIS B 1 240 ? 38.365 -6.809 99.896 1.00 58.13 ? 240 HIS B NE2 1 +ATOM 7649 N N . LYS B 1 241 ? 40.080 -1.922 104.124 1.00 54.61 ? 241 LYS B N 1 +ATOM 7650 C CA . LYS B 1 241 ? 40.627 -1.337 105.332 1.00 56.36 ? 241 LYS B CA 1 +ATOM 7651 C C . LYS B 1 241 ? 39.461 -1.130 106.298 1.00 55.61 ? 241 LYS B C 1 +ATOM 7652 O O . LYS B 1 241 ? 39.616 -1.253 107.510 1.00 56.37 ? 241 LYS B O 1 +ATOM 7653 C CB . LYS B 1 241 ? 41.284 -0.008 104.973 1.00 59.35 ? 241 LYS B CB 1 +ATOM 7654 C CG . LYS B 1 241 ? 42.386 0.453 105.892 1.00 62.99 ? 241 LYS B CG 1 +ATOM 7655 C CD . LYS B 1 241 ? 43.254 1.489 105.175 1.00 66.52 ? 241 LYS B CD 1 +ATOM 7656 C CE . LYS B 1 241 ? 42.419 2.638 104.596 1.00 67.91 ? 241 LYS B CE 1 +ATOM 7657 N NZ . LYS B 1 241 ? 43.241 3.600 103.797 1.00 68.30 ? 241 LYS B NZ 1 +ATOM 7658 N N . ARG B 1 242 ? 38.284 -0.844 105.745 1.00 53.86 ? 242 ARG B N 1 +ATOM 7659 C CA . ARG B 1 242 ? 37.085 -0.620 106.548 1.00 50.85 ? 242 ARG B CA 1 +ATOM 7660 C C . ARG B 1 242 ? 36.266 -1.897 106.709 1.00 49.05 ? 242 ARG B C 1 +ATOM 7661 O O . ARG B 1 242 ? 35.129 -1.867 107.162 1.00 49.15 ? 242 ARG B O 1 +ATOM 7662 C CB . ARG B 1 242 ? 36.227 0.479 105.912 1.00 50.18 ? 242 ARG B CB 1 +ATOM 7663 C CG . ARG B 1 242 ? 36.938 1.829 105.783 1.00 48.64 ? 242 ARG B CG 1 +ATOM 7664 C CD . ARG B 1 242 ? 36.087 2.798 104.993 1.00 49.19 ? 242 ARG B CD 1 +ATOM 7665 N NE . ARG B 1 242 ? 36.606 4.164 104.955 1.00 49.24 ? 242 ARG B NE 1 +ATOM 7666 C CZ . ARG B 1 242 ? 37.805 4.521 104.501 1.00 50.76 ? 242 ARG B CZ 1 +ATOM 7667 N NH1 . ARG B 1 242 ? 38.649 3.604 104.040 1.00 49.48 ? 242 ARG B NH1 1 +ATOM 7668 N NH2 . ARG B 1 242 ? 38.149 5.810 104.484 1.00 50.50 ? 242 ARG B NH2 1 +ATOM 7669 N N . ASN B 1 243 ? 36.851 -3.023 106.329 1.00 47.85 ? 243 ASN B N 1 +ATOM 7670 C CA . ASN B 1 243 ? 36.177 -4.309 106.452 1.00 47.78 ? 243 ASN B CA 1 +ATOM 7671 C C . ASN B 1 243 ? 34.889 -4.400 105.616 1.00 45.69 ? 243 ASN B C 1 +ATOM 7672 O O . ASN B 1 243 ? 33.891 -5.000 106.037 1.00 44.71 ? 243 ASN B O 1 +ATOM 7673 C CB . ASN B 1 243 ? 35.858 -4.583 107.924 1.00 50.73 ? 243 ASN B CB 1 +ATOM 7674 C CG . ASN B 1 243 ? 35.529 -6.045 108.191 1.00 55.39 ? 243 ASN B CG 1 +ATOM 7675 O OD1 . ASN B 1 243 ? 34.995 -6.385 109.250 1.00 58.27 ? 243 ASN B OD1 1 +ATOM 7676 N ND2 . ASN B 1 243 ? 35.858 -6.924 107.235 1.00 56.51 ? 243 ASN B ND2 1 +ATOM 7677 N N . VAL B 1 244 ? 34.926 -3.813 104.424 1.00 42.19 ? 244 VAL B N 1 +ATOM 7678 C CA . VAL B 1 244 ? 33.780 -3.831 103.527 1.00 38.56 ? 244 VAL B CA 1 +ATOM 7679 C C . VAL B 1 244 ? 34.140 -4.568 102.247 1.00 37.41 ? 244 VAL B C 1 +ATOM 7680 O O . VAL B 1 244 ? 35.138 -4.253 101.606 1.00 36.44 ? 244 VAL B O 1 +ATOM 7681 C CB . VAL B 1 244 ? 33.337 -2.395 103.194 1.00 37.65 ? 244 VAL B CB 1 +ATOM 7682 C CG1 . VAL B 1 244 ? 32.284 -2.403 102.098 1.00 33.37 ? 244 VAL B CG1 1 +ATOM 7683 C CG2 . VAL B 1 244 ? 32.798 -1.731 104.460 1.00 34.84 ? 244 VAL B CG2 1 +ATOM 7684 N N . LYS B 1 245 ? 33.332 -5.560 101.884 1.00 37.50 ? 245 LYS B N 1 +ATOM 7685 C CA . LYS B 1 245 ? 33.570 -6.332 100.664 1.00 36.23 ? 245 LYS B CA 1 +ATOM 7686 C C . LYS B 1 245 ? 33.157 -5.539 99.424 1.00 36.30 ? 245 LYS B C 1 +ATOM 7687 O O . LYS B 1 245 ? 32.306 -4.643 99.501 1.00 36.11 ? 245 LYS B O 1 +ATOM 7688 C CB . LYS B 1 245 ? 32.772 -7.627 100.699 1.00 35.68 ? 245 LYS B CB 1 +ATOM 7689 C CG . LYS B 1 245 ? 33.025 -8.467 101.914 1.00 37.81 ? 245 LYS B CG 1 +ATOM 7690 C CD . LYS B 1 245 ? 34.452 -8.971 101.927 1.00 40.86 ? 245 LYS B CD 1 +ATOM 7691 C CE . LYS B 1 245 ? 34.731 -9.742 103.200 1.00 42.45 ? 245 LYS B CE 1 +ATOM 7692 N NZ . LYS B 1 245 ? 36.098 -10.342 103.170 1.00 45.50 ? 245 LYS B NZ 1 +ATOM 7693 N N . LEU B 1 246 ? 33.766 -5.868 98.287 1.00 35.53 ? 246 LEU B N 1 +ATOM 7694 C CA . LEU B 1 246 ? 33.441 -5.216 97.029 1.00 36.17 ? 246 LEU B CA 1 +ATOM 7695 C C . LEU B 1 246 ? 32.908 -6.247 96.046 1.00 36.82 ? 246 LEU B C 1 +ATOM 7696 O O . LEU B 1 246 ? 33.599 -7.208 95.717 1.00 37.86 ? 246 LEU B O 1 +ATOM 7697 C CB . LEU B 1 246 ? 34.668 -4.547 96.423 1.00 37.14 ? 246 LEU B CB 1 +ATOM 7698 C CG . LEU B 1 246 ? 34.434 -3.933 95.033 1.00 37.44 ? 246 LEU B CG 1 +ATOM 7699 C CD1 . LEU B 1 246 ? 33.432 -2.787 95.132 1.00 36.83 ? 246 LEU B CD1 1 +ATOM 7700 C CD2 . LEU B 1 246 ? 35.749 -3.427 94.460 1.00 36.66 ? 246 LEU B CD2 1 +ATOM 7701 N N . ILE B 1 247 ? 31.672 -6.054 95.593 1.00 37.17 ? 247 ILE B N 1 +ATOM 7702 C CA . ILE B 1 247 ? 31.053 -6.962 94.626 1.00 35.71 ? 247 ILE B CA 1 +ATOM 7703 C C . ILE B 1 247 ? 30.855 -6.164 93.338 1.00 35.99 ? 247 ILE B C 1 +ATOM 7704 O O . ILE B 1 247 ? 30.294 -5.062 93.363 1.00 37.34 ? 247 ILE B O 1 +ATOM 7705 C CB . ILE B 1 247 ? 29.672 -7.487 95.126 1.00 34.67 ? 247 ILE B CB 1 +ATOM 7706 C CG1 . ILE B 1 247 ? 29.842 -8.325 96.399 1.00 35.18 ? 247 ILE B CG1 1 +ATOM 7707 C CG2 . ILE B 1 247 ? 29.016 -8.336 94.063 1.00 32.84 ? 247 ILE B CG2 1 +ATOM 7708 C CD1 . ILE B 1 247 ? 29.956 -7.503 97.673 1.00 34.60 ? 247 ILE B CD1 1 +ATOM 7709 N N . THR B 1 248 ? 31.327 -6.706 92.221 1.00 34.52 ? 248 THR B N 1 +ATOM 7710 C CA . THR B 1 248 ? 31.201 -6.026 90.942 1.00 33.77 ? 248 THR B CA 1 +ATOM 7711 C C . THR B 1 248 ? 30.264 -6.758 89.986 1.00 34.19 ? 248 THR B C 1 +ATOM 7712 O O . THR B 1 248 ? 30.290 -7.987 89.879 1.00 34.30 ? 248 THR B O 1 +ATOM 7713 C CB . THR B 1 248 ? 32.562 -5.879 90.249 1.00 33.42 ? 248 THR B CB 1 +ATOM 7714 O OG1 . THR B 1 248 ? 33.129 -7.180 90.040 1.00 34.52 ? 248 THR B OG1 1 +ATOM 7715 C CG2 . THR B 1 248 ? 33.501 -5.039 91.095 1.00 33.40 ? 248 THR B CG2 1 +ATOM 7716 N N . ILE B 1 249 ? 29.438 -5.988 89.286 1.00 34.23 ? 249 ILE B N 1 +ATOM 7717 C CA . ILE B 1 249 ? 28.505 -6.561 88.335 1.00 33.70 ? 249 ILE B CA 1 +ATOM 7718 C C . ILE B 1 249 ? 29.258 -6.984 87.087 1.00 33.33 ? 249 ILE B C 1 +ATOM 7719 O O . ILE B 1 249 ? 30.226 -6.347 86.682 1.00 32.81 ? 249 ILE B O 1 +ATOM 7720 C CB . ILE B 1 249 ? 27.403 -5.543 87.958 1.00 33.73 ? 249 ILE B CB 1 +ATOM 7721 C CG1 . ILE B 1 249 ? 26.262 -6.261 87.240 1.00 34.89 ? 249 ILE B CG1 1 +ATOM 7722 C CG2 . ILE B 1 249 ? 27.969 -4.446 87.081 1.00 30.61 ? 249 ILE B CG2 1 +ATOM 7723 C CD1 . ILE B 1 249 ? 25.041 -5.397 87.031 1.00 34.97 ? 249 ILE B CD1 1 +ATOM 7724 N N . VAL B 1 250 ? 28.821 -8.084 86.495 1.00 34.62 ? 250 VAL B N 1 +ATOM 7725 C CA . VAL B 1 250 ? 29.434 -8.593 85.279 1.00 37.82 ? 250 VAL B CA 1 +ATOM 7726 C C . VAL B 1 250 ? 28.311 -9.071 84.372 1.00 38.81 ? 250 VAL B C 1 +ATOM 7727 O O . VAL B 1 250 ? 27.587 -10.002 84.716 1.00 42.07 ? 250 VAL B O 1 +ATOM 7728 C CB . VAL B 1 250 ? 30.388 -9.779 85.582 1.00 38.43 ? 250 VAL B CB 1 +ATOM 7729 C CG1 . VAL B 1 250 ? 30.941 -10.363 84.291 1.00 35.29 ? 250 VAL B CG1 1 +ATOM 7730 C CG2 . VAL B 1 250 ? 31.524 -9.307 86.478 1.00 38.34 ? 250 VAL B CG2 1 +ATOM 7731 N N . ASP B 1 251 ? 28.143 -8.422 83.228 1.00 40.25 ? 251 ASP B N 1 +ATOM 7732 C CA . ASP B 1 251 ? 27.097 -8.833 82.300 1.00 41.67 ? 251 ASP B CA 1 +ATOM 7733 C C . ASP B 1 251 ? 27.637 -9.966 81.439 1.00 41.94 ? 251 ASP B C 1 +ATOM 7734 O O . ASP B 1 251 ? 28.753 -10.435 81.654 1.00 43.23 ? 251 ASP B O 1 +ATOM 7735 C CB . ASP B 1 251 ? 26.662 -7.659 81.427 1.00 41.69 ? 251 ASP B CB 1 +ATOM 7736 C CG . ASP B 1 251 ? 26.144 -6.496 82.241 1.00 42.82 ? 251 ASP B CG 1 +ATOM 7737 O OD1 . ASP B 1 251 ? 25.125 -6.668 82.942 1.00 40.96 ? 251 ASP B OD1 1 +ATOM 7738 O OD2 . ASP B 1 251 ? 26.762 -5.408 82.181 1.00 45.73 ? 251 ASP B OD2 1 +ATOM 7739 N N . HIS B 1 252 ? 26.855 -10.397 80.458 1.00 41.79 ? 252 HIS B N 1 +ATOM 7740 C CA . HIS B 1 252 ? 27.257 -11.508 79.598 1.00 41.38 ? 252 HIS B CA 1 +ATOM 7741 C C . HIS B 1 252 ? 27.599 -11.058 78.178 1.00 40.31 ? 252 HIS B C 1 +ATOM 7742 O O . HIS B 1 252 ? 27.953 -11.878 77.338 1.00 41.85 ? 252 HIS B O 1 +ATOM 7743 C CB . HIS B 1 252 ? 26.123 -12.533 79.549 1.00 41.50 ? 252 HIS B CB 1 +ATOM 7744 C CG . HIS B 1 252 ? 24.870 -11.995 78.933 1.00 44.57 ? 252 HIS B CG 1 +ATOM 7745 N ND1 . HIS B 1 252 ? 24.387 -10.734 79.218 1.00 46.13 ? 252 HIS B ND1 1 +ATOM 7746 C CD2 . HIS B 1 252 ? 24.022 -12.525 78.018 1.00 43.91 ? 252 HIS B CD2 1 +ATOM 7747 C CE1 . HIS B 1 252 ? 23.299 -10.509 78.501 1.00 44.95 ? 252 HIS B CE1 1 +ATOM 7748 N NE2 . HIS B 1 252 ? 23.056 -11.580 77.767 1.00 44.71 ? 252 HIS B NE2 1 +ATOM 7749 N N . GLY B 1 253 ? 27.497 -9.759 77.914 1.00 39.22 ? 253 GLY B N 1 +ATOM 7750 C CA . GLY B 1 253 ? 27.792 -9.260 76.586 1.00 37.20 ? 253 GLY B CA 1 +ATOM 7751 C C . GLY B 1 253 ? 29.220 -8.807 76.348 1.00 36.37 ? 253 GLY B C 1 +ATOM 7752 O O . GLY B 1 253 ? 29.747 -7.981 77.085 1.00 37.73 ? 253 GLY B O 1 +ATOM 7753 N N . ILE B 1 254 ? 29.839 -9.348 75.302 1.00 35.19 ? 254 ILE B N 1 +ATOM 7754 C CA . ILE B 1 254 ? 31.208 -9.004 74.935 1.00 32.93 ? 254 ILE B CA 1 +ATOM 7755 C C . ILE B 1 254 ? 31.153 -8.041 73.750 1.00 35.12 ? 254 ILE B C 1 +ATOM 7756 O O . ILE B 1 254 ? 30.654 -8.378 72.675 1.00 35.69 ? 254 ILE B O 1 +ATOM 7757 C CB . ILE B 1 254 ? 31.999 -10.258 74.525 1.00 32.63 ? 254 ILE B CB 1 +ATOM 7758 C CG1 . ILE B 1 254 ? 32.091 -11.233 75.709 1.00 32.46 ? 254 ILE B CG1 1 +ATOM 7759 C CG2 . ILE B 1 254 ? 33.377 -9.862 74.014 1.00 29.67 ? 254 ILE B CG2 1 +ATOM 7760 C CD1 . ILE B 1 254 ? 32.891 -10.698 76.886 1.00 32.43 ? 254 ILE B CD1 1 +ATOM 7761 N N . ARG B 1 255 ? 31.672 -6.840 73.949 1.00 34.65 ? 255 ARG B N 1 +ATOM 7762 C CA . ARG B 1 255 ? 31.654 -5.828 72.916 1.00 34.30 ? 255 ARG B CA 1 +ATOM 7763 C C . ARG B 1 255 ? 32.453 -6.205 71.676 1.00 35.21 ? 255 ARG B C 1 +ATOM 7764 O O . ARG B 1 255 ? 33.604 -6.617 71.775 1.00 35.92 ? 255 ARG B O 1 +ATOM 7765 C CB . ARG B 1 255 ? 32.171 -4.510 73.495 1.00 35.36 ? 255 ARG B CB 1 +ATOM 7766 C CG . ARG B 1 255 ? 32.129 -3.353 72.525 1.00 36.43 ? 255 ARG B CG 1 +ATOM 7767 C CD . ARG B 1 255 ? 32.098 -2.030 73.266 1.00 37.85 ? 255 ARG B CD 1 +ATOM 7768 N NE . ARG B 1 255 ? 33.127 -1.124 72.776 1.00 39.43 ? 255 ARG B NE 1 +ATOM 7769 C CZ . ARG B 1 255 ? 32.905 0.132 72.426 1.00 38.83 ? 255 ARG B CZ 1 +ATOM 7770 N NH1 . ARG B 1 255 ? 31.684 0.638 72.506 1.00 38.52 ? 255 ARG B NH1 1 +ATOM 7771 N NH2 . ARG B 1 255 ? 33.911 0.878 72.004 1.00 41.13 ? 255 ARG B NH2 1 +ATOM 7772 N N . VAL B 1 256 ? 31.831 -6.065 70.505 1.00 35.66 ? 256 VAL B N 1 +ATOM 7773 C CA . VAL B 1 256 ? 32.490 -6.368 69.239 1.00 35.04 ? 256 VAL B CA 1 +ATOM 7774 C C . VAL B 1 256 ? 33.397 -5.180 68.966 1.00 36.30 ? 256 VAL B C 1 +ATOM 7775 O O . VAL B 1 256 ? 33.054 -4.261 68.219 1.00 37.11 ? 256 VAL B O 1 +ATOM 7776 C CB . VAL B 1 256 ? 31.460 -6.531 68.103 1.00 33.98 ? 256 VAL B CB 1 +ATOM 7777 C CG1 . VAL B 1 256 ? 32.173 -6.805 66.782 1.00 31.08 ? 256 VAL B CG1 1 +ATOM 7778 C CG2 . VAL B 1 256 ? 30.509 -7.677 68.443 1.00 32.79 ? 256 VAL B CG2 1 +ATOM 7779 N N . ASP B 1 257 ? 34.564 -5.224 69.593 1.00 37.45 ? 257 ASP B N 1 +ATOM 7780 C CA . ASP B 1 257 ? 35.553 -4.161 69.522 1.00 39.12 ? 257 ASP B CA 1 +ATOM 7781 C C . ASP B 1 257 ? 36.894 -4.757 69.099 1.00 40.43 ? 257 ASP B C 1 +ATOM 7782 O O . ASP B 1 257 ? 37.419 -5.658 69.755 1.00 39.17 ? 257 ASP B O 1 +ATOM 7783 C CB . ASP B 1 257 ? 35.662 -3.527 70.915 1.00 41.40 ? 257 ASP B CB 1 +ATOM 7784 C CG . ASP B 1 257 ? 36.514 -2.281 70.942 1.00 44.55 ? 257 ASP B CG 1 +ATOM 7785 O OD1 . ASP B 1 257 ? 37.608 -2.284 70.329 1.00 47.15 ? 257 ASP B OD1 1 +ATOM 7786 O OD2 . ASP B 1 257 ? 36.087 -1.300 71.601 1.00 46.00 ? 257 ASP B OD2 1 +ATOM 7787 N N . GLN B 1 258 ? 37.432 -4.244 67.996 1.00 41.12 ? 258 GLN B N 1 +ATOM 7788 C CA . GLN B 1 258 ? 38.706 -4.687 67.427 1.00 40.78 ? 258 GLN B CA 1 +ATOM 7789 C C . GLN B 1 258 ? 39.907 -4.646 68.367 1.00 42.30 ? 258 GLN B C 1 +ATOM 7790 O O . GLN B 1 258 ? 40.879 -5.388 68.183 1.00 42.02 ? 258 GLN B O 1 +ATOM 7791 C CB . GLN B 1 258 ? 39.040 -3.826 66.224 1.00 38.64 ? 258 GLN B CB 1 +ATOM 7792 C CG . GLN B 1 258 ? 38.864 -4.527 64.931 1.00 39.18 ? 258 GLN B CG 1 +ATOM 7793 C CD . GLN B 1 258 ? 38.929 -3.578 63.766 1.00 36.13 ? 258 GLN B CD 1 +ATOM 7794 O OE1 . GLN B 1 258 ? 38.975 -4.012 62.618 1.00 39.29 ? 258 GLN B OE1 1 +ATOM 7795 N NE2 . GLN B 1 258 ? 38.924 -2.277 64.048 1.00 29.97 ? 258 GLN B NE2 1 +ATOM 7796 N N . ASN B 1 259 ? 39.854 -3.765 69.356 1.00 42.50 ? 259 ASN B N 1 +ATOM 7797 C CA . ASN B 1 259 ? 40.966 -3.624 70.287 1.00 44.27 ? 259 ASN B CA 1 +ATOM 7798 C C . ASN B 1 259 ? 40.597 -3.979 71.720 1.00 43.59 ? 259 ASN B C 1 +ATOM 7799 O O . ASN B 1 259 ? 41.275 -3.581 72.662 1.00 44.91 ? 259 ASN B O 1 +ATOM 7800 C CB . ASN B 1 259 ? 41.495 -2.192 70.218 1.00 45.18 ? 259 ASN B CB 1 +ATOM 7801 C CG . ASN B 1 259 ? 42.013 -1.839 68.837 1.00 47.36 ? 259 ASN B CG 1 +ATOM 7802 O OD1 . ASN B 1 259 ? 41.661 -0.803 68.273 1.00 48.62 ? 259 ASN B OD1 1 +ATOM 7803 N ND2 . ASN B 1 259 ? 42.854 -2.706 68.283 1.00 47.42 ? 259 ASN B ND2 1 +ATOM 7804 N N . TYR B 1 260 ? 39.520 -4.737 71.871 1.00 42.93 ? 260 TYR B N 1 +ATOM 7805 C CA . TYR B 1 260 ? 39.038 -5.160 73.174 1.00 40.45 ? 260 TYR B CA 1 +ATOM 7806 C C . TYR B 1 260 ? 39.485 -6.605 73.387 1.00 41.47 ? 260 TYR B C 1 +ATOM 7807 O O . TYR B 1 260 ? 39.003 -7.536 72.733 1.00 42.49 ? 260 TYR B O 1 +ATOM 7808 C CB . TYR B 1 260 ? 37.518 -5.037 73.202 1.00 38.35 ? 260 TYR B CB 1 +ATOM 7809 C CG . TYR B 1 260 ? 36.868 -5.473 74.484 1.00 37.87 ? 260 TYR B CG 1 +ATOM 7810 C CD1 . TYR B 1 260 ? 37.312 -4.987 75.715 1.00 38.23 ? 260 TYR B CD1 1 +ATOM 7811 C CD2 . TYR B 1 260 ? 35.795 -6.360 74.470 1.00 37.22 ? 260 TYR B CD2 1 +ATOM 7812 C CE1 . TYR B 1 260 ? 36.700 -5.377 76.903 1.00 38.72 ? 260 TYR B CE1 1 +ATOM 7813 C CE2 . TYR B 1 260 ? 35.174 -6.759 75.649 1.00 37.72 ? 260 TYR B CE2 1 +ATOM 7814 C CZ . TYR B 1 260 ? 35.634 -6.263 76.862 1.00 39.24 ? 260 TYR B CZ 1 +ATOM 7815 O OH . TYR B 1 260 ? 35.040 -6.657 78.035 1.00 39.45 ? 260 TYR B OH 1 +ATOM 7816 N N . SER B 1 261 ? 40.415 -6.780 74.313 1.00 40.79 ? 261 SER B N 1 +ATOM 7817 C CA . SER B 1 261 ? 40.982 -8.085 74.615 1.00 40.17 ? 261 SER B CA 1 +ATOM 7818 C C . SER B 1 261 ? 40.034 -9.289 74.745 1.00 38.56 ? 261 SER B C 1 +ATOM 7819 O O . SER B 1 261 ? 40.244 -10.320 74.097 1.00 38.86 ? 261 SER B O 1 +ATOM 7820 C CB . SER B 1 261 ? 41.838 -7.964 75.871 1.00 41.51 ? 261 SER B CB 1 +ATOM 7821 O OG . SER B 1 261 ? 42.442 -9.204 76.172 1.00 45.85 ? 261 SER B OG 1 +ATOM 7822 N N . PRO B 1 262 ? 38.993 -9.195 75.593 1.00 37.93 ? 262 PRO B N 1 +ATOM 7823 C CA . PRO B 1 262 ? 38.068 -10.332 75.745 1.00 36.88 ? 262 PRO B CA 1 +ATOM 7824 C C . PRO B 1 262 ? 37.439 -10.785 74.428 1.00 36.18 ? 262 PRO B C 1 +ATOM 7825 O O . PRO B 1 262 ? 37.184 -11.971 74.231 1.00 34.92 ? 262 PRO B O 1 +ATOM 7826 C CB . PRO B 1 262 ? 37.026 -9.806 76.726 1.00 36.80 ? 262 PRO B CB 1 +ATOM 7827 C CG . PRO B 1 262 ? 37.804 -8.850 77.555 1.00 36.06 ? 262 PRO B CG 1 +ATOM 7828 C CD . PRO B 1 262 ? 38.642 -8.116 76.531 1.00 37.27 ? 262 PRO B CD 1 +ATOM 7829 N N . PHE B 1 263 ? 37.186 -9.831 73.535 1.00 36.09 ? 263 PHE B N 1 +ATOM 7830 C CA . PHE B 1 263 ? 36.600 -10.148 72.241 1.00 36.48 ? 263 PHE B CA 1 +ATOM 7831 C C . PHE B 1 263 ? 37.575 -10.988 71.419 1.00 36.95 ? 263 PHE B C 1 +ATOM 7832 O O . PHE B 1 263 ? 37.185 -11.997 70.816 1.00 37.01 ? 263 PHE B O 1 +ATOM 7833 C CB . PHE B 1 263 ? 36.253 -8.862 71.481 1.00 34.36 ? 263 PHE B CB 1 +ATOM 7834 C CG . PHE B 1 263 ? 35.724 -9.102 70.095 1.00 34.17 ? 263 PHE B CG 1 +ATOM 7835 C CD1 . PHE B 1 263 ? 34.586 -9.882 69.894 1.00 33.72 ? 263 PHE B CD1 1 +ATOM 7836 C CD2 . PHE B 1 263 ? 36.361 -8.546 68.988 1.00 34.39 ? 263 PHE B CD2 1 +ATOM 7837 C CE1 . PHE B 1 263 ? 34.085 -10.109 68.612 1.00 33.88 ? 263 PHE B CE1 1 +ATOM 7838 C CE2 . PHE B 1 263 ? 35.868 -8.766 67.693 1.00 35.05 ? 263 PHE B CE2 1 +ATOM 7839 C CZ . PHE B 1 263 ? 34.724 -9.552 67.509 1.00 35.10 ? 263 PHE B CZ 1 +ATOM 7840 N N . LEU B 1 264 ? 38.839 -10.566 71.408 1.00 36.88 ? 264 LEU B N 1 +ATOM 7841 C CA . LEU B 1 264 ? 39.883 -11.261 70.666 1.00 37.27 ? 264 LEU B CA 1 +ATOM 7842 C C . LEU B 1 264 ? 40.223 -12.626 71.266 1.00 38.54 ? 264 LEU B C 1 +ATOM 7843 O O . LEU B 1 264 ? 40.379 -13.602 70.531 1.00 39.53 ? 264 LEU B O 1 +ATOM 7844 C CB . LEU B 1 264 ? 41.141 -10.395 70.598 1.00 35.98 ? 264 LEU B CB 1 +ATOM 7845 C CG . LEU B 1 264 ? 40.917 -8.995 70.016 1.00 36.97 ? 264 LEU B CG 1 +ATOM 7846 C CD1 . LEU B 1 264 ? 42.200 -8.179 70.114 1.00 36.24 ? 264 LEU B CD1 1 +ATOM 7847 C CD2 . LEU B 1 264 ? 40.451 -9.110 68.569 1.00 35.93 ? 264 LEU B CD2 1 +ATOM 7848 N N . SER B 1 265 ? 40.318 -12.713 72.591 1.00 38.74 ? 265 SER B N 1 +ATOM 7849 C CA . SER B 1 265 ? 40.660 -13.990 73.222 1.00 39.13 ? 265 SER B CA 1 +ATOM 7850 C C . SER B 1 265 ? 39.487 -14.959 73.274 1.00 38.94 ? 265 SER B C 1 +ATOM 7851 O O . SER B 1 265 ? 39.678 -16.177 73.315 1.00 39.69 ? 265 SER B O 1 +ATOM 7852 C CB . SER B 1 265 ? 41.199 -13.769 74.641 1.00 39.24 ? 265 SER B CB 1 +ATOM 7853 O OG . SER B 1 265 ? 40.158 -13.442 75.546 1.00 42.51 ? 265 SER B OG 1 +ATOM 7854 N N . GLY B 1 266 ? 38.269 -14.428 73.271 1.00 38.85 ? 266 GLY B N 1 +ATOM 7855 C CA . GLY B 1 266 ? 37.104 -15.295 73.321 1.00 37.59 ? 266 GLY B CA 1 +ATOM 7856 C C . GLY B 1 266 ? 36.732 -15.844 71.957 1.00 37.38 ? 266 GLY B C 1 +ATOM 7857 O O . GLY B 1 266 ? 35.937 -16.783 71.859 1.00 37.73 ? 266 GLY B O 1 +ATOM 7858 N N . MET B 1 267 ? 37.317 -15.271 70.906 1.00 36.74 ? 267 MET B N 1 +ATOM 7859 C CA . MET B 1 267 ? 37.019 -15.691 69.545 1.00 37.56 ? 267 MET B CA 1 +ATOM 7860 C C . MET B 1 267 ? 37.080 -17.206 69.410 1.00 38.21 ? 267 MET B C 1 +ATOM 7861 O O . MET B 1 267 ? 38.054 -17.843 69.811 1.00 38.54 ? 267 MET B O 1 +ATOM 7862 C CB . MET B 1 267 ? 37.983 -15.032 68.560 1.00 38.95 ? 267 MET B CB 1 +ATOM 7863 C CG . MET B 1 267 ? 37.500 -15.067 67.113 1.00 42.41 ? 267 MET B CG 1 +ATOM 7864 S SD . MET B 1 267 ? 35.836 -14.326 66.891 1.00 46.68 ? 267 MET B SD 1 +ATOM 7865 C CE . MET B 1 267 ? 36.218 -12.570 67.014 1.00 42.46 ? 267 MET B CE 1 +ATOM 7866 N N . GLY B 1 268 ? 36.023 -17.782 68.847 1.00 38.06 ? 268 GLY B N 1 +ATOM 7867 C CA . GLY B 1 268 ? 35.959 -19.221 68.685 1.00 34.57 ? 268 GLY B CA 1 +ATOM 7868 C C . GLY B 1 268 ? 35.035 -19.823 69.722 1.00 35.38 ? 268 GLY B C 1 +ATOM 7869 O O . GLY B 1 268 ? 34.531 -20.935 69.553 1.00 36.57 ? 268 GLY B O 1 +ATOM 7870 N N . LYS B 1 269 ? 34.780 -19.084 70.798 1.00 34.68 ? 269 LYS B N 1 +ATOM 7871 C CA . LYS B 1 269 ? 33.915 -19.594 71.858 1.00 35.35 ? 269 LYS B CA 1 +ATOM 7872 C C . LYS B 1 269 ? 32.580 -18.856 72.041 1.00 33.37 ? 269 LYS B C 1 +ATOM 7873 O O . LYS B 1 269 ? 31.902 -19.021 73.053 1.00 32.59 ? 269 LYS B O 1 +ATOM 7874 C CB . LYS B 1 269 ? 34.710 -19.613 73.171 1.00 36.73 ? 269 LYS B CB 1 +ATOM 7875 C CG . LYS B 1 269 ? 35.914 -20.552 73.104 1.00 38.47 ? 269 LYS B CG 1 +ATOM 7876 C CD . LYS B 1 269 ? 36.872 -20.358 74.255 1.00 39.93 ? 269 LYS B CD 1 +ATOM 7877 C CE . LYS B 1 269 ? 37.629 -19.054 74.128 1.00 42.49 ? 269 LYS B CE 1 +ATOM 7878 N NZ . LYS B 1 269 ? 38.497 -19.041 72.919 1.00 42.81 ? 269 LYS B NZ 1 +ATOM 7879 N N . PHE B 1 270 ? 32.195 -18.061 71.052 1.00 32.03 ? 270 PHE B N 1 +ATOM 7880 C CA . PHE B 1 270 ? 30.946 -17.306 71.109 1.00 32.21 ? 270 PHE B CA 1 +ATOM 7881 C C . PHE B 1 270 ? 29.769 -18.044 70.457 1.00 32.38 ? 270 PHE B C 1 +ATOM 7882 O O . PHE B 1 270 ? 29.961 -18.968 69.663 1.00 31.74 ? 270 PHE B O 1 +ATOM 7883 C CB . PHE B 1 270 ? 31.127 -15.959 70.419 1.00 31.12 ? 270 PHE B CB 1 +ATOM 7884 C CG . PHE B 1 270 ? 32.226 -15.117 71.002 1.00 30.78 ? 270 PHE B CG 1 +ATOM 7885 C CD1 . PHE B 1 270 ? 32.210 -14.767 72.348 1.00 28.97 ? 270 PHE B CD1 1 +ATOM 7886 C CD2 . PHE B 1 270 ? 33.259 -14.639 70.195 1.00 28.03 ? 270 PHE B CD2 1 +ATOM 7887 C CE1 . PHE B 1 270 ? 33.203 -13.952 72.880 1.00 28.39 ? 270 PHE B CE1 1 +ATOM 7888 C CE2 . PHE B 1 270 ? 34.252 -13.821 70.725 1.00 27.62 ? 270 PHE B CE2 1 +ATOM 7889 C CZ . PHE B 1 270 ? 34.223 -13.477 72.067 1.00 25.99 ? 270 PHE B CZ 1 +ATOM 7890 N N . CYS B 1 271 ? 28.553 -17.630 70.802 1.00 33.93 ? 271 CYS B N 1 +ATOM 7891 C CA . CYS B 1 271 ? 27.339 -18.222 70.235 1.00 35.30 ? 271 CYS B CA 1 +ATOM 7892 C C . CYS B 1 271 ? 27.227 -17.910 68.747 1.00 33.75 ? 271 CYS B C 1 +ATOM 7893 O O . CYS B 1 271 ? 27.651 -16.849 68.292 1.00 31.23 ? 271 CYS B O 1 +ATOM 7894 C CB . CYS B 1 271 ? 26.094 -17.668 70.921 1.00 38.62 ? 271 CYS B CB 1 +ATOM 7895 S SG . CYS B 1 271 ? 25.947 -18.045 72.677 1.00 47.47 ? 271 CYS B SG 1 +ATOM 7896 N N . GLU B 1 272 ? 26.640 -18.837 68.000 1.00 34.43 ? 272 GLU B N 1 +ATOM 7897 C CA . GLU B 1 272 ? 26.454 -18.659 66.563 1.00 36.49 ? 272 GLU B CA 1 +ATOM 7898 C C . GLU B 1 272 ? 24.971 -18.751 66.217 1.00 35.69 ? 272 GLU B C 1 +ATOM 7899 O O . GLU B 1 272 ? 24.130 -18.993 67.090 1.00 32.90 ? 272 GLU B O 1 +ATOM 7900 C CB . GLU B 1 272 ? 27.204 -19.747 65.782 1.00 37.11 ? 272 GLU B CB 1 +ATOM 7901 C CG . GLU B 1 272 ? 28.684 -19.836 66.093 1.00 42.42 ? 272 GLU B CG 1 +ATOM 7902 C CD . GLU B 1 272 ? 29.355 -21.003 65.393 1.00 47.11 ? 272 GLU B CD 1 +ATOM 7903 O OE1 . GLU B 1 272 ? 28.668 -22.018 65.104 1.00 50.04 ? 272 GLU B OE1 1 +ATOM 7904 O OE2 . GLU B 1 272 ? 30.579 -20.916 65.149 1.00 48.87 ? 272 GLU B OE2 1 +ATOM 7905 N N . ILE B 1 273 ? 24.659 -18.546 64.940 1.00 35.90 ? 273 ILE B N 1 +ATOM 7906 C CA . ILE B 1 273 ? 23.288 -18.679 64.475 1.00 35.57 ? 273 ILE B CA 1 +ATOM 7907 C C . ILE B 1 273 ? 23.281 -19.850 63.505 1.00 36.41 ? 273 ILE B C 1 +ATOM 7908 O O . ILE B 1 273 ? 24.332 -20.274 63.027 1.00 37.12 ? 273 ILE B O 1 +ATOM 7909 C CB . ILE B 1 273 ? 22.786 -17.392 63.773 1.00 35.54 ? 273 ILE B CB 1 +ATOM 7910 C CG1 . ILE B 1 273 ? 23.738 -16.990 62.647 1.00 35.31 ? 273 ILE B CG1 1 +ATOM 7911 C CG2 . ILE B 1 273 ? 22.650 -16.262 64.793 1.00 31.96 ? 273 ILE B CG2 1 +ATOM 7912 C CD1 . ILE B 1 273 ? 23.218 -15.818 61.824 1.00 34.22 ? 273 ILE B CD1 1 +ATOM 7913 N N . GLU B 1 274 ? 22.100 -20.384 63.232 1.00 39.26 ? 274 GLU B N 1 +ATOM 7914 C CA . GLU B 1 274 ? 21.944 -21.515 62.320 1.00 41.12 ? 274 GLU B CA 1 +ATOM 7915 C C . GLU B 1 274 ? 22.887 -21.508 61.120 1.00 40.44 ? 274 GLU B C 1 +ATOM 7916 O O . GLU B 1 274 ? 23.580 -22.488 60.862 1.00 40.40 ? 274 GLU B O 1 +ATOM 7917 C CB . GLU B 1 274 ? 20.497 -21.584 61.812 1.00 45.35 ? 274 GLU B CB 1 +ATOM 7918 C CG . GLU B 1 274 ? 19.577 -22.522 62.588 1.00 53.23 ? 274 GLU B CG 1 +ATOM 7919 C CD . GLU B 1 274 ? 20.026 -23.986 62.508 1.00 58.28 ? 274 GLU B CD 1 +ATOM 7920 O OE1 . GLU B 1 274 ? 20.498 -24.410 61.423 1.00 58.74 ? 274 GLU B OE1 1 +ATOM 7921 O OE2 . GLU B 1 274 ? 19.893 -24.714 63.523 1.00 59.82 ? 274 GLU B OE2 1 +ATOM 7922 N N . SER B 1 275 ? 22.920 -20.403 60.387 1.00 40.50 ? 275 SER B N 1 +ATOM 7923 C CA . SER B 1 275 ? 23.749 -20.319 59.193 1.00 40.88 ? 275 SER B CA 1 +ATOM 7924 C C . SER B 1 275 ? 25.263 -20.305 59.385 1.00 40.93 ? 275 SER B C 1 +ATOM 7925 O O . SER B 1 275 ? 26.006 -20.271 58.405 1.00 40.96 ? 275 SER B O 1 +ATOM 7926 C CB . SER B 1 275 ? 23.319 -19.117 58.361 1.00 41.21 ? 275 SER B CB 1 +ATOM 7927 O OG . SER B 1 275 ? 23.150 -17.981 59.180 1.00 41.54 ? 275 SER B OG 1 +ATOM 7928 N N . GLY B 1 276 ? 25.733 -20.310 60.629 1.00 40.45 ? 276 GLY B N 1 +ATOM 7929 C CA . GLY B 1 276 ? 27.170 -20.350 60.837 1.00 39.68 ? 276 GLY B CA 1 +ATOM 7930 C C . GLY B 1 276 ? 27.920 -19.107 61.269 1.00 39.62 ? 276 GLY B C 1 +ATOM 7931 O O . GLY B 1 276 ? 29.039 -19.227 61.759 1.00 41.03 ? 276 GLY B O 1 +ATOM 7932 N N . GLU B 1 277 ? 27.350 -17.921 61.090 1.00 38.60 ? 277 GLU B N 1 +ATOM 7933 C CA . GLU B 1 277 ? 28.045 -16.711 61.509 1.00 37.83 ? 277 GLU B CA 1 +ATOM 7934 C C . GLU B 1 277 ? 27.891 -16.568 63.015 1.00 36.64 ? 277 GLU B C 1 +ATOM 7935 O O . GLU B 1 277 ? 27.166 -17.332 63.650 1.00 36.25 ? 277 GLU B O 1 +ATOM 7936 C CB . GLU B 1 277 ? 27.459 -15.449 60.853 1.00 39.67 ? 277 GLU B CB 1 +ATOM 7937 C CG . GLU B 1 277 ? 27.189 -15.511 59.359 1.00 43.67 ? 277 GLU B CG 1 +ATOM 7938 C CD . GLU B 1 277 ? 25.758 -15.931 59.048 1.00 48.81 ? 277 GLU B CD 1 +ATOM 7939 O OE1 . GLU B 1 277 ? 25.430 -17.133 59.250 1.00 50.66 ? 277 GLU B OE1 1 +ATOM 7940 O OE2 . GLU B 1 277 ? 24.962 -15.057 58.613 1.00 49.33 ? 277 GLU B OE2 1 +ATOM 7941 N N . LEU B 1 278 ? 28.578 -15.582 63.584 1.00 35.68 ? 278 LEU B N 1 +ATOM 7942 C CA . LEU B 1 278 ? 28.465 -15.315 65.012 1.00 33.45 ? 278 LEU B CA 1 +ATOM 7943 C C . LEU B 1 278 ? 27.113 -14.668 65.250 1.00 32.48 ? 278 LEU B C 1 +ATOM 7944 O O . LEU B 1 278 ? 26.550 -14.033 64.352 1.00 31.39 ? 278 LEU B O 1 +ATOM 7945 C CB . LEU B 1 278 ? 29.531 -14.324 65.480 1.00 32.08 ? 278 LEU B CB 1 +ATOM 7946 C CG . LEU B 1 278 ? 30.983 -14.766 65.551 1.00 32.25 ? 278 LEU B CG 1 +ATOM 7947 C CD1 . LEU B 1 278 ? 31.837 -13.635 66.109 1.00 30.09 ? 278 LEU B CD1 1 +ATOM 7948 C CD2 . LEU B 1 278 ? 31.079 -15.993 66.427 1.00 30.59 ? 278 LEU B CD2 1 +ATOM 7949 N N . PHE B 1 279 ? 26.580 -14.838 66.451 1.00 30.55 ? 279 PHE B N 1 +ATOM 7950 C CA . PHE B 1 279 ? 25.327 -14.192 66.765 1.00 30.84 ? 279 PHE B CA 1 +ATOM 7951 C C . PHE B 1 279 ? 25.722 -12.808 67.276 1.00 31.89 ? 279 PHE B C 1 +ATOM 7952 O O . PHE B 1 279 ? 26.284 -12.677 68.370 1.00 30.71 ? 279 PHE B O 1 +ATOM 7953 C CB . PHE B 1 279 ? 24.548 -14.953 67.841 1.00 28.78 ? 279 PHE B CB 1 +ATOM 7954 C CG . PHE B 1 279 ? 23.455 -14.136 68.474 1.00 29.40 ? 279 PHE B CG 1 +ATOM 7955 C CD1 . PHE B 1 279 ? 22.596 -13.365 67.683 1.00 28.24 ? 279 PHE B CD1 1 +ATOM 7956 C CD2 . PHE B 1 279 ? 23.293 -14.121 69.862 1.00 29.13 ? 279 PHE B CD2 1 +ATOM 7957 C CE1 . PHE B 1 279 ? 21.586 -12.582 68.268 1.00 29.20 ? 279 PHE B CE1 1 +ATOM 7958 C CE2 . PHE B 1 279 ? 22.293 -13.351 70.462 1.00 28.57 ? 279 PHE B CE2 1 +ATOM 7959 C CZ . PHE B 1 279 ? 21.434 -12.574 69.661 1.00 29.76 ? 279 PHE B CZ 1 +ATOM 7960 N N . VAL B 1 280 ? 25.468 -11.781 66.467 1.00 31.39 ? 280 VAL B N 1 +ATOM 7961 C CA . VAL B 1 280 ? 25.790 -10.424 66.868 1.00 30.90 ? 280 VAL B CA 1 +ATOM 7962 C C . VAL B 1 280 ? 24.510 -9.733 67.298 1.00 32.93 ? 280 VAL B C 1 +ATOM 7963 O O . VAL B 1 280 ? 23.548 -9.664 66.534 1.00 35.41 ? 280 VAL B O 1 +ATOM 7964 C CB . VAL B 1 280 ? 26.430 -9.645 65.730 1.00 29.51 ? 280 VAL B CB 1 +ATOM 7965 C CG1 . VAL B 1 280 ? 26.733 -8.238 66.187 1.00 29.23 ? 280 VAL B CG1 1 +ATOM 7966 C CG2 . VAL B 1 280 ? 27.713 -10.345 65.278 1.00 29.21 ? 280 VAL B CG2 1 +ATOM 7967 N N . GLY B 1 281 ? 24.492 -9.243 68.534 1.00 34.00 ? 281 GLY B N 1 +ATOM 7968 C CA . GLY B 1 281 ? 23.316 -8.575 69.053 1.00 34.25 ? 281 GLY B CA 1 +ATOM 7969 C C . GLY B 1 281 ? 23.585 -7.189 69.615 1.00 35.81 ? 281 GLY B C 1 +ATOM 7970 O O . GLY B 1 281 ? 24.533 -6.501 69.215 1.00 35.28 ? 281 GLY B O 1 +ATOM 7971 N N . LYS B 1 282 ? 22.737 -6.775 70.549 1.00 35.92 ? 282 LYS B N 1 +ATOM 7972 C CA . LYS B 1 282 ? 22.857 -5.464 71.166 1.00 36.13 ? 282 LYS B CA 1 +ATOM 7973 C C . LYS B 1 282 ? 22.642 -5.584 72.659 1.00 36.39 ? 282 LYS B C 1 +ATOM 7974 O O . LYS B 1 282 ? 21.707 -6.242 73.109 1.00 36.00 ? 282 LYS B O 1 +ATOM 7975 C CB . LYS B 1 282 ? 21.813 -4.508 70.585 1.00 38.69 ? 282 LYS B CB 1 +ATOM 7976 C CG . LYS B 1 282 ? 22.072 -4.074 69.149 1.00 41.95 ? 282 LYS B CG 1 +ATOM 7977 C CD . LYS B 1 282 ? 23.064 -2.927 69.115 1.00 47.08 ? 282 LYS B CD 1 +ATOM 7978 C CE . LYS B 1 282 ? 23.318 -2.427 67.694 1.00 48.79 ? 282 LYS B CE 1 +ATOM 7979 N NZ . LYS B 1 282 ? 24.107 -3.415 66.891 1.00 53.10 ? 282 LYS B NZ 1 +ATOM 7980 N N . MET B 1 283 ? 23.519 -4.940 73.420 1.00 36.52 ? 283 MET B N 1 +ATOM 7981 C CA . MET B 1 283 ? 23.446 -4.938 74.875 1.00 37.06 ? 283 MET B CA 1 +ATOM 7982 C C . MET B 1 283 ? 24.106 -3.636 75.338 1.00 36.72 ? 283 MET B C 1 +ATOM 7983 O O . MET B 1 283 ? 24.431 -2.787 74.504 1.00 36.38 ? 283 MET B O 1 +ATOM 7984 C CB . MET B 1 283 ? 24.177 -6.164 75.442 1.00 37.23 ? 283 MET B CB 1 +ATOM 7985 C CG . MET B 1 283 ? 23.302 -7.068 76.301 1.00 39.83 ? 283 MET B CG 1 +ATOM 7986 S SD . MET B 1 283 ? 22.753 -6.287 77.848 1.00 43.53 ? 283 MET B SD 1 +ATOM 7987 C CE . MET B 1 283 ? 24.175 -6.676 78.935 1.00 41.52 ? 283 MET B CE 1 +ATOM 7988 N N . TRP B 1 284 ? 24.312 -3.478 76.646 1.00 37.17 ? 284 TRP B N 1 +ATOM 7989 C CA . TRP B 1 284 ? 24.911 -2.253 77.195 1.00 37.34 ? 284 TRP B CA 1 +ATOM 7990 C C . TRP B 1 284 ? 26.107 -1.693 76.415 1.00 36.19 ? 284 TRP B C 1 +ATOM 7991 O O . TRP B 1 284 ? 26.139 -0.510 76.090 1.00 36.22 ? 284 TRP B O 1 +ATOM 7992 C CB . TRP B 1 284 ? 25.325 -2.477 78.650 1.00 39.10 ? 284 TRP B CB 1 +ATOM 7993 C CG . TRP B 1 284 ? 24.209 -2.894 79.568 1.00 41.05 ? 284 TRP B CG 1 +ATOM 7994 C CD1 . TRP B 1 284 ? 24.327 -3.647 80.704 1.00 41.69 ? 284 TRP B CD1 1 +ATOM 7995 C CD2 . TRP B 1 284 ? 22.816 -2.574 79.443 1.00 42.04 ? 284 TRP B CD2 1 +ATOM 7996 N NE1 . TRP B 1 284 ? 23.095 -3.818 81.291 1.00 43.08 ? 284 TRP B NE1 1 +ATOM 7997 C CE2 . TRP B 1 284 ? 22.151 -3.169 80.539 1.00 42.60 ? 284 TRP B CE2 1 +ATOM 7998 C CE3 . TRP B 1 284 ? 22.065 -1.847 78.511 1.00 43.09 ? 284 TRP B CE3 1 +ATOM 7999 C CZ2 . TRP B 1 284 ? 20.772 -3.059 80.730 1.00 44.58 ? 284 TRP B CZ2 1 +ATOM 8000 C CZ3 . TRP B 1 284 ? 20.689 -1.738 78.699 1.00 44.45 ? 284 TRP B CZ3 1 +ATOM 8001 C CH2 . TRP B 1 284 ? 20.058 -2.342 79.801 1.00 45.24 ? 284 TRP B CH2 1 +ATOM 8002 N N . PRO B 1 285 ? 27.110 -2.529 76.109 1.00 36.10 ? 285 PRO B N 1 +ATOM 8003 C CA . PRO B 1 285 ? 28.263 -1.999 75.365 1.00 36.23 ? 285 PRO B CA 1 +ATOM 8004 C C . PRO B 1 285 ? 28.034 -1.720 73.878 1.00 36.32 ? 285 PRO B C 1 +ATOM 8005 O O . PRO B 1 285 ? 28.964 -1.326 73.172 1.00 38.07 ? 285 PRO B O 1 +ATOM 8006 C CB . PRO B 1 285 ? 29.335 -3.062 75.589 1.00 34.96 ? 285 PRO B CB 1 +ATOM 8007 C CG . PRO B 1 285 ? 28.535 -4.324 75.682 1.00 35.01 ? 285 PRO B CG 1 +ATOM 8008 C CD . PRO B 1 285 ? 27.339 -3.924 76.531 1.00 35.08 ? 285 PRO B CD 1 +ATOM 8009 N N . GLY B 1 286 ? 26.802 -1.903 73.411 1.00 36.09 ? 286 GLY B N 1 +ATOM 8010 C CA . GLY B 1 286 ? 26.494 -1.679 72.004 1.00 33.71 ? 286 GLY B CA 1 +ATOM 8011 C C . GLY B 1 286 ? 26.460 -3.007 71.265 1.00 32.93 ? 286 GLY B C 1 +ATOM 8012 O O . GLY B 1 286 ? 25.902 -3.985 71.765 1.00 32.64 ? 286 GLY B O 1 +ATOM 8013 N N . THR B 1 287 ? 27.056 -3.051 70.079 1.00 33.11 ? 287 THR B N 1 +ATOM 8014 C CA . THR B 1 287 ? 27.102 -4.280 69.291 1.00 32.32 ? 287 THR B CA 1 +ATOM 8015 C C . THR B 1 287 ? 27.876 -5.296 70.124 1.00 32.64 ? 287 THR B C 1 +ATOM 8016 O O . THR B 1 287 ? 28.987 -5.011 70.574 1.00 31.88 ? 287 THR B O 1 +ATOM 8017 C CB . THR B 1 287 ? 27.824 -4.041 67.966 1.00 32.09 ? 287 THR B CB 1 +ATOM 8018 O OG1 . THR B 1 287 ? 27.160 -2.988 67.253 1.00 33.67 ? 287 THR B OG1 1 +ATOM 8019 C CG2 . THR B 1 287 ? 27.827 -5.303 67.130 1.00 30.38 ? 287 THR B CG2 1 +ATOM 8020 N N . THR B 1 288 ? 27.300 -6.479 70.326 1.00 32.42 ? 288 THR B N 1 +ATOM 8021 C CA . THR B 1 288 ? 27.940 -7.484 71.166 1.00 32.99 ? 288 THR B CA 1 +ATOM 8022 C C . THR B 1 288 ? 27.763 -8.921 70.711 1.00 31.90 ? 288 THR B C 1 +ATOM 8023 O O . THR B 1 288 ? 26.862 -9.240 69.939 1.00 32.14 ? 288 THR B O 1 +ATOM 8024 C CB . THR B 1 288 ? 27.384 -7.419 72.615 1.00 34.86 ? 288 THR B CB 1 +ATOM 8025 O OG1 . THR B 1 288 ? 25.996 -7.780 72.598 1.00 38.67 ? 288 THR B OG1 1 +ATOM 8026 C CG2 . THR B 1 288 ? 27.501 -6.015 73.187 1.00 34.52 ? 288 THR B CG2 1 +ATOM 8027 N N . VAL B 1 289 ? 28.645 -9.788 71.197 1.00 31.10 ? 289 VAL B N 1 +ATOM 8028 C CA . VAL B 1 289 ? 28.556 -11.221 70.923 1.00 29.97 ? 289 VAL B CA 1 +ATOM 8029 C C . VAL B 1 289 ? 28.430 -11.843 72.302 1.00 29.73 ? 289 VAL B C 1 +ATOM 8030 O O . VAL B 1 289 ? 28.686 -11.178 73.311 1.00 31.62 ? 289 VAL B O 1 +ATOM 8031 C CB . VAL B 1 289 ? 29.802 -11.784 70.193 1.00 30.32 ? 289 VAL B CB 1 +ATOM 8032 C CG1 . VAL B 1 289 ? 29.785 -11.353 68.728 1.00 29.46 ? 289 VAL B CG1 1 +ATOM 8033 C CG2 . VAL B 1 289 ? 31.083 -11.314 70.878 1.00 30.86 ? 289 VAL B CG2 1 +ATOM 8034 N N . TYR B 1 290 ? 28.022 -13.097 72.375 1.00 29.77 ? 290 TYR B N 1 +ATOM 8035 C CA . TYR B 1 290 ? 27.858 -13.727 73.677 1.00 30.87 ? 290 TYR B CA 1 +ATOM 8036 C C . TYR B 1 290 ? 28.594 -15.045 73.788 1.00 31.71 ? 290 TYR B C 1 +ATOM 8037 O O . TYR B 1 290 ? 28.670 -15.808 72.826 1.00 32.14 ? 290 TYR B O 1 +ATOM 8038 C CB . TYR B 1 290 ? 26.370 -13.955 73.967 1.00 32.30 ? 290 TYR B CB 1 +ATOM 8039 C CG . TYR B 1 290 ? 25.527 -12.706 73.835 1.00 34.09 ? 290 TYR B CG 1 +ATOM 8040 C CD1 . TYR B 1 290 ? 25.012 -12.304 72.593 1.00 34.38 ? 290 TYR B CD1 1 +ATOM 8041 C CD2 . TYR B 1 290 ? 25.264 -11.909 74.943 1.00 34.01 ? 290 TYR B CD2 1 +ATOM 8042 C CE1 . TYR B 1 290 ? 24.254 -11.139 72.465 1.00 33.71 ? 290 TYR B CE1 1 +ATOM 8043 C CE2 . TYR B 1 290 ? 24.514 -10.741 74.828 1.00 36.78 ? 290 TYR B CE2 1 +ATOM 8044 C CZ . TYR B 1 290 ? 24.008 -10.360 73.589 1.00 36.38 ? 290 TYR B CZ 1 +ATOM 8045 O OH . TYR B 1 290 ? 23.257 -9.206 73.491 1.00 36.17 ? 290 TYR B OH 1 +ATOM 8046 N N . PRO B 1 291 ? 29.148 -15.333 74.974 1.00 33.24 ? 291 PRO B N 1 +ATOM 8047 C CA . PRO B 1 291 ? 29.882 -16.582 75.199 1.00 33.05 ? 291 PRO B CA 1 +ATOM 8048 C C . PRO B 1 291 ? 28.923 -17.761 75.175 1.00 34.42 ? 291 PRO B C 1 +ATOM 8049 O O . PRO B 1 291 ? 27.836 -17.690 75.749 1.00 35.95 ? 291 PRO B O 1 +ATOM 8050 C CB . PRO B 1 291 ? 30.478 -16.394 76.594 1.00 33.26 ? 291 PRO B CB 1 +ATOM 8051 C CG . PRO B 1 291 ? 30.537 -14.906 76.775 1.00 33.48 ? 291 PRO B CG 1 +ATOM 8052 C CD . PRO B 1 291 ? 29.230 -14.461 76.158 1.00 34.26 ? 291 PRO B CD 1 +ATOM 8053 N N . ASP B 1 292 ? 29.307 -18.842 74.507 1.00 35.02 ? 292 ASP B N 1 +ATOM 8054 C CA . ASP B 1 292 ? 28.466 -20.033 74.482 1.00 35.63 ? 292 ASP B CA 1 +ATOM 8055 C C . ASP B 1 292 ? 28.862 -20.868 75.710 1.00 35.83 ? 292 ASP B C 1 +ATOM 8056 O O . ASP B 1 292 ? 29.635 -21.819 75.611 1.00 36.41 ? 292 ASP B O 1 +ATOM 8057 C CB . ASP B 1 292 ? 28.698 -20.839 73.199 1.00 37.77 ? 292 ASP B CB 1 +ATOM 8058 C CG . ASP B 1 292 ? 27.820 -22.084 73.122 1.00 39.78 ? 292 ASP B CG 1 +ATOM 8059 O OD1 . ASP B 1 292 ? 27.002 -22.299 74.045 1.00 41.52 ? 292 ASP B OD1 1 +ATOM 8060 O OD2 . ASP B 1 292 ? 27.944 -22.849 72.137 1.00 40.10 ? 292 ASP B OD2 1 +ATOM 8061 N N . PHE B 1 293 ? 28.321 -20.499 76.865 1.00 34.65 ? 293 PHE B N 1 +ATOM 8062 C CA . PHE B 1 293 ? 28.626 -21.173 78.118 1.00 34.80 ? 293 PHE B CA 1 +ATOM 8063 C C . PHE B 1 293 ? 28.318 -22.666 78.164 1.00 35.77 ? 293 PHE B C 1 +ATOM 8064 O O . PHE B 1 293 ? 28.698 -23.347 79.116 1.00 35.32 ? 293 PHE B O 1 +ATOM 8065 C CB . PHE B 1 293 ? 27.909 -20.467 79.275 1.00 33.16 ? 293 PHE B CB 1 +ATOM 8066 C CG . PHE B 1 293 ? 28.424 -19.085 79.554 1.00 32.88 ? 293 PHE B CG 1 +ATOM 8067 C CD1 . PHE B 1 293 ? 29.721 -18.897 80.022 1.00 33.71 ? 293 PHE B CD1 1 +ATOM 8068 C CD2 . PHE B 1 293 ? 27.617 -17.966 79.346 1.00 34.01 ? 293 PHE B CD2 1 +ATOM 8069 C CE1 . PHE B 1 293 ? 30.216 -17.615 80.281 1.00 32.89 ? 293 PHE B CE1 1 +ATOM 8070 C CE2 . PHE B 1 293 ? 28.096 -16.678 79.600 1.00 33.53 ? 293 PHE B CE2 1 +ATOM 8071 C CZ . PHE B 1 293 ? 29.403 -16.504 80.070 1.00 35.10 ? 293 PHE B CZ 1 +ATOM 8072 N N . PHE B 1 294 ? 27.633 -23.184 77.152 1.00 35.83 ? 294 PHE B N 1 +ATOM 8073 C CA . PHE B 1 294 ? 27.312 -24.607 77.140 1.00 36.22 ? 294 PHE B CA 1 +ATOM 8074 C C . PHE B 1 294 ? 28.562 -25.419 76.823 1.00 37.56 ? 294 PHE B C 1 +ATOM 8075 O O . PHE B 1 294 ? 28.626 -26.619 77.080 1.00 37.85 ? 294 PHE B O 1 +ATOM 8076 C CB . PHE B 1 294 ? 26.224 -24.894 76.104 1.00 35.70 ? 294 PHE B CB 1 +ATOM 8077 C CG . PHE B 1 294 ? 24.873 -24.365 76.484 1.00 36.49 ? 294 PHE B CG 1 +ATOM 8078 C CD1 . PHE B 1 294 ? 24.102 -25.016 77.437 1.00 37.91 ? 294 PHE B CD1 1 +ATOM 8079 C CD2 . PHE B 1 294 ? 24.386 -23.197 75.917 1.00 36.52 ? 294 PHE B CD2 1 +ATOM 8080 C CE1 . PHE B 1 294 ? 22.866 -24.509 77.821 1.00 38.75 ? 294 PHE B CE1 1 +ATOM 8081 C CE2 . PHE B 1 294 ? 23.157 -22.685 76.294 1.00 37.07 ? 294 PHE B CE2 1 +ATOM 8082 C CZ . PHE B 1 294 ? 22.393 -23.342 77.249 1.00 38.19 ? 294 PHE B CZ 1 +ATOM 8083 N N . ARG B 1 295 ? 29.560 -24.752 76.262 1.00 38.95 ? 295 ARG B N 1 +ATOM 8084 C CA . ARG B 1 295 ? 30.802 -25.413 75.907 1.00 41.78 ? 295 ARG B CA 1 +ATOM 8085 C C . ARG B 1 295 ? 31.794 -25.408 77.051 1.00 43.71 ? 295 ARG B C 1 +ATOM 8086 O O . ARG B 1 295 ? 31.965 -24.413 77.764 1.00 42.96 ? 295 ARG B O 1 +ATOM 8087 C CB . ARG B 1 295 ? 31.425 -24.747 74.685 1.00 42.33 ? 295 ARG B CB 1 +ATOM 8088 C CG . ARG B 1 295 ? 30.555 -24.844 73.457 1.00 43.58 ? 295 ARG B CG 1 +ATOM 8089 C CD . ARG B 1 295 ? 31.031 -23.897 72.393 1.00 45.63 ? 295 ARG B CD 1 +ATOM 8090 N NE . ARG B 1 295 ? 32.429 -24.120 72.050 1.00 46.81 ? 295 ARG B NE 1 +ATOM 8091 C CZ . ARG B 1 295 ? 33.058 -23.495 71.059 1.00 48.88 ? 295 ARG B CZ 1 +ATOM 8092 N NH1 . ARG B 1 295 ? 32.413 -22.606 70.307 1.00 49.84 ? 295 ARG B NH1 1 +ATOM 8093 N NH2 . ARG B 1 295 ? 34.334 -23.752 70.822 1.00 49.84 ? 295 ARG B NH2 1 +ATOM 8094 N N . GLU B 1 296 ? 32.441 -26.552 77.197 1.00 46.70 ? 296 GLU B N 1 +ATOM 8095 C CA . GLU B 1 296 ? 33.434 -26.792 78.219 1.00 50.22 ? 296 GLU B CA 1 +ATOM 8096 C C . GLU B 1 296 ? 34.577 -25.779 78.119 1.00 49.46 ? 296 GLU B C 1 +ATOM 8097 O O . GLU B 1 296 ? 34.949 -25.160 79.115 1.00 49.84 ? 296 GLU B O 1 +ATOM 8098 C CB . GLU B 1 296 ? 33.933 -28.226 78.039 1.00 54.90 ? 296 GLU B CB 1 +ATOM 8099 C CG . GLU B 1 296 ? 34.691 -28.828 79.200 1.00 63.00 ? 296 GLU B CG 1 +ATOM 8100 C CD . GLU B 1 296 ? 34.741 -30.353 79.105 1.00 66.96 ? 296 GLU B CD 1 +ATOM 8101 O OE1 . GLU B 1 296 ? 33.679 -30.988 79.309 1.00 69.29 ? 296 GLU B OE1 1 +ATOM 8102 O OE2 . GLU B 1 296 ? 35.830 -30.912 78.816 1.00 69.28 ? 296 GLU B OE2 1 +ATOM 8103 N N . ASP B 1 297 ? 35.120 -25.599 76.916 1.00 49.55 ? 297 ASP B N 1 +ATOM 8104 C CA . ASP B 1 297 ? 36.221 -24.661 76.710 1.00 49.85 ? 297 ASP B CA 1 +ATOM 8105 C C . ASP B 1 297 ? 35.840 -23.203 76.981 1.00 48.83 ? 297 ASP B C 1 +ATOM 8106 O O . ASP B 1 297 ? 36.663 -22.429 77.472 1.00 50.72 ? 297 ASP B O 1 +ATOM 8107 C CB . ASP B 1 297 ? 36.794 -24.804 75.291 1.00 52.87 ? 297 ASP B CB 1 +ATOM 8108 C CG . ASP B 1 297 ? 35.726 -24.720 74.207 1.00 57.60 ? 297 ASP B CG 1 +ATOM 8109 O OD1 . ASP B 1 297 ? 35.005 -23.699 74.147 1.00 60.44 ? 297 ASP B OD1 1 +ATOM 8110 O OD2 . ASP B 1 297 ? 35.609 -25.675 73.405 1.00 59.37 ? 297 ASP B OD2 1 +ATOM 8111 N N . THR B 1 298 ? 34.604 -22.825 76.665 1.00 45.86 ? 298 THR B N 1 +ATOM 8112 C CA . THR B 1 298 ? 34.135 -21.459 76.904 1.00 42.88 ? 298 THR B CA 1 +ATOM 8113 C C . THR B 1 298 ? 34.114 -21.219 78.413 1.00 40.40 ? 298 THR B C 1 +ATOM 8114 O O . THR B 1 298 ? 34.527 -20.170 78.901 1.00 39.00 ? 298 THR B O 1 +ATOM 8115 C CB . THR B 1 298 ? 32.708 -21.246 76.314 1.00 42.16 ? 298 THR B CB 1 +ATOM 8116 O OG1 . THR B 1 298 ? 32.777 -21.299 74.885 1.00 43.65 ? 298 THR B OG1 1 +ATOM 8117 C CG2 . THR B 1 298 ? 32.135 -19.901 76.731 1.00 40.04 ? 298 THR B CG2 1 +ATOM 8118 N N . ARG B 1 299 ? 33.631 -22.208 79.150 1.00 39.82 ? 299 ARG B N 1 +ATOM 8119 C CA . ARG B 1 299 ? 33.579 -22.112 80.597 1.00 39.28 ? 299 ARG B CA 1 +ATOM 8120 C C . ARG B 1 299 ? 34.986 -21.923 81.178 1.00 39.71 ? 299 ARG B C 1 +ATOM 8121 O O . ARG B 1 299 ? 35.160 -21.203 82.157 1.00 39.32 ? 299 ARG B O 1 +ATOM 8122 C CB . ARG B 1 299 ? 32.926 -23.361 81.173 1.00 39.08 ? 299 ARG B CB 1 +ATOM 8123 C CG . ARG B 1 299 ? 31.535 -23.113 81.718 1.00 39.94 ? 299 ARG B CG 1 +ATOM 8124 C CD . ARG B 1 299 ? 30.544 -24.076 81.148 1.00 40.08 ? 299 ARG B CD 1 +ATOM 8125 N NE . ARG B 1 299 ? 30.896 -25.461 81.417 1.00 40.63 ? 299 ARG B NE 1 +ATOM 8126 C CZ . ARG B 1 299 ? 30.323 -26.496 80.813 1.00 41.65 ? 299 ARG B CZ 1 +ATOM 8127 N NH1 . ARG B 1 299 ? 29.379 -26.299 79.903 1.00 43.87 ? 299 ARG B NH1 1 +ATOM 8128 N NH2 . ARG B 1 299 ? 30.672 -27.729 81.134 1.00 42.76 ? 299 ARG B NH2 1 +ATOM 8129 N N . GLU B 1 300 ? 35.989 -22.551 80.568 1.00 38.66 ? 300 GLU B N 1 +ATOM 8130 C CA . GLU B 1 300 ? 37.356 -22.405 81.051 1.00 40.25 ? 300 GLU B CA 1 +ATOM 8131 C C . GLU B 1 300 ? 37.842 -20.991 80.806 1.00 38.43 ? 300 GLU B C 1 +ATOM 8132 O O . GLU B 1 300 ? 38.401 -20.347 81.706 1.00 38.46 ? 300 GLU B O 1 +ATOM 8133 C CB . GLU B 1 300 ? 38.291 -23.367 80.331 1.00 45.73 ? 300 GLU B CB 1 +ATOM 8134 C CG . GLU B 1 300 ? 38.004 -24.817 80.597 1.00 52.84 ? 300 GLU B CG 1 +ATOM 8135 C CD . GLU B 1 300 ? 38.894 -25.730 79.774 1.00 58.64 ? 300 GLU B CD 1 +ATOM 8136 O OE1 . GLU B 1 300 ? 38.739 -25.753 78.521 1.00 59.52 ? 300 GLU B OE1 1 +ATOM 8137 O OE2 . GLU B 1 300 ? 39.753 -26.417 80.385 1.00 60.43 ? 300 GLU B OE2 1 +ATOM 8138 N N . TRP B 1 301 ? 37.634 -20.524 79.576 1.00 35.30 ? 301 TRP B N 1 +ATOM 8139 C CA . TRP B 1 301 ? 38.033 -19.184 79.172 1.00 33.62 ? 301 TRP B CA 1 +ATOM 8140 C C . TRP B 1 301 ? 37.420 -18.153 80.118 1.00 34.21 ? 301 TRP B C 1 +ATOM 8141 O O . TRP B 1 301 ? 38.112 -17.257 80.609 1.00 35.03 ? 301 TRP B O 1 +ATOM 8142 C CB . TRP B 1 301 ? 37.579 -18.922 77.729 1.00 34.67 ? 301 TRP B CB 1 +ATOM 8143 C CG . TRP B 1 301 ? 37.645 -17.484 77.296 1.00 33.65 ? 301 TRP B CG 1 +ATOM 8144 C CD1 . TRP B 1 301 ? 38.757 -16.782 76.943 1.00 33.38 ? 301 TRP B CD1 1 +ATOM 8145 C CD2 . TRP B 1 301 ? 36.540 -16.577 77.178 1.00 34.51 ? 301 TRP B CD2 1 +ATOM 8146 N NE1 . TRP B 1 301 ? 38.417 -15.489 76.610 1.00 36.39 ? 301 TRP B NE1 1 +ATOM 8147 C CE2 . TRP B 1 301 ? 37.060 -15.340 76.746 1.00 36.02 ? 301 TRP B CE2 1 +ATOM 8148 C CE3 . TRP B 1 301 ? 35.159 -16.692 77.393 1.00 34.41 ? 301 TRP B CE3 1 +ATOM 8149 C CZ2 . TRP B 1 301 ? 36.246 -14.223 76.526 1.00 36.46 ? 301 TRP B CZ2 1 +ATOM 8150 C CZ3 . TRP B 1 301 ? 34.352 -15.582 77.176 1.00 33.60 ? 301 TRP B CZ3 1 +ATOM 8151 C CH2 . TRP B 1 301 ? 34.897 -14.367 76.747 1.00 34.98 ? 301 TRP B CH2 1 +ATOM 8152 N N . TRP B 1 302 ? 36.121 -18.289 80.381 1.00 33.78 ? 302 TRP B N 1 +ATOM 8153 C CA . TRP B 1 302 ? 35.415 -17.367 81.267 1.00 34.13 ? 302 TRP B CA 1 +ATOM 8154 C C . TRP B 1 302 ? 35.970 -17.424 82.693 1.00 34.57 ? 302 TRP B C 1 +ATOM 8155 O O . TRP B 1 302 ? 36.193 -16.386 83.335 1.00 33.05 ? 302 TRP B O 1 +ATOM 8156 C CB . TRP B 1 302 ? 33.925 -17.701 81.271 1.00 33.90 ? 302 TRP B CB 1 +ATOM 8157 C CG . TRP B 1 302 ? 33.089 -16.782 82.120 1.00 33.15 ? 302 TRP B CG 1 +ATOM 8158 C CD1 . TRP B 1 302 ? 32.617 -17.035 83.370 1.00 32.57 ? 302 TRP B CD1 1 +ATOM 8159 C CD2 . TRP B 1 302 ? 32.601 -15.479 81.762 1.00 33.01 ? 302 TRP B CD2 1 +ATOM 8160 N NE1 . TRP B 1 302 ? 31.861 -15.979 83.816 1.00 32.47 ? 302 TRP B NE1 1 +ATOM 8161 C CE2 . TRP B 1 302 ? 31.834 -15.010 82.847 1.00 32.98 ? 302 TRP B CE2 1 +ATOM 8162 C CE3 . TRP B 1 302 ? 32.736 -14.666 80.628 1.00 33.84 ? 302 TRP B CE3 1 +ATOM 8163 C CZ2 . TRP B 1 302 ? 31.199 -13.759 82.834 1.00 34.24 ? 302 TRP B CZ2 1 +ATOM 8164 C CZ3 . TRP B 1 302 ? 32.102 -13.420 80.613 1.00 34.06 ? 302 TRP B CZ3 1 +ATOM 8165 C CH2 . TRP B 1 302 ? 31.344 -12.982 81.709 1.00 34.53 ? 302 TRP B CH2 1 +ATOM 8166 N N . ALA B 1 303 ? 36.184 -18.644 83.187 1.00 35.36 ? 303 ALA B N 1 +ATOM 8167 C CA . ALA B 1 303 ? 36.738 -18.841 84.523 1.00 34.22 ? 303 ALA B CA 1 +ATOM 8168 C C . ALA B 1 303 ? 38.074 -18.096 84.628 1.00 35.12 ? 303 ALA B C 1 +ATOM 8169 O O . ALA B 1 303 ? 38.388 -17.512 85.665 1.00 35.00 ? 303 ALA B O 1 +ATOM 8170 C CB . ALA B 1 303 ? 36.936 -20.311 84.785 1.00 34.25 ? 303 ALA B CB 1 +ATOM 8171 N N . GLY B 1 304 ? 38.850 -18.105 83.544 1.00 34.19 ? 304 GLY B N 1 +ATOM 8172 C CA . GLY B 1 304 ? 40.121 -17.411 83.552 1.00 33.89 ? 304 GLY B CA 1 +ATOM 8173 C C . GLY B 1 304 ? 39.973 -15.910 83.718 1.00 36.22 ? 304 GLY B C 1 +ATOM 8174 O O . GLY B 1 304 ? 40.690 -15.294 84.508 1.00 38.46 ? 304 GLY B O 1 +ATOM 8175 N N . LEU B 1 305 ? 39.049 -15.304 82.978 1.00 36.57 ? 305 LEU B N 1 +ATOM 8176 C CA . LEU B 1 305 ? 38.841 -13.863 83.072 1.00 35.00 ? 305 LEU B CA 1 +ATOM 8177 C C . LEU B 1 305 ? 38.321 -13.515 84.455 1.00 35.17 ? 305 LEU B C 1 +ATOM 8178 O O . LEU B 1 305 ? 38.731 -12.510 85.046 1.00 35.69 ? 305 LEU B O 1 +ATOM 8179 C CB . LEU B 1 305 ? 37.835 -13.395 82.022 1.00 35.76 ? 305 LEU B CB 1 +ATOM 8180 C CG . LEU B 1 305 ? 38.230 -13.580 80.553 1.00 35.98 ? 305 LEU B CG 1 +ATOM 8181 C CD1 . LEU B 1 305 ? 37.041 -13.205 79.667 1.00 35.05 ? 305 LEU B CD1 1 +ATOM 8182 C CD2 . LEU B 1 305 ? 39.434 -12.717 80.219 1.00 32.19 ? 305 LEU B CD2 1 +ATOM 8183 N N . ILE B 1 306 ? 37.413 -14.339 84.967 1.00 33.34 ? 306 ILE B N 1 +ATOM 8184 C CA . ILE B 1 306 ? 36.857 -14.096 86.294 1.00 34.77 ? 306 ILE B CA 1 +ATOM 8185 C C . ILE B 1 306 ? 37.971 -14.154 87.336 1.00 36.60 ? 306 ILE B C 1 +ATOM 8186 O O . ILE B 1 306 ? 38.117 -13.249 88.160 1.00 35.82 ? 306 ILE B O 1 +ATOM 8187 C CB . ILE B 1 306 ? 35.784 -15.148 86.667 1.00 32.25 ? 306 ILE B CB 1 +ATOM 8188 C CG1 . ILE B 1 306 ? 34.516 -14.916 85.849 1.00 32.15 ? 306 ILE B CG1 1 +ATOM 8189 C CG2 . ILE B 1 306 ? 35.478 -15.077 88.150 1.00 31.77 ? 306 ILE B CG2 1 +ATOM 8190 C CD1 . ILE B 1 306 ? 33.848 -13.590 86.124 1.00 30.77 ? 306 ILE B CD1 1 +ATOM 8191 N N . SER B 1 307 ? 38.749 -15.233 87.289 1.00 38.52 ? 307 SER B N 1 +ATOM 8192 C CA . SER B 1 307 ? 39.854 -15.440 88.216 1.00 40.41 ? 307 SER B CA 1 +ATOM 8193 C C . SER B 1 307 ? 40.780 -14.231 88.209 1.00 40.13 ? 307 SER B C 1 +ATOM 8194 O O . SER B 1 307 ? 41.139 -13.699 89.258 1.00 40.26 ? 307 SER B O 1 +ATOM 8195 C CB . SER B 1 307 ? 40.625 -16.697 87.814 1.00 42.40 ? 307 SER B CB 1 +ATOM 8196 O OG . SER B 1 307 ? 41.540 -17.081 88.823 1.00 46.13 ? 307 SER B OG 1 +ATOM 8197 N N . GLU B 1 308 ? 41.145 -13.792 87.013 1.00 40.14 ? 308 GLU B N 1 +ATOM 8198 C CA . GLU B 1 308 ? 42.022 -12.647 86.853 1.00 42.07 ? 308 GLU B CA 1 +ATOM 8199 C C . GLU B 1 308 ? 41.370 -11.402 87.463 1.00 42.04 ? 308 GLU B C 1 +ATOM 8200 O O . GLU B 1 308 ? 42.040 -10.565 88.076 1.00 43.55 ? 308 GLU B O 1 +ATOM 8201 C CB . GLU B 1 308 ? 42.286 -12.435 85.364 1.00 45.25 ? 308 GLU B CB 1 +ATOM 8202 C CG . GLU B 1 308 ? 43.337 -11.406 85.020 1.00 52.66 ? 308 GLU B CG 1 +ATOM 8203 C CD . GLU B 1 308 ? 43.337 -11.088 83.527 1.00 58.33 ? 308 GLU B CD 1 +ATOM 8204 O OE1 . GLU B 1 308 ? 43.367 -12.048 82.710 1.00 59.19 ? 308 GLU B OE1 1 +ATOM 8205 O OE2 . GLU B 1 308 ? 43.305 -9.881 83.173 1.00 60.88 ? 308 GLU B OE2 1 +ATOM 8206 N N . TRP B 1 309 ? 40.055 -11.288 87.301 1.00 40.58 ? 309 TRP B N 1 +ATOM 8207 C CA . TRP B 1 309 ? 39.307 -10.141 87.821 1.00 37.97 ? 309 TRP B CA 1 +ATOM 8208 C C . TRP B 1 309 ? 39.257 -10.163 89.351 1.00 37.21 ? 309 TRP B C 1 +ATOM 8209 O O . TRP B 1 309 ? 39.355 -9.120 90.000 1.00 35.85 ? 309 TRP B O 1 +ATOM 8210 C CB . TRP B 1 309 ? 37.882 -10.149 87.239 1.00 35.97 ? 309 TRP B CB 1 +ATOM 8211 C CG . TRP B 1 309 ? 37.068 -8.958 87.611 1.00 32.64 ? 309 TRP B CG 1 +ATOM 8212 C CD1 . TRP B 1 309 ? 36.003 -8.927 88.473 1.00 31.02 ? 309 TRP B CD1 1 +ATOM 8213 C CD2 . TRP B 1 309 ? 37.260 -7.613 87.155 1.00 30.50 ? 309 TRP B CD2 1 +ATOM 8214 N NE1 . TRP B 1 309 ? 35.523 -7.642 88.579 1.00 30.85 ? 309 TRP B NE1 1 +ATOM 8215 C CE2 . TRP B 1 309 ? 36.275 -6.816 87.784 1.00 30.32 ? 309 TRP B CE2 1 +ATOM 8216 C CE3 . TRP B 1 309 ? 38.173 -7.002 86.280 1.00 31.21 ? 309 TRP B CE3 1 +ATOM 8217 C CZ2 . TRP B 1 309 ? 36.173 -5.440 87.568 1.00 29.91 ? 309 TRP B CZ2 1 +ATOM 8218 C CZ3 . TRP B 1 309 ? 38.076 -5.630 86.064 1.00 31.87 ? 309 TRP B CZ3 1 +ATOM 8219 C CH2 . TRP B 1 309 ? 37.076 -4.864 86.712 1.00 32.68 ? 309 TRP B CH2 1 +ATOM 8220 N N . LEU B 1 310 ? 39.102 -11.357 89.915 1.00 37.08 ? 310 LEU B N 1 +ATOM 8221 C CA . LEU B 1 310 ? 39.048 -11.535 91.360 1.00 37.48 ? 310 LEU B CA 1 +ATOM 8222 C C . LEU B 1 310 ? 40.397 -11.248 92.024 1.00 39.68 ? 310 LEU B C 1 +ATOM 8223 O O . LEU B 1 310 ? 40.451 -10.801 93.176 1.00 39.75 ? 310 LEU B O 1 +ATOM 8224 C CB . LEU B 1 310 ? 38.632 -12.964 91.704 1.00 35.33 ? 310 LEU B CB 1 +ATOM 8225 C CG . LEU B 1 310 ? 37.172 -13.342 91.482 1.00 36.04 ? 310 LEU B CG 1 +ATOM 8226 C CD1 . LEU B 1 310 ? 36.965 -14.813 91.840 1.00 36.00 ? 310 LEU B CD1 1 +ATOM 8227 C CD2 . LEU B 1 310 ? 36.287 -12.463 92.349 1.00 34.51 ? 310 LEU B CD2 1 +ATOM 8228 N N . SER B 1 311 ? 41.479 -11.495 91.292 1.00 39.76 ? 311 SER B N 1 +ATOM 8229 C CA . SER B 1 311 ? 42.812 -11.291 91.831 1.00 41.26 ? 311 SER B CA 1 +ATOM 8230 C C . SER B 1 311 ? 43.152 -9.851 92.229 1.00 42.25 ? 311 SER B C 1 +ATOM 8231 O O . SER B 1 311 ? 44.127 -9.631 92.954 1.00 43.39 ? 311 SER B O 1 +ATOM 8232 C CB . SER B 1 311 ? 43.856 -11.802 90.839 1.00 41.54 ? 311 SER B CB 1 +ATOM 8233 O OG . SER B 1 311 ? 44.069 -10.854 89.806 1.00 42.98 ? 311 SER B OG 1 +ATOM 8234 N N . GLN B 1 312 ? 42.389 -8.865 91.758 1.00 42.53 ? 312 GLN B N 1 +ATOM 8235 C CA . GLN B 1 312 ? 42.687 -7.483 92.145 1.00 42.22 ? 312 GLN B CA 1 +ATOM 8236 C C . GLN B 1 312 ? 42.187 -7.270 93.569 1.00 41.65 ? 312 GLN B C 1 +ATOM 8237 O O . GLN B 1 312 ? 42.514 -6.272 94.207 1.00 43.11 ? 312 GLN B O 1 +ATOM 8238 C CB . GLN B 1 312 ? 41.966 -6.458 91.272 1.00 43.37 ? 312 GLN B CB 1 +ATOM 8239 C CG . GLN B 1 312 ? 41.501 -6.913 89.919 1.00 46.84 ? 312 GLN B CG 1 +ATOM 8240 C CD . GLN B 1 312 ? 40.487 -5.938 89.339 1.00 48.60 ? 312 GLN B CD 1 +ATOM 8241 O OE1 . GLN B 1 312 ? 40.785 -4.753 89.150 1.00 49.34 ? 312 GLN B OE1 1 +ATOM 8242 N NE2 . GLN B 1 312 ? 39.278 -6.429 89.070 1.00 47.00 ? 312 GLN B NE2 1 +ATOM 8243 N N . GLY B 1 313 ? 41.372 -8.200 94.053 1.00 40.50 ? 313 GLY B N 1 +ATOM 8244 C CA . GLY B 1 313 ? 40.823 -8.071 95.390 1.00 39.12 ? 313 GLY B CA 1 +ATOM 8245 C C . GLY B 1 313 ? 39.301 -7.968 95.403 1.00 39.97 ? 313 GLY B C 1 +ATOM 8246 O O . GLY B 1 313 ? 38.700 -7.724 96.456 1.00 40.93 ? 313 GLY B O 1 +ATOM 8247 N N . VAL B 1 314 ? 38.670 -8.136 94.239 1.00 38.23 ? 314 VAL B N 1 +ATOM 8248 C CA . VAL B 1 314 ? 37.218 -8.088 94.149 1.00 35.20 ? 314 VAL B CA 1 +ATOM 8249 C C . VAL B 1 314 ? 36.724 -9.300 94.920 1.00 34.04 ? 314 VAL B C 1 +ATOM 8250 O O . VAL B 1 314 ? 37.207 -10.399 94.713 1.00 32.26 ? 314 VAL B O 1 +ATOM 8251 C CB . VAL B 1 314 ? 36.741 -8.155 92.669 1.00 35.95 ? 314 VAL B CB 1 +ATOM 8252 C CG1 . VAL B 1 314 ? 35.234 -8.413 92.607 1.00 33.53 ? 314 VAL B CG1 1 +ATOM 8253 C CG2 . VAL B 1 314 ? 37.079 -6.835 91.956 1.00 33.74 ? 314 VAL B CG2 1 +ATOM 8254 N N . ASP B 1 315 ? 35.744 -9.094 95.792 1.00 34.90 ? 315 ASP B N 1 +ATOM 8255 C CA . ASP B 1 315 ? 35.214 -10.160 96.641 1.00 35.24 ? 315 ASP B CA 1 +ATOM 8256 C C . ASP B 1 315 ? 34.041 -10.973 96.128 1.00 35.95 ? 315 ASP B C 1 +ATOM 8257 O O . ASP B 1 315 ? 33.841 -12.108 96.571 1.00 37.60 ? 315 ASP B O 1 +ATOM 8258 C CB . ASP B 1 315 ? 34.855 -9.560 98.003 1.00 36.40 ? 315 ASP B CB 1 +ATOM 8259 C CG . ASP B 1 315 ? 36.030 -8.811 98.630 1.00 39.50 ? 315 ASP B CG 1 +ATOM 8260 O OD1 . ASP B 1 315 ? 36.989 -9.491 99.070 1.00 44.08 ? 315 ASP B OD1 1 +ATOM 8261 O OD2 . ASP B 1 315 ? 36.019 -7.555 98.663 1.00 36.13 ? 315 ASP B OD2 1 +ATOM 8262 N N . GLY B 1 316 ? 33.257 -10.409 95.209 1.00 37.06 ? 316 GLY B N 1 +ATOM 8263 C CA . GLY B 1 316 ? 32.101 -11.135 94.701 1.00 34.92 ? 316 GLY B CA 1 +ATOM 8264 C C . GLY B 1 316 ? 31.699 -10.751 93.296 1.00 33.97 ? 316 GLY B C 1 +ATOM 8265 O O . GLY B 1 316 ? 32.037 -9.664 92.812 1.00 33.26 ? 316 GLY B O 1 +ATOM 8266 N N . ILE B 1 317 ? 30.970 -11.652 92.645 1.00 32.76 ? 317 ILE B N 1 +ATOM 8267 C CA . ILE B 1 317 ? 30.515 -11.433 91.275 1.00 32.81 ? 317 ILE B CA 1 +ATOM 8268 C C . ILE B 1 317 ? 28.988 -11.373 91.218 1.00 32.69 ? 317 ILE B C 1 +ATOM 8269 O O . ILE B 1 317 ? 28.280 -12.220 91.782 1.00 30.48 ? 317 ILE B O 1 +ATOM 8270 C CB . ILE B 1 317 ? 31.014 -12.561 90.335 1.00 31.76 ? 317 ILE B CB 1 +ATOM 8271 C CG1 . ILE B 1 317 ? 32.546 -12.642 90.377 1.00 32.00 ? 317 ILE B CG1 1 +ATOM 8272 C CG2 . ILE B 1 317 ? 30.553 -12.299 88.905 1.00 33.31 ? 317 ILE B CG2 1 +ATOM 8273 C CD1 . ILE B 1 317 ? 33.256 -11.408 89.848 1.00 30.36 ? 317 ILE B CD1 1 +ATOM 8274 N N . TRP B 1 318 ? 28.490 -10.349 90.540 1.00 32.99 ? 318 TRP B N 1 +ATOM 8275 C CA . TRP B 1 318 ? 27.060 -10.146 90.381 1.00 33.07 ? 318 TRP B CA 1 +ATOM 8276 C C . TRP B 1 318 ? 26.744 -10.304 88.896 1.00 32.76 ? 318 TRP B C 1 +ATOM 8277 O O . TRP B 1 318 ? 27.057 -9.426 88.092 1.00 33.49 ? 318 TRP B O 1 +ATOM 8278 C CB . TRP B 1 318 ? 26.710 -8.751 90.889 1.00 33.78 ? 318 TRP B CB 1 +ATOM 8279 C CG . TRP B 1 318 ? 25.329 -8.253 90.583 1.00 36.34 ? 318 TRP B CG 1 +ATOM 8280 C CD1 . TRP B 1 318 ? 24.233 -8.994 90.229 1.00 35.52 ? 318 TRP B CD1 1 +ATOM 8281 C CD2 . TRP B 1 318 ? 24.891 -6.891 90.648 1.00 36.33 ? 318 TRP B CD2 1 +ATOM 8282 N NE1 . TRP B 1 318 ? 23.142 -8.172 90.072 1.00 35.33 ? 318 TRP B NE1 1 +ATOM 8283 C CE2 . TRP B 1 318 ? 23.517 -6.878 90.323 1.00 36.06 ? 318 TRP B CE2 1 +ATOM 8284 C CE3 . TRP B 1 318 ? 25.530 -5.678 90.951 1.00 36.99 ? 318 TRP B CE3 1 +ATOM 8285 C CZ2 . TRP B 1 318 ? 22.765 -5.694 90.293 1.00 37.28 ? 318 TRP B CZ2 1 +ATOM 8286 C CZ3 . TRP B 1 318 ? 24.783 -4.499 90.923 1.00 37.70 ? 318 TRP B CZ3 1 +ATOM 8287 C CH2 . TRP B 1 318 ? 23.414 -4.518 90.595 1.00 37.60 ? 318 TRP B CH2 1 +ATOM 8288 N N . LEU B 1 319 ? 26.147 -11.440 88.545 1.00 33.13 ? 319 LEU B N 1 +ATOM 8289 C CA . LEU B 1 319 ? 25.787 -11.750 87.160 1.00 33.72 ? 319 LEU B CA 1 +ATOM 8290 C C . LEU B 1 319 ? 24.407 -11.184 86.821 1.00 35.50 ? 319 LEU B C 1 +ATOM 8291 O O . LEU B 1 319 ? 23.397 -11.557 87.427 1.00 36.69 ? 319 LEU B O 1 +ATOM 8292 C CB . LEU B 1 319 ? 25.785 -13.264 86.952 1.00 31.50 ? 319 LEU B CB 1 +ATOM 8293 C CG . LEU B 1 319 ? 27.106 -14.003 87.210 1.00 32.29 ? 319 LEU B CG 1 +ATOM 8294 C CD1 . LEU B 1 319 ? 26.903 -15.497 87.020 1.00 30.77 ? 319 LEU B CD1 1 +ATOM 8295 C CD2 . LEU B 1 319 ? 28.182 -13.490 86.249 1.00 32.58 ? 319 LEU B CD2 1 +ATOM 8296 N N . ASP B 1 320 ? 24.362 -10.284 85.847 1.00 37.02 ? 320 ASP B N 1 +ATOM 8297 C CA . ASP B 1 320 ? 23.103 -9.664 85.457 1.00 37.58 ? 320 ASP B CA 1 +ATOM 8298 C C . ASP B 1 320 ? 22.773 -9.856 83.974 1.00 36.88 ? 320 ASP B C 1 +ATOM 8299 O O . ASP B 1 320 ? 23.653 -10.183 83.169 1.00 35.72 ? 320 ASP B O 1 +ATOM 8300 C CB . ASP B 1 320 ? 23.165 -8.173 85.800 1.00 38.55 ? 320 ASP B CB 1 +ATOM 8301 C CG . ASP B 1 320 ? 21.814 -7.494 85.716 1.00 42.39 ? 320 ASP B CG 1 +ATOM 8302 O OD1 . ASP B 1 320 ? 20.791 -8.171 86.004 1.00 42.25 ? 320 ASP B OD1 1 +ATOM 8303 O OD2 . ASP B 1 320 ? 21.782 -6.279 85.376 1.00 41.58 ? 320 ASP B OD2 1 +ATOM 8304 N N . MET B 1 321 ? 21.498 -9.671 83.627 1.00 36.36 ? 321 MET B N 1 +ATOM 8305 C CA . MET B 1 321 ? 21.030 -9.789 82.235 1.00 35.83 ? 321 MET B CA 1 +ATOM 8306 C C . MET B 1 321 ? 21.283 -11.170 81.636 1.00 34.99 ? 321 MET B C 1 +ATOM 8307 O O . MET B 1 321 ? 21.203 -11.351 80.418 1.00 34.30 ? 321 MET B O 1 +ATOM 8308 C CB . MET B 1 321 ? 21.740 -8.749 81.356 1.00 35.73 ? 321 MET B CB 1 +ATOM 8309 C CG . MET B 1 321 ? 21.797 -7.340 81.931 1.00 37.59 ? 321 MET B CG 1 +ATOM 8310 S SD . MET B 1 321 ? 20.157 -6.684 82.307 1.00 40.88 ? 321 MET B SD 1 +ATOM 8311 C CE . MET B 1 321 ? 19.415 -6.645 80.597 1.00 39.00 ? 321 MET B CE 1 +ATOM 8312 N N . ASN B 1 322 ? 21.576 -12.145 82.489 1.00 34.81 ? 322 ASN B N 1 +ATOM 8313 C CA . ASN B 1 322 ? 21.905 -13.485 82.015 1.00 34.30 ? 322 ASN B CA 1 +ATOM 8314 C C . ASN B 1 322 ? 20.747 -14.448 81.749 1.00 33.76 ? 322 ASN B C 1 +ATOM 8315 O O . ASN B 1 322 ? 20.891 -15.658 81.936 1.00 32.81 ? 322 ASN B O 1 +ATOM 8316 C CB . ASN B 1 322 ? 22.912 -14.121 82.985 1.00 33.75 ? 322 ASN B CB 1 +ATOM 8317 C CG . ASN B 1 322 ? 22.344 -14.314 84.378 1.00 35.54 ? 322 ASN B CG 1 +ATOM 8318 O OD1 . ASN B 1 322 ? 21.432 -13.598 84.799 1.00 38.14 ? 322 ASN B OD1 1 +ATOM 8319 N ND2 . ASN B 1 322 ? 22.895 -15.274 85.111 1.00 35.58 ? 322 ASN B ND2 1 +ATOM 8320 N N . GLU B 1 323 ? 19.615 -13.923 81.284 1.00 33.81 ? 323 GLU B N 1 +ATOM 8321 C CA . GLU B 1 323 ? 18.449 -14.763 80.995 1.00 32.91 ? 323 GLU B CA 1 +ATOM 8322 C C . GLU B 1 323 ? 18.645 -15.852 79.933 1.00 32.17 ? 323 GLU B C 1 +ATOM 8323 O O . GLU B 1 323 ? 18.112 -16.955 80.080 1.00 30.89 ? 323 GLU B O 1 +ATOM 8324 C CB . GLU B 1 323 ? 17.244 -13.907 80.603 1.00 35.00 ? 323 GLU B CB 1 +ATOM 8325 C CG . GLU B 1 323 ? 16.577 -13.174 81.757 1.00 36.32 ? 323 GLU B CG 1 +ATOM 8326 C CD . GLU B 1 323 ? 17.508 -12.175 82.435 1.00 40.66 ? 323 GLU B CD 1 +ATOM 8327 O OE1 . GLU B 1 323 ? 18.171 -11.381 81.720 1.00 39.80 ? 323 GLU B OE1 1 +ATOM 8328 O OE2 . GLU B 1 323 ? 17.570 -12.178 83.685 1.00 41.13 ? 323 GLU B OE2 1 +ATOM 8329 N N . PRO B 1 324 ? 19.407 -15.574 78.857 1.00 31.27 ? 324 PRO B N 1 +ATOM 8330 C CA . PRO B 1 324 ? 20.132 -14.356 78.489 1.00 32.70 ? 324 PRO B CA 1 +ATOM 8331 C C . PRO B 1 324 ? 19.262 -13.346 77.737 1.00 34.43 ? 324 PRO B C 1 +ATOM 8332 O O . PRO B 1 324 ? 18.357 -13.718 76.983 1.00 34.72 ? 324 PRO B O 1 +ATOM 8333 C CB . PRO B 1 324 ? 21.270 -14.888 77.624 1.00 31.09 ? 324 PRO B CB 1 +ATOM 8334 C CG . PRO B 1 324 ? 20.592 -15.978 76.866 1.00 30.03 ? 324 PRO B CG 1 +ATOM 8335 C CD . PRO B 1 324 ? 19.727 -16.664 77.913 1.00 31.42 ? 324 PRO B CD 1 +ATOM 8336 N N . THR B 1 325 ? 19.574 -12.070 77.935 1.00 34.40 ? 325 THR B N 1 +ATOM 8337 C CA . THR B 1 325 ? 18.846 -10.978 77.323 1.00 34.66 ? 325 THR B CA 1 +ATOM 8338 C C . THR B 1 325 ? 19.601 -10.338 76.163 1.00 35.39 ? 325 THR B C 1 +ATOM 8339 O O . THR B 1 325 ? 20.836 -10.299 76.152 1.00 37.71 ? 325 THR B O 1 +ATOM 8340 C CB . THR B 1 325 ? 18.526 -9.903 78.383 1.00 34.43 ? 325 THR B CB 1 +ATOM 8341 O OG1 . THR B 1 325 ? 17.602 -10.451 79.338 1.00 35.14 ? 325 THR B OG1 1 +ATOM 8342 C CG2 . THR B 1 325 ? 17.918 -8.659 77.739 1.00 33.57 ? 325 THR B CG2 1 +ATOM 8343 N N . ASP B 1 326 ? 18.848 -9.864 75.175 1.00 34.01 ? 326 ASP B N 1 +ATOM 8344 C CA . ASP B 1 326 ? 19.408 -9.196 74.005 1.00 34.66 ? 326 ASP B CA 1 +ATOM 8345 C C . ASP B 1 326 ? 18.414 -8.126 73.556 1.00 35.36 ? 326 ASP B C 1 +ATOM 8346 O O . ASP B 1 326 ? 17.197 -8.333 73.597 1.00 36.61 ? 326 ASP B O 1 +ATOM 8347 C CB . ASP B 1 326 ? 19.652 -10.186 72.866 1.00 34.53 ? 326 ASP B CB 1 +ATOM 8348 C CG . ASP B 1 326 ? 20.137 -9.500 71.592 1.00 36.54 ? 326 ASP B CG 1 +ATOM 8349 O OD1 . ASP B 1 326 ? 21.243 -8.915 71.595 1.00 37.89 ? 326 ASP B OD1 1 +ATOM 8350 O OD2 . ASP B 1 326 ? 19.410 -9.538 70.583 1.00 36.72 ? 326 ASP B OD2 1 +ATOM 8351 N N . PHE B 1 327 ? 18.926 -6.982 73.123 1.00 34.71 ? 327 PHE B N 1 +ATOM 8352 C CA . PHE B 1 327 ? 18.055 -5.894 72.714 1.00 35.77 ? 327 PHE B CA 1 +ATOM 8353 C C . PHE B 1 327 ? 18.032 -5.575 71.225 1.00 36.12 ? 327 PHE B C 1 +ATOM 8354 O O . PHE B 1 327 ? 17.428 -4.585 70.824 1.00 37.13 ? 327 PHE B O 1 +ATOM 8355 C CB . PHE B 1 327 ? 18.431 -4.637 73.496 1.00 34.83 ? 327 PHE B CB 1 +ATOM 8356 C CG . PHE B 1 327 ? 18.157 -4.743 74.969 1.00 36.92 ? 327 PHE B CG 1 +ATOM 8357 C CD1 . PHE B 1 327 ? 16.846 -4.830 75.445 1.00 38.47 ? 327 PHE B CD1 1 +ATOM 8358 C CD2 . PHE B 1 327 ? 19.204 -4.765 75.883 1.00 37.21 ? 327 PHE B CD2 1 +ATOM 8359 C CE1 . PHE B 1 327 ? 16.583 -4.936 76.815 1.00 39.36 ? 327 PHE B CE1 1 +ATOM 8360 C CE2 . PHE B 1 327 ? 18.957 -4.871 77.247 1.00 38.52 ? 327 PHE B CE2 1 +ATOM 8361 C CZ . PHE B 1 327 ? 17.643 -4.957 77.717 1.00 39.52 ? 327 PHE B CZ 1 +ATOM 8362 N N . SER B 1 328 ? 18.669 -6.398 70.401 1.00 35.52 ? 328 SER B N 1 +ATOM 8363 C CA . SER B 1 328 ? 18.688 -6.102 68.978 1.00 37.19 ? 328 SER B CA 1 +ATOM 8364 C C . SER B 1 328 ? 17.299 -6.071 68.337 1.00 37.79 ? 328 SER B C 1 +ATOM 8365 O O . SER B 1 328 ? 17.027 -5.217 67.484 1.00 38.01 ? 328 SER B O 1 +ATOM 8366 C CB . SER B 1 328 ? 19.612 -7.075 68.231 1.00 36.20 ? 328 SER B CB 1 +ATOM 8367 O OG . SER B 1 328 ? 19.226 -8.421 68.422 1.00 40.19 ? 328 SER B OG 1 +ATOM 8368 N N . ARG B 1 329 ? 16.412 -6.978 68.738 1.00 38.58 ? 329 ARG B N 1 +ATOM 8369 C CA . ARG B 1 329 ? 15.062 -6.989 68.171 1.00 39.23 ? 329 ARG B CA 1 +ATOM 8370 C C . ARG B 1 329 ? 14.293 -5.731 68.571 1.00 39.23 ? 329 ARG B C 1 +ATOM 8371 O O . ARG B 1 329 ? 13.660 -5.089 67.734 1.00 39.24 ? 329 ARG B O 1 +ATOM 8372 C CB . ARG B 1 329 ? 14.283 -8.219 68.633 1.00 41.62 ? 329 ARG B CB 1 +ATOM 8373 C CG . ARG B 1 329 ? 13.992 -9.242 67.532 1.00 44.67 ? 329 ARG B CG 1 +ATOM 8374 C CD . ARG B 1 329 ? 14.865 -10.487 67.652 1.00 45.62 ? 329 ARG B CD 1 +ATOM 8375 N NE . ARG B 1 329 ? 14.711 -11.151 68.949 1.00 48.76 ? 329 ARG B NE 1 +ATOM 8376 C CZ . ARG B 1 329 ? 13.611 -11.783 69.360 1.00 49.23 ? 329 ARG B CZ 1 +ATOM 8377 N NH1 . ARG B 1 329 ? 12.541 -11.856 68.580 1.00 49.87 ? 329 ARG B NH1 1 +ATOM 8378 N NH2 . ARG B 1 329 ? 13.576 -12.335 70.565 1.00 49.77 ? 329 ARG B NH2 1 +ATOM 8379 N N . ALA B 1 330 ? 14.347 -5.380 69.851 1.00 38.97 ? 330 ALA B N 1 +ATOM 8380 C CA . ALA B 1 330 ? 13.652 -4.195 70.341 1.00 39.84 ? 330 ALA B CA 1 +ATOM 8381 C C . ALA B 1 330 ? 14.148 -2.941 69.633 1.00 41.45 ? 330 ALA B C 1 +ATOM 8382 O O . ALA B 1 330 ? 13.353 -2.114 69.191 1.00 42.70 ? 330 ALA B O 1 +ATOM 8383 C CB . ALA B 1 330 ? 13.851 -4.057 71.834 1.00 38.78 ? 330 ALA B CB 1 +ATOM 8384 N N . ILE B 1 331 ? 15.466 -2.805 69.529 1.00 42.71 ? 331 ILE B N 1 +ATOM 8385 C CA . ILE B 1 331 ? 16.082 -1.656 68.881 1.00 42.58 ? 331 ILE B CA 1 +ATOM 8386 C C . ILE B 1 331 ? 15.750 -1.593 67.400 1.00 44.05 ? 331 ILE B C 1 +ATOM 8387 O O . ILE B 1 331 ? 15.590 -0.518 66.838 1.00 43.16 ? 331 ILE B O 1 +ATOM 8388 C CB . ILE B 1 331 ? 17.600 -1.690 69.094 1.00 42.37 ? 331 ILE B CB 1 +ATOM 8389 C CG1 . ILE B 1 331 ? 17.896 -1.245 70.529 1.00 42.81 ? 331 ILE B CG1 1 +ATOM 8390 C CG2 . ILE B 1 331 ? 18.319 -0.817 68.074 1.00 39.85 ? 331 ILE B CG2 1 +ATOM 8391 C CD1 . ILE B 1 331 ? 19.357 -1.349 70.913 1.00 43.67 ? 331 ILE B CD1 1 +ATOM 8392 N N . GLU B 1 332 ? 15.639 -2.755 66.775 1.00 47.38 ? 332 GLU B N 1 +ATOM 8393 C CA . GLU B 1 332 ? 15.306 -2.844 65.357 1.00 49.74 ? 332 GLU B CA 1 +ATOM 8394 C C . GLU B 1 332 ? 13.908 -2.242 65.144 1.00 50.00 ? 332 GLU B C 1 +ATOM 8395 O O . GLU B 1 332 ? 13.689 -1.459 64.220 1.00 49.98 ? 332 GLU B O 1 +ATOM 8396 C CB . GLU B 1 332 ? 15.344 -4.318 64.939 1.00 53.08 ? 332 GLU B CB 1 +ATOM 8397 C CG . GLU B 1 332 ? 15.171 -4.608 63.467 1.00 57.77 ? 332 GLU B CG 1 +ATOM 8398 C CD . GLU B 1 332 ? 15.520 -6.056 63.129 1.00 61.86 ? 332 GLU B CD 1 +ATOM 8399 O OE1 . GLU B 1 332 ? 14.956 -6.979 63.767 1.00 63.31 ? 332 GLU B OE1 1 +ATOM 8400 O OE2 . GLU B 1 332 ? 16.359 -6.271 62.224 1.00 64.31 ? 332 GLU B OE2 1 +ATOM 8401 N N . ILE B 1 333 ? 12.976 -2.596 66.024 1.00 49.60 ? 333 ILE B N 1 +ATOM 8402 C CA . ILE B 1 333 ? 11.609 -2.100 65.952 1.00 50.28 ? 333 ILE B CA 1 +ATOM 8403 C C . ILE B 1 333 ? 11.571 -0.595 66.192 1.00 53.02 ? 333 ILE B C 1 +ATOM 8404 O O . ILE B 1 333 ? 10.874 0.147 65.491 1.00 53.11 ? 333 ILE B O 1 +ATOM 8405 C CB . ILE B 1 333 ? 10.725 -2.786 67.014 1.00 48.38 ? 333 ILE B CB 1 +ATOM 8406 C CG1 . ILE B 1 333 ? 10.551 -4.260 66.667 1.00 46.06 ? 333 ILE B CG1 1 +ATOM 8407 C CG2 . ILE B 1 333 ? 9.375 -2.094 67.105 1.00 48.40 ? 333 ILE B CG2 1 +ATOM 8408 C CD1 . ILE B 1 333 ? 9.904 -5.061 67.766 1.00 45.70 ? 333 ILE B CD1 1 +ATOM 8409 N N . ARG B 1 334 ? 12.323 -0.152 67.191 1.00 54.43 ? 334 ARG B N 1 +ATOM 8410 C CA . ARG B 1 334 ? 12.373 1.255 67.539 1.00 56.88 ? 334 ARG B CA 1 +ATOM 8411 C C . ARG B 1 334 ? 12.988 2.107 66.418 1.00 57.92 ? 334 ARG B C 1 +ATOM 8412 O O . ARG B 1 334 ? 12.667 3.285 66.293 1.00 58.80 ? 334 ARG B O 1 +ATOM 8413 C CB . ARG B 1 334 ? 13.141 1.430 68.864 1.00 58.39 ? 334 ARG B CB 1 +ATOM 8414 C CG . ARG B 1 334 ? 13.323 2.868 69.328 1.00 61.45 ? 334 ARG B CG 1 +ATOM 8415 C CD . ARG B 1 334 ? 14.727 3.385 69.007 1.00 64.85 ? 334 ARG B CD 1 +ATOM 8416 N NE . ARG B 1 334 ? 15.710 3.014 70.028 1.00 68.24 ? 334 ARG B NE 1 +ATOM 8417 C CZ . ARG B 1 334 ? 17.031 3.099 69.867 1.00 69.70 ? 334 ARG B CZ 1 +ATOM 8418 N NH1 . ARG B 1 334 ? 17.538 3.538 68.719 1.00 70.27 ? 334 ARG B NH1 1 +ATOM 8419 N NH2 . ARG B 1 334 ? 17.849 2.755 70.855 1.00 69.07 ? 334 ARG B NH2 1 +ATOM 8420 N N . ASP B 1 335 ? 13.859 1.524 65.596 1.00 58.81 ? 335 ASP B N 1 +ATOM 8421 C CA . ASP B 1 335 ? 14.473 2.288 64.508 1.00 60.03 ? 335 ASP B CA 1 +ATOM 8422 C C . ASP B 1 335 ? 13.530 2.444 63.322 1.00 60.11 ? 335 ASP B C 1 +ATOM 8423 O O . ASP B 1 335 ? 13.468 3.501 62.694 1.00 60.18 ? 335 ASP B O 1 +ATOM 8424 C CB . ASP B 1 335 ? 15.759 1.621 64.004 1.00 61.80 ? 335 ASP B CB 1 +ATOM 8425 C CG . ASP B 1 335 ? 16.901 1.697 65.006 1.00 65.11 ? 335 ASP B CG 1 +ATOM 8426 O OD1 . ASP B 1 335 ? 16.877 2.585 65.896 1.00 65.53 ? 335 ASP B OD1 1 +ATOM 8427 O OD2 . ASP B 1 335 ? 17.835 0.868 64.883 1.00 66.28 ? 335 ASP B OD2 1 +ATOM 8428 N N . VAL B 1 336 ? 12.799 1.380 63.015 1.00 59.72 ? 336 VAL B N 1 +ATOM 8429 C CA . VAL B 1 336 ? 11.877 1.397 61.893 1.00 58.38 ? 336 VAL B CA 1 +ATOM 8430 C C . VAL B 1 336 ? 10.588 2.179 62.156 1.00 58.82 ? 336 VAL B C 1 +ATOM 8431 O O . VAL B 1 336 ? 10.082 2.846 61.260 1.00 58.60 ? 336 VAL B O 1 +ATOM 8432 C CB . VAL B 1 336 ? 11.525 -0.043 61.467 1.00 57.26 ? 336 VAL B CB 1 +ATOM 8433 C CG1 . VAL B 1 336 ? 10.511 -0.025 60.341 1.00 56.60 ? 336 VAL B CG1 1 +ATOM 8434 C CG2 . VAL B 1 336 ? 12.787 -0.770 61.029 1.00 55.57 ? 336 VAL B CG2 1 +ATOM 8435 N N . LEU B 1 337 ? 10.070 2.116 63.380 1.00 59.02 ? 337 LEU B N 1 +ATOM 8436 C CA . LEU B 1 337 ? 8.824 2.807 63.706 1.00 60.43 ? 337 LEU B CA 1 +ATOM 8437 C C . LEU B 1 337 ? 8.965 3.956 64.707 1.00 62.67 ? 337 LEU B C 1 +ATOM 8438 O O . LEU B 1 337 ? 7.969 4.431 65.237 1.00 62.27 ? 337 LEU B O 1 +ATOM 8439 C CB . LEU B 1 337 ? 7.802 1.802 64.254 1.00 58.60 ? 337 LEU B CB 1 +ATOM 8440 C CG . LEU B 1 337 ? 7.582 0.537 63.419 1.00 58.50 ? 337 LEU B CG 1 +ATOM 8441 C CD1 . LEU B 1 337 ? 6.653 -0.413 64.149 1.00 57.78 ? 337 LEU B CD1 1 +ATOM 8442 C CD2 . LEU B 1 337 ? 7.014 0.908 62.062 1.00 58.34 ? 337 LEU B CD2 1 +ATOM 8443 N N . SER B 1 338 ? 10.186 4.402 64.982 1.00 65.89 ? 338 SER B N 1 +ATOM 8444 C CA . SER B 1 338 ? 10.404 5.493 65.947 1.00 68.29 ? 338 SER B CA 1 +ATOM 8445 C C . SER B 1 338 ? 9.490 6.701 65.723 1.00 69.36 ? 338 SER B C 1 +ATOM 8446 O O . SER B 1 338 ? 8.806 7.173 66.634 1.00 69.36 ? 338 SER B O 1 +ATOM 8447 C CB . SER B 1 338 ? 11.862 5.964 65.884 1.00 68.43 ? 338 SER B CB 1 +ATOM 8448 O OG . SER B 1 338 ? 12.220 6.314 64.553 1.00 69.09 ? 338 SER B OG 1 +ATOM 8449 N N . SER B 1 339 ? 9.511 7.184 64.489 1.00 70.60 ? 339 SER B N 1 +ATOM 8450 C CA . SER B 1 339 ? 8.748 8.336 64.027 1.00 71.96 ? 339 SER B CA 1 +ATOM 8451 C C . SER B 1 339 ? 7.232 8.294 64.214 1.00 72.86 ? 339 SER B C 1 +ATOM 8452 O O . SER B 1 339 ? 6.608 9.322 64.475 1.00 72.80 ? 339 SER B O 1 +ATOM 8453 C CB . SER B 1 339 ? 9.050 8.524 62.555 1.00 72.72 ? 339 SER B CB 1 +ATOM 8454 O OG . SER B 1 339 ? 8.977 7.260 61.908 1.00 72.85 ? 339 SER B OG 1 +ATOM 8455 N N . LEU B 1 340 ? 6.637 7.118 64.048 1.00 73.70 ? 340 LEU B N 1 +ATOM 8456 C CA . LEU B 1 340 ? 5.197 6.978 64.202 1.00 74.86 ? 340 LEU B CA 1 +ATOM 8457 C C . LEU B 1 340 ? 4.731 7.456 65.572 1.00 75.53 ? 340 LEU B C 1 +ATOM 8458 O O . LEU B 1 340 ? 5.314 7.101 66.597 1.00 75.56 ? 340 LEU B O 1 +ATOM 8459 C CB . LEU B 1 340 ? 4.782 5.520 63.991 1.00 75.69 ? 340 LEU B CB 1 +ATOM 8460 C CG . LEU B 1 340 ? 4.672 5.028 62.543 1.00 76.72 ? 340 LEU B CG 1 +ATOM 8461 C CD1 . LEU B 1 340 ? 3.516 5.750 61.853 1.00 76.72 ? 340 LEU B CD1 1 +ATOM 8462 C CD2 . LEU B 1 340 ? 5.980 5.263 61.801 1.00 76.58 ? 340 LEU B CD2 1 +ATOM 8463 N N . PRO B 1 341 ? 3.675 8.288 65.604 1.00 76.30 ? 341 PRO B N 1 +ATOM 8464 C CA . PRO B 1 341 ? 3.118 8.822 66.853 1.00 76.47 ? 341 PRO B CA 1 +ATOM 8465 C C . PRO B 1 341 ? 2.374 7.727 67.616 1.00 76.09 ? 341 PRO B C 1 +ATOM 8466 O O . PRO B 1 341 ? 1.748 7.971 68.645 1.00 76.35 ? 341 PRO B O 1 +ATOM 8467 C CB . PRO B 1 341 ? 2.186 9.926 66.363 1.00 76.95 ? 341 PRO B CB 1 +ATOM 8468 C CG . PRO B 1 341 ? 1.686 9.371 65.055 1.00 77.19 ? 341 PRO B CG 1 +ATOM 8469 C CD . PRO B 1 341 ? 2.952 8.821 64.433 1.00 76.18 ? 341 PRO B CD 1 +ATOM 8470 N N . VAL B 1 342 ? 2.469 6.514 67.086 1.00 75.95 ? 342 VAL B N 1 +ATOM 8471 C CA . VAL B 1 342 ? 1.828 5.336 67.649 1.00 75.33 ? 342 VAL B CA 1 +ATOM 8472 C C . VAL B 1 342 ? 2.607 4.704 68.807 1.00 75.49 ? 342 VAL B C 1 +ATOM 8473 O O . VAL B 1 342 ? 3.836 4.766 68.860 1.00 75.17 ? 342 VAL B O 1 +ATOM 8474 C CB . VAL B 1 342 ? 1.613 4.288 66.538 1.00 74.70 ? 342 VAL B CB 1 +ATOM 8475 C CG1 . VAL B 1 342 ? 1.275 2.942 67.134 1.00 74.47 ? 342 VAL B CG1 1 +ATOM 8476 C CG2 . VAL B 1 342 ? 0.509 4.758 65.605 1.00 74.24 ? 342 VAL B CG2 1 +ATOM 8477 N N . GLN B 1 343 ? 1.869 4.093 69.729 1.00 75.88 ? 343 GLN B N 1 +ATOM 8478 C CA . GLN B 1 343 ? 2.448 3.441 70.897 1.00 76.36 ? 343 GLN B CA 1 +ATOM 8479 C C . GLN B 1 343 ? 2.750 1.959 70.652 1.00 76.70 ? 343 GLN B C 1 +ATOM 8480 O O . GLN B 1 343 ? 2.068 1.296 69.871 1.00 76.83 ? 343 GLN B O 1 +ATOM 8481 C CB . GLN B 1 343 ? 1.496 3.577 72.079 1.00 76.41 ? 343 GLN B CB 1 +ATOM 8482 C CG . GLN B 1 343 ? 2.033 3.013 73.364 1.00 76.93 ? 343 GLN B CG 1 +ATOM 8483 C CD . GLN B 1 343 ? 1.058 3.183 74.499 1.00 78.73 ? 343 GLN B CD 1 +ATOM 8484 O OE1 . GLN B 1 343 ? 0.602 4.296 74.776 1.00 78.82 ? 343 GLN B OE1 1 +ATOM 8485 N NE2 . GLN B 1 343 ? 0.729 2.082 75.169 1.00 78.71 ? 343 GLN B NE2 1 +ATOM 8486 N N . PHE B 1 344 ? 3.774 1.448 71.331 1.00 76.97 ? 344 PHE B N 1 +ATOM 8487 C CA . PHE B 1 344 ? 4.181 0.056 71.188 1.00 76.75 ? 344 PHE B CA 1 +ATOM 8488 C C . PHE B 1 344 ? 3.663 -0.782 72.347 1.00 76.35 ? 344 PHE B C 1 +ATOM 8489 O O . PHE B 1 344 ? 3.534 -0.290 73.466 1.00 75.48 ? 344 PHE B O 1 +ATOM 8490 C CB . PHE B 1 344 ? 5.709 -0.063 71.168 1.00 78.15 ? 344 PHE B CB 1 +ATOM 8491 C CG . PHE B 1 344 ? 6.383 0.741 70.093 1.00 79.56 ? 344 PHE B CG 1 +ATOM 8492 C CD1 . PHE B 1 344 ? 6.091 0.527 68.751 1.00 80.73 ? 344 PHE B CD1 1 +ATOM 8493 C CD2 . PHE B 1 344 ? 7.350 1.689 70.425 1.00 80.84 ? 344 PHE B CD2 1 +ATOM 8494 C CE1 . PHE B 1 344 ? 6.757 1.243 67.750 1.00 81.96 ? 344 PHE B CE1 1 +ATOM 8495 C CE2 . PHE B 1 344 ? 8.020 2.409 69.436 1.00 80.97 ? 344 PHE B CE2 1 +ATOM 8496 C CZ . PHE B 1 344 ? 7.723 2.185 68.096 1.00 81.60 ? 344 PHE B CZ 1 +ATOM 8497 N N . ARG B 1 345 ? 3.374 -2.052 72.076 1.00 76.72 ? 345 ARG B N 1 +ATOM 8498 C CA . ARG B 1 345 ? 2.913 -2.958 73.121 1.00 77.32 ? 345 ARG B CA 1 +ATOM 8499 C C . ARG B 1 345 ? 4.192 -3.460 73.777 1.00 76.52 ? 345 ARG B C 1 +ATOM 8500 O O . ARG B 1 345 ? 5.231 -3.551 73.122 1.00 76.85 ? 345 ARG B O 1 +ATOM 8501 C CB . ARG B 1 345 ? 2.135 -4.131 72.520 1.00 78.34 ? 345 ARG B CB 1 +ATOM 8502 C CG . ARG B 1 345 ? 2.965 -5.013 71.615 1.00 80.59 ? 345 ARG B CG 1 +ATOM 8503 C CD . ARG B 1 345 ? 2.105 -6.018 70.872 1.00 83.25 ? 345 ARG B CD 1 +ATOM 8504 N NE . ARG B 1 345 ? 2.915 -6.859 69.995 1.00 85.73 ? 345 ARG B NE 1 +ATOM 8505 C CZ . ARG B 1 345 ? 2.419 -7.684 69.078 1.00 87.02 ? 345 ARG B CZ 1 +ATOM 8506 N NH1 . ARG B 1 345 ? 1.106 -7.782 68.912 1.00 87.23 ? 345 ARG B NH1 1 +ATOM 8507 N NH2 . ARG B 1 345 ? 3.237 -8.407 68.323 1.00 87.22 ? 345 ARG B NH2 1 +ATOM 8508 N N . ASP B 1 346 ? 4.132 -3.776 75.064 1.00 75.21 ? 346 ASP B N 1 +ATOM 8509 C CA . ASP B 1 346 ? 5.326 -4.242 75.751 1.00 73.92 ? 346 ASP B CA 1 +ATOM 8510 C C . ASP B 1 346 ? 5.418 -5.764 75.793 1.00 71.65 ? 346 ASP B C 1 +ATOM 8511 O O . ASP B 1 346 ? 5.040 -6.390 76.786 1.00 72.09 ? 346 ASP B O 1 +ATOM 8512 C CB . ASP B 1 346 ? 5.374 -3.682 77.179 1.00 76.09 ? 346 ASP B CB 1 +ATOM 8513 C CG . ASP B 1 346 ? 6.716 -3.920 77.855 1.00 77.63 ? 346 ASP B CG 1 +ATOM 8514 O OD1 . ASP B 1 346 ? 7.144 -5.092 77.929 1.00 79.42 ? 346 ASP B OD1 1 +ATOM 8515 O OD2 . ASP B 1 346 ? 7.343 -2.938 78.315 1.00 78.24 ? 346 ASP B OD2 1 +ATOM 8516 N N . ASP B 1 347 ? 5.909 -6.358 74.709 1.00 67.87 ? 347 ASP B N 1 +ATOM 8517 C CA . ASP B 1 347 ? 6.071 -7.803 74.655 1.00 63.20 ? 347 ASP B CA 1 +ATOM 8518 C C . ASP B 1 347 ? 7.493 -8.117 75.108 1.00 59.13 ? 347 ASP B C 1 +ATOM 8519 O O . ASP B 1 347 ? 8.457 -7.917 74.371 1.00 57.48 ? 347 ASP B O 1 +ATOM 8520 C CB . ASP B 1 347 ? 5.831 -8.328 73.238 1.00 65.27 ? 347 ASP B CB 1 +ATOM 8521 C CG . ASP B 1 347 ? 6.090 -9.830 73.119 1.00 67.52 ? 347 ASP B CG 1 +ATOM 8522 O OD1 . ASP B 1 347 ? 5.800 -10.571 74.090 1.00 68.43 ? 347 ASP B OD1 1 +ATOM 8523 O OD2 . ASP B 1 347 ? 6.572 -10.271 72.053 1.00 67.60 ? 347 ASP B OD2 1 +ATOM 8524 N N . ARG B 1 348 ? 7.606 -8.609 76.335 1.00 54.32 ? 348 ARG B N 1 +ATOM 8525 C CA . ARG B 1 348 ? 8.895 -8.931 76.930 1.00 50.81 ? 348 ARG B CA 1 +ATOM 8526 C C . ARG B 1 348 ? 9.674 -10.010 76.190 1.00 47.78 ? 348 ARG B C 1 +ATOM 8527 O O . ARG B 1 348 ? 10.907 -10.013 76.200 1.00 44.47 ? 348 ARG B O 1 +ATOM 8528 C CB . ARG B 1 348 ? 8.690 -9.327 78.390 1.00 50.48 ? 348 ARG B CB 1 +ATOM 8529 C CG . ARG B 1 348 ? 8.217 -8.170 79.275 1.00 50.43 ? 348 ARG B CG 1 +ATOM 8530 C CD . ARG B 1 348 ? 9.400 -7.369 79.781 1.00 50.35 ? 348 ARG B CD 1 +ATOM 8531 N NE . ARG B 1 348 ? 9.662 -6.139 79.045 1.00 48.90 ? 348 ARG B NE 1 +ATOM 8532 C CZ . ARG B 1 348 ? 10.823 -5.484 79.078 1.00 48.79 ? 348 ARG B CZ 1 +ATOM 8533 N NH1 . ARG B 1 348 ? 11.839 -5.944 79.795 1.00 46.98 ? 348 ARG B NH1 1 +ATOM 8534 N NH2 . ARG B 1 348 ? 10.963 -4.345 78.419 1.00 49.98 ? 348 ARG B NH2 1 +ATOM 8535 N N . LEU B 1 349 ? 8.956 -10.913 75.534 1.00 45.63 ? 349 LEU B N 1 +ATOM 8536 C CA . LEU B 1 349 ? 9.605 -11.980 74.791 1.00 45.05 ? 349 LEU B CA 1 +ATOM 8537 C C . LEU B 1 349 ? 10.518 -11.449 73.693 1.00 43.27 ? 349 LEU B C 1 +ATOM 8538 O O . LEU B 1 349 ? 11.365 -12.183 73.185 1.00 43.26 ? 349 LEU B O 1 +ATOM 8539 C CB . LEU B 1 349 ? 8.566 -12.923 74.190 1.00 46.00 ? 349 LEU B CB 1 +ATOM 8540 C CG . LEU B 1 349 ? 7.794 -13.750 75.225 1.00 48.38 ? 349 LEU B CG 1 +ATOM 8541 C CD1 . LEU B 1 349 ? 6.727 -14.579 74.522 1.00 49.21 ? 349 LEU B CD1 1 +ATOM 8542 C CD2 . LEU B 1 349 ? 8.749 -14.645 75.993 1.00 47.08 ? 349 LEU B CD2 1 +ATOM 8543 N N . VAL B 1 350 ? 10.358 -10.179 73.337 1.00 40.32 ? 350 VAL B N 1 +ATOM 8544 C CA . VAL B 1 350 ? 11.192 -9.580 72.303 1.00 39.28 ? 350 VAL B CA 1 +ATOM 8545 C C . VAL B 1 350 ? 12.643 -9.412 72.776 1.00 39.41 ? 350 VAL B C 1 +ATOM 8546 O O . VAL B 1 350 ? 13.556 -9.273 71.956 1.00 39.32 ? 350 VAL B O 1 +ATOM 8547 C CB . VAL B 1 350 ? 10.651 -8.186 71.866 1.00 40.61 ? 350 VAL B CB 1 +ATOM 8548 C CG1 . VAL B 1 350 ? 10.910 -7.153 72.960 1.00 40.97 ? 350 VAL B CG1 1 +ATOM 8549 C CG2 . VAL B 1 350 ? 11.311 -7.749 70.571 1.00 39.41 ? 350 VAL B CG2 1 +ATOM 8550 N N . THR B 1 351 ? 12.857 -9.421 74.093 1.00 39.09 ? 351 THR B N 1 +ATOM 8551 C CA . THR B 1 351 ? 14.205 -9.274 74.643 1.00 37.94 ? 351 THR B CA 1 +ATOM 8552 C C . THR B 1 351 ? 14.972 -10.597 74.796 1.00 39.10 ? 351 THR B C 1 +ATOM 8553 O O . THR B 1 351 ? 16.098 -10.602 75.305 1.00 40.18 ? 351 THR B O 1 +ATOM 8554 C CB . THR B 1 351 ? 14.193 -8.576 76.027 1.00 37.47 ? 351 THR B CB 1 +ATOM 8555 O OG1 . THR B 1 351 ? 13.579 -9.430 76.995 1.00 38.34 ? 351 THR B OG1 1 +ATOM 8556 C CG2 . THR B 1 351 ? 13.432 -7.263 75.960 1.00 37.39 ? 351 THR B CG2 1 +ATOM 8557 N N . THR B 1 352 ? 14.374 -11.717 74.390 1.00 37.33 ? 352 THR B N 1 +ATOM 8558 C CA . THR B 1 352 ? 15.077 -12.995 74.482 1.00 37.43 ? 352 THR B CA 1 +ATOM 8559 C C . THR B 1 352 ? 15.932 -13.149 73.226 1.00 36.88 ? 352 THR B C 1 +ATOM 8560 O O . THR B 1 352 ? 15.818 -12.358 72.300 1.00 38.27 ? 352 THR B O 1 +ATOM 8561 C CB . THR B 1 352 ? 14.111 -14.202 74.537 1.00 37.43 ? 352 THR B CB 1 +ATOM 8562 O OG1 . THR B 1 352 ? 13.405 -14.301 73.295 1.00 38.84 ? 352 THR B OG1 1 +ATOM 8563 C CG2 . THR B 1 352 ? 13.115 -14.057 75.672 1.00 37.17 ? 352 THR B CG2 1 +ATOM 8564 N N . PHE B 1 353 ? 16.788 -14.163 73.194 1.00 37.03 ? 353 PHE B N 1 +ATOM 8565 C CA . PHE B 1 353 ? 17.626 -14.405 72.020 1.00 38.02 ? 353 PHE B CA 1 +ATOM 8566 C C . PHE B 1 353 ? 16.728 -14.780 70.842 1.00 38.49 ? 353 PHE B C 1 +ATOM 8567 O O . PHE B 1 353 ? 15.651 -15.346 71.025 1.00 38.36 ? 353 PHE B O 1 +ATOM 8568 C CB . PHE B 1 353 ? 18.604 -15.557 72.283 1.00 36.28 ? 353 PHE B CB 1 +ATOM 8569 C CG . PHE B 1 353 ? 19.903 -15.135 72.919 1.00 36.85 ? 353 PHE B CG 1 +ATOM 8570 C CD1 . PHE B 1 353 ? 20.039 -13.883 73.518 1.00 35.21 ? 353 PHE B CD1 1 +ATOM 8571 C CD2 . PHE B 1 353 ? 20.997 -16.001 72.923 1.00 35.30 ? 353 PHE B CD2 1 +ATOM 8572 C CE1 . PHE B 1 353 ? 21.249 -13.500 74.110 1.00 36.29 ? 353 PHE B CE1 1 +ATOM 8573 C CE2 . PHE B 1 353 ? 22.206 -15.626 73.511 1.00 36.15 ? 353 PHE B CE2 1 +ATOM 8574 C CZ . PHE B 1 353 ? 22.332 -14.371 74.107 1.00 35.91 ? 353 PHE B CZ 1 +ATOM 8575 N N . PRO B 1 354 ? 17.152 -14.450 69.618 1.00 39.58 ? 354 PRO B N 1 +ATOM 8576 C CA . PRO B 1 354 ? 16.355 -14.781 68.435 1.00 40.76 ? 354 PRO B CA 1 +ATOM 8577 C C . PRO B 1 354 ? 16.238 -16.302 68.304 1.00 43.31 ? 354 PRO B C 1 +ATOM 8578 O O . PRO B 1 354 ? 16.939 -17.052 68.983 1.00 43.77 ? 354 PRO B O 1 +ATOM 8579 C CB . PRO B 1 354 ? 17.162 -14.173 67.300 1.00 38.90 ? 354 PRO B CB 1 +ATOM 8580 C CG . PRO B 1 354 ? 17.829 -13.002 67.953 1.00 38.98 ? 354 PRO B CG 1 +ATOM 8581 C CD . PRO B 1 354 ? 18.277 -13.566 69.268 1.00 39.61 ? 354 PRO B CD 1 +ATOM 8582 N N . ASP B 1 355 ? 15.366 -16.764 67.421 1.00 45.65 ? 355 ASP B N 1 +ATOM 8583 C CA . ASP B 1 355 ? 15.192 -18.200 67.247 1.00 47.65 ? 355 ASP B CA 1 +ATOM 8584 C C . ASP B 1 355 ? 16.279 -18.929 66.471 1.00 44.67 ? 355 ASP B C 1 +ATOM 8585 O O . ASP B 1 355 ? 16.422 -20.138 66.607 1.00 45.03 ? 355 ASP B O 1 +ATOM 8586 C CB . ASP B 1 355 ? 13.839 -18.482 66.603 1.00 52.77 ? 355 ASP B CB 1 +ATOM 8587 C CG . ASP B 1 355 ? 12.696 -18.342 67.589 1.00 58.94 ? 355 ASP B CG 1 +ATOM 8588 O OD1 . ASP B 1 355 ? 12.658 -19.132 68.566 1.00 60.40 ? 355 ASP B OD1 1 +ATOM 8589 O OD2 . ASP B 1 355 ? 11.844 -17.442 67.395 1.00 62.43 ? 355 ASP B OD2 1 +ATOM 8590 N N . ASN B 1 356 ? 17.055 -18.209 65.673 1.00 40.93 ? 356 ASN B N 1 +ATOM 8591 C CA . ASN B 1 356 ? 18.097 -18.852 64.883 1.00 38.90 ? 356 ASN B CA 1 +ATOM 8592 C C . ASN B 1 356 ? 19.440 -19.028 65.603 1.00 36.71 ? 356 ASN B C 1 +ATOM 8593 O O . ASN B 1 356 ? 20.430 -19.422 64.990 1.00 34.76 ? 356 ASN B O 1 +ATOM 8594 C CB . ASN B 1 356 ? 18.297 -18.077 63.578 1.00 39.55 ? 356 ASN B CB 1 +ATOM 8595 C CG . ASN B 1 356 ? 18.756 -16.658 63.818 1.00 43.53 ? 356 ASN B CG 1 +ATOM 8596 O OD1 . ASN B 1 356 ? 18.436 -16.059 64.848 1.00 46.63 ? 356 ASN B OD1 1 +ATOM 8597 N ND2 . ASN B 1 356 ? 19.501 -16.101 62.869 1.00 43.21 ? 356 ASN B ND2 1 +ATOM 8598 N N . VAL B 1 357 ? 19.475 -18.750 66.902 1.00 36.53 ? 357 VAL B N 1 +ATOM 8599 C CA . VAL B 1 357 ? 20.713 -18.887 67.678 1.00 35.40 ? 357 VAL B CA 1 +ATOM 8600 C C . VAL B 1 357 ? 20.944 -20.333 68.087 1.00 35.11 ? 357 VAL B C 1 +ATOM 8601 O O . VAL B 1 357 ? 20.018 -21.017 68.506 1.00 36.83 ? 357 VAL B O 1 +ATOM 8602 C CB . VAL B 1 357 ? 20.687 -18.012 68.954 1.00 34.10 ? 357 VAL B CB 1 +ATOM 8603 C CG1 . VAL B 1 357 ? 21.871 -18.343 69.832 1.00 32.43 ? 357 VAL B CG1 1 +ATOM 8604 C CG2 . VAL B 1 357 ? 20.720 -16.532 68.574 1.00 34.83 ? 357 VAL B CG2 1 +ATOM 8605 N N . VAL B 1 358 ? 22.184 -20.792 67.968 1.00 35.02 ? 358 VAL B N 1 +ATOM 8606 C CA . VAL B 1 358 ? 22.526 -22.163 68.320 1.00 36.12 ? 358 VAL B CA 1 +ATOM 8607 C C . VAL B 1 358 ? 23.695 -22.262 69.305 1.00 36.77 ? 358 VAL B C 1 +ATOM 8608 O O . VAL B 1 358 ? 24.517 -21.351 69.414 1.00 36.64 ? 358 VAL B O 1 +ATOM 8609 C CB . VAL B 1 358 ? 22.891 -22.993 67.057 1.00 36.65 ? 358 VAL B CB 1 +ATOM 8610 C CG1 . VAL B 1 358 ? 21.711 -23.027 66.092 1.00 34.28 ? 358 VAL B CG1 1 +ATOM 8611 C CG2 . VAL B 1 358 ? 24.123 -22.400 66.380 1.00 34.78 ? 358 VAL B CG2 1 +ATOM 8612 N N . HIS B 1 359 ? 23.757 -23.384 70.014 1.00 37.08 ? 359 HIS B N 1 +ATOM 8613 C CA . HIS B 1 359 ? 24.814 -23.636 70.991 1.00 38.54 ? 359 HIS B CA 1 +ATOM 8614 C C . HIS B 1 359 ? 25.356 -25.044 70.765 1.00 39.01 ? 359 HIS B C 1 +ATOM 8615 O O . HIS B 1 359 ? 24.759 -25.842 70.035 1.00 39.08 ? 359 HIS B O 1 +ATOM 8616 C CB . HIS B 1 359 ? 24.263 -23.568 72.424 1.00 37.42 ? 359 HIS B CB 1 +ATOM 8617 C CG . HIS B 1 359 ? 23.607 -22.270 72.773 1.00 38.33 ? 359 HIS B CG 1 +ATOM 8618 N ND1 . HIS B 1 359 ? 24.323 -21.132 73.074 1.00 39.70 ? 359 HIS B ND1 1 +ATOM 8619 C CD2 . HIS B 1 359 ? 22.300 -21.932 72.880 1.00 38.18 ? 359 HIS B CD2 1 +ATOM 8620 C CE1 . HIS B 1 359 ? 23.485 -20.149 73.353 1.00 39.14 ? 359 HIS B CE1 1 +ATOM 8621 N NE2 . HIS B 1 359 ? 22.251 -20.608 73.242 1.00 38.50 ? 359 HIS B NE2 1 +ATOM 8622 N N . TYR B 1 360 ? 26.487 -25.342 71.394 1.00 39.65 ? 360 TYR B N 1 +ATOM 8623 C CA . TYR B 1 360 ? 27.074 -26.673 71.314 1.00 40.78 ? 360 TYR B CA 1 +ATOM 8624 C C . TYR B 1 360 ? 27.045 -27.244 72.718 1.00 41.36 ? 360 TYR B C 1 +ATOM 8625 O O . TYR B 1 360 ? 27.825 -26.844 73.585 1.00 42.67 ? 360 TYR B O 1 +ATOM 8626 C CB . TYR B 1 360 ? 28.514 -26.633 70.792 1.00 42.07 ? 360 TYR B CB 1 +ATOM 8627 C CG . TYR B 1 360 ? 28.588 -26.323 69.315 1.00 46.00 ? 360 TYR B CG 1 +ATOM 8628 C CD1 . TYR B 1 360 ? 28.618 -25.004 68.858 1.00 48.43 ? 360 TYR B CD1 1 +ATOM 8629 C CD2 . TYR B 1 360 ? 28.557 -27.347 68.368 1.00 47.14 ? 360 TYR B CD2 1 +ATOM 8630 C CE1 . TYR B 1 360 ? 28.608 -24.712 67.495 1.00 50.16 ? 360 TYR B CE1 1 +ATOM 8631 C CE2 . TYR B 1 360 ? 28.547 -27.068 67.008 1.00 49.08 ? 360 TYR B CE2 1 +ATOM 8632 C CZ . TYR B 1 360 ? 28.571 -25.749 66.576 1.00 51.18 ? 360 TYR B CZ 1 +ATOM 8633 O OH . TYR B 1 360 ? 28.546 -25.456 65.224 1.00 53.34 ? 360 TYR B OH 1 +ATOM 8634 N N . LEU B 1 361 ? 26.117 -28.164 72.946 1.00 40.66 ? 361 LEU B N 1 +ATOM 8635 C CA . LEU B 1 361 ? 25.969 -28.794 74.246 1.00 39.19 ? 361 LEU B CA 1 +ATOM 8636 C C . LEU B 1 361 ? 26.510 -30.208 74.152 1.00 39.42 ? 361 LEU B C 1 +ATOM 8637 O O . LEU B 1 361 ? 26.028 -31.015 73.357 1.00 39.25 ? 361 LEU B O 1 +ATOM 8638 C CB . LEU B 1 361 ? 24.494 -28.820 74.649 1.00 37.40 ? 361 LEU B CB 1 +ATOM 8639 C CG . LEU B 1 361 ? 24.157 -29.499 75.976 1.00 37.82 ? 361 LEU B CG 1 +ATOM 8640 C CD1 . LEU B 1 361 ? 24.885 -28.805 77.114 1.00 35.65 ? 361 LEU B CD1 1 +ATOM 8641 C CD2 . LEU B 1 361 ? 22.658 -29.466 76.195 1.00 36.18 ? 361 LEU B CD2 1 +ATOM 8642 N N . ARG B 1 362 ? 27.515 -30.506 74.967 1.00 39.76 ? 362 ARG B N 1 +ATOM 8643 C CA . ARG B 1 362 ? 28.131 -31.830 74.964 1.00 39.92 ? 362 ARG B CA 1 +ATOM 8644 C C . ARG B 1 362 ? 28.446 -32.270 73.541 1.00 40.45 ? 362 ARG B C 1 +ATOM 8645 O O . ARG B 1 362 ? 28.144 -33.394 73.136 1.00 39.79 ? 362 ARG B O 1 +ATOM 8646 C CB . ARG B 1 362 ? 27.217 -32.854 75.658 1.00 38.43 ? 362 ARG B CB 1 +ATOM 8647 C CG . ARG B 1 362 ? 26.994 -32.549 77.146 1.00 38.16 ? 362 ARG B CG 1 +ATOM 8648 C CD . ARG B 1 362 ? 26.337 -33.700 77.896 1.00 35.82 ? 362 ARG B CD 1 +ATOM 8649 N NE . ARG B 1 362 ? 25.013 -34.040 77.375 1.00 39.39 ? 362 ARG B NE 1 +ATOM 8650 C CZ . ARG B 1 362 ? 23.901 -33.343 77.599 1.00 37.99 ? 362 ARG B CZ 1 +ATOM 8651 N NH1 . ARG B 1 362 ? 23.933 -32.248 78.346 1.00 37.84 ? 362 ARG B NH1 1 +ATOM 8652 N NH2 . ARG B 1 362 ? 22.751 -33.752 77.080 1.00 36.78 ? 362 ARG B NH2 1 +ATOM 8653 N N . GLY B 1 363 ? 29.044 -31.354 72.785 1.00 42.36 ? 363 GLY B N 1 +ATOM 8654 C CA . GLY B 1 363 ? 29.433 -31.636 71.415 1.00 43.89 ? 363 GLY B CA 1 +ATOM 8655 C C . GLY B 1 363 ? 28.347 -31.589 70.359 1.00 45.17 ? 363 GLY B C 1 +ATOM 8656 O O . GLY B 1 363 ? 28.642 -31.630 69.168 1.00 46.19 ? 363 GLY B O 1 +ATOM 8657 N N . LYS B 1 364 ? 27.093 -31.503 70.780 1.00 46.20 ? 364 LYS B N 1 +ATOM 8658 C CA . LYS B 1 364 ? 25.980 -31.471 69.840 1.00 45.99 ? 364 LYS B CA 1 +ATOM 8659 C C . LYS B 1 364 ? 25.454 -30.053 69.626 1.00 45.33 ? 364 LYS B C 1 +ATOM 8660 O O . LYS B 1 364 ? 25.369 -29.258 70.565 1.00 44.61 ? 364 LYS B O 1 +ATOM 8661 C CB . LYS B 1 364 ? 24.858 -32.382 70.347 1.00 47.12 ? 364 LYS B CB 1 +ATOM 8662 C CG . LYS B 1 364 ? 23.650 -32.462 69.438 1.00 50.26 ? 364 LYS B CG 1 +ATOM 8663 C CD . LYS B 1 364 ? 22.588 -33.379 70.030 1.00 52.22 ? 364 LYS B CD 1 +ATOM 8664 C CE . LYS B 1 364 ? 21.413 -33.557 69.083 1.00 53.08 ? 364 LYS B CE 1 +ATOM 8665 N NZ . LYS B 1 364 ? 20.413 -34.511 69.649 1.00 56.07 ? 364 LYS B NZ 1 +ATOM 8666 N N . ARG B 1 365 ? 25.100 -29.755 68.382 1.00 45.19 ? 365 ARG B N 1 +ATOM 8667 C CA . ARG B 1 365 ? 24.579 -28.448 67.999 1.00 45.68 ? 365 ARG B CA 1 +ATOM 8668 C C . ARG B 1 365 ? 23.083 -28.428 68.290 1.00 45.28 ? 365 ARG B C 1 +ATOM 8669 O O . ARG B 1 365 ? 22.342 -29.247 67.753 1.00 46.25 ? 365 ARG B O 1 +ATOM 8670 C CB . ARG B 1 365 ? 24.845 -28.239 66.514 1.00 46.49 ? 365 ARG B CB 1 +ATOM 8671 C CG . ARG B 1 365 ? 24.687 -26.830 65.997 1.00 49.41 ? 365 ARG B CG 1 +ATOM 8672 C CD . ARG B 1 365 ? 25.562 -26.678 64.755 1.00 53.11 ? 365 ARG B CD 1 +ATOM 8673 N NE . ARG B 1 365 ? 25.178 -25.547 63.923 1.00 55.88 ? 365 ARG B NE 1 +ATOM 8674 C CZ . ARG B 1 365 ? 24.027 -25.467 63.265 1.00 57.91 ? 365 ARG B CZ 1 +ATOM 8675 N NH1 . ARG B 1 365 ? 23.143 -26.459 63.345 1.00 58.40 ? 365 ARG B NH1 1 +ATOM 8676 N NH2 . ARG B 1 365 ? 23.759 -24.398 62.527 1.00 57.39 ? 365 ARG B NH2 1 +ATOM 8677 N N . VAL B 1 366 ? 22.647 -27.504 69.148 1.00 43.56 ? 366 VAL B N 1 +ATOM 8678 C CA . VAL B 1 366 ? 21.232 -27.399 69.515 1.00 42.09 ? 366 VAL B CA 1 +ATOM 8679 C C . VAL B 1 366 ? 20.676 -25.982 69.394 1.00 40.86 ? 366 VAL B C 1 +ATOM 8680 O O . VAL B 1 366 ? 21.411 -25.005 69.491 1.00 42.27 ? 366 VAL B O 1 +ATOM 8681 C CB . VAL B 1 366 ? 20.993 -27.872 70.971 1.00 42.73 ? 366 VAL B CB 1 +ATOM 8682 C CG1 . VAL B 1 366 ? 21.396 -29.327 71.116 1.00 42.91 ? 366 VAL B CG1 1 +ATOM 8683 C CG2 . VAL B 1 366 ? 21.791 -26.999 71.947 1.00 41.60 ? 366 VAL B CG2 1 +ATOM 8684 N N . LYS B 1 367 ? 19.369 -25.880 69.190 1.00 39.71 ? 367 LYS B N 1 +ATOM 8685 C CA . LYS B 1 367 ? 18.717 -24.583 69.074 1.00 38.07 ? 367 LYS B CA 1 +ATOM 8686 C C . LYS B 1 367 ? 18.605 -23.930 70.441 1.00 36.64 ? 367 LYS B C 1 +ATOM 8687 O O . LYS B 1 367 ? 18.364 -24.607 71.446 1.00 35.42 ? 367 LYS B O 1 +ATOM 8688 C CB . LYS B 1 367 ? 17.317 -24.734 68.480 1.00 39.06 ? 367 LYS B CB 1 +ATOM 8689 C CG . LYS B 1 367 ? 17.294 -25.091 67.014 1.00 43.85 ? 367 LYS B CG 1 +ATOM 8690 C CD . LYS B 1 367 ? 15.862 -25.120 66.501 1.00 48.50 ? 367 LYS B CD 1 +ATOM 8691 C CE . LYS B 1 367 ? 15.806 -25.402 65.008 1.00 51.93 ? 367 LYS B CE 1 +ATOM 8692 N NZ . LYS B 1 367 ? 14.403 -25.321 64.492 1.00 55.33 ? 367 LYS B NZ 1 +ATOM 8693 N N . HIS B 1 368 ? 18.763 -22.610 70.471 1.00 35.27 ? 368 HIS B N 1 +ATOM 8694 C CA . HIS B 1 368 ? 18.675 -21.859 71.711 1.00 34.58 ? 368 HIS B CA 1 +ATOM 8695 C C . HIS B 1 368 ? 17.353 -22.087 72.446 1.00 35.59 ? 368 HIS B C 1 +ATOM 8696 O O . HIS B 1 368 ? 17.319 -22.166 73.673 1.00 35.95 ? 368 HIS B O 1 +ATOM 8697 C CB . HIS B 1 368 ? 18.836 -20.371 71.435 1.00 34.27 ? 368 HIS B CB 1 +ATOM 8698 C CG . HIS B 1 368 ? 18.711 -19.525 72.662 1.00 36.15 ? 368 HIS B CG 1 +ATOM 8699 N ND1 . HIS B 1 368 ? 19.703 -19.447 73.617 1.00 34.44 ? 368 HIS B ND1 1 +ATOM 8700 C CD2 . HIS B 1 368 ? 17.681 -18.777 73.125 1.00 36.10 ? 368 HIS B CD2 1 +ATOM 8701 C CE1 . HIS B 1 368 ? 19.287 -18.689 74.617 1.00 37.11 ? 368 HIS B CE1 1 +ATOM 8702 N NE2 . HIS B 1 368 ? 18.063 -18.270 74.343 1.00 37.49 ? 368 HIS B NE2 1 +ATOM 8703 N N . GLU B 1 369 ? 16.263 -22.201 71.701 1.00 36.59 ? 369 GLU B N 1 +ATOM 8704 C CA . GLU B 1 369 ? 14.955 -22.395 72.316 1.00 38.66 ? 369 GLU B CA 1 +ATOM 8705 C C . GLU B 1 369 ? 14.796 -23.723 73.031 1.00 37.13 ? 369 GLU B C 1 +ATOM 8706 O O . GLU B 1 369 ? 13.887 -23.885 73.835 1.00 36.48 ? 369 GLU B O 1 +ATOM 8707 C CB . GLU B 1 369 ? 13.848 -22.250 71.271 1.00 41.94 ? 369 GLU B CB 1 +ATOM 8708 C CG . GLU B 1 369 ? 13.922 -23.251 70.141 1.00 49.54 ? 369 GLU B CG 1 +ATOM 8709 C CD . GLU B 1 369 ? 12.903 -22.960 69.048 1.00 54.51 ? 369 GLU B CD 1 +ATOM 8710 O OE1 . GLU B 1 369 ? 11.701 -23.270 69.234 1.00 56.14 ? 369 GLU B OE1 1 +ATOM 8711 O OE2 . GLU B 1 369 ? 13.307 -22.403 68.003 1.00 56.75 ? 369 GLU B OE2 1 +ATOM 8712 N N . LYS B 1 370 ? 15.666 -24.681 72.735 1.00 37.30 ? 370 LYS B N 1 +ATOM 8713 C CA . LYS B 1 370 ? 15.590 -25.978 73.388 1.00 37.25 ? 370 LYS B CA 1 +ATOM 8714 C C . LYS B 1 370 ? 16.310 -25.964 74.731 1.00 36.32 ? 370 LYS B C 1 +ATOM 8715 O O . LYS B 1 370 ? 15.932 -26.685 75.647 1.00 37.10 ? 370 LYS B O 1 +ATOM 8716 C CB . LYS B 1 370 ? 16.229 -27.057 72.514 1.00 42.17 ? 370 LYS B CB 1 +ATOM 8717 C CG . LYS B 1 370 ? 15.515 -27.324 71.186 1.00 48.13 ? 370 LYS B CG 1 +ATOM 8718 C CD . LYS B 1 370 ? 14.119 -27.906 71.399 1.00 52.40 ? 370 LYS B CD 1 +ATOM 8719 C CE . LYS B 1 370 ? 13.460 -28.254 70.069 1.00 55.52 ? 370 LYS B CE 1 +ATOM 8720 N NZ . LYS B 1 370 ? 13.352 -27.053 69.178 1.00 58.99 ? 370 LYS B NZ 1 +ATOM 8721 N N . VAL B 1 371 ? 17.335 -25.127 74.857 1.00 35.07 ? 371 VAL B N 1 +ATOM 8722 C CA . VAL B 1 371 ? 18.128 -25.084 76.084 1.00 34.73 ? 371 VAL B CA 1 +ATOM 8723 C C . VAL B 1 371 ? 18.263 -23.716 76.756 1.00 34.99 ? 371 VAL B C 1 +ATOM 8724 O O . VAL B 1 371 ? 19.040 -23.564 77.712 1.00 35.24 ? 371 VAL B O 1 +ATOM 8725 C CB . VAL B 1 371 ? 19.555 -25.605 75.797 1.00 33.87 ? 371 VAL B CB 1 +ATOM 8726 C CG1 . VAL B 1 371 ? 19.486 -26.989 75.189 1.00 30.90 ? 371 VAL B CG1 1 +ATOM 8727 C CG2 . VAL B 1 371 ? 20.284 -24.646 74.850 1.00 31.46 ? 371 VAL B CG2 1 +ATOM 8728 N N . ARG B 1 372 ? 17.509 -22.735 76.267 1.00 33.89 ? 372 ARG B N 1 +ATOM 8729 C CA . ARG B 1 372 ? 17.580 -21.371 76.791 1.00 32.13 ? 372 ARG B CA 1 +ATOM 8730 C C . ARG B 1 372 ? 17.718 -21.187 78.300 1.00 31.10 ? 372 ARG B C 1 +ATOM 8731 O O . ARG B 1 372 ? 18.665 -20.553 78.777 1.00 29.68 ? 372 ARG B O 1 +ATOM 8732 C CB . ARG B 1 372 ? 16.372 -20.551 76.320 1.00 32.32 ? 372 ARG B CB 1 +ATOM 8733 C CG . ARG B 1 372 ? 16.335 -19.144 76.918 1.00 31.90 ? 372 ARG B CG 1 +ATOM 8734 C CD . ARG B 1 372 ? 15.224 -18.268 76.342 1.00 31.48 ? 372 ARG B CD 1 +ATOM 8735 N NE . ARG B 1 372 ? 15.176 -16.981 77.034 1.00 29.64 ? 372 ARG B NE 1 +ATOM 8736 C CZ . ARG B 1 372 ? 16.026 -15.978 76.833 1.00 29.00 ? 372 ARG B CZ 1 +ATOM 8737 N NH1 . ARG B 1 372 ? 17.003 -16.090 75.940 1.00 28.94 ? 372 ARG B NH1 1 +ATOM 8738 N NH2 . ARG B 1 372 ? 15.924 -14.872 77.562 1.00 26.85 ? 372 ARG B NH2 1 +ATOM 8739 N N . ASN B 1 373 ? 16.780 -21.733 79.054 1.00 29.99 ? 373 ASN B N 1 +ATOM 8740 C CA . ASN B 1 373 ? 16.796 -21.528 80.490 1.00 32.31 ? 373 ASN B CA 1 +ATOM 8741 C C . ASN B 1 373 ? 18.032 -21.983 81.245 1.00 33.25 ? 373 ASN B C 1 +ATOM 8742 O O . ASN B 1 373 ? 18.285 -21.502 82.346 1.00 34.04 ? 373 ASN B O 1 +ATOM 8743 C CB . ASN B 1 373 ? 15.539 -22.142 81.108 1.00 32.22 ? 373 ASN B CB 1 +ATOM 8744 C CG . ASN B 1 373 ? 14.272 -21.579 80.492 1.00 33.59 ? 373 ASN B CG 1 +ATOM 8745 O OD1 . ASN B 1 373 ? 14.248 -20.419 80.077 1.00 35.84 ? 373 ASN B OD1 1 +ATOM 8746 N ND2 . ASN B 1 373 ? 13.214 -22.382 80.439 1.00 31.35 ? 373 ASN B ND2 1 +ATOM 8747 N N . ALA B 1 374 ? 18.809 -22.892 80.667 1.00 33.32 ? 374 ALA B N 1 +ATOM 8748 C CA . ALA B 1 374 ? 20.002 -23.374 81.350 1.00 34.05 ? 374 ALA B CA 1 +ATOM 8749 C C . ALA B 1 374 ? 21.210 -22.469 81.126 1.00 34.04 ? 374 ALA B C 1 +ATOM 8750 O O . ALA B 1 374 ? 22.256 -22.660 81.744 1.00 36.64 ? 374 ALA B O 1 +ATOM 8751 C CB . ALA B 1 374 ? 20.320 -24.807 80.904 1.00 34.40 ? 374 ALA B CB 1 +ATOM 8752 N N . TYR B 1 375 ? 21.069 -21.480 80.254 1.00 33.44 ? 375 TYR B N 1 +ATOM 8753 C CA . TYR B 1 375 ? 22.172 -20.567 79.959 1.00 32.79 ? 375 TYR B CA 1 +ATOM 8754 C C . TYR B 1 375 ? 22.757 -19.939 81.227 1.00 34.45 ? 375 TYR B C 1 +ATOM 8755 O O . TYR B 1 375 ? 23.971 -19.982 81.450 1.00 34.84 ? 375 TYR B O 1 +ATOM 8756 C CB . TYR B 1 375 ? 21.709 -19.460 79.009 1.00 30.97 ? 375 TYR B CB 1 +ATOM 8757 C CG . TYR B 1 375 ? 22.820 -18.565 78.499 1.00 31.18 ? 375 TYR B CG 1 +ATOM 8758 C CD1 . TYR B 1 375 ? 23.550 -18.900 77.358 1.00 32.47 ? 375 TYR B CD1 1 +ATOM 8759 C CD2 . TYR B 1 375 ? 23.133 -17.377 79.153 1.00 31.79 ? 375 TYR B CD2 1 +ATOM 8760 C CE1 . TYR B 1 375 ? 24.569 -18.064 76.877 1.00 34.26 ? 375 TYR B CE1 1 +ATOM 8761 C CE2 . TYR B 1 375 ? 24.141 -16.536 78.689 1.00 33.59 ? 375 TYR B CE2 1 +ATOM 8762 C CZ . TYR B 1 375 ? 24.854 -16.880 77.552 1.00 34.89 ? 375 TYR B CZ 1 +ATOM 8763 O OH . TYR B 1 375 ? 25.833 -16.027 77.088 1.00 35.48 ? 375 TYR B OH 1 +ATOM 8764 N N . PRO B 1 376 ? 21.908 -19.337 82.075 1.00 34.60 ? 376 PRO B N 1 +ATOM 8765 C CA . PRO B 1 376 ? 22.459 -18.730 83.293 1.00 34.96 ? 376 PRO B CA 1 +ATOM 8766 C C . PRO B 1 376 ? 23.126 -19.756 84.212 1.00 34.85 ? 376 PRO B C 1 +ATOM 8767 O O . PRO B 1 376 ? 24.072 -19.430 84.929 1.00 34.67 ? 376 PRO B O 1 +ATOM 8768 C CB . PRO B 1 376 ? 21.235 -18.071 83.932 1.00 33.63 ? 376 PRO B CB 1 +ATOM 8769 C CG . PRO B 1 376 ? 20.109 -18.964 83.484 1.00 32.16 ? 376 PRO B CG 1 +ATOM 8770 C CD . PRO B 1 376 ? 20.444 -19.189 82.033 1.00 33.24 ? 376 PRO B CD 1 +ATOM 8771 N N . LEU B 1 377 ? 22.633 -20.992 84.188 1.00 34.28 ? 377 LEU B N 1 +ATOM 8772 C CA . LEU B 1 377 ? 23.208 -22.043 85.026 1.00 34.51 ? 377 LEU B CA 1 +ATOM 8773 C C . LEU B 1 377 ? 24.666 -22.290 84.638 1.00 34.46 ? 377 LEU B C 1 +ATOM 8774 O O . LEU B 1 377 ? 25.534 -22.371 85.500 1.00 35.30 ? 377 LEU B O 1 +ATOM 8775 C CB . LEU B 1 377 ? 22.421 -23.350 84.885 1.00 33.86 ? 377 LEU B CB 1 +ATOM 8776 C CG . LEU B 1 377 ? 23.043 -24.587 85.553 1.00 34.77 ? 377 LEU B CG 1 +ATOM 8777 C CD1 . LEU B 1 377 ? 23.033 -24.418 87.062 1.00 36.48 ? 377 LEU B CD1 1 +ATOM 8778 C CD2 . LEU B 1 377 ? 22.263 -25.845 85.170 1.00 33.96 ? 377 LEU B CD2 1 +ATOM 8779 N N . TYR B 1 378 ? 24.932 -22.401 83.341 1.00 33.75 ? 378 TYR B N 1 +ATOM 8780 C CA . TYR B 1 378 ? 26.289 -22.641 82.872 1.00 33.39 ? 378 TYR B CA 1 +ATOM 8781 C C . TYR B 1 378 ? 27.200 -21.436 83.062 1.00 34.61 ? 378 TYR B C 1 +ATOM 8782 O O . TYR B 1 378 ? 28.408 -21.596 83.243 1.00 34.56 ? 378 TYR B O 1 +ATOM 8783 C CB . TYR B 1 378 ? 26.269 -23.086 81.412 1.00 32.98 ? 378 TYR B CB 1 +ATOM 8784 C CG . TYR B 1 378 ? 25.864 -24.538 81.255 1.00 34.65 ? 378 TYR B CG 1 +ATOM 8785 C CD1 . TYR B 1 378 ? 26.751 -25.567 81.567 1.00 35.26 ? 378 TYR B CD1 1 +ATOM 8786 C CD2 . TYR B 1 378 ? 24.583 -24.886 80.842 1.00 35.74 ? 378 TYR B CD2 1 +ATOM 8787 C CE1 . TYR B 1 378 ? 26.369 -26.907 81.477 1.00 34.63 ? 378 TYR B CE1 1 +ATOM 8788 C CE2 . TYR B 1 378 ? 24.190 -26.224 80.748 1.00 36.44 ? 378 TYR B CE2 1 +ATOM 8789 C CZ . TYR B 1 378 ? 25.088 -27.228 81.071 1.00 36.65 ? 378 TYR B CZ 1 +ATOM 8790 O OH . TYR B 1 378 ? 24.681 -28.546 81.009 1.00 36.66 ? 378 TYR B OH 1 +ATOM 8791 N N . GLU B 1 379 ? 26.632 -20.231 83.028 1.00 35.17 ? 379 GLU B N 1 +ATOM 8792 C CA . GLU B 1 379 ? 27.437 -19.040 83.239 1.00 35.02 ? 379 GLU B CA 1 +ATOM 8793 C C . GLU B 1 379 ? 27.855 -19.021 84.712 1.00 34.30 ? 379 GLU B C 1 +ATOM 8794 O O . GLU B 1 379 ? 29.004 -18.738 85.036 1.00 34.57 ? 379 GLU B O 1 +ATOM 8795 C CB . GLU B 1 379 ? 26.652 -17.767 82.916 1.00 35.43 ? 379 GLU B CB 1 +ATOM 8796 C CG . GLU B 1 379 ? 27.446 -16.489 83.212 1.00 39.19 ? 379 GLU B CG 1 +ATOM 8797 C CD . GLU B 1 379 ? 26.597 -15.221 83.191 1.00 43.42 ? 379 GLU B CD 1 +ATOM 8798 O OE1 . GLU B 1 379 ? 25.436 -15.269 83.660 1.00 45.36 ? 379 GLU B OE1 1 +ATOM 8799 O OE2 . GLU B 1 379 ? 27.098 -14.166 82.727 1.00 45.23 ? 379 GLU B OE2 1 +ATOM 8800 N N . ALA B 1 380 ? 26.918 -19.332 85.600 1.00 33.12 ? 380 ALA B N 1 +ATOM 8801 C CA . ALA B 1 380 ? 27.206 -19.345 87.029 1.00 33.54 ? 380 ALA B CA 1 +ATOM 8802 C C . ALA B 1 380 ? 28.243 -20.429 87.328 1.00 34.71 ? 380 ALA B C 1 +ATOM 8803 O O . ALA B 1 380 ? 29.143 -20.243 88.148 1.00 34.52 ? 380 ALA B O 1 +ATOM 8804 C CB . ALA B 1 380 ? 25.924 -19.600 87.824 1.00 30.74 ? 380 ALA B CB 1 +ATOM 8805 N N . MET B 1 381 ? 28.104 -21.560 86.649 1.00 35.49 ? 381 MET B N 1 +ATOM 8806 C CA . MET B 1 381 ? 29.019 -22.683 86.805 1.00 36.70 ? 381 MET B CA 1 +ATOM 8807 C C . MET B 1 381 ? 30.451 -22.246 86.491 1.00 37.49 ? 381 MET B C 1 +ATOM 8808 O O . MET B 1 381 ? 31.380 -22.521 87.260 1.00 38.68 ? 381 MET B O 1 +ATOM 8809 C CB . MET B 1 381 ? 28.608 -23.806 85.854 1.00 37.41 ? 381 MET B CB 1 +ATOM 8810 C CG . MET B 1 381 ? 29.446 -25.068 85.947 1.00 38.39 ? 381 MET B CG 1 +ATOM 8811 S SD . MET B 1 381 ? 28.929 -26.304 84.723 1.00 41.36 ? 381 MET B SD 1 +ATOM 8812 C CE . MET B 1 381 ? 27.279 -26.767 85.333 1.00 38.39 ? 381 MET B CE 1 +ATOM 8813 N N . ALA B 1 382 ? 30.620 -21.565 85.357 1.00 36.78 ? 382 ALA B N 1 +ATOM 8814 C CA . ALA B 1 382 ? 31.936 -21.092 84.930 1.00 35.99 ? 382 ALA B CA 1 +ATOM 8815 C C . ALA B 1 382 ? 32.470 -20.025 85.873 1.00 36.29 ? 382 ALA B C 1 +ATOM 8816 O O . ALA B 1 382 ? 33.675 -19.915 86.084 1.00 37.27 ? 382 ALA B O 1 +ATOM 8817 C CB . ALA B 1 382 ? 31.862 -20.531 83.522 1.00 34.81 ? 382 ALA B CB 1 +ATOM 8818 N N . THR B 1 383 ? 31.568 -19.235 86.439 1.00 36.23 ? 383 THR B N 1 +ATOM 8819 C CA . THR B 1 383 ? 31.968 -18.163 87.331 1.00 35.74 ? 383 THR B CA 1 +ATOM 8820 C C . THR B 1 383 ? 32.410 -18.769 88.653 1.00 36.01 ? 383 THR B C 1 +ATOM 8821 O O . THR B 1 383 ? 33.363 -18.302 89.272 1.00 35.76 ? 383 THR B O 1 +ATOM 8822 C CB . THR B 1 383 ? 30.801 -17.160 87.538 1.00 34.67 ? 383 THR B CB 1 +ATOM 8823 O OG1 . THR B 1 383 ? 30.408 -16.631 86.261 1.00 35.99 ? 383 THR B OG1 1 +ATOM 8824 C CG2 . THR B 1 383 ? 31.226 -16.004 88.433 1.00 33.38 ? 383 THR B CG2 1 +ATOM 8825 N N . PHE B 1 384 ? 31.723 -19.822 89.072 1.00 36.57 ? 384 PHE B N 1 +ATOM 8826 C CA . PHE B 1 384 ? 32.056 -20.504 90.311 1.00 39.30 ? 384 PHE B CA 1 +ATOM 8827 C C . PHE B 1 384 ? 33.451 -21.114 90.128 1.00 41.67 ? 384 PHE B C 1 +ATOM 8828 O O . PHE B 1 384 ? 34.302 -21.063 91.024 1.00 41.50 ? 384 PHE B O 1 +ATOM 8829 C CB . PHE B 1 384 ? 31.045 -21.614 90.577 1.00 38.42 ? 384 PHE B CB 1 +ATOM 8830 C CG . PHE B 1 384 ? 31.132 -22.203 91.956 1.00 39.16 ? 384 PHE B CG 1 +ATOM 8831 C CD1 . PHE B 1 384 ? 30.468 -21.607 93.027 1.00 38.78 ? 384 PHE B CD1 1 +ATOM 8832 C CD2 . PHE B 1 384 ? 31.855 -23.372 92.184 1.00 38.72 ? 384 PHE B CD2 1 +ATOM 8833 C CE1 . PHE B 1 384 ? 30.520 -22.176 94.313 1.00 39.74 ? 384 PHE B CE1 1 +ATOM 8834 C CE2 . PHE B 1 384 ? 31.913 -23.946 93.461 1.00 38.74 ? 384 PHE B CE2 1 +ATOM 8835 C CZ . PHE B 1 384 ? 31.243 -23.349 94.528 1.00 37.90 ? 384 PHE B CZ 1 +ATOM 8836 N N . LYS B 1 385 ? 33.667 -21.691 88.951 1.00 42.31 ? 385 LYS B N 1 +ATOM 8837 C CA . LYS B 1 385 ? 34.938 -22.304 88.610 1.00 43.33 ? 385 LYS B CA 1 +ATOM 8838 C C . LYS B 1 385 ? 36.026 -21.229 88.664 1.00 42.86 ? 385 LYS B C 1 +ATOM 8839 O O . LYS B 1 385 ? 37.185 -21.514 88.956 1.00 42.84 ? 385 LYS B O 1 +ATOM 8840 C CB . LYS B 1 385 ? 34.841 -22.914 87.207 1.00 45.07 ? 385 LYS B CB 1 +ATOM 8841 C CG . LYS B 1 385 ? 36.123 -23.529 86.681 1.00 48.41 ? 385 LYS B CG 1 +ATOM 8842 C CD . LYS B 1 385 ? 35.929 -23.996 85.235 1.00 51.76 ? 385 LYS B CD 1 +ATOM 8843 C CE . LYS B 1 385 ? 37.226 -24.524 84.625 1.00 51.85 ? 385 LYS B CE 1 +ATOM 8844 N NZ . LYS B 1 385 ? 37.737 -25.718 85.361 1.00 53.45 ? 385 LYS B NZ 1 +ATOM 8845 N N . GLY B 1 386 ? 35.643 -19.990 88.380 1.00 42.13 ? 386 GLY B N 1 +ATOM 8846 C CA . GLY B 1 386 ? 36.602 -18.904 88.423 1.00 41.82 ? 386 GLY B CA 1 +ATOM 8847 C C . GLY B 1 386 ? 37.079 -18.649 89.844 1.00 41.55 ? 386 GLY B C 1 +ATOM 8848 O O . GLY B 1 386 ? 38.213 -18.227 90.054 1.00 42.88 ? 386 GLY B O 1 +ATOM 8849 N N . PHE B 1 387 ? 36.210 -18.880 90.822 1.00 41.32 ? 387 PHE B N 1 +ATOM 8850 C CA . PHE B 1 387 ? 36.590 -18.677 92.213 1.00 43.25 ? 387 PHE B CA 1 +ATOM 8851 C C . PHE B 1 387 ? 37.572 -19.771 92.633 1.00 44.32 ? 387 PHE B C 1 +ATOM 8852 O O . PHE B 1 387 ? 38.535 -19.499 93.354 1.00 44.98 ? 387 PHE B O 1 +ATOM 8853 C CB . PHE B 1 387 ? 35.361 -18.695 93.139 1.00 40.81 ? 387 PHE B CB 1 +ATOM 8854 C CG . PHE B 1 387 ? 34.673 -17.364 93.262 1.00 39.80 ? 387 PHE B CG 1 +ATOM 8855 C CD1 . PHE B 1 387 ? 33.861 -16.879 92.234 1.00 39.22 ? 387 PHE B CD1 1 +ATOM 8856 C CD2 . PHE B 1 387 ? 34.857 -16.579 94.398 1.00 38.68 ? 387 PHE B CD2 1 +ATOM 8857 C CE1 . PHE B 1 387 ? 33.243 -15.627 92.333 1.00 38.09 ? 387 PHE B CE1 1 +ATOM 8858 C CE2 . PHE B 1 387 ? 34.246 -15.324 94.513 1.00 38.36 ? 387 PHE B CE2 1 +ATOM 8859 C CZ . PHE B 1 387 ? 33.438 -14.846 93.476 1.00 39.49 ? 387 PHE B CZ 1 +ATOM 8860 N N . ARG B 1 388 ? 37.320 -20.998 92.175 1.00 44.46 ? 388 ARG B N 1 +ATOM 8861 C CA . ARG B 1 388 ? 38.177 -22.136 92.481 1.00 45.74 ? 388 ARG B CA 1 +ATOM 8862 C C . ARG B 1 388 ? 39.567 -21.892 91.914 1.00 47.14 ? 388 ARG B C 1 +ATOM 8863 O O . ARG B 1 388 ? 40.569 -22.106 92.591 1.00 49.46 ? 388 ARG B O 1 +ATOM 8864 C CB . ARG B 1 388 ? 37.612 -23.420 91.874 1.00 46.01 ? 388 ARG B CB 1 +ATOM 8865 C CG . ARG B 1 388 ? 36.280 -23.880 92.446 1.00 47.31 ? 388 ARG B CG 1 +ATOM 8866 C CD . ARG B 1 388 ? 36.353 -24.072 93.941 1.00 49.11 ? 388 ARG B CD 1 +ATOM 8867 N NE . ARG B 1 388 ? 35.277 -24.925 94.429 1.00 51.71 ? 388 ARG B NE 1 +ATOM 8868 C CZ . ARG B 1 388 ? 34.834 -24.923 95.683 1.00 53.33 ? 388 ARG B CZ 1 +ATOM 8869 N NH1 . ARG B 1 388 ? 35.377 -24.103 96.578 1.00 53.10 ? 388 ARG B NH1 1 +ATOM 8870 N NH2 . ARG B 1 388 ? 33.850 -25.743 96.039 1.00 53.81 ? 388 ARG B NH2 1 +ATOM 8871 N N . THR B 1 389 ? 39.616 -21.445 90.665 1.00 47.96 ? 389 THR B N 1 +ATOM 8872 C CA . THR B 1 389 ? 40.870 -21.154 89.987 1.00 48.36 ? 389 THR B CA 1 +ATOM 8873 C C . THR B 1 389 ? 41.684 -20.133 90.780 1.00 49.82 ? 389 THR B C 1 +ATOM 8874 O O . THR B 1 389 ? 42.911 -20.078 90.663 1.00 51.75 ? 389 THR B O 1 +ATOM 8875 C CB . THR B 1 389 ? 40.610 -20.595 88.568 1.00 48.69 ? 389 THR B CB 1 +ATOM 8876 O OG1 . THR B 1 389 ? 39.961 -21.597 87.776 1.00 47.52 ? 389 THR B OG1 1 +ATOM 8877 C CG2 . THR B 1 389 ? 41.912 -20.184 87.896 1.00 47.05 ? 389 THR B CG2 1 +ATOM 8878 N N . SER B 1 390 ? 41.004 -19.319 91.580 1.00 49.26 ? 390 SER B N 1 +ATOM 8879 C CA . SER B 1 390 ? 41.686 -18.311 92.387 1.00 50.38 ? 390 SER B CA 1 +ATOM 8880 C C . SER B 1 390 ? 41.921 -18.805 93.808 1.00 49.92 ? 390 SER B C 1 +ATOM 8881 O O . SER B 1 390 ? 42.396 -18.057 94.661 1.00 49.00 ? 390 SER B O 1 +ATOM 8882 C CB . SER B 1 390 ? 40.869 -17.015 92.442 1.00 49.65 ? 390 SER B CB 1 +ATOM 8883 O OG . SER B 1 390 ? 40.819 -16.389 91.178 1.00 50.63 ? 390 SER B OG 1 +ATOM 8884 N N . HIS B 1 391 ? 41.584 -20.065 94.057 1.00 51.04 ? 391 HIS B N 1 +ATOM 8885 C CA . HIS B 1 391 ? 41.746 -20.649 95.386 1.00 53.77 ? 391 HIS B CA 1 +ATOM 8886 C C . HIS B 1 391 ? 41.032 -19.771 96.405 1.00 53.72 ? 391 HIS B C 1 +ATOM 8887 O O . HIS B 1 391 ? 41.516 -19.563 97.521 1.00 54.63 ? 391 HIS B O 1 +ATOM 8888 C CB . HIS B 1 391 ? 43.230 -20.767 95.743 1.00 55.71 ? 391 HIS B CB 1 +ATOM 8889 C CG . HIS B 1 391 ? 44.023 -21.563 94.754 1.00 59.15 ? 391 HIS B CG 1 +ATOM 8890 N ND1 . HIS B 1 391 ? 43.746 -22.884 94.469 1.00 59.63 ? 391 HIS B ND1 1 +ATOM 8891 C CD2 . HIS B 1 391 ? 45.063 -21.215 93.958 1.00 59.86 ? 391 HIS B CD2 1 +ATOM 8892 C CE1 . HIS B 1 391 ? 44.580 -23.315 93.540 1.00 60.78 ? 391 HIS B CE1 1 +ATOM 8893 N NE2 . HIS B 1 391 ? 45.390 -22.323 93.213 1.00 61.20 ? 391 HIS B NE2 1 +ATOM 8894 N N . ARG B 1 392 ? 39.876 -19.257 95.998 1.00 52.73 ? 392 ARG B N 1 +ATOM 8895 C CA . ARG B 1 392 ? 39.062 -18.398 96.839 1.00 51.49 ? 392 ARG B CA 1 +ATOM 8896 C C . ARG B 1 392 ? 38.032 -19.281 97.540 1.00 51.84 ? 392 ARG B C 1 +ATOM 8897 O O . ARG B 1 392 ? 37.165 -19.859 96.890 1.00 52.76 ? 392 ARG B O 1 +ATOM 8898 C CB . ARG B 1 392 ? 38.363 -17.371 95.959 1.00 50.89 ? 392 ARG B CB 1 +ATOM 8899 C CG . ARG B 1 392 ? 37.854 -16.158 96.687 1.00 49.95 ? 392 ARG B CG 1 +ATOM 8900 C CD . ARG B 1 392 ? 38.999 -15.320 97.198 1.00 48.19 ? 392 ARG B CD 1 +ATOM 8901 N NE . ARG B 1 392 ? 38.722 -13.908 96.999 1.00 47.70 ? 392 ARG B NE 1 +ATOM 8902 C CZ . ARG B 1 392 ? 39.203 -13.191 95.995 1.00 48.13 ? 392 ARG B CZ 1 +ATOM 8903 N NH1 . ARG B 1 392 ? 39.995 -13.748 95.097 1.00 50.73 ? 392 ARG B NH1 1 +ATOM 8904 N NH2 . ARG B 1 392 ? 38.889 -11.913 95.886 1.00 50.79 ? 392 ARG B NH2 1 +ATOM 8905 N N . ASN B 1 393 ? 38.129 -19.397 98.859 1.00 51.37 ? 393 ASN B N 1 +ATOM 8906 C CA . ASN B 1 393 ? 37.196 -20.233 99.604 1.00 51.26 ? 393 ASN B CA 1 +ATOM 8907 C C . ASN B 1 393 ? 35.877 -19.526 99.895 1.00 49.07 ? 393 ASN B C 1 +ATOM 8908 O O . ASN B 1 393 ? 34.830 -20.166 99.970 1.00 48.33 ? 393 ASN B O 1 +ATOM 8909 C CB . ASN B 1 393 ? 37.836 -20.690 100.915 1.00 54.92 ? 393 ASN B CB 1 +ATOM 8910 C CG . ASN B 1 393 ? 39.170 -21.375 100.699 1.00 59.20 ? 393 ASN B CG 1 +ATOM 8911 O OD1 . ASN B 1 393 ? 39.253 -22.397 100.005 1.00 60.40 ? 393 ASN B OD1 1 +ATOM 8912 N ND2 . ASN B 1 393 ? 40.230 -20.815 101.288 1.00 60.07 ? 393 ASN B ND2 1 +ATOM 8913 N N . GLU B 1 394 ? 35.934 -18.213 100.084 1.00 46.91 ? 394 GLU B N 1 +ATOM 8914 C CA . GLU B 1 394 ? 34.730 -17.442 100.350 1.00 46.67 ? 394 GLU B CA 1 +ATOM 8915 C C . GLU B 1 394 ? 34.172 -17.035 98.992 1.00 45.41 ? 394 GLU B C 1 +ATOM 8916 O O . GLU B 1 394 ? 34.677 -16.119 98.339 1.00 45.10 ? 394 GLU B O 1 +ATOM 8917 C CB . GLU B 1 394 ? 35.054 -16.201 101.182 1.00 47.73 ? 394 GLU B CB 1 +ATOM 8918 C CG . GLU B 1 394 ? 35.811 -16.502 102.459 1.00 50.18 ? 394 GLU B CG 1 +ATOM 8919 C CD . GLU B 1 394 ? 35.737 -15.373 103.467 1.00 52.15 ? 394 GLU B CD 1 +ATOM 8920 O OE1 . GLU B 1 394 ? 35.929 -14.197 103.081 1.00 53.73 ? 394 GLU B OE1 1 +ATOM 8921 O OE2 . GLU B 1 394 ? 35.490 -15.670 104.654 1.00 54.11 ? 394 GLU B OE2 1 +ATOM 8922 N N . ILE B 1 395 ? 33.128 -17.734 98.570 1.00 43.59 ? 395 ILE B N 1 +ATOM 8923 C CA . ILE B 1 395 ? 32.518 -17.478 97.274 1.00 41.96 ? 395 ILE B CA 1 +ATOM 8924 C C . ILE B 1 395 ? 31.194 -16.726 97.362 1.00 40.10 ? 395 ILE B C 1 +ATOM 8925 O O . ILE B 1 395 ? 30.331 -17.042 98.185 1.00 39.03 ? 395 ILE B O 1 +ATOM 8926 C CB . ILE B 1 395 ? 32.282 -18.808 96.527 1.00 42.16 ? 395 ILE B CB 1 +ATOM 8927 C CG1 . ILE B 1 395 ? 33.621 -19.525 96.334 1.00 42.02 ? 395 ILE B CG1 1 +ATOM 8928 C CG2 . ILE B 1 395 ? 31.594 -18.556 95.193 1.00 40.81 ? 395 ILE B CG2 1 +ATOM 8929 C CD1 . ILE B 1 395 ? 33.493 -20.913 95.720 1.00 43.20 ? 395 ILE B CD1 1 +ATOM 8930 N N . PHE B 1 396 ? 31.055 -15.710 96.524 1.00 38.27 ? 396 PHE B N 1 +ATOM 8931 C CA . PHE B 1 396 ? 29.816 -14.958 96.471 1.00 37.71 ? 396 PHE B CA 1 +ATOM 8932 C C . PHE B 1 396 ? 29.434 -14.654 95.030 1.00 36.18 ? 396 PHE B C 1 +ATOM 8933 O O . PHE B 1 396 ? 30.131 -13.923 94.326 1.00 33.17 ? 396 PHE B O 1 +ATOM 8934 C CB . PHE B 1 396 ? 29.888 -13.636 97.233 1.00 38.24 ? 396 PHE B CB 1 +ATOM 8935 C CG . PHE B 1 396 ? 28.594 -12.873 97.182 1.00 40.12 ? 396 PHE B CG 1 +ATOM 8936 C CD1 . PHE B 1 396 ? 27.504 -13.279 97.946 1.00 40.25 ? 396 PHE B CD1 1 +ATOM 8937 C CD2 . PHE B 1 396 ? 28.424 -11.828 96.277 1.00 41.91 ? 396 PHE B CD2 1 +ATOM 8938 C CE1 . PHE B 1 396 ? 26.259 -12.663 97.808 1.00 41.99 ? 396 PHE B CE1 1 +ATOM 8939 C CE2 . PHE B 1 396 ? 27.184 -11.202 96.127 1.00 43.51 ? 396 PHE B CE2 1 +ATOM 8940 C CZ . PHE B 1 396 ? 26.097 -11.623 96.896 1.00 43.59 ? 396 PHE B CZ 1 +ATOM 8941 N N . ILE B 1 397 ? 28.314 -15.224 94.603 1.00 36.07 ? 397 ILE B N 1 +ATOM 8942 C CA . ILE B 1 397 ? 27.816 -15.006 93.254 1.00 34.59 ? 397 ILE B CA 1 +ATOM 8943 C C . ILE B 1 397 ? 26.319 -14.740 93.317 1.00 35.84 ? 397 ILE B C 1 +ATOM 8944 O O . ILE B 1 397 ? 25.563 -15.484 93.957 1.00 34.78 ? 397 ILE B O 1 +ATOM 8945 C CB . ILE B 1 397 ? 28.072 -16.224 92.354 1.00 33.68 ? 397 ILE B CB 1 +ATOM 8946 C CG1 . ILE B 1 397 ? 29.579 -16.515 92.303 1.00 31.93 ? 397 ILE B CG1 1 +ATOM 8947 C CG2 . ILE B 1 397 ? 27.531 -15.954 90.949 1.00 31.48 ? 397 ILE B CG2 1 +ATOM 8948 C CD1 . ILE B 1 397 ? 29.941 -17.749 91.515 1.00 29.98 ? 397 ILE B CD1 1 +ATOM 8949 N N . LEU B 1 398 ? 25.911 -13.654 92.664 1.00 36.38 ? 398 LEU B N 1 +ATOM 8950 C CA . LEU B 1 398 ? 24.514 -13.239 92.599 1.00 35.23 ? 398 LEU B CA 1 +ATOM 8951 C C . LEU B 1 398 ? 24.123 -13.394 91.134 1.00 35.31 ? 398 LEU B C 1 +ATOM 8952 O O . LEU B 1 398 ? 24.880 -13.001 90.238 1.00 33.56 ? 398 LEU B O 1 +ATOM 8953 C CB . LEU B 1 398 ? 24.381 -11.765 92.991 1.00 34.75 ? 398 LEU B CB 1 +ATOM 8954 C CG . LEU B 1 398 ? 23.187 -11.255 93.814 1.00 38.57 ? 398 LEU B CG 1 +ATOM 8955 C CD1 . LEU B 1 398 ? 22.964 -9.777 93.467 1.00 37.56 ? 398 LEU B CD1 1 +ATOM 8956 C CD2 . LEU B 1 398 ? 21.920 -12.070 93.544 1.00 37.37 ? 398 LEU B CD2 1 +ATOM 8957 N N . SER B 1 399 ? 22.954 -13.973 90.880 1.00 35.18 ? 399 SER B N 1 +ATOM 8958 C CA . SER B 1 399 ? 22.491 -14.127 89.507 1.00 34.18 ? 399 SER B CA 1 +ATOM 8959 C C . SER B 1 399 ? 21.045 -13.664 89.412 1.00 34.40 ? 399 SER B C 1 +ATOM 8960 O O . SER B 1 399 ? 20.296 -13.750 90.383 1.00 35.28 ? 399 SER B O 1 +ATOM 8961 C CB . SER B 1 399 ? 22.595 -15.584 89.076 1.00 34.35 ? 399 SER B CB 1 +ATOM 8962 O OG . SER B 1 399 ? 22.162 -15.749 87.737 1.00 36.48 ? 399 SER B OG 1 +ATOM 8963 N N . ARG B 1 400 ? 20.652 -13.159 88.249 1.00 34.21 ? 400 ARG B N 1 +ATOM 8964 C CA . ARG B 1 400 ? 19.276 -12.723 88.076 1.00 32.86 ? 400 ARG B CA 1 +ATOM 8965 C C . ARG B 1 400 ? 18.437 -13.876 87.541 1.00 31.03 ? 400 ARG B C 1 +ATOM 8966 O O . ARG B 1 400 ? 17.336 -14.133 88.019 1.00 30.71 ? 400 ARG B O 1 +ATOM 8967 C CB . ARG B 1 400 ? 19.196 -11.539 87.115 1.00 33.13 ? 400 ARG B CB 1 +ATOM 8968 C CG . ARG B 1 400 ? 17.847 -10.845 87.159 1.00 33.92 ? 400 ARG B CG 1 +ATOM 8969 C CD . ARG B 1 400 ? 17.867 -9.501 86.461 1.00 34.34 ? 400 ARG B CD 1 +ATOM 8970 N NE . ARG B 1 400 ? 17.861 -9.654 85.010 1.00 38.41 ? 400 ARG B NE 1 +ATOM 8971 C CZ . ARG B 1 400 ? 17.655 -8.658 84.155 1.00 39.02 ? 400 ARG B CZ 1 +ATOM 8972 N NH1 . ARG B 1 400 ? 17.444 -7.428 84.608 1.00 37.19 ? 400 ARG B NH1 1 +ATOM 8973 N NH2 . ARG B 1 400 ? 17.636 -8.899 82.850 1.00 38.16 ? 400 ARG B NH2 1 +ATOM 8974 N N . ALA B 1 401 ? 18.965 -14.580 86.550 1.00 29.88 ? 401 ALA B N 1 +ATOM 8975 C CA . ALA B 1 401 ? 18.236 -15.699 85.968 1.00 30.96 ? 401 ALA B CA 1 +ATOM 8976 C C . ALA B 1 401 ? 18.733 -17.027 86.538 1.00 32.60 ? 401 ALA B C 1 +ATOM 8977 O O . ALA B 1 401 ? 19.724 -17.076 87.275 1.00 34.22 ? 401 ALA B O 1 +ATOM 8978 C CB . ALA B 1 401 ? 18.384 -15.682 84.461 1.00 28.58 ? 401 ALA B CB 1 +ATOM 8979 N N . GLY B 1 402 ? 18.041 -18.107 86.204 1.00 33.35 ? 402 GLY B N 1 +ATOM 8980 C CA . GLY B 1 402 ? 18.454 -19.399 86.706 1.00 33.82 ? 402 GLY B CA 1 +ATOM 8981 C C . GLY B 1 402 ? 17.638 -20.548 86.153 1.00 35.23 ? 402 GLY B C 1 +ATOM 8982 O O . GLY B 1 402 ? 16.665 -20.354 85.416 1.00 35.25 ? 402 GLY B O 1 +ATOM 8983 N N . TYR B 1 403 ? 18.056 -21.755 86.522 1.00 34.81 ? 403 TYR B N 1 +ATOM 8984 C CA . TYR B 1 403 ? 17.407 -22.989 86.106 1.00 33.98 ? 403 TYR B CA 1 +ATOM 8985 C C . TYR B 1 403 ? 17.688 -23.961 87.242 1.00 34.81 ? 403 TYR B C 1 +ATOM 8986 O O . TYR B 1 403 ? 18.465 -23.640 88.141 1.00 35.58 ? 403 TYR B O 1 +ATOM 8987 C CB . TYR B 1 403 ? 18.041 -23.493 84.809 1.00 32.75 ? 403 TYR B CB 1 +ATOM 8988 C CG . TYR B 1 403 ? 17.486 -24.807 84.324 1.00 32.20 ? 403 TYR B CG 1 +ATOM 8989 C CD1 . TYR B 1 403 ? 16.165 -24.911 83.903 1.00 32.22 ? 403 TYR B CD1 1 +ATOM 8990 C CD2 . TYR B 1 403 ? 18.281 -25.957 84.296 1.00 32.59 ? 403 TYR B CD2 1 +ATOM 8991 C CE1 . TYR B 1 403 ? 15.641 -26.122 83.465 1.00 32.26 ? 403 TYR B CE1 1 +ATOM 8992 C CE2 . TYR B 1 403 ? 17.763 -27.179 83.861 1.00 32.76 ? 403 TYR B CE2 1 +ATOM 8993 C CZ . TYR B 1 403 ? 16.445 -27.254 83.448 1.00 32.46 ? 403 TYR B CZ 1 +ATOM 8994 O OH . TYR B 1 403 ? 15.936 -28.459 83.020 1.00 33.34 ? 403 TYR B OH 1 +ATOM 8995 N N . ALA B 1 404 ? 17.053 -25.129 87.220 1.00 35.75 ? 404 ALA B N 1 +ATOM 8996 C CA . ALA B 1 404 ? 17.276 -26.135 88.256 1.00 35.79 ? 404 ALA B CA 1 +ATOM 8997 C C . ALA B 1 404 ? 18.784 -26.366 88.390 1.00 36.87 ? 404 ALA B C 1 +ATOM 8998 O O . ALA B 1 404 ? 19.481 -26.537 87.386 1.00 36.61 ? 404 ALA B O 1 +ATOM 8999 C CB . ALA B 1 404 ? 16.584 -27.434 87.881 1.00 34.98 ? 404 ALA B CB 1 +ATOM 9000 N N . GLY B 1 405 ? 19.283 -26.360 89.626 1.00 37.03 ? 405 GLY B N 1 +ATOM 9001 C CA . GLY B 1 405 ? 20.705 -26.562 89.850 1.00 36.94 ? 405 GLY B CA 1 +ATOM 9002 C C . GLY B 1 405 ? 21.467 -25.267 90.094 1.00 37.63 ? 405 GLY B C 1 +ATOM 9003 O O . GLY B 1 405 ? 22.611 -25.286 90.559 1.00 38.33 ? 405 GLY B O 1 +ATOM 9004 N N . ILE B 1 406 ? 20.836 -24.136 89.791 1.00 36.01 ? 406 ILE B N 1 +ATOM 9005 C CA . ILE B 1 406 ? 21.485 -22.849 89.985 1.00 35.17 ? 406 ILE B CA 1 +ATOM 9006 C C . ILE B 1 406 ? 21.903 -22.677 91.447 1.00 34.17 ? 406 ILE B C 1 +ATOM 9007 O O . ILE B 1 406 ? 22.852 -21.944 91.746 1.00 35.22 ? 406 ILE B O 1 +ATOM 9008 C CB . ILE B 1 406 ? 20.549 -21.666 89.556 1.00 34.70 ? 406 ILE B CB 1 +ATOM 9009 C CG1 . ILE B 1 406 ? 21.329 -20.351 89.570 1.00 33.68 ? 406 ILE B CG1 1 +ATOM 9010 C CG2 . ILE B 1 406 ? 19.348 -21.568 90.488 1.00 34.98 ? 406 ILE B CG2 1 +ATOM 9011 C CD1 . ILE B 1 406 ? 22.393 -20.263 88.480 1.00 33.10 ? 406 ILE B CD1 1 +ATOM 9012 N N . GLN B 1 407 ? 21.209 -23.358 92.358 1.00 34.14 ? 407 GLN B N 1 +ATOM 9013 C CA . GLN B 1 407 ? 21.538 -23.249 93.781 1.00 34.72 ? 407 GLN B CA 1 +ATOM 9014 C C . GLN B 1 407 ? 22.960 -23.732 94.103 1.00 35.03 ? 407 GLN B C 1 +ATOM 9015 O O . GLN B 1 407 ? 23.497 -23.409 95.157 1.00 36.23 ? 407 GLN B O 1 +ATOM 9016 C CB . GLN B 1 407 ? 20.523 -24.006 94.652 1.00 33.92 ? 407 GLN B CB 1 +ATOM 9017 C CG . GLN B 1 407 ? 20.576 -25.519 94.553 1.00 35.79 ? 407 GLN B CG 1 +ATOM 9018 C CD . GLN B 1 407 ? 19.793 -26.066 93.365 1.00 37.42 ? 407 GLN B CD 1 +ATOM 9019 O OE1 . GLN B 1 407 ? 19.313 -25.312 92.518 1.00 39.18 ? 407 GLN B OE1 1 +ATOM 9020 N NE2 . GLN B 1 407 ? 19.664 -27.390 93.298 1.00 36.28 ? 407 GLN B NE2 1 +ATOM 9021 N N . ARG B 1 408 ? 23.564 -24.498 93.198 1.00 34.54 ? 408 ARG B N 1 +ATOM 9022 C CA . ARG B 1 408 ? 24.926 -24.978 93.402 1.00 34.70 ? 408 ARG B CA 1 +ATOM 9023 C C . ARG B 1 408 ? 25.909 -23.818 93.364 1.00 35.15 ? 408 ARG B C 1 +ATOM 9024 O O . ARG B 1 408 ? 26.953 -23.869 93.996 1.00 35.89 ? 408 ARG B O 1 +ATOM 9025 C CB . ARG B 1 408 ? 25.395 -25.894 92.271 1.00 34.17 ? 408 ARG B CB 1 +ATOM 9026 C CG . ARG B 1 408 ? 24.629 -27.131 91.969 1.00 33.42 ? 408 ARG B CG 1 +ATOM 9027 C CD . ARG B 1 408 ? 25.196 -27.693 90.660 1.00 33.68 ? 408 ARG B CD 1 +ATOM 9028 N NE . ARG B 1 408 ? 24.630 -28.987 90.291 1.00 33.15 ? 408 ARG B NE 1 +ATOM 9029 C CZ . ARG B 1 408 ? 25.000 -29.679 89.219 1.00 34.27 ? 408 ARG B CZ 1 +ATOM 9030 N NH1 . ARG B 1 408 ? 25.937 -29.201 88.408 1.00 34.54 ? 408 ARG B NH1 1 +ATOM 9031 N NH2 . ARG B 1 408 ? 24.435 -30.850 88.959 1.00 34.85 ? 408 ARG B NH2 1 +ATOM 9032 N N . TYR B 1 409 ? 25.582 -22.781 92.600 1.00 36.25 ? 409 TYR B N 1 +ATOM 9033 C CA . TYR B 1 409 ? 26.522 -21.683 92.414 1.00 36.19 ? 409 TYR B CA 1 +ATOM 9034 C C . TYR B 1 409 ? 26.166 -20.268 92.791 1.00 35.95 ? 409 TYR B C 1 +ATOM 9035 O O . TYR B 1 409 ? 27.069 -19.428 92.873 1.00 37.25 ? 409 TYR B O 1 +ATOM 9036 C CB . TYR B 1 409 ? 26.958 -21.650 90.949 1.00 36.49 ? 409 TYR B CB 1 +ATOM 9037 C CG . TYR B 1 409 ? 27.180 -23.020 90.347 1.00 38.71 ? 409 TYR B CG 1 +ATOM 9038 C CD1 . TYR B 1 409 ? 28.242 -23.833 90.769 1.00 37.66 ? 409 TYR B CD1 1 +ATOM 9039 C CD2 . TYR B 1 409 ? 26.320 -23.511 89.357 1.00 37.94 ? 409 TYR B CD2 1 +ATOM 9040 C CE1 . TYR B 1 409 ? 28.441 -25.100 90.216 1.00 38.05 ? 409 TYR B CE1 1 +ATOM 9041 C CE2 . TYR B 1 409 ? 26.511 -24.777 88.799 1.00 39.15 ? 409 TYR B CE2 1 +ATOM 9042 C CZ . TYR B 1 409 ? 27.572 -25.566 89.233 1.00 39.49 ? 409 TYR B CZ 1 +ATOM 9043 O OH . TYR B 1 409 ? 27.758 -26.822 88.694 1.00 39.28 ? 409 TYR B OH 1 +ATOM 9044 N N . ALA B 1 410 ? 24.894 -19.961 93.019 1.00 35.37 ? 410 ALA B N 1 +ATOM 9045 C CA . ALA B 1 410 ? 24.604 -18.567 93.315 1.00 35.41 ? 410 ALA B CA 1 +ATOM 9046 C C . ALA B 1 410 ? 23.358 -18.200 94.099 1.00 36.44 ? 410 ALA B C 1 +ATOM 9047 O O . ALA B 1 410 ? 22.446 -19.011 94.295 1.00 37.16 ? 410 ALA B O 1 +ATOM 9048 C CB . ALA B 1 410 ? 24.610 -17.783 92.002 1.00 33.30 ? 410 ALA B CB 1 +ATOM 9049 N N . PHE B 1 411 ? 23.362 -16.948 94.556 1.00 36.13 ? 411 PHE B N 1 +ATOM 9050 C CA . PHE B 1 411 ? 22.239 -16.340 95.258 1.00 36.38 ? 411 PHE B CA 1 +ATOM 9051 C C . PHE B 1 411 ? 21.382 -15.819 94.107 1.00 36.14 ? 411 PHE B C 1 +ATOM 9052 O O . PHE B 1 411 ? 21.885 -15.573 93.007 1.00 34.14 ? 411 PHE B O 1 +ATOM 9053 C CB . PHE B 1 411 ? 22.677 -15.103 96.046 1.00 37.95 ? 411 PHE B CB 1 +ATOM 9054 C CG . PHE B 1 411 ? 23.191 -15.383 97.420 1.00 42.24 ? 411 PHE B CG 1 +ATOM 9055 C CD1 . PHE B 1 411 ? 24.264 -16.246 97.626 1.00 43.41 ? 411 PHE B CD1 1 +ATOM 9056 C CD2 . PHE B 1 411 ? 22.629 -14.737 98.520 1.00 43.24 ? 411 PHE B CD2 1 +ATOM 9057 C CE1 . PHE B 1 411 ? 24.769 -16.455 98.909 1.00 41.69 ? 411 PHE B CE1 1 +ATOM 9058 C CE2 . PHE B 1 411 ? 23.129 -14.942 99.800 1.00 42.95 ? 411 PHE B CE2 1 +ATOM 9059 C CZ . PHE B 1 411 ? 24.203 -15.803 99.991 1.00 41.71 ? 411 PHE B CZ 1 +ATOM 9060 N N . ILE B 1 412 ? 20.097 -15.634 94.357 1.00 36.48 ? 412 ILE B N 1 +ATOM 9061 C CA . ILE B 1 412 ? 19.234 -15.081 93.332 1.00 36.89 ? 412 ILE B CA 1 +ATOM 9062 C C . ILE B 1 412 ? 18.409 -13.980 93.970 1.00 36.94 ? 412 ILE B C 1 +ATOM 9063 O O . ILE B 1 412 ? 17.877 -14.161 95.064 1.00 37.46 ? 412 ILE B O 1 +ATOM 9064 C CB . ILE B 1 412 ? 18.294 -16.152 92.733 1.00 37.89 ? 412 ILE B CB 1 +ATOM 9065 C CG1 . ILE B 1 412 ? 19.093 -17.075 91.813 1.00 37.59 ? 412 ILE B CG1 1 +ATOM 9066 C CG2 . ILE B 1 412 ? 17.167 -15.488 91.943 1.00 38.60 ? 412 ILE B CG2 1 +ATOM 9067 C CD1 . ILE B 1 412 ? 18.246 -18.024 91.013 1.00 38.31 ? 412 ILE B CD1 1 +ATOM 9068 N N . TRP B 1 413 ? 18.340 -12.826 93.315 1.00 36.48 ? 413 TRP B N 1 +ATOM 9069 C CA . TRP B 1 413 ? 17.522 -11.733 93.828 1.00 36.66 ? 413 TRP B CA 1 +ATOM 9070 C C . TRP B 1 413 ? 16.414 -11.529 92.781 1.00 36.83 ? 413 TRP B C 1 +ATOM 9071 O O . TRP B 1 413 ? 16.598 -11.850 91.602 1.00 35.94 ? 413 TRP B O 1 +ATOM 9072 C CB . TRP B 1 413 ? 18.369 -10.471 94.055 1.00 34.92 ? 413 TRP B CB 1 +ATOM 9073 C CG . TRP B 1 413 ? 18.313 -9.440 92.985 1.00 36.88 ? 413 TRP B CG 1 +ATOM 9074 C CD1 . TRP B 1 413 ? 17.559 -8.296 92.979 1.00 35.89 ? 413 TRP B CD1 1 +ATOM 9075 C CD2 . TRP B 1 413 ? 19.063 -9.435 91.765 1.00 36.36 ? 413 TRP B CD2 1 +ATOM 9076 N NE1 . TRP B 1 413 ? 17.801 -7.579 91.830 1.00 36.32 ? 413 TRP B NE1 1 +ATOM 9077 C CE2 . TRP B 1 413 ? 18.718 -8.256 91.066 1.00 34.74 ? 413 TRP B CE2 1 +ATOM 9078 C CE3 . TRP B 1 413 ? 19.999 -10.312 91.195 1.00 36.82 ? 413 TRP B CE3 1 +ATOM 9079 C CZ2 . TRP B 1 413 ? 19.274 -7.930 89.823 1.00 35.21 ? 413 TRP B CZ2 1 +ATOM 9080 C CZ3 . TRP B 1 413 ? 20.555 -9.982 89.952 1.00 37.24 ? 413 TRP B CZ3 1 +ATOM 9081 C CH2 . TRP B 1 413 ? 20.187 -8.803 89.284 1.00 34.21 ? 413 TRP B CH2 1 +ATOM 9082 N N . THR B 1 414 ? 15.273 -11.010 93.218 1.00 35.69 ? 414 THR B N 1 +ATOM 9083 C CA . THR B 1 414 ? 14.117 -10.840 92.348 1.00 36.44 ? 414 THR B CA 1 +ATOM 9084 C C . THR B 1 414 ? 14.087 -9.732 91.292 1.00 38.36 ? 414 THR B C 1 +ATOM 9085 O O . THR B 1 414 ? 13.009 -9.316 90.866 1.00 39.00 ? 414 THR B O 1 +ATOM 9086 C CB . THR B 1 414 ? 12.853 -10.720 93.190 1.00 35.30 ? 414 THR B CB 1 +ATOM 9087 O OG1 . THR B 1 414 ? 12.951 -9.559 94.015 1.00 33.56 ? 414 THR B OG1 1 +ATOM 9088 C CG2 . THR B 1 414 ? 12.687 -11.949 94.070 1.00 32.57 ? 414 THR B CG2 1 +ATOM 9089 N N . GLY B 1 415 ? 15.247 -9.239 90.876 1.00 38.39 ? 415 GLY B N 1 +ATOM 9090 C CA . GLY B 1 415 ? 15.263 -8.231 89.833 1.00 38.29 ? 415 GLY B CA 1 +ATOM 9091 C C . GLY B 1 415 ? 14.684 -6.855 90.097 1.00 40.49 ? 415 GLY B C 1 +ATOM 9092 O O . GLY B 1 415 ? 14.643 -6.394 91.236 1.00 41.23 ? 415 GLY B O 1 +ATOM 9093 N N . ASP B 1 416 ? 14.214 -6.212 89.021 1.00 40.91 ? 416 ASP B N 1 +ATOM 9094 C CA . ASP B 1 416 ? 13.692 -4.844 89.051 1.00 39.18 ? 416 ASP B CA 1 +ATOM 9095 C C . ASP B 1 416 ? 12.287 -4.587 89.598 1.00 38.68 ? 416 ASP B C 1 +ATOM 9096 O O . ASP B 1 416 ? 11.383 -4.220 88.849 1.00 39.52 ? 416 ASP B O 1 +ATOM 9097 C CB . ASP B 1 416 ? 13.781 -4.244 87.645 1.00 40.47 ? 416 ASP B CB 1 +ATOM 9098 C CG . ASP B 1 416 ? 15.174 -4.363 87.036 1.00 42.59 ? 416 ASP B CG 1 +ATOM 9099 O OD1 . ASP B 1 416 ? 16.162 -4.498 87.792 1.00 43.97 ? 416 ASP B OD1 1 +ATOM 9100 O OD2 . ASP B 1 416 ? 15.278 -4.304 85.791 1.00 44.52 ? 416 ASP B OD2 1 +ATOM 9101 N N . ASN B 1 417 ? 12.111 -4.732 90.904 1.00 36.81 ? 417 ASN B N 1 +ATOM 9102 C CA . ASN B 1 417 ? 10.811 -4.507 91.511 1.00 35.46 ? 417 ASN B CA 1 +ATOM 9103 C C . ASN B 1 417 ? 10.466 -3.020 91.623 1.00 35.40 ? 417 ASN B C 1 +ATOM 9104 O O . ASN B 1 417 ? 11.332 -2.148 91.525 1.00 34.18 ? 417 ASN B O 1 +ATOM 9105 C CB . ASN B 1 417 ? 10.751 -5.188 92.892 1.00 36.89 ? 417 ASN B CB 1 +ATOM 9106 C CG . ASN B 1 417 ? 11.753 -4.612 93.886 1.00 38.14 ? 417 ASN B CG 1 +ATOM 9107 O OD1 . ASN B 1 417 ? 12.862 -4.220 93.520 1.00 38.98 ? 417 ASN B OD1 1 +ATOM 9108 N ND2 . ASN B 1 417 ? 11.369 -4.582 95.159 1.00 39.15 ? 417 ASN B ND2 1 +ATOM 9109 N N . THR B 1 418 ? 9.179 -2.746 91.815 1.00 35.49 ? 418 THR B N 1 +ATOM 9110 C CA . THR B 1 418 ? 8.664 -1.383 91.928 1.00 34.74 ? 418 THR B CA 1 +ATOM 9111 C C . THR B 1 418 ? 8.218 -1.098 93.355 1.00 35.14 ? 418 THR B C 1 +ATOM 9112 O O . THR B 1 418 ? 7.445 -1.860 93.933 1.00 36.59 ? 418 THR B O 1 +ATOM 9113 C CB . THR B 1 418 ? 7.436 -1.163 90.999 1.00 33.16 ? 418 THR B CB 1 +ATOM 9114 O OG1 . THR B 1 418 ? 7.832 -1.310 89.630 1.00 33.21 ? 418 THR B OG1 1 +ATOM 9115 C CG2 . THR B 1 418 ? 6.846 0.226 91.205 1.00 30.78 ? 418 THR B CG2 1 +ATOM 9116 N N . PRO B 1 419 ? 8.690 0.012 93.940 1.00 34.44 ? 419 PRO B N 1 +ATOM 9117 C CA . PRO B 1 419 ? 8.311 0.364 95.310 1.00 35.13 ? 419 PRO B CA 1 +ATOM 9118 C C . PRO B 1 419 ? 6.811 0.643 95.409 1.00 35.44 ? 419 PRO B C 1 +ATOM 9119 O O . PRO B 1 419 ? 6.288 1.500 94.699 1.00 34.79 ? 419 PRO B O 1 +ATOM 9120 C CB . PRO B 1 419 ? 9.126 1.631 95.592 1.00 33.26 ? 419 PRO B CB 1 +ATOM 9121 C CG . PRO B 1 419 ? 10.267 1.547 94.635 1.00 35.38 ? 419 PRO B CG 1 +ATOM 9122 C CD . PRO B 1 419 ? 9.641 0.991 93.391 1.00 35.27 ? 419 PRO B CD 1 +ATOM 9123 N N . SER B 1 420 ? 6.123 -0.079 96.284 1.00 35.36 ? 420 SER B N 1 +ATOM 9124 C CA . SER B 1 420 ? 4.697 0.136 96.484 1.00 36.20 ? 420 SER B CA 1 +ATOM 9125 C C . SER B 1 420 ? 4.234 -0.808 97.567 1.00 36.82 ? 420 SER B C 1 +ATOM 9126 O O . SER B 1 420 ? 4.868 -1.833 97.809 1.00 38.40 ? 420 SER B O 1 +ATOM 9127 C CB . SER B 1 420 ? 3.906 -0.142 95.211 1.00 35.96 ? 420 SER B CB 1 +ATOM 9128 O OG . SER B 1 420 ? 3.698 -1.533 95.046 1.00 38.72 ? 420 SER B OG 1 +ATOM 9129 N N . TRP B 1 421 ? 3.127 -0.473 98.216 1.00 36.59 ? 421 TRP B N 1 +ATOM 9130 C CA . TRP B 1 421 ? 2.624 -1.321 99.273 1.00 37.21 ? 421 TRP B CA 1 +ATOM 9131 C C . TRP B 1 421 ? 2.272 -2.710 98.783 1.00 39.13 ? 421 TRP B C 1 +ATOM 9132 O O . TRP B 1 421 ? 2.483 -3.692 99.496 1.00 42.08 ? 421 TRP B O 1 +ATOM 9133 C CB . TRP B 1 421 ? 1.434 -0.660 99.966 1.00 35.23 ? 421 TRP B CB 1 +ATOM 9134 C CG . TRP B 1 421 ? 1.870 0.510 100.788 1.00 35.19 ? 421 TRP B CG 1 +ATOM 9135 C CD1 . TRP B 1 421 ? 1.931 1.808 100.391 1.00 35.35 ? 421 TRP B CD1 1 +ATOM 9136 C CD2 . TRP B 1 421 ? 2.401 0.473 102.124 1.00 35.50 ? 421 TRP B CD2 1 +ATOM 9137 N NE1 . TRP B 1 421 ? 2.469 2.590 101.389 1.00 35.34 ? 421 TRP B NE1 1 +ATOM 9138 C CE2 . TRP B 1 421 ? 2.765 1.794 102.465 1.00 35.09 ? 421 TRP B CE2 1 +ATOM 9139 C CE3 . TRP B 1 421 ? 2.604 -0.549 103.063 1.00 35.77 ? 421 TRP B CE3 1 +ATOM 9140 C CZ2 . TRP B 1 421 ? 3.318 2.127 103.709 1.00 35.01 ? 421 TRP B CZ2 1 +ATOM 9141 C CZ3 . TRP B 1 421 ? 3.155 -0.219 104.302 1.00 36.98 ? 421 TRP B CZ3 1 +ATOM 9142 C CH2 . TRP B 1 421 ? 3.503 1.113 104.612 1.00 36.35 ? 421 TRP B CH2 1 +ATOM 9143 N N . ASP B 1 422 ? 1.751 -2.810 97.567 1.00 41.45 ? 422 ASP B N 1 +ATOM 9144 C CA . ASP B 1 422 ? 1.406 -4.118 97.032 1.00 42.59 ? 422 ASP B CA 1 +ATOM 9145 C C . ASP B 1 422 ? 2.670 -4.940 96.775 1.00 42.06 ? 422 ASP B C 1 +ATOM 9146 O O . ASP B 1 422 ? 2.665 -6.159 96.925 1.00 41.55 ? 422 ASP B O 1 +ATOM 9147 C CB . ASP B 1 422 ? 0.607 -3.983 95.735 1.00 46.57 ? 422 ASP B CB 1 +ATOM 9148 C CG . ASP B 1 422 ? -0.740 -3.298 95.945 1.00 52.88 ? 422 ASP B CG 1 +ATOM 9149 O OD1 . ASP B 1 422 ? -1.381 -3.551 96.993 1.00 55.84 ? 422 ASP B OD1 1 +ATOM 9150 O OD2 . ASP B 1 422 ? -1.167 -2.517 95.059 1.00 55.32 ? 422 ASP B OD2 1 +ATOM 9151 N N . ASP B 1 423 ? 3.759 -4.277 96.404 1.00 40.84 ? 423 ASP B N 1 +ATOM 9152 C CA . ASP B 1 423 ? 5.000 -4.995 96.136 1.00 41.41 ? 423 ASP B CA 1 +ATOM 9153 C C . ASP B 1 423 ? 5.505 -5.761 97.357 1.00 40.87 ? 423 ASP B C 1 +ATOM 9154 O O . ASP B 1 423 ? 6.216 -6.759 97.209 1.00 41.31 ? 423 ASP B O 1 +ATOM 9155 C CB . ASP B 1 423 ? 6.091 -4.042 95.637 1.00 43.17 ? 423 ASP B CB 1 +ATOM 9156 C CG . ASP B 1 423 ? 7.333 -4.783 95.133 1.00 46.34 ? 423 ASP B CG 1 +ATOM 9157 O OD1 . ASP B 1 423 ? 7.197 -5.671 94.254 1.00 46.74 ? 423 ASP B OD1 1 +ATOM 9158 O OD2 . ASP B 1 423 ? 8.449 -4.472 95.614 1.00 47.20 ? 423 ASP B OD2 1 +ATOM 9159 N N . LEU B 1 424 ? 5.145 -5.311 98.558 1.00 38.94 ? 424 LEU B N 1 +ATOM 9160 C CA . LEU B 1 424 ? 5.578 -6.015 99.762 1.00 38.28 ? 424 LEU B CA 1 +ATOM 9161 C C . LEU B 1 424 ? 5.087 -7.461 99.716 1.00 38.18 ? 424 LEU B C 1 +ATOM 9162 O O . LEU B 1 424 ? 5.849 -8.394 99.971 1.00 37.20 ? 424 LEU B O 1 +ATOM 9163 C CB . LEU B 1 424 ? 5.044 -5.330 101.019 1.00 36.81 ? 424 LEU B CB 1 +ATOM 9164 C CG . LEU B 1 424 ? 5.588 -3.935 101.320 1.00 35.74 ? 424 LEU B CG 1 +ATOM 9165 C CD1 . LEU B 1 424 ? 4.976 -3.448 102.617 1.00 34.45 ? 424 LEU B CD1 1 +ATOM 9166 C CD2 . LEU B 1 424 ? 7.121 -3.961 101.413 1.00 34.89 ? 424 LEU B CD2 1 +ATOM 9167 N N . LYS B 1 425 ? 3.812 -7.644 99.388 1.00 38.90 ? 425 LYS B N 1 +ATOM 9168 C CA . LYS B 1 425 ? 3.251 -8.984 99.295 1.00 39.84 ? 425 LYS B CA 1 +ATOM 9169 C C . LYS B 1 425 ? 3.837 -9.744 98.106 1.00 39.03 ? 425 LYS B C 1 +ATOM 9170 O O . LYS B 1 425 ? 4.096 -10.938 98.196 1.00 40.50 ? 425 LYS B O 1 +ATOM 9171 C CB . LYS B 1 425 ? 1.735 -8.923 99.145 1.00 42.96 ? 425 LYS B CB 1 +ATOM 9172 C CG . LYS B 1 425 ? 0.997 -8.401 100.365 1.00 47.56 ? 425 LYS B CG 1 +ATOM 9173 C CD . LYS B 1 425 ? -0.504 -8.674 100.226 1.00 51.10 ? 425 LYS B CD 1 +ATOM 9174 C CE . LYS B 1 425 ? -1.274 -8.220 101.454 1.00 53.90 ? 425 LYS B CE 1 +ATOM 9175 N NZ . LYS B 1 425 ? -1.142 -6.749 101.653 1.00 57.56 ? 425 LYS B NZ 1 +ATOM 9176 N N . LEU B 1 426 ? 4.048 -9.053 96.993 1.00 37.24 ? 426 LEU B N 1 +ATOM 9177 C CA . LEU B 1 426 ? 4.588 -9.693 95.802 1.00 36.82 ? 426 LEU B CA 1 +ATOM 9178 C C . LEU B 1 426 ? 5.985 -10.274 96.065 1.00 36.27 ? 426 LEU B C 1 +ATOM 9179 O O . LEU B 1 426 ? 6.255 -11.433 95.736 1.00 35.80 ? 426 LEU B O 1 +ATOM 9180 C CB . LEU B 1 426 ? 4.670 -8.686 94.645 1.00 35.45 ? 426 LEU B CB 1 +ATOM 9181 C CG . LEU B 1 426 ? 4.404 -9.170 93.214 1.00 36.03 ? 426 LEU B CG 1 +ATOM 9182 C CD1 . LEU B 1 426 ? 5.247 -8.342 92.244 1.00 33.73 ? 426 LEU B CD1 1 +ATOM 9183 C CD2 . LEU B 1 426 ? 4.731 -10.650 93.065 1.00 33.51 ? 426 LEU B CD2 1 +ATOM 9184 N N . GLN B 1 427 ? 6.868 -9.469 96.655 1.00 34.97 ? 427 GLN B N 1 +ATOM 9185 C CA . GLN B 1 427 ? 8.229 -9.913 96.940 1.00 34.68 ? 427 GLN B CA 1 +ATOM 9186 C C . GLN B 1 427 ? 8.247 -11.155 97.819 1.00 35.52 ? 427 GLN B C 1 +ATOM 9187 O O . GLN B 1 427 ? 9.080 -12.049 97.652 1.00 33.40 ? 427 GLN B O 1 +ATOM 9188 C CB . GLN B 1 427 ? 9.027 -8.790 97.599 1.00 34.81 ? 427 GLN B CB 1 +ATOM 9189 C CG . GLN B 1 427 ? 9.319 -7.635 96.655 1.00 35.25 ? 427 GLN B CG 1 +ATOM 9190 C CD . GLN B 1 427 ? 9.807 -8.129 95.306 1.00 37.51 ? 427 GLN B CD 1 +ATOM 9191 O OE1 . GLN B 1 427 ? 10.732 -8.935 95.233 1.00 38.09 ? 427 GLN B OE1 1 +ATOM 9192 N NE2 . GLN B 1 427 ? 9.180 -7.653 94.229 1.00 37.24 ? 427 GLN B NE2 1 +ATOM 9193 N N . LEU B 1 428 ? 7.308 -11.215 98.749 1.00 36.65 ? 428 LEU B N 1 +ATOM 9194 C CA . LEU B 1 428 ? 7.217 -12.356 99.636 1.00 38.02 ? 428 LEU B CA 1 +ATOM 9195 C C . LEU B 1 428 ? 6.858 -13.632 98.856 1.00 38.39 ? 428 LEU B C 1 +ATOM 9196 O O . LEU B 1 428 ? 7.386 -14.710 99.142 1.00 39.05 ? 428 LEU B O 1 +ATOM 9197 C CB . LEU B 1 428 ? 6.182 -12.061 100.713 1.00 39.09 ? 428 LEU B CB 1 +ATOM 9198 C CG . LEU B 1 428 ? 6.391 -12.700 102.080 1.00 41.84 ? 428 LEU B CG 1 +ATOM 9199 C CD1 . LEU B 1 428 ? 7.859 -12.672 102.458 1.00 42.75 ? 428 LEU B CD1 1 +ATOM 9200 C CD2 . LEU B 1 428 ? 5.558 -11.935 103.101 1.00 42.95 ? 428 LEU B CD2 1 +ATOM 9201 N N . GLN B 1 429 ? 5.971 -13.516 97.868 1.00 37.67 ? 429 GLN B N 1 +ATOM 9202 C CA . GLN B 1 429 ? 5.580 -14.680 97.068 1.00 37.76 ? 429 GLN B CA 1 +ATOM 9203 C C . GLN B 1 429 ? 6.746 -15.107 96.182 1.00 35.96 ? 429 GLN B C 1 +ATOM 9204 O O . GLN B 1 429 ? 6.990 -16.294 95.970 1.00 36.23 ? 429 GLN B O 1 +ATOM 9205 C CB . GLN B 1 429 ? 4.375 -14.356 96.180 1.00 38.03 ? 429 GLN B CB 1 +ATOM 9206 C CG . GLN B 1 429 ? 3.138 -13.938 96.928 1.00 40.65 ? 429 GLN B CG 1 +ATOM 9207 C CD . GLN B 1 429 ? 2.028 -13.499 95.991 1.00 44.70 ? 429 GLN B CD 1 +ATOM 9208 O OE1 . GLN B 1 429 ? 2.231 -12.647 95.121 1.00 45.99 ? 429 GLN B OE1 1 +ATOM 9209 N NE2 . GLN B 1 429 ? 0.843 -14.076 96.166 1.00 47.27 ? 429 GLN B NE2 1 +ATOM 9210 N N . LEU B 1 430 ? 7.457 -14.123 95.653 1.00 35.25 ? 430 LEU B N 1 +ATOM 9211 C CA . LEU B 1 430 ? 8.601 -14.383 94.787 1.00 35.16 ? 430 LEU B CA 1 +ATOM 9212 C C . LEU B 1 430 ? 9.722 -15.139 95.498 1.00 34.58 ? 430 LEU B C 1 +ATOM 9213 O O . LEU B 1 430 ? 10.179 -16.176 95.014 1.00 33.49 ? 430 LEU B O 1 +ATOM 9214 C CB . LEU B 1 430 ? 9.153 -13.064 94.237 1.00 33.99 ? 430 LEU B CB 1 +ATOM 9215 C CG . LEU B 1 430 ? 8.805 -12.640 92.804 1.00 36.14 ? 430 LEU B CG 1 +ATOM 9216 C CD1 . LEU B 1 430 ? 7.615 -13.414 92.248 1.00 35.24 ? 430 LEU B CD1 1 +ATOM 9217 C CD2 . LEU B 1 430 ? 8.537 -11.152 92.802 1.00 35.79 ? 430 LEU B CD2 1 +ATOM 9218 N N . VAL B 1 431 ? 10.163 -14.630 96.644 1.00 33.73 ? 431 VAL B N 1 +ATOM 9219 C CA . VAL B 1 431 ? 11.246 -15.287 97.359 1.00 33.89 ? 431 VAL B CA 1 +ATOM 9220 C C . VAL B 1 431 ? 10.825 -16.628 97.937 1.00 34.26 ? 431 VAL B C 1 +ATOM 9221 O O . VAL B 1 431 ? 11.621 -17.568 97.952 1.00 34.95 ? 431 VAL B O 1 +ATOM 9222 C CB . VAL B 1 431 ? 11.835 -14.383 98.475 1.00 34.71 ? 431 VAL B CB 1 +ATOM 9223 C CG1 . VAL B 1 431 ? 12.306 -13.067 97.864 1.00 33.12 ? 431 VAL B CG1 1 +ATOM 9224 C CG2 . VAL B 1 431 ? 10.810 -14.136 99.571 1.00 34.57 ? 431 VAL B CG2 1 +ATOM 9225 N N . LEU B 1 432 ? 9.576 -16.739 98.388 1.00 34.20 ? 432 LEU B N 1 +ATOM 9226 C CA . LEU B 1 432 ? 9.099 -18.012 98.932 1.00 33.42 ? 432 LEU B CA 1 +ATOM 9227 C C . LEU B 1 432 ? 8.914 -19.052 97.834 1.00 34.74 ? 432 LEU B C 1 +ATOM 9228 O O . LEU B 1 432 ? 9.144 -20.245 98.054 1.00 35.80 ? 432 LEU B O 1 +ATOM 9229 C CB . LEU B 1 432 ? 7.788 -17.832 99.703 1.00 32.66 ? 432 LEU B CB 1 +ATOM 9230 C CG . LEU B 1 432 ? 7.901 -17.064 101.026 1.00 32.29 ? 432 LEU B CG 1 +ATOM 9231 C CD1 . LEU B 1 432 ? 6.575 -17.106 101.755 1.00 28.25 ? 432 LEU B CD1 1 +ATOM 9232 C CD2 . LEU B 1 432 ? 8.988 -17.679 101.888 1.00 31.34 ? 432 LEU B CD2 1 +ATOM 9233 N N . GLY B 1 433 ? 8.509 -18.608 96.646 1.00 36.66 ? 433 GLY B N 1 +ATOM 9234 C CA . GLY B 1 433 ? 8.326 -19.539 95.542 1.00 37.18 ? 433 GLY B CA 1 +ATOM 9235 C C . GLY B 1 433 ? 9.667 -20.118 95.117 1.00 37.36 ? 433 GLY B C 1 +ATOM 9236 O O . GLY B 1 433 ? 9.781 -21.309 94.804 1.00 38.53 ? 433 GLY B O 1 +ATOM 9237 N N . LEU B 1 434 ? 10.680 -19.258 95.110 1.00 36.50 ? 434 LEU B N 1 +ATOM 9238 C CA . LEU B 1 434 ? 12.047 -19.627 94.745 1.00 37.75 ? 434 LEU B CA 1 +ATOM 9239 C C . LEU B 1 434 ? 12.608 -20.584 95.805 1.00 38.78 ? 434 LEU B C 1 +ATOM 9240 O O . LEU B 1 434 ? 13.216 -21.611 95.499 1.00 38.38 ? 434 LEU B O 1 +ATOM 9241 C CB . LEU B 1 434 ? 12.896 -18.361 94.706 1.00 36.47 ? 434 LEU B CB 1 +ATOM 9242 C CG . LEU B 1 434 ? 13.736 -17.996 93.492 1.00 38.55 ? 434 LEU B CG 1 +ATOM 9243 C CD1 . LEU B 1 434 ? 13.177 -18.600 92.224 1.00 37.91 ? 434 LEU B CD1 1 +ATOM 9244 C CD2 . LEU B 1 434 ? 13.772 -16.484 93.396 1.00 39.43 ? 434 LEU B CD2 1 +ATOM 9245 N N . SER B 1 435 ? 12.373 -20.227 97.060 1.00 39.33 ? 435 SER B N 1 +ATOM 9246 C CA . SER B 1 435 ? 12.838 -20.998 98.196 1.00 40.72 ? 435 SER B CA 1 +ATOM 9247 C C . SER B 1 435 ? 12.238 -22.407 98.243 1.00 41.08 ? 435 SER B C 1 +ATOM 9248 O O . SER B 1 435 ? 12.944 -23.389 98.473 1.00 42.39 ? 435 SER B O 1 +ATOM 9249 C CB . SER B 1 435 ? 12.502 -20.228 99.470 1.00 41.51 ? 435 SER B CB 1 +ATOM 9250 O OG . SER B 1 435 ? 13.038 -20.860 100.609 1.00 46.62 ? 435 SER B OG 1 +ATOM 9251 N N . ILE B 1 436 ? 10.936 -22.515 98.015 1.00 41.42 ? 436 ILE B N 1 +ATOM 9252 C CA . ILE B 1 436 ? 10.284 -23.818 98.047 1.00 40.80 ? 436 ILE B CA 1 +ATOM 9253 C C . ILE B 1 436 ? 10.647 -24.634 96.806 1.00 40.40 ? 436 ILE B C 1 +ATOM 9254 O O . ILE B 1 436 ? 10.312 -25.809 96.703 1.00 41.88 ? 436 ILE B O 1 +ATOM 9255 C CB . ILE B 1 436 ? 8.746 -23.655 98.132 1.00 42.28 ? 436 ILE B CB 1 +ATOM 9256 C CG1 . ILE B 1 436 ? 8.119 -24.945 98.641 1.00 42.89 ? 436 ILE B CG1 1 +ATOM 9257 C CG2 . ILE B 1 436 ? 8.168 -23.288 96.770 1.00 43.23 ? 436 ILE B CG2 1 +ATOM 9258 C CD1 . ILE B 1 436 ? 8.503 -25.253 100.069 1.00 43.72 ? 436 ILE B CD1 1 +ATOM 9259 N N . SER B 1 437 ? 11.347 -24.004 95.869 1.00 40.12 ? 437 SER B N 1 +ATOM 9260 C CA . SER B 1 437 ? 11.747 -24.660 94.631 1.00 39.24 ? 437 SER B CA 1 +ATOM 9261 C C . SER B 1 437 ? 13.230 -25.026 94.552 1.00 39.96 ? 437 SER B C 1 +ATOM 9262 O O . SER B 1 437 ? 13.761 -25.229 93.455 1.00 39.65 ? 437 SER B O 1 +ATOM 9263 C CB . SER B 1 437 ? 11.377 -23.778 93.431 1.00 39.26 ? 437 SER B CB 1 +ATOM 9264 O OG . SER B 1 437 ? 9.965 -23.653 93.294 1.00 38.31 ? 437 SER B OG 1 +ATOM 9265 N N . GLY B 1 438 ? 13.908 -25.090 95.699 1.00 39.75 ? 438 GLY B N 1 +ATOM 9266 C CA . GLY B 1 438 ? 15.307 -25.480 95.688 1.00 38.12 ? 438 GLY B CA 1 +ATOM 9267 C C . GLY B 1 438 ? 16.359 -24.394 95.689 1.00 39.08 ? 438 GLY B C 1 +ATOM 9268 O O . GLY B 1 438 ? 17.553 -24.691 95.726 1.00 40.63 ? 438 GLY B O 1 +ATOM 9269 N N . VAL B 1 439 ? 15.949 -23.137 95.636 1.00 38.64 ? 439 VAL B N 1 +ATOM 9270 C CA . VAL B 1 439 ? 16.924 -22.049 95.661 1.00 38.87 ? 439 VAL B CA 1 +ATOM 9271 C C . VAL B 1 439 ? 16.751 -21.344 96.996 1.00 39.52 ? 439 VAL B C 1 +ATOM 9272 O O . VAL B 1 439 ? 15.882 -20.490 97.146 1.00 40.62 ? 439 VAL B O 1 +ATOM 9273 C CB . VAL B 1 439 ? 16.683 -21.055 94.521 1.00 38.83 ? 439 VAL B CB 1 +ATOM 9274 C CG1 . VAL B 1 439 ? 17.816 -20.056 94.472 1.00 38.95 ? 439 VAL B CG1 1 +ATOM 9275 C CG2 . VAL B 1 439 ? 16.565 -21.805 93.198 1.00 37.79 ? 439 VAL B CG2 1 +ATOM 9276 N N . PRO B 1 440 ? 17.588 -21.697 97.987 1.00 39.84 ? 440 PRO B N 1 +ATOM 9277 C CA . PRO B 1 440 ? 17.546 -21.130 99.337 1.00 38.61 ? 440 PRO B CA 1 +ATOM 9278 C C . PRO B 1 440 ? 18.039 -19.707 99.561 1.00 38.06 ? 440 PRO B C 1 +ATOM 9279 O O . PRO B 1 440 ? 17.433 -18.956 100.324 1.00 38.66 ? 440 PRO B O 1 +ATOM 9280 C CB . PRO B 1 440 ? 18.351 -22.142 100.144 1.00 38.83 ? 440 PRO B CB 1 +ATOM 9281 C CG . PRO B 1 440 ? 19.427 -22.510 99.175 1.00 39.06 ? 440 PRO B CG 1 +ATOM 9282 C CD . PRO B 1 440 ? 18.661 -22.705 97.878 1.00 38.38 ? 440 PRO B CD 1 +ATOM 9283 N N . PHE B 1 441 ? 19.138 -19.330 98.920 1.00 36.99 ? 441 PHE B N 1 +ATOM 9284 C CA . PHE B 1 441 ? 19.679 -17.998 99.128 1.00 36.38 ? 441 PHE B CA 1 +ATOM 9285 C C . PHE B 1 441 ? 19.081 -16.980 98.182 1.00 37.76 ? 441 PHE B C 1 +ATOM 9286 O O . PHE B 1 441 ? 19.546 -16.792 97.052 1.00 38.91 ? 441 PHE B O 1 +ATOM 9287 C CB . PHE B 1 441 ? 21.197 -18.063 99.024 1.00 37.40 ? 441 PHE B CB 1 +ATOM 9288 C CG . PHE B 1 441 ? 21.791 -19.157 99.870 1.00 38.80 ? 441 PHE B CG 1 +ATOM 9289 C CD1 . PHE B 1 441 ? 21.270 -19.422 101.137 1.00 38.98 ? 441 PHE B CD1 1 +ATOM 9290 C CD2 . PHE B 1 441 ? 22.848 -19.932 99.408 1.00 39.18 ? 441 PHE B CD2 1 +ATOM 9291 C CE1 . PHE B 1 441 ? 21.787 -20.442 101.929 1.00 39.83 ? 441 PHE B CE1 1 +ATOM 9292 C CE2 . PHE B 1 441 ? 23.379 -20.960 100.193 1.00 39.30 ? 441 PHE B CE2 1 +ATOM 9293 C CZ . PHE B 1 441 ? 22.844 -21.216 101.457 1.00 40.07 ? 441 PHE B CZ 1 +ATOM 9294 N N . VAL B 1 442 ? 18.037 -16.317 98.674 1.00 38.20 ? 442 VAL B N 1 +ATOM 9295 C CA . VAL B 1 442 ? 17.305 -15.332 97.893 1.00 37.48 ? 442 VAL B CA 1 +ATOM 9296 C C . VAL B 1 442 ? 17.030 -14.034 98.657 1.00 38.84 ? 442 VAL B C 1 +ATOM 9297 O O . VAL B 1 442 ? 17.198 -13.962 99.876 1.00 38.83 ? 442 VAL B O 1 +ATOM 9298 C CB . VAL B 1 442 ? 15.964 -15.935 97.448 1.00 37.34 ? 442 VAL B CB 1 +ATOM 9299 C CG1 . VAL B 1 442 ? 16.209 -17.174 96.601 1.00 36.15 ? 442 VAL B CG1 1 +ATOM 9300 C CG2 . VAL B 1 442 ? 15.146 -16.324 98.670 1.00 34.64 ? 442 VAL B CG2 1 +ATOM 9301 N N . GLY B 1 443 ? 16.600 -13.015 97.919 1.00 39.71 ? 443 GLY B N 1 +ATOM 9302 C CA . GLY B 1 443 ? 16.282 -11.728 98.504 1.00 39.97 ? 443 GLY B CA 1 +ATOM 9303 C C . GLY B 1 443 ? 15.673 -10.840 97.437 1.00 41.53 ? 443 GLY B C 1 +ATOM 9304 O O . GLY B 1 443 ? 15.470 -11.273 96.302 1.00 41.19 ? 443 GLY B O 1 +ATOM 9305 N N . CYS B 1 444 ? 15.373 -9.598 97.797 1.00 42.84 ? 444 CYS B N 1 +ATOM 9306 C CA . CYS B 1 444 ? 14.807 -8.646 96.855 1.00 43.72 ? 444 CYS B CA 1 +ATOM 9307 C C . CYS B 1 444 ? 15.465 -7.307 97.146 1.00 44.65 ? 444 CYS B C 1 +ATOM 9308 O O . CYS B 1 444 ? 16.098 -7.149 98.195 1.00 45.45 ? 444 CYS B O 1 +ATOM 9309 C CB . CYS B 1 444 ? 13.299 -8.533 97.055 1.00 45.33 ? 444 CYS B CB 1 +ATOM 9310 S SG . CYS B 1 444 ? 12.828 -7.708 98.583 1.00 50.91 ? 444 CYS B SG 1 +ATOM 9311 N N . ASP B 1 445 ? 15.332 -6.350 96.228 1.00 44.43 ? 445 ASP B N 1 +ATOM 9312 C CA . ASP B 1 445 ? 15.929 -5.035 96.437 1.00 45.40 ? 445 ASP B CA 1 +ATOM 9313 C C . ASP B 1 445 ? 15.120 -4.272 97.469 1.00 44.76 ? 445 ASP B C 1 +ATOM 9314 O O . ASP B 1 445 ? 13.963 -3.911 97.222 1.00 46.46 ? 445 ASP B O 1 +ATOM 9315 C CB . ASP B 1 445 ? 15.993 -4.220 95.133 1.00 48.17 ? 445 ASP B CB 1 +ATOM 9316 C CG . ASP B 1 445 ? 17.022 -4.776 94.132 1.00 52.46 ? 445 ASP B CG 1 +ATOM 9317 O OD1 . ASP B 1 445 ? 18.045 -5.361 94.566 1.00 52.04 ? 445 ASP B OD1 1 +ATOM 9318 O OD2 . ASP B 1 445 ? 16.813 -4.612 92.905 1.00 53.71 ? 445 ASP B OD2 1 +ATOM 9319 N N . ILE B 1 446 ? 15.723 -4.042 98.630 1.00 42.05 ? 446 ILE B N 1 +ATOM 9320 C CA . ILE B 1 446 ? 15.053 -3.321 99.703 1.00 40.99 ? 446 ILE B CA 1 +ATOM 9321 C C . ILE B 1 446 ? 14.795 -1.890 99.248 1.00 39.58 ? 446 ILE B C 1 +ATOM 9322 O O . ILE B 1 446 ? 15.714 -1.178 98.850 1.00 38.62 ? 446 ILE B O 1 +ATOM 9323 C CB . ILE B 1 446 ? 15.913 -3.323 100.985 1.00 40.54 ? 446 ILE B CB 1 +ATOM 9324 C CG1 . ILE B 1 446 ? 16.077 -4.759 101.479 1.00 40.16 ? 446 ILE B CG1 1 +ATOM 9325 C CG2 . ILE B 1 446 ? 15.273 -2.466 102.060 1.00 39.16 ? 446 ILE B CG2 1 +ATOM 9326 C CD1 . ILE B 1 446 ? 17.042 -4.881 102.630 1.00 42.46 ? 446 ILE B CD1 1 +ATOM 9327 N N . GLY B 1 447 ? 13.534 -1.477 99.302 1.00 39.30 ? 447 GLY B N 1 +ATOM 9328 C CA . GLY B 1 447 ? 13.189 -0.133 98.866 1.00 37.93 ? 447 GLY B CA 1 +ATOM 9329 C C . GLY B 1 447 ? 12.752 -0.103 97.409 1.00 37.04 ? 447 GLY B C 1 +ATOM 9330 O O . GLY B 1 447 ? 12.312 0.931 96.913 1.00 37.22 ? 447 GLY B O 1 +ATOM 9331 N N . GLY B 1 448 ? 12.872 -1.236 96.719 1.00 36.48 ? 448 GLY B N 1 +ATOM 9332 C CA . GLY B 1 448 ? 12.475 -1.296 95.321 1.00 36.26 ? 448 GLY B CA 1 +ATOM 9333 C C . GLY B 1 448 ? 13.497 -0.691 94.373 1.00 35.36 ? 448 GLY B C 1 +ATOM 9334 O O . GLY B 1 448 ? 14.097 0.353 94.651 1.00 34.89 ? 448 GLY B O 1 +ATOM 9335 N N . PHE B 1 449 ? 13.689 -1.345 93.234 1.00 34.64 ? 449 PHE B N 1 +ATOM 9336 C CA . PHE B 1 449 ? 14.643 -0.871 92.241 1.00 33.95 ? 449 PHE B CA 1 +ATOM 9337 C C . PHE B 1 449 ? 14.214 0.384 91.467 1.00 34.35 ? 449 PHE B C 1 +ATOM 9338 O O . PHE B 1 449 ? 14.970 1.359 91.396 1.00 33.15 ? 449 PHE B O 1 +ATOM 9339 C CB . PHE B 1 449 ? 14.940 -1.983 91.240 1.00 32.79 ? 449 PHE B CB 1 +ATOM 9340 C CG . PHE B 1 449 ? 15.749 -1.531 90.067 1.00 31.80 ? 449 PHE B CG 1 +ATOM 9341 C CD1 . PHE B 1 449 ? 17.110 -1.255 90.207 1.00 32.35 ? 449 PHE B CD1 1 +ATOM 9342 C CD2 . PHE B 1 449 ? 15.145 -1.353 88.825 1.00 30.76 ? 449 PHE B CD2 1 +ATOM 9343 C CE1 . PHE B 1 449 ? 17.869 -0.801 89.117 1.00 33.13 ? 449 PHE B CE1 1 +ATOM 9344 C CE2 . PHE B 1 449 ? 15.883 -0.902 87.724 1.00 31.91 ? 449 PHE B CE2 1 +ATOM 9345 C CZ . PHE B 1 449 ? 17.252 -0.623 87.866 1.00 33.15 ? 449 PHE B CZ 1 +ATOM 9346 N N . GLN B 1 450 ? 13.014 0.353 90.884 1.00 34.18 ? 450 GLN B N 1 +ATOM 9347 C CA . GLN B 1 450 ? 12.512 1.471 90.080 1.00 34.40 ? 450 GLN B CA 1 +ATOM 9348 C C . GLN B 1 450 ? 12.631 2.835 90.760 1.00 35.00 ? 450 GLN B C 1 +ATOM 9349 O O . GLN B 1 450 ? 12.314 2.987 91.937 1.00 35.34 ? 450 GLN B O 1 +ATOM 9350 C CB . GLN B 1 450 ? 11.059 1.222 89.676 1.00 33.58 ? 450 GLN B CB 1 +ATOM 9351 C CG . GLN B 1 450 ? 10.823 -0.095 88.944 1.00 33.44 ? 450 GLN B CG 1 +ATOM 9352 C CD . GLN B 1 450 ? 11.580 -0.213 87.628 1.00 34.12 ? 450 GLN B CD 1 +ATOM 9353 O OE1 . GLN B 1 450 ? 11.850 0.790 86.957 1.00 36.39 ? 450 GLN B OE1 1 +ATOM 9354 N NE2 . GLN B 1 450 ? 11.901 -1.448 87.234 1.00 31.56 ? 450 GLN B NE2 1 +ATOM 9355 N N . GLY B 1 451 ? 13.081 3.825 89.996 1.00 35.97 ? 451 GLY B N 1 +ATOM 9356 C CA . GLY B 1 451 ? 13.266 5.158 90.530 1.00 37.74 ? 451 GLY B CA 1 +ATOM 9357 C C . GLY B 1 451 ? 12.096 6.112 90.382 1.00 38.71 ? 451 GLY B C 1 +ATOM 9358 O O . GLY B 1 451 ? 11.194 6.123 91.213 1.00 39.74 ? 451 GLY B O 1 +ATOM 9359 N N . ARG B 1 452 ? 12.121 6.936 89.341 1.00 39.23 ? 452 ARG B N 1 +ATOM 9360 C CA . ARG B 1 452 ? 11.045 7.895 89.104 1.00 39.50 ? 452 ARG B CA 1 +ATOM 9361 C C . ARG B 1 452 ? 10.794 8.067 87.611 1.00 39.80 ? 452 ARG B C 1 +ATOM 9362 O O . ARG B 1 452 ? 10.608 9.185 87.136 1.00 40.62 ? 452 ARG B O 1 +ATOM 9363 C CB . ARG B 1 452 ? 11.398 9.252 89.711 1.00 37.53 ? 452 ARG B CB 1 +ATOM 9364 C CG . ARG B 1 452 ? 11.486 9.252 91.215 1.00 38.59 ? 452 ARG B CG 1 +ATOM 9365 C CD . ARG B 1 452 ? 12.831 9.766 91.628 1.00 39.96 ? 452 ARG B CD 1 +ATOM 9366 N NE . ARG B 1 452 ? 12.744 11.080 92.234 1.00 40.21 ? 452 ARG B NE 1 +ATOM 9367 C CZ . ARG B 1 452 ? 13.757 11.932 92.303 1.00 39.10 ? 452 ARG B CZ 1 +ATOM 9368 N NH1 . ARG B 1 452 ? 14.943 11.609 91.792 1.00 38.17 ? 452 ARG B NH1 1 +ATOM 9369 N NH2 . ARG B 1 452 ? 13.578 13.104 92.893 1.00 39.15 ? 452 ARG B NH2 1 +ATOM 9370 N N . ASN B 1 453 ? 10.803 6.965 86.871 1.00 40.11 ? 453 ASN B N 1 +ATOM 9371 C CA . ASN B 1 453 ? 10.577 7.043 85.438 1.00 42.35 ? 453 ASN B CA 1 +ATOM 9372 C C . ASN B 1 453 ? 9.115 6.826 85.056 1.00 42.38 ? 453 ASN B C 1 +ATOM 9373 O O . ASN B 1 453 ? 8.782 6.820 83.874 1.00 42.98 ? 453 ASN B O 1 +ATOM 9374 C CB . ASN B 1 453 ? 11.498 6.067 84.694 1.00 43.72 ? 453 ASN B CB 1 +ATOM 9375 C CG . ASN B 1 453 ? 11.438 4.662 85.252 1.00 47.74 ? 453 ASN B CG 1 +ATOM 9376 O OD1 . ASN B 1 453 ? 11.631 4.447 86.455 1.00 51.01 ? 453 ASN B OD1 1 +ATOM 9377 N ND2 . ASN B 1 453 ? 11.182 3.689 84.379 1.00 49.65 ? 453 ASN B ND2 1 +ATOM 9378 N N . PHE B 1 454 ? 8.253 6.637 86.056 1.00 41.45 ? 454 PHE B N 1 +ATOM 9379 C CA . PHE B 1 454 ? 6.815 6.490 85.832 1.00 40.49 ? 454 PHE B CA 1 +ATOM 9380 C C . PHE B 1 454 ? 6.042 6.727 87.125 1.00 41.11 ? 454 PHE B C 1 +ATOM 9381 O O . PHE B 1 454 ? 6.543 6.468 88.219 1.00 41.51 ? 454 PHE B O 1 +ATOM 9382 C CB . PHE B 1 454 ? 6.464 5.138 85.177 1.00 40.24 ? 454 PHE B CB 1 +ATOM 9383 C CG . PHE B 1 454 ? 6.805 3.934 85.997 1.00 40.06 ? 454 PHE B CG 1 +ATOM 9384 C CD1 . PHE B 1 454 ? 5.892 3.416 86.910 1.00 37.69 ? 454 PHE B CD1 1 +ATOM 9385 C CD2 . PHE B 1 454 ? 8.034 3.290 85.829 1.00 40.18 ? 454 PHE B CD2 1 +ATOM 9386 C CE1 . PHE B 1 454 ? 6.187 2.269 87.647 1.00 38.89 ? 454 PHE B CE1 1 +ATOM 9387 C CE2 . PHE B 1 454 ? 8.344 2.135 86.566 1.00 40.68 ? 454 PHE B CE2 1 +ATOM 9388 C CZ . PHE B 1 454 ? 7.416 1.625 87.476 1.00 39.03 ? 454 PHE B CZ 1 +ATOM 9389 N N . ALA B 1 455 ? 4.826 7.248 86.975 1.00 42.08 ? 455 ALA B N 1 +ATOM 9390 C CA . ALA B 1 455 ? 3.945 7.637 88.083 1.00 42.90 ? 455 ALA B CA 1 +ATOM 9391 C C . ALA B 1 455 ? 3.598 6.658 89.189 1.00 43.43 ? 455 ALA B C 1 +ATOM 9392 O O . ALA B 1 455 ? 3.485 7.052 90.345 1.00 44.89 ? 455 ALA B O 1 +ATOM 9393 C CB . ALA B 1 455 ? 2.642 8.214 87.511 1.00 41.99 ? 455 ALA B CB 1 +ATOM 9394 N N . GLU B 1 456 ? 3.405 5.395 88.841 1.00 45.14 ? 456 GLU B N 1 +ATOM 9395 C CA . GLU B 1 456 ? 3.017 4.393 89.820 1.00 46.36 ? 456 GLU B CA 1 +ATOM 9396 C C . GLU B 1 456 ? 4.144 3.895 90.717 1.00 46.95 ? 456 GLU B C 1 +ATOM 9397 O O . GLU B 1 456 ? 4.250 2.695 90.973 1.00 50.03 ? 456 GLU B O 1 +ATOM 9398 C CB . GLU B 1 456 ? 2.371 3.206 89.108 1.00 48.47 ? 456 GLU B CB 1 +ATOM 9399 C CG . GLU B 1 456 ? 1.157 3.563 88.231 1.00 51.48 ? 456 GLU B CG 1 +ATOM 9400 C CD . GLU B 1 456 ? 1.508 4.457 87.033 1.00 54.36 ? 456 GLU B CD 1 +ATOM 9401 O OE1 . GLU B 1 456 ? 2.577 4.244 86.417 1.00 54.22 ? 456 GLU B OE1 1 +ATOM 9402 O OE2 . GLU B 1 456 ? 0.707 5.364 86.694 1.00 56.11 ? 456 GLU B OE2 1 +ATOM 9403 N N . ILE B 1 457 ? 4.979 4.808 91.200 1.00 44.40 ? 457 ILE B N 1 +ATOM 9404 C CA . ILE B 1 457 ? 6.076 4.442 92.079 1.00 42.94 ? 457 ILE B CA 1 +ATOM 9405 C C . ILE B 1 457 ? 5.874 5.186 93.389 1.00 43.26 ? 457 ILE B C 1 +ATOM 9406 O O . ILE B 1 457 ? 5.624 6.391 93.390 1.00 43.54 ? 457 ILE B O 1 +ATOM 9407 C CB . ILE B 1 457 ? 7.444 4.833 91.471 1.00 42.66 ? 457 ILE B CB 1 +ATOM 9408 C CG1 . ILE B 1 457 ? 7.656 4.094 90.149 1.00 42.00 ? 457 ILE B CG1 1 +ATOM 9409 C CG2 . ILE B 1 457 ? 8.565 4.497 92.436 1.00 41.62 ? 457 ILE B CG2 1 +ATOM 9410 C CD1 . ILE B 1 457 ? 8.971 4.408 89.468 1.00 41.55 ? 457 ILE B CD1 1 +ATOM 9411 N N . ASP B 1 458 ? 5.974 4.466 94.502 1.00 42.97 ? 458 ASP B N 1 +ATOM 9412 C CA . ASP B 1 458 ? 5.787 5.062 95.825 1.00 42.96 ? 458 ASP B CA 1 +ATOM 9413 C C . ASP B 1 458 ? 7.103 5.153 96.603 1.00 41.25 ? 458 ASP B C 1 +ATOM 9414 O O . ASP B 1 458 ? 7.598 4.145 97.112 1.00 40.53 ? 458 ASP B O 1 +ATOM 9415 C CB . ASP B 1 458 ? 4.786 4.233 96.626 1.00 42.89 ? 458 ASP B CB 1 +ATOM 9416 C CG . ASP B 1 458 ? 4.394 4.895 97.927 1.00 44.33 ? 458 ASP B CG 1 +ATOM 9417 O OD1 . ASP B 1 458 ? 5.189 5.711 98.444 1.00 44.33 ? 458 ASP B OD1 1 +ATOM 9418 O OD2 . ASP B 1 458 ? 3.293 4.587 98.438 1.00 44.38 ? 458 ASP B OD2 1 +ATOM 9419 N N . ASN B 1 459 ? 7.655 6.357 96.707 1.00 40.40 ? 459 ASN B N 1 +ATOM 9420 C CA . ASN B 1 459 ? 8.917 6.544 97.426 1.00 42.50 ? 459 ASN B CA 1 +ATOM 9421 C C . ASN B 1 459 ? 8.785 7.073 98.852 1.00 41.71 ? 459 ASN B C 1 +ATOM 9422 O O . ASN B 1 459 ? 9.713 7.687 99.370 1.00 43.94 ? 459 ASN B O 1 +ATOM 9423 C CB . ASN B 1 459 ? 9.848 7.466 96.633 1.00 42.32 ? 459 ASN B CB 1 +ATOM 9424 C CG . ASN B 1 459 ? 10.320 6.835 95.342 1.00 45.77 ? 459 ASN B CG 1 +ATOM 9425 O OD1 . ASN B 1 459 ? 10.964 5.776 95.347 1.00 47.28 ? 459 ASN B OD1 1 +ATOM 9426 N ND2 . ASN B 1 459 ? 9.995 7.474 94.220 1.00 45.10 ? 459 ASN B ND2 1 +ATOM 9427 N N . SER B 1 460 ? 7.646 6.839 99.490 1.00 40.50 ? 460 SER B N 1 +ATOM 9428 C CA . SER B 1 460 ? 7.461 7.309 100.855 1.00 41.52 ? 460 SER B CA 1 +ATOM 9429 C C . SER B 1 460 ? 8.433 6.582 101.796 1.00 41.72 ? 460 SER B C 1 +ATOM 9430 O O . SER B 1 460 ? 8.771 5.409 101.585 1.00 42.19 ? 460 SER B O 1 +ATOM 9431 C CB . SER B 1 460 ? 6.014 7.084 101.298 1.00 40.97 ? 460 SER B CB 1 +ATOM 9432 O OG . SER B 1 460 ? 5.695 5.708 101.314 1.00 43.93 ? 460 SER B OG 1 +ATOM 9433 N N . MET B 1 461 ? 8.871 7.276 102.840 1.00 41.28 ? 461 MET B N 1 +ATOM 9434 C CA . MET B 1 461 ? 9.829 6.712 103.780 1.00 41.26 ? 461 MET B CA 1 +ATOM 9435 C C . MET B 1 461 ? 9.308 5.627 104.698 1.00 41.09 ? 461 MET B C 1 +ATOM 9436 O O . MET B 1 461 ? 10.067 4.739 105.093 1.00 42.14 ? 461 MET B O 1 +ATOM 9437 C CB . MET B 1 461 ? 10.464 7.829 104.595 1.00 41.62 ? 461 MET B CB 1 +ATOM 9438 C CG . MET B 1 461 ? 11.262 8.767 103.726 1.00 43.45 ? 461 MET B CG 1 +ATOM 9439 S SD . MET B 1 461 ? 11.881 10.170 104.613 1.00 48.07 ? 461 MET B SD 1 +ATOM 9440 C CE . MET B 1 461 ? 10.372 11.160 104.828 1.00 47.02 ? 461 MET B CE 1 +ATOM 9441 N N . ASP B 1 462 ? 8.032 5.672 105.053 1.00 40.89 ? 462 ASP B N 1 +ATOM 9442 C CA . ASP B 1 462 ? 7.511 4.623 105.917 1.00 42.45 ? 462 ASP B CA 1 +ATOM 9443 C C . ASP B 1 462 ? 7.395 3.305 105.132 1.00 41.66 ? 462 ASP B C 1 +ATOM 9444 O O . ASP B 1 462 ? 7.478 2.223 105.711 1.00 42.87 ? 462 ASP B O 1 +ATOM 9445 C CB . ASP B 1 462 ? 6.170 5.038 106.528 1.00 45.81 ? 462 ASP B CB 1 +ATOM 9446 C CG . ASP B 1 462 ? 5.093 5.253 105.491 1.00 52.28 ? 462 ASP B CG 1 +ATOM 9447 O OD1 . ASP B 1 462 ? 5.387 5.849 104.426 1.00 54.57 ? 462 ASP B OD1 1 +ATOM 9448 O OD2 . ASP B 1 462 ? 3.940 4.834 105.753 1.00 56.80 ? 462 ASP B OD2 1 +ATOM 9449 N N . LEU B 1 463 ? 7.226 3.396 103.812 1.00 39.71 ? 463 LEU B N 1 +ATOM 9450 C CA . LEU B 1 463 ? 7.150 2.199 102.977 1.00 37.46 ? 463 LEU B CA 1 +ATOM 9451 C C . LEU B 1 463 ? 8.566 1.619 102.936 1.00 36.37 ? 463 LEU B C 1 +ATOM 9452 O O . LEU B 1 463 ? 8.756 0.404 103.024 1.00 36.70 ? 463 LEU B O 1 +ATOM 9453 C CB . LEU B 1 463 ? 6.722 2.552 101.547 1.00 37.38 ? 463 LEU B CB 1 +ATOM 9454 C CG . LEU B 1 463 ? 6.085 1.476 100.645 1.00 38.23 ? 463 LEU B CG 1 +ATOM 9455 C CD1 . LEU B 1 463 ? 6.383 1.836 99.193 1.00 36.43 ? 463 LEU B CD1 1 +ATOM 9456 C CD2 . LEU B 1 463 ? 6.603 0.079 100.958 1.00 35.95 ? 463 LEU B CD2 1 +ATOM 9457 N N . LEU B 1 464 ? 9.557 2.498 102.788 1.00 34.72 ? 464 LEU B N 1 +ATOM 9458 C CA . LEU B 1 464 ? 10.955 2.076 102.749 1.00 34.22 ? 464 LEU B CA 1 +ATOM 9459 C C . LEU B 1 464 ? 11.287 1.310 104.033 1.00 34.91 ? 464 LEU B C 1 +ATOM 9460 O O . LEU B 1 464 ? 11.929 0.258 103.997 1.00 34.66 ? 464 LEU B O 1 +ATOM 9461 C CB . LEU B 1 464 ? 11.875 3.292 102.618 1.00 33.87 ? 464 LEU B CB 1 +ATOM 9462 C CG . LEU B 1 464 ? 13.388 3.027 102.715 1.00 32.81 ? 464 LEU B CG 1 +ATOM 9463 C CD1 . LEU B 1 464 ? 13.840 2.104 101.598 1.00 30.87 ? 464 LEU B CD1 1 +ATOM 9464 C CD2 . LEU B 1 464 ? 14.140 4.339 102.642 1.00 30.06 ? 464 LEU B CD2 1 +ATOM 9465 N N . VAL B 1 465 ? 10.834 1.836 105.167 1.00 33.66 ? 465 VAL B N 1 +ATOM 9466 C CA . VAL B 1 465 ? 11.076 1.181 106.441 1.00 32.79 ? 465 VAL B CA 1 +ATOM 9467 C C . VAL B 1 465 ? 10.431 -0.193 106.437 1.00 33.70 ? 465 VAL B C 1 +ATOM 9468 O O . VAL B 1 465 ? 11.007 -1.149 106.959 1.00 35.61 ? 465 VAL B O 1 +ATOM 9469 C CB . VAL B 1 465 ? 10.525 2.021 107.618 1.00 31.56 ? 465 VAL B CB 1 +ATOM 9470 C CG1 . VAL B 1 465 ? 10.562 1.219 108.890 1.00 30.50 ? 465 VAL B CG1 1 +ATOM 9471 C CG2 . VAL B 1 465 ? 11.349 3.293 107.773 1.00 29.03 ? 465 VAL B CG2 1 +ATOM 9472 N N . LYS B 1 466 ? 9.243 -0.305 105.844 1.00 33.87 ? 466 LYS B N 1 +ATOM 9473 C CA . LYS B 1 466 ? 8.569 -1.603 105.787 1.00 34.49 ? 466 LYS B CA 1 +ATOM 9474 C C . LYS B 1 466 ? 9.332 -2.615 104.942 1.00 32.84 ? 466 LYS B C 1 +ATOM 9475 O O . LYS B 1 466 ? 9.224 -3.816 105.170 1.00 33.38 ? 466 LYS B O 1 +ATOM 9476 C CB . LYS B 1 466 ? 7.154 -1.466 105.240 1.00 35.75 ? 466 LYS B CB 1 +ATOM 9477 C CG . LYS B 1 466 ? 6.214 -0.747 106.169 1.00 38.67 ? 466 LYS B CG 1 +ATOM 9478 C CD . LYS B 1 466 ? 6.161 -1.410 107.519 1.00 39.74 ? 466 LYS B CD 1 +ATOM 9479 C CE . LYS B 1 466 ? 5.162 -0.706 108.425 1.00 42.47 ? 466 LYS B CE 1 +ATOM 9480 N NZ . LYS B 1 466 ? 5.212 -1.258 109.809 1.00 46.47 ? 466 LYS B NZ 1 +ATOM 9481 N N . TYR B 1 467 ? 10.092 -2.136 103.961 1.00 32.70 ? 467 TYR B N 1 +ATOM 9482 C CA . TYR B 1 467 ? 10.882 -3.041 103.118 1.00 34.04 ? 467 TYR B CA 1 +ATOM 9483 C C . TYR B 1 467 ? 12.007 -3.650 103.956 1.00 34.49 ? 467 TYR B C 1 +ATOM 9484 O O . TYR B 1 467 ? 12.249 -4.858 103.912 1.00 34.30 ? 467 TYR B O 1 +ATOM 9485 C CB . TYR B 1 467 ? 11.487 -2.285 101.939 1.00 34.46 ? 467 TYR B CB 1 +ATOM 9486 C CG . TYR B 1 467 ? 10.685 -2.366 100.665 1.00 35.16 ? 467 TYR B CG 1 +ATOM 9487 C CD1 . TYR B 1 467 ? 10.733 -3.504 99.851 1.00 34.76 ? 467 TYR B CD1 1 +ATOM 9488 C CD2 . TYR B 1 467 ? 9.874 -1.301 100.271 1.00 36.96 ? 467 TYR B CD2 1 +ATOM 9489 C CE1 . TYR B 1 467 ? 9.987 -3.575 98.670 1.00 36.32 ? 467 TYR B CE1 1 +ATOM 9490 C CE2 . TYR B 1 467 ? 9.126 -1.356 99.096 1.00 36.87 ? 467 TYR B CE2 1 +ATOM 9491 C CZ . TYR B 1 467 ? 9.184 -2.491 98.302 1.00 37.29 ? 467 TYR B CZ 1 +ATOM 9492 O OH . TYR B 1 467 ? 8.430 -2.536 97.154 1.00 38.05 ? 467 TYR B OH 1 +ATOM 9493 N N . TYR B 1 468 ? 12.691 -2.800 104.719 1.00 34.29 ? 468 TYR B N 1 +ATOM 9494 C CA . TYR B 1 468 ? 13.770 -3.246 105.589 1.00 33.57 ? 468 TYR B CA 1 +ATOM 9495 C C . TYR B 1 468 ? 13.246 -4.291 106.566 1.00 33.39 ? 468 TYR B C 1 +ATOM 9496 O O . TYR B 1 468 ? 13.907 -5.300 106.836 1.00 32.66 ? 468 TYR B O 1 +ATOM 9497 C CB . TYR B 1 468 ? 14.341 -2.057 106.352 1.00 32.06 ? 468 TYR B CB 1 +ATOM 9498 C CG . TYR B 1 468 ? 15.439 -1.344 105.612 1.00 32.10 ? 468 TYR B CG 1 +ATOM 9499 C CD1 . TYR B 1 468 ? 16.751 -1.833 105.629 1.00 32.35 ? 468 TYR B CD1 1 +ATOM 9500 C CD2 . TYR B 1 468 ? 15.176 -0.189 104.879 1.00 31.45 ? 468 TYR B CD2 1 +ATOM 9501 C CE1 . TYR B 1 468 ? 17.777 -1.186 104.932 1.00 30.85 ? 468 TYR B CE1 1 +ATOM 9502 C CE2 . TYR B 1 468 ? 16.191 0.464 104.179 1.00 31.20 ? 468 TYR B CE2 1 +ATOM 9503 C CZ . TYR B 1 468 ? 17.488 -0.042 104.211 1.00 32.03 ? 468 TYR B CZ 1 +ATOM 9504 O OH . TYR B 1 468 ? 18.491 0.595 103.519 1.00 34.22 ? 468 TYR B OH 1 +ATOM 9505 N N . ALA B 1 469 ? 12.043 -4.046 107.077 1.00 33.23 ? 469 ALA B N 1 +ATOM 9506 C CA . ALA B 1 469 ? 11.413 -4.956 108.025 1.00 33.56 ? 469 ALA B CA 1 +ATOM 9507 C C . ALA B 1 469 ? 10.931 -6.240 107.367 1.00 33.76 ? 469 ALA B C 1 +ATOM 9508 O O . ALA B 1 469 ? 10.976 -7.315 107.970 1.00 35.80 ? 469 ALA B O 1 +ATOM 9509 C CB . ALA B 1 469 ? 10.244 -4.263 108.711 1.00 31.87 ? 469 ALA B CB 1 +ATOM 9510 N N . LEU B 1 470 ? 10.461 -6.131 106.131 1.00 33.85 ? 470 LEU B N 1 +ATOM 9511 C CA . LEU B 1 470 ? 9.951 -7.295 105.414 1.00 34.86 ? 470 LEU B CA 1 +ATOM 9512 C C . LEU B 1 470 ? 11.026 -8.347 105.188 1.00 35.62 ? 470 LEU B C 1 +ATOM 9513 O O . LEU B 1 470 ? 10.798 -9.542 105.392 1.00 35.41 ? 470 LEU B O 1 +ATOM 9514 C CB . LEU B 1 470 ? 9.390 -6.877 104.055 1.00 34.87 ? 470 LEU B CB 1 +ATOM 9515 C CG . LEU B 1 470 ? 8.961 -8.055 103.174 1.00 35.77 ? 470 LEU B CG 1 +ATOM 9516 C CD1 . LEU B 1 470 ? 7.642 -8.608 103.685 1.00 34.98 ? 470 LEU B CD1 1 +ATOM 9517 C CD2 . LEU B 1 470 ? 8.829 -7.599 101.726 1.00 35.38 ? 470 LEU B CD2 1 +ATOM 9518 N N . ALA B 1 471 ? 12.196 -7.881 104.758 1.00 35.62 ? 471 ALA B N 1 +ATOM 9519 C CA . ALA B 1 471 ? 13.323 -8.745 104.461 1.00 36.44 ? 471 ALA B CA 1 +ATOM 9520 C C . ALA B 1 471 ? 14.221 -9.013 105.666 1.00 37.28 ? 471 ALA B C 1 +ATOM 9521 O O . ALA B 1 471 ? 15.333 -9.520 105.503 1.00 37.55 ? 471 ALA B O 1 +ATOM 9522 C CB . ALA B 1 471 ? 14.138 -8.130 103.339 1.00 34.47 ? 471 ALA B CB 1 +ATOM 9523 N N . LEU B 1 472 ? 13.741 -8.676 106.861 1.00 37.00 ? 472 LEU B N 1 +ATOM 9524 C CA . LEU B 1 472 ? 14.511 -8.879 108.091 1.00 37.79 ? 472 LEU B CA 1 +ATOM 9525 C C . LEU B 1 472 ? 15.232 -10.226 108.134 1.00 37.69 ? 472 LEU B C 1 +ATOM 9526 O O . LEU B 1 472 ? 16.405 -10.299 108.493 1.00 37.68 ? 472 LEU B O 1 +ATOM 9527 C CB . LEU B 1 472 ? 13.590 -8.757 109.316 1.00 37.64 ? 472 LEU B CB 1 +ATOM 9528 C CG . LEU B 1 472 ? 14.224 -9.021 110.686 1.00 37.22 ? 472 LEU B CG 1 +ATOM 9529 C CD1 . LEU B 1 472 ? 15.419 -8.104 110.882 1.00 36.48 ? 472 LEU B CD1 1 +ATOM 9530 C CD2 . LEU B 1 472 ? 13.200 -8.802 111.777 1.00 33.58 ? 472 LEU B CD2 1 +ATOM 9531 N N . PHE B 1 473 ? 14.533 -11.289 107.753 1.00 38.16 ? 473 PHE B N 1 +ATOM 9532 C CA . PHE B 1 473 ? 15.120 -12.625 107.770 1.00 38.46 ? 473 PHE B CA 1 +ATOM 9533 C C . PHE B 1 473 ? 15.455 -13.231 106.401 1.00 38.64 ? 473 PHE B C 1 +ATOM 9534 O O . PHE B 1 473 ? 15.822 -14.400 106.317 1.00 39.26 ? 473 PHE B O 1 +ATOM 9535 C CB . PHE B 1 473 ? 14.201 -13.571 108.547 1.00 37.82 ? 473 PHE B CB 1 +ATOM 9536 C CG . PHE B 1 473 ? 14.052 -13.203 109.996 1.00 38.46 ? 473 PHE B CG 1 +ATOM 9537 C CD1 . PHE B 1 473 ? 15.113 -13.374 110.884 1.00 38.49 ? 473 PHE B CD1 1 +ATOM 9538 C CD2 . PHE B 1 473 ? 12.867 -12.655 110.468 1.00 37.74 ? 473 PHE B CD2 1 +ATOM 9539 C CE1 . PHE B 1 473 ? 14.994 -13.003 112.220 1.00 37.67 ? 473 PHE B CE1 1 +ATOM 9540 C CE2 . PHE B 1 473 ? 12.733 -12.280 111.802 1.00 38.17 ? 473 PHE B CE2 1 +ATOM 9541 C CZ . PHE B 1 473 ? 13.801 -12.454 112.683 1.00 39.42 ? 473 PHE B CZ 1 +ATOM 9542 N N . PHE B 1 474 ? 15.335 -12.456 105.329 1.00 38.42 ? 474 PHE B N 1 +ATOM 9543 C CA . PHE B 1 474 ? 15.672 -12.987 104.008 1.00 38.36 ? 474 PHE B CA 1 +ATOM 9544 C C . PHE B 1 474 ? 17.171 -13.267 104.005 1.00 37.97 ? 474 PHE B C 1 +ATOM 9545 O O . PHE B 1 474 ? 17.940 -12.553 104.646 1.00 38.82 ? 474 PHE B O 1 +ATOM 9546 C CB . PHE B 1 474 ? 15.370 -11.967 102.893 1.00 37.16 ? 474 PHE B CB 1 +ATOM 9547 C CG . PHE B 1 474 ? 13.901 -11.764 102.608 1.00 34.96 ? 474 PHE B CG 1 +ATOM 9548 C CD1 . PHE B 1 474 ? 12.921 -12.410 103.351 1.00 35.04 ? 474 PHE B CD1 1 +ATOM 9549 C CD2 . PHE B 1 474 ? 13.503 -10.903 101.589 1.00 35.67 ? 474 PHE B CD2 1 +ATOM 9550 C CE1 . PHE B 1 474 ? 11.562 -12.198 103.083 1.00 34.04 ? 474 PHE B CE1 1 +ATOM 9551 C CE2 . PHE B 1 474 ? 12.150 -10.684 101.313 1.00 33.69 ? 474 PHE B CE2 1 +ATOM 9552 C CZ . PHE B 1 474 ? 11.181 -11.334 102.063 1.00 33.30 ? 474 PHE B CZ 1 +ATOM 9553 N N . PRO B 1 475 ? 17.605 -14.317 103.296 1.00 37.62 ? 475 PRO B N 1 +ATOM 9554 C CA . PRO B 1 475 ? 19.035 -14.634 103.247 1.00 37.59 ? 475 PRO B CA 1 +ATOM 9555 C C . PRO B 1 475 ? 19.854 -13.485 102.667 1.00 39.01 ? 475 PRO B C 1 +ATOM 9556 O O . PRO B 1 475 ? 20.868 -13.071 103.243 1.00 40.87 ? 475 PRO B O 1 +ATOM 9557 C CB . PRO B 1 475 ? 19.076 -15.874 102.370 1.00 37.08 ? 475 PRO B CB 1 +ATOM 9558 C CG . PRO B 1 475 ? 17.803 -16.578 102.772 1.00 37.14 ? 475 PRO B CG 1 +ATOM 9559 C CD . PRO B 1 475 ? 16.802 -15.433 102.765 1.00 36.35 ? 475 PRO B CD 1 +ATOM 9560 N N . PHE B 1 476 ? 19.409 -12.968 101.526 1.00 38.70 ? 476 PHE B N 1 +ATOM 9561 C CA . PHE B 1 476 ? 20.098 -11.867 100.862 1.00 37.84 ? 476 PHE B CA 1 +ATOM 9562 C C . PHE B 1 476 ? 19.420 -10.543 101.237 1.00 39.74 ? 476 PHE B C 1 +ATOM 9563 O O . PHE B 1 476 ? 18.240 -10.323 100.926 1.00 42.41 ? 476 PHE B O 1 +ATOM 9564 C CB . PHE B 1 476 ? 20.075 -12.097 99.354 1.00 36.67 ? 476 PHE B CB 1 +ATOM 9565 C CG . PHE B 1 476 ? 20.910 -11.128 98.585 1.00 37.00 ? 476 PHE B CG 1 +ATOM 9566 C CD1 . PHE B 1 476 ? 22.272 -10.996 98.856 1.00 36.75 ? 476 PHE B CD1 1 +ATOM 9567 C CD2 . PHE B 1 476 ? 20.339 -10.336 97.589 1.00 36.41 ? 476 PHE B CD2 1 +ATOM 9568 C CE1 . PHE B 1 476 ? 23.060 -10.090 98.153 1.00 35.35 ? 476 PHE B CE1 1 +ATOM 9569 C CE2 . PHE B 1 476 ? 21.116 -9.424 96.875 1.00 37.61 ? 476 PHE B CE2 1 +ATOM 9570 C CZ . PHE B 1 476 ? 22.486 -9.302 97.161 1.00 37.05 ? 476 PHE B CZ 1 +ATOM 9571 N N . TYR B 1 477 ? 20.175 -9.666 101.902 1.00 38.83 ? 477 TYR B N 1 +ATOM 9572 C CA . TYR B 1 477 ? 19.669 -8.380 102.395 1.00 37.16 ? 477 TYR B CA 1 +ATOM 9573 C C . TYR B 1 477 ? 20.393 -7.199 101.742 1.00 38.23 ? 477 TYR B C 1 +ATOM 9574 O O . TYR B 1 477 ? 21.389 -6.697 102.273 1.00 38.21 ? 477 TYR B O 1 +ATOM 9575 C CB . TYR B 1 477 ? 19.887 -8.338 103.907 1.00 36.26 ? 477 TYR B CB 1 +ATOM 9576 C CG . TYR B 1 477 ? 19.008 -7.387 104.676 1.00 34.44 ? 477 TYR B CG 1 +ATOM 9577 C CD1 . TYR B 1 477 ? 17.663 -7.690 104.917 1.00 33.54 ? 477 TYR B CD1 1 +ATOM 9578 C CD2 . TYR B 1 477 ? 19.528 -6.209 105.208 1.00 33.59 ? 477 TYR B CD2 1 +ATOM 9579 C CE1 . TYR B 1 477 ? 16.856 -6.841 105.678 1.00 33.24 ? 477 TYR B CE1 1 +ATOM 9580 C CE2 . TYR B 1 477 ? 18.737 -5.350 105.969 1.00 34.08 ? 477 TYR B CE2 1 +ATOM 9581 C CZ . TYR B 1 477 ? 17.402 -5.672 106.202 1.00 34.78 ? 477 TYR B CZ 1 +ATOM 9582 O OH . TYR B 1 477 ? 16.624 -4.829 106.970 1.00 35.51 ? 477 TYR B OH 1 +ATOM 9583 N N . ARG B 1 478 ? 19.881 -6.740 100.604 1.00 38.75 ? 478 ARG B N 1 +ATOM 9584 C CA . ARG B 1 478 ? 20.517 -5.643 99.885 1.00 39.03 ? 478 ARG B CA 1 +ATOM 9585 C C . ARG B 1 478 ? 19.579 -4.508 99.478 1.00 40.08 ? 478 ARG B C 1 +ATOM 9586 O O . ARG B 1 478 ? 18.443 -4.737 99.065 1.00 40.18 ? 478 ARG B O 1 +ATOM 9587 C CB . ARG B 1 478 ? 21.202 -6.178 98.624 1.00 38.31 ? 478 ARG B CB 1 +ATOM 9588 C CG . ARG B 1 478 ? 21.866 -5.087 97.795 1.00 39.60 ? 478 ARG B CG 1 +ATOM 9589 C CD . ARG B 1 478 ? 22.424 -5.612 96.481 1.00 40.85 ? 478 ARG B CD 1 +ATOM 9590 N NE . ARG B 1 478 ? 21.373 -5.993 95.541 1.00 41.79 ? 478 ARG B NE 1 +ATOM 9591 C CZ . ARG B 1 478 ? 21.526 -5.998 94.217 1.00 45.05 ? 478 ARG B CZ 1 +ATOM 9592 N NH1 . ARG B 1 478 ? 22.690 -5.637 93.681 1.00 44.93 ? 478 ARG B NH1 1 +ATOM 9593 N NH2 . ARG B 1 478 ? 20.516 -6.357 93.423 1.00 44.89 ? 478 ARG B NH2 1 +ATOM 9594 N N . SER B 1 479 ? 20.079 -3.283 99.605 1.00 40.21 ? 479 SER B N 1 +ATOM 9595 C CA . SER B 1 479 ? 19.351 -2.090 99.221 1.00 38.88 ? 479 SER B CA 1 +ATOM 9596 C C . SER B 1 479 ? 19.920 -1.710 97.856 1.00 40.41 ? 479 SER B C 1 +ATOM 9597 O O . SER B 1 479 ? 21.135 -1.513 97.706 1.00 40.66 ? 479 SER B O 1 +ATOM 9598 C CB . SER B 1 479 ? 19.617 -0.966 100.209 1.00 40.95 ? 479 SER B CB 1 +ATOM 9599 O OG . SER B 1 479 ? 19.059 0.250 99.730 1.00 45.74 ? 479 SER B OG 1 +ATOM 9600 N N . HIS B 1 480 ? 19.052 -1.617 96.856 1.00 39.87 ? 480 HIS B N 1 +ATOM 9601 C CA . HIS B 1 480 ? 19.489 -1.282 95.506 1.00 39.27 ? 480 HIS B CA 1 +ATOM 9602 C C . HIS B 1 480 ? 18.447 -0.350 94.904 1.00 39.36 ? 480 HIS B C 1 +ATOM 9603 O O . HIS B 1 480 ? 17.251 -0.528 95.128 1.00 41.58 ? 480 HIS B O 1 +ATOM 9604 C CB . HIS B 1 480 ? 19.627 -2.568 94.685 1.00 37.55 ? 480 HIS B CB 1 +ATOM 9605 C CG . HIS B 1 480 ? 20.180 -2.358 93.310 1.00 39.71 ? 480 HIS B CG 1 +ATOM 9606 N ND1 . HIS B 1 480 ? 21.333 -1.640 93.071 1.00 39.98 ? 480 HIS B ND1 1 +ATOM 9607 C CD2 . HIS B 1 480 ? 19.764 -2.813 92.103 1.00 39.55 ? 480 HIS B CD2 1 +ATOM 9608 C CE1 . HIS B 1 480 ? 21.606 -1.664 91.777 1.00 40.52 ? 480 HIS B CE1 1 +ATOM 9609 N NE2 . HIS B 1 480 ? 20.669 -2.370 91.168 1.00 40.55 ? 480 HIS B NE2 1 +ATOM 9610 N N . LYS B 1 481 ? 18.896 0.643 94.145 1.00 38.78 ? 481 LYS B N 1 +ATOM 9611 C CA . LYS B 1 481 ? 17.985 1.618 93.554 1.00 37.00 ? 481 LYS B CA 1 +ATOM 9612 C C . LYS B 1 481 ? 18.468 2.064 92.171 1.00 37.76 ? 481 LYS B C 1 +ATOM 9613 O O . LYS B 1 481 ? 19.682 2.106 91.907 1.00 38.35 ? 481 LYS B O 1 +ATOM 9614 C CB . LYS B 1 481 ? 17.875 2.821 94.498 1.00 36.44 ? 481 LYS B CB 1 +ATOM 9615 C CG . LYS B 1 481 ? 17.094 3.999 93.975 1.00 38.95 ? 481 LYS B CG 1 +ATOM 9616 C CD . LYS B 1 481 ? 15.610 3.673 93.804 1.00 41.86 ? 481 LYS B CD 1 +ATOM 9617 C CE . LYS B 1 481 ? 14.889 3.523 95.132 1.00 40.75 ? 481 LYS B CE 1 +ATOM 9618 N NZ . LYS B 1 481 ? 13.428 3.285 94.916 1.00 43.31 ? 481 LYS B NZ 1 +ATOM 9619 N N . ALA B 1 482 ? 17.516 2.390 91.293 1.00 36.07 ? 482 ALA B N 1 +ATOM 9620 C CA . ALA B 1 482 ? 17.827 2.833 89.933 1.00 35.66 ? 482 ALA B CA 1 +ATOM 9621 C C . ALA B 1 482 ? 18.465 4.222 89.918 1.00 35.11 ? 482 ALA B C 1 +ATOM 9622 O O . ALA B 1 482 ? 18.389 4.964 90.892 1.00 34.79 ? 482 ALA B O 1 +ATOM 9623 C CB . ALA B 1 482 ? 16.567 2.822 89.076 1.00 34.21 ? 482 ALA B CB 1 +ATOM 9624 N N . THR B 1 483 ? 19.071 4.572 88.789 1.00 36.00 ? 483 THR B N 1 +ATOM 9625 C CA . THR B 1 483 ? 19.768 5.841 88.642 1.00 36.58 ? 483 THR B CA 1 +ATOM 9626 C C . THR B 1 483 ? 18.978 7.095 89.003 1.00 38.43 ? 483 THR B C 1 +ATOM 9627 O O . THR B 1 483 ? 19.487 7.970 89.696 1.00 39.16 ? 483 THR B O 1 +ATOM 9628 C CB . THR B 1 483 ? 20.299 6.014 87.203 1.00 35.16 ? 483 THR B CB 1 +ATOM 9629 O OG1 . THR B 1 483 ? 20.713 4.744 86.689 1.00 35.63 ? 483 THR B OG1 1 +ATOM 9630 C CG2 . THR B 1 483 ? 21.494 6.952 87.193 1.00 34.98 ? 483 THR B CG2 1 +ATOM 9631 N N . ASP B 1 484 ? 17.740 7.193 88.538 1.00 40.36 ? 484 ASP B N 1 +ATOM 9632 C CA . ASP B 1 484 ? 16.940 8.384 88.809 1.00 41.49 ? 484 ASP B CA 1 +ATOM 9633 C C . ASP B 1 484 ? 16.065 8.287 90.048 1.00 40.62 ? 484 ASP B C 1 +ATOM 9634 O O . ASP B 1 484 ? 15.178 9.112 90.258 1.00 40.90 ? 484 ASP B O 1 +ATOM 9635 C CB . ASP B 1 484 ? 16.081 8.731 87.583 1.00 43.75 ? 484 ASP B CB 1 +ATOM 9636 C CG . ASP B 1 484 ? 14.897 7.779 87.393 1.00 47.98 ? 484 ASP B CG 1 +ATOM 9637 O OD1 . ASP B 1 484 ? 15.001 6.573 87.729 1.00 50.28 ? 484 ASP B OD1 1 +ATOM 9638 O OD2 . ASP B 1 484 ? 13.854 8.243 86.880 1.00 51.03 ? 484 ASP B OD2 1 +ATOM 9639 N N . GLY B 1 485 ? 16.311 7.283 90.875 1.00 41.82 ? 485 GLY B N 1 +ATOM 9640 C CA . GLY B 1 485 ? 15.533 7.147 92.092 1.00 42.95 ? 485 GLY B CA 1 +ATOM 9641 C C . GLY B 1 485 ? 16.152 7.999 93.186 1.00 44.62 ? 485 GLY B C 1 +ATOM 9642 O O . GLY B 1 485 ? 17.338 8.326 93.130 1.00 44.11 ? 485 GLY B O 1 +ATOM 9643 N N . ILE B 1 486 ? 15.352 8.383 94.174 1.00 46.94 ? 486 ILE B N 1 +ATOM 9644 C CA . ILE B 1 486 ? 15.857 9.194 95.281 1.00 48.55 ? 486 ILE B CA 1 +ATOM 9645 C C . ILE B 1 486 ? 16.925 8.381 96.012 1.00 48.50 ? 486 ILE B C 1 +ATOM 9646 O O . ILE B 1 486 ? 16.956 7.157 95.888 1.00 47.70 ? 486 ILE B O 1 +ATOM 9647 C CB . ILE B 1 486 ? 14.723 9.530 96.288 1.00 49.54 ? 486 ILE B CB 1 +ATOM 9648 C CG1 . ILE B 1 486 ? 14.079 8.231 96.792 1.00 49.34 ? 486 ILE B CG1 1 +ATOM 9649 C CG2 . ILE B 1 486 ? 13.675 10.424 95.623 1.00 49.23 ? 486 ILE B CG2 1 +ATOM 9650 C CD1 . ILE B 1 486 ? 12.996 8.442 97.831 1.00 50.63 ? 486 ILE B CD1 1 +ATOM 9651 N N . ASP B 1 487 ? 17.804 9.054 96.753 1.00 49.23 ? 487 ASP B N 1 +ATOM 9652 C CA . ASP B 1 487 ? 18.838 8.357 97.519 1.00 50.38 ? 487 ASP B CA 1 +ATOM 9653 C C . ASP B 1 487 ? 18.130 7.620 98.655 1.00 50.11 ? 487 ASP B C 1 +ATOM 9654 O O . ASP B 1 487 ? 17.430 8.233 99.454 1.00 49.87 ? 487 ASP B O 1 +ATOM 9655 C CB . ASP B 1 487 ? 19.850 9.353 98.091 1.00 52.44 ? 487 ASP B CB 1 +ATOM 9656 C CG . ASP B 1 487 ? 20.771 9.930 97.025 1.00 55.50 ? 487 ASP B CG 1 +ATOM 9657 O OD1 . ASP B 1 487 ? 21.519 9.143 96.392 1.00 57.22 ? 487 ASP B OD1 1 +ATOM 9658 O OD2 . ASP B 1 487 ? 20.750 11.166 96.822 1.00 56.72 ? 487 ASP B OD2 1 +ATOM 9659 N N . THR B 1 488 ? 18.303 6.306 98.725 1.00 50.13 ? 488 THR B N 1 +ATOM 9660 C CA . THR B 1 488 ? 17.636 5.531 99.760 1.00 49.48 ? 488 THR B CA 1 +ATOM 9661 C C . THR B 1 488 ? 18.528 5.029 100.890 1.00 49.40 ? 488 THR B C 1 +ATOM 9662 O O . THR B 1 488 ? 18.068 4.258 101.736 1.00 49.37 ? 488 THR B O 1 +ATOM 9663 C CB . THR B 1 488 ? 16.886 4.325 99.153 1.00 49.03 ? 488 THR B CB 1 +ATOM 9664 O OG1 . THR B 1 488 ? 17.804 3.486 98.437 1.00 49.18 ? 488 THR B OG1 1 +ATOM 9665 C CG2 . THR B 1 488 ? 15.804 4.805 98.218 1.00 48.68 ? 488 THR B CG2 1 +ATOM 9666 N N . GLU B 1 489 ? 19.792 5.444 100.911 1.00 48.33 ? 489 GLU B N 1 +ATOM 9667 C CA . GLU B 1 489 ? 20.681 5.014 101.989 1.00 49.09 ? 489 GLU B CA 1 +ATOM 9668 C C . GLU B 1 489 ? 20.114 5.600 103.284 1.00 47.62 ? 489 GLU B C 1 +ATOM 9669 O O . GLU B 1 489 ? 19.649 6.739 103.306 1.00 46.27 ? 489 GLU B O 1 +ATOM 9670 C CB . GLU B 1 489 ? 22.117 5.526 101.774 1.00 51.61 ? 489 GLU B CB 1 +ATOM 9671 C CG . GLU B 1 489 ? 22.812 5.052 100.499 1.00 54.49 ? 489 GLU B CG 1 +ATOM 9672 C CD . GLU B 1 489 ? 22.173 5.608 99.231 1.00 57.86 ? 489 GLU B CD 1 +ATOM 9673 O OE1 . GLU B 1 489 ? 21.835 6.814 99.206 1.00 59.41 ? 489 GLU B OE1 1 +ATOM 9674 O OE2 . GLU B 1 489 ? 22.019 4.844 98.253 1.00 58.94 ? 489 GLU B OE2 1 +ATOM 9675 N N . PRO B 1 490 ? 20.144 4.825 104.378 1.00 48.06 ? 490 PRO B N 1 +ATOM 9676 C CA . PRO B 1 490 ? 19.639 5.232 105.696 1.00 47.43 ? 490 PRO B CA 1 +ATOM 9677 C C . PRO B 1 490 ? 20.195 6.563 106.213 1.00 47.18 ? 490 PRO B C 1 +ATOM 9678 O O . PRO B 1 490 ? 19.484 7.333 106.872 1.00 46.16 ? 490 PRO B O 1 +ATOM 9679 C CB . PRO B 1 490 ? 20.039 4.065 106.589 1.00 47.86 ? 490 PRO B CB 1 +ATOM 9680 C CG . PRO B 1 490 ? 19.997 2.903 105.660 1.00 49.54 ? 490 PRO B CG 1 +ATOM 9681 C CD . PRO B 1 490 ? 20.688 3.457 104.436 1.00 48.89 ? 490 PRO B CD 1 +ATOM 9682 N N . VAL B 1 491 ? 21.461 6.836 105.914 1.00 46.40 ? 491 VAL B N 1 +ATOM 9683 C CA . VAL B 1 491 ? 22.084 8.073 106.363 1.00 46.57 ? 491 VAL B CA 1 +ATOM 9684 C C . VAL B 1 491 ? 21.428 9.334 105.806 1.00 46.04 ? 491 VAL B C 1 +ATOM 9685 O O . VAL B 1 491 ? 21.677 10.430 106.309 1.00 46.71 ? 491 VAL B O 1 +ATOM 9686 C CB . VAL B 1 491 ? 23.591 8.114 106.009 1.00 47.25 ? 491 VAL B CB 1 +ATOM 9687 C CG1 . VAL B 1 491 ? 24.335 7.041 106.789 1.00 47.69 ? 491 VAL B CG1 1 +ATOM 9688 C CG2 . VAL B 1 491 ? 23.783 7.923 104.511 1.00 48.20 ? 491 VAL B CG2 1 +ATOM 9689 N N . PHE B 1 492 ? 20.595 9.187 104.779 1.00 45.07 ? 492 PHE B N 1 +ATOM 9690 C CA . PHE B 1 492 ? 19.916 10.339 104.177 1.00 44.87 ? 492 PHE B CA 1 +ATOM 9691 C C . PHE B 1 492 ? 18.477 10.512 104.662 1.00 45.15 ? 492 PHE B C 1 +ATOM 9692 O O . PHE B 1 492 ? 17.757 11.389 104.184 1.00 45.76 ? 492 PHE B O 1 +ATOM 9693 C CB . PHE B 1 492 ? 19.909 10.225 102.652 1.00 44.55 ? 492 PHE B CB 1 +ATOM 9694 C CG . PHE B 1 492 ? 21.282 10.222 102.035 1.00 46.79 ? 492 PHE B CG 1 +ATOM 9695 C CD1 . PHE B 1 492 ? 22.146 11.297 102.218 1.00 46.06 ? 492 PHE B CD1 1 +ATOM 9696 C CD2 . PHE B 1 492 ? 21.720 9.132 101.286 1.00 46.31 ? 492 PHE B CD2 1 +ATOM 9697 C CE1 . PHE B 1 492 ? 23.424 11.284 101.671 1.00 46.94 ? 492 PHE B CE1 1 +ATOM 9698 C CE2 . PHE B 1 492 ? 22.997 9.111 100.734 1.00 46.35 ? 492 PHE B CE2 1 +ATOM 9699 C CZ . PHE B 1 492 ? 23.851 10.189 100.929 1.00 46.64 ? 492 PHE B CZ 1 +ATOM 9700 N N . LEU B 1 493 ? 18.065 9.684 105.616 1.00 44.00 ? 493 LEU B N 1 +ATOM 9701 C CA . LEU B 1 493 ? 16.711 9.742 106.150 1.00 44.12 ? 493 LEU B CA 1 +ATOM 9702 C C . LEU B 1 493 ? 16.613 10.624 107.389 1.00 45.04 ? 493 LEU B C 1 +ATOM 9703 O O . LEU B 1 493 ? 17.589 10.804 108.114 1.00 47.01 ? 493 LEU B O 1 +ATOM 9704 C CB . LEU B 1 493 ? 16.243 8.334 106.534 1.00 44.08 ? 493 LEU B CB 1 +ATOM 9705 C CG . LEU B 1 493 ? 16.002 7.296 105.447 1.00 43.42 ? 493 LEU B CG 1 +ATOM 9706 C CD1 . LEU B 1 493 ? 15.853 5.927 106.084 1.00 42.95 ? 493 LEU B CD1 1 +ATOM 9707 C CD2 . LEU B 1 493 ? 14.753 7.681 104.661 1.00 44.11 ? 493 LEU B CD2 1 +ATOM 9708 N N . PRO B 1 494 ? 15.430 11.202 107.642 1.00 44.75 ? 494 PRO B N 1 +ATOM 9709 C CA . PRO B 1 494 ? 15.269 12.048 108.830 1.00 43.97 ? 494 PRO B CA 1 +ATOM 9710 C C . PRO B 1 494 ? 15.512 11.129 110.022 1.00 44.82 ? 494 PRO B C 1 +ATOM 9711 O O . PRO B 1 494 ? 15.226 9.932 109.944 1.00 44.37 ? 494 PRO B O 1 +ATOM 9712 C CB . PRO B 1 494 ? 13.815 12.492 108.738 1.00 43.23 ? 494 PRO B CB 1 +ATOM 9713 C CG . PRO B 1 494 ? 13.587 12.564 107.263 1.00 44.40 ? 494 PRO B CG 1 +ATOM 9714 C CD . PRO B 1 494 ? 14.261 11.306 106.754 1.00 44.01 ? 494 PRO B CD 1 +ATOM 9715 N N . ASP B 1 495 ? 16.038 11.671 111.115 1.00 45.84 ? 495 ASP B N 1 +ATOM 9716 C CA . ASP B 1 495 ? 16.329 10.862 112.297 1.00 47.41 ? 495 ASP B CA 1 +ATOM 9717 C C . ASP B 1 495 ? 15.238 9.851 112.662 1.00 46.51 ? 495 ASP B C 1 +ATOM 9718 O O . ASP B 1 495 ? 15.538 8.698 112.988 1.00 46.25 ? 495 ASP B O 1 +ATOM 9719 C CB . ASP B 1 495 ? 16.623 11.767 113.500 1.00 51.93 ? 495 ASP B CB 1 +ATOM 9720 C CG . ASP B 1 495 ? 17.893 12.585 113.314 1.00 57.77 ? 495 ASP B CG 1 +ATOM 9721 O OD1 . ASP B 1 495 ? 18.953 11.973 113.036 1.00 60.91 ? 495 ASP B OD1 1 +ATOM 9722 O OD2 . ASP B 1 495 ? 17.836 13.835 113.444 1.00 60.20 ? 495 ASP B OD2 1 +ATOM 9723 N N . TYR B 1 496 ? 13.978 10.272 112.602 1.00 44.76 ? 496 TYR B N 1 +ATOM 9724 C CA . TYR B 1 496 ? 12.867 9.384 112.934 1.00 43.77 ? 496 TYR B CA 1 +ATOM 9725 C C . TYR B 1 496 ? 12.919 8.056 112.167 1.00 43.23 ? 496 TYR B C 1 +ATOM 9726 O O . TYR B 1 496 ? 12.824 6.984 112.762 1.00 42.93 ? 496 TYR B O 1 +ATOM 9727 C CB . TYR B 1 496 ? 11.533 10.076 112.649 1.00 43.02 ? 496 TYR B CB 1 +ATOM 9728 C CG . TYR B 1 496 ? 10.331 9.210 112.941 1.00 43.19 ? 496 TYR B CG 1 +ATOM 9729 C CD1 . TYR B 1 496 ? 9.891 9.004 114.247 1.00 43.54 ? 496 TYR B CD1 1 +ATOM 9730 C CD2 . TYR B 1 496 ? 9.652 8.565 111.913 1.00 44.23 ? 496 TYR B CD2 1 +ATOM 9731 C CE1 . TYR B 1 496 ? 8.799 8.172 114.522 1.00 43.09 ? 496 TYR B CE1 1 +ATOM 9732 C CE2 . TYR B 1 496 ? 8.563 7.731 112.176 1.00 44.82 ? 496 TYR B CE2 1 +ATOM 9733 C CZ . TYR B 1 496 ? 8.143 7.539 113.479 1.00 44.51 ? 496 TYR B CZ 1 +ATOM 9734 O OH . TYR B 1 496 ? 7.075 6.701 113.728 1.00 47.51 ? 496 TYR B OH 1 +ATOM 9735 N N . TYR B 1 497 ? 13.071 8.137 110.847 1.00 42.84 ? 497 TYR B N 1 +ATOM 9736 C CA . TYR B 1 497 ? 13.127 6.944 110.004 1.00 41.97 ? 497 TYR B CA 1 +ATOM 9737 C C . TYR B 1 497 ? 14.482 6.259 110.048 1.00 41.32 ? 497 TYR B C 1 +ATOM 9738 O O . TYR B 1 497 ? 14.562 5.030 110.035 1.00 40.26 ? 497 TYR B O 1 +ATOM 9739 C CB . TYR B 1 497 ? 12.765 7.309 108.561 1.00 42.25 ? 497 TYR B CB 1 +ATOM 9740 C CG . TYR B 1 497 ? 11.321 7.724 108.415 1.00 43.46 ? 497 TYR B CG 1 +ATOM 9741 C CD1 . TYR B 1 497 ? 10.293 6.798 108.574 1.00 43.78 ? 497 TYR B CD1 1 +ATOM 9742 C CD2 . TYR B 1 497 ? 10.978 9.053 108.171 1.00 43.65 ? 497 TYR B CD2 1 +ATOM 9743 C CE1 . TYR B 1 497 ? 8.960 7.185 108.496 1.00 44.48 ? 497 TYR B CE1 1 +ATOM 9744 C CE2 . TYR B 1 497 ? 9.646 9.450 108.092 1.00 43.39 ? 497 TYR B CE2 1 +ATOM 9745 C CZ . TYR B 1 497 ? 8.645 8.512 108.255 1.00 44.82 ? 497 TYR B CZ 1 +ATOM 9746 O OH . TYR B 1 497 ? 7.322 8.895 108.172 1.00 47.62 ? 497 TYR B OH 1 +ATOM 9747 N N . LYS B 1 498 ? 15.541 7.058 110.106 1.00 41.44 ? 498 LYS B N 1 +ATOM 9748 C CA . LYS B 1 498 ? 16.891 6.528 110.166 1.00 42.40 ? 498 LYS B CA 1 +ATOM 9749 C C . LYS B 1 498 ? 17.059 5.608 111.363 1.00 43.07 ? 498 LYS B C 1 +ATOM 9750 O O . LYS B 1 498 ? 17.674 4.549 111.252 1.00 44.70 ? 498 LYS B O 1 +ATOM 9751 C CB . LYS B 1 498 ? 17.906 7.669 110.246 1.00 43.61 ? 498 LYS B CB 1 +ATOM 9752 C CG . LYS B 1 498 ? 19.338 7.202 110.460 1.00 45.65 ? 498 LYS B CG 1 +ATOM 9753 C CD . LYS B 1 498 ? 20.342 8.291 110.104 1.00 47.39 ? 498 LYS B CD 1 +ATOM 9754 C CE . LYS B 1 498 ? 20.143 9.535 110.946 1.00 50.37 ? 498 LYS B CE 1 +ATOM 9755 N NZ . LYS B 1 498 ? 21.041 10.647 110.507 1.00 54.54 ? 498 LYS B NZ 1 +ATOM 9756 N N . GLU B 1 499 ? 16.505 6.000 112.506 1.00 43.31 ? 499 GLU B N 1 +ATOM 9757 C CA . GLU B 1 499 ? 16.628 5.180 113.702 1.00 45.25 ? 499 GLU B CA 1 +ATOM 9758 C C . GLU B 1 499 ? 15.913 3.857 113.550 1.00 44.83 ? 499 GLU B C 1 +ATOM 9759 O O . GLU B 1 499 ? 16.380 2.836 114.060 1.00 46.24 ? 499 GLU B O 1 +ATOM 9760 C CB . GLU B 1 499 ? 16.079 5.910 114.934 1.00 49.25 ? 499 GLU B CB 1 +ATOM 9761 C CG . GLU B 1 499 ? 17.165 6.438 115.879 1.00 54.92 ? 499 GLU B CG 1 +ATOM 9762 C CD . GLU B 1 499 ? 18.180 5.358 116.300 1.00 58.35 ? 499 GLU B CD 1 +ATOM 9763 O OE1 . GLU B 1 499 ? 17.772 4.322 116.889 1.00 58.36 ? 499 GLU B OE1 1 +ATOM 9764 O OE2 . GLU B 1 499 ? 19.392 5.555 116.038 1.00 59.83 ? 499 GLU B OE2 1 +ATOM 9765 N N . LYS B 1 500 ? 14.779 3.868 112.856 1.00 42.71 ? 500 LYS B N 1 +ATOM 9766 C CA . LYS B 1 500 ? 14.024 2.642 112.659 1.00 41.43 ? 500 LYS B CA 1 +ATOM 9767 C C . LYS B 1 500 ? 14.794 1.653 111.793 1.00 39.80 ? 500 LYS B C 1 +ATOM 9768 O O . LYS B 1 500 ? 14.815 0.459 112.077 1.00 39.20 ? 500 LYS B O 1 +ATOM 9769 C CB . LYS B 1 500 ? 12.659 2.947 112.035 1.00 42.52 ? 500 LYS B CB 1 +ATOM 9770 C CG . LYS B 1 500 ? 11.648 3.526 113.019 1.00 43.23 ? 500 LYS B CG 1 +ATOM 9771 C CD . LYS B 1 500 ? 10.287 3.700 112.366 1.00 46.66 ? 500 LYS B CD 1 +ATOM 9772 C CE . LYS B 1 500 ? 9.294 4.374 113.302 1.00 48.43 ? 500 LYS B CE 1 +ATOM 9773 N NZ . LYS B 1 500 ? 9.107 3.593 114.554 1.00 50.53 ? 500 LYS B NZ 1 +ATOM 9774 N N . VAL B 1 501 ? 15.435 2.151 110.743 1.00 39.44 ? 501 VAL B N 1 +ATOM 9775 C CA . VAL B 1 501 ? 16.199 1.284 109.856 1.00 40.24 ? 501 VAL B CA 1 +ATOM 9776 C C . VAL B 1 501 ? 17.399 0.736 110.614 1.00 41.33 ? 501 VAL B C 1 +ATOM 9777 O O . VAL B 1 501 ? 17.746 -0.445 110.502 1.00 41.26 ? 501 VAL B O 1 +ATOM 9778 C CB . VAL B 1 501 ? 16.687 2.041 108.602 1.00 39.02 ? 501 VAL B CB 1 +ATOM 9779 C CG1 . VAL B 1 501 ? 17.579 1.142 107.766 1.00 37.33 ? 501 VAL B CG1 1 +ATOM 9780 C CG2 . VAL B 1 501 ? 15.487 2.488 107.777 1.00 40.32 ? 501 VAL B CG2 1 +ATOM 9781 N N . LYS B 1 502 ? 18.014 1.603 111.406 1.00 42.29 ? 502 LYS B N 1 +ATOM 9782 C CA . LYS B 1 502 ? 19.174 1.236 112.206 1.00 43.15 ? 502 LYS B CA 1 +ATOM 9783 C C . LYS B 1 502 ? 18.836 0.080 113.157 1.00 43.46 ? 502 LYS B C 1 +ATOM 9784 O O . LYS B 1 502 ? 19.595 -0.883 113.273 1.00 44.11 ? 502 LYS B O 1 +ATOM 9785 C CB . LYS B 1 502 ? 19.634 2.465 112.994 1.00 44.10 ? 502 LYS B CB 1 +ATOM 9786 C CG . LYS B 1 502 ? 20.990 2.362 113.671 1.00 45.61 ? 502 LYS B CG 1 +ATOM 9787 C CD . LYS B 1 502 ? 21.365 3.723 114.248 1.00 48.01 ? 502 LYS B CD 1 +ATOM 9788 C CE . LYS B 1 502 ? 22.760 3.731 114.850 1.00 50.39 ? 502 LYS B CE 1 +ATOM 9789 N NZ . LYS B 1 502 ? 22.886 2.780 115.998 1.00 51.65 ? 502 LYS B NZ 1 +ATOM 9790 N N . GLU B 1 503 ? 17.687 0.162 113.819 1.00 43.22 ? 503 GLU B N 1 +ATOM 9791 C CA . GLU B 1 503 ? 17.289 -0.881 114.759 1.00 44.32 ? 503 GLU B CA 1 +ATOM 9792 C C . GLU B 1 503 ? 16.936 -2.183 114.067 1.00 42.89 ? 503 GLU B C 1 +ATOM 9793 O O . GLU B 1 503 ? 17.145 -3.261 114.623 1.00 43.56 ? 503 GLU B O 1 +ATOM 9794 C CB . GLU B 1 503 ? 16.111 -0.407 115.620 1.00 47.33 ? 503 GLU B CB 1 +ATOM 9795 C CG . GLU B 1 503 ? 16.414 0.903 116.351 1.00 54.79 ? 503 GLU B CG 1 +ATOM 9796 C CD . GLU B 1 503 ? 15.289 1.365 117.264 1.00 59.14 ? 503 GLU B CD 1 +ATOM 9797 O OE1 . GLU B 1 503 ? 14.100 1.220 116.883 1.00 61.57 ? 503 GLU B OE1 1 +ATOM 9798 O OE2 . GLU B 1 503 ? 15.602 1.896 118.357 1.00 60.96 ? 503 GLU B OE2 1 +ATOM 9799 N N . ILE B 1 504 ? 16.394 -2.090 112.857 1.00 41.02 ? 504 ILE B N 1 +ATOM 9800 C CA . ILE B 1 504 ? 16.031 -3.287 112.107 1.00 37.97 ? 504 ILE B CA 1 +ATOM 9801 C C . ILE B 1 504 ? 17.306 -4.018 111.657 1.00 36.98 ? 504 ILE B C 1 +ATOM 9802 O O . ILE B 1 504 ? 17.406 -5.244 111.763 1.00 34.91 ? 504 ILE B O 1 +ATOM 9803 C CB . ILE B 1 504 ? 15.171 -2.919 110.875 1.00 38.07 ? 504 ILE B CB 1 +ATOM 9804 C CG1 . ILE B 1 504 ? 13.793 -2.437 111.345 1.00 37.20 ? 504 ILE B CG1 1 +ATOM 9805 C CG2 . ILE B 1 504 ? 15.030 -4.125 109.940 1.00 36.60 ? 504 ILE B CG2 1 +ATOM 9806 C CD1 . ILE B 1 504 ? 12.926 -1.835 110.245 1.00 36.24 ? 504 ILE B CD1 1 +ATOM 9807 N N . VAL B 1 505 ? 18.280 -3.261 111.161 1.00 36.48 ? 505 VAL B N 1 +ATOM 9808 C CA . VAL B 1 505 ? 19.541 -3.848 110.717 1.00 37.63 ? 505 VAL B CA 1 +ATOM 9809 C C . VAL B 1 505 ? 20.292 -4.469 111.899 1.00 39.84 ? 505 VAL B C 1 +ATOM 9810 O O . VAL B 1 505 ? 20.885 -5.550 111.771 1.00 40.26 ? 505 VAL B O 1 +ATOM 9811 C CB . VAL B 1 505 ? 20.439 -2.801 110.029 1.00 36.71 ? 505 VAL B CB 1 +ATOM 9812 C CG1 . VAL B 1 505 ? 21.776 -3.425 109.649 1.00 36.24 ? 505 VAL B CG1 1 +ATOM 9813 C CG2 . VAL B 1 505 ? 19.747 -2.272 108.775 1.00 35.11 ? 505 VAL B CG2 1 +ATOM 9814 N N . GLU B 1 506 ? 20.263 -3.800 113.051 1.00 39.81 ? 506 GLU B N 1 +ATOM 9815 C CA . GLU B 1 506 ? 20.929 -4.347 114.226 1.00 39.79 ? 506 GLU B CA 1 +ATOM 9816 C C . GLU B 1 506 ? 20.246 -5.640 114.645 1.00 38.78 ? 506 GLU B C 1 +ATOM 9817 O O . GLU B 1 506 ? 20.909 -6.586 115.070 1.00 40.27 ? 506 GLU B O 1 +ATOM 9818 C CB . GLU B 1 506 ? 20.907 -3.340 115.377 1.00 41.70 ? 506 GLU B CB 1 +ATOM 9819 C CG . GLU B 1 506 ? 21.667 -2.068 115.041 1.00 47.26 ? 506 GLU B CG 1 +ATOM 9820 C CD . GLU B 1 506 ? 21.602 -1.019 116.133 1.00 51.28 ? 506 GLU B CD 1 +ATOM 9821 O OE1 . GLU B 1 506 ? 20.538 -0.898 116.788 1.00 54.06 ? 506 GLU B OE1 1 +ATOM 9822 O OE2 . GLU B 1 506 ? 22.611 -0.300 116.319 1.00 53.96 ? 506 GLU B OE2 1 +ATOM 9823 N N . LEU B 1 507 ? 18.922 -5.691 114.513 1.00 37.47 ? 507 LEU B N 1 +ATOM 9824 C CA . LEU B 1 507 ? 18.185 -6.890 114.889 1.00 36.58 ? 507 LEU B CA 1 +ATOM 9825 C C . LEU B 1 507 ? 18.550 -8.029 113.943 1.00 36.83 ? 507 LEU B C 1 +ATOM 9826 O O . LEU B 1 507 ? 18.604 -9.189 114.346 1.00 37.99 ? 507 LEU B O 1 +ATOM 9827 C CB . LEU B 1 507 ? 16.675 -6.637 114.860 1.00 34.72 ? 507 LEU B CB 1 +ATOM 9828 C CG . LEU B 1 507 ? 15.821 -7.810 115.356 1.00 36.91 ? 507 LEU B CG 1 +ATOM 9829 C CD1 . LEU B 1 507 ? 16.128 -8.097 116.828 1.00 35.38 ? 507 LEU B CD1 1 +ATOM 9830 C CD2 . LEU B 1 507 ? 14.346 -7.482 115.187 1.00 37.16 ? 507 LEU B CD2 1 +ATOM 9831 N N . ARG B 1 508 ? 18.813 -7.699 112.683 1.00 37.88 ? 508 ARG B N 1 +ATOM 9832 C CA . ARG B 1 508 ? 19.184 -8.728 111.718 1.00 37.96 ? 508 ARG B CA 1 +ATOM 9833 C C . ARG B 1 508 ? 20.526 -9.328 112.127 1.00 37.96 ? 508 ARG B C 1 +ATOM 9834 O O . ARG B 1 508 ? 20.675 -10.547 112.179 1.00 39.42 ? 508 ARG B O 1 +ATOM 9835 C CB . ARG B 1 508 ? 19.300 -8.157 110.303 1.00 36.22 ? 508 ARG B CB 1 +ATOM 9836 C CG . ARG B 1 508 ? 19.693 -9.219 109.280 1.00 36.13 ? 508 ARG B CG 1 +ATOM 9837 C CD . ARG B 1 508 ? 20.049 -8.624 107.927 1.00 34.49 ? 508 ARG B CD 1 +ATOM 9838 N NE . ARG B 1 508 ? 20.566 -9.641 107.008 1.00 34.00 ? 508 ARG B NE 1 +ATOM 9839 C CZ . ARG B 1 508 ? 19.836 -10.623 106.479 1.00 33.99 ? 508 ARG B CZ 1 +ATOM 9840 N NH1 . ARG B 1 508 ? 18.542 -10.733 106.771 1.00 31.85 ? 508 ARG B NH1 1 +ATOM 9841 N NH2 . ARG B 1 508 ? 20.405 -11.502 105.659 1.00 32.03 ? 508 ARG B NH2 1 +ATOM 9842 N N . TYR B 1 509 ? 21.503 -8.472 112.413 1.00 38.37 ? 509 TYR B N 1 +ATOM 9843 C CA . TYR B 1 509 ? 22.818 -8.949 112.829 1.00 39.12 ? 509 TYR B CA 1 +ATOM 9844 C C . TYR B 1 509 ? 22.733 -9.766 114.122 1.00 39.50 ? 509 TYR B C 1 +ATOM 9845 O O . TYR B 1 509 ? 23.533 -10.680 114.352 1.00 39.20 ? 509 TYR B O 1 +ATOM 9846 C CB . TYR B 1 509 ? 23.779 -7.773 112.998 1.00 37.26 ? 509 TYR B CB 1 +ATOM 9847 C CG . TYR B 1 509 ? 24.393 -7.331 111.689 1.00 38.02 ? 509 TYR B CG 1 +ATOM 9848 C CD1 . TYR B 1 509 ? 25.312 -8.141 111.018 1.00 37.25 ? 509 TYR B CD1 1 +ATOM 9849 C CD2 . TYR B 1 509 ? 24.030 -6.113 111.098 1.00 39.33 ? 509 TYR B CD2 1 +ATOM 9850 C CE1 . TYR B 1 509 ? 25.856 -7.754 109.782 1.00 37.70 ? 509 TYR B CE1 1 +ATOM 9851 C CE2 . TYR B 1 509 ? 24.565 -5.715 109.868 1.00 38.93 ? 509 TYR B CE2 1 +ATOM 9852 C CZ . TYR B 1 509 ? 25.476 -6.540 109.214 1.00 39.55 ? 509 TYR B CZ 1 +ATOM 9853 O OH . TYR B 1 509 ? 25.995 -6.138 107.995 1.00 39.36 ? 509 TYR B OH 1 +ATOM 9854 N N . LYS B 1 510 ? 21.747 -9.454 114.954 1.00 39.73 ? 510 LYS B N 1 +ATOM 9855 C CA . LYS B 1 510 ? 21.577 -10.183 116.198 1.00 40.35 ? 510 LYS B CA 1 +ATOM 9856 C C . LYS B 1 510 ? 21.133 -11.615 115.909 1.00 40.57 ? 510 LYS B C 1 +ATOM 9857 O O . LYS B 1 510 ? 21.455 -12.539 116.662 1.00 42.31 ? 510 LYS B O 1 +ATOM 9858 C CB . LYS B 1 510 ? 20.553 -9.476 117.082 1.00 40.58 ? 510 LYS B CB 1 +ATOM 9859 C CG . LYS B 1 510 ? 20.260 -10.210 118.373 1.00 43.76 ? 510 LYS B CG 1 +ATOM 9860 C CD . LYS B 1 510 ? 19.443 -9.364 119.330 1.00 43.73 ? 510 LYS B CD 1 +ATOM 9861 C CE . LYS B 1 510 ? 19.249 -10.088 120.648 1.00 46.05 ? 510 LYS B CE 1 +ATOM 9862 N NZ . LYS B 1 510 ? 18.599 -9.215 121.663 1.00 50.15 ? 510 LYS B NZ 1 +ATOM 9863 N N . PHE B 1 511 ? 20.400 -11.800 114.813 1.00 39.78 ? 511 PHE B N 1 +ATOM 9864 C CA . PHE B 1 511 ? 19.910 -13.124 114.432 1.00 37.78 ? 511 PHE B CA 1 +ATOM 9865 C C . PHE B 1 511 ? 20.775 -13.792 113.372 1.00 37.59 ? 511 PHE B C 1 +ATOM 9866 O O . PHE B 1 511 ? 20.511 -14.929 112.971 1.00 37.93 ? 511 PHE B O 1 +ATOM 9867 C CB . PHE B 1 511 ? 18.480 -13.027 113.913 1.00 36.98 ? 511 PHE B CB 1 +ATOM 9868 C CG . PHE B 1 511 ? 17.438 -13.070 114.990 1.00 36.76 ? 511 PHE B CG 1 +ATOM 9869 C CD1 . PHE B 1 511 ? 16.945 -14.288 115.446 1.00 35.42 ? 511 PHE B CD1 1 +ATOM 9870 C CD2 . PHE B 1 511 ? 16.950 -11.897 115.549 1.00 35.93 ? 511 PHE B CD2 1 +ATOM 9871 C CE1 . PHE B 1 511 ? 15.984 -14.338 116.442 1.00 34.45 ? 511 PHE B CE1 1 +ATOM 9872 C CE2 . PHE B 1 511 ? 15.989 -11.937 116.546 1.00 35.48 ? 511 PHE B CE2 1 +ATOM 9873 C CZ . PHE B 1 511 ? 15.506 -13.161 116.993 1.00 36.60 ? 511 PHE B CZ 1 +ATOM 9874 N N . LEU B 1 512 ? 21.811 -13.101 112.918 1.00 38.03 ? 512 LEU B N 1 +ATOM 9875 C CA . LEU B 1 512 ? 22.682 -13.665 111.890 1.00 40.04 ? 512 LEU B CA 1 +ATOM 9876 C C . LEU B 1 512 ? 23.175 -15.092 112.201 1.00 41.11 ? 512 LEU B C 1 +ATOM 9877 O O . LEU B 1 512 ? 23.163 -15.960 111.325 1.00 43.53 ? 512 LEU B O 1 +ATOM 9878 C CB . LEU B 1 512 ? 23.867 -12.742 111.636 1.00 39.52 ? 512 LEU B CB 1 +ATOM 9879 C CG . LEU B 1 512 ? 24.531 -12.963 110.278 1.00 42.69 ? 512 LEU B CG 1 +ATOM 9880 C CD1 . LEU B 1 512 ? 23.523 -12.670 109.168 1.00 44.29 ? 512 LEU B CD1 1 +ATOM 9881 C CD2 . LEU B 1 512 ? 25.739 -12.046 110.132 1.00 43.87 ? 512 LEU B CD2 1 +ATOM 9882 N N . PRO B 1 513 ? 23.621 -15.356 113.443 1.00 40.49 ? 513 PRO B N 1 +ATOM 9883 C CA . PRO B 1 513 ? 24.094 -16.706 113.790 1.00 39.97 ? 513 PRO B CA 1 +ATOM 9884 C C . PRO B 1 513 ? 23.073 -17.805 113.472 1.00 39.95 ? 513 PRO B C 1 +ATOM 9885 O O . PRO B 1 513 ? 23.439 -18.886 112.999 1.00 41.12 ? 513 PRO B O 1 +ATOM 9886 C CB . PRO B 1 513 ? 24.366 -16.598 115.281 1.00 39.51 ? 513 PRO B CB 1 +ATOM 9887 C CG . PRO B 1 513 ? 24.863 -15.177 115.407 1.00 39.82 ? 513 PRO B CG 1 +ATOM 9888 C CD . PRO B 1 513 ? 23.890 -14.409 114.541 1.00 39.76 ? 513 PRO B CD 1 +ATOM 9889 N N . TYR B 1 514 ? 21.797 -17.533 113.746 1.00 39.76 ? 514 TYR B N 1 +ATOM 9890 C CA . TYR B 1 514 ? 20.731 -18.497 113.475 1.00 38.37 ? 514 TYR B CA 1 +ATOM 9891 C C . TYR B 1 514 ? 20.554 -18.634 111.961 1.00 40.11 ? 514 TYR B C 1 +ATOM 9892 O O . TYR B 1 514 ? 20.479 -19.749 111.422 1.00 41.44 ? 514 TYR B O 1 +ATOM 9893 C CB . TYR B 1 514 ? 19.427 -18.026 114.111 1.00 36.15 ? 514 TYR B CB 1 +ATOM 9894 C CG . TYR B 1 514 ? 18.228 -18.903 113.802 1.00 35.63 ? 514 TYR B CG 1 +ATOM 9895 C CD1 . TYR B 1 514 ? 18.268 -20.280 114.022 1.00 34.40 ? 514 TYR B CD1 1 +ATOM 9896 C CD2 . TYR B 1 514 ? 17.044 -18.350 113.309 1.00 34.26 ? 514 TYR B CD2 1 +ATOM 9897 C CE1 . TYR B 1 514 ? 17.163 -21.087 113.760 1.00 34.43 ? 514 TYR B CE1 1 +ATOM 9898 C CE2 . TYR B 1 514 ? 15.929 -19.148 113.043 1.00 34.50 ? 514 TYR B CE2 1 +ATOM 9899 C CZ . TYR B 1 514 ? 15.994 -20.511 113.270 1.00 34.90 ? 514 TYR B CZ 1 +ATOM 9900 O OH . TYR B 1 514 ? 14.890 -21.294 113.019 1.00 35.27 ? 514 TYR B OH 1 +ATOM 9901 N N . ILE B 1 515 ? 20.498 -17.496 111.273 1.00 38.77 ? 515 ILE B N 1 +ATOM 9902 C CA . ILE B 1 515 ? 20.340 -17.501 109.829 1.00 38.62 ? 515 ILE B CA 1 +ATOM 9903 C C . ILE B 1 515 ? 21.478 -18.283 109.173 1.00 39.21 ? 515 ILE B C 1 +ATOM 9904 O O . ILE B 1 515 ? 21.247 -19.140 108.313 1.00 39.49 ? 515 ILE B O 1 +ATOM 9905 C CB . ILE B 1 515 ? 20.311 -16.061 109.268 1.00 38.38 ? 515 ILE B CB 1 +ATOM 9906 C CG1 . ILE B 1 515 ? 19.030 -15.355 109.721 1.00 37.64 ? 515 ILE B CG1 1 +ATOM 9907 C CG2 . ILE B 1 515 ? 20.371 -16.084 107.748 1.00 38.09 ? 515 ILE B CG2 1 +ATOM 9908 C CD1 . ILE B 1 515 ? 19.026 -13.876 109.440 1.00 38.56 ? 515 ILE B CD1 1 +ATOM 9909 N N . TYR B 1 516 ? 22.707 -18.008 109.593 1.00 39.13 ? 516 TYR B N 1 +ATOM 9910 C CA . TYR B 1 516 ? 23.850 -18.693 109.011 1.00 38.88 ? 516 TYR B CA 1 +ATOM 9911 C C . TYR B 1 516 ? 23.836 -20.186 109.305 1.00 38.44 ? 516 TYR B C 1 +ATOM 9912 O O . TYR B 1 516 ? 24.280 -20.983 108.481 1.00 39.35 ? 516 TYR B O 1 +ATOM 9913 C CB . TYR B 1 516 ? 25.156 -18.085 109.504 1.00 39.96 ? 516 TYR B CB 1 +ATOM 9914 C CG . TYR B 1 516 ? 26.319 -18.458 108.626 1.00 41.55 ? 516 TYR B CG 1 +ATOM 9915 C CD1 . TYR B 1 516 ? 26.248 -18.286 107.242 1.00 41.82 ? 516 TYR B CD1 1 +ATOM 9916 C CD2 . TYR B 1 516 ? 27.492 -18.975 109.166 1.00 42.67 ? 516 TYR B CD2 1 +ATOM 9917 C CE1 . TYR B 1 516 ? 27.318 -18.621 106.417 1.00 42.37 ? 516 TYR B CE1 1 +ATOM 9918 C CE2 . TYR B 1 516 ? 28.577 -19.313 108.348 1.00 41.68 ? 516 TYR B CE2 1 +ATOM 9919 C CZ . TYR B 1 516 ? 28.481 -19.134 106.979 1.00 42.54 ? 516 TYR B CZ 1 +ATOM 9920 O OH . TYR B 1 516 ? 29.541 -19.476 106.171 1.00 43.54 ? 516 TYR B OH 1 +ATOM 9921 N N . SER B 1 517 ? 23.328 -20.569 110.471 1.00 36.60 ? 517 SER B N 1 +ATOM 9922 C CA . SER B 1 517 ? 23.263 -21.983 110.809 1.00 37.48 ? 517 SER B CA 1 +ATOM 9923 C C . SER B 1 517 ? 22.283 -22.659 109.861 1.00 36.94 ? 517 SER B C 1 +ATOM 9924 O O . SER B 1 517 ? 22.487 -23.803 109.455 1.00 39.12 ? 517 SER B O 1 +ATOM 9925 C CB . SER B 1 517 ? 22.811 -22.181 112.261 1.00 37.09 ? 517 SER B CB 1 +ATOM 9926 O OG . SER B 1 517 ? 23.703 -21.541 113.150 1.00 36.78 ? 517 SER B OG 1 +ATOM 9927 N N . LEU B 1 518 ? 21.215 -21.948 109.509 1.00 36.83 ? 518 LEU B N 1 +ATOM 9928 C CA . LEU B 1 518 ? 20.223 -22.491 108.581 1.00 35.16 ? 518 LEU B CA 1 +ATOM 9929 C C . LEU B 1 518 ? 20.849 -22.572 107.189 1.00 34.70 ? 518 LEU B C 1 +ATOM 9930 O O . LEU B 1 518 ? 20.515 -23.454 106.396 1.00 34.66 ? 518 LEU B O 1 +ATOM 9931 C CB . LEU B 1 518 ? 18.974 -21.602 108.558 1.00 35.01 ? 518 LEU B CB 1 +ATOM 9932 C CG . LEU B 1 518 ? 18.171 -21.590 109.863 1.00 33.89 ? 518 LEU B CG 1 +ATOM 9933 C CD1 . LEU B 1 518 ? 17.089 -20.505 109.805 1.00 34.91 ? 518 LEU B CD1 1 +ATOM 9934 C CD2 . LEU B 1 518 ? 17.554 -22.970 110.082 1.00 31.06 ? 518 LEU B CD2 1 +ATOM 9935 N N . ALA B 1 519 ? 21.762 -21.648 106.897 1.00 33.77 ? 519 ALA B N 1 +ATOM 9936 C CA . ALA B 1 519 ? 22.453 -21.664 105.612 1.00 35.91 ? 519 ALA B CA 1 +ATOM 9937 C C . ALA B 1 519 ? 23.312 -22.935 105.532 1.00 37.72 ? 519 ALA B C 1 +ATOM 9938 O O . ALA B 1 519 ? 23.386 -23.587 104.479 1.00 37.68 ? 519 ALA B O 1 +ATOM 9939 C CB . ALA B 1 519 ? 23.330 -20.436 105.464 1.00 34.61 ? 519 ALA B CB 1 +ATOM 9940 N N . LEU B 1 520 ? 23.963 -23.287 106.644 1.00 37.78 ? 520 LEU B N 1 +ATOM 9941 C CA . LEU B 1 520 ? 24.787 -24.495 106.684 1.00 38.37 ? 520 LEU B CA 1 +ATOM 9942 C C . LEU B 1 520 ? 23.888 -25.710 106.456 1.00 38.90 ? 520 LEU B C 1 +ATOM 9943 O O . LEU B 1 520 ? 24.239 -26.628 105.713 1.00 38.08 ? 520 LEU B O 1 +ATOM 9944 C CB . LEU B 1 520 ? 25.487 -24.631 108.040 1.00 39.38 ? 520 LEU B CB 1 +ATOM 9945 C CG . LEU B 1 520 ? 26.210 -25.965 108.287 1.00 39.28 ? 520 LEU B CG 1 +ATOM 9946 C CD1 . LEU B 1 520 ? 27.366 -26.125 107.299 1.00 39.51 ? 520 LEU B CD1 1 +ATOM 9947 C CD2 . LEU B 1 520 ? 26.728 -26.002 109.717 1.00 40.77 ? 520 LEU B CD2 1 +ATOM 9948 N N . GLU B 1 521 ? 22.728 -25.706 107.106 1.00 39.17 ? 521 GLU B N 1 +ATOM 9949 C CA . GLU B 1 521 ? 21.760 -26.783 106.973 1.00 40.16 ? 521 GLU B CA 1 +ATOM 9950 C C . GLU B 1 521 ? 21.327 -26.881 105.506 1.00 40.81 ? 521 GLU B C 1 +ATOM 9951 O O . GLU B 1 521 ? 21.154 -27.975 104.973 1.00 41.30 ? 521 GLU B O 1 +ATOM 9952 C CB . GLU B 1 521 ? 20.551 -26.487 107.864 1.00 42.89 ? 521 GLU B CB 1 +ATOM 9953 C CG . GLU B 1 521 ? 19.507 -27.600 107.957 1.00 48.67 ? 521 GLU B CG 1 +ATOM 9954 C CD . GLU B 1 521 ? 18.238 -27.148 108.685 1.00 52.49 ? 521 GLU B CD 1 +ATOM 9955 O OE1 . GLU B 1 521 ? 18.361 -26.599 109.805 1.00 54.47 ? 521 GLU B OE1 1 +ATOM 9956 O OE2 . GLU B 1 521 ? 17.122 -27.341 108.139 1.00 54.22 ? 521 GLU B OE2 1 +ATOM 9957 N N . ALA B 1 522 ? 21.159 -25.732 104.851 1.00 40.75 ? 522 ALA B N 1 +ATOM 9958 C CA . ALA B 1 522 ? 20.747 -25.718 103.447 1.00 41.38 ? 522 ALA B CA 1 +ATOM 9959 C C . ALA B 1 522 ? 21.808 -26.383 102.573 1.00 41.76 ? 522 ALA B C 1 +ATOM 9960 O O . ALA B 1 522 ? 21.498 -27.232 101.731 1.00 40.43 ? 522 ALA B O 1 +ATOM 9961 C CB . ALA B 1 522 ? 20.510 -24.275 102.971 1.00 38.98 ? 522 ALA B CB 1 +ATOM 9962 N N . SER B 1 523 ? 23.061 -25.997 102.780 1.00 42.76 ? 523 SER B N 1 +ATOM 9963 C CA . SER B 1 523 ? 24.155 -26.551 101.990 1.00 46.27 ? 523 SER B CA 1 +ATOM 9964 C C . SER B 1 523 ? 24.421 -28.021 102.282 1.00 46.98 ? 523 SER B C 1 +ATOM 9965 O O . SER B 1 523 ? 25.028 -28.713 101.469 1.00 48.36 ? 523 SER B O 1 +ATOM 9966 C CB . SER B 1 523 ? 25.438 -25.756 102.223 1.00 46.52 ? 523 SER B CB 1 +ATOM 9967 O OG . SER B 1 523 ? 25.875 -25.908 103.561 1.00 51.07 ? 523 SER B OG 1 +ATOM 9968 N N . GLU B 1 524 ? 23.962 -28.505 103.430 1.00 48.53 ? 524 GLU B N 1 +ATOM 9969 C CA . GLU B 1 524 ? 24.189 -29.900 103.789 1.00 50.02 ? 524 GLU B CA 1 +ATOM 9970 C C . GLU B 1 524 ? 23.011 -30.807 103.479 1.00 49.87 ? 524 GLU B C 1 +ATOM 9971 O O . GLU B 1 524 ? 23.197 -31.944 103.046 1.00 50.74 ? 524 GLU B O 1 +ATOM 9972 C CB . GLU B 1 524 ? 24.525 -30.030 105.280 1.00 51.58 ? 524 GLU B CB 1 +ATOM 9973 C CG . GLU B 1 524 ? 25.766 -29.272 105.723 1.00 56.82 ? 524 GLU B CG 1 +ATOM 9974 C CD . GLU B 1 524 ? 26.153 -29.574 107.168 1.00 61.06 ? 524 GLU B CD 1 +ATOM 9975 O OE1 . GLU B 1 524 ? 25.264 -29.520 108.054 1.00 62.99 ? 524 GLU B OE1 1 +ATOM 9976 O OE2 . GLU B 1 524 ? 27.349 -29.859 107.417 1.00 62.31 ? 524 GLU B OE2 1 +ATOM 9977 N N . LYS B 1 525 ? 21.799 -30.315 103.696 1.00 49.35 ? 525 LYS B N 1 +ATOM 9978 C CA . LYS B 1 525 ? 20.625 -31.142 103.462 1.00 49.91 ? 525 LYS B CA 1 +ATOM 9979 C C . LYS B 1 525 ? 19.663 -30.605 102.418 1.00 49.25 ? 525 LYS B C 1 +ATOM 9980 O O . LYS B 1 525 ? 18.737 -31.306 102.007 1.00 49.79 ? 525 LYS B O 1 +ATOM 9981 C CB . LYS B 1 525 ? 19.892 -31.367 104.785 1.00 51.44 ? 525 LYS B CB 1 +ATOM 9982 C CG . LYS B 1 525 ? 20.775 -32.004 105.853 1.00 54.11 ? 525 LYS B CG 1 +ATOM 9983 C CD . LYS B 1 525 ? 20.052 -32.154 107.181 1.00 57.35 ? 525 LYS B CD 1 +ATOM 9984 C CE . LYS B 1 525 ? 20.937 -32.848 108.222 1.00 59.82 ? 525 LYS B CE 1 +ATOM 9985 N NZ . LYS B 1 525 ? 22.229 -32.125 108.466 1.00 60.68 ? 525 LYS B NZ 1 +ATOM 9986 N N . GLY B 1 526 ? 19.878 -29.369 101.983 1.00 48.16 ? 526 GLY B N 1 +ATOM 9987 C CA . GLY B 1 526 ? 19.005 -28.796 100.979 1.00 47.06 ? 526 GLY B CA 1 +ATOM 9988 C C . GLY B 1 526 ? 17.694 -28.271 101.532 1.00 48.24 ? 526 GLY B C 1 +ATOM 9989 O O . GLY B 1 526 ? 16.700 -28.192 100.816 1.00 49.86 ? 526 GLY B O 1 +ATOM 9990 N N . HIS B 1 527 ? 17.675 -27.922 102.813 1.00 47.95 ? 527 HIS B N 1 +ATOM 9991 C CA . HIS B 1 527 ? 16.468 -27.373 103.424 1.00 46.34 ? 527 HIS B CA 1 +ATOM 9992 C C . HIS B 1 527 ? 16.503 -25.865 103.186 1.00 45.07 ? 527 HIS B C 1 +ATOM 9993 O O . HIS B 1 527 ? 17.541 -25.219 103.361 1.00 45.71 ? 527 HIS B O 1 +ATOM 9994 C CB . HIS B 1 527 ? 16.454 -27.648 104.931 1.00 46.52 ? 527 HIS B CB 1 +ATOM 9995 C CG . HIS B 1 527 ? 16.406 -29.102 105.282 1.00 48.60 ? 527 HIS B CG 1 +ATOM 9996 N ND1 . HIS B 1 527 ? 16.631 -29.564 106.563 1.00 48.34 ? 527 HIS B ND1 1 +ATOM 9997 C CD2 . HIS B 1 527 ? 16.139 -30.196 104.528 1.00 47.21 ? 527 HIS B CD2 1 +ATOM 9998 C CE1 . HIS B 1 527 ? 16.503 -30.879 106.582 1.00 48.07 ? 527 HIS B CE1 1 +ATOM 9999 N NE2 . HIS B 1 527 ? 16.204 -31.287 105.361 1.00 48.62 ? 527 HIS B NE2 1 +ATOM 10000 N N . PRO B 1 528 ? 15.380 -25.280 102.768 1.00 42.78 ? 528 PRO B N 1 +ATOM 10001 C CA . PRO B 1 528 ? 15.412 -23.834 102.543 1.00 42.01 ? 528 PRO B CA 1 +ATOM 10002 C C . PRO B 1 528 ? 15.512 -23.044 103.853 1.00 40.43 ? 528 PRO B C 1 +ATOM 10003 O O . PRO B 1 528 ? 15.065 -23.510 104.898 1.00 39.38 ? 528 PRO B O 1 +ATOM 10004 C CB . PRO B 1 528 ? 14.107 -23.577 101.790 1.00 41.12 ? 528 PRO B CB 1 +ATOM 10005 C CG . PRO B 1 528 ? 13.203 -24.657 102.301 1.00 42.44 ? 528 PRO B CG 1 +ATOM 10006 C CD . PRO B 1 528 ? 14.105 -25.863 102.326 1.00 43.24 ? 528 PRO B CD 1 +ATOM 10007 N N . VAL B 1 529 ? 16.113 -21.858 103.789 1.00 39.40 ? 529 VAL B N 1 +ATOM 10008 C CA . VAL B 1 529 ? 16.259 -21.005 104.959 1.00 37.13 ? 529 VAL B CA 1 +ATOM 10009 C C . VAL B 1 529 ? 14.909 -20.409 105.350 1.00 37.64 ? 529 VAL B C 1 +ATOM 10010 O O . VAL B 1 529 ? 14.431 -20.640 106.462 1.00 38.54 ? 529 VAL B O 1 +ATOM 10011 C CB . VAL B 1 529 ? 17.257 -19.887 104.695 1.00 36.88 ? 529 VAL B CB 1 +ATOM 10012 C CG1 . VAL B 1 529 ? 17.350 -18.979 105.914 1.00 38.36 ? 529 VAL B CG1 1 +ATOM 10013 C CG2 . VAL B 1 529 ? 18.617 -20.489 104.369 1.00 37.54 ? 529 VAL B CG2 1 +ATOM 10014 N N . ILE B 1 530 ? 14.288 -19.638 104.457 1.00 36.57 ? 530 ILE B N 1 +ATOM 10015 C CA . ILE B 1 530 ? 12.971 -19.084 104.769 1.00 35.97 ? 530 ILE B CA 1 +ATOM 10016 C C . ILE B 1 530 ? 11.937 -20.020 104.154 1.00 35.77 ? 530 ILE B C 1 +ATOM 10017 O O . ILE B 1 530 ? 12.160 -20.576 103.077 1.00 33.52 ? 530 ILE B O 1 +ATOM 10018 C CB . ILE B 1 530 ? 12.794 -17.657 104.230 1.00 35.88 ? 530 ILE B CB 1 +ATOM 10019 C CG1 . ILE B 1 530 ? 13.031 -17.626 102.728 1.00 37.11 ? 530 ILE B CG1 1 +ATOM 10020 C CG2 . ILE B 1 530 ? 13.763 -16.712 104.938 1.00 32.88 ? 530 ILE B CG2 1 +ATOM 10021 C CD1 . ILE B 1 530 ? 12.708 -16.277 102.110 1.00 36.40 ? 530 ILE B CD1 1 +ATOM 10022 N N . ARG B 1 531 ? 10.815 -20.206 104.841 1.00 34.32 ? 531 ARG B N 1 +ATOM 10023 C CA . ARG B 1 531 ? 9.813 -21.137 104.351 1.00 37.02 ? 531 ARG B CA 1 +ATOM 10024 C C . ARG B 1 531 ? 8.379 -20.698 104.521 1.00 37.31 ? 531 ARG B C 1 +ATOM 10025 O O . ARG B 1 531 ? 8.029 -20.012 105.482 1.00 36.90 ? 531 ARG B O 1 +ATOM 10026 C CB . ARG B 1 531 ? 9.958 -22.477 105.081 1.00 38.87 ? 531 ARG B CB 1 +ATOM 10027 C CG . ARG B 1 531 ? 11.390 -22.853 105.355 1.00 41.46 ? 531 ARG B CG 1 +ATOM 10028 C CD . ARG B 1 531 ? 11.522 -23.871 106.468 1.00 42.71 ? 531 ARG B CD 1 +ATOM 10029 N NE . ARG B 1 531 ? 12.925 -24.239 106.629 1.00 43.85 ? 531 ARG B NE 1 +ATOM 10030 C CZ . ARG B 1 531 ? 13.371 -25.190 107.437 1.00 43.05 ? 531 ARG B CZ 1 +ATOM 10031 N NH1 . ARG B 1 531 ? 12.516 -25.885 108.176 1.00 42.96 ? 531 ARG B NH1 1 +ATOM 10032 N NH2 . ARG B 1 531 ? 14.677 -25.448 107.496 1.00 42.51 ? 531 ARG B NH2 1 +ATOM 10033 N N . PRO B 1 532 ? 7.522 -21.090 103.573 1.00 37.87 ? 532 PRO B N 1 +ATOM 10034 C CA . PRO B 1 532 ? 6.113 -20.715 103.696 1.00 36.79 ? 532 PRO B CA 1 +ATOM 10035 C C . PRO B 1 532 ? 5.593 -21.600 104.831 1.00 37.49 ? 532 PRO B C 1 +ATOM 10036 O O . PRO B 1 532 ? 6.188 -22.647 105.116 1.00 37.54 ? 532 PRO B O 1 +ATOM 10037 C CB . PRO B 1 532 ? 5.534 -21.090 102.329 1.00 37.56 ? 532 PRO B CB 1 +ATOM 10038 C CG . PRO B 1 532 ? 6.435 -22.217 101.863 1.00 37.65 ? 532 PRO B CG 1 +ATOM 10039 C CD . PRO B 1 532 ? 7.804 -21.732 102.274 1.00 36.26 ? 532 PRO B CD 1 +ATOM 10040 N N . LEU B 1 533 ? 4.509 -21.192 105.482 1.00 37.46 ? 533 LEU B N 1 +ATOM 10041 C CA . LEU B 1 533 ? 3.963 -21.970 106.580 1.00 37.99 ? 533 LEU B CA 1 +ATOM 10042 C C . LEU B 1 533 ? 3.595 -23.400 106.212 1.00 39.43 ? 533 LEU B C 1 +ATOM 10043 O O . LEU B 1 533 ? 3.776 -24.309 107.017 1.00 41.30 ? 533 LEU B O 1 +ATOM 10044 C CB . LEU B 1 533 ? 2.733 -21.277 107.184 1.00 38.19 ? 533 LEU B CB 1 +ATOM 10045 C CG . LEU B 1 533 ? 2.926 -19.852 107.726 1.00 38.90 ? 533 LEU B CG 1 +ATOM 10046 C CD1 . LEU B 1 533 ? 1.807 -19.527 108.697 1.00 38.87 ? 533 LEU B CD1 1 +ATOM 10047 C CD2 . LEU B 1 533 ? 4.264 -19.724 108.425 1.00 36.61 ? 533 LEU B CD2 1 +ATOM 10048 N N . PHE B 1 534 ? 3.077 -23.622 105.007 1.00 40.45 ? 534 PHE B N 1 +ATOM 10049 C CA . PHE B 1 534 ? 2.690 -24.979 104.641 1.00 40.41 ? 534 PHE B CA 1 +ATOM 10050 C C . PHE B 1 534 ? 3.868 -25.945 104.572 1.00 40.90 ? 534 PHE B C 1 +ATOM 10051 O O . PHE B 1 534 ? 3.669 -27.155 104.528 1.00 41.83 ? 534 PHE B O 1 +ATOM 10052 C CB . PHE B 1 534 ? 1.885 -24.998 103.324 1.00 39.01 ? 534 PHE B CB 1 +ATOM 10053 C CG . PHE B 1 534 ? 2.625 -24.457 102.127 1.00 38.03 ? 534 PHE B CG 1 +ATOM 10054 C CD1 . PHE B 1 534 ? 3.675 -25.169 101.549 1.00 37.82 ? 534 PHE B CD1 1 +ATOM 10055 C CD2 . PHE B 1 534 ? 2.248 -23.248 101.559 1.00 36.37 ? 534 PHE B CD2 1 +ATOM 10056 C CE1 . PHE B 1 534 ? 4.339 -24.681 100.413 1.00 36.41 ? 534 PHE B CE1 1 +ATOM 10057 C CE2 . PHE B 1 534 ? 2.903 -22.749 100.427 1.00 37.15 ? 534 PHE B CE2 1 +ATOM 10058 C CZ . PHE B 1 534 ? 3.953 -23.472 99.853 1.00 35.72 ? 534 PHE B CZ 1 +ATOM 10059 N N . TYR B 1 535 ? 5.091 -25.424 104.585 1.00 40.49 ? 535 TYR B N 1 +ATOM 10060 C CA . TYR B 1 535 ? 6.257 -26.294 104.527 1.00 40.38 ? 535 TYR B CA 1 +ATOM 10061 C C . TYR B 1 535 ? 6.406 -27.071 105.829 1.00 40.70 ? 535 TYR B C 1 +ATOM 10062 O O . TYR B 1 535 ? 6.736 -28.251 105.816 1.00 41.76 ? 535 TYR B O 1 +ATOM 10063 C CB . TYR B 1 535 ? 7.516 -25.478 104.244 1.00 39.41 ? 535 TYR B CB 1 +ATOM 10064 C CG . TYR B 1 535 ? 8.796 -26.288 104.271 1.00 40.51 ? 535 TYR B CG 1 +ATOM 10065 C CD1 . TYR B 1 535 ? 9.420 -26.604 105.482 1.00 41.38 ? 535 TYR B CD1 1 +ATOM 10066 C CD2 . TYR B 1 535 ? 9.408 -26.705 103.089 1.00 39.85 ? 535 TYR B CD2 1 +ATOM 10067 C CE1 . TYR B 1 535 ? 10.625 -27.304 105.518 1.00 40.56 ? 535 TYR B CE1 1 +ATOM 10068 C CE2 . TYR B 1 535 ? 10.620 -27.411 103.109 1.00 39.82 ? 535 TYR B CE2 1 +ATOM 10069 C CZ . TYR B 1 535 ? 11.225 -27.702 104.331 1.00 41.85 ? 535 TYR B CZ 1 +ATOM 10070 O OH . TYR B 1 535 ? 12.444 -28.356 104.379 1.00 40.76 ? 535 TYR B OH 1 +ATOM 10071 N N . GLU B 1 536 ? 6.156 -26.406 106.951 1.00 42.12 ? 536 GLU B N 1 +ATOM 10072 C CA . GLU B 1 536 ? 6.248 -27.038 108.265 1.00 42.42 ? 536 GLU B CA 1 +ATOM 10073 C C . GLU B 1 536 ? 4.923 -27.660 108.695 1.00 42.48 ? 536 GLU B C 1 +ATOM 10074 O O . GLU B 1 536 ? 4.900 -28.531 109.563 1.00 42.94 ? 536 GLU B O 1 +ATOM 10075 C CB . GLU B 1 536 ? 6.662 -26.010 109.320 1.00 44.55 ? 536 GLU B CB 1 +ATOM 10076 C CG . GLU B 1 536 ? 8.122 -25.590 109.268 1.00 48.43 ? 536 GLU B CG 1 +ATOM 10077 C CD . GLU B 1 536 ? 9.060 -26.752 109.537 1.00 51.25 ? 536 GLU B CD 1 +ATOM 10078 O OE1 . GLU B 1 536 ? 8.778 -27.543 110.467 1.00 53.03 ? 536 GLU B OE1 1 +ATOM 10079 O OE2 . GLU B 1 536 ? 10.079 -26.872 108.826 1.00 52.38 ? 536 GLU B OE2 1 +ATOM 10080 N N . PHE B 1 537 ? 3.822 -27.205 108.096 1.00 41.81 ? 537 PHE B N 1 +ATOM 10081 C CA . PHE B 1 537 ? 2.494 -27.703 108.442 1.00 40.44 ? 537 PHE B CA 1 +ATOM 10082 C C . PHE B 1 537 ? 1.714 -28.024 107.181 1.00 41.14 ? 537 PHE B C 1 +ATOM 10083 O O . PHE B 1 537 ? 0.620 -27.501 106.963 1.00 41.57 ? 537 PHE B O 1 +ATOM 10084 C CB . PHE B 1 537 ? 1.744 -26.650 109.263 1.00 39.66 ? 537 PHE B CB 1 +ATOM 10085 C CG . PHE B 1 537 ? 2.547 -26.091 110.400 1.00 39.19 ? 537 PHE B CG 1 +ATOM 10086 C CD1 . PHE B 1 537 ? 3.399 -25.005 110.200 1.00 39.03 ? 537 PHE B CD1 1 +ATOM 10087 C CD2 . PHE B 1 537 ? 2.509 -26.693 111.658 1.00 39.24 ? 537 PHE B CD2 1 +ATOM 10088 C CE1 . PHE B 1 537 ? 4.215 -24.522 111.235 1.00 39.10 ? 537 PHE B CE1 1 +ATOM 10089 C CE2 . PHE B 1 537 ? 3.317 -26.224 112.701 1.00 40.22 ? 537 PHE B CE2 1 +ATOM 10090 C CZ . PHE B 1 537 ? 4.177 -25.132 112.489 1.00 39.74 ? 537 PHE B CZ 1 +ATOM 10091 N N . GLN B 1 538 ? 2.277 -28.906 106.365 1.00 42.28 ? 538 GLN B N 1 +ATOM 10092 C CA . GLN B 1 538 ? 1.679 -29.294 105.089 1.00 42.90 ? 538 GLN B CA 1 +ATOM 10093 C C . GLN B 1 538 ? 0.333 -29.991 105.157 1.00 43.67 ? 538 GLN B C 1 +ATOM 10094 O O . GLN B 1 538 ? -0.361 -30.088 104.147 1.00 43.71 ? 538 GLN B O 1 +ATOM 10095 C CB . GLN B 1 538 ? 2.650 -30.182 104.309 1.00 40.62 ? 538 GLN B CB 1 +ATOM 10096 C CG . GLN B 1 538 ? 2.874 -31.549 104.915 1.00 39.70 ? 538 GLN B CG 1 +ATOM 10097 C CD . GLN B 1 538 ? 3.863 -32.369 104.112 1.00 41.41 ? 538 GLN B CD 1 +ATOM 10098 O OE1 . GLN B 1 538 ? 5.070 -32.089 104.111 1.00 42.20 ? 538 GLN B OE1 1 +ATOM 10099 N NE2 . GLN B 1 538 ? 3.361 -33.381 103.413 1.00 39.58 ? 538 GLN B NE2 1 +ATOM 10100 N N . ASP B 1 539 ? -0.036 -30.469 106.338 1.00 46.13 ? 539 ASP B N 1 +ATOM 10101 C CA . ASP B 1 539 ? -1.298 -31.186 106.511 1.00 48.84 ? 539 ASP B CA 1 +ATOM 10102 C C . ASP B 1 539 ? -2.496 -30.292 106.810 1.00 47.82 ? 539 ASP B C 1 +ATOM 10103 O O . ASP B 1 539 ? -3.623 -30.772 106.878 1.00 48.10 ? 539 ASP B O 1 +ATOM 10104 C CB . ASP B 1 539 ? -1.146 -32.213 107.630 1.00 53.51 ? 539 ASP B CB 1 +ATOM 10105 C CG . ASP B 1 539 ? -0.794 -31.569 108.961 1.00 57.00 ? 539 ASP B CG 1 +ATOM 10106 O OD1 . ASP B 1 539 ? 0.154 -30.745 108.992 1.00 57.55 ? 539 ASP B OD1 1 +ATOM 10107 O OD2 . ASP B 1 539 ? -1.465 -31.892 109.971 1.00 60.95 ? 539 ASP B OD2 1 +ATOM 10108 N N . ASP B 1 540 ? -2.254 -29.001 106.991 1.00 47.44 ? 540 ASP B N 1 +ATOM 10109 C CA . ASP B 1 540 ? -3.326 -28.056 107.280 1.00 48.45 ? 540 ASP B CA 1 +ATOM 10110 C C . ASP B 1 540 ? -3.598 -27.178 106.054 1.00 48.08 ? 540 ASP B C 1 +ATOM 10111 O O . ASP B 1 540 ? -2.797 -26.304 105.719 1.00 47.85 ? 540 ASP B O 1 +ATOM 10112 C CB . ASP B 1 540 ? -2.935 -27.203 108.496 1.00 50.31 ? 540 ASP B CB 1 +ATOM 10113 C CG . ASP B 1 540 ? -3.949 -26.112 108.807 1.00 53.98 ? 540 ASP B CG 1 +ATOM 10114 O OD1 . ASP B 1 540 ? -5.133 -26.251 108.421 1.00 56.44 ? 540 ASP B OD1 1 +ATOM 10115 O OD2 . ASP B 1 540 ? -3.559 -25.114 109.456 1.00 56.00 ? 540 ASP B OD2 1 +ATOM 10116 N N . ASP B 1 541 ? -4.733 -27.411 105.397 1.00 47.97 ? 541 ASP B N 1 +ATOM 10117 C CA . ASP B 1 541 ? -5.109 -26.662 104.195 1.00 48.73 ? 541 ASP B CA 1 +ATOM 10118 C C . ASP B 1 541 ? -5.082 -25.142 104.351 1.00 49.21 ? 541 ASP B C 1 +ATOM 10119 O O . ASP B 1 541 ? -4.750 -24.428 103.406 1.00 50.09 ? 541 ASP B O 1 +ATOM 10120 C CB . ASP B 1 541 ? -6.491 -27.104 103.694 1.00 49.20 ? 541 ASP B CB 1 +ATOM 10121 C CG . ASP B 1 541 ? -6.515 -28.570 103.251 1.00 51.27 ? 541 ASP B CG 1 +ATOM 10122 O OD1 . ASP B 1 541 ? -5.450 -29.100 102.866 1.00 51.94 ? 541 ASP B OD1 1 +ATOM 10123 O OD2 . ASP B 1 541 ? -7.601 -29.192 103.271 1.00 52.32 ? 541 ASP B OD2 1 +ATOM 10124 N N . ASP B 1 542 ? -5.426 -24.650 105.538 1.00 49.05 ? 542 ASP B N 1 +ATOM 10125 C CA . ASP B 1 542 ? -5.419 -23.214 105.811 1.00 48.08 ? 542 ASP B CA 1 +ATOM 10126 C C . ASP B 1 542 ? -4.077 -22.584 105.464 1.00 46.34 ? 542 ASP B C 1 +ATOM 10127 O O . ASP B 1 542 ? -4.016 -21.480 104.923 1.00 45.35 ? 542 ASP B O 1 +ATOM 10128 C CB . ASP B 1 542 ? -5.697 -22.962 107.291 1.00 51.25 ? 542 ASP B CB 1 +ATOM 10129 C CG . ASP B 1 542 ? -7.163 -23.106 107.649 1.00 55.44 ? 542 ASP B CG 1 +ATOM 10130 O OD1 . ASP B 1 542 ? -7.860 -23.969 107.055 1.00 56.65 ? 542 ASP B OD1 1 +ATOM 10131 O OD2 . ASP B 1 542 ? -7.611 -22.355 108.548 1.00 56.98 ? 542 ASP B OD2 1 +ATOM 10132 N N . MET B 1 543 ? -3.007 -23.299 105.789 1.00 45.12 ? 543 MET B N 1 +ATOM 10133 C CA . MET B 1 543 ? -1.643 -22.830 105.569 1.00 43.74 ? 543 MET B CA 1 +ATOM 10134 C C . MET B 1 543 ? -1.298 -22.448 104.135 1.00 42.91 ? 543 MET B C 1 +ATOM 10135 O O . MET B 1 543 ? -0.417 -21.621 103.915 1.00 42.86 ? 543 MET B O 1 +ATOM 10136 C CB . MET B 1 543 ? -0.651 -23.883 106.063 1.00 45.02 ? 543 MET B CB 1 +ATOM 10137 C CG . MET B 1 543 ? -0.808 -24.251 107.526 1.00 45.66 ? 543 MET B CG 1 +ATOM 10138 S SD . MET B 1 543 ? -0.529 -22.848 108.602 1.00 49.93 ? 543 MET B SD 1 +ATOM 10139 C CE . MET B 1 543 ? -2.267 -22.316 108.961 1.00 47.47 ? 543 MET B CE 1 +ATOM 10140 N N . TYR B 1 544 ? -1.982 -23.036 103.160 1.00 42.15 ? 544 TYR B N 1 +ATOM 10141 C CA . TYR B 1 544 ? -1.694 -22.719 101.766 1.00 41.24 ? 544 TYR B CA 1 +ATOM 10142 C C . TYR B 1 544 ? -2.291 -21.397 101.293 1.00 42.30 ? 544 TYR B C 1 +ATOM 10143 O O . TYR B 1 544 ? -2.101 -21.009 100.148 1.00 42.21 ? 544 TYR B O 1 +ATOM 10144 C CB . TYR B 1 544 ? -2.158 -23.853 100.859 1.00 38.82 ? 544 TYR B CB 1 +ATOM 10145 C CG . TYR B 1 544 ? -1.450 -25.150 101.138 1.00 38.76 ? 544 TYR B CG 1 +ATOM 10146 C CD1 . TYR B 1 544 ? -1.805 -25.942 102.234 1.00 37.94 ? 544 TYR B CD1 1 +ATOM 10147 C CD2 . TYR B 1 544 ? -0.401 -25.577 100.329 1.00 37.93 ? 544 TYR B CD2 1 +ATOM 10148 C CE1 . TYR B 1 544 ? -1.135 -27.123 102.513 1.00 36.46 ? 544 TYR B CE1 1 +ATOM 10149 C CE2 . TYR B 1 544 ? 0.276 -26.755 100.602 1.00 37.88 ? 544 TYR B CE2 1 +ATOM 10150 C CZ . TYR B 1 544 ? -0.098 -27.524 101.694 1.00 37.09 ? 544 TYR B CZ 1 +ATOM 10151 O OH . TYR B 1 544 ? 0.555 -28.700 101.957 1.00 37.23 ? 544 TYR B OH 1 +ATOM 10152 N N . ARG B 1 545 ? -3.006 -20.704 102.173 1.00 44.53 ? 545 ARG B N 1 +ATOM 10153 C CA . ARG B 1 545 ? -3.596 -19.413 101.828 1.00 45.70 ? 545 ARG B CA 1 +ATOM 10154 C C . ARG B 1 545 ? -2.912 -18.285 102.603 1.00 45.59 ? 545 ARG B C 1 +ATOM 10155 O O . ARG B 1 545 ? -3.217 -17.115 102.404 1.00 45.61 ? 545 ARG B O 1 +ATOM 10156 C CB . ARG B 1 545 ? -5.102 -19.401 102.132 1.00 47.08 ? 545 ARG B CB 1 +ATOM 10157 C CG . ARG B 1 545 ? -5.934 -20.368 101.293 1.00 49.53 ? 545 ARG B CG 1 +ATOM 10158 C CD . ARG B 1 545 ? -5.726 -20.131 99.807 1.00 50.97 ? 545 ARG B CD 1 +ATOM 10159 N NE . ARG B 1 545 ? -6.197 -18.816 99.373 1.00 53.28 ? 545 ARG B NE 1 +ATOM 10160 C CZ . ARG B 1 545 ? -7.474 -18.493 99.187 1.00 53.41 ? 545 ARG B CZ 1 +ATOM 10161 N NH1 . ARG B 1 545 ? -8.433 -19.385 99.398 1.00 54.15 ? 545 ARG B NH1 1 +ATOM 10162 N NH2 . ARG B 1 545 ? -7.793 -17.276 98.775 1.00 53.84 ? 545 ARG B NH2 1 +ATOM 10163 N N . ILE B 1 546 ? -1.997 -18.638 103.497 1.00 45.42 ? 546 ILE B N 1 +ATOM 10164 C CA . ILE B 1 546 ? -1.284 -17.631 104.273 1.00 46.96 ? 546 ILE B CA 1 +ATOM 10165 C C . ILE B 1 546 ? -0.031 -17.243 103.494 1.00 47.52 ? 546 ILE B C 1 +ATOM 10166 O O . ILE B 1 546 ? 0.856 -18.064 103.286 1.00 48.76 ? 546 ILE B O 1 +ATOM 10167 C CB . ILE B 1 546 ? -0.894 -18.171 105.681 1.00 47.36 ? 546 ILE B CB 1 +ATOM 10168 C CG1 . ILE B 1 546 ? -2.079 -18.062 106.648 1.00 47.18 ? 546 ILE B CG1 1 +ATOM 10169 C CG2 . ILE B 1 546 ? 0.258 -17.366 106.248 1.00 46.97 ? 546 ILE B CG2 1 +ATOM 10170 C CD1 . ILE B 1 546 ? -3.386 -18.634 106.144 1.00 49.02 ? 546 ILE B CD1 1 +ATOM 10171 N N . GLU B 1 547 ? 0.047 -15.991 103.059 1.00 48.76 ? 547 GLU B N 1 +ATOM 10172 C CA . GLU B 1 547 ? 1.201 -15.561 102.279 1.00 49.76 ? 547 GLU B CA 1 +ATOM 10173 C C . GLU B 1 547 ? 1.929 -14.325 102.782 1.00 48.01 ? 547 GLU B C 1 +ATOM 10174 O O . GLU B 1 547 ? 2.948 -13.933 102.214 1.00 48.63 ? 547 GLU B O 1 +ATOM 10175 C CB . GLU B 1 547 ? 0.787 -15.349 100.822 1.00 52.20 ? 547 GLU B CB 1 +ATOM 10176 C CG . GLU B 1 547 ? 0.051 -16.541 100.228 1.00 55.75 ? 547 GLU B CG 1 +ATOM 10177 C CD . GLU B 1 547 ? -0.026 -16.480 98.720 1.00 58.79 ? 547 GLU B CD 1 +ATOM 10178 O OE1 . GLU B 1 547 ? -0.427 -15.424 98.178 1.00 60.80 ? 547 GLU B OE1 1 +ATOM 10179 O OE2 . GLU B 1 547 ? 0.313 -17.492 98.075 1.00 59.96 ? 547 GLU B OE2 1 +ATOM 10180 N N . ASP B 1 548 ? 1.411 -13.695 103.827 1.00 45.87 ? 548 ASP B N 1 +ATOM 10181 C CA . ASP B 1 548 ? 2.078 -12.523 104.381 1.00 44.41 ? 548 ASP B CA 1 +ATOM 10182 C C . ASP B 1 548 ? 2.797 -12.904 105.678 1.00 42.55 ? 548 ASP B C 1 +ATOM 10183 O O . ASP B 1 548 ? 3.045 -12.069 106.539 1.00 42.69 ? 548 ASP B O 1 +ATOM 10184 C CB . ASP B 1 548 ? 1.079 -11.389 104.637 1.00 46.04 ? 548 ASP B CB 1 +ATOM 10185 C CG . ASP B 1 548 ? -0.187 -11.863 105.323 1.00 48.30 ? 548 ASP B CG 1 +ATOM 10186 O OD1 . ASP B 1 548 ? -0.176 -12.958 105.926 1.00 48.72 ? 548 ASP B OD1 1 +ATOM 10187 O OD2 . ASP B 1 548 ? -1.196 -11.125 105.264 1.00 51.55 ? 548 ASP B OD2 1 +ATOM 10188 N N . GLU B 1 549 ? 3.112 -14.188 105.807 1.00 40.57 ? 549 GLU B N 1 +ATOM 10189 C CA . GLU B 1 549 ? 3.832 -14.712 106.966 1.00 38.87 ? 549 GLU B CA 1 +ATOM 10190 C C . GLU B 1 549 ? 4.819 -15.734 106.435 1.00 38.56 ? 549 GLU B C 1 +ATOM 10191 O O . GLU B 1 549 ? 4.587 -16.344 105.382 1.00 38.36 ? 549 GLU B O 1 +ATOM 10192 C CB . GLU B 1 549 ? 2.890 -15.429 107.938 1.00 37.87 ? 549 GLU B CB 1 +ATOM 10193 C CG . GLU B 1 549 ? 1.986 -14.522 108.757 1.00 40.11 ? 549 GLU B CG 1 +ATOM 10194 C CD . GLU B 1 549 ? 0.975 -15.306 109.572 1.00 39.17 ? 549 GLU B CD 1 +ATOM 10195 O OE1 . GLU B 1 549 ? 1.359 -16.337 110.166 1.00 38.46 ? 549 GLU B OE1 1 +ATOM 10196 O OE2 . GLU B 1 549 ? -0.203 -14.892 109.625 1.00 41.37 ? 549 GLU B OE2 1 +ATOM 10197 N N . TYR B 1 550 ? 5.931 -15.906 107.135 1.00 36.39 ? 550 TYR B N 1 +ATOM 10198 C CA . TYR B 1 550 ? 6.890 -16.917 106.728 1.00 36.26 ? 550 TYR B CA 1 +ATOM 10199 C C . TYR B 1 550 ? 7.709 -17.435 107.897 1.00 36.52 ? 550 TYR B C 1 +ATOM 10200 O O . TYR B 1 550 ? 7.862 -16.757 108.913 1.00 35.90 ? 550 TYR B O 1 +ATOM 10201 C CB . TYR B 1 550 ? 7.804 -16.422 105.598 1.00 34.12 ? 550 TYR B CB 1 +ATOM 10202 C CG . TYR B 1 550 ? 8.747 -15.285 105.912 1.00 34.49 ? 550 TYR B CG 1 +ATOM 10203 C CD1 . TYR B 1 550 ? 8.334 -13.960 105.807 1.00 35.54 ? 550 TYR B CD1 1 +ATOM 10204 C CD2 . TYR B 1 550 ? 10.088 -15.532 106.225 1.00 34.55 ? 550 TYR B CD2 1 +ATOM 10205 C CE1 . TYR B 1 550 ? 9.241 -12.902 105.995 1.00 34.78 ? 550 TYR B CE1 1 +ATOM 10206 C CE2 . TYR B 1 550 ? 10.992 -14.494 106.417 1.00 32.90 ? 550 TYR B CE2 1 +ATOM 10207 C CZ . TYR B 1 550 ? 10.569 -13.181 106.297 1.00 33.87 ? 550 TYR B CZ 1 +ATOM 10208 O OH . TYR B 1 550 ? 11.474 -12.153 106.449 1.00 31.38 ? 550 TYR B OH 1 +ATOM 10209 N N . MET B 1 551 ? 8.193 -18.667 107.751 1.00 37.28 ? 551 MET B N 1 +ATOM 10210 C CA . MET B 1 551 ? 9.001 -19.327 108.773 1.00 37.02 ? 551 MET B CA 1 +ATOM 10211 C C . MET B 1 551 ? 10.474 -19.134 108.452 1.00 36.36 ? 551 MET B C 1 +ATOM 10212 O O . MET B 1 551 ? 10.880 -19.196 107.290 1.00 37.12 ? 551 MET B O 1 +ATOM 10213 C CB . MET B 1 551 ? 8.738 -20.832 108.791 1.00 38.71 ? 551 MET B CB 1 +ATOM 10214 C CG . MET B 1 551 ? 7.321 -21.269 109.091 1.00 43.13 ? 551 MET B CG 1 +ATOM 10215 S SD . MET B 1 551 ? 6.899 -21.138 110.823 1.00 51.34 ? 551 MET B SD 1 +ATOM 10216 C CE . MET B 1 551 ? 7.887 -22.493 111.538 1.00 46.92 ? 551 MET B CE 1 +ATOM 10217 N N . VAL B 1 552 ? 11.271 -18.894 109.482 1.00 35.54 ? 552 VAL B N 1 +ATOM 10218 C CA . VAL B 1 552 ? 12.707 -18.749 109.303 1.00 35.35 ? 552 VAL B CA 1 +ATOM 10219 C C . VAL B 1 552 ? 13.207 -20.007 109.980 1.00 36.91 ? 552 VAL B C 1 +ATOM 10220 O O . VAL B 1 552 ? 13.212 -20.105 111.202 1.00 38.39 ? 552 VAL B O 1 +ATOM 10221 C CB . VAL B 1 552 ? 13.253 -17.508 110.022 1.00 34.54 ? 552 VAL B CB 1 +ATOM 10222 C CG1 . VAL B 1 552 ? 14.761 -17.432 109.855 1.00 33.62 ? 552 VAL B CG1 1 +ATOM 10223 C CG2 . VAL B 1 552 ? 12.586 -16.254 109.457 1.00 32.82 ? 552 VAL B CG2 1 +ATOM 10224 N N . GLY B 1 553 ? 13.600 -20.985 109.177 1.00 38.58 ? 553 GLY B N 1 +ATOM 10225 C CA . GLY B 1 553 ? 14.047 -22.237 109.738 1.00 38.95 ? 553 GLY B CA 1 +ATOM 10226 C C . GLY B 1 553 ? 12.812 -22.981 110.214 1.00 40.80 ? 553 GLY B C 1 +ATOM 10227 O O . GLY B 1 553 ? 11.701 -22.765 109.725 1.00 42.00 ? 553 GLY B O 1 +ATOM 10228 N N . LYS B 1 554 ? 12.992 -23.840 111.200 1.00 41.56 ? 554 LYS B N 1 +ATOM 10229 C CA . LYS B 1 554 ? 11.886 -24.635 111.709 1.00 41.74 ? 554 LYS B CA 1 +ATOM 10230 C C . LYS B 1 554 ? 11.264 -24.021 112.956 1.00 40.78 ? 554 LYS B C 1 +ATOM 10231 O O . LYS B 1 554 ? 10.143 -24.365 113.336 1.00 41.07 ? 554 LYS B O 1 +ATOM 10232 C CB . LYS B 1 554 ? 12.425 -26.029 112.022 1.00 42.36 ? 554 LYS B CB 1 +ATOM 10233 C CG . LYS B 1 554 ? 11.407 -27.067 112.386 1.00 45.58 ? 554 LYS B CG 1 +ATOM 10234 C CD . LYS B 1 554 ? 12.106 -28.422 112.527 1.00 47.60 ? 554 LYS B CD 1 +ATOM 10235 C CE . LYS B 1 554 ? 11.113 -29.541 112.792 1.00 49.49 ? 554 LYS B CE 1 +ATOM 10236 N NZ . LYS B 1 554 ? 10.178 -29.743 111.640 1.00 50.96 ? 554 LYS B NZ 1 +ATOM 10237 N N . TYR B 1 555 ? 11.980 -23.077 113.561 1.00 40.11 ? 555 TYR B N 1 +ATOM 10238 C CA . TYR B 1 555 ? 11.544 -22.483 114.815 1.00 39.96 ? 555 TYR B CA 1 +ATOM 10239 C C . TYR B 1 555 ? 10.913 -21.101 114.868 1.00 40.71 ? 555 TYR B C 1 +ATOM 10240 O O . TYR B 1 555 ? 10.132 -20.820 115.782 1.00 42.32 ? 555 TYR B O 1 +ATOM 10241 C CB . TYR B 1 555 ? 12.720 -22.452 115.789 1.00 39.00 ? 555 TYR B CB 1 +ATOM 10242 C CG . TYR B 1 555 ? 13.541 -23.715 115.854 1.00 38.67 ? 555 TYR B CG 1 +ATOM 10243 C CD1 . TYR B 1 555 ? 12.927 -24.970 115.906 1.00 38.68 ? 555 TYR B CD1 1 +ATOM 10244 C CD2 . TYR B 1 555 ? 14.936 -23.653 115.937 1.00 38.23 ? 555 TYR B CD2 1 +ATOM 10245 C CE1 . TYR B 1 555 ? 13.684 -26.131 116.048 1.00 39.06 ? 555 TYR B CE1 1 +ATOM 10246 C CE2 . TYR B 1 555 ? 15.699 -24.804 116.083 1.00 37.40 ? 555 TYR B CE2 1 +ATOM 10247 C CZ . TYR B 1 555 ? 15.067 -26.038 116.141 1.00 38.80 ? 555 TYR B CZ 1 +ATOM 10248 O OH . TYR B 1 555 ? 15.807 -27.186 116.319 1.00 41.23 ? 555 TYR B OH 1 +ATOM 10249 N N . LEU B 1 556 ? 11.241 -20.233 113.921 1.00 39.23 ? 556 LEU B N 1 +ATOM 10250 C CA . LEU B 1 556 ? 10.740 -18.874 113.992 1.00 38.20 ? 556 LEU B CA 1 +ATOM 10251 C C . LEU B 1 556 ? 9.678 -18.462 112.980 1.00 38.83 ? 556 LEU B C 1 +ATOM 10252 O O . LEU B 1 556 ? 9.863 -18.619 111.770 1.00 39.69 ? 556 LEU B O 1 +ATOM 10253 C CB . LEU B 1 556 ? 11.946 -17.942 113.925 1.00 36.78 ? 556 LEU B CB 1 +ATOM 10254 C CG . LEU B 1 556 ? 11.808 -16.462 114.257 1.00 39.23 ? 556 LEU B CG 1 +ATOM 10255 C CD1 . LEU B 1 556 ? 13.189 -15.894 114.579 1.00 37.40 ? 556 LEU B CD1 1 +ATOM 10256 C CD2 . LEU B 1 556 ? 11.170 -15.717 113.084 1.00 38.56 ? 556 LEU B CD2 1 +ATOM 10257 N N . LEU B 1 557 ? 8.559 -17.943 113.485 1.00 38.58 ? 557 LEU B N 1 +ATOM 10258 C CA . LEU B 1 557 ? 7.471 -17.477 112.623 1.00 38.68 ? 557 LEU B CA 1 +ATOM 10259 C C . LEU B 1 557 ? 7.498 -15.953 112.611 1.00 37.66 ? 557 LEU B C 1 +ATOM 10260 O O . LEU B 1 557 ? 7.458 -15.316 113.661 1.00 37.47 ? 557 LEU B O 1 +ATOM 10261 C CB . LEU B 1 557 ? 6.106 -17.963 113.129 1.00 39.15 ? 557 LEU B CB 1 +ATOM 10262 C CG . LEU B 1 557 ? 4.927 -17.664 112.183 1.00 41.23 ? 557 LEU B CG 1 +ATOM 10263 C CD1 . LEU B 1 557 ? 3.745 -18.564 112.521 1.00 40.46 ? 557 LEU B CD1 1 +ATOM 10264 C CD2 . LEU B 1 557 ? 4.526 -16.206 112.293 1.00 41.23 ? 557 LEU B CD2 1 +ATOM 10265 N N . TYR B 1 558 ? 7.575 -15.377 111.420 1.00 36.49 ? 558 TYR B N 1 +ATOM 10266 C CA . TYR B 1 558 ? 7.614 -13.932 111.275 1.00 35.92 ? 558 TYR B CA 1 +ATOM 10267 C C . TYR B 1 558 ? 6.437 -13.473 110.437 1.00 37.02 ? 558 TYR B C 1 +ATOM 10268 O O . TYR B 1 558 ? 6.234 -13.963 109.324 1.00 38.41 ? 558 TYR B O 1 +ATOM 10269 C CB . TYR B 1 558 ? 8.929 -13.512 110.615 1.00 34.86 ? 558 TYR B CB 1 +ATOM 10270 C CG . TYR B 1 558 ? 9.090 -12.018 110.420 1.00 35.19 ? 558 TYR B CG 1 +ATOM 10271 C CD1 . TYR B 1 558 ? 8.723 -11.120 111.423 1.00 35.58 ? 558 TYR B CD1 1 +ATOM 10272 C CD2 . TYR B 1 558 ? 9.648 -11.503 109.248 1.00 33.94 ? 558 TYR B CD2 1 +ATOM 10273 C CE1 . TYR B 1 558 ? 8.909 -9.744 111.269 1.00 34.14 ? 558 TYR B CE1 1 +ATOM 10274 C CE2 . TYR B 1 558 ? 9.838 -10.131 109.084 1.00 34.74 ? 558 TYR B CE2 1 +ATOM 10275 C CZ . TYR B 1 558 ? 9.465 -9.258 110.099 1.00 35.28 ? 558 TYR B CZ 1 +ATOM 10276 O OH . TYR B 1 558 ? 9.633 -7.900 109.940 1.00 35.33 ? 558 TYR B OH 1 +ATOM 10277 N N . ALA B 1 559 ? 5.650 -12.551 110.987 1.00 37.19 ? 559 ALA B N 1 +ATOM 10278 C CA . ALA B 1 559 ? 4.488 -12.010 110.290 1.00 36.41 ? 559 ALA B CA 1 +ATOM 10279 C C . ALA B 1 559 ? 4.736 -10.524 110.068 1.00 36.57 ? 559 ALA B C 1 +ATOM 10280 O O . ALA B 1 559 ? 4.249 -9.694 110.824 1.00 37.32 ? 559 ALA B O 1 +ATOM 10281 C CB . ALA B 1 559 ? 3.241 -12.214 111.124 1.00 35.51 ? 559 ALA B CB 1 +ATOM 10282 N N . PRO B 1 560 ? 5.502 -10.173 109.024 1.00 36.39 ? 560 PRO B N 1 +ATOM 10283 C CA . PRO B 1 560 ? 5.786 -8.763 108.756 1.00 37.25 ? 560 PRO B CA 1 +ATOM 10284 C C . PRO B 1 560 ? 4.543 -7.928 108.482 1.00 39.30 ? 560 PRO B C 1 +ATOM 10285 O O . PRO B 1 560 ? 3.561 -8.411 107.918 1.00 40.59 ? 560 PRO B O 1 +ATOM 10286 C CB . PRO B 1 560 ? 6.729 -8.825 107.554 1.00 36.15 ? 560 PRO B CB 1 +ATOM 10287 C CG . PRO B 1 560 ? 6.249 -10.045 106.822 1.00 36.29 ? 560 PRO B CG 1 +ATOM 10288 C CD . PRO B 1 560 ? 6.041 -11.033 107.954 1.00 35.63 ? 560 PRO B CD 1 +ATOM 10289 N N . ILE B 1 561 ? 4.588 -6.673 108.908 1.00 41.55 ? 561 ILE B N 1 +ATOM 10290 C CA . ILE B 1 561 ? 3.485 -5.758 108.695 1.00 42.72 ? 561 ILE B CA 1 +ATOM 10291 C C . ILE B 1 561 ? 3.618 -5.213 107.280 1.00 43.63 ? 561 ILE B C 1 +ATOM 10292 O O . ILE B 1 561 ? 4.538 -4.452 106.984 1.00 43.23 ? 561 ILE B O 1 +ATOM 10293 C CB . ILE B 1 561 ? 3.533 -4.620 109.721 1.00 43.06 ? 561 ILE B CB 1 +ATOM 10294 C CG1 . ILE B 1 561 ? 3.257 -5.203 111.113 1.00 43.56 ? 561 ILE B CG1 1 +ATOM 10295 C CG2 . ILE B 1 561 ? 2.537 -3.529 109.348 1.00 42.14 ? 561 ILE B CG2 1 +ATOM 10296 C CD1 . ILE B 1 561 ? 3.300 -4.199 112.234 1.00 43.86 ? 561 ILE B CD1 1 +ATOM 10297 N N . VAL B 1 562 ? 2.696 -5.618 106.411 1.00 43.78 ? 562 VAL B N 1 +ATOM 10298 C CA . VAL B 1 562 ? 2.724 -5.194 105.022 1.00 45.06 ? 562 VAL B CA 1 +ATOM 10299 C C . VAL B 1 562 ? 1.624 -4.201 104.653 1.00 47.62 ? 562 VAL B C 1 +ATOM 10300 O O . VAL B 1 562 ? 1.122 -4.212 103.529 1.00 47.39 ? 562 VAL B O 1 +ATOM 10301 C CB . VAL B 1 562 ? 2.636 -6.417 104.087 1.00 44.18 ? 562 VAL B CB 1 +ATOM 10302 C CG1 . VAL B 1 562 ? 3.834 -7.315 104.317 1.00 43.57 ? 562 VAL B CG1 1 +ATOM 10303 C CG2 . VAL B 1 562 ? 1.348 -7.185 104.335 1.00 39.48 ? 562 VAL B CG2 1 +ATOM 10304 N N . SER B 1 563 ? 1.253 -3.351 105.606 1.00 50.58 ? 563 SER B N 1 +ATOM 10305 C CA . SER B 1 563 ? 0.228 -2.331 105.388 1.00 54.92 ? 563 SER B CA 1 +ATOM 10306 C C . SER B 1 563 ? 0.567 -1.115 106.248 1.00 57.16 ? 563 SER B C 1 +ATOM 10307 O O . SER B 1 563 ? 1.543 -1.129 107.000 1.00 57.31 ? 563 SER B O 1 +ATOM 10308 C CB . SER B 1 563 ? -1.155 -2.858 105.772 1.00 54.17 ? 563 SER B CB 1 +ATOM 10309 O OG . SER B 1 563 ? -1.266 -2.995 107.178 1.00 56.83 ? 563 SER B OG 1 +ATOM 10310 N N . LYS B 1 564 ? -0.240 -0.066 106.145 1.00 60.25 ? 564 LYS B N 1 +ATOM 10311 C CA . LYS B 1 564 ? 0.006 1.147 106.911 1.00 62.34 ? 564 LYS B CA 1 +ATOM 10312 C C . LYS B 1 564 ? -0.438 1.001 108.364 1.00 63.52 ? 564 LYS B C 1 +ATOM 10313 O O . LYS B 1 564 ? -0.048 1.798 109.215 1.00 64.52 ? 564 LYS B O 1 +ATOM 10314 C CB . LYS B 1 564 ? -0.704 2.340 106.263 1.00 63.33 ? 564 LYS B CB 1 +ATOM 10315 C CG . LYS B 1 564 ? -0.206 2.698 104.853 1.00 65.33 ? 564 LYS B CG 1 +ATOM 10316 C CD . LYS B 1 564 ? -1.078 2.103 103.727 1.00 66.00 ? 564 LYS B CD 1 +ATOM 10317 C CE . LYS B 1 564 ? -0.993 0.578 103.643 1.00 66.34 ? 564 LYS B CE 1 +ATOM 10318 N NZ . LYS B 1 564 ? -1.765 0.001 102.503 1.00 65.96 ? 564 LYS B NZ 1 +ATOM 10319 N N . GLU B 1 565 ? -1.245 -0.018 108.648 1.00 64.85 ? 565 GLU B N 1 +ATOM 10320 C CA . GLU B 1 565 ? -1.727 -0.257 110.010 1.00 66.30 ? 565 GLU B CA 1 +ATOM 10321 C C . GLU B 1 565 ? -0.582 -0.312 111.021 1.00 65.83 ? 565 GLU B C 1 +ATOM 10322 O O . GLU B 1 565 ? 0.588 -0.436 110.654 1.00 66.37 ? 565 GLU B O 1 +ATOM 10323 C CB . GLU B 1 565 ? -2.488 -1.581 110.095 1.00 68.40 ? 565 GLU B CB 1 +ATOM 10324 C CG . GLU B 1 565 ? -3.754 -1.684 109.271 1.00 71.81 ? 565 GLU B CG 1 +ATOM 10325 C CD . GLU B 1 565 ? -4.449 -3.031 109.477 1.00 75.04 ? 565 GLU B CD 1 +ATOM 10326 O OE1 . GLU B 1 565 ? -3.819 -4.083 109.197 1.00 75.48 ? 565 GLU B OE1 1 +ATOM 10327 O OE2 . GLU B 1 565 ? -5.620 -3.036 109.927 1.00 75.75 ? 565 GLU B OE2 1 +ATOM 10328 N N . GLU B 1 566 ? -0.935 -0.244 112.300 1.00 65.07 ? 566 GLU B N 1 +ATOM 10329 C CA . GLU B 1 566 ? 0.054 -0.291 113.368 1.00 64.53 ? 566 GLU B CA 1 +ATOM 10330 C C . GLU B 1 566 ? 0.183 -1.721 113.898 1.00 61.90 ? 566 GLU B C 1 +ATOM 10331 O O . GLU B 1 566 ? 1.177 -2.080 114.532 1.00 60.41 ? 566 GLU B O 1 +ATOM 10332 C CB . GLU B 1 566 ? -0.360 0.658 114.490 1.00 67.90 ? 566 GLU B CB 1 +ATOM 10333 C CG . GLU B 1 566 ? 0.712 0.871 115.539 1.00 73.58 ? 566 GLU B CG 1 +ATOM 10334 C CD . GLU B 1 566 ? 0.382 2.019 116.480 1.00 77.39 ? 566 GLU B CD 1 +ATOM 10335 O OE1 . GLU B 1 566 ? -0.663 1.943 117.173 1.00 79.10 ? 566 GLU B OE1 1 +ATOM 10336 O OE2 . GLU B 1 566 ? 1.168 2.995 116.521 1.00 78.12 ? 566 GLU B OE2 1 +ATOM 10337 N N . SER B 1 567 ? -0.837 -2.528 113.629 1.00 58.72 ? 567 SER B N 1 +ATOM 10338 C CA . SER B 1 567 ? -0.858 -3.922 114.042 1.00 55.11 ? 567 SER B CA 1 +ATOM 10339 C C . SER B 1 567 ? -1.580 -4.708 112.960 1.00 52.22 ? 567 SER B C 1 +ATOM 10340 O O . SER B 1 567 ? -2.227 -4.131 112.089 1.00 51.89 ? 567 SER B O 1 +ATOM 10341 C CB . SER B 1 567 ? -1.594 -4.081 115.370 1.00 56.01 ? 567 SER B CB 1 +ATOM 10342 O OG . SER B 1 567 ? -2.977 -3.844 115.203 1.00 59.12 ? 567 SER B OG 1 +ATOM 10343 N N . ARG B 1 568 ? -1.479 -6.028 113.019 1.00 49.26 ? 568 ARG B N 1 +ATOM 10344 C CA . ARG B 1 568 ? -2.114 -6.877 112.018 1.00 44.70 ? 568 ARG B CA 1 +ATOM 10345 C C . ARG B 1 568 ? -2.596 -8.175 112.641 1.00 43.29 ? 568 ARG B C 1 +ATOM 10346 O O . ARG B 1 568 ? -2.264 -8.498 113.783 1.00 43.28 ? 568 ARG B O 1 +ATOM 10347 C CB . ARG B 1 568 ? -1.114 -7.221 110.918 1.00 41.18 ? 568 ARG B CB 1 +ATOM 10348 C CG . ARG B 1 568 ? 0.138 -7.891 111.470 1.00 40.14 ? 568 ARG B CG 1 +ATOM 10349 C CD . ARG B 1 568 ? 0.904 -8.636 110.398 1.00 38.14 ? 568 ARG B CD 1 +ATOM 10350 N NE . ARG B 1 568 ? 0.193 -9.832 109.965 1.00 35.17 ? 568 ARG B NE 1 +ATOM 10351 C CZ . ARG B 1 568 ? 0.580 -10.595 108.951 1.00 35.34 ? 568 ARG B CZ 1 +ATOM 10352 N NH1 . ARG B 1 568 ? 1.676 -10.274 108.269 1.00 33.15 ? 568 ARG B NH1 1 +ATOM 10353 N NH2 . ARG B 1 568 ? -0.121 -11.676 108.618 1.00 33.16 ? 568 ARG B NH2 1 +ATOM 10354 N N . LEU B 1 569 ? -3.382 -8.920 111.880 1.00 41.32 ? 569 LEU B N 1 +ATOM 10355 C CA . LEU B 1 569 ? -3.864 -10.198 112.350 1.00 40.19 ? 569 LEU B CA 1 +ATOM 10356 C C . LEU B 1 569 ? -2.784 -11.208 111.977 1.00 39.77 ? 569 LEU B C 1 +ATOM 10357 O O . LEU B 1 569 ? -2.268 -11.202 110.855 1.00 38.27 ? 569 LEU B O 1 +ATOM 10358 C CB . LEU B 1 569 ? -5.191 -10.557 111.676 1.00 40.11 ? 569 LEU B CB 1 +ATOM 10359 C CG . LEU B 1 569 ? -6.408 -9.723 112.089 1.00 40.50 ? 569 LEU B CG 1 +ATOM 10360 C CD1 . LEU B 1 569 ? -7.633 -10.218 111.339 1.00 41.29 ? 569 LEU B CD1 1 +ATOM 10361 C CD2 . LEU B 1 569 ? -6.634 -9.838 113.596 1.00 40.42 ? 569 LEU B CD2 1 +ATOM 10362 N N . VAL B 1 570 ? -2.427 -12.058 112.932 1.00 38.50 ? 570 VAL B N 1 +ATOM 10363 C CA . VAL B 1 570 ? -1.413 -13.072 112.699 1.00 37.61 ? 570 VAL B CA 1 +ATOM 10364 C C . VAL B 1 570 ? -2.024 -14.450 112.842 1.00 38.44 ? 570 VAL B C 1 +ATOM 10365 O O . VAL B 1 570 ? -2.625 -14.757 113.872 1.00 38.05 ? 570 VAL B O 1 +ATOM 10366 C CB . VAL B 1 570 ? -0.261 -12.956 113.710 1.00 36.63 ? 570 VAL B CB 1 +ATOM 10367 C CG1 . VAL B 1 570 ? 0.743 -14.079 113.485 1.00 33.96 ? 570 VAL B CG1 1 +ATOM 10368 C CG2 . VAL B 1 570 ? 0.405 -11.608 113.579 1.00 33.60 ? 570 VAL B CG2 1 +ATOM 10369 N N . THR B 1 571 ? -1.877 -15.272 111.807 1.00 38.56 ? 571 THR B N 1 +ATOM 10370 C CA . THR B 1 571 ? -2.402 -16.628 111.849 1.00 40.37 ? 571 THR B CA 1 +ATOM 10371 C C . THR B 1 571 ? -1.302 -17.553 112.365 1.00 40.96 ? 571 THR B C 1 +ATOM 10372 O O . THR B 1 571 ? -0.213 -17.625 111.784 1.00 41.20 ? 571 THR B O 1 +ATOM 10373 C CB . THR B 1 571 ? -2.847 -17.111 110.453 1.00 40.85 ? 571 THR B CB 1 +ATOM 10374 O OG1 . THR B 1 571 ? -3.930 -16.298 109.983 1.00 41.41 ? 571 THR B OG1 1 +ATOM 10375 C CG2 . THR B 1 571 ? -3.307 -18.553 110.520 1.00 40.35 ? 571 THR B CG2 1 +ATOM 10376 N N . LEU B 1 572 ? -1.586 -18.240 113.465 1.00 40.24 ? 572 LEU B N 1 +ATOM 10377 C CA . LEU B 1 572 ? -0.629 -19.163 114.057 1.00 41.38 ? 572 LEU B CA 1 +ATOM 10378 C C . LEU B 1 572 ? -0.992 -20.623 113.756 1.00 42.03 ? 572 LEU B C 1 +ATOM 10379 O O . LEU B 1 572 ? -2.147 -21.045 113.915 1.00 40.74 ? 572 LEU B O 1 +ATOM 10380 C CB . LEU B 1 572 ? -0.569 -18.967 115.574 1.00 41.10 ? 572 LEU B CB 1 +ATOM 10381 C CG . LEU B 1 572 ? -0.112 -17.603 116.092 1.00 42.24 ? 572 LEU B CG 1 +ATOM 10382 C CD1 . LEU B 1 572 ? -0.283 -17.571 117.605 1.00 40.45 ? 572 LEU B CD1 1 +ATOM 10383 C CD2 . LEU B 1 572 ? 1.344 -17.341 115.703 1.00 40.43 ? 572 LEU B CD2 1 +ATOM 10384 N N . PRO B 1 573 ? -0.006 -21.414 113.308 1.00 41.26 ? 573 PRO B N 1 +ATOM 10385 C CA . PRO B 1 573 ? -0.267 -22.820 113.003 1.00 41.71 ? 573 PRO B CA 1 +ATOM 10386 C C . PRO B 1 573 ? -0.467 -23.609 114.300 1.00 43.43 ? 573 PRO B C 1 +ATOM 10387 O O . PRO B 1 573 ? -0.308 -23.078 115.399 1.00 40.71 ? 573 PRO B O 1 +ATOM 10388 C CB . PRO B 1 573 ? 1.005 -23.259 112.273 1.00 41.24 ? 573 PRO B CB 1 +ATOM 10389 C CG . PRO B 1 573 ? 1.548 -21.992 111.699 1.00 41.59 ? 573 PRO B CG 1 +ATOM 10390 C CD . PRO B 1 573 ? 1.323 -21.011 112.820 1.00 40.71 ? 573 PRO B CD 1 +ATOM 10391 N N . ARG B 1 574 ? -0.800 -24.886 114.153 1.00 46.84 ? 574 ARG B N 1 +ATOM 10392 C CA . ARG B 1 574 ? -1.005 -25.783 115.285 1.00 49.91 ? 574 ARG B CA 1 +ATOM 10393 C C . ARG B 1 574 ? 0.223 -25.763 116.210 1.00 49.41 ? 574 ARG B C 1 +ATOM 10394 O O . ARG B 1 574 ? 1.355 -25.604 115.747 1.00 49.63 ? 574 ARG B O 1 +ATOM 10395 C CB . ARG B 1 574 ? -1.240 -27.195 114.750 1.00 53.97 ? 574 ARG B CB 1 +ATOM 10396 C CG . ARG B 1 574 ? -1.661 -28.223 115.783 1.00 61.09 ? 574 ARG B CG 1 +ATOM 10397 C CD . ARG B 1 574 ? -2.035 -29.537 115.099 1.00 65.69 ? 574 ARG B CD 1 +ATOM 10398 N NE . ARG B 1 574 ? -2.326 -30.601 116.057 1.00 71.23 ? 574 ARG B NE 1 +ATOM 10399 C CZ . ARG B 1 574 ? -2.682 -31.840 115.719 1.00 74.06 ? 574 ARG B CZ 1 +ATOM 10400 N NH1 . ARG B 1 574 ? -2.793 -32.179 114.437 1.00 75.26 ? 574 ARG B NH1 1 +ATOM 10401 N NH2 . ARG B 1 574 ? -2.930 -32.743 116.663 1.00 74.41 ? 574 ARG B NH2 1 +ATOM 10402 N N . GLY B 1 575 ? 0.000 -25.917 117.514 1.00 48.51 ? 575 GLY B N 1 +ATOM 10403 C CA . GLY B 1 575 ? 1.107 -25.911 118.460 1.00 46.33 ? 575 GLY B CA 1 +ATOM 10404 C C . GLY B 1 575 ? 1.161 -24.643 119.295 1.00 46.14 ? 575 GLY B C 1 +ATOM 10405 O O . GLY B 1 575 ? 0.337 -23.756 119.132 1.00 46.31 ? 575 GLY B O 1 +ATOM 10406 N N . LYS B 1 576 ? 2.127 -24.543 120.197 1.00 45.21 ? 576 LYS B N 1 +ATOM 10407 C CA . LYS B 1 576 ? 2.233 -23.353 121.029 1.00 45.23 ? 576 LYS B CA 1 +ATOM 10408 C C . LYS B 1 576 ? 3.271 -22.385 120.487 1.00 43.67 ? 576 LYS B C 1 +ATOM 10409 O O . LYS B 1 576 ? 4.296 -22.800 119.952 1.00 43.18 ? 576 LYS B O 1 +ATOM 10410 C CB . LYS B 1 576 ? 2.587 -23.735 122.465 1.00 48.20 ? 576 LYS B CB 1 +ATOM 10411 C CG . LYS B 1 576 ? 1.445 -24.370 123.227 1.00 50.47 ? 576 LYS B CG 1 +ATOM 10412 C CD . LYS B 1 576 ? 1.867 -24.720 124.644 1.00 53.17 ? 576 LYS B CD 1 +ATOM 10413 C CE . LYS B 1 576 ? 0.682 -25.212 125.456 1.00 54.98 ? 576 LYS B CE 1 +ATOM 10414 N NZ . LYS B 1 576 ? 1.088 -25.605 126.833 1.00 57.50 ? 576 LYS B NZ 1 +ATOM 10415 N N . TRP B 1 577 ? 2.997 -21.091 120.627 1.00 42.03 ? 577 TRP B N 1 +ATOM 10416 C CA . TRP B 1 577 ? 3.904 -20.070 120.131 1.00 40.41 ? 577 TRP B CA 1 +ATOM 10417 C C . TRP B 1 577 ? 4.215 -19.033 121.188 1.00 40.26 ? 577 TRP B C 1 +ATOM 10418 O O . TRP B 1 577 ? 3.345 -18.594 121.935 1.00 42.45 ? 577 TRP B O 1 +ATOM 10419 C CB . TRP B 1 577 ? 3.316 -19.408 118.888 1.00 38.31 ? 577 TRP B CB 1 +ATOM 10420 C CG . TRP B 1 577 ? 3.062 -20.387 117.808 1.00 36.75 ? 577 TRP B CG 1 +ATOM 10421 C CD1 . TRP B 1 577 ? 1.958 -21.188 117.660 1.00 37.49 ? 577 TRP B CD1 1 +ATOM 10422 C CD2 . TRP B 1 577 ? 3.956 -20.732 116.745 1.00 36.63 ? 577 TRP B CD2 1 +ATOM 10423 N NE1 . TRP B 1 577 ? 2.117 -22.013 116.563 1.00 37.37 ? 577 TRP B NE1 1 +ATOM 10424 C CE2 . TRP B 1 577 ? 3.334 -21.751 115.986 1.00 35.95 ? 577 TRP B CE2 1 +ATOM 10425 C CE3 . TRP B 1 577 ? 5.223 -20.278 116.357 1.00 37.03 ? 577 TRP B CE3 1 +ATOM 10426 C CZ2 . TRP B 1 577 ? 3.938 -22.321 114.867 1.00 36.10 ? 577 TRP B CZ2 1 +ATOM 10427 C CZ3 . TRP B 1 577 ? 5.824 -20.846 115.240 1.00 36.40 ? 577 TRP B CZ3 1 +ATOM 10428 C CH2 . TRP B 1 577 ? 5.180 -21.857 114.509 1.00 36.69 ? 577 TRP B CH2 1 +ATOM 10429 N N . TYR B 1 578 ? 5.481 -18.658 121.242 1.00 39.86 ? 578 TYR B N 1 +ATOM 10430 C CA . TYR B 1 578 ? 5.989 -17.696 122.205 1.00 39.86 ? 578 TYR B CA 1 +ATOM 10431 C C . TYR B 1 578 ? 6.226 -16.346 121.540 1.00 40.15 ? 578 TYR B C 1 +ATOM 10432 O O . TYR B 1 578 ? 6.964 -16.251 120.556 1.00 40.71 ? 578 TYR B O 1 +ATOM 10433 C CB . TYR B 1 578 ? 7.305 -18.243 122.785 1.00 39.43 ? 578 TYR B CB 1 +ATOM 10434 C CG . TYR B 1 578 ? 8.113 -17.281 123.623 1.00 37.28 ? 578 TYR B CG 1 +ATOM 10435 C CD1 . TYR B 1 578 ? 7.745 -16.978 124.936 1.00 37.71 ? 578 TYR B CD1 1 +ATOM 10436 C CD2 . TYR B 1 578 ? 9.256 -16.684 123.104 1.00 36.03 ? 578 TYR B CD2 1 +ATOM 10437 C CE1 . TYR B 1 578 ? 8.510 -16.099 125.715 1.00 35.84 ? 578 TYR B CE1 1 +ATOM 10438 C CE2 . TYR B 1 578 ? 10.016 -15.811 123.859 1.00 36.43 ? 578 TYR B CE2 1 +ATOM 10439 C CZ . TYR B 1 578 ? 9.646 -15.522 125.160 1.00 37.46 ? 578 TYR B CZ 1 +ATOM 10440 O OH . TYR B 1 578 ? 10.435 -14.661 125.886 1.00 38.71 ? 578 TYR B OH 1 +ATOM 10441 N N . ASN B 1 579 ? 5.602 -15.304 122.076 1.00 40.70 ? 579 ASN B N 1 +ATOM 10442 C CA . ASN B 1 579 ? 5.768 -13.965 121.529 1.00 40.94 ? 579 ASN B CA 1 +ATOM 10443 C C . ASN B 1 579 ? 7.169 -13.491 121.932 1.00 41.81 ? 579 ASN B C 1 +ATOM 10444 O O . ASN B 1 579 ? 7.469 -13.334 123.115 1.00 42.02 ? 579 ASN B O 1 +ATOM 10445 C CB . ASN B 1 579 ? 4.691 -13.045 122.097 1.00 39.99 ? 579 ASN B CB 1 +ATOM 10446 C CG . ASN B 1 579 ? 4.778 -11.643 121.551 1.00 42.19 ? 579 ASN B CG 1 +ATOM 10447 O OD1 . ASN B 1 579 ? 5.869 -11.061 121.459 1.00 40.06 ? 579 ASN B OD1 1 +ATOM 10448 N ND2 . ASN B 1 579 ? 3.620 -11.073 121.199 1.00 42.15 ? 579 ASN B ND2 1 +ATOM 10449 N N . TYR B 1 580 ? 8.029 -13.279 120.943 1.00 41.65 ? 580 TYR B N 1 +ATOM 10450 C CA . TYR B 1 580 ? 9.406 -12.857 121.192 1.00 42.56 ? 580 TYR B CA 1 +ATOM 10451 C C . TYR B 1 580 ? 9.592 -11.558 121.985 1.00 43.39 ? 580 TYR B C 1 +ATOM 10452 O O . TYR B 1 580 ? 10.574 -11.412 122.719 1.00 44.74 ? 580 TYR B O 1 +ATOM 10453 C CB . TYR B 1 580 ? 10.151 -12.729 119.856 1.00 41.83 ? 580 TYR B CB 1 +ATOM 10454 C CG . TYR B 1 580 ? 11.578 -12.244 119.986 1.00 40.19 ? 580 TYR B CG 1 +ATOM 10455 C CD1 . TYR B 1 580 ? 12.583 -13.092 120.440 1.00 41.00 ? 580 TYR B CD1 1 +ATOM 10456 C CD2 . TYR B 1 580 ? 11.917 -10.932 119.674 1.00 39.50 ? 580 TYR B CD2 1 +ATOM 10457 C CE1 . TYR B 1 580 ? 13.894 -12.642 120.585 1.00 40.66 ? 580 TYR B CE1 1 +ATOM 10458 C CE2 . TYR B 1 580 ? 13.221 -10.471 119.813 1.00 40.35 ? 580 TYR B CE2 1 +ATOM 10459 C CZ . TYR B 1 580 ? 14.204 -11.332 120.273 1.00 40.68 ? 580 TYR B CZ 1 +ATOM 10460 O OH . TYR B 1 580 ? 15.491 -10.876 120.445 1.00 41.93 ? 580 TYR B OH 1 +ATOM 10461 N N . TRP B 1 581 ? 8.663 -10.617 121.848 1.00 43.33 ? 581 TRP B N 1 +ATOM 10462 C CA . TRP B 1 581 ? 8.805 -9.332 122.532 1.00 42.58 ? 581 TRP B CA 1 +ATOM 10463 C C . TRP B 1 581 ? 8.171 -9.184 123.909 1.00 42.25 ? 581 TRP B C 1 +ATOM 10464 O O . TRP B 1 581 ? 8.734 -8.518 124.774 1.00 41.19 ? 581 TRP B O 1 +ATOM 10465 C CB . TRP B 1 581 ? 8.307 -8.204 121.627 1.00 40.61 ? 581 TRP B CB 1 +ATOM 10466 C CG . TRP B 1 581 ? 8.978 -8.184 120.303 1.00 39.67 ? 581 TRP B CG 1 +ATOM 10467 C CD1 . TRP B 1 581 ? 8.477 -8.657 119.127 1.00 38.76 ? 581 TRP B CD1 1 +ATOM 10468 C CD2 . TRP B 1 581 ? 10.288 -7.677 120.009 1.00 39.78 ? 581 TRP B CD2 1 +ATOM 10469 N NE1 . TRP B 1 581 ? 9.389 -8.475 118.117 1.00 39.66 ? 581 TRP B NE1 1 +ATOM 10470 C CE2 . TRP B 1 581 ? 10.510 -7.874 118.627 1.00 38.77 ? 581 TRP B CE2 1 +ATOM 10471 C CE3 . TRP B 1 581 ? 11.297 -7.079 120.779 1.00 39.23 ? 581 TRP B CE3 1 +ATOM 10472 C CZ2 . TRP B 1 581 ? 11.701 -7.489 117.990 1.00 38.16 ? 581 TRP B CZ2 1 +ATOM 10473 C CZ3 . TRP B 1 581 ? 12.488 -6.695 120.146 1.00 39.33 ? 581 TRP B CZ3 1 +ATOM 10474 C CH2 . TRP B 1 581 ? 12.674 -6.903 118.762 1.00 38.49 ? 581 TRP B CH2 1 +ATOM 10475 N N . ASN B 1 582 ? 7.007 -9.787 124.121 1.00 43.44 ? 582 ASN B N 1 +ATOM 10476 C CA . ASN B 1 582 ? 6.360 -9.660 125.417 1.00 43.83 ? 582 ASN B CA 1 +ATOM 10477 C C . ASN B 1 582 ? 6.354 -10.952 126.220 1.00 44.59 ? 582 ASN B C 1 +ATOM 10478 O O . ASN B 1 582 ? 5.828 -10.992 127.337 1.00 45.60 ? 582 ASN B O 1 +ATOM 10479 C CB . ASN B 1 582 ? 4.931 -9.140 125.261 1.00 44.19 ? 582 ASN B CB 1 +ATOM 10480 C CG . ASN B 1 582 ? 4.015 -10.131 124.589 1.00 45.50 ? 582 ASN B CG 1 +ATOM 10481 O OD1 . ASN B 1 582 ? 4.253 -11.338 124.606 1.00 46.86 ? 582 ASN B OD1 1 +ATOM 10482 N ND2 . ASN B 1 582 ? 2.939 -9.627 124.013 1.00 46.87 ? 582 ASN B ND2 1 +ATOM 10483 N N . GLY B 1 583 ? 6.929 -12.005 125.645 1.00 44.64 ? 583 GLY B N 1 +ATOM 10484 C CA . GLY B 1 583 ? 7.012 -13.285 126.329 1.00 44.85 ? 583 GLY B CA 1 +ATOM 10485 C C . GLY B 1 583 ? 5.752 -14.121 126.449 1.00 45.72 ? 583 GLY B C 1 +ATOM 10486 O O . GLY B 1 583 ? 5.800 -15.251 126.930 1.00 47.18 ? 583 GLY B O 1 +ATOM 10487 N N . GLU B 1 584 ? 4.618 -13.582 126.029 1.00 46.85 ? 584 GLU B N 1 +ATOM 10488 C CA . GLU B 1 584 ? 3.361 -14.322 126.101 1.00 48.36 ? 584 GLU B CA 1 +ATOM 10489 C C . GLU B 1 584 ? 3.373 -15.567 125.207 1.00 47.40 ? 584 GLU B C 1 +ATOM 10490 O O . GLU B 1 584 ? 3.969 -15.567 124.137 1.00 48.04 ? 584 GLU B O 1 +ATOM 10491 C CB . GLU B 1 584 ? 2.209 -13.387 125.709 1.00 50.97 ? 584 GLU B CB 1 +ATOM 10492 C CG . GLU B 1 584 ? 0.899 -14.069 125.335 1.00 55.04 ? 584 GLU B CG 1 +ATOM 10493 C CD . GLU B 1 584 ? -0.242 -13.070 125.140 1.00 58.33 ? 584 GLU B CD 1 +ATOM 10494 O OE1 . GLU B 1 584 ? -0.002 -11.982 124.559 1.00 59.66 ? 584 GLU B OE1 1 +ATOM 10495 O OE2 . GLU B 1 584 ? -1.383 -13.378 125.559 1.00 59.38 ? 584 GLU B OE2 1 +ATOM 10496 N N . ILE B 1 585 ? 2.722 -16.633 125.655 1.00 48.04 ? 585 ILE B N 1 +ATOM 10497 C CA . ILE B 1 585 ? 2.641 -17.866 124.876 1.00 48.30 ? 585 ILE B CA 1 +ATOM 10498 C C . ILE B 1 585 ? 1.194 -18.061 124.419 1.00 49.73 ? 585 ILE B C 1 +ATOM 10499 O O . ILE B 1 585 ? 0.267 -17.826 125.194 1.00 49.28 ? 585 ILE B O 1 +ATOM 10500 C CB . ILE B 1 585 ? 3.107 -19.074 125.719 1.00 47.92 ? 585 ILE B CB 1 +ATOM 10501 C CG1 . ILE B 1 585 ? 4.603 -18.927 126.024 1.00 48.25 ? 585 ILE B CG1 1 +ATOM 10502 C CG2 . ILE B 1 585 ? 2.846 -20.373 124.981 1.00 45.81 ? 585 ILE B CG2 1 +ATOM 10503 C CD1 . ILE B 1 585 ? 5.196 -20.073 126.798 1.00 49.15 ? 585 ILE B CD1 1 +ATOM 10504 N N . ILE B 1 586 ? 1.000 -18.472 123.163 1.00 51.60 ? 586 ILE B N 1 +ATOM 10505 C CA . ILE B 1 586 ? -0.347 -18.673 122.612 1.00 53.62 ? 586 ILE B CA 1 +ATOM 10506 C C . ILE B 1 586 ? -0.554 -20.046 121.958 1.00 54.94 ? 586 ILE B C 1 +ATOM 10507 O O . ILE B 1 586 ? 0.370 -20.610 121.372 1.00 54.88 ? 586 ILE B O 1 +ATOM 10508 C CB . ILE B 1 586 ? -0.692 -17.596 121.552 1.00 53.82 ? 586 ILE B CB 1 +ATOM 10509 C CG1 . ILE B 1 586 ? -0.503 -16.195 122.133 1.00 54.74 ? 586 ILE B CG1 1 +ATOM 10510 C CG2 . ILE B 1 586 ? -2.141 -17.758 121.097 1.00 53.41 ? 586 ILE B CG2 1 +ATOM 10511 C CD1 . ILE B 1 586 ? -1.474 -15.856 123.262 1.00 56.55 ? 586 ILE B CD1 1 +ATOM 10512 N N . ASN B 1 587 ? -1.778 -20.566 122.045 1.00 55.67 ? 587 ASN B N 1 +ATOM 10513 C CA . ASN B 1 587 ? -2.083 -21.860 121.462 1.00 56.89 ? 587 ASN B CA 1 +ATOM 10514 C C . ASN B 1 587 ? -2.368 -21.766 119.975 1.00 57.57 ? 587 ASN B C 1 +ATOM 10515 O O . ASN B 1 587 ? -3.157 -20.939 119.519 1.00 57.85 ? 587 ASN B O 1 +ATOM 10516 C CB . ASN B 1 587 ? -3.259 -22.502 122.180 1.00 59.71 ? 587 ASN B CB 1 +ATOM 10517 C CG . ASN B 1 587 ? -2.838 -23.198 123.452 1.00 62.59 ? 587 ASN B CG 1 +ATOM 10518 O OD1 . ASN B 1 587 ? -2.036 -24.138 123.420 1.00 63.60 ? 587 ASN B OD1 1 +ATOM 10519 N ND2 . ASN B 1 587 ? -3.370 -22.742 124.587 1.00 63.87 ? 587 ASN B ND2 1 +ATOM 10520 N N . GLY B 1 588 ? -1.714 -22.648 119.234 1.00 57.74 ? 588 GLY B N 1 +ATOM 10521 C CA . GLY B 1 588 ? -1.836 -22.679 117.794 1.00 57.72 ? 588 GLY B CA 1 +ATOM 10522 C C . GLY B 1 588 ? -3.205 -22.914 117.214 1.00 58.13 ? 588 GLY B C 1 +ATOM 10523 O O . GLY B 1 588 ? -4.136 -23.337 117.898 1.00 59.32 ? 588 GLY B O 1 +ATOM 10524 N N . LYS B 1 589 ? -3.297 -22.645 115.916 1.00 58.27 ? 589 LYS B N 1 +ATOM 10525 C CA . LYS B 1 589 ? -4.526 -22.783 115.171 1.00 56.37 ? 589 LYS B CA 1 +ATOM 10526 C C . LYS B 1 589 ? -5.459 -21.718 115.716 1.00 54.17 ? 589 LYS B C 1 +ATOM 10527 O O . LYS B 1 589 ? -6.512 -22.009 116.273 1.00 54.21 ? 589 LYS B O 1 +ATOM 10528 C CB . LYS B 1 589 ? -5.113 -24.180 115.356 1.00 58.35 ? 589 LYS B CB 1 +ATOM 10529 C CG . LYS B 1 589 ? -6.084 -24.571 114.260 1.00 61.94 ? 589 LYS B CG 1 +ATOM 10530 C CD . LYS B 1 589 ? -5.448 -24.399 112.880 1.00 63.76 ? 589 LYS B CD 1 +ATOM 10531 C CE . LYS B 1 589 ? -6.462 -24.654 111.775 1.00 65.36 ? 589 LYS B CE 1 +ATOM 10532 N NZ . LYS B 1 589 ? -5.936 -24.235 110.450 1.00 66.83 ? 589 LYS B NZ 1 +ATOM 10533 N N . SER B 1 590 ? -5.031 -20.471 115.564 1.00 51.60 ? 590 SER B N 1 +ATOM 10534 C CA . SER B 1 590 ? -5.796 -19.326 116.018 1.00 49.62 ? 590 SER B CA 1 +ATOM 10535 C C . SER B 1 590 ? -5.287 -18.075 115.330 1.00 48.35 ? 590 SER B C 1 +ATOM 10536 O O . SER B 1 590 ? -4.238 -18.088 114.690 1.00 48.51 ? 590 SER B O 1 +ATOM 10537 C CB . SER B 1 590 ? -5.651 -19.155 117.530 1.00 50.79 ? 590 SER B CB 1 +ATOM 10538 O OG . SER B 1 590 ? -4.314 -18.824 117.878 1.00 50.80 ? 590 SER B OG 1 +ATOM 10539 N N . VAL B 1 591 ? -6.036 -16.989 115.473 1.00 47.37 ? 591 VAL B N 1 +ATOM 10540 C CA . VAL B 1 591 ? -5.655 -15.723 114.879 1.00 45.69 ? 591 VAL B CA 1 +ATOM 10541 C C . VAL B 1 591 ? -5.524 -14.714 116.005 1.00 46.35 ? 591 VAL B C 1 +ATOM 10542 O O . VAL B 1 591 ? -6.431 -14.572 116.823 1.00 47.08 ? 591 VAL B O 1 +ATOM 10543 C CB . VAL B 1 591 ? -6.714 -15.248 113.862 1.00 44.67 ? 591 VAL B CB 1 +ATOM 10544 C CG1 . VAL B 1 591 ? -6.364 -13.855 113.351 1.00 44.26 ? 591 VAL B CG1 1 +ATOM 10545 C CG2 . VAL B 1 591 ? -6.786 -16.233 112.697 1.00 41.72 ? 591 VAL B CG2 1 +ATOM 10546 N N . VAL B 1 592 ? -4.385 -14.030 116.060 1.00 46.15 ? 592 VAL B N 1 +ATOM 10547 C CA . VAL B 1 592 ? -4.147 -13.032 117.096 1.00 45.40 ? 592 VAL B CA 1 +ATOM 10548 C C . VAL B 1 592 ? -3.664 -11.728 116.498 1.00 45.84 ? 592 VAL B C 1 +ATOM 10549 O O . VAL B 1 592 ? -3.217 -11.681 115.357 1.00 47.09 ? 592 VAL B O 1 +ATOM 10550 C CB . VAL B 1 592 ? -3.095 -13.516 118.112 1.00 45.74 ? 592 VAL B CB 1 +ATOM 10551 C CG1 . VAL B 1 592 ? -3.533 -14.848 118.704 1.00 46.05 ? 592 VAL B CG1 1 +ATOM 10552 C CG2 . VAL B 1 592 ? -1.729 -13.650 117.442 1.00 43.71 ? 592 VAL B CG2 1 +ATOM 10553 N N . LYS B 1 593 ? -3.753 -10.666 117.282 1.00 47.26 ? 593 LYS B N 1 +ATOM 10554 C CA . LYS B 1 593 ? -3.329 -9.348 116.840 1.00 48.42 ? 593 LYS B CA 1 +ATOM 10555 C C . LYS B 1 593 ? -1.863 -9.163 117.237 1.00 47.67 ? 593 LYS B C 1 +ATOM 10556 O O . LYS B 1 593 ? -1.456 -9.585 118.317 1.00 47.42 ? 593 LYS B O 1 +ATOM 10557 C CB . LYS B 1 593 ? -4.217 -8.295 117.509 1.00 50.73 ? 593 LYS B CB 1 +ATOM 10558 C CG . LYS B 1 593 ? -4.023 -6.862 117.038 1.00 56.28 ? 593 LYS B CG 1 +ATOM 10559 C CD . LYS B 1 593 ? -4.963 -5.921 117.805 1.00 59.27 ? 593 LYS B CD 1 +ATOM 10560 C CE . LYS B 1 593 ? -4.752 -4.459 117.415 1.00 61.46 ? 593 LYS B CE 1 +ATOM 10561 N NZ . LYS B 1 593 ? -5.653 -3.529 118.162 1.00 63.39 ? 593 LYS B NZ 1 +ATOM 10562 N N . SER B 1 594 ? -1.075 -8.540 116.363 1.00 47.26 ? 594 SER B N 1 +ATOM 10563 C CA . SER B 1 594 ? 0.342 -8.310 116.638 1.00 47.56 ? 594 SER B CA 1 +ATOM 10564 C C . SER B 1 594 ? 0.507 -7.288 117.756 1.00 48.69 ? 594 SER B C 1 +ATOM 10565 O O . SER B 1 594 ? -0.301 -6.370 117.896 1.00 49.46 ? 594 SER B O 1 +ATOM 10566 C CB . SER B 1 594 ? 1.060 -7.793 115.394 1.00 46.31 ? 594 SER B CB 1 +ATOM 10567 O OG . SER B 1 594 ? 0.998 -6.377 115.324 1.00 49.16 ? 594 SER B OG 1 +ATOM 10568 N N . THR B 1 595 ? 1.577 -7.439 118.530 1.00 50.21 ? 595 THR B N 1 +ATOM 10569 C CA . THR B 1 595 ? 1.864 -6.551 119.652 1.00 50.59 ? 595 THR B CA 1 +ATOM 10570 C C . THR B 1 595 ? 3.072 -5.649 119.432 1.00 51.85 ? 595 THR B C 1 +ATOM 10571 O O . THR B 1 595 ? 3.228 -4.645 120.123 1.00 53.27 ? 595 THR B O 1 +ATOM 10572 C CB . THR B 1 595 ? 2.113 -7.366 120.922 1.00 50.23 ? 595 THR B CB 1 +ATOM 10573 O OG1 . THR B 1 595 ? 3.335 -8.110 120.782 1.00 49.92 ? 595 THR B OG1 1 +ATOM 10574 C CG2 . THR B 1 595 ? 0.961 -8.337 121.150 1.00 49.25 ? 595 THR B CG2 1 +ATOM 10575 N N . HIS B 1 596 ? 3.923 -5.998 118.473 1.00 53.42 ? 596 HIS B N 1 +ATOM 10576 C CA . HIS B 1 596 ? 5.131 -5.216 118.189 1.00 54.51 ? 596 HIS B CA 1 +ATOM 10577 C C . HIS B 1 596 ? 5.203 -4.877 116.688 1.00 54.48 ? 596 HIS B C 1 +ATOM 10578 O O . HIS B 1 596 ? 4.484 -5.484 115.884 1.00 55.04 ? 596 HIS B O 1 +ATOM 10579 C CB . HIS B 1 596 ? 6.352 -6.038 118.616 1.00 56.03 ? 596 HIS B CB 1 +ATOM 10580 C CG . HIS B 1 596 ? 7.651 -5.298 118.545 1.00 59.57 ? 596 HIS B CG 1 +ATOM 10581 N ND1 . HIS B 1 596 ? 8.044 -4.388 119.504 1.00 62.38 ? 596 HIS B ND1 1 +ATOM 10582 C CD2 . HIS B 1 596 ? 8.647 -5.330 117.627 1.00 59.76 ? 596 HIS B CD2 1 +ATOM 10583 C CE1 . HIS B 1 596 ? 9.227 -3.892 119.180 1.00 61.62 ? 596 HIS B CE1 1 +ATOM 10584 N NE2 . HIS B 1 596 ? 9.614 -4.447 118.045 1.00 61.04 ? 596 HIS B NE2 1 +ATOM 10585 N N . GLU B 1 597 ? 6.048 -3.911 116.313 1.00 53.02 ? 597 GLU B N 1 +ATOM 10586 C CA . GLU B 1 597 ? 6.198 -3.532 114.904 1.00 53.33 ? 597 GLU B CA 1 +ATOM 10587 C C . GLU B 1 597 ? 6.767 -4.695 114.091 1.00 51.17 ? 597 GLU B C 1 +ATOM 10588 O O . GLU B 1 597 ? 6.530 -4.793 112.890 1.00 52.61 ? 597 GLU B O 1 +ATOM 10589 C CB . GLU B 1 597 ? 7.123 -2.314 114.743 1.00 56.84 ? 597 GLU B CB 1 +ATOM 10590 C CG . GLU B 1 597 ? 6.576 -1.018 115.324 1.00 62.39 ? 597 GLU B CG 1 +ATOM 10591 C CD . GLU B 1 597 ? 7.479 0.179 115.056 1.00 66.45 ? 597 GLU B CD 1 +ATOM 10592 O OE1 . GLU B 1 597 ? 7.581 0.613 113.885 1.00 69.23 ? 597 GLU B OE1 1 +ATOM 10593 O OE2 . GLU B 1 597 ? 8.094 0.689 116.021 1.00 69.02 ? 597 GLU B OE2 1 +ATOM 10594 N N . LEU B 1 598 ? 7.519 -5.569 114.753 1.00 48.16 ? 598 LEU B N 1 +ATOM 10595 C CA . LEU B 1 598 ? 8.114 -6.733 114.105 1.00 44.94 ? 598 LEU B CA 1 +ATOM 10596 C C . LEU B 1 598 ? 7.572 -7.993 114.785 1.00 44.50 ? 598 LEU B C 1 +ATOM 10597 O O . LEU B 1 598 ? 8.179 -8.514 115.725 1.00 45.89 ? 598 LEU B O 1 +ATOM 10598 C CB . LEU B 1 598 ? 9.638 -6.688 114.239 1.00 43.05 ? 598 LEU B CB 1 +ATOM 10599 C CG . LEU B 1 598 ? 10.337 -5.404 113.789 1.00 42.23 ? 598 LEU B CG 1 +ATOM 10600 C CD1 . LEU B 1 598 ? 11.819 -5.496 114.130 1.00 41.76 ? 598 LEU B CD1 1 +ATOM 10601 C CD2 . LEU B 1 598 ? 10.144 -5.184 112.299 1.00 40.51 ? 598 LEU B CD2 1 +ATOM 10602 N N . PRO B 1 599 ? 6.424 -8.506 114.309 1.00 43.03 ? 599 PRO B N 1 +ATOM 10603 C CA . PRO B 1 599 ? 5.761 -9.704 114.852 1.00 41.59 ? 599 PRO B CA 1 +ATOM 10604 C C . PRO B 1 599 ? 6.549 -11.014 114.722 1.00 40.93 ? 599 PRO B C 1 +ATOM 10605 O O . PRO B 1 599 ? 6.472 -11.698 113.701 1.00 40.28 ? 599 PRO B O 1 +ATOM 10606 C CB . PRO B 1 599 ? 4.434 -9.745 114.084 1.00 41.78 ? 599 PRO B CB 1 +ATOM 10607 C CG . PRO B 1 599 ? 4.220 -8.305 113.672 1.00 41.83 ? 599 PRO B CG 1 +ATOM 10608 C CD . PRO B 1 599 ? 5.603 -7.887 113.257 1.00 41.52 ? 599 PRO B CD 1 +ATOM 10609 N N . ILE B 1 600 ? 7.292 -11.361 115.771 1.00 39.83 ? 600 ILE B N 1 +ATOM 10610 C CA . ILE B 1 600 ? 8.104 -12.578 115.795 1.00 37.41 ? 600 ILE B CA 1 +ATOM 10611 C C . ILE B 1 600 ? 7.610 -13.561 116.854 1.00 37.54 ? 600 ILE B C 1 +ATOM 10612 O O . ILE B 1 600 ? 7.360 -13.179 117.996 1.00 37.17 ? 600 ILE B O 1 +ATOM 10613 C CB . ILE B 1 600 ? 9.565 -12.239 116.099 1.00 37.15 ? 600 ILE B CB 1 +ATOM 10614 C CG1 . ILE B 1 600 ? 10.126 -11.341 115.000 1.00 35.91 ? 600 ILE B CG1 1 +ATOM 10615 C CG2 . ILE B 1 600 ? 10.374 -13.506 116.231 1.00 36.48 ? 600 ILE B CG2 1 +ATOM 10616 C CD1 . ILE B 1 600 ? 11.428 -10.684 115.367 1.00 35.83 ? 600 ILE B CD1 1 +ATOM 10617 N N . TYR B 1 601 ? 7.468 -14.825 116.475 1.00 37.22 ? 601 TYR B N 1 +ATOM 10618 C CA . TYR B 1 601 ? 6.997 -15.844 117.404 1.00 38.48 ? 601 TYR B CA 1 +ATOM 10619 C C . TYR B 1 601 ? 7.884 -17.082 117.354 1.00 40.07 ? 601 TYR B C 1 +ATOM 10620 O O . TYR B 1 601 ? 8.272 -17.534 116.275 1.00 41.49 ? 601 TYR B O 1 +ATOM 10621 C CB . TYR B 1 601 ? 5.559 -16.253 117.072 1.00 38.27 ? 601 TYR B CB 1 +ATOM 10622 C CG . TYR B 1 601 ? 4.573 -15.116 117.084 1.00 38.03 ? 601 TYR B CG 1 +ATOM 10623 C CD1 . TYR B 1 601 ? 4.483 -14.235 116.008 1.00 37.54 ? 601 TYR B CD1 1 +ATOM 10624 C CD2 . TYR B 1 601 ? 3.747 -14.900 118.191 1.00 37.92 ? 601 TYR B CD2 1 +ATOM 10625 C CE1 . TYR B 1 601 ? 3.597 -13.162 116.033 1.00 40.05 ? 601 TYR B CE1 1 +ATOM 10626 C CE2 . TYR B 1 601 ? 2.856 -13.832 118.227 1.00 38.89 ? 601 TYR B CE2 1 +ATOM 10627 C CZ . TYR B 1 601 ? 2.787 -12.965 117.151 1.00 40.18 ? 601 TYR B CZ 1 +ATOM 10628 O OH . TYR B 1 601 ? 1.935 -11.885 117.213 1.00 42.39 ? 601 TYR B OH 1 +ATOM 10629 N N . LEU B 1 602 ? 8.201 -17.634 118.521 1.00 41.69 ? 602 LEU B N 1 +ATOM 10630 C CA . LEU B 1 602 ? 9.036 -18.832 118.584 1.00 40.98 ? 602 LEU B CA 1 +ATOM 10631 C C . LEU B 1 602 ? 8.169 -20.039 118.849 1.00 40.50 ? 602 LEU B C 1 +ATOM 10632 O O . LEU B 1 602 ? 7.286 -20.019 119.704 1.00 41.50 ? 602 LEU B O 1 +ATOM 10633 C CB . LEU B 1 602 ? 10.092 -18.712 119.680 1.00 41.57 ? 602 LEU B CB 1 +ATOM 10634 C CG . LEU B 1 602 ? 11.043 -17.528 119.544 1.00 41.61 ? 602 LEU B CG 1 +ATOM 10635 C CD1 . LEU B 1 602 ? 12.147 -17.654 120.578 1.00 43.52 ? 602 LEU B CD1 1 +ATOM 10636 C CD2 . LEU B 1 602 ? 11.632 -17.499 118.153 1.00 43.48 ? 602 LEU B CD2 1 +ATOM 10637 N N . ARG B 1 603 ? 8.434 -21.091 118.094 1.00 41.24 ? 603 ARG B N 1 +ATOM 10638 C CA . ARG B 1 603 ? 7.705 -22.344 118.184 1.00 42.12 ? 603 ARG B CA 1 +ATOM 10639 C C . ARG B 1 603 ? 8.177 -23.149 119.397 1.00 43.27 ? 603 ARG B C 1 +ATOM 10640 O O . ARG B 1 603 ? 9.350 -23.123 119.741 1.00 42.66 ? 603 ARG B O 1 +ATOM 10641 C CB . ARG B 1 603 ? 7.973 -23.118 116.902 1.00 42.39 ? 603 ARG B CB 1 +ATOM 10642 C CG . ARG B 1 603 ? 7.196 -24.392 116.718 1.00 42.28 ? 603 ARG B CG 1 +ATOM 10643 C CD . ARG B 1 603 ? 7.702 -25.043 115.456 1.00 42.90 ? 603 ARG B CD 1 +ATOM 10644 N NE . ARG B 1 603 ? 6.918 -26.202 115.061 1.00 44.33 ? 603 ARG B NE 1 +ATOM 10645 C CZ . ARG B 1 603 ? 7.106 -26.853 113.922 1.00 42.92 ? 603 ARG B CZ 1 +ATOM 10646 N NH1 . ARG B 1 603 ? 8.051 -26.443 113.081 1.00 40.89 ? 603 ARG B NH1 1 +ATOM 10647 N NH2 . ARG B 1 603 ? 6.349 -27.902 113.629 1.00 44.29 ? 603 ARG B NH2 1 +ATOM 10648 N N . GLU B 1 604 ? 7.278 -23.858 120.061 1.00 44.78 ? 604 GLU B N 1 +ATOM 10649 C CA . GLU B 1 604 ? 7.695 -24.660 121.207 1.00 46.96 ? 604 GLU B CA 1 +ATOM 10650 C C . GLU B 1 604 ? 8.625 -25.751 120.676 1.00 46.61 ? 604 GLU B C 1 +ATOM 10651 O O . GLU B 1 604 ? 8.215 -26.600 119.890 1.00 46.95 ? 604 GLU B O 1 +ATOM 10652 C CB . GLU B 1 604 ? 6.481 -25.281 121.888 1.00 48.19 ? 604 GLU B CB 1 +ATOM 10653 C CG . GLU B 1 604 ? 6.815 -26.017 123.169 1.00 52.56 ? 604 GLU B CG 1 +ATOM 10654 C CD . GLU B 1 604 ? 5.568 -26.465 123.914 1.00 56.31 ? 604 GLU B CD 1 +ATOM 10655 O OE1 . GLU B 1 604 ? 4.713 -27.144 123.292 1.00 57.09 ? 604 GLU B OE1 1 +ATOM 10656 O OE2 . GLU B 1 604 ? 5.440 -26.136 125.120 1.00 57.45 ? 604 GLU B OE2 1 +ATOM 10657 N N . GLY B 1 605 ? 9.879 -25.720 121.111 1.00 46.10 ? 605 GLY B N 1 +ATOM 10658 C CA . GLY B 1 605 ? 10.854 -26.681 120.631 1.00 45.47 ? 605 GLY B CA 1 +ATOM 10659 C C . GLY B 1 605 ? 11.808 -25.913 119.731 1.00 45.37 ? 605 GLY B C 1 +ATOM 10660 O O . GLY B 1 605 ? 11.963 -26.230 118.551 1.00 47.19 ? 605 GLY B O 1 +ATOM 10661 N N . SER B 1 606 ? 12.449 -24.895 120.291 1.00 42.35 ? 606 SER B N 1 +ATOM 10662 C CA . SER B 1 606 ? 13.361 -24.071 119.522 1.00 42.24 ? 606 SER B CA 1 +ATOM 10663 C C . SER B 1 606 ? 14.666 -23.787 120.237 1.00 42.37 ? 606 SER B C 1 +ATOM 10664 O O . SER B 1 606 ? 14.722 -23.694 121.466 1.00 42.57 ? 606 SER B O 1 +ATOM 10665 C CB . SER B 1 606 ? 12.716 -22.720 119.208 1.00 43.49 ? 606 SER B CB 1 +ATOM 10666 O OG . SER B 1 606 ? 11.471 -22.866 118.557 1.00 47.54 ? 606 SER B OG 1 +ATOM 10667 N N . ILE B 1 607 ? 15.714 -23.627 119.444 1.00 41.00 ? 607 ILE B N 1 +ATOM 10668 C CA . ILE B 1 607 ? 17.031 -23.293 119.953 1.00 40.65 ? 607 ILE B CA 1 +ATOM 10669 C C . ILE B 1 607 ? 17.531 -22.265 118.962 1.00 40.56 ? 607 ILE B C 1 +ATOM 10670 O O . ILE B 1 607 ? 17.654 -22.543 117.766 1.00 40.97 ? 607 ILE B O 1 +ATOM 10671 C CB . ILE B 1 607 ? 17.984 -24.510 119.979 1.00 41.06 ? 607 ILE B CB 1 +ATOM 10672 C CG1 . ILE B 1 607 ? 17.483 -25.537 120.997 1.00 41.35 ? 607 ILE B CG1 1 +ATOM 10673 C CG2 . ILE B 1 607 ? 19.396 -24.052 120.328 1.00 38.39 ? 607 ILE B CG2 1 +ATOM 10674 C CD1 . ILE B 1 607 ? 18.286 -26.828 121.025 1.00 43.20 ? 607 ILE B CD1 1 +ATOM 10675 N N . ILE B 1 608 ? 17.810 -21.069 119.450 1.00 39.64 ? 608 ILE B N 1 +ATOM 10676 C CA . ILE B 1 608 ? 18.251 -20.022 118.563 1.00 40.58 ? 608 ILE B CA 1 +ATOM 10677 C C . ILE B 1 608 ? 19.525 -19.327 119.007 1.00 41.70 ? 608 ILE B C 1 +ATOM 10678 O O . ILE B 1 608 ? 19.553 -18.633 120.022 1.00 42.33 ? 608 ILE B O 1 +ATOM 10679 C CB . ILE B 1 608 ? 17.118 -18.980 118.380 1.00 41.14 ? 608 ILE B CB 1 +ATOM 10680 C CG1 . ILE B 1 608 ? 15.914 -19.660 117.712 1.00 41.75 ? 608 ILE B CG1 1 +ATOM 10681 C CG2 . ILE B 1 608 ? 17.600 -17.803 117.546 1.00 38.72 ? 608 ILE B CG2 1 +ATOM 10682 C CD1 . ILE B 1 608 ? 14.689 -18.796 117.647 1.00 43.91 ? 608 ILE B CD1 1 +ATOM 10683 N N . PRO B 1 609 ? 20.615 -19.528 118.255 1.00 41.63 ? 609 PRO B N 1 +ATOM 10684 C CA . PRO B 1 609 ? 21.883 -18.890 118.594 1.00 41.67 ? 609 PRO B CA 1 +ATOM 10685 C C . PRO B 1 609 ? 21.824 -17.425 118.133 1.00 42.85 ? 609 PRO B C 1 +ATOM 10686 O O . PRO B 1 609 ? 21.396 -17.133 117.014 1.00 43.78 ? 609 PRO B O 1 +ATOM 10687 C CB . PRO B 1 609 ? 22.896 -19.717 117.810 1.00 41.06 ? 609 PRO B CB 1 +ATOM 10688 C CG . PRO B 1 609 ? 22.128 -20.090 116.591 1.00 41.00 ? 609 PRO B CG 1 +ATOM 10689 C CD . PRO B 1 609 ? 20.785 -20.486 117.150 1.00 40.60 ? 609 PRO B CD 1 +ATOM 10690 N N . LEU B 1 610 ? 22.234 -16.505 119.000 1.00 42.51 ? 610 LEU B N 1 +ATOM 10691 C CA . LEU B 1 610 ? 22.214 -15.094 118.656 1.00 42.60 ? 610 LEU B CA 1 +ATOM 10692 C C . LEU B 1 610 ? 23.610 -14.508 118.702 1.00 44.18 ? 610 LEU B C 1 +ATOM 10693 O O . LEU B 1 610 ? 24.544 -15.124 119.212 1.00 45.27 ? 610 LEU B O 1 +ATOM 10694 C CB . LEU B 1 610 ? 21.299 -14.326 119.610 1.00 42.16 ? 610 LEU B CB 1 +ATOM 10695 C CG . LEU B 1 610 ? 19.825 -14.762 119.649 1.00 42.83 ? 610 LEU B CG 1 +ATOM 10696 C CD1 . LEU B 1 610 ? 19.097 -14.009 120.748 1.00 43.08 ? 610 LEU B CD1 1 +ATOM 10697 C CD2 . LEU B 1 610 ? 19.158 -14.495 118.309 1.00 41.23 ? 610 LEU B CD2 1 +ATOM 10698 N N . GLU B 1 611 ? 23.741 -13.308 118.159 1.00 45.61 ? 611 GLU B N 1 +ATOM 10699 C CA . GLU B 1 611 ? 25.011 -12.609 118.114 1.00 46.76 ? 611 GLU B CA 1 +ATOM 10700 C C . GLU B 1 611 ? 25.632 -12.515 119.506 1.00 47.87 ? 611 GLU B C 1 +ATOM 10701 O O . GLU B 1 611 ? 24.923 -12.352 120.510 1.00 47.60 ? 611 GLU B O 1 +ATOM 10702 C CB . GLU B 1 611 ? 24.787 -11.213 117.532 1.00 47.85 ? 611 GLU B CB 1 +ATOM 10703 C CG . GLU B 1 611 ? 26.009 -10.325 117.507 1.00 52.65 ? 611 GLU B CG 1 +ATOM 10704 C CD . GLU B 1 611 ? 25.731 -8.985 116.840 1.00 56.68 ? 611 GLU B CD 1 +ATOM 10705 O OE1 . GLU B 1 611 ? 24.764 -8.294 117.250 1.00 59.16 ? 611 GLU B OE1 1 +ATOM 10706 O OE2 . GLU B 1 611 ? 26.480 -8.622 115.903 1.00 57.63 ? 611 GLU B OE2 1 +ATOM 10707 N N . GLY B 1 612 ? 26.960 -12.628 119.562 1.00 48.70 ? 612 GLY B N 1 +ATOM 10708 C CA . GLY B 1 612 ? 27.662 -12.540 120.831 1.00 48.11 ? 612 GLY B CA 1 +ATOM 10709 C C . GLY B 1 612 ? 27.454 -13.749 121.720 1.00 48.71 ? 612 GLY B C 1 +ATOM 10710 O O . GLY B 1 612 ? 27.325 -13.620 122.933 1.00 48.43 ? 612 GLY B O 1 +ATOM 10711 N N . ASP B 1 613 ? 27.397 -14.927 121.111 1.00 50.02 ? 613 ASP B N 1 +ATOM 10712 C CA . ASP B 1 613 ? 27.232 -16.170 121.855 1.00 50.45 ? 613 ASP B CA 1 +ATOM 10713 C C . ASP B 1 613 ? 25.989 -16.258 122.735 1.00 50.40 ? 613 ASP B C 1 +ATOM 10714 O O . ASP B 1 613 ? 25.956 -17.059 123.682 1.00 49.03 ? 613 ASP B O 1 +ATOM 10715 C CB . ASP B 1 613 ? 28.477 -16.419 122.706 1.00 52.22 ? 613 ASP B CB 1 +ATOM 10716 C CG . ASP B 1 613 ? 29.736 -16.534 121.866 1.00 53.89 ? 613 ASP B CG 1 +ATOM 10717 O OD1 . ASP B 1 613 ? 29.906 -17.573 121.183 1.00 56.22 ? 613 ASP B OD1 1 +ATOM 10718 O OD2 . ASP B 1 613 ? 30.543 -15.578 121.885 1.00 52.01 ? 613 ASP B OD2 1 +ATOM 10719 N N . GLU B 1 614 ? 24.980 -15.435 122.442 1.00 49.36 ? 614 GLU B N 1 +ATOM 10720 C CA . GLU B 1 614 ? 23.731 -15.494 123.199 1.00 48.68 ? 614 GLU B CA 1 +ATOM 10721 C C . GLU B 1 614 ? 23.015 -16.754 122.740 1.00 46.95 ? 614 GLU B C 1 +ATOM 10722 O O . GLU B 1 614 ? 23.316 -17.291 121.674 1.00 46.53 ? 614 GLU B O 1 +ATOM 10723 C CB . GLU B 1 614 ? 22.840 -14.279 122.923 1.00 50.92 ? 614 GLU B CB 1 +ATOM 10724 C CG . GLU B 1 614 ? 22.940 -13.175 123.964 1.00 56.20 ? 614 GLU B CG 1 +ATOM 10725 C CD . GLU B 1 614 ? 21.844 -12.123 123.819 1.00 60.18 ? 614 GLU B CD 1 +ATOM 10726 O OE1 . GLU B 1 614 ? 20.647 -12.508 123.808 1.00 61.53 ? 614 GLU B OE1 1 +ATOM 10727 O OE2 . GLU B 1 614 ? 22.178 -10.913 123.726 1.00 60.62 ? 614 GLU B OE2 1 +ATOM 10728 N N . LEU B 1 615 ? 22.060 -17.224 123.528 1.00 46.14 ? 615 LEU B N 1 +ATOM 10729 C CA . LEU B 1 615 ? 21.347 -18.434 123.164 1.00 45.80 ? 615 LEU B CA 1 +ATOM 10730 C C . LEU B 1 615 ? 19.939 -18.429 123.740 1.00 45.23 ? 615 LEU B C 1 +ATOM 10731 O O . LEU B 1 615 ? 19.754 -18.150 124.924 1.00 46.37 ? 615 LEU B O 1 +ATOM 10732 C CB . LEU B 1 615 ? 22.123 -19.642 123.693 1.00 46.95 ? 615 LEU B CB 1 +ATOM 10733 C CG . LEU B 1 615 ? 21.774 -21.023 123.143 1.00 48.92 ? 615 LEU B CG 1 +ATOM 10734 C CD1 . LEU B 1 615 ? 22.142 -21.072 121.668 1.00 48.41 ? 615 LEU B CD1 1 +ATOM 10735 C CD2 . LEU B 1 615 ? 22.537 -22.098 123.918 1.00 48.98 ? 615 LEU B CD2 1 +ATOM 10736 N N . ILE B 1 616 ? 18.947 -18.731 122.906 1.00 44.38 ? 616 ILE B N 1 +ATOM 10737 C CA . ILE B 1 616 ? 17.558 -18.782 123.362 1.00 43.72 ? 616 ILE B CA 1 +ATOM 10738 C C . ILE B 1 616 ? 17.108 -20.227 123.256 1.00 42.16 ? 616 ILE B C 1 +ATOM 10739 O O . ILE B 1 616 ? 17.350 -20.871 122.243 1.00 42.38 ? 616 ILE B O 1 +ATOM 10740 C CB . ILE B 1 616 ? 16.602 -17.943 122.473 1.00 45.12 ? 616 ILE B CB 1 +ATOM 10741 C CG1 . ILE B 1 616 ? 17.081 -16.500 122.384 1.00 46.63 ? 616 ILE B CG1 1 +ATOM 10742 C CG2 . ILE B 1 616 ? 15.186 -17.966 123.055 1.00 44.88 ? 616 ILE B CG2 1 +ATOM 10743 C CD1 . ILE B 1 616 ? 16.219 -15.661 121.455 1.00 47.96 ? 616 ILE B CD1 1 +ATOM 10744 N N . VAL B 1 617 ? 16.456 -20.738 124.295 1.00 41.55 ? 617 VAL B N 1 +ATOM 10745 C CA . VAL B 1 617 ? 15.973 -22.110 124.266 1.00 41.38 ? 617 VAL B CA 1 +ATOM 10746 C C . VAL B 1 617 ? 14.537 -22.171 124.754 1.00 41.60 ? 617 VAL B C 1 +ATOM 10747 O O . VAL B 1 617 ? 14.208 -21.622 125.805 1.00 42.09 ? 617 VAL B O 1 +ATOM 10748 C CB . VAL B 1 617 ? 16.833 -23.048 125.149 1.00 40.84 ? 617 VAL B CB 1 +ATOM 10749 C CG1 . VAL B 1 617 ? 16.264 -24.468 125.110 1.00 39.47 ? 617 VAL B CG1 1 +ATOM 10750 C CG2 . VAL B 1 617 ? 18.269 -23.045 124.664 1.00 38.86 ? 617 VAL B CG2 1 +ATOM 10751 N N . TYR B 1 618 ? 13.693 -22.846 123.980 1.00 40.92 ? 618 TYR B N 1 +ATOM 10752 C CA . TYR B 1 618 ? 12.291 -23.003 124.314 1.00 41.36 ? 618 TYR B CA 1 +ATOM 10753 C C . TYR B 1 618 ? 11.840 -24.401 123.946 1.00 42.96 ? 618 TYR B C 1 +ATOM 10754 O O . TYR B 1 618 ? 11.645 -24.715 122.766 1.00 43.62 ? 618 TYR B O 1 +ATOM 10755 C CB . TYR B 1 618 ? 11.443 -21.967 123.568 1.00 41.86 ? 618 TYR B CB 1 +ATOM 10756 C CG . TYR B 1 618 ? 9.936 -22.148 123.713 1.00 41.78 ? 618 TYR B CG 1 +ATOM 10757 C CD1 . TYR B 1 618 ? 9.381 -22.756 124.847 1.00 42.26 ? 618 TYR B CD1 1 +ATOM 10758 C CD2 . TYR B 1 618 ? 9.064 -21.648 122.746 1.00 40.88 ? 618 TYR B CD2 1 +ATOM 10759 C CE1 . TYR B 1 618 ? 7.989 -22.854 125.010 1.00 43.43 ? 618 TYR B CE1 1 +ATOM 10760 C CE2 . TYR B 1 618 ? 7.683 -21.736 122.901 1.00 42.44 ? 618 TYR B CE2 1 +ATOM 10761 C CZ . TYR B 1 618 ? 7.150 -22.336 124.029 1.00 43.23 ? 618 TYR B CZ 1 +ATOM 10762 O OH . TYR B 1 618 ? 5.783 -22.409 124.163 1.00 43.72 ? 618 TYR B OH 1 +ATOM 10763 N N . GLY B 1 619 ? 11.675 -25.241 124.960 1.00 43.43 ? 619 GLY B N 1 +ATOM 10764 C CA . GLY B 1 619 ? 11.241 -26.602 124.719 1.00 45.27 ? 619 GLY B CA 1 +ATOM 10765 C C . GLY B 1 619 ? 12.370 -27.554 124.363 1.00 47.56 ? 619 GLY B C 1 +ATOM 10766 O O . GLY B 1 619 ? 13.550 -27.251 124.569 1.00 46.57 ? 619 GLY B O 1 +ATOM 10767 N N . GLU B 1 620 ? 11.999 -28.706 123.805 1.00 49.44 ? 620 GLU B N 1 +ATOM 10768 C CA . GLU B 1 620 ? 12.964 -29.737 123.439 1.00 51.68 ? 620 GLU B CA 1 +ATOM 10769 C C . GLU B 1 620 ? 13.161 -29.887 121.937 1.00 51.60 ? 620 GLU B C 1 +ATOM 10770 O O . GLU B 1 620 ? 12.201 -30.043 121.177 1.00 51.73 ? 620 GLU B O 1 +ATOM 10771 C CB . GLU B 1 620 ? 12.517 -31.081 124.015 1.00 54.22 ? 620 GLU B CB 1 +ATOM 10772 C CG . GLU B 1 620 ? 12.240 -31.049 125.502 1.00 58.61 ? 620 GLU B CG 1 +ATOM 10773 C CD . GLU B 1 620 ? 11.604 -32.337 125.999 1.00 62.62 ? 620 GLU B CD 1 +ATOM 10774 O OE1 . GLU B 1 620 ? 10.525 -32.713 125.484 1.00 64.95 ? 620 GLU B OE1 1 +ATOM 10775 O OE2 . GLU B 1 620 ? 12.179 -32.975 126.908 1.00 64.95 ? 620 GLU B OE2 1 +ATOM 10776 N N . THR B 1 621 ? 14.420 -29.860 121.520 1.00 51.14 ? 621 THR B N 1 +ATOM 10777 C CA . THR B 1 621 ? 14.765 -30.000 120.110 1.00 50.97 ? 621 THR B CA 1 +ATOM 10778 C C . THR B 1 621 ? 16.276 -30.149 120.012 1.00 50.89 ? 621 THR B C 1 +ATOM 10779 O O . THR B 1 621 ? 16.985 -30.078 121.020 1.00 51.45 ? 621 THR B O 1 +ATOM 10780 C CB . THR B 1 621 ? 14.311 -28.749 119.276 1.00 50.25 ? 621 THR B CB 1 +ATOM 10781 O OG1 . THR B 1 621 ? 14.576 -28.970 117.881 1.00 49.86 ? 621 THR B OG1 1 +ATOM 10782 C CG2 . THR B 1 621 ? 15.054 -27.494 119.728 1.00 47.79 ? 621 THR B CG2 1 +ATOM 10783 N N . SER B 1 622 ? 16.767 -30.358 118.799 1.00 50.85 ? 622 SER B N 1 +ATOM 10784 C CA . SER B 1 622 ? 18.200 -30.493 118.578 1.00 50.60 ? 622 SER B CA 1 +ATOM 10785 C C . SER B 1 622 ? 18.564 -29.538 117.450 1.00 49.13 ? 622 SER B C 1 +ATOM 10786 O O . SER B 1 622 ? 17.850 -29.459 116.457 1.00 49.53 ? 622 SER B O 1 +ATOM 10787 C CB . SER B 1 622 ? 18.542 -31.931 118.195 1.00 51.18 ? 622 SER B CB 1 +ATOM 10788 O OG . SER B 1 622 ? 19.945 -32.114 118.209 1.00 54.22 ? 622 SER B OG 1 +ATOM 10789 N N . PHE B 1 623 ? 19.671 -28.819 117.602 1.00 48.17 ? 623 PHE B N 1 +ATOM 10790 C CA . PHE B 1 623 ? 20.077 -27.850 116.601 1.00 47.18 ? 623 PHE B CA 1 +ATOM 10791 C C . PHE B 1 623 ? 21.580 -27.827 116.361 1.00 47.83 ? 623 PHE B C 1 +ATOM 10792 O O . PHE B 1 623 ? 22.370 -27.877 117.298 1.00 48.83 ? 623 PHE B O 1 +ATOM 10793 C CB . PHE B 1 623 ? 19.609 -26.465 117.043 1.00 48.09 ? 623 PHE B CB 1 +ATOM 10794 C CG . PHE B 1 623 ? 19.958 -25.364 116.083 1.00 48.35 ? 623 PHE B CG 1 +ATOM 10795 C CD1 . PHE B 1 623 ? 19.317 -25.260 114.856 1.00 48.53 ? 623 PHE B CD1 1 +ATOM 10796 C CD2 . PHE B 1 623 ? 20.922 -24.422 116.415 1.00 48.76 ? 623 PHE B CD2 1 +ATOM 10797 C CE1 . PHE B 1 623 ? 19.629 -24.228 113.970 1.00 49.34 ? 623 PHE B CE1 1 +ATOM 10798 C CE2 . PHE B 1 623 ? 21.242 -23.386 115.537 1.00 49.96 ? 623 PHE B CE2 1 +ATOM 10799 C CZ . PHE B 1 623 ? 20.590 -23.292 114.311 1.00 49.48 ? 623 PHE B CZ 1 +ATOM 10800 N N . LYS B 1 624 ? 21.973 -27.730 115.098 1.00 48.57 ? 624 LYS B N 1 +ATOM 10801 C CA . LYS B 1 624 ? 23.385 -27.688 114.740 1.00 48.96 ? 624 LYS B CA 1 +ATOM 10802 C C . LYS B 1 624 ? 23.785 -26.261 114.366 1.00 48.43 ? 624 LYS B C 1 +ATOM 10803 O O . LYS B 1 624 ? 23.300 -25.711 113.380 1.00 48.17 ? 624 LYS B O 1 +ATOM 10804 C CB . LYS B 1 624 ? 23.648 -28.636 113.566 1.00 49.04 ? 624 LYS B CB 1 +ATOM 10805 C CG . LYS B 1 624 ? 25.095 -28.693 113.108 1.00 51.59 ? 624 LYS B CG 1 +ATOM 10806 C CD . LYS B 1 624 ? 25.273 -29.745 112.019 1.00 52.18 ? 624 LYS B CD 1 +ATOM 10807 C CE . LYS B 1 624 ? 26.721 -29.830 111.579 1.00 54.72 ? 624 LYS B CE 1 +ATOM 10808 N NZ . LYS B 1 624 ? 26.936 -30.906 110.574 1.00 55.77 ? 624 LYS B NZ 1 +ATOM 10809 N N . ARG B 1 625 ? 24.663 -25.660 115.160 1.00 48.55 ? 625 ARG B N 1 +ATOM 10810 C CA . ARG B 1 625 ? 25.102 -24.303 114.881 1.00 49.49 ? 625 ARG B CA 1 +ATOM 10811 C C . ARG B 1 625 ? 26.059 -24.329 113.700 1.00 49.97 ? 625 ARG B C 1 +ATOM 10812 O O . ARG B 1 625 ? 26.641 -25.369 113.399 1.00 50.85 ? 625 ARG B O 1 +ATOM 10813 C CB . ARG B 1 625 ? 25.778 -23.702 116.109 1.00 49.97 ? 625 ARG B CB 1 +ATOM 10814 C CG . ARG B 1 625 ? 25.802 -22.187 116.084 1.00 52.58 ? 625 ARG B CG 1 +ATOM 10815 C CD . ARG B 1 625 ? 26.140 -21.615 117.441 1.00 53.49 ? 625 ARG B CD 1 +ATOM 10816 N NE . ARG B 1 625 ? 27.472 -22.014 117.866 1.00 54.71 ? 625 ARG B NE 1 +ATOM 10817 C CZ . ARG B 1 625 ? 28.036 -21.624 119.001 1.00 55.71 ? 625 ARG B CZ 1 +ATOM 10818 N NH1 . ARG B 1 625 ? 27.381 -20.825 119.833 1.00 55.80 ? 625 ARG B NH1 1 +ATOM 10819 N NH2 . ARG B 1 625 ? 29.262 -22.026 119.295 1.00 56.86 ? 625 ARG B NH2 1 +ATOM 10820 N N . TYR B 1 626 ? 26.223 -23.188 113.036 1.00 50.67 ? 626 TYR B N 1 +ATOM 10821 C CA . TYR B 1 626 ? 27.088 -23.090 111.859 1.00 51.52 ? 626 TYR B CA 1 +ATOM 10822 C C . TYR B 1 626 ? 28.549 -23.486 112.071 1.00 52.91 ? 626 TYR B C 1 +ATOM 10823 O O . TYR B 1 626 ? 29.225 -23.896 111.127 1.00 53.32 ? 626 TYR B O 1 +ATOM 10824 C CB . TYR B 1 626 ? 27.024 -21.677 111.283 1.00 48.85 ? 626 TYR B CB 1 +ATOM 10825 C CG . TYR B 1 626 ? 27.735 -20.637 112.101 1.00 46.97 ? 626 TYR B CG 1 +ATOM 10826 C CD1 . TYR B 1 626 ? 29.108 -20.448 111.981 1.00 47.25 ? 626 TYR B CD1 1 +ATOM 10827 C CD2 . TYR B 1 626 ? 27.031 -19.825 112.985 1.00 47.17 ? 626 TYR B CD2 1 +ATOM 10828 C CE1 . TYR B 1 626 ? 29.768 -19.465 112.722 1.00 47.57 ? 626 TYR B CE1 1 +ATOM 10829 C CE2 . TYR B 1 626 ? 27.678 -18.843 113.730 1.00 47.78 ? 626 TYR B CE2 1 +ATOM 10830 C CZ . TYR B 1 626 ? 29.043 -18.667 113.592 1.00 47.50 ? 626 TYR B CZ 1 +ATOM 10831 O OH . TYR B 1 626 ? 29.673 -17.681 114.312 1.00 49.98 ? 626 TYR B OH 1 +ATOM 10832 N N . ASP B 1 627 ? 29.038 -23.352 113.298 1.00 54.31 ? 627 ASP B N 1 +ATOM 10833 C CA . ASP B 1 627 ? 30.419 -23.707 113.602 1.00 56.22 ? 627 ASP B CA 1 +ATOM 10834 C C . ASP B 1 627 ? 30.514 -25.181 113.989 1.00 56.95 ? 627 ASP B C 1 +ATOM 10835 O O . ASP B 1 627 ? 31.475 -25.604 114.629 1.00 56.70 ? 627 ASP B O 1 +ATOM 10836 C CB . ASP B 1 627 ? 30.959 -22.818 114.728 1.00 56.16 ? 627 ASP B CB 1 +ATOM 10837 C CG . ASP B 1 627 ? 30.255 -23.051 116.051 1.00 57.84 ? 627 ASP B CG 1 +ATOM 10838 O OD1 . ASP B 1 627 ? 29.102 -23.540 116.050 1.00 58.65 ? 627 ASP B OD1 1 +ATOM 10839 O OD2 . ASP B 1 627 ? 30.856 -22.730 117.099 1.00 59.60 ? 627 ASP B OD2 1 +ATOM 10840 N N . ASN B 1 628 ? 29.497 -25.949 113.602 1.00 58.24 ? 628 ASN B N 1 +ATOM 10841 C CA . ASN B 1 628 ? 29.446 -27.384 113.864 1.00 59.70 ? 628 ASN B CA 1 +ATOM 10842 C C . ASN B 1 628 ? 29.005 -27.824 115.268 1.00 58.57 ? 628 ASN B C 1 +ATOM 10843 O O . ASN B 1 628 ? 28.702 -29.001 115.487 1.00 58.64 ? 628 ASN B O 1 +ATOM 10844 C CB . ASN B 1 628 ? 30.803 -28.009 113.515 1.00 63.10 ? 628 ASN B CB 1 +ATOM 10845 C CG . ASN B 1 628 ? 31.098 -29.245 114.332 1.00 67.84 ? 628 ASN B CG 1 +ATOM 10846 O OD1 . ASN B 1 628 ? 31.402 -29.156 115.533 1.00 69.67 ? 628 ASN B OD1 1 +ATOM 10847 N ND2 . ASN B 1 628 ? 30.995 -30.413 113.697 1.00 69.20 ? 628 ASN B ND2 1 +ATOM 10848 N N . ALA B 1 629 ? 28.961 -26.896 116.218 1.00 57.48 ? 629 ALA B N 1 +ATOM 10849 C CA . ALA B 1 629 ? 28.538 -27.241 117.576 1.00 56.32 ? 629 ALA B CA 1 +ATOM 10850 C C . ALA B 1 629 ? 27.049 -27.609 117.623 1.00 55.61 ? 629 ALA B C 1 +ATOM 10851 O O . ALA B 1 629 ? 26.195 -26.812 117.246 1.00 55.94 ? 629 ALA B O 1 +ATOM 10852 C CB . ALA B 1 629 ? 28.819 -26.077 118.520 1.00 55.00 ? 629 ALA B CB 1 +ATOM 10853 N N . GLU B 1 630 ? 26.743 -28.817 118.083 1.00 55.55 ? 630 GLU B N 1 +ATOM 10854 C CA . GLU B 1 630 ? 25.358 -29.274 118.186 1.00 56.38 ? 630 GLU B CA 1 +ATOM 10855 C C . GLU B 1 630 ? 24.802 -29.057 119.593 1.00 55.35 ? 630 GLU B C 1 +ATOM 10856 O O . GLU B 1 630 ? 25.442 -29.400 120.588 1.00 56.12 ? 630 GLU B O 1 +ATOM 10857 C CB . GLU B 1 630 ? 25.269 -30.752 117.816 1.00 58.29 ? 630 GLU B CB 1 +ATOM 10858 C CG . GLU B 1 630 ? 25.687 -31.023 116.386 1.00 64.65 ? 630 GLU B CG 1 +ATOM 10859 C CD . GLU B 1 630 ? 25.957 -32.493 116.111 1.00 67.95 ? 630 GLU B CD 1 +ATOM 10860 O OE1 . GLU B 1 630 ? 25.033 -33.319 116.303 1.00 69.19 ? 630 GLU B OE1 1 +ATOM 10861 O OE2 . GLU B 1 630 ? 27.098 -32.819 115.699 1.00 69.56 ? 630 GLU B OE2 1 +ATOM 10862 N N . ILE B 1 631 ? 23.605 -28.491 119.670 1.00 53.16 ? 631 ILE B N 1 +ATOM 10863 C CA . ILE B 1 631 ? 22.969 -28.208 120.945 1.00 51.34 ? 631 ILE B CA 1 +ATOM 10864 C C . ILE B 1 631 ? 21.671 -28.988 121.023 1.00 51.97 ? 631 ILE B C 1 +ATOM 10865 O O . ILE B 1 631 ? 20.905 -29.021 120.060 1.00 52.48 ? 631 ILE B O 1 +ATOM 10866 C CB . ILE B 1 631 ? 22.667 -26.708 121.064 1.00 50.50 ? 631 ILE B CB 1 +ATOM 10867 C CG1 . ILE B 1 631 ? 23.940 -25.907 120.799 1.00 49.92 ? 631 ILE B CG1 1 +ATOM 10868 C CG2 . ILE B 1 631 ? 22.118 -26.389 122.434 1.00 50.35 ? 631 ILE B CG2 1 +ATOM 10869 C CD1 . ILE B 1 631 ? 23.729 -24.411 120.789 1.00 51.01 ? 631 ILE B CD1 1 +ATOM 10870 N N . THR B 1 632 ? 21.423 -29.620 122.163 1.00 52.62 ? 632 THR B N 1 +ATOM 10871 C CA . THR B 1 632 ? 20.209 -30.405 122.337 1.00 54.04 ? 632 THR B CA 1 +ATOM 10872 C C . THR B 1 632 ? 19.536 -30.074 123.659 1.00 55.67 ? 632 THR B C 1 +ATOM 10873 O O . THR B 1 632 ? 20.201 -29.932 124.688 1.00 56.51 ? 632 THR B O 1 +ATOM 10874 C CB . THR B 1 632 ? 20.510 -31.922 122.323 1.00 54.74 ? 632 THR B CB 1 +ATOM 10875 O OG1 . THR B 1 632 ? 21.264 -32.259 121.149 1.00 55.11 ? 632 THR B OG1 1 +ATOM 10876 C CG2 . THR B 1 632 ? 19.205 -32.722 122.326 1.00 53.58 ? 632 THR B CG2 1 +ATOM 10877 N N . SER B 1 633 ? 18.216 -29.950 123.633 1.00 56.78 ? 633 SER B N 1 +ATOM 10878 C CA . SER B 1 633 ? 17.475 -29.646 124.845 1.00 59.05 ? 633 SER B CA 1 +ATOM 10879 C C . SER B 1 633 ? 16.460 -30.746 125.062 1.00 61.48 ? 633 SER B C 1 +ATOM 10880 O O . SER B 1 633 ? 15.755 -31.145 124.136 1.00 61.54 ? 633 SER B O 1 +ATOM 10881 C CB . SER B 1 633 ? 16.764 -28.293 124.726 1.00 58.38 ? 633 SER B CB 1 +ATOM 10882 O OG . SER B 1 633 ? 15.717 -28.343 123.767 1.00 59.37 ? 633 SER B OG 1 +ATOM 10883 N N . SER B 1 634 ? 16.405 -31.246 126.290 1.00 65.47 ? 634 SER B N 1 +ATOM 10884 C CA . SER B 1 634 ? 15.474 -32.305 126.645 1.00 69.37 ? 634 SER B CA 1 +ATOM 10885 C C . SER B 1 634 ? 14.708 -31.912 127.906 1.00 71.41 ? 634 SER B C 1 +ATOM 10886 O O . SER B 1 634 ? 14.521 -30.718 128.170 1.00 71.98 ? 634 SER B O 1 +ATOM 10887 C CB . SER B 1 634 ? 16.230 -33.610 126.872 1.00 69.86 ? 634 SER B CB 1 +ATOM 10888 O OG . SER B 1 634 ? 17.249 -33.417 127.835 1.00 72.90 ? 634 SER B OG 1 +ATOM 10889 N N . SER B 1 635 ? 14.272 -32.916 128.670 1.00 72.93 ? 635 SER B N 1 +ATOM 10890 C CA . SER B 1 635 ? 13.505 -32.715 129.905 1.00 74.09 ? 635 SER B CA 1 +ATOM 10891 C C . SER B 1 635 ? 13.849 -31.407 130.625 1.00 74.13 ? 635 SER B C 1 +ATOM 10892 O O . SER B 1 635 ? 13.049 -30.466 130.634 1.00 74.23 ? 635 SER B O 1 +ATOM 10893 C CB . SER B 1 635 ? 13.723 -33.901 130.855 1.00 75.60 ? 635 SER B CB 1 +ATOM 10894 O OG . SER B 1 635 ? 13.325 -35.129 130.256 1.00 76.66 ? 635 SER B OG 1 +ATOM 10895 N N . ASN B 1 636 ? 15.034 -31.362 131.231 1.00 73.48 ? 636 ASN B N 1 +ATOM 10896 C CA . ASN B 1 636 ? 15.515 -30.178 131.945 1.00 72.91 ? 636 ASN B CA 1 +ATOM 10897 C C . ASN B 1 636 ? 17.031 -30.122 131.764 1.00 72.21 ? 636 ASN B C 1 +ATOM 10898 O O . ASN B 1 636 ? 17.774 -29.824 132.705 1.00 72.21 ? 636 ASN B O 1 +ATOM 10899 C CB . ASN B 1 636 ? 15.195 -30.271 133.446 1.00 74.35 ? 636 ASN B CB 1 +ATOM 10900 C CG . ASN B 1 636 ? 13.703 -30.244 133.740 1.00 75.97 ? 636 ASN B CG 1 +ATOM 10901 O OD1 . ASN B 1 636 ? 12.955 -31.141 133.342 1.00 76.87 ? 636 ASN B OD1 1 +ATOM 10902 N ND2 . ASN B 1 636 ? 13.264 -29.212 134.450 1.00 76.99 ? 636 ASN B ND2 1 +ATOM 10903 N N . GLU B 1 637 ? 17.485 -30.400 130.546 1.00 70.84 ? 637 GLU B N 1 +ATOM 10904 C CA . GLU B 1 637 ? 18.913 -30.420 130.261 1.00 69.88 ? 637 GLU B CA 1 +ATOM 10905 C C . GLU B 1 637 ? 19.244 -29.929 128.850 1.00 67.25 ? 637 GLU B C 1 +ATOM 10906 O O . GLU B 1 637 ? 18.526 -30.213 127.889 1.00 66.23 ? 637 GLU B O 1 +ATOM 10907 C CB . GLU B 1 637 ? 19.421 -31.855 130.464 1.00 72.50 ? 637 GLU B CB 1 +ATOM 10908 C CG . GLU B 1 637 ? 20.912 -32.081 130.275 1.00 77.80 ? 637 GLU B CG 1 +ATOM 10909 C CD . GLU B 1 637 ? 21.310 -33.535 130.549 1.00 81.85 ? 637 GLU B CD 1 +ATOM 10910 O OE1 . GLU B 1 637 ? 20.721 -34.446 129.916 1.00 82.88 ? 637 GLU B OE1 1 +ATOM 10911 O OE2 . GLU B 1 637 ? 22.207 -33.767 131.397 1.00 83.41 ? 637 GLU B OE2 1 +ATOM 10912 N N . ILE B 1 638 ? 20.335 -29.181 128.742 1.00 64.24 ? 638 ILE B N 1 +ATOM 10913 C CA . ILE B 1 638 ? 20.794 -28.666 127.462 1.00 62.44 ? 638 ILE B CA 1 +ATOM 10914 C C . ILE B 1 638 ? 22.198 -29.222 127.236 1.00 62.64 ? 638 ILE B C 1 +ATOM 10915 O O . ILE B 1 638 ? 23.150 -28.793 127.887 1.00 62.21 ? 638 ILE B O 1 +ATOM 10916 C CB . ILE B 1 638 ? 20.865 -27.122 127.460 1.00 61.15 ? 638 ILE B CB 1 +ATOM 10917 C CG1 . ILE B 1 638 ? 19.488 -26.536 127.765 1.00 59.11 ? 638 ILE B CG1 1 +ATOM 10918 C CG2 . ILE B 1 638 ? 21.365 -26.621 126.110 1.00 59.35 ? 638 ILE B CG2 1 +ATOM 10919 C CD1 . ILE B 1 638 ? 19.493 -25.036 127.896 1.00 57.52 ? 638 ILE B CD1 1 +ATOM 10920 N N . LYS B 1 639 ? 22.318 -30.175 126.315 1.00 62.51 ? 639 LYS B N 1 +ATOM 10921 C CA . LYS B 1 639 ? 23.600 -30.798 126.014 1.00 62.17 ? 639 LYS B CA 1 +ATOM 10922 C C . LYS B 1 639 ? 24.320 -30.106 124.870 1.00 61.19 ? 639 LYS B C 1 +ATOM 10923 O O . LYS B 1 639 ? 23.685 -29.569 123.963 1.00 60.44 ? 639 LYS B O 1 +ATOM 10924 C CB . LYS B 1 639 ? 23.396 -32.272 125.656 1.00 64.03 ? 639 LYS B CB 1 +ATOM 10925 C CG . LYS B 1 639 ? 22.762 -33.113 126.762 1.00 67.13 ? 639 LYS B CG 1 +ATOM 10926 C CD . LYS B 1 639 ? 22.468 -34.524 126.269 1.00 68.88 ? 639 LYS B CD 1 +ATOM 10927 C CE . LYS B 1 639 ? 21.897 -35.410 127.372 1.00 70.14 ? 639 LYS B CE 1 +ATOM 10928 N NZ . LYS B 1 639 ? 22.871 -35.651 128.482 1.00 70.54 ? 639 LYS B NZ 1 +ATOM 10929 N N . PHE B 1 640 ? 25.650 -30.129 124.928 1.00 60.26 ? 640 PHE B N 1 +ATOM 10930 C CA . PHE B 1 640 ? 26.496 -29.536 123.897 1.00 59.88 ? 640 PHE B CA 1 +ATOM 10931 C C . PHE B 1 640 ? 27.462 -30.596 123.365 1.00 59.04 ? 640 PHE B C 1 +ATOM 10932 O O . PHE B 1 640 ? 28.125 -31.281 124.141 1.00 58.80 ? 640 PHE B O 1 +ATOM 10933 C CB . PHE B 1 640 ? 27.286 -28.352 124.463 1.00 59.72 ? 640 PHE B CB 1 +ATOM 10934 C CG . PHE B 1 640 ? 26.422 -27.217 124.932 1.00 61.05 ? 640 PHE B CG 1 +ATOM 10935 C CD1 . PHE B 1 640 ? 25.643 -27.345 126.080 1.00 62.02 ? 640 PHE B CD1 1 +ATOM 10936 C CD2 . PHE B 1 640 ? 26.369 -26.022 124.216 1.00 61.08 ? 640 PHE B CD2 1 +ATOM 10937 C CE1 . PHE B 1 640 ? 24.818 -26.295 126.507 1.00 62.43 ? 640 PHE B CE1 1 +ATOM 10938 C CE2 . PHE B 1 640 ? 25.551 -24.970 124.632 1.00 60.98 ? 640 PHE B CE2 1 +ATOM 10939 C CZ . PHE B 1 640 ? 24.775 -25.106 125.779 1.00 61.17 ? 640 PHE B CZ 1 +ATOM 10940 N N . SER B 1 641 ? 27.530 -30.730 122.042 1.00 58.53 ? 641 SER B N 1 +ATOM 10941 C CA . SER B 1 641 ? 28.414 -31.704 121.406 1.00 57.45 ? 641 SER B CA 1 +ATOM 10942 C C . SER B 1 641 ? 29.885 -31.392 121.689 1.00 56.91 ? 641 SER B C 1 +ATOM 10943 O O . SER B 1 641 ? 30.742 -32.254 121.543 1.00 56.50 ? 641 SER B O 1 +ATOM 10944 C CB . SER B 1 641 ? 28.176 -31.737 119.890 1.00 56.75 ? 641 SER B CB 1 +ATOM 10945 O OG . SER B 1 641 ? 28.636 -30.549 119.262 1.00 55.97 ? 641 SER B OG 1 +ATOM 10946 N N . ARG B 1 642 ? 30.176 -30.155 122.077 1.00 56.66 ? 642 ARG B N 1 +ATOM 10947 C CA . ARG B 1 642 ? 31.541 -29.783 122.392 1.00 58.49 ? 642 ARG B CA 1 +ATOM 10948 C C . ARG B 1 642 ? 31.579 -28.491 123.187 1.00 58.98 ? 642 ARG B C 1 +ATOM 10949 O O . ARG B 1 642 ? 30.612 -27.743 123.211 1.00 60.12 ? 642 ARG B O 1 +ATOM 10950 C CB . ARG B 1 642 ? 32.372 -29.651 121.114 1.00 59.02 ? 642 ARG B CB 1 +ATOM 10951 C CG . ARG B 1 642 ? 32.002 -28.494 120.216 1.00 60.75 ? 642 ARG B CG 1 +ATOM 10952 C CD . ARG B 1 642 ? 32.826 -28.554 118.941 1.00 62.65 ? 642 ARG B CD 1 +ATOM 10953 N NE . ARG B 1 642 ? 32.523 -27.457 118.030 1.00 65.70 ? 642 ARG B NE 1 +ATOM 10954 C CZ . ARG B 1 642 ? 32.787 -26.180 118.284 1.00 67.53 ? 642 ARG B CZ 1 +ATOM 10955 N NH1 . ARG B 1 642 ? 33.364 -25.833 119.428 1.00 68.71 ? 642 ARG B NH1 1 +ATOM 10956 N NH2 . ARG B 1 642 ? 32.475 -25.247 117.393 1.00 68.54 ? 642 ARG B NH2 1 +ATOM 10957 N N . GLU B 1 643 ? 32.703 -28.238 123.846 1.00 60.15 ? 643 GLU B N 1 +ATOM 10958 C CA . GLU B 1 643 ? 32.869 -27.043 124.665 1.00 60.49 ? 643 GLU B CA 1 +ATOM 10959 C C . GLU B 1 643 ? 32.704 -25.757 123.852 1.00 58.56 ? 643 GLU B C 1 +ATOM 10960 O O . GLU B 1 643 ? 33.370 -25.562 122.842 1.00 58.28 ? 643 GLU B O 1 +ATOM 10961 C CB . GLU B 1 643 ? 34.250 -27.067 125.338 1.00 62.54 ? 643 GLU B CB 1 +ATOM 10962 C CG . GLU B 1 643 ? 34.566 -25.855 126.207 1.00 67.46 ? 643 GLU B CG 1 +ATOM 10963 C CD . GLU B 1 643 ? 35.990 -25.887 126.758 1.00 70.83 ? 643 GLU B CD 1 +ATOM 10964 O OE1 . GLU B 1 643 ? 36.314 -26.827 127.518 1.00 71.70 ? 643 GLU B OE1 1 +ATOM 10965 O OE2 . GLU B 1 643 ? 36.787 -24.977 126.424 1.00 72.32 ? 643 GLU B OE2 1 +ATOM 10966 N N . ILE B 1 644 ? 31.805 -24.886 124.300 1.00 57.11 ? 644 ILE B N 1 +ATOM 10967 C CA . ILE B 1 644 ? 31.567 -23.608 123.626 1.00 55.84 ? 644 ILE B CA 1 +ATOM 10968 C C . ILE B 1 644 ? 31.269 -22.517 124.643 1.00 54.48 ? 644 ILE B C 1 +ATOM 10969 O O . ILE B 1 644 ? 30.735 -22.781 125.723 1.00 54.97 ? 644 ILE B O 1 +ATOM 10970 C CB . ILE B 1 644 ? 30.358 -23.656 122.659 1.00 55.86 ? 644 ILE B CB 1 +ATOM 10971 C CG1 . ILE B 1 644 ? 29.062 -23.834 123.458 1.00 57.02 ? 644 ILE B CG1 1 +ATOM 10972 C CG2 . ILE B 1 644 ? 30.526 -24.787 121.658 1.00 55.60 ? 644 ILE B CG2 1 +ATOM 10973 C CD1 . ILE B 1 644 ? 27.807 -23.581 122.649 1.00 57.87 ? 644 ILE B CD1 1 +ATOM 10974 N N . TYR B 1 645 ? 31.608 -21.286 124.288 1.00 53.00 ? 645 TYR B N 1 +ATOM 10975 C CA . TYR B 1 645 ? 31.361 -20.158 125.169 1.00 51.82 ? 645 TYR B CA 1 +ATOM 10976 C C . TYR B 1 645 ? 29.890 -19.780 125.071 1.00 51.08 ? 645 TYR B C 1 +ATOM 10977 O O . TYR B 1 645 ? 29.275 -19.906 124.009 1.00 51.52 ? 645 TYR B O 1 +ATOM 10978 C CB . TYR B 1 645 ? 32.212 -18.967 124.752 1.00 51.07 ? 645 TYR B CB 1 +ATOM 10979 C CG . TYR B 1 645 ? 32.107 -17.789 125.690 1.00 53.42 ? 645 TYR B CG 1 +ATOM 10980 C CD1 . TYR B 1 645 ? 32.827 -17.758 126.892 1.00 53.56 ? 645 TYR B CD1 1 +ATOM 10981 C CD2 . TYR B 1 645 ? 31.300 -16.691 125.373 1.00 52.75 ? 645 TYR B CD2 1 +ATOM 10982 C CE1 . TYR B 1 645 ? 32.747 -16.655 127.754 1.00 53.89 ? 645 TYR B CE1 1 +ATOM 10983 C CE2 . TYR B 1 645 ? 31.210 -15.585 126.225 1.00 53.32 ? 645 TYR B CE2 1 +ATOM 10984 C CZ . TYR B 1 645 ? 31.936 -15.572 127.412 1.00 54.50 ? 645 TYR B CZ 1 +ATOM 10985 O OH . TYR B 1 645 ? 31.856 -14.480 128.248 1.00 54.92 ? 645 TYR B OH 1 +ATOM 10986 N N . VAL B 1 646 ? 29.328 -19.328 126.185 1.00 49.90 ? 646 VAL B N 1 +ATOM 10987 C CA . VAL B 1 646 ? 27.934 -18.907 126.234 1.00 48.34 ? 646 VAL B CA 1 +ATOM 10988 C C . VAL B 1 646 ? 27.854 -17.656 127.097 1.00 48.65 ? 646 VAL B C 1 +ATOM 10989 O O . VAL B 1 646 ? 28.224 -17.672 128.267 1.00 49.53 ? 646 VAL B O 1 +ATOM 10990 C CB . VAL B 1 646 ? 27.021 -19.992 126.847 1.00 47.00 ? 646 VAL B CB 1 +ATOM 10991 C CG1 . VAL B 1 646 ? 25.595 -19.472 126.957 1.00 45.57 ? 646 VAL B CG1 1 +ATOM 10992 C CG2 . VAL B 1 646 ? 27.057 -21.248 125.992 1.00 46.90 ? 646 VAL B CG2 1 +ATOM 10993 N N . SER B 1 647 ? 27.395 -16.560 126.512 1.00 49.61 ? 647 SER B N 1 +ATOM 10994 C CA . SER B 1 647 ? 27.269 -15.318 127.259 1.00 50.02 ? 647 SER B CA 1 +ATOM 10995 C C . SER B 1 647 ? 25.935 -15.317 128.009 1.00 49.87 ? 647 SER B C 1 +ATOM 10996 O O . SER B 1 647 ? 25.850 -15.772 129.145 1.00 50.36 ? 647 SER B O 1 +ATOM 10997 C CB . SER B 1 647 ? 27.346 -14.115 126.310 1.00 49.40 ? 647 SER B CB 1 +ATOM 10998 O OG . SER B 1 647 ? 26.336 -14.182 125.307 1.00 51.83 ? 647 SER B OG 1 +ATOM 10999 N N . LYS B 1 648 ? 24.890 -14.827 127.356 1.00 50.95 ? 648 LYS B N 1 +ATOM 11000 C CA . LYS B 1 648 ? 23.563 -14.747 127.963 1.00 50.89 ? 648 LYS B CA 1 +ATOM 11001 C C . LYS B 1 648 ? 22.671 -15.887 127.471 1.00 49.56 ? 648 LYS B C 1 +ATOM 11002 O O . LYS B 1 648 ? 22.616 -16.169 126.275 1.00 49.20 ? 648 LYS B O 1 +ATOM 11003 C CB . LYS B 1 648 ? 22.966 -13.377 127.615 1.00 52.97 ? 648 LYS B CB 1 +ATOM 11004 C CG . LYS B 1 648 ? 21.571 -13.063 128.140 1.00 56.25 ? 648 LYS B CG 1 +ATOM 11005 C CD . LYS B 1 648 ? 21.261 -11.578 127.858 1.00 59.00 ? 648 LYS B CD 1 +ATOM 11006 C CE . LYS B 1 648 ? 19.787 -11.222 128.051 1.00 59.98 ? 648 LYS B CE 1 +ATOM 11007 N NZ . LYS B 1 648 ? 18.919 -11.789 126.966 1.00 62.56 ? 648 LYS B NZ 1 +ATOM 11008 N N . LEU B 1 649 ? 22.000 -16.560 128.402 1.00 48.22 ? 649 LEU B N 1 +ATOM 11009 C CA . LEU B 1 649 ? 21.106 -17.659 128.051 1.00 47.44 ? 649 LEU B CA 1 +ATOM 11010 C C . LEU B 1 649 ? 19.677 -17.291 128.414 1.00 48.08 ? 649 LEU B C 1 +ATOM 11011 O O . LEU B 1 649 ? 19.396 -16.892 129.540 1.00 48.67 ? 649 LEU B O 1 +ATOM 11012 C CB . LEU B 1 649 ? 21.491 -18.943 128.794 1.00 46.63 ? 649 LEU B CB 1 +ATOM 11013 C CG . LEU B 1 649 ? 20.474 -20.096 128.721 1.00 46.57 ? 649 LEU B CG 1 +ATOM 11014 C CD1 . LEU B 1 649 ? 20.349 -20.595 127.288 1.00 44.73 ? 649 LEU B CD1 1 +ATOM 11015 C CD2 . LEU B 1 649 ? 20.912 -21.235 129.635 1.00 46.71 ? 649 LEU B CD2 1 +ATOM 11016 N N . THR B 1 650 ? 18.770 -17.427 127.458 1.00 48.86 ? 650 THR B N 1 +ATOM 11017 C CA . THR B 1 650 ? 17.371 -17.113 127.712 1.00 47.97 ? 650 THR B CA 1 +ATOM 11018 C C . THR B 1 650 ? 16.552 -18.385 127.587 1.00 48.79 ? 650 THR B C 1 +ATOM 11019 O O . THR B 1 650 ? 16.613 -19.087 126.574 1.00 49.05 ? 650 THR B O 1 +ATOM 11020 C CB . THR B 1 650 ? 16.822 -16.067 126.713 1.00 47.51 ? 650 THR B CB 1 +ATOM 11021 O OG1 . THR B 1 650 ? 17.597 -14.861 126.794 1.00 45.88 ? 650 THR B OG1 1 +ATOM 11022 C CG2 . THR B 1 650 ? 15.352 -15.756 127.030 1.00 47.10 ? 650 THR B CG2 1 +ATOM 11023 N N . ILE B 1 651 ? 15.791 -18.682 128.628 1.00 48.92 ? 651 ILE B N 1 +ATOM 11024 C CA . ILE B 1 651 ? 14.959 -19.865 128.638 1.00 49.75 ? 651 ILE B CA 1 +ATOM 11025 C C . ILE B 1 651 ? 13.519 -19.423 128.754 1.00 50.88 ? 651 ILE B C 1 +ATOM 11026 O O . ILE B 1 651 ? 13.162 -18.681 129.671 1.00 51.65 ? 651 ILE B O 1 +ATOM 11027 C CB . ILE B 1 651 ? 15.311 -20.769 129.836 1.00 49.44 ? 651 ILE B CB 1 +ATOM 11028 C CG1 . ILE B 1 651 ? 16.757 -21.243 129.695 1.00 51.10 ? 651 ILE B CG1 1 +ATOM 11029 C CG2 . ILE B 1 651 ? 14.355 -21.955 129.911 1.00 48.29 ? 651 ILE B CG2 1 +ATOM 11030 C CD1 . ILE B 1 651 ? 17.268 -22.041 130.875 1.00 53.93 ? 651 ILE B CD1 1 +ATOM 11031 N N . THR B 1 652 ? 12.691 -19.846 127.810 1.00 51.39 ? 652 THR B N 1 +ATOM 11032 C CA . THR B 1 652 ? 11.289 -19.479 127.882 1.00 51.69 ? 652 THR B CA 1 +ATOM 11033 C C . THR B 1 652 ? 10.634 -20.737 128.422 1.00 52.18 ? 652 THR B C 1 +ATOM 11034 O O . THR B 1 652 ? 10.934 -21.846 127.969 1.00 50.66 ? 652 THR B O 1 +ATOM 11035 C CB . THR B 1 652 ? 10.705 -19.085 126.489 1.00 50.52 ? 652 THR B CB 1 +ATOM 11036 O OG1 . THR B 1 652 ? 10.378 -20.260 125.753 1.00 51.58 ? 652 THR B OG1 1 +ATOM 11037 C CG2 . THR B 1 652 ? 11.714 -18.273 125.691 1.00 47.96 ? 652 THR B CG2 1 +ATOM 11038 N N . SER B 1 653 ? 9.772 -20.569 129.417 1.00 53.80 ? 653 SER B N 1 +ATOM 11039 C CA . SER B 1 653 ? 9.113 -21.712 130.029 1.00 56.00 ? 653 SER B CA 1 +ATOM 11040 C C . SER B 1 653 ? 7.864 -21.301 130.790 1.00 57.36 ? 653 SER B C 1 +ATOM 11041 O O . SER B 1 653 ? 7.839 -20.247 131.433 1.00 58.01 ? 653 SER B O 1 +ATOM 11042 C CB . SER B 1 653 ? 10.085 -22.405 130.990 1.00 56.42 ? 653 SER B CB 1 +ATOM 11043 O OG . SER B 1 653 ? 9.482 -23.523 131.623 1.00 57.30 ? 653 SER B OG 1 +ATOM 11044 N N . GLU B 1 654 ? 6.833 -22.138 130.715 1.00 58.78 ? 654 GLU B N 1 +ATOM 11045 C CA . GLU B 1 654 ? 5.586 -21.872 131.417 1.00 61.47 ? 654 GLU B CA 1 +ATOM 11046 C C . GLU B 1 654 ? 5.773 -22.199 132.894 1.00 62.52 ? 654 GLU B C 1 +ATOM 11047 O O . GLU B 1 654 ? 5.117 -21.616 133.755 1.00 63.41 ? 654 GLU B O 1 +ATOM 11048 C CB . GLU B 1 654 ? 4.448 -22.701 130.818 1.00 62.46 ? 654 GLU B CB 1 +ATOM 11049 C CG . GLU B 1 654 ? 4.143 -22.337 129.364 1.00 65.27 ? 654 GLU B CG 1 +ATOM 11050 C CD . GLU B 1 654 ? 2.946 -23.089 128.794 1.00 67.50 ? 654 GLU B CD 1 +ATOM 11051 O OE1 . GLU B 1 654 ? 1.812 -22.870 129.283 1.00 68.35 ? 654 GLU B OE1 1 +ATOM 11052 O OE2 . GLU B 1 654 ? 3.140 -23.899 127.857 1.00 68.11 ? 654 GLU B OE2 1 +ATOM 11053 N N . LYS B 1 655 ? 6.677 -23.132 133.181 1.00 63.19 ? 655 LYS B N 1 +ATOM 11054 C CA . LYS B 1 655 ? 6.981 -23.506 134.560 1.00 64.14 ? 655 LYS B CA 1 +ATOM 11055 C C . LYS B 1 655 ? 8.188 -22.672 134.980 1.00 63.73 ? 655 LYS B C 1 +ATOM 11056 O O . LYS B 1 655 ? 9.137 -22.510 134.217 1.00 64.21 ? 655 LYS B O 1 +ATOM 11057 C CB . LYS B 1 655 ? 7.298 -25.000 134.654 1.00 64.99 ? 655 LYS B CB 1 +ATOM 11058 C CG . LYS B 1 655 ? 6.117 -25.873 134.263 1.00 67.37 ? 655 LYS B CG 1 +ATOM 11059 C CD . LYS B 1 655 ? 6.407 -27.351 134.423 1.00 68.64 ? 655 LYS B CD 1 +ATOM 11060 C CE . LYS B 1 655 ? 5.175 -28.179 134.060 1.00 70.59 ? 655 LYS B CE 1 +ATOM 11061 N NZ . LYS B 1 655 ? 5.395 -29.654 134.208 1.00 72.11 ? 655 LYS B NZ 1 +ATOM 11062 N N . PRO B 1 656 ? 8.165 -22.125 136.198 1.00 63.27 ? 656 PRO B N 1 +ATOM 11063 C CA . PRO B 1 656 ? 9.275 -21.299 136.686 1.00 63.31 ? 656 PRO B CA 1 +ATOM 11064 C C . PRO B 1 656 ? 10.647 -21.975 136.723 1.00 63.15 ? 656 PRO B C 1 +ATOM 11065 O O . PRO B 1 656 ? 10.762 -23.184 136.913 1.00 63.04 ? 656 PRO B O 1 +ATOM 11066 C CB . PRO B 1 656 ? 8.795 -20.865 138.066 1.00 63.31 ? 656 PRO B CB 1 +ATOM 11067 C CG . PRO B 1 656 ? 7.955 -22.034 138.506 1.00 64.18 ? 656 PRO B CG 1 +ATOM 11068 C CD . PRO B 1 656 ? 7.170 -22.360 137.259 1.00 63.49 ? 656 PRO B CD 1 +ATOM 11069 N N . VAL B 1 657 ? 11.685 -21.173 136.522 1.00 62.83 ? 657 VAL B N 1 +ATOM 11070 C CA . VAL B 1 657 ? 13.059 -21.657 136.540 1.00 63.61 ? 657 VAL B CA 1 +ATOM 11071 C C . VAL B 1 657 ? 13.821 -20.812 137.559 1.00 64.29 ? 657 VAL B C 1 +ATOM 11072 O O . VAL B 1 657 ? 14.061 -19.621 137.344 1.00 63.42 ? 657 VAL B O 1 +ATOM 11073 C CB . VAL B 1 657 ? 13.736 -21.505 135.156 1.00 63.31 ? 657 VAL B CB 1 +ATOM 11074 C CG1 . VAL B 1 657 ? 15.143 -22.073 135.199 1.00 62.79 ? 657 VAL B CG1 1 +ATOM 11075 C CG2 . VAL B 1 657 ? 12.910 -22.209 134.091 1.00 63.60 ? 657 VAL B CG2 1 +ATOM 11076 N N . SER B 1 658 ? 14.196 -21.433 138.670 1.00 65.08 ? 658 SER B N 1 +ATOM 11077 C CA . SER B 1 658 ? 14.905 -20.727 139.726 1.00 66.38 ? 658 SER B CA 1 +ATOM 11078 C C . SER B 1 658 ? 16.411 -20.669 139.507 1.00 66.30 ? 658 SER B C 1 +ATOM 11079 O O . SER B 1 658 ? 17.060 -19.668 139.836 1.00 65.59 ? 658 SER B O 1 +ATOM 11080 C CB . SER B 1 658 ? 14.608 -21.387 141.077 1.00 67.63 ? 658 SER B CB 1 +ATOM 11081 O OG . SER B 1 658 ? 14.907 -22.777 141.041 1.00 70.16 ? 658 SER B OG 1 +ATOM 11082 N N . LYS B 1 659 ? 16.968 -21.733 138.940 1.00 66.11 ? 659 LYS B N 1 +ATOM 11083 C CA . LYS B 1 659 ? 18.405 -21.776 138.727 1.00 66.45 ? 659 LYS B CA 1 +ATOM 11084 C C . LYS B 1 659 ? 18.823 -22.773 137.664 1.00 65.59 ? 659 LYS B C 1 +ATOM 11085 O O . LYS B 1 659 ? 18.070 -23.682 137.301 1.00 65.28 ? 659 LYS B O 1 +ATOM 11086 C CB . LYS B 1 659 ? 19.105 -22.147 140.041 1.00 67.84 ? 659 LYS B CB 1 +ATOM 11087 C CG . LYS B 1 659 ? 18.766 -23.563 140.533 1.00 68.71 ? 659 LYS B CG 1 +ATOM 11088 C CD . LYS B 1 659 ? 19.527 -23.959 141.805 1.00 70.57 ? 659 LYS B CD 1 +ATOM 11089 C CE . LYS B 1 659 ? 19.072 -23.178 143.042 1.00 71.85 ? 659 LYS B CE 1 +ATOM 11090 N NZ . LYS B 1 659 ? 19.411 -21.719 142.993 1.00 72.85 ? 659 LYS B NZ 1 +ATOM 11091 N N . ILE B 1 660 ? 20.045 -22.594 137.177 1.00 64.76 ? 660 ILE B N 1 +ATOM 11092 C CA . ILE B 1 660 ? 20.620 -23.493 136.188 1.00 65.52 ? 660 ILE B CA 1 +ATOM 11093 C C . ILE B 1 660 ? 21.947 -23.971 136.767 1.00 65.47 ? 660 ILE B C 1 +ATOM 11094 O O . ILE B 1 660 ? 22.559 -23.283 137.593 1.00 65.80 ? 660 ILE B O 1 +ATOM 11095 C CB . ILE B 1 660 ? 20.902 -22.789 134.828 1.00 65.27 ? 660 ILE B CB 1 +ATOM 11096 C CG1 . ILE B 1 660 ? 21.896 -21.643 135.034 1.00 64.04 ? 660 ILE B CG1 1 +ATOM 11097 C CG2 . ILE B 1 660 ? 19.592 -22.313 134.196 1.00 64.38 ? 660 ILE B CG2 1 +ATOM 11098 C CD1 . ILE B 1 660 ? 22.446 -21.072 133.754 1.00 65.67 ? 660 ILE B CD1 1 +ATOM 11099 N N . ILE B 1 661 ? 22.391 -25.147 136.339 1.00 65.39 ? 661 ILE B N 1 +ATOM 11100 C CA . ILE B 1 661 ? 23.652 -25.698 136.816 1.00 64.77 ? 661 ILE B CA 1 +ATOM 11101 C C . ILE B 1 661 ? 24.571 -26.033 135.648 1.00 64.64 ? 661 ILE B C 1 +ATOM 11102 O O . ILE B 1 661 ? 24.235 -26.856 134.797 1.00 63.80 ? 661 ILE B O 1 +ATOM 11103 C CB . ILE B 1 661 ? 23.413 -26.964 137.653 1.00 64.66 ? 661 ILE B CB 1 +ATOM 11104 C CG1 . ILE B 1 661 ? 22.452 -26.641 138.803 1.00 64.66 ? 661 ILE B CG1 1 +ATOM 11105 C CG2 . ILE B 1 661 ? 24.738 -27.488 138.190 1.00 64.00 ? 661 ILE B CG2 1 +ATOM 11106 C CD1 . ILE B 1 661 ? 21.949 -27.848 139.557 1.00 63.34 ? 661 ILE B CD1 1 +ATOM 11107 N N . VAL B 1 662 ? 25.729 -25.382 135.612 1.00 65.30 ? 662 VAL B N 1 +ATOM 11108 C CA . VAL B 1 662 ? 26.699 -25.609 134.549 1.00 66.48 ? 662 VAL B CA 1 +ATOM 11109 C C . VAL B 1 662 ? 27.616 -26.790 134.851 1.00 68.01 ? 662 VAL B C 1 +ATOM 11110 O O . VAL B 1 662 ? 28.410 -26.748 135.795 1.00 67.93 ? 662 VAL B O 1 +ATOM 11111 C CB . VAL B 1 662 ? 27.571 -24.358 134.318 1.00 65.61 ? 662 VAL B CB 1 +ATOM 11112 C CG1 . VAL B 1 662 ? 28.598 -24.624 133.227 1.00 64.81 ? 662 VAL B CG1 1 +ATOM 11113 C CG2 . VAL B 1 662 ? 26.689 -23.187 133.932 1.00 66.91 ? 662 VAL B CG2 1 +ATOM 11114 N N . ASP B 1 663 ? 27.491 -27.843 134.045 1.00 69.43 ? 663 ASP B N 1 +ATOM 11115 C CA . ASP B 1 663 ? 28.313 -29.048 134.172 1.00 71.55 ? 663 ASP B CA 1 +ATOM 11116 C C . ASP B 1 663 ? 28.279 -29.735 135.544 1.00 72.77 ? 663 ASP B C 1 +ATOM 11117 O O . ASP B 1 663 ? 29.316 -30.129 136.087 1.00 71.95 ? 663 ASP B O 1 +ATOM 11118 C CB . ASP B 1 663 ? 29.766 -28.730 133.783 1.00 71.80 ? 663 ASP B CB 1 +ATOM 11119 C CG . ASP B 1 663 ? 29.897 -28.248 132.336 1.00 72.60 ? 663 ASP B CG 1 +ATOM 11120 O OD1 . ASP B 1 663 ? 29.428 -28.963 131.425 1.00 73.01 ? 663 ASP B OD1 1 +ATOM 11121 O OD2 . ASP B 1 663 ? 30.471 -27.159 132.109 1.00 71.03 ? 663 ASP B OD2 1 +ATOM 11122 N N . ASP B 1 664 ? 27.075 -29.890 136.085 1.00 74.95 ? 664 ASP B N 1 +ATOM 11123 C CA . ASP B 1 664 ? 26.882 -30.542 137.374 1.00 77.07 ? 664 ASP B CA 1 +ATOM 11124 C C . ASP B 1 664 ? 27.685 -29.918 138.503 1.00 77.95 ? 664 ASP B C 1 +ATOM 11125 O O . ASP B 1 664 ? 27.619 -30.379 139.641 1.00 78.06 ? 664 ASP B O 1 +ATOM 11126 C CB . ASP B 1 664 ? 27.235 -32.025 137.270 1.00 78.39 ? 664 ASP B CB 1 +ATOM 11127 C CG . ASP B 1 664 ? 26.298 -32.781 136.354 1.00 79.98 ? 664 ASP B CG 1 +ATOM 11128 O OD1 . ASP B 1 664 ? 25.067 -32.690 136.560 1.00 80.33 ? 664 ASP B OD1 1 +ATOM 11129 O OD2 . ASP B 1 664 ? 26.791 -33.471 135.434 1.00 81.09 ? 664 ASP B OD2 1 +ATOM 11130 N N . SER B 1 665 ? 28.444 -28.874 138.192 1.00 78.69 ? 665 SER B N 1 +ATOM 11131 C CA . SER B 1 665 ? 29.248 -28.205 139.202 1.00 79.28 ? 665 SER B CA 1 +ATOM 11132 C C . SER B 1 665 ? 28.690 -26.824 139.538 1.00 79.43 ? 665 SER B C 1 +ATOM 11133 O O . SER B 1 665 ? 27.737 -26.704 140.314 1.00 79.26 ? 665 SER B O 1 +ATOM 11134 C CB . SER B 1 665 ? 30.699 -28.088 138.724 1.00 80.69 ? 665 SER B CB 1 +ATOM 11135 O OG . SER B 1 665 ? 30.782 -27.426 137.472 1.00 83.39 ? 665 SER B OG 1 +ATOM 11136 N N . LYS B 1 666 ? 29.282 -25.788 138.945 1.00 79.36 ? 666 LYS B N 1 +ATOM 11137 C CA . LYS B 1 666 ? 28.859 -24.412 139.186 1.00 78.85 ? 666 LYS B CA 1 +ATOM 11138 C C . LYS B 1 666 ? 27.357 -24.184 139.024 1.00 79.25 ? 666 LYS B C 1 +ATOM 11139 O O . LYS B 1 666 ? 26.676 -24.893 138.280 1.00 79.49 ? 666 LYS B O 1 +ATOM 11140 C CB . LYS B 1 666 ? 29.624 -23.454 138.265 1.00 77.61 ? 666 LYS B CB 1 +ATOM 11141 C CG . LYS B 1 666 ? 29.251 -22.001 138.483 1.00 76.36 ? 666 LYS B CG 1 +ATOM 11142 C CD . LYS B 1 666 ? 30.269 -21.049 137.899 1.00 75.33 ? 666 LYS B CD 1 +ATOM 11143 C CE . LYS B 1 666 ? 29.949 -19.632 138.337 1.00 75.77 ? 666 LYS B CE 1 +ATOM 11144 N NZ . LYS B 1 666 ? 30.927 -18.632 137.829 1.00 76.59 ? 666 LYS B NZ 1 +ATOM 11145 N N . GLU B 1 667 ? 26.851 -23.183 139.735 1.00 79.82 ? 667 GLU B N 1 +ATOM 11146 C CA . GLU B 1 667 ? 25.437 -22.837 139.690 1.00 80.35 ? 667 GLU B CA 1 +ATOM 11147 C C . GLU B 1 667 ? 25.301 -21.347 139.402 1.00 79.85 ? 667 GLU B C 1 +ATOM 11148 O O . GLU B 1 667 ? 26.104 -20.540 139.880 1.00 79.13 ? 667 GLU B O 1 +ATOM 11149 C CB . GLU B 1 667 ? 24.772 -23.153 141.031 1.00 81.65 ? 667 GLU B CB 1 +ATOM 11150 C CG . GLU B 1 667 ? 23.519 -24.009 140.930 1.00 83.66 ? 667 GLU B CG 1 +ATOM 11151 C CD . GLU B 1 667 ? 22.803 -24.152 142.265 1.00 85.24 ? 667 GLU B CD 1 +ATOM 11152 O OE1 . GLU B 1 667 ? 22.288 -23.131 142.774 1.00 85.72 ? 667 GLU B OE1 1 +ATOM 11153 O OE2 . GLU B 1 667 ? 22.757 -25.282 142.804 1.00 85.47 ? 667 GLU B OE2 1 +ATOM 11154 N N . ILE B 1 668 ? 24.294 -20.988 138.610 1.00 79.23 ? 668 ILE B N 1 +ATOM 11155 C CA . ILE B 1 668 ? 24.056 -19.589 138.277 1.00 78.33 ? 668 ILE B CA 1 +ATOM 11156 C C . ILE B 1 668 ? 22.597 -19.220 138.513 1.00 77.90 ? 668 ILE B C 1 +ATOM 11157 O O . ILE B 1 668 ? 21.686 -19.998 138.217 1.00 77.33 ? 668 ILE B O 1 +ATOM 11158 C CB . ILE B 1 668 ? 24.440 -19.282 136.818 1.00 78.12 ? 668 ILE B CB 1 +ATOM 11159 C CG1 . ILE B 1 668 ? 25.936 -19.544 136.616 1.00 77.87 ? 668 ILE B CG1 1 +ATOM 11160 C CG2 . ILE B 1 668 ? 24.111 -17.833 136.490 1.00 78.52 ? 668 ILE B CG2 1 +ATOM 11161 C CD1 . ILE B 1 668 ? 26.446 -19.221 135.230 1.00 78.45 ? 668 ILE B CD1 1 +ATOM 11162 N N . GLN B 1 669 ? 22.393 -18.029 139.064 1.00 77.60 ? 669 GLN B N 1 +ATOM 11163 C CA . GLN B 1 669 ? 21.057 -17.533 139.373 1.00 77.62 ? 669 GLN B CA 1 +ATOM 11164 C C . GLN B 1 669 ? 20.312 -17.038 138.132 1.00 76.29 ? 669 GLN B C 1 +ATOM 11165 O O . GLN B 1 669 ? 20.903 -16.442 137.226 1.00 75.64 ? 669 GLN B O 1 +ATOM 11166 C CB . GLN B 1 669 ? 21.153 -16.409 140.412 1.00 78.70 ? 669 GLN B CB 1 +ATOM 11167 C CG . GLN B 1 669 ? 21.800 -16.822 141.739 1.00 80.51 ? 669 GLN B CG 1 +ATOM 11168 C CD . GLN B 1 669 ? 20.892 -17.685 142.611 1.00 81.78 ? 669 GLN B CD 1 +ATOM 11169 O OE1 . GLN B 1 669 ? 20.472 -18.776 142.213 1.00 82.63 ? 669 GLN B OE1 1 +ATOM 11170 N NE2 . GLN B 1 669 ? 20.589 -17.196 143.811 1.00 81.53 ? 669 GLN B NE2 1 +ATOM 11171 N N . VAL B 1 670 ? 19.007 -17.290 138.112 1.00 74.64 ? 670 VAL B N 1 +ATOM 11172 C CA . VAL B 1 670 ? 18.151 -16.892 137.005 1.00 73.28 ? 670 VAL B CA 1 +ATOM 11173 C C . VAL B 1 670 ? 17.256 -15.702 137.367 1.00 72.84 ? 670 VAL B C 1 +ATOM 11174 O O . VAL B 1 670 ? 16.630 -15.685 138.430 1.00 73.68 ? 670 VAL B O 1 +ATOM 11175 C CB . VAL B 1 670 ? 17.253 -18.069 136.578 1.00 73.24 ? 670 VAL B CB 1 +ATOM 11176 C CG1 . VAL B 1 670 ? 16.256 -17.620 135.538 1.00 73.36 ? 670 VAL B CG1 1 +ATOM 11177 C CG2 . VAL B 1 670 ? 18.106 -19.191 136.034 1.00 73.57 ? 670 VAL B CG2 1 +ATOM 11178 N N . GLU B 1 671 ? 17.201 -14.709 136.481 1.00 70.96 ? 671 GLU B N 1 +ATOM 11179 C CA . GLU B 1 671 ? 16.364 -13.529 136.691 1.00 68.80 ? 671 GLU B CA 1 +ATOM 11180 C C . GLU B 1 671 ? 15.212 -13.482 135.685 1.00 66.90 ? 671 GLU B C 1 +ATOM 11181 O O . GLU B 1 671 ? 15.435 -13.272 134.489 1.00 66.67 ? 671 GLU B O 1 +ATOM 11182 C CB . GLU B 1 671 ? 17.173 -12.236 136.544 1.00 69.57 ? 671 GLU B CB 1 +ATOM 11183 C CG . GLU B 1 671 ? 16.294 -10.980 136.611 1.00 72.48 ? 671 GLU B CG 1 +ATOM 11184 C CD . GLU B 1 671 ? 16.806 -9.828 135.749 1.00 74.54 ? 671 GLU B CD 1 +ATOM 11185 O OE1 . GLU B 1 671 ? 17.214 -10.084 134.595 1.00 75.42 ? 671 GLU B OE1 1 +ATOM 11186 O OE2 . GLU B 1 671 ? 16.783 -8.665 136.215 1.00 74.48 ? 671 GLU B OE2 1 +ATOM 11187 N N . LYS B 1 672 ? 13.988 -13.679 136.170 1.00 63.72 ? 672 LYS B N 1 +ATOM 11188 C CA . LYS B 1 672 ? 12.815 -13.620 135.308 1.00 60.75 ? 672 LYS B CA 1 +ATOM 11189 C C . LYS B 1 672 ? 12.703 -12.183 134.819 1.00 58.13 ? 672 LYS B C 1 +ATOM 11190 O O . LYS B 1 672 ? 12.555 -11.261 135.622 1.00 57.12 ? 672 LYS B O 1 +ATOM 11191 C CB . LYS B 1 672 ? 11.554 -14.006 136.085 1.00 61.76 ? 672 LYS B CB 1 +ATOM 11192 C CG . LYS B 1 672 ? 10.249 -13.697 135.361 1.00 61.93 ? 672 LYS B CG 1 +ATOM 11193 C CD . LYS B 1 672 ? 9.065 -14.203 136.165 1.00 63.62 ? 672 LYS B CD 1 +ATOM 11194 C CE . LYS B 1 672 ? 7.741 -13.732 135.579 1.00 65.19 ? 672 LYS B CE 1 +ATOM 11195 N NZ . LYS B 1 672 ? 6.562 -14.271 136.328 1.00 65.41 ? 672 LYS B NZ 1 +ATOM 11196 N N . THR B 1 673 ? 12.778 -12.000 133.503 1.00 54.66 ? 673 THR B N 1 +ATOM 11197 C CA . THR B 1 673 ? 12.712 -10.671 132.902 1.00 51.74 ? 673 THR B CA 1 +ATOM 11198 C C . THR B 1 673 ? 11.305 -10.254 132.490 1.00 49.79 ? 673 THR B C 1 +ATOM 11199 O O . THR B 1 673 ? 10.995 -9.068 132.447 1.00 48.83 ? 673 THR B O 1 +ATOM 11200 C CB . THR B 1 673 ? 13.628 -10.593 131.680 1.00 52.07 ? 673 THR B CB 1 +ATOM 11201 O OG1 . THR B 1 673 ? 13.317 -11.671 130.789 1.00 51.95 ? 673 THR B OG1 1 +ATOM 11202 C CG2 . THR B 1 673 ? 15.090 -10.689 132.108 1.00 51.18 ? 673 THR B CG2 1 +ATOM 11203 N N . MET B 1 674 ? 10.465 -11.238 132.185 1.00 47.90 ? 674 MET B N 1 +ATOM 11204 C CA . MET B 1 674 ? 9.078 -10.999 131.798 1.00 46.54 ? 674 MET B CA 1 +ATOM 11205 C C . MET B 1 674 ? 8.372 -12.346 131.786 1.00 45.21 ? 674 MET B C 1 +ATOM 11206 O O . MET B 1 674 ? 9.017 -13.382 131.936 1.00 45.40 ? 674 MET B O 1 +ATOM 11207 C CB . MET B 1 674 ? 8.992 -10.321 130.420 1.00 47.90 ? 674 MET B CB 1 +ATOM 11208 C CG . MET B 1 674 ? 9.418 -11.168 129.224 1.00 48.72 ? 674 MET B CG 1 +ATOM 11209 S SD . MET B 1 674 ? 9.449 -10.214 127.662 1.00 50.38 ? 674 MET B SD 1 +ATOM 11210 C CE . MET B 1 674 ? 10.383 -11.328 126.597 1.00 47.84 ? 674 MET B CE 1 +ATOM 11211 N N . GLN B 1 675 ? 7.057 -12.343 131.610 1.00 43.80 ? 675 GLN B N 1 +ATOM 11212 C CA . GLN B 1 675 ? 6.305 -13.590 131.619 1.00 43.38 ? 675 GLN B CA 1 +ATOM 11213 C C . GLN B 1 675 ? 6.968 -14.693 130.795 1.00 43.65 ? 675 GLN B C 1 +ATOM 11214 O O . GLN B 1 675 ? 7.404 -14.467 129.665 1.00 42.13 ? 675 GLN B O 1 +ATOM 11215 C CB . GLN B 1 675 ? 4.875 -13.357 131.121 1.00 42.04 ? 675 GLN B CB 1 +ATOM 11216 C CG . GLN B 1 675 ? 4.772 -13.089 129.629 1.00 42.93 ? 675 GLN B CG 1 +ATOM 11217 C CD . GLN B 1 675 ? 3.404 -12.566 129.222 1.00 42.06 ? 675 GLN B CD 1 +ATOM 11218 O OE1 . GLN B 1 675 ? 2.377 -13.103 129.639 1.00 41.90 ? 675 GLN B OE1 1 +ATOM 11219 N NE2 . GLN B 1 675 ? 3.388 -11.517 128.398 1.00 37.83 ? 675 GLN B NE2 1 +ATOM 11220 N N . ASN B 1 676 ? 7.050 -15.883 131.391 1.00 44.81 ? 676 ASN B N 1 +ATOM 11221 C CA . ASN B 1 676 ? 7.631 -17.065 130.754 1.00 45.46 ? 676 ASN B CA 1 +ATOM 11222 C C . ASN B 1 676 ? 9.087 -16.884 130.313 1.00 46.17 ? 676 ASN B C 1 +ATOM 11223 O O . ASN B 1 676 ? 9.634 -17.741 129.615 1.00 46.53 ? 676 ASN B O 1 +ATOM 11224 C CB . ASN B 1 676 ? 6.806 -17.456 129.522 1.00 45.81 ? 676 ASN B CB 1 +ATOM 11225 C CG . ASN B 1 676 ? 5.326 -17.594 129.819 1.00 46.26 ? 676 ASN B CG 1 +ATOM 11226 O OD1 . ASN B 1 676 ? 4.917 -18.417 130.639 1.00 45.91 ? 676 ASN B OD1 1 +ATOM 11227 N ND2 . ASN B 1 676 ? 4.509 -16.790 129.138 1.00 46.28 ? 676 ASN B ND2 1 +ATOM 11228 N N . THR B 1 677 ? 9.726 -15.797 130.725 1.00 46.09 ? 677 THR B N 1 +ATOM 11229 C CA . THR B 1 677 ? 11.096 -15.555 130.291 1.00 47.48 ? 677 THR B CA 1 +ATOM 11230 C C . THR B 1 677 ? 12.112 -15.486 131.428 1.00 48.84 ? 677 THR B C 1 +ATOM 11231 O O . THR B 1 677 ? 12.032 -14.625 132.313 1.00 49.55 ? 677 THR B O 1 +ATOM 11232 C CB . THR B 1 677 ? 11.162 -14.257 129.461 1.00 47.42 ? 677 THR B CB 1 +ATOM 11233 O OG1 . THR B 1 677 ? 10.102 -14.270 128.497 1.00 47.55 ? 677 THR B OG1 1 +ATOM 11234 C CG2 . THR B 1 677 ? 12.497 -14.135 128.737 1.00 45.67 ? 677 THR B CG2 1 +ATOM 11235 N N . TYR B 1 678 ? 13.087 -16.390 131.375 1.00 50.04 ? 678 TYR B N 1 +ATOM 11236 C CA . TYR B 1 678 ? 14.134 -16.476 132.387 1.00 49.73 ? 678 TYR B CA 1 +ATOM 11237 C C . TYR B 1 678 ? 15.520 -16.308 131.782 1.00 50.27 ? 678 TYR B C 1 +ATOM 11238 O O . TYR B 1 678 ? 15.875 -16.987 130.822 1.00 50.73 ? 678 TYR B O 1 +ATOM 11239 C CB . TYR B 1 678 ? 14.003 -17.812 133.092 1.00 49.80 ? 678 TYR B CB 1 +ATOM 11240 C CG . TYR B 1 678 ? 12.631 -17.969 133.710 1.00 51.31 ? 678 TYR B CG 1 +ATOM 11241 C CD1 . TYR B 1 678 ? 12.294 -17.290 134.877 1.00 50.41 ? 678 TYR B CD1 1 +ATOM 11242 C CD2 . TYR B 1 678 ? 11.659 -18.763 133.106 1.00 51.18 ? 678 TYR B CD2 1 +ATOM 11243 C CE1 . TYR B 1 678 ? 11.029 -17.398 135.431 1.00 51.42 ? 678 TYR B CE1 1 +ATOM 11244 C CE2 . TYR B 1 678 ? 10.382 -18.879 133.652 1.00 52.09 ? 678 TYR B CE2 1 +ATOM 11245 C CZ . TYR B 1 678 ? 10.075 -18.192 134.817 1.00 52.27 ? 678 TYR B CZ 1 +ATOM 11246 O OH . TYR B 1 678 ? 8.817 -18.296 135.374 1.00 51.87 ? 678 TYR B OH 1 +ATOM 11247 N N . VAL B 1 679 ? 16.300 -15.395 132.355 1.00 50.55 ? 679 VAL B N 1 +ATOM 11248 C CA . VAL B 1 679 ? 17.638 -15.110 131.859 1.00 50.57 ? 679 VAL B CA 1 +ATOM 11249 C C . VAL B 1 679 ? 18.760 -15.472 132.826 1.00 52.49 ? 679 VAL B C 1 +ATOM 11250 O O . VAL B 1 679 ? 18.642 -15.280 134.034 1.00 53.68 ? 679 VAL B O 1 +ATOM 11251 C CB . VAL B 1 679 ? 17.771 -13.624 131.516 1.00 49.51 ? 679 VAL B CB 1 +ATOM 11252 C CG1 . VAL B 1 679 ? 19.187 -13.314 131.041 1.00 49.39 ? 679 VAL B CG1 1 +ATOM 11253 C CG2 . VAL B 1 679 ? 16.756 -13.257 130.453 1.00 49.80 ? 679 VAL B CG2 1 +ATOM 11254 N N . ALA B 1 680 ? 19.855 -15.990 132.277 1.00 53.09 ? 680 ALA B N 1 +ATOM 11255 C CA . ALA B 1 680 ? 21.014 -16.366 133.073 1.00 53.09 ? 680 ALA B CA 1 +ATOM 11256 C C . ALA B 1 680 ? 22.266 -15.826 132.408 1.00 54.27 ? 680 ALA B C 1 +ATOM 11257 O O . ALA B 1 680 ? 22.582 -16.201 131.276 1.00 54.44 ? 680 ALA B O 1 +ATOM 11258 C CB . ALA B 1 680 ? 21.104 -17.868 133.182 1.00 52.15 ? 680 ALA B CB 1 +ATOM 11259 N N . LYS B 1 681 ? 22.962 -14.929 133.101 1.00 55.20 ? 681 LYS B N 1 +ATOM 11260 C CA . LYS B 1 681 ? 24.200 -14.359 132.583 1.00 57.79 ? 681 LYS B CA 1 +ATOM 11261 C C . LYS B 1 681 ? 25.315 -15.370 132.890 1.00 58.65 ? 681 LYS B C 1 +ATOM 11262 O O . LYS B 1 681 ? 25.887 -15.352 133.984 1.00 59.30 ? 681 LYS B O 1 +ATOM 11263 C CB . LYS B 1 681 ? 24.518 -13.035 133.282 1.00 59.68 ? 681 LYS B CB 1 +ATOM 11264 C CG . LYS B 1 681 ? 23.390 -12.008 133.290 1.00 63.01 ? 681 LYS B CG 1 +ATOM 11265 C CD . LYS B 1 681 ? 23.233 -11.309 131.946 1.00 65.57 ? 681 LYS B CD 1 +ATOM 11266 C CE . LYS B 1 681 ? 22.304 -10.100 132.072 1.00 67.53 ? 681 LYS B CE 1 +ATOM 11267 N NZ . LYS B 1 681 ? 22.197 -9.329 130.788 1.00 68.34 ? 681 LYS B NZ 1 +ATOM 11268 N N . ILE B 1 682 ? 25.613 -16.247 131.934 1.00 57.86 ? 682 ILE B N 1 +ATOM 11269 C CA . ILE B 1 682 ? 26.642 -17.262 132.116 1.00 57.33 ? 682 ILE B CA 1 +ATOM 11270 C C . ILE B 1 682 ? 28.067 -16.754 131.862 1.00 58.27 ? 682 ILE B C 1 +ATOM 11271 O O . ILE B 1 682 ? 28.950 -16.921 132.703 1.00 58.57 ? 682 ILE B O 1 +ATOM 11272 C CB . ILE B 1 682 ? 26.351 -18.474 131.215 1.00 56.14 ? 682 ILE B CB 1 +ATOM 11273 C CG1 . ILE B 1 682 ? 25.011 -19.091 131.634 1.00 56.29 ? 682 ILE B CG1 1 +ATOM 11274 C CG2 . ILE B 1 682 ? 27.481 -19.497 131.317 1.00 56.17 ? 682 ILE B CG2 1 +ATOM 11275 C CD1 . ILE B 1 682 ? 24.571 -20.273 130.805 1.00 55.22 ? 682 ILE B CD1 1 +ATOM 11276 N N . ASN B 1 683 ? 28.287 -16.141 130.707 1.00 59.00 ? 683 ASN B N 1 +ATOM 11277 C CA . ASN B 1 683 ? 29.601 -15.607 130.344 1.00 60.09 ? 683 ASN B CA 1 +ATOM 11278 C C . ASN B 1 683 ? 30.791 -16.512 130.667 1.00 60.29 ? 683 ASN B C 1 +ATOM 11279 O O . ASN B 1 683 ? 31.727 -16.101 131.351 1.00 60.34 ? 683 ASN B O 1 +ATOM 11280 C CB . ASN B 1 683 ? 29.810 -14.244 131.003 1.00 59.53 ? 683 ASN B CB 1 +ATOM 11281 C CG . ASN B 1 683 ? 28.751 -13.244 130.603 1.00 61.83 ? 683 ASN B CG 1 +ATOM 11282 O OD1 . ASN B 1 683 ? 28.500 -13.035 129.415 1.00 63.58 ? 683 ASN B OD1 1 +ATOM 11283 N ND2 . ASN B 1 683 ? 28.116 -12.618 131.591 1.00 62.53 ? 683 ASN B ND2 1 +ATOM 11284 N N . GLN B 1 684 ? 30.762 -17.739 130.162 1.00 60.71 ? 684 GLN B N 1 +ATOM 11285 C CA . GLN B 1 684 ? 31.858 -18.669 130.394 1.00 61.12 ? 684 GLN B CA 1 +ATOM 11286 C C . GLN B 1 684 ? 31.689 -19.904 129.521 1.00 60.89 ? 684 GLN B C 1 +ATOM 11287 O O . GLN B 1 684 ? 30.579 -20.221 129.096 1.00 61.47 ? 684 GLN B O 1 +ATOM 11288 C CB . GLN B 1 684 ? 31.887 -19.095 131.858 1.00 61.66 ? 684 GLN B CB 1 +ATOM 11289 C CG . GLN B 1 684 ? 30.783 -20.066 132.216 1.00 63.61 ? 684 GLN B CG 1 +ATOM 11290 C CD . GLN B 1 684 ? 30.902 -20.571 133.637 1.00 65.19 ? 684 GLN B CD 1 +ATOM 11291 O OE1 . GLN B 1 684 ? 30.838 -19.790 134.588 1.00 65.66 ? 684 GLN B OE1 1 +ATOM 11292 N NE2 . GLN B 1 684 ? 31.077 -21.885 133.792 1.00 65.19 ? 684 GLN B NE2 1 +ATOM 11293 N N . LYS B 1 685 ? 32.787 -20.607 129.266 1.00 60.48 ? 685 LYS B N 1 +ATOM 11294 C CA . LYS B 1 685 ? 32.736 -21.810 128.449 1.00 61.18 ? 685 LYS B CA 1 +ATOM 11295 C C . LYS B 1 685 ? 31.977 -22.922 129.162 1.00 60.82 ? 685 LYS B C 1 +ATOM 11296 O O . LYS B 1 685 ? 31.954 -22.981 130.387 1.00 62.20 ? 685 LYS B O 1 +ATOM 11297 C CB . LYS B 1 685 ? 34.154 -22.279 128.103 1.00 62.64 ? 685 LYS B CB 1 +ATOM 11298 C CG . LYS B 1 685 ? 34.903 -21.326 127.182 1.00 64.97 ? 685 LYS B CG 1 +ATOM 11299 C CD . LYS B 1 685 ? 36.151 -21.967 126.587 1.00 67.90 ? 685 LYS B CD 1 +ATOM 11300 C CE . LYS B 1 685 ? 37.201 -22.257 127.657 1.00 70.29 ? 685 LYS B CE 1 +ATOM 11301 N NZ . LYS B 1 685 ? 37.704 -21.011 128.307 1.00 71.19 ? 685 LYS B NZ 1 +ATOM 11302 N N . ILE B 1 686 ? 31.344 -23.795 128.390 1.00 60.89 ? 686 ILE B N 1 +ATOM 11303 C CA . ILE B 1 686 ? 30.590 -24.915 128.947 1.00 61.94 ? 686 ILE B CA 1 +ATOM 11304 C C . ILE B 1 686 ? 31.105 -26.202 128.303 1.00 63.23 ? 686 ILE B C 1 +ATOM 11305 O O . ILE B 1 686 ? 31.006 -26.380 127.095 1.00 63.82 ? 686 ILE B O 1 +ATOM 11306 C CB . ILE B 1 686 ? 29.078 -24.748 128.671 1.00 61.67 ? 686 ILE B CB 1 +ATOM 11307 C CG1 . ILE B 1 686 ? 28.574 -23.491 129.383 1.00 61.79 ? 686 ILE B CG1 1 +ATOM 11308 C CG2 . ILE B 1 686 ? 28.306 -25.980 129.139 1.00 60.16 ? 686 ILE B CG2 1 +ATOM 11309 C CD1 . ILE B 1 686 ? 27.133 -23.166 129.100 1.00 62.01 ? 686 ILE B CD1 1 +ATOM 11310 N N . ARG B 1 687 ? 31.661 -27.099 129.107 1.00 64.59 ? 687 ARG B N 1 +ATOM 11311 C CA . ARG B 1 687 ? 32.212 -28.339 128.577 1.00 64.76 ? 687 ARG B CA 1 +ATOM 11312 C C . ARG B 1 687 ? 31.166 -29.219 127.896 1.00 63.80 ? 687 ARG B C 1 +ATOM 11313 O O . ARG B 1 687 ? 31.408 -29.742 126.805 1.00 64.92 ? 687 ARG B O 1 +ATOM 11314 C CB . ARG B 1 687 ? 32.909 -29.138 129.691 1.00 66.55 ? 687 ARG B CB 1 +ATOM 11315 C CG . ARG B 1 687 ? 33.265 -28.339 130.948 1.00 69.01 ? 687 ARG B CG 1 +ATOM 11316 C CD . ARG B 1 687 ? 34.213 -27.167 130.681 1.00 70.41 ? 687 ARG B CD 1 +ATOM 11317 N NE . ARG B 1 687 ? 35.544 -27.603 130.270 1.00 72.67 ? 687 ARG B NE 1 +ATOM 11318 C CZ . ARG B 1 687 ? 36.602 -26.802 130.173 1.00 73.38 ? 687 ARG B CZ 1 +ATOM 11319 N NH1 . ARG B 1 687 ? 36.492 -25.510 130.465 1.00 72.93 ? 687 ARG B NH1 1 +ATOM 11320 N NH2 . ARG B 1 687 ? 37.768 -27.295 129.765 1.00 73.51 ? 687 ARG B NH2 1 +ATOM 11321 N N . GLY B 1 688 ? 30.001 -29.386 128.516 1.00 62.23 ? 688 GLY B N 1 +ATOM 11322 C CA . GLY B 1 688 ? 29.014 -30.242 127.889 1.00 60.49 ? 688 GLY B CA 1 +ATOM 11323 C C . GLY B 1 688 ? 27.549 -30.156 128.269 1.00 60.47 ? 688 GLY B C 1 +ATOM 11324 O O . GLY B 1 688 ? 26.715 -30.697 127.544 1.00 60.17 ? 688 GLY B O 1 +ATOM 11325 N N . LYS B 1 689 ? 27.196 -29.514 129.379 1.00 60.70 ? 689 LYS B N 1 +ATOM 11326 C CA . LYS B 1 689 ? 25.775 -29.454 129.711 1.00 61.41 ? 689 LYS B CA 1 +ATOM 11327 C C . LYS B 1 689 ? 25.332 -28.434 130.749 1.00 61.41 ? 689 LYS B C 1 +ATOM 11328 O O . LYS B 1 689 ? 26.132 -27.924 131.534 1.00 62.47 ? 689 LYS B O 1 +ATOM 11329 C CB . LYS B 1 689 ? 25.269 -30.834 130.138 1.00 61.35 ? 689 LYS B CB 1 +ATOM 11330 C CG . LYS B 1 689 ? 25.580 -31.199 131.572 1.00 63.44 ? 689 LYS B CG 1 +ATOM 11331 C CD . LYS B 1 689 ? 24.809 -32.448 131.977 1.00 64.60 ? 689 LYS B CD 1 +ATOM 11332 C CE . LYS B 1 689 ? 24.858 -32.674 133.484 1.00 65.88 ? 689 LYS B CE 1 +ATOM 11333 N NZ . LYS B 1 689 ? 24.003 -33.828 133.913 1.00 66.30 ? 689 LYS B NZ 1 +ATOM 11334 N N . ILE B 1 690 ? 24.030 -28.155 130.728 1.00 61.18 ? 690 ILE B N 1 +ATOM 11335 C CA . ILE B 1 690 ? 23.387 -27.215 131.637 1.00 60.83 ? 690 ILE B CA 1 +ATOM 11336 C C . ILE B 1 690 ? 22.084 -27.854 132.092 1.00 62.00 ? 690 ILE B C 1 +ATOM 11337 O O . ILE B 1 690 ? 21.358 -28.429 131.279 1.00 62.73 ? 690 ILE B O 1 +ATOM 11338 C CB . ILE B 1 690 ? 23.037 -25.888 130.933 1.00 59.69 ? 690 ILE B CB 1 +ATOM 11339 C CG1 . ILE B 1 690 ? 24.312 -25.173 130.483 1.00 59.22 ? 690 ILE B CG1 1 +ATOM 11340 C CG2 . ILE B 1 690 ? 22.234 -25.003 131.866 1.00 59.31 ? 690 ILE B CG2 1 +ATOM 11341 C CD1 . ILE B 1 690 ? 24.046 -23.864 129.758 1.00 59.20 ? 690 ILE B CD1 1 +ATOM 11342 N N . ASN B 1 691 ? 21.793 -27.774 133.387 1.00 63.11 ? 691 ASN B N 1 +ATOM 11343 C CA . ASN B 1 691 ? 20.552 -28.335 133.905 1.00 64.94 ? 691 ASN B CA 1 +ATOM 11344 C C . ASN B 1 691 ? 19.671 -27.227 134.446 1.00 66.32 ? 691 ASN B C 1 +ATOM 11345 O O . ASN B 1 691 ? 20.167 -26.210 134.933 1.00 66.13 ? 691 ASN B O 1 +ATOM 11346 C CB . ASN B 1 691 ? 20.824 -29.357 135.010 1.00 64.88 ? 691 ASN B CB 1 +ATOM 11347 C CG . ASN B 1 691 ? 21.470 -30.619 134.485 1.00 65.33 ? 691 ASN B CG 1 +ATOM 11348 O OD1 . ASN B 1 691 ? 22.666 -30.644 134.201 1.00 66.70 ? 691 ASN B OD1 1 +ATOM 11349 N ND2 . ASN B 1 691 ? 20.675 -31.673 134.337 1.00 64.96 ? 691 ASN B ND2 1 +ATOM 11350 N N . LEU B 1 692 ? 18.363 -27.424 134.354 1.00 68.16 ? 692 LEU B N 1 +ATOM 11351 C CA . LEU B 1 692 ? 17.415 -26.430 134.840 1.00 71.16 ? 692 LEU B CA 1 +ATOM 11352 C C . LEU B 1 692 ? 16.677 -26.936 136.071 1.00 73.04 ? 692 LEU B C 1 +ATOM 11353 O O . LEU B 1 692 ? 16.388 -28.129 136.188 1.00 73.42 ? 692 LEU B O 1 +ATOM 11354 C CB . LEU B 1 692 ? 16.405 -26.079 133.741 1.00 71.55 ? 692 LEU B CB 1 +ATOM 11355 C CG . LEU B 1 692 ? 16.862 -25.192 132.574 1.00 72.27 ? 692 LEU B CG 1 +ATOM 11356 C CD1 . LEU B 1 692 ? 18.101 -25.770 131.900 1.00 71.37 ? 692 LEU B CD1 1 +ATOM 11357 C CD2 . LEU B 1 692 ? 15.713 -25.062 131.579 1.00 71.24 ? 692 LEU B CD2 1 +ATOM 11358 N N . GLU B 1 693 ? 16.374 -26.022 136.988 1.00 75.46 ? 693 GLU B N 1 +ATOM 11359 C CA . GLU B 1 693 ? 15.660 -26.372 138.213 1.00 77.63 ? 693 GLU B CA 1 +ATOM 11360 C C . GLU B 1 693 ? 14.656 -25.290 138.616 1.00 77.56 ? 693 GLU B C 1 +ATOM 11361 O O . GLU B 1 693 ? 14.880 -24.097 138.388 1.00 77.20 ? 693 GLU B O 1 +ATOM 11362 C CB . GLU B 1 693 ? 16.654 -26.599 139.354 1.00 79.33 ? 693 GLU B CB 1 +ATOM 11363 C CG . GLU B 1 693 ? 17.716 -27.642 139.050 1.00 82.31 ? 693 GLU B CG 1 +ATOM 11364 C CD . GLU B 1 693 ? 18.604 -27.929 140.246 1.00 84.37 ? 693 GLU B CD 1 +ATOM 11365 O OE1 . GLU B 1 693 ? 19.149 -26.965 140.828 1.00 85.19 ? 693 GLU B OE1 1 +ATOM 11366 O OE2 . GLU B 1 693 ? 18.758 -29.119 140.601 1.00 85.10 ? 693 GLU B OE2 1 +ATOM 11367 N N . ILE C 1 3 ? -45.000 16.294 62.806 1.00 58.89 ? 3 ILE C N 1 +ATOM 11368 C CA . ILE C 1 3 ? -46.323 16.437 63.488 1.00 59.00 ? 3 ILE C CA 1 +ATOM 11369 C C . ILE C 1 3 ? -46.256 16.091 64.975 1.00 57.98 ? 3 ILE C C 1 +ATOM 11370 O O . ILE C 1 3 ? -45.528 15.195 65.390 1.00 57.88 ? 3 ILE C O 1 +ATOM 11371 C CB . ILE C 1 3 ? -47.407 15.551 62.815 1.00 60.62 ? 3 ILE C CB 1 +ATOM 11372 C CG1 . ILE C 1 3 ? -46.958 14.086 62.786 1.00 61.94 ? 3 ILE C CG1 1 +ATOM 11373 C CG2 . ILE C 1 3 ? -47.675 16.046 61.399 1.00 62.00 ? 3 ILE C CG2 1 +ATOM 11374 C CD1 . ILE C 1 3 ? -47.894 13.160 62.006 1.00 62.40 ? 3 ILE C CD1 1 +ATOM 11375 N N . LEU C 1 4 ? -47.029 16.811 65.777 1.00 56.76 ? 4 LEU C N 1 +ATOM 11376 C CA . LEU C 1 4 ? -47.050 16.591 67.211 1.00 54.86 ? 4 LEU C CA 1 +ATOM 11377 C C . LEU C 1 4 ? -48.428 16.208 67.704 1.00 53.96 ? 4 LEU C C 1 +ATOM 11378 O O . LEU C 1 4 ? -49.430 16.769 67.280 1.00 53.72 ? 4 LEU C O 1 +ATOM 11379 C CB . LEU C 1 4 ? -46.602 17.854 67.944 1.00 55.32 ? 4 LEU C CB 1 +ATOM 11380 C CG . LEU C 1 4 ? -46.821 17.840 69.459 1.00 56.65 ? 4 LEU C CG 1 +ATOM 11381 C CD1 . LEU C 1 4 ? -45.898 16.819 70.097 1.00 56.62 ? 4 LEU C CD1 1 +ATOM 11382 C CD2 . LEU C 1 4 ? -46.561 19.224 70.035 1.00 56.17 ? 4 LEU C CD2 1 +ATOM 11383 N N . LYS C 1 5 ? -48.466 15.240 68.605 1.00 54.18 ? 5 LYS C N 1 +ATOM 11384 C CA . LYS C 1 5 ? -49.711 14.795 69.200 1.00 55.06 ? 5 LYS C CA 1 +ATOM 11385 C C . LYS C 1 5 ? -49.410 14.396 70.634 1.00 54.86 ? 5 LYS C C 1 +ATOM 11386 O O . LYS C 1 5 ? -48.405 13.743 70.907 1.00 54.88 ? 5 LYS C O 1 +ATOM 11387 C CB . LYS C 1 5 ? -50.303 13.605 68.440 1.00 57.86 ? 5 LYS C CB 1 +ATOM 11388 C CG . LYS C 1 5 ? -50.828 13.940 67.041 1.00 60.50 ? 5 LYS C CG 1 +ATOM 11389 C CD . LYS C 1 5 ? -49.798 13.638 65.956 1.00 62.27 ? 5 LYS C CD 1 +ATOM 11390 C CE . LYS C 1 5 ? -49.574 12.135 65.807 1.00 62.38 ? 5 LYS C CE 1 +ATOM 11391 N NZ . LYS C 1 5 ? -48.512 11.819 64.803 1.00 64.13 ? 5 LYS C NZ 1 +ATOM 11392 N N . ILE C 1 6 ? -50.275 14.806 71.552 1.00 54.08 ? 6 ILE C N 1 +ATOM 11393 C CA . ILE C 1 6 ? -50.086 14.487 72.954 1.00 52.97 ? 6 ILE C CA 1 +ATOM 11394 C C . ILE C 1 6 ? -51.328 13.830 73.521 1.00 53.73 ? 6 ILE C C 1 +ATOM 11395 O O . ILE C 1 6 ? -52.436 14.317 73.322 1.00 54.52 ? 6 ILE C O 1 +ATOM 11396 C CB . ILE C 1 6 ? -49.790 15.750 73.778 1.00 51.38 ? 6 ILE C CB 1 +ATOM 11397 C CG1 . ILE C 1 6 ? -48.586 16.481 73.183 1.00 49.58 ? 6 ILE C CG1 1 +ATOM 11398 C CG2 . ILE C 1 6 ? -49.544 15.367 75.233 1.00 50.69 ? 6 ILE C CG2 1 +ATOM 11399 C CD1 . ILE C 1 6 ? -48.253 17.777 73.864 1.00 48.72 ? 6 ILE C CD1 1 +ATOM 11400 N N . TYR C 1 7 ? -51.132 12.716 74.217 1.00 54.44 ? 7 TYR C N 1 +ATOM 11401 C CA . TYR C 1 7 ? -52.226 11.995 74.844 1.00 55.48 ? 7 TYR C CA 1 +ATOM 11402 C C . TYR C 1 7 ? -51.981 12.017 76.343 1.00 57.39 ? 7 TYR C C 1 +ATOM 11403 O O . TYR C 1 7 ? -50.866 12.280 76.788 1.00 57.64 ? 7 TYR C O 1 +ATOM 11404 C CB . TYR C 1 7 ? -52.279 10.548 74.357 1.00 54.43 ? 7 TYR C CB 1 +ATOM 11405 C CG . TYR C 1 7 ? -52.441 10.409 72.867 1.00 54.40 ? 7 TYR C CG 1 +ATOM 11406 C CD1 . TYR C 1 7 ? -51.329 10.363 72.027 1.00 54.26 ? 7 TYR C CD1 1 +ATOM 11407 C CD2 . TYR C 1 7 ? -53.708 10.342 72.289 1.00 54.46 ? 7 TYR C CD2 1 +ATOM 11408 C CE1 . TYR C 1 7 ? -51.476 10.251 70.642 1.00 55.07 ? 7 TYR C CE1 1 +ATOM 11409 C CE2 . TYR C 1 7 ? -53.869 10.231 70.910 1.00 54.55 ? 7 TYR C CE2 1 +ATOM 11410 C CZ . TYR C 1 7 ? -52.752 10.185 70.091 1.00 55.47 ? 7 TYR C CZ 1 +ATOM 11411 O OH . TYR C 1 7 ? -52.908 10.068 68.727 1.00 55.50 ? 7 TYR C OH 1 +ATOM 11412 N N . GLU C 1 8 ? -53.023 11.742 77.117 1.00 59.45 ? 8 GLU C N 1 +ATOM 11413 C CA . GLU C 1 8 ? -52.918 11.738 78.567 1.00 61.00 ? 8 GLU C CA 1 +ATOM 11414 C C . GLU C 1 8 ? -53.686 10.534 79.069 1.00 61.07 ? 8 GLU C C 1 +ATOM 11415 O O . GLU C 1 8 ? -54.723 10.166 78.507 1.00 60.42 ? 8 GLU C O 1 +ATOM 11416 C CB . GLU C 1 8 ? -53.514 13.027 79.138 1.00 64.79 ? 8 GLU C CB 1 +ATOM 11417 C CG . GLU C 1 8 ? -53.285 13.260 80.634 1.00 71.08 ? 8 GLU C CG 1 +ATOM 11418 C CD . GLU C 1 8 ? -54.049 12.286 81.523 1.00 75.31 ? 8 GLU C CD 1 +ATOM 11419 O OE1 . GLU C 1 8 ? -55.254 12.051 81.253 1.00 77.59 ? 8 GLU C OE1 1 +ATOM 11420 O OE2 . GLU C 1 8 ? -53.449 11.769 82.500 1.00 76.07 ? 8 GLU C OE2 1 +ATOM 11421 N N . ASN C 1 9 ? -53.172 9.908 80.121 1.00 61.13 ? 9 ASN C N 1 +ATOM 11422 C CA . ASN C 1 9 ? -53.825 8.735 80.677 1.00 61.19 ? 9 ASN C CA 1 +ATOM 11423 C C . ASN C 1 9 ? -53.392 8.480 82.103 1.00 60.59 ? 9 ASN C C 1 +ATOM 11424 O O . ASN C 1 9 ? -52.297 7.974 82.339 1.00 60.91 ? 9 ASN C O 1 +ATOM 11425 C CB . ASN C 1 9 ? -53.506 7.493 79.834 1.00 62.34 ? 9 ASN C CB 1 +ATOM 11426 C CG . ASN C 1 9 ? -54.267 6.259 80.295 1.00 63.29 ? 9 ASN C CG 1 +ATOM 11427 O OD1 . ASN C 1 9 ? -54.051 5.156 79.788 1.00 64.09 ? 9 ASN C OD1 1 +ATOM 11428 N ND2 . ASN C 1 9 ? -55.174 6.443 81.251 1.00 65.28 ? 9 ASN C ND2 1 +ATOM 11429 N N . LYS C 1 10 ? -54.255 8.840 83.047 1.00 59.85 ? 10 LYS C N 1 +ATOM 11430 C CA . LYS C 1 10 ? -53.993 8.618 84.463 1.00 58.98 ? 10 LYS C CA 1 +ATOM 11431 C C . LYS C 1 10 ? -52.593 9.021 84.932 1.00 57.61 ? 10 LYS C C 1 +ATOM 11432 O O . LYS C 1 10 ? -51.842 8.195 85.453 1.00 57.15 ? 10 LYS C O 1 +ATOM 11433 C CB . LYS C 1 10 ? -54.246 7.142 84.789 1.00 59.59 ? 10 LYS C CB 1 +ATOM 11434 C CG . LYS C 1 10 ? -55.630 6.670 84.369 1.00 63.09 ? 10 LYS C CG 1 +ATOM 11435 C CD . LYS C 1 10 ? -55.778 5.156 84.440 1.00 65.86 ? 10 LYS C CD 1 +ATOM 11436 C CE . LYS C 1 10 ? -57.065 4.719 83.741 1.00 68.52 ? 10 LYS C CE 1 +ATOM 11437 N NZ . LYS C 1 10 ? -57.256 3.236 83.705 1.00 70.57 ? 10 LYS C NZ 1 +ATOM 11438 N N . GLY C 1 11 ? -52.242 10.289 84.737 1.00 56.27 ? 11 GLY C N 1 +ATOM 11439 C CA . GLY C 1 11 ? -50.947 10.775 85.184 1.00 55.15 ? 11 GLY C CA 1 +ATOM 11440 C C . GLY C 1 11 ? -49.759 10.578 84.262 1.00 53.81 ? 11 GLY C C 1 +ATOM 11441 O O . GLY C 1 11 ? -48.619 10.849 84.643 1.00 54.07 ? 11 GLY C O 1 +ATOM 11442 N N . VAL C 1 12 ? -50.014 10.111 83.049 1.00 52.49 ? 12 VAL C N 1 +ATOM 11443 C CA . VAL C 1 12 ? -48.945 9.895 82.084 1.00 50.20 ? 12 VAL C CA 1 +ATOM 11444 C C . VAL C 1 12 ? -49.275 10.590 80.767 1.00 49.21 ? 12 VAL C C 1 +ATOM 11445 O O . VAL C 1 12 ? -50.382 10.457 80.247 1.00 49.34 ? 12 VAL C O 1 +ATOM 11446 C CB . VAL C 1 12 ? -48.749 8.397 81.808 1.00 49.46 ? 12 VAL C CB 1 +ATOM 11447 C CG1 . VAL C 1 12 ? -47.671 8.206 80.764 1.00 49.85 ? 12 VAL C CG1 1 +ATOM 11448 C CG2 . VAL C 1 12 ? -48.402 7.670 83.094 1.00 47.86 ? 12 VAL C CG2 1 +ATOM 11449 N N . TYR C 1 13 ? -48.315 11.336 80.236 1.00 47.40 ? 13 TYR C N 1 +ATOM 11450 C CA . TYR C 1 13 ? -48.515 12.022 78.972 1.00 46.12 ? 13 TYR C CA 1 +ATOM 11451 C C . TYR C 1 13 ? -47.683 11.340 77.903 1.00 45.47 ? 13 TYR C C 1 +ATOM 11452 O O . TYR C 1 13 ? -46.478 11.187 78.062 1.00 44.71 ? 13 TYR C O 1 +ATOM 11453 C CB . TYR C 1 13 ? -48.085 13.483 79.066 1.00 47.68 ? 13 TYR C CB 1 +ATOM 11454 C CG . TYR C 1 13 ? -48.945 14.313 79.977 1.00 50.01 ? 13 TYR C CG 1 +ATOM 11455 C CD1 . TYR C 1 13 ? -48.654 14.423 81.335 1.00 50.14 ? 13 TYR C CD1 1 +ATOM 11456 C CD2 . TYR C 1 13 ? -50.061 14.987 79.481 1.00 50.65 ? 13 TYR C CD2 1 +ATOM 11457 C CE1 . TYR C 1 13 ? -49.455 15.187 82.179 1.00 51.94 ? 13 TYR C CE1 1 +ATOM 11458 C CE2 . TYR C 1 13 ? -50.868 15.752 80.312 1.00 52.84 ? 13 TYR C CE2 1 +ATOM 11459 C CZ . TYR C 1 13 ? -50.560 15.850 81.660 1.00 53.36 ? 13 TYR C CZ 1 +ATOM 11460 O OH . TYR C 1 13 ? -51.360 16.611 82.479 1.00 54.34 ? 13 TYR C OH 1 +ATOM 11461 N N . LYS C 1 14 ? -48.327 10.924 76.817 1.00 44.04 ? 14 LYS C N 1 +ATOM 11462 C CA . LYS C 1 14 ? -47.612 10.276 75.734 1.00 41.98 ? 14 LYS C CA 1 +ATOM 11463 C C . LYS C 1 14 ? -47.426 11.302 74.631 1.00 41.71 ? 14 LYS C C 1 +ATOM 11464 O O . LYS C 1 14 ? -48.391 11.737 74.021 1.00 43.33 ? 14 LYS C O 1 +ATOM 11465 C CB . LYS C 1 14 ? -48.396 9.073 75.203 1.00 40.62 ? 14 LYS C CB 1 +ATOM 11466 C CG . LYS C 1 14 ? -47.693 8.379 74.053 1.00 40.27 ? 14 LYS C CG 1 +ATOM 11467 C CD . LYS C 1 14 ? -48.436 7.153 73.571 1.00 40.76 ? 14 LYS C CD 1 +ATOM 11468 C CE . LYS C 1 14 ? -47.652 6.479 72.457 1.00 41.78 ? 14 LYS C CE 1 +ATOM 11469 N NZ . LYS C 1 14 ? -48.216 5.155 72.064 1.00 44.33 ? 14 LYS C NZ 1 +ATOM 11470 N N . VAL C 1 15 ? -46.184 11.699 74.388 1.00 40.25 ? 15 VAL C N 1 +ATOM 11471 C CA . VAL C 1 15 ? -45.877 12.675 73.353 1.00 39.01 ? 15 VAL C CA 1 +ATOM 11472 C C . VAL C 1 15 ? -45.381 11.956 72.108 1.00 39.44 ? 15 VAL C C 1 +ATOM 11473 O O . VAL C 1 15 ? -44.406 11.207 72.154 1.00 40.98 ? 15 VAL C O 1 +ATOM 11474 C CB . VAL C 1 15 ? -44.792 13.669 73.827 1.00 40.35 ? 15 VAL C CB 1 +ATOM 11475 C CG1 . VAL C 1 15 ? -44.515 14.703 72.745 1.00 38.32 ? 15 VAL C CG1 1 +ATOM 11476 C CG2 . VAL C 1 15 ? -45.247 14.353 75.103 1.00 39.12 ? 15 VAL C CG2 1 +ATOM 11477 N N . VAL C 1 16 ? -46.057 12.185 70.993 1.00 40.05 ? 16 VAL C N 1 +ATOM 11478 C CA . VAL C 1 16 ? -45.698 11.541 69.739 1.00 40.49 ? 16 VAL C CA 1 +ATOM 11479 C C . VAL C 1 16 ? -45.187 12.568 68.747 1.00 41.46 ? 16 VAL C C 1 +ATOM 11480 O O . VAL C 1 16 ? -45.893 13.509 68.407 1.00 42.48 ? 16 VAL C O 1 +ATOM 11481 C CB . VAL C 1 16 ? -46.917 10.815 69.115 1.00 40.57 ? 16 VAL C CB 1 +ATOM 11482 C CG1 . VAL C 1 16 ? -46.505 10.126 67.826 1.00 40.81 ? 16 VAL C CG1 1 +ATOM 11483 C CG2 . VAL C 1 16 ? -47.490 9.797 70.098 1.00 39.56 ? 16 VAL C CG2 1 +ATOM 11484 N N . ILE C 1 17 ? -43.953 12.386 68.292 1.00 42.68 ? 17 ILE C N 1 +ATOM 11485 C CA . ILE C 1 17 ? -43.345 13.292 67.326 1.00 43.19 ? 17 ILE C CA 1 +ATOM 11486 C C . ILE C 1 17 ? -43.263 12.554 66.000 1.00 44.68 ? 17 ILE C C 1 +ATOM 11487 O O . ILE C 1 17 ? -42.619 11.513 65.903 1.00 45.15 ? 17 ILE C O 1 +ATOM 11488 C CB . ILE C 1 17 ? -41.923 13.692 67.754 1.00 44.80 ? 17 ILE C CB 1 +ATOM 11489 C CG1 . ILE C 1 17 ? -41.952 14.292 69.159 1.00 45.64 ? 17 ILE C CG1 1 +ATOM 11490 C CG2 . ILE C 1 17 ? -41.342 14.685 66.770 1.00 43.33 ? 17 ILE C CG2 1 +ATOM 11491 C CD1 . ILE C 1 17 ? -42.825 15.517 69.280 1.00 47.91 ? 17 ILE C CD1 1 +ATOM 11492 N N . GLY C 1 18 ? -43.922 13.092 64.979 1.00 46.17 ? 18 GLY C N 1 +ATOM 11493 C CA . GLY C 1 18 ? -43.918 12.454 63.676 1.00 47.25 ? 18 GLY C CA 1 +ATOM 11494 C C . GLY C 1 18 ? -44.731 11.175 63.701 1.00 49.41 ? 18 GLY C C 1 +ATOM 11495 O O . GLY C 1 18 ? -45.771 11.106 64.356 1.00 49.76 ? 18 GLY C O 1 +ATOM 11496 N N . GLU C 1 19 ? -44.253 10.157 62.992 1.00 51.75 ? 19 GLU C N 1 +ATOM 11497 C CA . GLU C 1 19 ? -44.928 8.863 62.928 1.00 54.41 ? 19 GLU C CA 1 +ATOM 11498 C C . GLU C 1 19 ? -43.959 7.784 63.399 1.00 54.08 ? 19 GLU C C 1 +ATOM 11499 O O . GLU C 1 19 ? -43.359 7.067 62.597 1.00 54.97 ? 19 GLU C O 1 +ATOM 11500 C CB . GLU C 1 19 ? -45.386 8.598 61.492 1.00 57.83 ? 19 GLU C CB 1 +ATOM 11501 C CG . GLU C 1 19 ? -46.384 9.646 61.004 1.00 64.65 ? 19 GLU C CG 1 +ATOM 11502 C CD . GLU C 1 19 ? -46.597 9.624 59.504 1.00 68.11 ? 19 GLU C CD 1 +ATOM 11503 O OE1 . GLU C 1 19 ? -45.617 9.873 58.763 1.00 69.65 ? 19 GLU C OE1 1 +ATOM 11504 O OE2 . GLU C 1 19 ? -47.744 9.362 59.069 1.00 70.12 ? 19 GLU C OE2 1 +ATOM 11505 N N . PRO C 1 20 ? -43.803 7.654 64.724 1.00 53.48 ? 20 PRO C N 1 +ATOM 11506 C CA . PRO C 1 20 ? -42.914 6.688 65.375 1.00 52.05 ? 20 PRO C CA 1 +ATOM 11507 C C . PRO C 1 20 ? -43.206 5.218 65.104 1.00 50.80 ? 20 PRO C C 1 +ATOM 11508 O O . PRO C 1 20 ? -44.351 4.821 64.893 1.00 50.84 ? 20 PRO C O 1 +ATOM 11509 C CB . PRO C 1 20 ? -43.072 7.014 66.861 1.00 51.31 ? 20 PRO C CB 1 +ATOM 11510 C CG . PRO C 1 20 ? -43.506 8.441 66.867 1.00 53.17 ? 20 PRO C CG 1 +ATOM 11511 C CD . PRO C 1 20 ? -44.491 8.472 65.733 1.00 52.98 ? 20 PRO C CD 1 +ATOM 11512 N N . PHE C 1 21 ? -42.142 4.423 65.123 1.00 48.99 ? 21 PHE C N 1 +ATOM 11513 C CA . PHE C 1 21 ? -42.217 2.982 64.943 1.00 46.02 ? 21 PHE C CA 1 +ATOM 11514 C C . PHE C 1 21 ? -41.380 2.476 66.110 1.00 43.83 ? 21 PHE C C 1 +ATOM 11515 O O . PHE C 1 21 ? -40.204 2.165 65.953 1.00 43.54 ? 21 PHE C O 1 +ATOM 11516 C CB . PHE C 1 21 ? -41.581 2.570 63.617 1.00 45.26 ? 21 PHE C CB 1 +ATOM 11517 C CG . PHE C 1 21 ? -41.872 1.154 63.226 1.00 44.62 ? 21 PHE C CG 1 +ATOM 11518 C CD1 . PHE C 1 21 ? -43.140 0.790 62.789 1.00 43.95 ? 21 PHE C CD1 1 +ATOM 11519 C CD2 . PHE C 1 21 ? -40.890 0.177 63.325 1.00 44.10 ? 21 PHE C CD2 1 +ATOM 11520 C CE1 . PHE C 1 21 ? -43.429 -0.528 62.459 1.00 44.10 ? 21 PHE C CE1 1 +ATOM 11521 C CE2 . PHE C 1 21 ? -41.165 -1.146 62.998 1.00 45.58 ? 21 PHE C CE2 1 +ATOM 11522 C CZ . PHE C 1 21 ? -42.440 -1.501 62.563 1.00 45.42 ? 21 PHE C CZ 1 +ATOM 11523 N N . PRO C 1 22 ? -41.982 2.406 67.305 1.00 43.10 ? 22 PRO C N 1 +ATOM 11524 C CA . PRO C 1 22 ? -41.328 1.957 68.541 1.00 42.32 ? 22 PRO C CA 1 +ATOM 11525 C C . PRO C 1 22 ? -40.683 0.580 68.456 1.00 41.09 ? 22 PRO C C 1 +ATOM 11526 O O . PRO C 1 22 ? -41.156 -0.289 67.729 1.00 40.26 ? 22 PRO C O 1 +ATOM 11527 C CB . PRO C 1 22 ? -42.463 1.977 69.570 1.00 42.72 ? 22 PRO C CB 1 +ATOM 11528 C CG . PRO C 1 22 ? -43.478 2.891 68.980 1.00 44.34 ? 22 PRO C CG 1 +ATOM 11529 C CD . PRO C 1 22 ? -43.427 2.559 67.520 1.00 43.40 ? 22 PRO C CD 1 +ATOM 11530 N N . PRO C 1 23 ? -39.594 0.366 69.212 1.00 40.79 ? 23 PRO C N 1 +ATOM 11531 C CA . PRO C 1 23 ? -38.912 -0.931 69.205 1.00 41.29 ? 23 PRO C CA 1 +ATOM 11532 C C . PRO C 1 23 ? -39.863 -1.978 69.772 1.00 42.01 ? 23 PRO C C 1 +ATOM 11533 O O . PRO C 1 23 ? -39.772 -3.168 69.460 1.00 43.53 ? 23 PRO C O 1 +ATOM 11534 C CB . PRO C 1 23 ? -37.705 -0.684 70.103 1.00 41.47 ? 23 PRO C CB 1 +ATOM 11535 C CG . PRO C 1 23 ? -38.215 0.351 71.070 1.00 40.60 ? 23 PRO C CG 1 +ATOM 11536 C CD . PRO C 1 23 ? -38.953 1.292 70.162 1.00 39.83 ? 23 PRO C CD 1 +ATOM 11537 N N . ILE C 1 24 ? -40.777 -1.511 70.614 1.00 41.74 ? 24 ILE C N 1 +ATOM 11538 C CA . ILE C 1 24 ? -41.786 -2.361 71.219 1.00 42.78 ? 24 ILE C CA 1 +ATOM 11539 C C . ILE C 1 24 ? -42.951 -1.457 71.551 1.00 43.46 ? 24 ILE C C 1 +ATOM 11540 O O . ILE C 1 24 ? -42.757 -0.299 71.913 1.00 43.43 ? 24 ILE C O 1 +ATOM 11541 C CB . ILE C 1 24 ? -41.276 -3.057 72.509 1.00 43.43 ? 24 ILE C CB 1 +ATOM 11542 C CG1 . ILE C 1 24 ? -42.407 -3.891 73.118 1.00 42.79 ? 24 ILE C CG1 1 +ATOM 11543 C CG2 . ILE C 1 24 ? -40.758 -2.026 73.507 1.00 42.03 ? 24 ILE C CG2 1 +ATOM 11544 C CD1 . ILE C 1 24 ? -41.958 -4.823 74.222 1.00 43.56 ? 24 ILE C CD1 1 +ATOM 11545 N N . GLU C 1 25 ? -44.162 -1.972 71.408 1.00 45.36 ? 25 GLU C N 1 +ATOM 11546 C CA . GLU C 1 25 ? -45.338 -1.171 71.698 1.00 49.15 ? 25 GLU C CA 1 +ATOM 11547 C C . GLU C 1 25 ? -45.859 -1.407 73.105 1.00 49.76 ? 25 GLU C C 1 +ATOM 11548 O O . GLU C 1 25 ? -46.110 -2.541 73.511 1.00 49.21 ? 25 GLU C O 1 +ATOM 11549 C CB . GLU C 1 25 ? -46.443 -1.461 70.682 1.00 50.51 ? 25 GLU C CB 1 +ATOM 11550 C CG . GLU C 1 25 ? -46.082 -1.069 69.266 1.00 54.47 ? 25 GLU C CG 1 +ATOM 11551 C CD . GLU C 1 25 ? -47.196 -1.366 68.276 1.00 57.66 ? 25 GLU C CD 1 +ATOM 11552 O OE1 . GLU C 1 25 ? -47.584 -2.551 68.145 1.00 57.56 ? 25 GLU C OE1 1 +ATOM 11553 O OE2 . GLU C 1 25 ? -47.683 -0.409 67.630 1.00 59.76 ? 25 GLU C OE2 1 +ATOM 11554 N N . PHE C 1 26 ? -46.001 -0.319 73.849 1.00 51.31 ? 26 PHE C N 1 +ATOM 11555 C CA . PHE C 1 26 ? -46.514 -0.386 75.206 1.00 54.20 ? 26 PHE C CA 1 +ATOM 11556 C C . PHE C 1 26 ? -47.948 0.104 75.176 1.00 57.18 ? 26 PHE C C 1 +ATOM 11557 O O . PHE C 1 26 ? -48.216 1.268 74.888 1.00 56.84 ? 26 PHE C O 1 +ATOM 11558 C CB . PHE C 1 26 ? -45.668 0.480 76.135 1.00 50.95 ? 26 PHE C CB 1 +ATOM 11559 C CG . PHE C 1 26 ? -44.273 -0.028 76.313 1.00 49.69 ? 26 PHE C CG 1 +ATOM 11560 C CD1 . PHE C 1 26 ? -44.048 -1.284 76.864 1.00 48.16 ? 26 PHE C CD1 1 +ATOM 11561 C CD2 . PHE C 1 26 ? -43.180 0.736 75.910 1.00 48.42 ? 26 PHE C CD2 1 +ATOM 11562 C CE1 . PHE C 1 26 ? -42.756 -1.773 77.011 1.00 49.06 ? 26 PHE C CE1 1 +ATOM 11563 C CE2 . PHE C 1 26 ? -41.887 0.258 76.052 1.00 48.14 ? 26 PHE C CE2 1 +ATOM 11564 C CZ . PHE C 1 26 ? -41.670 -1.000 76.603 1.00 48.45 ? 26 PHE C CZ 1 +ATOM 11565 N N . PRO C 1 27 ? -48.894 -0.787 75.472 1.00 61.45 ? 27 PRO C N 1 +ATOM 11566 C CA . PRO C 1 27 ? -50.301 -0.386 75.454 1.00 64.76 ? 27 PRO C CA 1 +ATOM 11567 C C . PRO C 1 27 ? -50.560 0.739 76.443 1.00 67.36 ? 27 PRO C C 1 +ATOM 11568 O O . PRO C 1 27 ? -50.066 0.705 77.578 1.00 67.53 ? 27 PRO C O 1 +ATOM 11569 C CB . PRO C 1 27 ? -51.019 -1.668 75.852 1.00 64.00 ? 27 PRO C CB 1 +ATOM 11570 C CG . PRO C 1 27 ? -50.070 -2.246 76.876 1.00 63.40 ? 27 PRO C CG 1 +ATOM 11571 C CD . PRO C 1 27 ? -48.725 -2.070 76.181 1.00 63.61 ? 27 PRO C CD 1 +ATOM 11572 N N . LEU C 1 28 ? -51.300 1.748 76.002 1.00 69.85 ? 28 LEU C N 1 +ATOM 11573 C CA . LEU C 1 28 ? -51.655 2.845 76.885 1.00 73.56 ? 28 LEU C CA 1 +ATOM 11574 C C . LEU C 1 28 ? -53.178 2.831 76.922 1.00 76.47 ? 28 LEU C C 1 +ATOM 11575 O O . LEU C 1 28 ? -53.841 3.843 76.681 1.00 77.28 ? 28 LEU C O 1 +ATOM 11576 C CB . LEU C 1 28 ? -51.126 4.186 76.367 1.00 72.79 ? 28 LEU C CB 1 +ATOM 11577 C CG . LEU C 1 28 ? -51.090 5.281 77.446 1.00 72.46 ? 28 LEU C CG 1 +ATOM 11578 C CD1 . LEU C 1 28 ? -50.334 4.773 78.669 1.00 72.47 ? 28 LEU C CD1 1 +ATOM 11579 C CD2 . LEU C 1 28 ? -50.427 6.542 76.903 1.00 72.21 ? 28 LEU C CD2 1 +ATOM 11580 N N . GLU C 1 29 ? -53.700 1.637 77.202 1.00 78.89 ? 29 GLU C N 1 +ATOM 11581 C CA . GLU C 1 29 ? -55.128 1.343 77.316 1.00 81.38 ? 29 GLU C CA 1 +ATOM 11582 C C . GLU C 1 29 ? -56.096 2.405 76.792 1.00 81.21 ? 29 GLU C C 1 +ATOM 11583 O O . GLU C 1 29 ? -56.401 2.456 75.598 1.00 81.00 ? 29 GLU C O 1 +ATOM 11584 C CB . GLU C 1 29 ? -55.472 1.035 78.784 1.00 83.69 ? 29 GLU C CB 1 +ATOM 11585 C CG . GLU C 1 29 ? -54.629 -0.074 79.429 1.00 87.11 ? 29 GLU C CG 1 +ATOM 11586 C CD . GLU C 1 29 ? -54.798 -1.439 78.757 1.00 89.06 ? 29 GLU C CD 1 +ATOM 11587 O OE1 . GLU C 1 29 ? -54.429 -1.577 77.566 1.00 88.95 ? 29 GLU C OE1 1 +ATOM 11588 O OE2 . GLU C 1 29 ? -55.299 -2.374 79.426 1.00 89.35 ? 29 GLU C OE2 1 +ATOM 11589 N N . GLN C 1 30 ? -56.584 3.244 77.699 1.00 80.56 ? 30 GLN C N 1 +ATOM 11590 C CA . GLN C 1 30 ? -57.538 4.280 77.343 1.00 80.03 ? 30 GLN C CA 1 +ATOM 11591 C C . GLN C 1 30 ? -56.920 5.645 77.067 1.00 79.15 ? 30 GLN C C 1 +ATOM 11592 O O . GLN C 1 30 ? -56.969 6.542 77.908 1.00 79.21 ? 30 GLN C O 1 +ATOM 11593 C CB . GLN C 1 30 ? -58.618 4.391 78.436 1.00 81.00 ? 30 GLN C CB 1 +ATOM 11594 C CG . GLN C 1 30 ? -58.124 4.183 79.875 1.00 81.99 ? 30 GLN C CG 1 +ATOM 11595 C CD . GLN C 1 30 ? -58.736 2.950 80.545 1.00 82.58 ? 30 GLN C CD 1 +ATOM 11596 O OE1 . GLN C 1 30 ? -59.957 2.837 80.683 1.00 82.41 ? 30 GLN C OE1 1 +ATOM 11597 N NE2 . GLN C 1 30 ? -57.882 2.023 80.967 1.00 82.63 ? 30 GLN C NE2 1 +ATOM 11598 N N . LYS C 1 31 ? -56.345 5.794 75.876 1.00 78.48 ? 31 LYS C N 1 +ATOM 11599 C CA . LYS C 1 31 ? -55.733 7.057 75.467 1.00 77.18 ? 31 LYS C CA 1 +ATOM 11600 C C . LYS C 1 31 ? -56.780 8.167 75.454 1.00 75.53 ? 31 LYS C C 1 +ATOM 11601 O O . LYS C 1 31 ? -57.977 7.912 75.351 1.00 75.13 ? 31 LYS C O 1 +ATOM 11602 C CB . LYS C 1 31 ? -55.129 6.945 74.058 1.00 77.97 ? 31 LYS C CB 1 +ATOM 11603 C CG . LYS C 1 31 ? -53.752 6.292 73.965 1.00 78.99 ? 31 LYS C CG 1 +ATOM 11604 C CD . LYS C 1 31 ? -53.209 6.390 72.536 1.00 78.65 ? 31 LYS C CD 1 +ATOM 11605 C CE . LYS C 1 31 ? -51.816 5.783 72.404 1.00 80.12 ? 31 LYS C CE 1 +ATOM 11606 N NZ . LYS C 1 31 ? -51.770 4.332 72.776 1.00 80.86 ? 31 LYS C NZ 1 +ATOM 11607 N N . ILE C 1 32 ? -56.312 9.402 75.550 1.00 73.77 ? 32 ILE C N 1 +ATOM 11608 C CA . ILE C 1 32 ? -57.185 10.565 75.537 1.00 71.78 ? 32 ILE C CA 1 +ATOM 11609 C C . ILE C 1 32 ? -56.329 11.698 75.009 1.00 70.48 ? 32 ILE C C 1 +ATOM 11610 O O . ILE C 1 32 ? -55.210 11.884 75.473 1.00 70.85 ? 32 ILE C O 1 +ATOM 11611 C CB . ILE C 1 32 ? -57.634 10.957 76.960 1.00 72.36 ? 32 ILE C CB 1 +ATOM 11612 C CG1 . ILE C 1 32 ? -58.260 9.757 77.680 1.00 73.22 ? 32 ILE C CG1 1 +ATOM 11613 C CG2 . ILE C 1 32 ? -58.608 12.116 76.887 1.00 71.11 ? 32 ILE C CG2 1 +ATOM 11614 C CD1 . ILE C 1 32 ? -58.448 9.962 79.193 1.00 71.87 ? 32 ILE C CD1 1 +ATOM 11615 N N . SER C 1 33 ? -56.823 12.445 74.033 1.00 68.97 ? 33 SER C N 1 +ATOM 11616 C CA . SER C 1 33 ? -56.041 13.564 73.532 1.00 68.51 ? 33 SER C CA 1 +ATOM 11617 C C . SER C 1 33 ? -56.071 14.605 74.642 1.00 68.19 ? 33 SER C C 1 +ATOM 11618 O O . SER C 1 33 ? -57.144 15.005 75.085 1.00 68.12 ? 33 SER C O 1 +ATOM 11619 C CB . SER C 1 33 ? -56.666 14.137 72.262 1.00 68.40 ? 33 SER C CB 1 +ATOM 11620 O OG . SER C 1 33 ? -56.721 13.153 71.245 1.00 69.02 ? 33 SER C OG 1 +ATOM 11621 N N . SER C 1 34 ? -54.902 15.025 75.114 1.00 68.25 ? 34 SER C N 1 +ATOM 11622 C CA . SER C 1 34 ? -54.852 16.016 76.181 1.00 68.51 ? 34 SER C CA 1 +ATOM 11623 C C . SER C 1 34 ? -54.745 17.398 75.573 1.00 69.00 ? 34 SER C C 1 +ATOM 11624 O O . SER C 1 34 ? -54.334 17.559 74.421 1.00 69.11 ? 34 SER C O 1 +ATOM 11625 C CB . SER C 1 34 ? -53.654 15.785 77.099 1.00 68.09 ? 34 SER C CB 1 +ATOM 11626 O OG . SER C 1 34 ? -52.463 16.241 76.487 1.00 67.20 ? 34 SER C OG 1 +ATOM 11627 N N . ASN C 1 35 ? -55.103 18.400 76.359 1.00 69.31 ? 35 ASN C N 1 +ATOM 11628 C CA . ASN C 1 35 ? -55.059 19.768 75.886 1.00 69.88 ? 35 ASN C CA 1 +ATOM 11629 C C . ASN C 1 35 ? -53.797 20.468 76.386 1.00 68.73 ? 35 ASN C C 1 +ATOM 11630 O O . ASN C 1 35 ? -53.619 21.675 76.187 1.00 67.79 ? 35 ASN C O 1 +ATOM 11631 C CB . ASN C 1 35 ? -56.329 20.489 76.337 1.00 72.22 ? 35 ASN C CB 1 +ATOM 11632 C CG . ASN C 1 35 ? -57.593 19.696 75.998 1.00 74.71 ? 35 ASN C CG 1 +ATOM 11633 O OD1 . ASN C 1 35 ? -57.912 19.480 74.824 1.00 75.86 ? 35 ASN C OD1 1 +ATOM 11634 N ND2 . ASN C 1 35 ? -58.305 19.243 77.029 1.00 75.20 ? 35 ASN C ND2 1 +ATOM 11635 N N . LYS C 1 36 ? -52.920 19.697 77.029 1.00 67.38 ? 36 LYS C N 1 +ATOM 11636 C CA . LYS C 1 36 ? -51.656 20.232 77.528 1.00 65.04 ? 36 LYS C CA 1 +ATOM 11637 C C . LYS C 1 36 ? -50.681 20.366 76.368 1.00 63.59 ? 36 LYS C C 1 +ATOM 11638 O O . LYS C 1 36 ? -50.664 19.534 75.462 1.00 63.53 ? 36 LYS C O 1 +ATOM 11639 C CB . LYS C 1 36 ? -51.052 19.320 78.595 1.00 63.99 ? 36 LYS C CB 1 +ATOM 11640 C CG . LYS C 1 36 ? -51.108 19.913 79.991 1.00 65.89 ? 36 LYS C CG 1 +ATOM 11641 C CD . LYS C 1 36 ? -50.195 19.172 80.960 1.00 66.97 ? 36 LYS C CD 1 +ATOM 11642 C CE . LYS C 1 36 ? -50.212 19.809 82.345 1.00 66.68 ? 36 LYS C CE 1 +ATOM 11643 N NZ . LYS C 1 36 ? -51.549 19.714 83.004 1.00 67.08 ? 36 LYS C NZ 1 +ATOM 11644 N N . SER C 1 37 ? -49.878 21.423 76.392 1.00 61.71 ? 37 SER C N 1 +ATOM 11645 C CA . SER C 1 37 ? -48.900 21.657 75.337 1.00 59.84 ? 37 SER C CA 1 +ATOM 11646 C C . SER C 1 37 ? -47.482 21.378 75.839 1.00 57.63 ? 37 SER C C 1 +ATOM 11647 O O . SER C 1 37 ? -47.292 20.972 76.979 1.00 56.04 ? 37 SER C O 1 +ATOM 11648 C CB . SER C 1 37 ? -48.991 23.108 74.857 1.00 59.85 ? 37 SER C CB 1 +ATOM 11649 O OG . SER C 1 37 ? -48.613 24.000 75.892 1.00 60.54 ? 37 SER C OG 1 +ATOM 11650 N N . LEU C 1 38 ? -46.497 21.596 74.971 1.00 56.97 ? 38 LEU C N 1 +ATOM 11651 C CA . LEU C 1 38 ? -45.098 21.395 75.316 1.00 56.09 ? 38 LEU C CA 1 +ATOM 11652 C C . LEU C 1 38 ? -44.693 22.430 76.357 1.00 56.83 ? 38 LEU C C 1 +ATOM 11653 O O . LEU C 1 38 ? -43.997 22.107 77.324 1.00 55.62 ? 38 LEU C O 1 +ATOM 11654 C CB . LEU C 1 38 ? -44.224 21.536 74.068 1.00 55.68 ? 38 LEU C CB 1 +ATOM 11655 C CG . LEU C 1 38 ? -43.730 20.254 73.386 1.00 55.41 ? 38 LEU C CG 1 +ATOM 11656 C CD1 . LEU C 1 38 ? -44.813 19.197 73.396 1.00 53.85 ? 38 LEU C CD1 1 +ATOM 11657 C CD2 . LEU C 1 38 ? -43.288 20.581 71.963 1.00 53.38 ? 38 LEU C CD2 1 +ATOM 11658 N N . SER C 1 39 ? -45.139 23.670 76.154 1.00 57.26 ? 39 SER C N 1 +ATOM 11659 C CA . SER C 1 39 ? -44.847 24.767 77.077 1.00 57.66 ? 39 SER C CA 1 +ATOM 11660 C C . SER C 1 39 ? -45.285 24.398 78.478 1.00 58.03 ? 39 SER C C 1 +ATOM 11661 O O . SER C 1 39 ? -44.518 24.509 79.428 1.00 58.76 ? 39 SER C O 1 +ATOM 11662 C CB . SER C 1 39 ? -45.595 26.028 76.669 1.00 58.15 ? 39 SER C CB 1 +ATOM 11663 O OG . SER C 1 39 ? -45.245 26.423 75.361 1.00 61.76 ? 39 SER C OG 1 +ATOM 11664 N N . GLU C 1 40 ? -46.536 23.966 78.597 1.00 58.82 ? 40 GLU C N 1 +ATOM 11665 C CA . GLU C 1 40 ? -47.096 23.580 79.887 1.00 58.93 ? 40 GLU C CA 1 +ATOM 11666 C C . GLU C 1 40 ? -46.335 22.386 80.449 1.00 57.05 ? 40 GLU C C 1 +ATOM 11667 O O . GLU C 1 40 ? -46.343 22.140 81.656 1.00 57.70 ? 40 GLU C O 1 +ATOM 11668 C CB . GLU C 1 40 ? -48.577 23.223 79.734 1.00 60.76 ? 40 GLU C CB 1 +ATOM 11669 C CG . GLU C 1 40 ? -49.360 24.241 78.928 1.00 65.96 ? 40 GLU C CG 1 +ATOM 11670 C CD . GLU C 1 40 ? -50.850 23.937 78.867 1.00 68.94 ? 40 GLU C CD 1 +ATOM 11671 O OE1 . GLU C 1 40 ? -51.227 22.816 78.457 1.00 69.97 ? 40 GLU C OE1 1 +ATOM 11672 O OE2 . GLU C 1 40 ? -51.646 24.832 79.225 1.00 70.92 ? 40 GLU C OE2 1 +ATOM 11673 N N . LEU C 1 41 ? -45.674 21.648 79.567 1.00 53.90 ? 41 LEU C N 1 +ATOM 11674 C CA . LEU C 1 41 ? -44.917 20.479 79.979 1.00 51.12 ? 41 LEU C CA 1 +ATOM 11675 C C . LEU C 1 41 ? -43.445 20.848 80.190 1.00 49.66 ? 41 LEU C C 1 +ATOM 11676 O O . LEU C 1 41 ? -42.658 20.041 80.686 1.00 48.63 ? 41 LEU C O 1 +ATOM 11677 C CB . LEU C 1 41 ? -45.063 19.387 78.917 1.00 49.93 ? 41 LEU C CB 1 +ATOM 11678 C CG . LEU C 1 41 ? -45.665 18.039 79.321 1.00 50.23 ? 41 LEU C CG 1 +ATOM 11679 C CD1 . LEU C 1 41 ? -46.748 18.203 80.371 1.00 49.28 ? 41 LEU C CD1 1 +ATOM 11680 C CD2 . LEU C 1 41 ? -46.220 17.377 78.076 1.00 49.81 ? 41 LEU C CD2 1 +ATOM 11681 N N . GLY C 1 42 ? -43.088 22.074 79.816 1.00 47.92 ? 42 GLY C N 1 +ATOM 11682 C CA . GLY C 1 42 ? -41.722 22.546 79.972 1.00 47.84 ? 42 GLY C CA 1 +ATOM 11683 C C . GLY C 1 42 ? -40.723 21.924 79.010 1.00 47.45 ? 42 GLY C C 1 +ATOM 11684 O O . GLY C 1 42 ? -39.532 21.810 79.317 1.00 46.29 ? 42 GLY C O 1 +ATOM 11685 N N . LEU C 1 43 ? -41.206 21.537 77.835 1.00 46.92 ? 43 LEU C N 1 +ATOM 11686 C CA . LEU C 1 43 ? -40.357 20.906 76.840 1.00 46.94 ? 43 LEU C CA 1 +ATOM 11687 C C . LEU C 1 43 ? -40.277 21.688 75.536 1.00 46.40 ? 43 LEU C C 1 +ATOM 11688 O O . LEU C 1 43 ? -41.201 22.404 75.164 1.00 45.23 ? 43 LEU C O 1 +ATOM 11689 C CB . LEU C 1 43 ? -40.868 19.492 76.541 1.00 46.26 ? 43 LEU C CB 1 +ATOM 11690 C CG . LEU C 1 43 ? -40.979 18.536 77.724 1.00 46.74 ? 43 LEU C CG 1 +ATOM 11691 C CD1 . LEU C 1 43 ? -41.569 17.221 77.251 1.00 47.13 ? 43 LEU C CD1 1 +ATOM 11692 C CD2 . LEU C 1 43 ? -39.603 18.324 78.341 1.00 46.85 ? 43 LEU C CD2 1 +ATOM 11693 N N . THR C 1 44 ? -39.153 21.527 74.856 1.00 46.30 ? 44 THR C N 1 +ATOM 11694 C CA . THR C 1 44 ? -38.901 22.157 73.576 1.00 47.74 ? 44 THR C CA 1 +ATOM 11695 C C . THR C 1 44 ? -38.524 20.997 72.676 1.00 48.53 ? 44 THR C C 1 +ATOM 11696 O O . THR C 1 44 ? -37.782 20.108 73.091 1.00 49.04 ? 44 THR C O 1 +ATOM 11697 C CB . THR C 1 44 ? -37.715 23.138 73.655 1.00 49.82 ? 44 THR C CB 1 +ATOM 11698 O OG1 . THR C 1 44 ? -38.084 24.270 74.451 1.00 52.15 ? 44 THR C OG1 1 +ATOM 11699 C CG2 . THR C 1 44 ? -37.307 23.608 72.268 1.00 49.67 ? 44 THR C CG2 1 +ATOM 11700 N N . ILE C 1 45 ? -39.035 20.991 71.455 1.00 48.61 ? 45 ILE C N 1 +ATOM 11701 C CA . ILE C 1 45 ? -38.730 19.905 70.548 1.00 50.38 ? 45 ILE C CA 1 +ATOM 11702 C C . ILE C 1 45 ? -38.302 20.403 69.180 1.00 52.03 ? 45 ILE C C 1 +ATOM 11703 O O . ILE C 1 45 ? -38.854 21.361 68.653 1.00 52.86 ? 45 ILE C O 1 +ATOM 11704 C CB . ILE C 1 45 ? -39.933 18.968 70.419 1.00 50.77 ? 45 ILE C CB 1 +ATOM 11705 C CG1 . ILE C 1 45 ? -40.239 18.359 71.791 1.00 51.26 ? 45 ILE C CG1 1 +ATOM 11706 C CG2 . ILE C 1 45 ? -39.650 17.879 69.397 1.00 50.65 ? 45 ILE C CG2 1 +ATOM 11707 C CD1 . ILE C 1 45 ? -41.415 17.411 71.800 1.00 51.42 ? 45 ILE C CD1 1 +ATOM 11708 N N . VAL C 1 46 ? -37.295 19.748 68.619 1.00 54.26 ? 46 VAL C N 1 +ATOM 11709 C CA . VAL C 1 46 ? -36.764 20.108 67.316 1.00 55.77 ? 46 VAL C CA 1 +ATOM 11710 C C . VAL C 1 46 ? -36.554 18.864 66.460 1.00 57.96 ? 46 VAL C C 1 +ATOM 11711 O O . VAL C 1 46 ? -36.071 17.842 66.942 1.00 58.53 ? 46 VAL C O 1 +ATOM 11712 C CB . VAL C 1 46 ? -35.412 20.840 67.458 1.00 55.47 ? 46 VAL C CB 1 +ATOM 11713 C CG1 . VAL C 1 46 ? -34.808 21.094 66.091 1.00 55.55 ? 46 VAL C CG1 1 +ATOM 11714 C CG2 . VAL C 1 46 ? -35.606 22.148 68.207 1.00 54.79 ? 46 VAL C CG2 1 +ATOM 11715 N N . GLN C 1 47 ? -36.939 18.956 65.192 1.00 60.41 ? 47 GLN C N 1 +ATOM 11716 C CA . GLN C 1 47 ? -36.770 17.861 64.249 1.00 62.62 ? 47 GLN C CA 1 +ATOM 11717 C C . GLN C 1 47 ? -35.803 18.313 63.167 1.00 64.27 ? 47 GLN C C 1 +ATOM 11718 O O . GLN C 1 47 ? -36.043 19.309 62.495 1.00 64.13 ? 47 GLN C O 1 +ATOM 11719 C CB . GLN C 1 47 ? -38.102 17.482 63.616 1.00 62.88 ? 47 GLN C CB 1 +ATOM 11720 C CG . GLN C 1 47 ? -38.947 16.565 64.461 1.00 63.95 ? 47 GLN C CG 1 +ATOM 11721 C CD . GLN C 1 47 ? -40.237 16.178 63.768 1.00 66.06 ? 47 GLN C CD 1 +ATOM 11722 O OE1 . GLN C 1 47 ? -41.154 16.991 63.647 1.00 67.17 ? 47 GLN C OE1 1 +ATOM 11723 N NE2 . GLN C 1 47 ? -40.312 14.933 63.297 1.00 66.31 ? 47 GLN C NE2 1 +ATOM 11724 N N . GLN C 1 48 ? -34.704 17.584 63.010 1.00 66.78 ? 48 GLN C N 1 +ATOM 11725 C CA . GLN C 1 48 ? -33.703 17.919 62.009 1.00 68.47 ? 48 GLN C CA 1 +ATOM 11726 C C . GLN C 1 48 ? -33.347 16.741 61.110 1.00 68.83 ? 48 GLN C C 1 +ATOM 11727 O O . GLN C 1 48 ? -34.196 15.903 60.788 1.00 69.33 ? 48 GLN C O 1 +ATOM 11728 C CB . GLN C 1 48 ? -32.439 18.437 62.692 1.00 70.38 ? 48 GLN C CB 1 +ATOM 11729 C CG . GLN C 1 48 ? -32.629 19.756 63.405 1.00 72.70 ? 48 GLN C CG 1 +ATOM 11730 C CD . GLN C 1 48 ? -31.372 20.215 64.118 1.00 74.80 ? 48 GLN C CD 1 +ATOM 11731 O OE1 . GLN C 1 48 ? -31.343 21.293 64.716 1.00 76.09 ? 48 GLN C OE1 1 +ATOM 11732 N NE2 . GLN C 1 48 ? -30.321 19.395 64.061 1.00 74.78 ? 48 GLN C NE2 1 +ATOM 11733 N N . GLY C 1 49 ? -32.082 16.691 60.706 1.00 68.62 ? 49 GLY C N 1 +ATOM 11734 C CA . GLY C 1 49 ? -31.620 15.626 59.840 1.00 67.97 ? 49 GLY C CA 1 +ATOM 11735 C C . GLY C 1 49 ? -31.814 14.258 60.453 1.00 67.35 ? 49 GLY C C 1 +ATOM 11736 O O . GLY C 1 49 ? -30.874 13.692 61.012 1.00 68.83 ? 49 GLY C O 1 +ATOM 11737 N N . ASN C 1 50 ? -33.030 13.728 60.351 1.00 65.68 ? 50 ASN C N 1 +ATOM 11738 C CA . ASN C 1 50 ? -33.343 12.414 60.897 1.00 64.02 ? 50 ASN C CA 1 +ATOM 11739 C C . ASN C 1 50 ? -33.057 12.309 62.391 1.00 61.25 ? 50 ASN C C 1 +ATOM 11740 O O . ASN C 1 50 ? -32.687 11.240 62.882 1.00 60.49 ? 50 ASN C O 1 +ATOM 11741 C CB . ASN C 1 50 ? -32.555 11.329 60.158 1.00 67.16 ? 50 ASN C CB 1 +ATOM 11742 C CG . ASN C 1 50 ? -33.097 11.059 58.767 1.00 69.78 ? 50 ASN C CG 1 +ATOM 11743 O OD1 . ASN C 1 50 ? -34.227 10.586 58.609 1.00 71.28 ? 50 ASN C OD1 1 +ATOM 11744 N ND2 . ASN C 1 50 ? -32.295 11.363 57.749 1.00 70.80 ? 50 ASN C ND2 1 +ATOM 11745 N N . LYS C 1 51 ? -33.220 13.416 63.109 1.00 57.53 ? 51 LYS C N 1 +ATOM 11746 C CA . LYS C 1 51 ? -32.997 13.420 64.547 1.00 53.13 ? 51 LYS C CA 1 +ATOM 11747 C C . LYS C 1 51 ? -34.051 14.245 65.258 1.00 49.48 ? 51 LYS C C 1 +ATOM 11748 O O . LYS C 1 51 ? -34.602 15.178 64.691 1.00 48.24 ? 51 LYS C O 1 +ATOM 11749 C CB . LYS C 1 51 ? -31.610 13.969 64.883 1.00 54.14 ? 51 LYS C CB 1 +ATOM 11750 C CG . LYS C 1 51 ? -30.466 13.115 64.354 1.00 57.80 ? 51 LYS C CG 1 +ATOM 11751 C CD . LYS C 1 51 ? -29.107 13.521 64.929 1.00 59.72 ? 51 LYS C CD 1 +ATOM 11752 C CE . LYS C 1 51 ? -28.697 14.928 64.513 1.00 61.88 ? 51 LYS C CE 1 +ATOM 11753 N NZ . LYS C 1 51 ? -29.592 15.980 65.075 1.00 63.33 ? 51 LYS C NZ 1 +ATOM 11754 N N . VAL C 1 52 ? -34.341 13.876 66.499 1.00 46.45 ? 52 VAL C N 1 +ATOM 11755 C CA . VAL C 1 52 ? -35.303 14.602 67.312 1.00 43.38 ? 52 VAL C CA 1 +ATOM 11756 C C . VAL C 1 52 ? -34.579 15.037 68.575 1.00 42.02 ? 52 VAL C C 1 +ATOM 11757 O O . VAL C 1 52 ? -33.997 14.214 69.269 1.00 42.51 ? 52 VAL C O 1 +ATOM 11758 C CB . VAL C 1 52 ? -36.516 13.726 67.694 1.00 42.87 ? 52 VAL C CB 1 +ATOM 11759 C CG1 . VAL C 1 52 ? -37.423 14.479 68.648 1.00 40.46 ? 52 VAL C CG1 1 +ATOM 11760 C CG2 . VAL C 1 52 ? -37.290 13.342 66.446 1.00 41.46 ? 52 VAL C CG2 1 +ATOM 11761 N N . ILE C 1 53 ? -34.597 16.336 68.857 1.00 41.21 ? 53 ILE C N 1 +ATOM 11762 C CA . ILE C 1 53 ? -33.943 16.867 70.040 1.00 39.68 ? 53 ILE C CA 1 +ATOM 11763 C C . ILE C 1 53 ? -35.003 17.384 70.998 1.00 40.18 ? 53 ILE C C 1 +ATOM 11764 O O . ILE C 1 53 ? -35.816 18.222 70.625 1.00 39.65 ? 53 ILE C O 1 +ATOM 11765 C CB . ILE C 1 53 ? -33.002 18.009 69.666 1.00 39.62 ? 53 ILE C CB 1 +ATOM 11766 C CG1 . ILE C 1 53 ? -32.002 17.517 68.615 1.00 39.70 ? 53 ILE C CG1 1 +ATOM 11767 C CG2 . ILE C 1 53 ? -32.276 18.515 70.903 1.00 38.22 ? 53 ILE C CG2 1 +ATOM 11768 C CD1 . ILE C 1 53 ? -31.093 18.600 68.079 1.00 39.23 ? 53 ILE C CD1 1 +ATOM 11769 N N . VAL C 1 54 ? -35.000 16.868 72.224 1.00 39.27 ? 54 VAL C N 1 +ATOM 11770 C CA . VAL C 1 54 ? -35.959 17.288 73.237 1.00 39.53 ? 54 VAL C CA 1 +ATOM 11771 C C . VAL C 1 54 ? -35.217 17.988 74.378 1.00 40.22 ? 54 VAL C C 1 +ATOM 11772 O O . VAL C 1 54 ? -34.323 17.410 74.997 1.00 41.07 ? 54 VAL C O 1 +ATOM 11773 C CB . VAL C 1 54 ? -36.734 16.078 73.791 1.00 39.03 ? 54 VAL C CB 1 +ATOM 11774 C CG1 . VAL C 1 54 ? -37.705 16.530 74.864 1.00 38.03 ? 54 VAL C CG1 1 +ATOM 11775 C CG2 . VAL C 1 54 ? -37.473 15.385 72.668 1.00 36.75 ? 54 VAL C CG2 1 +ATOM 11776 N N . GLU C 1 55 ? -35.592 19.233 74.649 1.00 40.74 ? 55 GLU C N 1 +ATOM 11777 C CA . GLU C 1 55 ? -34.948 20.023 75.693 1.00 42.27 ? 55 GLU C CA 1 +ATOM 11778 C C . GLU C 1 55 ? -35.842 20.327 76.877 1.00 41.55 ? 55 GLU C C 1 +ATOM 11779 O O . GLU C 1 55 ? -37.054 20.472 76.742 1.00 42.11 ? 55 GLU C O 1 +ATOM 11780 C CB . GLU C 1 55 ? -34.439 21.342 75.125 1.00 44.74 ? 55 GLU C CB 1 +ATOM 11781 C CG . GLU C 1 55 ? -33.172 21.229 74.309 1.00 51.90 ? 55 GLU C CG 1 +ATOM 11782 C CD . GLU C 1 55 ? -32.730 22.567 73.717 1.00 56.80 ? 55 GLU C CD 1 +ATOM 11783 O OE1 . GLU C 1 55 ? -32.848 23.608 74.419 1.00 59.51 ? 55 GLU C OE1 1 +ATOM 11784 O OE2 . GLU C 1 55 ? -32.256 22.572 72.555 1.00 57.58 ? 55 GLU C OE2 1 +ATOM 11785 N N . LYS C 1 56 ? -35.214 20.430 78.040 1.00 40.64 ? 56 LYS C N 1 +ATOM 11786 C CA . LYS C 1 56 ? -35.888 20.727 79.291 1.00 40.41 ? 56 LYS C CA 1 +ATOM 11787 C C . LYS C 1 56 ? -34.887 21.575 80.057 1.00 41.13 ? 56 LYS C C 1 +ATOM 11788 O O . LYS C 1 56 ? -33.674 21.404 79.905 1.00 42.42 ? 56 LYS C O 1 +ATOM 11789 C CB . LYS C 1 56 ? -36.156 19.434 80.061 1.00 41.34 ? 56 LYS C CB 1 +ATOM 11790 C CG . LYS C 1 56 ? -37.176 19.567 81.161 1.00 42.82 ? 56 LYS C CG 1 +ATOM 11791 C CD . LYS C 1 56 ? -37.261 18.299 81.993 1.00 43.01 ? 56 LYS C CD 1 +ATOM 11792 C CE . LYS C 1 56 ? -36.264 18.332 83.138 1.00 44.17 ? 56 LYS C CE 1 +ATOM 11793 N NZ . LYS C 1 56 ? -36.548 19.494 84.043 1.00 43.59 ? 56 LYS C NZ 1 +ATOM 11794 N N . SER C 1 57 ? -35.370 22.500 80.870 1.00 41.94 ? 57 SER C N 1 +ATOM 11795 C CA . SER C 1 57 ? -34.449 23.329 81.632 1.00 43.05 ? 57 SER C CA 1 +ATOM 11796 C C . SER C 1 57 ? -33.957 22.497 82.812 1.00 42.68 ? 57 SER C C 1 +ATOM 11797 O O . SER C 1 57 ? -34.562 21.484 83.166 1.00 41.95 ? 57 SER C O 1 +ATOM 11798 C CB . SER C 1 57 ? -35.146 24.589 82.145 1.00 43.52 ? 57 SER C CB 1 +ATOM 11799 O OG . SER C 1 57 ? -36.059 24.258 83.175 1.00 48.36 ? 57 SER C OG 1 +ATOM 11800 N N . LEU C 1 58 ? -32.859 22.932 83.413 1.00 42.02 ? 58 LEU C N 1 +ATOM 11801 C CA . LEU C 1 58 ? -32.280 22.237 84.548 1.00 43.14 ? 58 LEU C CA 1 +ATOM 11802 C C . LEU C 1 58 ? -31.848 23.283 85.569 1.00 44.97 ? 58 LEU C C 1 +ATOM 11803 O O . LEU C 1 58 ? -30.967 24.097 85.294 1.00 46.11 ? 58 LEU C O 1 +ATOM 11804 C CB . LEU C 1 58 ? -31.065 21.424 84.093 1.00 41.37 ? 58 LEU C CB 1 +ATOM 11805 C CG . LEU C 1 58 ? -30.347 20.590 85.147 1.00 39.19 ? 58 LEU C CG 1 +ATOM 11806 C CD1 . LEU C 1 58 ? -31.211 19.403 85.546 1.00 37.44 ? 58 LEU C CD1 1 +ATOM 11807 C CD2 . LEU C 1 58 ? -29.020 20.120 84.575 1.00 40.54 ? 58 LEU C CD2 1 +ATOM 11808 N N . ASP C 1 59 ? -32.472 23.265 86.740 1.00 47.01 ? 59 ASP C N 1 +ATOM 11809 C CA . ASP C 1 59 ? -32.138 24.219 87.791 1.00 48.98 ? 59 ASP C CA 1 +ATOM 11810 C C . ASP C 1 59 ? -30.955 23.741 88.627 1.00 48.46 ? 59 ASP C C 1 +ATOM 11811 O O . ASP C 1 59 ? -30.657 22.545 88.662 1.00 48.66 ? 59 ASP C O 1 +ATOM 11812 C CB . ASP C 1 59 ? -33.349 24.451 88.694 1.00 52.38 ? 59 ASP C CB 1 +ATOM 11813 C CG . ASP C 1 59 ? -34.549 24.974 87.928 1.00 58.69 ? 59 ASP C CG 1 +ATOM 11814 O OD1 . ASP C 1 59 ? -34.372 25.888 87.084 1.00 61.05 ? 59 ASP C OD1 1 +ATOM 11815 O OD2 . ASP C 1 59 ? -35.676 24.481 88.174 1.00 62.68 ? 59 ASP C OD2 1 +ATOM 11816 N N . LEU C 1 60 ? -30.295 24.677 89.304 1.00 47.78 ? 60 LEU C N 1 +ATOM 11817 C CA . LEU C 1 60 ? -29.137 24.360 90.137 1.00 47.80 ? 60 LEU C CA 1 +ATOM 11818 C C . LEU C 1 60 ? -29.402 23.276 91.166 1.00 47.48 ? 60 LEU C C 1 +ATOM 11819 O O . LEU C 1 60 ? -28.577 22.392 91.367 1.00 47.29 ? 60 LEU C O 1 +ATOM 11820 C CB . LEU C 1 60 ? -28.644 25.607 90.866 1.00 47.77 ? 60 LEU C CB 1 +ATOM 11821 C CG . LEU C 1 60 ? -27.885 26.650 90.050 1.00 49.05 ? 60 LEU C CG 1 +ATOM 11822 C CD1 . LEU C 1 60 ? -27.489 27.800 90.955 1.00 50.57 ? 60 LEU C CD1 1 +ATOM 11823 C CD2 . LEU C 1 60 ? -26.645 26.018 89.429 1.00 50.17 ? 60 LEU C CD2 1 +ATOM 11824 N N . LYS C 1 61 ? -30.556 23.348 91.817 1.00 48.38 ? 61 LYS C N 1 +ATOM 11825 C CA . LYS C 1 61 ? -30.916 22.379 92.851 1.00 49.44 ? 61 LYS C CA 1 +ATOM 11826 C C . LYS C 1 61 ? -31.669 21.157 92.326 1.00 47.38 ? 61 LYS C C 1 +ATOM 11827 O O . LYS C 1 61 ? -32.007 20.258 93.089 1.00 49.65 ? 61 LYS C O 1 +ATOM 11828 C CB . LYS C 1 61 ? -31.764 23.065 93.928 1.00 51.97 ? 61 LYS C CB 1 +ATOM 11829 C CG . LYS C 1 61 ? -31.045 24.156 94.726 1.00 56.24 ? 61 LYS C CG 1 +ATOM 11830 C CD . LYS C 1 61 ? -30.061 23.577 95.738 1.00 60.45 ? 61 LYS C CD 1 +ATOM 11831 C CE . LYS C 1 61 ? -29.649 24.632 96.765 1.00 63.42 ? 61 LYS C CE 1 +ATOM 11832 N NZ . LYS C 1 61 ? -28.741 24.089 97.825 1.00 65.13 ? 61 LYS C NZ 1 +ATOM 11833 N N . GLU C 1 62 ? -31.927 21.119 91.028 1.00 45.17 ? 62 GLU C N 1 +ATOM 11834 C CA . GLU C 1 62 ? -32.651 20.003 90.429 1.00 44.02 ? 62 GLU C CA 1 +ATOM 11835 C C . GLU C 1 62 ? -31.823 18.716 90.367 1.00 41.56 ? 62 GLU C C 1 +ATOM 11836 O O . GLU C 1 62 ? -30.644 18.750 90.026 1.00 42.53 ? 62 GLU C O 1 +ATOM 11837 C CB . GLU C 1 62 ? -33.103 20.402 89.024 1.00 44.94 ? 62 GLU C CB 1 +ATOM 11838 C CG . GLU C 1 62 ? -33.958 19.379 88.309 1.00 45.27 ? 62 GLU C CG 1 +ATOM 11839 C CD . GLU C 1 62 ? -34.589 19.946 87.046 1.00 48.95 ? 62 GLU C CD 1 +ATOM 11840 O OE1 . GLU C 1 62 ? -34.402 21.161 86.763 1.00 49.52 ? 62 GLU C OE1 1 +ATOM 11841 O OE2 . GLU C 1 62 ? -35.281 19.176 86.341 1.00 48.33 ? 62 GLU C OE2 1 +ATOM 11842 N N . HIS C 1 63 ? -32.444 17.586 90.696 1.00 39.05 ? 63 HIS C N 1 +ATOM 11843 C CA . HIS C 1 63 ? -31.756 16.297 90.659 1.00 37.81 ? 63 HIS C CA 1 +ATOM 11844 C C . HIS C 1 63 ? -32.211 15.469 89.466 1.00 36.72 ? 63 HIS C C 1 +ATOM 11845 O O . HIS C 1 63 ? -33.383 15.492 89.097 1.00 38.22 ? 63 HIS C O 1 +ATOM 11846 C CB . HIS C 1 63 ? -32.031 15.501 91.934 1.00 38.06 ? 63 HIS C CB 1 +ATOM 11847 C CG . HIS C 1 63 ? -31.720 16.248 93.191 1.00 38.44 ? 63 HIS C CG 1 +ATOM 11848 N ND1 . HIS C 1 63 ? -30.440 16.616 93.545 1.00 37.82 ? 63 HIS C ND1 1 +ATOM 11849 C CD2 . HIS C 1 63 ? -32.532 16.719 94.166 1.00 37.96 ? 63 HIS C CD2 1 +ATOM 11850 C CE1 . HIS C 1 63 ? -30.477 17.283 94.684 1.00 38.27 ? 63 HIS C CE1 1 +ATOM 11851 N NE2 . HIS C 1 63 ? -31.735 17.359 95.082 1.00 38.70 ? 63 HIS C NE2 1 +ATOM 11852 N N . ILE C 1 64 ? -31.279 14.743 88.863 1.00 35.18 ? 64 ILE C N 1 +ATOM 11853 C CA . ILE C 1 64 ? -31.585 13.884 87.728 1.00 33.01 ? 64 ILE C CA 1 +ATOM 11854 C C . ILE C 1 64 ? -31.090 12.493 88.097 1.00 33.55 ? 64 ILE C C 1 +ATOM 11855 O O . ILE C 1 64 ? -29.908 12.292 88.388 1.00 33.25 ? 64 ILE C O 1 +ATOM 11856 C CB . ILE C 1 64 ? -30.867 14.349 86.442 1.00 33.38 ? 64 ILE C CB 1 +ATOM 11857 C CG1 . ILE C 1 64 ? -31.261 15.795 86.112 1.00 33.51 ? 64 ILE C CG1 1 +ATOM 11858 C CG2 . ILE C 1 64 ? -31.227 13.416 85.278 1.00 32.53 ? 64 ILE C CG2 1 +ATOM 11859 C CD1 . ILE C 1 64 ? -32.747 15.990 85.794 1.00 34.34 ? 64 ILE C CD1 1 +ATOM 11860 N N . ILE C 1 65 ? -31.998 11.532 88.096 1.00 32.91 ? 65 ILE C N 1 +ATOM 11861 C CA . ILE C 1 65 ? -31.645 10.173 88.446 1.00 33.26 ? 65 ILE C CA 1 +ATOM 11862 C C . ILE C 1 65 ? -32.152 9.214 87.387 1.00 34.44 ? 65 ILE C C 1 +ATOM 11863 O O . ILE C 1 65 ? -32.968 9.586 86.538 1.00 34.10 ? 65 ILE C O 1 +ATOM 11864 C CB . ILE C 1 65 ? -32.251 9.800 89.802 1.00 34.18 ? 65 ILE C CB 1 +ATOM 11865 C CG1 . ILE C 1 65 ? -33.783 9.840 89.716 1.00 33.86 ? 65 ILE C CG1 1 +ATOM 11866 C CG2 . ILE C 1 65 ? -31.738 10.773 90.874 1.00 31.39 ? 65 ILE C CG2 1 +ATOM 11867 C CD1 . ILE C 1 65 ? -34.480 9.587 91.031 1.00 34.15 ? 65 ILE C CD1 1 +ATOM 11868 N N . GLY C 1 66 ? -31.660 7.980 87.425 1.00 35.71 ? 66 GLY C N 1 +ATOM 11869 C CA . GLY C 1 66 ? -32.093 6.999 86.450 1.00 35.37 ? 66 GLY C CA 1 +ATOM 11870 C C . GLY C 1 66 ? -31.035 6.661 85.417 1.00 36.62 ? 66 GLY C C 1 +ATOM 11871 O O . GLY C 1 66 ? -29.840 6.625 85.724 1.00 36.54 ? 66 GLY C O 1 +ATOM 11872 N N . LEU C 1 67 ? -31.492 6.415 84.192 1.00 35.89 ? 67 LEU C N 1 +ATOM 11873 C CA . LEU C 1 67 ? -30.637 6.042 83.072 1.00 35.77 ? 67 LEU C CA 1 +ATOM 11874 C C . LEU C 1 67 ? -30.068 4.637 83.229 1.00 36.13 ? 67 LEU C C 1 +ATOM 11875 O O . LEU C 1 67 ? -29.147 4.241 82.507 1.00 37.05 ? 67 LEU C O 1 +ATOM 11876 C CB . LEU C 1 67 ? -29.507 7.052 82.876 1.00 34.18 ? 67 LEU C CB 1 +ATOM 11877 C CG . LEU C 1 67 ? -29.998 8.458 82.523 1.00 35.74 ? 67 LEU C CG 1 +ATOM 11878 C CD1 . LEU C 1 67 ? -28.806 9.324 82.176 1.00 36.22 ? 67 LEU C CD1 1 +ATOM 11879 C CD2 . LEU C 1 67 ? -30.966 8.410 81.348 1.00 35.14 ? 67 LEU C CD2 1 +ATOM 11880 N N . GLY C 1 68 ? -30.621 3.888 84.177 1.00 36.03 ? 68 GLY C N 1 +ATOM 11881 C CA . GLY C 1 68 ? -30.193 2.513 84.389 1.00 36.38 ? 68 GLY C CA 1 +ATOM 11882 C C . GLY C 1 68 ? -28.775 2.240 84.865 1.00 36.68 ? 68 GLY C C 1 +ATOM 11883 O O . GLY C 1 68 ? -28.276 2.848 85.814 1.00 38.01 ? 68 GLY C O 1 +ATOM 11884 N N . GLU C 1 69 ? -28.126 1.309 84.180 1.00 35.52 ? 69 GLU C N 1 +ATOM 11885 C CA . GLU C 1 69 ? -26.777 0.874 84.509 1.00 35.86 ? 69 GLU C CA 1 +ATOM 11886 C C . GLU C 1 69 ? -25.687 1.853 84.073 1.00 33.93 ? 69 GLU C C 1 +ATOM 11887 O O . GLU C 1 69 ? -25.175 1.759 82.967 1.00 33.41 ? 69 GLU C O 1 +ATOM 11888 C CB . GLU C 1 69 ? -26.552 -0.488 83.857 1.00 37.72 ? 69 GLU C CB 1 +ATOM 11889 C CG . GLU C 1 69 ? -25.386 -1.286 84.366 1.00 41.13 ? 69 GLU C CG 1 +ATOM 11890 C CD . GLU C 1 69 ? -25.277 -2.616 83.647 1.00 44.19 ? 69 GLU C CD 1 +ATOM 11891 O OE1 . GLU C 1 69 ? -24.943 -2.608 82.438 1.00 45.69 ? 69 GLU C OE1 1 +ATOM 11892 O OE2 . GLU C 1 69 ? -25.543 -3.664 84.278 1.00 43.55 ? 69 GLU C OE2 1 +ATOM 11893 N N . LYS C 1 70 ? -25.322 2.782 84.949 1.00 33.09 ? 70 LYS C N 1 +ATOM 11894 C CA . LYS C 1 70 ? -24.282 3.760 84.623 1.00 32.94 ? 70 LYS C CA 1 +ATOM 11895 C C . LYS C 1 70 ? -23.161 3.740 85.651 1.00 32.13 ? 70 LYS C C 1 +ATOM 11896 O O . LYS C 1 70 ? -23.412 3.738 86.856 1.00 31.39 ? 70 LYS C O 1 +ATOM 11897 C CB . LYS C 1 70 ? -24.872 5.174 84.545 1.00 32.11 ? 70 LYS C CB 1 +ATOM 11898 C CG . LYS C 1 70 ? -25.874 5.364 83.422 1.00 33.02 ? 70 LYS C CG 1 +ATOM 11899 C CD . LYS C 1 70 ? -25.256 5.035 82.086 1.00 32.38 ? 70 LYS C CD 1 +ATOM 11900 C CE . LYS C 1 70 ? -26.253 5.183 80.959 1.00 33.66 ? 70 LYS C CE 1 +ATOM 11901 N NZ . LYS C 1 70 ? -25.653 4.760 79.666 1.00 34.39 ? 70 LYS C NZ 1 +ATOM 11902 N N . ALA C 1 71 ? -21.925 3.727 85.171 1.00 30.41 ? 71 ALA C N 1 +ATOM 11903 C CA . ALA C 1 71 ? -20.775 3.711 86.068 1.00 30.26 ? 71 ALA C CA 1 +ATOM 11904 C C . ALA C 1 71 ? -20.495 5.141 86.565 1.00 29.52 ? 71 ALA C C 1 +ATOM 11905 O O . ALA C 1 71 ? -19.373 5.640 86.467 1.00 28.81 ? 71 ALA C O 1 +ATOM 11906 C CB . ALA C 1 71 ? -19.557 3.143 85.334 1.00 29.31 ? 71 ALA C CB 1 +ATOM 11907 N N . PHE C 1 72 ? -21.533 5.789 87.092 1.00 29.77 ? 72 PHE C N 1 +ATOM 11908 C CA . PHE C 1 72 ? -21.437 7.162 87.587 1.00 29.23 ? 72 PHE C CA 1 +ATOM 11909 C C . PHE C 1 72 ? -22.259 7.377 88.849 1.00 29.57 ? 72 PHE C C 1 +ATOM 11910 O O . PHE C 1 72 ? -23.031 6.515 89.252 1.00 30.99 ? 72 PHE C O 1 +ATOM 11911 C CB . PHE C 1 72 ? -21.934 8.157 86.526 1.00 27.48 ? 72 PHE C CB 1 +ATOM 11912 C CG . PHE C 1 72 ? -21.060 8.249 85.317 1.00 27.26 ? 72 PHE C CG 1 +ATOM 11913 C CD1 . PHE C 1 72 ? -21.120 7.278 84.322 1.00 26.55 ? 72 PHE C CD1 1 +ATOM 11914 C CD2 . PHE C 1 72 ? -20.149 9.295 85.184 1.00 26.02 ? 72 PHE C CD2 1 +ATOM 11915 C CE1 . PHE C 1 72 ? -20.280 7.339 83.202 1.00 26.52 ? 72 PHE C CE1 1 +ATOM 11916 C CE2 . PHE C 1 72 ? -19.305 9.368 84.073 1.00 26.46 ? 72 PHE C CE2 1 +ATOM 11917 C CZ . PHE C 1 72 ? -19.371 8.384 83.078 1.00 26.46 ? 72 PHE C CZ 1 +ATOM 11918 N N . GLU C 1 73 ? -22.075 8.540 89.465 1.00 29.84 ? 73 GLU C N 1 +ATOM 11919 C CA . GLU C 1 73 ? -22.820 8.922 90.651 1.00 31.87 ? 73 GLU C CA 1 +ATOM 11920 C C . GLU C 1 73 ? -24.332 8.860 90.332 1.00 32.98 ? 73 GLU C C 1 +ATOM 11921 O O . GLU C 1 73 ? -24.758 9.080 89.196 1.00 32.26 ? 73 GLU C O 1 +ATOM 11922 C CB . GLU C 1 73 ? -22.443 10.348 91.071 1.00 32.94 ? 73 GLU C CB 1 +ATOM 11923 C CG . GLU C 1 73 ? -21.026 10.531 91.640 1.00 36.25 ? 73 GLU C CG 1 +ATOM 11924 C CD . GLU C 1 73 ? -19.906 10.326 90.615 1.00 38.57 ? 73 GLU C CD 1 +ATOM 11925 O OE1 . GLU C 1 73 ? -20.150 10.521 89.401 1.00 38.67 ? 73 GLU C OE1 1 +ATOM 11926 O OE2 . GLU C 1 73 ? -18.769 9.987 91.030 1.00 39.98 ? 73 GLU C OE2 1 +ATOM 11927 N N . LEU C 1 74 ? -25.138 8.568 91.339 1.00 34.35 ? 74 LEU C N 1 +ATOM 11928 C CA . LEU C 1 74 ? -26.578 8.467 91.160 1.00 36.48 ? 74 LEU C CA 1 +ATOM 11929 C C . LEU C 1 74 ? -27.236 9.743 90.638 1.00 37.49 ? 74 LEU C C 1 +ATOM 11930 O O . LEU C 1 74 ? -28.209 9.663 89.893 1.00 38.75 ? 74 LEU C O 1 +ATOM 11931 C CB . LEU C 1 74 ? -27.226 8.009 92.468 1.00 36.63 ? 74 LEU C CB 1 +ATOM 11932 C CG . LEU C 1 74 ? -27.552 6.510 92.607 1.00 36.73 ? 74 LEU C CG 1 +ATOM 11933 C CD1 . LEU C 1 74 ? -26.803 5.674 91.583 1.00 36.14 ? 74 LEU C CD1 1 +ATOM 11934 C CD2 . LEU C 1 74 ? -27.240 6.066 94.018 1.00 35.94 ? 74 LEU C CD2 1 +ATOM 11935 N N . ASP C 1 75 ? -26.733 10.913 91.031 1.00 38.22 ? 75 ASP C N 1 +ATOM 11936 C CA . ASP C 1 75 ? -27.271 12.172 90.514 1.00 38.40 ? 75 ASP C CA 1 +ATOM 11937 C C . ASP C 1 75 ? -26.464 12.343 89.229 1.00 36.93 ? 75 ASP C C 1 +ATOM 11938 O O . ASP C 1 75 ? -25.260 12.589 89.279 1.00 36.31 ? 75 ASP C O 1 +ATOM 11939 C CB . ASP C 1 75 ? -26.998 13.340 91.466 1.00 43.08 ? 75 ASP C CB 1 +ATOM 11940 C CG . ASP C 1 75 ? -27.799 14.597 91.097 1.00 48.34 ? 75 ASP C CG 1 +ATOM 11941 O OD1 . ASP C 1 75 ? -27.909 14.920 89.892 1.00 50.19 ? 75 ASP C OD1 1 +ATOM 11942 O OD2 . ASP C 1 75 ? -28.316 15.275 92.012 1.00 52.02 ? 75 ASP C OD2 1 +ATOM 11943 N N . ARG C 1 76 ? -27.139 12.229 88.085 1.00 36.18 ? 76 ARG C N 1 +ATOM 11944 C CA . ARG C 1 76 ? -26.491 12.257 86.775 1.00 34.74 ? 76 ARG C CA 1 +ATOM 11945 C C . ARG C 1 76 ? -26.037 13.560 86.134 1.00 36.23 ? 76 ARG C C 1 +ATOM 11946 O O . ARG C 1 76 ? -25.518 13.539 85.020 1.00 37.51 ? 76 ARG C O 1 +ATOM 11947 C CB . ARG C 1 76 ? -27.375 11.522 85.768 1.00 33.21 ? 76 ARG C CB 1 +ATOM 11948 C CG . ARG C 1 76 ? -27.963 10.209 86.263 1.00 33.08 ? 76 ARG C CG 1 +ATOM 11949 C CD . ARG C 1 76 ? -26.902 9.187 86.647 1.00 33.06 ? 76 ARG C CD 1 +ATOM 11950 N NE . ARG C 1 76 ? -27.447 7.830 86.628 1.00 33.30 ? 76 ARG C NE 1 +ATOM 11951 C CZ . ARG C 1 76 ? -26.856 6.756 87.149 1.00 32.49 ? 76 ARG C CZ 1 +ATOM 11952 N NH1 . ARG C 1 76 ? -25.677 6.852 87.753 1.00 31.99 ? 76 ARG C NH1 1 +ATOM 11953 N NH2 . ARG C 1 76 ? -27.452 5.575 87.058 1.00 32.67 ? 76 ARG C NH2 1 +ATOM 11954 N N . LYS C 1 77 ? -26.207 14.692 86.803 1.00 36.38 ? 77 LYS C N 1 +ATOM 11955 C CA . LYS C 1 77 ? -25.804 15.956 86.200 1.00 37.09 ? 77 LYS C CA 1 +ATOM 11956 C C . LYS C 1 77 ? -24.338 16.061 85.771 1.00 36.78 ? 77 LYS C C 1 +ATOM 11957 O O . LYS C 1 77 ? -23.458 15.407 86.330 1.00 38.24 ? 77 LYS C O 1 +ATOM 11958 C CB . LYS C 1 77 ? -26.152 17.105 87.149 1.00 39.59 ? 77 LYS C CB 1 +ATOM 11959 C CG . LYS C 1 77 ? -27.655 17.260 87.376 1.00 42.97 ? 77 LYS C CG 1 +ATOM 11960 C CD . LYS C 1 77 ? -27.969 18.104 88.602 1.00 45.30 ? 77 LYS C CD 1 +ATOM 11961 C CE . LYS C 1 77 ? -27.655 19.557 88.377 1.00 48.76 ? 77 LYS C CE 1 +ATOM 11962 N NZ . LYS C 1 77 ? -27.998 20.355 89.586 1.00 52.00 ? 77 LYS C NZ 1 +ATOM 11963 N N . ARG C 1 78 ? -24.107 16.889 84.756 1.00 35.61 ? 78 ARG C N 1 +ATOM 11964 C CA . ARG C 1 78 ? -22.783 17.177 84.212 1.00 35.94 ? 78 ARG C CA 1 +ATOM 11965 C C . ARG C 1 78 ? -22.110 16.033 83.483 1.00 35.27 ? 78 ARG C C 1 +ATOM 11966 O O . ARG C 1 78 ? -20.926 15.777 83.681 1.00 35.18 ? 78 ARG C O 1 +ATOM 11967 C CB . ARG C 1 78 ? -21.849 17.680 85.316 1.00 36.84 ? 78 ARG C CB 1 +ATOM 11968 C CG . ARG C 1 78 ? -22.478 18.673 86.266 1.00 37.41 ? 78 ARG C CG 1 +ATOM 11969 C CD . ARG C 1 78 ? -23.154 19.822 85.539 1.00 38.41 ? 78 ARG C CD 1 +ATOM 11970 N NE . ARG C 1 78 ? -23.930 20.625 86.479 1.00 40.64 ? 78 ARG C NE 1 +ATOM 11971 C CZ . ARG C 1 78 ? -24.919 21.440 86.132 1.00 40.65 ? 78 ARG C CZ 1 +ATOM 11972 N NH1 . ARG C 1 78 ? -25.262 21.563 84.859 1.00 41.17 ? 78 ARG C NH1 1 +ATOM 11973 N NH2 . ARG C 1 78 ? -25.564 22.131 87.062 1.00 42.40 ? 78 ARG C NH2 1 +ATOM 11974 N N . LYS C 1 79 ? -22.862 15.359 82.627 1.00 35.01 ? 79 LYS C N 1 +ATOM 11975 C CA . LYS C 1 79 ? -22.326 14.250 81.862 1.00 34.02 ? 79 LYS C CA 1 +ATOM 11976 C C . LYS C 1 79 ? -23.200 14.009 80.641 1.00 33.18 ? 79 LYS C C 1 +ATOM 11977 O O . LYS C 1 79 ? -24.404 14.246 80.682 1.00 34.47 ? 79 LYS C O 1 +ATOM 11978 C CB . LYS C 1 79 ? -22.283 12.984 82.726 1.00 35.82 ? 79 LYS C CB 1 +ATOM 11979 C CG . LYS C 1 79 ? -21.482 11.857 82.097 1.00 40.20 ? 79 LYS C CG 1 +ATOM 11980 C CD . LYS C 1 79 ? -20.024 12.271 81.942 1.00 43.51 ? 79 LYS C CD 1 +ATOM 11981 C CE . LYS C 1 79 ? -19.254 11.314 81.034 1.00 48.07 ? 79 LYS C CE 1 +ATOM 11982 N NZ . LYS C 1 79 ? -17.798 11.682 80.952 1.00 47.64 ? 79 LYS C NZ 1 +ATOM 11983 N N . ARG C 1 80 ? -22.588 13.562 79.552 1.00 32.38 ? 80 ARG C N 1 +ATOM 11984 C CA . ARG C 1 80 ? -23.319 13.261 78.327 1.00 32.49 ? 80 ARG C CA 1 +ATOM 11985 C C . ARG C 1 80 ? -23.365 11.727 78.244 1.00 33.33 ? 80 ARG C C 1 +ATOM 11986 O O . ARG C 1 80 ? -22.349 11.088 77.989 1.00 33.02 ? 80 ARG C O 1 +ATOM 11987 C CB A ARG C 1 80 ? -22.589 13.855 77.115 0.50 31.91 ? 80 ARG C CB 1 +ATOM 11988 C CB B ARG C 1 80 ? -22.581 13.832 77.114 0.50 31.92 ? 80 ARG C CB 1 +ATOM 11989 C CG A ARG C 1 80 ? -23.329 13.761 75.764 0.50 32.37 ? 80 ARG C CG 1 +ATOM 11990 C CG B ARG C 1 80 ? -23.021 13.251 75.770 0.50 32.47 ? 80 ARG C CG 1 +ATOM 11991 C CD A ARG C 1 80 ? -22.494 14.417 74.659 0.50 33.40 ? 80 ARG C CD 1 +ATOM 11992 C CD B ARG C 1 80 ? -22.444 14.046 74.614 0.50 33.50 ? 80 ARG C CD 1 +ATOM 11993 N NE A ARG C 1 80 ? -22.983 14.175 73.298 0.50 34.68 ? 80 ARG C NE 1 +ATOM 11994 N NE B ARG C 1 80 ? -22.787 13.475 73.312 0.50 34.88 ? 80 ARG C NE 1 +ATOM 11995 C CZ A ARG C 1 80 ? -23.934 14.883 72.690 0.50 35.47 ? 80 ARG C CZ 1 +ATOM 11996 C CZ B ARG C 1 80 ? -22.270 12.353 72.827 0.50 35.21 ? 80 ARG C CZ 1 +ATOM 11997 N NH1 A ARG C 1 80 ? -24.522 15.896 73.318 0.50 34.97 ? 80 ARG C NH1 1 +ATOM 11998 N NH1 B ARG C 1 80 ? -21.381 11.672 73.532 0.50 36.58 ? 80 ARG C NH1 1 +ATOM 11999 N NH2 A ARG C 1 80 ? -24.286 14.588 71.441 0.50 34.66 ? 80 ARG C NH2 1 +ATOM 12000 N NH2 B ARG C 1 80 ? -22.633 11.918 71.630 0.50 36.42 ? 80 ARG C NH2 1 +ATOM 12001 N N . TYR C 1 81 ? -24.540 11.138 78.463 1.00 32.65 ? 81 TYR C N 1 +ATOM 12002 C CA . TYR C 1 81 ? -24.674 9.687 78.433 1.00 31.81 ? 81 TYR C CA 1 +ATOM 12003 C C . TYR C 1 81 ? -25.116 9.146 77.097 1.00 33.07 ? 81 TYR C C 1 +ATOM 12004 O O . TYR C 1 81 ? -25.900 9.769 76.391 1.00 36.18 ? 81 TYR C O 1 +ATOM 12005 C CB . TYR C 1 81 ? -25.660 9.206 79.496 1.00 30.67 ? 81 TYR C CB 1 +ATOM 12006 C CG . TYR C 1 81 ? -25.328 9.664 80.899 1.00 31.43 ? 81 TYR C CG 1 +ATOM 12007 C CD1 . TYR C 1 81 ? -25.751 10.911 81.360 1.00 30.94 ? 81 TYR C CD1 1 +ATOM 12008 C CD2 . TYR C 1 81 ? -24.569 8.870 81.753 1.00 30.40 ? 81 TYR C CD2 1 +ATOM 12009 C CE1 . TYR C 1 81 ? -25.426 11.360 82.633 1.00 30.15 ? 81 TYR C CE1 1 +ATOM 12010 C CE2 . TYR C 1 81 ? -24.236 9.307 83.027 1.00 32.13 ? 81 TYR C CE2 1 +ATOM 12011 C CZ . TYR C 1 81 ? -24.668 10.557 83.461 1.00 31.21 ? 81 TYR C CZ 1 +ATOM 12012 O OH . TYR C 1 81 ? -24.338 11.007 84.713 1.00 30.16 ? 81 TYR C OH 1 +ATOM 12013 N N . VAL C 1 82 ? -24.608 7.972 76.753 1.00 33.53 ? 82 VAL C N 1 +ATOM 12014 C CA . VAL C 1 82 ? -24.961 7.316 75.503 1.00 34.00 ? 82 VAL C CA 1 +ATOM 12015 C C . VAL C 1 82 ? -25.697 6.034 75.863 1.00 35.62 ? 82 VAL C C 1 +ATOM 12016 O O . VAL C 1 82 ? -25.248 5.282 76.728 1.00 36.43 ? 82 VAL C O 1 +ATOM 12017 C CB . VAL C 1 82 ? -23.693 6.959 74.690 1.00 34.27 ? 82 VAL C CB 1 +ATOM 12018 C CG1 . VAL C 1 82 ? -24.062 6.104 73.500 1.00 35.09 ? 82 VAL C CG1 1 +ATOM 12019 C CG2 . VAL C 1 82 ? -22.990 8.233 74.231 1.00 32.22 ? 82 VAL C CG2 1 +ATOM 12020 N N . MET C 1 83 ? -26.838 5.793 75.232 1.00 36.42 ? 83 MET C N 1 +ATOM 12021 C CA . MET C 1 83 ? -27.588 4.572 75.501 1.00 37.10 ? 83 MET C CA 1 +ATOM 12022 C C . MET C 1 83 ? -27.374 3.628 74.327 1.00 36.25 ? 83 MET C C 1 +ATOM 12023 O O . MET C 1 83 ? -28.069 3.721 73.308 1.00 36.63 ? 83 MET C O 1 +ATOM 12024 C CB . MET C 1 83 ? -29.087 4.861 75.645 1.00 40.33 ? 83 MET C CB 1 +ATOM 12025 C CG . MET C 1 83 ? -29.446 5.903 76.695 1.00 45.62 ? 83 MET C CG 1 +ATOM 12026 S SD . MET C 1 83 ? -28.959 5.495 78.400 1.00 48.52 ? 83 MET C SD 1 +ATOM 12027 C CE . MET C 1 83 ? -30.073 4.162 78.728 1.00 50.41 ? 83 MET C CE 1 +ATOM 12028 N N . TYR C 1 84 ? -26.409 2.727 74.468 1.00 33.64 ? 84 TYR C N 1 +ATOM 12029 C CA . TYR C 1 84 ? -26.105 1.774 73.413 1.00 33.04 ? 84 TYR C CA 1 +ATOM 12030 C C . TYR C 1 84 ? -25.493 0.527 74.035 1.00 31.93 ? 84 TYR C C 1 +ATOM 12031 O O . TYR C 1 84 ? -24.327 0.548 74.431 1.00 32.34 ? 84 TYR C O 1 +ATOM 12032 C CB . TYR C 1 84 ? -25.121 2.395 72.422 1.00 32.66 ? 84 TYR C CB 1 +ATOM 12033 C CG . TYR C 1 84 ? -25.284 1.899 71.001 1.00 36.06 ? 84 TYR C CG 1 +ATOM 12034 C CD1 . TYR C 1 84 ? -26.517 2.008 70.343 1.00 37.10 ? 84 TYR C CD1 1 +ATOM 12035 C CD2 . TYR C 1 84 ? -24.205 1.351 70.299 1.00 35.98 ? 84 TYR C CD2 1 +ATOM 12036 C CE1 . TYR C 1 84 ? -26.675 1.585 69.018 1.00 39.18 ? 84 TYR C CE1 1 +ATOM 12037 C CE2 . TYR C 1 84 ? -24.348 0.923 68.973 1.00 38.28 ? 84 TYR C CE2 1 +ATOM 12038 C CZ . TYR C 1 84 ? -25.587 1.042 68.341 1.00 41.00 ? 84 TYR C CZ 1 +ATOM 12039 O OH . TYR C 1 84 ? -25.757 0.612 67.040 1.00 42.90 ? 84 TYR C OH 1 +ATOM 12040 N N . ASN C 1 85 ? -26.275 -0.548 74.126 1.00 30.47 ? 85 ASN C N 1 +ATOM 12041 C CA . ASN C 1 85 ? -25.799 -1.808 74.709 1.00 30.08 ? 85 ASN C CA 1 +ATOM 12042 C C . ASN C 1 85 ? -24.448 -2.192 74.121 1.00 30.38 ? 85 ASN C C 1 +ATOM 12043 O O . ASN C 1 85 ? -24.297 -2.287 72.900 1.00 31.38 ? 85 ASN C O 1 +ATOM 12044 C CB . ASN C 1 85 ? -26.777 -2.948 74.427 1.00 29.82 ? 85 ASN C CB 1 +ATOM 12045 C CG . ASN C 1 85 ? -28.109 -2.768 75.109 1.00 29.66 ? 85 ASN C CG 1 +ATOM 12046 O OD1 . ASN C 1 85 ? -28.341 -1.794 75.819 1.00 31.84 ? 85 ASN C OD1 1 +ATOM 12047 N ND2 . ASN C 1 85 ? -28.997 -3.715 74.896 1.00 31.06 ? 85 ASN C ND2 1 +ATOM 12048 N N . VAL C 1 86 ? -23.470 -2.425 74.981 1.00 28.72 ? 86 VAL C N 1 +ATOM 12049 C CA . VAL C 1 86 ? -22.152 -2.803 74.497 1.00 31.64 ? 86 VAL C CA 1 +ATOM 12050 C C . VAL C 1 86 ? -21.421 -3.711 75.483 1.00 31.94 ? 86 VAL C C 1 +ATOM 12051 O O . VAL C 1 86 ? -21.600 -3.600 76.696 1.00 31.75 ? 86 VAL C O 1 +ATOM 12052 C CB . VAL C 1 86 ? -21.268 -1.540 74.227 1.00 31.97 ? 86 VAL C CB 1 +ATOM 12053 C CG1 . VAL C 1 86 ? -20.793 -0.942 75.530 1.00 30.78 ? 86 VAL C CG1 1 +ATOM 12054 C CG2 . VAL C 1 86 ? -20.082 -1.912 73.365 1.00 34.12 ? 86 VAL C CG2 1 +ATOM 12055 N N . ASP C 1 87 ? -20.617 -4.624 74.949 1.00 33.81 ? 87 ASP C N 1 +ATOM 12056 C CA . ASP C 1 87 ? -19.812 -5.524 75.770 1.00 35.11 ? 87 ASP C CA 1 +ATOM 12057 C C . ASP C 1 87 ? -18.709 -4.622 76.330 1.00 34.79 ? 87 ASP C C 1 +ATOM 12058 O O . ASP C 1 87 ? -17.751 -4.301 75.629 1.00 33.33 ? 87 ASP C O 1 +ATOM 12059 C CB . ASP C 1 87 ? -19.185 -6.618 74.901 1.00 37.55 ? 87 ASP C CB 1 +ATOM 12060 C CG . ASP C 1 87 ? -18.339 -7.586 75.705 1.00 38.71 ? 87 ASP C CG 1 +ATOM 12061 O OD1 . ASP C 1 87 ? -17.492 -7.131 76.489 1.00 40.91 ? 87 ASP C OD1 1 +ATOM 12062 O OD2 . ASP C 1 87 ? -18.516 -8.806 75.555 1.00 43.19 ? 87 ASP C OD2 1 +ATOM 12063 N N . ALA C 1 88 ? -18.851 -4.215 77.587 1.00 34.74 ? 88 ALA C N 1 +ATOM 12064 C CA . ALA C 1 88 ? -17.903 -3.304 78.216 1.00 34.63 ? 88 ALA C CA 1 +ATOM 12065 C C . ALA C 1 88 ? -16.531 -3.885 78.576 1.00 35.01 ? 88 ALA C C 1 +ATOM 12066 O O . ALA C 1 88 ? -15.621 -3.135 78.920 1.00 35.21 ? 88 ALA C O 1 +ATOM 12067 C CB . ALA C 1 88 ? -18.544 -2.688 79.456 1.00 34.13 ? 88 ALA C CB 1 +ATOM 12068 N N . GLY C 1 89 ? -16.378 -5.201 78.492 1.00 34.14 ? 89 GLY C N 1 +ATOM 12069 C CA . GLY C 1 89 ? -15.109 -5.813 78.842 1.00 33.03 ? 89 GLY C CA 1 +ATOM 12070 C C . GLY C 1 89 ? -14.835 -5.625 80.327 1.00 33.29 ? 89 GLY C C 1 +ATOM 12071 O O . GLY C 1 89 ? -15.748 -5.681 81.154 1.00 32.20 ? 89 GLY C O 1 +ATOM 12072 N N . ALA C 1 90 ? -13.571 -5.402 80.668 1.00 32.34 ? 90 ALA C N 1 +ATOM 12073 C CA . ALA C 1 90 ? -13.188 -5.189 82.052 1.00 32.94 ? 90 ALA C CA 1 +ATOM 12074 C C . ALA C 1 90 ? -13.422 -3.708 82.349 1.00 33.40 ? 90 ALA C C 1 +ATOM 12075 O O . ALA C 1 90 ? -12.473 -2.928 82.452 1.00 34.73 ? 90 ALA C O 1 +ATOM 12076 C CB . ALA C 1 90 ? -11.723 -5.552 82.240 1.00 30.50 ? 90 ALA C CB 1 +ATOM 12077 N N . TYR C 1 91 ? -14.688 -3.330 82.499 1.00 31.48 ? 91 TYR C N 1 +ATOM 12078 C CA . TYR C 1 91 ? -15.039 -1.942 82.735 1.00 32.25 ? 91 TYR C CA 1 +ATOM 12079 C C . TYR C 1 91 ? -14.524 -1.332 84.028 1.00 33.58 ? 91 TYR C C 1 +ATOM 12080 O O . TYR C 1 91 ? -14.354 -2.016 85.029 1.00 33.65 ? 91 TYR C O 1 +ATOM 12081 C CB . TYR C 1 91 ? -16.554 -1.770 82.663 1.00 30.75 ? 91 TYR C CB 1 +ATOM 12082 C CG . TYR C 1 91 ? -17.321 -2.473 83.748 1.00 28.78 ? 91 TYR C CG 1 +ATOM 12083 C CD1 . TYR C 1 91 ? -17.547 -1.864 84.977 1.00 28.46 ? 91 TYR C CD1 1 +ATOM 12084 C CD2 . TYR C 1 91 ? -17.858 -3.744 83.533 1.00 29.05 ? 91 TYR C CD2 1 +ATOM 12085 C CE1 . TYR C 1 91 ? -18.300 -2.502 85.968 1.00 30.25 ? 91 TYR C CE1 1 +ATOM 12086 C CE2 . TYR C 1 91 ? -18.605 -4.391 84.511 1.00 28.18 ? 91 TYR C CE2 1 +ATOM 12087 C CZ . TYR C 1 91 ? -18.829 -3.771 85.724 1.00 29.89 ? 91 TYR C CZ 1 +ATOM 12088 O OH . TYR C 1 91 ? -19.596 -4.415 86.679 1.00 29.67 ? 91 TYR C OH 1 +ATOM 12089 N N . LYS C 1 92 ? -14.296 -0.025 83.987 1.00 34.94 ? 92 LYS C N 1 +ATOM 12090 C CA . LYS C 1 92 ? -13.812 0.729 85.136 1.00 36.49 ? 92 LYS C CA 1 +ATOM 12091 C C . LYS C 1 92 ? -14.834 1.822 85.392 1.00 35.13 ? 92 LYS C C 1 +ATOM 12092 O O . LYS C 1 92 ? -15.764 2.000 84.603 1.00 34.62 ? 92 LYS C O 1 +ATOM 12093 C CB . LYS C 1 92 ? -12.451 1.358 84.814 1.00 39.92 ? 92 LYS C CB 1 +ATOM 12094 C CG . LYS C 1 92 ? -11.406 0.360 84.343 1.00 43.85 ? 92 LYS C CG 1 +ATOM 12095 C CD . LYS C 1 92 ? -10.132 1.058 83.902 1.00 47.51 ? 92 LYS C CD 1 +ATOM 12096 C CE . LYS C 1 92 ? -9.138 0.060 83.337 1.00 51.18 ? 92 LYS C CE 1 +ATOM 12097 N NZ . LYS C 1 92 ? -7.909 0.739 82.824 1.00 55.76 ? 92 LYS C NZ 1 +ATOM 12098 N N . LYS C 1 93 ? -14.677 2.571 86.477 1.00 33.73 ? 93 LYS C N 1 +ATOM 12099 C CA . LYS C 1 93 ? -15.652 3.612 86.718 1.00 32.98 ? 93 LYS C CA 1 +ATOM 12100 C C . LYS C 1 93 ? -15.539 4.719 85.674 1.00 30.96 ? 93 LYS C C 1 +ATOM 12101 O O . LYS C 1 93 ? -14.474 4.944 85.091 1.00 30.69 ? 93 LYS C O 1 +ATOM 12102 C CB . LYS C 1 93 ? -15.549 4.160 88.141 1.00 32.64 ? 93 LYS C CB 1 +ATOM 12103 C CG . LYS C 1 93 ? -14.318 4.929 88.495 1.00 36.16 ? 93 LYS C CG 1 +ATOM 12104 C CD . LYS C 1 93 ? -14.559 5.562 89.865 1.00 37.78 ? 93 LYS C CD 1 +ATOM 12105 C CE . LYS C 1 93 ? -13.363 6.333 90.365 1.00 41.90 ? 93 LYS C CE 1 +ATOM 12106 N NZ . LYS C 1 93 ? -13.677 6.975 91.680 1.00 45.08 ? 93 LYS C NZ 1 +ATOM 12107 N N . TYR C 1 94 ? -16.671 5.364 85.417 1.00 28.16 ? 94 TYR C N 1 +ATOM 12108 C CA . TYR C 1 94 ? -16.786 6.442 84.445 1.00 28.64 ? 94 TYR C CA 1 +ATOM 12109 C C . TYR C 1 94 ? -16.721 5.954 83.008 1.00 30.11 ? 94 TYR C C 1 +ATOM 12110 O O . TYR C 1 94 ? -16.583 6.740 82.081 1.00 31.15 ? 94 TYR C O 1 +ATOM 12111 C CB . TYR C 1 94 ? -15.743 7.544 84.704 1.00 26.78 ? 94 TYR C CB 1 +ATOM 12112 C CG . TYR C 1 94 ? -15.882 8.169 86.082 1.00 26.36 ? 94 TYR C CG 1 +ATOM 12113 C CD1 . TYR C 1 94 ? -17.131 8.261 86.698 1.00 24.78 ? 94 TYR C CD1 1 +ATOM 12114 C CD2 . TYR C 1 94 ? -14.775 8.650 86.774 1.00 25.30 ? 94 TYR C CD2 1 +ATOM 12115 C CE1 . TYR C 1 94 ? -17.274 8.805 87.961 1.00 24.67 ? 94 TYR C CE1 1 +ATOM 12116 C CE2 . TYR C 1 94 ? -14.909 9.206 88.045 1.00 24.65 ? 94 TYR C CE2 1 +ATOM 12117 C CZ . TYR C 1 94 ? -16.163 9.276 88.629 1.00 25.36 ? 94 TYR C CZ 1 +ATOM 12118 O OH . TYR C 1 94 ? -16.330 9.812 89.881 1.00 28.23 ? 94 TYR C OH 1 +ATOM 12119 N N . GLN C 1 95 ? -16.834 4.647 82.817 1.00 31.98 ? 95 GLN C N 1 +ATOM 12120 C CA . GLN C 1 95 ? -16.839 4.105 81.472 1.00 32.37 ? 95 GLN C CA 1 +ATOM 12121 C C . GLN C 1 95 ? -18.305 4.095 81.026 1.00 33.74 ? 95 GLN C C 1 +ATOM 12122 O O . GLN C 1 95 ? -19.194 3.762 81.808 1.00 32.04 ? 95 GLN C O 1 +ATOM 12123 C CB . GLN C 1 95 ? -16.282 2.688 81.460 1.00 33.72 ? 95 GLN C CB 1 +ATOM 12124 C CG . GLN C 1 95 ? -16.155 2.122 80.059 1.00 33.70 ? 95 GLN C CG 1 +ATOM 12125 C CD . GLN C 1 95 ? -15.504 0.773 80.048 1.00 33.23 ? 95 GLN C CD 1 +ATOM 12126 O OE1 . GLN C 1 95 ? -14.534 0.542 80.774 1.00 36.27 ? 95 GLN C OE1 1 +ATOM 12127 N NE2 . GLN C 1 95 ? -16.015 -0.127 79.221 1.00 32.96 ? 95 GLN C NE2 1 +ATOM 12128 N N . ASP C 1 96 ? -18.552 4.457 79.771 1.00 35.01 ? 96 ASP C N 1 +ATOM 12129 C CA . ASP C 1 96 ? -19.908 4.521 79.241 1.00 36.58 ? 96 ASP C CA 1 +ATOM 12130 C C . ASP C 1 96 ? -19.797 4.303 77.743 1.00 35.90 ? 96 ASP C C 1 +ATOM 12131 O O . ASP C 1 96 ? -18.850 4.766 77.121 1.00 37.64 ? 96 ASP C O 1 +ATOM 12132 C CB . ASP C 1 96 ? -20.500 5.910 79.540 1.00 40.64 ? 96 ASP C CB 1 +ATOM 12133 C CG . ASP C 1 96 ? -21.983 6.044 79.144 1.00 44.52 ? 96 ASP C CG 1 +ATOM 12134 O OD1 . ASP C 1 96 ? -22.821 5.239 79.612 1.00 44.37 ? 96 ASP C OD1 1 +ATOM 12135 O OD2 . ASP C 1 96 ? -22.310 6.980 78.374 1.00 46.31 ? 96 ASP C OD2 1 +ATOM 12136 N N . PRO C 1 97 ? -20.752 3.580 77.142 1.00 35.12 ? 97 PRO C N 1 +ATOM 12137 C CA . PRO C 1 97 ? -21.909 2.966 77.796 1.00 34.20 ? 97 PRO C CA 1 +ATOM 12138 C C . PRO C 1 97 ? -21.560 1.572 78.300 1.00 33.54 ? 97 PRO C C 1 +ATOM 12139 O O . PRO C 1 97 ? -20.442 1.095 78.092 1.00 33.20 ? 97 PRO C O 1 +ATOM 12140 C CB . PRO C 1 97 ? -22.941 2.920 76.674 1.00 33.97 ? 97 PRO C CB 1 +ATOM 12141 C CG . PRO C 1 97 ? -22.079 2.552 75.488 1.00 34.87 ? 97 PRO C CG 1 +ATOM 12142 C CD . PRO C 1 97 ? -20.828 3.420 75.674 1.00 33.66 ? 97 PRO C CD 1 +ATOM 12143 N N . LEU C 1 98 ? -22.523 0.928 78.959 1.00 33.85 ? 98 LEU C N 1 +ATOM 12144 C CA . LEU C 1 98 ? -22.339 -0.420 79.472 1.00 32.43 ? 98 LEU C CA 1 +ATOM 12145 C C . LEU C 1 98 ? -23.311 -1.390 78.788 1.00 31.68 ? 98 LEU C C 1 +ATOM 12146 O O . LEU C 1 98 ? -23.741 -1.141 77.670 1.00 30.39 ? 98 LEU C O 1 +ATOM 12147 C CB . LEU C 1 98 ? -22.498 -0.444 80.989 1.00 30.68 ? 98 LEU C CB 1 +ATOM 12148 C CG . LEU C 1 98 ? -21.479 0.425 81.742 1.00 34.16 ? 98 LEU C CG 1 +ATOM 12149 C CD1 . LEU C 1 98 ? -21.790 0.374 83.225 1.00 35.20 ? 98 LEU C CD1 1 +ATOM 12150 C CD2 . LEU C 1 98 ? -20.039 -0.047 81.482 1.00 33.61 ? 98 LEU C CD2 1 +ATOM 12151 N N . TYR C 1 99 ? -23.654 -2.478 79.466 1.00 31.31 ? 99 TYR C N 1 +ATOM 12152 C CA . TYR C 1 99 ? -24.508 -3.520 78.913 1.00 31.50 ? 99 TYR C CA 1 +ATOM 12153 C C . TYR C 1 99 ? -25.996 -3.229 78.761 1.00 33.39 ? 99 TYR C C 1 +ATOM 12154 O O . TYR C 1 99 ? -26.630 -3.711 77.819 1.00 34.47 ? 99 TYR C O 1 +ATOM 12155 C CB . TYR C 1 99 ? -24.386 -4.787 79.754 1.00 30.30 ? 99 TYR C CB 1 +ATOM 12156 C CG . TYR C 1 99 ? -22.979 -5.199 80.113 1.00 30.87 ? 99 TYR C CG 1 +ATOM 12157 C CD1 . TYR C 1 99 ? -22.181 -5.913 79.219 1.00 31.85 ? 99 TYR C CD1 1 +ATOM 12158 C CD2 . TYR C 1 99 ? -22.465 -4.921 81.371 1.00 30.45 ? 99 TYR C CD2 1 +ATOM 12159 C CE1 . TYR C 1 99 ? -20.911 -6.345 79.579 1.00 32.18 ? 99 TYR C CE1 1 +ATOM 12160 C CE2 . TYR C 1 99 ? -21.204 -5.347 81.739 1.00 32.51 ? 99 TYR C CE2 1 +ATOM 12161 C CZ . TYR C 1 99 ? -20.429 -6.060 80.847 1.00 32.85 ? 99 TYR C CZ 1 +ATOM 12162 O OH . TYR C 1 99 ? -19.183 -6.505 81.244 1.00 34.68 ? 99 TYR C OH 1 +ATOM 12163 N N . VAL C 1 100 ? -26.559 -2.467 79.690 1.00 33.24 ? 100 VAL C N 1 +ATOM 12164 C CA . VAL C 1 100 ? -27.985 -2.185 79.676 1.00 33.70 ? 100 VAL C CA 1 +ATOM 12165 C C . VAL C 1 100 ? -28.353 -0.746 79.345 1.00 35.03 ? 100 VAL C C 1 +ATOM 12166 O O . VAL C 1 100 ? -27.673 0.194 79.778 1.00 36.36 ? 100 VAL C O 1 +ATOM 12167 C CB . VAL C 1 100 ? -28.595 -2.543 81.051 1.00 33.94 ? 100 VAL C CB 1 +ATOM 12168 C CG1 . VAL C 1 100 ? -30.089 -2.258 81.068 1.00 33.50 ? 100 VAL C CG1 1 +ATOM 12169 C CG2 . VAL C 1 100 ? -28.322 -3.998 81.359 1.00 34.04 ? 100 VAL C CG2 1 +ATOM 12170 N N . SER C 1 101 ? -29.452 -0.583 78.607 1.00 35.45 ? 101 SER C N 1 +ATOM 12171 C CA . SER C 1 101 ? -29.952 0.740 78.210 1.00 35.81 ? 101 SER C CA 1 +ATOM 12172 C C . SER C 1 101 ? -31.417 0.994 78.589 1.00 35.23 ? 101 SER C C 1 +ATOM 12173 O O . SER C 1 101 ? -32.319 0.519 77.901 1.00 36.50 ? 101 SER C O 1 +ATOM 12174 C CB . SER C 1 101 ? -29.820 0.927 76.695 1.00 36.08 ? 101 SER C CB 1 +ATOM 12175 O OG . SER C 1 101 ? -28.472 0.871 76.275 1.00 39.06 ? 101 SER C OG 1 +ATOM 12176 N N . ILE C 1 102 ? -31.652 1.733 79.674 1.00 33.69 ? 102 ILE C N 1 +ATOM 12177 C CA . ILE C 1 102 ? -33.012 2.077 80.096 1.00 33.02 ? 102 ILE C CA 1 +ATOM 12178 C C . ILE C 1 102 ? -33.113 3.602 79.892 1.00 32.95 ? 102 ILE C C 1 +ATOM 12179 O O . ILE C 1 102 ? -32.660 4.371 80.738 1.00 32.42 ? 102 ILE C O 1 +ATOM 12180 C CB . ILE C 1 102 ? -33.258 1.781 81.597 1.00 33.75 ? 102 ILE C CB 1 +ATOM 12181 C CG1 . ILE C 1 102 ? -32.744 0.388 81.985 1.00 32.90 ? 102 ILE C CG1 1 +ATOM 12182 C CG2 . ILE C 1 102 ? -34.756 1.895 81.893 1.00 35.01 ? 102 ILE C CG2 1 +ATOM 12183 C CD1 . ILE C 1 102 ? -33.508 -0.760 81.382 1.00 32.61 ? 102 ILE C CD1 1 +ATOM 12184 N N . PRO C 1 103 ? -33.714 4.054 78.772 1.00 33.57 ? 103 PRO C N 1 +ATOM 12185 C CA . PRO C 1 103 ? -33.871 5.480 78.436 1.00 33.58 ? 103 PRO C CA 1 +ATOM 12186 C C . PRO C 1 103 ? -34.900 6.210 79.294 1.00 33.53 ? 103 PRO C C 1 +ATOM 12187 O O . PRO C 1 103 ? -35.791 6.885 78.768 1.00 31.86 ? 103 PRO C O 1 +ATOM 12188 C CB . PRO C 1 103 ? -34.305 5.462 76.969 1.00 32.22 ? 103 PRO C CB 1 +ATOM 12189 C CG . PRO C 1 103 ? -34.170 4.007 76.539 1.00 35.25 ? 103 PRO C CG 1 +ATOM 12190 C CD . PRO C 1 103 ? -34.423 3.231 77.783 1.00 32.82 ? 103 PRO C CD 1 +ATOM 12191 N N . LEU C 1 104 ? -34.763 6.074 80.608 1.00 32.64 ? 104 LEU C N 1 +ATOM 12192 C CA . LEU C 1 104 ? -35.668 6.703 81.552 1.00 33.43 ? 104 LEU C CA 1 +ATOM 12193 C C . LEU C 1 104 ? -34.904 7.516 82.574 1.00 34.30 ? 104 LEU C C 1 +ATOM 12194 O O . LEU C 1 104 ? -33.917 7.041 83.132 1.00 35.26 ? 104 LEU C O 1 +ATOM 12195 C CB . LEU C 1 104 ? -36.474 5.639 82.294 1.00 32.67 ? 104 LEU C CB 1 +ATOM 12196 C CG . LEU C 1 104 ? -37.132 6.065 83.609 1.00 34.45 ? 104 LEU C CG 1 +ATOM 12197 C CD1 . LEU C 1 104 ? -38.297 7.002 83.322 1.00 35.17 ? 104 LEU C CD1 1 +ATOM 12198 C CD2 . LEU C 1 104 ? -37.615 4.845 84.367 1.00 32.78 ? 104 LEU C CD2 1 +ATOM 12199 N N . PHE C 1 105 ? -35.343 8.747 82.813 1.00 35.06 ? 105 PHE C N 1 +ATOM 12200 C CA . PHE C 1 105 ? -34.706 9.557 83.836 1.00 35.05 ? 105 PHE C CA 1 +ATOM 12201 C C . PHE C 1 105 ? -35.789 10.279 84.606 1.00 36.69 ? 105 PHE C C 1 +ATOM 12202 O O . PHE C 1 105 ? -36.852 10.609 84.062 1.00 36.24 ? 105 PHE C O 1 +ATOM 12203 C CB . PHE C 1 105 ? -33.658 10.515 83.245 1.00 33.72 ? 105 PHE C CB 1 +ATOM 12204 C CG . PHE C 1 105 ? -34.208 11.762 82.621 1.00 33.88 ? 105 PHE C CG 1 +ATOM 12205 C CD1 . PHE C 1 105 ? -34.620 12.836 83.410 1.00 34.06 ? 105 PHE C CD1 1 +ATOM 12206 C CD2 . PHE C 1 105 ? -34.226 11.905 81.233 1.00 33.23 ? 105 PHE C CD2 1 +ATOM 12207 C CE1 . PHE C 1 105 ? -35.035 14.041 82.822 1.00 33.94 ? 105 PHE C CE1 1 +ATOM 12208 C CE2 . PHE C 1 105 ? -34.637 13.100 80.637 1.00 32.91 ? 105 PHE C CE2 1 +ATOM 12209 C CZ . PHE C 1 105 ? -35.041 14.172 81.433 1.00 32.71 ? 105 PHE C CZ 1 +ATOM 12210 N N . ILE C 1 106 ? -35.548 10.466 85.895 1.00 36.96 ? 106 ILE C N 1 +ATOM 12211 C CA . ILE C 1 106 ? -36.513 11.138 86.736 1.00 35.15 ? 106 ILE C CA 1 +ATOM 12212 C C . ILE C 1 106 ? -35.916 12.431 87.248 1.00 36.77 ? 106 ILE C C 1 +ATOM 12213 O O . ILE C 1 106 ? -34.765 12.474 87.698 1.00 37.44 ? 106 ILE C O 1 +ATOM 12214 C CB . ILE C 1 106 ? -36.913 10.259 87.930 1.00 35.62 ? 106 ILE C CB 1 +ATOM 12215 C CG1 . ILE C 1 106 ? -37.538 8.958 87.428 1.00 34.90 ? 106 ILE C CG1 1 +ATOM 12216 C CG2 . ILE C 1 106 ? -37.888 11.004 88.829 1.00 33.70 ? 106 ILE C CG2 1 +ATOM 12217 C CD1 . ILE C 1 106 ? -37.817 7.952 88.530 1.00 33.23 ? 106 ILE C CD1 1 +ATOM 12218 N N . SER C 1 107 ? -36.705 13.490 87.156 1.00 36.65 ? 107 SER C N 1 +ATOM 12219 C CA . SER C 1 107 ? -36.286 14.790 87.628 1.00 36.80 ? 107 SER C CA 1 +ATOM 12220 C C . SER C 1 107 ? -36.975 15.055 88.962 1.00 38.54 ? 107 SER C C 1 +ATOM 12221 O O . SER C 1 107 ? -38.163 14.760 89.122 1.00 37.84 ? 107 SER C O 1 +ATOM 12222 C CB . SER C 1 107 ? -36.690 15.857 86.617 1.00 38.06 ? 107 SER C CB 1 +ATOM 12223 O OG . SER C 1 107 ? -36.629 17.157 87.185 1.00 40.52 ? 107 SER C OG 1 +ATOM 12224 N N . VAL C 1 108 ? -36.224 15.576 89.927 1.00 38.62 ? 108 VAL C N 1 +ATOM 12225 C CA . VAL C 1 108 ? -36.792 15.905 91.220 1.00 39.29 ? 108 VAL C CA 1 +ATOM 12226 C C . VAL C 1 108 ? -36.466 17.368 91.439 1.00 42.08 ? 108 VAL C C 1 +ATOM 12227 O O . VAL C 1 108 ? -35.312 17.743 91.670 1.00 42.18 ? 108 VAL C O 1 +ATOM 12228 C CB . VAL C 1 108 ? -36.186 15.079 92.355 1.00 39.23 ? 108 VAL C CB 1 +ATOM 12229 C CG1 . VAL C 1 108 ? -36.914 15.395 93.653 1.00 38.05 ? 108 VAL C CG1 1 +ATOM 12230 C CG2 . VAL C 1 108 ? -36.299 13.609 92.040 1.00 38.50 ? 108 VAL C CG2 1 +ATOM 12231 N N . LYS C 1 109 ? -37.496 18.196 91.335 1.00 44.10 ? 109 LYS C N 1 +ATOM 12232 C CA . LYS C 1 109 ? -37.353 19.632 91.490 1.00 46.17 ? 109 LYS C CA 1 +ATOM 12233 C C . LYS C 1 109 ? -38.322 20.110 92.567 1.00 47.13 ? 109 LYS C C 1 +ATOM 12234 O O . LYS C 1 109 ? -39.518 19.791 92.540 1.00 46.55 ? 109 LYS C O 1 +ATOM 12235 C CB . LYS C 1 109 ? -37.638 20.308 90.148 1.00 48.07 ? 109 LYS C CB 1 +ATOM 12236 C CG . LYS C 1 109 ? -37.353 21.792 90.118 1.00 51.60 ? 109 LYS C CG 1 +ATOM 12237 C CD . LYS C 1 109 ? -37.400 22.337 88.696 1.00 53.58 ? 109 LYS C CD 1 +ATOM 12238 C CE . LYS C 1 109 ? -38.753 22.112 88.035 1.00 55.05 ? 109 LYS C CE 1 +ATOM 12239 N NZ . LYS C 1 109 ? -38.845 22.846 86.743 1.00 55.63 ? 109 LYS C NZ 1 +ATOM 12240 N N . ASP C 1 110 ? -37.800 20.864 93.527 1.00 48.02 ? 110 ASP C N 1 +ATOM 12241 C CA . ASP C 1 110 ? -38.625 21.356 94.623 1.00 49.40 ? 110 ASP C CA 1 +ATOM 12242 C C . ASP C 1 110 ? -39.306 20.163 95.314 1.00 48.54 ? 110 ASP C C 1 +ATOM 12243 O O . ASP C 1 110 ? -40.467 20.245 95.728 1.00 48.78 ? 110 ASP C O 1 +ATOM 12244 C CB . ASP C 1 110 ? -39.687 22.337 94.101 1.00 52.19 ? 110 ASP C CB 1 +ATOM 12245 C CG . ASP C 1 110 ? -39.079 23.580 93.434 1.00 56.29 ? 110 ASP C CG 1 +ATOM 12246 O OD1 . ASP C 1 110 ? -38.228 24.259 94.060 1.00 56.31 ? 110 ASP C OD1 1 +ATOM 12247 O OD2 . ASP C 1 110 ? -39.467 23.888 92.280 1.00 58.42 ? 110 ASP C OD2 1 +ATOM 12248 N N . GLY C 1 111 ? -38.577 19.053 95.419 1.00 46.32 ? 111 GLY C N 1 +ATOM 12249 C CA . GLY C 1 111 ? -39.107 17.861 96.060 1.00 43.33 ? 111 GLY C CA 1 +ATOM 12250 C C . GLY C 1 111 ? -40.127 17.065 95.257 1.00 42.30 ? 111 GLY C C 1 +ATOM 12251 O O . GLY C 1 111 ? -40.597 16.027 95.723 1.00 42.50 ? 111 GLY C O 1 +ATOM 12252 N N . VAL C 1 112 ? -40.464 17.530 94.057 1.00 40.14 ? 112 VAL C N 1 +ATOM 12253 C CA . VAL C 1 112 ? -41.445 16.847 93.217 1.00 37.87 ? 112 VAL C CA 1 +ATOM 12254 C C . VAL C 1 112 ? -40.769 16.103 92.078 1.00 37.59 ? 112 VAL C C 1 +ATOM 12255 O O . VAL C 1 112 ? -39.955 16.671 91.347 1.00 36.25 ? 112 VAL C O 1 +ATOM 12256 C CB . VAL C 1 112 ? -42.465 17.854 92.617 1.00 39.45 ? 112 VAL C CB 1 +ATOM 12257 C CG1 . VAL C 1 112 ? -43.420 17.139 91.670 1.00 36.65 ? 112 VAL C CG1 1 +ATOM 12258 C CG2 . VAL C 1 112 ? -43.233 18.545 93.743 1.00 36.68 ? 112 VAL C CG2 1 +ATOM 12259 N N . ALA C 1 113 ? -41.134 14.834 91.915 1.00 36.83 ? 113 ALA C N 1 +ATOM 12260 C CA . ALA C 1 113 ? -40.549 13.995 90.876 1.00 36.82 ? 113 ALA C CA 1 +ATOM 12261 C C . ALA C 1 113 ? -41.404 13.885 89.625 1.00 37.29 ? 113 ALA C C 1 +ATOM 12262 O O . ALA C 1 113 ? -42.636 13.839 89.695 1.00 38.37 ? 113 ALA C O 1 +ATOM 12263 C CB . ALA C 1 113 ? -40.269 12.601 91.426 1.00 34.91 ? 113 ALA C CB 1 +ATOM 12264 N N . THR C 1 114 ? -40.730 13.843 88.481 1.00 36.76 ? 114 THR C N 1 +ATOM 12265 C CA . THR C 1 114 ? -41.384 13.708 87.189 1.00 36.85 ? 114 THR C CA 1 +ATOM 12266 C C . THR C 1 114 ? -40.506 12.797 86.340 1.00 36.87 ? 114 THR C C 1 +ATOM 12267 O O . THR C 1 114 ? -39.288 12.952 86.310 1.00 35.72 ? 114 THR C O 1 +ATOM 12268 C CB . THR C 1 114 ? -41.518 15.061 86.476 1.00 38.76 ? 114 THR C CB 1 +ATOM 12269 O OG1 . THR C 1 114 ? -42.166 15.998 87.345 1.00 39.94 ? 114 THR C OG1 1 +ATOM 12270 C CG2 . THR C 1 114 ? -42.341 14.909 85.196 1.00 37.79 ? 114 THR C CG2 1 +ATOM 12271 N N . GLY C 1 115 ? -41.127 11.842 85.658 1.00 37.68 ? 115 GLY C N 1 +ATOM 12272 C CA . GLY C 1 115 ? -40.370 10.925 84.826 1.00 37.01 ? 115 GLY C CA 1 +ATOM 12273 C C . GLY C 1 115 ? -40.418 11.232 83.341 1.00 36.41 ? 115 GLY C C 1 +ATOM 12274 O O . GLY C 1 115 ? -41.374 11.820 82.839 1.00 36.96 ? 115 GLY C O 1 +ATOM 12275 N N . TYR C 1 116 ? -39.367 10.835 82.638 1.00 37.21 ? 116 TYR C N 1 +ATOM 12276 C CA . TYR C 1 116 ? -39.268 11.038 81.198 1.00 36.67 ? 116 TYR C CA 1 +ATOM 12277 C C . TYR C 1 116 ? -38.707 9.767 80.591 1.00 36.51 ? 116 TYR C C 1 +ATOM 12278 O O . TYR C 1 116 ? -37.550 9.413 80.814 1.00 38.60 ? 116 TYR C O 1 +ATOM 12279 C CB . TYR C 1 116 ? -38.355 12.217 80.874 1.00 35.97 ? 116 TYR C CB 1 +ATOM 12280 C CG . TYR C 1 116 ? -38.847 13.515 81.460 1.00 37.34 ? 116 TYR C CG 1 +ATOM 12281 C CD1 . TYR C 1 116 ? -38.555 13.857 82.780 1.00 36.71 ? 116 TYR C CD1 1 +ATOM 12282 C CD2 . TYR C 1 116 ? -39.647 14.384 80.709 1.00 37.39 ? 116 TYR C CD2 1 +ATOM 12283 C CE1 . TYR C 1 116 ? -39.048 15.035 83.346 1.00 36.86 ? 116 TYR C CE1 1 +ATOM 12284 C CE2 . TYR C 1 116 ? -40.146 15.568 81.267 1.00 37.52 ? 116 TYR C CE2 1 +ATOM 12285 C CZ . TYR C 1 116 ? -39.841 15.886 82.583 1.00 37.71 ? 116 TYR C CZ 1 +ATOM 12286 O OH . TYR C 1 116 ? -40.321 17.064 83.127 1.00 39.92 ? 116 TYR C OH 1 +ATOM 12287 N N . PHE C 1 117 ? -39.545 9.077 79.832 1.00 35.20 ? 117 PHE C N 1 +ATOM 12288 C CA . PHE C 1 117 ? -39.163 7.830 79.203 1.00 33.50 ? 117 PHE C CA 1 +ATOM 12289 C C . PHE C 1 117 ? -39.239 7.950 77.683 1.00 33.54 ? 117 PHE C C 1 +ATOM 12290 O O . PHE C 1 117 ? -40.305 8.182 77.119 1.00 32.42 ? 117 PHE C O 1 +ATOM 12291 C CB . PHE C 1 117 ? -40.084 6.718 79.719 1.00 32.26 ? 117 PHE C CB 1 +ATOM 12292 C CG . PHE C 1 117 ? -40.006 5.446 78.939 1.00 31.86 ? 117 PHE C CG 1 +ATOM 12293 C CD1 . PHE C 1 117 ? -38.774 4.881 78.615 1.00 30.77 ? 117 PHE C CD1 1 +ATOM 12294 C CD2 . PHE C 1 117 ? -41.173 4.792 78.543 1.00 31.35 ? 117 PHE C CD2 1 +ATOM 12295 C CE1 . PHE C 1 117 ? -38.706 3.682 77.906 1.00 30.96 ? 117 PHE C CE1 1 +ATOM 12296 C CE2 . PHE C 1 117 ? -41.117 3.590 77.835 1.00 30.13 ? 117 PHE C CE2 1 +ATOM 12297 C CZ . PHE C 1 117 ? -39.881 3.034 77.515 1.00 30.88 ? 117 PHE C CZ 1 +ATOM 12298 N N . PHE C 1 118 ? -38.096 7.804 77.022 1.00 33.62 ? 118 PHE C N 1 +ATOM 12299 C CA . PHE C 1 118 ? -38.053 7.886 75.569 1.00 34.18 ? 118 PHE C CA 1 +ATOM 12300 C C . PHE C 1 118 ? -38.009 6.473 75.008 1.00 35.33 ? 118 PHE C C 1 +ATOM 12301 O O . PHE C 1 118 ? -36.999 5.782 75.112 1.00 35.38 ? 118 PHE C O 1 +ATOM 12302 C CB . PHE C 1 118 ? -36.830 8.687 75.128 1.00 32.92 ? 118 PHE C CB 1 +ATOM 12303 C CG . PHE C 1 118 ? -36.815 10.080 75.670 1.00 33.21 ? 118 PHE C CG 1 +ATOM 12304 C CD1 . PHE C 1 118 ? -36.477 10.319 77.001 1.00 32.64 ? 118 PHE C CD1 1 +ATOM 12305 C CD2 . PHE C 1 118 ? -37.221 11.149 74.877 1.00 33.40 ? 118 PHE C CD2 1 +ATOM 12306 C CE1 . PHE C 1 118 ? -36.552 11.601 77.536 1.00 32.34 ? 118 PHE C CE1 1 +ATOM 12307 C CE2 . PHE C 1 118 ? -37.301 12.434 75.402 1.00 33.19 ? 118 PHE C CE2 1 +ATOM 12308 C CZ . PHE C 1 118 ? -36.969 12.661 76.733 1.00 32.87 ? 118 PHE C CZ 1 +ATOM 12309 N N . ASN C 1 119 ? -39.116 6.042 74.412 1.00 36.09 ? 119 ASN C N 1 +ATOM 12310 C CA . ASN C 1 119 ? -39.187 4.692 73.876 1.00 35.83 ? 119 ASN C CA 1 +ATOM 12311 C C . ASN C 1 119 ? -38.500 4.504 72.528 1.00 34.57 ? 119 ASN C C 1 +ATOM 12312 O O . ASN C 1 119 ? -39.141 4.322 71.500 1.00 34.30 ? 119 ASN C O 1 +ATOM 12313 C CB . ASN C 1 119 ? -40.644 4.238 73.806 1.00 36.93 ? 119 ASN C CB 1 +ATOM 12314 C CG . ASN C 1 119 ? -40.778 2.762 73.487 1.00 38.53 ? 119 ASN C CG 1 +ATOM 12315 O OD1 . ASN C 1 119 ? -39.867 1.970 73.750 1.00 37.38 ? 119 ASN C OD1 1 +ATOM 12316 N ND2 . ASN C 1 119 ? -41.926 2.379 72.931 1.00 39.46 ? 119 ASN C ND2 1 +ATOM 12317 N N . SER C 1 120 ? -37.175 4.560 72.552 1.00 34.24 ? 120 SER C N 1 +ATOM 12318 C CA . SER C 1 120 ? -36.360 4.356 71.361 1.00 32.78 ? 120 SER C CA 1 +ATOM 12319 C C . SER C 1 120 ? -35.183 3.485 71.786 1.00 32.94 ? 120 SER C C 1 +ATOM 12320 O O . SER C 1 120 ? -34.549 3.751 72.804 1.00 33.21 ? 120 SER C O 1 +ATOM 12321 C CB . SER C 1 120 ? -35.845 5.679 70.813 1.00 31.79 ? 120 SER C CB 1 +ATOM 12322 O OG . SER C 1 120 ? -34.960 5.451 69.728 1.00 31.51 ? 120 SER C OG 1 +ATOM 12323 N N . ALA C 1 121 ? -34.908 2.435 71.021 1.00 32.60 ? 121 ALA C N 1 +ATOM 12324 C CA . ALA C 1 121 ? -33.809 1.534 71.332 1.00 31.48 ? 121 ALA C CA 1 +ATOM 12325 C C . ALA C 1 121 ? -32.586 1.862 70.481 1.00 31.46 ? 121 ALA C C 1 +ATOM 12326 O O . ALA C 1 121 ? -31.670 1.046 70.346 1.00 31.96 ? 121 ALA C O 1 +ATOM 12327 C CB . ALA C 1 121 ? -34.243 0.093 71.107 1.00 31.06 ? 121 ALA C CB 1 +ATOM 12328 N N . SER C 1 122 ? -32.581 3.056 69.899 1.00 30.89 ? 122 SER C N 1 +ATOM 12329 C CA . SER C 1 122 ? -31.459 3.502 69.078 1.00 32.26 ? 122 SER C CA 1 +ATOM 12330 C C . SER C 1 122 ? -30.416 4.132 70.004 1.00 31.14 ? 122 SER C C 1 +ATOM 12331 O O . SER C 1 122 ? -30.587 4.131 71.220 1.00 29.93 ? 122 SER C O 1 +ATOM 12332 C CB . SER C 1 122 ? -31.926 4.526 68.046 1.00 30.38 ? 122 SER C CB 1 +ATOM 12333 O OG . SER C 1 122 ? -32.421 5.677 68.694 1.00 31.39 ? 122 SER C OG 1 +ATOM 12334 N N . LYS C 1 123 ? -29.344 4.671 69.430 1.00 32.22 ? 123 LYS C N 1 +ATOM 12335 C CA . LYS C 1 123 ? -28.291 5.290 70.238 1.00 32.55 ? 123 LYS C CA 1 +ATOM 12336 C C . LYS C 1 123 ? -28.715 6.662 70.757 1.00 31.30 ? 123 LYS C C 1 +ATOM 12337 O O . LYS C 1 123 ? -28.287 7.692 70.250 1.00 31.53 ? 123 LYS C O 1 +ATOM 12338 C CB . LYS C 1 123 ? -26.994 5.407 69.426 1.00 32.80 ? 123 LYS C CB 1 +ATOM 12339 C CG . LYS C 1 123 ? -25.836 5.968 70.235 1.00 37.98 ? 123 LYS C CG 1 +ATOM 12340 C CD . LYS C 1 123 ? -24.563 6.140 69.410 1.00 39.48 ? 123 LYS C CD 1 +ATOM 12341 C CE . LYS C 1 123 ? -23.884 4.815 69.157 1.00 44.27 ? 123 LYS C CE 1 +ATOM 12342 N NZ . LYS C 1 123 ? -22.533 4.989 68.524 1.00 47.11 ? 123 LYS C NZ 1 +ATOM 12343 N N . VAL C 1 124 ? -29.563 6.661 71.777 1.00 31.73 ? 124 VAL C N 1 +ATOM 12344 C CA . VAL C 1 124 ? -30.062 7.892 72.386 1.00 31.87 ? 124 VAL C CA 1 +ATOM 12345 C C . VAL C 1 124 ? -29.022 8.572 73.274 1.00 31.31 ? 124 VAL C C 1 +ATOM 12346 O O . VAL C 1 124 ? -28.365 7.926 74.077 1.00 30.43 ? 124 VAL C O 1 +ATOM 12347 C CB . VAL C 1 124 ? -31.309 7.606 73.244 1.00 32.87 ? 124 VAL C CB 1 +ATOM 12348 C CG1 . VAL C 1 124 ? -31.760 8.876 73.952 1.00 32.91 ? 124 VAL C CG1 1 +ATOM 12349 C CG2 . VAL C 1 124 ? -32.421 7.054 72.370 1.00 32.11 ? 124 VAL C CG2 1 +ATOM 12350 N N . ILE C 1 125 ? -28.893 9.884 73.128 1.00 33.31 ? 125 ILE C N 1 +ATOM 12351 C CA . ILE C 1 125 ? -27.938 10.658 73.909 1.00 33.45 ? 125 ILE C CA 1 +ATOM 12352 C C . ILE C 1 125 ? -28.639 11.518 74.956 1.00 34.82 ? 125 ILE C C 1 +ATOM 12353 O O . ILE C 1 125 ? -29.547 12.290 74.623 1.00 33.90 ? 125 ILE C O 1 +ATOM 12354 C CB . ILE C 1 125 ? -27.142 11.621 73.028 1.00 34.37 ? 125 ILE C CB 1 +ATOM 12355 C CG1 . ILE C 1 125 ? -26.576 10.878 71.812 1.00 33.15 ? 125 ILE C CG1 1 +ATOM 12356 C CG2 . ILE C 1 125 ? -26.052 12.304 73.867 1.00 31.85 ? 125 ILE C CG2 1 +ATOM 12357 C CD1 . ILE C 1 125 ? -25.651 9.737 72.158 1.00 33.64 ? 125 ILE C CD1 1 +ATOM 12358 N N . PHE C 1 126 ? -28.224 11.379 76.216 1.00 33.91 ? 126 PHE C N 1 +ATOM 12359 C CA . PHE C 1 126 ? -28.781 12.191 77.292 1.00 34.37 ? 126 PHE C CA 1 +ATOM 12360 C C . PHE C 1 126 ? -27.717 13.142 77.786 1.00 34.66 ? 126 PHE C C 1 +ATOM 12361 O O . PHE C 1 126 ? -26.867 12.762 78.588 1.00 35.46 ? 126 PHE C O 1 +ATOM 12362 C CB . PHE C 1 126 ? -29.251 11.341 78.463 1.00 33.24 ? 126 PHE C CB 1 +ATOM 12363 C CG . PHE C 1 126 ? -30.505 10.586 78.190 1.00 34.04 ? 126 PHE C CG 1 +ATOM 12364 C CD1 . PHE C 1 126 ? -30.467 9.357 77.535 1.00 33.59 ? 126 PHE C CD1 1 +ATOM 12365 C CD2 . PHE C 1 126 ? -31.729 11.089 78.606 1.00 34.26 ? 126 PHE C CD2 1 +ATOM 12366 C CE1 . PHE C 1 126 ? -31.632 8.638 77.307 1.00 33.32 ? 126 PHE C CE1 1 +ATOM 12367 C CE2 . PHE C 1 126 ? -32.909 10.372 78.381 1.00 34.00 ? 126 PHE C CE2 1 +ATOM 12368 C CZ . PHE C 1 126 ? -32.861 9.148 77.734 1.00 32.31 ? 126 PHE C CZ 1 +ATOM 12369 N N . ASP C 1 127 ? -27.751 14.372 77.287 1.00 35.82 ? 127 ASP C N 1 +ATOM 12370 C CA . ASP C 1 127 ? -26.785 15.381 77.696 1.00 37.60 ? 127 ASP C CA 1 +ATOM 12371 C C . ASP C 1 127 ? -27.383 16.117 78.898 1.00 37.18 ? 127 ASP C C 1 +ATOM 12372 O O . ASP C 1 127 ? -28.196 17.038 78.751 1.00 36.20 ? 127 ASP C O 1 +ATOM 12373 C CB . ASP C 1 127 ? -26.523 16.342 76.545 1.00 40.46 ? 127 ASP C CB 1 +ATOM 12374 C CG . ASP C 1 127 ? -25.339 17.231 76.805 1.00 45.97 ? 127 ASP C CG 1 +ATOM 12375 O OD1 . ASP C 1 127 ? -25.387 17.999 77.790 1.00 49.54 ? 127 ASP C OD1 1 +ATOM 12376 O OD2 . ASP C 1 127 ? -24.356 17.160 76.034 1.00 49.16 ? 127 ASP C OD2 1 +ATOM 12377 N N . VAL C 1 128 ? -26.979 15.695 80.092 1.00 35.32 ? 128 VAL C N 1 +ATOM 12378 C CA . VAL C 1 128 ? -27.508 16.267 81.316 1.00 33.10 ? 128 VAL C CA 1 +ATOM 12379 C C . VAL C 1 128 ? -26.689 17.424 81.875 1.00 34.20 ? 128 VAL C C 1 +ATOM 12380 O O . VAL C 1 128 ? -25.826 17.235 82.731 1.00 34.76 ? 128 VAL C O 1 +ATOM 12381 C CB . VAL C 1 128 ? -27.643 15.171 82.386 1.00 33.07 ? 128 VAL C CB 1 +ATOM 12382 C CG1 . VAL C 1 128 ? -28.414 15.694 83.588 1.00 32.40 ? 128 VAL C CG1 1 +ATOM 12383 C CG2 . VAL C 1 128 ? -28.331 13.956 81.791 1.00 30.84 ? 128 VAL C CG2 1 +ATOM 12384 N N . GLY C 1 129 ? -26.976 18.625 81.384 1.00 35.64 ? 129 GLY C N 1 +ATOM 12385 C CA . GLY C 1 129 ? -26.296 19.818 81.857 1.00 36.29 ? 129 GLY C CA 1 +ATOM 12386 C C . GLY C 1 129 ? -24.826 19.880 81.527 1.00 36.37 ? 129 GLY C C 1 +ATOM 12387 O O . GLY C 1 129 ? -24.041 20.397 82.316 1.00 37.06 ? 129 GLY C O 1 +ATOM 12388 N N . LEU C 1 130 ? -24.459 19.364 80.358 1.00 37.35 ? 130 LEU C N 1 +ATOM 12389 C CA . LEU C 1 130 ? -23.068 19.340 79.908 1.00 38.30 ? 130 LEU C CA 1 +ATOM 12390 C C . LEU C 1 130 ? -22.900 20.283 78.723 1.00 38.24 ? 130 LEU C C 1 +ATOM 12391 O O . LEU C 1 130 ? -22.060 21.182 78.749 1.00 38.13 ? 130 LEU C O 1 +ATOM 12392 C CB . LEU C 1 130 ? -22.675 17.900 79.526 1.00 37.33 ? 130 LEU C CB 1 +ATOM 12393 C CG . LEU C 1 130 ? -21.209 17.443 79.426 1.00 37.95 ? 130 LEU C CG 1 +ATOM 12394 C CD1 . LEU C 1 130 ? -20.733 17.515 77.999 1.00 37.62 ? 130 LEU C CD1 1 +ATOM 12395 C CD2 . LEU C 1 130 ? -20.342 18.264 80.350 1.00 36.66 ? 130 LEU C CD2 1 +ATOM 12396 N N . GLU C 1 131 ? -23.704 20.078 77.685 1.00 39.34 ? 131 GLU C N 1 +ATOM 12397 C CA . GLU C 1 131 ? -23.654 20.937 76.510 1.00 41.50 ? 131 GLU C CA 1 +ATOM 12398 C C . GLU C 1 131 ? -24.107 22.332 76.965 1.00 41.49 ? 131 GLU C C 1 +ATOM 12399 O O . GLU C 1 131 ? -23.480 23.347 76.652 1.00 40.42 ? 131 GLU C O 1 +ATOM 12400 C CB . GLU C 1 131 ? -24.591 20.399 75.433 1.00 43.46 ? 131 GLU C CB 1 +ATOM 12401 C CG . GLU C 1 131 ? -24.473 21.118 74.104 1.00 48.99 ? 131 GLU C CG 1 +ATOM 12402 C CD . GLU C 1 131 ? -25.494 20.627 73.094 1.00 52.43 ? 131 GLU C CD 1 +ATOM 12403 O OE1 . GLU C 1 131 ? -25.555 19.400 72.854 1.00 54.66 ? 131 GLU C OE1 1 +ATOM 12404 O OE2 . GLU C 1 131 ? -26.238 21.465 72.540 1.00 54.64 ? 131 GLU C OE2 1 +ATOM 12405 N N . GLU C 1 132 ? -25.211 22.367 77.704 1.00 40.54 ? 132 GLU C N 1 +ATOM 12406 C CA . GLU C 1 132 ? -25.729 23.610 78.250 1.00 40.03 ? 132 GLU C CA 1 +ATOM 12407 C C . GLU C 1 132 ? -25.940 23.361 79.736 1.00 39.13 ? 132 GLU C C 1 +ATOM 12408 O O . GLU C 1 132 ? -26.777 22.547 80.124 1.00 38.97 ? 132 GLU C O 1 +ATOM 12409 C CB . GLU C 1 132 ? -27.052 24.005 77.578 1.00 42.10 ? 132 GLU C CB 1 +ATOM 12410 C CG . GLU C 1 132 ? -26.935 24.449 76.109 1.00 43.87 ? 132 GLU C CG 1 +ATOM 12411 C CD . GLU C 1 132 ? -25.925 25.584 75.883 1.00 47.73 ? 132 GLU C CD 1 +ATOM 12412 O OE1 . GLU C 1 132 ? -25.877 26.534 76.701 1.00 49.78 ? 132 GLU C OE1 1 +ATOM 12413 O OE2 . GLU C 1 132 ? -25.182 25.535 74.874 1.00 47.20 ? 132 GLU C OE2 1 +ATOM 12414 N N . TYR C 1 133 ? -25.157 24.057 80.557 1.00 37.99 ? 133 TYR C N 1 +ATOM 12415 C CA . TYR C 1 133 ? -25.201 23.935 82.012 1.00 37.17 ? 133 TYR C CA 1 +ATOM 12416 C C . TYR C 1 133 ? -26.615 23.958 82.620 1.00 36.48 ? 133 TYR C C 1 +ATOM 12417 O O . TYR C 1 133 ? -26.876 23.316 83.638 1.00 34.89 ? 133 TYR C O 1 +ATOM 12418 C CB . TYR C 1 133 ? -24.367 25.062 82.629 1.00 37.34 ? 133 TYR C CB 1 +ATOM 12419 C CG . TYR C 1 133 ? -24.088 24.917 84.109 1.00 37.85 ? 133 TYR C CG 1 +ATOM 12420 C CD1 . TYR C 1 133 ? -23.058 24.098 84.564 1.00 39.10 ? 133 TYR C CD1 1 +ATOM 12421 C CD2 . TYR C 1 133 ? -24.849 25.600 85.052 1.00 37.69 ? 133 TYR C CD2 1 +ATOM 12422 C CE1 . TYR C 1 133 ? -22.787 23.964 85.931 1.00 39.25 ? 133 TYR C CE1 1 +ATOM 12423 C CE2 . TYR C 1 133 ? -24.589 25.472 86.418 1.00 40.05 ? 133 TYR C CE2 1 +ATOM 12424 C CZ . TYR C 1 133 ? -23.555 24.653 86.849 1.00 40.08 ? 133 TYR C CZ 1 +ATOM 12425 O OH . TYR C 1 133 ? -23.283 24.528 88.198 1.00 43.83 ? 133 TYR C OH 1 +ATOM 12426 N N . ASP C 1 134 ? -27.523 24.689 81.991 1.00 36.46 ? 134 ASP C N 1 +ATOM 12427 C CA . ASP C 1 134 ? -28.883 24.816 82.506 1.00 38.58 ? 134 ASP C CA 1 +ATOM 12428 C C . ASP C 1 134 ? -29.926 24.056 81.692 1.00 38.53 ? 134 ASP C C 1 +ATOM 12429 O O . ASP C 1 134 ? -31.107 24.413 81.689 1.00 36.94 ? 134 ASP C O 1 +ATOM 12430 C CB . ASP C 1 134 ? -29.259 26.293 82.555 1.00 41.01 ? 134 ASP C CB 1 +ATOM 12431 C CG . ASP C 1 134 ? -29.331 26.920 81.164 1.00 46.22 ? 134 ASP C CG 1 +ATOM 12432 O OD1 . ASP C 1 134 ? -28.514 26.539 80.293 1.00 47.42 ? 134 ASP C OD1 1 +ATOM 12433 O OD2 . ASP C 1 134 ? -30.195 27.801 80.936 1.00 48.10 ? 134 ASP C OD2 1 +ATOM 12434 N N . LYS C 1 135 ? -29.496 23.004 81.007 1.00 37.78 ? 135 LYS C N 1 +ATOM 12435 C CA . LYS C 1 135 ? -30.420 22.218 80.207 1.00 38.47 ? 135 LYS C CA 1 +ATOM 12436 C C . LYS C 1 135 ? -30.130 20.737 80.165 1.00 37.34 ? 135 LYS C C 1 +ATOM 12437 O O . LYS C 1 135 ? -28.996 20.293 80.352 1.00 36.59 ? 135 LYS C O 1 +ATOM 12438 C CB . LYS C 1 135 ? -30.438 22.724 78.764 1.00 41.39 ? 135 LYS C CB 1 +ATOM 12439 C CG . LYS C 1 135 ? -31.245 23.981 78.540 1.00 43.91 ? 135 LYS C CG 1 +ATOM 12440 C CD . LYS C 1 135 ? -31.057 24.491 77.130 1.00 48.03 ? 135 LYS C CD 1 +ATOM 12441 C CE . LYS C 1 135 ? -32.062 25.590 76.829 1.00 52.37 ? 135 LYS C CE 1 +ATOM 12442 N NZ . LYS C 1 135 ? -32.191 26.527 77.988 1.00 54.56 ? 135 LYS C NZ 1 +ATOM 12443 N N . VAL C 1 136 ? -31.190 19.979 79.920 1.00 36.16 ? 136 VAL C N 1 +ATOM 12444 C CA . VAL C 1 136 ? -31.094 18.542 79.754 1.00 33.52 ? 136 VAL C CA 1 +ATOM 12445 C C . VAL C 1 136 ? -31.514 18.388 78.300 1.00 33.49 ? 136 VAL C C 1 +ATOM 12446 O O . VAL C 1 136 ? -32.653 18.672 77.950 1.00 33.52 ? 136 VAL C O 1 +ATOM 12447 C CB . VAL C 1 136 ? -32.091 17.783 80.625 1.00 32.51 ? 136 VAL C CB 1 +ATOM 12448 C CG1 . VAL C 1 136 ? -31.986 16.292 80.333 1.00 33.68 ? 136 VAL C CG1 1 +ATOM 12449 C CG2 . VAL C 1 136 ? -31.819 18.053 82.095 1.00 31.46 ? 136 VAL C CG2 1 +ATOM 12450 N N . ILE C 1 137 ? -30.588 17.975 77.450 1.00 33.03 ? 137 ILE C N 1 +ATOM 12451 C CA . ILE C 1 137 ? -30.883 17.803 76.040 1.00 32.60 ? 137 ILE C CA 1 +ATOM 12452 C C . ILE C 1 137 ? -30.852 16.324 75.665 1.00 33.24 ? 137 ILE C C 1 +ATOM 12453 O O . ILE C 1 137 ? -29.859 15.639 75.883 1.00 34.28 ? 137 ILE C O 1 +ATOM 12454 C CB . ILE C 1 137 ? -29.864 18.573 75.185 1.00 33.41 ? 137 ILE C CB 1 +ATOM 12455 C CG1 . ILE C 1 137 ? -29.855 20.047 75.611 1.00 33.66 ? 137 ILE C CG1 1 +ATOM 12456 C CG2 . ILE C 1 137 ? -30.215 18.457 73.711 1.00 30.88 ? 137 ILE C CG2 1 +ATOM 12457 C CD1 . ILE C 1 137 ? -28.767 20.877 74.951 1.00 34.70 ? 137 ILE C CD1 1 +ATOM 12458 N N . VAL C 1 138 ? -31.956 15.832 75.114 1.00 33.40 ? 138 VAL C N 1 +ATOM 12459 C CA . VAL C 1 138 ? -32.042 14.441 74.709 1.00 32.84 ? 138 VAL C CA 1 +ATOM 12460 C C . VAL C 1 138 ? -32.102 14.377 73.194 1.00 33.61 ? 138 VAL C C 1 +ATOM 12461 O O . VAL C 1 138 ? -32.966 14.992 72.580 1.00 34.15 ? 138 VAL C O 1 +ATOM 12462 C CB . VAL C 1 138 ? -33.292 13.774 75.287 1.00 32.89 ? 138 VAL C CB 1 +ATOM 12463 C CG1 . VAL C 1 138 ? -33.367 12.319 74.834 1.00 32.92 ? 138 VAL C CG1 1 +ATOM 12464 C CG2 . VAL C 1 138 ? -33.254 13.841 76.800 1.00 33.22 ? 138 VAL C CG2 1 +ATOM 12465 N N . THR C 1 139 ? -31.171 13.643 72.593 1.00 34.24 ? 139 THR C N 1 +ATOM 12466 C CA . THR C 1 139 ? -31.127 13.499 71.147 1.00 34.65 ? 139 THR C CA 1 +ATOM 12467 C C . THR C 1 139 ? -31.436 12.056 70.748 1.00 35.39 ? 139 THR C C 1 +ATOM 12468 O O . THR C 1 139 ? -30.741 11.130 71.170 1.00 34.10 ? 139 THR C O 1 +ATOM 12469 C CB . THR C 1 139 ? -29.732 13.849 70.598 1.00 36.01 ? 139 THR C CB 1 +ATOM 12470 O OG1 . THR C 1 139 ? -29.340 15.135 71.082 1.00 37.17 ? 139 THR C OG1 1 +ATOM 12471 C CG2 . THR C 1 139 ? -29.741 13.863 69.069 1.00 35.84 ? 139 THR C CG2 1 +ATOM 12472 N N . ILE C 1 140 ? -32.487 11.868 69.951 1.00 36.21 ? 140 ILE C N 1 +ATOM 12473 C CA . ILE C 1 140 ? -32.857 10.542 69.466 1.00 36.32 ? 140 ILE C CA 1 +ATOM 12474 C C . ILE C 1 140 ? -32.492 10.499 67.990 1.00 37.58 ? 140 ILE C C 1 +ATOM 12475 O O . ILE C 1 140 ? -33.012 11.275 67.195 1.00 36.16 ? 140 ILE C O 1 +ATOM 12476 C CB . ILE C 1 140 ? -34.370 10.263 69.611 1.00 37.12 ? 140 ILE C CB 1 +ATOM 12477 C CG1 . ILE C 1 140 ? -34.786 10.354 71.081 1.00 36.73 ? 140 ILE C CG1 1 +ATOM 12478 C CG2 . ILE C 1 140 ? -34.698 8.866 69.072 1.00 36.01 ? 140 ILE C CG2 1 +ATOM 12479 C CD1 . ILE C 1 140 ? -34.986 11.768 71.567 1.00 37.68 ? 140 ILE C CD1 1 +ATOM 12480 N N . PRO C 1 141 ? -31.577 9.596 67.604 1.00 39.34 ? 141 PRO C N 1 +ATOM 12481 C CA . PRO C 1 141 ? -31.162 9.489 66.201 1.00 40.48 ? 141 PRO C CA 1 +ATOM 12482 C C . PRO C 1 141 ? -32.214 8.866 65.270 1.00 42.05 ? 141 PRO C C 1 +ATOM 12483 O O . PRO C 1 141 ? -31.939 7.893 64.569 1.00 42.34 ? 141 PRO C O 1 +ATOM 12484 C CB . PRO C 1 141 ? -29.887 8.657 66.292 1.00 37.91 ? 141 PRO C CB 1 +ATOM 12485 C CG . PRO C 1 141 ? -30.198 7.717 67.411 1.00 38.75 ? 141 PRO C CG 1 +ATOM 12486 C CD . PRO C 1 141 ? -30.841 8.636 68.446 1.00 38.49 ? 141 PRO C CD 1 +ATOM 12487 N N . GLU C 1 142 ? -33.417 9.430 65.283 1.00 44.11 ? 142 GLU C N 1 +ATOM 12488 C CA . GLU C 1 142 ? -34.517 8.977 64.432 1.00 46.79 ? 142 GLU C CA 1 +ATOM 12489 C C . GLU C 1 142 ? -35.361 10.206 64.107 1.00 47.64 ? 142 GLU C C 1 +ATOM 12490 O O . GLU C 1 142 ? -35.342 11.182 64.861 1.00 46.71 ? 142 GLU C O 1 +ATOM 12491 C CB . GLU C 1 142 ? -35.379 7.941 65.152 1.00 47.13 ? 142 GLU C CB 1 +ATOM 12492 C CG . GLU C 1 142 ? -34.601 6.771 65.708 1.00 53.27 ? 142 GLU C CG 1 +ATOM 12493 C CD . GLU C 1 142 ? -35.490 5.585 66.063 1.00 56.91 ? 142 GLU C CD 1 +ATOM 12494 O OE1 . GLU C 1 142 ? -35.962 4.887 65.135 1.00 58.36 ? 142 GLU C OE1 1 +ATOM 12495 O OE2 . GLU C 1 142 ? -35.722 5.348 67.270 1.00 59.73 ? 142 GLU C OE2 1 +ATOM 12496 N N . ASP C 1 143 ? -36.095 10.169 62.996 1.00 48.83 ? 143 ASP C N 1 +ATOM 12497 C CA . ASP C 1 143 ? -36.924 11.311 62.610 1.00 50.47 ? 143 ASP C CA 1 +ATOM 12498 C C . ASP C 1 143 ? -38.220 11.388 63.411 1.00 49.16 ? 143 ASP C C 1 +ATOM 12499 O O . ASP C 1 143 ? -38.852 12.437 63.479 1.00 50.48 ? 143 ASP C O 1 +ATOM 12500 C CB . ASP C 1 143 ? -37.245 11.281 61.103 1.00 53.87 ? 143 ASP C CB 1 +ATOM 12501 C CG . ASP C 1 143 ? -37.948 9.995 60.667 1.00 57.43 ? 143 ASP C CG 1 +ATOM 12502 O OD1 . ASP C 1 143 ? -38.977 9.624 61.273 1.00 58.03 ? 143 ASP C OD1 1 +ATOM 12503 O OD2 . ASP C 1 143 ? -37.471 9.354 59.703 1.00 60.77 ? 143 ASP C OD2 1 +ATOM 12504 N N . SER C 1 144 ? -38.609 10.275 64.017 1.00 47.93 ? 144 SER C N 1 +ATOM 12505 C CA . SER C 1 144 ? -39.828 10.218 64.817 1.00 47.46 ? 144 SER C CA 1 +ATOM 12506 C C . SER C 1 144 ? -39.532 9.545 66.145 1.00 45.93 ? 144 SER C C 1 +ATOM 12507 O O . SER C 1 144 ? -38.561 8.801 66.267 1.00 47.20 ? 144 SER C O 1 +ATOM 12508 C CB . SER C 1 144 ? -40.913 9.420 64.087 1.00 47.75 ? 144 SER C CB 1 +ATOM 12509 O OG . SER C 1 144 ? -41.311 10.072 62.895 1.00 51.05 ? 144 SER C OG 1 +ATOM 12510 N N . VAL C 1 145 ? -40.373 9.790 67.139 1.00 43.35 ? 145 VAL C N 1 +ATOM 12511 C CA . VAL C 1 145 ? -40.167 9.175 68.429 1.00 41.66 ? 145 VAL C CA 1 +ATOM 12512 C C . VAL C 1 145 ? -41.347 9.394 69.349 1.00 41.48 ? 145 VAL C C 1 +ATOM 12513 O O . VAL C 1 145 ? -42.081 10.364 69.212 1.00 40.73 ? 145 VAL C O 1 +ATOM 12514 C CB . VAL C 1 145 ? -38.890 9.733 69.121 1.00 42.30 ? 145 VAL C CB 1 +ATOM 12515 C CG1 . VAL C 1 145 ? -39.095 11.188 69.509 1.00 41.35 ? 145 VAL C CG1 1 +ATOM 12516 C CG2 . VAL C 1 145 ? -38.548 8.900 70.353 1.00 42.21 ? 145 VAL C CG2 1 +ATOM 12517 N N . GLU C 1 146 ? -41.534 8.468 70.280 1.00 42.11 ? 146 GLU C N 1 +ATOM 12518 C CA . GLU C 1 146 ? -42.597 8.594 71.259 1.00 42.26 ? 146 GLU C CA 1 +ATOM 12519 C C . GLU C 1 146 ? -41.948 8.527 72.633 1.00 40.76 ? 146 GLU C C 1 +ATOM 12520 O O . GLU C 1 146 ? -41.155 7.629 72.909 1.00 40.32 ? 146 GLU C O 1 +ATOM 12521 C CB . GLU C 1 146 ? -43.646 7.473 71.118 1.00 42.62 ? 146 GLU C CB 1 +ATOM 12522 C CG . GLU C 1 146 ? -43.117 6.057 71.298 1.00 47.93 ? 146 GLU C CG 1 +ATOM 12523 C CD . GLU C 1 146 ? -44.232 5.014 71.423 1.00 51.53 ? 146 GLU C CD 1 +ATOM 12524 O OE1 . GLU C 1 146 ? -45.163 5.039 70.581 1.00 52.41 ? 146 GLU C OE1 1 +ATOM 12525 O OE2 . GLU C 1 146 ? -44.172 4.166 72.355 1.00 51.08 ? 146 GLU C OE2 1 +ATOM 12526 N N . PHE C 1 147 ? -42.247 9.504 73.479 1.00 39.10 ? 147 PHE C N 1 +ATOM 12527 C CA . PHE C 1 147 ? -41.722 9.477 74.827 1.00 39.27 ? 147 PHE C CA 1 +ATOM 12528 C C . PHE C 1 147 ? -42.864 9.781 75.777 1.00 39.03 ? 147 PHE C C 1 +ATOM 12529 O O . PHE C 1 147 ? -43.920 10.226 75.347 1.00 39.54 ? 147 PHE C O 1 +ATOM 12530 C CB . PHE C 1 147 ? -40.542 10.446 75.017 1.00 38.28 ? 147 PHE C CB 1 +ATOM 12531 C CG . PHE C 1 147 ? -40.870 11.887 74.788 1.00 37.84 ? 147 PHE C CG 1 +ATOM 12532 C CD1 . PHE C 1 147 ? -40.934 12.405 73.506 1.00 38.40 ? 147 PHE C CD1 1 +ATOM 12533 C CD2 . PHE C 1 147 ? -41.052 12.746 75.865 1.00 38.90 ? 147 PHE C CD2 1 +ATOM 12534 C CE1 . PHE C 1 147 ? -41.169 13.769 73.296 1.00 39.09 ? 147 PHE C CE1 1 +ATOM 12535 C CE2 . PHE C 1 147 ? -41.289 14.104 75.671 1.00 38.62 ? 147 PHE C CE2 1 +ATOM 12536 C CZ . PHE C 1 147 ? -41.346 14.619 74.384 1.00 38.79 ? 147 PHE C CZ 1 +ATOM 12537 N N . TYR C 1 148 ? -42.665 9.517 77.061 1.00 38.61 ? 148 TYR C N 1 +ATOM 12538 C CA . TYR C 1 148 ? -43.711 9.746 78.039 1.00 37.54 ? 148 TYR C CA 1 +ATOM 12539 C C . TYR C 1 148 ? -43.258 10.632 79.185 1.00 37.97 ? 148 TYR C C 1 +ATOM 12540 O O . TYR C 1 148 ? -42.113 10.556 79.630 1.00 38.11 ? 148 TYR C O 1 +ATOM 12541 C CB . TYR C 1 148 ? -44.188 8.413 78.623 1.00 37.47 ? 148 TYR C CB 1 +ATOM 12542 C CG . TYR C 1 148 ? -44.564 7.368 77.595 1.00 37.78 ? 148 TYR C CG 1 +ATOM 12543 C CD1 . TYR C 1 148 ? -43.594 6.786 76.769 1.00 37.22 ? 148 TYR C CD1 1 +ATOM 12544 C CD2 . TYR C 1 148 ? -45.892 6.965 77.442 1.00 35.65 ? 148 TYR C CD2 1 +ATOM 12545 C CE1 . TYR C 1 148 ? -43.941 5.831 75.821 1.00 37.93 ? 148 TYR C CE1 1 +ATOM 12546 C CE2 . TYR C 1 148 ? -46.252 6.018 76.498 1.00 36.14 ? 148 TYR C CE2 1 +ATOM 12547 C CZ . TYR C 1 148 ? -45.275 5.452 75.689 1.00 38.87 ? 148 TYR C CZ 1 +ATOM 12548 O OH . TYR C 1 148 ? -45.624 4.511 74.748 1.00 39.75 ? 148 TYR C OH 1 +ATOM 12549 N N . VAL C 1 149 ? -44.165 11.478 79.657 1.00 37.25 ? 149 VAL C N 1 +ATOM 12550 C CA . VAL C 1 149 ? -43.877 12.328 80.790 1.00 37.21 ? 149 VAL C CA 1 +ATOM 12551 C C . VAL C 1 149 ? -44.725 11.693 81.873 1.00 38.11 ? 149 VAL C C 1 +ATOM 12552 O O . VAL C 1 149 ? -45.950 11.608 81.745 1.00 37.66 ? 149 VAL C O 1 +ATOM 12553 C CB . VAL C 1 149 ? -44.304 13.773 80.534 1.00 37.01 ? 149 VAL C CB 1 +ATOM 12554 C CG1 . VAL C 1 149 ? -43.919 14.652 81.736 1.00 35.95 ? 149 VAL C CG1 1 +ATOM 12555 C CG2 . VAL C 1 149 ? -43.631 14.278 79.265 1.00 34.40 ? 149 VAL C CG2 1 +ATOM 12556 N N . ILE C 1 150 ? -44.065 11.220 82.924 1.00 38.77 ? 150 ILE C N 1 +ATOM 12557 C CA . ILE C 1 150 ? -44.750 10.533 84.012 1.00 40.75 ? 150 ILE C CA 1 +ATOM 12558 C C . ILE C 1 150 ? -44.781 11.346 85.302 1.00 42.97 ? 150 ILE C C 1 +ATOM 12559 O O . ILE C 1 150 ? -43.753 11.538 85.952 1.00 44.09 ? 150 ILE C O 1 +ATOM 12560 C CB . ILE C 1 150 ? -44.067 9.179 84.268 1.00 39.70 ? 150 ILE C CB 1 +ATOM 12561 C CG1 . ILE C 1 150 ? -43.866 8.456 82.928 1.00 39.03 ? 150 ILE C CG1 1 +ATOM 12562 C CG2 . ILE C 1 150 ? -44.895 8.341 85.216 1.00 37.98 ? 150 ILE C CG2 1 +ATOM 12563 C CD1 . ILE C 1 150 ? -43.004 7.202 83.005 1.00 37.86 ? 150 ILE C CD1 1 +ATOM 12564 N N . GLU C 1 151 ? -45.968 11.818 85.671 1.00 44.66 ? 151 GLU C N 1 +ATOM 12565 C CA . GLU C 1 151 ? -46.133 12.611 86.875 1.00 45.64 ? 151 GLU C CA 1 +ATOM 12566 C C . GLU C 1 151 ? -45.892 11.784 88.128 1.00 45.66 ? 151 GLU C C 1 +ATOM 12567 O O . GLU C 1 151 ? -46.094 10.563 88.139 1.00 44.94 ? 151 GLU C O 1 +ATOM 12568 C CB . GLU C 1 151 ? -47.539 13.212 86.925 1.00 49.75 ? 151 GLU C CB 1 +ATOM 12569 C CG . GLU C 1 151 ? -47.856 14.178 85.791 1.00 56.06 ? 151 GLU C CG 1 +ATOM 12570 C CD . GLU C 1 151 ? -46.810 15.282 85.641 1.00 60.96 ? 151 GLU C CD 1 +ATOM 12571 O OE1 . GLU C 1 151 ? -46.519 15.984 86.637 1.00 64.61 ? 151 GLU C OE1 1 +ATOM 12572 O OE2 . GLU C 1 151 ? -46.281 15.452 84.521 1.00 63.57 ? 151 GLU C OE2 1 +ATOM 12573 N N . GLY C 1 152 ? -45.457 12.466 89.184 1.00 44.50 ? 152 GLY C N 1 +ATOM 12574 C CA . GLY C 1 152 ? -45.192 11.801 90.442 1.00 43.58 ? 152 GLY C CA 1 +ATOM 12575 C C . GLY C 1 152 ? -46.352 11.954 91.407 1.00 43.47 ? 152 GLY C C 1 +ATOM 12576 O O . GLY C 1 152 ? -47.390 11.319 91.223 1.00 44.65 ? 152 GLY C O 1 +ATOM 12577 N N . PRO C 1 153 ? -46.216 12.793 92.447 1.00 42.26 ? 153 PRO C N 1 +ATOM 12578 C CA . PRO C 1 153 ? -45.025 13.597 92.746 1.00 40.80 ? 153 PRO C CA 1 +ATOM 12579 C C . PRO C 1 153 ? -43.909 12.819 93.452 1.00 39.55 ? 153 PRO C C 1 +ATOM 12580 O O . PRO C 1 153 ? -42.781 13.288 93.524 1.00 40.01 ? 153 PRO C O 1 +ATOM 12581 C CB . PRO C 1 153 ? -45.585 14.720 93.611 1.00 40.46 ? 153 PRO C CB 1 +ATOM 12582 C CG . PRO C 1 153 ? -46.627 14.005 94.413 1.00 40.43 ? 153 PRO C CG 1 +ATOM 12583 C CD . PRO C 1 153 ? -47.320 13.135 93.364 1.00 40.96 ? 153 PRO C CD 1 +ATOM 12584 N N . ARG C 1 154 ? -44.220 11.644 93.984 1.00 38.75 ? 154 ARG C N 1 +ATOM 12585 C CA . ARG C 1 154 ? -43.192 10.850 94.653 1.00 39.56 ? 154 ARG C CA 1 +ATOM 12586 C C . ARG C 1 154 ? -42.445 10.010 93.623 1.00 38.01 ? 154 ARG C C 1 +ATOM 12587 O O . ARG C 1 154 ? -43.014 9.634 92.608 1.00 37.78 ? 154 ARG C O 1 +ATOM 12588 C CB . ARG C 1 154 ? -43.808 9.918 95.694 1.00 40.92 ? 154 ARG C CB 1 +ATOM 12589 C CG . ARG C 1 154 ? -44.547 10.601 96.822 1.00 43.02 ? 154 ARG C CG 1 +ATOM 12590 C CD . ARG C 1 154 ? -44.978 9.554 97.828 1.00 46.03 ? 154 ARG C CD 1 +ATOM 12591 N NE . ARG C 1 154 ? -45.744 8.480 97.191 1.00 49.40 ? 154 ARG C NE 1 +ATOM 12592 C CZ . ARG C 1 154 ? -45.686 7.201 97.557 1.00 49.90 ? 154 ARG C CZ 1 +ATOM 12593 N NH1 . ARG C 1 154 ? -44.892 6.834 98.558 1.00 50.11 ? 154 ARG C NH1 1 +ATOM 12594 N NH2 . ARG C 1 154 ? -46.417 6.290 96.920 1.00 48.99 ? 154 ARG C NH2 1 +ATOM 12595 N N . ILE C 1 155 ? -41.172 9.720 93.881 1.00 37.15 ? 155 ILE C N 1 +ATOM 12596 C CA . ILE C 1 155 ? -40.389 8.912 92.955 1.00 36.24 ? 155 ILE C CA 1 +ATOM 12597 C C . ILE C 1 155 ? -41.098 7.565 92.798 1.00 36.51 ? 155 ILE C C 1 +ATOM 12598 O O . ILE C 1 155 ? -41.165 7.010 91.702 1.00 36.00 ? 155 ILE C O 1 +ATOM 12599 C CB . ILE C 1 155 ? -38.937 8.699 93.476 1.00 35.97 ? 155 ILE C CB 1 +ATOM 12600 C CG1 . ILE C 1 155 ? -38.188 10.031 93.471 1.00 35.44 ? 155 ILE C CG1 1 +ATOM 12601 C CG2 . ILE C 1 155 ? -38.212 7.678 92.619 1.00 33.80 ? 155 ILE C CG2 1 +ATOM 12602 C CD1 . ILE C 1 155 ? -36.820 9.974 94.120 1.00 37.19 ? 155 ILE C CD1 1 +ATOM 12603 N N . GLU C 1 156 ? -41.648 7.056 93.897 1.00 37.84 ? 156 GLU C N 1 +ATOM 12604 C CA . GLU C 1 156 ? -42.359 5.786 93.868 1.00 39.24 ? 156 GLU C CA 1 +ATOM 12605 C C . GLU C 1 156 ? -43.577 5.863 92.944 1.00 39.51 ? 156 GLU C C 1 +ATOM 12606 O O . GLU C 1 156 ? -43.936 4.876 92.304 1.00 38.80 ? 156 GLU C O 1 +ATOM 12607 C CB . GLU C 1 156 ? -42.803 5.379 95.274 1.00 40.13 ? 156 GLU C CB 1 +ATOM 12608 C CG . GLU C 1 156 ? -43.430 3.993 95.323 1.00 43.91 ? 156 GLU C CG 1 +ATOM 12609 C CD . GLU C 1 156 ? -43.596 3.461 96.740 1.00 46.42 ? 156 GLU C CD 1 +ATOM 12610 O OE1 . GLU C 1 156 ? -44.521 3.921 97.464 1.00 46.66 ? 156 GLU C OE1 1 +ATOM 12611 O OE2 . GLU C 1 156 ? -42.788 2.585 97.129 1.00 47.05 ? 156 GLU C OE2 1 +ATOM 12612 N N . ASP C 1 157 ? -44.211 7.030 92.869 1.00 39.99 ? 157 ASP C N 1 +ATOM 12613 C CA . ASP C 1 157 ? -45.380 7.199 92.000 1.00 40.56 ? 157 ASP C CA 1 +ATOM 12614 C C . ASP C 1 157 ? -44.952 7.103 90.534 1.00 39.74 ? 157 ASP C C 1 +ATOM 12615 O O . ASP C 1 157 ? -45.651 6.518 89.703 1.00 39.04 ? 157 ASP C O 1 +ATOM 12616 C CB . ASP C 1 157 ? -46.066 8.550 92.253 1.00 41.77 ? 157 ASP C CB 1 +ATOM 12617 C CG . ASP C 1 157 ? -46.485 8.736 93.708 1.00 44.34 ? 157 ASP C CG 1 +ATOM 12618 O OD1 . ASP C 1 157 ? -47.062 7.790 94.286 1.00 45.92 ? 157 ASP C OD1 1 +ATOM 12619 O OD2 . ASP C 1 157 ? -46.247 9.829 94.270 1.00 45.10 ? 157 ASP C OD2 1 +ATOM 12620 N N . VAL C 1 158 ? -43.794 7.672 90.221 1.00 38.31 ? 158 VAL C N 1 +ATOM 12621 C CA . VAL C 1 158 ? -43.282 7.625 88.863 1.00 37.51 ? 158 VAL C CA 1 +ATOM 12622 C C . VAL C 1 158 ? -42.996 6.179 88.469 1.00 37.89 ? 158 VAL C C 1 +ATOM 12623 O O . VAL C 1 158 ? -43.382 5.734 87.390 1.00 38.31 ? 158 VAL C O 1 +ATOM 12624 C CB . VAL C 1 158 ? -41.977 8.450 88.723 1.00 37.99 ? 158 VAL C CB 1 +ATOM 12625 C CG1 . VAL C 1 158 ? -41.404 8.293 87.314 1.00 37.96 ? 158 VAL C CG1 1 +ATOM 12626 C CG2 . VAL C 1 158 ? -42.251 9.910 89.010 1.00 36.22 ? 158 VAL C CG2 1 +ATOM 12627 N N . LEU C 1 159 ? -42.329 5.438 89.349 1.00 38.28 ? 159 LEU C N 1 +ATOM 12628 C CA . LEU C 1 159 ? -41.993 4.053 89.045 1.00 38.87 ? 159 LEU C CA 1 +ATOM 12629 C C . LEU C 1 159 ? -43.205 3.129 88.916 1.00 39.16 ? 159 LEU C C 1 +ATOM 12630 O O . LEU C 1 159 ? -43.180 2.177 88.134 1.00 38.12 ? 159 LEU C O 1 +ATOM 12631 C CB . LEU C 1 159 ? -41.011 3.510 90.083 1.00 39.44 ? 159 LEU C CB 1 +ATOM 12632 C CG . LEU C 1 159 ? -39.620 4.157 89.988 1.00 40.63 ? 159 LEU C CG 1 +ATOM 12633 C CD1 . LEU C 1 159 ? -38.681 3.550 91.012 1.00 42.02 ? 159 LEU C CD1 1 +ATOM 12634 C CD2 . LEU C 1 159 ? -39.056 3.945 88.600 1.00 40.90 ? 159 LEU C CD2 1 +ATOM 12635 N N . GLU C 1 160 ? -44.260 3.396 89.682 1.00 39.33 ? 160 GLU C N 1 +ATOM 12636 C CA . GLU C 1 160 ? -45.460 2.577 89.593 1.00 39.37 ? 160 GLU C CA 1 +ATOM 12637 C C . GLU C 1 160 ? -46.068 2.782 88.211 1.00 38.21 ? 160 GLU C C 1 +ATOM 12638 O O . GLU C 1 160 ? -46.401 1.820 87.517 1.00 37.31 ? 160 GLU C O 1 +ATOM 12639 C CB . GLU C 1 160 ? -46.485 2.975 90.658 1.00 41.87 ? 160 GLU C CB 1 +ATOM 12640 C CG . GLU C 1 160 ? -46.060 2.688 92.085 1.00 47.31 ? 160 GLU C CG 1 +ATOM 12641 C CD . GLU C 1 160 ? -47.154 3.004 93.097 1.00 50.75 ? 160 GLU C CD 1 +ATOM 12642 O OE1 . GLU C 1 160 ? -47.868 4.019 92.912 1.00 51.77 ? 160 GLU C OE1 1 +ATOM 12643 O OE2 . GLU C 1 160 ? -47.287 2.243 94.085 1.00 52.67 ? 160 GLU C OE2 1 +ATOM 12644 N N . LYS C 1 161 ? -46.204 4.039 87.809 1.00 37.14 ? 161 LYS C N 1 +ATOM 12645 C CA . LYS C 1 161 ? -46.770 4.336 86.508 1.00 37.80 ? 161 LYS C CA 1 +ATOM 12646 C C . LYS C 1 161 ? -45.881 3.772 85.409 1.00 37.84 ? 161 LYS C C 1 +ATOM 12647 O O . LYS C 1 161 ? -46.371 3.162 84.447 1.00 38.20 ? 161 LYS C O 1 +ATOM 12648 C CB . LYS C 1 161 ? -46.940 5.845 86.325 1.00 38.34 ? 161 LYS C CB 1 +ATOM 12649 C CG . LYS C 1 161 ? -47.943 6.488 87.268 1.00 38.77 ? 161 LYS C CG 1 +ATOM 12650 C CD . LYS C 1 161 ? -48.197 7.938 86.855 1.00 41.24 ? 161 LYS C CD 1 +ATOM 12651 C CE . LYS C 1 161 ? -49.086 8.676 87.854 1.00 41.88 ? 161 LYS C CE 1 +ATOM 12652 N NZ . LYS C 1 161 ? -48.409 8.871 89.174 1.00 43.49 ? 161 LYS C NZ 1 +ATOM 12653 N N . TYR C 1 162 ? -44.573 3.969 85.554 1.00 36.83 ? 162 TYR C N 1 +ATOM 12654 C CA . TYR C 1 162 ? -43.621 3.469 84.569 1.00 36.42 ? 162 TYR C CA 1 +ATOM 12655 C C . TYR C 1 162 ? -43.746 1.962 84.435 1.00 37.00 ? 162 TYR C C 1 +ATOM 12656 O O . TYR C 1 162 ? -43.784 1.433 83.326 1.00 37.18 ? 162 TYR C O 1 +ATOM 12657 C CB . TYR C 1 162 ? -42.187 3.826 84.976 1.00 36.50 ? 162 TYR C CB 1 +ATOM 12658 C CG . TYR C 1 162 ? -41.139 3.147 84.127 1.00 33.50 ? 162 TYR C CG 1 +ATOM 12659 C CD1 . TYR C 1 162 ? -40.860 3.590 82.834 1.00 33.14 ? 162 TYR C CD1 1 +ATOM 12660 C CD2 . TYR C 1 162 ? -40.469 2.028 84.598 1.00 33.13 ? 162 TYR C CD2 1 +ATOM 12661 C CE1 . TYR C 1 162 ? -39.943 2.929 82.037 1.00 33.92 ? 162 TYR C CE1 1 +ATOM 12662 C CE2 . TYR C 1 162 ? -39.552 1.356 83.812 1.00 33.58 ? 162 TYR C CE2 1 +ATOM 12663 C CZ . TYR C 1 162 ? -39.293 1.806 82.534 1.00 34.99 ? 162 TYR C CZ 1 +ATOM 12664 O OH . TYR C 1 162 ? -38.400 1.112 81.748 1.00 35.85 ? 162 TYR C OH 1 +ATOM 12665 N N . THR C 1 163 ? -43.807 1.277 85.573 1.00 38.12 ? 163 THR C N 1 +ATOM 12666 C CA . THR C 1 163 ? -43.934 -0.178 85.601 1.00 40.17 ? 163 THR C CA 1 +ATOM 12667 C C . THR C 1 163 ? -45.273 -0.615 85.018 1.00 41.32 ? 163 THR C C 1 +ATOM 12668 O O . THR C 1 163 ? -45.378 -1.657 84.372 1.00 40.28 ? 163 THR C O 1 +ATOM 12669 C CB . THR C 1 163 ? -43.812 -0.711 87.039 1.00 39.70 ? 163 THR C CB 1 +ATOM 12670 O OG1 . THR C 1 163 ? -42.528 -0.353 87.561 1.00 42.72 ? 163 THR C OG1 1 +ATOM 12671 C CG2 . THR C 1 163 ? -43.951 -2.219 87.063 1.00 39.53 ? 163 THR C CG2 1 +ATOM 12672 N N . GLU C 1 164 ? -46.302 0.181 85.268 1.00 43.48 ? 164 GLU C N 1 +ATOM 12673 C CA . GLU C 1 164 ? -47.623 -0.109 84.738 1.00 45.80 ? 164 GLU C CA 1 +ATOM 12674 C C . GLU C 1 164 ? -47.510 -0.071 83.208 1.00 44.56 ? 164 GLU C C 1 +ATOM 12675 O O . GLU C 1 164 ? -48.052 -0.925 82.505 1.00 44.41 ? 164 GLU C O 1 +ATOM 12676 C CB . GLU C 1 164 ? -48.616 0.957 85.212 1.00 49.98 ? 164 GLU C CB 1 +ATOM 12677 C CG . GLU C 1 164 ? -50.016 0.803 84.649 1.00 57.17 ? 164 GLU C CG 1 +ATOM 12678 C CD . GLU C 1 164 ? -50.854 -0.190 85.432 1.00 63.27 ? 164 GLU C CD 1 +ATOM 12679 O OE1 . GLU C 1 164 ? -50.302 -1.233 85.860 1.00 66.79 ? 164 GLU C OE1 1 +ATOM 12680 O OE2 . GLU C 1 164 ? -52.070 0.069 85.612 1.00 65.75 ? 164 GLU C OE2 1 +ATOM 12681 N N . LEU C 1 165 ? -46.772 0.917 82.709 1.00 42.44 ? 165 LEU C N 1 +ATOM 12682 C CA . LEU C 1 165 ? -46.580 1.109 81.277 1.00 40.94 ? 165 LEU C CA 1 +ATOM 12683 C C . LEU C 1 165 ? -45.731 0.040 80.583 1.00 40.69 ? 165 LEU C C 1 +ATOM 12684 O O . LEU C 1 165 ? -46.155 -0.550 79.590 1.00 39.77 ? 165 LEU C O 1 +ATOM 12685 C CB . LEU C 1 165 ? -45.937 2.474 81.032 1.00 40.88 ? 165 LEU C CB 1 +ATOM 12686 C CG . LEU C 1 165 ? -46.227 3.249 79.740 1.00 41.45 ? 165 LEU C CG 1 +ATOM 12687 C CD1 . LEU C 1 165 ? -44.970 4.023 79.338 1.00 39.40 ? 165 LEU C CD1 1 +ATOM 12688 C CD2 . LEU C 1 165 ? -46.644 2.319 78.631 1.00 41.06 ? 165 LEU C CD2 1 +ATOM 12689 N N . THR C 1 166 ? -44.533 -0.213 81.105 1.00 39.99 ? 166 THR C N 1 +ATOM 12690 C CA . THR C 1 166 ? -43.629 -1.168 80.473 1.00 39.12 ? 166 THR C CA 1 +ATOM 12691 C C . THR C 1 166 ? -43.736 -2.622 80.908 1.00 39.53 ? 166 THR C C 1 +ATOM 12692 O O . THR C 1 166 ? -43.254 -3.515 80.207 1.00 39.42 ? 166 THR C O 1 +ATOM 12693 C CB . THR C 1 166 ? -42.144 -0.707 80.612 1.00 38.93 ? 166 THR C CB 1 +ATOM 12694 O OG1 . THR C 1 166 ? -41.768 -0.653 81.996 1.00 36.44 ? 166 THR C OG1 1 +ATOM 12695 C CG2 . THR C 1 166 ? -41.962 0.673 79.984 1.00 35.99 ? 166 THR C CG2 1 +ATOM 12696 N N . GLY C 1 167 ? -44.360 -2.868 82.052 1.00 40.00 ? 167 GLY C N 1 +ATOM 12697 C CA . GLY C 1 167 ? -44.505 -4.237 82.518 1.00 40.46 ? 167 GLY C CA 1 +ATOM 12698 C C . GLY C 1 167 ? -44.062 -4.463 83.953 1.00 41.75 ? 167 GLY C C 1 +ATOM 12699 O O . GLY C 1 167 ? -43.013 -3.972 84.372 1.00 41.50 ? 167 GLY C O 1 +ATOM 12700 N N . LYS C 1 168 ? -44.869 -5.200 84.711 1.00 42.47 ? 168 LYS C N 1 +ATOM 12701 C CA . LYS C 1 168 ? -44.543 -5.500 86.098 1.00 42.93 ? 168 LYS C CA 1 +ATOM 12702 C C . LYS C 1 168 ? -43.486 -6.600 86.105 1.00 42.02 ? 168 LYS C C 1 +ATOM 12703 O O . LYS C 1 168 ? -43.446 -7.443 85.217 1.00 43.08 ? 168 LYS C O 1 +ATOM 12704 C CB . LYS C 1 168 ? -45.782 -5.996 86.855 1.00 44.56 ? 168 LYS C CB 1 +ATOM 12705 C CG . LYS C 1 168 ? -46.958 -5.017 86.934 1.00 47.96 ? 168 LYS C CG 1 +ATOM 12706 C CD . LYS C 1 168 ? -46.654 -3.826 87.839 1.00 50.93 ? 168 LYS C CD 1 +ATOM 12707 C CE . LYS C 1 168 ? -47.858 -2.879 87.945 1.00 53.95 ? 168 LYS C CE 1 +ATOM 12708 N NZ . LYS C 1 168 ? -47.536 -1.605 88.668 1.00 55.24 ? 168 LYS C NZ 1 +ATOM 12709 N N . PRO C 1 169 ? -42.596 -6.588 87.094 1.00 41.54 ? 169 PRO C N 1 +ATOM 12710 C CA . PRO C 1 169 ? -41.564 -7.626 87.162 1.00 41.71 ? 169 PRO C CA 1 +ATOM 12711 C C . PRO C 1 169 ? -42.240 -8.981 87.421 1.00 42.85 ? 169 PRO C C 1 +ATOM 12712 O O . PRO C 1 169 ? -43.237 -9.056 88.150 1.00 43.37 ? 169 PRO C O 1 +ATOM 12713 C CB . PRO C 1 169 ? -40.714 -7.190 88.355 1.00 40.45 ? 169 PRO C CB 1 +ATOM 12714 C CG . PRO C 1 169 ? -40.867 -5.704 88.355 1.00 41.11 ? 169 PRO C CG 1 +ATOM 12715 C CD . PRO C 1 169 ? -42.335 -5.513 88.062 1.00 41.30 ? 169 PRO C CD 1 +ATOM 12716 N N . PHE C 1 170 ? -41.720 -10.047 86.825 1.00 42.59 ? 170 PHE C N 1 +ATOM 12717 C CA . PHE C 1 170 ? -42.299 -11.362 87.065 1.00 42.32 ? 170 PHE C CA 1 +ATOM 12718 C C . PHE C 1 170 ? -41.949 -11.741 88.496 1.00 41.85 ? 170 PHE C C 1 +ATOM 12719 O O . PHE C 1 170 ? -41.003 -11.202 89.068 1.00 41.36 ? 170 PHE C O 1 +ATOM 12720 C CB . PHE C 1 170 ? -41.712 -12.407 86.114 1.00 42.45 ? 170 PHE C CB 1 +ATOM 12721 C CG . PHE C 1 170 ? -40.282 -12.784 86.422 1.00 44.45 ? 170 PHE C CG 1 +ATOM 12722 C CD1 . PHE C 1 170 ? -39.249 -11.865 86.256 1.00 44.56 ? 170 PHE C CD1 1 +ATOM 12723 C CD2 . PHE C 1 170 ? -39.963 -14.077 86.836 1.00 44.16 ? 170 PHE C CD2 1 +ATOM 12724 C CE1 . PHE C 1 170 ? -37.920 -12.229 86.488 1.00 44.50 ? 170 PHE C CE1 1 +ATOM 12725 C CE2 . PHE C 1 170 ? -38.636 -14.450 87.072 1.00 44.68 ? 170 PHE C CE2 1 +ATOM 12726 C CZ . PHE C 1 170 ? -37.613 -13.523 86.894 1.00 44.91 ? 170 PHE C CZ 1 +ATOM 12727 N N . LEU C 1 171 ? -42.712 -12.658 89.082 1.00 41.74 ? 171 LEU C N 1 +ATOM 12728 C CA . LEU C 1 171 ? -42.424 -13.097 90.437 1.00 41.39 ? 171 LEU C CA 1 +ATOM 12729 C C . LEU C 1 171 ? -41.625 -14.386 90.352 1.00 41.40 ? 171 LEU C C 1 +ATOM 12730 O O . LEU C 1 171 ? -42.141 -15.421 89.941 1.00 41.63 ? 171 LEU C O 1 +ATOM 12731 C CB . LEU C 1 171 ? -43.712 -13.345 91.218 1.00 42.15 ? 171 LEU C CB 1 +ATOM 12732 C CG . LEU C 1 171 ? -43.503 -13.854 92.657 1.00 43.36 ? 171 LEU C CG 1 +ATOM 12733 C CD1 . LEU C 1 171 ? -42.704 -12.837 93.478 1.00 40.78 ? 171 LEU C CD1 1 +ATOM 12734 C CD2 . LEU C 1 171 ? -44.858 -14.106 93.303 1.00 42.11 ? 171 LEU C CD2 1 +ATOM 12735 N N . PRO C 1 172 ? -40.339 -14.336 90.719 1.00 40.96 ? 172 PRO C N 1 +ATOM 12736 C CA . PRO C 1 172 ? -39.505 -15.539 90.662 1.00 39.98 ? 172 PRO C CA 1 +ATOM 12737 C C . PRO C 1 172 ? -39.661 -16.385 91.912 1.00 38.52 ? 172 PRO C C 1 +ATOM 12738 O O . PRO C 1 172 ? -40.270 -15.955 92.882 1.00 38.82 ? 172 PRO C O 1 +ATOM 12739 C CB . PRO C 1 172 ? -38.096 -14.971 90.503 1.00 39.11 ? 172 PRO C CB 1 +ATOM 12740 C CG . PRO C 1 172 ? -38.161 -13.734 91.323 1.00 40.67 ? 172 PRO C CG 1 +ATOM 12741 C CD . PRO C 1 172 ? -39.522 -13.136 90.983 1.00 41.04 ? 172 PRO C CD 1 +ATOM 12742 N N . PRO C 1 173 ? -39.131 -17.615 91.895 1.00 38.79 ? 173 PRO C N 1 +ATOM 12743 C CA . PRO C 1 173 ? -39.232 -18.499 93.058 1.00 38.39 ? 173 PRO C CA 1 +ATOM 12744 C C . PRO C 1 173 ? -38.301 -18.015 94.157 1.00 39.62 ? 173 PRO C C 1 +ATOM 12745 O O . PRO C 1 173 ? -37.295 -17.354 93.883 1.00 40.30 ? 173 PRO C O 1 +ATOM 12746 C CB . PRO C 1 173 ? -38.808 -19.850 92.497 1.00 38.31 ? 173 PRO C CB 1 +ATOM 12747 C CG . PRO C 1 173 ? -37.788 -19.465 91.463 1.00 38.55 ? 173 PRO C CG 1 +ATOM 12748 C CD . PRO C 1 173 ? -38.449 -18.292 90.776 1.00 38.70 ? 173 PRO C CD 1 +ATOM 12749 N N . MET C 1 174 ? -38.625 -18.343 95.402 1.00 40.44 ? 174 MET C N 1 +ATOM 12750 C CA . MET C 1 174 ? -37.791 -17.917 96.511 1.00 41.02 ? 174 MET C CA 1 +ATOM 12751 C C . MET C 1 174 ? -36.339 -18.402 96.392 1.00 40.85 ? 174 MET C C 1 +ATOM 12752 O O . MET C 1 174 ? -35.415 -17.703 96.816 1.00 40.91 ? 174 MET C O 1 +ATOM 12753 C CB . MET C 1 174 ? -38.399 -18.382 97.832 1.00 43.09 ? 174 MET C CB 1 +ATOM 12754 C CG . MET C 1 174 ? -37.618 -17.926 99.057 1.00 47.42 ? 174 MET C CG 1 +ATOM 12755 S SD . MET C 1 174 ? -38.524 -18.165 100.616 1.00 52.47 ? 174 MET C SD 1 +ATOM 12756 C CE . MET C 1 174 ? -38.579 -16.489 101.251 1.00 50.67 ? 174 MET C CE 1 +ATOM 12757 N N . TRP C 1 175 ? -36.117 -19.577 95.806 1.00 39.11 ? 175 TRP C N 1 +ATOM 12758 C CA . TRP C 1 175 ? -34.745 -20.056 95.689 1.00 38.90 ? 175 TRP C CA 1 +ATOM 12759 C C . TRP C 1 175 ? -33.874 -19.205 94.770 1.00 38.01 ? 175 TRP C C 1 +ATOM 12760 O O . TRP C 1 175 ? -32.650 -19.297 94.811 1.00 39.45 ? 175 TRP C O 1 +ATOM 12761 C CB . TRP C 1 175 ? -34.691 -21.525 95.241 1.00 38.37 ? 175 TRP C CB 1 +ATOM 12762 C CG . TRP C 1 175 ? -35.367 -21.851 93.938 1.00 39.07 ? 175 TRP C CG 1 +ATOM 12763 C CD1 . TRP C 1 175 ? -36.618 -22.382 93.771 1.00 39.17 ? 175 TRP C CD1 1 +ATOM 12764 C CD2 . TRP C 1 175 ? -34.813 -21.714 92.621 1.00 38.95 ? 175 TRP C CD2 1 +ATOM 12765 N NE1 . TRP C 1 175 ? -36.875 -22.588 92.433 1.00 40.30 ? 175 TRP C NE1 1 +ATOM 12766 C CE2 . TRP C 1 175 ? -35.784 -22.186 91.705 1.00 39.28 ? 175 TRP C CE2 1 +ATOM 12767 C CE3 . TRP C 1 175 ? -33.589 -21.240 92.126 1.00 39.77 ? 175 TRP C CE3 1 +ATOM 12768 C CZ2 . TRP C 1 175 ? -35.568 -22.198 90.322 1.00 39.08 ? 175 TRP C CZ2 1 +ATOM 12769 C CZ3 . TRP C 1 175 ? -33.374 -21.252 90.745 1.00 39.38 ? 175 TRP C CZ3 1 +ATOM 12770 C CH2 . TRP C 1 175 ? -34.360 -21.729 89.863 1.00 39.12 ? 175 TRP C CH2 1 +ATOM 12771 N N . ALA C 1 176 ? -34.498 -18.367 93.953 1.00 36.89 ? 176 ALA C N 1 +ATOM 12772 C CA . ALA C 1 176 ? -33.748 -17.509 93.041 1.00 35.97 ? 176 ALA C CA 1 +ATOM 12773 C C . ALA C 1 176 ? -32.982 -16.437 93.810 1.00 35.95 ? 176 ALA C C 1 +ATOM 12774 O O . ALA C 1 176 ? -32.062 -15.817 93.277 1.00 35.30 ? 176 ALA C O 1 +ATOM 12775 C CB . ALA C 1 176 ? -34.693 -16.854 92.040 1.00 35.38 ? 176 ALA C CB 1 +ATOM 12776 N N . PHE C 1 177 ? -33.362 -16.220 95.065 1.00 36.44 ? 177 PHE C N 1 +ATOM 12777 C CA . PHE C 1 177 ? -32.698 -15.221 95.891 1.00 36.95 ? 177 PHE C CA 1 +ATOM 12778 C C . PHE C 1 177 ? -31.709 -15.853 96.866 1.00 36.85 ? 177 PHE C C 1 +ATOM 12779 O O . PHE C 1 177 ? -31.159 -15.171 97.724 1.00 37.77 ? 177 PHE C O 1 +ATOM 12780 C CB . PHE C 1 177 ? -33.735 -14.396 96.664 1.00 36.78 ? 177 PHE C CB 1 +ATOM 12781 C CG . PHE C 1 177 ? -34.717 -13.688 95.780 1.00 38.21 ? 177 PHE C CG 1 +ATOM 12782 C CD1 . PHE C 1 177 ? -35.786 -14.377 95.211 1.00 37.45 ? 177 PHE C CD1 1 +ATOM 12783 C CD2 . PHE C 1 177 ? -34.562 -12.337 95.496 1.00 38.37 ? 177 PHE C CD2 1 +ATOM 12784 C CE1 . PHE C 1 177 ? -36.686 -13.730 94.372 1.00 37.82 ? 177 PHE C CE1 1 +ATOM 12785 C CE2 . PHE C 1 177 ? -35.457 -11.677 94.655 1.00 38.70 ? 177 PHE C CE2 1 +ATOM 12786 C CZ . PHE C 1 177 ? -36.521 -12.374 94.093 1.00 39.12 ? 177 PHE C CZ 1 +ATOM 12787 N N . GLY C 1 178 ? -31.487 -17.157 96.728 1.00 36.71 ? 178 GLY C N 1 +ATOM 12788 C CA . GLY C 1 178 ? -30.564 -17.847 97.611 1.00 35.93 ? 178 GLY C CA 1 +ATOM 12789 C C . GLY C 1 178 ? -29.120 -17.679 97.175 1.00 35.87 ? 178 GLY C C 1 +ATOM 12790 O O . GLY C 1 178 ? -28.826 -16.968 96.215 1.00 35.96 ? 178 GLY C O 1 +ATOM 12791 N N . TYR C 1 179 ? -28.215 -18.337 97.886 1.00 34.81 ? 179 TYR C N 1 +ATOM 12792 C CA . TYR C 1 179 ? -26.791 -18.262 97.579 1.00 35.43 ? 179 TYR C CA 1 +ATOM 12793 C C . TYR C 1 179 ? -26.434 -19.144 96.376 1.00 35.51 ? 179 TYR C C 1 +ATOM 12794 O O . TYR C 1 179 ? -26.601 -20.364 96.415 1.00 35.15 ? 179 TYR C O 1 +ATOM 12795 C CB . TYR C 1 179 ? -26.001 -18.678 98.816 1.00 35.65 ? 179 TYR C CB 1 +ATOM 12796 C CG . TYR C 1 179 ? -24.507 -18.733 98.639 1.00 36.87 ? 179 TYR C CG 1 +ATOM 12797 C CD1 . TYR C 1 179 ? -23.826 -17.737 97.943 1.00 39.27 ? 179 TYR C CD1 1 +ATOM 12798 C CD2 . TYR C 1 179 ? -23.763 -19.756 99.218 1.00 39.09 ? 179 TYR C CD2 1 +ATOM 12799 C CE1 . TYR C 1 179 ? -22.435 -17.753 97.829 1.00 40.16 ? 179 TYR C CE1 1 +ATOM 12800 C CE2 . TYR C 1 179 ? -22.370 -19.784 99.114 1.00 40.24 ? 179 TYR C CE2 1 +ATOM 12801 C CZ . TYR C 1 179 ? -21.715 -18.779 98.418 1.00 41.37 ? 179 TYR C CZ 1 +ATOM 12802 O OH . TYR C 1 179 ? -20.339 -18.803 98.310 1.00 43.37 ? 179 TYR C OH 1 +ATOM 12803 N N . MET C 1 180 ? -25.947 -18.519 95.309 1.00 34.31 ? 180 MET C N 1 +ATOM 12804 C CA . MET C 1 180 ? -25.587 -19.241 94.095 1.00 35.05 ? 180 MET C CA 1 +ATOM 12805 C C . MET C 1 180 ? -24.079 -19.278 93.909 1.00 35.61 ? 180 MET C C 1 +ATOM 12806 O O . MET C 1 180 ? -23.399 -18.270 94.105 1.00 36.54 ? 180 MET C O 1 +ATOM 12807 C CB . MET C 1 180 ? -26.183 -18.550 92.865 1.00 37.91 ? 180 MET C CB 1 +ATOM 12808 C CG . MET C 1 180 ? -27.641 -18.187 92.983 1.00 41.22 ? 180 MET C CG 1 +ATOM 12809 S SD . MET C 1 180 ? -28.697 -19.629 92.885 1.00 45.68 ? 180 MET C SD 1 +ATOM 12810 C CE . MET C 1 180 ? -30.231 -18.851 92.252 1.00 45.03 ? 180 MET C CE 1 +ATOM 12811 N N . ILE C 1 181 ? -23.547 -20.431 93.526 1.00 35.01 ? 181 ILE C N 1 +ATOM 12812 C CA . ILE C 1 181 ? -22.126 -20.511 93.276 1.00 34.61 ? 181 ILE C CA 1 +ATOM 12813 C C . ILE C 1 181 ? -21.966 -20.685 91.777 1.00 35.65 ? 181 ILE C C 1 +ATOM 12814 O O . ILE C 1 181 ? -22.779 -21.334 91.123 1.00 35.45 ? 181 ILE C O 1 +ATOM 12815 C CB . ILE C 1 181 ? -21.468 -21.674 94.024 1.00 35.66 ? 181 ILE C CB 1 +ATOM 12816 C CG1 . ILE C 1 181 ? -22.079 -23.009 93.594 1.00 35.34 ? 181 ILE C CG1 1 +ATOM 12817 C CG2 . ILE C 1 181 ? -21.631 -21.460 95.515 1.00 35.69 ? 181 ILE C CG2 1 +ATOM 12818 C CD1 . ILE C 1 181 ? -21.362 -24.203 94.186 1.00 32.93 ? 181 ILE C CD1 1 +ATOM 12819 N N . SER C 1 182 ? -20.916 -20.092 91.229 1.00 35.55 ? 182 SER C N 1 +ATOM 12820 C CA . SER C 1 182 ? -20.688 -20.158 89.804 1.00 34.47 ? 182 SER C CA 1 +ATOM 12821 C C . SER C 1 182 ? -19.223 -19.935 89.513 1.00 34.06 ? 182 SER C C 1 +ATOM 12822 O O . SER C 1 182 ? -18.461 -19.511 90.374 1.00 35.59 ? 182 SER C O 1 +ATOM 12823 C CB . SER C 1 182 ? -21.528 -19.074 89.116 1.00 35.45 ? 182 SER C CB 1 +ATOM 12824 O OG . SER C 1 182 ? -21.212 -18.939 87.739 1.00 35.80 ? 182 SER C OG 1 +ATOM 12825 N N . ARG C 1 183 ? -18.826 -20.244 88.296 1.00 34.06 ? 183 ARG C N 1 +ATOM 12826 C CA . ARG C 1 183 ? -17.460 -20.022 87.882 1.00 35.99 ? 183 ARG C CA 1 +ATOM 12827 C C . ARG C 1 183 ? -17.432 -20.202 86.377 1.00 36.85 ? 183 ARG C C 1 +ATOM 12828 O O . ARG C 1 183 ? -18.370 -20.725 85.783 1.00 37.54 ? 183 ARG C O 1 +ATOM 12829 C CB . ARG C 1 183 ? -16.496 -21.010 88.558 1.00 36.46 ? 183 ARG C CB 1 +ATOM 12830 C CG . ARG C 1 183 ? -15.030 -20.680 88.290 1.00 36.48 ? 183 ARG C CG 1 +ATOM 12831 C CD . ARG C 1 183 ? -14.054 -21.701 88.872 1.00 36.91 ? 183 ARG C CD 1 +ATOM 12832 N NE . ARG C 1 183 ? -12.688 -21.453 88.402 1.00 37.54 ? 183 ARG C NE 1 +ATOM 12833 C CZ . ARG C 1 183 ? -11.821 -20.631 88.985 1.00 37.17 ? 183 ARG C CZ 1 +ATOM 12834 N NH1 . ARG C 1 183 ? -12.156 -19.973 90.085 1.00 37.92 ? 183 ARG C NH1 1 +ATOM 12835 N NH2 . ARG C 1 183 ? -10.624 -20.443 88.448 1.00 36.45 ? 183 ARG C NH2 1 +ATOM 12836 N N . TYR C 1 184 ? -16.352 -19.754 85.766 1.00 37.29 ? 184 TYR C N 1 +ATOM 12837 C CA . TYR C 1 184 ? -16.176 -19.865 84.342 1.00 36.82 ? 184 TYR C CA 1 +ATOM 12838 C C . TYR C 1 184 ? -14.937 -20.722 84.129 1.00 37.54 ? 184 TYR C C 1 +ATOM 12839 O O . TYR C 1 184 ? -13.854 -20.189 83.886 1.00 37.39 ? 184 TYR C O 1 +ATOM 12840 C CB . TYR C 1 184 ? -16.001 -18.457 83.764 1.00 37.62 ? 184 TYR C CB 1 +ATOM 12841 C CG . TYR C 1 184 ? -15.543 -18.377 82.326 1.00 38.67 ? 184 TYR C CG 1 +ATOM 12842 C CD1 . TYR C 1 184 ? -15.875 -19.367 81.402 1.00 38.83 ? 184 TYR C CD1 1 +ATOM 12843 C CD2 . TYR C 1 184 ? -14.792 -17.291 81.886 1.00 40.87 ? 184 TYR C CD2 1 +ATOM 12844 C CE1 . TYR C 1 184 ? -15.468 -19.279 80.076 1.00 39.76 ? 184 TYR C CE1 1 +ATOM 12845 C CE2 . TYR C 1 184 ? -14.380 -17.189 80.558 1.00 41.33 ? 184 TYR C CE2 1 +ATOM 12846 C CZ . TYR C 1 184 ? -14.722 -18.189 79.659 1.00 41.09 ? 184 TYR C CZ 1 +ATOM 12847 O OH . TYR C 1 184 ? -14.321 -18.100 78.343 1.00 42.13 ? 184 TYR C OH 1 +ATOM 12848 N N . SER C 1 185 ? -15.073 -22.048 84.233 1.00 38.82 ? 185 SER C N 1 +ATOM 12849 C CA . SER C 1 185 ? -16.333 -22.744 84.537 1.00 39.36 ? 185 SER C CA 1 +ATOM 12850 C C . SER C 1 185 ? -16.072 -23.921 85.492 1.00 39.58 ? 185 SER C C 1 +ATOM 12851 O O . SER C 1 185 ? -14.920 -24.235 85.810 1.00 40.01 ? 185 SER C O 1 +ATOM 12852 C CB . SER C 1 185 ? -16.951 -23.332 83.253 1.00 40.26 ? 185 SER C CB 1 +ATOM 12853 O OG . SER C 1 185 ? -17.026 -22.394 82.196 1.00 42.77 ? 185 SER C OG 1 +ATOM 12854 N N . TYR C 1 186 ? -17.148 -24.573 85.933 1.00 39.26 ? 186 TYR C N 1 +ATOM 12855 C CA . TYR C 1 186 ? -17.043 -25.750 86.795 1.00 39.68 ? 186 TYR C CA 1 +ATOM 12856 C C . TYR C 1 186 ? -17.215 -26.985 85.903 1.00 41.43 ? 186 TYR C C 1 +ATOM 12857 O O . TYR C 1 186 ? -18.182 -27.076 85.141 1.00 43.04 ? 186 TYR C O 1 +ATOM 12858 C CB . TYR C 1 186 ? -18.142 -25.764 87.858 1.00 38.95 ? 186 TYR C CB 1 +ATOM 12859 C CG . TYR C 1 186 ? -17.951 -24.790 88.993 1.00 39.01 ? 186 TYR C CG 1 +ATOM 12860 C CD1 . TYR C 1 186 ? -16.717 -24.679 89.647 1.00 38.90 ? 186 TYR C CD1 1 +ATOM 12861 C CD2 . TYR C 1 186 ? -19.017 -24.016 89.454 1.00 38.39 ? 186 TYR C CD2 1 +ATOM 12862 C CE1 . TYR C 1 186 ? -16.547 -23.827 90.734 1.00 39.18 ? 186 TYR C CE1 1 +ATOM 12863 C CE2 . TYR C 1 186 ? -18.865 -23.159 90.545 1.00 40.56 ? 186 TYR C CE2 1 +ATOM 12864 C CZ . TYR C 1 186 ? -17.620 -23.070 91.184 1.00 41.41 ? 186 TYR C CZ 1 +ATOM 12865 O OH . TYR C 1 186 ? -17.455 -22.236 92.272 1.00 40.31 ? 186 TYR C OH 1 +ATOM 12866 N N . TYR C 1 187 ? -16.280 -27.927 85.994 1.00 41.15 ? 187 TYR C N 1 +ATOM 12867 C CA . TYR C 1 187 ? -16.332 -29.149 85.194 1.00 40.53 ? 187 TYR C CA 1 +ATOM 12868 C C . TYR C 1 187 ? -15.117 -30.016 85.513 1.00 40.52 ? 187 TYR C C 1 +ATOM 12869 O O . TYR C 1 187 ? -14.143 -29.528 86.076 1.00 41.28 ? 187 TYR C O 1 +ATOM 12870 C CB . TYR C 1 187 ? -16.333 -28.812 83.702 1.00 39.58 ? 187 TYR C CB 1 +ATOM 12871 C CG . TYR C 1 187 ? -15.098 -28.082 83.238 1.00 40.03 ? 187 TYR C CG 1 +ATOM 12872 C CD1 . TYR C 1 187 ? -14.897 -26.735 83.551 1.00 39.86 ? 187 TYR C CD1 1 +ATOM 12873 C CD2 . TYR C 1 187 ? -14.115 -28.741 82.499 1.00 40.98 ? 187 TYR C CD2 1 +ATOM 12874 C CE1 . TYR C 1 187 ? -13.750 -26.065 83.143 1.00 40.57 ? 187 TYR C CE1 1 +ATOM 12875 C CE2 . TYR C 1 187 ? -12.959 -28.074 82.081 1.00 42.18 ? 187 TYR C CE2 1 +ATOM 12876 C CZ . TYR C 1 187 ? -12.787 -26.739 82.408 1.00 41.36 ? 187 TYR C CZ 1 +ATOM 12877 O OH . TYR C 1 187 ? -11.661 -26.079 81.986 1.00 44.00 ? 187 TYR C OH 1 +ATOM 12878 N N . PRO C 1 188 ? -15.165 -31.319 85.178 1.00 40.57 ? 188 PRO C N 1 +ATOM 12879 C CA . PRO C 1 188 ? -16.266 -32.049 84.538 1.00 40.13 ? 188 PRO C CA 1 +ATOM 12880 C C . PRO C 1 188 ? -17.403 -32.250 85.535 1.00 40.54 ? 188 PRO C C 1 +ATOM 12881 O O . PRO C 1 188 ? -17.301 -31.803 86.677 1.00 42.12 ? 188 PRO C O 1 +ATOM 12882 C CB . PRO C 1 188 ? -15.608 -33.352 84.107 1.00 38.75 ? 188 PRO C CB 1 +ATOM 12883 C CG . PRO C 1 188 ? -14.614 -33.579 85.192 1.00 39.47 ? 188 PRO C CG 1 +ATOM 12884 C CD . PRO C 1 188 ? -14.012 -32.209 85.398 1.00 40.53 ? 188 PRO C CD 1 +ATOM 12885 N N . GLN C 1 189 ? -18.472 -32.929 85.126 1.00 40.67 ? 189 GLN C N 1 +ATOM 12886 C CA . GLN C 1 189 ? -19.625 -33.104 86.007 1.00 41.32 ? 189 GLN C CA 1 +ATOM 12887 C C . GLN C 1 189 ? -19.367 -33.679 87.404 1.00 42.37 ? 189 GLN C C 1 +ATOM 12888 O O . GLN C 1 189 ? -20.054 -33.317 88.360 1.00 41.41 ? 189 GLN C O 1 +ATOM 12889 C CB . GLN C 1 189 ? -20.723 -33.910 85.301 1.00 41.45 ? 189 GLN C CB 1 +ATOM 12890 C CG . GLN C 1 189 ? -20.422 -35.375 85.057 1.00 42.33 ? 189 GLN C CG 1 +ATOM 12891 C CD . GLN C 1 189 ? -21.560 -36.059 84.315 1.00 42.88 ? 189 GLN C CD 1 +ATOM 12892 O OE1 . GLN C 1 189 ? -21.669 -35.959 83.092 1.00 44.20 ? 189 GLN C OE1 1 +ATOM 12893 N NE2 . GLN C 1 189 ? -22.427 -36.737 85.056 1.00 42.54 ? 189 GLN C NE2 1 +ATOM 12894 N N . ASP C 1 190 ? -18.392 -34.570 87.545 1.00 44.20 ? 190 ASP C N 1 +ATOM 12895 C CA . ASP C 1 190 ? -18.115 -35.116 88.867 1.00 46.07 ? 190 ASP C CA 1 +ATOM 12896 C C . ASP C 1 190 ? -17.588 -34.036 89.809 1.00 45.78 ? 190 ASP C C 1 +ATOM 12897 O O . ASP C 1 190 ? -17.895 -34.040 91.004 1.00 46.10 ? 190 ASP C O 1 +ATOM 12898 C CB . ASP C 1 190 ? -17.111 -36.266 88.784 1.00 49.39 ? 190 ASP C CB 1 +ATOM 12899 C CG . ASP C 1 190 ? -17.701 -37.512 88.125 1.00 55.17 ? 190 ASP C CG 1 +ATOM 12900 O OD1 . ASP C 1 190 ? -18.938 -37.732 88.239 1.00 55.37 ? 190 ASP C OD1 1 +ATOM 12901 O OD2 . ASP C 1 190 ? -16.925 -38.281 87.506 1.00 57.50 ? 190 ASP C OD2 1 +ATOM 12902 N N . LYS C 1 191 ? -16.799 -33.110 89.274 1.00 43.96 ? 191 LYS C N 1 +ATOM 12903 C CA . LYS C 1 191 ? -16.255 -32.036 90.092 1.00 43.16 ? 191 LYS C CA 1 +ATOM 12904 C C . LYS C 1 191 ? -17.353 -31.095 90.572 1.00 42.06 ? 191 LYS C C 1 +ATOM 12905 O O . LYS C 1 191 ? -17.267 -30.544 91.669 1.00 41.59 ? 191 LYS C O 1 +ATOM 12906 C CB . LYS C 1 191 ? -15.202 -31.257 89.311 1.00 44.06 ? 191 LYS C CB 1 +ATOM 12907 C CG . LYS C 1 191 ? -13.856 -31.949 89.249 1.00 45.12 ? 191 LYS C CG 1 +ATOM 12908 C CD . LYS C 1 191 ? -13.149 -31.864 90.590 1.00 47.82 ? 191 LYS C CD 1 +ATOM 12909 C CE . LYS C 1 191 ? -11.801 -32.582 90.561 1.00 48.50 ? 191 LYS C CE 1 +ATOM 12910 N NZ . LYS C 1 191 ? -11.958 -34.059 90.397 1.00 49.17 ? 191 LYS C NZ 1 +ATOM 12911 N N . VAL C 1 192 ? -18.384 -30.917 89.752 1.00 40.61 ? 192 VAL C N 1 +ATOM 12912 C CA . VAL C 1 192 ? -19.499 -30.050 90.116 1.00 40.29 ? 192 VAL C CA 1 +ATOM 12913 C C . VAL C 1 192 ? -20.173 -30.584 91.371 1.00 40.79 ? 192 VAL C C 1 +ATOM 12914 O O . VAL C 1 192 ? -20.481 -29.834 92.298 1.00 41.92 ? 192 VAL C O 1 +ATOM 12915 C CB . VAL C 1 192 ? -20.554 -29.973 88.978 1.00 40.02 ? 192 VAL C CB 1 +ATOM 12916 C CG1 . VAL C 1 192 ? -21.770 -29.175 89.427 1.00 36.70 ? 192 VAL C CG1 1 +ATOM 12917 C CG2 . VAL C 1 192 ? -19.931 -29.343 87.738 1.00 39.94 ? 192 VAL C CG2 1 +ATOM 12918 N N . VAL C 1 193 ? -20.394 -31.890 91.402 1.00 41.94 ? 193 VAL C N 1 +ATOM 12919 C CA . VAL C 1 193 ? -21.043 -32.516 92.544 1.00 41.87 ? 193 VAL C CA 1 +ATOM 12920 C C . VAL C 1 193 ? -20.123 -32.538 93.754 1.00 42.19 ? 193 VAL C C 1 +ATOM 12921 O O . VAL C 1 193 ? -20.575 -32.330 94.881 1.00 41.53 ? 193 VAL C O 1 +ATOM 12922 C CB . VAL C 1 193 ? -21.483 -33.946 92.203 1.00 42.70 ? 193 VAL C CB 1 +ATOM 12923 C CG1 . VAL C 1 193 ? -22.209 -34.565 93.389 1.00 43.12 ? 193 VAL C CG1 1 +ATOM 12924 C CG2 . VAL C 1 193 ? -22.387 -33.918 90.980 1.00 41.38 ? 193 VAL C CG2 1 +ATOM 12925 N N . GLU C 1 194 ? -18.836 -32.782 93.522 1.00 42.29 ? 194 GLU C N 1 +ATOM 12926 C CA . GLU C 1 194 ? -17.869 -32.806 94.616 1.00 44.61 ? 194 GLU C CA 1 +ATOM 12927 C C . GLU C 1 194 ? -17.850 -31.460 95.345 1.00 44.47 ? 194 GLU C C 1 +ATOM 12928 O O . GLU C 1 194 ? -17.870 -31.404 96.584 1.00 43.27 ? 194 GLU C O 1 +ATOM 12929 C CB . GLU C 1 194 ? -16.468 -33.111 94.087 1.00 48.00 ? 194 GLU C CB 1 +ATOM 12930 C CG . GLU C 1 194 ? -16.258 -34.545 93.633 1.00 55.66 ? 194 GLU C CG 1 +ATOM 12931 C CD . GLU C 1 194 ? -14.923 -34.738 92.925 1.00 60.43 ? 194 GLU C CD 1 +ATOM 12932 O OE1 . GLU C 1 194 ? -13.899 -34.239 93.447 1.00 63.73 ? 194 GLU C OE1 1 +ATOM 12933 O OE2 . GLU C 1 194 ? -14.897 -35.389 91.853 1.00 61.71 ? 194 GLU C OE2 1 +ATOM 12934 N N . LEU C 1 195 ? -17.816 -30.379 94.568 1.00 42.77 ? 195 LEU C N 1 +ATOM 12935 C CA . LEU C 1 195 ? -17.788 -29.043 95.138 1.00 42.62 ? 195 LEU C CA 1 +ATOM 12936 C C . LEU C 1 195 ? -19.066 -28.753 95.925 1.00 42.78 ? 195 LEU C C 1 +ATOM 12937 O O . LEU C 1 195 ? -19.008 -28.226 97.036 1.00 42.66 ? 195 LEU C O 1 +ATOM 12938 C CB . LEU C 1 195 ? -17.596 -27.997 94.037 1.00 41.99 ? 195 LEU C CB 1 +ATOM 12939 C CG . LEU C 1 195 ? -17.531 -26.553 94.548 1.00 43.16 ? 195 LEU C CG 1 +ATOM 12940 C CD1 . LEU C 1 195 ? -16.387 -26.408 95.552 1.00 41.18 ? 195 LEU C CD1 1 +ATOM 12941 C CD2 . LEU C 1 195 ? -17.341 -25.609 93.385 1.00 40.51 ? 195 LEU C CD2 1 +ATOM 12942 N N . VAL C 1 196 ? -20.220 -29.096 95.357 1.00 42.10 ? 196 VAL C N 1 +ATOM 12943 C CA . VAL C 1 196 ? -21.476 -28.861 96.054 1.00 41.80 ? 196 VAL C CA 1 +ATOM 12944 C C . VAL C 1 196 ? -21.491 -29.623 97.377 1.00 43.02 ? 196 VAL C C 1 +ATOM 12945 O O . VAL C 1 196 ? -21.957 -29.104 98.395 1.00 43.27 ? 196 VAL C O 1 +ATOM 12946 C CB . VAL C 1 196 ? -22.685 -29.292 95.199 1.00 41.81 ? 196 VAL C CB 1 +ATOM 12947 C CG1 . VAL C 1 196 ? -23.954 -29.292 96.043 1.00 39.53 ? 196 VAL C CG1 1 +ATOM 12948 C CG2 . VAL C 1 196 ? -22.843 -28.332 94.015 1.00 42.02 ? 196 VAL C CG2 1 +ATOM 12949 N N . ASP C 1 197 ? -20.975 -30.851 97.366 1.00 43.95 ? 197 ASP C N 1 +ATOM 12950 C CA . ASP C 1 197 ? -20.938 -31.652 98.582 1.00 44.73 ? 197 ASP C CA 1 +ATOM 12951 C C . ASP C 1 197 ? -20.089 -31.008 99.669 1.00 44.02 ? 197 ASP C C 1 +ATOM 12952 O O . ASP C 1 197 ? -20.508 -30.931 100.824 1.00 42.60 ? 197 ASP C O 1 +ATOM 12953 C CB . ASP C 1 197 ? -20.417 -33.062 98.294 1.00 47.36 ? 197 ASP C CB 1 +ATOM 12954 C CG . ASP C 1 197 ? -21.513 -34.003 97.827 1.00 49.95 ? 197 ASP C CG 1 +ATOM 12955 O OD1 . ASP C 1 197 ? -22.681 -33.799 98.231 1.00 51.96 ? 197 ASP C OD1 1 +ATOM 12956 O OD2 . ASP C 1 197 ? -21.209 -34.954 97.076 1.00 52.57 ? 197 ASP C OD2 1 +ATOM 12957 N N . ILE C 1 198 ? -18.897 -30.551 99.302 1.00 44.83 ? 198 ILE C N 1 +ATOM 12958 C CA . ILE C 1 198 ? -18.013 -29.912 100.267 1.00 45.19 ? 198 ILE C CA 1 +ATOM 12959 C C . ILE C 1 198 ? -18.671 -28.646 100.820 1.00 46.43 ? 198 ILE C C 1 +ATOM 12960 O O . ILE C 1 198 ? -18.612 -28.390 102.024 1.00 47.55 ? 198 ILE C O 1 +ATOM 12961 C CB . ILE C 1 198 ? -16.663 -29.543 99.637 1.00 45.40 ? 198 ILE C CB 1 +ATOM 12962 C CG1 . ILE C 1 198 ? -16.000 -30.794 99.066 1.00 46.33 ? 198 ILE C CG1 1 +ATOM 12963 C CG2 . ILE C 1 198 ? -15.751 -28.925 100.694 1.00 47.02 ? 198 ILE C CG2 1 +ATOM 12964 C CD1 . ILE C 1 198 ? -14.682 -30.525 98.363 1.00 46.80 ? 198 ILE C CD1 1 +ATOM 12965 N N . MET C 1 199 ? -19.298 -27.856 99.948 1.00 46.02 ? 199 MET C N 1 +ATOM 12966 C CA . MET C 1 199 ? -19.973 -26.634 100.384 1.00 45.44 ? 199 MET C CA 1 +ATOM 12967 C C . MET C 1 199 ? -21.037 -26.952 101.430 1.00 45.78 ? 199 MET C C 1 +ATOM 12968 O O . MET C 1 199 ? -21.081 -26.332 102.492 1.00 47.26 ? 199 MET C O 1 +ATOM 12969 C CB . MET C 1 199 ? -20.640 -25.926 99.198 1.00 45.79 ? 199 MET C CB 1 +ATOM 12970 C CG . MET C 1 199 ? -19.695 -25.175 98.266 1.00 46.60 ? 199 MET C CG 1 +ATOM 12971 S SD . MET C 1 199 ? -18.999 -23.669 98.997 1.00 51.27 ? 199 MET C SD 1 +ATOM 12972 C CE . MET C 1 199 ? -20.342 -22.503 98.731 1.00 47.23 ? 199 MET C CE 1 +ATOM 12973 N N . GLN C 1 200 ? -21.897 -27.919 101.131 1.00 46.42 ? 200 GLN C N 1 +ATOM 12974 C CA . GLN C 1 200 ? -22.966 -28.292 102.053 1.00 47.00 ? 200 GLN C CA 1 +ATOM 12975 C C . GLN C 1 200 ? -22.422 -28.901 103.342 1.00 48.23 ? 200 GLN C C 1 +ATOM 12976 O O . GLN C 1 200 ? -22.904 -28.596 104.435 1.00 47.72 ? 200 GLN C O 1 +ATOM 12977 C CB . GLN C 1 200 ? -23.924 -29.269 101.374 1.00 45.49 ? 200 GLN C CB 1 +ATOM 12978 C CG . GLN C 1 200 ? -24.574 -28.700 100.124 1.00 45.72 ? 200 GLN C CG 1 +ATOM 12979 C CD . GLN C 1 200 ? -25.676 -29.591 99.580 1.00 45.74 ? 200 GLN C CD 1 +ATOM 12980 O OE1 . GLN C 1 200 ? -25.484 -30.796 99.413 1.00 46.28 ? 200 GLN C OE1 1 +ATOM 12981 N NE2 . GLN C 1 200 ? -26.836 -29.002 99.297 1.00 42.45 ? 200 GLN C NE2 1 +ATOM 12982 N N . LYS C 1 201 ? -21.412 -29.755 103.212 1.00 49.27 ? 201 LYS C N 1 +ATOM 12983 C CA . LYS C 1 201 ? -20.819 -30.393 104.376 1.00 50.32 ? 201 LYS C CA 1 +ATOM 12984 C C . LYS C 1 201 ? -20.240 -29.353 105.339 1.00 50.00 ? 201 LYS C C 1 +ATOM 12985 O O . LYS C 1 201 ? -20.299 -29.527 106.554 1.00 49.12 ? 201 LYS C O 1 +ATOM 12986 C CB . LYS C 1 201 ? -19.730 -31.376 103.942 1.00 51.83 ? 201 LYS C CB 1 +ATOM 12987 C CG . LYS C 1 201 ? -19.035 -32.065 105.100 1.00 55.42 ? 201 LYS C CG 1 +ATOM 12988 C CD . LYS C 1 201 ? -17.979 -33.035 104.609 1.00 58.33 ? 201 LYS C CD 1 +ATOM 12989 C CE . LYS C 1 201 ? -17.251 -33.696 105.774 1.00 61.20 ? 201 LYS C CE 1 +ATOM 12990 N NZ . LYS C 1 201 ? -16.531 -32.689 106.617 1.00 62.92 ? 201 LYS C NZ 1 +ATOM 12991 N N . GLU C 1 202 ? -19.693 -28.268 104.801 1.00 50.30 ? 202 GLU C N 1 +ATOM 12992 C CA . GLU C 1 202 ? -19.116 -27.236 105.652 1.00 50.57 ? 202 GLU C CA 1 +ATOM 12993 C C . GLU C 1 202 ? -20.119 -26.180 106.104 1.00 49.62 ? 202 GLU C C 1 +ATOM 12994 O O . GLU C 1 202 ? -19.745 -25.140 106.645 1.00 49.77 ? 202 GLU C O 1 +ATOM 12995 C CB . GLU C 1 202 ? -17.899 -26.593 104.970 1.00 52.53 ? 202 GLU C CB 1 +ATOM 12996 C CG . GLU C 1 202 ? -16.670 -27.510 105.013 1.00 57.63 ? 202 GLU C CG 1 +ATOM 12997 C CD . GLU C 1 202 ? -15.369 -26.816 104.626 1.00 61.36 ? 202 GLU C CD 1 +ATOM 12998 O OE1 . GLU C 1 202 ? -15.186 -25.637 105.010 1.00 64.41 ? 202 GLU C OE1 1 +ATOM 12999 O OE2 . GLU C 1 202 ? -14.518 -27.455 103.959 1.00 61.66 ? 202 GLU C OE2 1 +ATOM 13000 N N . GLY C 1 203 ? -21.401 -26.458 105.887 1.00 49.09 ? 203 GLY C N 1 +ATOM 13001 C CA . GLY C 1 203 ? -22.435 -25.542 106.333 1.00 47.70 ? 203 GLY C CA 1 +ATOM 13002 C C . GLY C 1 203 ? -22.962 -24.466 105.401 1.00 47.52 ? 203 GLY C C 1 +ATOM 13003 O O . GLY C 1 203 ? -23.748 -23.627 105.831 1.00 49.06 ? 203 GLY C O 1 +ATOM 13004 N N . PHE C 1 204 ? -22.554 -24.456 104.140 1.00 45.78 ? 204 PHE C N 1 +ATOM 13005 C CA . PHE C 1 204 ? -23.071 -23.431 103.245 1.00 44.52 ? 204 PHE C CA 1 +ATOM 13006 C C . PHE C 1 204 ? -24.299 -23.927 102.514 1.00 43.13 ? 204 PHE C C 1 +ATOM 13007 O O . PHE C 1 204 ? -24.268 -24.954 101.842 1.00 43.16 ? 204 PHE C O 1 +ATOM 13008 C CB . PHE C 1 204 ? -22.004 -22.987 102.243 1.00 43.44 ? 204 PHE C CB 1 +ATOM 13009 C CG . PHE C 1 204 ? -20.838 -22.305 102.883 1.00 43.83 ? 204 PHE C CG 1 +ATOM 13010 C CD1 . PHE C 1 204 ? -19.748 -23.042 103.344 1.00 43.60 ? 204 PHE C CD1 1 +ATOM 13011 C CD2 . PHE C 1 204 ? -20.848 -20.927 103.077 1.00 42.69 ? 204 PHE C CD2 1 +ATOM 13012 C CE1 . PHE C 1 204 ? -18.687 -22.409 103.994 1.00 44.27 ? 204 PHE C CE1 1 +ATOM 13013 C CE2 . PHE C 1 204 ? -19.798 -20.289 103.721 1.00 42.36 ? 204 PHE C CE2 1 +ATOM 13014 C CZ . PHE C 1 204 ? -18.715 -21.028 104.182 1.00 42.96 ? 204 PHE C CZ 1 +ATOM 13015 N N . ARG C 1 205 ? -25.386 -23.190 102.663 1.00 42.08 ? 205 ARG C N 1 +ATOM 13016 C CA . ARG C 1 205 ? -26.629 -23.542 102.015 1.00 42.95 ? 205 ARG C CA 1 +ATOM 13017 C C . ARG C 1 205 ? -26.594 -23.010 100.575 1.00 41.95 ? 205 ARG C C 1 +ATOM 13018 O O . ARG C 1 205 ? -26.740 -21.812 100.335 1.00 43.26 ? 205 ARG C O 1 +ATOM 13019 C CB . ARG C 1 205 ? -27.782 -22.942 102.814 1.00 45.04 ? 205 ARG C CB 1 +ATOM 13020 C CG . ARG C 1 205 ? -29.162 -23.317 102.333 1.00 50.21 ? 205 ARG C CG 1 +ATOM 13021 C CD . ARG C 1 205 ? -30.206 -22.748 103.278 1.00 52.96 ? 205 ARG C CD 1 +ATOM 13022 N NE . ARG C 1 205 ? -31.546 -22.807 102.705 1.00 57.78 ? 205 ARG C NE 1 +ATOM 13023 C CZ . ARG C 1 205 ? -32.625 -22.291 103.288 1.00 60.12 ? 205 ARG C CZ 1 +ATOM 13024 N NH1 . ARG C 1 205 ? -32.516 -21.682 104.467 1.00 59.65 ? 205 ARG C NH1 1 +ATOM 13025 N NH2 . ARG C 1 205 ? -33.809 -22.368 102.685 1.00 60.27 ? 205 ARG C NH2 1 +ATOM 13026 N N . VAL C 1 206 ? -26.376 -23.911 99.623 1.00 40.07 ? 206 VAL C N 1 +ATOM 13027 C CA . VAL C 1 206 ? -26.302 -23.549 98.213 1.00 38.71 ? 206 VAL C CA 1 +ATOM 13028 C C . VAL C 1 206 ? -27.645 -23.756 97.516 1.00 38.76 ? 206 VAL C C 1 +ATOM 13029 O O . VAL C 1 206 ? -28.187 -24.858 97.503 1.00 39.26 ? 206 VAL C O 1 +ATOM 13030 C CB . VAL C 1 206 ? -25.230 -24.387 97.497 1.00 38.74 ? 206 VAL C CB 1 +ATOM 13031 C CG1 . VAL C 1 206 ? -25.178 -24.031 96.029 1.00 39.61 ? 206 VAL C CG1 1 +ATOM 13032 C CG2 . VAL C 1 206 ? -23.881 -24.149 98.138 1.00 40.12 ? 206 VAL C CG2 1 +ATOM 13033 N N . ALA C 1 207 ? -28.174 -22.691 96.925 1.00 38.37 ? 207 ALA C N 1 +ATOM 13034 C CA . ALA C 1 207 ? -29.457 -22.756 96.237 1.00 37.36 ? 207 ALA C CA 1 +ATOM 13035 C C . ALA C 1 207 ? -29.333 -23.304 94.818 1.00 36.95 ? 207 ALA C C 1 +ATOM 13036 O O . ALA C 1 207 ? -30.221 -24.006 94.330 1.00 36.36 ? 207 ALA C O 1 +ATOM 13037 C CB . ALA C 1 207 ? -30.090 -21.378 96.206 1.00 37.03 ? 207 ALA C CB 1 +ATOM 13038 N N . GLY C 1 208 ? -28.231 -22.976 94.157 1.00 36.48 ? 208 GLY C N 1 +ATOM 13039 C CA . GLY C 1 208 ? -28.028 -23.438 92.799 1.00 35.35 ? 208 GLY C CA 1 +ATOM 13040 C C . GLY C 1 208 ? -26.609 -23.216 92.315 1.00 35.58 ? 208 GLY C C 1 +ATOM 13041 O O . GLY C 1 208 ? -25.840 -22.457 92.915 1.00 36.76 ? 208 GLY C O 1 +ATOM 13042 N N . VAL C 1 209 ? -26.250 -23.899 91.237 1.00 34.57 ? 209 VAL C N 1 +ATOM 13043 C CA . VAL C 1 209 ? -24.930 -23.756 90.657 1.00 35.31 ? 209 VAL C CA 1 +ATOM 13044 C C . VAL C 1 209 ? -25.113 -23.374 89.199 1.00 35.13 ? 209 VAL C C 1 +ATOM 13045 O O . VAL C 1 209 ? -26.037 -23.852 88.527 1.00 36.57 ? 209 VAL C O 1 +ATOM 13046 C CB . VAL C 1 209 ? -24.109 -25.071 90.747 1.00 36.70 ? 209 VAL C CB 1 +ATOM 13047 C CG1 . VAL C 1 209 ? -24.098 -25.569 92.167 1.00 39.92 ? 209 VAL C CG1 1 +ATOM 13048 C CG2 . VAL C 1 209 ? -24.688 -26.126 89.849 1.00 37.99 ? 209 VAL C CG2 1 +ATOM 13049 N N . PHE C 1 210 ? -24.243 -22.496 88.719 1.00 33.93 ? 210 PHE C N 1 +ATOM 13050 C CA . PHE C 1 210 ? -24.297 -22.048 87.340 1.00 33.59 ? 210 PHE C CA 1 +ATOM 13051 C C . PHE C 1 210 ? -23.236 -22.770 86.523 1.00 34.53 ? 210 PHE C C 1 +ATOM 13052 O O . PHE C 1 210 ? -22.082 -22.924 86.954 1.00 33.43 ? 210 PHE C O 1 +ATOM 13053 C CB . PHE C 1 210 ? -24.069 -20.529 87.256 1.00 32.96 ? 210 PHE C CB 1 +ATOM 13054 C CG . PHE C 1 210 ? -25.242 -19.709 87.723 1.00 32.85 ? 210 PHE C CG 1 +ATOM 13055 C CD1 . PHE C 1 210 ? -25.727 -19.837 89.020 1.00 32.73 ? 210 PHE C CD1 1 +ATOM 13056 C CD2 . PHE C 1 210 ? -25.874 -18.819 86.857 1.00 31.12 ? 210 PHE C CD2 1 +ATOM 13057 C CE1 . PHE C 1 210 ? -26.828 -19.091 89.448 1.00 33.65 ? 210 PHE C CE1 1 +ATOM 13058 C CE2 . PHE C 1 210 ? -26.972 -18.073 87.275 1.00 31.62 ? 210 PHE C CE2 1 +ATOM 13059 C CZ . PHE C 1 210 ? -27.453 -18.205 88.570 1.00 32.10 ? 210 PHE C CZ 1 +ATOM 13060 N N . LEU C 1 211 ? -23.635 -23.213 85.337 1.00 33.98 ? 211 LEU C N 1 +ATOM 13061 C CA . LEU C 1 211 ? -22.731 -23.895 84.435 1.00 33.69 ? 211 LEU C CA 1 +ATOM 13062 C C . LEU C 1 211 ? -22.409 -22.940 83.286 1.00 34.30 ? 211 LEU C C 1 +ATOM 13063 O O . LEU C 1 211 ? -23.295 -22.571 82.504 1.00 32.31 ? 211 LEU C O 1 +ATOM 13064 C CB . LEU C 1 211 ? -23.396 -25.167 83.910 1.00 34.47 ? 211 LEU C CB 1 +ATOM 13065 C CG . LEU C 1 211 ? -22.784 -26.512 84.299 1.00 36.65 ? 211 LEU C CG 1 +ATOM 13066 C CD1 . LEU C 1 211 ? -22.387 -26.527 85.768 1.00 35.88 ? 211 LEU C CD1 1 +ATOM 13067 C CD2 . LEU C 1 211 ? -23.800 -27.610 83.994 1.00 37.68 ? 211 LEU C CD2 1 +ATOM 13068 N N . ASP C 1 212 ? -21.143 -22.530 83.197 1.00 35.13 ? 212 ASP C N 1 +ATOM 13069 C CA . ASP C 1 212 ? -20.709 -21.618 82.150 1.00 34.70 ? 212 ASP C CA 1 +ATOM 13070 C C . ASP C 1 212 ? -20.388 -22.414 80.886 1.00 34.67 ? 212 ASP C C 1 +ATOM 13071 O O . ASP C 1 212 ? -20.460 -23.643 80.889 1.00 34.96 ? 212 ASP C O 1 +ATOM 13072 C CB . ASP C 1 212 ? -19.495 -20.802 82.615 1.00 35.37 ? 212 ASP C CB 1 +ATOM 13073 C CG . ASP C 1 212 ? -19.445 -19.407 81.986 1.00 36.65 ? 212 ASP C CG 1 +ATOM 13074 O OD1 . ASP C 1 212 ? -19.700 -19.283 80.757 1.00 35.73 ? 212 ASP C OD1 1 +ATOM 13075 O OD2 . ASP C 1 212 ? -19.138 -18.434 82.722 1.00 36.31 ? 212 ASP C OD2 1 +ATOM 13076 N N . ILE C 1 213 ? -20.007 -21.710 79.821 1.00 35.20 ? 213 ILE C N 1 +ATOM 13077 C CA . ILE C 1 213 ? -19.764 -22.324 78.513 1.00 35.52 ? 213 ILE C CA 1 +ATOM 13078 C C . ILE C 1 213 ? -18.907 -23.585 78.341 1.00 36.27 ? 213 ILE C C 1 +ATOM 13079 O O . ILE C 1 213 ? -18.969 -24.220 77.288 1.00 36.49 ? 213 ILE C O 1 +ATOM 13080 C CB . ILE C 1 213 ? -19.269 -21.261 77.500 1.00 35.06 ? 213 ILE C CB 1 +ATOM 13081 C CG1 . ILE C 1 213 ? -17.890 -20.729 77.899 1.00 33.39 ? 213 ILE C CG1 1 +ATOM 13082 C CG2 . ILE C 1 213 ? -20.285 -20.131 77.419 1.00 33.67 ? 213 ILE C CG2 1 +ATOM 13083 C CD1 . ILE C 1 213 ? -17.315 -19.727 76.906 1.00 30.99 ? 213 ILE C CD1 1 +ATOM 13084 N N . HIS C 1 214 ? -18.122 -23.965 79.342 1.00 36.84 ? 214 HIS C N 1 +ATOM 13085 C CA . HIS C 1 214 ? -17.303 -25.169 79.207 1.00 36.38 ? 214 HIS C CA 1 +ATOM 13086 C C . HIS C 1 214 ? -18.144 -26.450 79.166 1.00 35.96 ? 214 HIS C C 1 +ATOM 13087 O O . HIS C 1 214 ? -17.648 -27.505 78.771 1.00 34.20 ? 214 HIS C O 1 +ATOM 13088 C CB . HIS C 1 214 ? -16.299 -25.290 80.359 1.00 38.31 ? 214 HIS C CB 1 +ATOM 13089 C CG . HIS C 1 214 ? -15.121 -24.375 80.245 1.00 38.58 ? 214 HIS C CG 1 +ATOM 13090 N ND1 . HIS C 1 214 ? -15.177 -23.040 80.579 1.00 39.28 ? 214 HIS C ND1 1 +ATOM 13091 C CD2 . HIS C 1 214 ? -13.848 -24.611 79.849 1.00 39.19 ? 214 HIS C CD2 1 +ATOM 13092 C CE1 . HIS C 1 214 ? -13.990 -22.490 80.395 1.00 40.80 ? 214 HIS C CE1 1 +ATOM 13093 N NE2 . HIS C 1 214 ? -13.165 -23.422 79.953 1.00 41.11 ? 214 HIS C NE2 1 +ATOM 13094 N N . TYR C 1 215 ? -19.410 -26.363 79.568 1.00 35.52 ? 215 TYR C N 1 +ATOM 13095 C CA . TYR C 1 215 ? -20.267 -27.547 79.573 1.00 36.37 ? 215 TYR C CA 1 +ATOM 13096 C C . TYR C 1 215 ? -20.742 -27.955 78.185 1.00 36.97 ? 215 TYR C C 1 +ATOM 13097 O O . TYR C 1 215 ? -21.123 -29.105 77.973 1.00 37.55 ? 215 TYR C O 1 +ATOM 13098 C CB . TYR C 1 215 ? -21.483 -27.333 80.486 1.00 34.92 ? 215 TYR C CB 1 +ATOM 13099 C CG . TYR C 1 215 ? -22.648 -26.582 79.868 1.00 34.43 ? 215 TYR C CG 1 +ATOM 13100 C CD1 . TYR C 1 215 ? -23.465 -27.182 78.909 1.00 35.10 ? 215 TYR C CD1 1 +ATOM 13101 C CD2 . TYR C 1 215 ? -22.958 -25.281 80.273 1.00 34.35 ? 215 TYR C CD2 1 +ATOM 13102 C CE1 . TYR C 1 215 ? -24.563 -26.509 78.373 1.00 34.65 ? 215 TYR C CE1 1 +ATOM 13103 C CE2 . TYR C 1 215 ? -24.053 -24.599 79.747 1.00 32.97 ? 215 TYR C CE2 1 +ATOM 13104 C CZ . TYR C 1 215 ? -24.851 -25.221 78.799 1.00 33.63 ? 215 TYR C CZ 1 +ATOM 13105 O OH . TYR C 1 215 ? -25.939 -24.560 78.287 1.00 31.45 ? 215 TYR C OH 1 +ATOM 13106 N N . MET C 1 216 ? -20.724 -27.013 77.247 1.00 38.04 ? 216 MET C N 1 +ATOM 13107 C CA . MET C 1 216 ? -21.163 -27.271 75.880 1.00 38.59 ? 216 MET C CA 1 +ATOM 13108 C C . MET C 1 216 ? -20.133 -28.017 75.051 1.00 38.99 ? 216 MET C C 1 +ATOM 13109 O O . MET C 1 216 ? -18.954 -28.094 75.400 1.00 38.76 ? 216 MET C O 1 +ATOM 13110 C CB . MET C 1 216 ? -21.483 -25.958 75.165 1.00 39.42 ? 216 MET C CB 1 +ATOM 13111 C CG . MET C 1 216 ? -22.648 -25.182 75.745 1.00 42.53 ? 216 MET C CG 1 +ATOM 13112 S SD . MET C 1 216 ? -22.881 -23.575 74.922 1.00 43.48 ? 216 MET C SD 1 +ATOM 13113 C CE . MET C 1 216 ? -22.333 -22.483 76.163 1.00 44.68 ? 216 MET C CE 1 +ATOM 13114 N N . ASP C 1 217 ? -20.594 -28.559 73.934 1.00 40.25 ? 217 ASP C N 1 +ATOM 13115 C CA . ASP C 1 217 ? -19.724 -29.273 73.015 1.00 41.10 ? 217 ASP C CA 1 +ATOM 13116 C C . ASP C 1 217 ? -19.244 -28.244 71.997 1.00 41.43 ? 217 ASP C C 1 +ATOM 13117 O O . ASP C 1 217 ? -20.006 -27.831 71.128 1.00 40.11 ? 217 ASP C O 1 +ATOM 13118 C CB . ASP C 1 217 ? -20.510 -30.398 72.333 1.00 42.23 ? 217 ASP C CB 1 +ATOM 13119 C CG . ASP C 1 217 ? -19.753 -31.034 71.183 1.00 44.05 ? 217 ASP C CG 1 +ATOM 13120 O OD1 . ASP C 1 217 ? -18.501 -30.993 71.176 1.00 44.47 ? 217 ASP C OD1 1 +ATOM 13121 O OD2 . ASP C 1 217 ? -20.424 -31.590 70.287 1.00 45.61 ? 217 ASP C OD2 1 +ATOM 13122 N N . SER C 1 218 ? -17.985 -27.820 72.123 1.00 42.71 ? 218 SER C N 1 +ATOM 13123 C CA . SER C 1 218 ? -17.416 -26.821 71.222 1.00 42.46 ? 218 SER C CA 1 +ATOM 13124 C C . SER C 1 218 ? -18.231 -25.522 71.251 1.00 42.07 ? 218 SER C C 1 +ATOM 13125 O O . SER C 1 218 ? -18.384 -24.848 70.229 1.00 41.66 ? 218 SER C O 1 +ATOM 13126 C CB . SER C 1 218 ? -17.379 -27.350 69.788 1.00 42.78 ? 218 SER C CB 1 +ATOM 13127 O OG . SER C 1 218 ? -16.547 -28.488 69.680 1.00 46.94 ? 218 SER C OG 1 +ATOM 13128 N N . TYR C 1 219 ? -18.767 -25.187 72.418 1.00 40.61 ? 219 TYR C N 1 +ATOM 13129 C CA . TYR C 1 219 ? -19.555 -23.972 72.591 1.00 40.28 ? 219 TYR C CA 1 +ATOM 13130 C C . TYR C 1 219 ? -20.864 -23.967 71.804 1.00 40.26 ? 219 TYR C C 1 +ATOM 13131 O O . TYR C 1 219 ? -21.455 -22.913 71.578 1.00 40.34 ? 219 TYR C O 1 +ATOM 13132 C CB . TYR C 1 219 ? -18.714 -22.749 72.214 1.00 41.03 ? 219 TYR C CB 1 +ATOM 13133 C CG . TYR C 1 219 ? -17.385 -22.708 72.937 1.00 42.04 ? 219 TYR C CG 1 +ATOM 13134 C CD1 . TYR C 1 219 ? -17.330 -22.532 74.315 1.00 42.02 ? 219 TYR C CD1 1 +ATOM 13135 C CD2 . TYR C 1 219 ? -16.187 -22.912 72.250 1.00 41.54 ? 219 TYR C CD2 1 +ATOM 13136 C CE1 . TYR C 1 219 ? -16.119 -22.566 74.998 1.00 43.34 ? 219 TYR C CE1 1 +ATOM 13137 C CE2 . TYR C 1 219 ? -14.969 -22.947 72.922 1.00 41.93 ? 219 TYR C CE2 1 +ATOM 13138 C CZ . TYR C 1 219 ? -14.944 -22.776 74.296 1.00 44.18 ? 219 TYR C CZ 1 +ATOM 13139 O OH . TYR C 1 219 ? -13.749 -22.832 74.977 1.00 45.77 ? 219 TYR C OH 1 +ATOM 13140 N N . LYS C 1 220 ? -21.327 -25.142 71.395 1.00 39.88 ? 220 LYS C N 1 +ATOM 13141 C CA . LYS C 1 220 ? -22.584 -25.231 70.656 1.00 40.01 ? 220 LYS C CA 1 +ATOM 13142 C C . LYS C 1 220 ? -23.780 -25.208 71.604 1.00 39.05 ? 220 LYS C C 1 +ATOM 13143 O O . LYS C 1 220 ? -23.896 -26.050 72.496 1.00 38.50 ? 220 LYS C O 1 +ATOM 13144 C CB . LYS C 1 220 ? -22.625 -26.509 69.806 1.00 42.12 ? 220 LYS C CB 1 +ATOM 13145 C CG . LYS C 1 220 ? -21.749 -26.440 68.565 1.00 45.84 ? 220 LYS C CG 1 +ATOM 13146 C CD . LYS C 1 220 ? -21.905 -27.657 67.676 1.00 46.68 ? 220 LYS C CD 1 +ATOM 13147 C CE . LYS C 1 220 ? -21.204 -28.857 68.274 1.00 49.95 ? 220 LYS C CE 1 +ATOM 13148 N NZ . LYS C 1 220 ? -21.008 -29.942 67.260 1.00 51.73 ? 220 LYS C NZ 1 +ATOM 13149 N N . LEU C 1 221 ? -24.671 -24.240 71.416 1.00 36.58 ? 221 LEU C N 1 +ATOM 13150 C CA . LEU C 1 221 ? -25.843 -24.142 72.267 1.00 35.91 ? 221 LEU C CA 1 +ATOM 13151 C C . LEU C 1 221 ? -26.640 -25.436 72.283 1.00 35.57 ? 221 LEU C C 1 +ATOM 13152 O O . LEU C 1 221 ? -26.730 -26.144 71.284 1.00 35.28 ? 221 LEU C O 1 +ATOM 13153 C CB . LEU C 1 221 ? -26.763 -23.008 71.809 1.00 36.89 ? 221 LEU C CB 1 +ATOM 13154 C CG . LEU C 1 221 ? -26.149 -21.614 71.673 1.00 39.51 ? 221 LEU C CG 1 +ATOM 13155 C CD1 . LEU C 1 221 ? -27.267 -20.609 71.407 1.00 36.86 ? 221 LEU C CD1 1 +ATOM 13156 C CD2 . LEU C 1 221 ? -25.371 -21.246 72.945 1.00 38.85 ? 221 LEU C CD2 1 +ATOM 13157 N N . PHE C 1 222 ? -27.215 -25.737 73.440 1.00 36.38 ? 222 PHE C N 1 +ATOM 13158 C CA . PHE C 1 222 ? -28.038 -26.923 73.622 1.00 35.28 ? 222 PHE C CA 1 +ATOM 13159 C C . PHE C 1 222 ? -27.344 -28.250 73.362 1.00 34.89 ? 222 PHE C C 1 +ATOM 13160 O O . PHE C 1 222 ? -27.928 -29.148 72.784 1.00 35.56 ? 222 PHE C O 1 +ATOM 13161 C CB . PHE C 1 222 ? -29.290 -26.796 72.759 1.00 33.45 ? 222 PHE C CB 1 +ATOM 13162 C CG . PHE C 1 222 ? -29.972 -25.471 72.906 1.00 32.32 ? 222 PHE C CG 1 +ATOM 13163 C CD1 . PHE C 1 222 ? -30.431 -25.051 74.150 1.00 31.99 ? 222 PHE C CD1 1 +ATOM 13164 C CD2 . PHE C 1 222 ? -30.122 -24.622 71.812 1.00 32.00 ? 222 PHE C CD2 1 +ATOM 13165 C CE1 . PHE C 1 222 ? -31.031 -23.798 74.308 1.00 33.68 ? 222 PHE C CE1 1 +ATOM 13166 C CE2 . PHE C 1 222 ? -30.718 -23.368 71.953 1.00 32.39 ? 222 PHE C CE2 1 +ATOM 13167 C CZ . PHE C 1 222 ? -31.175 -22.952 73.204 1.00 33.24 ? 222 PHE C CZ 1 +ATOM 13168 N N . THR C 1 223 ? -26.093 -28.364 73.792 1.00 35.26 ? 223 THR C N 1 +ATOM 13169 C CA . THR C 1 223 ? -25.346 -29.606 73.654 1.00 35.64 ? 223 THR C CA 1 +ATOM 13170 C C . THR C 1 223 ? -24.537 -29.798 74.930 1.00 35.76 ? 223 THR C C 1 +ATOM 13171 O O . THR C 1 223 ? -24.316 -28.848 75.682 1.00 36.15 ? 223 THR C O 1 +ATOM 13172 C CB . THR C 1 223 ? -24.346 -29.579 72.483 1.00 36.75 ? 223 THR C CB 1 +ATOM 13173 O OG1 . THR C 1 223 ? -23.270 -28.682 72.799 1.00 36.59 ? 223 THR C OG1 1 +ATOM 13174 C CG2 . THR C 1 223 ? -25.036 -29.157 71.198 1.00 34.23 ? 223 THR C CG2 1 +ATOM 13175 N N . TRP C 1 224 ? -24.105 -31.029 75.175 1.00 35.09 ? 224 TRP C N 1 +ATOM 13176 C CA . TRP C 1 224 ? -23.302 -31.325 76.345 1.00 33.82 ? 224 TRP C CA 1 +ATOM 13177 C C . TRP C 1 224 ? -21.947 -31.814 75.874 1.00 35.87 ? 224 TRP C C 1 +ATOM 13178 O O . TRP C 1 224 ? -21.850 -32.599 74.932 1.00 36.58 ? 224 TRP C O 1 +ATOM 13179 C CB . TRP C 1 224 ? -23.958 -32.403 77.204 1.00 31.67 ? 224 TRP C CB 1 +ATOM 13180 C CG . TRP C 1 224 ? -25.195 -31.963 77.900 1.00 31.00 ? 224 TRP C CG 1 +ATOM 13181 C CD1 . TRP C 1 224 ? -26.485 -32.192 77.509 1.00 30.26 ? 224 TRP C CD1 1 +ATOM 13182 C CD2 . TRP C 1 224 ? -25.271 -31.226 79.130 1.00 31.20 ? 224 TRP C CD2 1 +ATOM 13183 N NE1 . TRP C 1 224 ? -27.362 -31.650 78.424 1.00 31.47 ? 224 TRP C NE1 1 +ATOM 13184 C CE2 . TRP C 1 224 ? -26.646 -31.051 79.428 1.00 30.27 ? 224 TRP C CE2 1 +ATOM 13185 C CE3 . TRP C 1 224 ? -24.311 -30.700 80.010 1.00 29.31 ? 224 TRP C CE3 1 +ATOM 13186 C CZ2 . TRP C 1 224 ? -27.088 -30.373 80.570 1.00 30.35 ? 224 TRP C CZ2 1 +ATOM 13187 C CZ3 . TRP C 1 224 ? -24.748 -30.024 81.148 1.00 30.50 ? 224 TRP C CZ3 1 +ATOM 13188 C CH2 . TRP C 1 224 ? -26.130 -29.867 81.417 1.00 31.56 ? 224 TRP C CH2 1 +ATOM 13189 N N . HIS C 1 225 ? -20.893 -31.339 76.521 1.00 36.86 ? 225 HIS C N 1 +ATOM 13190 C CA . HIS C 1 225 ? -19.551 -31.758 76.156 1.00 38.26 ? 225 HIS C CA 1 +ATOM 13191 C C . HIS C 1 225 ? -19.488 -33.275 76.398 1.00 39.94 ? 225 HIS C C 1 +ATOM 13192 O O . HIS C 1 225 ? -19.707 -33.749 77.519 1.00 40.41 ? 225 HIS C O 1 +ATOM 13193 C CB . HIS C 1 225 ? -18.535 -31.019 77.023 1.00 36.95 ? 225 HIS C CB 1 +ATOM 13194 C CG . HIS C 1 225 ? -17.124 -31.198 76.577 1.00 37.87 ? 225 HIS C CG 1 +ATOM 13195 N ND1 . HIS C 1 225 ? -16.438 -32.381 76.739 1.00 38.27 ? 225 HIS C ND1 1 +ATOM 13196 C CD2 . HIS C 1 225 ? -16.269 -30.347 75.960 1.00 38.85 ? 225 HIS C CD2 1 +ATOM 13197 C CE1 . HIS C 1 225 ? -15.219 -32.251 76.242 1.00 38.13 ? 225 HIS C CE1 1 +ATOM 13198 N NE2 . HIS C 1 225 ? -15.092 -31.026 75.763 1.00 39.00 ? 225 HIS C NE2 1 +ATOM 13199 N N . PRO C 1 226 ? -19.193 -34.054 75.343 1.00 40.79 ? 226 PRO C N 1 +ATOM 13200 C CA . PRO C 1 226 ? -19.107 -35.520 75.414 1.00 40.39 ? 226 PRO C CA 1 +ATOM 13201 C C . PRO C 1 226 ? -18.132 -36.098 76.434 1.00 41.37 ? 226 PRO C C 1 +ATOM 13202 O O . PRO C 1 226 ? -18.321 -37.211 76.911 1.00 42.22 ? 226 PRO C O 1 +ATOM 13203 C CB . PRO C 1 226 ? -18.750 -35.911 73.983 1.00 38.71 ? 226 PRO C CB 1 +ATOM 13204 C CG . PRO C 1 226 ? -17.964 -34.732 73.499 1.00 38.88 ? 226 PRO C CG 1 +ATOM 13205 C CD . PRO C 1 226 ? -18.766 -33.569 74.018 1.00 39.52 ? 226 PRO C CD 1 +ATOM 13206 N N . TYR C 1 227 ? -17.092 -35.352 76.770 1.00 42.99 ? 227 TYR C N 1 +ATOM 13207 C CA . TYR C 1 227 ? -16.113 -35.837 77.731 1.00 44.18 ? 227 TYR C CA 1 +ATOM 13208 C C . TYR C 1 227 ? -16.282 -35.258 79.130 1.00 43.99 ? 227 TYR C C 1 +ATOM 13209 O O . TYR C 1 227 ? -16.043 -35.952 80.112 1.00 45.16 ? 227 TYR C O 1 +ATOM 13210 C CB . TYR C 1 227 ? -14.703 -35.579 77.195 1.00 46.54 ? 227 TYR C CB 1 +ATOM 13211 C CG . TYR C 1 227 ? -14.465 -36.321 75.898 1.00 51.50 ? 227 TYR C CG 1 +ATOM 13212 C CD1 . TYR C 1 227 ? -14.307 -37.712 75.890 1.00 52.68 ? 227 TYR C CD1 1 +ATOM 13213 C CD2 . TYR C 1 227 ? -14.509 -35.657 74.666 1.00 52.94 ? 227 TYR C CD2 1 +ATOM 13214 C CE1 . TYR C 1 227 ? -14.210 -38.425 74.695 1.00 53.35 ? 227 TYR C CE1 1 +ATOM 13215 C CE2 . TYR C 1 227 ? -14.413 -36.367 73.461 1.00 54.14 ? 227 TYR C CE2 1 +ATOM 13216 C CZ . TYR C 1 227 ? -14.267 -37.752 73.488 1.00 54.08 ? 227 TYR C CZ 1 +ATOM 13217 O OH . TYR C 1 227 ? -14.191 -38.468 72.311 1.00 55.35 ? 227 TYR C OH 1 +ATOM 13218 N N . ARG C 1 228 ? -16.712 -34.003 79.231 1.00 43.15 ? 228 ARG C N 1 +ATOM 13219 C CA . ARG C 1 228 ? -16.897 -33.377 80.538 1.00 41.68 ? 228 ARG C CA 1 +ATOM 13220 C C . ARG C 1 228 ? -18.280 -33.637 81.114 1.00 41.13 ? 228 ARG C C 1 +ATOM 13221 O O . ARG C 1 228 ? -18.458 -33.647 82.329 1.00 41.27 ? 228 ARG C O 1 +ATOM 13222 C CB . ARG C 1 228 ? -16.691 -31.870 80.451 1.00 42.03 ? 228 ARG C CB 1 +ATOM 13223 C CG . ARG C 1 228 ? -15.295 -31.437 80.099 1.00 40.53 ? 228 ARG C CG 1 +ATOM 13224 C CD . ARG C 1 228 ? -15.332 -29.992 79.631 1.00 40.26 ? 228 ARG C CD 1 +ATOM 13225 N NE . ARG C 1 228 ? -14.009 -29.519 79.265 1.00 42.19 ? 228 ARG C NE 1 +ATOM 13226 C CZ . ARG C 1 228 ? -13.787 -28.503 78.443 1.00 42.27 ? 228 ARG C CZ 1 +ATOM 13227 N NH1 . ARG C 1 228 ? -14.808 -27.853 77.901 1.00 43.32 ? 228 ARG C NH1 1 +ATOM 13228 N NH2 . ARG C 1 228 ? -12.542 -28.146 78.158 1.00 42.87 ? 228 ARG C NH2 1 +ATOM 13229 N N . PHE C 1 229 ? -19.267 -33.822 80.251 1.00 39.89 ? 229 PHE C N 1 +ATOM 13230 C CA . PHE C 1 229 ? -20.612 -34.080 80.734 1.00 41.76 ? 229 PHE C CA 1 +ATOM 13231 C C . PHE C 1 229 ? -21.263 -35.224 79.959 1.00 43.52 ? 229 PHE C C 1 +ATOM 13232 O O . PHE C 1 229 ? -22.324 -35.069 79.356 1.00 43.01 ? 229 PHE C O 1 +ATOM 13233 C CB . PHE C 1 229 ? -21.460 -32.803 80.654 1.00 41.17 ? 229 PHE C CB 1 +ATOM 13234 C CG . PHE C 1 229 ? -21.010 -31.717 81.608 1.00 40.95 ? 229 PHE C CG 1 +ATOM 13235 C CD1 . PHE C 1 229 ? -19.869 -30.959 81.342 1.00 40.14 ? 229 PHE C CD1 1 +ATOM 13236 C CD2 . PHE C 1 229 ? -21.693 -31.494 82.801 1.00 39.85 ? 229 PHE C CD2 1 +ATOM 13237 C CE1 . PHE C 1 229 ? -19.414 -30.005 82.251 1.00 39.16 ? 229 PHE C CE1 1 +ATOM 13238 C CE2 . PHE C 1 229 ? -21.242 -30.540 83.713 1.00 39.58 ? 229 PHE C CE2 1 +ATOM 13239 C CZ . PHE C 1 229 ? -20.097 -29.797 83.434 1.00 38.55 ? 229 PHE C CZ 1 +ATOM 13240 N N . PRO C 1 230 ? -20.626 -36.403 79.982 1.00 44.42 ? 230 PRO C N 1 +ATOM 13241 C CA . PRO C 1 230 ? -21.134 -37.581 79.282 1.00 45.26 ? 230 PRO C CA 1 +ATOM 13242 C C . PRO C 1 230 ? -22.479 -38.097 79.786 1.00 46.69 ? 230 PRO C C 1 +ATOM 13243 O O . PRO C 1 230 ? -23.246 -38.679 79.023 1.00 47.57 ? 230 PRO C O 1 +ATOM 13244 C CB . PRO C 1 230 ? -20.006 -38.590 79.459 1.00 45.28 ? 230 PRO C CB 1 +ATOM 13245 C CG . PRO C 1 230 ? -19.413 -38.203 80.780 1.00 45.23 ? 230 PRO C CG 1 +ATOM 13246 C CD . PRO C 1 230 ? -19.369 -36.711 80.689 1.00 44.98 ? 230 PRO C CD 1 +ATOM 13247 N N . GLU C 1 231 ? -22.774 -37.880 81.061 1.00 48.10 ? 231 GLU C N 1 +ATOM 13248 C CA . GLU C 1 231 ? -24.036 -38.343 81.623 1.00 49.37 ? 231 GLU C CA 1 +ATOM 13249 C C . GLU C 1 231 ? -24.779 -37.204 82.320 1.00 48.39 ? 231 GLU C C 1 +ATOM 13250 O O . GLU C 1 231 ? -24.940 -37.178 83.535 1.00 48.43 ? 231 GLU C O 1 +ATOM 13251 C CB . GLU C 1 231 ? -23.765 -39.526 82.567 1.00 52.09 ? 231 GLU C CB 1 +ATOM 13252 C CG . GLU C 1 231 ? -23.399 -40.807 81.797 1.00 58.40 ? 231 GLU C CG 1 +ATOM 13253 C CD . GLU C 1 231 ? -22.909 -41.972 82.672 1.00 63.06 ? 231 GLU C CD 1 +ATOM 13254 O OE1 . GLU C 1 231 ? -23.570 -42.301 83.689 1.00 64.39 ? 231 GLU C OE1 1 +ATOM 13255 O OE2 . GLU C 1 231 ? -21.864 -42.577 82.320 1.00 64.70 ? 231 GLU C OE2 1 +ATOM 13256 N N . PRO C 1 232 ? -25.253 -36.237 81.536 1.00 48.34 ? 232 PRO C N 1 +ATOM 13257 C CA . PRO C 1 232 ? -25.977 -35.091 82.089 1.00 48.20 ? 232 PRO C CA 1 +ATOM 13258 C C . PRO C 1 232 ? -27.170 -35.436 82.977 1.00 49.05 ? 232 PRO C C 1 +ATOM 13259 O O . PRO C 1 232 ? -27.449 -34.734 83.956 1.00 49.31 ? 232 PRO C O 1 +ATOM 13260 C CB . PRO C 1 232 ? -26.371 -34.290 80.841 1.00 47.05 ? 232 PRO C CB 1 +ATOM 13261 C CG . PRO C 1 232 ? -26.381 -35.317 79.743 1.00 47.53 ? 232 PRO C CG 1 +ATOM 13262 C CD . PRO C 1 232 ? -25.190 -36.172 80.065 1.00 47.26 ? 232 PRO C CD 1 +ATOM 13263 N N . LYS C 1 233 ? -27.877 -36.508 82.638 1.00 49.70 ? 233 LYS C N 1 +ATOM 13264 C CA . LYS C 1 233 ? -29.040 -36.925 83.415 1.00 49.72 ? 233 LYS C CA 1 +ATOM 13265 C C . LYS C 1 233 ? -28.611 -37.298 84.832 1.00 48.60 ? 233 LYS C C 1 +ATOM 13266 O O . LYS C 1 233 ? -29.332 -37.060 85.801 1.00 48.61 ? 233 LYS C O 1 +ATOM 13267 C CB . LYS C 1 233 ? -29.716 -38.120 82.738 1.00 52.83 ? 233 LYS C CB 1 +ATOM 13268 C CG . LYS C 1 233 ? -30.982 -38.607 83.428 1.00 57.81 ? 233 LYS C CG 1 +ATOM 13269 C CD . LYS C 1 233 ? -31.516 -39.881 82.761 1.00 61.28 ? 233 LYS C CD 1 +ATOM 13270 C CE . LYS C 1 233 ? -32.757 -40.424 83.483 1.00 62.80 ? 233 LYS C CE 1 +ATOM 13271 N NZ . LYS C 1 233 ? -32.488 -40.790 84.909 1.00 63.24 ? 233 LYS C NZ 1 +ATOM 13272 N N . LYS C 1 234 ? -27.423 -37.878 84.949 1.00 47.47 ? 234 LYS C N 1 +ATOM 13273 C CA . LYS C 1 234 ? -26.907 -38.272 86.249 1.00 47.21 ? 234 LYS C CA 1 +ATOM 13274 C C . LYS C 1 234 ? -26.556 -37.048 87.101 1.00 46.63 ? 234 LYS C C 1 +ATOM 13275 O O . LYS C 1 234 ? -26.759 -37.066 88.318 1.00 44.95 ? 234 LYS C O 1 +ATOM 13276 C CB . LYS C 1 234 ? -25.674 -39.164 86.085 1.00 46.80 ? 234 LYS C CB 1 +ATOM 13277 C CG . LYS C 1 234 ? -25.073 -39.606 87.403 1.00 49.53 ? 234 LYS C CG 1 +ATOM 13278 C CD . LYS C 1 234 ? -23.711 -40.272 87.215 1.00 52.06 ? 234 LYS C CD 1 +ATOM 13279 C CE . LYS C 1 234 ? -23.027 -40.517 88.562 1.00 52.92 ? 234 LYS C CE 1 +ATOM 13280 N NZ . LYS C 1 234 ? -21.606 -40.941 88.392 1.00 54.15 ? 234 LYS C NZ 1 +ATOM 13281 N N . LEU C 1 235 ? -26.026 -35.997 86.463 1.00 46.47 ? 235 LEU C N 1 +ATOM 13282 C CA . LEU C 1 235 ? -25.652 -34.762 87.164 1.00 45.41 ? 235 LEU C CA 1 +ATOM 13283 C C . LEU C 1 235 ? -26.873 -34.055 87.714 1.00 45.14 ? 235 LEU C C 1 +ATOM 13284 O O . LEU C 1 235 ? -26.884 -33.605 88.858 1.00 45.57 ? 235 LEU C O 1 +ATOM 13285 C CB . LEU C 1 235 ? -24.916 -33.798 86.233 1.00 46.23 ? 235 LEU C CB 1 +ATOM 13286 C CG . LEU C 1 235 ? -24.668 -32.389 86.803 1.00 46.25 ? 235 LEU C CG 1 +ATOM 13287 C CD1 . LEU C 1 235 ? -23.786 -32.458 88.040 1.00 45.87 ? 235 LEU C CD1 1 +ATOM 13288 C CD2 . LEU C 1 235 ? -24.005 -31.524 85.748 1.00 46.57 ? 235 LEU C CD2 1 +ATOM 13289 N N . ILE C 1 236 ? -27.906 -33.960 86.891 1.00 45.37 ? 236 ILE C N 1 +ATOM 13290 C CA . ILE C 1 236 ? -29.140 -33.305 87.296 1.00 45.80 ? 236 ILE C CA 1 +ATOM 13291 C C . ILE C 1 236 ? -29.779 -33.989 88.506 1.00 46.88 ? 236 ILE C C 1 +ATOM 13292 O O . ILE C 1 236 ? -30.210 -33.320 89.442 1.00 47.10 ? 236 ILE C O 1 +ATOM 13293 C CB . ILE C 1 236 ? -30.123 -33.247 86.103 1.00 44.28 ? 236 ILE C CB 1 +ATOM 13294 C CG1 . ILE C 1 236 ? -29.497 -32.385 84.993 1.00 43.62 ? 236 ILE C CG1 1 +ATOM 13295 C CG2 . ILE C 1 236 ? -31.474 -32.698 86.546 1.00 41.91 ? 236 ILE C CG2 1 +ATOM 13296 C CD1 . ILE C 1 236 ? -30.275 -32.357 83.688 1.00 43.63 ? 236 ILE C CD1 1 +ATOM 13297 N N . ASP C 1 237 ? -29.819 -35.317 88.509 1.00 48.55 ? 237 ASP C N 1 +ATOM 13298 C CA . ASP C 1 237 ? -30.404 -36.028 89.638 1.00 50.33 ? 237 ASP C CA 1 +ATOM 13299 C C . ASP C 1 237 ? -29.576 -35.895 90.909 1.00 49.34 ? 237 ASP C C 1 +ATOM 13300 O O . ASP C 1 237 ? -30.130 -35.775 92.002 1.00 48.05 ? 237 ASP C O 1 +ATOM 13301 C CB . ASP C 1 237 ? -30.611 -37.506 89.295 1.00 54.10 ? 237 ASP C CB 1 +ATOM 13302 C CG . ASP C 1 237 ? -31.692 -37.706 88.242 1.00 59.20 ? 237 ASP C CG 1 +ATOM 13303 O OD1 . ASP C 1 237 ? -32.672 -36.918 88.243 1.00 61.76 ? 237 ASP C OD1 1 +ATOM 13304 O OD2 . ASP C 1 237 ? -31.574 -38.649 87.423 1.00 61.24 ? 237 ASP C OD2 1 +ATOM 13305 N N . GLU C 1 238 ? -28.254 -35.906 90.768 1.00 49.50 ? 238 GLU C N 1 +ATOM 13306 C CA . GLU C 1 238 ? -27.367 -35.773 91.922 1.00 51.34 ? 238 GLU C CA 1 +ATOM 13307 C C . GLU C 1 238 ? -27.542 -34.437 92.616 1.00 50.38 ? 238 GLU C C 1 +ATOM 13308 O O . GLU C 1 238 ? -27.590 -34.373 93.845 1.00 49.96 ? 238 GLU C O 1 +ATOM 13309 C CB . GLU C 1 238 ? -25.908 -35.934 91.503 1.00 54.90 ? 238 GLU C CB 1 +ATOM 13310 C CG . GLU C 1 238 ? -25.606 -37.311 90.949 1.00 62.00 ? 238 GLU C CG 1 +ATOM 13311 C CD . GLU C 1 238 ? -24.124 -37.566 90.760 1.00 66.23 ? 238 GLU C CD 1 +ATOM 13312 O OE1 . GLU C 1 238 ? -23.479 -36.816 89.990 1.00 69.09 ? 238 GLU C OE1 1 +ATOM 13313 O OE2 . GLU C 1 238 ? -23.610 -38.526 91.382 1.00 67.71 ? 238 GLU C OE2 1 +ATOM 13314 N N . LEU C 1 239 ? -27.637 -33.370 91.825 1.00 49.33 ? 239 LEU C N 1 +ATOM 13315 C CA . LEU C 1 239 ? -27.814 -32.029 92.375 1.00 47.98 ? 239 LEU C CA 1 +ATOM 13316 C C . LEU C 1 239 ? -29.217 -31.863 92.943 1.00 47.27 ? 239 LEU C C 1 +ATOM 13317 O O . LEU C 1 239 ? -29.402 -31.230 93.984 1.00 47.16 ? 239 LEU C O 1 +ATOM 13318 C CB . LEU C 1 239 ? -27.562 -30.964 91.300 1.00 47.36 ? 239 LEU C CB 1 +ATOM 13319 C CG . LEU C 1 239 ? -26.141 -30.849 90.742 1.00 47.84 ? 239 LEU C CG 1 +ATOM 13320 C CD1 . LEU C 1 239 ? -26.132 -29.919 89.537 1.00 46.85 ? 239 LEU C CD1 1 +ATOM 13321 C CD2 . LEU C 1 239 ? -25.200 -30.344 91.832 1.00 48.03 ? 239 LEU C CD2 1 +ATOM 13322 N N . HIS C 1 240 ? -30.210 -32.425 92.262 1.00 46.79 ? 240 HIS C N 1 +ATOM 13323 C CA . HIS C 1 240 ? -31.583 -32.319 92.748 1.00 47.72 ? 240 HIS C CA 1 +ATOM 13324 C C . HIS C 1 240 ? -31.752 -33.088 94.050 1.00 47.84 ? 240 HIS C C 1 +ATOM 13325 O O . HIS C 1 240 ? -32.533 -32.690 94.916 1.00 48.32 ? 240 HIS C O 1 +ATOM 13326 C CB . HIS C 1 240 ? -32.564 -32.820 91.688 1.00 47.96 ? 240 HIS C CB 1 +ATOM 13327 C CG . HIS C 1 240 ? -32.818 -31.823 90.601 1.00 50.46 ? 240 HIS C CG 1 +ATOM 13328 N ND1 . HIS C 1 240 ? -33.321 -32.173 89.366 1.00 51.94 ? 240 HIS C ND1 1 +ATOM 13329 C CD2 . HIS C 1 240 ? -32.639 -30.481 90.568 1.00 50.55 ? 240 HIS C CD2 1 +ATOM 13330 C CE1 . HIS C 1 240 ? -33.438 -31.090 88.619 1.00 51.32 ? 240 HIS C CE1 1 +ATOM 13331 N NE2 . HIS C 1 240 ? -33.031 -30.051 89.324 1.00 51.44 ? 240 HIS C NE2 1 +ATOM 13332 N N . LYS C 1 241 ? -31.007 -34.182 94.184 1.00 46.54 ? 241 LYS C N 1 +ATOM 13333 C CA . LYS C 1 241 ? -31.045 -34.997 95.390 1.00 47.05 ? 241 LYS C CA 1 +ATOM 13334 C C . LYS C 1 241 ? -30.537 -34.162 96.573 1.00 45.59 ? 241 LYS C C 1 +ATOM 13335 O O . LYS C 1 241 ? -31.009 -34.295 97.703 1.00 45.34 ? 241 LYS C O 1 +ATOM 13336 C CB . LYS C 1 241 ? -30.168 -36.241 95.195 1.00 48.51 ? 241 LYS C CB 1 +ATOM 13337 C CG . LYS C 1 241 ? -29.951 -37.074 96.451 1.00 52.93 ? 241 LYS C CG 1 +ATOM 13338 C CD . LYS C 1 241 ? -29.240 -38.403 96.144 1.00 57.21 ? 241 LYS C CD 1 +ATOM 13339 C CE . LYS C 1 241 ? -27.913 -38.192 95.409 1.00 59.34 ? 241 LYS C CE 1 +ATOM 13340 N NZ . LYS C 1 241 ? -27.216 -39.479 95.090 1.00 60.19 ? 241 LYS C NZ 1 +ATOM 13341 N N . ARG C 1 242 ? -29.572 -33.297 96.292 1.00 43.59 ? 242 ARG C N 1 +ATOM 13342 C CA . ARG C 1 242 ? -28.987 -32.432 97.298 1.00 41.46 ? 242 ARG C CA 1 +ATOM 13343 C C . ARG C 1 242 ? -29.777 -31.116 97.349 1.00 41.83 ? 242 ARG C C 1 +ATOM 13344 O O . ARG C 1 242 ? -29.397 -30.159 98.025 1.00 40.51 ? 242 ARG C O 1 +ATOM 13345 C CB . ARG C 1 242 ? -27.520 -32.187 96.947 1.00 39.27 ? 242 ARG C CB 1 +ATOM 13346 C CG . ARG C 1 242 ? -26.685 -33.460 96.882 1.00 36.95 ? 242 ARG C CG 1 +ATOM 13347 C CD . ARG C 1 242 ? -25.328 -33.167 96.257 1.00 38.47 ? 242 ARG C CD 1 +ATOM 13348 N NE . ARG C 1 242 ? -24.342 -34.234 96.430 1.00 37.05 ? 242 ARG C NE 1 +ATOM 13349 C CZ . ARG C 1 242 ? -24.444 -35.468 95.940 1.00 39.16 ? 242 ARG C CZ 1 +ATOM 13350 N NH1 . ARG C 1 242 ? -25.506 -35.833 95.224 1.00 39.18 ? 242 ARG C NH1 1 +ATOM 13351 N NH2 . ARG C 1 242 ? -23.468 -36.343 96.160 1.00 37.66 ? 242 ARG C NH2 1 +ATOM 13352 N N . ASN C 1 243 ? -30.889 -31.088 96.627 1.00 42.22 ? 243 ASN C N 1 +ATOM 13353 C CA . ASN C 1 243 ? -31.761 -29.915 96.579 1.00 44.13 ? 243 ASN C CA 1 +ATOM 13354 C C . ASN C 1 243 ? -31.067 -28.626 96.103 1.00 42.03 ? 243 ASN C C 1 +ATOM 13355 O O . ASN C 1 243 ? -31.228 -27.546 96.681 1.00 40.74 ? 243 ASN C O 1 +ATOM 13356 C CB . ASN C 1 243 ? -32.413 -29.679 97.948 1.00 47.31 ? 243 ASN C CB 1 +ATOM 13357 C CG . ASN C 1 243 ? -33.579 -28.697 97.871 1.00 51.70 ? 243 ASN C CG 1 +ATOM 13358 O OD1 . ASN C 1 243 ? -34.111 -28.264 98.894 1.00 55.27 ? 243 ASN C OD1 1 +ATOM 13359 N ND2 . ASN C 1 243 ? -33.981 -28.344 96.650 1.00 52.84 ? 243 ASN C ND2 1 +ATOM 13360 N N . VAL C 1 244 ? -30.307 -28.763 95.024 1.00 39.34 ? 244 VAL C N 1 +ATOM 13361 C CA . VAL C 1 244 ? -29.576 -27.660 94.421 1.00 36.85 ? 244 VAL C CA 1 +ATOM 13362 C C . VAL C 1 244 ? -30.060 -27.485 92.988 1.00 36.64 ? 244 VAL C C 1 +ATOM 13363 O O . VAL C 1 244 ? -30.126 -28.448 92.225 1.00 36.80 ? 244 VAL C O 1 +ATOM 13364 C CB . VAL C 1 244 ? -28.062 -27.960 94.426 1.00 35.45 ? 244 VAL C CB 1 +ATOM 13365 C CG1 . VAL C 1 244 ? -27.317 -26.952 93.594 1.00 31.71 ? 244 VAL C CG1 1 +ATOM 13366 C CG2 . VAL C 1 244 ? -27.553 -27.950 95.862 1.00 34.70 ? 244 VAL C CG2 1 +ATOM 13367 N N . LYS C 1 245 ? -30.411 -26.257 92.625 1.00 36.34 ? 245 LYS C N 1 +ATOM 13368 C CA . LYS C 1 245 ? -30.890 -25.972 91.277 1.00 35.94 ? 245 LYS C CA 1 +ATOM 13369 C C . LYS C 1 245 ? -29.728 -25.905 90.301 1.00 36.45 ? 245 LYS C C 1 +ATOM 13370 O O . LYS C 1 245 ? -28.591 -25.650 90.699 1.00 36.05 ? 245 LYS C O 1 +ATOM 13371 C CB . LYS C 1 245 ? -31.632 -24.639 91.246 1.00 36.35 ? 245 LYS C CB 1 +ATOM 13372 C CG . LYS C 1 245 ? -32.771 -24.546 92.221 1.00 37.24 ? 245 LYS C CG 1 +ATOM 13373 C CD . LYS C 1 245 ? -33.864 -25.528 91.867 1.00 36.97 ? 245 LYS C CD 1 +ATOM 13374 C CE . LYS C 1 245 ? -34.938 -25.507 92.914 1.00 38.55 ? 245 LYS C CE 1 +ATOM 13375 N NZ . LYS C 1 245 ? -36.067 -26.394 92.529 1.00 43.80 ? 245 LYS C NZ 1 +ATOM 13376 N N . LEU C 1 246 ? -30.017 -26.142 89.023 1.00 36.52 ? 246 LEU C N 1 +ATOM 13377 C CA . LEU C 1 246 ? -28.997 -26.084 87.985 1.00 36.05 ? 246 LEU C CA 1 +ATOM 13378 C C . LEU C 1 246 ? -29.377 -25.022 86.966 1.00 36.75 ? 246 LEU C C 1 +ATOM 13379 O O . LEU C 1 246 ? -30.445 -25.097 86.355 1.00 36.55 ? 246 LEU C O 1 +ATOM 13380 C CB . LEU C 1 246 ? -28.854 -27.432 87.272 1.00 35.83 ? 246 LEU C CB 1 +ATOM 13381 C CG . LEU C 1 246 ? -27.879 -27.407 86.079 1.00 36.13 ? 246 LEU C CG 1 +ATOM 13382 C CD1 . LEU C 1 246 ? -26.449 -27.132 86.567 1.00 36.37 ? 246 LEU C CD1 1 +ATOM 13383 C CD2 . LEU C 1 246 ? -27.927 -28.731 85.341 1.00 35.13 ? 246 LEU C CD2 1 +ATOM 13384 N N . ILE C 1 247 ? -28.514 -24.020 86.804 1.00 36.26 ? 247 ILE C N 1 +ATOM 13385 C CA . ILE C 1 247 ? -28.761 -22.949 85.845 1.00 34.03 ? 247 ILE C CA 1 +ATOM 13386 C C . ILE C 1 247 ? -27.675 -23.047 84.778 1.00 34.04 ? 247 ILE C C 1 +ATOM 13387 O O . ILE C 1 247 ? -26.485 -23.112 85.091 1.00 34.31 ? 247 ILE C O 1 +ATOM 13388 C CB . ILE C 1 247 ? -28.709 -21.558 86.515 1.00 33.35 ? 247 ILE C CB 1 +ATOM 13389 C CG1 . ILE C 1 247 ? -29.825 -21.436 87.558 1.00 31.92 ? 247 ILE C CG1 1 +ATOM 13390 C CG2 . ILE C 1 247 ? -28.858 -20.464 85.467 1.00 31.36 ? 247 ILE C CG2 1 +ATOM 13391 C CD1 . ILE C 1 247 ? -29.481 -22.010 88.911 1.00 31.92 ? 247 ILE C CD1 1 +ATOM 13392 N N . THR C 1 248 ? -28.086 -23.069 83.518 1.00 32.57 ? 248 THR C N 1 +ATOM 13393 C CA . THR C 1 248 ? -27.135 -23.188 82.427 1.00 32.63 ? 248 THR C CA 1 +ATOM 13394 C C . THR C 1 248 ? -27.089 -21.936 81.567 1.00 32.18 ? 248 THR C C 1 +ATOM 13395 O O . THR C 1 248 ? -28.115 -21.346 81.242 1.00 29.99 ? 248 THR C O 1 +ATOM 13396 C CB . THR C 1 248 ? -27.482 -24.385 81.509 1.00 33.76 ? 248 THR C CB 1 +ATOM 13397 O OG1 . THR C 1 248 ? -28.803 -24.206 80.977 1.00 34.35 ? 248 THR C OG1 1 +ATOM 13398 C CG2 . THR C 1 248 ? -27.426 -25.702 82.286 1.00 33.66 ? 248 THR C CG2 1 +ATOM 13399 N N . ILE C 1 249 ? -25.880 -21.548 81.187 1.00 32.79 ? 249 ILE C N 1 +ATOM 13400 C CA . ILE C 1 249 ? -25.698 -20.378 80.357 1.00 32.90 ? 249 ILE C CA 1 +ATOM 13401 C C . ILE C 1 249 ? -26.108 -20.713 78.925 1.00 33.36 ? 249 ILE C C 1 +ATOM 13402 O O . ILE C 1 249 ? -25.926 -21.831 78.454 1.00 33.10 ? 249 ILE C O 1 +ATOM 13403 C CB . ILE C 1 249 ? -24.223 -19.899 80.388 1.00 32.87 ? 249 ILE C CB 1 +ATOM 13404 C CG1 . ILE C 1 249 ? -24.119 -18.491 79.801 1.00 33.54 ? 249 ILE C CG1 1 +ATOM 13405 C CG2 . ILE C 1 249 ? -23.336 -20.859 79.611 1.00 30.77 ? 249 ILE C CG2 1 +ATOM 13406 C CD1 . ILE C 1 249 ? -22.766 -17.857 80.019 1.00 33.58 ? 249 ILE C CD1 1 +ATOM 13407 N N . VAL C 1 250 ? -26.680 -19.731 78.249 1.00 33.77 ? 250 VAL C N 1 +ATOM 13408 C CA . VAL C 1 250 ? -27.109 -19.883 76.870 1.00 35.89 ? 250 VAL C CA 1 +ATOM 13409 C C . VAL C 1 250 ? -26.767 -18.590 76.133 1.00 36.93 ? 250 VAL C C 1 +ATOM 13410 O O . VAL C 1 250 ? -27.324 -17.537 76.435 1.00 36.25 ? 250 VAL C O 1 +ATOM 13411 C CB . VAL C 1 250 ? -28.636 -20.120 76.779 1.00 35.35 ? 250 VAL C CB 1 +ATOM 13412 C CG1 . VAL C 1 250 ? -29.073 -20.177 75.327 1.00 34.06 ? 250 VAL C CG1 1 +ATOM 13413 C CG2 . VAL C 1 250 ? -28.995 -21.409 77.493 1.00 37.10 ? 250 VAL C CG2 1 +ATOM 13414 N N . ASP C 1 251 ? -25.836 -18.663 75.187 1.00 37.76 ? 251 ASP C N 1 +ATOM 13415 C CA . ASP C 1 251 ? -25.471 -17.485 74.425 1.00 39.38 ? 251 ASP C CA 1 +ATOM 13416 C C . ASP C 1 251 ? -26.478 -17.312 73.291 1.00 40.82 ? 251 ASP C C 1 +ATOM 13417 O O . ASP C 1 251 ? -27.456 -18.056 73.203 1.00 41.19 ? 251 ASP C O 1 +ATOM 13418 C CB . ASP C 1 251 ? -24.062 -17.623 73.872 1.00 41.30 ? 251 ASP C CB 1 +ATOM 13419 C CG . ASP C 1 251 ? -23.034 -17.841 74.967 1.00 43.61 ? 251 ASP C CG 1 +ATOM 13420 O OD1 . ASP C 1 251 ? -22.852 -16.938 75.817 1.00 44.08 ? 251 ASP C OD1 1 +ATOM 13421 O OD2 . ASP C 1 251 ? -22.412 -18.926 74.979 1.00 44.88 ? 251 ASP C OD2 1 +ATOM 13422 N N . HIS C 1 252 ? -26.243 -16.333 72.426 1.00 41.14 ? 252 HIS C N 1 +ATOM 13423 C CA . HIS C 1 252 ? -27.164 -16.042 71.330 1.00 41.13 ? 252 HIS C CA 1 +ATOM 13424 C C . HIS C 1 252 ? -26.605 -16.441 69.969 1.00 40.37 ? 252 HIS C C 1 +ATOM 13425 O O . HIS C 1 252 ? -27.281 -16.286 68.953 1.00 42.09 ? 252 HIS C O 1 +ATOM 13426 C CB . HIS C 1 252 ? -27.486 -14.545 71.331 1.00 41.10 ? 252 HIS C CB 1 +ATOM 13427 C CG . HIS C 1 252 ? -26.290 -13.682 71.078 1.00 41.67 ? 252 HIS C CG 1 +ATOM 13428 N ND1 . HIS C 1 252 ? -25.066 -13.917 71.672 1.00 42.75 ? 252 HIS C ND1 1 +ATOM 13429 C CD2 . HIS C 1 252 ? -26.118 -12.605 70.276 1.00 41.27 ? 252 HIS C CD2 1 +ATOM 13430 C CE1 . HIS C 1 252 ? -24.192 -13.024 71.245 1.00 42.03 ? 252 HIS C CE1 1 +ATOM 13431 N NE2 . HIS C 1 252 ? -24.805 -12.216 70.397 1.00 42.85 ? 252 HIS C NE2 1 +ATOM 13432 N N . GLY C 1 253 ? -25.377 -16.950 69.949 1.00 38.59 ? 253 GLY C N 1 +ATOM 13433 C CA . GLY C 1 253 ? -24.766 -17.340 68.695 1.00 36.11 ? 253 GLY C CA 1 +ATOM 13434 C C . GLY C 1 253 ? -24.993 -18.779 68.271 1.00 35.22 ? 253 GLY C C 1 +ATOM 13435 O O . GLY C 1 253 ? -24.728 -19.714 69.026 1.00 34.14 ? 253 GLY C O 1 +ATOM 13436 N N . ILE C 1 254 ? -25.485 -18.947 67.046 1.00 34.17 ? 254 ILE C N 1 +ATOM 13437 C CA . ILE C 1 254 ? -25.740 -20.257 66.467 1.00 31.98 ? 254 ILE C CA 1 +ATOM 13438 C C . ILE C 1 254 ? -24.595 -20.579 65.513 1.00 33.48 ? 254 ILE C C 1 +ATOM 13439 O O . ILE C 1 254 ? -24.367 -19.865 64.532 1.00 33.15 ? 254 ILE C O 1 +ATOM 13440 C CB . ILE C 1 254 ? -27.062 -20.260 65.691 1.00 32.06 ? 254 ILE C CB 1 +ATOM 13441 C CG1 . ILE C 1 254 ? -28.226 -19.967 66.648 1.00 31.10 ? 254 ILE C CG1 1 +ATOM 13442 C CG2 . ILE C 1 254 ? -27.251 -21.591 64.992 1.00 32.97 ? 254 ILE C CG2 1 +ATOM 13443 C CD1 . ILE C 1 254 ? -28.438 -21.022 67.702 1.00 29.27 ? 254 ILE C CD1 1 +ATOM 13444 N N . ARG C 1 255 ? -23.866 -21.652 65.806 1.00 33.71 ? 255 ARG C N 1 +ATOM 13445 C CA . ARG C 1 255 ? -22.734 -22.047 64.985 1.00 32.91 ? 255 ARG C CA 1 +ATOM 13446 C C . ARG C 1 255 ? -23.121 -22.424 63.555 1.00 33.14 ? 255 ARG C C 1 +ATOM 13447 O O . ARG C 1 255 ? -24.059 -23.192 63.338 1.00 34.86 ? 255 ARG C O 1 +ATOM 13448 C CB . ARG C 1 255 ? -22.011 -23.206 65.661 1.00 33.04 ? 255 ARG C CB 1 +ATOM 13449 C CG . ARG C 1 255 ? -20.763 -23.656 64.939 1.00 34.30 ? 255 ARG C CG 1 +ATOM 13450 C CD . ARG C 1 255 ? -19.817 -24.366 65.891 1.00 35.13 ? 255 ARG C CD 1 +ATOM 13451 N NE . ARG C 1 255 ? -19.391 -25.659 65.368 1.00 39.60 ? 255 ARG C NE 1 +ATOM 13452 C CZ . ARG C 1 255 ? -18.129 -26.061 65.290 1.00 37.48 ? 255 ARG C CZ 1 +ATOM 13453 N NH1 . ARG C 1 255 ? -17.156 -25.271 65.702 1.00 37.11 ? 255 ARG C NH1 1 +ATOM 13454 N NH2 . ARG C 1 255 ? -17.847 -27.253 64.789 1.00 39.25 ? 255 ARG C NH2 1 +ATOM 13455 N N . VAL C 1 256 ? -22.408 -21.864 62.580 1.00 32.65 ? 256 VAL C N 1 +ATOM 13456 C CA . VAL C 1 256 ? -22.668 -22.165 61.174 1.00 31.98 ? 256 VAL C CA 1 +ATOM 13457 C C . VAL C 1 256 ? -22.017 -23.521 60.932 1.00 33.72 ? 256 VAL C C 1 +ATOM 13458 O O . VAL C 1 256 ? -20.885 -23.624 60.447 1.00 33.32 ? 256 VAL C O 1 +ATOM 13459 C CB . VAL C 1 256 ? -22.056 -21.097 60.252 1.00 29.49 ? 256 VAL C CB 1 +ATOM 13460 C CG1 . VAL C 1 256 ? -22.291 -21.455 58.791 1.00 25.54 ? 256 VAL C CG1 1 +ATOM 13461 C CG2 . VAL C 1 256 ? -22.683 -19.752 60.563 1.00 30.70 ? 256 VAL C CG2 1 +ATOM 13462 N N . ASP C 1 257 ? -22.762 -24.556 61.293 1.00 34.31 ? 257 ASP C N 1 +ATOM 13463 C CA . ASP C 1 257 ? -22.311 -25.934 61.204 1.00 36.70 ? 257 ASP C CA 1 +ATOM 13464 C C . ASP C 1 257 ? -23.345 -26.752 60.422 1.00 37.45 ? 257 ASP C C 1 +ATOM 13465 O O . ASP C 1 257 ? -24.523 -26.818 60.803 1.00 36.60 ? 257 ASP C O 1 +ATOM 13466 C CB . ASP C 1 257 ? -22.166 -26.475 62.634 1.00 39.00 ? 257 ASP C CB 1 +ATOM 13467 C CG . ASP C 1 257 ? -21.514 -27.838 62.694 1.00 42.15 ? 257 ASP C CG 1 +ATOM 13468 O OD1 . ASP C 1 257 ? -21.880 -28.726 61.885 1.00 43.45 ? 257 ASP C OD1 1 +ATOM 13469 O OD2 . ASP C 1 257 ? -20.639 -28.021 63.570 1.00 43.09 ? 257 ASP C OD2 1 +ATOM 13470 N N . GLN C 1 258 ? -22.887 -27.366 59.337 1.00 36.72 ? 258 GLN C N 1 +ATOM 13471 C CA . GLN C 1 258 ? -23.718 -28.184 58.459 1.00 39.11 ? 258 GLN C CA 1 +ATOM 13472 C C . GLN C 1 258 ? -24.481 -29.324 59.132 1.00 40.51 ? 258 GLN C C 1 +ATOM 13473 O O . GLN C 1 258 ? -25.526 -29.749 58.643 1.00 41.23 ? 258 GLN C O 1 +ATOM 13474 C CB . GLN C 1 258 ? -22.845 -28.788 57.369 1.00 38.13 ? 258 GLN C CB 1 +ATOM 13475 C CG . GLN C 1 258 ? -22.997 -28.123 56.058 1.00 36.92 ? 258 GLN C CG 1 +ATOM 13476 C CD . GLN C 1 258 ? -21.953 -28.560 55.081 1.00 34.63 ? 258 GLN C CD 1 +ATOM 13477 O OE1 . GLN C 1 258 ? -22.069 -28.278 53.895 1.00 36.40 ? 258 GLN C OE1 1 +ATOM 13478 N NE2 . GLN C 1 258 ? -20.917 -29.244 55.567 1.00 29.46 ? 258 GLN C NE2 1 +ATOM 13479 N N . ASN C 1 259 ? -23.948 -29.827 60.238 1.00 41.13 ? 259 ASN C N 1 +ATOM 13480 C CA . ASN C 1 259 ? -24.581 -30.934 60.938 1.00 42.76 ? 259 ASN C CA 1 +ATOM 13481 C C . ASN C 1 259 ? -25.049 -30.566 62.332 1.00 41.78 ? 259 ASN C C 1 +ATOM 13482 O O . ASN C 1 259 ? -25.236 -31.433 63.177 1.00 43.19 ? 259 ASN C O 1 +ATOM 13483 C CB . ASN C 1 259 ? -23.603 -32.105 61.002 1.00 43.92 ? 259 ASN C CB 1 +ATOM 13484 C CG . ASN C 1 259 ? -23.187 -32.569 59.623 1.00 46.62 ? 259 ASN C CG 1 +ATOM 13485 O OD1 . ASN C 1 259 ? -21.997 -32.676 59.322 1.00 49.26 ? 259 ASN C OD1 1 +ATOM 13486 N ND2 . ASN C 1 259 ? -24.171 -32.838 58.767 1.00 45.78 ? 259 ASN C ND2 1 +ATOM 13487 N N . TYR C 1 260 ? -25.240 -29.272 62.558 1.00 40.89 ? 260 TYR C N 1 +ATOM 13488 C CA . TYR C 1 260 ? -25.688 -28.769 63.844 1.00 38.97 ? 260 TYR C CA 1 +ATOM 13489 C C . TYR C 1 260 ? -27.174 -28.454 63.712 1.00 39.01 ? 260 TYR C C 1 +ATOM 13490 O O . TYR C 1 260 ? -27.575 -27.533 63.004 1.00 39.14 ? 260 TYR C O 1 +ATOM 13491 C CB . TYR C 1 260 ? -24.869 -27.531 64.209 1.00 38.24 ? 260 TYR C CB 1 +ATOM 13492 C CG . TYR C 1 260 ? -25.262 -26.868 65.505 1.00 37.98 ? 260 TYR C CG 1 +ATOM 13493 C CD1 . TYR C 1 260 ? -25.364 -27.602 66.687 1.00 38.18 ? 260 TYR C CD1 1 +ATOM 13494 C CD2 . TYR C 1 260 ? -25.523 -25.501 65.552 1.00 36.90 ? 260 TYR C CD2 1 +ATOM 13495 C CE1 . TYR C 1 260 ? -25.717 -26.990 67.882 1.00 37.99 ? 260 TYR C CE1 1 +ATOM 13496 C CE2 . TYR C 1 260 ? -25.876 -24.881 66.736 1.00 37.88 ? 260 TYR C CE2 1 +ATOM 13497 C CZ . TYR C 1 260 ? -25.974 -25.628 67.896 1.00 37.85 ? 260 TYR C CZ 1 +ATOM 13498 O OH . TYR C 1 260 ? -26.351 -25.011 69.061 1.00 38.55 ? 260 TYR C OH 1 +ATOM 13499 N N . SER C 1 261 ? -27.985 -29.243 64.399 1.00 39.32 ? 261 SER C N 1 +ATOM 13500 C CA . SER C 1 261 ? -29.436 -29.117 64.359 1.00 39.28 ? 261 SER C CA 1 +ATOM 13501 C C . SER C 1 261 ? -30.055 -27.710 64.470 1.00 38.17 ? 261 SER C C 1 +ATOM 13502 O O . SER C 1 261 ? -30.866 -27.326 63.628 1.00 39.93 ? 261 SER C O 1 +ATOM 13503 C CB . SER C 1 261 ? -30.035 -30.039 65.417 1.00 40.54 ? 261 SER C CB 1 +ATOM 13504 O OG . SER C 1 261 ? -31.443 -30.002 65.366 1.00 47.17 ? 261 SER C OG 1 +ATOM 13505 N N . PRO C 1 262 ? -29.700 -26.928 65.508 1.00 37.44 ? 262 PRO C N 1 +ATOM 13506 C CA . PRO C 1 262 ? -30.269 -25.579 65.649 1.00 35.40 ? 262 PRO C CA 1 +ATOM 13507 C C . PRO C 1 262 ? -30.030 -24.696 64.424 1.00 35.49 ? 262 PRO C C 1 +ATOM 13508 O O . PRO C 1 262 ? -30.868 -23.871 64.066 1.00 34.52 ? 262 PRO C O 1 +ATOM 13509 C CB . PRO C 1 262 ? -29.566 -25.038 66.889 1.00 35.23 ? 262 PRO C CB 1 +ATOM 13510 C CG . PRO C 1 262 ? -29.348 -26.254 67.702 1.00 35.81 ? 262 PRO C CG 1 +ATOM 13511 C CD . PRO C 1 262 ? -28.854 -27.253 66.670 1.00 37.15 ? 262 PRO C CD 1 +ATOM 13512 N N . PHE C 1 263 ? -28.874 -24.862 63.786 1.00 35.12 ? 263 PHE C N 1 +ATOM 13513 C CA . PHE C 1 263 ? -28.557 -24.084 62.597 1.00 34.78 ? 263 PHE C CA 1 +ATOM 13514 C C . PHE C 1 263 ? -29.524 -24.437 61.467 1.00 35.49 ? 263 PHE C C 1 +ATOM 13515 O O . PHE C 1 263 ? -30.060 -23.552 60.792 1.00 34.76 ? 263 PHE C O 1 +ATOM 13516 C CB . PHE C 1 263 ? -27.117 -24.351 62.154 1.00 33.65 ? 263 PHE C CB 1 +ATOM 13517 C CG . PHE C 1 263 ? -26.730 -23.650 60.881 1.00 32.08 ? 263 PHE C CG 1 +ATOM 13518 C CD1 . PHE C 1 263 ? -26.800 -22.270 60.786 1.00 32.00 ? 263 PHE C CD1 1 +ATOM 13519 C CD2 . PHE C 1 263 ? -26.269 -24.372 59.784 1.00 32.37 ? 263 PHE C CD2 1 +ATOM 13520 C CE1 . PHE C 1 263 ? -26.413 -21.607 59.613 1.00 31.08 ? 263 PHE C CE1 1 +ATOM 13521 C CE2 . PHE C 1 263 ? -25.881 -23.723 58.609 1.00 32.25 ? 263 PHE C CE2 1 +ATOM 13522 C CZ . PHE C 1 263 ? -25.954 -22.332 58.527 1.00 31.06 ? 263 PHE C CZ 1 +ATOM 13523 N N . LEU C 1 264 ? -29.746 -25.736 61.275 1.00 35.78 ? 264 LEU C N 1 +ATOM 13524 C CA . LEU C 1 264 ? -30.643 -26.219 60.234 1.00 35.86 ? 264 LEU C CA 1 +ATOM 13525 C C . LEU C 1 264 ? -32.113 -25.877 60.519 1.00 36.29 ? 264 LEU C C 1 +ATOM 13526 O O . LEU C 1 264 ? -32.835 -25.431 59.625 1.00 35.52 ? 264 LEU C O 1 +ATOM 13527 C CB . LEU C 1 264 ? -30.475 -27.730 60.070 1.00 35.67 ? 264 LEU C CB 1 +ATOM 13528 C CG . LEU C 1 264 ? -29.043 -28.192 59.770 1.00 37.37 ? 264 LEU C CG 1 +ATOM 13529 C CD1 . LEU C 1 264 ? -28.976 -29.720 59.736 1.00 34.43 ? 264 LEU C CD1 1 +ATOM 13530 C CD2 . LEU C 1 264 ? -28.584 -27.593 58.447 1.00 34.99 ? 264 LEU C CD2 1 +ATOM 13531 N N . SER C 1 265 ? -32.556 -26.056 61.761 1.00 35.67 ? 265 SER C N 1 +ATOM 13532 C CA . SER C 1 265 ? -33.951 -25.764 62.083 1.00 36.84 ? 265 SER C CA 1 +ATOM 13533 C C . SER C 1 265 ? -34.237 -24.271 62.195 1.00 38.01 ? 265 SER C C 1 +ATOM 13534 O O . SER C 1 265 ? -35.370 -23.832 61.978 1.00 39.80 ? 265 SER C O 1 +ATOM 13535 C CB . SER C 1 265 ? -34.364 -26.462 63.381 1.00 35.35 ? 265 SER C CB 1 +ATOM 13536 O OG . SER C 1 265 ? -33.811 -25.825 64.516 1.00 37.08 ? 265 SER C OG 1 +ATOM 13537 N N . GLY C 1 266 ? -33.219 -23.487 62.529 1.00 37.18 ? 266 GLY C N 1 +ATOM 13538 C CA . GLY C 1 266 ? -33.426 -22.058 62.656 1.00 36.60 ? 266 GLY C CA 1 +ATOM 13539 C C . GLY C 1 266 ? -33.348 -21.328 61.327 1.00 37.37 ? 266 GLY C C 1 +ATOM 13540 O O . GLY C 1 266 ? -33.683 -20.141 61.237 1.00 38.01 ? 266 GLY C O 1 +ATOM 13541 N N . MET C 1 267 ? -32.910 -22.034 60.290 1.00 36.92 ? 267 MET C N 1 +ATOM 13542 C CA . MET C 1 267 ? -32.777 -21.435 58.968 1.00 37.71 ? 267 MET C CA 1 +ATOM 13543 C C . MET C 1 267 ? -34.067 -20.714 58.567 1.00 38.04 ? 267 MET C C 1 +ATOM 13544 O O . MET C 1 267 ? -35.168 -21.264 58.657 1.00 38.19 ? 267 MET C O 1 +ATOM 13545 C CB . MET C 1 267 ? -32.415 -22.511 57.939 1.00 38.45 ? 267 MET C CB 1 +ATOM 13546 C CG . MET C 1 267 ? -31.866 -21.962 56.645 1.00 40.08 ? 267 MET C CG 1 +ATOM 13547 S SD . MET C 1 267 ? -30.435 -20.871 56.892 1.00 42.94 ? 267 MET C SD 1 +ATOM 13548 C CE . MET C 1 267 ? -29.139 -22.062 57.236 1.00 41.03 ? 267 MET C CE 1 +ATOM 13549 N N . GLY C 1 268 ? -33.917 -19.467 58.138 1.00 37.68 ? 268 GLY C N 1 +ATOM 13550 C CA . GLY C 1 268 ? -35.063 -18.672 57.752 1.00 35.19 ? 268 GLY C CA 1 +ATOM 13551 C C . GLY C 1 268 ? -35.399 -17.665 58.832 1.00 34.65 ? 268 GLY C C 1 +ATOM 13552 O O . GLY C 1 268 ? -36.047 -16.661 58.570 1.00 36.32 ? 268 GLY C O 1 +ATOM 13553 N N . LYS C 1 269 ? -34.935 -17.908 60.049 1.00 34.46 ? 269 LYS C N 1 +ATOM 13554 C CA . LYS C 1 269 ? -35.235 -17.004 61.157 1.00 35.47 ? 269 LYS C CA 1 +ATOM 13555 C C . LYS C 1 269 ? -34.029 -16.249 61.736 1.00 34.64 ? 269 LYS C C 1 +ATOM 13556 O O . LYS C 1 269 ? -34.109 -15.692 62.834 1.00 33.42 ? 269 LYS C O 1 +ATOM 13557 C CB . LYS C 1 269 ? -35.948 -17.796 62.259 1.00 36.17 ? 269 LYS C CB 1 +ATOM 13558 C CG . LYS C 1 269 ? -37.278 -18.377 61.800 1.00 37.95 ? 269 LYS C CG 1 +ATOM 13559 C CD . LYS C 1 269 ? -37.837 -19.416 62.767 1.00 40.27 ? 269 LYS C CD 1 +ATOM 13560 C CE . LYS C 1 269 ? -37.041 -20.703 62.714 1.00 41.34 ? 269 LYS C CE 1 +ATOM 13561 N NZ . LYS C 1 269 ? -37.115 -21.329 61.362 1.00 44.38 ? 269 LYS C NZ 1 +ATOM 13562 N N . PHE C 1 270 ? -32.926 -16.221 60.991 1.00 32.51 ? 270 PHE C N 1 +ATOM 13563 C CA . PHE C 1 270 ? -31.708 -15.543 61.423 1.00 31.25 ? 270 PHE C CA 1 +ATOM 13564 C C . PHE C 1 270 ? -31.624 -14.108 60.906 1.00 32.62 ? 270 PHE C C 1 +ATOM 13565 O O . PHE C 1 270 ? -32.313 -13.744 59.948 1.00 32.00 ? 270 PHE C O 1 +ATOM 13566 C CB . PHE C 1 270 ? -30.480 -16.308 60.932 1.00 29.68 ? 270 PHE C CB 1 +ATOM 13567 C CG . PHE C 1 270 ? -30.403 -17.725 61.424 1.00 28.10 ? 270 PHE C CG 1 +ATOM 13568 C CD1 . PHE C 1 270 ? -30.439 -18.008 62.789 1.00 28.87 ? 270 PHE C CD1 1 +ATOM 13569 C CD2 . PHE C 1 270 ? -30.277 -18.776 60.528 1.00 25.59 ? 270 PHE C CD2 1 +ATOM 13570 C CE1 . PHE C 1 270 ? -30.349 -19.321 63.253 1.00 27.26 ? 270 PHE C CE1 1 +ATOM 13571 C CE2 . PHE C 1 270 ? -30.185 -20.092 60.983 1.00 27.42 ? 270 PHE C CE2 1 +ATOM 13572 C CZ . PHE C 1 270 ? -30.222 -20.363 62.349 1.00 26.68 ? 270 PHE C CZ 1 +ATOM 13573 N N . CYS C 1 271 ? -30.774 -13.299 61.543 1.00 33.47 ? 271 CYS C N 1 +ATOM 13574 C CA . CYS C 1 271 ? -30.570 -11.903 61.143 1.00 34.65 ? 271 CYS C CA 1 +ATOM 13575 C C . CYS C 1 271 ? -29.887 -11.817 59.784 1.00 33.32 ? 271 CYS C C 1 +ATOM 13576 O O . CYS C 1 271 ? -29.066 -12.657 59.442 1.00 32.37 ? 271 CYS C O 1 +ATOM 13577 C CB . CYS C 1 271 ? -29.690 -11.178 62.153 1.00 37.67 ? 271 CYS C CB 1 +ATOM 13578 S SG . CYS C 1 271 ? -30.374 -11.074 63.799 1.00 45.91 ? 271 CYS C SG 1 +ATOM 13579 N N . GLU C 1 272 ? -30.213 -10.780 59.023 1.00 33.86 ? 272 GLU C N 1 +ATOM 13580 C CA . GLU C 1 272 ? -29.628 -10.585 57.702 1.00 34.31 ? 272 GLU C CA 1 +ATOM 13581 C C . GLU C 1 272 ? -28.925 -9.231 57.643 1.00 34.39 ? 272 GLU C C 1 +ATOM 13582 O O . GLU C 1 272 ? -28.937 -8.463 58.605 1.00 33.31 ? 272 GLU C O 1 +ATOM 13583 C CB . GLU C 1 272 ? -30.717 -10.610 56.622 1.00 34.40 ? 272 GLU C CB 1 +ATOM 13584 C CG . GLU C 1 272 ? -31.590 -11.842 56.627 1.00 40.25 ? 272 GLU C CG 1 +ATOM 13585 C CD . GLU C 1 272 ? -32.702 -11.786 55.587 1.00 43.94 ? 272 GLU C CD 1 +ATOM 13586 O OE1 . GLU C 1 272 ? -33.163 -10.660 55.262 1.00 44.44 ? 272 GLU C OE1 1 +ATOM 13587 O OE2 . GLU C 1 272 ? -33.123 -12.870 55.109 1.00 45.08 ? 272 GLU C OE2 1 +ATOM 13588 N N . ILE C 1 273 ? -28.299 -8.950 56.509 1.00 33.92 ? 273 ILE C N 1 +ATOM 13589 C CA . ILE C 1 273 ? -27.660 -7.666 56.317 1.00 34.99 ? 273 ILE C CA 1 +ATOM 13590 C C . ILE C 1 273 ? -28.418 -6.977 55.181 1.00 35.51 ? 273 ILE C C 1 +ATOM 13591 O O . ILE C 1 273 ? -29.163 -7.627 54.450 1.00 34.29 ? 273 ILE C O 1 +ATOM 13592 C CB . ILE C 1 273 ? -26.160 -7.804 55.957 1.00 33.21 ? 273 ILE C CB 1 +ATOM 13593 C CG1 . ILE C 1 273 ? -25.984 -8.725 54.756 1.00 33.83 ? 273 ILE C CG1 1 +ATOM 13594 C CG2 . ILE C 1 273 ? -25.392 -8.336 57.148 1.00 34.63 ? 273 ILE C CG2 1 +ATOM 13595 C CD1 . ILE C 1 273 ? -24.563 -8.774 54.234 1.00 30.34 ? 273 ILE C CD1 1 +ATOM 13596 N N . GLU C 1 274 ? -28.237 -5.667 55.051 1.00 37.24 ? 274 GLU C N 1 +ATOM 13597 C CA . GLU C 1 274 ? -28.906 -4.882 54.020 1.00 40.23 ? 274 GLU C CA 1 +ATOM 13598 C C . GLU C 1 274 ? -29.056 -5.583 52.671 1.00 38.72 ? 274 GLU C C 1 +ATOM 13599 O O . GLU C 1 274 ? -30.148 -5.650 52.115 1.00 38.02 ? 274 GLU C O 1 +ATOM 13600 C CB . GLU C 1 274 ? -28.169 -3.554 53.806 1.00 44.65 ? 274 GLU C CB 1 +ATOM 13601 C CG . GLU C 1 274 ? -28.730 -2.361 54.575 1.00 54.24 ? 274 GLU C CG 1 +ATOM 13602 C CD . GLU C 1 274 ? -30.157 -2.001 54.157 1.00 59.70 ? 274 GLU C CD 1 +ATOM 13603 O OE1 . GLU C 1 274 ? -30.470 -2.111 52.947 1.00 61.58 ? 274 GLU C OE1 1 +ATOM 13604 O OE2 . GLU C 1 274 ? -30.961 -1.594 55.033 1.00 62.46 ? 274 GLU C OE2 1 +ATOM 13605 N N . SER C 1 275 ? -27.959 -6.109 52.147 1.00 38.95 ? 275 SER C N 1 +ATOM 13606 C CA . SER C 1 275 ? -27.981 -6.755 50.840 1.00 38.86 ? 275 SER C CA 1 +ATOM 13607 C C . SER C 1 275 ? -28.718 -8.087 50.725 1.00 37.73 ? 275 SER C C 1 +ATOM 13608 O O . SER C 1 275 ? -28.790 -8.657 49.645 1.00 38.36 ? 275 SER C O 1 +ATOM 13609 C CB . SER C 1 275 ? -26.550 -6.888 50.316 1.00 38.03 ? 275 SER C CB 1 +ATOM 13610 O OG . SER C 1 275 ? -25.695 -7.403 51.313 1.00 41.22 ? 275 SER C OG 1 +ATOM 13611 N N . GLY C 1 276 ? -29.256 -8.593 51.827 1.00 38.21 ? 276 GLY C N 1 +ATOM 13612 C CA . GLY C 1 276 ? -30.006 -9.835 51.751 1.00 37.46 ? 276 GLY C CA 1 +ATOM 13613 C C . GLY C 1 276 ? -29.393 -11.135 52.242 1.00 37.36 ? 276 GLY C C 1 +ATOM 13614 O O . GLY C 1 276 ? -30.130 -12.081 52.507 1.00 36.34 ? 276 GLY C O 1 +ATOM 13615 N N . GLU C 1 277 ? -28.069 -11.215 52.360 1.00 37.19 ? 277 GLU C N 1 +ATOM 13616 C CA . GLU C 1 277 ? -27.469 -12.454 52.841 1.00 36.78 ? 277 GLU C CA 1 +ATOM 13617 C C . GLU C 1 277 ? -27.635 -12.528 54.351 1.00 35.45 ? 277 GLU C C 1 +ATOM 13618 O O . GLU C 1 277 ? -28.080 -11.567 54.987 1.00 34.88 ? 277 GLU C O 1 +ATOM 13619 C CB . GLU C 1 277 ? -25.974 -12.528 52.530 1.00 40.11 ? 277 GLU C CB 1 +ATOM 13620 C CG . GLU C 1 277 ? -25.543 -12.129 51.134 1.00 43.46 ? 277 GLU C CG 1 +ATOM 13621 C CD . GLU C 1 277 ? -25.160 -10.661 51.050 1.00 47.54 ? 277 GLU C CD 1 +ATOM 13622 O OE1 . GLU C 1 277 ? -26.065 -9.801 51.144 1.00 48.36 ? 277 GLU C OE1 1 +ATOM 13623 O OE2 . GLU C 1 277 ? -23.948 -10.367 50.901 1.00 50.03 ? 277 GLU C OE2 1 +ATOM 13624 N N . LEU C 1 278 ? -27.285 -13.675 54.924 1.00 33.36 ? 278 LEU C N 1 +ATOM 13625 C CA . LEU C 1 278 ? -27.357 -13.837 56.372 1.00 31.56 ? 278 LEU C CA 1 +ATOM 13626 C C . LEU C 1 278 ? -26.238 -13.019 56.986 1.00 29.46 ? 278 LEU C C 1 +ATOM 13627 O O . LEU C 1 278 ? -25.200 -12.797 56.357 1.00 28.02 ? 278 LEU C O 1 +ATOM 13628 C CB . LEU C 1 278 ? -27.128 -15.295 56.785 1.00 31.16 ? 278 LEU C CB 1 +ATOM 13629 C CG . LEU C 1 278 ? -28.197 -16.334 56.473 1.00 33.38 ? 278 LEU C CG 1 +ATOM 13630 C CD1 . LEU C 1 278 ? -27.763 -17.679 57.042 1.00 31.15 ? 278 LEU C CD1 1 +ATOM 13631 C CD2 . LEU C 1 278 ? -29.525 -15.882 57.078 1.00 31.84 ? 278 LEU C CD2 1 +ATOM 13632 N N . PHE C 1 279 ? -26.445 -12.562 58.211 1.00 27.93 ? 279 PHE C N 1 +ATOM 13633 C CA . PHE C 1 279 ? -25.382 -11.847 58.881 1.00 27.93 ? 279 PHE C CA 1 +ATOM 13634 C C . PHE C 1 279 ? -24.516 -12.930 59.530 1.00 27.30 ? 279 PHE C C 1 +ATOM 13635 O O . PHE C 1 279 ? -24.934 -13.583 60.483 1.00 24.96 ? 279 PHE C O 1 +ATOM 13636 C CB . PHE C 1 279 ? -25.926 -10.895 59.948 1.00 25.93 ? 279 PHE C CB 1 +ATOM 13637 C CG . PHE C 1 279 ? -24.873 -10.424 60.923 1.00 26.51 ? 279 PHE C CG 1 +ATOM 13638 C CD1 . PHE C 1 279 ? -23.623 -9.996 60.468 1.00 25.61 ? 279 PHE C CD1 1 +ATOM 13639 C CD2 . PHE C 1 279 ? -25.118 -10.432 62.290 1.00 25.43 ? 279 PHE C CD2 1 +ATOM 13640 C CE1 . PHE C 1 279 ? -22.636 -9.590 61.366 1.00 26.30 ? 279 PHE C CE1 1 +ATOM 13641 C CE2 . PHE C 1 279 ? -24.133 -10.025 63.204 1.00 25.66 ? 279 PHE C CE2 1 +ATOM 13642 C CZ . PHE C 1 279 ? -22.895 -9.606 62.745 1.00 25.64 ? 279 PHE C CZ 1 +ATOM 13643 N N . VAL C 1 280 ? -23.327 -13.142 58.984 1.00 28.02 ? 280 VAL C N 1 +ATOM 13644 C CA . VAL C 1 280 ? -22.423 -14.140 59.535 1.00 29.35 ? 280 VAL C CA 1 +ATOM 13645 C C . VAL C 1 280 ? -21.336 -13.426 60.319 1.00 30.76 ? 280 VAL C C 1 +ATOM 13646 O O . VAL C 1 280 ? -20.615 -12.594 59.780 1.00 32.46 ? 280 VAL C O 1 +ATOM 13647 C CB . VAL C 1 280 ? -21.772 -14.983 58.427 1.00 29.00 ? 280 VAL C CB 1 +ATOM 13648 C CG1 . VAL C 1 280 ? -20.833 -16.013 59.043 1.00 29.21 ? 280 VAL C CG1 1 +ATOM 13649 C CG2 . VAL C 1 280 ? -22.844 -15.674 57.601 1.00 26.84 ? 280 VAL C CG2 1 +ATOM 13650 N N . GLY C 1 281 ? -21.227 -13.748 61.600 1.00 32.56 ? 281 GLY C N 1 +ATOM 13651 C CA . GLY C 1 281 ? -20.223 -13.119 62.433 1.00 32.70 ? 281 GLY C CA 1 +ATOM 13652 C C . GLY C 1 281 ? -19.323 -14.100 63.167 1.00 33.18 ? 281 GLY C C 1 +ATOM 13653 O O . GLY C 1 281 ? -19.105 -15.228 62.713 1.00 32.11 ? 281 GLY C O 1 +ATOM 13654 N N . LYS C 1 282 ? -18.795 -13.660 64.305 1.00 32.09 ? 282 LYS C N 1 +ATOM 13655 C CA . LYS C 1 282 ? -17.904 -14.482 65.104 1.00 33.97 ? 282 LYS C CA 1 +ATOM 13656 C C . LYS C 1 282 ? -18.286 -14.386 66.569 1.00 34.08 ? 282 LYS C C 1 +ATOM 13657 O O . LYS C 1 282 ? -18.562 -13.301 67.074 1.00 33.85 ? 282 LYS C O 1 +ATOM 13658 C CB . LYS C 1 282 ? -16.454 -14.019 64.918 1.00 35.17 ? 282 LYS C CB 1 +ATOM 13659 C CG . LYS C 1 282 ? -15.855 -14.336 63.556 1.00 38.95 ? 282 LYS C CG 1 +ATOM 13660 C CD . LYS C 1 282 ? -15.340 -15.769 63.513 1.00 44.84 ? 282 LYS C CD 1 +ATOM 13661 C CE . LYS C 1 282 ? -14.683 -16.103 62.175 1.00 48.12 ? 282 LYS C CE 1 +ATOM 13662 N NZ . LYS C 1 282 ? -15.690 -16.209 61.064 1.00 53.01 ? 282 LYS C NZ 1 +ATOM 13663 N N . MET C 1 283 ? -18.303 -15.533 67.243 1.00 34.62 ? 283 MET C N 1 +ATOM 13664 C CA . MET C 1 283 ? -18.628 -15.614 68.665 1.00 34.89 ? 283 MET C CA 1 +ATOM 13665 C C . MET C 1 283 ? -17.947 -16.868 69.212 1.00 34.49 ? 283 MET C C 1 +ATOM 13666 O O . MET C 1 283 ? -17.164 -17.496 68.505 1.00 35.55 ? 283 MET C O 1 +ATOM 13667 C CB . MET C 1 283 ? -20.147 -15.685 68.861 1.00 36.06 ? 283 MET C CB 1 +ATOM 13668 C CG . MET C 1 283 ? -20.719 -14.546 69.709 1.00 39.01 ? 283 MET C CG 1 +ATOM 13669 S SD . MET C 1 283 ? -20.218 -14.603 71.467 1.00 41.91 ? 283 MET C SD 1 +ATOM 13670 C CE . MET C 1 283 ? -21.442 -15.737 72.121 1.00 40.54 ? 283 MET C CE 1 +ATOM 13671 N N . TRP C 1 284 ? -18.239 -17.242 70.454 1.00 35.21 ? 284 TRP C N 1 +ATOM 13672 C CA . TRP C 1 284 ? -17.613 -18.423 71.070 1.00 36.65 ? 284 TRP C CA 1 +ATOM 13673 C C . TRP C 1 284 ? -17.506 -19.666 70.177 1.00 36.87 ? 284 TRP C C 1 +ATOM 13674 O O . TRP C 1 284 ? -16.438 -20.271 70.086 1.00 38.09 ? 284 TRP C O 1 +ATOM 13675 C CB . TRP C 1 284 ? -18.345 -18.806 72.356 1.00 37.40 ? 284 TRP C CB 1 +ATOM 13676 C CG . TRP C 1 284 ? -18.405 -17.719 73.398 1.00 40.41 ? 284 TRP C CG 1 +ATOM 13677 C CD1 . TRP C 1 284 ? -19.386 -17.542 74.343 1.00 40.44 ? 284 TRP C CD1 1 +ATOM 13678 C CD2 . TRP C 1 284 ? -17.453 -16.671 73.613 1.00 41.63 ? 284 TRP C CD2 1 +ATOM 13679 N NE1 . TRP C 1 284 ? -19.103 -16.451 75.123 1.00 40.53 ? 284 TRP C NE1 1 +ATOM 13680 C CE2 . TRP C 1 284 ? -17.922 -15.898 74.701 1.00 42.27 ? 284 TRP C CE2 1 +ATOM 13681 C CE3 . TRP C 1 284 ? -16.249 -16.306 72.990 1.00 43.72 ? 284 TRP C CE3 1 +ATOM 13682 C CZ2 . TRP C 1 284 ? -17.229 -14.781 75.181 1.00 44.65 ? 284 TRP C CZ2 1 +ATOM 13683 C CZ3 . TRP C 1 284 ? -15.559 -15.194 73.466 1.00 45.68 ? 284 TRP C CZ3 1 +ATOM 13684 C CH2 . TRP C 1 284 ? -16.055 -14.444 74.555 1.00 45.78 ? 284 TRP C CH2 1 +ATOM 13685 N N . PRO C 1 285 ? -18.608 -20.067 69.509 1.00 36.77 ? 285 PRO C N 1 +ATOM 13686 C CA . PRO C 1 285 ? -18.513 -21.261 68.653 1.00 36.33 ? 285 PRO C CA 1 +ATOM 13687 C C . PRO C 1 285 ? -17.796 -21.068 67.314 1.00 35.59 ? 285 PRO C C 1 +ATOM 13688 O O . PRO C 1 285 ? -17.707 -22.002 66.515 1.00 36.29 ? 285 PRO C O 1 +ATOM 13689 C CB . PRO C 1 285 ? -19.974 -21.677 68.478 1.00 36.25 ? 285 PRO C CB 1 +ATOM 13690 C CG . PRO C 1 285 ? -20.701 -20.366 68.527 1.00 35.51 ? 285 PRO C CG 1 +ATOM 13691 C CD . PRO C 1 285 ? -20.007 -19.609 69.634 1.00 34.18 ? 285 PRO C CD 1 +ATOM 13692 N N . GLY C 1 286 ? -17.266 -19.870 67.087 1.00 34.57 ? 286 GLY C N 1 +ATOM 13693 C CA . GLY C 1 286 ? -16.579 -19.574 65.840 1.00 33.02 ? 286 GLY C CA 1 +ATOM 13694 C C . GLY C 1 286 ? -17.503 -18.823 64.900 1.00 33.27 ? 286 GLY C C 1 +ATOM 13695 O O . GLY C 1 286 ? -18.191 -17.889 65.320 1.00 33.38 ? 286 GLY C O 1 +ATOM 13696 N N . THR C 1 287 ? -17.528 -19.217 63.629 1.00 33.18 ? 287 THR C N 1 +ATOM 13697 C CA . THR C 1 287 ? -18.403 -18.571 62.654 1.00 31.25 ? 287 THR C CA 1 +ATOM 13698 C C . THR C 1 287 ? -19.833 -18.814 63.140 1.00 31.59 ? 287 THR C C 1 +ATOM 13699 O O . THR C 1 287 ? -20.214 -19.951 63.408 1.00 31.10 ? 287 THR C O 1 +ATOM 13700 C CB . THR C 1 287 ? -18.201 -19.185 61.274 1.00 31.94 ? 287 THR C CB 1 +ATOM 13701 O OG1 . THR C 1 287 ? -16.820 -19.058 60.913 1.00 31.11 ? 287 THR C OG1 1 +ATOM 13702 C CG2 . THR C 1 287 ? -19.071 -18.489 60.236 1.00 30.89 ? 287 THR C CG2 1 +ATOM 13703 N N . THR C 1 288 ? -20.617 -17.748 63.259 1.00 31.45 ? 288 THR C N 1 +ATOM 13704 C CA . THR C 1 288 ? -21.974 -17.866 63.765 1.00 32.77 ? 288 THR C CA 1 +ATOM 13705 C C . THR C 1 288 ? -23.008 -16.945 63.116 1.00 31.34 ? 288 THR C C 1 +ATOM 13706 O O . THR C 1 288 ? -22.674 -15.945 62.485 1.00 31.39 ? 288 THR C O 1 +ATOM 13707 C CB . THR C 1 288 ? -22.007 -17.563 65.282 1.00 35.62 ? 288 THR C CB 1 +ATOM 13708 O OG1 . THR C 1 288 ? -21.673 -16.188 65.494 1.00 39.25 ? 288 THR C OG1 1 +ATOM 13709 C CG2 . THR C 1 288 ? -21.003 -18.410 66.025 1.00 35.37 ? 288 THR C CG2 1 +ATOM 13710 N N . VAL C 1 289 ? -24.275 -17.304 63.278 1.00 29.08 ? 289 VAL C N 1 +ATOM 13711 C CA . VAL C 1 289 ? -25.371 -16.494 62.774 1.00 28.61 ? 289 VAL C CA 1 +ATOM 13712 C C . VAL C 1 289 ? -26.184 -16.202 64.023 1.00 27.36 ? 289 VAL C C 1 +ATOM 13713 O O . VAL C 1 289 ? -25.984 -16.832 65.049 1.00 27.15 ? 289 VAL C O 1 +ATOM 13714 C CB . VAL C 1 289 ? -26.246 -17.224 61.697 1.00 28.49 ? 289 VAL C CB 1 +ATOM 13715 C CG1 . VAL C 1 289 ? -25.494 -17.282 60.377 1.00 27.92 ? 289 VAL C CG1 1 +ATOM 13716 C CG2 . VAL C 1 289 ? -26.624 -18.618 62.155 1.00 26.14 ? 289 VAL C CG2 1 +ATOM 13717 N N . TYR C 1 290 ? -27.090 -15.244 63.955 1.00 27.88 ? 290 TYR C N 1 +ATOM 13718 C CA . TYR C 1 290 ? -27.867 -14.911 65.133 1.00 29.04 ? 290 TYR C CA 1 +ATOM 13719 C C . TYR C 1 290 ? -29.361 -14.906 64.870 1.00 29.65 ? 290 TYR C C 1 +ATOM 13720 O O . TYR C 1 290 ? -29.819 -14.522 63.793 1.00 31.19 ? 290 TYR C O 1 +ATOM 13721 C CB . TYR C 1 290 ? -27.441 -13.539 65.664 1.00 29.84 ? 290 TYR C CB 1 +ATOM 13722 C CG . TYR C 1 290 ? -25.951 -13.418 65.914 1.00 31.95 ? 290 TYR C CG 1 +ATOM 13723 C CD1 . TYR C 1 290 ? -25.067 -13.072 64.882 1.00 29.58 ? 290 TYR C CD1 1 +ATOM 13724 C CD2 . TYR C 1 290 ? -25.422 -13.675 67.179 1.00 31.30 ? 290 TYR C CD2 1 +ATOM 13725 C CE1 . TYR C 1 290 ? -23.694 -12.987 65.113 1.00 33.02 ? 290 TYR C CE1 1 +ATOM 13726 C CE2 . TYR C 1 290 ? -24.054 -13.594 67.421 1.00 32.84 ? 290 TYR C CE2 1 +ATOM 13727 C CZ . TYR C 1 290 ? -23.192 -13.250 66.393 1.00 34.61 ? 290 TYR C CZ 1 +ATOM 13728 O OH . TYR C 1 290 ? -21.832 -13.157 66.648 1.00 35.78 ? 290 TYR C OH 1 +ATOM 13729 N N . PRO C 1 291 ? -30.144 -15.340 65.858 1.00 30.48 ? 291 PRO C N 1 +ATOM 13730 C CA . PRO C 1 291 ? -31.601 -15.371 65.712 1.00 31.36 ? 291 PRO C CA 1 +ATOM 13731 C C . PRO C 1 291 ? -32.148 -13.949 65.675 1.00 32.90 ? 291 PRO C C 1 +ATOM 13732 O O . PRO C 1 291 ? -31.709 -13.098 66.449 1.00 33.19 ? 291 PRO C O 1 +ATOM 13733 C CB . PRO C 1 291 ? -32.065 -16.099 66.972 1.00 31.59 ? 291 PRO C CB 1 +ATOM 13734 C CG . PRO C 1 291 ? -30.853 -16.902 67.403 1.00 30.61 ? 291 PRO C CG 1 +ATOM 13735 C CD . PRO C 1 291 ? -29.725 -15.952 67.133 1.00 30.59 ? 291 PRO C CD 1 +ATOM 13736 N N . ASP C 1 292 ? -33.090 -13.683 64.773 1.00 34.78 ? 292 ASP C N 1 +ATOM 13737 C CA . ASP C 1 292 ? -33.699 -12.355 64.709 1.00 35.67 ? 292 ASP C CA 1 +ATOM 13738 C C . ASP C 1 292 ? -34.889 -12.384 65.670 1.00 34.89 ? 292 ASP C C 1 +ATOM 13739 O O . ASP C 1 292 ? -36.036 -12.566 65.257 1.00 36.58 ? 292 ASP C O 1 +ATOM 13740 C CB . ASP C 1 292 ? -34.173 -12.031 63.287 1.00 36.90 ? 292 ASP C CB 1 +ATOM 13741 C CG . ASP C 1 292 ? -34.804 -10.639 63.183 1.00 40.98 ? 292 ASP C CG 1 +ATOM 13742 O OD1 . ASP C 1 292 ? -34.841 -9.919 64.205 1.00 42.26 ? 292 ASP C OD1 1 +ATOM 13743 O OD2 . ASP C 1 292 ? -35.262 -10.259 62.081 1.00 42.08 ? 292 ASP C OD2 1 +ATOM 13744 N N . PHE C 1 293 ? -34.604 -12.215 66.955 1.00 33.10 ? 293 PHE C N 1 +ATOM 13745 C CA . PHE C 1 293 ? -35.630 -12.248 67.988 1.00 34.17 ? 293 PHE C CA 1 +ATOM 13746 C C . PHE C 1 293 ? -36.774 -11.249 67.845 1.00 34.27 ? 293 PHE C C 1 +ATOM 13747 O O . PHE C 1 293 ? -37.757 -11.334 68.568 1.00 34.29 ? 293 PHE C O 1 +ATOM 13748 C CB . PHE C 1 293 ? -34.976 -12.081 69.360 1.00 33.15 ? 293 PHE C CB 1 +ATOM 13749 C CG . PHE C 1 293 ? -34.119 -13.246 69.761 1.00 33.47 ? 293 PHE C CG 1 +ATOM 13750 C CD1 . PHE C 1 293 ? -34.685 -14.500 69.980 1.00 32.07 ? 293 PHE C CD1 1 +ATOM 13751 C CD2 . PHE C 1 293 ? -32.741 -13.094 69.925 1.00 31.83 ? 293 PHE C CD2 1 +ATOM 13752 C CE1 . PHE C 1 293 ? -33.891 -15.589 70.358 1.00 32.34 ? 293 PHE C CE1 1 +ATOM 13753 C CE2 . PHE C 1 293 ? -31.942 -14.172 70.301 1.00 31.76 ? 293 PHE C CE2 1 +ATOM 13754 C CZ . PHE C 1 293 ? -32.517 -15.425 70.519 1.00 31.18 ? 293 PHE C CZ 1 +ATOM 13755 N N . PHE C 1 294 ? -36.646 -10.297 66.930 1.00 35.77 ? 294 PHE C N 1 +ATOM 13756 C CA . PHE C 1 294 ? -37.703 -9.310 66.728 1.00 36.95 ? 294 PHE C CA 1 +ATOM 13757 C C . PHE C 1 294 ? -38.900 -9.955 66.026 1.00 37.56 ? 294 PHE C C 1 +ATOM 13758 O O . PHE C 1 294 ? -40.007 -9.427 66.055 1.00 37.47 ? 294 PHE C O 1 +ATOM 13759 C CB . PHE C 1 294 ? -37.176 -8.133 65.900 1.00 35.86 ? 294 PHE C CB 1 +ATOM 13760 C CG . PHE C 1 294 ? -36.195 -7.274 66.634 1.00 35.31 ? 294 PHE C CG 1 +ATOM 13761 C CD1 . PHE C 1 294 ? -36.623 -6.392 67.616 1.00 35.39 ? 294 PHE C CD1 1 +ATOM 13762 C CD2 . PHE C 1 294 ? -34.838 -7.367 66.364 1.00 36.21 ? 294 PHE C CD2 1 +ATOM 13763 C CE1 . PHE C 1 294 ? -35.715 -5.616 68.320 1.00 36.13 ? 294 PHE C CE1 1 +ATOM 13764 C CE2 . PHE C 1 294 ? -33.922 -6.596 67.060 1.00 35.64 ? 294 PHE C CE2 1 +ATOM 13765 C CZ . PHE C 1 294 ? -34.361 -5.718 68.042 1.00 35.78 ? 294 PHE C CZ 1 +ATOM 13766 N N . ARG C 1 295 ? -38.667 -11.105 65.403 1.00 38.98 ? 295 ARG C N 1 +ATOM 13767 C CA . ARG C 1 295 ? -39.721 -11.818 64.699 1.00 40.83 ? 295 ARG C CA 1 +ATOM 13768 C C . ARG C 1 295 ? -40.446 -12.787 65.617 1.00 42.22 ? 295 ARG C C 1 +ATOM 13769 O O . ARG C 1 295 ? -39.824 -13.490 66.421 1.00 41.84 ? 295 ARG C O 1 +ATOM 13770 C CB . ARG C 1 295 ? -39.136 -12.570 63.514 1.00 40.58 ? 295 ARG C CB 1 +ATOM 13771 C CG . ARG C 1 295 ? -38.487 -11.656 62.507 1.00 41.83 ? 295 ARG C CG 1 +ATOM 13772 C CD . ARG C 1 295 ? -37.641 -12.439 61.534 1.00 42.43 ? 295 ARG C CD 1 +ATOM 13773 N NE . ARG C 1 295 ? -38.404 -13.491 60.877 1.00 45.15 ? 295 ARG C NE 1 +ATOM 13774 C CZ . ARG C 1 295 ? -37.930 -14.248 59.891 1.00 47.41 ? 295 ARG C CZ 1 +ATOM 13775 N NH1 . ARG C 1 295 ? -36.690 -14.066 59.444 1.00 48.34 ? 295 ARG C NH1 1 +ATOM 13776 N NH2 . ARG C 1 295 ? -38.690 -15.193 59.354 1.00 47.88 ? 295 ARG C NH2 1 +ATOM 13777 N N . GLU C 1 296 ? -41.768 -12.804 65.498 1.00 43.27 ? 296 GLU C N 1 +ATOM 13778 C CA . GLU C 1 296 ? -42.603 -13.670 66.309 1.00 44.87 ? 296 GLU C CA 1 +ATOM 13779 C C . GLU C 1 296 ? -42.227 -15.133 66.101 1.00 44.01 ? 296 GLU C C 1 +ATOM 13780 O O . GLU C 1 296 ? -42.113 -15.896 67.056 1.00 44.99 ? 296 GLU C O 1 +ATOM 13781 C CB . GLU C 1 296 ? -44.061 -13.439 65.940 1.00 48.72 ? 296 GLU C CB 1 +ATOM 13782 C CG . GLU C 1 296 ? -45.058 -14.051 66.890 1.00 57.16 ? 296 GLU C CG 1 +ATOM 13783 C CD . GLU C 1 296 ? -46.459 -13.530 66.635 1.00 61.96 ? 296 GLU C CD 1 +ATOM 13784 O OE1 . GLU C 1 296 ? -46.623 -12.286 66.586 1.00 64.40 ? 296 GLU C OE1 1 +ATOM 13785 O OE2 . GLU C 1 296 ? -47.391 -14.354 66.483 1.00 64.63 ? 296 GLU C OE2 1 +ATOM 13786 N N . ASP C 1 297 ? -42.024 -15.518 64.846 1.00 43.09 ? 297 ASP C N 1 +ATOM 13787 C CA . ASP C 1 297 ? -41.654 -16.889 64.503 1.00 42.82 ? 297 ASP C CA 1 +ATOM 13788 C C . ASP C 1 297 ? -40.303 -17.339 65.076 1.00 41.12 ? 297 ASP C C 1 +ATOM 13789 O O . ASP C 1 297 ? -40.157 -18.488 65.497 1.00 39.52 ? 297 ASP C O 1 +ATOM 13790 C CB . ASP C 1 297 ? -41.644 -17.051 62.987 1.00 45.74 ? 297 ASP C CB 1 +ATOM 13791 C CG . ASP C 1 297 ? -41.004 -15.872 62.288 1.00 52.44 ? 297 ASP C CG 1 +ATOM 13792 O OD1 . ASP C 1 297 ? -41.602 -14.763 62.326 1.00 56.43 ? 297 ASP C OD1 1 +ATOM 13793 O OD2 . ASP C 1 297 ? -39.906 -16.049 61.710 1.00 52.15 ? 297 ASP C OD2 1 +ATOM 13794 N N . THR C 1 298 ? -39.310 -16.453 65.069 1.00 39.27 ? 298 THR C N 1 +ATOM 13795 C CA . THR C 1 298 ? -38.007 -16.805 65.622 1.00 38.64 ? 298 THR C CA 1 +ATOM 13796 C C . THR C 1 298 ? -38.188 -17.026 67.127 1.00 38.13 ? 298 THR C C 1 +ATOM 13797 O O . THR C 1 298 ? -37.504 -17.847 67.736 1.00 36.75 ? 298 THR C O 1 +ATOM 13798 C CB . THR C 1 298 ? -36.951 -15.692 65.380 1.00 38.21 ? 298 THR C CB 1 +ATOM 13799 O OG1 . THR C 1 298 ? -36.731 -15.531 63.969 1.00 38.09 ? 298 THR C OG1 1 +ATOM 13800 C CG2 . THR C 1 298 ? -35.640 -16.061 66.047 1.00 35.00 ? 298 THR C CG2 1 +ATOM 13801 N N . ARG C 1 299 ? -39.134 -16.300 67.714 1.00 38.38 ? 299 ARG C N 1 +ATOM 13802 C CA . ARG C 1 299 ? -39.415 -16.434 69.136 1.00 39.25 ? 299 ARG C CA 1 +ATOM 13803 C C . ARG C 1 299 ? -40.033 -17.795 69.464 1.00 39.64 ? 299 ARG C C 1 +ATOM 13804 O O . ARG C 1 299 ? -39.673 -18.424 70.464 1.00 39.74 ? 299 ARG C O 1 +ATOM 13805 C CB . ARG C 1 299 ? -40.335 -15.307 69.598 1.00 37.24 ? 299 ARG C CB 1 +ATOM 13806 C CG . ARG C 1 299 ? -39.657 -14.345 70.542 1.00 37.56 ? 299 ARG C CG 1 +ATOM 13807 C CD . ARG C 1 299 ? -39.669 -12.957 70.004 1.00 37.27 ? 299 ARG C CD 1 +ATOM 13808 N NE . ARG C 1 299 ? -41.012 -12.393 69.990 1.00 38.80 ? 299 ARG C NE 1 +ATOM 13809 C CZ . ARG C 1 299 ? -41.356 -11.334 69.262 1.00 41.04 ? 299 ARG C CZ 1 +ATOM 13810 N NH1 . ARG C 1 299 ? -40.449 -10.739 68.490 1.00 36.94 ? 299 ARG C NH1 1 +ATOM 13811 N NH2 . ARG C 1 299 ? -42.597 -10.857 69.314 1.00 40.43 ? 299 ARG C NH2 1 +ATOM 13812 N N . GLU C 1 300 ? -40.964 -18.248 68.630 1.00 40.85 ? 300 GLU C N 1 +ATOM 13813 C CA . GLU C 1 300 ? -41.586 -19.554 68.840 1.00 42.52 ? 300 GLU C CA 1 +ATOM 13814 C C . GLU C 1 300 ? -40.503 -20.622 68.712 1.00 39.15 ? 300 GLU C C 1 +ATOM 13815 O O . GLU C 1 300 ? -40.415 -21.542 69.527 1.00 38.26 ? 300 GLU C O 1 +ATOM 13816 C CB . GLU C 1 300 ? -42.684 -19.819 67.800 1.00 47.18 ? 300 GLU C CB 1 +ATOM 13817 C CG . GLU C 1 300 ? -43.918 -18.928 67.942 1.00 56.34 ? 300 GLU C CG 1 +ATOM 13818 C CD . GLU C 1 300 ? -44.911 -19.098 66.780 1.00 62.42 ? 300 GLU C CD 1 +ATOM 13819 O OE1 . GLU C 1 300 ? -45.399 -20.237 66.576 1.00 63.77 ? 300 GLU C OE1 1 +ATOM 13820 O OE2 . GLU C 1 300 ? -45.200 -18.095 66.074 1.00 63.27 ? 300 GLU C OE2 1 +ATOM 13821 N N . TRP C 1 301 ? -39.667 -20.485 67.689 1.00 37.06 ? 301 TRP C N 1 +ATOM 13822 C CA . TRP C 1 301 ? -38.592 -21.444 67.453 1.00 34.55 ? 301 TRP C CA 1 +ATOM 13823 C C . TRP C 1 301 ? -37.665 -21.530 68.665 1.00 34.13 ? 301 TRP C C 1 +ATOM 13824 O O . TRP C 1 301 ? -37.356 -22.620 69.139 1.00 34.06 ? 301 TRP C O 1 +ATOM 13825 C CB . TRP C 1 301 ? -37.802 -21.038 66.212 1.00 33.80 ? 301 TRP C CB 1 +ATOM 13826 C CG . TRP C 1 301 ? -36.510 -21.776 66.029 1.00 35.66 ? 301 TRP C CG 1 +ATOM 13827 C CD1 . TRP C 1 301 ? -36.346 -23.057 65.584 1.00 35.78 ? 301 TRP C CD1 1 +ATOM 13828 C CD2 . TRP C 1 301 ? -35.195 -21.268 66.285 1.00 35.77 ? 301 TRP C CD2 1 +ATOM 13829 N NE1 . TRP C 1 301 ? -35.007 -23.376 65.544 1.00 36.56 ? 301 TRP C NE1 1 +ATOM 13830 C CE2 . TRP C 1 301 ? -34.280 -22.293 65.968 1.00 35.98 ? 301 TRP C CE2 1 +ATOM 13831 C CE3 . TRP C 1 301 ? -34.699 -20.040 66.750 1.00 36.80 ? 301 TRP C CE3 1 +ATOM 13832 C CZ2 . TRP C 1 301 ? -32.893 -22.129 66.100 1.00 36.37 ? 301 TRP C CZ2 1 +ATOM 13833 C CZ3 . TRP C 1 301 ? -33.320 -19.878 66.882 1.00 35.33 ? 301 TRP C CZ3 1 +ATOM 13834 C CH2 . TRP C 1 301 ? -32.434 -20.918 66.557 1.00 34.78 ? 301 TRP C CH2 1 +ATOM 13835 N N . TRP C 1 302 ? -37.234 -20.373 69.163 1.00 33.24 ? 302 TRP C N 1 +ATOM 13836 C CA . TRP C 1 302 ? -36.346 -20.308 70.314 1.00 32.25 ? 302 TRP C CA 1 +ATOM 13837 C C . TRP C 1 302 ? -37.021 -20.883 71.558 1.00 32.29 ? 302 TRP C C 1 +ATOM 13838 O O . TRP C 1 302 ? -36.415 -21.669 72.299 1.00 30.76 ? 302 TRP C O 1 +ATOM 13839 C CB . TRP C 1 302 ? -35.924 -18.855 70.558 1.00 32.72 ? 302 TRP C CB 1 +ATOM 13840 C CG . TRP C 1 302 ? -34.976 -18.678 71.702 1.00 30.55 ? 302 TRP C CG 1 +ATOM 13841 C CD1 . TRP C 1 302 ? -35.286 -18.274 72.967 1.00 31.36 ? 302 TRP C CD1 1 +ATOM 13842 C CD2 . TRP C 1 302 ? -33.560 -18.861 71.672 1.00 29.74 ? 302 TRP C CD2 1 +ATOM 13843 N NE1 . TRP C 1 302 ? -34.145 -18.188 73.730 1.00 31.03 ? 302 TRP C NE1 1 +ATOM 13844 C CE2 . TRP C 1 302 ? -33.070 -18.541 72.959 1.00 30.79 ? 302 TRP C CE2 1 +ATOM 13845 C CE3 . TRP C 1 302 ? -32.651 -19.260 70.679 1.00 30.22 ? 302 TRP C CE3 1 +ATOM 13846 C CZ2 . TRP C 1 302 ? -31.705 -18.603 73.284 1.00 30.51 ? 302 TRP C CZ2 1 +ATOM 13847 C CZ3 . TRP C 1 302 ? -31.286 -19.323 71.002 1.00 30.90 ? 302 TRP C CZ3 1 +ATOM 13848 C CH2 . TRP C 1 302 ? -30.832 -18.994 72.295 1.00 30.93 ? 302 TRP C CH2 1 +ATOM 13849 N N . ALA C 1 303 ? -38.277 -20.496 71.784 1.00 31.55 ? 303 ALA C N 1 +ATOM 13850 C CA . ALA C 1 303 ? -39.025 -20.996 72.934 1.00 30.09 ? 303 ALA C CA 1 +ATOM 13851 C C . ALA C 1 303 ? -39.038 -22.528 72.900 1.00 30.82 ? 303 ALA C C 1 +ATOM 13852 O O . ALA C 1 303 ? -38.932 -23.185 73.934 1.00 31.69 ? 303 ALA C O 1 +ATOM 13853 C CB . ALA C 1 303 ? -40.438 -20.455 72.908 1.00 27.60 ? 303 ALA C CB 1 +ATOM 13854 N N . GLY C 1 304 ? -39.146 -23.095 71.703 1.00 30.23 ? 304 GLY C N 1 +ATOM 13855 C CA . GLY C 1 304 ? -39.157 -24.534 71.568 1.00 28.85 ? 304 GLY C CA 1 +ATOM 13856 C C . GLY C 1 304 ? -37.856 -25.159 72.023 1.00 31.81 ? 304 GLY C C 1 +ATOM 13857 O O . GLY C 1 304 ? -37.865 -26.135 72.776 1.00 32.07 ? 304 GLY C O 1 +ATOM 13858 N N . LEU C 1 305 ? -36.727 -24.613 71.570 1.00 32.12 ? 305 LEU C N 1 +ATOM 13859 C CA . LEU C 1 305 ? -35.429 -25.148 71.963 1.00 31.75 ? 305 LEU C CA 1 +ATOM 13860 C C . LEU C 1 305 ? -35.233 -25.012 73.472 1.00 31.98 ? 305 LEU C C 1 +ATOM 13861 O O . LEU C 1 305 ? -34.724 -25.925 74.127 1.00 29.91 ? 305 LEU C O 1 +ATOM 13862 C CB . LEU C 1 305 ? -34.305 -24.407 71.234 1.00 33.75 ? 305 LEU C CB 1 +ATOM 13863 C CG . LEU C 1 305 ? -34.276 -24.529 69.708 1.00 34.26 ? 305 LEU C CG 1 +ATOM 13864 C CD1 . LEU C 1 305 ? -33.197 -23.620 69.145 1.00 34.34 ? 305 LEU C CD1 1 +ATOM 13865 C CD2 . LEU C 1 305 ? -34.015 -25.967 69.312 1.00 32.19 ? 305 LEU C CD2 1 +ATOM 13866 N N . ILE C 1 306 ? -35.638 -23.868 74.017 1.00 31.82 ? 306 ILE C N 1 +ATOM 13867 C CA . ILE C 1 306 ? -35.496 -23.617 75.444 1.00 32.86 ? 306 ILE C CA 1 +ATOM 13868 C C . ILE C 1 306 ? -36.312 -24.642 76.212 1.00 34.51 ? 306 ILE C C 1 +ATOM 13869 O O . ILE C 1 306 ? -35.806 -25.297 77.121 1.00 34.27 ? 306 ILE C O 1 +ATOM 13870 C CB . ILE C 1 306 ? -35.989 -22.190 75.825 1.00 31.30 ? 306 ILE C CB 1 +ATOM 13871 C CG1 . ILE C 1 306 ? -34.999 -21.138 75.328 1.00 29.74 ? 306 ILE C CG1 1 +ATOM 13872 C CG2 . ILE C 1 306 ? -36.168 -22.082 77.332 1.00 30.98 ? 306 ILE C CG2 1 +ATOM 13873 C CD1 . ILE C 1 306 ? -33.622 -21.252 75.969 1.00 32.45 ? 306 ILE C CD1 1 +ATOM 13874 N N . SER C 1 307 ? -37.580 -24.772 75.831 1.00 36.44 ? 307 SER C N 1 +ATOM 13875 C CA . SER C 1 307 ? -38.501 -25.710 76.467 1.00 37.48 ? 307 SER C CA 1 +ATOM 13876 C C . SER C 1 307 ? -37.901 -27.118 76.476 1.00 37.69 ? 307 SER C C 1 +ATOM 13877 O O . SER C 1 307 ? -37.866 -27.799 77.501 1.00 36.95 ? 307 SER C O 1 +ATOM 13878 C CB . SER C 1 307 ? -39.832 -25.708 75.712 1.00 37.22 ? 307 SER C CB 1 +ATOM 13879 O OG . SER C 1 307 ? -40.823 -26.412 76.422 1.00 37.81 ? 307 SER C OG 1 +ATOM 13880 N N . GLU C 1 308 ? -37.411 -27.540 75.321 1.00 38.42 ? 308 GLU C N 1 +ATOM 13881 C CA . GLU C 1 308 ? -36.798 -28.849 75.183 1.00 40.27 ? 308 GLU C CA 1 +ATOM 13882 C C . GLU C 1 308 ? -35.586 -28.968 76.115 1.00 40.06 ? 308 GLU C C 1 +ATOM 13883 O O . GLU C 1 308 ? -35.337 -30.022 76.704 1.00 40.65 ? 308 GLU C O 1 +ATOM 13884 C CB . GLU C 1 308 ? -36.363 -29.036 73.733 1.00 43.56 ? 308 GLU C CB 1 +ATOM 13885 C CG . GLU C 1 308 ? -35.901 -30.428 73.365 1.00 52.04 ? 308 GLU C CG 1 +ATOM 13886 C CD . GLU C 1 308 ? -35.263 -30.462 71.976 1.00 58.36 ? 308 GLU C CD 1 +ATOM 13887 O OE1 . GLU C 1 308 ? -35.878 -29.927 71.015 1.00 61.31 ? 308 GLU C OE1 1 +ATOM 13888 O OE2 . GLU C 1 308 ? -34.147 -31.020 71.845 1.00 60.90 ? 308 GLU C OE2 1 +ATOM 13889 N N . TRP C 1 309 ? -34.832 -27.881 76.241 1.00 38.15 ? 309 TRP C N 1 +ATOM 13890 C CA . TRP C 1 309 ? -33.648 -27.857 77.088 1.00 35.79 ? 309 TRP C CA 1 +ATOM 13891 C C . TRP C 1 309 ? -34.038 -27.933 78.564 1.00 36.11 ? 309 TRP C C 1 +ATOM 13892 O O . TRP C 1 309 ? -33.371 -28.606 79.357 1.00 35.81 ? 309 TRP C O 1 +ATOM 13893 C CB . TRP C 1 309 ? -32.844 -26.580 76.813 1.00 34.61 ? 309 TRP C CB 1 +ATOM 13894 C CG . TRP C 1 309 ? -31.545 -26.499 77.536 1.00 32.43 ? 309 TRP C CG 1 +ATOM 13895 C CD1 . TRP C 1 309 ? -31.232 -25.668 78.578 1.00 31.91 ? 309 TRP C CD1 1 +ATOM 13896 C CD2 . TRP C 1 309 ? -30.379 -27.295 77.294 1.00 30.95 ? 309 TRP C CD2 1 +ATOM 13897 N NE1 . TRP C 1 309 ? -29.941 -25.901 78.999 1.00 30.64 ? 309 TRP C NE1 1 +ATOM 13898 C CE2 . TRP C 1 309 ? -29.395 -26.895 78.231 1.00 30.74 ? 309 TRP C CE2 1 +ATOM 13899 C CE3 . TRP C 1 309 ? -30.070 -28.309 76.379 1.00 31.04 ? 309 TRP C CE3 1 +ATOM 13900 C CZ2 . TRP C 1 309 ? -28.119 -27.478 78.281 1.00 31.74 ? 309 TRP C CZ2 1 +ATOM 13901 C CZ3 . TRP C 1 309 ? -28.799 -28.894 76.427 1.00 32.78 ? 309 TRP C CZ3 1 +ATOM 13902 C CH2 . TRP C 1 309 ? -27.839 -28.473 77.376 1.00 31.93 ? 309 TRP C CH2 1 +ATOM 13903 N N . LEU C 1 310 ? -35.121 -27.252 78.927 1.00 34.74 ? 310 LEU C N 1 +ATOM 13904 C CA . LEU C 1 310 ? -35.593 -27.247 80.304 1.00 35.19 ? 310 LEU C CA 1 +ATOM 13905 C C . LEU C 1 310 ? -36.128 -28.600 80.741 1.00 36.57 ? 310 LEU C C 1 +ATOM 13906 O O . LEU C 1 310 ? -36.064 -28.956 81.922 1.00 37.37 ? 310 LEU C O 1 +ATOM 13907 C CB . LEU C 1 310 ? -36.694 -26.202 80.484 1.00 33.74 ? 310 LEU C CB 1 +ATOM 13908 C CG . LEU C 1 310 ? -36.275 -24.728 80.510 1.00 34.50 ? 310 LEU C CG 1 +ATOM 13909 C CD1 . LEU C 1 310 ? -37.518 -23.839 80.652 1.00 33.41 ? 310 LEU C CD1 1 +ATOM 13910 C CD2 . LEU C 1 310 ? -35.315 -24.486 81.673 1.00 33.76 ? 310 LEU C CD2 1 +ATOM 13911 N N . SER C 1 311 ? -36.646 -29.359 79.782 1.00 38.53 ? 311 SER C N 1 +ATOM 13912 C CA . SER C 1 311 ? -37.234 -30.666 80.067 1.00 38.92 ? 311 SER C CA 1 +ATOM 13913 C C . SER C 1 311 ? -36.274 -31.716 80.626 1.00 39.23 ? 311 SER C C 1 +ATOM 13914 O O . SER C 1 311 ? -36.718 -32.723 81.175 1.00 40.80 ? 311 SER C O 1 +ATOM 13915 C CB . SER C 1 311 ? -37.918 -31.217 78.815 1.00 39.21 ? 311 SER C CB 1 +ATOM 13916 O OG . SER C 1 311 ? -36.960 -31.746 77.913 1.00 40.43 ? 311 SER C OG 1 +ATOM 13917 N N . GLN C 1 312 ? -34.969 -31.514 80.484 1.00 39.92 ? 312 GLN C N 1 +ATOM 13918 C CA . GLN C 1 312 ? -34.028 -32.486 81.039 1.00 39.02 ? 312 GLN C CA 1 +ATOM 13919 C C . GLN C 1 312 ? -33.969 -32.287 82.545 1.00 38.09 ? 312 GLN C C 1 +ATOM 13920 O O . GLN C 1 312 ? -33.438 -33.125 83.263 1.00 37.49 ? 312 GLN C O 1 +ATOM 13921 C CB . GLN C 1 312 ? -32.603 -32.287 80.527 1.00 40.50 ? 312 GLN C CB 1 +ATOM 13922 C CG . GLN C 1 312 ? -32.433 -31.527 79.254 1.00 45.79 ? 312 GLN C CG 1 +ATOM 13923 C CD . GLN C 1 312 ? -30.981 -31.109 79.067 1.00 47.63 ? 312 GLN C CD 1 +ATOM 13924 O OE1 . GLN C 1 312 ? -30.076 -31.947 79.031 1.00 46.24 ? 312 GLN C OE1 1 +ATOM 13925 N NE2 . GLN C 1 312 ? -30.752 -29.804 78.959 1.00 49.58 ? 312 GLN C NE2 1 +ATOM 13926 N N . GLY C 1 313 ? -34.490 -31.158 83.016 1.00 37.27 ? 313 GLY C N 1 +ATOM 13927 C CA . GLY C 1 313 ? -34.448 -30.874 84.437 1.00 38.08 ? 313 GLY C CA 1 +ATOM 13928 C C . GLY C 1 313 ? -33.655 -29.615 84.775 1.00 38.45 ? 313 GLY C C 1 +ATOM 13929 O O . GLY C 1 313 ? -33.427 -29.314 85.948 1.00 39.05 ? 313 GLY C O 1 +ATOM 13930 N N . VAL C 1 314 ? -33.218 -28.882 83.750 1.00 37.64 ? 314 VAL C N 1 +ATOM 13931 C CA . VAL C 1 314 ? -32.484 -27.637 83.965 1.00 34.89 ? 314 VAL C CA 1 +ATOM 13932 C C . VAL C 1 314 ? -33.476 -26.666 84.600 1.00 33.78 ? 314 VAL C C 1 +ATOM 13933 O O . VAL C 1 314 ? -34.592 -26.503 84.118 1.00 33.58 ? 314 VAL C O 1 +ATOM 13934 C CB . VAL C 1 314 ? -31.949 -27.065 82.626 1.00 35.20 ? 314 VAL C CB 1 +ATOM 13935 C CG1 . VAL C 1 314 ? -31.436 -25.648 82.834 1.00 33.22 ? 314 VAL C CG1 1 +ATOM 13936 C CG2 . VAL C 1 314 ? -30.822 -27.966 82.083 1.00 31.39 ? 314 VAL C CG2 1 +ATOM 13937 N N . ASP C 1 315 ? -33.055 -26.013 85.674 1.00 34.04 ? 315 ASP C N 1 +ATOM 13938 C CA . ASP C 1 315 ? -33.915 -25.103 86.423 1.00 33.57 ? 315 ASP C CA 1 +ATOM 13939 C C . ASP C 1 315 ? -33.933 -23.634 86.027 1.00 33.67 ? 315 ASP C C 1 +ATOM 13940 O O . ASP C 1 315 ? -34.905 -22.926 86.320 1.00 34.21 ? 315 ASP C O 1 +ATOM 13941 C CB . ASP C 1 315 ? -33.571 -25.222 87.909 1.00 34.66 ? 315 ASP C CB 1 +ATOM 13942 C CG . ASP C 1 315 ? -33.654 -26.656 88.406 1.00 37.47 ? 315 ASP C CG 1 +ATOM 13943 O OD1 . ASP C 1 315 ? -34.787 -27.177 88.530 1.00 39.86 ? 315 ASP C OD1 1 +ATOM 13944 O OD2 . ASP C 1 315 ? -32.590 -27.269 88.653 1.00 36.64 ? 315 ASP C OD2 1 +ATOM 13945 N N . GLY C 1 316 ? -32.872 -23.160 85.380 1.00 33.77 ? 316 GLY C N 1 +ATOM 13946 C CA . GLY C 1 316 ? -32.837 -21.761 84.991 1.00 31.45 ? 316 GLY C CA 1 +ATOM 13947 C C . GLY C 1 316 ? -31.978 -21.489 83.776 1.00 31.37 ? 316 GLY C C 1 +ATOM 13948 O O . GLY C 1 316 ? -31.114 -22.294 83.416 1.00 30.42 ? 316 GLY C O 1 +ATOM 13949 N N . ILE C 1 317 ? -32.223 -20.344 83.145 1.00 30.93 ? 317 ILE C N 1 +ATOM 13950 C CA . ILE C 1 317 ? -31.484 -19.944 81.959 1.00 30.26 ? 317 ILE C CA 1 +ATOM 13951 C C . ILE C 1 317 ? -30.713 -18.654 82.225 1.00 30.76 ? 317 ILE C C 1 +ATOM 13952 O O . ILE C 1 317 ? -31.245 -17.682 82.773 1.00 28.73 ? 317 ILE C O 1 +ATOM 13953 C CB . ILE C 1 317 ? -32.436 -19.720 80.758 1.00 30.92 ? 317 ILE C CB 1 +ATOM 13954 C CG1 . ILE C 1 317 ? -33.225 -21.000 80.483 1.00 29.92 ? 317 ILE C CG1 1 +ATOM 13955 C CG2 . ILE C 1 317 ? -31.639 -19.315 79.520 1.00 29.39 ? 317 ILE C CG2 1 +ATOM 13956 C CD1 . ILE C 1 317 ? -32.378 -22.158 80.027 1.00 28.92 ? 317 ILE C CD1 1 +ATOM 13957 N N . TRP C 1 318 ? -29.448 -18.662 81.829 1.00 30.46 ? 318 TRP C N 1 +ATOM 13958 C CA . TRP C 1 318 ? -28.577 -17.520 82.009 1.00 30.86 ? 318 TRP C CA 1 +ATOM 13959 C C . TRP C 1 318 ? -28.196 -17.047 80.617 1.00 30.61 ? 318 TRP C C 1 +ATOM 13960 O O . TRP C 1 318 ? -27.394 -17.680 79.940 1.00 29.51 ? 318 TRP C O 1 +ATOM 13961 C CB . TRP C 1 318 ? -27.349 -17.954 82.828 1.00 32.09 ? 318 TRP C CB 1 +ATOM 13962 C CG . TRP C 1 318 ? -26.195 -16.996 82.869 1.00 33.26 ? 318 TRP C CG 1 +ATOM 13963 C CD1 . TRP C 1 318 ? -26.222 -15.653 82.619 1.00 33.62 ? 318 TRP C CD1 1 +ATOM 13964 C CD2 . TRP C 1 318 ? -24.846 -17.308 83.246 1.00 34.46 ? 318 TRP C CD2 1 +ATOM 13965 N NE1 . TRP C 1 318 ? -24.973 -15.109 82.821 1.00 35.28 ? 318 TRP C NE1 1 +ATOM 13966 C CE2 . TRP C 1 318 ? -24.111 -16.099 83.208 1.00 34.02 ? 318 TRP C CE2 1 +ATOM 13967 C CE3 . TRP C 1 318 ? -24.187 -18.493 83.615 1.00 35.18 ? 318 TRP C CE3 1 +ATOM 13968 C CZ2 . TRP C 1 318 ? -22.747 -16.038 83.526 1.00 35.27 ? 318 TRP C CZ2 1 +ATOM 13969 C CZ3 . TRP C 1 318 ? -22.830 -18.437 83.932 1.00 35.84 ? 318 TRP C CZ3 1 +ATOM 13970 C CH2 . TRP C 1 318 ? -22.123 -17.214 83.886 1.00 35.94 ? 318 TRP C CH2 1 +ATOM 13971 N N . LEU C 1 319 ? -28.796 -15.937 80.196 1.00 31.22 ? 319 LEU C N 1 +ATOM 13972 C CA . LEU C 1 319 ? -28.547 -15.345 78.886 1.00 31.48 ? 319 LEU C CA 1 +ATOM 13973 C C . LEU C 1 319 ? -27.334 -14.413 78.925 1.00 32.32 ? 319 LEU C C 1 +ATOM 13974 O O . LEU C 1 319 ? -27.337 -13.410 79.640 1.00 34.33 ? 319 LEU C O 1 +ATOM 13975 C CB . LEU C 1 319 ? -29.782 -14.561 78.437 1.00 30.49 ? 319 LEU C CB 1 +ATOM 13976 C CG . LEU C 1 319 ? -31.090 -15.345 78.288 1.00 32.70 ? 319 LEU C CG 1 +ATOM 13977 C CD1 . LEU C 1 319 ? -32.222 -14.402 77.899 1.00 30.88 ? 319 LEU C CD1 1 +ATOM 13978 C CD2 . LEU C 1 319 ? -30.919 -16.430 77.222 1.00 32.41 ? 319 LEU C CD2 1 +ATOM 13979 N N . ASP C 1 320 ? -26.306 -14.725 78.145 1.00 32.48 ? 320 ASP C N 1 +ATOM 13980 C CA . ASP C 1 320 ? -25.103 -13.900 78.132 1.00 34.08 ? 320 ASP C CA 1 +ATOM 13981 C C . ASP C 1 320 ? -24.735 -13.392 76.735 1.00 33.60 ? 320 ASP C C 1 +ATOM 13982 O O . ASP C 1 320 ? -25.208 -13.920 75.733 1.00 32.83 ? 320 ASP C O 1 +ATOM 13983 C CB . ASP C 1 320 ? -23.949 -14.714 78.722 1.00 37.96 ? 320 ASP C CB 1 +ATOM 13984 C CG . ASP C 1 320 ? -22.717 -13.880 79.003 1.00 40.32 ? 320 ASP C CG 1 +ATOM 13985 O OD1 . ASP C 1 320 ? -22.866 -12.693 79.368 1.00 41.92 ? 320 ASP C OD1 1 +ATOM 13986 O OD2 . ASP C 1 320 ? -21.595 -14.425 78.880 1.00 42.11 ? 320 ASP C OD2 1 +ATOM 13987 N N . MET C 1 321 ? -23.900 -12.355 76.681 1.00 33.44 ? 321 MET C N 1 +ATOM 13988 C CA . MET C 1 321 ? -23.441 -11.781 75.416 1.00 34.08 ? 321 MET C CA 1 +ATOM 13989 C C . MET C 1 321 ? -24.585 -11.260 74.545 1.00 34.77 ? 321 MET C C 1 +ATOM 13990 O O . MET C 1 321 ? -24.399 -11.006 73.350 1.00 35.03 ? 321 MET C O 1 +ATOM 13991 C CB . MET C 1 321 ? -22.676 -12.836 74.613 1.00 35.02 ? 321 MET C CB 1 +ATOM 13992 C CG . MET C 1 321 ? -21.659 -13.635 75.400 1.00 36.10 ? 321 MET C CG 1 +ATOM 13993 S SD . MET C 1 321 ? -20.428 -12.574 76.182 1.00 41.05 ? 321 MET C SD 1 +ATOM 13994 C CE . MET C 1 321 ? -19.626 -11.811 74.704 1.00 39.14 ? 321 MET C CE 1 +ATOM 13995 N N . ASN C 1 322 ? -25.759 -11.092 75.140 1.00 35.02 ? 322 ASN C N 1 +ATOM 13996 C CA . ASN C 1 322 ? -26.935 -10.658 74.394 1.00 35.10 ? 322 ASN C CA 1 +ATOM 13997 C C . ASN C 1 322 ? -27.139 -9.151 74.213 1.00 35.46 ? 322 ASN C C 1 +ATOM 13998 O O . ASN C 1 322 ? -28.278 -8.680 74.163 1.00 36.32 ? 322 ASN C O 1 +ATOM 13999 C CB . ASN C 1 322 ? -28.188 -11.292 75.020 1.00 33.98 ? 322 ASN C CB 1 +ATOM 14000 C CG . ASN C 1 322 ? -28.424 -10.851 76.454 1.00 35.23 ? 322 ASN C CG 1 +ATOM 14001 O OD1 . ASN C 1 322 ? -27.493 -10.472 77.171 1.00 35.95 ? 322 ASN C OD1 1 +ATOM 14002 N ND2 . ASN C 1 322 ? -29.682 -10.920 76.890 1.00 35.07 ? 322 ASN C ND2 1 +ATOM 14003 N N . GLU C 1 323 ? -26.048 -8.399 74.086 1.00 33.90 ? 323 GLU C N 1 +ATOM 14004 C CA . GLU C 1 323 ? -26.155 -6.953 73.902 1.00 34.05 ? 323 GLU C CA 1 +ATOM 14005 C C . GLU C 1 323 ? -26.925 -6.487 72.651 1.00 33.20 ? 323 GLU C C 1 +ATOM 14006 O O . GLU C 1 323 ? -27.668 -5.508 72.712 1.00 33.24 ? 323 GLU C O 1 +ATOM 14007 C CB . GLU C 1 323 ? -24.765 -6.305 73.900 1.00 34.62 ? 323 GLU C CB 1 +ATOM 14008 C CG . GLU C 1 323 ? -24.123 -6.204 75.275 1.00 37.56 ? 323 GLU C CG 1 +ATOM 14009 C CD . GLU C 1 323 ? -23.873 -7.567 75.909 1.00 41.25 ? 323 GLU C CD 1 +ATOM 14010 O OE1 . GLU C 1 323 ? -23.369 -8.476 75.208 1.00 42.14 ? 323 GLU C OE1 1 +ATOM 14011 O OE2 . GLU C 1 323 ? -24.169 -7.728 77.113 1.00 41.83 ? 323 GLU C OE2 1 +ATOM 14012 N N . PRO C 1 324 ? -26.773 -7.176 71.507 1.00 31.78 ? 324 PRO C N 1 +ATOM 14013 C CA . PRO C 1 324 ? -25.975 -8.369 71.204 1.00 31.33 ? 324 PRO C CA 1 +ATOM 14014 C C . PRO C 1 324 ? -24.528 -8.071 70.837 1.00 31.93 ? 324 PRO C C 1 +ATOM 14015 O O . PRO C 1 324 ? -24.220 -7.040 70.229 1.00 33.91 ? 324 PRO C O 1 +ATOM 14016 C CB . PRO C 1 324 ? -26.742 -8.997 70.053 1.00 30.03 ? 324 PRO C CB 1 +ATOM 14017 C CG . PRO C 1 324 ? -27.155 -7.794 69.276 1.00 30.50 ? 324 PRO C CG 1 +ATOM 14018 C CD . PRO C 1 324 ? -27.596 -6.799 70.343 1.00 31.05 ? 324 PRO C CD 1 +ATOM 14019 N N . THR C 1 325 ? -23.647 -8.998 71.189 1.00 32.05 ? 325 THR C N 1 +ATOM 14020 C CA . THR C 1 325 ? -22.224 -8.850 70.930 1.00 31.73 ? 325 THR C CA 1 +ATOM 14021 C C . THR C 1 325 ? -21.749 -9.706 69.770 1.00 31.23 ? 325 THR C C 1 +ATOM 14022 O O . THR C 1 325 ? -22.282 -10.783 69.538 1.00 32.58 ? 325 THR C O 1 +ATOM 14023 C CB . THR C 1 325 ? -21.425 -9.219 72.197 1.00 30.85 ? 325 THR C CB 1 +ATOM 14024 O OG1 . THR C 1 325 ? -21.697 -8.252 73.220 1.00 32.23 ? 325 THR C OG1 1 +ATOM 14025 C CG2 . THR C 1 325 ? -19.938 -9.255 71.916 1.00 29.79 ? 325 THR C CG2 1 +ATOM 14026 N N . ASP C 1 326 ? -20.757 -9.206 69.040 1.00 30.66 ? 326 ASP C N 1 +ATOM 14027 C CA . ASP C 1 326 ? -20.162 -9.917 67.914 1.00 31.13 ? 326 ASP C CA 1 +ATOM 14028 C C . ASP C 1 326 ? -18.682 -9.553 67.856 1.00 30.99 ? 326 ASP C C 1 +ATOM 14029 O O . ASP C 1 326 ? -18.310 -8.411 68.098 1.00 30.12 ? 326 ASP C O 1 +ATOM 14030 C CB . ASP C 1 326 ? -20.838 -9.530 66.599 1.00 32.19 ? 326 ASP C CB 1 +ATOM 14031 C CG . ASP C 1 326 ? -20.159 -10.168 65.397 1.00 34.12 ? 326 ASP C CG 1 +ATOM 14032 O OD1 . ASP C 1 326 ? -20.192 -11.417 65.280 1.00 35.95 ? 326 ASP C OD1 1 +ATOM 14033 O OD2 . ASP C 1 326 ? -19.584 -9.421 64.580 1.00 33.16 ? 326 ASP C OD2 1 +ATOM 14034 N N . PHE C 1 327 ? -17.837 -10.515 67.508 1.00 32.36 ? 327 PHE C N 1 +ATOM 14035 C CA . PHE C 1 327 ? -16.401 -10.268 67.480 1.00 33.26 ? 327 PHE C CA 1 +ATOM 14036 C C . PHE C 1 327 ? -15.752 -10.279 66.112 1.00 34.58 ? 327 PHE C C 1 +ATOM 14037 O O . PHE C 1 327 ? -14.525 -10.203 66.009 1.00 36.02 ? 327 PHE C O 1 +ATOM 14038 C CB . PHE C 1 327 ? -15.696 -11.289 68.376 1.00 33.62 ? 327 PHE C CB 1 +ATOM 14039 C CG . PHE C 1 327 ? -16.031 -11.147 69.830 1.00 34.73 ? 327 PHE C CG 1 +ATOM 14040 C CD1 . PHE C 1 327 ? -15.624 -10.022 70.538 1.00 36.04 ? 327 PHE C CD1 1 +ATOM 14041 C CD2 . PHE C 1 327 ? -16.756 -12.129 70.491 1.00 35.36 ? 327 PHE C CD2 1 +ATOM 14042 C CE1 . PHE C 1 327 ? -15.934 -9.876 71.888 1.00 36.95 ? 327 PHE C CE1 1 +ATOM 14043 C CE2 . PHE C 1 327 ? -17.070 -11.990 71.841 1.00 37.67 ? 327 PHE C CE2 1 +ATOM 14044 C CZ . PHE C 1 327 ? -16.656 -10.858 72.540 1.00 35.83 ? 327 PHE C CZ 1 +ATOM 14045 N N . SER C 1 328 ? -16.547 -10.358 65.055 1.00 34.35 ? 328 SER C N 1 +ATOM 14046 C CA . SER C 1 328 ? -15.949 -10.400 63.727 1.00 36.02 ? 328 SER C CA 1 +ATOM 14047 C C . SER C 1 328 ? -15.110 -9.161 63.400 1.00 35.69 ? 328 SER C C 1 +ATOM 14048 O O . SER C 1 328 ? -14.050 -9.282 62.790 1.00 34.57 ? 328 SER C O 1 +ATOM 14049 C CB . SER C 1 328 ? -17.027 -10.629 62.652 1.00 35.56 ? 328 SER C CB 1 +ATOM 14050 O OG . SER C 1 328 ? -18.013 -9.615 62.675 1.00 36.51 ? 328 SER C OG 1 +ATOM 14051 N N . ARG C 1 329 ? -15.567 -7.978 63.804 1.00 37.23 ? 329 ARG C N 1 +ATOM 14052 C CA . ARG C 1 329 ? -14.809 -6.752 63.528 1.00 38.54 ? 329 ARG C CA 1 +ATOM 14053 C C . ARG C 1 329 ? -13.479 -6.741 64.291 1.00 38.43 ? 329 ARG C C 1 +ATOM 14054 O O . ARG C 1 329 ? -12.435 -6.415 63.732 1.00 38.27 ? 329 ARG C O 1 +ATOM 14055 C CB . ARG C 1 329 ? -15.622 -5.514 63.912 1.00 40.41 ? 329 ARG C CB 1 +ATOM 14056 C CG . ARG C 1 329 ? -16.068 -4.653 62.736 1.00 43.29 ? 329 ARG C CG 1 +ATOM 14057 C CD . ARG C 1 329 ? -17.562 -4.778 62.466 1.00 44.09 ? 329 ARG C CD 1 +ATOM 14058 N NE . ARG C 1 329 ? -18.379 -4.433 63.631 1.00 47.43 ? 329 ARG C NE 1 +ATOM 14059 C CZ . ARG C 1 329 ? -18.503 -3.212 64.146 1.00 48.10 ? 329 ARG C CZ 1 +ATOM 14060 N NH1 . ARG C 1 329 ? -17.866 -2.184 63.609 1.00 48.26 ? 329 ARG C NH1 1 +ATOM 14061 N NH2 . ARG C 1 329 ? -19.270 -3.020 65.210 1.00 48.92 ? 329 ARG C NH2 1 +ATOM 14062 N N . ALA C 1 330 ? -13.521 -7.097 65.570 1.00 37.80 ? 330 ALA C N 1 +ATOM 14063 C CA . ALA C 1 330 ? -12.312 -7.130 66.381 1.00 39.74 ? 330 ALA C CA 1 +ATOM 14064 C C . ALA C 1 330 ? -11.305 -8.123 65.808 1.00 41.33 ? 330 ALA C C 1 +ATOM 14065 O O . ALA C 1 330 ? -10.122 -7.814 65.678 1.00 43.13 ? 330 ALA C O 1 +ATOM 14066 C CB . ALA C 1 330 ? -12.652 -7.508 67.811 1.00 38.05 ? 330 ALA C CB 1 +ATOM 14067 N N . ILE C 1 331 ? -11.780 -9.317 65.468 1.00 42.43 ? 331 ILE C N 1 +ATOM 14068 C CA . ILE C 1 331 ? -10.931 -10.360 64.907 1.00 42.94 ? 331 ILE C CA 1 +ATOM 14069 C C . ILE C 1 331 ? -10.363 -9.968 63.550 1.00 44.23 ? 331 ILE C C 1 +ATOM 14070 O O . ILE C 1 331 ? -9.232 -10.306 63.221 1.00 44.13 ? 331 ILE C O 1 +ATOM 14071 C CB . ILE C 1 331 ? -11.719 -11.675 64.802 1.00 43.12 ? 331 ILE C CB 1 +ATOM 14072 C CG1 . ILE C 1 331 ? -11.850 -12.276 66.203 1.00 42.37 ? 331 ILE C CG1 1 +ATOM 14073 C CG2 . ILE C 1 331 ? -11.041 -12.638 63.845 1.00 41.42 ? 331 ILE C CG2 1 +ATOM 14074 C CD1 . ILE C 1 331 ? -12.700 -13.509 66.265 1.00 43.77 ? 331 ILE C CD1 1 +ATOM 14075 N N . GLU C 1 332 ? -11.150 -9.239 62.773 1.00 46.82 ? 332 GLU C N 1 +ATOM 14076 C CA . GLU C 1 332 ? -10.727 -8.774 61.458 1.00 49.86 ? 332 GLU C CA 1 +ATOM 14077 C C . GLU C 1 332 ? -9.507 -7.854 61.625 1.00 49.96 ? 332 GLU C C 1 +ATOM 14078 O O . GLU C 1 332 ? -8.520 -7.969 60.896 1.00 48.69 ? 332 GLU C O 1 +ATOM 14079 C CB . GLU C 1 332 ? -11.894 -8.032 60.805 1.00 51.98 ? 332 GLU C CB 1 +ATOM 14080 C CG . GLU C 1 332 ? -11.689 -7.598 59.382 1.00 58.82 ? 332 GLU C CG 1 +ATOM 14081 C CD . GLU C 1 332 ? -12.998 -7.163 58.728 1.00 63.86 ? 332 GLU C CD 1 +ATOM 14082 O OE1 . GLU C 1 332 ? -13.682 -6.271 59.289 1.00 65.23 ? 332 GLU C OE1 1 +ATOM 14083 O OE2 . GLU C 1 332 ? -13.343 -7.715 57.655 1.00 66.60 ? 332 GLU C OE2 1 +ATOM 14084 N N . ILE C 1 333 ? -9.585 -6.958 62.606 1.00 49.75 ? 333 ILE C N 1 +ATOM 14085 C CA . ILE C 1 333 ? -8.506 -6.018 62.904 1.00 50.98 ? 333 ILE C CA 1 +ATOM 14086 C C . ILE C 1 333 ? -7.268 -6.762 63.404 1.00 52.72 ? 333 ILE C C 1 +ATOM 14087 O O . ILE C 1 333 ? -6.141 -6.465 63.008 1.00 51.98 ? 333 ILE C O 1 +ATOM 14088 C CB . ILE C 1 333 ? -8.942 -5.008 63.997 1.00 49.46 ? 333 ILE C CB 1 +ATOM 14089 C CG1 . ILE C 1 333 ? -10.028 -4.091 63.452 1.00 46.97 ? 333 ILE C CG1 1 +ATOM 14090 C CG2 . ILE C 1 333 ? -7.747 -4.197 64.482 1.00 49.18 ? 333 ILE C CG2 1 +ATOM 14091 C CD1 . ILE C 1 333 ? -10.680 -3.247 64.511 1.00 45.68 ? 333 ILE C CD1 1 +ATOM 14092 N N . ARG C 1 334 ? -7.493 -7.729 64.285 1.00 55.07 ? 334 ARG C N 1 +ATOM 14093 C CA . ARG C 1 334 ? -6.409 -8.511 64.850 1.00 58.38 ? 334 ARG C CA 1 +ATOM 14094 C C . ARG C 1 334 ? -5.688 -9.359 63.796 1.00 59.20 ? 334 ARG C C 1 +ATOM 14095 O O . ARG C 1 334 ? -4.507 -9.645 63.939 1.00 60.16 ? 334 ARG C O 1 +ATOM 14096 C CB . ARG C 1 334 ? -6.951 -9.384 65.993 1.00 60.24 ? 334 ARG C CB 1 +ATOM 14097 C CG . ARG C 1 334 ? -5.921 -10.288 66.648 1.00 62.99 ? 334 ARG C CG 1 +ATOM 14098 C CD . ARG C 1 334 ? -6.058 -11.720 66.147 1.00 66.51 ? 334 ARG C CD 1 +ATOM 14099 N NE . ARG C 1 334 ? -7.082 -12.467 66.876 1.00 69.00 ? 334 ARG C NE 1 +ATOM 14100 C CZ . ARG C 1 334 ? -7.585 -13.635 66.476 1.00 70.58 ? 334 ARG C CZ 1 +ATOM 14101 N NH1 . ARG C 1 334 ? -7.164 -14.191 65.342 1.00 70.81 ? 334 ARG C NH1 1 +ATOM 14102 N NH2 . ARG C 1 334 ? -8.499 -14.255 67.216 1.00 69.41 ? 334 ARG C NH2 1 +ATOM 14103 N N . ASP C 1 335 ? -6.385 -9.752 62.733 1.00 60.37 ? 335 ASP C N 1 +ATOM 14104 C CA . ASP C 1 335 ? -5.753 -10.555 61.683 1.00 60.89 ? 335 ASP C CA 1 +ATOM 14105 C C . ASP C 1 335 ? -4.892 -9.706 60.752 1.00 60.22 ? 335 ASP C C 1 +ATOM 14106 O O . ASP C 1 335 ? -3.810 -10.125 60.329 1.00 60.77 ? 335 ASP C O 1 +ATOM 14107 C CB . ASP C 1 335 ? -6.799 -11.283 60.824 1.00 62.48 ? 335 ASP C CB 1 +ATOM 14108 C CG . ASP C 1 335 ? -7.517 -12.397 61.574 1.00 64.83 ? 335 ASP C CG 1 +ATOM 14109 O OD1 . ASP C 1 335 ? -6.975 -12.900 62.590 1.00 65.50 ? 335 ASP C OD1 1 +ATOM 14110 O OD2 . ASP C 1 335 ? -8.625 -12.778 61.125 1.00 65.46 ? 335 ASP C OD2 1 +ATOM 14111 N N . VAL C 1 336 ? -5.381 -8.517 60.426 1.00 58.32 ? 336 VAL C N 1 +ATOM 14112 C CA . VAL C 1 336 ? -4.663 -7.629 59.529 1.00 57.39 ? 336 VAL C CA 1 +ATOM 14113 C C . VAL C 1 336 ? -3.460 -6.934 60.165 1.00 57.83 ? 336 VAL C C 1 +ATOM 14114 O O . VAL C 1 336 ? -2.434 -6.757 59.516 1.00 56.74 ? 336 VAL C O 1 +ATOM 14115 C CB . VAL C 1 336 ? -5.617 -6.569 58.947 1.00 55.90 ? 336 VAL C CB 1 +ATOM 14116 C CG1 . VAL C 1 336 ? -4.851 -5.593 58.061 1.00 55.50 ? 336 VAL C CG1 1 +ATOM 14117 C CG2 . VAL C 1 336 ? -6.711 -7.256 58.149 1.00 54.20 ? 336 VAL C CG2 1 +ATOM 14118 N N . LEU C 1 337 ? -3.575 -6.554 61.432 1.00 58.83 ? 337 LEU C N 1 +ATOM 14119 C CA . LEU C 1 337 ? -2.483 -5.858 62.108 1.00 60.77 ? 337 LEU C CA 1 +ATOM 14120 C C . LEU C 1 337 ? -1.808 -6.682 63.212 1.00 63.08 ? 337 LEU C C 1 +ATOM 14121 O O . LEU C 1 337 ? -1.099 -6.136 64.063 1.00 62.29 ? 337 LEU C O 1 +ATOM 14122 C CB . LEU C 1 337 ? -3.004 -4.541 62.689 1.00 59.30 ? 337 LEU C CB 1 +ATOM 14123 C CG . LEU C 1 337 ? -3.760 -3.646 61.705 1.00 58.27 ? 337 LEU C CG 1 +ATOM 14124 C CD1 . LEU C 1 337 ? -4.314 -2.435 62.432 1.00 57.32 ? 337 LEU C CD1 1 +ATOM 14125 C CD2 . LEU C 1 337 ? -2.830 -3.222 60.576 1.00 57.31 ? 337 LEU C CD2 1 +ATOM 14126 N N . SER C 1 338 ? -2.018 -7.997 63.174 1.00 65.68 ? 338 SER C N 1 +ATOM 14127 C CA . SER C 1 338 ? -1.455 -8.922 64.161 1.00 67.19 ? 338 SER C CA 1 +ATOM 14128 C C . SER C 1 338 ? 0.041 -8.761 64.435 1.00 68.41 ? 338 SER C C 1 +ATOM 14129 O O . SER C 1 338 ? 0.443 -8.562 65.582 1.00 68.98 ? 338 SER C O 1 +ATOM 14130 C CB . SER C 1 338 ? -1.733 -10.372 63.735 1.00 67.30 ? 338 SER C CB 1 +ATOM 14131 O OG . SER C 1 338 ? -1.320 -10.608 62.396 1.00 66.52 ? 338 SER C OG 1 +ATOM 14132 N N . SER C 1 339 ? 0.864 -8.847 63.394 1.00 69.37 ? 339 SER C N 1 +ATOM 14133 C CA . SER C 1 339 ? 2.309 -8.734 63.572 1.00 71.72 ? 339 SER C CA 1 +ATOM 14134 C C . SER C 1 339 ? 2.892 -7.323 63.497 1.00 72.03 ? 339 SER C C 1 +ATOM 14135 O O . SER C 1 339 ? 3.741 -7.020 62.657 1.00 72.49 ? 339 SER C O 1 +ATOM 14136 C CB . SER C 1 339 ? 3.036 -9.647 62.577 1.00 73.00 ? 339 SER C CB 1 +ATOM 14137 O OG . SER C 1 339 ? 2.893 -11.015 62.937 1.00 75.07 ? 339 SER C OG 1 +ATOM 14138 N N . LEU C 1 340 ? 2.419 -6.467 64.392 1.00 71.90 ? 340 LEU C N 1 +ATOM 14139 C CA . LEU C 1 340 ? 2.885 -5.095 64.503 1.00 71.67 ? 340 LEU C CA 1 +ATOM 14140 C C . LEU C 1 340 ? 2.979 -4.874 66.002 1.00 71.85 ? 340 LEU C C 1 +ATOM 14141 O O . LEU C 1 340 ? 1.983 -4.977 66.716 1.00 71.51 ? 340 LEU C O 1 +ATOM 14142 C CB . LEU C 1 340 ? 1.884 -4.113 63.883 1.00 71.04 ? 340 LEU C CB 1 +ATOM 14143 C CG . LEU C 1 340 ? 2.210 -3.521 62.506 1.00 70.84 ? 340 LEU C CG 1 +ATOM 14144 C CD1 . LEU C 1 340 ? 3.437 -2.625 62.596 1.00 70.74 ? 340 LEU C CD1 1 +ATOM 14145 C CD2 . LEU C 1 340 ? 2.441 -4.644 61.509 1.00 71.94 ? 340 LEU C CD2 1 +ATOM 14146 N N . PRO C 1 341 ? 4.187 -4.588 66.503 1.00 72.40 ? 341 PRO C N 1 +ATOM 14147 C CA . PRO C 1 341 ? 4.444 -4.355 67.927 1.00 72.90 ? 341 PRO C CA 1 +ATOM 14148 C C . PRO C 1 341 ? 3.648 -3.175 68.495 1.00 73.73 ? 341 PRO C C 1 +ATOM 14149 O O . PRO C 1 341 ? 4.013 -2.589 69.516 1.00 73.62 ? 341 PRO C O 1 +ATOM 14150 C CB . PRO C 1 341 ? 5.947 -4.116 67.957 1.00 72.69 ? 341 PRO C CB 1 +ATOM 14151 C CG . PRO C 1 341 ? 6.183 -3.420 66.650 1.00 73.27 ? 341 PRO C CG 1 +ATOM 14152 C CD . PRO C 1 341 ? 5.378 -4.266 65.697 1.00 72.69 ? 341 PRO C CD 1 +ATOM 14153 N N . VAL C 1 342 ? 2.551 -2.845 67.826 1.00 74.30 ? 342 VAL C N 1 +ATOM 14154 C CA . VAL C 1 342 ? 1.697 -1.741 68.232 1.00 74.29 ? 342 VAL C CA 1 +ATOM 14155 C C . VAL C 1 342 ? 0.551 -2.179 69.137 1.00 74.00 ? 342 VAL C C 1 +ATOM 14156 O O . VAL C 1 342 ? 0.017 -3.275 68.998 1.00 73.96 ? 342 VAL C O 1 +ATOM 14157 C CB . VAL C 1 342 ? 1.127 -1.030 66.989 1.00 74.50 ? 342 VAL C CB 1 +ATOM 14158 C CG1 . VAL C 1 342 ? -0.031 -0.139 67.378 1.00 75.28 ? 342 VAL C CG1 1 +ATOM 14159 C CG2 . VAL C 1 342 ? 2.226 -0.209 66.323 1.00 74.27 ? 342 VAL C CG2 1 +ATOM 14160 N N . GLN C 1 343 ? 0.186 -1.308 70.070 1.00 74.27 ? 343 GLN C N 1 +ATOM 14161 C CA . GLN C 1 343 ? -0.900 -1.583 70.999 1.00 74.94 ? 343 GLN C CA 1 +ATOM 14162 C C . GLN C 1 343 ? -2.187 -0.973 70.447 1.00 74.96 ? 343 GLN C C 1 +ATOM 14163 O O . GLN C 1 343 ? -2.201 0.181 70.021 1.00 74.68 ? 343 GLN C O 1 +ATOM 14164 C CB . GLN C 1 343 ? -0.566 -0.981 72.363 1.00 75.43 ? 343 GLN C CB 1 +ATOM 14165 C CG . GLN C 1 343 ? -1.479 -1.429 73.487 1.00 76.32 ? 343 GLN C CG 1 +ATOM 14166 C CD . GLN C 1 343 ? -0.811 -1.294 74.838 1.00 76.63 ? 343 GLN C CD 1 +ATOM 14167 O OE1 . GLN C 1 343 ? -0.459 -0.194 75.263 1.00 76.67 ? 343 GLN C OE1 1 +ATOM 14168 N NE2 . GLN C 1 343 ? -0.619 -2.420 75.517 1.00 76.73 ? 343 GLN C NE2 1 +ATOM 14169 N N . PHE C 1 344 ? -3.266 -1.747 70.449 1.00 74.94 ? 344 PHE C N 1 +ATOM 14170 C CA . PHE C 1 344 ? -4.538 -1.262 69.923 1.00 75.94 ? 344 PHE C CA 1 +ATOM 14171 C C . PHE C 1 344 ? -5.342 -0.486 70.956 1.00 75.98 ? 344 PHE C C 1 +ATOM 14172 O O . PHE C 1 344 ? -5.252 -0.751 72.154 1.00 75.64 ? 344 PHE C O 1 +ATOM 14173 C CB . PHE C 1 344 ? -5.375 -2.435 69.400 1.00 76.28 ? 344 PHE C CB 1 +ATOM 14174 C CG . PHE C 1 344 ? -4.659 -3.280 68.386 1.00 77.43 ? 344 PHE C CG 1 +ATOM 14175 C CD1 . PHE C 1 344 ? -4.182 -2.717 67.206 1.00 77.66 ? 344 PHE C CD1 1 +ATOM 14176 C CD2 . PHE C 1 344 ? -4.428 -4.632 68.626 1.00 78.19 ? 344 PHE C CD2 1 +ATOM 14177 C CE1 . PHE C 1 344 ? -3.480 -3.484 66.282 1.00 78.49 ? 344 PHE C CE1 1 +ATOM 14178 C CE2 . PHE C 1 344 ? -3.727 -5.413 67.709 1.00 78.74 ? 344 PHE C CE2 1 +ATOM 14179 C CZ . PHE C 1 344 ? -3.251 -4.837 66.534 1.00 79.39 ? 344 PHE C CZ 1 +ATOM 14180 N N . ARG C 1 345 ? -6.120 0.489 70.495 1.00 76.44 ? 345 ARG C N 1 +ATOM 14181 C CA . ARG C 1 345 ? -6.942 1.252 71.421 1.00 76.97 ? 345 ARG C CA 1 +ATOM 14182 C C . ARG C 1 345 ? -8.124 0.342 71.705 1.00 76.14 ? 345 ARG C C 1 +ATOM 14183 O O . ARG C 1 345 ? -8.523 -0.449 70.848 1.00 75.89 ? 345 ARG C O 1 +ATOM 14184 C CB . ARG C 1 345 ? -7.419 2.561 70.789 1.00 78.83 ? 345 ARG C CB 1 +ATOM 14185 C CG . ARG C 1 345 ? -8.336 2.370 69.598 1.00 81.60 ? 345 ARG C CG 1 +ATOM 14186 C CD . ARG C 1 345 ? -8.612 3.685 68.888 1.00 84.17 ? 345 ARG C CD 1 +ATOM 14187 N NE . ARG C 1 345 ? -9.484 3.483 67.733 1.00 86.43 ? 345 ARG C NE 1 +ATOM 14188 C CZ . ARG C 1 345 ? -9.717 4.399 66.800 1.00 87.17 ? 345 ARG C CZ 1 +ATOM 14189 N NH1 . ARG C 1 345 ? -9.140 5.593 66.883 1.00 87.29 ? 345 ARG C NH1 1 +ATOM 14190 N NH2 . ARG C 1 345 ? -10.521 4.118 65.781 1.00 87.04 ? 345 ARG C NH2 1 +ATOM 14191 N N . ASP C 1 346 ? -8.678 0.435 72.905 1.00 74.99 ? 346 ASP C N 1 +ATOM 14192 C CA . ASP C 1 346 ? -9.800 -0.421 73.251 1.00 74.00 ? 346 ASP C CA 1 +ATOM 14193 C C . ASP C 1 346 ? -11.145 0.257 73.017 1.00 71.85 ? 346 ASP C C 1 +ATOM 14194 O O . ASP C 1 346 ? -11.744 0.801 73.947 1.00 71.72 ? 346 ASP C O 1 +ATOM 14195 C CB . ASP C 1 346 ? -9.699 -0.873 74.711 1.00 75.90 ? 346 ASP C CB 1 +ATOM 14196 C CG . ASP C 1 346 ? -10.695 -1.973 75.048 1.00 77.84 ? 346 ASP C CG 1 +ATOM 14197 O OD1 . ASP C 1 346 ? -11.910 -1.761 74.841 1.00 78.73 ? 346 ASP C OD1 1 +ATOM 14198 O OD2 . ASP C 1 346 ? -10.265 -3.050 75.520 1.00 78.79 ? 346 ASP C OD2 1 +ATOM 14199 N N . ASP C 1 347 ? -11.612 0.230 71.771 1.00 68.36 ? 347 ASP C N 1 +ATOM 14200 C CA . ASP C 1 347 ? -12.902 0.817 71.442 1.00 64.27 ? 347 ASP C CA 1 +ATOM 14201 C C . ASP C 1 347 ? -13.943 -0.292 71.541 1.00 60.09 ? 347 ASP C C 1 +ATOM 14202 O O . ASP C 1 347 ? -14.042 -1.155 70.670 1.00 59.57 ? 347 ASP C O 1 +ATOM 14203 C CB . ASP C 1 347 ? -12.884 1.419 70.037 1.00 66.49 ? 347 ASP C CB 1 +ATOM 14204 C CG . ASP C 1 347 ? -14.245 1.954 69.617 1.00 69.70 ? 347 ASP C CG 1 +ATOM 14205 O OD1 . ASP C 1 347 ? -14.978 2.481 70.489 1.00 69.82 ? 347 ASP C OD1 1 +ATOM 14206 O OD2 . ASP C 1 347 ? -14.579 1.856 68.414 1.00 72.08 ? 347 ASP C OD2 1 +ATOM 14207 N N . ARG C 1 348 ? -14.711 -0.261 72.620 1.00 54.90 ? 348 ARG C N 1 +ATOM 14208 C CA . ARG C 1 348 ? -15.734 -1.264 72.879 1.00 51.49 ? 348 ARG C CA 1 +ATOM 14209 C C . ARG C 1 348 ? -16.844 -1.330 71.833 1.00 48.92 ? 348 ARG C C 1 +ATOM 14210 O O . ARG C 1 348 ? -17.444 -2.383 71.622 1.00 47.79 ? 348 ARG C O 1 +ATOM 14211 C CB . ARG C 1 348 ? -16.332 -1.024 74.266 1.00 50.92 ? 348 ARG C CB 1 +ATOM 14212 C CG . ARG C 1 348 ? -15.348 -1.271 75.415 1.00 49.05 ? 348 ARG C CG 1 +ATOM 14213 C CD . ARG C 1 348 ? -15.339 -2.732 75.813 1.00 48.98 ? 348 ARG C CD 1 +ATOM 14214 N NE . ARG C 1 348 ? -14.236 -3.500 75.251 1.00 47.77 ? 348 ARG C NE 1 +ATOM 14215 C CZ . ARG C 1 348 ? -14.231 -4.830 75.162 1.00 49.24 ? 348 ARG C CZ 1 +ATOM 14216 N NH1 . ARG C 1 348 ? -15.276 -5.534 75.585 1.00 47.74 ? 348 ARG C NH1 1 +ATOM 14217 N NH2 . ARG C 1 348 ? -13.170 -5.467 74.678 1.00 49.48 ? 348 ARG C NH2 1 +ATOM 14218 N N . LEU C 1 349 ? -17.116 -0.208 71.181 1.00 46.35 ? 349 LEU C N 1 +ATOM 14219 C CA . LEU C 1 349 ? -18.149 -0.164 70.161 1.00 43.83 ? 349 LEU C CA 1 +ATOM 14220 C C . LEU C 1 349 ? -17.858 -1.116 69.006 1.00 41.61 ? 349 LEU C C 1 +ATOM 14221 O O . LEU C 1 349 ? -18.752 -1.435 68.226 1.00 40.58 ? 349 LEU C O 1 +ATOM 14222 C CB . LEU C 1 349 ? -18.304 1.261 69.634 1.00 44.83 ? 349 LEU C CB 1 +ATOM 14223 C CG . LEU C 1 349 ? -18.893 2.243 70.654 1.00 46.80 ? 349 LEU C CG 1 +ATOM 14224 C CD1 . LEU C 1 349 ? -18.939 3.641 70.039 1.00 47.77 ? 349 LEU C CD1 1 +ATOM 14225 C CD2 . LEU C 1 349 ? -20.293 1.790 71.062 1.00 46.14 ? 349 LEU C CD2 1 +ATOM 14226 N N . VAL C 1 350 ? -16.615 -1.576 68.903 1.00 39.04 ? 350 VAL C N 1 +ATOM 14227 C CA . VAL C 1 350 ? -16.240 -2.494 67.834 1.00 38.02 ? 350 VAL C CA 1 +ATOM 14228 C C . VAL C 1 350 ? -16.892 -3.866 68.030 1.00 37.32 ? 350 VAL C C 1 +ATOM 14229 O O . VAL C 1 350 ? -17.001 -4.643 67.085 1.00 37.28 ? 350 VAL C O 1 +ATOM 14230 C CB . VAL C 1 350 ? -14.697 -2.687 67.760 1.00 38.87 ? 350 VAL C CB 1 +ATOM 14231 C CG1 . VAL C 1 350 ? -14.211 -3.528 68.942 1.00 39.28 ? 350 VAL C CG1 1 +ATOM 14232 C CG2 . VAL C 1 350 ? -14.314 -3.355 66.457 1.00 37.64 ? 350 VAL C CG2 1 +ATOM 14233 N N . THR C 1 351 ? -17.325 -4.160 69.252 1.00 36.92 ? 351 THR C N 1 +ATOM 14234 C CA . THR C 1 351 ? -17.954 -5.443 69.550 1.00 36.70 ? 351 THR C CA 1 +ATOM 14235 C C . THR C 1 351 ? -19.465 -5.461 69.335 1.00 36.93 ? 351 THR C C 1 +ATOM 14236 O O . THR C 1 351 ? -20.115 -6.463 69.634 1.00 37.80 ? 351 THR C O 1 +ATOM 14237 C CB . THR C 1 351 ? -17.692 -5.894 71.005 1.00 37.77 ? 351 THR C CB 1 +ATOM 14238 O OG1 . THR C 1 351 ? -18.398 -5.034 71.911 1.00 37.34 ? 351 THR C OG1 1 +ATOM 14239 C CG2 . THR C 1 351 ? -16.202 -5.864 71.317 1.00 34.06 ? 351 THR C CG2 1 +ATOM 14240 N N . THR C 1 352 ? -20.034 -4.363 68.843 1.00 35.98 ? 352 THR C N 1 +ATOM 14241 C CA . THR C 1 352 ? -21.475 -4.332 68.582 1.00 36.11 ? 352 THR C CA 1 +ATOM 14242 C C . THR C 1 352 ? -21.685 -4.864 67.170 1.00 34.59 ? 352 THR C C 1 +ATOM 14243 O O . THR C 1 352 ? -20.719 -5.043 66.430 1.00 35.59 ? 352 THR C O 1 +ATOM 14244 C CB . THR C 1 352 ? -22.057 -2.898 68.638 1.00 36.04 ? 352 THR C CB 1 +ATOM 14245 O OG1 . THR C 1 352 ? -21.518 -2.117 67.564 1.00 37.74 ? 352 THR C OG1 1 +ATOM 14246 C CG2 . THR C 1 352 ? -21.722 -2.234 69.952 1.00 36.04 ? 352 THR C CG2 1 +ATOM 14247 N N . PHE C 1 353 ? -22.935 -5.125 66.800 1.00 34.17 ? 353 PHE C N 1 +ATOM 14248 C CA . PHE C 1 353 ? -23.247 -5.610 65.457 1.00 34.00 ? 353 PHE C CA 1 +ATOM 14249 C C . PHE C 1 353 ? -22.859 -4.542 64.449 1.00 35.37 ? 353 PHE C C 1 +ATOM 14250 O O . PHE C 1 353 ? -22.878 -3.347 64.751 1.00 34.88 ? 353 PHE C O 1 +ATOM 14251 C CB . PHE C 1 353 ? -24.747 -5.900 65.314 1.00 31.87 ? 353 PHE C CB 1 +ATOM 14252 C CG . PHE C 1 353 ? -25.154 -7.281 65.751 1.00 33.13 ? 353 PHE C CG 1 +ATOM 14253 C CD1 . PHE C 1 353 ? -24.303 -8.076 66.527 1.00 33.45 ? 353 PHE C CD1 1 +ATOM 14254 C CD2 . PHE C 1 353 ? -26.401 -7.791 65.394 1.00 33.54 ? 353 PHE C CD2 1 +ATOM 14255 C CE1 . PHE C 1 353 ? -24.689 -9.352 66.937 1.00 33.06 ? 353 PHE C CE1 1 +ATOM 14256 C CE2 . PHE C 1 353 ? -26.799 -9.063 65.798 1.00 33.28 ? 353 PHE C CE2 1 +ATOM 14257 C CZ . PHE C 1 353 ? -25.943 -9.847 66.570 1.00 34.03 ? 353 PHE C CZ 1 +ATOM 14258 N N . PRO C 1 354 ? -22.478 -4.956 63.237 1.00 37.46 ? 354 PRO C N 1 +ATOM 14259 C CA . PRO C 1 354 ? -22.094 -3.995 62.197 1.00 38.84 ? 354 PRO C CA 1 +ATOM 14260 C C . PRO C 1 354 ? -23.300 -3.125 61.848 1.00 40.08 ? 354 PRO C C 1 +ATOM 14261 O O . PRO C 1 354 ? -24.422 -3.416 62.264 1.00 39.66 ? 354 PRO C O 1 +ATOM 14262 C CB . PRO C 1 354 ? -21.676 -4.894 61.039 1.00 37.26 ? 354 PRO C CB 1 +ATOM 14263 C CG . PRO C 1 354 ? -21.144 -6.099 61.730 1.00 37.52 ? 354 PRO C CG 1 +ATOM 14264 C CD . PRO C 1 354 ? -22.171 -6.331 62.818 1.00 36.72 ? 354 PRO C CD 1 +ATOM 14265 N N . ASP C 1 355 ? -23.079 -2.066 61.081 1.00 43.61 ? 355 ASP C N 1 +ATOM 14266 C CA . ASP C 1 355 ? -24.175 -1.175 60.709 1.00 46.16 ? 355 ASP C CA 1 +ATOM 14267 C C . ASP C 1 355 ? -25.109 -1.681 59.620 1.00 44.14 ? 355 ASP C C 1 +ATOM 14268 O O . ASP C 1 355 ? -26.250 -1.243 59.535 1.00 45.11 ? 355 ASP C O 1 +ATOM 14269 C CB . ASP C 1 355 ? -23.622 0.185 60.302 1.00 52.34 ? 355 ASP C CB 1 +ATOM 14270 C CG . ASP C 1 355 ? -23.216 1.019 61.501 1.00 58.41 ? 355 ASP C CG 1 +ATOM 14271 O OD1 . ASP C 1 355 ? -24.108 1.360 62.314 1.00 60.44 ? 355 ASP C OD1 1 +ATOM 14272 O OD2 . ASP C 1 355 ? -22.009 1.326 61.633 1.00 62.56 ? 355 ASP C OD2 1 +ATOM 14273 N N . ASN C 1 356 ? -24.649 -2.618 58.805 1.00 41.74 ? 356 ASN C N 1 +ATOM 14274 C CA . ASN C 1 356 ? -25.490 -3.124 57.727 1.00 40.19 ? 356 ASN C CA 1 +ATOM 14275 C C . ASN C 1 356 ? -26.441 -4.253 58.125 1.00 37.93 ? 356 ASN C C 1 +ATOM 14276 O O . ASN C 1 356 ? -27.076 -4.844 57.261 1.00 38.76 ? 356 ASN C O 1 +ATOM 14277 C CB . ASN C 1 356 ? -24.601 -3.567 56.556 1.00 39.68 ? 356 ASN C CB 1 +ATOM 14278 C CG . ASN C 1 356 ? -23.662 -4.685 56.940 1.00 40.15 ? 356 ASN C CG 1 +ATOM 14279 O OD1 . ASN C 1 356 ? -23.263 -4.804 58.103 1.00 40.36 ? 356 ASN C OD1 1 +ATOM 14280 N ND2 . ASN C 1 356 ? -23.294 -5.511 55.966 1.00 39.60 ? 356 ASN C ND2 1 +ATOM 14281 N N . VAL C 1 357 ? -26.549 -4.547 59.420 1.00 36.15 ? 357 VAL C N 1 +ATOM 14282 C CA . VAL C 1 357 ? -27.430 -5.617 59.891 1.00 33.59 ? 357 VAL C CA 1 +ATOM 14283 C C . VAL C 1 357 ? -28.869 -5.133 59.996 1.00 34.26 ? 357 VAL C C 1 +ATOM 14284 O O . VAL C 1 357 ? -29.121 -4.027 60.472 1.00 34.39 ? 357 VAL C O 1 +ATOM 14285 C CB . VAL C 1 357 ? -26.978 -6.156 61.274 1.00 34.18 ? 357 VAL C CB 1 +ATOM 14286 C CG1 . VAL C 1 357 ? -28.034 -7.099 61.846 1.00 31.22 ? 357 VAL C CG1 1 +ATOM 14287 C CG2 . VAL C 1 357 ? -25.646 -6.887 61.144 1.00 32.19 ? 357 VAL C CG2 1 +ATOM 14288 N N . VAL C 1 358 ? -29.813 -5.969 59.560 1.00 35.01 ? 358 VAL C N 1 +ATOM 14289 C CA . VAL C 1 358 ? -31.233 -5.616 59.589 1.00 35.20 ? 358 VAL C CA 1 +ATOM 14290 C C . VAL C 1 358 ? -32.097 -6.657 60.277 1.00 36.26 ? 358 VAL C C 1 +ATOM 14291 O O . VAL C 1 358 ? -31.734 -7.828 60.355 1.00 38.03 ? 358 VAL C O 1 +ATOM 14292 C CB . VAL C 1 358 ? -31.797 -5.401 58.157 1.00 35.13 ? 358 VAL C CB 1 +ATOM 14293 C CG1 . VAL C 1 358 ? -31.029 -4.289 57.463 1.00 33.84 ? 358 VAL C CG1 1 +ATOM 14294 C CG2 . VAL C 1 358 ? -31.712 -6.689 57.355 1.00 32.72 ? 358 VAL C CG2 1 +ATOM 14295 N N . HIS C 1 359 ? -33.249 -6.216 60.767 1.00 35.65 ? 359 HIS C N 1 +ATOM 14296 C CA . HIS C 1 359 ? -34.190 -7.089 61.461 1.00 36.89 ? 359 HIS C CA 1 +ATOM 14297 C C . HIS C 1 359 ? -35.586 -6.843 60.898 1.00 36.43 ? 359 HIS C C 1 +ATOM 14298 O O . HIS C 1 359 ? -35.805 -5.881 60.168 1.00 36.31 ? 359 HIS C O 1 +ATOM 14299 C CB . HIS C 1 359 ? -34.225 -6.760 62.961 1.00 36.66 ? 359 HIS C CB 1 +ATOM 14300 C CG . HIS C 1 359 ? -32.903 -6.882 63.650 1.00 38.10 ? 359 HIS C CG 1 +ATOM 14301 N ND1 . HIS C 1 359 ? -32.365 -8.095 64.022 1.00 40.06 ? 359 HIS C ND1 1 +ATOM 14302 C CD2 . HIS C 1 359 ? -32.014 -5.940 64.047 1.00 37.89 ? 359 HIS C CD2 1 +ATOM 14303 C CE1 . HIS C 1 359 ? -31.203 -7.894 64.620 1.00 38.61 ? 359 HIS C CE1 1 +ATOM 14304 N NE2 . HIS C 1 359 ? -30.967 -6.595 64.647 1.00 36.77 ? 359 HIS C NE2 1 +ATOM 14305 N N . TYR C 1 360 ? -36.525 -7.716 61.239 1.00 37.39 ? 360 TYR C N 1 +ATOM 14306 C CA . TYR C 1 360 ? -37.909 -7.545 60.815 1.00 38.77 ? 360 TYR C CA 1 +ATOM 14307 C C . TYR C 1 360 ? -38.731 -7.352 62.073 1.00 38.45 ? 360 TYR C C 1 +ATOM 14308 O O . TYR C 1 360 ? -38.983 -8.291 62.819 1.00 38.45 ? 360 TYR C O 1 +ATOM 14309 C CB . TYR C 1 360 ? -38.418 -8.753 60.029 1.00 40.75 ? 360 TYR C CB 1 +ATOM 14310 C CG . TYR C 1 360 ? -37.827 -8.831 58.641 1.00 46.45 ? 360 TYR C CG 1 +ATOM 14311 C CD1 . TYR C 1 360 ? -36.604 -9.471 58.416 1.00 49.80 ? 360 TYR C CD1 1 +ATOM 14312 C CD2 . TYR C 1 360 ? -38.454 -8.205 57.558 1.00 47.25 ? 360 TYR C CD2 1 +ATOM 14313 C CE1 . TYR C 1 360 ? -36.015 -9.482 57.144 1.00 51.98 ? 360 TYR C CE1 1 +ATOM 14314 C CE2 . TYR C 1 360 ? -37.875 -8.209 56.287 1.00 49.65 ? 360 TYR C CE2 1 +ATOM 14315 C CZ . TYR C 1 360 ? -36.659 -8.847 56.088 1.00 51.58 ? 360 TYR C CZ 1 +ATOM 14316 O OH . TYR C 1 360 ? -36.078 -8.846 54.842 1.00 54.99 ? 360 TYR C OH 1 +ATOM 14317 N N . LEU C 1 361 ? -39.120 -6.111 62.320 1.00 37.89 ? 361 LEU C N 1 +ATOM 14318 C CA . LEU C 1 361 ? -39.907 -5.792 63.493 1.00 37.85 ? 361 LEU C CA 1 +ATOM 14319 C C . LEU C 1 361 ? -41.341 -5.546 63.044 1.00 38.20 ? 361 LEU C C 1 +ATOM 14320 O O . LEU C 1 361 ? -41.596 -4.686 62.201 1.00 37.75 ? 361 LEU C O 1 +ATOM 14321 C CB . LEU C 1 361 ? -39.337 -4.551 64.175 1.00 36.55 ? 361 LEU C CB 1 +ATOM 14322 C CG . LEU C 1 361 ? -40.098 -4.052 65.400 1.00 37.96 ? 361 LEU C CG 1 +ATOM 14323 C CD1 . LEU C 1 361 ? -40.146 -5.138 66.463 1.00 36.87 ? 361 LEU C CD1 1 +ATOM 14324 C CD2 . LEU C 1 361 ? -39.414 -2.806 65.937 1.00 38.79 ? 361 LEU C CD2 1 +ATOM 14325 N N . ARG C 1 362 ? -42.270 -6.314 63.600 1.00 37.96 ? 362 ARG C N 1 +ATOM 14326 C CA . ARG C 1 362 ? -43.676 -6.192 63.247 1.00 38.50 ? 362 ARG C CA 1 +ATOM 14327 C C . ARG C 1 362 ? -43.848 -6.125 61.727 1.00 40.34 ? 362 ARG C C 1 +ATOM 14328 O O . ARG C 1 362 ? -44.561 -5.266 61.194 1.00 39.97 ? 362 ARG C O 1 +ATOM 14329 C CB . ARG C 1 362 ? -44.290 -4.963 63.927 1.00 36.29 ? 362 ARG C CB 1 +ATOM 14330 C CG . ARG C 1 362 ? -44.313 -5.073 65.453 1.00 35.01 ? 362 ARG C CG 1 +ATOM 14331 C CD . ARG C 1 362 ? -45.161 -4.002 66.114 1.00 32.70 ? 362 ARG C CD 1 +ATOM 14332 N NE . ARG C 1 362 ? -44.703 -2.645 65.820 1.00 36.95 ? 362 ARG C NE 1 +ATOM 14333 C CZ . ARG C 1 362 ? -43.656 -2.049 66.390 1.00 36.76 ? 362 ARG C CZ 1 +ATOM 14334 N NH1 . ARG C 1 362 ? -42.936 -2.682 67.304 1.00 36.15 ? 362 ARG C NH1 1 +ATOM 14335 N NH2 . ARG C 1 362 ? -43.327 -0.813 66.037 1.00 36.56 ? 362 ARG C NH2 1 +ATOM 14336 N N . GLY C 1 363 ? -43.162 -7.035 61.037 1.00 41.48 ? 363 GLY C N 1 +ATOM 14337 C CA . GLY C 1 363 ? -43.247 -7.109 59.588 1.00 42.71 ? 363 GLY C CA 1 +ATOM 14338 C C . GLY C 1 363 ? -42.444 -6.097 58.801 1.00 43.26 ? 363 GLY C C 1 +ATOM 14339 O O . GLY C 1 363 ? -42.325 -6.213 57.584 1.00 44.08 ? 363 GLY C O 1 +ATOM 14340 N N . LYS C 1 364 ? -41.886 -5.105 59.480 1.00 43.86 ? 364 LYS C N 1 +ATOM 14341 C CA . LYS C 1 364 ? -41.111 -4.079 58.797 1.00 44.03 ? 364 LYS C CA 1 +ATOM 14342 C C . LYS C 1 364 ? -39.604 -4.312 58.926 1.00 42.76 ? 364 LYS C C 1 +ATOM 14343 O O . LYS C 1 364 ? -39.110 -4.733 59.975 1.00 43.14 ? 364 LYS C O 1 +ATOM 14344 C CB . LYS C 1 364 ? -41.490 -2.702 59.351 1.00 45.30 ? 364 LYS C CB 1 +ATOM 14345 C CG . LYS C 1 364 ? -40.770 -1.534 58.692 1.00 48.87 ? 364 LYS C CG 1 +ATOM 14346 C CD . LYS C 1 364 ? -41.194 -0.209 59.328 1.00 51.47 ? 364 LYS C CD 1 +ATOM 14347 C CE . LYS C 1 364 ? -40.570 0.979 58.617 1.00 52.46 ? 364 LYS C CE 1 +ATOM 14348 N NZ . LYS C 1 364 ? -41.045 2.264 59.192 1.00 53.82 ? 364 LYS C NZ 1 +ATOM 14349 N N . ARG C 1 365 ? -38.885 -4.037 57.848 1.00 41.84 ? 365 ARG C N 1 +ATOM 14350 C CA . ARG C 1 365 ? -37.434 -4.199 57.801 1.00 42.89 ? 365 ARG C CA 1 +ATOM 14351 C C . ARG C 1 365 ? -36.783 -2.943 58.386 1.00 42.26 ? 365 ARG C C 1 +ATOM 14352 O O . ARG C 1 365 ? -36.994 -1.841 57.885 1.00 42.28 ? 365 ARG C O 1 +ATOM 14353 C CB . ARG C 1 365 ? -37.013 -4.403 56.350 1.00 43.56 ? 365 ARG C CB 1 +ATOM 14354 C CG . ARG C 1 365 ? -35.617 -4.897 56.123 1.00 47.93 ? 365 ARG C CG 1 +ATOM 14355 C CD . ARG C 1 365 ? -35.588 -5.654 54.801 1.00 53.26 ? 365 ARG C CD 1 +ATOM 14356 N NE . ARG C 1 365 ? -34.243 -5.810 54.263 1.00 55.68 ? 365 ARG C NE 1 +ATOM 14357 C CZ . ARG C 1 365 ? -33.481 -4.794 53.870 1.00 58.07 ? 365 ARG C CZ 1 +ATOM 14358 N NH1 . ARG C 1 365 ? -33.938 -3.548 53.960 1.00 58.40 ? 365 ARG C NH1 1 +ATOM 14359 N NH2 . ARG C 1 365 ? -32.264 -5.025 53.384 1.00 58.01 ? 365 ARG C NH2 1 +ATOM 14360 N N . VAL C 1 366 ? -36.009 -3.111 59.456 1.00 41.17 ? 366 VAL C N 1 +ATOM 14361 C CA . VAL C 1 366 ? -35.357 -1.983 60.120 1.00 39.21 ? 366 VAL C CA 1 +ATOM 14362 C C . VAL C 1 366 ? -33.864 -2.205 60.359 1.00 38.53 ? 366 VAL C C 1 +ATOM 14363 O O . VAL C 1 366 ? -33.398 -3.341 60.481 1.00 38.14 ? 366 VAL C O 1 +ATOM 14364 C CB . VAL C 1 366 ? -36.018 -1.687 61.486 1.00 38.61 ? 366 VAL C CB 1 +ATOM 14365 C CG1 . VAL C 1 366 ? -37.469 -1.318 61.297 1.00 38.80 ? 366 VAL C CG1 1 +ATOM 14366 C CG2 . VAL C 1 366 ? -35.914 -2.917 62.385 1.00 39.25 ? 366 VAL C CG2 1 +ATOM 14367 N N . LYS C 1 367 ? -33.116 -1.110 60.426 1.00 37.83 ? 367 LYS C N 1 +ATOM 14368 C CA . LYS C 1 367 ? -31.683 -1.190 60.666 1.00 38.46 ? 367 LYS C CA 1 +ATOM 14369 C C . LYS C 1 367 ? -31.414 -1.545 62.122 1.00 36.82 ? 367 LYS C C 1 +ATOM 14370 O O . LYS C 1 367 ? -32.135 -1.106 63.021 1.00 35.51 ? 367 LYS C O 1 +ATOM 14371 C CB . LYS C 1 367 ? -31.004 0.140 60.344 1.00 40.56 ? 367 LYS C CB 1 +ATOM 14372 C CG . LYS C 1 367 ? -30.945 0.481 58.874 1.00 42.76 ? 367 LYS C CG 1 +ATOM 14373 C CD . LYS C 1 367 ? -30.177 1.780 58.673 1.00 46.39 ? 367 LYS C CD 1 +ATOM 14374 C CE . LYS C 1 367 ? -30.009 2.104 57.196 1.00 51.19 ? 367 LYS C CE 1 +ATOM 14375 N NZ . LYS C 1 367 ? -29.164 3.317 56.981 1.00 53.53 ? 367 LYS C NZ 1 +ATOM 14376 N N . HIS C 1 368 ? -30.371 -2.339 62.343 1.00 35.36 ? 368 HIS C N 1 +ATOM 14377 C CA . HIS C 1 368 ? -30.004 -2.763 63.685 1.00 34.08 ? 368 HIS C CA 1 +ATOM 14378 C C . HIS C 1 368 ? -29.770 -1.571 64.628 1.00 34.29 ? 368 HIS C C 1 +ATOM 14379 O O . HIS C 1 368 ? -30.144 -1.615 65.802 1.00 32.16 ? 368 HIS C O 1 +ATOM 14380 C CB . HIS C 1 368 ? -28.743 -3.639 63.635 1.00 32.30 ? 368 HIS C CB 1 +ATOM 14381 C CG . HIS C 1 368 ? -28.260 -4.058 64.987 1.00 33.51 ? 368 HIS C CG 1 +ATOM 14382 N ND1 . HIS C 1 368 ? -28.888 -5.036 65.733 1.00 32.78 ? 368 HIS C ND1 1 +ATOM 14383 C CD2 . HIS C 1 368 ? -27.266 -3.569 65.768 1.00 32.43 ? 368 HIS C CD2 1 +ATOM 14384 C CE1 . HIS C 1 368 ? -28.305 -5.127 66.915 1.00 32.03 ? 368 HIS C CE1 1 +ATOM 14385 N NE2 . HIS C 1 368 ? -27.320 -4.247 66.962 1.00 33.83 ? 368 HIS C NE2 1 +ATOM 14386 N N . GLU C 1 369 ? -29.165 -0.503 64.111 1.00 35.48 ? 369 GLU C N 1 +ATOM 14387 C CA . GLU C 1 369 ? -28.866 0.664 64.933 1.00 38.46 ? 369 GLU C CA 1 +ATOM 14388 C C . GLU C 1 369 ? -30.099 1.398 65.434 1.00 38.14 ? 369 GLU C C 1 +ATOM 14389 O O . GLU C 1 369 ? -30.011 2.171 66.387 1.00 39.09 ? 369 GLU C O 1 +ATOM 14390 C CB . GLU C 1 369 ? -27.964 1.639 64.173 1.00 42.88 ? 369 GLU C CB 1 +ATOM 14391 C CG . GLU C 1 369 ? -28.576 2.182 62.893 1.00 50.46 ? 369 GLU C CG 1 +ATOM 14392 C CD . GLU C 1 369 ? -27.591 3.005 62.084 1.00 54.27 ? 369 GLU C CD 1 +ATOM 14393 O OE1 . GLU C 1 369 ? -27.338 4.177 62.449 1.00 57.10 ? 369 GLU C OE1 1 +ATOM 14394 O OE2 . GLU C 1 369 ? -27.056 2.470 61.089 1.00 57.08 ? 369 GLU C OE2 1 +ATOM 14395 N N . LYS C 1 370 ? -31.245 1.168 64.801 1.00 36.85 ? 370 LYS C N 1 +ATOM 14396 C CA . LYS C 1 370 ? -32.477 1.815 65.231 1.00 35.79 ? 370 LYS C CA 1 +ATOM 14397 C C . LYS C 1 370 ? -33.124 1.060 66.392 1.00 34.25 ? 370 LYS C C 1 +ATOM 14398 O O . LYS C 1 370 ? -33.774 1.665 67.243 1.00 33.39 ? 370 LYS C O 1 +ATOM 14399 C CB . LYS C 1 370 ? -33.486 1.892 64.078 1.00 39.10 ? 370 LYS C CB 1 +ATOM 14400 C CG . LYS C 1 370 ? -33.046 2.744 62.890 1.00 46.60 ? 370 LYS C CG 1 +ATOM 14401 C CD . LYS C 1 370 ? -32.936 4.222 63.264 1.00 51.56 ? 370 LYS C CD 1 +ATOM 14402 C CE . LYS C 1 370 ? -32.608 5.085 62.047 1.00 53.37 ? 370 LYS C CE 1 +ATOM 14403 N NZ . LYS C 1 370 ? -31.319 4.676 61.417 1.00 57.84 ? 370 LYS C NZ 1 +ATOM 14404 N N . VAL C 1 371 ? -32.935 -0.259 66.437 1.00 32.36 ? 371 VAL C N 1 +ATOM 14405 C CA . VAL C 1 371 ? -33.562 -1.072 67.472 1.00 30.39 ? 371 VAL C CA 1 +ATOM 14406 C C . VAL C 1 371 ? -32.630 -1.917 68.326 1.00 30.27 ? 371 VAL C C 1 +ATOM 14407 O O . VAL C 1 371 ? -33.100 -2.726 69.130 1.00 29.84 ? 371 VAL C O 1 +ATOM 14408 C CB . VAL C 1 371 ? -34.594 -2.014 66.831 1.00 32.03 ? 371 VAL C CB 1 +ATOM 14409 C CG1 . VAL C 1 371 ? -35.615 -1.195 66.023 1.00 30.48 ? 371 VAL C CG1 1 +ATOM 14410 C CG2 . VAL C 1 371 ? -33.883 -3.029 65.931 1.00 29.04 ? 371 VAL C CG2 1 +ATOM 14411 N N . ARG C 1 372 ? -31.322 -1.719 68.165 1.00 29.24 ? 372 ARG C N 1 +ATOM 14412 C CA . ARG C 1 372 ? -30.326 -2.495 68.892 1.00 28.51 ? 372 ARG C CA 1 +ATOM 14413 C C . ARG C 1 372 ? -30.600 -2.854 70.343 1.00 28.44 ? 372 ARG C C 1 +ATOM 14414 O O . ARG C 1 372 ? -30.593 -4.027 70.708 1.00 28.13 ? 372 ARG C O 1 +ATOM 14415 C CB . ARG C 1 372 ? -28.955 -1.810 68.832 1.00 29.35 ? 372 ARG C CB 1 +ATOM 14416 C CG . ARG C 1 372 ? -27.896 -2.543 69.663 1.00 29.48 ? 372 ARG C CG 1 +ATOM 14417 C CD . ARG C 1 372 ? -26.491 -1.994 69.470 1.00 31.73 ? 372 ARG C CD 1 +ATOM 14418 N NE . ARG C 1 372 ? -25.558 -2.671 70.370 1.00 32.13 ? 372 ARG C NE 1 +ATOM 14419 C CZ . ARG C 1 372 ? -25.022 -3.873 70.159 1.00 32.16 ? 372 ARG C CZ 1 +ATOM 14420 N NH1 . ARG C 1 372 ? -25.305 -4.558 69.057 1.00 30.42 ? 372 ARG C NH1 1 +ATOM 14421 N NH2 . ARG C 1 372 ? -24.219 -4.409 71.075 1.00 31.05 ? 372 ARG C NH2 1 +ATOM 14422 N N . ASN C 1 373 ? -30.832 -1.847 71.173 1.00 28.40 ? 373 ASN C N 1 +ATOM 14423 C CA . ASN C 1 373 ? -31.023 -2.084 72.594 1.00 29.64 ? 373 ASN C CA 1 +ATOM 14424 C C . ASN C 1 373 ? -32.176 -2.982 73.009 1.00 30.83 ? 373 ASN C C 1 +ATOM 14425 O O . ASN C 1 373 ? -32.162 -3.544 74.116 1.00 29.63 ? 373 ASN C O 1 +ATOM 14426 C CB . ASN C 1 373 ? -31.102 -0.748 73.328 1.00 29.97 ? 373 ASN C CB 1 +ATOM 14427 C CG . ASN C 1 373 ? -29.876 0.106 73.084 1.00 31.82 ? 373 ASN C CG 1 +ATOM 14428 O OD1 . ASN C 1 373 ? -28.785 -0.422 72.874 1.00 31.85 ? 373 ASN C OD1 1 +ATOM 14429 N ND2 . ASN C 1 373 ? -30.041 1.427 73.113 1.00 32.74 ? 373 ASN C ND2 1 +ATOM 14430 N N . ALA C 1 374 ? -33.163 -3.140 72.134 1.00 29.44 ? 374 ALA C N 1 +ATOM 14431 C CA . ALA C 1 374 ? -34.287 -3.990 72.471 1.00 30.31 ? 374 ALA C CA 1 +ATOM 14432 C C . ALA C 1 374 ? -34.024 -5.477 72.157 1.00 29.94 ? 374 ALA C C 1 +ATOM 14433 O O . ALA C 1 374 ? -34.828 -6.340 72.519 1.00 30.01 ? 374 ALA C O 1 +ATOM 14434 C CB . ALA C 1 374 ? -35.539 -3.495 71.749 1.00 31.09 ? 374 ALA C CB 1 +ATOM 14435 N N . TYR C 1 375 ? -32.901 -5.775 71.502 1.00 29.19 ? 375 TYR C N 1 +ATOM 14436 C CA . TYR C 1 375 ? -32.562 -7.156 71.151 1.00 30.87 ? 375 TYR C CA 1 +ATOM 14437 C C . TYR C 1 375 ? -32.622 -8.093 72.368 1.00 32.15 ? 375 TYR C C 1 +ATOM 14438 O O . TYR C 1 375 ? -33.309 -9.116 72.340 1.00 31.91 ? 375 TYR C O 1 +ATOM 14439 C CB . TYR C 1 375 ? -31.172 -7.216 70.520 1.00 31.62 ? 375 TYR C CB 1 +ATOM 14440 C CG . TYR C 1 375 ? -30.799 -8.578 69.960 1.00 33.67 ? 375 TYR C CG 1 +ATOM 14441 C CD1 . TYR C 1 375 ? -31.134 -8.937 68.651 1.00 33.36 ? 375 TYR C CD1 1 +ATOM 14442 C CD2 . TYR C 1 375 ? -30.103 -9.503 70.737 1.00 33.61 ? 375 TYR C CD2 1 +ATOM 14443 C CE1 . TYR C 1 375 ? -30.780 -10.180 68.130 1.00 33.52 ? 375 TYR C CE1 1 +ATOM 14444 C CE2 . TYR C 1 375 ? -29.742 -10.749 70.233 1.00 34.01 ? 375 TYR C CE2 1 +ATOM 14445 C CZ . TYR C 1 375 ? -30.080 -11.086 68.929 1.00 35.80 ? 375 TYR C CZ 1 +ATOM 14446 O OH . TYR C 1 375 ? -29.711 -12.328 68.439 1.00 35.97 ? 375 TYR C OH 1 +ATOM 14447 N N . PRO C 1 376 ? -31.904 -7.758 73.457 1.00 32.48 ? 376 PRO C N 1 +ATOM 14448 C CA . PRO C 1 376 ? -31.958 -8.642 74.627 1.00 32.61 ? 376 PRO C CA 1 +ATOM 14449 C C . PRO C 1 376 ? -33.374 -8.781 75.203 1.00 31.51 ? 376 PRO C C 1 +ATOM 14450 O O . PRO C 1 376 ? -33.732 -9.827 75.754 1.00 30.14 ? 376 PRO C O 1 +ATOM 14451 C CB . PRO C 1 376 ? -30.988 -7.979 75.606 1.00 31.78 ? 376 PRO C CB 1 +ATOM 14452 C CG . PRO C 1 376 ? -31.095 -6.516 75.235 1.00 33.20 ? 376 PRO C CG 1 +ATOM 14453 C CD . PRO C 1 376 ? -31.068 -6.575 73.731 1.00 31.53 ? 376 PRO C CD 1 +ATOM 14454 N N . LEU C 1 377 ? -34.176 -7.729 75.082 1.00 31.79 ? 377 LEU C N 1 +ATOM 14455 C CA . LEU C 1 377 ? -35.546 -7.776 75.601 1.00 32.37 ? 377 LEU C CA 1 +ATOM 14456 C C . LEU C 1 377 ? -36.344 -8.878 74.897 1.00 32.07 ? 377 LEU C C 1 +ATOM 14457 O O . LEU C 1 377 ? -37.034 -9.660 75.544 1.00 31.02 ? 377 LEU C O 1 +ATOM 14458 C CB . LEU C 1 377 ? -36.259 -6.433 75.398 1.00 32.43 ? 377 LEU C CB 1 +ATOM 14459 C CG . LEU C 1 377 ? -37.765 -6.411 75.716 1.00 32.81 ? 377 LEU C CG 1 +ATOM 14460 C CD1 . LEU C 1 377 ? -37.981 -6.620 77.202 1.00 33.06 ? 377 LEU C CD1 1 +ATOM 14461 C CD2 . LEU C 1 377 ? -38.372 -5.090 75.285 1.00 32.26 ? 377 LEU C CD2 1 +ATOM 14462 N N . TYR C 1 378 ? -36.241 -8.932 73.572 1.00 30.67 ? 378 TYR C N 1 +ATOM 14463 C CA . TYR C 1 378 ? -36.962 -9.929 72.804 1.00 32.87 ? 378 TYR C CA 1 +ATOM 14464 C C . TYR C 1 378 ? -36.418 -11.338 73.012 1.00 33.77 ? 378 TYR C C 1 +ATOM 14465 O O . TYR C 1 378 ? -37.172 -12.312 72.936 1.00 33.99 ? 378 TYR C O 1 +ATOM 14466 C CB . TYR C 1 378 ? -36.964 -9.550 71.319 1.00 32.70 ? 378 TYR C CB 1 +ATOM 14467 C CG . TYR C 1 378 ? -37.968 -8.467 71.005 1.00 34.14 ? 378 TYR C CG 1 +ATOM 14468 C CD1 . TYR C 1 378 ? -39.339 -8.754 70.950 1.00 34.57 ? 378 TYR C CD1 1 +ATOM 14469 C CD2 . TYR C 1 378 ? -37.561 -7.144 70.812 1.00 34.98 ? 378 TYR C CD2 1 +ATOM 14470 C CE1 . TYR C 1 378 ? -40.285 -7.748 70.711 1.00 34.08 ? 378 TYR C CE1 1 +ATOM 14471 C CE2 . TYR C 1 378 ? -38.494 -6.127 70.574 1.00 36.27 ? 378 TYR C CE2 1 +ATOM 14472 C CZ . TYR C 1 378 ? -39.857 -6.437 70.525 1.00 36.47 ? 378 TYR C CZ 1 +ATOM 14473 O OH . TYR C 1 378 ? -40.777 -5.433 70.297 1.00 33.91 ? 378 TYR C OH 1 +ATOM 14474 N N . GLU C 1 379 ? -35.118 -11.455 73.275 1.00 34.13 ? 379 GLU C N 1 +ATOM 14475 C CA . GLU C 1 379 ? -34.537 -12.763 73.527 1.00 33.13 ? 379 GLU C CA 1 +ATOM 14476 C C . GLU C 1 379 ? -35.072 -13.257 74.871 1.00 32.87 ? 379 GLU C C 1 +ATOM 14477 O O . GLU C 1 379 ? -35.455 -14.418 75.000 1.00 34.79 ? 379 GLU C O 1 +ATOM 14478 C CB . GLU C 1 379 ? -33.009 -12.695 73.577 1.00 35.27 ? 379 GLU C CB 1 +ATOM 14479 C CG . GLU C 1 379 ? -32.373 -14.038 73.941 1.00 38.11 ? 379 GLU C CG 1 +ATOM 14480 C CD . GLU C 1 379 ? -30.904 -13.932 74.301 1.00 40.35 ? 379 GLU C CD 1 +ATOM 14481 O OE1 . GLU C 1 379 ? -30.521 -12.942 74.975 1.00 42.32 ? 379 GLU C OE1 1 +ATOM 14482 O OE2 . GLU C 1 379 ? -30.142 -14.853 73.929 1.00 40.14 ? 379 GLU C OE2 1 +ATOM 14483 N N . ALA C 1 380 ? -35.109 -12.376 75.870 1.00 31.07 ? 380 ALA C N 1 +ATOM 14484 C CA . ALA C 1 380 ? -35.617 -12.754 77.185 1.00 30.58 ? 380 ALA C CA 1 +ATOM 14485 C C . ALA C 1 380 ? -37.093 -13.134 77.082 1.00 30.38 ? 380 ALA C C 1 +ATOM 14486 O O . ALA C 1 380 ? -37.552 -14.064 77.736 1.00 31.10 ? 380 ALA C O 1 +ATOM 14487 C CB . ALA C 1 380 ? -35.442 -11.605 78.172 1.00 28.12 ? 380 ALA C CB 1 +ATOM 14488 N N . MET C 1 381 ? -37.826 -12.401 76.260 1.00 30.63 ? 381 MET C N 1 +ATOM 14489 C CA . MET C 1 381 ? -39.249 -12.638 76.051 1.00 33.06 ? 381 MET C CA 1 +ATOM 14490 C C . MET C 1 381 ? -39.468 -14.059 75.534 1.00 33.91 ? 381 MET C C 1 +ATOM 14491 O O . MET C 1 381 ? -40.300 -14.802 76.049 1.00 33.66 ? 381 MET C O 1 +ATOM 14492 C CB . MET C 1 381 ? -39.784 -11.629 75.032 1.00 34.09 ? 381 MET C CB 1 +ATOM 14493 C CG . MET C 1 381 ? -41.265 -11.727 74.747 1.00 34.78 ? 381 MET C CG 1 +ATOM 14494 S SD . MET C 1 381 ? -41.752 -10.573 73.444 1.00 39.58 ? 381 MET C SD 1 +ATOM 14495 C CE . MET C 1 381 ? -41.551 -8.945 74.287 1.00 37.35 ? 381 MET C CE 1 +ATOM 14496 N N . ALA C 1 382 ? -38.708 -14.428 74.509 1.00 34.89 ? 382 ALA C N 1 +ATOM 14497 C CA . ALA C 1 382 ? -38.803 -15.755 73.913 1.00 34.59 ? 382 ALA C CA 1 +ATOM 14498 C C . ALA C 1 382 ? -38.374 -16.831 74.910 1.00 35.48 ? 382 ALA C C 1 +ATOM 14499 O O . ALA C 1 382 ? -38.923 -17.931 74.927 1.00 35.96 ? 382 ALA C O 1 +ATOM 14500 C CB . ALA C 1 382 ? -37.926 -15.826 72.675 1.00 34.44 ? 382 ALA C CB 1 +ATOM 14501 N N . THR C 1 383 ? -37.383 -16.516 75.736 1.00 35.07 ? 383 THR C N 1 +ATOM 14502 C CA . THR C 1 383 ? -36.906 -17.477 76.720 1.00 33.86 ? 383 THR C CA 1 +ATOM 14503 C C . THR C 1 383 ? -37.959 -17.673 77.810 1.00 33.52 ? 383 THR C C 1 +ATOM 14504 O O . THR C 1 383 ? -38.152 -18.777 78.307 1.00 34.12 ? 383 THR C O 1 +ATOM 14505 C CB . THR C 1 383 ? -35.577 -17.003 77.335 1.00 32.72 ? 383 THR C CB 1 +ATOM 14506 O OG1 . THR C 1 383 ? -34.620 -16.809 76.287 1.00 34.08 ? 383 THR C OG1 1 +ATOM 14507 C CG2 . THR C 1 383 ? -35.032 -18.038 78.305 1.00 31.42 ? 383 THR C CG2 1 +ATOM 14508 N N . PHE C 1 384 ? -38.638 -16.596 78.176 1.00 33.68 ? 384 PHE C N 1 +ATOM 14509 C CA . PHE C 1 384 ? -39.683 -16.652 79.190 1.00 35.75 ? 384 PHE C CA 1 +ATOM 14510 C C . PHE C 1 384 ? -40.810 -17.525 78.626 1.00 37.16 ? 384 PHE C C 1 +ATOM 14511 O O . PHE C 1 384 ? -41.389 -18.356 79.323 1.00 37.70 ? 384 PHE C O 1 +ATOM 14512 C CB . PHE C 1 384 ? -40.209 -15.242 79.464 1.00 34.31 ? 384 PHE C CB 1 +ATOM 14513 C CG . PHE C 1 384 ? -41.093 -15.143 80.672 1.00 34.91 ? 384 PHE C CG 1 +ATOM 14514 C CD1 . PHE C 1 384 ? -40.543 -14.979 81.939 1.00 32.66 ? 384 PHE C CD1 1 +ATOM 14515 C CD2 . PHE C 1 384 ? -42.484 -15.197 80.545 1.00 34.00 ? 384 PHE C CD2 1 +ATOM 14516 C CE1 . PHE C 1 384 ? -41.362 -14.868 83.061 1.00 32.28 ? 384 PHE C CE1 1 +ATOM 14517 C CE2 . PHE C 1 384 ? -43.305 -15.088 81.661 1.00 33.11 ? 384 PHE C CE2 1 +ATOM 14518 C CZ . PHE C 1 384 ? -42.740 -14.921 82.923 1.00 32.04 ? 384 PHE C CZ 1 +ATOM 14519 N N . LYS C 1 385 ? -41.111 -17.320 77.349 1.00 38.36 ? 385 LYS C N 1 +ATOM 14520 C CA . LYS C 1 385 ? -42.140 -18.077 76.661 1.00 39.19 ? 385 LYS C CA 1 +ATOM 14521 C C . LYS C 1 385 ? -41.754 -19.552 76.685 1.00 39.65 ? 385 LYS C C 1 +ATOM 14522 O O . LYS C 1 385 ? -42.611 -20.431 76.705 1.00 40.68 ? 385 LYS C O 1 +ATOM 14523 C CB . LYS C 1 385 ? -42.254 -17.577 75.224 1.00 41.79 ? 385 LYS C CB 1 +ATOM 14524 C CG . LYS C 1 385 ? -43.250 -18.316 74.356 1.00 45.17 ? 385 LYS C CG 1 +ATOM 14525 C CD . LYS C 1 385 ? -43.200 -17.764 72.931 1.00 48.51 ? 385 LYS C CD 1 +ATOM 14526 C CE . LYS C 1 385 ? -44.102 -18.556 71.988 1.00 51.26 ? 385 LYS C CE 1 +ATOM 14527 N NZ . LYS C 1 385 ? -45.535 -18.496 72.397 1.00 52.36 ? 385 LYS C NZ 1 +ATOM 14528 N N . GLY C 1 386 ? -40.454 -19.817 76.686 1.00 39.60 ? 386 GLY C N 1 +ATOM 14529 C CA . GLY C 1 386 ? -39.979 -21.186 76.730 1.00 39.43 ? 386 GLY C CA 1 +ATOM 14530 C C . GLY C 1 386 ? -40.341 -21.855 78.046 1.00 40.17 ? 386 GLY C C 1 +ATOM 14531 O O . GLY C 1 386 ? -40.588 -23.061 78.085 1.00 40.74 ? 386 GLY C O 1 +ATOM 14532 N N . PHE C 1 387 ? -40.357 -21.084 79.132 1.00 40.49 ? 387 PHE C N 1 +ATOM 14533 C CA . PHE C 1 387 ? -40.710 -21.634 80.432 1.00 40.61 ? 387 PHE C CA 1 +ATOM 14534 C C . PHE C 1 387 ? -42.198 -21.962 80.450 1.00 41.31 ? 387 PHE C C 1 +ATOM 14535 O O . PHE C 1 387 ? -42.603 -22.984 80.998 1.00 41.67 ? 387 PHE C O 1 +ATOM 14536 C CB . PHE C 1 387 ? -40.380 -20.649 81.562 1.00 38.51 ? 387 PHE C CB 1 +ATOM 14537 C CG . PHE C 1 387 ? -38.958 -20.730 82.039 1.00 37.44 ? 387 PHE C CG 1 +ATOM 14538 C CD1 . PHE C 1 387 ? -37.919 -20.177 81.292 1.00 36.13 ? 387 PHE C CD1 1 +ATOM 14539 C CD2 . PHE C 1 387 ? -38.652 -21.389 83.225 1.00 35.33 ? 387 PHE C CD2 1 +ATOM 14540 C CE1 . PHE C 1 387 ? -36.596 -20.286 81.724 1.00 34.95 ? 387 PHE C CE1 1 +ATOM 14541 C CE2 . PHE C 1 387 ? -37.336 -21.501 83.661 1.00 35.10 ? 387 PHE C CE2 1 +ATOM 14542 C CZ . PHE C 1 387 ? -36.306 -20.952 82.912 1.00 34.99 ? 387 PHE C CZ 1 +ATOM 14543 N N . ARG C 1 388 ? -43.003 -21.091 79.849 1.00 43.28 ? 388 ARG C N 1 +ATOM 14544 C CA . ARG C 1 388 ? -44.452 -21.291 79.775 1.00 45.84 ? 388 ARG C CA 1 +ATOM 14545 C C . ARG C 1 388 ? -44.761 -22.556 78.988 1.00 46.54 ? 388 ARG C C 1 +ATOM 14546 O O . ARG C 1 388 ? -45.585 -23.368 79.396 1.00 48.47 ? 388 ARG C O 1 +ATOM 14547 C CB . ARG C 1 388 ? -45.125 -20.106 79.084 1.00 47.31 ? 388 ARG C CB 1 +ATOM 14548 C CG . ARG C 1 388 ? -45.025 -18.784 79.831 1.00 48.46 ? 388 ARG C CG 1 +ATOM 14549 C CD . ARG C 1 388 ? -45.594 -18.896 81.233 1.00 50.82 ? 388 ARG C CD 1 +ATOM 14550 N NE . ARG C 1 388 ? -45.947 -17.586 81.772 1.00 53.20 ? 388 ARG C NE 1 +ATOM 14551 C CZ . ARG C 1 388 ? -46.052 -17.314 83.069 1.00 53.32 ? 388 ARG C CZ 1 +ATOM 14552 N NH1 . ARG C 1 388 ? -45.829 -18.266 83.971 1.00 52.43 ? 388 ARG C NH1 1 +ATOM 14553 N NH2 . ARG C 1 388 ? -46.370 -16.084 83.461 1.00 53.85 ? 388 ARG C NH2 1 +ATOM 14554 N N . THR C 1 389 ? -44.094 -22.709 77.851 1.00 47.84 ? 389 THR C N 1 +ATOM 14555 C CA . THR C 1 389 ? -44.263 -23.880 76.998 1.00 48.45 ? 389 THR C CA 1 +ATOM 14556 C C . THR C 1 389 ? -43.979 -25.164 77.768 1.00 49.40 ? 389 THR C C 1 +ATOM 14557 O O . THR C 1 389 ? -44.494 -26.227 77.420 1.00 50.98 ? 389 THR C O 1 +ATOM 14558 C CB . THR C 1 389 ? -43.318 -23.813 75.794 1.00 48.70 ? 389 THR C CB 1 +ATOM 14559 O OG1 . THR C 1 389 ? -43.672 -22.686 74.985 1.00 50.91 ? 389 THR C OG1 1 +ATOM 14560 C CG2 . THR C 1 389 ? -43.412 -25.081 74.961 1.00 48.58 ? 389 THR C CG2 1 +ATOM 14561 N N . SER C 1 390 ? -43.157 -25.065 78.808 1.00 48.71 ? 390 SER C N 1 +ATOM 14562 C CA . SER C 1 390 ? -42.824 -26.224 79.628 1.00 49.42 ? 390 SER C CA 1 +ATOM 14563 C C . SER C 1 390 ? -43.708 -26.305 80.872 1.00 50.53 ? 390 SER C C 1 +ATOM 14564 O O . SER C 1 390 ? -43.511 -27.169 81.733 1.00 50.55 ? 390 SER C O 1 +ATOM 14565 C CB . SER C 1 390 ? -41.359 -26.165 80.062 1.00 48.33 ? 390 SER C CB 1 +ATOM 14566 O OG . SER C 1 390 ? -40.499 -26.317 78.955 1.00 48.96 ? 390 SER C OG 1 +ATOM 14567 N N . HIS C 1 391 ? -44.681 -25.405 80.966 1.00 51.16 ? 391 HIS C N 1 +ATOM 14568 C CA . HIS C 1 391 ? -45.572 -25.378 82.119 1.00 53.61 ? 391 HIS C CA 1 +ATOM 14569 C C . HIS C 1 391 ? -44.739 -25.296 83.394 1.00 52.81 ? 391 HIS C C 1 +ATOM 14570 O O . HIS C 1 391 ? -45.054 -25.925 84.404 1.00 54.51 ? 391 HIS C O 1 +ATOM 14571 C CB . HIS C 1 391 ? -46.446 -26.634 82.146 1.00 55.14 ? 391 HIS C CB 1 +ATOM 14572 C CG . HIS C 1 391 ? -47.248 -26.828 80.901 1.00 58.70 ? 391 HIS C CG 1 +ATOM 14573 N ND1 . HIS C 1 391 ? -48.163 -25.897 80.455 1.00 60.00 ? 391 HIS C ND1 1 +ATOM 14574 C CD2 . HIS C 1 391 ? -47.249 -27.827 79.987 1.00 59.98 ? 391 HIS C CD2 1 +ATOM 14575 C CE1 . HIS C 1 391 ? -48.692 -26.315 79.318 1.00 60.79 ? 391 HIS C CE1 1 +ATOM 14576 N NE2 . HIS C 1 391 ? -48.155 -27.483 79.013 1.00 60.84 ? 391 HIS C NE2 1 +ATOM 14577 N N . ARG C 1 392 ? -43.669 -24.514 83.327 1.00 51.73 ? 392 ARG C N 1 +ATOM 14578 C CA . ARG C 1 392 ? -42.760 -24.321 84.450 1.00 50.47 ? 392 ARG C CA 1 +ATOM 14579 C C . ARG C 1 392 ? -43.196 -23.059 85.183 1.00 51.16 ? 392 ARG C C 1 +ATOM 14580 O O . ARG C 1 392 ? -43.101 -21.965 84.638 1.00 52.74 ? 392 ARG C O 1 +ATOM 14581 C CB . ARG C 1 392 ? -41.343 -24.145 83.917 1.00 49.37 ? 392 ARG C CB 1 +ATOM 14582 C CG . ARG C 1 392 ? -40.258 -24.385 84.924 1.00 47.84 ? 392 ARG C CG 1 +ATOM 14583 C CD . ARG C 1 392 ? -40.209 -25.841 85.328 1.00 46.09 ? 392 ARG C CD 1 +ATOM 14584 N NE . ARG C 1 392 ? -38.829 -26.286 85.428 1.00 46.87 ? 392 ARG C NE 1 +ATOM 14585 C CZ . ARG C 1 392 ? -38.189 -26.966 84.487 1.00 45.94 ? 392 ARG C CZ 1 +ATOM 14586 N NH1 . ARG C 1 392 ? -38.804 -27.301 83.367 1.00 48.53 ? 392 ARG C NH1 1 +ATOM 14587 N NH2 . ARG C 1 392 ? -36.923 -27.295 84.660 1.00 47.20 ? 392 ARG C NH2 1 +ATOM 14588 N N . ASN C 1 393 ? -43.675 -23.203 86.413 1.00 51.67 ? 393 ASN C N 1 +ATOM 14589 C CA . ASN C 1 393 ? -44.137 -22.046 87.175 1.00 51.50 ? 393 ASN C CA 1 +ATOM 14590 C C . ASN C 1 393 ? -42.995 -21.286 87.831 1.00 49.70 ? 393 ASN C C 1 +ATOM 14591 O O . ASN C 1 393 ? -43.065 -20.066 87.979 1.00 48.67 ? 393 ASN C O 1 +ATOM 14592 C CB . ASN C 1 393 ? -45.147 -22.489 88.233 1.00 54.91 ? 393 ASN C CB 1 +ATOM 14593 C CG . ASN C 1 393 ? -46.297 -23.275 87.635 1.00 59.66 ? 393 ASN C CG 1 +ATOM 14594 O OD1 . ASN C 1 393 ? -47.028 -22.775 86.767 1.00 60.22 ? 393 ASN C OD1 1 +ATOM 14595 N ND2 . ASN C 1 393 ? -46.463 -24.521 88.088 1.00 61.60 ? 393 ASN C ND2 1 +ATOM 14596 N N . GLU C 1 394 ? -41.955 -22.009 88.234 1.00 47.73 ? 394 GLU C N 1 +ATOM 14597 C CA . GLU C 1 394 ? -40.796 -21.384 88.855 1.00 46.71 ? 394 GLU C CA 1 +ATOM 14598 C C . GLU C 1 394 ? -39.857 -20.985 87.728 1.00 43.84 ? 394 GLU C C 1 +ATOM 14599 O O . GLU C 1 394 ? -39.158 -21.819 87.154 1.00 43.30 ? 394 GLU C O 1 +ATOM 14600 C CB . GLU C 1 394 ? -40.093 -22.358 89.808 1.00 48.81 ? 394 GLU C CB 1 +ATOM 14601 C CG . GLU C 1 394 ? -41.015 -22.975 90.842 1.00 51.56 ? 394 GLU C CG 1 +ATOM 14602 C CD . GLU C 1 394 ? -40.265 -23.562 92.017 1.00 53.76 ? 394 GLU C CD 1 +ATOM 14603 O OE1 . GLU C 1 394 ? -39.257 -24.274 91.801 1.00 55.91 ? 394 GLU C OE1 1 +ATOM 14604 O OE2 . GLU C 1 394 ? -40.693 -23.314 93.163 1.00 56.33 ? 394 GLU C OE2 1 +ATOM 14605 N N . ILE C 1 395 ? -39.854 -19.699 87.415 1.00 41.11 ? 395 ILE C N 1 +ATOM 14606 C CA . ILE C 1 395 ? -39.039 -19.186 86.336 1.00 38.92 ? 395 ILE C CA 1 +ATOM 14607 C C . ILE C 1 395 ? -37.807 -18.436 86.814 1.00 38.04 ? 395 ILE C C 1 +ATOM 14608 O O . ILE C 1 395 ? -37.881 -17.613 87.724 1.00 36.66 ? 395 ILE C O 1 +ATOM 14609 C CB . ILE C 1 395 ? -39.876 -18.246 85.446 1.00 37.92 ? 395 ILE C CB 1 +ATOM 14610 C CG1 . ILE C 1 395 ? -41.073 -19.020 84.882 1.00 39.94 ? 395 ILE C CG1 1 +ATOM 14611 C CG2 . ILE C 1 395 ? -39.011 -17.659 84.337 1.00 36.19 ? 395 ILE C CG2 1 +ATOM 14612 C CD1 . ILE C 1 395 ? -42.049 -18.180 84.068 1.00 39.45 ? 395 ILE C CD1 1 +ATOM 14613 N N . PHE C 1 396 ? -36.669 -18.738 86.200 1.00 37.04 ? 396 PHE C N 1 +ATOM 14614 C CA . PHE C 1 396 ? -35.442 -18.040 86.529 1.00 36.96 ? 396 PHE C CA 1 +ATOM 14615 C C . PHE C 1 396 ? -34.656 -17.741 85.275 1.00 35.85 ? 396 PHE C C 1 +ATOM 14616 O O . PHE C 1 396 ? -34.198 -18.655 84.590 1.00 36.03 ? 396 PHE C O 1 +ATOM 14617 C CB . PHE C 1 396 ? -34.535 -18.830 87.465 1.00 37.24 ? 396 PHE C CB 1 +ATOM 14618 C CG . PHE C 1 396 ? -33.272 -18.099 87.794 1.00 37.68 ? 396 PHE C CG 1 +ATOM 14619 C CD1 . PHE C 1 396 ? -33.290 -17.032 88.689 1.00 39.29 ? 396 PHE C CD1 1 +ATOM 14620 C CD2 . PHE C 1 396 ? -32.089 -18.395 87.131 1.00 37.55 ? 396 PHE C CD2 1 +ATOM 14621 C CE1 . PHE C 1 396 ? -32.146 -16.260 88.917 1.00 39.92 ? 396 PHE C CE1 1 +ATOM 14622 C CE2 . PHE C 1 396 ? -30.936 -17.631 87.347 1.00 40.57 ? 396 PHE C CE2 1 +ATOM 14623 C CZ . PHE C 1 396 ? -30.965 -16.558 88.242 1.00 40.84 ? 396 PHE C CZ 1 +ATOM 14624 N N . ILE C 1 397 ? -34.506 -16.453 84.981 1.00 35.17 ? 397 ILE C N 1 +ATOM 14625 C CA . ILE C 1 397 ? -33.748 -16.013 83.820 1.00 32.86 ? 397 ILE C CA 1 +ATOM 14626 C C . ILE C 1 397 ? -32.828 -14.869 84.240 1.00 32.20 ? 397 ILE C C 1 +ATOM 14627 O O . ILE C 1 397 ? -33.251 -13.931 84.915 1.00 31.27 ? 397 ILE C O 1 +ATOM 14628 C CB . ILE C 1 397 ? -34.676 -15.537 82.691 1.00 31.44 ? 397 ILE C CB 1 +ATOM 14629 C CG1 . ILE C 1 397 ? -35.613 -16.671 82.277 1.00 30.52 ? 397 ILE C CG1 1 +ATOM 14630 C CG2 . ILE C 1 397 ? -33.845 -15.089 81.494 1.00 30.70 ? 397 ILE C CG2 1 +ATOM 14631 C CD1 . ILE C 1 397 ? -36.628 -16.275 81.221 1.00 27.54 ? 397 ILE C CD1 1 +ATOM 14632 N N . LEU C 1 398 ? -31.565 -14.983 83.857 1.00 31.52 ? 398 LEU C N 1 +ATOM 14633 C CA . LEU C 1 398 ? -30.543 -13.984 84.148 1.00 31.71 ? 398 LEU C CA 1 +ATOM 14634 C C . LEU C 1 398 ? -30.109 -13.429 82.794 1.00 32.03 ? 398 LEU C C 1 +ATOM 14635 O O . LEU C 1 398 ? -29.865 -14.192 81.854 1.00 33.44 ? 398 LEU C O 1 +ATOM 14636 C CB . LEU C 1 398 ? -29.336 -14.644 84.807 1.00 32.46 ? 398 LEU C CB 1 +ATOM 14637 C CG . LEU C 1 398 ? -28.540 -13.942 85.911 1.00 35.73 ? 398 LEU C CG 1 +ATOM 14638 C CD1 . LEU C 1 398 ? -27.088 -14.445 85.847 1.00 34.98 ? 398 LEU C CD1 1 +ATOM 14639 C CD2 . LEU C 1 398 ? -28.587 -12.431 85.756 1.00 34.01 ? 398 LEU C CD2 1 +ATOM 14640 N N . SER C 1 399 ? -30.016 -12.112 82.677 1.00 31.43 ? 399 SER C N 1 +ATOM 14641 C CA . SER C 1 399 ? -29.593 -11.513 81.420 1.00 30.25 ? 399 SER C CA 1 +ATOM 14642 C C . SER C 1 399 ? -28.501 -10.490 81.691 1.00 30.80 ? 399 SER C C 1 +ATOM 14643 O O . SER C 1 399 ? -28.471 -9.879 82.752 1.00 31.02 ? 399 SER C O 1 +ATOM 14644 C CB . SER C 1 399 ? -30.774 -10.830 80.731 1.00 29.24 ? 399 SER C CB 1 +ATOM 14645 O OG . SER C 1 399 ? -30.376 -10.245 79.502 1.00 29.31 ? 399 SER C OG 1 +ATOM 14646 N N . ARG C 1 400 ? -27.600 -10.304 80.737 1.00 31.46 ? 400 ARG C N 1 +ATOM 14647 C CA . ARG C 1 400 ? -26.548 -9.319 80.922 1.00 31.70 ? 400 ARG C CA 1 +ATOM 14648 C C . ARG C 1 400 ? -27.012 -7.970 80.372 1.00 31.30 ? 400 ARG C C 1 +ATOM 14649 O O . ARG C 1 400 ? -26.838 -6.942 81.013 1.00 32.58 ? 400 ARG C O 1 +ATOM 14650 C CB . ARG C 1 400 ? -25.266 -9.749 80.216 1.00 31.42 ? 400 ARG C CB 1 +ATOM 14651 C CG . ARG C 1 400 ? -24.071 -8.921 80.638 1.00 32.29 ? 400 ARG C CG 1 +ATOM 14652 C CD . ARG C 1 400 ? -22.755 -9.531 80.182 1.00 34.44 ? 400 ARG C CD 1 +ATOM 14653 N NE . ARG C 1 400 ? -22.522 -9.327 78.758 1.00 37.96 ? 400 ARG C NE 1 +ATOM 14654 C CZ . ARG C 1 400 ? -21.372 -9.589 78.143 1.00 39.66 ? 400 ARG C CZ 1 +ATOM 14655 N NH1 . ARG C 1 400 ? -20.345 -10.077 78.835 1.00 39.53 ? 400 ARG C NH1 1 +ATOM 14656 N NH2 . ARG C 1 400 ? -21.240 -9.339 76.842 1.00 38.25 ? 400 ARG C NH2 1 +ATOM 14657 N N . ALA C 1 401 ? -27.606 -7.980 79.185 1.00 29.59 ? 401 ALA C N 1 +ATOM 14658 C CA . ALA C 1 401 ? -28.081 -6.753 78.573 1.00 28.22 ? 401 ALA C CA 1 +ATOM 14659 C C . ALA C 1 401 ? -29.579 -6.571 78.799 1.00 29.01 ? 401 ALA C C 1 +ATOM 14660 O O . ALA C 1 401 ? -30.268 -7.463 79.301 1.00 27.45 ? 401 ALA C O 1 +ATOM 14661 C CB . ALA C 1 401 ? -27.767 -6.763 77.088 1.00 26.49 ? 401 ALA C CB 1 +ATOM 14662 N N . GLY C 1 402 ? -30.088 -5.403 78.432 1.00 30.41 ? 402 GLY C N 1 +ATOM 14663 C CA . GLY C 1 402 ? -31.500 -5.152 78.613 1.00 30.67 ? 402 GLY C CA 1 +ATOM 14664 C C . GLY C 1 402 ? -31.963 -3.829 78.044 1.00 31.62 ? 402 GLY C C 1 +ATOM 14665 O O . GLY C 1 402 ? -31.173 -3.018 77.560 1.00 30.98 ? 402 GLY C O 1 +ATOM 14666 N N . TYR C 1 403 ? -33.276 -3.631 78.108 1.00 32.95 ? 403 TYR C N 1 +ATOM 14667 C CA . TYR C 1 403 ? -33.932 -2.422 77.634 1.00 32.41 ? 403 TYR C CA 1 +ATOM 14668 C C . TYR C 1 403 ? -35.166 -2.270 78.514 1.00 33.24 ? 403 TYR C C 1 +ATOM 14669 O O . TYR C 1 403 ? -35.496 -3.180 79.285 1.00 32.48 ? 403 TYR C O 1 +ATOM 14670 C CB . TYR C 1 403 ? -34.342 -2.592 76.169 1.00 31.49 ? 403 TYR C CB 1 +ATOM 14671 C CG . TYR C 1 403 ? -35.055 -1.402 75.582 1.00 30.66 ? 403 TYR C CG 1 +ATOM 14672 C CD1 . TYR C 1 403 ? -34.407 -0.175 75.432 1.00 30.50 ? 403 TYR C CD1 1 +ATOM 14673 C CD2 . TYR C 1 403 ? -36.391 -1.494 75.198 1.00 31.86 ? 403 TYR C CD2 1 +ATOM 14674 C CE1 . TYR C 1 403 ? -35.075 0.933 74.919 1.00 31.78 ? 403 TYR C CE1 1 +ATOM 14675 C CE2 . TYR C 1 403 ? -37.072 -0.393 74.681 1.00 31.24 ? 403 TYR C CE2 1 +ATOM 14676 C CZ . TYR C 1 403 ? -36.414 0.816 74.544 1.00 31.92 ? 403 TYR C CZ 1 +ATOM 14677 O OH . TYR C 1 403 ? -37.081 1.911 74.031 1.00 32.09 ? 403 TYR C OH 1 +ATOM 14678 N N . ALA C 1 404 ? -35.835 -1.126 78.425 1.00 33.10 ? 404 ALA C N 1 +ATOM 14679 C CA . ALA C 1 404 ? -37.043 -0.915 79.207 1.00 34.21 ? 404 ALA C CA 1 +ATOM 14680 C C . ALA C 1 404 ? -37.978 -2.118 78.999 1.00 35.29 ? 404 ALA C C 1 +ATOM 14681 O O . ALA C 1 404 ? -38.200 -2.554 77.869 1.00 35.80 ? 404 ALA C O 1 +ATOM 14682 C CB . ALA C 1 404 ? -37.728 0.368 78.760 1.00 32.77 ? 404 ALA C CB 1 +ATOM 14683 N N . GLY C 1 405 ? -38.507 -2.659 80.091 1.00 35.80 ? 405 GLY C N 1 +ATOM 14684 C CA . GLY C 1 405 ? -39.401 -3.800 79.989 1.00 35.50 ? 405 GLY C CA 1 +ATOM 14685 C C . GLY C 1 405 ? -38.722 -5.122 80.306 1.00 36.09 ? 405 GLY C C 1 +ATOM 14686 O O . GLY C 1 405 ? -39.394 -6.134 80.548 1.00 34.99 ? 405 GLY C O 1 +ATOM 14687 N N . ILE C 1 406 ? -37.389 -5.122 80.312 1.00 35.53 ? 406 ILE C N 1 +ATOM 14688 C CA . ILE C 1 406 ? -36.634 -6.338 80.590 1.00 33.73 ? 406 ILE C CA 1 +ATOM 14689 C C . ILE C 1 406 ? -37.042 -6.917 81.943 1.00 33.74 ? 406 ILE C C 1 +ATOM 14690 O O . ILE C 1 406 ? -36.927 -8.125 82.156 1.00 33.48 ? 406 ILE C O 1 +ATOM 14691 C CB . ILE C 1 406 ? -35.086 -6.074 80.575 1.00 34.73 ? 406 ILE C CB 1 +ATOM 14692 C CG1 . ILE C 1 406 ? -34.314 -7.396 80.658 1.00 34.22 ? 406 ILE C CG1 1 +ATOM 14693 C CG2 . ILE C 1 406 ? -34.683 -5.191 81.732 1.00 32.49 ? 406 ILE C CG2 1 +ATOM 14694 C CD1 . ILE C 1 406 ? -34.438 -8.261 79.415 1.00 33.93 ? 406 ILE C CD1 1 +ATOM 14695 N N . GLN C 1 407 ? -37.531 -6.066 82.848 1.00 32.82 ? 407 GLN C N 1 +ATOM 14696 C CA . GLN C 1 407 ? -37.949 -6.533 84.171 1.00 32.96 ? 407 GLN C CA 1 +ATOM 14697 C C . GLN C 1 407 ? -39.105 -7.540 84.113 1.00 33.37 ? 407 GLN C C 1 +ATOM 14698 O O . GLN C 1 407 ? -39.340 -8.278 85.077 1.00 35.56 ? 407 GLN C O 1 +ATOM 14699 C CB . GLN C 1 407 ? -38.331 -5.360 85.088 1.00 33.22 ? 407 GLN C CB 1 +ATOM 14700 C CG . GLN C 1 407 ? -39.623 -4.638 84.724 1.00 34.29 ? 407 GLN C CG 1 +ATOM 14701 C CD . GLN C 1 407 ? -39.439 -3.578 83.651 1.00 34.62 ? 407 GLN C CD 1 +ATOM 14702 O OE1 . GLN C 1 407 ? -38.359 -3.434 83.068 1.00 35.35 ? 407 GLN C OE1 1 +ATOM 14703 N NE2 . GLN C 1 407 ? -40.504 -2.832 83.381 1.00 34.18 ? 407 GLN C NE2 1 +ATOM 14704 N N . ARG C 1 408 ? -39.824 -7.584 82.994 1.00 32.81 ? 408 ARG C N 1 +ATOM 14705 C CA . ARG C 1 408 ? -40.922 -8.549 82.846 1.00 33.15 ? 408 ARG C CA 1 +ATOM 14706 C C . ARG C 1 408 ? -40.389 -9.975 82.820 1.00 32.35 ? 408 ARG C C 1 +ATOM 14707 O O . ARG C 1 408 ? -41.079 -10.898 83.223 1.00 31.80 ? 408 ARG C O 1 +ATOM 14708 C CB . ARG C 1 408 ? -41.655 -8.411 81.504 1.00 32.86 ? 408 ARG C CB 1 +ATOM 14709 C CG . ARG C 1 408 ? -42.291 -7.104 81.141 1.00 32.21 ? 408 ARG C CG 1 +ATOM 14710 C CD . ARG C 1 408 ? -42.680 -7.197 79.677 1.00 29.37 ? 408 ARG C CD 1 +ATOM 14711 N NE . ARG C 1 408 ? -43.398 -6.024 79.211 1.00 33.98 ? 408 ARG C NE 1 +ATOM 14712 C CZ . ARG C 1 408 ? -43.887 -5.884 77.982 1.00 34.81 ? 408 ARG C CZ 1 +ATOM 14713 N NH1 . ARG C 1 408 ? -43.728 -6.849 77.085 1.00 32.97 ? 408 ARG C NH1 1 +ATOM 14714 N NH2 . ARG C 1 408 ? -44.552 -4.784 77.657 1.00 35.23 ? 408 ARG C NH2 1 +ATOM 14715 N N . TYR C 1 409 ? -39.168 -10.149 82.320 1.00 33.59 ? 409 TYR C N 1 +ATOM 14716 C CA . TYR C 1 409 ? -38.624 -11.487 82.136 1.00 33.98 ? 409 TYR C CA 1 +ATOM 14717 C C . TYR C 1 409 ? -37.340 -11.917 82.811 1.00 34.13 ? 409 TYR C C 1 +ATOM 14718 O O . TYR C 1 409 ? -37.057 -13.110 82.841 1.00 35.76 ? 409 TYR C O 1 +ATOM 14719 C CB . TYR C 1 409 ? -38.441 -11.738 80.637 1.00 33.02 ? 409 TYR C CB 1 +ATOM 14720 C CG . TYR C 1 409 ? -39.547 -11.188 79.780 1.00 34.26 ? 409 TYR C CG 1 +ATOM 14721 C CD1 . TYR C 1 409 ? -40.835 -11.720 79.841 1.00 36.18 ? 409 TYR C CD1 1 +ATOM 14722 C CD2 . TYR C 1 409 ? -39.312 -10.130 78.904 1.00 35.65 ? 409 TYR C CD2 1 +ATOM 14723 C CE1 . TYR C 1 409 ? -41.863 -11.211 79.046 1.00 36.64 ? 409 TYR C CE1 1 +ATOM 14724 C CE2 . TYR C 1 409 ? -40.337 -9.609 78.103 1.00 36.78 ? 409 TYR C CE2 1 +ATOM 14725 C CZ . TYR C 1 409 ? -41.607 -10.155 78.182 1.00 37.53 ? 409 TYR C CZ 1 +ATOM 14726 O OH . TYR C 1 409 ? -42.622 -9.634 77.414 1.00 38.95 ? 409 TYR C OH 1 +ATOM 14727 N N . ALA C 1 410 ? -36.548 -11.000 83.349 1.00 34.40 ? 410 ALA C N 1 +ATOM 14728 C CA . ALA C 1 410 ? -35.295 -11.462 83.917 1.00 34.02 ? 410 ALA C CA 1 +ATOM 14729 C C . ALA C 1 410 ? -34.600 -10.642 84.980 1.00 34.11 ? 410 ALA C C 1 +ATOM 14730 O O . ALA C 1 410 ? -34.918 -9.486 85.214 1.00 35.08 ? 410 ALA C O 1 +ATOM 14731 C CB . ALA C 1 410 ? -34.312 -11.718 82.782 1.00 34.35 ? 410 ALA C CB 1 +ATOM 14732 N N . PHE C 1 411 ? -33.649 -11.302 85.628 1.00 34.47 ? 411 PHE C N 1 +ATOM 14733 C CA . PHE C 1 411 ? -32.785 -10.710 86.632 1.00 35.00 ? 411 PHE C CA 1 +ATOM 14734 C C . PHE C 1 411 ? -31.662 -10.126 85.782 1.00 35.07 ? 411 PHE C C 1 +ATOM 14735 O O . PHE C 1 411 ? -31.424 -10.580 84.656 1.00 34.89 ? 411 PHE C O 1 +ATOM 14736 C CB . PHE C 1 411 ? -32.132 -11.787 87.511 1.00 35.60 ? 411 PHE C CB 1 +ATOM 14737 C CG . PHE C 1 411 ? -32.943 -12.209 88.692 1.00 37.94 ? 411 PHE C CG 1 +ATOM 14738 C CD1 . PHE C 1 411 ? -34.234 -12.710 88.532 1.00 39.92 ? 411 PHE C CD1 1 +ATOM 14739 C CD2 . PHE C 1 411 ? -32.393 -12.156 89.971 1.00 39.17 ? 411 PHE C CD2 1 +ATOM 14740 C CE1 . PHE C 1 411 ? -34.964 -13.156 89.630 1.00 40.29 ? 411 PHE C CE1 1 +ATOM 14741 C CE2 . PHE C 1 411 ? -33.113 -12.602 91.082 1.00 39.50 ? 411 PHE C CE2 1 +ATOM 14742 C CZ . PHE C 1 411 ? -34.401 -13.104 90.913 1.00 39.90 ? 411 PHE C CZ 1 +ATOM 14743 N N . ILE C 1 412 ? -30.960 -9.137 86.314 1.00 34.46 ? 412 ILE C N 1 +ATOM 14744 C CA . ILE C 1 412 ? -29.827 -8.579 85.595 1.00 34.18 ? 412 ILE C CA 1 +ATOM 14745 C C . ILE C 1 412 ? -28.663 -8.490 86.564 1.00 34.18 ? 412 ILE C C 1 +ATOM 14746 O O . ILE C 1 412 ? -28.835 -8.063 87.709 1.00 34.88 ? 412 ILE C O 1 +ATOM 14747 C CB . ILE C 1 412 ? -30.148 -7.171 85.017 1.00 34.56 ? 412 ILE C CB 1 +ATOM 14748 C CG1 . ILE C 1 412 ? -31.068 -7.322 83.801 1.00 34.50 ? 412 ILE C CG1 1 +ATOM 14749 C CG2 . ILE C 1 412 ? -28.871 -6.458 84.602 1.00 32.97 ? 412 ILE C CG2 1 +ATOM 14750 C CD1 . ILE C 1 412 ? -31.293 -6.054 83.057 1.00 35.82 ? 412 ILE C CD1 1 +ATOM 14751 N N . TRP C 1 413 ? -27.492 -8.936 86.130 1.00 33.50 ? 413 TRP C N 1 +ATOM 14752 C CA . TRP C 1 413 ? -26.309 -8.831 86.971 1.00 33.85 ? 413 TRP C CA 1 +ATOM 14753 C C . TRP C 1 413 ? -25.371 -7.885 86.222 1.00 33.38 ? 413 TRP C C 1 +ATOM 14754 O O . TRP C 1 413 ? -25.456 -7.761 85.002 1.00 32.97 ? 413 TRP C O 1 +ATOM 14755 C CB . TRP C 1 413 ? -25.695 -10.219 87.239 1.00 32.49 ? 413 TRP C CB 1 +ATOM 14756 C CG . TRP C 1 413 ? -24.531 -10.597 86.403 1.00 33.71 ? 413 TRP C CG 1 +ATOM 14757 C CD1 . TRP C 1 413 ? -23.208 -10.528 86.749 1.00 33.40 ? 413 TRP C CD1 1 +ATOM 14758 C CD2 . TRP C 1 413 ? -24.573 -11.125 85.075 1.00 33.49 ? 413 TRP C CD2 1 +ATOM 14759 N NE1 . TRP C 1 413 ? -22.426 -10.986 85.713 1.00 32.97 ? 413 TRP C NE1 1 +ATOM 14760 C CE2 . TRP C 1 413 ? -23.239 -11.355 84.673 1.00 33.02 ? 413 TRP C CE2 1 +ATOM 14761 C CE3 . TRP C 1 413 ? -25.612 -11.429 84.184 1.00 33.44 ? 413 TRP C CE3 1 +ATOM 14762 C CZ2 . TRP C 1 413 ? -22.914 -11.874 83.416 1.00 33.24 ? 413 TRP C CZ2 1 +ATOM 14763 C CZ3 . TRP C 1 413 ? -25.289 -11.948 82.938 1.00 34.49 ? 413 TRP C CZ3 1 +ATOM 14764 C CH2 . TRP C 1 413 ? -23.947 -12.163 82.566 1.00 32.63 ? 413 TRP C CH2 1 +ATOM 14765 N N . THR C 1 414 ? -24.485 -7.218 86.955 1.00 35.19 ? 414 THR C N 1 +ATOM 14766 C CA . THR C 1 414 ? -23.584 -6.223 86.381 1.00 33.60 ? 414 THR C CA 1 +ATOM 14767 C C . THR C 1 414 ? -22.367 -6.661 85.573 1.00 35.09 ? 414 THR C C 1 +ATOM 14768 O O . THR C 1 414 ? -21.393 -5.907 85.452 1.00 36.31 ? 414 THR C O 1 +ATOM 14769 C CB . THR C 1 414 ? -23.111 -5.260 87.475 1.00 34.44 ? 414 THR C CB 1 +ATOM 14770 O OG1 . THR C 1 414 ? -22.379 -5.990 88.468 1.00 34.28 ? 414 THR C OG1 1 +ATOM 14771 C CG2 . THR C 1 414 ? -24.306 -4.586 88.133 1.00 31.67 ? 414 THR C CG2 1 +ATOM 14772 N N . GLY C 1 415 ? -22.401 -7.866 85.023 1.00 34.49 ? 415 GLY C N 1 +ATOM 14773 C CA . GLY C 1 415 ? -21.299 -8.297 84.184 1.00 35.83 ? 415 GLY C CA 1 +ATOM 14774 C C . GLY C 1 415 ? -19.918 -8.507 84.774 1.00 37.03 ? 415 GLY C C 1 +ATOM 14775 O O . GLY C 1 415 ? -19.776 -8.825 85.953 1.00 37.81 ? 415 GLY C O 1 +ATOM 14776 N N . ASP C 1 416 ? -18.898 -8.300 83.937 1.00 37.11 ? 416 ASP C N 1 +ATOM 14777 C CA . ASP C 1 416 ? -17.496 -8.531 84.301 1.00 36.83 ? 416 ASP C CA 1 +ATOM 14778 C C . ASP C 1 416 ? -16.764 -7.509 85.161 1.00 35.64 ? 416 ASP C C 1 +ATOM 14779 O O . ASP C 1 416 ? -15.847 -6.843 84.689 1.00 36.05 ? 416 ASP C O 1 +ATOM 14780 C CB . ASP C 1 416 ? -16.681 -8.769 83.029 1.00 37.61 ? 416 ASP C CB 1 +ATOM 14781 C CG . ASP C 1 416 ? -17.279 -9.853 82.141 1.00 42.11 ? 416 ASP C CG 1 +ATOM 14782 O OD1 . ASP C 1 416 ? -18.058 -10.703 82.643 1.00 44.02 ? 416 ASP C OD1 1 +ATOM 14783 O OD2 . ASP C 1 416 ? -16.956 -9.859 80.931 1.00 44.44 ? 416 ASP C OD2 1 +ATOM 14784 N N . ASN C 1 417 ? -17.137 -7.404 86.429 1.00 34.58 ? 417 ASN C N 1 +ATOM 14785 C CA . ASN C 1 417 ? -16.478 -6.455 87.318 1.00 34.30 ? 417 ASN C CA 1 +ATOM 14786 C C . ASN C 1 417 ? -15.077 -6.916 87.746 1.00 33.55 ? 417 ASN C C 1 +ATOM 14787 O O . ASN C 1 417 ? -14.727 -8.088 87.630 1.00 31.34 ? 417 ASN C O 1 +ATOM 14788 C CB . ASN C 1 417 ? -17.357 -6.184 88.545 1.00 35.04 ? 417 ASN C CB 1 +ATOM 14789 C CG . ASN C 1 417 ? -17.575 -7.420 89.406 1.00 38.38 ? 417 ASN C CG 1 +ATOM 14790 O OD1 . ASN C 1 417 ? -17.688 -8.542 88.904 1.00 38.78 ? 417 ASN C OD1 1 +ATOM 14791 N ND2 . ASN C 1 417 ? -17.660 -7.213 90.719 1.00 39.07 ? 417 ASN C ND2 1 +ATOM 14792 N N . THR C 1 418 ? -14.279 -5.962 88.217 1.00 34.84 ? 418 THR C N 1 +ATOM 14793 C CA . THR C 1 418 ? -12.910 -6.208 88.664 1.00 35.29 ? 418 THR C CA 1 +ATOM 14794 C C . THR C 1 418 ? -12.813 -6.092 90.176 1.00 35.64 ? 418 THR C C 1 +ATOM 14795 O O . THR C 1 418 ? -13.233 -5.094 90.750 1.00 37.13 ? 418 THR C O 1 +ATOM 14796 C CB . THR C 1 418 ? -11.929 -5.180 88.063 1.00 34.09 ? 418 THR C CB 1 +ATOM 14797 O OG1 . THR C 1 418 ? -11.887 -5.329 86.639 1.00 34.66 ? 418 THR C OG1 1 +ATOM 14798 C CG2 . THR C 1 418 ? -10.537 -5.378 88.627 1.00 33.08 ? 418 THR C CG2 1 +ATOM 14799 N N . PRO C 1 419 ? -12.247 -7.111 90.839 1.00 35.91 ? 419 PRO C N 1 +ATOM 14800 C CA . PRO C 1 419 ? -12.106 -7.086 92.304 1.00 34.58 ? 419 PRO C CA 1 +ATOM 14801 C C . PRO C 1 419 ? -11.194 -5.943 92.746 1.00 33.22 ? 419 PRO C C 1 +ATOM 14802 O O . PRO C 1 419 ? -10.051 -5.858 92.311 1.00 33.13 ? 419 PRO C O 1 +ATOM 14803 C CB . PRO C 1 419 ? -11.476 -8.449 92.628 1.00 34.29 ? 419 PRO C CB 1 +ATOM 14804 C CG . PRO C 1 419 ? -11.822 -9.309 91.441 1.00 36.24 ? 419 PRO C CG 1 +ATOM 14805 C CD . PRO C 1 419 ? -11.723 -8.367 90.271 1.00 35.11 ? 419 PRO C CD 1 +ATOM 14806 N N . SER C 1 420 ? -11.707 -5.065 93.595 1.00 32.79 ? 420 SER C N 1 +ATOM 14807 C CA . SER C 1 420 ? -10.918 -3.958 94.114 1.00 35.42 ? 420 SER C CA 1 +ATOM 14808 C C . SER C 1 420 ? -11.767 -3.194 95.109 1.00 36.21 ? 420 SER C C 1 +ATOM 14809 O O . SER C 1 420 ? -12.998 -3.267 95.066 1.00 36.25 ? 420 SER C O 1 +ATOM 14810 C CB . SER C 1 420 ? -10.478 -3.013 93.001 1.00 35.01 ? 420 SER C CB 1 +ATOM 14811 O OG . SER C 1 420 ? -11.502 -2.083 92.708 1.00 35.41 ? 420 SER C OG 1 +ATOM 14812 N N . TRP C 1 421 ? -11.118 -2.471 96.015 1.00 36.11 ? 421 TRP C N 1 +ATOM 14813 C CA . TRP C 1 421 ? -11.862 -1.707 96.996 1.00 38.02 ? 421 TRP C CA 1 +ATOM 14814 C C . TRP C 1 421 ? -12.757 -0.655 96.348 1.00 39.67 ? 421 TRP C C 1 +ATOM 14815 O O . TRP C 1 421 ? -13.869 -0.414 96.815 1.00 41.93 ? 421 TRP C O 1 +ATOM 14816 C CB . TRP C 1 421 ? -10.912 -1.070 98.010 1.00 36.13 ? 421 TRP C CB 1 +ATOM 14817 C CG . TRP C 1 421 ? -10.317 -2.098 98.915 1.00 35.82 ? 421 TRP C CG 1 +ATOM 14818 C CD1 . TRP C 1 421 ? -9.129 -2.755 98.746 1.00 36.23 ? 421 TRP C CD1 1 +ATOM 14819 C CD2 . TRP C 1 421 ? -10.919 -2.654 100.087 1.00 33.47 ? 421 TRP C CD2 1 +ATOM 14820 N NE1 . TRP C 1 421 ? -8.956 -3.687 99.742 1.00 35.29 ? 421 TRP C NE1 1 +ATOM 14821 C CE2 . TRP C 1 421 ? -10.039 -3.646 100.579 1.00 34.39 ? 421 TRP C CE2 1 +ATOM 14822 C CE3 . TRP C 1 421 ? -12.117 -2.412 100.770 1.00 34.76 ? 421 TRP C CE3 1 +ATOM 14823 C CZ2 . TRP C 1 421 ? -10.316 -4.396 101.725 1.00 35.10 ? 421 TRP C CZ2 1 +ATOM 14824 C CZ3 . TRP C 1 421 ? -12.400 -3.160 101.917 1.00 35.86 ? 421 TRP C CZ3 1 +ATOM 14825 C CH2 . TRP C 1 421 ? -11.498 -4.141 102.382 1.00 37.31 ? 421 TRP C CH2 1 +ATOM 14826 N N . ASP C 1 422 ? -12.288 -0.041 95.268 1.00 40.96 ? 422 ASP C N 1 +ATOM 14827 C CA . ASP C 1 422 ? -13.098 0.955 94.587 1.00 42.70 ? 422 ASP C CA 1 +ATOM 14828 C C . ASP C 1 422 ? -14.327 0.307 93.936 1.00 41.47 ? 422 ASP C C 1 +ATOM 14829 O O . ASP C 1 422 ? -15.382 0.927 93.840 1.00 41.19 ? 422 ASP C O 1 +ATOM 14830 C CB . ASP C 1 422 ? -12.279 1.686 93.516 1.00 45.92 ? 422 ASP C CB 1 +ATOM 14831 C CG . ASP C 1 422 ? -11.136 2.497 94.104 1.00 51.62 ? 422 ASP C CG 1 +ATOM 14832 O OD1 . ASP C 1 422 ? -11.322 3.105 95.184 1.00 53.22 ? 422 ASP C OD1 1 +ATOM 14833 O OD2 . ASP C 1 422 ? -10.050 2.540 93.477 1.00 55.69 ? 422 ASP C OD2 1 +ATOM 14834 N N . ASP C 1 423 ? -14.191 -0.938 93.493 1.00 38.96 ? 423 ASP C N 1 +ATOM 14835 C CA . ASP C 1 423 ? -15.307 -1.612 92.855 1.00 39.04 ? 423 ASP C CA 1 +ATOM 14836 C C . ASP C 1 423 ? -16.501 -1.766 93.798 1.00 37.89 ? 423 ASP C C 1 +ATOM 14837 O O . ASP C 1 423 ? -17.644 -1.855 93.347 1.00 35.20 ? 423 ASP C O 1 +ATOM 14838 C CB . ASP C 1 423 ? -14.881 -2.986 92.315 1.00 40.08 ? 423 ASP C CB 1 +ATOM 14839 C CG . ASP C 1 423 ? -15.969 -3.643 91.446 1.00 42.82 ? 423 ASP C CG 1 +ATOM 14840 O OD1 . ASP C 1 423 ? -16.446 -2.990 90.486 1.00 41.78 ? 423 ASP C OD1 1 +ATOM 14841 O OD2 . ASP C 1 423 ? -16.343 -4.812 91.714 1.00 42.34 ? 423 ASP C OD2 1 +ATOM 14842 N N . LEU C 1 424 ? -16.244 -1.797 95.103 1.00 37.39 ? 424 LEU C N 1 +ATOM 14843 C CA . LEU C 1 424 ? -17.335 -1.925 96.063 1.00 37.85 ? 424 LEU C CA 1 +ATOM 14844 C C . LEU C 1 424 ? -18.323 -0.776 95.879 1.00 37.79 ? 424 LEU C C 1 +ATOM 14845 O O . LEU C 1 424 ? -19.528 -0.985 95.845 1.00 36.57 ? 424 LEU C O 1 +ATOM 14846 C CB . LEU C 1 424 ? -16.805 -1.924 97.499 1.00 35.88 ? 424 LEU C CB 1 +ATOM 14847 C CG . LEU C 1 424 ? -15.955 -3.121 97.926 1.00 36.80 ? 424 LEU C CG 1 +ATOM 14848 C CD1 . LEU C 1 424 ? -15.569 -2.955 99.392 1.00 33.66 ? 424 LEU C CD1 1 +ATOM 14849 C CD2 . LEU C 1 424 ? -16.725 -4.424 97.707 1.00 33.50 ? 424 LEU C CD2 1 +ATOM 14850 N N . LYS C 1 425 ? -17.803 0.440 95.758 1.00 39.56 ? 425 LYS C N 1 +ATOM 14851 C CA . LYS C 1 425 ? -18.655 1.604 95.566 1.00 40.05 ? 425 LYS C CA 1 +ATOM 14852 C C . LYS C 1 425 ? -19.281 1.586 94.178 1.00 39.38 ? 425 LYS C C 1 +ATOM 14853 O O . LYS C 1 425 ? -20.449 1.939 94.014 1.00 39.97 ? 425 LYS C O 1 +ATOM 14854 C CB . LYS C 1 425 ? -17.853 2.895 95.735 1.00 43.32 ? 425 LYS C CB 1 +ATOM 14855 C CG . LYS C 1 425 ? -17.379 3.167 97.149 1.00 47.34 ? 425 LYS C CG 1 +ATOM 14856 C CD . LYS C 1 425 ? -16.872 4.599 97.273 1.00 50.63 ? 425 LYS C CD 1 +ATOM 14857 C CE . LYS C 1 425 ? -16.424 4.919 98.692 1.00 53.28 ? 425 LYS C CE 1 +ATOM 14858 N NZ . LYS C 1 425 ? -15.286 4.044 99.099 1.00 54.81 ? 425 LYS C NZ 1 +ATOM 14859 N N . LEU C 1 426 ? -18.509 1.168 93.179 1.00 36.94 ? 426 LEU C N 1 +ATOM 14860 C CA . LEU C 1 426 ? -19.016 1.116 91.811 1.00 35.80 ? 426 LEU C CA 1 +ATOM 14861 C C . LEU C 1 426 ? -20.220 0.182 91.693 1.00 34.79 ? 426 LEU C C 1 +ATOM 14862 O O . LEU C 1 426 ? -21.241 0.554 91.133 1.00 36.41 ? 426 LEU C O 1 +ATOM 14863 C CB . LEU C 1 426 ? -17.919 0.642 90.853 1.00 34.61 ? 426 LEU C CB 1 +ATOM 14864 C CG . LEU C 1 426 ? -17.862 1.237 89.440 1.00 36.21 ? 426 LEU C CG 1 +ATOM 14865 C CD1 . LEU C 1 426 ? -17.335 0.172 88.481 1.00 34.51 ? 426 LEU C CD1 1 +ATOM 14866 C CD2 . LEU C 1 426 ? -19.223 1.720 88.983 1.00 34.95 ? 426 LEU C CD2 1 +ATOM 14867 N N . GLN C 1 427 ? -20.094 -1.032 92.214 1.00 33.76 ? 427 GLN C N 1 +ATOM 14868 C CA . GLN C 1 427 ? -21.180 -1.999 92.143 1.00 35.44 ? 427 GLN C CA 1 +ATOM 14869 C C . GLN C 1 427 ? -22.463 -1.475 92.774 1.00 36.37 ? 427 GLN C C 1 +ATOM 14870 O O . GLN C 1 427 ? -23.564 -1.736 92.292 1.00 37.21 ? 427 GLN C O 1 +ATOM 14871 C CB . GLN C 1 427 ? -20.764 -3.310 92.819 1.00 34.85 ? 427 GLN C CB 1 +ATOM 14872 C CG . GLN C 1 427 ? -19.689 -4.049 92.045 1.00 33.85 ? 427 GLN C CG 1 +ATOM 14873 C CD . GLN C 1 427 ? -20.009 -4.116 90.568 1.00 33.09 ? 427 GLN C CD 1 +ATOM 14874 O OE1 . GLN C 1 427 ? -21.110 -4.519 90.186 1.00 33.46 ? 427 GLN C OE1 1 +ATOM 14875 N NE2 . GLN C 1 427 ? -19.055 -3.718 89.728 1.00 31.72 ? 427 GLN C NE2 1 +ATOM 14876 N N . LEU C 1 428 ? -22.314 -0.719 93.850 1.00 37.48 ? 428 LEU C N 1 +ATOM 14877 C CA . LEU C 1 428 ? -23.461 -0.161 94.540 1.00 36.99 ? 428 LEU C CA 1 +ATOM 14878 C C . LEU C 1 428 ? -24.186 0.859 93.648 1.00 37.10 ? 428 LEU C C 1 +ATOM 14879 O O . LEU C 1 428 ? -25.422 0.920 93.637 1.00 35.45 ? 428 LEU C O 1 +ATOM 14880 C CB . LEU C 1 428 ? -22.987 0.475 95.842 1.00 37.85 ? 428 LEU C CB 1 +ATOM 14881 C CG . LEU C 1 428 ? -23.959 0.488 97.017 1.00 39.72 ? 428 LEU C CG 1 +ATOM 14882 C CD1 . LEU C 1 428 ? -24.727 -0.814 97.092 1.00 39.34 ? 428 LEU C CD1 1 +ATOM 14883 C CD2 . LEU C 1 428 ? -23.166 0.715 98.286 1.00 39.43 ? 428 LEU C CD2 1 +ATOM 14884 N N . GLN C 1 429 ? -23.423 1.646 92.891 1.00 35.33 ? 429 GLN C N 1 +ATOM 14885 C CA . GLN C 1 429 ? -24.023 2.632 92.005 1.00 36.65 ? 429 GLN C CA 1 +ATOM 14886 C C . GLN C 1 429 ? -24.718 1.924 90.845 1.00 36.46 ? 429 GLN C C 1 +ATOM 14887 O O . GLN C 1 429 ? -25.793 2.331 90.403 1.00 37.58 ? 429 GLN C O 1 +ATOM 14888 C CB . GLN C 1 429 ? -22.964 3.575 91.439 1.00 37.27 ? 429 GLN C CB 1 +ATOM 14889 C CG . GLN C 1 429 ? -22.221 4.391 92.466 1.00 41.02 ? 429 GLN C CG 1 +ATOM 14890 C CD . GLN C 1 429 ? -21.112 5.214 91.834 1.00 43.28 ? 429 GLN C CD 1 +ATOM 14891 O OE1 . GLN C 1 429 ? -20.288 4.689 91.085 1.00 43.81 ? 429 GLN C OE1 1 +ATOM 14892 N NE2 . GLN C 1 429 ? -21.084 6.511 92.135 1.00 45.87 ? 429 GLN C NE2 1 +ATOM 14893 N N . LEU C 1 430 ? -24.091 0.866 90.350 1.00 35.05 ? 430 LEU C N 1 +ATOM 14894 C CA . LEU C 1 430 ? -24.637 0.104 89.238 1.00 33.17 ? 430 LEU C CA 1 +ATOM 14895 C C . LEU C 1 430 ? -25.968 -0.546 89.579 1.00 33.01 ? 430 LEU C C 1 +ATOM 14896 O O . LEU C 1 430 ? -26.947 -0.370 88.853 1.00 33.40 ? 430 LEU C O 1 +ATOM 14897 C CB . LEU C 1 430 ? -23.641 -0.970 88.803 1.00 33.17 ? 430 LEU C CB 1 +ATOM 14898 C CG . LEU C 1 430 ? -22.753 -0.763 87.571 1.00 33.78 ? 430 LEU C CG 1 +ATOM 14899 C CD1 . LEU C 1 430 ? -22.701 0.683 87.156 1.00 31.92 ? 430 LEU C CD1 1 +ATOM 14900 C CD2 . LEU C 1 430 ? -21.365 -1.297 87.870 1.00 32.46 ? 430 LEU C CD2 1 +ATOM 14901 N N . VAL C 1 431 ? -26.021 -1.290 90.679 1.00 32.29 ? 431 VAL C N 1 +ATOM 14902 C CA . VAL C 1 431 ? -27.264 -1.961 91.038 1.00 32.55 ? 431 VAL C CA 1 +ATOM 14903 C C . VAL C 1 431 ? -28.354 -0.980 91.452 1.00 32.48 ? 431 VAL C C 1 +ATOM 14904 O O . VAL C 1 431 ? -29.532 -1.204 91.156 1.00 32.15 ? 431 VAL C O 1 +ATOM 14905 C CB . VAL C 1 431 ? -27.051 -3.031 92.155 1.00 33.98 ? 431 VAL C CB 1 +ATOM 14906 C CG1 . VAL C 1 431 ? -26.006 -4.040 91.701 1.00 31.96 ? 431 VAL C CG1 1 +ATOM 14907 C CG2 . VAL C 1 431 ? -26.620 -2.377 93.464 1.00 34.67 ? 431 VAL C CG2 1 +ATOM 14908 N N . LEU C 1 432 ? -27.974 0.113 92.114 1.00 32.02 ? 432 LEU C N 1 +ATOM 14909 C CA . LEU C 1 432 ? -28.962 1.106 92.524 1.00 32.14 ? 432 LEU C CA 1 +ATOM 14910 C C . LEU C 1 432 ? -29.492 1.883 91.329 1.00 32.59 ? 432 LEU C C 1 +ATOM 14911 O O . LEU C 1 432 ? -30.662 2.256 91.298 1.00 30.78 ? 432 LEU C O 1 +ATOM 14912 C CB . LEU C 1 432 ? -28.387 2.075 93.558 1.00 31.12 ? 432 LEU C CB 1 +ATOM 14913 C CG . LEU C 1 432 ? -28.128 1.466 94.946 1.00 32.48 ? 432 LEU C CG 1 +ATOM 14914 C CD1 . LEU C 1 432 ? -27.699 2.554 95.926 1.00 29.06 ? 432 LEU C CD1 1 +ATOM 14915 C CD2 . LEU C 1 432 ? -29.388 0.773 95.448 1.00 31.68 ? 432 LEU C CD2 1 +ATOM 14916 N N . GLY C 1 433 ? -28.633 2.119 90.341 1.00 34.26 ? 433 GLY C N 1 +ATOM 14917 C CA . GLY C 1 433 ? -29.066 2.838 89.154 1.00 36.02 ? 433 GLY C CA 1 +ATOM 14918 C C . GLY C 1 433 ? -30.080 2.012 88.377 1.00 37.06 ? 433 GLY C C 1 +ATOM 14919 O O . GLY C 1 433 ? -31.068 2.536 87.857 1.00 37.08 ? 433 GLY C O 1 +ATOM 14920 N N . LEU C 1 434 ? -29.826 0.707 88.314 1.00 37.27 ? 434 LEU C N 1 +ATOM 14921 C CA . LEU C 1 434 ? -30.689 -0.248 87.622 1.00 37.71 ? 434 LEU C CA 1 +ATOM 14922 C C . LEU C 1 434 ? -32.024 -0.341 88.362 1.00 38.16 ? 434 LEU C C 1 +ATOM 14923 O O . LEU C 1 434 ? -33.103 -0.314 87.767 1.00 37.80 ? 434 LEU C O 1 +ATOM 14924 C CB . LEU C 1 434 ? -30.013 -1.611 87.637 1.00 37.16 ? 434 LEU C CB 1 +ATOM 14925 C CG . LEU C 1 434 ? -29.781 -2.396 86.352 1.00 38.97 ? 434 LEU C CG 1 +ATOM 14926 C CD1 . LEU C 1 434 ? -29.718 -1.484 85.155 1.00 37.98 ? 434 LEU C CD1 1 +ATOM 14927 C CD2 . LEU C 1 434 ? -28.490 -3.173 86.509 1.00 37.56 ? 434 LEU C CD2 1 +ATOM 14928 N N . SER C 1 435 ? -31.920 -0.438 89.678 1.00 38.32 ? 435 SER C N 1 +ATOM 14929 C CA . SER C 1 435 ? -33.065 -0.556 90.555 1.00 38.60 ? 435 SER C CA 1 +ATOM 14930 C C . SER C 1 435 ? -33.998 0.657 90.489 1.00 38.30 ? 435 SER C C 1 +ATOM 14931 O O . SER C 1 435 ? -35.221 0.512 90.425 1.00 38.45 ? 435 SER C O 1 +ATOM 14932 C CB . SER C 1 435 ? -32.557 -0.772 91.985 1.00 39.89 ? 435 SER C CB 1 +ATOM 14933 O OG . SER C 1 435 ? -33.620 -1.059 92.867 1.00 44.81 ? 435 SER C OG 1 +ATOM 14934 N N . ILE C 1 436 ? -33.427 1.853 90.497 1.00 37.74 ? 436 ILE C N 1 +ATOM 14935 C CA . ILE C 1 436 ? -34.232 3.063 90.444 1.00 37.74 ? 436 ILE C CA 1 +ATOM 14936 C C . ILE C 1 436 ? -34.795 3.276 89.033 1.00 38.14 ? 436 ILE C C 1 +ATOM 14937 O O . ILE C 1 436 ? -35.625 4.161 88.807 1.00 37.42 ? 436 ILE C O 1 +ATOM 14938 C CB . ILE C 1 436 ? -33.391 4.302 90.875 1.00 38.97 ? 436 ILE C CB 1 +ATOM 14939 C CG1 . ILE C 1 436 ? -34.322 5.441 91.270 1.00 39.75 ? 436 ILE C CG1 1 +ATOM 14940 C CG2 . ILE C 1 436 ? -32.463 4.750 89.755 1.00 38.85 ? 436 ILE C CG2 1 +ATOM 14941 C CD1 . ILE C 1 436 ? -35.115 5.139 92.516 1.00 43.21 ? 436 ILE C CD1 1 +ATOM 14942 N N . SER C 1 437 ? -34.347 2.451 88.090 1.00 37.38 ? 437 SER C N 1 +ATOM 14943 C CA . SER C 1 437 ? -34.793 2.550 86.704 1.00 36.47 ? 437 SER C CA 1 +ATOM 14944 C C . SER C 1 437 ? -35.786 1.465 86.279 1.00 37.19 ? 437 SER C C 1 +ATOM 14945 O O . SER C 1 437 ? -35.944 1.197 85.082 1.00 36.10 ? 437 SER C O 1 +ATOM 14946 C CB . SER C 1 437 ? -33.586 2.522 85.759 1.00 34.23 ? 437 SER C CB 1 +ATOM 14947 O OG . SER C 1 437 ? -32.761 3.654 85.944 1.00 32.41 ? 437 SER C OG 1 +ATOM 14948 N N . GLY C 1 438 ? -36.436 0.823 87.248 1.00 37.12 ? 438 GLY C N 1 +ATOM 14949 C CA . GLY C 1 438 ? -37.416 -0.198 86.911 1.00 36.76 ? 438 GLY C CA 1 +ATOM 14950 C C . GLY C 1 438 ? -36.981 -1.651 86.892 1.00 37.29 ? 438 GLY C C 1 +ATOM 14951 O O . GLY C 1 438 ? -37.807 -2.536 86.639 1.00 38.04 ? 438 GLY C O 1 +ATOM 14952 N N . VAL C 1 439 ? -35.701 -1.920 87.134 1.00 37.02 ? 439 VAL C N 1 +ATOM 14953 C CA . VAL C 1 439 ? -35.239 -3.305 87.140 1.00 37.26 ? 439 VAL C CA 1 +ATOM 14954 C C . VAL C 1 439 ? -34.893 -3.635 88.581 1.00 37.08 ? 439 VAL C C 1 +ATOM 14955 O O . VAL C 1 439 ? -33.807 -3.330 89.054 1.00 37.65 ? 439 VAL C O 1 +ATOM 14956 C CB . VAL C 1 439 ? -34.004 -3.504 86.244 1.00 37.58 ? 439 VAL C CB 1 +ATOM 14957 C CG1 . VAL C 1 439 ? -33.687 -4.981 86.140 1.00 38.36 ? 439 VAL C CG1 1 +ATOM 14958 C CG2 . VAL C 1 439 ? -34.261 -2.914 84.866 1.00 37.23 ? 439 VAL C CG2 1 +ATOM 14959 N N . PRO C 1 440 ? -35.826 -4.272 89.299 1.00 37.57 ? 440 PRO C N 1 +ATOM 14960 C CA . PRO C 1 440 ? -35.653 -4.648 90.705 1.00 36.58 ? 440 PRO C CA 1 +ATOM 14961 C C . PRO C 1 440 ? -34.729 -5.810 91.061 1.00 36.88 ? 440 PRO C C 1 +ATOM 14962 O O . PRO C 1 440 ? -34.010 -5.746 92.057 1.00 38.02 ? 440 PRO C O 1 +ATOM 14963 C CB . PRO C 1 440 ? -37.079 -4.924 91.150 1.00 36.90 ? 440 PRO C CB 1 +ATOM 14964 C CG . PRO C 1 440 ? -37.657 -5.583 89.918 1.00 36.90 ? 440 PRO C CG 1 +ATOM 14965 C CD . PRO C 1 440 ? -37.154 -4.688 88.800 1.00 36.86 ? 440 PRO C CD 1 +ATOM 14966 N N . PHE C 1 441 ? -34.745 -6.874 90.270 1.00 35.99 ? 441 PHE C N 1 +ATOM 14967 C CA . PHE C 1 441 ? -33.930 -8.029 90.594 1.00 35.13 ? 441 PHE C CA 1 +ATOM 14968 C C . PHE C 1 441 ? -32.553 -7.942 89.973 1.00 36.27 ? 441 PHE C C 1 +ATOM 14969 O O . PHE C 1 441 ? -32.332 -8.328 88.820 1.00 37.33 ? 441 PHE C O 1 +ATOM 14970 C CB . PHE C 1 441 ? -34.680 -9.290 90.179 1.00 34.91 ? 441 PHE C CB 1 +ATOM 14971 C CG . PHE C 1 441 ? -36.088 -9.330 90.702 1.00 35.02 ? 441 PHE C CG 1 +ATOM 14972 C CD1 . PHE C 1 441 ? -36.375 -8.867 91.986 1.00 34.59 ? 441 PHE C CD1 1 +ATOM 14973 C CD2 . PHE C 1 441 ? -37.129 -9.809 89.919 1.00 35.87 ? 441 PHE C CD2 1 +ATOM 14974 C CE1 . PHE C 1 441 ? -37.679 -8.879 92.476 1.00 34.08 ? 441 PHE C CE1 1 +ATOM 14975 C CE2 . PHE C 1 441 ? -38.437 -9.827 90.403 1.00 35.56 ? 441 PHE C CE2 1 +ATOM 14976 C CZ . PHE C 1 441 ? -38.710 -9.360 91.682 1.00 34.70 ? 441 PHE C CZ 1 +ATOM 14977 N N . VAL C 1 442 ? -31.618 -7.441 90.773 1.00 36.13 ? 442 VAL C N 1 +ATOM 14978 C CA . VAL C 1 442 ? -30.254 -7.228 90.326 1.00 35.70 ? 442 VAL C CA 1 +ATOM 14979 C C . VAL C 1 442 ? -29.225 -7.694 91.339 1.00 36.64 ? 442 VAL C C 1 +ATOM 14980 O O . VAL C 1 442 ? -29.550 -7.975 92.494 1.00 36.41 ? 442 VAL C O 1 +ATOM 14981 C CB . VAL C 1 442 ? -30.026 -5.730 90.061 1.00 35.60 ? 442 VAL C CB 1 +ATOM 14982 C CG1 . VAL C 1 442 ? -30.985 -5.241 88.991 1.00 35.32 ? 442 VAL C CG1 1 +ATOM 14983 C CG2 . VAL C 1 442 ? -30.268 -4.938 91.343 1.00 34.76 ? 442 VAL C CG2 1 +ATOM 14984 N N . GLY C 1 443 ? -27.977 -7.759 90.887 1.00 37.88 ? 443 GLY C N 1 +ATOM 14985 C CA . GLY C 1 443 ? -26.876 -8.169 91.738 1.00 38.04 ? 443 GLY C CA 1 +ATOM 14986 C C . GLY C 1 443 ? -25.573 -8.008 90.979 1.00 39.52 ? 443 GLY C C 1 +ATOM 14987 O O . GLY C 1 443 ? -25.564 -7.537 89.841 1.00 39.36 ? 443 GLY C O 1 +ATOM 14988 N N . CYS C 1 444 ? -24.467 -8.385 91.609 1.00 41.07 ? 444 CYS C N 1 +ATOM 14989 C CA . CYS C 1 444 ? -23.157 -8.306 90.974 1.00 42.22 ? 444 CYS C CA 1 +ATOM 14990 C C . CYS C 1 444 ? -22.401 -9.571 91.342 1.00 42.55 ? 444 CYS C C 1 +ATOM 14991 O O . CYS C 1 444 ? -22.808 -10.297 92.247 1.00 43.49 ? 444 CYS C O 1 +ATOM 14992 C CB . CYS C 1 444 ? -22.390 -7.087 91.482 1.00 44.67 ? 444 CYS C CB 1 +ATOM 14993 S SG . CYS C 1 444 ? -21.811 -7.222 93.199 1.00 49.84 ? 444 CYS C SG 1 +ATOM 14994 N N . ASP C 1 445 ? -21.308 -9.851 90.642 1.00 43.52 ? 445 ASP C N 1 +ATOM 14995 C CA . ASP C 1 445 ? -20.523 -11.044 90.954 1.00 43.15 ? 445 ASP C CA 1 +ATOM 14996 C C . ASP C 1 445 ? -19.748 -10.823 92.250 1.00 41.89 ? 445 ASP C C 1 +ATOM 14997 O O . ASP C 1 445 ? -18.841 -9.992 92.316 1.00 41.52 ? 445 ASP C O 1 +ATOM 14998 C CB . ASP C 1 445 ? -19.543 -11.385 89.820 1.00 46.10 ? 445 ASP C CB 1 +ATOM 14999 C CG . ASP C 1 445 ? -20.243 -11.898 88.557 1.00 49.90 ? 445 ASP C CG 1 +ATOM 15000 O OD1 . ASP C 1 445 ? -21.321 -12.530 88.664 1.00 51.99 ? 445 ASP C OD1 1 +ATOM 15001 O OD2 . ASP C 1 445 ? -19.702 -11.685 87.449 1.00 51.77 ? 445 ASP C OD2 1 +ATOM 15002 N N . ILE C 1 446 ? -20.122 -11.559 93.288 1.00 40.87 ? 446 ILE C N 1 +ATOM 15003 C CA . ILE C 1 446 ? -19.456 -11.441 94.575 1.00 39.86 ? 446 ILE C CA 1 +ATOM 15004 C C . ILE C 1 446 ? -18.013 -11.892 94.424 1.00 39.55 ? 446 ILE C C 1 +ATOM 15005 O O . ILE C 1 446 ? -17.743 -13.006 93.974 1.00 39.81 ? 446 ILE C O 1 +ATOM 15006 C CB . ILE C 1 446 ? -20.164 -12.295 95.628 1.00 39.73 ? 446 ILE C CB 1 +ATOM 15007 C CG1 . ILE C 1 446 ? -21.585 -11.767 95.826 1.00 38.88 ? 446 ILE C CG1 1 +ATOM 15008 C CG2 . ILE C 1 446 ? -19.385 -12.282 96.934 1.00 39.12 ? 446 ILE C CG2 1 +ATOM 15009 C CD1 . ILE C 1 446 ? -22.424 -12.640 96.726 1.00 41.44 ? 446 ILE C CD1 1 +ATOM 15010 N N . GLY C 1 447 ? -17.086 -11.016 94.789 1.00 38.69 ? 447 GLY C N 1 +ATOM 15011 C CA . GLY C 1 447 ? -15.684 -11.347 94.666 1.00 38.34 ? 447 GLY C CA 1 +ATOM 15012 C C . GLY C 1 447 ? -15.100 -10.843 93.360 1.00 39.18 ? 447 GLY C C 1 +ATOM 15013 O O . GLY C 1 447 ? -13.888 -10.913 93.148 1.00 40.83 ? 447 GLY C O 1 +ATOM 15014 N N . GLY C 1 448 ? -15.952 -10.332 92.475 1.00 38.35 ? 448 GLY C N 1 +ATOM 15015 C CA . GLY C 1 448 ? -15.463 -9.828 91.201 1.00 36.45 ? 448 GLY C CA 1 +ATOM 15016 C C . GLY C 1 448 ? -15.178 -10.927 90.187 1.00 36.52 ? 448 GLY C C 1 +ATOM 15017 O O . GLY C 1 448 ? -14.633 -11.984 90.522 1.00 36.38 ? 448 GLY C O 1 +ATOM 15018 N N . PHE C 1 449 ? -15.530 -10.666 88.931 1.00 35.09 ? 449 PHE C N 1 +ATOM 15019 C CA . PHE C 1 449 ? -15.333 -11.632 87.869 1.00 32.63 ? 449 PHE C CA 1 +ATOM 15020 C C . PHE C 1 449 ? -13.889 -11.809 87.418 1.00 32.12 ? 449 PHE C C 1 +ATOM 15021 O O . PHE C 1 449 ? -13.398 -12.932 87.329 1.00 32.41 ? 449 PHE C O 1 +ATOM 15022 C CB . PHE C 1 449 ? -16.194 -11.248 86.662 1.00 31.75 ? 449 PHE C CB 1 +ATOM 15023 C CG . PHE C 1 449 ? -15.904 -12.061 85.435 1.00 29.94 ? 449 PHE C CG 1 +ATOM 15024 C CD1 . PHE C 1 449 ? -16.337 -13.385 85.341 1.00 29.11 ? 449 PHE C CD1 1 +ATOM 15025 C CD2 . PHE C 1 449 ? -15.158 -11.517 84.387 1.00 28.18 ? 449 PHE C CD2 1 +ATOM 15026 C CE1 . PHE C 1 449 ? -16.031 -14.158 84.221 1.00 27.66 ? 449 PHE C CE1 1 +ATOM 15027 C CE2 . PHE C 1 449 ? -14.842 -12.278 83.260 1.00 28.39 ? 449 PHE C CE2 1 +ATOM 15028 C CZ . PHE C 1 449 ? -15.283 -13.603 83.179 1.00 29.90 ? 449 PHE C CZ 1 +ATOM 15029 N N . GLN C 1 450 ? -13.216 -10.707 87.111 1.00 32.78 ? 450 GLN C N 1 +ATOM 15030 C CA . GLN C 1 450 ? -11.837 -10.770 86.621 1.00 33.91 ? 450 GLN C CA 1 +ATOM 15031 C C . GLN C 1 450 ? -10.909 -11.632 87.483 1.00 34.44 ? 450 GLN C C 1 +ATOM 15032 O O . GLN C 1 450 ? -10.932 -11.553 88.715 1.00 33.56 ? 450 GLN C O 1 +ATOM 15033 C CB . GLN C 1 450 ? -11.266 -9.361 86.479 1.00 32.66 ? 450 GLN C CB 1 +ATOM 15034 C CG . GLN C 1 450 ? -12.088 -8.430 85.583 1.00 35.72 ? 450 GLN C CG 1 +ATOM 15035 C CD . GLN C 1 450 ? -12.211 -8.909 84.134 1.00 36.36 ? 450 GLN C CD 1 +ATOM 15036 O OE1 . GLN C 1 450 ? -11.323 -9.589 83.607 1.00 37.38 ? 450 GLN C OE1 1 +ATOM 15037 N NE2 . GLN C 1 450 ? -13.304 -8.529 83.480 1.00 34.38 ? 450 GLN C NE2 1 +ATOM 15038 N N . GLY C 1 451 ? -10.092 -12.448 86.817 1.00 35.55 ? 451 GLY C N 1 +ATOM 15039 C CA . GLY C 1 451 ? -9.172 -13.340 87.507 1.00 37.32 ? 451 GLY C CA 1 +ATOM 15040 C C . GLY C 1 451 ? -7.781 -12.797 87.770 1.00 37.91 ? 451 GLY C C 1 +ATOM 15041 O O . GLY C 1 451 ? -7.574 -12.117 88.771 1.00 40.30 ? 451 GLY C O 1 +ATOM 15042 N N . ARG C 1 452 ? -6.828 -13.113 86.894 1.00 38.22 ? 452 ARG C N 1 +ATOM 15043 C CA . ARG C 1 452 ? -5.449 -12.637 87.038 1.00 38.96 ? 452 ARG C CA 1 +ATOM 15044 C C . ARG C 1 452 ? -4.810 -12.374 85.687 1.00 39.81 ? 452 ARG C C 1 +ATOM 15045 O O . ARG C 1 452 ? -3.654 -12.723 85.464 1.00 41.32 ? 452 ARG C O 1 +ATOM 15046 C CB . ARG C 1 452 ? -4.594 -13.651 87.801 1.00 37.39 ? 452 ARG C CB 1 +ATOM 15047 C CG . ARG C 1 452 ? -5.030 -13.872 89.238 1.00 36.49 ? 452 ARG C CG 1 +ATOM 15048 C CD . ARG C 1 452 ? -5.317 -15.330 89.452 1.00 37.95 ? 452 ARG C CD 1 +ATOM 15049 N NE . ARG C 1 452 ? -4.284 -15.978 90.247 1.00 38.93 ? 452 ARG C NE 1 +ATOM 15050 C CZ . ARG C 1 452 ? -4.058 -17.287 90.265 1.00 37.92 ? 452 ARG C CZ 1 +ATOM 15051 N NH1 . ARG C 1 452 ? -4.783 -18.113 89.515 1.00 33.61 ? 452 ARG C NH1 1 +ATOM 15052 N NH2 . ARG C 1 452 ? -3.123 -17.769 91.072 1.00 38.76 ? 452 ARG C NH2 1 +ATOM 15053 N N . ASN C 1 453 ? -5.563 -11.758 84.785 1.00 41.81 ? 453 ASN C N 1 +ATOM 15054 C CA . ASN C 1 453 ? -5.045 -11.471 83.460 1.00 42.35 ? 453 ASN C CA 1 +ATOM 15055 C C . ASN C 1 453 ? -4.458 -10.066 83.357 1.00 42.87 ? 453 ASN C C 1 +ATOM 15056 O O . ASN C 1 453 ? -4.017 -9.646 82.288 1.00 43.65 ? 453 ASN C O 1 +ATOM 15057 C CB . ASN C 1 453 ? -6.132 -11.705 82.401 1.00 43.75 ? 453 ASN C CB 1 +ATOM 15058 C CG . ASN C 1 453 ? -7.432 -10.998 82.722 1.00 46.01 ? 453 ASN C CG 1 +ATOM 15059 O OD1 . ASN C 1 453 ? -7.996 -11.160 83.810 1.00 47.28 ? 453 ASN C OD1 1 +ATOM 15060 N ND2 . ASN C 1 453 ? -7.929 -10.215 81.767 1.00 48.53 ? 453 ASN C ND2 1 +ATOM 15061 N N . PHE C 1 454 ? -4.465 -9.333 84.468 1.00 42.48 ? 454 PHE C N 1 +ATOM 15062 C CA . PHE C 1 454 ? -3.859 -8.003 84.513 1.00 41.88 ? 454 PHE C CA 1 +ATOM 15063 C C . PHE C 1 454 ? -3.601 -7.578 85.965 1.00 41.59 ? 454 PHE C C 1 +ATOM 15064 O O . PHE C 1 454 ? -4.315 -7.981 86.887 1.00 41.49 ? 454 PHE C O 1 +ATOM 15065 C CB . PHE C 1 454 ? -4.684 -6.963 83.710 1.00 40.82 ? 454 PHE C CB 1 +ATOM 15066 C CG . PHE C 1 454 ? -6.073 -6.720 84.227 1.00 40.03 ? 454 PHE C CG 1 +ATOM 15067 C CD1 . PHE C 1 454 ? -6.308 -5.748 85.195 1.00 37.55 ? 454 PHE C CD1 1 +ATOM 15068 C CD2 . PHE C 1 454 ? -7.155 -7.442 83.715 1.00 39.36 ? 454 PHE C CD2 1 +ATOM 15069 C CE1 . PHE C 1 454 ? -7.607 -5.492 85.649 1.00 38.95 ? 454 PHE C CE1 1 +ATOM 15070 C CE2 . PHE C 1 454 ? -8.461 -7.196 84.160 1.00 39.27 ? 454 PHE C CE2 1 +ATOM 15071 C CZ . PHE C 1 454 ? -8.688 -6.219 85.128 1.00 38.88 ? 454 PHE C CZ 1 +ATOM 15072 N N . ALA C 1 455 ? -2.550 -6.785 86.148 1.00 41.45 ? 455 ALA C N 1 +ATOM 15073 C CA . ALA C 1 455 ? -2.087 -6.320 87.455 1.00 41.85 ? 455 ALA C CA 1 +ATOM 15074 C C . ALA C 1 455 ? -3.048 -5.629 88.416 1.00 43.59 ? 455 ALA C C 1 +ATOM 15075 O O . ALA C 1 455 ? -2.976 -5.849 89.628 1.00 43.88 ? 455 ALA C O 1 +ATOM 15076 C CB . ALA C 1 455 ? -0.860 -5.431 87.255 1.00 40.21 ? 455 ALA C CB 1 +ATOM 15077 N N . GLU C 1 456 ? -3.930 -4.784 87.894 1.00 45.09 ? 456 GLU C N 1 +ATOM 15078 C CA . GLU C 1 456 ? -4.854 -4.035 88.742 1.00 46.35 ? 456 GLU C CA 1 +ATOM 15079 C C . GLU C 1 456 ? -6.023 -4.835 89.309 1.00 45.71 ? 456 GLU C C 1 +ATOM 15080 O O . GLU C 1 456 ? -7.147 -4.349 89.345 1.00 48.49 ? 456 GLU C O 1 +ATOM 15081 C CB . GLU C 1 456 ? -5.390 -2.815 87.978 1.00 48.44 ? 456 GLU C CB 1 +ATOM 15082 C CG . GLU C 1 456 ? -4.314 -1.857 87.438 1.00 51.59 ? 456 GLU C CG 1 +ATOM 15083 C CD . GLU C 1 456 ? -3.408 -2.492 86.381 1.00 54.60 ? 456 GLU C CD 1 +ATOM 15084 O OE1 . GLU C 1 456 ? -3.919 -3.265 85.540 1.00 54.82 ? 456 GLU C OE1 1 +ATOM 15085 O OE2 . GLU C 1 456 ? -2.186 -2.208 86.380 1.00 56.94 ? 456 GLU C OE2 1 +ATOM 15086 N N . ILE C 1 457 ? -5.758 -6.057 89.753 1.00 44.24 ? 457 ILE C N 1 +ATOM 15087 C CA . ILE C 1 457 ? -6.795 -6.902 90.330 1.00 42.78 ? 457 ILE C CA 1 +ATOM 15088 C C . ILE C 1 457 ? -6.398 -7.233 91.766 1.00 43.60 ? 457 ILE C C 1 +ATOM 15089 O O . ILE C 1 457 ? -5.268 -7.650 92.025 1.00 43.29 ? 457 ILE C O 1 +ATOM 15090 C CB . ILE C 1 457 ? -6.957 -8.216 89.541 1.00 42.26 ? 457 ILE C CB 1 +ATOM 15091 C CG1 . ILE C 1 457 ? -7.334 -7.912 88.091 1.00 42.27 ? 457 ILE C CG1 1 +ATOM 15092 C CG2 . ILE C 1 457 ? -8.036 -9.071 90.183 1.00 41.29 ? 457 ILE C CG2 1 +ATOM 15093 C CD1 . ILE C 1 457 ? -7.527 -9.138 87.226 1.00 41.28 ? 457 ILE C CD1 1 +ATOM 15094 N N . ASP C 1 458 ? -7.328 -7.047 92.697 1.00 43.00 ? 458 ASP C N 1 +ATOM 15095 C CA . ASP C 1 458 ? -7.070 -7.304 94.105 1.00 42.34 ? 458 ASP C CA 1 +ATOM 15096 C C . ASP C 1 458 ? -7.802 -8.553 94.598 1.00 42.18 ? 458 ASP C C 1 +ATOM 15097 O O . ASP C 1 458 ? -9.014 -8.528 94.803 1.00 40.61 ? 458 ASP C O 1 +ATOM 15098 C CB . ASP C 1 458 ? -7.518 -6.101 94.932 1.00 44.47 ? 458 ASP C CB 1 +ATOM 15099 C CG . ASP C 1 458 ? -7.100 -6.202 96.383 1.00 45.04 ? 458 ASP C CG 1 +ATOM 15100 O OD1 . ASP C 1 458 ? -6.914 -7.339 96.871 1.00 46.46 ? 458 ASP C OD1 1 +ATOM 15101 O OD2 . ASP C 1 458 ? -6.972 -5.142 97.034 1.00 45.88 ? 458 ASP C OD2 1 +ATOM 15102 N N . ASN C 1 459 ? -7.063 -9.638 94.815 1.00 42.22 ? 459 ASN C N 1 +ATOM 15103 C CA . ASN C 1 459 ? -7.670 -10.881 95.278 1.00 42.76 ? 459 ASN C CA 1 +ATOM 15104 C C . ASN C 1 459 ? -7.501 -11.159 96.768 1.00 42.91 ? 459 ASN C C 1 +ATOM 15105 O O . ASN C 1 459 ? -7.550 -12.313 97.190 1.00 44.85 ? 459 ASN C O 1 +ATOM 15106 C CB . ASN C 1 459 ? -7.122 -12.067 94.482 1.00 43.73 ? 459 ASN C CB 1 +ATOM 15107 C CG . ASN C 1 459 ? -7.567 -12.047 93.037 1.00 45.66 ? 459 ASN C CG 1 +ATOM 15108 O OD1 . ASN C 1 459 ? -8.766 -12.100 92.746 1.00 46.45 ? 459 ASN C OD1 1 +ATOM 15109 N ND2 . ASN C 1 459 ? -6.604 -11.966 92.118 1.00 45.34 ? 459 ASN C ND2 1 +ATOM 15110 N N . SER C 1 460 ? -7.299 -10.119 97.569 1.00 41.26 ? 460 SER C N 1 +ATOM 15111 C CA . SER C 1 460 ? -7.155 -10.323 99.002 1.00 41.65 ? 460 SER C CA 1 +ATOM 15112 C C . SER C 1 460 ? -8.465 -10.881 99.583 1.00 41.19 ? 460 SER C C 1 +ATOM 15113 O O . SER C 1 460 ? -9.563 -10.567 99.103 1.00 40.97 ? 460 SER C O 1 +ATOM 15114 C CB . SER C 1 460 ? -6.794 -9.004 99.687 1.00 42.51 ? 460 SER C CB 1 +ATOM 15115 O OG . SER C 1 460 ? -7.844 -8.071 99.552 1.00 45.42 ? 460 SER C OG 1 +ATOM 15116 N N . MET C 1 461 ? -8.343 -11.700 100.624 1.00 40.37 ? 461 MET C N 1 +ATOM 15117 C CA . MET C 1 461 ? -9.498 -12.327 101.247 1.00 40.76 ? 461 MET C CA 1 +ATOM 15118 C C . MET C 1 461 ? -10.412 -11.416 102.055 1.00 40.40 ? 461 MET C C 1 +ATOM 15119 O O . MET C 1 461 ? -11.613 -11.660 102.134 1.00 38.78 ? 461 MET C O 1 +ATOM 15120 C CB . MET C 1 461 ? -9.037 -13.504 102.101 1.00 40.77 ? 461 MET C CB 1 +ATOM 15121 C CG . MET C 1 461 ? -8.392 -14.596 101.262 1.00 43.97 ? 461 MET C CG 1 +ATOM 15122 S SD . MET C 1 461 ? -7.691 -15.950 102.243 1.00 47.72 ? 461 MET C SD 1 +ATOM 15123 C CE . MET C 1 461 ? -6.214 -15.132 102.916 1.00 46.73 ? 461 MET C CE 1 +ATOM 15124 N N . ASP C 1 462 ? -9.864 -10.372 102.663 1.00 41.48 ? 462 ASP C N 1 +ATOM 15125 C CA . ASP C 1 462 ? -10.719 -9.474 103.424 1.00 43.72 ? 462 ASP C CA 1 +ATOM 15126 C C . ASP C 1 462 ? -11.591 -8.647 102.465 1.00 41.38 ? 462 ASP C C 1 +ATOM 15127 O O . ASP C 1 462 ? -12.693 -8.236 102.825 1.00 41.84 ? 462 ASP C O 1 +ATOM 15128 C CB . ASP C 1 462 ? -9.882 -8.580 104.354 1.00 47.27 ? 462 ASP C CB 1 +ATOM 15129 C CG . ASP C 1 462 ? -8.936 -7.670 103.604 1.00 53.07 ? 462 ASP C CG 1 +ATOM 15130 O OD1 . ASP C 1 462 ? -8.316 -8.126 102.613 1.00 57.03 ? 462 ASP C OD1 1 +ATOM 15131 O OD2 . ASP C 1 462 ? -8.799 -6.495 104.016 1.00 57.15 ? 462 ASP C OD2 1 +ATOM 15132 N N . LEU C 1 463 ? -11.109 -8.428 101.242 1.00 38.36 ? 463 LEU C N 1 +ATOM 15133 C CA . LEU C 1 463 ? -11.884 -7.693 100.244 1.00 36.32 ? 463 LEU C CA 1 +ATOM 15134 C C . LEU C 1 463 ? -13.032 -8.618 99.837 1.00 35.37 ? 463 LEU C C 1 +ATOM 15135 O O . LEU C 1 463 ? -14.177 -8.186 99.713 1.00 36.06 ? 463 LEU C O 1 +ATOM 15136 C CB . LEU C 1 463 ? -11.036 -7.376 99.004 1.00 34.63 ? 463 LEU C CB 1 +ATOM 15137 C CG . LEU C 1 463 ? -11.427 -6.199 98.094 1.00 33.83 ? 463 LEU C CG 1 +ATOM 15138 C CD1 . LEU C 1 463 ? -10.896 -6.473 96.695 1.00 31.75 ? 463 LEU C CD1 1 +ATOM 15139 C CD2 . LEU C 1 463 ? -12.941 -5.985 98.055 1.00 32.20 ? 463 LEU C CD2 1 +ATOM 15140 N N . LEU C 1 464 ? -12.711 -9.893 99.621 1.00 34.58 ? 464 LEU C N 1 +ATOM 15141 C CA . LEU C 1 464 ? -13.712 -10.880 99.247 1.00 31.69 ? 464 LEU C CA 1 +ATOM 15142 C C . LEU C 1 464 ? -14.830 -10.896 100.289 1.00 32.85 ? 464 LEU C C 1 +ATOM 15143 O O . LEU C 1 464 ? -16.019 -10.923 99.951 1.00 32.91 ? 464 LEU C O 1 +ATOM 15144 C CB . LEU C 1 464 ? -13.072 -12.261 99.150 1.00 31.59 ? 464 LEU C CB 1 +ATOM 15145 C CG . LEU C 1 464 ? -14.034 -13.433 98.904 1.00 31.33 ? 464 LEU C CG 1 +ATOM 15146 C CD1 . LEU C 1 464 ? -14.760 -13.265 97.573 1.00 29.21 ? 464 LEU C CD1 1 +ATOM 15147 C CD2 . LEU C 1 464 ? -13.243 -14.731 98.918 1.00 30.27 ? 464 LEU C CD2 1 +ATOM 15148 N N . VAL C 1 465 ? -14.450 -10.872 101.563 1.00 32.36 ? 465 VAL C N 1 +ATOM 15149 C CA . VAL C 1 465 ? -15.437 -10.875 102.629 1.00 32.21 ? 465 VAL C CA 1 +ATOM 15150 C C . VAL C 1 465 ? -16.320 -9.636 102.526 1.00 33.73 ? 465 VAL C C 1 +ATOM 15151 O O . VAL C 1 465 ? -17.529 -9.710 102.772 1.00 33.84 ? 465 VAL C O 1 +ATOM 15152 C CB . VAL C 1 465 ? -14.758 -10.924 104.013 1.00 31.68 ? 465 VAL C CB 1 +ATOM 15153 C CG1 . VAL C 1 465 ? -15.775 -10.651 105.106 1.00 29.92 ? 465 VAL C CG1 1 +ATOM 15154 C CG2 . VAL C 1 465 ? -14.130 -12.294 104.225 1.00 30.97 ? 465 VAL C CG2 1 +ATOM 15155 N N . LYS C 1 466 ? -15.723 -8.501 102.161 1.00 33.92 ? 466 LYS C N 1 +ATOM 15156 C CA . LYS C 1 466 ? -16.484 -7.264 102.031 1.00 34.80 ? 466 LYS C CA 1 +ATOM 15157 C C . LYS C 1 466 ? -17.500 -7.335 100.892 1.00 34.82 ? 466 LYS C C 1 +ATOM 15158 O O . LYS C 1 466 ? -18.534 -6.678 100.942 1.00 34.97 ? 466 LYS C O 1 +ATOM 15159 C CB . LYS C 1 466 ? -15.552 -6.077 101.810 1.00 37.13 ? 466 LYS C CB 1 +ATOM 15160 C CG . LYS C 1 466 ? -14.713 -5.720 103.019 1.00 39.96 ? 466 LYS C CG 1 +ATOM 15161 C CD . LYS C 1 466 ? -15.587 -5.469 104.234 1.00 41.81 ? 466 LYS C CD 1 +ATOM 15162 C CE . LYS C 1 466 ? -14.747 -5.039 105.422 1.00 42.91 ? 466 LYS C CE 1 +ATOM 15163 N NZ . LYS C 1 466 ? -15.593 -4.929 106.642 1.00 46.79 ? 466 LYS C NZ 1 +ATOM 15164 N N . TYR C 1 467 ? -17.201 -8.116 99.858 1.00 34.13 ? 467 TYR C N 1 +ATOM 15165 C CA . TYR C 1 467 ? -18.129 -8.275 98.742 1.00 33.36 ? 467 TYR C CA 1 +ATOM 15166 C C . TYR C 1 467 ? -19.372 -9.012 99.237 1.00 33.94 ? 467 TYR C C 1 +ATOM 15167 O O . TYR C 1 467 ? -20.502 -8.603 98.956 1.00 33.91 ? 467 TYR C O 1 +ATOM 15168 C CB . TYR C 1 467 ? -17.480 -9.073 97.616 1.00 33.68 ? 467 TYR C CB 1 +ATOM 15169 C CG . TYR C 1 467 ? -16.844 -8.223 96.546 1.00 35.42 ? 467 TYR C CG 1 +ATOM 15170 C CD1 . TYR C 1 467 ? -17.623 -7.625 95.548 1.00 34.23 ? 467 TYR C CD1 1 +ATOM 15171 C CD2 . TYR C 1 467 ? -15.461 -8.020 96.524 1.00 35.23 ? 467 TYR C CD2 1 +ATOM 15172 C CE1 . TYR C 1 467 ? -17.039 -6.848 94.553 1.00 35.64 ? 467 TYR C CE1 1 +ATOM 15173 C CE2 . TYR C 1 467 ? -14.867 -7.243 95.537 1.00 36.79 ? 467 TYR C CE2 1 +ATOM 15174 C CZ . TYR C 1 467 ? -15.658 -6.661 94.555 1.00 36.38 ? 467 TYR C CZ 1 +ATOM 15175 O OH . TYR C 1 467 ? -15.047 -5.892 93.592 1.00 37.54 ? 467 TYR C OH 1 +ATOM 15176 N N . TYR C 1 468 ? -19.154 -10.103 99.970 1.00 33.44 ? 468 TYR C N 1 +ATOM 15177 C CA . TYR C 1 468 ? -20.250 -10.892 100.517 1.00 33.37 ? 468 TYR C CA 1 +ATOM 15178 C C . TYR C 1 468 ? -21.124 -10.018 101.390 1.00 33.15 ? 468 TYR C C 1 +ATOM 15179 O O . TYR C 1 468 ? -22.356 -10.116 101.353 1.00 32.89 ? 468 TYR C O 1 +ATOM 15180 C CB . TYR C 1 468 ? -19.710 -12.065 101.342 1.00 33.71 ? 468 TYR C CB 1 +ATOM 15181 C CG . TYR C 1 468 ? -19.434 -13.306 100.525 1.00 34.51 ? 468 TYR C CG 1 +ATOM 15182 C CD1 . TYR C 1 468 ? -20.462 -14.197 100.204 1.00 33.97 ? 468 TYR C CD1 1 +ATOM 15183 C CD2 . TYR C 1 468 ? -18.152 -13.585 100.056 1.00 35.82 ? 468 TYR C CD2 1 +ATOM 15184 C CE1 . TYR C 1 468 ? -20.215 -15.341 99.437 1.00 32.71 ? 468 TYR C CE1 1 +ATOM 15185 C CE2 . TYR C 1 468 ? -17.897 -14.720 99.289 1.00 35.71 ? 468 TYR C CE2 1 +ATOM 15186 C CZ . TYR C 1 468 ? -18.933 -15.590 98.987 1.00 34.02 ? 468 TYR C CZ 1 +ATOM 15187 O OH . TYR C 1 468 ? -18.674 -16.711 98.237 1.00 36.79 ? 468 TYR C OH 1 +ATOM 15188 N N . ALA C 1 469 ? -20.480 -9.156 102.170 1.00 33.10 ? 469 ALA C N 1 +ATOM 15189 C CA . ALA C 1 469 ? -21.198 -8.257 103.066 1.00 33.66 ? 469 ALA C CA 1 +ATOM 15190 C C . ALA C 1 469 ? -21.907 -7.133 102.304 1.00 34.06 ? 469 ALA C C 1 +ATOM 15191 O O . ALA C 1 469 ? -23.006 -6.718 102.682 1.00 34.85 ? 469 ALA C O 1 +ATOM 15192 C CB . ALA C 1 469 ? -20.242 -7.673 104.081 1.00 30.85 ? 469 ALA C CB 1 +ATOM 15193 N N . LEU C 1 470 ? -21.279 -6.646 101.234 1.00 34.04 ? 470 LEU C N 1 +ATOM 15194 C CA . LEU C 1 470 ? -21.849 -5.563 100.430 1.00 33.42 ? 470 LEU C CA 1 +ATOM 15195 C C . LEU C 1 470 ? -23.187 -5.940 99.802 1.00 33.51 ? 470 LEU C C 1 +ATOM 15196 O O . LEU C 1 470 ? -24.132 -5.151 99.812 1.00 32.39 ? 470 LEU C O 1 +ATOM 15197 C CB . LEU C 1 470 ? -20.888 -5.167 99.308 1.00 32.55 ? 470 LEU C CB 1 +ATOM 15198 C CG . LEU C 1 470 ? -21.478 -4.143 98.338 1.00 34.21 ? 470 LEU C CG 1 +ATOM 15199 C CD1 . LEU C 1 470 ? -21.471 -2.785 99.008 1.00 35.43 ? 470 LEU C CD1 1 +ATOM 15200 C CD2 . LEU C 1 470 ? -20.690 -4.094 97.050 1.00 33.85 ? 470 LEU C CD2 1 +ATOM 15201 N N . ALA C 1 471 ? -23.244 -7.152 99.255 1.00 33.87 ? 471 ALA C N 1 +ATOM 15202 C CA . ALA C 1 471 ? -24.435 -7.657 98.592 1.00 34.31 ? 471 ALA C CA 1 +ATOM 15203 C C . ALA C 1 471 ? -25.370 -8.409 99.524 1.00 34.92 ? 471 ALA C C 1 +ATOM 15204 O O . ALA C 1 471 ? -26.273 -9.104 99.060 1.00 36.06 ? 471 ALA C O 1 +ATOM 15205 C CB . ALA C 1 471 ? -24.031 -8.560 97.441 1.00 33.34 ? 471 ALA C CB 1 +ATOM 15206 N N . LEU C 1 472 ? -25.159 -8.271 100.830 1.00 35.05 ? 472 LEU C N 1 +ATOM 15207 C CA . LEU C 1 472 ? -25.994 -8.950 101.822 1.00 34.91 ? 472 LEU C CA 1 +ATOM 15208 C C . LEU C 1 472 ? -27.485 -8.899 101.501 1.00 35.45 ? 472 LEU C C 1 +ATOM 15209 O O . LEU C 1 472 ? -28.190 -9.894 101.634 1.00 37.17 ? 472 LEU C O 1 +ATOM 15210 C CB . LEU C 1 472 ? -25.764 -8.343 103.205 1.00 35.24 ? 472 LEU C CB 1 +ATOM 15211 C CG . LEU C 1 472 ? -26.624 -8.889 104.350 1.00 35.03 ? 472 LEU C CG 1 +ATOM 15212 C CD1 . LEU C 1 472 ? -26.431 -10.389 104.461 1.00 32.53 ? 472 LEU C CD1 1 +ATOM 15213 C CD2 . LEU C 1 472 ? -26.242 -8.204 105.654 1.00 35.68 ? 472 LEU C CD2 1 +ATOM 15214 N N . PHE C 1 473 ? -27.965 -7.740 101.072 1.00 35.88 ? 473 PHE C N 1 +ATOM 15215 C CA . PHE C 1 473 ? -29.375 -7.583 100.759 1.00 35.99 ? 473 PHE C CA 1 +ATOM 15216 C C . PHE C 1 473 ? -29.711 -7.430 99.269 1.00 36.86 ? 473 PHE C C 1 +ATOM 15217 O O . PHE C 1 473 ? -30.853 -7.127 98.923 1.00 37.41 ? 473 PHE C O 1 +ATOM 15218 C CB . PHE C 1 473 ? -29.932 -6.395 101.535 1.00 36.67 ? 473 PHE C CB 1 +ATOM 15219 C CG . PHE C 1 473 ? -29.904 -6.579 103.020 1.00 37.12 ? 473 PHE C CG 1 +ATOM 15220 C CD1 . PHE C 1 473 ? -30.781 -7.462 103.638 1.00 37.43 ? 473 PHE C CD1 1 +ATOM 15221 C CD2 . PHE C 1 473 ? -28.995 -5.879 103.803 1.00 35.56 ? 473 PHE C CD2 1 +ATOM 15222 C CE1 . PHE C 1 473 ? -30.750 -7.645 105.023 1.00 38.80 ? 473 PHE C CE1 1 +ATOM 15223 C CE2 . PHE C 1 473 ? -28.958 -6.054 105.183 1.00 35.74 ? 473 PHE C CE2 1 +ATOM 15224 C CZ . PHE C 1 473 ? -29.836 -6.939 105.796 1.00 36.86 ? 473 PHE C CZ 1 +ATOM 15225 N N . PHE C 1 474 ? -28.737 -7.620 98.387 1.00 35.63 ? 474 PHE C N 1 +ATOM 15226 C CA . PHE C 1 474 ? -29.022 -7.521 96.961 1.00 35.49 ? 474 PHE C CA 1 +ATOM 15227 C C . PHE C 1 474 ? -29.967 -8.670 96.622 1.00 36.75 ? 474 PHE C C 1 +ATOM 15228 O O . PHE C 1 474 ? -29.896 -9.742 97.233 1.00 37.56 ? 474 PHE C O 1 +ATOM 15229 C CB . PHE C 1 474 ? -27.744 -7.676 96.116 1.00 34.91 ? 474 PHE C CB 1 +ATOM 15230 C CG . PHE C 1 474 ? -26.809 -6.488 96.164 1.00 35.22 ? 474 PHE C CG 1 +ATOM 15231 C CD1 . PHE C 1 474 ? -27.081 -5.383 96.971 1.00 33.95 ? 474 PHE C CD1 1 +ATOM 15232 C CD2 . PHE C 1 474 ? -25.633 -6.494 95.412 1.00 33.85 ? 474 PHE C CD2 1 +ATOM 15233 C CE1 . PHE C 1 474 ? -26.200 -4.307 97.031 1.00 33.75 ? 474 PHE C CE1 1 +ATOM 15234 C CE2 . PHE C 1 474 ? -24.746 -5.424 95.463 1.00 34.31 ? 474 PHE C CE2 1 +ATOM 15235 C CZ . PHE C 1 474 ? -25.030 -4.324 96.278 1.00 34.18 ? 474 PHE C CZ 1 +ATOM 15236 N N . PRO C 1 475 ? -30.880 -8.463 95.659 1.00 37.72 ? 475 PRO C N 1 +ATOM 15237 C CA . PRO C 1 475 ? -31.812 -9.534 95.280 1.00 37.06 ? 475 PRO C CA 1 +ATOM 15238 C C . PRO C 1 475 ? -31.084 -10.767 94.734 1.00 37.74 ? 475 PRO C C 1 +ATOM 15239 O O . PRO C 1 475 ? -31.379 -11.900 95.124 1.00 38.56 ? 475 PRO C O 1 +ATOM 15240 C CB . PRO C 1 475 ? -32.677 -8.868 94.227 1.00 36.32 ? 475 PRO C CB 1 +ATOM 15241 C CG . PRO C 1 475 ? -32.758 -7.458 94.732 1.00 36.54 ? 475 PRO C CG 1 +ATOM 15242 C CD . PRO C 1 475 ? -31.321 -7.168 95.108 1.00 36.56 ? 475 PRO C CD 1 +ATOM 15243 N N . PHE C 1 476 ? -30.126 -10.538 93.838 1.00 36.78 ? 476 PHE C N 1 +ATOM 15244 C CA . PHE C 1 476 ? -29.358 -11.628 93.229 1.00 36.04 ? 476 PHE C CA 1 +ATOM 15245 C C . PHE C 1 476 ? -28.006 -11.737 93.941 1.00 35.73 ? 476 PHE C C 1 +ATOM 15246 O O . PHE C 1 476 ? -27.202 -10.806 93.907 1.00 36.30 ? 476 PHE C O 1 +ATOM 15247 C CB . PHE C 1 476 ? -29.176 -11.351 91.734 1.00 34.74 ? 476 PHE C CB 1 +ATOM 15248 C CG . PHE C 1 476 ? -28.561 -12.483 90.981 1.00 34.68 ? 476 PHE C CG 1 +ATOM 15249 C CD1 . PHE C 1 476 ? -29.159 -13.738 90.983 1.00 32.91 ? 476 PHE C CD1 1 +ATOM 15250 C CD2 . PHE C 1 476 ? -27.367 -12.303 90.283 1.00 33.51 ? 476 PHE C CD2 1 +ATOM 15251 C CE1 . PHE C 1 476 ? -28.579 -14.805 90.306 1.00 33.82 ? 476 PHE C CE1 1 +ATOM 15252 C CE2 . PHE C 1 476 ? -26.778 -13.360 89.601 1.00 34.34 ? 476 PHE C CE2 1 +ATOM 15253 C CZ . PHE C 1 476 ? -27.385 -14.618 89.613 1.00 35.14 ? 476 PHE C CZ 1 +ATOM 15254 N N . TYR C 1 477 ? -27.772 -12.887 94.576 1.00 35.77 ? 477 TYR C N 1 +ATOM 15255 C CA . TYR C 1 477 ? -26.569 -13.150 95.380 1.00 34.72 ? 477 TYR C CA 1 +ATOM 15256 C C . TYR C 1 477 ? -25.745 -14.306 94.814 1.00 35.41 ? 477 TYR C C 1 +ATOM 15257 O O . TYR C 1 477 ? -25.913 -15.460 95.225 1.00 33.69 ? 477 TYR C O 1 +ATOM 15258 C CB . TYR C 1 477 ? -27.010 -13.496 96.804 1.00 34.11 ? 477 TYR C CB 1 +ATOM 15259 C CG . TYR C 1 477 ? -25.985 -13.275 97.895 1.00 33.90 ? 477 TYR C CG 1 +ATOM 15260 C CD1 . TYR C 1 477 ? -25.683 -11.989 98.346 1.00 32.84 ? 477 TYR C CD1 1 +ATOM 15261 C CD2 . TYR C 1 477 ? -25.356 -14.355 98.506 1.00 31.73 ? 477 TYR C CD2 1 +ATOM 15262 C CE1 . TYR C 1 477 ? -24.782 -11.788 99.385 1.00 34.33 ? 477 TYR C CE1 1 +ATOM 15263 C CE2 . TYR C 1 477 ? -24.458 -14.170 99.539 1.00 34.09 ? 477 TYR C CE2 1 +ATOM 15264 C CZ . TYR C 1 477 ? -24.171 -12.884 99.979 1.00 35.22 ? 477 TYR C CZ 1 +ATOM 15265 O OH . TYR C 1 477 ? -23.273 -12.702 101.008 1.00 34.31 ? 477 TYR C OH 1 +ATOM 15266 N N . ARG C 1 478 ? -24.835 -13.992 93.897 1.00 35.79 ? 478 ARG C N 1 +ATOM 15267 C CA . ARG C 1 478 ? -24.022 -15.014 93.266 1.00 35.85 ? 478 ARG C CA 1 +ATOM 15268 C C . ARG C 1 478 ? -22.529 -14.742 93.254 1.00 37.02 ? 478 ARG C C 1 +ATOM 15269 O O . ARG C 1 478 ? -22.082 -13.614 93.037 1.00 37.61 ? 478 ARG C O 1 +ATOM 15270 C CB . ARG C 1 478 ? -24.483 -15.216 91.821 1.00 36.99 ? 478 ARG C CB 1 +ATOM 15271 C CG . ARG C 1 478 ? -23.674 -16.253 91.065 1.00 37.80 ? 478 ARG C CG 1 +ATOM 15272 C CD . ARG C 1 478 ? -24.069 -16.343 89.598 1.00 39.89 ? 478 ARG C CD 1 +ATOM 15273 N NE . ARG C 1 478 ? -23.646 -15.169 88.833 1.00 42.51 ? 478 ARG C NE 1 +ATOM 15274 C CZ . ARG C 1 478 ? -23.384 -15.184 87.526 1.00 42.64 ? 478 ARG C CZ 1 +ATOM 15275 N NH1 . ARG C 1 478 ? -23.501 -16.315 86.838 1.00 42.63 ? 478 ARG C NH1 1 +ATOM 15276 N NH2 . ARG C 1 478 ? -22.997 -14.072 86.907 1.00 41.45 ? 478 ARG C NH2 1 +ATOM 15277 N N . SER C 1 479 ? -21.762 -15.801 93.477 1.00 37.11 ? 479 SER C N 1 +ATOM 15278 C CA . SER C 1 479 ? -20.311 -15.729 93.453 1.00 37.83 ? 479 SER C CA 1 +ATOM 15279 C C . SER C 1 479 ? -19.908 -16.273 92.087 1.00 37.96 ? 479 SER C C 1 +ATOM 15280 O O . SER C 1 479 ? -20.266 -17.397 91.737 1.00 38.59 ? 479 SER C O 1 +ATOM 15281 C CB . SER C 1 479 ? -19.720 -16.612 94.546 1.00 38.43 ? 479 SER C CB 1 +ATOM 15282 O OG . SER C 1 479 ? -18.317 -16.707 94.387 1.00 42.95 ? 479 SER C OG 1 +ATOM 15283 N N . HIS C 1 480 ? -19.179 -15.482 91.313 1.00 37.35 ? 480 HIS C N 1 +ATOM 15284 C CA . HIS C 1 480 ? -18.761 -15.902 89.975 1.00 37.80 ? 480 HIS C CA 1 +ATOM 15285 C C . HIS C 1 480 ? -17.337 -15.417 89.750 1.00 38.28 ? 480 HIS C C 1 +ATOM 15286 O O . HIS C 1 480 ? -16.981 -14.314 90.169 1.00 40.76 ? 480 HIS C O 1 +ATOM 15287 C CB . HIS C 1 480 ? -19.715 -15.304 88.937 1.00 37.71 ? 480 HIS C CB 1 +ATOM 15288 C CG . HIS C 1 480 ? -19.461 -15.761 87.536 1.00 37.29 ? 480 HIS C CG 1 +ATOM 15289 N ND1 . HIS C 1 480 ? -19.341 -17.090 87.196 1.00 36.70 ? 480 HIS C ND1 1 +ATOM 15290 C CD2 . HIS C 1 480 ? -19.348 -15.066 86.379 1.00 37.91 ? 480 HIS C CD2 1 +ATOM 15291 C CE1 . HIS C 1 480 ? -19.165 -17.197 85.892 1.00 37.24 ? 480 HIS C CE1 1 +ATOM 15292 N NE2 . HIS C 1 480 ? -19.166 -15.982 85.372 1.00 39.07 ? 480 HIS C NE2 1 +ATOM 15293 N N . LYS C 1 481 ? -16.522 -16.234 89.093 1.00 37.19 ? 481 LYS C N 1 +ATOM 15294 C CA . LYS C 1 481 ? -15.128 -15.885 88.876 1.00 35.10 ? 481 LYS C CA 1 +ATOM 15295 C C . LYS C 1 481 ? -14.636 -16.390 87.528 1.00 33.50 ? 481 LYS C C 1 +ATOM 15296 O O . LYS C 1 481 ? -15.099 -17.415 87.053 1.00 33.15 ? 481 LYS C O 1 +ATOM 15297 C CB . LYS C 1 481 ? -14.289 -16.485 90.016 1.00 35.80 ? 481 LYS C CB 1 +ATOM 15298 C CG . LYS C 1 481 ? -12.779 -16.333 89.875 1.00 39.08 ? 481 LYS C CG 1 +ATOM 15299 C CD . LYS C 1 481 ? -12.321 -14.870 89.936 1.00 39.80 ? 481 LYS C CD 1 +ATOM 15300 C CE . LYS C 1 481 ? -12.440 -14.282 91.334 1.00 41.14 ? 481 LYS C CE 1 +ATOM 15301 N NZ . LYS C 1 481 ? -11.884 -12.889 91.409 1.00 41.58 ? 481 LYS C NZ 1 +ATOM 15302 N N . ALA C 1 482 ? -13.700 -15.660 86.923 1.00 32.09 ? 482 ALA C N 1 +ATOM 15303 C CA . ALA C 1 482 ? -13.130 -16.027 85.627 1.00 33.48 ? 482 ALA C CA 1 +ATOM 15304 C C . ALA C 1 482 ? -12.239 -17.269 85.723 1.00 34.52 ? 482 ALA C C 1 +ATOM 15305 O O . ALA C 1 482 ? -11.796 -17.658 86.805 1.00 34.75 ? 482 ALA C O 1 +ATOM 15306 C CB . ALA C 1 482 ? -12.335 -14.860 85.054 1.00 32.40 ? 482 ALA C CB 1 +ATOM 15307 N N . THR C 1 483 ? -11.962 -17.870 84.575 1.00 35.31 ? 483 THR C N 1 +ATOM 15308 C CA . THR C 1 483 ? -11.164 -19.086 84.509 1.00 36.14 ? 483 THR C CA 1 +ATOM 15309 C C . THR C 1 483 ? -9.817 -19.075 85.219 1.00 37.24 ? 483 THR C C 1 +ATOM 15310 O O . THR C 1 483 ? -9.489 -20.031 85.916 1.00 37.01 ? 483 THR C O 1 +ATOM 15311 C CB . THR C 1 483 ? -10.916 -19.491 83.055 1.00 36.23 ? 483 THR C CB 1 +ATOM 15312 O OG1 . THR C 1 483 ? -12.066 -19.160 82.268 1.00 39.09 ? 483 THR C OG1 1 +ATOM 15313 C CG2 . THR C 1 483 ? -10.688 -20.983 82.963 1.00 34.04 ? 483 THR C CG2 1 +ATOM 15314 N N . ASP C 1 484 ? -9.035 -18.014 85.043 1.00 38.99 ? 484 ASP C N 1 +ATOM 15315 C CA . ASP C 1 484 ? -7.711 -17.946 85.661 1.00 40.63 ? 484 ASP C CA 1 +ATOM 15316 C C . ASP C 1 484 ? -7.685 -17.255 87.023 1.00 40.15 ? 484 ASP C C 1 +ATOM 15317 O O . ASP C 1 484 ? -6.620 -16.915 87.530 1.00 38.94 ? 484 ASP C O 1 +ATOM 15318 C CB . ASP C 1 484 ? -6.718 -17.263 84.706 1.00 42.51 ? 484 ASP C CB 1 +ATOM 15319 C CG . ASP C 1 484 ? -6.930 -15.752 84.601 1.00 46.79 ? 484 ASP C CG 1 +ATOM 15320 O OD1 . ASP C 1 484 ? -8.088 -15.285 84.728 1.00 47.59 ? 484 ASP C OD1 1 +ATOM 15321 O OD2 . ASP C 1 484 ? -5.926 -15.031 84.370 1.00 49.43 ? 484 ASP C OD2 1 +ATOM 15322 N N . GLY C 1 485 ? -8.855 -17.050 87.611 1.00 39.97 ? 485 GLY C N 1 +ATOM 15323 C CA . GLY C 1 485 ? -8.910 -16.415 88.909 1.00 41.69 ? 485 GLY C CA 1 +ATOM 15324 C C . GLY C 1 485 ? -8.747 -17.466 89.987 1.00 44.22 ? 485 GLY C C 1 +ATOM 15325 O O . GLY C 1 485 ? -9.017 -18.644 89.749 1.00 43.34 ? 485 GLY C O 1 +ATOM 15326 N N . ILE C 1 486 ? -8.291 -17.056 91.167 1.00 45.54 ? 486 ILE C N 1 +ATOM 15327 C CA . ILE C 1 486 ? -8.116 -17.991 92.270 1.00 47.75 ? 486 ILE C CA 1 +ATOM 15328 C C . ILE C 1 486 ? -9.482 -18.571 92.622 1.00 48.72 ? 486 ILE C C 1 +ATOM 15329 O O . ILE C 1 486 ? -10.513 -17.987 92.283 1.00 49.32 ? 486 ILE C O 1 +ATOM 15330 C CB . ILE C 1 486 ? -7.555 -17.278 93.524 1.00 49.76 ? 486 ILE C CB 1 +ATOM 15331 C CG1 . ILE C 1 486 ? -8.487 -16.124 93.915 1.00 51.15 ? 486 ILE C CG1 1 +ATOM 15332 C CG2 . ILE C 1 486 ? -6.145 -16.757 93.248 1.00 48.91 ? 486 ILE C CG2 1 +ATOM 15333 C CD1 . ILE C 1 486 ? -8.072 -15.389 95.185 1.00 53.84 ? 486 ILE C CD1 1 +ATOM 15334 N N . ASP C 1 487 ? -9.498 -19.723 93.284 1.00 49.51 ? 487 ASP C N 1 +ATOM 15335 C CA . ASP C 1 487 ? -10.760 -20.336 93.689 1.00 50.57 ? 487 ASP C CA 1 +ATOM 15336 C C . ASP C 1 487 ? -11.336 -19.459 94.794 1.00 50.35 ? 487 ASP C C 1 +ATOM 15337 O O . ASP C 1 487 ? -10.679 -19.224 95.803 1.00 50.75 ? 487 ASP C O 1 +ATOM 15338 C CB . ASP C 1 487 ? -10.526 -21.758 94.216 1.00 52.77 ? 487 ASP C CB 1 +ATOM 15339 C CG . ASP C 1 487 ? -10.199 -22.762 93.102 1.00 56.65 ? 487 ASP C CG 1 +ATOM 15340 O OD1 . ASP C 1 487 ? -11.054 -22.972 92.200 1.00 57.14 ? 487 ASP C OD1 1 +ATOM 15341 O OD2 . ASP C 1 487 ? -9.089 -23.348 93.135 1.00 56.57 ? 487 ASP C OD2 1 +ATOM 15342 N N . THR C 1 488 ? -12.557 -18.967 94.607 1.00 49.90 ? 488 THR C N 1 +ATOM 15343 C CA . THR C 1 488 ? -13.165 -18.101 95.608 1.00 48.74 ? 488 THR C CA 1 +ATOM 15344 C C . THR C 1 488 ? -14.288 -18.722 96.428 1.00 48.55 ? 488 THR C C 1 +ATOM 15345 O O . THR C 1 488 ? -14.950 -18.020 97.190 1.00 48.74 ? 488 THR C O 1 +ATOM 15346 C CB . THR C 1 488 ? -13.692 -16.793 94.976 1.00 48.56 ? 488 THR C CB 1 +ATOM 15347 O OG1 . THR C 1 488 ? -14.677 -17.095 93.974 1.00 48.57 ? 488 THR C OG1 1 +ATOM 15348 C CG2 . THR C 1 488 ? -12.545 -16.009 94.368 1.00 47.21 ? 488 THR C CG2 1 +ATOM 15349 N N . GLU C 1 489 ? -14.521 -20.022 96.276 1.00 48.22 ? 489 GLU C N 1 +ATOM 15350 C CA . GLU C 1 489 ? -15.565 -20.670 97.064 1.00 48.94 ? 489 GLU C CA 1 +ATOM 15351 C C . GLU C 1 489 ? -15.127 -20.600 98.532 1.00 48.31 ? 489 GLU C C 1 +ATOM 15352 O O . GLU C 1 489 ? -13.952 -20.799 98.854 1.00 47.39 ? 489 GLU C O 1 +ATOM 15353 C CB . GLU C 1 489 ? -15.746 -22.134 96.654 1.00 51.09 ? 489 GLU C CB 1 +ATOM 15354 C CG . GLU C 1 489 ? -16.155 -22.365 95.206 1.00 54.82 ? 489 GLU C CG 1 +ATOM 15355 C CD . GLU C 1 489 ? -15.072 -21.983 94.209 1.00 57.33 ? 489 GLU C CD 1 +ATOM 15356 O OE1 . GLU C 1 489 ? -13.886 -22.294 94.457 1.00 57.98 ? 489 GLU C OE1 1 +ATOM 15357 O OE2 . GLU C 1 489 ? -15.410 -21.379 93.167 1.00 59.35 ? 489 GLU C OE2 1 +ATOM 15358 N N . PRO C 1 490 ? -16.069 -20.320 99.441 1.00 47.81 ? 490 PRO C N 1 +ATOM 15359 C CA . PRO C 1 490 ? -15.803 -20.209 100.880 1.00 47.64 ? 490 PRO C CA 1 +ATOM 15360 C C . PRO C 1 490 ? -15.056 -21.391 101.488 1.00 47.96 ? 490 PRO C C 1 +ATOM 15361 O O . PRO C 1 490 ? -14.227 -21.214 102.386 1.00 48.23 ? 490 PRO C O 1 +ATOM 15362 C CB . PRO C 1 490 ? -17.195 -20.049 101.472 1.00 48.29 ? 490 PRO C CB 1 +ATOM 15363 C CG . PRO C 1 490 ? -17.943 -19.357 100.377 1.00 50.03 ? 490 PRO C CG 1 +ATOM 15364 C CD . PRO C 1 490 ? -17.497 -20.111 99.158 1.00 47.99 ? 490 PRO C CD 1 +ATOM 15365 N N . VAL C 1 491 ? -15.346 -22.593 101.003 1.00 47.05 ? 491 VAL C N 1 +ATOM 15366 C CA . VAL C 1 491 ? -14.700 -23.789 101.526 1.00 46.68 ? 491 VAL C CA 1 +ATOM 15367 C C . VAL C 1 491 ? -13.191 -23.808 101.334 1.00 46.66 ? 491 VAL C C 1 +ATOM 15368 O O . VAL C 1 491 ? -12.506 -24.624 101.948 1.00 47.84 ? 491 VAL C O 1 +ATOM 15369 C CB . VAL C 1 491 ? -15.282 -25.073 100.891 1.00 47.19 ? 491 VAL C CB 1 +ATOM 15370 C CG1 . VAL C 1 491 ? -16.734 -25.238 101.312 1.00 48.12 ? 491 VAL C CG1 1 +ATOM 15371 C CG2 . VAL C 1 491 ? -15.162 -25.013 99.370 1.00 45.92 ? 491 VAL C CG2 1 +ATOM 15372 N N . PHE C 1 492 ? -12.669 -22.921 100.490 1.00 45.50 ? 492 PHE C N 1 +ATOM 15373 C CA . PHE C 1 492 ? -11.229 -22.869 100.243 1.00 44.68 ? 492 PHE C CA 1 +ATOM 15374 C C . PHE C 1 492 ? -10.535 -21.761 101.028 1.00 44.13 ? 492 PHE C C 1 +ATOM 15375 O O . PHE C 1 492 ? -9.338 -21.530 100.860 1.00 45.23 ? 492 PHE C O 1 +ATOM 15376 C CB . PHE C 1 492 ? -10.947 -22.672 98.751 1.00 44.61 ? 492 PHE C CB 1 +ATOM 15377 C CG . PHE C 1 492 ? -11.442 -23.793 97.886 1.00 45.26 ? 492 PHE C CG 1 +ATOM 15378 C CD1 . PHE C 1 492 ? -10.985 -25.091 98.079 1.00 45.06 ? 492 PHE C CD1 1 +ATOM 15379 C CD2 . PHE C 1 492 ? -12.378 -23.554 96.883 1.00 45.51 ? 492 PHE C CD2 1 +ATOM 15380 C CE1 . PHE C 1 492 ? -11.455 -26.138 97.286 1.00 46.11 ? 492 PHE C CE1 1 +ATOM 15381 C CE2 . PHE C 1 492 ? -12.853 -24.594 96.085 1.00 46.29 ? 492 PHE C CE2 1 +ATOM 15382 C CZ . PHE C 1 492 ? -12.390 -25.889 96.287 1.00 45.61 ? 492 PHE C CZ 1 +ATOM 15383 N N . LEU C 1 493 ? -11.285 -21.084 101.886 1.00 43.16 ? 493 LEU C N 1 +ATOM 15384 C CA . LEU C 1 493 ? -10.742 -19.992 102.682 1.00 43.46 ? 493 LEU C CA 1 +ATOM 15385 C C . LEU C 1 493 ? -10.244 -20.452 104.055 1.00 44.20 ? 493 LEU C C 1 +ATOM 15386 O O . LEU C 1 493 ? -10.732 -21.445 104.607 1.00 43.42 ? 493 LEU C O 1 +ATOM 15387 C CB . LEU C 1 493 ? -11.817 -18.922 102.900 1.00 42.42 ? 493 LEU C CB 1 +ATOM 15388 C CG . LEU C 1 493 ? -12.308 -18.081 101.725 1.00 43.45 ? 493 LEU C CG 1 +ATOM 15389 C CD1 . LEU C 1 493 ? -13.556 -17.306 102.133 1.00 42.39 ? 493 LEU C CD1 1 +ATOM 15390 C CD2 . LEU C 1 493 ? -11.201 -17.127 101.289 1.00 43.47 ? 493 LEU C CD2 1 +ATOM 15391 N N . PRO C 1 494 ? -9.248 -19.742 104.617 1.00 44.30 ? 494 PRO C N 1 +ATOM 15392 C CA . PRO C 1 494 ? -8.745 -20.122 105.940 1.00 44.58 ? 494 PRO C CA 1 +ATOM 15393 C C . PRO C 1 494 ? -9.939 -19.984 106.887 1.00 45.14 ? 494 PRO C C 1 +ATOM 15394 O O . PRO C 1 494 ? -10.802 -19.133 106.667 1.00 45.23 ? 494 PRO C O 1 +ATOM 15395 C CB . PRO C 1 494 ? -7.673 -19.071 106.211 1.00 42.96 ? 494 PRO C CB 1 +ATOM 15396 C CG . PRO C 1 494 ? -7.141 -18.790 104.853 1.00 43.34 ? 494 PRO C CG 1 +ATOM 15397 C CD . PRO C 1 494 ? -8.395 -18.705 104.011 1.00 43.43 ? 494 PRO C CD 1 +ATOM 15398 N N . ASP C 1 495 ? -9.997 -20.812 107.924 1.00 46.60 ? 495 ASP C N 1 +ATOM 15399 C CA . ASP C 1 495 ? -11.111 -20.771 108.870 1.00 47.75 ? 495 ASP C CA 1 +ATOM 15400 C C . ASP C 1 495 ? -11.550 -19.364 109.274 1.00 46.22 ? 495 ASP C C 1 +ATOM 15401 O O . ASP C 1 495 ? -12.749 -19.087 109.344 1.00 45.90 ? 495 ASP C O 1 +ATOM 15402 C CB . ASP C 1 495 ? -10.770 -21.589 110.120 1.00 51.88 ? 495 ASP C CB 1 +ATOM 15403 C CG . ASP C 1 495 ? -10.624 -23.075 109.821 1.00 58.16 ? 495 ASP C CG 1 +ATOM 15404 O OD1 . ASP C 1 495 ? -11.573 -23.668 109.243 1.00 60.97 ? 495 ASP C OD1 1 +ATOM 15405 O OD2 . ASP C 1 495 ? -9.563 -23.653 110.164 1.00 60.77 ? 495 ASP C OD2 1 +ATOM 15406 N N . TYR C 1 496 ? -10.589 -18.479 109.529 1.00 44.49 ? 496 TYR C N 1 +ATOM 15407 C CA . TYR C 1 496 ? -10.909 -17.112 109.930 1.00 43.71 ? 496 TYR C CA 1 +ATOM 15408 C C . TYR C 1 496 ? -11.875 -16.431 108.959 1.00 43.77 ? 496 TYR C C 1 +ATOM 15409 O O . TYR C 1 496 ? -12.904 -15.893 109.372 1.00 44.56 ? 496 TYR C O 1 +ATOM 15410 C CB . TYR C 1 496 ? -9.635 -16.281 110.037 1.00 43.24 ? 496 TYR C CB 1 +ATOM 15411 C CG . TYR C 1 496 ? -9.888 -14.845 110.414 1.00 42.88 ? 496 TYR C CG 1 +ATOM 15412 C CD1 . TYR C 1 496 ? -10.187 -14.488 111.728 1.00 42.74 ? 496 TYR C CD1 1 +ATOM 15413 C CD2 . TYR C 1 496 ? -9.862 -13.841 109.446 1.00 42.65 ? 496 TYR C CD2 1 +ATOM 15414 C CE1 . TYR C 1 496 ? -10.458 -13.155 112.069 1.00 43.52 ? 496 TYR C CE1 1 +ATOM 15415 C CE2 . TYR C 1 496 ? -10.131 -12.513 109.772 1.00 44.25 ? 496 TYR C CE2 1 +ATOM 15416 C CZ . TYR C 1 496 ? -10.429 -12.176 111.084 1.00 44.40 ? 496 TYR C CZ 1 +ATOM 15417 O OH . TYR C 1 496 ? -10.702 -10.861 111.394 1.00 46.22 ? 496 TYR C OH 1 +ATOM 15418 N N . TYR C 1 497 ? -11.540 -16.459 107.673 1.00 42.87 ? 497 TYR C N 1 +ATOM 15419 C CA . TYR C 1 497 ? -12.374 -15.839 106.645 1.00 41.46 ? 497 TYR C CA 1 +ATOM 15420 C C . TYR C 1 497 ? -13.596 -16.678 106.298 1.00 41.06 ? 497 TYR C C 1 +ATOM 15421 O O . TYR C 1 497 ? -14.677 -16.142 106.051 1.00 40.46 ? 497 TYR C O 1 +ATOM 15422 C CB . TYR C 1 497 ? -11.540 -15.583 105.391 1.00 40.88 ? 497 TYR C CB 1 +ATOM 15423 C CG . TYR C 1 497 ? -10.478 -14.538 105.607 1.00 40.80 ? 497 TYR C CG 1 +ATOM 15424 C CD1 . TYR C 1 497 ? -10.825 -13.202 105.805 1.00 42.70 ? 497 TYR C CD1 1 +ATOM 15425 C CD2 . TYR C 1 497 ? -9.133 -14.885 105.658 1.00 41.80 ? 497 TYR C CD2 1 +ATOM 15426 C CE1 . TYR C 1 497 ? -9.856 -12.235 106.049 1.00 44.08 ? 497 TYR C CE1 1 +ATOM 15427 C CE2 . TYR C 1 497 ? -8.150 -13.926 105.901 1.00 43.42 ? 497 TYR C CE2 1 +ATOM 15428 C CZ . TYR C 1 497 ? -8.516 -12.605 106.096 1.00 44.15 ? 497 TYR C CZ 1 +ATOM 15429 O OH . TYR C 1 497 ? -7.551 -11.651 106.339 1.00 45.26 ? 497 TYR C OH 1 +ATOM 15430 N N . LYS C 1 498 ? -13.424 -17.993 106.291 1.00 41.39 ? 498 LYS C N 1 +ATOM 15431 C CA . LYS C 1 498 ? -14.521 -18.892 105.974 1.00 43.27 ? 498 LYS C CA 1 +ATOM 15432 C C . LYS C 1 498 ? -15.692 -18.688 106.930 1.00 43.69 ? 498 LYS C C 1 +ATOM 15433 O O . LYS C 1 498 ? -16.852 -18.677 106.505 1.00 43.09 ? 498 LYS C O 1 +ATOM 15434 C CB . LYS C 1 498 ? -14.044 -20.349 106.023 1.00 43.90 ? 498 LYS C CB 1 +ATOM 15435 C CG . LYS C 1 498 ? -15.164 -21.372 105.868 1.00 46.80 ? 498 LYS C CG 1 +ATOM 15436 C CD . LYS C 1 498 ? -14.628 -22.749 105.511 1.00 48.75 ? 498 LYS C CD 1 +ATOM 15437 C CE . LYS C 1 498 ? -13.704 -23.293 106.585 1.00 52.20 ? 498 LYS C CE 1 +ATOM 15438 N NZ . LYS C 1 498 ? -13.070 -24.579 106.164 1.00 54.58 ? 498 LYS C NZ 1 +ATOM 15439 N N . GLU C 1 499 ? -15.387 -18.519 108.216 1.00 44.23 ? 499 GLU C N 1 +ATOM 15440 C CA . GLU C 1 499 ? -16.428 -18.320 109.215 1.00 44.16 ? 499 GLU C CA 1 +ATOM 15441 C C . GLU C 1 499 ? -17.178 -17.020 108.983 1.00 42.43 ? 499 GLU C C 1 +ATOM 15442 O O . GLU C 1 499 ? -18.387 -16.953 109.198 1.00 41.13 ? 499 GLU C O 1 +ATOM 15443 C CB . GLU C 1 499 ? -15.842 -18.324 110.631 1.00 46.62 ? 499 GLU C CB 1 +ATOM 15444 C CG . GLU C 1 499 ? -16.133 -19.601 111.418 1.00 53.28 ? 499 GLU C CG 1 +ATOM 15445 C CD . GLU C 1 499 ? -17.624 -19.977 111.436 1.00 56.74 ? 499 GLU C CD 1 +ATOM 15446 O OE1 . GLU C 1 499 ? -18.461 -19.162 111.903 1.00 58.21 ? 499 GLU C OE1 1 +ATOM 15447 O OE2 . GLU C 1 499 ? -17.956 -21.097 110.978 1.00 57.82 ? 499 GLU C OE2 1 +ATOM 15448 N N . LYS C 1 500 ? -16.461 -15.986 108.550 1.00 40.69 ? 500 LYS C N 1 +ATOM 15449 C CA . LYS C 1 500 ? -17.098 -14.704 108.296 1.00 39.83 ? 500 LYS C CA 1 +ATOM 15450 C C . LYS C 1 500 ? -18.080 -14.788 107.135 1.00 38.49 ? 500 LYS C C 1 +ATOM 15451 O O . LYS C 1 500 ? -19.177 -14.234 107.210 1.00 38.20 ? 500 LYS C O 1 +ATOM 15452 C CB . LYS C 1 500 ? -16.050 -13.623 108.021 1.00 41.34 ? 500 LYS C CB 1 +ATOM 15453 C CG . LYS C 1 500 ? -15.327 -13.136 109.266 1.00 42.09 ? 500 LYS C CG 1 +ATOM 15454 C CD . LYS C 1 500 ? -14.388 -11.989 108.931 1.00 46.05 ? 500 LYS C CD 1 +ATOM 15455 C CE . LYS C 1 500 ? -13.582 -11.551 110.151 1.00 48.21 ? 500 LYS C CE 1 +ATOM 15456 N NZ . LYS C 1 500 ? -14.458 -11.120 111.282 1.00 50.05 ? 500 LYS C NZ 1 +ATOM 15457 N N . VAL C 1 501 ? -17.693 -15.479 106.066 1.00 37.41 ? 501 VAL C N 1 +ATOM 15458 C CA . VAL C 1 501 ? -18.572 -15.628 104.918 1.00 37.48 ? 501 VAL C CA 1 +ATOM 15459 C C . VAL C 1 501 ? -19.776 -16.463 105.316 1.00 37.88 ? 501 VAL C C 1 +ATOM 15460 O O . VAL C 1 501 ? -20.901 -16.176 104.920 1.00 38.21 ? 501 VAL C O 1 +ATOM 15461 C CB . VAL C 1 501 ? -17.850 -16.304 103.745 1.00 36.93 ? 501 VAL C CB 1 +ATOM 15462 C CG1 . VAL C 1 501 ? -18.825 -16.571 102.617 1.00 36.37 ? 501 VAL C CG1 1 +ATOM 15463 C CG2 . VAL C 1 501 ? -16.724 -15.405 103.255 1.00 37.66 ? 501 VAL C CG2 1 +ATOM 15464 N N . LYS C 1 502 ? -19.526 -17.489 106.119 1.00 39.12 ? 502 LYS C N 1 +ATOM 15465 C CA . LYS C 1 502 ? -20.575 -18.383 106.592 1.00 40.81 ? 502 LYS C CA 1 +ATOM 15466 C C . LYS C 1 502 ? -21.636 -17.610 107.377 1.00 41.22 ? 502 LYS C C 1 +ATOM 15467 O O . LYS C 1 502 ? -22.837 -17.794 107.168 1.00 41.60 ? 502 LYS C O 1 +ATOM 15468 C CB . LYS C 1 502 ? -19.949 -19.468 107.470 1.00 42.10 ? 502 LYS C CB 1 +ATOM 15469 C CG . LYS C 1 502 ? -20.840 -20.658 107.809 1.00 44.96 ? 502 LYS C CG 1 +ATOM 15470 C CD . LYS C 1 502 ? -20.007 -21.720 108.530 1.00 48.36 ? 502 LYS C CD 1 +ATOM 15471 C CE . LYS C 1 502 ? -20.804 -22.982 108.838 1.00 50.59 ? 502 LYS C CE 1 +ATOM 15472 N NZ . LYS C 1 502 ? -21.958 -22.721 109.747 1.00 52.19 ? 502 LYS C NZ 1 +ATOM 15473 N N . GLU C 1 503 ? -21.195 -16.730 108.269 1.00 41.37 ? 503 GLU C N 1 +ATOM 15474 C CA . GLU C 1 503 ? -22.128 -15.957 109.074 1.00 42.23 ? 503 GLU C CA 1 +ATOM 15475 C C . GLU C 1 503 ? -22.909 -14.941 108.247 1.00 40.68 ? 503 GLU C C 1 +ATOM 15476 O O . GLU C 1 503 ? -24.070 -14.655 108.546 1.00 39.02 ? 503 GLU C O 1 +ATOM 15477 C CB . GLU C 1 503 ? -21.386 -15.262 110.212 1.00 44.79 ? 503 GLU C CB 1 +ATOM 15478 C CG . GLU C 1 503 ? -20.600 -16.245 111.068 1.00 52.69 ? 503 GLU C CG 1 +ATOM 15479 C CD . GLU C 1 503 ? -19.898 -15.594 112.250 1.00 56.50 ? 503 GLU C CD 1 +ATOM 15480 O OE1 . GLU C 1 503 ? -19.370 -14.466 112.099 1.00 58.43 ? 503 GLU C OE1 1 +ATOM 15481 O OE2 . GLU C 1 503 ? -19.859 -16.229 113.327 1.00 58.78 ? 503 GLU C OE2 1 +ATOM 15482 N N . ILE C 1 504 ? -22.274 -14.400 107.209 1.00 38.01 ? 504 ILE C N 1 +ATOM 15483 C CA . ILE C 1 504 ? -22.938 -13.429 106.346 1.00 36.36 ? 504 ILE C CA 1 +ATOM 15484 C C . ILE C 1 504 ? -24.046 -14.117 105.538 1.00 36.16 ? 504 ILE C C 1 +ATOM 15485 O O . ILE C 1 504 ? -25.166 -13.603 105.426 1.00 34.84 ? 504 ILE C O 1 +ATOM 15486 C CB . ILE C 1 504 ? -21.924 -12.760 105.384 1.00 35.35 ? 504 ILE C CB 1 +ATOM 15487 C CG1 . ILE C 1 504 ? -20.983 -11.858 106.188 1.00 33.86 ? 504 ILE C CG1 1 +ATOM 15488 C CG2 . ILE C 1 504 ? -22.661 -11.970 104.304 1.00 31.54 ? 504 ILE C CG2 1 +ATOM 15489 C CD1 . ILE C 1 504 ? -19.786 -11.350 105.409 1.00 32.20 ? 504 ILE C CD1 1 +ATOM 15490 N N . VAL C 1 505 ? -23.733 -15.285 104.985 1.00 34.96 ? 505 VAL C N 1 +ATOM 15491 C CA . VAL C 1 505 ? -24.710 -16.031 104.209 1.00 35.89 ? 505 VAL C CA 1 +ATOM 15492 C C . VAL C 1 505 ? -25.875 -16.468 105.094 1.00 37.16 ? 505 VAL C C 1 +ATOM 15493 O O . VAL C 1 505 ? -27.033 -16.434 104.672 1.00 37.08 ? 505 VAL C O 1 +ATOM 15494 C CB . VAL C 1 505 ? -24.065 -17.260 103.550 1.00 34.80 ? 505 VAL C CB 1 +ATOM 15495 C CG1 . VAL C 1 505 ? -25.117 -18.090 102.836 1.00 34.70 ? 505 VAL C CG1 1 +ATOM 15496 C CG2 . VAL C 1 505 ? -22.998 -16.808 102.564 1.00 34.75 ? 505 VAL C CG2 1 +ATOM 15497 N N . GLU C 1 506 ? -25.576 -16.870 106.325 1.00 38.50 ? 506 GLU C N 1 +ATOM 15498 C CA . GLU C 1 506 ? -26.638 -17.290 107.233 1.00 39.84 ? 506 GLU C CA 1 +ATOM 15499 C C . GLU C 1 506 ? -27.529 -16.101 107.555 1.00 38.72 ? 506 GLU C C 1 +ATOM 15500 O O . GLU C 1 506 ? -28.749 -16.247 107.655 1.00 40.05 ? 506 GLU C O 1 +ATOM 15501 C CB . GLU C 1 506 ? -26.057 -17.888 108.515 1.00 41.64 ? 506 GLU C CB 1 +ATOM 15502 C CG . GLU C 1 506 ? -25.261 -19.161 108.259 1.00 46.81 ? 506 GLU C CG 1 +ATOM 15503 C CD . GLU C 1 506 ? -24.608 -19.735 109.515 1.00 51.20 ? 506 GLU C CD 1 +ATOM 15504 O OE1 . GLU C 1 506 ? -24.153 -18.947 110.381 1.00 53.65 ? 506 GLU C OE1 1 +ATOM 15505 O OE2 . GLU C 1 506 ? -24.533 -20.983 109.623 1.00 53.81 ? 506 GLU C OE2 1 +ATOM 15506 N N . LEU C 1 507 ? -26.924 -14.921 107.693 1.00 37.56 ? 507 LEU C N 1 +ATOM 15507 C CA . LEU C 1 507 ? -27.686 -13.719 107.992 1.00 36.45 ? 507 LEU C CA 1 +ATOM 15508 C C . LEU C 1 507 ? -28.594 -13.379 106.810 1.00 37.23 ? 507 LEU C C 1 +ATOM 15509 O O . LEU C 1 507 ? -29.711 -12.881 106.990 1.00 37.51 ? 507 LEU C O 1 +ATOM 15510 C CB . LEU C 1 507 ? -26.754 -12.541 108.285 1.00 35.93 ? 507 LEU C CB 1 +ATOM 15511 C CG . LEU C 1 507 ? -27.481 -11.266 108.748 1.00 37.12 ? 507 LEU C CG 1 +ATOM 15512 C CD1 . LEU C 1 507 ? -28.240 -11.534 110.055 1.00 36.00 ? 507 LEU C CD1 1 +ATOM 15513 C CD2 . LEU C 1 507 ? -26.481 -10.144 108.937 1.00 36.03 ? 507 LEU C CD2 1 +ATOM 15514 N N . ARG C 1 508 ? -28.120 -13.647 105.598 1.00 37.26 ? 508 ARG C N 1 +ATOM 15515 C CA . ARG C 1 508 ? -28.935 -13.376 104.422 1.00 37.55 ? 508 ARG C CA 1 +ATOM 15516 C C . ARG C 1 508 ? -30.172 -14.267 104.450 1.00 37.51 ? 508 ARG C C 1 +ATOM 15517 O O . ARG C 1 508 ? -31.292 -13.787 104.261 1.00 37.87 ? 508 ARG C O 1 +ATOM 15518 C CB . ARG C 1 508 ? -28.158 -13.647 103.128 1.00 38.03 ? 508 ARG C CB 1 +ATOM 15519 C CG . ARG C 1 508 ? -28.989 -13.362 101.881 1.00 38.59 ? 508 ARG C CG 1 +ATOM 15520 C CD . ARG C 1 508 ? -28.304 -13.826 100.602 1.00 37.42 ? 508 ARG C CD 1 +ATOM 15521 N NE . ARG C 1 508 ? -29.185 -13.682 99.445 1.00 35.86 ? 508 ARG C NE 1 +ATOM 15522 C CZ . ARG C 1 508 ? -29.542 -12.519 98.906 1.00 34.65 ? 508 ARG C CZ 1 +ATOM 15523 N NH1 . ARG C 1 508 ? -29.089 -11.383 99.414 1.00 31.38 ? 508 ARG C NH1 1 +ATOM 15524 N NH2 . ARG C 1 508 ? -30.364 -12.493 97.860 1.00 33.06 ? 508 ARG C NH2 1 +ATOM 15525 N N . TYR C 1 509 ? -29.970 -15.563 104.686 1.00 36.92 ? 509 TYR C N 1 +ATOM 15526 C CA . TYR C 1 509 ? -31.089 -16.495 104.739 1.00 37.11 ? 509 TYR C CA 1 +ATOM 15527 C C . TYR C 1 509 ? -32.058 -16.137 105.865 1.00 38.58 ? 509 TYR C C 1 +ATOM 15528 O O . TYR C 1 509 ? -33.264 -16.408 105.784 1.00 38.89 ? 509 TYR C O 1 +ATOM 15529 C CB . TYR C 1 509 ? -30.573 -17.926 104.893 1.00 35.69 ? 509 TYR C CB 1 +ATOM 15530 C CG . TYR C 1 509 ? -30.163 -18.555 103.572 1.00 36.01 ? 509 TYR C CG 1 +ATOM 15531 C CD1 . TYR C 1 509 ? -31.123 -18.894 102.607 1.00 35.63 ? 509 TYR C CD1 1 +ATOM 15532 C CD2 . TYR C 1 509 ? -28.819 -18.795 103.280 1.00 35.84 ? 509 TYR C CD2 1 +ATOM 15533 C CE1 . TYR C 1 509 ? -30.754 -19.456 101.386 1.00 35.00 ? 509 TYR C CE1 1 +ATOM 15534 C CE2 . TYR C 1 509 ? -28.434 -19.357 102.067 1.00 35.63 ? 509 TYR C CE2 1 +ATOM 15535 C CZ . TYR C 1 509 ? -29.407 -19.686 101.122 1.00 37.18 ? 509 TYR C CZ 1 +ATOM 15536 O OH . TYR C 1 509 ? -29.023 -20.236 99.917 1.00 35.62 ? 509 TYR C OH 1 +ATOM 15537 N N . LYS C 1 510 ? -31.537 -15.506 106.911 1.00 38.71 ? 510 LYS C N 1 +ATOM 15538 C CA . LYS C 1 510 ? -32.387 -15.108 108.017 1.00 39.69 ? 510 LYS C CA 1 +ATOM 15539 C C . LYS C 1 510 ? -33.329 -13.979 107.587 1.00 39.13 ? 510 LYS C C 1 +ATOM 15540 O O . LYS C 1 510 ? -34.450 -13.852 108.095 1.00 40.75 ? 510 LYS C O 1 +ATOM 15541 C CB . LYS C 1 510 ? -31.534 -14.657 109.196 1.00 40.65 ? 510 LYS C CB 1 +ATOM 15542 C CG . LYS C 1 510 ? -32.347 -14.162 110.375 1.00 42.45 ? 510 LYS C CG 1 +ATOM 15543 C CD . LYS C 1 510 ? -31.472 -13.973 111.603 1.00 45.05 ? 510 LYS C CD 1 +ATOM 15544 C CE . LYS C 1 510 ? -32.310 -13.592 112.812 1.00 47.36 ? 510 LYS C CE 1 +ATOM 15545 N NZ . LYS C 1 510 ? -31.498 -13.560 114.053 1.00 47.73 ? 510 LYS C NZ 1 +ATOM 15546 N N . PHE C 1 511 ? -32.874 -13.164 106.647 1.00 37.65 ? 511 PHE C N 1 +ATOM 15547 C CA . PHE C 1 511 ? -33.677 -12.053 106.147 1.00 38.82 ? 511 PHE C CA 1 +ATOM 15548 C C . PHE C 1 511 ? -34.388 -12.371 104.839 1.00 39.02 ? 511 PHE C C 1 +ATOM 15549 O O . PHE C 1 511 ? -35.129 -11.542 104.320 1.00 41.12 ? 511 PHE C O 1 +ATOM 15550 C CB . PHE C 1 511 ? -32.798 -10.816 105.943 1.00 37.67 ? 511 PHE C CB 1 +ATOM 15551 C CG . PHE C 1 511 ? -32.612 -9.999 107.179 1.00 37.83 ? 511 PHE C CG 1 +ATOM 15552 C CD1 . PHE C 1 511 ? -33.541 -9.024 107.525 1.00 36.42 ? 511 PHE C CD1 1 +ATOM 15553 C CD2 . PHE C 1 511 ? -31.514 -10.210 108.010 1.00 38.95 ? 511 PHE C CD2 1 +ATOM 15554 C CE1 . PHE C 1 511 ? -33.385 -8.269 108.676 1.00 36.40 ? 511 PHE C CE1 1 +ATOM 15555 C CE2 . PHE C 1 511 ? -31.348 -9.459 109.169 1.00 37.68 ? 511 PHE C CE2 1 +ATOM 15556 C CZ . PHE C 1 511 ? -32.288 -8.486 109.501 1.00 37.82 ? 511 PHE C CZ 1 +ATOM 15557 N N . LEU C 1 512 ? -34.172 -13.565 104.305 1.00 39.66 ? 512 LEU C N 1 +ATOM 15558 C CA . LEU C 1 512 ? -34.804 -13.936 103.048 1.00 40.56 ? 512 LEU C CA 1 +ATOM 15559 C C . LEU C 1 512 ? -36.319 -13.681 103.012 1.00 40.54 ? 512 LEU C C 1 +ATOM 15560 O O . LEU C 1 512 ? -36.837 -13.161 102.028 1.00 41.60 ? 512 LEU C O 1 +ATOM 15561 C CB . LEU C 1 512 ? -34.513 -15.398 102.720 1.00 41.99 ? 512 LEU C CB 1 +ATOM 15562 C CG . LEU C 1 512 ? -34.676 -15.740 101.233 1.00 44.07 ? 512 LEU C CG 1 +ATOM 15563 C CD1 . LEU C 1 512 ? -33.683 -14.912 100.420 1.00 43.88 ? 512 LEU C CD1 1 +ATOM 15564 C CD2 . LEU C 1 512 ? -34.434 -17.229 101.002 1.00 43.66 ? 512 LEU C CD2 1 +ATOM 15565 N N . PRO C 1 513 ? -37.051 -14.039 104.081 1.00 40.32 ? 513 PRO C N 1 +ATOM 15566 C CA . PRO C 1 513 ? -38.504 -13.807 104.083 1.00 38.63 ? 513 PRO C CA 1 +ATOM 15567 C C . PRO C 1 513 ? -38.886 -12.352 103.792 1.00 38.48 ? 513 PRO C C 1 +ATOM 15568 O O . PRO C 1 513 ? -39.858 -12.084 103.087 1.00 38.46 ? 513 PRO C O 1 +ATOM 15569 C CB . PRO C 1 513 ? -38.915 -14.247 105.485 1.00 38.47 ? 513 PRO C CB 1 +ATOM 15570 C CG . PRO C 1 513 ? -37.970 -15.393 105.746 1.00 39.10 ? 513 PRO C CG 1 +ATOM 15571 C CD . PRO C 1 513 ? -36.642 -14.836 105.255 1.00 39.10 ? 513 PRO C CD 1 +ATOM 15572 N N . TYR C 1 514 ? -38.120 -11.416 104.347 1.00 38.07 ? 514 TYR C N 1 +ATOM 15573 C CA . TYR C 1 514 ? -38.373 -9.997 104.142 1.00 36.56 ? 514 TYR C CA 1 +ATOM 15574 C C . TYR C 1 514 ? -38.036 -9.638 102.698 1.00 37.80 ? 514 TYR C C 1 +ATOM 15575 O O . TYR C 1 514 ? -38.810 -8.965 102.007 1.00 38.09 ? 514 TYR C O 1 +ATOM 15576 C CB . TYR C 1 514 ? -37.519 -9.165 105.106 1.00 35.91 ? 514 TYR C CB 1 +ATOM 15577 C CG . TYR C 1 514 ? -37.631 -7.662 104.914 1.00 32.91 ? 514 TYR C CG 1 +ATOM 15578 C CD1 . TYR C 1 514 ? -38.873 -7.028 104.903 1.00 31.84 ? 514 TYR C CD1 1 +ATOM 15579 C CD2 . TYR C 1 514 ? -36.492 -6.877 104.749 1.00 31.36 ? 514 TYR C CD2 1 +ATOM 15580 C CE1 . TYR C 1 514 ? -38.978 -5.650 104.732 1.00 30.63 ? 514 TYR C CE1 1 +ATOM 15581 C CE2 . TYR C 1 514 ? -36.584 -5.495 104.581 1.00 31.57 ? 514 TYR C CE2 1 +ATOM 15582 C CZ . TYR C 1 514 ? -37.828 -4.888 104.573 1.00 32.35 ? 514 TYR C CZ 1 +ATOM 15583 O OH . TYR C 1 514 ? -37.919 -3.517 104.421 1.00 34.42 ? 514 TYR C OH 1 +ATOM 15584 N N . ILE C 1 515 ? -36.876 -10.094 102.241 1.00 37.45 ? 515 ILE C N 1 +ATOM 15585 C CA . ILE C 1 515 ? -36.454 -9.818 100.875 1.00 37.44 ? 515 ILE C CA 1 +ATOM 15586 C C . ILE C 1 515 ? -37.485 -10.357 99.879 1.00 37.99 ? 515 ILE C C 1 +ATOM 15587 O O . ILE C 1 515 ? -37.879 -9.659 98.937 1.00 38.60 ? 515 ILE C O 1 +ATOM 15588 C CB . ILE C 1 515 ? -35.081 -10.455 100.587 1.00 37.61 ? 515 ILE C CB 1 +ATOM 15589 C CG1 . ILE C 1 515 ? -34.002 -9.754 101.417 1.00 38.64 ? 515 ILE C CG1 1 +ATOM 15590 C CG2 . ILE C 1 515 ? -34.751 -10.361 99.107 1.00 35.96 ? 515 ILE C CG2 1 +ATOM 15591 C CD1 . ILE C 1 515 ? -32.657 -10.457 101.369 1.00 38.74 ? 515 ILE C CD1 1 +ATOM 15592 N N . TYR C 1 516 ? -37.931 -11.591 100.089 1.00 37.16 ? 516 TYR C N 1 +ATOM 15593 C CA . TYR C 1 516 ? -38.904 -12.183 99.186 1.00 37.14 ? 516 TYR C CA 1 +ATOM 15594 C C . TYR C 1 516 ? -40.246 -11.446 99.215 1.00 36.72 ? 516 TYR C C 1 +ATOM 15595 O O . TYR C 1 516 ? -40.926 -11.347 98.189 1.00 35.72 ? 516 TYR C O 1 +ATOM 15596 C CB . TYR C 1 516 ? -39.116 -13.658 99.509 1.00 36.68 ? 516 TYR C CB 1 +ATOM 15597 C CG . TYR C 1 516 ? -39.760 -14.400 98.361 1.00 38.76 ? 516 TYR C CG 1 +ATOM 15598 C CD1 . TYR C 1 516 ? -39.244 -14.292 97.064 1.00 37.58 ? 516 TYR C CD1 1 +ATOM 15599 C CD2 . TYR C 1 516 ? -40.882 -15.205 98.561 1.00 38.74 ? 516 TYR C CD2 1 +ATOM 15600 C CE1 . TYR C 1 516 ? -39.830 -14.965 96.000 1.00 39.08 ? 516 TYR C CE1 1 +ATOM 15601 C CE2 . TYR C 1 516 ? -41.476 -15.884 97.503 1.00 39.44 ? 516 TYR C CE2 1 +ATOM 15602 C CZ . TYR C 1 516 ? -40.948 -15.762 96.226 1.00 40.17 ? 516 TYR C CZ 1 +ATOM 15603 O OH . TYR C 1 516 ? -41.537 -16.444 95.184 1.00 40.97 ? 516 TYR C OH 1 +ATOM 15604 N N . SER C 1 517 ? -40.626 -10.929 100.381 1.00 34.99 ? 517 SER C N 1 +ATOM 15605 C CA . SER C 1 517 ? -41.875 -10.191 100.483 1.00 35.29 ? 517 SER C CA 1 +ATOM 15606 C C . SER C 1 517 ? -41.751 -8.925 99.636 1.00 35.25 ? 517 SER C C 1 +ATOM 15607 O O . SER C 1 517 ? -42.712 -8.507 98.987 1.00 36.15 ? 517 SER C O 1 +ATOM 15608 C CB . SER C 1 517 ? -42.169 -9.829 101.936 1.00 34.90 ? 517 SER C CB 1 +ATOM 15609 O OG . SER C 1 517 ? -42.282 -10.997 102.729 1.00 35.55 ? 517 SER C OG 1 +ATOM 15610 N N . LEU C 1 518 ? -40.563 -8.323 99.641 1.00 34.07 ? 518 LEU C N 1 +ATOM 15611 C CA . LEU C 1 518 ? -40.321 -7.116 98.853 1.00 33.11 ? 518 LEU C CA 1 +ATOM 15612 C C . LEU C 1 518 ? -40.328 -7.475 97.366 1.00 33.91 ? 518 LEU C C 1 +ATOM 15613 O O . LEU C 1 518 ? -40.691 -6.657 96.517 1.00 32.51 ? 518 LEU C O 1 +ATOM 15614 C CB . LEU C 1 518 ? -38.983 -6.488 99.238 1.00 31.13 ? 518 LEU C CB 1 +ATOM 15615 C CG . LEU C 1 518 ? -38.930 -5.919 100.661 1.00 31.72 ? 518 LEU C CG 1 +ATOM 15616 C CD1 . LEU C 1 518 ? -37.492 -5.524 101.016 1.00 30.00 ? 518 LEU C CD1 1 +ATOM 15617 C CD2 . LEU C 1 518 ? -39.877 -4.730 100.772 1.00 27.46 ? 518 LEU C CD2 1 +ATOM 15618 N N . ALA C 1 519 ? -39.928 -8.706 97.055 1.00 33.86 ? 519 ALA C N 1 +ATOM 15619 C CA . ALA C 1 519 ? -39.935 -9.170 95.677 1.00 34.24 ? 519 ALA C CA 1 +ATOM 15620 C C . ALA C 1 519 ? -41.388 -9.281 95.217 1.00 34.67 ? 519 ALA C C 1 +ATOM 15621 O O . ALA C 1 519 ? -41.701 -8.942 94.078 1.00 34.66 ? 519 ALA C O 1 +ATOM 15622 C CB . ALA C 1 519 ? -39.240 -10.523 95.568 1.00 34.76 ? 519 ALA C CB 1 +ATOM 15623 N N . LEU C 1 520 ? -42.268 -9.755 96.101 1.00 35.54 ? 520 LEU C N 1 +ATOM 15624 C CA . LEU C 1 520 ? -43.686 -9.875 95.766 1.00 36.78 ? 520 LEU C CA 1 +ATOM 15625 C C . LEU C 1 520 ? -44.235 -8.477 95.520 1.00 37.61 ? 520 LEU C C 1 +ATOM 15626 O O . LEU C 1 520 ? -44.991 -8.252 94.576 1.00 40.10 ? 520 LEU C O 1 +ATOM 15627 C CB . LEU C 1 520 ? -44.470 -10.546 96.908 1.00 37.31 ? 520 LEU C CB 1 +ATOM 15628 C CG . LEU C 1 520 ? -46.006 -10.513 96.783 1.00 39.04 ? 520 LEU C CG 1 +ATOM 15629 C CD1 . LEU C 1 520 ? -46.453 -11.331 95.566 1.00 39.50 ? 520 LEU C CD1 1 +ATOM 15630 C CD2 . LEU C 1 520 ? -46.646 -11.072 98.040 1.00 39.48 ? 520 LEU C CD2 1 +ATOM 15631 N N . GLU C 1 521 ? -43.839 -7.538 96.373 1.00 37.69 ? 521 GLU C N 1 +ATOM 15632 C CA . GLU C 1 521 ? -44.273 -6.156 96.262 1.00 39.65 ? 521 GLU C CA 1 +ATOM 15633 C C . GLU C 1 521 ? -43.818 -5.590 94.914 1.00 40.08 ? 521 GLU C C 1 +ATOM 15634 O O . GLU C 1 521 ? -44.553 -4.851 94.254 1.00 41.18 ? 521 GLU C O 1 +ATOM 15635 C CB . GLU C 1 521 ? -43.675 -5.340 97.415 1.00 41.42 ? 521 GLU C CB 1 +ATOM 15636 C CG . GLU C 1 521 ? -44.149 -3.897 97.512 1.00 46.26 ? 521 GLU C CG 1 +ATOM 15637 C CD . GLU C 1 521 ? -43.364 -3.097 98.555 1.00 50.60 ? 521 GLU C CD 1 +ATOM 15638 O OE1 . GLU C 1 521 ? -43.229 -3.587 99.701 1.00 52.01 ? 521 GLU C OE1 1 +ATOM 15639 O OE2 . GLU C 1 521 ? -42.889 -1.977 98.235 1.00 51.33 ? 521 GLU C OE2 1 +ATOM 15640 N N . ALA C 1 522 ? -42.600 -5.942 94.509 1.00 39.37 ? 522 ALA C N 1 +ATOM 15641 C CA . ALA C 1 522 ? -42.051 -5.477 93.240 1.00 38.79 ? 522 ALA C CA 1 +ATOM 15642 C C . ALA C 1 522 ? -42.894 -5.983 92.069 1.00 39.06 ? 522 ALA C C 1 +ATOM 15643 O O . ALA C 1 522 ? -43.260 -5.216 91.185 1.00 37.36 ? 522 ALA C O 1 +ATOM 15644 C CB . ALA C 1 522 ? -40.596 -5.953 93.083 1.00 37.73 ? 522 ALA C CB 1 +ATOM 15645 N N . SER C 1 523 ? -43.202 -7.276 92.075 1.00 40.40 ? 523 SER C N 1 +ATOM 15646 C CA . SER C 1 523 ? -43.992 -7.874 91.009 1.00 43.90 ? 523 SER C CA 1 +ATOM 15647 C C . SER C 1 523 ? -45.446 -7.402 90.999 1.00 44.85 ? 523 SER C C 1 +ATOM 15648 O O . SER C 1 523 ? -46.130 -7.517 89.986 1.00 44.90 ? 523 SER C O 1 +ATOM 15649 C CB . SER C 1 523 ? -43.963 -9.394 91.121 1.00 43.58 ? 523 SER C CB 1 +ATOM 15650 O OG . SER C 1 523 ? -44.618 -9.813 92.303 1.00 48.39 ? 523 SER C OG 1 +ATOM 15651 N N . GLU C 1 524 ? -45.921 -6.869 92.118 1.00 46.44 ? 524 GLU C N 1 +ATOM 15652 C CA . GLU C 1 524 ? -47.300 -6.402 92.177 1.00 49.28 ? 524 GLU C CA 1 +ATOM 15653 C C . GLU C 1 524 ? -47.453 -4.901 91.956 1.00 49.13 ? 524 GLU C C 1 +ATOM 15654 O O . GLU C 1 524 ? -48.401 -4.461 91.307 1.00 49.75 ? 524 GLU C O 1 +ATOM 15655 C CB . GLU C 1 524 ? -47.936 -6.766 93.522 1.00 51.04 ? 524 GLU C CB 1 +ATOM 15656 C CG . GLU C 1 524 ? -47.977 -8.252 93.827 1.00 55.88 ? 524 GLU C CG 1 +ATOM 15657 C CD . GLU C 1 524 ? -48.768 -8.562 95.092 1.00 60.52 ? 524 GLU C CD 1 +ATOM 15658 O OE1 . GLU C 1 524 ? -48.516 -7.909 96.137 1.00 62.88 ? 524 GLU C OE1 1 +ATOM 15659 O OE2 . GLU C 1 524 ? -49.638 -9.462 95.043 1.00 61.80 ? 524 GLU C OE2 1 +ATOM 15660 N N . LYS C 1 525 ? -46.524 -4.113 92.484 1.00 48.92 ? 525 LYS C N 1 +ATOM 15661 C CA . LYS C 1 525 ? -46.625 -2.666 92.351 1.00 49.65 ? 525 LYS C CA 1 +ATOM 15662 C C . LYS C 1 525 ? -45.450 -2.012 91.629 1.00 49.11 ? 525 LYS C C 1 +ATOM 15663 O O . LYS C 1 525 ? -45.498 -0.829 91.298 1.00 48.94 ? 525 LYS C O 1 +ATOM 15664 C CB . LYS C 1 525 ? -46.800 -2.043 93.739 1.00 51.89 ? 525 LYS C CB 1 +ATOM 15665 C CG . LYS C 1 525 ? -48.013 -2.589 94.494 1.00 55.18 ? 525 LYS C CG 1 +ATOM 15666 C CD . LYS C 1 525 ? -48.117 -2.014 95.898 1.00 57.77 ? 525 LYS C CD 1 +ATOM 15667 C CE . LYS C 1 525 ? -49.366 -2.513 96.621 1.00 59.83 ? 525 LYS C CE 1 +ATOM 15668 N NZ . LYS C 1 525 ? -49.426 -4.009 96.718 1.00 62.19 ? 525 LYS C NZ 1 +ATOM 15669 N N . GLY C 1 526 ? -44.395 -2.778 91.387 1.00 47.75 ? 526 GLY C N 1 +ATOM 15670 C CA . GLY C 1 526 ? -43.247 -2.226 90.694 1.00 47.15 ? 526 GLY C CA 1 +ATOM 15671 C C . GLY C 1 526 ? -42.316 -1.412 91.572 1.00 46.42 ? 526 GLY C C 1 +ATOM 15672 O O . GLY C 1 526 ? -41.596 -0.543 91.085 1.00 47.20 ? 526 GLY C O 1 +ATOM 15673 N N . HIS C 1 527 ? -42.336 -1.675 92.870 1.00 44.58 ? 527 HIS C N 1 +ATOM 15674 C CA . HIS C 1 527 ? -41.462 -0.968 93.793 1.00 43.30 ? 527 HIS C CA 1 +ATOM 15675 C C . HIS C 1 527 ? -40.153 -1.728 93.819 1.00 42.19 ? 527 HIS C C 1 +ATOM 15676 O O . HIS C 1 527 ? -40.148 -2.952 93.905 1.00 44.01 ? 527 HIS C O 1 +ATOM 15677 C CB . HIS C 1 527 ? -42.061 -0.963 95.199 1.00 43.82 ? 527 HIS C CB 1 +ATOM 15678 C CG . HIS C 1 527 ? -43.358 -0.224 95.307 1.00 45.57 ? 527 HIS C CG 1 +ATOM 15679 N ND1 . HIS C 1 527 ? -44.162 -0.297 96.425 1.00 45.43 ? 527 HIS C ND1 1 +ATOM 15680 C CD2 . HIS C 1 527 ? -43.978 0.624 94.451 1.00 46.43 ? 527 HIS C CD2 1 +ATOM 15681 C CE1 . HIS C 1 527 ? -45.222 0.475 96.253 1.00 46.25 ? 527 HIS C CE1 1 +ATOM 15682 N NE2 . HIS C 1 527 ? -45.134 1.046 95.064 1.00 47.54 ? 527 HIS C NE2 1 +ATOM 15683 N N . PRO C 1 528 ? -39.020 -1.024 93.730 1.00 41.04 ? 528 PRO C N 1 +ATOM 15684 C CA . PRO C 1 528 ? -37.745 -1.753 93.761 1.00 40.02 ? 528 PRO C CA 1 +ATOM 15685 C C . PRO C 1 528 ? -37.442 -2.353 95.140 1.00 39.32 ? 528 PRO C C 1 +ATOM 15686 O O . PRO C 1 528 ? -37.883 -1.831 96.169 1.00 39.11 ? 528 PRO C O 1 +ATOM 15687 C CB . PRO C 1 528 ? -36.731 -0.690 93.352 1.00 40.70 ? 528 PRO C CB 1 +ATOM 15688 C CG . PRO C 1 528 ? -37.359 0.588 93.840 1.00 41.29 ? 528 PRO C CG 1 +ATOM 15689 C CD . PRO C 1 528 ? -38.811 0.411 93.474 1.00 40.73 ? 528 PRO C CD 1 +ATOM 15690 N N . VAL C 1 529 ? -36.700 -3.456 95.155 1.00 38.66 ? 529 VAL C N 1 +ATOM 15691 C CA . VAL C 1 529 ? -36.331 -4.114 96.407 1.00 37.08 ? 529 VAL C CA 1 +ATOM 15692 C C . VAL C 1 529 ? -35.285 -3.287 97.166 1.00 37.15 ? 529 VAL C C 1 +ATOM 15693 O O . VAL C 1 529 ? -35.518 -2.889 98.309 1.00 37.40 ? 529 VAL C O 1 +ATOM 15694 C CB . VAL C 1 529 ? -35.786 -5.525 96.145 1.00 37.21 ? 529 VAL C CB 1 +ATOM 15695 C CG1 . VAL C 1 529 ? -35.348 -6.176 97.463 1.00 34.00 ? 529 VAL C CG1 1 +ATOM 15696 C CG2 . VAL C 1 529 ? -36.862 -6.358 95.455 1.00 36.21 ? 529 VAL C CG2 1 +ATOM 15697 N N . ILE C 1 530 ? -34.130 -3.037 96.552 1.00 35.51 ? 530 ILE C N 1 +ATOM 15698 C CA . ILE C 1 530 ? -33.121 -2.217 97.215 1.00 34.80 ? 530 ILE C CA 1 +ATOM 15699 C C . ILE C 1 530 ? -33.289 -0.812 96.654 1.00 35.64 ? 530 ILE C C 1 +ATOM 15700 O O . ILE C 1 530 ? -33.599 -0.639 95.471 1.00 33.33 ? 530 ILE C O 1 +ATOM 15701 C CB . ILE C 1 530 ? -31.692 -2.725 96.963 1.00 35.42 ? 530 ILE C CB 1 +ATOM 15702 C CG1 . ILE C 1 530 ? -31.420 -2.809 95.461 1.00 35.49 ? 530 ILE C CG1 1 +ATOM 15703 C CG2 . ILE C 1 530 ? -31.501 -4.085 97.638 1.00 34.15 ? 530 ILE C CG2 1 +ATOM 15704 C CD1 . ILE C 1 530 ? -29.980 -3.156 95.132 1.00 37.42 ? 530 ILE C CD1 1 +ATOM 15705 N N . ARG C 1 531 ? -33.094 0.197 97.499 1.00 35.98 ? 531 ARG C N 1 +ATOM 15706 C CA . ARG C 1 531 ? -33.302 1.571 97.060 1.00 35.72 ? 531 ARG C CA 1 +ATOM 15707 C C . ARG C 1 531 ? -32.294 2.552 97.592 1.00 35.83 ? 531 ARG C C 1 +ATOM 15708 O O . ARG C 1 531 ? -31.772 2.388 98.691 1.00 35.24 ? 531 ARG C O 1 +ATOM 15709 C CB . ARG C 1 531 ? -34.681 2.052 97.513 1.00 34.92 ? 531 ARG C CB 1 +ATOM 15710 C CG . ARG C 1 531 ? -35.734 0.984 97.435 1.00 37.73 ? 531 ARG C CG 1 +ATOM 15711 C CD . ARG C 1 531 ? -36.923 1.264 98.333 1.00 38.60 ? 531 ARG C CD 1 +ATOM 15712 N NE . ARG C 1 531 ? -37.927 0.224 98.141 1.00 40.89 ? 531 ARG C NE 1 +ATOM 15713 C CZ . ARG C 1 531 ? -39.146 0.238 98.665 1.00 40.75 ? 531 ARG C CZ 1 +ATOM 15714 N NH1 . ARG C 1 531 ? -39.531 1.250 99.426 1.00 40.27 ? 531 ARG C NH1 1 +ATOM 15715 N NH2 . ARG C 1 531 ? -39.980 -0.765 98.419 1.00 40.35 ? 531 ARG C NH2 1 +ATOM 15716 N N . PRO C 1 532 ? -31.993 3.590 96.798 1.00 36.76 ? 532 PRO C N 1 +ATOM 15717 C CA . PRO C 1 532 ? -31.042 4.601 97.258 1.00 35.92 ? 532 PRO C CA 1 +ATOM 15718 C C . PRO C 1 532 ? -31.825 5.392 98.313 1.00 36.49 ? 532 PRO C C 1 +ATOM 15719 O O . PRO C 1 532 ? -33.062 5.373 98.311 1.00 35.66 ? 532 PRO C O 1 +ATOM 15720 C CB . PRO C 1 532 ? -30.752 5.403 95.990 1.00 35.08 ? 532 PRO C CB 1 +ATOM 15721 C CG . PRO C 1 532 ? -32.001 5.233 95.177 1.00 34.95 ? 532 PRO C CG 1 +ATOM 15722 C CD . PRO C 1 532 ? -32.334 3.786 95.377 1.00 35.53 ? 532 PRO C CD 1 +ATOM 15723 N N . LEU C 1 533 ? -31.127 6.067 99.220 1.00 37.32 ? 533 LEU C N 1 +ATOM 15724 C CA . LEU C 1 533 ? -31.810 6.827 100.265 1.00 37.39 ? 533 LEU C CA 1 +ATOM 15725 C C . LEU C 1 533 ? -32.758 7.900 99.741 1.00 37.37 ? 533 LEU C C 1 +ATOM 15726 O O . LEU C 1 533 ? -33.805 8.145 100.335 1.00 38.62 ? 533 LEU C O 1 +ATOM 15727 C CB . LEU C 1 533 ? -30.803 7.482 101.220 1.00 36.31 ? 533 LEU C CB 1 +ATOM 15728 C CG . LEU C 1 533 ? -29.811 6.560 101.927 1.00 36.13 ? 533 LEU C CG 1 +ATOM 15729 C CD1 . LEU C 1 533 ? -29.237 7.272 103.135 1.00 36.26 ? 533 LEU C CD1 1 +ATOM 15730 C CD2 . LEU C 1 533 ? -30.503 5.283 102.347 1.00 36.42 ? 533 LEU C CD2 1 +ATOM 15731 N N . PHE C 1 534 ? -32.410 8.551 98.639 1.00 36.67 ? 534 PHE C N 1 +ATOM 15732 C CA . PHE C 1 534 ? -33.294 9.589 98.133 1.00 37.72 ? 534 PHE C CA 1 +ATOM 15733 C C . PHE C 1 534 ? -34.651 9.055 97.669 1.00 38.28 ? 534 PHE C C 1 +ATOM 15734 O O . PHE C 1 534 ? -35.580 9.825 97.465 1.00 38.52 ? 534 PHE C O 1 +ATOM 15735 C CB . PHE C 1 534 ? -32.612 10.405 97.018 1.00 35.98 ? 534 PHE C CB 1 +ATOM 15736 C CG . PHE C 1 534 ? -32.202 9.604 95.815 1.00 35.30 ? 534 PHE C CG 1 +ATOM 15737 C CD1 . PHE C 1 534 ? -33.152 9.113 94.929 1.00 34.86 ? 534 PHE C CD1 1 +ATOM 15738 C CD2 . PHE C 1 534 ? -30.852 9.380 95.544 1.00 35.44 ? 534 PHE C CD2 1 +ATOM 15739 C CE1 . PHE C 1 534 ? -32.765 8.409 93.778 1.00 36.18 ? 534 PHE C CE1 1 +ATOM 15740 C CE2 . PHE C 1 534 ? -30.446 8.682 94.402 1.00 35.45 ? 534 PHE C CE2 1 +ATOM 15741 C CZ . PHE C 1 534 ? -31.406 8.195 93.513 1.00 37.32 ? 534 PHE C CZ 1 +ATOM 15742 N N . TYR C 1 535 ? -34.780 7.742 97.519 1.00 38.88 ? 535 TYR C N 1 +ATOM 15743 C CA . TYR C 1 535 ? -36.051 7.179 97.088 1.00 38.49 ? 535 TYR C CA 1 +ATOM 15744 C C . TYR C 1 535 ? -37.099 7.327 98.191 1.00 39.23 ? 535 TYR C C 1 +ATOM 15745 O O . TYR C 1 535 ? -38.257 7.648 97.926 1.00 40.21 ? 535 TYR C O 1 +ATOM 15746 C CB . TYR C 1 535 ? -35.872 5.710 96.703 1.00 37.62 ? 535 TYR C CB 1 +ATOM 15747 C CG . TYR C 1 535 ? -37.158 5.000 96.334 1.00 37.81 ? 535 TYR C CG 1 +ATOM 15748 C CD1 . TYR C 1 535 ? -38.015 4.517 97.322 1.00 37.70 ? 535 TYR C CD1 1 +ATOM 15749 C CD2 . TYR C 1 535 ? -37.509 4.795 94.999 1.00 37.04 ? 535 TYR C CD2 1 +ATOM 15750 C CE1 . TYR C 1 535 ? -39.184 3.841 96.993 1.00 38.79 ? 535 TYR C CE1 1 +ATOM 15751 C CE2 . TYR C 1 535 ? -38.678 4.121 94.660 1.00 37.64 ? 535 TYR C CE2 1 +ATOM 15752 C CZ . TYR C 1 535 ? -39.510 3.644 95.662 1.00 38.90 ? 535 TYR C CZ 1 +ATOM 15753 O OH . TYR C 1 535 ? -40.653 2.945 95.348 1.00 40.43 ? 535 TYR C OH 1 +ATOM 15754 N N . GLU C 1 536 ? -36.685 7.108 99.432 1.00 39.92 ? 536 GLU C N 1 +ATOM 15755 C CA . GLU C 1 536 ? -37.587 7.227 100.569 1.00 40.06 ? 536 GLU C CA 1 +ATOM 15756 C C . GLU C 1 536 ? -37.604 8.637 101.140 1.00 39.21 ? 536 GLU C C 1 +ATOM 15757 O O . GLU C 1 536 ? -38.547 9.017 101.831 1.00 38.53 ? 536 GLU C O 1 +ATOM 15758 C CB . GLU C 1 536 ? -37.170 6.256 101.676 1.00 42.37 ? 536 GLU C CB 1 +ATOM 15759 C CG . GLU C 1 536 ? -37.493 4.796 101.402 1.00 45.99 ? 536 GLU C CG 1 +ATOM 15760 C CD . GLU C 1 536 ? -38.992 4.550 101.283 1.00 49.07 ? 536 GLU C CD 1 +ATOM 15761 O OE1 . GLU C 1 536 ? -39.754 5.081 102.127 1.00 50.98 ? 536 GLU C OE1 1 +ATOM 15762 O OE2 . GLU C 1 536 ? -39.409 3.822 100.356 1.00 49.18 ? 536 GLU C OE2 1 +ATOM 15763 N N . PHE C 1 537 ? -36.554 9.405 100.864 1.00 38.78 ? 537 PHE C N 1 +ATOM 15764 C CA . PHE C 1 537 ? -36.442 10.773 101.377 1.00 39.72 ? 537 PHE C CA 1 +ATOM 15765 C C . PHE C 1 537 ? -36.045 11.723 100.257 1.00 40.04 ? 537 PHE C C 1 +ATOM 15766 O O . PHE C 1 537 ? -35.030 12.416 100.348 1.00 40.47 ? 537 PHE C O 1 +ATOM 15767 C CB . PHE C 1 537 ? -35.397 10.824 102.503 1.00 38.18 ? 537 PHE C CB 1 +ATOM 15768 C CG . PHE C 1 537 ? -35.579 9.748 103.539 1.00 38.33 ? 537 PHE C CG 1 +ATOM 15769 C CD1 . PHE C 1 537 ? -34.992 8.499 103.370 1.00 38.42 ? 537 PHE C CD1 1 +ATOM 15770 C CD2 . PHE C 1 537 ? -36.404 9.958 104.645 1.00 37.83 ? 537 PHE C CD2 1 +ATOM 15771 C CE1 . PHE C 1 537 ? -35.223 7.466 104.285 1.00 39.57 ? 537 PHE C CE1 1 +ATOM 15772 C CE2 . PHE C 1 537 ? -36.644 8.937 105.566 1.00 38.59 ? 537 PHE C CE2 1 +ATOM 15773 C CZ . PHE C 1 537 ? -36.051 7.683 105.386 1.00 38.96 ? 537 PHE C CZ 1 +ATOM 15774 N N . GLN C 1 538 ? -36.868 11.764 99.214 1.00 40.61 ? 538 GLN C N 1 +ATOM 15775 C CA . GLN C 1 538 ? -36.601 12.582 98.041 1.00 42.26 ? 538 GLN C CA 1 +ATOM 15776 C C . GLN C 1 538 ? -36.573 14.080 98.267 1.00 44.33 ? 538 GLN C C 1 +ATOM 15777 O O . GLN C 1 538 ? -36.053 14.823 97.432 1.00 45.94 ? 538 GLN C O 1 +ATOM 15778 C CB . GLN C 1 538 ? -37.616 12.263 96.945 1.00 40.33 ? 538 GLN C CB 1 +ATOM 15779 C CG . GLN C 1 538 ? -39.032 12.704 97.253 1.00 38.77 ? 538 GLN C CG 1 +ATOM 15780 C CD . GLN C 1 538 ? -40.002 12.338 96.133 1.00 40.89 ? 538 GLN C CD 1 +ATOM 15781 O OE1 . GLN C 1 538 ? -40.339 11.161 95.940 1.00 41.74 ? 538 GLN C OE1 1 +ATOM 15782 N NE2 . GLN C 1 538 ? -40.446 13.342 95.380 1.00 36.46 ? 538 GLN C NE2 1 +ATOM 15783 N N . ASP C 1 539 ? -37.113 14.528 99.390 1.00 46.02 ? 539 ASP C N 1 +ATOM 15784 C CA . ASP C 1 539 ? -37.168 15.956 99.687 1.00 48.99 ? 539 ASP C CA 1 +ATOM 15785 C C . ASP C 1 539 ? -35.915 16.515 100.361 1.00 48.66 ? 539 ASP C C 1 +ATOM 15786 O O . ASP C 1 539 ? -35.808 17.724 100.565 1.00 48.42 ? 539 ASP C O 1 +ATOM 15787 C CB . ASP C 1 539 ? -38.383 16.245 100.563 1.00 52.07 ? 539 ASP C CB 1 +ATOM 15788 C CG . ASP C 1 539 ? -38.330 15.501 101.883 1.00 56.52 ? 539 ASP C CG 1 +ATOM 15789 O OD1 . ASP C 1 539 ? -38.086 14.267 101.872 1.00 59.30 ? 539 ASP C OD1 1 +ATOM 15790 O OD2 . ASP C 1 539 ? -38.537 16.149 102.932 1.00 59.84 ? 539 ASP C OD2 1 +ATOM 15791 N N . ASP C 1 540 ? -34.975 15.641 100.705 1.00 48.39 ? 540 ASP C N 1 +ATOM 15792 C CA . ASP C 1 540 ? -33.741 16.068 101.360 1.00 48.80 ? 540 ASP C CA 1 +ATOM 15793 C C . ASP C 1 540 ? -32.564 15.978 100.391 1.00 47.99 ? 540 ASP C C 1 +ATOM 15794 O O . ASP C 1 540 ? -32.099 14.888 100.068 1.00 48.08 ? 540 ASP C O 1 +ATOM 15795 C CB . ASP C 1 540 ? -33.496 15.194 102.596 1.00 51.04 ? 540 ASP C CB 1 +ATOM 15796 C CG . ASP C 1 540 ? -32.174 15.500 103.289 1.00 54.57 ? 540 ASP C CG 1 +ATOM 15797 O OD1 . ASP C 1 540 ? -31.633 16.619 103.118 1.00 55.38 ? 540 ASP C OD1 1 +ATOM 15798 O OD2 . ASP C 1 540 ? -31.683 14.616 104.029 1.00 56.20 ? 540 ASP C OD2 1 +ATOM 15799 N N . ASP C 1 541 ? -32.084 17.131 99.936 1.00 47.00 ? 541 ASP C N 1 +ATOM 15800 C CA . ASP C 1 541 ? -30.978 17.187 98.986 1.00 47.19 ? 541 ASP C CA 1 +ATOM 15801 C C . ASP C 1 541 ? -29.738 16.392 99.385 1.00 46.85 ? 541 ASP C C 1 +ATOM 15802 O O . ASP C 1 541 ? -29.053 15.846 98.527 1.00 46.82 ? 541 ASP C O 1 +ATOM 15803 C CB . ASP C 1 541 ? -30.592 18.643 98.707 1.00 47.66 ? 541 ASP C CB 1 +ATOM 15804 C CG . ASP C 1 541 ? -31.715 19.427 98.038 1.00 50.80 ? 541 ASP C CG 1 +ATOM 15805 O OD1 . ASP C 1 541 ? -32.568 18.804 97.365 1.00 51.68 ? 541 ASP C OD1 1 +ATOM 15806 O OD2 . ASP C 1 541 ? -31.744 20.670 98.170 1.00 54.00 ? 541 ASP C OD2 1 +ATOM 15807 N N . ASP C 1 542 ? -29.449 16.332 100.680 1.00 47.26 ? 542 ASP C N 1 +ATOM 15808 C CA . ASP C 1 542 ? -28.295 15.588 101.182 1.00 47.40 ? 542 ASP C CA 1 +ATOM 15809 C C . ASP C 1 542 ? -28.305 14.145 100.686 1.00 46.41 ? 542 ASP C C 1 +ATOM 15810 O O . ASP C 1 542 ? -27.262 13.583 100.341 1.00 45.06 ? 542 ASP C O 1 +ATOM 15811 C CB . ASP C 1 542 ? -28.307 15.569 102.715 1.00 50.30 ? 542 ASP C CB 1 +ATOM 15812 C CG . ASP C 1 542 ? -27.834 16.875 103.326 1.00 54.13 ? 542 ASP C CG 1 +ATOM 15813 O OD1 . ASP C 1 542 ? -28.109 17.955 102.745 1.00 55.75 ? 542 ASP C OD1 1 +ATOM 15814 O OD2 . ASP C 1 542 ? -27.196 16.819 104.405 1.00 55.74 ? 542 ASP C OD2 1 +ATOM 15815 N N . MET C 1 543 ? -29.498 13.558 100.660 1.00 44.62 ? 543 MET C N 1 +ATOM 15816 C CA . MET C 1 543 ? -29.681 12.174 100.252 1.00 43.87 ? 543 MET C CA 1 +ATOM 15817 C C . MET C 1 543 ? -29.163 11.815 98.867 1.00 43.15 ? 543 MET C C 1 +ATOM 15818 O O . MET C 1 543 ? -28.826 10.658 98.615 1.00 44.02 ? 543 MET C O 1 +ATOM 15819 C CB . MET C 1 543 ? -31.161 11.803 100.356 1.00 44.67 ? 543 MET C CB 1 +ATOM 15820 C CG . MET C 1 543 ? -31.742 11.981 101.758 1.00 46.76 ? 543 MET C CG 1 +ATOM 15821 S SD . MET C 1 543 ? -30.923 10.934 103.013 1.00 48.23 ? 543 MET C SD 1 +ATOM 15822 C CE . MET C 1 543 ? -29.764 12.106 103.750 1.00 44.65 ? 543 MET C CE 1 +ATOM 15823 N N . TYR C 1 544 ? -29.094 12.789 97.969 1.00 41.79 ? 544 TYR C N 1 +ATOM 15824 C CA . TYR C 1 544 ? -28.617 12.512 96.623 1.00 41.47 ? 544 TYR C CA 1 +ATOM 15825 C C . TYR C 1 544 ? -27.101 12.415 96.518 1.00 43.00 ? 544 TYR C C 1 +ATOM 15826 O O . TYR C 1 544 ? -26.568 12.191 95.434 1.00 44.57 ? 544 TYR C O 1 +ATOM 15827 C CB . TYR C 1 544 ? -29.144 13.561 95.646 1.00 37.76 ? 544 TYR C CB 1 +ATOM 15828 C CG . TYR C 1 544 ? -30.647 13.562 95.561 1.00 36.47 ? 544 TYR C CG 1 +ATOM 15829 C CD1 . TYR C 1 544 ? -31.422 14.141 96.564 1.00 35.41 ? 544 TYR C CD1 1 +ATOM 15830 C CD2 . TYR C 1 544 ? -31.300 12.961 94.493 1.00 35.36 ? 544 TYR C CD2 1 +ATOM 15831 C CE1 . TYR C 1 544 ? -32.804 14.124 96.502 1.00 34.50 ? 544 TYR C CE1 1 +ATOM 15832 C CE2 . TYR C 1 544 ? -32.679 12.933 94.419 1.00 34.15 ? 544 TYR C CE2 1 +ATOM 15833 C CZ . TYR C 1 544 ? -33.428 13.516 95.424 1.00 35.17 ? 544 TYR C CZ 1 +ATOM 15834 O OH . TYR C 1 544 ? -34.802 13.494 95.351 1.00 35.14 ? 544 TYR C OH 1 +ATOM 15835 N N . ARG C 1 545 ? -26.404 12.575 97.637 1.00 44.63 ? 545 ARG C N 1 +ATOM 15836 C CA . ARG C 1 545 ? -24.949 12.479 97.631 1.00 46.15 ? 545 ARG C CA 1 +ATOM 15837 C C . ARG C 1 545 ? -24.497 11.258 98.427 1.00 46.53 ? 545 ARG C C 1 +ATOM 15838 O O . ARG C 1 545 ? -23.306 10.955 98.491 1.00 45.79 ? 545 ARG C O 1 +ATOM 15839 C CB . ARG C 1 545 ? -24.313 13.742 98.224 1.00 46.55 ? 545 ARG C CB 1 +ATOM 15840 C CG . ARG C 1 545 ? -24.542 15.008 97.408 1.00 48.94 ? 545 ARG C CG 1 +ATOM 15841 C CD . ARG C 1 545 ? -24.054 14.849 95.976 1.00 50.31 ? 545 ARG C CD 1 +ATOM 15842 N NE . ARG C 1 545 ? -22.607 14.644 95.880 1.00 52.23 ? 545 ARG C NE 1 +ATOM 15843 C CZ . ARG C 1 545 ? -21.695 15.608 96.000 1.00 53.11 ? 545 ARG C CZ 1 +ATOM 15844 N NH1 . ARG C 1 545 ? -22.070 16.863 96.225 1.00 52.96 ? 545 ARG C NH1 1 +ATOM 15845 N NH2 . ARG C 1 545 ? -20.403 15.321 95.882 1.00 52.05 ? 545 ARG C NH2 1 +ATOM 15846 N N . ILE C 1 546 ? -25.448 10.566 99.044 1.00 46.76 ? 546 ILE C N 1 +ATOM 15847 C CA . ILE C 1 546 ? -25.114 9.375 99.819 1.00 48.45 ? 546 ILE C CA 1 +ATOM 15848 C C . ILE C 1 546 ? -25.175 8.168 98.885 1.00 48.71 ? 546 ILE C C 1 +ATOM 15849 O O . ILE C 1 546 ? -26.243 7.818 98.378 1.00 48.46 ? 546 ILE C O 1 +ATOM 15850 C CB . ILE C 1 546 ? -26.093 9.181 101.006 1.00 48.46 ? 546 ILE C CB 1 +ATOM 15851 C CG1 . ILE C 1 546 ? -25.676 10.061 102.197 1.00 48.63 ? 546 ILE C CG1 1 +ATOM 15852 C CG2 . ILE C 1 546 ? -26.074 7.729 101.460 1.00 48.95 ? 546 ILE C CG2 1 +ATOM 15853 C CD1 . ILE C 1 546 ? -25.433 11.521 101.887 1.00 47.84 ? 546 ILE C CD1 1 +ATOM 15854 N N . GLU C 1 547 ? -24.031 7.533 98.652 1.00 48.52 ? 547 GLU C N 1 +ATOM 15855 C CA . GLU C 1 547 ? -24.008 6.392 97.750 1.00 49.43 ? 547 GLU C CA 1 +ATOM 15856 C C . GLU C 1 547 ? -23.423 5.095 98.295 1.00 46.85 ? 547 GLU C C 1 +ATOM 15857 O O . GLU C 1 547 ? -23.432 4.079 97.603 1.00 47.86 ? 547 GLU C O 1 +ATOM 15858 C CB . GLU C 1 547 ? -23.285 6.773 96.465 1.00 52.16 ? 547 GLU C CB 1 +ATOM 15859 C CG . GLU C 1 547 ? -23.815 8.044 95.839 1.00 56.30 ? 547 GLU C CG 1 +ATOM 15860 C CD . GLU C 1 547 ? -23.366 8.212 94.407 1.00 58.89 ? 547 GLU C CD 1 +ATOM 15861 O OE1 . GLU C 1 547 ? -22.148 8.096 94.149 1.00 61.56 ? 547 GLU C OE1 1 +ATOM 15862 O OE2 . GLU C 1 547 ? -24.232 8.463 93.544 1.00 60.00 ? 547 GLU C OE2 1 +ATOM 15863 N N . ASP C 1 548 ? -22.909 5.122 99.516 1.00 43.47 ? 548 ASP C N 1 +ATOM 15864 C CA . ASP C 1 548 ? -22.364 3.916 100.121 1.00 42.02 ? 548 ASP C CA 1 +ATOM 15865 C C . ASP C 1 548 ? -23.341 3.374 101.164 1.00 39.60 ? 548 ASP C C 1 +ATOM 15866 O O . ASP C 1 548 ? -22.956 2.678 102.096 1.00 38.81 ? 548 ASP C O 1 +ATOM 15867 C CB . ASP C 1 548 ? -20.997 4.188 100.762 1.00 43.26 ? 548 ASP C CB 1 +ATOM 15868 C CG . ASP C 1 548 ? -20.974 5.471 101.587 1.00 46.62 ? 548 ASP C CG 1 +ATOM 15869 O OD1 . ASP C 1 548 ? -22.059 5.968 101.981 1.00 44.68 ? 548 ASP C OD1 1 +ATOM 15870 O OD2 . ASP C 1 548 ? -19.855 5.978 101.851 1.00 48.89 ? 548 ASP C OD2 1 +ATOM 15871 N N . GLU C 1 549 ? -24.610 3.721 100.997 1.00 37.52 ? 549 GLU C N 1 +ATOM 15872 C CA . GLU C 1 549 ? -25.679 3.271 101.881 1.00 36.25 ? 549 GLU C CA 1 +ATOM 15873 C C . GLU C 1 549 ? -26.874 2.988 101.003 1.00 34.18 ? 549 GLU C C 1 +ATOM 15874 O O . GLU C 1 549 ? -27.016 3.585 99.941 1.00 34.45 ? 549 GLU C O 1 +ATOM 15875 C CB . GLU C 1 549 ? -26.076 4.357 102.882 1.00 37.18 ? 549 GLU C CB 1 +ATOM 15876 C CG . GLU C 1 549 ? -25.082 4.606 103.998 1.00 40.27 ? 549 GLU C CG 1 +ATOM 15877 C CD . GLU C 1 549 ? -25.475 5.790 104.864 1.00 42.39 ? 549 GLU C CD 1 +ATOM 15878 O OE1 . GLU C 1 549 ? -26.677 5.906 105.207 1.00 43.47 ? 549 GLU C OE1 1 +ATOM 15879 O OE2 . GLU C 1 549 ? -24.583 6.600 105.205 1.00 42.34 ? 549 GLU C OE2 1 +ATOM 15880 N N . TYR C 1 550 ? -27.721 2.062 101.426 1.00 33.69 ? 550 TYR C N 1 +ATOM 15881 C CA . TYR C 1 550 ? -28.926 1.772 100.671 1.00 32.87 ? 550 TYR C CA 1 +ATOM 15882 C C . TYR C 1 550 ? -30.021 1.212 101.550 1.00 33.05 ? 550 TYR C C 1 +ATOM 15883 O O . TYR C 1 550 ? -29.755 0.634 102.608 1.00 31.84 ? 550 TYR C O 1 +ATOM 15884 C CB . TYR C 1 550 ? -28.648 0.835 99.484 1.00 31.73 ? 550 TYR C CB 1 +ATOM 15885 C CG . TYR C 1 550 ? -28.202 -0.582 99.793 1.00 31.85 ? 550 TYR C CG 1 +ATOM 15886 C CD1 . TYR C 1 550 ? -26.856 -0.888 99.969 1.00 30.73 ? 550 TYR C CD1 1 +ATOM 15887 C CD2 . TYR C 1 550 ? -29.123 -1.632 99.813 1.00 33.44 ? 550 TYR C CD2 1 +ATOM 15888 C CE1 . TYR C 1 550 ? -26.428 -2.207 100.144 1.00 31.35 ? 550 TYR C CE1 1 +ATOM 15889 C CE2 . TYR C 1 550 ? -28.707 -2.958 99.992 1.00 33.84 ? 550 TYR C CE2 1 +ATOM 15890 C CZ . TYR C 1 550 ? -27.352 -3.238 100.153 1.00 32.13 ? 550 TYR C CZ 1 +ATOM 15891 O OH . TYR C 1 550 ? -26.924 -4.549 100.298 1.00 30.25 ? 550 TYR C OH 1 +ATOM 15892 N N . MET C 1 551 ? -31.260 1.433 101.118 1.00 34.77 ? 551 MET C N 1 +ATOM 15893 C CA . MET C 1 551 ? -32.447 0.958 101.824 1.00 34.62 ? 551 MET C CA 1 +ATOM 15894 C C . MET C 1 551 ? -32.876 -0.385 101.247 1.00 33.43 ? 551 MET C C 1 +ATOM 15895 O O . MET C 1 551 ? -32.803 -0.611 100.041 1.00 32.47 ? 551 MET C O 1 +ATOM 15896 C CB . MET C 1 551 ? -33.614 1.922 101.632 1.00 37.15 ? 551 MET C CB 1 +ATOM 15897 C CG . MET C 1 551 ? -33.405 3.335 102.135 1.00 42.60 ? 551 MET C CG 1 +ATOM 15898 S SD . MET C 1 551 ? -33.518 3.448 103.913 1.00 50.67 ? 551 MET C SD 1 +ATOM 15899 C CE . MET C 1 551 ? -35.315 3.247 104.180 1.00 44.37 ? 551 MET C CE 1 +ATOM 15900 N N . VAL C 1 552 ? -33.307 -1.284 102.118 1.00 34.01 ? 552 VAL C N 1 +ATOM 15901 C CA . VAL C 1 552 ? -33.819 -2.573 101.684 1.00 32.37 ? 552 VAL C CA 1 +ATOM 15902 C C . VAL C 1 552 ? -35.289 -2.422 102.016 1.00 32.64 ? 552 VAL C C 1 +ATOM 15903 O O . VAL C 1 552 ? -35.680 -2.466 103.184 1.00 32.90 ? 552 VAL C O 1 +ATOM 15904 C CB . VAL C 1 552 ? -33.208 -3.727 102.481 1.00 31.18 ? 552 VAL C CB 1 +ATOM 15905 C CG1 . VAL C 1 552 ? -33.817 -5.052 102.023 1.00 30.10 ? 552 VAL C CG1 1 +ATOM 15906 C CG2 . VAL C 1 552 ? -31.699 -3.729 102.292 1.00 29.85 ? 552 VAL C CG2 1 +ATOM 15907 N N . GLY C 1 553 ? -36.099 -2.205 100.988 1.00 33.18 ? 553 GLY C N 1 +ATOM 15908 C CA . GLY C 1 553 ? -37.514 -2.007 101.218 1.00 34.65 ? 553 GLY C CA 1 +ATOM 15909 C C . GLY C 1 553 ? -37.681 -0.621 101.817 1.00 37.74 ? 553 GLY C C 1 +ATOM 15910 O O . GLY C 1 553 ? -36.844 0.265 101.629 1.00 39.06 ? 553 GLY C O 1 +ATOM 15911 N N . LYS C 1 554 ? -38.745 -0.434 102.576 1.00 38.55 ? 554 LYS C N 1 +ATOM 15912 C CA . LYS C 1 554 ? -39.032 0.854 103.175 1.00 39.36 ? 554 LYS C CA 1 +ATOM 15913 C C . LYS C 1 554 ? -38.512 0.965 104.610 1.00 40.49 ? 554 LYS C C 1 +ATOM 15914 O O . LYS C 1 554 ? -38.357 2.068 105.142 1.00 40.64 ? 554 LYS C O 1 +ATOM 15915 C CB . LYS C 1 554 ? -40.548 1.039 103.157 1.00 40.26 ? 554 LYS C CB 1 +ATOM 15916 C CG . LYS C 1 554 ? -41.058 2.403 103.518 1.00 43.78 ? 554 LYS C CG 1 +ATOM 15917 C CD . LYS C 1 554 ? -42.565 2.464 103.272 1.00 44.75 ? 554 LYS C CD 1 +ATOM 15918 C CE . LYS C 1 554 ? -43.118 3.861 103.538 1.00 48.16 ? 554 LYS C CE 1 +ATOM 15919 N NZ . LYS C 1 554 ? -42.552 4.896 102.616 1.00 49.22 ? 554 LYS C NZ 1 +ATOM 15920 N N . TYR C 1 555 ? -38.204 -0.178 105.217 1.00 40.38 ? 555 TYR C N 1 +ATOM 15921 C CA . TYR C 1 555 ? -37.806 -0.217 106.620 1.00 38.79 ? 555 TYR C CA 1 +ATOM 15922 C C . TYR C 1 555 ? -36.356 -0.387 107.035 1.00 39.22 ? 555 TYR C C 1 +ATOM 15923 O O . TYR C 1 555 ? -35.981 0.015 108.143 1.00 40.98 ? 555 TYR C O 1 +ATOM 15924 C CB . TYR C 1 555 ? -38.577 -1.323 107.331 1.00 37.99 ? 555 TYR C CB 1 +ATOM 15925 C CG . TYR C 1 555 ? -40.050 -1.404 107.011 1.00 37.08 ? 555 TYR C CG 1 +ATOM 15926 C CD1 . TYR C 1 555 ? -40.839 -0.259 106.957 1.00 36.02 ? 555 TYR C CD1 1 +ATOM 15927 C CD2 . TYR C 1 555 ? -40.669 -2.642 106.841 1.00 36.57 ? 555 TYR C CD2 1 +ATOM 15928 C CE1 . TYR C 1 555 ? -42.204 -0.343 106.750 1.00 36.68 ? 555 TYR C CE1 1 +ATOM 15929 C CE2 . TYR C 1 555 ? -42.033 -2.739 106.636 1.00 36.86 ? 555 TYR C CE2 1 +ATOM 15930 C CZ . TYR C 1 555 ? -42.795 -1.583 106.594 1.00 37.78 ? 555 TYR C CZ 1 +ATOM 15931 O OH . TYR C 1 555 ? -44.155 -1.670 106.419 1.00 41.24 ? 555 TYR C OH 1 +ATOM 15932 N N . LEU C 1 556 ? -35.533 -0.975 106.183 1.00 38.18 ? 556 LEU C N 1 +ATOM 15933 C CA . LEU C 1 556 ? -34.161 -1.236 106.583 1.00 35.76 ? 556 LEU C CA 1 +ATOM 15934 C C . LEU C 1 556 ? -33.069 -0.429 105.895 1.00 35.15 ? 556 LEU C C 1 +ATOM 15935 O O . LEU C 1 556 ? -32.996 -0.377 104.669 1.00 35.61 ? 556 LEU C O 1 +ATOM 15936 C CB . LEU C 1 556 ? -33.912 -2.739 106.421 1.00 35.39 ? 556 LEU C CB 1 +ATOM 15937 C CG . LEU C 1 556 ? -32.670 -3.394 107.016 1.00 36.56 ? 556 LEU C CG 1 +ATOM 15938 C CD1 . LEU C 1 556 ? -32.919 -4.888 107.138 1.00 35.68 ? 556 LEU C CD1 1 +ATOM 15939 C CD2 . LEU C 1 556 ? -31.457 -3.112 106.156 1.00 35.09 ? 556 LEU C CD2 1 +ATOM 15940 N N . LEU C 1 557 ? -32.216 0.204 106.696 1.00 34.83 ? 557 LEU C N 1 +ATOM 15941 C CA . LEU C 1 557 ? -31.109 0.988 106.163 1.00 34.07 ? 557 LEU C CA 1 +ATOM 15942 C C . LEU C 1 557 ? -29.825 0.216 106.398 1.00 33.76 ? 557 LEU C C 1 +ATOM 15943 O O . LEU C 1 557 ? -29.516 -0.161 107.521 1.00 34.16 ? 557 LEU C O 1 +ATOM 15944 C CB . LEU C 1 557 ? -31.011 2.361 106.839 1.00 35.53 ? 557 LEU C CB 1 +ATOM 15945 C CG . LEU C 1 557 ? -29.976 3.309 106.202 1.00 37.50 ? 557 LEU C CG 1 +ATOM 15946 C CD1 . LEU C 1 557 ? -30.267 4.734 106.591 1.00 40.35 ? 557 LEU C CD1 1 +ATOM 15947 C CD2 . LEU C 1 557 ? -28.585 2.933 106.648 1.00 38.42 ? 557 LEU C CD2 1 +ATOM 15948 N N . TYR C 1 558 ? -29.074 -0.013 105.328 1.00 33.43 ? 558 TYR C N 1 +ATOM 15949 C CA . TYR C 1 558 ? -27.830 -0.753 105.422 1.00 32.94 ? 558 TYR C CA 1 +ATOM 15950 C C . TYR C 1 558 ? -26.677 0.105 104.929 1.00 33.36 ? 558 TYR C C 1 +ATOM 15951 O O . TYR C 1 558 ? -26.710 0.639 103.825 1.00 33.91 ? 558 TYR C O 1 +ATOM 15952 C CB . TYR C 1 558 ? -27.933 -2.050 104.605 1.00 33.59 ? 558 TYR C CB 1 +ATOM 15953 C CG . TYR C 1 558 ? -26.699 -2.930 104.640 1.00 33.42 ? 558 TYR C CG 1 +ATOM 15954 C CD1 . TYR C 1 558 ? -26.017 -3.158 105.831 1.00 34.29 ? 558 TYR C CD1 1 +ATOM 15955 C CD2 . TYR C 1 558 ? -26.223 -3.544 103.481 1.00 33.10 ? 558 TYR C CD2 1 +ATOM 15956 C CE1 . TYR C 1 558 ? -24.889 -3.967 105.872 1.00 35.04 ? 558 TYR C CE1 1 +ATOM 15957 C CE2 . TYR C 1 558 ? -25.100 -4.361 103.508 1.00 34.43 ? 558 TYR C CE2 1 +ATOM 15958 C CZ . TYR C 1 558 ? -24.431 -4.567 104.707 1.00 35.87 ? 558 TYR C CZ 1 +ATOM 15959 O OH . TYR C 1 558 ? -23.293 -5.347 104.741 1.00 34.67 ? 558 TYR C OH 1 +ATOM 15960 N N . ALA C 1 559 ? -25.664 0.258 105.771 1.00 33.54 ? 559 ALA C N 1 +ATOM 15961 C CA . ALA C 1 559 ? -24.492 1.045 105.418 1.00 34.36 ? 559 ALA C CA 1 +ATOM 15962 C C . ALA C 1 559 ? -23.289 0.104 105.403 1.00 35.34 ? 559 ALA C C 1 +ATOM 15963 O O . ALA C 1 559 ? -22.535 0.022 106.365 1.00 35.81 ? 559 ALA C O 1 +ATOM 15964 C CB . ALA C 1 559 ? -24.283 2.163 106.430 1.00 31.65 ? 559 ALA C CB 1 +ATOM 15965 N N . PRO C 1 560 ? -23.098 -0.626 104.300 1.00 35.48 ? 560 PRO C N 1 +ATOM 15966 C CA . PRO C 1 560 ? -21.969 -1.552 104.224 1.00 36.58 ? 560 PRO C CA 1 +ATOM 15967 C C . PRO C 1 560 ? -20.613 -0.876 104.361 1.00 37.55 ? 560 PRO C C 1 +ATOM 15968 O O . PRO C 1 560 ? -20.425 0.271 103.944 1.00 36.36 ? 560 PRO C O 1 +ATOM 15969 C CB . PRO C 1 560 ? -22.157 -2.214 102.859 1.00 35.76 ? 560 PRO C CB 1 +ATOM 15970 C CG . PRO C 1 560 ? -22.792 -1.119 102.051 1.00 35.86 ? 560 PRO C CG 1 +ATOM 15971 C CD . PRO C 1 560 ? -23.817 -0.560 103.016 1.00 35.56 ? 560 PRO C CD 1 +ATOM 15972 N N . ILE C 1 561 ? -19.674 -1.595 104.963 1.00 38.20 ? 561 ILE C N 1 +ATOM 15973 C CA . ILE C 1 561 ? -18.330 -1.083 105.142 1.00 40.02 ? 561 ILE C CA 1 +ATOM 15974 C C . ILE C 1 561 ? -17.573 -1.326 103.849 1.00 40.59 ? 561 ILE C C 1 +ATOM 15975 O O . ILE C 1 561 ? -17.277 -2.459 103.498 1.00 41.91 ? 561 ILE C O 1 +ATOM 15976 C CB . ILE C 1 561 ? -17.643 -1.782 106.318 1.00 40.51 ? 561 ILE C CB 1 +ATOM 15977 C CG1 . ILE C 1 561 ? -18.343 -1.362 107.616 1.00 43.20 ? 561 ILE C CG1 1 +ATOM 15978 C CG2 . ILE C 1 561 ? -16.166 -1.435 106.341 1.00 41.39 ? 561 ILE C CG2 1 +ATOM 15979 C CD1 . ILE C 1 561 ? -17.786 -1.995 108.867 1.00 45.51 ? 561 ILE C CD1 1 +ATOM 15980 N N . VAL C 1 562 ? -17.273 -0.249 103.136 1.00 41.99 ? 562 VAL C N 1 +ATOM 15981 C CA . VAL C 1 562 ? -16.586 -0.351 101.856 1.00 43.62 ? 562 VAL C CA 1 +ATOM 15982 C C . VAL C 1 562 ? -15.141 0.138 101.887 1.00 46.02 ? 562 VAL C C 1 +ATOM 15983 O O . VAL C 1 562 ? -14.644 0.691 100.910 1.00 45.07 ? 562 VAL C O 1 +ATOM 15984 C CB . VAL C 1 562 ? -17.367 0.419 100.757 1.00 41.96 ? 562 VAL C CB 1 +ATOM 15985 C CG1 . VAL C 1 562 ? -18.746 -0.189 100.591 1.00 41.42 ? 562 VAL C CG1 1 +ATOM 15986 C CG2 . VAL C 1 562 ? -17.496 1.886 101.122 1.00 37.77 ? 562 VAL C CG2 1 +ATOM 15987 N N . SER C 1 563 ? -14.474 -0.073 103.015 1.00 50.53 ? 563 SER C N 1 +ATOM 15988 C CA . SER C 1 563 ? -13.076 0.321 103.180 1.00 54.61 ? 563 SER C CA 1 +ATOM 15989 C C . SER C 1 563 ? -12.425 -0.659 104.145 1.00 57.24 ? 563 SER C C 1 +ATOM 15990 O O . SER C 1 563 ? -13.087 -1.556 104.672 1.00 58.09 ? 563 SER C O 1 +ATOM 15991 C CB . SER C 1 563 ? -12.970 1.738 103.748 1.00 54.83 ? 563 SER C CB 1 +ATOM 15992 O OG . SER C 1 563 ? -13.394 1.774 105.103 1.00 56.55 ? 563 SER C OG 1 +ATOM 15993 N N . LYS C 1 564 ? -11.131 -0.484 104.384 1.00 60.23 ? 564 LYS C N 1 +ATOM 15994 C CA . LYS C 1 564 ? -10.403 -1.366 105.286 1.00 62.21 ? 564 LYS C CA 1 +ATOM 15995 C C . LYS C 1 564 ? -10.674 -1.042 106.755 1.00 63.84 ? 564 LYS C C 1 +ATOM 15996 O O . LYS C 1 564 ? -10.373 -1.853 107.628 1.00 65.10 ? 564 LYS C O 1 +ATOM 15997 C CB . LYS C 1 564 ? -8.901 -1.285 105.008 1.00 62.83 ? 564 LYS C CB 1 +ATOM 15998 C CG . LYS C 1 564 ? -8.483 -1.763 103.619 1.00 64.22 ? 564 LYS C CG 1 +ATOM 15999 C CD . LYS C 1 564 ? -8.310 -0.613 102.607 1.00 65.63 ? 564 LYS C CD 1 +ATOM 16000 C CE . LYS C 1 564 ? -9.628 0.079 102.238 1.00 65.40 ? 564 LYS C CE 1 +ATOM 16001 N NZ . LYS C 1 564 ? -9.474 1.142 101.190 1.00 64.56 ? 564 LYS C NZ 1 +ATOM 16002 N N . GLU C 1 565 ? -11.244 0.135 107.024 1.00 64.53 ? 565 GLU C N 1 +ATOM 16003 C CA . GLU C 1 565 ? -11.558 0.551 108.390 1.00 65.28 ? 565 GLU C CA 1 +ATOM 16004 C C . GLU C 1 565 ? -12.387 -0.499 109.121 1.00 65.10 ? 565 GLU C C 1 +ATOM 16005 O O . GLU C 1 565 ? -12.938 -1.413 108.510 1.00 65.10 ? 565 GLU C O 1 +ATOM 16006 C CB . GLU C 1 565 ? -12.348 1.856 108.394 1.00 67.64 ? 565 GLU C CB 1 +ATOM 16007 C CG . GLU C 1 565 ? -11.635 3.073 107.845 1.00 71.36 ? 565 GLU C CG 1 +ATOM 16008 C CD . GLU C 1 565 ? -12.504 4.327 107.951 1.00 74.51 ? 565 GLU C CD 1 +ATOM 16009 O OE1 . GLU C 1 565 ? -13.623 4.331 107.379 1.00 75.03 ? 565 GLU C OE1 1 +ATOM 16010 O OE2 . GLU C 1 565 ? -12.072 5.303 108.613 1.00 75.25 ? 565 GLU C OE2 1 +ATOM 16011 N N . GLU C 1 566 ? -12.489 -0.345 110.437 1.00 65.02 ? 566 GLU C N 1 +ATOM 16012 C CA . GLU C 1 566 ? -13.250 -1.272 111.264 1.00 64.38 ? 566 GLU C CA 1 +ATOM 16013 C C . GLU C 1 566 ? -14.649 -0.711 111.506 1.00 61.62 ? 566 GLU C C 1 +ATOM 16014 O O . GLU C 1 566 ? -15.577 -1.440 111.857 1.00 61.35 ? 566 GLU C O 1 +ATOM 16015 C CB . GLU C 1 566 ? -12.524 -1.493 112.595 1.00 67.65 ? 566 GLU C CB 1 +ATOM 16016 C CG . GLU C 1 566 ? -13.098 -2.617 113.436 1.00 73.30 ? 566 GLU C CG 1 +ATOM 16017 C CD . GLU C 1 566 ? -12.196 -2.995 114.602 1.00 76.43 ? 566 GLU C CD 1 +ATOM 16018 O OE1 . GLU C 1 566 ? -11.928 -2.121 115.462 1.00 77.34 ? 566 GLU C OE1 1 +ATOM 16019 O OE2 . GLU C 1 566 ? -11.757 -4.170 114.653 1.00 77.42 ? 566 GLU C OE2 1 +ATOM 16020 N N . SER C 1 567 ? -14.783 0.597 111.317 1.00 58.01 ? 567 SER C N 1 +ATOM 16021 C CA . SER C 1 567 ? -16.061 1.279 111.487 1.00 54.42 ? 567 SER C CA 1 +ATOM 16022 C C . SER C 1 567 ? -16.136 2.393 110.456 1.00 50.61 ? 567 SER C C 1 +ATOM 16023 O O . SER C 1 567 ? -15.135 2.748 109.836 1.00 50.61 ? 567 SER C O 1 +ATOM 16024 C CB . SER C 1 567 ? -16.183 1.871 112.891 1.00 54.81 ? 567 SER C CB 1 +ATOM 16025 O OG . SER C 1 567 ? -15.276 2.942 113.060 1.00 57.38 ? 567 SER C OG 1 +ATOM 16026 N N . ARG C 1 568 ? -17.323 2.948 110.271 1.00 46.36 ? 568 ARG C N 1 +ATOM 16027 C CA . ARG C 1 568 ? -17.495 4.014 109.290 1.00 43.15 ? 568 ARG C CA 1 +ATOM 16028 C C . ARG C 1 568 ? -18.523 5.022 109.763 1.00 41.10 ? 568 ARG C C 1 +ATOM 16029 O O . ARG C 1 568 ? -19.229 4.803 110.745 1.00 41.22 ? 568 ARG C O 1 +ATOM 16030 C CB . ARG C 1 568 ? -17.974 3.432 107.963 1.00 40.81 ? 568 ARG C CB 1 +ATOM 16031 C CG . ARG C 1 568 ? -19.259 2.615 108.119 1.00 39.10 ? 568 ARG C CG 1 +ATOM 16032 C CD . ARG C 1 568 ? -19.979 2.433 106.814 1.00 35.31 ? 568 ARG C CD 1 +ATOM 16033 N NE . ARG C 1 568 ? -20.556 3.690 106.350 1.00 34.79 ? 568 ARG C NE 1 +ATOM 16034 C CZ . ARG C 1 568 ? -21.128 3.852 105.161 1.00 34.44 ? 568 ARG C CZ 1 +ATOM 16035 N NH1 . ARG C 1 568 ? -21.197 2.832 104.310 1.00 36.20 ? 568 ARG C NH1 1 +ATOM 16036 N NH2 . ARG C 1 568 ? -21.632 5.030 104.823 1.00 31.91 ? 568 ARG C NH2 1 +ATOM 16037 N N . LEU C 1 569 ? -18.598 6.139 109.060 1.00 39.58 ? 569 LEU C N 1 +ATOM 16038 C CA . LEU C 1 569 ? -19.578 7.152 109.390 1.00 39.06 ? 569 LEU C CA 1 +ATOM 16039 C C . LEU C 1 569 ? -20.842 6.765 108.637 1.00 37.79 ? 569 LEU C C 1 +ATOM 16040 O O . LEU C 1 569 ? -20.792 6.428 107.456 1.00 35.92 ? 569 LEU C O 1 +ATOM 16041 C CB . LEU C 1 569 ? -19.098 8.538 108.944 1.00 40.63 ? 569 LEU C CB 1 +ATOM 16042 C CG . LEU C 1 569 ? -17.919 9.132 109.724 1.00 41.99 ? 569 LEU C CG 1 +ATOM 16043 C CD1 . LEU C 1 569 ? -17.571 10.503 109.166 1.00 41.52 ? 569 LEU C CD1 1 +ATOM 16044 C CD2 . LEU C 1 569 ? -18.285 9.232 111.208 1.00 41.66 ? 569 LEU C CD2 1 +ATOM 16045 N N . VAL C 1 570 ? -21.971 6.794 109.331 1.00 37.12 ? 570 VAL C N 1 +ATOM 16046 C CA . VAL C 1 570 ? -23.251 6.448 108.732 1.00 35.63 ? 570 VAL C CA 1 +ATOM 16047 C C . VAL C 1 570 ? -24.168 7.658 108.762 1.00 36.49 ? 570 VAL C C 1 +ATOM 16048 O O . VAL C 1 570 ? -24.398 8.251 109.809 1.00 35.91 ? 570 VAL C O 1 +ATOM 16049 C CB . VAL C 1 570 ? -23.936 5.294 109.510 1.00 35.07 ? 570 VAL C CB 1 +ATOM 16050 C CG1 . VAL C 1 570 ? -25.315 5.017 108.945 1.00 31.43 ? 570 VAL C CG1 1 +ATOM 16051 C CG2 . VAL C 1 570 ? -23.081 4.052 109.443 1.00 33.89 ? 570 VAL C CG2 1 +ATOM 16052 N N . THR C 1 571 ? -24.691 8.027 107.605 1.00 38.13 ? 571 THR C N 1 +ATOM 16053 C CA . THR C 1 571 ? -25.598 9.161 107.527 1.00 38.87 ? 571 THR C CA 1 +ATOM 16054 C C . THR C 1 571 ? -27.012 8.622 107.643 1.00 39.55 ? 571 THR C C 1 +ATOM 16055 O O . THR C 1 571 ? -27.421 7.770 106.856 1.00 39.61 ? 571 THR C O 1 +ATOM 16056 C CB . THR C 1 571 ? -25.453 9.901 106.188 1.00 39.63 ? 571 THR C CB 1 +ATOM 16057 O OG1 . THR C 1 571 ? -24.141 10.468 106.096 1.00 39.41 ? 571 THR C OG1 1 +ATOM 16058 C CG2 . THR C 1 571 ? -26.491 11.006 106.072 1.00 39.63 ? 571 THR C CG2 1 +ATOM 16059 N N . LEU C 1 572 ? -27.747 9.103 108.639 1.00 39.82 ? 572 LEU C N 1 +ATOM 16060 C CA . LEU C 1 572 ? -29.117 8.669 108.854 1.00 39.68 ? 572 LEU C CA 1 +ATOM 16061 C C . LEU C 1 572 ? -30.089 9.742 108.395 1.00 41.56 ? 572 LEU C C 1 +ATOM 16062 O O . LEU C 1 572 ? -29.906 10.923 108.689 1.00 41.68 ? 572 LEU C O 1 +ATOM 16063 C CB . LEU C 1 572 ? -29.358 8.386 110.336 1.00 39.59 ? 572 LEU C CB 1 +ATOM 16064 C CG . LEU C 1 572 ? -28.530 7.278 110.998 1.00 40.21 ? 572 LEU C CG 1 +ATOM 16065 C CD1 . LEU C 1 572 ? -28.807 7.277 112.498 1.00 39.70 ? 572 LEU C CD1 1 +ATOM 16066 C CD2 . LEU C 1 572 ? -28.876 5.925 110.391 1.00 38.45 ? 572 LEU C CD2 1 +ATOM 16067 N N . PRO C 1 573 ? -31.127 9.348 107.644 1.00 42.23 ? 573 PRO C N 1 +ATOM 16068 C CA . PRO C 1 573 ? -32.129 10.302 107.158 1.00 41.98 ? 573 PRO C CA 1 +ATOM 16069 C C . PRO C 1 573 ? -33.013 10.756 108.312 1.00 42.25 ? 573 PRO C C 1 +ATOM 16070 O O . PRO C 1 573 ? -32.878 10.279 109.427 1.00 41.54 ? 573 PRO C O 1 +ATOM 16071 C CB . PRO C 1 573 ? -32.919 9.490 106.135 1.00 41.71 ? 573 PRO C CB 1 +ATOM 16072 C CG . PRO C 1 573 ? -31.939 8.472 105.671 1.00 43.42 ? 573 PRO C CG 1 +ATOM 16073 C CD . PRO C 1 573 ? -31.261 8.056 106.953 1.00 41.98 ? 573 PRO C CD 1 +ATOM 16074 N N . ARG C 1 574 ? -33.923 11.675 108.027 1.00 45.31 ? 574 ARG C N 1 +ATOM 16075 C CA . ARG C 1 574 ? -34.857 12.202 109.015 1.00 47.53 ? 574 ARG C CA 1 +ATOM 16076 C C . ARG C 1 574 ? -35.641 11.048 109.660 1.00 46.54 ? 574 ARG C C 1 +ATOM 16077 O O . ARG C 1 574 ? -35.914 10.039 109.015 1.00 45.88 ? 574 ARG C O 1 +ATOM 16078 C CB . ARG C 1 574 ? -35.811 13.177 108.311 1.00 52.43 ? 574 ARG C CB 1 +ATOM 16079 C CG . ARG C 1 574 ? -36.752 13.944 109.208 1.00 59.74 ? 574 ARG C CG 1 +ATOM 16080 C CD . ARG C 1 574 ? -37.513 14.998 108.404 1.00 65.48 ? 574 ARG C CD 1 +ATOM 16081 N NE . ARG C 1 574 ? -38.519 15.695 109.207 1.00 70.35 ? 574 ARG C NE 1 +ATOM 16082 C CZ . ARG C 1 574 ? -39.321 16.649 108.738 1.00 73.59 ? 574 ARG C CZ 1 +ATOM 16083 N NH1 . ARG C 1 574 ? -39.236 17.026 107.465 1.00 74.62 ? 574 ARG C NH1 1 +ATOM 16084 N NH2 . ARG C 1 574 ? -40.211 17.225 109.540 1.00 74.45 ? 574 ARG C NH2 1 +ATOM 16085 N N . GLY C 1 575 ? -35.992 11.196 110.934 1.00 45.72 ? 575 GLY C N 1 +ATOM 16086 C CA . GLY C 1 575 ? -36.744 10.159 111.621 1.00 44.30 ? 575 GLY C CA 1 +ATOM 16087 C C . GLY C 1 575 ? -35.897 9.410 112.632 1.00 45.18 ? 575 GLY C C 1 +ATOM 16088 O O . GLY C 1 575 ? -34.718 9.696 112.787 1.00 45.49 ? 575 GLY C O 1 +ATOM 16089 N N . LYS C 1 576 ? -36.485 8.450 113.334 1.00 45.32 ? 576 LYS C N 1 +ATOM 16090 C CA . LYS C 1 576 ? -35.724 7.682 114.314 1.00 44.76 ? 576 LYS C CA 1 +ATOM 16091 C C . LYS C 1 576 ? -35.240 6.361 113.729 1.00 43.12 ? 576 LYS C C 1 +ATOM 16092 O O . LYS C 1 576 ? -35.920 5.749 112.910 1.00 43.42 ? 576 LYS C O 1 +ATOM 16093 C CB . LYS C 1 576 ? -36.567 7.420 115.563 1.00 46.68 ? 576 LYS C CB 1 +ATOM 16094 C CG . LYS C 1 576 ? -36.759 8.651 116.429 1.00 50.87 ? 576 LYS C CG 1 +ATOM 16095 C CD . LYS C 1 576 ? -37.610 8.342 117.648 1.00 53.72 ? 576 LYS C CD 1 +ATOM 16096 C CE . LYS C 1 576 ? -37.665 9.536 118.590 1.00 56.38 ? 576 LYS C CE 1 +ATOM 16097 N NZ . LYS C 1 576 ? -38.557 9.268 119.761 1.00 58.81 ? 576 LYS C NZ 1 +ATOM 16098 N N . TRP C 1 577 ? -34.057 5.930 114.151 1.00 41.05 ? 577 TRP C N 1 +ATOM 16099 C CA . TRP C 1 577 ? -33.491 4.692 113.667 1.00 38.77 ? 577 TRP C CA 1 +ATOM 16100 C C . TRP C 1 577 ? -33.014 3.816 114.806 1.00 39.31 ? 577 TRP C C 1 +ATOM 16101 O O . TRP C 1 577 ? -32.410 4.292 115.762 1.00 38.59 ? 577 TRP C O 1 +ATOM 16102 C CB . TRP C 1 577 ? -32.342 4.978 112.705 1.00 39.51 ? 577 TRP C CB 1 +ATOM 16103 C CG . TRP C 1 577 ? -32.776 5.779 111.532 1.00 38.09 ? 577 TRP C CG 1 +ATOM 16104 C CD1 . TRP C 1 577 ? -32.899 7.137 111.467 1.00 38.81 ? 577 TRP C CD1 1 +ATOM 16105 C CD2 . TRP C 1 577 ? -33.232 5.273 110.274 1.00 38.11 ? 577 TRP C CD2 1 +ATOM 16106 N NE1 . TRP C 1 577 ? -33.408 7.510 110.246 1.00 38.41 ? 577 TRP C NE1 1 +ATOM 16107 C CE2 . TRP C 1 577 ? -33.622 6.386 109.493 1.00 37.86 ? 577 TRP C CE2 1 +ATOM 16108 C CE3 . TRP C 1 577 ? -33.350 3.987 109.728 1.00 37.60 ? 577 TRP C CE3 1 +ATOM 16109 C CZ2 . TRP C 1 577 ? -34.124 6.252 108.192 1.00 37.24 ? 577 TRP C CZ2 1 +ATOM 16110 C CZ3 . TRP C 1 577 ? -33.850 3.854 108.428 1.00 37.12 ? 577 TRP C CZ3 1 +ATOM 16111 C CH2 . TRP C 1 577 ? -34.230 4.983 107.679 1.00 36.84 ? 577 TRP C CH2 1 +ATOM 16112 N N . TYR C 1 578 ? -33.292 2.524 114.679 1.00 39.49 ? 578 TYR C N 1 +ATOM 16113 C CA . TYR C 1 578 ? -32.940 1.522 115.671 1.00 39.02 ? 578 TYR C CA 1 +ATOM 16114 C C . TYR C 1 578 ? -31.717 0.730 115.205 1.00 40.20 ? 578 TYR C C 1 +ATOM 16115 O O . TYR C 1 578 ? -31.735 0.142 114.121 1.00 40.37 ? 578 TYR C O 1 +ATOM 16116 C CB . TYR C 1 578 ? -34.147 0.602 115.854 1.00 39.90 ? 578 TYR C CB 1 +ATOM 16117 C CG . TYR C 1 578 ? -33.908 -0.643 116.664 1.00 40.39 ? 578 TYR C CG 1 +ATOM 16118 C CD1 . TYR C 1 578 ? -33.815 -0.593 118.057 1.00 41.32 ? 578 TYR C CD1 1 +ATOM 16119 C CD2 . TYR C 1 578 ? -33.803 -1.880 116.039 1.00 39.83 ? 578 TYR C CD2 1 +ATOM 16120 C CE1 . TYR C 1 578 ? -33.627 -1.762 118.804 1.00 41.95 ? 578 TYR C CE1 1 +ATOM 16121 C CE2 . TYR C 1 578 ? -33.614 -3.041 116.770 1.00 41.44 ? 578 TYR C CE2 1 +ATOM 16122 C CZ . TYR C 1 578 ? -33.529 -2.977 118.148 1.00 41.58 ? 578 TYR C CZ 1 +ATOM 16123 O OH . TYR C 1 578 ? -33.355 -4.133 118.861 1.00 45.27 ? 578 TYR C OH 1 +ATOM 16124 N N . ASN C 1 579 ? -30.650 0.740 116.011 1.00 41.25 ? 579 ASN C N 1 +ATOM 16125 C CA . ASN C 1 579 ? -29.414 0.013 115.689 1.00 41.73 ? 579 ASN C CA 1 +ATOM 16126 C C . ASN C 1 579 ? -29.662 -1.466 115.946 1.00 43.38 ? 579 ASN C C 1 +ATOM 16127 O O . ASN C 1 579 ? -29.739 -1.908 117.094 1.00 43.61 ? 579 ASN C O 1 +ATOM 16128 C CB . ASN C 1 579 ? -28.248 0.497 116.559 1.00 41.83 ? 579 ASN C CB 1 +ATOM 16129 C CG . ASN C 1 579 ? -26.933 -0.213 116.238 1.00 42.50 ? 579 ASN C CG 1 +ATOM 16130 O OD1 . ASN C 1 579 ? -26.875 -1.442 116.169 1.00 43.25 ? 579 ASN C OD1 1 +ATOM 16131 N ND2 . ASN C 1 579 ? -25.868 0.561 116.053 1.00 42.82 ? 579 ASN C ND2 1 +ATOM 16132 N N . TYR C 1 580 ? -29.787 -2.225 114.862 1.00 44.39 ? 580 TYR C N 1 +ATOM 16133 C CA . TYR C 1 580 ? -30.063 -3.656 114.918 1.00 44.45 ? 580 TYR C CA 1 +ATOM 16134 C C . TYR C 1 580 ? -29.229 -4.456 115.915 1.00 45.30 ? 580 TYR C C 1 +ATOM 16135 O O . TYR C 1 580 ? -29.766 -5.274 116.661 1.00 45.74 ? 580 TYR C O 1 +ATOM 16136 C CB . TYR C 1 580 ? -29.877 -4.266 113.526 1.00 43.57 ? 580 TYR C CB 1 +ATOM 16137 C CG . TYR C 1 580 ? -30.196 -5.742 113.449 1.00 42.16 ? 580 TYR C CG 1 +ATOM 16138 C CD1 . TYR C 1 580 ? -31.508 -6.195 113.526 1.00 41.06 ? 580 TYR C CD1 1 +ATOM 16139 C CD2 . TYR C 1 580 ? -29.180 -6.687 113.297 1.00 43.20 ? 580 TYR C CD2 1 +ATOM 16140 C CE1 . TYR C 1 580 ? -31.809 -7.550 113.449 1.00 40.84 ? 580 TYR C CE1 1 +ATOM 16141 C CE2 . TYR C 1 580 ? -29.470 -8.046 113.221 1.00 43.00 ? 580 TYR C CE2 1 +ATOM 16142 C CZ . TYR C 1 580 ? -30.790 -8.465 113.296 1.00 41.95 ? 580 TYR C CZ 1 +ATOM 16143 O OH . TYR C 1 580 ? -31.088 -9.805 113.204 1.00 44.47 ? 580 TYR C OH 1 +ATOM 16144 N N . TRP C 1 581 ? -27.919 -4.224 115.916 1.00 46.31 ? 581 TRP C N 1 +ATOM 16145 C CA . TRP C 1 581 ? -27.006 -4.962 116.780 1.00 46.98 ? 581 TRP C CA 1 +ATOM 16146 C C . TRP C 1 581 ? -26.903 -4.575 118.257 1.00 47.82 ? 581 TRP C C 1 +ATOM 16147 O O . TRP C 1 581 ? -26.710 -5.459 119.089 1.00 49.04 ? 581 TRP C O 1 +ATOM 16148 C CB . TRP C 1 581 ? -25.606 -4.965 116.169 1.00 46.74 ? 581 TRP C CB 1 +ATOM 16149 C CG . TRP C 1 581 ? -25.563 -5.563 114.804 1.00 46.07 ? 581 TRP C CG 1 +ATOM 16150 C CD1 . TRP C 1 581 ? -25.467 -4.895 113.619 1.00 46.05 ? 581 TRP C CD1 1 +ATOM 16151 C CD2 . TRP C 1 581 ? -25.609 -6.956 114.477 1.00 46.28 ? 581 TRP C CD2 1 +ATOM 16152 N NE1 . TRP C 1 581 ? -25.443 -5.785 112.572 1.00 45.87 ? 581 TRP C NE1 1 +ATOM 16153 C CE2 . TRP C 1 581 ? -25.531 -7.058 113.069 1.00 44.99 ? 581 TRP C CE2 1 +ATOM 16154 C CE3 . TRP C 1 581 ? -25.709 -8.130 115.236 1.00 46.50 ? 581 TRP C CE3 1 +ATOM 16155 C CZ2 . TRP C 1 581 ? -25.553 -8.284 112.404 1.00 43.84 ? 581 TRP C CZ2 1 +ATOM 16156 C CZ3 . TRP C 1 581 ? -25.731 -9.355 114.571 1.00 46.64 ? 581 TRP C CZ3 1 +ATOM 16157 C CH2 . TRP C 1 581 ? -25.653 -9.417 113.166 1.00 45.33 ? 581 TRP C CH2 1 +ATOM 16158 N N . ASN C 1 582 ? -27.009 -3.291 118.604 1.00 47.65 ? 582 ASN C N 1 +ATOM 16159 C CA . ASN C 1 582 ? -26.916 -2.929 120.021 1.00 48.05 ? 582 ASN C CA 1 +ATOM 16160 C C . ASN C 1 582 ? -28.160 -2.272 120.602 1.00 48.22 ? 582 ASN C C 1 +ATOM 16161 O O . ASN C 1 582 ? -28.174 -1.908 121.778 1.00 48.86 ? 582 ASN C O 1 +ATOM 16162 C CB . ASN C 1 582 ? -25.687 -2.049 120.310 1.00 47.01 ? 582 ASN C CB 1 +ATOM 16163 C CG . ASN C 1 582 ? -25.799 -0.656 119.717 1.00 47.61 ? 582 ASN C CG 1 +ATOM 16164 O OD1 . ASN C 1 582 ? -26.891 -0.113 119.561 1.00 48.50 ? 582 ASN C OD1 1 +ATOM 16165 N ND2 . ASN C 1 582 ? -24.656 -0.059 119.404 1.00 48.11 ? 582 ASN C ND2 1 +ATOM 16166 N N . GLY C 1 583 ? -29.196 -2.110 119.784 1.00 48.17 ? 583 GLY C N 1 +ATOM 16167 C CA . GLY C 1 583 ? -30.439 -1.532 120.268 1.00 48.46 ? 583 GLY C CA 1 +ATOM 16168 C C . GLY C 1 583 ? -30.553 -0.025 120.450 1.00 49.31 ? 583 GLY C C 1 +ATOM 16169 O O . GLY C 1 583 ? -31.624 0.474 120.808 1.00 49.03 ? 583 GLY C O 1 +ATOM 16170 N N . GLU C 1 584 ? -29.474 0.712 120.212 1.00 50.55 ? 584 GLU C N 1 +ATOM 16171 C CA . GLU C 1 584 ? -29.515 2.165 120.368 1.00 51.28 ? 584 GLU C CA 1 +ATOM 16172 C C . GLU C 1 584 ? -30.411 2.827 119.328 1.00 51.16 ? 584 GLU C C 1 +ATOM 16173 O O . GLU C 1 584 ? -30.383 2.469 118.151 1.00 50.67 ? 584 GLU C O 1 +ATOM 16174 C CB . GLU C 1 584 ? -28.105 2.756 120.260 1.00 52.83 ? 584 GLU C CB 1 +ATOM 16175 C CG . GLU C 1 584 ? -28.092 4.277 120.140 1.00 57.50 ? 584 GLU C CG 1 +ATOM 16176 C CD . GLU C 1 584 ? -26.690 4.875 120.180 1.00 59.71 ? 584 GLU C CD 1 +ATOM 16177 O OE1 . GLU C 1 584 ? -25.828 4.438 119.383 1.00 60.84 ? 584 GLU C OE1 1 +ATOM 16178 O OE2 . GLU C 1 584 ? -26.456 5.794 121.005 1.00 59.85 ? 584 GLU C OE2 1 +ATOM 16179 N N . ILE C 1 585 ? -31.210 3.790 119.771 1.00 51.14 ? 585 ILE C N 1 +ATOM 16180 C CA . ILE C 1 585 ? -32.083 4.527 118.869 1.00 51.09 ? 585 ILE C CA 1 +ATOM 16181 C C . ILE C 1 585 ? -31.488 5.926 118.660 1.00 51.98 ? 585 ILE C C 1 +ATOM 16182 O O . ILE C 1 585 ? -31.218 6.656 119.613 1.00 52.36 ? 585 ILE C O 1 +ATOM 16183 C CB . ILE C 1 585 ? -33.525 4.622 119.428 1.00 49.84 ? 585 ILE C CB 1 +ATOM 16184 C CG1 . ILE C 1 585 ? -34.178 3.240 119.378 1.00 49.65 ? 585 ILE C CG1 1 +ATOM 16185 C CG2 . ILE C 1 585 ? -34.351 5.614 118.617 1.00 48.17 ? 585 ILE C CG2 1 +ATOM 16186 C CD1 . ILE C 1 585 ? -35.596 3.209 119.905 1.00 48.78 ? 585 ILE C CD1 1 +ATOM 16187 N N . ILE C 1 586 ? -31.266 6.278 117.402 1.00 52.98 ? 586 ILE C N 1 +ATOM 16188 C CA . ILE C 1 586 ? -30.687 7.564 117.047 1.00 53.51 ? 586 ILE C CA 1 +ATOM 16189 C C . ILE C 1 586 ? -31.707 8.405 116.306 1.00 54.17 ? 586 ILE C C 1 +ATOM 16190 O O . ILE C 1 586 ? -32.525 7.886 115.551 1.00 53.56 ? 586 ILE C O 1 +ATOM 16191 C CB . ILE C 1 586 ? -29.460 7.388 116.111 1.00 55.00 ? 586 ILE C CB 1 +ATOM 16192 C CG1 . ILE C 1 586 ? -28.428 6.447 116.747 1.00 56.18 ? 586 ILE C CG1 1 +ATOM 16193 C CG2 . ILE C 1 586 ? -28.843 8.743 115.799 1.00 53.51 ? 586 ILE C CG2 1 +ATOM 16194 C CD1 . ILE C 1 586 ? -27.751 7.002 117.995 1.00 57.14 ? 586 ILE C CD1 1 +ATOM 16195 N N . ASN C 1 587 ? -31.661 9.709 116.538 1.00 55.75 ? 587 ASN C N 1 +ATOM 16196 C CA . ASN C 1 587 ? -32.551 10.633 115.859 1.00 56.64 ? 587 ASN C CA 1 +ATOM 16197 C C . ASN C 1 587 ? -31.986 10.970 114.496 1.00 56.98 ? 587 ASN C C 1 +ATOM 16198 O O . ASN C 1 587 ? -30.805 11.287 114.353 1.00 57.15 ? 587 ASN C O 1 +ATOM 16199 C CB . ASN C 1 587 ? -32.731 11.902 116.673 1.00 58.48 ? 587 ASN C CB 1 +ATOM 16200 C CG . ASN C 1 587 ? -33.822 11.768 117.703 1.00 61.13 ? 587 ASN C CG 1 +ATOM 16201 O OD1 . ASN C 1 587 ? -34.992 11.558 117.358 1.00 62.15 ? 587 ASN C OD1 1 +ATOM 16202 N ND2 . ASN C 1 587 ? -33.454 11.878 118.980 1.00 62.17 ? 587 ASN C ND2 1 +ATOM 16203 N N . GLY C 1 588 ? -32.858 10.899 113.500 1.00 57.75 ? 588 GLY C N 1 +ATOM 16204 C CA . GLY C 1 588 ? -32.475 11.158 112.129 1.00 57.88 ? 588 GLY C CA 1 +ATOM 16205 C C . GLY C 1 588 ? -31.878 12.506 111.803 1.00 57.95 ? 588 GLY C C 1 +ATOM 16206 O O . GLY C 1 588 ? -31.957 13.466 112.571 1.00 58.50 ? 588 GLY C O 1 +ATOM 16207 N N . LYS C 1 589 ? -31.289 12.559 110.616 1.00 57.64 ? 589 LYS C N 1 +ATOM 16208 C CA . LYS C 1 589 ? -30.646 13.750 110.114 1.00 55.65 ? 589 LYS C CA 1 +ATOM 16209 C C . LYS C 1 589 ? -29.443 13.964 111.004 1.00 53.74 ? 589 LYS C C 1 +ATOM 16210 O O . LYS C 1 589 ? -29.337 14.960 111.713 1.00 53.98 ? 589 LYS C O 1 +ATOM 16211 C CB . LYS C 1 589 ? -31.608 14.940 110.170 1.00 58.28 ? 589 LYS C CB 1 +ATOM 16212 C CG . LYS C 1 589 ? -31.228 16.073 109.234 1.00 60.29 ? 589 LYS C CG 1 +ATOM 16213 C CD . LYS C 1 589 ? -31.032 15.565 107.812 1.00 61.21 ? 589 LYS C CD 1 +ATOM 16214 C CE . LYS C 1 589 ? -30.494 16.661 106.906 1.00 63.15 ? 589 LYS C CE 1 +ATOM 16215 N NZ . LYS C 1 589 ? -30.064 16.111 105.595 1.00 64.00 ? 589 LYS C NZ 1 +ATOM 16216 N N . SER C 1 590 ? -28.545 12.986 110.975 1.00 50.98 ? 590 SER C N 1 +ATOM 16217 C CA . SER C 1 590 ? -27.326 13.043 111.759 1.00 48.96 ? 590 SER C CA 1 +ATOM 16218 C C . SER C 1 590 ? -26.330 12.048 111.197 1.00 47.46 ? 590 SER C C 1 +ATOM 16219 O O . SER C 1 590 ? -26.672 11.233 110.348 1.00 45.83 ? 590 SER C O 1 +ATOM 16220 C CB . SER C 1 590 ? -27.610 12.704 113.226 1.00 48.97 ? 590 SER C CB 1 +ATOM 16221 O OG . SER C 1 590 ? -28.064 11.372 113.359 1.00 49.72 ? 590 SER C OG 1 +ATOM 16222 N N . VAL C 1 591 ? -25.097 12.129 111.679 1.00 46.24 ? 591 VAL C N 1 +ATOM 16223 C CA . VAL C 1 591 ? -24.047 11.231 111.247 1.00 45.71 ? 591 VAL C CA 1 +ATOM 16224 C C . VAL C 1 591 ? -23.525 10.509 112.479 1.00 46.05 ? 591 VAL C C 1 +ATOM 16225 O O . VAL C 1 591 ? -23.181 11.142 113.478 1.00 46.58 ? 591 VAL C O 1 +ATOM 16226 C CB . VAL C 1 591 ? -22.897 12.003 110.569 1.00 45.53 ? 591 VAL C CB 1 +ATOM 16227 C CG1 . VAL C 1 591 ? -21.752 11.053 110.243 1.00 46.69 ? 591 VAL C CG1 1 +ATOM 16228 C CG2 . VAL C 1 591 ? -23.398 12.658 109.292 1.00 43.74 ? 591 VAL C CG2 1 +ATOM 16229 N N . VAL C 1 592 ? -23.489 9.183 112.418 1.00 45.75 ? 592 VAL C N 1 +ATOM 16230 C CA . VAL C 1 592 ? -23.010 8.386 113.541 1.00 45.22 ? 592 VAL C CA 1 +ATOM 16231 C C . VAL C 1 592 ? -21.969 7.373 113.089 1.00 45.59 ? 592 VAL C C 1 +ATOM 16232 O O . VAL C 1 592 ? -21.834 7.080 111.901 1.00 45.52 ? 592 VAL C O 1 +ATOM 16233 C CB . VAL C 1 592 ? -24.166 7.628 114.227 1.00 44.11 ? 592 VAL C CB 1 +ATOM 16234 C CG1 . VAL C 1 592 ? -25.231 8.607 114.670 1.00 44.44 ? 592 VAL C CG1 1 +ATOM 16235 C CG2 . VAL C 1 592 ? -24.756 6.593 113.277 1.00 43.71 ? 592 VAL C CG2 1 +ATOM 16236 N N . LYS C 1 593 ? -21.234 6.836 114.050 1.00 46.74 ? 593 LYS C N 1 +ATOM 16237 C CA . LYS C 1 593 ? -20.206 5.851 113.767 1.00 48.40 ? 593 LYS C CA 1 +ATOM 16238 C C . LYS C 1 593 ? -20.832 4.459 113.898 1.00 48.22 ? 593 LYS C C 1 +ATOM 16239 O O . LYS C 1 593 ? -21.640 4.220 114.799 1.00 47.93 ? 593 LYS C O 1 +ATOM 16240 C CB . LYS C 1 593 ? -19.062 6.033 114.765 1.00 50.91 ? 593 LYS C CB 1 +ATOM 16241 C CG . LYS C 1 593 ? -17.820 5.206 114.502 1.00 56.15 ? 593 LYS C CG 1 +ATOM 16242 C CD . LYS C 1 593 ? -16.779 5.466 115.593 1.00 59.95 ? 593 LYS C CD 1 +ATOM 16243 C CE . LYS C 1 593 ? -15.534 4.601 115.421 1.00 63.15 ? 593 LYS C CE 1 +ATOM 16244 N NZ . LYS C 1 593 ? -14.529 4.842 116.505 1.00 65.06 ? 593 LYS C NZ 1 +ATOM 16245 N N . SER C 1 594 ? -20.480 3.552 112.991 1.00 48.00 ? 594 SER C N 1 +ATOM 16246 C CA . SER C 1 594 ? -21.006 2.188 113.030 1.00 48.09 ? 594 SER C CA 1 +ATOM 16247 C C . SER C 1 594 ? -20.546 1.485 114.311 1.00 48.67 ? 594 SER C C 1 +ATOM 16248 O O . SER C 1 594 ? -19.567 1.895 114.929 1.00 47.72 ? 594 SER C O 1 +ATOM 16249 C CB . SER C 1 594 ? -20.545 1.408 111.796 1.00 47.67 ? 594 SER C CB 1 +ATOM 16250 O OG . SER C 1 594 ? -19.157 1.586 111.565 1.00 48.89 ? 594 SER C OG 1 +ATOM 16251 N N . THR C 1 595 ? -21.249 0.424 114.695 1.00 49.14 ? 595 THR C N 1 +ATOM 16252 C CA . THR C 1 595 ? -20.939 -0.307 115.918 1.00 49.62 ? 595 THR C CA 1 +ATOM 16253 C C . THR C 1 595 ? -20.686 -1.794 115.695 1.00 50.85 ? 595 THR C C 1 +ATOM 16254 O O . THR C 1 595 ? -20.187 -2.484 116.588 1.00 50.37 ? 595 THR C O 1 +ATOM 16255 C CB . THR C 1 595 ? -22.097 -0.178 116.923 1.00 50.29 ? 595 THR C CB 1 +ATOM 16256 O OG1 . THR C 1 595 ? -23.255 -0.861 116.417 1.00 50.13 ? 595 THR C OG1 1 +ATOM 16257 C CG2 . THR C 1 595 ? -22.456 1.279 117.124 1.00 50.78 ? 595 THR C CG2 1 +ATOM 16258 N N . HIS C 1 596 ? -21.048 -2.277 114.508 1.00 51.85 ? 596 HIS C N 1 +ATOM 16259 C CA . HIS C 1 596 ? -20.904 -3.687 114.126 1.00 51.53 ? 596 HIS C CA 1 +ATOM 16260 C C . HIS C 1 596 ? -20.267 -3.732 112.730 1.00 51.68 ? 596 HIS C C 1 +ATOM 16261 O O . HIS C 1 596 ? -20.166 -2.696 112.068 1.00 50.63 ? 596 HIS C O 1 +ATOM 16262 C CB . HIS C 1 596 ? -22.298 -4.341 114.093 1.00 50.87 ? 596 HIS C CB 1 +ATOM 16263 C CG . HIS C 1 596 ? -22.287 -5.824 113.848 1.00 53.02 ? 596 HIS C CG 1 +ATOM 16264 N ND1 . HIS C 1 596 ? -22.469 -6.750 114.856 1.00 52.62 ? 596 HIS C ND1 1 +ATOM 16265 C CD2 . HIS C 1 596 ? -22.146 -6.540 112.706 1.00 52.20 ? 596 HIS C CD2 1 +ATOM 16266 C CE1 . HIS C 1 596 ? -22.441 -7.969 114.347 1.00 51.79 ? 596 HIS C CE1 1 +ATOM 16267 N NE2 . HIS C 1 596 ? -22.247 -7.870 113.043 1.00 52.85 ? 596 HIS C NE2 1 +ATOM 16268 N N . GLU C 1 597 ? -19.838 -4.917 112.291 1.00 51.76 ? 597 GLU C N 1 +ATOM 16269 C CA . GLU C 1 597 ? -19.234 -5.078 110.966 1.00 52.29 ? 597 GLU C CA 1 +ATOM 16270 C C . GLU C 1 597 ? -20.286 -4.912 109.871 1.00 50.20 ? 597 GLU C C 1 +ATOM 16271 O O . GLU C 1 597 ? -19.962 -4.553 108.739 1.00 50.77 ? 597 GLU C O 1 +ATOM 16272 C CB . GLU C 1 597 ? -18.581 -6.456 110.821 1.00 56.08 ? 597 GLU C CB 1 +ATOM 16273 C CG . GLU C 1 597 ? -17.381 -6.690 111.729 1.00 62.63 ? 597 GLU C CG 1 +ATOM 16274 C CD . GLU C 1 597 ? -16.723 -8.053 111.496 1.00 67.27 ? 597 GLU C CD 1 +ATOM 16275 O OE1 . GLU C 1 597 ? -16.103 -8.244 110.420 1.00 69.94 ? 597 GLU C OE1 1 +ATOM 16276 O OE2 . GLU C 1 597 ? -16.830 -8.934 112.385 1.00 67.75 ? 597 GLU C OE2 1 +ATOM 16277 N N . LEU C 1 598 ? -21.542 -5.182 110.215 1.00 47.41 ? 598 LEU C N 1 +ATOM 16278 C CA . LEU C 1 598 ? -22.652 -5.055 109.273 1.00 44.54 ? 598 LEU C CA 1 +ATOM 16279 C C . LEU C 1 598 ? -23.639 -4.031 109.836 1.00 43.25 ? 598 LEU C C 1 +ATOM 16280 O O . LEU C 1 598 ? -24.587 -4.401 110.541 1.00 42.89 ? 598 LEU C O 1 +ATOM 16281 C CB . LEU C 1 598 ? -23.358 -6.406 109.100 1.00 44.05 ? 598 LEU C CB 1 +ATOM 16282 C CG . LEU C 1 598 ? -22.485 -7.620 108.755 1.00 42.77 ? 598 LEU C CG 1 +ATOM 16283 C CD1 . LEU C 1 598 ? -23.347 -8.864 108.760 1.00 42.03 ? 598 LEU C CD1 1 +ATOM 16284 C CD2 . LEU C 1 598 ? -21.820 -7.435 107.405 1.00 42.24 ? 598 LEU C CD2 1 +ATOM 16285 N N . PRO C 1 599 ? -23.430 -2.732 109.527 1.00 41.26 ? 599 PRO C N 1 +ATOM 16286 C CA . PRO C 1 599 ? -24.266 -1.601 109.979 1.00 39.00 ? 599 PRO C CA 1 +ATOM 16287 C C . PRO C 1 599 ? -25.711 -1.613 109.477 1.00 37.60 ? 599 PRO C C 1 +ATOM 16288 O O . PRO C 1 599 ? -26.000 -1.108 108.398 1.00 37.84 ? 599 PRO C O 1 +ATOM 16289 C CB . PRO C 1 599 ? -23.500 -0.377 109.473 1.00 38.93 ? 599 PRO C CB 1 +ATOM 16290 C CG . PRO C 1 599 ? -22.077 -0.867 109.354 1.00 39.21 ? 599 PRO C CG 1 +ATOM 16291 C CD . PRO C 1 599 ? -22.271 -2.241 108.764 1.00 39.79 ? 599 PRO C CD 1 +ATOM 16292 N N . ILE C 1 600 ? -26.613 -2.174 110.274 1.00 36.41 ? 600 ILE C N 1 +ATOM 16293 C CA . ILE C 1 600 ? -28.024 -2.270 109.912 1.00 36.35 ? 600 ILE C CA 1 +ATOM 16294 C C . ILE C 1 600 ? -28.890 -1.453 110.871 1.00 38.35 ? 600 ILE C C 1 +ATOM 16295 O O . ILE C 1 600 ? -28.731 -1.542 112.095 1.00 39.31 ? 600 ILE C O 1 +ATOM 16296 C CB . ILE C 1 600 ? -28.490 -3.736 109.959 1.00 36.25 ? 600 ILE C CB 1 +ATOM 16297 C CG1 . ILE C 1 600 ? -27.710 -4.554 108.932 1.00 35.41 ? 600 ILE C CG1 1 +ATOM 16298 C CG2 . ILE C 1 600 ? -29.982 -3.825 109.720 1.00 34.45 ? 600 ILE C CG2 1 +ATOM 16299 C CD1 . ILE C 1 600 ? -27.841 -6.040 109.121 1.00 36.89 ? 600 ILE C CD1 1 +ATOM 16300 N N . TYR C 1 601 ? -29.810 -0.664 110.319 1.00 37.78 ? 601 TYR C N 1 +ATOM 16301 C CA . TYR C 1 601 ? -30.689 0.162 111.135 1.00 37.40 ? 601 TYR C CA 1 +ATOM 16302 C C . TYR C 1 601 ? -32.141 0.021 110.699 1.00 38.23 ? 601 TYR C C 1 +ATOM 16303 O O . TYR C 1 601 ? -32.441 0.013 109.508 1.00 38.72 ? 601 TYR C O 1 +ATOM 16304 C CB . TYR C 1 601 ? -30.283 1.634 111.039 1.00 36.60 ? 601 TYR C CB 1 +ATOM 16305 C CG . TYR C 1 601 ? -28.863 1.914 111.440 1.00 36.08 ? 601 TYR C CG 1 +ATOM 16306 C CD1 . TYR C 1 601 ? -27.809 1.645 110.571 1.00 36.60 ? 601 TYR C CD1 1 +ATOM 16307 C CD2 . TYR C 1 601 ? -28.567 2.423 112.702 1.00 37.12 ? 601 TYR C CD2 1 +ATOM 16308 C CE1 . TYR C 1 601 ? -26.488 1.872 110.949 1.00 38.77 ? 601 TYR C CE1 1 +ATOM 16309 C CE2 . TYR C 1 601 ? -27.247 2.659 113.097 1.00 38.44 ? 601 TYR C CE2 1 +ATOM 16310 C CZ . TYR C 1 601 ? -26.214 2.377 112.219 1.00 39.16 ? 601 TYR C CZ 1 +ATOM 16311 O OH . TYR C 1 601 ? -24.911 2.565 112.617 1.00 40.08 ? 601 TYR C OH 1 +ATOM 16312 N N . LEU C 1 602 ? -33.042 -0.086 111.667 1.00 39.01 ? 602 LEU C N 1 +ATOM 16313 C CA . LEU C 1 602 ? -34.457 -0.219 111.361 1.00 40.55 ? 602 LEU C CA 1 +ATOM 16314 C C . LEU C 1 602 ? -35.143 1.108 111.591 1.00 41.55 ? 602 LEU C C 1 +ATOM 16315 O O . LEU C 1 602 ? -34.937 1.760 112.609 1.00 42.61 ? 602 LEU C O 1 +ATOM 16316 C CB . LEU C 1 602 ? -35.110 -1.289 112.239 1.00 40.68 ? 602 LEU C CB 1 +ATOM 16317 C CG . LEU C 1 602 ? -34.506 -2.687 112.127 1.00 41.22 ? 602 LEU C CG 1 +ATOM 16318 C CD1 . LEU C 1 602 ? -35.391 -3.675 112.882 1.00 41.88 ? 602 LEU C CD1 1 +ATOM 16319 C CD2 . LEU C 1 602 ? -34.388 -3.083 110.655 1.00 42.34 ? 602 LEU C CD2 1 +ATOM 16320 N N . ARG C 1 603 ? -35.974 1.486 110.633 1.00 42.50 ? 603 ARG C N 1 +ATOM 16321 C CA . ARG C 1 603 ? -36.717 2.738 110.660 1.00 43.12 ? 603 ARG C CA 1 +ATOM 16322 C C . ARG C 1 603 ? -37.909 2.630 111.614 1.00 43.81 ? 603 ARG C C 1 +ATOM 16323 O O . ARG C 1 603 ? -38.525 1.574 111.709 1.00 43.65 ? 603 ARG C O 1 +ATOM 16324 C CB . ARG C 1 603 ? -37.193 3.015 109.235 1.00 43.94 ? 603 ARG C CB 1 +ATOM 16325 C CG . ARG C 1 603 ? -37.859 4.334 108.986 1.00 41.85 ? 603 ARG C CG 1 +ATOM 16326 C CD . ARG C 1 603 ? -38.356 4.329 107.558 1.00 42.79 ? 603 ARG C CD 1 +ATOM 16327 N NE . ARG C 1 603 ? -38.870 5.621 107.127 1.00 43.35 ? 603 ARG C NE 1 +ATOM 16328 C CZ . ARG C 1 603 ? -39.237 5.888 105.880 1.00 42.32 ? 603 ARG C CZ 1 +ATOM 16329 N NH1 . ARG C 1 603 ? -39.148 4.948 104.948 1.00 41.39 ? 603 ARG C NH1 1 +ATOM 16330 N NH2 . ARG C 1 603 ? -39.677 7.099 105.564 1.00 42.35 ? 603 ARG C NH2 1 +ATOM 16331 N N . GLU C 1 604 ? -38.229 3.703 112.340 1.00 45.14 ? 604 GLU C N 1 +ATOM 16332 C CA . GLU C 1 604 ? -39.374 3.657 113.250 1.00 46.54 ? 604 GLU C CA 1 +ATOM 16333 C C . GLU C 1 604 ? -40.618 3.479 112.377 1.00 45.98 ? 604 GLU C C 1 +ATOM 16334 O O . GLU C 1 604 ? -40.952 4.343 111.573 1.00 44.97 ? 604 GLU C O 1 +ATOM 16335 C CB . GLU C 1 604 ? -39.472 4.942 114.076 1.00 48.33 ? 604 GLU C CB 1 +ATOM 16336 C CG . GLU C 1 604 ? -40.582 4.912 115.121 1.00 52.34 ? 604 GLU C CG 1 +ATOM 16337 C CD . GLU C 1 604 ? -40.590 6.148 116.010 1.00 56.15 ? 604 GLU C CD 1 +ATOM 16338 O OE1 . GLU C 1 604 ? -40.705 7.274 115.468 1.00 56.93 ? 604 GLU C OE1 1 +ATOM 16339 O OE2 . GLU C 1 604 ? -40.480 5.995 117.252 1.00 57.96 ? 604 GLU C OE2 1 +ATOM 16340 N N . GLY C 1 605 ? -41.288 2.343 112.546 1.00 45.63 ? 605 GLY C N 1 +ATOM 16341 C CA . GLY C 1 605 ? -42.450 2.024 111.739 1.00 45.28 ? 605 GLY C CA 1 +ATOM 16342 C C . GLY C 1 605 ? -42.004 0.910 110.805 1.00 45.38 ? 605 GLY C C 1 +ATOM 16343 O O . GLY C 1 605 ? -42.065 1.049 109.580 1.00 44.76 ? 605 GLY C O 1 +ATOM 16344 N N . SER C 1 606 ? -41.542 -0.195 111.396 1.00 44.26 ? 606 SER C N 1 +ATOM 16345 C CA . SER C 1 606 ? -41.046 -1.340 110.638 1.00 43.58 ? 606 SER C CA 1 +ATOM 16346 C C . SER C 1 606 ? -41.570 -2.680 111.123 1.00 43.15 ? 606 SER C C 1 +ATOM 16347 O O . SER C 1 606 ? -41.791 -2.887 112.319 1.00 42.84 ? 606 SER C O 1 +ATOM 16348 C CB . SER C 1 606 ? -39.513 -1.404 110.705 1.00 42.99 ? 606 SER C CB 1 +ATOM 16349 O OG . SER C 1 606 ? -38.910 -0.252 110.152 1.00 45.81 ? 606 SER C OG 1 +ATOM 16350 N N . ILE C 1 607 ? -41.749 -3.591 110.173 1.00 42.76 ? 607 ILE C N 1 +ATOM 16351 C CA . ILE C 1 607 ? -42.176 -4.950 110.461 1.00 41.74 ? 607 ILE C CA 1 +ATOM 16352 C C . ILE C 1 607 ? -41.292 -5.797 109.565 1.00 41.68 ? 607 ILE C C 1 +ATOM 16353 O O . ILE C 1 607 ? -41.346 -5.682 108.340 1.00 42.35 ? 607 ILE C O 1 +ATOM 16354 C CB . ILE C 1 607 ? -43.650 -5.194 110.105 1.00 41.41 ? 607 ILE C CB 1 +ATOM 16355 C CG1 . ILE C 1 607 ? -44.546 -4.375 111.035 1.00 41.87 ? 607 ILE C CG1 1 +ATOM 16356 C CG2 . ILE C 1 607 ? -43.972 -6.683 110.238 1.00 41.02 ? 607 ILE C CG2 1 +ATOM 16357 C CD1 . ILE C 1 607 ? -46.021 -4.465 110.711 1.00 42.08 ? 607 ILE C CD1 1 +ATOM 16358 N N . ILE C 1 608 ? -40.463 -6.634 110.169 1.00 40.27 ? 608 ILE C N 1 +ATOM 16359 C CA . ILE C 1 608 ? -39.579 -7.459 109.384 1.00 40.13 ? 608 ILE C CA 1 +ATOM 16360 C C . ILE C 1 608 ? -39.693 -8.946 109.694 1.00 40.75 ? 608 ILE C C 1 +ATOM 16361 O O . ILE C 1 608 ? -39.424 -9.382 110.811 1.00 41.78 ? 608 ILE C O 1 +ATOM 16362 C CB . ILE C 1 608 ? -38.131 -6.985 109.572 1.00 39.69 ? 608 ILE C CB 1 +ATOM 16363 C CG1 . ILE C 1 608 ? -38.013 -5.553 109.055 1.00 40.54 ? 608 ILE C CG1 1 +ATOM 16364 C CG2 . ILE C 1 608 ? -37.168 -7.885 108.823 1.00 37.77 ? 608 ILE C CG2 1 +ATOM 16365 C CD1 . ILE C 1 608 ? -36.680 -4.904 109.355 1.00 42.66 ? 608 ILE C CD1 1 +ATOM 16366 N N . PRO C 1 609 ? -40.140 -9.741 108.708 1.00 41.02 ? 609 PRO C N 1 +ATOM 16367 C CA . PRO C 1 609 ? -40.268 -11.186 108.908 1.00 40.05 ? 609 PRO C CA 1 +ATOM 16368 C C . PRO C 1 609 ? -38.884 -11.790 108.700 1.00 40.87 ? 609 PRO C C 1 +ATOM 16369 O O . PRO C 1 609 ? -38.182 -11.423 107.755 1.00 40.26 ? 609 PRO C O 1 +ATOM 16370 C CB . PRO C 1 609 ? -41.254 -11.600 107.817 1.00 39.75 ? 609 PRO C CB 1 +ATOM 16371 C CG . PRO C 1 609 ? -40.941 -10.644 106.709 1.00 40.33 ? 609 PRO C CG 1 +ATOM 16372 C CD . PRO C 1 609 ? -40.786 -9.324 107.447 1.00 40.68 ? 609 PRO C CD 1 +ATOM 16373 N N . LEU C 1 610 ? -38.481 -12.690 109.591 1.00 41.93 ? 610 LEU C N 1 +ATOM 16374 C CA . LEU C 1 610 ? -37.176 -13.330 109.479 1.00 42.46 ? 610 LEU C CA 1 +ATOM 16375 C C . LEU C 1 610 ? -37.333 -14.838 109.345 1.00 43.01 ? 610 LEU C C 1 +ATOM 16376 O O . LEU C 1 610 ? -38.421 -15.387 109.538 1.00 42.25 ? 610 LEU C O 1 +ATOM 16377 C CB . LEU C 1 610 ? -36.317 -13.013 110.702 1.00 41.57 ? 610 LEU C CB 1 +ATOM 16378 C CG . LEU C 1 610 ? -36.044 -11.533 110.965 1.00 43.29 ? 610 LEU C CG 1 +ATOM 16379 C CD1 . LEU C 1 610 ? -35.288 -11.374 112.284 1.00 42.65 ? 610 LEU C CD1 1 +ATOM 16380 C CD2 . LEU C 1 610 ? -35.243 -10.946 109.809 1.00 42.41 ? 610 LEU C CD2 1 +ATOM 16381 N N . GLU C 1 611 ? -36.234 -15.496 109.004 1.00 43.67 ? 611 GLU C N 1 +ATOM 16382 C CA . GLU C 1 611 ? -36.210 -16.939 108.839 1.00 46.09 ? 611 GLU C CA 1 +ATOM 16383 C C . GLU C 1 611 ? -36.726 -17.650 110.085 1.00 47.74 ? 611 GLU C C 1 +ATOM 16384 O O . GLU C 1 611 ? -36.474 -17.220 111.227 1.00 47.63 ? 611 GLU C O 1 +ATOM 16385 C CB . GLU C 1 611 ? -34.780 -17.390 108.534 1.00 48.39 ? 611 GLU C CB 1 +ATOM 16386 C CG . GLU C 1 611 ? -34.568 -18.891 108.440 1.00 51.65 ? 611 GLU C CG 1 +ATOM 16387 C CD . GLU C 1 611 ? -33.120 -19.244 108.122 1.00 54.78 ? 611 GLU C CD 1 +ATOM 16388 O OE1 . GLU C 1 611 ? -32.222 -18.752 108.843 1.00 56.61 ? 611 GLU C OE1 1 +ATOM 16389 O OE2 . GLU C 1 611 ? -32.882 -20.011 107.157 1.00 56.33 ? 611 GLU C OE2 1 +ATOM 16390 N N . GLY C 1 612 ? -37.449 -18.744 109.860 1.00 48.02 ? 612 GLY C N 1 +ATOM 16391 C CA . GLY C 1 612 ? -37.983 -19.519 110.967 1.00 48.91 ? 612 GLY C CA 1 +ATOM 16392 C C . GLY C 1 612 ? -39.146 -18.849 111.678 1.00 49.30 ? 612 GLY C C 1 +ATOM 16393 O O . GLY C 1 612 ? -39.282 -18.947 112.899 1.00 49.76 ? 612 GLY C O 1 +ATOM 16394 N N . ASP C 1 613 ? -39.977 -18.148 110.916 1.00 48.94 ? 613 ASP C N 1 +ATOM 16395 C CA . ASP C 1 613 ? -41.141 -17.477 111.470 1.00 48.77 ? 613 ASP C CA 1 +ATOM 16396 C C . ASP C 1 613 ? -40.862 -16.420 112.531 1.00 48.54 ? 613 ASP C C 1 +ATOM 16397 O O . ASP C 1 613 ? -41.766 -16.049 113.284 1.00 46.79 ? 613 ASP C O 1 +ATOM 16398 C CB . ASP C 1 613 ? -42.106 -18.519 112.025 1.00 50.42 ? 613 ASP C CB 1 +ATOM 16399 C CG . ASP C 1 613 ? -42.623 -19.451 110.948 1.00 52.56 ? 613 ASP C CG 1 +ATOM 16400 O OD1 . ASP C 1 613 ? -43.384 -18.984 110.073 1.00 53.65 ? 613 ASP C OD1 1 +ATOM 16401 O OD2 . ASP C 1 613 ? -42.262 -20.645 110.970 1.00 53.33 ? 613 ASP C OD2 1 +ATOM 16402 N N . GLU C 1 614 ? -39.620 -15.940 112.599 1.00 48.90 ? 614 GLU C N 1 +ATOM 16403 C CA . GLU C 1 614 ? -39.273 -14.890 113.558 1.00 49.42 ? 614 GLU C CA 1 +ATOM 16404 C C . GLU C 1 614 ? -39.918 -13.611 113.046 1.00 47.88 ? 614 GLU C C 1 +ATOM 16405 O O . GLU C 1 614 ? -40.270 -13.517 111.869 1.00 47.40 ? 614 GLU C O 1 +ATOM 16406 C CB . GLU C 1 614 ? -37.757 -14.681 113.653 1.00 51.66 ? 614 GLU C CB 1 +ATOM 16407 C CG . GLU C 1 614 ? -37.088 -15.398 114.806 1.00 55.41 ? 614 GLU C CG 1 +ATOM 16408 C CD . GLU C 1 614 ? -35.654 -14.931 115.033 1.00 58.67 ? 614 GLU C CD 1 +ATOM 16409 O OE1 . GLU C 1 614 ? -35.429 -13.701 115.163 1.00 59.02 ? 614 GLU C OE1 1 +ATOM 16410 O OE2 . GLU C 1 614 ? -34.755 -15.800 115.094 1.00 59.56 ? 614 GLU C OE2 1 +ATOM 16411 N N . LEU C 1 615 ? -40.057 -12.621 113.921 1.00 46.77 ? 615 LEU C N 1 +ATOM 16412 C CA . LEU C 1 615 ? -40.687 -11.364 113.533 1.00 46.33 ? 615 LEU C CA 1 +ATOM 16413 C C . LEU C 1 615 ? -40.165 -10.193 114.369 1.00 45.63 ? 615 LEU C C 1 +ATOM 16414 O O . LEU C 1 615 ? -40.095 -10.279 115.594 1.00 46.47 ? 615 LEU C O 1 +ATOM 16415 C CB . LEU C 1 615 ? -42.203 -11.492 113.709 1.00 45.39 ? 615 LEU C CB 1 +ATOM 16416 C CG . LEU C 1 615 ? -43.115 -10.479 113.029 1.00 46.23 ? 615 LEU C CG 1 +ATOM 16417 C CD1 . LEU C 1 615 ? -42.999 -10.649 111.524 1.00 47.22 ? 615 LEU C CD1 1 +ATOM 16418 C CD2 . LEU C 1 615 ? -44.559 -10.703 113.472 1.00 45.95 ? 615 LEU C CD2 1 +ATOM 16419 N N . ILE C 1 616 ? -39.786 -9.107 113.705 1.00 45.41 ? 616 ILE C N 1 +ATOM 16420 C CA . ILE C 1 616 ? -39.300 -7.914 114.400 1.00 44.50 ? 616 ILE C CA 1 +ATOM 16421 C C . ILE C 1 616 ? -40.288 -6.794 114.132 1.00 43.21 ? 616 ILE C C 1 +ATOM 16422 O O . ILE C 1 616 ? -40.637 -6.534 112.985 1.00 42.74 ? 616 ILE C O 1 +ATOM 16423 C CB . ILE C 1 616 ? -37.940 -7.416 113.873 1.00 45.50 ? 616 ILE C CB 1 +ATOM 16424 C CG1 . ILE C 1 616 ? -36.893 -8.522 113.941 1.00 47.51 ? 616 ILE C CG1 1 +ATOM 16425 C CG2 . ILE C 1 616 ? -37.479 -6.233 114.703 1.00 45.23 ? 616 ILE C CG2 1 +ATOM 16426 C CD1 . ILE C 1 616 ? -35.551 -8.105 113.358 1.00 49.01 ? 616 ILE C CD1 1 +ATOM 16427 N N . VAL C 1 617 ? -40.733 -6.129 115.188 1.00 42.35 ? 617 VAL C N 1 +ATOM 16428 C CA . VAL C 1 617 ? -41.669 -5.031 115.029 1.00 42.08 ? 617 VAL C CA 1 +ATOM 16429 C C . VAL C 1 617 ? -41.162 -3.800 115.769 1.00 42.94 ? 617 VAL C C 1 +ATOM 16430 O O . VAL C 1 617 ? -40.746 -3.884 116.932 1.00 42.51 ? 617 VAL C O 1 +ATOM 16431 C CB . VAL C 1 617 ? -43.066 -5.399 115.562 1.00 40.87 ? 617 VAL C CB 1 +ATOM 16432 C CG1 . VAL C 1 617 ? -44.004 -4.214 115.408 1.00 39.41 ? 617 VAL C CG1 1 +ATOM 16433 C CG2 . VAL C 1 617 ? -43.602 -6.609 114.812 1.00 40.41 ? 617 VAL C CG2 1 +ATOM 16434 N N . TYR C 1 618 ? -41.194 -2.662 115.078 1.00 42.43 ? 618 TYR C N 1 +ATOM 16435 C CA . TYR C 1 618 ? -40.747 -1.394 115.640 1.00 42.69 ? 618 TYR C CA 1 +ATOM 16436 C C . TYR C 1 618 ? -41.667 -0.300 115.155 1.00 43.72 ? 618 TYR C C 1 +ATOM 16437 O O . TYR C 1 618 ? -41.584 0.116 113.996 1.00 43.49 ? 618 TYR C O 1 +ATOM 16438 C CB . TYR C 1 618 ? -39.317 -1.077 115.194 1.00 41.23 ? 618 TYR C CB 1 +ATOM 16439 C CG . TYR C 1 618 ? -38.816 0.293 115.610 1.00 42.13 ? 618 TYR C CG 1 +ATOM 16440 C CD1 . TYR C 1 618 ? -39.357 0.960 116.717 1.00 43.01 ? 618 TYR C CD1 1 +ATOM 16441 C CD2 . TYR C 1 618 ? -37.741 0.886 114.951 1.00 42.42 ? 618 TYR C CD2 1 +ATOM 16442 C CE1 . TYR C 1 618 ? -38.830 2.183 117.157 1.00 44.28 ? 618 TYR C CE1 1 +ATOM 16443 C CE2 . TYR C 1 618 ? -37.204 2.102 115.382 1.00 43.78 ? 618 TYR C CE2 1 +ATOM 16444 C CZ . TYR C 1 618 ? -37.752 2.745 116.484 1.00 45.13 ? 618 TYR C CZ 1 +ATOM 16445 O OH . TYR C 1 618 ? -37.214 3.941 116.906 1.00 46.91 ? 618 TYR C OH 1 +ATOM 16446 N N . GLY C 1 619 ? -42.548 0.158 116.039 1.00 45.04 ? 619 GLY C N 1 +ATOM 16447 C CA . GLY C 1 619 ? -43.469 1.219 115.675 1.00 46.59 ? 619 GLY C CA 1 +ATOM 16448 C C . GLY C 1 619 ? -44.720 0.736 114.970 1.00 48.06 ? 619 GLY C C 1 +ATOM 16449 O O . GLY C 1 619 ? -45.065 -0.447 115.030 1.00 48.28 ? 619 GLY C O 1 +ATOM 16450 N N . GLU C 1 620 ? -45.389 1.661 114.288 1.00 49.90 ? 620 GLU C N 1 +ATOM 16451 C CA . GLU C 1 620 ? -46.629 1.360 113.584 1.00 52.54 ? 620 GLU C CA 1 +ATOM 16452 C C . GLU C 1 620 ? -46.491 1.389 112.060 1.00 52.48 ? 620 GLU C C 1 +ATOM 16453 O O . GLU C 1 620 ? -45.976 2.351 111.478 1.00 52.93 ? 620 GLU C O 1 +ATOM 16454 C CB . GLU C 1 620 ? -47.715 2.353 114.014 1.00 55.27 ? 620 GLU C CB 1 +ATOM 16455 C CG . GLU C 1 620 ? -47.893 2.459 115.525 1.00 60.53 ? 620 GLU C CG 1 +ATOM 16456 C CD . GLU C 1 620 ? -48.840 3.583 115.931 1.00 64.09 ? 620 GLU C CD 1 +ATOM 16457 O OE1 . GLU C 1 620 ? -48.560 4.756 115.586 1.00 65.80 ? 620 GLU C OE1 1 +ATOM 16458 O OE2 . GLU C 1 620 ? -49.862 3.296 116.598 1.00 66.05 ? 620 GLU C OE2 1 +ATOM 16459 N N . THR C 1 621 ? -46.963 0.327 111.418 1.00 51.12 ? 621 THR C N 1 +ATOM 16460 C CA . THR C 1 621 ? -46.908 0.232 109.966 1.00 50.25 ? 621 THR C CA 1 +ATOM 16461 C C . THR C 1 621 ? -47.689 -0.995 109.562 1.00 50.00 ? 621 THR C C 1 +ATOM 16462 O O . THR C 1 621 ? -48.178 -1.736 110.415 1.00 50.67 ? 621 THR C O 1 +ATOM 16463 C CB . THR C 1 621 ? -45.441 0.098 109.448 1.00 50.34 ? 621 THR C CB 1 +ATOM 16464 O OG1 . THR C 1 621 ? -45.435 0.111 108.015 1.00 49.63 ? 621 THR C OG1 1 +ATOM 16465 C CG2 . THR C 1 621 ? -44.806 -1.199 109.925 1.00 48.68 ? 621 THR C CG2 1 +ATOM 16466 N N . SER C 1 622 ? -47.815 -1.206 108.260 1.00 50.17 ? 622 SER C N 1 +ATOM 16467 C CA . SER C 1 622 ? -48.536 -2.362 107.743 1.00 50.47 ? 622 SER C CA 1 +ATOM 16468 C C . SER C 1 622 ? -47.616 -3.023 106.729 1.00 49.26 ? 622 SER C C 1 +ATOM 16469 O O . SER C 1 622 ? -46.984 -2.340 105.927 1.00 48.92 ? 622 SER C O 1 +ATOM 16470 C CB . SER C 1 622 ? -49.844 -1.920 107.079 1.00 50.76 ? 622 SER C CB 1 +ATOM 16471 O OG . SER C 1 622 ? -50.647 -3.042 106.757 1.00 53.12 ? 622 SER C OG 1 +ATOM 16472 N N . PHE C 1 623 ? -47.548 -4.348 106.761 1.00 48.69 ? 623 PHE C N 1 +ATOM 16473 C CA . PHE C 1 623 ? -46.663 -5.082 105.869 1.00 47.78 ? 623 PHE C CA 1 +ATOM 16474 C C . PHE C 1 623 ? -47.254 -6.395 105.376 1.00 47.97 ? 623 PHE C C 1 +ATOM 16475 O O . PHE C 1 623 ? -47.824 -7.166 106.150 1.00 47.26 ? 623 PHE C O 1 +ATOM 16476 C CB . PHE C 1 623 ? -45.353 -5.371 106.603 1.00 48.56 ? 623 PHE C CB 1 +ATOM 16477 C CG . PHE C 1 623 ? -44.358 -6.126 105.788 1.00 47.50 ? 623 PHE C CG 1 +ATOM 16478 C CD1 . PHE C 1 623 ? -43.658 -5.495 104.769 1.00 48.80 ? 623 PHE C CD1 1 +ATOM 16479 C CD2 . PHE C 1 623 ? -44.108 -7.468 106.048 1.00 48.26 ? 623 PHE C CD2 1 +ATOM 16480 C CE1 . PHE C 1 623 ? -42.708 -6.191 104.014 1.00 49.51 ? 623 PHE C CE1 1 +ATOM 16481 C CE2 . PHE C 1 623 ? -43.165 -8.177 105.304 1.00 49.82 ? 623 PHE C CE2 1 +ATOM 16482 C CZ . PHE C 1 623 ? -42.462 -7.535 104.284 1.00 49.43 ? 623 PHE C CZ 1 +ATOM 16483 N N . LYS C 1 624 ? -47.086 -6.659 104.084 1.00 48.57 ? 624 LYS C N 1 +ATOM 16484 C CA . LYS C 1 624 ? -47.596 -7.880 103.475 1.00 47.97 ? 624 LYS C CA 1 +ATOM 16485 C C . LYS C 1 624 ? -46.460 -8.882 103.267 1.00 47.80 ? 624 LYS C C 1 +ATOM 16486 O O . LYS C 1 624 ? -45.526 -8.630 102.512 1.00 46.29 ? 624 LYS C O 1 +ATOM 16487 C CB . LYS C 1 624 ? -48.256 -7.546 102.138 1.00 49.13 ? 624 LYS C CB 1 +ATOM 16488 C CG . LYS C 1 624 ? -48.890 -8.727 101.428 1.00 51.04 ? 624 LYS C CG 1 +ATOM 16489 C CD . LYS C 1 624 ? -49.575 -8.263 100.158 1.00 52.75 ? 624 LYS C CD 1 +ATOM 16490 C CE . LYS C 1 624 ? -50.229 -9.431 99.433 1.00 56.17 ? 624 LYS C CE 1 +ATOM 16491 N NZ . LYS C 1 624 ? -50.937 -8.992 98.197 1.00 56.83 ? 624 LYS C NZ 1 +ATOM 16492 N N . ARG C 1 625 ? -46.537 -10.016 103.951 1.00 48.47 ? 625 ARG C N 1 +ATOM 16493 C CA . ARG C 1 625 ? -45.506 -11.035 103.818 1.00 49.36 ? 625 ARG C CA 1 +ATOM 16494 C C . ARG C 1 625 ? -45.703 -11.769 102.489 1.00 49.42 ? 625 ARG C C 1 +ATOM 16495 O O . ARG C 1 625 ? -46.806 -11.794 101.937 1.00 50.05 ? 625 ARG C O 1 +ATOM 16496 C CB . ARG C 1 625 ? -45.563 -12.008 105.004 1.00 49.10 ? 625 ARG C CB 1 +ATOM 16497 C CG . ARG C 1 625 ? -44.276 -12.771 105.204 1.00 49.01 ? 625 ARG C CG 1 +ATOM 16498 C CD . ARG C 1 625 ? -44.256 -13.489 106.528 1.00 52.84 ? 625 ARG C CD 1 +ATOM 16499 N NE . ARG C 1 625 ? -45.291 -14.510 106.628 1.00 54.77 ? 625 ARG C NE 1 +ATOM 16500 C CZ . ARG C 1 625 ? -45.465 -15.289 107.691 1.00 55.85 ? 625 ARG C CZ 1 +ATOM 16501 N NH1 . ARG C 1 625 ? -44.670 -15.156 108.745 1.00 56.02 ? 625 ARG C NH1 1 +ATOM 16502 N NH2 . ARG C 1 625 ? -46.422 -16.208 107.695 1.00 56.78 ? 625 ARG C NH2 1 +ATOM 16503 N N . TYR C 1 626 ? -44.632 -12.366 101.979 1.00 50.06 ? 626 TYR C N 1 +ATOM 16504 C CA . TYR C 1 626 ? -44.674 -13.057 100.694 1.00 50.49 ? 626 TYR C CA 1 +ATOM 16505 C C . TYR C 1 626 ? -45.742 -14.133 100.561 1.00 52.11 ? 626 TYR C C 1 +ATOM 16506 O O . TYR C 1 626 ? -46.203 -14.410 99.458 1.00 52.15 ? 626 TYR C O 1 +ATOM 16507 C CB . TYR C 1 626 ? -43.304 -13.655 100.383 1.00 48.12 ? 626 TYR C CB 1 +ATOM 16508 C CG . TYR C 1 626 ? -42.929 -14.856 101.220 1.00 47.94 ? 626 TYR C CG 1 +ATOM 16509 C CD1 . TYR C 1 626 ? -43.412 -16.133 100.900 1.00 48.64 ? 626 TYR C CD1 1 +ATOM 16510 C CD2 . TYR C 1 626 ? -42.074 -14.728 102.320 1.00 46.13 ? 626 TYR C CD2 1 +ATOM 16511 C CE1 . TYR C 1 626 ? -43.049 -17.252 101.653 1.00 47.19 ? 626 TYR C CE1 1 +ATOM 16512 C CE2 . TYR C 1 626 ? -41.707 -15.835 103.078 1.00 46.09 ? 626 TYR C CE2 1 +ATOM 16513 C CZ . TYR C 1 626 ? -42.197 -17.092 102.737 1.00 47.04 ? 626 TYR C CZ 1 +ATOM 16514 O OH . TYR C 1 626 ? -41.830 -18.195 103.468 1.00 47.84 ? 626 TYR C OH 1 +ATOM 16515 N N . ASP C 1 627 ? -46.131 -14.738 101.678 1.00 53.96 ? 627 ASP C N 1 +ATOM 16516 C CA . ASP C 1 627 ? -47.139 -15.789 101.663 1.00 55.15 ? 627 ASP C CA 1 +ATOM 16517 C C . ASP C 1 627 ? -48.539 -15.193 101.788 1.00 56.17 ? 627 ASP C C 1 +ATOM 16518 O O . ASP C 1 627 ? -49.488 -15.884 102.161 1.00 56.04 ? 627 ASP C O 1 +ATOM 16519 C CB . ASP C 1 627 ? -46.874 -16.784 102.799 1.00 55.89 ? 627 ASP C CB 1 +ATOM 16520 C CG . ASP C 1 627 ? -47.064 -16.169 104.174 1.00 57.10 ? 627 ASP C CG 1 +ATOM 16521 O OD1 . ASP C 1 627 ? -47.016 -14.922 104.286 1.00 57.68 ? 627 ASP C OD1 1 +ATOM 16522 O OD2 . ASP C 1 627 ? -47.249 -16.933 105.146 1.00 59.04 ? 627 ASP C OD2 1 +ATOM 16523 N N . ASN C 1 628 ? -48.646 -13.902 101.484 1.00 57.34 ? 628 ASN C N 1 +ATOM 16524 C CA . ASN C 1 628 ? -49.916 -13.181 101.521 1.00 58.66 ? 628 ASN C CA 1 +ATOM 16525 C C . ASN C 1 628 ? -50.411 -12.732 102.900 1.00 57.80 ? 628 ASN C C 1 +ATOM 16526 O O . ASN C 1 628 ? -51.339 -11.924 102.997 1.00 57.26 ? 628 ASN C O 1 +ATOM 16527 C CB . ASN C 1 628 ? -50.994 -14.012 100.812 1.00 62.50 ? 628 ASN C CB 1 +ATOM 16528 C CG . ASN C 1 628 ? -52.385 -13.764 101.369 1.00 67.13 ? 628 ASN C CG 1 +ATOM 16529 O OD1 . ASN C 1 628 ? -52.713 -14.214 102.478 1.00 69.19 ? 628 ASN C OD1 1 +ATOM 16530 N ND2 . ASN C 1 628 ? -53.209 -13.035 100.613 1.00 68.21 ? 628 ASN C ND2 1 +ATOM 16531 N N . ALA C 1 629 ? -49.801 -13.243 103.964 1.00 56.62 ? 629 ALA C N 1 +ATOM 16532 C CA . ALA C 1 629 ? -50.201 -12.852 105.312 1.00 55.31 ? 629 ALA C CA 1 +ATOM 16533 C C . ALA C 1 629 ? -49.848 -11.382 105.575 1.00 55.22 ? 629 ALA C C 1 +ATOM 16534 O O . ALA C 1 629 ? -48.690 -10.987 105.466 1.00 55.12 ? 629 ALA C O 1 +ATOM 16535 C CB . ALA C 1 629 ? -49.519 -13.745 106.333 1.00 53.72 ? 629 ALA C CB 1 +ATOM 16536 N N . GLU C 1 630 ? -50.849 -10.576 105.919 1.00 55.46 ? 630 GLU C N 1 +ATOM 16537 C CA . GLU C 1 630 ? -50.635 -9.160 106.199 1.00 55.85 ? 630 GLU C CA 1 +ATOM 16538 C C . GLU C 1 630 ? -50.515 -8.928 107.701 1.00 54.83 ? 630 GLU C C 1 +ATOM 16539 O O . GLU C 1 630 ? -51.291 -9.462 108.490 1.00 54.68 ? 630 GLU C O 1 +ATOM 16540 C CB . GLU C 1 630 ? -51.787 -8.331 105.626 1.00 58.56 ? 630 GLU C CB 1 +ATOM 16541 C CG . GLU C 1 630 ? -51.890 -8.431 104.108 1.00 65.07 ? 630 GLU C CG 1 +ATOM 16542 C CD . GLU C 1 630 ? -53.212 -7.912 103.557 1.00 68.73 ? 630 GLU C CD 1 +ATOM 16543 O OE1 . GLU C 1 630 ? -53.524 -6.715 103.769 1.00 70.77 ? 630 GLU C OE1 1 +ATOM 16544 O OE2 . GLU C 1 630 ? -53.935 -8.708 102.910 1.00 69.72 ? 630 GLU C OE2 1 +ATOM 16545 N N . ILE C 1 631 ? -49.527 -8.133 108.090 1.00 53.24 ? 631 ILE C N 1 +ATOM 16546 C CA . ILE C 1 631 ? -49.287 -7.835 109.492 1.00 52.09 ? 631 ILE C CA 1 +ATOM 16547 C C . ILE C 1 631 ? -49.399 -6.331 109.710 1.00 52.76 ? 631 ILE C C 1 +ATOM 16548 O O . ILE C 1 631 ? -48.860 -5.540 108.933 1.00 51.86 ? 631 ILE C O 1 +ATOM 16549 C CB . ILE C 1 631 ? -47.884 -8.303 109.913 1.00 50.66 ? 631 ILE C CB 1 +ATOM 16550 C CG1 . ILE C 1 631 ? -47.699 -9.773 109.530 1.00 50.99 ? 631 ILE C CG1 1 +ATOM 16551 C CG2 . ILE C 1 631 ? -47.696 -8.113 111.405 1.00 50.01 ? 631 ILE C CG2 1 +ATOM 16552 C CD1 . ILE C 1 631 ? -46.314 -10.318 109.790 1.00 48.96 ? 631 ILE C CD1 1 +ATOM 16553 N N . THR C 1 632 ? -50.099 -5.934 110.767 1.00 53.11 ? 632 THR C N 1 +ATOM 16554 C CA . THR C 1 632 ? -50.271 -4.517 111.052 1.00 54.06 ? 632 THR C CA 1 +ATOM 16555 C C . THR C 1 632 ? -49.998 -4.204 112.517 1.00 55.96 ? 632 THR C C 1 +ATOM 16556 O O . THR C 1 632 ? -50.456 -4.919 113.415 1.00 55.94 ? 632 THR C O 1 +ATOM 16557 C CB . THR C 1 632 ? -51.705 -4.047 110.716 1.00 53.48 ? 632 THR C CB 1 +ATOM 16558 O OG1 . THR C 1 632 ? -52.042 -4.448 109.381 1.00 51.73 ? 632 THR C OG1 1 +ATOM 16559 C CG2 . THR C 1 632 ? -51.804 -2.526 110.833 1.00 51.57 ? 632 THR C CG2 1 +ATOM 16560 N N . SER C 1 633 ? -49.249 -3.132 112.754 1.00 57.11 ? 633 SER C N 1 +ATOM 16561 C CA . SER C 1 633 ? -48.931 -2.719 114.113 1.00 59.26 ? 633 SER C CA 1 +ATOM 16562 C C . SER C 1 633 ? -49.451 -1.306 114.334 1.00 61.66 ? 633 SER C C 1 +ATOM 16563 O O . SER C 1 633 ? -49.260 -0.423 113.494 1.00 61.27 ? 633 SER C O 1 +ATOM 16564 C CB . SER C 1 633 ? -47.419 -2.770 114.360 1.00 58.47 ? 633 SER C CB 1 +ATOM 16565 O OG . SER C 1 633 ? -46.742 -1.757 113.639 1.00 59.26 ? 633 SER C OG 1 +ATOM 16566 N N . SER C 1 634 ? -50.128 -1.109 115.462 1.00 65.91 ? 634 SER C N 1 +ATOM 16567 C CA . SER C 1 634 ? -50.694 0.188 115.819 1.00 70.19 ? 634 SER C CA 1 +ATOM 16568 C C . SER C 1 634 ? -50.411 0.442 117.294 1.00 72.50 ? 634 SER C C 1 +ATOM 16569 O O . SER C 1 634 ? -49.498 -0.167 117.860 1.00 73.62 ? 634 SER C O 1 +ATOM 16570 C CB . SER C 1 634 ? -52.204 0.191 115.580 1.00 70.41 ? 634 SER C CB 1 +ATOM 16571 O OG . SER C 1 634 ? -52.841 -0.770 116.409 1.00 73.00 ? 634 SER C OG 1 +ATOM 16572 N N . SER C 1 635 ? -51.198 1.330 117.906 1.00 74.51 ? 635 SER C N 1 +ATOM 16573 C CA . SER C 1 635 ? -51.052 1.688 119.322 1.00 75.79 ? 635 SER C CA 1 +ATOM 16574 C C . SER C 1 635 ? -50.140 0.728 120.091 1.00 76.20 ? 635 SER C C 1 +ATOM 16575 O O . SER C 1 635 ? -48.979 1.049 120.371 1.00 77.05 ? 635 SER C O 1 +ATOM 16576 C CB . SER C 1 635 ? -52.431 1.741 119.996 1.00 76.04 ? 635 SER C CB 1 +ATOM 16577 O OG . SER C 1 635 ? -53.107 0.498 119.891 1.00 76.14 ? 635 SER C OG 1 +ATOM 16578 N N . ASN C 1 636 ? -50.675 -0.447 120.418 1.00 75.37 ? 636 ASN C N 1 +ATOM 16579 C CA . ASN C 1 636 ? -49.941 -1.481 121.140 1.00 75.04 ? 636 ASN C CA 1 +ATOM 16580 C C . ASN C 1 636 ? -50.570 -2.816 120.771 1.00 74.45 ? 636 ASN C C 1 +ATOM 16581 O O . ASN C 1 636 ? -50.733 -3.706 121.611 1.00 74.71 ? 636 ASN C O 1 +ATOM 16582 C CB . ASN C 1 636 ? -50.043 -1.253 122.651 1.00 76.98 ? 636 ASN C CB 1 +ATOM 16583 C CG . ASN C 1 636 ? -49.405 0.059 123.089 1.00 78.94 ? 636 ASN C CG 1 +ATOM 16584 O OD1 . ASN C 1 636 ? -48.192 0.255 122.939 1.00 79.15 ? 636 ASN C OD1 1 +ATOM 16585 N ND2 . ASN C 1 636 ? -50.221 0.969 123.627 1.00 78.18 ? 636 ASN C ND2 1 +ATOM 16586 N N . GLU C 1 637 ? -50.918 -2.939 119.494 1.00 72.59 ? 637 GLU C N 1 +ATOM 16587 C CA . GLU C 1 637 ? -51.551 -4.138 118.966 1.00 71.17 ? 637 GLU C CA 1 +ATOM 16588 C C . GLU C 1 637 ? -50.961 -4.528 117.606 1.00 69.04 ? 637 GLU C C 1 +ATOM 16589 O O . GLU C 1 637 ? -50.673 -3.671 116.765 1.00 68.58 ? 637 GLU C O 1 +ATOM 16590 C CB . GLU C 1 637 ? -53.055 -3.883 118.840 1.00 73.54 ? 637 GLU C CB 1 +ATOM 16591 C CG . GLU C 1 637 ? -53.881 -5.035 118.296 1.00 77.91 ? 637 GLU C CG 1 +ATOM 16592 C CD . GLU C 1 637 ? -55.373 -4.702 118.270 1.00 81.45 ? 637 GLU C CD 1 +ATOM 16593 O OE1 . GLU C 1 637 ? -55.750 -3.678 117.648 1.00 82.61 ? 637 GLU C OE1 1 +ATOM 16594 O OE2 . GLU C 1 637 ? -56.166 -5.460 118.875 1.00 82.87 ? 637 GLU C OE2 1 +ATOM 16595 N N . ILE C 1 638 ? -50.774 -5.828 117.406 1.00 66.08 ? 638 ILE C N 1 +ATOM 16596 C CA . ILE C 1 638 ? -50.240 -6.349 116.155 1.00 63.41 ? 638 ILE C CA 1 +ATOM 16597 C C . ILE C 1 638 ? -51.302 -7.270 115.568 1.00 63.03 ? 638 ILE C C 1 +ATOM 16598 O O . ILE C 1 638 ? -51.522 -8.366 116.078 1.00 63.32 ? 638 ILE C O 1 +ATOM 16599 C CB . ILE C 1 638 ? -48.949 -7.161 116.392 1.00 61.81 ? 638 ILE C CB 1 +ATOM 16600 C CG1 . ILE C 1 638 ? -47.907 -6.286 117.087 1.00 60.48 ? 638 ILE C CG1 1 +ATOM 16601 C CG2 . ILE C 1 638 ? -48.404 -7.677 115.062 1.00 60.58 ? 638 ILE C CG2 1 +ATOM 16602 C CD1 . ILE C 1 638 ? -46.628 -7.013 117.430 1.00 59.35 ? 638 ILE C CD1 1 +ATOM 16603 N N . LYS C 1 639 ? -51.965 -6.825 114.505 1.00 62.92 ? 639 LYS C N 1 +ATOM 16604 C CA . LYS C 1 639 ? -53.016 -7.623 113.868 1.00 62.73 ? 639 LYS C CA 1 +ATOM 16605 C C . LYS C 1 639 ? -52.478 -8.493 112.735 1.00 62.06 ? 639 LYS C C 1 +ATOM 16606 O O . LYS C 1 639 ? -51.489 -8.145 112.086 1.00 62.63 ? 639 LYS C O 1 +ATOM 16607 C CB . LYS C 1 639 ? -54.112 -6.705 113.318 1.00 64.00 ? 639 LYS C CB 1 +ATOM 16608 C CG . LYS C 1 639 ? -54.803 -5.836 114.366 1.00 67.03 ? 639 LYS C CG 1 +ATOM 16609 C CD . LYS C 1 639 ? -55.780 -4.863 113.706 1.00 69.16 ? 639 LYS C CD 1 +ATOM 16610 C CE . LYS C 1 639 ? -56.514 -3.990 114.730 1.00 70.88 ? 639 LYS C CE 1 +ATOM 16611 N NZ . LYS C 1 639 ? -57.437 -4.765 115.618 1.00 72.53 ? 639 LYS C NZ 1 +ATOM 16612 N N . PHE C 1 640 ? -53.131 -9.628 112.505 1.00 60.61 ? 640 PHE C N 1 +ATOM 16613 C CA . PHE C 1 640 ? -52.739 -10.547 111.440 1.00 59.61 ? 640 PHE C CA 1 +ATOM 16614 C C . PHE C 1 640 ? -53.966 -10.843 110.578 1.00 59.24 ? 640 PHE C C 1 +ATOM 16615 O O . PHE C 1 640 ? -55.031 -11.183 111.098 1.00 59.46 ? 640 PHE C O 1 +ATOM 16616 C CB . PHE C 1 640 ? -52.194 -11.857 112.018 1.00 59.99 ? 640 PHE C CB 1 +ATOM 16617 C CG . PHE C 1 640 ? -50.943 -11.695 112.834 1.00 61.04 ? 640 PHE C CG 1 +ATOM 16618 C CD1 . PHE C 1 640 ? -50.981 -11.099 114.092 1.00 61.15 ? 640 PHE C CD1 1 +ATOM 16619 C CD2 . PHE C 1 640 ? -49.720 -12.143 112.341 1.00 62.16 ? 640 PHE C CD2 1 +ATOM 16620 C CE1 . PHE C 1 640 ? -49.812 -10.950 114.851 1.00 62.02 ? 640 PHE C CE1 1 +ATOM 16621 C CE2 . PHE C 1 640 ? -48.544 -12.000 113.091 1.00 62.10 ? 640 PHE C CE2 1 +ATOM 16622 C CZ . PHE C 1 640 ? -48.592 -11.402 114.348 1.00 61.57 ? 640 PHE C CZ 1 +ATOM 16623 N N . SER C 1 641 ? -53.812 -10.719 109.262 1.00 58.54 ? 641 SER C N 1 +ATOM 16624 C CA . SER C 1 641 ? -54.909 -10.951 108.329 1.00 57.30 ? 641 SER C CA 1 +ATOM 16625 C C . SER C 1 641 ? -55.390 -12.400 108.363 1.00 57.36 ? 641 SER C C 1 +ATOM 16626 O O . SER C 1 641 ? -56.475 -12.714 107.877 1.00 57.04 ? 641 SER C O 1 +ATOM 16627 C CB . SER C 1 641 ? -54.481 -10.573 106.901 1.00 57.44 ? 641 SER C CB 1 +ATOM 16628 O OG . SER C 1 641 ? -53.524 -11.484 106.376 1.00 56.95 ? 641 SER C OG 1 +ATOM 16629 N N . ARG C 1 642 ? -54.581 -13.285 108.931 1.00 57.39 ? 642 ARG C N 1 +ATOM 16630 C CA . ARG C 1 642 ? -54.955 -14.690 109.026 1.00 58.27 ? 642 ARG C CA 1 +ATOM 16631 C C . ARG C 1 642 ? -54.031 -15.435 109.989 1.00 58.23 ? 642 ARG C C 1 +ATOM 16632 O O . ARG C 1 642 ? -52.935 -14.974 110.302 1.00 58.47 ? 642 ARG C O 1 +ATOM 16633 C CB . ARG C 1 642 ? -54.935 -15.352 107.636 1.00 58.79 ? 642 ARG C CB 1 +ATOM 16634 C CG . ARG C 1 642 ? -53.557 -15.516 107.009 1.00 62.25 ? 642 ARG C CG 1 +ATOM 16635 C CD . ARG C 1 642 ? -53.657 -16.087 105.597 1.00 64.33 ? 642 ARG C CD 1 +ATOM 16636 N NE . ARG C 1 642 ? -52.347 -16.264 104.972 1.00 66.41 ? 642 ARG C NE 1 +ATOM 16637 C CZ . ARG C 1 642 ? -51.435 -17.144 105.380 1.00 68.27 ? 642 ARG C CZ 1 +ATOM 16638 N NH1 . ARG C 1 642 ? -51.691 -17.936 106.418 1.00 68.70 ? 642 ARG C NH1 1 +ATOM 16639 N NH2 . ARG C 1 642 ? -50.264 -17.233 104.755 1.00 68.38 ? 642 ARG C NH2 1 +ATOM 16640 N N . GLU C 1 643 ? -54.482 -16.591 110.457 1.00 58.48 ? 643 GLU C N 1 +ATOM 16641 C CA . GLU C 1 643 ? -53.709 -17.389 111.397 1.00 58.92 ? 643 GLU C CA 1 +ATOM 16642 C C . GLU C 1 643 ? -52.338 -17.796 110.863 1.00 57.90 ? 643 GLU C C 1 +ATOM 16643 O O . GLU C 1 643 ? -52.235 -18.398 109.789 1.00 57.17 ? 643 GLU C O 1 +ATOM 16644 C CB . GLU C 1 643 ? -54.500 -18.636 111.780 1.00 60.63 ? 643 GLU C CB 1 +ATOM 16645 C CG . GLU C 1 643 ? -53.788 -19.551 112.758 1.00 65.78 ? 643 GLU C CG 1 +ATOM 16646 C CD . GLU C 1 643 ? -54.577 -20.824 113.044 1.00 68.95 ? 643 GLU C CD 1 +ATOM 16647 O OE1 . GLU C 1 643 ? -55.705 -20.725 113.581 1.00 69.90 ? 643 GLU C OE1 1 +ATOM 16648 O OE2 . GLU C 1 643 ? -54.069 -21.926 112.729 1.00 70.59 ? 643 GLU C OE2 1 +ATOM 16649 N N . ILE C 1 644 ? -51.290 -17.458 111.616 1.00 56.56 ? 644 ILE C N 1 +ATOM 16650 C CA . ILE C 1 644 ? -49.923 -17.806 111.233 1.00 55.43 ? 644 ILE C CA 1 +ATOM 16651 C C . ILE C 1 644 ? -49.078 -18.179 112.447 1.00 53.76 ? 644 ILE C C 1 +ATOM 16652 O O . ILE C 1 644 ? -49.319 -17.708 113.557 1.00 53.59 ? 644 ILE C O 1 +ATOM 16653 C CB . ILE C 1 644 ? -49.195 -16.646 110.503 1.00 56.68 ? 644 ILE C CB 1 +ATOM 16654 C CG1 . ILE C 1 644 ? -48.955 -15.485 111.469 1.00 56.64 ? 644 ILE C CG1 1 +ATOM 16655 C CG2 . ILE C 1 644 ? -50.014 -16.180 109.297 1.00 57.60 ? 644 ILE C CG2 1 +ATOM 16656 C CD1 . ILE C 1 644 ? -47.941 -14.488 110.953 1.00 57.85 ? 644 ILE C CD1 1 +ATOM 16657 N N . TYR C 1 645 ? -48.084 -19.027 112.224 1.00 52.04 ? 645 TYR C N 1 +ATOM 16658 C CA . TYR C 1 645 ? -47.194 -19.450 113.290 1.00 50.47 ? 645 TYR C CA 1 +ATOM 16659 C C . TYR C 1 645 ? -46.166 -18.355 113.527 1.00 50.52 ? 645 TYR C C 1 +ATOM 16660 O O . TYR C 1 645 ? -45.700 -17.708 112.590 1.00 51.56 ? 645 TYR C O 1 +ATOM 16661 C CB . TYR C 1 645 ? -46.470 -20.733 112.897 1.00 51.04 ? 645 TYR C CB 1 +ATOM 16662 C CG . TYR C 1 645 ? -45.616 -21.321 113.998 1.00 51.38 ? 645 TYR C CG 1 +ATOM 16663 C CD1 . TYR C 1 645 ? -46.187 -22.067 115.030 1.00 51.32 ? 645 TYR C CD1 1 +ATOM 16664 C CD2 . TYR C 1 645 ? -44.238 -21.109 114.024 1.00 52.33 ? 645 TYR C CD2 1 +ATOM 16665 C CE1 . TYR C 1 645 ? -45.407 -22.587 116.060 1.00 50.72 ? 645 TYR C CE1 1 +ATOM 16666 C CE2 . TYR C 1 645 ? -43.444 -21.619 115.052 1.00 51.52 ? 645 TYR C CE2 1 +ATOM 16667 C CZ . TYR C 1 645 ? -44.034 -22.356 116.065 1.00 52.52 ? 645 TYR C CZ 1 +ATOM 16668 O OH . TYR C 1 645 ? -43.245 -22.850 117.081 1.00 53.18 ? 645 TYR C OH 1 +ATOM 16669 N N . VAL C 1 646 ? -45.817 -18.148 114.789 1.00 48.92 ? 646 VAL C N 1 +ATOM 16670 C CA . VAL C 1 646 ? -44.836 -17.146 115.152 1.00 47.16 ? 646 VAL C CA 1 +ATOM 16671 C C . VAL C 1 646 ? -43.915 -17.755 116.191 1.00 47.70 ? 646 VAL C C 1 +ATOM 16672 O O . VAL C 1 646 ? -44.368 -18.169 117.259 1.00 47.89 ? 646 VAL C O 1 +ATOM 16673 C CB . VAL C 1 646 ? -45.501 -15.893 115.751 1.00 46.88 ? 646 VAL C CB 1 +ATOM 16674 C CG1 . VAL C 1 646 ? -44.436 -14.913 116.220 1.00 45.48 ? 646 VAL C CG1 1 +ATOM 16675 C CG2 . VAL C 1 646 ? -46.394 -15.239 114.719 1.00 46.79 ? 646 VAL C CG2 1 +ATOM 16676 N N . SER C 1 647 ? -42.627 -17.823 115.873 1.00 47.64 ? 647 SER C N 1 +ATOM 16677 C CA . SER C 1 647 ? -41.656 -18.380 116.800 1.00 48.00 ? 647 SER C CA 1 +ATOM 16678 C C . SER C 1 647 ? -41.225 -17.316 117.804 1.00 48.93 ? 647 SER C C 1 +ATOM 16679 O O . SER C 1 647 ? -41.858 -17.142 118.847 1.00 49.18 ? 647 SER C O 1 +ATOM 16680 C CB . SER C 1 647 ? -40.445 -18.920 116.037 1.00 47.14 ? 647 SER C CB 1 +ATOM 16681 O OG . SER C 1 647 ? -39.864 -17.925 115.216 1.00 47.55 ? 647 SER C OG 1 +ATOM 16682 N N . LYS C 1 648 ? -40.160 -16.595 117.469 1.00 49.44 ? 648 LYS C N 1 +ATOM 16683 C CA . LYS C 1 648 ? -39.617 -15.544 118.321 1.00 49.52 ? 648 LYS C CA 1 +ATOM 16684 C C . LYS C 1 648 ? -40.076 -14.167 117.850 1.00 48.45 ? 648 LYS C C 1 +ATOM 16685 O O . LYS C 1 648 ? -39.959 -13.844 116.672 1.00 49.20 ? 648 LYS C O 1 +ATOM 16686 C CB . LYS C 1 648 ? -38.092 -15.645 118.283 1.00 52.18 ? 648 LYS C CB 1 +ATOM 16687 C CG . LYS C 1 648 ? -37.312 -14.606 119.068 1.00 54.91 ? 648 LYS C CG 1 +ATOM 16688 C CD . LYS C 1 648 ? -35.841 -15.046 119.122 1.00 57.44 ? 648 LYS C CD 1 +ATOM 16689 C CE . LYS C 1 648 ? -34.916 -13.963 119.661 1.00 59.57 ? 648 LYS C CE 1 +ATOM 16690 N NZ . LYS C 1 648 ? -34.773 -12.810 118.714 1.00 61.61 ? 648 LYS C NZ 1 +ATOM 16691 N N . LEU C 1 649 ? -40.616 -13.365 118.762 1.00 47.44 ? 649 LEU C N 1 +ATOM 16692 C CA . LEU C 1 649 ? -41.074 -12.015 118.420 1.00 47.22 ? 649 LEU C CA 1 +ATOM 16693 C C . LEU C 1 649 ? -40.188 -10.979 119.099 1.00 47.71 ? 649 LEU C C 1 +ATOM 16694 O O . LEU C 1 649 ? -39.964 -11.045 120.309 1.00 48.95 ? 649 LEU C O 1 +ATOM 16695 C CB . LEU C 1 649 ? -42.522 -11.794 118.867 1.00 45.58 ? 649 LEU C CB 1 +ATOM 16696 C CG . LEU C 1 649 ? -43.016 -10.341 118.817 1.00 45.60 ? 649 LEU C CG 1 +ATOM 16697 C CD1 . LEU C 1 649 ? -43.035 -9.840 117.376 1.00 44.59 ? 649 LEU C CD1 1 +ATOM 16698 C CD2 . LEU C 1 649 ? -44.405 -10.251 119.425 1.00 44.92 ? 649 LEU C CD2 1 +ATOM 16699 N N . THR C 1 650 ? -39.670 -10.033 118.326 1.00 47.42 ? 650 THR C N 1 +ATOM 16700 C CA . THR C 1 650 ? -38.825 -8.997 118.895 1.00 47.36 ? 650 THR C CA 1 +ATOM 16701 C C . THR C 1 650 ? -39.485 -7.651 118.717 1.00 47.67 ? 650 THR C C 1 +ATOM 16702 O O . THR C 1 650 ? -39.844 -7.263 117.611 1.00 47.33 ? 650 THR C O 1 +ATOM 16703 C CB . THR C 1 650 ? -37.443 -8.954 118.239 1.00 46.56 ? 650 THR C CB 1 +ATOM 16704 O OG1 . THR C 1 650 ? -36.789 -10.216 118.421 1.00 48.26 ? 650 THR C OG1 1 +ATOM 16705 C CG2 . THR C 1 650 ? -36.590 -7.864 118.877 1.00 46.48 ? 650 THR C CG2 1 +ATOM 16706 N N . ILE C 1 651 ? -39.649 -6.943 119.825 1.00 49.37 ? 651 ILE C N 1 +ATOM 16707 C CA . ILE C 1 651 ? -40.271 -5.633 119.807 1.00 50.54 ? 651 ILE C CA 1 +ATOM 16708 C C . ILE C 1 651 ? -39.264 -4.595 120.266 1.00 51.55 ? 651 ILE C C 1 +ATOM 16709 O O . ILE C 1 651 ? -38.692 -4.710 121.352 1.00 52.50 ? 651 ILE C O 1 +ATOM 16710 C CB . ILE C 1 651 ? -41.495 -5.597 120.744 1.00 50.42 ? 651 ILE C CB 1 +ATOM 16711 C CG1 . ILE C 1 651 ? -42.535 -6.610 120.270 1.00 52.19 ? 651 ILE C CG1 1 +ATOM 16712 C CG2 . ILE C 1 651 ? -42.100 -4.209 120.762 1.00 50.35 ? 651 ILE C CG2 1 +ATOM 16713 C CD1 . ILE C 1 651 ? -43.725 -6.744 121.196 1.00 55.02 ? 651 ILE C CD1 1 +ATOM 16714 N N . THR C 1 652 ? -39.018 -3.591 119.434 1.00 51.68 ? 652 THR C N 1 +ATOM 16715 C CA . THR C 1 652 ? -38.093 -2.552 119.838 1.00 52.83 ? 652 THR C CA 1 +ATOM 16716 C C . THR C 1 652 ? -39.003 -1.421 120.290 1.00 53.29 ? 652 THR C C 1 +ATOM 16717 O O . THR C 1 652 ? -39.970 -1.086 119.609 1.00 52.76 ? 652 THR C O 1 +ATOM 16718 C CB . THR C 1 652 ? -37.155 -2.096 118.673 1.00 52.86 ? 652 THR C CB 1 +ATOM 16719 O OG1 . THR C 1 652 ? -37.827 -1.144 117.852 1.00 53.33 ? 652 THR C OG1 1 +ATOM 16720 C CG2 . THR C 1 652 ? -36.747 -3.284 117.813 1.00 52.17 ? 652 THR C CG2 1 +ATOM 16721 N N . SER C 1 653 ? -38.712 -0.860 121.458 1.00 54.73 ? 653 SER C N 1 +ATOM 16722 C CA . SER C 1 653 ? -39.531 0.211 122.005 1.00 56.11 ? 653 SER C CA 1 +ATOM 16723 C C . SER C 1 653 ? -38.770 1.026 123.040 1.00 57.25 ? 653 SER C C 1 +ATOM 16724 O O . SER C 1 653 ? -37.977 0.479 123.814 1.00 57.18 ? 653 SER C O 1 +ATOM 16725 C CB . SER C 1 653 ? -40.787 -0.387 122.651 1.00 56.11 ? 653 SER C CB 1 +ATOM 16726 O OG . SER C 1 653 ? -41.622 0.619 123.197 1.00 56.09 ? 653 SER C OG 1 +ATOM 16727 N N . GLU C 1 654 ? -39.011 2.334 123.046 1.00 58.39 ? 654 GLU C N 1 +ATOM 16728 C CA . GLU C 1 654 ? -38.365 3.217 124.006 1.00 60.78 ? 654 GLU C CA 1 +ATOM 16729 C C . GLU C 1 654 ? -39.085 3.070 125.347 1.00 61.98 ? 654 GLU C C 1 +ATOM 16730 O O . GLU C 1 654 ? -38.495 3.268 126.409 1.00 62.13 ? 654 GLU C O 1 +ATOM 16731 C CB . GLU C 1 654 ? -38.420 4.666 123.516 1.00 60.90 ? 654 GLU C CB 1 +ATOM 16732 C CG . GLU C 1 654 ? -37.663 4.876 122.216 1.00 63.25 ? 654 GLU C CG 1 +ATOM 16733 C CD . GLU C 1 654 ? -37.625 6.324 121.771 1.00 64.36 ? 654 GLU C CD 1 +ATOM 16734 O OE1 . GLU C 1 654 ? -37.044 7.157 122.496 1.00 65.59 ? 654 GLU C OE1 1 +ATOM 16735 O OE2 . GLU C 1 654 ? -38.174 6.625 120.690 1.00 66.39 ? 654 GLU C OE2 1 +ATOM 16736 N N . LYS C 1 655 ? -40.367 2.722 125.288 1.00 62.68 ? 655 LYS C N 1 +ATOM 16737 C CA . LYS C 1 655 ? -41.154 2.508 126.491 1.00 64.30 ? 655 LYS C CA 1 +ATOM 16738 C C . LYS C 1 655 ? -41.083 1.014 126.805 1.00 64.90 ? 655 LYS C C 1 +ATOM 16739 O O . LYS C 1 655 ? -41.184 0.174 125.906 1.00 65.65 ? 655 LYS C O 1 +ATOM 16740 C CB . LYS C 1 655 ? -42.599 2.948 126.260 1.00 65.10 ? 655 LYS C CB 1 +ATOM 16741 C CG . LYS C 1 655 ? -42.716 4.433 125.957 1.00 66.86 ? 655 LYS C CG 1 +ATOM 16742 C CD . LYS C 1 655 ? -44.164 4.886 125.846 1.00 68.37 ? 655 LYS C CD 1 +ATOM 16743 C CE . LYS C 1 655 ? -44.247 6.395 125.616 1.00 69.08 ? 655 LYS C CE 1 +ATOM 16744 N NZ . LYS C 1 655 ? -45.657 6.882 125.538 1.00 69.70 ? 655 LYS C NZ 1 +ATOM 16745 N N . PRO C 1 656 ? -40.902 0.659 128.087 1.00 64.71 ? 656 PRO C N 1 +ATOM 16746 C CA . PRO C 1 656 ? -40.814 -0.751 128.485 1.00 63.90 ? 656 PRO C CA 1 +ATOM 16747 C C . PRO C 1 656 ? -42.033 -1.610 128.150 1.00 64.02 ? 656 PRO C C 1 +ATOM 16748 O O . PRO C 1 656 ? -43.171 -1.135 128.145 1.00 63.21 ? 656 PRO C O 1 +ATOM 16749 C CB . PRO C 1 656 ? -40.552 -0.667 129.987 1.00 64.09 ? 656 PRO C CB 1 +ATOM 16750 C CG . PRO C 1 656 ? -41.264 0.597 130.375 1.00 64.34 ? 656 PRO C CG 1 +ATOM 16751 C CD . PRO C 1 656 ? -40.890 1.544 129.267 1.00 63.96 ? 656 PRO C CD 1 +ATOM 16752 N N . VAL C 1 657 ? -41.771 -2.880 127.859 1.00 64.37 ? 657 VAL C N 1 +ATOM 16753 C CA . VAL C 1 657 ? -42.814 -3.841 127.532 1.00 64.16 ? 657 VAL C CA 1 +ATOM 16754 C C . VAL C 1 657 ? -42.676 -4.988 128.525 1.00 65.22 ? 657 VAL C C 1 +ATOM 16755 O O . VAL C 1 657 ? -41.700 -5.735 128.492 1.00 65.41 ? 657 VAL C O 1 +ATOM 16756 C CB . VAL C 1 657 ? -42.638 -4.388 126.099 1.00 63.45 ? 657 VAL C CB 1 +ATOM 16757 C CG1 . VAL C 1 657 ? -43.786 -5.328 125.752 1.00 62.87 ? 657 VAL C CG1 1 +ATOM 16758 C CG2 . VAL C 1 657 ? -42.567 -3.242 125.113 1.00 62.51 ? 657 VAL C CG2 1 +ATOM 16759 N N . SER C 1 658 ? -43.652 -5.124 129.413 1.00 66.58 ? 658 SER C N 1 +ATOM 16760 C CA . SER C 1 658 ? -43.609 -6.175 130.424 1.00 67.85 ? 658 SER C CA 1 +ATOM 16761 C C . SER C 1 658 ? -44.209 -7.497 129.956 1.00 68.00 ? 658 SER C C 1 +ATOM 16762 O O . SER C 1 658 ? -43.759 -8.577 130.364 1.00 68.70 ? 658 SER C O 1 +ATOM 16763 C CB . SER C 1 658 ? -44.337 -5.705 131.685 1.00 68.57 ? 658 SER C CB 1 +ATOM 16764 O OG . SER C 1 658 ? -45.644 -5.255 131.369 1.00 70.66 ? 658 SER C OG 1 +ATOM 16765 N N . LYS C 1 659 ? -45.221 -7.415 129.099 1.00 67.33 ? 659 LYS C N 1 +ATOM 16766 C CA . LYS C 1 659 ? -45.863 -8.623 128.617 1.00 67.19 ? 659 LYS C CA 1 +ATOM 16767 C C . LYS C 1 659 ? -46.670 -8.405 127.350 1.00 66.49 ? 659 LYS C C 1 +ATOM 16768 O O . LYS C 1 659 ? -47.053 -7.278 127.018 1.00 65.19 ? 659 LYS C O 1 +ATOM 16769 C CB . LYS C 1 659 ? -46.795 -9.175 129.698 1.00 67.94 ? 659 LYS C CB 1 +ATOM 16770 C CG . LYS C 1 659 ? -47.974 -8.255 130.001 1.00 68.99 ? 659 LYS C CG 1 +ATOM 16771 C CD . LYS C 1 659 ? -48.945 -8.852 131.023 1.00 71.38 ? 659 LYS C CD 1 +ATOM 16772 C CE . LYS C 1 659 ? -48.341 -8.951 132.432 1.00 72.39 ? 659 LYS C CE 1 +ATOM 16773 N NZ . LYS C 1 659 ? -47.236 -9.960 132.551 1.00 73.38 ? 659 LYS C NZ 1 +ATOM 16774 N N . ILE C 1 660 ? -46.922 -9.510 126.654 1.00 66.13 ? 660 ILE C N 1 +ATOM 16775 C CA . ILE C 1 660 ? -47.723 -9.502 125.439 1.00 66.24 ? 660 ILE C CA 1 +ATOM 16776 C C . ILE C 1 660 ? -48.852 -10.500 125.674 1.00 66.12 ? 660 ILE C C 1 +ATOM 16777 O O . ILE C 1 660 ? -48.709 -11.443 126.457 1.00 65.69 ? 660 ILE C O 1 +ATOM 16778 C CB . ILE C 1 660 ? -46.923 -9.957 124.197 1.00 66.06 ? 660 ILE C CB 1 +ATOM 16779 C CG1 . ILE C 1 660 ? -46.433 -11.391 124.395 1.00 66.01 ? 660 ILE C CG1 1 +ATOM 16780 C CG2 . ILE C 1 660 ? -45.755 -9.010 123.944 1.00 65.50 ? 660 ILE C CG2 1 +ATOM 16781 C CD1 . ILE C 1 660 ? -45.858 -12.006 123.144 1.00 66.96 ? 660 ILE C CD1 1 +ATOM 16782 N N . ILE C 1 661 ? -49.971 -10.290 124.993 1.00 66.16 ? 661 ILE C N 1 +ATOM 16783 C CA . ILE C 1 661 ? -51.123 -11.168 125.137 1.00 65.88 ? 661 ILE C CA 1 +ATOM 16784 C C . ILE C 1 661 ? -51.565 -11.687 123.774 1.00 65.83 ? 661 ILE C C 1 +ATOM 16785 O O . ILE C 1 661 ? -51.944 -10.915 122.894 1.00 65.35 ? 661 ILE C O 1 +ATOM 16786 C CB . ILE C 1 661 ? -52.297 -10.419 125.807 1.00 65.96 ? 661 ILE C CB 1 +ATOM 16787 C CG1 . ILE C 1 661 ? -51.843 -9.858 127.159 1.00 66.30 ? 661 ILE C CG1 1 +ATOM 16788 C CG2 . ILE C 1 661 ? -53.482 -11.353 125.986 1.00 64.47 ? 661 ILE C CG2 1 +ATOM 16789 C CD1 . ILE C 1 661 ? -52.828 -8.894 127.785 1.00 66.78 ? 661 ILE C CD1 1 +ATOM 16790 N N . VAL C 1 662 ? -51.515 -13.003 123.611 1.00 66.22 ? 662 VAL C N 1 +ATOM 16791 C CA . VAL C 1 662 ? -51.913 -13.632 122.362 1.00 67.23 ? 662 VAL C CA 1 +ATOM 16792 C C . VAL C 1 662 ? -53.420 -13.884 122.293 1.00 68.65 ? 662 VAL C C 1 +ATOM 16793 O O . VAL C 1 662 ? -53.961 -14.676 123.063 1.00 68.98 ? 662 VAL C O 1 +ATOM 16794 C CB . VAL C 1 662 ? -51.175 -14.972 122.169 1.00 66.46 ? 662 VAL C CB 1 +ATOM 16795 C CG1 . VAL C 1 662 ? -51.640 -15.653 120.887 1.00 66.11 ? 662 VAL C CG1 1 +ATOM 16796 C CG2 . VAL C 1 662 ? -49.677 -14.727 122.124 1.00 66.92 ? 662 VAL C CG2 1 +ATOM 16797 N N . ASP C 1 663 ? -54.087 -13.194 121.371 1.00 70.22 ? 663 ASP C N 1 +ATOM 16798 C CA . ASP C 1 663 ? -55.525 -13.348 121.161 1.00 72.10 ? 663 ASP C CA 1 +ATOM 16799 C C . ASP C 1 663 ? -56.375 -13.157 122.420 1.00 73.16 ? 663 ASP C C 1 +ATOM 16800 O O . ASP C 1 663 ? -57.389 -13.837 122.602 1.00 73.55 ? 663 ASP C O 1 +ATOM 16801 C CB . ASP C 1 663 ? -55.815 -14.734 120.556 1.00 72.55 ? 663 ASP C CB 1 +ATOM 16802 C CG . ASP C 1 663 ? -55.134 -14.948 119.201 1.00 73.48 ? 663 ASP C CG 1 +ATOM 16803 O OD1 . ASP C 1 663 ? -55.335 -14.112 118.283 1.00 72.98 ? 663 ASP C OD1 1 +ATOM 16804 O OD2 . ASP C 1 663 ? -54.408 -15.962 119.054 1.00 71.86 ? 663 ASP C OD2 1 +ATOM 16805 N N . ASP C 1 664 ? -55.967 -12.244 123.293 1.00 74.53 ? 664 ASP C N 1 +ATOM 16806 C CA . ASP C 1 664 ? -56.727 -11.992 124.516 1.00 76.00 ? 664 ASP C CA 1 +ATOM 16807 C C . ASP C 1 664 ? -56.701 -13.180 125.477 1.00 76.13 ? 664 ASP C C 1 +ATOM 16808 O O . ASP C 1 664 ? -57.749 -13.731 125.818 1.00 76.90 ? 664 ASP C O 1 +ATOM 16809 C CB . ASP C 1 664 ? -58.185 -11.666 124.174 1.00 75.85 ? 664 ASP C CB 1 +ATOM 16810 C CG . ASP C 1 664 ? -58.311 -10.525 123.187 1.00 77.03 ? 664 ASP C CG 1 +ATOM 16811 O OD1 . ASP C 1 664 ? -57.942 -9.384 123.548 1.00 77.11 ? 664 ASP C OD1 1 +ATOM 16812 O OD2 . ASP C 1 664 ? -58.775 -10.775 122.050 1.00 76.47 ? 664 ASP C OD2 1 +ATOM 16813 N N . SER C 1 665 ? -55.508 -13.572 125.906 1.00 76.09 ? 665 SER C N 1 +ATOM 16814 C CA . SER C 1 665 ? -55.349 -14.681 126.843 1.00 76.55 ? 665 SER C CA 1 +ATOM 16815 C C . SER C 1 665 ? -53.880 -15.066 126.991 1.00 75.87 ? 665 SER C C 1 +ATOM 16816 O O . SER C 1 665 ? -53.049 -14.228 127.349 1.00 76.85 ? 665 SER C O 1 +ATOM 16817 C CB . SER C 1 665 ? -56.150 -15.907 126.389 1.00 77.23 ? 665 SER C CB 1 +ATOM 16818 O OG . SER C 1 665 ? -55.550 -16.521 125.264 1.00 78.88 ? 665 SER C OG 1 +ATOM 16819 N N . LYS C 1 666 ? -53.571 -16.328 126.701 1.00 73.86 ? 666 LYS C N 1 +ATOM 16820 C CA . LYS C 1 666 ? -52.216 -16.848 126.818 1.00 72.96 ? 666 LYS C CA 1 +ATOM 16821 C C . LYS C 1 666 ? -51.126 -15.797 126.741 1.00 72.04 ? 666 LYS C C 1 +ATOM 16822 O O . LYS C 1 666 ? -50.742 -15.345 125.662 1.00 72.65 ? 666 LYS C O 1 +ATOM 16823 C CB . LYS C 1 666 ? -51.975 -17.939 125.778 1.00 73.11 ? 666 LYS C CB 1 +ATOM 16824 C CG . LYS C 1 666 ? -52.338 -19.339 126.281 1.00 74.47 ? 666 LYS C CG 1 +ATOM 16825 C CD . LYS C 1 666 ? -51.408 -19.803 127.428 1.00 75.06 ? 666 LYS C CD 1 +ATOM 16826 C CE . LYS C 1 666 ? -51.795 -19.275 128.816 1.00 74.41 ? 666 LYS C CE 1 +ATOM 16827 N NZ . LYS C 1 666 ? -53.040 -19.896 129.351 1.00 72.85 ? 666 LYS C NZ 1 +ATOM 16828 N N . GLU C 1 667 ? -50.636 -15.414 127.914 1.00 70.51 ? 667 GLU C N 1 +ATOM 16829 C CA . GLU C 1 667 ? -49.595 -14.408 128.028 1.00 69.27 ? 667 GLU C CA 1 +ATOM 16830 C C . GLU C 1 667 ? -48.218 -15.051 127.867 1.00 66.96 ? 667 GLU C C 1 +ATOM 16831 O O . GLU C 1 667 ? -48.037 -16.232 128.173 1.00 65.32 ? 667 GLU C O 1 +ATOM 16832 C CB . GLU C 1 667 ? -49.743 -13.694 129.375 1.00 71.12 ? 667 GLU C CB 1 +ATOM 16833 C CG . GLU C 1 667 ? -51.097 -12.977 129.495 1.00 74.38 ? 667 GLU C CG 1 +ATOM 16834 C CD . GLU C 1 667 ? -51.413 -12.468 130.901 1.00 76.95 ? 667 GLU C CD 1 +ATOM 16835 O OE1 . GLU C 1 667 ? -50.606 -11.685 131.459 1.00 77.91 ? 667 GLU C OE1 1 +ATOM 16836 O OE2 . GLU C 1 667 ? -52.480 -12.846 131.441 1.00 76.55 ? 667 GLU C OE2 1 +ATOM 16837 N N . ILE C 1 668 ? -47.258 -14.272 127.373 1.00 64.43 ? 668 ILE C N 1 +ATOM 16838 C CA . ILE C 1 668 ? -45.911 -14.781 127.139 1.00 62.83 ? 668 ILE C CA 1 +ATOM 16839 C C . ILE C 1 668 ? -44.818 -14.044 127.917 1.00 63.14 ? 668 ILE C C 1 +ATOM 16840 O O . ILE C 1 668 ? -44.828 -12.809 128.015 1.00 62.85 ? 668 ILE C O 1 +ATOM 16841 C CB . ILE C 1 668 ? -45.563 -14.719 125.629 1.00 62.25 ? 668 ILE C CB 1 +ATOM 16842 C CG1 . ILE C 1 668 ? -46.665 -15.402 124.805 1.00 62.30 ? 668 ILE C CG1 1 +ATOM 16843 C CG2 . ILE C 1 668 ? -44.213 -15.367 125.373 1.00 59.41 ? 668 ILE C CG2 1 +ATOM 16844 C CD1 . ILE C 1 668 ? -46.835 -16.884 125.080 1.00 62.66 ? 668 ILE C CD1 1 +ATOM 16845 N N . GLN C 1 669 ? -43.882 -14.819 128.469 1.00 62.43 ? 669 GLN C N 1 +ATOM 16846 C CA . GLN C 1 669 ? -42.751 -14.277 129.220 1.00 61.85 ? 669 GLN C CA 1 +ATOM 16847 C C . GLN C 1 669 ? -41.965 -13.329 128.291 1.00 62.35 ? 669 GLN C C 1 +ATOM 16848 O O . GLN C 1 669 ? -41.371 -13.762 127.294 1.00 62.38 ? 669 GLN C O 1 +ATOM 16849 C CB . GLN C 1 669 ? -41.856 -15.436 129.732 1.00 59.54 ? 669 GLN C CB 1 +ATOM 16850 C CG . GLN C 1 669 ? -40.534 -15.017 130.417 1.00 58.16 ? 669 GLN C CG 1 +ATOM 16851 C CD . GLN C 1 669 ? -39.848 -16.150 131.229 1.00 59.66 ? 669 GLN C CD 1 +ATOM 16852 O OE1 . GLN C 1 669 ? -39.554 -17.235 130.713 1.00 55.62 ? 669 GLN C OE1 1 +ATOM 16853 N NE2 . GLN C 1 669 ? -39.585 -15.878 132.508 1.00 60.82 ? 669 GLN C NE2 1 +ATOM 16854 N N . VAL C 1 670 ? -41.998 -12.034 128.605 1.00 62.10 ? 670 VAL C N 1 +ATOM 16855 C CA . VAL C 1 670 ? -41.288 -11.018 127.822 1.00 62.24 ? 670 VAL C CA 1 +ATOM 16856 C C . VAL C 1 670 ? -39.999 -10.593 128.525 1.00 62.42 ? 670 VAL C C 1 +ATOM 16857 O O . VAL C 1 670 ? -40.027 -10.193 129.691 1.00 63.19 ? 670 VAL C O 1 +ATOM 16858 C CB . VAL C 1 670 ? -42.154 -9.753 127.623 1.00 61.34 ? 670 VAL C CB 1 +ATOM 16859 C CG1 . VAL C 1 670 ? -41.316 -8.636 127.036 1.00 61.03 ? 670 VAL C CG1 1 +ATOM 16860 C CG2 . VAL C 1 670 ? -43.320 -10.058 126.707 1.00 63.33 ? 670 VAL C CG2 1 +ATOM 16861 N N . GLU C 1 671 ? -38.869 -10.667 127.832 1.00 61.66 ? 671 GLU C N 1 +ATOM 16862 C CA . GLU C 1 671 ? -37.622 -10.257 128.463 1.00 61.91 ? 671 GLU C CA 1 +ATOM 16863 C C . GLU C 1 671 ? -36.851 -9.188 127.682 1.00 60.15 ? 671 GLU C C 1 +ATOM 16864 O O . GLU C 1 671 ? -36.845 -9.178 126.453 1.00 61.01 ? 671 GLU C O 1 +ATOM 16865 C CB . GLU C 1 671 ? -36.713 -11.465 128.702 1.00 62.62 ? 671 GLU C CB 1 +ATOM 16866 C CG . GLU C 1 671 ? -35.963 -11.943 127.479 1.00 67.01 ? 671 GLU C CG 1 +ATOM 16867 C CD . GLU C 1 671 ? -34.579 -12.490 127.819 1.00 69.41 ? 671 GLU C CD 1 +ATOM 16868 O OE1 . GLU C 1 671 ? -33.757 -11.735 128.392 1.00 69.71 ? 671 GLU C OE1 1 +ATOM 16869 O OE2 . GLU C 1 671 ? -34.312 -13.672 127.509 1.00 70.45 ? 671 GLU C OE2 1 +ATOM 16870 N N . LYS C 1 672 ? -36.205 -8.286 128.413 1.00 57.62 ? 672 LYS C N 1 +ATOM 16871 C CA . LYS C 1 672 ? -35.412 -7.230 127.808 1.00 55.35 ? 672 LYS C CA 1 +ATOM 16872 C C . LYS C 1 672 ? -34.043 -7.837 127.541 1.00 53.64 ? 672 LYS C C 1 +ATOM 16873 O O . LYS C 1 672 ? -33.349 -8.217 128.478 1.00 53.68 ? 672 LYS C O 1 +ATOM 16874 C CB . LYS C 1 672 ? -35.295 -6.052 128.776 1.00 56.07 ? 672 LYS C CB 1 +ATOM 16875 C CG . LYS C 1 672 ? -34.629 -4.813 128.198 1.00 56.20 ? 672 LYS C CG 1 +ATOM 16876 C CD . LYS C 1 672 ? -34.794 -3.621 129.134 1.00 56.16 ? 672 LYS C CD 1 +ATOM 16877 C CE . LYS C 1 672 ? -34.334 -2.330 128.477 1.00 56.36 ? 672 LYS C CE 1 +ATOM 16878 N NZ . LYS C 1 672 ? -34.544 -1.141 129.342 1.00 55.80 ? 672 LYS C NZ 1 +ATOM 16879 N N . THR C 1 673 ? -33.667 -7.949 126.268 1.00 51.37 ? 673 THR C N 1 +ATOM 16880 C CA . THR C 1 673 ? -32.379 -8.532 125.901 1.00 50.08 ? 673 THR C CA 1 +ATOM 16881 C C . THR C 1 673 ? -31.269 -7.489 125.842 1.00 49.83 ? 673 THR C C 1 +ATOM 16882 O O . THR C 1 673 ? -30.092 -7.811 126.027 1.00 49.90 ? 673 THR C O 1 +ATOM 16883 C CB . THR C 1 673 ? -32.461 -9.238 124.537 1.00 50.77 ? 673 THR C CB 1 +ATOM 16884 O OG1 . THR C 1 673 ? -33.031 -8.342 123.571 1.00 51.05 ? 673 THR C OG1 1 +ATOM 16885 C CG2 . THR C 1 673 ? -33.317 -10.501 124.636 1.00 49.79 ? 673 THR C CG2 1 +ATOM 16886 N N . MET C 1 674 ? -31.651 -6.244 125.570 1.00 48.00 ? 674 MET C N 1 +ATOM 16887 C CA . MET C 1 674 ? -30.714 -5.131 125.494 1.00 45.96 ? 674 MET C CA 1 +ATOM 16888 C C . MET C 1 674 ? -31.561 -3.873 125.407 1.00 45.98 ? 674 MET C C 1 +ATOM 16889 O O . MET C 1 674 ? -32.788 -3.964 125.308 1.00 46.20 ? 674 MET C O 1 +ATOM 16890 C CB . MET C 1 674 ? -29.794 -5.265 124.273 1.00 46.51 ? 674 MET C CB 1 +ATOM 16891 C CG . MET C 1 674 ? -30.472 -5.161 122.914 1.00 47.48 ? 674 MET C CG 1 +ATOM 16892 S SD . MET C 1 674 ? -29.289 -5.515 121.603 1.00 51.99 ? 674 MET C SD 1 +ATOM 16893 C CE . MET C 1 674 ? -30.402 -5.590 120.122 1.00 48.96 ? 674 MET C CE 1 +ATOM 16894 N N . GLN C 1 675 ? -30.922 -2.708 125.445 1.00 44.44 ? 675 GLN C N 1 +ATOM 16895 C CA . GLN C 1 675 ? -31.651 -1.447 125.392 1.00 44.39 ? 675 GLN C CA 1 +ATOM 16896 C C . GLN C 1 675 ? -32.706 -1.395 124.289 1.00 44.75 ? 675 GLN C C 1 +ATOM 16897 O O . GLN C 1 675 ? -32.435 -1.732 123.137 1.00 44.45 ? 675 GLN C O 1 +ATOM 16898 C CB . GLN C 1 675 ? -30.674 -0.280 125.217 1.00 44.78 ? 675 GLN C CB 1 +ATOM 16899 C CG . GLN C 1 675 ? -30.034 -0.190 123.845 1.00 45.31 ? 675 GLN C CG 1 +ATOM 16900 C CD . GLN C 1 675 ? -28.890 0.812 123.809 1.00 45.84 ? 675 GLN C CD 1 +ATOM 16901 O OE1 . GLN C 1 675 ? -28.998 1.922 124.343 1.00 46.13 ? 675 GLN C OE1 1 +ATOM 16902 N NE2 . GLN C 1 675 ? -27.788 0.426 123.170 1.00 44.16 ? 675 GLN C NE2 1 +ATOM 16903 N N . ASN C 1 676 ? -33.913 -0.979 124.664 1.00 45.11 ? 676 ASN C N 1 +ATOM 16904 C CA . ASN C 1 676 ? -35.034 -0.845 123.735 1.00 45.58 ? 676 ASN C CA 1 +ATOM 16905 C C . ASN C 1 676 ? -35.453 -2.151 123.058 1.00 46.38 ? 676 ASN C C 1 +ATOM 16906 O O . ASN C 1 676 ? -36.306 -2.141 122.171 1.00 46.36 ? 676 ASN C O 1 +ATOM 16907 C CB . ASN C 1 676 ? -34.688 0.178 122.647 1.00 45.91 ? 676 ASN C CB 1 +ATOM 16908 C CG . ASN C 1 676 ? -34.209 1.506 123.212 1.00 46.45 ? 676 ASN C CG 1 +ATOM 16909 O OD1 . ASN C 1 676 ? -34.930 2.182 123.952 1.00 46.10 ? 676 ASN C OD1 1 +ATOM 16910 N ND2 . ASN C 1 676 ? -32.987 1.891 122.855 1.00 46.70 ? 676 ASN C ND2 1 +ATOM 16911 N N . THR C 1 677 ? -34.876 -3.273 123.478 1.00 46.72 ? 677 THR C N 1 +ATOM 16912 C CA . THR C 1 677 ? -35.181 -4.550 122.844 1.00 47.09 ? 677 THR C CA 1 +ATOM 16913 C C . THR C 1 677 ? -35.867 -5.575 123.756 1.00 48.89 ? 677 THR C C 1 +ATOM 16914 O O . THR C 1 677 ? -35.296 -6.033 124.757 1.00 49.64 ? 677 THR C O 1 +ATOM 16915 C CB . THR C 1 677 ? -33.887 -5.161 122.267 1.00 47.03 ? 677 THR C CB 1 +ATOM 16916 O OG1 . THR C 1 677 ? -33.150 -4.141 121.584 1.00 46.80 ? 677 THR C OG1 1 +ATOM 16917 C CG2 . THR C 1 677 ? -34.206 -6.276 121.284 1.00 46.46 ? 677 THR C CG2 1 +ATOM 16918 N N . TYR C 1 678 ? -37.088 -5.952 123.386 1.00 48.98 ? 678 TYR C N 1 +ATOM 16919 C CA . TYR C 1 678 ? -37.867 -6.912 124.158 1.00 48.86 ? 678 TYR C CA 1 +ATOM 16920 C C . TYR C 1 678 ? -38.207 -8.141 123.330 1.00 49.81 ? 678 TYR C C 1 +ATOM 16921 O O . TYR C 1 678 ? -38.730 -8.030 122.222 1.00 50.28 ? 678 TYR C O 1 +ATOM 16922 C CB . TYR C 1 678 ? -39.130 -6.233 124.654 1.00 49.02 ? 678 TYR C CB 1 +ATOM 16923 C CG . TYR C 1 678 ? -38.812 -5.029 125.500 1.00 51.74 ? 678 TYR C CG 1 +ATOM 16924 C CD1 . TYR C 1 678 ? -38.358 -5.174 126.815 1.00 51.89 ? 678 TYR C CD1 1 +ATOM 16925 C CD2 . TYR C 1 678 ? -38.905 -3.743 124.973 1.00 52.19 ? 678 TYR C CD2 1 +ATOM 16926 C CE1 . TYR C 1 678 ? -38.003 -4.066 127.582 1.00 52.32 ? 678 TYR C CE1 1 +ATOM 16927 C CE2 . TYR C 1 678 ? -38.550 -2.627 125.731 1.00 53.21 ? 678 TYR C CE2 1 +ATOM 16928 C CZ . TYR C 1 678 ? -38.098 -2.795 127.032 1.00 52.77 ? 678 TYR C CZ 1 +ATOM 16929 O OH . TYR C 1 678 ? -37.727 -1.691 127.769 1.00 53.47 ? 678 TYR C OH 1 +ATOM 16930 N N . VAL C 1 679 ? -37.911 -9.317 123.879 1.00 50.74 ? 679 VAL C N 1 +ATOM 16931 C CA . VAL C 1 679 ? -38.142 -10.580 123.187 1.00 50.11 ? 679 VAL C CA 1 +ATOM 16932 C C . VAL C 1 679 ? -39.181 -11.474 123.845 1.00 51.22 ? 679 VAL C C 1 +ATOM 16933 O O . VAL C 1 679 ? -39.239 -11.588 125.069 1.00 52.05 ? 679 VAL C O 1 +ATOM 16934 C CB . VAL C 1 679 ? -36.825 -11.377 123.074 1.00 49.01 ? 679 VAL C CB 1 +ATOM 16935 C CG1 . VAL C 1 679 ? -37.073 -12.701 122.372 1.00 48.54 ? 679 VAL C CG1 1 +ATOM 16936 C CG2 . VAL C 1 679 ? -35.790 -10.559 122.322 1.00 48.57 ? 679 VAL C CG2 1 +ATOM 16937 N N . ALA C 1 680 ? -39.989 -12.122 123.017 1.00 51.74 ? 680 ALA C N 1 +ATOM 16938 C CA . ALA C 1 680 ? -41.020 -13.026 123.502 1.00 52.27 ? 680 ALA C CA 1 +ATOM 16939 C C . ALA C 1 680 ? -40.981 -14.313 122.686 1.00 52.91 ? 680 ALA C C 1 +ATOM 16940 O O . ALA C 1 680 ? -41.196 -14.290 121.474 1.00 53.04 ? 680 ALA C O 1 +ATOM 16941 C CB . ALA C 1 680 ? -42.397 -12.372 123.384 1.00 51.41 ? 680 ALA C CB 1 +ATOM 16942 N N . LYS C 1 681 ? -40.690 -15.429 123.348 1.00 53.73 ? 681 LYS C N 1 +ATOM 16943 C CA . LYS C 1 681 ? -40.655 -16.725 122.681 1.00 55.13 ? 681 LYS C CA 1 +ATOM 16944 C C . LYS C 1 681 ? -42.102 -17.225 122.627 1.00 55.75 ? 681 LYS C C 1 +ATOM 16945 O O . LYS C 1 681 ? -42.592 -17.826 123.579 1.00 56.75 ? 681 LYS C O 1 +ATOM 16946 C CB . LYS C 1 681 ? -39.811 -17.716 123.481 1.00 57.69 ? 681 LYS C CB 1 +ATOM 16947 C CG . LYS C 1 681 ? -38.440 -17.210 123.907 1.00 59.70 ? 681 LYS C CG 1 +ATOM 16948 C CD . LYS C 1 681 ? -37.445 -17.252 122.774 1.00 61.57 ? 681 LYS C CD 1 +ATOM 16949 C CE . LYS C 1 681 ? -36.032 -17.034 123.296 1.00 63.94 ? 681 LYS C CE 1 +ATOM 16950 N NZ . LYS C 1 681 ? -35.002 -17.172 122.224 1.00 66.66 ? 681 LYS C NZ 1 +ATOM 16951 N N . ILE C 1 682 ? -42.786 -16.969 121.518 1.00 55.86 ? 682 ILE C N 1 +ATOM 16952 C CA . ILE C 1 682 ? -44.173 -17.385 121.362 1.00 54.96 ? 682 ILE C CA 1 +ATOM 16953 C C . ILE C 1 682 ? -44.326 -18.837 120.906 1.00 56.15 ? 682 ILE C C 1 +ATOM 16954 O O . ILE C 1 682 ? -45.083 -19.599 121.501 1.00 58.01 ? 682 ILE C O 1 +ATOM 16955 C CB . ILE C 1 682 ? -44.893 -16.462 120.375 1.00 54.67 ? 682 ILE C CB 1 +ATOM 16956 C CG1 . ILE C 1 682 ? -44.896 -15.034 120.935 1.00 52.44 ? 682 ILE C CG1 1 +ATOM 16957 C CG2 . ILE C 1 682 ? -46.303 -16.977 120.111 1.00 53.96 ? 682 ILE C CG2 1 +ATOM 16958 C CD1 . ILE C 1 682 ? -45.524 -14.007 120.029 1.00 50.94 ? 682 ILE C CD1 1 +ATOM 16959 N N . ASN C 1 683 ? -43.612 -19.215 119.853 1.00 56.48 ? 683 ASN C N 1 +ATOM 16960 C CA . ASN C 1 683 ? -43.668 -20.576 119.324 1.00 57.51 ? 683 ASN C CA 1 +ATOM 16961 C C . ASN C 1 683 ? -45.066 -21.196 119.282 1.00 58.29 ? 683 ASN C C 1 +ATOM 16962 O O . ASN C 1 683 ? -45.303 -22.249 119.876 1.00 58.72 ? 683 ASN C O 1 +ATOM 16963 C CB . ASN C 1 683 ? -42.743 -21.492 120.125 1.00 57.90 ? 683 ASN C CB 1 +ATOM 16964 C CG . ASN C 1 683 ? -41.303 -21.023 120.108 1.00 59.16 ? 683 ASN C CG 1 +ATOM 16965 O OD1 . ASN C 1 683 ? -40.722 -20.802 119.045 1.00 60.02 ? 683 ASN C OD1 1 +ATOM 16966 N ND2 . ASN C 1 683 ? -40.717 -20.871 121.290 1.00 60.08 ? 683 ASN C ND2 1 +ATOM 16967 N N . GLN C 1 684 ? -45.986 -20.548 118.575 1.00 58.36 ? 684 GLN C N 1 +ATOM 16968 C CA . GLN C 1 684 ? -47.339 -21.063 118.451 1.00 58.92 ? 684 GLN C CA 1 +ATOM 16969 C C . GLN C 1 684 ? -48.130 -20.254 117.436 1.00 59.45 ? 684 GLN C C 1 +ATOM 16970 O O . GLN C 1 684 ? -47.792 -19.108 117.147 1.00 60.10 ? 684 GLN C O 1 +ATOM 16971 C CB . GLN C 1 684 ? -48.046 -21.020 119.799 1.00 59.27 ? 684 GLN C CB 1 +ATOM 16972 C CG . GLN C 1 684 ? -48.478 -19.639 120.220 1.00 60.83 ? 684 GLN C CG 1 +ATOM 16973 C CD . GLN C 1 684 ? -49.315 -19.665 121.486 1.00 62.43 ? 684 GLN C CD 1 +ATOM 16974 O OE1 . GLN C 1 684 ? -48.839 -20.069 122.556 1.00 59.92 ? 684 GLN C OE1 1 +ATOM 16975 N NE2 . GLN C 1 684 ? -50.572 -19.236 121.371 1.00 62.77 ? 684 GLN C NE2 1 +ATOM 16976 N N . LYS C 1 685 ? -49.185 -20.850 116.893 1.00 59.74 ? 685 LYS C N 1 +ATOM 16977 C CA . LYS C 1 685 ? -50.011 -20.159 115.918 1.00 61.26 ? 685 LYS C CA 1 +ATOM 16978 C C . LYS C 1 685 ? -50.800 -19.044 116.584 1.00 61.32 ? 685 LYS C C 1 +ATOM 16979 O O . LYS C 1 685 ? -51.151 -19.138 117.761 1.00 61.66 ? 685 LYS C O 1 +ATOM 16980 C CB . LYS C 1 685 ? -50.969 -21.140 115.233 1.00 63.29 ? 685 LYS C CB 1 +ATOM 16981 C CG . LYS C 1 685 ? -50.261 -22.166 114.340 1.00 66.28 ? 685 LYS C CG 1 +ATOM 16982 C CD . LYS C 1 685 ? -51.236 -22.904 113.418 1.00 68.17 ? 685 LYS C CD 1 +ATOM 16983 C CE . LYS C 1 685 ? -52.221 -23.767 114.201 1.00 69.81 ? 685 LYS C CE 1 +ATOM 16984 N NZ . LYS C 1 685 ? -51.535 -24.854 114.966 1.00 70.80 ? 685 LYS C NZ 1 +ATOM 16985 N N . ILE C 1 686 ? -51.071 -17.986 115.828 1.00 61.29 ? 686 ILE C N 1 +ATOM 16986 C CA . ILE C 1 686 ? -51.813 -16.847 116.345 1.00 61.48 ? 686 ILE C CA 1 +ATOM 16987 C C . ILE C 1 686 ? -53.051 -16.615 115.490 1.00 62.84 ? 686 ILE C C 1 +ATOM 16988 O O . ILE C 1 686 ? -52.957 -16.383 114.283 1.00 64.35 ? 686 ILE C O 1 +ATOM 16989 C CB . ILE C 1 686 ? -50.921 -15.585 116.367 1.00 60.96 ? 686 ILE C CB 1 +ATOM 16990 C CG1 . ILE C 1 686 ? -49.740 -15.833 117.305 1.00 61.26 ? 686 ILE C CG1 1 +ATOM 16991 C CG2 . ILE C 1 686 ? -51.720 -14.371 116.815 1.00 59.27 ? 686 ILE C CG2 1 +ATOM 16992 C CD1 . ILE C 1 686 ? -48.742 -14.714 117.350 1.00 63.15 ? 686 ILE C CD1 1 +ATOM 16993 N N . ARG C 1 687 ? -54.211 -16.692 116.135 1.00 63.58 ? 687 ARG C N 1 +ATOM 16994 C CA . ARG C 1 687 ? -55.494 -16.520 115.468 1.00 63.47 ? 687 ARG C CA 1 +ATOM 16995 C C . ARG C 1 687 ? -55.647 -15.179 114.750 1.00 62.87 ? 687 ARG C C 1 +ATOM 16996 O O . ARG C 1 687 ? -56.074 -15.137 113.596 1.00 63.05 ? 687 ARG C O 1 +ATOM 16997 C CB . ARG C 1 687 ? -56.635 -16.719 116.483 1.00 65.11 ? 687 ARG C CB 1 +ATOM 16998 C CG . ARG C 1 687 ? -58.040 -16.524 115.909 1.00 67.11 ? 687 ARG C CG 1 +ATOM 16999 C CD . ARG C 1 687 ? -59.146 -17.191 116.756 1.00 68.80 ? 687 ARG C CD 1 +ATOM 17000 N NE . ARG C 1 687 ? -59.390 -16.545 118.049 1.00 70.04 ? 687 ARG C NE 1 +ATOM 17001 C CZ . ARG C 1 687 ? -58.755 -16.848 119.180 1.00 71.52 ? 687 ARG C CZ 1 +ATOM 17002 N NH1 . ARG C 1 687 ? -57.824 -17.798 119.195 1.00 71.73 ? 687 ARG C NH1 1 +ATOM 17003 N NH2 . ARG C 1 687 ? -59.054 -16.204 120.303 1.00 70.83 ? 687 ARG C NH2 1 +ATOM 17004 N N . GLY C 1 688 ? -55.297 -14.084 115.415 1.00 61.87 ? 688 GLY C N 1 +ATOM 17005 C CA . GLY C 1 688 ? -55.443 -12.796 114.768 1.00 61.57 ? 688 GLY C CA 1 +ATOM 17006 C C . GLY C 1 688 ? -54.785 -11.584 115.399 1.00 61.82 ? 688 GLY C C 1 +ATOM 17007 O O . GLY C 1 688 ? -54.705 -10.539 114.748 1.00 62.64 ? 688 GLY C O 1 +ATOM 17008 N N . LYS C 1 689 ? -54.319 -11.679 116.642 1.00 61.23 ? 689 LYS C N 1 +ATOM 17009 C CA . LYS C 1 689 ? -53.692 -10.507 117.246 1.00 61.25 ? 689 LYS C CA 1 +ATOM 17010 C C . LYS C 1 689 ? -52.832 -10.716 118.492 1.00 60.93 ? 689 LYS C C 1 +ATOM 17011 O O . LYS C 1 689 ? -52.910 -11.742 119.166 1.00 60.86 ? 689 LYS C O 1 +ATOM 17012 C CB . LYS C 1 689 ? -54.755 -9.453 117.558 1.00 61.44 ? 689 LYS C CB 1 +ATOM 17013 C CG . LYS C 1 689 ? -55.512 -9.683 118.855 1.00 62.73 ? 689 LYS C CG 1 +ATOM 17014 C CD . LYS C 1 689 ? -56.313 -8.442 119.214 1.00 64.75 ? 689 LYS C CD 1 +ATOM 17015 C CE . LYS C 1 689 ? -56.881 -8.516 120.621 1.00 65.77 ? 689 LYS C CE 1 +ATOM 17016 N NZ . LYS C 1 689 ? -57.552 -7.233 121.014 1.00 66.70 ? 689 LYS C NZ 1 +ATOM 17017 N N . ILE C 1 690 ? -52.008 -9.710 118.776 1.00 60.79 ? 690 ILE C N 1 +ATOM 17018 C CA . ILE C 1 690 ? -51.113 -9.696 119.926 1.00 60.40 ? 690 ILE C CA 1 +ATOM 17019 C C . ILE C 1 690 ? -51.172 -8.297 120.514 1.00 61.48 ? 690 ILE C C 1 +ATOM 17020 O O . ILE C 1 690 ? -51.126 -7.310 119.779 1.00 62.08 ? 690 ILE C O 1 +ATOM 17021 C CB . ILE C 1 690 ? -49.648 -9.970 119.521 1.00 59.60 ? 690 ILE C CB 1 +ATOM 17022 C CG1 . ILE C 1 690 ? -49.512 -11.374 118.937 1.00 60.01 ? 690 ILE C CG1 1 +ATOM 17023 C CG2 . ILE C 1 690 ? -48.734 -9.820 120.727 1.00 58.83 ? 690 ILE C CG2 1 +ATOM 17024 C CD1 . ILE C 1 690 ? -48.102 -11.702 118.467 1.00 58.74 ? 690 ILE C CD1 1 +ATOM 17025 N N . ASN C 1 691 ? -51.285 -8.207 121.833 1.00 62.90 ? 691 ASN C N 1 +ATOM 17026 C CA . ASN C 1 691 ? -51.323 -6.908 122.489 1.00 65.11 ? 691 ASN C CA 1 +ATOM 17027 C C . ASN C 1 691 ? -50.092 -6.727 123.367 1.00 66.07 ? 691 ASN C C 1 +ATOM 17028 O O . ASN C 1 691 ? -49.548 -7.696 123.900 1.00 65.04 ? 691 ASN C O 1 +ATOM 17029 C CB . ASN C 1 691 ? -52.591 -6.757 123.332 1.00 64.77 ? 691 ASN C CB 1 +ATOM 17030 C CG . ASN C 1 691 ? -53.842 -6.649 122.484 1.00 64.80 ? 691 ASN C CG 1 +ATOM 17031 O OD1 . ASN C 1 691 ? -54.359 -7.650 121.986 1.00 63.90 ? 691 ASN C OD1 1 +ATOM 17032 N ND2 . ASN C 1 691 ? -54.329 -5.424 122.306 1.00 65.07 ? 691 ASN C ND2 1 +ATOM 17033 N N . LEU C 1 692 ? -49.648 -5.482 123.501 1.00 67.80 ? 692 LEU C N 1 +ATOM 17034 C CA . LEU C 1 692 ? -48.480 -5.184 124.313 1.00 71.13 ? 692 LEU C CA 1 +ATOM 17035 C C . LEU C 1 692 ? -48.866 -4.417 125.570 1.00 73.36 ? 692 LEU C C 1 +ATOM 17036 O O . LEU C 1 692 ? -49.800 -3.611 125.558 1.00 74.08 ? 692 LEU C O 1 +ATOM 17037 C CB . LEU C 1 692 ? -47.462 -4.375 123.500 1.00 71.58 ? 692 LEU C CB 1 +ATOM 17038 C CG . LEU C 1 692 ? -46.618 -5.102 122.444 1.00 71.63 ? 692 LEU C CG 1 +ATOM 17039 C CD1 . LEU C 1 692 ? -47.497 -5.821 121.434 1.00 72.02 ? 692 LEU C CD1 1 +ATOM 17040 C CD2 . LEU C 1 692 ? -45.744 -4.083 121.739 1.00 72.74 ? 692 LEU C CD2 1 +ATOM 17041 N N . GLU C 1 693 ? -48.146 -4.677 126.657 1.00 75.90 ? 693 GLU C N 1 +ATOM 17042 C CA . GLU C 1 693 ? -48.404 -4.001 127.924 1.00 77.83 ? 693 GLU C CA 1 +ATOM 17043 C C . GLU C 1 693 ? -47.106 -3.700 128.678 1.00 77.88 ? 693 GLU C C 1 +ATOM 17044 O O . GLU C 1 693 ? -46.119 -4.432 128.565 1.00 77.41 ? 693 GLU C O 1 +ATOM 17045 C CB . GLU C 1 693 ? -49.321 -4.858 128.797 1.00 79.69 ? 693 GLU C CB 1 +ATOM 17046 C CG . GLU C 1 693 ? -50.632 -5.242 128.127 1.00 82.83 ? 693 GLU C CG 1 +ATOM 17047 C CD . GLU C 1 693 ? -51.572 -5.976 129.068 1.00 84.59 ? 693 GLU C CD 1 +ATOM 17048 O OE1 . GLU C 1 693 ? -51.122 -6.950 129.718 1.00 84.84 ? 693 GLU C OE1 1 +ATOM 17049 O OE2 . GLU C 1 693 ? -52.758 -5.579 129.149 1.00 84.89 ? 693 GLU C OE2 1 +ATOM 17050 N N . ILE D 1 3 ? 40.126 31.592 54.531 1.00 51.47 ? 3 ILE D N 1 +ATOM 17051 C CA . ILE D 1 3 ? 41.392 31.393 53.767 1.00 52.21 ? 3 ILE D CA 1 +ATOM 17052 C C . ILE D 1 3 ? 41.099 30.901 52.354 1.00 51.03 ? 3 ILE D C 1 +ATOM 17053 O O . ILE D 1 3 ? 40.226 30.061 52.146 1.00 50.28 ? 3 ILE D O 1 +ATOM 17054 C CB . ILE D 1 3 ? 42.312 30.356 54.456 1.00 54.51 ? 3 ILE D CB 1 +ATOM 17055 C CG1 . ILE D 1 3 ? 42.665 30.829 55.870 1.00 56.25 ? 3 ILE D CG1 1 +ATOM 17056 C CG2 . ILE D 1 3 ? 43.576 30.144 53.626 1.00 53.74 ? 3 ILE D CG2 1 +ATOM 17057 C CD1 . ILE D 1 3 ? 43.415 29.790 56.703 1.00 57.77 ? 3 ILE D CD1 1 +ATOM 17058 N N . LEU D 1 4 ? 41.845 31.433 51.392 1.00 50.31 ? 4 LEU D N 1 +ATOM 17059 C CA . LEU D 1 4 ? 41.702 31.078 49.987 1.00 48.76 ? 4 LEU D CA 1 +ATOM 17060 C C . LEU D 1 4 ? 43.053 31.126 49.295 1.00 48.47 ? 4 LEU D C 1 +ATOM 17061 O O . LEU D 1 4 ? 43.668 32.183 49.209 1.00 48.42 ? 4 LEU D O 1 +ATOM 17062 C CB . LEU D 1 4 ? 40.761 32.050 49.274 1.00 48.09 ? 4 LEU D CB 1 +ATOM 17063 C CG . LEU D 1 4 ? 40.947 32.067 47.748 1.00 49.43 ? 4 LEU D CG 1 +ATOM 17064 C CD1 . LEU D 1 4 ? 40.562 30.721 47.172 1.00 49.59 ? 4 LEU D CD1 1 +ATOM 17065 C CD2 . LEU D 1 4 ? 40.111 33.163 47.117 1.00 50.65 ? 4 LEU D CD2 1 +ATOM 17066 N N . LYS D 1 5 ? 43.515 29.991 48.788 1.00 47.96 ? 5 LYS D N 1 +ATOM 17067 C CA . LYS D 1 5 ? 44.791 29.970 48.091 1.00 48.41 ? 5 LYS D CA 1 +ATOM 17068 C C . LYS D 1 5 ? 44.568 29.476 46.671 1.00 47.18 ? 5 LYS D C 1 +ATOM 17069 O O . LYS D 1 5 ? 43.724 28.619 46.440 1.00 47.98 ? 5 LYS D O 1 +ATOM 17070 C CB . LYS D 1 5 ? 45.774 29.026 48.779 1.00 51.00 ? 5 LYS D CB 1 +ATOM 17071 C CG . LYS D 1 5 ? 45.786 29.086 50.285 1.00 55.59 ? 5 LYS D CG 1 +ATOM 17072 C CD . LYS D 1 5 ? 46.666 27.966 50.822 1.00 59.28 ? 5 LYS D CD 1 +ATOM 17073 C CE . LYS D 1 5 ? 46.503 27.785 52.317 1.00 61.89 ? 5 LYS D CE 1 +ATOM 17074 N NZ . LYS D 1 5 ? 47.423 26.725 52.824 1.00 64.63 ? 5 LYS D NZ 1 +ATOM 17075 N N . ILE D 1 6 ? 45.323 30.018 45.724 1.00 45.57 ? 6 ILE D N 1 +ATOM 17076 C CA . ILE D 1 6 ? 45.223 29.594 44.341 1.00 45.48 ? 6 ILE D CA 1 +ATOM 17077 C C . ILE D 1 6 ? 46.622 29.313 43.794 1.00 46.52 ? 6 ILE D C 1 +ATOM 17078 O O . ILE D 1 6 ? 47.485 30.184 43.793 1.00 47.06 ? 6 ILE D O 1 +ATOM 17079 C CB . ILE D 1 6 ? 44.538 30.655 43.468 1.00 44.30 ? 6 ILE D CB 1 +ATOM 17080 C CG1 . ILE D 1 6 ? 43.172 31.006 44.051 1.00 43.23 ? 6 ILE D CG1 1 +ATOM 17081 C CG2 . ILE D 1 6 ? 44.364 30.123 42.046 1.00 43.81 ? 6 ILE D CG2 1 +ATOM 17082 C CD1 . ILE D 1 6 ? 42.400 32.033 43.230 1.00 43.39 ? 6 ILE D CD1 1 +ATOM 17083 N N . TYR D 1 7 ? 46.837 28.082 43.344 1.00 48.55 ? 7 TYR D N 1 +ATOM 17084 C CA . TYR D 1 7 ? 48.118 27.654 42.793 1.00 49.71 ? 7 TYR D CA 1 +ATOM 17085 C C . TYR D 1 7 ? 47.954 27.441 41.303 1.00 51.06 ? 7 TYR D C 1 +ATOM 17086 O O . TYR D 1 7 ? 46.907 27.004 40.853 1.00 51.03 ? 7 TYR D O 1 +ATOM 17087 C CB . TYR D 1 7 ? 48.547 26.351 43.451 1.00 49.81 ? 7 TYR D CB 1 +ATOM 17088 C CG . TYR D 1 7 ? 48.754 26.458 44.944 1.00 51.65 ? 7 TYR D CG 1 +ATOM 17089 C CD1 . TYR D 1 7 ? 49.844 27.154 45.467 1.00 52.61 ? 7 TYR D CD1 1 +ATOM 17090 C CD2 . TYR D 1 7 ? 47.877 25.842 45.834 1.00 51.83 ? 7 TYR D CD2 1 +ATOM 17091 C CE1 . TYR D 1 7 ? 50.062 27.230 46.846 1.00 53.66 ? 7 TYR D CE1 1 +ATOM 17092 C CE2 . TYR D 1 7 ? 48.081 25.910 47.212 1.00 54.64 ? 7 TYR D CE2 1 +ATOM 17093 C CZ . TYR D 1 7 ? 49.179 26.606 47.713 1.00 55.33 ? 7 TYR D CZ 1 +ATOM 17094 O OH . TYR D 1 7 ? 49.397 26.671 49.075 1.00 56.30 ? 7 TYR D OH 1 +ATOM 17095 N N . GLU D 1 8 ? 48.985 27.744 40.531 1.00 54.36 ? 8 GLU D N 1 +ATOM 17096 C CA . GLU D 1 8 ? 48.898 27.587 39.084 1.00 57.88 ? 8 GLU D CA 1 +ATOM 17097 C C . GLU D 1 8 ? 50.052 26.743 38.564 1.00 58.69 ? 8 GLU D C 1 +ATOM 17098 O O . GLU D 1 8 ? 51.011 26.490 39.288 1.00 59.69 ? 8 GLU D O 1 +ATOM 17099 C CB . GLU D 1 8 ? 48.900 28.971 38.426 1.00 60.47 ? 8 GLU D CB 1 +ATOM 17100 C CG . GLU D 1 8 ? 48.936 28.998 36.893 1.00 65.55 ? 8 GLU D CG 1 +ATOM 17101 C CD . GLU D 1 8 ? 49.051 30.427 36.338 1.00 68.90 ? 8 GLU D CD 1 +ATOM 17102 O OE1 . GLU D 1 8 ? 49.980 31.163 36.754 1.00 69.53 ? 8 GLU D OE1 1 +ATOM 17103 O OE2 . GLU D 1 8 ? 48.215 30.817 35.488 1.00 70.06 ? 8 GLU D OE2 1 +ATOM 17104 N N . ASN D 1 9 ? 49.925 26.293 37.316 1.00 60.43 ? 9 ASN D N 1 +ATOM 17105 C CA . ASN D 1 9 ? 50.936 25.488 36.623 1.00 61.10 ? 9 ASN D CA 1 +ATOM 17106 C C . ASN D 1 9 ? 50.333 24.639 35.512 1.00 60.94 ? 9 ASN D C 1 +ATOM 17107 O O . ASN D 1 9 ? 49.422 23.845 35.749 1.00 61.45 ? 9 ASN D O 1 +ATOM 17108 C CB . ASN D 1 9 ? 51.667 24.544 37.572 1.00 62.94 ? 9 ASN D CB 1 +ATOM 17109 C CG . ASN D 1 9 ? 52.802 23.803 36.881 1.00 65.20 ? 9 ASN D CG 1 +ATOM 17110 O OD1 . ASN D 1 9 ? 53.153 22.686 37.268 1.00 65.96 ? 9 ASN D OD1 1 +ATOM 17111 N ND2 . ASN D 1 9 ? 53.389 24.429 35.855 1.00 64.25 ? 9 ASN D ND2 1 +ATOM 17112 N N . LYS D 1 10 ? 50.856 24.798 34.303 1.00 60.56 ? 10 LYS D N 1 +ATOM 17113 C CA . LYS D 1 10 ? 50.384 24.031 33.158 1.00 60.36 ? 10 LYS D CA 1 +ATOM 17114 C C . LYS D 1 10 ? 48.880 24.155 32.942 1.00 58.77 ? 10 LYS D C 1 +ATOM 17115 O O . LYS D 1 10 ? 48.193 23.147 32.782 1.00 57.94 ? 10 LYS D O 1 +ATOM 17116 C CB . LYS D 1 10 ? 50.718 22.551 33.339 1.00 62.94 ? 10 LYS D CB 1 +ATOM 17117 C CG . LYS D 1 10 ? 52.185 22.185 33.320 1.00 65.76 ? 10 LYS D CG 1 +ATOM 17118 C CD . LYS D 1 10 ? 52.294 20.686 33.561 1.00 69.43 ? 10 LYS D CD 1 +ATOM 17119 C CE . LYS D 1 10 ? 53.682 20.147 33.306 1.00 71.72 ? 10 LYS D CE 1 +ATOM 17120 N NZ . LYS D 1 10 ? 53.727 18.673 33.544 1.00 73.47 ? 10 LYS D NZ 1 +ATOM 17121 N N . GLY D 1 11 ? 48.369 25.380 32.949 1.00 57.09 ? 11 GLY D N 1 +ATOM 17122 C CA . GLY D 1 11 ? 46.946 25.577 32.729 1.00 54.89 ? 11 GLY D CA 1 +ATOM 17123 C C . GLY D 1 11 ? 46.048 24.846 33.710 1.00 52.55 ? 11 GLY D C 1 +ATOM 17124 O O . GLY D 1 11 ? 44.928 24.468 33.383 1.00 51.95 ? 11 GLY D O 1 +ATOM 17125 N N . VAL D 1 12 ? 46.553 24.618 34.912 1.00 50.23 ? 12 VAL D N 1 +ATOM 17126 C CA . VAL D 1 12 ? 45.765 23.974 35.945 1.00 47.51 ? 12 VAL D CA 1 +ATOM 17127 C C . VAL D 1 12 ? 45.880 24.816 37.205 1.00 47.66 ? 12 VAL D C 1 +ATOM 17128 O O . VAL D 1 12 ? 46.971 24.992 37.746 1.00 48.25 ? 12 VAL D O 1 +ATOM 17129 C CB . VAL D 1 12 ? 46.258 22.557 36.244 1.00 45.96 ? 12 VAL D CB 1 +ATOM 17130 C CG1 . VAL D 1 12 ? 45.593 22.040 37.503 1.00 44.21 ? 12 VAL D CG1 1 +ATOM 17131 C CG2 . VAL D 1 12 ? 45.939 21.647 35.074 1.00 45.67 ? 12 VAL D CG2 1 +ATOM 17132 N N . TYR D 1 13 ? 44.751 25.356 37.650 1.00 46.93 ? 13 TYR D N 1 +ATOM 17133 C CA . TYR D 1 13 ? 44.707 26.172 38.849 1.00 46.32 ? 13 TYR D CA 1 +ATOM 17134 C C . TYR D 1 13 ? 44.116 25.351 39.982 1.00 45.64 ? 13 TYR D C 1 +ATOM 17135 O O . TYR D 1 13 ? 43.043 24.773 39.839 1.00 47.51 ? 13 TYR D O 1 +ATOM 17136 C CB . TYR D 1 13 ? 43.833 27.405 38.631 1.00 48.95 ? 13 TYR D CB 1 +ATOM 17137 C CG . TYR D 1 13 ? 44.268 28.270 37.478 1.00 52.36 ? 13 TYR D CG 1 +ATOM 17138 C CD1 . TYR D 1 13 ? 44.064 27.861 36.164 1.00 53.02 ? 13 TYR D CD1 1 +ATOM 17139 C CD2 . TYR D 1 13 ? 44.908 29.489 37.699 1.00 53.33 ? 13 TYR D CD2 1 +ATOM 17140 C CE1 . TYR D 1 13 ? 44.490 28.639 35.094 1.00 54.63 ? 13 TYR D CE1 1 +ATOM 17141 C CE2 . TYR D 1 13 ? 45.336 30.276 36.636 1.00 55.18 ? 13 TYR D CE2 1 +ATOM 17142 C CZ . TYR D 1 13 ? 45.124 29.843 35.336 1.00 55.71 ? 13 TYR D CZ 1 +ATOM 17143 O OH . TYR D 1 13 ? 45.550 30.610 34.274 1.00 58.07 ? 13 TYR D OH 1 +ATOM 17144 N N . LYS D 1 14 ? 44.820 25.290 41.102 1.00 42.95 ? 14 LYS D N 1 +ATOM 17145 C CA . LYS D 1 14 ? 44.332 24.555 42.246 1.00 41.12 ? 14 LYS D CA 1 +ATOM 17146 C C . LYS D 1 14 ? 43.783 25.578 43.226 1.00 41.25 ? 14 LYS D C 1 +ATOM 17147 O O . LYS D 1 14 ? 44.533 26.397 43.762 1.00 39.94 ? 14 LYS D O 1 +ATOM 17148 C CB . LYS D 1 14 ? 45.464 23.758 42.903 1.00 40.90 ? 14 LYS D CB 1 +ATOM 17149 C CG . LYS D 1 14 ? 45.018 23.005 44.144 1.00 40.65 ? 14 LYS D CG 1 +ATOM 17150 C CD . LYS D 1 14 ? 46.118 22.155 44.738 1.00 41.56 ? 14 LYS D CD 1 +ATOM 17151 C CE . LYS D 1 14 ? 45.592 21.397 45.952 1.00 43.11 ? 14 LYS D CE 1 +ATOM 17152 N NZ . LYS D 1 14 ? 46.577 20.421 46.495 1.00 45.31 ? 14 LYS D NZ 1 +ATOM 17153 N N . VAL D 1 15 ? 42.472 25.538 43.449 1.00 39.84 ? 15 VAL D N 1 +ATOM 17154 C CA . VAL D 1 15 ? 41.829 26.466 44.367 1.00 38.15 ? 15 VAL D CA 1 +ATOM 17155 C C . VAL D 1 15 ? 41.587 25.772 45.691 1.00 38.27 ? 15 VAL D C 1 +ATOM 17156 O O . VAL D 1 15 ? 40.934 24.737 45.746 1.00 39.94 ? 15 VAL D O 1 +ATOM 17157 C CB . VAL D 1 15 ? 40.489 26.972 43.795 1.00 37.84 ? 15 VAL D CB 1 +ATOM 17158 C CG1 . VAL D 1 15 ? 39.846 27.960 44.752 1.00 36.33 ? 15 VAL D CG1 1 +ATOM 17159 C CG2 . VAL D 1 15 ? 40.719 27.609 42.447 1.00 34.76 ? 15 VAL D CG2 1 +ATOM 17160 N N . VAL D 1 16 ? 42.123 26.341 46.763 1.00 39.33 ? 16 VAL D N 1 +ATOM 17161 C CA . VAL D 1 16 ? 41.971 25.767 48.093 1.00 38.52 ? 16 VAL D CA 1 +ATOM 17162 C C . VAL D 1 16 ? 41.113 26.672 48.963 1.00 39.94 ? 16 VAL D C 1 +ATOM 17163 O O . VAL D 1 16 ? 41.438 27.839 49.161 1.00 40.02 ? 16 VAL D O 1 +ATOM 17164 C CB . VAL D 1 16 ? 43.344 25.584 48.779 1.00 39.14 ? 16 VAL D CB 1 +ATOM 17165 C CG1 . VAL D 1 16 ? 43.159 24.960 50.152 1.00 38.74 ? 16 VAL D CG1 1 +ATOM 17166 C CG2 . VAL D 1 16 ? 44.259 24.729 47.913 1.00 37.72 ? 16 VAL D CG2 1 +ATOM 17167 N N . ILE D 1 17 ? 40.009 26.132 49.466 1.00 41.23 ? 17 ILE D N 1 +ATOM 17168 C CA . ILE D 1 17 ? 39.109 26.880 50.329 1.00 41.96 ? 17 ILE D CA 1 +ATOM 17169 C C . ILE D 1 17 ? 39.260 26.325 51.734 1.00 41.91 ? 17 ILE D C 1 +ATOM 17170 O O . ILE D 1 17 ? 39.017 25.143 51.972 1.00 40.75 ? 17 ILE D O 1 +ATOM 17171 C CB . ILE D 1 17 ? 37.643 26.714 49.882 1.00 44.09 ? 17 ILE D CB 1 +ATOM 17172 C CG1 . ILE D 1 17 ? 37.500 27.119 48.417 1.00 44.29 ? 17 ILE D CG1 1 +ATOM 17173 C CG2 . ILE D 1 17 ? 36.724 27.551 50.772 1.00 43.37 ? 17 ILE D CG2 1 +ATOM 17174 C CD1 . ILE D 1 17 ? 37.888 28.551 48.146 1.00 45.35 ? 17 ILE D CD1 1 +ATOM 17175 N N . GLY D 1 18 ? 39.669 27.179 52.665 1.00 43.99 ? 18 GLY D N 1 +ATOM 17176 C CA . GLY D 1 18 ? 39.856 26.738 54.036 1.00 45.94 ? 18 GLY D CA 1 +ATOM 17177 C C . GLY D 1 18 ? 41.054 25.815 54.148 1.00 48.01 ? 18 GLY D C 1 +ATOM 17178 O O . GLY D 1 18 ? 42.063 26.028 53.483 1.00 47.19 ? 18 GLY D O 1 +ATOM 17179 N N . GLU D 1 19 ? 40.936 24.782 54.979 1.00 50.83 ? 19 GLU D N 1 +ATOM 17180 C CA . GLU D 1 19 ? 42.012 23.815 55.183 1.00 53.46 ? 19 GLU D CA 1 +ATOM 17181 C C . GLU D 1 19 ? 41.484 22.423 54.868 1.00 52.48 ? 19 GLU D C 1 +ATOM 17182 O O . GLU D 1 19 ? 41.153 21.652 55.765 1.00 53.00 ? 19 GLU D O 1 +ATOM 17183 C CB . GLU D 1 19 ? 42.498 23.893 56.630 1.00 57.23 ? 19 GLU D CB 1 +ATOM 17184 C CG . GLU D 1 19 ? 43.061 25.269 56.972 1.00 63.93 ? 19 GLU D CG 1 +ATOM 17185 C CD . GLU D 1 19 ? 43.236 25.498 58.464 1.00 68.39 ? 19 GLU D CD 1 +ATOM 17186 O OE1 . GLU D 1 19 ? 42.214 25.487 59.195 1.00 70.54 ? 19 GLU D OE1 1 +ATOM 17187 O OE2 . GLU D 1 19 ? 44.395 25.696 58.902 1.00 69.78 ? 19 GLU D OE2 1 +ATOM 17188 N N . PRO D 1 20 ? 41.407 22.088 53.573 1.00 51.84 ? 20 PRO D N 1 +ATOM 17189 C CA . PRO D 1 20 ? 40.919 20.805 53.056 1.00 50.60 ? 20 PRO D CA 1 +ATOM 17190 C C . PRO D 1 20 ? 41.694 19.573 53.485 1.00 48.90 ? 20 PRO D C 1 +ATOM 17191 O O . PRO D 1 20 ? 42.903 19.626 53.703 1.00 48.99 ? 20 PRO D O 1 +ATOM 17192 C CB . PRO D 1 20 ? 40.984 20.989 51.537 1.00 49.57 ? 20 PRO D CB 1 +ATOM 17193 C CG . PRO D 1 20 ? 40.912 22.469 51.354 1.00 51.11 ? 20 PRO D CG 1 +ATOM 17194 C CD . PRO D 1 20 ? 41.788 22.975 52.462 1.00 51.75 ? 20 PRO D CD 1 +ATOM 17195 N N . PHE D 1 21 ? 40.970 18.463 53.585 1.00 47.77 ? 21 PHE D N 1 +ATOM 17196 C CA . PHE D 1 21 ? 41.528 17.163 53.924 1.00 44.77 ? 21 PHE D CA 1 +ATOM 17197 C C . PHE D 1 21 ? 40.942 16.268 52.832 1.00 43.52 ? 21 PHE D C 1 +ATOM 17198 O O . PHE D 1 21 ? 39.937 15.587 53.041 1.00 44.39 ? 21 PHE D O 1 +ATOM 17199 C CB . PHE D 1 21 ? 41.042 16.712 55.297 1.00 44.03 ? 21 PHE D CB 1 +ATOM 17200 C CG . PHE D 1 21 ? 41.793 15.538 55.843 1.00 45.31 ? 21 PHE D CG 1 +ATOM 17201 C CD1 . PHE D 1 21 ? 43.098 15.690 56.312 1.00 45.47 ? 21 PHE D CD1 1 +ATOM 17202 C CD2 . PHE D 1 21 ? 41.209 14.275 55.871 1.00 44.58 ? 21 PHE D CD2 1 +ATOM 17203 C CE1 . PHE D 1 21 ? 43.812 14.597 56.804 1.00 45.08 ? 21 PHE D CE1 1 +ATOM 17204 C CE2 . PHE D 1 21 ? 41.911 13.173 56.358 1.00 46.47 ? 21 PHE D CE2 1 +ATOM 17205 C CZ . PHE D 1 21 ? 43.219 13.334 56.828 1.00 46.32 ? 21 PHE D CZ 1 +ATOM 17206 N N . PRO D 1 22 ? 41.563 16.269 51.642 1.00 41.88 ? 22 PRO D N 1 +ATOM 17207 C CA . PRO D 1 22 ? 41.136 15.486 50.478 1.00 40.73 ? 22 PRO D CA 1 +ATOM 17208 C C . PRO D 1 22 ? 41.002 13.999 50.738 1.00 39.98 ? 22 PRO D C 1 +ATOM 17209 O O . PRO D 1 22 ? 41.729 13.446 51.553 1.00 40.42 ? 22 PRO D O 1 +ATOM 17210 C CB . PRO D 1 22 ? 42.228 15.764 49.450 1.00 42.41 ? 22 PRO D CB 1 +ATOM 17211 C CG . PRO D 1 22 ? 42.856 17.039 49.915 1.00 42.70 ? 22 PRO D CG 1 +ATOM 17212 C CD . PRO D 1 22 ? 42.877 16.881 51.393 1.00 41.30 ? 22 PRO D CD 1 +ATOM 17213 N N . PRO D 1 23 ? 40.069 13.327 50.039 1.00 39.97 ? 23 PRO D N 1 +ATOM 17214 C CA . PRO D 1 23 ? 39.870 11.881 50.214 1.00 38.99 ? 23 PRO D CA 1 +ATOM 17215 C C . PRO D 1 23 ? 41.139 11.161 49.749 1.00 39.27 ? 23 PRO D C 1 +ATOM 17216 O O . PRO D 1 23 ? 41.455 10.058 50.191 1.00 39.07 ? 23 PRO D O 1 +ATOM 17217 C CB . PRO D 1 23 ? 38.670 11.592 49.319 1.00 38.39 ? 23 PRO D CB 1 +ATOM 17218 C CG . PRO D 1 23 ? 38.818 12.608 48.227 1.00 37.92 ? 23 PRO D CG 1 +ATOM 17219 C CD . PRO D 1 23 ? 39.171 13.855 48.996 1.00 38.38 ? 23 PRO D CD 1 +ATOM 17220 N N . ILE D 1 24 ? 41.858 11.813 48.847 1.00 38.80 ? 24 ILE D N 1 +ATOM 17221 C CA . ILE D 1 24 ? 43.105 11.298 48.326 1.00 41.40 ? 24 ILE D CA 1 +ATOM 17222 C C . ILE D 1 24 ? 43.900 12.508 47.866 1.00 43.35 ? 24 ILE D C 1 +ATOM 17223 O O . ILE D 1 24 ? 43.328 13.484 47.380 1.00 43.51 ? 24 ILE D O 1 +ATOM 17224 C CB . ILE D 1 24 ? 42.895 10.319 47.137 1.00 42.29 ? 24 ILE D CB 1 +ATOM 17225 C CG1 . ILE D 1 24 ? 44.260 9.866 46.608 1.00 41.96 ? 24 ILE D CG1 1 +ATOM 17226 C CG2 . ILE D 1 24 ? 42.086 10.983 46.025 1.00 40.22 ? 24 ILE D CG2 1 +ATOM 17227 C CD1 . ILE D 1 24 ? 44.194 8.747 45.597 1.00 41.85 ? 24 ILE D CD1 1 +ATOM 17228 N N . GLU D 1 25 ? 45.214 12.456 48.031 1.00 45.32 ? 25 GLU D N 1 +ATOM 17229 C CA . GLU D 1 25 ? 46.052 13.575 47.638 1.00 49.10 ? 25 GLU D CA 1 +ATOM 17230 C C . GLU D 1 25 ? 46.648 13.379 46.262 1.00 49.87 ? 25 GLU D C 1 +ATOM 17231 O O . GLU D 1 25 ? 47.260 12.350 45.971 1.00 50.01 ? 25 GLU D O 1 +ATOM 17232 C CB . GLU D 1 25 ? 47.167 13.794 48.664 1.00 50.82 ? 25 GLU D CB 1 +ATOM 17233 C CG . GLU D 1 25 ? 46.654 14.207 50.034 1.00 55.93 ? 25 GLU D CG 1 +ATOM 17234 C CD . GLU D 1 25 ? 47.768 14.447 51.038 1.00 59.11 ? 25 GLU D CD 1 +ATOM 17235 O OE1 . GLU D 1 25 ? 48.546 13.500 51.309 1.00 60.76 ? 25 GLU D OE1 1 +ATOM 17236 O OE2 . GLU D 1 25 ? 47.861 15.587 51.557 1.00 60.28 ? 25 GLU D OE2 1 +ATOM 17237 N N . PHE D 1 26 ? 46.445 14.371 45.409 1.00 51.36 ? 26 PHE D N 1 +ATOM 17238 C CA . PHE D 1 26 ? 46.966 14.330 44.054 1.00 54.51 ? 26 PHE D CA 1 +ATOM 17239 C C . PHE D 1 26 ? 48.151 15.277 43.967 1.00 57.75 ? 26 PHE D C 1 +ATOM 17240 O O . PHE D 1 26 ? 48.016 16.487 44.146 1.00 56.86 ? 26 PHE D O 1 +ATOM 17241 C CB . PHE D 1 26 ? 45.884 14.733 43.046 1.00 51.71 ? 26 PHE D CB 1 +ATOM 17242 C CG . PHE D 1 26 ? 44.749 13.748 42.952 1.00 50.34 ? 26 PHE D CG 1 +ATOM 17243 C CD1 . PHE D 1 26 ? 44.984 12.430 42.556 1.00 48.57 ? 26 PHE D CD1 1 +ATOM 17244 C CD2 . PHE D 1 26 ? 43.448 14.131 43.275 1.00 49.06 ? 26 PHE D CD2 1 +ATOM 17245 C CE1 . PHE D 1 26 ? 43.943 11.510 42.484 1.00 48.69 ? 26 PHE D CE1 1 +ATOM 17246 C CE2 . PHE D 1 26 ? 42.398 13.219 43.207 1.00 48.52 ? 26 PHE D CE2 1 +ATOM 17247 C CZ . PHE D 1 26 ? 42.643 11.906 42.811 1.00 48.13 ? 26 PHE D CZ 1 +ATOM 17248 N N . PRO D 1 27 ? 49.334 14.732 43.661 1.00 62.15 ? 27 PRO D N 1 +ATOM 17249 C CA . PRO D 1 27 ? 50.584 15.491 43.543 1.00 65.48 ? 27 PRO D CA 1 +ATOM 17250 C C . PRO D 1 27 ? 50.562 16.615 42.505 1.00 67.33 ? 27 PRO D C 1 +ATOM 17251 O O . PRO D 1 27 ? 49.943 16.488 41.445 1.00 68.50 ? 27 PRO D O 1 +ATOM 17252 C CB . PRO D 1 27 ? 51.600 14.408 43.187 1.00 64.40 ? 27 PRO D CB 1 +ATOM 17253 C CG . PRO D 1 27 ? 50.784 13.506 42.298 1.00 64.03 ? 27 PRO D CG 1 +ATOM 17254 C CD . PRO D 1 27 ? 49.500 13.375 43.103 1.00 63.34 ? 27 PRO D CD 1 +ATOM 17255 N N . LEU D 1 28 ? 51.242 17.712 42.828 1.00 69.37 ? 28 LEU D N 1 +ATOM 17256 C CA . LEU D 1 28 ? 51.358 18.864 41.932 1.00 71.52 ? 28 LEU D CA 1 +ATOM 17257 C C . LEU D 1 28 ? 52.872 19.147 41.809 1.00 72.61 ? 28 LEU D C 1 +ATOM 17258 O O . LEU D 1 28 ? 53.506 19.602 42.771 1.00 72.51 ? 28 LEU D O 1 +ATOM 17259 C CB . LEU D 1 28 ? 50.627 20.074 42.526 1.00 71.18 ? 28 LEU D CB 1 +ATOM 17260 C CG . LEU D 1 28 ? 50.044 21.105 41.549 1.00 72.16 ? 28 LEU D CG 1 +ATOM 17261 C CD1 . LEU D 1 28 ? 51.071 21.432 40.464 1.00 73.04 ? 28 LEU D CD1 1 +ATOM 17262 C CD2 . LEU D 1 28 ? 48.768 20.560 40.917 1.00 71.02 ? 28 LEU D CD2 1 +ATOM 17263 N N . GLU D 1 29 ? 53.442 18.876 40.633 1.00 73.54 ? 29 GLU D N 1 +ATOM 17264 C CA . GLU D 1 29 ? 54.880 19.050 40.398 1.00 74.48 ? 29 GLU D CA 1 +ATOM 17265 C C . GLU D 1 29 ? 55.423 20.469 40.310 1.00 74.99 ? 29 GLU D C 1 +ATOM 17266 O O . GLU D 1 29 ? 56.575 20.675 39.930 1.00 75.07 ? 29 GLU D O 1 +ATOM 17267 C CB . GLU D 1 29 ? 55.302 18.270 39.156 1.00 74.15 ? 29 GLU D CB 1 +ATOM 17268 C CG . GLU D 1 29 ? 54.346 18.376 37.996 1.00 75.43 ? 29 GLU D CG 1 +ATOM 17269 C CD . GLU D 1 29 ? 54.725 17.436 36.871 1.00 76.15 ? 29 GLU D CD 1 +ATOM 17270 O OE1 . GLU D 1 29 ? 55.016 16.255 37.167 1.00 75.98 ? 29 GLU D OE1 1 +ATOM 17271 O OE2 . GLU D 1 29 ? 54.728 17.870 35.698 1.00 76.25 ? 29 GLU D OE2 1 +ATOM 17272 N N . GLN D 1 30 ? 54.595 21.438 40.675 1.00 76.04 ? 30 GLN D N 1 +ATOM 17273 C CA . GLN D 1 30 ? 54.982 22.842 40.675 1.00 76.32 ? 30 GLN D CA 1 +ATOM 17274 C C . GLN D 1 30 ? 53.923 23.651 41.391 1.00 76.48 ? 30 GLN D C 1 +ATOM 17275 O O . GLN D 1 30 ? 52.893 23.988 40.806 1.00 77.27 ? 30 GLN D O 1 +ATOM 17276 C CB . GLN D 1 30 ? 55.141 23.372 39.247 1.00 76.85 ? 30 GLN D CB 1 +ATOM 17277 C CG . GLN D 1 30 ? 56.556 23.299 38.684 1.00 78.01 ? 30 GLN D CG 1 +ATOM 17278 C CD . GLN D 1 30 ? 57.516 24.272 39.355 1.00 78.39 ? 30 GLN D CD 1 +ATOM 17279 O OE1 . GLN D 1 30 ? 57.786 24.169 40.551 1.00 79.72 ? 30 GLN D OE1 1 +ATOM 17280 N NE2 . GLN D 1 30 ? 58.036 25.224 38.581 1.00 77.49 ? 30 GLN D NE2 1 +ATOM 17281 N N . LYS D 1 31 ? 54.161 23.944 42.664 1.00 76.43 ? 31 LYS D N 1 +ATOM 17282 C CA . LYS D 1 31 ? 53.217 24.744 43.426 1.00 76.21 ? 31 LYS D CA 1 +ATOM 17283 C C . LYS D 1 31 ? 53.653 26.204 43.398 1.00 74.99 ? 31 LYS D C 1 +ATOM 17284 O O . LYS D 1 31 ? 54.359 26.679 44.290 1.00 75.35 ? 31 LYS D O 1 +ATOM 17285 C CB . LYS D 1 31 ? 53.095 24.240 44.871 1.00 77.68 ? 31 LYS D CB 1 +ATOM 17286 C CG . LYS D 1 31 ? 51.965 23.220 45.071 1.00 79.58 ? 31 LYS D CG 1 +ATOM 17287 C CD . LYS D 1 31 ? 51.747 22.887 46.552 1.00 81.24 ? 31 LYS D CD 1 +ATOM 17288 C CE . LYS D 1 31 ? 50.533 21.970 46.778 1.00 81.55 ? 31 LYS D CE 1 +ATOM 17289 N NZ . LYS D 1 31 ? 50.676 20.616 46.158 1.00 80.76 ? 31 LYS D NZ 1 +ATOM 17290 N N . ILE D 1 32 ? 53.222 26.898 42.347 1.00 73.24 ? 32 ILE D N 1 +ATOM 17291 C CA . ILE D 1 32 ? 53.518 28.313 42.128 1.00 71.08 ? 32 ILE D CA 1 +ATOM 17292 C C . ILE D 1 32 ? 52.250 29.109 42.411 1.00 69.42 ? 32 ILE D C 1 +ATOM 17293 O O . ILE D 1 32 ? 51.213 28.839 41.810 1.00 68.74 ? 32 ILE D O 1 +ATOM 17294 C CB . ILE D 1 32 ? 53.909 28.569 40.657 1.00 71.12 ? 32 ILE D CB 1 +ATOM 17295 C CG1 . ILE D 1 32 ? 54.975 27.564 40.217 1.00 71.12 ? 32 ILE D CG1 1 +ATOM 17296 C CG2 . ILE D 1 32 ? 54.399 29.994 40.491 1.00 69.78 ? 32 ILE D CG2 1 +ATOM 17297 C CD1 . ILE D 1 32 ? 55.220 27.543 38.722 1.00 71.94 ? 32 ILE D CD1 1 +ATOM 17298 N N . SER D 1 33 ? 52.320 30.080 43.317 1.00 68.83 ? 33 SER D N 1 +ATOM 17299 C CA . SER D 1 33 ? 51.142 30.890 43.625 1.00 68.31 ? 33 SER D CA 1 +ATOM 17300 C C . SER D 1 33 ? 50.688 31.665 42.395 1.00 68.17 ? 33 SER D C 1 +ATOM 17301 O O . SER D 1 33 ? 51.474 32.361 41.755 1.00 68.46 ? 33 SER D O 1 +ATOM 17302 C CB . SER D 1 33 ? 51.420 31.848 44.780 1.00 67.51 ? 33 SER D CB 1 +ATOM 17303 O OG . SER D 1 33 ? 51.354 31.158 46.015 1.00 67.10 ? 33 SER D OG 1 +ATOM 17304 N N . SER D 1 34 ? 49.405 31.538 42.081 1.00 68.09 ? 34 SER D N 1 +ATOM 17305 C CA . SER D 1 34 ? 48.816 32.170 40.908 1.00 68.16 ? 34 SER D CA 1 +ATOM 17306 C C . SER D 1 34 ? 48.494 33.655 41.015 1.00 68.68 ? 34 SER D C 1 +ATOM 17307 O O . SER D 1 34 ? 48.235 34.188 42.097 1.00 68.62 ? 34 SER D O 1 +ATOM 17308 C CB . SER D 1 34 ? 47.547 31.410 40.513 1.00 67.21 ? 34 SER D CB 1 +ATOM 17309 O OG . SER D 1 34 ? 46.902 32.021 39.414 1.00 65.81 ? 34 SER D OG 1 +ATOM 17310 N N . ASN D 1 35 ? 48.510 34.311 39.861 1.00 69.17 ? 35 ASN D N 1 +ATOM 17311 C CA . ASN D 1 35 ? 48.201 35.730 39.760 1.00 70.31 ? 35 ASN D CA 1 +ATOM 17312 C C . ASN D 1 35 ? 46.694 35.905 39.551 1.00 68.69 ? 35 ASN D C 1 +ATOM 17313 O O . ASN D 1 35 ? 46.088 36.834 40.099 1.00 69.06 ? 35 ASN D O 1 +ATOM 17314 C CB . ASN D 1 35 ? 48.980 36.355 38.597 1.00 73.41 ? 35 ASN D CB 1 +ATOM 17315 C CG . ASN D 1 35 ? 49.016 35.458 37.368 1.00 76.33 ? 35 ASN D CG 1 +ATOM 17316 O OD1 . ASN D 1 35 ? 49.675 34.411 37.364 1.00 77.49 ? 35 ASN D OD1 1 +ATOM 17317 N ND2 . ASN D 1 35 ? 48.302 35.860 36.321 1.00 77.68 ? 35 ASN D ND2 1 +ATOM 17318 N N . LYS D 1 36 ? 46.097 35.009 38.762 1.00 66.09 ? 36 LYS D N 1 +ATOM 17319 C CA . LYS D 1 36 ? 44.657 35.046 38.502 1.00 63.30 ? 36 LYS D CA 1 +ATOM 17320 C C . LYS D 1 36 ? 43.823 34.951 39.782 1.00 60.42 ? 36 LYS D C 1 +ATOM 17321 O O . LYS D 1 36 ? 44.156 34.228 40.716 1.00 59.88 ? 36 LYS D O 1 +ATOM 17322 C CB . LYS D 1 36 ? 44.241 33.911 37.561 1.00 63.45 ? 36 LYS D CB 1 +ATOM 17323 C CG . LYS D 1 36 ? 44.291 34.271 36.091 1.00 64.57 ? 36 LYS D CG 1 +ATOM 17324 C CD . LYS D 1 36 ? 43.567 33.229 35.255 1.00 65.47 ? 36 LYS D CD 1 +ATOM 17325 C CE . LYS D 1 36 ? 43.555 33.613 33.781 1.00 66.68 ? 36 LYS D CE 1 +ATOM 17326 N NZ . LYS D 1 36 ? 42.785 32.643 32.949 1.00 68.51 ? 36 LYS D NZ 1 +ATOM 17327 N N . SER D 1 37 ? 42.729 35.695 39.813 1.00 57.31 ? 37 SER D N 1 +ATOM 17328 C CA . SER D 1 37 ? 41.847 35.700 40.963 1.00 54.48 ? 37 SER D CA 1 +ATOM 17329 C C . SER D 1 37 ? 40.586 34.906 40.638 1.00 53.06 ? 37 SER D C 1 +ATOM 17330 O O . SER D 1 37 ? 40.408 34.448 39.509 1.00 51.64 ? 37 SER D O 1 +ATOM 17331 C CB . SER D 1 37 ? 41.472 37.137 41.307 1.00 53.88 ? 37 SER D CB 1 +ATOM 17332 O OG . SER D 1 37 ? 40.810 37.750 40.215 1.00 52.50 ? 37 SER D OG 1 +ATOM 17333 N N . LEU D 1 38 ? 39.717 34.748 41.631 1.00 51.64 ? 38 LEU D N 1 +ATOM 17334 C CA . LEU D 1 38 ? 38.468 34.032 41.443 1.00 51.37 ? 38 LEU D CA 1 +ATOM 17335 C C . LEU D 1 38 ? 37.630 34.693 40.364 1.00 51.87 ? 38 LEU D C 1 +ATOM 17336 O O . LEU D 1 38 ? 37.075 34.010 39.498 1.00 51.27 ? 38 LEU D O 1 +ATOM 17337 C CB . LEU D 1 38 ? 37.681 33.988 42.747 1.00 50.95 ? 38 LEU D CB 1 +ATOM 17338 C CG . LEU D 1 38 ? 38.271 33.040 43.787 1.00 51.62 ? 38 LEU D CG 1 +ATOM 17339 C CD1 . LEU D 1 38 ? 37.437 33.099 45.054 1.00 50.91 ? 38 LEU D CD1 1 +ATOM 17340 C CD2 . LEU D 1 38 ? 38.299 31.620 43.223 1.00 50.89 ? 38 LEU D CD2 1 +ATOM 17341 N N . SER D 1 39 ? 37.550 36.020 40.410 1.00 51.85 ? 39 SER D N 1 +ATOM 17342 C CA . SER D 1 39 ? 36.775 36.762 39.426 1.00 52.75 ? 39 SER D CA 1 +ATOM 17343 C C . SER D 1 39 ? 37.334 36.613 38.013 1.00 53.23 ? 39 SER D C 1 +ATOM 17344 O O . SER D 1 39 ? 36.570 36.610 37.049 1.00 54.78 ? 39 SER D O 1 +ATOM 17345 C CB . SER D 1 39 ? 36.674 38.248 39.811 1.00 53.57 ? 39 SER D CB 1 +ATOM 17346 O OG . SER D 1 39 ? 37.928 38.900 39.780 1.00 56.31 ? 39 SER D OG 1 +ATOM 17347 N N . GLU D 1 40 ? 38.652 36.496 37.868 1.00 52.81 ? 40 GLU D N 1 +ATOM 17348 C CA . GLU D 1 40 ? 39.220 36.314 36.530 1.00 53.53 ? 40 GLU D CA 1 +ATOM 17349 C C . GLU D 1 40 ? 38.940 34.872 36.136 1.00 52.01 ? 40 GLU D C 1 +ATOM 17350 O O . GLU D 1 40 ? 38.961 34.520 34.961 1.00 51.30 ? 40 GLU D O 1 +ATOM 17351 C CB . GLU D 1 40 ? 40.735 36.537 36.503 1.00 55.07 ? 40 GLU D CB 1 +ATOM 17352 C CG . GLU D 1 40 ? 41.199 37.923 36.886 1.00 60.25 ? 40 GLU D CG 1 +ATOM 17353 C CD . GLU D 1 40 ? 42.713 38.075 36.753 1.00 64.10 ? 40 GLU D CD 1 +ATOM 17354 O OE1 . GLU D 1 40 ? 43.194 38.249 35.611 1.00 66.81 ? 40 GLU D OE1 1 +ATOM 17355 O OE2 . GLU D 1 40 ? 43.426 38.002 37.783 1.00 65.56 ? 40 GLU D OE2 1 +ATOM 17356 N N . LEU D 1 41 ? 38.687 34.037 37.137 1.00 51.06 ? 41 LEU D N 1 +ATOM 17357 C CA . LEU D 1 41 ? 38.397 32.637 36.887 1.00 49.29 ? 41 LEU D CA 1 +ATOM 17358 C C . LEU D 1 41 ? 36.890 32.455 36.659 1.00 48.62 ? 41 LEU D C 1 +ATOM 17359 O O . LEU D 1 41 ? 36.436 31.377 36.268 1.00 46.86 ? 41 LEU D O 1 +ATOM 17360 C CB . LEU D 1 41 ? 38.878 31.798 38.074 1.00 48.32 ? 41 LEU D CB 1 +ATOM 17361 C CG . LEU D 1 41 ? 39.918 30.699 37.820 1.00 48.28 ? 41 LEU D CG 1 +ATOM 17362 C CD1 . LEU D 1 41 ? 40.889 31.090 36.733 1.00 47.93 ? 41 LEU D CD1 1 +ATOM 17363 C CD2 . LEU D 1 41 ? 40.655 30.426 39.120 1.00 46.96 ? 41 LEU D CD2 1 +ATOM 17364 N N . GLY D 1 42 ? 36.128 33.525 36.896 1.00 47.34 ? 42 GLY D N 1 +ATOM 17365 C CA . GLY D 1 42 ? 34.685 33.487 36.720 1.00 46.82 ? 42 GLY D CA 1 +ATOM 17366 C C . GLY D 1 42 ? 33.948 32.675 37.770 1.00 47.04 ? 42 GLY D C 1 +ATOM 17367 O O . GLY D 1 42 ? 32.883 32.121 37.498 1.00 48.25 ? 42 GLY D O 1 +ATOM 17368 N N . LEU D 1 43 ? 34.507 32.606 38.975 1.00 46.34 ? 43 LEU D N 1 +ATOM 17369 C CA . LEU D 1 43 ? 33.900 31.836 40.050 1.00 46.23 ? 43 LEU D CA 1 +ATOM 17370 C C . LEU D 1 43 ? 33.518 32.684 41.249 1.00 46.20 ? 43 LEU D C 1 +ATOM 17371 O O . LEU D 1 43 ? 34.114 33.721 41.511 1.00 46.60 ? 43 LEU D O 1 +ATOM 17372 C CB . LEU D 1 43 ? 34.854 30.734 40.512 1.00 44.75 ? 43 LEU D CB 1 +ATOM 17373 C CG . LEU D 1 43 ? 35.320 29.743 39.453 1.00 45.38 ? 43 LEU D CG 1 +ATOM 17374 C CD1 . LEU D 1 43 ? 36.308 28.778 40.073 1.00 44.81 ? 43 LEU D CD1 1 +ATOM 17375 C CD2 . LEU D 1 43 ? 34.117 28.989 38.883 1.00 46.31 ? 43 LEU D CD2 1 +ATOM 17376 N N . THR D 1 44 ? 32.505 32.221 41.966 1.00 47.14 ? 44 THR D N 1 +ATOM 17377 C CA . THR D 1 44 ? 32.019 32.877 43.167 1.00 47.79 ? 44 THR D CA 1 +ATOM 17378 C C . THR D 1 44 ? 32.046 31.773 44.201 1.00 47.71 ? 44 THR D C 1 +ATOM 17379 O O . THR D 1 44 ? 31.668 30.651 43.903 1.00 47.78 ? 44 THR D O 1 +ATOM 17380 C CB . THR D 1 44 ? 30.569 33.378 42.998 1.00 48.64 ? 44 THR D CB 1 +ATOM 17381 O OG1 . THR D 1 44 ? 30.547 34.471 42.075 1.00 50.65 ? 44 THR D OG1 1 +ATOM 17382 C CG2 . THR D 1 44 ? 29.998 33.839 44.329 1.00 48.30 ? 44 THR D CG2 1 +ATOM 17383 N N . ILE D 1 45 ? 32.499 32.078 45.407 1.00 48.18 ? 45 ILE D N 1 +ATOM 17384 C CA . ILE D 1 45 ? 32.564 31.065 46.442 1.00 49.53 ? 45 ILE D CA 1 +ATOM 17385 C C . ILE D 1 45 ? 31.958 31.545 47.745 1.00 50.52 ? 45 ILE D C 1 +ATOM 17386 O O . ILE D 1 45 ? 32.134 32.694 48.140 1.00 51.09 ? 45 ILE D O 1 +ATOM 17387 C CB . ILE D 1 45 ? 34.017 30.620 46.663 1.00 49.28 ? 45 ILE D CB 1 +ATOM 17388 C CG1 . ILE D 1 45 ? 34.550 30.010 45.366 1.00 50.03 ? 45 ILE D CG1 1 +ATOM 17389 C CG2 . ILE D 1 45 ? 34.096 29.626 47.806 1.00 49.45 ? 45 ILE D CG2 1 +ATOM 17390 C CD1 . ILE D 1 45 ? 35.976 29.530 45.447 1.00 51.87 ? 45 ILE D CD1 1 +ATOM 17391 N N . VAL D 1 46 ? 31.229 30.652 48.401 1.00 52.58 ? 46 VAL D N 1 +ATOM 17392 C CA . VAL D 1 46 ? 30.573 30.962 49.664 1.00 54.38 ? 46 VAL D CA 1 +ATOM 17393 C C . VAL D 1 46 ? 30.780 29.835 50.665 1.00 56.60 ? 46 VAL D C 1 +ATOM 17394 O O . VAL D 1 46 ? 30.685 28.662 50.315 1.00 56.85 ? 46 VAL D O 1 +ATOM 17395 C CB . VAL D 1 46 ? 29.054 31.165 49.462 1.00 53.14 ? 46 VAL D CB 1 +ATOM 17396 C CG1 . VAL D 1 46 ? 28.369 31.346 50.795 1.00 52.90 ? 46 VAL D CG1 1 +ATOM 17397 C CG2 . VAL D 1 46 ? 28.808 32.364 48.578 1.00 52.91 ? 46 VAL D CG2 1 +ATOM 17398 N N . GLN D 1 47 ? 31.078 30.201 51.906 1.00 59.31 ? 47 GLN D N 1 +ATOM 17399 C CA . GLN D 1 47 ? 31.273 29.229 52.973 1.00 62.74 ? 47 GLN D CA 1 +ATOM 17400 C C . GLN D 1 47 ? 30.184 29.443 54.011 1.00 64.66 ? 47 GLN D C 1 +ATOM 17401 O O . GLN D 1 47 ? 30.038 30.538 54.551 1.00 64.78 ? 47 GLN D O 1 +ATOM 17402 C CB . GLN D 1 47 ? 32.642 29.404 53.628 1.00 63.27 ? 47 GLN D CB 1 +ATOM 17403 C CG . GLN D 1 47 ? 33.779 28.738 52.882 1.00 65.44 ? 47 GLN D CG 1 +ATOM 17404 C CD . GLN D 1 47 ? 35.117 28.896 53.593 1.00 66.42 ? 47 GLN D CD 1 +ATOM 17405 O OE1 . GLN D 1 47 ? 35.704 29.981 53.603 1.00 66.77 ? 47 GLN D OE1 1 +ATOM 17406 N NE2 . GLN D 1 47 ? 35.601 27.813 54.196 1.00 64.91 ? 47 GLN D NE2 1 +ATOM 17407 N N . GLN D 1 48 ? 29.414 28.396 54.283 1.00 66.81 ? 48 GLN D N 1 +ATOM 17408 C CA . GLN D 1 48 ? 28.333 28.485 55.251 1.00 68.33 ? 48 GLN D CA 1 +ATOM 17409 C C . GLN D 1 48 ? 28.383 27.372 56.285 1.00 68.89 ? 48 GLN D C 1 +ATOM 17410 O O . GLN D 1 48 ? 29.460 26.920 56.687 1.00 69.17 ? 48 GLN D O 1 +ATOM 17411 C CB . GLN D 1 48 ? 26.985 28.453 54.533 1.00 69.79 ? 48 GLN D CB 1 +ATOM 17412 C CG . GLN D 1 48 ? 26.725 29.667 53.665 1.00 72.21 ? 48 GLN D CG 1 +ATOM 17413 C CD . GLN D 1 48 ? 25.403 29.580 52.927 1.00 74.45 ? 48 GLN D CD 1 +ATOM 17414 O OE1 . GLN D 1 48 ? 25.019 30.505 52.205 1.00 75.20 ? 48 GLN D OE1 1 +ATOM 17415 N NE2 . GLN D 1 48 ? 24.698 28.463 53.101 1.00 74.52 ? 48 GLN D NE2 1 +ATOM 17416 N N . GLY D 1 49 ? 27.203 26.941 56.715 1.00 68.66 ? 49 GLY D N 1 +ATOM 17417 C CA . GLY D 1 49 ? 27.115 25.890 57.708 1.00 67.86 ? 49 GLY D CA 1 +ATOM 17418 C C . GLY D 1 49 ? 27.776 24.610 57.250 1.00 66.88 ? 49 GLY D C 1 +ATOM 17419 O O . GLY D 1 49 ? 27.100 23.698 56.771 1.00 67.75 ? 49 GLY D O 1 +ATOM 17420 N N . ASN D 1 50 ? 29.097 24.542 57.396 1.00 64.97 ? 50 ASN D N 1 +ATOM 17421 C CA . ASN D 1 50 ? 29.855 23.361 57.000 1.00 62.45 ? 50 ASN D CA 1 +ATOM 17422 C C . ASN D 1 50 ? 29.654 22.994 55.539 1.00 59.29 ? 50 ASN D C 1 +ATOM 17423 O O . ASN D 1 50 ? 29.669 21.817 55.186 1.00 58.39 ? 50 ASN D O 1 +ATOM 17424 C CB . ASN D 1 50 ? 29.473 22.165 57.877 1.00 65.00 ? 50 ASN D CB 1 +ATOM 17425 C CG . ASN D 1 50 ? 30.048 22.264 59.277 1.00 68.18 ? 50 ASN D CG 1 +ATOM 17426 O OD1 . ASN D 1 50 ? 31.268 22.219 59.462 1.00 69.34 ? 50 ASN D OD1 1 +ATOM 17427 N ND2 . ASN D 1 50 ? 29.173 22.404 60.273 1.00 68.34 ? 50 ASN D ND2 1 +ATOM 17428 N N . LYS D 1 51 ? 29.454 24.001 54.695 1.00 56.08 ? 51 LYS D N 1 +ATOM 17429 C CA . LYS D 1 51 ? 29.278 23.767 53.270 1.00 52.68 ? 51 LYS D CA 1 +ATOM 17430 C C . LYS D 1 51 ? 30.006 24.818 52.447 1.00 49.75 ? 51 LYS D C 1 +ATOM 17431 O O . LYS D 1 51 ? 30.218 25.942 52.896 1.00 47.82 ? 51 LYS D O 1 +ATOM 17432 C CB . LYS D 1 51 ? 27.791 23.765 52.896 1.00 54.71 ? 51 LYS D CB 1 +ATOM 17433 C CG . LYS D 1 51 ? 26.996 22.634 53.537 1.00 58.68 ? 51 LYS D CG 1 +ATOM 17434 C CD . LYS D 1 51 ? 25.599 22.477 52.938 1.00 60.86 ? 51 LYS D CD 1 +ATOM 17435 C CE . LYS D 1 51 ? 24.723 23.691 53.203 1.00 62.90 ? 51 LYS D CE 1 +ATOM 17436 N NZ . LYS D 1 51 ? 25.220 24.919 52.507 1.00 65.39 ? 51 LYS D NZ 1 +ATOM 17437 N N . VAL D 1 52 ? 30.409 24.435 51.243 1.00 47.07 ? 52 VAL D N 1 +ATOM 17438 C CA . VAL D 1 52 ? 31.089 25.345 50.333 1.00 43.63 ? 52 VAL D CA 1 +ATOM 17439 C C . VAL D 1 52 ? 30.295 25.340 49.040 1.00 42.68 ? 52 VAL D C 1 +ATOM 17440 O O . VAL D 1 52 ? 30.051 24.284 48.461 1.00 43.07 ? 52 VAL D O 1 +ATOM 17441 C CB . VAL D 1 52 ? 32.539 24.896 50.036 1.00 43.31 ? 52 VAL D CB 1 +ATOM 17442 C CG1 . VAL D 1 52 ? 33.155 25.790 48.976 1.00 40.13 ? 52 VAL D CG1 1 +ATOM 17443 C CG2 . VAL D 1 52 ? 33.368 24.950 51.310 1.00 42.21 ? 52 VAL D CG2 1 +ATOM 17444 N N . ILE D 1 53 ? 29.880 26.522 48.598 1.00 41.45 ? 53 ILE D N 1 +ATOM 17445 C CA . ILE D 1 53 ? 29.109 26.651 47.376 1.00 38.80 ? 53 ILE D CA 1 +ATOM 17446 C C . ILE D 1 53 ? 29.947 27.383 46.355 1.00 38.43 ? 53 ILE D C 1 +ATOM 17447 O O . ILE D 1 53 ? 30.416 28.479 46.616 1.00 38.99 ? 53 ILE D O 1 +ATOM 17448 C CB . ILE D 1 53 ? 27.813 27.445 47.627 1.00 38.43 ? 53 ILE D CB 1 +ATOM 17449 C CG1 . ILE D 1 53 ? 27.011 26.775 48.742 1.00 38.15 ? 53 ILE D CG1 1 +ATOM 17450 C CG2 . ILE D 1 53 ? 26.993 27.527 46.358 1.00 34.78 ? 53 ILE D CG2 1 +ATOM 17451 C CD1 . ILE D 1 53 ? 25.793 27.558 49.174 1.00 39.69 ? 53 ILE D CD1 1 +ATOM 17452 N N . VAL D 1 54 ? 30.145 26.768 45.199 1.00 38.35 ? 54 VAL D N 1 +ATOM 17453 C CA . VAL D 1 54 ? 30.922 27.376 44.129 1.00 39.14 ? 54 VAL D CA 1 +ATOM 17454 C C . VAL D 1 54 ? 30.006 27.636 42.935 1.00 40.66 ? 54 VAL D C 1 +ATOM 17455 O O . VAL D 1 54 ? 29.371 26.717 42.421 1.00 41.74 ? 54 VAL D O 1 +ATOM 17456 C CB . VAL D 1 54 ? 32.079 26.454 43.698 1.00 39.38 ? 54 VAL D CB 1 +ATOM 17457 C CG1 . VAL D 1 54 ? 32.862 27.086 42.562 1.00 36.10 ? 54 VAL D CG1 1 +ATOM 17458 C CG2 . VAL D 1 54 ? 32.986 26.183 44.885 1.00 36.99 ? 54 VAL D CG2 1 +ATOM 17459 N N . GLU D 1 55 ? 29.940 28.892 42.503 1.00 41.74 ? 55 GLU D N 1 +ATOM 17460 C CA . GLU D 1 55 ? 29.090 29.289 41.389 1.00 42.76 ? 55 GLU D CA 1 +ATOM 17461 C C . GLU D 1 55 ? 29.849 29.734 40.157 1.00 41.89 ? 55 GLU D C 1 +ATOM 17462 O O . GLU D 1 55 ? 30.934 30.298 40.246 1.00 43.29 ? 55 GLU D O 1 +ATOM 17463 C CB . GLU D 1 55 ? 28.152 30.416 41.809 1.00 45.39 ? 55 GLU D CB 1 +ATOM 17464 C CG . GLU D 1 55 ? 26.977 29.964 42.643 1.00 52.62 ? 55 GLU D CG 1 +ATOM 17465 C CD . GLU D 1 55 ? 26.106 31.124 43.091 1.00 57.30 ? 55 GLU D CD 1 +ATOM 17466 O OE1 . GLU D 1 55 ? 25.858 32.041 42.266 1.00 59.48 ? 55 GLU D OE1 1 +ATOM 17467 O OE2 . GLU D 1 55 ? 25.663 31.109 44.266 1.00 59.52 ? 55 GLU D OE2 1 +ATOM 17468 N N . LYS D 1 56 ? 29.247 29.476 39.004 1.00 40.12 ? 56 LYS D N 1 +ATOM 17469 C CA . LYS D 1 56 ? 29.807 29.835 37.718 1.00 39.62 ? 56 LYS D CA 1 +ATOM 17470 C C . LYS D 1 56 ? 28.593 30.202 36.881 1.00 40.53 ? 56 LYS D C 1 +ATOM 17471 O O . LYS D 1 56 ? 27.508 29.658 37.089 1.00 40.00 ? 56 LYS D O 1 +ATOM 17472 C CB . LYS D 1 56 ? 30.516 28.636 37.095 1.00 39.06 ? 56 LYS D CB 1 +ATOM 17473 C CG . LYS D 1 56 ? 31.459 28.986 35.971 1.00 40.80 ? 56 LYS D CG 1 +ATOM 17474 C CD . LYS D 1 56 ? 32.010 27.729 35.288 1.00 42.06 ? 56 LYS D CD 1 +ATOM 17475 C CE . LYS D 1 56 ? 31.098 27.276 34.158 1.00 44.76 ? 56 LYS D CE 1 +ATOM 17476 N NZ . LYS D 1 56 ? 30.988 28.346 33.118 1.00 45.12 ? 56 LYS D NZ 1 +ATOM 17477 N N . SER D 1 57 ? 28.752 31.131 35.949 1.00 41.19 ? 57 SER D N 1 +ATOM 17478 C CA . SER D 1 57 ? 27.624 31.508 35.121 1.00 42.06 ? 57 SER D CA 1 +ATOM 17479 C C . SER D 1 57 ? 27.476 30.431 34.059 1.00 42.09 ? 57 SER D C 1 +ATOM 17480 O O . SER D 1 57 ? 28.407 29.660 33.821 1.00 43.11 ? 57 SER D O 1 +ATOM 17481 C CB . SER D 1 57 ? 27.865 32.866 34.462 1.00 41.77 ? 57 SER D CB 1 +ATOM 17482 O OG . SER D 1 57 ? 28.841 32.760 33.449 1.00 44.76 ? 57 SER D OG 1 +ATOM 17483 N N . LEU D 1 58 ? 26.308 30.383 33.432 1.00 40.89 ? 58 LEU D N 1 +ATOM 17484 C CA . LEU D 1 58 ? 26.025 29.406 32.396 1.00 41.66 ? 58 LEU D CA 1 +ATOM 17485 C C . LEU D 1 58 ? 25.289 30.116 31.268 1.00 43.51 ? 58 LEU D C 1 +ATOM 17486 O O . LEU D 1 58 ? 24.177 30.613 31.463 1.00 43.39 ? 58 LEU D O 1 +ATOM 17487 C CB . LEU D 1 58 ? 25.144 28.293 32.966 1.00 40.69 ? 58 LEU D CB 1 +ATOM 17488 C CG . LEU D 1 58 ? 24.791 27.134 32.037 1.00 39.90 ? 58 LEU D CG 1 +ATOM 17489 C CD1 . LEU D 1 58 ? 26.028 26.271 31.780 1.00 38.28 ? 58 LEU D CD1 1 +ATOM 17490 C CD2 . LEU D 1 58 ? 23.691 26.307 32.671 1.00 39.63 ? 58 LEU D CD2 1 +ATOM 17491 N N . ASP D 1 59 ? 25.909 30.172 30.094 1.00 44.97 ? 59 ASP D N 1 +ATOM 17492 C CA . ASP D 1 59 ? 25.293 30.824 28.950 1.00 47.44 ? 59 ASP D CA 1 +ATOM 17493 C C . ASP D 1 59 ? 24.363 29.877 28.198 1.00 47.05 ? 59 ASP D C 1 +ATOM 17494 O O . ASP D 1 59 ? 24.488 28.655 28.311 1.00 46.93 ? 59 ASP D O 1 +ATOM 17495 C CB . ASP D 1 59 ? 26.369 31.349 28.002 1.00 50.88 ? 59 ASP D CB 1 +ATOM 17496 C CG . ASP D 1 59 ? 27.299 32.340 28.671 1.00 56.76 ? 59 ASP D CG 1 +ATOM 17497 O OD1 . ASP D 1 59 ? 26.804 33.227 29.405 1.00 59.87 ? 59 ASP D OD1 1 +ATOM 17498 O OD2 . ASP D 1 59 ? 28.529 32.241 28.458 1.00 60.75 ? 59 ASP D OD2 1 +ATOM 17499 N N . LEU D 1 60 ? 23.439 30.446 27.428 1.00 46.24 ? 60 LEU D N 1 +ATOM 17500 C CA . LEU D 1 60 ? 22.487 29.651 26.661 1.00 47.00 ? 60 LEU D CA 1 +ATOM 17501 C C . LEU D 1 60 ? 23.144 28.602 25.767 1.00 47.21 ? 60 LEU D C 1 +ATOM 17502 O O . LEU D 1 60 ? 22.695 27.455 25.715 1.00 46.90 ? 60 LEU D O 1 +ATOM 17503 C CB . LEU D 1 60 ? 21.609 30.558 25.794 1.00 47.46 ? 60 LEU D CB 1 +ATOM 17504 C CG . LEU D 1 60 ? 20.525 31.365 26.494 1.00 46.92 ? 60 LEU D CG 1 +ATOM 17505 C CD1 . LEU D 1 60 ? 19.793 32.214 25.471 1.00 47.81 ? 60 LEU D CD1 1 +ATOM 17506 C CD2 . LEU D 1 60 ? 19.565 30.421 27.196 1.00 48.16 ? 60 LEU D CD2 1 +ATOM 17507 N N . LYS D 1 61 ? 24.204 28.998 25.068 1.00 47.23 ? 61 LYS D N 1 +ATOM 17508 C CA . LYS D 1 61 ? 24.903 28.101 24.153 1.00 47.94 ? 61 LYS D CA 1 +ATOM 17509 C C . LYS D 1 61 ? 26.018 27.293 24.799 1.00 46.06 ? 61 LYS D C 1 +ATOM 17510 O O . LYS D 1 61 ? 26.671 26.495 24.137 1.00 47.05 ? 61 LYS D O 1 +ATOM 17511 C CB . LYS D 1 61 ? 25.483 28.897 22.980 1.00 51.91 ? 61 LYS D CB 1 +ATOM 17512 C CG . LYS D 1 61 ? 24.452 29.577 22.076 1.00 55.88 ? 61 LYS D CG 1 +ATOM 17513 C CD . LYS D 1 61 ? 23.742 28.577 21.170 1.00 60.05 ? 61 LYS D CD 1 +ATOM 17514 C CE . LYS D 1 61 ? 23.010 29.299 20.029 1.00 63.16 ? 61 LYS D CE 1 +ATOM 17515 N NZ . LYS D 1 61 ? 22.372 28.362 19.044 1.00 63.75 ? 61 LYS D NZ 1 +ATOM 17516 N N . GLU D 1 62 ? 26.240 27.496 26.087 1.00 43.88 ? 62 GLU D N 1 +ATOM 17517 C CA . GLU D 1 62 ? 27.289 26.775 26.792 1.00 43.14 ? 62 GLU D CA 1 +ATOM 17518 C C . GLU D 1 62 ? 26.937 25.296 27.016 1.00 40.97 ? 62 GLU D C 1 +ATOM 17519 O O . GLU D 1 62 ? 25.801 24.973 27.349 1.00 40.34 ? 62 GLU D O 1 +ATOM 17520 C CB . GLU D 1 62 ? 27.552 27.467 28.131 1.00 44.37 ? 62 GLU D CB 1 +ATOM 17521 C CG . GLU D 1 62 ? 28.698 26.894 28.942 1.00 44.30 ? 62 GLU D CG 1 +ATOM 17522 C CD . GLU D 1 62 ? 29.052 27.784 30.124 1.00 47.68 ? 62 GLU D CD 1 +ATOM 17523 O OE1 . GLU D 1 62 ? 28.455 28.882 30.265 1.00 48.47 ? 62 GLU D OE1 1 +ATOM 17524 O OE2 . GLU D 1 62 ? 29.935 27.393 30.912 1.00 48.72 ? 62 GLU D OE2 1 +ATOM 17525 N N . HIS D 1 63 ? 27.915 24.408 26.831 1.00 39.35 ? 63 HIS D N 1 +ATOM 17526 C CA . HIS D 1 63 ? 27.704 22.973 27.029 1.00 37.12 ? 63 HIS D CA 1 +ATOM 17527 C C . HIS D 1 63 ? 28.406 22.503 28.296 1.00 37.57 ? 63 HIS D C 1 +ATOM 17528 O O . HIS D 1 63 ? 29.501 22.958 28.617 1.00 38.13 ? 63 HIS D O 1 +ATOM 17529 C CB . HIS D 1 63 ? 28.264 22.176 25.853 1.00 36.33 ? 63 HIS D CB 1 +ATOM 17530 C CG . HIS D 1 63 ? 27.758 22.628 24.523 1.00 37.09 ? 63 HIS D CG 1 +ATOM 17531 N ND1 . HIS D 1 63 ? 26.435 22.514 24.153 1.00 37.68 ? 63 HIS D ND1 1 +ATOM 17532 C CD2 . HIS D 1 63 ? 28.391 23.227 23.487 1.00 35.90 ? 63 HIS D CD2 1 +ATOM 17533 C CE1 . HIS D 1 63 ? 26.275 23.027 22.945 1.00 38.78 ? 63 HIS D CE1 1 +ATOM 17534 N NE2 . HIS D 1 63 ? 27.446 23.467 22.519 1.00 37.22 ? 63 HIS D NE2 1 +ATOM 17535 N N . ILE D 1 64 ? 27.767 21.589 29.014 1.00 37.03 ? 64 ILE D N 1 +ATOM 17536 C CA . ILE D 1 64 ? 28.330 21.023 30.232 1.00 33.75 ? 64 ILE D CA 1 +ATOM 17537 C C . ILE D 1 64 ? 28.352 19.512 30.026 1.00 34.16 ? 64 ILE D C 1 +ATOM 17538 O O . ILE D 1 64 ? 27.315 18.901 29.762 1.00 34.90 ? 64 ILE D O 1 +ATOM 17539 C CB . ILE D 1 64 ? 27.467 21.352 31.465 1.00 33.71 ? 64 ILE D CB 1 +ATOM 17540 C CG1 . ILE D 1 64 ? 27.326 22.875 31.615 1.00 33.68 ? 64 ILE D CG1 1 +ATOM 17541 C CG2 . ILE D 1 64 ? 28.089 20.733 32.715 1.00 30.27 ? 64 ILE D CG2 1 +ATOM 17542 C CD1 . ILE D 1 64 ? 28.630 23.617 31.884 1.00 31.67 ? 64 ILE D CD1 1 +ATOM 17543 N N . ILE D 1 65 ? 29.537 18.916 30.119 1.00 32.62 ? 65 ILE D N 1 +ATOM 17544 C CA . ILE D 1 65 ? 29.680 17.487 29.933 1.00 31.96 ? 65 ILE D CA 1 +ATOM 17545 C C . ILE D 1 65 ? 30.450 16.885 31.090 1.00 33.14 ? 65 ILE D C 1 +ATOM 17546 O O . ILE D 1 65 ? 31.047 17.610 31.889 1.00 33.77 ? 65 ILE D O 1 +ATOM 17547 C CB . ILE D 1 65 ? 30.409 17.194 28.630 1.00 32.48 ? 65 ILE D CB 1 +ATOM 17548 C CG1 . ILE D 1 65 ? 31.819 17.791 28.679 1.00 33.91 ? 65 ILE D CG1 1 +ATOM 17549 C CG2 . ILE D 1 65 ? 29.641 17.808 27.473 1.00 31.59 ? 65 ILE D CG2 1 +ATOM 17550 C CD1 . ILE D 1 65 ? 32.613 17.617 27.405 1.00 32.41 ? 65 ILE D CD1 1 +ATOM 17551 N N . GLY D 1 66 ? 30.421 15.562 31.196 1.00 33.34 ? 66 GLY D N 1 +ATOM 17552 C CA . GLY D 1 66 ? 31.132 14.904 32.274 1.00 33.55 ? 66 GLY D CA 1 +ATOM 17553 C C . GLY D 1 66 ? 30.242 14.339 33.365 1.00 34.75 ? 66 GLY D C 1 +ATOM 17554 O O . GLY D 1 66 ? 29.151 13.843 33.091 1.00 34.81 ? 66 GLY D O 1 +ATOM 17555 N N . LEU D 1 67 ? 30.725 14.419 34.606 1.00 34.74 ? 67 LEU D N 1 +ATOM 17556 C CA . LEU D 1 67 ? 30.025 13.912 35.780 1.00 33.92 ? 67 LEU D CA 1 +ATOM 17557 C C . LEU D 1 67 ? 29.976 12.393 35.808 1.00 34.06 ? 67 LEU D C 1 +ATOM 17558 O O . LEU D 1 67 ? 29.251 11.794 36.601 1.00 35.13 ? 67 LEU D O 1 +ATOM 17559 C CB . LEU D 1 67 ? 28.615 14.488 35.870 1.00 33.18 ? 67 LEU D CB 1 +ATOM 17560 C CG . LEU D 1 67 ? 28.581 16.005 36.051 1.00 35.00 ? 67 LEU D CG 1 +ATOM 17561 C CD1 . LEU D 1 67 ? 27.152 16.430 36.315 1.00 33.65 ? 67 LEU D CD1 1 +ATOM 17562 C CD2 . LEU D 1 67 ? 29.499 16.431 37.197 1.00 33.10 ? 67 LEU D CD2 1 +ATOM 17563 N N . GLY D 1 68 ? 30.755 11.777 34.930 1.00 34.96 ? 68 GLY D N 1 +ATOM 17564 C CA . GLY D 1 68 ? 30.840 10.327 34.876 1.00 35.67 ? 68 GLY D CA 1 +ATOM 17565 C C . GLY D 1 68 ? 29.624 9.520 34.466 1.00 35.48 ? 68 GLY D C 1 +ATOM 17566 O O . GLY D 1 68 ? 28.980 9.790 33.449 1.00 37.10 ? 68 GLY D O 1 +ATOM 17567 N N . GLU D 1 69 ? 29.316 8.518 35.278 1.00 33.92 ? 69 GLU D N 1 +ATOM 17568 C CA . GLU D 1 69 ? 28.210 7.607 35.034 1.00 35.57 ? 69 GLU D CA 1 +ATOM 17569 C C . GLU D 1 69 ? 26.840 8.194 35.376 1.00 34.51 ? 69 GLU D C 1 +ATOM 17570 O O . GLU D 1 69 ? 26.372 8.065 36.501 1.00 35.06 ? 69 GLU D O 1 +ATOM 17571 C CB . GLU D 1 69 ? 28.457 6.339 35.845 1.00 36.91 ? 69 GLU D CB 1 +ATOM 17572 C CG . GLU D 1 69 ? 27.651 5.131 35.446 1.00 39.38 ? 69 GLU D CG 1 +ATOM 17573 C CD . GLU D 1 69 ? 27.977 3.936 36.321 1.00 41.22 ? 69 GLU D CD 1 +ATOM 17574 O OE1 . GLU D 1 69 ? 27.625 3.966 37.519 1.00 41.85 ? 69 GLU D OE1 1 +ATOM 17575 O OE2 . GLU D 1 69 ? 28.597 2.974 35.817 1.00 41.75 ? 69 GLU D OE2 1 +ATOM 17576 N N . LYS D 1 70 ? 26.196 8.830 34.404 1.00 33.58 ? 70 LYS D N 1 +ATOM 17577 C CA . LYS D 1 70 ? 24.884 9.429 34.633 1.00 32.30 ? 70 LYS D CA 1 +ATOM 17578 C C . LYS D 1 70 ? 23.867 8.905 33.630 1.00 31.50 ? 70 LYS D C 1 +ATOM 17579 O O . LYS D 1 70 ? 24.138 8.853 32.433 1.00 30.58 ? 70 LYS D O 1 +ATOM 17580 C CB . LYS D 1 70 ? 24.964 10.960 34.525 1.00 33.19 ? 70 LYS D CB 1 +ATOM 17581 C CG . LYS D 1 70 ? 25.805 11.615 35.595 1.00 32.95 ? 70 LYS D CG 1 +ATOM 17582 C CD . LYS D 1 70 ? 25.302 11.223 36.970 1.00 34.28 ? 70 LYS D CD 1 +ATOM 17583 C CE . LYS D 1 70 ? 26.137 11.856 38.064 1.00 35.93 ? 70 LYS D CE 1 +ATOM 17584 N NZ . LYS D 1 70 ? 25.687 11.405 39.417 1.00 35.96 ? 70 LYS D NZ 1 +ATOM 17585 N N . ALA D 1 71 ? 22.693 8.522 34.122 1.00 30.62 ? 71 ALA D N 1 +ATOM 17586 C CA . ALA D 1 71 ? 21.640 8.002 33.253 1.00 29.13 ? 71 ALA D CA 1 +ATOM 17587 C C . ALA D 1 71 ? 20.897 9.178 32.614 1.00 28.27 ? 71 ALA D C 1 +ATOM 17588 O O . ALA D 1 71 ? 19.676 9.274 32.711 1.00 26.00 ? 71 ALA D O 1 +ATOM 17589 C CB . ALA D 1 71 ? 20.684 7.135 34.071 1.00 29.27 ? 71 ALA D CB 1 +ATOM 17590 N N . PHE D 1 72 ? 21.657 10.070 31.977 1.00 28.05 ? 72 PHE D N 1 +ATOM 17591 C CA . PHE D 1 72 ? 21.105 11.256 31.333 1.00 29.69 ? 72 PHE D CA 1 +ATOM 17592 C C . PHE D 1 72 ? 21.828 11.598 30.033 1.00 31.62 ? 72 PHE D C 1 +ATOM 17593 O O . PHE D 1 72 ? 22.866 11.009 29.704 1.00 33.85 ? 72 PHE D O 1 +ATOM 17594 C CB . PHE D 1 72 ? 21.204 12.474 32.260 1.00 28.95 ? 72 PHE D CB 1 +ATOM 17595 C CG . PHE D 1 72 ? 20.318 12.400 33.465 1.00 29.14 ? 72 PHE D CG 1 +ATOM 17596 C CD1 . PHE D 1 72 ? 20.686 11.643 34.568 1.00 28.23 ? 72 PHE D CD1 1 +ATOM 17597 C CD2 . PHE D 1 72 ? 19.103 13.075 33.490 1.00 27.95 ? 72 PHE D CD2 1 +ATOM 17598 C CE1 . PHE D 1 72 ? 19.851 11.556 35.687 1.00 28.11 ? 72 PHE D CE1 1 +ATOM 17599 C CE2 . PHE D 1 72 ? 18.263 12.992 34.604 1.00 29.36 ? 72 PHE D CE2 1 +ATOM 17600 C CZ . PHE D 1 72 ? 18.642 12.229 35.702 1.00 28.32 ? 72 PHE D CZ 1 +ATOM 17601 N N . GLU D 1 73 ? 21.271 12.559 29.303 1.00 30.81 ? 73 GLU D N 1 +ATOM 17602 C CA . GLU D 1 73 ? 21.868 13.026 28.065 1.00 32.96 ? 73 GLU D CA 1 +ATOM 17603 C C . GLU D 1 73 ? 23.295 13.517 28.369 1.00 34.33 ? 73 GLU D C 1 +ATOM 17604 O O . GLU D 1 73 ? 23.575 13.997 29.474 1.00 33.92 ? 73 GLU D O 1 +ATOM 17605 C CB . GLU D 1 73 ? 21.039 14.181 27.483 1.00 34.41 ? 73 GLU D CB 1 +ATOM 17606 C CG . GLU D 1 73 ? 19.645 13.803 26.916 1.00 36.10 ? 73 GLU D CG 1 +ATOM 17607 C CD . GLU D 1 73 ? 18.645 13.337 27.977 1.00 37.90 ? 73 GLU D CD 1 +ATOM 17608 O OE1 . GLU D 1 73 ? 18.762 13.742 29.160 1.00 38.91 ? 73 GLU D OE1 1 +ATOM 17609 O OE2 . GLU D 1 73 ? 17.723 12.572 27.619 1.00 39.61 ? 73 GLU D OE2 1 +ATOM 17610 N N . LEU D 1 74 ? 24.190 13.400 27.393 1.00 34.64 ? 74 LEU D N 1 +ATOM 17611 C CA . LEU D 1 74 ? 25.576 13.827 27.554 1.00 35.13 ? 74 LEU D CA 1 +ATOM 17612 C C . LEU D 1 74 ? 25.736 15.314 27.908 1.00 37.33 ? 74 LEU D C 1 +ATOM 17613 O O . LEU D 1 74 ? 26.656 15.671 28.655 1.00 37.39 ? 74 LEU D O 1 +ATOM 17614 C CB . LEU D 1 74 ? 26.368 13.476 26.294 1.00 34.23 ? 74 LEU D CB 1 +ATOM 17615 C CG . LEU D 1 74 ? 27.188 12.178 26.324 1.00 33.92 ? 74 LEU D CG 1 +ATOM 17616 C CD1 . LEU D 1 74 ? 26.758 11.267 27.449 1.00 30.99 ? 74 LEU D CD1 1 +ATOM 17617 C CD2 . LEU D 1 74 ? 27.065 11.486 24.979 1.00 34.04 ? 74 LEU D CD2 1 +ATOM 17618 N N . ASP D 1 75 ? 24.872 16.183 27.371 1.00 38.14 ? 75 ASP D N 1 +ATOM 17619 C CA . ASP D 1 75 ? 24.926 17.605 27.731 1.00 38.90 ? 75 ASP D CA 1 +ATOM 17620 C C . ASP D 1 75 ? 24.082 17.637 29.008 1.00 37.60 ? 75 ASP D C 1 +ATOM 17621 O O . ASP D 1 75 ? 22.866 17.450 28.958 1.00 37.26 ? 75 ASP D O 1 +ATOM 17622 C CB . ASP D 1 75 ? 24.285 18.493 26.660 1.00 42.91 ? 75 ASP D CB 1 +ATOM 17623 C CG . ASP D 1 75 ? 24.611 19.992 26.862 1.00 48.51 ? 75 ASP D CG 1 +ATOM 17624 O OD1 . ASP D 1 75 ? 24.602 20.477 28.021 1.00 49.28 ? 75 ASP D OD1 1 +ATOM 17625 O OD2 . ASP D 1 75 ? 24.869 20.694 25.854 1.00 50.93 ? 75 ASP D OD2 1 +ATOM 17626 N N . ARG D 1 76 ? 24.735 17.883 30.140 1.00 35.86 ? 76 ARG D N 1 +ATOM 17627 C CA . ARG D 1 76 ? 24.091 17.849 31.447 1.00 33.86 ? 76 ARG D CA 1 +ATOM 17628 C C . ARG D 1 76 ? 23.199 18.982 31.941 1.00 33.26 ? 76 ARG D C 1 +ATOM 17629 O O . ARG D 1 76 ? 22.695 18.912 33.061 1.00 33.53 ? 76 ARG D O 1 +ATOM 17630 C CB . ARG D 1 76 ? 25.160 17.597 32.510 1.00 33.33 ? 76 ARG D CB 1 +ATOM 17631 C CG . ARG D 1 76 ? 26.165 16.509 32.177 1.00 32.47 ? 76 ARG D CG 1 +ATOM 17632 C CD . ARG D 1 76 ? 25.518 15.153 31.948 1.00 32.29 ? 76 ARG D CD 1 +ATOM 17633 N NE . ARG D 1 76 ? 26.505 14.082 32.086 1.00 32.66 ? 76 ARG D NE 1 +ATOM 17634 C CZ . ARG D 1 76 ? 26.333 12.819 31.704 1.00 31.46 ? 76 ARG D CZ 1 +ATOM 17635 N NH1 . ARG D 1 76 ? 25.199 12.424 31.137 1.00 32.23 ? 76 ARG D NH1 1 +ATOM 17636 N NH2 . ARG D 1 76 ? 27.304 11.941 31.905 1.00 32.10 ? 76 ARG D NH2 1 +ATOM 17637 N N . LYS D 1 77 ? 22.985 20.018 31.147 1.00 33.76 ? 77 LYS D N 1 +ATOM 17638 C CA . LYS D 1 77 ? 22.152 21.131 31.608 1.00 35.74 ? 77 LYS D CA 1 +ATOM 17639 C C . LYS D 1 77 ? 20.719 20.771 32.033 1.00 34.11 ? 77 LYS D C 1 +ATOM 17640 O O . LYS D 1 77 ? 20.139 19.803 31.562 1.00 32.04 ? 77 LYS D O 1 +ATOM 17641 C CB . LYS D 1 77 ? 22.109 22.222 30.536 1.00 38.43 ? 77 LYS D CB 1 +ATOM 17642 C CG . LYS D 1 77 ? 23.469 22.828 30.247 1.00 43.51 ? 77 LYS D CG 1 +ATOM 17643 C CD . LYS D 1 77 ? 23.490 23.599 28.930 1.00 47.61 ? 77 LYS D CD 1 +ATOM 17644 C CE . LYS D 1 77 ? 22.691 24.880 29.001 1.00 49.00 ? 77 LYS D CE 1 +ATOM 17645 N NZ . LYS D 1 77 ? 22.754 25.596 27.692 1.00 53.26 ? 77 LYS D NZ 1 +ATOM 17646 N N . ARG D 1 78 ? 20.186 21.575 32.950 1.00 34.65 ? 78 ARG D N 1 +ATOM 17647 C CA . ARG D 1 78 ? 18.828 21.457 33.486 1.00 34.93 ? 78 ARG D CA 1 +ATOM 17648 C C . ARG D 1 78 ? 18.586 20.249 34.378 1.00 35.17 ? 78 ARG D C 1 +ATOM 17649 O O . ARG D 1 78 ? 17.567 19.572 34.270 1.00 34.99 ? 78 ARG D O 1 +ATOM 17650 C CB . ARG D 1 78 ? 17.799 21.468 32.348 1.00 35.78 ? 78 ARG D CB 1 +ATOM 17651 C CG . ARG D 1 78 ? 18.065 22.512 31.273 1.00 35.85 ? 78 ARG D CG 1 +ATOM 17652 C CD . ARG D 1 78 ? 18.336 23.895 31.855 1.00 35.79 ? 78 ARG D CD 1 +ATOM 17653 N NE . ARG D 1 78 ? 18.815 24.802 30.813 1.00 37.55 ? 78 ARG D NE 1 +ATOM 17654 C CZ . ARG D 1 78 ? 19.439 25.953 31.043 1.00 34.86 ? 78 ARG D CZ 1 +ATOM 17655 N NH1 . ARG D 1 78 ? 19.670 26.346 32.282 1.00 35.46 ? 78 ARG D NH1 1 +ATOM 17656 N NH2 . ARG D 1 78 ? 19.824 26.715 30.034 1.00 35.09 ? 78 ARG D NH2 1 +ATOM 17657 N N . LYS D 1 79 ? 19.521 19.986 35.277 1.00 35.45 ? 79 LYS D N 1 +ATOM 17658 C CA . LYS D 1 79 ? 19.377 18.858 36.179 1.00 34.72 ? 79 LYS D CA 1 +ATOM 17659 C C . LYS D 1 79 ? 20.244 19.087 37.397 1.00 31.99 ? 79 LYS D C 1 +ATOM 17660 O O . LYS D 1 79 ? 21.279 19.733 37.307 1.00 34.16 ? 79 LYS D O 1 +ATOM 17661 C CB . LYS D 1 79 ? 19.794 17.557 35.475 1.00 35.97 ? 79 LYS D CB 1 +ATOM 17662 C CG . LYS D 1 79 ? 19.415 16.308 36.245 1.00 40.39 ? 79 LYS D CG 1 +ATOM 17663 C CD . LYS D 1 79 ? 17.898 16.196 36.358 1.00 44.44 ? 79 LYS D CD 1 +ATOM 17664 C CE . LYS D 1 79 ? 17.477 15.152 37.389 1.00 48.77 ? 79 LYS D CE 1 +ATOM 17665 N NZ . LYS D 1 79 ? 15.978 15.014 37.446 1.00 49.41 ? 79 LYS D NZ 1 +ATOM 17666 N N A ARG D 1 80 ? 19.804 18.578 38.536 1.00 30.97 ? 80 ARG D N 1 +ATOM 17667 C CA A ARG D 1 80 ? 20.552 18.689 39.782 1.00 29.99 ? 80 ARG D CA 1 +ATOM 17668 C C . ARG D 1 80 ? 21.122 17.282 40.045 1.00 31.33 ? 80 ARG D C 1 +ATOM 17669 O O . ARG D 1 80 ? 20.383 16.365 40.401 1.00 31.79 ? 80 ARG D O 1 +ATOM 17670 C CB A ARG D 1 80 ? 19.605 19.133 40.901 0.50 29.44 ? 80 ARG D CB 1 +ATOM 17671 C CB B ARG D 1 80 ? 19.626 19.079 40.937 0.50 29.20 ? 80 ARG D CB 1 +ATOM 17672 C CG A ARG D 1 80 ? 20.268 19.600 42.198 0.50 29.21 ? 80 ARG D CG 1 +ATOM 17673 C CG B ARG D 1 80 ? 20.245 18.907 42.334 0.50 28.27 ? 80 ARG D CG 1 +ATOM 17674 C CD A ARG D 1 80 ? 19.230 20.268 43.100 0.50 29.61 ? 80 ARG D CD 1 +ATOM 17675 C CD B ARG D 1 80 ? 19.261 19.301 43.420 0.50 29.33 ? 80 ARG D CD 1 +ATOM 17676 N NE A ARG D 1 80 ? 19.695 20.435 44.476 0.50 28.91 ? 80 ARG D NE 1 +ATOM 17677 N NE B ARG D 1 80 ? 19.897 19.469 44.725 0.50 29.51 ? 80 ARG D NE 1 +ATOM 17678 C CZ A ARG D 1 80 ? 20.354 21.496 44.927 0.50 28.95 ? 80 ARG D CZ 1 +ATOM 17679 C CZ B ARG D 1 80 ? 20.039 18.500 45.624 0.50 30.33 ? 80 ARG D CZ 1 +ATOM 17680 N NH1 A ARG D 1 80 ? 20.635 22.509 44.112 0.50 28.17 ? 80 ARG D NH1 1 +ATOM 17681 N NH1 B ARG D 1 80 ? 19.583 17.280 45.363 0.50 30.07 ? 80 ARG D NH1 1 +ATOM 17682 N NH2 A ARG D 1 80 ? 20.737 21.540 46.196 0.50 28.94 ? 80 ARG D NH2 1 +ATOM 17683 N NH2 B ARG D 1 80 ? 20.640 18.753 46.782 0.50 28.93 ? 80 ARG D NH2 1 +ATOM 17684 N N . TYR D 1 81 ? 22.429 17.105 39.857 1.00 31.68 ? 81 TYR D N 1 +ATOM 17685 C CA . TYR D 1 81 ? 23.056 15.799 40.067 1.00 30.96 ? 81 TYR D CA 1 +ATOM 17686 C C . TYR D 1 81 ? 23.629 15.611 41.456 1.00 32.02 ? 81 TYR D C 1 +ATOM 17687 O O . TYR D 1 81 ? 24.125 16.553 42.073 1.00 31.47 ? 81 TYR D O 1 +ATOM 17688 C CB . TYR D 1 81 ? 24.171 15.561 39.049 1.00 27.84 ? 81 TYR D CB 1 +ATOM 17689 C CG . TYR D 1 81 ? 23.728 15.717 37.618 1.00 29.36 ? 81 TYR D CG 1 +ATOM 17690 C CD1 . TYR D 1 81 ? 23.688 16.974 37.016 1.00 26.36 ? 81 TYR D CD1 1 +ATOM 17691 C CD2 . TYR D 1 81 ? 23.324 14.610 36.868 1.00 28.40 ? 81 TYR D CD2 1 +ATOM 17692 C CE1 . TYR D 1 81 ? 23.265 17.128 35.711 1.00 27.01 ? 81 TYR D CE1 1 +ATOM 17693 C CE2 . TYR D 1 81 ? 22.892 14.753 35.558 1.00 27.89 ? 81 TYR D CE2 1 +ATOM 17694 C CZ . TYR D 1 81 ? 22.866 16.013 34.983 1.00 28.91 ? 81 TYR D CZ 1 +ATOM 17695 O OH . TYR D 1 81 ? 22.448 16.165 33.680 1.00 27.37 ? 81 TYR D OH 1 +ATOM 17696 N N . VAL D 1 82 ? 23.555 14.377 41.940 1.00 33.40 ? 82 VAL D N 1 +ATOM 17697 C CA . VAL D 1 82 ? 24.080 14.023 43.254 1.00 33.83 ? 82 VAL D CA 1 +ATOM 17698 C C . VAL D 1 82 ? 25.222 13.035 43.036 1.00 35.67 ? 82 VAL D C 1 +ATOM 17699 O O . VAL D 1 82 ? 25.087 12.077 42.270 1.00 36.15 ? 82 VAL D O 1 +ATOM 17700 C CB . VAL D 1 82 ? 22.998 13.354 44.128 1.00 33.72 ? 82 VAL D CB 1 +ATOM 17701 C CG1 . VAL D 1 82 ? 23.619 12.841 45.406 1.00 35.22 ? 82 VAL D CG1 1 +ATOM 17702 C CG2 . VAL D 1 82 ? 21.886 14.349 44.442 1.00 32.41 ? 82 VAL D CG2 1 +ATOM 17703 N N . MET D 1 83 ? 26.359 13.278 43.676 1.00 36.67 ? 83 MET D N 1 +ATOM 17704 C CA . MET D 1 83 ? 27.494 12.374 43.530 1.00 37.51 ? 83 MET D CA 1 +ATOM 17705 C C . MET D 1 83 ? 27.586 11.560 44.810 1.00 36.43 ? 83 MET D C 1 +ATOM 17706 O O . MET D 1 83 ? 28.169 12.006 45.796 1.00 35.50 ? 83 MET D O 1 +ATOM 17707 C CB . MET D 1 83 ? 28.805 13.144 43.322 1.00 39.39 ? 83 MET D CB 1 +ATOM 17708 C CG . MET D 1 83 ? 28.808 14.116 42.156 1.00 45.03 ? 83 MET D CG 1 +ATOM 17709 S SD . MET D 1 83 ? 28.531 13.368 40.521 1.00 50.78 ? 83 MET D SD 1 +ATOM 17710 C CE . MET D 1 83 ? 30.048 12.484 40.330 1.00 49.57 ? 83 MET D CE 1 +ATOM 17711 N N . TYR D 1 84 ? 26.999 10.369 44.794 1.00 35.62 ? 84 TYR D N 1 +ATOM 17712 C CA . TYR D 1 84 ? 27.019 9.496 45.963 1.00 34.91 ? 84 TYR D CA 1 +ATOM 17713 C C . TYR D 1 84 ? 26.885 8.054 45.495 1.00 33.43 ? 84 TYR D C 1 +ATOM 17714 O O . TYR D 1 84 ? 25.801 7.635 45.105 1.00 34.80 ? 84 TYR D O 1 +ATOM 17715 C CB . TYR D 1 84 ? 25.856 9.848 46.898 1.00 35.31 ? 84 TYR D CB 1 +ATOM 17716 C CG . TYR D 1 84 ? 26.147 9.612 48.358 1.00 35.86 ? 84 TYR D CG 1 +ATOM 17717 C CD1 . TYR D 1 84 ? 27.248 10.216 48.972 1.00 37.94 ? 84 TYR D CD1 1 +ATOM 17718 C CD2 . TYR D 1 84 ? 25.313 8.809 49.138 1.00 36.12 ? 84 TYR D CD2 1 +ATOM 17719 C CE1 . TYR D 1 84 ? 27.512 10.029 50.336 1.00 38.70 ? 84 TYR D CE1 1 +ATOM 17720 C CE2 . TYR D 1 84 ? 25.564 8.612 50.497 1.00 36.47 ? 84 TYR D CE2 1 +ATOM 17721 C CZ . TYR D 1 84 ? 26.666 9.227 51.088 1.00 38.82 ? 84 TYR D CZ 1 +ATOM 17722 O OH . TYR D 1 84 ? 26.936 9.046 52.426 1.00 39.43 ? 84 TYR D OH 1 +ATOM 17723 N N . ASN D 1 85 ? 27.987 7.308 45.522 1.00 31.86 ? 85 ASN D N 1 +ATOM 17724 C CA . ASN D 1 85 ? 27.986 5.912 45.098 1.00 30.30 ? 85 ASN D CA 1 +ATOM 17725 C C . ASN D 1 85 ? 26.845 5.165 45.747 1.00 29.66 ? 85 ASN D C 1 +ATOM 17726 O O . ASN D 1 85 ? 26.721 5.170 46.967 1.00 30.24 ? 85 ASN D O 1 +ATOM 17727 C CB . ASN D 1 85 ? 29.290 5.223 45.491 1.00 30.49 ? 85 ASN D CB 1 +ATOM 17728 C CG . ASN D 1 85 ? 30.486 5.749 44.733 1.00 31.75 ? 85 ASN D CG 1 +ATOM 17729 O OD1 . ASN D 1 85 ? 30.374 6.655 43.902 1.00 31.52 ? 85 ASN D OD1 1 +ATOM 17730 N ND2 . ASN D 1 85 ? 31.653 5.181 45.020 1.00 33.71 ? 85 ASN D ND2 1 +ATOM 17731 N N . VAL D 1 86 ? 26.015 4.515 44.940 1.00 29.26 ? 86 VAL D N 1 +ATOM 17732 C CA . VAL D 1 86 ? 24.894 3.761 45.487 1.00 30.33 ? 86 VAL D CA 1 +ATOM 17733 C C . VAL D 1 86 ? 24.544 2.545 44.631 1.00 31.14 ? 86 VAL D C 1 +ATOM 17734 O O . VAL D 1 86 ? 24.703 2.557 43.408 1.00 32.14 ? 86 VAL D O 1 +ATOM 17735 C CB . VAL D 1 86 ? 23.630 4.653 45.620 1.00 31.69 ? 86 VAL D CB 1 +ATOM 17736 C CG1 . VAL D 1 86 ? 23.013 4.897 44.254 1.00 30.67 ? 86 VAL D CG1 1 +ATOM 17737 C CG2 . VAL D 1 86 ? 22.618 3.993 46.538 1.00 31.87 ? 86 VAL D CG2 1 +ATOM 17738 N N . ASP D 1 87 ? 24.097 1.479 45.286 1.00 33.30 ? 87 ASP D N 1 +ATOM 17739 C CA . ASP D 1 87 ? 23.672 0.268 44.581 1.00 34.33 ? 87 ASP D CA 1 +ATOM 17740 C C . ASP D 1 87 ? 22.330 0.657 43.928 1.00 33.79 ? 87 ASP D C 1 +ATOM 17741 O O . ASP D 1 87 ? 21.293 0.701 44.586 1.00 31.80 ? 87 ASP D O 1 +ATOM 17742 C CB . ASP D 1 87 ? 23.456 -0.869 45.578 1.00 34.69 ? 87 ASP D CB 1 +ATOM 17743 C CG . ASP D 1 87 ? 23.012 -2.143 44.907 1.00 38.31 ? 87 ASP D CG 1 +ATOM 17744 O OD1 . ASP D 1 87 ? 22.086 -2.091 44.075 1.00 42.51 ? 87 ASP D OD1 1 +ATOM 17745 O OD2 . ASP D 1 87 ? 23.578 -3.206 45.211 1.00 41.83 ? 87 ASP D OD2 1 +ATOM 17746 N N . ALA D 1 88 ? 22.360 0.943 42.635 1.00 34.56 ? 88 ALA D N 1 +ATOM 17747 C CA . ALA D 1 88 ? 21.169 1.385 41.920 1.00 34.93 ? 88 ALA D CA 1 +ATOM 17748 C C . ALA D 1 88 ? 20.103 0.329 41.651 1.00 35.47 ? 88 ALA D C 1 +ATOM 17749 O O . ALA D 1 88 ? 19.001 0.668 41.227 1.00 36.26 ? 88 ALA D O 1 +ATOM 17750 C CB . ALA D 1 88 ? 21.582 2.051 40.606 1.00 34.12 ? 88 ALA D CB 1 +ATOM 17751 N N . GLY D 1 89 ? 20.412 -0.939 41.908 1.00 35.55 ? 89 GLY D N 1 +ATOM 17752 C CA . GLY D 1 89 ? 19.442 -1.991 41.653 1.00 33.84 ? 89 GLY D CA 1 +ATOM 17753 C C . GLY D 1 89 ? 19.139 -2.080 40.165 1.00 34.49 ? 89 GLY D C 1 +ATOM 17754 O O . GLY D 1 89 ? 20.035 -1.917 39.330 1.00 33.96 ? 89 GLY D O 1 +ATOM 17755 N N . ALA D 1 90 ? 17.880 -2.339 39.824 1.00 33.36 ? 90 ALA D N 1 +ATOM 17756 C CA . ALA D 1 90 ? 17.475 -2.424 38.422 1.00 33.53 ? 90 ALA D CA 1 +ATOM 17757 C C . ALA D 1 90 ? 17.189 -0.998 37.950 1.00 33.70 ? 90 ALA D C 1 +ATOM 17758 O O . ALA D 1 90 ? 16.033 -0.610 37.764 1.00 34.78 ? 90 ALA D O 1 +ATOM 17759 C CB . ALA D 1 90 ? 16.218 -3.294 38.292 1.00 30.52 ? 90 ALA D CB 1 +ATOM 17760 N N . TYR D 1 91 ? 18.251 -0.223 37.756 1.00 32.90 ? 91 TYR D N 1 +ATOM 17761 C CA . TYR D 1 91 ? 18.119 1.164 37.349 1.00 32.70 ? 91 TYR D CA 1 +ATOM 17762 C C . TYR D 1 91 ? 17.457 1.402 35.995 1.00 33.90 ? 91 TYR D C 1 +ATOM 17763 O O . TYR D 1 91 ? 17.551 0.583 35.080 1.00 33.59 ? 91 TYR D O 1 +ATOM 17764 C CB . TYR D 1 91 ? 19.492 1.844 37.383 1.00 31.32 ? 91 TYR D CB 1 +ATOM 17765 C CG . TYR D 1 91 ? 20.488 1.334 36.367 1.00 29.84 ? 91 TYR D CG 1 +ATOM 17766 C CD1 . TYR D 1 91 ? 20.497 1.817 35.057 1.00 30.41 ? 91 TYR D CD1 1 +ATOM 17767 C CD2 . TYR D 1 91 ? 21.432 0.380 36.720 1.00 29.66 ? 91 TYR D CD2 1 +ATOM 17768 C CE1 . TYR D 1 91 ? 21.431 1.360 34.127 1.00 30.06 ? 91 TYR D CE1 1 +ATOM 17769 C CE2 . TYR D 1 91 ? 22.369 -0.084 35.798 1.00 30.29 ? 91 TYR D CE2 1 +ATOM 17770 C CZ . TYR D 1 91 ? 22.368 0.411 34.505 1.00 30.04 ? 91 TYR D CZ 1 +ATOM 17771 O OH . TYR D 1 91 ? 23.330 -0.024 33.604 1.00 29.98 ? 91 TYR D OH 1 +ATOM 17772 N N . LYS D 1 92 ? 16.794 2.551 35.885 1.00 35.14 ? 92 LYS D N 1 +ATOM 17773 C CA . LYS D 1 92 ? 16.101 2.946 34.667 1.00 36.90 ? 92 LYS D CA 1 +ATOM 17774 C C . LYS D 1 92 ? 16.683 4.285 34.263 1.00 35.80 ? 92 LYS D C 1 +ATOM 17775 O O . LYS D 1 92 ? 17.460 4.870 35.016 1.00 34.40 ? 92 LYS D O 1 +ATOM 17776 C CB . LYS D 1 92 ? 14.607 3.096 34.949 1.00 39.89 ? 92 LYS D CB 1 +ATOM 17777 C CG . LYS D 1 92 ? 13.962 1.853 35.539 1.00 43.86 ? 92 LYS D CG 1 +ATOM 17778 C CD . LYS D 1 92 ? 12.515 2.114 35.923 1.00 49.23 ? 92 LYS D CD 1 +ATOM 17779 C CE . LYS D 1 92 ? 11.893 0.899 36.599 1.00 51.91 ? 92 LYS D CE 1 +ATOM 17780 N NZ . LYS D 1 92 ? 10.491 1.190 37.034 1.00 55.63 ? 92 LYS D NZ 1 +ATOM 17781 N N . LYS D 1 93 ? 16.319 4.792 33.091 1.00 35.09 ? 93 LYS D N 1 +ATOM 17782 C CA . LYS D 1 93 ? 16.878 6.077 32.712 1.00 34.86 ? 93 LYS D CA 1 +ATOM 17783 C C . LYS D 1 93 ? 16.362 7.186 33.616 1.00 32.66 ? 93 LYS D C 1 +ATOM 17784 O O . LYS D 1 93 ? 15.270 7.090 34.185 1.00 31.65 ? 93 LYS D O 1 +ATOM 17785 C CB . LYS D 1 93 ? 16.626 6.396 31.240 1.00 35.21 ? 93 LYS D CB 1 +ATOM 17786 C CG . LYS D 1 93 ? 15.221 6.668 30.833 1.00 36.63 ? 93 LYS D CG 1 +ATOM 17787 C CD . LYS D 1 93 ? 15.258 7.172 29.392 1.00 39.05 ? 93 LYS D CD 1 +ATOM 17788 C CE . LYS D 1 93 ? 13.870 7.408 28.826 1.00 43.95 ? 93 LYS D CE 1 +ATOM 17789 N NZ . LYS D 1 93 ? 13.971 7.953 27.436 1.00 47.42 ? 93 LYS D NZ 1 +ATOM 17790 N N . TYR D 1 94 ? 17.192 8.214 33.767 1.00 30.24 ? 94 TYR D N 1 +ATOM 17791 C CA . TYR D 1 94 ? 16.910 9.363 34.611 1.00 29.45 ? 94 TYR D CA 1 +ATOM 17792 C C . TYR D 1 94 ? 16.975 9.047 36.098 1.00 29.58 ? 94 TYR D C 1 +ATOM 17793 O O . TYR D 1 94 ? 16.541 9.839 36.929 1.00 30.39 ? 94 TYR D O 1 +ATOM 17794 C CB . TYR D 1 94 ? 15.568 10.006 34.244 1.00 28.31 ? 94 TYR D CB 1 +ATOM 17795 C CG . TYR D 1 94 ? 15.520 10.464 32.808 1.00 26.06 ? 94 TYR D CG 1 +ATOM 17796 C CD1 . TYR D 1 94 ? 16.668 10.919 32.170 1.00 27.69 ? 94 TYR D CD1 1 +ATOM 17797 C CD2 . TYR D 1 94 ? 14.329 10.450 32.084 1.00 27.56 ? 94 TYR D CD2 1 +ATOM 17798 C CE1 . TYR D 1 94 ? 16.642 11.347 30.845 1.00 28.01 ? 94 TYR D CE1 1 +ATOM 17799 C CE2 . TYR D 1 94 ? 14.287 10.883 30.752 1.00 25.83 ? 94 TYR D CE2 1 +ATOM 17800 C CZ . TYR D 1 94 ? 15.444 11.326 30.145 1.00 26.79 ? 94 TYR D CZ 1 +ATOM 17801 O OH . TYR D 1 94 ? 15.427 11.749 28.836 1.00 29.43 ? 94 TYR D OH 1 +ATOM 17802 N N . GLN D 1 95 ? 17.529 7.890 36.441 1.00 30.97 ? 95 GLN D N 1 +ATOM 17803 C CA . GLN D 1 95 ? 17.689 7.546 37.848 1.00 32.33 ? 95 GLN D CA 1 +ATOM 17804 C C . GLN D 1 95 ? 19.061 8.090 38.264 1.00 32.70 ? 95 GLN D C 1 +ATOM 17805 O O . GLN D 1 95 ? 20.022 8.000 37.507 1.00 31.49 ? 95 GLN D O 1 +ATOM 17806 C CB . GLN D 1 95 ? 17.643 6.037 38.045 1.00 32.74 ? 95 GLN D CB 1 +ATOM 17807 C CG . GLN D 1 95 ? 17.698 5.633 39.501 1.00 32.53 ? 95 GLN D CG 1 +ATOM 17808 C CD . GLN D 1 95 ? 17.553 4.137 39.695 1.00 34.09 ? 95 GLN D CD 1 +ATOM 17809 O OE1 . GLN D 1 95 ? 16.748 3.485 39.018 1.00 33.29 ? 95 GLN D OE1 1 +ATOM 17810 N NE2 . GLN D 1 95 ? 18.319 3.584 40.633 1.00 33.20 ? 95 GLN D NE2 1 +ATOM 17811 N N . ASP D 1 96 ? 19.144 8.654 39.462 1.00 34.12 ? 96 ASP D N 1 +ATOM 17812 C CA . ASP D 1 96 ? 20.384 9.245 39.961 1.00 35.87 ? 96 ASP D CA 1 +ATOM 17813 C C . ASP D 1 96 ? 20.321 9.172 41.485 1.00 35.89 ? 96 ASP D C 1 +ATOM 17814 O O . ASP D 1 96 ? 19.255 9.333 42.078 1.00 35.98 ? 96 ASP D O 1 +ATOM 17815 C CB . ASP D 1 96 ? 20.468 10.713 39.491 1.00 39.97 ? 96 ASP D CB 1 +ATOM 17816 C CG . ASP D 1 96 ? 21.806 11.395 39.841 1.00 45.21 ? 96 ASP D CG 1 +ATOM 17817 O OD1 . ASP D 1 96 ? 22.877 10.883 39.445 1.00 48.01 ? 96 ASP D OD1 1 +ATOM 17818 O OD2 . ASP D 1 96 ? 21.787 12.465 40.502 1.00 48.61 ? 96 ASP D OD2 1 +ATOM 17819 N N . PRO D 1 97 ? 21.457 8.903 42.143 1.00 35.97 ? 97 PRO D N 1 +ATOM 17820 C CA . PRO D 1 97 ? 22.770 8.663 41.540 1.00 34.25 ? 97 PRO D CA 1 +ATOM 17821 C C . PRO D 1 97 ? 22.936 7.184 41.212 1.00 33.91 ? 97 PRO D C 1 +ATOM 17822 O O . PRO D 1 97 ? 22.053 6.374 41.498 1.00 33.14 ? 97 PRO D O 1 +ATOM 17823 C CB . PRO D 1 97 ? 23.720 9.108 42.638 1.00 34.57 ? 97 PRO D CB 1 +ATOM 17824 C CG . PRO D 1 97 ? 23.019 8.607 43.868 1.00 35.45 ? 97 PRO D CG 1 +ATOM 17825 C CD . PRO D 1 97 ? 21.556 8.951 43.617 1.00 34.18 ? 97 PRO D CD 1 +ATOM 17826 N N . LEU D 1 98 ? 24.073 6.839 40.613 1.00 34.46 ? 98 LEU D N 1 +ATOM 17827 C CA . LEU D 1 98 ? 24.364 5.453 40.267 1.00 33.29 ? 98 LEU D CA 1 +ATOM 17828 C C . LEU D 1 98 ? 25.590 4.961 41.041 1.00 32.56 ? 98 LEU D C 1 +ATOM 17829 O O . LEU D 1 98 ? 25.876 5.464 42.125 1.00 32.40 ? 98 LEU D O 1 +ATOM 17830 C CB . LEU D 1 98 ? 24.555 5.301 38.750 1.00 32.52 ? 98 LEU D CB 1 +ATOM 17831 C CG . LEU D 1 98 ? 23.319 5.690 37.918 1.00 33.58 ? 98 LEU D CG 1 +ATOM 17832 C CD1 . LEU D 1 98 ? 23.657 5.602 36.444 1.00 33.35 ? 98 LEU D CD1 1 +ATOM 17833 C CD2 . LEU D 1 98 ? 22.132 4.793 38.255 1.00 31.65 ? 98 LEU D CD2 1 +ATOM 17834 N N . TYR D 1 99 ? 26.308 3.992 40.484 1.00 32.13 ? 99 TYR D N 1 +ATOM 17835 C CA . TYR D 1 99 ? 27.457 3.386 41.148 1.00 32.73 ? 99 TYR D CA 1 +ATOM 17836 C C . TYR D 1 99 ? 28.742 4.191 41.234 1.00 33.66 ? 99 TYR D C 1 +ATOM 17837 O O . TYR D 1 99 ? 29.475 4.080 42.220 1.00 35.12 ? 99 TYR D O 1 +ATOM 17838 C CB . TYR D 1 99 ? 27.803 2.060 40.477 1.00 31.56 ? 99 TYR D CB 1 +ATOM 17839 C CG . TYR D 1 99 ? 26.630 1.159 40.190 1.00 32.17 ? 99 TYR D CG 1 +ATOM 17840 C CD1 . TYR D 1 99 ? 26.095 0.332 41.181 1.00 31.16 ? 99 TYR D CD1 1 +ATOM 17841 C CD2 . TYR D 1 99 ? 26.087 1.088 38.904 1.00 30.68 ? 99 TYR D CD2 1 +ATOM 17842 C CE1 . TYR D 1 99 ? 25.055 -0.552 40.891 1.00 31.24 ? 99 TYR D CE1 1 +ATOM 17843 C CE2 . TYR D 1 99 ? 25.054 0.212 38.607 1.00 30.55 ? 99 TYR D CE2 1 +ATOM 17844 C CZ . TYR D 1 99 ? 24.545 -0.606 39.597 1.00 31.55 ? 99 TYR D CZ 1 +ATOM 17845 O OH . TYR D 1 99 ? 23.555 -1.503 39.275 1.00 35.24 ? 99 TYR D OH 1 +ATOM 17846 N N . VAL D 1 100 ? 29.026 4.979 40.205 1.00 33.19 ? 100 VAL D N 1 +ATOM 17847 C CA . VAL D 1 100 ? 30.265 5.745 40.156 1.00 33.75 ? 100 VAL D CA 1 +ATOM 17848 C C . VAL D 1 100 ? 30.116 7.258 40.315 1.00 34.54 ? 100 VAL D C 1 +ATOM 17849 O O . VAL D 1 100 ? 29.169 7.853 39.796 1.00 33.63 ? 100 VAL D O 1 +ATOM 17850 C CB . VAL D 1 100 ? 31.005 5.458 38.824 1.00 33.17 ? 100 VAL D CB 1 +ATOM 17851 C CG1 . VAL D 1 100 ? 32.313 6.249 38.759 1.00 32.68 ? 100 VAL D CG1 1 +ATOM 17852 C CG2 . VAL D 1 100 ? 31.269 3.970 38.705 1.00 31.82 ? 100 VAL D CG2 1 +ATOM 17853 N N . SER D 1 101 ? 31.083 7.871 41.004 1.00 35.38 ? 101 SER D N 1 +ATOM 17854 C CA . SER D 1 101 ? 31.095 9.314 41.242 1.00 34.28 ? 101 SER D CA 1 +ATOM 17855 C C . SER D 1 101 ? 32.391 10.003 40.817 1.00 34.93 ? 101 SER D C 1 +ATOM 17856 O O . SER D 1 101 ? 33.379 9.947 41.540 1.00 36.63 ? 101 SER D O 1 +ATOM 17857 C CB . SER D 1 101 ? 30.875 9.601 42.719 1.00 34.45 ? 101 SER D CB 1 +ATOM 17858 O OG . SER D 1 101 ? 29.628 9.109 43.163 1.00 38.27 ? 101 SER D OG 1 +ATOM 17859 N N . ILE D 1 102 ? 32.384 10.645 39.650 1.00 34.06 ? 102 ILE D N 1 +ATOM 17860 C CA . ILE D 1 102 ? 33.546 11.383 39.158 1.00 33.23 ? 102 ILE D CA 1 +ATOM 17861 C C . ILE D 1 102 ? 33.108 12.862 39.173 1.00 33.64 ? 102 ILE D C 1 +ATOM 17862 O O . ILE D 1 102 ? 32.449 13.321 38.234 1.00 31.66 ? 102 ILE D O 1 +ATOM 17863 C CB . ILE D 1 102 ? 33.916 11.019 37.684 1.00 34.33 ? 102 ILE D CB 1 +ATOM 17864 C CG1 . ILE D 1 102 ? 33.921 9.502 37.462 1.00 33.24 ? 102 ILE D CG1 1 +ATOM 17865 C CG2 . ILE D 1 102 ? 35.291 11.590 37.349 1.00 32.48 ? 102 ILE D CG2 1 +ATOM 17866 C CD1 . ILE D 1 102 ? 35.024 8.758 38.181 1.00 35.23 ? 102 ILE D CD1 1 +ATOM 17867 N N . PRO D 1 103 ? 33.483 13.625 40.226 1.00 33.08 ? 103 PRO D N 1 +ATOM 17868 C CA . PRO D 1 103 ? 33.135 15.046 40.389 1.00 31.69 ? 103 PRO D CA 1 +ATOM 17869 C C . PRO D 1 103 ? 33.876 15.975 39.434 1.00 32.07 ? 103 PRO D C 1 +ATOM 17870 O O . PRO D 1 103 ? 34.483 16.961 39.857 1.00 30.32 ? 103 PRO D O 1 +ATOM 17871 C CB . PRO D 1 103 ? 33.505 15.347 41.843 1.00 32.22 ? 103 PRO D CB 1 +ATOM 17872 C CG . PRO D 1 103 ? 33.862 13.994 42.452 1.00 35.50 ? 103 PRO D CG 1 +ATOM 17873 C CD . PRO D 1 103 ? 34.391 13.198 41.300 1.00 33.65 ? 103 PRO D CD 1 +ATOM 17874 N N . LEU D 1 104 ? 33.813 15.659 38.148 1.00 31.61 ? 104 LEU D N 1 +ATOM 17875 C CA . LEU D 1 104 ? 34.475 16.447 37.124 1.00 31.73 ? 104 LEU D CA 1 +ATOM 17876 C C . LEU D 1 104 ? 33.509 16.832 36.022 1.00 32.00 ? 104 LEU D C 1 +ATOM 17877 O O . LEU D 1 104 ? 32.766 15.992 35.527 1.00 32.97 ? 104 LEU D O 1 +ATOM 17878 C CB . LEU D 1 104 ? 35.618 15.642 36.499 1.00 30.19 ? 104 LEU D CB 1 +ATOM 17879 C CG . LEU D 1 104 ? 36.118 16.113 35.127 1.00 31.48 ? 104 LEU D CG 1 +ATOM 17880 C CD1 . LEU D 1 104 ? 36.878 17.416 35.266 1.00 31.47 ? 104 LEU D CD1 1 +ATOM 17881 C CD2 . LEU D 1 104 ? 37.011 15.052 34.507 1.00 33.31 ? 104 LEU D CD2 1 +ATOM 17882 N N . PHE D 1 105 ? 33.504 18.100 35.637 1.00 32.34 ? 105 PHE D N 1 +ATOM 17883 C CA . PHE D 1 105 ? 32.657 18.506 34.533 1.00 33.42 ? 105 PHE D CA 1 +ATOM 17884 C C . PHE D 1 105 ? 33.432 19.460 33.655 1.00 34.11 ? 105 PHE D C 1 +ATOM 17885 O O . PHE D 1 105 ? 34.279 20.213 34.132 1.00 34.83 ? 105 PHE D O 1 +ATOM 17886 C CB . PHE D 1 105 ? 31.318 19.101 35.021 1.00 33.06 ? 105 PHE D CB 1 +ATOM 17887 C CG . PHE D 1 105 ? 31.379 20.532 35.488 1.00 32.01 ? 105 PHE D CG 1 +ATOM 17888 C CD1 . PHE D 1 105 ? 31.409 21.579 34.575 1.00 31.33 ? 105 PHE D CD1 1 +ATOM 17889 C CD2 . PHE D 1 105 ? 31.320 20.832 36.847 1.00 31.88 ? 105 PHE D CD2 1 +ATOM 17890 C CE1 . PHE D 1 105 ? 31.373 22.905 35.009 1.00 32.39 ? 105 PHE D CE1 1 +ATOM 17891 C CE2 . PHE D 1 105 ? 31.283 22.154 37.293 1.00 30.48 ? 105 PHE D CE2 1 +ATOM 17892 C CZ . PHE D 1 105 ? 31.308 23.193 36.376 1.00 31.07 ? 105 PHE D CZ 1 +ATOM 17893 N N . ILE D 1 106 ? 33.180 19.386 32.355 1.00 34.09 ? 106 ILE D N 1 +ATOM 17894 C CA . ILE D 1 106 ? 33.862 20.251 31.419 1.00 33.32 ? 106 ILE D CA 1 +ATOM 17895 C C . ILE D 1 106 ? 32.876 21.192 30.770 1.00 35.67 ? 106 ILE D C 1 +ATOM 17896 O O . ILE D 1 106 ? 31.791 20.794 30.354 1.00 36.07 ? 106 ILE D O 1 +ATOM 17897 C CB . ILE D 1 106 ? 34.570 19.444 30.336 1.00 32.97 ? 106 ILE D CB 1 +ATOM 17898 C CG1 . ILE D 1 106 ? 35.609 18.518 30.973 1.00 32.01 ? 106 ILE D CG1 1 +ATOM 17899 C CG2 . ILE D 1 106 ? 35.252 20.381 29.360 1.00 31.56 ? 106 ILE D CG2 1 +ATOM 17900 C CD1 . ILE D 1 106 ? 36.214 17.533 30.011 1.00 31.97 ? 106 ILE D CD1 1 +ATOM 17901 N N . SER D 1 107 ? 33.257 22.458 30.709 1.00 37.63 ? 107 SER D N 1 +ATOM 17902 C CA . SER D 1 107 ? 32.425 23.481 30.109 1.00 37.62 ? 107 SER D CA 1 +ATOM 17903 C C . SER D 1 107 ? 33.017 23.823 28.756 1.00 38.90 ? 107 SER D C 1 +ATOM 17904 O O . SER D 1 107 ? 34.233 23.965 28.620 1.00 39.80 ? 107 SER D O 1 +ATOM 17905 C CB . SER D 1 107 ? 32.411 24.726 30.992 1.00 38.88 ? 107 SER D CB 1 +ATOM 17906 O OG . SER D 1 107 ? 31.936 25.854 30.280 1.00 41.65 ? 107 SER D OG 1 +ATOM 17907 N N . VAL D 1 108 ? 32.162 23.926 27.749 1.00 39.42 ? 108 VAL D N 1 +ATOM 17908 C CA . VAL D 1 108 ? 32.608 24.283 26.412 1.00 39.20 ? 108 VAL D CA 1 +ATOM 17909 C C . VAL D 1 108 ? 31.800 25.505 26.030 1.00 41.43 ? 108 VAL D C 1 +ATOM 17910 O O . VAL D 1 108 ? 30.596 25.425 25.777 1.00 40.72 ? 108 VAL D O 1 +ATOM 17911 C CB . VAL D 1 108 ? 32.358 23.165 25.391 1.00 37.64 ? 108 VAL D CB 1 +ATOM 17912 C CG1 . VAL D 1 108 ? 32.965 23.552 24.064 1.00 35.77 ? 108 VAL D CG1 1 +ATOM 17913 C CG2 . VAL D 1 108 ? 32.966 21.864 25.886 1.00 36.41 ? 108 VAL D CG2 1 +ATOM 17914 N N . LYS D 1 109 ? 32.475 26.646 26.023 1.00 44.06 ? 109 LYS D N 1 +ATOM 17915 C CA . LYS D 1 109 ? 31.849 27.915 25.706 1.00 46.10 ? 109 LYS D CA 1 +ATOM 17916 C C . LYS D 1 109 ? 32.623 28.560 24.561 1.00 47.38 ? 109 LYS D C 1 +ATOM 17917 O O . LYS D 1 109 ? 33.852 28.662 24.606 1.00 47.76 ? 109 LYS D O 1 +ATOM 17918 C CB . LYS D 1 109 ? 31.861 28.802 26.953 1.00 46.83 ? 109 LYS D CB 1 +ATOM 17919 C CG . LYS D 1 109 ? 31.090 30.091 26.814 1.00 50.46 ? 109 LYS D CG 1 +ATOM 17920 C CD . LYS D 1 109 ? 30.911 30.782 28.153 1.00 51.93 ? 109 LYS D CD 1 +ATOM 17921 C CE . LYS D 1 109 ? 32.236 31.103 28.817 1.00 52.74 ? 109 LYS D CE 1 +ATOM 17922 N NZ . LYS D 1 109 ? 32.027 31.961 30.018 1.00 54.55 ? 109 LYS D NZ 1 +ATOM 17923 N N . ASP D 1 110 ? 31.900 28.983 23.530 1.00 48.35 ? 110 ASP D N 1 +ATOM 17924 C CA . ASP D 1 110 ? 32.526 29.594 22.367 1.00 49.50 ? 110 ASP D CA 1 +ATOM 17925 C C . ASP D 1 110 ? 33.587 28.641 21.800 1.00 48.21 ? 110 ASP D C 1 +ATOM 17926 O O . ASP D 1 110 ? 34.643 29.074 21.325 1.00 48.62 ? 110 ASP D O 1 +ATOM 17927 C CB . ASP D 1 110 ? 33.176 30.937 22.741 1.00 52.27 ? 110 ASP D CB 1 +ATOM 17928 C CG . ASP D 1 110 ? 32.168 31.956 23.269 1.00 56.84 ? 110 ASP D CG 1 +ATOM 17929 O OD1 . ASP D 1 110 ? 31.142 32.190 22.594 1.00 59.45 ? 110 ASP D OD1 1 +ATOM 17930 O OD2 . ASP D 1 110 ? 32.401 32.534 24.358 1.00 59.80 ? 110 ASP D OD2 1 +ATOM 17931 N N . GLY D 1 111 ? 33.304 27.343 21.867 1.00 45.28 ? 111 GLY D N 1 +ATOM 17932 C CA . GLY D 1 111 ? 34.230 26.347 21.348 1.00 43.16 ? 111 GLY D CA 1 +ATOM 17933 C C . GLY D 1 111 ? 35.440 26.036 22.223 1.00 42.20 ? 111 GLY D C 1 +ATOM 17934 O O . GLY D 1 111 ? 36.241 25.159 21.894 1.00 40.84 ? 111 GLY D O 1 +ATOM 17935 N N . VAL D 1 112 ? 35.574 26.738 23.342 1.00 40.95 ? 112 VAL D N 1 +ATOM 17936 C CA . VAL D 1 112 ? 36.700 26.528 24.244 1.00 38.16 ? 112 VAL D CA 1 +ATOM 17937 C C . VAL D 1 112 ? 36.289 25.724 25.467 1.00 37.94 ? 112 VAL D C 1 +ATOM 17938 O O . VAL D 1 112 ? 35.297 26.043 26.132 1.00 37.22 ? 112 VAL D O 1 +ATOM 17939 C CB . VAL D 1 112 ? 37.291 27.881 24.706 1.00 38.18 ? 112 VAL D CB 1 +ATOM 17940 C CG1 . VAL D 1 112 ? 38.429 27.649 25.695 1.00 35.41 ? 112 VAL D CG1 1 +ATOM 17941 C CG2 . VAL D 1 112 ? 37.782 28.666 23.492 1.00 36.90 ? 112 VAL D CG2 1 +ATOM 17942 N N . ALA D 1 113 ? 37.067 24.688 25.771 1.00 36.76 ? 113 ALA D N 1 +ATOM 17943 C CA . ALA D 1 113 ? 36.771 23.828 26.909 1.00 36.90 ? 113 ALA D CA 1 +ATOM 17944 C C . ALA D 1 113 ? 37.585 24.160 28.151 1.00 37.47 ? 113 ALA D C 1 +ATOM 17945 O O . ALA D 1 113 ? 38.759 24.517 28.063 1.00 39.73 ? 113 ALA D O 1 +ATOM 17946 C CB . ALA D 1 113 ? 36.998 22.385 26.529 1.00 36.00 ? 113 ALA D CB 1 +ATOM 17947 N N . THR D 1 114 ? 36.945 24.034 29.307 1.00 36.64 ? 114 THR D N 1 +ATOM 17948 C CA . THR D 1 114 ? 37.586 24.282 30.593 1.00 36.88 ? 114 THR D CA 1 +ATOM 17949 C C . THR D 1 114 ? 37.051 23.229 31.556 1.00 36.98 ? 114 THR D C 1 +ATOM 17950 O O . THR D 1 114 ? 35.854 22.954 31.570 1.00 38.75 ? 114 THR D O 1 +ATOM 17951 C CB . THR D 1 114 ? 37.236 25.678 31.148 1.00 37.77 ? 114 THR D CB 1 +ATOM 17952 O OG1 . THR D 1 114 ? 37.550 26.678 30.167 1.00 37.13 ? 114 THR D OG1 1 +ATOM 17953 C CG2 . THR D 1 114 ? 38.019 25.957 32.428 1.00 34.06 ? 114 THR D CG2 1 +ATOM 17954 N N . GLY D 1 115 ? 37.933 22.645 32.356 1.00 36.59 ? 115 GLY D N 1 +ATOM 17955 C CA . GLY D 1 115 ? 37.510 21.618 33.287 1.00 35.40 ? 115 GLY D CA 1 +ATOM 17956 C C . GLY D 1 115 ? 37.424 22.095 34.718 1.00 35.68 ? 115 GLY D C 1 +ATOM 17957 O O . GLY D 1 115 ? 38.111 23.032 35.111 1.00 35.43 ? 115 GLY D O 1 +ATOM 17958 N N . TYR D 1 116 ? 36.556 21.450 35.490 1.00 35.52 ? 116 TYR D N 1 +ATOM 17959 C CA . TYR D 1 116 ? 36.364 21.773 36.893 1.00 34.97 ? 116 TYR D CA 1 +ATOM 17960 C C . TYR D 1 116 ? 36.265 20.464 37.647 1.00 35.80 ? 116 TYR D C 1 +ATOM 17961 O O . TYR D 1 116 ? 35.313 19.704 37.476 1.00 36.45 ? 116 TYR D O 1 +ATOM 17962 C CB . TYR D 1 116 ? 35.091 22.588 37.097 1.00 35.36 ? 116 TYR D CB 1 +ATOM 17963 C CG . TYR D 1 116 ? 35.102 23.895 36.349 1.00 35.82 ? 116 TYR D CG 1 +ATOM 17964 C CD1 . TYR D 1 116 ? 34.730 23.955 35.006 1.00 33.77 ? 116 TYR D CD1 1 +ATOM 17965 C CD2 . TYR D 1 116 ? 35.535 25.070 36.971 1.00 35.89 ? 116 TYR D CD2 1 +ATOM 17966 C CE1 . TYR D 1 116 ? 34.791 25.149 34.297 1.00 34.76 ? 116 TYR D CE1 1 +ATOM 17967 C CE2 . TYR D 1 116 ? 35.601 26.270 36.270 1.00 35.50 ? 116 TYR D CE2 1 +ATOM 17968 C CZ . TYR D 1 116 ? 35.227 26.302 34.937 1.00 35.62 ? 116 TYR D CZ 1 +ATOM 17969 O OH . TYR D 1 116 ? 35.287 27.484 34.237 1.00 38.10 ? 116 TYR D OH 1 +ATOM 17970 N N . PHE D 1 117 ? 37.268 20.202 38.477 1.00 35.85 ? 117 PHE D N 1 +ATOM 17971 C CA . PHE D 1 117 ? 37.315 18.979 39.251 1.00 34.55 ? 117 PHE D CA 1 +ATOM 17972 C C . PHE D 1 117 ? 37.310 19.293 40.740 1.00 33.95 ? 117 PHE D C 1 +ATOM 17973 O O . PHE D 1 117 ? 38.221 19.948 41.243 1.00 35.79 ? 117 PHE D O 1 +ATOM 17974 C CB . PHE D 1 117 ? 38.566 18.192 38.846 1.00 31.82 ? 117 PHE D CB 1 +ATOM 17975 C CG . PHE D 1 117 ? 38.914 17.067 39.774 1.00 33.08 ? 117 PHE D CG 1 +ATOM 17976 C CD1 . PHE D 1 117 ? 37.948 16.156 40.181 1.00 31.43 ? 117 PHE D CD1 1 +ATOM 17977 C CD2 . PHE D 1 117 ? 40.229 16.901 40.222 1.00 31.62 ? 117 PHE D CD2 1 +ATOM 17978 C CE1 . PHE D 1 117 ? 38.290 15.092 41.027 1.00 33.04 ? 117 PHE D CE1 1 +ATOM 17979 C CE2 . PHE D 1 117 ? 40.572 15.847 41.059 1.00 30.49 ? 117 PHE D CE2 1 +ATOM 17980 C CZ . PHE D 1 117 ? 39.601 14.939 41.463 1.00 30.18 ? 117 PHE D CZ 1 +ATOM 17981 N N . PHE D 1 118 ? 36.274 18.839 41.438 1.00 32.00 ? 118 PHE D N 1 +ATOM 17982 C CA . PHE D 1 118 ? 36.175 19.056 42.869 1.00 32.42 ? 118 PHE D CA 1 +ATOM 17983 C C . PHE D 1 118 ? 36.604 17.793 43.593 1.00 33.80 ? 118 PHE D C 1 +ATOM 17984 O O . PHE D 1 118 ? 35.895 16.796 43.595 1.00 34.85 ? 118 PHE D O 1 +ATOM 17985 C CB . PHE D 1 118 ? 34.748 19.438 43.240 1.00 31.44 ? 118 PHE D CB 1 +ATOM 17986 C CG . PHE D 1 118 ? 34.273 20.670 42.537 1.00 30.64 ? 118 PHE D CG 1 +ATOM 17987 C CD1 . PHE D 1 118 ? 33.912 20.622 41.191 1.00 30.98 ? 118 PHE D CD1 1 +ATOM 17988 C CD2 . PHE D 1 118 ? 34.257 21.896 43.194 1.00 30.95 ? 118 PHE D CD2 1 +ATOM 17989 C CE1 . PHE D 1 118 ? 33.545 21.779 40.502 1.00 29.34 ? 118 PHE D CE1 1 +ATOM 17990 C CE2 . PHE D 1 118 ? 33.896 23.057 42.526 1.00 31.11 ? 118 PHE D CE2 1 +ATOM 17991 C CZ . PHE D 1 118 ? 33.539 22.999 41.173 1.00 32.56 ? 118 PHE D CZ 1 +ATOM 17992 N N . ASN D 1 119 ? 37.781 17.834 44.206 1.00 35.47 ? 119 ASN D N 1 +ATOM 17993 C CA . ASN D 1 119 ? 38.302 16.667 44.904 1.00 35.91 ? 119 ASN D CA 1 +ATOM 17994 C C . ASN D 1 119 ? 37.694 16.411 46.280 1.00 35.52 ? 119 ASN D C 1 +ATOM 17995 O O . ASN D 1 119 ? 38.352 16.559 47.304 1.00 35.72 ? 119 ASN D O 1 +ATOM 17996 C CB . ASN D 1 119 ? 39.828 16.759 45.013 1.00 37.19 ? 119 ASN D CB 1 +ATOM 17997 C CG . ASN D 1 119 ? 40.453 15.467 45.491 1.00 37.30 ? 119 ASN D CG 1 +ATOM 17998 O OD1 . ASN D 1 119 ? 39.895 14.388 45.296 1.00 38.50 ? 119 ASN D OD1 1 +ATOM 17999 N ND2 . ASN D 1 119 ? 41.623 15.566 46.103 1.00 37.75 ? 119 ASN D ND2 1 +ATOM 18000 N N . SER D 1 120 ? 36.423 16.029 46.284 1.00 35.41 ? 120 SER D N 1 +ATOM 18001 C CA . SER D 1 120 ? 35.706 15.689 47.504 1.00 33.52 ? 120 SER D CA 1 +ATOM 18002 C C . SER D 1 120 ? 34.912 14.415 47.197 1.00 33.98 ? 120 SER D C 1 +ATOM 18003 O O . SER D 1 120 ? 34.269 14.315 46.151 1.00 33.76 ? 120 SER D O 1 +ATOM 18004 C CB . SER D 1 120 ? 34.752 16.809 47.904 1.00 33.20 ? 120 SER D CB 1 +ATOM 18005 O OG . SER D 1 120 ? 33.979 16.421 49.029 1.00 31.70 ? 120 SER D OG 1 +ATOM 18006 N N . ALA D 1 121 ? 34.972 13.441 48.097 1.00 33.14 ? 121 ALA D N 1 +ATOM 18007 C CA . ALA D 1 121 ? 34.267 12.183 47.905 1.00 31.46 ? 121 ALA D CA 1 +ATOM 18008 C C . ALA D 1 121 ? 32.999 12.158 48.751 1.00 32.32 ? 121 ALA D C 1 +ATOM 18009 O O . ALA D 1 121 ? 32.442 11.086 49.027 1.00 32.58 ? 121 ALA D O 1 +ATOM 18010 C CB . ALA D 1 121 ? 35.169 11.020 48.275 1.00 31.88 ? 121 ALA D CB 1 +ATOM 18011 N N . SER D 1 122 ? 32.560 13.340 49.176 1.00 30.74 ? 122 SER D N 1 +ATOM 18012 C CA . SER D 1 122 ? 31.344 13.461 49.966 1.00 31.17 ? 122 SER D CA 1 +ATOM 18013 C C . SER D 1 122 ? 30.170 13.588 48.986 1.00 31.05 ? 122 SER D C 1 +ATOM 18014 O O . SER D 1 122 ? 30.368 13.504 47.770 1.00 29.14 ? 122 SER D O 1 +ATOM 18015 C CB . SER D 1 122 ? 31.409 14.698 50.858 1.00 31.01 ? 122 SER D CB 1 +ATOM 18016 O OG . SER D 1 122 ? 31.496 15.866 50.065 1.00 32.45 ? 122 SER D OG 1 +ATOM 18017 N N . LYS D 1 123 ? 28.961 13.792 49.509 1.00 30.83 ? 123 LYS D N 1 +ATOM 18018 C CA . LYS D 1 123 ? 27.779 13.911 48.660 1.00 31.93 ? 123 LYS D CA 1 +ATOM 18019 C C . LYS D 1 123 ? 27.706 15.280 47.974 1.00 31.78 ? 123 LYS D C 1 +ATOM 18020 O O . LYS D 1 123 ? 26.928 16.157 48.368 1.00 30.09 ? 123 LYS D O 1 +ATOM 18021 C CB . LYS D 1 123 ? 26.508 13.657 49.479 1.00 33.10 ? 123 LYS D CB 1 +ATOM 18022 C CG . LYS D 1 123 ? 25.238 13.694 48.640 1.00 39.57 ? 123 LYS D CG 1 +ATOM 18023 C CD . LYS D 1 123 ? 23.974 13.514 49.465 1.00 40.04 ? 123 LYS D CD 1 +ATOM 18024 C CE . LYS D 1 123 ? 23.804 12.077 49.893 1.00 44.38 ? 123 LYS D CE 1 +ATOM 18025 N NZ . LYS D 1 123 ? 22.440 11.837 50.479 1.00 48.24 ? 123 LYS D NZ 1 +ATOM 18026 N N . VAL D 1 124 ? 28.529 15.449 46.943 1.00 31.50 ? 124 VAL D N 1 +ATOM 18027 C CA . VAL D 1 124 ? 28.596 16.690 46.182 1.00 32.18 ? 124 VAL D CA 1 +ATOM 18028 C C . VAL D 1 124 ? 27.403 16.871 45.237 1.00 32.96 ? 124 VAL D C 1 +ATOM 18029 O O . VAL D 1 124 ? 27.018 15.955 44.517 1.00 32.56 ? 124 VAL D O 1 +ATOM 18030 C CB . VAL D 1 124 ? 29.880 16.741 45.343 1.00 32.59 ? 124 VAL D CB 1 +ATOM 18031 C CG1 . VAL D 1 124 ? 29.890 18.003 44.487 1.00 32.66 ? 124 VAL D CG1 1 +ATOM 18032 C CG2 . VAL D 1 124 ? 31.098 16.690 46.255 1.00 31.23 ? 124 VAL D CG2 1 +ATOM 18033 N N . ILE D 1 125 ? 26.839 18.071 45.233 1.00 32.79 ? 125 ILE D N 1 +ATOM 18034 C CA . ILE D 1 125 ? 25.700 18.379 44.390 1.00 32.71 ? 125 ILE D CA 1 +ATOM 18035 C C . ILE D 1 125 ? 26.089 19.284 43.225 1.00 33.66 ? 125 ILE D C 1 +ATOM 18036 O O . ILE D 1 125 ? 26.677 20.343 43.433 1.00 32.95 ? 125 ILE D O 1 +ATOM 18037 C CB . ILE D 1 125 ? 24.593 19.117 45.177 1.00 33.55 ? 125 ILE D CB 1 +ATOM 18038 C CG1 . ILE D 1 125 ? 24.261 18.369 46.477 1.00 32.89 ? 125 ILE D CG1 1 +ATOM 18039 C CG2 . ILE D 1 125 ? 23.360 19.269 44.296 1.00 31.72 ? 125 ILE D CG2 1 +ATOM 18040 C CD1 . ILE D 1 125 ? 23.817 16.934 46.277 1.00 34.20 ? 125 ILE D CD1 1 +ATOM 18041 N N . PHE D 1 126 ? 25.767 18.864 42.003 1.00 32.86 ? 126 PHE D N 1 +ATOM 18042 C CA . PHE D 1 126 ? 26.035 19.683 40.834 1.00 33.25 ? 126 PHE D CA 1 +ATOM 18043 C C . PHE D 1 126 ? 24.707 20.148 40.261 1.00 34.16 ? 126 PHE D C 1 +ATOM 18044 O O . PHE D 1 126 ? 24.036 19.416 39.541 1.00 33.70 ? 126 PHE D O 1 +ATOM 18045 C CB . PHE D 1 126 ? 26.793 18.912 39.757 1.00 33.02 ? 126 PHE D CB 1 +ATOM 18046 C CG . PHE D 1 126 ? 28.229 18.667 40.085 1.00 33.23 ? 126 PHE D CG 1 +ATOM 18047 C CD1 . PHE D 1 126 ? 28.603 17.589 40.879 1.00 33.20 ? 126 PHE D CD1 1 +ATOM 18048 C CD2 . PHE D 1 126 ? 29.217 19.511 39.593 1.00 33.40 ? 126 PHE D CD2 1 +ATOM 18049 C CE1 . PHE D 1 126 ? 29.947 17.351 41.176 1.00 32.94 ? 126 PHE D CE1 1 +ATOM 18050 C CE2 . PHE D 1 126 ? 30.572 19.280 39.886 1.00 32.00 ? 126 PHE D CE2 1 +ATOM 18051 C CZ . PHE D 1 126 ? 30.934 18.204 40.673 1.00 30.07 ? 126 PHE D CZ 1 +ATOM 18052 N N . ASP D 1 127 ? 24.318 21.367 40.598 1.00 36.66 ? 127 ASP D N 1 +ATOM 18053 C CA . ASP D 1 127 ? 23.073 21.925 40.093 1.00 37.47 ? 127 ASP D CA 1 +ATOM 18054 C C . ASP D 1 127 ? 23.405 22.674 38.799 1.00 35.95 ? 127 ASP D C 1 +ATOM 18055 O O . ASP D 1 127 ? 23.835 23.825 38.824 1.00 36.19 ? 127 ASP D O 1 +ATOM 18056 C CB . ASP D 1 127 ? 22.466 22.861 41.133 1.00 40.81 ? 127 ASP D CB 1 +ATOM 18057 C CG . ASP D 1 127 ? 21.046 23.245 40.797 1.00 45.96 ? 127 ASP D CG 1 +ATOM 18058 O OD1 . ASP D 1 127 ? 20.848 23.873 39.727 1.00 47.93 ? 127 ASP D OD1 1 +ATOM 18059 O OD2 . ASP D 1 127 ? 20.135 22.912 41.593 1.00 48.13 ? 127 ASP D OD2 1 +ATOM 18060 N N . VAL D 1 128 ? 23.207 22.006 37.669 1.00 34.31 ? 128 VAL D N 1 +ATOM 18061 C CA . VAL D 1 128 ? 23.534 22.581 36.372 1.00 33.22 ? 128 VAL D CA 1 +ATOM 18062 C C . VAL D 1 128 ? 22.379 23.315 35.693 1.00 33.89 ? 128 VAL D C 1 +ATOM 18063 O O . VAL D 1 128 ? 21.654 22.749 34.886 1.00 35.07 ? 128 VAL D O 1 +ATOM 18064 C CB . VAL D 1 128 ? 24.063 21.474 35.431 1.00 31.95 ? 128 VAL D CB 1 +ATOM 18065 C CG1 . VAL D 1 128 ? 24.626 22.069 34.164 1.00 29.85 ? 128 VAL D CG1 1 +ATOM 18066 C CG2 . VAL D 1 128 ? 25.120 20.666 36.146 1.00 31.26 ? 128 VAL D CG2 1 +ATOM 18067 N N . GLY D 1 129 ? 22.221 24.585 36.029 1.00 34.79 ? 129 GLY D N 1 +ATOM 18068 C CA . GLY D 1 129 ? 21.176 25.399 35.438 1.00 34.60 ? 129 GLY D CA 1 +ATOM 18069 C C . GLY D 1 129 ? 19.770 24.986 35.803 1.00 35.22 ? 129 GLY D C 1 +ATOM 18070 O O . GLY D 1 129 ? 18.860 25.101 34.985 1.00 36.17 ? 129 GLY D O 1 +ATOM 18071 N N . LEU D 1 130 ? 19.585 24.519 37.032 1.00 35.64 ? 130 LEU D N 1 +ATOM 18072 C CA . LEU D 1 130 ? 18.274 24.076 37.500 1.00 37.47 ? 130 LEU D CA 1 +ATOM 18073 C C . LEU D 1 130 ? 17.768 25.042 38.569 1.00 37.90 ? 130 LEU D C 1 +ATOM 18074 O O . LEU D 1 130 ? 16.685 25.610 38.450 1.00 38.09 ? 130 LEU D O 1 +ATOM 18075 C CB . LEU D 1 130 ? 18.387 22.643 38.048 1.00 36.91 ? 130 LEU D CB 1 +ATOM 18076 C CG . LEU D 1 130 ? 17.165 21.730 38.225 1.00 39.17 ? 130 LEU D CG 1 +ATOM 18077 C CD1 . LEU D 1 130 ? 16.673 21.787 39.642 1.00 38.29 ? 130 LEU D CD1 1 +ATOM 18078 C CD2 . LEU D 1 130 ? 16.075 22.109 37.236 1.00 36.31 ? 130 LEU D CD2 1 +ATOM 18079 N N . GLU D 1 131 ? 18.562 25.239 39.613 1.00 40.14 ? 131 GLU D N 1 +ATOM 18080 C CA . GLU D 1 131 ? 18.192 26.161 40.680 1.00 41.18 ? 131 GLU D CA 1 +ATOM 18081 C C . GLU D 1 131 ? 18.152 27.551 40.057 1.00 40.01 ? 131 GLU D C 1 +ATOM 18082 O O . GLU D 1 131 ? 17.209 28.310 40.256 1.00 39.18 ? 131 GLU D O 1 +ATOM 18083 C CB . GLU D 1 131 ? 19.233 26.111 41.799 1.00 44.71 ? 131 GLU D CB 1 +ATOM 18084 C CG . GLU D 1 131 ? 18.843 26.887 43.042 1.00 49.45 ? 131 GLU D CG 1 +ATOM 18085 C CD . GLU D 1 131 ? 19.946 26.903 44.084 1.00 53.54 ? 131 GLU D CD 1 +ATOM 18086 O OE1 . GLU D 1 131 ? 20.412 25.808 44.475 1.00 54.72 ? 131 GLU D OE1 1 +ATOM 18087 O OE2 . GLU D 1 131 ? 20.347 28.014 44.514 1.00 55.89 ? 131 GLU D OE2 1 +ATOM 18088 N N . GLU D 1 132 ? 19.195 27.876 39.302 1.00 39.22 ? 132 GLU D N 1 +ATOM 18089 C CA . GLU D 1 132 ? 19.267 29.151 38.604 1.00 39.19 ? 132 GLU D CA 1 +ATOM 18090 C C . GLU D 1 132 ? 19.581 28.826 37.146 1.00 38.01 ? 132 GLU D C 1 +ATOM 18091 O O . GLU D 1 132 ? 20.661 28.320 36.826 1.00 36.80 ? 132 GLU D O 1 +ATOM 18092 C CB . GLU D 1 132 ? 20.358 30.053 39.202 1.00 41.40 ? 132 GLU D CB 1 +ATOM 18093 C CG . GLU D 1 132 ? 20.061 30.593 40.606 1.00 44.68 ? 132 GLU D CG 1 +ATOM 18094 C CD . GLU D 1 132 ? 18.716 31.332 40.713 1.00 48.64 ? 132 GLU D CD 1 +ATOM 18095 O OE1 . GLU D 1 132 ? 18.356 32.106 39.793 1.00 48.87 ? 132 GLU D OE1 1 +ATOM 18096 O OE2 . GLU D 1 132 ? 18.023 31.147 41.737 1.00 50.45 ? 132 GLU D OE2 1 +ATOM 18097 N N . TYR D 1 133 ? 18.620 29.109 36.272 1.00 35.60 ? 133 TYR D N 1 +ATOM 18098 C CA . TYR D 1 133 ? 18.746 28.841 34.841 1.00 36.43 ? 133 TYR D CA 1 +ATOM 18099 C C . TYR D 1 133 ? 20.088 29.263 34.211 1.00 35.64 ? 133 TYR D C 1 +ATOM 18100 O O . TYR D 1 133 ? 20.581 28.625 33.286 1.00 32.86 ? 133 TYR D O 1 +ATOM 18101 C CB . TYR D 1 133 ? 17.590 29.541 34.105 1.00 35.92 ? 133 TYR D CB 1 +ATOM 18102 C CG . TYR D 1 133 ? 17.413 29.134 32.661 1.00 36.58 ? 133 TYR D CG 1 +ATOM 18103 C CD1 . TYR D 1 133 ? 16.746 27.952 32.320 1.00 36.24 ? 133 TYR D CD1 1 +ATOM 18104 C CD2 . TYR D 1 133 ? 17.903 29.931 31.631 1.00 37.08 ? 133 TYR D CD2 1 +ATOM 18105 C CE1 . TYR D 1 133 ? 16.571 27.577 30.991 1.00 35.19 ? 133 TYR D CE1 1 +ATOM 18106 C CE2 . TYR D 1 133 ? 17.730 29.562 30.296 1.00 38.89 ? 133 TYR D CE2 1 +ATOM 18107 C CZ . TYR D 1 133 ? 17.063 28.387 29.990 1.00 37.33 ? 133 TYR D CZ 1 +ATOM 18108 O OH . TYR D 1 133 ? 16.894 28.035 28.676 1.00 42.48 ? 133 TYR D OH 1 +ATOM 18109 N N . ASP D 1 134 ? 20.674 30.338 34.721 1.00 36.35 ? 134 ASP D N 1 +ATOM 18110 C CA . ASP D 1 134 ? 21.918 30.865 34.170 1.00 38.19 ? 134 ASP D CA 1 +ATOM 18111 C C . ASP D 1 134 ? 23.139 30.616 35.046 1.00 37.07 ? 134 ASP D C 1 +ATOM 18112 O O . ASP D 1 134 ? 24.114 31.357 34.982 1.00 34.94 ? 134 ASP D O 1 +ATOM 18113 C CB . ASP D 1 134 ? 21.759 32.367 33.938 1.00 41.06 ? 134 ASP D CB 1 +ATOM 18114 C CG . ASP D 1 134 ? 21.585 33.138 35.239 1.00 44.95 ? 134 ASP D CG 1 +ATOM 18115 O OD1 . ASP D 1 134 ? 20.964 32.588 36.178 1.00 47.84 ? 134 ASP D OD1 1 +ATOM 18116 O OD2 . ASP D 1 134 ? 22.056 34.296 35.323 1.00 46.80 ? 134 ASP D OD2 1 +ATOM 18117 N N . LYS D 1 135 ? 23.087 29.569 35.857 1.00 37.06 ? 135 LYS D N 1 +ATOM 18118 C CA . LYS D 1 135 ? 24.194 29.251 36.738 1.00 37.30 ? 135 LYS D CA 1 +ATOM 18119 C C . LYS D 1 135 ? 24.426 27.775 36.959 1.00 36.25 ? 135 LYS D C 1 +ATOM 18120 O O . LYS D 1 135 ? 23.517 26.964 36.850 1.00 35.55 ? 135 LYS D O 1 +ATOM 18121 C CB . LYS D 1 135 ? 23.986 29.892 38.112 1.00 39.09 ? 135 LYS D CB 1 +ATOM 18122 C CG . LYS D 1 135 ? 24.323 31.360 38.182 1.00 43.92 ? 135 LYS D CG 1 +ATOM 18123 C CD . LYS D 1 135 ? 23.923 31.945 39.523 1.00 47.64 ? 135 LYS D CD 1 +ATOM 18124 C CE . LYS D 1 135 ? 24.478 33.355 39.673 1.00 50.62 ? 135 LYS D CE 1 +ATOM 18125 N NZ . LYS D 1 135 ? 24.326 34.135 38.404 1.00 52.94 ? 135 LYS D NZ 1 +ATOM 18126 N N . VAL D 1 136 ? 25.673 27.450 37.275 1.00 35.85 ? 136 VAL D N 1 +ATOM 18127 C CA . VAL D 1 136 ? 26.079 26.095 37.608 1.00 33.79 ? 136 VAL D CA 1 +ATOM 18128 C C . VAL D 1 136 ? 26.482 26.268 39.062 1.00 34.17 ? 136 VAL D C 1 +ATOM 18129 O O . VAL D 1 136 ? 27.431 26.985 39.369 1.00 35.19 ? 136 VAL D O 1 +ATOM 18130 C CB . VAL D 1 136 ? 27.312 25.631 36.815 1.00 33.25 ? 136 VAL D CB 1 +ATOM 18131 C CG1 . VAL D 1 136 ? 27.703 24.239 37.269 1.00 31.63 ? 136 VAL D CG1 1 +ATOM 18132 C CG2 . VAL D 1 136 ? 27.019 25.625 35.329 1.00 32.46 ? 136 VAL D CG2 1 +ATOM 18133 N N . ILE D 1 137 ? 25.743 25.646 39.964 1.00 33.80 ? 137 ILE D N 1 +ATOM 18134 C CA . ILE D 1 137 ? 26.043 25.766 41.382 1.00 33.11 ? 137 ILE D CA 1 +ATOM 18135 C C . ILE D 1 137 ? 26.520 24.420 41.930 1.00 34.06 ? 137 ILE D C 1 +ATOM 18136 O O . ILE D 1 137 ? 25.843 23.400 41.798 1.00 34.18 ? 137 ILE D O 1 +ATOM 18137 C CB . ILE D 1 137 ? 24.795 26.232 42.155 1.00 32.09 ? 137 ILE D CB 1 +ATOM 18138 C CG1 . ILE D 1 137 ? 24.276 27.540 41.548 1.00 31.92 ? 137 ILE D CG1 1 +ATOM 18139 C CG2 . ILE D 1 137 ? 25.130 26.426 43.620 1.00 31.61 ? 137 ILE D CG2 1 +ATOM 18140 C CD1 . ILE D 1 137 ? 22.970 28.023 42.136 1.00 30.88 ? 137 ILE D CD1 1 +ATOM 18141 N N . VAL D 1 138 ? 27.703 24.415 42.529 1.00 34.21 ? 138 VAL D N 1 +ATOM 18142 C CA . VAL D 1 138 ? 28.257 23.194 43.087 1.00 32.67 ? 138 VAL D CA 1 +ATOM 18143 C C . VAL D 1 138 ? 28.295 23.342 44.592 1.00 33.53 ? 138 VAL D C 1 +ATOM 18144 O O . VAL D 1 138 ? 28.844 24.303 45.109 1.00 34.97 ? 138 VAL D O 1 +ATOM 18145 C CB . VAL D 1 138 ? 29.682 22.936 42.556 1.00 33.04 ? 138 VAL D CB 1 +ATOM 18146 C CG1 . VAL D 1 138 ? 30.246 21.671 43.166 1.00 30.03 ? 138 VAL D CG1 1 +ATOM 18147 C CG2 . VAL D 1 138 ? 29.658 22.820 41.032 1.00 29.73 ? 138 VAL D CG2 1 +ATOM 18148 N N . THR D 1 139 ? 27.687 22.393 45.293 1.00 33.68 ? 139 THR D N 1 +ATOM 18149 C CA . THR D 1 139 ? 27.647 22.417 46.744 1.00 33.85 ? 139 THR D CA 1 +ATOM 18150 C C . THR D 1 139 ? 28.429 21.228 47.304 1.00 34.71 ? 139 THR D C 1 +ATOM 18151 O O . THR D 1 139 ? 28.123 20.074 46.995 1.00 34.13 ? 139 THR D O 1 +ATOM 18152 C CB . THR D 1 139 ? 26.185 22.331 47.270 1.00 34.85 ? 139 THR D CB 1 +ATOM 18153 O OG1 . THR D 1 139 ? 25.384 23.337 46.638 1.00 34.16 ? 139 THR D OG1 1 +ATOM 18154 C CG2 . THR D 1 139 ? 26.145 22.544 48.779 1.00 33.76 ? 139 THR D CG2 1 +ATOM 18155 N N . ILE D 1 140 ? 29.448 21.512 48.111 1.00 35.05 ? 140 ILE D N 1 +ATOM 18156 C CA . ILE D 1 140 ? 30.239 20.456 48.728 1.00 35.53 ? 140 ILE D CA 1 +ATOM 18157 C C . ILE D 1 140 ? 29.884 20.464 50.204 1.00 36.06 ? 140 ILE D C 1 +ATOM 18158 O O . ILE D 1 140 ? 30.096 21.459 50.891 1.00 35.92 ? 140 ILE D O 1 +ATOM 18159 C CB . ILE D 1 140 ? 31.761 20.688 48.579 1.00 35.62 ? 140 ILE D CB 1 +ATOM 18160 C CG1 . ILE D 1 140 ? 32.142 20.744 47.105 1.00 35.91 ? 140 ILE D CG1 1 +ATOM 18161 C CG2 . ILE D 1 140 ? 32.532 19.564 49.258 1.00 35.74 ? 140 ILE D CG2 1 +ATOM 18162 C CD1 . ILE D 1 140 ? 31.889 22.097 46.464 1.00 36.59 ? 140 ILE D CD1 1 +ATOM 18163 N N . PRO D 1 141 ? 29.327 19.355 50.710 1.00 36.85 ? 141 PRO D N 1 +ATOM 18164 C CA . PRO D 1 141 ? 28.945 19.275 52.124 1.00 38.07 ? 141 PRO D CA 1 +ATOM 18165 C C . PRO D 1 141 ? 30.121 19.167 53.094 1.00 39.73 ? 141 PRO D C 1 +ATOM 18166 O O . PRO D 1 141 ? 30.188 18.249 53.905 1.00 39.69 ? 141 PRO D O 1 +ATOM 18167 C CB . PRO D 1 141 ? 28.033 18.052 52.160 1.00 36.26 ? 141 PRO D CB 1 +ATOM 18168 C CG . PRO D 1 141 ? 28.647 17.160 51.136 1.00 36.71 ? 141 PRO D CG 1 +ATOM 18169 C CD . PRO D 1 141 ? 28.956 18.121 49.995 1.00 35.04 ? 141 PRO D CD 1 +ATOM 18170 N N . GLU D 1 142 ? 31.052 20.108 52.992 1.00 43.39 ? 142 GLU D N 1 +ATOM 18171 C CA . GLU D 1 142 ? 32.222 20.163 53.873 1.00 46.40 ? 142 GLU D CA 1 +ATOM 18172 C C . GLU D 1 142 ? 32.587 21.636 54.037 1.00 47.04 ? 142 GLU D C 1 +ATOM 18173 O O . GLU D 1 142 ? 32.262 22.454 53.173 1.00 46.44 ? 142 GLU D O 1 +ATOM 18174 C CB . GLU D 1 142 ? 33.407 19.406 53.263 1.00 48.14 ? 142 GLU D CB 1 +ATOM 18175 C CG . GLU D 1 142 ? 33.087 17.982 52.855 1.00 53.57 ? 142 GLU D CG 1 +ATOM 18176 C CD . GLU D 1 142 ? 34.332 17.134 52.632 1.00 57.38 ? 142 GLU D CD 1 +ATOM 18177 O OE1 . GLU D 1 142 ? 34.993 16.757 53.628 1.00 58.85 ? 142 GLU D OE1 1 +ATOM 18178 O OE2 . GLU D 1 142 ? 34.654 16.841 51.459 1.00 59.98 ? 142 GLU D OE2 1 +ATOM 18179 N N . ASP D 1 143 ? 33.252 21.984 55.136 1.00 48.67 ? 143 ASP D N 1 +ATOM 18180 C CA . ASP D 1 143 ? 33.634 23.378 55.370 1.00 49.80 ? 143 ASP D CA 1 +ATOM 18181 C C . ASP D 1 143 ? 34.849 23.808 54.547 1.00 48.37 ? 143 ASP D C 1 +ATOM 18182 O O . ASP D 1 143 ? 35.085 24.997 54.358 1.00 48.25 ? 143 ASP D O 1 +ATOM 18183 C CB . ASP D 1 143 ? 33.907 23.623 56.861 1.00 54.58 ? 143 ASP D CB 1 +ATOM 18184 C CG . ASP D 1 143 ? 34.995 22.715 57.421 1.00 58.77 ? 143 ASP D CG 1 +ATOM 18185 O OD1 . ASP D 1 143 ? 36.090 22.649 56.819 1.00 61.00 ? 143 ASP D OD1 1 +ATOM 18186 O OD2 . ASP D 1 143 ? 34.758 22.069 58.469 1.00 62.12 ? 143 ASP D OD2 1 +ATOM 18187 N N . SER D 1 144 ? 35.609 22.835 54.057 1.00 46.81 ? 144 SER D N 1 +ATOM 18188 C CA . SER D 1 144 ? 36.795 23.104 53.249 1.00 46.74 ? 144 SER D CA 1 +ATOM 18189 C C . SER D 1 144 ? 36.781 22.216 52.020 1.00 45.53 ? 144 SER D C 1 +ATOM 18190 O O . SER D 1 144 ? 36.127 21.178 52.008 1.00 46.71 ? 144 SER D O 1 +ATOM 18191 C CB . SER D 1 144 ? 38.076 22.813 54.049 1.00 47.81 ? 144 SER D CB 1 +ATOM 18192 O OG . SER D 1 144 ? 38.215 23.694 55.151 1.00 49.52 ? 144 SER D OG 1 +ATOM 18193 N N . VAL D 1 145 ? 37.510 22.612 50.987 1.00 43.57 ? 145 VAL D N 1 +ATOM 18194 C CA . VAL D 1 145 ? 37.555 21.806 49.787 1.00 42.10 ? 145 VAL D CA 1 +ATOM 18195 C C . VAL D 1 145 ? 38.609 22.311 48.827 1.00 41.80 ? 145 VAL D C 1 +ATOM 18196 O O . VAL D 1 145 ? 38.950 23.492 48.830 1.00 40.99 ? 145 VAL D O 1 +ATOM 18197 C CB . VAL D 1 145 ? 36.177 21.811 49.057 1.00 42.20 ? 145 VAL D CB 1 +ATOM 18198 C CG1 . VAL D 1 145 ? 35.881 23.202 48.509 1.00 41.10 ? 145 VAL D CG1 1 +ATOM 18199 C CG2 . VAL D 1 145 ? 36.168 20.778 47.933 1.00 40.14 ? 145 VAL D CG2 1 +ATOM 18200 N N . GLU D 1 146 ? 39.136 21.400 48.017 1.00 41.50 ? 146 GLU D N 1 +ATOM 18201 C CA . GLU D 1 146 ? 40.107 21.772 47.003 1.00 42.50 ? 146 GLU D CA 1 +ATOM 18202 C C . GLU D 1 146 ? 39.563 21.329 45.648 1.00 41.19 ? 146 GLU D C 1 +ATOM 18203 O O . GLU D 1 146 ? 39.150 20.179 45.488 1.00 40.71 ? 146 GLU D O 1 +ATOM 18204 C CB . GLU D 1 146 ? 41.469 21.109 47.254 1.00 42.71 ? 146 GLU D CB 1 +ATOM 18205 C CG . GLU D 1 146 ? 41.467 19.595 47.235 1.00 47.32 ? 146 GLU D CG 1 +ATOM 18206 C CD . GLU D 1 146 ? 42.880 19.007 47.203 1.00 51.14 ? 146 GLU D CD 1 +ATOM 18207 O OE1 . GLU D 1 146 ? 43.727 19.437 48.020 1.00 54.07 ? 146 GLU D OE1 1 +ATOM 18208 O OE2 . GLU D 1 146 ? 43.149 18.109 46.369 1.00 51.38 ? 146 GLU D OE2 1 +ATOM 18209 N N . PHE D 1 147 ? 39.510 22.250 44.692 1.00 39.66 ? 147 PHE D N 1 +ATOM 18210 C CA . PHE D 1 147 ? 39.062 21.890 43.355 1.00 39.66 ? 147 PHE D CA 1 +ATOM 18211 C C . PHE D 1 147 ? 40.046 22.455 42.355 1.00 39.12 ? 147 PHE D C 1 +ATOM 18212 O O . PHE D 1 147 ? 40.885 23.277 42.706 1.00 40.49 ? 147 PHE D O 1 +ATOM 18213 C CB . PHE D 1 147 ? 37.624 22.368 43.062 1.00 39.55 ? 147 PHE D CB 1 +ATOM 18214 C CG . PHE D 1 147 ? 37.428 23.852 43.114 1.00 37.10 ? 147 PHE D CG 1 +ATOM 18215 C CD1 . PHE D 1 147 ? 37.276 24.505 44.322 1.00 36.64 ? 147 PHE D CD1 1 +ATOM 18216 C CD2 . PHE D 1 147 ? 37.328 24.587 41.940 1.00 37.23 ? 147 PHE D CD2 1 +ATOM 18217 C CE1 . PHE D 1 147 ? 37.019 25.876 44.369 1.00 37.34 ? 147 PHE D CE1 1 +ATOM 18218 C CE2 . PHE D 1 147 ? 37.074 25.954 41.973 1.00 36.73 ? 147 PHE D CE2 1 +ATOM 18219 C CZ . PHE D 1 147 ? 36.917 26.600 43.191 1.00 36.29 ? 147 PHE D CZ 1 +ATOM 18220 N N . TYR D 1 148 ? 39.963 22.001 41.113 1.00 38.26 ? 148 TYR D N 1 +ATOM 18221 C CA . TYR D 1 148 ? 40.893 22.456 40.096 1.00 36.78 ? 148 TYR D CA 1 +ATOM 18222 C C . TYR D 1 148 ? 40.199 22.997 38.861 1.00 37.31 ? 148 TYR D C 1 +ATOM 18223 O O . TYR D 1 148 ? 39.169 22.480 38.434 1.00 38.05 ? 148 TYR D O 1 +ATOM 18224 C CB . TYR D 1 148 ? 41.808 21.298 39.667 1.00 36.76 ? 148 TYR D CB 1 +ATOM 18225 C CG . TYR D 1 148 ? 42.501 20.578 40.802 1.00 36.94 ? 148 TYR D CG 1 +ATOM 18226 C CD1 . TYR D 1 148 ? 41.781 19.800 41.709 1.00 36.14 ? 148 TYR D CD1 1 +ATOM 18227 C CD2 . TYR D 1 148 ? 43.884 20.682 40.976 1.00 37.97 ? 148 TYR D CD2 1 +ATOM 18228 C CE1 . TYR D 1 148 ? 42.417 19.144 42.760 1.00 37.14 ? 148 TYR D CE1 1 +ATOM 18229 C CE2 . TYR D 1 148 ? 44.533 20.028 42.029 1.00 36.78 ? 148 TYR D CE2 1 +ATOM 18230 C CZ . TYR D 1 148 ? 43.793 19.265 42.913 1.00 37.80 ? 148 TYR D CZ 1 +ATOM 18231 O OH . TYR D 1 148 ? 44.420 18.628 43.955 1.00 39.34 ? 148 TYR D OH 1 +ATOM 18232 N N . VAL D 1 149 ? 40.768 24.045 38.285 1.00 36.78 ? 149 VAL D N 1 +ATOM 18233 C CA . VAL D 1 149 ? 40.229 24.602 37.062 1.00 36.13 ? 149 VAL D CA 1 +ATOM 18234 C C . VAL D 1 149 ? 41.272 24.175 36.045 1.00 37.52 ? 149 VAL D C 1 +ATOM 18235 O O . VAL D 1 149 ? 42.440 24.524 36.160 1.00 38.65 ? 149 VAL D O 1 +ATOM 18236 C CB . VAL D 1 149 ? 40.126 26.125 37.134 1.00 35.79 ? 149 VAL D CB 1 +ATOM 18237 C CG1 . VAL D 1 149 ? 39.503 26.657 35.857 1.00 33.65 ? 149 VAL D CG1 1 +ATOM 18238 C CG2 . VAL D 1 149 ? 39.293 26.523 38.341 1.00 33.34 ? 149 VAL D CG2 1 +ATOM 18239 N N . ILE D 1 150 ? 40.851 23.388 35.067 1.00 38.92 ? 150 ILE D N 1 +ATOM 18240 C CA . ILE D 1 150 ? 41.758 22.853 34.062 1.00 39.44 ? 150 ILE D CA 1 +ATOM 18241 C C . ILE D 1 150 ? 41.535 23.475 32.687 1.00 40.49 ? 150 ILE D C 1 +ATOM 18242 O O . ILE D 1 150 ? 40.521 23.218 32.039 1.00 40.82 ? 150 ILE D O 1 +ATOM 18243 C CB . ILE D 1 150 ? 41.571 21.322 33.974 1.00 38.35 ? 150 ILE D CB 1 +ATOM 18244 C CG1 . ILE D 1 150 ? 41.592 20.732 35.387 1.00 38.54 ? 150 ILE D CG1 1 +ATOM 18245 C CG2 . ILE D 1 150 ? 42.659 20.706 33.117 1.00 38.88 ? 150 ILE D CG2 1 +ATOM 18246 C CD1 . ILE D 1 150 ? 41.229 19.255 35.465 1.00 36.31 ? 150 ILE D CD1 1 +ATOM 18247 N N . GLU D 1 151 ? 42.490 24.283 32.243 1.00 42.07 ? 151 GLU D N 1 +ATOM 18248 C CA . GLU D 1 151 ? 42.395 24.944 30.951 1.00 43.53 ? 151 GLU D CA 1 +ATOM 18249 C C . GLU D 1 151 ? 42.483 23.945 29.810 1.00 43.85 ? 151 GLU D C 1 +ATOM 18250 O O . GLU D 1 151 ? 43.084 22.874 29.952 1.00 43.42 ? 151 GLU D O 1 +ATOM 18251 C CB . GLU D 1 151 ? 43.500 25.985 30.799 1.00 47.39 ? 151 GLU D CB 1 +ATOM 18252 C CG . GLU D 1 151 ? 43.442 27.118 31.809 1.00 55.03 ? 151 GLU D CG 1 +ATOM 18253 C CD . GLU D 1 151 ? 42.082 27.815 31.847 1.00 60.92 ? 151 GLU D CD 1 +ATOM 18254 O OE1 . GLU D 1 151 ? 41.596 28.255 30.780 1.00 64.35 ? 151 GLU D OE1 1 +ATOM 18255 O OE2 . GLU D 1 151 ? 41.495 27.936 32.947 1.00 62.80 ? 151 GLU D OE2 1 +ATOM 18256 N N . GLY D 1 152 ? 41.866 24.301 28.684 1.00 42.54 ? 152 GLY D N 1 +ATOM 18257 C CA . GLY D 1 152 ? 41.877 23.437 27.522 1.00 42.62 ? 152 GLY D CA 1 +ATOM 18258 C C . GLY D 1 152 ? 42.934 23.869 26.523 1.00 42.25 ? 152 GLY D C 1 +ATOM 18259 O O . GLY D 1 152 ? 44.120 23.676 26.769 1.00 43.70 ? 152 GLY D O 1 +ATOM 18260 N N . PRO D 1 153 ? 42.542 24.478 25.394 1.00 41.40 ? 153 PRO D N 1 +ATOM 18261 C CA . PRO D 1 153 ? 41.154 24.776 25.028 1.00 40.75 ? 153 PRO D CA 1 +ATOM 18262 C C . PRO D 1 153 ? 40.380 23.584 24.445 1.00 39.88 ? 153 PRO D C 1 +ATOM 18263 O O . PRO D 1 153 ? 39.157 23.626 24.342 1.00 40.58 ? 153 PRO D O 1 +ATOM 18264 C CB . PRO D 1 153 ? 41.310 25.917 24.030 1.00 40.26 ? 153 PRO D CB 1 +ATOM 18265 C CG . PRO D 1 153 ? 42.558 25.522 23.299 1.00 40.40 ? 153 PRO D CG 1 +ATOM 18266 C CD . PRO D 1 153 ? 43.479 25.070 24.422 1.00 40.85 ? 153 PRO D CD 1 +ATOM 18267 N N . ARG D 1 154 ? 41.086 22.526 24.063 1.00 38.92 ? 154 ARG D N 1 +ATOM 18268 C CA . ARG D 1 154 ? 40.423 21.356 23.502 1.00 38.54 ? 154 ARG D CA 1 +ATOM 18269 C C . ARG D 1 154 ? 39.980 20.429 24.622 1.00 38.28 ? 154 ARG D C 1 +ATOM 18270 O O . ARG D 1 154 ? 40.599 20.395 25.685 1.00 38.70 ? 154 ARG D O 1 +ATOM 18271 C CB . ARG D 1 154 ? 41.358 20.613 22.563 1.00 38.45 ? 154 ARG D CB 1 +ATOM 18272 C CG . ARG D 1 154 ? 41.836 21.445 21.387 1.00 42.45 ? 154 ARG D CG 1 +ATOM 18273 C CD . ARG D 1 154 ? 42.633 20.589 20.403 1.00 45.16 ? 154 ARG D CD 1 +ATOM 18274 N NE . ARG D 1 154 ? 43.739 19.896 21.063 1.00 48.98 ? 154 ARG D NE 1 +ATOM 18275 C CZ . ARG D 1 154 ? 44.025 18.608 20.881 1.00 51.42 ? 154 ARG D CZ 1 +ATOM 18276 N NH1 . ARG D 1 154 ? 43.287 17.870 20.054 1.00 52.51 ? 154 ARG D NH1 1 +ATOM 18277 N NH2 . ARG D 1 154 ? 45.037 18.052 21.537 1.00 51.97 ? 154 ARG D NH2 1 +ATOM 18278 N N . ILE D 1 155 ? 38.898 19.688 24.399 1.00 36.95 ? 155 ILE D N 1 +ATOM 18279 C CA . ILE D 1 155 ? 38.417 18.783 25.430 1.00 36.47 ? 155 ILE D CA 1 +ATOM 18280 C C . ILE D 1 155 ? 39.530 17.797 25.738 1.00 35.44 ? 155 ILE D C 1 +ATOM 18281 O O . ILE D 1 155 ? 39.748 17.435 26.894 1.00 34.55 ? 155 ILE D O 1 +ATOM 18282 C CB . ILE D 1 155 ? 37.136 18.031 24.983 1.00 35.80 ? 155 ILE D CB 1 +ATOM 18283 C CG1 . ILE D 1 155 ? 35.975 19.022 24.856 1.00 34.25 ? 155 ILE D CG1 1 +ATOM 18284 C CG2 . ILE D 1 155 ? 36.780 16.946 25.995 1.00 32.07 ? 155 ILE D CG2 1 +ATOM 18285 C CD1 . ILE D 1 155 ? 34.716 18.426 24.229 1.00 33.65 ? 155 ILE D CD1 1 +ATOM 18286 N N . GLU D 1 156 ? 40.247 17.389 24.695 1.00 36.66 ? 156 GLU D N 1 +ATOM 18287 C CA . GLU D 1 156 ? 41.362 16.467 24.850 1.00 37.92 ? 156 GLU D CA 1 +ATOM 18288 C C . GLU D 1 156 ? 42.451 17.084 25.735 1.00 36.97 ? 156 GLU D C 1 +ATOM 18289 O O . GLU D 1 156 ? 43.121 16.381 26.493 1.00 36.32 ? 156 GLU D O 1 +ATOM 18290 C CB . GLU D 1 156 ? 41.955 16.089 23.489 1.00 38.12 ? 156 GLU D CB 1 +ATOM 18291 C CG . GLU D 1 156 ? 43.013 14.999 23.604 1.00 42.49 ? 156 GLU D CG 1 +ATOM 18292 C CD . GLU D 1 156 ? 43.395 14.391 22.275 1.00 44.09 ? 156 GLU D CD 1 +ATOM 18293 O OE1 . GLU D 1 156 ? 44.102 15.065 21.484 1.00 45.43 ? 156 GLU D OE1 1 +ATOM 18294 O OE2 . GLU D 1 156 ? 42.983 13.236 22.024 1.00 44.65 ? 156 GLU D OE2 1 +ATOM 18295 N N . ASP D 1 157 ? 42.620 18.398 25.640 1.00 36.25 ? 157 ASP D N 1 +ATOM 18296 C CA . ASP D 1 157 ? 43.617 19.080 26.459 1.00 39.08 ? 157 ASP D CA 1 +ATOM 18297 C C . ASP D 1 157 ? 43.257 19.016 27.940 1.00 38.54 ? 157 ASP D C 1 +ATOM 18298 O O . ASP D 1 157 ? 44.129 18.853 28.791 1.00 38.88 ? 157 ASP D O 1 +ATOM 18299 C CB . ASP D 1 157 ? 43.758 20.544 26.038 1.00 42.33 ? 157 ASP D CB 1 +ATOM 18300 C CG . ASP D 1 157 ? 44.305 20.699 24.625 1.00 46.52 ? 157 ASP D CG 1 +ATOM 18301 O OD1 . ASP D 1 157 ? 45.194 19.897 24.246 1.00 48.88 ? 157 ASP D OD1 1 +ATOM 18302 O OD2 . ASP D 1 157 ? 43.859 21.626 23.905 1.00 47.10 ? 157 ASP D OD2 1 +ATOM 18303 N N . VAL D 1 158 ? 41.969 19.148 28.242 1.00 37.94 ? 158 VAL D N 1 +ATOM 18304 C CA . VAL D 1 158 ? 41.489 19.086 29.611 1.00 36.21 ? 158 VAL D CA 1 +ATOM 18305 C C . VAL D 1 158 ? 41.698 17.692 30.185 1.00 36.79 ? 158 VAL D C 1 +ATOM 18306 O O . VAL D 1 158 ? 42.163 17.548 31.311 1.00 36.60 ? 158 VAL D O 1 +ATOM 18307 C CB . VAL D 1 158 ? 39.987 19.427 29.685 1.00 37.52 ? 158 VAL D CB 1 +ATOM 18308 C CG1 . VAL D 1 158 ? 39.461 19.239 31.114 1.00 36.80 ? 158 VAL D CG1 1 +ATOM 18309 C CG2 . VAL D 1 158 ? 39.765 20.847 29.226 1.00 36.56 ? 158 VAL D CG2 1 +ATOM 18310 N N . LEU D 1 159 ? 41.354 16.665 29.412 1.00 37.31 ? 159 LEU D N 1 +ATOM 18311 C CA . LEU D 1 159 ? 41.501 15.290 29.878 1.00 38.40 ? 159 LEU D CA 1 +ATOM 18312 C C . LEU D 1 159 ? 42.950 14.866 30.091 1.00 38.41 ? 159 LEU D C 1 +ATOM 18313 O O . LEU D 1 159 ? 43.235 14.067 30.994 1.00 37.66 ? 159 LEU D O 1 +ATOM 18314 C CB . LEU D 1 159 ? 40.793 14.319 28.917 1.00 39.23 ? 159 LEU D CB 1 +ATOM 18315 C CG . LEU D 1 159 ? 39.264 14.429 28.965 1.00 39.34 ? 159 LEU D CG 1 +ATOM 18316 C CD1 . LEU D 1 159 ? 38.636 13.426 28.030 1.00 40.58 ? 159 LEU D CD1 1 +ATOM 18317 C CD2 . LEU D 1 159 ? 38.780 14.188 30.385 1.00 39.51 ? 159 LEU D CD2 1 +ATOM 18318 N N . GLU D 1 160 ? 43.862 15.386 29.269 1.00 38.08 ? 160 GLU D N 1 +ATOM 18319 C CA . GLU D 1 160 ? 45.277 15.051 29.433 1.00 39.35 ? 160 GLU D CA 1 +ATOM 18320 C C . GLU D 1 160 ? 45.746 15.603 30.776 1.00 37.62 ? 160 GLU D C 1 +ATOM 18321 O O . GLU D 1 160 ? 46.365 14.899 31.573 1.00 37.33 ? 160 GLU D O 1 +ATOM 18322 C CB . GLU D 1 160 ? 46.129 15.646 28.312 1.00 39.46 ? 160 GLU D CB 1 +ATOM 18323 C CG . GLU D 1 160 ? 45.873 15.058 26.945 1.00 44.87 ? 160 GLU D CG 1 +ATOM 18324 C CD . GLU D 1 160 ? 46.818 15.608 25.890 1.00 50.04 ? 160 GLU D CD 1 +ATOM 18325 O OE1 . GLU D 1 160 ? 47.139 16.821 25.942 1.00 53.44 ? 160 GLU D OE1 1 +ATOM 18326 O OE2 . GLU D 1 160 ? 47.234 14.835 24.997 1.00 52.86 ? 160 GLU D OE2 1 +ATOM 18327 N N . LYS D 1 161 ? 45.440 16.867 31.026 1.00 36.62 ? 161 LYS D N 1 +ATOM 18328 C CA . LYS D 1 161 ? 45.837 17.487 32.278 1.00 37.64 ? 161 LYS D CA 1 +ATOM 18329 C C . LYS D 1 161 ? 45.166 16.783 33.461 1.00 38.58 ? 161 LYS D C 1 +ATOM 18330 O O . LYS D 1 161 ? 45.804 16.511 34.484 1.00 39.84 ? 161 LYS D O 1 +ATOM 18331 C CB . LYS D 1 161 ? 45.472 18.975 32.278 1.00 36.88 ? 161 LYS D CB 1 +ATOM 18332 C CG . LYS D 1 161 ? 46.183 19.809 31.217 1.00 35.20 ? 161 LYS D CG 1 +ATOM 18333 C CD . LYS D 1 161 ? 45.926 21.283 31.460 1.00 36.11 ? 161 LYS D CD 1 +ATOM 18334 C CE . LYS D 1 161 ? 46.527 22.158 30.372 1.00 38.16 ? 161 LYS D CE 1 +ATOM 18335 N NZ . LYS D 1 161 ? 45.882 21.967 29.046 1.00 38.14 ? 161 LYS D NZ 1 +ATOM 18336 N N . TYR D 1 162 ? 43.877 16.484 33.318 1.00 37.85 ? 162 TYR D N 1 +ATOM 18337 C CA . TYR D 1 162 ? 43.131 15.810 34.372 1.00 36.13 ? 162 TYR D CA 1 +ATOM 18338 C C . TYR D 1 162 ? 43.763 14.454 34.662 1.00 36.41 ? 162 TYR D C 1 +ATOM 18339 O O . TYR D 1 162 ? 43.961 14.080 35.811 1.00 37.31 ? 162 TYR D O 1 +ATOM 18340 C CB . TYR D 1 162 ? 41.673 15.618 33.950 1.00 34.73 ? 162 TYR D CB 1 +ATOM 18341 C CG . TYR D 1 162 ? 40.902 14.720 34.879 1.00 32.62 ? 162 TYR D CG 1 +ATOM 18342 C CD1 . TYR D 1 162 ? 40.458 15.181 36.115 1.00 32.99 ? 162 TYR D CD1 1 +ATOM 18343 C CD2 . TYR D 1 162 ? 40.675 13.385 34.552 1.00 33.14 ? 162 TYR D CD2 1 +ATOM 18344 C CE1 . TYR D 1 162 ? 39.812 14.337 37.007 1.00 34.40 ? 162 TYR D CE1 1 +ATOM 18345 C CE2 . TYR D 1 162 ? 40.031 12.530 35.435 1.00 34.37 ? 162 TYR D CE2 1 +ATOM 18346 C CZ . TYR D 1 162 ? 39.606 13.013 36.659 1.00 34.84 ? 162 TYR D CZ 1 +ATOM 18347 O OH . TYR D 1 162 ? 38.995 12.163 37.542 1.00 36.93 ? 162 TYR D OH 1 +ATOM 18348 N N . THR D 1 163 ? 44.076 13.715 33.608 1.00 38.56 ? 163 THR D N 1 +ATOM 18349 C CA . THR D 1 163 ? 44.699 12.404 33.751 1.00 40.74 ? 163 THR D CA 1 +ATOM 18350 C C . THR D 1 163 ? 46.092 12.532 34.364 1.00 42.04 ? 163 THR D C 1 +ATOM 18351 O O . THR D 1 163 ? 46.522 11.681 35.145 1.00 41.87 ? 163 THR D O 1 +ATOM 18352 C CB . THR D 1 163 ? 44.805 11.706 32.391 1.00 41.03 ? 163 THR D CB 1 +ATOM 18353 O OG1 . THR D 1 163 ? 43.487 11.519 31.862 1.00 43.03 ? 163 THR D OG1 1 +ATOM 18354 C CG2 . THR D 1 163 ? 45.474 10.347 32.532 1.00 42.63 ? 163 THR D CG2 1 +ATOM 18355 N N . GLU D 1 164 ? 46.796 13.599 34.003 1.00 43.32 ? 164 GLU D N 1 +ATOM 18356 C CA . GLU D 1 164 ? 48.122 13.847 34.540 1.00 45.72 ? 164 GLU D CA 1 +ATOM 18357 C C . GLU D 1 164 ? 47.972 14.027 36.057 1.00 45.08 ? 164 GLU D C 1 +ATOM 18358 O O . GLU D 1 164 ? 48.763 13.503 36.850 1.00 45.14 ? 164 GLU D O 1 +ATOM 18359 C CB . GLU D 1 164 ? 48.702 15.121 33.919 1.00 50.01 ? 164 GLU D CB 1 +ATOM 18360 C CG . GLU D 1 164 ? 50.060 15.528 34.467 1.00 56.52 ? 164 GLU D CG 1 +ATOM 18361 C CD . GLU D 1 164 ? 51.208 14.801 33.786 1.00 61.32 ? 164 GLU D CD 1 +ATOM 18362 O OE1 . GLU D 1 164 ? 51.064 13.589 33.501 1.00 64.95 ? 164 GLU D OE1 1 +ATOM 18363 O OE2 . GLU D 1 164 ? 52.257 15.439 33.544 1.00 62.65 ? 164 GLU D OE2 1 +ATOM 18364 N N . LEU D 1 165 ? 46.927 14.749 36.448 1.00 42.84 ? 165 LEU D N 1 +ATOM 18365 C CA . LEU D 1 165 ? 46.648 15.024 37.850 1.00 40.25 ? 165 LEU D CA 1 +ATOM 18366 C C . LEU D 1 165 ? 46.200 13.819 38.678 1.00 39.92 ? 165 LEU D C 1 +ATOM 18367 O O . LEU D 1 165 ? 46.784 13.532 39.722 1.00 41.44 ? 165 LEU D O 1 +ATOM 18368 C CB . LEU D 1 165 ? 45.572 16.099 37.949 1.00 40.74 ? 165 LEU D CB 1 +ATOM 18369 C CG . LEU D 1 165 ? 45.556 17.083 39.126 1.00 41.69 ? 165 LEU D CG 1 +ATOM 18370 C CD1 . LEU D 1 165 ? 44.107 17.431 39.449 1.00 40.39 ? 165 LEU D CD1 1 +ATOM 18371 C CD2 . LEU D 1 165 ? 46.232 16.488 40.341 1.00 42.21 ? 165 LEU D CD2 1 +ATOM 18372 N N . THR D 1 166 ? 45.168 13.115 38.224 1.00 38.08 ? 166 THR D N 1 +ATOM 18373 C CA . THR D 1 166 ? 44.635 11.982 38.982 1.00 36.63 ? 166 THR D CA 1 +ATOM 18374 C C . THR D 1 166 ? 45.246 10.613 38.713 1.00 37.14 ? 166 THR D C 1 +ATOM 18375 O O . THR D 1 166 ? 45.086 9.705 39.523 1.00 36.58 ? 166 THR D O 1 +ATOM 18376 C CB . THR D 1 166 ? 43.087 11.876 38.817 1.00 36.85 ? 166 THR D CB 1 +ATOM 18377 O OG1 . THR D 1 166 ? 42.747 11.649 37.440 1.00 34.57 ? 166 THR D OG1 1 +ATOM 18378 C CG2 . THR D 1 166 ? 42.428 13.166 39.276 1.00 35.88 ? 166 THR D CG2 1 +ATOM 18379 N N . GLY D 1 167 ? 45.942 10.461 37.588 1.00 38.23 ? 167 GLY D N 1 +ATOM 18380 C CA . GLY D 1 167 ? 46.558 9.183 37.277 1.00 38.19 ? 167 GLY D CA 1 +ATOM 18381 C C . GLY D 1 167 ? 46.255 8.650 35.889 1.00 39.93 ? 167 GLY D C 1 +ATOM 18382 O O . GLY D 1 167 ? 45.117 8.689 35.433 1.00 40.38 ? 167 GLY D O 1 +ATOM 18383 N N . LYS D 1 168 ? 47.285 8.165 35.205 1.00 41.06 ? 168 LYS D N 1 +ATOM 18384 C CA . LYS D 1 168 ? 47.116 7.608 33.872 1.00 41.85 ? 168 LYS D CA 1 +ATOM 18385 C C . LYS D 1 168 ? 46.504 6.219 34.013 1.00 41.22 ? 168 LYS D C 1 +ATOM 18386 O O . LYS D 1 168 ? 46.741 5.520 34.993 1.00 42.00 ? 168 LYS D O 1 +ATOM 18387 C CB . LYS D 1 168 ? 48.473 7.481 33.161 1.00 43.66 ? 168 LYS D CB 1 +ATOM 18388 C CG . LYS D 1 168 ? 49.236 8.787 32.947 1.00 47.68 ? 168 LYS D CG 1 +ATOM 18389 C CD . LYS D 1 168 ? 48.565 9.681 31.913 1.00 50.95 ? 168 LYS D CD 1 +ATOM 18390 C CE . LYS D 1 168 ? 49.361 10.967 31.679 1.00 54.02 ? 168 LYS D CE 1 +ATOM 18391 N NZ . LYS D 1 168 ? 48.642 11.945 30.787 1.00 55.46 ? 168 LYS D NZ 1 +ATOM 18392 N N . PRO D 1 169 ? 45.689 5.807 33.041 1.00 40.68 ? 169 PRO D N 1 +ATOM 18393 C CA . PRO D 1 169 ? 45.077 4.478 33.109 1.00 40.85 ? 169 PRO D CA 1 +ATOM 18394 C C . PRO D 1 169 ? 46.178 3.421 32.996 1.00 41.09 ? 169 PRO D C 1 +ATOM 18395 O O . PRO D 1 169 ? 47.139 3.611 32.251 1.00 41.24 ? 169 PRO D O 1 +ATOM 18396 C CB . PRO D 1 169 ? 44.165 4.458 31.887 1.00 40.14 ? 169 PRO D CB 1 +ATOM 18397 C CG . PRO D 1 169 ? 43.798 5.897 31.714 1.00 40.49 ? 169 PRO D CG 1 +ATOM 18398 C CD . PRO D 1 169 ? 45.095 6.613 31.962 1.00 40.57 ? 169 PRO D CD 1 +ATOM 18399 N N . PHE D 1 170 ? 46.054 2.320 33.733 1.00 41.64 ? 170 PHE D N 1 +ATOM 18400 C CA . PHE D 1 170 ? 47.052 1.255 33.641 1.00 42.04 ? 170 PHE D CA 1 +ATOM 18401 C C . PHE D 1 170 ? 46.886 0.611 32.272 1.00 40.85 ? 170 PHE D C 1 +ATOM 18402 O O . PHE D 1 170 ? 45.826 0.722 31.657 1.00 40.69 ? 170 PHE D O 1 +ATOM 18403 C CB . PHE D 1 170 ? 46.838 0.186 34.724 1.00 42.62 ? 170 PHE D CB 1 +ATOM 18404 C CG . PHE D 1 170 ? 45.628 -0.691 34.495 1.00 45.14 ? 170 PHE D CG 1 +ATOM 18405 C CD1 . PHE D 1 170 ? 44.335 -0.168 34.576 1.00 45.94 ? 170 PHE D CD1 1 +ATOM 18406 C CD2 . PHE D 1 170 ? 45.780 -2.053 34.227 1.00 45.97 ? 170 PHE D CD2 1 +ATOM 18407 C CE1 . PHE D 1 170 ? 43.216 -0.987 34.403 1.00 46.16 ? 170 PHE D CE1 1 +ATOM 18408 C CE2 . PHE D 1 170 ? 44.668 -2.883 34.051 1.00 45.36 ? 170 PHE D CE2 1 +ATOM 18409 C CZ . PHE D 1 170 ? 43.384 -2.350 34.141 1.00 46.19 ? 170 PHE D CZ 1 +ATOM 18410 N N . LEU D 1 171 ? 47.929 -0.051 31.788 1.00 40.48 ? 171 LEU D N 1 +ATOM 18411 C CA . LEU D 1 171 ? 47.841 -0.718 30.496 1.00 40.92 ? 171 LEU D CA 1 +ATOM 18412 C C . LEU D 1 171 ? 47.528 -2.185 30.746 1.00 40.86 ? 171 LEU D C 1 +ATOM 18413 O O . LEU D 1 171 ? 48.357 -2.930 31.271 1.00 41.13 ? 171 LEU D O 1 +ATOM 18414 C CB . LEU D 1 171 ? 49.153 -0.597 29.722 1.00 41.64 ? 171 LEU D CB 1 +ATOM 18415 C CG . LEU D 1 171 ? 49.170 -1.305 28.359 1.00 42.65 ? 171 LEU D CG 1 +ATOM 18416 C CD1 . LEU D 1 171 ? 48.091 -0.720 27.440 1.00 40.66 ? 171 LEU D CD1 1 +ATOM 18417 C CD2 . LEU D 1 171 ? 50.552 -1.160 27.733 1.00 41.28 ? 171 LEU D CD2 1 +ATOM 18418 N N . PRO D 1 172 ? 46.313 -2.617 30.388 1.00 40.30 ? 172 PRO D N 1 +ATOM 18419 C CA . PRO D 1 172 ? 45.949 -4.016 30.605 1.00 39.55 ? 172 PRO D CA 1 +ATOM 18420 C C . PRO D 1 172 ? 46.410 -4.899 29.459 1.00 38.23 ? 172 PRO D C 1 +ATOM 18421 O O . PRO D 1 172 ? 46.840 -4.399 28.418 1.00 38.85 ? 172 PRO D O 1 +ATOM 18422 C CB . PRO D 1 172 ? 44.427 -3.953 30.728 1.00 40.23 ? 172 PRO D CB 1 +ATOM 18423 C CG . PRO D 1 172 ? 44.073 -2.857 29.770 1.00 40.49 ? 172 PRO D CG 1 +ATOM 18424 C CD . PRO D 1 172 ? 45.137 -1.807 30.010 1.00 40.63 ? 172 PRO D CD 1 +ATOM 18425 N N . PRO D 1 173 ? 46.348 -6.225 29.643 1.00 37.10 ? 173 PRO D N 1 +ATOM 18426 C CA . PRO D 1 173 ? 46.765 -7.154 28.589 1.00 37.90 ? 173 PRO D CA 1 +ATOM 18427 C C . PRO D 1 173 ? 45.744 -7.149 27.452 1.00 39.60 ? 173 PRO D C 1 +ATOM 18428 O O . PRO D 1 173 ? 44.570 -6.828 27.660 1.00 39.00 ? 173 PRO D O 1 +ATOM 18429 C CB . PRO D 1 173 ? 46.821 -8.494 29.314 1.00 37.46 ? 173 PRO D CB 1 +ATOM 18430 C CG . PRO D 1 173 ? 45.730 -8.355 30.340 1.00 37.94 ? 173 PRO D CG 1 +ATOM 18431 C CD . PRO D 1 173 ? 45.928 -6.950 30.855 1.00 36.81 ? 173 PRO D CD 1 +ATOM 18432 N N . MET D 1 174 ? 46.186 -7.507 26.252 1.00 40.13 ? 174 MET D N 1 +ATOM 18433 C CA . MET D 1 174 ? 45.289 -7.515 25.116 1.00 40.57 ? 174 MET D CA 1 +ATOM 18434 C C . MET D 1 174 ? 44.088 -8.444 25.307 1.00 39.84 ? 174 MET D C 1 +ATOM 18435 O O . MET D 1 174 ? 42.995 -8.157 24.803 1.00 40.51 ? 174 MET D O 1 +ATOM 18436 C CB . MET D 1 174 ? 46.047 -7.889 23.845 1.00 42.65 ? 174 MET D CB 1 +ATOM 18437 C CG . MET D 1 174 ? 45.179 -7.893 22.598 1.00 45.54 ? 174 MET D CG 1 +ATOM 18438 S SD . MET D 1 174 ? 46.143 -8.001 21.079 1.00 50.77 ? 174 MET D SD 1 +ATOM 18439 C CE . MET D 1 174 ? 45.637 -6.477 20.237 1.00 50.73 ? 174 MET D CE 1 +ATOM 18440 N N . TRP D 1 175 ? 44.263 -9.541 26.037 1.00 36.71 ? 175 TRP D N 1 +ATOM 18441 C CA . TRP D 1 175 ? 43.138 -10.451 26.232 1.00 35.73 ? 175 TRP D CA 1 +ATOM 18442 C C . TRP D 1 175 ? 42.004 -9.850 27.066 1.00 34.85 ? 175 TRP D C 1 +ATOM 18443 O O . TRP D 1 175 ? 40.892 -10.358 27.068 1.00 34.49 ? 175 TRP D O 1 +ATOM 18444 C CB . TRP D 1 175 ? 43.593 -11.787 26.848 1.00 34.96 ? 175 TRP D CB 1 +ATOM 18445 C CG . TRP D 1 175 ? 44.306 -11.703 28.171 1.00 35.89 ? 175 TRP D CG 1 +ATOM 18446 C CD1 . TRP D 1 175 ? 45.656 -11.751 28.376 1.00 36.16 ? 175 TRP D CD1 1 +ATOM 18447 C CD2 . TRP D 1 175 ? 43.707 -11.604 29.471 1.00 35.95 ? 175 TRP D CD2 1 +ATOM 18448 N NE1 . TRP D 1 175 ? 45.938 -11.699 29.722 1.00 37.73 ? 175 TRP D NE1 1 +ATOM 18449 C CE2 . TRP D 1 175 ? 44.761 -11.608 30.418 1.00 37.39 ? 175 TRP D CE2 1 +ATOM 18450 C CE3 . TRP D 1 175 ? 42.386 -11.514 29.929 1.00 35.85 ? 175 TRP D CE3 1 +ATOM 18451 C CZ2 . TRP D 1 175 ? 44.532 -11.528 31.797 1.00 36.08 ? 175 TRP D CZ2 1 +ATOM 18452 C CZ3 . TRP D 1 175 ? 42.155 -11.434 31.305 1.00 34.77 ? 175 TRP D CZ3 1 +ATOM 18453 C CH2 . TRP D 1 175 ? 43.224 -11.442 32.220 1.00 36.63 ? 175 TRP D CH2 1 +ATOM 18454 N N . ALA D 1 176 ? 42.285 -8.765 27.772 1.00 35.47 ? 176 ALA D N 1 +ATOM 18455 C CA . ALA D 1 176 ? 41.266 -8.123 28.589 1.00 35.89 ? 176 ALA D CA 1 +ATOM 18456 C C . ALA D 1 176 ? 40.200 -7.471 27.703 1.00 36.91 ? 176 ALA D C 1 +ATOM 18457 O O . ALA D 1 176 ? 39.110 -7.148 28.175 1.00 36.49 ? 176 ALA D O 1 +ATOM 18458 C CB . ALA D 1 176 ? 41.901 -7.078 29.493 1.00 36.59 ? 176 ALA D CB 1 +ATOM 18459 N N . PHE D 1 177 ? 40.513 -7.283 26.424 1.00 36.45 ? 177 PHE D N 1 +ATOM 18460 C CA . PHE D 1 177 ? 39.568 -6.673 25.499 1.00 36.24 ? 177 PHE D CA 1 +ATOM 18461 C C . PHE D 1 177 ? 38.892 -7.718 24.622 1.00 36.71 ? 177 PHE D C 1 +ATOM 18462 O O . PHE D 1 177 ? 38.179 -7.379 23.678 1.00 37.45 ? 177 PHE D O 1 +ATOM 18463 C CB . PHE D 1 177 ? 40.270 -5.638 24.617 1.00 36.88 ? 177 PHE D CB 1 +ATOM 18464 C CG . PHE D 1 177 ? 40.927 -4.532 25.392 1.00 38.58 ? 177 PHE D CG 1 +ATOM 18465 C CD1 . PHE D 1 177 ? 42.151 -4.738 26.025 1.00 39.72 ? 177 PHE D CD1 1 +ATOM 18466 C CD2 . PHE D 1 177 ? 40.314 -3.293 25.514 1.00 38.34 ? 177 PHE D CD2 1 +ATOM 18467 C CE1 . PHE D 1 177 ? 42.751 -3.721 26.770 1.00 40.08 ? 177 PHE D CE1 1 +ATOM 18468 C CE2 . PHE D 1 177 ? 40.908 -2.271 26.257 1.00 39.43 ? 177 PHE D CE2 1 +ATOM 18469 C CZ . PHE D 1 177 ? 42.129 -2.487 26.886 1.00 38.94 ? 177 PHE D CZ 1 +ATOM 18470 N N . GLY D 1 178 ? 39.114 -8.991 24.937 1.00 36.18 ? 178 GLY D N 1 +ATOM 18471 C CA . GLY D 1 178 ? 38.507 -10.056 24.162 1.00 35.10 ? 178 GLY D CA 1 +ATOM 18472 C C . GLY D 1 178 ? 37.077 -10.339 24.589 1.00 35.88 ? 178 GLY D C 1 +ATOM 18473 O O . GLY D 1 178 ? 36.516 -9.656 25.448 1.00 36.64 ? 178 GLY D O 1 +ATOM 18474 N N . TYR D 1 179 ? 36.479 -11.357 23.987 1.00 35.14 ? 179 TYR D N 1 +ATOM 18475 C CA . TYR D 1 179 ? 35.115 -11.731 24.303 1.00 34.57 ? 179 TYR D CA 1 +ATOM 18476 C C . TYR D 1 179 ? 35.055 -12.532 25.608 1.00 34.20 ? 179 TYR D C 1 +ATOM 18477 O O . TYR D 1 179 ? 35.619 -13.615 25.712 1.00 33.27 ? 179 TYR D O 1 +ATOM 18478 C CB . TYR D 1 179 ? 34.541 -12.534 23.137 1.00 34.88 ? 179 TYR D CB 1 +ATOM 18479 C CG . TYR D 1 179 ? 33.148 -13.086 23.346 1.00 35.91 ? 179 TYR D CG 1 +ATOM 18480 C CD1 . TYR D 1 179 ? 32.145 -12.310 23.931 1.00 37.67 ? 179 TYR D CD1 1 +ATOM 18481 C CD2 . TYR D 1 179 ? 32.817 -14.359 22.901 1.00 35.29 ? 179 TYR D CD2 1 +ATOM 18482 C CE1 . TYR D 1 179 ? 30.843 -12.793 24.064 1.00 37.76 ? 179 TYR D CE1 1 +ATOM 18483 C CE2 . TYR D 1 179 ? 31.524 -14.850 23.024 1.00 38.98 ? 179 TYR D CE2 1 +ATOM 18484 C CZ . TYR D 1 179 ? 30.540 -14.062 23.607 1.00 39.37 ? 179 TYR D CZ 1 +ATOM 18485 O OH . TYR D 1 179 ? 29.262 -14.556 23.730 1.00 40.05 ? 179 TYR D OH 1 +ATOM 18486 N N . MET D 1 180 ? 34.362 -11.987 26.600 1.00 34.24 ? 180 MET D N 1 +ATOM 18487 C CA . MET D 1 180 ? 34.226 -12.638 27.896 1.00 36.02 ? 180 MET D CA 1 +ATOM 18488 C C . MET D 1 180 ? 32.816 -13.176 28.103 1.00 36.09 ? 180 MET D C 1 +ATOM 18489 O O . MET D 1 180 ? 31.838 -12.499 27.789 1.00 36.07 ? 180 MET D O 1 +ATOM 18490 C CB . MET D 1 180 ? 34.506 -11.639 29.022 1.00 37.29 ? 180 MET D CB 1 +ATOM 18491 C CG . MET D 1 180 ? 35.755 -10.813 28.840 1.00 42.49 ? 180 MET D CG 1 +ATOM 18492 S SD . MET D 1 180 ? 37.253 -11.771 29.106 1.00 44.73 ? 180 MET D SD 1 +ATOM 18493 C CE . MET D 1 180 ? 38.390 -10.450 29.589 1.00 43.71 ? 180 MET D CE 1 +ATOM 18494 N N . ILE D 1 181 ? 32.706 -14.387 28.639 1.00 35.83 ? 181 ILE D N 1 +ATOM 18495 C CA . ILE D 1 181 ? 31.392 -14.941 28.922 1.00 34.72 ? 181 ILE D CA 1 +ATOM 18496 C C . ILE D 1 181 ? 31.276 -14.989 30.431 1.00 34.25 ? 181 ILE D C 1 +ATOM 18497 O O . ILE D 1 181 ? 32.249 -15.237 31.131 1.00 34.80 ? 181 ILE D O 1 +ATOM 18498 C CB . ILE D 1 181 ? 31.200 -16.342 28.323 1.00 34.82 ? 181 ILE D CB 1 +ATOM 18499 C CG1 . ILE D 1 181 ? 32.217 -17.320 28.905 1.00 34.48 ? 181 ILE D CG1 1 +ATOM 18500 C CG2 . ILE D 1 181 ? 31.321 -16.261 26.819 1.00 32.88 ? 181 ILE D CG2 1 +ATOM 18501 C CD1 . ILE D 1 181 ? 31.980 -18.744 28.474 1.00 35.31 ? 181 ILE D CD1 1 +ATOM 18502 N N . SER D 1 182 ? 30.081 -14.744 30.934 1.00 34.25 ? 182 SER D N 1 +ATOM 18503 C CA . SER D 1 182 ? 29.866 -14.705 32.364 1.00 32.77 ? 182 SER D CA 1 +ATOM 18504 C C . SER D 1 182 ? 28.399 -14.947 32.641 1.00 32.75 ? 182 SER D C 1 +ATOM 18505 O O . SER D 1 182 ? 27.573 -14.897 31.745 1.00 34.42 ? 182 SER D O 1 +ATOM 18506 C CB . SER D 1 182 ? 30.285 -13.317 32.883 1.00 33.68 ? 182 SER D CB 1 +ATOM 18507 O OG . SER D 1 182 ? 29.870 -13.073 34.218 1.00 33.45 ? 182 SER D OG 1 +ATOM 18508 N N . ARG D 1 183 ? 28.089 -15.229 33.891 1.00 33.80 ? 183 ARG D N 1 +ATOM 18509 C CA . ARG D 1 183 ? 26.726 -15.450 34.305 1.00 34.77 ? 183 ARG D CA 1 +ATOM 18510 C C . ARG D 1 183 ? 26.729 -15.468 35.814 1.00 35.95 ? 183 ARG D C 1 +ATOM 18511 O O . ARG D 1 183 ? 27.771 -15.588 36.440 1.00 37.16 ? 183 ARG D O 1 +ATOM 18512 C CB . ARG D 1 183 ? 26.181 -16.779 33.771 1.00 36.69 ? 183 ARG D CB 1 +ATOM 18513 C CG . ARG D 1 183 ? 24.674 -16.947 34.032 1.00 37.42 ? 183 ARG D CG 1 +ATOM 18514 C CD . ARG D 1 183 ? 24.119 -18.292 33.577 1.00 37.17 ? 183 ARG D CD 1 +ATOM 18515 N NE . ARG D 1 183 ? 22.741 -18.460 34.043 1.00 37.74 ? 183 ARG D NE 1 +ATOM 18516 C CZ . ARG D 1 183 ? 21.655 -18.058 33.388 1.00 36.23 ? 183 ARG D CZ 1 +ATOM 18517 N NH1 . ARG D 1 183 ? 21.759 -17.463 32.210 1.00 35.56 ? 183 ARG D NH1 1 +ATOM 18518 N NH2 . ARG D 1 183 ? 20.460 -18.232 33.930 1.00 34.88 ? 183 ARG D NH2 1 +ATOM 18519 N N . TYR D 1 184 ? 25.551 -15.341 36.394 1.00 36.99 ? 184 TYR D N 1 +ATOM 18520 C CA . TYR D 1 184 ? 25.394 -15.344 37.828 1.00 35.91 ? 184 TYR D CA 1 +ATOM 18521 C C . TYR D 1 184 ? 24.525 -16.545 38.158 1.00 35.59 ? 184 TYR D C 1 +ATOM 18522 O O . TYR D 1 184 ? 23.328 -16.399 38.372 1.00 36.70 ? 184 TYR D O 1 +ATOM 18523 C CB . TYR D 1 184 ? 24.732 -14.024 38.238 1.00 37.34 ? 184 TYR D CB 1 +ATOM 18524 C CG . TYR D 1 184 ? 24.233 -13.937 39.660 1.00 38.53 ? 184 TYR D CG 1 +ATOM 18525 C CD1 . TYR D 1 184 ? 24.860 -14.633 40.690 1.00 39.96 ? 184 TYR D CD1 1 +ATOM 18526 C CD2 . TYR D 1 184 ? 23.135 -13.132 39.980 1.00 39.53 ? 184 TYR D CD2 1 +ATOM 18527 C CE1 . TYR D 1 184 ? 24.406 -14.533 42.002 1.00 39.88 ? 184 TYR D CE1 1 +ATOM 18528 C CE2 . TYR D 1 184 ? 22.677 -13.026 41.284 1.00 38.14 ? 184 TYR D CE2 1 +ATOM 18529 C CZ . TYR D 1 184 ? 23.313 -13.726 42.287 1.00 38.82 ? 184 TYR D CZ 1 +ATOM 18530 O OH . TYR D 1 184 ? 22.849 -13.628 43.575 1.00 40.05 ? 184 TYR D OH 1 +ATOM 18531 N N . SER D 1 185 ? 25.111 -17.741 38.203 1.00 36.90 ? 185 SER D N 1 +ATOM 18532 C CA . SER D 1 185 ? 26.541 -17.990 37.970 1.00 36.98 ? 185 SER D CA 1 +ATOM 18533 C C . SER D 1 185 ? 26.719 -19.290 37.174 1.00 38.12 ? 185 SER D C 1 +ATOM 18534 O O . SER D 1 185 ? 25.755 -20.025 36.932 1.00 37.94 ? 185 SER D O 1 +ATOM 18535 C CB . SER D 1 185 ? 27.281 -18.182 39.306 1.00 36.10 ? 185 SER D CB 1 +ATOM 18536 O OG . SER D 1 185 ? 27.009 -17.165 40.251 1.00 35.07 ? 185 SER D OG 1 +ATOM 18537 N N . TYR D 1 186 ? 27.963 -19.573 36.783 1.00 38.88 ? 186 TYR D N 1 +ATOM 18538 C CA . TYR D 1 186 ? 28.282 -20.811 36.067 1.00 38.31 ? 186 TYR D CA 1 +ATOM 18539 C C . TYR D 1 186 ? 28.847 -21.797 37.094 1.00 38.97 ? 186 TYR D C 1 +ATOM 18540 O O . TYR D 1 186 ? 29.768 -21.462 37.836 1.00 38.74 ? 186 TYR D O 1 +ATOM 18541 C CB . TYR D 1 186 ? 29.335 -20.575 34.989 1.00 36.92 ? 186 TYR D CB 1 +ATOM 18542 C CG . TYR D 1 186 ? 28.844 -19.865 33.755 1.00 38.33 ? 186 TYR D CG 1 +ATOM 18543 C CD1 . TYR D 1 186 ? 27.670 -20.271 33.106 1.00 39.36 ? 186 TYR D CD1 1 +ATOM 18544 C CD2 . TYR D 1 186 ? 29.584 -18.818 33.193 1.00 37.82 ? 186 TYR D CD2 1 +ATOM 18545 C CE1 . TYR D 1 186 ? 27.246 -19.650 31.921 1.00 39.74 ? 186 TYR D CE1 1 +ATOM 18546 C CE2 . TYR D 1 186 ? 29.171 -18.193 32.009 1.00 38.95 ? 186 TYR D CE2 1 +ATOM 18547 C CZ . TYR D 1 186 ? 28.005 -18.613 31.381 1.00 40.42 ? 186 TYR D CZ 1 +ATOM 18548 O OH . TYR D 1 186 ? 27.609 -17.997 30.216 1.00 42.73 ? 186 TYR D OH 1 +ATOM 18549 N N . TYR D 1 187 ? 28.294 -23.006 37.136 1.00 39.01 ? 187 TYR D N 1 +ATOM 18550 C CA . TYR D 1 187 ? 28.743 -24.036 38.070 1.00 40.02 ? 187 TYR D CA 1 +ATOM 18551 C C . TYR D 1 187 ? 27.900 -25.292 37.878 1.00 40.16 ? 187 TYR D C 1 +ATOM 18552 O O . TYR D 1 187 ? 26.827 -25.231 37.281 1.00 41.79 ? 187 TYR D O 1 +ATOM 18553 C CB . TYR D 1 187 ? 28.594 -23.555 39.511 1.00 39.51 ? 187 TYR D CB 1 +ATOM 18554 C CG . TYR D 1 187 ? 27.173 -23.250 39.902 1.00 41.92 ? 187 TYR D CG 1 +ATOM 18555 C CD1 . TYR D 1 187 ? 26.530 -22.101 39.435 1.00 43.59 ? 187 TYR D CD1 1 +ATOM 18556 C CD2 . TYR D 1 187 ? 26.461 -24.109 40.741 1.00 42.48 ? 187 TYR D CD2 1 +ATOM 18557 C CE1 . TYR D 1 187 ? 25.214 -21.813 39.796 1.00 44.71 ? 187 TYR D CE1 1 +ATOM 18558 C CE2 . TYR D 1 187 ? 25.137 -23.829 41.112 1.00 44.32 ? 187 TYR D CE2 1 +ATOM 18559 C CZ . TYR D 1 187 ? 24.523 -22.679 40.637 1.00 44.91 ? 187 TYR D CZ 1 +ATOM 18560 O OH . TYR D 1 187 ? 23.228 -22.381 41.016 1.00 46.68 ? 187 TYR D OH 1 +ATOM 18561 N N . PRO D 1 188 ? 28.379 -26.452 38.362 1.00 39.91 ? 188 PRO D N 1 +ATOM 18562 C CA . PRO D 1 188 ? 29.653 -26.677 39.058 1.00 39.97 ? 188 PRO D CA 1 +ATOM 18563 C C . PRO D 1 188 ? 30.814 -26.600 38.070 1.00 39.25 ? 188 PRO D C 1 +ATOM 18564 O O . PRO D 1 188 ? 30.601 -26.371 36.881 1.00 39.76 ? 188 PRO D O 1 +ATOM 18565 C CB . PRO D 1 188 ? 29.466 -28.065 39.663 1.00 39.04 ? 188 PRO D CB 1 +ATOM 18566 C CG . PRO D 1 188 ? 28.636 -28.749 38.628 1.00 39.64 ? 188 PRO D CG 1 +ATOM 18567 C CD . PRO D 1 188 ? 27.611 -27.705 38.261 1.00 38.40 ? 188 PRO D CD 1 +ATOM 18568 N N . GLN D 1 189 ? 32.035 -26.810 38.544 1.00 39.95 ? 189 GLN D N 1 +ATOM 18569 C CA . GLN D 1 189 ? 33.202 -26.688 37.661 1.00 40.55 ? 189 GLN D CA 1 +ATOM 18570 C C . GLN D 1 189 ? 33.189 -27.463 36.346 1.00 40.57 ? 189 GLN D C 1 +ATOM 18571 O O . GLN D 1 189 ? 33.725 -26.983 35.352 1.00 39.48 ? 189 GLN D O 1 +ATOM 18572 C CB . GLN D 1 189 ? 34.494 -26.992 38.429 1.00 40.05 ? 189 GLN D CB 1 +ATOM 18573 C CG . GLN D 1 189 ? 34.710 -28.429 38.867 1.00 37.42 ? 189 GLN D CG 1 +ATOM 18574 C CD . GLN D 1 189 ? 36.015 -28.578 39.655 1.00 38.22 ? 189 GLN D CD 1 +ATOM 18575 O OE1 . GLN D 1 189 ? 36.072 -28.287 40.850 1.00 39.07 ? 189 GLN D OE1 1 +ATOM 18576 N NE2 . GLN D 1 189 ? 37.071 -29.006 38.978 1.00 36.56 ? 189 GLN D NE2 1 +ATOM 18577 N N . ASP D 1 190 ? 32.587 -28.649 36.322 1.00 42.09 ? 190 ASP D N 1 +ATOM 18578 C CA . ASP D 1 190 ? 32.548 -29.409 35.079 1.00 43.54 ? 190 ASP D CA 1 +ATOM 18579 C C . ASP D 1 190 ? 31.708 -28.697 34.026 1.00 42.72 ? 190 ASP D C 1 +ATOM 18580 O O . ASP D 1 190 ? 32.019 -28.751 32.833 1.00 42.90 ? 190 ASP D O 1 +ATOM 18581 C CB . ASP D 1 190 ? 31.997 -30.813 35.306 1.00 48.09 ? 190 ASP D CB 1 +ATOM 18582 C CG . ASP D 1 190 ? 32.956 -31.699 36.093 1.00 55.47 ? 190 ASP D CG 1 +ATOM 18583 O OD1 . ASP D 1 190 ? 34.193 -31.493 35.996 1.00 57.52 ? 190 ASP D OD1 1 +ATOM 18584 O OD2 . ASP D 1 190 ? 32.472 -32.615 36.800 1.00 59.32 ? 190 ASP D OD2 1 +ATOM 18585 N N . LYS D 1 191 ? 30.650 -28.022 34.467 1.00 40.92 ? 191 LYS D N 1 +ATOM 18586 C CA . LYS D 1 191 ? 29.780 -27.307 33.545 1.00 40.53 ? 191 LYS D CA 1 +ATOM 18587 C C . LYS D 1 191 ? 30.496 -26.115 32.930 1.00 39.41 ? 191 LYS D C 1 +ATOM 18588 O O . LYS D 1 191 ? 30.265 -25.769 31.774 1.00 39.82 ? 191 LYS D O 1 +ATOM 18589 C CB . LYS D 1 191 ? 28.503 -26.856 34.258 1.00 41.45 ? 191 LYS D CB 1 +ATOM 18590 C CG . LYS D 1 191 ? 27.465 -27.960 34.422 1.00 42.78 ? 191 LYS D CG 1 +ATOM 18591 C CD . LYS D 1 191 ? 26.809 -28.293 33.091 1.00 44.09 ? 191 LYS D CD 1 +ATOM 18592 C CE . LYS D 1 191 ? 25.794 -29.407 33.235 1.00 43.80 ? 191 LYS D CE 1 +ATOM 18593 N NZ . LYS D 1 191 ? 26.439 -30.699 33.582 1.00 44.69 ? 191 LYS D NZ 1 +ATOM 18594 N N . VAL D 1 192 ? 31.376 -25.492 33.704 1.00 39.10 ? 192 VAL D N 1 +ATOM 18595 C CA . VAL D 1 192 ? 32.133 -24.346 33.217 1.00 37.30 ? 192 VAL D CA 1 +ATOM 18596 C C . VAL D 1 192 ? 32.969 -24.773 32.019 1.00 38.07 ? 192 VAL D C 1 +ATOM 18597 O O . VAL D 1 192 ? 32.985 -24.105 30.987 1.00 38.03 ? 192 VAL D O 1 +ATOM 18598 C CB . VAL D 1 192 ? 33.065 -23.791 34.319 1.00 36.90 ? 192 VAL D CB 1 +ATOM 18599 C CG1 . VAL D 1 192 ? 33.953 -22.683 33.758 1.00 33.75 ? 192 VAL D CG1 1 +ATOM 18600 C CG2 . VAL D 1 192 ? 32.232 -23.286 35.478 1.00 35.09 ? 192 VAL D CG2 1 +ATOM 18601 N N . VAL D 1 193 ? 33.652 -25.903 32.152 1.00 39.06 ? 193 VAL D N 1 +ATOM 18602 C CA . VAL D 1 193 ? 34.490 -26.403 31.070 1.00 40.75 ? 193 VAL D CA 1 +ATOM 18603 C C . VAL D 1 193 ? 33.657 -26.886 29.879 1.00 40.89 ? 193 VAL D C 1 +ATOM 18604 O O . VAL D 1 193 ? 34.030 -26.675 28.727 1.00 39.93 ? 193 VAL D O 1 +ATOM 18605 C CB . VAL D 1 193 ? 35.392 -27.545 31.563 1.00 40.87 ? 193 VAL D CB 1 +ATOM 18606 C CG1 . VAL D 1 193 ? 36.311 -27.995 30.441 1.00 41.10 ? 193 VAL D CG1 1 +ATOM 18607 C CG2 . VAL D 1 193 ? 36.206 -27.076 32.758 1.00 40.56 ? 193 VAL D CG2 1 +ATOM 18608 N N . GLU D 1 194 ? 32.530 -27.534 30.159 1.00 41.48 ? 194 GLU D N 1 +ATOM 18609 C CA . GLU D 1 194 ? 31.660 -28.013 29.093 1.00 42.96 ? 194 GLU D CA 1 +ATOM 18610 C C . GLU D 1 194 ? 31.201 -26.846 28.227 1.00 41.94 ? 194 GLU D C 1 +ATOM 18611 O O . GLU D 1 194 ? 31.226 -26.929 27.002 1.00 41.68 ? 194 GLU D O 1 +ATOM 18612 C CB . GLU D 1 194 ? 30.436 -28.713 29.672 1.00 46.08 ? 194 GLU D CB 1 +ATOM 18613 C CG . GLU D 1 194 ? 30.723 -30.059 30.317 1.00 54.55 ? 194 GLU D CG 1 +ATOM 18614 C CD . GLU D 1 194 ? 29.519 -30.615 31.076 1.00 59.39 ? 194 GLU D CD 1 +ATOM 18615 O OE1 . GLU D 1 194 ? 28.396 -30.568 30.519 1.00 63.70 ? 194 GLU D OE1 1 +ATOM 18616 O OE2 . GLU D 1 194 ? 29.694 -31.103 32.220 1.00 59.00 ? 194 GLU D OE2 1 +ATOM 18617 N N . LEU D 1 195 ? 30.789 -25.759 28.871 1.00 39.66 ? 195 LEU D N 1 +ATOM 18618 C CA . LEU D 1 195 ? 30.318 -24.594 28.148 1.00 39.84 ? 195 LEU D CA 1 +ATOM 18619 C C . LEU D 1 195 ? 31.423 -23.971 27.309 1.00 39.73 ? 195 LEU D C 1 +ATOM 18620 O O . LEU D 1 195 ? 31.205 -23.627 26.150 1.00 40.47 ? 195 LEU D O 1 +ATOM 18621 C CB . LEU D 1 195 ? 29.743 -23.559 29.118 1.00 40.18 ? 195 LEU D CB 1 +ATOM 18622 C CG . LEU D 1 195 ? 29.199 -22.298 28.442 1.00 41.41 ? 195 LEU D CG 1 +ATOM 18623 C CD1 . LEU D 1 195 ? 28.104 -22.651 27.439 1.00 40.65 ? 195 LEU D CD1 1 +ATOM 18624 C CD2 . LEU D 1 195 ? 28.661 -21.362 29.501 1.00 42.21 ? 195 LEU D CD2 1 +ATOM 18625 N N . VAL D 1 196 ? 32.611 -23.824 27.886 1.00 40.03 ? 196 VAL D N 1 +ATOM 18626 C CA . VAL D 1 196 ? 33.735 -23.257 27.149 1.00 39.63 ? 196 VAL D CA 1 +ATOM 18627 C C . VAL D 1 196 ? 34.051 -24.121 25.930 1.00 40.91 ? 196 VAL D C 1 +ATOM 18628 O O . VAL D 1 196 ? 34.355 -23.602 24.853 1.00 40.81 ? 196 VAL D O 1 +ATOM 18629 C CB . VAL D 1 196 ? 34.999 -23.144 28.034 1.00 39.46 ? 196 VAL D CB 1 +ATOM 18630 C CG1 . VAL D 1 196 ? 36.212 -22.810 27.178 1.00 39.40 ? 196 VAL D CG1 1 +ATOM 18631 C CG2 . VAL D 1 196 ? 34.805 -22.056 29.076 1.00 38.20 ? 196 VAL D CG2 1 +ATOM 18632 N N . ASP D 1 197 ? 33.983 -25.439 26.096 1.00 42.08 ? 197 ASP D N 1 +ATOM 18633 C CA . ASP D 1 197 ? 34.248 -26.340 24.977 1.00 44.38 ? 197 ASP D CA 1 +ATOM 18634 C C . ASP D 1 197 ? 33.246 -26.160 23.840 1.00 43.65 ? 197 ASP D C 1 +ATOM 18635 O O . ASP D 1 197 ? 33.637 -26.092 22.676 1.00 43.80 ? 197 ASP D O 1 +ATOM 18636 C CB . ASP D 1 197 ? 34.238 -27.805 25.427 1.00 46.03 ? 197 ASP D CB 1 +ATOM 18637 C CG . ASP D 1 197 ? 35.575 -28.249 25.990 1.00 49.66 ? 197 ASP D CG 1 +ATOM 18638 O OD1 . ASP D 1 197 ? 36.611 -27.691 25.562 1.00 50.79 ? 197 ASP D OD1 1 +ATOM 18639 O OD2 . ASP D 1 197 ? 35.592 -29.167 26.844 1.00 52.06 ? 197 ASP D OD2 1 +ATOM 18640 N N . ILE D 1 198 ? 31.960 -26.091 24.173 1.00 42.95 ? 198 ILE D N 1 +ATOM 18641 C CA . ILE D 1 198 ? 30.935 -25.912 23.154 1.00 43.84 ? 198 ILE D CA 1 +ATOM 18642 C C . ILE D 1 198 ? 31.139 -24.573 22.442 1.00 43.74 ? 198 ILE D C 1 +ATOM 18643 O O . ILE D 1 198 ? 31.047 -24.495 21.219 1.00 43.94 ? 198 ILE D O 1 +ATOM 18644 C CB . ILE D 1 198 ? 29.517 -25.956 23.761 1.00 44.59 ? 198 ILE D CB 1 +ATOM 18645 C CG1 . ILE D 1 198 ? 29.312 -27.283 24.491 1.00 45.20 ? 198 ILE D CG1 1 +ATOM 18646 C CG2 . ILE D 1 198 ? 28.480 -25.822 22.653 1.00 45.77 ? 198 ILE D CG2 1 +ATOM 18647 C CD1 . ILE D 1 198 ? 27.975 -27.403 25.175 1.00 46.88 ? 198 ILE D CD1 1 +ATOM 18648 N N . MET D 1 199 ? 31.425 -23.523 23.205 1.00 43.17 ? 199 MET D N 1 +ATOM 18649 C CA . MET D 1 199 ? 31.651 -22.212 22.615 1.00 43.11 ? 199 MET D CA 1 +ATOM 18650 C C . MET D 1 199 ? 32.784 -22.274 21.595 1.00 42.60 ? 199 MET D C 1 +ATOM 18651 O O . MET D 1 199 ? 32.640 -21.824 20.461 1.00 43.16 ? 199 MET D O 1 +ATOM 18652 C CB . MET D 1 199 ? 32.005 -21.185 23.697 1.00 43.10 ? 199 MET D CB 1 +ATOM 18653 C CG . MET D 1 199 ? 30.839 -20.713 24.541 1.00 45.53 ? 199 MET D CG 1 +ATOM 18654 S SD . MET D 1 199 ? 29.686 -19.634 23.651 1.00 47.50 ? 199 MET D SD 1 +ATOM 18655 C CE . MET D 1 199 ? 30.526 -18.035 23.770 1.00 45.98 ? 199 MET D CE 1 +ATOM 18656 N N . GLN D 1 200 ? 33.917 -22.832 21.996 1.00 42.65 ? 200 GLN D N 1 +ATOM 18657 C CA . GLN D 1 200 ? 35.066 -22.919 21.096 1.00 45.12 ? 200 GLN D CA 1 +ATOM 18658 C C . GLN D 1 200 ? 34.801 -23.827 19.899 1.00 45.83 ? 200 GLN D C 1 +ATOM 18659 O O . GLN D 1 200 ? 35.170 -23.503 18.772 1.00 44.78 ? 200 GLN D O 1 +ATOM 18660 C CB . GLN D 1 200 ? 36.301 -23.403 21.858 1.00 43.96 ? 200 GLN D CB 1 +ATOM 18661 C CG . GLN D 1 200 ? 36.682 -22.503 23.023 1.00 44.80 ? 200 GLN D CG 1 +ATOM 18662 C CD . GLN D 1 200 ? 37.997 -22.907 23.653 1.00 45.71 ? 200 GLN D CD 1 +ATOM 18663 O OE1 . GLN D 1 200 ? 38.220 -24.084 23.944 1.00 46.50 ? 200 GLN D OE1 1 +ATOM 18664 N NE2 . GLN D 1 200 ? 38.878 -21.933 23.868 1.00 43.15 ? 200 GLN D NE2 1 +ATOM 18665 N N . LYS D 1 201 ? 34.150 -24.958 20.147 1.00 47.15 ? 201 LYS D N 1 +ATOM 18666 C CA . LYS D 1 201 ? 33.829 -25.886 19.077 1.00 49.60 ? 201 LYS D CA 1 +ATOM 18667 C C . LYS D 1 201 ? 32.957 -25.222 18.013 1.00 49.80 ? 201 LYS D C 1 +ATOM 18668 O O . LYS D 1 201 ? 33.115 -25.492 16.827 1.00 49.36 ? 201 LYS D O 1 +ATOM 18669 C CB . LYS D 1 201 ? 33.114 -27.115 19.639 1.00 51.24 ? 201 LYS D CB 1 +ATOM 18670 C CG . LYS D 1 201 ? 32.735 -28.128 18.580 1.00 54.71 ? 201 LYS D CG 1 +ATOM 18671 C CD . LYS D 1 201 ? 32.076 -29.350 19.200 1.00 59.48 ? 201 LYS D CD 1 +ATOM 18672 C CE . LYS D 1 201 ? 31.659 -30.357 18.130 1.00 61.30 ? 201 LYS D CE 1 +ATOM 18673 N NZ . LYS D 1 201 ? 30.662 -29.766 17.184 1.00 63.97 ? 201 LYS D NZ 1 +ATOM 18674 N N . GLU D 1 202 ? 32.041 -24.351 18.433 1.00 50.59 ? 202 GLU D N 1 +ATOM 18675 C CA . GLU D 1 202 ? 31.168 -23.675 17.482 1.00 50.27 ? 202 GLU D CA 1 +ATOM 18676 C C . GLU D 1 202 ? 31.759 -22.397 16.896 1.00 48.54 ? 202 GLU D C 1 +ATOM 18677 O O . GLU D 1 202 ? 31.059 -21.618 16.254 1.00 48.20 ? 202 GLU D O 1 +ATOM 18678 C CB . GLU D 1 202 ? 29.792 -23.416 18.105 1.00 52.21 ? 202 GLU D CB 1 +ATOM 18679 C CG . GLU D 1 202 ? 28.955 -24.694 18.186 1.00 57.16 ? 202 GLU D CG 1 +ATOM 18680 C CD . GLU D 1 202 ? 27.489 -24.448 18.510 1.00 59.98 ? 202 GLU D CD 1 +ATOM 18681 O OE1 . GLU D 1 202 ? 26.921 -23.463 17.991 1.00 61.98 ? 202 GLU D OE1 1 +ATOM 18682 O OE2 . GLU D 1 202 ? 26.897 -25.251 19.268 1.00 61.64 ? 202 GLU D OE2 1 +ATOM 18683 N N . GLY D 1 203 ? 33.053 -22.187 17.114 1.00 47.03 ? 203 GLY D N 1 +ATOM 18684 C CA . GLY D 1 203 ? 33.716 -21.031 16.541 1.00 45.29 ? 203 GLY D CA 1 +ATOM 18685 C C . GLY D 1 203 ? 33.818 -19.735 17.319 1.00 45.33 ? 203 GLY D C 1 +ATOM 18686 O O . GLY D 1 203 ? 34.267 -18.734 16.768 1.00 46.90 ? 203 GLY D O 1 +ATOM 18687 N N . PHE D 1 204 ? 33.414 -19.718 18.580 1.00 44.32 ? 204 PHE D N 1 +ATOM 18688 C CA . PHE D 1 204 ? 33.515 -18.484 19.342 1.00 43.09 ? 204 PHE D CA 1 +ATOM 18689 C C . PHE D 1 204 ? 34.825 -18.442 20.103 1.00 43.50 ? 204 PHE D C 1 +ATOM 18690 O O . PHE D 1 204 ? 35.137 -19.340 20.886 1.00 43.32 ? 204 PHE D O 1 +ATOM 18691 C CB . PHE D 1 204 ? 32.339 -18.336 20.309 1.00 42.36 ? 204 PHE D CB 1 +ATOM 18692 C CG . PHE D 1 204 ? 31.024 -18.166 19.623 1.00 41.94 ? 204 PHE D CG 1 +ATOM 18693 C CD1 . PHE D 1 204 ? 30.266 -19.272 19.265 1.00 41.83 ? 204 PHE D CD1 1 +ATOM 18694 C CD2 . PHE D 1 204 ? 30.569 -16.898 19.274 1.00 41.76 ? 204 PHE D CD2 1 +ATOM 18695 C CE1 . PHE D 1 204 ? 29.071 -19.124 18.562 1.00 43.12 ? 204 PHE D CE1 1 +ATOM 18696 C CE2 . PHE D 1 204 ? 29.378 -16.734 18.573 1.00 41.96 ? 204 PHE D CE2 1 +ATOM 18697 C CZ . PHE D 1 204 ? 28.626 -17.851 18.214 1.00 42.86 ? 204 PHE D CZ 1 +ATOM 18698 N N . ARG D 1 205 ? 35.595 -17.394 19.856 1.00 43.11 ? 205 ARG D N 1 +ATOM 18699 C CA . ARG D 1 205 ? 36.872 -17.225 20.511 1.00 43.98 ? 205 ARG D CA 1 +ATOM 18700 C C . ARG D 1 205 ? 36.625 -16.571 21.871 1.00 43.35 ? 205 ARG D C 1 +ATOM 18701 O O . ARG D 1 205 ? 36.339 -15.377 21.959 1.00 44.53 ? 205 ARG D O 1 +ATOM 18702 C CB . ARG D 1 205 ? 37.767 -16.365 19.626 1.00 46.63 ? 205 ARG D CB 1 +ATOM 18703 C CG . ARG D 1 205 ? 39.178 -16.188 20.117 1.00 51.64 ? 205 ARG D CG 1 +ATOM 18704 C CD . ARG D 1 205 ? 39.983 -15.397 19.098 1.00 54.61 ? 205 ARG D CD 1 +ATOM 18705 N NE . ARG D 1 205 ? 41.251 -14.927 19.647 1.00 58.89 ? 205 ARG D NE 1 +ATOM 18706 C CZ . ARG D 1 205 ? 42.102 -14.148 18.985 1.00 60.52 ? 205 ARG D CZ 1 +ATOM 18707 N NH1 . ARG D 1 205 ? 41.819 -13.759 17.746 1.00 59.82 ? 205 ARG D NH1 1 +ATOM 18708 N NH2 . ARG D 1 205 ? 43.224 -13.739 19.569 1.00 61.85 ? 205 ARG D NH2 1 +ATOM 18709 N N . VAL D 1 206 ? 36.713 -17.376 22.927 1.00 41.98 ? 206 VAL D N 1 +ATOM 18710 C CA . VAL D 1 206 ? 36.488 -16.907 24.288 1.00 40.29 ? 206 VAL D CA 1 +ATOM 18711 C C . VAL D 1 206 ? 37.805 -16.562 24.980 1.00 39.03 ? 206 VAL D C 1 +ATOM 18712 O O . VAL D 1 206 ? 38.688 -17.407 25.112 1.00 38.54 ? 206 VAL D O 1 +ATOM 18713 C CB . VAL D 1 206 ? 35.746 -17.976 25.116 1.00 39.97 ? 206 VAL D CB 1 +ATOM 18714 C CG1 . VAL D 1 206 ? 35.554 -17.495 26.541 1.00 41.68 ? 206 VAL D CG1 1 +ATOM 18715 C CG2 . VAL D 1 206 ? 34.408 -18.271 24.487 1.00 40.24 ? 206 VAL D CG2 1 +ATOM 18716 N N . ALA D 1 207 ? 37.923 -15.315 25.427 1.00 37.85 ? 207 ALA D N 1 +ATOM 18717 C CA . ALA D 1 207 ? 39.127 -14.846 26.103 1.00 36.73 ? 207 ALA D CA 1 +ATOM 18718 C C . ALA D 1 207 ? 39.158 -15.245 27.576 1.00 37.06 ? 207 ALA D C 1 +ATOM 18719 O O . ALA D 1 207 ? 40.220 -15.573 28.113 1.00 37.18 ? 207 ALA D O 1 +ATOM 18720 C CB . ALA D 1 207 ? 39.249 -13.331 25.971 1.00 33.89 ? 207 ALA D CB 1 +ATOM 18721 N N . GLY D 1 208 ? 37.998 -15.212 28.226 1.00 36.61 ? 208 GLY D N 1 +ATOM 18722 C CA . GLY D 1 208 ? 37.930 -15.574 29.628 1.00 33.18 ? 208 GLY D CA 1 +ATOM 18723 C C . GLY D 1 208 ? 36.511 -15.798 30.112 1.00 34.14 ? 208 GLY D C 1 +ATOM 18724 O O . GLY D 1 208 ? 35.537 -15.426 29.450 1.00 33.08 ? 208 GLY D O 1 +ATOM 18725 N N . VAL D 1 209 ? 36.389 -16.427 31.273 1.00 33.81 ? 209 VAL D N 1 +ATOM 18726 C CA . VAL D 1 209 ? 35.093 -16.684 31.855 1.00 33.80 ? 209 VAL D CA 1 +ATOM 18727 C C . VAL D 1 209 ? 35.101 -16.106 33.254 1.00 34.10 ? 209 VAL D C 1 +ATOM 18728 O O . VAL D 1 209 ? 36.106 -16.184 33.957 1.00 33.21 ? 209 VAL D O 1 +ATOM 18729 C CB . VAL D 1 209 ? 34.769 -18.206 31.922 1.00 34.99 ? 209 VAL D CB 1 +ATOM 18730 C CG1 . VAL D 1 209 ? 34.969 -18.834 30.558 1.00 37.40 ? 209 VAL D CG1 1 +ATOM 18731 C CG2 . VAL D 1 209 ? 35.644 -18.897 32.932 1.00 37.66 ? 209 VAL D CG2 1 +ATOM 18732 N N . PHE D 1 210 ? 33.975 -15.514 33.645 1.00 34.71 ? 210 PHE D N 1 +ATOM 18733 C CA . PHE D 1 210 ? 33.834 -14.923 34.964 1.00 33.67 ? 210 PHE D CA 1 +ATOM 18734 C C . PHE D 1 210 ? 33.070 -15.861 35.876 1.00 34.46 ? 210 PHE D C 1 +ATOM 18735 O O . PHE D 1 210 ? 32.055 -16.442 35.482 1.00 36.59 ? 210 PHE D O 1 +ATOM 18736 C CB . PHE D 1 210 ? 33.098 -13.584 34.883 1.00 33.12 ? 210 PHE D CB 1 +ATOM 18737 C CG . PHE D 1 210 ? 33.921 -12.470 34.293 1.00 32.01 ? 210 PHE D CG 1 +ATOM 18738 C CD1 . PHE D 1 210 ? 34.445 -12.573 33.009 1.00 29.90 ? 210 PHE D CD1 1 +ATOM 18739 C CD2 . PHE D 1 210 ? 34.180 -11.320 35.034 1.00 31.17 ? 210 PHE D CD2 1 +ATOM 18740 C CE1 . PHE D 1 210 ? 35.220 -11.546 32.465 1.00 31.67 ? 210 PHE D CE1 1 +ATOM 18741 C CE2 . PHE D 1 210 ? 34.954 -10.284 34.502 1.00 32.80 ? 210 PHE D CE2 1 +ATOM 18742 C CZ . PHE D 1 210 ? 35.477 -10.399 33.212 1.00 31.71 ? 210 PHE D CZ 1 +ATOM 18743 N N . LEU D 1 211 ? 33.565 -16.011 37.097 1.00 33.94 ? 211 LEU D N 1 +ATOM 18744 C CA . LEU D 1 211 ? 32.925 -16.861 38.082 1.00 34.56 ? 211 LEU D CA 1 +ATOM 18745 C C . LEU D 1 211 ? 32.271 -15.959 39.118 1.00 35.44 ? 211 LEU D C 1 +ATOM 18746 O O . LEU D 1 211 ? 32.967 -15.234 39.833 1.00 35.15 ? 211 LEU D O 1 +ATOM 18747 C CB . LEU D 1 211 ? 33.966 -17.754 38.743 1.00 35.13 ? 211 LEU D CB 1 +ATOM 18748 C CG . LEU D 1 211 ? 33.854 -19.262 38.527 1.00 36.80 ? 211 LEU D CG 1 +ATOM 18749 C CD1 . LEU D 1 211 ? 33.525 -19.575 37.075 1.00 35.02 ? 211 LEU D CD1 1 +ATOM 18750 C CD2 . LEU D 1 211 ? 35.179 -19.916 38.943 1.00 37.71 ? 211 LEU D CD2 1 +ATOM 18751 N N . ASP D 1 212 ? 30.936 -15.990 39.182 1.00 36.38 ? 212 ASP D N 1 +ATOM 18752 C CA . ASP D 1 212 ? 30.191 -15.166 40.129 1.00 35.21 ? 212 ASP D CA 1 +ATOM 18753 C C . ASP D 1 212 ? 30.136 -15.872 41.490 1.00 35.62 ? 212 ASP D C 1 +ATOM 18754 O O . ASP D 1 212 ? 30.624 -16.999 41.638 1.00 35.18 ? 212 ASP D O 1 +ATOM 18755 C CB . ASP D 1 212 ? 28.777 -14.878 39.603 1.00 37.24 ? 212 ASP D CB 1 +ATOM 18756 C CG . ASP D 1 212 ? 28.250 -13.509 40.042 1.00 38.89 ? 212 ASP D CG 1 +ATOM 18757 O OD1 . ASP D 1 212 ? 28.439 -13.138 41.231 1.00 37.85 ? 212 ASP D OD1 1 +ATOM 18758 O OD2 . ASP D 1 212 ? 27.638 -12.806 39.194 1.00 39.50 ? 212 ASP D OD2 1 +ATOM 18759 N N . ILE D 1 213 ? 29.515 -15.221 42.471 1.00 34.46 ? 213 ILE D N 1 +ATOM 18760 C CA . ILE D 1 213 ? 29.467 -15.720 43.839 1.00 33.91 ? 213 ILE D CA 1 +ATOM 18761 C C . ILE D 1 213 ? 29.094 -17.159 44.167 1.00 34.64 ? 213 ILE D C 1 +ATOM 18762 O O . ILE D 1 213 ? 29.356 -17.603 45.283 1.00 36.10 ? 213 ILE D O 1 +ATOM 18763 C CB . ILE D 1 213 ? 28.614 -14.786 44.738 1.00 33.15 ? 213 ILE D CB 1 +ATOM 18764 C CG1 . ILE D 1 213 ? 27.145 -14.826 44.323 1.00 34.05 ? 213 ILE D CG1 1 +ATOM 18765 C CG2 . ILE D 1 213 ? 29.153 -13.373 44.654 1.00 32.07 ? 213 ILE D CG2 1 +ATOM 18766 C CD1 . ILE D 1 213 ? 26.258 -13.954 45.193 1.00 32.70 ? 213 ILE D CD1 1 +ATOM 18767 N N . HIS D 1 214 ? 28.493 -17.895 43.239 1.00 34.75 ? 214 HIS D N 1 +ATOM 18768 C CA . HIS D 1 214 ? 28.142 -19.285 43.527 1.00 35.35 ? 214 HIS D CA 1 +ATOM 18769 C C . HIS D 1 214 ? 29.377 -20.195 43.693 1.00 35.77 ? 214 HIS D C 1 +ATOM 18770 O O . HIS D 1 214 ? 29.258 -21.312 44.203 1.00 35.28 ? 214 HIS D O 1 +ATOM 18771 C CB . HIS D 1 214 ? 27.266 -19.876 42.422 1.00 37.68 ? 214 HIS D CB 1 +ATOM 18772 C CG . HIS D 1 214 ? 25.845 -19.414 42.453 1.00 40.32 ? 214 HIS D CG 1 +ATOM 18773 N ND1 . HIS D 1 214 ? 25.445 -18.191 41.956 1.00 41.45 ? 214 HIS D ND1 1 +ATOM 18774 C CD2 . HIS D 1 214 ? 24.721 -20.026 42.897 1.00 40.61 ? 214 HIS D CD2 1 +ATOM 18775 C CE1 . HIS D 1 214 ? 24.137 -18.071 42.090 1.00 41.17 ? 214 HIS D CE1 1 +ATOM 18776 N NE2 . HIS D 1 214 ? 23.674 -19.171 42.658 1.00 41.45 ? 214 HIS D NE2 1 +ATOM 18777 N N . TYR D 1 215 ? 30.553 -19.733 43.262 1.00 34.85 ? 215 TYR D N 1 +ATOM 18778 C CA . TYR D 1 215 ? 31.763 -20.544 43.379 1.00 34.55 ? 215 TYR D CA 1 +ATOM 18779 C C . TYR D 1 215 ? 32.313 -20.582 44.801 1.00 35.84 ? 215 TYR D C 1 +ATOM 18780 O O . TYR D 1 215 ? 33.071 -21.482 45.152 1.00 36.22 ? 215 TYR D O 1 +ATOM 18781 C CB . TYR D 1 215 ? 32.853 -20.043 42.421 1.00 32.98 ? 215 TYR D CB 1 +ATOM 18782 C CG . TYR D 1 215 ? 33.678 -18.868 42.921 1.00 34.76 ? 215 TYR D CG 1 +ATOM 18783 C CD1 . TYR D 1 215 ? 34.632 -19.034 43.934 1.00 33.36 ? 215 TYR D CD1 1 +ATOM 18784 C CD2 . TYR D 1 215 ? 33.524 -17.593 42.364 1.00 32.78 ? 215 TYR D CD2 1 +ATOM 18785 C CE1 . TYR D 1 215 ? 35.413 -17.963 44.368 1.00 32.67 ? 215 TYR D CE1 1 +ATOM 18786 C CE2 . TYR D 1 215 ? 34.298 -16.517 42.797 1.00 32.53 ? 215 TYR D CE2 1 +ATOM 18787 C CZ . TYR D 1 215 ? 35.241 -16.712 43.796 1.00 32.48 ? 215 TYR D CZ 1 +ATOM 18788 O OH . TYR D 1 215 ? 36.025 -15.663 44.204 1.00 31.73 ? 215 TYR D OH 1 +ATOM 18789 N N . MET D 1 216 ? 31.931 -19.607 45.618 1.00 36.59 ? 216 MET D N 1 +ATOM 18790 C CA . MET D 1 216 ? 32.407 -19.543 46.995 1.00 38.10 ? 216 MET D CA 1 +ATOM 18791 C C . MET D 1 216 ? 31.686 -20.509 47.918 1.00 39.38 ? 216 MET D C 1 +ATOM 18792 O O . MET D 1 216 ? 30.625 -21.042 47.590 1.00 39.03 ? 216 MET D O 1 +ATOM 18793 C CB . MET D 1 216 ? 32.239 -18.126 47.557 1.00 37.28 ? 216 MET D CB 1 +ATOM 18794 C CG . MET D 1 216 ? 33.064 -17.063 46.860 1.00 39.81 ? 216 MET D CG 1 +ATOM 18795 S SD . MET D 1 216 ? 32.718 -15.406 47.486 1.00 42.15 ? 216 MET D SD 1 +ATOM 18796 C CE . MET D 1 216 ? 31.896 -14.680 46.136 1.00 40.12 ? 216 MET D CE 1 +ATOM 18797 N N . ASP D 1 217 ? 32.277 -20.722 49.085 1.00 40.73 ? 217 ASP D N 1 +ATOM 18798 C CA . ASP D 1 217 ? 31.691 -21.577 50.096 1.00 41.49 ? 217 ASP D CA 1 +ATOM 18799 C C . ASP D 1 217 ? 30.861 -20.662 50.993 1.00 41.33 ? 217 ASP D C 1 +ATOM 18800 O O . ASP D 1 217 ? 31.422 -19.906 51.786 1.00 40.07 ? 217 ASP D O 1 +ATOM 18801 C CB . ASP D 1 217 ? 32.801 -22.259 50.896 1.00 43.53 ? 217 ASP D CB 1 +ATOM 18802 C CG . ASP D 1 217 ? 32.277 -22.994 52.120 1.00 46.86 ? 217 ASP D CG 1 +ATOM 18803 O OD1 . ASP D 1 217 ? 31.081 -23.375 52.143 1.00 47.89 ? 217 ASP D OD1 1 +ATOM 18804 O OD2 . ASP D 1 217 ? 33.074 -23.200 53.059 1.00 50.15 ? 217 ASP D OD2 1 +ATOM 18805 N N . SER D 1 218 ? 29.535 -20.716 50.847 1.00 41.44 ? 218 SER D N 1 +ATOM 18806 C CA . SER D 1 218 ? 28.629 -19.874 51.633 1.00 41.35 ? 218 SER D CA 1 +ATOM 18807 C C . SER D 1 218 ? 28.945 -18.393 51.440 1.00 41.45 ? 218 SER D C 1 +ATOM 18808 O O . SER D 1 218 ? 28.832 -17.597 52.381 1.00 41.09 ? 218 SER D O 1 +ATOM 18809 C CB . SER D 1 218 ? 28.732 -20.200 53.123 1.00 42.09 ? 218 SER D CB 1 +ATOM 18810 O OG . SER D 1 218 ? 28.357 -21.535 53.383 1.00 47.69 ? 218 SER D OG 1 +ATOM 18811 N N . TYR D 1 219 ? 29.357 -18.027 50.229 1.00 40.58 ? 219 TYR D N 1 +ATOM 18812 C CA . TYR D 1 219 ? 29.689 -16.637 49.908 1.00 41.19 ? 219 TYR D CA 1 +ATOM 18813 C C . TYR D 1 219 ? 30.907 -16.087 50.661 1.00 40.34 ? 219 TYR D C 1 +ATOM 18814 O O . TYR D 1 219 ? 31.096 -14.875 50.739 1.00 40.53 ? 219 TYR D O 1 +ATOM 18815 C CB . TYR D 1 219 ? 28.472 -15.740 50.162 1.00 40.42 ? 219 TYR D CB 1 +ATOM 18816 C CG . TYR D 1 219 ? 27.234 -16.243 49.463 1.00 43.20 ? 219 TYR D CG 1 +ATOM 18817 C CD1 . TYR D 1 219 ? 27.167 -16.282 48.067 1.00 43.10 ? 219 TYR D CD1 1 +ATOM 18818 C CD2 . TYR D 1 219 ? 26.157 -16.751 50.190 1.00 42.54 ? 219 TYR D CD2 1 +ATOM 18819 C CE1 . TYR D 1 219 ? 26.063 -16.824 47.414 1.00 44.48 ? 219 TYR D CE1 1 +ATOM 18820 C CE2 . TYR D 1 219 ? 25.046 -17.293 49.545 1.00 44.31 ? 219 TYR D CE2 1 +ATOM 18821 C CZ . TYR D 1 219 ? 25.007 -17.329 48.158 1.00 45.27 ? 219 TYR D CZ 1 +ATOM 18822 O OH . TYR D 1 219 ? 23.920 -17.887 47.520 1.00 47.06 ? 219 TYR D OH 1 +ATOM 18823 N N . LYS D 1 220 ? 31.731 -16.973 51.213 1.00 39.97 ? 220 LYS D N 1 +ATOM 18824 C CA . LYS D 1 220 ? 32.928 -16.541 51.932 1.00 39.65 ? 220 LYS D CA 1 +ATOM 18825 C C . LYS D 1 220 ? 34.063 -16.229 50.966 1.00 37.93 ? 220 LYS D C 1 +ATOM 18826 O O . LYS D 1 220 ? 34.482 -17.086 50.193 1.00 36.12 ? 220 LYS D O 1 +ATOM 18827 C CB . LYS D 1 220 ? 33.383 -17.619 52.919 1.00 42.29 ? 220 LYS D CB 1 +ATOM 18828 C CG . LYS D 1 220 ? 32.525 -17.699 54.162 1.00 44.81 ? 220 LYS D CG 1 +ATOM 18829 C CD . LYS D 1 220 ? 33.065 -18.693 55.175 1.00 45.65 ? 220 LYS D CD 1 +ATOM 18830 C CE . LYS D 1 220 ? 32.805 -20.116 54.741 1.00 47.61 ? 220 LYS D CE 1 +ATOM 18831 N NZ . LYS D 1 220 ? 32.977 -21.063 55.880 1.00 49.68 ? 220 LYS D NZ 1 +ATOM 18832 N N . LEU D 1 221 ? 34.560 -14.998 51.011 1.00 36.67 ? 221 LEU D N 1 +ATOM 18833 C CA . LEU D 1 221 ? 35.648 -14.601 50.126 1.00 37.31 ? 221 LEU D CA 1 +ATOM 18834 C C . LEU D 1 221 ? 36.842 -15.533 50.243 1.00 36.32 ? 221 LEU D C 1 +ATOM 18835 O O . LEU D 1 221 ? 37.135 -16.055 51.314 1.00 37.01 ? 221 LEU D O 1 +ATOM 18836 C CB . LEU D 1 221 ? 36.115 -13.171 50.424 1.00 37.47 ? 221 LEU D CB 1 +ATOM 18837 C CG . LEU D 1 221 ? 35.052 -12.072 50.408 1.00 40.05 ? 221 LEU D CG 1 +ATOM 18838 C CD1 . LEU D 1 221 ? 35.739 -10.711 50.539 1.00 39.50 ? 221 LEU D CD1 1 +ATOM 18839 C CD2 . LEU D 1 221 ? 34.232 -12.153 49.121 1.00 38.66 ? 221 LEU D CD2 1 +ATOM 18840 N N . PHE D 1 222 ? 37.517 -15.743 49.122 1.00 35.93 ? 222 PHE D N 1 +ATOM 18841 C CA . PHE D 1 222 ? 38.702 -16.586 49.067 1.00 35.37 ? 222 PHE D CA 1 +ATOM 18842 C C . PHE D 1 222 ? 38.504 -18.032 49.495 1.00 35.93 ? 222 PHE D C 1 +ATOM 18843 O O . PHE D 1 222 ? 39.355 -18.604 50.172 1.00 36.40 ? 222 PHE D O 1 +ATOM 18844 C CB . PHE D 1 222 ? 39.811 -15.939 49.891 1.00 33.29 ? 222 PHE D CB 1 +ATOM 18845 C CG . PHE D 1 222 ? 40.006 -14.490 49.578 1.00 33.89 ? 222 PHE D CG 1 +ATOM 18846 C CD1 . PHE D 1 222 ? 40.313 -14.085 48.280 1.00 33.36 ? 222 PHE D CD1 1 +ATOM 18847 C CD2 . PHE D 1 222 ? 39.840 -13.519 50.567 1.00 33.30 ? 222 PHE D CD2 1 +ATOM 18848 C CE1 . PHE D 1 222 ? 40.450 -12.726 47.968 1.00 34.78 ? 222 PHE D CE1 1 +ATOM 18849 C CE2 . PHE D 1 222 ? 39.973 -12.159 50.268 1.00 32.07 ? 222 PHE D CE2 1 +ATOM 18850 C CZ . PHE D 1 222 ? 40.279 -11.763 48.964 1.00 33.76 ? 222 PHE D CZ 1 +ATOM 18851 N N . THR D 1 223 ? 37.379 -18.619 49.104 1.00 35.95 ? 223 THR D N 1 +ATOM 18852 C CA . THR D 1 223 ? 37.096 -20.019 49.406 1.00 36.03 ? 223 THR D CA 1 +ATOM 18853 C C . THR D 1 223 ? 36.433 -20.625 48.172 1.00 37.44 ? 223 THR D C 1 +ATOM 18854 O O . THR D 1 223 ? 35.924 -19.903 47.300 1.00 36.79 ? 223 THR D O 1 +ATOM 18855 C CB . THR D 1 223 ? 36.118 -20.192 50.584 1.00 36.31 ? 223 THR D CB 1 +ATOM 18856 O OG1 . THR D 1 223 ? 34.817 -19.742 50.190 1.00 35.52 ? 223 THR D OG1 1 +ATOM 18857 C CG2 . THR D 1 223 ? 36.597 -19.405 51.806 1.00 34.09 ? 223 THR D CG2 1 +ATOM 18858 N N . TRP D 1 224 ? 36.454 -21.950 48.090 1.00 36.37 ? 224 TRP D N 1 +ATOM 18859 C CA . TRP D 1 224 ? 35.832 -22.632 46.974 1.00 34.95 ? 224 TRP D CA 1 +ATOM 18860 C C . TRP D 1 224 ? 34.723 -23.505 47.522 1.00 35.80 ? 224 TRP D C 1 +ATOM 18861 O O . TRP D 1 224 ? 34.900 -24.158 48.547 1.00 36.69 ? 224 TRP D O 1 +ATOM 18862 C CB . TRP D 1 224 ? 36.841 -23.501 46.232 1.00 32.96 ? 224 TRP D CB 1 +ATOM 18863 C CG . TRP D 1 224 ? 37.861 -22.741 45.464 1.00 31.82 ? 224 TRP D CG 1 +ATOM 18864 C CD1 . TRP D 1 224 ? 39.139 -22.477 45.847 1.00 32.21 ? 224 TRP D CD1 1 +ATOM 18865 C CD2 . TRP D 1 224 ? 37.710 -22.180 44.154 1.00 31.77 ? 224 TRP D CD2 1 +ATOM 18866 N NE1 . TRP D 1 224 ? 39.802 -21.797 44.856 1.00 32.34 ? 224 TRP D NE1 1 +ATOM 18867 C CE2 . TRP D 1 224 ? 38.948 -21.600 43.805 1.00 32.03 ? 224 TRP D CE2 1 +ATOM 18868 C CE3 . TRP D 1 224 ? 36.649 -22.113 43.241 1.00 32.62 ? 224 TRP D CE3 1 +ATOM 18869 C CZ2 . TRP D 1 224 ? 39.159 -20.958 42.580 1.00 33.53 ? 224 TRP D CZ2 1 +ATOM 18870 C CZ3 . TRP D 1 224 ? 36.854 -21.477 42.022 1.00 32.61 ? 224 TRP D CZ3 1 +ATOM 18871 C CH2 . TRP D 1 224 ? 38.103 -20.908 41.702 1.00 34.53 ? 224 TRP D CH2 1 +ATOM 18872 N N . HIS D 1 225 ? 33.579 -23.503 46.850 1.00 35.94 ? 225 HIS D N 1 +ATOM 18873 C CA . HIS D 1 225 ? 32.452 -24.313 47.276 1.00 37.36 ? 225 HIS D CA 1 +ATOM 18874 C C . HIS D 1 225 ? 32.916 -25.768 47.216 1.00 39.04 ? 225 HIS D C 1 +ATOM 18875 O O . HIS D 1 225 ? 33.309 -26.260 46.155 1.00 40.64 ? 225 HIS D O 1 +ATOM 18876 C CB . HIS D 1 225 ? 31.261 -24.073 46.341 1.00 36.81 ? 225 HIS D CB 1 +ATOM 18877 C CG . HIS D 1 225 ? 29.982 -24.666 46.832 1.00 35.40 ? 225 HIS D CG 1 +ATOM 18878 N ND1 . HIS D 1 225 ? 29.743 -26.022 46.825 1.00 37.33 ? 225 HIS D ND1 1 +ATOM 18879 C CD2 . HIS D 1 225 ? 28.877 -24.091 47.361 1.00 36.52 ? 225 HIS D CD2 1 +ATOM 18880 C CE1 . HIS D 1 225 ? 28.545 -26.259 47.329 1.00 36.47 ? 225 HIS D CE1 1 +ATOM 18881 N NE2 . HIS D 1 225 ? 27.997 -25.103 47.662 1.00 37.25 ? 225 HIS D NE2 1 +ATOM 18882 N N . PRO D 1 226 ? 32.880 -26.475 48.357 1.00 39.81 ? 226 PRO D N 1 +ATOM 18883 C CA . PRO D 1 226 ? 33.304 -27.876 48.460 1.00 40.40 ? 226 PRO D CA 1 +ATOM 18884 C C . PRO D 1 226 ? 32.613 -28.871 47.539 1.00 40.82 ? 226 PRO D C 1 +ATOM 18885 O O . PRO D 1 226 ? 33.171 -29.918 47.231 1.00 41.91 ? 226 PRO D O 1 +ATOM 18886 C CB . PRO D 1 226 ? 33.080 -28.197 49.942 1.00 39.13 ? 226 PRO D CB 1 +ATOM 18887 C CG . PRO D 1 226 ? 31.931 -27.313 50.303 1.00 38.99 ? 226 PRO D CG 1 +ATOM 18888 C CD . PRO D 1 226 ? 32.299 -26.014 49.632 1.00 39.91 ? 226 PRO D CD 1 +ATOM 18889 N N . TYR D 1 227 ? 31.409 -28.559 47.084 1.00 41.55 ? 227 TYR D N 1 +ATOM 18890 C CA . TYR D 1 227 ? 30.710 -29.497 46.218 1.00 41.75 ? 227 TYR D CA 1 +ATOM 18891 C C . TYR D 1 227 ? 30.705 -29.095 44.762 1.00 41.07 ? 227 TYR D C 1 +ATOM 18892 O O . TYR D 1 227 ? 30.799 -29.951 43.890 1.00 42.18 ? 227 TYR D O 1 +ATOM 18893 C CB . TYR D 1 227 ? 29.283 -29.710 46.726 1.00 45.60 ? 227 TYR D CB 1 +ATOM 18894 C CG . TYR D 1 227 ? 29.278 -30.328 48.103 1.00 50.41 ? 227 TYR D CG 1 +ATOM 18895 C CD1 . TYR D 1 227 ? 29.691 -31.645 48.293 1.00 52.15 ? 227 TYR D CD1 1 +ATOM 18896 C CD2 . TYR D 1 227 ? 28.950 -29.571 49.229 1.00 52.56 ? 227 TYR D CD2 1 +ATOM 18897 C CE1 . TYR D 1 227 ? 29.785 -32.194 49.565 1.00 55.13 ? 227 TYR D CE1 1 +ATOM 18898 C CE2 . TYR D 1 227 ? 29.042 -30.110 50.508 1.00 55.37 ? 227 TYR D CE2 1 +ATOM 18899 C CZ . TYR D 1 227 ? 29.462 -31.422 50.667 1.00 55.86 ? 227 TYR D CZ 1 +ATOM 18900 O OH . TYR D 1 227 ? 29.570 -31.960 51.928 1.00 58.52 ? 227 TYR D OH 1 +ATOM 18901 N N . ARG D 1 228 ? 30.613 -27.799 44.493 1.00 39.92 ? 228 ARG D N 1 +ATOM 18902 C CA . ARG D 1 228 ? 30.593 -27.308 43.124 1.00 37.76 ? 228 ARG D CA 1 +ATOM 18903 C C . ARG D 1 228 ? 32.000 -27.143 42.583 1.00 38.11 ? 228 ARG D C 1 +ATOM 18904 O O . ARG D 1 228 ? 32.243 -27.318 41.387 1.00 39.24 ? 228 ARG D O 1 +ATOM 18905 C CB . ARG D 1 228 ? 29.872 -25.962 43.064 1.00 37.25 ? 228 ARG D CB 1 +ATOM 18906 C CG . ARG D 1 228 ? 28.436 -25.996 43.565 1.00 35.59 ? 228 ARG D CG 1 +ATOM 18907 C CD . ARG D 1 228 ? 27.935 -24.590 43.839 1.00 33.46 ? 228 ARG D CD 1 +ATOM 18908 N NE . ARG D 1 228 ? 26.550 -24.586 44.289 1.00 34.63 ? 228 ARG D NE 1 +ATOM 18909 C CZ . ARG D 1 228 ? 25.986 -23.576 44.944 1.00 34.37 ? 228 ARG D CZ 1 +ATOM 18910 N NH1 . ARG D 1 228 ? 26.705 -22.500 45.230 1.00 33.24 ? 228 ARG D NH1 1 +ATOM 18911 N NH2 . ARG D 1 228 ? 24.697 -23.623 45.278 1.00 32.43 ? 228 ARG D NH2 1 +ATOM 18912 N N . PHE D 1 229 ? 32.931 -26.785 43.460 1.00 39.02 ? 229 PHE D N 1 +ATOM 18913 C CA . PHE D 1 229 ? 34.312 -26.583 43.038 1.00 38.84 ? 229 PHE D CA 1 +ATOM 18914 C C . PHE D 1 229 ? 35.329 -27.321 43.905 1.00 40.34 ? 229 PHE D C 1 +ATOM 18915 O O . PHE D 1 229 ? 36.265 -26.720 44.430 1.00 39.90 ? 229 PHE D O 1 +ATOM 18916 C CB . PHE D 1 229 ? 34.642 -25.081 43.002 1.00 36.71 ? 229 PHE D CB 1 +ATOM 18917 C CG . PHE D 1 229 ? 33.889 -24.316 41.937 1.00 32.30 ? 229 PHE D CG 1 +ATOM 18918 C CD1 . PHE D 1 229 ? 32.602 -23.832 42.183 1.00 29.66 ? 229 PHE D CD1 1 +ATOM 18919 C CD2 . PHE D 1 229 ? 34.455 -24.116 40.677 1.00 29.48 ? 229 PHE D CD2 1 +ATOM 18920 C CE1 . PHE D 1 229 ? 31.886 -23.161 41.189 1.00 27.81 ? 229 PHE D CE1 1 +ATOM 18921 C CE2 . PHE D 1 229 ? 33.751 -23.449 39.676 1.00 30.30 ? 229 PHE D CE2 1 +ATOM 18922 C CZ . PHE D 1 229 ? 32.458 -22.969 39.934 1.00 28.34 ? 229 PHE D CZ 1 +ATOM 18923 N N . PRO D 1 230 ? 35.164 -28.647 44.043 1.00 41.75 ? 230 PRO D N 1 +ATOM 18924 C CA . PRO D 1 230 ? 36.051 -29.498 44.838 1.00 41.66 ? 230 PRO D CA 1 +ATOM 18925 C C . PRO D 1 230 ? 37.483 -29.566 44.313 1.00 42.08 ? 230 PRO D C 1 +ATOM 18926 O O . PRO D 1 230 ? 38.410 -29.851 45.064 1.00 42.62 ? 230 PRO D O 1 +ATOM 18927 C CB . PRO D 1 230 ? 35.364 -30.858 44.768 1.00 41.45 ? 230 PRO D CB 1 +ATOM 18928 C CG . PRO D 1 230 ? 34.768 -30.847 43.398 1.00 40.95 ? 230 PRO D CG 1 +ATOM 18929 C CD . PRO D 1 230 ? 34.153 -29.469 43.348 1.00 41.23 ? 230 PRO D CD 1 +ATOM 18930 N N . GLU D 1 231 ? 37.664 -29.299 43.026 1.00 42.87 ? 231 GLU D N 1 +ATOM 18931 C CA . GLU D 1 231 ? 38.991 -29.379 42.429 1.00 43.10 ? 231 GLU D CA 1 +ATOM 18932 C C . GLU D 1 231 ? 39.388 -28.155 41.635 1.00 42.12 ? 231 GLU D C 1 +ATOM 18933 O O . GLU D 1 231 ? 39.544 -28.212 40.414 1.00 41.12 ? 231 GLU D O 1 +ATOM 18934 C CB . GLU D 1 231 ? 39.067 -30.601 41.529 1.00 45.71 ? 231 GLU D CB 1 +ATOM 18935 C CG . GLU D 1 231 ? 38.893 -31.890 42.276 1.00 52.49 ? 231 GLU D CG 1 +ATOM 18936 C CD . GLU D 1 231 ? 38.847 -33.087 41.353 1.00 58.05 ? 231 GLU D CD 1 +ATOM 18937 O OE1 . GLU D 1 231 ? 39.812 -33.275 40.564 1.00 60.61 ? 231 GLU D OE1 1 +ATOM 18938 O OE2 . GLU D 1 231 ? 37.843 -33.839 41.422 1.00 59.97 ? 231 GLU D OE2 1 +ATOM 18939 N N . PRO D 1 232 ? 39.585 -27.028 42.326 1.00 42.57 ? 232 PRO D N 1 +ATOM 18940 C CA . PRO D 1 232 ? 39.969 -25.772 41.677 1.00 42.61 ? 232 PRO D CA 1 +ATOM 18941 C C . PRO D 1 232 ? 41.198 -25.862 40.774 1.00 44.65 ? 232 PRO D C 1 +ATOM 18942 O O . PRO D 1 232 ? 41.269 -25.176 39.746 1.00 46.15 ? 232 PRO D O 1 +ATOM 18943 C CB . PRO D 1 232 ? 40.152 -24.810 42.853 1.00 41.47 ? 232 PRO D CB 1 +ATOM 18944 C CG . PRO D 1 232 ? 40.415 -25.715 44.020 1.00 42.10 ? 232 PRO D CG 1 +ATOM 18945 C CD . PRO D 1 232 ? 39.484 -26.865 43.785 1.00 41.84 ? 232 PRO D CD 1 +ATOM 18946 N N . LYS D 1 233 ? 42.157 -26.708 41.133 1.00 45.50 ? 233 LYS D N 1 +ATOM 18947 C CA . LYS D 1 233 ? 43.352 -26.837 40.310 1.00 46.62 ? 233 LYS D CA 1 +ATOM 18948 C C . LYS D 1 233 ? 42.989 -27.455 38.958 1.00 45.89 ? 233 LYS D C 1 +ATOM 18949 O O . LYS D 1 233 ? 43.459 -27.010 37.910 1.00 44.71 ? 233 LYS D O 1 +ATOM 18950 C CB . LYS D 1 233 ? 44.404 -27.694 41.014 1.00 49.15 ? 233 LYS D CB 1 +ATOM 18951 C CG . LYS D 1 233 ? 45.790 -27.572 40.373 1.00 54.17 ? 233 LYS D CG 1 +ATOM 18952 C CD . LYS D 1 233 ? 46.837 -28.483 41.031 1.00 56.49 ? 233 LYS D CD 1 +ATOM 18953 C CE . LYS D 1 233 ? 48.215 -28.265 40.413 1.00 58.00 ? 233 LYS D CE 1 +ATOM 18954 N NZ . LYS D 1 233 ? 48.194 -28.373 38.921 1.00 57.14 ? 233 LYS D NZ 1 +ATOM 18955 N N . LYS D 1 234 ? 42.138 -28.476 38.989 1.00 45.68 ? 234 LYS D N 1 +ATOM 18956 C CA . LYS D 1 234 ? 41.703 -29.145 37.771 1.00 45.43 ? 234 LYS D CA 1 +ATOM 18957 C C . LYS D 1 234 ? 41.004 -28.133 36.868 1.00 45.29 ? 234 LYS D C 1 +ATOM 18958 O O . LYS D 1 234 ? 41.306 -28.039 35.679 1.00 43.74 ? 234 LYS D O 1 +ATOM 18959 C CB . LYS D 1 234 ? 40.748 -30.289 38.112 1.00 46.53 ? 234 LYS D CB 1 +ATOM 18960 C CG . LYS D 1 234 ? 40.313 -31.106 36.916 1.00 48.22 ? 234 LYS D CG 1 +ATOM 18961 C CD . LYS D 1 234 ? 39.483 -32.299 37.347 1.00 52.01 ? 234 LYS D CD 1 +ATOM 18962 C CE . LYS D 1 234 ? 39.245 -33.255 36.192 1.00 54.33 ? 234 LYS D CE 1 +ATOM 18963 N NZ . LYS D 1 234 ? 38.506 -34.472 36.641 1.00 56.60 ? 234 LYS D NZ 1 +ATOM 18964 N N . LEU D 1 235 ? 40.074 -27.371 37.445 1.00 45.20 ? 235 LEU D N 1 +ATOM 18965 C CA . LEU D 1 235 ? 39.347 -26.360 36.690 1.00 43.73 ? 235 LEU D CA 1 +ATOM 18966 C C . LEU D 1 235 ? 40.299 -25.374 36.046 1.00 44.05 ? 235 LEU D C 1 +ATOM 18967 O O . LEU D 1 235 ? 40.195 -25.077 34.855 1.00 44.35 ? 235 LEU D O 1 +ATOM 18968 C CB . LEU D 1 235 ? 38.396 -25.578 37.596 1.00 43.50 ? 235 LEU D CB 1 +ATOM 18969 C CG . LEU D 1 235 ? 37.792 -24.326 36.931 1.00 41.90 ? 235 LEU D CG 1 +ATOM 18970 C CD1 . LEU D 1 235 ? 36.837 -24.743 35.814 1.00 40.52 ? 235 LEU D CD1 1 +ATOM 18971 C CD2 . LEU D 1 235 ? 37.078 -23.482 37.967 1.00 40.13 ? 235 LEU D CD2 1 +ATOM 18972 N N . ILE D 1 236 ? 41.230 -24.863 36.841 1.00 43.87 ? 236 ILE D N 1 +ATOM 18973 C CA . ILE D 1 236 ? 42.167 -23.880 36.334 1.00 44.51 ? 236 ILE D CA 1 +ATOM 18974 C C . ILE D 1 236 ? 43.043 -24.389 35.198 1.00 45.45 ? 236 ILE D C 1 +ATOM 18975 O O . ILE D 1 236 ? 43.239 -23.695 34.201 1.00 46.27 ? 236 ILE D O 1 +ATOM 18976 C CB . ILE D 1 236 ? 43.047 -23.306 37.482 1.00 43.65 ? 236 ILE D CB 1 +ATOM 18977 C CG1 . ILE D 1 236 ? 42.169 -22.480 38.436 1.00 43.87 ? 236 ILE D CG1 1 +ATOM 18978 C CG2 . ILE D 1 236 ? 44.148 -22.425 36.913 1.00 41.17 ? 236 ILE D CG2 1 +ATOM 18979 C CD1 . ILE D 1 236 ? 42.865 -22.013 39.703 1.00 43.26 ? 236 ILE D CD1 1 +ATOM 18980 N N . ASP D 1 237 ? 43.555 -25.603 35.321 1.00 46.67 ? 237 ASP D N 1 +ATOM 18981 C CA . ASP D 1 237 ? 44.418 -26.114 34.269 1.00 47.49 ? 237 ASP D CA 1 +ATOM 18982 C C . ASP D 1 237 ? 43.667 -26.364 32.967 1.00 45.14 ? 237 ASP D C 1 +ATOM 18983 O O . ASP D 1 237 ? 44.202 -26.131 31.883 1.00 42.31 ? 237 ASP D O 1 +ATOM 18984 C CB . ASP D 1 237 ? 45.134 -27.380 34.748 1.00 51.47 ? 237 ASP D CB 1 +ATOM 18985 C CG . ASP D 1 237 ? 46.039 -27.112 35.959 1.00 57.44 ? 237 ASP D CG 1 +ATOM 18986 O OD1 . ASP D 1 237 ? 46.725 -26.056 35.986 1.00 59.67 ? 237 ASP D OD1 1 +ATOM 18987 O OD2 . ASP D 1 237 ? 46.072 -27.957 36.883 1.00 60.36 ? 237 ASP D OD2 1 +ATOM 18988 N N . GLU D 1 238 ? 42.420 -26.805 33.079 1.00 43.99 ? 238 GLU D N 1 +ATOM 18989 C CA . GLU D 1 238 ? 41.602 -27.086 31.904 1.00 44.19 ? 238 GLU D CA 1 +ATOM 18990 C C . GLU D 1 238 ? 41.297 -25.843 31.087 1.00 42.50 ? 238 GLU D C 1 +ATOM 18991 O O . GLU D 1 238 ? 41.324 -25.883 29.856 1.00 40.33 ? 238 GLU D O 1 +ATOM 18992 C CB . GLU D 1 238 ? 40.311 -27.777 32.326 1.00 45.40 ? 238 GLU D CB 1 +ATOM 18993 C CG . GLU D 1 238 ? 40.595 -29.090 33.011 1.00 50.60 ? 238 GLU D CG 1 +ATOM 18994 C CD . GLU D 1 238 ? 39.349 -29.828 33.424 1.00 53.25 ? 238 GLU D CD 1 +ATOM 18995 O OE1 . GLU D 1 238 ? 38.528 -29.242 34.164 1.00 55.08 ? 238 GLU D OE1 1 +ATOM 18996 O OE2 . GLU D 1 238 ? 39.199 -31.000 33.012 1.00 55.95 ? 238 GLU D OE2 1 +ATOM 18997 N N . LEU D 1 239 ? 41.016 -24.739 31.773 1.00 41.58 ? 239 LEU D N 1 +ATOM 18998 C CA . LEU D 1 239 ? 40.733 -23.481 31.095 1.00 41.07 ? 239 LEU D CA 1 +ATOM 18999 C C . LEU D 1 239 ? 41.996 -22.945 30.449 1.00 40.59 ? 239 LEU D C 1 +ATOM 19000 O O . LEU D 1 239 ? 41.975 -22.494 29.299 1.00 40.70 ? 239 LEU D O 1 +ATOM 19001 C CB . LEU D 1 239 ? 40.186 -22.444 32.081 1.00 40.16 ? 239 LEU D CB 1 +ATOM 19002 C CG . LEU D 1 239 ? 38.781 -22.739 32.600 1.00 40.26 ? 239 LEU D CG 1 +ATOM 19003 C CD1 . LEU D 1 239 ? 38.440 -21.778 33.731 1.00 40.86 ? 239 LEU D CD1 1 +ATOM 19004 C CD2 . LEU D 1 239 ? 37.780 -22.623 31.447 1.00 39.49 ? 239 LEU D CD2 1 +ATOM 19005 N N . HIS D 1 240 ? 43.100 -22.987 31.187 1.00 40.88 ? 240 HIS D N 1 +ATOM 19006 C CA . HIS D 1 240 ? 44.368 -22.497 30.655 1.00 41.41 ? 240 HIS D CA 1 +ATOM 19007 C C . HIS D 1 240 ? 44.800 -23.362 29.477 1.00 41.48 ? 240 HIS D C 1 +ATOM 19008 O O . HIS D 1 240 ? 45.412 -22.883 28.523 1.00 41.64 ? 240 HIS D O 1 +ATOM 19009 C CB . HIS D 1 240 ? 45.434 -22.490 31.752 1.00 40.63 ? 240 HIS D CB 1 +ATOM 19010 C CG . HIS D 1 240 ? 45.261 -21.385 32.749 1.00 43.05 ? 240 HIS D CG 1 +ATOM 19011 N ND1 . HIS D 1 240 ? 46.060 -21.254 33.865 1.00 43.43 ? 240 HIS D ND1 1 +ATOM 19012 C CD2 . HIS D 1 240 ? 44.389 -20.349 32.788 1.00 42.58 ? 240 HIS D CD2 1 +ATOM 19013 C CE1 . HIS D 1 240 ? 45.689 -20.185 34.547 1.00 42.81 ? 240 HIS D CE1 1 +ATOM 19014 N NE2 . HIS D 1 240 ? 44.677 -19.618 33.914 1.00 44.14 ? 240 HIS D NE2 1 +ATOM 19015 N N . LYS D 1 241 ? 44.457 -24.639 29.550 1.00 42.44 ? 241 LYS D N 1 +ATOM 19016 C CA . LYS D 1 241 ? 44.774 -25.593 28.493 1.00 44.44 ? 241 LYS D CA 1 +ATOM 19017 C C . LYS D 1 241 ? 44.050 -25.172 27.211 1.00 43.81 ? 241 LYS D C 1 +ATOM 19018 O O . LYS D 1 241 ? 44.503 -25.454 26.104 1.00 42.99 ? 241 LYS D O 1 +ATOM 19019 C CB . LYS D 1 241 ? 44.327 -26.990 28.932 1.00 46.39 ? 241 LYS D CB 1 +ATOM 19020 C CG . LYS D 1 241 ? 44.727 -28.126 28.020 1.00 50.80 ? 241 LYS D CG 1 +ATOM 19021 C CD . LYS D 1 241 ? 44.452 -29.476 28.685 1.00 54.88 ? 241 LYS D CD 1 +ATOM 19022 C CE . LYS D 1 241 ? 43.007 -29.583 29.173 1.00 56.95 ? 241 LYS D CE 1 +ATOM 19023 N NZ . LYS D 1 241 ? 42.755 -30.868 29.896 1.00 60.80 ? 241 LYS D NZ 1 +ATOM 19024 N N . ARG D 1 242 ? 42.925 -24.482 27.379 1.00 44.03 ? 242 ARG D N 1 +ATOM 19025 C CA . ARG D 1 242 ? 42.122 -23.998 26.262 1.00 42.40 ? 242 ARG D CA 1 +ATOM 19026 C C . ARG D 1 242 ? 42.354 -22.503 26.023 1.00 42.21 ? 242 ARG D C 1 +ATOM 19027 O O . ARG D 1 242 ? 41.577 -21.847 25.343 1.00 41.62 ? 242 ARG D O 1 +ATOM 19028 C CB . ARG D 1 242 ? 40.646 -24.261 26.542 1.00 41.33 ? 242 ARG D CB 1 +ATOM 19029 C CG . ARG D 1 242 ? 40.314 -25.737 26.691 1.00 42.32 ? 242 ARG D CG 1 +ATOM 19030 C CD . ARG D 1 242 ? 38.917 -25.911 27.255 1.00 44.13 ? 242 ARG D CD 1 +ATOM 19031 N NE . ARG D 1 242 ? 38.448 -27.297 27.255 1.00 44.69 ? 242 ARG D NE 1 +ATOM 19032 C CZ . ARG D 1 242 ? 38.991 -28.281 27.962 1.00 44.92 ? 242 ARG D CZ 1 +ATOM 19033 N NH1 . ARG D 1 242 ? 40.044 -28.051 28.735 1.00 47.66 ? 242 ARG D NH1 1 +ATOM 19034 N NH2 . ARG D 1 242 ? 38.459 -29.493 27.920 1.00 44.37 ? 242 ARG D NH2 1 +ATOM 19035 N N . ASN D 1 243 ? 43.430 -21.970 26.593 1.00 42.76 ? 243 ASN D N 1 +ATOM 19036 C CA . ASN D 1 243 ? 43.773 -20.566 26.432 1.00 42.16 ? 243 ASN D CA 1 +ATOM 19037 C C . ASN D 1 243 ? 42.649 -19.616 26.838 1.00 40.21 ? 243 ASN D C 1 +ATOM 19038 O O . ASN D 1 243 ? 42.415 -18.599 26.179 1.00 38.92 ? 243 ASN D O 1 +ATOM 19039 C CB . ASN D 1 243 ? 44.189 -20.308 24.988 1.00 45.37 ? 243 ASN D CB 1 +ATOM 19040 C CG . ASN D 1 243 ? 45.453 -21.062 24.612 1.00 51.07 ? 243 ASN D CG 1 +ATOM 19041 O OD1 . ASN D 1 243 ? 46.543 -20.765 25.116 1.00 53.21 ? 243 ASN D OD1 1 +ATOM 19042 N ND2 . ASN D 1 243 ? 45.315 -22.058 23.731 1.00 53.31 ? 243 ASN D ND2 1 +ATOM 19043 N N . VAL D 1 244 ? 41.968 -19.959 27.932 1.00 37.92 ? 244 VAL D N 1 +ATOM 19044 C CA . VAL D 1 244 ? 40.877 -19.152 28.464 1.00 34.88 ? 244 VAL D CA 1 +ATOM 19045 C C . VAL D 1 244 ? 41.241 -18.665 29.860 1.00 34.87 ? 244 VAL D C 1 +ATOM 19046 O O . VAL D 1 244 ? 41.608 -19.458 30.725 1.00 35.75 ? 244 VAL D O 1 +ATOM 19047 C CB . VAL D 1 244 ? 39.577 -19.970 28.536 1.00 33.33 ? 244 VAL D CB 1 +ATOM 19048 C CG1 . VAL D 1 244 ? 38.506 -19.196 29.274 1.00 32.27 ? 244 VAL D CG1 1 +ATOM 19049 C CG2 . VAL D 1 244 ? 39.111 -20.301 27.119 1.00 33.87 ? 244 VAL D CG2 1 +ATOM 19050 N N . LYS D 1 245 ? 41.156 -17.359 30.073 1.00 34.15 ? 245 LYS D N 1 +ATOM 19051 C CA . LYS D 1 245 ? 41.465 -16.780 31.377 1.00 34.79 ? 245 LYS D CA 1 +ATOM 19052 C C . LYS D 1 245 ? 40.317 -17.012 32.362 1.00 35.48 ? 245 LYS D C 1 +ATOM 19053 O O . LYS D 1 245 ? 39.164 -17.239 31.962 1.00 35.10 ? 245 LYS D O 1 +ATOM 19054 C CB . LYS D 1 245 ? 41.702 -15.280 31.243 1.00 35.23 ? 245 LYS D CB 1 +ATOM 19055 C CG . LYS D 1 245 ? 42.760 -14.913 30.240 1.00 36.27 ? 245 LYS D CG 1 +ATOM 19056 C CD . LYS D 1 245 ? 44.113 -15.388 30.687 1.00 38.56 ? 245 LYS D CD 1 +ATOM 19057 C CE . LYS D 1 245 ? 45.144 -15.140 29.604 1.00 39.92 ? 245 LYS D CE 1 +ATOM 19058 N NZ . LYS D 1 245 ? 46.506 -15.485 30.062 1.00 41.83 ? 245 LYS D NZ 1 +ATOM 19059 N N . LEU D 1 246 ? 40.638 -16.961 33.652 1.00 35.16 ? 246 LEU D N 1 +ATOM 19060 C CA . LEU D 1 246 ? 39.633 -17.137 34.693 1.00 34.78 ? 246 LEU D CA 1 +ATOM 19061 C C . LEU D 1 246 ? 39.607 -15.897 35.572 1.00 35.34 ? 246 LEU D C 1 +ATOM 19062 O O . LEU D 1 246 ? 40.622 -15.520 36.163 1.00 36.18 ? 246 LEU D O 1 +ATOM 19063 C CB . LEU D 1 246 ? 39.946 -18.357 35.559 1.00 35.75 ? 246 LEU D CB 1 +ATOM 19064 C CG . LEU D 1 246 ? 39.001 -18.546 36.754 1.00 37.04 ? 246 LEU D CG 1 +ATOM 19065 C CD1 . LEU D 1 246 ? 37.587 -18.834 36.259 1.00 36.77 ? 246 LEU D CD1 1 +ATOM 19066 C CD2 . LEU D 1 246 ? 39.499 -19.690 37.637 1.00 36.31 ? 246 LEU D CD2 1 +ATOM 19067 N N . ILE D 1 247 ? 38.451 -15.243 35.631 1.00 34.46 ? 247 ILE D N 1 +ATOM 19068 C CA . ILE D 1 247 ? 38.296 -14.052 36.454 1.00 32.30 ? 247 ILE D CA 1 +ATOM 19069 C C . ILE D 1 247 ? 37.296 -14.409 37.552 1.00 32.25 ? 247 ILE D C 1 +ATOM 19070 O O . ILE D 1 247 ? 36.225 -14.945 37.268 1.00 31.35 ? 247 ILE D O 1 +ATOM 19071 C CB . ILE D 1 247 ? 37.767 -12.845 35.626 1.00 30.78 ? 247 ILE D CB 1 +ATOM 19072 C CG1 . ILE D 1 247 ? 38.781 -12.450 34.554 1.00 30.97 ? 247 ILE D CG1 1 +ATOM 19073 C CG2 . ILE D 1 247 ? 37.521 -11.660 36.524 1.00 27.89 ? 247 ILE D CG2 1 +ATOM 19074 C CD1 . ILE D 1 247 ? 38.691 -13.279 33.294 1.00 32.87 ? 247 ILE D CD1 1 +ATOM 19075 N N . THR D 1 248 ? 37.652 -14.126 38.799 1.00 30.50 ? 248 THR D N 1 +ATOM 19076 C CA . THR D 1 248 ? 36.776 -14.443 39.915 1.00 31.48 ? 248 THR D CA 1 +ATOM 19077 C C . THR D 1 248 ? 36.275 -13.194 40.627 1.00 31.86 ? 248 THR D C 1 +ATOM 19078 O O . THR D 1 248 ? 37.027 -12.251 40.863 1.00 31.46 ? 248 THR D O 1 +ATOM 19079 C CB . THR D 1 248 ? 37.490 -15.348 40.958 1.00 32.56 ? 248 THR D CB 1 +ATOM 19080 O OG1 . THR D 1 248 ? 38.661 -14.684 41.457 1.00 31.23 ? 248 THR D OG1 1 +ATOM 19081 C CG2 . THR D 1 248 ? 37.891 -16.676 40.324 1.00 32.59 ? 248 THR D CG2 1 +ATOM 19082 N N . ILE D 1 249 ? 34.994 -13.201 40.976 1.00 32.37 ? 249 ILE D N 1 +ATOM 19083 C CA . ILE D 1 249 ? 34.404 -12.075 41.658 1.00 32.43 ? 249 ILE D CA 1 +ATOM 19084 C C . ILE D 1 249 ? 34.864 -12.078 43.110 1.00 33.45 ? 249 ILE D C 1 +ATOM 19085 O O . ILE D 1 249 ? 35.074 -13.127 43.711 1.00 32.29 ? 249 ILE D O 1 +ATOM 19086 C CB . ILE D 1 249 ? 32.877 -12.137 41.589 1.00 31.96 ? 249 ILE D CB 1 +ATOM 19087 C CG1 . ILE D 1 249 ? 32.287 -10.785 41.997 1.00 32.93 ? 249 ILE D CG1 1 +ATOM 19088 C CG2 . ILE D 1 249 ? 32.353 -13.259 42.483 1.00 30.68 ? 249 ILE D CG2 1 +ATOM 19089 C CD1 . ILE D 1 249 ? 30.779 -10.697 41.770 1.00 33.61 ? 249 ILE D CD1 1 +ATOM 19090 N N . VAL D 1 250 ? 35.037 -10.886 43.662 1.00 34.92 ? 250 VAL D N 1 +ATOM 19091 C CA . VAL D 1 250 ? 35.467 -10.727 45.041 1.00 36.28 ? 250 VAL D CA 1 +ATOM 19092 C C . VAL D 1 250 ? 34.692 -9.559 45.629 1.00 36.94 ? 250 VAL D C 1 +ATOM 19093 O O . VAL D 1 250 ? 34.852 -8.420 45.197 1.00 37.65 ? 250 VAL D O 1 +ATOM 19094 C CB . VAL D 1 250 ? 36.986 -10.416 45.123 1.00 37.41 ? 250 VAL D CB 1 +ATOM 19095 C CG1 . VAL D 1 250 ? 37.390 -10.132 46.574 1.00 37.95 ? 250 VAL D CG1 1 +ATOM 19096 C CG2 . VAL D 1 250 ? 37.786 -11.592 44.565 1.00 36.75 ? 250 VAL D CG2 1 +ATOM 19097 N N . ASP D 1 251 ? 33.832 -9.836 46.597 1.00 38.25 ? 251 ASP D N 1 +ATOM 19098 C CA . ASP D 1 251 ? 33.069 -8.769 47.214 1.00 39.97 ? 251 ASP D CA 1 +ATOM 19099 C C . ASP D 1 251 ? 33.933 -8.126 48.296 1.00 41.28 ? 251 ASP D C 1 +ATOM 19100 O O . ASP D 1 251 ? 35.104 -8.475 48.453 1.00 40.80 ? 251 ASP D O 1 +ATOM 19101 C CB . ASP D 1 251 ? 31.771 -9.316 47.802 1.00 40.67 ? 251 ASP D CB 1 +ATOM 19102 C CG . ASP D 1 251 ? 30.910 -9.992 46.758 1.00 43.19 ? 251 ASP D CG 1 +ATOM 19103 O OD1 . ASP D 1 251 ? 30.471 -9.312 45.806 1.00 43.65 ? 251 ASP D OD1 1 +ATOM 19104 O OD2 . ASP D 1 251 ? 30.676 -11.213 46.883 1.00 46.22 ? 251 ASP D OD2 1 +ATOM 19105 N N . HIS D 1 252 ? 33.351 -7.195 49.043 1.00 41.15 ? 252 HIS D N 1 +ATOM 19106 C CA . HIS D 1 252 ? 34.080 -6.486 50.081 1.00 40.91 ? 252 HIS D CA 1 +ATOM 19107 C C . HIS D 1 252 ? 33.652 -6.902 51.487 1.00 40.18 ? 252 HIS D C 1 +ATOM 19108 O O . HIS D 1 252 ? 34.189 -6.408 52.469 1.00 42.14 ? 252 HIS D O 1 +ATOM 19109 C CB . HIS D 1 252 ? 33.863 -4.978 49.895 1.00 41.40 ? 252 HIS D CB 1 +ATOM 19110 C CG . HIS D 1 252 ? 32.436 -4.555 50.061 1.00 42.18 ? 252 HIS D CG 1 +ATOM 19111 N ND1 . HIS D 1 252 ? 31.382 -5.274 49.534 1.00 43.37 ? 252 HIS D ND1 1 +ATOM 19112 C CD2 . HIS D 1 252 ? 31.884 -3.510 50.724 1.00 43.24 ? 252 HIS D CD2 1 +ATOM 19113 C CE1 . HIS D 1 252 ? 30.243 -4.693 49.870 1.00 42.58 ? 252 HIS D CE1 1 +ATOM 19114 N NE2 . HIS D 1 252 ? 30.519 -3.621 50.591 1.00 42.50 ? 252 HIS D NE2 1 +ATOM 19115 N N . GLY D 1 253 ? 32.691 -7.813 51.583 1.00 38.83 ? 253 GLY D N 1 +ATOM 19116 C CA . GLY D 1 253 ? 32.218 -8.221 52.888 1.00 37.34 ? 253 GLY D CA 1 +ATOM 19117 C C . GLY D 1 253 ? 32.909 -9.428 53.483 1.00 36.41 ? 253 GLY D C 1 +ATOM 19118 O O . GLY D 1 253 ? 32.989 -10.475 52.848 1.00 35.21 ? 253 GLY D O 1 +ATOM 19119 N N . ILE D 1 254 ? 33.396 -9.275 54.714 1.00 35.78 ? 254 ILE D N 1 +ATOM 19120 C CA . ILE D 1 254 ? 34.071 -10.348 55.432 1.00 32.81 ? 254 ILE D CA 1 +ATOM 19121 C C . ILE D 1 254 ? 33.087 -10.927 56.442 1.00 33.94 ? 254 ILE D C 1 +ATOM 19122 O O . ILE D 1 254 ? 32.594 -10.230 57.334 1.00 33.53 ? 254 ILE D O 1 +ATOM 19123 C CB . ILE D 1 254 ? 35.305 -9.823 56.175 1.00 33.23 ? 254 ILE D CB 1 +ATOM 19124 C CG1 . ILE D 1 254 ? 36.321 -9.255 55.174 1.00 32.10 ? 254 ILE D CG1 1 +ATOM 19125 C CG2 . ILE D 1 254 ? 35.911 -10.933 57.007 1.00 32.40 ? 254 ILE D CG2 1 +ATOM 19126 C CD1 . ILE D 1 254 ? 36.905 -10.281 54.245 1.00 29.79 ? 254 ILE D CD1 1 +ATOM 19127 N N . ARG D 1 255 ? 32.796 -12.211 56.296 1.00 33.75 ? 255 ARG D N 1 +ATOM 19128 C CA . ARG D 1 255 ? 31.856 -12.874 57.180 1.00 33.87 ? 255 ARG D CA 1 +ATOM 19129 C C . ARG D 1 255 ? 32.314 -12.932 58.640 1.00 34.36 ? 255 ARG D C 1 +ATOM 19130 O O . ARG D 1 255 ? 33.443 -13.330 58.935 1.00 32.81 ? 255 ARG D O 1 +ATOM 19131 C CB . ARG D 1 255 ? 31.583 -14.285 56.661 1.00 33.36 ? 255 ARG D CB 1 +ATOM 19132 C CG . ARG D 1 255 ? 30.544 -15.041 57.452 1.00 33.73 ? 255 ARG D CG 1 +ATOM 19133 C CD . ARG D 1 255 ? 29.912 -16.134 56.604 1.00 35.97 ? 255 ARG D CD 1 +ATOM 19134 N NE . ARG D 1 255 ? 29.958 -17.426 57.278 1.00 40.45 ? 255 ARG D NE 1 +ATOM 19135 C CZ . ARG D 1 255 ? 28.912 -18.230 57.428 1.00 40.75 ? 255 ARG D CZ 1 +ATOM 19136 N NH1 . ARG D 1 255 ? 27.730 -17.883 56.951 1.00 38.40 ? 255 ARG D NH1 1 +ATOM 19137 N NH2 . ARG D 1 255 ? 29.051 -19.383 58.068 1.00 43.43 ? 255 ARG D NH2 1 +ATOM 19138 N N . VAL D 1 256 ? 31.429 -12.528 59.550 1.00 34.03 ? 256 VAL D N 1 +ATOM 19139 C CA . VAL D 1 256 ? 31.730 -12.561 60.973 1.00 33.71 ? 256 VAL D CA 1 +ATOM 19140 C C . VAL D 1 256 ? 31.580 -14.017 61.373 1.00 35.36 ? 256 VAL D C 1 +ATOM 19141 O O . VAL D 1 256 ? 30.542 -14.443 61.886 1.00 36.42 ? 256 VAL D O 1 +ATOM 19142 C CB . VAL D 1 256 ? 30.754 -11.674 61.764 1.00 31.72 ? 256 VAL D CB 1 +ATOM 19143 C CG1 . VAL D 1 256 ? 31.050 -11.758 63.258 1.00 28.47 ? 256 VAL D CG1 1 +ATOM 19144 C CG2 . VAL D 1 256 ? 30.882 -10.235 61.271 1.00 31.05 ? 256 VAL D CG2 1 +ATOM 19145 N N . ASP D 1 257 ? 32.644 -14.769 61.118 1.00 35.97 ? 257 ASP D N 1 +ATOM 19146 C CA . ASP D 1 257 ? 32.697 -16.201 61.377 1.00 37.22 ? 257 ASP D CA 1 +ATOM 19147 C C . ASP D 1 257 ? 33.923 -16.529 62.236 1.00 37.84 ? 257 ASP D C 1 +ATOM 19148 O O . ASP D 1 257 ? 35.055 -16.242 61.852 1.00 38.66 ? 257 ASP D O 1 +ATOM 19149 C CB . ASP D 1 257 ? 32.789 -16.918 60.030 1.00 39.15 ? 257 ASP D CB 1 +ATOM 19150 C CG . ASP D 1 257 ? 32.640 -18.412 60.143 1.00 42.90 ? 257 ASP D CG 1 +ATOM 19151 O OD1 . ASP D 1 257 ? 33.274 -19.017 61.036 1.00 46.39 ? 257 ASP D OD1 1 +ATOM 19152 O OD2 . ASP D 1 257 ? 31.890 -18.985 59.321 1.00 44.63 ? 257 ASP D OD2 1 +ATOM 19153 N N . GLN D 1 258 ? 33.682 -17.134 63.392 1.00 38.62 ? 258 GLN D N 1 +ATOM 19154 C CA . GLN D 1 258 ? 34.725 -17.506 64.350 1.00 39.19 ? 258 GLN D CA 1 +ATOM 19155 C C . GLN D 1 258 ? 35.843 -18.383 63.803 1.00 40.50 ? 258 GLN D C 1 +ATOM 19156 O O . GLN D 1 258 ? 36.958 -18.377 64.321 1.00 40.22 ? 258 GLN D O 1 +ATOM 19157 C CB . GLN D 1 258 ? 34.088 -18.238 65.517 1.00 37.75 ? 258 GLN D CB 1 +ATOM 19158 C CG . GLN D 1 258 ? 33.983 -17.417 66.746 1.00 37.12 ? 258 GLN D CG 1 +ATOM 19159 C CD . GLN D 1 258 ? 33.140 -18.085 67.800 1.00 34.68 ? 258 GLN D CD 1 +ATOM 19160 O OE1 . GLN D 1 258 ? 33.104 -17.631 68.941 1.00 37.85 ? 258 GLN D OE1 1 +ATOM 19161 N NE2 . GLN D 1 258 ? 32.449 -19.158 67.430 1.00 27.51 ? 258 GLN D NE2 1 +ATOM 19162 N N . ASN D 1 259 ? 35.537 -19.151 62.767 1.00 40.89 ? 259 ASN D N 1 +ATOM 19163 C CA . ASN D 1 259 ? 36.525 -20.046 62.189 1.00 42.92 ? 259 ASN D CA 1 +ATOM 19164 C C . ASN D 1 259 ? 36.876 -19.700 60.757 1.00 42.24 ? 259 ASN D C 1 +ATOM 19165 O O . ASN D 1 259 ? 37.377 -20.536 60.013 1.00 43.98 ? 259 ASN D O 1 +ATOM 19166 C CB . ASN D 1 259 ? 36.010 -21.480 62.273 1.00 44.98 ? 259 ASN D CB 1 +ATOM 19167 C CG . ASN D 1 259 ? 35.764 -21.908 63.698 1.00 47.37 ? 259 ASN D CG 1 +ATOM 19168 O OD1 . ASN D 1 259 ? 34.683 -22.391 64.034 1.00 48.38 ? 259 ASN D OD1 1 +ATOM 19169 N ND2 . ASN D 1 259 ? 36.770 -21.720 64.555 1.00 46.58 ? 259 ASN D ND2 1 +ATOM 19170 N N . TYR D 1 260 ? 36.616 -18.454 60.381 1.00 41.85 ? 260 TYR D N 1 +ATOM 19171 C CA . TYR D 1 260 ? 36.898 -17.979 59.039 1.00 39.09 ? 260 TYR D CA 1 +ATOM 19172 C C . TYR D 1 260 ? 38.184 -17.158 59.102 1.00 39.09 ? 260 TYR D C 1 +ATOM 19173 O O . TYR D 1 260 ? 38.229 -16.079 59.683 1.00 39.38 ? 260 TYR D O 1 +ATOM 19174 C CB . TYR D 1 260 ? 35.715 -17.143 58.549 1.00 37.17 ? 260 TYR D CB 1 +ATOM 19175 C CG . TYR D 1 260 ? 35.889 -16.541 57.180 1.00 36.29 ? 260 TYR D CG 1 +ATOM 19176 C CD1 . TYR D 1 260 ? 36.254 -17.327 56.089 1.00 36.26 ? 260 TYR D CD1 1 +ATOM 19177 C CD2 . TYR D 1 260 ? 35.670 -15.180 56.970 1.00 36.49 ? 260 TYR D CD2 1 +ATOM 19178 C CE1 . TYR D 1 260 ? 36.395 -16.775 54.824 1.00 36.90 ? 260 TYR D CE1 1 +ATOM 19179 C CE2 . TYR D 1 260 ? 35.809 -14.611 55.710 1.00 35.62 ? 260 TYR D CE2 1 +ATOM 19180 C CZ . TYR D 1 260 ? 36.170 -15.411 54.643 1.00 37.85 ? 260 TYR D CZ 1 +ATOM 19181 O OH . TYR D 1 260 ? 36.306 -14.843 53.397 1.00 38.56 ? 260 TYR D OH 1 +ATOM 19182 N N . SER D 1 261 ? 39.232 -17.692 58.495 1.00 39.27 ? 261 SER D N 1 +ATOM 19183 C CA . SER D 1 261 ? 40.546 -17.068 58.499 1.00 38.38 ? 261 SER D CA 1 +ATOM 19184 C C . SER D 1 261 ? 40.637 -15.565 58.218 1.00 38.22 ? 261 SER D C 1 +ATOM 19185 O O . SER D 1 261 ? 41.233 -14.828 58.998 1.00 38.46 ? 261 SER D O 1 +ATOM 19186 C CB . SER D 1 261 ? 41.452 -17.826 57.537 1.00 40.27 ? 261 SER D CB 1 +ATOM 19187 O OG . SER D 1 261 ? 42.749 -17.272 57.550 1.00 45.02 ? 261 SER D OG 1 +ATOM 19188 N N . PRO D 1 262 ? 40.058 -15.084 57.099 1.00 37.69 ? 262 PRO D N 1 +ATOM 19189 C CA . PRO D 1 262 ? 40.131 -13.650 56.795 1.00 35.11 ? 262 PRO D CA 1 +ATOM 19190 C C . PRO D 1 262 ? 39.585 -12.771 57.905 1.00 35.42 ? 262 PRO D C 1 +ATOM 19191 O O . PRO D 1 262 ? 40.089 -11.671 58.136 1.00 35.54 ? 262 PRO D O 1 +ATOM 19192 C CB . PRO D 1 262 ? 39.320 -13.528 55.512 1.00 35.74 ? 262 PRO D CB 1 +ATOM 19193 C CG . PRO D 1 262 ? 39.568 -14.842 54.842 1.00 35.04 ? 262 PRO D CG 1 +ATOM 19194 C CD . PRO D 1 262 ? 39.416 -15.816 55.994 1.00 37.04 ? 262 PRO D CD 1 +ATOM 19195 N N . PHE D 1 263 ? 38.555 -13.257 58.592 1.00 34.81 ? 263 PHE D N 1 +ATOM 19196 C CA . PHE D 1 263 ? 37.953 -12.501 59.683 1.00 34.98 ? 263 PHE D CA 1 +ATOM 19197 C C . PHE D 1 263 ? 38.952 -12.356 60.829 1.00 36.70 ? 263 PHE D C 1 +ATOM 19198 O O . PHE D 1 263 ? 39.130 -11.265 61.383 1.00 36.89 ? 263 PHE D O 1 +ATOM 19199 C CB . PHE D 1 263 ? 36.691 -13.205 60.183 1.00 32.78 ? 263 PHE D CB 1 +ATOM 19200 C CG . PHE D 1 263 ? 36.046 -12.530 61.367 1.00 33.74 ? 263 PHE D CG 1 +ATOM 19201 C CD1 . PHE D 1 263 ? 35.636 -11.200 61.295 1.00 31.83 ? 263 PHE D CD1 1 +ATOM 19202 C CD2 . PHE D 1 263 ? 35.833 -13.229 62.553 1.00 32.05 ? 263 PHE D CD2 1 +ATOM 19203 C CE1 . PHE D 1 263 ? 35.024 -10.582 62.388 1.00 32.87 ? 263 PHE D CE1 1 +ATOM 19204 C CE2 . PHE D 1 263 ? 35.221 -12.615 63.645 1.00 30.85 ? 263 PHE D CE2 1 +ATOM 19205 C CZ . PHE D 1 263 ? 34.816 -11.293 63.563 1.00 30.42 ? 263 PHE D CZ 1 +ATOM 19206 N N . LEU D 1 264 ? 39.601 -13.465 61.178 1.00 37.24 ? 264 LEU D N 1 +ATOM 19207 C CA . LEU D 1 264 ? 40.587 -13.484 62.250 1.00 37.12 ? 264 LEU D CA 1 +ATOM 19208 C C . LEU D 1 264 ? 41.856 -12.699 61.905 1.00 37.22 ? 264 LEU D C 1 +ATOM 19209 O O . LEU D 1 264 ? 42.360 -11.946 62.736 1.00 38.37 ? 264 LEU D O 1 +ATOM 19210 C CB . LEU D 1 264 ? 40.950 -14.927 62.592 1.00 36.84 ? 264 LEU D CB 1 +ATOM 19211 C CG . LEU D 1 264 ? 39.754 -15.809 62.950 1.00 36.70 ? 264 LEU D CG 1 +ATOM 19212 C CD1 . LEU D 1 264 ? 40.214 -17.251 63.169 1.00 35.76 ? 264 LEU D CD1 1 +ATOM 19213 C CD2 . LEU D 1 264 ? 39.077 -15.256 64.188 1.00 36.67 ? 264 LEU D CD2 1 +ATOM 19214 N N . SER D 1 265 ? 42.367 -12.852 60.686 1.00 37.72 ? 265 SER D N 1 +ATOM 19215 C CA . SER D 1 265 ? 43.583 -12.133 60.298 1.00 38.79 ? 265 SER D CA 1 +ATOM 19216 C C . SER D 1 265 ? 43.333 -10.651 59.997 1.00 39.39 ? 265 SER D C 1 +ATOM 19217 O O . SER D 1 265 ? 44.242 -9.822 60.129 1.00 39.85 ? 265 SER D O 1 +ATOM 19218 C CB . SER D 1 265 ? 44.237 -12.794 59.078 1.00 38.18 ? 265 SER D CB 1 +ATOM 19219 O OG . SER D 1 265 ? 43.527 -12.503 57.886 1.00 43.25 ? 265 SER D OG 1 +ATOM 19220 N N . GLY D 1 266 ? 42.111 -10.313 59.588 1.00 38.88 ? 266 GLY D N 1 +ATOM 19221 C CA . GLY D 1 266 ? 41.812 -8.924 59.283 1.00 37.31 ? 266 GLY D CA 1 +ATOM 19222 C C . GLY D 1 266 ? 41.482 -8.115 60.524 1.00 37.40 ? 266 GLY D C 1 +ATOM 19223 O O . GLY D 1 266 ? 41.430 -6.885 60.478 1.00 37.61 ? 266 GLY D O 1 +ATOM 19224 N N . MET D 1 267 ? 41.265 -8.803 61.641 1.00 37.18 ? 267 MET D N 1 +ATOM 19225 C CA . MET D 1 267 ? 40.916 -8.135 62.886 1.00 37.75 ? 267 MET D CA 1 +ATOM 19226 C C . MET D 1 267 ? 41.870 -6.981 63.178 1.00 37.24 ? 267 MET D C 1 +ATOM 19227 O O . MET D 1 267 ? 43.090 -7.129 63.124 1.00 38.27 ? 267 MET D O 1 +ATOM 19228 C CB . MET D 1 267 ? 40.914 -9.138 64.037 1.00 38.84 ? 267 MET D CB 1 +ATOM 19229 C CG . MET D 1 267 ? 40.181 -8.648 65.267 1.00 41.91 ? 267 MET D CG 1 +ATOM 19230 S SD . MET D 1 267 ? 38.450 -8.188 64.923 1.00 46.08 ? 267 MET D SD 1 +ATOM 19231 C CE . MET D 1 267 ? 37.705 -9.788 64.772 1.00 42.19 ? 267 MET D CE 1 +ATOM 19232 N N . GLY D 1 268 ? 41.296 -5.823 63.472 1.00 37.44 ? 268 GLY D N 1 +ATOM 19233 C CA . GLY D 1 268 ? 42.087 -4.641 63.744 1.00 34.86 ? 268 GLY D CA 1 +ATOM 19234 C C . GLY D 1 268 ? 42.079 -3.712 62.546 1.00 35.55 ? 268 GLY D C 1 +ATOM 19235 O O . GLY D 1 268 ? 42.340 -2.519 62.678 1.00 35.53 ? 268 GLY D O 1 +ATOM 19236 N N . LYS D 1 269 ? 41.752 -4.245 61.373 1.00 35.33 ? 269 LYS D N 1 +ATOM 19237 C CA . LYS D 1 269 ? 41.749 -3.434 60.161 1.00 36.67 ? 269 LYS D CA 1 +ATOM 19238 C C . LYS D 1 269 ? 40.369 -3.206 59.518 1.00 36.49 ? 269 LYS D C 1 +ATOM 19239 O O . LYS D 1 269 ? 40.270 -2.768 58.368 1.00 36.78 ? 269 LYS D O 1 +ATOM 19240 C CB . LYS D 1 269 ? 42.717 -4.065 59.158 1.00 39.11 ? 269 LYS D CB 1 +ATOM 19241 C CG . LYS D 1 269 ? 44.157 -4.099 59.672 1.00 39.94 ? 269 LYS D CG 1 +ATOM 19242 C CD . LYS D 1 269 ? 45.063 -4.956 58.814 1.00 42.05 ? 269 LYS D CD 1 +ATOM 19243 C CE . LYS D 1 269 ? 44.782 -6.423 59.018 1.00 42.46 ? 269 LYS D CE 1 +ATOM 19244 N NZ . LYS D 1 269 ? 45.045 -6.819 60.427 1.00 45.16 ? 269 LYS D NZ 1 +ATOM 19245 N N . PHE D 1 270 ? 39.310 -3.484 60.272 1.00 33.34 ? 270 PHE D N 1 +ATOM 19246 C CA . PHE D 1 270 ? 37.946 -3.309 59.793 1.00 32.78 ? 270 PHE D CA 1 +ATOM 19247 C C . PHE D 1 270 ? 37.356 -1.933 60.139 1.00 33.43 ? 270 PHE D C 1 +ATOM 19248 O O . PHE D 1 270 ? 37.848 -1.239 61.037 1.00 32.53 ? 270 PHE D O 1 +ATOM 19249 C CB . PHE D 1 270 ? 37.047 -4.391 60.386 1.00 30.36 ? 270 PHE D CB 1 +ATOM 19250 C CG . PHE D 1 270 ? 37.484 -5.791 60.060 1.00 29.74 ? 270 PHE D CG 1 +ATOM 19251 C CD1 . PHE D 1 270 ? 37.654 -6.197 58.741 1.00 30.57 ? 270 PHE D CD1 1 +ATOM 19252 C CD2 . PHE D 1 270 ? 37.701 -6.716 61.071 1.00 28.79 ? 270 PHE D CD2 1 +ATOM 19253 C CE1 . PHE D 1 270 ? 38.032 -7.508 58.436 1.00 29.46 ? 270 PHE D CE1 1 +ATOM 19254 C CE2 . PHE D 1 270 ? 38.075 -8.026 60.775 1.00 28.61 ? 270 PHE D CE2 1 +ATOM 19255 C CZ . PHE D 1 270 ? 38.240 -8.421 59.455 1.00 27.31 ? 270 PHE D CZ 1 +ATOM 19256 N N . CYS D 1 271 ? 36.294 -1.555 59.427 1.00 32.63 ? 271 CYS D N 1 +ATOM 19257 C CA . CYS D 1 271 ? 35.616 -0.279 59.657 1.00 34.02 ? 271 CYS D CA 1 +ATOM 19258 C C . CYS D 1 271 ? 34.915 -0.281 61.004 1.00 32.82 ? 271 CYS D C 1 +ATOM 19259 O O . CYS D 1 271 ? 34.417 -1.314 61.447 1.00 30.26 ? 271 CYS D O 1 +ATOM 19260 C CB . CYS D 1 271 ? 34.564 -0.025 58.580 1.00 36.53 ? 271 CYS D CB 1 +ATOM 19261 S SG . CYS D 1 271 ? 35.221 0.134 56.923 1.00 45.92 ? 271 CYS D SG 1 +ATOM 19262 N N . GLU D 1 272 ? 34.857 0.885 61.637 1.00 33.93 ? 272 GLU D N 1 +ATOM 19263 C CA . GLU D 1 272 ? 34.204 1.022 62.933 1.00 36.98 ? 272 GLU D CA 1 +ATOM 19264 C C . GLU D 1 272 ? 33.079 2.058 62.850 1.00 37.51 ? 272 GLU D C 1 +ATOM 19265 O O . GLU D 1 272 ? 32.855 2.676 61.806 1.00 37.49 ? 272 GLU D O 1 +ATOM 19266 C CB . GLU D 1 272 ? 35.210 1.486 63.998 1.00 38.05 ? 272 GLU D CB 1 +ATOM 19267 C CG . GLU D 1 272 ? 36.446 0.628 64.125 1.00 43.61 ? 272 GLU D CG 1 +ATOM 19268 C CD . GLU D 1 272 ? 37.462 1.196 65.122 1.00 48.66 ? 272 GLU D CD 1 +ATOM 19269 O OE1 . GLU D 1 272 ? 37.521 2.444 65.289 1.00 50.07 ? 272 GLU D OE1 1 +ATOM 19270 O OE2 . GLU D 1 272 ? 38.215 0.393 65.724 1.00 49.80 ? 272 GLU D OE2 1 +ATOM 19271 N N . ILE D 1 273 ? 32.367 2.236 63.955 1.00 36.98 ? 273 ILE D N 1 +ATOM 19272 C CA . ILE D 1 273 ? 31.321 3.238 64.011 1.00 38.98 ? 273 ILE D CA 1 +ATOM 19273 C C . ILE D 1 273 ? 31.758 4.269 65.051 1.00 39.86 ? 273 ILE D C 1 +ATOM 19274 O O . ILE D 1 273 ? 32.644 4.003 65.849 1.00 41.07 ? 273 ILE D O 1 +ATOM 19275 C CB . ILE D 1 273 ? 29.956 2.633 64.404 1.00 37.54 ? 273 ILE D CB 1 +ATOM 19276 C CG1 . ILE D 1 273 ? 30.081 1.853 65.706 1.00 36.98 ? 273 ILE D CG1 1 +ATOM 19277 C CG2 . ILE D 1 273 ? 29.451 1.721 63.288 1.00 36.45 ? 273 ILE D CG2 1 +ATOM 19278 C CD1 . ILE D 1 273 ? 28.748 1.379 66.238 1.00 34.08 ? 273 ILE D CD1 1 +ATOM 19279 N N . GLU D 1 274 ? 31.153 5.449 65.016 1.00 41.79 ? 274 GLU D N 1 +ATOM 19280 C CA . GLU D 1 274 ? 31.485 6.528 65.938 1.00 43.93 ? 274 GLU D CA 1 +ATOM 19281 C C . GLU D 1 274 ? 31.830 6.079 67.357 1.00 42.79 ? 274 GLU D C 1 +ATOM 19282 O O . GLU D 1 274 ? 32.860 6.459 67.895 1.00 42.53 ? 274 GLU D O 1 +ATOM 19283 C CB . GLU D 1 274 ? 30.327 7.529 66.005 1.00 48.10 ? 274 GLU D CB 1 +ATOM 19284 C CG . GLU D 1 274 ? 30.462 8.743 65.087 1.00 56.52 ? 274 GLU D CG 1 +ATOM 19285 C CD . GLU D 1 274 ? 31.672 9.608 65.432 1.00 61.30 ? 274 GLU D CD 1 +ATOM 19286 O OE1 . GLU D 1 274 ? 31.970 9.761 66.643 1.00 63.52 ? 274 GLU D OE1 1 +ATOM 19287 O OE2 . GLU D 1 274 ? 32.314 10.144 64.496 1.00 63.87 ? 274 GLU D OE2 1 +ATOM 19288 N N . SER D 1 275 ? 30.970 5.266 67.957 1.00 41.45 ? 275 SER D N 1 +ATOM 19289 C CA . SER D 1 275 ? 31.179 4.821 69.325 1.00 40.44 ? 275 SER D CA 1 +ATOM 19290 C C . SER D 1 275 ? 32.315 3.837 69.583 1.00 40.04 ? 275 SER D C 1 +ATOM 19291 O O . SER D 1 275 ? 32.526 3.418 70.722 1.00 39.86 ? 275 SER D O 1 +ATOM 19292 C CB . SER D 1 275 ? 29.873 4.263 69.890 1.00 41.27 ? 275 SER D CB 1 +ATOM 19293 O OG . SER D 1 275 ? 29.266 3.366 68.982 1.00 41.42 ? 275 SER D OG 1 +ATOM 19294 N N . GLY D 1 276 ? 33.042 3.449 68.543 1.00 39.42 ? 276 GLY D N 1 +ATOM 19295 C CA . GLY D 1 276 ? 34.163 2.551 68.756 1.00 37.47 ? 276 GLY D CA 1 +ATOM 19296 C C . GLY D 1 276 ? 34.043 1.073 68.430 1.00 37.75 ? 276 GLY D C 1 +ATOM 19297 O O . GLY D 1 276 ? 35.064 0.410 68.274 1.00 38.44 ? 276 GLY D O 1 +ATOM 19298 N N . GLU D 1 277 ? 32.832 0.531 68.340 1.00 38.06 ? 277 GLU D N 1 +ATOM 19299 C CA . GLU D 1 277 ? 32.704 -0.887 68.013 1.00 37.68 ? 277 GLU D CA 1 +ATOM 19300 C C . GLU D 1 277 ? 32.922 -1.080 66.522 1.00 35.49 ? 277 GLU D C 1 +ATOM 19301 O O . GLU D 1 277 ? 33.019 -0.116 65.767 1.00 35.15 ? 277 GLU D O 1 +ATOM 19302 C CB . GLU D 1 277 ? 31.311 -1.433 68.346 1.00 40.25 ? 277 GLU D CB 1 +ATOM 19303 C CG . GLU D 1 277 ? 30.736 -1.046 69.697 1.00 44.96 ? 277 GLU D CG 1 +ATOM 19304 C CD . GLU D 1 277 ? 29.873 0.207 69.619 1.00 49.02 ? 277 GLU D CD 1 +ATOM 19305 O OE1 . GLU D 1 277 ? 30.441 1.310 69.420 1.00 49.44 ? 277 GLU D OE1 1 +ATOM 19306 O OE2 . GLU D 1 277 ? 28.626 0.083 69.744 1.00 49.85 ? 277 GLU D OE2 1 +ATOM 19307 N N . LEU D 1 278 ? 33.000 -2.336 66.101 1.00 34.37 ? 278 LEU D N 1 +ATOM 19308 C CA . LEU D 1 278 ? 33.154 -2.640 64.687 1.00 32.76 ? 278 LEU D CA 1 +ATOM 19309 C C . LEU D 1 278 ? 31.830 -2.330 63.993 1.00 32.48 ? 278 LEU D C 1 +ATOM 19310 O O . LEU D 1 278 ? 30.762 -2.382 64.609 1.00 31.35 ? 278 LEU D O 1 +ATOM 19311 C CB . LEU D 1 278 ? 33.445 -4.123 64.475 1.00 31.54 ? 278 LEU D CB 1 +ATOM 19312 C CG . LEU D 1 278 ? 34.809 -4.674 64.862 1.00 32.76 ? 278 LEU D CG 1 +ATOM 19313 C CD1 . LEU D 1 278 ? 34.883 -6.138 64.462 1.00 30.00 ? 278 LEU D CD1 1 +ATOM 19314 C CD2 . LEU D 1 278 ? 35.893 -3.871 64.166 1.00 29.57 ? 278 LEU D CD2 1 +ATOM 19315 N N . PHE D 1 279 ? 31.894 -1.995 62.715 1.00 30.82 ? 279 PHE D N 1 +ATOM 19316 C CA . PHE D 1 279 ? 30.668 -1.761 61.991 1.00 30.17 ? 279 PHE D CA 1 +ATOM 19317 C C . PHE D 1 279 ? 30.253 -3.138 61.495 1.00 30.15 ? 279 PHE D C 1 +ATOM 19318 O O . PHE D 1 279 ? 30.889 -3.710 60.622 1.00 30.51 ? 279 PHE D O 1 +ATOM 19319 C CB . PHE D 1 279 ? 30.883 -0.817 60.805 1.00 27.34 ? 279 PHE D CB 1 +ATOM 19320 C CG . PHE D 1 279 ? 29.760 -0.840 59.811 1.00 28.34 ? 279 PHE D CG 1 +ATOM 19321 C CD1 . PHE D 1 279 ? 28.430 -0.814 60.239 1.00 27.77 ? 279 PHE D CD1 1 +ATOM 19322 C CD2 . PHE D 1 279 ? 30.026 -0.907 58.447 1.00 28.51 ? 279 PHE D CD2 1 +ATOM 19323 C CE1 . PHE D 1 279 ? 27.377 -0.860 59.318 1.00 26.92 ? 279 PHE D CE1 1 +ATOM 19324 C CE2 . PHE D 1 279 ? 28.988 -0.952 57.515 1.00 30.14 ? 279 PHE D CE2 1 +ATOM 19325 C CZ . PHE D 1 279 ? 27.654 -0.931 57.952 1.00 27.97 ? 279 PHE D CZ 1 +ATOM 19326 N N . VAL D 1 280 ? 29.202 -3.687 62.084 1.00 31.74 ? 280 VAL D N 1 +ATOM 19327 C CA . VAL D 1 280 ? 28.710 -4.990 61.667 1.00 30.82 ? 280 VAL D CA 1 +ATOM 19328 C C . VAL D 1 280 ? 27.463 -4.776 60.824 1.00 31.26 ? 280 VAL D C 1 +ATOM 19329 O O . VAL D 1 280 ? 26.504 -4.146 61.270 1.00 32.48 ? 280 VAL D O 1 +ATOM 19330 C CB . VAL D 1 280 ? 28.354 -5.862 62.873 1.00 30.61 ? 280 VAL D CB 1 +ATOM 19331 C CG1 . VAL D 1 280 ? 27.844 -7.215 62.401 1.00 29.85 ? 280 VAL D CG1 1 +ATOM 19332 C CG2 . VAL D 1 280 ? 29.579 -6.039 63.759 1.00 30.79 ? 280 VAL D CG2 1 +ATOM 19333 N N . GLY D 1 281 ? 27.488 -5.289 59.602 1.00 30.98 ? 281 GLY D N 1 +ATOM 19334 C CA . GLY D 1 281 ? 26.356 -5.140 58.713 1.00 32.30 ? 281 GLY D CA 1 +ATOM 19335 C C . GLY D 1 281 ? 25.864 -6.444 58.109 1.00 34.00 ? 281 GLY D C 1 +ATOM 19336 O O . GLY D 1 281 ? 26.040 -7.523 58.682 1.00 34.36 ? 281 GLY D O 1 +ATOM 19337 N N . LYS D 1 282 ? 25.240 -6.343 56.940 1.00 34.97 ? 282 LYS D N 1 +ATOM 19338 C CA . LYS D 1 282 ? 24.694 -7.504 56.248 1.00 35.87 ? 282 LYS D CA 1 +ATOM 19339 C C . LYS D 1 282 ? 25.037 -7.451 54.775 1.00 35.19 ? 282 LYS D C 1 +ATOM 19340 O O . LYS D 1 282 ? 24.905 -6.413 54.135 1.00 34.79 ? 282 LYS D O 1 +ATOM 19341 C CB . LYS D 1 282 ? 23.175 -7.545 56.408 1.00 37.50 ? 282 LYS D CB 1 +ATOM 19342 C CG . LYS D 1 282 ? 22.698 -7.888 57.811 1.00 41.77 ? 282 LYS D CG 1 +ATOM 19343 C CD . LYS D 1 282 ? 22.719 -9.392 58.034 1.00 46.00 ? 282 LYS D CD 1 +ATOM 19344 C CE . LYS D 1 282 ? 22.180 -9.768 59.414 1.00 49.56 ? 282 LYS D CE 1 +ATOM 19345 N NZ . LYS D 1 282 ? 23.118 -9.375 60.511 1.00 53.31 ? 282 LYS D NZ 1 +ATOM 19346 N N . MET D 1 283 ? 25.479 -8.584 54.247 1.00 35.43 ? 283 MET D N 1 +ATOM 19347 C CA . MET D 1 283 ? 25.855 -8.708 52.843 1.00 36.39 ? 283 MET D CA 1 +ATOM 19348 C C . MET D 1 283 ? 25.671 -10.181 52.471 1.00 36.31 ? 283 MET D C 1 +ATOM 19349 O O . MET D 1 283 ? 25.152 -10.953 53.280 1.00 36.33 ? 283 MET D O 1 +ATOM 19350 C CB . MET D 1 283 ? 27.310 -8.270 52.642 1.00 36.16 ? 283 MET D CB 1 +ATOM 19351 C CG . MET D 1 283 ? 27.469 -7.122 51.655 1.00 39.75 ? 283 MET D CG 1 +ATOM 19352 S SD . MET D 1 283 ? 27.045 -7.558 49.940 1.00 41.48 ? 283 MET D SD 1 +ATOM 19353 C CE . MET D 1 283 ? 28.625 -8.268 49.382 1.00 39.26 ? 283 MET D CE 1 +ATOM 19354 N N . TRP D 1 284 ? 26.091 -10.574 51.270 1.00 35.88 ? 284 TRP D N 1 +ATOM 19355 C CA . TRP D 1 284 ? 25.930 -11.960 50.811 1.00 36.66 ? 284 TRP D CA 1 +ATOM 19356 C C . TRP D 1 284 ? 26.242 -13.053 51.854 1.00 36.36 ? 284 TRP D C 1 +ATOM 19357 O O . TRP D 1 284 ? 25.455 -13.971 52.060 1.00 34.94 ? 284 TRP D O 1 +ATOM 19358 C CB . TRP D 1 284 ? 26.785 -12.203 49.563 1.00 37.21 ? 284 TRP D CB 1 +ATOM 19359 C CG . TRP D 1 284 ? 26.486 -11.302 48.402 1.00 40.26 ? 284 TRP D CG 1 +ATOM 19360 C CD1 . TRP D 1 284 ? 27.363 -10.911 47.430 1.00 41.30 ? 284 TRP D CD1 1 +ATOM 19361 C CD2 . TRP D 1 284 ? 25.236 -10.673 48.088 1.00 42.04 ? 284 TRP D CD2 1 +ATOM 19362 N NE1 . TRP D 1 284 ? 26.741 -10.074 46.533 1.00 43.07 ? 284 TRP D NE1 1 +ATOM 19363 C CE2 . TRP D 1 284 ? 25.436 -9.911 46.912 1.00 42.60 ? 284 TRP D CE2 1 +ATOM 19364 C CE3 . TRP D 1 284 ? 23.970 -10.675 48.684 1.00 44.68 ? 284 TRP D CE3 1 +ATOM 19365 C CZ2 . TRP D 1 284 ? 24.418 -9.159 46.321 1.00 45.64 ? 284 TRP D CZ2 1 +ATOM 19366 C CZ3 . TRP D 1 284 ? 22.947 -9.921 48.093 1.00 47.20 ? 284 TRP D CZ3 1 +ATOM 19367 C CH2 . TRP D 1 284 ? 23.181 -9.175 46.923 1.00 46.67 ? 284 TRP D CH2 1 +ATOM 19368 N N . PRO D 1 285 ? 27.402 -12.968 52.528 1.00 37.35 ? 285 PRO D N 1 +ATOM 19369 C CA . PRO D 1 285 ? 27.699 -14.012 53.518 1.00 36.81 ? 285 PRO D CA 1 +ATOM 19370 C C . PRO D 1 285 ? 26.931 -13.923 54.835 1.00 36.07 ? 285 PRO D C 1 +ATOM 19371 O O . PRO D 1 285 ? 27.156 -14.730 55.735 1.00 37.66 ? 285 PRO D O 1 +ATOM 19372 C CB . PRO D 1 285 ? 29.209 -13.889 53.705 1.00 36.75 ? 285 PRO D CB 1 +ATOM 19373 C CG . PRO D 1 285 ? 29.448 -12.410 53.489 1.00 37.47 ? 285 PRO D CG 1 +ATOM 19374 C CD . PRO D 1 285 ? 28.560 -12.073 52.319 1.00 35.43 ? 285 PRO D CD 1 +ATOM 19375 N N . GLY D 1 286 ? 26.014 -12.962 54.937 1.00 35.58 ? 286 GLY D N 1 +ATOM 19376 C CA . GLY D 1 286 ? 25.232 -12.792 56.155 1.00 32.34 ? 286 GLY D CA 1 +ATOM 19377 C C . GLY D 1 286 ? 25.819 -11.666 56.984 1.00 32.05 ? 286 GLY D C 1 +ATOM 19378 O O . GLY D 1 286 ? 26.159 -10.618 56.443 1.00 32.07 ? 286 GLY D O 1 +ATOM 19379 N N . THR D 1 287 ? 25.942 -11.869 58.293 1.00 32.17 ? 287 THR D N 1 +ATOM 19380 C CA . THR D 1 287 ? 26.526 -10.847 59.161 1.00 30.77 ? 287 THR D CA 1 +ATOM 19381 C C . THR D 1 287 ? 27.964 -10.639 58.674 1.00 30.56 ? 287 THR D C 1 +ATOM 19382 O O . THR D 1 287 ? 28.714 -11.601 58.516 1.00 29.34 ? 287 THR D O 1 +ATOM 19383 C CB . THR D 1 287 ? 26.515 -11.322 60.610 1.00 32.41 ? 287 THR D CB 1 +ATOM 19384 O OG1 . THR D 1 287 ? 25.166 -11.641 60.984 1.00 33.53 ? 287 THR D OG1 1 +ATOM 19385 C CG2 . THR D 1 287 ? 27.047 -10.237 61.539 1.00 33.16 ? 287 THR D CG2 1 +ATOM 19386 N N . THR D 1 288 ? 28.344 -9.390 58.426 1.00 29.27 ? 288 THR D N 1 +ATOM 19387 C CA . THR D 1 288 ? 29.668 -9.107 57.913 1.00 30.74 ? 288 THR D CA 1 +ATOM 19388 C C . THR D 1 288 ? 30.313 -7.823 58.439 1.00 31.44 ? 288 THR D C 1 +ATOM 19389 O O . THR D 1 288 ? 29.635 -6.935 58.964 1.00 32.13 ? 288 THR D O 1 +ATOM 19390 C CB . THR D 1 288 ? 29.632 -8.981 56.371 1.00 34.79 ? 288 THR D CB 1 +ATOM 19391 O OG1 . THR D 1 288 ? 28.851 -7.833 56.002 1.00 39.03 ? 288 THR D OG1 1 +ATOM 19392 C CG2 . THR D 1 288 ? 28.994 -10.194 55.749 1.00 35.39 ? 288 THR D CG2 1 +ATOM 19393 N N . VAL D 1 289 ? 31.636 -7.737 58.291 1.00 28.90 ? 289 VAL D N 1 +ATOM 19394 C CA . VAL D 1 289 ? 32.370 -6.545 58.677 1.00 29.12 ? 289 VAL D CA 1 +ATOM 19395 C C . VAL D 1 289 ? 33.067 -6.146 57.395 1.00 28.35 ? 289 VAL D C 1 +ATOM 19396 O O . VAL D 1 289 ? 33.147 -6.945 56.468 1.00 26.77 ? 289 VAL D O 1 +ATOM 19397 C CB . VAL D 1 289 ? 33.416 -6.793 59.816 1.00 29.60 ? 289 VAL D CB 1 +ATOM 19398 C CG1 . VAL D 1 289 ? 32.705 -6.953 61.144 1.00 28.30 ? 289 VAL D CG1 1 +ATOM 19399 C CG2 . VAL D 1 289 ? 34.262 -8.016 59.513 1.00 29.52 ? 289 VAL D CG2 1 +ATOM 19400 N N . TYR D 1 290 ? 33.562 -4.917 57.327 1.00 29.21 ? 290 TYR D N 1 +ATOM 19401 C CA . TYR D 1 290 ? 34.209 -4.467 56.110 1.00 31.10 ? 290 TYR D CA 1 +ATOM 19402 C C . TYR D 1 290 ? 35.612 -3.918 56.342 1.00 32.39 ? 290 TYR D C 1 +ATOM 19403 O O . TYR D 1 290 ? 35.889 -3.272 57.362 1.00 33.50 ? 290 TYR D O 1 +ATOM 19404 C CB . TYR D 1 290 ? 33.346 -3.391 55.433 1.00 31.68 ? 290 TYR D CB 1 +ATOM 19405 C CG . TYR D 1 290 ? 31.913 -3.823 55.180 1.00 33.40 ? 290 TYR D CG 1 +ATOM 19406 C CD1 . TYR D 1 290 ? 30.934 -3.691 56.172 1.00 33.06 ? 290 TYR D CD1 1 +ATOM 19407 C CD2 . TYR D 1 290 ? 31.543 -4.394 53.963 1.00 33.03 ? 290 TYR D CD2 1 +ATOM 19408 C CE1 . TYR D 1 290 ? 29.622 -4.117 55.957 1.00 35.03 ? 290 TYR D CE1 1 +ATOM 19409 C CE2 . TYR D 1 290 ? 30.235 -4.825 53.739 1.00 35.36 ? 290 TYR D CE2 1 +ATOM 19410 C CZ . TYR D 1 290 ? 29.280 -4.682 54.736 1.00 34.96 ? 290 TYR D CZ 1 +ATOM 19411 O OH . TYR D 1 290 ? 27.987 -5.092 54.501 1.00 34.67 ? 290 TYR D OH 1 +ATOM 19412 N N . PRO D 1 291 ? 36.518 -4.167 55.393 1.00 31.26 ? 291 PRO D N 1 +ATOM 19413 C CA . PRO D 1 291 ? 37.894 -3.679 55.514 1.00 32.77 ? 291 PRO D CA 1 +ATOM 19414 C C . PRO D 1 291 ? 37.924 -2.159 55.381 1.00 35.19 ? 291 PRO D C 1 +ATOM 19415 O O . PRO D 1 291 ? 37.238 -1.596 54.519 1.00 36.71 ? 291 PRO D O 1 +ATOM 19416 C CB . PRO D 1 291 ? 38.612 -4.347 54.338 1.00 31.00 ? 291 PRO D CB 1 +ATOM 19417 C CG . PRO D 1 291 ? 37.773 -5.553 54.039 1.00 30.71 ? 291 PRO D CG 1 +ATOM 19418 C CD . PRO D 1 291 ? 36.368 -5.033 54.215 1.00 30.27 ? 291 PRO D CD 1 +ATOM 19419 N N . ASP D 1 292 ? 38.705 -1.489 56.224 1.00 35.40 ? 292 ASP D N 1 +ATOM 19420 C CA . ASP D 1 292 ? 38.815 -0.039 56.119 1.00 36.35 ? 292 ASP D CA 1 +ATOM 19421 C C . ASP D 1 292 ? 39.962 0.234 55.139 1.00 37.01 ? 292 ASP D C 1 +ATOM 19422 O O . ASP D 1 292 ? 41.096 0.509 55.543 1.00 38.26 ? 292 ASP D O 1 +ATOM 19423 C CB . ASP D 1 292 ? 39.114 0.595 57.483 1.00 36.43 ? 292 ASP D CB 1 +ATOM 19424 C CG . ASP D 1 292 ? 39.215 2.116 57.412 1.00 39.03 ? 292 ASP D CG 1 +ATOM 19425 O OD1 . ASP D 1 292 ? 39.033 2.685 56.309 1.00 41.92 ? 292 ASP D OD1 1 +ATOM 19426 O OD2 . ASP D 1 292 ? 39.476 2.749 58.459 1.00 39.90 ? 292 ASP D OD2 1 +ATOM 19427 N N . PHE D 1 293 ? 39.654 0.161 53.848 1.00 35.42 ? 293 PHE D N 1 +ATOM 19428 C CA . PHE D 1 293 ? 40.650 0.358 52.804 1.00 35.00 ? 293 PHE D CA 1 +ATOM 19429 C C . PHE D 1 293 ? 41.370 1.700 52.804 1.00 35.60 ? 293 PHE D C 1 +ATOM 19430 O O . PHE D 1 293 ? 42.344 1.881 52.068 1.00 34.25 ? 293 PHE D O 1 +ATOM 19431 C CB . PHE D 1 293 ? 40.017 0.121 51.432 1.00 32.99 ? 293 PHE D CB 1 +ATOM 19432 C CG . PHE D 1 293 ? 39.621 -1.303 51.190 1.00 32.03 ? 293 PHE D CG 1 +ATOM 19433 C CD1 . PHE D 1 293 ? 40.586 -2.301 51.109 1.00 30.63 ? 293 PHE D CD1 1 +ATOM 19434 C CD2 . PHE D 1 293 ? 38.280 -1.649 51.033 1.00 32.81 ? 293 PHE D CD2 1 +ATOM 19435 C CE1 . PHE D 1 293 ? 40.227 -3.628 50.874 1.00 32.06 ? 293 PHE D CE1 1 +ATOM 19436 C CE2 . PHE D 1 293 ? 37.906 -2.979 50.796 1.00 34.35 ? 293 PHE D CE2 1 +ATOM 19437 C CZ . PHE D 1 293 ? 38.886 -3.972 50.716 1.00 32.50 ? 293 PHE D CZ 1 +ATOM 19438 N N . PHE D 1 294 ? 40.896 2.645 53.607 1.00 36.76 ? 294 PHE D N 1 +ATOM 19439 C CA . PHE D 1 294 ? 41.550 3.951 53.675 1.00 37.94 ? 294 PHE D CA 1 +ATOM 19440 C C . PHE D 1 294 ? 42.883 3.845 54.423 1.00 38.17 ? 294 PHE D C 1 +ATOM 19441 O O . PHE D 1 294 ? 43.749 4.704 54.293 1.00 39.31 ? 294 PHE D O 1 +ATOM 19442 C CB . PHE D 1 294 ? 40.636 4.963 54.366 1.00 37.31 ? 294 PHE D CB 1 +ATOM 19443 C CG . PHE D 1 294 ? 39.434 5.340 53.554 1.00 36.20 ? 294 PHE D CG 1 +ATOM 19444 C CD1 . PHE D 1 294 ? 39.552 6.203 52.476 1.00 35.13 ? 294 PHE D CD1 1 +ATOM 19445 C CD2 . PHE D 1 294 ? 38.179 4.809 53.856 1.00 37.43 ? 294 PHE D CD2 1 +ATOM 19446 C CE1 . PHE D 1 294 ? 38.439 6.537 51.703 1.00 36.22 ? 294 PHE D CE1 1 +ATOM 19447 C CE2 . PHE D 1 294 ? 37.061 5.135 53.093 1.00 34.21 ? 294 PHE D CE2 1 +ATOM 19448 C CZ . PHE D 1 294 ? 37.191 6.001 52.014 1.00 34.36 ? 294 PHE D CZ 1 +ATOM 19449 N N . ARG D 1 295 ? 43.044 2.777 55.192 1.00 38.64 ? 295 ARG D N 1 +ATOM 19450 C CA . ARG D 1 295 ? 44.273 2.561 55.948 1.00 40.27 ? 295 ARG D CA 1 +ATOM 19451 C C . ARG D 1 295 ? 45.318 1.806 55.145 1.00 40.55 ? 295 ARG D C 1 +ATOM 19452 O O . ARG D 1 295 ? 45.007 0.839 54.439 1.00 41.11 ? 295 ARG D O 1 +ATOM 19453 C CB . ARG D 1 295 ? 43.966 1.793 57.230 1.00 40.66 ? 295 ARG D CB 1 +ATOM 19454 C CG . ARG D 1 295 ? 43.015 2.525 58.136 1.00 42.68 ? 295 ARG D CG 1 +ATOM 19455 C CD . ARG D 1 295 ? 42.466 1.615 59.197 1.00 43.89 ? 295 ARG D CD 1 +ATOM 19456 N NE . ARG D 1 295 ? 43.528 0.966 59.947 1.00 46.00 ? 295 ARG D NE 1 +ATOM 19457 C CZ . ARG D 1 295 ? 43.317 0.221 61.025 1.00 49.30 ? 295 ARG D CZ 1 +ATOM 19458 N NH1 . ARG D 1 295 ? 42.080 0.036 61.477 1.00 50.28 ? 295 ARG D NH1 1 +ATOM 19459 N NH2 . ARG D 1 295 ? 44.342 -0.347 61.647 1.00 51.75 ? 295 ARG D NH2 1 +ATOM 19460 N N . GLU D 1 296 ? 46.559 2.265 55.251 1.00 41.01 ? 296 GLU D N 1 +ATOM 19461 C CA . GLU D 1 296 ? 47.667 1.628 54.559 1.00 42.84 ? 296 GLU D CA 1 +ATOM 19462 C C . GLU D 1 296 ? 47.749 0.152 54.951 1.00 41.36 ? 296 GLU D C 1 +ATOM 19463 O O . GLU D 1 296 ? 47.796 -0.722 54.097 1.00 40.52 ? 296 GLU D O 1 +ATOM 19464 C CB . GLU D 1 296 ? 48.976 2.333 54.913 1.00 46.87 ? 296 GLU D CB 1 +ATOM 19465 C CG . GLU D 1 296 ? 50.246 1.490 54.704 1.00 55.09 ? 296 GLU D CG 1 +ATOM 19466 C CD . GLU D 1 296 ? 50.621 1.294 53.234 1.00 60.25 ? 296 GLU D CD 1 +ATOM 19467 O OE1 . GLU D 1 296 ? 50.891 2.308 52.549 1.00 62.53 ? 296 GLU D OE1 1 +ATOM 19468 O OE2 . GLU D 1 296 ? 50.655 0.128 52.766 1.00 62.37 ? 296 GLU D OE2 1 +ATOM 19469 N N . ASP D 1 297 ? 47.751 -0.135 56.246 1.00 41.34 ? 297 ASP D N 1 +ATOM 19470 C CA . ASP D 1 297 ? 47.853 -1.522 56.667 1.00 41.66 ? 297 ASP D CA 1 +ATOM 19471 C C . ASP D 1 297 ? 46.718 -2.423 56.179 1.00 39.47 ? 297 ASP D C 1 +ATOM 19472 O O . ASP D 1 297 ? 46.965 -3.578 55.819 1.00 37.98 ? 297 ASP D O 1 +ATOM 19473 C CB . ASP D 1 297 ? 48.032 -1.624 58.194 1.00 44.12 ? 297 ASP D CB 1 +ATOM 19474 C CG . ASP D 1 297 ? 46.936 -0.926 58.977 1.00 49.52 ? 297 ASP D CG 1 +ATOM 19475 O OD1 . ASP D 1 297 ? 46.716 0.293 58.783 1.00 51.58 ? 297 ASP D OD1 1 +ATOM 19476 O OD2 . ASP D 1 297 ? 46.305 -1.606 59.813 1.00 52.86 ? 297 ASP D OD2 1 +ATOM 19477 N N . THR D 1 298 ? 45.486 -1.914 56.159 1.00 38.14 ? 298 THR D N 1 +ATOM 19478 C CA . THR D 1 298 ? 44.359 -2.719 55.675 1.00 35.68 ? 298 THR D CA 1 +ATOM 19479 C C . THR D 1 298 ? 44.612 -3.042 54.197 1.00 33.51 ? 298 THR D C 1 +ATOM 19480 O O . THR D 1 298 ? 44.310 -4.136 53.718 1.00 31.30 ? 298 THR D O 1 +ATOM 19481 C CB . THR D 1 298 ? 43.004 -1.963 55.838 1.00 35.83 ? 298 THR D CB 1 +ATOM 19482 O OG1 . THR D 1 298 ? 42.681 -1.863 57.232 1.00 33.80 ? 298 THR D OG1 1 +ATOM 19483 C CG2 . THR D 1 298 ? 41.867 -2.708 55.105 1.00 33.28 ? 298 THR D CG2 1 +ATOM 19484 N N . ARG D 1 299 ? 45.195 -2.083 53.491 1.00 33.41 ? 299 ARG D N 1 +ATOM 19485 C CA . ARG D 1 299 ? 45.519 -2.250 52.084 1.00 34.65 ? 299 ARG D CA 1 +ATOM 19486 C C . ARG D 1 299 ? 46.574 -3.335 51.908 1.00 34.30 ? 299 ARG D C 1 +ATOM 19487 O O . ARG D 1 299 ? 46.491 -4.142 50.986 1.00 35.92 ? 299 ARG D O 1 +ATOM 19488 C CB . ARG D 1 299 ? 46.036 -0.934 51.503 1.00 34.12 ? 299 ARG D CB 1 +ATOM 19489 C CG . ARG D 1 299 ? 45.193 -0.378 50.391 1.00 34.99 ? 299 ARG D CG 1 +ATOM 19490 C CD . ARG D 1 299 ? 44.714 1.005 50.723 1.00 35.31 ? 299 ARG D CD 1 +ATOM 19491 N NE . ARG D 1 299 ? 45.799 1.973 50.658 1.00 34.60 ? 299 ARG D NE 1 +ATOM 19492 C CZ . ARG D 1 299 ? 45.869 3.064 51.410 1.00 34.68 ? 299 ARG D CZ 1 +ATOM 19493 N NH1 . ARG D 1 299 ? 44.923 3.336 52.303 1.00 32.84 ? 299 ARG D NH1 1 +ATOM 19494 N NH2 . ARG D 1 299 ? 46.882 3.900 51.253 1.00 36.85 ? 299 ARG D NH2 1 +ATOM 19495 N N . GLU D 1 300 ? 47.563 -3.359 52.793 1.00 34.93 ? 300 GLU D N 1 +ATOM 19496 C CA . GLU D 1 300 ? 48.630 -4.360 52.711 1.00 35.93 ? 300 GLU D CA 1 +ATOM 19497 C C . GLU D 1 300 ? 48.093 -5.761 52.993 1.00 33.28 ? 300 GLU D C 1 +ATOM 19498 O O . GLU D 1 300 ? 48.470 -6.729 52.331 1.00 32.36 ? 300 GLU D O 1 +ATOM 19499 C CB . GLU D 1 300 ? 49.760 -4.023 53.696 1.00 39.32 ? 300 GLU D CB 1 +ATOM 19500 C CG . GLU D 1 300 ? 50.902 -5.032 53.678 1.00 48.04 ? 300 GLU D CG 1 +ATOM 19501 C CD . GLU D 1 300 ? 51.491 -5.217 52.282 1.00 53.63 ? 300 GLU D CD 1 +ATOM 19502 O OE1 . GLU D 1 300 ? 52.106 -4.250 51.772 1.00 57.30 ? 300 GLU D OE1 1 +ATOM 19503 O OE2 . GLU D 1 300 ? 51.330 -6.317 51.690 1.00 54.65 ? 300 GLU D OE2 1 +ATOM 19504 N N . TRP D 1 301 ? 47.214 -5.856 53.982 1.00 32.40 ? 301 TRP D N 1 +ATOM 19505 C CA . TRP D 1 301 ? 46.588 -7.120 54.359 1.00 33.57 ? 301 TRP D CA 1 +ATOM 19506 C C . TRP D 1 301 ? 45.776 -7.665 53.176 1.00 34.94 ? 301 TRP D C 1 +ATOM 19507 O O . TRP D 1 301 ? 45.890 -8.839 52.819 1.00 35.38 ? 301 TRP D O 1 +ATOM 19508 C CB . TRP D 1 301 ? 45.677 -6.892 55.569 1.00 32.72 ? 301 TRP D CB 1 +ATOM 19509 C CG . TRP D 1 301 ? 44.708 -7.997 55.857 1.00 34.20 ? 301 TRP D CG 1 +ATOM 19510 C CD1 . TRP D 1 301 ? 44.979 -9.196 56.451 1.00 36.22 ? 301 TRP D CD1 1 +ATOM 19511 C CD2 . TRP D 1 301 ? 43.304 -7.999 55.573 1.00 34.24 ? 301 TRP D CD2 1 +ATOM 19512 N NE1 . TRP D 1 301 ? 43.829 -9.946 56.558 1.00 35.79 ? 301 TRP D NE1 1 +ATOM 19513 C CE2 . TRP D 1 301 ? 42.786 -9.233 56.026 1.00 35.12 ? 301 TRP D CE2 1 +ATOM 19514 C CE3 . TRP D 1 301 ? 42.430 -7.075 54.975 1.00 35.11 ? 301 TRP D CE3 1 +ATOM 19515 C CZ2 . TRP D 1 301 ? 41.428 -9.572 55.901 1.00 35.35 ? 301 TRP D CZ2 1 +ATOM 19516 C CZ3 . TRP D 1 301 ? 41.080 -7.413 54.850 1.00 34.20 ? 301 TRP D CZ3 1 +ATOM 19517 C CH2 . TRP D 1 301 ? 40.594 -8.655 55.313 1.00 33.77 ? 301 TRP D CH2 1 +ATOM 19518 N N . TRP D 1 302 ? 44.967 -6.800 52.568 1.00 34.48 ? 302 TRP D N 1 +ATOM 19519 C CA . TRP D 1 302 ? 44.142 -7.181 51.431 1.00 32.77 ? 302 TRP D CA 1 +ATOM 19520 C C . TRP D 1 302 ? 45.011 -7.617 50.256 1.00 32.57 ? 302 TRP D C 1 +ATOM 19521 O O . TRP D 1 302 ? 44.734 -8.637 49.607 1.00 32.91 ? 302 TRP D O 1 +ATOM 19522 C CB . TRP D 1 302 ? 43.254 -6.004 51.022 1.00 32.61 ? 302 TRP D CB 1 +ATOM 19523 C CG . TRP D 1 302 ? 42.337 -6.293 49.890 1.00 32.38 ? 302 TRP D CG 1 +ATOM 19524 C CD1 . TRP D 1 302 ? 42.514 -5.947 48.577 1.00 32.86 ? 302 TRP D CD1 1 +ATOM 19525 C CD2 . TRP D 1 302 ? 41.068 -6.951 49.966 1.00 33.38 ? 302 TRP D CD2 1 +ATOM 19526 N NE1 . TRP D 1 302 ? 41.428 -6.341 47.832 1.00 33.05 ? 302 TRP D NE1 1 +ATOM 19527 C CE2 . TRP D 1 302 ? 40.522 -6.957 48.658 1.00 34.04 ? 302 TRP D CE2 1 +ATOM 19528 C CE3 . TRP D 1 302 ? 40.335 -7.534 51.012 1.00 32.12 ? 302 TRP D CE3 1 +ATOM 19529 C CZ2 . TRP D 1 302 ? 39.270 -7.521 48.368 1.00 34.03 ? 302 TRP D CZ2 1 +ATOM 19530 C CZ3 . TRP D 1 302 ? 39.088 -8.099 50.724 1.00 34.31 ? 302 TRP D CZ3 1 +ATOM 19531 C CH2 . TRP D 1 302 ? 38.570 -8.085 49.409 1.00 35.03 ? 302 TRP D CH2 1 +ATOM 19532 N N . ALA D 1 303 ? 46.060 -6.851 49.974 1.00 31.61 ? 303 ALA D N 1 +ATOM 19533 C CA . ALA D 1 303 ? 46.959 -7.193 48.875 1.00 31.22 ? 303 ALA D CA 1 +ATOM 19534 C C . ALA D 1 303 ? 47.480 -8.604 49.073 1.00 31.99 ? 303 ALA D C 1 +ATOM 19535 O O . ALA D 1 303 ? 47.613 -9.365 48.118 1.00 33.97 ? 303 ALA D O 1 +ATOM 19536 C CB . ALA D 1 303 ? 48.108 -6.216 48.816 1.00 30.87 ? 303 ALA D CB 1 +ATOM 19537 N N . GLY D 1 304 ? 47.757 -8.959 50.325 1.00 33.31 ? 304 GLY D N 1 +ATOM 19538 C CA . GLY D 1 304 ? 48.254 -10.290 50.629 1.00 32.30 ? 304 GLY D CA 1 +ATOM 19539 C C . GLY D 1 304 ? 47.264 -11.383 50.278 1.00 32.94 ? 304 GLY D C 1 +ATOM 19540 O O . GLY D 1 304 ? 47.626 -12.388 49.665 1.00 33.01 ? 304 GLY D O 1 +ATOM 19541 N N . LEU D 1 305 ? 46.008 -11.202 50.673 1.00 32.70 ? 305 LEU D N 1 +ATOM 19542 C CA . LEU D 1 305 ? 44.984 -12.192 50.375 1.00 33.18 ? 305 LEU D CA 1 +ATOM 19543 C C . LEU D 1 305 ? 44.786 -12.306 48.863 1.00 33.39 ? 305 LEU D C 1 +ATOM 19544 O O . LEU D 1 305 ? 44.643 -13.400 48.322 1.00 32.54 ? 305 LEU D O 1 +ATOM 19545 C CB . LEU D 1 305 ? 43.666 -11.799 51.037 1.00 33.87 ? 305 LEU D CB 1 +ATOM 19546 C CG . LEU D 1 305 ? 43.644 -11.754 52.564 1.00 33.51 ? 305 LEU D CG 1 +ATOM 19547 C CD1 . LEU D 1 305 ? 42.295 -11.216 53.030 1.00 32.28 ? 305 LEU D CD1 1 +ATOM 19548 C CD2 . LEU D 1 305 ? 43.894 -13.142 53.127 1.00 29.85 ? 305 LEU D CD2 1 +ATOM 19549 N N . ILE D 1 306 ? 44.782 -11.166 48.183 1.00 34.02 ? 306 ILE D N 1 +ATOM 19550 C CA . ILE D 1 306 ? 44.604 -11.157 46.737 1.00 34.77 ? 306 ILE D CA 1 +ATOM 19551 C C . ILE D 1 306 ? 45.748 -11.914 46.078 1.00 36.33 ? 306 ILE D C 1 +ATOM 19552 O O . ILE D 1 306 ? 45.531 -12.798 45.243 1.00 36.36 ? 306 ILE D O 1 +ATOM 19553 C CB . ILE D 1 306 ? 44.583 -9.715 46.179 1.00 32.70 ? 306 ILE D CB 1 +ATOM 19554 C CG1 . ILE D 1 306 ? 43.279 -9.015 46.572 1.00 32.37 ? 306 ILE D CG1 1 +ATOM 19555 C CG2 . ILE D 1 306 ? 44.747 -9.742 44.669 1.00 31.86 ? 306 ILE D CG2 1 +ATOM 19556 C CD1 . ILE D 1 306 ? 42.031 -9.646 45.977 1.00 32.98 ? 306 ILE D CD1 1 +ATOM 19557 N N . SER D 1 307 ? 46.968 -11.559 46.465 1.00 37.44 ? 307 SER D N 1 +ATOM 19558 C CA . SER D 1 307 ? 48.163 -12.182 45.916 1.00 38.81 ? 307 SER D CA 1 +ATOM 19559 C C . SER D 1 307 ? 48.094 -13.704 46.083 1.00 38.90 ? 307 SER D C 1 +ATOM 19560 O O . SER D 1 307 ? 48.348 -14.468 45.146 1.00 39.02 ? 307 SER D O 1 +ATOM 19561 C CB . SER D 1 307 ? 49.396 -11.624 46.630 1.00 39.64 ? 307 SER D CB 1 +ATOM 19562 O OG . SER D 1 307 ? 50.588 -12.017 45.982 1.00 40.06 ? 307 SER D OG 1 +ATOM 19563 N N . GLU D 1 308 ? 47.744 -14.134 47.285 1.00 38.26 ? 308 GLU D N 1 +ATOM 19564 C CA . GLU D 1 308 ? 47.626 -15.548 47.588 1.00 40.03 ? 308 GLU D CA 1 +ATOM 19565 C C . GLU D 1 308 ? 46.551 -16.181 46.697 1.00 39.43 ? 308 GLU D C 1 +ATOM 19566 O O . GLU D 1 308 ? 46.707 -17.309 46.230 1.00 39.54 ? 308 GLU D O 1 +ATOM 19567 C CB . GLU D 1 308 ? 47.253 -15.708 49.058 1.00 42.98 ? 308 GLU D CB 1 +ATOM 19568 C CG . GLU D 1 308 ? 47.276 -17.117 49.589 1.00 50.08 ? 308 GLU D CG 1 +ATOM 19569 C CD . GLU D 1 308 ? 46.651 -17.204 50.978 1.00 56.20 ? 308 GLU D CD 1 +ATOM 19570 O OE1 . GLU D 1 308 ? 47.020 -16.382 51.854 1.00 59.95 ? 308 GLU D OE1 1 +ATOM 19571 O OE2 . GLU D 1 308 ? 45.792 -18.091 51.199 1.00 58.71 ? 308 GLU D OE2 1 +ATOM 19572 N N . TRP D 1 309 ? 45.465 -15.445 46.463 1.00 37.77 ? 309 TRP D N 1 +ATOM 19573 C CA . TRP D 1 309 ? 44.362 -15.926 45.637 1.00 34.89 ? 309 TRP D CA 1 +ATOM 19574 C C . TRP D 1 309 ? 44.782 -16.040 44.167 1.00 34.69 ? 309 TRP D C 1 +ATOM 19575 O O . TRP D 1 309 ? 44.411 -16.987 43.474 1.00 34.04 ? 309 TRP D O 1 +ATOM 19576 C CB . TRP D 1 309 ? 43.165 -14.978 45.786 1.00 34.26 ? 309 TRP D CB 1 +ATOM 19577 C CG . TRP D 1 309 ? 41.928 -15.436 45.079 1.00 32.89 ? 309 TRP D CG 1 +ATOM 19578 C CD1 . TRP D 1 309 ? 41.374 -14.893 43.951 1.00 30.42 ? 309 TRP D CD1 1 +ATOM 19579 C CD2 . TRP D 1 309 ? 41.110 -16.555 45.428 1.00 31.77 ? 309 TRP D CD2 1 +ATOM 19580 N NE1 . TRP D 1 309 ? 40.260 -15.608 43.577 1.00 29.98 ? 309 TRP D NE1 1 +ATOM 19581 C CE2 . TRP D 1 309 ? 40.074 -16.634 44.463 1.00 31.82 ? 309 TRP D CE2 1 +ATOM 19582 C CE3 . TRP D 1 309 ? 41.151 -17.503 46.458 1.00 31.35 ? 309 TRP D CE3 1 +ATOM 19583 C CZ2 . TRP D 1 309 ? 39.084 -17.628 44.499 1.00 31.51 ? 309 TRP D CZ2 1 +ATOM 19584 C CZ3 . TRP D 1 309 ? 40.170 -18.493 46.496 1.00 31.94 ? 309 TRP D CZ3 1 +ATOM 19585 C CH2 . TRP D 1 309 ? 39.148 -18.546 45.518 1.00 33.01 ? 309 TRP D CH2 1 +ATOM 19586 N N . LEU D 1 310 ? 45.559 -15.072 43.698 1.00 34.07 ? 310 LEU D N 1 +ATOM 19587 C CA . LEU D 1 310 ? 46.040 -15.074 42.325 1.00 34.46 ? 310 LEU D CA 1 +ATOM 19588 C C . LEU D 1 310 ? 47.028 -16.202 42.057 1.00 36.49 ? 310 LEU D C 1 +ATOM 19589 O O . LEU D 1 310 ? 47.125 -16.697 40.932 1.00 38.45 ? 310 LEU D O 1 +ATOM 19590 C CB . LEU D 1 310 ? 46.722 -13.746 41.999 1.00 33.84 ? 310 LEU D CB 1 +ATOM 19591 C CG . LEU D 1 310 ? 45.834 -12.508 41.823 1.00 34.33 ? 310 LEU D CG 1 +ATOM 19592 C CD1 . LEU D 1 310 ? 46.700 -11.277 41.563 1.00 31.76 ? 310 LEU D CD1 1 +ATOM 19593 C CD2 . LEU D 1 310 ? 44.880 -12.739 40.656 1.00 33.64 ? 310 LEU D CD2 1 +ATOM 19594 N N . SER D 1 311 ? 47.756 -16.612 43.089 1.00 37.38 ? 311 SER D N 1 +ATOM 19595 C CA . SER D 1 311 ? 48.763 -17.654 42.942 1.00 39.15 ? 311 SER D CA 1 +ATOM 19596 C C . SER D 1 311 ? 48.234 -19.028 42.524 1.00 40.01 ? 311 SER D C 1 +ATOM 19597 O O . SER D 1 311 ? 49.009 -19.871 42.078 1.00 40.59 ? 311 SER D O 1 +ATOM 19598 C CB . SER D 1 311 ? 49.569 -17.792 44.235 1.00 40.24 ? 311 SER D CB 1 +ATOM 19599 O OG . SER D 1 311 ? 48.835 -18.523 45.204 1.00 42.04 ? 311 SER D OG 1 +ATOM 19600 N N . GLN D 1 312 ? 46.934 -19.276 42.668 1.00 40.18 ? 312 GLN D N 1 +ATOM 19601 C CA . GLN D 1 312 ? 46.403 -20.576 42.249 1.00 39.47 ? 312 GLN D CA 1 +ATOM 19602 C C . GLN D 1 312 ? 46.312 -20.591 40.732 1.00 38.17 ? 312 GLN D C 1 +ATOM 19603 O O . GLN D 1 312 ? 46.118 -21.638 40.131 1.00 38.39 ? 312 GLN D O 1 +ATOM 19604 C CB . GLN D 1 312 ? 44.992 -20.831 42.769 1.00 40.03 ? 312 GLN D CB 1 +ATOM 19605 C CG . GLN D 1 312 ? 44.549 -20.029 43.943 1.00 44.72 ? 312 GLN D CG 1 +ATOM 19606 C CD . GLN D 1 312 ? 43.043 -20.103 44.115 1.00 46.34 ? 312 GLN D CD 1 +ATOM 19607 O OE1 . GLN D 1 312 ? 42.476 -21.186 44.271 1.00 45.73 ? 312 GLN D OE1 1 +ATOM 19608 N NE2 . GLN D 1 312 ? 42.385 -18.947 44.078 1.00 47.75 ? 312 GLN D NE2 1 +ATOM 19609 N N . GLY D 1 313 ? 46.418 -19.419 40.120 1.00 38.06 ? 313 GLY D N 1 +ATOM 19610 C CA . GLY D 1 313 ? 46.315 -19.331 38.674 1.00 37.90 ? 313 GLY D CA 1 +ATOM 19611 C C . GLY D 1 313 ? 45.149 -18.458 38.211 1.00 38.19 ? 313 GLY D C 1 +ATOM 19612 O O . GLY D 1 313 ? 44.870 -18.375 37.015 1.00 39.46 ? 313 GLY D O 1 +ATOM 19613 N N . VAL D 1 314 ? 44.456 -17.820 39.152 1.00 35.94 ? 314 VAL D N 1 +ATOM 19614 C CA . VAL D 1 314 ? 43.351 -16.937 38.813 1.00 33.88 ? 314 VAL D CA 1 +ATOM 19615 C C . VAL D 1 314 ? 43.968 -15.768 38.044 1.00 34.16 ? 314 VAL D C 1 +ATOM 19616 O O . VAL D 1 314 ? 44.955 -15.194 38.483 1.00 33.72 ? 314 VAL D O 1 +ATOM 19617 C CB . VAL D 1 314 ? 42.646 -16.427 40.088 1.00 32.50 ? 314 VAL D CB 1 +ATOM 19618 C CG1 . VAL D 1 314 ? 41.708 -15.277 39.752 1.00 30.58 ? 314 VAL D CG1 1 +ATOM 19619 C CG2 . VAL D 1 314 ? 41.878 -17.578 40.747 1.00 29.74 ? 314 VAL D CG2 1 +ATOM 19620 N N . ASP D 1 315 ? 43.370 -15.410 36.910 1.00 34.18 ? 315 ASP D N 1 +ATOM 19621 C CA . ASP D 1 315 ? 43.893 -14.349 36.047 1.00 32.72 ? 315 ASP D CA 1 +ATOM 19622 C C . ASP D 1 315 ? 43.391 -12.929 36.272 1.00 31.60 ? 315 ASP D C 1 +ATOM 19623 O O . ASP D 1 315 ? 44.043 -11.970 35.866 1.00 30.80 ? 315 ASP D O 1 +ATOM 19624 C CB . ASP D 1 315 ? 43.651 -14.737 34.586 1.00 33.57 ? 315 ASP D CB 1 +ATOM 19625 C CG . ASP D 1 315 ? 44.224 -16.104 34.251 1.00 37.45 ? 315 ASP D CG 1 +ATOM 19626 O OD1 . ASP D 1 315 ? 45.469 -16.213 34.186 1.00 39.74 ? 315 ASP D OD1 1 +ATOM 19627 O OD2 . ASP D 1 315 ? 43.439 -17.066 34.074 1.00 37.01 ? 315 ASP D OD2 1 +ATOM 19628 N N . GLY D 1 316 ? 42.235 -12.780 36.906 1.00 31.75 ? 316 GLY D N 1 +ATOM 19629 C CA . GLY D 1 316 ? 41.700 -11.446 37.112 1.00 29.07 ? 316 GLY D CA 1 +ATOM 19630 C C . GLY D 1 316 ? 40.759 -11.341 38.291 1.00 29.81 ? 316 GLY D C 1 +ATOM 19631 O O . GLY D 1 316 ? 40.199 -12.331 38.758 1.00 29.21 ? 316 GLY D O 1 +ATOM 19632 N N . ILE D 1 317 ? 40.586 -10.119 38.772 1.00 29.89 ? 317 ILE D N 1 +ATOM 19633 C CA . ILE D 1 317 ? 39.721 -9.859 39.911 1.00 30.92 ? 317 ILE D CA 1 +ATOM 19634 C C . ILE D 1 317 ? 38.551 -8.956 39.517 1.00 31.65 ? 317 ILE D C 1 +ATOM 19635 O O . ILE D 1 317 ? 38.719 -7.922 38.860 1.00 30.39 ? 317 ILE D O 1 +ATOM 19636 C CB . ILE D 1 317 ? 40.511 -9.186 41.062 1.00 31.20 ? 317 ILE D CB 1 +ATOM 19637 C CG1 . ILE D 1 317 ? 41.689 -10.077 41.466 1.00 31.86 ? 317 ILE D CG1 1 +ATOM 19638 C CG2 . ILE D 1 317 ? 39.592 -8.954 42.263 1.00 28.29 ? 317 ILE D CG2 1 +ATOM 19639 C CD1 . ILE D 1 317 ? 41.263 -11.420 42.061 1.00 32.00 ? 317 ILE D CD1 1 +ATOM 19640 N N . TRP D 1 318 ? 37.361 -9.359 39.934 1.00 31.47 ? 318 TRP D N 1 +ATOM 19641 C CA . TRP D 1 318 ? 36.151 -8.615 39.638 1.00 31.72 ? 318 TRP D CA 1 +ATOM 19642 C C . TRP D 1 318 ? 35.598 -8.130 40.962 1.00 31.77 ? 318 TRP D C 1 +ATOM 19643 O O . TRP D 1 318 ? 35.045 -8.909 41.731 1.00 33.30 ? 318 TRP D O 1 +ATOM 19644 C CB . TRP D 1 318 ? 35.170 -9.548 38.917 1.00 32.13 ? 318 TRP D CB 1 +ATOM 19645 C CG . TRP D 1 318 ? 33.771 -9.053 38.751 1.00 32.91 ? 318 TRP D CG 1 +ATOM 19646 C CD1 . TRP D 1 318 ? 33.331 -7.766 38.841 1.00 33.58 ? 318 TRP D CD1 1 +ATOM 19647 C CD2 . TRP D 1 318 ? 32.624 -9.849 38.437 1.00 33.40 ? 318 TRP D CD2 1 +ATOM 19648 N NE1 . TRP D 1 318 ? 31.976 -7.711 38.603 1.00 34.55 ? 318 TRP D NE1 1 +ATOM 19649 C CE2 . TRP D 1 318 ? 31.518 -8.976 38.351 1.00 33.83 ? 318 TRP D CE2 1 +ATOM 19650 C CE3 . TRP D 1 318 ? 32.423 -11.221 38.218 1.00 34.46 ? 318 TRP D CE3 1 +ATOM 19651 C CZ2 . TRP D 1 318 ? 30.225 -9.425 38.057 1.00 34.94 ? 318 TRP D CZ2 1 +ATOM 19652 C CZ3 . TRP D 1 318 ? 31.137 -11.672 37.925 1.00 35.57 ? 318 TRP D CZ3 1 +ATOM 19653 C CH2 . TRP D 1 318 ? 30.053 -10.772 37.847 1.00 35.63 ? 318 TRP D CH2 1 +ATOM 19654 N N . LEU D 1 319 ? 35.779 -6.842 41.235 1.00 32.90 ? 319 LEU D N 1 +ATOM 19655 C CA . LEU D 1 319 ? 35.312 -6.228 42.483 1.00 33.53 ? 319 LEU D CA 1 +ATOM 19656 C C . LEU D 1 319 ? 33.853 -5.778 42.357 1.00 34.53 ? 319 LEU D C 1 +ATOM 19657 O O . LEU D 1 319 ? 33.523 -4.937 41.524 1.00 35.88 ? 319 LEU D O 1 +ATOM 19658 C CB . LEU D 1 319 ? 36.192 -5.025 42.828 1.00 30.96 ? 319 LEU D CB 1 +ATOM 19659 C CG . LEU D 1 319 ? 37.684 -5.294 43.025 1.00 31.44 ? 319 LEU D CG 1 +ATOM 19660 C CD1 . LEU D 1 319 ? 38.417 -3.984 43.273 1.00 30.98 ? 319 LEU D CD1 1 +ATOM 19661 C CD2 . LEU D 1 319 ? 37.881 -6.239 44.203 1.00 32.24 ? 319 LEU D CD2 1 +ATOM 19662 N N . ASP D 1 320 ? 32.983 -6.329 43.192 1.00 35.22 ? 320 ASP D N 1 +ATOM 19663 C CA . ASP D 1 320 ? 31.565 -5.989 43.130 1.00 35.79 ? 320 ASP D CA 1 +ATOM 19664 C C . ASP D 1 320 ? 31.013 -5.482 44.459 1.00 35.02 ? 320 ASP D C 1 +ATOM 19665 O O . ASP D 1 320 ? 31.615 -5.694 45.511 1.00 35.53 ? 320 ASP D O 1 +ATOM 19666 C CB . ASP D 1 320 ? 30.780 -7.222 42.661 1.00 38.46 ? 320 ASP D CB 1 +ATOM 19667 C CG . ASP D 1 320 ? 29.344 -6.904 42.298 1.00 39.48 ? 320 ASP D CG 1 +ATOM 19668 O OD1 . ASP D 1 320 ? 29.085 -5.797 41.779 1.00 41.33 ? 320 ASP D OD1 1 +ATOM 19669 O OD2 . ASP D 1 320 ? 28.475 -7.772 42.516 1.00 41.73 ? 320 ASP D OD2 1 +ATOM 19670 N N . MET D 1 321 ? 29.879 -4.787 44.399 1.00 35.06 ? 321 MET D N 1 +ATOM 19671 C CA . MET D 1 321 ? 29.214 -4.263 45.596 1.00 34.99 ? 321 MET D CA 1 +ATOM 19672 C C . MET D 1 321 ? 30.092 -3.284 46.369 1.00 34.96 ? 321 MET D C 1 +ATOM 19673 O O . MET D 1 321 ? 29.809 -2.974 47.529 1.00 34.38 ? 321 MET D O 1 +ATOM 19674 C CB . MET D 1 321 ? 28.847 -5.420 46.538 1.00 35.75 ? 321 MET D CB 1 +ATOM 19675 C CG . MET D 1 321 ? 28.176 -6.615 45.874 1.00 35.82 ? 321 MET D CG 1 +ATOM 19676 S SD . MET D 1 321 ? 26.655 -6.167 45.020 1.00 39.28 ? 321 MET D SD 1 +ATOM 19677 C CE . MET D 1 321 ? 25.638 -5.551 46.393 1.00 39.10 ? 321 MET D CE 1 +ATOM 19678 N N . ASN D 1 322 ? 31.145 -2.788 45.729 1.00 34.56 ? 322 ASN D N 1 +ATOM 19679 C CA . ASN D 1 322 ? 32.084 -1.902 46.409 1.00 34.89 ? 322 ASN D CA 1 +ATOM 19680 C C . ASN D 1 322 ? 31.763 -0.406 46.410 1.00 34.71 ? 322 ASN D C 1 +ATOM 19681 O O . ASN D 1 322 ? 32.672 0.421 46.378 1.00 34.83 ? 322 ASN D O 1 +ATOM 19682 C CB . ASN D 1 322 ? 33.489 -2.145 45.845 1.00 34.55 ? 322 ASN D CB 1 +ATOM 19683 C CG . ASN D 1 322 ? 33.592 -1.816 44.360 1.00 38.14 ? 322 ASN D CG 1 +ATOM 19684 O OD1 . ASN D 1 322 ? 32.597 -1.876 43.626 1.00 38.37 ? 322 ASN D OD1 1 +ATOM 19685 N ND2 . ASN D 1 322 ? 34.806 -1.482 43.905 1.00 37.39 ? 322 ASN D ND2 1 +ATOM 19686 N N . GLU D 1 323 ? 30.480 -0.059 46.480 1.00 34.06 ? 323 GLU D N 1 +ATOM 19687 C CA . GLU D 1 323 ? 30.069 1.344 46.493 1.00 33.90 ? 323 GLU D CA 1 +ATOM 19688 C C . GLU D 1 323 ? 30.586 2.187 47.664 1.00 33.76 ? 323 GLU D C 1 +ATOM 19689 O O . GLU D 1 323 ? 30.936 3.356 47.468 1.00 34.43 ? 323 GLU D O 1 +ATOM 19690 C CB . GLU D 1 323 ? 28.539 1.467 46.438 1.00 34.92 ? 323 GLU D CB 1 +ATOM 19691 C CG . GLU D 1 323 ? 27.925 1.173 45.077 1.00 36.18 ? 323 GLU D CG 1 +ATOM 19692 C CD . GLU D 1 323 ? 28.183 -0.252 44.601 1.00 40.30 ? 323 GLU D CD 1 +ATOM 19693 O OE1 . GLU D 1 323 ? 28.003 -1.199 45.403 1.00 42.21 ? 323 GLU D OE1 1 +ATOM 19694 O OE2 . GLU D 1 323 ? 28.556 -0.431 43.421 1.00 40.07 ? 323 GLU D OE2 1 +ATOM 19695 N N . PRO D 1 324 ? 30.660 1.624 48.888 1.00 32.53 ? 324 PRO D N 1 +ATOM 19696 C CA . PRO D 1 324 ? 30.327 0.271 49.335 1.00 32.63 ? 324 PRO D CA 1 +ATOM 19697 C C . PRO D 1 324 ? 28.849 0.099 49.700 1.00 33.37 ? 324 PRO D C 1 +ATOM 19698 O O . PRO D 1 324 ? 28.192 1.023 50.187 1.00 34.45 ? 324 PRO D O 1 +ATOM 19699 C CB . PRO D 1 324 ? 31.245 0.082 50.534 1.00 31.20 ? 324 PRO D CB 1 +ATOM 19700 C CG . PRO D 1 324 ? 31.199 1.420 51.164 1.00 30.68 ? 324 PRO D CG 1 +ATOM 19701 C CD . PRO D 1 324 ? 31.290 2.379 49.988 1.00 31.84 ? 324 PRO D CD 1 +ATOM 19702 N N . THR D 1 325 ? 28.343 -1.105 49.474 1.00 32.52 ? 325 THR D N 1 +ATOM 19703 C CA . THR D 1 325 ? 26.958 -1.423 49.752 1.00 32.12 ? 325 THR D CA 1 +ATOM 19704 C C . THR D 1 325 ? 26.787 -2.254 51.020 1.00 31.86 ? 325 THR D C 1 +ATOM 19705 O O . THR D 1 325 ? 27.651 -3.062 51.381 1.00 33.37 ? 325 THR D O 1 +ATOM 19706 C CB . THR D 1 325 ? 26.356 -2.184 48.542 1.00 32.16 ? 325 THR D CB 1 +ATOM 19707 O OG1 . THR D 1 325 ? 26.305 -1.293 47.423 1.00 33.30 ? 325 THR D OG1 1 +ATOM 19708 C CG2 . THR D 1 325 ? 24.950 -2.705 48.845 1.00 29.98 ? 325 THR D CG2 1 +ATOM 19709 N N . ASP D 1 326 ? 25.668 -2.037 51.696 1.00 30.65 ? 326 ASP D N 1 +ATOM 19710 C CA . ASP D 1 326 ? 25.323 -2.783 52.900 1.00 32.27 ? 326 ASP D CA 1 +ATOM 19711 C C . ASP D 1 326 ? 23.795 -2.949 52.947 1.00 33.03 ? 326 ASP D C 1 +ATOM 19712 O O . ASP D 1 326 ? 23.057 -2.026 52.613 1.00 32.62 ? 326 ASP D O 1 +ATOM 19713 C CB . ASP D 1 326 ? 25.786 -2.049 54.149 1.00 31.56 ? 326 ASP D CB 1 +ATOM 19714 C CG . ASP D 1 326 ? 25.340 -2.743 55.403 1.00 32.44 ? 326 ASP D CG 1 +ATOM 19715 O OD1 . ASP D 1 326 ? 25.783 -3.888 55.635 1.00 34.12 ? 326 ASP D OD1 1 +ATOM 19716 O OD2 . ASP D 1 326 ? 24.534 -2.159 56.146 1.00 34.04 ? 326 ASP D OD2 1 +ATOM 19717 N N . PHE D 1 327 ? 23.326 -4.112 53.383 1.00 33.83 ? 327 PHE D N 1 +ATOM 19718 C CA . PHE D 1 327 ? 21.894 -4.381 53.429 1.00 33.53 ? 327 PHE D CA 1 +ATOM 19719 C C . PHE D 1 327 ? 21.256 -4.453 54.807 1.00 34.75 ? 327 PHE D C 1 +ATOM 19720 O O . PHE D 1 327 ? 20.072 -4.784 54.921 1.00 33.15 ? 327 PHE D O 1 +ATOM 19721 C CB . PHE D 1 327 ? 21.606 -5.679 52.677 1.00 33.97 ? 327 PHE D CB 1 +ATOM 19722 C CG . PHE D 1 327 ? 21.899 -5.595 51.204 1.00 36.27 ? 327 PHE D CG 1 +ATOM 19723 C CD1 . PHE D 1 327 ? 21.140 -4.767 50.378 1.00 36.83 ? 327 PHE D CD1 1 +ATOM 19724 C CD2 . PHE D 1 327 ? 22.942 -6.325 50.645 1.00 36.38 ? 327 PHE D CD2 1 +ATOM 19725 C CE1 . PHE D 1 327 ? 21.419 -4.666 49.011 1.00 38.70 ? 327 PHE D CE1 1 +ATOM 19726 C CE2 . PHE D 1 327 ? 23.233 -6.236 49.284 1.00 36.99 ? 327 PHE D CE2 1 +ATOM 19727 C CZ . PHE D 1 327 ? 22.471 -5.405 48.464 1.00 39.09 ? 327 PHE D CZ 1 +ATOM 19728 N N . SER D 1 328 ? 22.011 -4.135 55.855 1.00 34.66 ? 328 SER D N 1 +ATOM 19729 C CA . SER D 1 328 ? 21.436 -4.212 57.185 1.00 36.39 ? 328 SER D CA 1 +ATOM 19730 C C . SER D 1 328 ? 20.221 -3.301 57.384 1.00 37.74 ? 328 SER D C 1 +ATOM 19731 O O . SER D 1 328 ? 19.261 -3.699 58.041 1.00 37.39 ? 328 SER D O 1 +ATOM 19732 C CB . SER D 1 328 ? 22.501 -3.927 58.246 1.00 35.94 ? 328 SER D CB 1 +ATOM 19733 O OG . SER D 1 328 ? 23.089 -2.657 58.063 1.00 37.51 ? 328 SER D OG 1 +ATOM 19734 N N . ARG D 1 329 ? 20.245 -2.090 56.823 1.00 39.31 ? 329 ARG D N 1 +ATOM 19735 C CA . ARG D 1 329 ? 19.103 -1.180 56.980 1.00 39.79 ? 329 ARG D CA 1 +ATOM 19736 C C . ARG D 1 329 ? 17.863 -1.722 56.254 1.00 39.89 ? 329 ARG D C 1 +ATOM 19737 O O . ARG D 1 329 ? 16.756 -1.728 56.798 1.00 37.83 ? 329 ARG D O 1 +ATOM 19738 C CB . ARG D 1 329 ? 19.437 0.211 56.436 1.00 42.37 ? 329 ARG D CB 1 +ATOM 19739 C CG . ARG D 1 329 ? 19.539 1.311 57.498 1.00 44.92 ? 329 ARG D CG 1 +ATOM 19740 C CD . ARG D 1 329 ? 20.984 1.735 57.751 1.00 45.70 ? 329 ARG D CD 1 +ATOM 19741 N NE . ARG D 1 329 ? 21.656 2.196 56.532 1.00 48.92 ? 329 ARG D NE 1 +ATOM 19742 C CZ . ARG D 1 329 ? 21.372 3.322 55.878 1.00 49.09 ? 329 ARG D CZ 1 +ATOM 19743 N NH1 . ARG D 1 329 ? 20.419 4.133 56.317 1.00 48.85 ? 329 ARG D NH1 1 +ATOM 19744 N NH2 . ARG D 1 329 ? 22.044 3.634 54.775 1.00 48.88 ? 329 ARG D NH2 1 +ATOM 19745 N N . ALA D 1 330 ? 18.054 -2.175 55.021 1.00 39.44 ? 330 ALA D N 1 +ATOM 19746 C CA . ALA D 1 330 ? 16.955 -2.717 54.237 1.00 39.65 ? 330 ALA D CA 1 +ATOM 19747 C C . ALA D 1 330 ? 16.337 -3.916 54.938 1.00 41.58 ? 330 ALA D C 1 +ATOM 19748 O O . ALA D 1 330 ? 15.117 -4.019 55.046 1.00 42.34 ? 330 ALA D O 1 +ATOM 19749 C CB . ALA D 1 330 ? 17.446 -3.121 52.862 1.00 38.16 ? 330 ALA D CB 1 +ATOM 19750 N N . ILE D 1 331 ? 17.187 -4.821 55.416 1.00 43.43 ? 331 ILE D N 1 +ATOM 19751 C CA . ILE D 1 331 ? 16.737 -6.025 56.104 1.00 42.67 ? 331 ILE D CA 1 +ATOM 19752 C C . ILE D 1 331 ? 16.035 -5.700 57.407 1.00 44.07 ? 331 ILE D C 1 +ATOM 19753 O O . ILE D 1 331 ? 15.076 -6.365 57.783 1.00 44.24 ? 331 ILE D O 1 +ATOM 19754 C CB . ILE D 1 331 ? 17.930 -6.969 56.346 1.00 42.36 ? 331 ILE D CB 1 +ATOM 19755 C CG1 . ILE D 1 331 ? 18.291 -7.648 55.021 1.00 41.16 ? 331 ILE D CG1 1 +ATOM 19756 C CG2 . ILE D 1 331 ? 17.607 -7.995 57.424 1.00 39.68 ? 331 ILE D CG2 1 +ATOM 19757 C CD1 . ILE D 1 331 ? 19.525 -8.503 55.077 1.00 42.54 ? 331 ILE D CD1 1 +ATOM 19758 N N . GLU D 1 332 ? 16.508 -4.667 58.087 1.00 46.71 ? 332 GLU D N 1 +ATOM 19759 C CA . GLU D 1 332 ? 15.915 -4.226 59.348 1.00 49.53 ? 332 GLU D CA 1 +ATOM 19760 C C . GLU D 1 332 ? 14.457 -3.800 59.086 1.00 49.93 ? 332 GLU D C 1 +ATOM 19761 O O . GLU D 1 332 ? 13.545 -4.146 59.837 1.00 49.97 ? 332 GLU D O 1 +ATOM 19762 C CB . GLU D 1 332 ? 16.742 -3.057 59.891 1.00 52.19 ? 332 GLU D CB 1 +ATOM 19763 C CG . GLU D 1 332 ? 16.372 -2.560 61.264 1.00 58.42 ? 332 GLU D CG 1 +ATOM 19764 C CD . GLU D 1 332 ? 17.425 -1.613 61.829 1.00 62.77 ? 332 GLU D CD 1 +ATOM 19765 O OE1 . GLU D 1 332 ? 17.760 -0.613 61.148 1.00 64.65 ? 332 GLU D OE1 1 +ATOM 19766 O OE2 . GLU D 1 332 ? 17.917 -1.869 62.954 1.00 65.40 ? 332 GLU D OE2 1 +ATOM 19767 N N . ILE D 1 333 ? 14.248 -3.059 58.002 1.00 50.26 ? 333 ILE D N 1 +ATOM 19768 C CA . ILE D 1 333 ? 12.920 -2.589 57.619 1.00 51.09 ? 333 ILE D CA 1 +ATOM 19769 C C . ILE D 1 333 ? 12.028 -3.762 57.233 1.00 52.94 ? 333 ILE D C 1 +ATOM 19770 O O . ILE D 1 333 ? 10.858 -3.831 57.618 1.00 52.22 ? 333 ILE D O 1 +ATOM 19771 C CB . ILE D 1 333 ? 13.005 -1.629 56.416 1.00 49.10 ? 333 ILE D CB 1 +ATOM 19772 C CG1 . ILE D 1 333 ? 13.694 -0.332 56.835 1.00 48.03 ? 333 ILE D CG1 1 +ATOM 19773 C CG2 . ILE D 1 333 ? 11.617 -1.337 55.875 1.00 49.38 ? 333 ILE D CG2 1 +ATOM 19774 C CD1 . ILE D 1 333 ? 14.042 0.567 55.670 1.00 45.74 ? 333 ILE D CD1 1 +ATOM 19775 N N . ARG D 1 334 ? 12.591 -4.684 56.464 1.00 55.00 ? 334 ARG D N 1 +ATOM 19776 C CA . ARG D 1 334 ? 11.852 -5.854 56.020 1.00 57.66 ? 334 ARG D CA 1 +ATOM 19777 C C . ARG D 1 334 ? 11.447 -6.774 57.181 1.00 58.68 ? 334 ARG D C 1 +ATOM 19778 O O . ARG D 1 334 ? 10.439 -7.468 57.095 1.00 59.00 ? 334 ARG D O 1 +ATOM 19779 C CB . ARG D 1 334 ? 12.680 -6.613 54.976 1.00 60.10 ? 334 ARG D CB 1 +ATOM 19780 C CG . ARG D 1 334 ? 12.044 -7.895 54.455 1.00 63.14 ? 334 ARG D CG 1 +ATOM 19781 C CD . ARG D 1 334 ? 12.663 -9.130 55.111 1.00 65.95 ? 334 ARG D CD 1 +ATOM 19782 N NE . ARG D 1 334 ? 13.898 -9.561 54.456 1.00 67.57 ? 334 ARG D NE 1 +ATOM 19783 C CZ . ARG D 1 334 ? 14.761 -10.427 54.986 1.00 69.79 ? 334 ARG D CZ 1 +ATOM 19784 N NH1 . ARG D 1 334 ? 14.530 -10.952 56.183 1.00 70.07 ? 334 ARG D NH1 1 +ATOM 19785 N NH2 . ARG D 1 334 ? 15.853 -10.780 54.316 1.00 69.49 ? 334 ARG D NH2 1 +ATOM 19786 N N . ASP D 1 335 ? 12.215 -6.777 58.267 1.00 58.94 ? 335 ASP D N 1 +ATOM 19787 C CA . ASP D 1 335 ? 11.872 -7.620 59.411 1.00 59.73 ? 335 ASP D CA 1 +ATOM 19788 C C . ASP D 1 335 ? 10.747 -7.017 60.250 1.00 59.20 ? 335 ASP D C 1 +ATOM 19789 O O . ASP D 1 335 ? 9.866 -7.731 60.729 1.00 59.59 ? 335 ASP D O 1 +ATOM 19790 C CB . ASP D 1 335 ? 13.084 -7.839 60.328 1.00 61.49 ? 335 ASP D CB 1 +ATOM 19791 C CG . ASP D 1 335 ? 14.160 -8.700 59.695 1.00 63.38 ? 335 ASP D CG 1 +ATOM 19792 O OD1 . ASP D 1 335 ? 13.843 -9.477 58.762 1.00 64.17 ? 335 ASP D OD1 1 +ATOM 19793 O OD2 . ASP D 1 335 ? 15.323 -8.607 60.152 1.00 63.55 ? 335 ASP D OD2 1 +ATOM 19794 N N . VAL D 1 336 ? 10.792 -5.703 60.438 1.00 57.94 ? 336 VAL D N 1 +ATOM 19795 C CA . VAL D 1 336 ? 9.791 -5.017 61.239 1.00 57.48 ? 336 VAL D CA 1 +ATOM 19796 C C . VAL D 1 336 ? 8.438 -4.852 60.539 1.00 57.77 ? 336 VAL D C 1 +ATOM 19797 O O . VAL D 1 336 ? 7.394 -4.952 61.178 1.00 56.77 ? 336 VAL D O 1 +ATOM 19798 C CB . VAL D 1 336 ? 10.310 -3.628 61.683 1.00 56.81 ? 336 VAL D CB 1 +ATOM 19799 C CG1 . VAL D 1 336 ? 9.240 -2.887 62.468 1.00 55.57 ? 336 VAL D CG1 1 +ATOM 19800 C CG2 . VAL D 1 336 ? 11.558 -3.795 62.527 1.00 55.14 ? 336 VAL D CG2 1 +ATOM 19801 N N . LEU D 1 337 ? 8.452 -4.620 59.230 1.00 58.64 ? 337 LEU D N 1 +ATOM 19802 C CA . LEU D 1 337 ? 7.206 -4.425 58.493 1.00 60.11 ? 337 LEU D CA 1 +ATOM 19803 C C . LEU D 1 337 ? 6.869 -5.538 57.498 1.00 61.55 ? 337 LEU D C 1 +ATOM 19804 O O . LEU D 1 337 ? 6.032 -5.355 56.620 1.00 60.89 ? 337 LEU D O 1 +ATOM 19805 C CB . LEU D 1 337 ? 7.252 -3.081 57.761 1.00 58.49 ? 337 LEU D CB 1 +ATOM 19806 C CG . LEU D 1 337 ? 7.624 -1.871 58.621 1.00 57.76 ? 337 LEU D CG 1 +ATOM 19807 C CD1 . LEU D 1 337 ? 7.729 -0.641 57.734 1.00 57.72 ? 337 LEU D CD1 1 +ATOM 19808 C CD2 . LEU D 1 337 ? 6.588 -1.663 59.719 1.00 56.37 ? 337 LEU D CD2 1 +ATOM 19809 N N . SER D 1 338 ? 7.508 -6.694 57.639 1.00 63.67 ? 338 SER D N 1 +ATOM 19810 C CA . SER D 1 338 ? 7.273 -7.832 56.743 1.00 64.85 ? 338 SER D CA 1 +ATOM 19811 C C . SER D 1 338 ? 5.803 -8.246 56.666 1.00 66.21 ? 338 SER D C 1 +ATOM 19812 O O . SER D 1 338 ? 5.272 -8.511 55.585 1.00 65.84 ? 338 SER D O 1 +ATOM 19813 C CB . SER D 1 338 ? 8.094 -9.034 57.213 1.00 65.01 ? 338 SER D CB 1 +ATOM 19814 O OG . SER D 1 338 ? 7.837 -9.312 58.585 1.00 64.08 ? 338 SER D OG 1 +ATOM 19815 N N . SER D 1 339 ? 5.163 -8.312 57.829 1.00 67.54 ? 339 SER D N 1 +ATOM 19816 C CA . SER D 1 339 ? 3.761 -8.706 57.950 1.00 68.43 ? 339 SER D CA 1 +ATOM 19817 C C . SER D 1 339 ? 2.810 -7.804 57.171 1.00 68.83 ? 339 SER D C 1 +ATOM 19818 O O . SER D 1 339 ? 2.010 -8.271 56.362 1.00 68.51 ? 339 SER D O 1 +ATOM 19819 C CB . SER D 1 339 ? 3.362 -8.702 59.428 1.00 69.19 ? 339 SER D CB 1 +ATOM 19820 O OG . SER D 1 339 ? 3.651 -7.449 60.036 1.00 69.45 ? 339 SER D OG 1 +ATOM 19821 N N . LEU D 1 340 ? 2.905 -6.510 57.448 1.00 69.58 ? 340 LEU D N 1 +ATOM 19822 C CA . LEU D 1 340 ? 2.087 -5.483 56.822 1.00 70.18 ? 340 LEU D CA 1 +ATOM 19823 C C . LEU D 1 340 ? 1.954 -5.714 55.308 1.00 70.71 ? 340 LEU D C 1 +ATOM 19824 O O . LEU D 1 340 ? 2.951 -5.898 54.612 1.00 70.52 ? 340 LEU D O 1 +ATOM 19825 C CB . LEU D 1 340 ? 2.726 -4.126 57.116 1.00 70.48 ? 340 LEU D CB 1 +ATOM 19826 C CG . LEU D 1 340 ? 1.942 -2.836 56.922 1.00 71.18 ? 340 LEU D CG 1 +ATOM 19827 C CD1 . LEU D 1 340 ? 0.673 -2.860 57.759 1.00 71.55 ? 340 LEU D CD1 1 +ATOM 19828 C CD2 . LEU D 1 340 ? 2.832 -1.672 57.325 1.00 71.57 ? 340 LEU D CD2 1 +ATOM 19829 N N . PRO D 1 341 ? 0.712 -5.712 54.786 1.00 71.36 ? 341 PRO D N 1 +ATOM 19830 C CA . PRO D 1 341 ? 0.416 -5.922 53.360 1.00 71.73 ? 341 PRO D CA 1 +ATOM 19831 C C . PRO D 1 341 ? 0.621 -4.688 52.475 1.00 72.31 ? 341 PRO D C 1 +ATOM 19832 O O . PRO D 1 341 ? -0.025 -4.545 51.435 1.00 72.43 ? 341 PRO D O 1 +ATOM 19833 C CB . PRO D 1 341 ? -1.042 -6.363 53.385 1.00 71.59 ? 341 PRO D CB 1 +ATOM 19834 C CG . PRO D 1 341 ? -1.602 -5.517 54.485 1.00 71.25 ? 341 PRO D CG 1 +ATOM 19835 C CD . PRO D 1 341 ? -0.538 -5.629 55.568 1.00 71.08 ? 341 PRO D CD 1 +ATOM 19836 N N . VAL D 1 342 ? 1.531 -3.813 52.884 1.00 72.74 ? 342 VAL D N 1 +ATOM 19837 C CA . VAL D 1 342 ? 1.807 -2.581 52.153 1.00 72.32 ? 342 VAL D CA 1 +ATOM 19838 C C . VAL D 1 342 ? 3.074 -2.629 51.299 1.00 72.60 ? 342 VAL D C 1 +ATOM 19839 O O . VAL D 1 342 ? 4.026 -3.345 51.616 1.00 72.18 ? 342 VAL D O 1 +ATOM 19840 C CB . VAL D 1 342 ? 1.906 -1.400 53.135 1.00 71.80 ? 342 VAL D CB 1 +ATOM 19841 C CG1 . VAL D 1 342 ? 2.346 -0.144 52.406 1.00 72.66 ? 342 VAL D CG1 1 +ATOM 19842 C CG2 . VAL D 1 342 ? 0.556 -1.184 53.810 1.00 70.91 ? 342 VAL D CG2 1 +ATOM 19843 N N . GLN D 1 343 ? 3.072 -1.852 50.215 1.00 72.78 ? 343 GLN D N 1 +ATOM 19844 C CA . GLN D 1 343 ? 4.207 -1.788 49.300 1.00 73.51 ? 343 GLN D CA 1 +ATOM 19845 C C . GLN D 1 343 ? 5.212 -0.720 49.725 1.00 73.31 ? 343 GLN D C 1 +ATOM 19846 O O . GLN D 1 343 ? 4.853 0.441 49.913 1.00 73.08 ? 343 GLN D O 1 +ATOM 19847 C CB . GLN D 1 343 ? 3.726 -1.488 47.879 1.00 74.20 ? 343 GLN D CB 1 +ATOM 19848 C CG . GLN D 1 343 ? 4.788 -1.733 46.823 1.00 76.97 ? 343 GLN D CG 1 +ATOM 19849 C CD . GLN D 1 343 ? 4.337 -1.341 45.430 1.00 79.01 ? 343 GLN D CD 1 +ATOM 19850 O OE1 . GLN D 1 343 ? 3.238 -1.693 44.995 1.00 79.17 ? 343 GLN D OE1 1 +ATOM 19851 N NE2 . GLN D 1 343 ? 5.194 -0.615 44.714 1.00 80.18 ? 343 GLN D NE2 1 +ATOM 19852 N N . PHE D 1 344 ? 6.473 -1.118 49.862 1.00 73.42 ? 344 PHE D N 1 +ATOM 19853 C CA . PHE D 1 344 ? 7.531 -0.202 50.271 1.00 73.95 ? 344 PHE D CA 1 +ATOM 19854 C C . PHE D 1 344 ? 8.019 0.644 49.099 1.00 73.86 ? 344 PHE D C 1 +ATOM 19855 O O . PHE D 1 344 ? 7.847 0.276 47.940 1.00 73.24 ? 344 PHE D O 1 +ATOM 19856 C CB . PHE D 1 344 ? 8.719 -0.988 50.845 1.00 75.13 ? 344 PHE D CB 1 +ATOM 19857 C CG . PHE D 1 344 ? 8.346 -1.968 51.931 1.00 76.55 ? 344 PHE D CG 1 +ATOM 19858 C CD1 . PHE D 1 344 ? 7.693 -1.542 53.087 1.00 77.62 ? 344 PHE D CD1 1 +ATOM 19859 C CD2 . PHE D 1 344 ? 8.663 -3.320 51.801 1.00 76.91 ? 344 PHE D CD2 1 +ATOM 19860 C CE1 . PHE D 1 344 ? 7.362 -2.449 54.099 1.00 77.49 ? 344 PHE D CE1 1 +ATOM 19861 C CE2 . PHE D 1 344 ? 8.338 -4.235 52.805 1.00 76.65 ? 344 PHE D CE2 1 +ATOM 19862 C CZ . PHE D 1 344 ? 7.687 -3.797 53.955 1.00 77.58 ? 344 PHE D CZ 1 +ATOM 19863 N N . ARG D 1 345 ? 8.620 1.788 49.402 1.00 74.85 ? 345 ARG D N 1 +ATOM 19864 C CA . ARG D 1 345 ? 9.152 2.652 48.357 1.00 76.46 ? 345 ARG D CA 1 +ATOM 19865 C C . ARG D 1 345 ? 10.583 2.175 48.151 1.00 75.98 ? 345 ARG D C 1 +ATOM 19866 O O . ARG D 1 345 ? 11.213 1.675 49.083 1.00 75.50 ? 345 ARG D O 1 +ATOM 19867 C CB . ARG D 1 345 ? 9.144 4.118 48.805 1.00 77.99 ? 345 ARG D CB 1 +ATOM 19868 C CG . ARG D 1 345 ? 10.044 4.402 49.988 1.00 81.00 ? 345 ARG D CG 1 +ATOM 19869 C CD . ARG D 1 345 ? 9.824 5.800 50.537 1.00 83.40 ? 345 ARG D CD 1 +ATOM 19870 N NE . ARG D 1 345 ? 10.687 6.047 51.688 1.00 86.42 ? 345 ARG D NE 1 +ATOM 19871 C CZ . ARG D 1 345 ? 10.574 7.090 52.502 1.00 87.47 ? 345 ARG D CZ 1 +ATOM 19872 N NH1 . ARG D 1 345 ? 9.626 7.994 52.296 1.00 87.93 ? 345 ARG D NH1 1 +ATOM 19873 N NH2 . ARG D 1 345 ? 11.410 7.227 53.525 1.00 88.62 ? 345 ARG D NH2 1 +ATOM 19874 N N . ASP D 1 346 ? 11.101 2.315 46.939 1.00 75.37 ? 346 ASP D N 1 +ATOM 19875 C CA . ASP D 1 346 ? 12.459 1.863 46.678 1.00 74.40 ? 346 ASP D CA 1 +ATOM 19876 C C . ASP D 1 346 ? 13.485 2.982 46.806 1.00 71.95 ? 346 ASP D C 1 +ATOM 19877 O O . ASP D 1 346 ? 13.885 3.584 45.809 1.00 72.22 ? 346 ASP D O 1 +ATOM 19878 C CB . ASP D 1 346 ? 12.555 1.238 45.283 1.00 76.84 ? 346 ASP D CB 1 +ATOM 19879 C CG . ASP D 1 346 ? 13.879 0.525 45.058 1.00 78.47 ? 346 ASP D CG 1 +ATOM 19880 O OD1 . ASP D 1 346 ? 14.935 1.169 45.232 1.00 79.56 ? 346 ASP D OD1 1 +ATOM 19881 O OD2 . ASP D 1 346 ? 13.866 -0.677 44.710 1.00 79.15 ? 346 ASP D OD2 1 +ATOM 19882 N N . ASP D 1 347 ? 13.900 3.264 48.038 1.00 68.61 ? 347 ASP D N 1 +ATOM 19883 C CA . ASP D 1 347 ? 14.900 4.292 48.275 1.00 64.59 ? 347 ASP D CA 1 +ATOM 19884 C C . ASP D 1 347 ? 16.259 3.600 48.286 1.00 60.44 ? 347 ASP D C 1 +ATOM 19885 O O . ASP D 1 347 ? 16.618 2.915 49.243 1.00 59.15 ? 347 ASP D O 1 +ATOM 19886 C CB . ASP D 1 347 ? 14.644 5.011 49.601 1.00 66.27 ? 347 ASP D CB 1 +ATOM 19887 C CG . ASP D 1 347 ? 15.729 6.026 49.931 1.00 69.71 ? 347 ASP D CG 1 +ATOM 19888 O OD1 . ASP D 1 347 ? 16.256 6.672 48.992 1.00 70.21 ? 347 ASP D OD1 1 +ATOM 19889 O OD2 . ASP D 1 347 ? 16.050 6.184 51.133 1.00 71.44 ? 347 ASP D OD2 1 +ATOM 19890 N N . ARG D 1 348 ? 16.998 3.774 47.196 1.00 55.64 ? 348 ARG D N 1 +ATOM 19891 C CA . ARG D 1 348 ? 18.309 3.163 47.031 1.00 51.40 ? 348 ARG D CA 1 +ATOM 19892 C C . ARG D 1 348 ? 19.340 3.612 48.059 1.00 48.56 ? 348 ARG D C 1 +ATOM 19893 O O . ARG D 1 348 ? 20.251 2.860 48.394 1.00 48.27 ? 348 ARG D O 1 +ATOM 19894 C CB . ARG D 1 348 ? 18.815 3.445 45.617 1.00 51.25 ? 348 ARG D CB 1 +ATOM 19895 C CG . ARG D 1 348 ? 18.012 2.744 44.525 1.00 48.81 ? 348 ARG D CG 1 +ATOM 19896 C CD . ARG D 1 348 ? 18.519 1.329 44.307 1.00 49.20 ? 348 ARG D CD 1 +ATOM 19897 N NE . ARG D 1 348 ? 17.738 0.296 44.975 1.00 47.94 ? 348 ARG D NE 1 +ATOM 19898 C CZ . ARG D 1 348 ? 18.187 -0.934 45.221 1.00 49.59 ? 348 ARG D CZ 1 +ATOM 19899 N NH1 . ARG D 1 348 ? 19.419 -1.287 44.867 1.00 48.80 ? 348 ARG D NH1 1 +ATOM 19900 N NH2 . ARG D 1 348 ? 17.396 -1.829 45.794 1.00 50.81 ? 348 ARG D NH2 1 +ATOM 19901 N N . LEU D 1 349 ? 19.196 4.832 48.562 1.00 46.10 ? 349 LEU D N 1 +ATOM 19902 C CA . LEU D 1 349 ? 20.124 5.346 49.556 1.00 43.45 ? 349 LEU D CA 1 +ATOM 19903 C C . LEU D 1 349 ? 20.153 4.491 50.813 1.00 41.36 ? 349 LEU D C 1 +ATOM 19904 O O . LEU D 1 349 ? 21.083 4.593 51.607 1.00 40.01 ? 349 LEU D O 1 +ATOM 19905 C CB . LEU D 1 349 ? 19.769 6.786 49.916 1.00 43.47 ? 349 LEU D CB 1 +ATOM 19906 C CG . LEU D 1 349 ? 20.021 7.793 48.787 1.00 45.89 ? 349 LEU D CG 1 +ATOM 19907 C CD1 . LEU D 1 349 ? 19.571 9.179 49.232 1.00 46.09 ? 349 LEU D CD1 1 +ATOM 19908 C CD2 . LEU D 1 349 ? 21.506 7.810 48.416 1.00 45.73 ? 349 LEU D CD2 1 +ATOM 19909 N N . VAL D 1 350 ? 19.143 3.644 50.990 1.00 38.71 ? 350 VAL D N 1 +ATOM 19910 C CA . VAL D 1 350 ? 19.082 2.779 52.166 1.00 37.99 ? 350 VAL D CA 1 +ATOM 19911 C C . VAL D 1 350 ? 20.168 1.693 52.124 1.00 36.49 ? 350 VAL D C 1 +ATOM 19912 O O . VAL D 1 350 ? 20.496 1.098 53.147 1.00 35.16 ? 350 VAL D O 1 +ATOM 19913 C CB . VAL D 1 350 ? 17.698 2.086 52.295 1.00 38.70 ? 350 VAL D CB 1 +ATOM 19914 C CG1 . VAL D 1 350 ? 17.555 0.988 51.231 1.00 40.07 ? 350 VAL D CG1 1 +ATOM 19915 C CG2 . VAL D 1 350 ? 17.538 1.496 53.680 1.00 39.09 ? 350 VAL D CG2 1 +ATOM 19916 N N . THR D 1 351 ? 20.719 1.437 50.942 1.00 36.24 ? 351 THR D N 1 +ATOM 19917 C CA . THR D 1 351 ? 21.756 0.421 50.792 1.00 36.96 ? 351 THR D CA 1 +ATOM 19918 C C . THR D 1 351 ? 23.177 0.952 50.992 1.00 37.16 ? 351 THR D C 1 +ATOM 19919 O O . THR D 1 351 ? 24.141 0.203 50.844 1.00 39.25 ? 351 THR D O 1 +ATOM 19920 C CB . THR D 1 351 ? 21.714 -0.258 49.407 1.00 36.94 ? 351 THR D CB 1 +ATOM 19921 O OG1 . THR D 1 351 ? 22.103 0.687 48.400 1.00 38.03 ? 351 THR D OG1 1 +ATOM 19922 C CG2 . THR D 1 351 ? 20.320 -0.796 49.112 1.00 36.57 ? 351 THR D CG2 1 +ATOM 19923 N N . THR D 1 352 ? 23.321 2.234 51.307 1.00 35.85 ? 352 THR D N 1 +ATOM 19924 C CA . THR D 1 352 ? 24.651 2.783 51.548 1.00 36.51 ? 352 THR D CA 1 +ATOM 19925 C C . THR D 1 352 ? 25.000 2.520 53.019 1.00 36.43 ? 352 THR D C 1 +ATOM 19926 O O . THR D 1 352 ? 24.143 2.100 53.798 1.00 36.65 ? 352 THR D O 1 +ATOM 19927 C CB . THR D 1 352 ? 24.704 4.307 51.323 1.00 35.37 ? 352 THR D CB 1 +ATOM 19928 O OG1 . THR D 1 352 ? 23.915 4.957 52.325 1.00 35.63 ? 352 THR D OG1 1 +ATOM 19929 C CG2 . THR D 1 352 ? 24.190 4.670 49.946 1.00 33.98 ? 352 THR D CG2 1 +ATOM 19930 N N . PHE D 1 353 ? 26.254 2.757 53.393 1.00 36.22 ? 353 PHE D N 1 +ATOM 19931 C CA . PHE D 1 353 ? 26.680 2.566 54.776 1.00 36.65 ? 353 PHE D CA 1 +ATOM 19932 C C . PHE D 1 353 ? 25.930 3.554 55.658 1.00 36.94 ? 353 PHE D C 1 +ATOM 19933 O O . PHE D 1 353 ? 25.572 4.644 55.217 1.00 37.35 ? 353 PHE D O 1 +ATOM 19934 C CB . PHE D 1 353 ? 28.187 2.825 54.923 1.00 36.73 ? 353 PHE D CB 1 +ATOM 19935 C CG . PHE D 1 353 ? 29.056 1.623 54.651 1.00 36.50 ? 353 PHE D CG 1 +ATOM 19936 C CD1 . PHE D 1 353 ? 28.555 0.505 53.987 1.00 35.36 ? 353 PHE D CD1 1 +ATOM 19937 C CD2 . PHE D 1 353 ? 30.395 1.622 55.045 1.00 37.63 ? 353 PHE D CD2 1 +ATOM 19938 C CE1 . PHE D 1 353 ? 29.370 -0.599 53.718 1.00 34.52 ? 353 PHE D CE1 1 +ATOM 19939 C CE2 . PHE D 1 353 ? 31.221 0.523 54.783 1.00 37.49 ? 353 PHE D CE2 1 +ATOM 19940 C CZ . PHE D 1 353 ? 30.700 -0.592 54.114 1.00 36.80 ? 353 PHE D CZ 1 +ATOM 19941 N N . PRO D 1 354 ? 25.668 3.177 56.914 1.00 38.30 ? 354 PRO D N 1 +ATOM 19942 C CA . PRO D 1 354 ? 24.962 4.057 57.850 1.00 39.72 ? 354 PRO D CA 1 +ATOM 19943 C C . PRO D 1 354 ? 25.788 5.327 58.079 1.00 41.67 ? 354 PRO D C 1 +ATOM 19944 O O . PRO D 1 354 ? 26.956 5.405 57.679 1.00 42.11 ? 354 PRO D O 1 +ATOM 19945 C CB . PRO D 1 354 ? 24.862 3.207 59.110 1.00 39.33 ? 354 PRO D CB 1 +ATOM 19946 C CG . PRO D 1 354 ? 24.791 1.810 58.567 1.00 39.65 ? 354 PRO D CG 1 +ATOM 19947 C CD . PRO D 1 354 ? 25.845 1.832 57.487 1.00 38.83 ? 354 PRO D CD 1 +ATOM 19948 N N . ASP D 1 355 ? 25.199 6.320 58.730 1.00 43.45 ? 355 ASP D N 1 +ATOM 19949 C CA . ASP D 1 355 ? 25.915 7.570 58.965 1.00 46.76 ? 355 ASP D CA 1 +ATOM 19950 C C . ASP D 1 355 ? 26.943 7.550 60.086 1.00 44.52 ? 355 ASP D C 1 +ATOM 19951 O O . ASP D 1 355 ? 27.853 8.370 60.101 1.00 45.09 ? 355 ASP D O 1 +ATOM 19952 C CB . ASP D 1 355 ? 24.922 8.706 59.209 1.00 52.22 ? 355 ASP D CB 1 +ATOM 19953 C CG . ASP D 1 355 ? 24.282 9.201 57.920 1.00 57.94 ? 355 ASP D CG 1 +ATOM 19954 O OD1 . ASP D 1 355 ? 25.023 9.731 57.051 1.00 58.75 ? 355 ASP D OD1 1 +ATOM 19955 O OD2 . ASP D 1 355 ? 23.043 9.054 57.776 1.00 60.76 ? 355 ASP D OD2 1 +ATOM 19956 N N . ASN D 1 356 ? 26.817 6.611 61.011 1.00 41.64 ? 356 ASN D N 1 +ATOM 19957 C CA . ASN D 1 356 ? 27.751 6.549 62.124 1.00 40.34 ? 356 ASN D CA 1 +ATOM 19958 C C . ASN D 1 356 ? 29.039 5.769 61.846 1.00 37.81 ? 356 ASN D C 1 +ATOM 19959 O O . ASN D 1 356 ? 29.806 5.514 62.763 1.00 37.02 ? 356 ASN D O 1 +ATOM 19960 C CB . ASN D 1 356 ? 27.038 5.975 63.350 1.00 39.44 ? 356 ASN D CB 1 +ATOM 19961 C CG . ASN D 1 356 ? 26.538 4.564 63.121 1.00 42.22 ? 356 ASN D CG 1 +ATOM 19962 O OD1 . ASN D 1 356 ? 26.231 4.178 61.989 1.00 42.87 ? 356 ASN D OD1 1 +ATOM 19963 N ND2 . ASN D 1 356 ? 26.443 3.783 64.197 1.00 41.55 ? 356 ASN D ND2 1 +ATOM 19964 N N . VAL D 1 357 ? 29.282 5.402 60.590 1.00 35.82 ? 357 VAL D N 1 +ATOM 19965 C CA . VAL D 1 357 ? 30.491 4.648 60.231 1.00 34.44 ? 357 VAL D CA 1 +ATOM 19966 C C . VAL D 1 357 ? 31.683 5.580 60.042 1.00 34.61 ? 357 VAL D C 1 +ATOM 19967 O O . VAL D 1 357 ? 31.564 6.637 59.430 1.00 34.80 ? 357 VAL D O 1 +ATOM 19968 C CB . VAL D 1 357 ? 30.287 3.819 58.919 1.00 34.03 ? 357 VAL D CB 1 +ATOM 19969 C CG1 . VAL D 1 357 ? 31.602 3.231 58.457 1.00 30.37 ? 357 VAL D CG1 1 +ATOM 19970 C CG2 . VAL D 1 357 ? 29.274 2.696 59.149 1.00 32.81 ? 357 VAL D CG2 1 +ATOM 19971 N N . VAL D 1 358 ? 32.838 5.181 60.566 1.00 35.89 ? 358 VAL D N 1 +ATOM 19972 C CA . VAL D 1 358 ? 34.042 5.997 60.460 1.00 36.43 ? 358 VAL D CA 1 +ATOM 19973 C C . VAL D 1 358 ? 35.225 5.246 59.867 1.00 37.16 ? 358 VAL D C 1 +ATOM 19974 O O . VAL D 1 358 ? 35.283 4.023 59.918 1.00 39.23 ? 358 VAL D O 1 +ATOM 19975 C CB . VAL D 1 358 ? 34.462 6.553 61.847 1.00 36.27 ? 358 VAL D CB 1 +ATOM 19976 C CG1 . VAL D 1 358 ? 33.348 7.401 62.429 1.00 34.60 ? 358 VAL D CG1 1 +ATOM 19977 C CG2 . VAL D 1 358 ? 34.789 5.412 62.790 1.00 35.66 ? 358 VAL D CG2 1 +ATOM 19978 N N . HIS D 1 359 ? 36.170 5.995 59.310 1.00 37.34 ? 359 HIS D N 1 +ATOM 19979 C CA . HIS D 1 359 ? 37.370 5.425 58.709 1.00 38.48 ? 359 HIS D CA 1 +ATOM 19980 C C . HIS D 1 359 ? 38.588 6.198 59.215 1.00 38.77 ? 359 HIS D C 1 +ATOM 19981 O O . HIS D 1 359 ? 38.453 7.261 59.820 1.00 38.38 ? 359 HIS D O 1 +ATOM 19982 C CB . HIS D 1 359 ? 37.328 5.569 57.182 1.00 38.80 ? 359 HIS D CB 1 +ATOM 19983 C CG . HIS D 1 359 ? 36.146 4.917 56.534 1.00 40.28 ? 359 HIS D CG 1 +ATOM 19984 N ND1 . HIS D 1 359 ? 36.064 3.556 56.327 1.00 40.64 ? 359 HIS D ND1 1 +ATOM 19985 C CD2 . HIS D 1 359 ? 35.000 5.443 56.037 1.00 38.89 ? 359 HIS D CD2 1 +ATOM 19986 C CE1 . HIS D 1 359 ? 34.918 3.273 55.731 1.00 39.74 ? 359 HIS D CE1 1 +ATOM 19987 N NE2 . HIS D 1 359 ? 34.255 4.400 55.544 1.00 37.98 ? 359 HIS D NE2 1 +ATOM 19988 N N . TYR D 1 360 ? 39.776 5.661 58.966 1.00 38.98 ? 360 TYR D N 1 +ATOM 19989 C CA . TYR D 1 360 ? 40.998 6.347 59.345 1.00 39.92 ? 360 TYR D CA 1 +ATOM 19990 C C . TYR D 1 360 ? 41.738 6.668 58.068 1.00 39.59 ? 360 TYR D C 1 +ATOM 19991 O O . TYR D 1 360 ? 42.322 5.790 57.438 1.00 41.06 ? 360 TYR D O 1 +ATOM 19992 C CB . TYR D 1 360 ? 41.866 5.485 60.256 1.00 42.27 ? 360 TYR D CB 1 +ATOM 19993 C CG . TYR D 1 360 ? 41.302 5.381 61.647 1.00 46.10 ? 360 TYR D CG 1 +ATOM 19994 C CD1 . TYR D 1 360 ? 40.370 4.393 61.968 1.00 49.08 ? 360 TYR D CD1 1 +ATOM 19995 C CD2 . TYR D 1 360 ? 41.653 6.304 62.633 1.00 46.54 ? 360 TYR D CD2 1 +ATOM 19996 C CE1 . TYR D 1 360 ? 39.799 4.323 63.238 1.00 50.75 ? 360 TYR D CE1 1 +ATOM 19997 C CE2 . TYR D 1 360 ? 41.090 6.247 63.902 1.00 49.69 ? 360 TYR D CE2 1 +ATOM 19998 C CZ . TYR D 1 360 ? 40.162 5.252 64.199 1.00 51.62 ? 360 TYR D CZ 1 +ATOM 19999 O OH . TYR D 1 360 ? 39.590 5.186 65.452 1.00 55.59 ? 360 TYR D OH 1 +ATOM 20000 N N . LEU D 1 361 ? 41.682 7.931 57.668 1.00 38.78 ? 361 LEU D N 1 +ATOM 20001 C CA . LEU D 1 361 ? 42.344 8.363 56.451 1.00 38.41 ? 361 LEU D CA 1 +ATOM 20002 C C . LEU D 1 361 ? 43.594 9.141 56.835 1.00 37.74 ? 361 LEU D C 1 +ATOM 20003 O O . LEU D 1 361 ? 43.515 10.140 57.551 1.00 36.62 ? 361 LEU D O 1 +ATOM 20004 C CB . LEU D 1 361 ? 41.393 9.237 55.627 1.00 37.23 ? 361 LEU D CB 1 +ATOM 20005 C CG . LEU D 1 361 ? 41.950 9.821 54.333 1.00 38.86 ? 361 LEU D CG 1 +ATOM 20006 C CD1 . LEU D 1 361 ? 42.391 8.710 53.396 1.00 36.95 ? 361 LEU D CD1 1 +ATOM 20007 C CD2 . LEU D 1 361 ? 40.890 10.682 53.688 1.00 38.62 ? 361 LEU D CD2 1 +ATOM 20008 N N . ARG D 1 362 ? 44.744 8.674 56.360 1.00 38.17 ? 362 ARG D N 1 +ATOM 20009 C CA . ARG D 1 362 ? 46.018 9.315 56.664 1.00 38.06 ? 362 ARG D CA 1 +ATOM 20010 C C . ARG D 1 362 ? 46.113 9.620 58.159 1.00 39.95 ? 362 ARG D C 1 +ATOM 20011 O O . ARG D 1 362 ? 46.450 10.736 58.572 1.00 38.81 ? 362 ARG D O 1 +ATOM 20012 C CB . ARG D 1 362 ? 46.185 10.594 55.832 1.00 36.04 ? 362 ARG D CB 1 +ATOM 20013 C CG . ARG D 1 362 ? 46.259 10.316 54.325 1.00 36.30 ? 362 ARG D CG 1 +ATOM 20014 C CD . ARG D 1 362 ? 46.715 11.526 53.525 1.00 34.62 ? 362 ARG D CD 1 +ATOM 20015 N NE . ARG D 1 362 ? 45.819 12.672 53.673 1.00 38.85 ? 362 ARG D NE 1 +ATOM 20016 C CZ . ARG D 1 362 ? 44.643 12.806 53.063 1.00 39.07 ? 362 ARG D CZ 1 +ATOM 20017 N NH1 . ARG D 1 362 ? 44.197 11.856 52.244 1.00 40.16 ? 362 ARG D NH1 1 +ATOM 20018 N NH2 . ARG D 1 362 ? 43.915 13.901 53.270 1.00 37.52 ? 362 ARG D NH2 1 +ATOM 20019 N N . GLY D 1 363 ? 45.786 8.613 58.963 1.00 41.11 ? 363 GLY D N 1 +ATOM 20020 C CA . GLY D 1 363 ? 45.848 8.750 60.406 1.00 43.09 ? 363 GLY D CA 1 +ATOM 20021 C C . GLY D 1 363 ? 44.715 9.502 61.079 1.00 44.38 ? 363 GLY D C 1 +ATOM 20022 O O . GLY D 1 363 ? 44.603 9.487 62.307 1.00 46.03 ? 363 GLY D O 1 +ATOM 20023 N N . LYS D 1 364 ? 43.868 10.157 60.297 1.00 44.37 ? 364 LYS D N 1 +ATOM 20024 C CA . LYS D 1 364 ? 42.765 10.923 60.867 1.00 44.13 ? 364 LYS D CA 1 +ATOM 20025 C C . LYS D 1 364 ? 41.431 10.182 60.796 1.00 43.56 ? 364 LYS D C 1 +ATOM 20026 O O . LYS D 1 364 ? 41.119 9.511 59.807 1.00 43.85 ? 364 LYS D O 1 +ATOM 20027 C CB . LYS D 1 364 ? 42.657 12.268 60.149 1.00 45.44 ? 364 LYS D CB 1 +ATOM 20028 C CG . LYS D 1 364 ? 41.565 13.176 60.662 1.00 47.99 ? 364 LYS D CG 1 +ATOM 20029 C CD . LYS D 1 364 ? 41.537 14.479 59.877 1.00 50.69 ? 364 LYS D CD 1 +ATOM 20030 C CE . LYS D 1 364 ? 40.528 15.463 60.458 1.00 53.56 ? 364 LYS D CE 1 +ATOM 20031 N NZ . LYS D 1 364 ? 40.559 16.759 59.720 1.00 54.93 ? 364 LYS D NZ 1 +ATOM 20032 N N . ARG D 1 365 ? 40.649 10.308 61.858 1.00 43.03 ? 365 ARG D N 1 +ATOM 20033 C CA . ARG D 1 365 ? 39.346 9.666 61.949 1.00 44.06 ? 365 ARG D CA 1 +ATOM 20034 C C . ARG D 1 365 ? 38.315 10.542 61.234 1.00 43.41 ? 365 ARG D C 1 +ATOM 20035 O O . ARG D 1 365 ? 38.106 11.694 61.613 1.00 43.84 ? 365 ARG D O 1 +ATOM 20036 C CB . ARG D 1 365 ? 38.990 9.498 63.422 1.00 46.11 ? 365 ARG D CB 1 +ATOM 20037 C CG . ARG D 1 365 ? 37.841 8.568 63.735 1.00 49.40 ? 365 ARG D CG 1 +ATOM 20038 C CD . ARG D 1 365 ? 38.032 8.023 65.147 1.00 52.94 ? 365 ARG D CD 1 +ATOM 20039 N NE . ARG D 1 365 ? 36.812 7.477 65.723 1.00 56.12 ? 365 ARG D NE 1 +ATOM 20040 C CZ . ARG D 1 365 ? 35.737 8.206 66.008 1.00 58.42 ? 365 ARG D CZ 1 +ATOM 20041 N NH1 . ARG D 1 365 ? 35.732 9.513 65.769 1.00 58.62 ? 365 ARG D NH1 1 +ATOM 20042 N NH2 . ARG D 1 365 ? 34.664 7.628 66.533 1.00 58.46 ? 365 ARG D NH2 1 +ATOM 20043 N N . VAL D 1 366 ? 37.684 9.998 60.194 1.00 41.78 ? 366 VAL D N 1 +ATOM 20044 C CA . VAL D 1 366 ? 36.691 10.739 59.420 1.00 40.16 ? 366 VAL D CA 1 +ATOM 20045 C C . VAL D 1 366 ? 35.371 9.992 59.253 1.00 38.78 ? 366 VAL D C 1 +ATOM 20046 O O . VAL D 1 366 ? 35.330 8.766 59.306 1.00 38.43 ? 366 VAL D O 1 +ATOM 20047 C CB . VAL D 1 366 ? 37.227 11.076 58.014 1.00 40.74 ? 366 VAL D CB 1 +ATOM 20048 C CG1 . VAL D 1 366 ? 38.472 11.929 58.122 1.00 41.56 ? 366 VAL D CG1 1 +ATOM 20049 C CG2 . VAL D 1 366 ? 37.547 9.797 57.258 1.00 40.88 ? 366 VAL D CG2 1 +ATOM 20050 N N . LYS D 1 367 ? 34.292 10.744 59.055 1.00 38.75 ? 367 LYS D N 1 +ATOM 20051 C CA . LYS D 1 367 ? 32.974 10.152 58.855 1.00 37.95 ? 367 LYS D CA 1 +ATOM 20052 C C . LYS D 1 367 ? 32.876 9.552 57.457 1.00 36.54 ? 367 LYS D C 1 +ATOM 20053 O O . LYS D 1 367 ? 33.431 10.091 56.493 1.00 34.92 ? 367 LYS D O 1 +ATOM 20054 C CB . LYS D 1 367 ? 31.880 11.200 59.028 1.00 39.81 ? 367 LYS D CB 1 +ATOM 20055 C CG . LYS D 1 367 ? 31.667 11.666 60.457 1.00 43.51 ? 367 LYS D CG 1 +ATOM 20056 C CD . LYS D 1 367 ? 30.499 12.636 60.521 1.00 46.37 ? 367 LYS D CD 1 +ATOM 20057 C CE . LYS D 1 367 ? 30.195 13.040 61.950 1.00 50.97 ? 367 LYS D CE 1 +ATOM 20058 N NZ . LYS D 1 367 ? 28.970 13.898 62.039 1.00 53.75 ? 367 LYS D NZ 1 +ATOM 20059 N N . HIS D 1 368 ? 32.170 8.432 57.357 1.00 35.03 ? 368 HIS D N 1 +ATOM 20060 C CA . HIS D 1 368 ? 31.999 7.755 56.080 1.00 35.09 ? 368 HIS D CA 1 +ATOM 20061 C C . HIS D 1 368 ? 31.392 8.668 55.014 1.00 34.47 ? 368 HIS D C 1 +ATOM 20062 O O . HIS D 1 368 ? 31.781 8.610 53.848 1.00 34.48 ? 368 HIS D O 1 +ATOM 20063 C CB . HIS D 1 368 ? 31.110 6.518 56.248 1.00 33.60 ? 368 HIS D CB 1 +ATOM 20064 C CG . HIS D 1 368 ? 30.834 5.808 54.964 1.00 34.32 ? 368 HIS D CG 1 +ATOM 20065 N ND1 . HIS D 1 368 ? 31.781 5.036 54.323 1.00 36.03 ? 368 HIS D ND1 1 +ATOM 20066 C CD2 . HIS D 1 368 ? 29.747 5.817 54.158 1.00 33.26 ? 368 HIS D CD2 1 +ATOM 20067 C CE1 . HIS D 1 368 ? 31.289 4.604 53.175 1.00 35.97 ? 368 HIS D CE1 1 +ATOM 20068 N NE2 . HIS D 1 368 ? 30.056 5.065 53.051 1.00 35.32 ? 368 HIS D NE2 1 +ATOM 20069 N N . GLU D 1 369 ? 30.447 9.512 55.414 1.00 35.39 ? 369 GLU D N 1 +ATOM 20070 C CA . GLU D 1 369 ? 29.789 10.406 54.467 1.00 38.67 ? 369 GLU D CA 1 +ATOM 20071 C C . GLU D 1 369 ? 30.714 11.458 53.859 1.00 37.72 ? 369 GLU D C 1 +ATOM 20072 O O . GLU D 1 369 ? 30.394 12.048 52.820 1.00 36.95 ? 369 GLU D O 1 +ATOM 20073 C CB . GLU D 1 369 ? 28.588 11.094 55.125 1.00 42.12 ? 369 GLU D CB 1 +ATOM 20074 C CG . GLU D 1 369 ? 28.946 11.959 56.307 1.00 50.33 ? 369 GLU D CG 1 +ATOM 20075 C CD . GLU D 1 369 ? 27.722 12.485 57.029 1.00 55.36 ? 369 GLU D CD 1 +ATOM 20076 O OE1 . GLU D 1 369 ? 27.092 13.452 56.529 1.00 58.86 ? 369 GLU D OE1 1 +ATOM 20077 O OE2 . GLU D 1 369 ? 27.383 11.918 58.093 1.00 58.15 ? 369 GLU D OE2 1 +ATOM 20078 N N . LYS D 1 370 ? 31.856 11.698 54.494 1.00 35.97 ? 370 LYS D N 1 +ATOM 20079 C CA . LYS D 1 370 ? 32.801 12.677 53.968 1.00 36.12 ? 370 LYS D CA 1 +ATOM 20080 C C . LYS D 1 370 ? 33.702 12.079 52.892 1.00 33.60 ? 370 LYS D C 1 +ATOM 20081 O O . LYS D 1 370 ? 34.153 12.781 51.991 1.00 31.22 ? 370 LYS D O 1 +ATOM 20082 C CB . LYS D 1 370 ? 33.690 13.228 55.087 1.00 40.53 ? 370 LYS D CB 1 +ATOM 20083 C CG . LYS D 1 370 ? 32.953 14.026 56.167 1.00 47.41 ? 370 LYS D CG 1 +ATOM 20084 C CD . LYS D 1 370 ? 32.350 15.325 55.611 1.00 51.77 ? 370 LYS D CD 1 +ATOM 20085 C CE . LYS D 1 370 ? 31.710 16.149 56.722 1.00 54.82 ? 370 LYS D CE 1 +ATOM 20086 N NZ . LYS D 1 370 ? 30.636 15.383 57.431 1.00 56.48 ? 370 LYS D NZ 1 +ATOM 20087 N N . VAL D 1 371 ? 33.947 10.776 52.977 1.00 31.69 ? 371 VAL D N 1 +ATOM 20088 C CA . VAL D 1 371 ? 34.849 10.110 52.040 1.00 31.38 ? 371 VAL D CA 1 +ATOM 20089 C C . VAL D 1 371 ? 34.280 8.886 51.312 1.00 31.17 ? 371 VAL D C 1 +ATOM 20090 O O . VAL D 1 371 ? 35.007 8.187 50.593 1.00 29.63 ? 371 VAL D O 1 +ATOM 20091 C CB . VAL D 1 371 ? 36.142 9.664 52.782 1.00 30.09 ? 371 VAL D CB 1 +ATOM 20092 C CG1 . VAL D 1 371 ? 36.786 10.858 53.465 1.00 28.19 ? 371 VAL D CG1 1 +ATOM 20093 C CG2 . VAL D 1 371 ? 35.804 8.580 53.809 1.00 28.18 ? 371 VAL D CG2 1 +ATOM 20094 N N . ARG D 1 372 ? 32.989 8.634 51.493 1.00 30.66 ? 372 ARG D N 1 +ATOM 20095 C CA . ARG D 1 372 ? 32.335 7.487 50.875 1.00 30.38 ? 372 ARG D CA 1 +ATOM 20096 C C . ARG D 1 372 ? 32.748 7.098 49.457 1.00 30.14 ? 372 ARG D C 1 +ATOM 20097 O O . ARG D 1 372 ? 33.166 5.970 49.216 1.00 30.53 ? 372 ARG D O 1 +ATOM 20098 C CB . ARG D 1 372 ? 30.815 7.665 50.888 1.00 29.83 ? 372 ARG D CB 1 +ATOM 20099 C CG . ARG D 1 372 ? 30.090 6.540 50.162 1.00 32.58 ? 372 ARG D CG 1 +ATOM 20100 C CD . ARG D 1 372 ? 28.564 6.604 50.311 1.00 32.21 ? 372 ARG D CD 1 +ATOM 20101 N NE . ARG D 1 372 ? 27.933 5.551 49.518 1.00 32.19 ? 372 ARG D NE 1 +ATOM 20102 C CZ . ARG D 1 372 ? 27.867 4.269 49.869 1.00 33.14 ? 372 ARG D CZ 1 +ATOM 20103 N NH1 . ARG D 1 372 ? 28.386 3.861 51.023 1.00 31.94 ? 372 ARG D NH1 1 +ATOM 20104 N NH2 . ARG D 1 372 ? 27.301 3.387 49.047 1.00 33.76 ? 372 ARG D NH2 1 +ATOM 20105 N N . ASN D 1 373 ? 32.635 8.023 48.516 1.00 29.00 ? 373 ASN D N 1 +ATOM 20106 C CA . ASN D 1 373 ? 32.936 7.692 47.130 1.00 30.01 ? 373 ASN D CA 1 +ATOM 20107 C C . ASN D 1 373 ? 34.339 7.212 46.803 1.00 31.77 ? 373 ASN D C 1 +ATOM 20108 O O . ASN D 1 373 ? 34.553 6.587 45.757 1.00 31.76 ? 373 ASN D O 1 +ATOM 20109 C CB . ASN D 1 373 ? 32.567 8.869 46.228 1.00 29.94 ? 373 ASN D CB 1 +ATOM 20110 C CG . ASN D 1 373 ? 31.124 9.290 46.405 1.00 28.56 ? 373 ASN D CG 1 +ATOM 20111 O OD1 . ASN D 1 373 ? 30.262 8.463 46.697 1.00 28.82 ? 373 ASN D OD1 1 +ATOM 20112 N ND2 . ASN D 1 373 ? 30.852 10.570 46.227 1.00 27.47 ? 373 ASN D ND2 1 +ATOM 20113 N N . ALA D 1 374 ? 35.300 7.484 47.682 1.00 32.55 ? 374 ALA D N 1 +ATOM 20114 C CA . ALA D 1 374 ? 36.668 7.045 47.421 1.00 31.67 ? 374 ALA D CA 1 +ATOM 20115 C C . ALA D 1 374 ? 36.919 5.616 47.908 1.00 31.42 ? 374 ALA D C 1 +ATOM 20116 O O . ALA D 1 374 ? 37.966 5.049 47.640 1.00 32.52 ? 374 ALA D O 1 +ATOM 20117 C CB . ALA D 1 374 ? 37.654 8.003 48.059 1.00 30.93 ? 374 ALA D CB 1 +ATOM 20118 N N . TYR D 1 375 ? 35.950 5.025 48.601 1.00 32.40 ? 375 TYR D N 1 +ATOM 20119 C CA . TYR D 1 375 ? 36.102 3.664 49.122 1.00 31.98 ? 375 TYR D CA 1 +ATOM 20120 C C . TYR D 1 375 ? 36.507 2.677 48.026 1.00 33.30 ? 375 TYR D C 1 +ATOM 20121 O O . TYR D 1 375 ? 37.497 1.968 48.165 1.00 32.64 ? 375 TYR D O 1 +ATOM 20122 C CB . TYR D 1 375 ? 34.804 3.199 49.781 1.00 31.91 ? 375 TYR D CB 1 +ATOM 20123 C CG . TYR D 1 375 ? 34.899 1.872 50.499 1.00 31.98 ? 375 TYR D CG 1 +ATOM 20124 C CD1 . TYR D 1 375 ? 35.302 1.805 51.833 1.00 34.84 ? 375 TYR D CD1 1 +ATOM 20125 C CD2 . TYR D 1 375 ? 34.579 0.681 49.849 1.00 32.48 ? 375 TYR D CD2 1 +ATOM 20126 C CE1 . TYR D 1 375 ? 35.381 0.581 52.509 1.00 34.79 ? 375 TYR D CE1 1 +ATOM 20127 C CE2 . TYR D 1 375 ? 34.653 -0.552 50.509 1.00 32.41 ? 375 TYR D CE2 1 +ATOM 20128 C CZ . TYR D 1 375 ? 35.053 -0.591 51.836 1.00 34.39 ? 375 TYR D CZ 1 +ATOM 20129 O OH . TYR D 1 375 ? 35.121 -1.795 52.491 1.00 35.36 ? 375 TYR D OH 1 +ATOM 20130 N N . PRO D 1 376 ? 35.741 2.612 46.918 1.00 34.06 ? 376 PRO D N 1 +ATOM 20131 C CA . PRO D 1 376 ? 36.116 1.672 45.856 1.00 32.28 ? 376 PRO D CA 1 +ATOM 20132 C C . PRO D 1 376 ? 37.498 1.970 45.274 1.00 31.98 ? 376 PRO D C 1 +ATOM 20133 O O . PRO D 1 376 ? 38.196 1.057 44.820 1.00 30.28 ? 376 PRO D O 1 +ATOM 20134 C CB . PRO D 1 376 ? 34.999 1.847 44.825 1.00 32.58 ? 376 PRO D CB 1 +ATOM 20135 C CG . PRO D 1 376 ? 34.597 3.289 45.002 1.00 34.03 ? 376 PRO D CG 1 +ATOM 20136 C CD . PRO D 1 376 ? 34.558 3.400 46.523 1.00 34.43 ? 376 PRO D CD 1 +ATOM 20137 N N . LEU D 1 377 ? 37.891 3.243 45.277 1.00 31.55 ? 377 LEU D N 1 +ATOM 20138 C CA . LEU D 1 377 ? 39.200 3.612 44.741 1.00 32.25 ? 377 LEU D CA 1 +ATOM 20139 C C . LEU D 1 377 ? 40.310 2.946 45.545 1.00 31.98 ? 377 LEU D C 1 +ATOM 20140 O O . LEU D 1 377 ? 41.249 2.381 44.977 1.00 32.04 ? 377 LEU D O 1 +ATOM 20141 C CB . LEU D 1 377 ? 39.402 5.127 44.770 1.00 32.32 ? 377 LEU D CB 1 +ATOM 20142 C CG . LEU D 1 377 ? 40.813 5.625 44.410 1.00 33.76 ? 377 LEU D CG 1 +ATOM 20143 C CD1 . LEU D 1 377 ? 41.123 5.332 42.951 1.00 34.53 ? 377 LEU D CD1 1 +ATOM 20144 C CD2 . LEU D 1 377 ? 40.904 7.119 44.660 1.00 35.18 ? 377 LEU D CD2 1 +ATOM 20145 N N . TYR D 1 378 ? 40.192 3.003 46.867 1.00 30.63 ? 378 TYR D N 1 +ATOM 20146 C CA . TYR D 1 378 ? 41.200 2.417 47.732 1.00 33.26 ? 378 TYR D CA 1 +ATOM 20147 C C . TYR D 1 378 ? 41.193 0.893 47.706 1.00 34.34 ? 378 TYR D C 1 +ATOM 20148 O O . TYR D 1 378 ? 42.243 0.259 47.889 1.00 33.87 ? 378 TYR D O 1 +ATOM 20149 C CB . TYR D 1 378 ? 41.031 2.948 49.155 1.00 33.72 ? 378 TYR D CB 1 +ATOM 20150 C CG . TYR D 1 378 ? 41.604 4.338 49.331 1.00 33.76 ? 378 TYR D CG 1 +ATOM 20151 C CD1 . TYR D 1 378 ? 42.983 4.542 49.399 1.00 35.79 ? 378 TYR D CD1 1 +ATOM 20152 C CD2 . TYR D 1 378 ? 40.774 5.449 49.378 1.00 34.77 ? 378 TYR D CD2 1 +ATOM 20153 C CE1 . TYR D 1 378 ? 43.521 5.824 49.503 1.00 35.52 ? 378 TYR D CE1 1 +ATOM 20154 C CE2 . TYR D 1 378 ? 41.298 6.734 49.483 1.00 36.14 ? 378 TYR D CE2 1 +ATOM 20155 C CZ . TYR D 1 378 ? 42.675 6.913 49.542 1.00 36.66 ? 378 TYR D CZ 1 +ATOM 20156 O OH . TYR D 1 378 ? 43.201 8.182 49.613 1.00 38.75 ? 378 TYR D OH 1 +ATOM 20157 N N . GLU D 1 379 ? 40.019 0.304 47.475 1.00 33.70 ? 379 GLU D N 1 +ATOM 20158 C CA . GLU D 1 379 ? 39.928 -1.141 47.390 1.00 32.90 ? 379 GLU D CA 1 +ATOM 20159 C C . GLU D 1 379 ? 40.635 -1.570 46.105 1.00 32.68 ? 379 GLU D C 1 +ATOM 20160 O O . GLU D 1 379 ? 41.393 -2.538 46.105 1.00 33.62 ? 379 GLU D O 1 +ATOM 20161 C CB . GLU D 1 379 ? 38.470 -1.613 47.362 1.00 33.72 ? 379 GLU D CB 1 +ATOM 20162 C CG . GLU D 1 379 ? 38.337 -3.123 47.172 1.00 36.41 ? 379 GLU D CG 1 +ATOM 20163 C CD . GLU D 1 379 ? 36.927 -3.577 46.830 1.00 39.01 ? 379 GLU D CD 1 +ATOM 20164 O OE1 . GLU D 1 379 ? 36.242 -2.878 46.051 1.00 40.82 ? 379 GLU D OE1 1 +ATOM 20165 O OE2 . GLU D 1 379 ? 36.512 -4.648 47.323 1.00 40.26 ? 379 GLU D OE2 1 +ATOM 20166 N N . ALA D 1 380 ? 40.393 -0.847 45.015 1.00 31.41 ? 380 ALA D N 1 +ATOM 20167 C CA . ALA D 1 380 ? 41.024 -1.181 43.739 1.00 32.91 ? 380 ALA D CA 1 +ATOM 20168 C C . ALA D 1 380 ? 42.542 -1.019 43.853 1.00 33.67 ? 380 ALA D C 1 +ATOM 20169 O O . ALA D 1 380 ? 43.307 -1.805 43.302 1.00 33.81 ? 380 ALA D O 1 +ATOM 20170 C CB . ALA D 1 380 ? 40.486 -0.284 42.621 1.00 30.26 ? 380 ALA D CB 1 +ATOM 20171 N N . MET D 1 381 ? 42.962 0.014 44.572 1.00 34.21 ? 381 MET D N 1 +ATOM 20172 C CA . MET D 1 381 ? 44.374 0.303 44.780 1.00 34.33 ? 381 MET D CA 1 +ATOM 20173 C C . MET D 1 381 ? 45.054 -0.884 45.463 1.00 34.56 ? 381 MET D C 1 +ATOM 20174 O O . MET D 1 381 ? 46.112 -1.341 45.036 1.00 35.56 ? 381 MET D O 1 +ATOM 20175 C CB . MET D 1 381 ? 44.498 1.552 45.651 1.00 36.53 ? 381 MET D CB 1 +ATOM 20176 C CG . MET D 1 381 ? 45.912 2.000 45.939 1.00 36.67 ? 381 MET D CG 1 +ATOM 20177 S SD . MET D 1 381 ? 45.909 3.393 47.095 1.00 40.42 ? 381 MET D SD 1 +ATOM 20178 C CE . MET D 1 381 ? 45.213 4.726 46.042 1.00 40.02 ? 381 MET D CE 1 +ATOM 20179 N N . ALA D 1 382 ? 44.434 -1.379 46.529 1.00 34.69 ? 382 ALA D N 1 +ATOM 20180 C CA . ALA D 1 382 ? 44.966 -2.514 47.268 1.00 34.31 ? 382 ALA D CA 1 +ATOM 20181 C C . ALA D 1 382 ? 44.966 -3.776 46.414 1.00 35.21 ? 382 ALA D C 1 +ATOM 20182 O O . ALA D 1 382 ? 45.861 -4.615 46.529 1.00 37.01 ? 382 ALA D O 1 +ATOM 20183 C CB . ALA D 1 382 ? 44.140 -2.750 48.526 1.00 32.72 ? 382 ALA D CB 1 +ATOM 20184 N N . THR D 1 383 ? 43.958 -3.916 45.559 1.00 34.44 ? 383 THR D N 1 +ATOM 20185 C CA . THR D 1 383 ? 43.850 -5.092 44.717 1.00 32.94 ? 383 THR D CA 1 +ATOM 20186 C C . THR D 1 383 ? 44.922 -5.044 43.641 1.00 33.73 ? 383 THR D C 1 +ATOM 20187 O O . THR D 1 383 ? 45.488 -6.069 43.265 1.00 33.70 ? 383 THR D O 1 +ATOM 20188 C CB . THR D 1 383 ? 42.451 -5.172 44.088 1.00 32.66 ? 383 THR D CB 1 +ATOM 20189 O OG1 . THR D 1 383 ? 41.475 -5.188 45.136 1.00 33.39 ? 383 THR D OG1 1 +ATOM 20190 C CG2 . THR D 1 383 ? 42.301 -6.428 43.250 1.00 31.48 ? 383 THR D CG2 1 +ATOM 20191 N N . PHE D 1 384 ? 45.208 -3.843 43.157 1.00 33.94 ? 384 PHE D N 1 +ATOM 20192 C CA . PHE D 1 384 ? 46.227 -3.651 42.135 1.00 35.95 ? 384 PHE D CA 1 +ATOM 20193 C C . PHE D 1 384 ? 47.573 -4.007 42.773 1.00 38.22 ? 384 PHE D C 1 +ATOM 20194 O O . PHE D 1 384 ? 48.430 -4.651 42.161 1.00 37.29 ? 384 PHE D O 1 +ATOM 20195 C CB . PHE D 1 384 ? 46.242 -2.191 41.686 1.00 34.62 ? 384 PHE D CB 1 +ATOM 20196 C CG . PHE D 1 384 ? 47.067 -1.940 40.456 1.00 36.11 ? 384 PHE D CG 1 +ATOM 20197 C CD1 . PHE D 1 384 ? 46.519 -2.111 39.191 1.00 35.16 ? 384 PHE D CD1 1 +ATOM 20198 C CD2 . PHE D 1 384 ? 48.394 -1.511 40.562 1.00 35.90 ? 384 PHE D CD2 1 +ATOM 20199 C CE1 . PHE D 1 384 ? 47.274 -1.853 38.041 1.00 37.23 ? 384 PHE D CE1 1 +ATOM 20200 C CE2 . PHE D 1 384 ? 49.158 -1.252 39.425 1.00 36.41 ? 384 PHE D CE2 1 +ATOM 20201 C CZ . PHE D 1 384 ? 48.597 -1.422 38.157 1.00 36.99 ? 384 PHE D CZ 1 +ATOM 20202 N N . LYS D 1 385 ? 47.743 -3.568 44.015 1.00 39.63 ? 385 LYS D N 1 +ATOM 20203 C CA . LYS D 1 385 ? 48.953 -3.842 44.766 1.00 41.50 ? 385 LYS D CA 1 +ATOM 20204 C C . LYS D 1 385 ? 49.100 -5.359 44.920 1.00 41.08 ? 385 LYS D C 1 +ATOM 20205 O O . LYS D 1 385 ? 50.210 -5.883 44.977 1.00 41.38 ? 385 LYS D O 1 +ATOM 20206 C CB . LYS D 1 385 ? 48.862 -3.165 46.133 1.00 43.14 ? 385 LYS D CB 1 +ATOM 20207 C CG . LYS D 1 385 ? 50.039 -3.407 47.052 1.00 45.86 ? 385 LYS D CG 1 +ATOM 20208 C CD . LYS D 1 385 ? 49.768 -2.762 48.408 1.00 50.05 ? 385 LYS D CD 1 +ATOM 20209 C CE . LYS D 1 385 ? 50.863 -3.082 49.421 1.00 52.14 ? 385 LYS D CE 1 +ATOM 20210 N NZ . LYS D 1 385 ? 52.204 -2.586 48.981 1.00 55.56 ? 385 LYS D NZ 1 +ATOM 20211 N N . GLY D 1 386 ? 47.968 -6.059 44.970 1.00 40.52 ? 386 GLY D N 1 +ATOM 20212 C CA . GLY D 1 386 ? 47.988 -7.507 45.094 1.00 38.74 ? 386 GLY D CA 1 +ATOM 20213 C C . GLY D 1 386 ? 48.584 -8.163 43.865 1.00 38.81 ? 386 GLY D C 1 +ATOM 20214 O O . GLY D 1 386 ? 49.216 -9.209 43.968 1.00 40.84 ? 386 GLY D O 1 +ATOM 20215 N N . PHE D 1 387 ? 48.372 -7.563 42.696 1.00 38.73 ? 387 PHE D N 1 +ATOM 20216 C CA . PHE D 1 387 ? 48.928 -8.103 41.461 1.00 39.21 ? 387 PHE D CA 1 +ATOM 20217 C C . PHE D 1 387 ? 50.444 -7.902 41.450 1.00 40.66 ? 387 PHE D C 1 +ATOM 20218 O O . PHE D 1 387 ? 51.185 -8.776 41.007 1.00 38.00 ? 387 PHE D O 1 +ATOM 20219 C CB . PHE D 1 387 ? 48.308 -7.427 40.231 1.00 37.43 ? 387 PHE D CB 1 +ATOM 20220 C CG . PHE D 1 387 ? 47.011 -8.051 39.781 1.00 37.00 ? 387 PHE D CG 1 +ATOM 20221 C CD1 . PHE D 1 387 ? 45.830 -7.823 40.479 1.00 34.64 ? 387 PHE D CD1 1 +ATOM 20222 C CD2 . PHE D 1 387 ? 46.978 -8.890 38.675 1.00 36.24 ? 387 PHE D CD2 1 +ATOM 20223 C CE1 . PHE D 1 387 ? 44.649 -8.418 40.083 1.00 35.20 ? 387 PHE D CE1 1 +ATOM 20224 C CE2 . PHE D 1 387 ? 45.793 -9.493 38.271 1.00 35.53 ? 387 PHE D CE2 1 +ATOM 20225 C CZ . PHE D 1 387 ? 44.628 -9.257 38.976 1.00 35.65 ? 387 PHE D CZ 1 +ATOM 20226 N N . ARG D 1 388 ? 50.888 -6.742 41.942 1.00 43.06 ? 388 ARG D N 1 +ATOM 20227 C CA . ARG D 1 388 ? 52.308 -6.411 42.004 1.00 45.14 ? 388 ARG D CA 1 +ATOM 20228 C C . ARG D 1 388 ? 53.018 -7.395 42.922 1.00 46.22 ? 388 ARG D C 1 +ATOM 20229 O O . ARG D 1 388 ? 54.079 -7.923 42.582 1.00 47.15 ? 388 ARG D O 1 +ATOM 20230 C CB . ARG D 1 388 ? 52.511 -4.994 42.537 1.00 45.78 ? 388 ARG D CB 1 +ATOM 20231 C CG . ARG D 1 388 ? 51.997 -3.886 41.644 1.00 47.52 ? 388 ARG D CG 1 +ATOM 20232 C CD . ARG D 1 388 ? 52.595 -3.958 40.255 1.00 50.24 ? 388 ARG D CD 1 +ATOM 20233 N NE . ARG D 1 388 ? 52.495 -2.677 39.557 1.00 53.35 ? 388 ARG D NE 1 +ATOM 20234 C CZ . ARG D 1 388 ? 52.526 -2.540 38.233 1.00 55.09 ? 388 ARG D CZ 1 +ATOM 20235 N NH1 . ARG D 1 388 ? 52.651 -3.609 37.449 1.00 54.23 ? 388 ARG D NH1 1 +ATOM 20236 N NH2 . ARG D 1 388 ? 52.428 -1.330 37.691 1.00 55.75 ? 388 ARG D NH2 1 +ATOM 20237 N N . THR D 1 389 ? 52.419 -7.636 44.084 1.00 46.65 ? 389 THR D N 1 +ATOM 20238 C CA . THR D 1 389 ? 52.963 -8.565 45.067 1.00 47.20 ? 389 THR D CA 1 +ATOM 20239 C C . THR D 1 389 ? 53.160 -9.953 44.458 1.00 48.29 ? 389 THR D C 1 +ATOM 20240 O O . THR D 1 389 ? 53.995 -10.727 44.918 1.00 48.99 ? 389 THR D O 1 +ATOM 20241 C CB . THR D 1 389 ? 52.021 -8.679 46.280 1.00 46.98 ? 389 THR D CB 1 +ATOM 20242 O OG1 . THR D 1 389 ? 51.955 -7.413 46.940 1.00 47.89 ? 389 THR D OG1 1 +ATOM 20243 C CG2 . THR D 1 389 ? 52.512 -9.731 47.264 1.00 47.30 ? 389 THR D CG2 1 +ATOM 20244 N N . SER D 1 390 ? 52.382 -10.265 43.425 1.00 48.93 ? 390 SER D N 1 +ATOM 20245 C CA . SER D 1 390 ? 52.480 -11.560 42.756 1.00 48.96 ? 390 SER D CA 1 +ATOM 20246 C C . SER D 1 390 ? 53.360 -11.466 41.521 1.00 49.17 ? 390 SER D C 1 +ATOM 20247 O O . SER D 1 390 ? 53.490 -12.434 40.782 1.00 50.18 ? 390 SER D O 1 +ATOM 20248 C CB . SER D 1 390 ? 51.093 -12.060 42.335 1.00 49.29 ? 390 SER D CB 1 +ATOM 20249 O OG . SER D 1 390 ? 50.281 -12.352 43.454 1.00 51.70 ? 390 SER D OG 1 +ATOM 20250 N N . HIS D 1 391 ? 53.961 -10.302 41.297 1.00 50.05 ? 391 HIS D N 1 +ATOM 20251 C CA . HIS D 1 391 ? 54.820 -10.100 40.129 1.00 52.74 ? 391 HIS D CA 1 +ATOM 20252 C C . HIS D 1 391 ? 54.044 -10.461 38.865 1.00 52.10 ? 391 HIS D C 1 +ATOM 20253 O O . HIS D 1 391 ? 54.579 -11.051 37.926 1.00 52.20 ? 391 HIS D O 1 +ATOM 20254 C CB . HIS D 1 391 ? 56.080 -10.966 40.235 1.00 55.02 ? 391 HIS D CB 1 +ATOM 20255 C CG . HIS D 1 391 ? 56.868 -10.727 41.484 1.00 58.36 ? 391 HIS D CG 1 +ATOM 20256 N ND1 . HIS D 1 391 ? 57.403 -9.497 41.803 1.00 59.92 ? 391 HIS D ND1 1 +ATOM 20257 C CD2 . HIS D 1 391 ? 57.192 -11.554 42.506 1.00 59.53 ? 391 HIS D CD2 1 +ATOM 20258 C CE1 . HIS D 1 391 ? 58.022 -9.575 42.967 1.00 60.22 ? 391 HIS D CE1 1 +ATOM 20259 N NE2 . HIS D 1 391 ? 57.910 -10.813 43.415 1.00 60.84 ? 391 HIS D NE2 1 +ATOM 20260 N N . ARG D 1 392 ? 52.768 -10.102 38.867 1.00 51.04 ? 392 ARG D N 1 +ATOM 20261 C CA . ARG D 1 392 ? 51.877 -10.363 37.751 1.00 50.15 ? 392 ARG D CA 1 +ATOM 20262 C C . ARG D 1 392 ? 51.875 -9.119 36.866 1.00 50.39 ? 392 ARG D C 1 +ATOM 20263 O O . ARG D 1 392 ? 51.407 -8.061 37.284 1.00 51.97 ? 392 ARG D O 1 +ATOM 20264 C CB . ARG D 1 392 ? 50.473 -10.629 38.293 1.00 48.53 ? 392 ARG D CB 1 +ATOM 20265 C CG . ARG D 1 392 ? 49.558 -11.330 37.338 1.00 46.14 ? 392 ARG D CG 1 +ATOM 20266 C CD . ARG D 1 392 ? 50.018 -12.748 37.095 1.00 45.58 ? 392 ARG D CD 1 +ATOM 20267 N NE . ARG D 1 392 ? 48.881 -13.654 37.074 1.00 46.93 ? 392 ARG D NE 1 +ATOM 20268 C CZ . ARG D 1 392 ? 48.483 -14.379 38.110 1.00 46.49 ? 392 ARG D CZ 1 +ATOM 20269 N NH1 . ARG D 1 392 ? 49.136 -14.319 39.256 1.00 48.54 ? 392 ARG D NH1 1 +ATOM 20270 N NH2 . ARG D 1 392 ? 47.424 -15.160 37.999 1.00 48.96 ? 392 ARG D NH2 1 +ATOM 20271 N N . ASN D 1 393 ? 52.398 -9.234 35.652 1.00 50.56 ? 393 ASN D N 1 +ATOM 20272 C CA . ASN D 1 393 ? 52.448 -8.082 34.754 1.00 50.75 ? 393 ASN D CA 1 +ATOM 20273 C C . ASN D 1 393 ? 51.126 -7.836 34.037 1.00 48.96 ? 393 ASN D C 1 +ATOM 20274 O O . ASN D 1 393 ? 50.777 -6.690 33.752 1.00 47.70 ? 393 ASN D O 1 +ATOM 20275 C CB . ASN D 1 393 ? 53.572 -8.263 33.731 1.00 53.93 ? 393 ASN D CB 1 +ATOM 20276 C CG . ASN D 1 393 ? 54.913 -8.539 34.392 1.00 58.04 ? 393 ASN D CG 1 +ATOM 20277 O OD1 . ASN D 1 393 ? 55.417 -7.721 35.177 1.00 57.97 ? 393 ASN D OD1 1 +ATOM 20278 N ND2 . ASN D 1 393 ? 55.494 -9.700 34.087 1.00 58.28 ? 393 ASN D ND2 1 +ATOM 20279 N N . GLU D 1 394 ? 50.404 -8.914 33.738 1.00 46.86 ? 394 GLU D N 1 +ATOM 20280 C CA . GLU D 1 394 ? 49.120 -8.810 33.068 1.00 45.40 ? 394 GLU D CA 1 +ATOM 20281 C C . GLU D 1 394 ? 48.074 -8.631 34.153 1.00 43.65 ? 394 GLU D C 1 +ATOM 20282 O O . GLU D 1 394 ? 47.676 -9.588 34.818 1.00 42.74 ? 394 GLU D O 1 +ATOM 20283 C CB . GLU D 1 394 ? 48.821 -10.070 32.254 1.00 47.25 ? 394 GLU D CB 1 +ATOM 20284 C CG . GLU D 1 394 ? 49.917 -10.439 31.271 1.00 50.08 ? 394 GLU D CG 1 +ATOM 20285 C CD . GLU D 1 394 ? 49.435 -11.383 30.189 1.00 52.22 ? 394 GLU D CD 1 +ATOM 20286 O OE1 . GLU D 1 394 ? 48.728 -12.372 30.506 1.00 53.03 ? 394 GLU D OE1 1 +ATOM 20287 O OE2 . GLU D 1 394 ? 49.774 -11.134 29.015 1.00 54.24 ? 394 GLU D OE2 1 +ATOM 20288 N N . ILE D 1 395 ? 47.633 -7.393 34.321 1.00 40.66 ? 395 ILE D N 1 +ATOM 20289 C CA . ILE D 1 395 ? 46.660 -7.069 35.344 1.00 39.52 ? 395 ILE D CA 1 +ATOM 20290 C C . ILE D 1 395 ? 45.247 -6.849 34.809 1.00 37.31 ? 395 ILE D C 1 +ATOM 20291 O O . ILE D 1 395 ? 45.041 -6.167 33.810 1.00 34.38 ? 395 ILE D O 1 +ATOM 20292 C CB . ILE D 1 395 ? 47.102 -5.802 36.109 1.00 39.62 ? 395 ILE D CB 1 +ATOM 20293 C CG1 . ILE D 1 395 ? 48.490 -6.038 36.723 1.00 39.38 ? 395 ILE D CG1 1 +ATOM 20294 C CG2 . ILE D 1 395 ? 46.061 -5.434 37.166 1.00 39.04 ? 395 ILE D CG2 1 +ATOM 20295 C CD1 . ILE D 1 395 ? 49.080 -4.829 37.427 1.00 37.42 ? 395 ILE D CD1 1 +ATOM 20296 N N . PHE D 1 396 ? 44.278 -7.454 35.476 1.00 36.52 ? 396 PHE D N 1 +ATOM 20297 C CA . PHE D 1 396 ? 42.893 -7.267 35.093 1.00 35.95 ? 396 PHE D CA 1 +ATOM 20298 C C . PHE D 1 396 ? 42.016 -7.116 36.316 1.00 33.82 ? 396 PHE D C 1 +ATOM 20299 O O . PHE D 1 396 ? 41.856 -8.051 37.106 1.00 31.28 ? 396 PHE D O 1 +ATOM 20300 C CB . PHE D 1 396 ? 42.339 -8.424 34.261 1.00 37.67 ? 396 PHE D CB 1 +ATOM 20301 C CG . PHE D 1 396 ? 40.908 -8.216 33.868 1.00 37.78 ? 396 PHE D CG 1 +ATOM 20302 C CD1 . PHE D 1 396 ? 40.581 -7.308 32.863 1.00 38.98 ? 396 PHE D CD1 1 +ATOM 20303 C CD2 . PHE D 1 396 ? 39.882 -8.826 34.583 1.00 38.25 ? 396 PHE D CD2 1 +ATOM 20304 C CE1 . PHE D 1 396 ? 39.250 -6.999 32.573 1.00 40.24 ? 396 PHE D CE1 1 +ATOM 20305 C CE2 . PHE D 1 396 ? 38.542 -8.531 34.310 1.00 40.66 ? 396 PHE D CE2 1 +ATOM 20306 C CZ . PHE D 1 396 ? 38.223 -7.611 33.299 1.00 41.82 ? 396 PHE D CZ 1 +ATOM 20307 N N . ILE D 1 397 ? 41.443 -5.929 36.462 1.00 33.09 ? 397 ILE D N 1 +ATOM 20308 C CA . ILE D 1 397 ? 40.547 -5.652 37.571 1.00 31.61 ? 397 ILE D CA 1 +ATOM 20309 C C . ILE D 1 397 ? 39.302 -4.949 37.033 1.00 31.01 ? 397 ILE D C 1 +ATOM 20310 O O . ILE D 1 397 ? 39.401 -4.007 36.242 1.00 27.93 ? 397 ILE D O 1 +ATOM 20311 C CB . ILE D 1 397 ? 41.228 -4.763 38.630 1.00 30.12 ? 397 ILE D CB 1 +ATOM 20312 C CG1 . ILE D 1 397 ? 42.498 -5.449 39.137 1.00 29.64 ? 397 ILE D CG1 1 +ATOM 20313 C CG2 . ILE D 1 397 ? 40.265 -4.492 39.780 1.00 26.85 ? 397 ILE D CG2 1 +ATOM 20314 C CD1 . ILE D 1 397 ? 43.296 -4.607 40.116 1.00 29.38 ? 397 ILE D CD1 1 +ATOM 20315 N N . LEU D 1 398 ? 38.142 -5.437 37.461 1.00 31.75 ? 398 LEU D N 1 +ATOM 20316 C CA . LEU D 1 398 ? 36.843 -4.895 37.067 1.00 31.41 ? 398 LEU D CA 1 +ATOM 20317 C C . LEU D 1 398 ? 36.215 -4.377 38.347 1.00 30.99 ? 398 LEU D C 1 +ATOM 20318 O O . LEU D 1 398 ? 36.227 -5.064 39.367 1.00 31.79 ? 398 LEU D O 1 +ATOM 20319 C CB . LEU D 1 398 ? 35.954 -6.005 36.504 1.00 31.70 ? 398 LEU D CB 1 +ATOM 20320 C CG . LEU D 1 398 ? 34.980 -5.749 35.344 1.00 34.58 ? 398 LEU D CG 1 +ATOM 20321 C CD1 . LEU D 1 398 ? 33.802 -6.707 35.490 1.00 33.20 ? 398 LEU D CD1 1 +ATOM 20322 C CD2 . LEU D 1 398 ? 34.479 -4.316 35.323 1.00 33.06 ? 398 LEU D CD2 1 +ATOM 20323 N N . SER D 1 399 ? 35.674 -3.169 38.308 1.00 31.38 ? 399 SER D N 1 +ATOM 20324 C CA . SER D 1 399 ? 35.042 -2.597 39.493 1.00 31.07 ? 399 SER D CA 1 +ATOM 20325 C C . SER D 1 399 ? 33.671 -2.044 39.133 1.00 30.70 ? 399 SER D C 1 +ATOM 20326 O O . SER D 1 399 ? 33.451 -1.609 38.004 1.00 30.62 ? 399 SER D O 1 +ATOM 20327 C CB . SER D 1 399 ? 35.908 -1.481 40.067 1.00 29.83 ? 399 SER D CB 1 +ATOM 20328 O OG . SER D 1 399 ? 35.325 -0.953 41.244 1.00 33.58 ? 399 SER D OG 1 +ATOM 20329 N N . ARG D 1 400 ? 32.743 -2.066 40.084 1.00 31.08 ? 400 ARG D N 1 +ATOM 20330 C CA . ARG D 1 400 ? 31.415 -1.544 39.807 1.00 31.63 ? 400 ARG D CA 1 +ATOM 20331 C C . ARG D 1 400 ? 31.359 -0.071 40.178 1.00 31.94 ? 400 ARG D C 1 +ATOM 20332 O O . ARG D 1 400 ? 30.839 0.749 39.420 1.00 33.26 ? 400 ARG D O 1 +ATOM 20333 C CB . ARG D 1 400 ? 30.353 -2.313 40.581 1.00 32.06 ? 400 ARG D CB 1 +ATOM 20334 C CG . ARG D 1 400 ? 28.959 -2.015 40.086 1.00 33.96 ? 400 ARG D CG 1 +ATOM 20335 C CD . ARG D 1 400 ? 27.931 -2.992 40.634 1.00 34.97 ? 400 ARG D CD 1 +ATOM 20336 N NE . ARG D 1 400 ? 27.600 -2.703 42.022 1.00 38.40 ? 400 ARG D NE 1 +ATOM 20337 C CZ . ARG D 1 400 ? 26.590 -3.267 42.682 1.00 40.90 ? 400 ARG D CZ 1 +ATOM 20338 N NH1 . ARG D 1 400 ? 25.816 -4.161 42.069 1.00 39.55 ? 400 ARG D NH1 1 +ATOM 20339 N NH2 . ARG D 1 400 ? 26.341 -2.923 43.948 1.00 38.86 ? 400 ARG D NH2 1 +ATOM 20340 N N . ALA D 1 401 ? 31.905 0.270 41.341 1.00 30.73 ? 401 ALA D N 1 +ATOM 20341 C CA . ALA D 1 401 ? 31.913 1.654 41.787 1.00 29.00 ? 401 ALA D CA 1 +ATOM 20342 C C . ALA D 1 401 ? 33.258 2.305 41.514 1.00 30.42 ? 401 ALA D C 1 +ATOM 20343 O O . ALA D 1 401 ? 34.214 1.648 41.091 1.00 28.47 ? 401 ALA D O 1 +ATOM 20344 C CB . ALA D 1 401 ? 31.586 1.725 43.253 1.00 27.73 ? 401 ALA D CB 1 +ATOM 20345 N N . GLY D 1 402 ? 33.334 3.609 41.749 1.00 31.61 ? 402 GLY D N 1 +ATOM 20346 C CA . GLY D 1 402 ? 34.579 4.304 41.506 1.00 31.67 ? 402 GLY D CA 1 +ATOM 20347 C C . GLY D 1 402 ? 34.549 5.763 41.904 1.00 32.15 ? 402 GLY D C 1 +ATOM 20348 O O . GLY D 1 402 ? 33.521 6.294 42.322 1.00 31.58 ? 402 GLY D O 1 +ATOM 20349 N N . TYR D 1 403 ? 35.707 6.400 41.775 1.00 31.83 ? 403 TYR D N 1 +ATOM 20350 C CA . TYR D 1 403 ? 35.883 7.810 42.098 1.00 32.21 ? 403 TYR D CA 1 +ATOM 20351 C C . TYR D 1 403 ? 37.009 8.280 41.185 1.00 32.75 ? 403 TYR D C 1 +ATOM 20352 O O . TYR D 1 403 ? 37.643 7.466 40.509 1.00 33.38 ? 403 TYR D O 1 +ATOM 20353 C CB . TYR D 1 403 ? 36.298 7.960 43.564 1.00 31.26 ? 403 TYR D CB 1 +ATOM 20354 C CG . TYR D 1 403 ? 36.561 9.378 43.990 1.00 32.07 ? 403 TYR D CG 1 +ATOM 20355 C CD1 . TYR D 1 403 ? 35.528 10.318 44.032 1.00 33.53 ? 403 TYR D CD1 1 +ATOM 20356 C CD2 . TYR D 1 403 ? 37.850 9.795 44.341 1.00 32.50 ? 403 TYR D CD2 1 +ATOM 20357 C CE1 . TYR D 1 403 ? 35.769 11.640 44.412 1.00 33.12 ? 403 TYR D CE1 1 +ATOM 20358 C CE2 . TYR D 1 403 ? 38.102 11.115 44.721 1.00 31.94 ? 403 TYR D CE2 1 +ATOM 20359 C CZ . TYR D 1 403 ? 37.059 12.028 44.754 1.00 32.99 ? 403 TYR D CZ 1 +ATOM 20360 O OH . TYR D 1 403 ? 37.304 13.328 45.128 1.00 34.20 ? 403 TYR D OH 1 +ATOM 20361 N N . ALA D 1 404 ? 37.259 9.580 41.147 1.00 32.64 ? 404 ALA D N 1 +ATOM 20362 C CA . ALA D 1 404 ? 38.340 10.093 40.315 1.00 33.64 ? 404 ALA D CA 1 +ATOM 20363 C C . ALA D 1 404 ? 39.617 9.323 40.641 1.00 34.38 ? 404 ALA D C 1 +ATOM 20364 O O . ALA D 1 404 ? 39.952 9.143 41.813 1.00 35.65 ? 404 ALA D O 1 +ATOM 20365 C CB . ALA D 1 404 ? 38.544 11.573 40.584 1.00 33.54 ? 404 ALA D CB 1 +ATOM 20366 N N . GLY D 1 405 ? 40.321 8.862 39.610 1.00 35.73 ? 405 GLY D N 1 +ATOM 20367 C CA . GLY D 1 405 ? 41.556 8.123 39.826 1.00 34.52 ? 405 GLY D CA 1 +ATOM 20368 C C . GLY D 1 405 ? 41.385 6.622 39.694 1.00 35.76 ? 405 GLY D C 1 +ATOM 20369 O O . GLY D 1 405 ? 42.368 5.877 39.569 1.00 35.82 ? 405 GLY D O 1 +ATOM 20370 N N . ILE D 1 406 ? 40.136 6.166 39.715 1.00 34.58 ? 406 ILE D N 1 +ATOM 20371 C CA . ILE D 1 406 ? 39.861 4.742 39.594 1.00 32.85 ? 406 ILE D CA 1 +ATOM 20372 C C . ILE D 1 406 ? 40.483 4.189 38.314 1.00 31.63 ? 406 ILE D C 1 +ATOM 20373 O O . ILE D 1 406 ? 40.806 3.011 38.253 1.00 33.54 ? 406 ILE D O 1 +ATOM 20374 C CB . ILE D 1 406 ? 38.312 4.450 39.605 1.00 33.09 ? 406 ILE D CB 1 +ATOM 20375 C CG1 . ILE D 1 406 ? 38.056 2.943 39.694 1.00 32.01 ? 406 ILE D CG1 1 +ATOM 20376 C CG2 . ILE D 1 406 ? 37.648 4.994 38.355 1.00 30.10 ? 406 ILE D CG2 1 +ATOM 20377 C CD1 . ILE D 1 406 ? 38.422 2.343 41.035 1.00 30.95 ? 406 ILE D CD1 1 +ATOM 20378 N N . GLN D 1 407 ? 40.666 5.034 37.302 1.00 30.97 ? 407 GLN D N 1 +ATOM 20379 C CA . GLN D 1 407 ? 41.244 4.580 36.038 1.00 32.09 ? 407 GLN D CA 1 +ATOM 20380 C C . GLN D 1 407 ? 42.669 4.041 36.183 1.00 32.71 ? 407 GLN D C 1 +ATOM 20381 O O . GLN D 1 407 ? 43.167 3.339 35.302 1.00 32.78 ? 407 GLN D O 1 +ATOM 20382 C CB . GLN D 1 407 ? 41.219 5.700 34.978 1.00 32.97 ? 407 GLN D CB 1 +ATOM 20383 C CG . GLN D 1 407 ? 42.171 6.870 35.224 1.00 33.77 ? 407 GLN D CG 1 +ATOM 20384 C CD . GLN D 1 407 ? 41.600 7.909 36.172 1.00 35.85 ? 407 GLN D CD 1 +ATOM 20385 O OE1 . GLN D 1 407 ? 40.527 7.717 36.755 1.00 34.58 ? 407 GLN D OE1 1 +ATOM 20386 N NE2 . GLN D 1 407 ? 42.319 9.017 36.334 1.00 36.01 ? 407 GLN D NE2 1 +ATOM 20387 N N . ARG D 1 408 ? 43.326 4.370 37.291 1.00 33.03 ? 408 ARG D N 1 +ATOM 20388 C CA . ARG D 1 408 ? 44.681 3.885 37.527 1.00 33.31 ? 408 ARG D CA 1 +ATOM 20389 C C . ARG D 1 408 ? 44.668 2.379 37.724 1.00 33.15 ? 408 ARG D C 1 +ATOM 20390 O O . ARG D 1 408 ? 45.636 1.701 37.396 1.00 32.98 ? 408 ARG D O 1 +ATOM 20391 C CB . ARG D 1 408 ? 45.276 4.428 38.832 1.00 34.46 ? 408 ARG D CB 1 +ATOM 20392 C CG . ARG D 1 408 ? 45.440 5.909 39.012 1.00 34.24 ? 408 ARG D CG 1 +ATOM 20393 C CD . ARG D 1 408 ? 45.796 6.137 40.475 1.00 33.55 ? 408 ARG D CD 1 +ATOM 20394 N NE . ARG D 1 408 ? 46.088 7.530 40.787 1.00 35.60 ? 408 ARG D NE 1 +ATOM 20395 C CZ . ARG D 1 408 ? 46.475 7.964 41.986 1.00 35.92 ? 408 ARG D CZ 1 +ATOM 20396 N NH1 . ARG D 1 408 ? 46.619 7.112 42.994 1.00 32.14 ? 408 ARG D NH1 1 +ATOM 20397 N NH2 . ARG D 1 408 ? 46.714 9.256 42.177 1.00 37.04 ? 408 ARG D NH2 1 +ATOM 20398 N N . TYR D 1 409 ? 43.575 1.865 38.276 1.00 33.05 ? 409 TYR D N 1 +ATOM 20399 C CA . TYR D 1 409 ? 43.517 0.450 38.618 1.00 34.49 ? 409 TYR D CA 1 +ATOM 20400 C C . TYR D 1 409 ? 42.477 -0.471 38.021 1.00 34.07 ? 409 TYR D C 1 +ATOM 20401 O O . TYR D 1 409 ? 42.624 -1.686 38.127 1.00 34.55 ? 409 TYR D O 1 +ATOM 20402 C CB . TYR D 1 409 ? 43.399 0.319 40.141 1.00 34.68 ? 409 TYR D CB 1 +ATOM 20403 C CG . TYR D 1 409 ? 44.236 1.313 40.912 1.00 36.47 ? 409 TYR D CG 1 +ATOM 20404 C CD1 . TYR D 1 409 ? 45.634 1.257 40.880 1.00 35.50 ? 409 TYR D CD1 1 +ATOM 20405 C CD2 . TYR D 1 409 ? 43.630 2.319 41.667 1.00 35.57 ? 409 TYR D CD2 1 +ATOM 20406 C CE1 . TYR D 1 409 ? 46.405 2.181 41.582 1.00 36.36 ? 409 TYR D CE1 1 +ATOM 20407 C CE2 . TYR D 1 409 ? 44.392 3.248 42.374 1.00 38.08 ? 409 TYR D CE2 1 +ATOM 20408 C CZ . TYR D 1 409 ? 45.782 3.174 42.325 1.00 38.58 ? 409 TYR D CZ 1 +ATOM 20409 O OH . TYR D 1 409 ? 46.537 4.108 43.001 1.00 39.17 ? 409 TYR D OH 1 +ATOM 20410 N N . ALA D 1 410 ? 41.425 0.053 37.411 1.00 34.34 ? 410 ALA D N 1 +ATOM 20411 C CA . ALA D 1 410 ? 40.423 -0.876 36.919 1.00 34.97 ? 410 ALA D CA 1 +ATOM 20412 C C . ALA D 1 410 ? 39.511 -0.481 35.772 1.00 35.46 ? 410 ALA D C 1 +ATOM 20413 O O . ALA D 1 410 ? 39.395 0.687 35.403 1.00 36.31 ? 410 ALA D O 1 +ATOM 20414 C CB . ALA D 1 410 ? 39.559 -1.315 38.094 1.00 32.60 ? 410 ALA D CB 1 +ATOM 20415 N N . PHE D 1 411 ? 38.873 -1.506 35.218 1.00 35.33 ? 411 PHE D N 1 +ATOM 20416 C CA . PHE D 1 411 ? 37.878 -1.367 34.169 1.00 35.07 ? 411 PHE D CA 1 +ATOM 20417 C C . PHE D 1 411 ? 36.598 -1.105 34.970 1.00 35.28 ? 411 PHE D C 1 +ATOM 20418 O O . PHE D 1 411 ? 36.497 -1.471 36.146 1.00 33.75 ? 411 PHE D O 1 +ATOM 20419 C CB . PHE D 1 411 ? 37.653 -2.693 33.431 1.00 35.80 ? 411 PHE D CB 1 +ATOM 20420 C CG . PHE D 1 411 ? 38.592 -2.951 32.296 1.00 38.15 ? 411 PHE D CG 1 +ATOM 20421 C CD1 . PHE D 1 411 ? 39.968 -2.959 32.490 1.00 38.81 ? 411 PHE D CD1 1 +ATOM 20422 C CD2 . PHE D 1 411 ? 38.091 -3.233 31.028 1.00 39.44 ? 411 PHE D CD2 1 +ATOM 20423 C CE1 . PHE D 1 411 ? 40.831 -3.245 31.437 1.00 39.22 ? 411 PHE D CE1 1 +ATOM 20424 C CE2 . PHE D 1 411 ? 38.948 -3.519 29.966 1.00 40.03 ? 411 PHE D CE2 1 +ATOM 20425 C CZ . PHE D 1 411 ? 40.321 -3.525 30.173 1.00 38.58 ? 411 PHE D CZ 1 +ATOM 20426 N N . ILE D 1 412 ? 35.618 -0.481 34.338 1.00 34.89 ? 412 ILE D N 1 +ATOM 20427 C CA . ILE D 1 412 ? 34.347 -0.264 35.004 1.00 34.72 ? 412 ILE D CA 1 +ATOM 20428 C C . ILE D 1 412 ? 33.243 -0.686 34.047 1.00 34.25 ? 412 ILE D C 1 +ATOM 20429 O O . ILE D 1 412 ? 33.288 -0.355 32.861 1.00 32.21 ? 412 ILE D O 1 +ATOM 20430 C CB . ILE D 1 412 ? 34.152 1.215 35.404 1.00 35.39 ? 412 ILE D CB 1 +ATOM 20431 C CG1 . ILE D 1 412 ? 35.050 1.534 36.605 1.00 35.62 ? 412 ILE D CG1 1 +ATOM 20432 C CG2 . ILE D 1 412 ? 32.691 1.478 35.752 1.00 34.54 ? 412 ILE D CG2 1 +ATOM 20433 C CD1 . ILE D 1 412 ? 34.795 2.861 37.207 1.00 37.52 ? 412 ILE D CD1 1 +ATOM 20434 N N . TRP D 1 413 ? 32.287 -1.459 34.548 1.00 34.09 ? 413 TRP D N 1 +ATOM 20435 C CA . TRP D 1 413 ? 31.155 -1.872 33.727 1.00 35.06 ? 413 TRP D CA 1 +ATOM 20436 C C . TRP D 1 413 ? 29.936 -1.228 34.385 1.00 34.88 ? 413 TRP D C 1 +ATOM 20437 O O . TRP D 1 413 ? 29.947 -0.942 35.584 1.00 34.39 ? 413 TRP D O 1 +ATOM 20438 C CB . TRP D 1 413 ? 31.059 -3.405 33.639 1.00 34.52 ? 413 TRP D CB 1 +ATOM 20439 C CG . TRP D 1 413 ? 30.082 -4.064 34.539 1.00 35.26 ? 413 TRP D CG 1 +ATOM 20440 C CD1 . TRP D 1 413 ? 28.824 -4.501 34.213 1.00 35.39 ? 413 TRP D CD1 1 +ATOM 20441 C CD2 . TRP D 1 413 ? 30.274 -4.389 35.915 1.00 35.41 ? 413 TRP D CD2 1 +ATOM 20442 N NE1 . TRP D 1 413 ? 28.226 -5.080 35.305 1.00 34.13 ? 413 TRP D NE1 1 +ATOM 20443 C CE2 . TRP D 1 413 ? 29.092 -5.023 36.365 1.00 35.51 ? 413 TRP D CE2 1 +ATOM 20444 C CE3 . TRP D 1 413 ? 31.331 -4.208 36.817 1.00 34.73 ? 413 TRP D CE3 1 +ATOM 20445 C CZ2 . TRP D 1 413 ? 28.939 -5.474 37.680 1.00 36.37 ? 413 TRP D CZ2 1 +ATOM 20446 C CZ3 . TRP D 1 413 ? 31.178 -4.662 38.129 1.00 34.62 ? 413 TRP D CZ3 1 +ATOM 20447 C CH2 . TRP D 1 413 ? 29.991 -5.285 38.544 1.00 34.99 ? 413 TRP D CH2 1 +ATOM 20448 N N . THR D 1 414 ? 28.894 -0.994 33.597 1.00 35.60 ? 414 THR D N 1 +ATOM 20449 C CA . THR D 1 414 ? 27.697 -0.306 34.070 1.00 33.72 ? 414 THR D CA 1 +ATOM 20450 C C . THR D 1 414 ? 26.690 -1.028 34.953 1.00 34.67 ? 414 THR D C 1 +ATOM 20451 O O . THR D 1 414 ? 25.526 -0.636 35.012 1.00 36.00 ? 414 THR D O 1 +ATOM 20452 C CB . THR D 1 414 ? 26.949 0.290 32.883 1.00 32.50 ? 414 THR D CB 1 +ATOM 20453 O OG1 . THR D 1 414 ? 26.548 -0.767 32.008 1.00 32.37 ? 414 THR D OG1 1 +ATOM 20454 C CG2 . THR D 1 414 ? 27.852 1.259 32.122 1.00 29.24 ? 414 THR D CG2 1 +ATOM 20455 N N . GLY D 1 415 ? 27.113 -2.082 35.634 1.00 34.59 ? 415 GLY D N 1 +ATOM 20456 C CA . GLY D 1 415 ? 26.200 -2.760 36.535 1.00 35.14 ? 415 GLY D CA 1 +ATOM 20457 C C . GLY D 1 415 ? 24.993 -3.513 35.995 1.00 35.66 ? 415 GLY D C 1 +ATOM 20458 O O . GLY D 1 415 ? 24.993 -4.002 34.867 1.00 35.50 ? 415 GLY D O 1 +ATOM 20459 N N . ASP D 1 416 ? 23.950 -3.586 36.823 1.00 36.23 ? 416 ASP D N 1 +ATOM 20460 C CA . ASP D 1 416 ? 22.726 -4.332 36.511 1.00 36.07 ? 416 ASP D CA 1 +ATOM 20461 C C . ASP D 1 416 ? 21.707 -3.715 35.555 1.00 35.40 ? 416 ASP D C 1 +ATOM 20462 O O . ASP D 1 416 ? 20.618 -3.334 35.971 1.00 35.67 ? 416 ASP D O 1 +ATOM 20463 C CB . ASP D 1 416 ? 22.011 -4.697 37.816 1.00 36.52 ? 416 ASP D CB 1 +ATOM 20464 C CG . ASP D 1 416 ? 22.938 -5.393 38.829 1.00 42.03 ? 416 ASP D CG 1 +ATOM 20465 O OD1 . ASP D 1 416 ? 23.977 -5.985 38.425 1.00 41.40 ? 416 ASP D OD1 1 +ATOM 20466 O OD2 . ASP D 1 416 ? 22.615 -5.357 40.040 1.00 41.53 ? 416 ASP D OD2 1 +ATOM 20467 N N . ASN D 1 417 ? 22.041 -3.650 34.271 1.00 34.09 ? 417 ASN D N 1 +ATOM 20468 C CA . ASN D 1 417 ? 21.123 -3.085 33.290 1.00 33.56 ? 417 ASN D CA 1 +ATOM 20469 C C . ASN D 1 417 ? 19.971 -4.044 32.936 1.00 32.77 ? 417 ASN D C 1 +ATOM 20470 O O . ASN D 1 417 ? 20.041 -5.252 33.182 1.00 31.70 ? 417 ASN D O 1 +ATOM 20471 C CB . ASN D 1 417 ? 21.894 -2.672 32.029 1.00 33.18 ? 417 ASN D CB 1 +ATOM 20472 C CG . ASN D 1 417 ? 22.541 -3.845 31.320 1.00 34.95 ? 417 ASN D CG 1 +ATOM 20473 O OD1 . ASN D 1 417 ? 22.994 -4.797 31.952 1.00 36.68 ? 417 ASN D OD1 1 +ATOM 20474 N ND2 . ASN D 1 417 ? 22.607 -3.771 29.995 1.00 35.74 ? 417 ASN D ND2 1 +ATOM 20475 N N . THR D 1 418 ? 18.905 -3.480 32.378 1.00 32.40 ? 418 THR D N 1 +ATOM 20476 C CA . THR D 1 418 ? 17.719 -4.232 31.984 1.00 32.48 ? 418 THR D CA 1 +ATOM 20477 C C . THR D 1 418 ? 17.621 -4.342 30.471 1.00 32.35 ? 418 THR D C 1 +ATOM 20478 O O . THR D 1 418 ? 17.672 -3.338 29.773 1.00 34.26 ? 418 THR D O 1 +ATOM 20479 C CB . THR D 1 418 ? 16.425 -3.541 32.480 1.00 31.92 ? 418 THR D CB 1 +ATOM 20480 O OG1 . THR D 1 418 ? 16.398 -3.537 33.913 1.00 33.81 ? 418 THR D OG1 1 +ATOM 20481 C CG2 . THR D 1 418 ? 15.197 -4.263 31.963 1.00 30.19 ? 418 THR D CG2 1 +ATOM 20482 N N . PRO D 1 419 ? 17.468 -5.565 29.944 1.00 32.78 ? 419 PRO D N 1 +ATOM 20483 C CA . PRO D 1 419 ? 17.358 -5.759 28.492 1.00 33.65 ? 419 PRO D CA 1 +ATOM 20484 C C . PRO D 1 419 ? 16.115 -5.063 27.939 1.00 32.23 ? 419 PRO D C 1 +ATOM 20485 O O . PRO D 1 419 ? 14.994 -5.344 28.379 1.00 31.49 ? 419 PRO D O 1 +ATOM 20486 C CB . PRO D 1 419 ? 17.234 -7.279 28.343 1.00 32.53 ? 419 PRO D CB 1 +ATOM 20487 C CG . PRO D 1 419 ? 17.823 -7.817 29.607 1.00 34.70 ? 419 PRO D CG 1 +ATOM 20488 C CD . PRO D 1 419 ? 17.371 -6.851 30.652 1.00 33.17 ? 419 PRO D CD 1 +ATOM 20489 N N . SER D 1 420 ? 16.315 -4.157 26.992 1.00 31.78 ? 420 SER D N 1 +ATOM 20490 C CA . SER D 1 420 ? 15.204 -3.454 26.353 1.00 34.93 ? 420 SER D CA 1 +ATOM 20491 C C . SER D 1 420 ? 15.754 -2.562 25.266 1.00 35.20 ? 420 SER D C 1 +ATOM 20492 O O . SER D 1 420 ? 16.926 -2.188 25.296 1.00 36.93 ? 420 SER D O 1 +ATOM 20493 C CB . SER D 1 420 ? 14.428 -2.603 27.353 1.00 33.89 ? 420 SER D CB 1 +ATOM 20494 O OG . SER D 1 420 ? 15.087 -1.376 27.574 1.00 37.92 ? 420 SER D OG 1 +ATOM 20495 N N . TRP D 1 421 ? 14.917 -2.216 24.298 1.00 36.12 ? 421 TRP D N 1 +ATOM 20496 C CA . TRP D 1 421 ? 15.377 -1.362 23.219 1.00 36.10 ? 421 TRP D CA 1 +ATOM 20497 C C . TRP D 1 421 ? 15.836 -0.009 23.727 1.00 36.85 ? 421 TRP D C 1 +ATOM 20498 O O . TRP D 1 421 ? 16.820 0.537 23.240 1.00 39.74 ? 421 TRP D O 1 +ATOM 20499 C CB . TRP D 1 421 ? 14.298 -1.223 22.146 1.00 33.82 ? 421 TRP D CB 1 +ATOM 20500 C CG . TRP D 1 421 ? 14.115 -2.491 21.379 1.00 31.80 ? 421 TRP D CG 1 +ATOM 20501 C CD1 . TRP D 1 421 ? 13.229 -3.489 21.652 1.00 31.87 ? 421 TRP D CD1 1 +ATOM 20502 C CD2 . TRP D 1 421 ? 14.892 -2.938 20.262 1.00 30.98 ? 421 TRP D CD2 1 +ATOM 20503 N NE1 . TRP D 1 421 ? 13.408 -4.533 20.775 1.00 32.39 ? 421 TRP D NE1 1 +ATOM 20504 C CE2 . TRP D 1 421 ? 14.420 -4.222 19.909 1.00 30.77 ? 421 TRP D CE2 1 +ATOM 20505 C CE3 . TRP D 1 421 ? 15.941 -2.378 19.525 1.00 32.49 ? 421 TRP D CE3 1 +ATOM 20506 C CZ2 . TRP D 1 421 ? 14.957 -4.958 18.848 1.00 30.64 ? 421 TRP D CZ2 1 +ATOM 20507 C CZ3 . TRP D 1 421 ? 16.482 -3.113 18.464 1.00 33.58 ? 421 TRP D CZ3 1 +ATOM 20508 C CH2 . TRP D 1 421 ? 15.983 -4.392 18.138 1.00 33.47 ? 421 TRP D CH2 1 +ATOM 20509 N N . ASP D 1 422 ? 15.152 0.535 24.718 1.00 38.39 ? 422 ASP D N 1 +ATOM 20510 C CA . ASP D 1 422 ? 15.574 1.818 25.263 1.00 40.67 ? 422 ASP D CA 1 +ATOM 20511 C C . ASP D 1 422 ? 16.941 1.711 25.960 1.00 40.30 ? 422 ASP D C 1 +ATOM 20512 O O . ASP D 1 422 ? 17.720 2.660 25.956 1.00 37.85 ? 422 ASP D O 1 +ATOM 20513 C CB . ASP D 1 422 ? 14.538 2.345 26.255 1.00 44.96 ? 422 ASP D CB 1 +ATOM 20514 C CG . ASP D 1 422 ? 13.192 2.625 25.602 1.00 51.66 ? 422 ASP D CG 1 +ATOM 20515 O OD1 . ASP D 1 422 ? 13.175 3.118 24.450 1.00 55.18 ? 422 ASP D OD1 1 +ATOM 20516 O OD2 . ASP D 1 422 ? 12.146 2.365 26.239 1.00 54.29 ? 422 ASP D OD2 1 +ATOM 20517 N N . ASP D 1 423 ? 17.231 0.557 26.556 1.00 38.86 ? 423 ASP D N 1 +ATOM 20518 C CA . ASP D 1 423 ? 18.495 0.381 27.247 1.00 38.93 ? 423 ASP D CA 1 +ATOM 20519 C C . ASP D 1 423 ? 19.688 0.524 26.309 1.00 38.38 ? 423 ASP D C 1 +ATOM 20520 O O . ASP D 1 423 ? 20.782 0.865 26.753 1.00 37.95 ? 423 ASP D O 1 +ATOM 20521 C CB . ASP D 1 423 ? 18.546 -0.979 27.957 1.00 41.06 ? 423 ASP D CB 1 +ATOM 20522 C CG . ASP D 1 423 ? 19.776 -1.127 28.870 1.00 42.93 ? 423 ASP D CG 1 +ATOM 20523 O OD1 . ASP D 1 423 ? 19.972 -0.266 29.762 1.00 43.19 ? 423 ASP D OD1 1 +ATOM 20524 O OD2 . ASP D 1 423 ? 20.542 -2.106 28.702 1.00 41.15 ? 423 ASP D OD2 1 +ATOM 20525 N N . LEU D 1 424 ? 19.490 0.259 25.021 1.00 38.34 ? 424 LEU D N 1 +ATOM 20526 C CA . LEU D 1 424 ? 20.585 0.400 24.060 1.00 37.38 ? 424 LEU D CA 1 +ATOM 20527 C C . LEU D 1 424 ? 21.100 1.832 24.087 1.00 37.28 ? 424 LEU D C 1 +ATOM 20528 O O . LEU D 1 424 ? 22.307 2.060 24.111 1.00 37.72 ? 424 LEU D O 1 +ATOM 20529 C CB . LEU D 1 424 ? 20.130 0.056 22.639 1.00 34.14 ? 424 LEU D CB 1 +ATOM 20530 C CG . LEU D 1 424 ? 19.752 -1.401 22.371 1.00 34.64 ? 424 LEU D CG 1 +ATOM 20531 C CD1 . LEU D 1 424 ? 19.379 -1.554 20.896 1.00 31.10 ? 424 LEU D CD1 1 +ATOM 20532 C CD2 . LEU D 1 424 ? 20.914 -2.327 22.730 1.00 30.36 ? 424 LEU D CD2 1 +ATOM 20533 N N . LYS D 1 425 ? 20.187 2.796 24.087 1.00 37.01 ? 425 LYS D N 1 +ATOM 20534 C CA . LYS D 1 425 ? 20.582 4.195 24.122 1.00 38.97 ? 425 LYS D CA 1 +ATOM 20535 C C . LYS D 1 425 ? 21.159 4.566 25.481 1.00 37.98 ? 425 LYS D C 1 +ATOM 20536 O O . LYS D 1 425 ? 22.131 5.312 25.567 1.00 38.98 ? 425 LYS D O 1 +ATOM 20537 C CB . LYS D 1 425 ? 19.388 5.102 23.817 1.00 42.08 ? 425 LYS D CB 1 +ATOM 20538 C CG . LYS D 1 425 ? 18.897 5.038 22.379 1.00 47.36 ? 425 LYS D CG 1 +ATOM 20539 C CD . LYS D 1 425 ? 17.930 6.189 22.092 1.00 52.46 ? 425 LYS D CD 1 +ATOM 20540 C CE . LYS D 1 425 ? 17.444 6.172 20.647 1.00 54.35 ? 425 LYS D CE 1 +ATOM 20541 N NZ . LYS D 1 425 ? 16.672 4.923 20.347 1.00 57.18 ? 425 LYS D NZ 1 +ATOM 20542 N N . LEU D 1 426 ? 20.564 4.037 26.544 1.00 36.01 ? 426 LEU D N 1 +ATOM 20543 C CA . LEU D 1 426 ? 21.017 4.325 27.898 1.00 33.53 ? 426 LEU D CA 1 +ATOM 20544 C C . LEU D 1 426 ? 22.464 3.869 28.106 1.00 33.55 ? 426 LEU D C 1 +ATOM 20545 O O . LEU D 1 426 ? 23.290 4.620 28.621 1.00 32.59 ? 426 LEU D O 1 +ATOM 20546 C CB . LEU D 1 426 ? 20.117 3.620 28.914 1.00 32.83 ? 426 LEU D CB 1 +ATOM 20547 C CG . LEU D 1 426 ? 19.822 4.320 30.245 1.00 35.40 ? 426 LEU D CG 1 +ATOM 20548 C CD1 . LEU D 1 426 ? 19.674 3.251 31.334 1.00 33.38 ? 426 LEU D CD1 1 +ATOM 20549 C CD2 . LEU D 1 426 ? 20.931 5.296 30.613 1.00 34.14 ? 426 LEU D CD2 1 +ATOM 20550 N N . GLN D 1 427 ? 22.767 2.633 27.715 1.00 32.54 ? 427 GLN D N 1 +ATOM 20551 C CA . GLN D 1 427 ? 24.115 2.108 27.877 1.00 33.67 ? 427 GLN D CA 1 +ATOM 20552 C C . GLN D 1 427 ? 25.153 2.972 27.173 1.00 33.08 ? 427 GLN D C 1 +ATOM 20553 O O . GLN D 1 427 ? 26.258 3.175 27.673 1.00 31.78 ? 427 GLN D O 1 +ATOM 20554 C CB . GLN D 1 427 ? 24.186 0.664 27.363 1.00 32.89 ? 427 GLN D CB 1 +ATOM 20555 C CG . GLN D 1 427 ? 23.426 -0.307 28.242 1.00 34.17 ? 427 GLN D CG 1 +ATOM 20556 C CD . GLN D 1 427 ? 23.717 -0.076 29.731 1.00 34.56 ? 427 GLN D CD 1 +ATOM 20557 O OE1 . GLN D 1 427 ? 24.878 -0.024 30.135 1.00 32.89 ? 427 GLN D OE1 1 +ATOM 20558 N NE2 . GLN D 1 427 ? 22.664 0.063 30.540 1.00 29.88 ? 427 GLN D NE2 1 +ATOM 20559 N N . LEU D 1 428 ? 24.784 3.487 26.013 1.00 34.44 ? 428 LEU D N 1 +ATOM 20560 C CA . LEU D 1 428 ? 25.676 4.334 25.242 1.00 35.81 ? 428 LEU D CA 1 +ATOM 20561 C C . LEU D 1 428 ? 25.992 5.641 25.994 1.00 36.21 ? 428 LEU D C 1 +ATOM 20562 O O . LEU D 1 428 ? 27.128 6.117 25.971 1.00 36.06 ? 428 LEU D O 1 +ATOM 20563 C CB . LEU D 1 428 ? 25.038 4.622 23.889 1.00 36.12 ? 428 LEU D CB 1 +ATOM 20564 C CG . LEU D 1 428 ? 25.976 4.841 22.713 1.00 38.76 ? 428 LEU D CG 1 +ATOM 20565 C CD1 . LEU D 1 428 ? 27.151 3.871 22.781 1.00 39.65 ? 428 LEU D CD1 1 +ATOM 20566 C CD2 . LEU D 1 428 ? 25.183 4.651 21.431 1.00 38.36 ? 428 LEU D CD2 1 +ATOM 20567 N N . GLN D 1 429 ? 24.995 6.213 26.665 1.00 36.00 ? 429 GLN D N 1 +ATOM 20568 C CA . GLN D 1 429 ? 25.204 7.445 27.427 1.00 36.57 ? 429 GLN D CA 1 +ATOM 20569 C C . GLN D 1 429 ? 26.070 7.157 28.650 1.00 36.30 ? 429 GLN D C 1 +ATOM 20570 O O . GLN D 1 429 ? 26.922 7.963 29.025 1.00 36.52 ? 429 GLN D O 1 +ATOM 20571 C CB . GLN D 1 429 ? 23.874 8.027 27.907 1.00 36.12 ? 429 GLN D CB 1 +ATOM 20572 C CG . GLN D 1 429 ? 22.908 8.389 26.802 1.00 40.10 ? 429 GLN D CG 1 +ATOM 20573 C CD . GLN D 1 429 ? 21.570 8.843 27.350 1.00 41.22 ? 429 GLN D CD 1 +ATOM 20574 O OE1 . GLN D 1 429 ? 20.970 8.162 28.179 1.00 40.71 ? 429 GLN D OE1 1 +ATOM 20575 N NE2 . GLN D 1 429 ? 21.098 10.001 26.892 1.00 43.26 ? 429 GLN D NE2 1 +ATOM 20576 N N . LEU D 1 430 ? 25.833 6.007 29.270 1.00 34.49 ? 430 LEU D N 1 +ATOM 20577 C CA . LEU D 1 430 ? 26.575 5.604 30.449 1.00 32.53 ? 430 LEU D CA 1 +ATOM 20578 C C . LEU D 1 430 ? 28.059 5.417 30.164 1.00 31.91 ? 430 LEU D C 1 +ATOM 20579 O O . LEU D 1 430 ? 28.901 6.003 30.844 1.00 31.47 ? 430 LEU D O 1 +ATOM 20580 C CB . LEU D 1 430 ? 25.987 4.307 31.014 1.00 31.90 ? 430 LEU D CB 1 +ATOM 20581 C CG . LEU D 1 430 ? 25.068 4.352 32.242 1.00 33.81 ? 430 LEU D CG 1 +ATOM 20582 C CD1 . LEU D 1 430 ? 24.512 5.742 32.484 1.00 31.20 ? 430 LEU D CD1 1 +ATOM 20583 C CD2 . LEU D 1 430 ? 23.952 3.341 32.043 1.00 33.81 ? 430 LEU D CD2 1 +ATOM 20584 N N . VAL D 1 431 ? 28.389 4.614 29.161 1.00 31.10 ? 431 VAL D N 1 +ATOM 20585 C CA . VAL D 1 431 ? 29.789 4.374 28.865 1.00 31.48 ? 431 VAL D CA 1 +ATOM 20586 C C . VAL D 1 431 ? 30.484 5.610 28.323 1.00 32.24 ? 431 VAL D C 1 +ATOM 20587 O O . VAL D 1 431 ? 31.659 5.840 28.626 1.00 31.35 ? 431 VAL D O 1 +ATOM 20588 C CB . VAL D 1 431 ? 29.970 3.185 27.890 1.00 32.19 ? 431 VAL D CB 1 +ATOM 20589 C CG1 . VAL D 1 431 ? 29.346 1.942 28.489 1.00 31.88 ? 431 VAL D CG1 1 +ATOM 20590 C CG2 . VAL D 1 431 ? 29.360 3.489 26.547 1.00 32.04 ? 431 VAL D CG2 1 +ATOM 20591 N N . LEU D 1 432 ? 29.767 6.423 27.547 1.00 31.89 ? 432 LEU D N 1 +ATOM 20592 C CA . LEU D 1 432 ? 30.371 7.639 27.008 1.00 32.88 ? 432 LEU D CA 1 +ATOM 20593 C C . LEU D 1 432 ? 30.575 8.690 28.092 1.00 33.36 ? 432 LEU D C 1 +ATOM 20594 O O . LEU D 1 432 ? 31.537 9.455 28.043 1.00 32.95 ? 432 LEU D O 1 +ATOM 20595 C CB . LEU D 1 432 ? 29.527 8.224 25.870 1.00 32.00 ? 432 LEU D CB 1 +ATOM 20596 C CG . LEU D 1 432 ? 29.524 7.410 24.571 1.00 32.23 ? 432 LEU D CG 1 +ATOM 20597 C CD1 . LEU D 1 432 ? 28.782 8.176 23.490 1.00 30.03 ? 432 LEU D CD1 1 +ATOM 20598 C CD2 . LEU D 1 432 ? 30.952 7.128 24.132 1.00 31.41 ? 432 LEU D CD2 1 +ATOM 20599 N N . GLY D 1 433 ? 29.672 8.723 29.070 1.00 34.27 ? 433 GLY D N 1 +ATOM 20600 C CA . GLY D 1 433 ? 29.795 9.683 30.155 1.00 34.74 ? 433 GLY D CA 1 +ATOM 20601 C C . GLY D 1 433 ? 31.021 9.356 30.989 1.00 36.21 ? 433 GLY D C 1 +ATOM 20602 O O . GLY D 1 433 ? 31.773 10.236 31.413 1.00 35.78 ? 433 GLY D O 1 +ATOM 20603 N N . LEU D 1 434 ? 31.214 8.065 31.222 1.00 36.19 ? 434 LEU D N 1 +ATOM 20604 C CA . LEU D 1 434 ? 32.336 7.555 31.994 1.00 36.46 ? 434 LEU D CA 1 +ATOM 20605 C C . LEU D 1 434 ? 33.637 7.846 31.239 1.00 37.30 ? 434 LEU D C 1 +ATOM 20606 O O . LEU D 1 434 ? 34.626 8.322 31.802 1.00 36.62 ? 434 LEU D O 1 +ATOM 20607 C CB . LEU D 1 434 ? 32.160 6.050 32.158 1.00 35.49 ? 434 LEU D CB 1 +ATOM 20608 C CG . LEU D 1 434 ? 32.200 5.375 33.530 1.00 37.22 ? 434 LEU D CG 1 +ATOM 20609 C CD1 . LEU D 1 434 ? 31.830 6.334 34.635 1.00 35.78 ? 434 LEU D CD1 1 +ATOM 20610 C CD2 . LEU D 1 434 ? 31.253 4.186 33.491 1.00 36.03 ? 434 LEU D CD2 1 +ATOM 20611 N N . SER D 1 435 ? 33.603 7.567 29.946 1.00 37.66 ? 435 SER D N 1 +ATOM 20612 C CA . SER D 1 435 ? 34.742 7.753 29.074 1.00 38.45 ? 435 SER D CA 1 +ATOM 20613 C C . SER D 1 435 ? 35.201 9.209 28.979 1.00 39.09 ? 435 SER D C 1 +ATOM 20614 O O . SER D 1 435 ? 36.391 9.506 29.016 1.00 39.26 ? 435 SER D O 1 +ATOM 20615 C CB . SER D 1 435 ? 34.383 7.216 27.692 1.00 39.72 ? 435 SER D CB 1 +ATOM 20616 O OG . SER D 1 435 ? 35.500 7.207 26.834 1.00 43.22 ? 435 SER D OG 1 +ATOM 20617 N N . ILE D 1 436 ? 34.255 10.125 28.855 1.00 39.47 ? 436 ILE D N 1 +ATOM 20618 C CA . ILE D 1 436 ? 34.599 11.528 28.743 1.00 38.83 ? 436 ILE D CA 1 +ATOM 20619 C C . ILE D 1 436 ? 35.021 12.076 30.110 1.00 38.23 ? 436 ILE D C 1 +ATOM 20620 O O . ILE D 1 436 ? 35.473 13.208 30.222 1.00 37.92 ? 436 ILE D O 1 +ATOM 20621 C CB . ILE D 1 436 ? 33.392 12.340 28.197 1.00 39.96 ? 436 ILE D CB 1 +ATOM 20622 C CG1 . ILE D 1 436 ? 33.880 13.670 27.648 1.00 42.52 ? 436 ILE D CG1 1 +ATOM 20623 C CG2 . ILE D 1 436 ? 32.362 12.590 29.286 1.00 39.00 ? 436 ILE D CG2 1 +ATOM 20624 C CD1 . ILE D 1 436 ? 34.763 13.510 26.418 1.00 43.82 ? 436 ILE D CD1 1 +ATOM 20625 N N . SER D 1 437 ? 34.873 11.260 31.146 1.00 37.62 ? 437 SER D N 1 +ATOM 20626 C CA . SER D 1 437 ? 35.216 11.668 32.504 1.00 36.35 ? 437 SER D CA 1 +ATOM 20627 C C . SER D 1 437 ? 36.500 11.040 33.050 1.00 37.16 ? 437 SER D C 1 +ATOM 20628 O O . SER D 1 437 ? 36.693 10.981 34.268 1.00 36.39 ? 437 SER D O 1 +ATOM 20629 C CB . SER D 1 437 ? 34.058 11.347 33.453 1.00 36.09 ? 437 SER D CB 1 +ATOM 20630 O OG . SER D 1 437 ? 32.911 12.122 33.140 1.00 34.13 ? 437 SER D OG 1 +ATOM 20631 N N . GLY D 1 438 ? 37.370 10.565 32.159 1.00 36.09 ? 438 GLY D N 1 +ATOM 20632 C CA . GLY D 1 438 ? 38.625 9.992 32.606 1.00 35.51 ? 438 GLY D CA 1 +ATOM 20633 C C . GLY D 1 438 ? 38.716 8.486 32.790 1.00 37.21 ? 438 GLY D C 1 +ATOM 20634 O O . GLY D 1 438 ? 39.796 7.976 33.100 1.00 37.02 ? 438 GLY D O 1 +ATOM 20635 N N . VAL D 1 439 ? 37.611 7.767 32.617 1.00 35.68 ? 439 VAL D N 1 +ATOM 20636 C CA . VAL D 1 439 ? 37.647 6.322 32.762 1.00 36.22 ? 439 VAL D CA 1 +ATOM 20637 C C . VAL D 1 439 ? 37.469 5.731 31.368 1.00 37.01 ? 439 VAL D C 1 +ATOM 20638 O O . VAL D 1 439 ? 36.349 5.593 30.873 1.00 36.31 ? 439 VAL D O 1 +ATOM 20639 C CB . VAL D 1 439 ? 36.532 5.821 33.693 1.00 37.21 ? 439 VAL D CB 1 +ATOM 20640 C CG1 . VAL D 1 439 ? 36.736 4.332 33.989 1.00 37.96 ? 439 VAL D CG1 1 +ATOM 20641 C CG2 . VAL D 1 439 ? 36.526 6.634 34.979 1.00 36.77 ? 439 VAL D CG2 1 +ATOM 20642 N N . PRO D 1 440 ? 38.582 5.366 30.718 1.00 37.54 ? 440 PRO D N 1 +ATOM 20643 C CA . PRO D 1 440 ? 38.584 4.796 29.368 1.00 37.00 ? 440 PRO D CA 1 +ATOM 20644 C C . PRO D 1 440 ? 38.125 3.352 29.164 1.00 36.98 ? 440 PRO D C 1 +ATOM 20645 O O . PRO D 1 440 ? 37.450 3.048 28.176 1.00 37.08 ? 440 PRO D O 1 +ATOM 20646 C CB . PRO D 1 440 ? 40.028 4.992 28.931 1.00 36.55 ? 440 PRO D CB 1 +ATOM 20647 C CG . PRO D 1 440 ? 40.768 4.721 30.203 1.00 37.47 ? 440 PRO D CG 1 +ATOM 20648 C CD . PRO D 1 440 ? 39.959 5.497 31.232 1.00 37.70 ? 440 PRO D CD 1 +ATOM 20649 N N . PHE D 1 441 ? 38.486 2.460 30.075 1.00 35.77 ? 441 PHE D N 1 +ATOM 20650 C CA . PHE D 1 441 ? 38.127 1.066 29.903 1.00 35.48 ? 441 PHE D CA 1 +ATOM 20651 C C . PHE D 1 441 ? 36.793 0.750 30.535 1.00 36.61 ? 441 PHE D C 1 +ATOM 20652 O O . PHE D 1 441 ? 36.692 0.460 31.730 1.00 38.21 ? 441 PHE D O 1 +ATOM 20653 C CB . PHE D 1 441 ? 39.253 0.187 30.448 1.00 34.97 ? 441 PHE D CB 1 +ATOM 20654 C CG . PHE D 1 441 ? 40.610 0.564 29.906 1.00 35.24 ? 441 PHE D CG 1 +ATOM 20655 C CD1 . PHE D 1 441 ? 40.753 0.947 28.574 1.00 35.39 ? 441 PHE D CD1 1 +ATOM 20656 C CD2 . PHE D 1 441 ? 41.731 0.574 30.726 1.00 34.84 ? 441 PHE D CD2 1 +ATOM 20657 C CE1 . PHE D 1 441 ? 41.988 1.338 28.070 1.00 36.39 ? 441 PHE D CE1 1 +ATOM 20658 C CE2 . PHE D 1 441 ? 42.971 0.963 30.229 1.00 35.38 ? 441 PHE D CE2 1 +ATOM 20659 C CZ . PHE D 1 441 ? 43.098 1.348 28.899 1.00 36.07 ? 441 PHE D CZ 1 +ATOM 20660 N N . VAL D 1 442 ? 35.762 0.798 29.699 1.00 36.34 ? 442 VAL D N 1 +ATOM 20661 C CA . VAL D 1 442 ? 34.395 0.581 30.136 1.00 35.30 ? 442 VAL D CA 1 +ATOM 20662 C C . VAL D 1 442 ? 33.603 -0.333 29.207 1.00 36.27 ? 442 VAL D C 1 +ATOM 20663 O O . VAL D 1 442 ? 34.023 -0.641 28.093 1.00 36.88 ? 442 VAL D O 1 +ATOM 20664 C CB . VAL D 1 442 ? 33.658 1.937 30.230 1.00 35.32 ? 442 VAL D CB 1 +ATOM 20665 C CG1 . VAL D 1 442 ? 34.336 2.840 31.247 1.00 34.41 ? 442 VAL D CG1 1 +ATOM 20666 C CG2 . VAL D 1 442 ? 33.658 2.618 28.868 1.00 33.00 ? 442 VAL D CG2 1 +ATOM 20667 N N . GLY D 1 443 ? 32.440 -0.754 29.682 1.00 37.46 ? 443 GLY D N 1 +ATOM 20668 C CA . GLY D 1 443 ? 31.573 -1.612 28.899 1.00 37.94 ? 443 GLY D CA 1 +ATOM 20669 C C . GLY D 1 443 ? 30.288 -1.832 29.666 1.00 38.57 ? 443 GLY D C 1 +ATOM 20670 O O . GLY D 1 443 ? 30.104 -1.277 30.754 1.00 38.47 ? 443 GLY D O 1 +ATOM 20671 N N . CYS D 1 444 ? 29.396 -2.635 29.104 1.00 39.47 ? 444 CYS D N 1 +ATOM 20672 C CA . CYS D 1 444 ? 28.129 -2.941 29.751 1.00 41.56 ? 444 CYS D CA 1 +ATOM 20673 C C . CYS D 1 444 ? 27.856 -4.429 29.543 1.00 41.98 ? 444 CYS D C 1 +ATOM 20674 O O . CYS D 1 444 ? 28.504 -5.071 28.718 1.00 42.82 ? 444 CYS D O 1 +ATOM 20675 C CB . CYS D 1 444 ? 27.007 -2.123 29.122 1.00 43.38 ? 444 CYS D CB 1 +ATOM 20676 S SG . CYS D 1 444 ? 26.572 -2.685 27.461 1.00 49.15 ? 444 CYS D SG 1 +ATOM 20677 N N . ASP D 1 445 ? 26.908 -4.985 30.292 1.00 42.38 ? 445 ASP D N 1 +ATOM 20678 C CA . ASP D 1 445 ? 26.585 -6.394 30.136 1.00 42.43 ? 445 ASP D CA 1 +ATOM 20679 C C . ASP D 1 445 ? 25.814 -6.597 28.840 1.00 41.27 ? 445 ASP D C 1 +ATOM 20680 O O . ASP D 1 445 ? 24.680 -6.140 28.689 1.00 40.73 ? 445 ASP D O 1 +ATOM 20681 C CB . ASP D 1 445 ? 25.758 -6.921 31.323 1.00 45.49 ? 445 ASP D CB 1 +ATOM 20682 C CG . ASP D 1 445 ? 26.572 -7.017 32.628 1.00 50.20 ? 445 ASP D CG 1 +ATOM 20683 O OD1 . ASP D 1 445 ? 27.806 -7.255 32.570 1.00 51.74 ? 445 ASP D OD1 1 +ATOM 20684 O OD2 . ASP D 1 445 ? 25.969 -6.876 33.719 1.00 50.50 ? 445 ASP D OD2 1 +ATOM 20685 N N . ILE D 1 446 ? 26.445 -7.273 27.892 1.00 39.74 ? 446 ILE D N 1 +ATOM 20686 C CA . ILE D 1 446 ? 25.808 -7.541 26.617 1.00 38.28 ? 446 ILE D CA 1 +ATOM 20687 C C . ILE D 1 446 ? 24.611 -8.442 26.852 1.00 38.36 ? 446 ILE D C 1 +ATOM 20688 O O . ILE D 1 446 ? 24.738 -9.519 27.429 1.00 39.30 ? 446 ILE D O 1 +ATOM 20689 C CB . ILE D 1 446 ? 26.791 -8.219 25.653 1.00 37.22 ? 446 ILE D CB 1 +ATOM 20690 C CG1 . ILE D 1 446 ? 27.953 -7.267 25.377 1.00 35.03 ? 446 ILE D CG1 1 +ATOM 20691 C CG2 . ILE D 1 446 ? 26.088 -8.610 24.360 1.00 35.83 ? 446 ILE D CG2 1 +ATOM 20692 C CD1 . ILE D 1 446 ? 29.059 -7.881 24.589 1.00 37.07 ? 446 ILE D CD1 1 +ATOM 20693 N N . GLY D 1 447 ? 23.444 -7.986 26.413 1.00 38.55 ? 447 GLY D N 1 +ATOM 20694 C CA . GLY D 1 447 ? 22.234 -8.768 26.586 1.00 37.23 ? 447 GLY D CA 1 +ATOM 20695 C C . GLY D 1 447 ? 21.476 -8.350 27.827 1.00 37.04 ? 447 GLY D C 1 +ATOM 20696 O O . GLY D 1 447 ? 20.352 -8.800 28.052 1.00 37.67 ? 447 GLY D O 1 +ATOM 20697 N N . GLY D 1 448 ? 22.090 -7.495 28.642 1.00 36.10 ? 448 GLY D N 1 +ATOM 20698 C CA . GLY D 1 448 ? 21.433 -7.038 29.854 1.00 34.68 ? 448 GLY D CA 1 +ATOM 20699 C C . GLY D 1 448 ? 21.519 -8.031 30.995 1.00 34.63 ? 448 GLY D C 1 +ATOM 20700 O O . GLY D 1 448 ? 21.372 -9.235 30.807 1.00 36.23 ? 448 GLY D O 1 +ATOM 20701 N N . PHE D 1 449 ? 21.738 -7.523 32.197 1.00 33.86 ? 449 PHE D N 1 +ATOM 20702 C CA . PHE D 1 449 ? 21.853 -8.370 33.370 1.00 32.09 ? 449 PHE D CA 1 +ATOM 20703 C C . PHE D 1 449 ? 20.539 -8.978 33.872 1.00 33.46 ? 449 PHE D C 1 +ATOM 20704 O O . PHE D 1 449 ? 20.460 -10.187 34.092 1.00 34.22 ? 449 PHE D O 1 +ATOM 20705 C CB . PHE D 1 449 ? 22.501 -7.580 34.509 1.00 29.98 ? 449 PHE D CB 1 +ATOM 20706 C CG . PHE D 1 449 ? 22.472 -8.290 35.824 1.00 28.98 ? 449 PHE D CG 1 +ATOM 20707 C CD1 . PHE D 1 449 ? 23.343 -9.351 36.074 1.00 29.64 ? 449 PHE D CD1 1 +ATOM 20708 C CD2 . PHE D 1 449 ? 21.547 -7.922 36.809 1.00 28.65 ? 449 PHE D CD2 1 +ATOM 20709 C CE1 . PHE D 1 449 ? 23.299 -10.039 37.284 1.00 28.27 ? 449 PHE D CE1 1 +ATOM 20710 C CE2 . PHE D 1 449 ? 21.489 -8.598 38.024 1.00 27.51 ? 449 PHE D CE2 1 +ATOM 20711 C CZ . PHE D 1 449 ? 22.371 -9.663 38.262 1.00 30.99 ? 449 PHE D CZ 1 +ATOM 20712 N N . GLN D 1 450 ? 19.518 -8.148 34.069 1.00 33.35 ? 450 GLN D N 1 +ATOM 20713 C CA . GLN D 1 450 ? 18.233 -8.623 34.587 1.00 33.85 ? 450 GLN D CA 1 +ATOM 20714 C C . GLN D 1 450 ? 17.670 -9.838 33.851 1.00 34.14 ? 450 GLN D C 1 +ATOM 20715 O O . GLN D 1 450 ? 17.681 -9.893 32.624 1.00 35.17 ? 450 GLN D O 1 +ATOM 20716 C CB . GLN D 1 450 ? 17.205 -7.485 34.568 1.00 34.32 ? 450 GLN D CB 1 +ATOM 20717 C CG . GLN D 1 450 ? 17.635 -6.221 35.313 1.00 35.15 ? 450 GLN D CG 1 +ATOM 20718 C CD . GLN D 1 450 ? 17.883 -6.447 36.799 1.00 36.41 ? 450 GLN D CD 1 +ATOM 20719 O OE1 . GLN D 1 450 ? 17.274 -7.326 37.416 1.00 40.07 ? 450 GLN D OE1 1 +ATOM 20720 N NE2 . GLN D 1 450 ? 18.756 -5.632 37.385 1.00 34.21 ? 450 GLN D NE2 1 +ATOM 20721 N N . GLY D 1 451 ? 17.165 -10.801 34.618 1.00 35.69 ? 451 GLY D N 1 +ATOM 20722 C CA . GLY D 1 451 ? 16.619 -12.023 34.042 1.00 36.93 ? 451 GLY D CA 1 +ATOM 20723 C C . GLY D 1 451 ? 15.131 -12.025 33.738 1.00 37.17 ? 451 GLY D C 1 +ATOM 20724 O O . GLY D 1 451 ? 14.714 -11.570 32.674 1.00 38.93 ? 451 GLY D O 1 +ATOM 20725 N N . ARG D 1 452 ? 14.330 -12.550 34.661 1.00 36.60 ? 452 ARG D N 1 +ATOM 20726 C CA . ARG D 1 452 ? 12.883 -12.604 34.484 1.00 37.19 ? 452 ARG D CA 1 +ATOM 20727 C C . ARG D 1 452 ? 12.168 -12.422 35.805 1.00 38.21 ? 452 ARG D C 1 +ATOM 20728 O O . ARG D 1 452 ? 11.194 -13.125 36.089 1.00 38.02 ? 452 ARG D O 1 +ATOM 20729 C CB . ARG D 1 452 ? 12.454 -13.940 33.877 1.00 36.75 ? 452 ARG D CB 1 +ATOM 20730 C CG . ARG D 1 452 ? 12.958 -14.174 32.468 1.00 36.24 ? 452 ARG D CG 1 +ATOM 20731 C CD . ARG D 1 452 ? 13.730 -15.451 32.427 1.00 38.45 ? 452 ARG D CD 1 +ATOM 20732 N NE . ARG D 1 452 ? 13.004 -16.498 31.734 1.00 39.22 ? 452 ARG D NE 1 +ATOM 20733 C CZ . ARG D 1 452 ? 13.264 -17.795 31.860 1.00 39.79 ? 452 ARG D CZ 1 +ATOM 20734 N NH1 . ARG D 1 452 ? 14.233 -18.215 32.673 1.00 37.12 ? 452 ARG D NH1 1 +ATOM 20735 N NH2 . ARG D 1 452 ? 12.573 -18.674 31.141 1.00 39.36 ? 452 ARG D NH2 1 +ATOM 20736 N N . ASN D 1 453 ? 12.647 -11.480 36.612 1.00 39.21 ? 453 ASN D N 1 +ATOM 20737 C CA . ASN D 1 453 ? 12.034 -11.237 37.906 1.00 41.05 ? 453 ASN D CA 1 +ATOM 20738 C C . ASN D 1 453 ? 10.993 -10.122 37.867 1.00 41.64 ? 453 ASN D C 1 +ATOM 20739 O O . ASN D 1 453 ? 10.412 -9.781 38.891 1.00 41.62 ? 453 ASN D O 1 +ATOM 20740 C CB . ASN D 1 453 ? 13.109 -10.966 38.974 1.00 43.00 ? 453 ASN D CB 1 +ATOM 20741 C CG . ASN D 1 453 ? 14.089 -9.894 38.567 1.00 43.68 ? 453 ASN D CG 1 +ATOM 20742 O OD1 . ASN D 1 453 ? 14.707 -9.964 37.505 1.00 45.88 ? 453 ASN D OD1 1 +ATOM 20743 N ND2 . ASN D 1 453 ? 14.253 -8.897 39.423 1.00 45.16 ? 453 ASN D ND2 1 +ATOM 20744 N N . PHE D 1 454 ? 10.767 -9.554 36.683 1.00 41.43 ? 454 PHE D N 1 +ATOM 20745 C CA . PHE D 1 454 ? 9.739 -8.526 36.498 1.00 40.60 ? 454 PHE D CA 1 +ATOM 20746 C C . PHE D 1 454 ? 9.392 -8.377 35.018 1.00 39.73 ? 454 PHE D C 1 +ATOM 20747 O O . PHE D 1 454 ? 10.231 -8.591 34.144 1.00 40.34 ? 454 PHE D O 1 +ATOM 20748 C CB . PHE D 1 454 ? 10.137 -7.181 37.153 1.00 39.64 ? 454 PHE D CB 1 +ATOM 20749 C CG . PHE D 1 454 ? 11.371 -6.537 36.581 1.00 38.40 ? 454 PHE D CG 1 +ATOM 20750 C CD1 . PHE D 1 454 ? 11.282 -5.670 35.505 1.00 36.65 ? 454 PHE D CD1 1 +ATOM 20751 C CD2 . PHE D 1 454 ? 12.620 -6.777 37.148 1.00 38.52 ? 454 PHE D CD2 1 +ATOM 20752 C CE1 . PHE D 1 454 ? 12.423 -5.042 34.996 1.00 38.17 ? 454 PHE D CE1 1 +ATOM 20753 C CE2 . PHE D 1 454 ? 13.766 -6.160 36.652 1.00 38.91 ? 454 PHE D CE2 1 +ATOM 20754 C CZ . PHE D 1 454 ? 13.669 -5.287 35.571 1.00 37.25 ? 454 PHE D CZ 1 +ATOM 20755 N N . ALA D 1 455 ? 8.138 -8.024 34.759 1.00 40.01 ? 455 ALA D N 1 +ATOM 20756 C CA . ALA D 1 455 ? 7.573 -7.900 33.408 1.00 40.60 ? 455 ALA D CA 1 +ATOM 20757 C C . ALA D 1 455 ? 8.248 -7.047 32.347 1.00 41.44 ? 455 ALA D C 1 +ATOM 20758 O O . ALA D 1 455 ? 8.263 -7.417 31.179 1.00 42.89 ? 455 ALA D O 1 +ATOM 20759 C CB . ALA D 1 455 ? 6.113 -7.475 33.517 1.00 37.04 ? 455 ALA D CB 1 +ATOM 20760 N N . GLU D 1 456 ? 8.785 -5.902 32.739 1.00 43.47 ? 456 GLU D N 1 +ATOM 20761 C CA . GLU D 1 456 ? 9.408 -4.990 31.792 1.00 44.96 ? 456 GLU D CA 1 +ATOM 20762 C C . GLU D 1 456 ? 10.798 -5.402 31.317 1.00 45.43 ? 456 GLU D C 1 +ATOM 20763 O O . GLU D 1 456 ? 11.694 -4.561 31.229 1.00 47.59 ? 456 GLU D O 1 +ATOM 20764 C CB . GLU D 1 456 ? 9.477 -3.581 32.396 1.00 46.06 ? 456 GLU D CB 1 +ATOM 20765 C CG . GLU D 1 456 ? 8.132 -2.994 32.852 1.00 50.07 ? 456 GLU D CG 1 +ATOM 20766 C CD . GLU D 1 456 ? 7.483 -3.765 34.005 1.00 52.73 ? 456 GLU D CD 1 +ATOM 20767 O OE1 . GLU D 1 456 ? 8.209 -4.188 34.934 1.00 52.41 ? 456 GLU D OE1 1 +ATOM 20768 O OE2 . GLU D 1 456 ? 6.239 -3.936 33.992 1.00 55.06 ? 456 GLU D OE2 1 +ATOM 20769 N N . ILE D 1 457 ? 10.981 -6.683 31.014 1.00 43.30 ? 457 ILE D N 1 +ATOM 20770 C CA . ILE D 1 457 ? 12.263 -7.179 30.529 1.00 42.21 ? 457 ILE D CA 1 +ATOM 20771 C C . ILE D 1 457 ? 12.036 -7.786 29.150 1.00 42.88 ? 457 ILE D C 1 +ATOM 20772 O O . ILE D 1 457 ? 11.111 -8.578 28.955 1.00 42.48 ? 457 ILE D O 1 +ATOM 20773 C CB . ILE D 1 457 ? 12.847 -8.260 31.468 1.00 42.48 ? 457 ILE D CB 1 +ATOM 20774 C CG1 . ILE D 1 457 ? 13.077 -7.671 32.860 1.00 40.93 ? 457 ILE D CG1 1 +ATOM 20775 C CG2 . ILE D 1 457 ? 14.153 -8.798 30.900 1.00 40.59 ? 457 ILE D CG2 1 +ATOM 20776 C CD1 . ILE D 1 457 ? 13.647 -8.647 33.853 1.00 41.22 ? 457 ILE D CD1 1 +ATOM 20777 N N . ASP D 1 458 ? 12.876 -7.405 28.192 1.00 42.49 ? 458 ASP D N 1 +ATOM 20778 C CA . ASP D 1 458 ? 12.745 -7.900 26.827 1.00 41.86 ? 458 ASP D CA 1 +ATOM 20779 C C . ASP D 1 458 ? 13.871 -8.869 26.468 1.00 41.20 ? 458 ASP D C 1 +ATOM 20780 O O . ASP D 1 458 ? 15.006 -8.451 26.244 1.00 40.07 ? 458 ASP D O 1 +ATOM 20781 C CB . ASP D 1 458 ? 12.755 -6.725 25.854 1.00 42.48 ? 458 ASP D CB 1 +ATOM 20782 C CG . ASP D 1 458 ? 12.425 -7.141 24.435 1.00 44.31 ? 458 ASP D CG 1 +ATOM 20783 O OD1 . ASP D 1 458 ? 12.638 -8.327 24.095 1.00 44.76 ? 458 ASP D OD1 1 +ATOM 20784 O OD2 . ASP D 1 458 ? 11.966 -6.277 23.655 1.00 45.99 ? 458 ASP D OD2 1 +ATOM 20785 N N . ASN D 1 459 ? 13.551 -10.157 26.392 1.00 41.10 ? 459 ASN D N 1 +ATOM 20786 C CA . ASN D 1 459 ? 14.556 -11.162 26.068 1.00 41.51 ? 459 ASN D CA 1 +ATOM 20787 C C . ASN D 1 459 ? 14.539 -11.656 24.625 1.00 41.39 ? 459 ASN D C 1 +ATOM 20788 O O . ASN D 1 459 ? 15.006 -12.762 24.346 1.00 43.46 ? 459 ASN D O 1 +ATOM 20789 C CB . ASN D 1 459 ? 14.433 -12.359 27.016 1.00 42.86 ? 459 ASN D CB 1 +ATOM 20790 C CG . ASN D 1 459 ? 14.804 -12.004 28.445 1.00 45.25 ? 459 ASN D CG 1 +ATOM 20791 O OD1 . ASN D 1 459 ? 15.930 -11.582 28.720 1.00 46.72 ? 459 ASN D OD1 1 +ATOM 20792 N ND2 . ASN D 1 459 ? 13.855 -12.164 29.363 1.00 44.60 ? 459 ASN D ND2 1 +ATOM 20793 N N . SER D 1 460 ? 14.020 -10.850 23.705 1.00 39.75 ? 460 SER D N 1 +ATOM 20794 C CA . SER D 1 460 ? 13.993 -11.256 22.309 1.00 39.23 ? 460 SER D CA 1 +ATOM 20795 C C . SER D 1 460 ? 15.425 -11.396 21.774 1.00 39.37 ? 460 SER D C 1 +ATOM 20796 O O . SER D 1 460 ? 16.339 -10.679 22.188 1.00 37.83 ? 460 SER D O 1 +ATOM 20797 C CB . SER D 1 460 ? 13.218 -10.240 21.477 1.00 40.00 ? 460 SER D CB 1 +ATOM 20798 O OG . SER D 1 460 ? 13.867 -8.992 21.486 1.00 43.12 ? 460 SER D OG 1 +ATOM 20799 N N . MET D 1 461 ? 15.611 -12.323 20.845 1.00 39.73 ? 461 MET D N 1 +ATOM 20800 C CA . MET D 1 461 ? 16.923 -12.586 20.277 1.00 40.04 ? 461 MET D CA 1 +ATOM 20801 C C . MET D 1 461 ? 17.474 -11.517 19.350 1.00 40.19 ? 461 MET D C 1 +ATOM 20802 O O . MET D 1 461 ? 18.691 -11.345 19.268 1.00 38.71 ? 461 MET D O 1 +ATOM 20803 C CB . MET D 1 461 ? 16.908 -13.939 19.575 1.00 40.23 ? 461 MET D CB 1 +ATOM 20804 C CG . MET D 1 461 ? 16.640 -15.072 20.546 1.00 41.65 ? 461 MET D CG 1 +ATOM 20805 S SD . MET D 1 461 ? 16.447 -16.678 19.770 1.00 46.01 ? 461 MET D SD 1 +ATOM 20806 C CE . MET D 1 461 ? 14.822 -16.501 19.008 1.00 44.72 ? 461 MET D CE 1 +ATOM 20807 N N . ASP D 1 462 ? 16.609 -10.798 18.643 1.00 40.24 ? 462 ASP D N 1 +ATOM 20808 C CA . ASP D 1 462 ? 17.129 -9.752 17.767 1.00 42.09 ? 462 ASP D CA 1 +ATOM 20809 C C . ASP D 1 462 ? 17.653 -8.566 18.608 1.00 39.53 ? 462 ASP D C 1 +ATOM 20810 O O . ASP D 1 462 ? 18.566 -7.855 18.199 1.00 37.98 ? 462 ASP D O 1 +ATOM 20811 C CB . ASP D 1 462 ? 16.065 -9.313 16.751 1.00 44.96 ? 462 ASP D CB 1 +ATOM 20812 C CG . ASP D 1 462 ? 14.843 -8.720 17.398 1.00 50.38 ? 462 ASP D CG 1 +ATOM 20813 O OD1 . ASP D 1 462 ? 14.396 -9.250 18.445 1.00 54.57 ? 462 ASP D OD1 1 +ATOM 20814 O OD2 . ASP D 1 462 ? 14.317 -7.725 16.847 1.00 54.49 ? 462 ASP D OD2 1 +ATOM 20815 N N . LEU D 1 463 ? 17.084 -8.374 19.795 1.00 37.38 ? 463 LEU D N 1 +ATOM 20816 C CA . LEU D 1 463 ? 17.539 -7.311 20.685 1.00 35.57 ? 463 LEU D CA 1 +ATOM 20817 C C . LEU D 1 463 ? 18.923 -7.737 21.192 1.00 34.53 ? 463 LEU D C 1 +ATOM 20818 O O . LEU D 1 463 ? 19.838 -6.923 21.276 1.00 35.14 ? 463 LEU D O 1 +ATOM 20819 C CB . LEU D 1 463 ? 16.601 -7.164 21.883 1.00 34.40 ? 463 LEU D CB 1 +ATOM 20820 C CG . LEU D 1 463 ? 16.555 -5.832 22.656 1.00 36.41 ? 463 LEU D CG 1 +ATOM 20821 C CD1 . LEU D 1 463 ? 16.114 -6.115 24.090 1.00 34.22 ? 463 LEU D CD1 1 +ATOM 20822 C CD2 . LEU D 1 463 ? 17.897 -5.121 22.651 1.00 32.87 ? 463 LEU D CD2 1 +ATOM 20823 N N . LEU D 1 464 ? 19.061 -9.016 21.533 1.00 32.57 ? 464 LEU D N 1 +ATOM 20824 C CA . LEU D 1 464 ? 20.329 -9.553 22.010 1.00 32.07 ? 464 LEU D CA 1 +ATOM 20825 C C . LEU D 1 464 ? 21.416 -9.312 20.961 1.00 32.38 ? 464 LEU D C 1 +ATOM 20826 O O . LEU D 1 464 ? 22.528 -8.896 21.286 1.00 32.33 ? 464 LEU D O 1 +ATOM 20827 C CB . LEU D 1 464 ? 20.201 -11.050 22.295 1.00 31.06 ? 464 LEU D CB 1 +ATOM 20828 C CG . LEU D 1 464 ? 21.505 -11.769 22.662 1.00 31.54 ? 464 LEU D CG 1 +ATOM 20829 C CD1 . LEU D 1 464 ? 22.079 -11.194 23.940 1.00 29.79 ? 464 LEU D CD1 1 +ATOM 20830 C CD2 . LEU D 1 464 ? 21.234 -13.248 22.830 1.00 31.49 ? 464 LEU D CD2 1 +ATOM 20831 N N . VAL D 1 465 ? 21.088 -9.566 19.700 1.00 31.43 ? 465 VAL D N 1 +ATOM 20832 C CA . VAL D 1 465 ? 22.040 -9.348 18.629 1.00 30.13 ? 465 VAL D CA 1 +ATOM 20833 C C . VAL D 1 465 ? 22.431 -7.873 18.574 1.00 31.75 ? 465 VAL D C 1 +ATOM 20834 O O . VAL D 1 465 ? 23.590 -7.546 18.334 1.00 33.45 ? 465 VAL D O 1 +ATOM 20835 C CB . VAL D 1 465 ? 21.451 -9.786 17.270 1.00 28.95 ? 465 VAL D CB 1 +ATOM 20836 C CG1 . VAL D 1 465 ? 22.338 -9.313 16.140 1.00 26.05 ? 465 VAL D CG1 1 +ATOM 20837 C CG2 . VAL D 1 465 ? 21.328 -11.304 17.232 1.00 28.42 ? 465 VAL D CG2 1 +ATOM 20838 N N . LYS D 1 466 ? 21.472 -6.982 18.799 1.00 32.13 ? 466 LYS D N 1 +ATOM 20839 C CA . LYS D 1 466 ? 21.758 -5.551 18.775 1.00 32.54 ? 466 LYS D CA 1 +ATOM 20840 C C . LYS D 1 466 ? 22.701 -5.134 19.895 1.00 30.93 ? 466 LYS D C 1 +ATOM 20841 O O . LYS D 1 466 ? 23.423 -4.157 19.760 1.00 29.90 ? 466 LYS D O 1 +ATOM 20842 C CB . LYS D 1 466 ? 20.467 -4.736 18.874 1.00 35.17 ? 466 LYS D CB 1 +ATOM 20843 C CG . LYS D 1 466 ? 19.590 -4.822 17.640 1.00 38.14 ? 466 LYS D CG 1 +ATOM 20844 C CD . LYS D 1 466 ? 20.364 -4.441 16.399 1.00 40.08 ? 466 LYS D CD 1 +ATOM 20845 C CE . LYS D 1 466 ? 19.464 -4.466 15.176 1.00 44.27 ? 466 LYS D CE 1 +ATOM 20846 N NZ . LYS D 1 466 ? 20.235 -4.195 13.933 1.00 46.73 ? 466 LYS D NZ 1 +ATOM 20847 N N . TYR D 1 467 ? 22.673 -5.856 21.010 1.00 31.16 ? 467 TYR D N 1 +ATOM 20848 C CA . TYR D 1 467 ? 23.569 -5.554 22.129 1.00 32.72 ? 467 TYR D CA 1 +ATOM 20849 C C . TYR D 1 467 ? 25.005 -5.881 21.707 1.00 33.16 ? 467 TYR D C 1 +ATOM 20850 O O . TYR D 1 467 ? 25.926 -5.089 21.909 1.00 33.69 ? 467 TYR D O 1 +ATOM 20851 C CB . TYR D 1 467 ? 23.200 -6.388 23.350 1.00 33.37 ? 467 TYR D CB 1 +ATOM 20852 C CG . TYR D 1 467 ? 22.291 -5.688 24.326 1.00 34.48 ? 467 TYR D CG 1 +ATOM 20853 C CD1 . TYR D 1 467 ? 22.795 -4.754 25.231 1.00 33.97 ? 467 TYR D CD1 1 +ATOM 20854 C CD2 . TYR D 1 467 ? 20.921 -5.966 24.355 1.00 34.45 ? 467 TYR D CD2 1 +ATOM 20855 C CE1 . TYR D 1 467 ? 21.954 -4.116 26.146 1.00 34.28 ? 467 TYR D CE1 1 +ATOM 20856 C CE2 . TYR D 1 467 ? 20.072 -5.331 25.259 1.00 33.76 ? 467 TYR D CE2 1 +ATOM 20857 C CZ . TYR D 1 467 ? 20.595 -4.411 26.149 1.00 34.62 ? 467 TYR D CZ 1 +ATOM 20858 O OH . TYR D 1 467 ? 19.755 -3.787 27.034 1.00 35.46 ? 467 TYR D OH 1 +ATOM 20859 N N . TYR D 1 468 ? 25.185 -7.049 21.107 1.00 31.49 ? 468 TYR D N 1 +ATOM 20860 C CA . TYR D 1 468 ? 26.496 -7.461 20.640 1.00 32.44 ? 468 TYR D CA 1 +ATOM 20861 C C . TYR D 1 468 ? 27.035 -6.447 19.653 1.00 32.93 ? 468 TYR D C 1 +ATOM 20862 O O . TYR D 1 468 ? 28.229 -6.126 19.665 1.00 34.28 ? 468 TYR D O 1 +ATOM 20863 C CB . TYR D 1 468 ? 26.411 -8.831 19.963 1.00 31.27 ? 468 TYR D CB 1 +ATOM 20864 C CG . TYR D 1 468 ? 26.546 -9.988 20.916 1.00 30.77 ? 468 TYR D CG 1 +ATOM 20865 C CD1 . TYR D 1 468 ? 27.813 -10.434 21.317 1.00 31.65 ? 468 TYR D CD1 1 +ATOM 20866 C CD2 . TYR D 1 468 ? 25.422 -10.631 21.430 1.00 28.79 ? 468 TYR D CD2 1 +ATOM 20867 C CE1 . TYR D 1 468 ? 27.958 -11.496 22.206 1.00 31.65 ? 468 TYR D CE1 1 +ATOM 20868 C CE2 . TYR D 1 468 ? 25.550 -11.696 22.325 1.00 31.63 ? 468 TYR D CE2 1 +ATOM 20869 C CZ . TYR D 1 468 ? 26.825 -12.124 22.707 1.00 33.19 ? 468 TYR D CZ 1 +ATOM 20870 O OH . TYR D 1 468 ? 26.973 -13.174 23.588 1.00 34.96 ? 468 TYR D OH 1 +ATOM 20871 N N . ALA D 1 469 ? 26.149 -5.944 18.800 1.00 31.88 ? 469 ALA D N 1 +ATOM 20872 C CA . ALA D 1 469 ? 26.540 -4.973 17.782 1.00 31.62 ? 469 ALA D CA 1 +ATOM 20873 C C . ALA D 1 469 ? 26.796 -3.595 18.385 1.00 31.67 ? 469 ALA D C 1 +ATOM 20874 O O . ALA D 1 469 ? 27.675 -2.869 17.924 1.00 31.92 ? 469 ALA D O 1 +ATOM 20875 C CB . ALA D 1 469 ? 25.460 -4.881 16.708 1.00 28.91 ? 469 ALA D CB 1 +ATOM 20876 N N . LEU D 1 470 ? 26.025 -3.240 19.410 1.00 30.84 ? 470 LEU D N 1 +ATOM 20877 C CA . LEU D 1 470 ? 26.176 -1.943 20.066 1.00 32.94 ? 470 LEU D CA 1 +ATOM 20878 C C . LEU D 1 470 ? 27.556 -1.766 20.698 1.00 33.28 ? 470 LEU D C 1 +ATOM 20879 O O . LEU D 1 470 ? 28.184 -0.717 20.562 1.00 33.47 ? 470 LEU D O 1 +ATOM 20880 C CB . LEU D 1 470 ? 25.118 -1.771 21.165 1.00 31.70 ? 470 LEU D CB 1 +ATOM 20881 C CG . LEU D 1 470 ? 25.285 -0.492 21.987 1.00 33.01 ? 470 LEU D CG 1 +ATOM 20882 C CD1 . LEU D 1 470 ? 24.813 0.684 21.163 1.00 34.72 ? 470 LEU D CD1 1 +ATOM 20883 C CD2 . LEU D 1 470 ? 24.494 -0.572 23.283 1.00 32.92 ? 470 LEU D CD2 1 +ATOM 20884 N N . ALA D 1 471 ? 28.009 -2.808 21.389 1.00 33.38 ? 471 ALA D N 1 +ATOM 20885 C CA . ALA D 1 471 ? 29.279 -2.791 22.087 1.00 33.06 ? 471 ALA D CA 1 +ATOM 20886 C C . ALA D 1 471 ? 30.440 -3.269 21.233 1.00 34.07 ? 471 ALA D C 1 +ATOM 20887 O O . ALA D 1 471 ? 31.524 -3.543 21.749 1.00 34.95 ? 471 ALA D O 1 +ATOM 20888 C CB . ALA D 1 471 ? 29.170 -3.644 23.332 1.00 32.37 ? 471 ALA D CB 1 +ATOM 20889 N N . LEU D 1 472 ? 30.214 -3.372 19.929 1.00 34.31 ? 472 LEU D N 1 +ATOM 20890 C CA . LEU D 1 472 ? 31.248 -3.829 19.004 1.00 34.85 ? 472 LEU D CA 1 +ATOM 20891 C C . LEU D 1 472 ? 32.629 -3.241 19.294 1.00 34.86 ? 472 LEU D C 1 +ATOM 20892 O O . LEU D 1 472 ? 33.630 -3.950 19.273 1.00 35.20 ? 472 LEU D O 1 +ATOM 20893 C CB . LEU D 1 472 ? 30.847 -3.495 17.562 1.00 34.02 ? 472 LEU D CB 1 +ATOM 20894 C CG . LEU D 1 472 ? 31.869 -3.833 16.474 1.00 35.15 ? 472 LEU D CG 1 +ATOM 20895 C CD1 . LEU D 1 472 ? 32.224 -5.306 16.531 1.00 34.38 ? 472 LEU D CD1 1 +ATOM 20896 C CD2 . LEU D 1 472 ? 31.299 -3.475 15.115 1.00 36.14 ? 472 LEU D CD2 1 +ATOM 20897 N N . PHE D 1 473 ? 32.673 -1.943 19.565 1.00 36.24 ? 473 PHE D N 1 +ATOM 20898 C CA . PHE D 1 473 ? 33.929 -1.264 19.836 1.00 35.69 ? 473 PHE D CA 1 +ATOM 20899 C C . PHE D 1 473 ? 34.153 -0.838 21.291 1.00 36.43 ? 473 PHE D C 1 +ATOM 20900 O O . PHE D 1 473 ? 35.122 -0.132 21.583 1.00 37.90 ? 473 PHE D O 1 +ATOM 20901 C CB . PHE D 1 473 ? 34.055 -0.054 18.916 1.00 35.60 ? 473 PHE D CB 1 +ATOM 20902 C CG . PHE D 1 473 ? 34.133 -0.413 17.461 1.00 36.80 ? 473 PHE D CG 1 +ATOM 20903 C CD1 . PHE D 1 473 ? 35.277 -1.019 16.936 1.00 36.75 ? 473 PHE D CD1 1 +ATOM 20904 C CD2 . PHE D 1 473 ? 33.064 -0.158 16.617 1.00 35.66 ? 473 PHE D CD2 1 +ATOM 20905 C CE1 . PHE D 1 473 ? 35.348 -1.362 15.593 1.00 37.12 ? 473 PHE D CE1 1 +ATOM 20906 C CE2 . PHE D 1 473 ? 33.123 -0.496 15.272 1.00 36.45 ? 473 PHE D CE2 1 +ATOM 20907 C CZ . PHE D 1 473 ? 34.269 -1.102 14.756 1.00 37.44 ? 473 PHE D CZ 1 +ATOM 20908 N N . PHE D 1 474 ? 33.278 -1.249 22.205 1.00 35.10 ? 474 PHE D N 1 +ATOM 20909 C CA . PHE D 1 474 ? 33.480 -0.898 23.608 1.00 35.79 ? 474 PHE D CA 1 +ATOM 20910 C C . PHE D 1 474 ? 34.760 -1.607 24.068 1.00 36.47 ? 474 PHE D C 1 +ATOM 20911 O O . PHE D 1 474 ? 35.064 -2.708 23.603 1.00 36.67 ? 474 PHE D O 1 +ATOM 20912 C CB . PHE D 1 474 ? 32.316 -1.383 24.480 1.00 33.94 ? 474 PHE D CB 1 +ATOM 20913 C CG . PHE D 1 474 ? 31.041 -0.600 24.316 1.00 34.02 ? 474 PHE D CG 1 +ATOM 20914 C CD1 . PHE D 1 474 ? 30.934 0.420 23.375 1.00 33.67 ? 474 PHE D CD1 1 +ATOM 20915 C CD2 . PHE D 1 474 ? 29.930 -0.904 25.099 1.00 34.63 ? 474 PHE D CD2 1 +ATOM 20916 C CE1 . PHE D 1 474 ? 29.740 1.125 23.215 1.00 33.69 ? 474 PHE D CE1 1 +ATOM 20917 C CE2 . PHE D 1 474 ? 28.726 -0.205 24.948 1.00 34.97 ? 474 PHE D CE2 1 +ATOM 20918 C CZ . PHE D 1 474 ? 28.632 0.810 24.003 1.00 34.22 ? 474 PHE D CZ 1 +ATOM 20919 N N . PRO D 1 475 ? 35.535 -0.977 24.965 1.00 36.33 ? 475 PRO D N 1 +ATOM 20920 C CA . PRO D 1 475 ? 36.765 -1.611 25.448 1.00 36.88 ? 475 PRO D CA 1 +ATOM 20921 C C . PRO D 1 475 ? 36.476 -2.952 26.138 1.00 38.11 ? 475 PRO D C 1 +ATOM 20922 O O . PRO D 1 475 ? 37.121 -3.963 25.849 1.00 38.88 ? 475 PRO D O 1 +ATOM 20923 C CB . PRO D 1 475 ? 37.321 -0.575 26.412 1.00 35.86 ? 475 PRO D CB 1 +ATOM 20924 C CG . PRO D 1 475 ? 36.924 0.710 25.753 1.00 36.64 ? 475 PRO D CG 1 +ATOM 20925 C CD . PRO D 1 475 ? 35.488 0.441 25.364 1.00 35.81 ? 475 PRO D CD 1 +ATOM 20926 N N . PHE D 1 476 ? 35.500 -2.953 27.045 1.00 37.90 ? 476 PHE D N 1 +ATOM 20927 C CA . PHE D 1 476 ? 35.124 -4.158 27.784 1.00 36.82 ? 476 PHE D CA 1 +ATOM 20928 C C . PHE D 1 476 ? 33.904 -4.811 27.115 1.00 36.49 ? 476 PHE D C 1 +ATOM 20929 O O . PHE D 1 476 ? 32.817 -4.227 27.070 1.00 36.60 ? 476 PHE D O 1 +ATOM 20930 C CB . PHE D 1 476 ? 34.823 -3.792 29.240 1.00 35.00 ? 476 PHE D CB 1 +ATOM 20931 C CG . PHE D 1 476 ? 34.615 -4.975 30.128 1.00 35.36 ? 476 PHE D CG 1 +ATOM 20932 C CD1 . PHE D 1 476 ? 35.604 -5.943 30.254 1.00 36.38 ? 476 PHE D CD1 1 +ATOM 20933 C CD2 . PHE D 1 476 ? 33.434 -5.126 30.841 1.00 35.35 ? 476 PHE D CD2 1 +ATOM 20934 C CE1 . PHE D 1 476 ? 35.418 -7.052 31.081 1.00 36.41 ? 476 PHE D CE1 1 +ATOM 20935 C CE2 . PHE D 1 476 ? 33.236 -6.227 31.669 1.00 36.70 ? 476 PHE D CE2 1 +ATOM 20936 C CZ . PHE D 1 476 ? 34.233 -7.194 31.788 1.00 36.52 ? 476 PHE D CZ 1 +ATOM 20937 N N . TYR D 1 477 ? 34.103 -6.030 26.616 1.00 35.11 ? 477 TYR D N 1 +ATOM 20938 C CA . TYR D 1 477 ? 33.089 -6.784 25.883 1.00 33.77 ? 477 TYR D CA 1 +ATOM 20939 C C . TYR D 1 477 ? 32.703 -8.075 26.610 1.00 34.12 ? 477 TYR D C 1 +ATOM 20940 O O . TYR D 1 477 ? 33.273 -9.135 26.361 1.00 33.95 ? 477 TYR D O 1 +ATOM 20941 C CB . TYR D 1 477 ? 33.654 -7.119 24.498 1.00 34.10 ? 477 TYR D CB 1 +ATOM 20942 C CG . TYR D 1 477 ? 32.643 -7.394 23.412 1.00 33.44 ? 477 TYR D CG 1 +ATOM 20943 C CD1 . TYR D 1 477 ? 31.918 -6.359 22.826 1.00 31.90 ? 477 TYR D CD1 1 +ATOM 20944 C CD2 . TYR D 1 477 ? 32.449 -8.688 22.936 1.00 34.08 ? 477 TYR D CD2 1 +ATOM 20945 C CE1 . TYR D 1 477 ? 31.033 -6.603 21.792 1.00 32.48 ? 477 TYR D CE1 1 +ATOM 20946 C CE2 . TYR D 1 477 ? 31.563 -8.945 21.902 1.00 34.76 ? 477 TYR D CE2 1 +ATOM 20947 C CZ . TYR D 1 477 ? 30.857 -7.898 21.331 1.00 33.89 ? 477 TYR D CZ 1 +ATOM 20948 O OH . TYR D 1 477 ? 29.975 -8.158 20.308 1.00 35.45 ? 477 TYR D OH 1 +ATOM 20949 N N . ARG D 1 478 ? 31.713 -7.991 27.489 1.00 34.67 ? 478 ARG D N 1 +ATOM 20950 C CA . ARG D 1 478 ? 31.287 -9.155 28.246 1.00 33.92 ? 478 ARG D CA 1 +ATOM 20951 C C . ARG D 1 478 ? 29.782 -9.403 28.244 1.00 35.04 ? 478 ARG D C 1 +ATOM 20952 O O . ARG D 1 478 ? 28.974 -8.477 28.332 1.00 34.26 ? 478 ARG D O 1 +ATOM 20953 C CB . ARG D 1 478 ? 31.751 -9.022 29.702 1.00 32.85 ? 478 ARG D CB 1 +ATOM 20954 C CG . ARG D 1 478 ? 31.339 -10.181 30.583 1.00 34.17 ? 478 ARG D CG 1 +ATOM 20955 C CD . ARG D 1 478 ? 31.701 -9.968 32.052 1.00 37.25 ? 478 ARG D CD 1 +ATOM 20956 N NE . ARG D 1 478 ? 30.886 -8.930 32.678 1.00 40.68 ? 478 ARG D NE 1 +ATOM 20957 C CZ . ARG D 1 478 ? 30.616 -8.874 33.980 1.00 41.63 ? 478 ARG D CZ 1 +ATOM 20958 N NH1 . ARG D 1 478 ? 31.097 -9.801 34.800 1.00 40.60 ? 478 ARG D NH1 1 +ATOM 20959 N NH2 . ARG D 1 478 ? 29.854 -7.895 34.463 1.00 42.06 ? 478 ARG D NH2 1 +ATOM 20960 N N . SER D 1 479 ? 29.428 -10.678 28.156 1.00 36.86 ? 479 SER D N 1 +ATOM 20961 C CA . SER D 1 479 ? 28.045 -11.123 28.204 1.00 37.82 ? 479 SER D CA 1 +ATOM 20962 C C . SER D 1 479 ? 27.830 -11.602 29.638 1.00 37.82 ? 479 SER D C 1 +ATOM 20963 O O . SER D 1 479 ? 28.554 -12.473 30.118 1.00 38.37 ? 479 SER D O 1 +ATOM 20964 C CB . SER D 1 479 ? 27.838 -12.291 27.251 1.00 38.93 ? 479 SER D CB 1 +ATOM 20965 O OG . SER D 1 479 ? 26.550 -12.837 27.442 1.00 44.36 ? 479 SER D OG 1 +ATOM 20966 N N . HIS D 1 480 ? 26.851 -11.033 30.326 1.00 37.15 ? 480 HIS D N 1 +ATOM 20967 C CA . HIS D 1 480 ? 26.582 -11.414 31.712 1.00 37.03 ? 480 HIS D CA 1 +ATOM 20968 C C . HIS D 1 480 ? 25.073 -11.430 31.906 1.00 37.09 ? 480 HIS D C 1 +ATOM 20969 O O . HIS D 1 480 ? 24.374 -10.576 31.368 1.00 39.29 ? 480 HIS D O 1 +ATOM 20970 C CB . HIS D 1 480 ? 27.246 -10.406 32.655 1.00 36.96 ? 480 HIS D CB 1 +ATOM 20971 C CG . HIS D 1 480 ? 27.133 -10.755 34.106 1.00 37.82 ? 480 HIS D CG 1 +ATOM 20972 N ND1 . HIS D 1 480 ? 27.484 -11.992 34.604 1.00 37.72 ? 480 HIS D ND1 1 +ATOM 20973 C CD2 . HIS D 1 480 ? 26.755 -10.013 35.174 1.00 38.69 ? 480 HIS D CD2 1 +ATOM 20974 C CE1 . HIS D 1 480 ? 27.327 -11.997 35.916 1.00 38.62 ? 480 HIS D CE1 1 +ATOM 20975 N NE2 . HIS D 1 480 ? 26.886 -10.808 36.288 1.00 39.90 ? 480 HIS D NE2 1 +ATOM 20976 N N . LYS D 1 481 ? 24.571 -12.392 32.672 1.00 36.66 ? 481 LYS D N 1 +ATOM 20977 C CA . LYS D 1 481 ? 23.133 -12.519 32.880 1.00 35.16 ? 481 LYS D CA 1 +ATOM 20978 C C . LYS D 1 481 ? 22.808 -13.010 34.285 1.00 34.23 ? 481 LYS D C 1 +ATOM 20979 O O . LYS D 1 481 ? 23.567 -13.770 34.875 1.00 34.97 ? 481 LYS D O 1 +ATOM 20980 C CB . LYS D 1 481 ? 22.566 -13.485 31.828 1.00 35.89 ? 481 LYS D CB 1 +ATOM 20981 C CG . LYS D 1 481 ? 21.101 -13.847 31.986 1.00 37.61 ? 481 LYS D CG 1 +ATOM 20982 C CD . LYS D 1 481 ? 20.174 -12.662 31.757 1.00 38.88 ? 481 LYS D CD 1 +ATOM 20983 C CE . LYS D 1 481 ? 20.118 -12.247 30.301 1.00 41.35 ? 481 LYS D CE 1 +ATOM 20984 N NZ . LYS D 1 481 ? 19.122 -11.147 30.098 1.00 43.08 ? 481 LYS D NZ 1 +ATOM 20985 N N . ALA D 1 482 ? 21.672 -12.571 34.815 1.00 33.59 ? 482 ALA D N 1 +ATOM 20986 C CA . ALA D 1 482 ? 21.228 -12.958 36.155 1.00 34.25 ? 482 ALA D CA 1 +ATOM 20987 C C . ALA D 1 482 ? 20.824 -14.425 36.230 1.00 34.07 ? 482 ALA D C 1 +ATOM 20988 O O . ALA D 1 482 ? 20.564 -15.062 35.210 1.00 35.39 ? 482 ALA D O 1 +ATOM 20989 C CB . ALA D 1 482 ? 20.064 -12.076 36.594 1.00 32.42 ? 482 ALA D CB 1 +ATOM 20990 N N . THR D 1 483 ? 20.736 -14.946 37.448 1.00 33.71 ? 483 THR D N 1 +ATOM 20991 C CA . THR D 1 483 ? 20.408 -16.352 37.665 1.00 34.55 ? 483 THR D CA 1 +ATOM 20992 C C . THR D 1 483 ? 19.159 -16.885 36.976 1.00 35.28 ? 483 THR D C 1 +ATOM 20993 O O . THR D 1 483 ? 19.196 -17.964 36.386 1.00 33.60 ? 483 THR D O 1 +ATOM 20994 C CB . THR D 1 483 ? 20.274 -16.655 39.160 1.00 35.21 ? 483 THR D CB 1 +ATOM 20995 O OG1 . THR D 1 483 ? 21.214 -15.860 39.889 1.00 37.30 ? 483 THR D OG1 1 +ATOM 20996 C CG2 . THR D 1 483 ? 20.575 -18.118 39.428 1.00 34.42 ? 483 THR D CG2 1 +ATOM 20997 N N . ASP D 1 484 ? 18.060 -16.138 37.042 1.00 37.13 ? 484 ASP D N 1 +ATOM 20998 C CA . ASP D 1 484 ? 16.811 -16.589 36.439 1.00 39.43 ? 484 ASP D CA 1 +ATOM 20999 C C . ASP D 1 484 ? 16.581 -16.106 35.010 1.00 39.43 ? 484 ASP D C 1 +ATOM 21000 O O . ASP D 1 484 ? 15.467 -16.188 34.485 1.00 38.57 ? 484 ASP D O 1 +ATOM 21001 C CB . ASP D 1 484 ? 15.623 -16.195 37.325 1.00 41.32 ? 484 ASP D CB 1 +ATOM 21002 C CG . ASP D 1 484 ? 15.294 -14.716 37.247 1.00 46.22 ? 484 ASP D CG 1 +ATOM 21003 O OD1 . ASP D 1 484 ? 16.222 -13.892 37.043 1.00 49.02 ? 484 ASP D OD1 1 +ATOM 21004 O OD2 . ASP D 1 484 ? 14.098 -14.377 37.407 1.00 47.56 ? 484 ASP D OD2 1 +ATOM 21005 N N . GLY D 1 485 ? 17.634 -15.613 34.373 1.00 39.14 ? 485 GLY D N 1 +ATOM 21006 C CA . GLY D 1 485 ? 17.488 -15.150 33.010 1.00 40.43 ? 485 GLY D CA 1 +ATOM 21007 C C . GLY D 1 485 ? 17.706 -16.308 32.071 1.00 42.61 ? 485 GLY D C 1 +ATOM 21008 O O . GLY D 1 485 ? 18.349 -17.288 32.447 1.00 43.08 ? 485 GLY D O 1 +ATOM 21009 N N . ILE D 1 486 ? 17.166 -16.218 30.860 1.00 43.85 ? 486 ILE D N 1 +ATOM 21010 C CA . ILE D 1 486 ? 17.353 -17.280 29.875 1.00 45.42 ? 486 ILE D CA 1 +ATOM 21011 C C . ILE D 1 486 ? 18.847 -17.389 29.565 1.00 45.71 ? 486 ILE D C 1 +ATOM 21012 O O . ILE D 1 486 ? 19.601 -16.443 29.801 1.00 43.61 ? 486 ILE D O 1 +ATOM 21013 C CB . ILE D 1 486 ? 16.614 -16.961 28.560 1.00 47.04 ? 486 ILE D CB 1 +ATOM 21014 C CG1 . ILE D 1 486 ? 17.089 -15.609 28.019 1.00 48.83 ? 486 ILE D CG1 1 +ATOM 21015 C CG2 . ILE D 1 486 ? 15.106 -16.934 28.800 1.00 48.44 ? 486 ILE D CG2 1 +ATOM 21016 C CD1 . ILE D 1 486 ? 16.473 -15.225 26.693 1.00 50.89 ? 486 ILE D CD1 1 +ATOM 21017 N N . ASP D 1 487 ? 19.278 -18.542 29.054 1.00 46.66 ? 487 ASP D N 1 +ATOM 21018 C CA . ASP D 1 487 ? 20.683 -18.725 28.701 1.00 48.84 ? 487 ASP D CA 1 +ATOM 21019 C C . ASP D 1 487 ? 20.949 -17.836 27.488 1.00 49.65 ? 487 ASP D C 1 +ATOM 21020 O O . ASP D 1 487 ? 20.272 -17.953 26.467 1.00 51.08 ? 487 ASP D O 1 +ATOM 21021 C CB . ASP D 1 487 ? 20.971 -20.189 28.354 1.00 50.87 ? 487 ASP D CB 1 +ATOM 21022 C CG . ASP D 1 487 ? 20.973 -21.102 29.581 1.00 53.88 ? 487 ASP D CG 1 +ATOM 21023 O OD1 . ASP D 1 487 ? 21.810 -20.885 30.495 1.00 54.80 ? 487 ASP D OD1 1 +ATOM 21024 O OD2 . ASP D 1 487 ? 20.143 -22.043 29.627 1.00 53.90 ? 487 ASP D OD2 1 +ATOM 21025 N N . THR D 1 488 ? 21.924 -16.939 27.594 1.00 48.74 ? 488 THR D N 1 +ATOM 21026 C CA . THR D 1 488 ? 22.213 -16.042 26.487 1.00 48.84 ? 488 THR D CA 1 +ATOM 21027 C C . THR D 1 488 ? 23.496 -16.330 25.709 1.00 48.71 ? 488 THR D C 1 +ATOM 21028 O O . THR D 1 488 ? 23.871 -15.549 24.831 1.00 47.74 ? 488 THR D O 1 +ATOM 21029 C CB . THR D 1 488 ? 22.241 -14.565 26.959 1.00 49.97 ? 488 THR D CB 1 +ATOM 21030 O OG1 . THR D 1 488 ? 23.224 -14.402 27.991 1.00 49.84 ? 488 THR D OG1 1 +ATOM 21031 C CG2 . THR D 1 488 ? 20.874 -14.153 27.489 1.00 49.99 ? 488 THR D CG2 1 +ATOM 21032 N N . GLU D 1 489 ? 24.172 -17.435 26.019 1.00 47.73 ? 489 GLU D N 1 +ATOM 21033 C CA . GLU D 1 489 ? 25.388 -17.776 25.293 1.00 47.70 ? 489 GLU D CA 1 +ATOM 21034 C C . GLU D 1 489 ? 24.976 -18.033 23.847 1.00 47.16 ? 489 GLU D C 1 +ATOM 21035 O O . GLU D 1 489 ? 23.946 -18.654 23.588 1.00 45.77 ? 489 GLU D O 1 +ATOM 21036 C CB . GLU D 1 489 ? 26.043 -19.034 25.864 1.00 50.73 ? 489 GLU D CB 1 +ATOM 21037 C CG . GLU D 1 489 ? 26.482 -18.948 27.324 1.00 54.76 ? 489 GLU D CG 1 +ATOM 21038 C CD . GLU D 1 489 ? 25.314 -18.833 28.293 1.00 57.03 ? 489 GLU D CD 1 +ATOM 21039 O OE1 . GLU D 1 489 ? 24.308 -19.559 28.118 1.00 58.42 ? 489 GLU D OE1 1 +ATOM 21040 O OE2 . GLU D 1 489 ? 25.409 -18.024 29.238 1.00 57.33 ? 489 GLU D OE2 1 +ATOM 21041 N N . PRO D 1 490 ? 25.782 -17.565 22.886 1.00 46.68 ? 490 PRO D N 1 +ATOM 21042 C CA . PRO D 1 490 ? 25.532 -17.717 21.449 1.00 46.15 ? 490 PRO D CA 1 +ATOM 21043 C C . PRO D 1 490 ? 25.243 -19.145 20.993 1.00 46.93 ? 490 PRO D C 1 +ATOM 21044 O O . PRO D 1 490 ? 24.423 -19.368 20.093 1.00 45.25 ? 490 PRO D O 1 +ATOM 21045 C CB . PRO D 1 490 ? 26.806 -17.168 20.827 1.00 46.44 ? 490 PRO D CB 1 +ATOM 21046 C CG . PRO D 1 490 ? 27.236 -16.130 21.811 1.00 48.50 ? 490 PRO D CG 1 +ATOM 21047 C CD . PRO D 1 490 ? 27.043 -16.844 23.117 1.00 47.13 ? 490 PRO D CD 1 +ATOM 21048 N N . VAL D 1 491 ? 25.919 -20.110 21.611 1.00 46.29 ? 491 VAL D N 1 +ATOM 21049 C CA . VAL D 1 491 ? 25.740 -21.507 21.249 1.00 45.29 ? 491 VAL D CA 1 +ATOM 21050 C C . VAL D 1 491 ? 24.320 -22.021 21.471 1.00 44.63 ? 491 VAL D C 1 +ATOM 21051 O O . VAL D 1 491 ? 23.969 -23.088 20.975 1.00 45.13 ? 491 VAL D O 1 +ATOM 21052 C CB . VAL D 1 491 ? 26.723 -22.423 22.025 1.00 45.71 ? 491 VAL D CB 1 +ATOM 21053 C CG1 . VAL D 1 491 ? 28.156 -22.134 21.591 1.00 44.66 ? 491 VAL D CG1 1 +ATOM 21054 C CG2 . VAL D 1 491 ? 26.557 -22.224 23.525 1.00 44.05 ? 491 VAL D CG2 1 +ATOM 21055 N N . PHE D 1 492 ? 23.509 -21.273 22.211 1.00 43.32 ? 492 PHE D N 1 +ATOM 21056 C CA . PHE D 1 492 ? 22.133 -21.691 22.479 1.00 42.80 ? 492 PHE D CA 1 +ATOM 21057 C C . PHE D 1 492 ? 21.119 -20.985 21.594 1.00 41.92 ? 492 PHE D C 1 +ATOM 21058 O O . PHE D 1 492 ? 19.914 -21.157 21.771 1.00 43.24 ? 492 PHE D O 1 +ATOM 21059 C CB . PHE D 1 492 ? 21.768 -21.437 23.941 1.00 43.45 ? 492 PHE D CB 1 +ATOM 21060 C CG . PHE D 1 492 ? 22.609 -22.206 24.918 1.00 44.92 ? 492 PHE D CG 1 +ATOM 21061 C CD1 . PHE D 1 492 ? 22.632 -23.593 24.891 1.00 45.14 ? 492 PHE D CD1 1 +ATOM 21062 C CD2 . PHE D 1 492 ? 23.383 -21.545 25.866 1.00 44.58 ? 492 PHE D CD2 1 +ATOM 21063 C CE1 . PHE D 1 492 ? 23.413 -24.311 25.793 1.00 45.17 ? 492 PHE D CE1 1 +ATOM 21064 C CE2 . PHE D 1 492 ? 24.165 -22.257 26.772 1.00 44.59 ? 492 PHE D CE2 1 +ATOM 21065 C CZ . PHE D 1 492 ? 24.180 -23.641 26.734 1.00 44.49 ? 492 PHE D CZ 1 +ATOM 21066 N N . LEU D 1 493 ? 21.607 -20.197 20.643 1.00 39.58 ? 493 LEU D N 1 +ATOM 21067 C CA . LEU D 1 493 ? 20.742 -19.460 19.736 1.00 40.17 ? 493 LEU D CA 1 +ATOM 21068 C C . LEU D 1 493 ? 20.471 -20.213 18.439 1.00 40.28 ? 493 LEU D C 1 +ATOM 21069 O O . LEU D 1 493 ? 21.285 -21.015 18.003 1.00 41.26 ? 493 LEU D O 1 +ATOM 21070 C CB . LEU D 1 493 ? 21.386 -18.116 19.378 1.00 40.45 ? 493 LEU D CB 1 +ATOM 21071 C CG . LEU D 1 493 ? 21.536 -17.031 20.438 1.00 39.65 ? 493 LEU D CG 1 +ATOM 21072 C CD1 . LEU D 1 493 ? 22.453 -15.947 19.917 1.00 39.75 ? 493 LEU D CD1 1 +ATOM 21073 C CD2 . LEU D 1 493 ? 20.168 -16.462 20.782 1.00 41.08 ? 493 LEU D CD2 1 +ATOM 21074 N N . PRO D 1 494 ? 19.310 -19.974 17.814 1.00 41.11 ? 494 PRO D N 1 +ATOM 21075 C CA . PRO D 1 494 ? 19.008 -20.659 16.551 1.00 41.49 ? 494 PRO D CA 1 +ATOM 21076 C C . PRO D 1 494 ? 20.103 -20.230 15.576 1.00 42.65 ? 494 PRO D C 1 +ATOM 21077 O O . PRO D 1 494 ? 20.625 -19.120 15.689 1.00 42.99 ? 494 PRO D O 1 +ATOM 21078 C CB . PRO D 1 494 ? 17.651 -20.090 16.169 1.00 40.33 ? 494 PRO D CB 1 +ATOM 21079 C CG . PRO D 1 494 ? 17.014 -19.844 17.501 1.00 41.89 ? 494 PRO D CG 1 +ATOM 21080 C CD . PRO D 1 494 ? 18.141 -19.229 18.309 1.00 40.17 ? 494 PRO D CD 1 +ATOM 21081 N N . ASP D 1 495 ? 20.459 -21.095 14.634 1.00 43.97 ? 495 ASP D N 1 +ATOM 21082 C CA . ASP D 1 495 ? 21.508 -20.780 13.665 1.00 46.24 ? 495 ASP D CA 1 +ATOM 21083 C C . ASP D 1 495 ? 21.449 -19.359 13.096 1.00 45.22 ? 495 ASP D C 1 +ATOM 21084 O O . ASP D 1 495 ? 22.479 -18.694 12.976 1.00 45.05 ? 495 ASP D O 1 +ATOM 21085 C CB . ASP D 1 495 ? 21.494 -21.801 12.518 1.00 50.69 ? 495 ASP D CB 1 +ATOM 21086 C CG . ASP D 1 495 ? 21.861 -23.210 12.987 1.00 57.25 ? 495 ASP D CG 1 +ATOM 21087 O OD1 . ASP D 1 495 ? 22.934 -23.364 13.624 1.00 60.85 ? 495 ASP D OD1 1 +ATOM 21088 O OD2 . ASP D 1 495 ? 21.082 -24.162 12.724 1.00 59.07 ? 495 ASP D OD2 1 +ATOM 21089 N N . TYR D 1 496 ? 20.253 -18.892 12.750 1.00 43.35 ? 496 TYR D N 1 +ATOM 21090 C CA . TYR D 1 496 ? 20.097 -17.554 12.194 1.00 41.82 ? 496 TYR D CA 1 +ATOM 21091 C C . TYR D 1 496 ? 20.751 -16.479 13.068 1.00 41.35 ? 496 TYR D C 1 +ATOM 21092 O O . TYR D 1 496 ? 21.542 -15.669 12.595 1.00 41.10 ? 496 TYR D O 1 +ATOM 21093 C CB . TYR D 1 496 ? 18.613 -17.231 12.017 1.00 41.44 ? 496 TYR D CB 1 +ATOM 21094 C CG . TYR D 1 496 ? 18.364 -15.850 11.463 1.00 40.47 ? 496 TYR D CG 1 +ATOM 21095 C CD1 . TYR D 1 496 ? 18.564 -15.567 10.111 1.00 40.67 ? 496 TYR D CD1 1 +ATOM 21096 C CD2 . TYR D 1 496 ? 17.964 -14.812 12.300 1.00 41.73 ? 496 TYR D CD2 1 +ATOM 21097 C CE1 . TYR D 1 496 ? 18.373 -14.273 9.610 1.00 41.05 ? 496 TYR D CE1 1 +ATOM 21098 C CE2 . TYR D 1 496 ? 17.771 -13.520 11.816 1.00 42.19 ? 496 TYR D CE2 1 +ATOM 21099 C CZ . TYR D 1 496 ? 17.978 -13.257 10.472 1.00 42.31 ? 496 TYR D CZ 1 +ATOM 21100 O OH . TYR D 1 496 ? 17.798 -11.974 10.007 1.00 44.18 ? 496 TYR D OH 1 +ATOM 21101 N N . TYR D 1 497 ? 20.414 -16.476 14.350 1.00 41.32 ? 497 TYR D N 1 +ATOM 21102 C CA . TYR D 1 497 ? 20.956 -15.496 15.284 1.00 40.54 ? 497 TYR D CA 1 +ATOM 21103 C C . TYR D 1 497 ? 22.381 -15.811 15.709 1.00 40.06 ? 497 TYR D C 1 +ATOM 21104 O O . TYR D 1 497 ? 23.201 -14.908 15.884 1.00 37.81 ? 497 TYR D O 1 +ATOM 21105 C CB . TYR D 1 497 ? 20.047 -15.405 16.511 1.00 40.94 ? 497 TYR D CB 1 +ATOM 21106 C CG . TYR D 1 497 ? 18.695 -14.815 16.186 1.00 41.71 ? 497 TYR D CG 1 +ATOM 21107 C CD1 . TYR D 1 497 ? 18.569 -13.475 15.823 1.00 42.23 ? 497 TYR D CD1 1 +ATOM 21108 C CD2 . TYR D 1 497 ? 17.546 -15.604 16.202 1.00 43.00 ? 497 TYR D CD2 1 +ATOM 21109 C CE1 . TYR D 1 497 ? 17.327 -12.934 15.482 1.00 44.78 ? 497 TYR D CE1 1 +ATOM 21110 C CE2 . TYR D 1 497 ? 16.300 -15.077 15.865 1.00 43.19 ? 497 TYR D CE2 1 +ATOM 21111 C CZ . TYR D 1 497 ? 16.196 -13.743 15.506 1.00 44.75 ? 497 TYR D CZ 1 +ATOM 21112 O OH . TYR D 1 497 ? 14.966 -13.212 15.172 1.00 46.34 ? 497 TYR D OH 1 +ATOM 21113 N N . LYS D 1 498 ? 22.674 -17.098 15.868 1.00 40.60 ? 498 LYS D N 1 +ATOM 21114 C CA . LYS D 1 498 ? 24.005 -17.523 16.269 1.00 41.08 ? 498 LYS D CA 1 +ATOM 21115 C C . LYS D 1 498 ? 25.046 -17.049 15.270 1.00 41.29 ? 498 LYS D C 1 +ATOM 21116 O O . LYS D 1 498 ? 26.115 -16.595 15.663 1.00 41.23 ? 498 LYS D O 1 +ATOM 21117 C CB . LYS D 1 498 ? 24.056 -19.040 16.401 1.00 41.54 ? 498 LYS D CB 1 +ATOM 21118 C CG . LYS D 1 498 ? 25.451 -19.591 16.639 1.00 44.07 ? 498 LYS D CG 1 +ATOM 21119 C CD . LYS D 1 498 ? 25.416 -21.020 17.165 1.00 45.54 ? 498 LYS D CD 1 +ATOM 21120 C CE . LYS D 1 498 ? 24.748 -21.968 16.198 1.00 48.98 ? 498 LYS D CE 1 +ATOM 21121 N NZ . LYS D 1 498 ? 24.582 -23.331 16.783 1.00 52.46 ? 498 LYS D NZ 1 +ATOM 21122 N N . GLU D 1 499 ? 24.727 -17.138 13.982 1.00 41.44 ? 499 GLU D N 1 +ATOM 21123 C CA . GLU D 1 499 ? 25.660 -16.713 12.949 1.00 43.35 ? 499 GLU D CA 1 +ATOM 21124 C C . GLU D 1 499 ? 25.917 -15.220 13.011 1.00 41.51 ? 499 GLU D C 1 +ATOM 21125 O O . GLU D 1 499 ? 27.042 -14.771 12.775 1.00 40.71 ? 499 GLU D O 1 +ATOM 21126 C CB . GLU D 1 499 ? 25.146 -17.084 11.550 1.00 46.47 ? 499 GLU D CB 1 +ATOM 21127 C CG . GLU D 1 499 ? 25.874 -18.264 10.915 1.00 52.60 ? 499 GLU D CG 1 +ATOM 21128 C CD . GLU D 1 499 ? 27.400 -18.107 10.913 1.00 56.30 ? 499 GLU D CD 1 +ATOM 21129 O OE1 . GLU D 1 499 ? 27.911 -17.114 10.341 1.00 58.22 ? 499 GLU D OE1 1 +ATOM 21130 O OE2 . GLU D 1 499 ? 28.088 -18.987 11.486 1.00 57.70 ? 499 GLU D OE2 1 +ATOM 21131 N N . LYS D 1 500 ? 24.877 -14.451 13.322 1.00 39.39 ? 500 LYS D N 1 +ATOM 21132 C CA . LYS D 1 500 ? 25.036 -13.009 13.407 1.00 38.83 ? 500 LYS D CA 1 +ATOM 21133 C C . LYS D 1 500 ? 25.964 -12.627 14.563 1.00 37.56 ? 500 LYS D C 1 +ATOM 21134 O O . LYS D 1 500 ? 26.818 -11.761 14.414 1.00 37.60 ? 500 LYS D O 1 +ATOM 21135 C CB . LYS D 1 500 ? 23.675 -12.327 13.567 1.00 40.26 ? 500 LYS D CB 1 +ATOM 21136 C CG . LYS D 1 500 ? 22.854 -12.271 12.291 1.00 41.31 ? 500 LYS D CG 1 +ATOM 21137 C CD . LYS D 1 500 ? 21.573 -11.485 12.507 1.00 46.13 ? 500 LYS D CD 1 +ATOM 21138 C CE . LYS D 1 500 ? 20.694 -11.511 11.265 1.00 48.23 ? 500 LYS D CE 1 +ATOM 21139 N NZ . LYS D 1 500 ? 21.396 -10.940 10.086 1.00 50.86 ? 500 LYS D NZ 1 +ATOM 21140 N N . VAL D 1 501 ? 25.812 -13.284 15.708 1.00 36.55 ? 501 VAL D N 1 +ATOM 21141 C CA . VAL D 1 501 ? 26.656 -12.976 16.850 1.00 36.91 ? 501 VAL D CA 1 +ATOM 21142 C C . VAL D 1 501 ? 28.088 -13.368 16.528 1.00 38.07 ? 501 VAL D C 1 +ATOM 21143 O O . VAL D 1 501 ? 29.029 -12.646 16.845 1.00 37.96 ? 501 VAL D O 1 +ATOM 21144 C CB . VAL D 1 501 ? 26.184 -13.717 18.114 1.00 35.72 ? 501 VAL D CB 1 +ATOM 21145 C CG1 . VAL D 1 501 ? 27.153 -13.480 19.256 1.00 34.08 ? 501 VAL D CG1 1 +ATOM 21146 C CG2 . VAL D 1 501 ? 24.797 -13.225 18.507 1.00 36.10 ? 501 VAL D CG2 1 +ATOM 21147 N N . LYS D 1 502 ? 28.232 -14.510 15.871 1.00 39.62 ? 502 LYS D N 1 +ATOM 21148 C CA . LYS D 1 502 ? 29.532 -15.036 15.481 1.00 40.79 ? 502 LYS D CA 1 +ATOM 21149 C C . LYS D 1 502 ? 30.270 -14.042 14.582 1.00 40.82 ? 502 LYS D C 1 +ATOM 21150 O O . LYS D 1 502 ? 31.454 -13.787 14.772 1.00 40.50 ? 502 LYS D O 1 +ATOM 21151 C CB . LYS D 1 502 ? 29.331 -16.371 14.754 1.00 42.34 ? 502 LYS D CB 1 +ATOM 21152 C CG . LYS D 1 502 ? 30.579 -17.218 14.539 1.00 43.75 ? 502 LYS D CG 1 +ATOM 21153 C CD . LYS D 1 502 ? 30.176 -18.566 13.949 1.00 46.35 ? 502 LYS D CD 1 +ATOM 21154 C CE . LYS D 1 502 ? 31.355 -19.509 13.777 1.00 48.50 ? 502 LYS D CE 1 +ATOM 21155 N NZ . LYS D 1 502 ? 32.382 -18.969 12.832 1.00 52.60 ? 502 LYS D NZ 1 +ATOM 21156 N N . GLU D 1 503 ? 29.565 -13.466 13.613 1.00 41.55 ? 503 GLU D N 1 +ATOM 21157 C CA . GLU D 1 503 ? 30.192 -12.518 12.700 1.00 41.91 ? 503 GLU D CA 1 +ATOM 21158 C C . GLU D 1 503 ? 30.552 -11.211 13.384 1.00 40.01 ? 503 GLU D C 1 +ATOM 21159 O O . GLU D 1 503 ? 31.546 -10.578 13.036 1.00 40.46 ? 503 GLU D O 1 +ATOM 21160 C CB . GLU D 1 503 ? 29.283 -12.258 11.502 1.00 44.45 ? 503 GLU D CB 1 +ATOM 21161 C CG . GLU D 1 503 ? 28.911 -13.539 10.775 1.00 52.16 ? 503 GLU D CG 1 +ATOM 21162 C CD . GLU D 1 503 ? 28.058 -13.306 9.538 1.00 55.80 ? 503 GLU D CD 1 +ATOM 21163 O OE1 . GLU D 1 503 ? 27.173 -12.421 9.568 1.00 57.91 ? 503 GLU D OE1 1 +ATOM 21164 O OE2 . GLU D 1 503 ? 28.264 -14.029 8.539 1.00 58.62 ? 503 GLU D OE2 1 +ATOM 21165 N N . ILE D 1 504 ? 29.750 -10.808 14.361 1.00 37.61 ? 504 ILE D N 1 +ATOM 21166 C CA . ILE D 1 504 ? 30.023 -9.579 15.091 1.00 35.80 ? 504 ILE D CA 1 +ATOM 21167 C C . ILE D 1 504 ? 31.277 -9.739 15.958 1.00 35.14 ? 504 ILE D C 1 +ATOM 21168 O O . ILE D 1 504 ? 32.131 -8.859 15.996 1.00 33.95 ? 504 ILE D O 1 +ATOM 21169 C CB . ILE D 1 504 ? 28.826 -9.193 15.986 1.00 35.15 ? 504 ILE D CB 1 +ATOM 21170 C CG1 . ILE D 1 504 ? 27.645 -8.761 15.107 1.00 30.80 ? 504 ILE D CG1 1 +ATOM 21171 C CG2 . ILE D 1 504 ? 29.231 -8.078 16.954 1.00 33.75 ? 504 ILE D CG2 1 +ATOM 21172 C CD1 . ILE D 1 504 ? 26.352 -8.589 15.860 1.00 28.08 ? 504 ILE D CD1 1 +ATOM 21173 N N . VAL D 1 505 ? 31.385 -10.869 16.647 1.00 35.09 ? 505 VAL D N 1 +ATOM 21174 C CA . VAL D 1 505 ? 32.538 -11.131 17.492 1.00 35.74 ? 505 VAL D CA 1 +ATOM 21175 C C . VAL D 1 505 ? 33.806 -11.251 16.639 1.00 37.35 ? 505 VAL D C 1 +ATOM 21176 O O . VAL D 1 505 ? 34.872 -10.780 17.039 1.00 37.41 ? 505 VAL D O 1 +ATOM 21177 C CB . VAL D 1 505 ? 32.345 -12.422 18.313 1.00 35.78 ? 505 VAL D CB 1 +ATOM 21178 C CG1 . VAL D 1 505 ? 33.605 -12.738 19.105 1.00 35.53 ? 505 VAL D CG1 1 +ATOM 21179 C CG2 . VAL D 1 505 ? 31.170 -12.258 19.259 1.00 34.81 ? 505 VAL D CG2 1 +ATOM 21180 N N . GLU D 1 506 ? 33.694 -11.868 15.464 1.00 36.84 ? 506 GLU D N 1 +ATOM 21181 C CA . GLU D 1 506 ? 34.854 -12.006 14.595 1.00 37.86 ? 506 GLU D CA 1 +ATOM 21182 C C . GLU D 1 506 ? 35.283 -10.633 14.117 1.00 37.49 ? 506 GLU D C 1 +ATOM 21183 O O . GLU D 1 506 ? 36.474 -10.362 14.001 1.00 38.42 ? 506 GLU D O 1 +ATOM 21184 C CB . GLU D 1 506 ? 34.544 -12.912 13.402 1.00 39.49 ? 506 GLU D CB 1 +ATOM 21185 C CG . GLU D 1 506 ? 34.226 -14.338 13.816 1.00 45.77 ? 506 GLU D CG 1 +ATOM 21186 C CD . GLU D 1 506 ? 33.827 -15.239 12.652 1.00 50.65 ? 506 GLU D CD 1 +ATOM 21187 O OE1 . GLU D 1 506 ? 33.158 -14.754 11.708 1.00 52.85 ? 506 GLU D OE1 1 +ATOM 21188 O OE2 . GLU D 1 506 ? 34.165 -16.446 12.694 1.00 53.15 ? 506 GLU D OE2 1 +ATOM 21189 N N . LEU D 1 507 ? 34.313 -9.759 13.856 1.00 36.86 ? 507 LEU D N 1 +ATOM 21190 C CA . LEU D 1 507 ? 34.628 -8.409 13.406 1.00 35.21 ? 507 LEU D CA 1 +ATOM 21191 C C . LEU D 1 507 ? 35.328 -7.642 14.527 1.00 34.61 ? 507 LEU D C 1 +ATOM 21192 O O . LEU D 1 507 ? 36.194 -6.809 14.270 1.00 35.29 ? 507 LEU D O 1 +ATOM 21193 C CB . LEU D 1 507 ? 33.361 -7.663 12.973 1.00 34.28 ? 507 LEU D CB 1 +ATOM 21194 C CG . LEU D 1 507 ? 33.613 -6.273 12.355 1.00 36.06 ? 507 LEU D CG 1 +ATOM 21195 C CD1 . LEU D 1 507 ? 34.430 -6.413 11.067 1.00 33.68 ? 507 LEU D CD1 1 +ATOM 21196 C CD2 . LEU D 1 507 ? 32.289 -5.574 12.067 1.00 33.90 ? 507 LEU D CD2 1 +ATOM 21197 N N . ARG D 1 508 ? 34.956 -7.919 15.771 1.00 34.14 ? 508 ARG D N 1 +ATOM 21198 C CA . ARG D 1 508 ? 35.596 -7.242 16.892 1.00 35.38 ? 508 ARG D CA 1 +ATOM 21199 C C . ARG D 1 508 ? 37.063 -7.654 16.949 1.00 35.89 ? 508 ARG D C 1 +ATOM 21200 O O . ARG D 1 508 ? 37.943 -6.809 17.066 1.00 36.32 ? 508 ARG D O 1 +ATOM 21201 C CB . ARG D 1 508 ? 34.936 -7.601 18.222 1.00 34.14 ? 508 ARG D CB 1 +ATOM 21202 C CG . ARG D 1 508 ? 35.593 -6.897 19.393 1.00 33.67 ? 508 ARG D CG 1 +ATOM 21203 C CD . ARG D 1 508 ? 35.098 -7.424 20.715 1.00 36.43 ? 508 ARG D CD 1 +ATOM 21204 N NE . ARG D 1 508 ? 35.844 -6.854 21.832 1.00 36.55 ? 508 ARG D NE 1 +ATOM 21205 C CZ . ARG D 1 508 ? 35.758 -5.590 22.227 1.00 35.40 ? 508 ARG D CZ 1 +ATOM 21206 N NH1 . ARG D 1 508 ? 34.955 -4.752 21.594 1.00 35.89 ? 508 ARG D NH1 1 +ATOM 21207 N NH2 . ARG D 1 508 ? 36.474 -5.168 23.261 1.00 34.78 ? 508 ARG D NH2 1 +ATOM 21208 N N . TYR D 1 509 ? 37.323 -8.955 16.864 1.00 35.37 ? 509 TYR D N 1 +ATOM 21209 C CA . TYR D 1 509 ? 38.694 -9.438 16.902 1.00 35.93 ? 509 TYR D CA 1 +ATOM 21210 C C . TYR D 1 509 ? 39.504 -8.899 15.729 1.00 36.38 ? 509 TYR D C 1 +ATOM 21211 O O . TYR D 1 509 ? 40.713 -8.720 15.830 1.00 37.54 ? 509 TYR D O 1 +ATOM 21212 C CB . TYR D 1 509 ? 38.716 -10.970 16.922 1.00 35.21 ? 509 TYR D CB 1 +ATOM 21213 C CG . TYR D 1 509 ? 38.513 -11.542 18.310 1.00 35.51 ? 509 TYR D CG 1 +ATOM 21214 C CD1 . TYR D 1 509 ? 39.501 -11.402 19.300 1.00 35.41 ? 509 TYR D CD1 1 +ATOM 21215 C CD2 . TYR D 1 509 ? 37.329 -12.197 18.650 1.00 35.67 ? 509 TYR D CD2 1 +ATOM 21216 C CE1 . TYR D 1 509 ? 39.310 -11.899 20.594 1.00 34.62 ? 509 TYR D CE1 1 +ATOM 21217 C CE2 . TYR D 1 509 ? 37.127 -12.704 19.942 1.00 36.02 ? 509 TYR D CE2 1 +ATOM 21218 C CZ . TYR D 1 509 ? 38.120 -12.551 20.908 1.00 36.32 ? 509 TYR D CZ 1 +ATOM 21219 O OH . TYR D 1 509 ? 37.916 -13.052 22.178 1.00 33.97 ? 509 TYR D OH 1 +ATOM 21220 N N . LYS D 1 510 ? 38.833 -8.613 14.622 1.00 37.08 ? 510 LYS D N 1 +ATOM 21221 C CA . LYS D 1 510 ? 39.518 -8.085 13.455 1.00 36.60 ? 510 LYS D CA 1 +ATOM 21222 C C . LYS D 1 510 ? 40.012 -6.664 13.723 1.00 36.88 ? 510 LYS D C 1 +ATOM 21223 O O . LYS D 1 510 ? 41.028 -6.230 13.179 1.00 36.70 ? 510 LYS D O 1 +ATOM 21224 C CB . LYS D 1 510 ? 38.579 -8.097 12.253 1.00 37.38 ? 510 LYS D CB 1 +ATOM 21225 C CG . LYS D 1 510 ? 39.198 -7.502 11.007 1.00 40.93 ? 510 LYS D CG 1 +ATOM 21226 C CD . LYS D 1 510 ? 38.350 -7.759 9.781 1.00 43.53 ? 510 LYS D CD 1 +ATOM 21227 C CE . LYS D 1 510 ? 39.031 -7.229 8.527 1.00 46.68 ? 510 LYS D CE 1 +ATOM 21228 N NZ . LYS D 1 510 ? 38.295 -7.618 7.294 1.00 48.57 ? 510 LYS D NZ 1 +ATOM 21229 N N . PHE D 1 511 ? 39.280 -5.940 14.565 1.00 36.97 ? 511 PHE D N 1 +ATOM 21230 C CA . PHE D 1 511 ? 39.634 -4.568 14.923 1.00 36.16 ? 511 PHE D CA 1 +ATOM 21231 C C . PHE D 1 511 ? 40.384 -4.476 16.250 1.00 35.72 ? 511 PHE D C 1 +ATOM 21232 O O . PHE D 1 511 ? 40.784 -3.394 16.659 1.00 37.68 ? 511 PHE D O 1 +ATOM 21233 C CB . PHE D 1 511 ? 38.375 -3.705 15.007 1.00 34.84 ? 511 PHE D CB 1 +ATOM 21234 C CG . PHE D 1 511 ? 37.938 -3.147 13.692 1.00 36.33 ? 511 PHE D CG 1 +ATOM 21235 C CD1 . PHE D 1 511 ? 38.475 -1.956 13.219 1.00 36.37 ? 511 PHE D CD1 1 +ATOM 21236 C CD2 . PHE D 1 511 ? 37.009 -3.820 12.908 1.00 36.97 ? 511 PHE D CD2 1 +ATOM 21237 C CE1 . PHE D 1 511 ? 38.101 -1.441 11.986 1.00 35.30 ? 511 PHE D CE1 1 +ATOM 21238 C CE2 . PHE D 1 511 ? 36.630 -3.314 11.673 1.00 37.30 ? 511 PHE D CE2 1 +ATOM 21239 C CZ . PHE D 1 511 ? 37.179 -2.121 11.211 1.00 36.70 ? 511 PHE D CZ 1 +ATOM 21240 N N . LEU D 1 512 ? 40.577 -5.602 16.926 1.00 36.10 ? 512 LEU D N 1 +ATOM 21241 C CA . LEU D 1 512 ? 41.269 -5.582 18.206 1.00 37.57 ? 512 LEU D CA 1 +ATOM 21242 C C . LEU D 1 512 ? 42.603 -4.819 18.185 1.00 37.04 ? 512 LEU D C 1 +ATOM 21243 O O . LEU D 1 512 ? 42.886 -4.054 19.092 1.00 37.79 ? 512 LEU D O 1 +ATOM 21244 C CB . LEU D 1 512 ? 41.486 -7.007 18.716 1.00 39.43 ? 512 LEU D CB 1 +ATOM 21245 C CG . LEU D 1 512 ? 41.719 -7.099 20.230 1.00 41.10 ? 512 LEU D CG 1 +ATOM 21246 C CD1 . LEU D 1 512 ? 40.503 -6.579 20.959 1.00 41.57 ? 512 LEU D CD1 1 +ATOM 21247 C CD2 . LEU D 1 512 ? 41.983 -8.542 20.634 1.00 42.14 ? 512 LEU D CD2 1 +ATOM 21248 N N . PRO D 1 513 ? 43.436 -5.019 17.152 1.00 37.23 ? 513 PRO D N 1 +ATOM 21249 C CA . PRO D 1 513 ? 44.720 -4.304 17.095 1.00 37.29 ? 513 PRO D CA 1 +ATOM 21250 C C . PRO D 1 513 ? 44.565 -2.784 17.205 1.00 37.91 ? 513 PRO D C 1 +ATOM 21251 O O . PRO D 1 513 ? 45.366 -2.110 17.867 1.00 39.28 ? 513 PRO D O 1 +ATOM 21252 C CB . PRO D 1 513 ? 45.290 -4.730 15.742 1.00 35.41 ? 513 PRO D CB 1 +ATOM 21253 C CG . PRO D 1 513 ? 44.802 -6.145 15.627 1.00 36.60 ? 513 PRO D CG 1 +ATOM 21254 C CD . PRO D 1 513 ? 43.352 -6.030 16.080 1.00 36.20 ? 513 PRO D CD 1 +ATOM 21255 N N . TYR D 1 514 ? 43.541 -2.242 16.549 1.00 36.75 ? 514 TYR D N 1 +ATOM 21256 C CA . TYR D 1 514 ? 43.285 -0.809 16.590 1.00 35.09 ? 514 TYR D CA 1 +ATOM 21257 C C . TYR D 1 514 ? 42.818 -0.422 17.983 1.00 35.80 ? 514 TYR D C 1 +ATOM 21258 O O . TYR D 1 514 ? 43.307 0.548 18.568 1.00 36.28 ? 514 TYR D O 1 +ATOM 21259 C CB . TYR D 1 514 ? 42.215 -0.439 15.562 1.00 36.19 ? 514 TYR D CB 1 +ATOM 21260 C CG . TYR D 1 514 ? 41.808 1.019 15.569 1.00 34.22 ? 514 TYR D CG 1 +ATOM 21261 C CD1 . TYR D 1 514 ? 42.762 2.037 15.486 1.00 33.15 ? 514 TYR D CD1 1 +ATOM 21262 C CD2 . TYR D 1 514 ? 40.465 1.380 15.644 1.00 33.74 ? 514 TYR D CD2 1 +ATOM 21263 C CE1 . TYR D 1 514 ? 42.386 3.380 15.478 1.00 32.88 ? 514 TYR D CE1 1 +ATOM 21264 C CE2 . TYR D 1 514 ? 40.076 2.722 15.639 1.00 33.58 ? 514 TYR D CE2 1 +ATOM 21265 C CZ . TYR D 1 514 ? 41.040 3.715 15.556 1.00 33.02 ? 514 TYR D CZ 1 +ATOM 21266 O OH . TYR D 1 514 ? 40.661 5.041 15.554 1.00 31.99 ? 514 TYR D OH 1 +ATOM 21267 N N . ILE D 1 515 ? 41.869 -1.185 18.514 1.00 35.22 ? 515 ILE D N 1 +ATOM 21268 C CA . ILE D 1 515 ? 41.352 -0.919 19.845 1.00 36.22 ? 515 ILE D CA 1 +ATOM 21269 C C . ILE D 1 515 ? 42.475 -0.954 20.878 1.00 35.99 ? 515 ILE D C 1 +ATOM 21270 O O . ILE D 1 515 ? 42.577 -0.062 21.729 1.00 36.26 ? 515 ILE D O 1 +ATOM 21271 C CB . ILE D 1 515 ? 40.270 -1.947 20.234 1.00 37.92 ? 515 ILE D CB 1 +ATOM 21272 C CG1 . ILE D 1 515 ? 39.037 -1.752 19.352 1.00 38.13 ? 515 ILE D CG1 1 +ATOM 21273 C CG2 . ILE D 1 515 ? 39.888 -1.795 21.707 1.00 35.35 ? 515 ILE D CG2 1 +ATOM 21274 C CD1 . ILE D 1 515 ? 38.015 -2.883 19.481 1.00 40.66 ? 515 ILE D CD1 1 +ATOM 21275 N N . TYR D 1 516 ? 43.321 -1.976 20.807 1.00 36.08 ? 516 TYR D N 1 +ATOM 21276 C CA . TYR D 1 516 ? 44.420 -2.088 21.759 1.00 36.89 ? 516 TYR D CA 1 +ATOM 21277 C C . TYR D 1 516 ? 45.429 -0.948 21.622 1.00 36.00 ? 516 TYR D C 1 +ATOM 21278 O O . TYR D 1 516 ? 46.013 -0.515 22.617 1.00 36.85 ? 516 TYR D O 1 +ATOM 21279 C CB . TYR D 1 516 ? 45.131 -3.434 21.617 1.00 38.20 ? 516 TYR D CB 1 +ATOM 21280 C CG . TYR D 1 516 ? 45.963 -3.767 22.832 1.00 39.50 ? 516 TYR D CG 1 +ATOM 21281 C CD1 . TYR D 1 516 ? 45.414 -3.678 24.115 1.00 39.04 ? 516 TYR D CD1 1 +ATOM 21282 C CD2 . TYR D 1 516 ? 47.296 -4.161 22.707 1.00 39.40 ? 516 TYR D CD2 1 +ATOM 21283 C CE1 . TYR D 1 516 ? 46.172 -3.973 25.244 1.00 40.93 ? 516 TYR D CE1 1 +ATOM 21284 C CE2 . TYR D 1 516 ? 48.065 -4.459 23.827 1.00 40.20 ? 516 TYR D CE2 1 +ATOM 21285 C CZ . TYR D 1 516 ? 47.499 -4.366 25.093 1.00 42.39 ? 516 TYR D CZ 1 +ATOM 21286 O OH . TYR D 1 516 ? 48.250 -4.680 26.205 1.00 43.88 ? 516 TYR D OH 1 +ATOM 21287 N N . SER D 1 517 ? 45.634 -0.459 20.402 1.00 34.28 ? 517 SER D N 1 +ATOM 21288 C CA . SER D 1 517 ? 46.559 0.650 20.191 1.00 34.75 ? 517 SER D CA 1 +ATOM 21289 C C . SER D 1 517 ? 45.994 1.889 20.881 1.00 34.79 ? 517 SER D C 1 +ATOM 21290 O O . SER D 1 517 ? 46.730 2.699 21.445 1.00 36.03 ? 517 SER D O 1 +ATOM 21291 C CB . SER D 1 517 ? 46.743 0.922 18.697 1.00 34.49 ? 517 SER D CB 1 +ATOM 21292 O OG . SER D 1 517 ? 47.262 -0.223 18.043 1.00 36.30 ? 517 SER D OG 1 +ATOM 21293 N N . LEU D 1 518 ? 44.674 2.027 20.845 1.00 35.22 ? 518 LEU D N 1 +ATOM 21294 C CA . LEU D 1 518 ? 44.017 3.160 21.483 1.00 32.85 ? 518 LEU D CA 1 +ATOM 21295 C C . LEU D 1 518 ? 44.118 2.996 22.992 1.00 32.79 ? 518 LEU D C 1 +ATOM 21296 O O . LEU D 1 518 ? 44.160 3.980 23.729 1.00 32.55 ? 518 LEU D O 1 +ATOM 21297 C CB . LEU D 1 518 ? 42.553 3.240 21.045 1.00 30.96 ? 518 LEU D CB 1 +ATOM 21298 C CG . LEU D 1 518 ? 42.340 3.581 19.566 1.00 30.42 ? 518 LEU D CG 1 +ATOM 21299 C CD1 . LEU D 1 518 ? 40.860 3.403 19.197 1.00 31.44 ? 518 LEU D CD1 1 +ATOM 21300 C CD2 . LEU D 1 518 ? 42.809 5.006 19.297 1.00 27.28 ? 518 LEU D CD2 1 +ATOM 21301 N N . ALA D 1 519 ? 44.151 1.748 23.452 1.00 32.01 ? 519 ALA D N 1 +ATOM 21302 C CA . ALA D 1 519 ? 44.282 1.484 24.875 1.00 32.71 ? 519 ALA D CA 1 +ATOM 21303 C C . ALA D 1 519 ? 45.670 1.945 25.317 1.00 34.90 ? 519 ALA D C 1 +ATOM 21304 O O . ALA D 1 519 ? 45.820 2.522 26.399 1.00 34.50 ? 519 ALA D O 1 +ATOM 21305 C CB . ALA D 1 519 ? 44.110 0.006 25.160 1.00 33.42 ? 519 ALA D CB 1 +ATOM 21306 N N . LEU D 1 520 ? 46.683 1.694 24.482 1.00 35.30 ? 520 LEU D N 1 +ATOM 21307 C CA . LEU D 1 520 ? 48.045 2.108 24.801 1.00 36.51 ? 520 LEU D CA 1 +ATOM 21308 C C . LEU D 1 520 ? 48.068 3.632 24.873 1.00 38.06 ? 520 LEU D C 1 +ATOM 21309 O O . LEU D 1 520 ? 48.667 4.223 25.775 1.00 38.88 ? 520 LEU D O 1 +ATOM 21310 C CB . LEU D 1 520 ? 49.028 1.624 23.724 1.00 37.29 ? 520 LEU D CB 1 +ATOM 21311 C CG . LEU D 1 520 ? 50.461 2.178 23.823 1.00 38.77 ? 520 LEU D CG 1 +ATOM 21312 C CD1 . LEU D 1 520 ? 51.126 1.720 25.128 1.00 38.69 ? 520 LEU D CD1 1 +ATOM 21313 C CD2 . LEU D 1 520 ? 51.269 1.711 22.631 1.00 38.35 ? 520 LEU D CD2 1 +ATOM 21314 N N . GLU D 1 521 ? 47.402 4.265 23.915 1.00 38.05 ? 521 GLU D N 1 +ATOM 21315 C CA . GLU D 1 521 ? 47.334 5.719 23.864 1.00 39.41 ? 521 GLU D CA 1 +ATOM 21316 C C . GLU D 1 521 ? 46.671 6.237 25.143 1.00 39.27 ? 521 GLU D C 1 +ATOM 21317 O O . GLU D 1 521 ? 47.075 7.257 25.694 1.00 40.08 ? 521 GLU D O 1 +ATOM 21318 C CB . GLU D 1 521 ? 46.531 6.147 22.629 1.00 40.36 ? 521 GLU D CB 1 +ATOM 21319 C CG . GLU D 1 521 ? 46.470 7.642 22.354 1.00 45.60 ? 521 GLU D CG 1 +ATOM 21320 C CD . GLU D 1 521 ? 45.478 7.992 21.232 1.00 50.83 ? 521 GLU D CD 1 +ATOM 21321 O OE1 . GLU D 1 521 ? 45.549 7.375 20.139 1.00 51.82 ? 521 GLU D OE1 1 +ATOM 21322 O OE2 . GLU D 1 521 ? 44.627 8.889 21.440 1.00 52.35 ? 521 GLU D OE2 1 +ATOM 21323 N N . ALA D 1 522 ? 45.651 5.526 25.616 1.00 38.81 ? 522 ALA D N 1 +ATOM 21324 C CA . ALA D 1 522 ? 44.940 5.932 26.824 1.00 38.72 ? 522 ALA D CA 1 +ATOM 21325 C C . ALA D 1 522 ? 45.870 5.883 28.037 1.00 39.61 ? 522 ALA D C 1 +ATOM 21326 O O . ALA D 1 522 ? 45.914 6.818 28.841 1.00 37.70 ? 522 ALA D O 1 +ATOM 21327 C CB . ALA D 1 522 ? 43.724 5.025 27.051 1.00 37.17 ? 522 ALA D CB 1 +ATOM 21328 N N . SER D 1 523 ? 46.618 4.790 28.163 1.00 40.76 ? 523 SER D N 1 +ATOM 21329 C CA . SER D 1 523 ? 47.537 4.627 29.287 1.00 44.08 ? 523 SER D CA 1 +ATOM 21330 C C . SER D 1 523 ? 48.738 5.564 29.223 1.00 44.00 ? 523 SER D C 1 +ATOM 21331 O O . SER D 1 523 ? 49.389 5.801 30.234 1.00 44.80 ? 523 SER D O 1 +ATOM 21332 C CB . SER D 1 523 ? 48.036 3.187 29.366 1.00 43.12 ? 523 SER D CB 1 +ATOM 21333 O OG . SER D 1 523 ? 48.846 2.892 28.246 1.00 48.87 ? 523 SER D OG 1 +ATOM 21334 N N . GLU D 1 524 ? 49.029 6.101 28.043 1.00 45.76 ? 524 GLU D N 1 +ATOM 21335 C CA . GLU D 1 524 ? 50.162 7.005 27.897 1.00 47.81 ? 524 GLU D CA 1 +ATOM 21336 C C . GLU D 1 524 ? 49.780 8.480 27.938 1.00 48.70 ? 524 GLU D C 1 +ATOM 21337 O O . GLU D 1 524 ? 50.498 9.296 28.515 1.00 50.20 ? 524 GLU D O 1 +ATOM 21338 C CB . GLU D 1 524 ? 50.909 6.730 26.589 1.00 49.86 ? 524 GLU D CB 1 +ATOM 21339 C CG . GLU D 1 524 ? 51.469 5.328 26.457 1.00 55.07 ? 524 GLU D CG 1 +ATOM 21340 C CD . GLU D 1 524 ? 52.342 5.163 25.217 1.00 59.54 ? 524 GLU D CD 1 +ATOM 21341 O OE1 . GLU D 1 524 ? 51.901 5.560 24.113 1.00 62.02 ? 524 GLU D OE1 1 +ATOM 21342 O OE2 . GLU D 1 524 ? 53.469 4.630 25.343 1.00 61.58 ? 524 GLU D OE2 1 +ATOM 21343 N N . LYS D 1 525 ? 48.650 8.830 27.338 1.00 48.63 ? 525 LYS D N 1 +ATOM 21344 C CA . LYS D 1 525 ? 48.245 10.224 27.299 1.00 48.16 ? 525 LYS D CA 1 +ATOM 21345 C C . LYS D 1 525 ? 46.907 10.514 27.960 1.00 46.89 ? 525 LYS D C 1 +ATOM 21346 O O . LYS D 1 525 ? 46.543 11.671 28.144 1.00 46.94 ? 525 LYS D O 1 +ATOM 21347 C CB . LYS D 1 525 ? 48.229 10.696 25.846 1.00 50.53 ? 525 LYS D CB 1 +ATOM 21348 C CG . LYS D 1 525 ? 49.571 10.513 25.146 1.00 53.02 ? 525 LYS D CG 1 +ATOM 21349 C CD . LYS D 1 525 ? 49.499 10.929 23.680 1.00 58.44 ? 525 LYS D CD 1 +ATOM 21350 C CE . LYS D 1 525 ? 50.862 10.815 22.997 1.00 61.31 ? 525 LYS D CE 1 +ATOM 21351 N NZ . LYS D 1 525 ? 51.444 9.436 23.081 1.00 63.05 ? 525 LYS D NZ 1 +ATOM 21352 N N . GLY D 1 526 ? 46.176 9.470 28.321 1.00 46.18 ? 526 GLY D N 1 +ATOM 21353 C CA . GLY D 1 526 ? 44.890 9.670 28.963 1.00 45.74 ? 526 GLY D CA 1 +ATOM 21354 C C . GLY D 1 526 ? 43.759 10.002 28.005 1.00 45.66 ? 526 GLY D C 1 +ATOM 21355 O O . GLY D 1 526 ? 42.776 10.628 28.394 1.00 47.37 ? 526 GLY D O 1 +ATOM 21356 N N . HIS D 1 527 ? 43.892 9.604 26.747 1.00 44.53 ? 527 HIS D N 1 +ATOM 21357 C CA . HIS D 1 527 ? 42.846 9.856 25.763 1.00 43.89 ? 527 HIS D CA 1 +ATOM 21358 C C . HIS D 1 527 ? 41.867 8.692 25.847 1.00 42.88 ? 527 HIS D C 1 +ATOM 21359 O O . HIS D 1 527 ? 42.270 7.534 25.896 1.00 43.85 ? 527 HIS D O 1 +ATOM 21360 C CB . HIS D 1 527 ? 43.435 9.912 24.350 1.00 45.13 ? 527 HIS D CB 1 +ATOM 21361 C CG . HIS D 1 527 ? 44.406 11.033 24.136 1.00 46.66 ? 527 HIS D CG 1 +ATOM 21362 N ND1 . HIS D 1 527 ? 45.216 11.110 23.022 1.00 46.32 ? 527 HIS D ND1 1 +ATOM 21363 C CD2 . HIS D 1 527 ? 44.683 12.130 24.880 1.00 46.67 ? 527 HIS D CD2 1 +ATOM 21364 C CE1 . HIS D 1 527 ? 45.951 12.206 23.089 1.00 46.05 ? 527 HIS D CE1 1 +ATOM 21365 N NE2 . HIS D 1 527 ? 45.646 12.843 24.206 1.00 48.12 ? 527 HIS D NE2 1 +ATOM 21366 N N . PRO D 1 528 ? 40.565 8.976 25.879 1.00 41.08 ? 528 PRO D N 1 +ATOM 21367 C CA . PRO D 1 528 ? 39.625 7.857 25.956 1.00 40.68 ? 528 PRO D CA 1 +ATOM 21368 C C . PRO D 1 528 ? 39.590 7.030 24.665 1.00 40.15 ? 528 PRO D C 1 +ATOM 21369 O O . PRO D 1 528 ? 39.881 7.546 23.582 1.00 40.07 ? 528 PRO D O 1 +ATOM 21370 C CB . PRO D 1 528 ? 38.296 8.547 26.256 1.00 40.30 ? 528 PRO D CB 1 +ATOM 21371 C CG . PRO D 1 528 ? 38.457 9.888 25.604 1.00 41.79 ? 528 PRO D CG 1 +ATOM 21372 C CD . PRO D 1 528 ? 39.867 10.268 25.969 1.00 41.74 ? 528 PRO D CD 1 +ATOM 21373 N N . VAL D 1 529 ? 39.252 5.748 24.786 1.00 38.11 ? 529 VAL D N 1 +ATOM 21374 C CA . VAL D 1 529 ? 39.172 4.868 23.629 1.00 36.47 ? 529 VAL D CA 1 +ATOM 21375 C C . VAL D 1 529 ? 37.924 5.191 22.800 1.00 35.97 ? 529 VAL D C 1 +ATOM 21376 O O . VAL D 1 529 ? 38.034 5.517 21.615 1.00 34.48 ? 529 VAL D O 1 +ATOM 21377 C CB . VAL D 1 529 ? 39.150 3.391 24.059 1.00 37.78 ? 529 VAL D CB 1 +ATOM 21378 C CG1 . VAL D 1 529 ? 38.993 2.486 22.838 1.00 35.37 ? 529 VAL D CG1 1 +ATOM 21379 C CG2 . VAL D 1 529 ? 40.436 3.061 24.805 1.00 36.51 ? 529 VAL D CG2 1 +ATOM 21380 N N . ILE D 1 530 ? 36.739 5.095 23.404 1.00 35.07 ? 530 ILE D N 1 +ATOM 21381 C CA . ILE D 1 530 ? 35.525 5.437 22.671 1.00 34.70 ? 530 ILE D CA 1 +ATOM 21382 C C . ILE D 1 530 ? 35.182 6.866 23.053 1.00 35.40 ? 530 ILE D C 1 +ATOM 21383 O O . ILE D 1 530 ? 35.371 7.268 24.201 1.00 33.69 ? 530 ILE D O 1 +ATOM 21384 C CB . ILE D 1 530 ? 34.353 4.501 23.002 1.00 34.46 ? 530 ILE D CB 1 +ATOM 21385 C CG1 . ILE D 1 530 ? 34.084 4.504 24.505 1.00 33.85 ? 530 ILE D CG1 1 +ATOM 21386 C CG2 . ILE D 1 530 ? 34.657 3.095 22.479 1.00 33.25 ? 530 ILE D CG2 1 +ATOM 21387 C CD1 . ILE D 1 530 ? 32.852 3.706 24.892 1.00 33.93 ? 530 ILE D CD1 1 +ATOM 21388 N N . ARG D 1 531 ? 34.675 7.638 22.097 1.00 35.70 ? 531 ARG D N 1 +ATOM 21389 C CA . ARG D 1 531 ? 34.377 9.039 22.366 1.00 36.23 ? 531 ARG D CA 1 +ATOM 21390 C C . ARG D 1 531 ? 33.097 9.558 21.741 1.00 36.37 ? 531 ARG D C 1 +ATOM 21391 O O . ARG D 1 531 ? 32.690 9.127 20.662 1.00 35.21 ? 531 ARG D O 1 +ATOM 21392 C CB . ARG D 1 531 ? 35.519 9.912 21.839 1.00 35.30 ? 531 ARG D CB 1 +ATOM 21393 C CG . ARG D 1 531 ? 36.874 9.281 22.005 1.00 39.01 ? 531 ARG D CG 1 +ATOM 21394 C CD . ARG D 1 531 ? 37.916 9.863 21.077 1.00 38.50 ? 531 ARG D CD 1 +ATOM 21395 N NE . ARG D 1 531 ? 39.206 9.259 21.372 1.00 41.42 ? 531 ARG D NE 1 +ATOM 21396 C CZ . ARG D 1 531 ? 40.356 9.621 20.822 1.00 42.34 ? 531 ARG D CZ 1 +ATOM 21397 N NH1 . ARG D 1 531 ? 40.387 10.600 19.926 1.00 42.31 ? 531 ARG D NH1 1 +ATOM 21398 N NH2 . ARG D 1 531 ? 41.477 9.007 21.185 1.00 44.14 ? 531 ARG D NH2 1 +ATOM 21399 N N . PRO D 1 532 ? 32.440 10.501 22.422 1.00 36.72 ? 532 PRO D N 1 +ATOM 21400 C CA . PRO D 1 532 ? 31.211 11.065 21.862 1.00 36.69 ? 532 PRO D CA 1 +ATOM 21401 C C . PRO D 1 532 ? 31.698 11.952 20.711 1.00 37.50 ? 532 PRO D C 1 +ATOM 21402 O O . PRO D 1 532 ? 32.863 12.365 20.697 1.00 37.17 ? 532 PRO D O 1 +ATOM 21403 C CB . PRO D 1 532 ? 30.631 11.861 23.030 1.00 36.04 ? 532 PRO D CB 1 +ATOM 21404 C CG . PRO D 1 532 ? 31.856 12.223 23.848 1.00 37.08 ? 532 PRO D CG 1 +ATOM 21405 C CD . PRO D 1 532 ? 32.672 10.968 23.802 1.00 35.49 ? 532 PRO D CD 1 +ATOM 21406 N N . LEU D 1 533 ? 30.834 12.237 19.743 1.00 38.39 ? 533 LEU D N 1 +ATOM 21407 C CA . LEU D 1 533 ? 31.247 13.051 18.604 1.00 38.83 ? 533 LEU D CA 1 +ATOM 21408 C C . LEU D 1 533 ? 31.772 14.436 18.981 1.00 38.41 ? 533 LEU D C 1 +ATOM 21409 O O . LEU D 1 533 ? 32.703 14.941 18.349 1.00 38.22 ? 533 LEU D O 1 +ATOM 21410 C CB . LEU D 1 533 ? 30.097 13.205 17.596 1.00 37.95 ? 533 LEU D CB 1 +ATOM 21411 C CG . LEU D 1 533 ? 29.498 11.924 17.021 1.00 38.87 ? 533 LEU D CG 1 +ATOM 21412 C CD1 . LEU D 1 533 ? 28.730 12.249 15.753 1.00 36.68 ? 533 LEU D CD1 1 +ATOM 21413 C CD2 . LEU D 1 533 ? 30.602 10.923 16.732 1.00 38.62 ? 533 LEU D CD2 1 +ATOM 21414 N N . PHE D 1 534 ? 31.190 15.058 19.999 1.00 36.96 ? 534 PHE D N 1 +ATOM 21415 C CA . PHE D 1 534 ? 31.657 16.382 20.365 1.00 37.22 ? 534 PHE D CA 1 +ATOM 21416 C C . PHE D 1 534 ? 33.098 16.406 20.861 1.00 37.19 ? 534 PHE D C 1 +ATOM 21417 O O . PHE D 1 534 ? 33.702 17.467 20.960 1.00 38.78 ? 534 PHE D O 1 +ATOM 21418 C CB . PHE D 1 534 ? 30.713 17.042 21.384 1.00 35.64 ? 534 PHE D CB 1 +ATOM 21419 C CG . PHE D 1 534 ? 30.568 16.298 22.677 1.00 35.92 ? 534 PHE D CG 1 +ATOM 21420 C CD1 . PHE D 1 534 ? 31.611 16.255 23.593 1.00 34.66 ? 534 PHE D CD1 1 +ATOM 21421 C CD2 . PHE D 1 534 ? 29.363 15.674 22.999 1.00 34.39 ? 534 PHE D CD2 1 +ATOM 21422 C CE1 . PHE D 1 534 ? 31.461 15.606 24.813 1.00 35.16 ? 534 PHE D CE1 1 +ATOM 21423 C CE2 . PHE D 1 534 ? 29.202 15.022 24.218 1.00 34.47 ? 534 PHE D CE2 1 +ATOM 21424 C CZ . PHE D 1 534 ? 30.255 14.989 25.129 1.00 35.78 ? 534 PHE D CZ 1 +ATOM 21425 N N . TYR D 1 535 ? 33.661 15.245 21.161 1.00 37.60 ? 535 TYR D N 1 +ATOM 21426 C CA . TYR D 1 535 ? 35.040 15.200 21.631 1.00 38.55 ? 535 TYR D CA 1 +ATOM 21427 C C . TYR D 1 535 ? 36.005 15.575 20.502 1.00 39.34 ? 535 TYR D C 1 +ATOM 21428 O O . TYR D 1 535 ? 36.975 16.302 20.714 1.00 37.88 ? 535 TYR D O 1 +ATOM 21429 C CB . TYR D 1 535 ? 35.368 13.813 22.177 1.00 37.19 ? 535 TYR D CB 1 +ATOM 21430 C CG . TYR D 1 535 ? 36.808 13.643 22.606 1.00 37.88 ? 535 TYR D CG 1 +ATOM 21431 C CD1 . TYR D 1 535 ? 37.813 13.385 21.662 1.00 38.24 ? 535 TYR D CD1 1 +ATOM 21432 C CD2 . TYR D 1 535 ? 37.171 13.719 23.949 1.00 35.66 ? 535 TYR D CD2 1 +ATOM 21433 C CE1 . TYR D 1 535 ? 39.137 13.199 22.044 1.00 36.34 ? 535 TYR D CE1 1 +ATOM 21434 C CE2 . TYR D 1 535 ? 38.498 13.536 24.344 1.00 37.98 ? 535 TYR D CE2 1 +ATOM 21435 C CZ . TYR D 1 535 ? 39.473 13.271 23.384 1.00 37.84 ? 535 TYR D CZ 1 +ATOM 21436 O OH . TYR D 1 535 ? 40.772 13.031 23.766 1.00 38.00 ? 535 TYR D OH 1 +ATOM 21437 N N . GLU D 1 536 ? 35.721 15.084 19.301 1.00 40.71 ? 536 GLU D N 1 +ATOM 21438 C CA . GLU D 1 536 ? 36.545 15.374 18.136 1.00 41.37 ? 536 GLU D CA 1 +ATOM 21439 C C . GLU D 1 536 ? 36.095 16.630 17.402 1.00 40.82 ? 536 GLU D C 1 +ATOM 21440 O O . GLU D 1 536 ? 36.868 17.221 16.654 1.00 40.73 ? 536 GLU D O 1 +ATOM 21441 C CB . GLU D 1 536 ? 36.504 14.197 17.161 1.00 44.01 ? 536 GLU D CB 1 +ATOM 21442 C CG . GLU D 1 536 ? 37.308 12.979 17.593 1.00 47.38 ? 536 GLU D CG 1 +ATOM 21443 C CD . GLU D 1 536 ? 38.793 13.290 17.721 1.00 50.48 ? 536 GLU D CD 1 +ATOM 21444 O OE1 . GLU D 1 536 ? 39.342 13.969 16.818 1.00 51.38 ? 536 GLU D OE1 1 +ATOM 21445 O OE2 . GLU D 1 536 ? 39.410 12.853 18.719 1.00 52.73 ? 536 GLU D OE2 1 +ATOM 21446 N N . PHE D 1 537 ? 34.842 17.030 17.611 1.00 40.25 ? 537 PHE D N 1 +ATOM 21447 C CA . PHE D 1 537 ? 34.283 18.203 16.940 1.00 38.80 ? 537 PHE D CA 1 +ATOM 21448 C C . PHE D 1 537 ? 33.548 19.069 17.949 1.00 39.90 ? 537 PHE D C 1 +ATOM 21449 O O . PHE D 1 537 ? 32.355 19.334 17.795 1.00 39.81 ? 537 PHE D O 1 +ATOM 21450 C CB . PHE D 1 537 ? 33.314 17.759 15.835 1.00 38.04 ? 537 PHE D CB 1 +ATOM 21451 C CG . PHE D 1 537 ? 33.875 16.696 14.936 1.00 36.91 ? 537 PHE D CG 1 +ATOM 21452 C CD1 . PHE D 1 537 ? 33.749 15.349 15.266 1.00 36.53 ? 537 PHE D CD1 1 +ATOM 21453 C CD2 . PHE D 1 537 ? 34.593 17.044 13.796 1.00 36.17 ? 537 PHE D CD2 1 +ATOM 21454 C CE1 . PHE D 1 537 ? 34.339 14.358 14.473 1.00 37.00 ? 537 PHE D CE1 1 +ATOM 21455 C CE2 . PHE D 1 537 ? 35.188 16.063 12.997 1.00 37.41 ? 537 PHE D CE2 1 +ATOM 21456 C CZ . PHE D 1 537 ? 35.061 14.716 13.338 1.00 37.10 ? 537 PHE D CZ 1 +ATOM 21457 N N . GLN D 1 538 ? 34.278 19.522 18.966 1.00 40.27 ? 538 GLN D N 1 +ATOM 21458 C CA . GLN D 1 538 ? 33.717 20.326 20.043 1.00 40.21 ? 538 GLN D CA 1 +ATOM 21459 C C . GLN D 1 538 ? 33.186 21.689 19.644 1.00 41.22 ? 538 GLN D C 1 +ATOM 21460 O O . GLN D 1 538 ? 32.436 22.307 20.394 1.00 42.17 ? 538 GLN D O 1 +ATOM 21461 C CB . GLN D 1 538 ? 34.758 20.503 21.148 1.00 40.06 ? 538 GLN D CB 1 +ATOM 21462 C CG . GLN D 1 538 ? 35.942 21.370 20.758 1.00 37.47 ? 538 GLN D CG 1 +ATOM 21463 C CD . GLN D 1 538 ? 36.962 21.472 21.870 1.00 39.13 ? 538 GLN D CD 1 +ATOM 21464 O OE1 . GLN D 1 538 ? 37.667 20.508 22.172 1.00 38.59 ? 538 GLN D OE1 1 +ATOM 21465 N NE2 . GLN D 1 538 ? 37.036 22.641 22.499 1.00 39.07 ? 538 GLN D NE2 1 +ATOM 21466 N N . ASP D 1 539 ? 33.562 22.157 18.467 1.00 43.51 ? 539 ASP D N 1 +ATOM 21467 C CA . ASP D 1 539 ? 33.130 23.475 18.005 1.00 47.26 ? 539 ASP D CA 1 +ATOM 21468 C C . ASP D 1 539 ? 31.782 23.488 17.293 1.00 47.25 ? 539 ASP D C 1 +ATOM 21469 O O . ASP D 1 539 ? 31.277 24.550 16.954 1.00 48.76 ? 539 ASP D O 1 +ATOM 21470 C CB . ASP D 1 539 ? 34.194 24.059 17.077 1.00 50.63 ? 539 ASP D CB 1 +ATOM 21471 C CG . ASP D 1 539 ? 34.433 23.189 15.854 1.00 55.26 ? 539 ASP D CG 1 +ATOM 21472 O OD1 . ASP D 1 539 ? 34.626 21.959 16.018 1.00 56.13 ? 539 ASP D OD1 1 +ATOM 21473 O OD2 . ASP D 1 539 ? 34.427 23.738 14.729 1.00 58.63 ? 539 ASP D OD2 1 +ATOM 21474 N N . ASP D 1 540 ? 31.207 22.314 17.061 1.00 47.47 ? 540 ASP D N 1 +ATOM 21475 C CA . ASP D 1 540 ? 29.919 22.211 16.385 1.00 47.73 ? 540 ASP D CA 1 +ATOM 21476 C C . ASP D 1 540 ? 28.826 21.830 17.385 1.00 46.45 ? 540 ASP D C 1 +ATOM 21477 O O . ASP D 1 540 ? 28.770 20.692 17.848 1.00 45.82 ? 540 ASP D O 1 +ATOM 21478 C CB . ASP D 1 540 ? 30.022 21.171 15.259 1.00 50.12 ? 540 ASP D CB 1 +ATOM 21479 C CG . ASP D 1 540 ? 28.689 20.901 14.573 1.00 53.00 ? 540 ASP D CG 1 +ATOM 21480 O OD1 . ASP D 1 540 ? 27.784 21.769 14.633 1.00 55.20 ? 540 ASP D OD1 1 +ATOM 21481 O OD2 . ASP D 1 540 ? 28.556 19.821 13.955 1.00 53.53 ? 540 ASP D OD2 1 +ATOM 21482 N N . ASP D 1 541 ? 27.962 22.789 17.710 1.00 45.86 ? 541 ASP D N 1 +ATOM 21483 C CA . ASP D 1 541 ? 26.874 22.573 18.667 1.00 46.42 ? 541 ASP D CA 1 +ATOM 21484 C C . ASP D 1 541 ? 25.994 21.349 18.388 1.00 46.40 ? 541 ASP D C 1 +ATOM 21485 O O . ASP D 1 541 ? 25.533 20.690 19.315 1.00 45.71 ? 541 ASP D O 1 +ATOM 21486 C CB . ASP D 1 541 ? 26.006 23.831 18.770 1.00 46.34 ? 541 ASP D CB 1 +ATOM 21487 C CG . ASP D 1 541 ? 26.773 25.027 19.338 1.00 50.13 ? 541 ASP D CG 1 +ATOM 21488 O OD1 . ASP D 1 541 ? 27.771 24.812 20.061 1.00 51.14 ? 541 ASP D OD1 1 +ATOM 21489 O OD2 . ASP D 1 541 ? 26.379 26.187 19.080 1.00 52.60 ? 541 ASP D OD2 1 +ATOM 21490 N N . ASP D 1 542 ? 25.765 21.047 17.114 1.00 47.01 ? 542 ASP D N 1 +ATOM 21491 C CA . ASP D 1 542 ? 24.961 19.895 16.719 1.00 46.53 ? 542 ASP D CA 1 +ATOM 21492 C C . ASP D 1 542 ? 25.453 18.613 17.384 1.00 45.53 ? 542 ASP D C 1 +ATOM 21493 O O . ASP D 1 542 ? 24.663 17.772 17.816 1.00 44.95 ? 542 ASP D O 1 +ATOM 21494 C CB . ASP D 1 542 ? 25.031 19.704 15.203 1.00 49.44 ? 542 ASP D CB 1 +ATOM 21495 C CG . ASP D 1 542 ? 24.159 20.684 14.442 1.00 53.36 ? 542 ASP D CG 1 +ATOM 21496 O OD1 . ASP D 1 542 ? 24.027 21.855 14.883 1.00 54.87 ? 542 ASP D OD1 1 +ATOM 21497 O OD2 . ASP D 1 542 ? 23.619 20.274 13.387 1.00 53.08 ? 542 ASP D OD2 1 +ATOM 21498 N N . MET D 1 543 ? 26.770 18.473 17.451 1.00 44.53 ? 543 MET D N 1 +ATOM 21499 C CA . MET D 1 543 ? 27.407 17.292 18.020 1.00 43.31 ? 543 MET D CA 1 +ATOM 21500 C C . MET D 1 543 ? 27.004 16.952 19.445 1.00 41.43 ? 543 MET D C 1 +ATOM 21501 O O . MET D 1 543 ? 27.053 15.796 19.837 1.00 43.51 ? 543 MET D O 1 +ATOM 21502 C CB . MET D 1 543 ? 28.932 17.437 17.938 1.00 43.67 ? 543 MET D CB 1 +ATOM 21503 C CG . MET D 1 543 ? 29.454 17.661 16.526 1.00 44.45 ? 543 MET D CG 1 +ATOM 21504 S SD . MET D 1 543 ? 29.077 16.287 15.412 1.00 48.70 ? 543 MET D SD 1 +ATOM 21505 C CE . MET D 1 543 ? 27.596 16.892 14.560 1.00 45.05 ? 543 MET D CE 1 +ATOM 21506 N N . TYR D 1 544 ? 26.599 17.940 20.224 1.00 39.96 ? 544 TYR D N 1 +ATOM 21507 C CA . TYR D 1 544 ? 26.215 17.674 21.600 1.00 39.44 ? 544 TYR D CA 1 +ATOM 21508 C C . TYR D 1 544 ? 24.823 17.073 21.752 1.00 40.48 ? 544 TYR D C 1 +ATOM 21509 O O . TYR D 1 544 ? 24.379 16.802 22.863 1.00 39.96 ? 544 TYR D O 1 +ATOM 21510 C CB . TYR D 1 544 ? 26.328 18.950 22.434 1.00 38.12 ? 544 TYR D CB 1 +ATOM 21511 C CG . TYR D 1 544 ? 27.735 19.485 22.499 1.00 36.40 ? 544 TYR D CG 1 +ATOM 21512 C CD1 . TYR D 1 544 ? 28.291 20.164 21.421 1.00 35.31 ? 544 TYR D CD1 1 +ATOM 21513 C CD2 . TYR D 1 544 ? 28.524 19.285 23.628 1.00 35.79 ? 544 TYR D CD2 1 +ATOM 21514 C CE1 . TYR D 1 544 ? 29.593 20.634 21.461 1.00 35.17 ? 544 TYR D CE1 1 +ATOM 21515 C CE2 . TYR D 1 544 ? 29.829 19.746 23.681 1.00 35.61 ? 544 TYR D CE2 1 +ATOM 21516 C CZ . TYR D 1 544 ? 30.359 20.425 22.594 1.00 36.05 ? 544 TYR D CZ 1 +ATOM 21517 O OH . TYR D 1 544 ? 31.643 20.918 22.647 1.00 34.47 ? 544 TYR D OH 1 +ATOM 21518 N N . ARG D 1 545 ? 24.136 16.862 20.639 1.00 42.81 ? 545 ARG D N 1 +ATOM 21519 C CA . ARG D 1 545 ? 22.805 16.269 20.675 1.00 44.62 ? 545 ARG D CA 1 +ATOM 21520 C C . ARG D 1 545 ? 22.823 14.881 20.036 1.00 45.38 ? 545 ARG D C 1 +ATOM 21521 O O . ARG D 1 545 ? 21.814 14.178 20.033 1.00 46.04 ? 545 ARG D O 1 +ATOM 21522 C CB . ARG D 1 545 ? 21.792 17.159 19.943 1.00 46.00 ? 545 ARG D CB 1 +ATOM 21523 C CG . ARG D 1 545 ? 21.543 18.518 20.603 1.00 47.82 ? 545 ARG D CG 1 +ATOM 21524 C CD . ARG D 1 545 ? 21.124 18.369 22.062 1.00 49.22 ? 545 ARG D CD 1 +ATOM 21525 N NE . ARG D 1 545 ? 19.837 17.689 22.226 1.00 52.42 ? 545 ARG D NE 1 +ATOM 21526 C CZ . ARG D 1 545 ? 18.652 18.250 21.997 1.00 51.93 ? 545 ARG D CZ 1 +ATOM 21527 N NH1 . ARG D 1 545 ? 18.571 19.510 21.590 1.00 51.65 ? 545 ARG D NH1 1 +ATOM 21528 N NH2 . ARG D 1 545 ? 17.542 17.550 22.183 1.00 52.68 ? 545 ARG D NH2 1 +ATOM 21529 N N . ILE D 1 546 ? 23.965 14.493 19.478 1.00 45.32 ? 546 ILE D N 1 +ATOM 21530 C CA . ILE D 1 546 ? 24.082 13.178 18.858 1.00 47.83 ? 546 ILE D CA 1 +ATOM 21531 C C . ILE D 1 546 ? 24.536 12.181 19.926 1.00 48.71 ? 546 ILE D C 1 +ATOM 21532 O O . ILE D 1 546 ? 25.645 12.286 20.454 1.00 50.79 ? 546 ILE D O 1 +ATOM 21533 C CB . ILE D 1 546 ? 25.094 13.199 17.685 1.00 48.39 ? 546 ILE D CB 1 +ATOM 21534 C CG1 . ILE D 1 546 ? 24.429 13.734 16.408 1.00 49.71 ? 546 ILE D CG1 1 +ATOM 21535 C CG2 . ILE D 1 546 ? 25.589 11.791 17.403 1.00 49.25 ? 546 ILE D CG2 1 +ATOM 21536 C CD1 . ILE D 1 546 ? 23.694 15.062 16.547 1.00 48.92 ? 546 ILE D CD1 1 +ATOM 21537 N N . GLU D 1 547 ? 23.685 11.215 20.252 1.00 48.81 ? 547 GLU D N 1 +ATOM 21538 C CA . GLU D 1 547 ? 24.040 10.255 21.288 1.00 49.50 ? 547 GLU D CA 1 +ATOM 21539 C C . GLU D 1 547 ? 23.950 8.788 20.909 1.00 47.65 ? 547 GLU D C 1 +ATOM 21540 O O . GLU D 1 547 ? 24.298 7.930 21.712 1.00 48.87 ? 547 GLU D O 1 +ATOM 21541 C CB . GLU D 1 547 ? 23.193 10.507 22.532 1.00 52.62 ? 547 GLU D CB 1 +ATOM 21542 C CG . GLU D 1 547 ? 23.218 11.953 22.992 1.00 57.09 ? 547 GLU D CG 1 +ATOM 21543 C CD . GLU D 1 547 ? 22.704 12.122 24.402 1.00 58.83 ? 547 GLU D CD 1 +ATOM 21544 O OE1 . GLU D 1 547 ? 21.600 11.617 24.694 1.00 60.59 ? 547 GLU D OE1 1 +ATOM 21545 O OE2 . GLU D 1 547 ? 23.407 12.760 25.213 1.00 59.93 ? 547 GLU D OE2 1 +ATOM 21546 N N . ASP D 1 548 ? 23.472 8.492 19.704 1.00 45.10 ? 548 ASP D N 1 +ATOM 21547 C CA . ASP D 1 548 ? 23.387 7.107 19.253 1.00 42.47 ? 548 ASP D CA 1 +ATOM 21548 C C . ASP D 1 548 ? 24.514 6.814 18.265 1.00 40.07 ? 548 ASP D C 1 +ATOM 21549 O O . ASP D 1 548 ? 24.414 5.913 17.437 1.00 38.03 ? 548 ASP D O 1 +ATOM 21550 C CB . ASP D 1 548 ? 22.027 6.818 18.605 1.00 44.43 ? 548 ASP D CB 1 +ATOM 21551 C CG . ASP D 1 548 ? 21.589 7.907 17.632 1.00 48.41 ? 548 ASP D CG 1 +ATOM 21552 O OD1 . ASP D 1 548 ? 22.450 8.699 17.171 1.00 46.85 ? 548 ASP D OD1 1 +ATOM 21553 O OD2 . ASP D 1 548 ? 20.374 7.959 17.320 1.00 50.90 ? 548 ASP D OD2 1 +ATOM 21554 N N . GLU D 1 549 ? 25.580 7.602 18.360 1.00 37.83 ? 549 GLU D N 1 +ATOM 21555 C CA . GLU D 1 549 ? 26.755 7.449 17.514 1.00 36.30 ? 549 GLU D CA 1 +ATOM 21556 C C . GLU D 1 549 ? 27.952 7.697 18.401 1.00 35.20 ? 549 GLU D C 1 +ATOM 21557 O O . GLU D 1 549 ? 27.843 8.423 19.386 1.00 33.84 ? 549 GLU D O 1 +ATOM 21558 C CB . GLU D 1 549 ? 26.772 8.489 16.391 1.00 36.54 ? 549 GLU D CB 1 +ATOM 21559 C CG . GLU D 1 549 ? 25.781 8.254 15.280 1.00 38.55 ? 549 GLU D CG 1 +ATOM 21560 C CD . GLU D 1 549 ? 25.769 9.384 14.272 1.00 38.93 ? 549 GLU D CD 1 +ATOM 21561 O OE1 . GLU D 1 549 ? 26.860 9.859 13.898 1.00 40.76 ? 549 GLU D OE1 1 +ATOM 21562 O OE2 . GLU D 1 549 ? 24.670 9.792 13.839 1.00 40.93 ? 549 GLU D OE2 1 +ATOM 21563 N N . TYR D 1 550 ? 29.085 7.085 18.066 1.00 33.85 ? 550 TYR D N 1 +ATOM 21564 C CA . TYR D 1 550 ? 30.300 7.310 18.830 1.00 32.38 ? 550 TYR D CA 1 +ATOM 21565 C C . TYR D 1 550 ? 31.539 7.056 18.007 1.00 32.67 ? 550 TYR D C 1 +ATOM 21566 O O . TYR D 1 550 ? 31.517 6.294 17.042 1.00 32.69 ? 550 TYR D O 1 +ATOM 21567 C CB . TYR D 1 550 ? 30.335 6.479 20.123 1.00 31.57 ? 550 TYR D CB 1 +ATOM 21568 C CG . TYR D 1 550 ? 30.405 4.964 19.991 1.00 32.12 ? 550 TYR D CG 1 +ATOM 21569 C CD1 . TYR D 1 550 ? 29.247 4.196 19.876 1.00 32.00 ? 550 TYR D CD1 1 +ATOM 21570 C CD2 . TYR D 1 550 ? 31.632 4.292 20.085 1.00 32.37 ? 550 TYR D CD2 1 +ATOM 21571 C CE1 . TYR D 1 550 ? 29.303 2.792 19.871 1.00 32.00 ? 550 TYR D CE1 1 +ATOM 21572 C CE2 . TYR D 1 550 ? 31.704 2.896 20.078 1.00 30.02 ? 550 TYR D CE2 1 +ATOM 21573 C CZ . TYR D 1 550 ? 30.538 2.150 19.976 1.00 32.93 ? 550 TYR D CZ 1 +ATOM 21574 O OH . TYR D 1 550 ? 30.601 0.768 20.010 1.00 30.17 ? 550 TYR D OH 1 +ATOM 21575 N N . MET D 1 551 ? 32.614 7.739 18.382 1.00 34.75 ? 551 MET D N 1 +ATOM 21576 C CA . MET D 1 551 ? 33.910 7.624 17.716 1.00 34.94 ? 551 MET D CA 1 +ATOM 21577 C C . MET D 1 551 ? 34.755 6.599 18.448 1.00 33.78 ? 551 MET D C 1 +ATOM 21578 O O . MET D 1 551 ? 34.729 6.518 19.681 1.00 32.02 ? 551 MET D O 1 +ATOM 21579 C CB . MET D 1 551 ? 34.676 8.949 17.772 1.00 39.19 ? 551 MET D CB 1 +ATOM 21580 C CG . MET D 1 551 ? 34.006 10.147 17.127 1.00 40.89 ? 551 MET D CG 1 +ATOM 21581 S SD . MET D 1 551 ? 34.108 10.083 15.363 1.00 48.01 ? 551 MET D SD 1 +ATOM 21582 C CE . MET D 1 551 ? 35.867 10.459 15.087 1.00 43.81 ? 551 MET D CE 1 +ATOM 21583 N N . VAL D 1 552 ? 35.496 5.812 17.680 1.00 33.45 ? 552 VAL D N 1 +ATOM 21584 C CA . VAL D 1 552 ? 36.406 4.832 18.244 1.00 32.19 ? 552 VAL D CA 1 +ATOM 21585 C C . VAL D 1 552 ? 37.745 5.431 17.862 1.00 32.69 ? 552 VAL D C 1 +ATOM 21586 O O . VAL D 1 552 ? 38.158 5.373 16.702 1.00 32.25 ? 552 VAL D O 1 +ATOM 21587 C CB . VAL D 1 552 ? 36.241 3.448 17.599 1.00 32.26 ? 552 VAL D CB 1 +ATOM 21588 C CG1 . VAL D 1 552 ? 37.253 2.472 18.203 1.00 30.84 ? 552 VAL D CG1 1 +ATOM 21589 C CG2 . VAL D 1 552 ? 34.816 2.949 17.814 1.00 30.00 ? 552 VAL D CG2 1 +ATOM 21590 N N . GLY D 1 553 ? 38.405 6.039 18.839 1.00 33.42 ? 553 GLY D N 1 +ATOM 21591 C CA . GLY D 1 553 ? 39.672 6.674 18.566 1.00 33.91 ? 553 GLY D CA 1 +ATOM 21592 C C . GLY D 1 553 ? 39.370 7.958 17.821 1.00 35.99 ? 553 GLY D C 1 +ATOM 21593 O O . GLY D 1 553 ? 38.288 8.529 17.937 1.00 37.35 ? 553 GLY D O 1 +ATOM 21594 N N . LYS D 1 554 ? 40.316 8.399 17.016 1.00 37.57 ? 554 LYS D N 1 +ATOM 21595 C CA . LYS D 1 554 ? 40.161 9.634 16.274 1.00 38.87 ? 554 LYS D CA 1 +ATOM 21596 C C . LYS D 1 554 ? 39.668 9.400 14.844 1.00 38.42 ? 554 LYS D C 1 +ATOM 21597 O O . LYS D 1 554 ? 39.158 10.308 14.200 1.00 38.06 ? 554 LYS D O 1 +ATOM 21598 C CB . LYS D 1 554 ? 41.524 10.332 16.256 1.00 39.09 ? 554 LYS D CB 1 +ATOM 21599 C CG . LYS D 1 554 ? 41.546 11.736 15.732 1.00 43.65 ? 554 LYS D CG 1 +ATOM 21600 C CD . LYS D 1 554 ? 42.936 12.338 15.919 1.00 44.89 ? 554 LYS D CD 1 +ATOM 21601 C CE . LYS D 1 554 ? 42.971 13.805 15.479 1.00 48.62 ? 554 LYS D CE 1 +ATOM 21602 N NZ . LYS D 1 554 ? 42.075 14.682 16.302 1.00 50.74 ? 554 LYS D NZ 1 +ATOM 21603 N N . TYR D 1 555 ? 39.783 8.163 14.375 1.00 37.98 ? 555 TYR D N 1 +ATOM 21604 C CA . TYR D 1 555 ? 39.449 7.831 12.995 1.00 36.97 ? 555 TYR D CA 1 +ATOM 21605 C C . TYR D 1 555 ? 38.148 7.130 12.634 1.00 36.87 ? 555 TYR D C 1 +ATOM 21606 O O . TYR D 1 555 ? 37.674 7.257 11.506 1.00 35.66 ? 555 TYR D O 1 +ATOM 21607 C CB . TYR D 1 555 ? 40.570 6.975 12.406 1.00 36.18 ? 555 TYR D CB 1 +ATOM 21608 C CG . TYR D 1 555 ? 41.978 7.441 12.702 1.00 35.22 ? 555 TYR D CG 1 +ATOM 21609 C CD1 . TYR D 1 555 ? 42.326 8.782 12.606 1.00 35.64 ? 555 TYR D CD1 1 +ATOM 21610 C CD2 . TYR D 1 555 ? 42.978 6.525 13.017 1.00 36.65 ? 555 TYR D CD2 1 +ATOM 21611 C CE1 . TYR D 1 555 ? 43.630 9.203 12.810 1.00 35.88 ? 555 TYR D CE1 1 +ATOM 21612 C CE2 . TYR D 1 555 ? 44.294 6.934 13.225 1.00 37.05 ? 555 TYR D CE2 1 +ATOM 21613 C CZ . TYR D 1 555 ? 44.610 8.277 13.114 1.00 37.21 ? 555 TYR D CZ 1 +ATOM 21614 O OH . TYR D 1 555 ? 45.909 8.703 13.264 1.00 38.72 ? 555 TYR D OH 1 +ATOM 21615 N N . LEU D 1 556 ? 37.564 6.386 13.562 1.00 36.99 ? 556 LEU D N 1 +ATOM 21616 C CA . LEU D 1 556 ? 36.379 5.624 13.218 1.00 35.41 ? 556 LEU D CA 1 +ATOM 21617 C C . LEU D 1 556 ? 35.058 6.077 13.826 1.00 35.36 ? 556 LEU D C 1 +ATOM 21618 O O . LEU D 1 556 ? 34.937 6.245 15.039 1.00 36.18 ? 556 LEU D O 1 +ATOM 21619 C CB . LEU D 1 556 ? 36.663 4.156 13.552 1.00 34.75 ? 556 LEU D CB 1 +ATOM 21620 C CG . LEU D 1 556 ? 35.732 3.058 13.053 1.00 36.02 ? 556 LEU D CG 1 +ATOM 21621 C CD1 . LEU D 1 556 ? 36.485 1.735 13.082 1.00 35.14 ? 556 LEU D CD1 1 +ATOM 21622 C CD2 . LEU D 1 556 ? 34.467 3.006 13.904 1.00 33.24 ? 556 LEU D CD2 1 +ATOM 21623 N N . LEU D 1 557 ? 34.063 6.283 12.969 1.00 35.18 ? 557 LEU D N 1 +ATOM 21624 C CA . LEU D 1 557 ? 32.743 6.691 13.437 1.00 34.92 ? 557 LEU D CA 1 +ATOM 21625 C C . LEU D 1 557 ? 31.818 5.491 13.326 1.00 33.75 ? 557 LEU D C 1 +ATOM 21626 O O . LEU D 1 557 ? 31.704 4.881 12.270 1.00 33.11 ? 557 LEU D O 1 +ATOM 21627 C CB . LEU D 1 557 ? 32.191 7.855 12.603 1.00 36.02 ? 557 LEU D CB 1 +ATOM 21628 C CG . LEU D 1 557 ? 30.889 8.463 13.145 1.00 37.23 ? 557 LEU D CG 1 +ATOM 21629 C CD1 . LEU D 1 557 ? 30.692 9.852 12.585 1.00 39.85 ? 557 LEU D CD1 1 +ATOM 21630 C CD2 . LEU D 1 557 ? 29.717 7.588 12.778 1.00 39.56 ? 557 LEU D CD2 1 +ATOM 21631 N N . TYR D 1 558 ? 31.163 5.151 14.428 1.00 34.04 ? 558 TYR D N 1 +ATOM 21632 C CA . TYR D 1 558 ? 30.255 4.016 14.445 1.00 33.82 ? 558 TYR D CA 1 +ATOM 21633 C C . TYR D 1 558 ? 28.866 4.475 14.855 1.00 33.16 ? 558 TYR D C 1 +ATOM 21634 O O . TYR D 1 558 ? 28.693 5.110 15.894 1.00 33.03 ? 558 TYR D O 1 +ATOM 21635 C CB . TYR D 1 558 ? 30.774 2.946 15.419 1.00 33.83 ? 558 TYR D CB 1 +ATOM 21636 C CG . TYR D 1 558 ? 29.911 1.705 15.508 1.00 33.95 ? 558 TYR D CG 1 +ATOM 21637 C CD1 . TYR D 1 558 ? 29.372 1.120 14.359 1.00 35.41 ? 558 TYR D CD1 1 +ATOM 21638 C CD2 . TYR D 1 558 ? 29.647 1.103 16.737 1.00 32.95 ? 558 TYR D CD2 1 +ATOM 21639 C CE1 . TYR D 1 558 ? 28.588 -0.033 14.430 1.00 34.36 ? 558 TYR D CE1 1 +ATOM 21640 C CE2 . TYR D 1 558 ? 28.866 -0.052 16.826 1.00 33.15 ? 558 TYR D CE2 1 +ATOM 21641 C CZ . TYR D 1 558 ? 28.336 -0.617 15.667 1.00 35.00 ? 558 TYR D CZ 1 +ATOM 21642 O OH . TYR D 1 558 ? 27.548 -1.756 15.743 1.00 32.31 ? 558 TYR D OH 1 +ATOM 21643 N N . ALA D 1 559 ? 27.879 4.167 14.024 1.00 33.84 ? 559 ALA D N 1 +ATOM 21644 C CA . ALA D 1 559 ? 26.494 4.548 14.308 1.00 33.87 ? 559 ALA D CA 1 +ATOM 21645 C C . ALA D 1 559 ? 25.692 3.269 14.439 1.00 33.83 ? 559 ALA D C 1 +ATOM 21646 O O . ALA D 1 559 ? 25.047 2.826 13.490 1.00 35.08 ? 559 ALA D O 1 +ATOM 21647 C CB . ALA D 1 559 ? 25.933 5.401 13.178 1.00 34.35 ? 559 ALA D CB 1 +ATOM 21648 N N . PRO D 1 560 ? 25.733 2.645 15.620 1.00 33.61 ? 560 PRO D N 1 +ATOM 21649 C CA . PRO D 1 560 ? 24.993 1.403 15.824 1.00 34.35 ? 560 PRO D CA 1 +ATOM 21650 C C . PRO D 1 560 ? 23.488 1.544 15.635 1.00 35.62 ? 560 PRO D C 1 +ATOM 21651 O O . PRO D 1 560 ? 22.898 2.588 15.928 1.00 34.99 ? 560 PRO D O 1 +ATOM 21652 C CB . PRO D 1 560 ? 25.372 1.009 17.257 1.00 33.79 ? 560 PRO D CB 1 +ATOM 21653 C CG . PRO D 1 560 ? 25.576 2.332 17.919 1.00 32.34 ? 560 PRO D CG 1 +ATOM 21654 C CD . PRO D 1 560 ? 26.366 3.093 16.874 1.00 32.56 ? 560 PRO D CD 1 +ATOM 21655 N N . ILE D 1 561 ? 22.873 0.482 15.132 1.00 36.44 ? 561 ILE D N 1 +ATOM 21656 C CA . ILE D 1 561 ? 21.441 0.474 14.929 1.00 39.59 ? 561 ILE D CA 1 +ATOM 21657 C C . ILE D 1 561 ? 20.794 0.135 16.262 1.00 40.29 ? 561 ILE D C 1 +ATOM 21658 O O . ILE D 1 561 ? 20.913 -0.984 16.750 1.00 41.72 ? 561 ILE D O 1 +ATOM 21659 C CB . ILE D 1 561 ? 21.058 -0.554 13.855 1.00 40.58 ? 561 ILE D CB 1 +ATOM 21660 C CG1 . ILE D 1 561 ? 21.562 -0.054 12.496 1.00 42.38 ? 561 ILE D CG1 1 +ATOM 21661 C CG2 . ILE D 1 561 ? 19.560 -0.775 13.847 1.00 41.26 ? 561 ILE D CG2 1 +ATOM 21662 C CD1 . ILE D 1 561 ? 21.291 -0.988 11.345 1.00 44.53 ? 561 ILE D CD1 1 +ATOM 21663 N N . VAL D 1 562 ? 20.125 1.115 16.854 1.00 41.15 ? 562 VAL D N 1 +ATOM 21664 C CA . VAL D 1 562 ? 19.483 0.931 18.145 1.00 42.69 ? 562 VAL D CA 1 +ATOM 21665 C C . VAL D 1 562 ? 17.950 0.884 18.079 1.00 45.36 ? 562 VAL D C 1 +ATOM 21666 O O . VAL D 1 562 ? 17.265 1.328 18.997 1.00 44.57 ? 562 VAL D O 1 +ATOM 21667 C CB . VAL D 1 562 ? 19.921 2.049 19.125 1.00 41.34 ? 562 VAL D CB 1 +ATOM 21668 C CG1 . VAL D 1 562 ? 21.418 1.981 19.335 1.00 40.24 ? 562 VAL D CG1 1 +ATOM 21669 C CG2 . VAL D 1 562 ? 19.531 3.415 18.584 1.00 37.41 ? 562 VAL D CG2 1 +ATOM 21670 N N . SER D 1 563 ? 17.422 0.342 16.988 1.00 49.64 ? 563 SER D N 1 +ATOM 21671 C CA . SER D 1 563 ? 15.978 0.217 16.802 1.00 53.98 ? 563 SER D CA 1 +ATOM 21672 C C . SER D 1 563 ? 15.719 -1.028 15.957 1.00 55.99 ? 563 SER D C 1 +ATOM 21673 O O . SER D 1 563 ? 16.659 -1.687 15.509 1.00 55.98 ? 563 SER D O 1 +ATOM 21674 C CB . SER D 1 563 ? 15.416 1.448 16.093 1.00 53.59 ? 563 SER D CB 1 +ATOM 21675 O OG . SER D 1 563 ? 15.833 1.481 14.735 1.00 57.77 ? 563 SER D OG 1 +ATOM 21676 N N . LYS D 1 564 ? 14.449 -1.342 15.733 1.00 58.84 ? 564 LYS D N 1 +ATOM 21677 C CA . LYS D 1 564 ? 14.093 -2.519 14.954 1.00 61.95 ? 564 LYS D CA 1 +ATOM 21678 C C . LYS D 1 564 ? 14.273 -2.296 13.451 1.00 63.42 ? 564 LYS D C 1 +ATOM 21679 O O . LYS D 1 564 ? 14.292 -3.250 12.676 1.00 64.16 ? 564 LYS D O 1 +ATOM 21680 C CB . LYS D 1 564 ? 12.647 -2.936 15.251 1.00 63.15 ? 564 LYS D CB 1 +ATOM 21681 C CG . LYS D 1 564 ? 12.379 -3.363 16.704 1.00 64.61 ? 564 LYS D CG 1 +ATOM 21682 C CD . LYS D 1 564 ? 11.794 -2.232 17.574 1.00 64.93 ? 564 LYS D CD 1 +ATOM 21683 C CE . LYS D 1 564 ? 12.777 -1.087 17.818 1.00 64.91 ? 564 LYS D CE 1 +ATOM 21684 N NZ . LYS D 1 564 ? 12.247 -0.046 18.752 1.00 64.06 ? 564 LYS D NZ 1 +ATOM 21685 N N . GLU D 1 565 ? 14.412 -1.038 13.044 1.00 64.58 ? 565 GLU D N 1 +ATOM 21686 C CA . GLU D 1 565 ? 14.595 -0.707 11.635 1.00 65.60 ? 565 GLU D CA 1 +ATOM 21687 C C . GLU D 1 565 ? 15.747 -1.487 11.019 1.00 65.16 ? 565 GLU D C 1 +ATOM 21688 O O . GLU D 1 565 ? 16.564 -2.075 11.724 1.00 65.52 ? 565 GLU D O 1 +ATOM 21689 C CB . GLU D 1 565 ? 14.889 0.782 11.464 1.00 68.12 ? 565 GLU D CB 1 +ATOM 21690 C CG . GLU D 1 565 ? 13.785 1.736 11.886 1.00 72.38 ? 565 GLU D CG 1 +ATOM 21691 C CD . GLU D 1 565 ? 14.168 3.190 11.614 1.00 75.40 ? 565 GLU D CD 1 +ATOM 21692 O OE1 . GLU D 1 565 ? 15.202 3.647 12.167 1.00 76.62 ? 565 GLU D OE1 1 +ATOM 21693 O OE2 . GLU D 1 565 ? 13.444 3.867 10.846 1.00 75.39 ? 565 GLU D OE2 1 +ATOM 21694 N N . GLU D 1 566 ? 15.819 -1.467 9.694 1.00 65.01 ? 566 GLU D N 1 +ATOM 21695 C CA . GLU D 1 566 ? 16.873 -2.163 8.967 1.00 64.35 ? 566 GLU D CA 1 +ATOM 21696 C C . GLU D 1 566 ? 18.002 -1.183 8.638 1.00 61.67 ? 566 GLU D C 1 +ATOM 21697 O O . GLU D 1 566 ? 19.134 -1.582 8.360 1.00 61.07 ? 566 GLU D O 1 +ATOM 21698 C CB . GLU D 1 566 ? 16.301 -2.764 7.681 1.00 67.60 ? 566 GLU D CB 1 +ATOM 21699 C CG . GLU D 1 566 ? 17.243 -3.721 6.969 1.00 73.29 ? 566 GLU D CG 1 +ATOM 21700 C CD . GLU D 1 566 ? 16.546 -4.511 5.869 1.00 76.58 ? 566 GLU D CD 1 +ATOM 21701 O OE1 . GLU D 1 566 ? 16.019 -3.881 4.919 1.00 77.22 ? 566 GLU D OE1 1 +ATOM 21702 O OE2 . GLU D 1 566 ? 16.526 -5.763 5.961 1.00 77.68 ? 566 GLU D OE2 1 +ATOM 21703 N N . SER D 1 567 ? 17.675 0.103 8.668 1.00 57.99 ? 567 SER D N 1 +ATOM 21704 C CA . SER D 1 567 ? 18.640 1.161 8.395 1.00 54.43 ? 567 SER D CA 1 +ATOM 21705 C C . SER D 1 567 ? 18.293 2.345 9.289 1.00 50.66 ? 567 SER D C 1 +ATOM 21706 O O . SER D 1 567 ? 17.215 2.398 9.882 1.00 49.98 ? 567 SER D O 1 +ATOM 21707 C CB . SER D 1 567 ? 18.577 1.592 6.928 1.00 55.10 ? 567 SER D CB 1 +ATOM 21708 O OG . SER D 1 567 ? 17.366 2.277 6.663 1.00 57.37 ? 567 SER D OG 1 +ATOM 21709 N N . ARG D 1 568 ? 19.202 3.303 9.380 1.00 46.28 ? 568 ARG D N 1 +ATOM 21710 C CA . ARG D 1 568 ? 18.970 4.461 10.227 1.00 42.09 ? 568 ARG D CA 1 +ATOM 21711 C C . ARG D 1 568 ? 19.599 5.688 9.617 1.00 40.16 ? 568 ARG D C 1 +ATOM 21712 O O . ARG D 1 568 ? 20.365 5.601 8.658 1.00 41.03 ? 568 ARG D O 1 +ATOM 21713 C CB . ARG D 1 568 ? 19.604 4.235 11.600 1.00 39.37 ? 568 ARG D CB 1 +ATOM 21714 C CG . ARG D 1 568 ? 21.099 3.928 11.503 1.00 37.34 ? 568 ARG D CG 1 +ATOM 21715 C CD . ARG D 1 568 ? 21.809 4.141 12.816 1.00 35.10 ? 568 ARG D CD 1 +ATOM 21716 N NE . ARG D 1 568 ? 21.900 5.556 13.140 1.00 33.76 ? 568 ARG D NE 1 +ATOM 21717 C CZ . ARG D 1 568 ? 22.369 6.030 14.289 1.00 33.48 ? 568 ARG D CZ 1 +ATOM 21718 N NH1 . ARG D 1 568 ? 22.787 5.191 15.228 1.00 33.20 ? 568 ARG D NH1 1 +ATOM 21719 N NH2 . ARG D 1 568 ? 22.426 7.341 14.497 1.00 31.38 ? 568 ARG D NH2 1 +ATOM 21720 N N . LEU D 1 569 ? 19.268 6.839 10.182 1.00 39.34 ? 569 LEU D N 1 +ATOM 21721 C CA . LEU D 1 569 ? 19.862 8.083 9.728 1.00 38.89 ? 569 LEU D CA 1 +ATOM 21722 C C . LEU D 1 569 ? 21.182 8.243 10.494 1.00 37.63 ? 569 LEU D C 1 +ATOM 21723 O O . LEU D 1 569 ? 21.246 8.041 11.712 1.00 35.02 ? 569 LEU D O 1 +ATOM 21724 C CB . LEU D 1 569 ? 18.930 9.265 10.019 1.00 39.53 ? 569 LEU D CB 1 +ATOM 21725 C CG . LEU D 1 569 ? 17.646 9.330 9.186 1.00 42.02 ? 569 LEU D CG 1 +ATOM 21726 C CD1 . LEU D 1 569 ? 16.847 10.562 9.586 1.00 41.22 ? 569 LEU D CD1 1 +ATOM 21727 C CD2 . LEU D 1 569 ? 17.996 9.379 7.692 1.00 41.65 ? 569 LEU D CD2 1 +ATOM 21728 N N . VAL D 1 570 ? 22.236 8.583 9.768 1.00 36.32 ? 570 VAL D N 1 +ATOM 21729 C CA . VAL D 1 570 ? 23.539 8.775 10.375 1.00 36.18 ? 570 VAL D CA 1 +ATOM 21730 C C . VAL D 1 570 ? 23.982 10.214 10.191 1.00 36.67 ? 570 VAL D C 1 +ATOM 21731 O O . VAL D 1 570 ? 24.002 10.729 9.071 1.00 36.21 ? 570 VAL D O 1 +ATOM 21732 C CB . VAL D 1 570 ? 24.593 7.859 9.728 1.00 35.20 ? 570 VAL D CB 1 +ATOM 21733 C CG1 . VAL D 1 570 ? 25.968 8.157 10.318 1.00 33.13 ? 570 VAL D CG1 1 +ATOM 21734 C CG2 . VAL D 1 570 ? 24.206 6.400 9.934 1.00 32.84 ? 570 VAL D CG2 1 +ATOM 21735 N N . THR D 1 571 ? 24.324 10.866 11.293 1.00 37.35 ? 571 THR D N 1 +ATOM 21736 C CA . THR D 1 571 ? 24.793 12.242 11.230 1.00 38.31 ? 571 THR D CA 1 +ATOM 21737 C C . THR D 1 571 ? 26.315 12.226 11.153 1.00 39.73 ? 571 THR D C 1 +ATOM 21738 O O . THR D 1 571 ? 26.987 11.687 12.032 1.00 39.38 ? 571 THR D O 1 +ATOM 21739 C CB . THR D 1 571 ? 24.369 13.035 12.471 1.00 39.06 ? 571 THR D CB 1 +ATOM 21740 O OG1 . THR D 1 571 ? 22.937 13.102 12.525 1.00 38.08 ? 571 THR D OG1 1 +ATOM 21741 C CG2 . THR D 1 571 ? 24.953 14.447 12.425 1.00 38.71 ? 571 THR D CG2 1 +ATOM 21742 N N . LEU D 1 572 ? 26.853 12.811 10.089 1.00 40.54 ? 572 LEU D N 1 +ATOM 21743 C CA . LEU D 1 572 ? 28.293 12.861 9.894 1.00 40.23 ? 572 LEU D CA 1 +ATOM 21744 C C . LEU D 1 572 ? 28.843 14.242 10.207 1.00 40.99 ? 572 LEU D C 1 +ATOM 21745 O O . LEU D 1 572 ? 28.302 15.256 9.762 1.00 41.01 ? 572 LEU D O 1 +ATOM 21746 C CB . LEU D 1 572 ? 28.641 12.505 8.451 1.00 40.71 ? 572 LEU D CB 1 +ATOM 21747 C CG . LEU D 1 572 ? 28.270 11.104 7.959 1.00 41.44 ? 572 LEU D CG 1 +ATOM 21748 C CD1 . LEU D 1 572 ? 28.556 11.019 6.468 1.00 42.99 ? 572 LEU D CD1 1 +ATOM 21749 C CD2 . LEU D 1 572 ? 29.056 10.049 8.719 1.00 39.75 ? 572 LEU D CD2 1 +ATOM 21750 N N . PRO D 1 573 ? 29.925 14.305 10.994 1.00 41.36 ? 573 PRO D N 1 +ATOM 21751 C CA . PRO D 1 573 ? 30.522 15.599 11.335 1.00 41.62 ? 573 PRO D CA 1 +ATOM 21752 C C . PRO D 1 573 ? 31.226 16.206 10.112 1.00 42.34 ? 573 PRO D C 1 +ATOM 21753 O O . PRO D 1 573 ? 31.293 15.597 9.047 1.00 40.05 ? 573 PRO D O 1 +ATOM 21754 C CB . PRO D 1 573 ? 31.516 15.241 12.440 1.00 40.57 ? 573 PRO D CB 1 +ATOM 21755 C CG . PRO D 1 573 ? 30.944 13.993 13.029 1.00 40.18 ? 573 PRO D CG 1 +ATOM 21756 C CD . PRO D 1 573 ? 30.498 13.233 11.821 1.00 39.59 ? 573 PRO D CD 1 +ATOM 21757 N N . ARG D 1 574 ? 31.758 17.405 10.283 1.00 45.18 ? 574 ARG D N 1 +ATOM 21758 C CA . ARG D 1 574 ? 32.476 18.101 9.224 1.00 48.04 ? 574 ARG D CA 1 +ATOM 21759 C C . ARG D 1 574 ? 33.623 17.225 8.696 1.00 47.19 ? 574 ARG D C 1 +ATOM 21760 O O . ARG D 1 574 ? 34.222 16.453 9.450 1.00 47.79 ? 574 ARG D O 1 +ATOM 21761 C CB . ARG D 1 574 ? 33.023 19.413 9.794 1.00 52.43 ? 574 ARG D CB 1 +ATOM 21762 C CG . ARG D 1 574 ? 33.667 20.343 8.791 1.00 60.86 ? 574 ARG D CG 1 +ATOM 21763 C CD . ARG D 1 574 ? 33.999 21.685 9.453 1.00 66.73 ? 574 ARG D CD 1 +ATOM 21764 N NE . ARG D 1 574 ? 34.721 22.591 8.558 1.00 71.72 ? 574 ARG D NE 1 +ATOM 21765 C CZ . ARG D 1 574 ? 35.137 23.811 8.896 1.00 74.15 ? 574 ARG D CZ 1 +ATOM 21766 N NH1 . ARG D 1 574 ? 34.904 24.290 10.117 1.00 74.90 ? 574 ARG D NH1 1 +ATOM 21767 N NH2 . ARG D 1 574 ? 35.797 24.551 8.014 1.00 74.90 ? 574 ARG D NH2 1 +ATOM 21768 N N . GLY D 1 575 ? 33.923 17.340 7.404 1.00 45.18 ? 575 GLY D N 1 +ATOM 21769 C CA . GLY D 1 575 ? 34.998 16.554 6.821 1.00 44.04 ? 575 GLY D CA 1 +ATOM 21770 C C . GLY D 1 575 ? 34.491 15.444 5.927 1.00 44.00 ? 575 GLY D C 1 +ATOM 21771 O O . GLY D 1 575 ? 33.293 15.292 5.763 1.00 45.02 ? 575 GLY D O 1 +ATOM 21772 N N . LYS D 1 576 ? 35.388 14.663 5.335 1.00 43.39 ? 576 LYS D N 1 +ATOM 21773 C CA . LYS D 1 576 ? 34.954 13.570 4.471 1.00 43.11 ? 576 LYS D CA 1 +ATOM 21774 C C . LYS D 1 576 ? 34.944 12.240 5.213 1.00 41.47 ? 576 LYS D C 1 +ATOM 21775 O O . LYS D 1 576 ? 35.779 11.993 6.078 1.00 41.89 ? 576 LYS D O 1 +ATOM 21776 C CB . LYS D 1 576 ? 35.854 13.475 3.241 1.00 45.89 ? 576 LYS D CB 1 +ATOM 21777 C CG . LYS D 1 576 ? 35.622 14.576 2.231 1.00 48.58 ? 576 LYS D CG 1 +ATOM 21778 C CD . LYS D 1 576 ? 36.561 14.441 1.052 1.00 51.91 ? 576 LYS D CD 1 +ATOM 21779 C CE . LYS D 1 576 ? 36.240 15.471 -0.030 1.00 54.11 ? 576 LYS D CE 1 +ATOM 21780 N NZ . LYS D 1 576 ? 37.188 15.387 -1.187 1.00 55.35 ? 576 LYS D NZ 1 +ATOM 21781 N N . TRP D 1 577 ? 33.987 11.387 4.873 1.00 40.25 ? 577 TRP D N 1 +ATOM 21782 C CA . TRP D 1 577 ? 33.871 10.087 5.511 1.00 38.14 ? 577 TRP D CA 1 +ATOM 21783 C C . TRP D 1 577 ? 33.758 8.974 4.492 1.00 38.80 ? 577 TRP D C 1 +ATOM 21784 O O . TRP D 1 577 ? 33.054 9.093 3.488 1.00 38.19 ? 577 TRP D O 1 +ATOM 21785 C CB . TRP D 1 577 ? 32.674 10.067 6.450 1.00 37.04 ? 577 TRP D CB 1 +ATOM 21786 C CG . TRP D 1 577 ? 32.785 11.103 7.506 1.00 37.40 ? 577 TRP D CG 1 +ATOM 21787 C CD1 . TRP D 1 577 ? 32.439 12.420 7.404 1.00 38.30 ? 577 TRP D CD1 1 +ATOM 21788 C CD2 . TRP D 1 577 ? 33.358 10.938 8.807 1.00 37.37 ? 577 TRP D CD2 1 +ATOM 21789 N NE1 . TRP D 1 577 ? 32.760 13.088 8.561 1.00 38.64 ? 577 TRP D NE1 1 +ATOM 21790 C CE2 . TRP D 1 577 ? 33.329 12.203 9.440 1.00 38.19 ? 577 TRP D CE2 1 +ATOM 21791 C CE3 . TRP D 1 577 ? 33.897 9.845 9.500 1.00 37.49 ? 577 TRP D CE3 1 +ATOM 21792 C CZ2 . TRP D 1 577 ? 33.821 12.407 10.735 1.00 37.64 ? 577 TRP D CZ2 1 +ATOM 21793 C CZ3 . TRP D 1 577 ? 34.386 10.045 10.791 1.00 37.92 ? 577 TRP D CZ3 1 +ATOM 21794 C CH2 . TRP D 1 577 ? 34.344 11.322 11.394 1.00 38.23 ? 577 TRP D CH2 1 +ATOM 21795 N N . TYR D 1 578 ? 34.475 7.892 4.766 1.00 38.97 ? 578 TYR D N 1 +ATOM 21796 C CA . TYR D 1 578 ? 34.519 6.726 3.903 1.00 39.14 ? 578 TYR D CA 1 +ATOM 21797 C C . TYR D 1 578 ? 33.634 5.621 4.474 1.00 39.67 ? 578 TYR D C 1 +ATOM 21798 O O . TYR D 1 578 ? 33.806 5.206 5.621 1.00 41.01 ? 578 TYR D O 1 +ATOM 21799 C CB . TYR D 1 578 ? 35.976 6.262 3.796 1.00 39.02 ? 578 TYR D CB 1 +ATOM 21800 C CG . TYR D 1 578 ? 36.192 4.922 3.144 1.00 38.36 ? 578 TYR D CG 1 +ATOM 21801 C CD1 . TYR D 1 578 ? 36.112 4.770 1.759 1.00 38.12 ? 578 TYR D CD1 1 +ATOM 21802 C CD2 . TYR D 1 578 ? 36.498 3.806 3.916 1.00 37.79 ? 578 TYR D CD2 1 +ATOM 21803 C CE1 . TYR D 1 578 ? 36.337 3.532 1.158 1.00 39.31 ? 578 TYR D CE1 1 +ATOM 21804 C CE2 . TYR D 1 578 ? 36.720 2.565 3.333 1.00 39.76 ? 578 TYR D CE2 1 +ATOM 21805 C CZ . TYR D 1 578 ? 36.643 2.432 1.950 1.00 40.50 ? 578 TYR D CZ 1 +ATOM 21806 O OH . TYR D 1 578 ? 36.891 1.204 1.372 1.00 41.29 ? 578 TYR D OH 1 +ATOM 21807 N N . ASN D 1 579 ? 32.669 5.175 3.678 1.00 39.98 ? 579 ASN D N 1 +ATOM 21808 C CA . ASN D 1 579 ? 31.765 4.111 4.096 1.00 40.18 ? 579 ASN D CA 1 +ATOM 21809 C C . ASN D 1 579 ? 32.572 2.814 4.044 1.00 40.37 ? 579 ASN D C 1 +ATOM 21810 O O . ASN D 1 579 ? 32.964 2.357 2.967 1.00 38.77 ? 579 ASN D O 1 +ATOM 21811 C CB . ASN D 1 579 ? 30.569 4.035 3.145 1.00 40.79 ? 579 ASN D CB 1 +ATOM 21812 C CG . ASN D 1 579 ? 29.552 2.987 3.562 1.00 43.23 ? 579 ASN D CG 1 +ATOM 21813 O OD1 . ASN D 1 579 ? 29.915 1.872 3.944 1.00 43.97 ? 579 ASN D OD1 1 +ATOM 21814 N ND2 . ASN D 1 579 ? 28.265 3.334 3.472 1.00 43.21 ? 579 ASN D ND2 1 +ATOM 21815 N N . TYR D 1 580 ? 32.823 2.237 5.218 1.00 39.73 ? 580 TYR D N 1 +ATOM 21816 C CA . TYR D 1 580 ? 33.606 1.013 5.347 1.00 39.50 ? 580 TYR D CA 1 +ATOM 21817 C C . TYR D 1 580 ? 33.101 -0.171 4.514 1.00 40.72 ? 580 TYR D C 1 +ATOM 21818 O O . TYR D 1 580 ? 33.895 -0.939 3.960 1.00 40.54 ? 580 TYR D O 1 +ATOM 21819 C CB . TYR D 1 580 ? 33.663 0.602 6.824 1.00 40.28 ? 580 TYR D CB 1 +ATOM 21820 C CG . TYR D 1 580 ? 34.507 -0.629 7.102 1.00 39.91 ? 580 TYR D CG 1 +ATOM 21821 C CD1 . TYR D 1 580 ? 35.901 -0.568 7.050 1.00 40.69 ? 580 TYR D CD1 1 +ATOM 21822 C CD2 . TYR D 1 580 ? 33.913 -1.864 7.366 1.00 39.42 ? 580 TYR D CD2 1 +ATOM 21823 C CE1 . TYR D 1 580 ? 36.682 -1.702 7.246 1.00 39.90 ? 580 TYR D CE1 1 +ATOM 21824 C CE2 . TYR D 1 580 ? 34.686 -3.003 7.565 1.00 40.71 ? 580 TYR D CE2 1 +ATOM 21825 C CZ . TYR D 1 580 ? 36.069 -2.911 7.500 1.00 40.21 ? 580 TYR D CZ 1 +ATOM 21826 O OH . TYR D 1 580 ? 36.844 -4.030 7.670 1.00 43.56 ? 580 TYR D OH 1 +ATOM 21827 N N . TRP D 1 581 ? 31.785 -0.317 4.413 1.00 40.78 ? 581 TRP D N 1 +ATOM 21828 C CA . TRP D 1 581 ? 31.215 -1.447 3.690 1.00 41.22 ? 581 TRP D CA 1 +ATOM 21829 C C . TRP D 1 581 ? 31.016 -1.357 2.177 1.00 41.30 ? 581 TRP D C 1 +ATOM 21830 O O . TRP D 1 581 ? 31.181 -2.362 1.487 1.00 40.20 ? 581 TRP D O 1 +ATOM 21831 C CB . TRP D 1 581 ? 29.905 -1.863 4.351 1.00 40.87 ? 581 TRP D CB 1 +ATOM 21832 C CG . TRP D 1 581 ? 30.095 -2.276 5.774 1.00 42.45 ? 581 TRP D CG 1 +ATOM 21833 C CD1 . TRP D 1 581 ? 29.804 -1.542 6.887 1.00 42.51 ? 581 TRP D CD1 1 +ATOM 21834 C CD2 . TRP D 1 581 ? 30.628 -3.520 6.241 1.00 42.24 ? 581 TRP D CD2 1 +ATOM 21835 N NE1 . TRP D 1 581 ? 30.118 -2.256 8.019 1.00 42.90 ? 581 TRP D NE1 1 +ATOM 21836 C CE2 . TRP D 1 581 ? 30.625 -3.474 7.650 1.00 42.26 ? 581 TRP D CE2 1 +ATOM 21837 C CE3 . TRP D 1 581 ? 31.108 -4.669 5.604 1.00 42.83 ? 581 TRP D CE3 1 +ATOM 21838 C CZ2 . TRP D 1 581 ? 31.080 -4.534 8.436 1.00 42.60 ? 581 TRP D CZ2 1 +ATOM 21839 C CZ3 . TRP D 1 581 ? 31.561 -5.723 6.384 1.00 44.01 ? 581 TRP D CZ3 1 +ATOM 21840 C CH2 . TRP D 1 581 ? 31.543 -5.647 7.788 1.00 43.55 ? 581 TRP D CH2 1 +ATOM 21841 N N . ASN D 1 582 ? 30.656 -0.190 1.646 1.00 41.10 ? 582 ASN D N 1 +ATOM 21842 C CA . ASN D 1 582 ? 30.470 -0.106 0.205 1.00 40.44 ? 582 ASN D CA 1 +ATOM 21843 C C . ASN D 1 582 ? 31.459 0.816 -0.498 1.00 40.61 ? 582 ASN D C 1 +ATOM 21844 O O . ASN D 1 582 ? 31.449 0.918 -1.718 1.00 41.99 ? 582 ASN D O 1 +ATOM 21845 C CB . ASN D 1 582 ? 29.028 0.285 -0.142 1.00 39.38 ? 582 ASN D CB 1 +ATOM 21846 C CG . ASN D 1 582 ? 28.701 1.711 0.227 1.00 39.72 ? 582 ASN D CG 1 +ATOM 21847 O OD1 . ASN D 1 582 ? 29.592 2.553 0.382 1.00 39.80 ? 582 ASN D OD1 1 +ATOM 21848 N ND2 . ASN D 1 582 ? 27.411 2.000 0.348 1.00 38.90 ? 582 ASN D ND2 1 +ATOM 21849 N N . GLY D 1 583 ? 32.309 1.487 0.270 1.00 41.69 ? 583 GLY D N 1 +ATOM 21850 C CA . GLY D 1 583 ? 33.321 2.347 -0.323 1.00 42.59 ? 583 GLY D CA 1 +ATOM 21851 C C . GLY D 1 583 ? 32.966 3.787 -0.636 1.00 44.19 ? 583 GLY D C 1 +ATOM 21852 O O . GLY D 1 583 ? 33.812 4.556 -1.097 1.00 43.73 ? 583 GLY D O 1 +ATOM 21853 N N . GLU D 1 584 ? 31.724 4.172 -0.388 1.00 46.07 ? 584 GLU D N 1 +ATOM 21854 C CA . GLU D 1 584 ? 31.314 5.534 -0.676 1.00 48.38 ? 584 GLU D CA 1 +ATOM 21855 C C . GLU D 1 584 ? 31.943 6.560 0.262 1.00 49.04 ? 584 GLU D C 1 +ATOM 21856 O O . GLU D 1 584 ? 32.105 6.315 1.461 1.00 49.39 ? 584 GLU D O 1 +ATOM 21857 C CB . GLU D 1 584 ? 29.796 5.640 -0.609 1.00 49.92 ? 584 GLU D CB 1 +ATOM 21858 C CG . GLU D 1 584 ? 29.258 7.045 -0.765 1.00 53.84 ? 584 GLU D CG 1 +ATOM 21859 C CD . GLU D 1 584 ? 27.737 7.079 -0.765 1.00 57.93 ? 584 GLU D CD 1 +ATOM 21860 O OE1 . GLU D 1 584 ? 27.117 6.261 -0.041 1.00 60.09 ? 584 GLU D OE1 1 +ATOM 21861 O OE2 . GLU D 1 584 ? 27.161 7.930 -1.478 1.00 59.46 ? 584 GLU D OE2 1 +ATOM 21862 N N . ILE D 1 585 ? 32.304 7.709 -0.299 1.00 49.06 ? 585 ILE D N 1 +ATOM 21863 C CA . ILE D 1 585 ? 32.884 8.794 0.481 1.00 49.37 ? 585 ILE D CA 1 +ATOM 21864 C C . ILE D 1 585 ? 31.874 9.938 0.459 1.00 49.43 ? 585 ILE D C 1 +ATOM 21865 O O . ILE D 1 585 ? 31.508 10.430 -0.603 1.00 48.31 ? 585 ILE D O 1 +ATOM 21866 C CB . ILE D 1 585 ? 34.241 9.262 -0.109 1.00 48.10 ? 585 ILE D CB 1 +ATOM 21867 C CG1 . ILE D 1 585 ? 35.270 8.137 0.015 1.00 47.68 ? 585 ILE D CG1 1 +ATOM 21868 C CG2 . ILE D 1 585 ? 34.738 10.495 0.627 1.00 47.99 ? 585 ILE D CG2 1 +ATOM 21869 C CD1 . ILE D 1 585 ? 36.650 8.491 -0.507 1.00 47.71 ? 585 ILE D CD1 1 +ATOM 21870 N N . ILE D 1 586 ? 31.416 10.338 1.641 1.00 50.58 ? 586 ILE D N 1 +ATOM 21871 C CA . ILE D 1 586 ? 30.430 11.400 1.770 1.00 51.43 ? 586 ILE D CA 1 +ATOM 21872 C C . ILE D 1 586 ? 31.037 12.619 2.443 1.00 52.65 ? 586 ILE D C 1 +ATOM 21873 O O . ILE D 1 586 ? 31.943 12.502 3.266 1.00 52.87 ? 586 ILE D O 1 +ATOM 21874 C CB . ILE D 1 586 ? 29.211 10.947 2.616 1.00 51.80 ? 586 ILE D CB 1 +ATOM 21875 C CG1 . ILE D 1 586 ? 28.665 9.613 2.100 1.00 51.98 ? 586 ILE D CG1 1 +ATOM 21876 C CG2 . ILE D 1 586 ? 28.125 12.001 2.567 1.00 51.73 ? 586 ILE D CG2 1 +ATOM 21877 C CD1 . ILE D 1 586 ? 29.456 8.397 2.574 1.00 51.75 ? 586 ILE D CD1 1 +ATOM 21878 N N . ASN D 1 587 ? 30.530 13.793 2.084 1.00 54.45 ? 587 ASN D N 1 +ATOM 21879 C CA . ASN D 1 587 ? 31.004 15.040 2.660 1.00 55.79 ? 587 ASN D CA 1 +ATOM 21880 C C . ASN D 1 587 ? 30.322 15.310 3.983 1.00 56.54 ? 587 ASN D C 1 +ATOM 21881 O O . ASN D 1 587 ? 29.102 15.194 4.118 1.00 54.93 ? 587 ASN D O 1 +ATOM 21882 C CB . ASN D 1 587 ? 30.765 16.198 1.703 1.00 58.35 ? 587 ASN D CB 1 +ATOM 21883 C CG . ASN D 1 587 ? 31.861 16.320 0.672 1.00 60.80 ? 587 ASN D CG 1 +ATOM 21884 O OD1 . ASN D 1 587 ? 33.022 16.552 1.018 1.00 62.32 ? 587 ASN D OD1 1 +ATOM 21885 N ND2 . ASN D 1 587 ? 31.507 16.155 -0.601 1.00 61.92 ? 587 ASN D ND2 1 +ATOM 21886 N N . GLY D 1 588 ? 31.142 15.682 4.956 1.00 57.06 ? 588 GLY D N 1 +ATOM 21887 C CA . GLY D 1 588 ? 30.668 15.944 6.296 1.00 57.38 ? 588 GLY D CA 1 +ATOM 21888 C C . GLY D 1 588 ? 29.639 17.028 6.475 1.00 58.12 ? 588 GLY D C 1 +ATOM 21889 O O . GLY D 1 588 ? 29.403 17.854 5.597 1.00 58.93 ? 588 GLY D O 1 +ATOM 21890 N N . LYS D 1 589 ? 29.040 17.014 7.659 1.00 58.51 ? 589 LYS D N 1 +ATOM 21891 C CA . LYS D 1 589 ? 28.014 17.961 8.026 1.00 56.42 ? 589 LYS D CA 1 +ATOM 21892 C C . LYS D 1 589 ? 26.831 17.644 7.133 1.00 54.31 ? 589 LYS D C 1 +ATOM 21893 O O . LYS D 1 589 ? 26.410 18.453 6.312 1.00 54.73 ? 589 LYS D O 1 +ATOM 21894 C CB . LYS D 1 589 ? 28.510 19.392 7.815 1.00 58.23 ? 589 LYS D CB 1 +ATOM 21895 C CG . LYS D 1 589 ? 27.734 20.417 8.616 1.00 61.69 ? 589 LYS D CG 1 +ATOM 21896 C CD . LYS D 1 589 ? 27.674 20.025 10.091 1.00 63.34 ? 589 LYS D CD 1 +ATOM 21897 C CE . LYS D 1 589 ? 26.791 20.979 10.874 1.00 64.77 ? 589 LYS D CE 1 +ATOM 21898 N NZ . LYS D 1 589 ? 26.554 20.472 12.246 1.00 65.63 ? 589 LYS D NZ 1 +ATOM 21899 N N . SER D 1 590 ? 26.320 16.431 7.294 1.00 51.14 ? 590 SER D N 1 +ATOM 21900 C CA . SER D 1 590 ? 25.178 15.965 6.532 1.00 49.36 ? 590 SER D CA 1 +ATOM 21901 C C . SER D 1 590 ? 24.569 14.757 7.232 1.00 47.54 ? 590 SER D C 1 +ATOM 21902 O O . SER D 1 590 ? 25.147 14.218 8.173 1.00 46.79 ? 590 SER D O 1 +ATOM 21903 C CB . SER D 1 590 ? 25.601 15.574 5.114 1.00 48.78 ? 590 SER D CB 1 +ATOM 21904 O OG . SER D 1 590 ? 26.472 14.462 5.140 1.00 47.90 ? 590 SER D OG 1 +ATOM 21905 N N . VAL D 1 591 ? 23.394 14.349 6.771 1.00 45.13 ? 591 VAL D N 1 +ATOM 21906 C CA . VAL D 1 591 ? 22.710 13.202 7.327 1.00 43.50 ? 591 VAL D CA 1 +ATOM 21907 C C . VAL D 1 591 ? 22.503 12.213 6.188 1.00 44.50 ? 591 VAL D C 1 +ATOM 21908 O O . VAL D 1 591 ? 22.009 12.579 5.125 1.00 44.73 ? 591 VAL D O 1 +ATOM 21909 C CB . VAL D 1 591 ? 21.355 13.609 7.934 1.00 43.19 ? 591 VAL D CB 1 +ATOM 21910 C CG1 . VAL D 1 591 ? 20.586 12.370 8.388 1.00 42.45 ? 591 VAL D CG1 1 +ATOM 21911 C CG2 . VAL D 1 591 ? 21.584 14.553 9.111 1.00 39.45 ? 591 VAL D CG2 1 +ATOM 21912 N N . VAL D 1 592 ? 22.912 10.967 6.404 1.00 44.88 ? 592 VAL D N 1 +ATOM 21913 C CA . VAL D 1 592 ? 22.771 9.933 5.387 1.00 44.11 ? 592 VAL D CA 1 +ATOM 21914 C C . VAL D 1 592 ? 22.140 8.688 5.980 1.00 44.83 ? 592 VAL D C 1 +ATOM 21915 O O . VAL D 1 592 ? 22.102 8.515 7.197 1.00 45.06 ? 592 VAL D O 1 +ATOM 21916 C CB . VAL D 1 592 ? 24.134 9.545 4.767 1.00 43.40 ? 592 VAL D CB 1 +ATOM 21917 C CG1 . VAL D 1 592 ? 24.810 10.781 4.206 1.00 43.44 ? 592 VAL D CG1 1 +ATOM 21918 C CG2 . VAL D 1 592 ? 25.022 8.876 5.811 1.00 43.88 ? 592 VAL D CG2 1 +ATOM 21919 N N . LYS D 1 593 ? 21.644 7.824 5.107 1.00 45.64 ? 593 LYS D N 1 +ATOM 21920 C CA . LYS D 1 593 ? 21.006 6.591 5.522 1.00 47.31 ? 593 LYS D CA 1 +ATOM 21921 C C . LYS D 1 593 ? 22.068 5.489 5.556 1.00 47.58 ? 593 LYS D C 1 +ATOM 21922 O O . LYS D 1 593 ? 22.934 5.426 4.675 1.00 47.51 ? 593 LYS D O 1 +ATOM 21923 C CB . LYS D 1 593 ? 19.894 6.253 4.529 1.00 49.23 ? 593 LYS D CB 1 +ATOM 21924 C CG . LYS D 1 593 ? 19.010 5.081 4.908 1.00 55.24 ? 593 LYS D CG 1 +ATOM 21925 C CD . LYS D 1 593 ? 17.962 4.838 3.811 1.00 59.20 ? 593 LYS D CD 1 +ATOM 21926 C CE . LYS D 1 593 ? 17.093 3.615 4.099 1.00 61.26 ? 593 LYS D CE 1 +ATOM 21927 N NZ . LYS D 1 593 ? 16.079 3.373 3.026 1.00 63.34 ? 593 LYS D NZ 1 +ATOM 21928 N N . SER D 1 594 ? 22.013 4.640 6.583 1.00 46.31 ? 594 SER D N 1 +ATOM 21929 C CA . SER D 1 594 ? 22.960 3.533 6.729 1.00 45.57 ? 594 SER D CA 1 +ATOM 21930 C C . SER D 1 594 ? 22.756 2.478 5.629 1.00 46.26 ? 594 SER D C 1 +ATOM 21931 O O . SER D 1 594 ? 21.626 2.213 5.213 1.00 47.18 ? 594 SER D O 1 +ATOM 21932 C CB . SER D 1 594 ? 22.794 2.888 8.104 1.00 44.48 ? 594 SER D CB 1 +ATOM 21933 O OG . SER D 1 594 ? 21.448 2.495 8.329 1.00 43.28 ? 594 SER D OG 1 +ATOM 21934 N N . THR D 1 595 ? 23.845 1.863 5.179 1.00 45.19 ? 595 THR D N 1 +ATOM 21935 C CA . THR D 1 595 ? 23.777 0.871 4.116 1.00 45.02 ? 595 THR D CA 1 +ATOM 21936 C C . THR D 1 595 ? 24.046 -0.571 4.556 1.00 46.65 ? 595 THR D C 1 +ATOM 21937 O O . THR D 1 595 ? 23.775 -1.510 3.818 1.00 46.55 ? 595 THR D O 1 +ATOM 21938 C CB . THR D 1 595 ? 24.777 1.227 3.008 1.00 44.83 ? 595 THR D CB 1 +ATOM 21939 O OG1 . THR D 1 595 ? 26.109 1.209 3.543 1.00 44.92 ? 595 THR D OG1 1 +ATOM 21940 C CG2 . THR D 1 595 ? 24.483 2.617 2.460 1.00 42.72 ? 595 THR D CG2 1 +ATOM 21941 N N . HIS D 1 596 ? 24.577 -0.744 5.760 1.00 48.29 ? 596 HIS D N 1 +ATOM 21942 C CA . HIS D 1 596 ? 24.904 -2.066 6.287 1.00 48.02 ? 596 HIS D CA 1 +ATOM 21943 C C . HIS D 1 596 ? 24.294 -2.202 7.692 1.00 48.62 ? 596 HIS D C 1 +ATOM 21944 O O . HIS D 1 596 ? 23.811 -1.222 8.255 1.00 48.60 ? 596 HIS D O 1 +ATOM 21945 C CB . HIS D 1 596 ? 26.434 -2.198 6.355 1.00 48.90 ? 596 HIS D CB 1 +ATOM 21946 C CG . HIS D 1 596 ? 26.918 -3.555 6.771 1.00 52.22 ? 596 HIS D CG 1 +ATOM 21947 N ND1 . HIS D 1 596 ? 27.070 -4.598 5.882 1.00 53.21 ? 596 HIS D ND1 1 +ATOM 21948 C CD2 . HIS D 1 596 ? 27.260 -4.045 7.986 1.00 51.24 ? 596 HIS D CD2 1 +ATOM 21949 C CE1 . HIS D 1 596 ? 27.483 -5.672 6.531 1.00 51.65 ? 596 HIS D CE1 1 +ATOM 21950 N NE2 . HIS D 1 596 ? 27.606 -5.362 7.809 1.00 52.14 ? 596 HIS D NE2 1 +ATOM 21951 N N . GLU D 1 597 ? 24.310 -3.406 8.256 1.00 49.17 ? 597 GLU D N 1 +ATOM 21952 C CA . GLU D 1 597 ? 23.780 -3.614 9.601 1.00 50.35 ? 597 GLU D CA 1 +ATOM 21953 C C . GLU D 1 597 ? 24.692 -2.961 10.647 1.00 48.90 ? 597 GLU D C 1 +ATOM 21954 O O . GLU D 1 597 ? 24.237 -2.593 11.736 1.00 49.06 ? 597 GLU D O 1 +ATOM 21955 C CB . GLU D 1 597 ? 23.653 -5.109 9.914 1.00 53.71 ? 597 GLU D CB 1 +ATOM 21956 C CG . GLU D 1 597 ? 22.637 -5.842 9.064 1.00 60.59 ? 597 GLU D CG 1 +ATOM 21957 C CD . GLU D 1 597 ? 22.473 -7.303 9.469 1.00 64.71 ? 597 GLU D CD 1 +ATOM 21958 O OE1 . GLU D 1 597 ? 21.938 -7.565 10.572 1.00 66.99 ? 597 GLU D OE1 1 +ATOM 21959 O OE2 . GLU D 1 597 ? 22.880 -8.192 8.685 1.00 66.36 ? 597 GLU D OE2 1 +ATOM 21960 N N . LEU D 1 598 ? 25.976 -2.829 10.316 1.00 46.00 ? 598 LEU D N 1 +ATOM 21961 C CA . LEU D 1 598 ? 26.960 -2.214 11.208 1.00 43.67 ? 598 LEU D CA 1 +ATOM 21962 C C . LEU D 1 598 ? 27.543 -0.976 10.521 1.00 42.63 ? 598 LEU D C 1 +ATOM 21963 O O . LEU D 1 598 ? 28.582 -1.060 9.863 1.00 43.51 ? 598 LEU D O 1 +ATOM 21964 C CB . LEU D 1 598 ? 28.088 -3.207 11.518 1.00 41.84 ? 598 LEU D CB 1 +ATOM 21965 C CG . LEU D 1 598 ? 27.669 -4.591 12.023 1.00 41.93 ? 598 LEU D CG 1 +ATOM 21966 C CD1 . LEU D 1 598 ? 28.904 -5.454 12.146 1.00 40.09 ? 598 LEU D CD1 1 +ATOM 21967 C CD2 . LEU D 1 598 ? 26.938 -4.493 13.362 1.00 38.79 ? 598 LEU D CD2 1 +ATOM 21968 N N . PRO D 1 599 ? 26.885 0.191 10.673 1.00 41.21 ? 599 PRO D N 1 +ATOM 21969 C CA . PRO D 1 599 ? 27.296 1.477 10.076 1.00 39.22 ? 599 PRO D CA 1 +ATOM 21970 C C . PRO D 1 599 ? 28.636 2.024 10.562 1.00 37.75 ? 599 PRO D C 1 +ATOM 21971 O O . PRO D 1 599 ? 28.700 2.723 11.575 1.00 36.63 ? 599 PRO D O 1 +ATOM 21972 C CB . PRO D 1 599 ? 26.144 2.416 10.434 1.00 39.40 ? 599 PRO D CB 1 +ATOM 21973 C CG . PRO D 1 599 ? 24.972 1.473 10.658 1.00 41.61 ? 599 PRO D CG 1 +ATOM 21974 C CD . PRO D 1 599 ? 25.612 0.339 11.400 1.00 40.03 ? 599 PRO D CD 1 +ATOM 21975 N N . ILE D 1 600 ? 29.696 1.719 9.819 1.00 36.84 ? 600 ILE D N 1 +ATOM 21976 C CA . ILE D 1 600 ? 31.048 2.157 10.155 1.00 35.59 ? 600 ILE D CA 1 +ATOM 21977 C C . ILE D 1 600 ? 31.604 3.107 9.097 1.00 36.54 ? 600 ILE D C 1 +ATOM 21978 O O . ILE D 1 600 ? 31.526 2.823 7.899 1.00 36.95 ? 600 ILE D O 1 +ATOM 21979 C CB . ILE D 1 600 ? 31.995 0.945 10.264 1.00 35.38 ? 600 ILE D CB 1 +ATOM 21980 C CG1 . ILE D 1 600 ? 31.529 0.025 11.391 1.00 34.29 ? 600 ILE D CG1 1 +ATOM 21981 C CG2 . ILE D 1 600 ? 33.424 1.412 10.498 1.00 34.52 ? 600 ILE D CG2 1 +ATOM 21982 C CD1 . ILE D 1 600 ? 32.151 -1.356 11.350 1.00 34.60 ? 600 ILE D CD1 1 +ATOM 21983 N N . TYR D 1 601 ? 32.175 4.225 9.536 1.00 35.88 ? 601 TYR D N 1 +ATOM 21984 C CA . TYR D 1 601 ? 32.744 5.198 8.606 1.00 36.70 ? 601 TYR D CA 1 +ATOM 21985 C C . TYR D 1 601 ? 34.145 5.614 9.028 1.00 37.68 ? 601 TYR D C 1 +ATOM 21986 O O . TYR D 1 601 ? 34.399 5.846 10.213 1.00 37.48 ? 601 TYR D O 1 +ATOM 21987 C CB . TYR D 1 601 ? 31.858 6.445 8.520 1.00 36.20 ? 601 TYR D CB 1 +ATOM 21988 C CG . TYR D 1 601 ? 30.430 6.162 8.120 1.00 35.70 ? 601 TYR D CG 1 +ATOM 21989 C CD1 . TYR D 1 601 ? 29.514 5.657 9.042 1.00 35.66 ? 601 TYR D CD1 1 +ATOM 21990 C CD2 . TYR D 1 601 ? 30.002 6.367 6.807 1.00 35.31 ? 601 TYR D CD2 1 +ATOM 21991 C CE1 . TYR D 1 601 ? 28.203 5.359 8.664 1.00 38.10 ? 601 TYR D CE1 1 +ATOM 21992 C CE2 . TYR D 1 601 ? 28.698 6.074 6.414 1.00 34.47 ? 601 TYR D CE2 1 +ATOM 21993 C CZ . TYR D 1 601 ? 27.802 5.569 7.345 1.00 37.67 ? 601 TYR D CZ 1 +ATOM 21994 O OH . TYR D 1 601 ? 26.509 5.262 6.976 1.00 37.41 ? 601 TYR D OH 1 +ATOM 21995 N N . LEU D 1 602 ? 35.051 5.711 8.059 1.00 38.28 ? 602 LEU D N 1 +ATOM 21996 C CA . LEU D 1 602 ? 36.420 6.116 8.352 1.00 39.44 ? 602 LEU D CA 1 +ATOM 21997 C C . LEU D 1 602 ? 36.609 7.568 7.962 1.00 40.70 ? 602 LEU D C 1 +ATOM 21998 O O . LEU D 1 602 ? 36.197 7.998 6.882 1.00 41.89 ? 602 LEU D O 1 +ATOM 21999 C CB . LEU D 1 602 ? 37.428 5.249 7.599 1.00 39.08 ? 602 LEU D CB 1 +ATOM 22000 C CG . LEU D 1 602 ? 37.346 3.754 7.895 1.00 41.38 ? 602 LEU D CG 1 +ATOM 22001 C CD1 . LEU D 1 602 ? 38.529 3.049 7.247 1.00 42.73 ? 602 LEU D CD1 1 +ATOM 22002 C CD2 . LEU D 1 602 ? 37.348 3.522 9.393 1.00 41.27 ? 602 LEU D CD2 1 +ATOM 22003 N N . ARG D 1 603 ? 37.241 8.314 8.857 1.00 40.53 ? 603 ARG D N 1 +ATOM 22004 C CA . ARG D 1 603 ? 37.510 9.733 8.676 1.00 40.45 ? 603 ARG D CA 1 +ATOM 22005 C C . ARG D 1 603 ? 38.690 9.945 7.721 1.00 42.13 ? 603 ARG D C 1 +ATOM 22006 O O . ARG D 1 603 ? 39.642 9.162 7.730 1.00 41.64 ? 603 ARG D O 1 +ATOM 22007 C CB . ARG D 1 603 ? 37.827 10.313 10.047 1.00 39.83 ? 603 ARG D CB 1 +ATOM 22008 C CG . ARG D 1 603 ? 37.984 11.794 10.120 1.00 38.68 ? 603 ARG D CG 1 +ATOM 22009 C CD . ARG D 1 603 ? 38.409 12.128 11.529 1.00 40.19 ? 603 ARG D CD 1 +ATOM 22010 N NE . ARG D 1 603 ? 38.459 13.558 11.785 1.00 41.48 ? 603 ARG D NE 1 +ATOM 22011 C CZ . ARG D 1 603 ? 38.683 14.080 12.981 1.00 40.87 ? 603 ARG D CZ 1 +ATOM 22012 N NH1 . ARG D 1 603 ? 38.882 13.277 14.013 1.00 41.98 ? 603 ARG D NH1 1 +ATOM 22013 N NH2 . ARG D 1 603 ? 38.686 15.399 13.150 1.00 41.68 ? 603 ARG D NH2 1 +ATOM 22014 N N . GLU D 1 604 ? 38.634 10.981 6.882 1.00 43.43 ? 604 GLU D N 1 +ATOM 22015 C CA . GLU D 1 604 ? 39.745 11.244 5.967 1.00 44.95 ? 604 GLU D CA 1 +ATOM 22016 C C . GLU D 1 604 ? 40.949 11.604 6.847 1.00 45.28 ? 604 GLU D C 1 +ATOM 22017 O O . GLU D 1 604 ? 40.949 12.610 7.551 1.00 45.04 ? 604 GLU D O 1 +ATOM 22018 C CB . GLU D 1 604 ? 39.417 12.392 5.006 1.00 46.99 ? 604 GLU D CB 1 +ATOM 22019 C CG . GLU D 1 604 ? 40.505 12.655 3.966 1.00 50.95 ? 604 GLU D CG 1 +ATOM 22020 C CD . GLU D 1 604 ? 40.102 13.705 2.931 1.00 54.85 ? 604 GLU D CD 1 +ATOM 22021 O OE1 . GLU D 1 604 ? 39.732 14.840 3.326 1.00 53.95 ? 604 GLU D OE1 1 +ATOM 22022 O OE2 . GLU D 1 604 ? 40.160 13.389 1.717 1.00 56.01 ? 604 GLU D OE2 1 +ATOM 22023 N N . GLY D 1 605 ? 41.972 10.765 6.803 1.00 45.10 ? 605 GLY D N 1 +ATOM 22024 C CA . GLY D 1 605 ? 43.142 10.982 7.627 1.00 44.51 ? 605 GLY D CA 1 +ATOM 22025 C C . GLY D 1 605 ? 43.105 9.890 8.677 1.00 44.67 ? 605 GLY D C 1 +ATOM 22026 O O . GLY D 1 605 ? 43.103 10.171 9.878 1.00 45.13 ? 605 GLY D O 1 +ATOM 22027 N N . SER D 1 606 ? 43.065 8.640 8.217 1.00 42.98 ? 606 SER D N 1 +ATOM 22028 C CA . SER D 1 606 ? 42.999 7.490 9.109 1.00 42.85 ? 606 SER D CA 1 +ATOM 22029 C C . SER D 1 606 ? 43.973 6.366 8.773 1.00 42.31 ? 606 SER D C 1 +ATOM 22030 O O . SER D 1 606 ? 44.292 6.118 7.612 1.00 41.39 ? 606 SER D O 1 +ATOM 22031 C CB . SER D 1 606 ? 41.586 6.889 9.095 1.00 43.12 ? 606 SER D CB 1 +ATOM 22032 O OG . SER D 1 606 ? 40.604 7.815 9.511 1.00 45.78 ? 606 SER D OG 1 +ATOM 22033 N N . ILE D 1 607 ? 44.429 5.683 9.814 1.00 41.33 ? 607 ILE D N 1 +ATOM 22034 C CA . ILE D 1 607 ? 45.308 4.534 9.664 1.00 41.04 ? 607 ILE D CA 1 +ATOM 22035 C C . ILE D 1 607 ? 44.760 3.535 10.672 1.00 40.46 ? 607 ILE D C 1 +ATOM 22036 O O . ILE D 1 607 ? 44.745 3.793 11.875 1.00 40.09 ? 607 ILE D O 1 +ATOM 22037 C CB . ILE D 1 607 ? 46.778 4.855 10.005 1.00 40.54 ? 607 ILE D CB 1 +ATOM 22038 C CG1 . ILE D 1 607 ? 47.367 5.789 8.948 1.00 41.22 ? 607 ILE D CG1 1 +ATOM 22039 C CG2 . ILE D 1 607 ? 47.578 3.571 10.070 1.00 38.44 ? 607 ILE D CG2 1 +ATOM 22040 C CD1 . ILE D 1 607 ? 48.765 6.313 9.290 1.00 42.47 ? 607 ILE D CD1 1 +ATOM 22041 N N . ILE D 1 608 ? 44.298 2.399 10.183 1.00 38.92 ? 608 ILE D N 1 +ATOM 22042 C CA . ILE D 1 608 ? 43.723 1.415 11.068 1.00 38.66 ? 608 ILE D CA 1 +ATOM 22043 C C . ILE D 1 608 ? 44.336 0.035 10.925 1.00 39.58 ? 608 ILE D C 1 +ATOM 22044 O O . ILE D 1 608 ? 44.222 -0.605 9.880 1.00 38.74 ? 608 ILE D O 1 +ATOM 22045 C CB . ILE D 1 608 ? 42.201 1.340 10.836 1.00 39.15 ? 608 ILE D CB 1 +ATOM 22046 C CG1 . ILE D 1 608 ? 41.591 2.699 11.186 1.00 39.89 ? 608 ILE D CG1 1 +ATOM 22047 C CG2 . ILE D 1 608 ? 41.575 0.205 11.658 1.00 36.87 ? 608 ILE D CG2 1 +ATOM 22048 C CD1 . ILE D 1 608 ? 40.146 2.845 10.805 1.00 43.07 ? 608 ILE D CD1 1 +ATOM 22049 N N . PRO D 1 609 ? 45.026 -0.431 11.981 1.00 40.95 ? 609 PRO D N 1 +ATOM 22050 C CA . PRO D 1 609 ? 45.655 -1.751 11.978 1.00 39.41 ? 609 PRO D CA 1 +ATOM 22051 C C . PRO D 1 609 ? 44.567 -2.768 12.287 1.00 39.62 ? 609 PRO D C 1 +ATOM 22052 O O . PRO D 1 609 ? 43.765 -2.569 13.196 1.00 37.78 ? 609 PRO D O 1 +ATOM 22053 C CB . PRO D 1 609 ? 46.687 -1.641 13.093 1.00 39.00 ? 609 PRO D CB 1 +ATOM 22054 C CG . PRO D 1 609 ? 46.016 -0.758 14.079 1.00 39.45 ? 609 PRO D CG 1 +ATOM 22055 C CD . PRO D 1 609 ? 45.396 0.321 13.198 1.00 41.30 ? 609 PRO D CD 1 +ATOM 22056 N N . LEU D 1 610 ? 44.528 -3.842 11.510 1.00 41.21 ? 610 LEU D N 1 +ATOM 22057 C CA . LEU D 1 610 ? 43.533 -4.880 11.691 1.00 41.48 ? 610 LEU D CA 1 +ATOM 22058 C C . LEU D 1 610 ? 44.201 -6.207 11.998 1.00 42.29 ? 610 LEU D C 1 +ATOM 22059 O O . LEU D 1 610 ? 45.409 -6.364 11.854 1.00 42.37 ? 610 LEU D O 1 +ATOM 22060 C CB . LEU D 1 610 ? 42.681 -5.012 10.423 1.00 42.17 ? 610 LEU D CB 1 +ATOM 22061 C CG . LEU D 1 610 ? 41.890 -3.768 9.999 1.00 42.56 ? 610 LEU D CG 1 +ATOM 22062 C CD1 . LEU D 1 610 ? 41.188 -4.031 8.680 1.00 43.50 ? 610 LEU D CD1 1 +ATOM 22063 C CD2 . LEU D 1 610 ? 40.873 -3.410 11.070 1.00 42.87 ? 610 LEU D CD2 1 +ATOM 22064 N N . GLU D 1 611 ? 43.393 -7.164 12.419 1.00 44.05 ? 611 GLU D N 1 +ATOM 22065 C CA . GLU D 1 611 ? 43.870 -8.495 12.751 1.00 45.23 ? 611 GLU D CA 1 +ATOM 22066 C C . GLU D 1 611 ? 44.649 -9.100 11.585 1.00 45.39 ? 611 GLU D C 1 +ATOM 22067 O O . GLU D 1 611 ? 44.342 -8.858 10.416 1.00 44.01 ? 611 GLU D O 1 +ATOM 22068 C CB . GLU D 1 611 ? 42.669 -9.378 13.109 1.00 46.80 ? 611 GLU D CB 1 +ATOM 22069 C CG . GLU D 1 611 ? 42.989 -10.811 13.421 1.00 50.91 ? 611 GLU D CG 1 +ATOM 22070 C CD . GLU D 1 611 ? 41.747 -11.607 13.793 1.00 55.10 ? 611 GLU D CD 1 +ATOM 22071 O OE1 . GLU D 1 611 ? 40.758 -11.560 13.023 1.00 56.59 ? 611 GLU D OE1 1 +ATOM 22072 O OE2 . GLU D 1 611 ? 41.759 -12.283 14.850 1.00 56.84 ? 611 GLU D OE2 1 +ATOM 22073 N N . GLY D 1 612 ? 45.668 -9.885 11.915 1.00 46.73 ? 612 GLY D N 1 +ATOM 22074 C CA . GLY D 1 612 ? 46.471 -10.529 10.892 1.00 46.52 ? 612 GLY D CA 1 +ATOM 22075 C C . GLY D 1 612 ? 47.337 -9.574 10.101 1.00 46.85 ? 612 GLY D C 1 +ATOM 22076 O O . GLY D 1 612 ? 47.523 -9.749 8.901 1.00 47.57 ? 612 GLY D O 1 +ATOM 22077 N N . ASP D 1 613 ? 47.856 -8.553 10.767 1.00 47.38 ? 613 ASP D N 1 +ATOM 22078 C CA . ASP D 1 613 ? 48.731 -7.581 10.119 1.00 48.64 ? 613 ASP D CA 1 +ATOM 22079 C C . ASP D 1 613 ? 48.136 -6.824 8.942 1.00 48.31 ? 613 ASP D C 1 +ATOM 22080 O O . ASP D 1 613 ? 48.882 -6.281 8.125 1.00 47.41 ? 613 ASP D O 1 +ATOM 22081 C CB . ASP D 1 613 ? 50.027 -8.264 9.680 1.00 50.56 ? 613 ASP D CB 1 +ATOM 22082 C CG . ASP D 1 613 ? 50.805 -8.835 10.853 1.00 53.31 ? 613 ASP D CG 1 +ATOM 22083 O OD1 . ASP D 1 613 ? 51.324 -8.026 11.661 1.00 53.62 ? 613 ASP D OD1 1 +ATOM 22084 O OD2 . ASP D 1 613 ? 50.885 -10.085 10.972 1.00 53.06 ? 613 ASP D OD2 1 +ATOM 22085 N N . GLU D 1 614 ? 46.806 -6.791 8.845 1.00 48.74 ? 614 GLU D N 1 +ATOM 22086 C CA . GLU D 1 614 ? 46.147 -6.042 7.774 1.00 48.53 ? 614 GLU D CA 1 +ATOM 22087 C C . GLU D 1 614 ? 46.294 -4.562 8.117 1.00 47.52 ? 614 GLU D C 1 +ATOM 22088 O O . GLU D 1 614 ? 46.559 -4.201 9.268 1.00 46.50 ? 614 GLU D O 1 +ATOM 22089 C CB . GLU D 1 614 ? 44.658 -6.389 7.677 1.00 50.58 ? 614 GLU D CB 1 +ATOM 22090 C CG . GLU D 1 614 ? 44.312 -7.415 6.615 1.00 54.88 ? 614 GLU D CG 1 +ATOM 22091 C CD . GLU D 1 614 ? 42.810 -7.519 6.356 1.00 58.65 ? 614 GLU D CD 1 +ATOM 22092 O OE1 . GLU D 1 614 ? 42.172 -6.470 6.077 1.00 60.67 ? 614 GLU D OE1 1 +ATOM 22093 O OE2 . GLU D 1 614 ? 42.271 -8.650 6.418 1.00 58.77 ? 614 GLU D OE2 1 +ATOM 22094 N N . LEU D 1 615 ? 46.114 -3.699 7.126 1.00 46.80 ? 615 LEU D N 1 +ATOM 22095 C CA . LEU D 1 615 ? 46.252 -2.268 7.362 1.00 46.45 ? 615 LEU D CA 1 +ATOM 22096 C C . LEU D 1 615 ? 45.360 -1.447 6.426 1.00 45.51 ? 615 LEU D C 1 +ATOM 22097 O O . LEU D 1 615 ? 45.331 -1.681 5.221 1.00 46.24 ? 615 LEU D O 1 +ATOM 22098 C CB . LEU D 1 615 ? 47.721 -1.873 7.178 1.00 45.65 ? 615 LEU D CB 1 +ATOM 22099 C CG . LEU D 1 615 ? 48.196 -0.533 7.733 1.00 46.46 ? 615 LEU D CG 1 +ATOM 22100 C CD1 . LEU D 1 615 ? 48.084 -0.536 9.252 1.00 47.57 ? 615 LEU D CD1 1 +ATOM 22101 C CD2 . LEU D 1 615 ? 49.640 -0.301 7.318 1.00 46.03 ? 615 LEU D CD2 1 +ATOM 22102 N N . ILE D 1 616 ? 44.616 -0.499 6.986 1.00 44.51 ? 616 ILE D N 1 +ATOM 22103 C CA . ILE D 1 616 ? 43.752 0.362 6.180 1.00 43.44 ? 616 ILE D CA 1 +ATOM 22104 C C . ILE D 1 616 ? 44.265 1.787 6.285 1.00 41.65 ? 616 ILE D C 1 +ATOM 22105 O O . ILE D 1 616 ? 44.470 2.305 7.382 1.00 40.36 ? 616 ILE D O 1 +ATOM 22106 C CB . ILE D 1 616 ? 42.293 0.393 6.677 1.00 44.56 ? 616 ILE D CB 1 +ATOM 22107 C CG1 . ILE D 1 616 ? 41.704 -1.011 6.724 1.00 46.88 ? 616 ILE D CG1 1 +ATOM 22108 C CG2 . ILE D 1 616 ? 41.464 1.245 5.737 1.00 45.32 ? 616 ILE D CG2 1 +ATOM 22109 C CD1 . ILE D 1 616 ? 40.289 -1.046 7.290 1.00 49.48 ? 616 ILE D CD1 1 +ATOM 22110 N N . VAL D 1 617 ? 44.467 2.426 5.145 1.00 40.90 ? 617 VAL D N 1 +ATOM 22111 C CA . VAL D 1 617 ? 44.949 3.789 5.152 1.00 40.16 ? 617 VAL D CA 1 +ATOM 22112 C C . VAL D 1 617 ? 44.060 4.671 4.293 1.00 40.79 ? 617 VAL D C 1 +ATOM 22113 O O . VAL D 1 617 ? 43.728 4.323 3.154 1.00 40.95 ? 617 VAL D O 1 +ATOM 22114 C CB . VAL D 1 617 ? 46.401 3.863 4.632 1.00 40.76 ? 617 VAL D CB 1 +ATOM 22115 C CG1 . VAL D 1 617 ? 46.860 5.313 4.586 1.00 39.76 ? 617 VAL D CG1 1 +ATOM 22116 C CG2 . VAL D 1 617 ? 47.325 3.030 5.538 1.00 39.68 ? 617 VAL D CG2 1 +ATOM 22117 N N . TYR D 1 618 ? 43.666 5.809 4.852 1.00 40.23 ? 618 TYR D N 1 +ATOM 22118 C CA . TYR D 1 618 ? 42.836 6.766 4.140 1.00 40.74 ? 618 TYR D CA 1 +ATOM 22119 C C . TYR D 1 618 ? 43.281 8.175 4.467 1.00 41.77 ? 618 TYR D C 1 +ATOM 22120 O O . TYR D 1 618 ? 42.973 8.685 5.541 1.00 41.81 ? 618 TYR D O 1 +ATOM 22121 C CB . TYR D 1 618 ? 41.370 6.598 4.529 1.00 40.20 ? 618 TYR D CB 1 +ATOM 22122 C CG . TYR D 1 618 ? 40.440 7.662 3.972 1.00 40.00 ? 618 TYR D CG 1 +ATOM 22123 C CD1 . TYR D 1 618 ? 40.756 8.366 2.804 1.00 40.11 ? 618 TYR D CD1 1 +ATOM 22124 C CD2 . TYR D 1 618 ? 39.210 7.918 4.577 1.00 39.55 ? 618 TYR D CD2 1 +ATOM 22125 C CE1 . TYR D 1 618 ? 39.867 9.297 2.254 1.00 41.12 ? 618 TYR D CE1 1 +ATOM 22126 C CE2 . TYR D 1 618 ? 38.315 8.836 4.037 1.00 41.23 ? 618 TYR D CE2 1 +ATOM 22127 C CZ . TYR D 1 618 ? 38.648 9.525 2.878 1.00 41.86 ? 618 TYR D CZ 1 +ATOM 22128 O OH . TYR D 1 618 ? 37.767 10.448 2.355 1.00 42.27 ? 618 TYR D OH 1 +ATOM 22129 N N . GLY D 1 619 ? 44.003 8.799 3.543 1.00 42.75 ? 619 GLY D N 1 +ATOM 22130 C CA . GLY D 1 619 ? 44.459 10.159 3.768 1.00 44.96 ? 619 GLY D CA 1 +ATOM 22131 C C . GLY D 1 619 ? 45.771 10.236 4.508 1.00 45.72 ? 619 GLY D C 1 +ATOM 22132 O O . GLY D 1 619 ? 46.482 9.241 4.605 1.00 46.70 ? 619 GLY D O 1 +ATOM 22133 N N . GLU D 1 620 ? 46.077 11.415 5.041 1.00 48.29 ? 620 GLU D N 1 +ATOM 22134 C CA . GLU D 1 620 ? 47.327 11.643 5.764 1.00 50.81 ? 620 GLU D CA 1 +ATOM 22135 C C . GLU D 1 620 ? 47.136 11.795 7.270 1.00 50.03 ? 620 GLU D C 1 +ATOM 22136 O O . GLU D 1 620 ? 46.273 12.550 7.730 1.00 48.98 ? 620 GLU D O 1 +ATOM 22137 C CB . GLU D 1 620 ? 48.018 12.895 5.221 1.00 53.95 ? 620 GLU D CB 1 +ATOM 22138 C CG . GLU D 1 620 ? 48.216 12.889 3.704 1.00 59.97 ? 620 GLU D CG 1 +ATOM 22139 C CD . GLU D 1 620 ? 48.753 14.222 3.171 1.00 63.55 ? 620 GLU D CD 1 +ATOM 22140 O OE1 . GLU D 1 620 ? 48.079 15.266 3.362 1.00 65.24 ? 620 GLU D OE1 1 +ATOM 22141 O OE2 . GLU D 1 620 ? 49.848 14.226 2.559 1.00 63.69 ? 620 GLU D OE2 1 +ATOM 22142 N N . THR D 1 621 ? 47.954 11.071 8.030 1.00 49.06 ? 621 THR D N 1 +ATOM 22143 C CA . THR D 1 621 ? 47.910 11.118 9.487 1.00 47.80 ? 621 THR D CA 1 +ATOM 22144 C C . THR D 1 621 ? 49.088 10.306 10.004 1.00 48.20 ? 621 THR D C 1 +ATOM 22145 O O . THR D 1 621 ? 49.855 9.749 9.218 1.00 48.00 ? 621 THR D O 1 +ATOM 22146 C CB . THR D 1 621 ? 46.570 10.525 10.046 1.00 47.07 ? 621 THR D CB 1 +ATOM 22147 O OG1 . THR D 1 621 ? 46.517 10.696 11.470 1.00 45.50 ? 621 THR D OG1 1 +ATOM 22148 C CG2 . THR D 1 621 ? 46.451 9.035 9.722 1.00 45.84 ? 621 THR D CG2 1 +ATOM 22149 N N . SER D 1 622 ? 49.234 10.255 11.323 1.00 48.54 ? 622 SER D N 1 +ATOM 22150 C CA . SER D 1 622 ? 50.303 9.498 11.957 1.00 48.09 ? 622 SER D CA 1 +ATOM 22151 C C . SER D 1 622 ? 49.647 8.673 13.058 1.00 47.18 ? 622 SER D C 1 +ATOM 22152 O O . SER D 1 622 ? 48.792 9.169 13.789 1.00 46.62 ? 622 SER D O 1 +ATOM 22153 C CB . SER D 1 622 ? 51.347 10.448 12.544 1.00 50.10 ? 622 SER D CB 1 +ATOM 22154 O OG . SER D 1 622 ? 52.474 9.728 13.004 1.00 53.16 ? 622 SER D OG 1 +ATOM 22155 N N . PHE D 1 623 ? 50.048 7.414 13.177 1.00 47.00 ? 623 PHE D N 1 +ATOM 22156 C CA . PHE D 1 623 ? 49.452 6.527 14.163 1.00 46.60 ? 623 PHE D CA 1 +ATOM 22157 C C . PHE D 1 623 ? 50.475 5.593 14.804 1.00 47.39 ? 623 PHE D C 1 +ATOM 22158 O O . PHE D 1 623 ? 51.356 5.059 14.131 1.00 47.07 ? 623 PHE D O 1 +ATOM 22159 C CB . PHE D 1 623 ? 48.353 5.705 13.489 1.00 46.96 ? 623 PHE D CB 1 +ATOM 22160 C CG . PHE D 1 623 ? 47.661 4.744 14.406 1.00 46.91 ? 623 PHE D CG 1 +ATOM 22161 C CD1 . PHE D 1 623 ? 46.798 5.205 15.390 1.00 47.90 ? 623 PHE D CD1 1 +ATOM 22162 C CD2 . PHE D 1 623 ? 47.873 3.374 14.286 1.00 46.57 ? 623 PHE D CD2 1 +ATOM 22163 C CE1 . PHE D 1 623 ? 46.154 4.309 16.243 1.00 49.19 ? 623 PHE D CE1 1 +ATOM 22164 C CE2 . PHE D 1 623 ? 47.240 2.476 15.128 1.00 46.96 ? 623 PHE D CE2 1 +ATOM 22165 C CZ . PHE D 1 623 ? 46.380 2.939 16.107 1.00 47.92 ? 623 PHE D CZ 1 +ATOM 22166 N N . LYS D 1 624 ? 50.344 5.399 16.110 1.00 47.37 ? 624 LYS D N 1 +ATOM 22167 C CA . LYS D 1 624 ? 51.240 4.528 16.854 1.00 48.38 ? 624 LYS D CA 1 +ATOM 22168 C C . LYS D 1 624 ? 50.513 3.225 17.187 1.00 48.55 ? 624 LYS D C 1 +ATOM 22169 O O . LYS D 1 624 ? 49.511 3.229 17.902 1.00 49.07 ? 624 LYS D O 1 +ATOM 22170 C CB . LYS D 1 624 ? 51.687 5.229 18.139 1.00 48.03 ? 624 LYS D CB 1 +ATOM 22171 C CG . LYS D 1 624 ? 52.655 4.432 18.983 1.00 51.30 ? 624 LYS D CG 1 +ATOM 22172 C CD . LYS D 1 624 ? 53.113 5.243 20.181 1.00 52.44 ? 624 LYS D CD 1 +ATOM 22173 C CE . LYS D 1 624 ? 54.125 4.462 21.007 1.00 56.23 ? 624 LYS D CE 1 +ATOM 22174 N NZ . LYS D 1 624 ? 54.650 5.255 22.160 1.00 57.86 ? 624 LYS D NZ 1 +ATOM 22175 N N . ARG D 1 625 ? 51.005 2.113 16.653 1.00 48.88 ? 625 ARG D N 1 +ATOM 22176 C CA . ARG D 1 625 ? 50.385 0.824 16.917 1.00 49.15 ? 625 ARG D CA 1 +ATOM 22177 C C . ARG D 1 625 ? 50.784 0.370 18.326 1.00 49.97 ? 625 ARG D C 1 +ATOM 22178 O O . ARG D 1 625 ? 51.780 0.836 18.882 1.00 50.52 ? 625 ARG D O 1 +ATOM 22179 C CB . ARG D 1 625 ? 50.821 -0.197 15.863 1.00 49.30 ? 625 ARG D CB 1 +ATOM 22180 C CG . ARG D 1 625 ? 49.881 -1.379 15.757 1.00 51.01 ? 625 ARG D CG 1 +ATOM 22181 C CD . ARG D 1 625 ? 50.151 -2.199 14.515 1.00 52.78 ? 625 ARG D CD 1 +ATOM 22182 N NE . ARG D 1 625 ? 51.491 -2.767 14.525 1.00 54.21 ? 625 ARG D NE 1 +ATOM 22183 C CZ . ARG D 1 625 ? 51.965 -3.569 13.580 1.00 54.61 ? 625 ARG D CZ 1 +ATOM 22184 N NH1 . ARG D 1 625 ? 51.202 -3.895 12.545 1.00 54.48 ? 625 ARG D NH1 1 +ATOM 22185 N NH2 . ARG D 1 625 ? 53.200 -4.045 13.673 1.00 55.17 ? 625 ARG D NH2 1 +ATOM 22186 N N . TYR D 1 626 ? 50.003 -0.534 18.903 1.00 50.12 ? 626 TYR D N 1 +ATOM 22187 C CA . TYR D 1 626 ? 50.249 -1.006 20.259 1.00 50.71 ? 626 TYR D CA 1 +ATOM 22188 C C . TYR D 1 626 ? 51.615 -1.632 20.499 1.00 52.38 ? 626 TYR D C 1 +ATOM 22189 O O . TYR D 1 626 ? 52.103 -1.641 21.627 1.00 52.39 ? 626 TYR D O 1 +ATOM 22190 C CB . TYR D 1 626 ? 49.157 -1.995 20.664 1.00 49.05 ? 626 TYR D CB 1 +ATOM 22191 C CG . TYR D 1 626 ? 49.243 -3.335 19.979 1.00 47.87 ? 626 TYR D CG 1 +ATOM 22192 C CD1 . TYR D 1 626 ? 50.129 -4.314 20.433 1.00 46.62 ? 626 TYR D CD1 1 +ATOM 22193 C CD2 . TYR D 1 626 ? 48.428 -3.633 18.884 1.00 47.22 ? 626 TYR D CD2 1 +ATOM 22194 C CE1 . TYR D 1 626 ? 50.204 -5.560 19.818 1.00 46.77 ? 626 TYR D CE1 1 +ATOM 22195 C CE2 . TYR D 1 626 ? 48.494 -4.877 18.258 1.00 47.44 ? 626 TYR D CE2 1 +ATOM 22196 C CZ . TYR D 1 626 ? 49.387 -5.835 18.733 1.00 48.31 ? 626 TYR D CZ 1 +ATOM 22197 O OH . TYR D 1 626 ? 49.470 -7.065 18.121 1.00 51.15 ? 626 TYR D OH 1 +ATOM 22198 N N . ASP D 1 627 ? 52.228 -2.166 19.448 1.00 54.28 ? 627 ASP D N 1 +ATOM 22199 C CA . ASP D 1 627 ? 53.540 -2.793 19.577 1.00 54.85 ? 627 ASP D CA 1 +ATOM 22200 C C . ASP D 1 627 ? 54.641 -1.765 19.372 1.00 55.84 ? 627 ASP D C 1 +ATOM 22201 O O . ASP D 1 627 ? 55.784 -2.112 19.083 1.00 56.62 ? 627 ASP D O 1 +ATOM 22202 C CB . ASP D 1 627 ? 53.685 -3.940 18.570 1.00 55.72 ? 627 ASP D CB 1 +ATOM 22203 C CG . ASP D 1 627 ? 53.678 -3.462 17.127 1.00 57.06 ? 627 ASP D CG 1 +ATOM 22204 O OD1 . ASP D 1 627 ? 53.191 -2.341 16.862 1.00 57.26 ? 627 ASP D OD1 1 +ATOM 22205 O OD2 . ASP D 1 627 ? 54.151 -4.219 16.252 1.00 58.80 ? 627 ASP D OD2 1 +ATOM 22206 N N . ASN D 1 628 ? 54.278 -0.494 19.517 1.00 56.97 ? 628 ASN D N 1 +ATOM 22207 C CA . ASN D 1 628 ? 55.219 0.608 19.381 1.00 58.09 ? 628 ASN D CA 1 +ATOM 22208 C C . ASN D 1 628 ? 55.550 1.050 17.947 1.00 57.01 ? 628 ASN D C 1 +ATOM 22209 O O . ASN D 1 628 ? 56.137 2.118 17.742 1.00 56.77 ? 628 ASN D O 1 +ATOM 22210 C CB . ASN D 1 628 ? 56.499 0.270 20.156 1.00 61.52 ? 628 ASN D CB 1 +ATOM 22211 C CG . ASN D 1 628 ? 57.730 0.922 19.567 1.00 65.86 ? 628 ASN D CG 1 +ATOM 22212 O OD1 . ASN D 1 628 ? 58.224 0.507 18.508 1.00 68.04 ? 628 ASN D OD1 1 +ATOM 22213 N ND2 . ASN D 1 628 ? 58.235 1.954 20.242 1.00 67.48 ? 628 ASN D ND2 1 +ATOM 22214 N N . ALA D 1 629 ? 55.167 0.252 16.956 1.00 55.28 ? 629 ALA D N 1 +ATOM 22215 C CA . ALA D 1 629 ? 55.439 0.606 15.566 1.00 54.58 ? 629 ALA D CA 1 +ATOM 22216 C C . ALA D 1 629 ? 54.626 1.836 15.134 1.00 54.63 ? 629 ALA D C 1 +ATOM 22217 O O . ALA D 1 629 ? 53.399 1.826 15.209 1.00 54.79 ? 629 ALA D O 1 +ATOM 22218 C CB . ALA D 1 629 ? 55.118 -0.574 14.662 1.00 52.95 ? 629 ALA D CB 1 +ATOM 22219 N N . GLU D 1 630 ? 55.308 2.891 14.692 1.00 53.82 ? 630 GLU D N 1 +ATOM 22220 C CA . GLU D 1 630 ? 54.623 4.102 14.248 1.00 55.12 ? 630 GLU D CA 1 +ATOM 22221 C C . GLU D 1 630 ? 54.467 4.108 12.731 1.00 54.13 ? 630 GLU D C 1 +ATOM 22222 O O . GLU D 1 630 ? 55.407 3.808 11.998 1.00 54.39 ? 630 GLU D O 1 +ATOM 22223 C CB . GLU D 1 630 ? 55.391 5.344 14.702 1.00 57.34 ? 630 GLU D CB 1 +ATOM 22224 C CG . GLU D 1 630 ? 55.470 5.471 16.214 1.00 64.16 ? 630 GLU D CG 1 +ATOM 22225 C CD . GLU D 1 630 ? 56.530 6.458 16.682 1.00 67.62 ? 630 GLU D CD 1 +ATOM 22226 O OE1 . GLU D 1 630 ? 56.426 7.666 16.356 1.00 68.94 ? 630 GLU D OE1 1 +ATOM 22227 O OE2 . GLU D 1 630 ? 57.472 6.017 17.380 1.00 69.32 ? 630 GLU D OE2 1 +ATOM 22228 N N . ILE D 1 631 ? 53.271 4.450 12.266 1.00 52.56 ? 631 ILE D N 1 +ATOM 22229 C CA . ILE D 1 631 ? 52.981 4.482 10.840 1.00 51.37 ? 631 ILE D CA 1 +ATOM 22230 C C . ILE D 1 631 ? 52.565 5.895 10.464 1.00 51.65 ? 631 ILE D C 1 +ATOM 22231 O O . ILE D 1 631 ? 51.788 6.527 11.175 1.00 52.25 ? 631 ILE D O 1 +ATOM 22232 C CB . ILE D 1 631 ? 51.839 3.513 10.498 1.00 50.89 ? 631 ILE D CB 1 +ATOM 22233 C CG1 . ILE D 1 631 ? 52.158 2.118 11.051 1.00 51.23 ? 631 ILE D CG1 1 +ATOM 22234 C CG2 . ILE D 1 631 ? 51.636 3.464 9.000 1.00 50.97 ? 631 ILE D CG2 1 +ATOM 22235 C CD1 . ILE D 1 631 ? 51.044 1.100 10.872 1.00 49.85 ? 631 ILE D CD1 1 +ATOM 22236 N N . THR D 1 632 ? 53.090 6.396 9.354 1.00 51.52 ? 632 THR D N 1 +ATOM 22237 C CA . THR D 1 632 ? 52.757 7.744 8.915 1.00 51.86 ? 632 THR D CA 1 +ATOM 22238 C C . THR D 1 632 ? 52.428 7.776 7.432 1.00 53.36 ? 632 THR D C 1 +ATOM 22239 O O . THR D 1 632 ? 53.124 7.164 6.611 1.00 52.62 ? 632 THR D O 1 +ATOM 22240 C CB . THR D 1 632 ? 53.921 8.729 9.162 1.00 52.32 ? 632 THR D CB 1 +ATOM 22241 O OG1 . THR D 1 632 ? 54.357 8.634 10.527 1.00 52.53 ? 632 THR D OG1 1 +ATOM 22242 C CG2 . THR D 1 632 ? 53.474 10.165 8.865 1.00 49.62 ? 632 THR D CG2 1 +ATOM 22243 N N . SER D 1 633 ? 51.360 8.487 7.089 1.00 54.47 ? 633 SER D N 1 +ATOM 22244 C CA . SER D 1 633 ? 50.965 8.601 5.695 1.00 57.72 ? 633 SER D CA 1 +ATOM 22245 C C . SER D 1 633 ? 50.954 10.067 5.305 1.00 59.64 ? 633 SER D C 1 +ATOM 22246 O O . SER D 1 633 ? 50.480 10.920 6.057 1.00 59.43 ? 633 SER D O 1 +ATOM 22247 C CB . SER D 1 633 ? 49.580 7.984 5.461 1.00 56.66 ? 633 SER D CB 1 +ATOM 22248 O OG . SER D 1 633 ? 48.566 8.728 6.108 1.00 58.51 ? 633 SER D OG 1 +ATOM 22249 N N . SER D 1 634 ? 51.510 10.353 4.133 1.00 62.99 ? 634 SER D N 1 +ATOM 22250 C CA . SER D 1 634 ? 51.565 11.712 3.610 1.00 66.84 ? 634 SER D CA 1 +ATOM 22251 C C . SER D 1 634 ? 51.222 11.641 2.122 1.00 68.61 ? 634 SER D C 1 +ATOM 22252 O O . SER D 1 634 ? 50.465 10.757 1.708 1.00 69.52 ? 634 SER D O 1 +ATOM 22253 C CB . SER D 1 634 ? 52.962 12.309 3.814 1.00 66.57 ? 634 SER D CB 1 +ATOM 22254 O OG . SER D 1 634 ? 53.943 11.553 3.125 1.00 67.97 ? 634 SER D OG 1 +ATOM 22255 N N . SER D 1 635 ? 51.770 12.564 1.331 1.00 70.51 ? 635 SER D N 1 +ATOM 22256 C CA . SER D 1 635 ? 51.528 12.610 -0.116 1.00 72.22 ? 635 SER D CA 1 +ATOM 22257 C C . SER D 1 635 ? 51.130 11.243 -0.698 1.00 72.52 ? 635 SER D C 1 +ATOM 22258 O O . SER D 1 635 ? 49.943 10.917 -0.793 1.00 73.31 ? 635 SER D O 1 +ATOM 22259 C CB . SER D 1 635 ? 52.776 13.157 -0.826 1.00 73.06 ? 635 SER D CB 1 +ATOM 22260 O OG . SER D 1 635 ? 53.965 12.533 -0.353 1.00 74.15 ? 635 SER D OG 1 +ATOM 22261 N N . ASN D 1 636 ? 52.117 10.451 -1.094 1.00 72.14 ? 636 ASN D N 1 +ATOM 22262 C CA . ASN D 1 636 ? 51.852 9.123 -1.628 1.00 71.95 ? 636 ASN D CA 1 +ATOM 22263 C C . ASN D 1 636 ? 52.871 8.219 -0.983 1.00 71.13 ? 636 ASN D C 1 +ATOM 22264 O O . ASN D 1 636 ? 53.473 7.362 -1.628 1.00 71.19 ? 636 ASN D O 1 +ATOM 22265 C CB . ASN D 1 636 ? 52.026 9.091 -3.144 1.00 73.98 ? 636 ASN D CB 1 +ATOM 22266 C CG . ASN D 1 636 ? 51.020 9.962 -3.859 1.00 76.14 ? 636 ASN D CG 1 +ATOM 22267 O OD1 . ASN D 1 636 ? 49.828 9.951 -3.531 1.00 76.38 ? 636 ASN D OD1 1 +ATOM 22268 N ND2 . ASN D 1 636 ? 51.488 10.718 -4.852 1.00 76.42 ? 636 ASN D ND2 1 +ATOM 22269 N N . GLU D 1 637 ? 53.061 8.421 0.312 1.00 69.84 ? 637 GLU D N 1 +ATOM 22270 C CA . GLU D 1 637 ? 54.038 7.640 1.033 1.00 68.81 ? 637 GLU D CA 1 +ATOM 22271 C C . GLU D 1 637 ? 53.574 7.237 2.430 1.00 66.54 ? 637 GLU D C 1 +ATOM 22272 O O . GLU D 1 637 ? 52.989 8.032 3.168 1.00 65.46 ? 637 GLU D O 1 +ATOM 22273 C CB . GLU D 1 637 ? 55.338 8.440 1.107 1.00 71.48 ? 637 GLU D CB 1 +ATOM 22274 C CG . GLU D 1 637 ? 56.509 7.721 1.739 1.00 76.58 ? 637 GLU D CG 1 +ATOM 22275 C CD . GLU D 1 637 ? 57.782 8.560 1.701 1.00 80.42 ? 637 GLU D CD 1 +ATOM 22276 O OE1 . GLU D 1 637 ? 57.755 9.710 2.202 1.00 81.22 ? 637 GLU D OE1 1 +ATOM 22277 O OE2 . GLU D 1 637 ? 58.805 8.070 1.169 1.00 82.16 ? 637 GLU D OE2 1 +ATOM 22278 N N . ILE D 1 638 ? 53.831 5.980 2.773 1.00 64.21 ? 638 ILE D N 1 +ATOM 22279 C CA . ILE D 1 638 ? 53.481 5.443 4.079 1.00 61.58 ? 638 ILE D CA 1 +ATOM 22280 C C . ILE D 1 638 ? 54.788 5.018 4.733 1.00 61.23 ? 638 ILE D C 1 +ATOM 22281 O O . ILE D 1 638 ? 55.381 4.015 4.344 1.00 61.07 ? 638 ILE D O 1 +ATOM 22282 C CB . ILE D 1 638 ? 52.564 4.212 3.957 1.00 59.96 ? 638 ILE D CB 1 +ATOM 22283 C CG1 . ILE D 1 638 ? 51.290 4.585 3.201 1.00 58.26 ? 638 ILE D CG1 1 +ATOM 22284 C CG2 . ILE D 1 638 ? 52.218 3.684 5.343 1.00 58.56 ? 638 ILE D CG2 1 +ATOM 22285 C CD1 . ILE D 1 638 ? 50.393 3.405 2.899 1.00 57.33 ? 638 ILE D CD1 1 +ATOM 22286 N N . LYS D 1 639 ? 55.242 5.789 5.714 1.00 60.76 ? 639 LYS D N 1 +ATOM 22287 C CA . LYS D 1 639 ? 56.490 5.483 6.404 1.00 60.98 ? 639 LYS D CA 1 +ATOM 22288 C C . LYS D 1 639 ? 56.266 4.635 7.656 1.00 60.67 ? 639 LYS D C 1 +ATOM 22289 O O . LYS D 1 639 ? 55.224 4.738 8.315 1.00 60.91 ? 639 LYS D O 1 +ATOM 22290 C CB . LYS D 1 639 ? 57.200 6.779 6.797 1.00 62.76 ? 639 LYS D CB 1 +ATOM 22291 C CG . LYS D 1 639 ? 57.527 7.709 5.638 1.00 65.32 ? 639 LYS D CG 1 +ATOM 22292 C CD . LYS D 1 639 ? 58.061 9.041 6.163 1.00 69.09 ? 639 LYS D CD 1 +ATOM 22293 C CE . LYS D 1 639 ? 58.475 9.989 5.037 1.00 70.30 ? 639 LYS D CE 1 +ATOM 22294 N NZ . LYS D 1 639 ? 59.630 9.469 4.242 1.00 71.87 ? 639 LYS D NZ 1 +ATOM 22295 N N . PHE D 1 640 ? 57.251 3.799 7.976 1.00 59.32 ? 640 PHE D N 1 +ATOM 22296 C CA . PHE D 1 640 ? 57.193 2.937 9.156 1.00 58.78 ? 640 PHE D CA 1 +ATOM 22297 C C . PHE D 1 640 ? 58.413 3.199 10.039 1.00 57.93 ? 640 PHE D C 1 +ATOM 22298 O O . PHE D 1 640 ? 59.545 3.212 9.554 1.00 57.47 ? 640 PHE D O 1 +ATOM 22299 C CB . PHE D 1 640 ? 57.155 1.461 8.747 1.00 59.15 ? 640 PHE D CB 1 +ATOM 22300 C CG . PHE D 1 640 ? 55.938 1.084 7.949 1.00 60.17 ? 640 PHE D CG 1 +ATOM 22301 C CD1 . PHE D 1 640 ? 55.784 1.524 6.637 1.00 60.44 ? 640 PHE D CD1 1 +ATOM 22302 C CD2 . PHE D 1 640 ? 54.935 0.305 8.517 1.00 59.91 ? 640 PHE D CD2 1 +ATOM 22303 C CE1 . PHE D 1 640 ? 54.645 1.193 5.902 1.00 60.77 ? 640 PHE D CE1 1 +ATOM 22304 C CE2 . PHE D 1 640 ? 53.793 -0.031 7.793 1.00 59.82 ? 640 PHE D CE2 1 +ATOM 22305 C CZ . PHE D 1 640 ? 53.647 0.413 6.484 1.00 60.23 ? 640 PHE D CZ 1 +ATOM 22306 N N . SER D 1 641 ? 58.176 3.411 11.331 1.00 57.29 ? 641 SER D N 1 +ATOM 22307 C CA . SER D 1 641 ? 59.256 3.690 12.271 1.00 56.22 ? 641 SER D CA 1 +ATOM 22308 C C . SER D 1 641 ? 60.208 2.510 12.391 1.00 56.17 ? 641 SER D C 1 +ATOM 22309 O O . SER D 1 641 ? 61.336 2.667 12.844 1.00 56.44 ? 641 SER D O 1 +ATOM 22310 C CB . SER D 1 641 ? 58.695 4.052 13.652 1.00 55.37 ? 641 SER D CB 1 +ATOM 22311 O OG . SER D 1 641 ? 58.082 2.941 14.278 1.00 54.83 ? 641 SER D OG 1 +ATOM 22312 N N . ARG D 1 642 ? 59.755 1.329 11.988 1.00 56.28 ? 642 ARG D N 1 +ATOM 22313 C CA . ARG D 1 642 ? 60.603 0.146 12.037 1.00 57.50 ? 642 ARG D CA 1 +ATOM 22314 C C . ARG D 1 642 ? 60.034 -0.966 11.163 1.00 57.99 ? 642 ARG D C 1 +ATOM 22315 O O . ARG D 1 642 ? 58.865 -0.944 10.798 1.00 59.22 ? 642 ARG D O 1 +ATOM 22316 C CB . ARG D 1 642 ? 60.780 -0.343 13.481 1.00 57.35 ? 642 ARG D CB 1 +ATOM 22317 C CG . ARG D 1 642 ? 59.539 -0.906 14.141 1.00 59.42 ? 642 ARG D CG 1 +ATOM 22318 C CD . ARG D 1 642 ? 59.805 -1.223 15.610 1.00 62.22 ? 642 ARG D CD 1 +ATOM 22319 N NE . ARG D 1 642 ? 58.635 -1.781 16.289 1.00 64.54 ? 642 ARG D NE 1 +ATOM 22320 C CZ . ARG D 1 642 ? 58.095 -2.966 16.004 1.00 66.02 ? 642 ARG D CZ 1 +ATOM 22321 N NH1 . ARG D 1 642 ? 58.617 -3.730 15.052 1.00 66.99 ? 642 ARG D NH1 1 +ATOM 22322 N NH2 . ARG D 1 642 ? 57.024 -3.387 16.666 1.00 65.51 ? 642 ARG D NH2 1 +ATOM 22323 N N . GLU D 1 643 ? 60.874 -1.933 10.822 1.00 58.55 ? 643 GLU D N 1 +ATOM 22324 C CA . GLU D 1 643 ? 60.463 -3.046 9.983 1.00 58.73 ? 643 GLU D CA 1 +ATOM 22325 C C . GLU D 1 643 ? 59.304 -3.836 10.587 1.00 57.21 ? 643 GLU D C 1 +ATOM 22326 O O . GLU D 1 643 ? 59.378 -4.289 11.732 1.00 56.49 ? 643 GLU D O 1 +ATOM 22327 C CB . GLU D 1 643 ? 61.658 -3.977 9.744 1.00 61.27 ? 643 GLU D CB 1 +ATOM 22328 C CG . GLU D 1 643 ? 61.340 -5.202 8.892 1.00 66.00 ? 643 GLU D CG 1 +ATOM 22329 C CD . GLU D 1 643 ? 62.523 -6.143 8.748 1.00 68.79 ? 643 GLU D CD 1 +ATOM 22330 O OE1 . GLU D 1 643 ? 63.551 -5.728 8.164 1.00 70.90 ? 643 GLU D OE1 1 +ATOM 22331 O OE2 . GLU D 1 643 ? 62.424 -7.297 9.223 1.00 70.21 ? 643 GLU D OE2 1 +ATOM 22332 N N . ILE D 1 644 ? 58.232 -3.996 9.814 1.00 55.59 ? 644 ILE D N 1 +ATOM 22333 C CA . ILE D 1 644 ? 57.072 -4.755 10.274 1.00 54.89 ? 644 ILE D CA 1 +ATOM 22334 C C . ILE D 1 644 ? 56.433 -5.524 9.130 1.00 53.12 ? 644 ILE D C 1 +ATOM 22335 O O . ILE D 1 644 ? 56.499 -5.112 7.972 1.00 53.62 ? 644 ILE D O 1 +ATOM 22336 C CB . ILE D 1 644 ? 55.973 -3.851 10.892 1.00 55.63 ? 644 ILE D CB 1 +ATOM 22337 C CG1 . ILE D 1 644 ? 55.353 -2.967 9.809 1.00 55.61 ? 644 ILE D CG1 1 +ATOM 22338 C CG2 . ILE D 1 644 ? 56.559 -3.002 12.019 1.00 55.17 ? 644 ILE D CG2 1 +ATOM 22339 C CD1 . ILE D 1 644 ? 54.056 -2.322 10.244 1.00 56.70 ? 644 ILE D CD1 1 +ATOM 22340 N N . TYR D 1 645 ? 55.807 -6.642 9.463 1.00 51.46 ? 645 TYR D N 1 +ATOM 22341 C CA . TYR D 1 645 ? 55.144 -7.456 8.460 1.00 50.50 ? 645 TYR D CA 1 +ATOM 22342 C C . TYR D 1 645 ? 53.808 -6.810 8.104 1.00 50.31 ? 645 TYR D C 1 +ATOM 22343 O O . TYR D 1 645 ? 53.146 -6.205 8.949 1.00 50.01 ? 645 TYR D O 1 +ATOM 22344 C CB . TYR D 1 645 ? 54.898 -8.862 8.998 1.00 49.76 ? 645 TYR D CB 1 +ATOM 22345 C CG . TYR D 1 645 ? 54.338 -9.819 7.976 1.00 51.14 ? 645 TYR D CG 1 +ATOM 22346 C CD1 . TYR D 1 645 ? 55.169 -10.437 7.035 1.00 51.33 ? 645 TYR D CD1 1 +ATOM 22347 C CD2 . TYR D 1 645 ? 52.976 -10.104 7.940 1.00 51.19 ? 645 TYR D CD2 1 +ATOM 22348 C CE1 . TYR D 1 645 ? 54.654 -11.319 6.087 1.00 50.82 ? 645 TYR D CE1 1 +ATOM 22349 C CE2 . TYR D 1 645 ? 52.447 -10.983 6.996 1.00 51.95 ? 645 TYR D CE2 1 +ATOM 22350 C CZ . TYR D 1 645 ? 53.289 -11.586 6.072 1.00 52.71 ? 645 TYR D CZ 1 +ATOM 22351 O OH . TYR D 1 645 ? 52.754 -12.444 5.132 1.00 54.87 ? 645 TYR D OH 1 +ATOM 22352 N N . VAL D 1 646 ? 53.419 -6.934 6.843 1.00 49.81 ? 646 VAL D N 1 +ATOM 22353 C CA . VAL D 1 646 ? 52.159 -6.379 6.372 1.00 47.37 ? 646 VAL D CA 1 +ATOM 22354 C C . VAL D 1 646 ? 51.544 -7.383 5.413 1.00 47.46 ? 646 VAL D C 1 +ATOM 22355 O O . VAL D 1 646 ? 52.140 -7.719 4.384 1.00 47.49 ? 646 VAL D O 1 +ATOM 22356 C CB . VAL D 1 646 ? 52.364 -5.047 5.628 1.00 45.43 ? 646 VAL D CB 1 +ATOM 22357 C CG1 . VAL D 1 646 ? 51.046 -4.556 5.073 1.00 45.45 ? 646 VAL D CG1 1 +ATOM 22358 C CG2 . VAL D 1 646 ? 52.946 -4.019 6.558 1.00 46.00 ? 646 VAL D CG2 1 +ATOM 22359 N N . SER D 1 647 ? 50.361 -7.876 5.756 1.00 46.63 ? 647 SER D N 1 +ATOM 22360 C CA . SER D 1 647 ? 49.685 -8.837 4.905 1.00 47.52 ? 647 SER D CA 1 +ATOM 22361 C C . SER D 1 647 ? 48.917 -8.102 3.802 1.00 48.28 ? 647 SER D C 1 +ATOM 22362 O O . SER D 1 647 ? 49.454 -7.861 2.723 1.00 48.57 ? 647 SER D O 1 +ATOM 22363 C CB . SER D 1 647 ? 48.740 -9.720 5.738 1.00 46.08 ? 647 SER D CB 1 +ATOM 22364 O OG . SER D 1 647 ? 47.797 -8.943 6.453 1.00 47.32 ? 647 SER D OG 1 +ATOM 22365 N N . LYS D 1 648 ? 47.675 -7.727 4.094 1.00 48.88 ? 648 LYS D N 1 +ATOM 22366 C CA . LYS D 1 648 ? 46.815 -7.037 3.145 1.00 48.63 ? 648 LYS D CA 1 +ATOM 22367 C C . LYS D 1 648 ? 46.742 -5.540 3.448 1.00 48.56 ? 648 LYS D C 1 +ATOM 22368 O O . LYS D 1 648 ? 46.487 -5.139 4.577 1.00 49.41 ? 648 LYS D O 1 +ATOM 22369 C CB . LYS D 1 648 ? 45.426 -7.669 3.205 1.00 50.30 ? 648 LYS D CB 1 +ATOM 22370 C CG . LYS D 1 648 ? 44.362 -7.101 2.278 1.00 52.10 ? 648 LYS D CG 1 +ATOM 22371 C CD . LYS D 1 648 ? 43.136 -8.022 2.333 1.00 55.71 ? 648 LYS D CD 1 +ATOM 22372 C CE . LYS D 1 648 ? 41.902 -7.417 1.696 1.00 57.94 ? 648 LYS D CE 1 +ATOM 22373 N NZ . LYS D 1 648 ? 41.344 -6.311 2.522 1.00 60.87 ? 648 LYS D NZ 1 +ATOM 22374 N N . LEU D 1 649 ? 46.991 -4.717 2.435 1.00 47.71 ? 649 LEU D N 1 +ATOM 22375 C CA . LEU D 1 649 ? 46.934 -3.271 2.596 1.00 47.00 ? 649 LEU D CA 1 +ATOM 22376 C C . LEU D 1 649 ? 45.755 -2.699 1.812 1.00 46.63 ? 649 LEU D C 1 +ATOM 22377 O O . LEU D 1 649 ? 45.610 -2.956 0.620 1.00 46.75 ? 649 LEU D O 1 +ATOM 22378 C CB . LEU D 1 649 ? 48.230 -2.621 2.095 1.00 46.46 ? 649 LEU D CB 1 +ATOM 22379 C CG . LEU D 1 649 ? 48.196 -1.086 1.970 1.00 46.53 ? 649 LEU D CG 1 +ATOM 22380 C CD1 . LEU D 1 649 ? 48.001 -0.460 3.348 1.00 44.67 ? 649 LEU D CD1 1 +ATOM 22381 C CD2 . LEU D 1 649 ? 49.497 -0.582 1.325 1.00 45.51 ? 649 LEU D CD2 1 +ATOM 22382 N N . THR D 1 650 ? 44.906 -1.931 2.480 1.00 46.02 ? 650 THR D N 1 +ATOM 22383 C CA . THR D 1 650 ? 43.769 -1.333 1.805 1.00 45.84 ? 650 THR D CA 1 +ATOM 22384 C C . THR D 1 650 ? 43.930 0.172 1.805 1.00 46.58 ? 650 THR D C 1 +ATOM 22385 O O . THR D 1 650 ? 44.138 0.794 2.851 1.00 46.76 ? 650 THR D O 1 +ATOM 22386 C CB . THR D 1 650 ? 42.429 -1.682 2.481 1.00 46.23 ? 650 THR D CB 1 +ATOM 22387 O OG1 . THR D 1 650 ? 42.253 -3.107 2.516 1.00 48.11 ? 650 THR D OG1 1 +ATOM 22388 C CG2 . THR D 1 650 ? 41.276 -1.054 1.705 1.00 44.01 ? 650 THR D CG2 1 +ATOM 22389 N N . ILE D 1 651 ? 43.852 0.755 0.619 1.00 46.78 ? 651 ILE D N 1 +ATOM 22390 C CA . ILE D 1 651 ? 43.978 2.189 0.482 1.00 48.33 ? 651 ILE D CA 1 +ATOM 22391 C C . ILE D 1 651 ? 42.677 2.742 -0.080 1.00 49.15 ? 651 ILE D C 1 +ATOM 22392 O O . ILE D 1 651 ? 42.200 2.295 -1.120 1.00 49.53 ? 651 ILE D O 1 +ATOM 22393 C CB . ILE D 1 651 ? 45.141 2.551 -0.461 1.00 48.65 ? 651 ILE D CB 1 +ATOM 22394 C CG1 . ILE D 1 651 ? 46.458 2.038 0.131 1.00 48.99 ? 651 ILE D CG1 1 +ATOM 22395 C CG2 . ILE D 1 651 ? 45.194 4.053 -0.674 1.00 46.10 ? 651 ILE D CG2 1 +ATOM 22396 C CD1 . ILE D 1 651 ? 47.642 2.217 -0.779 1.00 51.82 ? 651 ILE D CD1 1 +ATOM 22397 N N . THR D 1 652 ? 42.074 3.685 0.627 1.00 49.19 ? 652 THR D N 1 +ATOM 22398 C CA . THR D 1 652 ? 40.857 4.279 0.119 1.00 50.09 ? 652 THR D CA 1 +ATOM 22399 C C . THR D 1 652 ? 41.333 5.602 -0.463 1.00 50.69 ? 652 THR D C 1 +ATOM 22400 O O . THR D 1 652 ? 42.115 6.323 0.157 1.00 49.43 ? 652 THR D O 1 +ATOM 22401 C CB . THR D 1 652 ? 39.808 4.509 1.234 1.00 50.32 ? 652 THR D CB 1 +ATOM 22402 O OG1 . THR D 1 652 ? 40.123 5.705 1.940 1.00 52.17 ? 652 THR D OG1 1 +ATOM 22403 C CG2 . THR D 1 652 ? 39.805 3.347 2.225 1.00 49.61 ? 652 THR D CG2 1 +ATOM 22404 N N . SER D 1 653 ? 40.893 5.904 -1.677 1.00 52.96 ? 653 SER D N 1 +ATOM 22405 C CA . SER D 1 653 ? 41.299 7.137 -2.342 1.00 54.94 ? 653 SER D CA 1 +ATOM 22406 C C . SER D 1 653 ? 40.342 7.508 -3.466 1.00 55.87 ? 653 SER D C 1 +ATOM 22407 O O . SER D 1 653 ? 39.824 6.638 -4.170 1.00 54.88 ? 653 SER D O 1 +ATOM 22408 C CB . SER D 1 653 ? 42.715 6.985 -2.910 1.00 55.00 ? 653 SER D CB 1 +ATOM 22409 O OG . SER D 1 653 ? 43.135 8.175 -3.557 1.00 55.22 ? 653 SER D OG 1 +ATOM 22410 N N . GLU D 1 654 ? 40.110 8.808 -3.623 1.00 57.84 ? 654 GLU D N 1 +ATOM 22411 C CA . GLU D 1 654 ? 39.224 9.300 -4.667 1.00 59.91 ? 654 GLU D CA 1 +ATOM 22412 C C . GLU D 1 654 ? 39.969 9.271 -5.995 1.00 60.86 ? 654 GLU D C 1 +ATOM 22413 O O . GLU D 1 654 ? 39.359 9.152 -7.055 1.00 60.95 ? 654 GLU D O 1 +ATOM 22414 C CB . GLU D 1 654 ? 38.753 10.718 -4.339 1.00 60.80 ? 654 GLU D CB 1 +ATOM 22415 C CG . GLU D 1 654 ? 37.907 10.798 -3.072 1.00 63.23 ? 654 GLU D CG 1 +ATOM 22416 C CD . GLU D 1 654 ? 37.370 12.195 -2.798 1.00 65.11 ? 654 GLU D CD 1 +ATOM 22417 O OE1 . GLU D 1 654 ? 36.508 12.675 -3.571 1.00 65.65 ? 654 GLU D OE1 1 +ATOM 22418 O OE2 . GLU D 1 654 ? 37.814 12.817 -1.807 1.00 65.92 ? 654 GLU D OE2 1 +ATOM 22419 N N . LYS D 1 655 ? 41.294 9.383 -5.926 1.00 62.21 ? 655 LYS D N 1 +ATOM 22420 C CA . LYS D 1 655 ? 42.137 9.327 -7.114 1.00 63.41 ? 655 LYS D CA 1 +ATOM 22421 C C . LYS D 1 655 ? 42.608 7.882 -7.244 1.00 64.11 ? 655 LYS D C 1 +ATOM 22422 O O . LYS D 1 655 ? 42.975 7.249 -6.253 1.00 65.50 ? 655 LYS D O 1 +ATOM 22423 C CB . LYS D 1 655 ? 43.335 10.266 -6.971 1.00 64.31 ? 655 LYS D CB 1 +ATOM 22424 C CG . LYS D 1 655 ? 42.931 11.729 -6.851 1.00 66.27 ? 655 LYS D CG 1 +ATOM 22425 C CD . LYS D 1 655 ? 44.130 12.666 -6.799 1.00 67.62 ? 655 LYS D CD 1 +ATOM 22426 C CE . LYS D 1 655 ? 43.667 14.120 -6.724 1.00 69.69 ? 655 LYS D CE 1 +ATOM 22427 N NZ . LYS D 1 655 ? 44.794 15.096 -6.709 1.00 70.99 ? 655 LYS D NZ 1 +ATOM 22428 N N . PRO D 1 656 ? 42.597 7.333 -8.467 1.00 64.24 ? 656 PRO D N 1 +ATOM 22429 C CA . PRO D 1 656 ? 43.025 5.946 -8.690 1.00 63.82 ? 656 PRO D CA 1 +ATOM 22430 C C . PRO D 1 656 ? 44.456 5.609 -8.277 1.00 63.67 ? 656 PRO D C 1 +ATOM 22431 O O . PRO D 1 656 ? 45.362 6.437 -8.360 1.00 63.12 ? 656 PRO D O 1 +ATOM 22432 C CB . PRO D 1 656 ? 42.789 5.750 -10.188 1.00 63.91 ? 656 PRO D CB 1 +ATOM 22433 C CG . PRO D 1 656 ? 43.002 7.128 -10.742 1.00 64.37 ? 656 PRO D CG 1 +ATOM 22434 C CD . PRO D 1 656 ? 42.275 7.997 -9.744 1.00 63.94 ? 656 PRO D CD 1 +ATOM 22435 N N . VAL D 1 657 ? 44.642 4.376 -7.824 1.00 63.72 ? 657 VAL D N 1 +ATOM 22436 C CA . VAL D 1 657 ? 45.951 3.891 -7.410 1.00 63.83 ? 657 VAL D CA 1 +ATOM 22437 C C . VAL D 1 657 ? 46.254 2.663 -8.259 1.00 64.66 ? 657 VAL D C 1 +ATOM 22438 O O . VAL D 1 657 ? 45.610 1.625 -8.111 1.00 64.52 ? 657 VAL D O 1 +ATOM 22439 C CB . VAL D 1 657 ? 45.951 3.488 -5.924 1.00 63.24 ? 657 VAL D CB 1 +ATOM 22440 C CG1 . VAL D 1 657 ? 47.340 3.032 -5.508 1.00 61.80 ? 657 VAL D CG1 1 +ATOM 22441 C CG2 . VAL D 1 657 ? 45.491 4.656 -5.076 1.00 62.16 ? 657 VAL D CG2 1 +ATOM 22442 N N . SER D 1 658 ? 47.231 2.783 -9.152 1.00 65.66 ? 658 SER D N 1 +ATOM 22443 C CA . SER D 1 658 ? 47.587 1.675 -10.033 1.00 66.86 ? 658 SER D CA 1 +ATOM 22444 C C . SER D 1 658 ? 48.596 0.708 -9.425 1.00 66.60 ? 658 SER D C 1 +ATOM 22445 O O . SER D 1 658 ? 48.557 -0.495 -9.696 1.00 66.87 ? 658 SER D O 1 +ATOM 22446 C CB . SER D 1 658 ? 48.137 2.220 -11.348 1.00 67.33 ? 658 SER D CB 1 +ATOM 22447 O OG . SER D 1 658 ? 49.188 3.137 -11.100 1.00 69.36 ? 658 SER D OG 1 +ATOM 22448 N N . LYS D 1 659 ? 49.496 1.227 -8.600 1.00 66.17 ? 659 LYS D N 1 +ATOM 22449 C CA . LYS D 1 659 ? 50.499 0.370 -7.998 1.00 66.63 ? 659 LYS D CA 1 +ATOM 22450 C C . LYS D 1 659 ? 51.132 0.992 -6.773 1.00 66.17 ? 659 LYS D C 1 +ATOM 22451 O O . LYS D 1 659 ? 51.060 2.203 -6.566 1.00 65.75 ? 659 LYS D O 1 +ATOM 22452 C CB . LYS D 1 659 ? 51.602 0.071 -9.016 1.00 67.82 ? 659 LYS D CB 1 +ATOM 22453 C CG . LYS D 1 659 ? 52.381 1.316 -9.447 1.00 68.56 ? 659 LYS D CG 1 +ATOM 22454 C CD . LYS D 1 659 ? 53.520 0.998 -10.412 1.00 69.76 ? 659 LYS D CD 1 +ATOM 22455 C CE . LYS D 1 659 ? 53.018 0.544 -11.783 1.00 71.09 ? 659 LYS D CE 1 +ATOM 22456 N NZ . LYS D 1 659 ? 52.336 -0.787 -11.763 1.00 71.83 ? 659 LYS D NZ 1 +ATOM 22457 N N . ILE D 1 660 ? 51.749 0.138 -5.962 1.00 66.09 ? 660 ILE D N 1 +ATOM 22458 C CA . ILE D 1 660 ? 52.461 0.571 -4.769 1.00 65.20 ? 660 ILE D CA 1 +ATOM 22459 C C . ILE D 1 660 ? 53.883 0.027 -4.903 1.00 65.03 ? 660 ILE D C 1 +ATOM 22460 O O . ILE D 1 660 ? 54.116 -0.971 -5.590 1.00 64.21 ? 660 ILE D O 1 +ATOM 22461 C CB . ILE D 1 660 ? 51.835 0.013 -3.475 1.00 64.88 ? 660 ILE D CB 1 +ATOM 22462 C CG1 . ILE D 1 660 ? 51.875 -1.510 -3.490 1.00 65.11 ? 660 ILE D CG1 1 +ATOM 22463 C CG2 . ILE D 1 660 ? 50.410 0.499 -3.331 1.00 64.09 ? 660 ILE D CG2 1 +ATOM 22464 C CD1 . ILE D 1 660 ? 51.539 -2.126 -2.152 1.00 66.23 ? 660 ILE D CD1 1 +ATOM 22465 N N . ILE D 1 661 ? 54.832 0.687 -4.254 1.00 65.30 ? 661 ILE D N 1 +ATOM 22466 C CA . ILE D 1 661 ? 56.220 0.257 -4.321 1.00 65.51 ? 661 ILE D CA 1 +ATOM 22467 C C . ILE D 1 661 ? 56.788 0.090 -2.917 1.00 66.07 ? 661 ILE D C 1 +ATOM 22468 O O . ILE D 1 661 ? 56.851 1.043 -2.133 1.00 66.34 ? 661 ILE D O 1 +ATOM 22469 C CB . ILE D 1 661 ? 57.075 1.277 -5.103 1.00 65.14 ? 661 ILE D CB 1 +ATOM 22470 C CG1 . ILE D 1 661 ? 56.479 1.475 -6.500 1.00 65.00 ? 661 ILE D CG1 1 +ATOM 22471 C CG2 . ILE D 1 661 ? 58.515 0.794 -5.196 1.00 63.52 ? 661 ILE D CG2 1 +ATOM 22472 C CD1 . ILE D 1 661 ? 57.077 2.638 -7.263 1.00 66.36 ? 661 ILE D CD1 1 +ATOM 22473 N N . VAL D 1 662 ? 57.198 -1.131 -2.607 1.00 65.89 ? 662 VAL D N 1 +ATOM 22474 C CA . VAL D 1 662 ? 57.763 -1.430 -1.304 1.00 66.46 ? 662 VAL D CA 1 +ATOM 22475 C C . VAL D 1 662 ? 59.260 -1.135 -1.247 1.00 67.82 ? 662 VAL D C 1 +ATOM 22476 O O . VAL D 1 662 ? 60.055 -1.770 -1.937 1.00 68.04 ? 662 VAL D O 1 +ATOM 22477 C CB . VAL D 1 662 ? 57.537 -2.903 -0.943 1.00 65.90 ? 662 VAL D CB 1 +ATOM 22478 C CG1 . VAL D 1 662 ? 58.173 -3.214 0.399 1.00 66.06 ? 662 VAL D CG1 1 +ATOM 22479 C CG2 . VAL D 1 662 ? 56.048 -3.201 -0.909 1.00 66.34 ? 662 VAL D CG2 1 +ATOM 22480 N N . ASP D 1 663 ? 59.630 -0.161 -0.420 1.00 69.76 ? 663 ASP D N 1 +ATOM 22481 C CA . ASP D 1 663 ? 61.024 0.234 -0.225 1.00 71.23 ? 663 ASP D CA 1 +ATOM 22482 C C . ASP D 1 663 ? 61.791 0.583 -1.505 1.00 71.73 ? 663 ASP D C 1 +ATOM 22483 O O . ASP D 1 663 ? 62.976 0.267 -1.625 1.00 71.60 ? 663 ASP D O 1 +ATOM 22484 C CB . ASP D 1 663 ? 61.784 -0.865 0.533 1.00 71.95 ? 663 ASP D CB 1 +ATOM 22485 C CG . ASP D 1 663 ? 61.212 -1.134 1.921 1.00 72.82 ? 663 ASP D CG 1 +ATOM 22486 O OD1 . ASP D 1 663 ? 61.106 -0.181 2.727 1.00 72.25 ? 663 ASP D OD1 1 +ATOM 22487 O OD2 . ASP D 1 663 ? 60.881 -2.310 2.202 1.00 73.56 ? 663 ASP D OD2 1 +ATOM 22488 N N . ASP D 1 664 ? 61.111 1.224 -2.456 1.00 72.38 ? 664 ASP D N 1 +ATOM 22489 C CA . ASP D 1 664 ? 61.721 1.654 -3.718 1.00 72.79 ? 664 ASP D CA 1 +ATOM 22490 C C . ASP D 1 664 ? 61.966 0.568 -4.768 1.00 73.13 ? 664 ASP D C 1 +ATOM 22491 O O . ASP D 1 664 ? 62.127 0.876 -5.946 1.00 73.63 ? 664 ASP D O 1 +ATOM 22492 C CB . ASP D 1 664 ? 63.055 2.359 -3.449 1.00 73.33 ? 664 ASP D CB 1 +ATOM 22493 C CG . ASP D 1 664 ? 62.960 3.400 -2.353 1.00 74.35 ? 664 ASP D CG 1 +ATOM 22494 O OD1 . ASP D 1 664 ? 62.206 4.384 -2.517 1.00 75.63 ? 664 ASP D OD1 1 +ATOM 22495 O OD2 . ASP D 1 664 ? 63.646 3.234 -1.322 1.00 74.53 ? 664 ASP D OD2 1 +ATOM 22496 N N . SER D 1 665 ? 61.995 -0.694 -4.359 1.00 73.27 ? 665 SER D N 1 +ATOM 22497 C CA . SER D 1 665 ? 62.259 -1.769 -5.309 1.00 73.35 ? 665 SER D CA 1 +ATOM 22498 C C . SER D 1 665 ? 61.054 -2.579 -5.784 1.00 73.78 ? 665 SER D C 1 +ATOM 22499 O O . SER D 1 665 ? 60.598 -2.412 -6.914 1.00 74.54 ? 665 SER D O 1 +ATOM 22500 C CB . SER D 1 665 ? 63.313 -2.720 -4.733 1.00 73.09 ? 665 SER D CB 1 +ATOM 22501 O OG . SER D 1 665 ? 62.917 -3.216 -3.466 1.00 72.72 ? 665 SER D OG 1 +ATOM 22502 N N . LYS D 1 666 ? 60.545 -3.455 -4.923 1.00 73.94 ? 666 LYS D N 1 +ATOM 22503 C CA . LYS D 1 666 ? 59.422 -4.317 -5.272 1.00 73.74 ? 666 LYS D CA 1 +ATOM 22504 C C . LYS D 1 666 ? 58.081 -3.622 -5.484 1.00 73.16 ? 666 LYS D C 1 +ATOM 22505 O O . LYS D 1 666 ? 57.689 -2.746 -4.718 1.00 73.85 ? 666 LYS D O 1 +ATOM 22506 C CB . LYS D 1 666 ? 59.260 -5.411 -4.215 1.00 74.29 ? 666 LYS D CB 1 +ATOM 22507 C CG . LYS D 1 666 ? 58.144 -6.410 -4.511 1.00 76.34 ? 666 LYS D CG 1 +ATOM 22508 C CD . LYS D 1 666 ? 58.477 -7.359 -5.674 1.00 77.75 ? 666 LYS D CD 1 +ATOM 22509 C CE . LYS D 1 666 ? 58.272 -6.734 -7.048 1.00 78.40 ? 666 LYS D CE 1 +ATOM 22510 N NZ . LYS D 1 666 ? 58.603 -7.687 -8.149 1.00 78.42 ? 666 LYS D NZ 1 +ATOM 22511 N N . GLU D 1 667 ? 57.384 -4.031 -6.538 1.00 72.65 ? 667 GLU D N 1 +ATOM 22512 C CA . GLU D 1 667 ? 56.076 -3.488 -6.873 1.00 72.66 ? 667 GLU D CA 1 +ATOM 22513 C C . GLU D 1 667 ? 55.005 -4.550 -6.637 1.00 72.40 ? 667 GLU D C 1 +ATOM 22514 O O . GLU D 1 667 ? 55.125 -5.689 -7.108 1.00 71.96 ? 667 GLU D O 1 +ATOM 22515 C CB . GLU D 1 667 ? 56.033 -3.056 -8.336 1.00 73.97 ? 667 GLU D CB 1 +ATOM 22516 C CG . GLU D 1 667 ? 56.901 -1.857 -8.681 1.00 76.56 ? 667 GLU D CG 1 +ATOM 22517 C CD . GLU D 1 667 ? 56.679 -1.392 -10.113 1.00 77.58 ? 667 GLU D CD 1 +ATOM 22518 O OE1 . GLU D 1 667 ? 56.820 -2.230 -11.029 1.00 78.45 ? 667 GLU D OE1 1 +ATOM 22519 O OE2 . GLU D 1 667 ? 56.361 -0.198 -10.323 1.00 77.88 ? 667 GLU D OE2 1 +ATOM 22520 N N . ILE D 1 668 ? 53.957 -4.174 -5.911 1.00 71.04 ? 668 ILE D N 1 +ATOM 22521 C CA . ILE D 1 668 ? 52.875 -5.099 -5.612 1.00 69.42 ? 668 ILE D CA 1 +ATOM 22522 C C . ILE D 1 668 ? 51.609 -4.752 -6.392 1.00 68.65 ? 668 ILE D C 1 +ATOM 22523 O O . ILE D 1 668 ? 51.223 -3.584 -6.510 1.00 67.84 ? 668 ILE D O 1 +ATOM 22524 C CB . ILE D 1 668 ? 52.559 -5.114 -4.099 1.00 69.79 ? 668 ILE D CB 1 +ATOM 22525 C CG1 . ILE D 1 668 ? 53.833 -5.416 -3.303 1.00 69.51 ? 668 ILE D CG1 1 +ATOM 22526 C CG2 . ILE D 1 668 ? 51.496 -6.168 -3.795 1.00 69.23 ? 668 ILE D CG2 1 +ATOM 22527 C CD1 . ILE D 1 668 ? 54.427 -6.799 -3.566 1.00 70.35 ? 668 ILE D CD1 1 +ATOM 22528 N N . GLN D 1 669 ? 50.973 -5.792 -6.922 1.00 67.67 ? 669 GLN D N 1 +ATOM 22529 C CA . GLN D 1 669 ? 49.758 -5.661 -7.709 1.00 66.29 ? 669 GLN D CA 1 +ATOM 22530 C C . GLN D 1 669 ? 48.614 -5.049 -6.908 1.00 65.25 ? 669 GLN D C 1 +ATOM 22531 O O . GLN D 1 669 ? 48.238 -5.553 -5.849 1.00 64.93 ? 669 GLN D O 1 +ATOM 22532 C CB . GLN D 1 669 ? 49.341 -7.036 -8.237 1.00 66.51 ? 669 GLN D CB 1 +ATOM 22533 C CG . GLN D 1 669 ? 48.833 -7.028 -9.673 1.00 68.68 ? 669 GLN D CG 1 +ATOM 22534 C CD . GLN D 1 669 ? 49.892 -6.561 -10.684 1.00 69.33 ? 669 GLN D CD 1 +ATOM 22535 O OE1 . GLN D 1 669 ? 49.676 -6.620 -11.896 1.00 67.25 ? 669 GLN D OE1 1 +ATOM 22536 N NE2 . GLN D 1 669 ? 51.037 -6.092 -10.183 1.00 69.27 ? 669 GLN D NE2 1 +ATOM 22537 N N . VAL D 1 670 ? 48.070 -3.952 -7.422 1.00 63.82 ? 670 VAL D N 1 +ATOM 22538 C CA . VAL D 1 670 ? 46.959 -3.274 -6.774 1.00 62.28 ? 670 VAL D CA 1 +ATOM 22539 C C . VAL D 1 670 ? 45.663 -3.689 -7.452 1.00 61.65 ? 670 VAL D C 1 +ATOM 22540 O O . VAL D 1 670 ? 45.619 -3.883 -8.668 1.00 61.87 ? 670 VAL D O 1 +ATOM 22541 C CB . VAL D 1 670 ? 47.094 -1.748 -6.878 1.00 62.40 ? 670 VAL D CB 1 +ATOM 22542 C CG1 . VAL D 1 670 ? 45.843 -1.086 -6.337 1.00 62.68 ? 670 VAL D CG1 1 +ATOM 22543 C CG2 . VAL D 1 670 ? 48.317 -1.277 -6.106 1.00 63.42 ? 670 VAL D CG2 1 +ATOM 22544 N N . GLU D 1 671 ? 44.606 -3.821 -6.663 1.00 60.66 ? 671 GLU D N 1 +ATOM 22545 C CA . GLU D 1 671 ? 43.310 -4.220 -7.196 1.00 59.47 ? 671 GLU D CA 1 +ATOM 22546 C C . GLU D 1 671 ? 42.161 -3.369 -6.652 1.00 57.47 ? 671 GLU D C 1 +ATOM 22547 O O . GLU D 1 671 ? 41.993 -3.224 -5.440 1.00 56.85 ? 671 GLU D O 1 +ATOM 22548 C CB . GLU D 1 671 ? 43.060 -5.696 -6.879 1.00 60.55 ? 671 GLU D CB 1 +ATOM 22549 C CG . GLU D 1 671 ? 41.693 -6.224 -7.277 1.00 63.41 ? 671 GLU D CG 1 +ATOM 22550 C CD . GLU D 1 671 ? 41.536 -7.711 -6.959 1.00 66.70 ? 671 GLU D CD 1 +ATOM 22551 O OE1 . GLU D 1 671 ? 42.351 -8.524 -7.463 1.00 68.06 ? 671 GLU D OE1 1 +ATOM 22552 O OE2 . GLU D 1 671 ? 40.600 -8.069 -6.207 1.00 65.99 ? 671 GLU D OE2 1 +ATOM 22553 N N . LYS D 1 672 ? 41.389 -2.792 -7.565 1.00 54.98 ? 672 LYS D N 1 +ATOM 22554 C CA . LYS D 1 672 ? 40.228 -1.990 -7.208 1.00 53.15 ? 672 LYS D CA 1 +ATOM 22555 C C . LYS D 1 672 ? 39.136 -2.991 -6.824 1.00 51.98 ? 672 LYS D C 1 +ATOM 22556 O O . LYS D 1 672 ? 38.651 -3.733 -7.677 1.00 51.89 ? 672 LYS D O 1 +ATOM 22557 C CB . LYS D 1 672 ? 39.782 -1.171 -8.415 1.00 52.97 ? 672 LYS D CB 1 +ATOM 22558 C CG . LYS D 1 672 ? 38.337 -0.725 -8.351 1.00 53.13 ? 672 LYS D CG 1 +ATOM 22559 C CD . LYS D 1 672 ? 38.186 0.706 -7.864 1.00 53.86 ? 672 LYS D CD 1 +ATOM 22560 C CE . LYS D 1 672 ? 38.432 1.702 -8.979 1.00 51.95 ? 672 LYS D CE 1 +ATOM 22561 N NZ . LYS D 1 672 ? 37.910 3.047 -8.615 1.00 53.42 ? 672 LYS D NZ 1 +ATOM 22562 N N . THR D 1 673 ? 38.763 -3.028 -5.547 1.00 50.37 ? 673 THR D N 1 +ATOM 22563 C CA . THR D 1 673 ? 37.743 -3.968 -5.091 1.00 48.87 ? 673 THR D CA 1 +ATOM 22564 C C . THR D 1 673 ? 36.343 -3.363 -5.124 1.00 47.99 ? 673 THR D C 1 +ATOM 22565 O O . THR D 1 673 ? 35.347 -4.079 -5.255 1.00 47.04 ? 673 THR D O 1 +ATOM 22566 C CB . THR D 1 673 ? 38.040 -4.466 -3.662 1.00 48.50 ? 673 THR D CB 1 +ATOM 22567 O OG1 . THR D 1 673 ? 38.201 -3.347 -2.784 1.00 50.68 ? 673 THR D OG1 1 +ATOM 22568 C CG2 . THR D 1 673 ? 39.303 -5.291 -3.641 1.00 48.08 ? 673 THR D CG2 1 +ATOM 22569 N N . MET D 1 674 ? 36.278 -2.042 -4.994 1.00 47.17 ? 674 MET D N 1 +ATOM 22570 C CA . MET D 1 674 ? 35.018 -1.308 -5.021 1.00 45.72 ? 674 MET D CA 1 +ATOM 22571 C C . MET D 1 674 ? 35.354 0.172 -5.104 1.00 45.24 ? 674 MET D C 1 +ATOM 22572 O O . MET D 1 674 ? 36.525 0.545 -5.052 1.00 44.85 ? 674 MET D O 1 +ATOM 22573 C CB . MET D 1 674 ? 34.172 -1.611 -3.781 1.00 46.23 ? 674 MET D CB 1 +ATOM 22574 C CG . MET D 1 674 ? 34.738 -1.134 -2.453 1.00 47.21 ? 674 MET D CG 1 +ATOM 22575 S SD . MET D 1 674 ? 33.720 -1.731 -1.077 1.00 49.80 ? 674 MET D SD 1 +ATOM 22576 C CE . MET D 1 674 ? 34.762 -1.283 0.342 1.00 50.72 ? 674 MET D CE 1 +ATOM 22577 N N . GLN D 1 675 ? 34.340 1.017 -5.243 1.00 44.22 ? 675 GLN D N 1 +ATOM 22578 C CA . GLN D 1 675 ? 34.593 2.441 -5.370 1.00 44.04 ? 675 GLN D CA 1 +ATOM 22579 C C . GLN D 1 675 ? 35.555 2.981 -4.305 1.00 44.23 ? 675 GLN D C 1 +ATOM 22580 O O . GLN D 1 675 ? 35.420 2.684 -3.117 1.00 44.80 ? 675 GLN D O 1 +ATOM 22581 C CB . GLN D 1 675 ? 33.265 3.200 -5.328 1.00 44.46 ? 675 GLN D CB 1 +ATOM 22582 C CG . GLN D 1 675 ? 32.583 3.191 -3.978 1.00 44.95 ? 675 GLN D CG 1 +ATOM 22583 C CD . GLN D 1 675 ? 31.177 3.750 -4.036 1.00 43.62 ? 675 GLN D CD 1 +ATOM 22584 O OE1 . GLN D 1 675 ? 30.914 4.739 -4.726 1.00 43.62 ? 675 GLN D OE1 1 +ATOM 22585 N NE2 . GLN D 1 675 ? 30.266 3.127 -3.299 1.00 41.13 ? 675 GLN D NE2 1 +ATOM 22586 N N . ASN D 1 676 ? 36.540 3.756 -4.748 1.00 43.94 ? 676 ASN D N 1 +ATOM 22587 C CA . ASN D 1 676 ? 37.526 4.371 -3.860 1.00 44.48 ? 676 ASN D CA 1 +ATOM 22588 C C . ASN D 1 676 ? 38.354 3.386 -3.046 1.00 45.29 ? 676 ASN D C 1 +ATOM 22589 O O . ASN D 1 676 ? 39.108 3.790 -2.166 1.00 45.81 ? 676 ASN D O 1 +ATOM 22590 C CB . ASN D 1 676 ? 36.828 5.312 -2.879 1.00 45.47 ? 676 ASN D CB 1 +ATOM 22591 C CG . ASN D 1 676 ? 35.923 6.299 -3.563 1.00 45.98 ? 676 ASN D CG 1 +ATOM 22592 O OD1 . ASN D 1 676 ? 36.369 7.094 -4.396 1.00 46.95 ? 676 ASN D OD1 1 +ATOM 22593 N ND2 . ASN D 1 676 ? 34.637 6.263 -3.213 1.00 45.82 ? 676 ASN D ND2 1 +ATOM 22594 N N . THR D 1 677 ? 38.224 2.100 -3.332 1.00 45.70 ? 677 THR D N 1 +ATOM 22595 C CA . THR D 1 677 ? 38.941 1.098 -2.562 1.00 45.70 ? 677 THR D CA 1 +ATOM 22596 C C . THR D 1 677 ? 39.949 0.279 -3.363 1.00 47.23 ? 677 THR D C 1 +ATOM 22597 O O . THR D 1 677 ? 39.579 -0.466 -4.276 1.00 47.35 ? 677 THR D O 1 +ATOM 22598 C CB . THR D 1 677 ? 37.942 0.139 -1.910 1.00 46.30 ? 677 THR D CB 1 +ATOM 22599 O OG1 . THR D 1 677 ? 36.868 0.902 -1.346 1.00 47.90 ? 677 THR D OG1 1 +ATOM 22600 C CG2 . THR D 1 677 ? 38.614 -0.690 -0.812 1.00 45.04 ? 677 THR D CG2 1 +ATOM 22601 N N . TYR D 1 678 ? 41.219 0.401 -2.988 1.00 46.83 ? 678 TYR D N 1 +ATOM 22602 C CA . TYR D 1 678 ? 42.298 -0.316 -3.649 1.00 47.56 ? 678 TYR D CA 1 +ATOM 22603 C C . TYR D 1 678 ? 43.020 -1.253 -2.683 1.00 48.43 ? 678 TYR D C 1 +ATOM 22604 O O . TYR D 1 678 ? 43.411 -0.852 -1.588 1.00 49.42 ? 678 TYR D O 1 +ATOM 22605 C CB . TYR D 1 678 ? 43.259 0.698 -4.245 1.00 48.56 ? 678 TYR D CB 1 +ATOM 22606 C CG . TYR D 1 678 ? 42.558 1.621 -5.207 1.00 50.16 ? 678 TYR D CG 1 +ATOM 22607 C CD1 . TYR D 1 678 ? 42.218 1.188 -6.488 1.00 50.75 ? 678 TYR D CD1 1 +ATOM 22608 C CD2 . TYR D 1 678 ? 42.186 2.908 -4.822 1.00 49.92 ? 678 TYR D CD2 1 +ATOM 22609 C CE1 . TYR D 1 678 ? 41.526 2.013 -7.362 1.00 52.07 ? 678 TYR D CE1 1 +ATOM 22610 C CE2 . TYR D 1 678 ? 41.494 3.742 -5.682 1.00 51.41 ? 678 TYR D CE2 1 +ATOM 22611 C CZ . TYR D 1 678 ? 41.166 3.291 -6.952 1.00 52.74 ? 678 TYR D CZ 1 +ATOM 22612 O OH . TYR D 1 678 ? 40.475 4.120 -7.806 1.00 53.06 ? 678 TYR D OH 1 +ATOM 22613 N N . VAL D 1 679 ? 43.194 -2.505 -3.096 1.00 48.50 ? 679 VAL D N 1 +ATOM 22614 C CA . VAL D 1 679 ? 43.838 -3.513 -2.266 1.00 48.11 ? 679 VAL D CA 1 +ATOM 22615 C C . VAL D 1 679 ? 45.142 -4.068 -2.837 1.00 49.74 ? 679 VAL D C 1 +ATOM 22616 O O . VAL D 1 679 ? 45.269 -4.317 -4.036 1.00 49.97 ? 679 VAL D O 1 +ATOM 22617 C CB . VAL D 1 679 ? 42.887 -4.686 -2.024 1.00 46.98 ? 679 VAL D CB 1 +ATOM 22618 C CG1 . VAL D 1 679 ? 43.565 -5.738 -1.178 1.00 48.02 ? 679 VAL D CG1 1 +ATOM 22619 C CG2 . VAL D 1 679 ? 41.631 -4.191 -1.348 1.00 47.84 ? 679 VAL D CG2 1 +ATOM 22620 N N . ALA D 1 680 ? 46.108 -4.275 -1.954 1.00 50.70 ? 680 ALA D N 1 +ATOM 22621 C CA . ALA D 1 680 ? 47.401 -4.811 -2.341 1.00 51.23 ? 680 ALA D CA 1 +ATOM 22622 C C . ALA D 1 680 ? 47.770 -5.941 -1.387 1.00 52.63 ? 680 ALA D C 1 +ATOM 22623 O O . ALA D 1 680 ? 47.892 -5.720 -0.181 1.00 53.31 ? 680 ALA D O 1 +ATOM 22624 C CB . ALA D 1 680 ? 48.448 -3.716 -2.278 1.00 50.03 ? 680 ALA D CB 1 +ATOM 22625 N N . LYS D 1 681 ? 47.923 -7.151 -1.917 1.00 53.58 ? 681 LYS D N 1 +ATOM 22626 C CA . LYS D 1 681 ? 48.310 -8.304 -1.099 1.00 54.70 ? 681 LYS D CA 1 +ATOM 22627 C C . LYS D 1 681 ? 49.840 -8.284 -0.988 1.00 54.75 ? 681 LYS D C 1 +ATOM 22628 O O . LYS D 1 681 ? 50.534 -8.836 -1.836 1.00 54.68 ? 681 LYS D O 1 +ATOM 22629 C CB . LYS D 1 681 ? 47.884 -9.604 -1.774 1.00 55.90 ? 681 LYS D CB 1 +ATOM 22630 C CG . LYS D 1 681 ? 46.441 -9.658 -2.222 1.00 58.66 ? 681 LYS D CG 1 +ATOM 22631 C CD . LYS D 1 681 ? 45.498 -9.958 -1.077 1.00 61.83 ? 681 LYS D CD 1 +ATOM 22632 C CE . LYS D 1 681 ? 44.107 -10.343 -1.602 1.00 64.22 ? 681 LYS D CE 1 +ATOM 22633 N NZ . LYS D 1 681 ? 43.151 -10.733 -0.514 1.00 65.80 ? 681 LYS D NZ 1 +ATOM 22634 N N . ILE D 1 682 ? 50.360 -7.648 0.056 1.00 54.68 ? 682 ILE D N 1 +ATOM 22635 C CA . ILE D 1 682 ? 51.802 -7.540 0.249 1.00 54.84 ? 682 ILE D CA 1 +ATOM 22636 C C . ILE D 1 682 ? 52.448 -8.783 0.859 1.00 55.18 ? 682 ILE D C 1 +ATOM 22637 O O . ILE D 1 682 ? 53.436 -9.292 0.338 1.00 55.26 ? 682 ILE D O 1 +ATOM 22638 C CB . ILE D 1 682 ? 52.129 -6.314 1.117 1.00 54.35 ? 682 ILE D CB 1 +ATOM 22639 C CG1 . ILE D 1 682 ? 51.633 -5.052 0.405 1.00 52.39 ? 682 ILE D CG1 1 +ATOM 22640 C CG2 . ILE D 1 682 ? 53.625 -6.241 1.381 1.00 52.58 ? 682 ILE D CG2 1 +ATOM 22641 C CD1 . ILE D 1 682 ? 51.809 -3.785 1.199 1.00 53.45 ? 682 ILE D CD1 1 +ATOM 22642 N N . ASN D 1 683 ? 51.892 -9.262 1.964 1.00 56.11 ? 683 ASN D N 1 +ATOM 22643 C CA . ASN D 1 683 ? 52.403 -10.452 2.644 1.00 57.55 ? 683 ASN D CA 1 +ATOM 22644 C C . ASN D 1 683 ? 53.924 -10.541 2.736 1.00 58.22 ? 683 ASN D C 1 +ATOM 22645 O O . ASN D 1 683 ? 54.524 -11.511 2.275 1.00 58.19 ? 683 ASN D O 1 +ATOM 22646 C CB . ASN D 1 683 ? 51.870 -11.712 1.966 1.00 57.36 ? 683 ASN D CB 1 +ATOM 22647 C CG . ASN D 1 683 ? 50.354 -11.769 1.958 1.00 58.82 ? 683 ASN D CG 1 +ATOM 22648 O OD1 . ASN D 1 683 ? 49.710 -11.656 3.005 1.00 58.19 ? 683 ASN D OD1 1 +ATOM 22649 N ND2 . ASN D 1 683 ? 49.776 -11.948 0.776 1.00 58.78 ? 683 ASN D ND2 1 +ATOM 22650 N N . GLN D 1 684 ? 54.544 -9.528 3.331 1.00 58.61 ? 684 GLN D N 1 +ATOM 22651 C CA . GLN D 1 684 ? 55.986 -9.521 3.494 1.00 58.95 ? 684 GLN D CA 1 +ATOM 22652 C C . GLN D 1 684 ? 56.405 -8.381 4.400 1.00 59.14 ? 684 GLN D C 1 +ATOM 22653 O O . GLN D 1 684 ? 55.662 -7.418 4.578 1.00 59.24 ? 684 GLN D O 1 +ATOM 22654 C CB . GLN D 1 684 ? 56.672 -9.380 2.141 1.00 59.51 ? 684 GLN D CB 1 +ATOM 22655 C CG . GLN D 1 684 ? 56.588 -7.999 1.546 1.00 60.35 ? 684 GLN D CG 1 +ATOM 22656 C CD . GLN D 1 684 ? 57.396 -7.876 0.264 1.00 61.18 ? 684 GLN D CD 1 +ATOM 22657 O OE1 . GLN D 1 684 ? 57.102 -8.536 -0.737 1.00 58.97 ? 684 GLN D OE1 1 +ATOM 22658 N NE2 . GLN D 1 684 ? 58.425 -7.029 0.291 1.00 62.12 ? 684 GLN D NE2 1 +ATOM 22659 N N . LYS D 1 685 ? 57.596 -8.492 4.978 1.00 59.18 ? 685 LYS D N 1 +ATOM 22660 C CA . LYS D 1 685 ? 58.094 -7.452 5.862 1.00 60.20 ? 685 LYS D CA 1 +ATOM 22661 C C . LYS D 1 685 ? 58.448 -6.199 5.077 1.00 59.61 ? 685 LYS D C 1 +ATOM 22662 O O . LYS D 1 685 ? 58.839 -6.273 3.917 1.00 59.82 ? 685 LYS D O 1 +ATOM 22663 C CB . LYS D 1 685 ? 59.318 -7.947 6.640 1.00 61.87 ? 685 LYS D CB 1 +ATOM 22664 C CG . LYS D 1 685 ? 58.999 -9.040 7.651 1.00 64.65 ? 685 LYS D CG 1 +ATOM 22665 C CD . LYS D 1 685 ? 60.150 -9.267 8.633 1.00 67.76 ? 685 LYS D CD 1 +ATOM 22666 C CE . LYS D 1 685 ? 61.395 -9.813 7.940 1.00 68.96 ? 685 LYS D CE 1 +ATOM 22667 N NZ . LYS D 1 685 ? 61.161 -11.161 7.343 1.00 70.46 ? 685 LYS D NZ 1 +ATOM 22668 N N . ILE D 1 686 ? 58.302 -5.046 5.716 1.00 60.17 ? 686 ILE D N 1 +ATOM 22669 C CA . ILE D 1 686 ? 58.612 -3.780 5.072 1.00 61.02 ? 686 ILE D CA 1 +ATOM 22670 C C . ILE D 1 686 ? 59.651 -3.029 5.890 1.00 62.12 ? 686 ILE D C 1 +ATOM 22671 O O . ILE D 1 686 ? 59.416 -2.691 7.051 1.00 63.03 ? 686 ILE D O 1 +ATOM 22672 C CB . ILE D 1 686 ? 57.338 -2.927 4.912 1.00 60.78 ? 686 ILE D CB 1 +ATOM 22673 C CG1 . ILE D 1 686 ? 56.350 -3.677 4.013 1.00 61.44 ? 686 ILE D CG1 1 +ATOM 22674 C CG2 . ILE D 1 686 ? 57.677 -1.566 4.321 1.00 59.13 ? 686 ILE D CG2 1 +ATOM 22675 C CD1 . ILE D 1 686 ? 55.026 -2.996 3.848 1.00 62.14 ? 686 ILE D CD1 1 +ATOM 22676 N N . ARG D 1 687 ? 60.805 -2.786 5.276 1.00 63.17 ? 687 ARG D N 1 +ATOM 22677 C CA . ARG D 1 687 ? 61.902 -2.084 5.929 1.00 64.07 ? 687 ARG D CA 1 +ATOM 22678 C C . ARG D 1 687 ? 61.484 -0.731 6.494 1.00 62.04 ? 687 ARG D C 1 +ATOM 22679 O O . ARG D 1 687 ? 61.661 -0.471 7.685 1.00 61.33 ? 687 ARG D O 1 +ATOM 22680 C CB . ARG D 1 687 ? 63.066 -1.868 4.951 1.00 67.51 ? 687 ARG D CB 1 +ATOM 22681 C CG . ARG D 1 687 ? 63.558 -3.118 4.242 1.00 72.24 ? 687 ARG D CG 1 +ATOM 22682 C CD . ARG D 1 687 ? 64.881 -2.855 3.525 1.00 76.54 ? 687 ARG D CD 1 +ATOM 22683 N NE . ARG D 1 687 ? 65.996 -2.769 4.470 1.00 81.07 ? 687 ARG D NE 1 +ATOM 22684 C CZ . ARG D 1 687 ? 67.273 -2.601 4.125 1.00 82.72 ? 687 ARG D CZ 1 +ATOM 22685 N NH1 . ARG D 1 687 ? 67.616 -2.492 2.845 1.00 83.14 ? 687 ARG D NH1 1 +ATOM 22686 N NH2 . ARG D 1 687 ? 68.212 -2.559 5.064 1.00 82.70 ? 687 ARG D NH2 1 +ATOM 22687 N N . GLY D 1 688 ? 60.933 0.132 5.643 1.00 60.56 ? 688 GLY D N 1 +ATOM 22688 C CA . GLY D 1 688 ? 60.547 1.443 6.123 1.00 59.44 ? 688 GLY D CA 1 +ATOM 22689 C C . GLY D 1 688 ? 59.541 2.263 5.343 1.00 59.45 ? 688 GLY D C 1 +ATOM 22690 O O . GLY D 1 688 ? 59.105 3.293 5.849 1.00 60.26 ? 688 GLY D O 1 +ATOM 22691 N N . LYS D 1 689 ? 59.163 1.861 4.133 1.00 59.69 ? 689 LYS D N 1 +ATOM 22692 C CA . LYS D 1 689 ? 58.185 2.664 3.397 1.00 59.63 ? 689 LYS D CA 1 +ATOM 22693 C C . LYS D 1 689 ? 57.497 2.024 2.195 1.00 59.31 ? 689 LYS D C 1 +ATOM 22694 O O . LYS D 1 689 ? 57.954 1.029 1.646 1.00 58.16 ? 689 LYS D O 1 +ATOM 22695 C CB . LYS D 1 689 ? 58.815 3.983 2.944 1.00 59.85 ? 689 LYS D CB 1 +ATOM 22696 C CG . LYS D 1 689 ? 59.631 3.894 1.672 1.00 60.84 ? 689 LYS D CG 1 +ATOM 22697 C CD . LYS D 1 689 ? 59.956 5.292 1.167 1.00 63.53 ? 689 LYS D CD 1 +ATOM 22698 C CE . LYS D 1 689 ? 60.579 5.260 -0.219 1.00 65.41 ? 689 LYS D CE 1 +ATOM 22699 N NZ . LYS D 1 689 ? 60.829 6.633 -0.753 1.00 66.65 ? 689 LYS D NZ 1 +ATOM 22700 N N . ILE D 1 690 ? 56.381 2.635 1.807 1.00 59.75 ? 690 ILE D N 1 +ATOM 22701 C CA . ILE D 1 690 ? 55.572 2.215 0.672 1.00 59.40 ? 690 ILE D CA 1 +ATOM 22702 C C . ILE D 1 690 ? 55.159 3.480 -0.074 1.00 60.17 ? 690 ILE D C 1 +ATOM 22703 O O . ILE D 1 690 ? 54.765 4.467 0.542 1.00 59.29 ? 690 ILE D O 1 +ATOM 22704 C CB . ILE D 1 690 ? 54.281 1.492 1.126 1.00 58.96 ? 690 ILE D CB 1 +ATOM 22705 C CG1 . ILE D 1 690 ? 54.627 0.211 1.875 1.00 58.77 ? 690 ILE D CG1 1 +ATOM 22706 C CG2 . ILE D 1 690 ? 53.410 1.161 -0.074 1.00 57.49 ? 690 ILE D CG2 1 +ATOM 22707 C CD1 . ILE D 1 690 ? 53.408 -0.514 2.410 1.00 58.68 ? 690 ILE D CD1 1 +ATOM 22708 N N . ASN D 1 691 ? 55.259 3.455 -1.399 1.00 62.42 ? 691 ASN D N 1 +ATOM 22709 C CA . ASN D 1 691 ? 54.863 4.604 -2.206 1.00 64.16 ? 691 ASN D CA 1 +ATOM 22710 C C . ASN D 1 691 ? 53.672 4.243 -3.072 1.00 65.28 ? 691 ASN D C 1 +ATOM 22711 O O . ASN D 1 691 ? 53.519 3.094 -3.484 1.00 64.61 ? 691 ASN D O 1 +ATOM 22712 C CB . ASN D 1 691 ? 56.019 5.085 -3.086 1.00 63.70 ? 691 ASN D CB 1 +ATOM 22713 C CG . ASN D 1 691 ? 57.131 5.728 -2.280 1.00 65.07 ? 691 ASN D CG 1 +ATOM 22714 O OD1 . ASN D 1 691 ? 57.955 5.037 -1.670 1.00 65.43 ? 691 ASN D OD1 1 +ATOM 22715 N ND2 . ASN D 1 691 ? 57.149 7.060 -2.252 1.00 64.92 ? 691 ASN D ND2 1 +ATOM 22716 N N . LEU D 1 692 ? 52.822 5.230 -3.333 1.00 67.66 ? 692 LEU D N 1 +ATOM 22717 C CA . LEU D 1 692 ? 51.634 5.021 -4.148 1.00 70.52 ? 692 LEU D CA 1 +ATOM 22718 C C . LEU D 1 692 ? 51.752 5.739 -5.484 1.00 72.45 ? 692 LEU D C 1 +ATOM 22719 O O . LEU D 1 692 ? 52.319 6.830 -5.563 1.00 72.48 ? 692 LEU D O 1 +ATOM 22720 C CB . LEU D 1 692 ? 50.386 5.513 -3.406 1.00 70.57 ? 692 LEU D CB 1 +ATOM 22721 C CG . LEU D 1 692 ? 49.829 4.644 -2.270 1.00 70.42 ? 692 LEU D CG 1 +ATOM 22722 C CD1 . LEU D 1 692 ? 50.886 4.398 -1.210 1.00 70.13 ? 692 LEU D CD1 1 +ATOM 22723 C CD2 . LEU D 1 692 ? 48.626 5.342 -1.668 1.00 70.99 ? 692 LEU D CD2 1 +ATOM 22724 N N . GLU D 1 693 ? 51.211 5.117 -6.530 1.00 74.87 ? 693 GLU D N 1 +ATOM 22725 C CA . GLU D 1 693 ? 51.243 5.683 -7.876 1.00 77.26 ? 693 GLU D CA 1 +ATOM 22726 C C . GLU D 1 693 ? 49.936 5.423 -8.635 1.00 77.33 ? 693 GLU D C 1 +ATOM 22727 O O . GLU D 1 693 ? 49.272 4.397 -8.445 1.00 76.91 ? 693 GLU D O 1 +ATOM 22728 C CB . GLU D 1 693 ? 52.425 5.100 -8.668 1.00 79.37 ? 693 GLU D CB 1 +ATOM 22729 C CG . GLU D 1 693 ? 53.784 5.268 -7.986 1.00 82.29 ? 693 GLU D CG 1 +ATOM 22730 C CD . GLU D 1 693 ? 54.948 4.806 -8.856 1.00 84.35 ? 693 GLU D CD 1 +ATOM 22731 O OE1 . GLU D 1 693 ? 54.886 3.674 -9.395 1.00 85.47 ? 693 GLU D OE1 1 +ATOM 22732 O OE2 . GLU D 1 693 ? 55.929 5.573 -8.994 1.00 84.21 ? 693 GLU D OE2 1 +ATOM 22733 N N . ILE E 1 3 ? -41.045 17.553 41.932 1.00 45.36 ? 3 ILE E N 1 +ATOM 22734 C CA . ILE E 1 3 ? -41.157 18.910 41.306 1.00 47.69 ? 3 ILE E CA 1 +ATOM 22735 C C . ILE E 1 3 ? -40.470 18.928 39.949 1.00 46.63 ? 3 ILE E C 1 +ATOM 22736 O O . ILE E 1 3 ? -39.261 18.716 39.849 1.00 47.82 ? 3 ILE E O 1 +ATOM 22737 C CB . ILE E 1 3 ? -40.531 19.995 42.198 1.00 48.25 ? 3 ILE E CB 1 +ATOM 22738 C CG1 . ILE E 1 3 ? -41.109 19.896 43.611 1.00 51.21 ? 3 ILE E CG1 1 +ATOM 22739 C CG2 . ILE E 1 3 ? -40.824 21.382 41.623 1.00 49.60 ? 3 ILE E CG2 1 +ATOM 22740 C CD1 . ILE E 1 3 ? -42.635 19.968 43.664 1.00 53.96 ? 3 ILE E CD1 1 +ATOM 22741 N N . LEU E 1 4 ? -41.245 19.197 38.906 1.00 45.71 ? 4 LEU E N 1 +ATOM 22742 C CA . LEU E 1 4 ? -40.727 19.193 37.548 1.00 45.54 ? 4 LEU E CA 1 +ATOM 22743 C C . LEU E 1 4 ? -41.372 20.298 36.721 1.00 45.93 ? 4 LEU E C 1 +ATOM 22744 O O . LEU E 1 4 ? -42.556 20.590 36.885 1.00 46.15 ? 4 LEU E O 1 +ATOM 22745 C CB . LEU E 1 4 ? -40.997 17.809 36.931 1.00 45.70 ? 4 LEU E CB 1 +ATOM 22746 C CG . LEU E 1 4 ? -40.585 17.382 35.515 1.00 46.80 ? 4 LEU E CG 1 +ATOM 22747 C CD1 . LEU E 1 4 ? -41.754 17.514 34.567 1.00 47.57 ? 4 LEU E CD1 1 +ATOM 22748 C CD2 . LEU E 1 4 ? -39.399 18.199 35.042 1.00 48.58 ? 4 LEU E CD2 1 +ATOM 22749 N N . LYS E 1 5 ? -40.586 20.920 35.847 1.00 46.12 ? 5 LYS E N 1 +ATOM 22750 C CA . LYS E 1 5 ? -41.082 21.994 34.991 1.00 46.70 ? 5 LYS E CA 1 +ATOM 22751 C C . LYS E 1 5 ? -40.230 22.058 33.732 1.00 45.82 ? 5 LYS E C 1 +ATOM 22752 O O . LYS E 1 5 ? -39.002 21.973 33.805 1.00 46.62 ? 5 LYS E O 1 +ATOM 22753 C CB . LYS E 1 5 ? -41.016 23.334 35.725 1.00 48.85 ? 5 LYS E CB 1 +ATOM 22754 C CG . LYS E 1 5 ? -42.302 24.156 35.654 1.00 53.72 ? 5 LYS E CG 1 +ATOM 22755 C CD . LYS E 1 5 ? -42.731 24.464 34.219 1.00 56.97 ? 5 LYS E CD 1 +ATOM 22756 C CE . LYS E 1 5 ? -44.044 25.259 34.186 1.00 58.65 ? 5 LYS E CE 1 +ATOM 22757 N NZ . LYS E 1 5 ? -44.570 25.434 32.795 1.00 58.67 ? 5 LYS E NZ 1 +ATOM 22758 N N . ILE E 1 6 ? -40.876 22.212 32.581 1.00 43.69 ? 6 ILE E N 1 +ATOM 22759 C CA . ILE E 1 6 ? -40.154 22.266 31.316 1.00 42.16 ? 6 ILE E CA 1 +ATOM 22760 C C . ILE E 1 6 ? -40.450 23.513 30.484 1.00 44.61 ? 6 ILE E C 1 +ATOM 22761 O O . ILE E 1 6 ? -41.604 23.900 30.309 1.00 43.82 ? 6 ILE E O 1 +ATOM 22762 C CB . ILE E 1 6 ? -40.460 21.024 30.458 1.00 39.58 ? 6 ILE E CB 1 +ATOM 22763 C CG1 . ILE E 1 6 ? -40.173 19.757 31.275 1.00 37.67 ? 6 ILE E CG1 1 +ATOM 22764 C CG2 . ILE E 1 6 ? -39.628 21.053 29.172 1.00 35.75 ? 6 ILE E CG2 1 +ATOM 22765 C CD1 . ILE E 1 6 ? -40.469 18.467 30.543 1.00 35.14 ? 6 ILE E CD1 1 +ATOM 22766 N N . TYR E 1 7 ? -39.386 24.136 29.984 1.00 46.32 ? 7 TYR E N 1 +ATOM 22767 C CA . TYR E 1 7 ? -39.486 25.323 29.150 1.00 49.00 ? 7 TYR E CA 1 +ATOM 22768 C C . TYR E 1 7 ? -38.906 24.955 27.805 1.00 51.61 ? 7 TYR E C 1 +ATOM 22769 O O . TYR E 1 7 ? -38.158 23.988 27.695 1.00 53.12 ? 7 TYR E O 1 +ATOM 22770 C CB . TYR E 1 7 ? -38.680 26.480 29.742 1.00 48.17 ? 7 TYR E CB 1 +ATOM 22771 C CG . TYR E 1 7 ? -39.194 26.957 31.073 1.00 49.06 ? 7 TYR E CG 1 +ATOM 22772 C CD1 . TYR E 1 7 ? -40.397 27.654 31.164 1.00 49.68 ? 7 TYR E CD1 1 +ATOM 22773 C CD2 . TYR E 1 7 ? -38.498 26.685 32.249 1.00 49.52 ? 7 TYR E CD2 1 +ATOM 22774 C CE1 . TYR E 1 7 ? -40.899 28.068 32.393 1.00 49.67 ? 7 TYR E CE1 1 +ATOM 22775 C CE2 . TYR E 1 7 ? -38.991 27.094 33.487 1.00 50.37 ? 7 TYR E CE2 1 +ATOM 22776 C CZ . TYR E 1 7 ? -40.194 27.786 33.549 1.00 50.50 ? 7 TYR E CZ 1 +ATOM 22777 O OH . TYR E 1 7 ? -40.702 28.184 34.762 1.00 51.17 ? 7 TYR E OH 1 +ATOM 22778 N N . GLU E 1 8 ? -39.257 25.720 26.782 1.00 54.23 ? 8 GLU E N 1 +ATOM 22779 C CA . GLU E 1 8 ? -38.747 25.474 25.445 1.00 57.49 ? 8 GLU E CA 1 +ATOM 22780 C C . GLU E 1 8 ? -38.632 26.808 24.733 1.00 58.33 ? 8 GLU E C 1 +ATOM 22781 O O . GLU E 1 8 ? -39.147 27.816 25.217 1.00 58.54 ? 8 GLU E O 1 +ATOM 22782 C CB . GLU E 1 8 ? -39.689 24.560 24.669 1.00 59.69 ? 8 GLU E CB 1 +ATOM 22783 C CG . GLU E 1 8 ? -41.017 25.203 24.337 1.00 64.50 ? 8 GLU E CG 1 +ATOM 22784 C CD . GLU E 1 8 ? -41.797 24.408 23.317 1.00 67.31 ? 8 GLU E CD 1 +ATOM 22785 O OE1 . GLU E 1 8 ? -42.219 23.274 23.635 1.00 68.06 ? 8 GLU E OE1 1 +ATOM 22786 O OE2 . GLU E 1 8 ? -41.979 24.920 22.189 1.00 70.07 ? 8 GLU E OE2 1 +ATOM 22787 N N . ASN E 1 9 ? -37.958 26.812 23.587 1.00 59.76 ? 9 ASN E N 1 +ATOM 22788 C CA . ASN E 1 9 ? -37.773 28.028 22.804 1.00 61.39 ? 9 ASN E CA 1 +ATOM 22789 C C . ASN E 1 9 ? -36.610 27.846 21.850 1.00 61.50 ? 9 ASN E C 1 +ATOM 22790 O O . ASN E 1 9 ? -35.488 27.547 22.276 1.00 61.58 ? 9 ASN E O 1 +ATOM 22791 C CB . ASN E 1 9 ? -37.476 29.228 23.714 1.00 63.77 ? 9 ASN E CB 1 +ATOM 22792 C CG . ASN E 1 9 ? -37.509 30.559 22.966 1.00 66.82 ? 9 ASN E CG 1 +ATOM 22793 O OD1 . ASN E 1 9 ? -38.560 30.981 22.469 1.00 67.98 ? 9 ASN E OD1 1 +ATOM 22794 N ND2 . ASN E 1 9 ? -36.355 31.224 22.883 1.00 66.68 ? 9 ASN E ND2 1 +ATOM 22795 N N . LYS E 1 10 ? -36.879 28.033 20.563 1.00 60.77 ? 10 LYS E N 1 +ATOM 22796 C CA . LYS E 1 10 ? -35.850 27.911 19.538 1.00 60.12 ? 10 LYS E CA 1 +ATOM 22797 C C . LYS E 1 10 ? -35.091 26.585 19.595 1.00 57.84 ? 10 LYS E C 1 +ATOM 22798 O O . LYS E 1 10 ? -33.868 26.550 19.415 1.00 58.51 ? 10 LYS E O 1 +ATOM 22799 C CB . LYS E 1 10 ? -34.858 29.086 19.640 1.00 62.87 ? 10 LYS E CB 1 +ATOM 22800 C CG . LYS E 1 10 ? -35.357 30.412 19.046 1.00 65.59 ? 10 LYS E CG 1 +ATOM 22801 C CD . LYS E 1 10 ? -36.621 30.922 19.739 1.00 68.62 ? 10 LYS E CD 1 +ATOM 22802 C CE . LYS E 1 10 ? -37.121 32.225 19.105 1.00 70.94 ? 10 LYS E CE 1 +ATOM 22803 N NZ . LYS E 1 10 ? -38.375 32.756 19.742 1.00 71.59 ? 10 LYS E NZ 1 +ATOM 22804 N N . GLY E 1 11 ? -35.820 25.502 19.851 1.00 54.41 ? 11 GLY E N 1 +ATOM 22805 C CA . GLY E 1 11 ? -35.212 24.184 19.900 1.00 49.99 ? 11 GLY E CA 1 +ATOM 22806 C C . GLY E 1 11 ? -34.344 23.870 21.105 1.00 47.15 ? 11 GLY E C 1 +ATOM 22807 O O . GLY E 1 11 ? -33.376 23.125 20.993 1.00 48.51 ? 11 GLY E O 1 +ATOM 22808 N N . VAL E 1 12 ? -34.678 24.436 22.255 1.00 43.40 ? 12 VAL E N 1 +ATOM 22809 C CA . VAL E 1 12 ? -33.933 24.184 23.474 1.00 39.99 ? 12 VAL E CA 1 +ATOM 22810 C C . VAL E 1 12 ? -34.933 23.989 24.607 1.00 40.01 ? 12 VAL E C 1 +ATOM 22811 O O . VAL E 1 12 ? -35.725 24.875 24.928 1.00 37.48 ? 12 VAL E O 1 +ATOM 22812 C CB . VAL E 1 12 ? -32.966 25.355 23.818 1.00 40.08 ? 12 VAL E CB 1 +ATOM 22813 C CG1 . VAL E 1 12 ? -32.325 25.131 25.181 1.00 37.36 ? 12 VAL E CG1 1 +ATOM 22814 C CG2 . VAL E 1 12 ? -31.885 25.470 22.752 1.00 36.82 ? 12 VAL E CG2 1 +ATOM 22815 N N . TYR E 1 13 ? -34.902 22.799 25.195 1.00 40.50 ? 13 TYR E N 1 +ATOM 22816 C CA . TYR E 1 13 ? -35.787 22.463 26.295 1.00 39.81 ? 13 TYR E CA 1 +ATOM 22817 C C . TYR E 1 13 ? -35.038 22.647 27.593 1.00 38.67 ? 13 TYR E C 1 +ATOM 22818 O O . TYR E 1 13 ? -33.913 22.193 27.751 1.00 38.04 ? 13 TYR E O 1 +ATOM 22819 C CB . TYR E 1 13 ? -36.243 21.016 26.182 1.00 41.28 ? 13 TYR E CB 1 +ATOM 22820 C CG . TYR E 1 13 ? -37.111 20.745 24.973 1.00 45.31 ? 13 TYR E CG 1 +ATOM 22821 C CD1 . TYR E 1 13 ? -38.473 21.063 24.977 1.00 46.02 ? 13 TYR E CD1 1 +ATOM 22822 C CD2 . TYR E 1 13 ? -36.570 20.177 23.821 1.00 45.90 ? 13 TYR E CD2 1 +ATOM 22823 C CE1 . TYR E 1 13 ? -39.272 20.818 23.864 1.00 47.22 ? 13 TYR E CE1 1 +ATOM 22824 C CE2 . TYR E 1 13 ? -37.358 19.931 22.703 1.00 47.95 ? 13 TYR E CE2 1 +ATOM 22825 C CZ . TYR E 1 13 ? -38.706 20.253 22.731 1.00 48.42 ? 13 TYR E CZ 1 +ATOM 22826 O OH . TYR E 1 13 ? -39.480 20.005 21.620 1.00 51.26 ? 13 TYR E OH 1 +ATOM 22827 N N . LYS E 1 14 ? -35.651 23.347 28.521 1.00 38.60 ? 14 LYS E N 1 +ATOM 22828 C CA . LYS E 1 14 ? -35.010 23.532 29.791 1.00 38.84 ? 14 LYS E CA 1 +ATOM 22829 C C . LYS E 1 14 ? -35.825 22.734 30.781 1.00 39.62 ? 14 LYS E C 1 +ATOM 22830 O O . LYS E 1 14 ? -36.990 23.050 31.027 1.00 39.88 ? 14 LYS E O 1 +ATOM 22831 C CB . LYS E 1 14 ? -34.986 25.008 30.183 1.00 39.83 ? 14 LYS E CB 1 +ATOM 22832 C CG . LYS E 1 14 ? -34.354 25.239 31.543 1.00 40.58 ? 14 LYS E CG 1 +ATOM 22833 C CD . LYS E 1 14 ? -34.250 26.709 31.904 1.00 40.60 ? 14 LYS E CD 1 +ATOM 22834 C CE . LYS E 1 14 ? -33.588 26.854 33.269 1.00 42.84 ? 14 LYS E CE 1 +ATOM 22835 N NZ . LYS E 1 14 ? -33.322 28.266 33.639 1.00 44.22 ? 14 LYS E NZ 1 +ATOM 22836 N N . VAL E 1 15 ? -35.222 21.683 31.331 1.00 38.77 ? 15 VAL E N 1 +ATOM 22837 C CA . VAL E 1 15 ? -35.905 20.845 32.303 1.00 38.15 ? 15 VAL E CA 1 +ATOM 22838 C C . VAL E 1 15 ? -35.449 21.228 33.706 1.00 39.56 ? 15 VAL E C 1 +ATOM 22839 O O . VAL E 1 15 ? -34.256 21.204 34.015 1.00 37.97 ? 15 VAL E O 1 +ATOM 22840 C CB . VAL E 1 15 ? -35.622 19.353 32.056 1.00 37.14 ? 15 VAL E CB 1 +ATOM 22841 C CG1 . VAL E 1 15 ? -36.378 18.508 33.060 1.00 34.64 ? 15 VAL E CG1 1 +ATOM 22842 C CG2 . VAL E 1 15 ? -36.026 18.984 30.640 1.00 35.43 ? 15 VAL E CG2 1 +ATOM 22843 N N . VAL E 1 16 ? -36.410 21.593 34.550 1.00 40.91 ? 16 VAL E N 1 +ATOM 22844 C CA . VAL E 1 16 ? -36.118 21.989 35.918 1.00 40.21 ? 16 VAL E CA 1 +ATOM 22845 C C . VAL E 1 16 ? -36.679 20.976 36.901 1.00 40.66 ? 16 VAL E C 1 +ATOM 22846 O O . VAL E 1 16 ? -37.881 20.718 36.926 1.00 41.01 ? 16 VAL E O 1 +ATOM 22847 C CB . VAL E 1 16 ? -36.725 23.377 36.239 1.00 40.88 ? 16 VAL E CB 1 +ATOM 22848 C CG1 . VAL E 1 16 ? -36.366 23.791 37.654 1.00 38.60 ? 16 VAL E CG1 1 +ATOM 22849 C CG2 . VAL E 1 16 ? -36.227 24.404 35.242 1.00 40.06 ? 16 VAL E CG2 1 +ATOM 22850 N N . ILE E 1 17 ? -35.795 20.398 37.705 1.00 41.89 ? 17 ILE E N 1 +ATOM 22851 C CA . ILE E 1 17 ? -36.190 19.418 38.706 1.00 42.77 ? 17 ILE E CA 1 +ATOM 22852 C C . ILE E 1 17 ? -36.051 20.071 40.070 1.00 43.80 ? 17 ILE E C 1 +ATOM 22853 O O . ILE E 1 17 ? -34.955 20.472 40.457 1.00 43.28 ? 17 ILE E O 1 +ATOM 22854 C CB . ILE E 1 17 ? -35.284 18.174 38.657 1.00 43.75 ? 17 ILE E CB 1 +ATOM 22855 C CG1 . ILE E 1 17 ? -35.278 17.587 37.246 1.00 42.69 ? 17 ILE E CG1 1 +ATOM 22856 C CG2 . ILE E 1 17 ? -35.764 17.137 39.666 1.00 42.98 ? 17 ILE E CG2 1 +ATOM 22857 C CD1 . ILE E 1 17 ? -36.648 17.158 36.765 1.00 47.56 ? 17 ILE E CD1 1 +ATOM 22858 N N . GLY E 1 18 ? -37.162 20.180 40.792 1.00 45.29 ? 18 GLY E N 1 +ATOM 22859 C CA . GLY E 1 18 ? -37.139 20.805 42.102 1.00 46.16 ? 18 GLY E CA 1 +ATOM 22860 C C . GLY E 1 18 ? -36.934 22.303 41.978 1.00 48.16 ? 18 GLY E C 1 +ATOM 22861 O O . GLY E 1 18 ? -37.463 22.935 41.066 1.00 47.54 ? 18 GLY E O 1 +ATOM 22862 N N . GLU E 1 19 ? -36.160 22.870 42.898 1.00 50.29 ? 19 GLU E N 1 +ATOM 22863 C CA . GLU E 1 19 ? -35.867 24.300 42.896 1.00 52.57 ? 19 GLU E CA 1 +ATOM 22864 C C . GLU E 1 19 ? -34.353 24.484 42.836 1.00 51.97 ? 19 GLU E C 1 +ATOM 22865 O O . GLU E 1 19 ? -33.700 24.744 43.843 1.00 51.91 ? 19 GLU E O 1 +ATOM 22866 C CB . GLU E 1 19 ? -36.451 24.941 44.152 1.00 56.23 ? 19 GLU E CB 1 +ATOM 22867 C CG . GLU E 1 19 ? -37.969 24.797 44.224 1.00 63.32 ? 19 GLU E CG 1 +ATOM 22868 C CD . GLU E 1 19 ? -38.534 25.104 45.600 1.00 67.34 ? 19 GLU E CD 1 +ATOM 22869 O OE1 . GLU E 1 19 ? -38.187 24.384 46.562 1.00 69.39 ? 19 GLU E OE1 1 +ATOM 22870 O OE2 . GLU E 1 19 ? -39.331 26.061 45.720 1.00 70.61 ? 19 GLU E OE2 1 +ATOM 22871 N N . PRO E 1 20 ? -33.779 24.355 41.631 1.00 50.85 ? 20 PRO E N 1 +ATOM 22872 C CA . PRO E 1 20 ? -32.346 24.482 41.368 1.00 49.82 ? 20 PRO E CA 1 +ATOM 22873 C C . PRO E 1 20 ? -31.715 25.827 41.683 1.00 48.70 ? 20 PRO E C 1 +ATOM 22874 O O . PRO E 1 20 ? -32.352 26.875 41.580 1.00 49.69 ? 20 PRO E O 1 +ATOM 22875 C CB . PRO E 1 20 ? -32.236 24.157 39.879 1.00 49.17 ? 20 PRO E CB 1 +ATOM 22876 C CG . PRO E 1 20 ? -33.437 23.320 39.608 1.00 50.21 ? 20 PRO E CG 1 +ATOM 22877 C CD . PRO E 1 20 ? -34.497 24.030 40.389 1.00 50.59 ? 20 PRO E CD 1 +ATOM 22878 N N . PHE E 1 21 ? -30.443 25.773 42.062 1.00 46.81 ? 21 PHE E N 1 +ATOM 22879 C CA . PHE E 1 21 ? -29.647 26.959 42.357 1.00 44.88 ? 21 PHE E CA 1 +ATOM 22880 C C . PHE E 1 21 ? -28.388 26.715 41.535 1.00 43.02 ? 21 PHE E C 1 +ATOM 22881 O O . PHE E 1 21 ? -27.382 26.245 42.055 1.00 44.08 ? 21 PHE E O 1 +ATOM 22882 C CB . PHE E 1 21 ? -29.302 27.021 43.846 1.00 43.95 ? 21 PHE E CB 1 +ATOM 22883 C CG . PHE E 1 21 ? -28.749 28.337 44.276 1.00 44.89 ? 21 PHE E CG 1 +ATOM 22884 C CD1 . PHE E 1 21 ? -29.577 29.454 44.376 1.00 45.09 ? 21 PHE E CD1 1 +ATOM 22885 C CD2 . PHE E 1 21 ? -27.394 28.477 44.559 1.00 44.82 ? 21 PHE E CD2 1 +ATOM 22886 C CE1 . PHE E 1 21 ? -29.060 30.697 44.753 1.00 44.90 ? 21 PHE E CE1 1 +ATOM 22887 C CE2 . PHE E 1 21 ? -26.866 29.713 44.934 1.00 45.54 ? 21 PHE E CE2 1 +ATOM 22888 C CZ . PHE E 1 21 ? -27.702 30.826 45.031 1.00 45.58 ? 21 PHE E CZ 1 +ATOM 22889 N N . PRO E 1 22 ? -28.437 27.022 40.230 1.00 41.88 ? 22 PRO E N 1 +ATOM 22890 C CA . PRO E 1 22 ? -27.327 26.838 39.284 1.00 40.95 ? 22 PRO E CA 1 +ATOM 22891 C C . PRO E 1 22 ? -26.028 27.509 39.698 1.00 39.90 ? 22 PRO E C 1 +ATOM 22892 O O . PRO E 1 22 ? -26.043 28.544 40.359 1.00 39.53 ? 22 PRO E O 1 +ATOM 22893 C CB . PRO E 1 22 ? -27.869 27.425 37.982 1.00 40.67 ? 22 PRO E CB 1 +ATOM 22894 C CG . PRO E 1 22 ? -29.349 27.403 38.164 1.00 42.13 ? 22 PRO E CG 1 +ATOM 22895 C CD . PRO E 1 22 ? -29.527 27.775 39.595 1.00 40.88 ? 22 PRO E CD 1 +ATOM 22896 N N . PRO E 1 23 ? -24.883 26.924 39.315 1.00 39.51 ? 23 PRO E N 1 +ATOM 22897 C CA . PRO E 1 23 ? -23.578 27.501 39.660 1.00 39.74 ? 23 PRO E CA 1 +ATOM 22898 C C . PRO E 1 23 ? -23.455 28.847 38.954 1.00 40.42 ? 23 PRO E C 1 +ATOM 22899 O O . PRO E 1 23 ? -22.742 29.743 39.392 1.00 40.67 ? 23 PRO E O 1 +ATOM 22900 C CB . PRO E 1 23 ? -22.593 26.469 39.123 1.00 39.33 ? 23 PRO E CB 1 +ATOM 22901 C CG . PRO E 1 23 ? -23.335 25.896 37.933 1.00 38.81 ? 23 PRO E CG 1 +ATOM 22902 C CD . PRO E 1 23 ? -24.723 25.716 38.488 1.00 38.79 ? 23 PRO E CD 1 +ATOM 22903 N N . ILE E 1 24 ? -24.163 28.961 37.839 1.00 40.57 ? 24 ILE E N 1 +ATOM 22904 C CA . ILE E 1 24 ? -24.195 30.180 37.058 1.00 41.40 ? 24 ILE E CA 1 +ATOM 22905 C C . ILE E 1 24 ? -25.513 30.163 36.306 1.00 43.52 ? 24 ILE E C 1 +ATOM 22906 O O . ILE E 1 24 ? -25.984 29.101 35.881 1.00 42.51 ? 24 ILE E O 1 +ATOM 22907 C CB . ILE E 1 24 ? -23.023 30.261 36.054 1.00 42.26 ? 24 ILE E CB 1 +ATOM 22908 C CG1 . ILE E 1 24 ? -23.144 31.547 35.234 1.00 41.15 ? 24 ILE E CG1 1 +ATOM 22909 C CG2 . ILE E 1 24 ? -23.011 29.034 35.139 1.00 39.56 ? 24 ILE E CG2 1 +ATOM 22910 C CD1 . ILE E 1 24 ? -21.929 31.857 34.397 1.00 42.67 ? 24 ILE E CD1 1 +ATOM 22911 N N . GLU E 1 25 ? -26.120 31.332 36.156 1.00 45.45 ? 25 GLU E N 1 +ATOM 22912 C CA . GLU E 1 25 ? -27.388 31.420 35.459 1.00 49.42 ? 25 GLU E CA 1 +ATOM 22913 C C . GLU E 1 25 ? -27.219 31.773 33.992 1.00 50.54 ? 25 GLU E C 1 +ATOM 22914 O O . GLU E 1 25 ? -26.577 32.767 33.646 1.00 51.81 ? 25 GLU E O 1 +ATOM 22915 C CB . GLU E 1 25 ? -28.292 32.445 36.140 1.00 51.30 ? 25 GLU E CB 1 +ATOM 22916 C CG . GLU E 1 25 ? -28.694 32.054 37.551 1.00 55.82 ? 25 GLU E CG 1 +ATOM 22917 C CD . GLU E 1 25 ? -29.611 33.073 38.201 1.00 58.59 ? 25 GLU E CD 1 +ATOM 22918 O OE1 . GLU E 1 25 ? -29.198 34.249 38.329 1.00 59.38 ? 25 GLU E OE1 1 +ATOM 22919 O OE2 . GLU E 1 25 ? -30.745 32.694 38.584 1.00 60.87 ? 25 GLU E OE2 1 +ATOM 22920 N N . PHE E 1 26 ? -27.790 30.941 33.132 1.00 51.66 ? 26 PHE E N 1 +ATOM 22921 C CA . PHE E 1 26 ? -27.729 31.168 31.700 1.00 54.18 ? 26 PHE E CA 1 +ATOM 22922 C C . PHE E 1 26 ? -29.084 31.684 31.249 1.00 57.76 ? 26 PHE E C 1 +ATOM 22923 O O . PHE E 1 26 ? -30.092 30.987 31.342 1.00 57.86 ? 26 PHE E O 1 +ATOM 22924 C CB . PHE E 1 26 ? -27.384 29.875 30.973 1.00 51.33 ? 26 PHE E CB 1 +ATOM 22925 C CG . PHE E 1 26 ? -26.001 29.379 31.262 1.00 49.64 ? 26 PHE E CG 1 +ATOM 22926 C CD1 . PHE E 1 26 ? -24.894 30.152 30.930 1.00 47.61 ? 26 PHE E CD1 1 +ATOM 22927 C CD2 . PHE E 1 26 ? -25.800 28.147 31.873 1.00 47.95 ? 26 PHE E CD2 1 +ATOM 22928 C CE1 . PHE E 1 26 ? -23.608 29.707 31.201 1.00 46.89 ? 26 PHE E CE1 1 +ATOM 22929 C CE2 . PHE E 1 26 ? -24.517 27.693 32.147 1.00 47.48 ? 26 PHE E CE2 1 +ATOM 22930 C CZ . PHE E 1 26 ? -23.416 28.475 31.811 1.00 46.83 ? 26 PHE E CZ 1 +ATOM 22931 N N . PRO E 1 27 ? -29.120 32.923 30.750 1.00 61.28 ? 27 PRO E N 1 +ATOM 22932 C CA . PRO E 1 27 ? -30.361 33.542 30.284 1.00 64.31 ? 27 PRO E CA 1 +ATOM 22933 C C . PRO E 1 27 ? -30.942 32.844 29.055 1.00 67.28 ? 27 PRO E C 1 +ATOM 22934 O O . PRO E 1 27 ? -30.218 32.532 28.105 1.00 67.84 ? 27 PRO E O 1 +ATOM 22935 C CB . PRO E 1 27 ? -29.925 34.968 29.984 1.00 63.58 ? 27 PRO E CB 1 +ATOM 22936 C CG . PRO E 1 27 ? -28.544 34.754 29.429 1.00 63.23 ? 27 PRO E CG 1 +ATOM 22937 C CD . PRO E 1 27 ? -27.954 33.757 30.403 1.00 61.67 ? 27 PRO E CD 1 +ATOM 22938 N N . LEU E 1 28 ? -32.244 32.580 29.086 1.00 70.34 ? 28 LEU E N 1 +ATOM 22939 C CA . LEU E 1 28 ? -32.913 31.952 27.954 1.00 73.63 ? 28 LEU E CA 1 +ATOM 22940 C C . LEU E 1 28 ? -33.799 33.005 27.301 1.00 76.41 ? 28 LEU E C 1 +ATOM 22941 O O . LEU E 1 28 ? -34.758 33.484 27.911 1.00 77.26 ? 28 LEU E O 1 +ATOM 22942 C CB . LEU E 1 28 ? -33.763 30.764 28.403 1.00 72.98 ? 28 LEU E CB 1 +ATOM 22943 C CG . LEU E 1 28 ? -33.287 29.378 27.951 1.00 73.57 ? 28 LEU E CG 1 +ATOM 22944 C CD1 . LEU E 1 28 ? -34.328 28.346 28.339 1.00 73.95 ? 28 LEU E CD1 1 +ATOM 22945 C CD2 . LEU E 1 28 ? -33.069 29.348 26.443 1.00 73.63 ? 28 LEU E CD2 1 +ATOM 22946 N N . GLU E 1 29 ? -33.454 33.364 26.066 1.00 78.94 ? 29 GLU E N 1 +ATOM 22947 C CA . GLU E 1 29 ? -34.172 34.364 25.269 1.00 81.35 ? 29 GLU E CA 1 +ATOM 22948 C C . GLU E 1 29 ? -35.638 34.604 25.667 1.00 81.46 ? 29 GLU E C 1 +ATOM 22949 O O . GLU E 1 29 ? -36.055 35.751 25.854 1.00 81.53 ? 29 GLU E O 1 +ATOM 22950 C CB . GLU E 1 29 ? -34.082 33.973 23.791 1.00 83.46 ? 29 GLU E CB 1 +ATOM 22951 C CG . GLU E 1 29 ? -32.646 33.752 23.321 1.00 85.95 ? 29 GLU E CG 1 +ATOM 22952 C CD . GLU E 1 29 ? -32.555 33.080 21.961 1.00 87.89 ? 29 GLU E CD 1 +ATOM 22953 O OE1 . GLU E 1 29 ? -32.931 33.711 20.947 1.00 88.26 ? 29 GLU E OE1 1 +ATOM 22954 O OE2 . GLU E 1 29 ? -32.105 31.912 21.911 1.00 88.61 ? 29 GLU E OE2 1 +ATOM 22955 N N . GLN E 1 30 ? -36.412 33.526 25.787 1.00 81.43 ? 30 GLN E N 1 +ATOM 22956 C CA . GLN E 1 30 ? -37.821 33.614 26.176 1.00 81.21 ? 30 GLN E CA 1 +ATOM 22957 C C . GLN E 1 30 ? -38.215 32.338 26.918 1.00 80.80 ? 30 GLN E C 1 +ATOM 22958 O O . GLN E 1 30 ? -38.049 31.236 26.399 1.00 81.02 ? 30 GLN E O 1 +ATOM 22959 C CB . GLN E 1 30 ? -38.715 33.774 24.943 1.00 82.04 ? 30 GLN E CB 1 +ATOM 22960 C CG . GLN E 1 30 ? -38.329 34.926 24.026 1.00 83.24 ? 30 GLN E CG 1 +ATOM 22961 C CD . GLN E 1 30 ? -39.274 35.080 22.847 1.00 84.26 ? 30 GLN E CD 1 +ATOM 22962 O OE1 . GLN E 1 30 ? -40.454 35.404 23.018 1.00 84.70 ? 30 GLN E OE1 1 +ATOM 22963 N NE2 . GLN E 1 30 ? -38.760 34.844 21.638 1.00 83.29 ? 30 GLN E NE2 1 +ATOM 22964 N N . LYS E 1 31 ? -38.734 32.482 28.132 1.00 80.10 ? 31 LYS E N 1 +ATOM 22965 C CA . LYS E 1 31 ? -39.137 31.315 28.906 1.00 78.09 ? 31 LYS E CA 1 +ATOM 22966 C C . LYS E 1 31 ? -40.576 30.920 28.634 1.00 76.28 ? 31 LYS E C 1 +ATOM 22967 O O . LYS E 1 31 ? -41.478 31.275 29.395 1.00 76.94 ? 31 LYS E O 1 +ATOM 22968 C CB . LYS E 1 31 ? -38.956 31.559 30.411 1.00 79.27 ? 31 LYS E CB 1 +ATOM 22969 C CG . LYS E 1 31 ? -37.631 31.050 30.969 1.00 80.21 ? 31 LYS E CG 1 +ATOM 22970 C CD . LYS E 1 31 ? -37.641 31.028 32.492 1.00 81.37 ? 31 LYS E CD 1 +ATOM 22971 C CE . LYS E 1 31 ? -36.359 30.408 33.046 1.00 82.82 ? 31 LYS E CE 1 +ATOM 22972 N NZ . LYS E 1 31 ? -36.389 30.214 34.529 1.00 82.69 ? 31 LYS E NZ 1 +ATOM 22973 N N . ILE E 1 32 ? -40.785 30.184 27.546 1.00 73.32 ? 32 ILE E N 1 +ATOM 22974 C CA . ILE E 1 32 ? -42.117 29.718 27.176 1.00 70.50 ? 32 ILE E CA 1 +ATOM 22975 C C . ILE E 1 32 ? -42.383 28.348 27.796 1.00 68.42 ? 32 ILE E C 1 +ATOM 22976 O O . ILE E 1 32 ? -41.659 27.393 27.523 1.00 67.54 ? 32 ILE E O 1 +ATOM 22977 C CB . ILE E 1 32 ? -42.260 29.574 25.647 1.00 70.71 ? 32 ILE E CB 1 +ATOM 22978 C CG1 . ILE E 1 32 ? -42.138 30.940 24.976 1.00 71.18 ? 32 ILE E CG1 1 +ATOM 22979 C CG2 . ILE E 1 32 ? -43.596 28.925 25.305 1.00 69.96 ? 32 ILE E CG2 1 +ATOM 22980 C CD1 . ILE E 1 32 ? -42.185 30.874 23.459 1.00 71.69 ? 32 ILE E CD1 1 +ATOM 22981 N N . SER E 1 33 ? -43.415 28.246 28.630 1.00 66.23 ? 33 SER E N 1 +ATOM 22982 C CA . SER E 1 33 ? -43.742 26.964 29.240 1.00 63.95 ? 33 SER E CA 1 +ATOM 22983 C C . SER E 1 33 ? -43.953 25.986 28.108 1.00 62.59 ? 33 SER E C 1 +ATOM 22984 O O . SER E 1 33 ? -44.439 26.356 27.043 1.00 62.00 ? 33 SER E O 1 +ATOM 22985 C CB . SER E 1 33 ? -45.018 27.056 30.073 1.00 63.93 ? 33 SER E CB 1 +ATOM 22986 O OG . SER E 1 33 ? -44.825 27.883 31.204 1.00 65.58 ? 33 SER E OG 1 +ATOM 22987 N N . SER E 1 34 ? -43.580 24.737 28.338 1.00 61.74 ? 34 SER E N 1 +ATOM 22988 C CA . SER E 1 34 ? -43.716 23.711 27.323 1.00 61.93 ? 34 SER E CA 1 +ATOM 22989 C C . SER E 1 34 ? -44.715 22.654 27.748 1.00 62.72 ? 34 SER E C 1 +ATOM 22990 O O . SER E 1 34 ? -44.885 22.400 28.940 1.00 63.18 ? 34 SER E O 1 +ATOM 22991 C CB . SER E 1 34 ? -42.361 23.056 27.071 1.00 61.00 ? 34 SER E CB 1 +ATOM 22992 O OG . SER E 1 34 ? -42.493 21.939 26.215 1.00 60.64 ? 34 SER E OG 1 +ATOM 22993 N N . ASN E 1 35 ? -45.383 22.039 26.779 1.00 63.05 ? 35 ASN E N 1 +ATOM 22994 C CA . ASN E 1 35 ? -46.338 20.987 27.100 1.00 64.12 ? 35 ASN E CA 1 +ATOM 22995 C C . ASN E 1 35 ? -45.732 19.624 26.805 1.00 63.63 ? 35 ASN E C 1 +ATOM 22996 O O . ASN E 1 35 ? -46.397 18.593 26.941 1.00 64.11 ? 35 ASN E O 1 +ATOM 22997 C CB . ASN E 1 35 ? -47.649 21.170 26.321 1.00 66.19 ? 35 ASN E CB 1 +ATOM 22998 C CG . ASN E 1 35 ? -48.548 22.231 26.942 1.00 68.28 ? 35 ASN E CG 1 +ATOM 22999 O OD1 . ASN E 1 35 ? -48.866 22.168 28.137 1.00 68.74 ? 35 ASN E OD1 1 +ATOM 23000 N ND2 . ASN E 1 35 ? -48.962 23.211 26.137 1.00 67.61 ? 35 ASN E ND2 1 +ATOM 23001 N N . LYS E 1 36 ? -44.462 19.618 26.406 1.00 62.52 ? 36 LYS E N 1 +ATOM 23002 C CA . LYS E 1 36 ? -43.787 18.362 26.115 1.00 60.58 ? 36 LYS E CA 1 +ATOM 23003 C C . LYS E 1 36 ? -43.455 17.689 27.432 1.00 58.64 ? 36 LYS E C 1 +ATOM 23004 O O . LYS E 1 36 ? -43.069 18.349 28.395 1.00 58.25 ? 36 LYS E O 1 +ATOM 23005 C CB . LYS E 1 36 ? -42.509 18.594 25.310 1.00 60.55 ? 36 LYS E CB 1 +ATOM 23006 C CG . LYS E 1 36 ? -42.069 17.364 24.538 1.00 60.51 ? 36 LYS E CG 1 +ATOM 23007 C CD . LYS E 1 36 ? -41.034 17.716 23.496 1.00 61.56 ? 36 LYS E CD 1 +ATOM 23008 C CE . LYS E 1 36 ? -40.832 16.573 22.524 1.00 62.57 ? 36 LYS E CE 1 +ATOM 23009 N NZ . LYS E 1 36 ? -39.824 16.923 21.483 1.00 65.05 ? 36 LYS E NZ 1 +ATOM 23010 N N . SER E 1 37 ? -43.618 16.373 27.466 1.00 56.76 ? 37 SER E N 1 +ATOM 23011 C CA . SER E 1 37 ? -43.355 15.592 28.663 1.00 55.62 ? 37 SER E CA 1 +ATOM 23012 C C . SER E 1 37 ? -41.985 14.931 28.621 1.00 54.51 ? 37 SER E C 1 +ATOM 23013 O O . SER E 1 37 ? -41.396 14.751 27.553 1.00 53.11 ? 37 SER E O 1 +ATOM 23014 C CB . SER E 1 37 ? -44.401 14.498 28.788 1.00 56.39 ? 37 SER E CB 1 +ATOM 23015 O OG . SER E 1 37 ? -44.221 13.552 27.744 1.00 57.72 ? 37 SER E OG 1 +ATOM 23016 N N . LEU E 1 38 ? -41.482 14.560 29.792 1.00 53.62 ? 38 LEU E N 1 +ATOM 23017 C CA . LEU E 1 38 ? -40.199 13.883 29.859 1.00 54.34 ? 38 LEU E CA 1 +ATOM 23018 C C . LEU E 1 38 ? -40.305 12.638 28.986 1.00 54.74 ? 38 LEU E C 1 +ATOM 23019 O O . LEU E 1 38 ? -39.384 12.294 28.244 1.00 54.08 ? 38 LEU E O 1 +ATOM 23020 C CB . LEU E 1 38 ? -39.893 13.468 31.293 1.00 53.60 ? 38 LEU E CB 1 +ATOM 23021 C CG . LEU E 1 38 ? -39.437 14.578 32.229 1.00 54.69 ? 38 LEU E CG 1 +ATOM 23022 C CD1 . LEU E 1 38 ? -39.296 14.007 33.632 1.00 54.46 ? 38 LEU E CD1 1 +ATOM 23023 C CD2 . LEU E 1 38 ? -38.113 15.163 31.737 1.00 54.61 ? 38 LEU E CD2 1 +ATOM 23024 N N . SER E 1 39 ? -41.452 11.975 29.085 1.00 54.59 ? 39 SER E N 1 +ATOM 23025 C CA . SER E 1 39 ? -41.729 10.763 28.330 1.00 54.51 ? 39 SER E CA 1 +ATOM 23026 C C . SER E 1 39 ? -41.434 10.918 26.840 1.00 54.74 ? 39 SER E C 1 +ATOM 23027 O O . SER E 1 39 ? -40.750 10.081 26.252 1.00 55.36 ? 39 SER E O 1 +ATOM 23028 C CB . SER E 1 39 ? -43.190 10.358 28.536 1.00 54.86 ? 39 SER E CB 1 +ATOM 23029 O OG . SER E 1 39 ? -43.495 9.179 27.821 1.00 55.95 ? 39 SER E OG 1 +ATOM 23030 N N . GLU E 1 40 ? -41.944 11.986 26.234 1.00 54.85 ? 40 GLU E N 1 +ATOM 23031 C CA . GLU E 1 40 ? -41.731 12.242 24.806 1.00 55.35 ? 40 GLU E CA 1 +ATOM 23032 C C . GLU E 1 40 ? -40.276 12.616 24.521 1.00 53.43 ? 40 GLU E C 1 +ATOM 23033 O O . GLU E 1 40 ? -39.791 12.482 23.399 1.00 52.73 ? 40 GLU E O 1 +ATOM 23034 C CB . GLU E 1 40 ? -42.653 13.369 24.340 1.00 57.51 ? 40 GLU E CB 1 +ATOM 23035 C CG . GLU E 1 40 ? -44.109 13.156 24.727 1.00 63.25 ? 40 GLU E CG 1 +ATOM 23036 C CD . GLU E 1 40 ? -44.956 14.409 24.559 1.00 66.07 ? 40 GLU E CD 1 +ATOM 23037 O OE1 . GLU E 1 40 ? -44.616 15.450 25.171 1.00 66.86 ? 40 GLU E OE1 1 +ATOM 23038 O OE2 . GLU E 1 40 ? -45.964 14.350 23.818 1.00 68.55 ? 40 GLU E OE2 1 +ATOM 23039 N N . LEU E 1 41 ? -39.595 13.092 25.555 1.00 52.28 ? 41 LEU E N 1 +ATOM 23040 C CA . LEU E 1 41 ? -38.198 13.490 25.467 1.00 50.73 ? 41 LEU E CA 1 +ATOM 23041 C C . LEU E 1 41 ? -37.296 12.268 25.656 1.00 49.53 ? 41 LEU E C 1 +ATOM 23042 O O . LEU E 1 41 ? -36.084 12.352 25.501 1.00 50.33 ? 41 LEU E O 1 +ATOM 23043 C CB . LEU E 1 41 ? -37.912 14.539 26.544 1.00 49.65 ? 41 LEU E CB 1 +ATOM 23044 C CG . LEU E 1 41 ? -37.395 15.915 26.125 1.00 49.42 ? 41 LEU E CG 1 +ATOM 23045 C CD1 . LEU E 1 41 ? -37.979 16.342 24.795 1.00 49.50 ? 41 LEU E CD1 1 +ATOM 23046 C CD2 . LEU E 1 41 ? -37.746 16.913 27.211 1.00 49.17 ? 41 LEU E CD2 1 +ATOM 23047 N N . GLY E 1 42 ? -37.902 11.131 25.989 1.00 49.24 ? 42 GLY E N 1 +ATOM 23048 C CA . GLY E 1 42 ? -37.149 9.901 26.191 1.00 47.71 ? 42 GLY E CA 1 +ATOM 23049 C C . GLY E 1 42 ? -36.305 9.877 27.458 1.00 46.88 ? 42 GLY E C 1 +ATOM 23050 O O . GLY E 1 42 ? -35.269 9.214 27.511 1.00 47.00 ? 42 GLY E O 1 +ATOM 23051 N N . LEU E 1 43 ? -36.753 10.589 28.485 1.00 44.79 ? 43 LEU E N 1 +ATOM 23052 C CA . LEU E 1 43 ? -36.025 10.660 29.738 1.00 44.95 ? 43 LEU E CA 1 +ATOM 23053 C C . LEU E 1 43 ? -36.822 10.143 30.917 1.00 45.38 ? 43 LEU E C 1 +ATOM 23054 O O . LEU E 1 43 ? -38.044 10.199 30.931 1.00 46.44 ? 43 LEU E O 1 +ATOM 23055 C CB . LEU E 1 43 ? -35.607 12.103 30.030 1.00 43.91 ? 43 LEU E CB 1 +ATOM 23056 C CG . LEU E 1 43 ? -34.753 12.792 28.969 1.00 43.54 ? 43 LEU E CG 1 +ATOM 23057 C CD1 . LEU E 1 43 ? -34.503 14.215 29.375 1.00 42.89 ? 43 LEU E CD1 1 +ATOM 23058 C CD2 . LEU E 1 43 ? -33.447 12.043 28.796 1.00 43.41 ? 43 LEU E CD2 1 +ATOM 23059 N N . THR E 1 44 ? -36.101 9.631 31.902 1.00 46.00 ? 44 THR E N 1 +ATOM 23060 C CA . THR E 1 44 ? -36.686 9.119 33.125 1.00 47.67 ? 44 THR E CA 1 +ATOM 23061 C C . THR E 1 44 ? -35.947 9.875 34.208 1.00 48.46 ? 44 THR E C 1 +ATOM 23062 O O . THR E 1 44 ? -34.735 10.061 34.118 1.00 48.77 ? 44 THR E O 1 +ATOM 23063 C CB . THR E 1 44 ? -36.426 7.608 33.292 1.00 48.94 ? 44 THR E CB 1 +ATOM 23064 O OG1 . THR E 1 44 ? -37.191 6.882 32.323 1.00 49.00 ? 44 THR E OG1 1 +ATOM 23065 C CG2 . THR E 1 44 ? -36.817 7.147 34.686 1.00 48.68 ? 44 THR E CG2 1 +ATOM 23066 N N . ILE E 1 45 ? -36.666 10.325 35.225 1.00 49.16 ? 45 ILE E N 1 +ATOM 23067 C CA . ILE E 1 45 ? -36.030 11.073 36.291 1.00 50.92 ? 45 ILE E CA 1 +ATOM 23068 C C . ILE E 1 45 ? -36.424 10.569 37.666 1.00 52.07 ? 45 ILE E C 1 +ATOM 23069 O O . ILE E 1 45 ? -37.579 10.235 37.914 1.00 53.56 ? 45 ILE E O 1 +ATOM 23070 C CB . ILE E 1 45 ? -36.359 12.568 36.162 1.00 51.27 ? 45 ILE E CB 1 +ATOM 23071 C CG1 . ILE E 1 45 ? -35.819 13.082 34.824 1.00 50.42 ? 45 ILE E CG1 1 +ATOM 23072 C CG2 . ILE E 1 45 ? -35.763 13.346 37.336 1.00 51.27 ? 45 ILE E CG2 1 +ATOM 23073 C CD1 . ILE E 1 45 ? -36.076 14.546 34.580 1.00 51.87 ? 45 ILE E CD1 1 +ATOM 23074 N N . VAL E 1 46 ? -35.441 10.505 38.554 1.00 53.75 ? 46 VAL E N 1 +ATOM 23075 C CA . VAL E 1 46 ? -35.656 10.040 39.914 1.00 55.16 ? 46 VAL E CA 1 +ATOM 23076 C C . VAL E 1 46 ? -34.977 10.969 40.921 1.00 56.99 ? 46 VAL E C 1 +ATOM 23077 O O . VAL E 1 46 ? -33.852 11.419 40.712 1.00 55.79 ? 46 VAL E O 1 +ATOM 23078 C CB . VAL E 1 46 ? -35.098 8.611 40.101 1.00 54.93 ? 46 VAL E CB 1 +ATOM 23079 C CG1 . VAL E 1 46 ? -35.218 8.190 41.557 1.00 54.58 ? 46 VAL E CG1 1 +ATOM 23080 C CG2 . VAL E 1 46 ? -35.845 7.637 39.201 1.00 54.11 ? 46 VAL E CG2 1 +ATOM 23081 N N . GLN E 1 47 ? -35.682 11.267 42.005 1.00 59.76 ? 47 GLN E N 1 +ATOM 23082 C CA . GLN E 1 47 ? -35.146 12.108 43.068 1.00 62.48 ? 47 GLN E CA 1 +ATOM 23083 C C . GLN E 1 47 ? -35.033 11.268 44.332 1.00 64.13 ? 47 GLN E C 1 +ATOM 23084 O O . GLN E 1 47 ? -36.023 10.713 44.808 1.00 64.24 ? 47 GLN E O 1 +ATOM 23085 C CB . GLN E 1 47 ? -36.061 13.298 43.331 1.00 63.06 ? 47 GLN E CB 1 +ATOM 23086 C CG . GLN E 1 47 ? -35.866 14.450 42.376 1.00 64.73 ? 47 GLN E CG 1 +ATOM 23087 C CD . GLN E 1 47 ? -36.763 15.632 42.707 1.00 66.50 ? 47 GLN E CD 1 +ATOM 23088 O OE1 . GLN E 1 47 ? -37.973 15.602 42.467 1.00 66.22 ? 47 GLN E OE1 1 +ATOM 23089 N NE2 . GLN E 1 47 ? -36.174 16.680 43.271 1.00 66.79 ? 47 GLN E NE2 1 +ATOM 23090 N N . GLN E 1 48 ? -33.824 11.170 44.871 1.00 66.32 ? 48 GLN E N 1 +ATOM 23091 C CA . GLN E 1 48 ? -33.599 10.384 46.075 1.00 68.13 ? 48 GLN E CA 1 +ATOM 23092 C C . GLN E 1 48 ? -32.868 11.169 47.150 1.00 69.08 ? 48 GLN E C 1 +ATOM 23093 O O . GLN E 1 48 ? -33.054 12.385 47.290 1.00 69.13 ? 48 GLN E O 1 +ATOM 23094 C CB . GLN E 1 48 ? -32.804 9.127 45.739 1.00 69.47 ? 48 GLN E CB 1 +ATOM 23095 C CG . GLN E 1 48 ? -33.558 8.144 44.860 1.00 72.63 ? 48 GLN E CG 1 +ATOM 23096 C CD . GLN E 1 48 ? -32.725 6.924 44.499 1.00 74.10 ? 48 GLN E CD 1 +ATOM 23097 O OE1 . GLN E 1 48 ? -33.203 6.008 43.825 1.00 74.68 ? 48 GLN E OE1 1 +ATOM 23098 N NE2 . GLN E 1 48 ? -31.470 6.907 44.947 1.00 74.94 ? 48 GLN E NE2 1 +ATOM 23099 N N . GLY E 1 49 ? -32.037 10.459 47.909 1.00 69.26 ? 49 GLY E N 1 +ATOM 23100 C CA . GLY E 1 49 ? -31.286 11.089 48.977 1.00 68.27 ? 49 GLY E CA 1 +ATOM 23101 C C . GLY E 1 49 ? -30.399 12.206 48.472 1.00 67.62 ? 49 GLY E C 1 +ATOM 23102 O O . GLY E 1 49 ? -29.204 11.997 48.255 1.00 68.82 ? 49 GLY E O 1 +ATOM 23103 N N . ASN E 1 50 ? -30.981 13.388 48.282 1.00 65.11 ? 50 ASN E N 1 +ATOM 23104 C CA . ASN E 1 50 ? -30.232 14.540 47.806 1.00 63.26 ? 50 ASN E CA 1 +ATOM 23105 C C . ASN E 1 50 ? -29.529 14.281 46.480 1.00 60.20 ? 50 ASN E C 1 +ATOM 23106 O O . ASN E 1 50 ? -28.447 14.815 46.231 1.00 59.82 ? 50 ASN E O 1 +ATOM 23107 C CB . ASN E 1 50 ? -29.197 14.969 48.851 1.00 66.37 ? 50 ASN E CB 1 +ATOM 23108 C CG . ASN E 1 50 ? -29.825 15.671 50.044 1.00 69.52 ? 50 ASN E CG 1 +ATOM 23109 O OD1 . ASN E 1 50 ? -30.384 16.767 49.915 1.00 70.28 ? 50 ASN E OD1 1 +ATOM 23110 N ND2 . ASN E 1 50 ? -29.739 15.042 51.215 1.00 70.89 ? 50 ASN E ND2 1 +ATOM 23111 N N . LYS E 1 51 ? -30.133 13.450 45.637 1.00 56.43 ? 51 LYS E N 1 +ATOM 23112 C CA . LYS E 1 51 ? -29.559 13.160 44.329 1.00 52.99 ? 51 LYS E CA 1 +ATOM 23113 C C . LYS E 1 51 ? -30.637 13.102 43.262 1.00 49.28 ? 51 LYS E C 1 +ATOM 23114 O O . LYS E 1 51 ? -31.787 12.789 43.547 1.00 47.77 ? 51 LYS E O 1 +ATOM 23115 C CB . LYS E 1 51 ? -28.788 11.837 44.348 1.00 53.69 ? 51 LYS E CB 1 +ATOM 23116 C CG . LYS E 1 51 ? -27.575 11.847 45.264 1.00 57.80 ? 51 LYS E CG 1 +ATOM 23117 C CD . LYS E 1 51 ? -26.677 10.625 45.068 1.00 59.94 ? 51 LYS E CD 1 +ATOM 23118 C CE . LYS E 1 51 ? -27.380 9.326 45.440 1.00 62.66 ? 51 LYS E CE 1 +ATOM 23119 N NZ . LYS E 1 51 ? -28.534 9.014 44.539 1.00 64.57 ? 51 LYS E NZ 1 +ATOM 23120 N N . VAL E 1 52 ? -30.259 13.431 42.034 1.00 46.56 ? 52 VAL E N 1 +ATOM 23121 C CA . VAL E 1 52 ? -31.177 13.385 40.904 1.00 43.26 ? 52 VAL E CA 1 +ATOM 23122 C C . VAL E 1 52 ? -30.548 12.471 39.866 1.00 42.20 ? 52 VAL E C 1 +ATOM 23123 O O . VAL E 1 52 ? -29.406 12.671 39.467 1.00 42.72 ? 52 VAL E O 1 +ATOM 23124 C CB . VAL E 1 52 ? -31.399 14.780 40.281 1.00 41.69 ? 52 VAL E CB 1 +ATOM 23125 C CG1 . VAL E 1 52 ? -32.250 14.666 39.031 1.00 39.32 ? 52 VAL E CG1 1 +ATOM 23126 C CG2 . VAL E 1 52 ? -32.072 15.688 41.284 1.00 40.94 ? 52 VAL E CG2 1 +ATOM 23127 N N . ILE E 1 53 ? -31.291 11.457 39.449 1.00 41.50 ? 53 ILE E N 1 +ATOM 23128 C CA . ILE E 1 53 ? -30.805 10.513 38.458 1.00 40.85 ? 53 ILE E CA 1 +ATOM 23129 C C . ILE E 1 53 ? -31.625 10.672 37.187 1.00 40.57 ? 53 ILE E C 1 +ATOM 23130 O O . ILE E 1 53 ? -32.850 10.581 37.213 1.00 41.67 ? 53 ILE E O 1 +ATOM 23131 C CB . ILE E 1 53 ? -30.939 9.066 38.973 1.00 41.15 ? 53 ILE E CB 1 +ATOM 23132 C CG1 . ILE E 1 53 ? -30.205 8.932 40.311 1.00 42.02 ? 53 ILE E CG1 1 +ATOM 23133 C CG2 . ILE E 1 53 ? -30.376 8.086 37.957 1.00 40.02 ? 53 ILE E CG2 1 +ATOM 23134 C CD1 . ILE E 1 53 ? -30.389 7.588 40.978 1.00 42.48 ? 53 ILE E CD1 1 +ATOM 23135 N N . VAL E 1 54 ? -30.947 10.929 36.078 1.00 40.02 ? 54 VAL E N 1 +ATOM 23136 C CA . VAL E 1 54 ? -31.616 11.091 34.795 1.00 39.80 ? 54 VAL E CA 1 +ATOM 23137 C C . VAL E 1 54 ? -31.178 9.965 33.862 1.00 39.99 ? 54 VAL E C 1 +ATOM 23138 O O . VAL E 1 54 ? -29.987 9.785 33.616 1.00 39.43 ? 54 VAL E O 1 +ATOM 23139 C CB . VAL E 1 54 ? -31.262 12.450 34.165 1.00 39.97 ? 54 VAL E CB 1 +ATOM 23140 C CG1 . VAL E 1 54 ? -31.935 12.598 32.811 1.00 37.93 ? 54 VAL E CG1 1 +ATOM 23141 C CG2 . VAL E 1 54 ? -31.693 13.565 35.099 1.00 39.30 ? 54 VAL E CG2 1 +ATOM 23142 N N . GLU E 1 55 ? -32.149 9.210 33.357 1.00 40.28 ? 55 GLU E N 1 +ATOM 23143 C CA . GLU E 1 55 ? -31.878 8.087 32.472 1.00 41.92 ? 55 GLU E CA 1 +ATOM 23144 C C . GLU E 1 55 ? -32.377 8.278 31.052 1.00 41.24 ? 55 GLU E C 1 +ATOM 23145 O O . GLU E 1 55 ? -33.402 8.914 30.806 1.00 40.67 ? 55 GLU E O 1 +ATOM 23146 C CB . GLU E 1 55 ? -32.501 6.807 33.027 1.00 45.17 ? 55 GLU E CB 1 +ATOM 23147 C CG . GLU E 1 55 ? -31.743 6.189 34.175 1.00 52.75 ? 55 GLU E CG 1 +ATOM 23148 C CD . GLU E 1 55 ? -32.438 4.948 34.730 1.00 57.83 ? 55 GLU E CD 1 +ATOM 23149 O OE1 . GLU E 1 55 ? -32.954 4.139 33.919 1.00 59.60 ? 55 GLU E OE1 1 +ATOM 23150 O OE2 . GLU E 1 55 ? -32.457 4.777 35.975 1.00 59.55 ? 55 GLU E OE2 1 +ATOM 23151 N N . LYS E 1 56 ? -31.641 7.689 30.123 1.00 40.08 ? 56 LYS E N 1 +ATOM 23152 C CA . LYS E 1 56 ? -31.960 7.743 28.710 1.00 39.88 ? 56 LYS E CA 1 +ATOM 23153 C C . LYS E 1 56 ? -31.542 6.382 28.180 1.00 39.47 ? 56 LYS E C 1 +ATOM 23154 O O . LYS E 1 56 ? -30.592 5.785 28.682 1.00 38.82 ? 56 LYS E O 1 +ATOM 23155 C CB . LYS E 1 56 ? -31.132 8.830 28.023 1.00 39.97 ? 56 LYS E CB 1 +ATOM 23156 C CG . LYS E 1 56 ? -31.643 9.228 26.665 1.00 41.65 ? 56 LYS E CG 1 +ATOM 23157 C CD . LYS E 1 56 ? -30.686 10.196 25.973 1.00 42.36 ? 56 LYS E CD 1 +ATOM 23158 C CE . LYS E 1 56 ? -29.646 9.447 25.173 1.00 43.45 ? 56 LYS E CE 1 +ATOM 23159 N NZ . LYS E 1 56 ? -30.295 8.645 24.100 1.00 43.72 ? 56 LYS E NZ 1 +ATOM 23160 N N . SER E 1 57 ? -32.243 5.877 27.178 1.00 39.04 ? 57 SER E N 1 +ATOM 23161 C CA . SER E 1 57 ? -31.871 4.590 26.623 1.00 40.13 ? 57 SER E CA 1 +ATOM 23162 C C . SER E 1 57 ? -30.656 4.809 25.726 1.00 40.06 ? 57 SER E C 1 +ATOM 23163 O O . SER E 1 57 ? -30.370 5.932 25.315 1.00 38.74 ? 57 SER E O 1 +ATOM 23164 C CB . SER E 1 57 ? -33.018 3.999 25.805 1.00 40.82 ? 57 SER E CB 1 +ATOM 23165 O OG . SER E 1 57 ? -33.173 4.699 24.584 1.00 43.25 ? 57 SER E OG 1 +ATOM 23166 N N . LEU E 1 58 ? -29.953 3.726 25.425 1.00 40.08 ? 58 LEU E N 1 +ATOM 23167 C CA . LEU E 1 58 ? -28.772 3.782 24.590 1.00 41.25 ? 58 LEU E CA 1 +ATOM 23168 C C . LEU E 1 58 ? -28.813 2.604 23.632 1.00 43.34 ? 58 LEU E C 1 +ATOM 23169 O O . LEU E 1 58 ? -28.756 1.456 24.062 1.00 45.88 ? 58 LEU E O 1 +ATOM 23170 C CB . LEU E 1 58 ? -27.518 3.699 25.461 1.00 39.69 ? 58 LEU E CB 1 +ATOM 23171 C CG . LEU E 1 58 ? -26.166 3.792 24.754 1.00 38.54 ? 58 LEU E CG 1 +ATOM 23172 C CD1 . LEU E 1 58 ? -25.954 5.206 24.251 1.00 36.98 ? 58 LEU E CD1 1 +ATOM 23173 C CD2 . LEU E 1 58 ? -25.063 3.396 25.713 1.00 37.30 ? 58 LEU E CD2 1 +ATOM 23174 N N . ASP E 1 59 ? -28.918 2.883 22.339 1.00 44.76 ? 59 ASP E N 1 +ATOM 23175 C CA . ASP E 1 59 ? -28.963 1.826 21.339 1.00 47.11 ? 59 ASP E CA 1 +ATOM 23176 C C . ASP E 1 59 ? -27.568 1.362 20.935 1.00 46.73 ? 59 ASP E C 1 +ATOM 23177 O O . ASP E 1 59 ? -26.591 2.087 21.112 1.00 46.16 ? 59 ASP E O 1 +ATOM 23178 C CB . ASP E 1 59 ? -29.728 2.304 20.106 1.00 50.32 ? 59 ASP E CB 1 +ATOM 23179 C CG . ASP E 1 59 ? -31.154 2.715 20.433 1.00 57.13 ? 59 ASP E CG 1 +ATOM 23180 O OD1 . ASP E 1 59 ? -31.826 1.980 21.195 1.00 59.86 ? 59 ASP E OD1 1 +ATOM 23181 O OD2 . ASP E 1 59 ? -31.612 3.766 19.923 1.00 61.07 ? 59 ASP E OD2 1 +ATOM 23182 N N . LEU E 1 60 ? -27.480 0.151 20.391 1.00 46.65 ? 60 LEU E N 1 +ATOM 23183 C CA . LEU E 1 60 ? -26.204 -0.408 19.961 1.00 46.97 ? 60 LEU E CA 1 +ATOM 23184 C C . LEU E 1 60 ? -25.424 0.497 19.017 1.00 47.21 ? 60 LEU E C 1 +ATOM 23185 O O . LEU E 1 60 ? -24.214 0.665 19.169 1.00 46.89 ? 60 LEU E O 1 +ATOM 23186 C CB . LEU E 1 60 ? -26.413 -1.757 19.274 1.00 47.98 ? 60 LEU E CB 1 +ATOM 23187 C CG . LEU E 1 60 ? -26.732 -2.961 20.157 1.00 49.55 ? 60 LEU E CG 1 +ATOM 23188 C CD1 . LEU E 1 60 ? -26.892 -4.191 19.283 1.00 49.57 ? 60 LEU E CD1 1 +ATOM 23189 C CD2 . LEU E 1 60 ? -25.609 -3.173 21.164 1.00 48.92 ? 60 LEU E CD2 1 +ATOM 23190 N N . LYS E 1 61 ? -26.116 1.073 18.041 1.00 47.54 ? 61 LYS E N 1 +ATOM 23191 C CA . LYS E 1 61 ? -25.472 1.944 17.060 1.00 48.46 ? 61 LYS E CA 1 +ATOM 23192 C C . LYS E 1 61 ? -25.415 3.415 17.467 1.00 46.39 ? 61 LYS E C 1 +ATOM 23193 O O . LYS E 1 61 ? -24.894 4.238 16.723 1.00 48.67 ? 61 LYS E O 1 +ATOM 23194 C CB . LYS E 1 61 ? -26.191 1.834 15.716 1.00 51.35 ? 61 LYS E CB 1 +ATOM 23195 C CG . LYS E 1 61 ? -26.129 0.458 15.066 1.00 56.05 ? 61 LYS E CG 1 +ATOM 23196 C CD . LYS E 1 61 ? -24.770 0.186 14.440 1.00 59.66 ? 61 LYS E CD 1 +ATOM 23197 C CE . LYS E 1 61 ? -24.844 -0.997 13.467 1.00 62.04 ? 61 LYS E CE 1 +ATOM 23198 N NZ . LYS E 1 61 ? -23.545 -1.239 12.760 1.00 64.43 ? 61 LYS E NZ 1 +ATOM 23199 N N . GLU E 1 62 ? -25.952 3.746 18.635 1.00 43.60 ? 62 GLU E N 1 +ATOM 23200 C CA . GLU E 1 62 ? -25.954 5.124 19.120 1.00 41.25 ? 62 GLU E CA 1 +ATOM 23201 C C . GLU E 1 62 ? -24.560 5.613 19.544 1.00 39.55 ? 62 GLU E C 1 +ATOM 23202 O O . GLU E 1 62 ? -23.811 4.889 20.189 1.00 38.71 ? 62 GLU E O 1 +ATOM 23203 C CB . GLU E 1 62 ? -26.925 5.240 20.292 1.00 39.93 ? 62 GLU E CB 1 +ATOM 23204 C CG . GLU E 1 62 ? -27.118 6.635 20.823 1.00 41.78 ? 62 GLU E CG 1 +ATOM 23205 C CD . GLU E 1 62 ? -28.298 6.725 21.770 1.00 43.56 ? 62 GLU E CD 1 +ATOM 23206 O OE1 . GLU E 1 62 ? -29.003 5.705 21.950 1.00 44.13 ? 62 GLU E OE1 1 +ATOM 23207 O OE2 . GLU E 1 62 ? -28.524 7.817 22.328 1.00 44.63 ? 62 GLU E OE2 1 +ATOM 23208 N N . HIS E 1 63 ? -24.215 6.842 19.174 1.00 38.17 ? 63 HIS E N 1 +ATOM 23209 C CA . HIS E 1 63 ? -22.922 7.416 19.538 1.00 36.58 ? 63 HIS E CA 1 +ATOM 23210 C C . HIS E 1 63 ? -23.092 8.472 20.615 1.00 35.75 ? 63 HIS E C 1 +ATOM 23211 O O . HIS E 1 63 ? -24.067 9.216 20.616 1.00 36.40 ? 63 HIS E O 1 +ATOM 23212 C CB . HIS E 1 63 ? -22.250 8.064 18.329 1.00 35.09 ? 63 HIS E CB 1 +ATOM 23213 C CG . HIS E 1 63 ? -22.144 7.160 17.148 1.00 35.36 ? 63 HIS E CG 1 +ATOM 23214 N ND1 . HIS E 1 63 ? -21.361 6.027 17.145 1.00 36.14 ? 63 HIS E ND1 1 +ATOM 23215 C CD2 . HIS E 1 63 ? -22.743 7.208 15.935 1.00 37.22 ? 63 HIS E CD2 1 +ATOM 23216 C CE1 . HIS E 1 63 ? -21.481 5.415 15.981 1.00 37.32 ? 63 HIS E CE1 1 +ATOM 23217 N NE2 . HIS E 1 63 ? -22.315 6.111 15.228 1.00 37.96 ? 63 HIS E NE2 1 +ATOM 23218 N N . ILE E 1 64 ? -22.143 8.517 21.541 1.00 34.86 ? 64 ILE E N 1 +ATOM 23219 C CA . ILE E 1 64 ? -22.158 9.491 22.618 1.00 32.90 ? 64 ILE E CA 1 +ATOM 23220 C C . ILE E 1 64 ? -20.823 10.218 22.542 1.00 33.13 ? 64 ILE E C 1 +ATOM 23221 O O . ILE E 1 64 ? -19.753 9.591 22.603 1.00 30.83 ? 64 ILE E O 1 +ATOM 23222 C CB . ILE E 1 64 ? -22.295 8.821 24.001 1.00 33.32 ? 64 ILE E CB 1 +ATOM 23223 C CG1 . ILE E 1 64 ? -23.576 7.978 24.051 1.00 32.32 ? 64 ILE E CG1 1 +ATOM 23224 C CG2 . ILE E 1 64 ? -22.305 9.898 25.104 1.00 31.13 ? 64 ILE E CG2 1 +ATOM 23225 C CD1 . ILE E 1 64 ? -24.858 8.767 23.910 1.00 32.81 ? 64 ILE E CD1 1 +ATOM 23226 N N . ILE E 1 65 ? -20.884 11.537 22.397 1.00 32.31 ? 65 ILE E N 1 +ATOM 23227 C CA . ILE E 1 65 ? -19.676 12.338 22.292 1.00 31.26 ? 65 ILE E CA 1 +ATOM 23228 C C . ILE E 1 65 ? -19.745 13.505 23.254 1.00 31.81 ? 65 ILE E C 1 +ATOM 23229 O O . ILE E 1 65 ? -20.806 13.801 23.802 1.00 31.91 ? 65 ILE E O 1 +ATOM 23230 C CB . ILE E 1 65 ? -19.498 12.857 20.856 1.00 30.94 ? 65 ILE E CB 1 +ATOM 23231 C CG1 . ILE E 1 65 ? -20.666 13.772 20.486 1.00 32.01 ? 65 ILE E CG1 1 +ATOM 23232 C CG2 . ILE E 1 65 ? -19.425 11.679 19.886 1.00 27.74 ? 65 ILE E CG2 1 +ATOM 23233 C CD1 . ILE E 1 65 ? -20.619 14.286 19.066 1.00 31.49 ? 65 ILE E CD1 1 +ATOM 23234 N N . GLY E 1 66 ? -18.610 14.160 23.477 1.00 33.04 ? 66 GLY E N 1 +ATOM 23235 C CA . GLY E 1 66 ? -18.590 15.289 24.388 1.00 32.78 ? 66 GLY E CA 1 +ATOM 23236 C C . GLY E 1 66 ? -17.907 15.011 25.714 1.00 33.83 ? 66 GLY E C 1 +ATOM 23237 O O . GLY E 1 66 ? -16.922 14.271 25.783 1.00 33.83 ? 66 GLY E O 1 +ATOM 23238 N N . LEU E 1 67 ? -18.452 15.607 26.772 1.00 34.05 ? 67 LEU E N 1 +ATOM 23239 C CA . LEU E 1 67 ? -17.922 15.487 28.126 1.00 33.38 ? 67 LEU E CA 1 +ATOM 23240 C C . LEU E 1 67 ? -16.590 16.221 28.290 1.00 33.00 ? 67 LEU E C 1 +ATOM 23241 O O . LEU E 1 67 ? -15.904 16.075 29.293 1.00 35.41 ? 67 LEU E O 1 +ATOM 23242 C CB . LEU E 1 67 ? -17.781 14.017 28.519 1.00 32.81 ? 67 LEU E CB 1 +ATOM 23243 C CG . LEU E 1 67 ? -19.115 13.271 28.579 1.00 34.87 ? 67 LEU E CG 1 +ATOM 23244 C CD1 . LEU E 1 67 ? -18.876 11.900 29.167 1.00 34.92 ? 67 LEU E CD1 1 +ATOM 23245 C CD2 . LEU E 1 67 ? -20.126 14.036 29.425 1.00 34.17 ? 67 LEU E CD2 1 +ATOM 23246 N N . GLY E 1 68 ? -16.229 17.009 27.291 1.00 31.76 ? 68 GLY E N 1 +ATOM 23247 C CA . GLY E 1 68 ? -15.012 17.785 27.353 1.00 32.31 ? 68 GLY E CA 1 +ATOM 23248 C C . GLY E 1 68 ? -13.673 17.079 27.338 1.00 33.80 ? 68 GLY E C 1 +ATOM 23249 O O . GLY E 1 68 ? -13.407 16.216 26.510 1.00 34.04 ? 68 GLY E O 1 +ATOM 23250 N N . GLU E 1 69 ? -12.826 17.463 28.284 1.00 34.02 ? 69 GLU E N 1 +ATOM 23251 C CA . GLU E 1 69 ? -11.480 16.932 28.404 1.00 35.52 ? 69 GLU E CA 1 +ATOM 23252 C C . GLU E 1 69 ? -11.427 15.539 29.044 1.00 34.59 ? 69 GLU E C 1 +ATOM 23253 O O . GLU E 1 69 ? -11.328 15.414 30.257 1.00 35.05 ? 69 GLU E O 1 +ATOM 23254 C CB . GLU E 1 69 ? -10.656 17.926 29.222 1.00 37.13 ? 69 GLU E CB 1 +ATOM 23255 C CG . GLU E 1 69 ? -9.161 17.757 29.165 1.00 39.07 ? 69 GLU E CG 1 +ATOM 23256 C CD . GLU E 1 69 ? -8.459 18.799 30.016 1.00 40.92 ? 69 GLU E CD 1 +ATOM 23257 O OE1 . GLU E 1 69 ? -8.549 18.708 31.262 1.00 42.30 ? 69 GLU E OE1 1 +ATOM 23258 O OE2 . GLU E 1 69 ? -7.836 19.720 29.443 1.00 41.28 ? 69 GLU E OE2 1 +ATOM 23259 N N . LYS E 1 70 ? -11.474 14.496 28.224 1.00 34.23 ? 70 LYS E N 1 +ATOM 23260 C CA . LYS E 1 70 ? -11.429 13.123 28.729 1.00 32.09 ? 70 LYS E CA 1 +ATOM 23261 C C . LYS E 1 70 ? -10.310 12.334 28.072 1.00 31.31 ? 70 LYS E C 1 +ATOM 23262 O O . LYS E 1 70 ? -10.149 12.369 26.849 1.00 29.66 ? 70 LYS E O 1 +ATOM 23263 C CB . LYS E 1 70 ? -12.764 12.415 28.473 1.00 31.87 ? 70 LYS E CB 1 +ATOM 23264 C CG . LYS E 1 70 ? -13.940 13.015 29.232 1.00 31.92 ? 70 LYS E CG 1 +ATOM 23265 C CD . LYS E 1 70 ? -13.678 12.991 30.723 1.00 33.36 ? 70 LYS E CD 1 +ATOM 23266 C CE . LYS E 1 70 ? -14.824 13.599 31.491 1.00 33.58 ? 70 LYS E CE 1 +ATOM 23267 N NZ . LYS E 1 70 ? -14.483 13.708 32.933 1.00 36.76 ? 70 LYS E NZ 1 +ATOM 23268 N N . ALA E 1 71 ? -9.536 11.623 28.887 1.00 29.51 ? 71 ALA E N 1 +ATOM 23269 C CA . ALA E 1 71 ? -8.431 10.828 28.373 1.00 29.36 ? 71 ALA E CA 1 +ATOM 23270 C C . ALA E 1 71 ? -8.962 9.491 27.823 1.00 28.60 ? 71 ALA E C 1 +ATOM 23271 O O . ALA E 1 71 ? -8.464 8.422 28.169 1.00 27.24 ? 71 ALA E O 1 +ATOM 23272 C CB . ALA E 1 71 ? -7.404 10.591 29.488 1.00 28.85 ? 71 ALA E CB 1 +ATOM 23273 N N . PHE E 1 72 ? -9.978 9.574 26.964 1.00 28.66 ? 72 PHE E N 1 +ATOM 23274 C CA . PHE E 1 72 ? -10.614 8.402 26.371 1.00 28.44 ? 72 PHE E CA 1 +ATOM 23275 C C . PHE E 1 72 ? -10.982 8.602 24.903 1.00 30.35 ? 72 PHE E C 1 +ATOM 23276 O O . PHE E 1 72 ? -10.889 9.706 24.355 1.00 31.30 ? 72 PHE E O 1 +ATOM 23277 C CB . PHE E 1 72 ? -11.900 8.054 27.132 1.00 27.75 ? 72 PHE E CB 1 +ATOM 23278 C CG . PHE E 1 72 ? -11.671 7.568 28.529 1.00 27.86 ? 72 PHE E CG 1 +ATOM 23279 C CD1 . PHE E 1 72 ? -11.373 8.461 29.550 1.00 26.06 ? 72 PHE E CD1 1 +ATOM 23280 C CD2 . PHE E 1 72 ? -11.726 6.200 28.819 1.00 28.75 ? 72 PHE E CD2 1 +ATOM 23281 C CE1 . PHE E 1 72 ? -11.129 8.008 30.843 1.00 25.73 ? 72 PHE E CE1 1 +ATOM 23282 C CE2 . PHE E 1 72 ? -11.484 5.733 30.111 1.00 26.43 ? 72 PHE E CE2 1 +ATOM 23283 C CZ . PHE E 1 72 ? -11.184 6.639 31.125 1.00 27.22 ? 72 PHE E CZ 1 +ATOM 23284 N N . GLU E 1 73 ? -11.415 7.519 24.272 1.00 30.73 ? 73 GLU E N 1 +ATOM 23285 C CA . GLU E 1 73 ? -11.844 7.569 22.885 1.00 32.24 ? 73 GLU E CA 1 +ATOM 23286 C C . GLU E 1 73 ? -12.991 8.591 22.772 1.00 32.54 ? 73 GLU E C 1 +ATOM 23287 O O . GLU E 1 73 ? -13.745 8.797 23.724 1.00 30.57 ? 73 GLU E O 1 +ATOM 23288 C CB . GLU E 1 73 ? -12.337 6.183 22.439 1.00 32.73 ? 73 GLU E CB 1 +ATOM 23289 C CG . GLU E 1 73 ? -11.259 5.097 22.289 1.00 33.86 ? 73 GLU E CG 1 +ATOM 23290 C CD . GLU E 1 73 ? -10.613 4.674 23.609 1.00 35.71 ? 73 GLU E CD 1 +ATOM 23291 O OE1 . GLU E 1 73 ? -11.240 4.839 24.675 1.00 34.31 ? 73 GLU E OE1 1 +ATOM 23292 O OE2 . GLU E 1 73 ? -9.475 4.155 23.578 1.00 37.94 ? 73 GLU E OE2 1 +ATOM 23293 N N . LEU E 1 74 ? -13.116 9.221 21.606 1.00 34.16 ? 74 LEU E N 1 +ATOM 23294 C CA . LEU E 1 74 ? -14.148 10.218 21.360 1.00 35.16 ? 74 LEU E CA 1 +ATOM 23295 C C . LEU E 1 74 ? -15.573 9.690 21.532 1.00 35.17 ? 74 LEU E C 1 +ATOM 23296 O O . LEU E 1 74 ? -16.453 10.429 21.977 1.00 35.15 ? 74 LEU E O 1 +ATOM 23297 C CB . LEU E 1 74 ? -13.943 10.833 19.971 1.00 36.10 ? 74 LEU E CB 1 +ATOM 23298 C CG . LEU E 1 74 ? -13.222 12.188 19.898 1.00 36.78 ? 74 LEU E CG 1 +ATOM 23299 C CD1 . LEU E 1 74 ? -12.437 12.482 21.164 1.00 33.47 ? 74 LEU E CD1 1 +ATOM 23300 C CD2 . LEU E 1 74 ? -12.332 12.192 18.668 1.00 36.26 ? 74 LEU E CD2 1 +ATOM 23301 N N . ASP E 1 75 ? -15.813 8.430 21.178 1.00 35.59 ? 75 ASP E N 1 +ATOM 23302 C CA . ASP E 1 75 ? -17.140 7.840 21.388 1.00 37.14 ? 75 ASP E CA 1 +ATOM 23303 C C . ASP E 1 75 ? -17.026 7.346 22.824 1.00 35.23 ? 75 ASP E C 1 +ATOM 23304 O O . ASP E 1 75 ? -16.276 6.422 23.104 1.00 34.71 ? 75 ASP E O 1 +ATOM 23305 C CB . ASP E 1 75 ? -17.398 6.661 20.443 1.00 42.29 ? 75 ASP E CB 1 +ATOM 23306 C CG . ASP E 1 75 ? -18.872 6.231 20.433 1.00 48.03 ? 75 ASP E CG 1 +ATOM 23307 O OD1 . ASP E 1 75 ? -19.496 6.173 21.522 1.00 49.88 ? 75 ASP E OD1 1 +ATOM 23308 O OD2 . ASP E 1 75 ? -19.408 5.938 19.338 1.00 51.27 ? 75 ASP E OD2 1 +ATOM 23309 N N . ARG E 1 76 ? -17.780 7.968 23.722 1.00 35.63 ? 76 ARG E N 1 +ATOM 23310 C CA . ARG E 1 76 ? -17.711 7.693 25.151 1.00 34.30 ? 76 ARG E CA 1 +ATOM 23311 C C . ARG E 1 76 ? -18.378 6.471 25.762 1.00 35.91 ? 76 ARG E C 1 +ATOM 23312 O O . ARG E 1 76 ? -18.316 6.298 26.981 1.00 36.55 ? 76 ARG E O 1 +ATOM 23313 C CB . ARG E 1 76 ? -18.207 8.922 25.914 1.00 33.19 ? 76 ARG E CB 1 +ATOM 23314 C CG . ARG E 1 76 ? -17.656 10.255 25.425 1.00 33.14 ? 76 ARG E CG 1 +ATOM 23315 C CD . ARG E 1 76 ? -16.137 10.329 25.463 1.00 31.19 ? 76 ARG E CD 1 +ATOM 23316 N NE . ARG E 1 76 ? -15.699 11.721 25.470 1.00 32.00 ? 76 ARG E NE 1 +ATOM 23317 C CZ . ARG E 1 76 ? -14.447 12.126 25.272 1.00 31.54 ? 76 ARG E CZ 1 +ATOM 23318 N NH1 . ARG E 1 76 ? -13.475 11.243 25.040 1.00 29.60 ? 76 ARG E NH1 1 +ATOM 23319 N NH2 . ARG E 1 76 ? -14.172 13.420 25.318 1.00 29.24 ? 76 ARG E NH2 1 +ATOM 23320 N N . LYS E 1 77 ? -19.006 5.620 24.962 1.00 36.18 ? 77 LYS E N 1 +ATOM 23321 C CA . LYS E 1 77 ? -19.679 4.448 25.525 1.00 37.03 ? 77 LYS E CA 1 +ATOM 23322 C C . LYS E 1 77 ? -18.800 3.494 26.343 1.00 35.83 ? 77 LYS E C 1 +ATOM 23323 O O . LYS E 1 77 ? -17.599 3.386 26.117 1.00 36.19 ? 77 LYS E O 1 +ATOM 23324 C CB . LYS E 1 77 ? -20.372 3.670 24.405 1.00 39.15 ? 77 LYS E CB 1 +ATOM 23325 C CG . LYS E 1 77 ? -21.501 4.458 23.742 1.00 44.57 ? 77 LYS E CG 1 +ATOM 23326 C CD . LYS E 1 77 ? -21.901 3.864 22.399 1.00 46.80 ? 77 LYS E CD 1 +ATOM 23327 C CE . LYS E 1 77 ? -22.647 2.564 22.562 1.00 49.39 ? 77 LYS E CE 1 +ATOM 23328 N NZ . LYS E 1 77 ? -23.053 2.024 21.234 1.00 53.34 ? 77 LYS E NZ 1 +ATOM 23329 N N . ARG E 1 78 ? -19.433 2.815 27.300 1.00 34.76 ? 78 ARG E N 1 +ATOM 23330 C CA . ARG E 1 78 ? -18.803 1.816 28.166 1.00 34.84 ? 78 ARG E CA 1 +ATOM 23331 C C . ARG E 1 78 ? -17.814 2.376 29.181 1.00 35.06 ? 78 ARG E C 1 +ATOM 23332 O O . ARG E 1 78 ? -16.722 1.832 29.363 1.00 33.74 ? 78 ARG E O 1 +ATOM 23333 C CB . ARG E 1 78 ? -18.105 0.741 27.324 1.00 33.25 ? 78 ARG E CB 1 +ATOM 23334 C CG . ARG E 1 78 ? -18.910 0.260 26.133 1.00 35.48 ? 78 ARG E CG 1 +ATOM 23335 C CD . ARG E 1 78 ? -20.341 -0.115 26.510 1.00 36.11 ? 78 ARG E CD 1 +ATOM 23336 N NE . ARG E 1 78 ? -21.135 -0.364 25.310 1.00 37.40 ? 78 ARG E NE 1 +ATOM 23337 C CZ . ARG E 1 78 ? -22.465 -0.356 25.272 1.00 37.02 ? 78 ARG E CZ 1 +ATOM 23338 N NH1 . ARG E 1 78 ? -23.168 -0.111 26.369 1.00 35.83 ? 78 ARG E NH1 1 +ATOM 23339 N NH2 . ARG E 1 78 ? -23.093 -0.592 24.132 1.00 38.67 ? 78 ARG E NH2 1 +ATOM 23340 N N . LYS E 1 79 ? -18.205 3.447 29.854 1.00 33.43 ? 79 LYS E N 1 +ATOM 23341 C CA . LYS E 1 79 ? -17.337 4.059 30.842 1.00 33.97 ? 79 LYS E CA 1 +ATOM 23342 C C . LYS E 1 79 ? -18.178 4.922 31.761 1.00 32.88 ? 79 LYS E C 1 +ATOM 23343 O O . LYS E 1 79 ? -19.197 5.473 31.341 1.00 32.42 ? 79 LYS E O 1 +ATOM 23344 C CB . LYS E 1 79 ? -16.267 4.920 30.155 1.00 35.29 ? 79 LYS E CB 1 +ATOM 23345 C CG . LYS E 1 79 ? -15.165 5.377 31.091 1.00 39.52 ? 79 LYS E CG 1 +ATOM 23346 C CD . LYS E 1 79 ? -14.386 4.172 31.608 1.00 44.77 ? 79 LYS E CD 1 +ATOM 23347 C CE . LYS E 1 79 ? -13.500 4.527 32.811 1.00 47.62 ? 79 LYS E CE 1 +ATOM 23348 N NZ . LYS E 1 79 ? -12.716 3.325 33.273 1.00 48.84 ? 79 LYS E NZ 1 +ATOM 23349 N N . ARG E 1 80 ? -17.765 5.016 33.018 1.00 31.05 ? 80 ARG E N 1 +ATOM 23350 C CA . ARG E 1 80 ? -18.471 5.826 34.001 1.00 31.15 ? 80 ARG E CA 1 +ATOM 23351 C C . ARG E 1 80 ? -17.568 7.038 34.243 1.00 31.68 ? 80 ARG E C 1 +ATOM 23352 O O . ARG E 1 80 ? -16.505 6.917 34.841 1.00 32.99 ? 80 ARG E O 1 +ATOM 23353 C CB A ARG E 1 80 ? -18.693 5.040 35.294 0.50 30.15 ? 80 ARG E CB 1 +ATOM 23354 C CB B ARG E 1 80 ? -18.658 5.010 35.286 0.50 30.68 ? 80 ARG E CB 1 +ATOM 23355 C CG A ARG E 1 80 ? -19.608 5.723 36.318 0.50 29.47 ? 80 ARG E CG 1 +ATOM 23356 C CG B ARG E 1 80 ? -19.067 5.791 36.540 0.50 31.04 ? 80 ARG E CG 1 +ATOM 23357 C CD A ARG E 1 80 ? -19.570 4.955 37.643 0.50 29.54 ? 80 ARG E CD 1 +ATOM 23358 C CD B ARG E 1 80 ? -19.106 4.842 37.752 0.50 30.85 ? 80 ARG E CD 1 +ATOM 23359 N NE A ARG E 1 80 ? -20.457 5.491 38.677 0.50 28.61 ? 80 ARG E NE 1 +ATOM 23360 N NE B ARG E 1 80 ? -19.397 5.509 39.025 0.50 30.90 ? 80 ARG E NE 1 +ATOM 23361 C CZ A ARG E 1 80 ? -21.767 5.267 38.740 0.50 28.05 ? 80 ARG E CZ 1 +ATOM 23362 C CZ B ARG E 1 80 ? -18.528 6.256 39.701 0.50 29.92 ? 80 ARG E CZ 1 +ATOM 23363 N NH1 A ARG E 1 80 ? -22.365 4.514 37.823 0.50 25.95 ? 80 ARG E NH1 1 +ATOM 23364 N NH1 B ARG E 1 80 ? -17.303 6.441 39.234 0.50 29.48 ? 80 ARG E NH1 1 +ATOM 23365 N NH2 A ARG E 1 80 ? -22.477 5.786 39.735 0.50 27.02 ? 80 ARG E NH2 1 +ATOM 23366 N NH2 B ARG E 1 80 ? -18.888 6.817 40.847 0.50 29.78 ? 80 ARG E NH2 1 +ATOM 23367 N N . TYR E 1 81 ? -17.981 8.202 33.749 1.00 31.97 ? 81 TYR E N 1 +ATOM 23368 C CA . TYR E 1 81 ? -17.171 9.419 33.897 1.00 32.20 ? 81 TYR E CA 1 +ATOM 23369 C C . TYR E 1 81 ? -17.545 10.260 35.095 1.00 32.75 ? 81 TYR E C 1 +ATOM 23370 O O . TYR E 1 81 ? -18.712 10.349 35.478 1.00 34.04 ? 81 TYR E O 1 +ATOM 23371 C CB . TYR E 1 81 ? -17.266 10.303 32.651 1.00 29.80 ? 81 TYR E CB 1 +ATOM 23372 C CG . TYR E 1 81 ? -16.922 9.585 31.359 1.00 27.31 ? 81 TYR E CG 1 +ATOM 23373 C CD1 . TYR E 1 81 ? -17.875 8.828 30.684 1.00 23.67 ? 81 TYR E CD1 1 +ATOM 23374 C CD2 . TYR E 1 81 ? -15.639 9.654 30.829 1.00 27.03 ? 81 TYR E CD2 1 +ATOM 23375 C CE1 . TYR E 1 81 ? -17.559 8.162 29.511 1.00 25.02 ? 81 TYR E CE1 1 +ATOM 23376 C CE2 . TYR E 1 81 ? -15.309 8.988 29.660 1.00 28.27 ? 81 TYR E CE2 1 +ATOM 23377 C CZ . TYR E 1 81 ? -16.276 8.243 29.005 1.00 25.75 ? 81 TYR E CZ 1 +ATOM 23378 O OH . TYR E 1 81 ? -15.948 7.567 27.858 1.00 23.45 ? 81 TYR E OH 1 +ATOM 23379 N N . VAL E 1 82 ? -16.536 10.877 35.690 1.00 32.68 ? 82 VAL E N 1 +ATOM 23380 C CA . VAL E 1 82 ? -16.741 11.740 36.839 1.00 32.97 ? 82 VAL E CA 1 +ATOM 23381 C C . VAL E 1 82 ? -16.389 13.162 36.411 1.00 32.62 ? 82 VAL E C 1 +ATOM 23382 O O . VAL E 1 82 ? -15.363 13.375 35.777 1.00 31.95 ? 82 VAL E O 1 +ATOM 23383 C CB . VAL E 1 82 ? -15.833 11.315 38.021 1.00 34.19 ? 82 VAL E CB 1 +ATOM 23384 C CG1 . VAL E 1 82 ? -15.936 12.322 39.139 1.00 35.19 ? 82 VAL E CG1 1 +ATOM 23385 C CG2 . VAL E 1 82 ? -16.248 9.946 38.533 1.00 33.86 ? 82 VAL E CG2 1 +ATOM 23386 N N . MET E 1 83 ? -17.251 14.125 36.724 1.00 34.34 ? 83 MET E N 1 +ATOM 23387 C CA . MET E 1 83 ? -16.969 15.516 36.378 1.00 35.57 ? 83 MET E CA 1 +ATOM 23388 C C . MET E 1 83 ? -16.558 16.234 37.651 1.00 34.09 ? 83 MET E C 1 +ATOM 23389 O O . MET E 1 83 ? -17.410 16.687 38.409 1.00 32.72 ? 83 MET E O 1 +ATOM 23390 C CB . MET E 1 83 ? -18.201 16.209 35.781 1.00 39.69 ? 83 MET E CB 1 +ATOM 23391 C CG . MET E 1 83 ? -18.811 15.514 34.553 1.00 45.32 ? 83 MET E CG 1 +ATOM 23392 S SD . MET E 1 83 ? -17.704 15.344 33.119 1.00 48.31 ? 83 MET E SD 1 +ATOM 23393 C CE . MET E 1 83 ? -17.587 17.048 32.643 1.00 46.78 ? 83 MET E CE 1 +ATOM 23394 N N . TYR E 1 84 ? -15.252 16.328 37.886 1.00 31.81 ? 84 TYR E N 1 +ATOM 23395 C CA . TYR E 1 84 ? -14.741 16.992 39.079 1.00 30.92 ? 84 TYR E CA 1 +ATOM 23396 C C . TYR E 1 84 ? -13.336 17.508 38.781 1.00 30.41 ? 84 TYR E C 1 +ATOM 23397 O O . TYR E 1 84 ? -12.393 16.725 38.712 1.00 29.63 ? 84 TYR E O 1 +ATOM 23398 C CB . TYR E 1 84 ? -14.699 16.001 40.243 1.00 30.75 ? 84 TYR E CB 1 +ATOM 23399 C CG . TYR E 1 84 ? -14.920 16.627 41.601 1.00 32.83 ? 84 TYR E CG 1 +ATOM 23400 C CD1 . TYR E 1 84 ? -16.074 17.364 41.865 1.00 34.37 ? 84 TYR E CD1 1 +ATOM 23401 C CD2 . TYR E 1 84 ? -13.993 16.463 42.631 1.00 33.85 ? 84 TYR E CD2 1 +ATOM 23402 C CE1 . TYR E 1 84 ? -16.305 17.922 43.116 1.00 36.26 ? 84 TYR E CE1 1 +ATOM 23403 C CE2 . TYR E 1 84 ? -14.208 17.017 43.888 1.00 34.66 ? 84 TYR E CE2 1 +ATOM 23404 C CZ . TYR E 1 84 ? -15.368 17.748 44.123 1.00 37.36 ? 84 TYR E CZ 1 +ATOM 23405 O OH . TYR E 1 84 ? -15.586 18.342 45.345 1.00 39.08 ? 84 TYR E OH 1 +ATOM 23406 N N . ASN E 1 85 ? -13.205 18.818 38.592 1.00 28.92 ? 85 ASN E N 1 +ATOM 23407 C CA . ASN E 1 85 ? -11.912 19.422 38.289 1.00 28.23 ? 85 ASN E CA 1 +ATOM 23408 C C . ASN E 1 85 ? -10.861 18.943 39.274 1.00 29.25 ? 85 ASN E C 1 +ATOM 23409 O O . ASN E 1 85 ? -11.046 19.061 40.490 1.00 30.07 ? 85 ASN E O 1 +ATOM 23410 C CB . ASN E 1 85 ? -11.987 20.945 38.386 1.00 29.83 ? 85 ASN E CB 1 +ATOM 23411 C CG . ASN E 1 85 ? -12.860 21.565 37.320 1.00 29.66 ? 85 ASN E CG 1 +ATOM 23412 O OD1 . ASN E 1 85 ? -13.425 20.871 36.475 1.00 31.11 ? 85 ASN E OD1 1 +ATOM 23413 N ND2 . ASN E 1 85 ? -12.979 22.886 37.357 1.00 28.43 ? 85 ASN E ND2 1 +ATOM 23414 N N . VAL E 1 86 ? -9.751 18.432 38.764 1.00 27.56 ? 86 VAL E N 1 +ATOM 23415 C CA . VAL E 1 86 ? -8.703 17.959 39.639 1.00 30.03 ? 86 VAL E CA 1 +ATOM 23416 C C . VAL E 1 86 ? -7.331 18.103 39.007 1.00 30.61 ? 86 VAL E C 1 +ATOM 23417 O O . VAL E 1 86 ? -7.189 17.986 37.795 1.00 29.86 ? 86 VAL E O 1 +ATOM 23418 C CB . VAL E 1 86 ? -8.920 16.466 40.012 1.00 31.65 ? 86 VAL E CB 1 +ATOM 23419 C CG1 . VAL E 1 86 ? -8.580 15.575 38.829 1.00 30.49 ? 86 VAL E CG1 1 +ATOM 23420 C CG2 . VAL E 1 86 ? -8.059 16.103 41.217 1.00 32.03 ? 86 VAL E CG2 1 +ATOM 23421 N N . ASP E 1 87 ? -6.326 18.379 39.836 1.00 32.97 ? 87 ASP E N 1 +ATOM 23422 C CA . ASP E 1 87 ? -4.941 18.488 39.371 1.00 33.09 ? 87 ASP E CA 1 +ATOM 23423 C C . ASP E 1 87 ? -4.534 17.037 39.063 1.00 32.93 ? 87 ASP E C 1 +ATOM 23424 O O . ASP E 1 87 ? -4.240 16.256 39.973 1.00 31.47 ? 87 ASP E O 1 +ATOM 23425 C CB . ASP E 1 87 ? -4.061 19.051 40.483 1.00 35.63 ? 87 ASP E CB 1 +ATOM 23426 C CG . ASP E 1 87 ? -2.606 19.171 40.068 1.00 38.19 ? 87 ASP E CG 1 +ATOM 23427 O OD1 . ASP E 1 87 ? -2.059 18.199 39.520 1.00 41.22 ? 87 ASP E OD1 1 +ATOM 23428 O OD2 . ASP E 1 87 ? -1.999 20.234 40.292 1.00 41.88 ? 87 ASP E OD2 1 +ATOM 23429 N N . ALA E 1 88 ? -4.529 16.678 37.786 1.00 32.37 ? 88 ALA E N 1 +ATOM 23430 C CA . ALA E 1 88 ? -4.219 15.313 37.378 1.00 32.85 ? 88 ALA E CA 1 +ATOM 23431 C C . ALA E 1 88 ? -2.757 14.888 37.488 1.00 33.12 ? 88 ALA E C 1 +ATOM 23432 O O . ALA E 1 88 ? -2.448 13.712 37.353 1.00 33.71 ? 88 ALA E O 1 +ATOM 23433 C CB . ALA E 1 88 ? -4.719 15.089 35.954 1.00 33.40 ? 88 ALA E CB 1 +ATOM 23434 N N . GLY E 1 89 ? -1.857 15.829 37.738 1.00 33.26 ? 89 GLY E N 1 +ATOM 23435 C CA . GLY E 1 89 ? -0.451 15.477 37.833 1.00 32.95 ? 89 GLY E CA 1 +ATOM 23436 C C . GLY E 1 89 ? 0.054 14.974 36.492 1.00 32.90 ? 89 GLY E C 1 +ATOM 23437 O O . GLY E 1 89 ? -0.355 15.478 35.449 1.00 33.88 ? 89 GLY E O 1 +ATOM 23438 N N . ALA E 1 90 ? 0.939 13.984 36.508 1.00 31.41 ? 90 ALA E N 1 +ATOM 23439 C CA . ALA E 1 90 ? 1.474 13.422 35.275 1.00 32.65 ? 90 ALA E CA 1 +ATOM 23440 C C . ALA E 1 90 ? 0.470 12.376 34.771 1.00 33.19 ? 90 ALA E C 1 +ATOM 23441 O O . ALA E 1 90 ? 0.706 11.174 34.859 1.00 33.29 ? 90 ALA E O 1 +ATOM 23442 C CB . ALA E 1 90 ? 2.838 12.776 35.538 1.00 30.31 ? 90 ALA E CB 1 +ATOM 23443 N N . TYR E 1 91 ? -0.654 12.851 34.245 1.00 33.07 ? 91 TYR E N 1 +ATOM 23444 C CA . TYR E 1 91 ? -1.711 11.973 33.770 1.00 32.77 ? 91 TYR E CA 1 +ATOM 23445 C C . TYR E 1 91 ? -1.336 11.049 32.618 1.00 33.54 ? 91 TYR E C 1 +ATOM 23446 O O . TYR E 1 91 ? -0.481 11.354 31.786 1.00 33.24 ? 91 TYR E O 1 +ATOM 23447 C CB . TYR E 1 91 ? -2.938 12.802 33.387 1.00 32.07 ? 91 TYR E CB 1 +ATOM 23448 C CG . TYR E 1 91 ? -2.746 13.718 32.195 1.00 30.62 ? 91 TYR E CG 1 +ATOM 23449 C CD1 . TYR E 1 91 ? -2.909 13.249 30.891 1.00 31.62 ? 91 TYR E CD1 1 +ATOM 23450 C CD2 . TYR E 1 91 ? -2.420 15.063 32.372 1.00 30.19 ? 91 TYR E CD2 1 +ATOM 23451 C CE1 . TYR E 1 91 ? -2.754 14.106 29.791 1.00 31.03 ? 91 TYR E CE1 1 +ATOM 23452 C CE2 . TYR E 1 91 ? -2.266 15.920 31.291 1.00 29.27 ? 91 TYR E CE2 1 +ATOM 23453 C CZ . TYR E 1 91 ? -2.434 15.442 30.006 1.00 30.29 ? 91 TYR E CZ 1 +ATOM 23454 O OH . TYR E 1 91 ? -2.292 16.307 28.944 1.00 30.95 ? 91 TYR E OH 1 +ATOM 23455 N N . LYS E 1 92 ? -2.002 9.906 32.584 1.00 34.94 ? 92 LYS E N 1 +ATOM 23456 C CA . LYS E 1 92 ? -1.779 8.900 31.556 1.00 35.88 ? 92 LYS E CA 1 +ATOM 23457 C C . LYS E 1 92 ? -3.134 8.650 30.917 1.00 34.70 ? 92 LYS E C 1 +ATOM 23458 O O . LYS E 1 92 ? -4.155 9.142 31.407 1.00 33.10 ? 92 LYS E O 1 +ATOM 23459 C CB . LYS E 1 92 ? -1.268 7.608 32.190 1.00 39.60 ? 92 LYS E CB 1 +ATOM 23460 C CG . LYS E 1 92 ? -0.024 7.783 33.043 1.00 44.31 ? 92 LYS E CG 1 +ATOM 23461 C CD . LYS E 1 92 ? 0.334 6.489 33.770 1.00 49.70 ? 92 LYS E CD 1 +ATOM 23462 C CE . LYS E 1 92 ? 1.532 6.692 34.695 1.00 53.20 ? 92 LYS E CE 1 +ATOM 23463 N NZ . LYS E 1 92 ? 1.855 5.452 35.465 1.00 55.75 ? 92 LYS E NZ 1 +ATOM 23464 N N . LYS E 1 93 ? -3.170 7.882 29.837 1.00 33.45 ? 93 LYS E N 1 +ATOM 23465 C CA . LYS E 1 93 ? -4.459 7.649 29.223 1.00 33.05 ? 93 LYS E CA 1 +ATOM 23466 C C . LYS E 1 93 ? -5.353 6.826 30.128 1.00 31.22 ? 93 LYS E C 1 +ATOM 23467 O O . LYS E 1 93 ? -4.879 6.046 30.947 1.00 30.89 ? 93 LYS E O 1 +ATOM 23468 C CB . LYS E 1 93 ? -4.315 7.012 27.842 1.00 34.00 ? 93 LYS E CB 1 +ATOM 23469 C CG . LYS E 1 93 ? -3.782 5.615 27.777 1.00 36.80 ? 93 LYS E CG 1 +ATOM 23470 C CD . LYS E 1 93 ? -3.982 5.124 26.345 1.00 38.36 ? 93 LYS E CD 1 +ATOM 23471 C CE . LYS E 1 93 ? -3.445 3.726 26.130 1.00 43.00 ? 93 LYS E CE 1 +ATOM 23472 N NZ . LYS E 1 93 ? -3.668 3.288 24.720 1.00 44.51 ? 93 LYS E NZ 1 +ATOM 23473 N N . TYR E 1 94 ? -6.654 7.050 29.985 1.00 30.61 ? 94 TYR E N 1 +ATOM 23474 C CA . TYR E 1 94 ? -7.694 6.393 30.770 1.00 29.31 ? 94 TYR E CA 1 +ATOM 23475 C C . TYR E 1 94 ? -7.756 6.883 32.208 1.00 30.06 ? 94 TYR E C 1 +ATOM 23476 O O . TYR E 1 94 ? -8.431 6.298 33.045 1.00 32.03 ? 94 TYR E O 1 +ATOM 23477 C CB . TYR E 1 94 ? -7.563 4.865 30.713 1.00 27.84 ? 94 TYR E CB 1 +ATOM 23478 C CG . TYR E 1 94 ? -7.657 4.321 29.301 1.00 27.25 ? 94 TYR E CG 1 +ATOM 23479 C CD1 . TYR E 1 94 ? -8.453 4.955 28.347 1.00 28.48 ? 94 TYR E CD1 1 +ATOM 23480 C CD2 . TYR E 1 94 ? -6.949 3.187 28.913 1.00 27.45 ? 94 TYR E CD2 1 +ATOM 23481 C CE1 . TYR E 1 94 ? -8.537 4.480 27.045 1.00 27.64 ? 94 TYR E CE1 1 +ATOM 23482 C CE2 . TYR E 1 94 ? -7.028 2.699 27.608 1.00 27.80 ? 94 TYR E CE2 1 +ATOM 23483 C CZ . TYR E 1 94 ? -7.822 3.351 26.683 1.00 27.98 ? 94 TYR E CZ 1 +ATOM 23484 O OH . TYR E 1 94 ? -7.914 2.883 25.391 1.00 29.75 ? 94 TYR E OH 1 +ATOM 23485 N N . GLN E 1 95 ? -7.062 7.974 32.498 1.00 32.14 ? 95 GLN E N 1 +ATOM 23486 C CA . GLN E 1 95 ? -7.122 8.549 33.837 1.00 32.43 ? 95 GLN E CA 1 +ATOM 23487 C C . GLN E 1 95 ? -8.309 9.516 33.834 1.00 32.39 ? 95 GLN E C 1 +ATOM 23488 O O . GLN E 1 95 ? -8.509 10.240 32.868 1.00 30.88 ? 95 GLN E O 1 +ATOM 23489 C CB . GLN E 1 95 ? -5.848 9.316 34.152 1.00 32.75 ? 95 GLN E CB 1 +ATOM 23490 C CG . GLN E 1 95 ? -5.812 9.819 35.579 1.00 32.63 ? 95 GLN E CG 1 +ATOM 23491 C CD . GLN E 1 95 ? -4.494 10.463 35.910 1.00 33.80 ? 95 GLN E CD 1 +ATOM 23492 O OE1 . GLN E 1 95 ? -3.431 9.972 35.499 1.00 34.97 ? 95 GLN E OE1 1 +ATOM 23493 N NE2 . GLN E 1 95 ? -4.542 11.558 36.661 1.00 31.89 ? 95 GLN E NE2 1 +ATOM 23494 N N . ASP E 1 96 ? -9.078 9.534 34.918 1.00 33.91 ? 96 ASP E N 1 +ATOM 23495 C CA . ASP E 1 96 ? -10.263 10.384 35.022 1.00 34.91 ? 96 ASP E CA 1 +ATOM 23496 C C . ASP E 1 96 ? -10.477 10.640 36.507 1.00 34.22 ? 96 ASP E C 1 +ATOM 23497 O O . ASP E 1 96 ? -10.254 9.756 37.324 1.00 37.31 ? 96 ASP E O 1 +ATOM 23498 C CB . ASP E 1 96 ? -11.472 9.636 34.424 1.00 38.30 ? 96 ASP E CB 1 +ATOM 23499 C CG . ASP E 1 96 ? -12.746 10.488 34.358 1.00 43.24 ? 96 ASP E CG 1 +ATOM 23500 O OD1 . ASP E 1 96 ? -12.715 11.587 33.759 1.00 46.51 ? 96 ASP E OD1 1 +ATOM 23501 O OD2 . ASP E 1 96 ? -13.792 10.047 34.894 1.00 46.35 ? 96 ASP E OD2 1 +ATOM 23502 N N . PRO E 1 97 ? -10.894 11.855 36.881 1.00 32.98 ? 97 PRO E N 1 +ATOM 23503 C CA . PRO E 1 97 ? -11.164 12.986 35.988 1.00 33.11 ? 97 PRO E CA 1 +ATOM 23504 C C . PRO E 1 97 ? -9.898 13.809 35.744 1.00 33.27 ? 97 PRO E C 1 +ATOM 23505 O O . PRO E 1 97 ? -8.839 13.519 36.298 1.00 34.60 ? 97 PRO E O 1 +ATOM 23506 C CB . PRO E 1 97 ? -12.219 13.770 36.754 1.00 31.90 ? 97 PRO E CB 1 +ATOM 23507 C CG . PRO E 1 97 ? -11.726 13.632 38.176 1.00 33.40 ? 97 PRO E CG 1 +ATOM 23508 C CD . PRO E 1 97 ? -11.286 12.170 38.270 1.00 31.13 ? 97 PRO E CD 1 +ATOM 23509 N N . LEU E 1 98 ? -10.012 14.833 34.910 1.00 33.59 ? 98 LEU E N 1 +ATOM 23510 C CA . LEU E 1 98 ? -8.885 15.701 34.618 1.00 32.12 ? 98 LEU E CA 1 +ATOM 23511 C C . LEU E 1 98 ? -9.181 17.128 35.086 1.00 30.71 ? 98 LEU E C 1 +ATOM 23512 O O . LEU E 1 98 ? -9.969 17.324 35.997 1.00 28.67 ? 98 LEU E O 1 +ATOM 23513 C CB . LEU E 1 98 ? -8.546 15.653 33.126 1.00 31.50 ? 98 LEU E CB 1 +ATOM 23514 C CG . LEU E 1 98 ? -8.139 14.263 32.612 1.00 33.46 ? 98 LEU E CG 1 +ATOM 23515 C CD1 . LEU E 1 98 ? -7.919 14.334 31.113 1.00 33.48 ? 98 LEU E CD1 1 +ATOM 23516 C CD2 . LEU E 1 98 ? -6.870 13.759 33.319 1.00 33.57 ? 98 LEU E CD2 1 +ATOM 23517 N N . TYR E 1 99 ? -8.556 18.113 34.453 1.00 31.43 ? 99 TYR E N 1 +ATOM 23518 C CA . TYR E 1 99 ? -8.695 19.513 34.846 1.00 30.83 ? 99 TYR E CA 1 +ATOM 23519 C C . TYR E 1 99 ? -10.001 20.236 34.523 1.00 32.78 ? 99 TYR E C 1 +ATOM 23520 O O . TYR E 1 99 ? -10.422 21.120 35.280 1.00 33.00 ? 99 TYR E O 1 +ATOM 23521 C CB . TYR E 1 99 ? -7.573 20.326 34.220 1.00 28.80 ? 99 TYR E CB 1 +ATOM 23522 C CG . TYR E 1 99 ? -6.204 19.720 34.319 1.00 28.95 ? 99 TYR E CG 1 +ATOM 23523 C CD1 . TYR E 1 99 ? -5.432 19.863 35.475 1.00 30.63 ? 99 TYR E CD1 1 +ATOM 23524 C CD2 . TYR E 1 99 ? -5.642 19.072 33.232 1.00 29.60 ? 99 TYR E CD2 1 +ATOM 23525 C CE1 . TYR E 1 99 ? -4.125 19.384 35.535 1.00 31.17 ? 99 TYR E CE1 1 +ATOM 23526 C CE2 . TYR E 1 99 ? -4.340 18.587 33.276 1.00 32.18 ? 99 TYR E CE2 1 +ATOM 23527 C CZ . TYR E 1 99 ? -3.584 18.750 34.422 1.00 32.79 ? 99 TYR E CZ 1 +ATOM 23528 O OH . TYR E 1 99 ? -2.274 18.322 34.414 1.00 33.60 ? 99 TYR E OH 1 +ATOM 23529 N N . VAL E 1 100 ? -10.622 19.890 33.397 1.00 31.82 ? 100 VAL E N 1 +ATOM 23530 C CA . VAL E 1 100 ? -11.838 20.566 32.962 1.00 31.81 ? 100 VAL E CA 1 +ATOM 23531 C C . VAL E 1 100 ? -13.095 19.715 33.030 1.00 32.26 ? 100 VAL E C 1 +ATOM 23532 O O . VAL E 1 100 ? -13.053 18.520 32.744 1.00 32.70 ? 100 VAL E O 1 +ATOM 23533 C CB . VAL E 1 100 ? -11.672 21.078 31.511 1.00 31.59 ? 100 VAL E CB 1 +ATOM 23534 C CG1 . VAL E 1 100 ? -12.936 21.805 31.057 1.00 31.86 ? 100 VAL E CG1 1 +ATOM 23535 C CG2 . VAL E 1 100 ? -10.473 21.989 31.424 1.00 29.87 ? 100 VAL E CG2 1 +ATOM 23536 N N . SER E 1 101 ? -14.209 20.353 33.387 1.00 33.35 ? 101 SER E N 1 +ATOM 23537 C CA . SER E 1 101 ? -15.503 19.679 33.492 1.00 34.16 ? 101 SER E CA 1 +ATOM 23538 C C . SER E 1 101 ? -16.618 20.346 32.690 1.00 34.69 ? 101 SER E C 1 +ATOM 23539 O O . SER E 1 101 ? -17.179 21.341 33.143 1.00 36.05 ? 101 SER E O 1 +ATOM 23540 C CB . SER E 1 101 ? -15.950 19.616 34.954 1.00 35.19 ? 101 SER E CB 1 +ATOM 23541 O OG . SER E 1 101 ? -15.055 18.851 35.740 1.00 36.63 ? 101 SER E OG 1 +ATOM 23542 N N . ILE E 1 102 ? -16.929 19.810 31.508 1.00 32.44 ? 102 ILE E N 1 +ATOM 23543 C CA . ILE E 1 102 ? -18.016 20.337 30.685 1.00 32.05 ? 102 ILE E CA 1 +ATOM 23544 C C . ILE E 1 102 ? -19.099 19.243 30.692 1.00 31.87 ? 102 ILE E C 1 +ATOM 23545 O O . ILE E 1 102 ? -19.010 18.282 29.922 1.00 30.40 ? 102 ILE E O 1 +ATOM 23546 C CB . ILE E 1 102 ? -17.589 20.564 29.202 1.00 34.21 ? 102 ILE E CB 1 +ATOM 23547 C CG1 . ILE E 1 102 ? -16.244 21.298 29.116 1.00 33.93 ? 102 ILE E CG1 1 +ATOM 23548 C CG2 . ILE E 1 102 ? -18.666 21.381 28.472 1.00 32.14 ? 102 ILE E CG2 1 +ATOM 23549 C CD1 . ILE E 1 102 ? -16.278 22.726 29.558 1.00 33.75 ? 102 ILE E CD1 1 +ATOM 23550 N N . PRO E 1 103 ? -20.137 19.381 31.548 1.00 31.01 ? 103 PRO E N 1 +ATOM 23551 C CA . PRO E 1 103 ? -21.238 18.412 31.671 1.00 31.21 ? 103 PRO E CA 1 +ATOM 23552 C C . PRO E 1 103 ? -22.193 18.407 30.485 1.00 32.01 ? 103 PRO E C 1 +ATOM 23553 O O . PRO E 1 103 ? -23.409 18.519 30.655 1.00 33.42 ? 103 PRO E O 1 +ATOM 23554 C CB . PRO E 1 103 ? -21.958 18.843 32.950 1.00 30.57 ? 103 PRO E CB 1 +ATOM 23555 C CG . PRO E 1 103 ? -21.097 19.926 33.537 1.00 31.39 ? 103 PRO E CG 1 +ATOM 23556 C CD . PRO E 1 103 ? -20.409 20.555 32.382 1.00 28.55 ? 103 PRO E CD 1 +ATOM 23557 N N . LEU E 1 104 ? -21.638 18.271 29.290 1.00 32.56 ? 104 LEU E N 1 +ATOM 23558 C CA . LEU E 1 104 ? -22.424 18.250 28.065 1.00 33.67 ? 104 LEU E CA 1 +ATOM 23559 C C . LEU E 1 104 ? -22.088 17.034 27.220 1.00 34.38 ? 104 LEU E C 1 +ATOM 23560 O O . LEU E 1 104 ? -20.919 16.725 27.008 1.00 36.26 ? 104 LEU E O 1 +ATOM 23561 C CB . LEU E 1 104 ? -22.131 19.501 27.231 1.00 32.84 ? 104 LEU E CB 1 +ATOM 23562 C CG . LEU E 1 104 ? -22.496 19.438 25.743 1.00 33.09 ? 104 LEU E CG 1 +ATOM 23563 C CD1 . LEU E 1 104 ? -24.015 19.485 25.566 1.00 32.61 ? 104 LEU E CD1 1 +ATOM 23564 C CD2 . LEU E 1 104 ? -21.848 20.605 25.013 1.00 33.27 ? 104 LEU E CD2 1 +ATOM 23565 N N . PHE E 1 105 ? -23.105 16.326 26.748 1.00 33.65 ? 105 PHE E N 1 +ATOM 23566 C CA . PHE E 1 105 ? -22.844 15.207 25.862 1.00 32.51 ? 105 PHE E CA 1 +ATOM 23567 C C . PHE E 1 105 ? -23.863 15.244 24.732 1.00 32.94 ? 105 PHE E C 1 +ATOM 23568 O O . PHE E 1 105 ? -25.003 15.702 24.899 1.00 30.84 ? 105 PHE E O 1 +ATOM 23569 C CB . PHE E 1 105 ? -22.849 13.865 26.619 1.00 30.88 ? 105 PHE E CB 1 +ATOM 23570 C CG . PHE E 1 105 ? -24.211 13.316 26.938 1.00 31.85 ? 105 PHE E CG 1 +ATOM 23571 C CD1 . PHE E 1 105 ? -24.954 12.654 25.965 1.00 32.27 ? 105 PHE E CD1 1 +ATOM 23572 C CD2 . PHE E 1 105 ? -24.711 13.371 28.239 1.00 32.84 ? 105 PHE E CD2 1 +ATOM 23573 C CE1 . PHE E 1 105 ? -26.171 12.045 26.285 1.00 33.30 ? 105 PHE E CE1 1 +ATOM 23574 C CE2 . PHE E 1 105 ? -25.929 12.768 28.573 1.00 32.51 ? 105 PHE E CE2 1 +ATOM 23575 C CZ . PHE E 1 105 ? -26.657 12.102 27.596 1.00 33.01 ? 105 PHE E CZ 1 +ATOM 23576 N N . ILE E 1 106 ? -23.426 14.808 23.562 1.00 32.89 ? 106 ILE E N 1 +ATOM 23577 C CA . ILE E 1 106 ? -24.295 14.788 22.418 1.00 32.46 ? 106 ILE E CA 1 +ATOM 23578 C C . ILE E 1 106 ? -24.524 13.356 21.987 1.00 34.20 ? 106 ILE E C 1 +ATOM 23579 O O . ILE E 1 106 ? -23.596 12.543 21.920 1.00 32.62 ? 106 ILE E O 1 +ATOM 23580 C CB . ILE E 1 106 ? -23.694 15.586 21.256 1.00 31.98 ? 106 ILE E CB 1 +ATOM 23581 C CG1 . ILE E 1 106 ? -23.534 17.049 21.672 1.00 30.89 ? 106 ILE E CG1 1 +ATOM 23582 C CG2 . ILE E 1 106 ? -24.599 15.487 20.038 1.00 31.48 ? 106 ILE E CG2 1 +ATOM 23583 C CD1 . ILE E 1 106 ? -22.781 17.896 20.667 1.00 32.09 ? 106 ILE E CD1 1 +ATOM 23584 N N . SER E 1 107 ? -25.783 13.051 21.716 1.00 35.34 ? 107 SER E N 1 +ATOM 23585 C CA . SER E 1 107 ? -26.173 11.734 21.261 1.00 35.71 ? 107 SER E CA 1 +ATOM 23586 C C . SER E 1 107 ? -26.454 11.800 19.761 1.00 36.76 ? 107 SER E C 1 +ATOM 23587 O O . SER E 1 107 ? -27.104 12.723 19.283 1.00 37.83 ? 107 SER E O 1 +ATOM 23588 C CB . SER E 1 107 ? -27.428 11.290 22.004 1.00 34.70 ? 107 SER E CB 1 +ATOM 23589 O OG . SER E 1 107 ? -28.022 10.191 21.348 1.00 38.47 ? 107 SER E OG 1 +ATOM 23590 N N . VAL E 1 108 ? -25.934 10.841 19.011 1.00 37.85 ? 108 VAL E N 1 +ATOM 23591 C CA . VAL E 1 108 ? -26.186 10.799 17.586 1.00 38.60 ? 108 VAL E CA 1 +ATOM 23592 C C . VAL E 1 108 ? -26.801 9.444 17.323 1.00 39.92 ? 108 VAL E C 1 +ATOM 23593 O O . VAL E 1 108 ? -26.128 8.422 17.390 1.00 39.66 ? 108 VAL E O 1 +ATOM 23594 C CB . VAL E 1 108 ? -24.911 10.943 16.751 1.00 38.08 ? 108 VAL E CB 1 +ATOM 23595 C CG1 . VAL E 1 108 ? -25.289 11.021 15.268 1.00 36.52 ? 108 VAL E CG1 1 +ATOM 23596 C CG2 . VAL E 1 108 ? -24.156 12.186 17.169 1.00 37.62 ? 108 VAL E CG2 1 +ATOM 23597 N N . LYS E 1 109 ? -28.097 9.450 17.049 1.00 42.27 ? 109 LYS E N 1 +ATOM 23598 C CA . LYS E 1 109 ? -28.843 8.234 16.791 1.00 44.85 ? 109 LYS E CA 1 +ATOM 23599 C C . LYS E 1 109 ? -29.521 8.359 15.431 1.00 45.36 ? 109 LYS E C 1 +ATOM 23600 O O . LYS E 1 109 ? -30.171 9.363 15.143 1.00 46.30 ? 109 LYS E O 1 +ATOM 23601 C CB . LYS E 1 109 ? -29.871 8.035 17.910 1.00 46.21 ? 109 LYS E CB 1 +ATOM 23602 C CG . LYS E 1 109 ? -30.610 6.718 17.860 1.00 49.95 ? 109 LYS E CG 1 +ATOM 23603 C CD . LYS E 1 109 ? -31.387 6.468 19.143 1.00 51.82 ? 109 LYS E CD 1 +ATOM 23604 C CE . LYS E 1 109 ? -32.400 7.561 19.418 1.00 52.67 ? 109 LYS E CE 1 +ATOM 23605 N NZ . LYS E 1 109 ? -33.297 7.190 20.547 1.00 53.77 ? 109 LYS E NZ 1 +ATOM 23606 N N . ASP E 1 110 ? -29.349 7.347 14.589 1.00 46.14 ? 110 ASP E N 1 +ATOM 23607 C CA . ASP E 1 110 ? -29.939 7.361 13.253 1.00 47.88 ? 110 ASP E CA 1 +ATOM 23608 C C . ASP E 1 110 ? -29.497 8.619 12.507 1.00 46.88 ? 110 ASP E C 1 +ATOM 23609 O O . ASP E 1 110 ? -30.267 9.206 11.740 1.00 47.93 ? 110 ASP E O 1 +ATOM 23610 C CB . ASP E 1 110 ? -31.476 7.316 13.337 1.00 50.60 ? 110 ASP E CB 1 +ATOM 23611 C CG . ASP E 1 110 ? -31.997 6.052 14.029 1.00 54.85 ? 110 ASP E CG 1 +ATOM 23612 O OD1 . ASP E 1 110 ? -31.599 4.930 13.621 1.00 57.08 ? 110 ASP E OD1 1 +ATOM 23613 O OD2 . ASP E 1 110 ? -32.812 6.179 14.976 1.00 55.70 ? 110 ASP E OD2 1 +ATOM 23614 N N . GLY E 1 111 ? -28.257 9.038 12.748 1.00 44.89 ? 111 GLY E N 1 +ATOM 23615 C CA . GLY E 1 111 ? -27.723 10.222 12.095 1.00 40.38 ? 111 GLY E CA 1 +ATOM 23616 C C . GLY E 1 111 ? -28.184 11.557 12.664 1.00 39.02 ? 111 GLY E C 1 +ATOM 23617 O O . GLY E 1 111 ? -27.722 12.604 12.222 1.00 37.37 ? 111 GLY E O 1 +ATOM 23618 N N . VAL E 1 112 ? -29.079 11.531 13.648 1.00 37.01 ? 112 VAL E N 1 +ATOM 23619 C CA . VAL E 1 112 ? -29.592 12.760 14.245 1.00 35.68 ? 112 VAL E CA 1 +ATOM 23620 C C . VAL E 1 112 ? -28.958 13.037 15.598 1.00 36.16 ? 112 VAL E C 1 +ATOM 23621 O O . VAL E 1 112 ? -28.919 12.166 16.475 1.00 35.97 ? 112 VAL E O 1 +ATOM 23622 C CB . VAL E 1 112 ? -31.133 12.687 14.420 1.00 36.21 ? 112 VAL E CB 1 +ATOM 23623 C CG1 . VAL E 1 112 ? -31.654 13.948 15.089 1.00 32.85 ? 112 VAL E CG1 1 +ATOM 23624 C CG2 . VAL E 1 112 ? -31.791 12.485 13.061 1.00 35.50 ? 112 VAL E CG2 1 +ATOM 23625 N N . ALA E 1 113 ? -28.489 14.266 15.775 1.00 35.39 ? 113 ALA E N 1 +ATOM 23626 C CA . ALA E 1 113 ? -27.834 14.661 17.015 1.00 34.07 ? 113 ALA E CA 1 +ATOM 23627 C C . ALA E 1 113 ? -28.739 15.406 17.975 1.00 34.50 ? 113 ALA E C 1 +ATOM 23628 O O . ALA E 1 113 ? -29.572 16.202 17.563 1.00 36.16 ? 113 ALA E O 1 +ATOM 23629 C CB . ALA E 1 113 ? -26.612 15.512 16.698 1.00 31.53 ? 113 ALA E CB 1 +ATOM 23630 N N . THR E 1 114 ? -28.558 15.140 19.263 1.00 35.60 ? 114 THR E N 1 +ATOM 23631 C CA . THR E 1 114 ? -29.322 15.788 20.320 1.00 36.81 ? 114 THR E CA 1 +ATOM 23632 C C . THR E 1 114 ? -28.347 16.045 21.475 1.00 37.74 ? 114 THR E C 1 +ATOM 23633 O O . THR E 1 114 ? -27.539 15.184 21.816 1.00 37.25 ? 114 THR E O 1 +ATOM 23634 C CB . THR E 1 114 ? -30.473 14.893 20.828 1.00 37.14 ? 114 THR E CB 1 +ATOM 23635 O OG1 . THR E 1 114 ? -31.291 14.484 19.724 1.00 39.94 ? 114 THR E OG1 1 +ATOM 23636 C CG2 . THR E 1 114 ? -31.331 15.655 21.818 1.00 36.15 ? 114 THR E CG2 1 +ATOM 23637 N N . GLY E 1 115 ? -28.419 17.230 22.070 1.00 37.48 ? 115 GLY E N 1 +ATOM 23638 C CA . GLY E 1 115 ? -27.520 17.557 23.157 1.00 35.21 ? 115 GLY E CA 1 +ATOM 23639 C C . GLY E 1 115 ? -28.176 17.521 24.520 1.00 35.65 ? 115 GLY E C 1 +ATOM 23640 O O . GLY E 1 115 ? -29.382 17.730 24.655 1.00 35.80 ? 115 GLY E O 1 +ATOM 23641 N N . TYR E 1 116 ? -27.370 17.231 25.536 1.00 35.26 ? 116 TYR E N 1 +ATOM 23642 C CA . TYR E 1 116 ? -27.844 17.169 26.913 1.00 34.60 ? 116 TYR E CA 1 +ATOM 23643 C C . TYR E 1 116 ? -26.821 17.882 27.780 1.00 33.56 ? 116 TYR E C 1 +ATOM 23644 O O . TYR E 1 116 ? -25.689 17.430 27.930 1.00 35.10 ? 116 TYR E O 1 +ATOM 23645 C CB . TYR E 1 116 ? -28.010 15.715 27.369 1.00 34.06 ? 116 TYR E CB 1 +ATOM 23646 C CG . TYR E 1 116 ? -29.003 14.938 26.536 1.00 34.37 ? 116 TYR E CG 1 +ATOM 23647 C CD1 . TYR E 1 116 ? -28.616 14.342 25.338 1.00 33.45 ? 116 TYR E CD1 1 +ATOM 23648 C CD2 . TYR E 1 116 ? -30.349 14.854 26.914 1.00 35.35 ? 116 TYR E CD2 1 +ATOM 23649 C CE1 . TYR E 1 116 ? -29.537 13.686 24.532 1.00 34.30 ? 116 TYR E CE1 1 +ATOM 23650 C CE2 . TYR E 1 116 ? -31.280 14.200 26.118 1.00 34.04 ? 116 TYR E CE2 1 +ATOM 23651 C CZ . TYR E 1 116 ? -30.869 13.620 24.927 1.00 35.62 ? 116 TYR E CZ 1 +ATOM 23652 O OH . TYR E 1 116 ? -31.781 12.974 24.118 1.00 37.86 ? 116 TYR E OH 1 +ATOM 23653 N N . PHE E 1 117 ? -27.224 19.012 28.336 1.00 31.51 ? 117 PHE E N 1 +ATOM 23654 C CA . PHE E 1 117 ? -26.346 19.808 29.167 1.00 31.41 ? 117 PHE E CA 1 +ATOM 23655 C C . PHE E 1 117 ? -26.908 19.922 30.574 1.00 32.41 ? 117 PHE E C 1 +ATOM 23656 O O . PHE E 1 117 ? -27.999 20.460 30.777 1.00 32.77 ? 117 PHE E O 1 +ATOM 23657 C CB . PHE E 1 117 ? -26.176 21.190 28.519 1.00 31.27 ? 117 PHE E CB 1 +ATOM 23658 C CG . PHE E 1 117 ? -25.535 22.211 29.405 1.00 31.37 ? 117 PHE E CG 1 +ATOM 23659 C CD1 . PHE E 1 117 ? -24.369 21.922 30.107 1.00 31.61 ? 117 PHE E CD1 1 +ATOM 23660 C CD2 . PHE E 1 117 ? -26.100 23.480 29.533 1.00 31.64 ? 117 PHE E CD2 1 +ATOM 23661 C CE1 . PHE E 1 117 ? -23.777 22.882 30.925 1.00 30.82 ? 117 PHE E CE1 1 +ATOM 23662 C CE2 . PHE E 1 117 ? -25.521 24.446 30.343 1.00 29.53 ? 117 PHE E CE2 1 +ATOM 23663 C CZ . PHE E 1 117 ? -24.356 24.148 31.043 1.00 31.29 ? 117 PHE E CZ 1 +ATOM 23664 N N . PHE E 1 118 ? -26.170 19.400 31.548 1.00 31.89 ? 118 PHE E N 1 +ATOM 23665 C CA . PHE E 1 118 ? -26.614 19.457 32.934 1.00 32.12 ? 118 PHE E CA 1 +ATOM 23666 C C . PHE E 1 118 ? -25.862 20.577 33.626 1.00 33.73 ? 118 PHE E C 1 +ATOM 23667 O O . PHE E 1 118 ? -24.666 20.470 33.894 1.00 34.24 ? 118 PHE E O 1 +ATOM 23668 C CB . PHE E 1 118 ? -26.360 18.113 33.627 1.00 31.08 ? 118 PHE E CB 1 +ATOM 23669 C CG . PHE E 1 118 ? -27.060 16.965 32.971 1.00 29.51 ? 118 PHE E CG 1 +ATOM 23670 C CD1 . PHE E 1 118 ? -26.578 16.426 31.787 1.00 28.10 ? 118 PHE E CD1 1 +ATOM 23671 C CD2 . PHE E 1 118 ? -28.251 16.472 33.495 1.00 31.25 ? 118 PHE E CD2 1 +ATOM 23672 C CE1 . PHE E 1 118 ? -27.274 15.419 31.131 1.00 30.32 ? 118 PHE E CE1 1 +ATOM 23673 C CE2 . PHE E 1 118 ? -28.956 15.462 32.845 1.00 29.33 ? 118 PHE E CE2 1 +ATOM 23674 C CZ . PHE E 1 118 ? -28.466 14.937 31.658 1.00 27.75 ? 118 PHE E CZ 1 +ATOM 23675 N N . ASN E 1 119 ? -26.568 21.663 33.912 1.00 35.20 ? 119 ASN E N 1 +ATOM 23676 C CA . ASN E 1 119 ? -25.938 22.812 34.544 1.00 35.17 ? 119 ASN E CA 1 +ATOM 23677 C C . ASN E 1 119 ? -25.701 22.669 36.048 1.00 33.75 ? 119 ASN E C 1 +ATOM 23678 O O . ASN E 1 119 ? -26.340 23.330 36.867 1.00 33.43 ? 119 ASN E O 1 +ATOM 23679 C CB . ASN E 1 119 ? -26.745 24.079 34.243 1.00 35.18 ? 119 ASN E CB 1 +ATOM 23680 C CG . ASN E 1 119 ? -26.008 25.343 34.648 1.00 37.90 ? 119 ASN E CG 1 +ATOM 23681 O OD1 . ASN E 1 119 ? -24.772 25.362 34.714 1.00 38.32 ? 119 ASN E OD1 1 +ATOM 23682 N ND2 . ASN E 1 119 ? -26.758 26.414 34.909 1.00 38.60 ? 119 ASN E ND2 1 +ATOM 23683 N N . SER E 1 120 ? -24.779 21.783 36.397 1.00 33.44 ? 120 SER E N 1 +ATOM 23684 C CA . SER E 1 120 ? -24.398 21.561 37.789 1.00 33.42 ? 120 SER E CA 1 +ATOM 23685 C C . SER E 1 120 ? -22.871 21.473 37.821 1.00 32.44 ? 120 SER E C 1 +ATOM 23686 O O . SER E 1 120 ? -22.272 20.787 36.999 1.00 31.05 ? 120 SER E O 1 +ATOM 23687 C CB . SER E 1 120 ? -25.001 20.263 38.322 1.00 33.18 ? 120 SER E CB 1 +ATOM 23688 O OG . SER E 1 120 ? -24.561 20.023 39.649 1.00 35.39 ? 120 SER E OG 1 +ATOM 23689 N N . ALA E 1 121 ? -22.244 22.187 38.749 1.00 31.75 ? 121 ALA E N 1 +ATOM 23690 C CA . ALA E 1 121 ? -20.785 22.171 38.856 1.00 31.55 ? 121 ALA E CA 1 +ATOM 23691 C C . ALA E 1 121 ? -20.342 21.240 39.983 1.00 31.02 ? 121 ALA E C 1 +ATOM 23692 O O . ALA E 1 121 ? -19.215 21.310 40.458 1.00 30.02 ? 121 ALA E O 1 +ATOM 23693 C CB . ALA E 1 121 ? -20.262 23.584 39.098 1.00 29.30 ? 121 ALA E CB 1 +ATOM 23694 N N . SER E 1 122 ? -21.252 20.378 40.420 1.00 31.45 ? 122 SER E N 1 +ATOM 23695 C CA . SER E 1 122 ? -20.944 19.423 41.479 1.00 32.04 ? 122 SER E CA 1 +ATOM 23696 C C . SER E 1 122 ? -20.313 18.192 40.838 1.00 30.84 ? 122 SER E C 1 +ATOM 23697 O O . SER E 1 122 ? -20.079 18.170 39.628 1.00 30.69 ? 122 SER E O 1 +ATOM 23698 C CB . SER E 1 122 ? -22.220 19.031 42.217 1.00 31.65 ? 122 SER E CB 1 +ATOM 23699 O OG . SER E 1 122 ? -23.116 18.393 41.331 1.00 34.58 ? 122 SER E OG 1 +ATOM 23700 N N . LYS E 1 123 ? -20.043 17.166 41.635 1.00 31.93 ? 123 LYS E N 1 +ATOM 23701 C CA . LYS E 1 123 ? -19.425 15.944 41.100 1.00 32.21 ? 123 LYS E CA 1 +ATOM 23702 C C . LYS E 1 123 ? -20.434 15.073 40.338 1.00 30.11 ? 123 LYS E C 1 +ATOM 23703 O O . LYS E 1 123 ? -20.896 14.047 40.835 1.00 29.33 ? 123 LYS E O 1 +ATOM 23704 C CB . LYS E 1 123 ? -18.776 15.136 42.231 1.00 32.08 ? 123 LYS E CB 1 +ATOM 23705 C CG . LYS E 1 123 ? -18.079 13.881 41.741 1.00 37.34 ? 123 LYS E CG 1 +ATOM 23706 C CD . LYS E 1 123 ? -17.496 13.048 42.874 1.00 40.34 ? 123 LYS E CD 1 +ATOM 23707 C CE . LYS E 1 123 ? -16.248 13.689 43.451 1.00 43.79 ? 123 LYS E CE 1 +ATOM 23708 N NZ . LYS E 1 123 ? -15.540 12.785 44.408 1.00 47.99 ? 123 LYS E NZ 1 +ATOM 23709 N N . VAL E 1 124 ? -20.765 15.500 39.125 1.00 29.82 ? 124 VAL E N 1 +ATOM 23710 C CA . VAL E 1 124 ? -21.714 14.797 38.271 1.00 30.44 ? 124 VAL E CA 1 +ATOM 23711 C C . VAL E 1 124 ? -21.129 13.525 37.658 1.00 30.95 ? 124 VAL E C 1 +ATOM 23712 O O . VAL E 1 124 ? -20.016 13.527 37.139 1.00 29.06 ? 124 VAL E O 1 +ATOM 23713 C CB . VAL E 1 124 ? -22.192 15.707 37.121 1.00 31.40 ? 124 VAL E CB 1 +ATOM 23714 C CG1 . VAL E 1 124 ? -23.116 14.927 36.190 1.00 30.43 ? 124 VAL E CG1 1 +ATOM 23715 C CG2 . VAL E 1 124 ? -22.900 16.937 37.686 1.00 29.09 ? 124 VAL E CG2 1 +ATOM 23716 N N . ILE E 1 125 ? -21.898 12.443 37.717 1.00 31.69 ? 125 ILE E N 1 +ATOM 23717 C CA . ILE E 1 125 ? -21.471 11.168 37.162 1.00 31.07 ? 125 ILE E CA 1 +ATOM 23718 C C . ILE E 1 125 ? -22.206 10.834 35.864 1.00 31.49 ? 125 ILE E C 1 +ATOM 23719 O O . ILE E 1 125 ? -23.434 10.842 35.820 1.00 32.02 ? 125 ILE E O 1 +ATOM 23720 C CB . ILE E 1 125 ? -21.748 10.009 38.132 1.00 32.04 ? 125 ILE E CB 1 +ATOM 23721 C CG1 . ILE E 1 125 ? -21.217 10.337 39.537 1.00 30.56 ? 125 ILE E CG1 1 +ATOM 23722 C CG2 . ILE E 1 125 ? -21.121 8.727 37.575 1.00 31.01 ? 125 ILE E CG2 1 +ATOM 23723 C CD1 . ILE E 1 125 ? -19.735 10.618 39.583 1.00 32.26 ? 125 ILE E CD1 1 +ATOM 23724 N N . PHE E 1 126 ? -21.457 10.545 34.809 1.00 31.17 ? 126 PHE E N 1 +ATOM 23725 C CA . PHE E 1 126 ? -22.056 10.162 33.541 1.00 32.32 ? 126 PHE E CA 1 +ATOM 23726 C C . PHE E 1 126 ? -21.727 8.698 33.290 1.00 33.49 ? 126 PHE E C 1 +ATOM 23727 O O . PHE E 1 126 ? -20.620 8.365 32.839 1.00 33.10 ? 126 PHE E O 1 +ATOM 23728 C CB . PHE E 1 126 ? -21.516 10.994 32.373 1.00 32.17 ? 126 PHE E CB 1 +ATOM 23729 C CG . PHE E 1 126 ? -22.032 12.392 32.333 1.00 33.25 ? 126 PHE E CG 1 +ATOM 23730 C CD1 . PHE E 1 126 ? -21.438 13.389 33.101 1.00 33.92 ? 126 PHE E CD1 1 +ATOM 23731 C CD2 . PHE E 1 126 ? -23.119 12.718 31.537 1.00 33.19 ? 126 PHE E CD2 1 +ATOM 23732 C CE1 . PHE E 1 126 ? -21.921 14.691 33.073 1.00 35.50 ? 126 PHE E CE1 1 +ATOM 23733 C CE2 . PHE E 1 126 ? -23.615 14.025 31.500 1.00 33.79 ? 126 PHE E CE2 1 +ATOM 23734 C CZ . PHE E 1 126 ? -23.019 15.010 32.265 1.00 33.84 ? 126 PHE E CZ 1 +ATOM 23735 N N . ASP E 1 127 ? -22.681 7.824 33.596 1.00 34.86 ? 127 ASP E N 1 +ATOM 23736 C CA . ASP E 1 127 ? -22.487 6.396 33.384 1.00 36.56 ? 127 ASP E CA 1 +ATOM 23737 C C . ASP E 1 127 ? -23.033 6.066 31.995 1.00 35.85 ? 127 ASP E C 1 +ATOM 23738 O O . ASP E 1 127 ? -24.239 5.857 31.808 1.00 35.52 ? 127 ASP E O 1 +ATOM 23739 C CB . ASP E 1 127 ? -23.218 5.599 34.458 1.00 39.20 ? 127 ASP E CB 1 +ATOM 23740 C CG . ASP E 1 127 ? -22.805 4.153 34.471 1.00 43.96 ? 127 ASP E CG 1 +ATOM 23741 O OD1 . ASP E 1 127 ? -23.024 3.481 33.441 1.00 46.44 ? 127 ASP E OD1 1 +ATOM 23742 O OD2 . ASP E 1 127 ? -22.256 3.687 35.500 1.00 46.64 ? 127 ASP E OD2 1 +ATOM 23743 N N . VAL E 1 128 ? -22.134 6.023 31.019 1.00 33.17 ? 128 VAL E N 1 +ATOM 23744 C CA . VAL E 1 128 ? -22.513 5.777 29.640 1.00 31.52 ? 128 VAL E CA 1 +ATOM 23745 C C . VAL E 1 128 ? -22.485 4.311 29.221 1.00 32.51 ? 128 VAL E C 1 +ATOM 23746 O O . VAL E 1 128 ? -21.505 3.828 28.665 1.00 33.24 ? 128 VAL E O 1 +ATOM 23747 C CB . VAL E 1 128 ? -21.610 6.605 28.698 1.00 31.02 ? 128 VAL E CB 1 +ATOM 23748 C CG1 . VAL E 1 128 ? -22.124 6.567 27.282 1.00 27.81 ? 128 VAL E CG1 1 +ATOM 23749 C CG2 . VAL E 1 128 ? -21.535 8.044 29.205 1.00 30.51 ? 128 VAL E CG2 1 +ATOM 23750 N N . GLY E 1 129 ? -23.583 3.611 29.484 1.00 34.27 ? 129 GLY E N 1 +ATOM 23751 C CA . GLY E 1 129 ? -23.692 2.214 29.114 1.00 34.63 ? 129 GLY E CA 1 +ATOM 23752 C C . GLY E 1 129 ? -22.753 1.287 29.845 1.00 35.04 ? 129 GLY E C 1 +ATOM 23753 O O . GLY E 1 129 ? -22.283 0.320 29.268 1.00 36.13 ? 129 GLY E O 1 +ATOM 23754 N N . LEU E 1 130 ? -22.496 1.575 31.116 1.00 37.33 ? 130 LEU E N 1 +ATOM 23755 C CA . LEU E 1 130 ? -21.595 0.769 31.939 1.00 37.09 ? 130 LEU E CA 1 +ATOM 23756 C C . LEU E 1 130 ? -22.418 0.070 33.016 1.00 37.19 ? 130 LEU E C 1 +ATOM 23757 O O . LEU E 1 130 ? -22.390 -1.151 33.127 1.00 38.23 ? 130 LEU E O 1 +ATOM 23758 C CB . LEU E 1 130 ? -20.519 1.679 32.557 1.00 37.20 ? 130 LEU E CB 1 +ATOM 23759 C CG . LEU E 1 130 ? -19.198 1.145 33.130 1.00 36.68 ? 130 LEU E CG 1 +ATOM 23760 C CD1 . LEU E 1 130 ? -19.307 0.965 34.613 1.00 36.83 ? 130 LEU E CD1 1 +ATOM 23761 C CD2 . LEU E 1 130 ? -18.812 -0.136 32.433 1.00 36.15 ? 130 LEU E CD2 1 +ATOM 23762 N N . GLU E 1 131 ? -23.157 0.840 33.805 1.00 37.85 ? 131 GLU E N 1 +ATOM 23763 C CA . GLU E 1 131 ? -23.999 0.261 34.846 1.00 40.35 ? 131 GLU E CA 1 +ATOM 23764 C C . GLU E 1 131 ? -25.060 -0.586 34.137 1.00 39.81 ? 131 GLU E C 1 +ATOM 23765 O O . GLU E 1 131 ? -25.309 -1.731 34.498 1.00 40.31 ? 131 GLU E O 1 +ATOM 23766 C CB . GLU E 1 131 ? -24.665 1.366 35.662 1.00 43.39 ? 131 GLU E CB 1 +ATOM 23767 C CG . GLU E 1 131 ? -25.412 0.870 36.888 1.00 48.86 ? 131 GLU E CG 1 +ATOM 23768 C CD . GLU E 1 131 ? -26.141 1.994 37.598 1.00 52.42 ? 131 GLU E CD 1 +ATOM 23769 O OE1 . GLU E 1 131 ? -25.488 3.006 37.947 1.00 55.42 ? 131 GLU E OE1 1 +ATOM 23770 O OE2 . GLU E 1 131 ? -27.367 1.867 37.804 1.00 54.65 ? 131 GLU E OE2 1 +ATOM 23771 N N . GLU E 1 132 ? -25.686 -0.004 33.123 1.00 38.52 ? 132 GLU E N 1 +ATOM 23772 C CA . GLU E 1 132 ? -26.677 -0.706 32.326 1.00 37.70 ? 132 GLU E CA 1 +ATOM 23773 C C . GLU E 1 132 ? -26.238 -0.540 30.876 1.00 36.49 ? 132 GLU E C 1 +ATOM 23774 O O . GLU E 1 132 ? -26.205 0.570 30.350 1.00 37.00 ? 132 GLU E O 1 +ATOM 23775 C CB . GLU E 1 132 ? -28.080 -0.123 32.535 1.00 39.22 ? 132 GLU E CB 1 +ATOM 23776 C CG . GLU E 1 132 ? -28.687 -0.378 33.913 1.00 43.16 ? 132 GLU E CG 1 +ATOM 23777 C CD . GLU E 1 132 ? -28.713 -1.858 34.314 1.00 46.05 ? 132 GLU E CD 1 +ATOM 23778 O OE1 . GLU E 1 132 ? -29.034 -2.719 33.465 1.00 46.27 ? 132 GLU E OE1 1 +ATOM 23779 O OE2 . GLU E 1 132 ? -28.420 -2.159 35.496 1.00 48.29 ? 132 GLU E OE2 1 +ATOM 23780 N N . TYR E 1 133 ? -25.890 -1.657 30.246 1.00 34.49 ? 133 TYR E N 1 +ATOM 23781 C CA . TYR E 1 133 ? -25.417 -1.685 28.867 1.00 34.25 ? 133 TYR E CA 1 +ATOM 23782 C C . TYR E 1 133 ? -26.271 -0.885 27.871 1.00 34.49 ? 133 TYR E C 1 +ATOM 23783 O O . TYR E 1 133 ? -25.753 -0.352 26.878 1.00 31.47 ? 133 TYR E O 1 +ATOM 23784 C CB . TYR E 1 133 ? -25.334 -3.142 28.405 1.00 33.18 ? 133 TYR E CB 1 +ATOM 23785 C CG . TYR E 1 133 ? -24.615 -3.362 27.090 1.00 34.62 ? 133 TYR E CG 1 +ATOM 23786 C CD1 . TYR E 1 133 ? -23.215 -3.425 27.035 1.00 34.43 ? 133 TYR E CD1 1 +ATOM 23787 C CD2 . TYR E 1 133 ? -25.329 -3.508 25.895 1.00 34.82 ? 133 TYR E CD2 1 +ATOM 23788 C CE1 . TYR E 1 133 ? -22.544 -3.630 25.829 1.00 33.21 ? 133 TYR E CE1 1 +ATOM 23789 C CE2 . TYR E 1 133 ? -24.668 -3.712 24.682 1.00 35.37 ? 133 TYR E CE2 1 +ATOM 23790 C CZ . TYR E 1 133 ? -23.279 -3.774 24.657 1.00 35.21 ? 133 TYR E CZ 1 +ATOM 23791 O OH . TYR E 1 133 ? -22.633 -3.993 23.464 1.00 36.13 ? 133 TYR E OH 1 +ATOM 23792 N N . ASP E 1 134 ? -27.571 -0.799 28.140 1.00 34.32 ? 134 ASP E N 1 +ATOM 23793 C CA . ASP E 1 134 ? -28.491 -0.113 27.240 1.00 36.82 ? 134 ASP E CA 1 +ATOM 23794 C C . ASP E 1 134 ? -29.016 1.200 27.785 1.00 37.57 ? 134 ASP E C 1 +ATOM 23795 O O . ASP E 1 134 ? -30.105 1.644 27.414 1.00 38.00 ? 134 ASP E O 1 +ATOM 23796 C CB . ASP E 1 134 ? -29.670 -1.035 26.928 1.00 39.57 ? 134 ASP E CB 1 +ATOM 23797 C CG . ASP E 1 134 ? -30.514 -1.336 28.162 1.00 43.13 ? 134 ASP E CG 1 +ATOM 23798 O OD1 . ASP E 1 134 ? -29.938 -1.429 29.272 1.00 46.78 ? 134 ASP E OD1 1 +ATOM 23799 O OD2 . ASP E 1 134 ? -31.747 -1.490 28.027 1.00 44.15 ? 134 ASP E OD2 1 +ATOM 23800 N N . LYS E 1 135 ? -28.244 1.828 28.660 1.00 38.05 ? 135 LYS E N 1 +ATOM 23801 C CA . LYS E 1 135 ? -28.661 3.089 29.242 1.00 38.45 ? 135 LYS E CA 1 +ATOM 23802 C C . LYS E 1 135 ? -27.533 4.057 29.509 1.00 37.35 ? 135 LYS E C 1 +ATOM 23803 O O . LYS E 1 135 ? -26.375 3.662 29.669 1.00 37.47 ? 135 LYS E O 1 +ATOM 23804 C CB . LYS E 1 135 ? -29.395 2.847 30.565 1.00 40.86 ? 135 LYS E CB 1 +ATOM 23805 C CG . LYS E 1 135 ? -30.825 2.394 30.412 1.00 44.05 ? 135 LYS E CG 1 +ATOM 23806 C CD . LYS E 1 135 ? -31.419 2.045 31.757 1.00 48.43 ? 135 LYS E CD 1 +ATOM 23807 C CE . LYS E 1 135 ? -32.922 1.857 31.639 1.00 52.24 ? 135 LYS E CE 1 +ATOM 23808 N NZ . LYS E 1 135 ? -33.267 1.073 30.415 1.00 54.21 ? 135 LYS E NZ 1 +ATOM 23809 N N . VAL E 1 136 ? -27.899 5.337 29.536 1.00 35.81 ? 136 VAL E N 1 +ATOM 23810 C CA . VAL E 1 136 ? -26.986 6.410 29.871 1.00 32.62 ? 136 VAL E CA 1 +ATOM 23811 C C . VAL E 1 136 ? -27.618 6.929 31.149 1.00 32.29 ? 136 VAL E C 1 +ATOM 23812 O O . VAL E 1 136 ? -28.743 7.426 31.128 1.00 32.04 ? 136 VAL E O 1 +ATOM 23813 C CB . VAL E 1 136 ? -26.984 7.530 28.837 1.00 31.46 ? 136 VAL E CB 1 +ATOM 23814 C CG1 . VAL E 1 136 ? -26.065 8.638 29.300 1.00 30.40 ? 136 VAL E CG1 1 +ATOM 23815 C CG2 . VAL E 1 136 ? -26.538 6.995 27.484 1.00 31.32 ? 136 VAL E CG2 1 +ATOM 23816 N N . ILE E 1 137 ? -26.918 6.778 32.267 1.00 30.97 ? 137 ILE E N 1 +ATOM 23817 C CA . ILE E 1 137 ? -27.434 7.239 33.544 1.00 30.26 ? 137 ILE E CA 1 +ATOM 23818 C C . ILE E 1 137 ? -26.592 8.404 34.059 1.00 30.99 ? 137 ILE E C 1 +ATOM 23819 O O . ILE E 1 137 ? -25.373 8.295 34.188 1.00 29.43 ? 137 ILE E O 1 +ATOM 23820 C CB . ILE E 1 137 ? -27.420 6.108 34.570 1.00 30.47 ? 137 ILE E CB 1 +ATOM 23821 C CG1 . ILE E 1 137 ? -28.196 4.911 34.019 1.00 31.20 ? 137 ILE E CG1 1 +ATOM 23822 C CG2 . ILE E 1 137 ? -28.015 6.586 35.879 1.00 29.83 ? 137 ILE E CG2 1 +ATOM 23823 C CD1 . ILE E 1 137 ? -28.126 3.673 34.882 1.00 33.07 ? 137 ILE E CD1 1 +ATOM 23824 N N . VAL E 1 138 ? -27.250 9.525 34.334 1.00 31.41 ? 138 VAL E N 1 +ATOM 23825 C CA . VAL E 1 138 ? -26.566 10.705 34.831 1.00 31.84 ? 138 VAL E CA 1 +ATOM 23826 C C . VAL E 1 138 ? -27.011 10.948 36.259 1.00 34.06 ? 138 VAL E C 1 +ATOM 23827 O O . VAL E 1 138 ? -28.205 11.049 36.535 1.00 35.53 ? 138 VAL E O 1 +ATOM 23828 C CB . VAL E 1 138 ? -26.899 11.953 33.975 1.00 31.95 ? 138 VAL E CB 1 +ATOM 23829 C CG1 . VAL E 1 138 ? -26.207 13.182 34.544 1.00 30.64 ? 138 VAL E CG1 1 +ATOM 23830 C CG2 . VAL E 1 138 ? -26.468 11.728 32.534 1.00 28.20 ? 138 VAL E CG2 1 +ATOM 23831 N N . THR E 1 139 ? -26.046 11.027 37.169 1.00 35.46 ? 139 THR E N 1 +ATOM 23832 C CA . THR E 1 139 ? -26.342 11.256 38.576 1.00 35.72 ? 139 THR E CA 1 +ATOM 23833 C C . THR E 1 139 ? -25.782 12.601 39.014 1.00 36.19 ? 139 THR E C 1 +ATOM 23834 O O . THR E 1 139 ? -24.573 12.846 38.888 1.00 36.30 ? 139 THR E O 1 +ATOM 23835 C CB . THR E 1 139 ? -25.709 10.166 39.462 1.00 36.77 ? 139 THR E CB 1 +ATOM 23836 O OG1 . THR E 1 139 ? -26.087 8.877 38.969 1.00 37.09 ? 139 THR E OG1 1 +ATOM 23837 C CG2 . THR E 1 139 ? -26.182 10.309 40.908 1.00 36.62 ? 139 THR E CG2 1 +ATOM 23838 N N . ILE E 1 140 ? -26.659 13.475 39.505 1.00 35.94 ? 140 ILE E N 1 +ATOM 23839 C CA . ILE E 1 140 ? -26.237 14.782 39.985 1.00 36.22 ? 140 ILE E CA 1 +ATOM 23840 C C . ILE E 1 140 ? -26.368 14.745 41.500 1.00 37.31 ? 140 ILE E C 1 +ATOM 23841 O O . ILE E 1 140 ? -27.453 14.532 42.037 1.00 37.47 ? 140 ILE E O 1 +ATOM 23842 C CB . ILE E 1 140 ? -27.117 15.928 39.434 1.00 36.67 ? 140 ILE E CB 1 +ATOM 23843 C CG1 . ILE E 1 140 ? -27.048 15.969 37.902 1.00 36.64 ? 140 ILE E CG1 1 +ATOM 23844 C CG2 . ILE E 1 140 ? -26.644 17.259 39.997 1.00 36.28 ? 140 ILE E CG2 1 +ATOM 23845 C CD1 . ILE E 1 140 ? -27.973 14.976 37.228 1.00 36.38 ? 140 ILE E CD1 1 +ATOM 23846 N N . PRO E 1 141 ? -25.254 14.935 42.213 1.00 38.18 ? 141 PRO E N 1 +ATOM 23847 C CA . PRO E 1 141 ? -25.294 14.909 43.679 1.00 39.90 ? 141 PRO E CA 1 +ATOM 23848 C C . PRO E 1 141 ? -25.928 16.144 44.320 1.00 41.47 ? 141 PRO E C 1 +ATOM 23849 O O . PRO E 1 141 ? -25.309 16.808 45.153 1.00 41.17 ? 141 PRO E O 1 +ATOM 23850 C CB . PRO E 1 141 ? -23.823 14.742 44.055 1.00 37.17 ? 141 PRO E CB 1 +ATOM 23851 C CG . PRO E 1 141 ? -23.136 15.524 42.984 1.00 38.23 ? 141 PRO E CG 1 +ATOM 23852 C CD . PRO E 1 141 ? -23.876 15.099 41.723 1.00 36.39 ? 141 PRO E CD 1 +ATOM 23853 N N . GLU E 1 142 ? -27.161 16.444 43.918 1.00 44.33 ? 142 GLU E N 1 +ATOM 23854 C CA . GLU E 1 142 ? -27.923 17.573 44.455 1.00 46.09 ? 142 GLU E CA 1 +ATOM 23855 C C . GLU E 1 142 ? -29.395 17.182 44.390 1.00 47.40 ? 142 GLU E C 1 +ATOM 23856 O O . GLU E 1 142 ? -29.769 16.336 43.576 1.00 46.18 ? 142 GLU E O 1 +ATOM 23857 C CB . GLU E 1 142 ? -27.689 18.838 43.631 1.00 47.48 ? 142 GLU E CB 1 +ATOM 23858 C CG . GLU E 1 142 ? -26.230 19.189 43.439 1.00 53.15 ? 142 GLU E CG 1 +ATOM 23859 C CD . GLU E 1 142 ? -26.027 20.623 42.978 1.00 57.88 ? 142 GLU E CD 1 +ATOM 23860 O OE1 . GLU E 1 142 ? -26.192 21.549 43.807 1.00 60.46 ? 142 GLU E OE1 1 +ATOM 23861 O OE2 . GLU E 1 142 ? -25.704 20.831 41.785 1.00 60.65 ? 142 GLU E OE2 1 +ATOM 23862 N N . ASP E 1 143 ? -30.229 17.787 45.237 1.00 48.88 ? 143 ASP E N 1 +ATOM 23863 C CA . ASP E 1 143 ? -31.651 17.451 45.251 1.00 51.10 ? 143 ASP E CA 1 +ATOM 23864 C C . ASP E 1 143 ? -32.417 18.108 44.109 1.00 49.62 ? 143 ASP E C 1 +ATOM 23865 O O . ASP E 1 143 ? -33.507 17.677 43.758 1.00 50.72 ? 143 ASP E O 1 +ATOM 23866 C CB . ASP E 1 143 ? -32.287 17.829 46.600 1.00 54.96 ? 143 ASP E CB 1 +ATOM 23867 C CG . ASP E 1 143 ? -32.129 19.309 46.939 1.00 59.58 ? 143 ASP E CG 1 +ATOM 23868 O OD1 . ASP E 1 143 ? -32.465 20.163 46.085 1.00 61.16 ? 143 ASP E OD1 1 +ATOM 23869 O OD2 . ASP E 1 143 ? -31.680 19.618 48.072 1.00 62.17 ? 143 ASP E OD2 1 +ATOM 23870 N N . SER E 1 144 ? -31.835 19.149 43.532 1.00 48.09 ? 144 SER E N 1 +ATOM 23871 C CA . SER E 1 144 ? -32.452 19.869 42.428 1.00 47.15 ? 144 SER E CA 1 +ATOM 23872 C C . SER E 1 144 ? -31.433 20.070 41.318 1.00 45.90 ? 144 SER E C 1 +ATOM 23873 O O . SER E 1 144 ? -30.225 20.032 41.553 1.00 46.78 ? 144 SER E O 1 +ATOM 23874 C CB . SER E 1 144 ? -32.952 21.238 42.896 1.00 47.99 ? 144 SER E CB 1 +ATOM 23875 O OG . SER E 1 144 ? -33.972 21.107 43.866 1.00 51.31 ? 144 SER E OG 1 +ATOM 23876 N N . VAL E 1 145 ? -31.913 20.291 40.104 1.00 44.05 ? 145 VAL E N 1 +ATOM 23877 C CA . VAL E 1 145 ? -31.001 20.509 38.996 1.00 42.17 ? 145 VAL E CA 1 +ATOM 23878 C C . VAL E 1 145 ? -31.733 20.973 37.750 1.00 41.35 ? 145 VAL E C 1 +ATOM 23879 O O . VAL E 1 145 ? -32.909 20.676 37.555 1.00 39.85 ? 145 VAL E O 1 +ATOM 23880 C CB . VAL E 1 145 ? -30.216 19.212 38.650 1.00 42.06 ? 145 VAL E CB 1 +ATOM 23881 C CG1 . VAL E 1 145 ? -31.164 18.161 38.083 1.00 41.17 ? 145 VAL E CG1 1 +ATOM 23882 C CG2 . VAL E 1 145 ? -29.109 19.518 37.656 1.00 40.02 ? 145 VAL E CG2 1 +ATOM 23883 N N . GLU E 1 146 ? -31.028 21.720 36.913 1.00 41.55 ? 146 GLU E N 1 +ATOM 23884 C CA . GLU E 1 146 ? -31.594 22.184 35.661 1.00 41.59 ? 146 GLU E CA 1 +ATOM 23885 C C . GLU E 1 146 ? -30.685 21.699 34.547 1.00 39.69 ? 146 GLU E C 1 +ATOM 23886 O O . GLU E 1 146 ? -29.472 21.877 34.607 1.00 39.46 ? 146 GLU E O 1 +ATOM 23887 C CB . GLU E 1 146 ? -31.701 23.720 35.615 1.00 43.63 ? 146 GLU E CB 1 +ATOM 23888 C CG . GLU E 1 146 ? -30.384 24.472 35.738 1.00 48.01 ? 146 GLU E CG 1 +ATOM 23889 C CD . GLU E 1 146 ? -30.510 25.967 35.405 1.00 52.20 ? 146 GLU E CD 1 +ATOM 23890 O OE1 . GLU E 1 146 ? -31.435 26.628 35.940 1.00 53.93 ? 146 GLU E OE1 1 +ATOM 23891 O OE2 . GLU E 1 146 ? -29.678 26.486 34.618 1.00 51.03 ? 146 GLU E OE2 1 +ATOM 23892 N N . PHE E 1 147 ? -31.265 21.045 33.549 1.00 38.53 ? 147 PHE E N 1 +ATOM 23893 C CA . PHE E 1 147 ? -30.480 20.593 32.417 1.00 37.90 ? 147 PHE E CA 1 +ATOM 23894 C C . PHE E 1 147 ? -31.234 20.965 31.153 1.00 37.27 ? 147 PHE E C 1 +ATOM 23895 O O . PHE E 1 147 ? -32.402 21.327 31.210 1.00 37.36 ? 147 PHE E O 1 +ATOM 23896 C CB . PHE E 1 147 ? -30.173 19.081 32.476 1.00 37.34 ? 147 PHE E CB 1 +ATOM 23897 C CG . PHE E 1 147 ? -31.380 18.190 32.451 1.00 37.25 ? 147 PHE E CG 1 +ATOM 23898 C CD1 . PHE E 1 147 ? -32.122 17.960 33.607 1.00 36.66 ? 147 PHE E CD1 1 +ATOM 23899 C CD2 . PHE E 1 147 ? -31.743 17.534 31.279 1.00 36.90 ? 147 PHE E CD2 1 +ATOM 23900 C CE1 . PHE E 1 147 ? -33.202 17.086 33.598 1.00 37.61 ? 147 PHE E CE1 1 +ATOM 23901 C CE2 . PHE E 1 147 ? -32.826 16.656 31.258 1.00 38.06 ? 147 PHE E CE2 1 +ATOM 23902 C CZ . PHE E 1 147 ? -33.557 16.429 32.419 1.00 37.49 ? 147 PHE E CZ 1 +ATOM 23903 N N . TYR E 1 148 ? -30.558 20.893 30.016 1.00 36.52 ? 148 TYR E N 1 +ATOM 23904 C CA . TYR E 1 148 ? -31.172 21.268 28.765 1.00 36.51 ? 148 TYR E CA 1 +ATOM 23905 C C . TYR E 1 148 ? -31.078 20.185 27.705 1.00 37.13 ? 148 TYR E C 1 +ATOM 23906 O O . TYR E 1 148 ? -30.076 19.484 27.608 1.00 37.86 ? 148 TYR E O 1 +ATOM 23907 C CB . TYR E 1 148 ? -30.507 22.533 28.220 1.00 37.26 ? 148 TYR E CB 1 +ATOM 23908 C CG . TYR E 1 148 ? -30.437 23.685 29.193 1.00 36.75 ? 148 TYR E CG 1 +ATOM 23909 C CD1 . TYR E 1 148 ? -29.607 23.634 30.312 1.00 38.19 ? 148 TYR E CD1 1 +ATOM 23910 C CD2 . TYR E 1 148 ? -31.204 24.832 28.998 1.00 37.60 ? 148 TYR E CD2 1 +ATOM 23911 C CE1 . TYR E 1 148 ? -29.542 24.698 31.217 1.00 36.49 ? 148 TYR E CE1 1 +ATOM 23912 C CE2 . TYR E 1 148 ? -31.147 25.900 29.890 1.00 38.25 ? 148 TYR E CE2 1 +ATOM 23913 C CZ . TYR E 1 148 ? -30.312 25.828 30.999 1.00 37.08 ? 148 TYR E CZ 1 +ATOM 23914 O OH . TYR E 1 148 ? -30.253 26.894 31.873 1.00 35.08 ? 148 TYR E OH 1 +ATOM 23915 N N . VAL E 1 149 ? -32.135 20.045 26.915 1.00 35.97 ? 149 VAL E N 1 +ATOM 23916 C CA . VAL E 1 149 ? -32.132 19.085 25.833 1.00 36.37 ? 149 VAL E CA 1 +ATOM 23917 C C . VAL E 1 149 ? -32.040 19.995 24.615 1.00 37.41 ? 149 VAL E C 1 +ATOM 23918 O O . VAL E 1 149 ? -32.914 20.825 24.388 1.00 38.55 ? 149 VAL E O 1 +ATOM 23919 C CB . VAL E 1 149 ? -33.415 18.261 25.816 1.00 34.85 ? 149 VAL E CB 1 +ATOM 23920 C CG1 . VAL E 1 149 ? -33.340 17.213 24.705 1.00 34.28 ? 149 VAL E CG1 1 +ATOM 23921 C CG2 . VAL E 1 149 ? -33.602 17.598 27.169 1.00 33.90 ? 149 VAL E CG2 1 +ATOM 23922 N N . ILE E 1 150 ? -30.964 19.858 23.853 1.00 37.28 ? 150 ILE E N 1 +ATOM 23923 C CA . ILE E 1 150 ? -30.722 20.708 22.703 1.00 37.85 ? 150 ILE E CA 1 +ATOM 23924 C C . ILE E 1 150 ? -30.875 19.959 21.382 1.00 41.16 ? 150 ILE E C 1 +ATOM 23925 O O . ILE E 1 150 ? -30.048 19.112 21.031 1.00 41.22 ? 150 ILE E O 1 +ATOM 23926 C CB . ILE E 1 150 ? -29.307 21.294 22.798 1.00 36.61 ? 150 ILE E CB 1 +ATOM 23927 C CG1 . ILE E 1 150 ? -29.096 21.869 24.202 1.00 36.40 ? 150 ILE E CG1 1 +ATOM 23928 C CG2 . ILE E 1 150 ? -29.095 22.350 21.737 1.00 35.17 ? 150 ILE E CG2 1 +ATOM 23929 C CD1 . ILE E 1 150 ? -27.664 22.276 24.509 1.00 34.85 ? 150 ILE E CD1 1 +ATOM 23930 N N . GLU E 1 151 ? -31.932 20.285 20.643 1.00 43.37 ? 151 GLU E N 1 +ATOM 23931 C CA . GLU E 1 151 ? -32.193 19.638 19.363 1.00 44.63 ? 151 GLU E CA 1 +ATOM 23932 C C . GLU E 1 151 ? -31.135 19.992 18.328 1.00 43.08 ? 151 GLU E C 1 +ATOM 23933 O O . GLU E 1 151 ? -30.508 21.051 18.393 1.00 41.97 ? 151 GLU E O 1 +ATOM 23934 C CB . GLU E 1 151 ? -33.578 20.030 18.845 1.00 48.58 ? 151 GLU E CB 1 +ATOM 23935 C CG . GLU E 1 151 ? -34.734 19.594 19.746 1.00 55.38 ? 151 GLU E CG 1 +ATOM 23936 C CD . GLU E 1 151 ? -34.707 18.097 20.078 1.00 60.94 ? 151 GLU E CD 1 +ATOM 23937 O OE1 . GLU E 1 151 ? -34.652 17.261 19.144 1.00 64.17 ? 151 GLU E OE1 1 +ATOM 23938 O OE2 . GLU E 1 151 ? -34.751 17.751 21.280 1.00 63.54 ? 151 GLU E OE2 1 +ATOM 23939 N N . GLY E 1 152 ? -30.937 19.085 17.378 1.00 42.19 ? 152 GLY E N 1 +ATOM 23940 C CA . GLY E 1 152 ? -29.957 19.302 16.330 1.00 41.57 ? 152 GLY E CA 1 +ATOM 23941 C C . GLY E 1 152 ? -30.619 19.801 15.063 1.00 40.87 ? 152 GLY E C 1 +ATOM 23942 O O . GLY E 1 152 ? -31.027 20.967 15.012 1.00 42.14 ? 152 GLY E O 1 +ATOM 23943 N N . PRO E 1 153 ? -30.746 18.953 14.021 1.00 38.77 ? 153 PRO E N 1 +ATOM 23944 C CA . PRO E 1 153 ? -30.287 17.560 13.993 1.00 37.52 ? 153 PRO E CA 1 +ATOM 23945 C C . PRO E 1 153 ? -28.786 17.402 13.718 1.00 35.97 ? 153 PRO E C 1 +ATOM 23946 O O . PRO E 1 153 ? -28.234 16.321 13.900 1.00 34.51 ? 153 PRO E O 1 +ATOM 23947 C CB . PRO E 1 153 ? -31.140 16.944 12.884 1.00 37.21 ? 153 PRO E CB 1 +ATOM 23948 C CG . PRO E 1 153 ? -31.233 18.055 11.909 1.00 35.52 ? 153 PRO E CG 1 +ATOM 23949 C CD . PRO E 1 153 ? -31.515 19.264 12.800 1.00 36.71 ? 153 PRO E CD 1 +ATOM 23950 N N . ARG E 1 154 ? -28.132 18.461 13.245 1.00 34.60 ? 154 ARG E N 1 +ATOM 23951 C CA . ARG E 1 154 ? -26.695 18.385 12.981 1.00 36.19 ? 154 ARG E CA 1 +ATOM 23952 C C . ARG E 1 154 ? -25.926 18.643 14.275 1.00 36.15 ? 154 ARG E C 1 +ATOM 23953 O O . ARG E 1 154 ? -26.410 19.363 15.154 1.00 36.80 ? 154 ARG E O 1 +ATOM 23954 C CB . ARG E 1 154 ? -26.254 19.422 11.948 1.00 36.20 ? 154 ARG E CB 1 +ATOM 23955 C CG . ARG E 1 154 ? -26.657 19.135 10.513 1.00 38.49 ? 154 ARG E CG 1 +ATOM 23956 C CD . ARG E 1 154 ? -26.044 20.183 9.582 1.00 38.86 ? 154 ARG E CD 1 +ATOM 23957 N NE . ARG E 1 154 ? -26.454 21.540 9.943 1.00 44.33 ? 154 ARG E NE 1 +ATOM 23958 C CZ . ARG E 1 154 ? -25.636 22.595 10.011 1.00 47.56 ? 154 ARG E CZ 1 +ATOM 23959 N NH1 . ARG E 1 154 ? -24.333 22.462 9.739 1.00 46.83 ? 154 ARG E NH1 1 +ATOM 23960 N NH2 . ARG E 1 154 ? -26.118 23.785 10.374 1.00 45.18 ? 154 ARG E NH2 1 +ATOM 23961 N N . ILE E 1 155 ? -24.742 18.052 14.401 1.00 34.36 ? 155 ILE E N 1 +ATOM 23962 C CA . ILE E 1 155 ? -23.948 18.276 15.594 1.00 35.62 ? 155 ILE E CA 1 +ATOM 23963 C C . ILE E 1 155 ? -23.668 19.782 15.683 1.00 35.57 ? 155 ILE E C 1 +ATOM 23964 O O . ILE E 1 155 ? -23.682 20.367 16.770 1.00 35.37 ? 155 ILE E O 1 +ATOM 23965 C CB . ILE E 1 155 ? -22.614 17.488 15.548 1.00 35.08 ? 155 ILE E CB 1 +ATOM 23966 C CG1 . ILE E 1 155 ? -22.895 15.990 15.653 1.00 34.48 ? 155 ILE E CG1 1 +ATOM 23967 C CG2 . ILE E 1 155 ? -21.702 17.932 16.693 1.00 34.03 ? 155 ILE E CG2 1 +ATOM 23968 C CD1 . ILE E 1 155 ? -21.671 15.117 15.427 1.00 34.96 ? 155 ILE E CD1 1 +ATOM 23969 N N . GLU E 1 156 ? -23.432 20.405 14.531 1.00 34.63 ? 156 GLU E N 1 +ATOM 23970 C CA . GLU E 1 156 ? -23.177 21.835 14.485 1.00 34.90 ? 156 GLU E CA 1 +ATOM 23971 C C . GLU E 1 156 ? -24.375 22.640 15.011 1.00 33.99 ? 156 GLU E C 1 +ATOM 23972 O O . GLU E 1 156 ? -24.189 23.690 15.620 1.00 32.88 ? 156 GLU E O 1 +ATOM 23973 C CB . GLU E 1 156 ? -22.838 22.279 13.063 1.00 35.86 ? 156 GLU E CB 1 +ATOM 23974 C CG . GLU E 1 156 ? -22.420 23.742 12.989 1.00 41.22 ? 156 GLU E CG 1 +ATOM 23975 C CD . GLU E 1 156 ? -21.803 24.122 11.650 1.00 44.61 ? 156 GLU E CD 1 +ATOM 23976 O OE1 . GLU E 1 156 ? -22.560 24.261 10.660 1.00 47.02 ? 156 GLU E OE1 1 +ATOM 23977 O OE2 . GLU E 1 156 ? -20.559 24.268 11.588 1.00 45.31 ? 156 GLU E OE2 1 +ATOM 23978 N N . ASP E 1 157 ? -25.595 22.157 14.782 1.00 31.13 ? 157 ASP E N 1 +ATOM 23979 C CA . ASP E 1 157 ? -26.777 22.858 15.277 1.00 31.23 ? 157 ASP E CA 1 +ATOM 23980 C C . ASP E 1 157 ? -26.823 22.811 16.794 1.00 31.48 ? 157 ASP E C 1 +ATOM 23981 O O . ASP E 1 157 ? -27.219 23.779 17.440 1.00 32.29 ? 157 ASP E O 1 +ATOM 23982 C CB . ASP E 1 157 ? -28.069 22.233 14.740 1.00 32.84 ? 157 ASP E CB 1 +ATOM 23983 C CG . ASP E 1 157 ? -28.173 22.307 13.235 1.00 34.74 ? 157 ASP E CG 1 +ATOM 23984 O OD1 . ASP E 1 157 ? -27.888 23.394 12.662 1.00 37.84 ? 157 ASP E OD1 1 +ATOM 23985 O OD2 . ASP E 1 157 ? -28.549 21.277 12.629 1.00 32.79 ? 157 ASP E OD2 1 +ATOM 23986 N N . VAL E 1 158 ? -26.445 21.670 17.361 1.00 32.88 ? 158 VAL E N 1 +ATOM 23987 C CA . VAL E 1 158 ? -26.438 21.516 18.803 1.00 32.62 ? 158 VAL E CA 1 +ATOM 23988 C C . VAL E 1 158 ? -25.453 22.499 19.415 1.00 32.78 ? 158 VAL E C 1 +ATOM 23989 O O . VAL E 1 158 ? -25.785 23.192 20.378 1.00 31.76 ? 158 VAL E O 1 +ATOM 23990 C CB . VAL E 1 158 ? -26.040 20.073 19.220 1.00 34.27 ? 158 VAL E CB 1 +ATOM 23991 C CG1 . VAL E 1 158 ? -25.929 19.973 20.746 1.00 32.58 ? 158 VAL E CG1 1 +ATOM 23992 C CG2 . VAL E 1 158 ? -27.070 19.085 18.708 1.00 33.56 ? 158 VAL E CG2 1 +ATOM 23993 N N . LEU E 1 159 ? -24.247 22.561 18.857 1.00 34.08 ? 159 LEU E N 1 +ATOM 23994 C CA . LEU E 1 159 ? -23.220 23.461 19.374 1.00 36.83 ? 159 LEU E CA 1 +ATOM 23995 C C . LEU E 1 159 ? -23.574 24.944 19.235 1.00 38.10 ? 159 LEU E C 1 +ATOM 23996 O O . LEU E 1 159 ? -23.217 25.751 20.098 1.00 37.57 ? 159 LEU E O 1 +ATOM 23997 C CB . LEU E 1 159 ? -21.865 23.170 18.713 1.00 37.03 ? 159 LEU E CB 1 +ATOM 23998 C CG . LEU E 1 159 ? -21.286 21.816 19.131 1.00 38.94 ? 159 LEU E CG 1 +ATOM 23999 C CD1 . LEU E 1 159 ? -19.934 21.609 18.487 1.00 41.72 ? 159 LEU E CD1 1 +ATOM 24000 C CD2 . LEU E 1 159 ? -21.146 21.756 20.642 1.00 41.18 ? 159 LEU E CD2 1 +ATOM 24001 N N . GLU E 1 160 ? -24.276 25.311 18.165 1.00 38.25 ? 160 GLU E N 1 +ATOM 24002 C CA . GLU E 1 160 ? -24.667 26.702 17.998 1.00 38.64 ? 160 GLU E CA 1 +ATOM 24003 C C . GLU E 1 160 ? -25.638 27.057 19.118 1.00 38.12 ? 160 GLU E C 1 +ATOM 24004 O O . GLU E 1 160 ? -25.484 28.078 19.784 1.00 38.68 ? 160 GLU E O 1 +ATOM 24005 C CB . GLU E 1 160 ? -25.348 26.931 16.648 1.00 40.17 ? 160 GLU E CB 1 +ATOM 24006 C CG . GLU E 1 160 ? -24.451 26.744 15.446 1.00 44.78 ? 160 GLU E CG 1 +ATOM 24007 C CD . GLU E 1 160 ? -25.156 27.073 14.133 1.00 49.01 ? 160 GLU E CD 1 +ATOM 24008 O OE1 . GLU E 1 160 ? -26.362 26.751 14.002 1.00 51.54 ? 160 GLU E OE1 1 +ATOM 24009 O OE2 . GLU E 1 160 ? -24.500 27.639 13.227 1.00 49.86 ? 160 GLU E OE2 1 +ATOM 24010 N N . LYS E 1 161 ? -26.641 26.214 19.330 1.00 36.19 ? 161 LYS E N 1 +ATOM 24011 C CA . LYS E 1 161 ? -27.610 26.492 20.380 1.00 36.30 ? 161 LYS E CA 1 +ATOM 24012 C C . LYS E 1 161 ? -26.928 26.484 21.742 1.00 35.92 ? 161 LYS E C 1 +ATOM 24013 O O . LYS E 1 161 ? -27.188 27.348 22.577 1.00 36.03 ? 161 LYS E O 1 +ATOM 24014 C CB . LYS E 1 161 ? -28.745 25.466 20.360 1.00 35.56 ? 161 LYS E CB 1 +ATOM 24015 C CG . LYS E 1 161 ? -29.574 25.459 19.083 1.00 34.58 ? 161 LYS E CG 1 +ATOM 24016 C CD . LYS E 1 161 ? -30.781 24.537 19.248 1.00 36.97 ? 161 LYS E CD 1 +ATOM 24017 C CE . LYS E 1 161 ? -31.596 24.409 17.973 1.00 36.17 ? 161 LYS E CE 1 +ATOM 24018 N NZ . LYS E 1 161 ? -30.854 23.698 16.902 1.00 37.21 ? 161 LYS E NZ 1 +ATOM 24019 N N . TYR E 1 162 ? -26.049 25.508 21.962 1.00 35.44 ? 162 TYR E N 1 +ATOM 24020 C CA . TYR E 1 162 ? -25.325 25.400 23.225 1.00 34.50 ? 162 TYR E CA 1 +ATOM 24021 C C . TYR E 1 162 ? -24.507 26.669 23.468 1.00 34.87 ? 162 TYR E C 1 +ATOM 24022 O O . TYR E 1 162 ? -24.508 27.230 24.567 1.00 32.57 ? 162 TYR E O 1 +ATOM 24023 C CB . TYR E 1 162 ? -24.386 24.183 23.204 1.00 33.71 ? 162 TYR E CB 1 +ATOM 24024 C CG . TYR E 1 162 ? -23.444 24.138 24.383 1.00 28.35 ? 162 TYR E CG 1 +ATOM 24025 C CD1 . TYR E 1 162 ? -23.895 23.799 25.651 1.00 27.91 ? 162 TYR E CD1 1 +ATOM 24026 C CD2 . TYR E 1 162 ? -22.117 24.509 24.236 1.00 30.12 ? 162 TYR E CD2 1 +ATOM 24027 C CE1 . TYR E 1 162 ? -23.050 23.838 26.747 1.00 30.15 ? 162 TYR E CE1 1 +ATOM 24028 C CE2 . TYR E 1 162 ? -21.258 24.553 25.325 1.00 30.69 ? 162 TYR E CE2 1 +ATOM 24029 C CZ . TYR E 1 162 ? -21.730 24.219 26.572 1.00 29.67 ? 162 TYR E CZ 1 +ATOM 24030 O OH . TYR E 1 162 ? -20.879 24.294 27.636 1.00 31.08 ? 162 TYR E OH 1 +ATOM 24031 N N . THR E 1 163 ? -23.809 27.116 22.431 1.00 35.55 ? 163 THR E N 1 +ATOM 24032 C CA . THR E 1 163 ? -22.988 28.317 22.522 1.00 38.01 ? 163 THR E CA 1 +ATOM 24033 C C . THR E 1 163 ? -23.858 29.548 22.742 1.00 39.30 ? 163 THR E C 1 +ATOM 24034 O O . THR E 1 163 ? -23.469 30.484 23.436 1.00 37.71 ? 163 THR E O 1 +ATOM 24035 C CB . THR E 1 163 ? -22.145 28.506 21.246 1.00 38.77 ? 163 THR E CB 1 +ATOM 24036 O OG1 . THR E 1 163 ? -21.248 27.398 21.102 1.00 40.78 ? 163 THR E OG1 1 +ATOM 24037 C CG2 . THR E 1 163 ? -21.329 29.773 21.330 1.00 40.05 ? 163 THR E CG2 1 +ATOM 24038 N N . GLU E 1 164 ? -25.040 29.545 22.138 1.00 41.78 ? 164 GLU E N 1 +ATOM 24039 C CA . GLU E 1 164 ? -25.973 30.647 22.290 1.00 43.45 ? 164 GLU E CA 1 +ATOM 24040 C C . GLU E 1 164 ? -26.355 30.707 23.768 1.00 42.07 ? 164 GLU E C 1 +ATOM 24041 O O . GLU E 1 164 ? -26.435 31.779 24.367 1.00 42.18 ? 164 GLU E O 1 +ATOM 24042 C CB . GLU E 1 164 ? -27.219 30.392 21.436 1.00 48.69 ? 164 GLU E CB 1 +ATOM 24043 C CG . GLU E 1 164 ? -28.306 31.442 21.583 1.00 56.92 ? 164 GLU E CG 1 +ATOM 24044 C CD . GLU E 1 164 ? -28.072 32.660 20.698 1.00 63.74 ? 164 GLU E CD 1 +ATOM 24045 O OE1 . GLU E 1 164 ? -26.898 33.085 20.560 1.00 67.20 ? 164 GLU E OE1 1 +ATOM 24046 O OE2 . GLU E 1 164 ? -29.065 33.199 20.148 1.00 65.96 ? 164 GLU E OE2 1 +ATOM 24047 N N . LEU E 1 165 ? -26.564 29.535 24.355 1.00 40.31 ? 165 LEU E N 1 +ATOM 24048 C CA . LEU E 1 165 ? -26.957 29.419 25.754 1.00 38.50 ? 165 LEU E CA 1 +ATOM 24049 C C . LEU E 1 165 ? -25.862 29.792 26.764 1.00 38.76 ? 165 LEU E C 1 +ATOM 24050 O O . LEU E 1 165 ? -26.075 30.623 27.650 1.00 37.95 ? 165 LEU E O 1 +ATOM 24051 C CB . LEU E 1 165 ? -27.405 27.984 26.037 1.00 38.45 ? 165 LEU E CB 1 +ATOM 24052 C CG . LEU E 1 165 ? -28.482 27.693 27.087 1.00 40.20 ? 165 LEU E CG 1 +ATOM 24053 C CD1 . LEU E 1 165 ? -28.184 26.351 27.733 1.00 38.95 ? 165 LEU E CD1 1 +ATOM 24054 C CD2 . LEU E 1 165 ? -28.525 28.775 28.134 1.00 41.43 ? 165 LEU E CD2 1 +ATOM 24055 N N . THR E 1 166 ? -24.690 29.177 26.638 1.00 37.15 ? 166 THR E N 1 +ATOM 24056 C CA . THR E 1 166 ? -23.623 29.423 27.596 1.00 36.79 ? 166 THR E CA 1 +ATOM 24057 C C . THR E 1 166 ? -22.674 30.572 27.294 1.00 36.86 ? 166 THR E C 1 +ATOM 24058 O O . THR E 1 166 ? -21.979 31.048 28.196 1.00 35.03 ? 166 THR E O 1 +ATOM 24059 C CB . THR E 1 166 ? -22.793 28.142 27.836 1.00 36.11 ? 166 THR E CB 1 +ATOM 24060 O OG1 . THR E 1 166 ? -22.159 27.736 26.616 1.00 34.24 ? 166 THR E OG1 1 +ATOM 24061 C CG2 . THR E 1 166 ? -23.695 27.028 28.334 1.00 34.69 ? 166 THR E CG2 1 +ATOM 24062 N N . GLY E 1 167 ? -22.645 31.022 26.042 1.00 35.70 ? 167 GLY E N 1 +ATOM 24063 C CA . GLY E 1 167 ? -21.778 32.130 25.688 1.00 35.70 ? 167 GLY E CA 1 +ATOM 24064 C C . GLY E 1 167 ? -20.898 31.888 24.477 1.00 37.71 ? 167 GLY E C 1 +ATOM 24065 O O . GLY E 1 167 ? -20.307 30.817 24.318 1.00 37.79 ? 167 GLY E O 1 +ATOM 24066 N N . LYS E 1 168 ? -20.816 32.883 23.607 1.00 38.49 ? 168 LYS E N 1 +ATOM 24067 C CA . LYS E 1 168 ? -19.987 32.774 22.420 1.00 40.39 ? 168 LYS E CA 1 +ATOM 24068 C C . LYS E 1 168 ? -18.528 32.974 22.833 1.00 40.61 ? 168 LYS E C 1 +ATOM 24069 O O . LYS E 1 168 ? -18.226 33.714 23.777 1.00 40.03 ? 168 LYS E O 1 +ATOM 24070 C CB . LYS E 1 168 ? -20.359 33.856 21.397 1.00 42.15 ? 168 LYS E CB 1 +ATOM 24071 C CG . LYS E 1 168 ? -21.791 33.821 20.871 1.00 46.97 ? 168 LYS E CG 1 +ATOM 24072 C CD . LYS E 1 168 ? -22.052 32.608 19.986 1.00 50.17 ? 168 LYS E CD 1 +ATOM 24073 C CE . LYS E 1 168 ? -23.487 32.602 19.451 1.00 52.70 ? 168 LYS E CE 1 +ATOM 24074 N NZ . LYS E 1 168 ? -23.817 31.346 18.696 1.00 54.02 ? 168 LYS E NZ 1 +ATOM 24075 N N . PRO E 1 169 ? -17.602 32.291 22.151 1.00 39.62 ? 169 PRO E N 1 +ATOM 24076 C CA . PRO E 1 169 ? -16.184 32.443 22.481 1.00 39.53 ? 169 PRO E CA 1 +ATOM 24077 C C . PRO E 1 169 ? -15.757 33.888 22.185 1.00 39.92 ? 169 PRO E C 1 +ATOM 24078 O O . PRO E 1 169 ? -16.221 34.486 21.214 1.00 41.08 ? 169 PRO E O 1 +ATOM 24079 C CB . PRO E 1 169 ? -15.506 31.464 21.527 1.00 38.62 ? 169 PRO E CB 1 +ATOM 24080 C CG . PRO E 1 169 ? -16.547 30.411 21.334 1.00 39.18 ? 169 PRO E CG 1 +ATOM 24081 C CD . PRO E 1 169 ? -17.815 31.192 21.196 1.00 37.37 ? 169 PRO E CD 1 +ATOM 24082 N N . PHE E 1 170 ? -14.889 34.457 23.012 1.00 40.05 ? 170 PHE E N 1 +ATOM 24083 C CA . PHE E 1 170 ? -14.418 35.813 22.755 1.00 39.95 ? 170 PHE E CA 1 +ATOM 24084 C C . PHE E 1 170 ? -13.508 35.739 21.531 1.00 39.24 ? 170 PHE E C 1 +ATOM 24085 O O . PHE E 1 170 ? -12.993 34.671 21.200 1.00 38.79 ? 170 PHE E O 1 +ATOM 24086 C CB . PHE E 1 170 ? -13.616 36.358 23.944 1.00 41.25 ? 170 PHE E CB 1 +ATOM 24087 C CG . PHE E 1 170 ? -12.249 35.729 24.107 1.00 44.29 ? 170 PHE E CG 1 +ATOM 24088 C CD1 . PHE E 1 170 ? -12.117 34.390 24.476 1.00 44.23 ? 170 PHE E CD1 1 +ATOM 24089 C CD2 . PHE E 1 170 ? -11.091 36.487 23.921 1.00 44.74 ? 170 PHE E CD2 1 +ATOM 24090 C CE1 . PHE E 1 170 ? -10.860 33.821 24.665 1.00 44.44 ? 170 PHE E CE1 1 +ATOM 24091 C CE2 . PHE E 1 170 ? -9.823 35.925 24.107 1.00 44.63 ? 170 PHE E CE2 1 +ATOM 24092 C CZ . PHE E 1 170 ? -9.707 34.590 24.482 1.00 45.10 ? 170 PHE E CZ 1 +ATOM 24093 N N . LEU E 1 171 ? -13.323 36.862 20.850 1.00 38.89 ? 171 LEU E N 1 +ATOM 24094 C CA . LEU E 1 171 ? -12.454 36.883 19.684 1.00 39.99 ? 171 LEU E CA 1 +ATOM 24095 C C . LEU E 1 171 ? -11.091 37.396 20.120 1.00 39.67 ? 171 LEU E C 1 +ATOM 24096 O O . LEU E 1 171 ? -10.931 38.567 20.453 1.00 39.69 ? 171 LEU E O 1 +ATOM 24097 C CB . LEU E 1 171 ? -13.019 37.791 18.592 1.00 39.92 ? 171 LEU E CB 1 +ATOM 24098 C CG . LEU E 1 171 ? -12.131 37.909 17.347 1.00 40.84 ? 171 LEU E CG 1 +ATOM 24099 C CD1 . LEU E 1 171 ? -11.940 36.543 16.699 1.00 40.93 ? 171 LEU E CD1 1 +ATOM 24100 C CD2 . LEU E 1 171 ? -12.769 38.880 16.371 1.00 41.67 ? 171 LEU E CD2 1 +ATOM 24101 N N . PRO E 1 172 ? -10.087 36.514 20.139 1.00 39.41 ? 172 PRO E N 1 +ATOM 24102 C CA . PRO E 1 172 ? -8.746 36.940 20.551 1.00 37.99 ? 172 PRO E CA 1 +ATOM 24103 C C . PRO E 1 172 ? -7.970 37.562 19.405 1.00 36.49 ? 172 PRO E C 1 +ATOM 24104 O O . PRO E 1 172 ? -8.395 37.503 18.254 1.00 35.21 ? 172 PRO E O 1 +ATOM 24105 C CB . PRO E 1 172 ? -8.117 35.643 21.050 1.00 37.71 ? 172 PRO E CB 1 +ATOM 24106 C CG . PRO E 1 172 ? -8.719 34.625 20.147 1.00 39.73 ? 172 PRO E CG 1 +ATOM 24107 C CD . PRO E 1 172 ? -10.171 35.048 20.013 1.00 38.43 ? 172 PRO E CD 1 +ATOM 24108 N N . PRO E 1 173 ? -6.826 38.193 19.709 1.00 36.05 ? 173 PRO E N 1 +ATOM 24109 C CA . PRO E 1 173 ? -6.015 38.813 18.659 1.00 35.12 ? 173 PRO E CA 1 +ATOM 24110 C C . PRO E 1 173 ? -5.339 37.740 17.829 1.00 35.32 ? 173 PRO E C 1 +ATOM 24111 O O . PRO E 1 173 ? -5.127 36.625 18.296 1.00 35.60 ? 173 PRO E O 1 +ATOM 24112 C CB . PRO E 1 173 ? -5.012 39.645 19.443 1.00 34.52 ? 173 PRO E CB 1 +ATOM 24113 C CG . PRO E 1 173 ? -4.836 38.844 20.702 1.00 35.55 ? 173 PRO E CG 1 +ATOM 24114 C CD . PRO E 1 173 ? -6.249 38.442 21.040 1.00 35.17 ? 173 PRO E CD 1 +ATOM 24115 N N . MET E 1 174 ? -4.993 38.074 16.598 1.00 36.79 ? 174 MET E N 1 +ATOM 24116 C CA . MET E 1 174 ? -4.340 37.110 15.739 1.00 37.88 ? 174 MET E CA 1 +ATOM 24117 C C . MET E 1 174 ? -3.016 36.595 16.311 1.00 36.66 ? 174 MET E C 1 +ATOM 24118 O O . MET E 1 174 ? -2.655 35.442 16.088 1.00 37.29 ? 174 MET E O 1 +ATOM 24119 C CB . MET E 1 174 ? -4.121 37.710 14.352 1.00 40.51 ? 174 MET E CB 1 +ATOM 24120 C CG . MET E 1 174 ? -3.493 36.747 13.356 1.00 47.15 ? 174 MET E CG 1 +ATOM 24121 S SD . MET E 1 174 ? -3.573 37.341 11.641 1.00 53.66 ? 174 MET E SD 1 +ATOM 24122 C CE . MET E 1 174 ? -4.445 35.994 10.853 1.00 52.22 ? 174 MET E CE 1 +ATOM 24123 N N . TRP E 1 175 ? -2.289 37.421 17.056 1.00 35.41 ? 175 TRP E N 1 +ATOM 24124 C CA . TRP E 1 175 ? -1.018 36.950 17.602 1.00 35.31 ? 175 TRP E CA 1 +ATOM 24125 C C . TRP E 1 175 ? -1.183 35.841 18.637 1.00 34.75 ? 175 TRP E C 1 +ATOM 24126 O O . TRP E 1 175 ? -0.229 35.132 18.937 1.00 34.79 ? 175 TRP E O 1 +ATOM 24127 C CB . TRP E 1 175 ? -0.195 38.102 18.205 1.00 35.19 ? 175 TRP E CB 1 +ATOM 24128 C CG . TRP E 1 175 ? -0.869 38.909 19.289 1.00 34.39 ? 175 TRP E CG 1 +ATOM 24129 C CD1 . TRP E 1 175 ? -1.484 40.116 19.144 1.00 35.23 ? 175 TRP E CD1 1 +ATOM 24130 C CD2 . TRP E 1 175 ? -0.929 38.597 20.685 1.00 33.85 ? 175 TRP E CD2 1 +ATOM 24131 N NE1 . TRP E 1 175 ? -1.917 40.585 20.365 1.00 35.42 ? 175 TRP E NE1 1 +ATOM 24132 C CE2 . TRP E 1 175 ? -1.588 39.672 21.329 1.00 34.45 ? 175 TRP E CE2 1 +ATOM 24133 C CE3 . TRP E 1 175 ? -0.487 37.517 21.458 1.00 34.32 ? 175 TRP E CE3 1 +ATOM 24134 C CZ2 . TRP E 1 175 ? -1.815 39.698 22.710 1.00 33.86 ? 175 TRP E CZ2 1 +ATOM 24135 C CZ3 . TRP E 1 175 ? -0.713 37.542 22.840 1.00 32.76 ? 175 TRP E CZ3 1 +ATOM 24136 C CH2 . TRP E 1 175 ? -1.370 38.629 23.447 1.00 33.58 ? 175 TRP E CH2 1 +ATOM 24137 N N . ALA E 1 176 ? -2.390 35.685 19.175 1.00 33.72 ? 176 ALA E N 1 +ATOM 24138 C CA . ALA E 1 176 ? -2.638 34.642 20.165 1.00 33.81 ? 176 ALA E CA 1 +ATOM 24139 C C . ALA E 1 176 ? -2.542 33.247 19.528 1.00 33.96 ? 176 ALA E C 1 +ATOM 24140 O O . ALA E 1 176 ? -2.429 32.240 20.234 1.00 33.47 ? 176 ALA E O 1 +ATOM 24141 C CB . ALA E 1 176 ? -4.001 34.837 20.798 1.00 34.15 ? 176 ALA E CB 1 +ATOM 24142 N N . PHE E 1 177 ? -2.577 33.192 18.198 1.00 32.58 ? 177 PHE E N 1 +ATOM 24143 C CA . PHE E 1 177 ? -2.487 31.924 17.495 1.00 33.43 ? 177 PHE E CA 1 +ATOM 24144 C C . PHE E 1 177 ? -1.099 31.702 16.920 1.00 34.45 ? 177 PHE E C 1 +ATOM 24145 O O . PHE E 1 177 ? -0.866 30.741 16.179 1.00 35.86 ? 177 PHE E O 1 +ATOM 24146 C CB . PHE E 1 177 ? -3.536 31.848 16.377 1.00 34.01 ? 177 PHE E CB 1 +ATOM 24147 C CG . PHE E 1 177 ? -4.951 31.994 16.866 1.00 34.75 ? 177 PHE E CG 1 +ATOM 24148 C CD1 . PHE E 1 177 ? -5.467 33.250 17.173 1.00 35.33 ? 177 PHE E CD1 1 +ATOM 24149 C CD2 . PHE E 1 177 ? -5.758 30.877 17.050 1.00 35.40 ? 177 PHE E CD2 1 +ATOM 24150 C CE1 . PHE E 1 177 ? -6.768 33.394 17.658 1.00 36.24 ? 177 PHE E CE1 1 +ATOM 24151 C CE2 . PHE E 1 177 ? -7.064 31.003 17.535 1.00 36.39 ? 177 PHE E CE2 1 +ATOM 24152 C CZ . PHE E 1 177 ? -7.571 32.265 17.841 1.00 37.19 ? 177 PHE E CZ 1 +ATOM 24153 N N . GLY E 1 178 ? -0.168 32.587 17.264 1.00 34.02 ? 178 GLY E N 1 +ATOM 24154 C CA . GLY E 1 178 ? 1.187 32.443 16.766 1.00 33.54 ? 178 GLY E CA 1 +ATOM 24155 C C . GLY E 1 178 ? 2.002 31.447 17.583 1.00 34.30 ? 178 GLY E C 1 +ATOM 24156 O O . GLY E 1 178 ? 1.487 30.812 18.511 1.00 32.31 ? 178 GLY E O 1 +ATOM 24157 N N . TYR E 1 179 ? 3.281 31.320 17.239 1.00 33.36 ? 179 TYR E N 1 +ATOM 24158 C CA . TYR E 1 179 ? 4.182 30.412 17.925 1.00 33.81 ? 179 TYR E CA 1 +ATOM 24159 C C . TYR E 1 179 ? 4.645 31.008 19.261 1.00 34.01 ? 179 TYR E C 1 +ATOM 24160 O O . TYR E 1 179 ? 5.301 32.045 19.295 1.00 33.97 ? 179 TYR E O 1 +ATOM 24161 C CB . TYR E 1 179 ? 5.377 30.121 17.009 1.00 34.98 ? 179 TYR E CB 1 +ATOM 24162 C CG . TYR E 1 179 ? 6.453 29.238 17.597 1.00 33.74 ? 179 TYR E CG 1 +ATOM 24163 C CD1 . TYR E 1 179 ? 6.127 28.112 18.354 1.00 35.07 ? 179 TYR E CD1 1 +ATOM 24164 C CD2 . TYR E 1 179 ? 7.801 29.512 17.366 1.00 35.66 ? 179 TYR E CD2 1 +ATOM 24165 C CE1 . TYR E 1 179 ? 7.118 27.277 18.868 1.00 36.59 ? 179 TYR E CE1 1 +ATOM 24166 C CE2 . TYR E 1 179 ? 8.804 28.685 17.872 1.00 36.61 ? 179 TYR E CE2 1 +ATOM 24167 C CZ . TYR E 1 179 ? 8.453 27.569 18.621 1.00 37.74 ? 179 TYR E CZ 1 +ATOM 24168 O OH . TYR E 1 179 ? 9.436 26.736 19.099 1.00 40.18 ? 179 TYR E OH 1 +ATOM 24169 N N . MET E 1 180 ? 4.301 30.341 20.356 1.00 33.81 ? 180 MET E N 1 +ATOM 24170 C CA . MET E 1 180 ? 4.664 30.795 21.696 1.00 34.86 ? 180 MET E CA 1 +ATOM 24171 C C . MET E 1 180 ? 5.732 29.893 22.302 1.00 35.08 ? 180 MET E C 1 +ATOM 24172 O O . MET E 1 180 ? 5.663 28.664 22.189 1.00 34.24 ? 180 MET E O 1 +ATOM 24173 C CB . MET E 1 180 ? 3.444 30.749 22.625 1.00 37.04 ? 180 MET E CB 1 +ATOM 24174 C CG . MET E 1 180 ? 2.181 31.351 22.058 1.00 40.18 ? 180 MET E CG 1 +ATOM 24175 S SD . MET E 1 180 ? 2.238 33.127 22.023 1.00 43.60 ? 180 MET E SD 1 +ATOM 24176 C CE . MET E 1 180 ? 0.489 33.526 22.052 1.00 43.64 ? 180 MET E CE 1 +ATOM 24177 N N . ILE E 1 181 ? 6.720 30.495 22.949 1.00 34.67 ? 181 ILE E N 1 +ATOM 24178 C CA . ILE E 1 181 ? 7.749 29.701 23.607 1.00 34.66 ? 181 ILE E CA 1 +ATOM 24179 C C . ILE E 1 181 ? 7.542 29.900 25.089 1.00 33.03 ? 181 ILE E C 1 +ATOM 24180 O O . ILE E 1 181 ? 7.152 30.969 25.532 1.00 32.77 ? 181 ILE E O 1 +ATOM 24181 C CB . ILE E 1 181 ? 9.178 30.116 23.206 1.00 33.96 ? 181 ILE E CB 1 +ATOM 24182 C CG1 . ILE E 1 181 ? 9.442 31.569 23.585 1.00 33.92 ? 181 ILE E CG1 1 +ATOM 24183 C CG2 . ILE E 1 181 ? 9.355 29.899 21.715 1.00 34.72 ? 181 ILE E CG2 1 +ATOM 24184 C CD1 . ILE E 1 181 ? 10.854 32.004 23.303 1.00 34.91 ? 181 ILE E CD1 1 +ATOM 24185 N N . SER E 1 182 ? 7.788 28.853 25.857 1.00 33.82 ? 182 SER E N 1 +ATOM 24186 C CA . SER E 1 182 ? 7.569 28.911 27.285 1.00 32.74 ? 182 SER E CA 1 +ATOM 24187 C C . SER E 1 182 ? 8.395 27.838 27.951 1.00 33.08 ? 182 SER E C 1 +ATOM 24188 O O . SER E 1 182 ? 8.899 26.930 27.295 1.00 34.76 ? 182 SER E O 1 +ATOM 24189 C CB . SER E 1 182 ? 6.076 28.680 27.568 1.00 33.62 ? 182 SER E CB 1 +ATOM 24190 O OG . SER E 1 182 ? 5.800 28.499 28.943 1.00 32.71 ? 182 SER E OG 1 +ATOM 24191 N N . ARG E 1 183 ? 8.539 27.955 29.260 1.00 32.66 ? 183 ARG E N 1 +ATOM 24192 C CA . ARG E 1 183 ? 9.278 26.986 30.029 1.00 33.62 ? 183 ARG E CA 1 +ATOM 24193 C C . ARG E 1 183 ? 8.987 27.266 31.486 1.00 34.08 ? 183 ARG E C 1 +ATOM 24194 O O . ARG E 1 183 ? 8.485 28.326 31.844 1.00 34.15 ? 183 ARG E O 1 +ATOM 24195 C CB . ARG E 1 183 ? 10.788 27.089 29.765 1.00 33.37 ? 183 ARG E CB 1 +ATOM 24196 C CG . ARG E 1 183 ? 11.579 25.934 30.406 1.00 36.53 ? 183 ARG E CG 1 +ATOM 24197 C CD . ARG E 1 183 ? 13.097 26.055 30.256 1.00 34.91 ? 183 ARG E CD 1 +ATOM 24198 N NE . ARG E 1 183 ? 13.787 25.050 31.066 1.00 33.02 ? 183 ARG E NE 1 +ATOM 24199 C CZ . ARG E 1 183 ? 14.067 23.808 30.670 1.00 34.08 ? 183 ARG E CZ 1 +ATOM 24200 N NH1 . ARG E 1 183 ? 13.729 23.391 29.457 1.00 34.70 ? 183 ARG E NH1 1 +ATOM 24201 N NH2 . ARG E 1 183 ? 14.678 22.970 31.499 1.00 33.06 ? 183 ARG E NH2 1 +ATOM 24202 N N . TYR E 1 184 ? 9.300 26.300 32.328 1.00 34.31 ? 184 TYR E N 1 +ATOM 24203 C CA . TYR E 1 184 ? 9.093 26.439 33.749 1.00 34.27 ? 184 TYR E CA 1 +ATOM 24204 C C . TYR E 1 184 ? 10.480 26.362 34.398 1.00 34.66 ? 184 TYR E C 1 +ATOM 24205 O O . TYR E 1 184 ? 10.873 25.308 34.888 1.00 34.40 ? 184 TYR E O 1 +ATOM 24206 C CB . TYR E 1 184 ? 8.167 25.301 34.209 1.00 34.22 ? 184 TYR E CB 1 +ATOM 24207 C CG . TYR E 1 184 ? 8.030 25.099 35.695 1.00 33.82 ? 184 TYR E CG 1 +ATOM 24208 C CD1 . TYR E 1 184 ? 8.147 26.164 36.585 1.00 35.14 ? 184 TYR E CD1 1 +ATOM 24209 C CD2 . TYR E 1 184 ? 7.773 23.834 36.212 1.00 36.01 ? 184 TYR E CD2 1 +ATOM 24210 C CE1 . TYR E 1 184 ? 8.016 25.974 37.956 1.00 36.56 ? 184 TYR E CE1 1 +ATOM 24211 C CE2 . TYR E 1 184 ? 7.640 23.629 37.590 1.00 36.57 ? 184 TYR E CE2 1 +ATOM 24212 C CZ . TYR E 1 184 ? 7.764 24.702 38.451 1.00 36.60 ? 184 TYR E CZ 1 +ATOM 24213 O OH . TYR E 1 184 ? 7.651 24.498 39.802 1.00 37.53 ? 184 TYR E OH 1 +ATOM 24214 N N . SER E 1 185 ? 11.236 27.464 34.396 1.00 35.49 ? 185 SER E N 1 +ATOM 24215 C CA . SER E 1 185 ? 10.843 28.755 33.825 1.00 35.99 ? 185 SER E CA 1 +ATOM 24216 C C . SER E 1 185 ? 12.036 29.404 33.115 1.00 36.73 ? 185 SER E C 1 +ATOM 24217 O O . SER E 1 185 ? 13.156 28.894 33.165 1.00 37.82 ? 185 SER E O 1 +ATOM 24218 C CB . SER E 1 185 ? 10.386 29.717 34.930 1.00 36.21 ? 185 SER E CB 1 +ATOM 24219 O OG . SER E 1 185 ? 9.412 29.147 35.790 1.00 35.23 ? 185 SER E OG 1 +ATOM 24220 N N . TYR E 1 186 ? 11.786 30.533 32.453 1.00 37.32 ? 186 TYR E N 1 +ATOM 24221 C CA . TYR E 1 186 ? 12.842 31.283 31.775 1.00 37.08 ? 186 TYR E CA 1 +ATOM 24222 C C . TYR E 1 186 ? 13.227 32.444 32.692 1.00 37.96 ? 186 TYR E C 1 +ATOM 24223 O O . TYR E 1 186 ? 12.359 33.196 33.132 1.00 37.43 ? 186 TYR E O 1 +ATOM 24224 C CB . TYR E 1 186 ? 12.353 31.858 30.445 1.00 36.80 ? 186 TYR E CB 1 +ATOM 24225 C CG . TYR E 1 186 ? 12.213 30.861 29.323 1.00 36.46 ? 186 TYR E CG 1 +ATOM 24226 C CD1 . TYR E 1 186 ? 13.230 29.946 29.039 1.00 35.89 ? 186 TYR E CD1 1 +ATOM 24227 C CD2 . TYR E 1 186 ? 11.081 30.871 28.501 1.00 37.46 ? 186 TYR E CD2 1 +ATOM 24228 C CE1 . TYR E 1 186 ? 13.130 29.068 27.966 1.00 36.65 ? 186 TYR E CE1 1 +ATOM 24229 C CE2 . TYR E 1 186 ? 10.967 29.998 27.422 1.00 37.42 ? 186 TYR E CE2 1 +ATOM 24230 C CZ . TYR E 1 186 ? 11.993 29.101 27.159 1.00 38.53 ? 186 TYR E CZ 1 +ATOM 24231 O OH . TYR E 1 186 ? 11.874 28.252 26.082 1.00 39.33 ? 186 TYR E OH 1 +ATOM 24232 N N . TYR E 1 187 ? 14.520 32.581 32.979 1.00 37.95 ? 187 TYR E N 1 +ATOM 24233 C CA . TYR E 1 187 ? 15.018 33.643 33.845 1.00 38.17 ? 187 TYR E CA 1 +ATOM 24234 C C . TYR E 1 187 ? 16.529 33.522 33.983 1.00 38.89 ? 187 TYR E C 1 +ATOM 24235 O O . TYR E 1 187 ? 17.101 32.482 33.676 1.00 40.22 ? 187 TYR E O 1 +ATOM 24236 C CB . TYR E 1 187 ? 14.381 33.543 35.231 1.00 39.11 ? 187 TYR E CB 1 +ATOM 24237 C CG . TYR E 1 187 ? 14.688 32.253 35.954 1.00 40.13 ? 187 TYR E CG 1 +ATOM 24238 C CD1 . TYR E 1 187 ? 14.094 31.055 35.566 1.00 40.91 ? 187 TYR E CD1 1 +ATOM 24239 C CD2 . TYR E 1 187 ? 15.580 32.229 37.027 1.00 39.38 ? 187 TYR E CD2 1 +ATOM 24240 C CE1 . TYR E 1 187 ? 14.377 29.861 36.231 1.00 41.87 ? 187 TYR E CE1 1 +ATOM 24241 C CE2 . TYR E 1 187 ? 15.869 31.045 37.694 1.00 41.48 ? 187 TYR E CE2 1 +ATOM 24242 C CZ . TYR E 1 187 ? 15.262 29.864 37.294 1.00 41.61 ? 187 TYR E CZ 1 +ATOM 24243 O OH . TYR E 1 187 ? 15.530 28.686 37.959 1.00 44.63 ? 187 TYR E OH 1 +ATOM 24244 N N . PRO E 1 188 ? 17.206 34.593 34.431 1.00 39.20 ? 188 PRO E N 1 +ATOM 24245 C CA . PRO E 1 188 ? 16.672 35.908 34.801 1.00 38.58 ? 188 PRO E CA 1 +ATOM 24246 C C . PRO E 1 188 ? 16.263 36.681 33.536 1.00 37.80 ? 188 PRO E C 1 +ATOM 24247 O O . PRO E 1 188 ? 16.405 36.170 32.422 1.00 36.28 ? 188 PRO E O 1 +ATOM 24248 C CB . PRO E 1 188 ? 17.840 36.545 35.549 1.00 37.29 ? 188 PRO E CB 1 +ATOM 24249 C CG . PRO E 1 188 ? 19.017 36.002 34.804 1.00 37.92 ? 188 PRO E CG 1 +ATOM 24250 C CD . PRO E 1 188 ? 18.665 34.547 34.636 1.00 38.12 ? 188 PRO E CD 1 +ATOM 24251 N N . GLN E 1 189 ? 15.782 37.910 33.699 1.00 38.00 ? 189 GLN E N 1 +ATOM 24252 C CA . GLN E 1 189 ? 15.321 38.682 32.545 1.00 39.42 ? 189 GLN E CA 1 +ATOM 24253 C C . GLN E 1 189 ? 16.258 38.816 31.348 1.00 40.64 ? 189 GLN E C 1 +ATOM 24254 O O . GLN E 1 189 ? 15.786 38.841 30.216 1.00 41.23 ? 189 GLN E O 1 +ATOM 24255 C CB . GLN E 1 189 ? 14.837 40.062 32.983 1.00 38.33 ? 189 GLN E CB 1 +ATOM 24256 C CG . GLN E 1 189 ? 15.891 41.021 33.469 1.00 36.83 ? 189 GLN E CG 1 +ATOM 24257 C CD . GLN E 1 189 ? 15.277 42.342 33.902 1.00 37.60 ? 189 GLN E CD 1 +ATOM 24258 O OE1 . GLN E 1 189 ? 14.781 42.469 35.020 1.00 37.96 ? 189 GLN E OE1 1 +ATOM 24259 N NE2 . GLN E 1 189 ? 15.282 43.325 33.005 1.00 38.92 ? 189 GLN E NE2 1 +ATOM 24260 N N . ASP E 1 190 ? 17.569 38.894 31.570 1.00 42.26 ? 190 ASP E N 1 +ATOM 24261 C CA . ASP E 1 190 ? 18.489 39.006 30.440 1.00 43.52 ? 190 ASP E CA 1 +ATOM 24262 C C . ASP E 1 190 ? 18.473 37.745 29.587 1.00 43.00 ? 190 ASP E C 1 +ATOM 24263 O O . ASP E 1 190 ? 18.599 37.818 28.363 1.00 43.52 ? 190 ASP E O 1 +ATOM 24264 C CB . ASP E 1 190 ? 19.917 39.281 30.909 1.00 47.46 ? 190 ASP E CB 1 +ATOM 24265 C CG . ASP E 1 190 ? 20.072 40.666 31.522 1.00 53.70 ? 190 ASP E CG 1 +ATOM 24266 O OD1 . ASP E 1 190 ? 19.338 41.598 31.111 1.00 55.96 ? 190 ASP E OD1 1 +ATOM 24267 O OD2 . ASP E 1 190 ? 20.938 40.831 32.410 1.00 56.88 ? 190 ASP E OD2 1 +ATOM 24268 N N . LYS E 1 191 ? 18.314 36.592 30.231 1.00 41.14 ? 191 LYS E N 1 +ATOM 24269 C CA . LYS E 1 191 ? 18.277 35.328 29.508 1.00 40.67 ? 191 LYS E CA 1 +ATOM 24270 C C . LYS E 1 191 ? 17.023 35.229 28.635 1.00 38.90 ? 191 LYS E C 1 +ATOM 24271 O O . LYS E 1 191 ? 17.061 34.636 27.559 1.00 37.94 ? 191 LYS E O 1 +ATOM 24272 C CB . LYS E 1 191 ? 18.341 34.152 30.485 1.00 40.63 ? 191 LYS E CB 1 +ATOM 24273 C CG . LYS E 1 191 ? 19.734 33.862 30.991 1.00 42.07 ? 191 LYS E CG 1 +ATOM 24274 C CD . LYS E 1 191 ? 20.571 33.216 29.906 1.00 45.73 ? 191 LYS E CD 1 +ATOM 24275 C CE . LYS E 1 191 ? 21.987 32.936 30.379 1.00 47.54 ? 191 LYS E CE 1 +ATOM 24276 N NZ . LYS E 1 191 ? 22.741 34.196 30.647 1.00 48.69 ? 191 LYS E NZ 1 +ATOM 24277 N N . VAL E 1 192 ? 15.922 35.812 29.102 1.00 37.47 ? 192 VAL E N 1 +ATOM 24278 C CA . VAL E 1 192 ? 14.678 35.795 28.347 1.00 37.62 ? 192 VAL E CA 1 +ATOM 24279 C C . VAL E 1 192 ? 14.891 36.487 27.006 1.00 38.55 ? 192 VAL E C 1 +ATOM 24280 O O . VAL E 1 192 ? 14.513 35.966 25.957 1.00 39.63 ? 192 VAL E O 1 +ATOM 24281 C CB . VAL E 1 192 ? 13.553 36.517 29.118 1.00 38.90 ? 192 VAL E CB 1 +ATOM 24282 C CG1 . VAL E 1 192 ? 12.291 36.609 28.260 1.00 37.09 ? 192 VAL E CG1 1 +ATOM 24283 C CG2 . VAL E 1 192 ? 13.267 35.779 30.417 1.00 38.46 ? 192 VAL E CG2 1 +ATOM 24284 N N . VAL E 1 193 ? 15.522 37.653 27.043 1.00 38.83 ? 193 VAL E N 1 +ATOM 24285 C CA . VAL E 1 193 ? 15.784 38.411 25.840 1.00 39.27 ? 193 VAL E CA 1 +ATOM 24286 C C . VAL E 1 193 ? 16.816 37.727 24.962 1.00 39.76 ? 193 VAL E C 1 +ATOM 24287 O O . VAL E 1 193 ? 16.678 37.728 23.740 1.00 40.59 ? 193 VAL E O 1 +ATOM 24288 C CB . VAL E 1 193 ? 16.260 39.839 26.176 1.00 40.78 ? 193 VAL E CB 1 +ATOM 24289 C CG1 . VAL E 1 193 ? 16.448 40.639 24.892 1.00 39.67 ? 193 VAL E CG1 1 +ATOM 24290 C CG2 . VAL E 1 193 ? 15.238 40.526 27.077 1.00 38.96 ? 193 VAL E CG2 1 +ATOM 24291 N N . GLU E 1 194 ? 17.842 37.142 25.573 1.00 39.41 ? 194 GLU E N 1 +ATOM 24292 C CA . GLU E 1 194 ? 18.872 36.455 24.807 1.00 41.05 ? 194 GLU E CA 1 +ATOM 24293 C C . GLU E 1 194 ? 18.259 35.329 23.987 1.00 39.58 ? 194 GLU E C 1 +ATOM 24294 O O . GLU E 1 194 ? 18.561 35.172 22.803 1.00 38.49 ? 194 GLU E O 1 +ATOM 24295 C CB . GLU E 1 194 ? 19.938 35.876 25.737 1.00 46.23 ? 194 GLU E CB 1 +ATOM 24296 C CG . GLU E 1 194 ? 20.847 36.908 26.393 1.00 53.26 ? 194 GLU E CG 1 +ATOM 24297 C CD . GLU E 1 194 ? 21.728 36.294 27.481 1.00 58.85 ? 194 GLU E CD 1 +ATOM 24298 O OE1 . GLU E 1 194 ? 22.303 35.205 27.238 1.00 62.78 ? 194 GLU E OE1 1 +ATOM 24299 O OE2 . GLU E 1 194 ? 21.851 36.899 28.573 1.00 60.20 ? 194 GLU E OE2 1 +ATOM 24300 N N . LEU E 1 195 ? 17.389 34.551 24.621 1.00 38.82 ? 195 LEU E N 1 +ATOM 24301 C CA . LEU E 1 195 ? 16.748 33.434 23.951 1.00 38.25 ? 195 LEU E CA 1 +ATOM 24302 C C . LEU E 1 195 ? 15.867 33.913 22.798 1.00 37.45 ? 195 LEU E C 1 +ATOM 24303 O O . LEU E 1 195 ? 15.914 33.348 21.706 1.00 36.06 ? 195 LEU E O 1 +ATOM 24304 C CB . LEU E 1 195 ? 15.924 32.619 24.950 1.00 38.45 ? 195 LEU E CB 1 +ATOM 24305 C CG . LEU E 1 195 ? 15.220 31.410 24.329 1.00 39.42 ? 195 LEU E CG 1 +ATOM 24306 C CD1 . LEU E 1 195 ? 16.238 30.483 23.696 1.00 39.85 ? 195 LEU E CD1 1 +ATOM 24307 C CD2 . LEU E 1 195 ? 14.423 30.692 25.381 1.00 40.00 ? 195 LEU E CD2 1 +ATOM 24308 N N . VAL E 1 196 ? 15.073 34.953 23.038 1.00 37.11 ? 196 VAL E N 1 +ATOM 24309 C CA . VAL E 1 196 ? 14.216 35.493 21.991 1.00 38.18 ? 196 VAL E CA 1 +ATOM 24310 C C . VAL E 1 196 ? 15.068 35.955 20.802 1.00 39.44 ? 196 VAL E C 1 +ATOM 24311 O O . VAL E 1 196 ? 14.714 35.725 19.642 1.00 39.46 ? 196 VAL E O 1 +ATOM 24312 C CB . VAL E 1 196 ? 13.366 36.675 22.509 1.00 37.65 ? 196 VAL E CB 1 +ATOM 24313 C CG1 . VAL E 1 196 ? 12.699 37.386 21.345 1.00 37.71 ? 196 VAL E CG1 1 +ATOM 24314 C CG2 . VAL E 1 196 ? 12.306 36.166 23.482 1.00 37.22 ? 196 VAL E CG2 1 +ATOM 24315 N N . ASP E 1 197 ? 16.198 36.593 21.087 1.00 40.45 ? 197 ASP E N 1 +ATOM 24316 C CA . ASP E 1 197 ? 17.079 37.054 20.026 1.00 41.77 ? 197 ASP E CA 1 +ATOM 24317 C C . ASP E 1 197 ? 17.615 35.910 19.185 1.00 42.15 ? 197 ASP E C 1 +ATOM 24318 O O . ASP E 1 197 ? 17.628 35.994 17.958 1.00 43.33 ? 197 ASP E O 1 +ATOM 24319 C CB . ASP E 1 197 ? 18.254 37.851 20.592 1.00 43.59 ? 197 ASP E CB 1 +ATOM 24320 C CG . ASP E 1 197 ? 17.905 39.309 20.839 1.00 47.57 ? 197 ASP E CG 1 +ATOM 24321 O OD1 . ASP E 1 197 ? 17.021 39.842 20.129 1.00 51.47 ? 197 ASP E OD1 1 +ATOM 24322 O OD2 . ASP E 1 197 ? 18.522 39.933 21.728 1.00 48.79 ? 197 ASP E OD2 1 +ATOM 24323 N N . ILE E 1 198 ? 18.064 34.840 19.833 1.00 41.92 ? 198 ILE E N 1 +ATOM 24324 C CA . ILE E 1 198 ? 18.592 33.698 19.098 1.00 41.37 ? 198 ILE E CA 1 +ATOM 24325 C C . ILE E 1 198 ? 17.489 33.079 18.247 1.00 40.55 ? 198 ILE E C 1 +ATOM 24326 O O . ILE E 1 198 ? 17.711 32.732 17.091 1.00 40.13 ? 198 ILE E O 1 +ATOM 24327 C CB . ILE E 1 198 ? 19.164 32.630 20.051 1.00 42.33 ? 198 ILE E CB 1 +ATOM 24328 C CG1 . ILE E 1 198 ? 20.257 33.251 20.917 1.00 44.15 ? 198 ILE E CG1 1 +ATOM 24329 C CG2 . ILE E 1 198 ? 19.761 31.476 19.250 1.00 42.56 ? 198 ILE E CG2 1 +ATOM 24330 C CD1 . ILE E 1 198 ? 20.854 32.298 21.930 1.00 45.18 ? 198 ILE E CD1 1 +ATOM 24331 N N . MET E 1 199 ? 16.299 32.941 18.821 1.00 40.59 ? 199 MET E N 1 +ATOM 24332 C CA . MET E 1 199 ? 15.172 32.376 18.089 1.00 41.84 ? 199 MET E CA 1 +ATOM 24333 C C . MET E 1 199 ? 14.896 33.175 16.815 1.00 41.67 ? 199 MET E C 1 +ATOM 24334 O O . MET E 1 199 ? 14.773 32.611 15.727 1.00 40.84 ? 199 MET E O 1 +ATOM 24335 C CB . MET E 1 199 ? 13.911 32.374 18.960 1.00 42.53 ? 199 MET E CB 1 +ATOM 24336 C CG . MET E 1 199 ? 13.861 31.301 20.036 1.00 43.03 ? 199 MET E CG 1 +ATOM 24337 S SD . MET E 1 199 ? 13.658 29.644 19.363 1.00 47.65 ? 199 MET E SD 1 +ATOM 24338 C CE . MET E 1 199 ? 11.847 29.563 19.139 1.00 45.36 ? 199 MET E CE 1 +ATOM 24339 N N . GLN E 1 200 ? 14.806 34.494 16.953 1.00 42.03 ? 200 GLN E N 1 +ATOM 24340 C CA . GLN E 1 200 ? 14.527 35.352 15.806 1.00 43.57 ? 200 GLN E CA 1 +ATOM 24341 C C . GLN E 1 200 ? 15.666 35.360 14.798 1.00 44.39 ? 200 GLN E C 1 +ATOM 24342 O O . GLN E 1 200 ? 15.441 35.328 13.586 1.00 44.35 ? 200 GLN E O 1 +ATOM 24343 C CB . GLN E 1 200 ? 14.226 36.779 16.275 1.00 43.05 ? 200 GLN E CB 1 +ATOM 24344 C CG . GLN E 1 200 ? 13.019 36.860 17.204 1.00 43.01 ? 200 GLN E CG 1 +ATOM 24345 C CD . GLN E 1 200 ? 12.621 38.280 17.534 1.00 43.71 ? 200 GLN E CD 1 +ATOM 24346 O OE1 . GLN E 1 200 ? 13.465 39.102 17.890 1.00 42.99 ? 200 GLN E OE1 1 +ATOM 24347 N NE2 . GLN E 1 200 ? 11.325 38.576 17.432 1.00 42.39 ? 200 GLN E NE2 1 +ATOM 24348 N N . LYS E 1 201 ? 16.892 35.389 15.298 1.00 45.13 ? 201 LYS E N 1 +ATOM 24349 C CA . LYS E 1 201 ? 18.047 35.395 14.421 1.00 47.24 ? 201 LYS E CA 1 +ATOM 24350 C C . LYS E 1 201 ? 18.096 34.128 13.568 1.00 48.30 ? 201 LYS E C 1 +ATOM 24351 O O . LYS E 1 201 ? 18.513 34.170 12.408 1.00 47.62 ? 201 LYS E O 1 +ATOM 24352 C CB . LYS E 1 201 ? 19.327 35.526 15.241 1.00 49.55 ? 201 LYS E CB 1 +ATOM 24353 C CG . LYS E 1 201 ? 20.591 35.493 14.411 1.00 53.38 ? 201 LYS E CG 1 +ATOM 24354 C CD . LYS E 1 201 ? 21.825 35.644 15.283 1.00 57.74 ? 201 LYS E CD 1 +ATOM 24355 C CE . LYS E 1 201 ? 23.101 35.588 14.451 1.00 59.72 ? 201 LYS E CE 1 +ATOM 24356 N NZ . LYS E 1 201 ? 23.240 34.280 13.749 1.00 61.87 ? 201 LYS E NZ 1 +ATOM 24357 N N . GLU E 1 202 ? 17.668 33.001 14.131 1.00 48.88 ? 202 GLU E N 1 +ATOM 24358 C CA . GLU E 1 202 ? 17.687 31.755 13.374 1.00 49.64 ? 202 GLU E CA 1 +ATOM 24359 C C . GLU E 1 202 ? 16.426 31.513 12.544 1.00 48.43 ? 202 GLU E C 1 +ATOM 24360 O O . GLU E 1 202 ? 16.205 30.415 12.032 1.00 48.59 ? 202 GLU E O 1 +ATOM 24361 C CB . GLU E 1 202 ? 17.977 30.574 14.304 1.00 52.75 ? 202 GLU E CB 1 +ATOM 24362 C CG . GLU E 1 202 ? 19.456 30.514 14.714 1.00 58.37 ? 202 GLU E CG 1 +ATOM 24363 C CD . GLU E 1 202 ? 19.850 29.206 15.394 1.00 62.78 ? 202 GLU E CD 1 +ATOM 24364 O OE1 . GLU E 1 202 ? 19.364 28.137 14.956 1.00 65.38 ? 202 GLU E OE1 1 +ATOM 24365 O OE2 . GLU E 1 202 ? 20.661 29.242 16.353 1.00 64.35 ? 202 GLU E OE2 1 +ATOM 24366 N N . GLY E 1 203 ? 15.600 32.547 12.414 1.00 45.94 ? 203 GLY E N 1 +ATOM 24367 C CA . GLY E 1 203 ? 14.412 32.436 11.597 1.00 44.88 ? 203 GLY E CA 1 +ATOM 24368 C C . GLY E 1 203 ? 13.091 32.023 12.208 1.00 44.95 ? 203 GLY E C 1 +ATOM 24369 O O . GLY E 1 203 ? 12.133 31.802 11.471 1.00 47.20 ? 203 GLY E O 1 +ATOM 24370 N N . PHE E 1 204 ? 13.007 31.911 13.525 1.00 43.05 ? 204 PHE E N 1 +ATOM 24371 C CA . PHE E 1 204 ? 11.743 31.524 14.122 1.00 41.82 ? 204 PHE E CA 1 +ATOM 24372 C C . PHE E 1 204 ? 10.951 32.746 14.511 1.00 41.92 ? 204 PHE E C 1 +ATOM 24373 O O . PHE E 1 204 ? 11.422 33.603 15.248 1.00 43.57 ? 204 PHE E O 1 +ATOM 24374 C CB . PHE E 1 204 ? 11.959 30.620 15.341 1.00 41.32 ? 204 PHE E CB 1 +ATOM 24375 C CG . PHE E 1 204 ? 12.564 29.293 15.000 1.00 40.52 ? 204 PHE E CG 1 +ATOM 24376 C CD1 . PHE E 1 204 ? 13.948 29.138 14.940 1.00 39.92 ? 204 PHE E CD1 1 +ATOM 24377 C CD2 . PHE E 1 204 ? 11.752 28.212 14.685 1.00 38.85 ? 204 PHE E CD2 1 +ATOM 24378 C CE1 . PHE E 1 204 ? 14.509 27.929 14.573 1.00 41.14 ? 204 PHE E CE1 1 +ATOM 24379 C CE2 . PHE E 1 204 ? 12.301 26.999 14.313 1.00 39.96 ? 204 PHE E CE2 1 +ATOM 24380 C CZ . PHE E 1 204 ? 13.685 26.854 14.256 1.00 41.31 ? 204 PHE E CZ 1 +ATOM 24381 N N . ARG E 1 205 ? 9.739 32.830 13.994 1.00 41.79 ? 205 ARG E N 1 +ATOM 24382 C CA . ARG E 1 205 ? 8.869 33.947 14.291 1.00 41.70 ? 205 ARG E CA 1 +ATOM 24383 C C . ARG E 1 205 ? 8.158 33.651 15.610 1.00 40.98 ? 205 ARG E C 1 +ATOM 24384 O O . ARG E 1 205 ? 7.255 32.818 15.674 1.00 41.97 ? 205 ARG E O 1 +ATOM 24385 C CB . ARG E 1 205 ? 7.878 34.117 13.143 1.00 44.09 ? 205 ARG E CB 1 +ATOM 24386 C CG . ARG E 1 205 ? 6.971 35.310 13.238 1.00 46.56 ? 205 ARG E CG 1 +ATOM 24387 C CD . ARG E 1 205 ? 6.124 35.401 11.987 1.00 49.30 ? 205 ARG E CD 1 +ATOM 24388 N NE . ARG E 1 205 ? 5.015 36.333 12.152 1.00 53.68 ? 205 ARG E NE 1 +ATOM 24389 C CZ . ARG E 1 205 ? 4.079 36.543 11.233 1.00 56.21 ? 205 ARG E CZ 1 +ATOM 24390 N NH1 . ARG E 1 205 ? 4.123 35.887 10.079 1.00 56.77 ? 205 ARG E NH1 1 +ATOM 24391 N NH2 . ARG E 1 205 ? 3.094 37.400 11.472 1.00 58.04 ? 205 ARG E NH2 1 +ATOM 24392 N N . VAL E 1 206 ? 8.588 34.329 16.666 1.00 39.49 ? 206 VAL E N 1 +ATOM 24393 C CA . VAL E 1 206 ? 8.018 34.146 17.993 1.00 38.59 ? 206 VAL E CA 1 +ATOM 24394 C C . VAL E 1 206 ? 6.969 35.212 18.297 1.00 38.21 ? 206 VAL E C 1 +ATOM 24395 O O . VAL E 1 206 ? 7.267 36.398 18.282 1.00 39.83 ? 206 VAL E O 1 +ATOM 24396 C CB . VAL E 1 206 ? 9.124 34.211 19.077 1.00 38.57 ? 206 VAL E CB 1 +ATOM 24397 C CG1 . VAL E 1 206 ? 8.515 34.064 20.463 1.00 37.97 ? 206 VAL E CG1 1 +ATOM 24398 C CG2 . VAL E 1 206 ? 10.152 33.122 18.831 1.00 39.16 ? 206 VAL E CG2 1 +ATOM 24399 N N . ALA E 1 207 ? 5.748 34.780 18.587 1.00 35.61 ? 207 ALA E N 1 +ATOM 24400 C CA . ALA E 1 207 ? 4.661 35.692 18.893 1.00 34.87 ? 207 ALA E CA 1 +ATOM 24401 C C . ALA E 1 207 ? 4.697 36.180 20.336 1.00 34.97 ? 207 ALA E C 1 +ATOM 24402 O O . ALA E 1 207 ? 4.387 37.331 20.622 1.00 35.89 ? 207 ALA E O 1 +ATOM 24403 C CB . ALA E 1 207 ? 3.322 35.012 18.611 1.00 34.10 ? 207 ALA E CB 1 +ATOM 24404 N N . GLY E 1 208 ? 5.058 35.296 21.252 1.00 35.44 ? 208 GLY E N 1 +ATOM 24405 C CA . GLY E 1 208 ? 5.106 35.678 22.653 1.00 35.33 ? 208 GLY E CA 1 +ATOM 24406 C C . GLY E 1 208 ? 5.873 34.688 23.511 1.00 35.25 ? 208 GLY E C 1 +ATOM 24407 O O . GLY E 1 208 ? 6.143 33.560 23.092 1.00 36.49 ? 208 GLY E O 1 +ATOM 24408 N N . VAL E 1 209 ? 6.247 35.117 24.709 1.00 33.71 ? 209 VAL E N 1 +ATOM 24409 C CA . VAL E 1 209 ? 6.966 34.250 25.624 1.00 33.50 ? 209 VAL E CA 1 +ATOM 24410 C C . VAL E 1 209 ? 6.190 34.217 26.918 1.00 32.15 ? 209 VAL E C 1 +ATOM 24411 O O . VAL E 1 209 ? 5.645 35.238 27.344 1.00 32.30 ? 209 VAL E O 1 +ATOM 24412 C CB . VAL E 1 209 ? 8.406 34.750 25.898 1.00 34.16 ? 209 VAL E CB 1 +ATOM 24413 C CG1 . VAL E 1 209 ? 9.132 34.959 24.587 1.00 37.26 ? 209 VAL E CG1 1 +ATOM 24414 C CG2 . VAL E 1 209 ? 8.385 36.026 26.679 1.00 34.80 ? 209 VAL E CG2 1 +ATOM 24415 N N . PHE E 1 210 ? 6.110 33.038 27.524 1.00 30.74 ? 210 PHE E N 1 +ATOM 24416 C CA . PHE E 1 210 ? 5.397 32.885 28.774 1.00 30.27 ? 210 PHE E CA 1 +ATOM 24417 C C . PHE E 1 210 ? 6.381 32.877 29.930 1.00 31.11 ? 210 PHE E C 1 +ATOM 24418 O O . PHE E 1 210 ? 7.438 32.259 29.855 1.00 33.22 ? 210 PHE E O 1 +ATOM 24419 C CB . PHE E 1 210 ? 4.598 31.583 28.772 1.00 31.05 ? 210 PHE E CB 1 +ATOM 24420 C CG . PHE E 1 210 ? 3.370 31.623 27.910 1.00 31.54 ? 210 PHE E CG 1 +ATOM 24421 C CD1 . PHE E 1 210 ? 3.465 31.898 26.549 1.00 29.48 ? 210 PHE E CD1 1 +ATOM 24422 C CD2 . PHE E 1 210 ? 2.110 31.407 28.463 1.00 30.78 ? 210 PHE E CD2 1 +ATOM 24423 C CE1 . PHE E 1 210 ? 2.329 31.961 25.756 1.00 29.81 ? 210 PHE E CE1 1 +ATOM 24424 C CE2 . PHE E 1 210 ? 0.965 31.466 27.672 1.00 31.08 ? 210 PHE E CE2 1 +ATOM 24425 C CZ . PHE E 1 210 ? 1.075 31.746 26.313 1.00 28.83 ? 210 PHE E CZ 1 +ATOM 24426 N N . LEU E 1 211 ? 6.024 33.566 31.002 1.00 30.62 ? 211 LEU E N 1 +ATOM 24427 C CA . LEU E 1 211 ? 6.865 33.627 32.183 1.00 30.44 ? 211 LEU E CA 1 +ATOM 24428 C C . LEU E 1 211 ? 6.187 32.815 33.273 1.00 30.37 ? 211 LEU E C 1 +ATOM 24429 O O . LEU E 1 211 ? 5.104 33.178 33.737 1.00 27.95 ? 211 LEU E O 1 +ATOM 24430 C CB . LEU E 1 211 ? 7.022 35.081 32.630 1.00 31.92 ? 211 LEU E CB 1 +ATOM 24431 C CG . LEU E 1 211 ? 8.417 35.708 32.569 1.00 33.96 ? 211 LEU E CG 1 +ATOM 24432 C CD1 . LEU E 1 211 ? 9.146 35.306 31.299 1.00 32.61 ? 211 LEU E CD1 1 +ATOM 24433 C CD2 . LEU E 1 211 ? 8.274 37.222 32.678 1.00 34.24 ? 211 LEU E CD2 1 +ATOM 24434 N N . ASP E 1 212 ? 6.819 31.709 33.671 1.00 30.73 ? 212 ASP E N 1 +ATOM 24435 C CA . ASP E 1 212 ? 6.263 30.847 34.709 1.00 30.42 ? 212 ASP E CA 1 +ATOM 24436 C C . ASP E 1 212 ? 6.629 31.402 36.092 1.00 31.28 ? 212 ASP E C 1 +ATOM 24437 O O . ASP E 1 212 ? 7.325 32.414 36.193 1.00 30.35 ? 212 ASP E O 1 +ATOM 24438 C CB . ASP E 1 212 ? 6.759 29.404 34.534 1.00 32.23 ? 212 ASP E CB 1 +ATOM 24439 C CG . ASP E 1 212 ? 5.731 28.364 34.988 1.00 32.54 ? 212 ASP E CG 1 +ATOM 24440 O OD1 . ASP E 1 212 ? 5.095 28.558 36.053 1.00 32.04 ? 212 ASP E OD1 1 +ATOM 24441 O OD2 . ASP E 1 212 ? 5.569 27.341 34.282 1.00 31.75 ? 212 ASP E OD2 1 +ATOM 24442 N N . ILE E 1 213 ? 6.176 30.726 37.146 1.00 31.68 ? 213 ILE E N 1 +ATOM 24443 C CA . ILE E 1 213 ? 6.351 31.191 38.522 1.00 32.06 ? 213 ILE E CA 1 +ATOM 24444 C C . ILE E 1 213 ? 7.702 31.663 39.062 1.00 33.17 ? 213 ILE E C 1 +ATOM 24445 O O . ILE E 1 213 ? 7.739 32.332 40.097 1.00 32.06 ? 213 ILE E O 1 +ATOM 24446 C CB . ILE E 1 213 ? 5.762 30.169 39.525 1.00 31.88 ? 213 ILE E CB 1 +ATOM 24447 C CG1 . ILE E 1 213 ? 6.547 28.862 39.482 1.00 30.90 ? 213 ILE E CG1 1 +ATOM 24448 C CG2 . ILE E 1 213 ? 4.285 29.922 39.205 1.00 30.24 ? 213 ILE E CG2 1 +ATOM 24449 C CD1 . ILE E 1 213 ? 6.047 27.835 40.489 1.00 30.78 ? 213 ILE E CD1 1 +ATOM 24450 N N . HIS E 1 214 ? 8.802 31.344 38.387 1.00 33.40 ? 214 HIS E N 1 +ATOM 24451 C CA . HIS E 1 214 ? 10.107 31.786 38.862 1.00 34.32 ? 214 HIS E CA 1 +ATOM 24452 C C . HIS E 1 214 ? 10.296 33.302 38.785 1.00 36.06 ? 214 HIS E C 1 +ATOM 24453 O O . HIS E 1 214 ? 11.234 33.831 39.395 1.00 36.44 ? 214 HIS E O 1 +ATOM 24454 C CB . HIS E 1 214 ? 11.248 31.136 38.075 1.00 36.96 ? 214 HIS E CB 1 +ATOM 24455 C CG . HIS E 1 214 ? 11.505 29.707 38.428 1.00 38.43 ? 214 HIS E CG 1 +ATOM 24456 N ND1 . HIS E 1 214 ? 10.737 28.669 37.949 1.00 39.93 ? 214 HIS E ND1 1 +ATOM 24457 C CD2 . HIS E 1 214 ? 12.470 29.138 39.188 1.00 40.37 ? 214 HIS E CD2 1 +ATOM 24458 C CE1 . HIS E 1 214 ? 11.219 27.522 38.392 1.00 39.95 ? 214 HIS E CE1 1 +ATOM 24459 N NE2 . HIS E 1 214 ? 12.272 27.778 39.147 1.00 39.60 ? 214 HIS E NE2 1 +ATOM 24460 N N . TYR E 1 215 ? 9.430 34.000 38.047 1.00 34.81 ? 215 TYR E N 1 +ATOM 24461 C CA . TYR E 1 215 ? 9.551 35.453 37.905 1.00 33.58 ? 215 TYR E CA 1 +ATOM 24462 C C . TYR E 1 215 ? 9.059 36.202 39.132 1.00 34.80 ? 215 TYR E C 1 +ATOM 24463 O O . TYR E 1 215 ? 9.428 37.357 39.352 1.00 34.98 ? 215 TYR E O 1 +ATOM 24464 C CB . TYR E 1 215 ? 8.793 35.955 36.656 1.00 31.95 ? 215 TYR E CB 1 +ATOM 24465 C CG . TYR E 1 215 ? 7.297 36.165 36.823 1.00 29.80 ? 215 TYR E CG 1 +ATOM 24466 C CD1 . TYR E 1 215 ? 6.799 37.216 37.582 1.00 30.22 ? 215 TYR E CD1 1 +ATOM 24467 C CD2 . TYR E 1 215 ? 6.380 35.317 36.202 1.00 30.82 ? 215 TYR E CD2 1 +ATOM 24468 C CE1 . TYR E 1 215 ? 5.425 37.423 37.724 1.00 31.02 ? 215 TYR E CE1 1 +ATOM 24469 C CE2 . TYR E 1 215 ? 5.008 35.510 36.331 1.00 30.10 ? 215 TYR E CE2 1 +ATOM 24470 C CZ . TYR E 1 215 ? 4.539 36.564 37.095 1.00 32.23 ? 215 TYR E CZ 1 +ATOM 24471 O OH . TYR E 1 215 ? 3.183 36.753 37.236 1.00 32.98 ? 215 TYR E OH 1 +ATOM 24472 N N . MET E 1 216 ? 8.222 35.551 39.926 1.00 36.24 ? 216 MET E N 1 +ATOM 24473 C CA . MET E 1 216 ? 7.670 36.175 41.126 1.00 38.25 ? 216 MET E CA 1 +ATOM 24474 C C . MET E 1 216 ? 8.650 36.208 42.293 1.00 39.42 ? 216 MET E C 1 +ATOM 24475 O O . MET E 1 216 ? 9.666 35.512 42.312 1.00 39.28 ? 216 MET E O 1 +ATOM 24476 C CB . MET E 1 216 ? 6.408 35.432 41.583 1.00 39.49 ? 216 MET E CB 1 +ATOM 24477 C CG . MET E 1 216 ? 5.251 35.480 40.614 1.00 40.97 ? 216 MET E CG 1 +ATOM 24478 S SD . MET E 1 216 ? 3.865 34.483 41.168 1.00 42.73 ? 216 MET E SD 1 +ATOM 24479 C CE . MET E 1 216 ? 3.899 33.173 40.019 1.00 43.12 ? 216 MET E CE 1 +ATOM 24480 N N . ASP E 1 217 ? 8.329 37.034 43.275 1.00 40.44 ? 217 ASP E N 1 +ATOM 24481 C CA . ASP E 1 217 ? 9.136 37.138 44.476 1.00 40.88 ? 217 ASP E CA 1 +ATOM 24482 C C . ASP E 1 217 ? 8.548 36.142 45.478 1.00 40.19 ? 217 ASP E C 1 +ATOM 24483 O O . ASP E 1 217 ? 7.482 36.375 46.043 1.00 38.61 ? 217 ASP E O 1 +ATOM 24484 C CB . ASP E 1 217 ? 9.069 38.567 45.018 1.00 42.23 ? 217 ASP E CB 1 +ATOM 24485 C CG . ASP E 1 217 ? 9.684 38.702 46.401 1.00 45.53 ? 217 ASP E CG 1 +ATOM 24486 O OD1 . ASP E 1 217 ? 10.554 37.880 46.769 1.00 46.79 ? 217 ASP E OD1 1 +ATOM 24487 O OD2 . ASP E 1 217 ? 9.303 39.647 47.124 1.00 47.95 ? 217 ASP E OD2 1 +ATOM 24488 N N . SER E 1 218 ? 9.239 35.022 45.676 1.00 41.69 ? 218 SER E N 1 +ATOM 24489 C CA . SER E 1 218 ? 8.773 33.984 46.595 1.00 42.17 ? 218 SER E CA 1 +ATOM 24490 C C . SER E 1 218 ? 7.390 33.478 46.207 1.00 42.33 ? 218 SER E C 1 +ATOM 24491 O O . SER E 1 218 ? 6.588 33.154 47.083 1.00 41.91 ? 218 SER E O 1 +ATOM 24492 C CB . SER E 1 218 ? 8.706 34.516 48.025 1.00 43.35 ? 218 SER E CB 1 +ATOM 24493 O OG . SER E 1 218 ? 9.986 34.892 48.495 1.00 47.20 ? 218 SER E OG 1 +ATOM 24494 N N . TYR E 1 219 ? 7.112 33.427 44.904 1.00 41.72 ? 219 TYR E N 1 +ATOM 24495 C CA . TYR E 1 219 ? 5.825 32.953 44.389 1.00 40.94 ? 219 TYR E CA 1 +ATOM 24496 C C . TYR E 1 219 ? 4.640 33.839 44.763 1.00 40.26 ? 219 TYR E C 1 +ATOM 24497 O O . TYR E 1 219 ? 3.493 33.400 44.712 1.00 40.58 ? 219 TYR E O 1 +ATOM 24498 C CB . TYR E 1 219 ? 5.566 31.519 44.863 1.00 40.68 ? 219 TYR E CB 1 +ATOM 24499 C CG . TYR E 1 219 ? 6.714 30.584 44.553 1.00 41.10 ? 219 TYR E CG 1 +ATOM 24500 C CD1 . TYR E 1 219 ? 7.058 30.292 43.235 1.00 41.45 ? 219 TYR E CD1 1 +ATOM 24501 C CD2 . TYR E 1 219 ? 7.502 30.053 45.572 1.00 40.41 ? 219 TYR E CD2 1 +ATOM 24502 C CE1 . TYR E 1 219 ? 8.167 29.501 42.933 1.00 42.76 ? 219 TYR E CE1 1 +ATOM 24503 C CE2 . TYR E 1 219 ? 8.610 29.260 45.286 1.00 41.71 ? 219 TYR E CE2 1 +ATOM 24504 C CZ . TYR E 1 219 ? 8.939 28.990 43.964 1.00 43.29 ? 219 TYR E CZ 1 +ATOM 24505 O OH . TYR E 1 219 ? 10.044 28.227 43.671 1.00 43.54 ? 219 TYR E OH 1 +ATOM 24506 N N . LYS E 1 220 ? 4.912 35.081 45.147 1.00 39.47 ? 220 LYS E N 1 +ATOM 24507 C CA . LYS E 1 220 ? 3.838 36.009 45.497 1.00 39.59 ? 220 LYS E CA 1 +ATOM 24508 C C . LYS E 1 220 ? 3.235 36.642 44.244 1.00 37.44 ? 220 LYS E C 1 +ATOM 24509 O O . LYS E 1 220 ? 3.937 37.264 43.448 1.00 37.80 ? 220 LYS E O 1 +ATOM 24510 C CB . LYS E 1 220 ? 4.356 37.110 46.426 1.00 41.18 ? 220 LYS E CB 1 +ATOM 24511 C CG . LYS E 1 220 ? 4.574 36.651 47.841 1.00 43.51 ? 220 LYS E CG 1 +ATOM 24512 C CD . LYS E 1 220 ? 4.990 37.792 48.754 1.00 46.15 ? 220 LYS E CD 1 +ATOM 24513 C CE . LYS E 1 220 ? 6.424 38.202 48.512 1.00 47.20 ? 220 LYS E CE 1 +ATOM 24514 N NZ . LYS E 1 220 ? 6.928 39.025 49.646 1.00 52.47 ? 220 LYS E NZ 1 +ATOM 24515 N N . LEU E 1 221 ? 1.932 36.482 44.070 1.00 35.89 ? 221 LEU E N 1 +ATOM 24516 C CA . LEU E 1 221 ? 1.263 37.041 42.904 1.00 35.59 ? 221 LEU E CA 1 +ATOM 24517 C C . LEU E 1 221 ? 1.486 38.542 42.787 1.00 34.95 ? 221 LEU E C 1 +ATOM 24518 O O . LEU E 1 221 ? 1.574 39.254 43.787 1.00 34.93 ? 221 LEU E O 1 +ATOM 24519 C CB . LEU E 1 221 ? -0.245 36.766 42.954 1.00 36.11 ? 221 LEU E CB 1 +ATOM 24520 C CG . LEU E 1 221 ? -0.697 35.315 43.121 1.00 36.09 ? 221 LEU E CG 1 +ATOM 24521 C CD1 . LEU E 1 221 ? -2.211 35.242 42.963 1.00 36.01 ? 221 LEU E CD1 1 +ATOM 24522 C CD2 . LEU E 1 221 ? 0.001 34.423 42.100 1.00 35.02 ? 221 LEU E CD2 1 +ATOM 24523 N N . PHE E 1 222 ? 1.588 39.008 41.549 1.00 34.39 ? 222 PHE E N 1 +ATOM 24524 C CA . PHE E 1 222 ? 1.779 40.416 41.257 1.00 33.13 ? 222 PHE E CA 1 +ATOM 24525 C C . PHE E 1 222 ? 3.050 41.038 41.850 1.00 33.42 ? 222 PHE E C 1 +ATOM 24526 O O . PHE E 1 222 ? 3.030 42.166 42.344 1.00 32.09 ? 222 PHE E O 1 +ATOM 24527 C CB . PHE E 1 222 ? 0.540 41.183 41.707 1.00 29.48 ? 222 PHE E CB 1 +ATOM 24528 C CG . PHE E 1 222 ? -0.739 40.574 41.226 1.00 31.33 ? 222 PHE E CG 1 +ATOM 24529 C CD1 . PHE E 1 222 ? -0.981 40.404 39.866 1.00 31.67 ? 222 PHE E CD1 1 +ATOM 24530 C CD2 . PHE E 1 222 ? -1.692 40.127 42.129 1.00 33.16 ? 222 PHE E CD2 1 +ATOM 24531 C CE1 . PHE E 1 222 ? -2.151 39.794 39.410 1.00 30.47 ? 222 PHE E CE1 1 +ATOM 24532 C CE2 . PHE E 1 222 ? -2.868 39.513 41.686 1.00 32.51 ? 222 PHE E CE2 1 +ATOM 24533 C CZ . PHE E 1 222 ? -3.094 39.347 40.323 1.00 31.77 ? 222 PHE E CZ 1 +ATOM 24534 N N . THR E 1 223 ? 4.153 40.301 41.794 1.00 32.05 ? 223 THR E N 1 +ATOM 24535 C CA . THR E 1 223 ? 5.426 40.817 42.277 1.00 32.24 ? 223 THR E CA 1 +ATOM 24536 C C . THR E 1 223 ? 6.497 40.340 41.318 1.00 32.86 ? 223 THR E C 1 +ATOM 24537 O O . THR E 1 223 ? 6.280 39.404 40.544 1.00 33.61 ? 223 THR E O 1 +ATOM 24538 C CB . THR E 1 223 ? 5.795 40.299 43.696 1.00 33.19 ? 223 THR E CB 1 +ATOM 24539 O OG1 . THR E 1 223 ? 6.090 38.895 43.637 1.00 33.49 ? 223 THR E OG1 1 +ATOM 24540 C CG2 . THR E 1 223 ? 4.662 40.546 44.676 1.00 28.55 ? 223 THR E CG2 1 +ATOM 24541 N N . TRP E 1 224 ? 7.649 40.993 41.351 1.00 32.97 ? 224 TRP E N 1 +ATOM 24542 C CA . TRP E 1 224 ? 8.751 40.603 40.493 1.00 32.54 ? 224 TRP E CA 1 +ATOM 24543 C C . TRP E 1 224 ? 9.907 40.187 41.376 1.00 33.61 ? 224 TRP E C 1 +ATOM 24544 O O . TRP E 1 224 ? 10.193 40.835 42.381 1.00 35.46 ? 224 TRP E O 1 +ATOM 24545 C CB . TRP E 1 224 ? 9.186 41.759 39.596 1.00 30.11 ? 224 TRP E CB 1 +ATOM 24546 C CG . TRP E 1 224 ? 8.203 42.103 38.523 1.00 30.94 ? 224 TRP E CG 1 +ATOM 24547 C CD1 . TRP E 1 224 ? 7.291 43.115 38.543 1.00 31.16 ? 224 TRP E CD1 1 +ATOM 24548 C CD2 . TRP E 1 224 ? 8.057 41.458 37.251 1.00 30.17 ? 224 TRP E CD2 1 +ATOM 24549 N NE1 . TRP E 1 224 ? 6.592 43.152 37.362 1.00 30.59 ? 224 TRP E NE1 1 +ATOM 24550 C CE2 . TRP E 1 224 ? 7.038 42.145 36.550 1.00 30.71 ? 224 TRP E CE2 1 +ATOM 24551 C CE3 . TRP E 1 224 ? 8.688 40.367 36.634 1.00 30.20 ? 224 TRP E CE3 1 +ATOM 24552 C CZ2 . TRP E 1 224 ? 6.631 41.780 35.262 1.00 30.10 ? 224 TRP E CZ2 1 +ATOM 24553 C CZ3 . TRP E 1 224 ? 8.284 40.000 35.349 1.00 32.29 ? 224 TRP E CZ3 1 +ATOM 24554 C CH2 . TRP E 1 224 ? 7.260 40.710 34.677 1.00 30.62 ? 224 TRP E CH2 1 +ATOM 24555 N N . HIS E 1 225 ? 10.560 39.093 41.019 1.00 34.09 ? 225 HIS E N 1 +ATOM 24556 C CA . HIS E 1 225 ? 11.694 38.622 41.788 1.00 35.50 ? 225 HIS E CA 1 +ATOM 24557 C C . HIS E 1 225 ? 12.759 39.726 41.724 1.00 36.89 ? 225 HIS E C 1 +ATOM 24558 O O . HIS E 1 225 ? 13.230 40.085 40.640 1.00 35.91 ? 225 HIS E O 1 +ATOM 24559 C CB . HIS E 1 225 ? 12.216 37.323 41.190 1.00 34.46 ? 225 HIS E CB 1 +ATOM 24560 C CG . HIS E 1 225 ? 13.224 36.635 42.048 1.00 36.56 ? 225 HIS E CG 1 +ATOM 24561 N ND1 . HIS E 1 225 ? 14.514 37.099 42.197 1.00 37.04 ? 225 HIS E ND1 1 +ATOM 24562 C CD2 . HIS E 1 225 ? 13.136 35.512 42.796 1.00 34.41 ? 225 HIS E CD2 1 +ATOM 24563 C CE1 . HIS E 1 225 ? 15.179 36.286 42.998 1.00 36.99 ? 225 HIS E CE1 1 +ATOM 24564 N NE2 . HIS E 1 225 ? 14.365 35.315 43.375 1.00 37.45 ? 225 HIS E NE2 1 +ATOM 24565 N N . PRO E 1 226 ? 13.151 40.272 42.890 1.00 37.20 ? 226 PRO E N 1 +ATOM 24566 C CA . PRO E 1 226 ? 14.147 41.339 43.008 1.00 37.23 ? 226 PRO E CA 1 +ATOM 24567 C C . PRO E 1 226 ? 15.518 41.081 42.397 1.00 37.79 ? 226 PRO E C 1 +ATOM 24568 O O . PRO E 1 226 ? 16.222 42.018 42.038 1.00 38.83 ? 226 PRO E O 1 +ATOM 24569 C CB . PRO E 1 226 ? 14.221 41.570 44.516 1.00 38.22 ? 226 PRO E CB 1 +ATOM 24570 C CG . PRO E 1 226 ? 13.931 40.218 45.079 1.00 39.22 ? 226 PRO E CG 1 +ATOM 24571 C CD . PRO E 1 226 ? 12.765 39.775 44.225 1.00 38.47 ? 226 PRO E CD 1 +ATOM 24572 N N . TYR E 1 227 ? 15.913 39.828 42.274 1.00 37.05 ? 227 TYR E N 1 +ATOM 24573 C CA . TYR E 1 227 ? 17.214 39.562 41.702 1.00 37.32 ? 227 TYR E CA 1 +ATOM 24574 C C . TYR E 1 227 ? 17.133 38.998 40.292 1.00 37.15 ? 227 TYR E C 1 +ATOM 24575 O O . TYR E 1 227 ? 18.061 39.147 39.504 1.00 37.13 ? 227 TYR E O 1 +ATOM 24576 C CB . TYR E 1 227 ? 17.994 38.643 42.642 1.00 41.14 ? 227 TYR E CB 1 +ATOM 24577 C CG . TYR E 1 227 ? 18.121 39.248 44.026 1.00 47.47 ? 227 TYR E CG 1 +ATOM 24578 C CD1 . TYR E 1 227 ? 18.913 40.379 44.242 1.00 50.30 ? 227 TYR E CD1 1 +ATOM 24579 C CD2 . TYR E 1 227 ? 17.390 38.742 45.103 1.00 50.23 ? 227 TYR E CD2 1 +ATOM 24580 C CE1 . TYR E 1 227 ? 18.974 40.999 45.493 1.00 53.22 ? 227 TYR E CE1 1 +ATOM 24581 C CE2 . TYR E 1 227 ? 17.441 39.351 46.362 1.00 53.83 ? 227 TYR E CE2 1 +ATOM 24582 C CZ . TYR E 1 227 ? 18.237 40.482 46.552 1.00 55.76 ? 227 TYR E CZ 1 +ATOM 24583 O OH . TYR E 1 227 ? 18.297 41.094 47.796 1.00 56.93 ? 227 TYR E OH 1 +ATOM 24584 N N . ARG E 1 228 ? 16.019 38.362 39.954 1.00 36.96 ? 228 ARG E N 1 +ATOM 24585 C CA . ARG E 1 228 ? 15.875 37.805 38.614 1.00 35.22 ? 228 ARG E CA 1 +ATOM 24586 C C . ARG E 1 228 ? 15.232 38.810 37.677 1.00 35.53 ? 228 ARG E C 1 +ATOM 24587 O O . ARG E 1 228 ? 15.500 38.803 36.478 1.00 36.42 ? 228 ARG E O 1 +ATOM 24588 C CB . ARG E 1 228 ? 15.027 36.549 38.653 1.00 33.62 ? 228 ARG E CB 1 +ATOM 24589 C CG . ARG E 1 228 ? 15.714 35.378 39.284 1.00 32.71 ? 228 ARG E CG 1 +ATOM 24590 C CD . ARG E 1 228 ? 14.704 34.308 39.600 1.00 31.60 ? 228 ARG E CD 1 +ATOM 24591 N NE . ARG E 1 228 ? 15.310 33.156 40.240 1.00 29.52 ? 228 ARG E NE 1 +ATOM 24592 C CZ . ARG E 1 228 ? 14.645 32.318 41.025 1.00 30.02 ? 228 ARG E CZ 1 +ATOM 24593 N NH1 . ARG E 1 228 ? 13.355 32.521 41.268 1.00 29.21 ? 228 ARG E NH1 1 +ATOM 24594 N NH2 . ARG E 1 228 ? 15.265 31.261 41.539 1.00 30.01 ? 228 ARG E NH2 1 +ATOM 24595 N N . PHE E 1 229 ? 14.373 39.664 38.233 1.00 35.02 ? 229 PHE E N 1 +ATOM 24596 C CA . PHE E 1 229 ? 13.680 40.682 37.452 1.00 34.23 ? 229 PHE E CA 1 +ATOM 24597 C C . PHE E 1 229 ? 13.698 42.048 38.151 1.00 34.81 ? 229 PHE E C 1 +ATOM 24598 O O . PHE E 1 229 ? 12.657 42.572 38.535 1.00 37.81 ? 229 PHE E O 1 +ATOM 24599 C CB . PHE E 1 229 ? 12.233 40.243 37.192 1.00 31.61 ? 229 PHE E CB 1 +ATOM 24600 C CG . PHE E 1 229 ? 12.126 38.998 36.364 1.00 29.66 ? 229 PHE E CG 1 +ATOM 24601 C CD1 . PHE E 1 229 ? 12.179 37.740 36.959 1.00 27.21 ? 229 PHE E CD1 1 +ATOM 24602 C CD2 . PHE E 1 229 ? 12.036 39.078 34.974 1.00 27.65 ? 229 PHE E CD2 1 +ATOM 24603 C CE1 . PHE E 1 229 ? 12.152 36.581 36.176 1.00 27.82 ? 229 PHE E CE1 1 +ATOM 24604 C CE2 . PHE E 1 229 ? 12.008 37.925 34.191 1.00 25.91 ? 229 PHE E CE2 1 +ATOM 24605 C CZ . PHE E 1 229 ? 12.068 36.678 34.791 1.00 24.24 ? 229 PHE E CZ 1 +ATOM 24606 N N . PRO E 1 230 ? 14.886 42.639 38.324 1.00 34.22 ? 230 PRO E N 1 +ATOM 24607 C CA . PRO E 1 230 ? 14.993 43.940 38.984 1.00 34.45 ? 230 PRO E CA 1 +ATOM 24608 C C . PRO E 1 230 ? 14.428 45.116 38.178 1.00 35.68 ? 230 PRO E C 1 +ATOM 24609 O O . PRO E 1 230 ? 13.971 46.111 38.751 1.00 35.31 ? 230 PRO E O 1 +ATOM 24610 C CB . PRO E 1 230 ? 16.495 44.070 39.228 1.00 33.29 ? 230 PRO E CB 1 +ATOM 24611 C CG . PRO E 1 230 ? 17.085 43.340 38.047 1.00 32.31 ? 230 PRO E CG 1 +ATOM 24612 C CD . PRO E 1 230 ? 16.221 42.116 37.967 1.00 34.47 ? 230 PRO E CD 1 +ATOM 24613 N N . GLU E 1 231 ? 14.452 44.993 36.853 1.00 36.50 ? 231 GLU E N 1 +ATOM 24614 C CA . GLU E 1 231 ? 13.971 46.053 35.970 1.00 37.92 ? 231 GLU E CA 1 +ATOM 24615 C C . GLU E 1 231 ? 12.897 45.527 35.023 1.00 36.34 ? 231 GLU E C 1 +ATOM 24616 O O . GLU E 1 231 ? 13.113 45.425 33.815 1.00 34.01 ? 231 GLU E O 1 +ATOM 24617 C CB . GLU E 1 231 ? 15.147 46.612 35.167 1.00 40.99 ? 231 GLU E CB 1 +ATOM 24618 C CG . GLU E 1 231 ? 16.283 47.121 36.038 1.00 49.08 ? 231 GLU E CG 1 +ATOM 24619 C CD . GLU E 1 231 ? 17.541 47.438 35.246 1.00 54.93 ? 231 GLU E CD 1 +ATOM 24620 O OE1 . GLU E 1 231 ? 17.599 48.511 34.594 1.00 58.91 ? 231 GLU E OE1 1 +ATOM 24621 O OE2 . GLU E 1 231 ? 18.473 46.602 35.268 1.00 57.78 ? 231 GLU E OE2 1 +ATOM 24622 N N . PRO E 1 232 ? 11.720 45.190 35.565 1.00 36.02 ? 232 PRO E N 1 +ATOM 24623 C CA . PRO E 1 232 ? 10.631 44.667 34.734 1.00 37.44 ? 232 PRO E CA 1 +ATOM 24624 C C . PRO E 1 232 ? 10.289 45.542 33.542 1.00 39.01 ? 232 PRO E C 1 +ATOM 24625 O O . PRO E 1 232 ? 10.128 45.040 32.428 1.00 39.88 ? 232 PRO E O 1 +ATOM 24626 C CB . PRO E 1 232 ? 9.470 44.508 35.725 1.00 37.15 ? 232 PRO E CB 1 +ATOM 24627 C CG . PRO E 1 232 ? 9.807 45.465 36.827 1.00 36.09 ? 232 PRO E CG 1 +ATOM 24628 C CD . PRO E 1 232 ? 11.298 45.334 36.965 1.00 33.90 ? 232 PRO E CD 1 +ATOM 24629 N N . LYS E 1 233 ? 10.193 46.847 33.766 1.00 41.67 ? 233 LYS E N 1 +ATOM 24630 C CA . LYS E 1 233 ? 9.875 47.768 32.687 1.00 43.31 ? 233 LYS E CA 1 +ATOM 24631 C C . LYS E 1 233 ? 10.880 47.641 31.539 1.00 43.68 ? 233 LYS E C 1 +ATOM 24632 O O . LYS E 1 233 ? 10.513 47.761 30.371 1.00 44.63 ? 233 LYS E O 1 +ATOM 24633 C CB . LYS E 1 233 ? 9.860 49.202 33.195 1.00 46.26 ? 233 LYS E CB 1 +ATOM 24634 C CG . LYS E 1 233 ? 9.340 50.187 32.161 1.00 52.91 ? 233 LYS E CG 1 +ATOM 24635 C CD . LYS E 1 233 ? 9.459 51.640 32.624 1.00 56.42 ? 233 LYS E CD 1 +ATOM 24636 C CE . LYS E 1 233 ? 8.812 52.595 31.610 1.00 58.86 ? 233 LYS E CE 1 +ATOM 24637 N NZ . LYS E 1 233 ? 9.352 52.422 30.224 1.00 59.73 ? 233 LYS E NZ 1 +ATOM 24638 N N . LYS E 1 234 ? 12.144 47.392 31.866 1.00 42.09 ? 234 LYS E N 1 +ATOM 24639 C CA . LYS E 1 234 ? 13.173 47.241 30.844 1.00 42.67 ? 234 LYS E CA 1 +ATOM 24640 C C . LYS E 1 234 ? 12.956 45.973 30.012 1.00 42.04 ? 234 LYS E C 1 +ATOM 24641 O O . LYS E 1 234 ? 13.246 45.947 28.814 1.00 41.60 ? 234 LYS E O 1 +ATOM 24642 C CB . LYS E 1 234 ? 14.551 47.199 31.499 1.00 45.32 ? 234 LYS E CB 1 +ATOM 24643 C CG . LYS E 1 234 ? 15.697 46.989 30.534 1.00 49.19 ? 234 LYS E CG 1 +ATOM 24644 C CD . LYS E 1 234 ? 17.027 46.895 31.285 1.00 53.44 ? 234 LYS E CD 1 +ATOM 24645 C CE . LYS E 1 234 ? 18.176 46.619 30.321 1.00 55.63 ? 234 LYS E CE 1 +ATOM 24646 N NZ . LYS E 1 234 ? 19.505 46.592 31.000 1.00 58.68 ? 234 LYS E NZ 1 +ATOM 24647 N N . LEU E 1 235 ? 12.453 44.922 30.656 1.00 40.51 ? 235 LEU E N 1 +ATOM 24648 C CA . LEU E 1 235 ? 12.178 43.655 29.983 1.00 39.23 ? 235 LEU E CA 1 +ATOM 24649 C C . LEU E 1 235 ? 11.015 43.818 29.006 1.00 38.01 ? 235 LEU E C 1 +ATOM 24650 O O . LEU E 1 235 ? 11.078 43.384 27.861 1.00 35.48 ? 235 LEU E O 1 +ATOM 24651 C CB . LEU E 1 235 ? 11.809 42.575 31.007 1.00 39.50 ? 235 LEU E CB 1 +ATOM 24652 C CG . LEU E 1 235 ? 11.307 41.250 30.422 1.00 38.71 ? 235 LEU E CG 1 +ATOM 24653 C CD1 . LEU E 1 235 ? 12.466 40.508 29.759 1.00 38.08 ? 235 LEU E CD1 1 +ATOM 24654 C CD2 . LEU E 1 235 ? 10.688 40.404 31.523 1.00 38.76 ? 235 LEU E CD2 1 +ATOM 24655 N N . ILE E 1 236 ? 9.950 44.448 29.480 1.00 37.16 ? 236 ILE E N 1 +ATOM 24656 C CA . ILE E 1 236 ? 8.768 44.661 28.669 1.00 38.24 ? 236 ILE E CA 1 +ATOM 24657 C C . ILE E 1 236 ? 9.077 45.513 27.435 1.00 38.79 ? 236 ILE E C 1 +ATOM 24658 O O . ILE E 1 236 ? 8.580 45.244 26.342 1.00 39.56 ? 236 ILE E O 1 +ATOM 24659 C CB . ILE E 1 236 ? 7.664 45.295 29.533 1.00 37.43 ? 236 ILE E CB 1 +ATOM 24660 C CG1 . ILE E 1 236 ? 7.351 44.336 30.690 1.00 38.08 ? 236 ILE E CG1 1 +ATOM 24661 C CG2 . ILE E 1 236 ? 6.434 45.592 28.697 1.00 32.87 ? 236 ILE E CG2 1 +ATOM 24662 C CD1 . ILE E 1 236 ? 6.407 44.872 31.733 1.00 39.62 ? 236 ILE E CD1 1 +ATOM 24663 N N . ASP E 1 237 ? 9.916 46.524 27.602 1.00 39.65 ? 237 ASP E N 1 +ATOM 24664 C CA . ASP E 1 237 ? 10.285 47.378 26.483 1.00 40.93 ? 237 ASP E CA 1 +ATOM 24665 C C . ASP E 1 237 ? 11.121 46.595 25.478 1.00 39.63 ? 237 ASP E C 1 +ATOM 24666 O O . ASP E 1 237 ? 10.878 46.673 24.279 1.00 39.66 ? 237 ASP E O 1 +ATOM 24667 C CB . ASP E 1 237 ? 11.037 48.616 26.989 1.00 44.77 ? 237 ASP E CB 1 +ATOM 24668 C CG . ASP E 1 237 ? 10.092 49.675 27.587 1.00 50.57 ? 237 ASP E CG 1 +ATOM 24669 O OD1 . ASP E 1 237 ? 9.108 49.300 28.272 1.00 53.04 ? 237 ASP E OD1 1 +ATOM 24670 O OD2 . ASP E 1 237 ? 10.336 50.890 27.382 1.00 54.99 ? 237 ASP E OD2 1 +ATOM 24671 N N . GLU E 1 238 ? 12.090 45.826 25.965 1.00 39.35 ? 238 GLU E N 1 +ATOM 24672 C CA . GLU E 1 238 ? 12.927 45.016 25.083 1.00 39.60 ? 238 GLU E CA 1 +ATOM 24673 C C . GLU E 1 238 ? 12.141 43.934 24.329 1.00 36.29 ? 238 GLU E C 1 +ATOM 24674 O O . GLU E 1 238 ? 12.409 43.680 23.154 1.00 34.75 ? 238 GLU E O 1 +ATOM 24675 C CB . GLU E 1 238 ? 14.076 44.376 25.869 1.00 41.81 ? 238 GLU E CB 1 +ATOM 24676 C CG . GLU E 1 238 ? 15.015 45.412 26.459 1.00 51.20 ? 238 GLU E CG 1 +ATOM 24677 C CD . GLU E 1 238 ? 16.410 44.873 26.748 1.00 55.61 ? 238 GLU E CD 1 +ATOM 24678 O OE1 . GLU E 1 238 ? 16.556 43.970 27.603 1.00 57.45 ? 238 GLU E OE1 1 +ATOM 24679 O OE2 . GLU E 1 238 ? 17.366 45.363 26.108 1.00 59.74 ? 238 GLU E OE2 1 +ATOM 24680 N N . LEU E 1 239 ? 11.177 43.296 24.989 1.00 34.23 ? 239 LEU E N 1 +ATOM 24681 C CA . LEU E 1 239 ? 10.381 42.271 24.312 1.00 33.79 ? 239 LEU E CA 1 +ATOM 24682 C C . LEU E 1 239 ? 9.520 42.949 23.252 1.00 32.94 ? 239 LEU E C 1 +ATOM 24683 O O . LEU E 1 239 ? 9.402 42.471 22.122 1.00 32.23 ? 239 LEU E O 1 +ATOM 24684 C CB . LEU E 1 239 ? 9.507 41.501 25.313 1.00 32.04 ? 239 LEU E CB 1 +ATOM 24685 C CG . LEU E 1 239 ? 10.284 40.520 26.205 1.00 30.17 ? 239 LEU E CG 1 +ATOM 24686 C CD1 . LEU E 1 239 ? 9.362 39.905 27.243 1.00 29.86 ? 239 LEU E CD1 1 +ATOM 24687 C CD2 . LEU E 1 239 ? 10.904 39.449 25.355 1.00 28.75 ? 239 LEU E CD2 1 +ATOM 24688 N N . HIS E 1 240 ? 8.945 44.091 23.614 1.00 33.34 ? 240 HIS E N 1 +ATOM 24689 C CA . HIS E 1 240 ? 8.114 44.841 22.686 1.00 33.14 ? 240 HIS E CA 1 +ATOM 24690 C C . HIS E 1 240 ? 8.914 45.417 21.521 1.00 32.37 ? 240 HIS E C 1 +ATOM 24691 O O . HIS E 1 240 ? 8.403 45.511 20.411 1.00 33.10 ? 240 HIS E O 1 +ATOM 24692 C CB . HIS E 1 240 ? 7.357 45.944 23.431 1.00 32.03 ? 240 HIS E CB 1 +ATOM 24693 C CG . HIS E 1 240 ? 6.239 45.427 24.276 1.00 32.54 ? 240 HIS E CG 1 +ATOM 24694 N ND1 . HIS E 1 240 ? 5.457 46.245 25.063 1.00 34.52 ? 240 HIS E ND1 1 +ATOM 24695 C CD2 . HIS E 1 240 ? 5.764 44.169 24.451 1.00 33.34 ? 240 HIS E CD2 1 +ATOM 24696 C CE1 . HIS E 1 240 ? 4.548 45.515 25.687 1.00 33.33 ? 240 HIS E CE1 1 +ATOM 24697 N NE2 . HIS E 1 240 ? 4.712 44.251 25.332 1.00 35.42 ? 240 HIS E NE2 1 +ATOM 24698 N N . LYS E 1 241 ? 10.165 45.793 21.758 1.00 32.88 ? 241 LYS E N 1 +ATOM 24699 C CA . LYS E 1 241 ? 10.981 46.339 20.672 1.00 34.46 ? 241 LYS E CA 1 +ATOM 24700 C C . LYS E 1 241 ? 11.279 45.252 19.654 1.00 32.74 ? 241 LYS E C 1 +ATOM 24701 O O . LYS E 1 241 ? 11.627 45.539 18.506 1.00 31.44 ? 241 LYS E O 1 +ATOM 24702 C CB . LYS E 1 241 ? 12.287 46.936 21.202 1.00 36.71 ? 241 LYS E CB 1 +ATOM 24703 C CG . LYS E 1 241 ? 12.069 48.196 22.017 1.00 43.42 ? 241 LYS E CG 1 +ATOM 24704 C CD . LYS E 1 241 ? 13.385 48.847 22.434 1.00 47.99 ? 241 LYS E CD 1 +ATOM 24705 C CE . LYS E 1 241 ? 13.135 50.214 23.065 1.00 49.56 ? 241 LYS E CE 1 +ATOM 24706 N NZ . LYS E 1 241 ? 14.395 51.006 23.212 1.00 52.96 ? 241 LYS E NZ 1 +ATOM 24707 N N . ARG E 1 242 ? 11.129 44.000 20.075 1.00 32.95 ? 242 ARG E N 1 +ATOM 24708 C CA . ARG E 1 242 ? 11.363 42.870 19.181 1.00 32.88 ? 242 ARG E CA 1 +ATOM 24709 C C . ARG E 1 242 ? 10.039 42.275 18.690 1.00 32.33 ? 242 ARG E C 1 +ATOM 24710 O O . ARG E 1 242 ? 10.014 41.204 18.091 1.00 31.79 ? 242 ARG E O 1 +ATOM 24711 C CB . ARG E 1 242 ? 12.198 41.813 19.896 1.00 32.61 ? 242 ARG E CB 1 +ATOM 24712 C CG . ARG E 1 242 ? 13.577 42.311 20.276 1.00 34.45 ? 242 ARG E CG 1 +ATOM 24713 C CD . ARG E 1 242 ? 14.315 41.328 21.174 1.00 37.21 ? 242 ARG E CD 1 +ATOM 24714 N NE . ARG E 1 242 ? 15.705 41.739 21.390 1.00 40.71 ? 242 ARG E NE 1 +ATOM 24715 C CZ . ARG E 1 242 ? 16.084 42.814 22.084 1.00 39.83 ? 242 ARG E CZ 1 +ATOM 24716 N NH1 . ARG E 1 242 ? 15.185 43.615 22.649 1.00 38.07 ? 242 ARG E NH1 1 +ATOM 24717 N NH2 . ARG E 1 242 ? 17.372 43.087 22.212 1.00 40.34 ? 242 ARG E NH2 1 +ATOM 24718 N N . ASN E 1 243 ? 8.940 42.977 18.960 1.00 32.04 ? 243 ASN E N 1 +ATOM 24719 C CA . ASN E 1 243 ? 7.610 42.544 18.529 1.00 32.16 ? 243 ASN E CA 1 +ATOM 24720 C C . ASN E 1 243 ? 7.190 41.204 19.140 1.00 31.29 ? 243 ASN E C 1 +ATOM 24721 O O . ASN E 1 243 ? 6.624 40.343 18.460 1.00 29.75 ? 243 ASN E O 1 +ATOM 24722 C CB . ASN E 1 243 ? 7.572 42.437 16.998 1.00 30.98 ? 243 ASN E CB 1 +ATOM 24723 C CG . ASN E 1 243 ? 6.196 42.096 16.477 1.00 32.39 ? 243 ASN E CG 1 +ATOM 24724 O OD1 . ASN E 1 243 ? 6.051 41.366 15.483 1.00 31.66 ? 243 ASN E OD1 1 +ATOM 24725 N ND2 . ASN E 1 243 ? 5.166 42.625 17.143 1.00 29.98 ? 243 ASN E ND2 1 +ATOM 24726 N N . VAL E 1 244 ? 7.462 41.029 20.425 1.00 31.85 ? 244 VAL E N 1 +ATOM 24727 C CA . VAL E 1 244 ? 7.125 39.789 21.108 1.00 32.19 ? 244 VAL E CA 1 +ATOM 24728 C C . VAL E 1 244 ? 6.247 40.101 22.302 1.00 32.57 ? 244 VAL E C 1 +ATOM 24729 O O . VAL E 1 244 ? 6.580 40.968 23.098 1.00 33.36 ? 244 VAL E O 1 +ATOM 24730 C CB . VAL E 1 244 ? 8.404 39.066 21.574 1.00 31.43 ? 244 VAL E CB 1 +ATOM 24731 C CG1 . VAL E 1 244 ? 8.047 37.906 22.475 1.00 31.78 ? 244 VAL E CG1 1 +ATOM 24732 C CG2 . VAL E 1 244 ? 9.192 38.577 20.362 1.00 30.23 ? 244 VAL E CG2 1 +ATOM 24733 N N . LYS E 1 245 ? 5.118 39.411 22.415 1.00 32.31 ? 245 LYS E N 1 +ATOM 24734 C CA . LYS E 1 245 ? 4.200 39.626 23.530 1.00 32.49 ? 245 LYS E CA 1 +ATOM 24735 C C . LYS E 1 245 ? 4.727 38.950 24.796 1.00 32.69 ? 245 LYS E C 1 +ATOM 24736 O O . LYS E 1 245 ? 5.512 38.009 24.727 1.00 34.25 ? 245 LYS E O 1 +ATOM 24737 C CB . LYS E 1 245 ? 2.816 39.047 23.205 1.00 34.35 ? 245 LYS E CB 1 +ATOM 24738 C CG . LYS E 1 245 ? 2.206 39.568 21.937 1.00 34.39 ? 245 LYS E CG 1 +ATOM 24739 C CD . LYS E 1 245 ? 1.904 41.044 22.054 1.00 36.93 ? 245 LYS E CD 1 +ATOM 24740 C CE . LYS E 1 245 ? 1.435 41.601 20.722 1.00 37.20 ? 245 LYS E CE 1 +ATOM 24741 N NZ . LYS E 1 245 ? 1.009 43.025 20.841 1.00 41.18 ? 245 LYS E NZ 1 +ATOM 24742 N N . LEU E 1 246 ? 4.287 39.432 25.950 1.00 31.69 ? 246 LEU E N 1 +ATOM 24743 C CA . LEU E 1 246 ? 4.700 38.855 27.220 1.00 32.69 ? 246 LEU E CA 1 +ATOM 24744 C C . LEU E 1 246 ? 3.462 38.377 27.977 1.00 32.69 ? 246 LEU E C 1 +ATOM 24745 O O . LEU E 1 246 ? 2.558 39.161 28.268 1.00 31.87 ? 246 LEU E O 1 +ATOM 24746 C CB . LEU E 1 246 ? 5.449 39.885 28.075 1.00 33.19 ? 246 LEU E CB 1 +ATOM 24747 C CG . LEU E 1 246 ? 5.781 39.406 29.495 1.00 34.77 ? 246 LEU E CG 1 +ATOM 24748 C CD1 . LEU E 1 246 ? 6.783 38.249 29.418 1.00 36.78 ? 246 LEU E CD1 1 +ATOM 24749 C CD2 . LEU E 1 246 ? 6.360 40.540 30.318 1.00 33.59 ? 246 LEU E CD2 1 +ATOM 24750 N N . ILE E 1 247 ? 3.416 37.081 28.271 1.00 32.76 ? 247 ILE E N 1 +ATOM 24751 C CA . ILE E 1 247 ? 2.297 36.498 29.003 1.00 31.66 ? 247 ILE E CA 1 +ATOM 24752 C C . ILE E 1 247 ? 2.840 36.018 30.350 1.00 32.55 ? 247 ILE E C 1 +ATOM 24753 O O . ILE E 1 247 ? 3.844 35.299 30.408 1.00 33.17 ? 247 ILE E O 1 +ATOM 24754 C CB . ILE E 1 247 ? 1.669 35.304 28.240 1.00 29.11 ? 247 ILE E CB 1 +ATOM 24755 C CG1 . ILE E 1 247 ? 1.073 35.772 26.911 1.00 28.91 ? 247 ILE E CG1 1 +ATOM 24756 C CG2 . ILE E 1 247 ? 0.584 34.680 29.065 1.00 28.67 ? 247 ILE E CG2 1 +ATOM 24757 C CD1 . ILE E 1 247 ? 2.080 35.904 25.793 1.00 27.70 ? 247 ILE E CD1 1 +ATOM 24758 N N . THR E 1 248 ? 2.192 36.428 31.434 1.00 31.61 ? 248 THR E N 1 +ATOM 24759 C CA . THR E 1 248 ? 2.643 36.039 32.758 1.00 31.54 ? 248 THR E CA 1 +ATOM 24760 C C . THR E 1 248 ? 1.650 35.132 33.467 1.00 32.93 ? 248 THR E C 1 +ATOM 24761 O O . THR E 1 248 ? 0.435 35.355 33.437 1.00 31.89 ? 248 THR E O 1 +ATOM 24762 C CB . THR E 1 248 ? 2.889 37.268 33.648 1.00 31.31 ? 248 THR E CB 1 +ATOM 24763 O OG1 . THR E 1 248 ? 1.677 38.016 33.781 1.00 30.75 ? 248 THR E OG1 1 +ATOM 24764 C CG2 . THR E 1 248 ? 3.967 38.161 33.039 1.00 31.57 ? 248 THR E CG2 1 +ATOM 24765 N N . ILE E 1 249 ? 2.178 34.106 34.122 1.00 34.02 ? 249 ILE E N 1 +ATOM 24766 C CA . ILE E 1 249 ? 1.338 33.172 34.844 1.00 33.01 ? 249 ILE E CA 1 +ATOM 24767 C C . ILE E 1 249 ? 0.851 33.840 36.121 1.00 33.80 ? 249 ILE E C 1 +ATOM 24768 O O . ILE E 1 249 ? 1.555 34.647 36.726 1.00 34.30 ? 249 ILE E O 1 +ATOM 24769 C CB . ILE E 1 249 ? 2.117 31.878 35.190 1.00 32.95 ? 249 ILE E CB 1 +ATOM 24770 C CG1 . ILE E 1 249 ? 1.148 30.788 35.632 1.00 32.12 ? 249 ILE E CG1 1 +ATOM 24771 C CG2 . ILE E 1 249 ? 3.130 32.145 36.289 1.00 31.15 ? 249 ILE E CG2 1 +ATOM 24772 C CD1 . ILE E 1 249 ? 1.791 29.442 35.765 1.00 32.42 ? 249 ILE E CD1 1 +ATOM 24773 N N . VAL E 1 250 ? -0.369 33.505 36.514 1.00 35.34 ? 250 VAL E N 1 +ATOM 24774 C CA . VAL E 1 250 ? -0.979 34.042 37.715 1.00 35.51 ? 250 VAL E CA 1 +ATOM 24775 C C . VAL E 1 250 ? -1.746 32.909 38.380 1.00 37.31 ? 250 VAL E C 1 +ATOM 24776 O O . VAL E 1 250 ? -2.723 32.405 37.821 1.00 38.26 ? 250 VAL E O 1 +ATOM 24777 C CB . VAL E 1 250 ? -1.969 35.180 37.377 1.00 35.69 ? 250 VAL E CB 1 +ATOM 24778 C CG1 . VAL E 1 250 ? -2.674 35.664 38.640 1.00 34.00 ? 250 VAL E CG1 1 +ATOM 24779 C CG2 . VAL E 1 250 ? -1.227 36.328 36.709 1.00 35.69 ? 250 VAL E CG2 1 +ATOM 24780 N N . ASP E 1 251 ? -1.304 32.496 39.562 1.00 38.01 ? 251 ASP E N 1 +ATOM 24781 C CA . ASP E 1 251 ? -1.993 31.427 40.272 1.00 39.40 ? 251 ASP E CA 1 +ATOM 24782 C C . ASP E 1 251 ? -3.160 32.030 41.048 1.00 39.65 ? 251 ASP E C 1 +ATOM 24783 O O . ASP E 1 251 ? -3.432 33.222 40.940 1.00 39.20 ? 251 ASP E O 1 +ATOM 24784 C CB . ASP E 1 251 ? -1.031 30.703 41.212 1.00 40.86 ? 251 ASP E CB 1 +ATOM 24785 C CG . ASP E 1 251 ? 0.167 30.128 40.479 1.00 42.53 ? 251 ASP E CG 1 +ATOM 24786 O OD1 . ASP E 1 251 ? -0.021 29.235 39.626 1.00 44.55 ? 251 ASP E OD1 1 +ATOM 24787 O OD2 . ASP E 1 251 ? 1.300 30.573 40.745 1.00 42.69 ? 251 ASP E OD2 1 +ATOM 24788 N N . HIS E 1 252 ? -3.842 31.212 41.837 1.00 39.74 ? 252 HIS E N 1 +ATOM 24789 C CA . HIS E 1 252 ? -5.008 31.680 42.583 1.00 40.22 ? 252 HIS E CA 1 +ATOM 24790 C C . HIS E 1 252 ? -4.730 31.775 44.085 1.00 39.57 ? 252 HIS E C 1 +ATOM 24791 O O . HIS E 1 252 ? -5.598 32.166 44.860 1.00 40.30 ? 252 HIS E O 1 +ATOM 24792 C CB . HIS E 1 252 ? -6.179 30.716 42.335 1.00 39.74 ? 252 HIS E CB 1 +ATOM 24793 C CG . HIS E 1 252 ? -5.916 29.324 42.827 1.00 41.51 ? 252 HIS E CG 1 +ATOM 24794 N ND1 . HIS E 1 252 ? -4.707 28.685 42.639 1.00 43.19 ? 252 HIS E ND1 1 +ATOM 24795 C CD2 . HIS E 1 252 ? -6.691 28.461 43.528 1.00 41.91 ? 252 HIS E CD2 1 +ATOM 24796 C CE1 . HIS E 1 252 ? -4.747 27.492 43.207 1.00 42.99 ? 252 HIS E CE1 1 +ATOM 24797 N NE2 . HIS E 1 252 ? -5.940 27.331 43.753 1.00 41.89 ? 252 HIS E NE2 1 +ATOM 24798 N N . GLY E 1 253 ? -3.522 31.417 44.499 1.00 38.00 ? 253 GLY E N 1 +ATOM 24799 C CA . GLY E 1 253 ? -3.207 31.462 45.915 1.00 36.03 ? 253 GLY E CA 1 +ATOM 24800 C C . GLY E 1 253 ? -2.601 32.761 46.414 1.00 34.91 ? 253 GLY E C 1 +ATOM 24801 O O . GLY E 1 253 ? -1.598 33.241 45.888 1.00 34.43 ? 253 GLY E O 1 +ATOM 24802 N N . ILE E 1 254 ? -3.218 33.326 47.445 1.00 32.93 ? 254 ILE E N 1 +ATOM 24803 C CA . ILE E 1 254 ? -2.751 34.564 48.044 1.00 31.98 ? 254 ILE E CA 1 +ATOM 24804 C C . ILE E 1 254 ? -1.992 34.214 49.316 1.00 31.80 ? 254 ILE E C 1 +ATOM 24805 O O . ILE E 1 254 ? -2.562 33.640 50.242 1.00 32.12 ? 254 ILE E O 1 +ATOM 24806 C CB . ILE E 1 254 ? -3.937 35.475 48.406 1.00 32.85 ? 254 ILE E CB 1 +ATOM 24807 C CG1 . ILE E 1 254 ? -4.694 35.876 47.131 1.00 32.49 ? 254 ILE E CG1 1 +ATOM 24808 C CG2 . ILE E 1 254 ? -3.442 36.703 49.161 1.00 31.49 ? 254 ILE E CG2 1 +ATOM 24809 C CD1 . ILE E 1 254 ? -3.876 36.723 46.157 1.00 30.49 ? 254 ILE E CD1 1 +ATOM 24810 N N . ARG E 1 255 ? -0.711 34.559 49.357 1.00 30.38 ? 255 ARG E N 1 +ATOM 24811 C CA . ARG E 1 255 ? 0.126 34.257 50.515 1.00 32.72 ? 255 ARG E CA 1 +ATOM 24812 C C . ARG E 1 255 ? -0.317 34.935 51.812 1.00 32.42 ? 255 ARG E C 1 +ATOM 24813 O O . ARG E 1 255 ? -0.535 36.142 51.843 1.00 34.89 ? 255 ARG E O 1 +ATOM 24814 C CB . ARG E 1 255 ? 1.574 34.632 50.209 1.00 32.89 ? 255 ARG E CB 1 +ATOM 24815 C CG . ARG E 1 255 ? 2.539 34.272 51.298 1.00 34.61 ? 255 ARG E CG 1 +ATOM 24816 C CD . ARG E 1 255 ? 3.935 34.141 50.745 1.00 36.96 ? 255 ARG E CD 1 +ATOM 24817 N NE . ARG E 1 255 ? 4.887 34.934 51.509 1.00 38.90 ? 255 ARG E NE 1 +ATOM 24818 C CZ . ARG E 1 255 ? 6.032 34.463 51.985 1.00 39.27 ? 255 ARG E CZ 1 +ATOM 24819 N NH1 . ARG E 1 255 ? 6.374 33.195 51.782 1.00 36.51 ? 255 ARG E NH1 1 +ATOM 24820 N NH2 . ARG E 1 255 ? 6.837 35.272 52.657 1.00 42.02 ? 255 ARG E NH2 1 +ATOM 24821 N N . VAL E 1 256 ? -0.456 34.154 52.881 1.00 31.81 ? 256 VAL E N 1 +ATOM 24822 C CA . VAL E 1 256 ? -0.863 34.697 54.172 1.00 31.82 ? 256 VAL E CA 1 +ATOM 24823 C C . VAL E 1 256 ? 0.375 35.363 54.735 1.00 33.64 ? 256 VAL E C 1 +ATOM 24824 O O . VAL E 1 256 ? 1.100 34.788 55.545 1.00 34.30 ? 256 VAL E O 1 +ATOM 24825 C CB . VAL E 1 256 ? -1.352 33.584 55.118 1.00 31.95 ? 256 VAL E CB 1 +ATOM 24826 C CG1 . VAL E 1 256 ? -1.708 34.163 56.480 1.00 30.34 ? 256 VAL E CG1 1 +ATOM 24827 C CG2 . VAL E 1 256 ? -2.572 32.894 54.507 1.00 29.54 ? 256 VAL E CG2 1 +ATOM 24828 N N . ASP E 1 257 ? 0.599 36.592 54.278 1.00 35.11 ? 257 ASP E N 1 +ATOM 24829 C CA . ASP E 1 257 ? 1.760 37.389 54.638 1.00 35.88 ? 257 ASP E CA 1 +ATOM 24830 C C . ASP E 1 257 ? 1.285 38.741 55.168 1.00 37.48 ? 257 ASP E C 1 +ATOM 24831 O O . ASP E 1 257 ? 0.567 39.478 54.483 1.00 36.41 ? 257 ASP E O 1 +ATOM 24832 C CB . ASP E 1 257 ? 2.616 37.572 53.378 1.00 37.55 ? 257 ASP E CB 1 +ATOM 24833 C CG . ASP E 1 257 ? 3.948 38.218 53.648 1.00 38.28 ? 257 ASP E CG 1 +ATOM 24834 O OD1 . ASP E 1 257 ? 3.995 39.221 54.385 1.00 39.65 ? 257 ASP E OD1 1 +ATOM 24835 O OD2 . ASP E 1 257 ? 4.957 37.727 53.096 1.00 43.70 ? 257 ASP E OD2 1 +ATOM 24836 N N . GLN E 1 258 ? 1.696 39.054 56.391 1.00 38.60 ? 258 GLN E N 1 +ATOM 24837 C CA . GLN E 1 258 ? 1.347 40.302 57.072 1.00 39.20 ? 258 GLN E CA 1 +ATOM 24838 C C . GLN E 1 258 ? 1.704 41.587 56.326 1.00 40.10 ? 258 GLN E C 1 +ATOM 24839 O O . GLN E 1 258 ? 1.076 42.628 56.540 1.00 40.35 ? 258 GLN E O 1 +ATOM 24840 C CB . GLN E 1 258 ? 2.048 40.342 58.422 1.00 39.37 ? 258 GLN E CB 1 +ATOM 24841 C CG . GLN E 1 258 ? 1.146 40.115 59.576 1.00 38.47 ? 258 GLN E CG 1 +ATOM 24842 C CD . GLN E 1 258 ? 1.910 39.880 60.860 1.00 36.21 ? 258 GLN E CD 1 +ATOM 24843 O OE1 . GLN E 1 258 ? 1.318 39.837 61.929 1.00 38.81 ? 258 GLN E OE1 1 +ATOM 24844 N NE2 . GLN E 1 258 ? 3.221 39.710 60.761 1.00 32.08 ? 258 GLN E NE2 1 +ATOM 24845 N N . ASN E 1 259 ? 2.721 41.523 55.476 1.00 39.52 ? 259 ASN E N 1 +ATOM 24846 C CA . ASN E 1 259 ? 3.155 42.702 54.742 1.00 41.93 ? 259 ASN E CA 1 +ATOM 24847 C C . ASN E 1 259 ? 2.974 42.574 53.240 1.00 41.73 ? 259 ASN E C 1 +ATOM 24848 O O . ASN E 1 259 ? 3.606 43.293 52.466 1.00 42.68 ? 259 ASN E O 1 +ATOM 24849 C CB . ASN E 1 259 ? 4.618 42.988 55.077 1.00 42.64 ? 259 ASN E CB 1 +ATOM 24850 C CG . ASN E 1 259 ? 4.822 43.249 56.558 1.00 45.68 ? 259 ASN E CG 1 +ATOM 24851 O OD1 . ASN E 1 259 ? 5.669 42.628 57.196 1.00 46.23 ? 259 ASN E OD1 1 +ATOM 24852 N ND2 . ASN E 1 259 ? 4.034 44.168 57.114 1.00 46.54 ? 259 ASN E ND2 1 +ATOM 24853 N N . TYR E 1 260 ? 2.104 41.655 52.839 1.00 40.79 ? 260 TYR E N 1 +ATOM 24854 C CA . TYR E 1 260 ? 1.827 41.409 51.435 1.00 39.21 ? 260 TYR E CA 1 +ATOM 24855 C C . TYR E 1 260 ? 0.512 42.099 51.098 1.00 39.20 ? 260 TYR E C 1 +ATOM 24856 O O . TYR E 1 260 ? -0.560 41.702 51.552 1.00 39.35 ? 260 TYR E O 1 +ATOM 24857 C CB . TYR E 1 260 ? 1.756 39.902 51.196 1.00 38.67 ? 260 TYR E CB 1 +ATOM 24858 C CG . TYR E 1 260 ? 1.433 39.496 49.784 1.00 38.14 ? 260 TYR E CG 1 +ATOM 24859 C CD1 . TYR E 1 260 ? 2.159 39.999 48.709 1.00 37.15 ? 260 TYR E CD1 1 +ATOM 24860 C CD2 . TYR E 1 260 ? 0.407 38.582 49.524 1.00 38.57 ? 260 TYR E CD2 1 +ATOM 24861 C CE1 . TYR E 1 260 ? 1.874 39.603 47.408 1.00 39.38 ? 260 TYR E CE1 1 +ATOM 24862 C CE2 . TYR E 1 260 ? 0.115 38.180 48.228 1.00 38.69 ? 260 TYR E CE2 1 +ATOM 24863 C CZ . TYR E 1 260 ? 0.851 38.693 47.178 1.00 39.61 ? 260 TYR E CZ 1 +ATOM 24864 O OH . TYR E 1 260 ? 0.559 38.302 45.894 1.00 42.25 ? 260 TYR E OH 1 +ATOM 24865 N N . SER E 1 261 ? 0.617 43.152 50.303 1.00 39.44 ? 261 SER E N 1 +ATOM 24866 C CA . SER E 1 261 ? -0.526 43.960 49.912 1.00 39.56 ? 261 SER E CA 1 +ATOM 24867 C C . SER E 1 261 ? -1.816 43.236 49.487 1.00 38.17 ? 261 SER E C 1 +ATOM 24868 O O . SER E 1 261 ? -2.887 43.523 50.029 1.00 37.82 ? 261 SER E O 1 +ATOM 24869 C CB . SER E 1 261 ? -0.086 44.938 48.820 1.00 41.28 ? 261 SER E CB 1 +ATOM 24870 O OG . SER E 1 261 ? -1.153 45.792 48.451 1.00 47.68 ? 261 SER E OG 1 +ATOM 24871 N N . PRO E 1 262 ? -1.741 42.303 48.515 1.00 37.37 ? 262 PRO E N 1 +ATOM 24872 C CA . PRO E 1 262 ? -2.951 41.591 48.076 1.00 35.57 ? 262 PRO E CA 1 +ATOM 24873 C C . PRO E 1 262 ? -3.683 40.899 49.216 1.00 35.11 ? 262 PRO E C 1 +ATOM 24874 O O . PRO E 1 262 ? -4.912 40.836 49.230 1.00 36.06 ? 262 PRO E O 1 +ATOM 24875 C CB . PRO E 1 262 ? -2.417 40.601 47.051 1.00 36.14 ? 262 PRO E CB 1 +ATOM 24876 C CG . PRO E 1 262 ? -1.268 41.342 46.451 1.00 36.80 ? 262 PRO E CG 1 +ATOM 24877 C CD . PRO E 1 262 ? -0.587 41.923 47.681 1.00 37.04 ? 262 PRO E CD 1 +ATOM 24878 N N . PHE E 1 263 ? -2.930 40.383 50.177 1.00 34.16 ? 263 PHE E N 1 +ATOM 24879 C CA . PHE E 1 263 ? -3.535 39.713 51.324 1.00 34.27 ? 263 PHE E CA 1 +ATOM 24880 C C . PHE E 1 263 ? -4.335 40.712 52.157 1.00 34.01 ? 263 PHE E C 1 +ATOM 24881 O O . PHE E 1 263 ? -5.465 40.447 52.565 1.00 32.43 ? 263 PHE E O 1 +ATOM 24882 C CB . PHE E 1 263 ? -2.450 39.067 52.193 1.00 34.24 ? 263 PHE E CB 1 +ATOM 24883 C CG . PHE E 1 263 ? -2.973 38.414 53.441 1.00 32.85 ? 263 PHE E CG 1 +ATOM 24884 C CD1 . PHE E 1 263 ? -3.912 37.396 53.368 1.00 33.41 ? 263 PHE E CD1 1 +ATOM 24885 C CD2 . PHE E 1 263 ? -2.505 38.803 54.693 1.00 34.07 ? 263 PHE E CD2 1 +ATOM 24886 C CE1 . PHE E 1 263 ? -4.383 36.766 54.523 1.00 32.45 ? 263 PHE E CE1 1 +ATOM 24887 C CE2 . PHE E 1 263 ? -2.969 38.178 55.859 1.00 34.56 ? 263 PHE E CE2 1 +ATOM 24888 C CZ . PHE E 1 263 ? -3.910 37.158 55.768 1.00 33.67 ? 263 PHE E CZ 1 +ATOM 24889 N N . LEU E 1 264 ? -3.733 41.865 52.406 1.00 34.84 ? 264 LEU E N 1 +ATOM 24890 C CA . LEU E 1 264 ? -4.387 42.908 53.183 1.00 36.48 ? 264 LEU E CA 1 +ATOM 24891 C C . LEU E 1 264 ? -5.589 43.532 52.464 1.00 36.30 ? 264 LEU E C 1 +ATOM 24892 O O . LEU E 1 264 ? -6.637 43.746 53.083 1.00 35.42 ? 264 LEU E O 1 +ATOM 24893 C CB . LEU E 1 264 ? -3.374 43.997 53.548 1.00 35.88 ? 264 LEU E CB 1 +ATOM 24894 C CG . LEU E 1 264 ? -2.131 43.483 54.290 1.00 38.09 ? 264 LEU E CG 1 +ATOM 24895 C CD1 . LEU E 1 264 ? -1.137 44.616 54.493 1.00 36.33 ? 264 LEU E CD1 1 +ATOM 24896 C CD2 . LEU E 1 264 ? -2.540 42.875 55.629 1.00 36.00 ? 264 LEU E CD2 1 +ATOM 24897 N N . SER E 1 265 ? -5.455 43.809 51.167 1.00 35.99 ? 265 SER E N 1 +ATOM 24898 C CA . SER E 1 265 ? -6.562 44.412 50.423 1.00 37.56 ? 265 SER E CA 1 +ATOM 24899 C C . SER E 1 265 ? -7.667 43.418 50.073 1.00 39.21 ? 265 SER E C 1 +ATOM 24900 O O . SER E 1 265 ? -8.827 43.806 49.898 1.00 40.41 ? 265 SER E O 1 +ATOM 24901 C CB . SER E 1 265 ? -6.060 45.067 49.140 1.00 36.85 ? 265 SER E CB 1 +ATOM 24902 O OG . SER E 1 265 ? -5.739 44.097 48.167 1.00 39.65 ? 265 SER E OG 1 +ATOM 24903 N N . GLY E 1 266 ? -7.313 42.138 49.969 1.00 39.35 ? 266 GLY E N 1 +ATOM 24904 C CA . GLY E 1 266 ? -8.311 41.136 49.644 1.00 38.04 ? 266 GLY E CA 1 +ATOM 24905 C C . GLY E 1 266 ? -9.107 40.690 50.856 1.00 37.52 ? 266 GLY E C 1 +ATOM 24906 O O . GLY E 1 266 ? -10.144 40.030 50.717 1.00 36.84 ? 266 GLY E O 1 +ATOM 24907 N N . MET E 1 267 ? -8.632 41.054 52.045 1.00 36.10 ? 267 MET E N 1 +ATOM 24908 C CA . MET E 1 267 ? -9.300 40.658 53.279 1.00 36.91 ? 267 MET E CA 1 +ATOM 24909 C C . MET E 1 267 ? -10.801 40.939 53.220 1.00 36.80 ? 267 MET E C 1 +ATOM 24910 O O . MET E 1 267 ? -11.234 42.032 52.872 1.00 37.75 ? 267 MET E O 1 +ATOM 24911 C CB . MET E 1 267 ? -8.668 41.368 54.476 1.00 37.89 ? 267 MET E CB 1 +ATOM 24912 C CG . MET E 1 267 ? -8.990 40.730 55.816 1.00 38.84 ? 267 MET E CG 1 +ATOM 24913 S SD . MET E 1 267 ? -8.537 38.960 55.899 1.00 45.55 ? 267 MET E SD 1 +ATOM 24914 C CE . MET E 1 267 ? -6.760 39.064 56.048 1.00 42.77 ? 267 MET E CE 1 +ATOM 24915 N N . GLY E 1 268 ? -11.595 39.932 53.554 1.00 37.42 ? 268 GLY E N 1 +ATOM 24916 C CA . GLY E 1 268 ? -13.035 40.078 53.504 1.00 35.11 ? 268 GLY E CA 1 +ATOM 24917 C C . GLY E 1 268 ? -13.605 39.392 52.280 1.00 34.40 ? 268 GLY E C 1 +ATOM 24918 O O . GLY E 1 268 ? -14.788 39.067 52.251 1.00 33.89 ? 268 GLY E O 1 +ATOM 24919 N N . LYS E 1 269 ? -12.759 39.142 51.283 1.00 33.78 ? 269 LYS E N 1 +ATOM 24920 C CA . LYS E 1 269 ? -13.209 38.515 50.043 1.00 35.74 ? 269 LYS E CA 1 +ATOM 24921 C C . LYS E 1 269 ? -12.640 37.111 49.771 1.00 35.68 ? 269 LYS E C 1 +ATOM 24922 O O . LYS E 1 269 ? -12.736 36.599 48.651 1.00 36.83 ? 269 LYS E O 1 +ATOM 24923 C CB . LYS E 1 269 ? -12.898 39.464 48.870 1.00 35.93 ? 269 LYS E CB 1 +ATOM 24924 C CG . LYS E 1 269 ? -13.651 40.793 48.986 1.00 37.98 ? 269 LYS E CG 1 +ATOM 24925 C CD . LYS E 1 269 ? -13.155 41.842 48.013 1.00 39.77 ? 269 LYS E CD 1 +ATOM 24926 C CE . LYS E 1 269 ? -11.795 42.369 48.425 1.00 41.87 ? 269 LYS E CE 1 +ATOM 24927 N NZ . LYS E 1 269 ? -11.862 43.076 49.740 1.00 40.44 ? 269 LYS E NZ 1 +ATOM 24928 N N . PHE E 1 270 ? -12.073 36.482 50.796 1.00 33.73 ? 270 PHE E N 1 +ATOM 24929 C CA . PHE E 1 270 ? -11.483 35.155 50.653 1.00 31.74 ? 270 PHE E CA 1 +ATOM 24930 C C . PHE E 1 270 ? -12.448 34.037 51.023 1.00 31.00 ? 270 PHE E C 1 +ATOM 24931 O O . PHE E 1 270 ? -13.428 34.271 51.720 1.00 31.89 ? 270 PHE E O 1 +ATOM 24932 C CB . PHE E 1 270 ? -10.244 35.042 51.536 1.00 30.27 ? 270 PHE E CB 1 +ATOM 24933 C CG . PHE E 1 270 ? -9.179 36.052 51.225 1.00 29.06 ? 270 PHE E CG 1 +ATOM 24934 C CD1 . PHE E 1 270 ? -8.642 36.148 49.945 1.00 28.96 ? 270 PHE E CD1 1 +ATOM 24935 C CD2 . PHE E 1 270 ? -8.680 36.883 52.224 1.00 28.07 ? 270 PHE E CD2 1 +ATOM 24936 C CE1 . PHE E 1 270 ? -7.623 37.056 49.670 1.00 28.20 ? 270 PHE E CE1 1 +ATOM 24937 C CE2 . PHE E 1 270 ? -7.662 37.790 51.959 1.00 25.91 ? 270 PHE E CE2 1 +ATOM 24938 C CZ . PHE E 1 270 ? -7.133 37.878 50.685 1.00 26.27 ? 270 PHE E CZ 1 +ATOM 24939 N N . CYS E 1 271 ? -12.153 32.823 50.561 1.00 30.14 ? 271 CYS E N 1 +ATOM 24940 C CA . CYS E 1 271 ? -12.977 31.652 50.865 1.00 33.37 ? 271 CYS E CA 1 +ATOM 24941 C C . CYS E 1 271 ? -12.930 31.306 52.353 1.00 32.03 ? 271 CYS E C 1 +ATOM 24942 O O . CYS E 1 271 ? -11.904 31.471 53.004 1.00 31.35 ? 271 CYS E O 1 +ATOM 24943 C CB . CYS E 1 271 ? -12.488 30.425 50.092 1.00 34.34 ? 271 CYS E CB 1 +ATOM 24944 S SG . CYS E 1 271 ? -12.618 30.506 48.299 1.00 45.96 ? 271 CYS E SG 1 +ATOM 24945 N N . GLU E 1 272 ? -14.040 30.804 52.877 1.00 33.73 ? 272 GLU E N 1 +ATOM 24946 C CA . GLU E 1 272 ? -14.115 30.415 54.281 1.00 36.59 ? 272 GLU E CA 1 +ATOM 24947 C C . GLU E 1 272 ? -14.468 28.930 54.395 1.00 36.04 ? 272 GLU E C 1 +ATOM 24948 O O . GLU E 1 272 ? -14.682 28.246 53.389 1.00 34.76 ? 272 GLU E O 1 +ATOM 24949 C CB . GLU E 1 272 ? -15.196 31.224 55.009 1.00 37.85 ? 272 GLU E CB 1 +ATOM 24950 C CG . GLU E 1 272 ? -15.055 32.723 54.888 1.00 42.00 ? 272 GLU E CG 1 +ATOM 24951 C CD . GLU E 1 272 ? -16.211 33.476 55.536 1.00 44.45 ? 272 GLU E CD 1 +ATOM 24952 O OE1 . GLU E 1 272 ? -17.338 32.924 55.594 1.00 45.73 ? 272 GLU E OE1 1 +ATOM 24953 O OE2 . GLU E 1 272 ? -15.993 34.629 55.967 1.00 44.39 ? 272 GLU E OE2 1 +ATOM 24954 N N . ILE E 1 273 ? -14.519 28.437 55.628 1.00 34.91 ? 273 ILE E N 1 +ATOM 24955 C CA . ILE E 1 273 ? -14.907 27.062 55.864 1.00 35.12 ? 273 ILE E CA 1 +ATOM 24956 C C . ILE E 1 273 ? -16.211 27.115 56.656 1.00 36.23 ? 273 ILE E C 1 +ATOM 24957 O O . ILE E 1 273 ? -16.557 28.157 57.205 1.00 35.96 ? 273 ILE E O 1 +ATOM 24958 C CB . ILE E 1 273 ? -13.835 26.283 56.647 1.00 34.11 ? 273 ILE E CB 1 +ATOM 24959 C CG1 . ILE E 1 273 ? -13.485 27.007 57.945 1.00 33.20 ? 273 ILE E CG1 1 +ATOM 24960 C CG2 . ILE E 1 273 ? -12.604 26.091 55.776 1.00 34.37 ? 273 ILE E CG2 1 +ATOM 24961 C CD1 . ILE E 1 273 ? -12.555 26.192 58.839 1.00 31.86 ? 273 ILE E CD1 1 +ATOM 24962 N N . GLU E 1 274 ? -16.933 25.999 56.698 1.00 38.04 ? 274 GLU E N 1 +ATOM 24963 C CA . GLU E 1 274 ? -18.208 25.918 57.405 1.00 41.13 ? 274 GLU E CA 1 +ATOM 24964 C C . GLU E 1 274 ? -18.271 26.689 58.718 1.00 40.13 ? 274 GLU E C 1 +ATOM 24965 O O . GLU E 1 274 ? -19.180 27.485 58.938 1.00 38.05 ? 274 GLU E O 1 +ATOM 24966 C CB . GLU E 1 274 ? -18.562 24.455 57.681 1.00 45.66 ? 274 GLU E CB 1 +ATOM 24967 C CG . GLU E 1 274 ? -19.490 23.803 56.661 1.00 53.85 ? 274 GLU E CG 1 +ATOM 24968 C CD . GLU E 1 274 ? -20.866 24.461 56.615 1.00 59.17 ? 274 GLU E CD 1 +ATOM 24969 O OE1 . GLU E 1 274 ? -21.365 24.863 57.694 1.00 59.69 ? 274 GLU E OE1 1 +ATOM 24970 O OE2 . GLU E 1 274 ? -21.453 24.563 55.505 1.00 62.45 ? 274 GLU E OE2 1 +ATOM 24971 N N . SER E 1 275 ? -17.296 26.457 59.590 1.00 40.41 ? 275 SER E N 1 +ATOM 24972 C CA . SER E 1 275 ? -17.284 27.111 60.894 1.00 40.79 ? 275 SER E CA 1 +ATOM 24973 C C . SER E 1 275 ? -17.026 28.621 60.927 1.00 40.34 ? 275 SER E C 1 +ATOM 24974 O O . SER E 1 275 ? -17.051 29.228 61.998 1.00 41.50 ? 275 SER E O 1 +ATOM 24975 C CB . SER E 1 275 ? -16.312 26.386 61.824 1.00 40.45 ? 275 SER E CB 1 +ATOM 24976 O OG . SER E 1 275 ? -15.069 26.155 61.188 1.00 45.14 ? 275 SER E OG 1 +ATOM 24977 N N . GLY E 1 276 ? -16.768 29.232 59.777 1.00 39.19 ? 276 GLY E N 1 +ATOM 24978 C CA . GLY E 1 276 ? -16.574 30.670 59.772 1.00 37.71 ? 276 GLY E CA 1 +ATOM 24979 C C . GLY E 1 276 ? -15.188 31.248 59.600 1.00 37.56 ? 276 GLY E C 1 +ATOM 24980 O O . GLY E 1 276 ? -15.074 32.414 59.232 1.00 38.83 ? 276 GLY E O 1 +ATOM 24981 N N . GLU E 1 277 ? -14.136 30.480 59.863 1.00 37.23 ? 277 GLU E N 1 +ATOM 24982 C CA . GLU E 1 277 ? -12.795 31.023 59.708 1.00 36.51 ? 277 GLU E CA 1 +ATOM 24983 C C . GLU E 1 277 ? -12.427 31.023 58.235 1.00 35.96 ? 277 GLU E C 1 +ATOM 24984 O O . GLU E 1 277 ? -13.149 30.480 57.405 1.00 35.28 ? 277 GLU E O 1 +ATOM 24985 C CB . GLU E 1 277 ? -11.748 30.188 60.457 1.00 39.83 ? 277 GLU E CB 1 +ATOM 24986 C CG . GLU E 1 277 ? -12.093 29.756 61.874 1.00 43.25 ? 277 GLU E CG 1 +ATOM 24987 C CD . GLU E 1 277 ? -12.731 28.371 61.911 1.00 47.56 ? 277 GLU E CD 1 +ATOM 24988 O OE1 . GLU E 1 277 ? -13.901 28.254 61.468 1.00 47.31 ? 277 GLU E OE1 1 +ATOM 24989 O OE2 . GLU E 1 277 ? -12.059 27.403 62.365 1.00 46.38 ? 277 GLU E OE2 1 +ATOM 24990 N N . LEU E 1 278 ? -11.295 31.637 57.909 1.00 35.07 ? 278 LEU E N 1 +ATOM 24991 C CA . LEU E 1 278 ? -10.827 31.656 56.533 1.00 33.46 ? 278 LEU E CA 1 +ATOM 24992 C C . LEU E 1 278 ? -10.351 30.259 56.191 1.00 32.85 ? 278 LEU E C 1 +ATOM 24993 O O . LEU E 1 278 ? -9.936 29.508 57.072 1.00 34.73 ? 278 LEU E O 1 +ATOM 24994 C CB . LEU E 1 278 ? -9.633 32.596 56.368 1.00 31.86 ? 278 LEU E CB 1 +ATOM 24995 C CG . LEU E 1 278 ? -9.857 34.098 56.461 1.00 32.65 ? 278 LEU E CG 1 +ATOM 24996 C CD1 . LEU E 1 278 ? -8.545 34.819 56.202 1.00 30.99 ? 278 LEU E CD1 1 +ATOM 24997 C CD2 . LEU E 1 278 ? -10.912 34.506 55.450 1.00 31.36 ? 278 LEU E CD2 1 +ATOM 24998 N N . PHE E 1 279 ? -10.414 29.899 54.918 1.00 30.80 ? 279 PHE E N 1 +ATOM 24999 C CA . PHE E 1 279 ? -9.903 28.609 54.521 1.00 29.04 ? 279 PHE E CA 1 +ATOM 25000 C C . PHE E 1 279 ? -8.417 28.852 54.262 1.00 28.73 ? 279 PHE E C 1 +ATOM 25001 O O . PHE E 1 279 ? -8.050 29.522 53.306 1.00 28.52 ? 279 PHE E O 1 +ATOM 25002 C CB . PHE E 1 279 ? -10.584 28.103 53.249 1.00 26.59 ? 279 PHE E CB 1 +ATOM 25003 C CG . PHE E 1 279 ? -9.839 26.988 52.573 1.00 27.22 ? 279 PHE E CG 1 +ATOM 25004 C CD1 . PHE E 1 279 ? -9.318 25.930 53.321 1.00 27.27 ? 279 PHE E CD1 1 +ATOM 25005 C CD2 . PHE E 1 279 ? -9.643 26.993 51.195 1.00 26.82 ? 279 PHE E CD2 1 +ATOM 25006 C CE1 . PHE E 1 279 ? -8.613 24.900 52.705 1.00 26.86 ? 279 PHE E CE1 1 +ATOM 25007 C CE2 . PHE E 1 279 ? -8.939 25.966 50.569 1.00 25.20 ? 279 PHE E CE2 1 +ATOM 25008 C CZ . PHE E 1 279 ? -8.422 24.920 51.320 1.00 27.08 ? 279 PHE E CZ 1 +ATOM 25009 N N . VAL E 1 280 ? -7.567 28.335 55.140 1.00 29.37 ? 280 VAL E N 1 +ATOM 25010 C CA . VAL E 1 280 ? -6.127 28.492 54.981 1.00 29.26 ? 280 VAL E CA 1 +ATOM 25011 C C . VAL E 1 280 ? -5.558 27.177 54.476 1.00 30.05 ? 280 VAL E C 1 +ATOM 25012 O O . VAL E 1 280 ? -5.736 26.135 55.107 1.00 31.41 ? 280 VAL E O 1 +ATOM 25013 C CB . VAL E 1 280 ? -5.454 28.847 56.314 1.00 30.06 ? 280 VAL E CB 1 +ATOM 25014 C CG1 . VAL E 1 280 ? -3.946 28.977 56.116 1.00 28.49 ? 280 VAL E CG1 1 +ATOM 25015 C CG2 . VAL E 1 280 ? -6.044 30.151 56.853 1.00 28.78 ? 280 VAL E CG2 1 +ATOM 25016 N N . GLY E 1 281 ? -4.882 27.227 53.337 1.00 29.50 ? 281 GLY E N 1 +ATOM 25017 C CA . GLY E 1 281 ? -4.318 26.028 52.762 1.00 30.06 ? 281 GLY E CA 1 +ATOM 25018 C C . GLY E 1 281 ? -2.849 26.147 52.416 1.00 31.27 ? 281 GLY E C 1 +ATOM 25019 O O . GLY E 1 281 ? -2.114 26.930 53.024 1.00 30.86 ? 281 GLY E O 1 +ATOM 25020 N N . LYS E 1 282 ? -2.418 25.363 51.434 1.00 32.12 ? 282 LYS E N 1 +ATOM 25021 C CA . LYS E 1 282 ? -1.025 25.357 51.012 1.00 34.30 ? 282 LYS E CA 1 +ATOM 25022 C C . LYS E 1 282 ? -0.941 25.348 49.504 1.00 34.83 ? 282 LYS E C 1 +ATOM 25023 O O . LYS E 1 282 ? -1.645 24.587 48.847 1.00 34.66 ? 282 LYS E O 1 +ATOM 25024 C CB . LYS E 1 282 ? -0.315 24.116 51.561 1.00 37.19 ? 282 LYS E CB 1 +ATOM 25025 C CG . LYS E 1 282 ? -0.085 24.123 53.070 1.00 40.73 ? 282 LYS E CG 1 +ATOM 25026 C CD . LYS E 1 282 ? 1.175 24.902 53.402 1.00 45.71 ? 282 LYS E CD 1 +ATOM 25027 C CE . LYS E 1 282 ? 1.473 24.901 54.898 1.00 48.77 ? 282 LYS E CE 1 +ATOM 25028 N NZ . LYS E 1 282 ? 0.495 25.733 55.668 1.00 53.15 ? 282 LYS E NZ 1 +ATOM 25029 N N . MET E 1 283 ? -0.066 26.194 48.968 1.00 35.50 ? 283 MET E N 1 +ATOM 25030 C CA . MET E 1 283 ? 0.155 26.310 47.532 1.00 35.24 ? 283 MET E CA 1 +ATOM 25031 C C . MET E 1 283 ? 1.587 26.810 47.343 1.00 36.19 ? 283 MET E C 1 +ATOM 25032 O O . MET E 1 283 ? 2.337 26.888 48.319 1.00 36.70 ? 283 MET E O 1 +ATOM 25033 C CB . MET E 1 283 ? -0.848 27.289 46.915 1.00 36.87 ? 283 MET E CB 1 +ATOM 25034 C CG . MET E 1 283 ? -1.725 26.688 45.819 1.00 37.81 ? 283 MET E CG 1 +ATOM 25035 S SD . MET E 1 283 ? -0.787 26.236 44.324 1.00 42.25 ? 283 MET E SD 1 +ATOM 25036 C CE . MET E 1 283 ? -0.793 27.793 43.445 1.00 37.74 ? 283 MET E CE 1 +ATOM 25037 N N . TRP E 1 284 ? 1.966 27.153 46.111 1.00 35.77 ? 284 TRP E N 1 +ATOM 25038 C CA . TRP E 1 284 ? 3.336 27.613 45.822 1.00 37.20 ? 284 TRP E CA 1 +ATOM 25039 C C . TRP E 1 284 ? 3.938 28.603 46.829 1.00 36.36 ? 284 TRP E C 1 +ATOM 25040 O O . TRP E 1 284 ? 5.067 28.427 47.274 1.00 36.91 ? 284 TRP E O 1 +ATOM 25041 C CB . TRP E 1 284 ? 3.416 28.230 44.420 1.00 36.47 ? 284 TRP E CB 1 +ATOM 25042 C CG . TRP E 1 284 ? 3.006 27.312 43.301 1.00 39.83 ? 284 TRP E CG 1 +ATOM 25043 C CD1 . TRP E 1 284 ? 2.465 27.684 42.108 1.00 39.97 ? 284 TRP E CD1 1 +ATOM 25044 C CD2 . TRP E 1 284 ? 3.101 25.880 43.267 1.00 41.27 ? 284 TRP E CD2 1 +ATOM 25045 N NE1 . TRP E 1 284 ? 2.212 26.581 41.335 1.00 39.83 ? 284 TRP E NE1 1 +ATOM 25046 C CE2 . TRP E 1 284 ? 2.591 25.459 42.019 1.00 41.14 ? 284 TRP E CE2 1 +ATOM 25047 C CE3 . TRP E 1 284 ? 3.562 24.909 44.171 1.00 43.84 ? 284 TRP E CE3 1 +ATOM 25048 C CZ2 . TRP E 1 284 ? 2.528 24.107 41.645 1.00 43.31 ? 284 TRP E CZ2 1 +ATOM 25049 C CZ3 . TRP E 1 284 ? 3.498 23.560 43.802 1.00 44.18 ? 284 TRP E CZ3 1 +ATOM 25050 C CH2 . TRP E 1 284 ? 2.984 23.176 42.548 1.00 44.96 ? 284 TRP E CH2 1 +ATOM 25051 N N . PRO E 1 285 ? 3.199 29.664 47.191 1.00 36.11 ? 285 PRO E N 1 +ATOM 25052 C CA . PRO E 1 285 ? 3.769 30.620 48.152 1.00 36.67 ? 285 PRO E CA 1 +ATOM 25053 C C . PRO E 1 285 ? 3.779 30.168 49.617 1.00 36.44 ? 285 PRO E C 1 +ATOM 25054 O O . PRO E 1 285 ? 4.175 30.933 50.500 1.00 37.08 ? 285 PRO E O 1 +ATOM 25055 C CB . PRO E 1 285 ? 2.919 31.870 47.932 1.00 35.67 ? 285 PRO E CB 1 +ATOM 25056 C CG . PRO E 1 285 ? 1.579 31.292 47.570 1.00 34.15 ? 285 PRO E CG 1 +ATOM 25057 C CD . PRO E 1 285 ? 1.935 30.170 46.625 1.00 34.62 ? 285 PRO E CD 1 +ATOM 25058 N N . GLY E 1 286 ? 3.364 28.926 49.866 1.00 35.45 ? 286 GLY E N 1 +ATOM 25059 C CA . GLY E 1 286 ? 3.319 28.407 51.223 1.00 33.80 ? 286 GLY E CA 1 +ATOM 25060 C C . GLY E 1 286 ? 1.905 28.502 51.776 1.00 33.14 ? 286 GLY E C 1 +ATOM 25061 O O . GLY E 1 286 ? 0.947 28.166 51.082 1.00 34.75 ? 286 GLY E O 1 +ATOM 25062 N N . THR E 1 287 ? 1.763 28.957 53.015 1.00 31.84 ? 287 THR E N 1 +ATOM 25063 C CA . THR E 1 287 ? 0.446 29.105 53.625 1.00 31.99 ? 287 THR E CA 1 +ATOM 25064 C C . THR E 1 287 ? -0.304 30.125 52.777 1.00 31.26 ? 287 THR E C 1 +ATOM 25065 O O . THR E 1 287 ? 0.212 31.211 52.520 1.00 30.62 ? 287 THR E O 1 +ATOM 25066 C CB . THR E 1 287 ? 0.574 29.611 55.069 1.00 32.30 ? 287 THR E CB 1 +ATOM 25067 O OG1 . THR E 1 287 ? 1.382 28.693 55.817 1.00 34.09 ? 287 THR E OG1 1 +ATOM 25068 C CG2 . THR E 1 287 ? -0.788 29.716 55.723 1.00 32.13 ? 287 THR E CG2 1 +ATOM 25069 N N . THR E 1 288 ? -1.515 29.784 52.346 1.00 30.86 ? 288 THR E N 1 +ATOM 25070 C CA . THR E 1 288 ? -2.279 30.670 51.474 1.00 30.95 ? 288 THR E CA 1 +ATOM 25071 C C . THR E 1 288 ? -3.783 30.658 51.698 1.00 30.25 ? 288 THR E C 1 +ATOM 25072 O O . THR E 1 288 ? -4.332 29.723 52.275 1.00 31.53 ? 288 THR E O 1 +ATOM 25073 C CB . THR E 1 288 ? -2.054 30.291 49.978 1.00 33.54 ? 288 THR E CB 1 +ATOM 25074 O OG1 . THR E 1 288 ? -2.611 28.995 49.721 1.00 35.91 ? 288 THR E OG1 1 +ATOM 25075 C CG2 . THR E 1 288 ? -0.582 30.235 49.642 1.00 33.42 ? 288 THR E CG2 1 +ATOM 25076 N N . VAL E 1 289 ? -4.443 31.714 51.235 1.00 28.78 ? 289 VAL E N 1 +ATOM 25077 C CA . VAL E 1 289 ? -5.895 31.817 51.309 1.00 27.27 ? 289 VAL E CA 1 +ATOM 25078 C C . VAL E 1 289 ? -6.297 31.972 49.860 1.00 26.39 ? 289 VAL E C 1 +ATOM 25079 O O . VAL E 1 289 ? -5.453 32.255 49.014 1.00 24.48 ? 289 VAL E O 1 +ATOM 25080 C CB . VAL E 1 289 ? -6.388 33.039 52.132 1.00 28.46 ? 289 VAL E CB 1 +ATOM 25081 C CG1 . VAL E 1 289 ? -6.214 32.765 53.622 1.00 26.25 ? 289 VAL E CG1 1 +ATOM 25082 C CG2 . VAL E 1 289 ? -5.628 34.305 51.722 1.00 27.33 ? 289 VAL E CG2 1 +ATOM 25083 N N . TYR E 1 290 ? -7.573 31.784 49.560 1.00 27.96 ? 290 TYR E N 1 +ATOM 25084 C CA . TYR E 1 290 ? -8.015 31.879 48.170 1.00 28.99 ? 290 TYR E CA 1 +ATOM 25085 C C . TYR E 1 290 ? -9.179 32.827 47.986 1.00 28.83 ? 290 TYR E C 1 +ATOM 25086 O O . TYR E 1 290 ? -10.061 32.915 48.841 1.00 29.41 ? 290 TYR E O 1 +ATOM 25087 C CB . TYR E 1 290 ? -8.405 30.484 47.651 1.00 30.06 ? 290 TYR E CB 1 +ATOM 25088 C CG . TYR E 1 290 ? -7.315 29.445 47.818 1.00 29.73 ? 290 TYR E CG 1 +ATOM 25089 C CD1 . TYR E 1 290 ? -7.192 28.715 49.000 1.00 29.17 ? 290 TYR E CD1 1 +ATOM 25090 C CD2 . TYR E 1 290 ? -6.394 29.212 46.803 1.00 29.36 ? 290 TYR E CD2 1 +ATOM 25091 C CE1 . TYR E 1 290 ? -6.181 27.775 49.165 1.00 31.55 ? 290 TYR E CE1 1 +ATOM 25092 C CE2 . TYR E 1 290 ? -5.378 28.281 46.955 1.00 32.29 ? 290 TYR E CE2 1 +ATOM 25093 C CZ . TYR E 1 290 ? -5.274 27.559 48.135 1.00 33.38 ? 290 TYR E CZ 1 +ATOM 25094 O OH . TYR E 1 290 ? -4.274 26.614 48.261 1.00 33.89 ? 290 TYR E OH 1 +ATOM 25095 N N . PRO E 1 291 ? -9.192 33.557 46.865 1.00 30.03 ? 291 PRO E N 1 +ATOM 25096 C CA . PRO E 1 291 ? -10.277 34.503 46.586 1.00 30.93 ? 291 PRO E CA 1 +ATOM 25097 C C . PRO E 1 291 ? -11.563 33.738 46.321 1.00 32.43 ? 291 PRO E C 1 +ATOM 25098 O O . PRO E 1 291 ? -11.536 32.717 45.632 1.00 33.60 ? 291 PRO E O 1 +ATOM 25099 C CB . PRO E 1 291 ? -9.800 35.226 45.323 1.00 31.31 ? 291 PRO E CB 1 +ATOM 25100 C CG . PRO E 1 291 ? -8.304 35.047 45.333 1.00 30.74 ? 291 PRO E CG 1 +ATOM 25101 C CD . PRO E 1 291 ? -8.143 33.637 45.833 1.00 29.97 ? 291 PRO E CD 1 +ATOM 25102 N N . ASP E 1 292 ? -12.676 34.204 46.881 1.00 33.45 ? 292 ASP E N 1 +ATOM 25103 C CA . ASP E 1 292 ? -13.963 33.566 46.626 1.00 34.80 ? 292 ASP E CA 1 +ATOM 25104 C C . ASP E 1 292 ? -14.532 34.233 45.368 1.00 33.99 ? 292 ASP E C 1 +ATOM 25105 O O . ASP E 1 292 ? -15.361 35.138 45.457 1.00 34.93 ? 292 ASP E O 1 +ATOM 25106 C CB . ASP E 1 292 ? -14.924 33.767 47.805 1.00 37.57 ? 292 ASP E CB 1 +ATOM 25107 C CG . ASP E 1 292 ? -16.280 33.104 47.576 1.00 39.82 ? 292 ASP E CG 1 +ATOM 25108 O OD1 . ASP E 1 292 ? -16.461 32.459 46.509 1.00 41.97 ? 292 ASP E OD1 1 +ATOM 25109 O OD2 . ASP E 1 292 ? -17.164 33.222 48.457 1.00 38.18 ? 292 ASP E OD2 1 +ATOM 25110 N N . PHE E 1 293 ? -14.074 33.783 44.203 1.00 32.72 ? 293 PHE E N 1 +ATOM 25111 C CA . PHE E 1 293 ? -14.505 34.342 42.924 1.00 33.07 ? 293 PHE E CA 1 +ATOM 25112 C C . PHE E 1 293 ? -16.001 34.276 42.629 1.00 32.68 ? 293 PHE E C 1 +ATOM 25113 O O . PHE E 1 293 ? -16.464 34.852 41.657 1.00 34.00 ? 293 PHE E O 1 +ATOM 25114 C CB . PHE E 1 293 ? -13.735 33.679 41.785 1.00 31.62 ? 293 PHE E CB 1 +ATOM 25115 C CG . PHE E 1 293 ? -12.270 34.001 41.780 1.00 32.68 ? 293 PHE E CG 1 +ATOM 25116 C CD1 . PHE E 1 293 ? -11.833 35.300 41.536 1.00 31.90 ? 293 PHE E CD1 1 +ATOM 25117 C CD2 . PHE E 1 293 ? -11.322 33.006 42.009 1.00 31.47 ? 293 PHE E CD2 1 +ATOM 25118 C CE1 . PHE E 1 293 ? -10.470 35.610 41.517 1.00 32.18 ? 293 PHE E CE1 1 +ATOM 25119 C CE2 . PHE E 1 293 ? -9.955 33.304 41.993 1.00 33.20 ? 293 PHE E CE2 1 +ATOM 25120 C CZ . PHE E 1 293 ? -9.527 34.615 41.745 1.00 32.71 ? 293 PHE E CZ 1 +ATOM 25121 N N . PHE E 1 294 ? -16.763 33.576 43.454 1.00 33.97 ? 294 PHE E N 1 +ATOM 25122 C CA . PHE E 1 294 ? -18.201 33.490 43.225 1.00 36.12 ? 294 PHE E CA 1 +ATOM 25123 C C . PHE E 1 294 ? -18.883 34.807 43.610 1.00 37.22 ? 294 PHE E C 1 +ATOM 25124 O O . PHE E 1 294 ? -20.019 35.072 43.211 1.00 35.96 ? 294 PHE E O 1 +ATOM 25125 C CB . PHE E 1 294 ? -18.796 32.340 44.035 1.00 36.05 ? 294 PHE E CB 1 +ATOM 25126 C CG . PHE E 1 294 ? -18.394 30.982 43.541 1.00 36.44 ? 294 PHE E CG 1 +ATOM 25127 C CD1 . PHE E 1 294 ? -18.972 30.451 42.400 1.00 36.60 ? 294 PHE E CD1 1 +ATOM 25128 C CD2 . PHE E 1 294 ? -17.426 30.238 44.208 1.00 36.47 ? 294 PHE E CD2 1 +ATOM 25129 C CE1 . PHE E 1 294 ? -18.595 29.202 41.927 1.00 34.72 ? 294 PHE E CE1 1 +ATOM 25130 C CE2 . PHE E 1 294 ? -17.043 28.987 43.739 1.00 34.08 ? 294 PHE E CE2 1 +ATOM 25131 C CZ . PHE E 1 294 ? -17.631 28.473 42.596 1.00 34.22 ? 294 PHE E CZ 1 +ATOM 25132 N N . ARG E 1 295 ? -18.177 35.627 44.383 1.00 38.78 ? 295 ARG E N 1 +ATOM 25133 C CA . ARG E 1 295 ? -18.699 36.916 44.824 1.00 40.15 ? 295 ARG E CA 1 +ATOM 25134 C C . ARG E 1 295 ? -18.355 38.038 43.851 1.00 40.84 ? 295 ARG E C 1 +ATOM 25135 O O . ARG E 1 295 ? -17.240 38.091 43.326 1.00 40.61 ? 295 ARG E O 1 +ATOM 25136 C CB . ARG E 1 295 ? -18.139 37.247 46.200 1.00 40.47 ? 295 ARG E CB 1 +ATOM 25137 C CG . ARG E 1 295 ? -18.531 36.247 47.257 1.00 42.94 ? 295 ARG E CG 1 +ATOM 25138 C CD . ARG E 1 295 ? -17.689 36.432 48.496 1.00 44.46 ? 295 ARG E CD 1 +ATOM 25139 N NE . ARG E 1 295 ? -17.764 37.794 49.000 1.00 47.88 ? 295 ARG E NE 1 +ATOM 25140 C CZ . ARG E 1 295 ? -17.233 38.187 50.154 1.00 50.27 ? 295 ARG E CZ 1 +ATOM 25141 N NH1 . ARG E 1 295 ? -16.588 37.313 50.922 1.00 50.49 ? 295 ARG E NH1 1 +ATOM 25142 N NH2 . ARG E 1 295 ? -17.346 39.453 50.543 1.00 50.52 ? 295 ARG E NH2 1 +ATOM 25143 N N . GLU E 1 296 ? -19.306 38.937 43.600 1.00 41.53 ? 296 GLU E N 1 +ATOM 25144 C CA . GLU E 1 296 ? -19.031 40.046 42.688 1.00 42.56 ? 296 GLU E CA 1 +ATOM 25145 C C . GLU E 1 296 ? -17.894 40.935 43.197 1.00 40.06 ? 296 GLU E C 1 +ATOM 25146 O O . GLU E 1 296 ? -17.029 41.345 42.425 1.00 37.39 ? 296 GLU E O 1 +ATOM 25147 C CB . GLU E 1 296 ? -20.269 40.913 42.481 1.00 45.53 ? 296 GLU E CB 1 +ATOM 25148 C CG . GLU E 1 296 ? -21.370 40.271 41.646 1.00 54.04 ? 296 GLU E CG 1 +ATOM 25149 C CD . GLU E 1 296 ? -22.501 41.253 41.317 1.00 57.77 ? 296 GLU E CD 1 +ATOM 25150 O OE1 . GLU E 1 296 ? -23.100 41.821 42.266 1.00 58.94 ? 296 GLU E OE1 1 +ATOM 25151 O OE2 . GLU E 1 296 ? -22.786 41.458 40.111 1.00 59.06 ? 296 GLU E OE2 1 +ATOM 25152 N N . ASP E 1 297 ? -17.896 41.227 44.494 1.00 38.69 ? 297 ASP E N 1 +ATOM 25153 C CA . ASP E 1 297 ? -16.864 42.088 45.065 1.00 40.00 ? 297 ASP E CA 1 +ATOM 25154 C C . ASP E 1 297 ? -15.445 41.505 44.962 1.00 38.25 ? 297 ASP E C 1 +ATOM 25155 O O . ASP E 1 297 ? -14.479 42.254 44.766 1.00 37.99 ? 297 ASP E O 1 +ATOM 25156 C CB . ASP E 1 297 ? -17.215 42.470 46.522 1.00 42.42 ? 297 ASP E CB 1 +ATOM 25157 C CG . ASP E 1 297 ? -17.340 41.265 47.447 1.00 46.33 ? 297 ASP E CG 1 +ATOM 25158 O OD1 . ASP E 1 297 ? -17.838 40.210 47.000 1.00 49.53 ? 297 ASP E OD1 1 +ATOM 25159 O OD2 . ASP E 1 297 ? -16.958 41.380 48.633 1.00 47.19 ? 297 ASP E OD2 1 +ATOM 25160 N N . THR E 1 298 ? -15.314 40.184 45.083 1.00 33.69 ? 298 THR E N 1 +ATOM 25161 C CA . THR E 1 298 ? -14.005 39.560 44.949 1.00 31.03 ? 298 THR E CA 1 +ATOM 25162 C C . THR E 1 298 ? -13.598 39.702 43.482 1.00 29.85 ? 298 THR E C 1 +ATOM 25163 O O . THR E 1 298 ? -12.457 40.032 43.164 1.00 29.83 ? 298 THR E O 1 +ATOM 25164 C CB . THR E 1 298 ? -14.043 38.054 45.310 1.00 30.32 ? 298 THR E CB 1 +ATOM 25165 O OG1 . THR E 1 298 ? -14.483 37.898 46.661 1.00 29.56 ? 298 THR E OG1 1 +ATOM 25166 C CG2 . THR E 1 298 ? -12.660 37.430 45.149 1.00 23.72 ? 298 THR E CG2 1 +ATOM 25167 N N . ARG E 1 299 ? -14.546 39.444 42.594 1.00 29.73 ? 299 ARG E N 1 +ATOM 25168 C CA . ARG E 1 299 ? -14.314 39.552 41.162 1.00 30.62 ? 299 ARG E CA 1 +ATOM 25169 C C . ARG E 1 299 ? -13.825 40.964 40.826 1.00 32.18 ? 299 ARG E C 1 +ATOM 25170 O O . ARG E 1 299 ? -12.841 41.131 40.096 1.00 32.36 ? 299 ARG E O 1 +ATOM 25171 C CB . ARG E 1 299 ? -15.608 39.250 40.426 1.00 30.11 ? 299 ARG E CB 1 +ATOM 25172 C CG . ARG E 1 299 ? -15.473 38.185 39.375 1.00 33.09 ? 299 ARG E CG 1 +ATOM 25173 C CD . ARG E 1 299 ? -16.526 37.110 39.529 1.00 31.28 ? 299 ARG E CD 1 +ATOM 25174 N NE . ARG E 1 299 ? -17.871 37.633 39.323 1.00 29.99 ? 299 ARG E NE 1 +ATOM 25175 C CZ . ARG E 1 299 ? -18.941 37.177 39.960 1.00 30.75 ? 299 ARG E CZ 1 +ATOM 25176 N NH1 . ARG E 1 299 ? -18.825 36.185 40.844 1.00 27.73 ? 299 ARG E NH1 1 +ATOM 25177 N NH2 . ARG E 1 299 ? -20.128 37.717 39.723 1.00 33.32 ? 299 ARG E NH2 1 +ATOM 25178 N N . GLU E 1 300 ? -14.500 41.979 41.372 1.00 33.53 ? 300 GLU E N 1 +ATOM 25179 C CA . GLU E 1 300 ? -14.108 43.373 41.139 1.00 35.99 ? 300 GLU E CA 1 +ATOM 25180 C C . GLU E 1 300 ? -12.683 43.619 41.657 1.00 33.51 ? 300 GLU E C 1 +ATOM 25181 O O . GLU E 1 300 ? -11.840 44.144 40.933 1.00 32.80 ? 300 GLU E O 1 +ATOM 25182 C CB . GLU E 1 300 ? -15.089 44.341 41.819 1.00 40.58 ? 300 GLU E CB 1 +ATOM 25183 C CG . GLU E 1 300 ? -14.868 45.822 41.431 1.00 51.71 ? 300 GLU E CG 1 +ATOM 25184 C CD . GLU E 1 300 ? -15.730 46.824 42.243 1.00 58.72 ? 300 GLU E CD 1 +ATOM 25185 O OE1 . GLU E 1 300 ? -16.986 46.698 42.229 1.00 61.46 ? 300 GLU E OE1 1 +ATOM 25186 O OE2 . GLU E 1 300 ? -15.148 47.742 42.887 1.00 58.96 ? 300 GLU E OE2 1 +ATOM 25187 N N . TRP E 1 301 ? -12.424 43.233 42.904 1.00 31.43 ? 301 TRP E N 1 +ATOM 25188 C CA . TRP E 1 301 ? -11.106 43.377 43.526 1.00 31.96 ? 301 TRP E CA 1 +ATOM 25189 C C . TRP E 1 301 ? -10.018 42.740 42.649 1.00 32.70 ? 301 TRP E C 1 +ATOM 25190 O O . TRP E 1 301 ? -8.971 43.347 42.385 1.00 32.73 ? 301 TRP E O 1 +ATOM 25191 C CB . TRP E 1 301 ? -11.128 42.709 44.908 1.00 32.44 ? 301 TRP E CB 1 +ATOM 25192 C CG . TRP E 1 301 ? -9.784 42.497 45.532 1.00 33.60 ? 301 TRP E CG 1 +ATOM 25193 C CD1 . TRP E 1 301 ? -8.993 43.437 46.130 1.00 33.20 ? 301 TRP E CD1 1 +ATOM 25194 C CD2 . TRP E 1 301 ? -9.066 41.260 45.608 1.00 33.31 ? 301 TRP E CD2 1 +ATOM 25195 N NE1 . TRP E 1 301 ? -7.825 42.861 46.575 1.00 34.30 ? 301 TRP E NE1 1 +ATOM 25196 C CE2 . TRP E 1 301 ? -7.843 41.525 46.269 1.00 34.72 ? 301 TRP E CE2 1 +ATOM 25197 C CE3 . TRP E 1 301 ? -9.335 39.955 45.181 1.00 32.65 ? 301 TRP E CE3 1 +ATOM 25198 C CZ2 . TRP E 1 301 ? -6.888 40.527 46.515 1.00 34.35 ? 301 TRP E CZ2 1 +ATOM 25199 C CZ3 . TRP E 1 301 ? -8.387 38.961 45.424 1.00 34.61 ? 301 TRP E CZ3 1 +ATOM 25200 C CH2 . TRP E 1 301 ? -7.177 39.256 46.087 1.00 34.29 ? 301 TRP E CH2 1 +ATOM 25201 N N . TRP E 1 302 ? -10.284 41.520 42.188 1.00 32.42 ? 302 TRP E N 1 +ATOM 25202 C CA . TRP E 1 302 ? -9.345 40.793 41.338 1.00 32.39 ? 302 TRP E CA 1 +ATOM 25203 C C . TRP E 1 302 ? -9.114 41.528 40.014 1.00 31.90 ? 302 TRP E C 1 +ATOM 25204 O O . TRP E 1 302 ? -7.975 41.662 39.557 1.00 31.57 ? 302 TRP E O 1 +ATOM 25205 C CB . TRP E 1 302 ? -9.879 39.375 41.077 1.00 31.46 ? 302 TRP E CB 1 +ATOM 25206 C CG . TRP E 1 302 ? -8.971 38.526 40.238 1.00 31.21 ? 302 TRP E CG 1 +ATOM 25207 C CD1 . TRP E 1 302 ? -9.082 38.279 38.898 1.00 29.74 ? 302 TRP E CD1 1 +ATOM 25208 C CD2 . TRP E 1 302 ? -7.822 37.790 40.692 1.00 29.88 ? 302 TRP E CD2 1 +ATOM 25209 N NE1 . TRP E 1 302 ? -8.080 37.430 38.491 1.00 30.23 ? 302 TRP E NE1 1 +ATOM 25210 C CE2 . TRP E 1 302 ? -7.293 37.113 39.571 1.00 30.83 ? 302 TRP E CE2 1 +ATOM 25211 C CE3 . TRP E 1 302 ? -7.192 37.638 41.936 1.00 27.71 ? 302 TRP E CE3 1 +ATOM 25212 C CZ2 . TRP E 1 302 ? -6.158 36.289 39.657 1.00 30.41 ? 302 TRP E CZ2 1 +ATOM 25213 C CZ3 . TRP E 1 302 ? -6.071 36.828 42.024 1.00 29.42 ? 302 TRP E CZ3 1 +ATOM 25214 C CH2 . TRP E 1 302 ? -5.564 36.160 40.888 1.00 31.35 ? 302 TRP E CH2 1 +ATOM 25215 N N . ALA E 1 303 ? -10.199 42.003 39.405 1.00 31.45 ? 303 ALA E N 1 +ATOM 25216 C CA . ALA E 1 303 ? -10.105 42.734 38.142 1.00 30.92 ? 303 ALA E CA 1 +ATOM 25217 C C . ALA E 1 303 ? -9.176 43.933 38.326 1.00 29.86 ? 303 ALA E C 1 +ATOM 25218 O O . ALA E 1 303 ? -8.400 44.274 37.440 1.00 30.46 ? 303 ALA E O 1 +ATOM 25219 C CB . ALA E 1 303 ? -11.488 43.196 37.706 1.00 29.38 ? 303 ALA E CB 1 +ATOM 25220 N N . GLY E 1 304 ? -9.251 44.562 39.494 1.00 29.61 ? 304 GLY E N 1 +ATOM 25221 C CA . GLY E 1 304 ? -8.389 45.698 39.768 1.00 29.67 ? 304 GLY E CA 1 +ATOM 25222 C C . GLY E 1 304 ? -6.910 45.323 39.785 1.00 30.31 ? 304 GLY E C 1 +ATOM 25223 O O . GLY E 1 304 ? -6.085 46.023 39.196 1.00 29.13 ? 304 GLY E O 1 +ATOM 25224 N N . LEU E 1 305 ? -6.566 44.222 40.456 1.00 28.81 ? 305 LEU E N 1 +ATOM 25225 C CA . LEU E 1 305 ? -5.178 43.799 40.521 1.00 29.21 ? 305 LEU E CA 1 +ATOM 25226 C C . LEU E 1 305 ? -4.689 43.400 39.141 1.00 30.20 ? 305 LEU E C 1 +ATOM 25227 O O . LEU E 1 305 ? -3.556 43.706 38.760 1.00 29.50 ? 305 LEU E O 1 +ATOM 25228 C CB . LEU E 1 305 ? -5.022 42.621 41.476 1.00 31.60 ? 305 LEU E CB 1 +ATOM 25229 C CG . LEU E 1 305 ? -5.375 42.858 42.943 1.00 31.41 ? 305 LEU E CG 1 +ATOM 25230 C CD1 . LEU E 1 305 ? -5.325 41.536 43.697 1.00 31.86 ? 305 LEU E CD1 1 +ATOM 25231 C CD2 . LEU E 1 305 ? -4.406 43.863 43.543 1.00 30.76 ? 305 LEU E CD2 1 +ATOM 25232 N N . ILE E 1 306 ? -5.542 42.712 38.389 1.00 29.78 ? 306 ILE E N 1 +ATOM 25233 C CA . ILE E 1 306 ? -5.176 42.298 37.043 1.00 31.03 ? 306 ILE E CA 1 +ATOM 25234 C C . ILE E 1 306 ? -4.912 43.532 36.180 1.00 32.78 ? 306 ILE E C 1 +ATOM 25235 O O . ILE E 1 306 ? -3.877 43.634 35.513 1.00 32.37 ? 306 ILE E O 1 +ATOM 25236 C CB . ILE E 1 306 ? -6.310 41.463 36.383 1.00 30.11 ? 306 ILE E CB 1 +ATOM 25237 C CG1 . ILE E 1 306 ? -6.389 40.077 37.036 1.00 29.26 ? 306 ILE E CG1 1 +ATOM 25238 C CG2 . ILE E 1 306 ? -6.077 41.354 34.877 1.00 27.00 ? 306 ILE E CG2 1 +ATOM 25239 C CD1 . ILE E 1 306 ? -5.159 39.214 36.835 1.00 26.38 ? 306 ILE E CD1 1 +ATOM 25240 N N . SER E 1 307 ? -5.862 44.464 36.202 1.00 33.99 ? 307 SER E N 1 +ATOM 25241 C CA . SER E 1 307 ? -5.768 45.692 35.418 1.00 36.65 ? 307 SER E CA 1 +ATOM 25242 C C . SER E 1 307 ? -4.456 46.413 35.718 1.00 37.79 ? 307 SER E C 1 +ATOM 25243 O O . SER E 1 307 ? -3.724 46.815 34.815 1.00 37.67 ? 307 SER E O 1 +ATOM 25244 C CB . SER E 1 307 ? -6.948 46.600 35.748 1.00 36.78 ? 307 SER E CB 1 +ATOM 25245 O OG . SER E 1 307 ? -7.019 47.678 34.842 1.00 38.14 ? 307 SER E OG 1 +ATOM 25246 N N . GLU E 1 308 ? -4.168 46.568 37.000 1.00 38.31 ? 308 GLU E N 1 +ATOM 25247 C CA . GLU E 1 308 ? -2.940 47.209 37.443 1.00 39.73 ? 308 GLU E CA 1 +ATOM 25248 C C . GLU E 1 308 ? -1.727 46.441 36.918 1.00 38.22 ? 308 GLU E C 1 +ATOM 25249 O O . GLU E 1 308 ? -0.730 47.034 36.523 1.00 39.35 ? 308 GLU E O 1 +ATOM 25250 C CB . GLU E 1 308 ? -2.914 47.233 38.964 1.00 43.06 ? 308 GLU E CB 1 +ATOM 25251 C CG . GLU E 1 308 ? -1.825 48.068 39.587 1.00 50.82 ? 308 GLU E CG 1 +ATOM 25252 C CD . GLU E 1 308 ? -1.733 47.832 41.100 1.00 58.49 ? 308 GLU E CD 1 +ATOM 25253 O OE1 . GLU E 1 308 ? -2.790 47.897 41.788 1.00 60.26 ? 308 GLU E OE1 1 +ATOM 25254 O OE2 . GLU E 1 308 ? -0.605 47.579 41.599 1.00 60.21 ? 308 GLU E OE2 1 +ATOM 25255 N N . TRP E 1 309 ? -1.823 45.116 36.906 1.00 36.08 ? 309 TRP E N 1 +ATOM 25256 C CA . TRP E 1 309 ? -0.735 44.267 36.440 1.00 33.65 ? 309 TRP E CA 1 +ATOM 25257 C C . TRP E 1 309 ? -0.533 44.416 34.931 1.00 32.65 ? 309 TRP E C 1 +ATOM 25258 O O . TRP E 1 309 ? 0.597 44.444 34.447 1.00 31.57 ? 309 TRP E O 1 +ATOM 25259 C CB . TRP E 1 309 ? -1.030 42.800 36.814 1.00 31.84 ? 309 TRP E CB 1 +ATOM 25260 C CG . TRP E 1 309 ? 0.077 41.852 36.491 1.00 30.53 ? 309 TRP E CG 1 +ATOM 25261 C CD1 . TRP E 1 309 ? 0.095 40.920 35.494 1.00 29.41 ? 309 TRP E CD1 1 +ATOM 25262 C CD2 . TRP E 1 309 ? 1.353 41.772 37.141 1.00 30.61 ? 309 TRP E CD2 1 +ATOM 25263 N NE1 . TRP E 1 309 ? 1.302 40.263 35.482 1.00 31.15 ? 309 TRP E NE1 1 +ATOM 25264 C CE2 . TRP E 1 309 ? 2.096 40.767 36.480 1.00 29.28 ? 309 TRP E CE2 1 +ATOM 25265 C CE3 . TRP E 1 309 ? 1.944 42.457 38.220 1.00 30.93 ? 309 TRP E CE3 1 +ATOM 25266 C CZ2 . TRP E 1 309 ? 3.401 40.424 36.857 1.00 29.42 ? 309 TRP E CZ2 1 +ATOM 25267 C CZ3 . TRP E 1 309 ? 3.250 42.114 38.601 1.00 30.92 ? 309 TRP E CZ3 1 +ATOM 25268 C CH2 . TRP E 1 309 ? 3.961 41.103 37.915 1.00 31.01 ? 309 TRP E CH2 1 +ATOM 25269 N N . LEU E 1 310 ? -1.636 44.523 34.197 1.00 31.87 ? 310 LEU E N 1 +ATOM 25270 C CA . LEU E 1 310 ? -1.584 44.675 32.745 1.00 32.54 ? 310 LEU E CA 1 +ATOM 25271 C C . LEU E 1 310 ? -1.003 46.017 32.319 1.00 33.44 ? 310 LEU E C 1 +ATOM 25272 O O . LEU E 1 310 ? -0.387 46.127 31.253 1.00 32.47 ? 310 LEU E O 1 +ATOM 25273 C CB . LEU E 1 310 ? -2.992 44.534 32.141 1.00 30.62 ? 310 LEU E CB 1 +ATOM 25274 C CG . LEU E 1 310 ? -3.602 43.129 32.101 1.00 31.14 ? 310 LEU E CG 1 +ATOM 25275 C CD1 . LEU E 1 310 ? -5.023 43.195 31.559 1.00 28.07 ? 310 LEU E CD1 1 +ATOM 25276 C CD2 . LEU E 1 310 ? -2.726 42.219 31.231 1.00 29.42 ? 310 LEU E CD2 1 +ATOM 25277 N N . SER E 1 311 ? -1.191 47.032 33.162 1.00 33.99 ? 311 SER E N 1 +ATOM 25278 C CA . SER E 1 311 ? -0.724 48.373 32.858 1.00 35.76 ? 311 SER E CA 1 +ATOM 25279 C C . SER E 1 311 ? 0.788 48.538 32.724 1.00 37.25 ? 311 SER E C 1 +ATOM 25280 O O . SER E 1 311 ? 1.242 49.550 32.198 1.00 37.40 ? 311 SER E O 1 +ATOM 25281 C CB . SER E 1 311 ? -1.253 49.362 33.889 1.00 36.52 ? 311 SER E CB 1 +ATOM 25282 O OG . SER E 1 311 ? -0.517 49.270 35.094 1.00 41.70 ? 311 SER E OG 1 +ATOM 25283 N N . GLN E 1 312 ? 1.576 47.577 33.201 1.00 37.58 ? 312 GLN E N 1 +ATOM 25284 C CA . GLN E 1 312 ? 3.023 47.691 33.049 1.00 37.39 ? 312 GLN E CA 1 +ATOM 25285 C C . GLN E 1 312 ? 3.371 47.338 31.613 1.00 37.02 ? 312 GLN E C 1 +ATOM 25286 O O . GLN E 1 312 ? 4.503 47.569 31.176 1.00 36.76 ? 312 GLN E O 1 +ATOM 25287 C CB . GLN E 1 312 ? 3.794 46.709 33.929 1.00 39.50 ? 312 GLN E CB 1 +ATOM 25288 C CG . GLN E 1 312 ? 3.073 46.149 35.123 1.00 44.94 ? 312 GLN E CG 1 +ATOM 25289 C CD . GLN E 1 312 ? 3.801 44.936 35.684 1.00 45.57 ? 312 GLN E CD 1 +ATOM 25290 O OE1 . GLN E 1 312 ? 4.966 45.021 36.068 1.00 46.43 ? 312 GLN E OE1 1 +ATOM 25291 N NE2 . GLN E 1 312 ? 3.118 43.799 35.717 1.00 45.58 ? 312 GLN E NE2 1 +ATOM 25292 N N . GLY E 1 313 ? 2.412 46.750 30.893 1.00 34.82 ? 313 GLY E N 1 +ATOM 25293 C CA . GLY E 1 313 ? 2.673 46.342 29.521 1.00 34.29 ? 313 GLY E CA 1 +ATOM 25294 C C . GLY E 1 313 ? 2.590 44.834 29.303 1.00 34.22 ? 313 GLY E C 1 +ATOM 25295 O O . GLY E 1 313 ? 2.942 44.333 28.233 1.00 35.65 ? 313 GLY E O 1 +ATOM 25296 N N . VAL E 1 314 ? 2.149 44.101 30.321 1.00 32.66 ? 314 VAL E N 1 +ATOM 25297 C CA . VAL E 1 314 ? 1.984 42.657 30.204 1.00 31.47 ? 314 VAL E CA 1 +ATOM 25298 C C . VAL E 1 314 ? 0.838 42.448 29.210 1.00 30.41 ? 314 VAL E C 1 +ATOM 25299 O O . VAL E 1 314 ? -0.209 43.059 29.339 1.00 28.74 ? 314 VAL E O 1 +ATOM 25300 C CB . VAL E 1 314 ? 1.624 42.023 31.572 1.00 32.53 ? 314 VAL E CB 1 +ATOM 25301 C CG1 . VAL E 1 314 ? 1.143 40.582 31.376 1.00 31.44 ? 314 VAL E CG1 1 +ATOM 25302 C CG2 . VAL E 1 314 ? 2.849 42.072 32.506 1.00 29.74 ? 314 VAL E CG2 1 +ATOM 25303 N N . ASP E 1 315 ? 1.038 41.564 28.240 1.00 30.16 ? 315 ASP E N 1 +ATOM 25304 C CA . ASP E 1 315 ? 0.053 41.323 27.189 1.00 30.67 ? 315 ASP E CA 1 +ATOM 25305 C C . ASP E 1 315 ? -0.990 40.238 27.408 1.00 31.43 ? 315 ASP E C 1 +ATOM 25306 O O . ASP E 1 315 ? -2.043 40.266 26.779 1.00 30.94 ? 315 ASP E O 1 +ATOM 25307 C CB . ASP E 1 315 ? 0.799 41.048 25.883 1.00 30.92 ? 315 ASP E CB 1 +ATOM 25308 C CG . ASP E 1 315 ? 1.778 42.156 25.540 1.00 34.74 ? 315 ASP E CG 1 +ATOM 25309 O OD1 . ASP E 1 315 ? 1.305 43.252 25.165 1.00 37.64 ? 315 ASP E OD1 1 +ATOM 25310 O OD2 . ASP E 1 315 ? 3.011 41.951 25.665 1.00 33.79 ? 315 ASP E OD2 1 +ATOM 25311 N N . GLY E 1 316 ? -0.703 39.278 28.283 1.00 32.57 ? 316 GLY E N 1 +ATOM 25312 C CA . GLY E 1 316 ? -1.656 38.210 28.522 1.00 31.77 ? 316 GLY E CA 1 +ATOM 25313 C C . GLY E 1 316 ? -1.553 37.589 29.899 1.00 31.68 ? 316 GLY E C 1 +ATOM 25314 O O . GLY E 1 316 ? -0.530 37.701 30.569 1.00 32.24 ? 316 GLY E O 1 +ATOM 25315 N N . ILE E 1 317 ? -2.630 36.939 30.321 1.00 30.69 ? 317 ILE E N 1 +ATOM 25316 C CA . ILE E 1 317 ? -2.675 36.286 31.617 1.00 30.88 ? 317 ILE E CA 1 +ATOM 25317 C C . ILE E 1 317 ? -2.826 34.768 31.461 1.00 31.04 ? 317 ILE E C 1 +ATOM 25318 O O . ILE E 1 317 ? -3.650 34.274 30.684 1.00 31.48 ? 317 ILE E O 1 +ATOM 25319 C CB . ILE E 1 317 ? -3.841 36.820 32.464 1.00 30.30 ? 317 ILE E CB 1 +ATOM 25320 C CG1 . ILE E 1 317 ? -3.708 38.337 32.636 1.00 30.03 ? 317 ILE E CG1 1 +ATOM 25321 C CG2 . ILE E 1 317 ? -3.852 36.127 33.829 1.00 28.88 ? 317 ILE E CG2 1 +ATOM 25322 C CD1 . ILE E 1 317 ? -2.479 38.771 33.404 1.00 28.86 ? 317 ILE E CD1 1 +ATOM 25323 N N . TRP E 1 318 ? -2.009 34.032 32.198 1.00 30.61 ? 318 TRP E N 1 +ATOM 25324 C CA . TRP E 1 318 ? -2.036 32.579 32.162 1.00 29.78 ? 318 TRP E CA 1 +ATOM 25325 C C . TRP E 1 318 ? -2.476 32.112 33.536 1.00 30.01 ? 318 TRP E C 1 +ATOM 25326 O O . TRP E 1 318 ? -1.706 32.175 34.487 1.00 30.80 ? 318 TRP E O 1 +ATOM 25327 C CB . TRP E 1 318 ? -0.640 32.072 31.803 1.00 29.14 ? 318 TRP E CB 1 +ATOM 25328 C CG . TRP E 1 318 ? -0.389 30.603 31.966 1.00 32.14 ? 318 TRP E CG 1 +ATOM 25329 C CD1 . TRP E 1 318 ? -1.314 29.609 32.066 1.00 33.02 ? 318 TRP E CD1 1 +ATOM 25330 C CD2 . TRP E 1 318 ? 0.892 29.965 32.017 1.00 32.09 ? 318 TRP E CD2 1 +ATOM 25331 N NE1 . TRP E 1 318 ? -0.688 28.392 32.176 1.00 33.26 ? 318 TRP E NE1 1 +ATOM 25332 C CE2 . TRP E 1 318 ? 0.667 28.584 32.147 1.00 32.19 ? 318 TRP E CE2 1 +ATOM 25333 C CE3 . TRP E 1 318 ? 2.214 30.435 31.967 1.00 34.59 ? 318 TRP E CE3 1 +ATOM 25334 C CZ2 . TRP E 1 318 ? 1.714 27.655 32.226 1.00 35.12 ? 318 TRP E CZ2 1 +ATOM 25335 C CZ3 . TRP E 1 318 ? 3.258 29.514 32.046 1.00 35.94 ? 318 TRP E CZ3 1 +ATOM 25336 C CH2 . TRP E 1 318 ? 2.999 28.136 32.174 1.00 34.54 ? 318 TRP E CH2 1 +ATOM 25337 N N . LEU E 1 319 ? -3.730 31.681 33.640 1.00 28.89 ? 319 LEU E N 1 +ATOM 25338 C CA . LEU E 1 319 ? -4.283 31.206 34.906 1.00 30.64 ? 319 LEU E CA 1 +ATOM 25339 C C . LEU E 1 319 ? -3.971 29.719 35.111 1.00 31.96 ? 319 LEU E C 1 +ATOM 25340 O O . LEU E 1 319 ? -4.391 28.869 34.314 1.00 32.82 ? 319 LEU E O 1 +ATOM 25341 C CB . LEU E 1 319 ? -5.801 31.414 34.929 1.00 28.78 ? 319 LEU E CB 1 +ATOM 25342 C CG . LEU E 1 319 ? -6.309 32.843 34.773 1.00 29.89 ? 319 LEU E CG 1 +ATOM 25343 C CD1 . LEU E 1 319 ? -7.840 32.846 34.713 1.00 30.84 ? 319 LEU E CD1 1 +ATOM 25344 C CD2 . LEU E 1 319 ? -5.827 33.685 35.931 1.00 27.41 ? 319 LEU E CD2 1 +ATOM 25345 N N . ASP E 1 320 ? -3.248 29.404 36.180 1.00 32.34 ? 320 ASP E N 1 +ATOM 25346 C CA . ASP E 1 320 ? -2.883 28.021 36.464 1.00 33.31 ? 320 ASP E CA 1 +ATOM 25347 C C . ASP E 1 320 ? -3.357 27.540 37.842 1.00 32.46 ? 320 ASP E C 1 +ATOM 25348 O O . ASP E 1 320 ? -3.703 28.350 38.702 1.00 32.27 ? 320 ASP E O 1 +ATOM 25349 C CB . ASP E 1 320 ? -1.365 27.879 36.339 1.00 35.87 ? 320 ASP E CB 1 +ATOM 25350 C CG . ASP E 1 320 ? -0.908 26.431 36.336 1.00 39.00 ? 320 ASP E CG 1 +ATOM 25351 O OD1 . ASP E 1 320 ? -1.657 25.578 35.827 1.00 41.29 ? 320 ASP E OD1 1 +ATOM 25352 O OD2 . ASP E 1 320 ? 0.207 26.146 36.829 1.00 42.41 ? 320 ASP E OD2 1 +ATOM 25353 N N . MET E 1 321 ? -3.397 26.224 38.029 1.00 30.84 ? 321 MET E N 1 +ATOM 25354 C CA . MET E 1 321 ? -3.792 25.626 39.308 1.00 31.98 ? 321 MET E CA 1 +ATOM 25355 C C . MET E 1 321 ? -5.204 26.021 39.749 1.00 31.16 ? 321 MET E C 1 +ATOM 25356 O O . MET E 1 321 ? -5.582 25.832 40.913 1.00 29.00 ? 321 MET E O 1 +ATOM 25357 C CB . MET E 1 321 ? -2.804 26.056 40.407 1.00 32.30 ? 321 MET E CB 1 +ATOM 25358 C CG . MET E 1 321 ? -1.320 25.946 40.043 1.00 34.40 ? 321 MET E CG 1 +ATOM 25359 S SD . MET E 1 321 ? -0.812 24.265 39.578 1.00 37.01 ? 321 MET E SD 1 +ATOM 25360 C CE . MET E 1 321 ? -1.181 23.364 41.101 1.00 37.61 ? 321 MET E CE 1 +ATOM 25361 N N . ASN E 1 322 ? -5.986 26.557 38.822 1.00 30.96 ? 322 ASN E N 1 +ATOM 25362 C CA . ASN E 1 322 ? -7.321 27.031 39.157 1.00 30.79 ? 322 ASN E CA 1 +ATOM 25363 C C . ASN E 1 322 ? -8.464 26.022 39.121 1.00 31.13 ? 322 ASN E C 1 +ATOM 25364 O O . ASN E 1 322 ? -9.592 26.384 38.801 1.00 32.13 ? 322 ASN E O 1 +ATOM 25365 C CB . ASN E 1 322 ? -7.653 28.231 38.268 1.00 31.17 ? 322 ASN E CB 1 +ATOM 25366 C CG . ASN E 1 322 ? -7.687 27.877 36.794 1.00 32.12 ? 322 ASN E CG 1 +ATOM 25367 O OD1 . ASN E 1 322 ? -7.051 26.917 36.362 1.00 32.13 ? 322 ASN E OD1 1 +ATOM 25368 N ND2 . ASN E 1 322 ? -8.424 28.664 36.009 1.00 31.46 ? 322 ASN E ND2 1 +ATOM 25369 N N . GLU E 1 323 ? -8.188 24.770 39.479 1.00 30.72 ? 323 GLU E N 1 +ATOM 25370 C CA . GLU E 1 323 ? -9.212 23.732 39.481 1.00 31.05 ? 323 GLU E CA 1 +ATOM 25371 C C . GLU E 1 323 ? -10.416 23.972 40.401 1.00 30.97 ? 323 GLU E C 1 +ATOM 25372 O O . GLU E 1 323 ? -11.542 23.658 40.026 1.00 31.29 ? 323 GLU E O 1 +ATOM 25373 C CB . GLU E 1 323 ? -8.600 22.371 39.817 1.00 31.99 ? 323 GLU E CB 1 +ATOM 25374 C CG . GLU E 1 323 ? -7.804 21.745 38.686 1.00 35.14 ? 323 GLU E CG 1 +ATOM 25375 C CD . GLU E 1 323 ? -6.591 22.567 38.292 1.00 36.36 ? 323 GLU E CD 1 +ATOM 25376 O OE1 . GLU E 1 323 ? -5.857 23.021 39.193 1.00 37.25 ? 323 GLU E OE1 1 +ATOM 25377 O OE2 . GLU E 1 323 ? -6.365 22.753 37.082 1.00 36.05 ? 323 GLU E OE2 1 +ATOM 25378 N N . PRO E 1 324 ? -10.209 24.529 41.609 1.00 29.61 ? 324 PRO E N 1 +ATOM 25379 C CA . PRO E 1 324 ? -8.969 24.991 42.248 1.00 29.90 ? 324 PRO E CA 1 +ATOM 25380 C C . PRO E 1 324 ? -8.198 23.891 42.997 1.00 31.18 ? 324 PRO E C 1 +ATOM 25381 O O . PRO E 1 324 ? -8.784 22.971 43.582 1.00 30.93 ? 324 PRO E O 1 +ATOM 25382 C CB . PRO E 1 324 ? -9.470 26.085 43.192 1.00 29.08 ? 324 PRO E CB 1 +ATOM 25383 C CG . PRO E 1 324 ? -10.740 25.475 43.712 1.00 27.22 ? 324 PRO E CG 1 +ATOM 25384 C CD . PRO E 1 324 ? -11.378 24.859 42.449 1.00 26.53 ? 324 PRO E CD 1 +ATOM 25385 N N . THR E 1 325 ? -6.877 24.014 42.994 1.00 31.08 ? 325 THR E N 1 +ATOM 25386 C CA . THR E 1 325 ? -6.014 23.049 43.646 1.00 30.21 ? 325 THR E CA 1 +ATOM 25387 C C . THR E 1 325 ? -5.467 23.555 44.976 1.00 31.21 ? 325 THR E C 1 +ATOM 25388 O O . THR E 1 325 ? -5.244 24.756 45.154 1.00 32.44 ? 325 THR E O 1 +ATOM 25389 C CB . THR E 1 325 ? -4.854 22.705 42.717 1.00 30.16 ? 325 THR E CB 1 +ATOM 25390 O OG1 . THR E 1 325 ? -5.370 22.025 41.573 1.00 31.17 ? 325 THR E OG1 1 +ATOM 25391 C CG2 . THR E 1 325 ? -3.819 21.825 43.411 1.00 30.56 ? 325 THR E CG2 1 +ATOM 25392 N N . ASP E 1 326 ? -5.278 22.627 45.910 1.00 30.90 ? 326 ASP E N 1 +ATOM 25393 C CA . ASP E 1 326 ? -4.723 22.916 47.227 1.00 31.61 ? 326 ASP E CA 1 +ATOM 25394 C C . ASP E 1 326 ? -3.879 21.714 47.675 1.00 32.97 ? 326 ASP E C 1 +ATOM 25395 O O . ASP E 1 326 ? -4.255 20.560 47.458 1.00 31.82 ? 326 ASP E O 1 +ATOM 25396 C CB . ASP E 1 326 ? -5.825 23.169 48.250 1.00 31.13 ? 326 ASP E CB 1 +ATOM 25397 C CG . ASP E 1 326 ? -5.268 23.381 49.654 1.00 33.52 ? 326 ASP E CG 1 +ATOM 25398 O OD1 . ASP E 1 326 ? -4.543 24.378 49.895 1.00 33.98 ? 326 ASP E OD1 1 +ATOM 25399 O OD2 . ASP E 1 326 ? -5.542 22.537 50.519 1.00 33.27 ? 326 ASP E OD2 1 +ATOM 25400 N N . PHE E 1 327 ? -2.749 21.978 48.320 1.00 33.92 ? 327 PHE E N 1 +ATOM 25401 C CA . PHE E 1 327 ? -1.869 20.897 48.745 1.00 33.93 ? 327 PHE E CA 1 +ATOM 25402 C C . PHE E 1 327 ? -1.789 20.646 50.244 1.00 34.65 ? 327 PHE E C 1 +ATOM 25403 O O . PHE E 1 327 ? -0.975 19.840 50.690 1.00 34.56 ? 327 PHE E O 1 +ATOM 25404 C CB . PHE E 1 327 ? -0.464 21.154 48.203 1.00 34.22 ? 327 PHE E CB 1 +ATOM 25405 C CG . PHE E 1 327 ? -0.378 21.096 46.708 1.00 35.95 ? 327 PHE E CG 1 +ATOM 25406 C CD1 . PHE E 1 327 ? -0.589 19.893 46.034 1.00 37.61 ? 327 PHE E CD1 1 +ATOM 25407 C CD2 . PHE E 1 327 ? -0.108 22.238 45.966 1.00 35.54 ? 327 PHE E CD2 1 +ATOM 25408 C CE1 . PHE E 1 327 ? -0.534 19.834 44.636 1.00 36.42 ? 327 PHE E CE1 1 +ATOM 25409 C CE2 . PHE E 1 327 ? -0.052 22.187 44.574 1.00 35.23 ? 327 PHE E CE2 1 +ATOM 25410 C CZ . PHE E 1 327 ? -0.265 20.986 43.911 1.00 35.00 ? 327 PHE E CZ 1 +ATOM 25411 N N . SER E 1 328 ? -2.629 21.309 51.028 1.00 34.35 ? 328 SER E N 1 +ATOM 25412 C CA . SER E 1 328 ? -2.559 21.115 52.465 1.00 36.29 ? 328 SER E CA 1 +ATOM 25413 C C . SER E 1 328 ? -2.817 19.670 52.905 1.00 38.02 ? 328 SER E C 1 +ATOM 25414 O O . SER E 1 328 ? -2.149 19.176 53.822 1.00 38.22 ? 328 SER E O 1 +ATOM 25415 C CB . SER E 1 328 ? -3.500 22.090 53.196 1.00 35.27 ? 328 SER E CB 1 +ATOM 25416 O OG . SER E 1 328 ? -4.848 21.930 52.804 1.00 36.18 ? 328 SER E OG 1 +ATOM 25417 N N . ARG E 1 329 ? -3.764 18.986 52.264 1.00 38.17 ? 329 ARG E N 1 +ATOM 25418 C CA . ARG E 1 329 ? -4.050 17.594 52.629 1.00 38.92 ? 329 ARG E CA 1 +ATOM 25419 C C . ARG E 1 329 ? -2.862 16.683 52.295 1.00 38.24 ? 329 ARG E C 1 +ATOM 25420 O O . ARG E 1 329 ? -2.461 15.851 53.098 1.00 37.04 ? 329 ARG E O 1 +ATOM 25421 C CB . ARG E 1 329 ? -5.296 17.081 51.897 1.00 41.48 ? 329 ARG E CB 1 +ATOM 25422 C CG . ARG E 1 329 ? -6.501 16.820 52.793 1.00 44.69 ? 329 ARG E CG 1 +ATOM 25423 C CD . ARG E 1 329 ? -7.577 17.882 52.635 1.00 44.72 ? 329 ARG E CD 1 +ATOM 25424 N NE . ARG E 1 329 ? -8.045 17.990 51.253 1.00 47.86 ? 329 ARG E NE 1 +ATOM 25425 C CZ . ARG E 1 329 ? -8.758 17.067 50.610 1.00 46.83 ? 329 ARG E CZ 1 +ATOM 25426 N NH1 . ARG E 1 329 ? -9.105 15.945 51.218 1.00 46.45 ? 329 ARG E NH1 1 +ATOM 25427 N NH2 . ARG E 1 329 ? -9.117 17.267 49.347 1.00 47.90 ? 329 ARG E NH2 1 +ATOM 25428 N N . ALA E 1 330 ? -2.309 16.841 51.099 1.00 38.43 ? 330 ALA E N 1 +ATOM 25429 C CA . ALA E 1 330 ? -1.180 16.035 50.673 1.00 38.86 ? 330 ALA E CA 1 +ATOM 25430 C C . ALA E 1 330 ? 0.003 16.243 51.608 1.00 40.88 ? 330 ALA E C 1 +ATOM 25431 O O . ALA E 1 330 ? 0.637 15.285 52.039 1.00 42.02 ? 330 ALA E O 1 +ATOM 25432 C CB . ALA E 1 330 ? -0.786 16.403 49.251 1.00 37.83 ? 330 ALA E CB 1 +ATOM 25433 N N . ILE E 1 331 ? 0.293 17.501 51.923 1.00 42.06 ? 331 ILE E N 1 +ATOM 25434 C CA . ILE E 1 331 ? 1.405 17.840 52.797 1.00 42.41 ? 331 ILE E CA 1 +ATOM 25435 C C . ILE E 1 331 ? 1.185 17.319 54.209 1.00 44.47 ? 331 ILE E C 1 +ATOM 25436 O O . ILE E 1 331 ? 2.124 16.903 54.882 1.00 44.89 ? 331 ILE E O 1 +ATOM 25437 C CB . ILE E 1 331 ? 1.628 19.363 52.800 1.00 40.95 ? 331 ILE E CB 1 +ATOM 25438 C CG1 . ILE E 1 331 ? 2.335 19.754 51.504 1.00 41.19 ? 331 ILE E CG1 1 +ATOM 25439 C CG2 . ILE E 1 331 ? 2.438 19.795 54.009 1.00 39.59 ? 331 ILE E CG2 1 +ATOM 25440 C CD1 . ILE E 1 331 ? 2.484 21.243 51.308 1.00 43.17 ? 331 ILE E CD1 1 +ATOM 25441 N N . GLU E 1 332 ? -0.063 17.330 54.649 1.00 46.38 ? 332 GLU E N 1 +ATOM 25442 C CA . GLU E 1 332 ? -0.415 16.841 55.972 1.00 49.09 ? 332 GLU E CA 1 +ATOM 25443 C C . GLU E 1 332 ? -0.049 15.352 56.064 1.00 49.62 ? 332 GLU E C 1 +ATOM 25444 O O . GLU E 1 332 ? 0.538 14.906 57.051 1.00 49.28 ? 332 GLU E O 1 +ATOM 25445 C CB . GLU E 1 332 ? -1.913 17.057 56.186 1.00 52.23 ? 332 GLU E CB 1 +ATOM 25446 C CG . GLU E 1 332 ? -2.443 16.748 57.562 1.00 59.01 ? 332 GLU E CG 1 +ATOM 25447 C CD . GLU E 1 332 ? -3.861 17.283 57.755 1.00 63.86 ? 332 GLU E CD 1 +ATOM 25448 O OE1 . GLU E 1 332 ? -4.739 16.950 56.923 1.00 66.31 ? 332 GLU E OE1 1 +ATOM 25449 O OE2 . GLU E 1 332 ? -4.098 18.036 58.732 1.00 65.53 ? 332 GLU E OE2 1 +ATOM 25450 N N . ILE E 1 333 ? -0.386 14.596 55.020 1.00 49.40 ? 333 ILE E N 1 +ATOM 25451 C CA . ILE E 1 333 ? -0.097 13.165 54.957 1.00 49.61 ? 333 ILE E CA 1 +ATOM 25452 C C . ILE E 1 333 ? 1.410 12.931 54.911 1.00 51.53 ? 333 ILE E C 1 +ATOM 25453 O O . ILE E 1 333 ? 1.944 12.065 55.600 1.00 51.40 ? 333 ILE E O 1 +ATOM 25454 C CB . ILE E 1 333 ? -0.723 12.536 53.700 1.00 48.29 ? 333 ILE E CB 1 +ATOM 25455 C CG1 . ILE E 1 333 ? -2.246 12.553 53.812 1.00 46.38 ? 333 ILE E CG1 1 +ATOM 25456 C CG2 . ILE E 1 333 ? -0.207 11.130 53.506 1.00 47.15 ? 333 ILE E CG2 1 +ATOM 25457 C CD1 . ILE E 1 333 ? -2.934 12.209 52.520 1.00 43.37 ? 333 ILE E CD1 1 +ATOM 25458 N N . ARG E 1 334 ? 2.092 13.716 54.092 1.00 53.73 ? 334 ARG E N 1 +ATOM 25459 C CA . ARG E 1 334 ? 3.529 13.593 53.952 1.00 56.96 ? 334 ARG E CA 1 +ATOM 25460 C C . ARG E 1 334 ? 4.277 13.915 55.251 1.00 58.32 ? 334 ARG E C 1 +ATOM 25461 O O . ARG E 1 334 ? 5.358 13.390 55.477 1.00 59.42 ? 334 ARG E O 1 +ATOM 25462 C CB . ARG E 1 334 ? 4.009 14.486 52.799 1.00 58.40 ? 334 ARG E CB 1 +ATOM 25463 C CG . ARG E 1 334 ? 5.512 14.482 52.565 1.00 62.04 ? 334 ARG E CG 1 +ATOM 25464 C CD . ARG E 1 334 ? 6.161 15.731 53.154 1.00 65.40 ? 334 ARG E CD 1 +ATOM 25465 N NE . ARG E 1 334 ? 6.100 16.873 52.241 1.00 68.04 ? 334 ARG E NE 1 +ATOM 25466 C CZ . ARG E 1 334 ? 6.337 18.135 52.597 1.00 69.00 ? 334 ARG E CZ 1 +ATOM 25467 N NH1 . ARG E 1 334 ? 6.648 18.426 53.856 1.00 69.03 ? 334 ARG E NH1 1 +ATOM 25468 N NH2 . ARG E 1 334 ? 6.272 19.105 51.693 1.00 68.60 ? 334 ARG E NH2 1 +ATOM 25469 N N . ASP E 1 335 ? 3.709 14.760 56.109 1.00 59.17 ? 335 ASP E N 1 +ATOM 25470 C CA . ASP E 1 335 ? 4.371 15.101 57.370 1.00 59.80 ? 335 ASP E CA 1 +ATOM 25471 C C . ASP E 1 335 ? 4.201 14.004 58.415 1.00 59.76 ? 335 ASP E C 1 +ATOM 25472 O O . ASP E 1 335 ? 5.129 13.692 59.159 1.00 60.51 ? 335 ASP E O 1 +ATOM 25473 C CB . ASP E 1 335 ? 3.821 16.406 57.961 1.00 61.45 ? 335 ASP E CB 1 +ATOM 25474 C CG . ASP E 1 335 ? 4.209 17.635 57.154 1.00 64.64 ? 335 ASP E CG 1 +ATOM 25475 O OD1 . ASP E 1 335 ? 5.217 17.578 56.408 1.00 66.30 ? 335 ASP E OD1 1 +ATOM 25476 O OD2 . ASP E 1 335 ? 3.507 18.669 57.283 1.00 65.44 ? 335 ASP E OD2 1 +ATOM 25477 N N . VAL E 1 336 ? 3.008 13.427 58.475 1.00 58.16 ? 336 VAL E N 1 +ATOM 25478 C CA . VAL E 1 336 ? 2.728 12.386 59.442 1.00 56.68 ? 336 VAL E CA 1 +ATOM 25479 C C . VAL E 1 336 ? 3.350 11.030 59.101 1.00 58.06 ? 336 VAL E C 1 +ATOM 25480 O O . VAL E 1 336 ? 3.789 10.315 59.994 1.00 57.68 ? 336 VAL E O 1 +ATOM 25481 C CB . VAL E 1 336 ? 1.208 12.217 59.622 1.00 55.51 ? 336 VAL E CB 1 +ATOM 25482 C CG1 . VAL E 1 336 ? 0.916 11.082 60.583 1.00 54.57 ? 336 VAL E CG1 1 +ATOM 25483 C CG2 . VAL E 1 336 ? 0.606 13.508 60.138 1.00 53.85 ? 336 VAL E CG2 1 +ATOM 25484 N N . LEU E 1 337 ? 3.402 10.678 57.820 1.00 58.70 ? 337 LEU E N 1 +ATOM 25485 C CA . LEU E 1 337 ? 3.955 9.385 57.425 1.00 59.71 ? 337 LEU E CA 1 +ATOM 25486 C C . LEU E 1 337 ? 5.261 9.491 56.647 1.00 61.61 ? 337 LEU E C 1 +ATOM 25487 O O . LEU E 1 337 ? 5.686 8.532 56.009 1.00 62.59 ? 337 LEU E O 1 +ATOM 25488 C CB . LEU E 1 337 ? 2.924 8.621 56.591 1.00 58.23 ? 337 LEU E CB 1 +ATOM 25489 C CG . LEU E 1 337 ? 1.531 8.505 57.214 1.00 58.13 ? 337 LEU E CG 1 +ATOM 25490 C CD1 . LEU E 1 337 ? 0.587 7.839 56.236 1.00 59.05 ? 337 LEU E CD1 1 +ATOM 25491 C CD2 . LEU E 1 337 ? 1.605 7.713 58.506 1.00 58.13 ? 337 LEU E CD2 1 +ATOM 25492 N N . SER E 1 338 ? 5.897 10.655 56.709 1.00 63.25 ? 338 SER E N 1 +ATOM 25493 C CA . SER E 1 338 ? 7.152 10.898 55.996 1.00 65.20 ? 338 SER E CA 1 +ATOM 25494 C C . SER E 1 338 ? 8.256 9.894 56.301 1.00 66.05 ? 338 SER E C 1 +ATOM 25495 O O . SER E 1 338 ? 9.070 9.566 55.436 1.00 66.91 ? 338 SER E O 1 +ATOM 25496 C CB . SER E 1 338 ? 7.682 12.296 56.322 1.00 66.22 ? 338 SER E CB 1 +ATOM 25497 O OG . SER E 1 338 ? 7.845 12.467 57.724 1.00 67.76 ? 338 SER E OG 1 +ATOM 25498 N N . SER E 1 339 ? 8.287 9.425 57.540 1.00 66.30 ? 339 SER E N 1 +ATOM 25499 C CA . SER E 1 339 ? 9.303 8.485 57.987 1.00 66.70 ? 339 SER E CA 1 +ATOM 25500 C C . SER E 1 339 ? 9.127 7.066 57.467 1.00 67.39 ? 339 SER E C 1 +ATOM 25501 O O . SER E 1 339 ? 10.112 6.391 57.177 1.00 67.70 ? 339 SER E O 1 +ATOM 25502 C CB . SER E 1 339 ? 9.310 8.449 59.500 1.00 66.23 ? 339 SER E CB 1 +ATOM 25503 O OG . SER E 1 339 ? 8.016 8.105 59.971 1.00 65.32 ? 339 SER E OG 1 +ATOM 25504 N N . LEU E 1 340 ? 7.883 6.604 57.367 1.00 68.16 ? 340 LEU E N 1 +ATOM 25505 C CA . LEU E 1 340 ? 7.627 5.253 56.882 1.00 68.89 ? 340 LEU E CA 1 +ATOM 25506 C C . LEU E 1 340 ? 8.139 5.028 55.465 1.00 69.22 ? 340 LEU E C 1 +ATOM 25507 O O . LEU E 1 340 ? 7.825 5.788 54.547 1.00 68.67 ? 340 LEU E O 1 +ATOM 25508 C CB . LEU E 1 340 ? 6.137 4.917 56.949 1.00 68.34 ? 340 LEU E CB 1 +ATOM 25509 C CG . LEU E 1 340 ? 5.629 4.484 58.323 1.00 68.85 ? 340 LEU E CG 1 +ATOM 25510 C CD1 . LEU E 1 340 ? 4.263 3.830 58.165 1.00 68.26 ? 340 LEU E CD1 1 +ATOM 25511 C CD2 . LEU E 1 340 ? 6.609 3.499 58.952 1.00 69.13 ? 340 LEU E CD2 1 +ATOM 25512 N N . PRO E 1 341 ? 8.940 3.967 55.276 1.00 69.53 ? 341 PRO E N 1 +ATOM 25513 C CA . PRO E 1 341 ? 9.523 3.603 53.983 1.00 70.10 ? 341 PRO E CA 1 +ATOM 25514 C C . PRO E 1 341 ? 8.503 2.976 53.036 1.00 70.69 ? 341 PRO E C 1 +ATOM 25515 O O . PRO E 1 341 ? 8.862 2.203 52.146 1.00 71.36 ? 341 PRO E O 1 +ATOM 25516 C CB . PRO E 1 341 ? 10.622 2.628 54.377 1.00 69.76 ? 341 PRO E CB 1 +ATOM 25517 C CG . PRO E 1 341 ? 9.990 1.901 55.519 1.00 70.04 ? 341 PRO E CG 1 +ATOM 25518 C CD . PRO E 1 341 ? 9.365 3.022 56.324 1.00 69.16 ? 341 PRO E CD 1 +ATOM 25519 N N . VAL E 1 342 ? 7.232 3.311 53.233 1.00 70.59 ? 342 VAL E N 1 +ATOM 25520 C CA . VAL E 1 342 ? 6.163 2.782 52.394 1.00 70.54 ? 342 VAL E CA 1 +ATOM 25521 C C . VAL E 1 342 ? 5.905 3.697 51.198 1.00 70.87 ? 342 VAL E C 1 +ATOM 25522 O O . VAL E 1 342 ? 6.523 4.751 51.063 1.00 70.95 ? 342 VAL E O 1 +ATOM 25523 C CB . VAL E 1 342 ? 4.850 2.615 53.202 1.00 70.37 ? 342 VAL E CB 1 +ATOM 25524 C CG1 . VAL E 1 342 ? 5.080 1.663 54.374 1.00 69.21 ? 342 VAL E CG1 1 +ATOM 25525 C CG2 . VAL E 1 342 ? 4.362 3.970 53.699 1.00 69.55 ? 342 VAL E CG2 1 +ATOM 25526 N N . GLN E 1 343 ? 4.991 3.292 50.329 1.00 71.52 ? 343 GLN E N 1 +ATOM 25527 C CA . GLN E 1 343 ? 4.677 4.084 49.151 1.00 72.68 ? 343 GLN E CA 1 +ATOM 25528 C C . GLN E 1 343 ? 3.239 4.574 49.224 1.00 72.74 ? 343 GLN E C 1 +ATOM 25529 O O . GLN E 1 343 ? 2.323 3.798 49.494 1.00 72.40 ? 343 GLN E O 1 +ATOM 25530 C CB . GLN E 1 343 ? 4.865 3.240 47.890 1.00 74.45 ? 343 GLN E CB 1 +ATOM 25531 C CG . GLN E 1 343 ? 5.095 4.043 46.621 1.00 76.28 ? 343 GLN E CG 1 +ATOM 25532 C CD . GLN E 1 343 ? 4.346 3.468 45.439 1.00 77.77 ? 343 GLN E CD 1 +ATOM 25533 O OE1 . GLN E 1 343 ? 4.279 2.249 45.266 1.00 78.32 ? 343 GLN E OE1 1 +ATOM 25534 N NE2 . GLN E 1 343 ? 3.782 4.345 44.612 1.00 77.93 ? 343 GLN E NE2 1 +ATOM 25535 N N . PHE E 1 344 ? 3.042 5.864 48.980 1.00 73.21 ? 344 PHE E N 1 +ATOM 25536 C CA . PHE E 1 344 ? 1.707 6.442 49.026 1.00 73.40 ? 344 PHE E CA 1 +ATOM 25537 C C . PHE E 1 344 ? 0.994 6.242 47.702 1.00 73.49 ? 344 PHE E C 1 +ATOM 25538 O O . PHE E 1 344 ? 1.577 6.437 46.638 1.00 72.72 ? 344 PHE E O 1 +ATOM 25539 C CB . PHE E 1 344 ? 1.786 7.937 49.318 1.00 73.39 ? 344 PHE E CB 1 +ATOM 25540 C CG . PHE E 1 344 ? 2.591 8.273 50.531 1.00 74.37 ? 344 PHE E CG 1 +ATOM 25541 C CD1 . PHE E 1 344 ? 2.174 7.864 51.790 1.00 74.84 ? 344 PHE E CD1 1 +ATOM 25542 C CD2 . PHE E 1 344 ? 3.771 8.998 50.414 1.00 74.34 ? 344 PHE E CD2 1 +ATOM 25543 C CE1 . PHE E 1 344 ? 2.921 8.173 52.917 1.00 75.64 ? 344 PHE E CE1 1 +ATOM 25544 C CE2 . PHE E 1 344 ? 4.525 9.313 51.530 1.00 74.59 ? 344 PHE E CE2 1 +ATOM 25545 C CZ . PHE E 1 344 ? 4.101 8.901 52.787 1.00 75.70 ? 344 PHE E CZ 1 +ATOM 25546 N N . ARG E 1 345 ? -0.269 5.844 47.767 1.00 74.67 ? 345 ARG E N 1 +ATOM 25547 C CA . ARG E 1 345 ? -1.048 5.660 46.552 1.00 75.84 ? 345 ARG E CA 1 +ATOM 25548 C C . ARG E 1 345 ? -1.258 7.071 46.028 1.00 75.28 ? 345 ARG E C 1 +ATOM 25549 O O . ARG E 1 345 ? -1.307 8.023 46.810 1.00 75.03 ? 345 ARG E O 1 +ATOM 25550 C CB . ARG E 1 345 ? -2.392 5.010 46.870 1.00 77.59 ? 345 ARG E CB 1 +ATOM 25551 C CG . ARG E 1 345 ? -3.271 5.847 47.772 1.00 80.80 ? 345 ARG E CG 1 +ATOM 25552 C CD . ARG E 1 345 ? -4.489 5.073 48.235 1.00 83.68 ? 345 ARG E CD 1 +ATOM 25553 N NE . ARG E 1 345 ? -5.332 5.896 49.098 1.00 87.07 ? 345 ARG E NE 1 +ATOM 25554 C CZ . ARG E 1 345 ? -6.347 5.430 49.819 1.00 88.33 ? 345 ARG E CZ 1 +ATOM 25555 N NH1 . ARG E 1 345 ? -6.649 4.137 49.783 1.00 88.50 ? 345 ARG E NH1 1 +ATOM 25556 N NH2 . ARG E 1 345 ? -7.055 6.257 50.581 1.00 88.35 ? 345 ARG E NH2 1 +ATOM 25557 N N . ASP E 1 346 ? -1.373 7.217 44.715 1.00 74.53 ? 346 ASP E N 1 +ATOM 25558 C CA . ASP E 1 346 ? -1.555 8.546 44.150 1.00 73.97 ? 346 ASP E CA 1 +ATOM 25559 C C . ASP E 1 346 ? -3.025 8.888 43.918 1.00 71.90 ? 346 ASP E C 1 +ATOM 25560 O O . ASP E 1 346 ? -3.540 8.748 42.804 1.00 72.34 ? 346 ASP E O 1 +ATOM 25561 C CB . ASP E 1 346 ? -0.775 8.681 42.836 1.00 75.71 ? 346 ASP E CB 1 +ATOM 25562 C CG . ASP E 1 346 ? -0.716 10.119 42.340 1.00 77.85 ? 346 ASP E CG 1 +ATOM 25563 O OD1 . ASP E 1 346 ? -1.789 10.740 42.170 1.00 79.34 ? 346 ASP E OD1 1 +ATOM 25564 O OD2 . ASP E 1 346 ? 0.404 10.630 42.119 1.00 78.52 ? 346 ASP E OD2 1 +ATOM 25565 N N . ASP E 1 347 ? -3.703 9.326 44.976 1.00 68.04 ? 347 ASP E N 1 +ATOM 25566 C CA . ASP E 1 347 ? -5.101 9.713 44.858 1.00 64.29 ? 347 ASP E CA 1 +ATOM 25567 C C . ASP E 1 347 ? -5.137 11.211 44.580 1.00 60.13 ? 347 ASP E C 1 +ATOM 25568 O O . ASP E 1 347 ? -4.918 12.035 45.473 1.00 59.23 ? 347 ASP E O 1 +ATOM 25569 C CB . ASP E 1 347 ? -5.871 9.386 46.141 1.00 66.46 ? 347 ASP E CB 1 +ATOM 25570 C CG . ASP E 1 347 ? -7.319 9.864 46.089 1.00 69.73 ? 347 ASP E CG 1 +ATOM 25571 O OD1 . ASP E 1 347 ? -7.923 9.819 44.990 1.00 71.08 ? 347 ASP E OD1 1 +ATOM 25572 O OD2 . ASP E 1 347 ? -7.859 10.274 47.144 1.00 70.36 ? 347 ASP E OD2 1 +ATOM 25573 N N . ARG E 1 348 ? -5.401 11.551 43.325 1.00 55.05 ? 348 ARG E N 1 +ATOM 25574 C CA . ARG E 1 348 ? -5.444 12.938 42.884 1.00 49.93 ? 348 ARG E CA 1 +ATOM 25575 C C . ARG E 1 348 ? -6.518 13.774 43.576 1.00 46.68 ? 348 ARG E C 1 +ATOM 25576 O O . ARG E 1 348 ? -6.350 14.978 43.749 1.00 44.24 ? 348 ARG E O 1 +ATOM 25577 C CB . ARG E 1 348 ? -5.632 12.974 41.371 1.00 49.44 ? 348 ARG E CB 1 +ATOM 25578 C CG . ARG E 1 348 ? -4.437 12.432 40.600 1.00 47.24 ? 348 ARG E CG 1 +ATOM 25579 C CD . ARG E 1 348 ? -3.412 13.519 40.376 1.00 47.91 ? 348 ARG E CD 1 +ATOM 25580 N NE . ARG E 1 348 ? -2.289 13.484 41.299 1.00 45.84 ? 348 ARG E NE 1 +ATOM 25581 C CZ . ARG E 1 348 ? -1.478 14.517 41.511 1.00 47.66 ? 348 ARG E CZ 1 +ATOM 25582 N NH1 . ARG E 1 348 ? -1.675 15.668 40.882 1.00 47.00 ? 348 ARG E NH1 1 +ATOM 25583 N NH2 . ARG E 1 348 ? -0.442 14.389 42.325 1.00 50.01 ? 348 ARG E NH2 1 +ATOM 25584 N N . LEU E 1 349 ? -7.610 13.139 43.981 1.00 43.32 ? 349 LEU E N 1 +ATOM 25585 C CA . LEU E 1 349 ? -8.674 13.862 44.657 1.00 42.91 ? 349 LEU E CA 1 +ATOM 25586 C C . LEU E 1 349 ? -8.192 14.536 45.944 1.00 40.29 ? 349 LEU E C 1 +ATOM 25587 O O . LEU E 1 349 ? -8.858 15.421 46.473 1.00 37.60 ? 349 LEU E O 1 +ATOM 25588 C CB . LEU E 1 349 ? -9.838 12.924 44.966 1.00 44.90 ? 349 LEU E CB 1 +ATOM 25589 C CG . LEU E 1 349 ? -10.587 12.421 43.729 1.00 46.87 ? 349 LEU E CG 1 +ATOM 25590 C CD1 . LEU E 1 349 ? -11.663 11.420 44.145 1.00 48.28 ? 349 LEU E CD1 1 +ATOM 25591 C CD2 . LEU E 1 349 ? -11.204 13.595 43.000 1.00 45.93 ? 349 LEU E CD2 1 +ATOM 25592 N N . VAL E 1 350 ? -7.026 14.129 46.433 1.00 38.35 ? 350 VAL E N 1 +ATOM 25593 C CA . VAL E 1 350 ? -6.490 14.720 47.651 1.00 38.80 ? 350 VAL E CA 1 +ATOM 25594 C C . VAL E 1 350 ? -6.061 16.173 47.420 1.00 37.16 ? 350 VAL E C 1 +ATOM 25595 O O . VAL E 1 350 ? -5.931 16.941 48.370 1.00 36.92 ? 350 VAL E O 1 +ATOM 25596 C CB . VAL E 1 350 ? -5.268 13.916 48.191 1.00 39.53 ? 350 VAL E CB 1 +ATOM 25597 C CG1 . VAL E 1 350 ? -4.053 14.140 47.302 1.00 40.82 ? 350 VAL E CG1 1 +ATOM 25598 C CG2 . VAL E 1 350 ? -4.951 14.336 49.615 1.00 39.38 ? 350 VAL E CG2 1 +ATOM 25599 N N . THR E 1 351 ? -5.841 16.546 46.163 1.00 36.88 ? 351 THR E N 1 +ATOM 25600 C CA . THR E 1 351 ? -5.427 17.911 45.841 1.00 37.53 ? 351 THR E CA 1 +ATOM 25601 C C . THR E 1 351 ? -6.585 18.892 45.623 1.00 37.02 ? 351 THR E C 1 +ATOM 25602 O O . THR E 1 351 ? -6.358 20.051 45.282 1.00 37.99 ? 351 THR E O 1 +ATOM 25603 C CB . THR E 1 351 ? -4.527 17.962 44.583 1.00 37.55 ? 351 THR E CB 1 +ATOM 25604 O OG1 . THR E 1 351 ? -5.303 17.635 43.424 1.00 39.26 ? 351 THR E OG1 1 +ATOM 25605 C CG2 . THR E 1 351 ? -3.372 16.991 44.714 1.00 37.27 ? 351 THR E CG2 1 +ATOM 25606 N N . THR E 1 352 ? -7.820 18.440 45.795 1.00 36.20 ? 352 THR E N 1 +ATOM 25607 C CA . THR E 1 352 ? -8.955 19.339 45.631 1.00 35.76 ? 352 THR E CA 1 +ATOM 25608 C C . THR E 1 352 ? -9.181 20.035 46.965 1.00 36.28 ? 352 THR E C 1 +ATOM 25609 O O . THR E 1 352 ? -8.569 19.669 47.964 1.00 37.74 ? 352 THR E O 1 +ATOM 25610 C CB . THR E 1 352 ? -10.243 18.585 45.276 1.00 34.82 ? 352 THR E CB 1 +ATOM 25611 O OG1 . THR E 1 352 ? -10.613 17.748 46.373 1.00 34.73 ? 352 THR E OG1 1 +ATOM 25612 C CG2 . THR E 1 352 ? -10.049 17.747 44.030 1.00 34.21 ? 352 THR E CG2 1 +ATOM 25613 N N . PHE E 1 353 ? -10.050 21.041 46.987 1.00 36.24 ? 353 PHE E N 1 +ATOM 25614 C CA . PHE E 1 353 ? -10.350 21.755 48.227 1.00 35.93 ? 353 PHE E CA 1 +ATOM 25615 C C . PHE E 1 353 ? -11.023 20.791 49.196 1.00 36.68 ? 353 PHE E C 1 +ATOM 25616 O O . PHE E 1 353 ? -11.695 19.849 48.781 1.00 36.79 ? 353 PHE E O 1 +ATOM 25617 C CB . PHE E 1 353 ? -11.302 22.939 47.961 1.00 34.80 ? 353 PHE E CB 1 +ATOM 25618 C CG . PHE E 1 353 ? -10.607 24.224 47.581 1.00 33.67 ? 353 PHE E CG 1 +ATOM 25619 C CD1 . PHE E 1 353 ? -9.267 24.233 47.181 1.00 31.01 ? 353 PHE E CD1 1 +ATOM 25620 C CD2 . PHE E 1 353 ? -11.303 25.431 47.607 1.00 32.80 ? 353 PHE E CD2 1 +ATOM 25621 C CE1 . PHE E 1 353 ? -8.635 25.425 46.814 1.00 30.49 ? 353 PHE E CE1 1 +ATOM 25622 C CE2 . PHE E 1 353 ? -10.678 26.622 47.243 1.00 31.39 ? 353 PHE E CE2 1 +ATOM 25623 C CZ . PHE E 1 353 ? -9.338 26.616 46.845 1.00 30.26 ? 353 PHE E CZ 1 +ATOM 25624 N N . PRO E 1 354 ? -10.837 21.002 50.502 1.00 37.38 ? 354 PRO E N 1 +ATOM 25625 C CA . PRO E 1 354 ? -11.453 20.134 51.504 1.00 38.68 ? 354 PRO E CA 1 +ATOM 25626 C C . PRO E 1 354 ? -12.975 20.247 51.402 1.00 39.95 ? 354 PRO E C 1 +ATOM 25627 O O . PRO E 1 354 ? -13.495 21.123 50.718 1.00 40.15 ? 354 PRO E O 1 +ATOM 25628 C CB . PRO E 1 354 ? -10.924 20.698 52.815 1.00 38.20 ? 354 PRO E CB 1 +ATOM 25629 C CG . PRO E 1 354 ? -9.584 21.236 52.432 1.00 38.62 ? 354 PRO E CG 1 +ATOM 25630 C CD . PRO E 1 354 ? -9.875 21.924 51.125 1.00 37.64 ? 354 PRO E CD 1 +ATOM 25631 N N . ASP E 1 355 ? -13.692 19.373 52.093 1.00 42.84 ? 355 ASP E N 1 +ATOM 25632 C CA . ASP E 1 355 ? -15.147 19.398 52.034 1.00 46.25 ? 355 ASP E CA 1 +ATOM 25633 C C . ASP E 1 355 ? -15.826 20.486 52.850 1.00 44.36 ? 355 ASP E C 1 +ATOM 25634 O O . ASP E 1 355 ? -16.967 20.852 52.568 1.00 45.84 ? 355 ASP E O 1 +ATOM 25635 C CB . ASP E 1 355 ? -15.714 18.036 52.442 1.00 51.22 ? 355 ASP E CB 1 +ATOM 25636 C CG . ASP E 1 355 ? -15.596 17.005 51.330 1.00 58.53 ? 355 ASP E CG 1 +ATOM 25637 O OD1 . ASP E 1 355 ? -16.209 17.215 50.252 1.00 61.16 ? 355 ASP E OD1 1 +ATOM 25638 O OD2 . ASP E 1 355 ? -14.888 15.986 51.532 1.00 62.58 ? 355 ASP E OD2 1 +ATOM 25639 N N . ASN E 1 356 ? -15.137 21.017 53.849 1.00 41.23 ? 356 ASN E N 1 +ATOM 25640 C CA . ASN E 1 356 ? -15.739 22.041 54.691 1.00 38.73 ? 356 ASN E CA 1 +ATOM 25641 C C . ASN E 1 356 ? -15.598 23.472 54.167 1.00 36.27 ? 356 ASN E C 1 +ATOM 25642 O O . ASN E 1 356 ? -15.920 24.412 54.883 1.00 35.07 ? 356 ASN E O 1 +ATOM 25643 C CB . ASN E 1 356 ? -15.161 21.945 56.097 1.00 38.14 ? 356 ASN E CB 1 +ATOM 25644 C CG . ASN E 1 356 ? -13.675 22.208 56.119 1.00 39.28 ? 356 ASN E CG 1 +ATOM 25645 O OD1 . ASN E 1 356 ? -12.975 21.939 55.140 1.00 37.96 ? 356 ASN E OD1 1 +ATOM 25646 N ND2 . ASN E 1 356 ? -13.178 22.726 57.238 1.00 38.53 ? 356 ASN E ND2 1 +ATOM 25647 N N . VAL E 1 357 ? -15.126 23.633 52.931 1.00 35.14 ? 357 VAL E N 1 +ATOM 25648 C CA . VAL E 1 357 ? -14.967 24.957 52.323 1.00 33.80 ? 357 VAL E CA 1 +ATOM 25649 C C . VAL E 1 357 ? -16.294 25.463 51.757 1.00 34.37 ? 357 VAL E C 1 +ATOM 25650 O O . VAL E 1 357 ? -17.027 24.711 51.129 1.00 34.27 ? 357 VAL E O 1 +ATOM 25651 C CB . VAL E 1 357 ? -13.919 24.936 51.182 1.00 32.44 ? 357 VAL E CB 1 +ATOM 25652 C CG1 . VAL E 1 357 ? -13.926 26.259 50.430 1.00 30.84 ? 357 VAL E CG1 1 +ATOM 25653 C CG2 . VAL E 1 357 ? -12.536 24.692 51.760 1.00 31.20 ? 357 VAL E CG2 1 +ATOM 25654 N N . VAL E 1 358 ? -16.591 26.742 51.985 1.00 35.38 ? 358 VAL E N 1 +ATOM 25655 C CA . VAL E 1 358 ? -17.834 27.347 51.507 1.00 36.96 ? 358 VAL E CA 1 +ATOM 25656 C C . VAL E 1 358 ? -17.613 28.627 50.705 1.00 37.38 ? 358 VAL E C 1 +ATOM 25657 O O . VAL E 1 358 ? -16.587 29.306 50.847 1.00 38.53 ? 358 VAL E O 1 +ATOM 25658 C CB . VAL E 1 358 ? -18.792 27.675 52.683 1.00 36.89 ? 358 VAL E CB 1 +ATOM 25659 C CG1 . VAL E 1 358 ? -19.118 26.408 53.451 1.00 34.99 ? 358 VAL E CG1 1 +ATOM 25660 C CG2 . VAL E 1 358 ? -18.153 28.702 53.607 1.00 34.79 ? 358 VAL E CG2 1 +ATOM 25661 N N . HIS E 1 359 ? -18.592 28.953 49.868 1.00 37.77 ? 359 HIS E N 1 +ATOM 25662 C CA . HIS E 1 359 ? -18.536 30.144 49.023 1.00 37.13 ? 359 HIS E CA 1 +ATOM 25663 C C . HIS E 1 359 ? -19.870 30.871 49.138 1.00 37.41 ? 359 HIS E C 1 +ATOM 25664 O O . HIS E 1 359 ? -20.831 30.331 49.684 1.00 35.23 ? 359 HIS E O 1 +ATOM 25665 C CB . HIS E 1 359 ? -18.336 29.754 47.553 1.00 36.45 ? 359 HIS E CB 1 +ATOM 25666 C CG . HIS E 1 359 ? -17.098 28.956 47.293 1.00 38.84 ? 359 HIS E CG 1 +ATOM 25667 N ND1 . HIS E 1 359 ? -15.842 29.525 47.226 1.00 39.33 ? 359 HIS E ND1 1 +ATOM 25668 C CD2 . HIS E 1 359 ? -16.924 27.631 47.072 1.00 37.99 ? 359 HIS E CD2 1 +ATOM 25669 C CE1 . HIS E 1 359 ? -14.950 28.583 46.973 1.00 38.96 ? 359 HIS E CE1 1 +ATOM 25670 N NE2 . HIS E 1 359 ? -15.580 27.426 46.874 1.00 38.63 ? 359 HIS E NE2 1 +ATOM 25671 N N . TYR E 1 360 ? -19.914 32.099 48.630 1.00 38.69 ? 360 TYR E N 1 +ATOM 25672 C CA . TYR E 1 360 ? -21.148 32.874 48.618 1.00 39.63 ? 360 TYR E CA 1 +ATOM 25673 C C . TYR E 1 360 ? -21.499 33.111 47.162 1.00 38.98 ? 360 TYR E C 1 +ATOM 25674 O O . TYR E 1 360 ? -20.870 33.913 46.477 1.00 39.46 ? 360 TYR E O 1 +ATOM 25675 C CB . TYR E 1 360 ? -20.988 34.206 49.349 1.00 41.58 ? 360 TYR E CB 1 +ATOM 25676 C CG . TYR E 1 360 ? -20.911 34.044 50.848 1.00 45.43 ? 360 TYR E CG 1 +ATOM 25677 C CD1 . TYR E 1 360 ? -19.684 33.813 51.481 1.00 47.74 ? 360 TYR E CD1 1 +ATOM 25678 C CD2 . TYR E 1 360 ? -22.068 34.062 51.630 1.00 44.85 ? 360 TYR E CD2 1 +ATOM 25679 C CE1 . TYR E 1 360 ? -19.612 33.598 52.856 1.00 49.68 ? 360 TYR E CE1 1 +ATOM 25680 C CE2 . TYR E 1 360 ? -22.008 33.850 52.999 1.00 47.59 ? 360 TYR E CE2 1 +ATOM 25681 C CZ . TYR E 1 360 ? -20.777 33.615 53.608 1.00 50.12 ? 360 TYR E CZ 1 +ATOM 25682 O OH . TYR E 1 360 ? -20.707 33.374 54.966 1.00 52.75 ? 360 TYR E OH 1 +ATOM 25683 N N . LEU E 1 361 ? -22.491 32.372 46.685 1.00 38.90 ? 361 LEU E N 1 +ATOM 25684 C CA . LEU E 1 361 ? -22.929 32.487 45.311 1.00 37.84 ? 361 LEU E CA 1 +ATOM 25685 C C . LEU E 1 361 ? -24.246 33.233 45.308 1.00 37.89 ? 361 LEU E C 1 +ATOM 25686 O O . LEU E 1 361 ? -25.202 32.815 45.958 1.00 37.24 ? 361 LEU E O 1 +ATOM 25687 C CB . LEU E 1 361 ? -23.101 31.097 44.707 1.00 37.69 ? 361 LEU E CB 1 +ATOM 25688 C CG . LEU E 1 361 ? -23.596 31.037 43.264 1.00 37.19 ? 361 LEU E CG 1 +ATOM 25689 C CD1 . LEU E 1 361 ? -22.637 31.774 42.353 1.00 35.80 ? 361 LEU E CD1 1 +ATOM 25690 C CD2 . LEU E 1 361 ? -23.725 29.582 42.852 1.00 36.48 ? 361 LEU E CD2 1 +ATOM 25691 N N . ARG E 1 362 ? -24.285 34.346 44.584 1.00 38.85 ? 362 ARG E N 1 +ATOM 25692 C CA . ARG E 1 362 ? -25.487 35.171 44.499 1.00 38.36 ? 362 ARG E CA 1 +ATOM 25693 C C . ARG E 1 362 ? -26.094 35.384 45.884 1.00 39.28 ? 362 ARG E C 1 +ATOM 25694 O O . ARG E 1 362 ? -27.299 35.215 46.095 1.00 38.46 ? 362 ARG E O 1 +ATOM 25695 C CB . ARG E 1 362 ? -26.501 34.529 43.551 1.00 35.51 ? 362 ARG E CB 1 +ATOM 25696 C CG . ARG E 1 362 ? -25.998 34.455 42.108 1.00 35.74 ? 362 ARG E CG 1 +ATOM 25697 C CD . ARG E 1 362 ? -27.105 34.085 41.115 1.00 32.97 ? 362 ARG E CD 1 +ATOM 25698 N NE . ARG E 1 362 ? -27.704 32.781 41.388 1.00 35.37 ? 362 ARG E NE 1 +ATOM 25699 C CZ . ARG E 1 362 ? -27.148 31.608 41.095 1.00 36.14 ? 362 ARG E CZ 1 +ATOM 25700 N NH1 . ARG E 1 362 ? -25.957 31.552 40.504 1.00 35.35 ? 362 ARG E NH1 1 +ATOM 25701 N NH2 . ARG E 1 362 ? -27.789 30.484 41.396 1.00 36.32 ? 362 ARG E NH2 1 +ATOM 25702 N N . GLY E 1 363 ? -25.227 35.740 46.828 1.00 40.96 ? 363 GLY E N 1 +ATOM 25703 C CA . GLY E 1 363 ? -25.656 35.996 48.193 1.00 43.21 ? 363 GLY E CA 1 +ATOM 25704 C C . GLY E 1 363 ? -25.924 34.788 49.070 1.00 43.72 ? 363 GLY E C 1 +ATOM 25705 O O . GLY E 1 363 ? -26.112 34.935 50.274 1.00 44.91 ? 363 GLY E O 1 +ATOM 25706 N N . LYS E 1 364 ? -25.944 33.596 48.483 1.00 44.58 ? 364 LYS E N 1 +ATOM 25707 C CA . LYS E 1 364 ? -26.212 32.382 49.249 1.00 44.68 ? 364 LYS E CA 1 +ATOM 25708 C C . LYS E 1 364 ? -24.929 31.608 49.586 1.00 44.00 ? 364 LYS E C 1 +ATOM 25709 O O . LYS E 1 364 ? -24.007 31.511 48.777 1.00 41.63 ? 364 LYS E O 1 +ATOM 25710 C CB . LYS E 1 364 ? -27.183 31.493 48.469 1.00 45.97 ? 364 LYS E CB 1 +ATOM 25711 C CG . LYS E 1 364 ? -27.586 30.215 49.178 1.00 49.74 ? 364 LYS E CG 1 +ATOM 25712 C CD . LYS E 1 364 ? -28.558 29.406 48.331 1.00 51.65 ? 364 LYS E CD 1 +ATOM 25713 C CE . LYS E 1 364 ? -29.028 28.162 49.070 1.00 53.55 ? 364 LYS E CE 1 +ATOM 25714 N NZ . LYS E 1 364 ? -29.996 27.386 48.253 1.00 55.69 ? 364 LYS E NZ 1 +ATOM 25715 N N . ARG E 1 365 ? -24.886 31.071 50.798 1.00 43.87 ? 365 ARG E N 1 +ATOM 25716 C CA . ARG E 1 365 ? -23.746 30.300 51.282 1.00 44.24 ? 365 ARG E CA 1 +ATOM 25717 C C . ARG E 1 365 ? -23.886 28.858 50.793 1.00 43.53 ? 365 ARG E C 1 +ATOM 25718 O O . ARG E 1 365 ? -24.859 28.182 51.122 1.00 43.89 ? 365 ARG E O 1 +ATOM 25719 C CB . ARG E 1 365 ? -23.738 30.347 52.804 1.00 45.68 ? 365 ARG E CB 1 +ATOM 25720 C CG . ARG E 1 365 ? -22.467 29.893 53.470 1.00 48.89 ? 365 ARG E CG 1 +ATOM 25721 C CD . ARG E 1 365 ? -22.363 30.589 54.825 1.00 53.36 ? 365 ARG E CD 1 +ATOM 25722 N NE . ARG E 1 365 ? -21.438 29.930 55.740 1.00 56.18 ? 365 ARG E NE 1 +ATOM 25723 C CZ . ARG E 1 365 ? -21.625 28.708 56.230 1.00 58.80 ? 365 ARG E CZ 1 +ATOM 25724 N NH1 . ARG E 1 365 ? -22.707 28.008 55.891 1.00 60.20 ? 365 ARG E NH1 1 +ATOM 25725 N NH2 . ARG E 1 365 ? -20.733 28.184 57.059 1.00 58.49 ? 365 ARG E NH2 1 +ATOM 25726 N N . VAL E 1 366 ? -22.918 28.395 50.003 1.00 41.55 ? 366 VAL E N 1 +ATOM 25727 C CA . VAL E 1 366 ? -22.953 27.045 49.450 1.00 39.84 ? 366 VAL E CA 1 +ATOM 25728 C C . VAL E 1 366 ? -21.656 26.264 49.675 1.00 38.77 ? 366 VAL E C 1 +ATOM 25729 O O . VAL E 1 366 ? -20.577 26.849 49.808 1.00 37.54 ? 366 VAL E O 1 +ATOM 25730 C CB . VAL E 1 366 ? -23.227 27.081 47.920 1.00 40.34 ? 366 VAL E CB 1 +ATOM 25731 C CG1 . VAL E 1 366 ? -24.566 27.734 47.643 1.00 40.29 ? 366 VAL E CG1 1 +ATOM 25732 C CG2 . VAL E 1 366 ? -22.120 27.848 47.209 1.00 39.42 ? 366 VAL E CG2 1 +ATOM 25733 N N . LYS E 1 367 ? -21.768 24.940 49.706 1.00 37.30 ? 367 LYS E N 1 +ATOM 25734 C CA . LYS E 1 367 ? -20.606 24.079 49.895 1.00 36.58 ? 367 LYS E CA 1 +ATOM 25735 C C . LYS E 1 367 ? -19.776 24.026 48.619 1.00 35.77 ? 367 LYS E C 1 +ATOM 25736 O O . LYS E 1 367 ? -20.318 24.023 47.496 1.00 32.32 ? 367 LYS E O 1 +ATOM 25737 C CB . LYS E 1 367 ? -21.027 22.660 50.265 1.00 39.05 ? 367 LYS E CB 1 +ATOM 25738 C CG . LYS E 1 367 ? -21.617 22.514 51.652 1.00 43.63 ? 367 LYS E CG 1 +ATOM 25739 C CD . LYS E 1 367 ? -21.937 21.058 51.933 1.00 47.58 ? 367 LYS E CD 1 +ATOM 25740 C CE . LYS E 1 367 ? -22.451 20.862 53.350 1.00 51.92 ? 367 LYS E CE 1 +ATOM 25741 N NZ . LYS E 1 367 ? -22.649 19.411 53.660 1.00 55.30 ? 367 LYS E NZ 1 +ATOM 25742 N N . HIS E 1 368 ? -18.459 23.975 48.800 1.00 32.28 ? 368 HIS E N 1 +ATOM 25743 C CA . HIS E 1 368 ? -17.546 23.936 47.676 1.00 32.02 ? 368 HIS E CA 1 +ATOM 25744 C C . HIS E 1 368 ? -17.830 22.775 46.728 1.00 32.00 ? 368 HIS E C 1 +ATOM 25745 O O . HIS E 1 368 ? -17.705 22.920 45.517 1.00 31.44 ? 368 HIS E O 1 +ATOM 25746 C CB . HIS E 1 368 ? -16.102 23.847 48.173 1.00 31.76 ? 368 HIS E CB 1 +ATOM 25747 C CG . HIS E 1 368 ? -15.102 23.733 47.069 1.00 31.12 ? 368 HIS E CG 1 +ATOM 25748 N ND1 . HIS E 1 368 ? -14.736 24.805 46.285 1.00 30.59 ? 368 HIS E ND1 1 +ATOM 25749 C CD2 . HIS E 1 368 ? -14.459 22.655 46.560 1.00 30.30 ? 368 HIS E CD2 1 +ATOM 25750 C CE1 . HIS E 1 368 ? -13.912 24.391 45.338 1.00 31.87 ? 368 HIS E CE1 1 +ATOM 25751 N NE2 . HIS E 1 368 ? -13.729 23.090 45.482 1.00 31.13 ? 368 HIS E NE2 1 +ATOM 25752 N N . GLU E 1 369 ? -18.216 21.630 47.277 1.00 33.11 ? 369 GLU E N 1 +ATOM 25753 C CA . GLU E 1 369 ? -18.489 20.453 46.465 1.00 35.53 ? 369 GLU E CA 1 +ATOM 25754 C C . GLU E 1 369 ? -19.698 20.594 45.557 1.00 35.21 ? 369 GLU E C 1 +ATOM 25755 O O . GLU E 1 369 ? -19.844 19.826 44.613 1.00 33.95 ? 369 GLU E O 1 +ATOM 25756 C CB . GLU E 1 369 ? -18.660 19.217 47.350 1.00 39.01 ? 369 GLU E CB 1 +ATOM 25757 C CG . GLU E 1 369 ? -19.808 19.303 48.325 1.00 47.91 ? 369 GLU E CG 1 +ATOM 25758 C CD . GLU E 1 369 ? -19.833 18.131 49.286 1.00 53.52 ? 369 GLU E CD 1 +ATOM 25759 O OE1 . GLU E 1 369 ? -20.277 17.027 48.889 1.00 56.21 ? 369 GLU E OE1 1 +ATOM 25760 O OE2 . GLU E 1 369 ? -19.390 18.314 50.442 1.00 57.74 ? 369 GLU E OE2 1 +ATOM 25761 N N . LYS E 1 370 ? -20.565 21.562 45.842 1.00 35.19 ? 370 LYS E N 1 +ATOM 25762 C CA . LYS E 1 370 ? -21.748 21.776 45.019 1.00 35.86 ? 370 LYS E CA 1 +ATOM 25763 C C . LYS E 1 370 ? -21.429 22.639 43.806 1.00 35.17 ? 370 LYS E C 1 +ATOM 25764 O O . LYS E 1 370 ? -22.054 22.493 42.759 1.00 34.80 ? 370 LYS E O 1 +ATOM 25765 C CB . LYS E 1 370 ? -22.862 22.464 45.818 1.00 38.63 ? 370 LYS E CB 1 +ATOM 25766 C CG . LYS E 1 370 ? -23.422 21.651 46.983 1.00 44.88 ? 370 LYS E CG 1 +ATOM 25767 C CD . LYS E 1 370 ? -24.160 20.400 46.500 1.00 50.76 ? 370 LYS E CD 1 +ATOM 25768 C CE . LYS E 1 370 ? -24.788 19.647 47.670 1.00 54.76 ? 370 LYS E CE 1 +ATOM 25769 N NZ . LYS E 1 370 ? -23.764 19.236 48.690 1.00 56.22 ? 370 LYS E NZ 1 +ATOM 25770 N N . VAL E 1 371 ? -20.442 23.519 43.938 1.00 33.31 ? 371 VAL E N 1 +ATOM 25771 C CA . VAL E 1 371 ? -20.097 24.437 42.856 1.00 31.78 ? 371 VAL E CA 1 +ATOM 25772 C C . VAL E 1 371 ? -18.638 24.431 42.406 1.00 31.44 ? 371 VAL E C 1 +ATOM 25773 O O . VAL E 1 371 ? -18.229 25.256 41.592 1.00 31.58 ? 371 VAL E O 1 +ATOM 25774 C CB . VAL E 1 371 ? -20.466 25.879 43.272 1.00 32.34 ? 371 VAL E CB 1 +ATOM 25775 C CG1 . VAL E 1 371 ? -21.928 25.934 43.681 1.00 28.23 ? 371 VAL E CG1 1 +ATOM 25776 C CG2 . VAL E 1 371 ? -19.578 26.334 44.435 1.00 30.37 ? 371 VAL E CG2 1 +ATOM 25777 N N . ARG E 1 372 ? -17.859 23.489 42.919 1.00 31.28 ? 372 ARG E N 1 +ATOM 25778 C CA . ARG E 1 372 ? -16.443 23.406 42.599 1.00 29.23 ? 372 ARG E CA 1 +ATOM 25779 C C . ARG E 1 372 ? -16.014 23.692 41.168 1.00 29.70 ? 372 ARG E C 1 +ATOM 25780 O O . ARG E 1 372 ? -15.168 24.554 40.934 1.00 30.00 ? 372 ARG E O 1 +ATOM 25781 C CB . ARG E 1 372 ? -15.883 22.034 42.994 1.00 28.34 ? 372 ARG E CB 1 +ATOM 25782 C CG . ARG E 1 372 ? -14.427 21.852 42.582 1.00 28.24 ? 372 ARG E CG 1 +ATOM 25783 C CD . ARG E 1 372 ? -13.811 20.561 43.096 1.00 27.78 ? 372 ARG E CD 1 +ATOM 25784 N NE . ARG E 1 372 ? -12.456 20.405 42.575 1.00 28.10 ? 372 ARG E NE 1 +ATOM 25785 C CZ . ARG E 1 372 ? -11.375 21.020 43.055 1.00 27.13 ? 372 ARG E CZ 1 +ATOM 25786 N NH1 . ARG E 1 372 ? -11.463 21.840 44.094 1.00 23.72 ? 372 ARG E NH1 1 +ATOM 25787 N NH2 . ARG E 1 372 ? -10.197 20.828 42.470 1.00 27.33 ? 372 ARG E NH2 1 +ATOM 25788 N N . ASN E 1 373 ? -16.576 22.967 40.210 1.00 28.17 ? 373 ASN E N 1 +ATOM 25789 C CA . ASN E 1 373 ? -16.147 23.122 38.830 1.00 28.98 ? 373 ASN E CA 1 +ATOM 25790 C C . ASN E 1 373 ? -16.298 24.497 38.203 1.00 30.09 ? 373 ASN E C 1 +ATOM 25791 O O . ASN E 1 373 ? -15.615 24.816 37.225 1.00 29.85 ? 373 ASN E O 1 +ATOM 25792 C CB . ASN E 1 373 ? -16.821 22.067 37.960 1.00 29.70 ? 373 ASN E CB 1 +ATOM 25793 C CG . ASN E 1 373 ? -16.534 20.661 38.447 1.00 31.56 ? 373 ASN E CG 1 +ATOM 25794 O OD1 . ASN E 1 373 ? -15.458 20.400 39.001 1.00 31.36 ? 373 ASN E OD1 1 +ATOM 25795 N ND2 . ASN E 1 373 ? -17.484 19.743 38.242 1.00 27.86 ? 373 ASN E ND2 1 +ATOM 25796 N N . ALA E 1 374 ? -17.168 25.325 38.764 1.00 30.13 ? 374 ALA E N 1 +ATOM 25797 C CA . ALA E 1 374 ? -17.372 26.652 38.213 1.00 30.76 ? 374 ALA E CA 1 +ATOM 25798 C C . ALA E 1 374 ? -16.341 27.667 38.724 1.00 30.84 ? 374 ALA E C 1 +ATOM 25799 O O . ALA E 1 374 ? -16.281 28.795 38.230 1.00 30.18 ? 374 ALA E O 1 +ATOM 25800 C CB . ALA E 1 374 ? -18.785 27.127 38.529 1.00 30.38 ? 374 ALA E CB 1 +ATOM 25801 N N . TYR E 1 375 ? -15.524 27.268 39.697 1.00 30.53 ? 375 TYR E N 1 +ATOM 25802 C CA . TYR E 1 375 ? -14.516 28.165 40.262 1.00 30.43 ? 375 TYR E CA 1 +ATOM 25803 C C . TYR E 1 375 ? -13.620 28.791 39.183 1.00 29.87 ? 375 TYR E C 1 +ATOM 25804 O O . TYR E 1 375 ? -13.469 30.000 39.118 1.00 29.43 ? 375 TYR E O 1 +ATOM 25805 C CB . TYR E 1 375 ? -13.655 27.419 41.286 1.00 31.59 ? 375 TYR E CB 1 +ATOM 25806 C CG . TYR E 1 375 ? -12.700 28.304 42.067 1.00 30.58 ? 375 TYR E CG 1 +ATOM 25807 C CD1 . TYR E 1 375 ? -13.098 28.923 43.252 1.00 30.12 ? 375 TYR E CD1 1 +ATOM 25808 C CD2 . TYR E 1 375 ? -11.396 28.511 41.622 1.00 31.45 ? 375 TYR E CD2 1 +ATOM 25809 C CE1 . TYR E 1 375 ? -12.218 29.721 43.979 1.00 31.24 ? 375 TYR E CE1 1 +ATOM 25810 C CE2 . TYR E 1 375 ? -10.506 29.306 42.339 1.00 32.47 ? 375 TYR E CE2 1 +ATOM 25811 C CZ . TYR E 1 375 ? -10.920 29.907 43.518 1.00 33.00 ? 375 TYR E CZ 1 +ATOM 25812 O OH . TYR E 1 375 ? -10.030 30.678 44.241 1.00 33.04 ? 375 TYR E OH 1 +ATOM 25813 N N . PRO E 1 376 ? -13.011 27.972 38.324 1.00 30.49 ? 376 PRO E N 1 +ATOM 25814 C CA . PRO E 1 376 ? -12.156 28.560 37.287 1.00 31.65 ? 376 PRO E CA 1 +ATOM 25815 C C . PRO E 1 376 ? -12.922 29.482 36.336 1.00 32.72 ? 376 PRO E C 1 +ATOM 25816 O O . PRO E 1 376 ? -12.350 30.439 35.790 1.00 32.13 ? 376 PRO E O 1 +ATOM 25817 C CB . PRO E 1 376 ? -11.584 27.336 36.574 1.00 30.44 ? 376 PRO E CB 1 +ATOM 25818 C CG . PRO E 1 376 ? -12.673 26.318 36.742 1.00 30.45 ? 376 PRO E CG 1 +ATOM 25819 C CD . PRO E 1 376 ? -13.070 26.508 38.188 1.00 29.68 ? 376 PRO E CD 1 +ATOM 25820 N N . LEU E 1 377 ? -14.208 29.194 36.134 1.00 32.11 ? 377 LEU E N 1 +ATOM 25821 C CA . LEU E 1 377 ? -15.029 30.021 35.249 1.00 33.07 ? 377 LEU E CA 1 +ATOM 25822 C C . LEU E 1 377 ? -15.121 31.446 35.800 1.00 32.11 ? 377 LEU E C 1 +ATOM 25823 O O . LEU E 1 377 ? -14.938 32.409 35.064 1.00 32.38 ? 377 LEU E O 1 +ATOM 25824 C CB . LEU E 1 377 ? -16.446 29.434 35.100 1.00 31.30 ? 377 LEU E CB 1 +ATOM 25825 C CG . LEU E 1 377 ? -17.456 30.324 34.364 1.00 32.36 ? 377 LEU E CG 1 +ATOM 25826 C CD1 . LEU E 1 377 ? -17.053 30.471 32.896 1.00 30.47 ? 377 LEU E CD1 1 +ATOM 25827 C CD2 . LEU E 1 377 ? -18.851 29.721 34.467 1.00 32.57 ? 377 LEU E CD2 1 +ATOM 25828 N N . TYR E 1 378 ? -15.388 31.567 37.097 1.00 31.19 ? 378 TYR E N 1 +ATOM 25829 C CA . TYR E 1 378 ? -15.518 32.874 37.723 1.00 31.93 ? 378 TYR E CA 1 +ATOM 25830 C C . TYR E 1 378 ? -14.189 33.601 37.833 1.00 32.64 ? 378 TYR E C 1 +ATOM 25831 O O . TYR E 1 378 ? -14.148 34.830 37.804 1.00 33.33 ? 378 TYR E O 1 +ATOM 25832 C CB . TYR E 1 378 ? -16.190 32.744 39.091 1.00 30.77 ? 378 TYR E CB 1 +ATOM 25833 C CG . TYR E 1 378 ? -17.688 32.565 38.991 1.00 33.13 ? 378 TYR E CG 1 +ATOM 25834 C CD1 . TYR E 1 378 ? -18.520 33.643 38.678 1.00 34.59 ? 378 TYR E CD1 1 +ATOM 25835 C CD2 . TYR E 1 378 ? -18.275 31.315 39.169 1.00 34.18 ? 378 TYR E CD2 1 +ATOM 25836 C CE1 . TYR E 1 378 ? -19.901 33.479 38.542 1.00 34.70 ? 378 TYR E CE1 1 +ATOM 25837 C CE2 . TYR E 1 378 ? -19.655 31.134 39.034 1.00 35.68 ? 378 TYR E CE2 1 +ATOM 25838 C CZ . TYR E 1 378 ? -20.461 32.222 38.718 1.00 36.65 ? 378 TYR E CZ 1 +ATOM 25839 O OH . TYR E 1 378 ? -21.814 32.047 38.558 1.00 35.07 ? 378 TYR E OH 1 +ATOM 25840 N N . GLU E 1 379 ? -13.097 32.853 37.949 1.00 33.53 ? 379 GLU E N 1 +ATOM 25841 C CA . GLU E 1 379 ? -11.786 33.484 38.012 1.00 33.08 ? 379 GLU E CA 1 +ATOM 25842 C C . GLU E 1 379 ? -11.479 34.064 36.629 1.00 31.65 ? 379 GLU E C 1 +ATOM 25843 O O . GLU E 1 379 ? -10.991 35.186 36.514 1.00 31.81 ? 379 GLU E O 1 +ATOM 25844 C CB . GLU E 1 379 ? -10.698 32.481 38.401 1.00 34.33 ? 379 GLU E CB 1 +ATOM 25845 C CG . GLU E 1 379 ? -9.293 33.084 38.369 1.00 36.88 ? 379 GLU E CG 1 +ATOM 25846 C CD . GLU E 1 379 ? -8.183 32.043 38.445 1.00 39.86 ? 379 GLU E CD 1 +ATOM 25847 O OE1 . GLU E 1 379 ? -8.316 30.977 37.803 1.00 41.05 ? 379 GLU E OE1 1 +ATOM 25848 O OE2 . GLU E 1 379 ? -7.166 32.296 39.132 1.00 41.13 ? 379 GLU E OE2 1 +ATOM 25849 N N . ALA E 1 380 ? -11.772 33.303 35.579 1.00 30.60 ? 380 ALA E N 1 +ATOM 25850 C CA . ALA E 1 380 ? -11.527 33.766 34.213 1.00 29.94 ? 380 ALA E CA 1 +ATOM 25851 C C . ALA E 1 380 ? -12.398 34.984 33.915 1.00 31.14 ? 380 ALA E C 1 +ATOM 25852 O O . ALA E 1 380 ? -11.962 35.920 33.249 1.00 31.42 ? 380 ALA E O 1 +ATOM 25853 C CB . ALA E 1 380 ? -11.827 32.660 33.222 1.00 28.33 ? 380 ALA E CB 1 +ATOM 25854 N N . MET E 1 381 ? -13.630 34.961 34.415 1.00 31.40 ? 381 MET E N 1 +ATOM 25855 C CA . MET E 1 381 ? -14.574 36.061 34.236 1.00 32.49 ? 381 MET E CA 1 +ATOM 25856 C C . MET E 1 381 ? -13.985 37.358 34.820 1.00 33.31 ? 381 MET E C 1 +ATOM 25857 O O . MET E 1 381 ? -13.983 38.404 34.169 1.00 33.17 ? 381 MET E O 1 +ATOM 25858 C CB . MET E 1 381 ? -15.889 35.721 34.949 1.00 32.87 ? 381 MET E CB 1 +ATOM 25859 C CG . MET E 1 381 ? -16.984 36.747 34.808 1.00 32.10 ? 381 MET E CG 1 +ATOM 25860 S SD . MET E 1 381 ? -18.443 36.303 35.785 1.00 39.59 ? 381 MET E SD 1 +ATOM 25861 C CE . MET E 1 381 ? -19.032 34.809 34.893 1.00 39.05 ? 381 MET E CE 1 +ATOM 25862 N N . ALA E 1 382 ? -13.497 37.274 36.057 1.00 33.38 ? 382 ALA E N 1 +ATOM 25863 C CA . ALA E 1 382 ? -12.904 38.416 36.741 1.00 32.49 ? 382 ALA E CA 1 +ATOM 25864 C C . ALA E 1 382 ? -11.638 38.879 36.033 1.00 32.62 ? 382 ALA E C 1 +ATOM 25865 O O . ALA E 1 382 ? -11.348 40.068 35.980 1.00 33.30 ? 382 ALA E O 1 +ATOM 25866 C CB . ALA E 1 382 ? -12.583 38.050 38.173 1.00 31.68 ? 382 ALA E CB 1 +ATOM 25867 N N . THR E 1 383 ? -10.881 37.938 35.490 1.00 32.30 ? 383 THR E N 1 +ATOM 25868 C CA . THR E 1 383 ? -9.655 38.281 34.791 1.00 32.45 ? 383 THR E CA 1 +ATOM 25869 C C . THR E 1 383 ? -9.980 38.980 33.474 1.00 32.76 ? 383 THR E C 1 +ATOM 25870 O O . THR E 1 383 ? -9.291 39.918 33.080 1.00 33.60 ? 383 THR E O 1 +ATOM 25871 C CB . THR E 1 383 ? -8.799 37.016 34.545 1.00 31.26 ? 383 THR E CB 1 +ATOM 25872 O OG1 . THR E 1 383 ? -8.526 36.393 35.805 1.00 30.64 ? 383 THR E OG1 1 +ATOM 25873 C CG2 . THR E 1 383 ? -7.473 37.368 33.880 1.00 27.10 ? 383 THR E CG2 1 +ATOM 25874 N N . PHE E 1 384 ? -11.034 38.524 32.807 1.00 33.63 ? 384 PHE E N 1 +ATOM 25875 C CA . PHE E 1 384 ? -11.472 39.116 31.548 1.00 34.62 ? 384 PHE E CA 1 +ATOM 25876 C C . PHE E 1 384 ? -11.913 40.552 31.851 1.00 34.92 ? 384 PHE E C 1 +ATOM 25877 O O . PHE E 1 384 ? -11.615 41.485 31.106 1.00 33.72 ? 384 PHE E O 1 +ATOM 25878 C CB . PHE E 1 384 ? -12.660 38.332 30.985 1.00 33.89 ? 384 PHE E CB 1 +ATOM 25879 C CG . PHE E 1 384 ? -13.009 38.687 29.571 1.00 32.86 ? 384 PHE E CG 1 +ATOM 25880 C CD1 . PHE E 1 384 ? -12.354 38.076 28.508 1.00 33.63 ? 384 PHE E CD1 1 +ATOM 25881 C CD2 . PHE E 1 384 ? -14.013 39.612 29.299 1.00 32.51 ? 384 PHE E CD2 1 +ATOM 25882 C CE1 . PHE E 1 384 ? -12.697 38.373 27.185 1.00 34.03 ? 384 PHE E CE1 1 +ATOM 25883 C CE2 . PHE E 1 384 ? -14.365 39.919 27.983 1.00 32.39 ? 384 PHE E CE2 1 +ATOM 25884 C CZ . PHE E 1 384 ? -13.708 39.297 26.924 1.00 32.50 ? 384 PHE E CZ 1 +ATOM 25885 N N . LYS E 1 385 ? -12.627 40.708 32.957 1.00 35.45 ? 385 LYS E N 1 +ATOM 25886 C CA . LYS E 1 385 ? -13.103 42.011 33.393 1.00 38.12 ? 385 LYS E CA 1 +ATOM 25887 C C . LYS E 1 385 ? -11.898 42.916 33.636 1.00 38.88 ? 385 LYS E C 1 +ATOM 25888 O O . LYS E 1 385 ? -11.978 44.128 33.469 1.00 39.12 ? 385 LYS E O 1 +ATOM 25889 C CB . LYS E 1 385 ? -13.920 41.846 34.671 1.00 38.52 ? 385 LYS E CB 1 +ATOM 25890 C CG . LYS E 1 385 ? -14.421 43.125 35.289 1.00 44.42 ? 385 LYS E CG 1 +ATOM 25891 C CD . LYS E 1 385 ? -15.149 42.818 36.605 1.00 49.13 ? 385 LYS E CD 1 +ATOM 25892 C CE . LYS E 1 385 ? -15.590 44.091 37.325 1.00 52.82 ? 385 LYS E CE 1 +ATOM 25893 N NZ . LYS E 1 385 ? -16.557 44.900 36.515 1.00 54.90 ? 385 LYS E NZ 1 +ATOM 25894 N N . GLY E 1 386 ? -10.775 42.310 34.022 1.00 39.74 ? 386 GLY E N 1 +ATOM 25895 C CA . GLY E 1 386 ? -9.559 43.066 34.268 1.00 38.88 ? 386 GLY E CA 1 +ATOM 25896 C C . GLY E 1 386 ? -9.025 43.676 32.985 1.00 39.20 ? 386 GLY E C 1 +ATOM 25897 O O . GLY E 1 386 ? -8.440 44.759 32.999 1.00 39.04 ? 386 GLY E O 1 +ATOM 25898 N N . PHE E 1 387 ? -9.213 42.980 31.869 1.00 39.38 ? 387 PHE E N 1 +ATOM 25899 C CA . PHE E 1 387 ? -8.759 43.497 30.583 1.00 39.04 ? 387 PHE E CA 1 +ATOM 25900 C C . PHE E 1 387 ? -9.635 44.674 30.161 1.00 39.90 ? 387 PHE E C 1 +ATOM 25901 O O . PHE E 1 387 ? -9.131 45.653 29.608 1.00 38.96 ? 387 PHE E O 1 +ATOM 25902 C CB . PHE E 1 387 ? -8.801 42.410 29.502 1.00 37.33 ? 387 PHE E CB 1 +ATOM 25903 C CG . PHE E 1 387 ? -7.572 41.542 29.467 1.00 35.97 ? 387 PHE E CG 1 +ATOM 25904 C CD1 . PHE E 1 387 ? -7.371 40.546 30.421 1.00 34.61 ? 387 PHE E CD1 1 +ATOM 25905 C CD2 . PHE E 1 387 ? -6.600 41.733 28.488 1.00 34.95 ? 387 PHE E CD2 1 +ATOM 25906 C CE1 . PHE E 1 387 ? -6.217 39.755 30.394 1.00 31.64 ? 387 PHE E CE1 1 +ATOM 25907 C CE2 . PHE E 1 387 ? -5.447 40.947 28.456 1.00 32.75 ? 387 PHE E CE2 1 +ATOM 25908 C CZ . PHE E 1 387 ? -5.258 39.958 29.411 1.00 31.80 ? 387 PHE E CZ 1 +ATOM 25909 N N . ARG E 1 388 ? -10.938 44.567 30.421 1.00 40.26 ? 388 ARG E N 1 +ATOM 25910 C CA . ARG E 1 388 ? -11.888 45.618 30.086 1.00 42.39 ? 388 ARG E CA 1 +ATOM 25911 C C . ARG E 1 388 ? -11.548 46.878 30.873 1.00 43.97 ? 388 ARG E C 1 +ATOM 25912 O O . ARG E 1 388 ? -11.520 47.980 30.323 1.00 44.39 ? 388 ARG E O 1 +ATOM 25913 C CB . ARG E 1 388 ? -13.317 45.185 30.430 1.00 42.92 ? 388 ARG E CB 1 +ATOM 25914 C CG . ARG E 1 388 ? -13.860 44.036 29.613 1.00 43.84 ? 388 ARG E CG 1 +ATOM 25915 C CD . ARG E 1 388 ? -13.812 44.333 28.132 1.00 47.75 ? 388 ARG E CD 1 +ATOM 25916 N NE . ARG E 1 388 ? -14.729 43.488 27.370 1.00 50.51 ? 388 ARG E NE 1 +ATOM 25917 C CZ . ARG E 1 388 ? -14.585 43.198 26.078 1.00 51.56 ? 388 ARG E CZ 1 +ATOM 25918 N NH1 . ARG E 1 388 ? -13.553 43.681 25.395 1.00 51.18 ? 388 ARG E NH1 1 +ATOM 25919 N NH2 . ARG E 1 388 ? -15.474 42.422 25.468 1.00 51.82 ? 388 ARG E NH2 1 +ATOM 25920 N N . THR E 1 389 ? -11.296 46.701 32.168 1.00 45.06 ? 389 THR E N 1 +ATOM 25921 C CA . THR E 1 389 ? -10.941 47.800 33.053 1.00 45.53 ? 389 THR E CA 1 +ATOM 25922 C C . THR E 1 389 ? -9.715 48.546 32.533 1.00 46.27 ? 389 THR E C 1 +ATOM 25923 O O . THR E 1 389 ? -9.531 49.721 32.822 1.00 47.69 ? 389 THR E O 1 +ATOM 25924 C CB . THR E 1 389 ? -10.644 47.280 34.467 1.00 45.97 ? 389 THR E CB 1 +ATOM 25925 O OG1 . THR E 1 389 ? -11.833 46.704 35.018 1.00 46.55 ? 389 THR E OG1 1 +ATOM 25926 C CG2 . THR E 1 389 ? -10.162 48.404 35.368 1.00 45.54 ? 389 THR E CG2 1 +ATOM 25927 N N . SER E 1 390 ? -8.875 47.856 31.772 1.00 46.54 ? 390 SER E N 1 +ATOM 25928 C CA . SER E 1 390 ? -7.678 48.463 31.209 1.00 47.61 ? 390 SER E CA 1 +ATOM 25929 C C . SER E 1 390 ? -7.913 48.940 29.780 1.00 48.33 ? 390 SER E C 1 +ATOM 25930 O O . SER E 1 390 ? -6.982 49.394 29.114 1.00 47.75 ? 390 SER E O 1 +ATOM 25931 C CB . SER E 1 390 ? -6.523 47.461 31.214 1.00 48.20 ? 390 SER E CB 1 +ATOM 25932 O OG . SER E 1 390 ? -6.129 47.149 32.534 1.00 50.96 ? 390 SER E OG 1 +ATOM 25933 N N . HIS E 1 391 ? -9.153 48.830 29.309 1.00 49.26 ? 391 HIS E N 1 +ATOM 25934 C CA . HIS E 1 391 ? -9.492 49.242 27.949 1.00 51.05 ? 391 HIS E CA 1 +ATOM 25935 C C . HIS E 1 391 ? -8.570 48.532 26.967 1.00 50.74 ? 391 HIS E C 1 +ATOM 25936 O O . HIS E 1 391 ? -8.119 49.107 25.978 1.00 50.30 ? 391 HIS E O 1 +ATOM 25937 C CB . HIS E 1 391 ? -9.345 50.761 27.797 1.00 53.40 ? 391 HIS E CB 1 +ATOM 25938 C CG . HIS E 1 391 ? -10.165 51.541 28.773 1.00 56.97 ? 391 HIS E CG 1 +ATOM 25939 N ND1 . HIS E 1 391 ? -11.540 51.439 28.838 1.00 58.18 ? 391 HIS E ND1 1 +ATOM 25940 C CD2 . HIS E 1 391 ? -9.804 52.405 29.752 1.00 58.12 ? 391 HIS E CD2 1 +ATOM 25941 C CE1 . HIS E 1 391 ? -11.989 52.205 29.816 1.00 59.12 ? 391 HIS E CE1 1 +ATOM 25942 N NE2 . HIS E 1 391 ? -10.957 52.802 30.387 1.00 59.56 ? 391 HIS E NE2 1 +ATOM 25943 N N . ARG E 1 392 ? -8.295 47.268 27.264 1.00 50.60 ? 392 ARG E N 1 +ATOM 25944 C CA . ARG E 1 392 ? -7.430 46.439 26.440 1.00 49.91 ? 392 ARG E CA 1 +ATOM 25945 C C . ARG E 1 392 ? -8.327 45.650 25.481 1.00 50.43 ? 392 ARG E C 1 +ATOM 25946 O O . ARG E 1 392 ? -9.111 44.807 25.915 1.00 52.60 ? 392 ARG E O 1 +ATOM 25947 C CB . ARG E 1 392 ? -6.651 45.490 27.349 1.00 48.37 ? 392 ARG E CB 1 +ATOM 25948 C CG . ARG E 1 392 ? -5.437 44.887 26.725 1.00 46.67 ? 392 ARG E CG 1 +ATOM 25949 C CD . ARG E 1 392 ? -4.385 45.934 26.482 1.00 45.14 ? 392 ARG E CD 1 +ATOM 25950 N NE . ARG E 1 392 ? -3.072 45.417 26.838 1.00 46.92 ? 392 ARG E NE 1 +ATOM 25951 C CZ . ARG E 1 392 ? -2.466 45.636 27.998 1.00 44.87 ? 392 ARG E CZ 1 +ATOM 25952 N NH1 . ARG E 1 392 ? -3.040 46.374 28.926 1.00 46.20 ? 392 ARG E NH1 1 +ATOM 25953 N NH2 . ARG E 1 392 ? -1.284 45.105 28.231 1.00 48.28 ? 392 ARG E NH2 1 +ATOM 25954 N N . ASN E 1 393 ? -8.222 45.922 24.185 1.00 49.61 ? 393 ASN E N 1 +ATOM 25955 C CA . ASN E 1 393 ? -9.056 45.234 23.207 1.00 49.96 ? 393 ASN E CA 1 +ATOM 25956 C C . ASN E 1 393 ? -8.508 43.870 22.834 1.00 47.71 ? 393 ASN E C 1 +ATOM 25957 O O . ASN E 1 393 ? -9.270 42.952 22.543 1.00 47.03 ? 393 ASN E O 1 +ATOM 25958 C CB . ASN E 1 393 ? -9.217 46.092 21.951 1.00 53.45 ? 393 ASN E CB 1 +ATOM 25959 C CG . ASN E 1 393 ? -9.745 47.483 22.267 1.00 58.72 ? 393 ASN E CG 1 +ATOM 25960 O OD1 . ASN E 1 393 ? -10.838 47.638 22.833 1.00 59.81 ? 393 ASN E OD1 1 +ATOM 25961 N ND2 . ASN E 1 393 ? -8.965 48.508 21.914 1.00 59.85 ? 393 ASN E ND2 1 +ATOM 25962 N N . GLU E 1 394 ? -7.186 43.743 22.830 1.00 46.36 ? 394 GLU E N 1 +ATOM 25963 C CA . GLU E 1 394 ? -6.552 42.468 22.512 1.00 45.06 ? 394 GLU E CA 1 +ATOM 25964 C C . GLU E 1 394 ? -6.435 41.688 23.812 1.00 43.53 ? 394 GLU E C 1 +ATOM 25965 O O . GLU E 1 394 ? -5.555 41.946 24.635 1.00 42.96 ? 394 GLU E O 1 +ATOM 25966 C CB . GLU E 1 394 ? -5.170 42.684 21.907 1.00 46.97 ? 394 GLU E CB 1 +ATOM 25967 C CG . GLU E 1 394 ? -5.161 43.628 20.722 1.00 50.00 ? 394 GLU E CG 1 +ATOM 25968 C CD . GLU E 1 394 ? -3.907 43.501 19.879 1.00 52.72 ? 394 GLU E CD 1 +ATOM 25969 O OE1 . GLU E 1 394 ? -2.791 43.447 20.450 1.00 54.37 ? 394 GLU E OE1 1 +ATOM 25970 O OE2 . GLU E 1 394 ? -4.041 43.463 18.635 1.00 54.17 ? 394 GLU E OE2 1 +ATOM 25971 N N . ILE E 1 395 ? -7.340 40.735 23.990 1.00 41.59 ? 395 ILE E N 1 +ATOM 25972 C CA . ILE E 1 395 ? -7.380 39.931 25.198 1.00 39.34 ? 395 ILE E CA 1 +ATOM 25973 C C . ILE E 1 395 ? -6.806 38.534 25.013 1.00 37.36 ? 395 ILE E C 1 +ATOM 25974 O O . ILE E 1 395 ? -7.079 37.861 24.016 1.00 35.29 ? 395 ILE E O 1 +ATOM 25975 C CB . ILE E 1 395 ? -8.832 39.812 25.702 1.00 38.16 ? 395 ILE E CB 1 +ATOM 25976 C CG1 . ILE E 1 395 ? -9.389 41.214 25.975 1.00 38.50 ? 395 ILE E CG1 1 +ATOM 25977 C CG2 . ILE E 1 395 ? -8.885 38.943 26.944 1.00 38.48 ? 395 ILE E CG2 1 +ATOM 25978 C CD1 . ILE E 1 395 ? -10.844 41.241 26.390 1.00 34.72 ? 395 ILE E CD1 1 +ATOM 25979 N N . PHE E 1 396 ? -5.979 38.120 25.965 1.00 34.83 ? 396 PHE E N 1 +ATOM 25980 C CA . PHE E 1 396 ? -5.417 36.782 25.936 1.00 34.38 ? 396 PHE E CA 1 +ATOM 25981 C C . PHE E 1 396 ? -5.390 36.189 27.337 1.00 33.68 ? 396 PHE E C 1 +ATOM 25982 O O . PHE E 1 396 ? -4.699 36.676 28.230 1.00 32.53 ? 396 PHE E O 1 +ATOM 25983 C CB . PHE E 1 396 ? -4.003 36.736 25.368 1.00 35.15 ? 396 PHE E CB 1 +ATOM 25984 C CG . PHE E 1 396 ? -3.440 35.345 25.341 1.00 37.43 ? 396 PHE E CG 1 +ATOM 25985 C CD1 . PHE E 1 396 ? -3.882 34.425 24.395 1.00 37.83 ? 396 PHE E CD1 1 +ATOM 25986 C CD2 . PHE E 1 396 ? -2.572 34.909 26.339 1.00 38.01 ? 396 PHE E CD2 1 +ATOM 25987 C CE1 . PHE E 1 396 ? -3.479 33.092 24.445 1.00 37.72 ? 396 PHE E CE1 1 +ATOM 25988 C CE2 . PHE E 1 396 ? -2.162 33.573 26.398 1.00 38.21 ? 396 PHE E CE2 1 +ATOM 25989 C CZ . PHE E 1 396 ? -2.619 32.664 25.450 1.00 38.87 ? 396 PHE E CZ 1 +ATOM 25990 N N . ILE E 1 397 ? -6.164 35.133 27.523 1.00 33.72 ? 397 ILE E N 1 +ATOM 25991 C CA . ILE E 1 397 ? -6.226 34.450 28.803 1.00 31.88 ? 397 ILE E CA 1 +ATOM 25992 C C . ILE E 1 397 ? -6.163 32.947 28.557 1.00 31.84 ? 397 ILE E C 1 +ATOM 25993 O O . ILE E 1 397 ? -6.886 32.412 27.710 1.00 30.02 ? 397 ILE E O 1 +ATOM 25994 C CB . ILE E 1 397 ? -7.518 34.780 29.547 1.00 30.86 ? 397 ILE E CB 1 +ATOM 25995 C CG1 . ILE E 1 397 ? -7.617 36.290 29.753 1.00 28.63 ? 397 ILE E CG1 1 +ATOM 25996 C CG2 . ILE E 1 397 ? -7.557 34.033 30.871 1.00 30.33 ? 397 ILE E CG2 1 +ATOM 25997 C CD1 . ILE E 1 397 ? -8.903 36.718 30.420 1.00 28.95 ? 397 ILE E CD1 1 +ATOM 25998 N N . LEU E 1 398 ? -5.267 32.289 29.288 1.00 31.70 ? 398 LEU E N 1 +ATOM 25999 C CA . LEU E 1 398 ? -5.065 30.845 29.197 1.00 31.92 ? 398 LEU E CA 1 +ATOM 26000 C C . LEU E 1 398 ? -5.489 30.302 30.549 1.00 31.63 ? 398 LEU E C 1 +ATOM 26001 O O . LEU E 1 398 ? -5.116 30.859 31.584 1.00 32.39 ? 398 LEU E O 1 +ATOM 26002 C CB . LEU E 1 398 ? -3.582 30.531 28.992 1.00 31.44 ? 398 LEU E CB 1 +ATOM 26003 C CG . LEU E 1 398 ? -3.121 29.376 28.097 1.00 36.04 ? 398 LEU E CG 1 +ATOM 26004 C CD1 . LEU E 1 398 ? -1.781 28.862 28.645 1.00 35.68 ? 398 LEU E CD1 1 +ATOM 26005 C CD2 . LEU E 1 398 ? -4.145 28.244 28.040 1.00 33.59 ? 398 LEU E CD2 1 +ATOM 26006 N N . SER E 1 399 ? -6.266 29.228 30.551 1.00 30.98 ? 399 SER E N 1 +ATOM 26007 C CA . SER E 1 399 ? -6.708 28.624 31.802 1.00 31.13 ? 399 SER E CA 1 +ATOM 26008 C C . SER E 1 399 ? -6.477 27.114 31.749 1.00 31.89 ? 399 SER E C 1 +ATOM 26009 O O . SER E 1 399 ? -6.528 26.511 30.669 1.00 30.57 ? 399 SER E O 1 +ATOM 26010 C CB . SER E 1 399 ? -8.194 28.907 32.036 1.00 30.73 ? 399 SER E CB 1 +ATOM 26011 O OG . SER E 1 399 ? -8.627 28.352 33.273 1.00 33.76 ? 399 SER E OG 1 +ATOM 26012 N N . ARG E 1 400 ? -6.204 26.507 32.902 1.00 30.97 ? 400 ARG E N 1 +ATOM 26013 C CA . ARG E 1 400 ? -5.995 25.070 32.937 1.00 30.56 ? 400 ARG E CA 1 +ATOM 26014 C C . ARG E 1 400 ? -7.324 24.366 33.188 1.00 29.67 ? 400 ARG E C 1 +ATOM 26015 O O . ARG E 1 400 ? -7.641 23.384 32.529 1.00 30.30 ? 400 ARG E O 1 +ATOM 26016 C CB . ARG E 1 400 ? -4.996 24.685 34.025 1.00 31.33 ? 400 ARG E CB 1 +ATOM 26017 C CG . ARG E 1 400 ? -4.516 23.256 33.880 1.00 31.69 ? 400 ARG E CG 1 +ATOM 26018 C CD . ARG E 1 400 ? -3.314 22.961 34.753 1.00 33.08 ? 400 ARG E CD 1 +ATOM 26019 N NE . ARG E 1 400 ? -3.679 22.813 36.155 1.00 34.96 ? 400 ARG E NE 1 +ATOM 26020 C CZ . ARG E 1 400 ? -2.851 22.372 37.095 1.00 36.39 ? 400 ARG E CZ 1 +ATOM 26021 N NH1 . ARG E 1 400 ? -1.605 22.040 36.770 1.00 36.56 ? 400 ARG E NH1 1 +ATOM 26022 N NH2 . ARG E 1 400 ? -3.272 22.251 38.351 1.00 32.60 ? 400 ARG E NH2 1 +ATOM 26023 N N . ALA E 1 401 ? -8.098 24.871 34.139 1.00 27.40 ? 401 ALA E N 1 +ATOM 26024 C CA . ALA E 1 401 ? -9.386 24.274 34.450 1.00 28.80 ? 401 ALA E CA 1 +ATOM 26025 C C . ALA E 1 401 ? -10.522 25.027 33.774 1.00 29.08 ? 401 ALA E C 1 +ATOM 26026 O O . ALA E 1 401 ? -10.315 26.069 33.178 1.00 30.92 ? 401 ALA E O 1 +ATOM 26027 C CB . ALA E 1 401 ? -9.603 24.257 35.956 1.00 26.57 ? 401 ALA E CB 1 +ATOM 26028 N N . GLY E 1 402 ? -11.731 24.503 33.883 1.00 30.17 ? 402 GLY E N 1 +ATOM 26029 C CA . GLY E 1 402 ? -12.857 25.173 33.271 1.00 31.46 ? 402 GLY E CA 1 +ATOM 26030 C C . GLY E 1 402 ? -14.178 24.482 33.538 1.00 32.98 ? 402 GLY E C 1 +ATOM 26031 O O . GLY E 1 402 ? -14.235 23.400 34.134 1.00 34.25 ? 402 GLY E O 1 +ATOM 26032 N N . TYR E 1 403 ? -15.241 25.128 33.082 1.00 31.60 ? 403 TYR E N 1 +ATOM 26033 C CA . TYR E 1 403 ? -16.602 24.644 33.220 1.00 31.77 ? 403 TYR E CA 1 +ATOM 26034 C C . TYR E 1 403 ? -17.347 25.208 32.010 1.00 31.76 ? 403 TYR E C 1 +ATOM 26035 O O . TYR E 1 403 ? -16.790 26.017 31.267 1.00 32.01 ? 403 TYR E O 1 +ATOM 26036 C CB . TYR E 1 403 ? -17.214 25.179 34.516 1.00 29.54 ? 403 TYR E CB 1 +ATOM 26037 C CG . TYR E 1 403 ? -18.654 24.778 34.737 1.00 29.71 ? 403 TYR E CG 1 +ATOM 26038 C CD1 . TYR E 1 403 ? -18.997 23.454 34.959 1.00 27.60 ? 403 TYR E CD1 1 +ATOM 26039 C CD2 . TYR E 1 403 ? -19.681 25.729 34.702 1.00 31.46 ? 403 TYR E CD2 1 +ATOM 26040 C CE1 . TYR E 1 403 ? -20.315 23.075 35.138 1.00 29.07 ? 403 TYR E CE1 1 +ATOM 26041 C CE2 . TYR E 1 403 ? -21.005 25.362 34.883 1.00 30.26 ? 403 TYR E CE2 1 +ATOM 26042 C CZ . TYR E 1 403 ? -21.316 24.029 35.099 1.00 31.24 ? 403 TYR E CZ 1 +ATOM 26043 O OH . TYR E 1 403 ? -22.629 23.644 35.263 1.00 32.83 ? 403 TYR E OH 1 +ATOM 26044 N N . ALA E 1 404 ? -18.587 24.780 31.801 1.00 31.41 ? 404 ALA E N 1 +ATOM 26045 C CA . ALA E 1 404 ? -19.375 25.281 30.678 1.00 32.56 ? 404 ALA E CA 1 +ATOM 26046 C C . ALA E 1 404 ? -19.360 26.809 30.722 1.00 32.76 ? 404 ALA E C 1 +ATOM 26047 O O . ALA E 1 404 ? -19.572 27.406 31.774 1.00 34.79 ? 404 ALA E O 1 +ATOM 26048 C CB . ALA E 1 404 ? -20.803 24.762 30.770 1.00 30.24 ? 404 ALA E CB 1 +ATOM 26049 N N . GLY E 1 405 ? -19.095 27.441 29.586 1.00 32.75 ? 405 GLY E N 1 +ATOM 26050 C CA . GLY E 1 405 ? -19.052 28.889 29.548 1.00 32.71 ? 405 GLY E CA 1 +ATOM 26051 C C . GLY E 1 405 ? -17.641 29.456 29.572 1.00 33.99 ? 405 GLY E C 1 +ATOM 26052 O O . GLY E 1 405 ? -17.422 30.628 29.251 1.00 33.70 ? 405 GLY E O 1 +ATOM 26053 N N . ILE E 1 406 ? -16.673 28.628 29.951 1.00 33.63 ? 406 ILE E N 1 +ATOM 26054 C CA . ILE E 1 406 ? -15.287 29.076 30.020 1.00 33.30 ? 406 ILE E CA 1 +ATOM 26055 C C . ILE E 1 406 ? -14.828 29.631 28.665 1.00 32.01 ? 406 ILE E C 1 +ATOM 26056 O O . ILE E 1 406 ? -13.925 30.468 28.603 1.00 30.96 ? 406 ILE E O 1 +ATOM 26057 C CB . ILE E 1 406 ? -14.334 27.918 30.468 1.00 32.72 ? 406 ILE E CB 1 +ATOM 26058 C CG1 . ILE E 1 406 ? -12.938 28.468 30.760 1.00 33.36 ? 406 ILE E CG1 1 +ATOM 26059 C CG2 . ILE E 1 406 ? -14.229 26.859 29.395 1.00 32.87 ? 406 ILE E CG2 1 +ATOM 26060 C CD1 . ILE E 1 406 ? -12.869 29.336 31.989 1.00 27.81 ? 406 ILE E CD1 1 +ATOM 26061 N N . GLN E 1 407 ? -15.465 29.188 27.582 1.00 30.33 ? 407 GLN E N 1 +ATOM 26062 C CA . GLN E 1 407 ? -15.086 29.669 26.254 1.00 30.51 ? 407 GLN E CA 1 +ATOM 26063 C C . GLN E 1 407 ? -15.307 31.181 26.095 1.00 30.68 ? 407 GLN E C 1 +ATOM 26064 O O . GLN E 1 407 ? -14.727 31.808 25.208 1.00 31.64 ? 407 GLN E O 1 +ATOM 26065 C CB . GLN E 1 407 ? -15.830 28.900 25.139 1.00 29.45 ? 407 GLN E CB 1 +ATOM 26066 C CG . GLN E 1 407 ? -17.335 29.150 25.033 1.00 31.01 ? 407 GLN E CG 1 +ATOM 26067 C CD . GLN E 1 407 ? -18.162 28.342 26.028 1.00 32.51 ? 407 GLN E CD 1 +ATOM 26068 O OE1 . GLN E 1 407 ? -17.627 27.640 26.881 1.00 35.86 ? 407 GLN E OE1 1 +ATOM 26069 N NE2 . GLN E 1 407 ? -19.477 28.447 25.920 1.00 33.20 ? 407 GLN E NE2 1 +ATOM 26070 N N . ARG E 1 408 ? -16.141 31.771 26.949 1.00 31.20 ? 408 ARG E N 1 +ATOM 26071 C CA . ARG E 1 408 ? -16.377 33.217 26.885 1.00 32.06 ? 408 ARG E CA 1 +ATOM 26072 C C . ARG E 1 408 ? -15.106 33.987 27.206 1.00 32.20 ? 408 ARG E C 1 +ATOM 26073 O O . ARG E 1 408 ? -14.906 35.088 26.708 1.00 32.15 ? 408 ARG E O 1 +ATOM 26074 C CB . ARG E 1 408 ? -17.379 33.704 27.941 1.00 30.02 ? 408 ARG E CB 1 +ATOM 26075 C CG . ARG E 1 408 ? -18.758 33.145 27.944 1.00 30.87 ? 408 ARG E CG 1 +ATOM 26076 C CD . ARG E 1 408 ? -19.428 33.628 29.224 1.00 31.84 ? 408 ARG E CD 1 +ATOM 26077 N NE . ARG E 1 408 ? -20.822 33.210 29.343 1.00 34.69 ? 408 ARG E NE 1 +ATOM 26078 C CZ . ARG E 1 408 ? -21.609 33.528 30.370 1.00 35.44 ? 408 ARG E CZ 1 +ATOM 26079 N NH1 . ARG E 1 408 ? -21.139 34.267 31.365 1.00 34.24 ? 408 ARG E NH1 1 +ATOM 26080 N NH2 . ARG E 1 408 ? -22.867 33.108 30.404 1.00 36.71 ? 408 ARG E NH2 1 +ATOM 26081 N N . TYR E 1 409 ? -14.255 33.411 28.055 1.00 32.85 ? 409 TYR E N 1 +ATOM 26082 C CA . TYR E 1 409 ? -13.080 34.135 28.512 1.00 33.04 ? 409 TYR E CA 1 +ATOM 26083 C C . TYR E 1 409 ? -11.682 33.609 28.274 1.00 33.59 ? 409 TYR E C 1 +ATOM 26084 O O . TYR E 1 409 ? -10.719 34.372 28.426 1.00 33.70 ? 409 TYR E O 1 +ATOM 26085 C CB . TYR E 1 409 ? -13.215 34.390 30.015 1.00 31.61 ? 409 TYR E CB 1 +ATOM 26086 C CG . TYR E 1 409 ? -14.617 34.742 30.457 1.00 33.26 ? 409 TYR E CG 1 +ATOM 26087 C CD1 . TYR E 1 409 ? -15.207 35.956 30.081 1.00 33.50 ? 409 TYR E CD1 1 +ATOM 26088 C CD2 . TYR E 1 409 ? -15.360 33.863 31.250 1.00 31.72 ? 409 TYR E CD2 1 +ATOM 26089 C CE1 . TYR E 1 409 ? -16.503 36.282 30.486 1.00 32.20 ? 409 TYR E CE1 1 +ATOM 26090 C CE2 . TYR E 1 409 ? -16.652 34.183 31.658 1.00 33.48 ? 409 TYR E CE2 1 +ATOM 26091 C CZ . TYR E 1 409 ? -17.216 35.393 31.272 1.00 32.74 ? 409 TYR E CZ 1 +ATOM 26092 O OH . TYR E 1 409 ? -18.484 35.707 31.676 1.00 33.26 ? 409 TYR E OH 1 +ATOM 26093 N N . ALA E 1 410 ? -11.523 32.342 27.906 1.00 33.60 ? 410 ALA E N 1 +ATOM 26094 C CA . ALA E 1 410 ? -10.158 31.866 27.766 1.00 31.78 ? 410 ALA E CA 1 +ATOM 26095 C C . ALA E 1 410 ? -9.867 30.687 26.877 1.00 31.21 ? 410 ALA E C 1 +ATOM 26096 O O . ALA E 1 410 ? -10.755 29.955 26.475 1.00 32.28 ? 410 ALA E O 1 +ATOM 26097 C CB . ALA E 1 410 ? -9.599 31.571 29.165 1.00 33.03 ? 410 ALA E CB 1 +ATOM 26098 N N . PHE E 1 411 ? -8.579 30.544 26.580 1.00 31.91 ? 411 PHE E N 1 +ATOM 26099 C CA . PHE E 1 411 ? -8.022 29.434 25.825 1.00 31.28 ? 411 PHE E CA 1 +ATOM 26100 C C . PHE E 1 411 ? -7.804 28.372 26.907 1.00 31.66 ? 411 PHE E C 1 +ATOM 26101 O O . PHE E 1 411 ? -7.666 28.694 28.088 1.00 29.24 ? 411 PHE E O 1 +ATOM 26102 C CB . PHE E 1 411 ? -6.630 29.765 25.294 1.00 33.49 ? 411 PHE E CB 1 +ATOM 26103 C CG . PHE E 1 411 ? -6.610 30.485 23.985 1.00 35.70 ? 411 PHE E CG 1 +ATOM 26104 C CD1 . PHE E 1 411 ? -7.276 31.693 23.819 1.00 36.19 ? 411 PHE E CD1 1 +ATOM 26105 C CD2 . PHE E 1 411 ? -5.878 29.971 22.921 1.00 35.58 ? 411 PHE E CD2 1 +ATOM 26106 C CE1 . PHE E 1 411 ? -7.211 32.377 22.612 1.00 35.65 ? 411 PHE E CE1 1 +ATOM 26107 C CE2 . PHE E 1 411 ? -5.809 30.652 21.710 1.00 35.96 ? 411 PHE E CE2 1 +ATOM 26108 C CZ . PHE E 1 411 ? -6.477 31.855 21.556 1.00 35.19 ? 411 PHE E CZ 1 +ATOM 26109 N N . ILE E 1 412 ? -7.759 27.110 26.508 1.00 32.24 ? 412 ILE E N 1 +ATOM 26110 C CA . ILE E 1 412 ? -7.496 26.046 27.455 1.00 32.12 ? 412 ILE E CA 1 +ATOM 26111 C C . ILE E 1 412 ? -6.425 25.148 26.861 1.00 31.79 ? 412 ILE E C 1 +ATOM 26112 O O . ILE E 1 412 ? -6.482 24.816 25.682 1.00 30.74 ? 412 ILE E O 1 +ATOM 26113 C CB . ILE E 1 412 ? -8.763 25.210 27.764 1.00 32.92 ? 412 ILE E CB 1 +ATOM 26114 C CG1 . ILE E 1 412 ? -9.702 26.020 28.661 1.00 33.77 ? 412 ILE E CG1 1 +ATOM 26115 C CG2 . ILE E 1 412 ? -8.377 23.900 28.460 1.00 31.76 ? 412 ILE E CG2 1 +ATOM 26116 C CD1 . ILE E 1 412 ? -10.883 25.243 29.176 1.00 34.67 ? 412 ILE E CD1 1 +ATOM 26117 N N . TRP E 1 413 ? -5.415 24.807 27.658 1.00 31.24 ? 413 TRP E N 1 +ATOM 26118 C CA . TRP E 1 413 ? -4.378 23.898 27.184 1.00 31.70 ? 413 TRP E CA 1 +ATOM 26119 C C . TRP E 1 413 ? -4.502 22.663 28.072 1.00 31.26 ? 413 TRP E C 1 +ATOM 26120 O O . TRP E 1 413 ? -5.004 22.755 29.194 1.00 31.75 ? 413 TRP E O 1 +ATOM 26121 C CB . TRP E 1 413 ? -2.990 24.556 27.251 1.00 32.09 ? 413 TRP E CB 1 +ATOM 26122 C CG . TRP E 1 413 ? -2.150 24.226 28.432 1.00 31.80 ? 413 TRP E CG 1 +ATOM 26123 C CD1 . TRP E 1 413 ? -1.139 23.315 28.484 1.00 31.34 ? 413 TRP E CD1 1 +ATOM 26124 C CD2 . TRP E 1 413 ? -2.240 24.805 29.733 1.00 31.11 ? 413 TRP E CD2 1 +ATOM 26125 N NE1 . TRP E 1 413 ? -0.589 23.290 29.739 1.00 31.46 ? 413 TRP E NE1 1 +ATOM 26126 C CE2 . TRP E 1 413 ? -1.246 24.193 30.528 1.00 31.76 ? 413 TRP E CE2 1 +ATOM 26127 C CE3 . TRP E 1 413 ? -3.064 25.783 30.307 1.00 31.81 ? 413 TRP E CE3 1 +ATOM 26128 C CZ2 . TRP E 1 413 ? -1.050 24.525 31.871 1.00 32.92 ? 413 TRP E CZ2 1 +ATOM 26129 C CZ3 . TRP E 1 413 ? -2.872 26.116 31.646 1.00 34.05 ? 413 TRP E CZ3 1 +ATOM 26130 C CH2 . TRP E 1 413 ? -1.870 25.486 32.415 1.00 33.42 ? 413 TRP E CH2 1 +ATOM 26131 N N . THR E 1 414 ? -4.065 21.515 27.566 1.00 31.22 ? 414 THR E N 1 +ATOM 26132 C CA . THR E 1 414 ? -4.201 20.243 28.275 1.00 31.21 ? 414 THR E CA 1 +ATOM 26133 C C . THR E 1 414 ? -3.272 19.905 29.443 1.00 33.91 ? 414 THR E C 1 +ATOM 26134 O O . THR E 1 414 ? -3.062 18.733 29.751 1.00 33.77 ? 414 THR E O 1 +ATOM 26135 C CB . THR E 1 414 ? -4.153 19.090 27.286 1.00 29.75 ? 414 THR E CB 1 +ATOM 26136 O OG1 . THR E 1 414 ? -2.896 19.109 26.607 1.00 30.48 ? 414 THR E OG1 1 +ATOM 26137 C CG2 . THR E 1 414 ? -5.268 19.234 26.250 1.00 29.82 ? 414 THR E CG2 1 +ATOM 26138 N N . GLY E 1 415 ? -2.709 20.917 30.093 1.00 34.02 ? 415 GLY E N 1 +ATOM 26139 C CA . GLY E 1 415 ? -1.875 20.659 31.248 1.00 35.66 ? 415 GLY E CA 1 +ATOM 26140 C C . GLY E 1 415 ? -0.560 19.910 31.091 1.00 36.86 ? 415 GLY E C 1 +ATOM 26141 O O . GLY E 1 415 ? 0.083 19.948 30.041 1.00 35.70 ? 415 GLY E O 1 +ATOM 26142 N N . ASP E 1 416 ? -0.185 19.206 32.160 1.00 36.52 ? 416 ASP E N 1 +ATOM 26143 C CA . ASP E 1 416 ? 1.076 18.479 32.241 1.00 35.94 ? 416 ASP E CA 1 +ATOM 26144 C C . ASP E 1 416 ? 1.207 17.130 31.533 1.00 35.66 ? 416 ASP E C 1 +ATOM 26145 O O . ASP E 1 416 ? 1.324 16.087 32.187 1.00 36.16 ? 416 ASP E O 1 +ATOM 26146 C CB . ASP E 1 416 ? 1.455 18.296 33.716 1.00 37.04 ? 416 ASP E CB 1 +ATOM 26147 C CG . ASP E 1 416 ? 1.447 19.607 34.500 1.00 40.48 ? 416 ASP E CG 1 +ATOM 26148 O OD1 . ASP E 1 416 ? 1.561 20.695 33.888 1.00 41.20 ? 416 ASP E OD1 1 +ATOM 26149 O OD2 . ASP E 1 416 ? 1.347 19.542 35.744 1.00 42.58 ? 416 ASP E OD2 1 +ATOM 26150 N N . ASN E 1 417 ? 1.228 17.142 30.206 1.00 33.69 ? 417 ASN E N 1 +ATOM 26151 C CA . ASN E 1 417 ? 1.365 15.903 29.462 1.00 32.37 ? 417 ASN E CA 1 +ATOM 26152 C C . ASN E 1 417 ? 2.802 15.351 29.505 1.00 32.42 ? 417 ASN E C 1 +ATOM 26153 O O . ASN E 1 417 ? 3.750 16.067 29.818 1.00 29.92 ? 417 ASN E O 1 +ATOM 26154 C CB . ASN E 1 417 ? 0.907 16.119 28.017 1.00 32.74 ? 417 ASN E CB 1 +ATOM 26155 C CG . ASN E 1 417 ? 1.775 17.122 27.259 1.00 36.40 ? 417 ASN E CG 1 +ATOM 26156 O OD1 . ASN E 1 417 ? 2.271 18.101 27.829 1.00 37.49 ? 417 ASN E OD1 1 +ATOM 26157 N ND2 . ASN E 1 417 ? 1.946 16.887 25.961 1.00 35.66 ? 417 ASN E ND2 1 +ATOM 26158 N N . THR E 1 418 ? 2.932 14.064 29.193 1.00 32.75 ? 418 THR E N 1 +ATOM 26159 C CA . THR E 1 418 ? 4.208 13.361 29.176 1.00 32.43 ? 418 THR E CA 1 +ATOM 26160 C C . THR E 1 418 ? 4.648 13.059 27.743 1.00 32.27 ? 418 THR E C 1 +ATOM 26161 O O . THR E 1 418 ? 3.889 12.485 26.967 1.00 32.58 ? 418 THR E O 1 +ATOM 26162 C CB . THR E 1 418 ? 4.096 12.004 29.917 1.00 32.00 ? 418 THR E CB 1 +ATOM 26163 O OG1 . THR E 1 418 ? 3.767 12.232 31.290 1.00 31.95 ? 418 THR E OG1 1 +ATOM 26164 C CG2 . THR E 1 418 ? 5.411 11.222 29.823 1.00 31.67 ? 418 THR E CG2 1 +ATOM 26165 N N . PRO E 1 419 ? 5.887 13.422 27.384 1.00 31.23 ? 419 PRO E N 1 +ATOM 26166 C CA . PRO E 1 419 ? 6.395 13.162 26.028 1.00 31.88 ? 419 PRO E CA 1 +ATOM 26167 C C . PRO E 1 419 ? 6.480 11.655 25.749 1.00 33.21 ? 419 PRO E C 1 +ATOM 26168 O O . PRO E 1 419 ? 7.158 10.922 26.473 1.00 34.33 ? 419 PRO E O 1 +ATOM 26169 C CB . PRO E 1 419 ? 7.790 13.780 26.045 1.00 28.36 ? 419 PRO E CB 1 +ATOM 26170 C CG . PRO E 1 419 ? 7.725 14.775 27.148 1.00 31.65 ? 419 PRO E CG 1 +ATOM 26171 C CD . PRO E 1 419 ? 6.884 14.126 28.198 1.00 29.45 ? 419 PRO E CD 1 +ATOM 26172 N N . SER E 1 420 ? 5.787 11.197 24.717 1.00 32.91 ? 420 SER E N 1 +ATOM 26173 C CA . SER E 1 420 ? 5.830 9.792 24.331 1.00 35.08 ? 420 SER E CA 1 +ATOM 26174 C C . SER E 1 420 ? 5.024 9.621 23.059 1.00 34.62 ? 420 SER E C 1 +ATOM 26175 O O . SER E 1 420 ? 4.157 10.440 22.759 1.00 34.89 ? 420 SER E O 1 +ATOM 26176 C CB . SER E 1 420 ? 5.246 8.897 25.426 1.00 35.81 ? 420 SER E CB 1 +ATOM 26177 O OG . SER E 1 420 ? 3.830 8.881 25.372 1.00 39.31 ? 420 SER E OG 1 +ATOM 26178 N N . TRP E 1 421 ? 5.305 8.561 22.308 1.00 34.91 ? 421 TRP E N 1 +ATOM 26179 C CA . TRP E 1 421 ? 4.569 8.331 21.077 1.00 35.52 ? 421 TRP E CA 1 +ATOM 26180 C C . TRP E 1 421 ? 3.082 8.138 21.323 1.00 36.76 ? 421 TRP E C 1 +ATOM 26181 O O . TRP E 1 421 ? 2.259 8.587 20.535 1.00 39.29 ? 421 TRP E O 1 +ATOM 26182 C CB . TRP E 1 421 ? 5.153 7.151 20.316 1.00 33.50 ? 421 TRP E CB 1 +ATOM 26183 C CG . TRP E 1 421 ? 6.486 7.484 19.739 1.00 33.02 ? 421 TRP E CG 1 +ATOM 26184 C CD1 . TRP E 1 421 ? 7.704 7.279 20.313 1.00 33.85 ? 421 TRP E CD1 1 +ATOM 26185 C CD2 . TRP E 1 421 ? 6.735 8.156 18.502 1.00 32.97 ? 421 TRP E CD2 1 +ATOM 26186 N NE1 . TRP E 1 421 ? 8.701 7.781 19.510 1.00 33.39 ? 421 TRP E NE1 1 +ATOM 26187 C CE2 . TRP E 1 421 ? 8.136 8.325 18.391 1.00 31.40 ? 421 TRP E CE2 1 +ATOM 26188 C CE3 . TRP E 1 421 ? 5.910 8.635 17.473 1.00 31.49 ? 421 TRP E CE3 1 +ATOM 26189 C CZ2 . TRP E 1 421 ? 8.734 8.951 17.295 1.00 31.21 ? 421 TRP E CZ2 1 +ATOM 26190 C CZ3 . TRP E 1 421 ? 6.502 9.260 16.379 1.00 31.36 ? 421 TRP E CZ3 1 +ATOM 26191 C CH2 . TRP E 1 421 ? 7.906 9.412 16.300 1.00 32.92 ? 421 TRP E CH2 1 +ATOM 26192 N N . ASP E 1 422 ? 2.729 7.498 22.426 1.00 38.59 ? 422 ASP E N 1 +ATOM 26193 C CA . ASP E 1 422 ? 1.330 7.302 22.738 1.00 40.68 ? 422 ASP E CA 1 +ATOM 26194 C C . ASP E 1 422 ? 0.665 8.636 23.064 1.00 40.28 ? 422 ASP E C 1 +ATOM 26195 O O . ASP E 1 422 ? -0.514 8.833 22.769 1.00 40.35 ? 422 ASP E O 1 +ATOM 26196 C CB . ASP E 1 422 ? 1.162 6.344 23.923 1.00 45.39 ? 422 ASP E CB 1 +ATOM 26197 C CG . ASP E 1 422 ? 1.659 4.942 23.619 1.00 50.33 ? 422 ASP E CG 1 +ATOM 26198 O OD1 . ASP E 1 422 ? 1.477 4.487 22.468 1.00 53.69 ? 422 ASP E OD1 1 +ATOM 26199 O OD2 . ASP E 1 422 ? 2.217 4.289 24.535 1.00 53.01 ? 422 ASP E OD2 1 +ATOM 26200 N N . ASP E 1 423 ? 1.412 9.555 23.670 1.00 38.64 ? 423 ASP E N 1 +ATOM 26201 C CA . ASP E 1 423 ? 0.832 10.845 24.022 1.00 38.67 ? 423 ASP E CA 1 +ATOM 26202 C C . ASP E 1 423 ? 0.333 11.614 22.795 1.00 37.12 ? 423 ASP E C 1 +ATOM 26203 O O . ASP E 1 423 ? -0.569 12.440 22.913 1.00 36.24 ? 423 ASP E O 1 +ATOM 26204 C CB . ASP E 1 423 ? 1.831 11.700 24.801 1.00 39.17 ? 423 ASP E CB 1 +ATOM 26205 C CG . ASP E 1 423 ? 1.199 12.975 25.366 1.00 43.14 ? 423 ASP E CG 1 +ATOM 26206 O OD1 . ASP E 1 423 ? 0.171 12.874 26.083 1.00 43.28 ? 423 ASP E OD1 1 +ATOM 26207 O OD2 . ASP E 1 423 ? 1.731 14.083 25.102 1.00 43.77 ? 423 ASP E OD2 1 +ATOM 26208 N N . LEU E 1 424 ? 0.907 11.347 21.623 1.00 36.06 ? 424 LEU E N 1 +ATOM 26209 C CA . LEU E 1 424 ? 0.461 12.029 20.405 1.00 35.78 ? 424 LEU E CA 1 +ATOM 26210 C C . LEU E 1 424 ? -1.029 11.752 20.178 1.00 36.33 ? 424 LEU E C 1 +ATOM 26211 O O . LEU E 1 424 ? -1.802 12.660 19.884 1.00 35.30 ? 424 LEU E O 1 +ATOM 26212 C CB . LEU E 1 424 ? 1.253 11.563 19.187 1.00 33.90 ? 424 LEU E CB 1 +ATOM 26213 C CG . LEU E 1 424 ? 2.747 11.892 19.160 1.00 34.61 ? 424 LEU E CG 1 +ATOM 26214 C CD1 . LEU E 1 424 ? 3.352 11.377 17.867 1.00 32.78 ? 424 LEU E CD1 1 +ATOM 26215 C CD2 . LEU E 1 424 ? 2.952 13.399 19.284 1.00 33.98 ? 424 LEU E CD2 1 +ATOM 26216 N N . LYS E 1 425 ? -1.433 10.496 20.327 1.00 36.01 ? 425 LYS E N 1 +ATOM 26217 C CA . LYS E 1 425 ? -2.832 10.146 20.153 1.00 36.90 ? 425 LYS E CA 1 +ATOM 26218 C C . LYS E 1 425 ? -3.681 10.688 21.291 1.00 34.99 ? 425 LYS E C 1 +ATOM 26219 O O . LYS E 1 425 ? -4.804 11.132 21.076 1.00 35.99 ? 425 LYS E O 1 +ATOM 26220 C CB . LYS E 1 425 ? -3.008 8.630 20.079 1.00 40.59 ? 425 LYS E CB 1 +ATOM 26221 C CG . LYS E 1 425 ? -2.429 7.985 18.837 1.00 45.29 ? 425 LYS E CG 1 +ATOM 26222 C CD . LYS E 1 425 ? -2.910 6.547 18.718 1.00 50.36 ? 425 LYS E CD 1 +ATOM 26223 C CE . LYS E 1 425 ? -2.386 5.888 17.448 1.00 53.96 ? 425 LYS E CE 1 +ATOM 26224 N NZ . LYS E 1 425 ? -0.892 5.793 17.463 1.00 58.18 ? 425 LYS E NZ 1 +ATOM 26225 N N . LEU E 1 426 ? -3.142 10.663 22.501 1.00 33.73 ? 426 LEU E N 1 +ATOM 26226 C CA . LEU E 1 426 ? -3.879 11.146 23.661 1.00 32.50 ? 426 LEU E CA 1 +ATOM 26227 C C . LEU E 1 426 ? -4.209 12.634 23.530 1.00 31.05 ? 426 LEU E C 1 +ATOM 26228 O O . LEU E 1 426 ? -5.350 13.039 23.729 1.00 29.46 ? 426 LEU E O 1 +ATOM 26229 C CB . LEU E 1 426 ? -3.067 10.910 24.936 1.00 32.91 ? 426 LEU E CB 1 +ATOM 26230 C CG . LEU E 1 426 ? -3.799 10.560 26.242 1.00 33.95 ? 426 LEU E CG 1 +ATOM 26231 C CD1 . LEU E 1 426 ? -3.022 11.164 27.410 1.00 31.79 ? 426 LEU E CD1 1 +ATOM 26232 C CD2 . LEU E 1 426 ? -5.226 11.074 26.239 1.00 33.56 ? 426 LEU E CD2 1 +ATOM 26233 N N . GLN E 1 427 ? -3.207 13.439 23.192 1.00 30.06 ? 427 GLN E N 1 +ATOM 26234 C CA . GLN E 1 427 ? -3.413 14.874 23.044 1.00 31.57 ? 427 GLN E CA 1 +ATOM 26235 C C . GLN E 1 427 ? -4.490 15.197 22.011 1.00 31.05 ? 427 GLN E C 1 +ATOM 26236 O O . GLN E 1 427 ? -5.263 16.136 22.174 1.00 30.75 ? 427 GLN E O 1 +ATOM 26237 C CB . GLN E 1 427 ? -2.099 15.561 22.665 1.00 31.04 ? 427 GLN E CB 1 +ATOM 26238 C CG . GLN E 1 427 ? -1.084 15.561 23.786 1.00 31.76 ? 427 GLN E CG 1 +ATOM 26239 C CD . GLN E 1 427 ? -1.712 15.946 25.109 1.00 33.07 ? 427 GLN E CD 1 +ATOM 26240 O OE1 . GLN E 1 427 ? -2.402 16.967 25.207 1.00 33.06 ? 427 GLN E OE1 1 +ATOM 26241 N NE2 . GLN E 1 427 ? -1.488 15.126 26.135 1.00 31.38 ? 427 GLN E NE2 1 +ATOM 26242 N N . LEU E 1 428 ? -4.541 14.405 20.953 1.00 31.97 ? 428 LEU E N 1 +ATOM 26243 C CA . LEU E 1 428 ? -5.532 14.603 19.912 1.00 34.27 ? 428 LEU E CA 1 +ATOM 26244 C C . LEU E 1 428 ? -6.950 14.360 20.457 1.00 34.45 ? 428 LEU E C 1 +ATOM 26245 O O . LEU E 1 428 ? -7.880 15.096 20.140 1.00 34.95 ? 428 LEU E O 1 +ATOM 26246 C CB . LEU E 1 428 ? -5.221 13.673 18.752 1.00 36.47 ? 428 LEU E CB 1 +ATOM 26247 C CG . LEU E 1 428 ? -5.582 14.163 17.350 1.00 40.96 ? 428 LEU E CG 1 +ATOM 26248 C CD1 . LEU E 1 428 ? -5.304 15.653 17.208 1.00 40.52 ? 428 LEU E CD1 1 +ATOM 26249 C CD2 . LEU E 1 428 ? -4.770 13.361 16.336 1.00 38.97 ? 428 LEU E CD2 1 +ATOM 26250 N N . GLN E 1 429 ? -7.111 13.349 21.302 1.00 33.66 ? 429 GLN E N 1 +ATOM 26251 C CA . GLN E 1 429 ? -8.419 13.062 21.884 1.00 34.66 ? 429 GLN E CA 1 +ATOM 26252 C C . GLN E 1 429 ? -8.825 14.165 22.857 1.00 33.61 ? 429 GLN E C 1 +ATOM 26253 O O . GLN E 1 429 ? -9.990 14.556 22.921 1.00 31.89 ? 429 GLN E O 1 +ATOM 26254 C CB . GLN E 1 429 ? -8.399 11.724 22.635 1.00 34.87 ? 429 GLN E CB 1 +ATOM 26255 C CG . GLN E 1 429 ? -8.053 10.522 21.786 1.00 38.35 ? 429 GLN E CG 1 +ATOM 26256 C CD . GLN E 1 429 ? -7.944 9.248 22.618 1.00 41.24 ? 429 GLN E CD 1 +ATOM 26257 O OE1 . GLN E 1 429 ? -7.240 9.213 23.626 1.00 42.20 ? 429 GLN E OE1 1 +ATOM 26258 N NE2 . GLN E 1 429 ? -8.643 8.197 22.199 1.00 41.75 ? 429 GLN E NE2 1 +ATOM 26259 N N . LEU E 1 430 ? -7.851 14.643 23.627 1.00 32.15 ? 430 LEU E N 1 +ATOM 26260 C CA . LEU E 1 430 ? -8.081 15.693 24.599 1.00 30.44 ? 430 LEU E CA 1 +ATOM 26261 C C . LEU E 1 430 ? -8.545 16.990 23.952 1.00 29.98 ? 430 LEU E C 1 +ATOM 26262 O O . LEU E 1 430 ? -9.580 17.532 24.335 1.00 28.99 ? 430 LEU E O 1 +ATOM 26263 C CB . LEU E 1 430 ? -6.803 15.954 25.395 1.00 32.11 ? 430 LEU E CB 1 +ATOM 26264 C CG . LEU E 1 430 ? -6.646 15.387 26.809 1.00 32.70 ? 430 LEU E CG 1 +ATOM 26265 C CD1 . LEU E 1 430 ? -7.634 14.284 27.079 1.00 31.76 ? 430 LEU E CD1 1 +ATOM 26266 C CD2 . LEU E 1 430 ? -5.213 14.907 26.975 1.00 32.92 ? 430 LEU E CD2 1 +ATOM 26267 N N . VAL E 1 431 ? -7.793 17.490 22.976 1.00 28.22 ? 431 VAL E N 1 +ATOM 26268 C CA . VAL E 1 431 ? -8.182 18.741 22.341 1.00 30.76 ? 431 VAL E CA 1 +ATOM 26269 C C . VAL E 1 431 ? -9.470 18.624 21.533 1.00 30.79 ? 431 VAL E C 1 +ATOM 26270 O O . VAL E 1 431 ? -10.255 19.568 21.506 1.00 30.56 ? 431 VAL E O 1 +ATOM 26271 C CB . VAL E 1 431 ? -7.049 19.326 21.444 1.00 30.45 ? 431 VAL E CB 1 +ATOM 26272 C CG1 . VAL E 1 431 ? -5.806 19.528 22.281 1.00 31.02 ? 431 VAL E CG1 1 +ATOM 26273 C CG2 . VAL E 1 431 ? -6.764 18.425 20.270 1.00 29.44 ? 431 VAL E CG2 1 +ATOM 26274 N N . LEU E 1 432 ? -9.694 17.476 20.894 1.00 29.69 ? 432 LEU E N 1 +ATOM 26275 C CA . LEU E 1 432 ? -10.911 17.280 20.116 1.00 29.92 ? 432 LEU E CA 1 +ATOM 26276 C C . LEU E 1 432 ? -12.121 17.121 21.021 1.00 30.12 ? 432 LEU E C 1 +ATOM 26277 O O . LEU E 1 432 ? -13.211 17.545 20.668 1.00 28.24 ? 432 LEU E O 1 +ATOM 26278 C CB . LEU E 1 432 ? -10.795 16.062 19.195 1.00 29.63 ? 432 LEU E CB 1 +ATOM 26279 C CG . LEU E 1 432 ? -9.820 16.223 18.027 1.00 28.72 ? 432 LEU E CG 1 +ATOM 26280 C CD1 . LEU E 1 432 ? -9.905 15.011 17.122 1.00 26.57 ? 432 LEU E CD1 1 +ATOM 26281 C CD2 . LEU E 1 432 ? -10.151 17.485 17.259 1.00 28.71 ? 432 LEU E CD2 1 +ATOM 26282 N N . GLY E 1 433 ? -11.928 16.517 22.191 1.00 32.22 ? 433 GLY E N 1 +ATOM 26283 C CA . GLY E 1 433 ? -13.037 16.348 23.117 1.00 32.66 ? 433 GLY E CA 1 +ATOM 26284 C C . GLY E 1 433 ? -13.483 17.704 23.645 1.00 34.70 ? 433 GLY E C 1 +ATOM 26285 O O . GLY E 1 433 ? -14.675 17.972 23.812 1.00 35.07 ? 433 GLY E O 1 +ATOM 26286 N N . LEU E 1 434 ? -12.505 18.565 23.903 1.00 34.43 ? 434 LEU E N 1 +ATOM 26287 C CA . LEU E 1 434 ? -12.734 19.913 24.412 1.00 34.95 ? 434 LEU E CA 1 +ATOM 26288 C C . LEU E 1 434 ? -13.432 20.741 23.334 1.00 35.18 ? 434 LEU E C 1 +ATOM 26289 O O . LEU E 1 434 ? -14.395 21.472 23.579 1.00 33.09 ? 434 LEU E O 1 +ATOM 26290 C CB . LEU E 1 434 ? -11.379 20.539 24.733 1.00 34.39 ? 434 LEU E CB 1 +ATOM 26291 C CG . LEU E 1 434 ? -11.086 21.154 26.099 1.00 37.67 ? 434 LEU E CG 1 +ATOM 26292 C CD1 . LEU E 1 434 ? -11.996 20.593 27.174 1.00 35.93 ? 434 LEU E CD1 1 +ATOM 26293 C CD2 . LEU E 1 434 ? -9.610 20.908 26.409 1.00 34.27 ? 434 LEU E CD2 1 +ATOM 26294 N N . SER E 1 435 ? -12.917 20.602 22.126 1.00 35.76 ? 435 SER E N 1 +ATOM 26295 C CA . SER E 1 435 ? -13.418 21.312 20.970 1.00 37.60 ? 435 SER E CA 1 +ATOM 26296 C C . SER E 1 435 ? -14.875 20.964 20.644 1.00 37.50 ? 435 SER E C 1 +ATOM 26297 O O . SER E 1 435 ? -15.688 21.840 20.374 1.00 38.90 ? 435 SER E O 1 +ATOM 26298 C CB . SER E 1 435 ? -12.502 21.002 19.784 1.00 37.54 ? 435 SER E CB 1 +ATOM 26299 O OG . SER E 1 435 ? -12.840 21.769 18.655 1.00 43.30 ? 435 SER E OG 1 +ATOM 26300 N N . ILE E 1 436 ? -15.207 19.683 20.673 1.00 37.62 ? 436 ILE E N 1 +ATOM 26301 C CA . ILE E 1 436 ? -16.562 19.252 20.375 1.00 37.21 ? 436 ILE E CA 1 +ATOM 26302 C C . ILE E 1 436 ? -17.507 19.584 21.537 1.00 37.11 ? 436 ILE E C 1 +ATOM 26303 O O . ILE E 1 436 ? -18.724 19.424 21.433 1.00 36.16 ? 436 ILE E O 1 +ATOM 26304 C CB . ILE E 1 436 ? -16.595 17.727 20.089 1.00 39.11 ? 436 ILE E CB 1 +ATOM 26305 C CG1 . ILE E 1 436 ? -17.858 17.378 19.310 1.00 41.74 ? 436 ILE E CG1 1 +ATOM 26306 C CG2 . ILE E 1 436 ? -16.542 16.927 21.389 1.00 38.08 ? 436 ILE E CG2 1 +ATOM 26307 C CD1 . ILE E 1 436 ? -17.887 17.993 17.926 1.00 41.43 ? 436 ILE E CD1 1 +ATOM 26308 N N . SER E 1 437 ? -16.936 20.061 22.641 1.00 36.67 ? 437 SER E N 1 +ATOM 26309 C CA . SER E 1 437 ? -17.717 20.405 23.828 1.00 35.46 ? 437 SER E CA 1 +ATOM 26310 C C . SER E 1 437 ? -17.882 21.910 24.063 1.00 35.65 ? 437 SER E C 1 +ATOM 26311 O O . SER E 1 437 ? -18.175 22.343 25.181 1.00 35.88 ? 437 SER E O 1 +ATOM 26312 C CB . SER E 1 437 ? -17.097 19.764 25.077 1.00 33.42 ? 437 SER E CB 1 +ATOM 26313 O OG . SER E 1 437 ? -17.168 18.350 25.022 1.00 30.89 ? 437 SER E OG 1 +ATOM 26314 N N . GLY E 1 438 ? -17.684 22.713 23.024 1.00 34.80 ? 438 GLY E N 1 +ATOM 26315 C CA . GLY E 1 438 ? -17.862 24.143 23.188 1.00 34.61 ? 438 GLY E CA 1 +ATOM 26316 C C . GLY E 1 438 ? -16.644 25.001 23.475 1.00 35.99 ? 438 GLY E C 1 +ATOM 26317 O O . GLY E 1 438 ? -16.775 26.218 23.548 1.00 36.43 ? 438 GLY E O 1 +ATOM 26318 N N . VAL E 1 439 ? -15.468 24.400 23.647 1.00 34.83 ? 439 VAL E N 1 +ATOM 26319 C CA . VAL E 1 439 ? -14.263 25.185 23.905 1.00 34.40 ? 439 VAL E CA 1 +ATOM 26320 C C . VAL E 1 439 ? -13.393 25.071 22.668 1.00 34.07 ? 439 VAL E C 1 +ATOM 26321 O O . VAL E 1 439 ? -12.655 24.111 22.501 1.00 34.81 ? 439 VAL E O 1 +ATOM 26322 C CB . VAL E 1 439 ? -13.504 24.651 25.129 1.00 36.05 ? 439 VAL E CB 1 +ATOM 26323 C CG1 . VAL E 1 439 ? -12.381 25.592 25.492 1.00 34.26 ? 439 VAL E CG1 1 +ATOM 26324 C CG2 . VAL E 1 439 ? -14.474 24.488 26.299 1.00 37.15 ? 439 VAL E CG2 1 +ATOM 26325 N N . PRO E 1 440 ? -13.465 26.066 21.780 1.00 34.66 ? 440 PRO E N 1 +ATOM 26326 C CA . PRO E 1 440 ? -12.707 26.096 20.528 1.00 34.09 ? 440 PRO E CA 1 +ATOM 26327 C C . PRO E 1 440 ? -11.212 26.389 20.569 1.00 34.27 ? 440 PRO E C 1 +ATOM 26328 O O . PRO E 1 440 ? -10.446 25.804 19.810 1.00 34.15 ? 440 PRO E O 1 +ATOM 26329 C CB . PRO E 1 440 ? -13.460 27.140 19.717 1.00 33.30 ? 440 PRO E CB 1 +ATOM 26330 C CG . PRO E 1 440 ? -13.807 28.135 20.773 1.00 34.19 ? 440 PRO E CG 1 +ATOM 26331 C CD . PRO E 1 440 ? -14.311 27.266 21.906 1.00 34.23 ? 440 PRO E CD 1 +ATOM 26332 N N . PHE E 1 441 ? -10.790 27.301 21.435 1.00 33.32 ? 441 PHE E N 1 +ATOM 26333 C CA . PHE E 1 441 ? -9.383 27.658 21.475 1.00 33.71 ? 441 PHE E CA 1 +ATOM 26334 C C . PHE E 1 441 ? -8.606 26.794 22.454 1.00 34.41 ? 441 PHE E C 1 +ATOM 26335 O O . PHE E 1 441 ? -8.534 27.067 23.653 1.00 35.94 ? 441 PHE E O 1 +ATOM 26336 C CB . PHE E 1 441 ? -9.257 29.151 21.774 1.00 32.08 ? 441 PHE E CB 1 +ATOM 26337 C CG . PHE E 1 441 ? -10.115 30.003 20.877 1.00 35.33 ? 441 PHE E CG 1 +ATOM 26338 C CD1 . PHE E 1 441 ? -10.255 29.684 19.526 1.00 33.31 ? 441 PHE E CD1 1 +ATOM 26339 C CD2 . PHE E 1 441 ? -10.800 31.111 21.376 1.00 35.28 ? 441 PHE E CD2 1 +ATOM 26340 C CE1 . PHE E 1 441 ? -11.060 30.453 18.693 1.00 35.09 ? 441 PHE E CE1 1 +ATOM 26341 C CE2 . PHE E 1 441 ? -11.610 31.886 20.542 1.00 34.37 ? 441 PHE E CE2 1 +ATOM 26342 C CZ . PHE E 1 441 ? -11.738 31.554 19.199 1.00 33.98 ? 441 PHE E CZ 1 +ATOM 26343 N N . VAL E 1 442 ? -8.015 25.740 21.907 1.00 33.47 ? 442 VAL E N 1 +ATOM 26344 C CA . VAL E 1 442 ? -7.285 24.768 22.687 1.00 32.21 ? 442 VAL E CA 1 +ATOM 26345 C C . VAL E 1 442 ? -5.947 24.370 22.066 1.00 32.00 ? 442 VAL E C 1 +ATOM 26346 O O . VAL E 1 442 ? -5.668 24.640 20.897 1.00 30.48 ? 442 VAL E O 1 +ATOM 26347 C CB . VAL E 1 442 ? -8.146 23.497 22.852 1.00 32.94 ? 442 VAL E CB 1 +ATOM 26348 C CG1 . VAL E 1 442 ? -9.438 23.829 23.577 1.00 31.88 ? 442 VAL E CG1 1 +ATOM 26349 C CG2 . VAL E 1 442 ? -8.478 22.925 21.479 1.00 31.34 ? 442 VAL E CG2 1 +ATOM 26350 N N . GLY E 1 443 ? -5.132 23.704 22.870 1.00 32.32 ? 443 GLY E N 1 +ATOM 26351 C CA . GLY E 1 443 ? -3.838 23.243 22.420 1.00 33.99 ? 443 GLY E CA 1 +ATOM 26352 C C . GLY E 1 443 ? -3.218 22.388 23.504 1.00 35.44 ? 443 GLY E C 1 +ATOM 26353 O O . GLY E 1 443 ? -3.841 22.134 24.534 1.00 33.50 ? 443 GLY E O 1 +ATOM 26354 N N . CYS E 1 444 ? -1.992 21.940 23.267 1.00 37.42 ? 444 CYS E N 1 +ATOM 26355 C CA . CYS E 1 444 ? -1.270 21.127 24.229 1.00 39.57 ? 444 CYS E CA 1 +ATOM 26356 C C . CYS E 1 444 ? 0.176 21.599 24.220 1.00 39.73 ? 444 CYS E C 1 +ATOM 26357 O O . CYS E 1 444 ? 0.584 22.310 23.306 1.00 39.86 ? 444 CYS E O 1 +ATOM 26358 C CB . CYS E 1 444 ? -1.327 19.657 23.826 1.00 42.12 ? 444 CYS E CB 1 +ATOM 26359 S SG . CYS E 1 444 ? -0.336 19.259 22.360 1.00 46.33 ? 444 CYS E SG 1 +ATOM 26360 N N . ASP E 1 445 ? 0.946 21.214 25.233 1.00 40.16 ? 445 ASP E N 1 +ATOM 26361 C CA . ASP E 1 445 ? 2.345 21.612 25.289 1.00 41.03 ? 445 ASP E CA 1 +ATOM 26362 C C . ASP E 1 445 ? 3.127 20.815 24.254 1.00 39.65 ? 445 ASP E C 1 +ATOM 26363 O O . ASP E 1 445 ? 3.268 19.594 24.362 1.00 39.84 ? 445 ASP E O 1 +ATOM 26364 C CB . ASP E 1 445 ? 2.950 21.379 26.686 1.00 43.96 ? 445 ASP E CB 1 +ATOM 26365 C CG . ASP E 1 445 ? 2.402 22.340 27.745 1.00 50.12 ? 445 ASP E CG 1 +ATOM 26366 O OD1 . ASP E 1 445 ? 2.046 23.501 27.405 1.00 51.87 ? 445 ASP E OD1 1 +ATOM 26367 O OD2 . ASP E 1 445 ? 2.346 21.934 28.932 1.00 51.30 ? 445 ASP E OD2 1 +ATOM 26368 N N . ILE E 1 446 ? 3.619 21.509 23.238 1.00 37.08 ? 446 ILE E N 1 +ATOM 26369 C CA . ILE E 1 446 ? 4.397 20.861 22.197 1.00 37.35 ? 446 ILE E CA 1 +ATOM 26370 C C . ILE E 1 446 ? 5.696 20.339 22.806 1.00 37.14 ? 446 ILE E C 1 +ATOM 26371 O O . ILE E 1 446 ? 6.453 21.094 23.418 1.00 35.88 ? 446 ILE E O 1 +ATOM 26372 C CB . ILE E 1 446 ? 4.717 21.854 21.066 1.00 37.98 ? 446 ILE E CB 1 +ATOM 26373 C CG1 . ILE E 1 446 ? 3.406 22.314 20.419 1.00 35.56 ? 446 ILE E CG1 1 +ATOM 26374 C CG2 . ILE E 1 446 ? 5.668 21.221 20.054 1.00 33.89 ? 446 ILE E CG2 1 +ATOM 26375 C CD1 . ILE E 1 446 ? 3.580 23.437 19.433 1.00 37.73 ? 446 ILE E CD1 1 +ATOM 26376 N N . GLY E 1 447 ? 5.938 19.044 22.638 1.00 36.67 ? 447 GLY E N 1 +ATOM 26377 C CA . GLY E 1 447 ? 7.131 18.432 23.184 1.00 36.78 ? 447 GLY E CA 1 +ATOM 26378 C C . GLY E 1 447 ? 6.873 17.812 24.548 1.00 37.51 ? 447 GLY E C 1 +ATOM 26379 O O . GLY E 1 447 ? 7.738 17.133 25.099 1.00 37.93 ? 447 GLY E O 1 +ATOM 26380 N N . GLY E 1 448 ? 5.683 18.042 25.094 1.00 36.48 ? 448 GLY E N 1 +ATOM 26381 C CA . GLY E 1 448 ? 5.350 17.496 26.395 1.00 34.78 ? 448 GLY E CA 1 +ATOM 26382 C C . GLY E 1 448 ? 5.940 18.279 27.559 1.00 34.66 ? 448 GLY E C 1 +ATOM 26383 O O . GLY E 1 448 ? 7.090 18.721 27.525 1.00 34.64 ? 448 GLY E O 1 +ATOM 26384 N N . PHE E 1 449 ? 5.150 18.440 28.611 1.00 33.32 ? 449 PHE E N 1 +ATOM 26385 C CA . PHE E 1 449 ? 5.592 19.169 29.789 1.00 31.66 ? 449 PHE E CA 1 +ATOM 26386 C C . PHE E 1 449 ? 6.636 18.444 30.657 1.00 30.95 ? 449 PHE E C 1 +ATOM 26387 O O . PHE E 1 449 ? 7.665 19.014 30.988 1.00 29.86 ? 449 PHE E O 1 +ATOM 26388 C CB . PHE E 1 449 ? 4.383 19.516 30.659 1.00 29.33 ? 449 PHE E CB 1 +ATOM 26389 C CG . PHE E 1 449 ? 4.751 20.091 31.994 1.00 29.44 ? 449 PHE E CG 1 +ATOM 26390 C CD1 . PHE E 1 449 ? 5.224 21.406 32.100 1.00 28.64 ? 449 PHE E CD1 1 +ATOM 26391 C CD2 . PHE E 1 449 ? 4.658 19.313 33.148 1.00 27.56 ? 449 PHE E CD2 1 +ATOM 26392 C CE1 . PHE E 1 449 ? 5.596 21.937 33.330 1.00 27.86 ? 449 PHE E CE1 1 +ATOM 26393 C CE2 . PHE E 1 449 ? 5.029 19.831 34.390 1.00 27.59 ? 449 PHE E CE2 1 +ATOM 26394 C CZ . PHE E 1 449 ? 5.501 21.151 34.485 1.00 28.51 ? 449 PHE E CZ 1 +ATOM 26395 N N . GLN E 1 450 ? 6.360 17.196 31.031 1.00 31.73 ? 450 GLN E N 1 +ATOM 26396 C CA . GLN E 1 450 ? 7.260 16.430 31.897 1.00 31.90 ? 450 GLN E CA 1 +ATOM 26397 C C . GLN E 1 450 ? 8.722 16.420 31.440 1.00 32.59 ? 450 GLN E C 1 +ATOM 26398 O O . GLN E 1 450 ? 9.024 16.243 30.261 1.00 30.73 ? 450 GLN E O 1 +ATOM 26399 C CB . GLN E 1 450 ? 6.744 15.005 32.052 1.00 32.21 ? 450 GLN E CB 1 +ATOM 26400 C CG . GLN E 1 450 ? 5.303 14.896 32.570 1.00 33.40 ? 450 GLN E CG 1 +ATOM 26401 C CD . GLN E 1 450 ? 5.102 15.490 33.953 1.00 35.40 ? 450 GLN E CD 1 +ATOM 26402 O OE1 . GLN E 1 450 ? 6.024 15.512 34.771 1.00 37.03 ? 450 GLN E OE1 1 +ATOM 26403 N NE2 . GLN E 1 450 ? 3.882 15.952 34.233 1.00 34.49 ? 450 GLN E NE2 1 +ATOM 26404 N N . GLY E 1 451 ? 9.626 16.612 32.396 1.00 34.39 ? 451 GLY E N 1 +ATOM 26405 C CA . GLY E 1 451 ? 11.045 16.665 32.087 1.00 36.49 ? 451 GLY E CA 1 +ATOM 26406 C C . GLY E 1 451 ? 11.800 15.355 32.182 1.00 37.56 ? 451 GLY E C 1 +ATOM 26407 O O . GLY E 1 451 ? 11.834 14.596 31.222 1.00 39.86 ? 451 GLY E O 1 +ATOM 26408 N N . ARG E 1 452 ? 12.423 15.097 33.328 1.00 37.55 ? 452 ARG E N 1 +ATOM 26409 C CA . ARG E 1 452 ? 13.174 13.860 33.525 1.00 37.46 ? 452 ARG E CA 1 +ATOM 26410 C C . ARG E 1 452 ? 13.077 13.397 34.970 1.00 38.52 ? 452 ARG E C 1 +ATOM 26411 O O . ARG E 1 452 ? 14.061 12.945 35.560 1.00 38.75 ? 452 ARG E O 1 +ATOM 26412 C CB . ARG E 1 452 ? 14.646 14.054 33.154 1.00 34.79 ? 452 ARG E CB 1 +ATOM 26413 C CG . ARG E 1 452 ? 14.886 14.348 31.698 1.00 33.51 ? 452 ARG E CG 1 +ATOM 26414 C CD . ARG E 1 452 ? 15.648 15.623 31.564 1.00 35.22 ? 452 ARG E CD 1 +ATOM 26415 N NE . ARG E 1 452 ? 17.026 15.408 31.153 1.00 37.09 ? 452 ARG E NE 1 +ATOM 26416 C CZ . ARG E 1 452 ? 18.007 16.287 31.323 1.00 36.32 ? 452 ARG E CZ 1 +ATOM 26417 N NH1 . ARG E 1 452 ? 17.773 17.453 31.913 1.00 33.52 ? 452 ARG E NH1 1 +ATOM 26418 N NH2 . ARG E 1 452 ? 19.223 15.998 30.881 1.00 38.33 ? 452 ARG E NH2 1 +ATOM 26419 N N . ASN E 1 453 ? 11.886 13.504 35.544 1.00 39.54 ? 453 ASN E N 1 +ATOM 26420 C CA . ASN E 1 453 ? 11.699 13.091 36.925 1.00 40.78 ? 453 ASN E CA 1 +ATOM 26421 C C . ASN E 1 453 ? 11.223 11.647 37.050 1.00 39.93 ? 453 ASN E C 1 +ATOM 26422 O O . ASN E 1 453 ? 10.991 11.166 38.149 1.00 40.37 ? 453 ASN E O 1 +ATOM 26423 C CB . ASN E 1 453 ? 10.758 14.058 37.655 1.00 42.24 ? 453 ASN E CB 1 +ATOM 26424 C CG . ASN E 1 453 ? 9.453 14.286 36.914 1.00 46.15 ? 453 ASN E CG 1 +ATOM 26425 O OD1 . ASN E 1 453 ? 9.439 14.655 35.734 1.00 47.78 ? 453 ASN E OD1 1 +ATOM 26426 N ND2 . ASN E 1 453 ? 8.341 14.079 37.611 1.00 47.98 ? 453 ASN E ND2 1 +ATOM 26427 N N . PHE E 1 454 ? 11.079 10.962 35.918 1.00 39.31 ? 454 PHE E N 1 +ATOM 26428 C CA . PHE E 1 454 ? 10.707 9.550 35.914 1.00 39.18 ? 454 PHE E CA 1 +ATOM 26429 C C . PHE E 1 454 ? 11.045 8.899 34.571 1.00 39.76 ? 454 PHE E C 1 +ATOM 26430 O O . PHE E 1 454 ? 11.034 9.553 33.529 1.00 41.85 ? 454 PHE E O 1 +ATOM 26431 C CB . PHE E 1 454 ? 9.235 9.334 36.332 1.00 37.35 ? 454 PHE E CB 1 +ATOM 26432 C CG . PHE E 1 454 ? 8.224 9.958 35.424 1.00 37.43 ? 454 PHE E CG 1 +ATOM 26433 C CD1 . PHE E 1 454 ? 7.732 9.260 34.330 1.00 36.49 ? 454 PHE E CD1 1 +ATOM 26434 C CD2 . PHE E 1 454 ? 7.734 11.240 35.683 1.00 38.60 ? 454 PHE E CD2 1 +ATOM 26435 C CE1 . PHE E 1 454 ? 6.763 9.820 33.502 1.00 37.65 ? 454 PHE E CE1 1 +ATOM 26436 C CE2 . PHE E 1 454 ? 6.758 11.818 34.857 1.00 38.35 ? 454 PHE E CE2 1 +ATOM 26437 C CZ . PHE E 1 454 ? 6.273 11.106 33.766 1.00 37.38 ? 454 PHE E CZ 1 +ATOM 26438 N N . ALA E 1 455 ? 11.372 7.611 34.620 1.00 39.52 ? 455 ALA E N 1 +ATOM 26439 C CA . ALA E 1 455 ? 11.801 6.826 33.459 1.00 40.56 ? 455 ALA E CA 1 +ATOM 26440 C C . ALA E 1 455 ? 10.956 6.784 32.186 1.00 41.36 ? 455 ALA E C 1 +ATOM 26441 O O . ALA E 1 455 ? 11.499 6.776 31.078 1.00 40.15 ? 455 ALA E O 1 +ATOM 26442 C CB . ALA E 1 455 ? 12.086 5.388 33.911 1.00 38.84 ? 455 ALA E CB 1 +ATOM 26443 N N . GLU E 1 456 ? 9.638 6.733 32.339 1.00 43.53 ? 456 GLU E N 1 +ATOM 26444 C CA . GLU E 1 456 ? 8.746 6.639 31.187 1.00 45.04 ? 456 GLU E CA 1 +ATOM 26445 C C . GLU E 1 456 ? 8.546 7.932 30.404 1.00 44.83 ? 456 GLU E C 1 +ATOM 26446 O O . GLU E 1 456 ? 7.427 8.247 30.021 1.00 47.23 ? 456 GLU E O 1 +ATOM 26447 C CB . GLU E 1 456 ? 7.382 6.106 31.629 1.00 46.99 ? 456 GLU E CB 1 +ATOM 26448 C CG . GLU E 1 456 ? 7.418 4.760 32.360 1.00 50.22 ? 456 GLU E CG 1 +ATOM 26449 C CD . GLU E 1 456 ? 8.158 4.814 33.703 1.00 53.17 ? 456 GLU E CD 1 +ATOM 26450 O OE1 . GLU E 1 456 ? 8.023 5.827 34.432 1.00 50.32 ? 456 GLU E OE1 1 +ATOM 26451 O OE2 . GLU E 1 456 ? 8.861 3.827 34.033 1.00 55.52 ? 456 GLU E OE2 1 +ATOM 26452 N N . ILE E 1 457 ? 9.623 8.674 30.169 1.00 44.03 ? 457 ILE E N 1 +ATOM 26453 C CA . ILE E 1 457 ? 9.560 9.920 29.418 1.00 41.79 ? 457 ILE E CA 1 +ATOM 26454 C C . ILE E 1 457 ? 10.469 9.772 28.204 1.00 42.71 ? 457 ILE E C 1 +ATOM 26455 O O . ILE E 1 457 ? 11.623 9.355 28.332 1.00 43.96 ? 457 ILE E O 1 +ATOM 26456 C CB . ILE E 1 457 ? 10.041 11.115 30.258 1.00 41.83 ? 457 ILE E CB 1 +ATOM 26457 C CG1 . ILE E 1 457 ? 9.154 11.273 31.493 1.00 41.49 ? 457 ILE E CG1 1 +ATOM 26458 C CG2 . ILE E 1 457 ? 10.000 12.397 29.424 1.00 41.01 ? 457 ILE E CG2 1 +ATOM 26459 C CD1 . ILE E 1 457 ? 9.549 12.436 32.395 1.00 40.00 ? 457 ILE E CD1 1 +ATOM 26460 N N . ASP E 1 458 ? 9.949 10.111 27.028 1.00 41.65 ? 458 ASP E N 1 +ATOM 26461 C CA . ASP E 1 458 ? 10.706 9.996 25.788 1.00 41.32 ? 458 ASP E CA 1 +ATOM 26462 C C . ASP E 1 458 ? 11.095 11.366 25.238 1.00 40.76 ? 458 ASP E C 1 +ATOM 26463 O O . ASP E 1 458 ? 10.255 12.076 24.691 1.00 40.09 ? 458 ASP E O 1 +ATOM 26464 C CB . ASP E 1 458 ? 9.873 9.251 24.744 1.00 42.79 ? 458 ASP E CB 1 +ATOM 26465 C CG . ASP E 1 458 ? 10.665 8.908 23.493 1.00 45.27 ? 458 ASP E CG 1 +ATOM 26466 O OD1 . ASP E 1 458 ? 11.661 9.604 23.207 1.00 47.27 ? 458 ASP E OD1 1 +ATOM 26467 O OD2 . ASP E 1 458 ? 10.283 7.947 22.783 1.00 46.42 ? 458 ASP E OD2 1 +ATOM 26468 N N . ASN E 1 459 ? 12.370 11.728 25.364 1.00 40.55 ? 459 ASN E N 1 +ATOM 26469 C CA . ASN E 1 459 ? 12.837 13.019 24.874 1.00 40.92 ? 459 ASN E CA 1 +ATOM 26470 C C . ASN E 1 459 ? 13.556 12.981 23.525 1.00 40.78 ? 459 ASN E C 1 +ATOM 26471 O O . ASN E 1 459 ? 14.347 13.872 23.220 1.00 42.99 ? 459 ASN E O 1 +ATOM 26472 C CB . ASN E 1 459 ? 13.739 13.676 25.917 1.00 41.81 ? 459 ASN E CB 1 +ATOM 26473 C CG . ASN E 1 459 ? 12.978 14.076 27.160 1.00 43.19 ? 459 ASN E CG 1 +ATOM 26474 O OD1 . ASN E 1 459 ? 12.046 14.881 27.097 1.00 44.65 ? 459 ASN E OD1 1 +ATOM 26475 N ND2 . ASN E 1 459 ? 13.365 13.515 28.299 1.00 42.18 ? 459 ASN E ND2 1 +ATOM 26476 N N . SER E 1 460 ? 13.288 11.966 22.711 1.00 39.38 ? 460 SER E N 1 +ATOM 26477 C CA . SER E 1 460 ? 13.925 11.890 21.404 1.00 39.97 ? 460 SER E CA 1 +ATOM 26478 C C . SER E 1 460 ? 13.488 13.078 20.521 1.00 39.44 ? 460 SER E C 1 +ATOM 26479 O O . SER E 1 460 ? 12.359 13.571 20.613 1.00 37.40 ? 460 SER E O 1 +ATOM 26480 C CB . SER E 1 460 ? 13.575 10.573 20.723 1.00 40.22 ? 460 SER E CB 1 +ATOM 26481 O OG . SER E 1 460 ? 12.194 10.510 20.459 1.00 43.91 ? 460 SER E OG 1 +ATOM 26482 N N . MET E 1 461 ? 14.389 13.524 19.658 1.00 38.77 ? 461 MET E N 1 +ATOM 26483 C CA . MET E 1 461 ? 14.118 14.664 18.802 1.00 38.95 ? 461 MET E CA 1 +ATOM 26484 C C . MET E 1 461 ? 13.124 14.433 17.676 1.00 38.67 ? 461 MET E C 1 +ATOM 26485 O O . MET E 1 461 ? 12.428 15.360 17.273 1.00 38.27 ? 461 MET E O 1 +ATOM 26486 C CB . MET E 1 461 ? 15.432 15.209 18.248 1.00 39.11 ? 461 MET E CB 1 +ATOM 26487 C CG . MET E 1 461 ? 16.343 15.725 19.346 1.00 40.12 ? 461 MET E CG 1 +ATOM 26488 S SD . MET E 1 461 ? 17.972 16.204 18.751 1.00 45.20 ? 461 MET E SD 1 +ATOM 26489 C CE . MET E 1 461 ? 18.720 14.582 18.455 1.00 41.68 ? 461 MET E CE 1 +ATOM 26490 N N . ASP E 1 462 ? 13.041 13.217 17.158 1.00 38.42 ? 462 ASP E N 1 +ATOM 26491 C CA . ASP E 1 462 ? 12.085 12.975 16.092 1.00 40.98 ? 462 ASP E CA 1 +ATOM 26492 C C . ASP E 1 462 ? 10.653 12.971 16.656 1.00 39.92 ? 462 ASP E C 1 +ATOM 26493 O O . ASP E 1 462 ? 9.694 13.283 15.943 1.00 38.43 ? 462 ASP E O 1 +ATOM 26494 C CB . ASP E 1 462 ? 12.408 11.670 15.354 1.00 45.13 ? 462 ASP E CB 1 +ATOM 26495 C CG . ASP E 1 462 ? 12.319 10.453 16.241 1.00 51.75 ? 462 ASP E CG 1 +ATOM 26496 O OD1 . ASP E 1 462 ? 12.768 10.518 17.415 1.00 55.79 ? 462 ASP E OD1 1 +ATOM 26497 O OD2 . ASP E 1 462 ? 11.812 9.417 15.755 1.00 55.02 ? 462 ASP E OD2 1 +ATOM 26498 N N . LEU E 1 463 ? 10.515 12.636 17.938 1.00 36.85 ? 463 LEU E N 1 +ATOM 26499 C CA . LEU E 1 463 ? 9.211 12.649 18.586 1.00 33.82 ? 463 LEU E CA 1 +ATOM 26500 C C . LEU E 1 463 ? 8.839 14.131 18.746 1.00 33.75 ? 463 LEU E C 1 +ATOM 26501 O O . LEU E 1 463 ? 7.694 14.529 18.523 1.00 32.71 ? 463 LEU E O 1 +ATOM 26502 C CB . LEU E 1 463 ? 9.281 12.002 19.974 1.00 30.85 ? 463 LEU E CB 1 +ATOM 26503 C CG . LEU E 1 463 ? 8.006 11.448 20.633 1.00 31.07 ? 463 LEU E CG 1 +ATOM 26504 C CD1 . LEU E 1 463 ? 8.156 11.513 22.136 1.00 26.79 ? 463 LEU E CD1 1 +ATOM 26505 C CD2 . LEU E 1 463 ? 6.774 12.210 20.211 1.00 30.65 ? 463 LEU E CD2 1 +ATOM 26506 N N . LEU E 1 464 ? 9.818 14.941 19.143 1.00 32.98 ? 464 LEU E N 1 +ATOM 26507 C CA . LEU E 1 464 ? 9.595 16.368 19.335 1.00 32.79 ? 464 LEU E CA 1 +ATOM 26508 C C . LEU E 1 464 ? 9.086 16.971 18.029 1.00 32.43 ? 464 LEU E C 1 +ATOM 26509 O O . LEU E 1 464 ? 8.135 17.756 18.022 1.00 32.42 ? 464 LEU E O 1 +ATOM 26510 C CB . LEU E 1 464 ? 10.894 17.062 19.763 1.00 30.73 ? 464 LEU E CB 1 +ATOM 26511 C CG . LEU E 1 464 ? 10.835 18.593 19.839 1.00 30.65 ? 464 LEU E CG 1 +ATOM 26512 C CD1 . LEU E 1 464 ? 9.805 19.023 20.880 1.00 29.17 ? 464 LEU E CD1 1 +ATOM 26513 C CD2 . LEU E 1 464 ? 12.211 19.137 20.194 1.00 29.56 ? 464 LEU E CD2 1 +ATOM 26514 N N . VAL E 1 465 ? 9.719 16.596 16.926 1.00 30.75 ? 465 VAL E N 1 +ATOM 26515 C CA . VAL E 1 465 ? 9.306 17.091 15.624 1.00 30.89 ? 465 VAL E CA 1 +ATOM 26516 C C . VAL E 1 465 ? 7.863 16.679 15.337 1.00 30.99 ? 465 VAL E C 1 +ATOM 26517 O O . VAL E 1 465 ? 7.102 17.456 14.776 1.00 31.89 ? 465 VAL E O 1 +ATOM 26518 C CB . VAL E 1 465 ? 10.232 16.569 14.508 1.00 30.64 ? 465 VAL E CB 1 +ATOM 26519 C CG1 . VAL E 1 465 ? 9.647 16.884 13.159 1.00 30.77 ? 465 VAL E CG1 1 +ATOM 26520 C CG2 . VAL E 1 465 ? 11.605 17.213 14.633 1.00 30.44 ? 465 VAL E CG2 1 +ATOM 26521 N N . LYS E 1 466 ? 7.483 15.467 15.735 1.00 31.28 ? 466 LYS E N 1 +ATOM 26522 C CA . LYS E 1 466 ? 6.116 14.998 15.522 1.00 31.73 ? 466 LYS E CA 1 +ATOM 26523 C C . LYS E 1 466 ? 5.103 15.812 16.325 1.00 31.05 ? 466 LYS E C 1 +ATOM 26524 O O . LYS E 1 466 ? 3.955 15.948 15.915 1.00 32.50 ? 466 LYS E O 1 +ATOM 26525 C CB . LYS E 1 466 ? 5.978 13.516 15.884 1.00 33.79 ? 466 LYS E CB 1 +ATOM 26526 C CG . LYS E 1 466 ? 6.704 12.581 14.939 1.00 36.42 ? 466 LYS E CG 1 +ATOM 26527 C CD . LYS E 1 466 ? 6.294 12.826 13.502 1.00 39.94 ? 466 LYS E CD 1 +ATOM 26528 C CE . LYS E 1 466 ? 6.974 11.844 12.563 1.00 41.41 ? 466 LYS E CE 1 +ATOM 26529 N NZ . LYS E 1 466 ? 6.637 12.150 11.143 1.00 45.63 ? 466 LYS E NZ 1 +ATOM 26530 N N . TYR E 1 467 ? 5.517 16.337 17.471 1.00 29.06 ? 467 TYR E N 1 +ATOM 26531 C CA . TYR E 1 467 ? 4.625 17.151 18.282 1.00 30.37 ? 467 TYR E CA 1 +ATOM 26532 C C . TYR E 1 467 ? 4.317 18.454 17.537 1.00 30.63 ? 467 TYR E C 1 +ATOM 26533 O O . TYR E 1 467 ? 3.165 18.881 17.459 1.00 30.44 ? 467 TYR E O 1 +ATOM 26534 C CB . TYR E 1 467 ? 5.268 17.476 19.625 1.00 29.98 ? 467 TYR E CB 1 +ATOM 26535 C CG . TYR E 1 467 ? 4.880 16.546 20.743 1.00 32.28 ? 467 TYR E CG 1 +ATOM 26536 C CD1 . TYR E 1 467 ? 3.652 16.677 21.400 1.00 33.39 ? 467 TYR E CD1 1 +ATOM 26537 C CD2 . TYR E 1 467 ? 5.744 15.525 21.151 1.00 33.23 ? 467 TYR E CD2 1 +ATOM 26538 C CE1 . TYR E 1 467 ? 3.299 15.812 22.442 1.00 34.18 ? 467 TYR E CE1 1 +ATOM 26539 C CE2 . TYR E 1 467 ? 5.405 14.654 22.177 1.00 32.54 ? 467 TYR E CE2 1 +ATOM 26540 C CZ . TYR E 1 467 ? 4.188 14.799 22.820 1.00 34.69 ? 467 TYR E CZ 1 +ATOM 26541 O OH . TYR E 1 467 ? 3.871 13.923 23.832 1.00 34.63 ? 467 TYR E OH 1 +ATOM 26542 N N . TYR E 1 468 ? 5.357 19.086 17.005 1.00 29.84 ? 468 TYR E N 1 +ATOM 26543 C CA . TYR E 1 468 ? 5.201 20.324 16.254 1.00 30.06 ? 468 TYR E CA 1 +ATOM 26544 C C . TYR E 1 468 ? 4.267 20.097 15.076 1.00 30.44 ? 468 TYR E C 1 +ATOM 26545 O O . TYR E 1 468 ? 3.423 20.940 14.763 1.00 28.30 ? 468 TYR E O 1 +ATOM 26546 C CB . TYR E 1 468 ? 6.558 20.802 15.742 1.00 31.18 ? 468 TYR E CB 1 +ATOM 26547 C CG . TYR E 1 468 ? 7.304 21.670 16.727 1.00 31.50 ? 468 TYR E CG 1 +ATOM 26548 C CD1 . TYR E 1 468 ? 7.022 23.037 16.827 1.00 31.46 ? 468 TYR E CD1 1 +ATOM 26549 C CD2 . TYR E 1 468 ? 8.272 21.131 17.571 1.00 29.46 ? 468 TYR E CD2 1 +ATOM 26550 C CE1 . TYR E 1 468 ? 7.688 23.846 17.740 1.00 32.55 ? 468 TYR E CE1 1 +ATOM 26551 C CE2 . TYR E 1 468 ? 8.945 21.933 18.497 1.00 31.75 ? 468 TYR E CE2 1 +ATOM 26552 C CZ . TYR E 1 468 ? 8.651 23.288 18.572 1.00 32.71 ? 468 TYR E CZ 1 +ATOM 26553 O OH . TYR E 1 468 ? 9.326 24.094 19.456 1.00 35.08 ? 468 TYR E OH 1 +ATOM 26554 N N . ALA E 1 469 ? 4.420 18.943 14.434 1.00 30.58 ? 469 ALA E N 1 +ATOM 26555 C CA . ALA E 1 469 ? 3.600 18.594 13.286 1.00 30.75 ? 469 ALA E CA 1 +ATOM 26556 C C . ALA E 1 469 ? 2.168 18.240 13.688 1.00 30.62 ? 469 ALA E C 1 +ATOM 26557 O O . ALA E 1 469 ? 1.228 18.540 12.966 1.00 30.66 ? 469 ALA E O 1 +ATOM 26558 C CB . ALA E 1 469 ? 4.240 17.438 12.531 1.00 28.55 ? 469 ALA E CB 1 +ATOM 26559 N N . LEU E 1 470 ? 2.010 17.606 14.842 1.00 31.05 ? 470 LEU E N 1 +ATOM 26560 C CA . LEU E 1 470 ? 0.690 17.205 15.322 1.00 31.65 ? 470 LEU E CA 1 +ATOM 26561 C C . LEU E 1 470 ? -0.220 18.400 15.570 1.00 32.10 ? 470 LEU E C 1 +ATOM 26562 O O . LEU E 1 470 ? -1.391 18.399 15.191 1.00 33.54 ? 470 LEU E O 1 +ATOM 26563 C CB . LEU E 1 470 ? 0.815 16.412 16.626 1.00 31.73 ? 470 LEU E CB 1 +ATOM 26564 C CG . LEU E 1 470 ? -0.529 16.065 17.276 1.00 32.36 ? 470 LEU E CG 1 +ATOM 26565 C CD1 . LEU E 1 470 ? -1.169 14.923 16.512 1.00 32.88 ? 470 LEU E CD1 1 +ATOM 26566 C CD2 . LEU E 1 470 ? -0.335 15.675 18.734 1.00 32.89 ? 470 LEU E CD2 1 +ATOM 26567 N N . ALA E 1 471 ? 0.329 19.414 16.223 1.00 32.27 ? 471 ALA E N 1 +ATOM 26568 C CA . ALA E 1 471 ? -0.411 20.617 16.560 1.00 30.79 ? 471 ALA E CA 1 +ATOM 26569 C C . ALA E 1 471 ? -0.358 21.692 15.474 1.00 30.56 ? 471 ALA E C 1 +ATOM 26570 O O . ALA E 1 471 ? -0.719 22.837 15.727 1.00 29.49 ? 471 ALA E O 1 +ATOM 26571 C CB . ALA E 1 471 ? 0.117 21.167 17.859 1.00 31.42 ? 471 ALA E CB 1 +ATOM 26572 N N . LEU E 1 472 ? 0.084 21.317 14.274 1.00 30.72 ? 472 LEU E N 1 +ATOM 26573 C CA . LEU E 1 472 ? 0.184 22.244 13.151 1.00 33.17 ? 472 LEU E CA 1 +ATOM 26574 C C . LEU E 1 472 ? -1.024 23.171 13.020 1.00 34.68 ? 472 LEU E C 1 +ATOM 26575 O O . LEU E 1 472 ? -0.872 24.375 12.795 1.00 35.56 ? 472 LEU E O 1 +ATOM 26576 C CB . LEU E 1 472 ? 0.361 21.470 11.839 1.00 33.34 ? 472 LEU E CB 1 +ATOM 26577 C CG . LEU E 1 472 ? 0.394 22.309 10.555 1.00 33.73 ? 472 LEU E CG 1 +ATOM 26578 C CD1 . LEU E 1 472 ? 1.499 23.344 10.646 1.00 34.24 ? 472 LEU E CD1 1 +ATOM 26579 C CD2 . LEU E 1 472 ? 0.623 21.400 9.358 1.00 33.39 ? 472 LEU E CD2 1 +ATOM 26580 N N . PHE E 1 473 ? -2.221 22.611 13.167 1.00 33.85 ? 473 PHE E N 1 +ATOM 26581 C CA . PHE E 1 473 ? -3.438 23.397 13.048 1.00 33.72 ? 473 PHE E CA 1 +ATOM 26582 C C . PHE E 1 473 ? -4.202 23.641 14.342 1.00 33.99 ? 473 PHE E C 1 +ATOM 26583 O O . PHE E 1 473 ? -5.318 24.145 14.296 1.00 34.45 ? 473 PHE E O 1 +ATOM 26584 C CB . PHE E 1 473 ? -4.366 22.751 12.024 1.00 32.61 ? 473 PHE E CB 1 +ATOM 26585 C CG . PHE E 1 473 ? -3.795 22.714 10.640 1.00 32.10 ? 473 PHE E CG 1 +ATOM 26586 C CD1 . PHE E 1 473 ? -3.692 23.878 9.889 1.00 32.03 ? 473 PHE E CD1 1 +ATOM 26587 C CD2 . PHE E 1 473 ? -3.340 21.526 10.092 1.00 29.08 ? 473 PHE E CD2 1 +ATOM 26588 C CE1 . PHE E 1 473 ? -3.146 23.860 8.615 1.00 31.16 ? 473 PHE E CE1 1 +ATOM 26589 C CE2 . PHE E 1 473 ? -2.793 21.501 8.817 1.00 30.97 ? 473 PHE E CE2 1 +ATOM 26590 C CZ . PHE E 1 473 ? -2.697 22.675 8.077 1.00 30.44 ? 473 PHE E CZ 1 +ATOM 26591 N N . PHE E 1 474 ? -3.628 23.276 15.486 1.00 32.92 ? 474 PHE E N 1 +ATOM 26592 C CA . PHE E 1 474 ? -4.301 23.531 16.756 1.00 33.81 ? 474 PHE E CA 1 +ATOM 26593 C C . PHE E 1 474 ? -4.366 25.052 16.933 1.00 35.20 ? 474 PHE E C 1 +ATOM 26594 O O . PHE E 1 474 ? -3.463 25.780 16.494 1.00 37.08 ? 474 PHE E O 1 +ATOM 26595 C CB . PHE E 1 474 ? -3.516 22.943 17.941 1.00 33.69 ? 474 PHE E CB 1 +ATOM 26596 C CG . PHE E 1 474 ? -3.565 21.434 18.044 1.00 33.71 ? 474 PHE E CG 1 +ATOM 26597 C CD1 . PHE E 1 474 ? -4.216 20.665 17.083 1.00 33.15 ? 474 PHE E CD1 1 +ATOM 26598 C CD2 . PHE E 1 474 ? -2.929 20.784 19.103 1.00 32.31 ? 474 PHE E CD2 1 +ATOM 26599 C CE1 . PHE E 1 474 ? -4.228 19.270 17.174 1.00 33.91 ? 474 PHE E CE1 1 +ATOM 26600 C CE2 . PHE E 1 474 ? -2.935 19.393 19.204 1.00 32.71 ? 474 PHE E CE2 1 +ATOM 26601 C CZ . PHE E 1 474 ? -3.587 18.632 18.234 1.00 32.93 ? 474 PHE E CZ 1 +ATOM 26602 N N . PRO E 1 475 ? -5.438 25.559 17.557 1.00 35.45 ? 475 PRO E N 1 +ATOM 26603 C CA . PRO E 1 475 ? -5.559 27.004 17.768 1.00 35.47 ? 475 PRO E CA 1 +ATOM 26604 C C . PRO E 1 475 ? -4.408 27.551 18.615 1.00 36.24 ? 475 PRO E C 1 +ATOM 26605 O O . PRO E 1 475 ? -3.778 28.547 18.257 1.00 37.64 ? 475 PRO E O 1 +ATOM 26606 C CB . PRO E 1 475 ? -6.900 27.130 18.478 1.00 35.56 ? 475 PRO E CB 1 +ATOM 26607 C CG . PRO E 1 475 ? -7.701 26.037 17.842 1.00 35.82 ? 475 PRO E CG 1 +ATOM 26608 C CD . PRO E 1 475 ? -6.720 24.882 17.825 1.00 35.38 ? 475 PRO E CD 1 +ATOM 26609 N N . PHE E 1 476 ? -4.142 26.899 19.743 1.00 35.40 ? 476 PHE E N 1 +ATOM 26610 C CA . PHE E 1 476 ? -3.067 27.319 20.642 1.00 35.26 ? 476 PHE E CA 1 +ATOM 26611 C C . PHE E 1 476 ? -1.807 26.484 20.353 1.00 34.97 ? 476 PHE E C 1 +ATOM 26612 O O . PHE E 1 476 ? -1.810 25.260 20.515 1.00 37.01 ? 476 PHE E O 1 +ATOM 26613 C CB . PHE E 1 476 ? -3.529 27.146 22.086 1.00 33.73 ? 476 PHE E CB 1 +ATOM 26614 C CG . PHE E 1 476 ? -2.589 27.715 23.092 1.00 35.09 ? 476 PHE E CG 1 +ATOM 26615 C CD1 . PHE E 1 476 ? -2.238 29.057 23.047 1.00 34.74 ? 476 PHE E CD1 1 +ATOM 26616 C CD2 . PHE E 1 476 ? -2.052 26.911 24.097 1.00 35.71 ? 476 PHE E CD2 1 +ATOM 26617 C CE1 . PHE E 1 476 ? -1.362 29.603 23.988 1.00 35.34 ? 476 PHE E CE1 1 +ATOM 26618 C CE2 . PHE E 1 476 ? -1.174 27.444 25.048 1.00 36.65 ? 476 PHE E CE2 1 +ATOM 26619 C CZ . PHE E 1 476 ? -0.830 28.798 24.989 1.00 36.21 ? 476 PHE E CZ 1 +ATOM 26620 N N . TYR E 1 477 ? -0.743 27.159 19.924 1.00 32.61 ? 477 TYR E N 1 +ATOM 26621 C CA . TYR E 1 477 ? 0.520 26.523 19.542 1.00 31.43 ? 477 TYR E CA 1 +ATOM 26622 C C . TYR E 1 477 ? 1.681 26.965 20.448 1.00 32.95 ? 477 TYR E C 1 +ATOM 26623 O O . TYR E 1 477 ? 2.401 27.918 20.133 1.00 30.97 ? 477 TYR E O 1 +ATOM 26624 C CB . TYR E 1 477 ? 0.821 26.918 18.098 1.00 29.82 ? 477 TYR E CB 1 +ATOM 26625 C CG . TYR E 1 477 ? 1.752 26.003 17.345 1.00 30.34 ? 477 TYR E CG 1 +ATOM 26626 C CD1 . TYR E 1 477 ? 1.319 24.754 16.890 1.00 26.96 ? 477 TYR E CD1 1 +ATOM 26627 C CD2 . TYR E 1 477 ? 3.060 26.399 17.048 1.00 28.87 ? 477 TYR E CD2 1 +ATOM 26628 C CE1 . TYR E 1 477 ? 2.156 23.930 16.155 1.00 27.11 ? 477 TYR E CE1 1 +ATOM 26629 C CE2 . TYR E 1 477 ? 3.907 25.580 16.315 1.00 28.39 ? 477 TYR E CE2 1 +ATOM 26630 C CZ . TYR E 1 477 ? 3.448 24.348 15.868 1.00 29.02 ? 477 TYR E CZ 1 +ATOM 26631 O OH . TYR E 1 477 ? 4.284 23.557 15.116 1.00 29.17 ? 477 TYR E OH 1 +ATOM 26632 N N . ARG E 1 478 ? 1.875 26.262 21.558 1.00 34.32 ? 478 ARG E N 1 +ATOM 26633 C CA . ARG E 1 478 ? 2.926 26.612 22.500 1.00 33.96 ? 478 ARG E CA 1 +ATOM 26634 C C . ARG E 1 478 ? 3.848 25.474 22.916 1.00 35.59 ? 478 ARG E C 1 +ATOM 26635 O O . ARG E 1 478 ? 3.412 24.349 23.150 1.00 36.11 ? 478 ARG E O 1 +ATOM 26636 C CB . ARG E 1 478 ? 2.305 27.206 23.762 1.00 34.05 ? 478 ARG E CB 1 +ATOM 26637 C CG . ARG E 1 478 ? 3.321 27.591 24.821 1.00 36.36 ? 478 ARG E CG 1 +ATOM 26638 C CD . ARG E 1 478 ? 2.672 28.069 26.110 1.00 37.02 ? 478 ARG E CD 1 +ATOM 26639 N NE . ARG E 1 478 ? 2.030 26.984 26.841 1.00 38.22 ? 478 ARG E NE 1 +ATOM 26640 C CZ . ARG E 1 478 ? 1.862 26.973 28.161 1.00 39.67 ? 478 ARG E CZ 1 +ATOM 26641 N NH1 . ARG E 1 478 ? 2.292 27.987 28.900 1.00 39.27 ? 478 ARG E NH1 1 +ATOM 26642 N NH2 . ARG E 1 478 ? 1.266 25.945 28.748 1.00 41.47 ? 478 ARG E NH2 1 +ATOM 26643 N N . SER E 1 479 ? 5.133 25.789 23.010 1.00 36.69 ? 479 SER E N 1 +ATOM 26644 C CA . SER E 1 479 ? 6.146 24.842 23.454 1.00 36.94 ? 479 SER E CA 1 +ATOM 26645 C C . SER E 1 479 ? 6.366 25.162 24.933 1.00 36.88 ? 479 SER E C 1 +ATOM 26646 O O . SER E 1 479 ? 6.666 26.299 25.287 1.00 37.87 ? 479 SER E O 1 +ATOM 26647 C CB . SER E 1 479 ? 7.443 25.065 22.690 1.00 38.41 ? 479 SER E CB 1 +ATOM 26648 O OG . SER E 1 479 ? 8.471 24.270 23.237 1.00 42.87 ? 479 SER E OG 1 +ATOM 26649 N N . HIS E 1 480 ? 6.211 24.173 25.797 1.00 36.10 ? 480 HIS E N 1 +ATOM 26650 C CA . HIS E 1 480 ? 6.380 24.391 27.230 1.00 36.98 ? 480 HIS E CA 1 +ATOM 26651 C C . HIS E 1 480 ? 7.051 23.154 27.802 1.00 36.70 ? 480 HIS E C 1 +ATOM 26652 O O . HIS E 1 480 ? 6.751 22.039 27.378 1.00 38.74 ? 480 HIS E O 1 +ATOM 26653 C CB . HIS E 1 480 ? 5.009 24.619 27.881 1.00 36.89 ? 480 HIS E CB 1 +ATOM 26654 C CG . HIS E 1 480 ? 5.072 24.966 29.337 1.00 37.30 ? 480 HIS E CG 1 +ATOM 26655 N ND1 . HIS E 1 480 ? 5.884 25.967 29.831 1.00 36.69 ? 480 HIS E ND1 1 +ATOM 26656 C CD2 . HIS E 1 480 ? 4.390 24.476 30.401 1.00 36.80 ? 480 HIS E CD2 1 +ATOM 26657 C CE1 . HIS E 1 480 ? 5.699 26.078 31.136 1.00 36.05 ? 480 HIS E CE1 1 +ATOM 26658 N NE2 . HIS E 1 480 ? 4.798 25.185 31.506 1.00 38.30 ? 480 HIS E NE2 1 +ATOM 26659 N N . LYS E 1 481 ? 7.954 23.344 28.757 1.00 34.58 ? 481 LYS E N 1 +ATOM 26660 C CA . LYS E 1 481 ? 8.678 22.220 29.330 1.00 34.38 ? 481 LYS E CA 1 +ATOM 26661 C C . LYS E 1 481 ? 8.955 22.445 30.805 1.00 33.34 ? 481 LYS E C 1 +ATOM 26662 O O . LYS E 1 481 ? 9.105 23.584 31.237 1.00 35.39 ? 481 LYS E O 1 +ATOM 26663 C CB . LYS E 1 481 ? 9.992 22.034 28.554 1.00 35.84 ? 481 LYS E CB 1 +ATOM 26664 C CG . LYS E 1 481 ? 10.954 20.994 29.113 1.00 38.06 ? 481 LYS E CG 1 +ATOM 26665 C CD . LYS E 1 481 ? 10.397 19.574 29.025 1.00 38.43 ? 481 LYS E CD 1 +ATOM 26666 C CE . LYS E 1 481 ? 10.352 19.052 27.598 1.00 38.46 ? 481 LYS E CE 1 +ATOM 26667 N NZ . LYS E 1 481 ? 9.916 17.627 27.572 1.00 38.98 ? 481 LYS E NZ 1 +ATOM 26668 N N . ALA E 1 482 ? 9.010 21.361 31.572 1.00 31.28 ? 482 ALA E N 1 +ATOM 26669 C CA . ALA E 1 482 ? 9.284 21.429 33.006 1.00 31.94 ? 482 ALA E CA 1 +ATOM 26670 C C . ALA E 1 482 ? 10.743 21.826 33.310 1.00 32.53 ? 482 ALA E C 1 +ATOM 26671 O O . ALA E 1 482 ? 11.624 21.746 32.452 1.00 30.65 ? 482 ALA E O 1 +ATOM 26672 C CB . ALA E 1 482 ? 8.957 20.093 33.658 1.00 31.37 ? 482 ALA E CB 1 +ATOM 26673 N N . THR E 1 483 ? 10.990 22.234 34.550 1.00 33.54 ? 483 THR E N 1 +ATOM 26674 C CA . THR E 1 483 ? 12.314 22.683 34.968 1.00 33.81 ? 483 THR E CA 1 +ATOM 26675 C C . THR E 1 483 ? 13.484 21.769 34.667 1.00 34.56 ? 483 THR E C 1 +ATOM 26676 O O . THR E 1 483 ? 14.509 22.225 34.161 1.00 34.12 ? 483 THR E O 1 +ATOM 26677 C CB . THR E 1 483 ? 12.329 22.984 36.453 1.00 33.18 ? 483 THR E CB 1 +ATOM 26678 O OG1 . THR E 1 483 ? 11.051 23.515 36.830 1.00 34.53 ? 483 THR E OG1 1 +ATOM 26679 C CG2 . THR E 1 483 ? 13.409 24.017 36.771 1.00 30.95 ? 483 THR E CG2 1 +ATOM 26680 N N . ASP E 1 484 ? 13.339 20.484 34.968 1.00 36.85 ? 484 ASP E N 1 +ATOM 26681 C CA . ASP E 1 484 ? 14.424 19.535 34.740 1.00 38.94 ? 484 ASP E CA 1 +ATOM 26682 C C . ASP E 1 484 ? 14.399 18.840 33.382 1.00 38.91 ? 484 ASP E C 1 +ATOM 26683 O O . ASP E 1 484 ? 15.104 17.857 33.176 1.00 37.82 ? 484 ASP E O 1 +ATOM 26684 C CB . ASP E 1 484 ? 14.448 18.489 35.865 1.00 42.27 ? 484 ASP E CB 1 +ATOM 26685 C CG . ASP E 1 484 ? 13.329 17.455 35.746 1.00 46.36 ? 484 ASP E CG 1 +ATOM 26686 O OD1 . ASP E 1 484 ? 12.228 17.786 35.245 1.00 47.92 ? 484 ASP E OD1 1 +ATOM 26687 O OD2 . ASP E 1 484 ? 13.550 16.302 36.179 1.00 49.75 ? 484 ASP E OD2 1 +ATOM 26688 N N . GLY E 1 485 ? 13.583 19.343 32.460 1.00 40.16 ? 485 GLY E N 1 +ATOM 26689 C CA . GLY E 1 485 ? 13.531 18.749 31.136 1.00 40.08 ? 485 GLY E CA 1 +ATOM 26690 C C . GLY E 1 485 ? 14.617 19.346 30.264 1.00 41.09 ? 485 GLY E C 1 +ATOM 26691 O O . GLY E 1 485 ? 15.086 20.453 30.525 1.00 41.22 ? 485 GLY E O 1 +ATOM 26692 N N . ILE E 1 486 ? 15.031 18.621 29.233 1.00 42.96 ? 486 ILE E N 1 +ATOM 26693 C CA . ILE E 1 486 ? 16.061 19.127 28.330 1.00 46.24 ? 486 ILE E CA 1 +ATOM 26694 C C . ILE E 1 486 ? 15.529 20.392 27.657 1.00 46.63 ? 486 ILE E C 1 +ATOM 26695 O O . ILE E 1 486 ? 14.315 20.604 27.617 1.00 44.61 ? 486 ILE E O 1 +ATOM 26696 C CB . ILE E 1 486 ? 16.396 18.097 27.228 1.00 47.36 ? 486 ILE E CB 1 +ATOM 26697 C CG1 . ILE E 1 486 ? 15.119 17.735 26.462 1.00 49.30 ? 486 ILE E CG1 1 +ATOM 26698 C CG2 . ILE E 1 486 ? 17.020 16.851 27.848 1.00 47.53 ? 486 ILE E CG2 1 +ATOM 26699 C CD1 . ILE E 1 486 ? 15.341 16.771 25.317 1.00 49.31 ? 486 ILE E CD1 1 +ATOM 26700 N N . ASP E 1 487 ? 16.430 21.234 27.150 1.00 47.85 ? 487 ASP E N 1 +ATOM 26701 C CA . ASP E 1 487 ? 16.018 22.457 26.460 1.00 49.57 ? 487 ASP E CA 1 +ATOM 26702 C C . ASP E 1 487 ? 15.374 22.020 25.146 1.00 49.70 ? 487 ASP E C 1 +ATOM 26703 O O . ASP E 1 487 ? 16.000 21.317 24.349 1.00 51.09 ? 487 ASP E O 1 +ATOM 26704 C CB . ASP E 1 487 ? 17.228 23.355 26.178 1.00 51.85 ? 487 ASP E CB 1 +ATOM 26705 C CG . ASP E 1 487 ? 17.768 24.038 27.437 1.00 54.80 ? 487 ASP E CG 1 +ATOM 26706 O OD1 . ASP E 1 487 ? 17.014 24.811 28.074 1.00 54.15 ? 487 ASP E OD1 1 +ATOM 26707 O OD2 . ASP E 1 487 ? 18.949 23.804 27.785 1.00 54.94 ? 487 ASP E OD2 1 +ATOM 26708 N N . THR E 1 488 ? 14.128 22.424 24.917 1.00 47.91 ? 488 THR E N 1 +ATOM 26709 C CA . THR E 1 488 ? 13.435 22.014 23.705 1.00 47.30 ? 488 THR E CA 1 +ATOM 26710 C C . THR E 1 488 ? 13.238 23.102 22.656 1.00 47.74 ? 488 THR E C 1 +ATOM 26711 O O . THR E 1 488 ? 12.547 22.878 21.657 1.00 46.87 ? 488 THR E O 1 +ATOM 26712 C CB . THR E 1 488 ? 12.056 21.406 24.029 1.00 47.18 ? 488 THR E CB 1 +ATOM 26713 O OG1 . THR E 1 488 ? 11.268 22.364 24.747 1.00 46.94 ? 488 THR E OG1 1 +ATOM 26714 C CG2 . THR E 1 488 ? 12.215 20.144 24.852 1.00 46.48 ? 488 THR E CG2 1 +ATOM 26715 N N . GLU E 1 489 ? 13.823 24.279 22.875 1.00 47.79 ? 489 GLU E N 1 +ATOM 26716 C CA . GLU E 1 489 ? 13.699 25.350 21.892 1.00 47.71 ? 489 GLU E CA 1 +ATOM 26717 C C . GLU E 1 489 ? 14.398 24.864 20.622 1.00 46.44 ? 489 GLU E C 1 +ATOM 26718 O O . GLU E 1 489 ? 15.465 24.252 20.687 1.00 45.63 ? 489 GLU E O 1 +ATOM 26719 C CB . GLU E 1 489 ? 14.367 26.636 22.379 1.00 49.88 ? 489 GLU E CB 1 +ATOM 26720 C CG . GLU E 1 489 ? 13.800 27.225 23.661 1.00 54.12 ? 489 GLU E CG 1 +ATOM 26721 C CD . GLU E 1 489 ? 14.061 26.358 24.886 1.00 57.25 ? 489 GLU E CD 1 +ATOM 26722 O OE1 . GLU E 1 489 ? 15.185 25.823 25.023 1.00 58.82 ? 489 GLU E OE1 1 +ATOM 26723 O OE2 . GLU E 1 489 ? 13.142 26.223 25.721 1.00 58.78 ? 489 GLU E OE2 1 +ATOM 26724 N N . PRO E 1 490 ? 13.806 25.135 19.453 1.00 45.43 ? 490 PRO E N 1 +ATOM 26725 C CA . PRO E 1 490 ? 14.341 24.733 18.148 1.00 44.99 ? 490 PRO E CA 1 +ATOM 26726 C C . PRO E 1 490 ? 15.799 25.130 17.897 1.00 44.44 ? 490 PRO E C 1 +ATOM 26727 O O . PRO E 1 490 ? 16.548 24.388 17.252 1.00 43.22 ? 490 PRO E O 1 +ATOM 26728 C CB . PRO E 1 490 ? 13.386 25.404 17.166 1.00 45.26 ? 490 PRO E CB 1 +ATOM 26729 C CG . PRO E 1 490 ? 12.111 25.454 17.922 1.00 46.95 ? 490 PRO E CG 1 +ATOM 26730 C CD . PRO E 1 490 ? 12.558 25.894 19.286 1.00 46.24 ? 490 PRO E CD 1 +ATOM 26731 N N . VAL E 1 491 ? 16.198 26.292 18.403 1.00 42.96 ? 491 VAL E N 1 +ATOM 26732 C CA . VAL E 1 491 ? 17.561 26.761 18.218 1.00 43.46 ? 491 VAL E CA 1 +ATOM 26733 C C . VAL E 1 491 ? 18.616 25.849 18.841 1.00 43.83 ? 491 VAL E C 1 +ATOM 26734 O O . VAL E 1 491 ? 19.804 25.981 18.539 1.00 43.93 ? 491 VAL E O 1 +ATOM 26735 C CB . VAL E 1 491 ? 17.750 28.183 18.790 1.00 44.49 ? 491 VAL E CB 1 +ATOM 26736 C CG1 . VAL E 1 491 ? 16.923 29.175 17.993 1.00 44.73 ? 491 VAL E CG1 1 +ATOM 26737 C CG2 . VAL E 1 491 ? 17.363 28.213 20.262 1.00 43.91 ? 491 VAL E CG2 1 +ATOM 26738 N N . PHE E 1 492 ? 18.192 24.930 19.706 1.00 42.89 ? 492 PHE E N 1 +ATOM 26739 C CA . PHE E 1 492 ? 19.130 24.015 20.351 1.00 43.37 ? 492 PHE E CA 1 +ATOM 26740 C C . PHE E 1 492 ? 19.165 22.644 19.697 1.00 43.25 ? 492 PHE E C 1 +ATOM 26741 O O . PHE E 1 492 ? 19.832 21.736 20.193 1.00 44.36 ? 492 PHE E O 1 +ATOM 26742 C CB . PHE E 1 492 ? 18.792 23.843 21.834 1.00 43.10 ? 492 PHE E CB 1 +ATOM 26743 C CG . PHE E 1 492 ? 18.876 25.113 22.625 1.00 43.34 ? 492 PHE E CG 1 +ATOM 26744 C CD1 . PHE E 1 492 ? 20.074 25.814 22.709 1.00 43.60 ? 492 PHE E CD1 1 +ATOM 26745 C CD2 . PHE E 1 492 ? 17.753 25.615 23.279 1.00 42.38 ? 492 PHE E CD2 1 +ATOM 26746 C CE1 . PHE E 1 492 ? 20.160 27.000 23.431 1.00 45.55 ? 492 PHE E CE1 1 +ATOM 26747 C CE2 . PHE E 1 492 ? 17.822 26.800 24.006 1.00 43.94 ? 492 PHE E CE2 1 +ATOM 26748 C CZ . PHE E 1 492 ? 19.031 27.498 24.083 1.00 46.07 ? 492 PHE E CZ 1 +ATOM 26749 N N . LEU E 1 493 ? 18.456 22.498 18.584 1.00 42.43 ? 493 LEU E N 1 +ATOM 26750 C CA . LEU E 1 493 ? 18.404 21.225 17.870 1.00 42.30 ? 493 LEU E CA 1 +ATOM 26751 C C . LEU E 1 493 ? 19.444 21.131 16.756 1.00 42.49 ? 493 LEU E C 1 +ATOM 26752 O O . LEU E 1 493 ? 19.852 22.142 16.187 1.00 42.23 ? 493 LEU E O 1 +ATOM 26753 C CB . LEU E 1 493 ? 17.022 21.034 17.242 1.00 40.70 ? 493 LEU E CB 1 +ATOM 26754 C CG . LEU E 1 493 ? 15.801 20.810 18.129 1.00 41.91 ? 493 LEU E CG 1 +ATOM 26755 C CD1 . LEU E 1 493 ? 14.531 20.953 17.299 1.00 39.78 ? 493 LEU E CD1 1 +ATOM 26756 C CD2 . LEU E 1 493 ? 15.886 19.432 18.766 1.00 41.48 ? 493 LEU E CD2 1 +ATOM 26757 N N . PRO E 1 494 ? 19.896 19.907 16.440 1.00 42.47 ? 494 PRO E N 1 +ATOM 26758 C CA . PRO E 1 494 ? 20.881 19.762 15.366 1.00 42.41 ? 494 PRO E CA 1 +ATOM 26759 C C . PRO E 1 494 ? 20.199 20.304 14.108 1.00 43.34 ? 494 PRO E C 1 +ATOM 26760 O O . PRO E 1 494 ? 18.974 20.225 13.988 1.00 42.64 ? 494 PRO E O 1 +ATOM 26761 C CB . PRO E 1 494 ? 21.088 18.252 15.297 1.00 40.74 ? 494 PRO E CB 1 +ATOM 26762 C CG . PRO E 1 494 ? 20.887 17.828 16.707 1.00 41.76 ? 494 PRO E CG 1 +ATOM 26763 C CD . PRO E 1 494 ? 19.684 18.629 17.141 1.00 40.82 ? 494 PRO E CD 1 +ATOM 26764 N N . ASP E 1 495 ? 20.977 20.851 13.181 1.00 44.58 ? 495 ASP E N 1 +ATOM 26765 C CA . ASP E 1 495 ? 20.415 21.408 11.950 1.00 46.66 ? 495 ASP E CA 1 +ATOM 26766 C C . ASP E 1 495 ? 19.331 20.545 11.295 1.00 44.76 ? 495 ASP E C 1 +ATOM 26767 O O . ASP E 1 495 ? 18.312 21.066 10.850 1.00 44.61 ? 495 ASP E O 1 +ATOM 26768 C CB . ASP E 1 495 ? 21.533 21.693 10.939 1.00 49.93 ? 495 ASP E CB 1 +ATOM 26769 C CG . ASP E 1 495 ? 22.475 22.809 11.402 1.00 56.02 ? 495 ASP E CG 1 +ATOM 26770 O OD1 . ASP E 1 495 ? 21.988 23.917 11.734 1.00 58.28 ? 495 ASP E OD1 1 +ATOM 26771 O OD2 . ASP E 1 495 ? 23.708 22.583 11.430 1.00 59.30 ? 495 ASP E OD2 1 +ATOM 26772 N N . TYR E 1 496 ? 19.545 19.234 11.242 1.00 42.64 ? 496 TYR E N 1 +ATOM 26773 C CA . TYR E 1 496 ? 18.575 18.337 10.629 1.00 41.30 ? 496 TYR E CA 1 +ATOM 26774 C C . TYR E 1 496 ? 17.161 18.511 11.205 1.00 41.16 ? 496 TYR E C 1 +ATOM 26775 O O . TYR E 1 496 ? 16.193 18.678 10.466 1.00 40.99 ? 496 TYR E O 1 +ATOM 26776 C CB . TYR E 1 496 ? 19.018 16.889 10.803 1.00 39.67 ? 496 TYR E CB 1 +ATOM 26777 C CG . TYR E 1 496 ? 18.041 15.895 10.224 1.00 40.27 ? 496 TYR E CG 1 +ATOM 26778 C CD1 . TYR E 1 496 ? 17.970 15.672 8.847 1.00 40.50 ? 496 TYR E CD1 1 +ATOM 26779 C CD2 . TYR E 1 496 ? 17.161 15.200 11.049 1.00 40.76 ? 496 TYR E CD2 1 +ATOM 26780 C CE1 . TYR E 1 496 ? 17.043 14.779 8.307 1.00 40.25 ? 496 TYR E CE1 1 +ATOM 26781 C CE2 . TYR E 1 496 ? 16.231 14.309 10.524 1.00 42.00 ? 496 TYR E CE2 1 +ATOM 26782 C CZ . TYR E 1 496 ? 16.174 14.101 9.152 1.00 42.54 ? 496 TYR E CZ 1 +ATOM 26783 O OH . TYR E 1 496 ? 15.235 13.220 8.642 1.00 43.64 ? 496 TYR E OH 1 +ATOM 26784 N N . TYR E 1 497 ? 17.052 18.473 12.527 1.00 40.39 ? 497 TYR E N 1 +ATOM 26785 C CA . TYR E 1 497 ? 15.768 18.614 13.195 1.00 40.20 ? 497 TYR E CA 1 +ATOM 26786 C C . TYR E 1 497 ? 15.291 20.062 13.266 1.00 39.87 ? 497 TYR E C 1 +ATOM 26787 O O . TYR E 1 497 ? 14.095 20.336 13.167 1.00 36.91 ? 497 TYR E O 1 +ATOM 26788 C CB . TYR E 1 497 ? 15.858 18.019 14.600 1.00 40.25 ? 497 TYR E CB 1 +ATOM 26789 C CG . TYR E 1 497 ? 16.048 16.528 14.584 1.00 42.37 ? 497 TYR E CG 1 +ATOM 26790 C CD1 . TYR E 1 497 ? 15.022 15.685 14.163 1.00 42.21 ? 497 TYR E CD1 1 +ATOM 26791 C CD2 . TYR E 1 497 ? 17.265 15.954 14.954 1.00 43.04 ? 497 TYR E CD2 1 +ATOM 26792 C CE1 . TYR E 1 497 ? 15.199 14.313 14.109 1.00 43.48 ? 497 TYR E CE1 1 +ATOM 26793 C CE2 . TYR E 1 497 ? 17.453 14.581 14.903 1.00 43.53 ? 497 TYR E CE2 1 +ATOM 26794 C CZ . TYR E 1 497 ? 16.417 13.768 14.480 1.00 44.84 ? 497 TYR E CZ 1 +ATOM 26795 O OH . TYR E 1 497 ? 16.594 12.404 14.432 1.00 48.34 ? 497 TYR E OH 1 +ATOM 26796 N N . LYS E 1 498 ? 16.233 20.981 13.451 1.00 40.51 ? 498 LYS E N 1 +ATOM 26797 C CA . LYS E 1 498 ? 15.913 22.396 13.531 1.00 40.96 ? 498 LYS E CA 1 +ATOM 26798 C C . LYS E 1 498 ? 15.219 22.859 12.250 1.00 41.07 ? 498 LYS E C 1 +ATOM 26799 O O . LYS E 1 498 ? 14.248 23.617 12.304 1.00 40.24 ? 498 LYS E O 1 +ATOM 26800 C CB . LYS E 1 498 ? 17.185 23.215 13.762 1.00 40.77 ? 498 LYS E CB 1 +ATOM 26801 C CG . LYS E 1 498 ? 16.964 24.716 13.706 1.00 43.43 ? 498 LYS E CG 1 +ATOM 26802 C CD . LYS E 1 498 ? 18.116 25.479 14.335 1.00 46.71 ? 498 LYS E CD 1 +ATOM 26803 C CE . LYS E 1 498 ? 19.448 25.189 13.641 1.00 49.64 ? 498 LYS E CE 1 +ATOM 26804 N NZ . LYS E 1 498 ? 20.603 25.829 14.350 1.00 51.89 ? 498 LYS E NZ 1 +ATOM 26805 N N . GLU E 1 499 ? 15.711 22.402 11.102 1.00 40.43 ? 499 GLU E N 1 +ATOM 26806 C CA . GLU E 1 499 ? 15.107 22.780 9.831 1.00 42.32 ? 499 GLU E CA 1 +ATOM 26807 C C . GLU E 1 499 ? 13.684 22.256 9.702 1.00 40.84 ? 499 GLU E C 1 +ATOM 26808 O O . GLU E 1 499 ? 12.824 22.924 9.141 1.00 40.56 ? 499 GLU E O 1 +ATOM 26809 C CB . GLU E 1 499 ? 15.935 22.275 8.648 1.00 44.26 ? 499 GLU E CB 1 +ATOM 26810 C CG . GLU E 1 499 ? 16.749 23.364 7.956 1.00 52.10 ? 499 GLU E CG 1 +ATOM 26811 C CD . GLU E 1 499 ? 15.907 24.586 7.544 1.00 55.96 ? 499 GLU E CD 1 +ATOM 26812 O OE1 . GLU E 1 499 ? 14.928 24.426 6.772 1.00 57.29 ? 499 GLU E OE1 1 +ATOM 26813 O OE2 . GLU E 1 499 ? 16.230 25.710 7.994 1.00 57.14 ? 499 GLU E OE2 1 +ATOM 26814 N N . LYS E 1 500 ? 13.433 21.060 10.217 1.00 38.41 ? 500 LYS E N 1 +ATOM 26815 C CA . LYS E 1 500 ? 12.101 20.498 10.141 1.00 38.47 ? 500 LYS E CA 1 +ATOM 26816 C C . LYS E 1 500 ? 11.106 21.304 10.973 1.00 37.01 ? 500 LYS E C 1 +ATOM 26817 O O . LYS E 1 500 ? 9.988 21.562 10.531 1.00 36.45 ? 500 LYS E O 1 +ATOM 26818 C CB . LYS E 1 500 ? 12.109 19.037 10.594 1.00 39.96 ? 500 LYS E CB 1 +ATOM 26819 C CG . LYS E 1 500 ? 12.694 18.075 9.573 1.00 41.97 ? 500 LYS E CG 1 +ATOM 26820 C CD . LYS E 1 500 ? 12.564 16.635 10.044 1.00 45.08 ? 500 LYS E CD 1 +ATOM 26821 C CE . LYS E 1 500 ? 13.221 15.670 9.081 1.00 47.45 ? 500 LYS E CE 1 +ATOM 26822 N NZ . LYS E 1 500 ? 12.634 15.772 7.718 1.00 49.91 ? 500 LYS E NZ 1 +ATOM 26823 N N . VAL E 1 501 ? 11.509 21.705 12.171 1.00 36.13 ? 501 VAL E N 1 +ATOM 26824 C CA . VAL E 1 501 ? 10.631 22.488 13.029 1.00 36.36 ? 501 VAL E CA 1 +ATOM 26825 C C . VAL E 1 501 ? 10.386 23.853 12.393 1.00 37.62 ? 501 VAL E C 1 +ATOM 26826 O O . VAL E 1 501 ? 9.269 24.372 12.417 1.00 37.48 ? 501 VAL E O 1 +ATOM 26827 C CB . VAL E 1 501 ? 11.240 22.686 14.438 1.00 35.62 ? 501 VAL E CB 1 +ATOM 26828 C CG1 . VAL E 1 501 ? 10.361 23.625 15.258 1.00 32.89 ? 501 VAL E CG1 1 +ATOM 26829 C CG2 . VAL E 1 501 ? 11.368 21.337 15.144 1.00 32.96 ? 501 VAL E CG2 1 +ATOM 26830 N N . LYS E 1 502 ? 11.440 24.421 11.821 1.00 37.99 ? 502 LYS E N 1 +ATOM 26831 C CA . LYS E 1 502 ? 11.369 25.715 11.157 1.00 39.67 ? 502 LYS E CA 1 +ATOM 26832 C C . LYS E 1 502 ? 10.347 25.683 10.012 1.00 39.63 ? 502 LYS E C 1 +ATOM 26833 O O . LYS E 1 502 ? 9.534 26.595 9.874 1.00 38.53 ? 502 LYS E O 1 +ATOM 26834 C CB . LYS E 1 502 ? 12.755 26.073 10.615 1.00 41.77 ? 502 LYS E CB 1 +ATOM 26835 C CG . LYS E 1 502 ? 12.946 27.501 10.147 1.00 43.85 ? 502 LYS E CG 1 +ATOM 26836 C CD . LYS E 1 502 ? 14.420 27.720 9.799 1.00 46.26 ? 502 LYS E CD 1 +ATOM 26837 C CE . LYS E 1 502 ? 14.728 29.156 9.412 1.00 49.17 ? 502 LYS E CE 1 +ATOM 26838 N NZ . LYS E 1 502 ? 14.006 29.574 8.178 1.00 51.37 ? 502 LYS E NZ 1 +ATOM 26839 N N . GLU E 1 503 ? 10.381 24.630 9.202 1.00 39.22 ? 503 GLU E N 1 +ATOM 26840 C CA . GLU E 1 503 ? 9.452 24.520 8.085 1.00 40.59 ? 503 GLU E CA 1 +ATOM 26841 C C . GLU E 1 503 ? 8.015 24.294 8.542 1.00 38.44 ? 503 GLU E C 1 +ATOM 26842 O O . GLU E 1 503 ? 7.081 24.748 7.891 1.00 37.52 ? 503 GLU E O 1 +ATOM 26843 C CB . GLU E 1 503 ? 9.886 23.399 7.140 1.00 43.71 ? 503 GLU E CB 1 +ATOM 26844 C CG . GLU E 1 503 ? 11.300 23.587 6.634 1.00 50.36 ? 503 GLU E CG 1 +ATOM 26845 C CD . GLU E 1 503 ? 11.741 22.516 5.649 1.00 55.27 ? 503 GLU E CD 1 +ATOM 26846 O OE1 . GLU E 1 503 ? 11.388 21.326 5.844 1.00 57.18 ? 503 GLU E OE1 1 +ATOM 26847 O OE2 . GLU E 1 503 ? 12.466 22.870 4.689 1.00 57.15 ? 503 GLU E OE2 1 +ATOM 26848 N N . ILE E 1 504 ? 7.839 23.598 9.662 1.00 35.83 ? 504 ILE E N 1 +ATOM 26849 C CA . ILE E 1 504 ? 6.506 23.343 10.179 1.00 33.23 ? 504 ILE E CA 1 +ATOM 26850 C C . ILE E 1 504 ? 5.891 24.644 10.699 1.00 33.07 ? 504 ILE E C 1 +ATOM 26851 O O . ILE E 1 504 ? 4.719 24.933 10.440 1.00 29.51 ? 504 ILE E O 1 +ATOM 26852 C CB . ILE E 1 504 ? 6.548 22.297 11.311 1.00 31.50 ? 504 ILE E CB 1 +ATOM 26853 C CG1 . ILE E 1 504 ? 6.902 20.934 10.734 1.00 31.09 ? 504 ILE E CG1 1 +ATOM 26854 C CG2 . ILE E 1 504 ? 5.214 22.242 12.034 1.00 31.14 ? 504 ILE E CG2 1 +ATOM 26855 C CD1 . ILE E 1 504 ? 7.226 19.881 11.781 1.00 29.86 ? 504 ILE E CD1 1 +ATOM 26856 N N . VAL E 1 505 ? 6.683 25.421 11.436 1.00 32.18 ? 505 VAL E N 1 +ATOM 26857 C CA . VAL E 1 505 ? 6.205 26.687 11.976 1.00 33.18 ? 505 VAL E CA 1 +ATOM 26858 C C . VAL E 1 505 ? 5.889 27.669 10.839 1.00 34.17 ? 505 VAL E C 1 +ATOM 26859 O O . VAL E 1 505 ? 4.915 28.420 10.906 1.00 33.50 ? 505 VAL E O 1 +ATOM 26860 C CB . VAL E 1 505 ? 7.247 27.316 12.940 1.00 34.19 ? 505 VAL E CB 1 +ATOM 26861 C CG1 . VAL E 1 505 ? 6.789 28.696 13.404 1.00 32.19 ? 505 VAL E CG1 1 +ATOM 26862 C CG2 . VAL E 1 505 ? 7.440 26.407 14.142 1.00 33.90 ? 505 VAL E CG2 1 +ATOM 26863 N N . GLU E 1 506 ? 6.703 27.659 9.791 1.00 35.10 ? 506 GLU E N 1 +ATOM 26864 C CA . GLU E 1 506 ? 6.461 28.549 8.669 1.00 36.89 ? 506 GLU E CA 1 +ATOM 26865 C C . GLU E 1 506 ? 5.164 28.143 7.983 1.00 36.93 ? 506 GLU E C 1 +ATOM 26866 O O . GLU E 1 506 ? 4.392 28.995 7.537 1.00 37.89 ? 506 GLU E O 1 +ATOM 26867 C CB . GLU E 1 506 ? 7.625 28.511 7.676 1.00 37.20 ? 506 GLU E CB 1 +ATOM 26868 C CG . GLU E 1 506 ? 8.923 29.036 8.271 1.00 43.49 ? 506 GLU E CG 1 +ATOM 26869 C CD . GLU E 1 506 ? 10.119 28.945 7.318 1.00 48.30 ? 506 GLU E CD 1 +ATOM 26870 O OE1 . GLU E 1 506 ? 10.205 27.965 6.536 1.00 50.49 ? 506 GLU E OE1 1 +ATOM 26871 O OE2 . GLU E 1 506 ? 10.987 29.850 7.370 1.00 49.49 ? 506 GLU E OE2 1 +ATOM 26872 N N . LEU E 1 507 ? 4.912 26.841 7.912 1.00 35.95 ? 507 LEU E N 1 +ATOM 26873 C CA . LEU E 1 507 ? 3.698 26.359 7.280 1.00 34.24 ? 507 LEU E CA 1 +ATOM 26874 C C . LEU E 1 507 ? 2.484 26.772 8.115 1.00 34.98 ? 507 LEU E C 1 +ATOM 26875 O O . LEU E 1 507 ? 1.404 27.043 7.573 1.00 34.08 ? 507 LEU E O 1 +ATOM 26876 C CB . LEU E 1 507 ? 3.740 24.842 7.120 1.00 33.39 ? 507 LEU E CB 1 +ATOM 26877 C CG . LEU E 1 507 ? 2.548 24.257 6.350 1.00 34.65 ? 507 LEU E CG 1 +ATOM 26878 C CD1 . LEU E 1 507 ? 2.534 24.791 4.915 1.00 31.26 ? 507 LEU E CD1 1 +ATOM 26879 C CD2 . LEU E 1 507 ? 2.628 22.739 6.361 1.00 33.88 ? 507 LEU E CD2 1 +ATOM 26880 N N . ARG E 1 508 ? 2.655 26.828 9.432 1.00 34.29 ? 508 ARG E N 1 +ATOM 26881 C CA . ARG E 1 508 ? 1.557 27.242 10.292 1.00 34.47 ? 508 ARG E CA 1 +ATOM 26882 C C . ARG E 1 508 ? 1.215 28.706 10.004 1.00 34.51 ? 508 ARG E C 1 +ATOM 26883 O O . ARG E 1 508 ? 0.053 29.057 9.828 1.00 33.66 ? 508 ARG E O 1 +ATOM 26884 C CB . ARG E 1 508 ? 1.916 27.105 11.771 1.00 32.75 ? 508 ARG E CB 1 +ATOM 26885 C CG . ARG E 1 508 ? 0.770 27.518 12.685 1.00 32.49 ? 508 ARG E CG 1 +ATOM 26886 C CD . ARG E 1 508 ? 1.180 27.605 14.134 1.00 31.48 ? 508 ARG E CD 1 +ATOM 26887 N NE . ARG E 1 508 ? 0.111 28.161 14.964 1.00 32.65 ? 508 ARG E NE 1 +ATOM 26888 C CZ . ARG E 1 508 ? -1.021 27.532 15.274 1.00 31.53 ? 508 ARG E CZ 1 +ATOM 26889 N NH1 . ARG E 1 508 ? -1.258 26.304 14.825 1.00 30.94 ? 508 ARG E NH1 1 +ATOM 26890 N NH2 . ARG E 1 508 ? -1.910 28.126 16.055 1.00 27.65 ? 508 ARG E NH2 1 +ATOM 26891 N N . TYR E 1 509 ? 2.231 29.557 9.966 1.00 34.53 ? 509 TYR E N 1 +ATOM 26892 C CA . TYR E 1 509 ? 2.011 30.970 9.691 1.00 35.00 ? 509 TYR E CA 1 +ATOM 26893 C C . TYR E 1 509 ? 1.402 31.172 8.309 1.00 34.16 ? 509 TYR E C 1 +ATOM 26894 O O . TYR E 1 509 ? 0.653 32.111 8.091 1.00 33.70 ? 509 TYR E O 1 +ATOM 26895 C CB . TYR E 1 509 ? 3.326 31.750 9.829 1.00 33.51 ? 509 TYR E CB 1 +ATOM 26896 C CG . TYR E 1 509 ? 3.640 32.121 11.261 1.00 33.89 ? 509 TYR E CG 1 +ATOM 26897 C CD1 . TYR E 1 509 ? 2.873 33.073 11.942 1.00 33.86 ? 509 TYR E CD1 1 +ATOM 26898 C CD2 . TYR E 1 509 ? 4.683 31.501 11.954 1.00 34.66 ? 509 TYR E CD2 1 +ATOM 26899 C CE1 . TYR E 1 509 ? 3.135 33.393 13.282 1.00 32.87 ? 509 TYR E CE1 1 +ATOM 26900 C CE2 . TYR E 1 509 ? 4.954 31.817 13.290 1.00 33.80 ? 509 TYR E CE2 1 +ATOM 26901 C CZ . TYR E 1 509 ? 4.177 32.758 13.947 1.00 33.64 ? 509 TYR E CZ 1 +ATOM 26902 O OH . TYR E 1 509 ? 4.429 33.049 15.270 1.00 32.77 ? 509 TYR E OH 1 +ATOM 26903 N N . LYS E 1 510 ? 1.711 30.279 7.380 1.00 34.75 ? 510 LYS E N 1 +ATOM 26904 C CA . LYS E 1 510 ? 1.159 30.381 6.039 1.00 35.40 ? 510 LYS E CA 1 +ATOM 26905 C C . LYS E 1 510 ? -0.360 30.138 6.056 1.00 35.03 ? 510 LYS E C 1 +ATOM 26906 O O . LYS E 1 510 ? -1.091 30.695 5.246 1.00 33.54 ? 510 LYS E O 1 +ATOM 26907 C CB . LYS E 1 510 ? 1.845 29.378 5.120 1.00 36.41 ? 510 LYS E CB 1 +ATOM 26908 C CG . LYS E 1 510 ? 1.279 29.357 3.718 1.00 40.00 ? 510 LYS E CG 1 +ATOM 26909 C CD . LYS E 1 510 ? 2.135 28.532 2.779 1.00 41.30 ? 510 LYS E CD 1 +ATOM 26910 C CE . LYS E 1 510 ? 1.628 28.638 1.353 1.00 44.44 ? 510 LYS E CE 1 +ATOM 26911 N NZ . LYS E 1 510 ? 2.548 27.972 0.392 1.00 47.16 ? 510 LYS E NZ 1 +ATOM 26912 N N . PHE E 1 511 ? -0.820 29.315 6.996 1.00 34.72 ? 511 PHE E N 1 +ATOM 26913 C CA . PHE E 1 511 ? -2.235 28.990 7.133 1.00 34.59 ? 511 PHE E CA 1 +ATOM 26914 C C . PHE E 1 511 ? -2.928 29.806 8.212 1.00 35.12 ? 511 PHE E C 1 +ATOM 26915 O O . PHE E 1 511 ? -4.133 29.662 8.425 1.00 34.95 ? 511 PHE E O 1 +ATOM 26916 C CB . PHE E 1 511 ? -2.408 27.502 7.459 1.00 35.30 ? 511 PHE E CB 1 +ATOM 26917 C CG . PHE E 1 511 ? -2.432 26.612 6.252 1.00 34.48 ? 511 PHE E CG 1 +ATOM 26918 C CD1 . PHE E 1 511 ? -3.617 26.386 5.565 1.00 33.87 ? 511 PHE E CD1 1 +ATOM 26919 C CD2 . PHE E 1 511 ? -1.267 26.021 5.786 1.00 34.85 ? 511 PHE E CD2 1 +ATOM 26920 C CE1 . PHE E 1 511 ? -3.641 25.582 4.431 1.00 33.31 ? 511 PHE E CE1 1 +ATOM 26921 C CE2 . PHE E 1 511 ? -1.283 25.215 4.649 1.00 34.68 ? 511 PHE E CE2 1 +ATOM 26922 C CZ . PHE E 1 511 ? -2.472 24.998 3.973 1.00 33.09 ? 511 PHE E CZ 1 +ATOM 26923 N N . LEU E 1 512 ? -2.180 30.670 8.889 1.00 35.40 ? 512 LEU E N 1 +ATOM 26924 C CA . LEU E 1 512 ? -2.769 31.470 9.953 1.00 35.81 ? 512 LEU E CA 1 +ATOM 26925 C C . LEU E 1 512 ? -4.044 32.215 9.532 1.00 36.57 ? 512 LEU E C 1 +ATOM 26926 O O . LEU E 1 512 ? -5.016 32.252 10.292 1.00 35.72 ? 512 LEU E O 1 +ATOM 26927 C CB . LEU E 1 512 ? -1.743 32.455 10.504 1.00 38.03 ? 512 LEU E CB 1 +ATOM 26928 C CG . LEU E 1 512 ? -2.071 32.965 11.907 1.00 39.65 ? 512 LEU E CG 1 +ATOM 26929 C CD1 . LEU E 1 512 ? -2.076 31.793 12.874 1.00 40.74 ? 512 LEU E CD1 1 +ATOM 26930 C CD2 . LEU E 1 512 ? -1.043 34.000 12.335 1.00 43.58 ? 512 LEU E CD2 1 +ATOM 26931 N N . PRO E 1 513 ? -4.057 32.828 8.328 1.00 35.71 ? 513 PRO E N 1 +ATOM 26932 C CA . PRO E 1 513 ? -5.249 33.554 7.866 1.00 35.12 ? 513 PRO E CA 1 +ATOM 26933 C C . PRO E 1 513 ? -6.512 32.699 7.883 1.00 34.29 ? 513 PRO E C 1 +ATOM 26934 O O . PRO E 1 513 ? -7.592 33.170 8.253 1.00 33.44 ? 513 PRO E O 1 +ATOM 26935 C CB . PRO E 1 513 ? -4.862 33.991 6.460 1.00 33.61 ? 513 PRO E CB 1 +ATOM 26936 C CG . PRO E 1 513 ? -3.406 34.278 6.613 1.00 35.27 ? 513 PRO E CG 1 +ATOM 26937 C CD . PRO E 1 513 ? -2.920 33.080 7.422 1.00 35.51 ? 513 PRO E CD 1 +ATOM 26938 N N . TYR E 1 514 ? -6.371 31.438 7.488 1.00 34.15 ? 514 TYR E N 1 +ATOM 26939 C CA . TYR E 1 514 ? -7.501 30.514 7.482 1.00 34.03 ? 514 TYR E CA 1 +ATOM 26940 C C . TYR E 1 514 ? -7.901 30.187 8.917 1.00 34.65 ? 514 TYR E C 1 +ATOM 26941 O O . TYR E 1 514 ? -9.080 30.254 9.289 1.00 34.97 ? 514 TYR E O 1 +ATOM 26942 C CB . TYR E 1 514 ? -7.127 29.237 6.731 1.00 34.30 ? 514 TYR E CB 1 +ATOM 26943 C CG . TYR E 1 514 ? -8.197 28.172 6.731 1.00 33.45 ? 514 TYR E CG 1 +ATOM 26944 C CD1 . TYR E 1 514 ? -9.502 28.459 6.324 1.00 33.32 ? 514 TYR E CD1 1 +ATOM 26945 C CD2 . TYR E 1 514 ? -7.903 26.864 7.125 1.00 33.83 ? 514 TYR E CD2 1 +ATOM 26946 C CE1 . TYR E 1 514 ? -10.486 27.471 6.309 1.00 33.18 ? 514 TYR E CE1 1 +ATOM 26947 C CE2 . TYR E 1 514 ? -8.880 25.865 7.111 1.00 33.26 ? 514 TYR E CE2 1 +ATOM 26948 C CZ . TYR E 1 514 ? -10.168 26.175 6.702 1.00 33.22 ? 514 TYR E CZ 1 +ATOM 26949 O OH . TYR E 1 514 ? -11.129 25.194 6.678 1.00 32.88 ? 514 TYR E OH 1 +ATOM 26950 N N . ILE E 1 515 ? -6.910 29.844 9.730 1.00 34.59 ? 515 ILE E N 1 +ATOM 26951 C CA . ILE E 1 515 ? -7.163 29.528 11.128 1.00 34.25 ? 515 ILE E CA 1 +ATOM 26952 C C . ILE E 1 515 ? -7.861 30.689 11.834 1.00 33.36 ? 515 ILE E C 1 +ATOM 26953 O O . ILE E 1 515 ? -8.834 30.482 12.559 1.00 32.82 ? 515 ILE E O 1 +ATOM 26954 C CB . ILE E 1 515 ? -5.845 29.203 11.868 1.00 35.04 ? 515 ILE E CB 1 +ATOM 26955 C CG1 . ILE E 1 515 ? -5.264 27.897 11.328 1.00 36.45 ? 515 ILE E CG1 1 +ATOM 26956 C CG2 . ILE E 1 515 ? -6.092 29.094 13.364 1.00 33.97 ? 515 ILE E CG2 1 +ATOM 26957 C CD1 . ILE E 1 515 ? -3.846 27.611 11.811 1.00 38.53 ? 515 ILE E CD1 1 +ATOM 26958 N N . TYR E 1 516 ? -7.369 31.910 11.623 1.00 33.07 ? 516 TYR E N 1 +ATOM 26959 C CA . TYR E 1 516 ? -7.965 33.073 12.265 1.00 32.47 ? 516 TYR E CA 1 +ATOM 26960 C C . TYR E 1 516 ? -9.393 33.332 11.775 1.00 31.80 ? 516 TYR E C 1 +ATOM 26961 O O . TYR E 1 516 ? -10.248 33.765 12.544 1.00 30.39 ? 516 TYR E O 1 +ATOM 26962 C CB . TYR E 1 516 ? -7.105 34.315 12.054 1.00 33.04 ? 516 TYR E CB 1 +ATOM 26963 C CG . TYR E 1 516 ? -7.438 35.407 13.037 1.00 35.75 ? 516 TYR E CG 1 +ATOM 26964 C CD1 . TYR E 1 516 ? -7.507 35.135 14.409 1.00 35.79 ? 516 TYR E CD1 1 +ATOM 26965 C CD2 . TYR E 1 516 ? -7.692 36.712 12.609 1.00 36.19 ? 516 TYR E CD2 1 +ATOM 26966 C CE1 . TYR E 1 516 ? -7.822 36.134 15.329 1.00 35.83 ? 516 TYR E CE1 1 +ATOM 26967 C CE2 . TYR E 1 516 ? -8.005 37.722 13.522 1.00 35.79 ? 516 TYR E CE2 1 +ATOM 26968 C CZ . TYR E 1 516 ? -8.068 37.424 14.881 1.00 37.21 ? 516 TYR E CZ 1 +ATOM 26969 O OH . TYR E 1 516 ? -8.377 38.409 15.792 1.00 36.59 ? 516 TYR E OH 1 +ATOM 26970 N N . SER E 1 517 ? -9.649 33.072 10.497 1.00 30.41 ? 517 SER E N 1 +ATOM 26971 C CA . SER E 1 517 ? -10.992 33.242 9.963 1.00 30.46 ? 517 SER E CA 1 +ATOM 26972 C C . SER E 1 517 ? -11.938 32.263 10.679 1.00 29.70 ? 517 SER E C 1 +ATOM 26973 O O . SER E 1 517 ? -13.088 32.596 10.980 1.00 29.88 ? 517 SER E O 1 +ATOM 26974 C CB . SER E 1 517 ? -11.011 32.975 8.454 1.00 30.99 ? 517 SER E CB 1 +ATOM 26975 O OG . SER E 1 517 ? -10.155 33.870 7.760 1.00 30.12 ? 517 SER E OG 1 +ATOM 26976 N N . LEU E 1 518 ? -11.454 31.053 10.946 1.00 29.05 ? 518 LEU E N 1 +ATOM 26977 C CA . LEU E 1 518 ? -12.253 30.059 11.662 1.00 28.91 ? 518 LEU E CA 1 +ATOM 26978 C C . LEU E 1 518 ? -12.449 30.514 13.106 1.00 29.15 ? 518 LEU E C 1 +ATOM 26979 O O . LEU E 1 518 ? -13.473 30.230 13.723 1.00 29.70 ? 518 LEU E O 1 +ATOM 26980 C CB . LEU E 1 518 ? -11.567 28.694 11.625 1.00 29.01 ? 518 LEU E CB 1 +ATOM 26981 C CG . LEU E 1 518 ? -11.468 28.063 10.233 1.00 29.81 ? 518 LEU E CG 1 +ATOM 26982 C CD1 . LEU E 1 518 ? -10.565 26.828 10.280 1.00 29.85 ? 518 LEU E CD1 1 +ATOM 26983 C CD2 . LEU E 1 518 ? -12.873 27.713 9.733 1.00 25.80 ? 518 LEU E CD2 1 +ATOM 26984 N N . ALA E 1 519 ? -11.466 31.227 13.649 1.00 29.88 ? 519 ALA E N 1 +ATOM 26985 C CA . ALA E 1 519 ? -11.585 31.752 15.005 1.00 31.19 ? 519 ALA E CA 1 +ATOM 26986 C C . ALA E 1 519 ? -12.723 32.784 15.030 1.00 30.62 ? 519 ALA E C 1 +ATOM 26987 O O . ALA E 1 519 ? -13.513 32.828 15.972 1.00 28.12 ? 519 ALA E O 1 +ATOM 26988 C CB . ALA E 1 519 ? -10.264 32.401 15.447 1.00 30.16 ? 519 ALA E CB 1 +ATOM 26989 N N . LEU E 1 520 ? -12.796 33.619 13.992 1.00 32.83 ? 520 LEU E N 1 +ATOM 26990 C CA . LEU E 1 520 ? -13.858 34.621 13.901 1.00 35.78 ? 520 LEU E CA 1 +ATOM 26991 C C . LEU E 1 520 ? -15.210 33.900 13.836 1.00 36.02 ? 520 LEU E C 1 +ATOM 26992 O O . LEU E 1 520 ? -16.169 34.290 14.502 1.00 34.81 ? 520 LEU E O 1 +ATOM 26993 C CB . LEU E 1 520 ? -13.689 35.489 12.650 1.00 37.36 ? 520 LEU E CB 1 +ATOM 26994 C CG . LEU E 1 520 ? -14.864 36.443 12.340 1.00 37.63 ? 520 LEU E CG 1 +ATOM 26995 C CD1 . LEU E 1 520 ? -15.013 37.476 13.449 1.00 36.46 ? 520 LEU E CD1 1 +ATOM 26996 C CD2 . LEU E 1 520 ? -14.631 37.139 11.013 1.00 37.88 ? 520 LEU E CD2 1 +ATOM 26997 N N . GLU E 1 521 ? -15.266 32.842 13.037 1.00 35.71 ? 521 GLU E N 1 +ATOM 26998 C CA . GLU E 1 521 ? -16.477 32.047 12.893 1.00 37.91 ? 521 GLU E CA 1 +ATOM 26999 C C . GLU E 1 521 ? -16.859 31.454 14.259 1.00 38.31 ? 521 GLU E C 1 +ATOM 27000 O O . GLU E 1 521 ? -18.041 31.396 14.624 1.00 39.90 ? 521 GLU E O 1 +ATOM 27001 C CB . GLU E 1 521 ? -16.228 30.931 11.873 1.00 40.02 ? 521 GLU E CB 1 +ATOM 27002 C CG . GLU E 1 521 ? -17.438 30.099 11.486 1.00 46.14 ? 521 GLU E CG 1 +ATOM 27003 C CD . GLU E 1 521 ? -17.059 28.868 10.639 1.00 50.83 ? 521 GLU E CD 1 +ATOM 27004 O OE1 . GLU E 1 521 ? -16.335 29.035 9.626 1.00 52.99 ? 521 GLU E OE1 1 +ATOM 27005 O OE2 . GLU E 1 521 ? -17.486 27.734 10.980 1.00 51.67 ? 521 GLU E OE2 1 +ATOM 27006 N N . ALA E 1 522 ? -15.861 31.016 15.019 1.00 36.88 ? 522 ALA E N 1 +ATOM 27007 C CA . ALA E 1 522 ? -16.122 30.447 16.337 1.00 37.29 ? 522 ALA E CA 1 +ATOM 27008 C C . ALA E 1 522 ? -16.751 31.494 17.260 1.00 37.90 ? 522 ALA E C 1 +ATOM 27009 O O . ALA E 1 522 ? -17.752 31.231 17.923 1.00 36.85 ? 522 ALA E O 1 +ATOM 27010 C CB . ALA E 1 522 ? -14.825 29.925 16.955 1.00 35.73 ? 522 ALA E CB 1 +ATOM 27011 N N . SER E 1 523 ? -16.168 32.687 17.292 1.00 38.81 ? 523 SER E N 1 +ATOM 27012 C CA . SER E 1 523 ? -16.688 33.750 18.147 1.00 42.33 ? 523 SER E CA 1 +ATOM 27013 C C . SER E 1 523 ? -18.045 34.284 17.705 1.00 42.95 ? 523 SER E C 1 +ATOM 27014 O O . SER E 1 523 ? -18.755 34.894 18.497 1.00 42.36 ? 523 SER E O 1 +ATOM 27015 C CB . SER E 1 523 ? -15.700 34.914 18.216 1.00 41.94 ? 523 SER E CB 1 +ATOM 27016 O OG . SER E 1 523 ? -15.599 35.544 16.955 1.00 46.42 ? 523 SER E OG 1 +ATOM 27017 N N . GLU E 1 524 ? -18.407 34.057 16.447 1.00 44.97 ? 524 GLU E N 1 +ATOM 27018 C CA . GLU E 1 524 ? -19.684 34.542 15.938 1.00 47.20 ? 524 GLU E CA 1 +ATOM 27019 C C . GLU E 1 524 ? -20.788 33.495 15.950 1.00 46.80 ? 524 GLU E C 1 +ATOM 27020 O O . GLU E 1 524 ? -21.940 33.807 16.240 1.00 45.41 ? 524 GLU E O 1 +ATOM 27021 C CB . GLU E 1 524 ? -19.526 35.069 14.505 1.00 50.04 ? 524 GLU E CB 1 +ATOM 27022 C CG . GLU E 1 524 ? -18.559 36.230 14.351 1.00 54.69 ? 524 GLU E CG 1 +ATOM 27023 C CD . GLU E 1 524 ? -18.579 36.825 12.948 1.00 58.23 ? 524 GLU E CD 1 +ATOM 27024 O OE1 . GLU E 1 524 ? -18.524 36.050 11.965 1.00 60.44 ? 524 GLU E OE1 1 +ATOM 27025 O OE2 . GLU E 1 524 ? -18.641 38.071 12.829 1.00 61.01 ? 524 GLU E OE2 1 +ATOM 27026 N N . LYS E 1 525 ? -20.439 32.254 15.637 1.00 46.95 ? 525 LYS E N 1 +ATOM 27027 C CA . LYS E 1 525 ? -21.447 31.209 15.582 1.00 47.97 ? 525 LYS E CA 1 +ATOM 27028 C C . LYS E 1 525 ? -21.211 30.054 16.536 1.00 47.30 ? 525 LYS E C 1 +ATOM 27029 O O . LYS E 1 525 ? -22.076 29.211 16.712 1.00 48.94 ? 525 LYS E O 1 +ATOM 27030 C CB . LYS E 1 525 ? -21.562 30.696 14.146 1.00 49.93 ? 525 LYS E CB 1 +ATOM 27031 C CG . LYS E 1 525 ? -21.875 31.803 13.137 1.00 52.29 ? 525 LYS E CG 1 +ATOM 27032 C CD . LYS E 1 525 ? -21.908 31.276 11.715 1.00 56.58 ? 525 LYS E CD 1 +ATOM 27033 C CE . LYS E 1 525 ? -22.319 32.361 10.725 1.00 58.42 ? 525 LYS E CE 1 +ATOM 27034 N NZ . LYS E 1 525 ? -21.408 33.541 10.769 1.00 59.93 ? 525 LYS E NZ 1 +ATOM 27035 N N . GLY E 1 526 ? -20.044 30.010 17.159 1.00 46.64 ? 526 GLY E N 1 +ATOM 27036 C CA . GLY E 1 526 ? -19.771 28.934 18.091 1.00 44.69 ? 526 GLY E CA 1 +ATOM 27037 C C . GLY E 1 526 ? -19.344 27.638 17.433 1.00 44.59 ? 526 GLY E C 1 +ATOM 27038 O O . GLY E 1 526 ? -19.498 26.569 18.004 1.00 46.09 ? 526 GLY E O 1 +ATOM 27039 N N . HIS E 1 527 ? -18.811 27.721 16.225 1.00 43.87 ? 527 HIS E N 1 +ATOM 27040 C CA . HIS E 1 527 ? -18.344 26.529 15.527 1.00 44.47 ? 527 HIS E CA 1 +ATOM 27041 C C . HIS E 1 527 ? -16.903 26.291 15.958 1.00 43.03 ? 527 HIS E C 1 +ATOM 27042 O O . HIS E 1 527 ? -16.104 27.218 16.008 1.00 44.89 ? 527 HIS E O 1 +ATOM 27043 C CB . HIS E 1 527 ? -18.382 26.737 14.007 1.00 44.76 ? 527 HIS E CB 1 +ATOM 27044 C CG . HIS E 1 527 ? -19.755 26.963 13.455 1.00 45.57 ? 527 HIS E CG 1 +ATOM 27045 N ND1 . HIS E 1 527 ? -19.974 27.417 12.171 1.00 46.85 ? 527 HIS E ND1 1 +ATOM 27046 C CD2 . HIS E 1 527 ? -20.980 26.787 14.004 1.00 45.77 ? 527 HIS E CD2 1 +ATOM 27047 C CE1 . HIS E 1 527 ? -21.273 27.512 11.954 1.00 46.15 ? 527 HIS E CE1 1 +ATOM 27048 N NE2 . HIS E 1 527 ? -21.906 27.136 13.051 1.00 47.31 ? 527 HIS E NE2 1 +ATOM 27049 N N . PRO E 1 528 ? -16.549 25.050 16.285 1.00 41.64 ? 528 PRO E N 1 +ATOM 27050 C CA . PRO E 1 528 ? -15.163 24.827 16.696 1.00 39.85 ? 528 PRO E CA 1 +ATOM 27051 C C . PRO E 1 528 ? -14.177 24.968 15.534 1.00 38.40 ? 528 PRO E C 1 +ATOM 27052 O O . PRO E 1 528 ? -14.531 24.751 14.376 1.00 38.99 ? 528 PRO E O 1 +ATOM 27053 C CB . PRO E 1 528 ? -15.205 23.415 17.271 1.00 40.81 ? 528 PRO E CB 1 +ATOM 27054 C CG . PRO E 1 528 ? -16.314 22.765 16.503 1.00 42.85 ? 528 PRO E CG 1 +ATOM 27055 C CD . PRO E 1 528 ? -17.363 23.839 16.475 1.00 41.76 ? 528 PRO E CD 1 +ATOM 27056 N N . VAL E 1 529 ? -12.941 25.343 15.845 1.00 36.24 ? 529 VAL E N 1 +ATOM 27057 C CA . VAL E 1 529 ? -11.911 25.497 14.826 1.00 33.88 ? 529 VAL E CA 1 +ATOM 27058 C C . VAL E 1 529 ? -11.450 24.129 14.323 1.00 32.52 ? 529 VAL E C 1 +ATOM 27059 O O . VAL E 1 529 ? -11.533 23.847 13.131 1.00 30.70 ? 529 VAL E O 1 +ATOM 27060 C CB . VAL E 1 529 ? -10.711 26.283 15.375 1.00 34.23 ? 529 VAL E CB 1 +ATOM 27061 C CG1 . VAL E 1 529 ? -9.605 26.368 14.324 1.00 31.18 ? 529 VAL E CG1 1 +ATOM 27062 C CG2 . VAL E 1 529 ? -11.177 27.673 15.811 1.00 32.73 ? 529 VAL E CG2 1 +ATOM 27063 N N . ILE E 1 530 ? -10.953 23.283 15.220 1.00 31.70 ? 530 ILE E N 1 +ATOM 27064 C CA . ILE E 1 530 ? -10.531 21.953 14.803 1.00 31.61 ? 530 ILE E CA 1 +ATOM 27065 C C . ILE E 1 530 ? -11.681 21.018 15.136 1.00 31.85 ? 530 ILE E C 1 +ATOM 27066 O O . ILE E 1 530 ? -12.352 21.189 16.153 1.00 30.94 ? 530 ILE E O 1 +ATOM 27067 C CB . ILE E 1 530 ? -9.237 21.487 15.509 1.00 31.55 ? 530 ILE E CB 1 +ATOM 27068 C CG1 . ILE E 1 530 ? -9.417 21.525 17.025 1.00 30.17 ? 530 ILE E CG1 1 +ATOM 27069 C CG2 . ILE E 1 530 ? -8.053 22.347 15.040 1.00 28.92 ? 530 ILE E CG2 1 +ATOM 27070 C CD1 . ILE E 1 530 ? -8.260 20.919 17.765 1.00 34.11 ? 530 ILE E CD1 1 +ATOM 27071 N N . ARG E 1 531 ? -11.922 20.036 14.274 1.00 31.83 ? 531 ARG E N 1 +ATOM 27072 C CA . ARG E 1 531 ? -13.041 19.132 14.487 1.00 32.89 ? 531 ARG E CA 1 +ATOM 27073 C C . ARG E 1 531 ? -12.768 17.672 14.179 1.00 32.32 ? 531 ARG E C 1 +ATOM 27074 O O . ARG E 1 531 ? -11.968 17.339 13.306 1.00 29.16 ? 531 ARG E O 1 +ATOM 27075 C CB . ARG E 1 531 ? -14.218 19.574 13.614 1.00 33.71 ? 531 ARG E CB 1 +ATOM 27076 C CG . ARG E 1 531 ? -14.337 21.070 13.502 1.00 37.17 ? 531 ARG E CG 1 +ATOM 27077 C CD . ARG E 1 531 ? -15.130 21.504 12.292 1.00 39.22 ? 531 ARG E CD 1 +ATOM 27078 N NE . ARG E 1 531 ? -15.287 22.953 12.308 1.00 40.43 ? 531 ARG E NE 1 +ATOM 27079 C CZ . ARG E 1 531 ? -16.023 23.641 11.448 1.00 40.00 ? 531 ARG E CZ 1 +ATOM 27080 N NH1 . ARG E 1 531 ? -16.683 23.014 10.487 1.00 39.57 ? 531 ARG E NH1 1 +ATOM 27081 N NH2 . ARG E 1 531 ? -16.094 24.960 11.554 1.00 39.76 ? 531 ARG E NH2 1 +ATOM 27082 N N . PRO E 1 532 ? -13.423 16.777 14.922 1.00 34.16 ? 532 PRO E N 1 +ATOM 27083 C CA . PRO E 1 532 ? -13.228 15.352 14.658 1.00 35.04 ? 532 PRO E CA 1 +ATOM 27084 C C . PRO E 1 532 ? -13.999 15.107 13.353 1.00 35.74 ? 532 PRO E C 1 +ATOM 27085 O O . PRO E 1 532 ? -14.915 15.869 13.019 1.00 35.21 ? 532 PRO E O 1 +ATOM 27086 C CB . PRO E 1 532 ? -13.878 14.683 15.869 1.00 35.03 ? 532 PRO E CB 1 +ATOM 27087 C CG . PRO E 1 532 ? -14.927 15.685 16.310 1.00 34.63 ? 532 PRO E CG 1 +ATOM 27088 C CD . PRO E 1 532 ? -14.206 16.995 16.155 1.00 34.05 ? 532 PRO E CD 1 +ATOM 27089 N N . LEU E 1 533 ? -13.635 14.071 12.611 1.00 37.07 ? 533 LEU E N 1 +ATOM 27090 C CA . LEU E 1 533 ? -14.313 13.789 11.345 1.00 37.66 ? 533 LEU E CA 1 +ATOM 27091 C C . LEU E 1 533 ? -15.821 13.604 11.455 1.00 37.35 ? 533 LEU E C 1 +ATOM 27092 O O . LEU E 1 533 ? -16.559 14.004 10.557 1.00 37.71 ? 533 LEU E O 1 +ATOM 27093 C CB . LEU E 1 533 ? -13.714 12.554 10.667 1.00 36.66 ? 533 LEU E CB 1 +ATOM 27094 C CG . LEU E 1 533 ? -12.211 12.579 10.376 1.00 39.03 ? 533 LEU E CG 1 +ATOM 27095 C CD1 . LEU E 1 533 ? -11.885 11.535 9.311 1.00 38.52 ? 533 LEU E CD1 1 +ATOM 27096 C CD2 . LEU E 1 533 ? -11.795 13.962 9.908 1.00 37.93 ? 533 LEU E CD2 1 +ATOM 27097 N N . PHE E 1 534 ? -16.293 13.006 12.541 1.00 36.15 ? 534 PHE E N 1 +ATOM 27098 C CA . PHE E 1 534 ? -17.727 12.800 12.656 1.00 37.27 ? 534 PHE E CA 1 +ATOM 27099 C C . PHE E 1 534 ? -18.511 14.100 12.763 1.00 38.17 ? 534 PHE E C 1 +ATOM 27100 O O . PHE E 1 534 ? -19.729 14.096 12.618 1.00 40.32 ? 534 PHE E O 1 +ATOM 27101 C CB . PHE E 1 534 ? -18.067 11.852 13.824 1.00 35.19 ? 534 PHE E CB 1 +ATOM 27102 C CG . PHE E 1 534 ? -17.627 12.338 15.181 1.00 34.24 ? 534 PHE E CG 1 +ATOM 27103 C CD1 . PHE E 1 534 ? -18.268 13.401 15.803 1.00 33.33 ? 534 PHE E CD1 1 +ATOM 27104 C CD2 . PHE E 1 534 ? -16.581 11.710 15.848 1.00 33.20 ? 534 PHE E CD2 1 +ATOM 27105 C CE1 . PHE E 1 534 ? -17.870 13.830 17.073 1.00 33.21 ? 534 PHE E CE1 1 +ATOM 27106 C CE2 . PHE E 1 534 ? -16.183 12.133 17.109 1.00 32.03 ? 534 PHE E CE2 1 +ATOM 27107 C CZ . PHE E 1 534 ? -16.826 13.191 17.721 1.00 32.34 ? 534 PHE E CZ 1 +ATOM 27108 N N . TYR E 1 535 ? -17.825 15.214 13.007 1.00 38.04 ? 535 TYR E N 1 +ATOM 27109 C CA . TYR E 1 535 ? -18.522 16.489 13.108 1.00 37.45 ? 535 TYR E CA 1 +ATOM 27110 C C . TYR E 1 535 ? -19.071 16.915 11.745 1.00 37.77 ? 535 TYR E C 1 +ATOM 27111 O O . TYR E 1 535 ? -20.197 17.413 11.647 1.00 38.17 ? 535 TYR E O 1 +ATOM 27112 C CB . TYR E 1 535 ? -17.590 17.561 13.670 1.00 36.61 ? 535 TYR E CB 1 +ATOM 27113 C CG . TYR E 1 535 ? -18.193 18.950 13.729 1.00 35.72 ? 535 TYR E CG 1 +ATOM 27114 C CD1 . TYR E 1 535 ? -18.235 19.762 12.591 1.00 35.89 ? 535 TYR E CD1 1 +ATOM 27115 C CD2 . TYR E 1 535 ? -18.705 19.462 14.921 1.00 35.21 ? 535 TYR E CD2 1 +ATOM 27116 C CE1 . TYR E 1 535 ? -18.763 21.047 12.637 1.00 35.20 ? 535 TYR E CE1 1 +ATOM 27117 C CE2 . TYR E 1 535 ? -19.238 20.755 14.981 1.00 36.58 ? 535 TYR E CE2 1 +ATOM 27118 C CZ . TYR E 1 535 ? -19.258 21.543 13.835 1.00 36.55 ? 535 TYR E CZ 1 +ATOM 27119 O OH . TYR E 1 535 ? -19.725 22.838 13.900 1.00 34.10 ? 535 TYR E OH 1 +ATOM 27120 N N . GLU E 1 536 ? -18.277 16.710 10.700 1.00 38.09 ? 536 GLU E N 1 +ATOM 27121 C CA . GLU E 1 536 ? -18.675 17.053 9.339 1.00 39.05 ? 536 GLU E CA 1 +ATOM 27122 C C . GLU E 1 536 ? -19.401 15.896 8.646 1.00 39.35 ? 536 GLU E C 1 +ATOM 27123 O O . GLU E 1 536 ? -20.121 16.102 7.676 1.00 39.79 ? 536 GLU E O 1 +ATOM 27124 C CB . GLU E 1 536 ? -17.448 17.421 8.508 1.00 40.66 ? 536 GLU E CB 1 +ATOM 27125 C CG . GLU E 1 536 ? -16.842 18.780 8.821 1.00 45.48 ? 536 GLU E CG 1 +ATOM 27126 C CD . GLU E 1 536 ? -17.809 19.922 8.534 1.00 48.63 ? 536 GLU E CD 1 +ATOM 27127 O OE1 . GLU E 1 536 ? -18.466 19.904 7.466 1.00 50.27 ? 536 GLU E OE1 1 +ATOM 27128 O OE2 . GLU E 1 536 ? -17.907 20.843 9.370 1.00 50.33 ? 536 GLU E OE2 1 +ATOM 27129 N N . PHE E 1 537 ? -19.202 14.678 9.140 1.00 38.76 ? 537 PHE E N 1 +ATOM 27130 C CA . PHE E 1 537 ? -19.819 13.501 8.541 1.00 37.25 ? 537 PHE E CA 1 +ATOM 27131 C C . PHE E 1 537 ? -20.438 12.635 9.617 1.00 38.02 ? 537 PHE E C 1 +ATOM 27132 O O . PHE E 1 537 ? -20.094 11.458 9.741 1.00 37.96 ? 537 PHE E O 1 +ATOM 27133 C CB . PHE E 1 537 ? -18.770 12.698 7.773 1.00 34.73 ? 537 PHE E CB 1 +ATOM 27134 C CG . PHE E 1 537 ? -17.935 13.531 6.845 1.00 35.72 ? 537 PHE E CG 1 +ATOM 27135 C CD1 . PHE E 1 537 ? -16.777 14.156 7.304 1.00 35.74 ? 537 PHE E CD1 1 +ATOM 27136 C CD2 . PHE E 1 537 ? -18.339 13.751 5.530 1.00 35.50 ? 537 PHE E CD2 1 +ATOM 27137 C CE1 . PHE E 1 537 ? -16.030 14.994 6.471 1.00 35.12 ? 537 PHE E CE1 1 +ATOM 27138 C CE2 . PHE E 1 537 ? -17.604 14.588 4.684 1.00 35.41 ? 537 PHE E CE2 1 +ATOM 27139 C CZ . PHE E 1 537 ? -16.447 15.213 5.155 1.00 37.17 ? 537 PHE E CZ 1 +ATOM 27140 N N . GLN E 1 538 ? -21.367 13.220 10.372 1.00 38.06 ? 538 GLN E N 1 +ATOM 27141 C CA . GLN E 1 538 ? -22.018 12.540 11.485 1.00 39.83 ? 538 GLN E CA 1 +ATOM 27142 C C . GLN E 1 538 ? -22.875 11.333 11.131 1.00 42.29 ? 538 GLN E C 1 +ATOM 27143 O O . GLN E 1 538 ? -23.213 10.532 12.006 1.00 41.44 ? 538 GLN E O 1 +ATOM 27144 C CB . GLN E 1 538 ? -22.869 13.539 12.272 1.00 39.02 ? 538 GLN E CB 1 +ATOM 27145 C CG . GLN E 1 538 ? -24.093 14.043 11.531 1.00 36.35 ? 538 GLN E CG 1 +ATOM 27146 C CD . GLN E 1 538 ? -24.867 15.051 12.337 1.00 37.01 ? 538 GLN E CD 1 +ATOM 27147 O OE1 . GLN E 1 538 ? -24.423 16.184 12.530 1.00 38.19 ? 538 GLN E OE1 1 +ATOM 27148 N NE2 . GLN E 1 538 ? -26.031 14.646 12.827 1.00 36.87 ? 538 GLN E NE2 1 +ATOM 27149 N N . ASP E 1 539 ? -23.218 11.200 9.857 1.00 44.43 ? 539 ASP E N 1 +ATOM 27150 C CA . ASP E 1 539 ? -24.068 10.103 9.411 1.00 48.00 ? 539 ASP E CA 1 +ATOM 27151 C C . ASP E 1 539 ? -23.313 8.820 9.073 1.00 47.49 ? 539 ASP E C 1 +ATOM 27152 O O . ASP E 1 539 ? -23.925 7.796 8.791 1.00 47.83 ? 539 ASP E O 1 +ATOM 27153 C CB . ASP E 1 539 ? -24.876 10.551 8.197 1.00 51.25 ? 539 ASP E CB 1 +ATOM 27154 C CG . ASP E 1 539 ? -23.989 10.950 7.034 1.00 56.82 ? 539 ASP E CG 1 +ATOM 27155 O OD1 . ASP E 1 539 ? -23.035 11.745 7.249 1.00 57.28 ? 539 ASP E OD1 1 +ATOM 27156 O OD2 . ASP E 1 539 ? -24.243 10.468 5.905 1.00 60.67 ? 539 ASP E OD2 1 +ATOM 27157 N N . ASP E 1 540 ? -21.987 8.877 9.096 1.00 47.50 ? 540 ASP E N 1 +ATOM 27158 C CA . ASP E 1 540 ? -21.166 7.710 8.787 1.00 47.20 ? 540 ASP E CA 1 +ATOM 27159 C C . ASP E 1 540 ? -20.535 7.148 10.060 1.00 46.31 ? 540 ASP E C 1 +ATOM 27160 O O . ASP E 1 540 ? -19.622 7.745 10.625 1.00 46.44 ? 540 ASP E O 1 +ATOM 27161 C CB . ASP E 1 540 ? -20.091 8.108 7.771 1.00 49.95 ? 540 ASP E CB 1 +ATOM 27162 C CG . ASP E 1 540 ? -19.110 6.982 7.475 1.00 54.93 ? 540 ASP E CG 1 +ATOM 27163 O OD1 . ASP E 1 540 ? -19.453 5.790 7.689 1.00 56.40 ? 540 ASP E OD1 1 +ATOM 27164 O OD2 . ASP E 1 540 ? -17.990 7.297 7.010 1.00 57.11 ? 540 ASP E OD2 1 +ATOM 27165 N N . ASP E 1 541 ? -21.025 5.995 10.507 1.00 46.14 ? 541 ASP E N 1 +ATOM 27166 C CA . ASP E 1 541 ? -20.529 5.360 11.727 1.00 45.90 ? 541 ASP E CA 1 +ATOM 27167 C C . ASP E 1 541 ? -19.018 5.167 11.790 1.00 44.97 ? 541 ASP E C 1 +ATOM 27168 O O . ASP E 1 541 ? -18.432 5.257 12.859 1.00 44.74 ? 541 ASP E O 1 +ATOM 27169 C CB . ASP E 1 541 ? -21.228 4.021 11.948 1.00 47.01 ? 541 ASP E CB 1 +ATOM 27170 C CG . ASP E 1 541 ? -22.722 4.178 12.195 1.00 49.88 ? 541 ASP E CG 1 +ATOM 27171 O OD1 . ASP E 1 541 ? -23.143 5.266 12.649 1.00 50.23 ? 541 ASP E OD1 1 +ATOM 27172 O OD2 . ASP E 1 541 ? -23.475 3.207 11.948 1.00 51.65 ? 541 ASP E OD2 1 +ATOM 27173 N N . ASP E 1 542 ? -18.396 4.901 10.649 1.00 45.87 ? 542 ASP E N 1 +ATOM 27174 C CA . ASP E 1 542 ? -16.947 4.713 10.574 1.00 47.17 ? 542 ASP E CA 1 +ATOM 27175 C C . ASP E 1 542 ? -16.198 5.888 11.186 1.00 46.19 ? 542 ASP E C 1 +ATOM 27176 O O . ASP E 1 542 ? -15.190 5.712 11.868 1.00 46.55 ? 542 ASP E O 1 +ATOM 27177 C CB . ASP E 1 542 ? -16.505 4.582 9.118 1.00 50.49 ? 542 ASP E CB 1 +ATOM 27178 C CG . ASP E 1 542 ? -16.795 3.218 8.534 1.00 54.06 ? 542 ASP E CG 1 +ATOM 27179 O OD1 . ASP E 1 542 ? -17.831 2.616 8.895 1.00 56.77 ? 542 ASP E OD1 1 +ATOM 27180 O OD2 . ASP E 1 542 ? -15.986 2.759 7.694 1.00 54.25 ? 542 ASP E OD2 1 +ATOM 27181 N N . MET E 1 543 ? -16.699 7.087 10.923 1.00 44.54 ? 543 MET E N 1 +ATOM 27182 C CA . MET E 1 543 ? -16.085 8.313 11.408 1.00 43.47 ? 543 MET E CA 1 +ATOM 27183 C C . MET E 1 543 ? -15.878 8.400 12.924 1.00 41.80 ? 543 MET E C 1 +ATOM 27184 O O . MET E 1 543 ? -14.958 9.080 13.382 1.00 41.74 ? 543 MET E O 1 +ATOM 27185 C CB . MET E 1 543 ? -16.906 9.513 10.924 1.00 44.25 ? 543 MET E CB 1 +ATOM 27186 C CG . MET E 1 543 ? -17.055 9.574 9.404 1.00 45.72 ? 543 MET E CG 1 +ATOM 27187 S SD . MET E 1 543 ? -15.465 9.707 8.538 1.00 48.14 ? 543 MET E SD 1 +ATOM 27188 C CE . MET E 1 543 ? -15.155 8.037 8.074 1.00 45.29 ? 543 MET E CE 1 +ATOM 27189 N N . TYR E 1 544 ? -16.717 7.721 13.700 1.00 39.07 ? 544 TYR E N 1 +ATOM 27190 C CA . TYR E 1 544 ? -16.584 7.772 15.147 1.00 39.02 ? 544 TYR E CA 1 +ATOM 27191 C C . TYR E 1 544 ? -15.450 6.919 15.699 1.00 40.02 ? 544 TYR E C 1 +ATOM 27192 O O . TYR E 1 544 ? -15.236 6.881 16.906 1.00 38.94 ? 544 TYR E O 1 +ATOM 27193 C CB . TYR E 1 544 ? -17.903 7.384 15.819 1.00 36.74 ? 544 TYR E CB 1 +ATOM 27194 C CG . TYR E 1 544 ? -19.026 8.322 15.478 1.00 35.17 ? 544 TYR E CG 1 +ATOM 27195 C CD1 . TYR E 1 544 ? -19.668 8.248 14.240 1.00 33.60 ? 544 TYR E CD1 1 +ATOM 27196 C CD2 . TYR E 1 544 ? -19.422 9.312 16.366 1.00 33.26 ? 544 TYR E CD2 1 +ATOM 27197 C CE1 . TYR E 1 544 ? -20.673 9.134 13.901 1.00 33.12 ? 544 TYR E CE1 1 +ATOM 27198 C CE2 . TYR E 1 544 ? -20.431 10.209 16.036 1.00 33.86 ? 544 TYR E CE2 1 +ATOM 27199 C CZ . TYR E 1 544 ? -21.053 10.110 14.801 1.00 33.30 ? 544 TYR E CZ 1 +ATOM 27200 O OH . TYR E 1 544 ? -22.076 10.969 14.477 1.00 35.08 ? 544 TYR E OH 1 +ATOM 27201 N N . ARG E 1 545 ? -14.723 6.242 14.816 1.00 42.44 ? 545 ARG E N 1 +ATOM 27202 C CA . ARG E 1 545 ? -13.602 5.414 15.239 1.00 44.37 ? 545 ARG E CA 1 +ATOM 27203 C C . ARG E 1 545 ? -12.286 5.993 14.743 1.00 44.68 ? 545 ARG E C 1 +ATOM 27204 O O . ARG E 1 545 ? -11.218 5.478 15.067 1.00 45.83 ? 545 ARG E O 1 +ATOM 27205 C CB . ARG E 1 545 ? -13.752 3.976 14.725 1.00 45.97 ? 545 ARG E CB 1 +ATOM 27206 C CG . ARG E 1 545 ? -14.937 3.202 15.313 1.00 46.95 ? 545 ARG E CG 1 +ATOM 27207 C CD . ARG E 1 545 ? -14.909 3.190 16.831 1.00 48.26 ? 545 ARG E CD 1 +ATOM 27208 N NE . ARG E 1 545 ? -13.758 2.464 17.369 1.00 52.17 ? 545 ARG E NE 1 +ATOM 27209 C CZ . ARG E 1 545 ? -13.655 1.137 17.412 1.00 51.69 ? 545 ARG E CZ 1 +ATOM 27210 N NH1 . ARG E 1 545 ? -14.637 0.374 16.949 1.00 51.39 ? 545 ARG E NH1 1 +ATOM 27211 N NH2 . ARG E 1 545 ? -12.568 0.571 17.926 1.00 51.41 ? 545 ARG E NH2 1 +ATOM 27212 N N . ILE E 1 546 ? -12.361 7.058 13.952 1.00 44.78 ? 546 ILE E N 1 +ATOM 27213 C CA . ILE E 1 546 ? -11.157 7.696 13.430 1.00 46.62 ? 546 ILE E CA 1 +ATOM 27214 C C . ILE E 1 546 ? -10.717 8.768 14.423 1.00 47.75 ? 546 ILE E C 1 +ATOM 27215 O O . ILE E 1 546 ? -11.417 9.764 14.623 1.00 48.32 ? 546 ILE E O 1 +ATOM 27216 C CB . ILE E 1 546 ? -11.413 8.340 12.041 1.00 46.54 ? 546 ILE E CB 1 +ATOM 27217 C CG1 . ILE E 1 546 ? -11.327 7.290 10.926 1.00 48.00 ? 546 ILE E CG1 1 +ATOM 27218 C CG2 . ILE E 1 546 ? -10.366 9.397 11.765 1.00 47.39 ? 546 ILE E CG2 1 +ATOM 27219 C CD1 . ILE E 1 546 ? -12.145 6.023 11.144 1.00 49.79 ? 546 ILE E CD1 1 +ATOM 27220 N N . GLU E 1 547 ? -9.559 8.571 15.047 1.00 48.52 ? 547 GLU E N 1 +ATOM 27221 C CA . GLU E 1 547 ? -9.088 9.537 16.034 1.00 49.45 ? 547 GLU E CA 1 +ATOM 27222 C C . GLU E 1 547 ? -7.704 10.115 15.816 1.00 47.41 ? 547 GLU E C 1 +ATOM 27223 O O . GLU E 1 547 ? -7.279 10.979 16.577 1.00 49.35 ? 547 GLU E O 1 +ATOM 27224 C CB . GLU E 1 547 ? -9.165 8.930 17.428 1.00 52.27 ? 547 GLU E CB 1 +ATOM 27225 C CG . GLU E 1 547 ? -10.525 8.332 17.738 1.00 56.19 ? 547 GLU E CG 1 +ATOM 27226 C CD . GLU E 1 547 ? -10.720 8.068 19.212 1.00 58.26 ? 547 GLU E CD 1 +ATOM 27227 O OE1 . GLU E 1 547 ? -9.845 7.424 19.828 1.00 61.15 ? 547 GLU E OE1 1 +ATOM 27228 O OE2 . GLU E 1 547 ? -11.754 8.503 19.752 1.00 58.75 ? 547 GLU E OE2 1 +ATOM 27229 N N . ASP E 1 548 ? -6.994 9.639 14.799 1.00 44.36 ? 548 ASP E N 1 +ATOM 27230 C CA . ASP E 1 548 ? -5.675 10.176 14.498 1.00 41.40 ? 548 ASP E CA 1 +ATOM 27231 C C . ASP E 1 548 ? -5.744 11.096 13.277 1.00 39.11 ? 548 ASP E C 1 +ATOM 27232 O O . ASP E 1 548 ? -4.757 11.304 12.574 1.00 38.13 ? 548 ASP E O 1 +ATOM 27233 C CB . ASP E 1 548 ? -4.667 9.051 14.263 1.00 43.75 ? 548 ASP E CB 1 +ATOM 27234 C CG . ASP E 1 548 ? -5.192 7.973 13.347 1.00 46.38 ? 548 ASP E CG 1 +ATOM 27235 O OD1 . ASP E 1 548 ? -6.158 8.233 12.590 1.00 46.89 ? 548 ASP E OD1 1 +ATOM 27236 O OD2 . ASP E 1 548 ? -4.619 6.859 13.380 1.00 48.65 ? 548 ASP E OD2 1 +ATOM 27237 N N . GLU E 1 549 ? -6.934 11.635 13.033 1.00 37.03 ? 549 GLU E N 1 +ATOM 27238 C CA . GLU E 1 549 ? -7.177 12.559 11.932 1.00 35.40 ? 549 GLU E CA 1 +ATOM 27239 C C . GLU E 1 549 ? -8.127 13.617 12.442 1.00 32.83 ? 549 GLU E C 1 +ATOM 27240 O O . GLU E 1 549 ? -8.930 13.341 13.327 1.00 32.85 ? 549 GLU E O 1 +ATOM 27241 C CB . GLU E 1 549 ? -7.850 11.857 10.750 1.00 36.01 ? 549 GLU E CB 1 +ATOM 27242 C CG . GLU E 1 549 ? -6.966 10.934 9.950 1.00 36.99 ? 549 GLU E CG 1 +ATOM 27243 C CD . GLU E 1 549 ? -7.748 10.162 8.892 1.00 38.27 ? 549 GLU E CD 1 +ATOM 27244 O OE1 . GLU E 1 549 ? -8.612 10.767 8.223 1.00 38.73 ? 549 GLU E OE1 1 +ATOM 27245 O OE2 . GLU E 1 549 ? -7.495 8.952 8.719 1.00 38.18 ? 549 GLU E OE2 1 +ATOM 27246 N N . TYR E 1 550 ? -8.022 14.828 11.909 1.00 30.28 ? 550 TYR E N 1 +ATOM 27247 C CA . TYR E 1 550 ? -8.941 15.880 12.301 1.00 29.62 ? 550 TYR E CA 1 +ATOM 27248 C C . TYR E 1 550 ? -9.144 16.901 11.193 1.00 29.59 ? 550 TYR E C 1 +ATOM 27249 O O . TYR E 1 550 ? -8.295 17.064 10.306 1.00 27.05 ? 550 TYR E O 1 +ATOM 27250 C CB . TYR E 1 550 ? -8.506 16.566 13.604 1.00 29.25 ? 550 TYR E CB 1 +ATOM 27251 C CG . TYR E 1 550 ? -7.212 17.348 13.576 1.00 30.16 ? 550 TYR E CG 1 +ATOM 27252 C CD1 . TYR E 1 550 ? -5.987 16.725 13.814 1.00 30.54 ? 550 TYR E CD1 1 +ATOM 27253 C CD2 . TYR E 1 550 ? -7.221 18.731 13.416 1.00 31.18 ? 550 TYR E CD2 1 +ATOM 27254 C CE1 . TYR E 1 550 ? -4.805 17.462 13.910 1.00 30.33 ? 550 TYR E CE1 1 +ATOM 27255 C CE2 . TYR E 1 550 ? -6.043 19.479 13.506 1.00 31.95 ? 550 TYR E CE2 1 +ATOM 27256 C CZ . TYR E 1 550 ? -4.842 18.838 13.756 1.00 31.90 ? 550 TYR E CZ 1 +ATOM 27257 O OH . TYR E 1 550 ? -3.683 19.580 13.863 1.00 32.33 ? 550 TYR E OH 1 +ATOM 27258 N N . MET E 1 551 ? -10.298 17.556 11.241 1.00 30.65 ? 551 MET E N 1 +ATOM 27259 C CA . MET E 1 551 ? -10.670 18.581 10.268 1.00 32.39 ? 551 MET E CA 1 +ATOM 27260 C C . MET E 1 551 ? -10.324 19.949 10.832 1.00 31.17 ? 551 MET E C 1 +ATOM 27261 O O . MET E 1 551 ? -10.497 20.207 12.026 1.00 29.61 ? 551 MET E O 1 +ATOM 27262 C CB . MET E 1 551 ? -12.182 18.576 10.015 1.00 35.15 ? 551 MET E CB 1 +ATOM 27263 C CG . MET E 1 551 ? -12.766 17.300 9.459 1.00 39.84 ? 551 MET E CG 1 +ATOM 27264 S SD . MET E 1 551 ? -12.412 17.068 7.725 1.00 43.35 ? 551 MET E SD 1 +ATOM 27265 C CE . MET E 1 551 ? -13.510 18.324 6.970 1.00 43.24 ? 551 MET E CE 1 +ATOM 27266 N N . VAL E 1 552 ? -9.841 20.825 9.969 1.00 30.70 ? 552 VAL E N 1 +ATOM 27267 C CA . VAL E 1 552 ? -9.535 22.192 10.368 1.00 30.31 ? 552 VAL E CA 1 +ATOM 27268 C C . VAL E 1 552 ? -10.593 22.962 9.613 1.00 29.85 ? 552 VAL E C 1 +ATOM 27269 O O . VAL E 1 552 ? -10.507 23.137 8.396 1.00 28.83 ? 552 VAL E O 1 +ATOM 27270 C CB . VAL E 1 552 ? -8.125 22.622 9.917 1.00 30.00 ? 552 VAL E CB 1 +ATOM 27271 C CG1 . VAL E 1 552 ? -7.869 24.066 10.309 1.00 27.01 ? 552 VAL E CG1 1 +ATOM 27272 C CG2 . VAL E 1 552 ? -7.087 21.695 10.549 1.00 26.70 ? 552 VAL E CG2 1 +ATOM 27273 N N . GLY E 1 553 ? -11.613 23.390 10.341 1.00 30.71 ? 553 GLY E N 1 +ATOM 27274 C CA . GLY E 1 553 ? -12.700 24.096 9.708 1.00 32.85 ? 553 GLY E CA 1 +ATOM 27275 C C . GLY E 1 553 ? -13.508 23.065 8.949 1.00 35.02 ? 553 GLY E C 1 +ATOM 27276 O O . GLY E 1 553 ? -13.499 21.882 9.278 1.00 36.83 ? 553 GLY E O 1 +ATOM 27277 N N . LYS E 1 554 ? -14.172 23.497 7.896 1.00 36.24 ? 554 LYS E N 1 +ATOM 27278 C CA . LYS E 1 554 ? -15.012 22.609 7.116 1.00 36.69 ? 554 LYS E CA 1 +ATOM 27279 C C . LYS E 1 554 ? -14.292 22.051 5.894 1.00 36.26 ? 554 LYS E C 1 +ATOM 27280 O O . LYS E 1 554 ? -14.707 21.039 5.333 1.00 36.22 ? 554 LYS E O 1 +ATOM 27281 C CB . LYS E 1 554 ? -16.251 23.407 6.690 1.00 38.79 ? 554 LYS E CB 1 +ATOM 27282 C CG . LYS E 1 554 ? -17.362 22.635 6.051 1.00 43.03 ? 554 LYS E CG 1 +ATOM 27283 C CD . LYS E 1 554 ? -18.560 23.551 5.824 1.00 45.98 ? 554 LYS E CD 1 +ATOM 27284 C CE . LYS E 1 554 ? -19.752 22.779 5.269 1.00 48.91 ? 554 LYS E CE 1 +ATOM 27285 N NZ . LYS E 1 554 ? -20.265 21.744 6.231 1.00 51.04 ? 554 LYS E NZ 1 +ATOM 27286 N N . TYR E 1 555 ? -13.184 22.681 5.518 1.00 35.86 ? 555 TYR E N 1 +ATOM 27287 C CA . TYR E 1 555 ? -12.479 22.309 4.299 1.00 35.64 ? 555 TYR E CA 1 +ATOM 27288 C C . TYR E 1 555 ? -11.208 21.487 4.332 1.00 35.92 ? 555 TYR E C 1 +ATOM 27289 O O . TYR E 1 555 ? -10.891 20.809 3.353 1.00 35.81 ? 555 TYR E O 1 +ATOM 27290 C CB . TYR E 1 555 ? -12.148 23.575 3.498 1.00 36.08 ? 555 TYR E CB 1 +ATOM 27291 C CG . TYR E 1 555 ? -13.258 24.596 3.388 1.00 34.44 ? 555 TYR E CG 1 +ATOM 27292 C CD1 . TYR E 1 555 ? -14.560 24.211 3.096 1.00 32.17 ? 555 TYR E CD1 1 +ATOM 27293 C CD2 . TYR E 1 555 ? -12.983 25.964 3.508 1.00 34.55 ? 555 TYR E CD2 1 +ATOM 27294 C CE1 . TYR E 1 555 ? -15.562 25.152 2.921 1.00 33.45 ? 555 TYR E CE1 1 +ATOM 27295 C CE2 . TYR E 1 555 ? -13.975 26.917 3.330 1.00 34.28 ? 555 TYR E CE2 1 +ATOM 27296 C CZ . TYR E 1 555 ? -15.267 26.502 3.035 1.00 34.57 ? 555 TYR E CZ 1 +ATOM 27297 O OH . TYR E 1 555 ? -16.257 27.431 2.845 1.00 32.37 ? 555 TYR E OH 1 +ATOM 27298 N N . LEU E 1 556 ? -10.473 21.536 5.432 1.00 35.61 ? 556 LEU E N 1 +ATOM 27299 C CA . LEU E 1 556 ? -9.196 20.844 5.467 1.00 33.78 ? 556 LEU E CA 1 +ATOM 27300 C C . LEU E 1 556 ? -9.102 19.612 6.366 1.00 33.09 ? 556 LEU E C 1 +ATOM 27301 O O . LEU E 1 556 ? -9.431 19.661 7.550 1.00 31.55 ? 556 LEU E O 1 +ATOM 27302 C CB . LEU E 1 556 ? -8.121 21.874 5.831 1.00 33.61 ? 556 LEU E CB 1 +ATOM 27303 C CG . LEU E 1 556 ? -6.641 21.543 5.693 1.00 34.93 ? 556 LEU E CG 1 +ATOM 27304 C CD1 . LEU E 1 556 ? -5.858 22.837 5.640 1.00 34.86 ? 556 LEU E CD1 1 +ATOM 27305 C CD2 . LEU E 1 556 ? -6.180 20.664 6.858 1.00 33.36 ? 556 LEU E CD2 1 +ATOM 27306 N N . LEU E 1 557 ? -8.658 18.501 5.779 1.00 32.67 ? 557 LEU E N 1 +ATOM 27307 C CA . LEU E 1 557 ? -8.481 17.261 6.521 1.00 30.78 ? 557 LEU E CA 1 +ATOM 27308 C C . LEU E 1 557 ? -6.987 17.048 6.744 1.00 29.47 ? 557 LEU E C 1 +ATOM 27309 O O . LEU E 1 557 ? -6.200 17.041 5.800 1.00 26.43 ? 557 LEU E O 1 +ATOM 27310 C CB . LEU E 1 557 ? -9.061 16.064 5.762 1.00 31.64 ? 557 LEU E CB 1 +ATOM 27311 C CG . LEU E 1 557 ? -9.088 14.750 6.573 1.00 33.80 ? 557 LEU E CG 1 +ATOM 27312 C CD1 . LEU E 1 557 ? -10.080 13.781 5.973 1.00 36.13 ? 557 LEU E CD1 1 +ATOM 27313 C CD2 . LEU E 1 557 ? -7.716 14.126 6.605 1.00 35.60 ? 557 LEU E CD2 1 +ATOM 27314 N N . TYR E 1 558 ? -6.607 16.882 8.003 1.00 29.84 ? 558 TYR E N 1 +ATOM 27315 C CA . TYR E 1 558 ? -5.209 16.671 8.352 1.00 30.33 ? 558 TYR E CA 1 +ATOM 27316 C C . TYR E 1 558 ? -5.059 15.334 9.069 1.00 29.93 ? 558 TYR E C 1 +ATOM 27317 O O . TYR E 1 558 ? -5.741 15.061 10.058 1.00 27.90 ? 558 TYR E O 1 +ATOM 27318 C CB . TYR E 1 558 ? -4.718 17.816 9.250 1.00 29.65 ? 558 TYR E CB 1 +ATOM 27319 C CG . TYR E 1 558 ? -3.269 17.714 9.663 1.00 30.89 ? 558 TYR E CG 1 +ATOM 27320 C CD1 . TYR E 1 558 ? -2.287 17.356 8.743 1.00 30.95 ? 558 TYR E CD1 1 +ATOM 27321 C CD2 . TYR E 1 558 ? -2.872 18.001 10.972 1.00 30.83 ? 558 TYR E CD2 1 +ATOM 27322 C CE1 . TYR E 1 558 ? -0.949 17.283 9.107 1.00 31.13 ? 558 TYR E CE1 1 +ATOM 27323 C CE2 . TYR E 1 558 ? -1.532 17.934 11.352 1.00 28.79 ? 558 TYR E CE2 1 +ATOM 27324 C CZ . TYR E 1 558 ? -0.576 17.573 10.412 1.00 31.22 ? 558 TYR E CZ 1 +ATOM 27325 O OH . TYR E 1 558 ? 0.751 17.489 10.764 1.00 30.74 ? 558 TYR E OH 1 +ATOM 27326 N N . ALA E 1 559 ? -4.179 14.491 8.546 1.00 30.63 ? 559 ALA E N 1 +ATOM 27327 C CA . ALA E 1 559 ? -3.919 13.181 9.141 1.00 30.69 ? 559 ALA E CA 1 +ATOM 27328 C C . ALA E 1 559 ? -2.461 13.166 9.583 1.00 31.09 ? 559 ALA E C 1 +ATOM 27329 O O . ALA E 1 559 ? -1.586 12.676 8.859 1.00 29.84 ? 559 ALA E O 1 +ATOM 27330 C CB . ALA E 1 559 ? -4.166 12.085 8.123 1.00 28.15 ? 559 ALA E CB 1 +ATOM 27331 N N . PRO E 1 560 ? -2.177 13.714 10.775 1.00 30.84 ? 560 PRO E N 1 +ATOM 27332 C CA . PRO E 1 560 ? -0.799 13.743 11.264 1.00 31.76 ? 560 PRO E CA 1 +ATOM 27333 C C . PRO E 1 560 ? -0.192 12.359 11.446 1.00 34.37 ? 560 PRO E C 1 +ATOM 27334 O O . PRO E 1 560 ? -0.882 11.392 11.768 1.00 33.20 ? 560 PRO E O 1 +ATOM 27335 C CB . PRO E 1 560 ? -0.914 14.507 12.581 1.00 30.50 ? 560 PRO E CB 1 +ATOM 27336 C CG . PRO E 1 560 ? -2.277 14.161 13.059 1.00 30.37 ? 560 PRO E CG 1 +ATOM 27337 C CD . PRO E 1 560 ? -3.102 14.258 11.784 1.00 30.84 ? 560 PRO E CD 1 +ATOM 27338 N N . ILE E 1 561 ? 1.109 12.269 11.213 1.00 36.01 ? 561 ILE E N 1 +ATOM 27339 C CA . ILE E 1 561 ? 1.814 11.021 11.385 1.00 38.58 ? 561 ILE E CA 1 +ATOM 27340 C C . ILE E 1 561 ? 2.140 10.890 12.862 1.00 39.64 ? 561 ILE E C 1 +ATOM 27341 O O . ILE E 1 561 ? 2.947 11.642 13.393 1.00 41.59 ? 561 ILE E O 1 +ATOM 27342 C CB . ILE E 1 561 ? 3.090 11.011 10.538 1.00 40.07 ? 561 ILE E CB 1 +ATOM 27343 C CG1 . ILE E 1 561 ? 2.693 10.989 9.055 1.00 40.00 ? 561 ILE E CG1 1 +ATOM 27344 C CG2 . ILE E 1 561 ? 3.965 9.818 10.912 1.00 39.25 ? 561 ILE E CG2 1 +ATOM 27345 C CD1 . ILE E 1 561 ? 3.842 11.021 8.095 1.00 42.80 ? 561 ILE E CD1 1 +ATOM 27346 N N . VAL E 1 562 ? 1.494 9.940 13.526 1.00 41.38 ? 562 VAL E N 1 +ATOM 27347 C CA . VAL E 1 562 ? 1.696 9.733 14.955 1.00 43.55 ? 562 VAL E CA 1 +ATOM 27348 C C . VAL E 1 562 ? 2.464 8.454 15.293 1.00 45.32 ? 562 VAL E C 1 +ATOM 27349 O O . VAL E 1 562 ? 2.230 7.836 16.319 1.00 45.31 ? 562 VAL E O 1 +ATOM 27350 C CB . VAL E 1 562 ? 0.341 9.724 15.693 1.00 41.65 ? 562 VAL E CB 1 +ATOM 27351 C CG1 . VAL E 1 562 ? -0.334 11.067 15.532 1.00 41.56 ? 562 VAL E CG1 1 +ATOM 27352 C CG2 . VAL E 1 562 ? -0.547 8.620 15.137 1.00 40.03 ? 562 VAL E CG2 1 +ATOM 27353 N N . SER E 1 563 ? 3.382 8.068 14.420 1.00 49.37 ? 563 SER E N 1 +ATOM 27354 C CA . SER E 1 563 ? 4.196 6.876 14.627 1.00 53.85 ? 563 SER E CA 1 +ATOM 27355 C C . SER E 1 563 ? 5.561 7.120 13.990 1.00 55.76 ? 563 SER E C 1 +ATOM 27356 O O . SER E 1 563 ? 5.788 8.166 13.383 1.00 56.33 ? 563 SER E O 1 +ATOM 27357 C CB . SER E 1 563 ? 3.539 5.653 13.981 1.00 53.79 ? 563 SER E CB 1 +ATOM 27358 O OG . SER E 1 563 ? 3.597 5.737 12.568 1.00 54.76 ? 563 SER E OG 1 +ATOM 27359 N N . LYS E 1 564 ? 6.461 6.153 14.117 1.00 58.52 ? 564 LYS E N 1 +ATOM 27360 C CA . LYS E 1 564 ? 7.800 6.294 13.561 1.00 61.78 ? 564 LYS E CA 1 +ATOM 27361 C C . LYS E 1 564 ? 7.830 6.061 12.053 1.00 63.18 ? 564 LYS E C 1 +ATOM 27362 O O . LYS E 1 564 ? 8.806 6.408 11.386 1.00 63.22 ? 564 LYS E O 1 +ATOM 27363 C CB . LYS E 1 564 ? 8.772 5.332 14.255 1.00 63.03 ? 564 LYS E CB 1 +ATOM 27364 C CG . LYS E 1 564 ? 8.975 5.586 15.757 1.00 64.54 ? 564 LYS E CG 1 +ATOM 27365 C CD . LYS E 1 564 ? 8.094 4.687 16.657 1.00 65.78 ? 564 LYS E CD 1 +ATOM 27366 C CE . LYS E 1 564 ? 6.597 5.004 16.548 1.00 66.36 ? 564 LYS E CE 1 +ATOM 27367 N NZ . LYS E 1 564 ? 5.757 4.197 17.484 1.00 65.18 ? 564 LYS E NZ 1 +ATOM 27368 N N . GLU E 1 565 ? 6.761 5.475 11.517 1.00 64.80 ? 565 GLU E N 1 +ATOM 27369 C CA . GLU E 1 565 ? 6.669 5.207 10.082 1.00 65.64 ? 565 GLU E CA 1 +ATOM 27370 C C . GLU E 1 565 ? 6.937 6.463 9.252 1.00 65.23 ? 565 GLU E C 1 +ATOM 27371 O O . GLU E 1 565 ? 6.936 7.585 9.767 1.00 65.55 ? 565 GLU E O 1 +ATOM 27372 C CB . GLU E 1 565 ? 5.279 4.687 9.713 1.00 68.00 ? 565 GLU E CB 1 +ATOM 27373 C CG . GLU E 1 565 ? 4.877 3.354 10.323 1.00 72.55 ? 565 GLU E CG 1 +ATOM 27374 C CD . GLU E 1 565 ? 3.493 2.908 9.845 1.00 75.18 ? 565 GLU E CD 1 +ATOM 27375 O OE1 . GLU E 1 565 ? 2.509 3.657 10.068 1.00 74.82 ? 565 GLU E OE1 1 +ATOM 27376 O OE2 . GLU E 1 565 ? 3.394 1.812 9.241 1.00 75.97 ? 565 GLU E OE2 1 +ATOM 27377 N N . GLU E 1 566 ? 7.145 6.262 7.955 1.00 64.38 ? 566 GLU E N 1 +ATOM 27378 C CA . GLU E 1 566 ? 7.401 7.364 7.038 1.00 63.80 ? 566 GLU E CA 1 +ATOM 27379 C C . GLU E 1 566 ? 6.100 7.781 6.350 1.00 61.08 ? 566 GLU E C 1 +ATOM 27380 O O . GLU E 1 566 ? 5.978 8.892 5.830 1.00 60.77 ? 566 GLU E O 1 +ATOM 27381 C CB . GLU E 1 566 ? 8.439 6.943 6.001 1.00 66.29 ? 566 GLU E CB 1 +ATOM 27382 C CG . GLU E 1 566 ? 8.971 8.086 5.169 1.00 72.54 ? 566 GLU E CG 1 +ATOM 27383 C CD . GLU E 1 566 ? 10.198 7.694 4.358 1.00 76.66 ? 566 GLU E CD 1 +ATOM 27384 O OE1 . GLU E 1 566 ? 10.094 6.758 3.527 1.00 77.57 ? 566 GLU E OE1 1 +ATOM 27385 O OE2 . GLU E 1 566 ? 11.267 8.325 4.554 1.00 78.31 ? 566 GLU E OE2 1 +ATOM 27386 N N . SER E 1 567 ? 5.131 6.873 6.354 1.00 57.12 ? 567 SER E N 1 +ATOM 27387 C CA . SER E 1 567 ? 3.828 7.132 5.763 1.00 53.07 ? 567 SER E CA 1 +ATOM 27388 C C . SER E 1 567 ? 2.793 6.416 6.614 1.00 49.50 ? 567 SER E C 1 +ATOM 27389 O O . SER E 1 567 ? 3.139 5.586 7.452 1.00 51.29 ? 567 SER E O 1 +ATOM 27390 C CB . SER E 1 567 ? 3.770 6.603 4.336 1.00 53.58 ? 567 SER E CB 1 +ATOM 27391 O OG . SER E 1 567 ? 3.823 5.192 4.338 1.00 58.28 ? 567 SER E OG 1 +ATOM 27392 N N . ARG E 1 568 ? 1.524 6.728 6.399 1.00 44.00 ? 568 ARG E N 1 +ATOM 27393 C CA . ARG E 1 568 ? 0.460 6.110 7.170 1.00 39.12 ? 568 ARG E CA 1 +ATOM 27394 C C . ARG E 1 568 ? -0.778 5.918 6.312 1.00 38.30 ? 568 ARG E C 1 +ATOM 27395 O O . ARG E 1 568 ? -0.861 6.424 5.195 1.00 36.94 ? 568 ARG E O 1 +ATOM 27396 C CB . ARG E 1 568 ? 0.089 7.004 8.349 1.00 36.80 ? 568 ARG E CB 1 +ATOM 27397 C CG . ARG E 1 568 ? -0.306 8.410 7.917 1.00 35.50 ? 568 ARG E CG 1 +ATOM 27398 C CD . ARG E 1 568 ? -1.085 9.134 8.979 1.00 33.70 ? 568 ARG E CD 1 +ATOM 27399 N NE . ARG E 1 568 ? -2.421 8.573 9.133 1.00 31.59 ? 568 ARG E NE 1 +ATOM 27400 C CZ . ARG E 1 568 ? -3.284 8.947 10.074 1.00 31.18 ? 568 ARG E CZ 1 +ATOM 27401 N NH1 . ARG E 1 568 ? -2.946 9.884 10.955 1.00 29.86 ? 568 ARG E NH1 1 +ATOM 27402 N NH2 . ARG E 1 568 ? -4.491 8.392 10.130 1.00 28.19 ? 568 ARG E NH2 1 +ATOM 27403 N N . LEU E 1 569 ? -1.742 5.182 6.845 1.00 37.16 ? 569 LEU E N 1 +ATOM 27404 C CA . LEU E 1 569 ? -2.993 4.972 6.147 1.00 36.59 ? 569 LEU E CA 1 +ATOM 27405 C C . LEU E 1 569 ? -3.894 6.134 6.533 1.00 35.15 ? 569 LEU E C 1 +ATOM 27406 O O . LEU E 1 569 ? -4.003 6.484 7.706 1.00 32.32 ? 569 LEU E O 1 +ATOM 27407 C CB . LEU E 1 569 ? -3.636 3.649 6.568 1.00 38.63 ? 569 LEU E CB 1 +ATOM 27408 C CG . LEU E 1 569 ? -2.923 2.375 6.100 1.00 40.38 ? 569 LEU E CG 1 +ATOM 27409 C CD1 . LEU E 1 569 ? -3.686 1.154 6.592 1.00 40.85 ? 569 LEU E CD1 1 +ATOM 27410 C CD2 . LEU E 1 569 ? -2.829 2.368 4.578 1.00 40.64 ? 569 LEU E CD2 1 +ATOM 27411 N N . VAL E 1 570 ? -4.526 6.741 5.536 1.00 34.32 ? 570 VAL E N 1 +ATOM 27412 C CA . VAL E 1 570 ? -5.412 7.863 5.781 1.00 34.00 ? 570 VAL E CA 1 +ATOM 27413 C C . VAL E 1 570 ? -6.823 7.491 5.372 1.00 33.84 ? 570 VAL E C 1 +ATOM 27414 O O . VAL E 1 570 ? -7.051 7.052 4.251 1.00 33.91 ? 570 VAL E O 1 +ATOM 27415 C CB . VAL E 1 570 ? -4.976 9.100 4.974 1.00 33.29 ? 570 VAL E CB 1 +ATOM 27416 C CG1 . VAL E 1 570 ? -5.971 10.231 5.171 1.00 31.84 ? 570 VAL E CG1 1 +ATOM 27417 C CG2 . VAL E 1 570 ? -3.581 9.528 5.396 1.00 33.80 ? 570 VAL E CG2 1 +ATOM 27418 N N . THR E 1 571 ? -7.767 7.651 6.287 1.00 34.09 ? 571 THR E N 1 +ATOM 27419 C CA . THR E 1 571 ? -9.157 7.358 5.979 1.00 36.71 ? 571 THR E CA 1 +ATOM 27420 C C . THR E 1 571 ? -9.834 8.647 5.507 1.00 37.31 ? 571 THR E C 1 +ATOM 27421 O O . THR E 1 571 ? -9.858 9.649 6.225 1.00 37.56 ? 571 THR E O 1 +ATOM 27422 C CB . THR E 1 571 ? -9.904 6.821 7.209 1.00 37.72 ? 571 THR E CB 1 +ATOM 27423 O OG1 . THR E 1 571 ? -9.349 5.558 7.588 1.00 36.74 ? 571 THR E OG1 1 +ATOM 27424 C CG2 . THR E 1 571 ? -11.377 6.637 6.898 1.00 39.42 ? 571 THR E CG2 1 +ATOM 27425 N N . LEU E 1 572 ? -10.371 8.620 4.293 1.00 36.75 ? 572 LEU E N 1 +ATOM 27426 C CA . LEU E 1 572 ? -11.040 9.781 3.738 1.00 37.62 ? 572 LEU E CA 1 +ATOM 27427 C C . LEU E 1 572 ? -12.549 9.615 3.790 1.00 38.67 ? 572 LEU E C 1 +ATOM 27428 O O . LEU E 1 572 ? -13.074 8.566 3.432 1.00 39.22 ? 572 LEU E O 1 +ATOM 27429 C CB . LEU E 1 572 ? -10.613 9.993 2.289 1.00 37.18 ? 572 LEU E CB 1 +ATOM 27430 C CG . LEU E 1 572 ? -9.135 10.285 2.025 1.00 38.42 ? 572 LEU E CG 1 +ATOM 27431 C CD1 . LEU E 1 572 ? -8.882 10.309 0.535 1.00 38.30 ? 572 LEU E CD1 1 +ATOM 27432 C CD2 . LEU E 1 572 ? -8.750 11.617 2.649 1.00 38.98 ? 572 LEU E CD2 1 +ATOM 27433 N N . PRO E 1 573 ? -13.267 10.645 4.261 1.00 39.54 ? 573 PRO E N 1 +ATOM 27434 C CA . PRO E 1 573 ? -14.730 10.568 4.333 1.00 39.35 ? 573 PRO E CA 1 +ATOM 27435 C C . PRO E 1 573 ? -15.327 10.645 2.923 1.00 40.00 ? 573 PRO E C 1 +ATOM 27436 O O . PRO E 1 573 ? -14.607 10.813 1.940 1.00 37.42 ? 573 PRO E O 1 +ATOM 27437 C CB . PRO E 1 573 ? -15.104 11.793 5.164 1.00 39.03 ? 573 PRO E CB 1 +ATOM 27438 C CG . PRO E 1 573 ? -13.874 12.062 5.977 1.00 40.11 ? 573 PRO E CG 1 +ATOM 27439 C CD . PRO E 1 573 ? -12.768 11.826 4.985 1.00 38.85 ? 573 PRO E CD 1 +ATOM 27440 N N . ARG E 1 574 ? -16.646 10.534 2.844 1.00 42.78 ? 574 ARG E N 1 +ATOM 27441 C CA . ARG E 1 574 ? -17.374 10.607 1.585 1.00 44.82 ? 574 ARG E CA 1 +ATOM 27442 C C . ARG E 1 574 ? -17.035 11.909 0.849 1.00 43.11 ? 574 ARG E C 1 +ATOM 27443 O O . ARG E 1 574 ? -16.788 12.932 1.475 1.00 43.21 ? 574 ARG E O 1 +ATOM 27444 C CB . ARG E 1 574 ? -18.871 10.541 1.888 1.00 49.85 ? 574 ARG E CB 1 +ATOM 27445 C CG . ARG E 1 574 ? -19.771 10.422 0.678 1.00 58.98 ? 574 ARG E CG 1 +ATOM 27446 C CD . ARG E 1 574 ? -21.217 10.163 1.112 1.00 66.15 ? 574 ARG E CD 1 +ATOM 27447 N NE . ARG E 1 574 ? -22.157 10.162 -0.014 1.00 72.22 ? 574 ARG E NE 1 +ATOM 27448 C CZ . ARG E 1 574 ? -23.474 9.970 0.101 1.00 74.59 ? 574 ARG E CZ 1 +ATOM 27449 N NH1 . ARG E 1 574 ? -24.023 9.759 1.297 1.00 75.06 ? 574 ARG E NH1 1 +ATOM 27450 N NH2 . ARG E 1 574 ? -24.247 9.996 -0.980 1.00 75.10 ? 574 ARG E NH2 1 +ATOM 27451 N N . GLY E 1 575 ? -17.016 11.870 -0.478 1.00 41.04 ? 575 GLY E N 1 +ATOM 27452 C CA . GLY E 1 575 ? -16.716 13.067 -1.242 1.00 39.70 ? 575 GLY E CA 1 +ATOM 27453 C C . GLY E 1 575 ? -15.340 13.028 -1.873 1.00 40.37 ? 575 GLY E C 1 +ATOM 27454 O O . GLY E 1 575 ? -14.608 12.069 -1.690 1.00 39.59 ? 575 GLY E O 1 +ATOM 27455 N N . LYS E 1 576 ? -14.976 14.060 -2.622 1.00 40.61 ? 576 LYS E N 1 +ATOM 27456 C CA . LYS E 1 576 ? -13.664 14.084 -3.247 1.00 40.90 ? 576 LYS E CA 1 +ATOM 27457 C C . LYS E 1 576 ? -12.655 14.868 -2.414 1.00 39.89 ? 576 LYS E C 1 +ATOM 27458 O O . LYS E 1 576 ? -13.000 15.850 -1.755 1.00 39.34 ? 576 LYS E O 1 +ATOM 27459 C CB . LYS E 1 576 ? -13.759 14.673 -4.650 1.00 43.11 ? 576 LYS E CB 1 +ATOM 27460 C CG . LYS E 1 576 ? -14.407 13.739 -5.657 1.00 46.01 ? 576 LYS E CG 1 +ATOM 27461 C CD . LYS E 1 576 ? -14.475 14.376 -7.035 1.00 49.78 ? 576 LYS E CD 1 +ATOM 27462 C CE . LYS E 1 576 ? -14.986 13.393 -8.075 1.00 51.25 ? 576 LYS E CE 1 +ATOM 27463 N NZ . LYS E 1 576 ? -15.136 14.023 -9.421 1.00 52.86 ? 576 LYS E NZ 1 +ATOM 27464 N N . TRP E 1 577 ? -11.404 14.418 -2.436 1.00 38.50 ? 577 TRP E N 1 +ATOM 27465 C CA . TRP E 1 577 ? -10.353 15.078 -1.682 1.00 35.96 ? 577 TRP E CA 1 +ATOM 27466 C C . TRP E 1 577 ? -9.133 15.355 -2.532 1.00 36.00 ? 577 TRP E C 1 +ATOM 27467 O O . TRP E 1 577 ? -8.698 14.511 -3.313 1.00 35.28 ? 577 TRP E O 1 +ATOM 27468 C CB . TRP E 1 577 ? -9.973 14.241 -0.464 1.00 34.33 ? 577 TRP E CB 1 +ATOM 27469 C CG . TRP E 1 577 ? -11.140 14.021 0.440 1.00 32.51 ? 577 TRP E CG 1 +ATOM 27470 C CD1 . TRP E 1 577 ? -12.092 13.054 0.325 1.00 32.37 ? 577 TRP E CD1 1 +ATOM 27471 C CD2 . TRP E 1 577 ? -11.522 14.830 1.558 1.00 32.37 ? 577 TRP E CD2 1 +ATOM 27472 N NE1 . TRP E 1 577 ? -13.047 13.208 1.299 1.00 32.88 ? 577 TRP E NE1 1 +ATOM 27473 C CE2 . TRP E 1 577 ? -12.721 14.293 2.070 1.00 32.76 ? 577 TRP E CE2 1 +ATOM 27474 C CE3 . TRP E 1 577 ? -10.966 15.959 2.177 1.00 32.93 ? 577 TRP E CE3 1 +ATOM 27475 C CZ2 . TRP E 1 577 ? -13.376 14.843 3.174 1.00 34.11 ? 577 TRP E CZ2 1 +ATOM 27476 C CZ3 . TRP E 1 577 ? -11.612 16.506 3.274 1.00 32.57 ? 577 TRP E CZ3 1 +ATOM 27477 C CH2 . TRP E 1 577 ? -12.806 15.948 3.762 1.00 36.33 ? 577 TRP E CH2 1 +ATOM 27478 N N . TYR E 1 578 ? -8.597 16.559 -2.372 1.00 35.48 ? 578 TYR E N 1 +ATOM 27479 C CA . TYR E 1 578 ? -7.430 17.011 -3.112 1.00 34.75 ? 578 TYR E CA 1 +ATOM 27480 C C . TYR E 1 578 ? -6.183 16.922 -2.235 1.00 34.08 ? 578 TYR E C 1 +ATOM 27481 O O . TYR E 1 578 ? -6.146 17.462 -1.131 1.00 35.08 ? 578 TYR E O 1 +ATOM 27482 C CB . TYR E 1 578 ? -7.679 18.455 -3.562 1.00 34.95 ? 578 TYR E CB 1 +ATOM 27483 C CG . TYR E 1 578 ? -6.482 19.187 -4.129 1.00 35.95 ? 578 TYR E CG 1 +ATOM 27484 C CD1 . TYR E 1 578 ? -6.031 18.938 -5.422 1.00 35.43 ? 578 TYR E CD1 1 +ATOM 27485 C CD2 . TYR E 1 578 ? -5.819 20.152 -3.374 1.00 35.98 ? 578 TYR E CD2 1 +ATOM 27486 C CE1 . TYR E 1 578 ? -4.956 19.637 -5.949 1.00 36.60 ? 578 TYR E CE1 1 +ATOM 27487 C CE2 . TYR E 1 578 ? -4.746 20.849 -3.885 1.00 36.98 ? 578 TYR E CE2 1 +ATOM 27488 C CZ . TYR E 1 578 ? -4.317 20.593 -5.174 1.00 38.30 ? 578 TYR E CZ 1 +ATOM 27489 O OH . TYR E 1 578 ? -3.251 21.308 -5.683 1.00 39.32 ? 578 TYR E OH 1 +ATOM 27490 N N . ASN E 1 579 ? -5.172 16.218 -2.723 1.00 34.46 ? 579 ASN E N 1 +ATOM 27491 C CA . ASN E 1 579 ? -3.915 16.073 -1.989 1.00 35.14 ? 579 ASN E CA 1 +ATOM 27492 C C . ASN E 1 579 ? -3.150 17.394 -2.122 1.00 35.88 ? 579 ASN E C 1 +ATOM 27493 O O . ASN E 1 579 ? -2.593 17.701 -3.186 1.00 34.86 ? 579 ASN E O 1 +ATOM 27494 C CB . ASN E 1 579 ? -3.084 14.925 -2.573 1.00 34.25 ? 579 ASN E CB 1 +ATOM 27495 C CG . ASN E 1 579 ? -1.782 14.706 -1.819 1.00 35.30 ? 579 ASN E CG 1 +ATOM 27496 O OD1 . ASN E 1 579 ? -1.062 15.657 -1.524 1.00 34.02 ? 579 ASN E OD1 1 +ATOM 27497 N ND2 . ASN E 1 579 ? -1.469 13.447 -1.513 1.00 35.28 ? 579 ASN E ND2 1 +ATOM 27498 N N . TYR E 1 580 ? -3.133 18.175 -1.044 1.00 35.52 ? 580 TYR E N 1 +ATOM 27499 C CA . TYR E 1 580 ? -2.459 19.470 -1.050 1.00 36.32 ? 580 TYR E CA 1 +ATOM 27500 C C . TYR E 1 580 ? -1.048 19.441 -1.645 1.00 35.93 ? 580 TYR E C 1 +ATOM 27501 O O . TYR E 1 580 ? -0.646 20.372 -2.345 1.00 34.56 ? 580 TYR E O 1 +ATOM 27502 C CB . TYR E 1 580 ? -2.399 20.034 0.374 1.00 36.89 ? 580 TYR E CB 1 +ATOM 27503 C CG . TYR E 1 580 ? -1.710 21.379 0.494 1.00 36.62 ? 580 TYR E CG 1 +ATOM 27504 C CD1 . TYR E 1 580 ? -2.296 22.540 -0.018 1.00 39.22 ? 580 TYR E CD1 1 +ATOM 27505 C CD2 . TYR E 1 580 ? -0.479 21.492 1.125 1.00 38.73 ? 580 TYR E CD2 1 +ATOM 27506 C CE1 . TYR E 1 580 ? -1.670 23.785 0.102 1.00 38.52 ? 580 TYR E CE1 1 +ATOM 27507 C CE2 . TYR E 1 580 ? 0.158 22.729 1.250 1.00 41.59 ? 580 TYR E CE2 1 +ATOM 27508 C CZ . TYR E 1 580 ? -0.446 23.871 0.739 1.00 40.61 ? 580 TYR E CZ 1 +ATOM 27509 O OH . TYR E 1 580 ? 0.173 25.092 0.902 1.00 42.33 ? 580 TYR E OH 1 +ATOM 27510 N N . TRP E 1 581 ? -0.309 18.367 -1.393 1.00 36.13 ? 581 TRP E N 1 +ATOM 27511 C CA . TRP E 1 581 ? 1.066 18.283 -1.871 1.00 37.71 ? 581 TRP E CA 1 +ATOM 27512 C C . TRP E 1 581 ? 1.334 17.776 -3.284 1.00 38.59 ? 581 TRP E C 1 +ATOM 27513 O O . TRP E 1 581 ? 2.237 18.287 -3.947 1.00 40.50 ? 581 TRP E O 1 +ATOM 27514 C CB . TRP E 1 581 ? 1.913 17.488 -0.873 1.00 37.46 ? 581 TRP E CB 1 +ATOM 27515 C CG . TRP E 1 581 ? 1.907 18.092 0.505 1.00 40.55 ? 581 TRP E CG 1 +ATOM 27516 C CD1 . TRP E 1 581 ? 1.211 17.649 1.589 1.00 40.35 ? 581 TRP E CD1 1 +ATOM 27517 C CD2 . TRP E 1 581 ? 2.612 19.270 0.937 1.00 41.65 ? 581 TRP E CD2 1 +ATOM 27518 N NE1 . TRP E 1 581 ? 1.435 18.470 2.670 1.00 40.61 ? 581 TRP E NE1 1 +ATOM 27519 C CE2 . TRP E 1 581 ? 2.291 19.472 2.300 1.00 41.00 ? 581 TRP E CE2 1 +ATOM 27520 C CE3 . TRP E 1 581 ? 3.481 20.172 0.306 1.00 40.77 ? 581 TRP E CE3 1 +ATOM 27521 C CZ2 . TRP E 1 581 ? 2.809 20.540 3.046 1.00 40.38 ? 581 TRP E CZ2 1 +ATOM 27522 C CZ3 . TRP E 1 581 ? 3.997 21.236 1.051 1.00 40.96 ? 581 TRP E CZ3 1 +ATOM 27523 C CH2 . TRP E 1 581 ? 3.656 21.406 2.407 1.00 40.27 ? 581 TRP E CH2 1 +ATOM 27524 N N . ASN E 1 582 ? 0.594 16.783 -3.764 1.00 38.12 ? 582 ASN E N 1 +ATOM 27525 C CA . ASN E 1 582 ? 0.863 16.310 -5.119 1.00 38.32 ? 582 ASN E CA 1 +ATOM 27526 C C . ASN E 1 582 ? -0.294 16.564 -6.069 1.00 37.33 ? 582 ASN E C 1 +ATOM 27527 O O . ASN E 1 582 ? -0.209 16.274 -7.258 1.00 37.00 ? 582 ASN E O 1 +ATOM 27528 C CB . ASN E 1 582 ? 1.252 14.822 -5.133 1.00 38.18 ? 582 ASN E CB 1 +ATOM 27529 C CG . ASN E 1 582 ? 0.111 13.914 -4.767 1.00 38.79 ? 582 ASN E CG 1 +ATOM 27530 O OD1 . ASN E 1 582 ? -1.059 14.295 -4.845 1.00 43.02 ? 582 ASN E OD1 1 +ATOM 27531 N ND2 . ASN E 1 582 ? 0.441 12.691 -4.383 1.00 39.13 ? 582 ASN E ND2 1 +ATOM 27532 N N . GLY E 1 583 ? -1.379 17.104 -5.538 1.00 37.82 ? 583 GLY E N 1 +ATOM 27533 C CA . GLY E 1 583 ? -2.519 17.420 -6.375 1.00 38.70 ? 583 GLY E CA 1 +ATOM 27534 C C . GLY E 1 583 ? -3.449 16.308 -6.821 1.00 39.39 ? 583 GLY E C 1 +ATOM 27535 O O . GLY E 1 583 ? -4.366 16.564 -7.596 1.00 40.69 ? 583 GLY E O 1 +ATOM 27536 N N . GLU E 1 584 ? -3.247 15.082 -6.361 1.00 39.62 ? 584 GLU E N 1 +ATOM 27537 C CA . GLU E 1 584 ? -4.142 14.006 -6.767 1.00 41.08 ? 584 GLU E CA 1 +ATOM 27538 C C . GLU E 1 584 ? -5.549 14.161 -6.171 1.00 39.85 ? 584 GLU E C 1 +ATOM 27539 O O . GLU E 1 584 ? -5.704 14.616 -5.044 1.00 40.05 ? 584 GLU E O 1 +ATOM 27540 C CB . GLU E 1 584 ? -3.550 12.664 -6.345 1.00 43.77 ? 584 GLU E CB 1 +ATOM 27541 C CG . GLU E 1 584 ? -4.541 11.514 -6.327 1.00 48.95 ? 584 GLU E CG 1 +ATOM 27542 C CD . GLU E 1 584 ? -3.876 10.171 -6.038 1.00 54.48 ? 584 GLU E CD 1 +ATOM 27543 O OE1 . GLU E 1 584 ? -3.001 10.117 -5.139 1.00 59.05 ? 584 GLU E OE1 1 +ATOM 27544 O OE2 . GLU E 1 584 ? -4.229 9.166 -6.697 1.00 55.35 ? 584 GLU E OE2 1 +ATOM 27545 N N . ILE E 1 585 ? -6.579 13.814 -6.937 1.00 40.43 ? 585 ILE E N 1 +ATOM 27546 C CA . ILE E 1 585 ? -7.947 13.872 -6.417 1.00 40.45 ? 585 ILE E CA 1 +ATOM 27547 C C . ILE E 1 585 ? -8.330 12.431 -6.143 1.00 41.31 ? 585 ILE E C 1 +ATOM 27548 O O . ILE E 1 585 ? -8.252 11.591 -7.039 1.00 39.88 ? 585 ILE E O 1 +ATOM 27549 C CB . ILE E 1 585 ? -8.986 14.396 -7.426 1.00 41.01 ? 585 ILE E CB 1 +ATOM 27550 C CG1 . ILE E 1 585 ? -8.641 15.810 -7.900 1.00 40.62 ? 585 ILE E CG1 1 +ATOM 27551 C CG2 . ILE E 1 585 ? -10.362 14.388 -6.764 1.00 42.04 ? 585 ILE E CG2 1 +ATOM 27552 C CD1 . ILE E 1 585 ? -8.856 16.867 -6.869 1.00 40.27 ? 585 ILE E CD1 1 +ATOM 27553 N N . ILE E 1 586 ? -8.734 12.151 -4.909 1.00 42.93 ? 586 ILE E N 1 +ATOM 27554 C CA . ILE E 1 586 ? -9.130 10.812 -4.505 1.00 44.72 ? 586 ILE E CA 1 +ATOM 27555 C C . ILE E 1 586 ? -10.597 10.829 -4.090 1.00 47.10 ? 586 ILE E C 1 +ATOM 27556 O O . ILE E 1 586 ? -11.058 11.771 -3.445 1.00 47.56 ? 586 ILE E O 1 +ATOM 27557 C CB . ILE E 1 586 ? -8.307 10.318 -3.297 1.00 44.87 ? 586 ILE E CB 1 +ATOM 27558 C CG1 . ILE E 1 586 ? -6.816 10.592 -3.518 1.00 45.20 ? 586 ILE E CG1 1 +ATOM 27559 C CG2 . ILE E 1 586 ? -8.556 8.842 -3.067 1.00 44.57 ? 586 ILE E CG2 1 +ATOM 27560 C CD1 . ILE E 1 586 ? -6.308 11.859 -2.799 1.00 43.17 ? 586 ILE E CD1 1 +ATOM 27561 N N . ASN E 1 587 ? -11.326 9.784 -4.460 1.00 49.89 ? 587 ASN E N 1 +ATOM 27562 C CA . ASN E 1 587 ? -12.735 9.670 -4.113 1.00 52.96 ? 587 ASN E CA 1 +ATOM 27563 C C . ASN E 1 587 ? -12.923 9.205 -2.684 1.00 54.56 ? 587 ASN E C 1 +ATOM 27564 O O . ASN E 1 587 ? -12.297 8.246 -2.235 1.00 54.18 ? 587 ASN E O 1 +ATOM 27565 C CB . ASN E 1 587 ? -13.437 8.716 -5.065 1.00 55.13 ? 587 ASN E CB 1 +ATOM 27566 C CG . ASN E 1 587 ? -13.843 9.392 -6.343 1.00 57.23 ? 587 ASN E CG 1 +ATOM 27567 O OD1 . ASN E 1 587 ? -14.651 10.319 -6.327 1.00 59.96 ? 587 ASN E OD1 1 +ATOM 27568 N ND2 . ASN E 1 587 ? -13.279 8.949 -7.459 1.00 58.32 ? 587 ASN E ND2 1 +ATOM 27569 N N . GLY E 1 588 ? -13.810 9.899 -1.982 1.00 55.51 ? 588 GLY E N 1 +ATOM 27570 C CA . GLY E 1 588 ? -14.079 9.605 -0.591 1.00 56.83 ? 588 GLY E CA 1 +ATOM 27571 C C . GLY E 1 588 ? -14.584 8.224 -0.243 1.00 57.55 ? 588 GLY E C 1 +ATOM 27572 O O . GLY E 1 588 ? -15.026 7.456 -1.098 1.00 58.08 ? 588 GLY E O 1 +ATOM 27573 N N . LYS E 1 589 ? -14.529 7.936 1.052 1.00 57.39 ? 589 LYS E N 1 +ATOM 27574 C CA . LYS E 1 589 ? -14.953 6.665 1.591 1.00 54.71 ? 589 LYS E CA 1 +ATOM 27575 C C . LYS E 1 589 ? -13.956 5.650 1.070 1.00 51.89 ? 589 LYS E C 1 +ATOM 27576 O O . LYS E 1 589 ? -14.297 4.736 0.335 1.00 52.25 ? 589 LYS E O 1 +ATOM 27577 C CB . LYS E 1 589 ? -16.375 6.343 1.133 1.00 57.72 ? 589 LYS E CB 1 +ATOM 27578 C CG . LYS E 1 589 ? -17.074 5.328 2.016 1.00 61.54 ? 589 LYS E CG 1 +ATOM 27579 C CD . LYS E 1 589 ? -17.018 5.742 3.486 1.00 63.03 ? 589 LYS E CD 1 +ATOM 27580 C CE . LYS E 1 589 ? -17.571 4.645 4.388 1.00 64.43 ? 589 LYS E CE 1 +ATOM 27581 N NZ . LYS E 1 589 ? -17.307 4.934 5.820 1.00 65.50 ? 589 LYS E NZ 1 +ATOM 27582 N N . SER E 1 590 ? -12.701 5.854 1.449 1.00 49.26 ? 590 SER E N 1 +ATOM 27583 C CA . SER E 1 590 ? -11.618 4.977 1.050 1.00 46.41 ? 590 SER E CA 1 +ATOM 27584 C C . SER E 1 590 ? -10.435 5.196 1.979 1.00 44.95 ? 590 SER E C 1 +ATOM 27585 O O . SER E 1 590 ? -10.422 6.135 2.772 1.00 43.58 ? 590 SER E O 1 +ATOM 27586 C CB . SER E 1 590 ? -11.195 5.267 -0.391 1.00 46.48 ? 590 SER E CB 1 +ATOM 27587 O OG . SER E 1 590 ? -10.639 6.565 -0.511 1.00 45.98 ? 590 SER E OG 1 +ATOM 27588 N N . VAL E 1 591 ? -9.447 4.317 1.872 1.00 43.43 ? 591 VAL E N 1 +ATOM 27589 C CA . VAL E 1 591 ? -8.246 4.400 2.678 1.00 43.03 ? 591 VAL E CA 1 +ATOM 27590 C C . VAL E 1 591 ? -7.060 4.501 1.729 1.00 43.92 ? 591 VAL E C 1 +ATOM 27591 O O . VAL E 1 591 ? -6.919 3.691 0.821 1.00 45.28 ? 591 VAL E O 1 +ATOM 27592 C CB . VAL E 1 591 ? -8.091 3.157 3.571 1.00 41.92 ? 591 VAL E CB 1 +ATOM 27593 C CG1 . VAL E 1 591 ? -6.769 3.210 4.307 1.00 42.91 ? 591 VAL E CG1 1 +ATOM 27594 C CG2 . VAL E 1 591 ? -9.240 3.088 4.563 1.00 39.68 ? 591 VAL E CG2 1 +ATOM 27595 N N . VAL E 1 592 ? -6.216 5.506 1.932 1.00 44.22 ? 592 VAL E N 1 +ATOM 27596 C CA . VAL E 1 592 ? -5.057 5.708 1.075 1.00 43.29 ? 592 VAL E CA 1 +ATOM 27597 C C . VAL E 1 592 ? -3.811 5.904 1.908 1.00 43.41 ? 592 VAL E C 1 +ATOM 27598 O O . VAL E 1 592 ? -3.882 6.183 3.099 1.00 43.73 ? 592 VAL E O 1 +ATOM 27599 C CB . VAL E 1 592 ? -5.232 6.948 0.165 1.00 43.96 ? 592 VAL E CB 1 +ATOM 27600 C CG1 . VAL E 1 592 ? -6.496 6.801 -0.660 1.00 45.61 ? 592 VAL E CG1 1 +ATOM 27601 C CG2 . VAL E 1 592 ? -5.286 8.222 1.005 1.00 42.42 ? 592 VAL E CG2 1 +ATOM 27602 N N . LYS E 1 593 ? -2.666 5.760 1.264 1.00 44.15 ? 593 LYS E N 1 +ATOM 27603 C CA . LYS E 1 593 ? -1.389 5.916 1.930 1.00 46.25 ? 593 LYS E CA 1 +ATOM 27604 C C . LYS E 1 593 ? -0.962 7.376 1.775 1.00 45.24 ? 593 LYS E C 1 +ATOM 27605 O O . LYS E 1 593 ? -1.122 7.959 0.703 1.00 45.07 ? 593 LYS E O 1 +ATOM 27606 C CB . LYS E 1 593 ? -0.375 4.970 1.281 1.00 49.65 ? 593 LYS E CB 1 +ATOM 27607 C CG . LYS E 1 593 ? 0.964 4.864 1.980 1.00 55.75 ? 593 LYS E CG 1 +ATOM 27608 C CD . LYS E 1 593 ? 1.877 3.893 1.221 1.00 60.87 ? 593 LYS E CD 1 +ATOM 27609 C CE . LYS E 1 593 ? 3.275 3.804 1.838 1.00 62.29 ? 593 LYS E CE 1 +ATOM 27610 N NZ . LYS E 1 593 ? 4.175 2.870 1.089 1.00 64.93 ? 593 LYS E NZ 1 +ATOM 27611 N N . SER E 1 594 ? -0.455 7.977 2.848 1.00 43.00 ? 594 SER E N 1 +ATOM 27612 C CA . SER E 1 594 ? -0.020 9.368 2.795 1.00 40.57 ? 594 SER E CA 1 +ATOM 27613 C C . SER E 1 594 ? 1.140 9.475 1.817 1.00 39.88 ? 594 SER E C 1 +ATOM 27614 O O . SER E 1 594 ? 1.778 8.471 1.501 1.00 37.87 ? 594 SER E O 1 +ATOM 27615 C CB . SER E 1 594 ? 0.408 9.843 4.186 1.00 40.82 ? 594 SER E CB 1 +ATOM 27616 O OG . SER E 1 594 ? 1.348 8.958 4.770 1.00 39.89 ? 594 SER E OG 1 +ATOM 27617 N N . THR E 1 595 ? 1.414 10.685 1.337 1.00 39.61 ? 595 THR E N 1 +ATOM 27618 C CA . THR E 1 595 ? 2.493 10.879 0.374 1.00 40.27 ? 595 THR E CA 1 +ATOM 27619 C C . THR E 1 595 ? 3.525 11.906 0.812 1.00 42.37 ? 595 THR E C 1 +ATOM 27620 O O . THR E 1 595 ? 4.572 12.039 0.187 1.00 42.71 ? 595 THR E O 1 +ATOM 27621 C CB . THR E 1 595 ? 1.949 11.333 -1.007 1.00 40.11 ? 595 THR E CB 1 +ATOM 27622 O OG1 . THR E 1 595 ? 1.401 12.659 -0.904 1.00 39.38 ? 595 THR E OG1 1 +ATOM 27623 C CG2 . THR E 1 595 ? 0.875 10.370 -1.505 1.00 39.38 ? 595 THR E CG2 1 +ATOM 27624 N N . HIS E 1 596 ? 3.229 12.631 1.883 1.00 44.44 ? 596 HIS E N 1 +ATOM 27625 C CA . HIS E 1 596 ? 4.123 13.670 2.386 1.00 45.76 ? 596 HIS E CA 1 +ATOM 27626 C C . HIS E 1 596 ? 4.236 13.481 3.904 1.00 45.84 ? 596 HIS E C 1 +ATOM 27627 O O . HIS E 1 596 ? 3.492 12.689 4.477 1.00 43.74 ? 596 HIS E O 1 +ATOM 27628 C CB . HIS E 1 596 ? 3.514 15.040 2.038 1.00 48.17 ? 596 HIS E CB 1 +ATOM 27629 C CG . HIS E 1 596 ? 4.393 16.212 2.358 1.00 52.47 ? 596 HIS E CG 1 +ATOM 27630 N ND1 . HIS E 1 596 ? 5.321 16.714 1.469 1.00 54.32 ? 596 HIS E ND1 1 +ATOM 27631 C CD2 . HIS E 1 596 ? 4.480 16.984 3.469 1.00 52.24 ? 596 HIS E CD2 1 +ATOM 27632 C CE1 . HIS E 1 596 ? 5.940 17.746 2.018 1.00 54.41 ? 596 HIS E CE1 1 +ATOM 27633 N NE2 . HIS E 1 596 ? 5.448 17.930 3.231 1.00 53.37 ? 596 HIS E NE2 1 +ATOM 27634 N N . GLU E 1 597 ? 5.168 14.185 4.549 1.00 47.84 ? 597 GLU E N 1 +ATOM 27635 C CA . GLU E 1 597 ? 5.331 14.080 6.001 1.00 49.32 ? 597 GLU E CA 1 +ATOM 27636 C C . GLU E 1 597 ? 4.145 14.718 6.719 1.00 47.85 ? 597 GLU E C 1 +ATOM 27637 O O . GLU E 1 597 ? 3.830 14.347 7.846 1.00 48.98 ? 597 GLU E O 1 +ATOM 27638 C CB . GLU E 1 597 ? 6.620 14.764 6.464 1.00 53.08 ? 597 GLU E CB 1 +ATOM 27639 C CG . GLU E 1 597 ? 7.901 14.102 5.977 1.00 59.71 ? 597 GLU E CG 1 +ATOM 27640 C CD . GLU E 1 597 ? 9.160 14.768 6.535 1.00 64.15 ? 597 GLU E CD 1 +ATOM 27641 O OE1 . GLU E 1 597 ? 9.412 14.656 7.760 1.00 65.84 ? 597 GLU E OE1 1 +ATOM 27642 O OE2 . GLU E 1 597 ? 9.896 15.409 5.748 1.00 66.40 ? 597 GLU E OE2 1 +ATOM 27643 N N . LEU E 1 598 ? 3.499 15.683 6.064 1.00 45.49 ? 598 LEU E N 1 +ATOM 27644 C CA . LEU E 1 598 ? 2.338 16.375 6.619 1.00 42.31 ? 598 LEU E CA 1 +ATOM 27645 C C . LEU E 1 598 ? 1.142 16.127 5.692 1.00 42.12 ? 598 LEU E C 1 +ATOM 27646 O O . LEU E 1 598 ? 0.883 16.908 4.778 1.00 41.34 ? 598 LEU E O 1 +ATOM 27647 C CB . LEU E 1 598 ? 2.619 17.872 6.710 1.00 40.57 ? 598 LEU E CB 1 +ATOM 27648 C CG . LEU E 1 598 ? 3.901 18.305 7.427 1.00 41.17 ? 598 LEU E CG 1 +ATOM 27649 C CD1 . LEU E 1 598 ? 4.052 19.801 7.280 1.00 41.04 ? 598 LEU E CD1 1 +ATOM 27650 C CD2 . LEU E 1 598 ? 3.871 17.917 8.901 1.00 38.73 ? 598 LEU E CD2 1 +ATOM 27651 N N . PRO E 1 599 ? 0.398 15.026 5.920 1.00 41.58 ? 599 PRO E N 1 +ATOM 27652 C CA . PRO E 1 599 ? -0.779 14.621 5.127 1.00 38.98 ? 599 PRO E CA 1 +ATOM 27653 C C . PRO E 1 599 ? -1.974 15.573 5.195 1.00 37.28 ? 599 PRO E C 1 +ATOM 27654 O O . PRO E 1 599 ? -2.819 15.459 6.089 1.00 35.63 ? 599 PRO E O 1 +ATOM 27655 C CB . PRO E 1 599 ? -1.123 13.245 5.694 1.00 39.72 ? 599 PRO E CB 1 +ATOM 27656 C CG . PRO E 1 599 ? 0.186 12.761 6.271 1.00 40.81 ? 599 PRO E CG 1 +ATOM 27657 C CD . PRO E 1 599 ? 0.722 14.001 6.926 1.00 40.63 ? 599 PRO E CD 1 +ATOM 27658 N N . ILE E 1 600 ? -2.052 16.486 4.231 1.00 35.59 ? 600 ILE E N 1 +ATOM 27659 C CA . ILE E 1 600 ? -3.124 17.479 4.174 1.00 34.72 ? 600 ILE E CA 1 +ATOM 27660 C C . ILE E 1 600 ? -3.994 17.280 2.933 1.00 34.79 ? 600 ILE E C 1 +ATOM 27661 O O . ILE E 1 600 ? -3.483 17.116 1.826 1.00 33.93 ? 600 ILE E O 1 +ATOM 27662 C CB . ILE E 1 600 ? -2.533 18.906 4.138 1.00 33.81 ? 600 ILE E CB 1 +ATOM 27663 C CG1 . ILE E 1 600 ? -1.751 19.174 5.423 1.00 33.92 ? 600 ILE E CG1 1 +ATOM 27664 C CG2 . ILE E 1 600 ? -3.634 19.925 3.965 1.00 31.85 ? 600 ILE E CG2 1 +ATOM 27665 C CD1 . ILE E 1 600 ? -0.854 20.396 5.358 1.00 34.15 ? 600 ILE E CD1 1 +ATOM 27666 N N . TYR E 1 601 ? -5.310 17.302 3.117 1.00 33.90 ? 601 TYR E N 1 +ATOM 27667 C CA . TYR E 1 601 ? -6.227 17.119 1.999 1.00 34.07 ? 601 TYR E CA 1 +ATOM 27668 C C . TYR E 1 601 ? -7.322 18.179 2.005 1.00 35.77 ? 601 TYR E C 1 +ATOM 27669 O O . TYR E 1 601 ? -7.889 18.491 3.058 1.00 35.80 ? 601 TYR E O 1 +ATOM 27670 C CB . TYR E 1 601 ? -6.880 15.732 2.064 1.00 33.99 ? 601 TYR E CB 1 +ATOM 27671 C CG . TYR E 1 601 ? -5.904 14.579 2.063 1.00 33.98 ? 601 TYR E CG 1 +ATOM 27672 C CD1 . TYR E 1 601 ? -5.222 14.219 3.224 1.00 34.10 ? 601 TYR E CD1 1 +ATOM 27673 C CD2 . TYR E 1 601 ? -5.619 13.886 0.886 1.00 32.60 ? 601 TYR E CD2 1 +ATOM 27674 C CE1 . TYR E 1 601 ? -4.275 13.203 3.211 1.00 35.37 ? 601 TYR E CE1 1 +ATOM 27675 C CE2 . TYR E 1 601 ? -4.677 12.869 0.858 1.00 33.28 ? 601 TYR E CE2 1 +ATOM 27676 C CZ . TYR E 1 601 ? -4.005 12.531 2.021 1.00 36.19 ? 601 TYR E CZ 1 +ATOM 27677 O OH . TYR E 1 601 ? -3.058 11.531 1.996 1.00 36.09 ? 601 TYR E OH 1 +ATOM 27678 N N . LEU E 1 602 ? -7.625 18.728 0.833 1.00 36.06 ? 602 LEU E N 1 +ATOM 27679 C CA . LEU E 1 602 ? -8.668 19.734 0.737 1.00 37.60 ? 602 LEU E CA 1 +ATOM 27680 C C . LEU E 1 602 ? -9.931 19.099 0.192 1.00 38.62 ? 602 LEU E C 1 +ATOM 27681 O O . LEU E 1 602 ? -9.903 18.334 -0.776 1.00 38.11 ? 602 LEU E O 1 +ATOM 27682 C CB . LEU E 1 602 ? -8.240 20.889 -0.168 1.00 40.18 ? 602 LEU E CB 1 +ATOM 27683 C CG . LEU E 1 602 ? -6.967 21.618 0.248 1.00 41.32 ? 602 LEU E CG 1 +ATOM 27684 C CD1 . LEU E 1 602 ? -6.786 22.852 -0.624 1.00 41.49 ? 602 LEU E CD1 1 +ATOM 27685 C CD2 . LEU E 1 602 ? -7.059 22.002 1.716 1.00 42.26 ? 602 LEU E CD2 1 +ATOM 27686 N N . ARG E 1 603 ? -11.040 19.438 0.826 1.00 38.76 ? 603 ARG E N 1 +ATOM 27687 C CA . ARG E 1 603 ? -12.348 18.923 0.472 1.00 39.39 ? 603 ARG E CA 1 +ATOM 27688 C C . ARG E 1 603 ? -12.898 19.622 -0.766 1.00 42.17 ? 603 ARG E C 1 +ATOM 27689 O O . ARG E 1 603 ? -12.659 20.817 -0.972 1.00 42.36 ? 603 ARG E O 1 +ATOM 27690 C CB . ARG E 1 603 ? -13.273 19.156 1.660 1.00 37.96 ? 603 ARG E CB 1 +ATOM 27691 C CG . ARG E 1 603 ? -14.636 18.568 1.562 1.00 36.01 ? 603 ARG E CG 1 +ATOM 27692 C CD . ARG E 1 603 ? -15.424 19.023 2.767 1.00 37.92 ? 603 ARG E CD 1 +ATOM 27693 N NE . ARG E 1 603 ? -16.737 18.402 2.878 1.00 35.49 ? 603 ARG E NE 1 +ATOM 27694 C CZ . ARG E 1 603 ? -17.528 18.553 3.932 1.00 37.75 ? 603 ARG E CZ 1 +ATOM 27695 N NH1 . ARG E 1 603 ? -17.135 19.302 4.954 1.00 39.61 ? 603 ARG E NH1 1 +ATOM 27696 N NH2 . ARG E 1 603 ? -18.704 17.945 3.980 1.00 39.11 ? 603 ARG E NH2 1 +ATOM 27697 N N . GLU E 1 604 ? -13.624 18.875 -1.599 1.00 43.97 ? 604 GLU E N 1 +ATOM 27698 C CA . GLU E 1 604 ? -14.216 19.475 -2.782 1.00 44.94 ? 604 GLU E CA 1 +ATOM 27699 C C . GLU E 1 604 ? -15.269 20.428 -2.240 1.00 44.45 ? 604 GLU E C 1 +ATOM 27700 O O . GLU E 1 604 ? -16.229 20.005 -1.604 1.00 44.43 ? 604 GLU E O 1 +ATOM 27701 C CB . GLU E 1 604 ? -14.857 18.422 -3.677 1.00 46.58 ? 604 GLU E CB 1 +ATOM 27702 C CG . GLU E 1 604 ? -15.430 19.002 -4.961 1.00 50.47 ? 604 GLU E CG 1 +ATOM 27703 C CD . GLU E 1 604 ? -15.925 17.927 -5.921 1.00 53.99 ? 604 GLU E CD 1 +ATOM 27704 O OE1 . GLU E 1 604 ? -16.798 17.115 -5.533 1.00 55.07 ? 604 GLU E OE1 1 +ATOM 27705 O OE2 . GLU E 1 604 ? -15.440 17.892 -7.072 1.00 56.79 ? 604 GLU E OE2 1 +ATOM 27706 N N . GLY E 1 605 ? -15.060 21.718 -2.483 1.00 44.54 ? 605 GLY E N 1 +ATOM 27707 C CA . GLY E 1 605 ? -15.957 22.746 -1.986 1.00 42.70 ? 605 GLY E CA 1 +ATOM 27708 C C . GLY E 1 605 ? -15.202 23.463 -0.879 1.00 43.43 ? 605 GLY E C 1 +ATOM 27709 O O . GLY E 1 605 ? -15.654 23.524 0.268 1.00 42.83 ? 605 GLY E O 1 +ATOM 27710 N N . SER E 1 606 ? -14.036 24.004 -1.232 1.00 43.06 ? 606 SER E N 1 +ATOM 27711 C CA . SER E 1 606 ? -13.177 24.691 -0.271 1.00 41.18 ? 606 SER E CA 1 +ATOM 27712 C C . SER E 1 606 ? -12.619 26.023 -0.738 1.00 39.18 ? 606 SER E C 1 +ATOM 27713 O O . SER E 1 606 ? -12.319 26.224 -1.911 1.00 39.60 ? 606 SER E O 1 +ATOM 27714 C CB . SER E 1 606 ? -11.982 23.805 0.095 1.00 40.90 ? 606 SER E CB 1 +ATOM 27715 O OG . SER E 1 606 ? -12.391 22.589 0.675 1.00 42.92 ? 606 SER E OG 1 +ATOM 27716 N N . ILE E 1 607 ? -12.474 26.934 0.206 1.00 36.80 ? 607 ILE E N 1 +ATOM 27717 C CA . ILE E 1 607 ? -11.883 28.218 -0.081 1.00 36.81 ? 607 ILE E CA 1 +ATOM 27718 C C . ILE E 1 607 ? -10.932 28.443 1.084 1.00 36.82 ? 607 ILE E C 1 +ATOM 27719 O O . ILE E 1 607 ? -11.347 28.505 2.235 1.00 37.30 ? 607 ILE E O 1 +ATOM 27720 C CB . ILE E 1 607 ? -12.928 29.339 -0.140 1.00 37.38 ? 607 ILE E CB 1 +ATOM 27721 C CG1 . ILE E 1 607 ? -13.832 29.137 -1.363 1.00 38.40 ? 607 ILE E CG1 1 +ATOM 27722 C CG2 . ILE E 1 607 ? -12.231 30.696 -0.224 1.00 35.72 ? 607 ILE E CG2 1 +ATOM 27723 C CD1 . ILE E 1 607 ? -14.989 30.120 -1.442 1.00 38.52 ? 607 ILE E CD1 1 +ATOM 27724 N N . ILE E 1 608 ? -9.648 28.544 0.792 1.00 35.92 ? 608 ILE E N 1 +ATOM 27725 C CA . ILE E 1 608 ? -8.692 28.738 1.860 1.00 37.25 ? 608 ILE E CA 1 +ATOM 27726 C C . ILE E 1 608 ? -7.794 29.945 1.679 1.00 36.65 ? 608 ILE E C 1 +ATOM 27727 O O . ILE E 1 608 ? -7.011 30.011 0.732 1.00 36.32 ? 608 ILE E O 1 +ATOM 27728 C CB . ILE E 1 608 ? -7.827 27.471 2.032 1.00 36.97 ? 608 ILE E CB 1 +ATOM 27729 C CG1 . ILE E 1 608 ? -8.730 26.312 2.462 1.00 37.93 ? 608 ILE E CG1 1 +ATOM 27730 C CG2 . ILE E 1 608 ? -6.743 27.702 3.074 1.00 34.31 ? 608 ILE E CG2 1 +ATOM 27731 C CD1 . ILE E 1 608 ? -8.044 24.989 2.466 1.00 38.51 ? 608 ILE E CD1 1 +ATOM 27732 N N . PRO E 1 609 ? -7.916 30.933 2.580 1.00 36.97 ? 609 PRO E N 1 +ATOM 27733 C CA . PRO E 1 609 ? -7.088 32.143 2.509 1.00 36.82 ? 609 PRO E CA 1 +ATOM 27734 C C . PRO E 1 609 ? -5.739 31.825 3.150 1.00 36.07 ? 609 PRO E C 1 +ATOM 27735 O O . PRO E 1 609 ? -5.686 31.256 4.232 1.00 35.38 ? 609 PRO E O 1 +ATOM 27736 C CB . PRO E 1 609 ? -7.894 33.160 3.314 1.00 34.82 ? 609 PRO E CB 1 +ATOM 27737 C CG . PRO E 1 609 ? -8.498 32.320 4.368 1.00 36.14 ? 609 PRO E CG 1 +ATOM 27738 C CD . PRO E 1 609 ? -8.949 31.069 3.621 1.00 36.22 ? 609 PRO E CD 1 +ATOM 27739 N N . LEU E 1 610 ? -4.659 32.167 2.466 1.00 37.73 ? 610 LEU E N 1 +ATOM 27740 C CA . LEU E 1 610 ? -3.322 31.914 2.974 1.00 38.96 ? 610 LEU E CA 1 +ATOM 27741 C C . LEU E 1 610 ? -2.562 33.210 3.194 1.00 40.76 ? 610 LEU E C 1 +ATOM 27742 O O . LEU E 1 610 ? -2.987 34.282 2.773 1.00 41.73 ? 610 LEU E O 1 +ATOM 27743 C CB . LEU E 1 610 ? -2.546 31.035 1.996 1.00 39.57 ? 610 LEU E CB 1 +ATOM 27744 C CG . LEU E 1 610 ? -3.158 29.667 1.669 1.00 40.87 ? 610 LEU E CG 1 +ATOM 27745 C CD1 . LEU E 1 610 ? -2.327 28.984 0.591 1.00 39.13 ? 610 LEU E CD1 1 +ATOM 27746 C CD2 . LEU E 1 610 ? -3.226 28.809 2.931 1.00 38.59 ? 610 LEU E CD2 1 +ATOM 27747 N N . GLU E 1 611 ? -1.426 33.098 3.863 1.00 42.73 ? 611 GLU E N 1 +ATOM 27748 C CA . GLU E 1 611 ? -0.580 34.243 4.159 1.00 43.78 ? 611 GLU E CA 1 +ATOM 27749 C C . GLU E 1 611 ? -0.205 35.009 2.892 1.00 43.49 ? 611 GLU E C 1 +ATOM 27750 O O . GLU E 1 611 ? 0.039 34.415 1.841 1.00 41.51 ? 611 GLU E O 1 +ATOM 27751 C CB . GLU E 1 611 ? 0.685 33.754 4.865 1.00 45.50 ? 611 GLU E CB 1 +ATOM 27752 C CG . GLU E 1 611 ? 1.716 34.818 5.186 1.00 49.93 ? 611 GLU E CG 1 +ATOM 27753 C CD . GLU E 1 611 ? 2.921 34.244 5.949 1.00 53.91 ? 611 GLU E CD 1 +ATOM 27754 O OE1 . GLU E 1 611 ? 3.491 33.223 5.487 1.00 53.06 ? 611 GLU E OE1 1 +ATOM 27755 O OE2 . GLU E 1 611 ? 3.297 34.813 7.004 1.00 53.37 ? 611 GLU E OE2 1 +ATOM 27756 N N . GLY E 1 612 ? -0.164 36.332 3.005 1.00 42.85 ? 612 GLY E N 1 +ATOM 27757 C CA . GLY E 1 612 ? 0.199 37.156 1.872 1.00 43.30 ? 612 GLY E CA 1 +ATOM 27758 C C . GLY E 1 612 ? -0.888 37.261 0.825 1.00 43.74 ? 612 GLY E C 1 +ATOM 27759 O O . GLY E 1 612 ? -0.602 37.313 -0.368 1.00 43.30 ? 612 GLY E O 1 +ATOM 27760 N N . ASP E 1 613 ? -2.137 37.272 1.273 1.00 43.89 ? 613 ASP E N 1 +ATOM 27761 C CA . ASP E 1 613 ? -3.277 37.387 0.384 1.00 46.00 ? 613 ASP E CA 1 +ATOM 27762 C C . ASP E 1 613 ? -3.405 36.293 -0.678 1.00 46.19 ? 613 ASP E C 1 +ATOM 27763 O O . ASP E 1 613 ? -4.068 36.486 -1.695 1.00 44.77 ? 613 ASP E O 1 +ATOM 27764 C CB . ASP E 1 613 ? -3.266 38.767 -0.278 1.00 49.14 ? 613 ASP E CB 1 +ATOM 27765 C CG . ASP E 1 613 ? -3.366 39.894 0.741 1.00 52.85 ? 613 ASP E CG 1 +ATOM 27766 O OD1 . ASP E 1 613 ? -4.452 40.071 1.345 1.00 52.25 ? 613 ASP E OD1 1 +ATOM 27767 O OD2 . ASP E 1 613 ? -2.351 40.595 0.951 1.00 54.97 ? 613 ASP E OD2 1 +ATOM 27768 N N . GLU E 1 614 ? -2.768 35.149 -0.447 1.00 47.02 ? 614 GLU E N 1 +ATOM 27769 C CA . GLU E 1 614 ? -2.878 34.032 -1.380 1.00 46.80 ? 614 GLU E CA 1 +ATOM 27770 C C . GLU E 1 614 ? -4.278 33.462 -1.184 1.00 44.24 ? 614 GLU E C 1 +ATOM 27771 O O . GLU E 1 614 ? -4.915 33.704 -0.162 1.00 42.10 ? 614 GLU E O 1 +ATOM 27772 C CB . GLU E 1 614 ? -1.841 32.945 -1.074 1.00 49.43 ? 614 GLU E CB 1 +ATOM 27773 C CG . GLU E 1 614 ? -0.586 33.007 -1.917 1.00 54.85 ? 614 GLU E CG 1 +ATOM 27774 C CD . GLU E 1 614 ? 0.282 31.748 -1.789 1.00 59.28 ? 614 GLU E CD 1 +ATOM 27775 O OE1 . GLU E 1 614 ? -0.245 30.617 -1.974 1.00 60.99 ? 614 GLU E OE1 1 +ATOM 27776 O OE2 . GLU E 1 614 ? 1.497 31.892 -1.517 1.00 59.78 ? 614 GLU E OE2 1 +ATOM 27777 N N . LEU E 1 615 ? -4.753 32.704 -2.159 1.00 42.96 ? 615 LEU E N 1 +ATOM 27778 C CA . LEU E 1 615 ? -6.077 32.119 -2.055 1.00 42.93 ? 615 LEU E CA 1 +ATOM 27779 C C . LEU E 1 615 ? -6.163 30.782 -2.793 1.00 42.90 ? 615 LEU E C 1 +ATOM 27780 O O . LEU E 1 615 ? -5.721 30.673 -3.939 1.00 43.38 ? 615 LEU E O 1 +ATOM 27781 C CB . LEU E 1 615 ? -7.090 33.097 -2.631 1.00 43.47 ? 615 LEU E CB 1 +ATOM 27782 C CG . LEU E 1 615 ? -8.561 32.916 -2.294 1.00 44.15 ? 615 LEU E CG 1 +ATOM 27783 C CD1 . LEU E 1 615 ? -8.768 33.118 -0.803 1.00 44.75 ? 615 LEU E CD1 1 +ATOM 27784 C CD2 . LEU E 1 615 ? -9.373 33.929 -3.074 1.00 44.16 ? 615 LEU E CD2 1 +ATOM 27785 N N . ILE E 1 616 ? -6.704 29.758 -2.133 1.00 42.20 ? 616 ILE E N 1 +ATOM 27786 C CA . ILE E 1 616 ? -6.870 28.445 -2.771 1.00 41.64 ? 616 ILE E CA 1 +ATOM 27787 C C . ILE E 1 616 ? -8.356 28.182 -2.892 1.00 39.40 ? 616 ILE E C 1 +ATOM 27788 O O . ILE E 1 616 ? -9.087 28.323 -1.915 1.00 38.73 ? 616 ILE E O 1 +ATOM 27789 C CB . ILE E 1 616 ? -6.294 27.281 -1.939 1.00 43.67 ? 616 ILE E CB 1 +ATOM 27790 C CG1 . ILE E 1 616 ? -4.813 27.500 -1.656 1.00 45.26 ? 616 ILE E CG1 1 +ATOM 27791 C CG2 . ILE E 1 616 ? -6.460 25.976 -2.701 1.00 44.44 ? 616 ILE E CG2 1 +ATOM 27792 C CD1 . ILE E 1 616 ? -4.238 26.464 -0.725 1.00 45.23 ? 616 ILE E CD1 1 +ATOM 27793 N N . VAL E 1 617 ? -8.802 27.806 -4.083 1.00 38.11 ? 617 VAL E N 1 +ATOM 27794 C CA . VAL E 1 617 ? -10.209 27.522 -4.288 1.00 37.84 ? 617 VAL E CA 1 +ATOM 27795 C C . VAL E 1 617 ? -10.377 26.168 -4.959 1.00 38.12 ? 617 VAL E C 1 +ATOM 27796 O O . VAL E 1 617 ? -9.697 25.862 -5.940 1.00 39.00 ? 617 VAL E O 1 +ATOM 27797 C CB . VAL E 1 617 ? -10.888 28.605 -5.161 1.00 38.12 ? 617 VAL E CB 1 +ATOM 27798 C CG1 . VAL E 1 617 ? -12.361 28.251 -5.379 1.00 37.31 ? 617 VAL E CG1 1 +ATOM 27799 C CG2 . VAL E 1 617 ? -10.773 29.958 -4.493 1.00 35.92 ? 617 VAL E CG2 1 +ATOM 27800 N N . TYR E 1 618 ? -11.282 25.359 -4.418 1.00 37.89 ? 618 TYR E N 1 +ATOM 27801 C CA . TYR E 1 618 ? -11.570 24.040 -4.968 1.00 38.17 ? 618 TYR E CA 1 +ATOM 27802 C C . TYR E 1 618 ? -13.057 23.773 -4.848 1.00 39.49 ? 618 TYR E C 1 +ATOM 27803 O O . TYR E 1 618 ? -13.567 23.497 -3.756 1.00 38.01 ? 618 TYR E O 1 +ATOM 27804 C CB . TYR E 1 618 ? -10.788 22.957 -4.220 1.00 37.09 ? 618 TYR E CB 1 +ATOM 27805 C CG . TYR E 1 618 ? -11.140 21.530 -4.594 1.00 37.72 ? 618 TYR E CG 1 +ATOM 27806 C CD1 . TYR E 1 618 ? -11.638 21.212 -5.864 1.00 39.42 ? 618 TYR E CD1 1 +ATOM 27807 C CD2 . TYR E 1 618 ? -10.898 20.482 -3.705 1.00 39.42 ? 618 TYR E CD2 1 +ATOM 27808 C CE1 . TYR E 1 618 ? -11.880 19.886 -6.242 1.00 40.01 ? 618 TYR E CE1 1 +ATOM 27809 C CE2 . TYR E 1 618 ? -11.132 19.149 -4.068 1.00 41.12 ? 618 TYR E CE2 1 +ATOM 27810 C CZ . TYR E 1 618 ? -11.622 18.858 -5.336 1.00 42.19 ? 618 TYR E CZ 1 +ATOM 27811 O OH . TYR E 1 618 ? -11.848 17.548 -5.690 1.00 40.70 ? 618 TYR E OH 1 +ATOM 27812 N N . GLY E 1 619 ? -13.753 23.866 -5.974 1.00 39.76 ? 619 GLY E N 1 +ATOM 27813 C CA . GLY E 1 619 ? -15.174 23.608 -5.958 1.00 41.23 ? 619 GLY E CA 1 +ATOM 27814 C C . GLY E 1 619 ? -16.010 24.802 -5.574 1.00 42.61 ? 619 GLY E C 1 +ATOM 27815 O O . GLY E 1 619 ? -15.544 25.931 -5.601 1.00 43.55 ? 619 GLY E O 1 +ATOM 27816 N N . GLU E 1 620 ? -17.256 24.544 -5.199 1.00 45.32 ? 620 GLU E N 1 +ATOM 27817 C CA . GLU E 1 620 ? -18.186 25.599 -4.839 1.00 46.94 ? 620 GLU E CA 1 +ATOM 27818 C C . GLU E 1 620 ? -18.498 25.638 -3.356 1.00 46.91 ? 620 GLU E C 1 +ATOM 27819 O O . GLU E 1 620 ? -18.808 24.621 -2.743 1.00 47.56 ? 620 GLU E O 1 +ATOM 27820 C CB . GLU E 1 620 ? -19.482 25.427 -5.630 1.00 50.07 ? 620 GLU E CB 1 +ATOM 27821 C CG . GLU E 1 620 ? -19.273 25.314 -7.135 1.00 55.78 ? 620 GLU E CG 1 +ATOM 27822 C CD . GLU E 1 620 ? -20.545 24.928 -7.880 1.00 60.12 ? 620 GLU E CD 1 +ATOM 27823 O OE1 . GLU E 1 620 ? -21.123 23.864 -7.562 1.00 62.56 ? 620 GLU E OE1 1 +ATOM 27824 O OE2 . GLU E 1 620 ? -20.966 25.680 -8.785 1.00 62.14 ? 620 GLU E OE2 1 +ATOM 27825 N N . THR E 1 621 ? -18.412 26.829 -2.781 1.00 46.22 ? 621 THR E N 1 +ATOM 27826 C CA . THR E 1 621 ? -18.706 27.023 -1.369 1.00 45.31 ? 621 THR E CA 1 +ATOM 27827 C C . THR E 1 621 ? -18.690 28.517 -1.092 1.00 45.14 ? 621 THR E C 1 +ATOM 27828 O O . THR E 1 621 ? -18.437 29.321 -1.987 1.00 44.07 ? 621 THR E O 1 +ATOM 27829 C CB . THR E 1 621 ? -17.656 26.309 -0.452 1.00 45.57 ? 621 THR E CB 1 +ATOM 27830 O OG1 . THR E 1 621 ? -18.042 26.441 0.926 1.00 43.41 ? 621 THR E OG1 1 +ATOM 27831 C CG2 . THR E 1 621 ? -16.265 26.909 -0.644 1.00 43.18 ? 621 THR E CG2 1 +ATOM 27832 N N . SER E 1 622 ? -18.975 28.883 0.147 1.00 45.40 ? 622 SER E N 1 +ATOM 27833 C CA . SER E 1 622 ? -18.971 30.276 0.552 1.00 45.91 ? 622 SER E CA 1 +ATOM 27834 C C . SER E 1 622 ? -18.149 30.347 1.837 1.00 45.10 ? 622 SER E C 1 +ATOM 27835 O O . SER E 1 622 ? -18.285 29.497 2.713 1.00 44.77 ? 622 SER E O 1 +ATOM 27836 C CB . SER E 1 622 ? -20.396 30.762 0.794 1.00 47.16 ? 622 SER E CB 1 +ATOM 27837 O OG . SER E 1 622 ? -20.413 32.166 0.965 1.00 50.99 ? 622 SER E OG 1 +ATOM 27838 N N . PHE E 1 623 ? -17.300 31.362 1.947 1.00 45.20 ? 623 PHE E N 1 +ATOM 27839 C CA . PHE E 1 623 ? -16.425 31.504 3.102 1.00 44.94 ? 623 PHE E CA 1 +ATOM 27840 C C . PHE E 1 623 ? -16.233 32.951 3.531 1.00 45.26 ? 623 PHE E C 1 +ATOM 27841 O O . PHE E 1 623 ? -16.075 33.844 2.702 1.00 44.54 ? 623 PHE E O 1 +ATOM 27842 C CB . PHE E 1 623 ? -15.059 30.892 2.769 1.00 45.83 ? 623 PHE E CB 1 +ATOM 27843 C CG . PHE E 1 623 ? -14.070 30.953 3.891 1.00 45.56 ? 623 PHE E CG 1 +ATOM 27844 C CD1 . PHE E 1 623 ? -14.239 30.174 5.029 1.00 45.98 ? 623 PHE E CD1 1 +ATOM 27845 C CD2 . PHE E 1 623 ? -12.957 31.784 3.802 1.00 46.67 ? 623 PHE E CD2 1 +ATOM 27846 C CE1 . PHE E 1 623 ? -13.311 30.218 6.066 1.00 47.92 ? 623 PHE E CE1 1 +ATOM 27847 C CE2 . PHE E 1 623 ? -12.023 31.841 4.825 1.00 47.46 ? 623 PHE E CE2 1 +ATOM 27848 C CZ . PHE E 1 623 ? -12.197 31.056 5.964 1.00 48.63 ? 623 PHE E CZ 1 +ATOM 27849 N N . LYS E 1 624 ? -16.231 33.172 4.839 1.00 45.58 ? 624 LYS E N 1 +ATOM 27850 C CA . LYS E 1 624 ? -16.044 34.505 5.387 1.00 45.41 ? 624 LYS E CA 1 +ATOM 27851 C C . LYS E 1 624 ? -14.642 34.625 5.988 1.00 45.18 ? 624 LYS E C 1 +ATOM 27852 O O . LYS E 1 624 ? -14.298 33.937 6.943 1.00 43.89 ? 624 LYS E O 1 +ATOM 27853 C CB . LYS E 1 624 ? -17.106 34.778 6.455 1.00 46.03 ? 624 LYS E CB 1 +ATOM 27854 C CG . LYS E 1 624 ? -17.051 36.154 7.075 1.00 47.52 ? 624 LYS E CG 1 +ATOM 27855 C CD . LYS E 1 624 ? -18.191 36.336 8.070 1.00 48.99 ? 624 LYS E CD 1 +ATOM 27856 C CE . LYS E 1 624 ? -18.188 37.730 8.661 1.00 50.22 ? 624 LYS E CE 1 +ATOM 27857 N NZ . LYS E 1 624 ? -19.330 37.917 9.586 1.00 53.49 ? 624 LYS E NZ 1 +ATOM 27858 N N . ARG E 1 625 ? -13.826 35.495 5.407 1.00 45.66 ? 625 ARG E N 1 +ATOM 27859 C CA . ARG E 1 625 ? -12.478 35.705 5.902 1.00 45.01 ? 625 ARG E CA 1 +ATOM 27860 C C . ARG E 1 625 ? -12.557 36.522 7.184 1.00 44.83 ? 625 ARG E C 1 +ATOM 27861 O O . ARG E 1 625 ? -13.546 37.210 7.424 1.00 44.59 ? 625 ARG E O 1 +ATOM 27862 C CB . ARG E 1 625 ? -11.633 36.419 4.855 1.00 45.27 ? 625 ARG E CB 1 +ATOM 27863 C CG . ARG E 1 625 ? -10.154 36.197 5.058 1.00 47.91 ? 625 ARG E CG 1 +ATOM 27864 C CD . ARG E 1 625 ? -9.350 36.619 3.853 1.00 49.26 ? 625 ARG E CD 1 +ATOM 27865 N NE . ARG E 1 625 ? -9.489 38.043 3.581 1.00 51.74 ? 625 ARG E NE 1 +ATOM 27866 C CZ . ARG E 1 625 ? -8.866 38.675 2.596 1.00 51.37 ? 625 ARG E CZ 1 +ATOM 27867 N NH1 . ARG E 1 625 ? -8.058 38.004 1.791 1.00 51.13 ? 625 ARG E NH1 1 +ATOM 27868 N NH2 . ARG E 1 625 ? -9.059 39.975 2.414 1.00 52.81 ? 625 ARG E NH2 1 +ATOM 27869 N N . TYR E 1 626 ? -11.513 36.446 8.004 1.00 45.69 ? 626 TYR E N 1 +ATOM 27870 C CA . TYR E 1 626 ? -11.492 37.134 9.293 1.00 47.29 ? 626 TYR E CA 1 +ATOM 27871 C C . TYR E 1 626 ? -11.678 38.637 9.220 1.00 49.06 ? 626 TYR E C 1 +ATOM 27872 O O . TYR E 1 626 ? -12.157 39.253 10.171 1.00 48.26 ? 626 TYR E O 1 +ATOM 27873 C CB . TYR E 1 626 ? -10.200 36.819 10.037 1.00 45.81 ? 626 TYR E CB 1 +ATOM 27874 C CG . TYR E 1 626 ? -8.969 37.461 9.449 1.00 44.90 ? 626 TYR E CG 1 +ATOM 27875 C CD1 . TYR E 1 626 ? -8.639 38.783 9.748 1.00 43.76 ? 626 TYR E CD1 1 +ATOM 27876 C CD2 . TYR E 1 626 ? -8.122 36.742 8.610 1.00 44.73 ? 626 TYR E CD2 1 +ATOM 27877 C CE1 . TYR E 1 626 ? -7.492 39.371 9.228 1.00 44.63 ? 626 TYR E CE1 1 +ATOM 27878 C CE2 . TYR E 1 626 ? -6.975 37.317 8.083 1.00 46.06 ? 626 TYR E CE2 1 +ATOM 27879 C CZ . TYR E 1 626 ? -6.663 38.633 8.398 1.00 46.86 ? 626 TYR E CZ 1 +ATOM 27880 O OH . TYR E 1 626 ? -5.514 39.200 7.895 1.00 48.50 ? 626 TYR E OH 1 +ATOM 27881 N N . ASP E 1 627 ? -11.296 39.227 8.095 1.00 50.91 ? 627 ASP E N 1 +ATOM 27882 C CA . ASP E 1 627 ? -11.436 40.665 7.921 1.00 52.97 ? 627 ASP E CA 1 +ATOM 27883 C C . ASP E 1 627 ? -12.821 41.017 7.374 1.00 52.82 ? 627 ASP E C 1 +ATOM 27884 O O . ASP E 1 627 ? -13.031 42.094 6.832 1.00 51.70 ? 627 ASP E O 1 +ATOM 27885 C CB . ASP E 1 627 ? -10.329 41.193 6.996 1.00 52.97 ? 627 ASP E CB 1 +ATOM 27886 C CG . ASP E 1 627 ? -10.440 40.664 5.587 1.00 54.03 ? 627 ASP E CG 1 +ATOM 27887 O OD1 . ASP E 1 627 ? -11.052 39.596 5.389 1.00 53.86 ? 627 ASP E OD1 1 +ATOM 27888 O OD2 . ASP E 1 627 ? -9.902 41.315 4.669 1.00 56.12 ? 627 ASP E OD2 1 +ATOM 27889 N N . ASN E 1 628 ? -13.757 40.085 7.523 1.00 54.91 ? 628 ASN E N 1 +ATOM 27890 C CA . ASN E 1 628 ? -15.136 40.274 7.090 1.00 56.46 ? 628 ASN E CA 1 +ATOM 27891 C C . ASN E 1 628 ? -15.418 40.104 5.595 1.00 55.23 ? 628 ASN E C 1 +ATOM 27892 O O . ASN E 1 628 ? -16.576 40.065 5.185 1.00 55.41 ? 628 ASN E O 1 +ATOM 27893 C CB . ASN E 1 628 ? -15.633 41.637 7.569 1.00 60.09 ? 628 ASN E CB 1 +ATOM 27894 C CG . ASN E 1 628 ? -16.666 42.232 6.650 1.00 65.14 ? 628 ASN E CG 1 +ATOM 27895 O OD1 . ASN E 1 628 ? -16.346 42.656 5.529 1.00 67.82 ? 628 ASN E OD1 1 +ATOM 27896 N ND2 . ASN E 1 628 ? -17.919 42.263 7.104 1.00 66.46 ? 628 ASN E ND2 1 +ATOM 27897 N N . ALA E 1 629 ? -14.374 39.988 4.784 1.00 54.10 ? 629 ALA E N 1 +ATOM 27898 C CA . ALA E 1 629 ? -14.552 39.810 3.345 1.00 52.40 ? 629 ALA E CA 1 +ATOM 27899 C C . ALA E 1 629 ? -15.100 38.413 3.035 1.00 51.52 ? 629 ALA E C 1 +ATOM 27900 O O . ALA E 1 629 ? -14.483 37.408 3.375 1.00 50.29 ? 629 ALA E O 1 +ATOM 27901 C CB . ALA E 1 629 ? -13.223 40.023 2.625 1.00 50.77 ? 629 ALA E CB 1 +ATOM 27902 N N . GLU E 1 630 ? -16.260 38.351 2.389 1.00 51.67 ? 630 GLU E N 1 +ATOM 27903 C CA . GLU E 1 630 ? -16.871 37.070 2.047 1.00 52.06 ? 630 GLU E CA 1 +ATOM 27904 C C . GLU E 1 630 ? -16.526 36.661 0.628 1.00 50.18 ? 630 GLU E C 1 +ATOM 27905 O O . GLU E 1 630 ? -16.606 37.460 -0.292 1.00 49.95 ? 630 GLU E O 1 +ATOM 27906 C CB . GLU E 1 630 ? -18.383 37.147 2.218 1.00 54.83 ? 630 GLU E CB 1 +ATOM 27907 C CG . GLU E 1 630 ? -18.802 37.433 3.652 1.00 62.57 ? 630 GLU E CG 1 +ATOM 27908 C CD . GLU E 1 630 ? -20.242 37.898 3.771 1.00 66.57 ? 630 GLU E CD 1 +ATOM 27909 O OE1 . GLU E 1 630 ? -21.152 37.124 3.388 1.00 68.27 ? 630 GLU E OE1 1 +ATOM 27910 O OE2 . GLU E 1 630 ? -20.458 39.040 4.248 1.00 68.24 ? 630 GLU E OE2 1 +ATOM 27911 N N . ILE E 1 631 ? -16.133 35.406 0.461 1.00 48.41 ? 631 ILE E N 1 +ATOM 27912 C CA . ILE E 1 631 ? -15.760 34.890 -0.844 1.00 47.41 ? 631 ILE E CA 1 +ATOM 27913 C C . ILE E 1 631 ? -16.694 33.747 -1.220 1.00 46.93 ? 631 ILE E C 1 +ATOM 27914 O O . ILE E 1 631 ? -16.989 32.894 -0.398 1.00 47.30 ? 631 ILE E O 1 +ATOM 27915 C CB . ILE E 1 631 ? -14.316 34.384 -0.820 1.00 46.83 ? 631 ILE E CB 1 +ATOM 27916 C CG1 . ILE E 1 631 ? -13.403 35.477 -0.268 1.00 47.11 ? 631 ILE E CG1 1 +ATOM 27917 C CG2 . ILE E 1 631 ? -13.884 33.989 -2.203 1.00 45.55 ? 631 ILE E CG2 1 +ATOM 27918 C CD1 . ILE E 1 631 ? -11.969 35.047 -0.102 1.00 48.36 ? 631 ILE E CD1 1 +ATOM 27919 N N . THR E 1 632 ? -17.170 33.737 -2.458 1.00 46.38 ? 632 THR E N 1 +ATOM 27920 C CA . THR E 1 632 ? -18.073 32.686 -2.899 1.00 47.59 ? 632 THR E CA 1 +ATOM 27921 C C . THR E 1 632 ? -17.669 32.118 -4.243 1.00 48.44 ? 632 THR E C 1 +ATOM 27922 O O . THR E 1 632 ? -17.342 32.853 -5.163 1.00 48.88 ? 632 THR E O 1 +ATOM 27923 C CB . THR E 1 632 ? -19.525 33.191 -3.007 1.00 47.82 ? 632 THR E CB 1 +ATOM 27924 O OG1 . THR E 1 632 ? -19.913 33.796 -1.770 1.00 47.08 ? 632 THR E OG1 1 +ATOM 27925 C CG2 . THR E 1 632 ? -20.468 32.038 -3.295 1.00 45.62 ? 632 THR E CG2 1 +ATOM 27926 N N . SER E 1 633 ? -17.681 30.797 -4.350 1.00 50.08 ? 633 SER E N 1 +ATOM 27927 C CA . SER E 1 633 ? -17.327 30.152 -5.602 1.00 52.18 ? 633 SER E CA 1 +ATOM 27928 C C . SER E 1 633 ? -18.508 29.320 -6.089 1.00 52.92 ? 633 SER E C 1 +ATOM 27929 O O . SER E 1 633 ? -19.216 28.701 -5.300 1.00 53.01 ? 633 SER E O 1 +ATOM 27930 C CB . SER E 1 633 ? -16.082 29.270 -5.424 1.00 52.02 ? 633 SER E CB 1 +ATOM 27931 O OG . SER E 1 633 ? -16.337 28.152 -4.592 1.00 52.39 ? 633 SER E OG 1 +ATOM 27932 N N . SER E 1 634 ? -18.720 29.326 -7.396 1.00 54.33 ? 634 SER E N 1 +ATOM 27933 C CA . SER E 1 634 ? -19.805 28.581 -8.020 1.00 57.10 ? 634 SER E CA 1 +ATOM 27934 C C . SER E 1 634 ? -19.441 28.453 -9.486 1.00 57.95 ? 634 SER E C 1 +ATOM 27935 O O . SER E 1 634 ? -18.472 29.058 -9.918 1.00 58.75 ? 634 SER E O 1 +ATOM 27936 C CB . SER E 1 634 ? -21.130 29.331 -7.863 1.00 56.27 ? 634 SER E CB 1 +ATOM 27937 O OG . SER E 1 634 ? -21.003 30.673 -8.290 1.00 59.65 ? 634 SER E OG 1 +ATOM 27938 N N . SER E 1 635 ? -20.203 27.665 -10.241 1.00 59.89 ? 635 SER E N 1 +ATOM 27939 C CA . SER E 1 635 ? -19.945 27.465 -11.669 1.00 60.99 ? 635 SER E CA 1 +ATOM 27940 C C . SER E 1 635 ? -18.470 27.722 -11.980 1.00 61.79 ? 635 SER E C 1 +ATOM 27941 O O . SER E 1 635 ? -17.600 26.927 -11.624 1.00 62.70 ? 635 SER E O 1 +ATOM 27942 C CB . SER E 1 635 ? -20.819 28.414 -12.499 1.00 61.61 ? 635 SER E CB 1 +ATOM 27943 O OG . SER E 1 635 ? -20.412 29.769 -12.345 1.00 60.62 ? 635 SER E OG 1 +ATOM 27944 N N . ASN E 1 636 ? -18.207 28.846 -12.638 1.00 61.66 ? 636 ASN E N 1 +ATOM 27945 C CA . ASN E 1 636 ? -16.857 29.261 -12.993 1.00 62.28 ? 636 ASN E CA 1 +ATOM 27946 C C . ASN E 1 636 ? -16.681 30.704 -12.539 1.00 61.76 ? 636 ASN E C 1 +ATOM 27947 O O . ASN E 1 636 ? -16.078 31.512 -13.236 1.00 60.47 ? 636 ASN E O 1 +ATOM 27948 C CB . ASN E 1 636 ? -16.660 29.185 -14.504 1.00 63.99 ? 636 ASN E CB 1 +ATOM 27949 C CG . ASN E 1 636 ? -16.535 27.768 -15.003 1.00 66.23 ? 636 ASN E CG 1 +ATOM 27950 O OD1 . ASN E 1 636 ? -16.412 27.533 -16.206 1.00 68.58 ? 636 ASN E OD1 1 +ATOM 27951 N ND2 . ASN E 1 636 ? -16.558 26.812 -14.084 1.00 66.62 ? 636 ASN E ND2 1 +ATOM 27952 N N . GLU E 1 637 ? -17.205 31.018 -11.362 1.00 63.26 ? 637 GLU E N 1 +ATOM 27953 C CA . GLU E 1 637 ? -17.130 32.371 -10.848 1.00 64.84 ? 637 GLU E CA 1 +ATOM 27954 C C . GLU E 1 637 ? -16.815 32.451 -9.353 1.00 63.61 ? 637 GLU E C 1 +ATOM 27955 O O . GLU E 1 637 ? -17.347 31.686 -8.548 1.00 63.60 ? 637 GLU E O 1 +ATOM 27956 C CB . GLU E 1 637 ? -18.456 33.074 -11.144 1.00 67.98 ? 637 GLU E CB 1 +ATOM 27957 C CG . GLU E 1 637 ? -18.523 34.535 -10.758 1.00 73.89 ? 637 GLU E CG 1 +ATOM 27958 C CD . GLU E 1 637 ? -19.844 35.168 -11.166 1.00 78.02 ? 637 GLU E CD 1 +ATOM 27959 O OE1 . GLU E 1 637 ? -20.905 34.649 -10.745 1.00 79.52 ? 637 GLU E OE1 1 +ATOM 27960 O OE2 . GLU E 1 637 ? -19.821 36.179 -11.908 1.00 79.81 ? 637 GLU E OE2 1 +ATOM 27961 N N . ILE E 1 638 ? -15.937 33.381 -8.995 1.00 61.48 ? 638 ILE E N 1 +ATOM 27962 C CA . ILE E 1 638 ? -15.568 33.600 -7.605 1.00 59.00 ? 638 ILE E CA 1 +ATOM 27963 C C . ILE E 1 638 ? -15.972 35.031 -7.293 1.00 58.25 ? 638 ILE E C 1 +ATOM 27964 O O . ILE E 1 638 ? -15.379 35.961 -7.812 1.00 58.98 ? 638 ILE E O 1 +ATOM 27965 C CB . ILE E 1 638 ? -14.049 33.453 -7.387 1.00 57.33 ? 638 ILE E CB 1 +ATOM 27966 C CG1 . ILE E 1 638 ? -13.586 32.074 -7.847 1.00 54.76 ? 638 ILE E CG1 1 +ATOM 27967 C CG2 . ILE E 1 638 ? -13.716 33.656 -5.916 1.00 56.13 ? 638 ILE E CG2 1 +ATOM 27968 C CD1 . ILE E 1 638 ? -12.097 31.894 -7.818 1.00 52.99 ? 638 ILE E CD1 1 +ATOM 27969 N N . LYS E 1 639 ? -16.990 35.203 -6.461 1.00 58.25 ? 639 LYS E N 1 +ATOM 27970 C CA . LYS E 1 639 ? -17.469 36.530 -6.093 1.00 58.20 ? 639 LYS E CA 1 +ATOM 27971 C C . LYS E 1 639 ? -16.855 37.007 -4.778 1.00 56.96 ? 639 LYS E C 1 +ATOM 27972 O O . LYS E 1 639 ? -16.521 36.204 -3.910 1.00 55.57 ? 639 LYS E O 1 +ATOM 27973 C CB . LYS E 1 639 ? -18.995 36.517 -5.957 1.00 60.54 ? 639 LYS E CB 1 +ATOM 27974 C CG . LYS E 1 639 ? -19.747 36.164 -7.227 1.00 64.35 ? 639 LYS E CG 1 +ATOM 27975 C CD . LYS E 1 639 ? -21.243 36.033 -6.945 1.00 68.32 ? 639 LYS E CD 1 +ATOM 27976 C CE . LYS E 1 639 ? -22.040 35.677 -8.203 1.00 70.20 ? 639 LYS E CE 1 +ATOM 27977 N NZ . LYS E 1 639 ? -22.009 36.767 -9.227 1.00 71.01 ? 639 LYS E NZ 1 +ATOM 27978 N N . PHE E 1 640 ? -16.715 38.323 -4.641 1.00 55.87 ? 640 PHE E N 1 +ATOM 27979 C CA . PHE E 1 640 ? -16.163 38.929 -3.436 1.00 54.78 ? 640 PHE E CA 1 +ATOM 27980 C C . PHE E 1 640 ? -17.139 39.972 -2.894 1.00 54.04 ? 640 PHE E C 1 +ATOM 27981 O O . PHE E 1 640 ? -17.603 40.830 -3.633 1.00 55.38 ? 640 PHE E O 1 +ATOM 27982 C CB . PHE E 1 640 ? -14.810 39.579 -3.744 1.00 54.86 ? 640 PHE E CB 1 +ATOM 27983 C CG . PHE E 1 640 ? -13.749 38.603 -4.186 1.00 55.93 ? 640 PHE E CG 1 +ATOM 27984 C CD1 . PHE E 1 640 ? -13.790 38.029 -5.448 1.00 56.53 ? 640 PHE E CD1 1 +ATOM 27985 C CD2 . PHE E 1 640 ? -12.716 38.244 -3.329 1.00 56.50 ? 640 PHE E CD2 1 +ATOM 27986 C CE1 . PHE E 1 640 ? -12.816 37.113 -5.848 1.00 57.41 ? 640 PHE E CE1 1 +ATOM 27987 C CE2 . PHE E 1 640 ? -11.740 37.330 -3.721 1.00 56.15 ? 640 PHE E CE2 1 +ATOM 27988 C CZ . PHE E 1 640 ? -11.789 36.765 -4.979 1.00 56.23 ? 640 PHE E CZ 1 +ATOM 27989 N N . SER E 1 641 ? -17.449 39.899 -1.603 1.00 53.58 ? 641 SER E N 1 +ATOM 27990 C CA . SER E 1 641 ? -18.380 40.837 -0.981 1.00 52.60 ? 641 SER E CA 1 +ATOM 27991 C C . SER E 1 641 ? -17.852 42.270 -0.991 1.00 52.75 ? 641 SER E C 1 +ATOM 27992 O O . SER E 1 641 ? -18.599 43.215 -0.761 1.00 52.30 ? 641 SER E O 1 +ATOM 27993 C CB . SER E 1 641 ? -18.688 40.413 0.456 1.00 51.57 ? 641 SER E CB 1 +ATOM 27994 O OG . SER E 1 641 ? -17.555 40.574 1.287 1.00 52.85 ? 641 SER E OG 1 +ATOM 27995 N N . ARG E 1 642 ? -16.562 42.434 -1.237 1.00 52.51 ? 642 ARG E N 1 +ATOM 27996 C CA . ARG E 1 642 ? -15.981 43.762 -1.302 1.00 54.00 ? 642 ARG E CA 1 +ATOM 27997 C C . ARG E 1 642 ? -14.605 43.689 -1.928 1.00 54.40 ? 642 ARG E C 1 +ATOM 27998 O O . ARG E 1 642 ? -14.016 42.618 -2.019 1.00 55.09 ? 642 ARG E O 1 +ATOM 27999 C CB . ARG E 1 642 ? -15.906 44.400 0.088 1.00 56.20 ? 642 ARG E CB 1 +ATOM 28000 C CG . ARG E 1 642 ? -14.951 43.746 1.066 1.00 58.75 ? 642 ARG E CG 1 +ATOM 28001 C CD . ARG E 1 642 ? -15.075 44.408 2.425 1.00 61.31 ? 642 ARG E CD 1 +ATOM 28002 N NE . ARG E 1 642 ? -14.160 43.839 3.407 1.00 63.72 ? 642 ARG E NE 1 +ATOM 28003 C CZ . ARG E 1 642 ? -12.837 43.944 3.344 1.00 64.93 ? 642 ARG E CZ 1 +ATOM 28004 N NH1 . ARG E 1 642 ? -12.266 44.598 2.345 1.00 66.58 ? 642 ARG E NH1 1 +ATOM 28005 N NH2 . ARG E 1 642 ? -12.082 43.390 4.278 1.00 65.47 ? 642 ARG E NH2 1 +ATOM 28006 N N . GLU E 1 643 ? -14.100 44.833 -2.368 1.00 54.76 ? 643 GLU E N 1 +ATOM 28007 C CA . GLU E 1 643 ? -12.796 44.898 -3.012 1.00 55.59 ? 643 GLU E CA 1 +ATOM 28008 C C . GLU E 1 643 ? -11.666 44.435 -2.094 1.00 53.79 ? 643 GLU E C 1 +ATOM 28009 O O . GLU E 1 643 ? -11.523 44.929 -0.982 1.00 52.68 ? 643 GLU E O 1 +ATOM 28010 C CB . GLU E 1 643 ? -12.533 46.332 -3.485 1.00 57.77 ? 643 GLU E CB 1 +ATOM 28011 C CG . GLU E 1 643 ? -11.191 46.543 -4.169 1.00 63.51 ? 643 GLU E CG 1 +ATOM 28012 C CD . GLU E 1 643 ? -10.945 48.003 -4.523 1.00 67.03 ? 643 GLU E CD 1 +ATOM 28013 O OE1 . GLU E 1 643 ? -11.721 48.552 -5.335 1.00 68.55 ? 643 GLU E OE1 1 +ATOM 28014 O OE2 . GLU E 1 643 ? -9.983 48.602 -3.986 1.00 68.58 ? 643 GLU E OE2 1 +ATOM 28015 N N . ILE E 1 644 ? -10.875 43.472 -2.560 1.00 52.32 ? 644 ILE E N 1 +ATOM 28016 C CA . ILE E 1 644 ? -9.742 42.976 -1.777 1.00 51.23 ? 644 ILE E CA 1 +ATOM 28017 C C . ILE E 1 644 ? -8.551 42.659 -2.671 1.00 48.84 ? 644 ILE E C 1 +ATOM 28018 O O . ILE E 1 644 ? -8.703 42.367 -3.857 1.00 49.11 ? 644 ILE E O 1 +ATOM 28019 C CB . ILE E 1 644 ? -10.078 41.686 -0.973 1.00 52.20 ? 644 ILE E CB 1 +ATOM 28020 C CG1 . ILE E 1 644 ? -10.314 40.516 -1.928 1.00 52.00 ? 644 ILE E CG1 1 +ATOM 28021 C CG2 . ILE E 1 644 ? -11.290 41.923 -0.077 1.00 52.87 ? 644 ILE E CG2 1 +ATOM 28022 C CD1 . ILE E 1 644 ? -10.273 39.173 -1.244 1.00 52.51 ? 644 ILE E CD1 1 +ATOM 28023 N N . TYR E 1 645 ? -7.362 42.721 -2.096 1.00 46.38 ? 645 TYR E N 1 +ATOM 28024 C CA . TYR E 1 645 ? -6.159 42.422 -2.843 1.00 45.17 ? 645 TYR E CA 1 +ATOM 28025 C C . TYR E 1 645 ? -5.977 40.909 -2.883 1.00 44.08 ? 645 TYR E C 1 +ATOM 28026 O O . TYR E 1 645 ? -6.273 40.212 -1.914 1.00 42.84 ? 645 TYR E O 1 +ATOM 28027 C CB . TYR E 1 645 ? -4.944 43.063 -2.174 1.00 44.00 ? 645 TYR E CB 1 +ATOM 28028 C CG . TYR E 1 645 ? -3.662 42.905 -2.953 1.00 43.63 ? 645 TYR E CG 1 +ATOM 28029 C CD1 . TYR E 1 645 ? -3.334 43.790 -3.982 1.00 43.60 ? 645 TYR E CD1 1 +ATOM 28030 C CD2 . TYR E 1 645 ? -2.778 41.867 -2.671 1.00 43.39 ? 645 TYR E CD2 1 +ATOM 28031 C CE1 . TYR E 1 645 ? -2.153 43.647 -4.712 1.00 42.59 ? 645 TYR E CE1 1 +ATOM 28032 C CE2 . TYR E 1 645 ? -1.598 41.709 -3.396 1.00 44.65 ? 645 TYR E CE2 1 +ATOM 28033 C CZ . TYR E 1 645 ? -1.293 42.606 -4.414 1.00 45.23 ? 645 TYR E CZ 1 +ATOM 28034 O OH . TYR E 1 645 ? -0.132 42.460 -5.131 1.00 45.89 ? 645 TYR E OH 1 +ATOM 28035 N N . VAL E 1 646 ? -5.491 40.411 -4.012 1.00 43.52 ? 646 VAL E N 1 +ATOM 28036 C CA . VAL E 1 646 ? -5.240 38.992 -4.190 1.00 42.91 ? 646 VAL E CA 1 +ATOM 28037 C C . VAL E 1 646 ? -3.903 38.827 -4.883 1.00 43.94 ? 646 VAL E C 1 +ATOM 28038 O O . VAL E 1 646 ? -3.696 39.336 -5.988 1.00 45.07 ? 646 VAL E O 1 +ATOM 28039 C CB . VAL E 1 646 ? -6.325 38.322 -5.056 1.00 42.91 ? 646 VAL E CB 1 +ATOM 28040 C CG1 . VAL E 1 646 ? -5.959 36.875 -5.299 1.00 41.23 ? 646 VAL E CG1 1 +ATOM 28041 C CG2 . VAL E 1 646 ? -7.679 38.415 -4.368 1.00 42.78 ? 646 VAL E CG2 1 +ATOM 28042 N N . SER E 1 647 ? -2.983 38.128 -4.234 1.00 44.29 ? 647 SER E N 1 +ATOM 28043 C CA . SER E 1 647 ? -1.675 37.922 -4.830 1.00 44.57 ? 647 SER E CA 1 +ATOM 28044 C C . SER E 1 647 ? -1.722 36.718 -5.753 1.00 45.69 ? 647 SER E C 1 +ATOM 28045 O O . SER E 1 647 ? -1.983 36.854 -6.942 1.00 47.41 ? 647 SER E O 1 +ATOM 28046 C CB . SER E 1 647 ? -0.616 37.727 -3.744 1.00 42.91 ? 647 SER E CB 1 +ATOM 28047 O OG . SER E 1 647 ? -0.960 36.674 -2.867 1.00 42.66 ? 647 SER E OG 1 +ATOM 28048 N N . LYS E 1 648 ? -1.494 35.537 -5.192 1.00 46.85 ? 648 LYS E N 1 +ATOM 28049 C CA . LYS E 1 648 ? -1.493 34.293 -5.949 1.00 47.22 ? 648 LYS E CA 1 +ATOM 28050 C C . LYS E 1 648 ? -2.799 33.525 -5.721 1.00 46.42 ? 648 LYS E C 1 +ATOM 28051 O O . LYS E 1 648 ? -3.241 33.361 -4.586 1.00 46.16 ? 648 LYS E O 1 +ATOM 28052 C CB . LYS E 1 648 ? -0.283 33.464 -5.511 1.00 48.97 ? 648 LYS E CB 1 +ATOM 28053 C CG . LYS E 1 648 ? -0.082 32.119 -6.171 1.00 52.32 ? 648 LYS E CG 1 +ATOM 28054 C CD . LYS E 1 648 ? 1.276 31.562 -5.718 1.00 57.56 ? 648 LYS E CD 1 +ATOM 28055 C CE . LYS E 1 648 ? 1.487 30.086 -6.066 1.00 60.13 ? 648 LYS E CE 1 +ATOM 28056 N NZ . LYS E 1 648 ? 0.652 29.168 -5.229 1.00 61.64 ? 648 LYS E NZ 1 +ATOM 28057 N N . LEU E 1 649 ? -3.425 33.088 -6.814 1.00 45.66 ? 649 LEU E N 1 +ATOM 28058 C CA . LEU E 1 649 ? -4.670 32.321 -6.757 1.00 44.66 ? 649 LEU E CA 1 +ATOM 28059 C C . LEU E 1 649 ? -4.441 30.904 -7.275 1.00 44.56 ? 649 LEU E C 1 +ATOM 28060 O O . LEU E 1 649 ? -3.936 30.706 -8.375 1.00 43.55 ? 649 LEU E O 1 +ATOM 28061 C CB . LEU E 1 649 ? -5.762 32.978 -7.602 1.00 44.32 ? 649 LEU E CB 1 +ATOM 28062 C CG . LEU E 1 649 ? -7.027 32.137 -7.813 1.00 44.65 ? 649 LEU E CG 1 +ATOM 28063 C CD1 . LEU E 1 649 ? -7.716 31.905 -6.483 1.00 43.48 ? 649 LEU E CD1 1 +ATOM 28064 C CD2 . LEU E 1 649 ? -7.973 32.837 -8.787 1.00 44.85 ? 649 LEU E CD2 1 +ATOM 28065 N N . THR E 1 650 ? -4.800 29.915 -6.471 1.00 45.11 ? 650 THR E N 1 +ATOM 28066 C CA . THR E 1 650 ? -4.638 28.529 -6.881 1.00 44.20 ? 650 THR E CA 1 +ATOM 28067 C C . THR E 1 650 ? -6.006 27.890 -7.025 1.00 44.05 ? 650 THR E C 1 +ATOM 28068 O O . THR E 1 650 ? -6.828 27.921 -6.110 1.00 41.85 ? 650 THR E O 1 +ATOM 28069 C CB . THR E 1 650 ? -3.826 27.706 -5.872 1.00 44.05 ? 650 THR E CB 1 +ATOM 28070 O OG1 . THR E 1 650 ? -2.531 28.295 -5.692 1.00 46.11 ? 650 THR E OG1 1 +ATOM 28071 C CG2 . THR E 1 650 ? -3.659 26.282 -6.379 1.00 42.55 ? 650 THR E CG2 1 +ATOM 28072 N N . ILE E 1 651 ? -6.243 27.325 -8.197 1.00 45.38 ? 651 ILE E N 1 +ATOM 28073 C CA . ILE E 1 651 ? -7.504 26.672 -8.482 1.00 47.14 ? 651 ILE E CA 1 +ATOM 28074 C C . ILE E 1 651 ? -7.256 25.194 -8.722 1.00 47.09 ? 651 ILE E C 1 +ATOM 28075 O O . ILE E 1 651 ? -6.452 24.817 -9.574 1.00 46.59 ? 651 ILE E O 1 +ATOM 28076 C CB . ILE E 1 651 ? -8.174 27.295 -9.728 1.00 47.34 ? 651 ILE E CB 1 +ATOM 28077 C CG1 . ILE E 1 651 ? -8.469 28.772 -9.458 1.00 48.98 ? 651 ILE E CG1 1 +ATOM 28078 C CG2 . ILE E 1 651 ? -9.462 26.560 -10.057 1.00 46.25 ? 651 ILE E CG2 1 +ATOM 28079 C CD1 . ILE E 1 651 ? -9.007 29.525 -10.645 1.00 50.90 ? 651 ILE E CD1 1 +ATOM 28080 N N . THR E 1 652 ? -7.912 24.348 -7.944 1.00 47.48 ? 652 THR E N 1 +ATOM 28081 C CA . THR E 1 652 ? -7.740 22.927 -8.161 1.00 50.06 ? 652 THR E CA 1 +ATOM 28082 C C . THR E 1 652 ? -8.987 22.528 -8.942 1.00 49.48 ? 652 THR E C 1 +ATOM 28083 O O . THR E 1 652 ? -10.102 22.909 -8.591 1.00 47.66 ? 652 THR E O 1 +ATOM 28084 C CB . THR E 1 652 ? -7.615 22.129 -6.826 1.00 50.21 ? 652 THR E CB 1 +ATOM 28085 O OG1 . THR E 1 652 ? -8.909 21.877 -6.292 1.00 52.00 ? 652 THR E OG1 1 +ATOM 28086 C CG2 . THR E 1 652 ? -6.808 22.914 -5.798 1.00 49.03 ? 652 THR E CG2 1 +ATOM 28087 N N . SER E 1 653 ? -8.789 21.791 -10.027 1.00 51.23 ? 653 SER E N 1 +ATOM 28088 C CA . SER E 1 653 ? -9.900 21.391 -10.870 1.00 52.46 ? 653 SER E CA 1 +ATOM 28089 C C . SER E 1 653 ? -9.555 20.178 -11.712 1.00 53.28 ? 653 SER E C 1 +ATOM 28090 O O . SER E 1 653 ? -8.431 20.036 -12.179 1.00 52.84 ? 653 SER E O 1 +ATOM 28091 C CB . SER E 1 653 ? -10.276 22.562 -11.780 1.00 52.19 ? 653 SER E CB 1 +ATOM 28092 O OG . SER E 1 653 ? -11.363 22.249 -12.628 1.00 53.33 ? 653 SER E OG 1 +ATOM 28093 N N . GLU E 1 654 ? -10.527 19.297 -11.901 1.00 55.81 ? 654 GLU E N 1 +ATOM 28094 C CA . GLU E 1 654 ? -10.305 18.115 -12.718 1.00 58.65 ? 654 GLU E CA 1 +ATOM 28095 C C . GLU E 1 654 ? -10.373 18.525 -14.185 1.00 59.59 ? 654 GLU E C 1 +ATOM 28096 O O . GLU E 1 654 ? -9.728 17.917 -15.035 1.00 59.71 ? 654 GLU E O 1 +ATOM 28097 C CB . GLU E 1 654 ? -11.347 17.041 -12.399 1.00 59.73 ? 654 GLU E CB 1 +ATOM 28098 C CG . GLU E 1 654 ? -11.257 16.537 -10.967 1.00 62.63 ? 654 GLU E CG 1 +ATOM 28099 C CD . GLU E 1 654 ? -12.218 15.402 -10.664 1.00 64.01 ? 654 GLU E CD 1 +ATOM 28100 O OE1 . GLU E 1 654 ? -12.034 14.294 -11.213 1.00 65.66 ? 654 GLU E OE1 1 +ATOM 28101 O OE2 . GLU E 1 654 ? -13.158 15.619 -9.870 1.00 65.49 ? 654 GLU E OE2 1 +ATOM 28102 N N . LYS E 1 655 ? -11.153 19.566 -14.470 1.00 60.71 ? 655 LYS E N 1 +ATOM 28103 C CA . LYS E 1 655 ? -11.285 20.092 -15.825 1.00 62.58 ? 655 LYS E CA 1 +ATOM 28104 C C . LYS E 1 655 ? -10.251 21.204 -15.970 1.00 62.52 ? 655 LYS E C 1 +ATOM 28105 O O . LYS E 1 655 ? -10.079 22.012 -15.064 1.00 62.67 ? 655 LYS E O 1 +ATOM 28106 C CB . LYS E 1 655 ? -12.694 20.645 -16.049 1.00 64.68 ? 655 LYS E CB 1 +ATOM 28107 C CG . LYS E 1 655 ? -13.776 19.582 -15.922 1.00 67.95 ? 655 LYS E CG 1 +ATOM 28108 C CD . LYS E 1 655 ? -15.167 20.121 -16.233 1.00 69.80 ? 655 LYS E CD 1 +ATOM 28109 C CE . LYS E 1 655 ? -16.207 18.997 -16.174 1.00 71.40 ? 655 LYS E CE 1 +ATOM 28110 N NZ . LYS E 1 655 ? -17.597 19.465 -16.473 1.00 71.46 ? 655 LYS E NZ 1 +ATOM 28111 N N . PRO E 1 656 ? -9.549 21.259 -17.111 1.00 62.33 ? 656 PRO E N 1 +ATOM 28112 C CA . PRO E 1 656 ? -8.526 22.286 -17.340 1.00 62.26 ? 656 PRO E CA 1 +ATOM 28113 C C . PRO E 1 656 ? -9.013 23.733 -17.285 1.00 61.62 ? 656 PRO E C 1 +ATOM 28114 O O . PRO E 1 656 ? -10.155 24.040 -17.626 1.00 60.93 ? 656 PRO E O 1 +ATOM 28115 C CB . PRO E 1 656 ? -7.955 21.904 -18.706 1.00 62.44 ? 656 PRO E CB 1 +ATOM 28116 C CG . PRO E 1 656 ? -9.130 21.291 -19.390 1.00 62.63 ? 656 PRO E CG 1 +ATOM 28117 C CD . PRO E 1 656 ? -9.735 20.430 -18.313 1.00 62.10 ? 656 PRO E CD 1 +ATOM 28118 N N . VAL E 1 657 ? -8.129 24.612 -16.826 1.00 61.56 ? 657 VAL E N 1 +ATOM 28119 C CA . VAL E 1 657 ? -8.418 26.036 -16.710 1.00 61.71 ? 657 VAL E CA 1 +ATOM 28120 C C . VAL E 1 657 ? -7.346 26.756 -17.519 1.00 62.16 ? 657 VAL E C 1 +ATOM 28121 O O . VAL E 1 657 ? -6.173 26.742 -17.157 1.00 62.02 ? 657 VAL E O 1 +ATOM 28122 C CB . VAL E 1 657 ? -8.345 26.512 -15.233 1.00 61.52 ? 657 VAL E CB 1 +ATOM 28123 C CG1 . VAL E 1 657 ? -8.720 27.989 -15.133 1.00 60.38 ? 657 VAL E CG1 1 +ATOM 28124 C CG2 . VAL E 1 657 ? -9.268 25.677 -14.370 1.00 60.07 ? 657 VAL E CG2 1 +ATOM 28125 N N . SER E 1 658 ? -7.749 27.379 -18.620 1.00 62.96 ? 658 SER E N 1 +ATOM 28126 C CA . SER E 1 658 ? -6.800 28.080 -19.475 1.00 64.13 ? 658 SER E CA 1 +ATOM 28127 C C . SER E 1 658 ? -6.579 29.532 -19.068 1.00 63.64 ? 658 SER E C 1 +ATOM 28128 O O . SER E 1 658 ? -5.481 30.063 -19.222 1.00 64.16 ? 658 SER E O 1 +ATOM 28129 C CB . SER E 1 658 ? -7.270 28.022 -20.929 1.00 64.32 ? 658 SER E CB 1 +ATOM 28130 O OG . SER E 1 658 ? -8.595 28.510 -21.042 1.00 66.88 ? 658 SER E OG 1 +ATOM 28131 N N . LYS E 1 659 ? -7.614 30.171 -18.538 1.00 63.14 ? 659 LYS E N 1 +ATOM 28132 C CA . LYS E 1 659 ? -7.493 31.563 -18.147 1.00 62.86 ? 659 LYS E CA 1 +ATOM 28133 C C . LYS E 1 659 ? -8.568 31.995 -17.166 1.00 62.08 ? 659 LYS E C 1 +ATOM 28134 O O . LYS E 1 659 ? -9.605 31.344 -17.028 1.00 60.81 ? 659 LYS E O 1 +ATOM 28135 C CB . LYS E 1 659 ? -7.577 32.450 -19.390 1.00 63.51 ? 659 LYS E CB 1 +ATOM 28136 C CG . LYS E 1 659 ? -8.935 32.399 -20.068 1.00 65.81 ? 659 LYS E CG 1 +ATOM 28137 C CD . LYS E 1 659 ? -9.031 33.333 -21.267 1.00 68.20 ? 659 LYS E CD 1 +ATOM 28138 C CE . LYS E 1 659 ? -8.159 32.868 -22.430 1.00 70.31 ? 659 LYS E CE 1 +ATOM 28139 N NZ . LYS E 1 659 ? -6.696 32.975 -22.147 1.00 71.09 ? 659 LYS E NZ 1 +ATOM 28140 N N . ILE E 1 660 ? -8.297 33.102 -16.480 1.00 61.48 ? 660 ILE E N 1 +ATOM 28141 C CA . ILE E 1 660 ? -9.240 33.684 -15.537 1.00 61.54 ? 660 ILE E CA 1 +ATOM 28142 C C . ILE E 1 660 ? -9.435 35.128 -15.981 1.00 61.40 ? 660 ILE E C 1 +ATOM 28143 O O . ILE E 1 660 ? -8.562 35.706 -16.627 1.00 60.31 ? 660 ILE E O 1 +ATOM 28144 C CB . ILE E 1 660 ? -8.716 33.681 -14.082 1.00 61.91 ? 660 ILE E CB 1 +ATOM 28145 C CG1 . ILE E 1 660 ? -7.442 34.514 -13.985 1.00 62.52 ? 660 ILE E CG1 1 +ATOM 28146 C CG2 . ILE E 1 660 ? -8.474 32.258 -13.613 1.00 60.84 ? 660 ILE E CG2 1 +ATOM 28147 C CD1 . ILE E 1 660 ? -7.016 34.800 -12.568 1.00 63.32 ? 660 ILE E CD1 1 +ATOM 28148 N N . ILE E 1 661 ? -10.583 35.702 -15.643 1.00 61.66 ? 661 ILE E N 1 +ATOM 28149 C CA . ILE E 1 661 ? -10.888 37.075 -16.019 1.00 61.93 ? 661 ILE E CA 1 +ATOM 28150 C C . ILE E 1 661 ? -11.294 37.884 -14.797 1.00 62.13 ? 661 ILE E C 1 +ATOM 28151 O O . ILE E 1 661 ? -12.292 37.584 -14.139 1.00 61.00 ? 661 ILE E O 1 +ATOM 28152 C CB . ILE E 1 661 ? -12.032 37.129 -17.059 1.00 62.37 ? 661 ILE E CB 1 +ATOM 28153 C CG1 . ILE E 1 661 ? -11.642 36.322 -18.300 1.00 63.44 ? 661 ILE E CG1 1 +ATOM 28154 C CG2 . ILE E 1 661 ? -12.319 38.573 -17.440 1.00 61.31 ? 661 ILE E CG2 1 +ATOM 28155 C CD1 . ILE E 1 661 ? -12.779 36.080 -19.262 1.00 64.70 ? 661 ILE E CD1 1 +ATOM 28156 N N . VAL E 1 662 ? -10.513 38.917 -14.503 1.00 62.46 ? 662 VAL E N 1 +ATOM 28157 C CA . VAL E 1 662 ? -10.775 39.776 -13.361 1.00 62.72 ? 662 VAL E CA 1 +ATOM 28158 C C . VAL E 1 662 ? -11.757 40.896 -13.688 1.00 62.88 ? 662 VAL E C 1 +ATOM 28159 O O . VAL E 1 662 ? -11.465 41.770 -14.496 1.00 61.95 ? 662 VAL E O 1 +ATOM 28160 C CB . VAL E 1 662 ? -9.474 40.402 -12.845 1.00 62.08 ? 662 VAL E CB 1 +ATOM 28161 C CG1 . VAL E 1 662 ? -9.772 41.322 -11.681 1.00 62.28 ? 662 VAL E CG1 1 +ATOM 28162 C CG2 . VAL E 1 662 ? -8.504 39.312 -12.438 1.00 62.08 ? 662 VAL E CG2 1 +ATOM 28163 N N . ASP E 1 663 ? -12.924 40.854 -13.052 1.00 64.13 ? 663 ASP E N 1 +ATOM 28164 C CA . ASP E 1 663 ? -13.965 41.866 -13.235 1.00 65.95 ? 663 ASP E CA 1 +ATOM 28165 C C . ASP E 1 663 ? -14.360 42.151 -14.687 1.00 65.27 ? 663 ASP E C 1 +ATOM 28166 O O . ASP E 1 663 ? -14.723 43.274 -15.014 1.00 64.92 ? 663 ASP E O 1 +ATOM 28167 C CB . ASP E 1 663 ? -13.526 43.186 -12.592 1.00 68.00 ? 663 ASP E CB 1 +ATOM 28168 C CG . ASP E 1 663 ? -13.263 43.060 -11.099 1.00 70.09 ? 663 ASP E CG 1 +ATOM 28169 O OD1 . ASP E 1 663 ? -14.164 42.591 -10.377 1.00 71.44 ? 663 ASP E OD1 1 +ATOM 28170 O OD2 . ASP E 1 663 ? -12.160 43.439 -10.643 1.00 71.18 ? 663 ASP E OD2 1 +ATOM 28171 N N . ASP E 1 664 ? -14.282 41.153 -15.558 1.00 63.98 ? 664 ASP E N 1 +ATOM 28172 C CA . ASP E 1 664 ? -14.632 41.338 -16.967 1.00 62.35 ? 664 ASP E CA 1 +ATOM 28173 C C . ASP E 1 664 ? -13.626 42.209 -17.708 1.00 60.78 ? 664 ASP E C 1 +ATOM 28174 O O . ASP E 1 664 ? -13.799 42.481 -18.891 1.00 61.22 ? 664 ASP E O 1 +ATOM 28175 C CB . ASP E 1 664 ? -16.014 41.973 -17.109 1.00 61.80 ? 664 ASP E CB 1 +ATOM 28176 C CG . ASP E 1 664 ? -17.076 41.222 -16.354 1.00 63.38 ? 664 ASP E CG 1 +ATOM 28177 O OD1 . ASP E 1 664 ? -17.195 39.993 -16.561 1.00 64.40 ? 664 ASP E OD1 1 +ATOM 28178 O OD2 . ASP E 1 664 ? -17.794 41.861 -15.557 1.00 63.76 ? 664 ASP E OD2 1 +ATOM 28179 N N . SER E 1 665 ? -12.588 42.659 -17.016 1.00 58.68 ? 665 SER E N 1 +ATOM 28180 C CA . SER E 1 665 ? -11.572 43.492 -17.645 1.00 57.72 ? 665 SER E CA 1 +ATOM 28181 C C . SER E 1 665 ? -10.287 42.707 -17.866 1.00 56.43 ? 665 SER E C 1 +ATOM 28182 O O . SER E 1 665 ? -10.121 42.041 -18.882 1.00 56.43 ? 665 SER E O 1 +ATOM 28183 C CB . SER E 1 665 ? -11.262 44.715 -16.774 1.00 58.89 ? 665 SER E CB 1 +ATOM 28184 O OG . SER E 1 665 ? -12.437 45.448 -16.477 1.00 61.74 ? 665 SER E OG 1 +ATOM 28185 N N . LYS E 1 666 ? -9.393 42.783 -16.887 1.00 55.34 ? 666 LYS E N 1 +ATOM 28186 C CA . LYS E 1 666 ? -8.099 42.121 -16.940 1.00 54.37 ? 666 LYS E CA 1 +ATOM 28187 C C . LYS E 1 666 ? -8.177 40.606 -17.110 1.00 54.85 ? 666 LYS E C 1 +ATOM 28188 O O . LYS E 1 666 ? -8.755 39.900 -16.285 1.00 54.51 ? 666 LYS E O 1 +ATOM 28189 C CB . LYS E 1 666 ? -7.308 42.462 -15.673 1.00 54.19 ? 666 LYS E CB 1 +ATOM 28190 C CG . LYS E 1 666 ? -5.882 42.946 -15.911 1.00 53.08 ? 666 LYS E CG 1 +ATOM 28191 C CD . LYS E 1 666 ? -4.963 41.816 -16.315 1.00 52.08 ? 666 LYS E CD 1 +ATOM 28192 C CE . LYS E 1 666 ? -3.541 42.316 -16.450 1.00 50.25 ? 666 LYS E CE 1 +ATOM 28193 N NZ . LYS E 1 666 ? -3.171 43.132 -15.270 1.00 50.61 ? 666 LYS E NZ 1 +ATOM 28194 N N . GLU E 1 667 ? -7.593 40.121 -18.200 1.00 55.10 ? 667 GLU E N 1 +ATOM 28195 C CA . GLU E 1 667 ? -7.546 38.697 -18.494 1.00 55.68 ? 667 GLU E CA 1 +ATOM 28196 C C . GLU E 1 667 ? -6.173 38.238 -18.010 1.00 55.07 ? 667 GLU E C 1 +ATOM 28197 O O . GLU E 1 667 ? -5.165 38.857 -18.334 1.00 55.13 ? 667 GLU E O 1 +ATOM 28198 C CB . GLU E 1 667 ? -7.664 38.465 -20.002 1.00 57.47 ? 667 GLU E CB 1 +ATOM 28199 C CG . GLU E 1 667 ? -7.965 37.025 -20.402 1.00 62.14 ? 667 GLU E CG 1 +ATOM 28200 C CD . GLU E 1 667 ? -8.058 36.839 -21.914 1.00 64.53 ? 667 GLU E CD 1 +ATOM 28201 O OE1 . GLU E 1 667 ? -6.996 36.759 -22.574 1.00 65.53 ? 667 GLU E OE1 1 +ATOM 28202 O OE2 . GLU E 1 667 ? -9.193 36.783 -22.443 1.00 65.43 ? 667 GLU E OE2 1 +ATOM 28203 N N . ILE E 1 668 ? -6.123 37.169 -17.226 1.00 54.41 ? 668 ILE E N 1 +ATOM 28204 C CA . ILE E 1 668 ? -4.839 36.699 -16.727 1.00 54.16 ? 668 ILE E CA 1 +ATOM 28205 C C . ILE E 1 668 ? -4.602 35.232 -17.023 1.00 54.51 ? 668 ILE E C 1 +ATOM 28206 O O . ILE E 1 668 ? -5.499 34.395 -16.879 1.00 53.32 ? 668 ILE E O 1 +ATOM 28207 C CB . ILE E 1 668 ? -4.706 36.928 -15.209 1.00 53.95 ? 668 ILE E CB 1 +ATOM 28208 C CG1 . ILE E 1 668 ? -4.838 38.421 -14.898 1.00 53.20 ? 668 ILE E CG1 1 +ATOM 28209 C CG2 . ILE E 1 668 ? -3.364 36.400 -14.723 1.00 52.65 ? 668 ILE E CG2 1 +ATOM 28210 C CD1 . ILE E 1 668 ? -4.921 38.733 -13.423 1.00 54.47 ? 668 ILE E CD1 1 +ATOM 28211 N N . GLN E 1 669 ? -3.377 34.937 -17.438 1.00 55.00 ? 669 GLN E N 1 +ATOM 28212 C CA . GLN E 1 669 ? -2.978 33.582 -17.771 1.00 56.24 ? 669 GLN E CA 1 +ATOM 28213 C C . GLN E 1 669 ? -2.858 32.697 -16.538 1.00 55.20 ? 669 GLN E C 1 +ATOM 28214 O O . GLN E 1 669 ? -2.473 33.151 -15.459 1.00 54.55 ? 669 GLN E O 1 +ATOM 28215 C CB . GLN E 1 669 ? -1.646 33.604 -18.522 1.00 58.88 ? 669 GLN E CB 1 +ATOM 28216 C CG . GLN E 1 669 ? -1.736 34.206 -19.915 1.00 62.33 ? 669 GLN E CG 1 +ATOM 28217 C CD . GLN E 1 669 ? -2.735 33.473 -20.800 1.00 65.08 ? 669 GLN E CD 1 +ATOM 28218 O OE1 . GLN E 1 669 ? -3.946 33.529 -20.572 1.00 66.85 ? 669 GLN E OE1 1 +ATOM 28219 N NE2 . GLN E 1 669 ? -2.229 32.775 -21.812 1.00 65.41 ? 669 GLN E NE2 1 +ATOM 28220 N N . VAL E 1 670 ? -3.196 31.427 -16.712 1.00 54.07 ? 670 VAL E N 1 +ATOM 28221 C CA . VAL E 1 670 ? -3.131 30.459 -15.630 1.00 52.58 ? 670 VAL E CA 1 +ATOM 28222 C C . VAL E 1 670 ? -2.152 29.384 -16.047 1.00 52.52 ? 670 VAL E C 1 +ATOM 28223 O O . VAL E 1 670 ? -2.105 29.012 -17.214 1.00 53.40 ? 670 VAL E O 1 +ATOM 28224 C CB . VAL E 1 670 ? -4.504 29.820 -15.393 1.00 52.30 ? 670 VAL E CB 1 +ATOM 28225 C CG1 . VAL E 1 670 ? -4.402 28.762 -14.334 1.00 52.10 ? 670 VAL E CG1 1 +ATOM 28226 C CG2 . VAL E 1 670 ? -5.514 30.894 -14.991 1.00 51.07 ? 670 VAL E CG2 1 +ATOM 28227 N N . GLU E 1 671 ? -1.349 28.895 -15.111 1.00 52.21 ? 671 GLU E N 1 +ATOM 28228 C CA . GLU E 1 671 ? -0.400 27.848 -15.453 1.00 52.31 ? 671 GLU E CA 1 +ATOM 28229 C C . GLU E 1 671 ? -0.569 26.599 -14.581 1.00 50.67 ? 671 GLU E C 1 +ATOM 28230 O O . GLU E 1 671 ? -0.633 26.676 -13.356 1.00 51.90 ? 671 GLU E O 1 +ATOM 28231 C CB . GLU E 1 671 ? 1.035 28.382 -15.374 1.00 54.54 ? 671 GLU E CB 1 +ATOM 28232 C CG . GLU E 1 671 ? 1.592 28.596 -13.982 1.00 60.84 ? 671 GLU E CG 1 +ATOM 28233 C CD . GLU E 1 671 ? 2.924 29.351 -14.001 1.00 65.62 ? 671 GLU E CD 1 +ATOM 28234 O OE1 . GLU E 1 671 ? 3.822 28.957 -14.788 1.00 65.82 ? 671 GLU E OE1 1 +ATOM 28235 O OE2 . GLU E 1 671 ? 3.071 30.334 -13.228 1.00 66.66 ? 671 GLU E OE2 1 +ATOM 28236 N N . LYS E 1 672 ? -0.669 25.448 -15.230 1.00 47.79 ? 672 LYS E N 1 +ATOM 28237 C CA . LYS E 1 672 ? -0.818 24.193 -14.525 1.00 46.79 ? 672 LYS E CA 1 +ATOM 28238 C C . LYS E 1 672 ? 0.527 23.884 -13.884 1.00 46.18 ? 672 LYS E C 1 +ATOM 28239 O O . LYS E 1 672 ? 1.509 23.654 -14.580 1.00 45.50 ? 672 LYS E O 1 +ATOM 28240 C CB . LYS E 1 672 ? -1.210 23.085 -15.511 1.00 46.36 ? 672 LYS E CB 1 +ATOM 28241 C CG . LYS E 1 672 ? -1.628 21.771 -14.870 1.00 46.17 ? 672 LYS E CG 1 +ATOM 28242 C CD . LYS E 1 672 ? -2.106 20.769 -15.912 1.00 46.40 ? 672 LYS E CD 1 +ATOM 28243 C CE . LYS E 1 672 ? -2.730 19.546 -15.248 1.00 48.77 ? 672 LYS E CE 1 +ATOM 28244 N NZ . LYS E 1 672 ? -3.220 18.520 -16.208 1.00 48.33 ? 672 LYS E NZ 1 +ATOM 28245 N N . THR E 1 673 ? 0.571 23.895 -12.556 1.00 46.50 ? 673 THR E N 1 +ATOM 28246 C CA . THR E 1 673 ? 1.802 23.617 -11.819 1.00 46.46 ? 673 THR E CA 1 +ATOM 28247 C C . THR E 1 673 ? 1.975 22.127 -11.532 1.00 45.82 ? 673 THR E C 1 +ATOM 28248 O O . THR E 1 673 ? 3.086 21.644 -11.333 1.00 46.24 ? 673 THR E O 1 +ATOM 28249 C CB . THR E 1 673 ? 1.825 24.383 -10.489 1.00 47.03 ? 673 THR E CB 1 +ATOM 28250 O OG1 . THR E 1 673 ? 0.614 24.122 -9.765 1.00 46.51 ? 673 THR E OG1 1 +ATOM 28251 C CG2 . THR E 1 673 ? 1.959 25.879 -10.739 1.00 45.47 ? 673 THR E CG2 1 +ATOM 28252 N N . MET E 1 674 ? 0.861 21.410 -11.486 1.00 45.04 ? 674 MET E N 1 +ATOM 28253 C CA . MET E 1 674 ? 0.868 19.971 -11.255 1.00 44.40 ? 674 MET E CA 1 +ATOM 28254 C C . MET E 1 674 ? -0.545 19.473 -11.528 1.00 43.19 ? 674 MET E C 1 +ATOM 28255 O O . MET E 1 674 ? -1.437 20.273 -11.803 1.00 43.19 ? 674 MET E O 1 +ATOM 28256 C CB . MET E 1 674 ? 1.310 19.642 -9.825 1.00 45.02 ? 674 MET E CB 1 +ATOM 28257 C CG . MET E 1 674 ? 0.356 20.062 -8.725 1.00 44.76 ? 674 MET E CG 1 +ATOM 28258 S SD . MET E 1 674 ? 1.091 19.733 -7.097 1.00 44.63 ? 674 MET E SD 1 +ATOM 28259 C CE . MET E 1 674 ? -0.025 20.699 -6.028 1.00 44.62 ? 674 MET E CE 1 +ATOM 28260 N N . GLN E 1 675 ? -0.754 18.166 -11.466 1.00 41.83 ? 675 GLN E N 1 +ATOM 28261 C CA . GLN E 1 675 ? -2.071 17.609 -11.757 1.00 42.27 ? 675 GLN E CA 1 +ATOM 28262 C C . GLN E 1 675 ? -3.204 18.313 -11.007 1.00 41.87 ? 675 GLN E C 1 +ATOM 28263 O O . GLN E 1 675 ? -3.113 18.548 -9.802 1.00 41.70 ? 675 GLN E O 1 +ATOM 28264 C CB . GLN E 1 675 ? -2.090 16.106 -11.451 1.00 41.43 ? 675 GLN E CB 1 +ATOM 28265 C CG . GLN E 1 675 ? -2.034 15.779 -9.974 1.00 42.84 ? 675 GLN E CG 1 +ATOM 28266 C CD . GLN E 1 675 ? -1.770 14.308 -9.706 1.00 43.63 ? 675 GLN E CD 1 +ATOM 28267 O OE1 . GLN E 1 675 ? -2.374 13.430 -10.329 1.00 44.25 ? 675 GLN E OE1 1 +ATOM 28268 N NE2 . GLN E 1 675 ? -0.870 14.031 -8.766 1.00 41.98 ? 675 GLN E NE2 1 +ATOM 28269 N N . ASN E 1 676 ? -4.263 18.655 -11.739 1.00 41.21 ? 676 ASN E N 1 +ATOM 28270 C CA . ASN E 1 676 ? -5.436 19.322 -11.181 1.00 42.23 ? 676 ASN E CA 1 +ATOM 28271 C C . ASN E 1 676 ? -5.138 20.680 -10.528 1.00 42.87 ? 676 ASN E C 1 +ATOM 28272 O O . ASN E 1 676 ? -6.017 21.268 -9.891 1.00 40.78 ? 676 ASN E O 1 +ATOM 28273 C CB . ASN E 1 676 ? -6.104 18.414 -10.140 1.00 42.92 ? 676 ASN E CB 1 +ATOM 28274 C CG . ASN E 1 676 ? -6.369 17.001 -10.663 1.00 44.61 ? 676 ASN E CG 1 +ATOM 28275 O OD1 . ASN E 1 676 ? -7.084 16.813 -11.650 1.00 45.20 ? 676 ASN E OD1 1 +ATOM 28276 N ND2 . ASN E 1 676 ? -5.799 16.001 -9.991 1.00 42.36 ? 676 ASN E ND2 1 +ATOM 28277 N N . THR E 1 677 ? -3.921 21.190 -10.700 1.00 42.28 ? 677 THR E N 1 +ATOM 28278 C CA . THR E 1 677 ? -3.546 22.446 -10.059 1.00 44.40 ? 677 THR E CA 1 +ATOM 28279 C C . THR E 1 677 ? -3.194 23.590 -11.017 1.00 44.59 ? 677 THR E C 1 +ATOM 28280 O O . THR E 1 677 ? -2.224 23.509 -11.768 1.00 45.46 ? 677 THR E O 1 +ATOM 28281 C CB . THR E 1 677 ? -2.366 22.204 -9.088 1.00 45.20 ? 677 THR E CB 1 +ATOM 28282 O OG1 . THR E 1 677 ? -2.628 21.024 -8.317 1.00 45.57 ? 677 THR E OG1 1 +ATOM 28283 C CG2 . THR E 1 677 ? -2.191 23.393 -8.137 1.00 43.29 ? 677 THR E CG2 1 +ATOM 28284 N N . TYR E 1 678 ? -3.979 24.662 -10.957 1.00 44.15 ? 678 TYR E N 1 +ATOM 28285 C CA . TYR E 1 678 ? -3.787 25.823 -11.824 1.00 45.26 ? 678 TYR E CA 1 +ATOM 28286 C C . TYR E 1 678 ? -3.527 27.095 -11.024 1.00 44.43 ? 678 TYR E C 1 +ATOM 28287 O O . TYR E 1 678 ? -4.288 27.444 -10.125 1.00 42.50 ? 678 TYR E O 1 +ATOM 28288 C CB . TYR E 1 678 ? -5.018 25.987 -12.715 1.00 46.73 ? 678 TYR E CB 1 +ATOM 28289 C CG . TYR E 1 678 ? -5.276 24.762 -13.554 1.00 48.14 ? 678 TYR E CG 1 +ATOM 28290 C CD1 . TYR E 1 678 ? -4.480 24.476 -14.665 1.00 48.17 ? 678 TYR E CD1 1 +ATOM 28291 C CD2 . TYR E 1 678 ? -6.269 23.853 -13.201 1.00 48.47 ? 678 TYR E CD2 1 +ATOM 28292 C CE1 . TYR E 1 678 ? -4.666 23.315 -15.399 1.00 49.15 ? 678 TYR E CE1 1 +ATOM 28293 C CE2 . TYR E 1 678 ? -6.462 22.685 -13.928 1.00 49.18 ? 678 TYR E CE2 1 +ATOM 28294 C CZ . TYR E 1 678 ? -5.656 22.422 -15.024 1.00 49.92 ? 678 TYR E CZ 1 +ATOM 28295 O OH . TYR E 1 678 ? -5.819 21.259 -15.735 1.00 51.75 ? 678 TYR E OH 1 +ATOM 28296 N N . VAL E 1 679 ? -2.444 27.782 -11.367 1.00 45.01 ? 679 VAL E N 1 +ATOM 28297 C CA . VAL E 1 679 ? -2.043 28.994 -10.666 1.00 45.83 ? 679 VAL E CA 1 +ATOM 28298 C C . VAL E 1 679 ? -2.094 30.264 -11.509 1.00 46.89 ? 679 VAL E C 1 +ATOM 28299 O O . VAL E 1 679 ? -1.705 30.276 -12.674 1.00 47.14 ? 679 VAL E O 1 +ATOM 28300 C CB . VAL E 1 679 ? -0.618 28.836 -10.116 1.00 45.01 ? 679 VAL E CB 1 +ATOM 28301 C CG1 . VAL E 1 679 ? -0.176 30.101 -9.412 1.00 44.27 ? 679 VAL E CG1 1 +ATOM 28302 C CG2 . VAL E 1 679 ? -0.574 27.657 -9.175 1.00 44.65 ? 679 VAL E CG2 1 +ATOM 28303 N N . ALA E 1 680 ? -2.573 31.336 -10.893 1.00 48.29 ? 680 ALA E N 1 +ATOM 28304 C CA . ALA E 1 680 ? -2.673 32.632 -11.546 1.00 49.03 ? 680 ALA E CA 1 +ATOM 28305 C C . ALA E 1 680 ? -2.060 33.703 -10.648 1.00 49.49 ? 680 ALA E C 1 +ATOM 28306 O O . ALA E 1 680 ? -2.535 33.922 -9.535 1.00 48.14 ? 680 ALA E O 1 +ATOM 28307 C CB . ALA E 1 680 ? -4.130 32.958 -11.819 1.00 47.53 ? 680 ALA E CB 1 +ATOM 28308 N N . LYS E 1 681 ? -0.997 34.350 -11.123 1.00 51.05 ? 681 LYS E N 1 +ATOM 28309 C CA . LYS E 1 681 ? -0.345 35.423 -10.368 1.00 52.93 ? 681 LYS E CA 1 +ATOM 28310 C C . LYS E 1 681 ? -1.151 36.698 -10.652 1.00 53.03 ? 681 LYS E C 1 +ATOM 28311 O O . LYS E 1 681 ? -0.922 37.371 -11.650 1.00 53.65 ? 681 LYS E O 1 +ATOM 28312 C CB . LYS E 1 681 ? 1.097 35.619 -10.846 1.00 54.76 ? 681 LYS E CB 1 +ATOM 28313 C CG . LYS E 1 681 ? 1.953 34.362 -10.898 1.00 58.81 ? 681 LYS E CG 1 +ATOM 28314 C CD . LYS E 1 681 ? 2.442 33.928 -9.520 1.00 63.28 ? 681 LYS E CD 1 +ATOM 28315 C CE . LYS E 1 681 ? 3.511 32.839 -9.644 1.00 64.65 ? 681 LYS E CE 1 +ATOM 28316 N NZ . LYS E 1 681 ? 4.082 32.462 -8.319 1.00 67.30 ? 681 LYS E NZ 1 +ATOM 28317 N N . ILE E 1 682 ? -2.098 37.022 -9.779 1.00 52.39 ? 682 ILE E N 1 +ATOM 28318 C CA . ILE E 1 682 ? -2.945 38.193 -9.962 1.00 52.03 ? 682 ILE E CA 1 +ATOM 28319 C C . ILE E 1 682 ? -2.306 39.485 -9.456 1.00 52.68 ? 682 ILE E C 1 +ATOM 28320 O O . ILE E 1 682 ? -2.242 40.476 -10.179 1.00 51.53 ? 682 ILE E O 1 +ATOM 28321 C CB . ILE E 1 682 ? -4.305 37.978 -9.264 1.00 51.17 ? 682 ILE E CB 1 +ATOM 28322 C CG1 . ILE E 1 682 ? -5.028 36.803 -9.920 1.00 50.42 ? 682 ILE E CG1 1 +ATOM 28323 C CG2 . ILE E 1 682 ? -5.139 39.232 -9.336 1.00 49.33 ? 682 ILE E CG2 1 +ATOM 28324 C CD1 . ILE E 1 682 ? -6.333 36.439 -9.266 1.00 49.76 ? 682 ILE E CD1 1 +ATOM 28325 N N . ASN E 1 683 ? -1.848 39.471 -8.209 1.00 53.65 ? 683 ASN E N 1 +ATOM 28326 C CA . ASN E 1 683 ? -1.202 40.630 -7.605 1.00 54.42 ? 683 ASN E CA 1 +ATOM 28327 C C . ASN E 1 683 ? -1.888 41.957 -7.899 1.00 54.94 ? 683 ASN E C 1 +ATOM 28328 O O . ASN E 1 683 ? -1.284 42.858 -8.471 1.00 55.82 ? 683 ASN E O 1 +ATOM 28329 C CB . ASN E 1 683 ? 0.259 40.709 -8.054 1.00 53.73 ? 683 ASN E CB 1 +ATOM 28330 C CG . ASN E 1 683 ? 1.036 39.452 -7.723 1.00 54.94 ? 683 ASN E CG 1 +ATOM 28331 O OD1 . ASN E 1 683 ? 1.043 38.989 -6.581 1.00 56.26 ? 683 ASN E OD1 1 +ATOM 28332 N ND2 . ASN E 1 683 ? 1.698 38.892 -8.722 1.00 54.74 ? 683 ASN E ND2 1 +ATOM 28333 N N . GLN E 1 684 ? -3.151 42.074 -7.507 1.00 55.04 ? 684 GLN E N 1 +ATOM 28334 C CA . GLN E 1 684 ? -3.898 43.304 -7.711 1.00 55.46 ? 684 GLN E CA 1 +ATOM 28335 C C . GLN E 1 684 ? -5.251 43.223 -7.018 1.00 55.98 ? 684 GLN E C 1 +ATOM 28336 O O . GLN E 1 684 ? -5.742 42.139 -6.713 1.00 54.94 ? 684 GLN E O 1 +ATOM 28337 C CB . GLN E 1 684 ? -4.106 43.574 -9.199 1.00 56.09 ? 684 GLN E CB 1 +ATOM 28338 C CG . GLN E 1 684 ? -5.147 42.698 -9.833 1.00 58.24 ? 684 GLN E CG 1 +ATOM 28339 C CD . GLN E 1 684 ? -5.439 43.084 -11.264 1.00 59.67 ? 684 GLN E CD 1 +ATOM 28340 O OE1 . GLN E 1 684 ? -4.565 43.012 -12.130 1.00 61.61 ? 684 GLN E OE1 1 +ATOM 28341 N NE2 . GLN E 1 684 ? -6.673 43.495 -11.523 1.00 58.77 ? 684 GLN E NE2 1 +ATOM 28342 N N . LYS E 1 685 ? -5.850 44.378 -6.761 1.00 56.92 ? 685 LYS E N 1 +ATOM 28343 C CA . LYS E 1 685 ? -7.147 44.414 -6.105 1.00 57.89 ? 685 LYS E CA 1 +ATOM 28344 C C . LYS E 1 685 ? -8.237 43.923 -7.048 1.00 57.47 ? 685 LYS E C 1 +ATOM 28345 O O . LYS E 1 685 ? -8.139 44.070 -8.264 1.00 57.01 ? 685 LYS E O 1 +ATOM 28346 C CB . LYS E 1 685 ? -7.470 45.835 -5.621 1.00 59.65 ? 685 LYS E CB 1 +ATOM 28347 C CG . LYS E 1 685 ? -6.570 46.320 -4.500 1.00 61.39 ? 685 LYS E CG 1 +ATOM 28348 C CD . LYS E 1 685 ? -7.107 47.581 -3.853 1.00 63.64 ? 685 LYS E CD 1 +ATOM 28349 C CE . LYS E 1 685 ? -7.071 48.769 -4.803 1.00 65.63 ? 685 LYS E CE 1 +ATOM 28350 N NZ . LYS E 1 685 ? -5.690 49.124 -5.244 1.00 66.01 ? 685 LYS E NZ 1 +ATOM 28351 N N . ILE E 1 686 ? -9.273 43.326 -6.474 1.00 57.21 ? 686 ILE E N 1 +ATOM 28352 C CA . ILE E 1 686 ? -10.381 42.806 -7.250 1.00 57.14 ? 686 ILE E CA 1 +ATOM 28353 C C . ILE E 1 686 ? -11.668 43.433 -6.742 1.00 57.83 ? 686 ILE E C 1 +ATOM 28354 O O . ILE E 1 686 ? -12.068 43.231 -5.599 1.00 58.17 ? 686 ILE E O 1 +ATOM 28355 C CB . ILE E 1 686 ? -10.444 41.279 -7.135 1.00 57.27 ? 686 ILE E CB 1 +ATOM 28356 C CG1 . ILE E 1 686 ? -9.164 40.690 -7.720 1.00 57.35 ? 686 ILE E CG1 1 +ATOM 28357 C CG2 . ILE E 1 686 ? -11.659 40.734 -7.878 1.00 57.32 ? 686 ILE E CG2 1 +ATOM 28358 C CD1 . ILE E 1 686 ? -9.068 39.211 -7.604 1.00 58.31 ? 686 ILE E CD1 1 +ATOM 28359 N N . ARG E 1 687 ? -12.315 44.200 -7.606 1.00 58.11 ? 687 ARG E N 1 +ATOM 28360 C CA . ARG E 1 687 ? -13.532 44.896 -7.239 1.00 58.96 ? 687 ARG E CA 1 +ATOM 28361 C C . ARG E 1 687 ? -14.697 43.992 -6.853 1.00 57.94 ? 687 ARG E C 1 +ATOM 28362 O O . ARG E 1 687 ? -15.439 44.317 -5.929 1.00 57.80 ? 687 ARG E O 1 +ATOM 28363 C CB . ARG E 1 687 ? -13.923 45.867 -8.368 1.00 61.62 ? 687 ARG E CB 1 +ATOM 28364 C CG . ARG E 1 687 ? -12.853 46.949 -8.613 1.00 64.57 ? 687 ARG E CG 1 +ATOM 28365 C CD . ARG E 1 687 ? -13.161 47.907 -9.772 1.00 67.96 ? 687 ARG E CD 1 +ATOM 28366 N NE . ARG E 1 687 ? -14.388 48.679 -9.579 1.00 71.26 ? 687 ARG E NE 1 +ATOM 28367 C CZ . ARG E 1 687 ? -14.640 49.461 -8.530 1.00 73.34 ? 687 ARG E CZ 1 +ATOM 28368 N NH1 . ARG E 1 687 ? -13.748 49.593 -7.552 1.00 73.35 ? 687 ARG E NH1 1 +ATOM 28369 N NH2 . ARG E 1 687 ? -15.796 50.112 -8.455 1.00 73.69 ? 687 ARG E NH2 1 +ATOM 28370 N N . GLY E 1 688 ? -14.860 42.856 -7.527 1.00 57.23 ? 688 GLY E N 1 +ATOM 28371 C CA . GLY E 1 688 ? -15.967 41.983 -7.170 1.00 56.80 ? 688 GLY E CA 1 +ATOM 28372 C C . GLY E 1 688 ? -16.035 40.558 -7.704 1.00 56.13 ? 688 GLY E C 1 +ATOM 28373 O O . GLY E 1 688 ? -16.797 39.745 -7.172 1.00 55.78 ? 688 GLY E O 1 +ATOM 28374 N N . LYS E 1 689 ? -15.280 40.226 -8.745 1.00 55.43 ? 689 LYS E N 1 +ATOM 28375 C CA . LYS E 1 689 ? -15.360 38.866 -9.249 1.00 56.36 ? 689 LYS E CA 1 +ATOM 28376 C C . LYS E 1 689 ? -14.273 38.396 -10.212 1.00 56.58 ? 689 LYS E C 1 +ATOM 28377 O O . LYS E 1 689 ? -13.583 39.192 -10.847 1.00 56.03 ? 689 LYS E O 1 +ATOM 28378 C CB . LYS E 1 689 ? -16.720 38.633 -9.903 1.00 58.00 ? 689 LYS E CB 1 +ATOM 28379 C CG . LYS E 1 689 ? -16.819 39.149 -11.315 1.00 60.78 ? 689 LYS E CG 1 +ATOM 28380 C CD . LYS E 1 689 ? -18.060 38.616 -11.992 1.00 62.90 ? 689 LYS E CD 1 +ATOM 28381 C CE . LYS E 1 689 ? -18.042 38.904 -13.488 1.00 64.41 ? 689 LYS E CE 1 +ATOM 28382 N NZ . LYS E 1 689 ? -19.213 38.286 -14.171 1.00 65.44 ? 689 LYS E NZ 1 +ATOM 28383 N N . ILE E 1 690 ? -14.142 37.075 -10.293 1.00 56.56 ? 690 ILE E N 1 +ATOM 28384 C CA . ILE E 1 690 ? -13.184 36.413 -11.161 1.00 57.15 ? 690 ILE E CA 1 +ATOM 28385 C C . ILE E 1 690 ? -13.925 35.286 -11.870 1.00 58.64 ? 690 ILE E C 1 +ATOM 28386 O O . ILE E 1 690 ? -14.699 34.563 -11.247 1.00 58.02 ? 690 ILE E O 1 +ATOM 28387 C CB . ILE E 1 690 ? -12.025 35.783 -10.368 1.00 55.87 ? 690 ILE E CB 1 +ATOM 28388 C CG1 . ILE E 1 690 ? -11.250 36.858 -9.615 1.00 56.22 ? 690 ILE E CG1 1 +ATOM 28389 C CG2 . ILE E 1 690 ? -11.090 35.055 -11.313 1.00 55.53 ? 690 ILE E CG2 1 +ATOM 28390 C CD1 . ILE E 1 690 ? -10.133 36.306 -8.766 1.00 55.02 ? 690 ILE E CD1 1 +ATOM 28391 N N . ASN E 1 691 ? -13.699 35.148 -13.172 1.00 60.19 ? 691 ASN E N 1 +ATOM 28392 C CA . ASN E 1 691 ? -14.337 34.089 -13.939 1.00 61.75 ? 691 ASN E CA 1 +ATOM 28393 C C . ASN E 1 691 ? -13.278 33.130 -14.454 1.00 62.96 ? 691 ASN E C 1 +ATOM 28394 O O . ASN E 1 691 ? -12.152 33.534 -14.739 1.00 61.01 ? 691 ASN E O 1 +ATOM 28395 C CB . ASN E 1 691 ? -15.136 34.660 -15.117 1.00 61.62 ? 691 ASN E CB 1 +ATOM 28396 C CG . ASN E 1 691 ? -16.380 35.405 -14.673 1.00 62.28 ? 691 ASN E CG 1 +ATOM 28397 O OD1 . ASN E 1 691 ? -16.313 36.564 -14.266 1.00 62.69 ? 691 ASN E OD1 1 +ATOM 28398 N ND2 . ASN E 1 691 ? -17.526 34.734 -14.735 1.00 62.67 ? 691 ASN E ND2 1 +ATOM 28399 N N . LEU E 1 692 ? -13.643 31.855 -14.558 1.00 65.57 ? 692 LEU E N 1 +ATOM 28400 C CA . LEU E 1 692 ? -12.724 30.834 -15.041 1.00 68.78 ? 692 LEU E CA 1 +ATOM 28401 C C . LEU E 1 692 ? -13.145 30.347 -16.419 1.00 70.62 ? 692 LEU E C 1 +ATOM 28402 O O . LEU E 1 692 ? -14.338 30.295 -16.733 1.00 70.68 ? 692 LEU E O 1 +ATOM 28403 C CB . LEU E 1 692 ? -12.679 29.651 -14.064 1.00 69.08 ? 692 LEU E CB 1 +ATOM 28404 C CG . LEU E 1 692 ? -11.902 29.814 -12.754 1.00 69.14 ? 692 LEU E CG 1 +ATOM 28405 C CD1 . LEU E 1 692 ? -12.415 31.015 -11.970 1.00 69.45 ? 692 LEU E CD1 1 +ATOM 28406 C CD2 . LEU E 1 692 ? -12.041 28.541 -11.938 1.00 69.76 ? 692 LEU E CD2 1 +ATOM 28407 N N . GLU E 1 693 ? -12.158 29.996 -17.239 1.00 73.17 ? 693 GLU E N 1 +ATOM 28408 C CA . GLU E 1 693 ? -12.419 29.499 -18.586 1.00 76.22 ? 693 GLU E CA 1 +ATOM 28409 C C . GLU E 1 693 ? -11.448 28.389 -18.997 1.00 76.33 ? 693 GLU E C 1 +ATOM 28410 O O . GLU E 1 693 ? -10.293 28.359 -18.568 1.00 76.59 ? 693 GLU E O 1 +ATOM 28411 C CB . GLU E 1 693 ? -12.347 30.646 -19.595 1.00 77.81 ? 693 GLU E CB 1 +ATOM 28412 C CG . GLU E 1 693 ? -13.292 31.789 -19.292 1.00 81.03 ? 693 GLU E CG 1 +ATOM 28413 C CD . GLU E 1 693 ? -13.301 32.831 -20.387 1.00 83.50 ? 693 GLU E CD 1 +ATOM 28414 O OE1 . GLU E 1 693 ? -12.203 33.269 -20.793 1.00 85.13 ? 693 GLU E OE1 1 +ATOM 28415 O OE2 . GLU E 1 693 ? -14.403 33.216 -20.838 1.00 84.00 ? 693 GLU E OE2 1 +ATOM 28416 N N . ILE F 1 3 ? 9.956 -46.051 52.893 1.00 58.80 ? 3 ILE F N 1 +ATOM 28417 C CA . ILE F 1 3 ? 9.282 -47.064 52.029 1.00 59.12 ? 3 ILE F CA 1 +ATOM 28418 C C . ILE F 1 3 ? 9.012 -46.541 50.621 1.00 59.15 ? 3 ILE F C 1 +ATOM 28419 O O . ILE F 1 3 ? 7.944 -46.003 50.340 1.00 60.26 ? 3 ILE F O 1 +ATOM 28420 C CB . ILE F 1 3 ? 7.933 -47.531 52.647 1.00 59.10 ? 3 ILE F CB 1 +ATOM 28421 C CG1 . ILE F 1 3 ? 7.162 -48.389 51.639 1.00 59.50 ? 3 ILE F CG1 1 +ATOM 28422 C CG2 . ILE F 1 3 ? 7.098 -46.333 53.065 1.00 59.98 ? 3 ILE F CG2 1 +ATOM 28423 C CD1 . ILE F 1 3 ? 5.833 -48.916 52.159 1.00 59.76 ? 3 ILE F CD1 1 +ATOM 28424 N N . LEU F 1 4 ? 9.989 -46.701 49.737 1.00 57.84 ? 4 LEU F N 1 +ATOM 28425 C CA . LEU F 1 4 ? 9.837 -46.268 48.362 1.00 57.80 ? 4 LEU F CA 1 +ATOM 28426 C C . LEU F 1 4 ? 9.852 -47.467 47.429 1.00 57.39 ? 4 LEU F C 1 +ATOM 28427 O O . LEU F 1 4 ? 10.791 -48.251 47.430 1.00 57.69 ? 4 LEU F O 1 +ATOM 28428 C CB . LEU F 1 4 ? 10.947 -45.287 47.976 1.00 59.81 ? 4 LEU F CB 1 +ATOM 28429 C CG . LEU F 1 4 ? 12.397 -45.624 48.321 1.00 60.91 ? 4 LEU F CG 1 +ATOM 28430 C CD1 . LEU F 1 4 ? 13.312 -44.546 47.753 1.00 61.13 ? 4 LEU F CD1 1 +ATOM 28431 C CD2 . LEU F 1 4 ? 12.563 -45.717 49.830 1.00 61.55 ? 4 LEU F CD2 1 +ATOM 28432 N N . LYS F 1 5 ? 8.794 -47.611 46.642 1.00 56.54 ? 5 LYS F N 1 +ATOM 28433 C CA . LYS F 1 5 ? 8.689 -48.715 45.707 1.00 56.17 ? 5 LYS F CA 1 +ATOM 28434 C C . LYS F 1 5 ? 8.520 -48.197 44.288 1.00 55.28 ? 5 LYS F C 1 +ATOM 28435 O O . LYS F 1 5 ? 8.256 -47.016 44.078 1.00 55.76 ? 5 LYS F O 1 +ATOM 28436 C CB . LYS F 1 5 ? 7.509 -49.606 46.086 1.00 58.49 ? 5 LYS F CB 1 +ATOM 28437 C CG . LYS F 1 5 ? 7.762 -50.436 47.333 1.00 63.12 ? 5 LYS F CG 1 +ATOM 28438 C CD . LYS F 1 5 ? 6.493 -51.119 47.851 1.00 67.04 ? 5 LYS F CD 1 +ATOM 28439 C CE . LYS F 1 5 ? 5.601 -50.162 48.656 1.00 69.30 ? 5 LYS F CE 1 +ATOM 28440 N NZ . LYS F 1 5 ? 5.118 -48.975 47.876 1.00 70.06 ? 5 LYS F NZ 1 +ATOM 28441 N N . ILE F 1 6 ? 8.686 -49.082 43.314 1.00 53.02 ? 6 ILE F N 1 +ATOM 28442 C CA . ILE F 1 6 ? 8.548 -48.712 41.918 1.00 50.27 ? 6 ILE F CA 1 +ATOM 28443 C C . ILE F 1 6 ? 7.765 -49.781 41.180 1.00 51.49 ? 6 ILE F C 1 +ATOM 28444 O O . ILE F 1 6 ? 8.062 -50.961 41.309 1.00 50.74 ? 6 ILE F O 1 +ATOM 28445 C CB . ILE F 1 6 ? 9.906 -48.582 41.221 1.00 48.29 ? 6 ILE F CB 1 +ATOM 28446 C CG1 . ILE F 1 6 ? 10.748 -47.492 41.884 1.00 46.87 ? 6 ILE F CG1 1 +ATOM 28447 C CG2 . ILE F 1 6 ? 9.693 -48.273 39.743 1.00 48.31 ? 6 ILE F CG2 1 +ATOM 28448 C CD1 . ILE F 1 6 ? 12.054 -47.204 41.146 1.00 44.81 ? 6 ILE F CD1 1 +ATOM 28449 N N . TYR F 1 7 ? 6.766 -49.362 40.411 1.00 52.68 ? 7 TYR F N 1 +ATOM 28450 C CA . TYR F 1 7 ? 5.963 -50.285 39.632 1.00 54.03 ? 7 TYR F CA 1 +ATOM 28451 C C . TYR F 1 7 ? 6.176 -49.963 38.161 1.00 54.97 ? 7 TYR F C 1 +ATOM 28452 O O . TYR F 1 7 ? 6.733 -48.919 37.832 1.00 55.47 ? 7 TYR F O 1 +ATOM 28453 C CB . TYR F 1 7 ? 4.489 -50.151 39.999 1.00 55.99 ? 7 TYR F CB 1 +ATOM 28454 C CG . TYR F 1 7 ? 4.206 -50.436 41.455 1.00 59.37 ? 7 TYR F CG 1 +ATOM 28455 C CD1 . TYR F 1 7 ? 4.553 -49.515 42.445 1.00 60.43 ? 7 TYR F CD1 1 +ATOM 28456 C CD2 . TYR F 1 7 ? 3.592 -51.630 41.849 1.00 60.93 ? 7 TYR F CD2 1 +ATOM 28457 C CE1 . TYR F 1 7 ? 4.294 -49.770 43.796 1.00 61.19 ? 7 TYR F CE1 1 +ATOM 28458 C CE2 . TYR F 1 7 ? 3.328 -51.897 43.201 1.00 62.46 ? 7 TYR F CE2 1 +ATOM 28459 C CZ . TYR F 1 7 ? 3.682 -50.959 44.166 1.00 62.52 ? 7 TYR F CZ 1 +ATOM 28460 O OH . TYR F 1 7 ? 3.415 -51.199 45.497 1.00 64.24 ? 7 TYR F OH 1 +ATOM 28461 N N . GLU F 1 8 ? 5.738 -50.854 37.277 1.00 55.81 ? 8 GLU F N 1 +ATOM 28462 C CA . GLU F 1 8 ? 5.911 -50.655 35.840 1.00 56.68 ? 8 GLU F CA 1 +ATOM 28463 C C . GLU F 1 8 ? 4.705 -51.129 35.042 1.00 55.38 ? 8 GLU F C 1 +ATOM 28464 O O . GLU F 1 8 ? 3.941 -51.975 35.493 1.00 54.85 ? 8 GLU F O 1 +ATOM 28465 C CB . GLU F 1 8 ? 7.185 -51.382 35.376 1.00 60.09 ? 8 GLU F CB 1 +ATOM 28466 C CG . GLU F 1 8 ? 7.134 -52.065 33.993 1.00 65.93 ? 8 GLU F CG 1 +ATOM 28467 C CD . GLU F 1 8 ? 7.291 -51.099 32.821 1.00 69.69 ? 8 GLU F CD 1 +ATOM 28468 O OE1 . GLU F 1 8 ? 8.217 -50.253 32.866 1.00 72.01 ? 8 GLU F OE1 1 +ATOM 28469 O OE2 . GLU F 1 8 ? 6.503 -51.195 31.847 1.00 70.83 ? 8 GLU F OE2 1 +ATOM 28470 N N . ASN F 1 9 ? 4.534 -50.559 33.856 1.00 54.76 ? 9 ASN F N 1 +ATOM 28471 C CA . ASN F 1 9 ? 3.437 -50.923 32.976 1.00 55.17 ? 9 ASN F CA 1 +ATOM 28472 C C . ASN F 1 9 ? 3.502 -50.165 31.659 1.00 54.63 ? 9 ASN F C 1 +ATOM 28473 O O . ASN F 1 9 ? 3.227 -48.965 31.604 1.00 54.69 ? 9 ASN F O 1 +ATOM 28474 C CB . ASN F 1 9 ? 2.081 -50.650 33.631 1.00 56.76 ? 9 ASN F CB 1 +ATOM 28475 C CG . ASN F 1 9 ? 0.920 -51.063 32.737 1.00 58.43 ? 9 ASN F CG 1 +ATOM 28476 O OD1 . ASN F 1 9 ? 0.756 -52.244 32.422 1.00 58.76 ? 9 ASN F OD1 1 +ATOM 28477 N ND2 . ASN F 1 9 ? 0.123 -50.089 32.309 1.00 59.45 ? 9 ASN F ND2 1 +ATOM 28478 N N . LYS F 1 10 ? 3.867 -50.876 30.600 1.00 53.64 ? 10 LYS F N 1 +ATOM 28479 C CA . LYS F 1 10 ? 3.947 -50.281 29.277 1.00 52.61 ? 10 LYS F CA 1 +ATOM 28480 C C . LYS F 1 10 ? 4.674 -48.942 29.290 1.00 50.46 ? 10 LYS F C 1 +ATOM 28481 O O . LYS F 1 10 ? 4.085 -47.925 28.940 1.00 50.34 ? 10 LYS F O 1 +ATOM 28482 C CB . LYS F 1 10 ? 2.539 -50.072 28.712 1.00 54.76 ? 10 LYS F CB 1 +ATOM 28483 C CG . LYS F 1 10 ? 1.664 -51.316 28.662 1.00 56.76 ? 10 LYS F CG 1 +ATOM 28484 C CD . LYS F 1 10 ? 0.280 -50.964 28.116 1.00 59.74 ? 10 LYS F CD 1 +ATOM 28485 C CE . LYS F 1 10 ? -0.629 -52.184 28.002 1.00 61.58 ? 10 LYS F CE 1 +ATOM 28486 N NZ . LYS F 1 10 ? -0.984 -52.768 29.332 1.00 63.32 ? 10 LYS F NZ 1 +ATOM 28487 N N . GLY F 1 11 ? 5.937 -48.937 29.713 1.00 47.87 ? 11 GLY F N 1 +ATOM 28488 C CA . GLY F 1 11 ? 6.715 -47.704 29.726 1.00 44.65 ? 11 GLY F CA 1 +ATOM 28489 C C . GLY F 1 11 ? 6.385 -46.631 30.757 1.00 42.29 ? 11 GLY F C 1 +ATOM 28490 O O . GLY F 1 11 ? 6.838 -45.500 30.636 1.00 42.84 ? 11 GLY F O 1 +ATOM 28491 N N . VAL F 1 12 ? 5.598 -46.977 31.767 1.00 40.02 ? 12 VAL F N 1 +ATOM 28492 C CA . VAL F 1 12 ? 5.234 -46.036 32.802 1.00 38.65 ? 12 VAL F CA 1 +ATOM 28493 C C . VAL F 1 12 ? 5.691 -46.562 34.156 1.00 39.61 ? 12 VAL F C 1 +ATOM 28494 O O . VAL F 1 12 ? 5.157 -47.550 34.659 1.00 39.77 ? 12 VAL F O 1 +ATOM 28495 C CB . VAL F 1 12 ? 3.712 -45.826 32.851 1.00 38.28 ? 12 VAL F CB 1 +ATOM 28496 C CG1 . VAL F 1 12 ? 3.349 -44.852 33.967 1.00 37.21 ? 12 VAL F CG1 1 +ATOM 28497 C CG2 . VAL F 1 12 ? 3.225 -45.301 31.521 1.00 38.96 ? 12 VAL F CG2 1 +ATOM 28498 N N . TYR F 1 13 ? 6.686 -45.902 34.737 1.00 39.40 ? 13 TYR F N 1 +ATOM 28499 C CA . TYR F 1 13 ? 7.213 -46.288 36.042 1.00 37.96 ? 13 TYR F CA 1 +ATOM 28500 C C . TYR F 1 13 ? 6.502 -45.480 37.111 1.00 37.76 ? 13 TYR F C 1 +ATOM 28501 O O . TYR F 1 13 ? 6.564 -44.257 37.112 1.00 39.25 ? 13 TYR F O 1 +ATOM 28502 C CB . TYR F 1 13 ? 8.710 -45.995 36.110 1.00 39.09 ? 13 TYR F CB 1 +ATOM 28503 C CG . TYR F 1 13 ? 9.522 -46.782 35.121 1.00 41.92 ? 13 TYR F CG 1 +ATOM 28504 C CD1 . TYR F 1 13 ? 9.796 -48.135 35.333 1.00 44.29 ? 13 TYR F CD1 1 +ATOM 28505 C CD2 . TYR F 1 13 ? 9.978 -46.196 33.947 1.00 43.14 ? 13 TYR F CD2 1 +ATOM 28506 C CE1 . TYR F 1 13 ? 10.503 -48.886 34.393 1.00 45.35 ? 13 TYR F CE1 1 +ATOM 28507 C CE2 . TYR F 1 13 ? 10.687 -46.934 32.996 1.00 45.73 ? 13 TYR F CE2 1 +ATOM 28508 C CZ . TYR F 1 13 ? 10.944 -48.279 33.226 1.00 46.49 ? 13 TYR F CZ 1 +ATOM 28509 O OH . TYR F 1 13 ? 11.635 -49.015 32.285 1.00 48.99 ? 13 TYR F OH 1 +ATOM 28510 N N . LYS F 1 14 ? 5.818 -46.152 38.020 1.00 37.66 ? 14 LYS F N 1 +ATOM 28511 C CA . LYS F 1 14 ? 5.127 -45.451 39.083 1.00 37.48 ? 14 LYS F CA 1 +ATOM 28512 C C . LYS F 1 14 ? 5.988 -45.538 40.338 1.00 39.01 ? 14 LYS F C 1 +ATOM 28513 O O . LYS F 1 14 ? 6.193 -46.626 40.874 1.00 39.51 ? 14 LYS F O 1 +ATOM 28514 C CB . LYS F 1 14 ? 3.763 -46.085 39.342 1.00 35.47 ? 14 LYS F CB 1 +ATOM 28515 C CG . LYS F 1 14 ? 3.015 -45.418 40.465 1.00 37.03 ? 14 LYS F CG 1 +ATOM 28516 C CD . LYS F 1 14 ? 1.631 -45.989 40.662 1.00 38.33 ? 14 LYS F CD 1 +ATOM 28517 C CE . LYS F 1 14 ? 0.916 -45.238 41.776 1.00 39.64 ? 14 LYS F CE 1 +ATOM 28518 N NZ . LYS F 1 14 ? -0.503 -45.643 41.938 1.00 42.40 ? 14 LYS F NZ 1 +ATOM 28519 N N . VAL F 1 15 ? 6.507 -44.398 40.791 1.00 38.55 ? 15 VAL F N 1 +ATOM 28520 C CA . VAL F 1 15 ? 7.345 -44.359 41.980 1.00 37.58 ? 15 VAL F CA 1 +ATOM 28521 C C . VAL F 1 15 ? 6.517 -43.905 43.166 1.00 38.70 ? 15 VAL F C 1 +ATOM 28522 O O . VAL F 1 15 ? 5.927 -42.831 43.152 1.00 40.61 ? 15 VAL F O 1 +ATOM 28523 C CB . VAL F 1 15 ? 8.535 -43.401 41.790 1.00 36.72 ? 15 VAL F CB 1 +ATOM 28524 C CG1 . VAL F 1 15 ? 9.420 -43.411 43.033 1.00 36.27 ? 15 VAL F CG1 1 +ATOM 28525 C CG2 . VAL F 1 15 ? 9.331 -43.810 40.566 1.00 35.33 ? 15 VAL F CG2 1 +ATOM 28526 N N . VAL F 1 16 ? 6.461 -44.738 44.194 1.00 40.07 ? 16 VAL F N 1 +ATOM 28527 C CA . VAL F 1 16 ? 5.701 -44.416 45.395 1.00 40.47 ? 16 VAL F CA 1 +ATOM 28528 C C . VAL F 1 16 ? 6.632 -44.173 46.584 1.00 41.63 ? 16 VAL F C 1 +ATOM 28529 O O . VAL F 1 16 ? 7.407 -45.047 46.964 1.00 39.53 ? 16 VAL F O 1 +ATOM 28530 C CB . VAL F 1 16 ? 4.737 -45.554 45.755 1.00 40.22 ? 16 VAL F CB 1 +ATOM 28531 C CG1 . VAL F 1 16 ? 3.927 -45.178 46.982 1.00 40.47 ? 16 VAL F CG1 1 +ATOM 28532 C CG2 . VAL F 1 16 ? 3.815 -45.848 44.575 1.00 41.35 ? 16 VAL F CG2 1 +ATOM 28533 N N . ILE F 1 17 ? 6.555 -42.975 47.157 1.00 43.53 ? 17 ILE F N 1 +ATOM 28534 C CA . ILE F 1 17 ? 7.369 -42.612 48.306 1.00 43.98 ? 17 ILE F CA 1 +ATOM 28535 C C . ILE F 1 17 ? 6.453 -42.570 49.518 1.00 44.94 ? 17 ILE F C 1 +ATOM 28536 O O . ILE F 1 17 ? 5.510 -41.781 49.557 1.00 45.09 ? 17 ILE F O 1 +ATOM 28537 C CB . ILE F 1 17 ? 8.013 -41.230 48.122 1.00 44.22 ? 17 ILE F CB 1 +ATOM 28538 C CG1 . ILE F 1 17 ? 8.816 -41.200 46.822 1.00 44.26 ? 17 ILE F CG1 1 +ATOM 28539 C CG2 . ILE F 1 17 ? 8.917 -40.915 49.305 1.00 44.25 ? 17 ILE F CG2 1 +ATOM 28540 C CD1 . ILE F 1 17 ? 9.923 -42.229 46.770 1.00 49.02 ? 17 ILE F CD1 1 +ATOM 28541 N N . GLY F 1 18 ? 6.723 -43.432 50.496 1.00 46.13 ? 18 GLY F N 1 +ATOM 28542 C CA . GLY F 1 18 ? 5.905 -43.477 51.696 1.00 46.11 ? 18 GLY F CA 1 +ATOM 28543 C C . GLY F 1 18 ? 4.540 -44.057 51.404 1.00 46.70 ? 18 GLY F C 1 +ATOM 28544 O O . GLY F 1 18 ? 4.415 -44.987 50.625 1.00 46.82 ? 18 GLY F O 1 +ATOM 28545 N N . GLU F 1 19 ? 3.512 -43.502 52.027 1.00 49.41 ? 19 GLU F N 1 +ATOM 28546 C CA . GLU F 1 19 ? 2.147 -43.966 51.824 1.00 53.13 ? 19 GLU F CA 1 +ATOM 28547 C C . GLU F 1 19 ? 1.295 -42.797 51.334 1.00 52.90 ? 19 GLU F C 1 +ATOM 28548 O O . GLU F 1 19 ? 0.561 -42.182 52.104 1.00 54.05 ? 19 GLU F O 1 +ATOM 28549 C CB . GLU F 1 19 ? 1.609 -44.518 53.139 1.00 57.21 ? 19 GLU F CB 1 +ATOM 28550 C CG . GLU F 1 19 ? 2.422 -45.712 53.633 1.00 64.20 ? 19 GLU F CG 1 +ATOM 28551 C CD . GLU F 1 19 ? 2.127 -46.088 55.078 1.00 67.90 ? 19 GLU F CD 1 +ATOM 28552 O OE1 . GLU F 1 19 ? 2.369 -45.241 55.971 1.00 70.00 ? 19 GLU F OE1 1 +ATOM 28553 O OE2 . GLU F 1 19 ? 1.659 -47.229 55.317 1.00 69.13 ? 19 GLU F OE2 1 +ATOM 28554 N N . PRO F 1 20 ? 1.386 -42.483 50.030 1.00 52.12 ? 20 PRO F N 1 +ATOM 28555 C CA . PRO F 1 20 ? 0.662 -41.391 49.375 1.00 50.04 ? 20 PRO F CA 1 +ATOM 28556 C C . PRO F 1 20 ? -0.850 -41.479 49.392 1.00 48.27 ? 20 PRO F C 1 +ATOM 28557 O O . PRO F 1 20 ? -1.426 -42.562 49.377 1.00 48.09 ? 20 PRO F O 1 +ATOM 28558 C CB . PRO F 1 20 ? 1.195 -41.428 47.945 1.00 50.17 ? 20 PRO F CB 1 +ATOM 28559 C CG . PRO F 1 20 ? 2.540 -42.081 48.078 1.00 51.18 ? 20 PRO F CG 1 +ATOM 28560 C CD . PRO F 1 20 ? 2.249 -43.174 49.059 1.00 51.52 ? 20 PRO F CD 1 +ATOM 28561 N N . PHE F 1 21 ? -1.477 -40.310 49.424 1.00 46.75 ? 21 PHE F N 1 +ATOM 28562 C CA . PHE F 1 21 ? -2.928 -40.176 49.380 1.00 44.85 ? 21 PHE F CA 1 +ATOM 28563 C C . PHE F 1 21 ? -3.128 -39.142 48.262 1.00 43.04 ? 21 PHE F C 1 +ATOM 28564 O O . PHE F 1 21 ? -3.292 -37.954 48.521 1.00 43.20 ? 21 PHE F O 1 +ATOM 28565 C CB . PHE F 1 21 ? -3.455 -39.636 50.704 1.00 43.52 ? 21 PHE F CB 1 +ATOM 28566 C CG . PHE F 1 21 ? -4.934 -39.742 50.849 1.00 43.17 ? 21 PHE F CG 1 +ATOM 28567 C CD1 . PHE F 1 21 ? -5.531 -40.974 51.082 1.00 42.85 ? 21 PHE F CD1 1 +ATOM 28568 C CD2 . PHE F 1 21 ? -5.743 -38.609 50.740 1.00 43.95 ? 21 PHE F CD2 1 +ATOM 28569 C CE1 . PHE F 1 21 ? -6.914 -41.084 51.207 1.00 42.64 ? 21 PHE F CE1 1 +ATOM 28570 C CE2 . PHE F 1 21 ? -7.131 -38.704 50.863 1.00 42.85 ? 21 PHE F CE2 1 +ATOM 28571 C CZ . PHE F 1 21 ? -7.716 -39.945 51.097 1.00 44.01 ? 21 PHE F CZ 1 +ATOM 28572 N N . PRO F 1 22 ? -3.097 -39.592 46.997 1.00 42.22 ? 22 PRO F N 1 +ATOM 28573 C CA . PRO F 1 22 ? -3.255 -38.754 45.800 1.00 40.45 ? 22 PRO F CA 1 +ATOM 28574 C C . PRO F 1 22 ? -4.529 -37.929 45.775 1.00 38.57 ? 22 PRO F C 1 +ATOM 28575 O O . PRO F 1 22 ? -5.560 -38.352 46.304 1.00 37.78 ? 22 PRO F O 1 +ATOM 28576 C CB . PRO F 1 22 ? -3.235 -39.761 44.652 1.00 41.70 ? 22 PRO F CB 1 +ATOM 28577 C CG . PRO F 1 22 ? -2.569 -40.972 45.234 1.00 44.09 ? 22 PRO F CG 1 +ATOM 28578 C CD . PRO F 1 22 ? -3.109 -41.017 46.632 1.00 42.65 ? 22 PRO F CD 1 +ATOM 28579 N N . PRO F 1 23 ? -4.474 -36.739 45.154 1.00 37.93 ? 23 PRO F N 1 +ATOM 28580 C CA . PRO F 1 23 ? -5.651 -35.867 45.068 1.00 38.91 ? 23 PRO F CA 1 +ATOM 28581 C C . PRO F 1 23 ? -6.714 -36.580 44.250 1.00 39.21 ? 23 PRO F C 1 +ATOM 28582 O O . PRO F 1 23 ? -7.912 -36.356 44.408 1.00 39.60 ? 23 PRO F O 1 +ATOM 28583 C CB . PRO F 1 23 ? -5.110 -34.626 44.372 1.00 38.40 ? 23 PRO F CB 1 +ATOM 28584 C CG . PRO F 1 23 ? -3.999 -35.174 43.528 1.00 38.61 ? 23 PRO F CG 1 +ATOM 28585 C CD . PRO F 1 23 ? -3.327 -36.141 44.449 1.00 36.43 ? 23 PRO F CD 1 +ATOM 28586 N N . ILE F 1 24 ? -6.250 -37.454 43.372 1.00 40.02 ? 24 ILE F N 1 +ATOM 28587 C CA . ILE F 1 24 ? -7.129 -38.251 42.535 1.00 41.88 ? 24 ILE F CA 1 +ATOM 28588 C C . ILE F 1 24 ? -6.345 -39.504 42.182 1.00 43.26 ? 24 ILE F C 1 +ATOM 28589 O O . ILE F 1 24 ? -5.122 -39.457 42.013 1.00 42.18 ? 24 ILE F O 1 +ATOM 28590 C CB . ILE F 1 24 ? -7.540 -37.506 41.239 1.00 41.88 ? 24 ILE F CB 1 +ATOM 28591 C CG1 . ILE F 1 24 ? -8.433 -38.418 40.395 1.00 42.32 ? 24 ILE F CG1 1 +ATOM 28592 C CG2 . ILE F 1 24 ? -6.303 -37.065 40.459 1.00 38.88 ? 24 ILE F CG2 1 +ATOM 28593 C CD1 . ILE F 1 24 ? -9.103 -37.724 39.223 1.00 44.19 ? 24 ILE F CD1 1 +ATOM 28594 N N . GLU F 1 25 ? -7.042 -40.628 42.092 1.00 44.99 ? 25 GLU F N 1 +ATOM 28595 C CA . GLU F 1 25 ? -6.384 -41.878 41.768 1.00 48.55 ? 25 GLU F CA 1 +ATOM 28596 C C . GLU F 1 25 ? -6.464 -42.207 40.285 1.00 49.85 ? 25 GLU F C 1 +ATOM 28597 O O . GLU F 1 25 ? -7.544 -42.236 39.697 1.00 49.72 ? 25 GLU F O 1 +ATOM 28598 C CB . GLU F 1 25 ? -6.986 -43.018 42.589 1.00 49.26 ? 25 GLU F CB 1 +ATOM 28599 C CG . GLU F 1 25 ? -6.752 -42.879 44.083 1.00 53.54 ? 25 GLU F CG 1 +ATOM 28600 C CD . GLU F 1 25 ? -7.342 -44.023 44.878 1.00 56.97 ? 25 GLU F CD 1 +ATOM 28601 O OE1 . GLU F 1 25 ? -8.578 -44.221 44.801 1.00 58.09 ? 25 GLU F OE1 1 +ATOM 28602 O OE2 . GLU F 1 25 ? -6.569 -44.723 45.576 1.00 58.26 ? 25 GLU F OE2 1 +ATOM 28603 N N . PHE F 1 26 ? -5.303 -42.435 39.686 1.00 51.57 ? 26 PHE F N 1 +ATOM 28604 C CA . PHE F 1 26 ? -5.221 -42.788 38.282 1.00 54.69 ? 26 PHE F CA 1 +ATOM 28605 C C . PHE F 1 26 ? -4.939 -44.287 38.223 1.00 58.66 ? 26 PHE F C 1 +ATOM 28606 O O . PHE F 1 26 ? -3.861 -44.744 38.595 1.00 57.47 ? 26 PHE F O 1 +ATOM 28607 C CB . PHE F 1 26 ? -4.107 -41.986 37.608 1.00 52.19 ? 26 PHE F CB 1 +ATOM 28608 C CG . PHE F 1 26 ? -4.385 -40.510 37.542 1.00 49.84 ? 26 PHE F CG 1 +ATOM 28609 C CD1 . PHE F 1 26 ? -5.504 -40.035 36.864 1.00 48.40 ? 26 PHE F CD1 1 +ATOM 28610 C CD2 . PHE F 1 26 ? -3.543 -39.598 38.172 1.00 48.76 ? 26 PHE F CD2 1 +ATOM 28611 C CE1 . PHE F 1 26 ? -5.784 -38.677 36.812 1.00 47.97 ? 26 PHE F CE1 1 +ATOM 28612 C CE2 . PHE F 1 26 ? -3.808 -38.236 38.131 1.00 48.15 ? 26 PHE F CE2 1 +ATOM 28613 C CZ . PHE F 1 26 ? -4.932 -37.771 37.449 1.00 49.54 ? 26 PHE F CZ 1 +ATOM 28614 N N . PRO F 1 27 ? -5.924 -45.081 37.784 1.00 63.18 ? 27 PRO F N 1 +ATOM 28615 C CA . PRO F 1 27 ? -5.726 -46.531 37.707 1.00 66.52 ? 27 PRO F CA 1 +ATOM 28616 C C . PRO F 1 27 ? -4.653 -46.992 36.713 1.00 69.17 ? 27 PRO F C 1 +ATOM 28617 O O . PRO F 1 27 ? -4.706 -46.662 35.529 1.00 69.28 ? 27 PRO F O 1 +ATOM 28618 C CB . PRO F 1 27 ? -7.123 -47.043 37.348 1.00 66.45 ? 27 PRO F CB 1 +ATOM 28619 C CG . PRO F 1 27 ? -7.670 -45.935 36.489 1.00 65.56 ? 27 PRO F CG 1 +ATOM 28620 C CD . PRO F 1 27 ? -7.253 -44.699 37.264 1.00 64.84 ? 27 PRO F CD 1 +ATOM 28621 N N . LEU F 1 28 ? -3.674 -47.742 37.215 1.00 72.18 ? 28 LEU F N 1 +ATOM 28622 C CA . LEU F 1 28 ? -2.596 -48.289 36.392 1.00 75.31 ? 28 LEU F CA 1 +ATOM 28623 C C . LEU F 1 28 ? -2.830 -49.794 36.386 1.00 76.85 ? 28 LEU F C 1 +ATOM 28624 O O . LEU F 1 28 ? -2.554 -50.465 37.377 1.00 77.22 ? 28 LEU F O 1 +ATOM 28625 C CB . LEU F 1 28 ? -1.224 -47.979 37.007 1.00 75.41 ? 28 LEU F CB 1 +ATOM 28626 C CG . LEU F 1 28 ? 0.014 -48.409 36.205 1.00 76.24 ? 28 LEU F CG 1 +ATOM 28627 C CD1 . LEU F 1 28 ? 0.092 -47.601 34.914 1.00 76.00 ? 28 LEU F CD1 1 +ATOM 28628 C CD2 . LEU F 1 28 ? 1.279 -48.193 37.028 1.00 75.86 ? 28 LEU F CD2 1 +ATOM 28629 N N . GLU F 1 29 ? -3.340 -50.309 35.269 1.00 79.70 ? 29 GLU F N 1 +ATOM 28630 C CA . GLU F 1 29 ? -3.673 -51.732 35.099 1.00 82.30 ? 29 GLU F CA 1 +ATOM 28631 C C . GLU F 1 29 ? -2.668 -52.793 35.573 1.00 82.73 ? 29 GLU F C 1 +ATOM 28632 O O . GLU F 1 29 ? -2.397 -52.920 36.770 1.00 83.39 ? 29 GLU F O 1 +ATOM 28633 C CB . GLU F 1 29 ? -4.023 -52.000 33.633 1.00 83.50 ? 29 GLU F CB 1 +ATOM 28634 C CG . GLU F 1 29 ? -5.184 -51.164 33.124 1.00 85.91 ? 29 GLU F CG 1 +ATOM 28635 C CD . GLU F 1 29 ? -5.811 -51.750 31.877 1.00 87.21 ? 29 GLU F CD 1 +ATOM 28636 O OE1 . GLU F 1 29 ? -6.329 -52.886 31.958 1.00 87.49 ? 29 GLU F OE1 1 +ATOM 28637 O OE2 . GLU F 1 29 ? -5.787 -51.079 30.821 1.00 87.96 ? 29 GLU F OE2 1 +ATOM 28638 N N . GLN F 1 30 ? -2.145 -53.576 34.634 1.00 82.47 ? 30 GLN F N 1 +ATOM 28639 C CA . GLN F 1 30 ? -1.183 -54.625 34.968 1.00 81.93 ? 30 GLN F CA 1 +ATOM 28640 C C . GLN F 1 30 ? 0.086 -54.028 35.577 1.00 80.86 ? 30 GLN F C 1 +ATOM 28641 O O . GLN F 1 30 ? 1.061 -53.762 34.873 1.00 81.26 ? 30 GLN F O 1 +ATOM 28642 C CB . GLN F 1 30 ? -0.830 -55.441 33.717 1.00 82.40 ? 30 GLN F CB 1 +ATOM 28643 C CG . GLN F 1 30 ? -2.013 -56.174 33.094 1.00 82.71 ? 30 GLN F CG 1 +ATOM 28644 C CD . GLN F 1 30 ? -1.618 -57.025 31.894 1.00 83.02 ? 30 GLN F CD 1 +ATOM 28645 O OE1 . GLN F 1 30 ? -2.460 -57.689 31.284 1.00 82.98 ? 30 GLN F OE1 1 +ATOM 28646 N NE2 . GLN F 1 30 ? -0.335 -57.007 31.552 1.00 82.42 ? 30 GLN F NE2 1 +ATOM 28647 N N . LYS F 1 31 ? 0.062 -53.828 36.892 1.00 79.61 ? 31 LYS F N 1 +ATOM 28648 C CA . LYS F 1 31 ? 1.190 -53.255 37.624 1.00 78.13 ? 31 LYS F CA 1 +ATOM 28649 C C . LYS F 1 31 ? 2.494 -54.069 37.561 1.00 76.50 ? 31 LYS F C 1 +ATOM 28650 O O . LYS F 1 31 ? 3.176 -54.067 36.540 1.00 77.62 ? 31 LYS F O 1 +ATOM 28651 C CB . LYS F 1 31 ? 0.795 -53.035 39.087 1.00 78.12 ? 31 LYS F CB 1 +ATOM 28652 C CG . LYS F 1 31 ? 0.327 -54.299 39.791 1.00 77.92 ? 31 LYS F CG 1 +ATOM 28653 C CD . LYS F 1 31 ? 0.046 -54.040 41.254 1.00 78.47 ? 31 LYS F CD 1 +ATOM 28654 C CE . LYS F 1 31 ? -0.384 -55.314 41.962 1.00 79.26 ? 31 LYS F CE 1 +ATOM 28655 N NZ . LYS F 1 31 ? -0.819 -55.057 43.367 1.00 79.65 ? 31 LYS F NZ 1 +ATOM 28656 N N . ILE F 1 32 ? 2.815 -54.761 38.657 1.00 73.50 ? 32 ILE F N 1 +ATOM 28657 C CA . ILE F 1 32 ? 4.035 -55.575 38.830 1.00 70.78 ? 32 ILE F CA 1 +ATOM 28658 C C . ILE F 1 32 ? 5.201 -54.671 39.223 1.00 67.88 ? 32 ILE F C 1 +ATOM 28659 O O . ILE F 1 32 ? 5.365 -53.588 38.662 1.00 67.25 ? 32 ILE F O 1 +ATOM 28660 C CB . ILE F 1 32 ? 4.463 -56.389 37.547 1.00 70.72 ? 32 ILE F CB 1 +ATOM 28661 C CG1 . ILE F 1 32 ? 5.363 -55.538 36.643 1.00 68.80 ? 32 ILE F CG1 1 +ATOM 28662 C CG2 . ILE F 1 32 ? 3.232 -56.894 36.801 1.00 70.04 ? 32 ILE F CG2 1 +ATOM 28663 C CD1 . ILE F 1 32 ? 6.069 -56.315 35.562 1.00 67.86 ? 32 ILE F CD1 1 +ATOM 28664 N N . SER F 1 33 ? 6.008 -55.110 40.184 1.00 64.69 ? 33 SER F N 1 +ATOM 28665 C CA . SER F 1 33 ? 7.140 -54.302 40.622 1.00 62.71 ? 33 SER F CA 1 +ATOM 28666 C C . SER F 1 33 ? 8.201 -54.220 39.536 1.00 61.34 ? 33 SER F C 1 +ATOM 28667 O O . SER F 1 33 ? 8.333 -55.121 38.719 1.00 60.27 ? 33 SER F O 1 +ATOM 28668 C CB . SER F 1 33 ? 7.738 -54.861 41.917 1.00 62.36 ? 33 SER F CB 1 +ATOM 28669 O OG . SER F 1 33 ? 8.079 -56.222 41.774 1.00 63.21 ? 33 SER F OG 1 +ATOM 28670 N N . SER F 1 34 ? 8.948 -53.123 39.534 1.00 61.56 ? 34 SER F N 1 +ATOM 28671 C CA . SER F 1 34 ? 9.983 -52.882 38.539 1.00 62.68 ? 34 SER F CA 1 +ATOM 28672 C C . SER F 1 34 ? 11.369 -53.357 38.938 1.00 64.62 ? 34 SER F C 1 +ATOM 28673 O O . SER F 1 34 ? 11.754 -53.278 40.102 1.00 65.97 ? 34 SER F O 1 +ATOM 28674 C CB . SER F 1 34 ? 10.052 -51.388 38.221 1.00 61.43 ? 34 SER F CB 1 +ATOM 28675 O OG . SER F 1 34 ? 11.254 -51.062 37.543 1.00 59.38 ? 34 SER F OG 1 +ATOM 28676 N N . ASN F 1 35 ? 12.121 -53.840 37.956 1.00 65.92 ? 35 ASN F N 1 +ATOM 28677 C CA . ASN F 1 35 ? 13.484 -54.301 38.191 1.00 67.78 ? 35 ASN F CA 1 +ATOM 28678 C C . ASN F 1 35 ? 14.400 -53.086 38.066 1.00 67.31 ? 35 ASN F C 1 +ATOM 28679 O O . ASN F 1 35 ? 15.626 -53.197 38.133 1.00 68.18 ? 35 ASN F O 1 +ATOM 28680 C CB . ASN F 1 35 ? 13.869 -55.358 37.155 1.00 69.56 ? 35 ASN F CB 1 +ATOM 28681 C CG . ASN F 1 35 ? 12.893 -56.522 37.124 1.00 72.74 ? 35 ASN F CG 1 +ATOM 28682 O OD1 . ASN F 1 35 ? 12.785 -57.280 38.094 1.00 72.85 ? 35 ASN F OD1 1 +ATOM 28683 N ND2 . ASN F 1 35 ? 12.166 -56.663 36.012 1.00 72.45 ? 35 ASN F ND2 1 +ATOM 28684 N N . LYS F 1 36 ? 13.786 -51.923 37.875 1.00 65.92 ? 36 LYS F N 1 +ATOM 28685 C CA . LYS F 1 36 ? 14.530 -50.685 37.745 1.00 64.85 ? 36 LYS F CA 1 +ATOM 28686 C C . LYS F 1 36 ? 14.795 -50.074 39.106 1.00 62.99 ? 36 LYS F C 1 +ATOM 28687 O O . LYS F 1 36 ? 14.094 -50.353 40.075 1.00 62.51 ? 36 LYS F O 1 +ATOM 28688 C CB . LYS F 1 36 ? 13.762 -49.684 36.880 1.00 66.81 ? 36 LYS F CB 1 +ATOM 28689 C CG . LYS F 1 36 ? 13.744 -50.032 35.405 1.00 69.21 ? 36 LYS F CG 1 +ATOM 28690 C CD . LYS F 1 36 ? 15.163 -50.162 34.866 1.00 70.48 ? 36 LYS F CD 1 +ATOM 28691 C CE . LYS F 1 36 ? 15.164 -50.211 33.353 1.00 71.22 ? 36 LYS F CE 1 +ATOM 28692 N NZ . LYS F 1 36 ? 14.543 -48.979 32.794 1.00 71.89 ? 36 LYS F NZ 1 +ATOM 28693 N N . SER F 1 37 ? 15.824 -49.242 39.168 1.00 61.42 ? 37 SER F N 1 +ATOM 28694 C CA . SER F 1 37 ? 16.196 -48.570 40.401 1.00 59.98 ? 37 SER F CA 1 +ATOM 28695 C C . SER F 1 37 ? 16.181 -47.060 40.158 1.00 59.34 ? 37 SER F C 1 +ATOM 28696 O O . SER F 1 37 ? 16.192 -46.607 39.010 1.00 58.29 ? 37 SER F O 1 +ATOM 28697 C CB . SER F 1 37 ? 17.597 -49.010 40.836 1.00 59.14 ? 37 SER F CB 1 +ATOM 28698 O OG . SER F 1 37 ? 18.577 -48.612 39.889 1.00 57.05 ? 37 SER F OG 1 +ATOM 28699 N N . LEU F 1 38 ? 16.145 -46.287 41.239 1.00 58.19 ? 38 LEU F N 1 +ATOM 28700 C CA . LEU F 1 38 ? 16.155 -44.835 41.131 1.00 56.00 ? 38 LEU F CA 1 +ATOM 28701 C C . LEU F 1 38 ? 17.429 -44.380 40.429 1.00 55.49 ? 38 LEU F C 1 +ATOM 28702 O O . LEU F 1 38 ? 17.377 -43.563 39.513 1.00 55.29 ? 38 LEU F O 1 +ATOM 28703 C CB . LEU F 1 38 ? 16.070 -44.201 42.524 1.00 54.56 ? 38 LEU F CB 1 +ATOM 28704 C CG . LEU F 1 38 ? 14.690 -43.859 43.108 1.00 53.37 ? 38 LEU F CG 1 +ATOM 28705 C CD1 . LEU F 1 38 ? 13.575 -44.568 42.361 1.00 51.70 ? 38 LEU F CD1 1 +ATOM 28706 C CD2 . LEU F 1 38 ? 14.683 -44.222 44.587 1.00 52.09 ? 38 LEU F CD2 1 +ATOM 28707 N N . SER F 1 39 ? 18.571 -44.918 40.848 1.00 55.42 ? 39 SER F N 1 +ATOM 28708 C CA . SER F 1 39 ? 19.843 -44.536 40.247 1.00 55.43 ? 39 SER F CA 1 +ATOM 28709 C C . SER F 1 39 ? 19.799 -44.802 38.756 1.00 54.97 ? 39 SER F C 1 +ATOM 28710 O O . SER F 1 39 ? 20.286 -43.995 37.967 1.00 55.60 ? 39 SER F O 1 +ATOM 28711 C CB . SER F 1 39 ? 21.002 -45.301 40.886 1.00 56.75 ? 39 SER F CB 1 +ATOM 28712 O OG . SER F 1 39 ? 22.253 -44.792 40.455 1.00 58.21 ? 39 SER F OG 1 +ATOM 28713 N N . GLU F 1 40 ? 19.230 -45.939 38.368 1.00 54.58 ? 40 GLU F N 1 +ATOM 28714 C CA . GLU F 1 40 ? 19.101 -46.250 36.946 1.00 55.17 ? 40 GLU F CA 1 +ATOM 28715 C C . GLU F 1 40 ? 18.201 -45.172 36.365 1.00 53.18 ? 40 GLU F C 1 +ATOM 28716 O O . GLU F 1 40 ? 18.483 -44.601 35.311 1.00 52.63 ? 40 GLU F O 1 +ATOM 28717 C CB . GLU F 1 40 ? 18.419 -47.607 36.716 1.00 57.24 ? 40 GLU F CB 1 +ATOM 28718 C CG . GLU F 1 40 ? 19.330 -48.822 36.728 1.00 62.07 ? 40 GLU F CG 1 +ATOM 28719 C CD . GLU F 1 40 ? 18.566 -50.119 36.455 1.00 65.05 ? 40 GLU F CD 1 +ATOM 28720 O OE1 . GLU F 1 40 ? 17.805 -50.569 37.343 1.00 67.02 ? 40 GLU F OE1 1 +ATOM 28721 O OE2 . GLU F 1 40 ? 18.717 -50.686 35.347 1.00 66.31 ? 40 GLU F OE2 1 +ATOM 28722 N N . LEU F 1 41 ? 17.116 -44.896 37.080 1.00 51.64 ? 41 LEU F N 1 +ATOM 28723 C CA . LEU F 1 41 ? 16.151 -43.903 36.642 1.00 50.23 ? 41 LEU F CA 1 +ATOM 28724 C C . LEU F 1 41 ? 16.754 -42.500 36.676 1.00 49.76 ? 41 LEU F C 1 +ATOM 28725 O O . LEU F 1 41 ? 16.161 -41.553 36.176 1.00 49.53 ? 41 LEU F O 1 +ATOM 28726 C CB . LEU F 1 41 ? 14.903 -43.979 37.526 1.00 49.56 ? 41 LEU F CB 1 +ATOM 28727 C CG . LEU F 1 41 ? 13.561 -44.330 36.874 1.00 50.12 ? 41 LEU F CG 1 +ATOM 28728 C CD1 . LEU F 1 41 ? 13.741 -45.295 35.721 1.00 49.04 ? 41 LEU F CD1 1 +ATOM 28729 C CD2 . LEU F 1 41 ? 12.644 -44.925 37.936 1.00 50.16 ? 41 LEU F CD2 1 +ATOM 28730 N N . GLY F 1 42 ? 17.942 -42.374 37.260 1.00 49.54 ? 42 GLY F N 1 +ATOM 28731 C CA . GLY F 1 42 ? 18.598 -41.079 37.344 1.00 47.74 ? 42 GLY F CA 1 +ATOM 28732 C C . GLY F 1 42 ? 17.972 -40.118 38.346 1.00 46.92 ? 42 GLY F C 1 +ATOM 28733 O O . GLY F 1 42 ? 18.079 -38.904 38.192 1.00 45.86 ? 42 GLY F O 1 +ATOM 28734 N N . LEU F 1 43 ? 17.340 -40.655 39.384 1.00 45.57 ? 43 LEU F N 1 +ATOM 28735 C CA . LEU F 1 43 ? 16.695 -39.830 40.390 1.00 46.48 ? 43 LEU F CA 1 +ATOM 28736 C C . LEU F 1 43 ? 17.275 -40.004 41.781 1.00 47.70 ? 43 LEU F C 1 +ATOM 28737 O O . LEU F 1 43 ? 17.807 -41.056 42.124 1.00 49.39 ? 43 LEU F O 1 +ATOM 28738 C CB . LEU F 1 43 ? 15.202 -40.152 40.442 1.00 45.55 ? 43 LEU F CB 1 +ATOM 28739 C CG . LEU F 1 43 ? 14.430 -39.989 39.133 1.00 45.46 ? 43 LEU F CG 1 +ATOM 28740 C CD1 . LEU F 1 43 ? 12.996 -40.420 39.338 1.00 45.10 ? 43 LEU F CD1 1 +ATOM 28741 C CD2 . LEU F 1 43 ? 14.492 -38.539 38.674 1.00 44.38 ? 43 LEU F CD2 1 +ATOM 28742 N N . THR F 1 44 ? 17.162 -38.950 42.576 1.00 48.50 ? 44 THR F N 1 +ATOM 28743 C CA . THR F 1 44 ? 17.621 -38.940 43.955 1.00 48.80 ? 44 THR F CA 1 +ATOM 28744 C C . THR F 1 44 ? 16.396 -38.492 44.731 1.00 49.71 ? 44 THR F C 1 +ATOM 28745 O O . THR F 1 44 ? 15.696 -37.585 44.302 1.00 49.95 ? 44 THR F O 1 +ATOM 28746 C CB . THR F 1 44 ? 18.754 -37.923 44.161 1.00 48.84 ? 44 THR F CB 1 +ATOM 28747 O OG1 . THR F 1 44 ? 19.928 -38.380 43.479 1.00 49.50 ? 44 THR F OG1 1 +ATOM 28748 C CG2 . THR F 1 44 ? 19.052 -37.739 45.644 1.00 48.81 ? 44 THR F CG2 1 +ATOM 28749 N N . ILE F 1 45 ? 16.124 -39.124 45.863 1.00 50.30 ? 45 ILE F N 1 +ATOM 28750 C CA . ILE F 1 45 ? 14.962 -38.750 46.644 1.00 50.59 ? 45 ILE F CA 1 +ATOM 28751 C C . ILE F 1 45 ? 15.301 -38.560 48.110 1.00 52.11 ? 45 ILE F C 1 +ATOM 28752 O O . ILE F 1 45 ? 16.081 -39.320 48.685 1.00 53.34 ? 45 ILE F O 1 +ATOM 28753 C CB . ILE F 1 45 ? 13.861 -39.805 46.487 1.00 50.06 ? 45 ILE F CB 1 +ATOM 28754 C CG1 . ILE F 1 45 ? 13.455 -39.879 45.013 1.00 49.44 ? 45 ILE F CG1 1 +ATOM 28755 C CG2 . ILE F 1 45 ? 12.676 -39.476 47.383 1.00 49.22 ? 45 ILE F CG2 1 +ATOM 28756 C CD1 . ILE F 1 45 ? 12.379 -40.887 44.721 1.00 51.45 ? 45 ILE F CD1 1 +ATOM 28757 N N . VAL F 1 46 ? 14.713 -37.528 48.703 1.00 53.54 ? 46 VAL F N 1 +ATOM 28758 C CA . VAL F 1 46 ? 14.937 -37.208 50.101 1.00 54.50 ? 46 VAL F CA 1 +ATOM 28759 C C . VAL F 1 46 ? 13.616 -36.911 50.793 1.00 56.55 ? 46 VAL F C 1 +ATOM 28760 O O . VAL F 1 46 ? 12.753 -36.241 50.234 1.00 55.73 ? 46 VAL F O 1 +ATOM 28761 C CB . VAL F 1 46 ? 15.856 -35.977 50.239 1.00 53.75 ? 46 VAL F CB 1 +ATOM 28762 C CG1 . VAL F 1 46 ? 15.978 -35.573 51.704 1.00 53.50 ? 46 VAL F CG1 1 +ATOM 28763 C CG2 . VAL F 1 46 ? 17.217 -36.284 49.658 1.00 52.73 ? 46 VAL F CG2 1 +ATOM 28764 N N . GLN F 1 47 ? 13.463 -37.428 52.008 1.00 59.41 ? 47 GLN F N 1 +ATOM 28765 C CA . GLN F 1 47 ? 12.268 -37.194 52.805 1.00 62.16 ? 47 GLN F CA 1 +ATOM 28766 C C . GLN F 1 47 ? 12.678 -36.427 54.049 1.00 63.82 ? 47 GLN F C 1 +ATOM 28767 O O . GLN F 1 47 ? 13.530 -36.880 54.801 1.00 63.83 ? 47 GLN F O 1 +ATOM 28768 C CB . GLN F 1 47 ? 11.618 -38.511 53.210 1.00 62.78 ? 47 GLN F CB 1 +ATOM 28769 C CG . GLN F 1 47 ? 10.734 -39.114 52.146 1.00 65.12 ? 47 GLN F CG 1 +ATOM 28770 C CD . GLN F 1 47 ? 10.064 -40.394 52.613 1.00 67.34 ? 47 GLN F CD 1 +ATOM 28771 O OE1 . GLN F 1 47 ? 10.707 -41.440 52.715 1.00 67.93 ? 47 GLN F OE1 1 +ATOM 28772 N NE2 . GLN F 1 47 ? 8.766 -40.315 52.913 1.00 67.87 ? 47 GLN F NE2 1 +ATOM 28773 N N . GLN F 1 48 ? 12.077 -35.260 54.256 1.00 66.45 ? 48 GLN F N 1 +ATOM 28774 C CA . GLN F 1 48 ? 12.392 -34.433 55.411 1.00 68.00 ? 48 GLN F CA 1 +ATOM 28775 C C . GLN F 1 48 ? 11.151 -34.000 56.178 1.00 68.77 ? 48 GLN F C 1 +ATOM 28776 O O . GLN F 1 48 ? 10.161 -34.736 56.266 1.00 68.92 ? 48 GLN F O 1 +ATOM 28777 C CB . GLN F 1 48 ? 13.175 -33.198 54.969 1.00 69.41 ? 48 GLN F CB 1 +ATOM 28778 C CG . GLN F 1 48 ? 14.557 -33.511 54.430 1.00 71.87 ? 48 GLN F CG 1 +ATOM 28779 C CD . GLN F 1 48 ? 15.288 -32.269 53.955 1.00 73.92 ? 48 GLN F CD 1 +ATOM 28780 O OE1 . GLN F 1 48 ? 16.442 -32.341 53.525 1.00 74.50 ? 48 GLN F OE1 1 +ATOM 28781 N NE2 . GLN F 1 48 ? 14.618 -31.118 54.028 1.00 74.43 ? 48 GLN F NE2 1 +ATOM 28782 N N . GLY F 1 49 ? 11.216 -32.794 56.733 1.00 68.61 ? 49 GLY F N 1 +ATOM 28783 C CA . GLY F 1 49 ? 10.102 -32.271 57.495 1.00 67.85 ? 49 GLY F CA 1 +ATOM 28784 C C . GLY F 1 49 ? 8.836 -32.184 56.671 1.00 66.78 ? 49 GLY F C 1 +ATOM 28785 O O . GLY F 1 49 ? 8.502 -31.117 56.150 1.00 67.27 ? 49 GLY F O 1 +ATOM 28786 N N . ASN F 1 50 ? 8.130 -33.304 56.554 1.00 64.43 ? 50 ASN F N 1 +ATOM 28787 C CA . ASN F 1 50 ? 6.889 -33.345 55.793 1.00 62.60 ? 50 ASN F CA 1 +ATOM 28788 C C . ASN F 1 50 ? 7.062 -32.892 54.350 1.00 58.99 ? 50 ASN F C 1 +ATOM 28789 O O . ASN F 1 50 ? 6.155 -32.310 53.768 1.00 57.86 ? 50 ASN F O 1 +ATOM 28790 C CB . ASN F 1 50 ? 5.822 -32.481 56.472 1.00 65.71 ? 50 ASN F CB 1 +ATOM 28791 C CG . ASN F 1 50 ? 5.265 -33.125 57.727 1.00 69.17 ? 50 ASN F CG 1 +ATOM 28792 O OD1 . ASN F 1 50 ? 4.624 -34.179 57.667 1.00 70.50 ? 50 ASN F OD1 1 +ATOM 28793 N ND2 . ASN F 1 50 ? 5.509 -32.496 58.873 1.00 70.81 ? 50 ASN F ND2 1 +ATOM 28794 N N . LYS F 1 51 ? 8.232 -33.150 53.780 1.00 54.91 ? 51 LYS F N 1 +ATOM 28795 C CA . LYS F 1 51 ? 8.487 -32.776 52.401 1.00 52.34 ? 51 LYS F CA 1 +ATOM 28796 C C . LYS F 1 51 ? 9.263 -33.858 51.668 1.00 49.49 ? 51 LYS F C 1 +ATOM 28797 O O . LYS F 1 51 ? 10.020 -34.612 52.270 1.00 48.35 ? 51 LYS F O 1 +ATOM 28798 C CB . LYS F 1 51 ? 9.264 -31.457 52.328 1.00 53.88 ? 51 LYS F CB 1 +ATOM 28799 C CG . LYS F 1 51 ? 8.496 -30.258 52.864 1.00 57.19 ? 51 LYS F CG 1 +ATOM 28800 C CD . LYS F 1 51 ? 9.173 -28.928 52.529 1.00 60.22 ? 51 LYS F CD 1 +ATOM 28801 C CE . LYS F 1 51 ? 10.550 -28.792 53.186 1.00 62.23 ? 51 LYS F CE 1 +ATOM 28802 N NZ . LYS F 1 51 ? 11.544 -29.778 52.669 1.00 63.37 ? 51 LYS F NZ 1 +ATOM 28803 N N . VAL F 1 52 ? 9.052 -33.941 50.361 1.00 46.35 ? 52 VAL F N 1 +ATOM 28804 C CA . VAL F 1 52 ? 9.761 -34.907 49.541 1.00 44.01 ? 52 VAL F CA 1 +ATOM 28805 C C . VAL F 1 52 ? 10.480 -34.124 48.451 1.00 42.00 ? 52 VAL F C 1 +ATOM 28806 O O . VAL F 1 52 ? 9.869 -33.341 47.741 1.00 42.27 ? 52 VAL F O 1 +ATOM 28807 C CB . VAL F 1 52 ? 8.802 -35.932 48.889 1.00 44.48 ? 52 VAL F CB 1 +ATOM 28808 C CG1 . VAL F 1 52 ? 9.574 -36.840 47.940 1.00 42.36 ? 52 VAL F CG1 1 +ATOM 28809 C CG2 . VAL F 1 52 ? 8.123 -36.769 49.961 1.00 44.01 ? 52 VAL F CG2 1 +ATOM 28810 N N . ILE F 1 53 ? 11.785 -34.330 48.336 1.00 40.54 ? 53 ILE F N 1 +ATOM 28811 C CA . ILE F 1 53 ? 12.577 -33.644 47.335 1.00 38.47 ? 53 ILE F CA 1 +ATOM 28812 C C . ILE F 1 53 ? 13.079 -34.660 46.328 1.00 38.77 ? 53 ILE F C 1 +ATOM 28813 O O . ILE F 1 53 ? 13.721 -35.633 46.696 1.00 40.36 ? 53 ILE F O 1 +ATOM 28814 C CB . ILE F 1 53 ? 13.776 -32.939 47.983 1.00 38.97 ? 53 ILE F CB 1 +ATOM 28815 C CG1 . ILE F 1 53 ? 13.279 -32.004 49.090 1.00 40.00 ? 53 ILE F CG1 1 +ATOM 28816 C CG2 . ILE F 1 53 ? 14.559 -32.161 46.938 1.00 37.55 ? 53 ILE F CG2 1 +ATOM 28817 C CD1 . ILE F 1 53 ? 14.387 -31.364 49.890 1.00 42.54 ? 53 ILE F CD1 1 +ATOM 28818 N N . VAL F 1 54 ? 12.778 -34.438 45.056 1.00 38.18 ? 54 VAL F N 1 +ATOM 28819 C CA . VAL F 1 54 ? 13.207 -35.342 44.000 1.00 37.99 ? 54 VAL F CA 1 +ATOM 28820 C C . VAL F 1 54 ? 14.161 -34.602 43.082 1.00 38.31 ? 54 VAL F C 1 +ATOM 28821 O O . VAL F 1 54 ? 13.808 -33.577 42.532 1.00 40.15 ? 54 VAL F O 1 +ATOM 28822 C CB . VAL F 1 54 ? 12.012 -35.847 43.178 1.00 38.06 ? 54 VAL F CB 1 +ATOM 28823 C CG1 . VAL F 1 54 ? 12.498 -36.743 42.072 1.00 36.25 ? 54 VAL F CG1 1 +ATOM 28824 C CG2 . VAL F 1 54 ? 11.034 -36.585 44.074 1.00 35.81 ? 54 VAL F CG2 1 +ATOM 28825 N N . GLU F 1 55 ? 15.370 -35.129 42.926 1.00 39.85 ? 55 GLU F N 1 +ATOM 28826 C CA . GLU F 1 55 ? 16.389 -34.508 42.096 1.00 41.49 ? 55 GLU F CA 1 +ATOM 28827 C C . GLU F 1 55 ? 16.744 -35.303 40.855 1.00 40.63 ? 55 GLU F C 1 +ATOM 28828 O O . GLU F 1 55 ? 16.707 -36.530 40.848 1.00 40.75 ? 55 GLU F O 1 +ATOM 28829 C CB . GLU F 1 55 ? 17.669 -34.277 42.903 1.00 44.65 ? 55 GLU F CB 1 +ATOM 28830 C CG . GLU F 1 55 ? 17.614 -33.095 43.843 1.00 53.34 ? 55 GLU F CG 1 +ATOM 28831 C CD . GLU F 1 55 ? 18.887 -32.946 44.672 1.00 59.13 ? 55 GLU F CD 1 +ATOM 28832 O OE1 . GLU F 1 55 ? 19.996 -33.126 44.102 1.00 61.05 ? 55 GLU F OE1 1 +ATOM 28833 O OE2 . GLU F 1 55 ? 18.774 -32.638 45.888 1.00 60.85 ? 55 GLU F OE2 1 +ATOM 28834 N N . LYS F 1 56 ? 17.106 -34.571 39.810 1.00 38.96 ? 56 LYS F N 1 +ATOM 28835 C CA . LYS F 1 56 ? 17.505 -35.144 38.540 1.00 39.06 ? 56 LYS F CA 1 +ATOM 28836 C C . LYS F 1 56 ? 18.604 -34.220 38.034 1.00 38.83 ? 56 LYS F C 1 +ATOM 28837 O O . LYS F 1 56 ? 18.586 -33.028 38.326 1.00 39.23 ? 56 LYS F O 1 +ATOM 28838 C CB . LYS F 1 56 ? 16.332 -35.122 37.566 1.00 39.65 ? 56 LYS F CB 1 +ATOM 28839 C CG . LYS F 1 56 ? 16.505 -36.025 36.371 1.00 42.42 ? 56 LYS F CG 1 +ATOM 28840 C CD . LYS F 1 56 ? 15.376 -35.836 35.362 1.00 43.49 ? 56 LYS F CD 1 +ATOM 28841 C CE . LYS F 1 56 ? 15.718 -34.753 34.373 1.00 43.57 ? 56 LYS F CE 1 +ATOM 28842 N NZ . LYS F 1 56 ? 16.944 -35.131 33.608 1.00 44.08 ? 56 LYS F NZ 1 +ATOM 28843 N N . SER F 1 57 ? 19.568 -34.750 37.298 1.00 38.93 ? 57 SER F N 1 +ATOM 28844 C CA . SER F 1 57 ? 20.625 -33.893 36.782 1.00 41.41 ? 57 SER F CA 1 +ATOM 28845 C C . SER F 1 57 ? 20.064 -33.163 35.570 1.00 41.89 ? 57 SER F C 1 +ATOM 28846 O O . SER F 1 57 ? 19.049 -33.574 34.994 1.00 41.12 ? 57 SER F O 1 +ATOM 28847 C CB . SER F 1 57 ? 21.843 -34.712 36.360 1.00 41.98 ? 57 SER F CB 1 +ATOM 28848 O OG . SER F 1 57 ? 21.551 -35.459 35.194 1.00 45.47 ? 57 SER F OG 1 +ATOM 28849 N N . LEU F 1 58 ? 20.733 -32.085 35.183 1.00 41.90 ? 58 LEU F N 1 +ATOM 28850 C CA . LEU F 1 58 ? 20.310 -31.284 34.050 1.00 41.34 ? 58 LEU F CA 1 +ATOM 28851 C C . LEU F 1 58 ? 21.544 -30.916 33.250 1.00 43.37 ? 58 LEU F C 1 +ATOM 28852 O O . LEU F 1 58 ? 22.418 -30.210 33.748 1.00 45.35 ? 58 LEU F O 1 +ATOM 28853 C CB . LEU F 1 58 ? 19.624 -30.017 34.550 1.00 40.51 ? 58 LEU F CB 1 +ATOM 28854 C CG . LEU F 1 58 ? 19.065 -29.069 33.496 1.00 40.36 ? 58 LEU F CG 1 +ATOM 28855 C CD1 . LEU F 1 58 ? 17.848 -29.709 32.830 1.00 38.11 ? 58 LEU F CD1 1 +ATOM 28856 C CD2 . LEU F 1 58 ? 18.704 -27.747 34.162 1.00 39.14 ? 58 LEU F CD2 1 +ATOM 28857 N N . ASP F 1 59 ? 21.627 -31.401 32.016 1.00 45.36 ? 59 ASP F N 1 +ATOM 28858 C CA . ASP F 1 59 ? 22.777 -31.106 31.169 1.00 47.16 ? 59 ASP F CA 1 +ATOM 28859 C C . ASP F 1 59 ? 22.602 -29.780 30.437 1.00 46.14 ? 59 ASP F C 1 +ATOM 28860 O O . ASP F 1 59 ? 21.485 -29.291 30.288 1.00 45.78 ? 59 ASP F O 1 +ATOM 28861 C CB . ASP F 1 59 ? 22.990 -32.229 30.152 1.00 51.28 ? 59 ASP F CB 1 +ATOM 28862 C CG . ASP F 1 59 ? 23.219 -33.577 30.813 1.00 56.29 ? 59 ASP F CG 1 +ATOM 28863 O OD1 . ASP F 1 59 ? 23.988 -33.637 31.797 1.00 59.37 ? 59 ASP F OD1 1 +ATOM 28864 O OD2 . ASP F 1 59 ? 22.641 -34.583 30.344 1.00 59.37 ? 59 ASP F OD2 1 +ATOM 28865 N N . LEU F 1 60 ? 23.712 -29.209 29.982 1.00 45.65 ? 60 LEU F N 1 +ATOM 28866 C CA . LEU F 1 60 ? 23.691 -27.942 29.265 1.00 46.63 ? 60 LEU F CA 1 +ATOM 28867 C C . LEU F 1 60 ? 22.746 -27.921 28.074 1.00 46.62 ? 60 LEU F C 1 +ATOM 28868 O O . LEU F 1 60 ? 22.018 -26.948 27.878 1.00 47.47 ? 60 LEU F O 1 +ATOM 28869 C CB . LEU F 1 60 ? 25.092 -27.574 28.775 1.00 46.92 ? 60 LEU F CB 1 +ATOM 28870 C CG . LEU F 1 60 ? 26.087 -27.058 29.808 1.00 48.47 ? 60 LEU F CG 1 +ATOM 28871 C CD1 . LEU F 1 60 ? 27.407 -26.755 29.122 1.00 47.40 ? 60 LEU F CD1 1 +ATOM 28872 C CD2 . LEU F 1 60 ? 25.531 -25.807 30.480 1.00 48.53 ? 60 LEU F CD2 1 +ATOM 28873 N N . LYS F 1 61 ? 22.763 -28.986 27.282 1.00 46.77 ? 61 LYS F N 1 +ATOM 28874 C CA . LYS F 1 61 ? 21.923 -29.076 26.090 1.00 47.32 ? 61 LYS F CA 1 +ATOM 28875 C C . LYS F 1 61 ? 20.549 -29.682 26.340 1.00 46.19 ? 61 LYS F C 1 +ATOM 28876 O O . LYS F 1 61 ? 19.753 -29.809 25.414 1.00 46.52 ? 61 LYS F O 1 +ATOM 28877 C CB . LYS F 1 61 ? 22.632 -29.900 25.015 1.00 49.66 ? 61 LYS F CB 1 +ATOM 28878 C CG . LYS F 1 61 ? 23.920 -29.287 24.475 1.00 54.72 ? 61 LYS F CG 1 +ATOM 28879 C CD . LYS F 1 61 ? 23.653 -28.116 23.535 1.00 58.75 ? 61 LYS F CD 1 +ATOM 28880 C CE . LYS F 1 61 ? 24.909 -27.768 22.727 1.00 61.32 ? 61 LYS F CE 1 +ATOM 28881 N NZ . LYS F 1 61 ? 24.680 -26.666 21.742 1.00 63.22 ? 61 LYS F NZ 1 +ATOM 28882 N N . GLU F 1 62 ? 20.270 -30.055 27.583 1.00 44.40 ? 62 GLU F N 1 +ATOM 28883 C CA . GLU F 1 62 ? 18.987 -30.662 27.931 1.00 43.20 ? 62 GLU F CA 1 +ATOM 28884 C C . GLU F 1 62 ? 17.830 -29.652 27.921 1.00 41.67 ? 62 GLU F C 1 +ATOM 28885 O O . GLU F 1 62 ? 17.979 -28.531 28.396 1.00 42.75 ? 62 GLU F O 1 +ATOM 28886 C CB . GLU F 1 62 ? 19.099 -31.320 29.309 1.00 43.74 ? 62 GLU F CB 1 +ATOM 28887 C CG . GLU F 1 62 ? 17.876 -32.108 29.748 1.00 44.79 ? 62 GLU F CG 1 +ATOM 28888 C CD . GLU F 1 62 ? 18.158 -32.949 30.981 1.00 47.25 ? 62 GLU F CD 1 +ATOM 28889 O OE1 . GLU F 1 62 ? 19.327 -32.980 31.438 1.00 48.92 ? 62 GLU F OE1 1 +ATOM 28890 O OE2 . GLU F 1 62 ? 17.215 -33.588 31.491 1.00 47.65 ? 62 GLU F OE2 1 +ATOM 28891 N N . HIS F 1 63 ? 16.685 -30.054 27.375 1.00 38.06 ? 63 HIS F N 1 +ATOM 28892 C CA . HIS F 1 63 ? 15.516 -29.180 27.316 1.00 35.94 ? 63 HIS F CA 1 +ATOM 28893 C C . HIS F 1 63 ? 14.460 -29.636 28.311 1.00 34.65 ? 63 HIS F C 1 +ATOM 28894 O O . HIS F 1 63 ? 14.256 -30.828 28.518 1.00 35.76 ? 63 HIS F O 1 +ATOM 28895 C CB . HIS F 1 63 ? 14.890 -29.176 25.909 1.00 34.08 ? 63 HIS F CB 1 +ATOM 28896 C CG . HIS F 1 63 ? 15.861 -28.864 24.814 1.00 35.79 ? 63 HIS F CG 1 +ATOM 28897 N ND1 . HIS F 1 63 ? 16.459 -27.630 24.676 1.00 35.77 ? 63 HIS F ND1 1 +ATOM 28898 C CD2 . HIS F 1 63 ? 16.376 -29.641 23.832 1.00 35.32 ? 63 HIS F CD2 1 +ATOM 28899 C CE1 . HIS F 1 63 ? 17.303 -27.662 23.661 1.00 35.14 ? 63 HIS F CE1 1 +ATOM 28900 N NE2 . HIS F 1 63 ? 17.271 -28.870 23.132 1.00 35.35 ? 63 HIS F NE2 1 +ATOM 28901 N N . ILE F 1 64 ? 13.793 -28.676 28.935 1.00 33.38 ? 64 ILE F N 1 +ATOM 28902 C CA . ILE F 1 64 ? 12.734 -28.977 29.884 1.00 31.16 ? 64 ILE F CA 1 +ATOM 28903 C C . ILE F 1 64 ? 11.505 -28.246 29.378 1.00 30.43 ? 64 ILE F C 1 +ATOM 28904 O O . ILE F 1 64 ? 11.541 -27.037 29.180 1.00 30.66 ? 64 ILE F O 1 +ATOM 28905 C CB . ILE F 1 64 ? 13.080 -28.480 31.309 1.00 30.75 ? 64 ILE F CB 1 +ATOM 28906 C CG1 . ILE F 1 64 ? 14.389 -29.119 31.779 1.00 30.67 ? 64 ILE F CG1 1 +ATOM 28907 C CG2 . ILE F 1 64 ? 11.942 -28.819 32.276 1.00 27.84 ? 64 ILE F CG2 1 +ATOM 28908 C CD1 . ILE F 1 64 ? 14.349 -30.641 31.900 1.00 31.34 ? 64 ILE F CD1 1 +ATOM 28909 N N . ILE F 1 65 ? 10.424 -28.980 29.157 1.00 29.73 ? 65 ILE F N 1 +ATOM 28910 C CA . ILE F 1 65 ? 9.198 -28.381 28.656 1.00 29.99 ? 65 ILE F CA 1 +ATOM 28911 C C . ILE F 1 65 ? 8.025 -28.842 29.492 1.00 30.39 ? 65 ILE F C 1 +ATOM 28912 O O . ILE F 1 65 ? 8.148 -29.792 30.261 1.00 31.18 ? 65 ILE F O 1 +ATOM 28913 C CB . ILE F 1 65 ? 8.959 -28.769 27.187 1.00 30.70 ? 65 ILE F CB 1 +ATOM 28914 C CG1 . ILE F 1 65 ? 8.769 -30.286 27.076 1.00 29.75 ? 65 ILE F CG1 1 +ATOM 28915 C CG2 . ILE F 1 65 ? 10.138 -28.302 26.338 1.00 28.50 ? 65 ILE F CG2 1 +ATOM 28916 C CD1 . ILE F 1 65 ? 8.641 -30.794 25.664 1.00 30.72 ? 65 ILE F CD1 1 +ATOM 28917 N N . GLY F 1 66 ? 6.893 -28.160 29.359 1.00 30.81 ? 66 GLY F N 1 +ATOM 28918 C CA . GLY F 1 66 ? 5.717 -28.540 30.120 1.00 30.89 ? 66 GLY F CA 1 +ATOM 28919 C C . GLY F 1 66 ? 5.355 -27.567 31.218 1.00 32.78 ? 66 GLY F C 1 +ATOM 28920 O O . GLY F 1 66 ? 5.516 -26.352 31.072 1.00 35.25 ? 66 GLY F O 1 +ATOM 28921 N N . LEU F 1 67 ? 4.864 -28.112 32.326 1.00 32.13 ? 67 LEU F N 1 +ATOM 28922 C CA . LEU F 1 67 ? 4.450 -27.339 33.486 1.00 31.81 ? 67 LEU F CA 1 +ATOM 28923 C C . LEU F 1 67 ? 3.176 -26.557 33.223 1.00 32.42 ? 67 LEU F C 1 +ATOM 28924 O O . LEU F 1 67 ? 2.787 -25.699 34.013 1.00 33.70 ? 67 LEU F O 1 +ATOM 28925 C CB . LEU F 1 67 ? 5.569 -26.402 33.944 1.00 32.70 ? 67 LEU F CB 1 +ATOM 28926 C CG . LEU F 1 67 ? 6.828 -27.121 34.433 1.00 34.40 ? 67 LEU F CG 1 +ATOM 28927 C CD1 . LEU F 1 67 ? 7.769 -26.099 35.031 1.00 34.31 ? 67 LEU F CD1 1 +ATOM 28928 C CD2 . LEU F 1 67 ? 6.472 -28.191 35.472 1.00 33.89 ? 67 LEU F CD2 1 +ATOM 28929 N N . GLY F 1 68 ? 2.532 -26.855 32.102 1.00 32.89 ? 68 GLY F N 1 +ATOM 28930 C CA . GLY F 1 68 ? 1.281 -26.204 31.757 1.00 32.79 ? 68 GLY F CA 1 +ATOM 28931 C C . GLY F 1 68 ? 1.275 -24.721 31.431 1.00 32.06 ? 68 GLY F C 1 +ATOM 28932 O O . GLY F 1 68 ? 2.076 -24.224 30.643 1.00 32.03 ? 68 GLY F O 1 +ATOM 28933 N N . GLU F 1 69 ? 0.347 -24.016 32.059 1.00 32.39 ? 69 GLU F N 1 +ATOM 28934 C CA . GLU F 1 69 ? 0.159 -22.581 31.856 1.00 34.33 ? 69 GLU F CA 1 +ATOM 28935 C C . GLU F 1 69 ? 1.199 -21.706 32.572 1.00 32.95 ? 69 GLU F C 1 +ATOM 28936 O O . GLU F 1 69 ? 1.005 -21.314 33.715 1.00 33.81 ? 69 GLU F O 1 +ATOM 28937 C CB . GLU F 1 69 ? -1.248 -22.220 32.334 1.00 35.48 ? 69 GLU F CB 1 +ATOM 28938 C CG . GLU F 1 69 ? -1.782 -20.894 31.892 1.00 38.07 ? 69 GLU F CG 1 +ATOM 28939 C CD . GLU F 1 69 ? -3.195 -20.668 32.422 1.00 42.57 ? 69 GLU F CD 1 +ATOM 28940 O OE1 . GLU F 1 69 ? -3.347 -20.456 33.652 1.00 42.88 ? 69 GLU F OE1 1 +ATOM 28941 O OE2 . GLU F 1 69 ? -4.154 -20.719 31.613 1.00 40.03 ? 69 GLU F OE2 1 +ATOM 28942 N N . LYS F 1 70 ? 2.294 -21.392 31.891 1.00 32.63 ? 70 LYS F N 1 +ATOM 28943 C CA . LYS F 1 70 ? 3.348 -20.563 32.475 1.00 31.78 ? 70 LYS F CA 1 +ATOM 28944 C C . LYS F 1 70 ? 3.640 -19.361 31.597 1.00 31.36 ? 70 LYS F C 1 +ATOM 28945 O O . LYS F 1 70 ? 3.773 -19.488 30.376 1.00 30.11 ? 70 LYS F O 1 +ATOM 28946 C CB . LYS F 1 70 ? 4.636 -21.368 32.665 1.00 31.60 ? 70 LYS F CB 1 +ATOM 28947 C CG . LYS F 1 70 ? 4.504 -22.513 33.662 1.00 33.88 ? 70 LYS F CG 1 +ATOM 28948 C CD . LYS F 1 70 ? 4.067 -21.995 35.013 1.00 34.75 ? 70 LYS F CD 1 +ATOM 28949 C CE . LYS F 1 70 ? 3.927 -23.113 36.018 1.00 34.86 ? 70 LYS F CE 1 +ATOM 28950 N NZ . LYS F 1 70 ? 3.380 -22.582 37.297 1.00 37.03 ? 70 LYS F NZ 1 +ATOM 28951 N N . ALA F 1 71 ? 3.733 -18.190 32.222 1.00 30.69 ? 71 ALA F N 1 +ATOM 28952 C CA . ALA F 1 71 ? 4.008 -16.963 31.495 1.00 29.62 ? 71 ALA F CA 1 +ATOM 28953 C C . ALA F 1 71 ? 5.510 -16.851 31.231 1.00 30.01 ? 71 ALA F C 1 +ATOM 28954 O O . ALA F 1 71 ? 6.130 -15.822 31.524 1.00 30.60 ? 71 ALA F O 1 +ATOM 28955 C CB . ALA F 1 71 ? 3.515 -15.770 32.302 1.00 28.87 ? 71 ALA F CB 1 +ATOM 28956 N N . PHE F 1 72 ? 6.087 -17.916 30.673 1.00 29.66 ? 72 PHE F N 1 +ATOM 28957 C CA . PHE F 1 72 ? 7.517 -17.966 30.385 1.00 29.30 ? 72 PHE F CA 1 +ATOM 28958 C C . PHE F 1 72 ? 7.807 -18.678 29.079 1.00 30.64 ? 72 PHE F C 1 +ATOM 28959 O O . PHE F 1 72 ? 6.917 -19.293 28.476 1.00 29.20 ? 72 PHE F O 1 +ATOM 28960 C CB . PHE F 1 72 ? 8.266 -18.717 31.497 1.00 28.12 ? 72 PHE F CB 1 +ATOM 28961 C CG . PHE F 1 72 ? 8.279 -18.010 32.814 1.00 27.55 ? 72 PHE F CG 1 +ATOM 28962 C CD1 . PHE F 1 72 ? 7.157 -18.027 33.643 1.00 25.86 ? 72 PHE F CD1 1 +ATOM 28963 C CD2 . PHE F 1 72 ? 9.413 -17.290 33.213 1.00 26.16 ? 72 PHE F CD2 1 +ATOM 28964 C CE1 . PHE F 1 72 ? 7.152 -17.330 34.862 1.00 27.76 ? 72 PHE F CE1 1 +ATOM 28965 C CE2 . PHE F 1 72 ? 9.428 -16.589 34.421 1.00 26.84 ? 72 PHE F CE2 1 +ATOM 28966 C CZ . PHE F 1 72 ? 8.292 -16.605 35.254 1.00 28.35 ? 72 PHE F CZ 1 +ATOM 28967 N N . GLU F 1 73 ? 9.071 -18.604 28.661 1.00 31.18 ? 73 GLU F N 1 +ATOM 28968 C CA . GLU F 1 73 ? 9.533 -19.276 27.450 1.00 32.31 ? 73 GLU F CA 1 +ATOM 28969 C C . GLU F 1 73 ? 9.221 -20.778 27.574 1.00 33.48 ? 73 GLU F C 1 +ATOM 28970 O O . GLU F 1 73 ? 9.231 -21.331 28.675 1.00 31.91 ? 73 GLU F O 1 +ATOM 28971 C CB . GLU F 1 73 ? 11.046 -19.088 27.283 1.00 31.23 ? 73 GLU F CB 1 +ATOM 28972 C CG . GLU F 1 73 ? 11.511 -17.668 26.937 1.00 35.60 ? 73 GLU F CG 1 +ATOM 28973 C CD . GLU F 1 73 ? 11.282 -16.640 28.049 1.00 38.76 ? 73 GLU F CD 1 +ATOM 28974 O OE1 . GLU F 1 73 ? 11.214 -17.032 29.236 1.00 38.47 ? 73 GLU F OE1 1 +ATOM 28975 O OE2 . GLU F 1 73 ? 11.187 -15.428 27.731 1.00 41.25 ? 73 GLU F OE2 1 +ATOM 28976 N N . LEU F 1 74 ? 8.953 -21.430 26.442 1.00 35.50 ? 74 LEU F N 1 +ATOM 28977 C CA . LEU F 1 74 ? 8.632 -22.850 26.411 1.00 35.32 ? 74 LEU F CA 1 +ATOM 28978 C C . LEU F 1 74 ? 9.718 -23.749 27.016 1.00 36.01 ? 74 LEU F C 1 +ATOM 28979 O O . LEU F 1 74 ? 9.397 -24.766 27.622 1.00 34.80 ? 74 LEU F O 1 +ATOM 28980 C CB . LEU F 1 74 ? 8.304 -23.264 24.977 1.00 36.08 ? 74 LEU F CB 1 +ATOM 28981 C CG . LEU F 1 74 ? 6.818 -23.344 24.590 1.00 37.21 ? 74 LEU F CG 1 +ATOM 28982 C CD1 . LEU F 1 74 ? 5.935 -22.591 25.566 1.00 36.61 ? 74 LEU F CD1 1 +ATOM 28983 C CD2 . LEU F 1 74 ? 6.654 -22.798 23.182 1.00 36.64 ? 74 LEU F CD2 1 +ATOM 28984 N N . ASP F 1 75 ? 10.992 -23.397 26.841 1.00 36.68 ? 75 ASP F N 1 +ATOM 28985 C CA . ASP F 1 75 ? 12.070 -24.174 27.456 1.00 38.31 ? 75 ASP F CA 1 +ATOM 28986 C C . ASP F 1 75 ? 12.136 -23.541 28.847 1.00 36.39 ? 75 ASP F C 1 +ATOM 28987 O O . ASP F 1 75 ? 12.528 -22.381 28.987 1.00 35.73 ? 75 ASP F O 1 +ATOM 28988 C CB . ASP F 1 75 ? 13.406 -23.977 26.725 1.00 43.00 ? 75 ASP F CB 1 +ATOM 28989 C CG . ASP F 1 75 ? 14.467 -24.997 27.157 1.00 48.56 ? 75 ASP F CG 1 +ATOM 28990 O OD1 . ASP F 1 75 ? 14.581 -25.280 28.377 1.00 49.18 ? 75 ASP F OD1 1 +ATOM 28991 O OD2 . ASP F 1 75 ? 15.197 -25.513 26.276 1.00 51.96 ? 75 ASP F OD2 1 +ATOM 28992 N N . ARG F 1 76 ? 11.754 -24.308 29.862 1.00 34.52 ? 76 ARG F N 1 +ATOM 28993 C CA . ARG F 1 76 ? 11.673 -23.819 31.235 1.00 34.26 ? 76 ARG F CA 1 +ATOM 28994 C C . ARG F 1 76 ? 12.923 -23.644 32.108 1.00 34.52 ? 76 ARG F C 1 +ATOM 28995 O O . ARG F 1 76 ? 12.802 -23.249 33.269 1.00 34.14 ? 76 ARG F O 1 +ATOM 28996 C CB . ARG F 1 76 ? 10.682 -24.688 32.007 1.00 32.98 ? 76 ARG F CB 1 +ATOM 28997 C CG . ARG F 1 76 ? 9.401 -25.017 31.263 1.00 32.82 ? 76 ARG F CG 1 +ATOM 28998 C CD . ARG F 1 76 ? 8.612 -23.780 30.874 1.00 33.75 ? 76 ARG F CD 1 +ATOM 28999 N NE . ARG F 1 76 ? 7.204 -24.109 30.649 1.00 34.27 ? 76 ARG F NE 1 +ATOM 29000 C CZ . ARG F 1 76 ? 6.318 -23.306 30.067 1.00 32.57 ? 76 ARG F CZ 1 +ATOM 29001 N NH1 . ARG F 1 76 ? 6.679 -22.105 29.627 1.00 32.47 ? 76 ARG F NH1 1 +ATOM 29002 N NH2 . ARG F 1 76 ? 5.061 -23.701 29.948 1.00 30.65 ? 76 ARG F NH2 1 +ATOM 29003 N N . LYS F 1 77 ? 14.111 -23.917 31.587 1.00 34.94 ? 77 LYS F N 1 +ATOM 29004 C CA . LYS F 1 77 ? 15.320 -23.782 32.406 1.00 36.91 ? 77 LYS F CA 1 +ATOM 29005 C C . LYS F 1 77 ? 15.563 -22.395 33.014 1.00 35.95 ? 77 LYS F C 1 +ATOM 29006 O O . LYS F 1 77 ? 15.152 -21.371 32.465 1.00 36.01 ? 77 LYS F O 1 +ATOM 29007 C CB . LYS F 1 77 ? 16.550 -24.199 31.593 1.00 38.94 ? 77 LYS F CB 1 +ATOM 29008 C CG . LYS F 1 77 ? 16.536 -25.660 31.196 1.00 43.24 ? 77 LYS F CG 1 +ATOM 29009 C CD . LYS F 1 77 ? 17.501 -25.958 30.064 1.00 46.71 ? 77 LYS F CD 1 +ATOM 29010 C CE . LYS F 1 77 ? 18.934 -25.909 30.527 1.00 49.87 ? 77 LYS F CE 1 +ATOM 29011 N NZ . LYS F 1 77 ? 19.848 -26.250 29.400 1.00 52.10 ? 77 LYS F NZ 1 +ATOM 29012 N N . ARG F 1 78 ? 16.232 -22.398 34.168 1.00 35.69 ? 78 ARG F N 1 +ATOM 29013 C CA . ARG F 1 78 ? 16.613 -21.198 34.913 1.00 33.52 ? 78 ARG F CA 1 +ATOM 29014 C C . ARG F 1 78 ? 15.465 -20.449 35.560 1.00 34.15 ? 78 ARG F C 1 +ATOM 29015 O O . ARG F 1 78 ? 15.383 -19.228 35.470 1.00 34.53 ? 78 ARG F O 1 +ATOM 29016 C CB . ARG F 1 78 ? 17.392 -20.238 34.015 1.00 33.59 ? 78 ARG F CB 1 +ATOM 29017 C CG . ARG F 1 78 ? 18.432 -20.912 33.128 1.00 34.11 ? 78 ARG F CG 1 +ATOM 29018 C CD . ARG F 1 78 ? 19.329 -21.868 33.905 1.00 35.47 ? 78 ARG F CD 1 +ATOM 29019 N NE . ARG F 1 78 ? 20.170 -22.641 32.994 1.00 37.98 ? 78 ARG F NE 1 +ATOM 29020 C CZ . ARG F 1 78 ? 20.800 -23.762 33.324 1.00 37.81 ? 78 ARG F CZ 1 +ATOM 29021 N NH1 . ARG F 1 78 ? 20.690 -24.257 34.551 1.00 39.77 ? 78 ARG F NH1 1 +ATOM 29022 N NH2 . ARG F 1 78 ? 21.543 -24.385 32.429 1.00 37.10 ? 78 ARG F NH2 1 +ATOM 29023 N N . LYS F 1 79 ? 14.586 -21.179 36.228 1.00 33.53 ? 79 LYS F N 1 +ATOM 29024 C CA . LYS F 1 79 ? 13.456 -20.564 36.889 1.00 32.32 ? 79 LYS F CA 1 +ATOM 29025 C C . LYS F 1 79 ? 12.917 -21.522 37.928 1.00 31.10 ? 79 LYS F C 1 +ATOM 29026 O O . LYS F 1 79 ? 12.992 -22.733 37.765 1.00 32.75 ? 79 LYS F O 1 +ATOM 29027 C CB . LYS F 1 79 ? 12.356 -20.229 35.874 1.00 35.28 ? 79 LYS F CB 1 +ATOM 29028 C CG . LYS F 1 79 ? 11.251 -19.344 36.437 1.00 38.71 ? 79 LYS F CG 1 +ATOM 29029 C CD . LYS F 1 79 ? 11.812 -17.976 36.799 1.00 42.03 ? 79 LYS F CD 1 +ATOM 29030 C CE . LYS F 1 79 ? 10.854 -17.180 37.665 1.00 45.07 ? 79 LYS F CE 1 +ATOM 29031 N NZ . LYS F 1 79 ? 11.429 -15.834 37.992 1.00 47.19 ? 79 LYS F NZ 1 +ATOM 29032 N N . ARG F 1 80 ? 12.374 -20.974 39.001 1.00 30.33 ? 80 ARG F N 1 +ATOM 29033 C CA . ARG F 1 80 ? 11.811 -21.770 40.072 1.00 29.16 ? 80 ARG F CA 1 +ATOM 29034 C C . ARG F 1 80 ? 10.295 -21.586 39.949 1.00 29.55 ? 80 ARG F C 1 +ATOM 29035 O O . ARG F 1 80 ? 9.784 -20.523 40.249 1.00 30.97 ? 80 ARG F O 1 +ATOM 29036 C CB A ARG F 1 80 ? 12.332 -21.244 41.414 0.50 28.11 ? 80 ARG F CB 1 +ATOM 29037 C CB B ARG F 1 80 ? 12.324 -21.246 41.418 0.50 27.58 ? 80 ARG F CB 1 +ATOM 29038 C CG A ARG F 1 80 ? 12.089 -22.139 42.623 0.50 27.82 ? 80 ARG F CG 1 +ATOM 29039 C CG B ARG F 1 80 ? 11.563 -21.738 42.639 0.50 26.76 ? 80 ARG F CG 1 +ATOM 29040 C CD A ARG F 1 80 ? 12.551 -21.428 43.896 0.50 27.33 ? 80 ARG F CD 1 +ATOM 29041 C CD B ARG F 1 80 ? 12.197 -21.214 43.929 0.50 25.49 ? 80 ARG F CD 1 +ATOM 29042 N NE A ARG F 1 80 ? 12.118 -22.116 45.107 0.50 27.96 ? 80 ARG F NE 1 +ATOM 29043 N NE B ARG F 1 80 ? 11.330 -21.446 45.081 0.50 26.04 ? 80 ARG F NE 1 +ATOM 29044 C CZ A ARG F 1 80 ? 12.693 -23.206 45.598 0.50 29.03 ? 80 ARG F CZ 1 +ATOM 29045 C CZ B ARG F 1 80 ? 10.178 -20.814 45.281 0.50 25.16 ? 80 ARG F CZ 1 +ATOM 29046 N NH1 A ARG F 1 80 ? 13.742 -23.732 44.983 0.50 28.86 ? 80 ARG F NH1 1 +ATOM 29047 N NH1 B ARG F 1 80 ? 9.759 -19.903 44.410 0.50 25.25 ? 80 ARG F NH1 1 +ATOM 29048 N NH2 A ARG F 1 80 ? 12.206 -23.782 46.696 0.50 30.45 ? 80 ARG F NH2 1 +ATOM 29049 N NH2 B ARG F 1 80 ? 9.436 -21.106 46.338 0.50 23.83 ? 80 ARG F NH2 1 +ATOM 29050 N N . TYR F 1 81 ? 9.584 -22.614 39.489 1.00 29.28 ? 81 TYR F N 1 +ATOM 29051 C CA . TYR F 1 81 ? 8.135 -22.523 39.314 1.00 29.74 ? 81 TYR F CA 1 +ATOM 29052 C C . TYR F 1 81 ? 7.340 -23.022 40.494 1.00 29.97 ? 81 TYR F C 1 +ATOM 29053 O O . TYR F 1 81 ? 7.732 -23.965 41.156 1.00 32.59 ? 81 TYR F O 1 +ATOM 29054 C CB . TYR F 1 81 ? 7.677 -23.302 38.071 1.00 29.03 ? 81 TYR F CB 1 +ATOM 29055 C CG . TYR F 1 81 ? 8.389 -22.902 36.799 1.00 28.18 ? 81 TYR F CG 1 +ATOM 29056 C CD1 . TYR F 1 81 ? 9.630 -23.445 36.474 1.00 26.92 ? 81 TYR F CD1 1 +ATOM 29057 C CD2 . TYR F 1 81 ? 7.845 -21.945 35.946 1.00 26.49 ? 81 TYR F CD2 1 +ATOM 29058 C CE1 . TYR F 1 81 ? 10.314 -23.044 35.331 1.00 26.28 ? 81 TYR F CE1 1 +ATOM 29059 C CE2 . TYR F 1 81 ? 8.514 -21.537 34.812 1.00 26.01 ? 81 TYR F CE2 1 +ATOM 29060 C CZ . TYR F 1 81 ? 9.749 -22.087 34.507 1.00 25.65 ? 81 TYR F CZ 1 +ATOM 29061 O OH . TYR F 1 81 ? 10.409 -21.658 33.384 1.00 24.18 ? 81 TYR F OH 1 +ATOM 29062 N N . VAL F 1 82 ? 6.206 -22.382 40.743 1.00 31.70 ? 82 VAL F N 1 +ATOM 29063 C CA . VAL F 1 82 ? 5.316 -22.760 41.832 1.00 32.84 ? 82 VAL F CA 1 +ATOM 29064 C C . VAL F 1 82 ? 4.007 -23.246 41.209 1.00 34.77 ? 82 VAL F C 1 +ATOM 29065 O O . VAL F 1 82 ? 3.460 -22.593 40.325 1.00 36.12 ? 82 VAL F O 1 +ATOM 29066 C CB . VAL F 1 82 ? 5.016 -21.550 42.746 1.00 32.59 ? 82 VAL F CB 1 +ATOM 29067 C CG1 . VAL F 1 82 ? 3.950 -21.904 43.743 1.00 32.00 ? 82 VAL F CG1 1 +ATOM 29068 C CG2 . VAL F 1 82 ? 6.286 -21.103 43.455 1.00 31.34 ? 82 VAL F CG2 1 +ATOM 29069 N N . MET F 1 83 ? 3.519 -24.401 41.646 1.00 35.66 ? 83 MET F N 1 +ATOM 29070 C CA . MET F 1 83 ? 2.264 -24.923 41.119 1.00 36.40 ? 83 MET F CA 1 +ATOM 29071 C C . MET F 1 83 ? 1.176 -24.686 42.169 1.00 35.54 ? 83 MET F C 1 +ATOM 29072 O O . MET F 1 83 ? 1.011 -25.477 43.095 1.00 34.22 ? 83 MET F O 1 +ATOM 29073 C CB . MET F 1 83 ? 2.369 -26.425 40.825 1.00 39.37 ? 83 MET F CB 1 +ATOM 29074 C CG . MET F 1 83 ? 3.509 -26.833 39.901 1.00 44.24 ? 83 MET F CG 1 +ATOM 29075 S SD . MET F 1 83 ? 3.436 -26.106 38.244 1.00 52.04 ? 83 MET F SD 1 +ATOM 29076 C CE . MET F 1 83 ? 2.002 -26.967 37.592 1.00 48.18 ? 83 MET F CE 1 +ATOM 29077 N N . TYR F 1 84 ? 0.445 -23.585 42.030 1.00 33.02 ? 84 TYR F N 1 +ATOM 29078 C CA . TYR F 1 84 ? -0.610 -23.261 42.972 1.00 31.15 ? 84 TYR F CA 1 +ATOM 29079 C C . TYR F 1 84 ? -1.649 -22.400 42.259 1.00 29.77 ? 84 TYR F C 1 +ATOM 29080 O O . TYR F 1 84 ? -1.410 -21.227 41.991 1.00 29.23 ? 84 TYR F O 1 +ATOM 29081 C CB . TYR F 1 84 ? -0.020 -22.498 44.160 1.00 32.26 ? 84 TYR F CB 1 +ATOM 29082 C CG . TYR F 1 84 ? -0.753 -22.721 45.462 1.00 34.57 ? 84 TYR F CG 1 +ATOM 29083 C CD1 . TYR F 1 84 ? -0.905 -24.014 45.979 1.00 36.27 ? 84 TYR F CD1 1 +ATOM 29084 C CD2 . TYR F 1 84 ? -1.266 -21.650 46.198 1.00 34.41 ? 84 TYR F CD2 1 +ATOM 29085 C CE1 . TYR F 1 84 ? -1.546 -24.240 47.198 1.00 36.91 ? 84 TYR F CE1 1 +ATOM 29086 C CE2 . TYR F 1 84 ? -1.911 -21.864 47.425 1.00 35.64 ? 84 TYR F CE2 1 +ATOM 29087 C CZ . TYR F 1 84 ? -2.045 -23.164 47.912 1.00 36.63 ? 84 TYR F CZ 1 +ATOM 29088 O OH . TYR F 1 84 ? -2.695 -23.401 49.092 1.00 37.08 ? 84 TYR F OH 1 +ATOM 29089 N N . ASN F 1 85 ? -2.803 -22.981 41.953 1.00 29.17 ? 85 ASN F N 1 +ATOM 29090 C CA . ASN F 1 85 ? -3.861 -22.251 41.253 1.00 28.30 ? 85 ASN F CA 1 +ATOM 29091 C C . ASN F 1 85 ? -4.149 -20.940 41.943 1.00 28.39 ? 85 ASN F C 1 +ATOM 29092 O O . ASN F 1 85 ? -4.439 -20.916 43.138 1.00 28.92 ? 85 ASN F O 1 +ATOM 29093 C CB . ASN F 1 85 ? -5.161 -23.051 41.223 1.00 28.54 ? 85 ASN F CB 1 +ATOM 29094 C CG . ASN F 1 85 ? -5.059 -24.316 40.412 1.00 26.58 ? 85 ASN F CG 1 +ATOM 29095 O OD1 . ASN F 1 85 ? -4.028 -24.616 39.810 1.00 27.05 ? 85 ASN F OD1 1 +ATOM 29096 N ND2 . ASN F 1 85 ? -6.140 -25.069 40.392 1.00 27.30 ? 85 ASN F ND2 1 +ATOM 29097 N N . VAL F 1 86 ? -4.089 -19.848 41.194 1.00 27.87 ? 86 VAL F N 1 +ATOM 29098 C CA . VAL F 1 86 ? -4.362 -18.546 41.777 1.00 29.07 ? 86 VAL F CA 1 +ATOM 29099 C C . VAL F 1 86 ? -4.998 -17.589 40.772 1.00 30.48 ? 86 VAL F C 1 +ATOM 29100 O O . VAL F 1 86 ? -4.726 -17.657 39.571 1.00 29.46 ? 86 VAL F O 1 +ATOM 29101 C CB . VAL F 1 86 ? -3.062 -17.891 42.324 1.00 30.36 ? 86 VAL F CB 1 +ATOM 29102 C CG1 . VAL F 1 86 ? -2.182 -17.401 41.171 1.00 29.87 ? 86 VAL F CG1 1 +ATOM 29103 C CG2 . VAL F 1 86 ? -3.413 -16.736 43.239 1.00 30.79 ? 86 VAL F CG2 1 +ATOM 29104 N N . ASP F 1 87 ? -5.866 -16.716 41.274 1.00 32.43 ? 87 ASP F N 1 +ATOM 29105 C CA . ASP F 1 87 ? -6.505 -15.699 40.449 1.00 32.87 ? 87 ASP F CA 1 +ATOM 29106 C C . ASP F 1 87 ? -5.388 -14.690 40.165 1.00 31.87 ? 87 ASP F C 1 +ATOM 29107 O O . ASP F 1 87 ? -5.042 -13.871 41.013 1.00 30.49 ? 87 ASP F O 1 +ATOM 29108 C CB . ASP F 1 87 ? -7.633 -15.026 41.225 1.00 35.87 ? 87 ASP F CB 1 +ATOM 29109 C CG . ASP F 1 87 ? -8.336 -13.959 40.412 1.00 39.72 ? 87 ASP F CG 1 +ATOM 29110 O OD1 . ASP F 1 87 ? -7.639 -13.111 39.820 1.00 42.74 ? 87 ASP F OD1 1 +ATOM 29111 O OD2 . ASP F 1 87 ? -9.586 -13.960 40.365 1.00 42.38 ? 87 ASP F OD2 1 +ATOM 29112 N N . ALA F 1 88 ? -4.825 -14.753 38.967 1.00 32.69 ? 88 ALA F N 1 +ATOM 29113 C CA . ALA F 1 88 ? -3.708 -13.894 38.596 1.00 32.54 ? 88 ALA F CA 1 +ATOM 29114 C C . ALA F 1 88 ? -4.023 -12.430 38.339 1.00 31.62 ? 88 ALA F C 1 +ATOM 29115 O O . ALA F 1 88 ? -3.108 -11.625 38.214 1.00 32.32 ? 88 ALA F O 1 +ATOM 29116 C CB . ALA F 1 88 ? -2.985 -14.495 37.380 1.00 31.92 ? 88 ALA F CB 1 +ATOM 29117 N N . GLY F 1 89 ? -5.304 -12.082 38.277 1.00 31.23 ? 89 GLY F N 1 +ATOM 29118 C CA . GLY F 1 89 ? -5.678 -10.707 38.008 1.00 30.28 ? 89 GLY F CA 1 +ATOM 29119 C C . GLY F 1 89 ? -5.215 -10.303 36.614 1.00 31.64 ? 89 GLY F C 1 +ATOM 29120 O O . GLY F 1 89 ? -5.251 -11.110 35.684 1.00 32.75 ? 89 GLY F O 1 +ATOM 29121 N N . ALA F 1 90 ? -4.778 -9.059 36.464 1.00 29.44 ? 90 ALA F N 1 +ATOM 29122 C CA . ALA F 1 90 ? -4.292 -8.569 35.186 1.00 30.39 ? 90 ALA F CA 1 +ATOM 29123 C C . ALA F 1 90 ? -2.821 -8.989 35.056 1.00 31.40 ? 90 ALA F C 1 +ATOM 29124 O O . ALA F 1 90 ? -1.911 -8.155 35.136 1.00 33.68 ? 90 ALA F O 1 +ATOM 29125 C CB . ALA F 1 90 ? -4.426 -7.036 35.136 1.00 27.35 ? 90 ALA F CB 1 +ATOM 29126 N N . TYR F 1 91 ? -2.595 -10.278 34.844 1.00 30.00 ? 91 TYR F N 1 +ATOM 29127 C CA . TYR F 1 91 ? -1.248 -10.816 34.748 1.00 29.94 ? 91 TYR F CA 1 +ATOM 29128 C C . TYR F 1 91 ? -0.385 -10.259 33.628 1.00 30.62 ? 91 TYR F C 1 +ATOM 29129 O O . TYR F 1 91 ? -0.881 -9.855 32.584 1.00 29.61 ? 91 TYR F O 1 +ATOM 29130 C CB . TYR F 1 91 ? -1.301 -12.350 34.646 1.00 29.11 ? 91 TYR F CB 1 +ATOM 29131 C CG . TYR F 1 91 ? -1.930 -12.886 33.380 1.00 27.47 ? 91 TYR F CG 1 +ATOM 29132 C CD1 . TYR F 1 91 ? -1.177 -13.038 32.209 1.00 28.69 ? 91 TYR F CD1 1 +ATOM 29133 C CD2 . TYR F 1 91 ? -3.278 -13.251 33.351 1.00 27.77 ? 91 TYR F CD2 1 +ATOM 29134 C CE1 . TYR F 1 91 ? -1.758 -13.547 31.034 1.00 29.19 ? 91 TYR F CE1 1 +ATOM 29135 C CE2 . TYR F 1 91 ? -3.867 -13.762 32.185 1.00 27.55 ? 91 TYR F CE2 1 +ATOM 29136 C CZ . TYR F 1 91 ? -3.102 -13.908 31.037 1.00 28.08 ? 91 TYR F CZ 1 +ATOM 29137 O OH . TYR F 1 91 ? -3.674 -14.434 29.903 1.00 30.42 ? 91 TYR F OH 1 +ATOM 29138 N N . LYS F 1 92 ? 0.923 -10.258 33.867 1.00 30.93 ? 92 LYS F N 1 +ATOM 29139 C CA . LYS F 1 92 ? 1.891 -9.773 32.897 1.00 32.55 ? 92 LYS F CA 1 +ATOM 29140 C C . LYS F 1 92 ? 2.870 -10.906 32.666 1.00 31.74 ? 92 LYS F C 1 +ATOM 29141 O O . LYS F 1 92 ? 2.806 -11.928 33.346 1.00 31.04 ? 92 LYS F O 1 +ATOM 29142 C CB . LYS F 1 92 ? 2.629 -8.559 33.455 1.00 37.50 ? 92 LYS F CB 1 +ATOM 29143 C CG . LYS F 1 92 ? 1.720 -7.427 33.918 1.00 43.29 ? 92 LYS F CG 1 +ATOM 29144 C CD . LYS F 1 92 ? 2.510 -6.333 34.637 1.00 49.13 ? 92 LYS F CD 1 +ATOM 29145 C CE . LYS F 1 92 ? 1.583 -5.244 35.171 1.00 52.15 ? 92 LYS F CE 1 +ATOM 29146 N NZ . LYS F 1 92 ? 2.336 -4.200 35.927 1.00 54.09 ? 92 LYS F NZ 1 +ATOM 29147 N N . LYS F 1 93 ? 3.788 -10.748 31.724 1.00 31.34 ? 93 LYS F N 1 +ATOM 29148 C CA . LYS F 1 93 ? 4.719 -11.832 31.509 1.00 31.83 ? 93 LYS F CA 1 +ATOM 29149 C C . LYS F 1 93 ? 5.658 -12.000 32.693 1.00 30.69 ? 93 LYS F C 1 +ATOM 29150 O O . LYS F 1 93 ? 5.934 -11.054 33.427 1.00 29.42 ? 93 LYS F O 1 +ATOM 29151 C CB . LYS F 1 93 ? 5.491 -11.668 30.199 1.00 33.10 ? 93 LYS F CB 1 +ATOM 29152 C CG . LYS F 1 93 ? 6.450 -10.542 30.103 1.00 35.53 ? 93 LYS F CG 1 +ATOM 29153 C CD . LYS F 1 93 ? 7.259 -10.730 28.823 1.00 37.13 ? 93 LYS F CD 1 +ATOM 29154 C CE . LYS F 1 93 ? 8.242 -9.604 28.580 1.00 40.48 ? 93 LYS F CE 1 +ATOM 29155 N NZ . LYS F 1 93 ? 9.052 -9.873 27.350 1.00 43.09 ? 93 LYS F NZ 1 +ATOM 29156 N N . TYR F 1 94 ? 6.099 -13.240 32.887 1.00 29.44 ? 94 TYR F N 1 +ATOM 29157 C CA . TYR F 1 94 ? 6.970 -13.628 33.978 1.00 27.64 ? 94 TYR F CA 1 +ATOM 29158 C C . TYR F 1 94 ? 6.279 -13.627 35.331 1.00 28.72 ? 94 TYR F C 1 +ATOM 29159 O O . TYR F 1 94 ? 6.925 -13.682 36.361 1.00 29.93 ? 94 TYR F O 1 +ATOM 29160 C CB . TYR F 1 94 ? 8.234 -12.766 34.003 1.00 28.01 ? 94 TYR F CB 1 +ATOM 29161 C CG . TYR F 1 94 ? 9.028 -12.856 32.708 1.00 26.26 ? 94 TYR F CG 1 +ATOM 29162 C CD1 . TYR F 1 94 ? 9.056 -14.038 31.966 1.00 24.19 ? 94 TYR F CD1 1 +ATOM 29163 C CD2 . TYR F 1 94 ? 9.743 -11.769 32.231 1.00 26.25 ? 94 TYR F CD2 1 +ATOM 29164 C CE1 . TYR F 1 94 ? 9.769 -14.129 30.792 1.00 23.51 ? 94 TYR F CE1 1 +ATOM 29165 C CE2 . TYR F 1 94 ? 10.470 -11.846 31.049 1.00 26.54 ? 94 TYR F CE2 1 +ATOM 29166 C CZ . TYR F 1 94 ? 10.478 -13.032 30.336 1.00 27.60 ? 94 TYR F CZ 1 +ATOM 29167 O OH . TYR F 1 94 ? 11.213 -13.133 29.171 1.00 30.82 ? 94 TYR F OH 1 +ATOM 29168 N N . GLN F 1 95 ? 4.954 -13.573 35.331 1.00 30.33 ? 95 GLN F N 1 +ATOM 29169 C CA . GLN F 1 95 ? 4.211 -13.637 36.578 1.00 30.39 ? 95 GLN F CA 1 +ATOM 29170 C C . GLN F 1 95 ? 3.933 -15.118 36.820 1.00 31.55 ? 95 GLN F C 1 +ATOM 29171 O O . GLN F 1 95 ? 3.608 -15.848 35.886 1.00 31.59 ? 95 GLN F O 1 +ATOM 29172 C CB . GLN F 1 95 ? 2.898 -12.882 36.467 1.00 29.51 ? 95 GLN F CB 1 +ATOM 29173 C CG . GLN F 1 95 ? 2.139 -12.836 37.772 1.00 31.46 ? 95 GLN F CG 1 +ATOM 29174 C CD . GLN F 1 95 ? 0.904 -11.977 37.690 1.00 33.22 ? 95 GLN F CD 1 +ATOM 29175 O OE1 . GLN F 1 95 ? 0.926 -10.906 37.079 1.00 36.02 ? 95 GLN F OE1 1 +ATOM 29176 N NE2 . GLN F 1 95 ? -0.183 -12.433 38.306 1.00 32.22 ? 95 GLN F NE2 1 +ATOM 29177 N N . ASP F 1 96 ? 4.055 -15.559 38.067 1.00 32.59 ? 96 ASP F N 1 +ATOM 29178 C CA . ASP F 1 96 ? 3.846 -16.965 38.420 1.00 33.50 ? 96 ASP F CA 1 +ATOM 29179 C C . ASP F 1 96 ? 3.403 -16.978 39.874 1.00 32.30 ? 96 ASP F C 1 +ATOM 29180 O O . ASP F 1 96 ? 3.870 -16.168 40.667 1.00 33.32 ? 96 ASP F O 1 +ATOM 29181 C CB . ASP F 1 96 ? 5.174 -17.728 38.241 1.00 36.32 ? 96 ASP F CB 1 +ATOM 29182 C CG . ASP F 1 96 ? 5.046 -19.245 38.453 1.00 42.73 ? 96 ASP F CG 1 +ATOM 29183 O OD1 . ASP F 1 96 ? 4.235 -19.897 37.754 1.00 44.17 ? 96 ASP F OD1 1 +ATOM 29184 O OD2 . ASP F 1 96 ? 5.783 -19.797 39.314 1.00 45.43 ? 96 ASP F OD2 1 +ATOM 29185 N N . PRO F 1 97 ? 2.471 -17.872 40.241 1.00 31.76 ? 97 PRO F N 1 +ATOM 29186 C CA . PRO F 1 97 ? 1.810 -18.850 39.375 1.00 31.53 ? 97 PRO F CA 1 +ATOM 29187 C C . PRO F 1 97 ? 0.572 -18.250 38.728 1.00 31.55 ? 97 PRO F C 1 +ATOM 29188 O O . PRO F 1 97 ? 0.214 -17.113 39.003 1.00 31.74 ? 97 PRO F O 1 +ATOM 29189 C CB . PRO F 1 97 ? 1.450 -19.963 40.339 1.00 30.67 ? 97 PRO F CB 1 +ATOM 29190 C CG . PRO F 1 97 ? 1.041 -19.192 41.556 1.00 31.19 ? 97 PRO F CG 1 +ATOM 29191 C CD . PRO F 1 97 ? 2.090 -18.087 41.651 1.00 31.05 ? 97 PRO F CD 1 +ATOM 29192 N N . LEU F 1 98 ? -0.082 -19.026 37.871 1.00 32.09 ? 98 LEU F N 1 +ATOM 29193 C CA . LEU F 1 98 ? -1.284 -18.569 37.204 1.00 30.26 ? 98 LEU F CA 1 +ATOM 29194 C C . LEU F 1 98 ? -2.463 -19.443 37.609 1.00 30.29 ? 98 LEU F C 1 +ATOM 29195 O O . LEU F 1 98 ? -2.448 -20.030 38.690 1.00 29.27 ? 98 LEU F O 1 +ATOM 29196 C CB . LEU F 1 98 ? -1.084 -18.556 35.688 1.00 30.56 ? 98 LEU F CB 1 +ATOM 29197 C CG . LEU F 1 98 ? 0.022 -17.602 35.201 1.00 32.83 ? 98 LEU F CG 1 +ATOM 29198 C CD1 . LEU F 1 98 ? 0.191 -17.748 33.702 1.00 32.89 ? 98 LEU F CD1 1 +ATOM 29199 C CD2 . LEU F 1 98 ? -0.302 -16.150 35.566 1.00 29.75 ? 98 LEU F CD2 1 +ATOM 29200 N N . TYR F 1 99 ? -3.472 -19.535 36.746 1.00 29.90 ? 99 TYR F N 1 +ATOM 29201 C CA . TYR F 1 99 ? -4.695 -20.279 37.043 1.00 29.32 ? 99 TYR F CA 1 +ATOM 29202 C C . TYR F 1 99 ? -4.638 -21.798 37.042 1.00 29.93 ? 99 TYR F C 1 +ATOM 29203 O O . TYR F 1 99 ? -5.354 -22.439 37.804 1.00 30.14 ? 99 TYR F O 1 +ATOM 29204 C CB . TYR F 1 99 ? -5.796 -19.878 36.060 1.00 28.59 ? 99 TYR F CB 1 +ATOM 29205 C CG . TYR F 1 99 ? -5.947 -18.396 35.834 1.00 29.87 ? 99 TYR F CG 1 +ATOM 29206 C CD1 . TYR F 1 99 ? -6.665 -17.591 36.730 1.00 29.26 ? 99 TYR F CD1 1 +ATOM 29207 C CD2 . TYR F 1 99 ? -5.423 -17.802 34.689 1.00 30.51 ? 99 TYR F CD2 1 +ATOM 29208 C CE1 . TYR F 1 99 ? -6.862 -16.232 36.480 1.00 29.91 ? 99 TYR F CE1 1 +ATOM 29209 C CE2 . TYR F 1 99 ? -5.615 -16.447 34.431 1.00 31.76 ? 99 TYR F CE2 1 +ATOM 29210 C CZ . TYR F 1 99 ? -6.339 -15.671 35.327 1.00 31.70 ? 99 TYR F CZ 1 +ATOM 29211 O OH . TYR F 1 99 ? -6.573 -14.351 35.034 1.00 33.34 ? 99 TYR F OH 1 +ATOM 29212 N N . VAL F 1 100 ? -3.807 -22.371 36.178 1.00 30.32 ? 100 VAL F N 1 +ATOM 29213 C CA . VAL F 1 100 ? -3.737 -23.819 36.038 1.00 30.46 ? 100 VAL F CA 1 +ATOM 29214 C C . VAL F 1 100 ? -2.443 -24.447 36.513 1.00 30.94 ? 100 VAL F C 1 +ATOM 29215 O O . VAL F 1 100 ? -1.374 -23.878 36.330 1.00 31.29 ? 100 VAL F O 1 +ATOM 29216 C CB . VAL F 1 100 ? -3.964 -24.217 34.556 1.00 29.59 ? 100 VAL F CB 1 +ATOM 29217 C CG1 . VAL F 1 100 ? -3.888 -25.718 34.391 1.00 29.63 ? 100 VAL F CG1 1 +ATOM 29218 C CG2 . VAL F 1 100 ? -5.312 -23.705 34.095 1.00 27.96 ? 100 VAL F CG2 1 +ATOM 29219 N N . SER F 1 101 ? -2.558 -25.637 37.101 1.00 31.74 ? 101 SER F N 1 +ATOM 29220 C CA . SER F 1 101 ? -1.408 -26.374 37.611 1.00 32.69 ? 101 SER F CA 1 +ATOM 29221 C C . SER F 1 101 ? -1.296 -27.810 37.091 1.00 32.52 ? 101 SER F C 1 +ATOM 29222 O O . SER F 1 101 ? -1.976 -28.699 37.594 1.00 34.50 ? 101 SER F O 1 +ATOM 29223 C CB . SER F 1 101 ? -1.447 -26.425 39.147 1.00 33.55 ? 101 SER F CB 1 +ATOM 29224 O OG . SER F 1 101 ? -1.318 -25.138 39.733 1.00 34.23 ? 101 SER F OG 1 +ATOM 29225 N N . ILE F 1 102 ? -0.440 -28.033 36.096 1.00 30.33 ? 102 ILE F N 1 +ATOM 29226 C CA . ILE F 1 102 ? -0.210 -29.372 35.558 1.00 29.71 ? 102 ILE F CA 1 +ATOM 29227 C C . ILE F 1 102 ? 1.235 -29.725 35.960 1.00 30.36 ? 102 ILE F C 1 +ATOM 29228 O O . ILE F 1 102 ? 2.182 -29.299 35.304 1.00 29.38 ? 102 ILE F O 1 +ATOM 29229 C CB . ILE F 1 102 ? -0.288 -29.409 34.004 1.00 30.68 ? 102 ILE F CB 1 +ATOM 29230 C CG1 . ILE F 1 102 ? -1.517 -28.647 33.488 1.00 30.94 ? 102 ILE F CG1 1 +ATOM 29231 C CG2 . ILE F 1 102 ? -0.336 -30.846 33.532 1.00 28.34 ? 102 ILE F CG2 1 +ATOM 29232 C CD1 . ILE F 1 102 ? -2.843 -29.270 33.818 1.00 29.92 ? 102 ILE F CD1 1 +ATOM 29233 N N . PRO F 1 103 ? 1.418 -30.510 37.041 1.00 30.58 ? 103 PRO F N 1 +ATOM 29234 C CA . PRO F 1 103 ? 2.735 -30.921 37.549 1.00 31.59 ? 103 PRO F CA 1 +ATOM 29235 C C . PRO F 1 103 ? 3.440 -31.951 36.678 1.00 31.75 ? 103 PRO F C 1 +ATOM 29236 O O . PRO F 1 103 ? 3.875 -32.990 37.167 1.00 31.50 ? 103 PRO F O 1 +ATOM 29237 C CB . PRO F 1 103 ? 2.422 -31.500 38.932 1.00 31.64 ? 103 PRO F CB 1 +ATOM 29238 C CG . PRO F 1 103 ? 0.976 -31.166 39.182 1.00 31.90 ? 103 PRO F CG 1 +ATOM 29239 C CD . PRO F 1 103 ? 0.360 -31.156 37.823 1.00 30.47 ? 103 PRO F CD 1 +ATOM 29240 N N . LEU F 1 104 ? 3.551 -31.650 35.392 1.00 32.61 ? 104 LEU F N 1 +ATOM 29241 C CA . LEU F 1 104 ? 4.188 -32.538 34.431 1.00 33.09 ? 104 LEU F CA 1 +ATOM 29242 C C . LEU F 1 104 ? 5.256 -31.807 33.641 1.00 33.04 ? 104 LEU F C 1 +ATOM 29243 O O . LEU F 1 104 ? 5.024 -30.699 33.175 1.00 34.95 ? 104 LEU F O 1 +ATOM 29244 C CB . LEU F 1 104 ? 3.145 -33.071 33.445 1.00 32.67 ? 104 LEU F CB 1 +ATOM 29245 C CG . LEU F 1 104 ? 3.689 -33.620 32.117 1.00 33.89 ? 104 LEU F CG 1 +ATOM 29246 C CD1 . LEU F 1 104 ? 4.438 -34.933 32.362 1.00 35.13 ? 104 LEU F CD1 1 +ATOM 29247 C CD2 . LEU F 1 104 ? 2.537 -33.847 31.146 1.00 32.73 ? 104 LEU F CD2 1 +ATOM 29248 N N . PHE F 1 105 ? 6.430 -32.407 33.503 1.00 31.96 ? 105 PHE F N 1 +ATOM 29249 C CA . PHE F 1 105 ? 7.455 -31.784 32.694 1.00 31.58 ? 105 PHE F CA 1 +ATOM 29250 C C . PHE F 1 105 ? 8.133 -32.867 31.893 1.00 30.75 ? 105 PHE F C 1 +ATOM 29251 O O . PHE F 1 105 ? 8.222 -34.007 32.325 1.00 31.60 ? 105 PHE F O 1 +ATOM 29252 C CB . PHE F 1 105 ? 8.445 -30.965 33.544 1.00 31.96 ? 105 PHE F CB 1 +ATOM 29253 C CG . PHE F 1 105 ? 9.497 -31.774 34.261 1.00 32.47 ? 105 PHE F CG 1 +ATOM 29254 C CD1 . PHE F 1 105 ? 10.618 -32.257 33.582 1.00 32.78 ? 105 PHE F CD1 1 +ATOM 29255 C CD2 . PHE F 1 105 ? 9.421 -31.962 35.639 1.00 32.27 ? 105 PHE F CD2 1 +ATOM 29256 C CE1 . PHE F 1 105 ? 11.654 -32.907 34.268 1.00 33.40 ? 105 PHE F CE1 1 +ATOM 29257 C CE2 . PHE F 1 105 ? 10.451 -32.610 36.338 1.00 31.59 ? 105 PHE F CE2 1 +ATOM 29258 C CZ . PHE F 1 105 ? 11.568 -33.081 35.653 1.00 31.82 ? 105 PHE F CZ 1 +ATOM 29259 N N . ILE F 1 106 ? 8.567 -32.516 30.699 1.00 30.45 ? 106 ILE F N 1 +ATOM 29260 C CA . ILE F 1 106 ? 9.219 -33.477 29.845 1.00 32.17 ? 106 ILE F CA 1 +ATOM 29261 C C . ILE F 1 106 ? 10.650 -33.049 29.609 1.00 32.82 ? 106 ILE F C 1 +ATOM 29262 O O . ILE F 1 106 ? 10.941 -31.878 29.363 1.00 31.58 ? 106 ILE F O 1 +ATOM 29263 C CB . ILE F 1 106 ? 8.485 -33.613 28.491 1.00 31.78 ? 106 ILE F CB 1 +ATOM 29264 C CG1 . ILE F 1 106 ? 7.057 -34.100 28.736 1.00 30.12 ? 106 ILE F CG1 1 +ATOM 29265 C CG2 . ILE F 1 106 ? 9.239 -34.566 27.581 1.00 28.89 ? 106 ILE F CG2 1 +ATOM 29266 C CD1 . ILE F 1 106 ? 6.198 -34.123 27.486 1.00 33.81 ? 106 ILE F CD1 1 +ATOM 29267 N N . SER F 1 107 ? 11.548 -34.015 29.710 1.00 33.50 ? 107 SER F N 1 +ATOM 29268 C CA . SER F 1 107 ? 12.955 -33.760 29.491 1.00 34.74 ? 107 SER F CA 1 +ATOM 29269 C C . SER F 1 107 ? 13.330 -34.320 28.128 1.00 34.50 ? 107 SER F C 1 +ATOM 29270 O O . SER F 1 107 ? 12.904 -35.408 27.769 1.00 34.73 ? 107 SER F O 1 +ATOM 29271 C CB . SER F 1 107 ? 13.778 -34.445 30.584 1.00 34.04 ? 107 SER F CB 1 +ATOM 29272 O OG . SER F 1 107 ? 15.134 -34.544 30.208 1.00 36.09 ? 107 SER F OG 1 +ATOM 29273 N N . VAL F 1 108 ? 14.093 -33.561 27.357 1.00 35.89 ? 108 VAL F N 1 +ATOM 29274 C CA . VAL F 1 108 ? 14.538 -34.029 26.058 1.00 38.27 ? 108 VAL F CA 1 +ATOM 29275 C C . VAL F 1 108 ? 16.041 -33.914 26.081 1.00 40.04 ? 108 VAL F C 1 +ATOM 29276 O O . VAL F 1 108 ? 16.590 -32.818 26.046 1.00 40.38 ? 108 VAL F O 1 +ATOM 29277 C CB . VAL F 1 108 ? 13.980 -33.184 24.893 1.00 39.56 ? 108 VAL F CB 1 +ATOM 29278 C CG1 . VAL F 1 108 ? 14.390 -33.824 23.560 1.00 36.74 ? 108 VAL F CG1 1 +ATOM 29279 C CG2 . VAL F 1 108 ? 12.457 -33.090 24.991 1.00 37.15 ? 108 VAL F CG2 1 +ATOM 29280 N N . LYS F 1 109 ? 16.700 -35.060 26.165 1.00 42.84 ? 109 LYS F N 1 +ATOM 29281 C CA . LYS F 1 109 ? 18.149 -35.113 26.228 1.00 44.30 ? 109 LYS F CA 1 +ATOM 29282 C C . LYS F 1 109 ? 18.642 -36.019 25.110 1.00 44.51 ? 109 LYS F C 1 +ATOM 29283 O O . LYS F 1 109 ? 18.145 -37.129 24.936 1.00 44.57 ? 109 LYS F O 1 +ATOM 29284 C CB . LYS F 1 109 ? 18.559 -35.648 27.599 1.00 46.21 ? 109 LYS F CB 1 +ATOM 29285 C CG . LYS F 1 109 ? 20.040 -35.608 27.867 1.00 50.41 ? 109 LYS F CG 1 +ATOM 29286 C CD . LYS F 1 109 ? 20.354 -35.896 29.331 1.00 52.30 ? 109 LYS F CD 1 +ATOM 29287 C CE . LYS F 1 109 ? 19.833 -37.250 29.781 1.00 53.60 ? 109 LYS F CE 1 +ATOM 29288 N NZ . LYS F 1 109 ? 20.347 -37.599 31.136 1.00 54.66 ? 109 LYS F NZ 1 +ATOM 29289 N N . ASP F 1 110 ? 19.612 -35.538 24.344 1.00 46.02 ? 110 ASP F N 1 +ATOM 29290 C CA . ASP F 1 110 ? 20.147 -36.305 23.224 1.00 47.66 ? 110 ASP F CA 1 +ATOM 29291 C C . ASP F 1 110 ? 19.002 -36.714 22.290 1.00 46.31 ? 110 ASP F C 1 +ATOM 29292 O O . ASP F 1 110 ? 19.003 -37.807 21.728 1.00 46.80 ? 110 ASP F O 1 +ATOM 29293 C CB . ASP F 1 110 ? 20.880 -37.559 23.726 1.00 51.07 ? 110 ASP F CB 1 +ATOM 29294 C CG . ASP F 1 110 ? 22.067 -37.228 24.632 1.00 55.27 ? 110 ASP F CG 1 +ATOM 29295 O OD1 . ASP F 1 110 ? 22.921 -36.407 24.225 1.00 57.48 ? 110 ASP F OD1 1 +ATOM 29296 O OD2 . ASP F 1 110 ? 22.153 -37.794 25.747 1.00 55.88 ? 110 ASP F OD2 1 +ATOM 29297 N N . GLY F 1 111 ? 18.018 -35.831 22.148 1.00 44.18 ? 111 GLY F N 1 +ATOM 29298 C CA . GLY F 1 111 ? 16.884 -36.099 21.282 1.00 40.93 ? 111 GLY F CA 1 +ATOM 29299 C C . GLY F 1 111 ? 15.834 -37.046 21.836 1.00 39.35 ? 111 GLY F C 1 +ATOM 29300 O O . GLY F 1 111 ? 14.811 -37.274 21.191 1.00 39.64 ? 111 GLY F O 1 +ATOM 29301 N N . VAL F 1 112 ? 16.070 -37.591 23.027 1.00 36.80 ? 112 VAL F N 1 +ATOM 29302 C CA . VAL F 1 112 ? 15.138 -38.530 23.639 1.00 33.72 ? 112 VAL F CA 1 +ATOM 29303 C C . VAL F 1 112 ? 14.320 -37.872 24.732 1.00 34.27 ? 112 VAL F C 1 +ATOM 29304 O O . VAL F 1 112 ? 14.864 -37.221 25.626 1.00 35.68 ? 112 VAL F O 1 +ATOM 29305 C CB . VAL F 1 112 ? 15.892 -39.741 24.233 1.00 33.24 ? 112 VAL F CB 1 +ATOM 29306 C CG1 . VAL F 1 112 ? 14.920 -40.694 24.913 1.00 30.75 ? 112 VAL F CG1 1 +ATOM 29307 C CG2 . VAL F 1 112 ? 16.649 -40.456 23.137 1.00 32.26 ? 112 VAL F CG2 1 +ATOM 29308 N N . ALA F 1 113 ? 13.008 -38.057 24.672 1.00 33.98 ? 113 ALA F N 1 +ATOM 29309 C CA . ALA F 1 113 ? 12.108 -37.460 25.644 1.00 33.55 ? 113 ALA F CA 1 +ATOM 29310 C C . ALA F 1 113 ? 11.689 -38.419 26.744 1.00 34.76 ? 113 ALA F C 1 +ATOM 29311 O O . ALA F 1 113 ? 11.490 -39.613 26.507 1.00 36.40 ? 113 ALA F O 1 +ATOM 29312 C CB . ALA F 1 113 ? 10.874 -36.928 24.943 1.00 33.53 ? 113 ALA F CB 1 +ATOM 29313 N N . THR F 1 114 ? 11.556 -37.879 27.948 1.00 33.99 ? 114 THR F N 1 +ATOM 29314 C CA . THR F 1 114 ? 11.129 -38.638 29.113 1.00 35.00 ? 114 THR F CA 1 +ATOM 29315 C C . THR F 1 114 ? 10.231 -37.713 29.938 1.00 35.68 ? 114 THR F C 1 +ATOM 29316 O O . THR F 1 114 ? 10.552 -36.541 30.144 1.00 36.53 ? 114 THR F O 1 +ATOM 29317 C CB . THR F 1 114 ? 12.316 -39.056 29.995 1.00 35.87 ? 114 THR F CB 1 +ATOM 29318 O OG1 . THR F 1 114 ? 13.301 -39.734 29.202 1.00 38.67 ? 114 THR F OG1 1 +ATOM 29319 C CG2 . THR F 1 114 ? 11.838 -39.976 31.105 1.00 34.38 ? 114 THR F CG2 1 +ATOM 29320 N N . GLY F 1 115 ? 9.110 -38.238 30.409 1.00 35.59 ? 115 GLY F N 1 +ATOM 29321 C CA . GLY F 1 115 ? 8.194 -37.433 31.186 1.00 33.56 ? 115 GLY F CA 1 +ATOM 29322 C C . GLY F 1 115 ? 8.247 -37.700 32.672 1.00 33.06 ? 115 GLY F C 1 +ATOM 29323 O O . GLY F 1 115 ? 8.590 -38.795 33.106 1.00 32.02 ? 115 GLY F O 1 +ATOM 29324 N N . TYR F 1 116 ? 7.907 -36.675 33.451 1.00 33.25 ? 116 TYR F N 1 +ATOM 29325 C CA . TYR F 1 116 ? 7.880 -36.768 34.903 1.00 32.20 ? 116 TYR F CA 1 +ATOM 29326 C C . TYR F 1 116 ? 6.610 -36.095 35.399 1.00 32.39 ? 116 TYR F C 1 +ATOM 29327 O O . TYR F 1 116 ? 6.443 -34.881 35.291 1.00 33.41 ? 116 TYR F O 1 +ATOM 29328 C CB . TYR F 1 116 ? 9.112 -36.097 35.499 1.00 31.72 ? 116 TYR F CB 1 +ATOM 29329 C CG . TYR F 1 116 ? 10.401 -36.718 35.028 1.00 31.53 ? 116 TYR F CG 1 +ATOM 29330 C CD1 . TYR F 1 116 ? 10.988 -36.321 33.833 1.00 29.89 ? 116 TYR F CD1 1 +ATOM 29331 C CD2 . TYR F 1 116 ? 11.021 -37.734 35.768 1.00 33.65 ? 116 TYR F CD2 1 +ATOM 29332 C CE1 . TYR F 1 116 ? 12.160 -36.908 33.380 1.00 32.41 ? 116 TYR F CE1 1 +ATOM 29333 C CE2 . TYR F 1 116 ? 12.196 -38.335 35.325 1.00 33.17 ? 116 TYR F CE2 1 +ATOM 29334 C CZ . TYR F 1 116 ? 12.762 -37.915 34.128 1.00 35.12 ? 116 TYR F CZ 1 +ATOM 29335 O OH . TYR F 1 116 ? 13.926 -38.494 33.663 1.00 36.61 ? 116 TYR F OH 1 +ATOM 29336 N N . PHE F 1 117 ? 5.708 -36.897 35.941 1.00 31.38 ? 117 PHE F N 1 +ATOM 29337 C CA . PHE F 1 117 ? 4.439 -36.400 36.430 1.00 30.55 ? 117 PHE F CA 1 +ATOM 29338 C C . PHE F 1 117 ? 4.290 -36.644 37.918 1.00 30.51 ? 117 PHE F C 1 +ATOM 29339 O O . PHE F 1 117 ? 4.231 -37.781 38.353 1.00 31.51 ? 117 PHE F O 1 +ATOM 29340 C CB . PHE F 1 117 ? 3.312 -37.085 35.655 1.00 29.37 ? 117 PHE F CB 1 +ATOM 29341 C CG . PHE F 1 117 ? 1.949 -36.887 36.246 1.00 29.19 ? 117 PHE F CG 1 +ATOM 29342 C CD1 . PHE F 1 117 ? 1.509 -35.626 36.626 1.00 29.13 ? 117 PHE F CD1 1 +ATOM 29343 C CD2 . PHE F 1 117 ? 1.092 -37.969 36.407 1.00 28.16 ? 117 PHE F CD2 1 +ATOM 29344 C CE1 . PHE F 1 117 ? 0.236 -35.449 37.162 1.00 27.70 ? 117 PHE F CE1 1 +ATOM 29345 C CE2 . PHE F 1 117 ? -0.179 -37.804 36.938 1.00 26.57 ? 117 PHE F CE2 1 +ATOM 29346 C CZ . PHE F 1 117 ? -0.607 -36.541 37.318 1.00 27.62 ? 117 PHE F CZ 1 +ATOM 29347 N N . PHE F 1 118 ? 4.233 -35.570 38.702 1.00 31.27 ? 118 PHE F N 1 +ATOM 29348 C CA . PHE F 1 118 ? 4.081 -35.692 40.146 1.00 30.95 ? 118 PHE F CA 1 +ATOM 29349 C C . PHE F 1 118 ? 2.619 -35.493 40.511 1.00 31.93 ? 118 PHE F C 1 +ATOM 29350 O O . PHE F 1 118 ? 2.098 -34.387 40.446 1.00 33.41 ? 118 PHE F O 1 +ATOM 29351 C CB . PHE F 1 118 ? 4.969 -34.665 40.844 1.00 31.33 ? 118 PHE F CB 1 +ATOM 29352 C CG . PHE F 1 118 ? 6.419 -34.812 40.503 1.00 31.83 ? 118 PHE F CG 1 +ATOM 29353 C CD1 . PHE F 1 118 ? 6.900 -34.387 39.266 1.00 31.22 ? 118 PHE F CD1 1 +ATOM 29354 C CD2 . PHE F 1 118 ? 7.289 -35.450 41.383 1.00 30.95 ? 118 PHE F CD2 1 +ATOM 29355 C CE1 . PHE F 1 118 ? 8.219 -34.600 38.904 1.00 31.75 ? 118 PHE F CE1 1 +ATOM 29356 C CE2 . PHE F 1 118 ? 8.613 -35.673 41.038 1.00 32.00 ? 118 PHE F CE2 1 +ATOM 29357 C CZ . PHE F 1 118 ? 9.084 -35.250 39.797 1.00 33.39 ? 118 PHE F CZ 1 +ATOM 29358 N N . ASN F 1 119 ? 1.952 -36.572 40.890 1.00 32.48 ? 119 ASN F N 1 +ATOM 29359 C CA . ASN F 1 119 ? 0.541 -36.499 41.222 1.00 32.12 ? 119 ASN F CA 1 +ATOM 29360 C C . ASN F 1 119 ? 0.229 -35.937 42.604 1.00 32.54 ? 119 ASN F C 1 +ATOM 29361 O O . ASN F 1 119 ? -0.244 -36.641 43.496 1.00 31.21 ? 119 ASN F O 1 +ATOM 29362 C CB . ASN F 1 119 ? -0.110 -37.874 41.049 1.00 33.28 ? 119 ASN F CB 1 +ATOM 29363 C CG . ASN F 1 119 ? -1.614 -37.812 41.135 1.00 34.84 ? 119 ASN F CG 1 +ATOM 29364 O OD1 . ASN F 1 119 ? -2.219 -36.767 40.869 1.00 35.53 ? 119 ASN F OD1 1 +ATOM 29365 N ND2 . ASN F 1 119 ? -2.236 -38.929 41.495 1.00 35.53 ? 119 ASN F ND2 1 +ATOM 29366 N N . SER F 1 120 ? 0.500 -34.648 42.768 1.00 33.00 ? 120 SER F N 1 +ATOM 29367 C CA . SER F 1 120 ? 0.217 -33.943 44.009 1.00 32.07 ? 120 SER F CA 1 +ATOM 29368 C C . SER F 1 120 ? -0.412 -32.608 43.618 1.00 31.16 ? 120 SER F C 1 +ATOM 29369 O O . SER F 1 120 ? 0.080 -31.925 42.720 1.00 29.76 ? 120 SER F O 1 +ATOM 29370 C CB . SER F 1 120 ? 1.498 -33.696 44.799 1.00 33.15 ? 120 SER F CB 1 +ATOM 29371 O OG . SER F 1 120 ? 1.218 -32.921 45.954 1.00 34.27 ? 120 SER F OG 1 +ATOM 29372 N N . ALA F 1 121 ? -1.507 -32.253 44.276 1.00 30.50 ? 121 ALA F N 1 +ATOM 29373 C CA . ALA F 1 121 ? -2.196 -31.000 43.991 1.00 31.41 ? 121 ALA F CA 1 +ATOM 29374 C C . ALA F 1 121 ? -1.841 -29.937 45.034 1.00 31.66 ? 121 ALA F C 1 +ATOM 29375 O O . ALA F 1 121 ? -2.536 -28.942 45.186 1.00 31.63 ? 121 ALA F O 1 +ATOM 29376 C CB . ALA F 1 121 ? -3.701 -31.236 43.967 1.00 31.00 ? 121 ALA F CB 1 +ATOM 29377 N N . SER F 1 122 ? -0.758 -30.169 45.765 1.00 32.09 ? 122 SER F N 1 +ATOM 29378 C CA . SER F 1 122 ? -0.303 -29.229 46.779 1.00 31.17 ? 122 SER F CA 1 +ATOM 29379 C C . SER F 1 122 ? 0.600 -28.217 46.083 1.00 31.42 ? 122 SER F C 1 +ATOM 29380 O O . SER F 1 122 ? 0.768 -28.273 44.863 1.00 29.81 ? 122 SER F O 1 +ATOM 29381 C CB . SER F 1 122 ? 0.475 -29.960 47.876 1.00 29.98 ? 122 SER F CB 1 +ATOM 29382 O OG . SER F 1 122 ? 1.656 -30.550 47.347 1.00 32.87 ? 122 SER F OG 1 +ATOM 29383 N N . LYS F 1 123 ? 1.182 -27.302 46.855 1.00 32.26 ? 123 LYS F N 1 +ATOM 29384 C CA . LYS F 1 123 ? 2.053 -26.284 46.289 1.00 32.20 ? 123 LYS F CA 1 +ATOM 29385 C C . LYS F 1 123 ? 3.425 -26.849 45.925 1.00 31.69 ? 123 LYS F C 1 +ATOM 29386 O O . LYS F 1 123 ? 4.412 -26.623 46.628 1.00 30.95 ? 123 LYS F O 1 +ATOM 29387 C CB . LYS F 1 123 ? 2.211 -25.110 47.262 1.00 33.71 ? 123 LYS F CB 1 +ATOM 29388 C CG . LYS F 1 123 ? 3.076 -23.984 46.705 1.00 37.88 ? 123 LYS F CG 1 +ATOM 29389 C CD . LYS F 1 123 ? 3.278 -22.845 47.697 1.00 41.20 ? 123 LYS F CD 1 +ATOM 29390 C CE . LYS F 1 123 ? 2.017 -22.019 47.860 1.00 44.47 ? 123 LYS F CE 1 +ATOM 29391 N NZ . LYS F 1 123 ? 2.286 -20.772 48.634 1.00 48.24 ? 123 LYS F NZ 1 +ATOM 29392 N N . VAL F 1 124 ? 3.470 -27.571 44.808 1.00 30.86 ? 124 VAL F N 1 +ATOM 29393 C CA . VAL F 1 124 ? 4.692 -28.185 44.309 1.00 31.20 ? 124 VAL F CA 1 +ATOM 29394 C C . VAL F 1 124 ? 5.642 -27.166 43.675 1.00 31.67 ? 124 VAL F C 1 +ATOM 29395 O O . VAL F 1 124 ? 5.225 -26.324 42.881 1.00 31.76 ? 124 VAL F O 1 +ATOM 29396 C CB . VAL F 1 124 ? 4.371 -29.271 43.252 1.00 30.20 ? 124 VAL F CB 1 +ATOM 29397 C CG1 . VAL F 1 124 ? 5.665 -29.844 42.677 1.00 30.33 ? 124 VAL F CG1 1 +ATOM 29398 C CG2 . VAL F 1 124 ? 3.544 -30.376 43.873 1.00 30.15 ? 124 VAL F CG2 1 +ATOM 29399 N N . ILE F 1 125 ? 6.925 -27.273 44.007 1.00 30.59 ? 125 ILE F N 1 +ATOM 29400 C CA . ILE F 1 125 ? 7.935 -26.373 43.469 1.00 30.64 ? 125 ILE F CA 1 +ATOM 29401 C C . ILE F 1 125 ? 8.833 -27.075 42.459 1.00 30.72 ? 125 ILE F C 1 +ATOM 29402 O O . ILE F 1 125 ? 9.397 -28.122 42.749 1.00 30.83 ? 125 ILE F O 1 +ATOM 29403 C CB . ILE F 1 125 ? 8.865 -25.827 44.581 1.00 31.72 ? 125 ILE F CB 1 +ATOM 29404 C CG1 . ILE F 1 125 ? 8.039 -25.280 45.747 1.00 29.75 ? 125 ILE F CG1 1 +ATOM 29405 C CG2 . ILE F 1 125 ? 9.795 -24.762 43.994 1.00 30.44 ? 125 ILE F CG2 1 +ATOM 29406 C CD1 . ILE F 1 125 ? 7.085 -24.191 45.364 1.00 31.96 ? 125 ILE F CD1 1 +ATOM 29407 N N . PHE F 1 126 ? 8.966 -26.496 41.273 1.00 31.54 ? 126 PHE F N 1 +ATOM 29408 C CA . PHE F 1 126 ? 9.844 -27.061 40.256 1.00 33.90 ? 126 PHE F CA 1 +ATOM 29409 C C . PHE F 1 126 ? 10.994 -26.099 40.053 1.00 34.43 ? 126 PHE F C 1 +ATOM 29410 O O . PHE F 1 126 ? 10.863 -25.098 39.355 1.00 35.65 ? 126 PHE F O 1 +ATOM 29411 C CB . PHE F 1 126 ? 9.125 -27.268 38.911 1.00 33.45 ? 126 PHE F CB 1 +ATOM 29412 C CG . PHE F 1 126 ? 8.165 -28.419 38.906 1.00 34.41 ? 126 PHE F CG 1 +ATOM 29413 C CD1 . PHE F 1 126 ? 6.873 -28.268 39.395 1.00 32.22 ? 126 PHE F CD1 1 +ATOM 29414 C CD2 . PHE F 1 126 ? 8.554 -29.660 38.409 1.00 32.87 ? 126 PHE F CD2 1 +ATOM 29415 C CE1 . PHE F 1 126 ? 5.984 -29.337 39.384 1.00 34.49 ? 126 PHE F CE1 1 +ATOM 29416 C CE2 . PHE F 1 126 ? 7.666 -30.734 38.399 1.00 32.42 ? 126 PHE F CE2 1 +ATOM 29417 C CZ . PHE F 1 126 ? 6.382 -30.571 38.884 1.00 32.53 ? 126 PHE F CZ 1 +ATOM 29418 N N . ASP F 1 127 ? 12.121 -26.397 40.676 1.00 35.82 ? 127 ASP F N 1 +ATOM 29419 C CA . ASP F 1 127 ? 13.296 -25.550 40.545 1.00 37.54 ? 127 ASP F CA 1 +ATOM 29420 C C . ASP F 1 127 ? 14.114 -26.121 39.396 1.00 35.54 ? 127 ASP F C 1 +ATOM 29421 O O . ASP F 1 127 ? 14.872 -27.077 39.568 1.00 37.21 ? 127 ASP F O 1 +ATOM 29422 C CB . ASP F 1 127 ? 14.098 -25.563 41.848 1.00 40.90 ? 127 ASP F CB 1 +ATOM 29423 C CG . ASP F 1 127 ? 15.162 -24.511 41.868 1.00 44.77 ? 127 ASP F CG 1 +ATOM 29424 O OD1 . ASP F 1 127 ? 16.061 -24.590 41.009 1.00 47.98 ? 127 ASP F OD1 1 +ATOM 29425 O OD2 . ASP F 1 127 ? 15.102 -23.597 42.728 1.00 49.39 ? 127 ASP F OD2 1 +ATOM 29426 N N . VAL F 1 128 ? 13.957 -25.525 38.224 1.00 33.53 ? 128 VAL F N 1 +ATOM 29427 C CA . VAL F 1 128 ? 14.632 -26.002 37.025 1.00 32.18 ? 128 VAL F CA 1 +ATOM 29428 C C . VAL F 1 128 ? 15.970 -25.321 36.735 1.00 32.93 ? 128 VAL F C 1 +ATOM 29429 O O . VAL F 1 128 ? 16.040 -24.342 35.991 1.00 33.49 ? 128 VAL F O 1 +ATOM 29430 C CB . VAL F 1 128 ? 13.691 -25.860 35.795 1.00 29.41 ? 128 VAL F CB 1 +ATOM 29431 C CG1 . VAL F 1 128 ? 14.267 -26.575 34.602 1.00 27.82 ? 128 VAL F CG1 1 +ATOM 29432 C CG2 . VAL F 1 128 ? 12.314 -26.401 36.136 1.00 26.88 ? 128 VAL F CG2 1 +ATOM 29433 N N . GLY F 1 129 ? 17.032 -25.858 37.320 1.00 33.42 ? 129 GLY F N 1 +ATOM 29434 C CA . GLY F 1 129 ? 18.359 -25.313 37.100 1.00 34.50 ? 129 GLY F CA 1 +ATOM 29435 C C . GLY F 1 129 ? 18.560 -23.910 37.642 1.00 35.88 ? 129 GLY F C 1 +ATOM 29436 O O . GLY F 1 129 ? 19.295 -23.129 37.052 1.00 35.56 ? 129 GLY F O 1 +ATOM 29437 N N . LEU F 1 130 ? 17.923 -23.598 38.769 1.00 36.30 ? 130 LEU F N 1 +ATOM 29438 C CA . LEU F 1 130 ? 18.022 -22.282 39.385 1.00 38.09 ? 130 LEU F CA 1 +ATOM 29439 C C . LEU F 1 130 ? 18.785 -22.403 40.701 1.00 39.49 ? 130 LEU F C 1 +ATOM 29440 O O . LEU F 1 130 ? 19.794 -21.735 40.897 1.00 41.36 ? 130 LEU F O 1 +ATOM 29441 C CB . LEU F 1 130 ? 16.610 -21.718 39.618 1.00 38.36 ? 130 LEU F CB 1 +ATOM 29442 C CG . LEU F 1 130 ? 16.342 -20.215 39.835 1.00 38.00 ? 130 LEU F CG 1 +ATOM 29443 C CD1 . LEU F 1 130 ? 16.229 -19.905 41.296 1.00 38.73 ? 130 LEU F CD1 1 +ATOM 29444 C CD2 . LEU F 1 130 ? 17.419 -19.394 39.174 1.00 37.02 ? 130 LEU F CD2 1 +ATOM 29445 N N . GLU F 1 131 ? 18.303 -23.252 41.604 1.00 39.91 ? 131 GLU F N 1 +ATOM 29446 C CA . GLU F 1 131 ? 18.974 -23.463 42.873 1.00 41.02 ? 131 GLU F CA 1 +ATOM 29447 C C . GLU F 1 131 ? 20.352 -24.065 42.547 1.00 42.33 ? 131 GLU F C 1 +ATOM 29448 O O . GLU F 1 131 ? 21.387 -23.618 43.051 1.00 42.24 ? 131 GLU F O 1 +ATOM 29449 C CB . GLU F 1 131 ? 18.165 -24.423 43.735 1.00 43.47 ? 131 GLU F CB 1 +ATOM 29450 C CG . GLU F 1 131 ? 18.682 -24.563 45.164 1.00 50.32 ? 131 GLU F CG 1 +ATOM 29451 C CD . GLU F 1 131 ? 17.901 -25.596 45.961 1.00 53.29 ? 131 GLU F CD 1 +ATOM 29452 O OE1 . GLU F 1 131 ? 16.658 -25.470 46.041 1.00 56.16 ? 131 GLU F OE1 1 +ATOM 29453 O OE2 . GLU F 1 131 ? 18.528 -26.533 46.504 1.00 55.19 ? 131 GLU F OE2 1 +ATOM 29454 N N . GLU F 1 132 ? 20.353 -25.088 41.700 1.00 41.52 ? 132 GLU F N 1 +ATOM 29455 C CA . GLU F 1 132 ? 21.583 -25.729 41.266 1.00 39.87 ? 132 GLU F CA 1 +ATOM 29456 C C . GLU F 1 132 ? 21.534 -25.737 39.739 1.00 38.70 ? 132 GLU F C 1 +ATOM 29457 O O . GLU F 1 132 ? 20.676 -26.375 39.131 1.00 37.12 ? 132 GLU F O 1 +ATOM 29458 C CB . GLU F 1 132 ? 21.682 -27.161 41.812 1.00 42.30 ? 132 GLU F CB 1 +ATOM 29459 C CG . GLU F 1 132 ? 21.907 -27.276 43.328 1.00 45.17 ? 132 GLU F CG 1 +ATOM 29460 C CD . GLU F 1 132 ? 23.122 -26.486 43.830 1.00 47.72 ? 132 GLU F CD 1 +ATOM 29461 O OE1 . GLU F 1 132 ? 24.176 -26.488 43.157 1.00 48.90 ? 132 GLU F OE1 1 +ATOM 29462 O OE2 . GLU F 1 132 ? 23.032 -25.864 44.914 1.00 50.40 ? 132 GLU F OE2 1 +ATOM 29463 N N . TYR F 1 133 ? 22.462 -25.010 39.132 1.00 37.37 ? 133 TYR F N 1 +ATOM 29464 C CA . TYR F 1 133 ? 22.556 -24.877 37.684 1.00 36.88 ? 133 TYR F CA 1 +ATOM 29465 C C . TYR F 1 133 ? 22.478 -26.193 36.901 1.00 37.34 ? 133 TYR F C 1 +ATOM 29466 O O . TYR F 1 133 ? 21.990 -26.235 35.768 1.00 36.24 ? 133 TYR F O 1 +ATOM 29467 C CB . TYR F 1 133 ? 23.867 -24.169 37.338 1.00 36.47 ? 133 TYR F CB 1 +ATOM 29468 C CG . TYR F 1 133 ? 23.983 -23.714 35.902 1.00 37.96 ? 133 TYR F CG 1 +ATOM 29469 C CD1 . TYR F 1 133 ? 23.388 -22.523 35.471 1.00 39.11 ? 133 TYR F CD1 1 +ATOM 29470 C CD2 . TYR F 1 133 ? 24.698 -24.463 34.971 1.00 38.58 ? 133 TYR F CD2 1 +ATOM 29471 C CE1 . TYR F 1 133 ? 23.509 -22.084 34.144 1.00 37.37 ? 133 TYR F CE1 1 +ATOM 29472 C CE2 . TYR F 1 133 ? 24.825 -24.038 33.645 1.00 39.01 ? 133 TYR F CE2 1 +ATOM 29473 C CZ . TYR F 1 133 ? 24.231 -22.847 33.240 1.00 40.07 ? 133 TYR F CZ 1 +ATOM 29474 O OH . TYR F 1 133 ? 24.384 -22.414 31.937 1.00 41.72 ? 133 TYR F OH 1 +ATOM 29475 N N . ASP F 1 134 ? 22.952 -27.269 37.506 1.00 37.50 ? 134 ASP F N 1 +ATOM 29476 C CA . ASP F 1 134 ? 22.975 -28.561 36.834 1.00 38.15 ? 134 ASP F CA 1 +ATOM 29477 C C . ASP F 1 134 ? 21.960 -29.554 37.375 1.00 36.66 ? 134 ASP F C 1 +ATOM 29478 O O . ASP F 1 134 ? 22.132 -30.761 37.235 1.00 36.02 ? 134 ASP F O 1 +ATOM 29479 C CB . ASP F 1 134 ? 24.385 -29.151 36.944 1.00 40.81 ? 134 ASP F CB 1 +ATOM 29480 C CG . ASP F 1 134 ? 24.766 -29.476 38.377 1.00 43.73 ? 134 ASP F CG 1 +ATOM 29481 O OD1 . ASP F 1 134 ? 24.365 -28.711 39.287 1.00 46.15 ? 134 ASP F OD1 1 +ATOM 29482 O OD2 . ASP F 1 134 ? 25.469 -30.489 38.594 1.00 45.93 ? 134 ASP F OD2 1 +ATOM 29483 N N . LYS F 1 135 ? 20.896 -29.048 37.980 1.00 36.53 ? 135 LYS F N 1 +ATOM 29484 C CA . LYS F 1 135 ? 19.880 -29.917 38.542 1.00 37.21 ? 135 LYS F CA 1 +ATOM 29485 C C . LYS F 1 135 ? 18.459 -29.407 38.406 1.00 36.55 ? 135 LYS F C 1 +ATOM 29486 O O . LYS F 1 135 ? 18.215 -28.206 38.299 1.00 37.16 ? 135 LYS F O 1 +ATOM 29487 C CB . LYS F 1 135 ? 20.152 -30.151 40.035 1.00 39.00 ? 135 LYS F CB 1 +ATOM 29488 C CG . LYS F 1 135 ? 21.233 -31.166 40.331 1.00 44.51 ? 135 LYS F CG 1 +ATOM 29489 C CD . LYS F 1 135 ? 21.544 -31.217 41.817 1.00 48.80 ? 135 LYS F CD 1 +ATOM 29490 C CE . LYS F 1 135 ? 22.436 -32.406 42.129 1.00 52.53 ? 135 LYS F CE 1 +ATOM 29491 N NZ . LYS F 1 135 ? 23.497 -32.554 41.087 1.00 54.01 ? 135 LYS F NZ 1 +ATOM 29492 N N . VAL F 1 136 ? 17.528 -30.351 38.420 1.00 34.57 ? 136 VAL F N 1 +ATOM 29493 C CA . VAL F 1 136 ? 16.114 -30.055 38.400 1.00 32.08 ? 136 VAL F CA 1 +ATOM 29494 C C . VAL F 1 136 ? 15.689 -30.594 39.754 1.00 31.45 ? 136 VAL F C 1 +ATOM 29495 O O . VAL F 1 136 ? 15.779 -31.790 39.997 1.00 31.86 ? 136 VAL F O 1 +ATOM 29496 C CB . VAL F 1 136 ? 15.359 -30.834 37.310 1.00 32.14 ? 136 VAL F CB 1 +ATOM 29497 C CG1 . VAL F 1 136 ? 13.875 -30.529 37.408 1.00 29.94 ? 136 VAL F CG1 1 +ATOM 29498 C CG2 . VAL F 1 136 ? 15.886 -30.464 35.939 1.00 31.08 ? 136 VAL F CG2 1 +ATOM 29499 N N . ILE F 1 137 ? 15.251 -29.717 40.643 1.00 31.68 ? 137 ILE F N 1 +ATOM 29500 C CA . ILE F 1 137 ? 14.838 -30.140 41.972 1.00 31.61 ? 137 ILE F CA 1 +ATOM 29501 C C . ILE F 1 137 ? 13.344 -29.912 42.140 1.00 31.47 ? 137 ILE F C 1 +ATOM 29502 O O . ILE F 1 137 ? 12.846 -28.805 41.952 1.00 31.85 ? 137 ILE F O 1 +ATOM 29503 C CB . ILE F 1 137 ? 15.610 -29.352 43.058 1.00 31.76 ? 137 ILE F CB 1 +ATOM 29504 C CG1 . ILE F 1 137 ? 17.115 -29.515 42.834 1.00 30.94 ? 137 ILE F CG1 1 +ATOM 29505 C CG2 . ILE F 1 137 ? 15.217 -29.842 44.443 1.00 29.07 ? 137 ILE F CG2 1 +ATOM 29506 C CD1 . ILE F 1 137 ? 17.972 -28.645 43.726 1.00 33.12 ? 137 ILE F CD1 1 +ATOM 29507 N N . VAL F 1 138 ? 12.628 -30.968 42.492 1.00 31.27 ? 138 VAL F N 1 +ATOM 29508 C CA . VAL F 1 138 ? 11.188 -30.875 42.682 1.00 31.30 ? 138 VAL F CA 1 +ATOM 29509 C C . VAL F 1 138 ? 10.882 -31.091 44.145 1.00 31.59 ? 138 VAL F C 1 +ATOM 29510 O O . VAL F 1 138 ? 11.268 -32.101 44.716 1.00 34.11 ? 138 VAL F O 1 +ATOM 29511 C CB . VAL F 1 138 ? 10.446 -31.943 41.854 1.00 30.85 ? 138 VAL F CB 1 +ATOM 29512 C CG1 . VAL F 1 138 ? 8.949 -31.844 42.090 1.00 29.20 ? 138 VAL F CG1 1 +ATOM 29513 C CG2 . VAL F 1 138 ? 10.768 -31.767 40.371 1.00 29.15 ? 138 VAL F CG2 1 +ATOM 29514 N N . THR F 1 139 ? 10.192 -30.137 44.753 1.00 31.55 ? 139 THR F N 1 +ATOM 29515 C CA . THR F 1 139 ? 9.842 -30.238 46.159 1.00 33.50 ? 139 THR F CA 1 +ATOM 29516 C C . THR F 1 139 ? 8.333 -30.375 46.325 1.00 34.09 ? 139 THR F C 1 +ATOM 29517 O O . THR F 1 139 ? 7.578 -29.511 45.876 1.00 35.46 ? 139 THR F O 1 +ATOM 29518 C CB . THR F 1 139 ? 10.293 -28.979 46.933 1.00 35.12 ? 139 THR F CB 1 +ATOM 29519 O OG1 . THR F 1 139 ? 11.683 -28.729 46.682 1.00 35.90 ? 139 THR F OG1 1 +ATOM 29520 C CG2 . THR F 1 139 ? 10.077 -29.167 48.434 1.00 34.37 ? 139 THR F CG2 1 +ATOM 29521 N N . ILE F 1 140 ? 7.893 -31.459 46.956 1.00 34.22 ? 140 ILE F N 1 +ATOM 29522 C CA . ILE F 1 140 ? 6.472 -31.662 47.199 1.00 36.30 ? 140 ILE F CA 1 +ATOM 29523 C C . ILE F 1 140 ? 6.240 -31.451 48.686 1.00 38.55 ? 140 ILE F C 1 +ATOM 29524 O O . ILE F 1 140 ? 6.802 -32.159 49.515 1.00 39.73 ? 140 ILE F O 1 +ATOM 29525 C CB . ILE F 1 140 ? 5.997 -33.082 46.816 1.00 35.55 ? 140 ILE F CB 1 +ATOM 29526 C CG1 . ILE F 1 140 ? 6.245 -33.347 45.325 1.00 34.63 ? 140 ILE F CG1 1 +ATOM 29527 C CG2 . ILE F 1 140 ? 4.500 -33.225 47.096 1.00 34.32 ? 140 ILE F CG2 1 +ATOM 29528 C CD1 . ILE F 1 140 ? 7.667 -33.730 45.000 1.00 35.42 ? 140 ILE F CD1 1 +ATOM 29529 N N . PRO F 1 141 ? 5.417 -30.459 49.047 1.00 39.66 ? 141 PRO F N 1 +ATOM 29530 C CA . PRO F 1 141 ? 5.147 -30.193 50.461 1.00 40.62 ? 141 PRO F CA 1 +ATOM 29531 C C . PRO F 1 141 ? 4.248 -31.228 51.134 1.00 41.34 ? 141 PRO F C 1 +ATOM 29532 O O . PRO F 1 141 ? 3.210 -30.884 51.698 1.00 41.39 ? 141 PRO F O 1 +ATOM 29533 C CB . PRO F 1 141 ? 4.520 -28.801 50.431 1.00 39.99 ? 141 PRO F CB 1 +ATOM 29534 C CG . PRO F 1 141 ? 3.749 -28.829 49.151 1.00 40.54 ? 141 PRO F CG 1 +ATOM 29535 C CD . PRO F 1 141 ? 4.735 -29.476 48.188 1.00 39.11 ? 141 PRO F CD 1 +ATOM 29536 N N . GLU F 1 142 ? 4.649 -32.493 51.056 1.00 42.32 ? 142 GLU F N 1 +ATOM 29537 C CA . GLU F 1 142 ? 3.919 -33.593 51.692 1.00 45.85 ? 142 GLU F CA 1 +ATOM 29538 C C . GLU F 1 142 ? 4.957 -34.647 52.077 1.00 46.91 ? 142 GLU F C 1 +ATOM 29539 O O . GLU F 1 142 ? 6.034 -34.695 51.479 1.00 46.32 ? 142 GLU F O 1 +ATOM 29540 C CB . GLU F 1 142 ? 2.888 -34.205 50.738 1.00 46.60 ? 142 GLU F CB 1 +ATOM 29541 C CG . GLU F 1 142 ? 1.934 -33.197 50.125 1.00 52.98 ? 142 GLU F CG 1 +ATOM 29542 C CD . GLU F 1 142 ? 0.705 -33.846 49.497 1.00 56.62 ? 142 GLU F CD 1 +ATOM 29543 O OE1 . GLU F 1 142 ? -0.184 -34.318 50.246 1.00 59.15 ? 142 GLU F OE1 1 +ATOM 29544 O OE2 . GLU F 1 142 ? 0.624 -33.892 48.251 1.00 58.78 ? 142 GLU F OE2 1 +ATOM 29545 N N . ASP F 1 143 ? 4.646 -35.484 53.067 1.00 48.42 ? 143 ASP F N 1 +ATOM 29546 C CA . ASP F 1 143 ? 5.591 -36.513 53.500 1.00 49.98 ? 143 ASP F CA 1 +ATOM 29547 C C . ASP F 1 143 ? 5.613 -37.715 52.560 1.00 49.41 ? 143 ASP F C 1 +ATOM 29548 O O . ASP F 1 143 ? 6.572 -38.488 52.555 1.00 49.17 ? 143 ASP F O 1 +ATOM 29549 C CB . ASP F 1 143 ? 5.281 -36.980 54.931 1.00 53.57 ? 143 ASP F CB 1 +ATOM 29550 C CG . ASP F 1 143 ? 3.860 -37.509 55.091 1.00 58.27 ? 143 ASP F CG 1 +ATOM 29551 O OD1 . ASP F 1 143 ? 3.450 -38.397 54.313 1.00 61.59 ? 143 ASP F OD1 1 +ATOM 29552 O OD2 . ASP F 1 143 ? 3.149 -37.040 56.008 1.00 61.80 ? 143 ASP F OD2 1 +ATOM 29553 N N . SER F 1 144 ? 4.554 -37.867 51.768 1.00 48.30 ? 144 SER F N 1 +ATOM 29554 C CA . SER F 1 144 ? 4.442 -38.967 50.810 1.00 47.40 ? 144 SER F CA 1 +ATOM 29555 C C . SER F 1 144 ? 4.026 -38.435 49.456 1.00 45.99 ? 144 SER F C 1 +ATOM 29556 O O . SER F 1 144 ? 3.446 -37.361 49.362 1.00 47.60 ? 144 SER F O 1 +ATOM 29557 C CB . SER F 1 144 ? 3.398 -39.981 51.269 1.00 47.59 ? 144 SER F CB 1 +ATOM 29558 O OG . SER F 1 144 ? 3.777 -40.576 52.489 1.00 49.35 ? 144 SER F OG 1 +ATOM 29559 N N . VAL F 1 145 ? 4.309 -39.187 48.406 1.00 44.25 ? 145 VAL F N 1 +ATOM 29560 C CA . VAL F 1 145 ? 3.935 -38.745 47.076 1.00 43.11 ? 145 VAL F CA 1 +ATOM 29561 C C . VAL F 1 145 ? 4.136 -39.834 46.042 1.00 41.64 ? 145 VAL F C 1 +ATOM 29562 O O . VAL F 1 145 ? 4.986 -40.703 46.193 1.00 42.08 ? 145 VAL F O 1 +ATOM 29563 C CB . VAL F 1 145 ? 4.766 -37.495 46.648 1.00 42.92 ? 145 VAL F CB 1 +ATOM 29564 C CG1 . VAL F 1 145 ? 6.227 -37.875 46.471 1.00 43.11 ? 145 VAL F CG1 1 +ATOM 29565 C CG2 . VAL F 1 145 ? 4.208 -36.905 45.361 1.00 41.98 ? 145 VAL F CG2 1 +ATOM 29566 N N . GLU F 1 146 ? 3.332 -39.789 44.991 1.00 41.15 ? 146 GLU F N 1 +ATOM 29567 C CA . GLU F 1 146 ? 3.469 -40.739 43.903 1.00 41.27 ? 146 GLU F CA 1 +ATOM 29568 C C . GLU F 1 146 ? 3.706 -39.951 42.625 1.00 39.68 ? 146 GLU F C 1 +ATOM 29569 O O . GLU F 1 146 ? 2.973 -39.009 42.332 1.00 38.90 ? 146 GLU F O 1 +ATOM 29570 C CB . GLU F 1 146 ? 2.212 -41.604 43.748 1.00 42.65 ? 146 GLU F CB 1 +ATOM 29571 C CG . GLU F 1 146 ? 0.930 -40.848 43.440 1.00 46.99 ? 146 GLU F CG 1 +ATOM 29572 C CD . GLU F 1 146 ? -0.217 -41.776 43.032 1.00 49.87 ? 146 GLU F CD 1 +ATOM 29573 O OE1 . GLU F 1 146 ? -0.450 -42.780 43.744 1.00 50.53 ? 146 GLU F OE1 1 +ATOM 29574 O OE2 . GLU F 1 146 ? -0.891 -41.503 42.004 1.00 49.72 ? 146 GLU F OE2 1 +ATOM 29575 N N . PHE F 1 147 ? 4.760 -40.295 41.895 1.00 38.21 ? 147 PHE F N 1 +ATOM 29576 C CA . PHE F 1 147 ? 5.020 -39.632 40.632 1.00 38.64 ? 147 PHE F CA 1 +ATOM 29577 C C . PHE F 1 147 ? 5.309 -40.698 39.588 1.00 38.11 ? 147 PHE F C 1 +ATOM 29578 O O . PHE F 1 147 ? 5.515 -41.857 39.930 1.00 37.33 ? 147 PHE F O 1 +ATOM 29579 C CB . PHE F 1 147 ? 6.162 -38.609 40.729 1.00 38.18 ? 147 PHE F CB 1 +ATOM 29580 C CG . PHE F 1 147 ? 7.495 -39.186 41.099 1.00 39.50 ? 147 PHE F CG 1 +ATOM 29581 C CD1 . PHE F 1 147 ? 7.804 -39.461 42.426 1.00 39.01 ? 147 PHE F CD1 1 +ATOM 29582 C CD2 . PHE F 1 147 ? 8.472 -39.383 40.129 1.00 38.40 ? 147 PHE F CD2 1 +ATOM 29583 C CE1 . PHE F 1 147 ? 9.064 -39.915 42.786 1.00 37.74 ? 147 PHE F CE1 1 +ATOM 29584 C CE2 . PHE F 1 147 ? 9.735 -39.837 40.476 1.00 39.96 ? 147 PHE F CE2 1 +ATOM 29585 C CZ . PHE F 1 147 ? 10.034 -40.102 41.815 1.00 39.92 ? 147 PHE F CZ 1 +ATOM 29586 N N . TYR F 1 148 ? 5.303 -40.312 38.318 1.00 36.45 ? 148 TYR F N 1 +ATOM 29587 C CA . TYR F 1 148 ? 5.522 -41.265 37.251 1.00 36.61 ? 148 TYR F CA 1 +ATOM 29588 C C . TYR F 1 148 ? 6.621 -40.852 36.310 1.00 37.02 ? 148 TYR F C 1 +ATOM 29589 O O . TYR F 1 148 ? 6.774 -39.672 36.003 1.00 38.25 ? 148 TYR F O 1 +ATOM 29590 C CB . TYR F 1 148 ? 4.234 -41.455 36.441 1.00 35.36 ? 148 TYR F CB 1 +ATOM 29591 C CG . TYR F 1 148 ? 3.017 -41.797 37.269 1.00 34.21 ? 148 TYR F CG 1 +ATOM 29592 C CD1 . TYR F 1 148 ? 2.443 -40.854 38.120 1.00 35.43 ? 148 TYR F CD1 1 +ATOM 29593 C CD2 . TYR F 1 148 ? 2.426 -43.057 37.189 1.00 33.67 ? 148 TYR F CD2 1 +ATOM 29594 C CE1 . TYR F 1 148 ? 1.303 -41.154 38.872 1.00 35.13 ? 148 TYR F CE1 1 +ATOM 29595 C CE2 . TYR F 1 148 ? 1.280 -43.370 37.937 1.00 34.67 ? 148 TYR F CE2 1 +ATOM 29596 C CZ . TYR F 1 148 ? 0.727 -42.414 38.775 1.00 35.12 ? 148 TYR F CZ 1 +ATOM 29597 O OH . TYR F 1 148 ? -0.398 -42.710 39.513 1.00 33.94 ? 148 TYR F OH 1 +ATOM 29598 N N . VAL F 1 149 ? 7.399 -41.827 35.856 1.00 36.76 ? 149 VAL F N 1 +ATOM 29599 C CA . VAL F 1 149 ? 8.454 -41.550 34.891 1.00 36.83 ? 149 VAL F CA 1 +ATOM 29600 C C . VAL F 1 149 ? 7.882 -42.174 33.622 1.00 37.52 ? 149 VAL F C 1 +ATOM 29601 O O . VAL F 1 149 ? 7.614 -43.372 33.578 1.00 37.20 ? 149 VAL F O 1 +ATOM 29602 C CB . VAL F 1 149 ? 9.780 -42.220 35.283 1.00 35.70 ? 149 VAL F CB 1 +ATOM 29603 C CG1 . VAL F 1 149 ? 10.863 -41.844 34.282 1.00 33.10 ? 149 VAL F CG1 1 +ATOM 29604 C CG2 . VAL F 1 149 ? 10.171 -41.793 36.685 1.00 34.47 ? 149 VAL F CG2 1 +ATOM 29605 N N . ILE F 1 150 ? 7.660 -41.344 32.610 1.00 38.37 ? 150 ILE F N 1 +ATOM 29606 C CA . ILE F 1 150 ? 7.055 -41.792 31.365 1.00 38.79 ? 150 ILE F CA 1 +ATOM 29607 C C . ILE F 1 150 ? 8.038 -41.812 30.205 1.00 40.01 ? 150 ILE F C 1 +ATOM 29608 O O . ILE F 1 150 ? 8.456 -40.761 29.721 1.00 38.36 ? 150 ILE F O 1 +ATOM 29609 C CB . ILE F 1 150 ? 5.873 -40.879 31.021 1.00 38.28 ? 150 ILE F CB 1 +ATOM 29610 C CG1 . ILE F 1 150 ? 4.996 -40.709 32.267 1.00 35.99 ? 150 ILE F CG1 1 +ATOM 29611 C CG2 . ILE F 1 150 ? 5.076 -41.461 29.856 1.00 36.82 ? 150 ILE F CG2 1 +ATOM 29612 C CD1 . ILE F 1 150 ? 3.891 -39.679 32.123 1.00 36.15 ? 150 ILE F CD1 1 +ATOM 29613 N N . GLU F 1 151 ? 8.392 -43.015 29.755 1.00 41.67 ? 151 GLU F N 1 +ATOM 29614 C CA . GLU F 1 151 ? 9.339 -43.167 28.659 1.00 43.73 ? 151 GLU F CA 1 +ATOM 29615 C C . GLU F 1 151 ? 8.769 -42.659 27.345 1.00 42.30 ? 151 GLU F C 1 +ATOM 29616 O O . GLU F 1 151 ? 7.556 -42.666 27.136 1.00 41.67 ? 151 GLU F O 1 +ATOM 29617 C CB . GLU F 1 151 ? 9.752 -44.635 28.509 1.00 48.02 ? 151 GLU F CB 1 +ATOM 29618 C CG . GLU F 1 151 ? 10.492 -45.213 29.721 1.00 56.49 ? 151 GLU F CG 1 +ATOM 29619 C CD . GLU F 1 151 ? 11.695 -44.363 30.160 1.00 62.09 ? 151 GLU F CD 1 +ATOM 29620 O OE1 . GLU F 1 151 ? 12.581 -44.080 29.318 1.00 64.98 ? 151 GLU F OE1 1 +ATOM 29621 O OE2 . GLU F 1 151 ? 11.760 -43.983 31.354 1.00 64.12 ? 151 GLU F OE2 1 +ATOM 29622 N N . GLY F 1 152 ? 9.658 -42.207 26.469 1.00 41.70 ? 152 GLY F N 1 +ATOM 29623 C CA . GLY F 1 152 ? 9.241 -41.712 25.170 1.00 41.51 ? 152 GLY F CA 1 +ATOM 29624 C C . GLY F 1 152 ? 9.390 -42.778 24.098 1.00 39.70 ? 152 GLY F C 1 +ATOM 29625 O O . GLY F 1 152 ? 8.600 -43.716 24.062 1.00 40.69 ? 152 GLY F O 1 +ATOM 29626 N N . PRO F 1 153 ? 10.396 -42.669 23.214 1.00 38.88 ? 153 PRO F N 1 +ATOM 29627 C CA . PRO F 1 153 ? 11.389 -41.588 23.188 1.00 38.55 ? 153 PRO F CA 1 +ATOM 29628 C C . PRO F 1 153 ? 10.878 -40.296 22.535 1.00 37.88 ? 153 PRO F C 1 +ATOM 29629 O O . PRO F 1 153 ? 11.506 -39.244 22.647 1.00 38.49 ? 153 PRO F O 1 +ATOM 29630 C CB . PRO F 1 153 ? 12.544 -42.212 22.419 1.00 37.84 ? 153 PRO F CB 1 +ATOM 29631 C CG . PRO F 1 153 ? 11.821 -43.051 21.401 1.00 37.60 ? 153 PRO F CG 1 +ATOM 29632 C CD . PRO F 1 153 ? 10.724 -43.706 22.218 1.00 37.13 ? 153 PRO F CD 1 +ATOM 29633 N N . ARG F 1 154 ? 9.738 -40.372 21.859 1.00 36.49 ? 154 ARG F N 1 +ATOM 29634 C CA . ARG F 1 154 ? 9.180 -39.189 21.212 1.00 36.20 ? 154 ARG F CA 1 +ATOM 29635 C C . ARG F 1 154 ? 8.366 -38.407 22.233 1.00 34.31 ? 154 ARG F C 1 +ATOM 29636 O O . ARG F 1 154 ? 7.863 -38.979 23.204 1.00 30.88 ? 154 ARG F O 1 +ATOM 29637 C CB . ARG F 1 154 ? 8.258 -39.570 20.044 1.00 35.04 ? 154 ARG F CB 1 +ATOM 29638 C CG . ARG F 1 154 ? 8.921 -40.284 18.871 1.00 37.14 ? 154 ARG F CG 1 +ATOM 29639 C CD . ARG F 1 154 ? 7.839 -40.731 17.869 1.00 37.48 ? 154 ARG F CD 1 +ATOM 29640 N NE . ARG F 1 154 ? 6.809 -41.527 18.537 1.00 38.81 ? 154 ARG F NE 1 +ATOM 29641 C CZ . ARG F 1 154 ? 5.525 -41.566 18.179 1.00 40.79 ? 154 ARG F CZ 1 +ATOM 29642 N NH1 . ARG F 1 154 ? 5.091 -40.854 17.145 1.00 41.74 ? 154 ARG F NH1 1 +ATOM 29643 N NH2 . ARG F 1 154 ? 4.666 -42.307 18.869 1.00 39.46 ? 154 ARG F NH2 1 +ATOM 29644 N N . ILE F 1 155 ? 8.254 -37.099 22.018 1.00 33.61 ? 155 ILE F N 1 +ATOM 29645 C CA . ILE F 1 155 ? 7.463 -36.287 22.919 1.00 34.27 ? 155 ILE F CA 1 +ATOM 29646 C C . ILE F 1 155 ? 6.023 -36.789 22.798 1.00 34.81 ? 155 ILE F C 1 +ATOM 29647 O O . ILE F 1 155 ? 5.301 -36.895 23.793 1.00 34.08 ? 155 ILE F O 1 +ATOM 29648 C CB . ILE F 1 155 ? 7.549 -34.777 22.563 1.00 33.13 ? 155 ILE F CB 1 +ATOM 29649 C CG1 . ILE F 1 155 ? 8.956 -34.255 22.863 1.00 30.58 ? 155 ILE F CG1 1 +ATOM 29650 C CG2 . ILE F 1 155 ? 6.511 -33.990 23.356 1.00 32.12 ? 155 ILE F CG2 1 +ATOM 29651 C CD1 . ILE F 1 155 ? 9.188 -32.836 22.388 1.00 32.05 ? 155 ILE F CD1 1 +ATOM 29652 N N . GLU F 1 156 ? 5.620 -37.126 21.577 1.00 35.96 ? 156 GLU F N 1 +ATOM 29653 C CA . GLU F 1 156 ? 4.274 -37.637 21.340 1.00 36.75 ? 156 GLU F CA 1 +ATOM 29654 C C . GLU F 1 156 ? 4.048 -38.942 22.115 1.00 36.88 ? 156 GLU F C 1 +ATOM 29655 O O . GLU F 1 156 ? 2.935 -39.200 22.588 1.00 35.80 ? 156 GLU F O 1 +ATOM 29656 C CB . GLU F 1 156 ? 4.033 -37.869 19.842 1.00 37.81 ? 156 GLU F CB 1 +ATOM 29657 C CG . GLU F 1 156 ? 2.598 -38.277 19.535 1.00 41.57 ? 156 GLU F CG 1 +ATOM 29658 C CD . GLU F 1 156 ? 2.253 -38.205 18.056 1.00 43.63 ? 156 GLU F CD 1 +ATOM 29659 O OE1 . GLU F 1 156 ? 2.664 -39.108 17.291 1.00 44.91 ? 156 GLU F OE1 1 +ATOM 29660 O OE2 . GLU F 1 156 ? 1.573 -37.232 17.662 1.00 43.59 ? 156 GLU F OE2 1 +ATOM 29661 N N . ASP F 1 157 ? 5.090 -39.769 22.247 1.00 35.25 ? 157 ASP F N 1 +ATOM 29662 C CA . ASP F 1 157 ? 4.963 -41.022 23.009 1.00 35.85 ? 157 ASP F CA 1 +ATOM 29663 C C . ASP F 1 157 ? 4.647 -40.711 24.475 1.00 34.12 ? 157 ASP F C 1 +ATOM 29664 O O . ASP F 1 157 ? 3.772 -41.326 25.098 1.00 31.22 ? 157 ASP F O 1 +ATOM 29665 C CB . ASP F 1 157 ? 6.265 -41.830 22.977 1.00 39.35 ? 157 ASP F CB 1 +ATOM 29666 C CG . ASP F 1 157 ? 6.520 -42.483 21.643 1.00 43.13 ? 157 ASP F CG 1 +ATOM 29667 O OD1 . ASP F 1 157 ? 5.575 -43.127 21.119 1.00 47.52 ? 157 ASP F OD1 1 +ATOM 29668 O OD2 . ASP F 1 157 ? 7.666 -42.367 21.131 1.00 43.00 ? 157 ASP F OD2 1 +ATOM 29669 N N . VAL F 1 158 ? 5.385 -39.753 25.025 1.00 32.72 ? 158 VAL F N 1 +ATOM 29670 C CA . VAL F 1 158 ? 5.181 -39.368 26.404 1.00 32.56 ? 158 VAL F CA 1 +ATOM 29671 C C . VAL F 1 158 ? 3.752 -38.907 26.629 1.00 32.60 ? 158 VAL F C 1 +ATOM 29672 O O . VAL F 1 158 ? 3.110 -39.326 27.585 1.00 32.09 ? 158 VAL F O 1 +ATOM 29673 C CB . VAL F 1 158 ? 6.149 -38.235 26.827 1.00 33.04 ? 158 VAL F CB 1 +ATOM 29674 C CG1 . VAL F 1 158 ? 5.854 -37.809 28.252 1.00 30.33 ? 158 VAL F CG1 1 +ATOM 29675 C CG2 . VAL F 1 158 ? 7.595 -38.704 26.706 1.00 31.01 ? 158 VAL F CG2 1 +ATOM 29676 N N . LEU F 1 159 ? 3.248 -38.053 25.741 1.00 33.75 ? 159 LEU F N 1 +ATOM 29677 C CA . LEU F 1 159 ? 1.889 -37.540 25.880 1.00 34.42 ? 159 LEU F CA 1 +ATOM 29678 C C . LEU F 1 159 ? 0.810 -38.595 25.729 1.00 33.91 ? 159 LEU F C 1 +ATOM 29679 O O . LEU F 1 159 ? -0.225 -38.511 26.382 1.00 32.89 ? 159 LEU F O 1 +ATOM 29680 C CB . LEU F 1 159 ? 1.647 -36.378 24.904 1.00 35.48 ? 159 LEU F CB 1 +ATOM 29681 C CG . LEU F 1 159 ? 2.453 -35.124 25.262 1.00 37.11 ? 159 LEU F CG 1 +ATOM 29682 C CD1 . LEU F 1 159 ? 2.152 -34.008 24.291 1.00 40.21 ? 159 LEU F CD1 1 +ATOM 29683 C CD2 . LEU F 1 159 ? 2.108 -34.687 26.680 1.00 38.96 ? 159 LEU F CD2 1 +ATOM 29684 N N . GLU F 1 160 ? 1.042 -39.587 24.876 1.00 35.03 ? 160 GLU F N 1 +ATOM 29685 C CA . GLU F 1 160 ? 0.057 -40.655 24.702 1.00 37.06 ? 160 GLU F CA 1 +ATOM 29686 C C . GLU F 1 160 ? -0.043 -41.435 26.003 1.00 36.01 ? 160 GLU F C 1 +ATOM 29687 O O . GLU F 1 160 ? -1.135 -41.696 26.502 1.00 36.21 ? 160 GLU F O 1 +ATOM 29688 C CB . GLU F 1 160 ? 0.459 -41.614 23.574 1.00 40.21 ? 160 GLU F CB 1 +ATOM 29689 C CG . GLU F 1 160 ? 0.466 -41.004 22.178 1.00 45.64 ? 160 GLU F CG 1 +ATOM 29690 C CD . GLU F 1 160 ? 0.788 -42.029 21.091 1.00 50.39 ? 160 GLU F CD 1 +ATOM 29691 O OE1 . GLU F 1 160 ? 1.653 -42.908 21.336 1.00 51.17 ? 160 GLU F OE1 1 +ATOM 29692 O OE2 . GLU F 1 160 ? 0.186 -41.950 19.990 1.00 50.12 ? 160 GLU F OE2 1 +ATOM 29693 N N . LYS F 1 161 ? 1.103 -41.802 26.560 1.00 36.13 ? 161 LYS F N 1 +ATOM 29694 C CA . LYS F 1 161 ? 1.107 -42.553 27.808 1.00 36.03 ? 161 LYS F CA 1 +ATOM 29695 C C . LYS F 1 161 ? 0.510 -41.710 28.925 1.00 35.54 ? 161 LYS F C 1 +ATOM 29696 O O . LYS F 1 161 ? -0.303 -42.196 29.716 1.00 34.34 ? 161 LYS F O 1 +ATOM 29697 C CB . LYS F 1 161 ? 2.529 -42.987 28.175 1.00 36.80 ? 161 LYS F CB 1 +ATOM 29698 C CG . LYS F 1 161 ? 3.178 -43.967 27.192 1.00 35.65 ? 161 LYS F CG 1 +ATOM 29699 C CD . LYS F 1 161 ? 4.501 -44.482 27.765 1.00 37.30 ? 161 LYS F CD 1 +ATOM 29700 C CE . LYS F 1 161 ? 5.272 -45.349 26.776 1.00 36.18 ? 161 LYS F CE 1 +ATOM 29701 N NZ . LYS F 1 161 ? 5.790 -44.601 25.605 1.00 35.88 ? 161 LYS F NZ 1 +ATOM 29702 N N . TYR F 1 162 ? 0.909 -40.441 28.984 1.00 35.12 ? 162 TYR F N 1 +ATOM 29703 C CA . TYR F 1 162 ? 0.395 -39.530 30.003 1.00 34.22 ? 162 TYR F CA 1 +ATOM 29704 C C . TYR F 1 162 ? -1.130 -39.433 29.901 1.00 34.07 ? 162 TYR F C 1 +ATOM 29705 O O . TYR F 1 162 ? -1.840 -39.508 30.903 1.00 31.86 ? 162 TYR F O 1 +ATOM 29706 C CB . TYR F 1 162 ? 1.010 -38.137 29.831 1.00 35.09 ? 162 TYR F CB 1 +ATOM 29707 C CG . TYR F 1 162 ? 0.362 -37.090 30.701 1.00 34.14 ? 162 TYR F CG 1 +ATOM 29708 C CD1 . TYR F 1 162 ? 0.603 -37.048 32.078 1.00 34.18 ? 162 TYR F CD1 1 +ATOM 29709 C CD2 . TYR F 1 162 ? -0.549 -36.184 30.161 1.00 34.23 ? 162 TYR F CD2 1 +ATOM 29710 C CE1 . TYR F 1 162 ? -0.052 -36.130 32.892 1.00 35.01 ? 162 TYR F CE1 1 +ATOM 29711 C CE2 . TYR F 1 162 ? -1.213 -35.268 30.962 1.00 35.12 ? 162 TYR F CE2 1 +ATOM 29712 C CZ . TYR F 1 162 ? -0.962 -35.244 32.323 1.00 36.38 ? 162 TYR F CZ 1 +ATOM 29713 O OH . TYR F 1 162 ? -1.635 -34.340 33.107 1.00 36.89 ? 162 TYR F OH 1 +ATOM 29714 N N . THR F 1 163 ? -1.623 -39.270 28.679 1.00 35.29 ? 163 THR F N 1 +ATOM 29715 C CA . THR F 1 163 ? -3.056 -39.166 28.430 1.00 37.85 ? 163 THR F CA 1 +ATOM 29716 C C . THR F 1 163 ? -3.751 -40.472 28.778 1.00 38.67 ? 163 THR F C 1 +ATOM 29717 O O . THR F 1 163 ? -4.878 -40.482 29.277 1.00 37.88 ? 163 THR F O 1 +ATOM 29718 C CB . THR F 1 163 ? -3.333 -38.821 26.954 1.00 38.22 ? 163 THR F CB 1 +ATOM 29719 O OG1 . THR F 1 163 ? -2.746 -37.552 26.657 1.00 41.10 ? 163 THR F OG1 1 +ATOM 29720 C CG2 . THR F 1 163 ? -4.823 -38.741 26.690 1.00 37.51 ? 163 THR F CG2 1 +ATOM 29721 N N . GLU F 1 164 ? -3.075 -41.579 28.502 1.00 40.23 ? 164 GLU F N 1 +ATOM 29722 C CA . GLU F 1 164 ? -3.620 -42.887 28.821 1.00 43.16 ? 164 GLU F CA 1 +ATOM 29723 C C . GLU F 1 164 ? -3.805 -42.952 30.341 1.00 41.84 ? 164 GLU F C 1 +ATOM 29724 O O . GLU F 1 164 ? -4.818 -43.433 30.841 1.00 41.18 ? 164 GLU F O 1 +ATOM 29725 C CB . GLU F 1 164 ? -2.644 -43.974 28.371 1.00 48.95 ? 164 GLU F CB 1 +ATOM 29726 C CG . GLU F 1 164 ? -3.067 -45.389 28.724 1.00 57.10 ? 164 GLU F CG 1 +ATOM 29727 C CD . GLU F 1 164 ? -4.034 -45.973 27.714 1.00 63.02 ? 164 GLU F CD 1 +ATOM 29728 O OE1 . GLU F 1 164 ? -4.909 -45.217 27.226 1.00 65.98 ? 164 GLU F OE1 1 +ATOM 29729 O OE2 . GLU F 1 164 ? -3.922 -47.189 27.415 1.00 66.28 ? 164 GLU F OE2 1 +ATOM 29730 N N . LEU F 1 165 ? -2.816 -42.435 31.064 1.00 40.50 ? 165 LEU F N 1 +ATOM 29731 C CA . LEU F 1 165 ? -2.821 -42.429 32.519 1.00 38.24 ? 165 LEU F CA 1 +ATOM 29732 C C . LEU F 1 165 ? -3.851 -41.498 33.160 1.00 37.75 ? 165 LEU F C 1 +ATOM 29733 O O . LEU F 1 165 ? -4.642 -41.930 33.997 1.00 37.08 ? 165 LEU F O 1 +ATOM 29734 C CB . LEU F 1 165 ? -1.429 -42.048 33.027 1.00 38.28 ? 165 LEU F CB 1 +ATOM 29735 C CG . LEU F 1 165 ? -0.913 -42.590 34.359 1.00 37.87 ? 165 LEU F CG 1 +ATOM 29736 C CD1 . LEU F 1 165 ? -0.036 -41.519 35.003 1.00 36.54 ? 165 LEU F CD1 1 +ATOM 29737 C CD2 . LEU F 1 165 ? -2.052 -42.966 35.266 1.00 36.73 ? 165 LEU F CD2 1 +ATOM 29738 N N . THR F 1 166 ? -3.847 -40.223 32.775 1.00 37.13 ? 166 THR F N 1 +ATOM 29739 C CA . THR F 1 166 ? -4.765 -39.260 33.387 1.00 36.18 ? 166 THR F CA 1 +ATOM 29740 C C . THR F 1 166 ? -6.139 -39.107 32.736 1.00 36.17 ? 166 THR F C 1 +ATOM 29741 O O . THR F 1 166 ? -7.060 -38.582 33.367 1.00 35.63 ? 166 THR F O 1 +ATOM 29742 C CB . THR F 1 166 ? -4.105 -37.867 33.501 1.00 34.69 ? 166 THR F CB 1 +ATOM 29743 O OG1 . THR F 1 166 ? -3.770 -37.380 32.197 1.00 35.36 ? 166 THR F OG1 1 +ATOM 29744 C CG2 . THR F 1 166 ? -2.834 -37.955 34.329 1.00 34.20 ? 166 THR F CG2 1 +ATOM 29745 N N . GLY F 1 167 ? -6.284 -39.570 31.496 1.00 35.19 ? 167 GLY F N 1 +ATOM 29746 C CA . GLY F 1 167 ? -7.565 -39.457 30.821 1.00 36.20 ? 167 GLY F CA 1 +ATOM 29747 C C . GLY F 1 167 ? -7.522 -38.822 29.441 1.00 36.76 ? 167 GLY F C 1 +ATOM 29748 O O . GLY F 1 167 ? -6.865 -37.808 29.226 1.00 37.17 ? 167 GLY F O 1 +ATOM 29749 N N . LYS F 1 168 ? -8.227 -39.425 28.494 1.00 37.40 ? 168 LYS F N 1 +ATOM 29750 C CA . LYS F 1 168 ? -8.271 -38.898 27.139 1.00 39.14 ? 168 LYS F CA 1 +ATOM 29751 C C . LYS F 1 168 ? -9.211 -37.692 27.107 1.00 38.05 ? 168 LYS F C 1 +ATOM 29752 O O . LYS F 1 168 ? -10.203 -37.638 27.845 1.00 36.09 ? 168 LYS F O 1 +ATOM 29753 C CB . LYS F 1 168 ? -8.799 -39.954 26.165 1.00 41.11 ? 168 LYS F CB 1 +ATOM 29754 C CG . LYS F 1 168 ? -7.992 -41.245 26.073 1.00 45.78 ? 168 LYS F CG 1 +ATOM 29755 C CD . LYS F 1 168 ? -6.650 -41.030 25.386 1.00 49.61 ? 168 LYS F CD 1 +ATOM 29756 C CE . LYS F 1 168 ? -5.861 -42.337 25.283 1.00 52.71 ? 168 LYS F CE 1 +ATOM 29757 N NZ . LYS F 1 168 ? -4.466 -42.136 24.763 1.00 53.94 ? 168 LYS F NZ 1 +ATOM 29758 N N . PRO F 1 169 ? -8.902 -36.701 26.265 1.00 36.70 ? 169 PRO F N 1 +ATOM 29759 C CA . PRO F 1 169 ? -9.761 -35.519 26.168 1.00 37.69 ? 169 PRO F CA 1 +ATOM 29760 C C . PRO F 1 169 ? -11.138 -35.940 25.644 1.00 38.38 ? 169 PRO F C 1 +ATOM 29761 O O . PRO F 1 169 ? -11.234 -36.822 24.791 1.00 38.85 ? 169 PRO F O 1 +ATOM 29762 C CB . PRO F 1 169 ? -9.030 -34.649 25.156 1.00 36.14 ? 169 PRO F CB 1 +ATOM 29763 C CG . PRO F 1 169 ? -7.603 -35.031 25.347 1.00 37.15 ? 169 PRO F CG 1 +ATOM 29764 C CD . PRO F 1 169 ? -7.662 -36.521 25.494 1.00 36.19 ? 169 PRO F CD 1 +ATOM 29765 N N . PHE F 1 170 ? -12.204 -35.331 26.151 1.00 39.33 ? 170 PHE F N 1 +ATOM 29766 C CA . PHE F 1 170 ? -13.537 -35.674 25.661 1.00 39.50 ? 170 PHE F CA 1 +ATOM 29767 C C . PHE F 1 170 ? -13.633 -35.120 24.250 1.00 38.12 ? 170 PHE F C 1 +ATOM 29768 O O . PHE F 1 170 ? -12.877 -34.227 23.879 1.00 37.13 ? 170 PHE F O 1 +ATOM 29769 C CB . PHE F 1 170 ? -14.633 -35.041 26.530 1.00 40.81 ? 170 PHE F CB 1 +ATOM 29770 C CG . PHE F 1 170 ? -14.758 -33.537 26.375 1.00 43.32 ? 170 PHE F CG 1 +ATOM 29771 C CD1 . PHE F 1 170 ? -13.748 -32.683 26.813 1.00 43.43 ? 170 PHE F CD1 1 +ATOM 29772 C CD2 . PHE F 1 170 ? -15.904 -32.977 25.810 1.00 44.30 ? 170 PHE F CD2 1 +ATOM 29773 C CE1 . PHE F 1 170 ? -13.878 -31.297 26.695 1.00 43.62 ? 170 PHE F CE1 1 +ATOM 29774 C CE2 . PHE F 1 170 ? -16.043 -31.589 25.687 1.00 43.35 ? 170 PHE F CE2 1 +ATOM 29775 C CZ . PHE F 1 170 ? -15.031 -30.751 26.130 1.00 43.73 ? 170 PHE F CZ 1 +ATOM 29776 N N . LEU F 1 171 ? -14.542 -35.659 23.453 1.00 38.13 ? 171 LEU F N 1 +ATOM 29777 C CA . LEU F 1 171 ? -14.716 -35.164 22.095 1.00 37.73 ? 171 LEU F CA 1 +ATOM 29778 C C . LEU F 1 171 ? -15.891 -34.188 22.104 1.00 37.97 ? 171 LEU F C 1 +ATOM 29779 O O . LEU F 1 171 ? -17.047 -34.583 22.295 1.00 37.69 ? 171 LEU F O 1 +ATOM 29780 C CB . LEU F 1 171 ? -15.000 -36.313 21.126 1.00 37.50 ? 171 LEU F CB 1 +ATOM 29781 C CG . LEU F 1 171 ? -15.263 -35.877 19.672 1.00 39.97 ? 171 LEU F CG 1 +ATOM 29782 C CD1 . LEU F 1 171 ? -14.042 -35.155 19.105 1.00 39.51 ? 171 LEU F CD1 1 +ATOM 29783 C CD2 . LEU F 1 171 ? -15.593 -37.085 18.830 1.00 37.86 ? 171 LEU F CD2 1 +ATOM 29784 N N . PRO F 1 172 ? -15.606 -32.891 21.923 1.00 37.06 ? 172 PRO F N 1 +ATOM 29785 C CA . PRO F 1 172 ? -16.678 -31.893 21.919 1.00 34.95 ? 172 PRO F CA 1 +ATOM 29786 C C . PRO F 1 172 ? -17.331 -31.774 20.548 1.00 34.35 ? 172 PRO F C 1 +ATOM 29787 O O . PRO F 1 172 ? -16.823 -32.315 19.560 1.00 32.42 ? 172 PRO F O 1 +ATOM 29788 C CB . PRO F 1 172 ? -15.955 -30.620 22.333 1.00 34.03 ? 172 PRO F CB 1 +ATOM 29789 C CG . PRO F 1 172 ? -14.628 -30.786 21.696 1.00 36.21 ? 172 PRO F CG 1 +ATOM 29790 C CD . PRO F 1 172 ? -14.280 -32.249 21.918 1.00 36.23 ? 172 PRO F CD 1 +ATOM 29791 N N . PRO F 1 173 ? -18.480 -31.084 20.475 1.00 34.08 ? 173 PRO F N 1 +ATOM 29792 C CA . PRO F 1 173 ? -19.173 -30.915 19.195 1.00 34.21 ? 173 PRO F CA 1 +ATOM 29793 C C . PRO F 1 173 ? -18.386 -29.955 18.307 1.00 35.28 ? 173 PRO F C 1 +ATOM 29794 O O . PRO F 1 173 ? -17.616 -29.135 18.791 1.00 35.41 ? 173 PRO F O 1 +ATOM 29795 C CB . PRO F 1 173 ? -20.523 -30.351 19.609 1.00 33.92 ? 173 PRO F CB 1 +ATOM 29796 C CG . PRO F 1 173 ? -20.182 -29.552 20.841 1.00 35.44 ? 173 PRO F CG 1 +ATOM 29797 C CD . PRO F 1 173 ? -19.236 -30.458 21.578 1.00 33.13 ? 173 PRO F CD 1 +ATOM 29798 N N . MET F 1 174 ? -18.568 -30.069 17.003 1.00 36.89 ? 174 MET F N 1 +ATOM 29799 C CA . MET F 1 174 ? -17.862 -29.210 16.079 1.00 37.01 ? 174 MET F CA 1 +ATOM 29800 C C . MET F 1 174 ? -18.159 -27.723 16.307 1.00 36.09 ? 174 MET F C 1 +ATOM 29801 O O . MET F 1 174 ? -17.288 -26.879 16.103 1.00 34.70 ? 174 MET F O 1 +ATOM 29802 C CB . MET F 1 174 ? -18.191 -29.607 14.635 1.00 39.52 ? 174 MET F CB 1 +ATOM 29803 C CG . MET F 1 174 ? -17.456 -28.780 13.585 1.00 44.45 ? 174 MET F CG 1 +ATOM 29804 S SD . MET F 1 174 ? -17.579 -29.468 11.916 1.00 48.70 ? 174 MET F SD 1 +ATOM 29805 C CE . MET F 1 174 ? -15.849 -29.692 11.515 1.00 50.43 ? 174 MET F CE 1 +ATOM 29806 N N . TRP F 1 175 ? -19.369 -27.387 16.741 1.00 34.42 ? 175 TRP F N 1 +ATOM 29807 C CA . TRP F 1 175 ? -19.668 -25.978 16.961 1.00 34.32 ? 175 TRP F CA 1 +ATOM 29808 C C . TRP F 1 175 ? -18.846 -25.351 18.097 1.00 34.81 ? 175 TRP F C 1 +ATOM 29809 O O . TRP F 1 175 ? -18.744 -24.129 18.201 1.00 34.43 ? 175 TRP F O 1 +ATOM 29810 C CB . TRP F 1 175 ? -21.167 -25.756 17.217 1.00 33.03 ? 175 TRP F CB 1 +ATOM 29811 C CG . TRP F 1 175 ? -21.777 -26.513 18.369 1.00 33.94 ? 175 TRP F CG 1 +ATOM 29812 C CD1 . TRP F 1 175 ? -22.505 -27.675 18.298 1.00 32.92 ? 175 TRP F CD1 1 +ATOM 29813 C CD2 . TRP F 1 175 ? -21.773 -26.130 19.749 1.00 33.77 ? 175 TRP F CD2 1 +ATOM 29814 N NE1 . TRP F 1 175 ? -22.958 -28.030 19.547 1.00 32.91 ? 175 TRP F NE1 1 +ATOM 29815 C CE2 . TRP F 1 175 ? -22.524 -27.100 20.456 1.00 34.46 ? 175 TRP F CE2 1 +ATOM 29816 C CE3 . TRP F 1 175 ? -21.212 -25.061 20.457 1.00 34.54 ? 175 TRP F CE3 1 +ATOM 29817 C CZ2 . TRP F 1 175 ? -22.727 -27.029 21.838 1.00 34.13 ? 175 TRP F CZ2 1 +ATOM 29818 C CZ3 . TRP F 1 175 ? -21.415 -24.990 21.839 1.00 35.23 ? 175 TRP F CZ3 1 +ATOM 29819 C CH2 . TRP F 1 175 ? -22.167 -25.970 22.510 1.00 35.21 ? 175 TRP F CH2 1 +ATOM 29820 N N . ALA F 1 176 ? -18.252 -26.184 18.942 1.00 33.92 ? 176 ALA F N 1 +ATOM 29821 C CA . ALA F 1 176 ? -17.452 -25.682 20.052 1.00 34.83 ? 176 ALA F CA 1 +ATOM 29822 C C . ALA F 1 176 ? -16.170 -25.026 19.534 1.00 34.22 ? 176 ALA F C 1 +ATOM 29823 O O . ALA F 1 176 ? -15.510 -24.286 20.251 1.00 32.89 ? 176 ALA F O 1 +ATOM 29824 C CB . ALA F 1 176 ? -17.116 -26.817 21.009 1.00 33.95 ? 176 ALA F CB 1 +ATOM 29825 N N . PHE F 1 177 ? -15.830 -25.293 18.279 1.00 33.67 ? 177 PHE F N 1 +ATOM 29826 C CA . PHE F 1 177 ? -14.637 -24.714 17.686 1.00 33.70 ? 177 PHE F CA 1 +ATOM 29827 C C . PHE F 1 177 ? -14.977 -23.549 16.755 1.00 34.21 ? 177 PHE F C 1 +ATOM 29828 O O . PHE F 1 177 ? -14.109 -23.026 16.046 1.00 34.49 ? 177 PHE F O 1 +ATOM 29829 C CB . PHE F 1 177 ? -13.847 -25.773 16.917 1.00 34.31 ? 177 PHE F CB 1 +ATOM 29830 C CG . PHE F 1 177 ? -13.427 -26.945 17.757 1.00 34.98 ? 177 PHE F CG 1 +ATOM 29831 C CD1 . PHE F 1 177 ? -14.334 -27.953 18.078 1.00 35.78 ? 177 PHE F CD1 1 +ATOM 29832 C CD2 . PHE F 1 177 ? -12.130 -27.029 18.252 1.00 36.38 ? 177 PHE F CD2 1 +ATOM 29833 C CE1 . PHE F 1 177 ? -13.953 -29.029 18.885 1.00 36.03 ? 177 PHE F CE1 1 +ATOM 29834 C CE2 . PHE F 1 177 ? -11.735 -28.100 19.060 1.00 35.56 ? 177 PHE F CE2 1 +ATOM 29835 C CZ . PHE F 1 177 ? -12.645 -29.100 19.377 1.00 36.09 ? 177 PHE F CZ 1 +ATOM 29836 N N . GLY F 1 178 ? -16.240 -23.134 16.766 1.00 34.15 ? 178 GLY F N 1 +ATOM 29837 C CA . GLY F 1 178 ? -16.651 -22.023 15.928 1.00 35.06 ? 178 GLY F CA 1 +ATOM 29838 C C . GLY F 1 178 ? -16.353 -20.674 16.571 1.00 35.62 ? 178 GLY F C 1 +ATOM 29839 O O . GLY F 1 178 ? -15.763 -20.605 17.653 1.00 35.85 ? 178 GLY F O 1 +ATOM 29840 N N . TYR F 1 179 ? -16.766 -19.601 15.907 1.00 34.30 ? 179 TYR F N 1 +ATOM 29841 C CA . TYR F 1 179 ? -16.540 -18.253 16.395 1.00 33.84 ? 179 TYR F CA 1 +ATOM 29842 C C . TYR F 1 179 ? -17.534 -17.899 17.499 1.00 33.36 ? 179 TYR F C 1 +ATOM 29843 O O . TYR F 1 179 ? -18.731 -17.867 17.276 1.00 33.34 ? 179 TYR F O 1 +ATOM 29844 C CB . TYR F 1 179 ? -16.651 -17.283 15.221 1.00 34.70 ? 179 TYR F CB 1 +ATOM 29845 C CG . TYR F 1 179 ? -16.518 -15.824 15.574 1.00 36.52 ? 179 TYR F CG 1 +ATOM 29846 C CD1 . TYR F 1 179 ? -15.546 -15.384 16.477 1.00 37.29 ? 179 TYR F CD1 1 +ATOM 29847 C CD2 . TYR F 1 179 ? -17.328 -14.870 14.962 1.00 35.93 ? 179 TYR F CD2 1 +ATOM 29848 C CE1 . TYR F 1 179 ? -15.387 -14.022 16.758 1.00 38.50 ? 179 TYR F CE1 1 +ATOM 29849 C CE2 . TYR F 1 179 ? -17.178 -13.512 15.231 1.00 37.59 ? 179 TYR F CE2 1 +ATOM 29850 C CZ . TYR F 1 179 ? -16.207 -13.092 16.129 1.00 38.58 ? 179 TYR F CZ 1 +ATOM 29851 O OH . TYR F 1 179 ? -16.051 -11.748 16.386 1.00 37.36 ? 179 TYR F OH 1 +ATOM 29852 N N . MET F 1 180 ? -17.022 -17.638 18.696 1.00 33.16 ? 180 MET F N 1 +ATOM 29853 C CA . MET F 1 180 ? -17.855 -17.302 19.841 1.00 34.11 ? 180 MET F CA 1 +ATOM 29854 C C . MET F 1 180 ? -17.712 -15.829 20.205 1.00 34.79 ? 180 MET F C 1 +ATOM 29855 O O . MET F 1 180 ? -16.605 -15.292 20.213 1.00 34.29 ? 180 MET F O 1 +ATOM 29856 C CB . MET F 1 180 ? -17.424 -18.121 21.060 1.00 36.76 ? 180 MET F CB 1 +ATOM 29857 C CG . MET F 1 180 ? -17.254 -19.604 20.813 1.00 40.17 ? 180 MET F CG 1 +ATOM 29858 S SD . MET F 1 180 ? -18.823 -20.456 20.606 1.00 42.86 ? 180 MET F SD 1 +ATOM 29859 C CE . MET F 1 180 ? -18.368 -22.110 21.078 1.00 43.66 ? 180 MET F CE 1 +ATOM 29860 N N . ILE F 1 181 ? -18.825 -15.172 20.507 1.00 33.61 ? 181 ILE F N 1 +ATOM 29861 C CA . ILE F 1 181 ? -18.761 -13.780 20.915 1.00 32.72 ? 181 ILE F CA 1 +ATOM 29862 C C . ILE F 1 181 ? -19.142 -13.749 22.380 1.00 31.11 ? 181 ILE F C 1 +ATOM 29863 O O . ILE F 1 181 ? -19.994 -14.501 22.833 1.00 30.66 ? 181 ILE F O 1 +ATOM 29864 C CB . ILE F 1 181 ? -19.711 -12.871 20.097 1.00 32.60 ? 181 ILE F CB 1 +ATOM 29865 C CG1 . ILE F 1 181 ? -21.161 -13.310 20.274 1.00 31.59 ? 181 ILE F CG1 1 +ATOM 29866 C CG2 . ILE F 1 181 ? -19.302 -12.897 18.644 1.00 31.83 ? 181 ILE F CG2 1 +ATOM 29867 C CD1 . ILE F 1 181 ? -22.137 -12.385 19.603 1.00 35.49 ? 181 ILE F CD1 1 +ATOM 29868 N N . SER F 1 182 ? -18.505 -12.869 23.124 1.00 31.29 ? 182 SER F N 1 +ATOM 29869 C CA . SER F 1 182 ? -18.757 -12.790 24.546 1.00 32.18 ? 182 SER F CA 1 +ATOM 29870 C C . SER F 1 182 ? -18.371 -11.417 25.059 1.00 31.99 ? 182 SER F C 1 +ATOM 29871 O O . SER F 1 182 ? -17.696 -10.654 24.387 1.00 33.14 ? 182 SER F O 1 +ATOM 29872 C CB . SER F 1 182 ? -17.921 -13.868 25.258 1.00 31.76 ? 182 SER F CB 1 +ATOM 29873 O OG . SER F 1 182 ? -17.933 -13.718 26.664 1.00 31.53 ? 182 SER F OG 1 +ATOM 29874 N N . ARG F 1 183 ? -18.820 -11.103 26.256 1.00 32.47 ? 183 ARG F N 1 +ATOM 29875 C CA . ARG F 1 183 ? -18.479 -9.844 26.867 1.00 33.21 ? 183 ARG F CA 1 +ATOM 29876 C C . ARG F 1 183 ? -18.880 -9.958 28.321 1.00 33.76 ? 183 ARG F C 1 +ATOM 29877 O O . ARG F 1 183 ? -19.596 -10.868 28.707 1.00 36.02 ? 183 ARG F O 1 +ATOM 29878 C CB . ARG F 1 183 ? -19.218 -8.676 26.200 1.00 33.12 ? 183 ARG F CB 1 +ATOM 29879 C CG . ARG F 1 183 ? -18.722 -7.315 26.684 1.00 34.62 ? 183 ARG F CG 1 +ATOM 29880 C CD . ARG F 1 183 ? -19.504 -6.138 26.128 1.00 35.28 ? 183 ARG F CD 1 +ATOM 29881 N NE . ARG F 1 183 ? -19.134 -4.887 26.797 1.00 35.99 ? 183 ARG F NE 1 +ATOM 29882 C CZ . ARG F 1 183 ? -18.110 -4.109 26.445 1.00 36.14 ? 183 ARG F CZ 1 +ATOM 29883 N NH1 . ARG F 1 183 ? -17.343 -4.440 25.419 1.00 36.18 ? 183 ARG F NH1 1 +ATOM 29884 N NH2 . ARG F 1 183 ? -17.845 -2.996 27.125 1.00 35.52 ? 183 ARG F NH2 1 +ATOM 29885 N N . TYR F 1 184 ? -18.397 -9.033 29.127 1.00 35.55 ? 184 TYR F N 1 +ATOM 29886 C CA . TYR F 1 184 ? -18.708 -9.003 30.534 1.00 35.57 ? 184 TYR F CA 1 +ATOM 29887 C C . TYR F 1 184 ? -19.415 -7.676 30.778 1.00 35.57 ? 184 TYR F C 1 +ATOM 29888 O O . TYR F 1 184 ? -18.788 -6.725 31.229 1.00 36.70 ? 184 TYR F O 1 +ATOM 29889 C CB . TYR F 1 184 ? -17.395 -9.104 31.316 1.00 36.54 ? 184 TYR F CB 1 +ATOM 29890 C CG . TYR F 1 184 ? -17.476 -8.807 32.793 1.00 37.55 ? 184 TYR F CG 1 +ATOM 29891 C CD1 . TYR F 1 184 ? -18.635 -9.067 33.519 1.00 36.81 ? 184 TYR F CD1 1 +ATOM 29892 C CD2 . TYR F 1 184 ? -16.367 -8.296 33.476 1.00 38.60 ? 184 TYR F CD2 1 +ATOM 29893 C CE1 . TYR F 1 184 ? -18.687 -8.825 34.889 1.00 38.96 ? 184 TYR F CE1 1 +ATOM 29894 C CE2 . TYR F 1 184 ? -16.411 -8.055 34.849 1.00 37.62 ? 184 TYR F CE2 1 +ATOM 29895 C CZ . TYR F 1 184 ? -17.570 -8.320 35.544 1.00 37.86 ? 184 TYR F CZ 1 +ATOM 29896 O OH . TYR F 1 184 ? -17.622 -8.086 36.895 1.00 40.70 ? 184 TYR F OH 1 +ATOM 29897 N N . SER F 1 185 ? -20.713 -7.591 30.477 1.00 36.23 ? 185 SER F N 1 +ATOM 29898 C CA . SER F 1 185 ? -21.522 -8.683 29.930 1.00 37.35 ? 185 SER F CA 1 +ATOM 29899 C C . SER F 1 185 ? -22.483 -8.143 28.865 1.00 37.79 ? 185 SER F C 1 +ATOM 29900 O O . SER F 1 185 ? -22.575 -6.932 28.661 1.00 37.77 ? 185 SER F O 1 +ATOM 29901 C CB . SER F 1 185 ? -22.378 -9.317 31.032 1.00 37.10 ? 185 SER F CB 1 +ATOM 29902 O OG . SER F 1 185 ? -21.619 -9.649 32.176 1.00 41.28 ? 185 SER F OG 1 +ATOM 29903 N N . TYR F 1 186 ? -23.203 -9.047 28.200 1.00 37.61 ? 186 TYR F N 1 +ATOM 29904 C CA . TYR F 1 186 ? -24.200 -8.665 27.200 1.00 36.31 ? 186 TYR F CA 1 +ATOM 29905 C C . TYR F 1 186 ? -25.563 -8.742 27.878 1.00 36.33 ? 186 TYR F C 1 +ATOM 29906 O O . TYR F 1 186 ? -25.891 -9.759 28.478 1.00 36.29 ? 186 TYR F O 1 +ATOM 29907 C CB . TYR F 1 186 ? -24.200 -9.628 26.018 1.00 36.71 ? 186 TYR F CB 1 +ATOM 29908 C CG . TYR F 1 186 ? -23.052 -9.464 25.059 1.00 37.24 ? 186 TYR F CG 1 +ATOM 29909 C CD1 . TYR F 1 186 ? -22.673 -8.198 24.595 1.00 35.78 ? 186 TYR F CD1 1 +ATOM 29910 C CD2 . TYR F 1 186 ? -22.363 -10.581 24.576 1.00 37.32 ? 186 TYR F CD2 1 +ATOM 29911 C CE1 . TYR F 1 186 ? -21.637 -8.052 23.674 1.00 36.55 ? 186 TYR F CE1 1 +ATOM 29912 C CE2 . TYR F 1 186 ? -21.328 -10.444 23.652 1.00 37.57 ? 186 TYR F CE2 1 +ATOM 29913 C CZ . TYR F 1 186 ? -20.972 -9.177 23.208 1.00 38.39 ? 186 TYR F CZ 1 +ATOM 29914 O OH . TYR F 1 186 ? -19.947 -9.043 22.297 1.00 41.36 ? 186 TYR F OH 1 +ATOM 29915 N N . TYR F 1 187 ? -26.348 -7.671 27.782 1.00 36.20 ? 187 TYR F N 1 +ATOM 29916 C CA . TYR F 1 187 ? -27.671 -7.619 28.395 1.00 36.95 ? 187 TYR F CA 1 +ATOM 29917 C C . TYR F 1 187 ? -28.303 -6.259 28.122 1.00 37.18 ? 187 TYR F C 1 +ATOM 29918 O O . TYR F 1 187 ? -27.611 -5.321 27.748 1.00 37.78 ? 187 TYR F O 1 +ATOM 29919 C CB . TYR F 1 187 ? -27.570 -7.833 29.905 1.00 37.93 ? 187 TYR F CB 1 +ATOM 29920 C CG . TYR F 1 187 ? -26.757 -6.778 30.621 1.00 40.06 ? 187 TYR F CG 1 +ATOM 29921 C CD1 . TYR F 1 187 ? -25.365 -6.749 30.516 1.00 41.02 ? 187 TYR F CD1 1 +ATOM 29922 C CD2 . TYR F 1 187 ? -27.379 -5.801 31.395 1.00 41.42 ? 187 TYR F CD2 1 +ATOM 29923 C CE1 . TYR F 1 187 ? -24.611 -5.774 31.166 1.00 41.86 ? 187 TYR F CE1 1 +ATOM 29924 C CE2 . TYR F 1 187 ? -26.637 -4.817 32.053 1.00 42.75 ? 187 TYR F CE2 1 +ATOM 29925 C CZ . TYR F 1 187 ? -25.250 -4.808 31.936 1.00 43.90 ? 187 TYR F CZ 1 +ATOM 29926 O OH . TYR F 1 187 ? -24.506 -3.844 32.603 1.00 43.44 ? 187 TYR F OH 1 +ATOM 29927 N N . PRO F 1 188 ? -29.635 -6.140 28.270 1.00 36.97 ? 188 PRO F N 1 +ATOM 29928 C CA . PRO F 1 188 ? -30.598 -7.179 28.652 1.00 36.89 ? 188 PRO F CA 1 +ATOM 29929 C C . PRO F 1 188 ? -30.793 -8.164 27.495 1.00 36.82 ? 188 PRO F C 1 +ATOM 29930 O O . PRO F 1 188 ? -30.158 -8.026 26.450 1.00 35.85 ? 188 PRO F O 1 +ATOM 29931 C CB . PRO F 1 188 ? -31.856 -6.377 28.975 1.00 36.45 ? 188 PRO F CB 1 +ATOM 29932 C CG . PRO F 1 188 ? -31.769 -5.257 28.001 1.00 37.07 ? 188 PRO F CG 1 +ATOM 29933 C CD . PRO F 1 188 ? -30.316 -4.850 28.063 1.00 35.61 ? 188 PRO F CD 1 +ATOM 29934 N N . GLN F 1 189 ? -31.674 -9.142 27.664 1.00 37.41 ? 189 GLN F N 1 +ATOM 29935 C CA . GLN F 1 189 ? -31.864 -10.154 26.623 1.00 38.19 ? 189 GLN F CA 1 +ATOM 29936 C C . GLN F 1 189 ? -32.159 -9.665 25.208 1.00 37.87 ? 189 GLN F C 1 +ATOM 29937 O O . GLN F 1 189 ? -31.710 -10.277 24.247 1.00 35.59 ? 189 GLN F O 1 +ATOM 29938 C CB . GLN F 1 189 ? -32.920 -11.182 27.053 1.00 38.70 ? 189 GLN F CB 1 +ATOM 29939 C CG . GLN F 1 189 ? -34.352 -10.682 27.146 1.00 37.19 ? 189 GLN F CG 1 +ATOM 29940 C CD . GLN F 1 189 ? -35.282 -11.771 27.636 1.00 37.24 ? 189 GLN F CD 1 +ATOM 29941 O OE1 . GLN F 1 189 ? -35.383 -12.016 28.834 1.00 38.00 ? 189 GLN F OE1 1 +ATOM 29942 N NE2 . GLN F 1 189 ? -35.949 -12.446 26.706 1.00 37.59 ? 189 GLN F NE2 1 +ATOM 29943 N N . ASP F 1 190 ? -32.893 -8.567 25.061 1.00 39.97 ? 190 ASP F N 1 +ATOM 29944 C CA . ASP F 1 190 ? -33.185 -8.072 23.720 1.00 42.28 ? 190 ASP F CA 1 +ATOM 29945 C C . ASP F 1 190 ? -31.918 -7.609 23.011 1.00 41.17 ? 190 ASP F C 1 +ATOM 29946 O O . ASP F 1 190 ? -31.791 -7.752 21.796 1.00 40.95 ? 190 ASP F O 1 +ATOM 29947 C CB . ASP F 1 190 ? -34.191 -6.921 23.765 1.00 47.75 ? 190 ASP F CB 1 +ATOM 29948 C CG . ASP F 1 190 ? -35.579 -7.371 24.197 1.00 54.10 ? 190 ASP F CG 1 +ATOM 29949 O OD1 . ASP F 1 190 ? -35.953 -8.541 23.918 1.00 55.97 ? 190 ASP F OD1 1 +ATOM 29950 O OD2 . ASP F 1 190 ? -36.302 -6.545 24.804 1.00 57.69 ? 190 ASP F OD2 1 +ATOM 29951 N N . LYS F 1 191 ? -30.984 -7.046 23.769 1.00 39.81 ? 191 LYS F N 1 +ATOM 29952 C CA . LYS F 1 191 ? -29.733 -6.576 23.191 1.00 39.44 ? 191 LYS F CA 1 +ATOM 29953 C C . LYS F 1 191 ? -28.881 -7.742 22.709 1.00 38.54 ? 191 LYS F C 1 +ATOM 29954 O O . LYS F 1 191 ? -28.142 -7.614 21.729 1.00 36.68 ? 191 LYS F O 1 +ATOM 29955 C CB . LYS F 1 191 ? -28.949 -5.744 24.211 1.00 40.25 ? 191 LYS F CB 1 +ATOM 29956 C CG . LYS F 1 191 ? -29.442 -4.321 24.348 1.00 40.83 ? 191 LYS F CG 1 +ATOM 29957 C CD . LYS F 1 191 ? -29.067 -3.502 23.124 1.00 44.04 ? 191 LYS F CD 1 +ATOM 29958 C CE . LYS F 1 191 ? -29.569 -2.066 23.234 1.00 45.86 ? 191 LYS F CE 1 +ATOM 29959 N NZ . LYS F 1 191 ? -31.062 -1.992 23.189 1.00 47.87 ? 191 LYS F NZ 1 +ATOM 29960 N N . VAL F 1 192 ? -28.990 -8.878 23.397 1.00 37.57 ? 192 VAL F N 1 +ATOM 29961 C CA . VAL F 1 192 ? -28.232 -10.063 23.029 1.00 36.78 ? 192 VAL F CA 1 +ATOM 29962 C C . VAL F 1 192 ? -28.638 -10.493 21.633 1.00 36.77 ? 192 VAL F C 1 +ATOM 29963 O O . VAL F 1 192 ? -27.791 -10.753 20.782 1.00 35.45 ? 192 VAL F O 1 +ATOM 29964 C CB . VAL F 1 192 ? -28.491 -11.216 24.026 1.00 37.68 ? 192 VAL F CB 1 +ATOM 29965 C CG1 . VAL F 1 192 ? -27.812 -12.501 23.548 1.00 35.87 ? 192 VAL F CG1 1 +ATOM 29966 C CG2 . VAL F 1 192 ? -27.968 -10.820 25.401 1.00 37.37 ? 192 VAL F CG2 1 +ATOM 29967 N N . VAL F 1 193 ? -29.946 -10.539 21.400 1.00 38.02 ? 193 VAL F N 1 +ATOM 29968 C CA . VAL F 1 193 ? -30.475 -10.936 20.110 1.00 39.08 ? 193 VAL F CA 1 +ATOM 29969 C C . VAL F 1 193 ? -30.177 -9.902 19.041 1.00 39.99 ? 193 VAL F C 1 +ATOM 29970 O O . VAL F 1 193 ? -29.849 -10.257 17.911 1.00 41.00 ? 193 VAL F O 1 +ATOM 29971 C CB . VAL F 1 193 ? -31.989 -11.171 20.184 1.00 40.04 ? 193 VAL F CB 1 +ATOM 29972 C CG1 . VAL F 1 193 ? -32.502 -11.678 18.844 1.00 38.63 ? 193 VAL F CG1 1 +ATOM 29973 C CG2 . VAL F 1 193 ? -32.292 -12.181 21.276 1.00 39.67 ? 193 VAL F CG2 1 +ATOM 29974 N N . GLU F 1 194 ? -30.281 -8.625 19.394 1.00 40.52 ? 194 GLU F N 1 +ATOM 29975 C CA . GLU F 1 194 ? -29.999 -7.563 18.438 1.00 42.03 ? 194 GLU F CA 1 +ATOM 29976 C C . GLU F 1 194 ? -28.577 -7.678 17.917 1.00 40.49 ? 194 GLU F C 1 +ATOM 29977 O O . GLU F 1 194 ? -28.332 -7.568 16.714 1.00 40.44 ? 194 GLU F O 1 +ATOM 29978 C CB . GLU F 1 194 ? -30.181 -6.194 19.084 1.00 46.08 ? 194 GLU F CB 1 +ATOM 29979 C CG . GLU F 1 194 ? -31.622 -5.816 19.378 1.00 54.47 ? 194 GLU F CG 1 +ATOM 29980 C CD . GLU F 1 194 ? -31.729 -4.543 20.225 1.00 60.05 ? 194 GLU F CD 1 +ATOM 29981 O OE1 . GLU F 1 194 ? -31.011 -3.556 19.928 1.00 61.77 ? 194 GLU F OE1 1 +ATOM 29982 O OE2 . GLU F 1 194 ? -32.538 -4.525 21.183 1.00 63.16 ? 194 GLU F OE2 1 +ATOM 29983 N N . LEU F 1 195 ? -27.640 -7.904 18.826 1.00 40.50 ? 195 LEU F N 1 +ATOM 29984 C CA . LEU F 1 195 ? -26.237 -8.015 18.451 1.00 39.87 ? 195 LEU F CA 1 +ATOM 29985 C C . LEU F 1 195 ? -26.000 -9.223 17.559 1.00 39.28 ? 195 LEU F C 1 +ATOM 29986 O O . LEU F 1 195 ? -25.295 -9.131 16.556 1.00 39.20 ? 195 LEU F O 1 +ATOM 29987 C CB . LEU F 1 195 ? -25.350 -8.100 19.700 1.00 40.01 ? 195 LEU F CB 1 +ATOM 29988 C CG . LEU F 1 195 ? -23.849 -8.201 19.408 1.00 40.61 ? 195 LEU F CG 1 +ATOM 29989 C CD1 . LEU F 1 195 ? -23.388 -7.005 18.576 1.00 37.38 ? 195 LEU F CD1 1 +ATOM 29990 C CD2 . LEU F 1 195 ? -23.090 -8.266 20.715 1.00 40.40 ? 195 LEU F CD2 1 +ATOM 29991 N N . VAL F 1 196 ? -26.588 -10.359 17.917 1.00 39.14 ? 196 VAL F N 1 +ATOM 29992 C CA . VAL F 1 196 ? -26.418 -11.556 17.107 1.00 38.69 ? 196 VAL F CA 1 +ATOM 29993 C C . VAL F 1 196 ? -26.961 -11.310 15.697 1.00 38.99 ? 196 VAL F C 1 +ATOM 29994 O O . VAL F 1 196 ? -26.352 -11.726 14.707 1.00 37.85 ? 196 VAL F O 1 +ATOM 29995 C CB . VAL F 1 196 ? -27.134 -12.776 17.739 1.00 38.71 ? 196 VAL F CB 1 +ATOM 29996 C CG1 . VAL F 1 196 ? -27.176 -13.935 16.746 1.00 37.86 ? 196 VAL F CG1 1 +ATOM 29997 C CG2 . VAL F 1 196 ? -26.401 -13.212 18.990 1.00 37.52 ? 196 VAL F CG2 1 +ATOM 29998 N N . ASP F 1 197 ? -28.100 -10.630 15.604 1.00 39.63 ? 197 ASP F N 1 +ATOM 29999 C CA . ASP F 1 197 ? -28.683 -10.330 14.303 1.00 41.60 ? 197 ASP F CA 1 +ATOM 30000 C C . ASP F 1 197 ? -27.766 -9.464 13.442 1.00 41.33 ? 197 ASP F C 1 +ATOM 30001 O O . ASP F 1 197 ? -27.568 -9.745 12.259 1.00 39.88 ? 197 ASP F O 1 +ATOM 30002 C CB . ASP F 1 197 ? -30.034 -9.635 14.458 1.00 44.93 ? 197 ASP F CB 1 +ATOM 30003 C CG . ASP F 1 197 ? -31.168 -10.617 14.687 1.00 49.67 ? 197 ASP F CG 1 +ATOM 30004 O OD1 . ASP F 1 197 ? -31.075 -11.759 14.173 1.00 53.07 ? 197 ASP F OD1 1 +ATOM 30005 O OD2 . ASP F 1 197 ? -32.158 -10.244 15.360 1.00 51.43 ? 197 ASP F OD2 1 +ATOM 30006 N N . ILE F 1 198 ? -27.213 -8.409 14.027 1.00 40.79 ? 198 ILE F N 1 +ATOM 30007 C CA . ILE F 1 198 ? -26.315 -7.543 13.278 1.00 42.76 ? 198 ILE F CA 1 +ATOM 30008 C C . ILE F 1 198 ? -25.085 -8.320 12.816 1.00 42.15 ? 198 ILE F C 1 +ATOM 30009 O O . ILE F 1 198 ? -24.647 -8.164 11.679 1.00 41.90 ? 198 ILE F O 1 +ATOM 30010 C CB . ILE F 1 198 ? -25.861 -6.331 14.122 1.00 44.81 ? 198 ILE F CB 1 +ATOM 30011 C CG1 . ILE F 1 198 ? -27.085 -5.547 14.592 1.00 46.04 ? 198 ILE F CG1 1 +ATOM 30012 C CG2 . ILE F 1 198 ? -24.967 -5.416 13.289 1.00 44.88 ? 198 ILE F CG2 1 +ATOM 30013 C CD1 . ILE F 1 198 ? -26.753 -4.372 15.476 1.00 46.21 ? 198 ILE F CD1 1 +ATOM 30014 N N . MET F 1 199 ? -24.532 -9.155 13.696 1.00 42.31 ? 199 MET F N 1 +ATOM 30015 C CA . MET F 1 199 ? -23.357 -9.961 13.355 1.00 41.87 ? 199 MET F CA 1 +ATOM 30016 C C . MET F 1 199 ? -23.644 -10.845 12.148 1.00 41.96 ? 199 MET F C 1 +ATOM 30017 O O . MET F 1 199 ? -22.864 -10.883 11.194 1.00 40.80 ? 199 MET F O 1 +ATOM 30018 C CB . MET F 1 199 ? -22.941 -10.850 14.532 1.00 41.99 ? 199 MET F CB 1 +ATOM 30019 C CG . MET F 1 199 ? -22.229 -10.142 15.682 1.00 42.62 ? 199 MET F CG 1 +ATOM 30020 S SD . MET F 1 199 ? -20.552 -9.600 15.278 1.00 44.05 ? 199 MET F SD 1 +ATOM 30021 C CE . MET F 1 199 ? -19.633 -11.120 15.507 1.00 45.01 ? 199 MET F CE 1 +ATOM 30022 N N . GLN F 1 200 ? -24.766 -11.557 12.192 1.00 42.67 ? 200 GLN F N 1 +ATOM 30023 C CA . GLN F 1 200 ? -25.136 -12.453 11.100 1.00 44.16 ? 200 GLN F CA 1 +ATOM 30024 C C . GLN F 1 200 ? -25.461 -11.691 9.821 1.00 44.93 ? 200 GLN F C 1 +ATOM 30025 O O . GLN F 1 200 ? -25.060 -12.087 8.728 1.00 43.71 ? 200 GLN F O 1 +ATOM 30026 C CB . GLN F 1 200 ? -26.325 -13.325 11.512 1.00 44.09 ? 200 GLN F CB 1 +ATOM 30027 C CG . GLN F 1 200 ? -26.035 -14.205 12.717 1.00 44.74 ? 200 GLN F CG 1 +ATOM 30028 C CD . GLN F 1 200 ? -27.140 -15.194 13.009 1.00 45.35 ? 200 GLN F CD 1 +ATOM 30029 O OE1 . GLN F 1 200 ? -28.319 -14.833 13.036 1.00 46.27 ? 200 GLN F OE1 1 +ATOM 30030 N NE2 . GLN F 1 200 ? -26.765 -16.451 13.244 1.00 43.51 ? 200 GLN F NE2 1 +ATOM 30031 N N . LYS F 1 201 ? -26.180 -10.586 9.961 1.00 46.44 ? 201 LYS F N 1 +ATOM 30032 C CA . LYS F 1 201 ? -26.534 -9.785 8.805 1.00 47.59 ? 201 LYS F CA 1 +ATOM 30033 C C . LYS F 1 201 ? -25.285 -9.288 8.084 1.00 47.65 ? 201 LYS F C 1 +ATOM 30034 O O . LYS F 1 201 ? -25.261 -9.213 6.856 1.00 47.40 ? 201 LYS F O 1 +ATOM 30035 C CB . LYS F 1 201 ? -27.399 -8.604 9.233 1.00 49.66 ? 201 LYS F CB 1 +ATOM 30036 C CG . LYS F 1 201 ? -27.803 -7.699 8.090 1.00 54.66 ? 201 LYS F CG 1 +ATOM 30037 C CD . LYS F 1 201 ? -28.694 -6.561 8.578 1.00 59.79 ? 201 LYS F CD 1 +ATOM 30038 C CE . LYS F 1 201 ? -29.055 -5.610 7.442 1.00 62.34 ? 201 LYS F CE 1 +ATOM 30039 N NZ . LYS F 1 201 ? -27.837 -4.976 6.843 1.00 63.48 ? 201 LYS F NZ 1 +ATOM 30040 N N . GLU F 1 202 ? -24.243 -8.954 8.836 1.00 47.42 ? 202 GLU F N 1 +ATOM 30041 C CA . GLU F 1 202 ? -23.021 -8.463 8.214 1.00 48.20 ? 202 GLU F CA 1 +ATOM 30042 C C . GLU F 1 202 ? -22.061 -9.565 7.780 1.00 46.22 ? 202 GLU F C 1 +ATOM 30043 O O . GLU F 1 202 ? -20.915 -9.301 7.428 1.00 46.29 ? 202 GLU F O 1 +ATOM 30044 C CB . GLU F 1 202 ? -22.327 -7.441 9.127 1.00 50.51 ? 202 GLU F CB 1 +ATOM 30045 C CG . GLU F 1 202 ? -23.056 -6.088 9.127 1.00 57.06 ? 202 GLU F CG 1 +ATOM 30046 C CD . GLU F 1 202 ? -22.256 -4.949 9.758 1.00 60.81 ? 202 GLU F CD 1 +ATOM 30047 O OE1 . GLU F 1 202 ? -21.019 -4.906 9.560 1.00 63.22 ? 202 GLU F OE1 1 +ATOM 30048 O OE2 . GLU F 1 202 ? -22.868 -4.082 10.431 1.00 61.25 ? 202 GLU F OE2 1 +ATOM 30049 N N . GLY F 1 203 ? -22.535 -10.805 7.806 1.00 44.79 ? 203 GLY F N 1 +ATOM 30050 C CA . GLY F 1 203 ? -21.711 -11.914 7.357 1.00 44.69 ? 203 GLY F CA 1 +ATOM 30051 C C . GLY F 1 203 ? -20.858 -12.695 8.340 1.00 44.54 ? 203 GLY F C 1 +ATOM 30052 O O . GLY F 1 203 ? -20.056 -13.530 7.925 1.00 44.55 ? 203 GLY F O 1 +ATOM 30053 N N . PHE F 1 204 ? -21.001 -12.447 9.634 1.00 44.05 ? 204 PHE F N 1 +ATOM 30054 C CA . PHE F 1 204 ? -20.202 -13.194 10.589 1.00 42.90 ? 204 PHE F CA 1 +ATOM 30055 C C . PHE F 1 204 ? -20.967 -14.400 11.086 1.00 43.50 ? 204 PHE F C 1 +ATOM 30056 O O . PHE F 1 204 ? -22.079 -14.282 11.612 1.00 44.59 ? 204 PHE F O 1 +ATOM 30057 C CB . PHE F 1 204 ? -19.788 -12.312 11.763 1.00 41.43 ? 204 PHE F CB 1 +ATOM 30058 C CG . PHE F 1 204 ? -18.862 -11.212 11.376 1.00 40.43 ? 204 PHE F CG 1 +ATOM 30059 C CD1 . PHE F 1 204 ? -19.356 -9.989 10.964 1.00 39.76 ? 204 PHE F CD1 1 +ATOM 30060 C CD2 . PHE F 1 204 ? -17.489 -11.418 11.375 1.00 40.44 ? 204 PHE F CD2 1 +ATOM 30061 C CE1 . PHE F 1 204 ? -18.497 -8.983 10.550 1.00 41.55 ? 204 PHE F CE1 1 +ATOM 30062 C CE2 . PHE F 1 204 ? -16.622 -10.423 10.963 1.00 40.69 ? 204 PHE F CE2 1 +ATOM 30063 C CZ . PHE F 1 204 ? -17.125 -9.200 10.548 1.00 41.53 ? 204 PHE F CZ 1 +ATOM 30064 N N . ARG F 1 205 ? -20.369 -15.567 10.902 1.00 42.65 ? 205 ARG F N 1 +ATOM 30065 C CA . ARG F 1 205 ? -20.984 -16.807 11.328 1.00 43.34 ? 205 ARG F CA 1 +ATOM 30066 C C . ARG F 1 205 ? -20.689 -17.019 12.812 1.00 43.13 ? 205 ARG F C 1 +ATOM 30067 O O . ARG F 1 205 ? -19.581 -17.399 13.195 1.00 43.74 ? 205 ARG F O 1 +ATOM 30068 C CB . ARG F 1 205 ? -20.432 -17.948 10.483 1.00 45.48 ? 205 ARG F CB 1 +ATOM 30069 C CG . ARG F 1 205 ? -21.082 -19.280 10.710 1.00 50.28 ? 205 ARG F CG 1 +ATOM 30070 C CD . ARG F 1 205 ? -20.513 -20.295 9.739 1.00 54.74 ? 205 ARG F CD 1 +ATOM 30071 N NE . ARG F 1 205 ? -20.841 -21.672 10.115 1.00 58.09 ? 205 ARG F NE 1 +ATOM 30072 C CZ . ARG F 1 205 ? -20.380 -22.747 9.475 1.00 60.45 ? 205 ARG F CZ 1 +ATOM 30073 N NH1 . ARG F 1 205 ? -19.575 -22.605 8.422 1.00 59.76 ? 205 ARG F NH1 1 +ATOM 30074 N NH2 . ARG F 1 205 ? -20.707 -23.966 9.897 1.00 61.61 ? 205 ARG F NH2 1 +ATOM 30075 N N . VAL F 1 206 ? -21.687 -16.749 13.646 1.00 41.72 ? 206 VAL F N 1 +ATOM 30076 C CA . VAL F 1 206 ? -21.544 -16.890 15.088 1.00 40.18 ? 206 VAL F CA 1 +ATOM 30077 C C . VAL F 1 206 ? -22.047 -18.249 15.575 1.00 39.31 ? 206 VAL F C 1 +ATOM 30078 O O . VAL F 1 206 ? -23.208 -18.596 15.379 1.00 39.73 ? 206 VAL F O 1 +ATOM 30079 C CB . VAL F 1 206 ? -22.320 -15.779 15.819 1.00 40.40 ? 206 VAL F CB 1 +ATOM 30080 C CG1 . VAL F 1 206 ? -22.197 -15.948 17.328 1.00 40.69 ? 206 VAL F CG1 1 +ATOM 30081 C CG2 . VAL F 1 206 ? -21.783 -14.424 15.399 1.00 40.91 ? 206 VAL F CG2 1 +ATOM 30082 N N . ALA F 1 207 ? -21.166 -19.004 16.222 1.00 36.61 ? 207 ALA F N 1 +ATOM 30083 C CA . ALA F 1 207 ? -21.506 -20.318 16.730 1.00 35.65 ? 207 ALA F CA 1 +ATOM 30084 C C . ALA F 1 207 ? -22.237 -20.257 18.070 1.00 35.45 ? 207 ALA F C 1 +ATOM 30085 O O . ALA F 1 207 ? -23.135 -21.059 18.330 1.00 35.83 ? 207 ALA F O 1 +ATOM 30086 C CB . ALA F 1 207 ? -20.242 -21.160 16.857 1.00 34.59 ? 207 ALA F CB 1 +ATOM 30087 N N . GLY F 1 208 ? -21.846 -19.312 18.921 1.00 34.92 ? 208 GLY F N 1 +ATOM 30088 C CA . GLY F 1 208 ? -22.479 -19.187 20.221 1.00 32.85 ? 208 GLY F CA 1 +ATOM 30089 C C . GLY F 1 208 ? -22.151 -17.879 20.920 1.00 33.11 ? 208 GLY F C 1 +ATOM 30090 O O . GLY F 1 208 ? -21.200 -17.179 20.555 1.00 31.70 ? 208 GLY F O 1 +ATOM 30091 N N . VAL F 1 209 ? -22.953 -17.540 21.922 1.00 31.86 ? 209 VAL F N 1 +ATOM 30092 C CA . VAL F 1 209 ? -22.732 -16.333 22.678 1.00 33.38 ? 209 VAL F CA 1 +ATOM 30093 C C . VAL F 1 209 ? -22.614 -16.716 24.142 1.00 32.68 ? 209 VAL F C 1 +ATOM 30094 O O . VAL F 1 209 ? -23.336 -17.586 24.634 1.00 31.72 ? 209 VAL F O 1 +ATOM 30095 C CB . VAL F 1 209 ? -23.894 -15.310 22.504 1.00 34.60 ? 209 VAL F CB 1 +ATOM 30096 C CG1 . VAL F 1 209 ? -24.149 -15.068 21.045 1.00 36.27 ? 209 VAL F CG1 1 +ATOM 30097 C CG2 . VAL F 1 209 ? -25.151 -15.814 23.165 1.00 37.28 ? 209 VAL F CG2 1 +ATOM 30098 N N . PHE F 1 210 ? -21.691 -16.067 24.834 1.00 32.18 ? 210 PHE F N 1 +ATOM 30099 C CA . PHE F 1 210 ? -21.487 -16.327 26.248 1.00 32.06 ? 210 PHE F CA 1 +ATOM 30100 C C . PHE F 1 210 ? -22.179 -15.265 27.077 1.00 31.80 ? 210 PHE F C 1 +ATOM 30101 O O . PHE F 1 210 ? -22.110 -14.080 26.764 1.00 33.66 ? 210 PHE F O 1 +ATOM 30102 C CB . PHE F 1 210 ? -19.987 -16.340 26.576 1.00 31.43 ? 210 PHE F CB 1 +ATOM 30103 C CG . PHE F 1 210 ? -19.273 -17.558 26.077 1.00 31.45 ? 210 PHE F CG 1 +ATOM 30104 C CD1 . PHE F 1 210 ? -19.280 -17.883 24.725 1.00 32.42 ? 210 PHE F CD1 1 +ATOM 30105 C CD2 . PHE F 1 210 ? -18.611 -18.398 26.961 1.00 32.32 ? 210 PHE F CD2 1 +ATOM 30106 C CE1 . PHE F 1 210 ? -18.634 -19.036 24.261 1.00 33.20 ? 210 PHE F CE1 1 +ATOM 30107 C CE2 . PHE F 1 210 ? -17.961 -19.553 26.507 1.00 33.19 ? 210 PHE F CE2 1 +ATOM 30108 C CZ . PHE F 1 210 ? -17.974 -19.871 25.155 1.00 31.23 ? 210 PHE F CZ 1 +ATOM 30109 N N . LEU F 1 211 ? -22.856 -15.699 28.128 1.00 31.12 ? 211 LEU F N 1 +ATOM 30110 C CA . LEU F 1 211 ? -23.540 -14.796 29.035 1.00 32.02 ? 211 LEU F CA 1 +ATOM 30111 C C . LEU F 1 211 ? -22.734 -14.748 30.341 1.00 32.56 ? 211 LEU F C 1 +ATOM 30112 O O . LEU F 1 211 ? -22.608 -15.758 31.035 1.00 32.32 ? 211 LEU F O 1 +ATOM 30113 C CB . LEU F 1 211 ? -24.955 -15.306 29.303 1.00 32.36 ? 211 LEU F CB 1 +ATOM 30114 C CG . LEU F 1 211 ? -26.125 -14.455 28.812 1.00 35.58 ? 211 LEU F CG 1 +ATOM 30115 C CD1 . LEU F 1 211 ? -25.843 -13.907 27.422 1.00 32.95 ? 211 LEU F CD1 1 +ATOM 30116 C CD2 . LEU F 1 211 ? -27.398 -15.294 28.829 1.00 34.46 ? 211 LEU F CD2 1 +ATOM 30117 N N . ASP F 1 212 ? -22.175 -13.579 30.660 1.00 33.38 ? 212 ASP F N 1 +ATOM 30118 C CA . ASP F 1 212 ? -21.385 -13.412 31.871 1.00 32.25 ? 212 ASP F CA 1 +ATOM 30119 C C . ASP F 1 212 ? -22.311 -13.107 33.047 1.00 33.48 ? 212 ASP F C 1 +ATOM 30120 O O . ASP F 1 212 ? -23.527 -13.000 32.876 1.00 33.94 ? 212 ASP F O 1 +ATOM 30121 C CB . ASP F 1 212 ? -20.343 -12.306 31.689 1.00 33.37 ? 212 ASP F CB 1 +ATOM 30122 C CG . ASP F 1 212 ? -19.061 -12.570 32.481 1.00 33.94 ? 212 ASP F CG 1 +ATOM 30123 O OD1 . ASP F 1 212 ? -19.161 -12.975 33.662 1.00 32.12 ? 212 ASP F OD1 1 +ATOM 30124 O OD2 . ASP F 1 212 ? -17.956 -12.363 31.923 1.00 33.48 ? 212 ASP F OD2 1 +ATOM 30125 N N . ILE F 1 213 ? -21.734 -12.943 34.234 1.00 33.31 ? 213 ILE F N 1 +ATOM 30126 C CA . ILE F 1 213 ? -22.502 -12.755 35.461 1.00 32.30 ? 213 ILE F CA 1 +ATOM 30127 C C . ILE F 1 213 ? -23.646 -11.752 35.567 1.00 34.38 ? 213 ILE F C 1 +ATOM 30128 O O . ILE F 1 213 ? -24.449 -11.842 36.506 1.00 33.14 ? 213 ILE F O 1 +ATOM 30129 C CB . ILE F 1 213 ? -21.555 -12.539 36.662 1.00 33.24 ? 213 ILE F CB 1 +ATOM 30130 C CG1 . ILE F 1 213 ? -20.792 -11.225 36.516 1.00 31.90 ? 213 ILE F CG1 1 +ATOM 30131 C CG2 . ILE F 1 213 ? -20.587 -13.711 36.766 1.00 30.45 ? 213 ILE F CG2 1 +ATOM 30132 C CD1 . ILE F 1 213 ? -19.872 -10.939 37.688 1.00 32.74 ? 213 ILE F CD1 1 +ATOM 30133 N N . HIS F 1 214 ? -23.746 -10.806 34.634 1.00 35.57 ? 214 HIS F N 1 +ATOM 30134 C CA . HIS F 1 214 ? -24.841 -9.834 34.695 1.00 35.30 ? 214 HIS F CA 1 +ATOM 30135 C C . HIS F 1 214 ? -26.213 -10.455 34.432 1.00 35.15 ? 214 HIS F C 1 +ATOM 30136 O O . HIS F 1 214 ? -27.230 -9.816 34.689 1.00 35.20 ? 214 HIS F O 1 +ATOM 30137 C CB . HIS F 1 214 ? -24.643 -8.704 33.690 1.00 37.70 ? 214 HIS F CB 1 +ATOM 30138 C CG . HIS F 1 214 ? -23.606 -7.705 34.089 1.00 39.89 ? 214 HIS F CG 1 +ATOM 30139 N ND1 . HIS F 1 214 ? -22.256 -7.929 33.933 1.00 40.07 ? 214 HIS F ND1 1 +ATOM 30140 C CD2 . HIS F 1 214 ? -23.726 -6.459 34.600 1.00 39.73 ? 214 HIS F CD2 1 +ATOM 30141 C CE1 . HIS F 1 214 ? -21.588 -6.860 34.324 1.00 39.98 ? 214 HIS F CE1 1 +ATOM 30142 N NE2 . HIS F 1 214 ? -22.456 -5.953 34.732 1.00 40.59 ? 214 HIS F NE2 1 +ATOM 30143 N N . TYR F 1 215 ? -26.249 -11.687 33.925 1.00 33.37 ? 215 TYR F N 1 +ATOM 30144 C CA . TYR F 1 215 ? -27.525 -12.333 33.634 1.00 33.25 ? 215 TYR F CA 1 +ATOM 30145 C C . TYR F 1 215 ? -28.208 -12.882 34.873 1.00 33.16 ? 215 TYR F C 1 +ATOM 30146 O O . TYR F 1 215 ? -29.422 -13.111 34.870 1.00 31.96 ? 215 TYR F O 1 +ATOM 30147 C CB . TYR F 1 215 ? -27.343 -13.463 32.603 1.00 33.41 ? 215 TYR F CB 1 +ATOM 30148 C CG . TYR F 1 215 ? -26.862 -14.801 33.159 1.00 31.63 ? 215 TYR F CG 1 +ATOM 30149 C CD1 . TYR F 1 215 ? -27.704 -15.612 33.911 1.00 31.75 ? 215 TYR F CD1 1 +ATOM 30150 C CD2 . TYR F 1 215 ? -25.572 -15.259 32.903 1.00 30.59 ? 215 TYR F CD2 1 +ATOM 30151 C CE1 . TYR F 1 215 ? -27.274 -16.845 34.396 1.00 32.04 ? 215 TYR F CE1 1 +ATOM 30152 C CE2 . TYR F 1 215 ? -25.137 -16.485 33.375 1.00 30.15 ? 215 TYR F CE2 1 +ATOM 30153 C CZ . TYR F 1 215 ? -25.991 -17.274 34.120 1.00 31.07 ? 215 TYR F CZ 1 +ATOM 30154 O OH . TYR F 1 215 ? -25.554 -18.492 34.581 1.00 29.79 ? 215 TYR F OH 1 +ATOM 30155 N N . MET F 1 216 ? -27.425 -13.098 35.925 1.00 33.81 ? 216 MET F N 1 +ATOM 30156 C CA . MET F 1 216 ? -27.949 -13.638 37.172 1.00 34.96 ? 216 MET F CA 1 +ATOM 30157 C C . MET F 1 216 ? -28.686 -12.609 37.998 1.00 35.41 ? 216 MET F C 1 +ATOM 30158 O O . MET F 1 216 ? -28.575 -11.409 37.767 1.00 36.06 ? 216 MET F O 1 +ATOM 30159 C CB . MET F 1 216 ? -26.807 -14.213 38.023 1.00 36.68 ? 216 MET F CB 1 +ATOM 30160 C CG . MET F 1 216 ? -26.109 -15.413 37.417 1.00 39.24 ? 216 MET F CG 1 +ATOM 30161 S SD . MET F 1 216 ? -24.729 -15.968 38.423 1.00 40.03 ? 216 MET F SD 1 +ATOM 30162 C CE . MET F 1 216 ? -23.378 -15.534 37.412 1.00 41.68 ? 216 MET F CE 1 +ATOM 30163 N N . ASP F 1 217 ? -29.444 -13.093 38.969 1.00 36.93 ? 217 ASP F N 1 +ATOM 30164 C CA . ASP F 1 217 ? -30.164 -12.226 39.883 1.00 38.51 ? 217 ASP F CA 1 +ATOM 30165 C C . ASP F 1 217 ? -29.244 -12.019 41.091 1.00 38.20 ? 217 ASP F C 1 +ATOM 30166 O O . ASP F 1 217 ? -29.082 -12.918 41.907 1.00 38.66 ? 217 ASP F O 1 +ATOM 30167 C CB . ASP F 1 217 ? -31.472 -12.898 40.305 1.00 40.15 ? 217 ASP F CB 1 +ATOM 30168 C CG . ASP F 1 217 ? -32.152 -12.183 41.446 1.00 42.41 ? 217 ASP F CG 1 +ATOM 30169 O OD1 . ASP F 1 217 ? -31.949 -10.960 41.603 1.00 44.81 ? 217 ASP F OD1 1 +ATOM 30170 O OD2 . ASP F 1 217 ? -32.905 -12.847 42.183 1.00 46.83 ? 217 ASP F OD2 1 +ATOM 30171 N N . SER F 1 218 ? -28.628 -10.844 41.185 1.00 39.69 ? 218 SER F N 1 +ATOM 30172 C CA . SER F 1 218 ? -27.713 -10.530 42.289 1.00 41.00 ? 218 SER F CA 1 +ATOM 30173 C C . SER F 1 218 ? -26.547 -11.508 42.338 1.00 40.31 ? 218 SER F C 1 +ATOM 30174 O O . SER F 1 218 ? -26.067 -11.847 43.414 1.00 39.97 ? 218 SER F O 1 +ATOM 30175 C CB . SER F 1 218 ? -28.447 -10.574 43.633 1.00 41.57 ? 218 SER F CB 1 +ATOM 30176 O OG . SER F 1 218 ? -29.463 -9.595 43.690 1.00 44.92 ? 218 SER F OG 1 +ATOM 30177 N N . TYR F 1 219 ? -26.112 -11.971 41.171 1.00 40.26 ? 219 TYR F N 1 +ATOM 30178 C CA . TYR F 1 219 ? -25.003 -12.918 41.072 1.00 39.66 ? 219 TYR F CA 1 +ATOM 30179 C C . TYR F 1 219 ? -25.292 -14.293 41.675 1.00 39.05 ? 219 TYR F C 1 +ATOM 30180 O O . TYR F 1 219 ? -24.365 -15.053 41.952 1.00 38.88 ? 219 TYR F O 1 +ATOM 30181 C CB . TYR F 1 219 ? -23.753 -12.326 41.720 1.00 39.13 ? 219 TYR F CB 1 +ATOM 30182 C CG . TYR F 1 219 ? -23.417 -10.962 41.182 1.00 40.55 ? 219 TYR F CG 1 +ATOM 30183 C CD1 . TYR F 1 219 ? -23.054 -10.791 39.847 1.00 40.09 ? 219 TYR F CD1 1 +ATOM 30184 C CD2 . TYR F 1 219 ? -23.531 -9.827 41.989 1.00 40.51 ? 219 TYR F CD2 1 +ATOM 30185 C CE1 . TYR F 1 219 ? -22.821 -9.521 39.322 1.00 41.99 ? 219 TYR F CE1 1 +ATOM 30186 C CE2 . TYR F 1 219 ? -23.301 -8.554 41.481 1.00 40.68 ? 219 TYR F CE2 1 +ATOM 30187 C CZ . TYR F 1 219 ? -22.948 -8.405 40.146 1.00 43.37 ? 219 TYR F CZ 1 +ATOM 30188 O OH . TYR F 1 219 ? -22.739 -7.142 39.630 1.00 43.86 ? 219 TYR F OH 1 +ATOM 30189 N N . LYS F 1 220 ? -26.569 -14.611 41.877 1.00 38.37 ? 220 LYS F N 1 +ATOM 30190 C CA . LYS F 1 220 ? -26.947 -15.914 42.421 1.00 38.93 ? 220 LYS F CA 1 +ATOM 30191 C C . LYS F 1 220 ? -26.940 -16.984 41.331 1.00 38.22 ? 220 LYS F C 1 +ATOM 30192 O O . LYS F 1 220 ? -27.630 -16.852 40.312 1.00 38.59 ? 220 LYS F O 1 +ATOM 30193 C CB . LYS F 1 220 ? -28.334 -15.847 43.067 1.00 40.72 ? 220 LYS F CB 1 +ATOM 30194 C CG . LYS F 1 220 ? -28.337 -15.156 44.418 1.00 45.26 ? 220 LYS F CG 1 +ATOM 30195 C CD . LYS F 1 220 ? -29.699 -15.197 45.095 1.00 46.35 ? 220 LYS F CD 1 +ATOM 30196 C CE . LYS F 1 220 ? -30.670 -14.241 44.438 1.00 48.88 ? 220 LYS F CE 1 +ATOM 30197 N NZ . LYS F 1 220 ? -31.870 -14.016 45.307 1.00 51.60 ? 220 LYS F NZ 1 +ATOM 30198 N N . LEU F 1 221 ? -26.156 -18.039 41.538 1.00 35.81 ? 221 LEU F N 1 +ATOM 30199 C CA . LEU F 1 221 ? -26.085 -19.112 40.556 1.00 34.86 ? 221 LEU F CA 1 +ATOM 30200 C C . LEU F 1 221 ? -27.465 -19.685 40.251 1.00 33.41 ? 221 LEU F C 1 +ATOM 30201 O O . LEU F 1 221 ? -28.344 -19.733 41.114 1.00 31.76 ? 221 LEU F O 1 +ATOM 30202 C CB . LEU F 1 221 ? -25.171 -20.239 41.045 1.00 33.51 ? 221 LEU F CB 1 +ATOM 30203 C CG . LEU F 1 221 ? -23.750 -19.850 41.448 1.00 36.86 ? 221 LEU F CG 1 +ATOM 30204 C CD1 . LEU F 1 221 ? -22.945 -21.117 41.709 1.00 38.04 ? 221 LEU F CD1 1 +ATOM 30205 C CD2 . LEU F 1 221 ? -23.090 -19.022 40.358 1.00 36.24 ? 221 LEU F CD2 1 +ATOM 30206 N N . PHE F 1 222 ? -27.646 -20.096 39.002 1.00 33.27 ? 222 PHE F N 1 +ATOM 30207 C CA . PHE F 1 222 ? -28.891 -20.704 38.547 1.00 33.78 ? 222 PHE F CA 1 +ATOM 30208 C C . PHE F 1 222 ? -30.146 -19.846 38.723 1.00 33.84 ? 222 PHE F C 1 +ATOM 30209 O O . PHE F 1 222 ? -31.201 -20.354 39.109 1.00 34.26 ? 222 PHE F O 1 +ATOM 30210 C CB . PHE F 1 222 ? -29.082 -22.055 39.247 1.00 32.20 ? 222 PHE F CB 1 +ATOM 30211 C CG . PHE F 1 222 ? -27.867 -22.923 39.197 1.00 32.22 ? 222 PHE F CG 1 +ATOM 30212 C CD1 . PHE F 1 222 ? -27.312 -23.284 37.977 1.00 31.16 ? 222 PHE F CD1 1 +ATOM 30213 C CD2 . PHE F 1 222 ? -27.238 -23.332 40.368 1.00 32.79 ? 222 PHE F CD2 1 +ATOM 30214 C CE1 . PHE F 1 222 ? -26.137 -24.039 37.921 1.00 33.15 ? 222 PHE F CE1 1 +ATOM 30215 C CE2 . PHE F 1 222 ? -26.064 -24.087 40.324 1.00 33.93 ? 222 PHE F CE2 1 +ATOM 30216 C CZ . PHE F 1 222 ? -25.511 -24.440 39.097 1.00 32.25 ? 222 PHE F CZ 1 +ATOM 30217 N N . THR F 1 223 ? -30.023 -18.554 38.441 1.00 32.94 ? 223 THR F N 1 +ATOM 30218 C CA . THR F 1 223 ? -31.151 -17.630 38.512 1.00 32.79 ? 223 THR F CA 1 +ATOM 30219 C C . THR F 1 223 ? -31.025 -16.679 37.335 1.00 32.84 ? 223 THR F C 1 +ATOM 30220 O O . THR F 1 223 ? -29.951 -16.539 36.746 1.00 33.37 ? 223 THR F O 1 +ATOM 30221 C CB . THR F 1 223 ? -31.152 -16.768 39.800 1.00 33.82 ? 223 THR F CB 1 +ATOM 30222 O OG1 . THR F 1 223 ? -30.057 -15.839 39.754 1.00 32.83 ? 223 THR F OG1 1 +ATOM 30223 C CG2 . THR F 1 223 ? -31.042 -17.644 41.042 1.00 31.26 ? 223 THR F CG2 1 +ATOM 30224 N N . TRP F 1 224 ? -32.131 -16.041 36.977 1.00 33.82 ? 224 TRP F N 1 +ATOM 30225 C CA . TRP F 1 224 ? -32.130 -15.076 35.884 1.00 33.56 ? 224 TRP F CA 1 +ATOM 30226 C C . TRP F 1 224 ? -32.498 -13.715 36.446 1.00 33.27 ? 224 TRP F C 1 +ATOM 30227 O O . TRP F 1 224 ? -33.411 -13.599 37.258 1.00 34.00 ? 224 TRP F O 1 +ATOM 30228 C CB . TRP F 1 224 ? -33.141 -15.460 34.802 1.00 30.49 ? 224 TRP F CB 1 +ATOM 30229 C CG . TRP F 1 224 ? -32.771 -16.670 34.022 1.00 30.59 ? 224 TRP F CG 1 +ATOM 30230 C CD1 . TRP F 1 224 ? -33.239 -17.939 34.206 1.00 29.95 ? 224 TRP F CD1 1 +ATOM 30231 C CD2 . TRP F 1 224 ? -31.872 -16.731 32.909 1.00 30.03 ? 224 TRP F CD2 1 +ATOM 30232 N NE1 . TRP F 1 224 ? -32.693 -18.782 33.272 1.00 28.55 ? 224 TRP F NE1 1 +ATOM 30233 C CE2 . TRP F 1 224 ? -31.851 -18.071 32.462 1.00 28.69 ? 224 TRP F CE2 1 +ATOM 30234 C CE3 . TRP F 1 224 ? -31.081 -15.784 32.244 1.00 31.38 ? 224 TRP F CE3 1 +ATOM 30235 C CZ2 . TRP F 1 224 ? -31.070 -18.491 31.374 1.00 29.20 ? 224 TRP F CZ2 1 +ATOM 30236 C CZ3 . TRP F 1 224 ? -30.302 -16.200 31.162 1.00 30.18 ? 224 TRP F CZ3 1 +ATOM 30237 C CH2 . TRP F 1 224 ? -30.306 -17.545 30.739 1.00 30.39 ? 224 TRP F CH2 1 +ATOM 30238 N N . HIS F 1 225 ? -31.777 -12.689 36.029 1.00 33.36 ? 225 HIS F N 1 +ATOM 30239 C CA . HIS F 1 225 ? -32.066 -11.341 36.493 1.00 35.03 ? 225 HIS F CA 1 +ATOM 30240 C C . HIS F 1 225 ? -33.500 -11.019 36.054 1.00 37.36 ? 225 HIS F C 1 +ATOM 30241 O O . HIS F 1 225 ? -33.809 -11.036 34.860 1.00 37.70 ? 225 HIS F O 1 +ATOM 30242 C CB . HIS F 1 225 ? -31.071 -10.368 35.871 1.00 33.99 ? 225 HIS F CB 1 +ATOM 30243 C CG . HIS F 1 225 ? -31.116 -8.996 36.459 1.00 37.51 ? 225 HIS F CG 1 +ATOM 30244 N ND1 . HIS F 1 225 ? -32.159 -8.123 36.233 1.00 37.41 ? 225 HIS F ND1 1 +ATOM 30245 C CD2 . HIS F 1 225 ? -30.250 -8.348 37.274 1.00 37.21 ? 225 HIS F CD2 1 +ATOM 30246 C CE1 . HIS F 1 225 ? -31.932 -6.997 36.885 1.00 37.17 ? 225 HIS F CE1 1 +ATOM 30247 N NE2 . HIS F 1 225 ? -30.781 -7.108 37.524 1.00 37.83 ? 225 HIS F NE2 1 +ATOM 30248 N N . PRO F 1 226 ? -34.393 -10.722 37.018 1.00 39.02 ? 226 PRO F N 1 +ATOM 30249 C CA . PRO F 1 226 ? -35.807 -10.401 36.767 1.00 39.82 ? 226 PRO F CA 1 +ATOM 30250 C C . PRO F 1 226 ? -36.093 -9.248 35.821 1.00 40.48 ? 226 PRO F C 1 +ATOM 30251 O O . PRO F 1 226 ? -37.156 -9.203 35.202 1.00 41.49 ? 226 PRO F O 1 +ATOM 30252 C CB . PRO F 1 226 ? -36.363 -10.146 38.167 1.00 40.06 ? 226 PRO F CB 1 +ATOM 30253 C CG . PRO F 1 226 ? -35.173 -9.604 38.902 1.00 41.43 ? 226 PRO F CG 1 +ATOM 30254 C CD . PRO F 1 226 ? -34.065 -10.535 38.444 1.00 39.88 ? 226 PRO F CD 1 +ATOM 30255 N N . TYR F 1 227 ? -35.166 -8.311 35.699 1.00 40.26 ? 227 TYR F N 1 +ATOM 30256 C CA . TYR F 1 227 ? -35.403 -7.198 34.794 1.00 40.07 ? 227 TYR F CA 1 +ATOM 30257 C C . TYR F 1 227 ? -34.639 -7.309 33.494 1.00 38.70 ? 227 TYR F C 1 +ATOM 30258 O O . TYR F 1 227 ? -35.165 -6.960 32.445 1.00 38.13 ? 227 TYR F O 1 +ATOM 30259 C CB . TYR F 1 227 ? -35.095 -5.872 35.492 1.00 42.70 ? 227 TYR F CB 1 +ATOM 30260 C CG . TYR F 1 227 ? -36.030 -5.637 36.653 1.00 46.70 ? 227 TYR F CG 1 +ATOM 30261 C CD1 . TYR F 1 227 ? -37.416 -5.622 36.461 1.00 47.48 ? 227 TYR F CD1 1 +ATOM 30262 C CD2 . TYR F 1 227 ? -35.542 -5.497 37.950 1.00 47.85 ? 227 TYR F CD2 1 +ATOM 30263 C CE1 . TYR F 1 227 ? -38.287 -5.480 37.534 1.00 50.63 ? 227 TYR F CE1 1 +ATOM 30264 C CE2 . TYR F 1 227 ? -36.404 -5.356 39.029 1.00 49.59 ? 227 TYR F CE2 1 +ATOM 30265 C CZ . TYR F 1 227 ? -37.773 -5.351 38.815 1.00 51.77 ? 227 TYR F CZ 1 +ATOM 30266 O OH . TYR F 1 227 ? -38.625 -5.244 39.893 1.00 55.89 ? 227 TYR F OH 1 +ATOM 30267 N N . ARG F 1 228 ? -33.403 -7.801 33.555 1.00 38.11 ? 228 ARG F N 1 +ATOM 30268 C CA . ARG F 1 228 ? -32.593 -7.938 32.347 1.00 35.60 ? 228 ARG F CA 1 +ATOM 30269 C C . ARG F 1 228 ? -32.998 -9.177 31.559 1.00 34.71 ? 228 ARG F C 1 +ATOM 30270 O O . ARG F 1 228 ? -32.919 -9.191 30.330 1.00 33.46 ? 228 ARG F O 1 +ATOM 30271 C CB . ARG F 1 228 ? -31.103 -8.028 32.699 1.00 34.18 ? 228 ARG F CB 1 +ATOM 30272 C CG . ARG F 1 228 ? -30.512 -6.772 33.284 1.00 34.04 ? 228 ARG F CG 1 +ATOM 30273 C CD . ARG F 1 228 ? -29.199 -7.091 33.964 1.00 33.28 ? 228 ARG F CD 1 +ATOM 30274 N NE . ARG F 1 228 ? -28.625 -5.932 34.628 1.00 34.50 ? 228 ARG F NE 1 +ATOM 30275 C CZ . ARG F 1 228 ? -27.677 -5.999 35.565 1.00 34.87 ? 228 ARG F CZ 1 +ATOM 30276 N NH1 . ARG F 1 228 ? -27.198 -7.175 35.948 1.00 31.92 ? 228 ARG F NH1 1 +ATOM 30277 N NH2 . ARG F 1 228 ? -27.210 -4.884 36.123 1.00 31.24 ? 228 ARG F NH2 1 +ATOM 30278 N N . PHE F 1 229 ? -33.413 -10.225 32.266 1.00 34.17 ? 229 PHE F N 1 +ATOM 30279 C CA . PHE F 1 229 ? -33.815 -11.464 31.599 1.00 33.23 ? 229 PHE F CA 1 +ATOM 30280 C C . PHE F 1 229 ? -35.155 -12.015 32.088 1.00 33.26 ? 229 PHE F C 1 +ATOM 30281 O O . PHE F 1 229 ? -35.228 -13.120 32.619 1.00 30.85 ? 229 PHE F O 1 +ATOM 30282 C CB . PHE F 1 229 ? -32.724 -12.532 31.758 1.00 29.73 ? 229 PHE F CB 1 +ATOM 30283 C CG . PHE F 1 229 ? -31.453 -12.199 31.039 1.00 26.14 ? 229 PHE F CG 1 +ATOM 30284 C CD1 . PHE F 1 229 ? -30.494 -11.367 31.633 1.00 25.66 ? 229 PHE F CD1 1 +ATOM 30285 C CD2 . PHE F 1 229 ? -31.236 -12.663 29.746 1.00 23.00 ? 229 PHE F CD2 1 +ATOM 30286 C CE1 . PHE F 1 229 ? -29.333 -11.000 30.937 1.00 24.15 ? 229 PHE F CE1 1 +ATOM 30287 C CE2 . PHE F 1 229 ? -30.081 -12.306 29.033 1.00 26.03 ? 229 PHE F CE2 1 +ATOM 30288 C CZ . PHE F 1 229 ? -29.123 -11.468 29.630 1.00 23.34 ? 229 PHE F CZ 1 +ATOM 30289 N N . PRO F 1 230 ? -36.237 -11.246 31.892 1.00 35.21 ? 230 PRO F N 1 +ATOM 30290 C CA . PRO F 1 230 ? -37.583 -11.656 32.312 1.00 36.18 ? 230 PRO F CA 1 +ATOM 30291 C C . PRO F 1 230 ? -38.131 -12.900 31.599 1.00 37.12 ? 230 PRO F C 1 +ATOM 30292 O O . PRO F 1 230 ? -38.892 -13.667 32.192 1.00 37.54 ? 230 PRO F O 1 +ATOM 30293 C CB . PRO F 1 230 ? -38.422 -10.408 32.036 1.00 34.09 ? 230 PRO F CB 1 +ATOM 30294 C CG . PRO F 1 230 ? -37.736 -9.806 30.850 1.00 35.56 ? 230 PRO F CG 1 +ATOM 30295 C CD . PRO F 1 230 ? -36.273 -9.942 31.202 1.00 34.61 ? 230 PRO F CD 1 +ATOM 30296 N N . GLU F 1 231 ? -37.740 -13.102 30.340 1.00 39.19 ? 231 GLU F N 1 +ATOM 30297 C CA . GLU F 1 231 ? -38.209 -14.249 29.545 1.00 40.80 ? 231 GLU F CA 1 +ATOM 30298 C C . GLU F 1 231 ? -37.050 -15.063 28.931 1.00 39.45 ? 231 GLU F C 1 +ATOM 30299 O O . GLU F 1 231 ? -36.836 -15.052 27.718 1.00 38.53 ? 231 GLU F O 1 +ATOM 30300 C CB . GLU F 1 231 ? -39.127 -13.748 28.422 1.00 43.81 ? 231 GLU F CB 1 +ATOM 30301 C CG . GLU F 1 231 ? -40.280 -12.869 28.899 1.00 51.19 ? 231 GLU F CG 1 +ATOM 30302 C CD . GLU F 1 231 ? -40.914 -12.060 27.766 1.00 57.14 ? 231 GLU F CD 1 +ATOM 30303 O OE1 . GLU F 1 231 ? -41.549 -12.668 26.866 1.00 60.20 ? 231 GLU F OE1 1 +ATOM 30304 O OE2 . GLU F 1 231 ? -40.771 -10.810 27.770 1.00 59.46 ? 231 GLU F OE2 1 +ATOM 30305 N N . PRO F 1 232 ? -36.294 -15.790 29.764 1.00 38.14 ? 232 PRO F N 1 +ATOM 30306 C CA . PRO F 1 232 ? -35.181 -16.574 29.225 1.00 38.28 ? 232 PRO F CA 1 +ATOM 30307 C C . PRO F 1 232 ? -35.557 -17.593 28.149 1.00 38.57 ? 232 PRO F C 1 +ATOM 30308 O O . PRO F 1 232 ? -34.760 -17.859 27.244 1.00 36.80 ? 232 PRO F O 1 +ATOM 30309 C CB . PRO F 1 232 ? -34.569 -17.223 30.475 1.00 38.35 ? 232 PRO F CB 1 +ATOM 30310 C CG . PRO F 1 232 ? -35.709 -17.281 31.437 1.00 37.53 ? 232 PRO F CG 1 +ATOM 30311 C CD . PRO F 1 232 ? -36.400 -15.956 31.222 1.00 37.05 ? 232 PRO F CD 1 +ATOM 30312 N N . LYS F 1 233 ? -36.756 -18.167 28.247 1.00 39.78 ? 233 LYS F N 1 +ATOM 30313 C CA . LYS F 1 233 ? -37.197 -19.146 27.256 1.00 41.31 ? 233 LYS F CA 1 +ATOM 30314 C C . LYS F 1 233 ? -37.238 -18.503 25.872 1.00 40.75 ? 233 LYS F C 1 +ATOM 30315 O O . LYS F 1 233 ? -36.771 -19.085 24.878 1.00 39.10 ? 233 LYS F O 1 +ATOM 30316 C CB . LYS F 1 233 ? -38.577 -19.698 27.605 1.00 46.13 ? 233 LYS F CB 1 +ATOM 30317 C CG . LYS F 1 233 ? -39.006 -20.814 26.649 1.00 51.60 ? 233 LYS F CG 1 +ATOM 30318 C CD . LYS F 1 233 ? -40.236 -21.584 27.140 1.00 54.30 ? 233 LYS F CD 1 +ATOM 30319 C CE . LYS F 1 233 ? -40.434 -22.873 26.329 1.00 54.06 ? 233 LYS F CE 1 +ATOM 30320 N NZ . LYS F 1 233 ? -40.506 -22.604 24.862 1.00 53.77 ? 233 LYS F NZ 1 +ATOM 30321 N N . LYS F 1 234 ? -37.787 -17.293 25.819 1.00 39.65 ? 234 LYS F N 1 +ATOM 30322 C CA . LYS F 1 234 ? -37.868 -16.545 24.575 1.00 39.99 ? 234 LYS F CA 1 +ATOM 30323 C C . LYS F 1 234 ? -36.466 -16.289 24.010 1.00 39.05 ? 234 LYS F C 1 +ATOM 30324 O O . LYS F 1 234 ? -36.257 -16.375 22.808 1.00 40.79 ? 234 LYS F O 1 +ATOM 30325 C CB . LYS F 1 234 ? -38.583 -15.217 24.813 1.00 42.22 ? 234 LYS F CB 1 +ATOM 30326 C CG . LYS F 1 234 ? -38.732 -14.364 23.566 1.00 46.84 ? 234 LYS F CG 1 +ATOM 30327 C CD . LYS F 1 234 ? -39.205 -12.958 23.910 1.00 48.94 ? 234 LYS F CD 1 +ATOM 30328 C CE . LYS F 1 234 ? -39.224 -12.071 22.675 1.00 50.28 ? 234 LYS F CE 1 +ATOM 30329 N NZ . LYS F 1 234 ? -39.450 -10.642 23.037 1.00 52.13 ? 234 LYS F NZ 1 +ATOM 30330 N N . LEU F 1 235 ? -35.506 -15.973 24.875 1.00 38.40 ? 235 LEU F N 1 +ATOM 30331 C CA . LEU F 1 235 ? -34.131 -15.719 24.440 1.00 36.44 ? 235 LEU F CA 1 +ATOM 30332 C C . LEU F 1 235 ? -33.492 -16.969 23.848 1.00 36.74 ? 235 LEU F C 1 +ATOM 30333 O O . LEU F 1 235 ? -32.837 -16.920 22.800 1.00 36.07 ? 235 LEU F O 1 +ATOM 30334 C CB . LEU F 1 235 ? -33.272 -15.241 25.616 1.00 34.95 ? 235 LEU F CB 1 +ATOM 30335 C CG . LEU F 1 235 ? -31.755 -15.318 25.379 1.00 32.06 ? 235 LEU F CG 1 +ATOM 30336 C CD1 . LEU F 1 235 ? -31.341 -14.259 24.379 1.00 28.88 ? 235 LEU F CD1 1 +ATOM 30337 C CD2 . LEU F 1 235 ? -31.021 -15.136 26.697 1.00 30.22 ? 235 LEU F CD2 1 +ATOM 30338 N N . ILE F 1 236 ? -33.668 -18.090 24.535 1.00 37.44 ? 236 ILE F N 1 +ATOM 30339 C CA . ILE F 1 236 ? -33.106 -19.346 24.067 1.00 38.23 ? 236 ILE F CA 1 +ATOM 30340 C C . ILE F 1 236 ? -33.721 -19.715 22.724 1.00 39.92 ? 236 ILE F C 1 +ATOM 30341 O O . ILE F 1 236 ? -33.012 -20.102 21.795 1.00 40.95 ? 236 ILE F O 1 +ATOM 30342 C CB . ILE F 1 236 ? -33.331 -20.465 25.114 1.00 37.96 ? 236 ILE F CB 1 +ATOM 30343 C CG1 . ILE F 1 236 ? -32.418 -20.212 26.324 1.00 37.51 ? 236 ILE F CG1 1 +ATOM 30344 C CG2 . ILE F 1 236 ? -33.050 -21.826 24.509 1.00 37.42 ? 236 ILE F CG2 1 +ATOM 30345 C CD1 . ILE F 1 236 ? -32.686 -21.117 27.512 1.00 37.18 ? 236 ILE F CD1 1 +ATOM 30346 N N . ASP F 1 237 ? -35.036 -19.572 22.597 1.00 42.29 ? 237 ASP F N 1 +ATOM 30347 C CA . ASP F 1 237 ? -35.664 -19.901 21.330 1.00 44.00 ? 237 ASP F CA 1 +ATOM 30348 C C . ASP F 1 237 ? -35.177 -18.985 20.213 1.00 43.15 ? 237 ASP F C 1 +ATOM 30349 O O . ASP F 1 237 ? -34.923 -19.436 19.096 1.00 44.00 ? 237 ASP F O 1 +ATOM 30350 C CB . ASP F 1 237 ? -37.181 -19.845 21.455 1.00 49.18 ? 237 ASP F CB 1 +ATOM 30351 C CG . ASP F 1 237 ? -37.718 -20.879 22.438 1.00 56.31 ? 237 ASP F CG 1 +ATOM 30352 O OD1 . ASP F 1 237 ? -37.216 -22.035 22.443 1.00 57.63 ? 237 ASP F OD1 1 +ATOM 30353 O OD2 . ASP F 1 237 ? -38.654 -20.540 23.203 1.00 61.55 ? 237 ASP F OD2 1 +ATOM 30354 N N . GLU F 1 238 ? -35.032 -17.700 20.503 1.00 41.45 ? 238 GLU F N 1 +ATOM 30355 C CA . GLU F 1 238 ? -34.548 -16.777 19.486 1.00 41.49 ? 238 GLU F CA 1 +ATOM 30356 C C . GLU F 1 238 ? -33.143 -17.159 19.026 1.00 38.37 ? 238 GLU F C 1 +ATOM 30357 O O . GLU F 1 238 ? -32.833 -17.111 17.841 1.00 38.22 ? 238 GLU F O 1 +ATOM 30358 C CB . GLU F 1 238 ? -34.547 -15.347 20.023 1.00 43.90 ? 238 GLU F CB 1 +ATOM 30359 C CG . GLU F 1 238 ? -35.922 -14.729 20.093 1.00 51.79 ? 238 GLU F CG 1 +ATOM 30360 C CD . GLU F 1 238 ? -35.936 -13.449 20.904 1.00 58.53 ? 238 GLU F CD 1 +ATOM 30361 O OE1 . GLU F 1 238 ? -35.704 -13.535 22.134 1.00 62.23 ? 238 GLU F OE1 1 +ATOM 30362 O OE2 . GLU F 1 238 ? -36.172 -12.358 20.321 1.00 61.70 ? 238 GLU F OE2 1 +ATOM 30363 N N . LEU F 1 239 ? -32.295 -17.548 19.968 1.00 36.84 ? 239 LEU F N 1 +ATOM 30364 C CA . LEU F 1 239 ? -30.927 -17.921 19.638 1.00 34.93 ? 239 LEU F CA 1 +ATOM 30365 C C . LEU F 1 239 ? -30.895 -19.216 18.853 1.00 34.58 ? 239 LEU F C 1 +ATOM 30366 O O . LEU F 1 239 ? -30.164 -19.345 17.873 1.00 31.97 ? 239 LEU F O 1 +ATOM 30367 C CB . LEU F 1 239 ? -30.105 -18.066 20.918 1.00 34.66 ? 239 LEU F CB 1 +ATOM 30368 C CG . LEU F 1 239 ? -29.835 -16.733 21.605 1.00 34.93 ? 239 LEU F CG 1 +ATOM 30369 C CD1 . LEU F 1 239 ? -29.154 -16.947 22.938 1.00 32.63 ? 239 LEU F CD1 1 +ATOM 30370 C CD2 . LEU F 1 239 ? -28.977 -15.879 20.671 1.00 35.03 ? 239 LEU F CD2 1 +ATOM 30371 N N . HIS F 1 240 ? -31.679 -20.190 19.291 1.00 35.15 ? 240 HIS F N 1 +ATOM 30372 C CA . HIS F 1 240 ? -31.704 -21.453 18.575 1.00 37.29 ? 240 HIS F CA 1 +ATOM 30373 C C . HIS F 1 240 ? -32.288 -21.270 17.173 1.00 37.04 ? 240 HIS F C 1 +ATOM 30374 O O . HIS F 1 240 ? -31.805 -21.893 16.236 1.00 36.84 ? 240 HIS F O 1 +ATOM 30375 C CB . HIS F 1 240 ? -32.478 -22.510 19.368 1.00 37.77 ? 240 HIS F CB 1 +ATOM 30376 C CG . HIS F 1 240 ? -31.742 -23.006 20.575 1.00 40.18 ? 240 HIS F CG 1 +ATOM 30377 N ND1 . HIS F 1 240 ? -32.365 -23.674 21.608 1.00 40.51 ? 240 HIS F ND1 1 +ATOM 30378 C CD2 . HIS F 1 240 ? -30.433 -22.924 20.917 1.00 39.97 ? 240 HIS F CD2 1 +ATOM 30379 C CE1 . HIS F 1 240 ? -31.472 -23.979 22.533 1.00 39.88 ? 240 HIS F CE1 1 +ATOM 30380 N NE2 . HIS F 1 240 ? -30.292 -23.534 22.138 1.00 39.32 ? 240 HIS F NE2 1 +ATOM 30381 N N . LYS F 1 241 ? -33.302 -20.420 17.014 1.00 36.83 ? 241 LYS F N 1 +ATOM 30382 C CA . LYS F 1 241 ? -33.864 -20.199 15.678 1.00 39.69 ? 241 LYS F CA 1 +ATOM 30383 C C . LYS F 1 241 ? -32.756 -19.698 14.757 1.00 38.86 ? 241 LYS F C 1 +ATOM 30384 O O . LYS F 1 241 ? -32.742 -19.993 13.563 1.00 40.36 ? 241 LYS F O 1 +ATOM 30385 C CB . LYS F 1 241 ? -34.974 -19.148 15.696 1.00 42.88 ? 241 LYS F CB 1 +ATOM 30386 C CG . LYS F 1 241 ? -36.229 -19.546 16.444 1.00 49.50 ? 241 LYS F CG 1 +ATOM 30387 C CD . LYS F 1 241 ? -37.161 -18.346 16.562 1.00 53.31 ? 241 LYS F CD 1 +ATOM 30388 C CE . LYS F 1 241 ? -38.158 -18.507 17.702 1.00 56.06 ? 241 LYS F CE 1 +ATOM 30389 N NZ . LYS F 1 241 ? -38.757 -17.181 18.068 1.00 57.08 ? 241 LYS F NZ 1 +ATOM 30390 N N . ARG F 1 242 ? -31.827 -18.934 15.318 1.00 36.61 ? 242 ARG F N 1 +ATOM 30391 C CA . ARG F 1 242 ? -30.731 -18.386 14.543 1.00 34.52 ? 242 ARG F CA 1 +ATOM 30392 C C . ARG F 1 242 ? -29.507 -19.307 14.530 1.00 35.21 ? 242 ARG F C 1 +ATOM 30393 O O . ARG F 1 242 ? -28.437 -18.933 14.046 1.00 34.50 ? 242 ARG F O 1 +ATOM 30394 C CB . ARG F 1 242 ? -30.379 -16.999 15.087 1.00 33.57 ? 242 ARG F CB 1 +ATOM 30395 C CG . ARG F 1 242 ? -31.542 -15.981 15.009 1.00 33.10 ? 242 ARG F CG 1 +ATOM 30396 C CD . ARG F 1 242 ? -31.242 -14.745 15.847 1.00 35.63 ? 242 ARG F CD 1 +ATOM 30397 N NE . ARG F 1 242 ? -32.174 -13.622 15.696 1.00 34.46 ? 242 ARG F NE 1 +ATOM 30398 C CZ . ARG F 1 242 ? -33.466 -13.643 16.022 1.00 36.54 ? 242 ARG F CZ 1 +ATOM 30399 N NH1 . ARG F 1 242 ? -34.032 -14.741 16.515 1.00 34.53 ? 242 ARG F NH1 1 +ATOM 30400 N NH2 . ARG F 1 242 ? -34.188 -12.537 15.902 1.00 35.00 ? 242 ARG F NH2 1 +ATOM 30401 N N . ASN F 1 243 ? -29.673 -20.523 15.046 1.00 36.66 ? 243 ASN F N 1 +ATOM 30402 C CA . ASN F 1 243 ? -28.585 -21.501 15.078 1.00 37.46 ? 243 ASN F CA 1 +ATOM 30403 C C . ASN F 1 243 ? -27.375 -21.028 15.878 1.00 36.00 ? 243 ASN F C 1 +ATOM 30404 O O . ASN F 1 243 ? -26.220 -21.257 15.504 1.00 34.48 ? 243 ASN F O 1 +ATOM 30405 C CB . ASN F 1 243 ? -28.155 -21.840 13.657 1.00 42.91 ? 243 ASN F CB 1 +ATOM 30406 C CG . ASN F 1 243 ? -29.083 -22.829 13.000 1.00 49.59 ? 243 ASN F CG 1 +ATOM 30407 O OD1 . ASN F 1 243 ? -29.129 -24.004 13.388 1.00 53.87 ? 243 ASN F OD1 1 +ATOM 30408 N ND2 . ASN F 1 243 ? -29.839 -22.366 12.004 1.00 51.06 ? 243 ASN F ND2 1 +ATOM 30409 N N . VAL F 1 244 ? -27.651 -20.361 16.986 1.00 34.43 ? 244 VAL F N 1 +ATOM 30410 C CA . VAL F 1 244 ? -26.597 -19.863 17.842 1.00 32.33 ? 244 VAL F CA 1 +ATOM 30411 C C . VAL F 1 244 ? -26.715 -20.524 19.204 1.00 31.19 ? 244 VAL F C 1 +ATOM 30412 O O . VAL F 1 244 ? -27.784 -20.532 19.805 1.00 29.97 ? 244 VAL F O 1 +ATOM 30413 C CB . VAL F 1 244 ? -26.697 -18.334 17.987 1.00 32.95 ? 244 VAL F CB 1 +ATOM 30414 C CG1 . VAL F 1 244 ? -25.721 -17.842 19.046 1.00 31.25 ? 244 VAL F CG1 1 +ATOM 30415 C CG2 . VAL F 1 244 ? -26.407 -17.680 16.647 1.00 30.12 ? 244 VAL F CG2 1 +ATOM 30416 N N . LYS F 1 245 ? -25.618 -21.099 19.678 1.00 31.07 ? 245 LYS F N 1 +ATOM 30417 C CA . LYS F 1 245 ? -25.611 -21.754 20.987 1.00 32.20 ? 245 LYS F CA 1 +ATOM 30418 C C . LYS F 1 245 ? -25.528 -20.724 22.108 1.00 31.24 ? 245 LYS F C 1 +ATOM 30419 O O . LYS F 1 245 ? -25.033 -19.621 21.913 1.00 30.80 ? 245 LYS F O 1 +ATOM 30420 C CB . LYS F 1 245 ? -24.415 -22.692 21.108 1.00 32.72 ? 245 LYS F CB 1 +ATOM 30421 C CG . LYS F 1 245 ? -24.331 -23.725 20.018 1.00 36.48 ? 245 LYS F CG 1 +ATOM 30422 C CD . LYS F 1 245 ? -25.487 -24.707 20.103 1.00 37.64 ? 245 LYS F CD 1 +ATOM 30423 C CE . LYS F 1 245 ? -25.453 -25.654 18.920 1.00 38.44 ? 245 LYS F CE 1 +ATOM 30424 N NZ . LYS F 1 245 ? -26.511 -26.691 19.046 1.00 43.07 ? 245 LYS F NZ 1 +ATOM 30425 N N . LEU F 1 246 ? -26.019 -21.094 23.280 1.00 31.79 ? 246 LEU F N 1 +ATOM 30426 C CA . LEU F 1 246 ? -25.983 -20.219 24.441 1.00 32.93 ? 246 LEU F CA 1 +ATOM 30427 C C . LEU F 1 246 ? -25.143 -20.870 25.547 1.00 32.72 ? 246 LEU F C 1 +ATOM 30428 O O . LEU F 1 246 ? -25.459 -21.970 26.009 1.00 33.80 ? 246 LEU F O 1 +ATOM 30429 C CB . LEU F 1 246 ? -27.398 -19.956 24.965 1.00 31.37 ? 246 LEU F CB 1 +ATOM 30430 C CG . LEU F 1 246 ? -27.414 -19.149 26.271 1.00 33.19 ? 246 LEU F CG 1 +ATOM 30431 C CD1 . LEU F 1 246 ? -26.874 -17.742 26.016 1.00 31.67 ? 246 LEU F CD1 1 +ATOM 30432 C CD2 . LEU F 1 246 ? -28.825 -19.087 26.830 1.00 32.47 ? 246 LEU F CD2 1 +ATOM 30433 N N . ILE F 1 247 ? -24.062 -20.208 25.949 1.00 31.34 ? 247 ILE F N 1 +ATOM 30434 C CA . ILE F 1 247 ? -23.205 -20.729 27.010 1.00 28.95 ? 247 ILE F CA 1 +ATOM 30435 C C . ILE F 1 247 ? -23.323 -19.766 28.179 1.00 29.28 ? 247 ILE F C 1 +ATOM 30436 O O . ILE F 1 247 ? -23.167 -18.560 28.013 1.00 29.60 ? 247 ILE F O 1 +ATOM 30437 C CB . ILE F 1 247 ? -21.726 -20.818 26.558 1.00 30.33 ? 247 ILE F CB 1 +ATOM 30438 C CG1 . ILE F 1 247 ? -21.573 -21.819 25.408 1.00 28.24 ? 247 ILE F CG1 1 +ATOM 30439 C CG2 . ILE F 1 247 ? -20.848 -21.224 27.712 1.00 26.96 ? 247 ILE F CG2 1 +ATOM 30440 C CD1 . ILE F 1 247 ? -21.901 -21.245 24.044 1.00 30.34 ? 247 ILE F CD1 1 +ATOM 30441 N N . THR F 1 248 ? -23.616 -20.292 29.360 1.00 29.24 ? 248 THR F N 1 +ATOM 30442 C CA . THR F 1 248 ? -23.764 -19.452 30.540 1.00 29.82 ? 248 THR F CA 1 +ATOM 30443 C C . THR F 1 248 ? -22.659 -19.689 31.567 1.00 30.33 ? 248 THR F C 1 +ATOM 30444 O O . THR F 1 248 ? -22.268 -20.823 31.831 1.00 29.52 ? 248 THR F O 1 +ATOM 30445 C CB . THR F 1 248 ? -25.115 -19.693 31.225 1.00 29.91 ? 248 THR F CB 1 +ATOM 30446 O OG1 . THR F 1 248 ? -25.213 -21.067 31.609 1.00 30.87 ? 248 THR F OG1 1 +ATOM 30447 C CG2 . THR F 1 248 ? -26.253 -19.348 30.288 1.00 29.44 ? 248 THR F CG2 1 +ATOM 30448 N N . ILE F 1 249 ? -22.158 -18.601 32.137 1.00 30.30 ? 249 ILE F N 1 +ATOM 30449 C CA . ILE F 1 249 ? -21.118 -18.695 33.136 1.00 29.89 ? 249 ILE F CA 1 +ATOM 30450 C C . ILE F 1 249 ? -21.724 -19.197 34.441 1.00 30.75 ? 249 ILE F C 1 +ATOM 30451 O O . ILE F 1 249 ? -22.877 -18.895 34.772 1.00 29.37 ? 249 ILE F O 1 +ATOM 30452 C CB . ILE F 1 249 ? -20.447 -17.319 33.366 1.00 29.95 ? 249 ILE F CB 1 +ATOM 30453 C CG1 . ILE F 1 249 ? -19.157 -17.497 34.173 1.00 29.29 ? 249 ILE F CG1 1 +ATOM 30454 C CG2 . ILE F 1 249 ? -21.397 -16.381 34.105 1.00 28.28 ? 249 ILE F CG2 1 +ATOM 30455 C CD1 . ILE F 1 249 ? -18.312 -16.258 34.228 1.00 30.22 ? 249 ILE F CD1 1 +ATOM 30456 N N . VAL F 1 250 ? -20.942 -19.981 35.169 1.00 32.33 ? 250 VAL F N 1 +ATOM 30457 C CA . VAL F 1 250 ? -21.375 -20.517 36.450 1.00 35.12 ? 250 VAL F CA 1 +ATOM 30458 C C . VAL F 1 250 ? -20.179 -20.445 37.387 1.00 36.66 ? 250 VAL F C 1 +ATOM 30459 O O . VAL F 1 250 ? -19.161 -21.085 37.139 1.00 38.46 ? 250 VAL F O 1 +ATOM 30460 C CB . VAL F 1 250 ? -21.834 -21.998 36.316 1.00 33.92 ? 250 VAL F CB 1 +ATOM 30461 C CG1 . VAL F 1 250 ? -22.188 -22.568 37.673 1.00 31.89 ? 250 VAL F CG1 1 +ATOM 30462 C CG2 . VAL F 1 250 ? -23.034 -22.082 35.384 1.00 34.92 ? 250 VAL F CG2 1 +ATOM 30463 N N . ASP F 1 251 ? -20.282 -19.647 38.442 1.00 38.08 ? 251 ASP F N 1 +ATOM 30464 C CA . ASP F 1 251 ? -19.186 -19.553 39.395 1.00 39.13 ? 251 ASP F CA 1 +ATOM 30465 C C . ASP F 1 251 ? -19.324 -20.688 40.406 1.00 39.80 ? 251 ASP F C 1 +ATOM 30466 O O . ASP F 1 251 ? -20.191 -21.539 40.268 1.00 40.09 ? 251 ASP F O 1 +ATOM 30467 C CB . ASP F 1 251 ? -19.205 -18.206 40.098 1.00 40.42 ? 251 ASP F CB 1 +ATOM 30468 C CG . ASP F 1 251 ? -19.121 -17.049 39.128 1.00 42.43 ? 251 ASP F CG 1 +ATOM 30469 O OD1 . ASP F 1 251 ? -18.089 -16.931 38.423 1.00 41.97 ? 251 ASP F OD1 1 +ATOM 30470 O OD2 . ASP F 1 251 ? -20.094 -16.263 39.068 1.00 42.12 ? 251 ASP F OD2 1 +ATOM 30471 N N . HIS F 1 252 ? -18.474 -20.695 41.424 1.00 40.69 ? 252 HIS F N 1 +ATOM 30472 C CA . HIS F 1 252 ? -18.487 -21.759 42.429 1.00 40.20 ? 252 HIS F CA 1 +ATOM 30473 C C . HIS F 1 252 ? -18.996 -21.278 43.792 1.00 39.37 ? 252 HIS F C 1 +ATOM 30474 O O . HIS F 1 252 ? -19.058 -22.058 44.742 1.00 39.87 ? 252 HIS F O 1 +ATOM 30475 C CB . HIS F 1 252 ? -17.066 -22.315 42.585 1.00 39.71 ? 252 HIS F CB 1 +ATOM 30476 C CG . HIS F 1 252 ? -16.089 -21.305 43.094 1.00 40.99 ? 252 HIS F CG 1 +ATOM 30477 N ND1 . HIS F 1 252 ? -16.075 -19.999 42.650 1.00 42.39 ? 252 HIS F ND1 1 +ATOM 30478 C CD2 . HIS F 1 252 ? -15.125 -21.390 44.040 1.00 42.77 ? 252 HIS F CD2 1 +ATOM 30479 C CE1 . HIS F 1 252 ? -15.148 -19.322 43.305 1.00 40.99 ? 252 HIS F CE1 1 +ATOM 30480 N NE2 . HIS F 1 252 ? -14.557 -20.143 44.154 1.00 41.90 ? 252 HIS F NE2 1 +ATOM 30481 N N . GLY F 1 253 ? -19.348 -20.000 43.890 1.00 36.59 ? 253 GLY F N 1 +ATOM 30482 C CA . GLY F 1 253 ? -19.827 -19.477 45.151 1.00 34.91 ? 253 GLY F CA 1 +ATOM 30483 C C . GLY F 1 253 ? -21.335 -19.530 45.351 1.00 33.21 ? 253 GLY F C 1 +ATOM 30484 O O . GLY F 1 253 ? -22.102 -19.048 44.527 1.00 33.43 ? 253 GLY F O 1 +ATOM 30485 N N . ILE F 1 254 ? -21.753 -20.115 46.464 1.00 31.34 ? 254 ILE F N 1 +ATOM 30486 C CA . ILE F 1 254 ? -23.159 -20.228 46.804 1.00 30.62 ? 254 ILE F CA 1 +ATOM 30487 C C . ILE F 1 254 ? -23.468 -19.153 47.847 1.00 31.86 ? 254 ILE F C 1 +ATOM 30488 O O . ILE F 1 254 ? -22.887 -19.141 48.933 1.00 31.27 ? 254 ILE F O 1 +ATOM 30489 C CB . ILE F 1 254 ? -23.475 -21.629 47.395 1.00 30.38 ? 254 ILE F CB 1 +ATOM 30490 C CG1 . ILE F 1 254 ? -23.203 -22.714 46.346 1.00 30.50 ? 254 ILE F CG1 1 +ATOM 30491 C CG2 . ILE F 1 254 ? -24.917 -21.686 47.872 1.00 27.92 ? 254 ILE F CG2 1 +ATOM 30492 C CD1 . ILE F 1 254 ? -24.132 -22.648 45.141 1.00 30.06 ? 254 ILE F CD1 1 +ATOM 30493 N N . ARG F 1 255 ? -24.391 -18.256 47.515 1.00 31.59 ? 255 ARG F N 1 +ATOM 30494 C CA . ARG F 1 255 ? -24.758 -17.172 48.406 1.00 31.67 ? 255 ARG F CA 1 +ATOM 30495 C C . ARG F 1 255 ? -25.411 -17.640 49.697 1.00 32.24 ? 255 ARG F C 1 +ATOM 30496 O O . ARG F 1 255 ? -26.343 -18.434 49.665 1.00 34.54 ? 255 ARG F O 1 +ATOM 30497 C CB . ARG F 1 255 ? -25.682 -16.206 47.675 1.00 32.54 ? 255 ARG F CB 1 +ATOM 30498 C CG . ARG F 1 255 ? -26.074 -15.000 48.489 1.00 33.86 ? 255 ARG F CG 1 +ATOM 30499 C CD . ARG F 1 255 ? -26.470 -13.845 47.602 1.00 35.04 ? 255 ARG F CD 1 +ATOM 30500 N NE . ARG F 1 255 ? -27.754 -13.300 48.015 1.00 38.26 ? 255 ARG F NE 1 +ATOM 30501 C CZ . ARG F 1 255 ? -27.988 -12.009 48.206 1.00 39.15 ? 255 ARG F CZ 1 +ATOM 30502 N NH1 . ARG F 1 255 ? -27.018 -11.121 48.024 1.00 37.39 ? 255 ARG F NH1 1 +ATOM 30503 N NH2 . ARG F 1 255 ? -29.200 -11.611 48.571 1.00 39.71 ? 255 ARG F NH2 1 +ATOM 30504 N N . VAL F 1 256 ? -24.911 -17.148 50.831 1.00 31.47 ? 256 VAL F N 1 +ATOM 30505 C CA . VAL F 1 256 ? -25.447 -17.506 52.139 1.00 30.83 ? 256 VAL F CA 1 +ATOM 30506 C C . VAL F 1 256 ? -26.717 -16.698 52.283 1.00 32.32 ? 256 VAL F C 1 +ATOM 30507 O O . VAL F 1 256 ? -26.745 -15.645 52.916 1.00 34.50 ? 256 VAL F O 1 +ATOM 30508 C CB . VAL F 1 256 ? -24.449 -17.157 53.262 1.00 28.39 ? 256 VAL F CB 1 +ATOM 30509 C CG1 . VAL F 1 256 ? -25.045 -17.478 54.619 1.00 26.17 ? 256 VAL F CG1 1 +ATOM 30510 C CG2 . VAL F 1 256 ? -23.163 -17.947 53.056 1.00 28.61 ? 256 VAL F CG2 1 +ATOM 30511 N N . ASP F 1 257 ? -27.769 -17.214 51.671 1.00 34.11 ? 257 ASP F N 1 +ATOM 30512 C CA . ASP F 1 257 ? -29.068 -16.563 51.636 1.00 36.23 ? 257 ASP F CA 1 +ATOM 30513 C C . ASP F 1 257 ? -30.129 -17.534 52.156 1.00 36.63 ? 257 ASP F C 1 +ATOM 30514 O O . ASP F 1 257 ? -30.284 -18.633 51.635 1.00 36.32 ? 257 ASP F O 1 +ATOM 30515 C CB . ASP F 1 257 ? -29.357 -16.171 50.185 1.00 37.57 ? 257 ASP F CB 1 +ATOM 30516 C CG . ASP F 1 257 ? -30.586 -15.313 50.032 1.00 40.55 ? 257 ASP F CG 1 +ATOM 30517 O OD1 . ASP F 1 257 ? -31.625 -15.624 50.657 1.00 41.54 ? 257 ASP F OD1 1 +ATOM 30518 O OD2 . ASP F 1 257 ? -30.509 -14.328 49.260 1.00 43.67 ? 257 ASP F OD2 1 +ATOM 30519 N N . GLN F 1 258 ? -30.842 -17.111 53.193 1.00 37.92 ? 258 GLN F N 1 +ATOM 30520 C CA . GLN F 1 258 ? -31.898 -17.891 53.837 1.00 38.44 ? 258 GLN F CA 1 +ATOM 30521 C C . GLN F 1 258 ? -33.015 -18.380 52.921 1.00 39.79 ? 258 GLN F C 1 +ATOM 30522 O O . GLN F 1 258 ? -33.672 -19.378 53.217 1.00 40.39 ? 258 GLN F O 1 +ATOM 30523 C CB . GLN F 1 258 ? -32.535 -17.054 54.935 1.00 37.64 ? 258 GLN F CB 1 +ATOM 30524 C CG . GLN F 1 258 ? -32.131 -17.457 56.303 1.00 37.37 ? 258 GLN F CG 1 +ATOM 30525 C CD . GLN F 1 258 ? -32.569 -16.469 57.353 1.00 34.62 ? 258 GLN F CD 1 +ATOM 30526 O OE1 . GLN F 1 258 ? -32.503 -16.769 58.534 1.00 36.01 ? 258 GLN F OE1 1 +ATOM 30527 N NE2 . GLN F 1 258 ? -33.002 -15.282 56.936 1.00 31.46 ? 258 GLN F NE2 1 +ATOM 30528 N N . ASN F 1 259 ? -33.244 -17.670 51.826 1.00 40.07 ? 259 ASN F N 1 +ATOM 30529 C CA . ASN F 1 259 ? -34.308 -18.045 50.910 1.00 41.99 ? 259 ASN F CA 1 +ATOM 30530 C C . ASN F 1 259 ? -33.795 -18.410 49.537 1.00 41.04 ? 259 ASN F C 1 +ATOM 30531 O O . ASN F 1 259 ? -34.542 -18.387 48.564 1.00 42.94 ? 259 ASN F O 1 +ATOM 30532 C CB . ASN F 1 259 ? -35.314 -16.898 50.813 1.00 44.23 ? 259 ASN F CB 1 +ATOM 30533 C CG . ASN F 1 259 ? -35.937 -16.572 52.156 1.00 45.63 ? 259 ASN F CG 1 +ATOM 30534 O OD1 . ASN F 1 259 ? -35.943 -15.421 52.586 1.00 48.29 ? 259 ASN F OD1 1 +ATOM 30535 N ND2 . ASN F 1 259 ? -36.458 -17.592 52.829 1.00 43.43 ? 259 ASN F ND2 1 +ATOM 30536 N N . TYR F 1 260 ? -32.515 -18.748 49.467 1.00 39.38 ? 260 TYR F N 1 +ATOM 30537 C CA . TYR F 1 260 ? -31.887 -19.138 48.217 1.00 38.04 ? 260 TYR F CA 1 +ATOM 30538 C C . TYR F 1 260 ? -31.809 -20.669 48.190 1.00 37.48 ? 260 TYR F C 1 +ATOM 30539 O O . TYR F 1 260 ? -31.066 -21.283 48.956 1.00 36.56 ? 260 TYR F O 1 +ATOM 30540 C CB . TYR F 1 260 ? -30.501 -18.503 48.142 1.00 36.46 ? 260 TYR F CB 1 +ATOM 30541 C CG . TYR F 1 260 ? -29.709 -18.843 46.909 1.00 34.79 ? 260 TYR F CG 1 +ATOM 30542 C CD1 . TYR F 1 260 ? -30.260 -18.706 45.638 1.00 34.79 ? 260 TYR F CD1 1 +ATOM 30543 C CD2 . TYR F 1 260 ? -28.396 -19.285 47.014 1.00 35.19 ? 260 TYR F CD2 1 +ATOM 30544 C CE1 . TYR F 1 260 ? -29.519 -19.001 44.502 1.00 36.45 ? 260 TYR F CE1 1 +ATOM 30545 C CE2 . TYR F 1 260 ? -27.640 -19.583 45.883 1.00 35.06 ? 260 TYR F CE2 1 +ATOM 30546 C CZ . TYR F 1 260 ? -28.205 -19.441 44.634 1.00 36.22 ? 260 TYR F CZ 1 +ATOM 30547 O OH . TYR F 1 260 ? -27.465 -19.749 43.522 1.00 36.41 ? 260 TYR F OH 1 +ATOM 30548 N N . SER F 1 261 ? -32.588 -21.269 47.301 1.00 36.77 ? 261 SER F N 1 +ATOM 30549 C CA . SER F 1 261 ? -32.669 -22.720 47.175 1.00 38.17 ? 261 SER F CA 1 +ATOM 30550 C C . SER F 1 261 ? -31.358 -23.529 47.182 1.00 36.71 ? 261 SER F C 1 +ATOM 30551 O O . SER F 1 261 ? -31.215 -24.470 47.958 1.00 37.02 ? 261 SER F O 1 +ATOM 30552 C CB . SER F 1 261 ? -33.485 -23.065 45.931 1.00 40.22 ? 261 SER F CB 1 +ATOM 30553 O OG . SER F 1 261 ? -33.627 -24.468 45.811 1.00 46.82 ? 261 SER F OG 1 +ATOM 30554 N N . PRO F 1 262 ? -30.391 -23.187 46.313 1.00 36.28 ? 262 PRO F N 1 +ATOM 30555 C CA . PRO F 1 262 ? -29.122 -23.934 46.286 1.00 35.11 ? 262 PRO F CA 1 +ATOM 30556 C C . PRO F 1 262 ? -28.410 -23.976 47.634 1.00 35.20 ? 262 PRO F C 1 +ATOM 30557 O O . PRO F 1 262 ? -27.751 -24.959 47.965 1.00 36.25 ? 262 PRO F O 1 +ATOM 30558 C CB . PRO F 1 262 ? -28.303 -23.190 45.234 1.00 34.99 ? 262 PRO F CB 1 +ATOM 30559 C CG . PRO F 1 262 ? -29.349 -22.696 44.289 1.00 34.34 ? 262 PRO F CG 1 +ATOM 30560 C CD . PRO F 1 262 ? -30.428 -22.186 45.231 1.00 35.30 ? 262 PRO F CD 1 +ATOM 30561 N N . PHE F 1 263 ? -28.531 -22.900 48.403 1.00 34.14 ? 263 PHE F N 1 +ATOM 30562 C CA . PHE F 1 263 ? -27.906 -22.834 49.717 1.00 33.56 ? 263 PHE F CA 1 +ATOM 30563 C C . PHE F 1 263 ? -28.562 -23.842 50.649 1.00 33.95 ? 263 PHE F C 1 +ATOM 30564 O O . PHE F 1 263 ? -27.880 -24.564 51.373 1.00 34.99 ? 263 PHE F O 1 +ATOM 30565 C CB . PHE F 1 263 ? -28.043 -21.421 50.304 1.00 32.44 ? 263 PHE F CB 1 +ATOM 30566 C CG . PHE F 1 263 ? -27.497 -21.285 51.696 1.00 30.94 ? 263 PHE F CG 1 +ATOM 30567 C CD1 . PHE F 1 263 ? -26.170 -21.577 51.967 1.00 31.44 ? 263 PHE F CD1 1 +ATOM 30568 C CD2 . PHE F 1 263 ? -28.311 -20.855 52.733 1.00 32.42 ? 263 PHE F CD2 1 +ATOM 30569 C CE1 . PHE F 1 263 ? -25.654 -21.444 53.255 1.00 32.25 ? 263 PHE F CE1 1 +ATOM 30570 C CE2 . PHE F 1 263 ? -27.806 -20.715 54.028 1.00 33.58 ? 263 PHE F CE2 1 +ATOM 30571 C CZ . PHE F 1 263 ? -26.474 -21.011 54.289 1.00 32.45 ? 263 PHE F CZ 1 +ATOM 30572 N N . LEU F 1 264 ? -29.890 -23.887 50.624 1.00 34.97 ? 264 LEU F N 1 +ATOM 30573 C CA . LEU F 1 264 ? -30.641 -24.800 51.473 1.00 35.08 ? 264 LEU F CA 1 +ATOM 30574 C C . LEU F 1 264 ? -30.461 -26.265 51.059 1.00 35.55 ? 264 LEU F C 1 +ATOM 30575 O O . LEU F 1 264 ? -30.260 -27.127 51.913 1.00 35.99 ? 264 LEU F O 1 +ATOM 30576 C CB . LEU F 1 264 ? -32.122 -24.425 51.446 1.00 35.39 ? 264 LEU F CB 1 +ATOM 30577 C CG . LEU F 1 264 ? -32.418 -22.981 51.864 1.00 36.69 ? 264 LEU F CG 1 +ATOM 30578 C CD1 . LEU F 1 264 ? -33.909 -22.670 51.705 1.00 34.44 ? 264 LEU F CD1 1 +ATOM 30579 C CD2 . LEU F 1 264 ? -31.974 -22.781 53.305 1.00 35.08 ? 264 LEU F CD2 1 +ATOM 30580 N N . SER F 1 265 ? -30.499 -26.549 49.758 1.00 34.84 ? 265 SER F N 1 +ATOM 30581 C CA . SER F 1 265 ? -30.357 -27.921 49.297 1.00 33.98 ? 265 SER F CA 1 +ATOM 30582 C C . SER F 1 265 ? -28.915 -28.420 49.351 1.00 36.30 ? 265 SER F C 1 +ATOM 30583 O O . SER F 1 265 ? -28.667 -29.623 49.461 1.00 36.55 ? 265 SER F O 1 +ATOM 30584 C CB . SER F 1 265 ? -30.884 -28.059 47.870 1.00 34.00 ? 265 SER F CB 1 +ATOM 30585 O OG . SER F 1 265 ? -29.999 -27.488 46.916 1.00 34.47 ? 265 SER F OG 1 +ATOM 30586 N N . GLY F 1 266 ? -27.959 -27.502 49.260 1.00 35.77 ? 266 GLY F N 1 +ATOM 30587 C CA . GLY F 1 266 ? -26.569 -27.910 49.300 1.00 35.58 ? 266 GLY F CA 1 +ATOM 30588 C C . GLY F 1 266 ? -26.053 -28.092 50.717 1.00 35.97 ? 266 GLY F C 1 +ATOM 30589 O O . GLY F 1 266 ? -24.954 -28.614 50.922 1.00 34.66 ? 266 GLY F O 1 +ATOM 30590 N N . MET F 1 267 ? -26.841 -27.658 51.697 1.00 35.55 ? 267 MET F N 1 +ATOM 30591 C CA . MET F 1 267 ? -26.445 -27.772 53.094 1.00 37.47 ? 267 MET F CA 1 +ATOM 30592 C C . MET F 1 267 ? -25.970 -29.191 53.412 1.00 36.82 ? 267 MET F C 1 +ATOM 30593 O O . MET F 1 267 ? -26.630 -30.167 53.082 1.00 38.46 ? 267 MET F O 1 +ATOM 30594 C CB . MET F 1 267 ? -27.611 -27.378 54.011 1.00 37.75 ? 267 MET F CB 1 +ATOM 30595 C CG . MET F 1 267 ? -27.190 -27.069 55.438 1.00 39.80 ? 267 MET F CG 1 +ATOM 30596 S SD . MET F 1 267 ? -25.884 -25.805 55.533 1.00 40.95 ? 267 MET F SD 1 +ATOM 30597 C CE . MET F 1 267 ? -26.830 -24.307 55.195 1.00 42.13 ? 267 MET F CE 1 +ATOM 30598 N N . GLY F 1 268 ? -24.806 -29.296 54.040 1.00 36.49 ? 268 GLY F N 1 +ATOM 30599 C CA . GLY F 1 268 ? -24.257 -30.598 54.368 1.00 32.48 ? 268 GLY F CA 1 +ATOM 30600 C C . GLY F 1 268 ? -23.140 -30.961 53.409 1.00 32.68 ? 268 GLY F C 1 +ATOM 30601 O O . GLY F 1 268 ? -22.278 -31.783 53.718 1.00 32.13 ? 268 GLY F O 1 +ATOM 30602 N N . LYS F 1 269 ? -23.125 -30.321 52.246 1.00 32.07 ? 269 LYS F N 1 +ATOM 30603 C CA . LYS F 1 269 ? -22.116 -30.623 51.237 1.00 33.67 ? 269 LYS F CA 1 +ATOM 30604 C C . LYS F 1 269 ? -21.114 -29.492 50.943 1.00 32.68 ? 269 LYS F C 1 +ATOM 30605 O O . LYS F 1 269 ? -20.379 -29.530 49.949 1.00 32.57 ? 269 LYS F O 1 +ATOM 30606 C CB . LYS F 1 269 ? -22.830 -31.065 49.947 1.00 33.73 ? 269 LYS F CB 1 +ATOM 30607 C CG . LYS F 1 269 ? -23.636 -32.344 50.144 1.00 37.14 ? 269 LYS F CG 1 +ATOM 30608 C CD . LYS F 1 269 ? -24.566 -32.643 48.980 1.00 39.21 ? 269 LYS F CD 1 +ATOM 30609 C CE . LYS F 1 269 ? -25.752 -31.699 48.958 1.00 38.55 ? 269 LYS F CE 1 +ATOM 30610 N NZ . LYS F 1 269 ? -26.577 -31.839 50.186 1.00 39.68 ? 269 LYS F NZ 1 +ATOM 30611 N N . PHE F 1 270 ? -21.068 -28.496 51.816 1.00 30.42 ? 270 PHE F N 1 +ATOM 30612 C CA . PHE F 1 270 ? -20.160 -27.365 51.642 1.00 29.76 ? 270 PHE F CA 1 +ATOM 30613 C C . PHE F 1 270 ? -18.813 -27.562 52.345 1.00 29.91 ? 270 PHE F C 1 +ATOM 30614 O O . PHE F 1 270 ? -18.681 -28.404 53.230 1.00 30.52 ? 270 PHE F O 1 +ATOM 30615 C CB . PHE F 1 270 ? -20.818 -26.096 52.172 1.00 27.48 ? 270 PHE F CB 1 +ATOM 30616 C CG . PHE F 1 270 ? -22.120 -25.759 51.503 1.00 26.39 ? 270 PHE F CG 1 +ATOM 30617 C CD1 . PHE F 1 270 ? -22.194 -25.615 50.121 1.00 26.11 ? 270 PHE F CD1 1 +ATOM 30618 C CD2 . PHE F 1 270 ? -23.266 -25.560 52.256 1.00 24.71 ? 270 PHE F CD2 1 +ATOM 30619 C CE1 . PHE F 1 270 ? -23.393 -25.276 49.497 1.00 24.13 ? 270 PHE F CE1 1 +ATOM 30620 C CE2 . PHE F 1 270 ? -24.471 -25.222 51.639 1.00 26.79 ? 270 PHE F CE2 1 +ATOM 30621 C CZ . PHE F 1 270 ? -24.530 -25.080 50.253 1.00 24.23 ? 270 PHE F CZ 1 +ATOM 30622 N N . CYS F 1 271 ? -17.815 -26.782 51.942 1.00 30.38 ? 271 CYS F N 1 +ATOM 30623 C CA . CYS F 1 271 ? -16.485 -26.843 52.554 1.00 33.35 ? 271 CYS F CA 1 +ATOM 30624 C C . CYS F 1 271 ? -16.524 -26.333 53.989 1.00 31.33 ? 271 CYS F C 1 +ATOM 30625 O O . CYS F 1 271 ? -17.304 -25.439 54.315 1.00 29.58 ? 271 CYS F O 1 +ATOM 30626 C CB . CYS F 1 271 ? -15.490 -25.981 51.776 1.00 36.68 ? 271 CYS F CB 1 +ATOM 30627 S SG . CYS F 1 271 ? -15.202 -26.492 50.068 1.00 47.19 ? 271 CYS F SG 1 +ATOM 30628 N N . GLU F 1 272 ? -15.670 -26.893 54.840 1.00 31.99 ? 272 GLU F N 1 +ATOM 30629 C CA . GLU F 1 272 ? -15.607 -26.484 56.241 1.00 32.68 ? 272 GLU F CA 1 +ATOM 30630 C C . GLU F 1 272 ? -14.202 -26.027 56.566 1.00 31.37 ? 272 GLU F C 1 +ATOM 30631 O O . GLU F 1 272 ? -13.308 -26.084 55.729 1.00 29.23 ? 272 GLU F O 1 +ATOM 30632 C CB . GLU F 1 272 ? -15.963 -27.652 57.169 1.00 34.98 ? 272 GLU F CB 1 +ATOM 30633 C CG . GLU F 1 272 ? -17.293 -28.310 56.887 1.00 41.14 ? 272 GLU F CG 1 +ATOM 30634 C CD . GLU F 1 272 ? -17.540 -29.552 57.744 1.00 47.14 ? 272 GLU F CD 1 +ATOM 30635 O OE1 . GLU F 1 272 ? -16.547 -30.210 58.150 1.00 50.28 ? 272 GLU F OE1 1 +ATOM 30636 O OE2 . GLU F 1 272 ? -18.730 -29.884 57.994 1.00 48.56 ? 272 GLU F OE2 1 +ATOM 30637 N N . ILE F 1 273 ? -14.011 -25.572 57.795 1.00 33.50 ? 273 ILE F N 1 +ATOM 30638 C CA . ILE F 1 273 ? -12.691 -25.164 58.248 1.00 34.30 ? 273 ILE F CA 1 +ATOM 30639 C C . ILE F 1 273 ? -12.293 -26.135 59.362 1.00 35.88 ? 273 ILE F C 1 +ATOM 30640 O O . ILE F 1 273 ? -13.140 -26.853 59.898 1.00 35.19 ? 273 ILE F O 1 +ATOM 30641 C CB . ILE F 1 273 ? -12.688 -23.707 58.767 1.00 34.05 ? 273 ILE F CB 1 +ATOM 30642 C CG1 . ILE F 1 273 ? -13.757 -23.520 59.846 1.00 31.81 ? 273 ILE F CG1 1 +ATOM 30643 C CG2 . ILE F 1 273 ? -12.924 -22.745 57.605 1.00 32.38 ? 273 ILE F CG2 1 +ATOM 30644 C CD1 . ILE F 1 273 ? -13.675 -22.167 60.539 1.00 30.89 ? 273 ILE F CD1 1 +ATOM 30645 N N . GLU F 1 274 ? -11.005 -26.169 59.690 1.00 38.40 ? 274 GLU F N 1 +ATOM 30646 C CA . GLU F 1 274 ? -10.482 -27.058 60.730 1.00 40.70 ? 274 GLU F CA 1 +ATOM 30647 C C . GLU F 1 274 ? -11.391 -27.238 61.944 1.00 39.35 ? 274 GLU F C 1 +ATOM 30648 O O . GLU F 1 274 ? -11.672 -28.358 62.348 1.00 38.41 ? 274 GLU F O 1 +ATOM 30649 C CB . GLU F 1 274 ? -9.117 -26.557 61.212 1.00 44.74 ? 274 GLU F CB 1 +ATOM 30650 C CG . GLU F 1 274 ? -7.919 -27.207 60.550 1.00 53.08 ? 274 GLU F CG 1 +ATOM 30651 C CD . GLU F 1 274 ? -7.844 -28.711 60.819 1.00 60.43 ? 274 GLU F CD 1 +ATOM 30652 O OE1 . GLU F 1 274 ? -8.185 -29.135 61.952 1.00 62.58 ? 274 GLU F OE1 1 +ATOM 30653 O OE2 . GLU F 1 274 ? -7.431 -29.470 59.904 1.00 63.71 ? 274 GLU F OE2 1 +ATOM 30654 N N . SER F 1 275 ? -11.846 -26.134 62.527 1.00 39.23 ? 275 SER F N 1 +ATOM 30655 C CA . SER F 1 275 ? -12.686 -26.199 63.715 1.00 38.66 ? 275 SER F CA 1 +ATOM 30656 C C . SER F 1 275 ? -14.105 -26.742 63.549 1.00 38.06 ? 275 SER F C 1 +ATOM 30657 O O . SER F 1 275 ? -14.838 -26.865 64.528 1.00 38.94 ? 275 SER F O 1 +ATOM 30658 C CB . SER F 1 275 ? -12.720 -24.826 64.387 1.00 40.13 ? 275 SER F CB 1 +ATOM 30659 O OG . SER F 1 275 ? -12.907 -23.787 63.444 1.00 42.26 ? 275 SER F OG 1 +ATOM 30660 N N . GLY F 1 276 ? -14.508 -27.054 62.325 1.00 37.50 ? 276 GLY F N 1 +ATOM 30661 C CA . GLY F 1 276 ? -15.834 -27.615 62.137 1.00 37.59 ? 276 GLY F CA 1 +ATOM 30662 C C . GLY F 1 276 ? -16.948 -26.765 61.556 1.00 38.15 ? 276 GLY F C 1 +ATOM 30663 O O . GLY F 1 276 ? -17.936 -27.313 61.079 1.00 39.19 ? 276 GLY F O 1 +ATOM 30664 N N . GLU F 1 277 ? -16.833 -25.443 61.602 1.00 37.89 ? 277 GLU F N 1 +ATOM 30665 C CA . GLU F 1 277 ? -17.890 -24.615 61.036 1.00 38.08 ? 277 GLU F CA 1 +ATOM 30666 C C . GLU F 1 277 ? -17.759 -24.614 59.509 1.00 36.96 ? 277 GLU F C 1 +ATOM 30667 O O . GLU F 1 277 ? -16.797 -25.144 58.949 1.00 35.81 ? 277 GLU F O 1 +ATOM 30668 C CB . GLU F 1 277 ? -17.796 -23.161 61.525 1.00 38.92 ? 277 GLU F CB 1 +ATOM 30669 C CG . GLU F 1 277 ? -17.575 -22.953 62.999 1.00 43.06 ? 277 GLU F CG 1 +ATOM 30670 C CD . GLU F 1 277 ? -16.101 -22.805 63.336 1.00 48.02 ? 277 GLU F CD 1 +ATOM 30671 O OE1 . GLU F 1 277 ? -15.373 -23.822 63.259 1.00 50.11 ? 277 GLU F OE1 1 +ATOM 30672 O OE2 . GLU F 1 277 ? -15.665 -21.673 63.665 1.00 48.79 ? 277 GLU F OE2 1 +ATOM 30673 N N . LEU F 1 278 ? -18.736 -24.017 58.837 1.00 36.16 ? 278 LEU F N 1 +ATOM 30674 C CA . LEU F 1 278 ? -18.675 -23.906 57.388 1.00 34.27 ? 278 LEU F CA 1 +ATOM 30675 C C . LEU F 1 278 ? -17.619 -22.859 57.055 1.00 32.93 ? 278 LEU F C 1 +ATOM 30676 O O . LEU F 1 278 ? -17.334 -21.967 57.854 1.00 32.11 ? 278 LEU F O 1 +ATOM 30677 C CB . LEU F 1 278 ? -20.009 -23.419 56.815 1.00 33.10 ? 278 LEU F CB 1 +ATOM 30678 C CG . LEU F 1 278 ? -21.217 -24.346 56.826 1.00 32.77 ? 278 LEU F CG 1 +ATOM 30679 C CD1 . LEU F 1 278 ? -22.384 -23.666 56.120 1.00 32.46 ? 278 LEU F CD1 1 +ATOM 30680 C CD2 . LEU F 1 278 ? -20.857 -25.632 56.129 1.00 31.74 ? 278 LEU F CD2 1 +ATOM 30681 N N . PHE F 1 279 ? -17.025 -22.972 55.877 1.00 31.62 ? 279 PHE F N 1 +ATOM 30682 C CA . PHE F 1 279 ? -16.066 -21.975 55.459 1.00 29.13 ? 279 PHE F CA 1 +ATOM 30683 C C . PHE F 1 279 ? -16.902 -20.893 54.782 1.00 29.50 ? 279 PHE F C 1 +ATOM 30684 O O . PHE F 1 279 ? -17.435 -21.095 53.690 1.00 29.82 ? 279 PHE F O 1 +ATOM 30685 C CB . PHE F 1 279 ? -15.049 -22.549 54.473 1.00 26.74 ? 279 PHE F CB 1 +ATOM 30686 C CG . PHE F 1 279 ? -14.291 -21.493 53.719 1.00 26.77 ? 279 PHE F CG 1 +ATOM 30687 C CD1 . PHE F 1 279 ? -13.775 -20.378 54.387 1.00 27.13 ? 279 PHE F CD1 1 +ATOM 30688 C CD2 . PHE F 1 279 ? -14.116 -21.588 52.337 1.00 26.67 ? 279 PHE F CD2 1 +ATOM 30689 C CE1 . PHE F 1 279 ? -13.097 -19.369 53.684 1.00 27.33 ? 279 PHE F CE1 1 +ATOM 30690 C CE2 . PHE F 1 279 ? -13.442 -20.590 51.619 1.00 24.94 ? 279 PHE F CE2 1 +ATOM 30691 C CZ . PHE F 1 279 ? -12.934 -19.482 52.285 1.00 26.50 ? 279 PHE F CZ 1 +ATOM 30692 N N . VAL F 1 280 ? -17.049 -19.755 55.447 1.00 30.23 ? 280 VAL F N 1 +ATOM 30693 C CA . VAL F 1 280 ? -17.821 -18.663 54.883 1.00 29.59 ? 280 VAL F CA 1 +ATOM 30694 C C . VAL F 1 280 ? -16.850 -17.628 54.358 1.00 30.82 ? 280 VAL F C 1 +ATOM 30695 O O . VAL F 1 280 ? -16.007 -17.131 55.106 1.00 31.41 ? 280 VAL F O 1 +ATOM 30696 C CB . VAL F 1 280 ? -18.730 -18.019 55.931 1.00 28.61 ? 280 VAL F CB 1 +ATOM 30697 C CG1 . VAL F 1 280 ? -19.499 -16.872 55.306 1.00 27.67 ? 280 VAL F CG1 1 +ATOM 30698 C CG2 . VAL F 1 280 ? -19.678 -19.055 56.504 1.00 24.73 ? 280 VAL F CG2 1 +ATOM 30699 N N . GLY F 1 281 ? -16.965 -17.315 53.070 1.00 31.25 ? 281 GLY F N 1 +ATOM 30700 C CA . GLY F 1 281 ? -16.074 -16.347 52.459 1.00 31.30 ? 281 GLY F CA 1 +ATOM 30701 C C . GLY F 1 281 ? -16.797 -15.234 51.730 1.00 31.30 ? 281 GLY F C 1 +ATOM 30702 O O . GLY F 1 281 ? -17.935 -14.897 52.056 1.00 31.28 ? 281 GLY F O 1 +ATOM 30703 N N . LYS F 1 282 ? -16.127 -14.669 50.734 1.00 31.84 ? 282 LYS F N 1 +ATOM 30704 C CA . LYS F 1 282 ? -16.670 -13.576 49.947 1.00 33.76 ? 282 LYS F CA 1 +ATOM 30705 C C . LYS F 1 282 ? -16.397 -13.795 48.469 1.00 34.58 ? 282 LYS F C 1 +ATOM 30706 O O . LYS F 1 282 ? -15.282 -14.145 48.082 1.00 35.16 ? 282 LYS F O 1 +ATOM 30707 C CB . LYS F 1 282 ? -16.029 -12.256 50.390 1.00 37.34 ? 282 LYS F CB 1 +ATOM 30708 C CG . LYS F 1 282 ? -16.470 -11.752 51.757 1.00 39.50 ? 282 LYS F CG 1 +ATOM 30709 C CD . LYS F 1 282 ? -17.818 -11.051 51.665 1.00 43.79 ? 282 LYS F CD 1 +ATOM 30710 C CE . LYS F 1 282 ? -18.264 -10.495 53.012 1.00 46.19 ? 282 LYS F CE 1 +ATOM 30711 N NZ . LYS F 1 282 ? -18.655 -11.583 53.951 1.00 49.35 ? 282 LYS F NZ 1 +ATOM 30712 N N . MET F 1 283 ? -17.419 -13.581 47.651 1.00 33.86 ? 283 MET F N 1 +ATOM 30713 C CA . MET F 1 283 ? -17.309 -13.731 46.204 1.00 35.49 ? 283 MET F CA 1 +ATOM 30714 C C . MET F 1 283 ? -18.369 -12.817 45.586 1.00 35.37 ? 283 MET F C 1 +ATOM 30715 O O . MET F 1 283 ? -18.998 -12.050 46.307 1.00 35.76 ? 283 MET F O 1 +ATOM 30716 C CB . MET F 1 283 ? -17.547 -15.187 45.797 1.00 37.23 ? 283 MET F CB 1 +ATOM 30717 C CG . MET F 1 283 ? -16.389 -15.818 45.038 1.00 38.12 ? 283 MET F CG 1 +ATOM 30718 S SD . MET F 1 283 ? -16.139 -15.093 43.397 1.00 38.61 ? 283 MET F SD 1 +ATOM 30719 C CE . MET F 1 283 ? -17.280 -16.107 42.406 1.00 37.61 ? 283 MET F CE 1 +ATOM 30720 N N . TRP F 1 284 ? -18.574 -12.898 44.273 1.00 33.90 ? 284 TRP F N 1 +ATOM 30721 C CA . TRP F 1 284 ? -19.552 -12.040 43.589 1.00 34.61 ? 284 TRP F CA 1 +ATOM 30722 C C . TRP F 1 284 ? -20.893 -11.842 44.311 1.00 33.52 ? 284 TRP F C 1 +ATOM 30723 O O . TRP F 1 284 ? -21.355 -10.715 44.473 1.00 31.75 ? 284 TRP F O 1 +ATOM 30724 C CB . TRP F 1 284 ? -19.830 -12.567 42.175 1.00 36.87 ? 284 TRP F CB 1 +ATOM 30725 C CG . TRP F 1 284 ? -18.612 -12.688 41.299 1.00 39.83 ? 284 TRP F CG 1 +ATOM 30726 C CD1 . TRP F 1 284 ? -18.434 -13.571 40.271 1.00 40.20 ? 284 TRP F CD1 1 +ATOM 30727 C CD2 . TRP F 1 284 ? -17.419 -11.896 41.358 1.00 41.20 ? 284 TRP F CD2 1 +ATOM 30728 N NE1 . TRP F 1 284 ? -17.208 -13.377 39.687 1.00 42.01 ? 284 TRP F NE1 1 +ATOM 30729 C CE2 . TRP F 1 284 ? -16.562 -12.358 40.332 1.00 42.13 ? 284 TRP F CE2 1 +ATOM 30730 C CE3 . TRP F 1 284 ? -16.989 -10.843 42.177 1.00 43.82 ? 284 TRP F CE3 1 +ATOM 30731 C CZ2 . TRP F 1 284 ? -15.293 -11.802 40.102 1.00 44.28 ? 284 TRP F CZ2 1 +ATOM 30732 C CZ3 . TRP F 1 284 ? -15.724 -10.288 41.950 1.00 45.89 ? 284 TRP F CZ3 1 +ATOM 30733 C CH2 . TRP F 1 284 ? -14.892 -10.771 40.918 1.00 45.24 ? 284 TRP F CH2 1 +ATOM 30734 N N . PRO F 1 285 ? -21.545 -12.933 44.744 1.00 32.86 ? 285 PRO F N 1 +ATOM 30735 C CA . PRO F 1 285 ? -22.830 -12.743 45.431 1.00 33.69 ? 285 PRO F CA 1 +ATOM 30736 C C . PRO F 1 285 ? -22.754 -12.219 46.868 1.00 33.61 ? 285 PRO F C 1 +ATOM 30737 O O . PRO F 1 285 ? -23.784 -12.090 47.536 1.00 33.56 ? 285 PRO F O 1 +ATOM 30738 C CB . PRO F 1 285 ? -23.470 -14.128 45.351 1.00 33.72 ? 285 PRO F CB 1 +ATOM 30739 C CG . PRO F 1 285 ? -22.273 -15.044 45.390 1.00 33.63 ? 285 PRO F CG 1 +ATOM 30740 C CD . PRO F 1 285 ? -21.275 -14.359 44.493 1.00 30.90 ? 285 PRO F CD 1 +ATOM 30741 N N . GLY F 1 286 ? -21.543 -11.904 47.331 1.00 32.79 ? 286 GLY F N 1 +ATOM 30742 C CA . GLY F 1 286 ? -21.362 -11.413 48.690 1.00 31.86 ? 286 GLY F CA 1 +ATOM 30743 C C . GLY F 1 286 ? -20.897 -12.534 49.607 1.00 31.74 ? 286 GLY F C 1 +ATOM 30744 O O . GLY F 1 286 ? -20.005 -13.298 49.245 1.00 33.93 ? 286 GLY F O 1 +ATOM 30745 N N . THR F 1 287 ? -21.483 -12.638 50.794 1.00 31.38 ? 287 THR F N 1 +ATOM 30746 C CA . THR F 1 287 ? -21.118 -13.701 51.729 1.00 30.82 ? 287 THR F CA 1 +ATOM 30747 C C . THR F 1 287 ? -21.465 -15.019 51.040 1.00 30.86 ? 287 THR F C 1 +ATOM 30748 O O . THR F 1 287 ? -22.589 -15.204 50.573 1.00 29.96 ? 287 THR F O 1 +ATOM 30749 C CB . THR F 1 287 ? -21.915 -13.569 53.036 1.00 30.88 ? 287 THR F CB 1 +ATOM 30750 O OG1 . THR F 1 287 ? -21.666 -12.277 53.607 1.00 31.51 ? 287 THR F OG1 1 +ATOM 30751 C CG2 . THR F 1 287 ? -21.505 -14.647 54.031 1.00 28.78 ? 287 THR F CG2 1 +ATOM 30752 N N . THR F 1 288 ? -20.505 -15.932 50.970 1.00 30.68 ? 288 THR F N 1 +ATOM 30753 C CA . THR F 1 288 ? -20.735 -17.190 50.274 1.00 31.33 ? 288 THR F CA 1 +ATOM 30754 C C . THR F 1 288 ? -20.081 -18.412 50.903 1.00 30.39 ? 288 THR F C 1 +ATOM 30755 O O . THR F 1 288 ? -19.151 -18.289 51.695 1.00 31.06 ? 288 THR F O 1 +ATOM 30756 C CB . THR F 1 288 ? -20.197 -17.105 48.831 1.00 32.77 ? 288 THR F CB 1 +ATOM 30757 O OG1 . THR F 1 288 ? -18.773 -16.959 48.865 1.00 33.49 ? 288 THR F OG1 1 +ATOM 30758 C CG2 . THR F 1 288 ? -20.779 -15.912 48.104 1.00 31.55 ? 288 THR F CG2 1 +ATOM 30759 N N . VAL F 1 289 ? -20.590 -19.591 50.546 1.00 29.94 ? 289 VAL F N 1 +ATOM 30760 C CA . VAL F 1 289 ? -20.020 -20.857 51.005 1.00 28.48 ? 289 VAL F CA 1 +ATOM 30761 C C . VAL F 1 289 ? -19.649 -21.561 49.710 1.00 28.51 ? 289 VAL F C 1 +ATOM 30762 O O . VAL F 1 289 ? -20.081 -21.143 48.634 1.00 28.47 ? 289 VAL F O 1 +ATOM 30763 C CB . VAL F 1 289 ? -21.019 -21.723 51.835 1.00 28.22 ? 289 VAL F CB 1 +ATOM 30764 C CG1 . VAL F 1 289 ? -21.166 -21.134 53.237 1.00 26.13 ? 289 VAL F CG1 1 +ATOM 30765 C CG2 . VAL F 1 289 ? -22.374 -21.807 51.137 1.00 25.87 ? 289 VAL F CG2 1 +ATOM 30766 N N . TYR F 1 290 ? -18.844 -22.608 49.791 1.00 28.07 ? 290 TYR F N 1 +ATOM 30767 C CA . TYR F 1 290 ? -18.426 -23.294 48.582 1.00 29.14 ? 290 TYR F CA 1 +ATOM 30768 C C . TYR F 1 290 ? -18.661 -24.795 48.645 1.00 31.71 ? 290 TYR F C 1 +ATOM 30769 O O . TYR F 1 290 ? -18.492 -25.421 49.696 1.00 33.54 ? 290 TYR F O 1 +ATOM 30770 C CB . TYR F 1 290 ? -16.946 -23.023 48.312 1.00 28.20 ? 290 TYR F CB 1 +ATOM 30771 C CG . TYR F 1 290 ? -16.593 -21.553 48.260 1.00 29.51 ? 290 TYR F CG 1 +ATOM 30772 C CD1 . TYR F 1 290 ? -16.291 -20.843 49.422 1.00 28.81 ? 290 TYR F CD1 1 +ATOM 30773 C CD2 . TYR F 1 290 ? -16.591 -20.862 47.047 1.00 29.85 ? 290 TYR F CD2 1 +ATOM 30774 C CE1 . TYR F 1 290 ? -15.996 -19.484 49.381 1.00 29.84 ? 290 TYR F CE1 1 +ATOM 30775 C CE2 . TYR F 1 290 ? -16.299 -19.500 46.991 1.00 30.75 ? 290 TYR F CE2 1 +ATOM 30776 C CZ . TYR F 1 290 ? -16.000 -18.815 48.163 1.00 31.99 ? 290 TYR F CZ 1 +ATOM 30777 O OH . TYR F 1 290 ? -15.704 -17.468 48.102 1.00 32.89 ? 290 TYR F OH 1 +ATOM 30778 N N . PRO F 1 291 ? -19.059 -25.396 47.514 1.00 32.39 ? 291 PRO F N 1 +ATOM 30779 C CA . PRO F 1 291 ? -19.309 -26.839 47.468 1.00 31.50 ? 291 PRO F CA 1 +ATOM 30780 C C . PRO F 1 291 ? -17.996 -27.587 47.633 1.00 31.96 ? 291 PRO F C 1 +ATOM 30781 O O . PRO F 1 291 ? -16.975 -27.191 47.056 1.00 31.14 ? 291 PRO F O 1 +ATOM 30782 C CB . PRO F 1 291 ? -19.883 -27.051 46.069 1.00 30.64 ? 291 PRO F CB 1 +ATOM 30783 C CG . PRO F 1 291 ? -20.436 -25.693 45.689 1.00 31.23 ? 291 PRO F CG 1 +ATOM 30784 C CD . PRO F 1 291 ? -19.392 -24.760 46.226 1.00 31.64 ? 291 PRO F CD 1 +ATOM 30785 N N . ASP F 1 292 ? -18.010 -28.651 48.430 1.00 32.74 ? 292 ASP F N 1 +ATOM 30786 C CA . ASP F 1 292 ? -16.809 -29.463 48.599 1.00 33.58 ? 292 ASP F CA 1 +ATOM 30787 C C . ASP F 1 292 ? -16.854 -30.528 47.495 1.00 33.46 ? 292 ASP F C 1 +ATOM 30788 O O . ASP F 1 292 ? -17.257 -31.668 47.731 1.00 32.62 ? 292 ASP F O 1 +ATOM 30789 C CB . ASP F 1 292 ? -16.783 -30.134 49.972 1.00 33.84 ? 292 ASP F CB 1 +ATOM 30790 C CG . ASP F 1 292 ? -15.519 -30.965 50.188 1.00 38.19 ? 292 ASP F CG 1 +ATOM 30791 O OD1 . ASP F 1 292 ? -14.663 -30.998 49.270 1.00 39.10 ? 292 ASP F OD1 1 +ATOM 30792 O OD2 . ASP F 1 292 ? -15.376 -31.587 51.273 1.00 38.61 ? 292 ASP F OD2 1 +ATOM 30793 N N . PHE F 1 293 ? -16.443 -30.138 46.291 1.00 32.91 ? 293 PHE F N 1 +ATOM 30794 C CA . PHE F 1 293 ? -16.455 -31.027 45.135 1.00 34.14 ? 293 PHE F CA 1 +ATOM 30795 C C . PHE F 1 293 ? -15.643 -32.316 45.266 1.00 34.13 ? 293 PHE F C 1 +ATOM 30796 O O . PHE F 1 293 ? -15.745 -33.189 44.415 1.00 34.69 ? 293 PHE F O 1 +ATOM 30797 C CB . PHE F 1 293 ? -15.994 -30.268 43.889 1.00 33.69 ? 293 PHE F CB 1 +ATOM 30798 C CG . PHE F 1 293 ? -16.948 -29.207 43.439 1.00 33.87 ? 293 PHE F CG 1 +ATOM 30799 C CD1 . PHE F 1 293 ? -18.223 -29.547 42.990 1.00 33.30 ? 293 PHE F CD1 1 +ATOM 30800 C CD2 . PHE F 1 293 ? -16.578 -27.859 43.470 1.00 34.23 ? 293 PHE F CD2 1 +ATOM 30801 C CE1 . PHE F 1 293 ? -19.125 -28.558 42.573 1.00 33.51 ? 293 PHE F CE1 1 +ATOM 30802 C CE2 . PHE F 1 293 ? -17.466 -26.858 43.060 1.00 33.54 ? 293 PHE F CE2 1 +ATOM 30803 C CZ . PHE F 1 293 ? -18.748 -27.210 42.607 1.00 35.28 ? 293 PHE F CZ 1 +ATOM 30804 N N . PHE F 1 294 ? -14.831 -32.434 46.310 1.00 34.35 ? 294 PHE F N 1 +ATOM 30805 C CA . PHE F 1 294 ? -14.049 -33.643 46.505 1.00 34.65 ? 294 PHE F CA 1 +ATOM 30806 C C . PHE F 1 294 ? -14.958 -34.789 46.951 1.00 35.78 ? 294 PHE F C 1 +ATOM 30807 O O . PHE F 1 294 ? -14.588 -35.952 46.848 1.00 37.15 ? 294 PHE F O 1 +ATOM 30808 C CB . PHE F 1 294 ? -12.958 -33.404 47.548 1.00 34.73 ? 294 PHE F CB 1 +ATOM 30809 C CG . PHE F 1 294 ? -11.871 -32.497 47.075 1.00 35.39 ? 294 PHE F CG 1 +ATOM 30810 C CD1 . PHE F 1 294 ? -10.911 -32.950 46.182 1.00 35.30 ? 294 PHE F CD1 1 +ATOM 30811 C CD2 . PHE F 1 294 ? -11.820 -31.177 47.498 1.00 35.89 ? 294 PHE F CD2 1 +ATOM 30812 C CE1 . PHE F 1 294 ? -9.920 -32.104 45.721 1.00 35.17 ? 294 PHE F CE1 1 +ATOM 30813 C CE2 . PHE F 1 294 ? -10.833 -30.323 47.043 1.00 34.22 ? 294 PHE F CE2 1 +ATOM 30814 C CZ . PHE F 1 294 ? -9.880 -30.787 46.153 1.00 35.56 ? 294 PHE F CZ 1 +ATOM 30815 N N . ARG F 1 295 ? -16.146 -34.453 47.442 1.00 36.35 ? 295 ARG F N 1 +ATOM 30816 C CA . ARG F 1 295 ? -17.103 -35.451 47.899 1.00 38.21 ? 295 ARG F CA 1 +ATOM 30817 C C . ARG F 1 295 ? -18.052 -35.917 46.800 1.00 39.69 ? 295 ARG F C 1 +ATOM 30818 O O . ARG F 1 295 ? -18.465 -35.133 45.949 1.00 39.41 ? 295 ARG F O 1 +ATOM 30819 C CB . ARG F 1 295 ? -17.930 -34.881 49.038 1.00 38.06 ? 295 ARG F CB 1 +ATOM 30820 C CG . ARG F 1 295 ? -17.107 -34.494 50.230 1.00 41.09 ? 295 ARG F CG 1 +ATOM 30821 C CD . ARG F 1 295 ? -17.919 -33.659 51.189 1.00 43.19 ? 295 ARG F CD 1 +ATOM 30822 N NE . ARG F 1 295 ? -19.152 -34.325 51.590 1.00 45.58 ? 295 ARG F NE 1 +ATOM 30823 C CZ . ARG F 1 295 ? -19.977 -33.858 52.520 1.00 47.87 ? 295 ARG F CZ 1 +ATOM 30824 N NH1 . ARG F 1 295 ? -19.696 -32.719 53.148 1.00 49.91 ? 295 ARG F NH1 1 +ATOM 30825 N NH2 . ARG F 1 295 ? -21.084 -34.526 52.817 1.00 48.04 ? 295 ARG F NH2 1 +ATOM 30826 N N . GLU F 1 296 ? -18.428 -37.191 46.860 1.00 40.55 ? 296 GLU F N 1 +ATOM 30827 C CA . GLU F 1 296 ? -19.340 -37.775 45.893 1.00 41.71 ? 296 GLU F CA 1 +ATOM 30828 C C . GLU F 1 296 ? -20.736 -37.137 45.973 1.00 39.01 ? 296 GLU F C 1 +ATOM 30829 O O . GLU F 1 296 ? -21.322 -36.804 44.943 1.00 37.06 ? 296 GLU F O 1 +ATOM 30830 C CB . GLU F 1 296 ? -19.437 -39.308 46.105 1.00 46.46 ? 296 GLU F CB 1 +ATOM 30831 C CG . GLU F 1 296 ? -18.165 -40.099 45.713 1.00 57.23 ? 296 GLU F CG 1 +ATOM 30832 C CD . GLU F 1 296 ? -18.259 -41.628 45.982 1.00 63.37 ? 296 GLU F CD 1 +ATOM 30833 O OE1 . GLU F 1 296 ? -19.110 -42.320 45.366 1.00 66.62 ? 296 GLU F OE1 1 +ATOM 30834 O OE2 . GLU F 1 296 ? -17.470 -42.143 46.812 1.00 64.89 ? 296 GLU F OE2 1 +ATOM 30835 N N . ASP F 1 297 ? -21.271 -36.959 47.179 1.00 37.14 ? 297 ASP F N 1 +ATOM 30836 C CA . ASP F 1 297 ? -22.604 -36.376 47.306 1.00 38.97 ? 297 ASP F CA 1 +ATOM 30837 C C . ASP F 1 297 ? -22.697 -34.934 46.791 1.00 38.71 ? 297 ASP F C 1 +ATOM 30838 O O . ASP F 1 297 ? -23.723 -34.533 46.239 1.00 38.78 ? 297 ASP F O 1 +ATOM 30839 C CB . ASP F 1 297 ? -23.114 -36.469 48.757 1.00 40.56 ? 297 ASP F CB 1 +ATOM 30840 C CG . ASP F 1 297 ? -22.238 -35.719 49.752 1.00 43.55 ? 297 ASP F CG 1 +ATOM 30841 O OD1 . ASP F 1 297 ? -21.082 -35.387 49.418 1.00 47.41 ? 297 ASP F OD1 1 +ATOM 30842 O OD2 . ASP F 1 297 ? -22.702 -35.475 50.887 1.00 43.44 ? 297 ASP F OD2 1 +ATOM 30843 N N . THR F 1 298 ? -21.626 -34.164 46.968 1.00 37.25 ? 298 THR F N 1 +ATOM 30844 C CA . THR F 1 298 ? -21.586 -32.785 46.501 1.00 34.37 ? 298 THR F CA 1 +ATOM 30845 C C . THR F 1 298 ? -21.625 -32.822 44.985 1.00 34.12 ? 298 THR F C 1 +ATOM 30846 O O . THR F 1 298 ? -22.404 -32.117 44.342 1.00 33.30 ? 298 THR F O 1 +ATOM 30847 C CB . THR F 1 298 ? -20.283 -32.079 46.937 1.00 31.73 ? 298 THR F CB 1 +ATOM 30848 O OG1 . THR F 1 298 ? -20.264 -31.963 48.360 1.00 30.28 ? 298 THR F OG1 1 +ATOM 30849 C CG2 . THR F 1 298 ? -20.180 -30.695 46.321 1.00 27.72 ? 298 THR F CG2 1 +ATOM 30850 N N . ARG F 1 299 ? -20.768 -33.657 44.419 1.00 33.41 ? 299 ARG F N 1 +ATOM 30851 C CA . ARG F 1 299 ? -20.694 -33.799 42.978 1.00 33.55 ? 299 ARG F CA 1 +ATOM 30852 C C . ARG F 1 299 ? -22.049 -34.210 42.391 1.00 33.75 ? 299 ARG F C 1 +ATOM 30853 O O . ARG F 1 299 ? -22.476 -33.688 41.371 1.00 33.01 ? 299 ARG F O 1 +ATOM 30854 C CB . ARG F 1 299 ? -19.597 -34.803 42.638 1.00 32.16 ? 299 ARG F CB 1 +ATOM 30855 C CG . ARG F 1 299 ? -18.443 -34.181 41.888 1.00 32.13 ? 299 ARG F CG 1 +ATOM 30856 C CD . ARG F 1 299 ? -17.124 -34.652 42.378 1.00 32.91 ? 299 ARG F CD 1 +ATOM 30857 N NE . ARG F 1 299 ? -16.991 -36.106 42.388 1.00 35.22 ? 299 ARG F NE 1 +ATOM 30858 C CZ . ARG F 1 299 ? -16.328 -36.764 43.336 1.00 35.85 ? 299 ARG F CZ 1 +ATOM 30859 N NH1 . ARG F 1 299 ? -15.760 -36.096 44.332 1.00 32.54 ? 299 ARG F NH1 1 +ATOM 30860 N NH2 . ARG F 1 299 ? -16.222 -38.081 43.294 1.00 38.09 ? 299 ARG F NH2 1 +ATOM 30861 N N . GLU F 1 300 ? -22.735 -35.126 43.057 1.00 35.72 ? 300 GLU F N 1 +ATOM 30862 C CA . GLU F 1 300 ? -24.042 -35.577 42.597 1.00 38.13 ? 300 GLU F CA 1 +ATOM 30863 C C . GLU F 1 300 ? -25.064 -34.442 42.668 1.00 36.07 ? 300 GLU F C 1 +ATOM 30864 O O . GLU F 1 300 ? -25.865 -34.251 41.751 1.00 36.13 ? 300 GLU F O 1 +ATOM 30865 C CB . GLU F 1 300 ? -24.512 -36.772 43.441 1.00 41.54 ? 300 GLU F CB 1 +ATOM 30866 C CG . GLU F 1 300 ? -26.020 -36.911 43.516 1.00 49.94 ? 300 GLU F CG 1 +ATOM 30867 C CD . GLU F 1 300 ? -26.467 -38.061 44.412 1.00 56.73 ? 300 GLU F CD 1 +ATOM 30868 O OE1 . GLU F 1 300 ? -25.770 -38.334 45.430 1.00 58.26 ? 300 GLU F OE1 1 +ATOM 30869 O OE2 . GLU F 1 300 ? -27.525 -38.676 44.101 1.00 57.00 ? 300 GLU F OE2 1 +ATOM 30870 N N . TRP F 1 301 ? -25.041 -33.710 43.778 1.00 34.55 ? 301 TRP F N 1 +ATOM 30871 C CA . TRP F 1 301 ? -25.932 -32.575 44.009 1.00 31.94 ? 301 TRP F CA 1 +ATOM 30872 C C . TRP F 1 301 ? -25.707 -31.513 42.926 1.00 32.64 ? 301 TRP F C 1 +ATOM 30873 O O . TRP F 1 301 ? -26.654 -30.980 42.345 1.00 32.25 ? 301 TRP F O 1 +ATOM 30874 C CB . TRP F 1 301 ? -25.639 -31.987 45.388 1.00 31.22 ? 301 TRP F CB 1 +ATOM 30875 C CG . TRP F 1 301 ? -26.209 -30.622 45.625 1.00 33.03 ? 301 TRP F CG 1 +ATOM 30876 C CD1 . TRP F 1 301 ? -27.512 -30.303 45.902 1.00 33.43 ? 301 TRP F CD1 1 +ATOM 30877 C CD2 . TRP F 1 301 ? -25.490 -29.381 45.613 1.00 32.42 ? 301 TRP F CD2 1 +ATOM 30878 N NE1 . TRP F 1 301 ? -27.646 -28.941 46.068 1.00 32.92 ? 301 TRP F NE1 1 +ATOM 30879 C CE2 . TRP F 1 301 ? -26.419 -28.354 45.895 1.00 33.50 ? 301 TRP F CE2 1 +ATOM 30880 C CE3 . TRP F 1 301 ? -24.150 -29.039 45.393 1.00 31.28 ? 301 TRP F CE3 1 +ATOM 30881 C CZ2 . TRP F 1 301 ? -26.046 -27.007 45.964 1.00 34.13 ? 301 TRP F CZ2 1 +ATOM 30882 C CZ3 . TRP F 1 301 ? -23.783 -27.701 45.459 1.00 33.69 ? 301 TRP F CZ3 1 +ATOM 30883 C CH2 . TRP F 1 301 ? -24.729 -26.701 45.743 1.00 32.68 ? 301 TRP F CH2 1 +ATOM 30884 N N . TRP F 1 302 ? -24.440 -31.220 42.653 1.00 32.54 ? 302 TRP F N 1 +ATOM 30885 C CA . TRP F 1 302 ? -24.076 -30.231 41.648 1.00 31.99 ? 302 TRP F CA 1 +ATOM 30886 C C . TRP F 1 302 ? -24.533 -30.670 40.259 1.00 32.61 ? 302 TRP F C 1 +ATOM 30887 O O . TRP F 1 302 ? -25.080 -29.866 39.493 1.00 33.59 ? 302 TRP F O 1 +ATOM 30888 C CB . TRP F 1 302 ? -22.564 -30.014 41.660 1.00 30.07 ? 302 TRP F CB 1 +ATOM 30889 C CG . TRP F 1 302 ? -22.076 -28.992 40.688 1.00 29.98 ? 302 TRP F CG 1 +ATOM 30890 C CD1 . TRP F 1 302 ? -21.511 -29.223 39.467 1.00 30.08 ? 302 TRP F CD1 1 +ATOM 30891 C CD2 . TRP F 1 302 ? -22.067 -27.571 40.871 1.00 30.25 ? 302 TRP F CD2 1 +ATOM 30892 N NE1 . TRP F 1 302 ? -21.144 -28.037 38.878 1.00 29.17 ? 302 TRP F NE1 1 +ATOM 30893 C CE2 . TRP F 1 302 ? -21.476 -27.005 39.718 1.00 31.10 ? 302 TRP F CE2 1 +ATOM 30894 C CE3 . TRP F 1 302 ? -22.500 -26.720 41.897 1.00 29.87 ? 302 TRP F CE3 1 +ATOM 30895 C CZ2 . TRP F 1 302 ? -21.305 -25.615 39.562 1.00 31.10 ? 302 TRP F CZ2 1 +ATOM 30896 C CZ3 . TRP F 1 302 ? -22.332 -25.338 41.744 1.00 31.26 ? 302 TRP F CZ3 1 +ATOM 30897 C CH2 . TRP F 1 302 ? -21.738 -24.802 40.582 1.00 29.72 ? 302 TRP F CH2 1 +ATOM 30898 N N . ALA F 1 303 ? -24.303 -31.939 39.935 1.00 31.43 ? 303 ALA F N 1 +ATOM 30899 C CA . ALA F 1 303 ? -24.704 -32.480 38.642 1.00 31.04 ? 303 ALA F CA 1 +ATOM 30900 C C . ALA F 1 303 ? -26.204 -32.253 38.463 1.00 30.73 ? 303 ALA F C 1 +ATOM 30901 O O . ALA F 1 303 ? -26.672 -31.942 37.372 1.00 28.97 ? 303 ALA F O 1 +ATOM 30902 C CB . ALA F 1 303 ? -24.382 -33.966 38.576 1.00 28.70 ? 303 ALA F CB 1 +ATOM 30903 N N . GLY F 1 304 ? -26.950 -32.399 39.549 1.00 31.21 ? 304 GLY F N 1 +ATOM 30904 C CA . GLY F 1 304 ? -28.383 -32.198 39.488 1.00 31.62 ? 304 GLY F CA 1 +ATOM 30905 C C . GLY F 1 304 ? -28.752 -30.775 39.122 1.00 32.43 ? 304 GLY F C 1 +ATOM 30906 O O . GLY F 1 304 ? -29.605 -30.552 38.262 1.00 33.28 ? 304 GLY F O 1 +ATOM 30907 N N . LEU F 1 305 ? -28.116 -29.804 39.768 1.00 32.46 ? 305 LEU F N 1 +ATOM 30908 C CA . LEU F 1 305 ? -28.401 -28.399 39.480 1.00 31.96 ? 305 LEU F CA 1 +ATOM 30909 C C . LEU F 1 305 ? -28.012 -28.067 38.046 1.00 31.35 ? 305 LEU F C 1 +ATOM 30910 O O . LEU F 1 305 ? -28.744 -27.370 37.336 1.00 30.97 ? 305 LEU F O 1 +ATOM 30911 C CB . LEU F 1 305 ? -27.643 -27.485 40.449 1.00 30.75 ? 305 LEU F CB 1 +ATOM 30912 C CG . LEU F 1 305 ? -28.008 -27.608 41.928 1.00 30.26 ? 305 LEU F CG 1 +ATOM 30913 C CD1 . LEU F 1 305 ? -27.061 -26.751 42.736 1.00 30.09 ? 305 LEU F CD1 1 +ATOM 30914 C CD2 . LEU F 1 305 ? -29.437 -27.190 42.160 1.00 27.71 ? 305 LEU F CD2 1 +ATOM 30915 N N . ILE F 1 306 ? -26.855 -28.566 37.625 1.00 29.84 ? 306 ILE F N 1 +ATOM 30916 C CA . ILE F 1 306 ? -26.390 -28.335 36.265 1.00 30.75 ? 306 ILE F CA 1 +ATOM 30917 C C . ILE F 1 306 ? -27.386 -28.908 35.267 1.00 31.65 ? 306 ILE F C 1 +ATOM 30918 O O . ILE F 1 306 ? -27.799 -28.234 34.339 1.00 32.09 ? 306 ILE F O 1 +ATOM 30919 C CB . ILE F 1 306 ? -25.019 -28.995 36.015 1.00 28.44 ? 306 ILE F CB 1 +ATOM 30920 C CG1 . ILE F 1 306 ? -23.926 -28.238 36.774 1.00 31.26 ? 306 ILE F CG1 1 +ATOM 30921 C CG2 . ILE F 1 306 ? -24.712 -29.022 34.524 1.00 27.51 ? 306 ILE F CG2 1 +ATOM 30922 C CD1 . ILE F 1 306 ? -23.714 -26.795 36.306 1.00 28.09 ? 306 ILE F CD1 1 +ATOM 30923 N N . SER F 1 307 ? -27.757 -30.165 35.468 1.00 34.57 ? 307 SER F N 1 +ATOM 30924 C CA . SER F 1 307 ? -28.699 -30.857 34.599 1.00 36.75 ? 307 SER F CA 1 +ATOM 30925 C C . SER F 1 307 ? -29.991 -30.047 34.476 1.00 36.68 ? 307 SER F C 1 +ATOM 30926 O O . SER F 1 307 ? -30.486 -29.792 33.382 1.00 35.54 ? 307 SER F O 1 +ATOM 30927 C CB . SER F 1 307 ? -28.993 -32.245 35.169 1.00 36.92 ? 307 SER F CB 1 +ATOM 30928 O OG . SER F 1 307 ? -29.718 -33.038 34.249 1.00 39.48 ? 307 SER F OG 1 +ATOM 30929 N N . GLU F 1 308 ? -30.515 -29.622 35.614 1.00 37.14 ? 308 GLU F N 1 +ATOM 30930 C CA . GLU F 1 308 ? -31.732 -28.832 35.643 1.00 39.16 ? 308 GLU F CA 1 +ATOM 30931 C C . GLU F 1 308 ? -31.529 -27.528 34.867 1.00 39.01 ? 308 GLU F C 1 +ATOM 30932 O O . GLU F 1 308 ? -32.426 -27.062 34.164 1.00 41.08 ? 308 GLU F O 1 +ATOM 30933 C CB . GLU F 1 308 ? -32.088 -28.531 37.090 1.00 41.74 ? 308 GLU F CB 1 +ATOM 30934 C CG . GLU F 1 308 ? -33.448 -27.919 37.317 1.00 49.38 ? 308 GLU F CG 1 +ATOM 30935 C CD . GLU F 1 308 ? -33.600 -27.424 38.757 1.00 55.92 ? 308 GLU F CD 1 +ATOM 30936 O OE1 . GLU F 1 308 ? -33.310 -28.208 39.701 1.00 56.63 ? 308 GLU F OE1 1 +ATOM 30937 O OE2 . GLU F 1 308 ? -34.001 -26.248 38.946 1.00 59.60 ? 308 GLU F OE2 1 +ATOM 30938 N N . TRP F 1 309 ? -30.341 -26.943 34.991 1.00 36.54 ? 309 TRP F N 1 +ATOM 30939 C CA . TRP F 1 309 ? -30.020 -25.697 34.305 1.00 33.15 ? 309 TRP F CA 1 +ATOM 30940 C C . TRP F 1 309 ? -29.924 -25.900 32.789 1.00 32.73 ? 309 TRP F C 1 +ATOM 30941 O O . TRP F 1 309 ? -30.370 -25.060 32.003 1.00 32.01 ? 309 TRP F O 1 +ATOM 30942 C CB . TRP F 1 309 ? -28.704 -25.137 34.856 1.00 31.50 ? 309 TRP F CB 1 +ATOM 30943 C CG . TRP F 1 309 ? -28.336 -23.788 34.334 1.00 27.59 ? 309 TRP F CG 1 +ATOM 30944 C CD1 . TRP F 1 309 ? -27.315 -23.492 33.481 1.00 26.91 ? 309 TRP F CD1 1 +ATOM 30945 C CD2 . TRP F 1 309 ? -29.007 -22.553 34.601 1.00 27.01 ? 309 TRP F CD2 1 +ATOM 30946 N NE1 . TRP F 1 309 ? -27.308 -22.146 33.195 1.00 26.14 ? 309 TRP F NE1 1 +ATOM 30947 C CE2 . TRP F 1 309 ? -28.336 -21.546 33.872 1.00 27.10 ? 309 TRP F CE2 1 +ATOM 30948 C CE3 . TRP F 1 309 ? -30.111 -22.197 35.384 1.00 28.08 ? 309 TRP F CE3 1 +ATOM 30949 C CZ2 . TRP F 1 309 ? -28.735 -20.200 33.903 1.00 27.14 ? 309 TRP F CZ2 1 +ATOM 30950 C CZ3 . TRP F 1 309 ? -30.510 -20.851 35.414 1.00 28.41 ? 309 TRP F CZ3 1 +ATOM 30951 C CH2 . TRP F 1 309 ? -29.819 -19.875 34.676 1.00 26.02 ? 309 TRP F CH2 1 +ATOM 30952 N N . LEU F 1 310 ? -29.347 -27.023 32.378 1.00 32.36 ? 310 LEU F N 1 +ATOM 30953 C CA . LEU F 1 310 ? -29.207 -27.339 30.965 1.00 32.02 ? 310 LEU F CA 1 +ATOM 30954 C C . LEU F 1 310 ? -30.553 -27.628 30.297 1.00 33.91 ? 310 LEU F C 1 +ATOM 30955 O O . LEU F 1 310 ? -30.721 -27.403 29.098 1.00 34.54 ? 310 LEU F O 1 +ATOM 30956 C CB . LEU F 1 310 ? -28.299 -28.555 30.781 1.00 30.50 ? 310 LEU F CB 1 +ATOM 30957 C CG . LEU F 1 310 ? -26.801 -28.385 31.028 1.00 32.17 ? 310 LEU F CG 1 +ATOM 30958 C CD1 . LEU F 1 310 ? -26.083 -29.728 30.873 1.00 30.59 ? 310 LEU F CD1 1 +ATOM 30959 C CD2 . LEU F 1 310 ? -26.243 -27.368 30.044 1.00 30.95 ? 310 LEU F CD2 1 +ATOM 30960 N N . SER F 1 311 ? -31.512 -28.111 31.075 1.00 33.84 ? 311 SER F N 1 +ATOM 30961 C CA . SER F 1 311 ? -32.810 -28.467 30.535 1.00 36.60 ? 311 SER F CA 1 +ATOM 30962 C C . SER F 1 311 ? -33.620 -27.309 29.974 1.00 37.87 ? 311 SER F C 1 +ATOM 30963 O O . SER F 1 311 ? -34.586 -27.537 29.263 1.00 39.82 ? 311 SER F O 1 +ATOM 30964 C CB . SER F 1 311 ? -33.640 -29.210 31.587 1.00 36.06 ? 311 SER F CB 1 +ATOM 30965 O OG . SER F 1 311 ? -34.211 -28.301 32.505 1.00 40.50 ? 311 SER F OG 1 +ATOM 30966 N N . GLN F 1 312 ? -33.257 -26.070 30.287 1.00 39.65 ? 312 GLN F N 1 +ATOM 30967 C CA . GLN F 1 312 ? -34.005 -24.937 29.738 1.00 38.81 ? 312 GLN F CA 1 +ATOM 30968 C C . GLN F 1 312 ? -33.569 -24.740 28.294 1.00 38.06 ? 312 GLN F C 1 +ATOM 30969 O O . GLN F 1 312 ? -34.202 -24.004 27.545 1.00 38.31 ? 312 GLN F O 1 +ATOM 30970 C CB . GLN F 1 312 ? -33.701 -23.628 30.459 1.00 39.52 ? 312 GLN F CB 1 +ATOM 30971 C CG . GLN F 1 312 ? -33.131 -23.723 31.842 1.00 44.88 ? 312 GLN F CG 1 +ATOM 30972 C CD . GLN F 1 312 ? -32.559 -22.384 32.285 1.00 46.65 ? 312 GLN F CD 1 +ATOM 30973 O OE1 . GLN F 1 312 ? -33.276 -21.383 32.349 1.00 46.95 ? 312 GLN F OE1 1 +ATOM 30974 N NE2 . GLN F 1 312 ? -31.262 -22.358 32.579 1.00 45.30 ? 312 GLN F NE2 1 +ATOM 30975 N N . GLY F 1 313 ? -32.466 -25.374 27.918 1.00 35.62 ? 313 GLY F N 1 +ATOM 30976 C CA . GLY F 1 313 ? -31.961 -25.210 26.572 1.00 35.64 ? 313 GLY F CA 1 +ATOM 30977 C C . GLY F 1 313 ? -30.572 -24.586 26.513 1.00 35.20 ? 313 GLY F C 1 +ATOM 30978 O O . GLY F 1 313 ? -30.067 -24.273 25.430 1.00 34.72 ? 313 GLY F O 1 +ATOM 30979 N N . VAL F 1 314 ? -29.954 -24.388 27.675 1.00 33.45 ? 314 VAL F N 1 +ATOM 30980 C CA . VAL F 1 314 ? -28.610 -23.833 27.729 1.00 32.37 ? 314 VAL F CA 1 +ATOM 30981 C C . VAL F 1 314 ? -27.701 -24.898 27.111 1.00 31.63 ? 314 VAL F C 1 +ATOM 30982 O O . VAL F 1 314 ? -27.779 -26.059 27.471 1.00 29.13 ? 314 VAL F O 1 +ATOM 30983 C CB . VAL F 1 314 ? -28.183 -23.553 29.195 1.00 33.86 ? 314 VAL F CB 1 +ATOM 30984 C CG1 . VAL F 1 314 ? -26.695 -23.258 29.260 1.00 32.03 ? 314 VAL F CG1 1 +ATOM 30985 C CG2 . VAL F 1 314 ? -28.983 -22.389 29.753 1.00 32.08 ? 314 VAL F CG2 1 +ATOM 30986 N N . ASP F 1 315 ? -26.827 -24.485 26.204 1.00 32.01 ? 315 ASP F N 1 +ATOM 30987 C CA . ASP F 1 315 ? -25.938 -25.396 25.490 1.00 31.65 ? 315 ASP F CA 1 +ATOM 30988 C C . ASP F 1 315 ? -24.567 -25.677 26.092 1.00 31.37 ? 315 ASP F C 1 +ATOM 30989 O O . ASP F 1 315 ? -23.966 -26.710 25.799 1.00 30.85 ? 315 ASP F O 1 +ATOM 30990 C CB . ASP F 1 315 ? -25.768 -24.880 24.055 1.00 32.47 ? 315 ASP F CB 1 +ATOM 30991 C CG . ASP F 1 315 ? -27.109 -24.689 23.354 1.00 37.36 ? 315 ASP F CG 1 +ATOM 30992 O OD1 . ASP F 1 315 ? -27.756 -25.713 23.052 1.00 41.18 ? 315 ASP F OD1 1 +ATOM 30993 O OD2 . ASP F 1 315 ? -27.539 -23.531 23.128 1.00 36.12 ? 315 ASP F OD2 1 +ATOM 30994 N N . GLY F 1 316 ? -24.061 -24.773 26.925 1.00 30.96 ? 316 GLY F N 1 +ATOM 30995 C CA . GLY F 1 316 ? -22.744 -24.986 27.494 1.00 29.28 ? 316 GLY F CA 1 +ATOM 30996 C C . GLY F 1 316 ? -22.539 -24.323 28.836 1.00 29.71 ? 316 GLY F C 1 +ATOM 30997 O O . GLY F 1 316 ? -23.263 -23.402 29.207 1.00 29.09 ? 316 GLY F O 1 +ATOM 30998 N N . ILE F 1 317 ? -21.537 -24.795 29.567 1.00 29.80 ? 317 ILE F N 1 +ATOM 30999 C CA . ILE F 1 317 ? -21.240 -24.261 30.884 1.00 29.52 ? 317 ILE F CA 1 +ATOM 31000 C C . ILE F 1 317 ? -19.842 -23.668 30.902 1.00 29.93 ? 317 ILE F C 1 +ATOM 31001 O O . ILE F 1 317 ? -18.879 -24.268 30.420 1.00 29.20 ? 317 ILE F O 1 +ATOM 31002 C CB . ILE F 1 317 ? -21.344 -25.359 31.973 1.00 29.90 ? 317 ILE F CB 1 +ATOM 31003 C CG1 . ILE F 1 317 ? -22.752 -25.974 31.965 1.00 28.62 ? 317 ILE F CG1 1 +ATOM 31004 C CG2 . ILE F 1 317 ? -21.044 -24.763 33.352 1.00 28.77 ? 317 ILE F CG2 1 +ATOM 31005 C CD1 . ILE F 1 317 ? -23.862 -25.006 32.347 1.00 27.32 ? 317 ILE F CD1 1 +ATOM 31006 N N . TRP F 1 318 ? -19.743 -22.467 31.454 1.00 29.81 ? 318 TRP F N 1 +ATOM 31007 C CA . TRP F 1 318 ? -18.470 -21.772 31.553 1.00 28.97 ? 318 TRP F CA 1 +ATOM 31008 C C . TRP F 1 318 ? -18.169 -21.628 33.031 1.00 28.29 ? 318 TRP F C 1 +ATOM 31009 O O . TRP F 1 318 ? -18.797 -20.838 33.726 1.00 29.78 ? 318 TRP F O 1 +ATOM 31010 C CB . TRP F 1 318 ? -18.596 -20.418 30.856 1.00 29.73 ? 318 TRP F CB 1 +ATOM 31011 C CG . TRP F 1 318 ? -17.496 -19.436 31.077 1.00 31.01 ? 318 TRP F CG 1 +ATOM 31012 C CD1 . TRP F 1 318 ? -16.224 -19.693 31.508 1.00 31.49 ? 318 TRP F CD1 1 +ATOM 31013 C CD2 . TRP F 1 318 ? -17.558 -18.028 30.829 1.00 31.53 ? 318 TRP F CD2 1 +ATOM 31014 N NE1 . TRP F 1 318 ? -15.491 -18.535 31.544 1.00 30.25 ? 318 TRP F NE1 1 +ATOM 31015 C CE2 . TRP F 1 318 ? -16.284 -17.494 31.132 1.00 32.44 ? 318 TRP F CE2 1 +ATOM 31016 C CE3 . TRP F 1 318 ? -18.569 -17.161 30.379 1.00 32.26 ? 318 TRP F CE3 1 +ATOM 31017 C CZ2 . TRP F 1 318 ? -15.989 -16.125 30.999 1.00 31.97 ? 318 TRP F CZ2 1 +ATOM 31018 C CZ3 . TRP F 1 318 ? -18.280 -15.803 30.249 1.00 32.70 ? 318 TRP F CZ3 1 +ATOM 31019 C CH2 . TRP F 1 318 ? -16.995 -15.300 30.559 1.00 33.32 ? 318 TRP F CH2 1 +ATOM 31020 N N . LEU F 1 319 ? -17.228 -22.429 33.511 1.00 28.47 ? 319 LEU F N 1 +ATOM 31021 C CA . LEU F 1 319 ? -16.830 -22.414 34.918 1.00 29.53 ? 319 LEU F CA 1 +ATOM 31022 C C . LEU F 1 319 ? -15.749 -21.360 35.164 1.00 30.84 ? 319 LEU F C 1 +ATOM 31023 O O . LEU F 1 319 ? -14.656 -21.433 34.600 1.00 32.21 ? 319 LEU F O 1 +ATOM 31024 C CB . LEU F 1 319 ? -16.303 -23.795 35.324 1.00 26.85 ? 319 LEU F CB 1 +ATOM 31025 C CG . LEU F 1 319 ? -17.268 -24.972 35.207 1.00 27.20 ? 319 LEU F CG 1 +ATOM 31026 C CD1 . LEU F 1 319 ? -16.550 -26.268 35.582 1.00 24.56 ? 319 LEU F CD1 1 +ATOM 31027 C CD2 . LEU F 1 319 ? -18.470 -24.742 36.107 1.00 24.24 ? 319 LEU F CD2 1 +ATOM 31028 N N . ASP F 1 320 ? -16.046 -20.387 36.016 1.00 32.94 ? 320 ASP F N 1 +ATOM 31029 C CA . ASP F 1 320 ? -15.079 -19.332 36.307 1.00 34.37 ? 320 ASP F CA 1 +ATOM 31030 C C . ASP F 1 320 ? -14.736 -19.206 37.797 1.00 33.68 ? 320 ASP F C 1 +ATOM 31031 O O . ASP F 1 320 ? -15.465 -19.702 38.652 1.00 32.60 ? 320 ASP F O 1 +ATOM 31032 C CB . ASP F 1 320 ? -15.620 -18.004 35.774 1.00 36.83 ? 320 ASP F CB 1 +ATOM 31033 C CG . ASP F 1 320 ? -14.578 -16.903 35.773 1.00 40.18 ? 320 ASP F CG 1 +ATOM 31034 O OD1 . ASP F 1 320 ? -13.385 -17.220 35.562 1.00 42.54 ? 320 ASP F OD1 1 +ATOM 31035 O OD2 . ASP F 1 320 ? -14.949 -15.720 35.966 1.00 41.51 ? 320 ASP F OD2 1 +ATOM 31036 N N . MET F 1 321 ? -13.606 -18.563 38.092 1.00 33.92 ? 321 MET F N 1 +ATOM 31037 C CA . MET F 1 321 ? -13.170 -18.331 39.471 1.00 33.98 ? 321 MET F CA 1 +ATOM 31038 C C . MET F 1 321 ? -12.946 -19.630 40.245 1.00 34.98 ? 321 MET F C 1 +ATOM 31039 O O . MET F 1 321 ? -12.842 -19.617 41.475 1.00 35.40 ? 321 MET F O 1 +ATOM 31040 C CB . MET F 1 321 ? -14.231 -17.511 40.211 1.00 33.62 ? 321 MET F CB 1 +ATOM 31041 C CG . MET F 1 321 ? -14.746 -16.286 39.472 1.00 34.49 ? 321 MET F CG 1 +ATOM 31042 S SD . MET F 1 321 ? -13.445 -15.105 39.030 1.00 38.77 ? 321 MET F SD 1 +ATOM 31043 C CE . MET F 1 321 ? -12.810 -14.648 40.673 1.00 39.83 ? 321 MET F CE 1 +ATOM 31044 N N . ASN F 1 322 ? -12.858 -20.746 39.533 1.00 34.01 ? 322 ASN F N 1 +ATOM 31045 C CA . ASN F 1 322 ? -12.717 -22.039 40.182 1.00 33.20 ? 322 ASN F CA 1 +ATOM 31046 C C . ASN F 1 322 ? -11.306 -22.496 40.554 1.00 33.50 ? 322 ASN F C 1 +ATOM 31047 O O . ASN F 1 322 ? -11.025 -23.694 40.543 1.00 35.28 ? 322 ASN F O 1 +ATOM 31048 C CB . ASN F 1 322 ? -13.410 -23.104 39.317 1.00 32.12 ? 322 ASN F CB 1 +ATOM 31049 C CG . ASN F 1 322 ? -12.775 -23.262 37.945 1.00 32.04 ? 322 ASN F CG 1 +ATOM 31050 O OD1 . ASN F 1 322 ? -12.157 -22.342 37.428 1.00 33.14 ? 322 ASN F OD1 1 +ATOM 31051 N ND2 . ASN F 1 322 ? -12.946 -24.434 37.344 1.00 32.07 ? 322 ASN F ND2 1 +ATOM 31052 N N . GLU F 1 323 ? -10.430 -21.561 40.914 1.00 31.88 ? 323 GLU F N 1 +ATOM 31053 C CA . GLU F 1 323 ? -9.055 -21.914 41.277 1.00 31.66 ? 323 GLU F CA 1 +ATOM 31054 C C . GLU F 1 323 ? -8.891 -22.865 42.462 1.00 30.18 ? 323 GLU F C 1 +ATOM 31055 O O . GLU F 1 323 ? -8.013 -23.723 42.429 1.00 28.97 ? 323 GLU F O 1 +ATOM 31056 C CB . GLU F 1 323 ? -8.217 -20.661 41.539 1.00 33.59 ? 323 GLU F CB 1 +ATOM 31057 C CG . GLU F 1 323 ? -7.822 -19.885 40.285 1.00 35.95 ? 323 GLU F CG 1 +ATOM 31058 C CD . GLU F 1 323 ? -9.023 -19.351 39.516 1.00 39.53 ? 323 GLU F CD 1 +ATOM 31059 O OE1 . GLU F 1 323 ? -9.933 -18.774 40.157 1.00 38.54 ? 323 GLU F OE1 1 +ATOM 31060 O OE2 . GLU F 1 323 ? -9.049 -19.495 38.269 1.00 40.51 ? 323 GLU F OE2 1 +ATOM 31061 N N . PRO F 1 324 ? -9.725 -22.738 43.519 1.00 28.77 ? 324 PRO F N 1 +ATOM 31062 C CA . PRO F 1 324 ? -10.832 -21.801 43.753 1.00 28.95 ? 324 PRO F CA 1 +ATOM 31063 C C . PRO F 1 324 ? -10.398 -20.453 44.350 1.00 30.42 ? 324 PRO F C 1 +ATOM 31064 O O . PRO F 1 324 ? -9.458 -20.371 45.147 1.00 30.60 ? 324 PRO F O 1 +ATOM 31065 C CB . PRO F 1 324 ? -11.735 -22.582 44.703 1.00 27.03 ? 324 PRO F CB 1 +ATOM 31066 C CG . PRO F 1 324 ? -10.743 -23.247 45.583 1.00 26.45 ? 324 PRO F CG 1 +ATOM 31067 C CD . PRO F 1 324 ? -9.651 -23.719 44.617 1.00 27.16 ? 324 PRO F CD 1 +ATOM 31068 N N . THR F 1 325 ? -11.117 -19.404 43.977 1.00 30.35 ? 325 THR F N 1 +ATOM 31069 C CA . THR F 1 325 ? -10.824 -18.065 44.451 1.00 30.92 ? 325 THR F CA 1 +ATOM 31070 C C . THR F 1 325 ? -11.791 -17.589 45.539 1.00 31.74 ? 325 THR F C 1 +ATOM 31071 O O . THR F 1 325 ? -12.964 -17.968 45.560 1.00 31.70 ? 325 THR F O 1 +ATOM 31072 C CB . THR F 1 325 ? -10.851 -17.086 43.267 1.00 30.65 ? 325 THR F CB 1 +ATOM 31073 O OG1 . THR F 1 325 ? -9.768 -17.406 42.384 1.00 31.78 ? 325 THR F OG1 1 +ATOM 31074 C CG2 . THR F 1 325 ? -10.730 -15.645 43.731 1.00 27.50 ? 325 THR F CG2 1 +ATOM 31075 N N . ASP F 1 326 ? -11.271 -16.780 46.459 1.00 31.54 ? 326 ASP F N 1 +ATOM 31076 C CA . ASP F 1 326 ? -12.067 -16.202 47.538 1.00 32.80 ? 326 ASP F CA 1 +ATOM 31077 C C . ASP F 1 326 ? -11.513 -14.810 47.832 1.00 33.07 ? 326 ASP F C 1 +ATOM 31078 O O . ASP F 1 326 ? -10.291 -14.597 47.802 1.00 33.77 ? 326 ASP F O 1 +ATOM 31079 C CB . ASP F 1 326 ? -11.999 -17.063 48.794 1.00 34.52 ? 326 ASP F CB 1 +ATOM 31080 C CG . ASP F 1 326 ? -12.717 -16.426 49.978 1.00 35.35 ? 326 ASP F CG 1 +ATOM 31081 O OD1 . ASP F 1 326 ? -13.955 -16.271 49.925 1.00 35.82 ? 326 ASP F OD1 1 +ATOM 31082 O OD2 . ASP F 1 326 ? -12.037 -16.074 50.962 1.00 35.88 ? 326 ASP F OD2 1 +ATOM 31083 N N . PHE F 1 327 ? -12.399 -13.867 48.131 1.00 33.43 ? 327 PHE F N 1 +ATOM 31084 C CA . PHE F 1 327 ? -11.969 -12.494 48.382 1.00 33.28 ? 327 PHE F CA 1 +ATOM 31085 C C . PHE F 1 327 ? -12.104 -12.003 49.813 1.00 33.81 ? 327 PHE F C 1 +ATOM 31086 O O . PHE F 1 327 ? -11.887 -10.821 50.072 1.00 34.69 ? 327 PHE F O 1 +ATOM 31087 C CB . PHE F 1 327 ? -12.731 -11.548 47.451 1.00 32.50 ? 327 PHE F CB 1 +ATOM 31088 C CG . PHE F 1 327 ? -12.407 -11.739 46.002 1.00 34.44 ? 327 PHE F CG 1 +ATOM 31089 C CD1 . PHE F 1 327 ? -11.131 -11.436 45.515 1.00 35.99 ? 327 PHE F CD1 1 +ATOM 31090 C CD2 . PHE F 1 327 ? -13.363 -12.225 45.118 1.00 34.18 ? 327 PHE F CD2 1 +ATOM 31091 C CE1 . PHE F 1 327 ? -10.816 -11.619 44.165 1.00 36.17 ? 327 PHE F CE1 1 +ATOM 31092 C CE2 . PHE F 1 327 ? -13.061 -12.412 43.773 1.00 34.80 ? 327 PHE F CE2 1 +ATOM 31093 C CZ . PHE F 1 327 ? -11.788 -12.109 43.293 1.00 36.02 ? 327 PHE F CZ 1 +ATOM 31094 N N . SER F 1 328 ? -12.446 -12.885 50.746 1.00 33.77 ? 328 SER F N 1 +ATOM 31095 C CA . SER F 1 328 ? -12.609 -12.439 52.124 1.00 35.89 ? 328 SER F CA 1 +ATOM 31096 C C . SER F 1 328 ? -11.336 -11.849 52.731 1.00 36.47 ? 328 SER F C 1 +ATOM 31097 O O . SER F 1 328 ? -11.406 -10.859 53.463 1.00 36.47 ? 328 SER F O 1 +ATOM 31098 C CB . SER F 1 328 ? -13.152 -13.562 53.012 1.00 33.29 ? 328 SER F CB 1 +ATOM 31099 O OG . SER F 1 328 ? -12.301 -14.682 53.002 1.00 38.15 ? 328 SER F OG 1 +ATOM 31100 N N . ARG F 1 329 ? -10.177 -12.427 52.424 1.00 37.86 ? 329 ARG F N 1 +ATOM 31101 C CA . ARG F 1 329 ? -8.917 -11.899 52.966 1.00 39.28 ? 329 ARG F CA 1 +ATOM 31102 C C . ARG F 1 329 ? -8.610 -10.511 52.388 1.00 39.40 ? 329 ARG F C 1 +ATOM 31103 O O . ARG F 1 329 ? -8.241 -9.592 53.111 1.00 37.55 ? 329 ARG F O 1 +ATOM 31104 C CB . ARG F 1 329 ? -7.748 -12.837 52.649 1.00 40.42 ? 329 ARG F CB 1 +ATOM 31105 C CG . ARG F 1 329 ? -7.154 -13.545 53.855 1.00 43.99 ? 329 ARG F CG 1 +ATOM 31106 C CD . ARG F 1 329 ? -7.533 -15.022 53.910 1.00 44.79 ? 329 ARG F CD 1 +ATOM 31107 N NE . ARG F 1 329 ? -7.126 -15.750 52.704 1.00 48.67 ? 329 ARG F NE 1 +ATOM 31108 C CZ . ARG F 1 329 ? -5.867 -16.017 52.354 1.00 49.12 ? 329 ARG F CZ 1 +ATOM 31109 N NH1 . ARG F 1 329 ? -4.850 -15.622 53.113 1.00 49.08 ? 329 ARG F NH1 1 +ATOM 31110 N NH2 . ARG F 1 329 ? -5.625 -16.681 51.229 1.00 48.96 ? 329 ARG F NH2 1 +ATOM 31111 N N . ALA F 1 330 ? -8.765 -10.365 51.077 1.00 39.91 ? 330 ALA F N 1 +ATOM 31112 C CA . ALA F 1 330 ? -8.502 -9.089 50.431 1.00 40.68 ? 330 ALA F CA 1 +ATOM 31113 C C . ALA F 1 330 ? -9.418 -8.009 50.994 1.00 41.96 ? 330 ALA F C 1 +ATOM 31114 O O . ALA F 1 330 ? -8.966 -6.918 51.331 1.00 42.38 ? 330 ALA F O 1 +ATOM 31115 C CB . ALA F 1 330 ? -8.705 -9.216 48.941 1.00 37.98 ? 330 ALA F CB 1 +ATOM 31116 N N . ILE F 1 331 ? -10.704 -8.326 51.101 1.00 42.01 ? 331 ILE F N 1 +ATOM 31117 C CA . ILE F 1 331 ? -11.688 -7.388 51.610 1.00 42.08 ? 331 ILE F CA 1 +ATOM 31118 C C . ILE F 1 331 ? -11.426 -7.044 53.065 1.00 43.21 ? 331 ILE F C 1 +ATOM 31119 O O . ILE F 1 331 ? -11.642 -5.921 53.500 1.00 42.82 ? 331 ILE F O 1 +ATOM 31120 C CB . ILE F 1 331 ? -13.108 -7.968 51.425 1.00 42.16 ? 331 ILE F CB 1 +ATOM 31121 C CG1 . ILE F 1 331 ? -13.498 -7.844 49.951 1.00 41.45 ? 331 ILE F CG1 1 +ATOM 31122 C CG2 . ILE F 1 331 ? -14.114 -7.268 52.332 1.00 38.40 ? 331 ILE F CG2 1 +ATOM 31123 C CD1 . ILE F 1 331 ? -14.806 -8.505 49.605 1.00 44.23 ? 331 ILE F CD1 1 +ATOM 31124 N N . GLU F 1 332 ? -10.944 -8.016 53.817 1.00 45.72 ? 332 GLU F N 1 +ATOM 31125 C CA . GLU F 1 332 ? -10.644 -7.804 55.231 1.00 48.94 ? 332 GLU F CA 1 +ATOM 31126 C C . GLU F 1 332 ? -9.554 -6.729 55.353 1.00 48.63 ? 332 GLU F C 1 +ATOM 31127 O O . GLU F 1 332 ? -9.639 -5.825 56.182 1.00 48.20 ? 332 GLU F O 1 +ATOM 31128 C CB . GLU F 1 332 ? -10.186 -9.133 55.835 1.00 51.20 ? 332 GLU F CB 1 +ATOM 31129 C CG . GLU F 1 332 ? -9.971 -9.157 57.322 1.00 56.79 ? 332 GLU F CG 1 +ATOM 31130 C CD . GLU F 1 332 ? -9.807 -10.580 57.848 1.00 61.24 ? 332 GLU F CD 1 +ATOM 31131 O OE1 . GLU F 1 332 ? -8.946 -11.318 57.317 1.00 62.73 ? 332 GLU F OE1 1 +ATOM 31132 O OE2 . GLU F 1 332 ? -10.534 -10.968 58.793 1.00 64.57 ? 332 GLU F OE2 1 +ATOM 31133 N N . ILE F 1 333 ? -8.537 -6.837 54.507 1.00 48.28 ? 333 ILE F N 1 +ATOM 31134 C CA . ILE F 1 333 ? -7.433 -5.891 54.488 1.00 49.00 ? 333 ILE F CA 1 +ATOM 31135 C C . ILE F 1 333 ? -7.917 -4.506 54.061 1.00 51.14 ? 333 ILE F C 1 +ATOM 31136 O O . ILE F 1 333 ? -7.554 -3.491 54.660 1.00 50.47 ? 333 ILE F O 1 +ATOM 31137 C CB . ILE F 1 333 ? -6.341 -6.353 53.504 1.00 47.49 ? 333 ILE F CB 1 +ATOM 31138 C CG1 . ILE F 1 333 ? -5.673 -7.619 54.032 1.00 46.19 ? 333 ILE F CG1 1 +ATOM 31139 C CG2 . ILE F 1 333 ? -5.321 -5.254 53.287 1.00 46.27 ? 333 ILE F CG2 1 +ATOM 31140 C CD1 . ILE F 1 333 ? -4.769 -8.286 53.014 1.00 44.77 ? 333 ILE F CD1 1 +ATOM 31141 N N . ARG F 1 334 ? -8.739 -4.476 53.018 1.00 53.91 ? 334 ARG F N 1 +ATOM 31142 C CA . ARG F 1 334 ? -9.275 -3.228 52.498 1.00 56.31 ? 334 ARG F CA 1 +ATOM 31143 C C . ARG F 1 334 ? -10.171 -2.507 53.514 1.00 57.27 ? 334 ARG F C 1 +ATOM 31144 O O . ARG F 1 334 ? -10.265 -1.289 53.488 1.00 57.78 ? 334 ARG F O 1 +ATOM 31145 C CB . ARG F 1 334 ? -10.028 -3.502 51.188 1.00 57.97 ? 334 ARG F CB 1 +ATOM 31146 C CG . ARG F 1 334 ? -10.674 -2.287 50.550 1.00 61.45 ? 334 ARG F CG 1 +ATOM 31147 C CD . ARG F 1 334 ? -12.175 -2.266 50.829 1.00 65.18 ? 334 ARG F CD 1 +ATOM 31148 N NE . ARG F 1 334 ? -12.937 -3.079 49.878 1.00 67.89 ? 334 ARG F NE 1 +ATOM 31149 C CZ . ARG F 1 334 ? -14.210 -3.436 50.047 1.00 69.65 ? 334 ARG F CZ 1 +ATOM 31150 N NH1 . ARG F 1 334 ? -14.866 -3.059 51.139 1.00 70.59 ? 334 ARG F NH1 1 +ATOM 31151 N NH2 . ARG F 1 334 ? -14.838 -4.152 49.117 1.00 68.63 ? 334 ARG F NH2 1 +ATOM 31152 N N . ASP F 1 335 ? -10.813 -3.244 54.417 1.00 58.56 ? 335 ASP F N 1 +ATOM 31153 C CA . ASP F 1 335 ? -11.681 -2.615 55.415 1.00 59.72 ? 335 ASP F CA 1 +ATOM 31154 C C . ASP F 1 335 ? -10.877 -2.001 56.556 1.00 59.90 ? 335 ASP F C 1 +ATOM 31155 O O . ASP F 1 335 ? -11.197 -0.915 57.046 1.00 60.74 ? 335 ASP F O 1 +ATOM 31156 C CB . ASP F 1 335 ? -12.672 -3.621 56.019 1.00 61.05 ? 335 ASP F CB 1 +ATOM 31157 C CG . ASP F 1 335 ? -13.737 -4.076 55.033 1.00 63.99 ? 335 ASP F CG 1 +ATOM 31158 O OD1 . ASP F 1 335 ? -14.002 -3.351 54.042 1.00 64.55 ? 335 ASP F OD1 1 +ATOM 31159 O OD2 . ASP F 1 335 ? -14.323 -5.160 55.265 1.00 64.24 ? 335 ASP F OD2 1 +ATOM 31160 N N . VAL F 1 336 ? -9.838 -2.702 56.985 1.00 58.33 ? 336 VAL F N 1 +ATOM 31161 C CA . VAL F 1 336 ? -9.012 -2.228 58.078 1.00 57.75 ? 336 VAL F CA 1 +ATOM 31162 C C . VAL F 1 336 ? -8.063 -1.089 57.705 1.00 58.73 ? 336 VAL F C 1 +ATOM 31163 O O . VAL F 1 336 ? -7.856 -0.178 58.502 1.00 58.55 ? 336 VAL F O 1 +ATOM 31164 C CB . VAL F 1 336 ? -8.195 -3.390 58.680 1.00 57.24 ? 336 VAL F CB 1 +ATOM 31165 C CG1 . VAL F 1 336 ? -7.275 -2.882 59.778 1.00 56.17 ? 336 VAL F CG1 1 +ATOM 31166 C CG2 . VAL F 1 336 ? -9.141 -4.443 59.234 1.00 55.65 ? 336 VAL F CG2 1 +ATOM 31167 N N . LEU F 1 337 ? -7.498 -1.129 56.501 1.00 59.85 ? 337 LEU F N 1 +ATOM 31168 C CA . LEU F 1 337 ? -6.557 -0.091 56.076 1.00 61.86 ? 337 LEU F CA 1 +ATOM 31169 C C . LEU F 1 337 ? -7.111 0.806 54.979 1.00 64.43 ? 337 LEU F C 1 +ATOM 31170 O O . LEU F 1 337 ? -6.367 1.518 54.295 1.00 64.43 ? 337 LEU F O 1 +ATOM 31171 C CB . LEU F 1 337 ? -5.258 -0.741 55.606 1.00 60.24 ? 337 LEU F CB 1 +ATOM 31172 C CG . LEU F 1 337 ? -4.650 -1.733 56.600 1.00 59.60 ? 337 LEU F CG 1 +ATOM 31173 C CD1 . LEU F 1 337 ? -3.425 -2.383 55.983 1.00 58.83 ? 337 LEU F CD1 1 +ATOM 31174 C CD2 . LEU F 1 337 ? -4.290 -1.016 57.894 1.00 58.63 ? 337 LEU F CD2 1 +ATOM 31175 N N . SER F 1 338 ? -8.428 0.764 54.835 1.00 67.66 ? 338 SER F N 1 +ATOM 31176 C CA . SER F 1 338 ? -9.143 1.549 53.843 1.00 70.91 ? 338 SER F CA 1 +ATOM 31177 C C . SER F 1 338 ? -8.781 3.026 53.877 1.00 72.33 ? 338 SER F C 1 +ATOM 31178 O O . SER F 1 338 ? -8.328 3.594 52.884 1.00 73.02 ? 338 SER F O 1 +ATOM 31179 C CB . SER F 1 338 ? -10.644 1.412 54.083 1.00 71.78 ? 338 SER F CB 1 +ATOM 31180 O OG . SER F 1 338 ? -10.949 1.682 55.443 1.00 72.48 ? 338 SER F OG 1 +ATOM 31181 N N . SER F 1 339 ? -8.995 3.633 55.038 1.00 73.87 ? 339 SER F N 1 +ATOM 31182 C CA . SER F 1 339 ? -8.752 5.054 55.243 1.00 75.68 ? 339 SER F CA 1 +ATOM 31183 C C . SER F 1 339 ? -7.285 5.480 55.183 1.00 76.18 ? 339 SER F C 1 +ATOM 31184 O O . SER F 1 339 ? -6.980 6.643 54.907 1.00 75.99 ? 339 SER F O 1 +ATOM 31185 C CB . SER F 1 339 ? -9.367 5.470 56.577 1.00 76.65 ? 339 SER F CB 1 +ATOM 31186 O OG . SER F 1 339 ? -10.712 5.012 56.679 1.00 78.64 ? 339 SER F OG 1 +ATOM 31187 N N . LEU F 1 340 ? -6.380 4.543 55.436 1.00 76.33 ? 340 LEU F N 1 +ATOM 31188 C CA . LEU F 1 340 ? -4.954 4.838 55.400 1.00 76.19 ? 340 LEU F CA 1 +ATOM 31189 C C . LEU F 1 340 ? -4.540 5.207 53.970 1.00 76.25 ? 340 LEU F C 1 +ATOM 31190 O O . LEU F 1 340 ? -4.796 4.459 53.028 1.00 76.60 ? 340 LEU F O 1 +ATOM 31191 C CB . LEU F 1 340 ? -4.172 3.621 55.891 1.00 76.31 ? 340 LEU F CB 1 +ATOM 31192 C CG . LEU F 1 340 ? -2.806 3.886 56.522 1.00 77.27 ? 340 LEU F CG 1 +ATOM 31193 C CD1 . LEU F 1 340 ? -2.915 5.013 57.547 1.00 77.17 ? 340 LEU F CD1 1 +ATOM 31194 C CD2 . LEU F 1 340 ? -2.300 2.603 57.172 1.00 76.63 ? 340 LEU F CD2 1 +ATOM 31195 N N . PRO F 1 341 ? -3.904 6.379 53.792 1.00 76.20 ? 341 PRO F N 1 +ATOM 31196 C CA . PRO F 1 341 ? -3.446 6.879 52.489 1.00 75.86 ? 341 PRO F CA 1 +ATOM 31197 C C . PRO F 1 341 ? -2.180 6.184 51.974 1.00 76.28 ? 341 PRO F C 1 +ATOM 31198 O O . PRO F 1 341 ? -1.186 6.840 51.646 1.00 76.33 ? 341 PRO F O 1 +ATOM 31199 C CB . PRO F 1 341 ? -3.206 8.352 52.771 1.00 75.42 ? 341 PRO F CB 1 +ATOM 31200 C CG . PRO F 1 341 ? -2.651 8.308 54.161 1.00 74.55 ? 341 PRO F CG 1 +ATOM 31201 C CD . PRO F 1 341 ? -3.600 7.357 54.855 1.00 75.28 ? 341 PRO F CD 1 +ATOM 31202 N N . VAL F 1 342 ? -2.227 4.860 51.890 1.00 75.89 ? 342 VAL F N 1 +ATOM 31203 C CA . VAL F 1 342 ? -1.079 4.092 51.436 1.00 75.26 ? 342 VAL F CA 1 +ATOM 31204 C C . VAL F 1 342 ? -1.436 3.188 50.258 1.00 74.96 ? 342 VAL F C 1 +ATOM 31205 O O . VAL F 1 342 ? -2.600 3.085 49.864 1.00 75.39 ? 342 VAL F O 1 +ATOM 31206 C CB . VAL F 1 342 ? -0.527 3.230 52.586 1.00 75.43 ? 342 VAL F CB 1 +ATOM 31207 C CG1 . VAL F 1 342 ? -1.409 1.997 52.786 1.00 74.97 ? 342 VAL F CG1 1 +ATOM 31208 C CG2 . VAL F 1 342 ? 0.912 2.856 52.311 1.00 75.83 ? 342 VAL F CG2 1 +ATOM 31209 N N . GLN F 1 343 ? -0.426 2.533 49.698 1.00 74.58 ? 343 GLN F N 1 +ATOM 31210 C CA . GLN F 1 343 ? -0.638 1.642 48.568 1.00 75.19 ? 343 GLN F CA 1 +ATOM 31211 C C . GLN F 1 343 ? -0.368 0.193 48.952 1.00 75.34 ? 343 GLN F C 1 +ATOM 31212 O O . GLN F 1 343 ? 0.687 -0.128 49.506 1.00 75.03 ? 343 GLN F O 1 +ATOM 31213 C CB . GLN F 1 343 ? 0.272 2.037 47.409 1.00 75.47 ? 343 GLN F CB 1 +ATOM 31214 C CG . GLN F 1 343 ? -0.031 1.299 46.124 1.00 76.30 ? 343 GLN F CG 1 +ATOM 31215 C CD . GLN F 1 343 ? 0.888 1.712 45.004 1.00 77.69 ? 343 GLN F CD 1 +ATOM 31216 O OE1 . GLN F 1 343 ? 1.043 2.902 44.721 1.00 77.65 ? 343 GLN F OE1 1 +ATOM 31217 N NE2 . GLN F 1 343 ? 1.506 0.731 44.351 1.00 78.04 ? 343 GLN F NE2 1 +ATOM 31218 N N . PHE F 1 344 ? -1.322 -0.683 48.653 1.00 75.22 ? 344 PHE F N 1 +ATOM 31219 C CA . PHE F 1 344 ? -1.170 -2.096 48.976 1.00 75.29 ? 344 PHE F CA 1 +ATOM 31220 C C . PHE F 1 344 ? -0.397 -2.814 47.879 1.00 74.83 ? 344 PHE F C 1 +ATOM 31221 O O . PHE F 1 344 ? -0.526 -2.488 46.701 1.00 74.10 ? 344 PHE F O 1 +ATOM 31222 C CB . PHE F 1 344 ? -2.542 -2.768 49.156 1.00 75.36 ? 344 PHE F CB 1 +ATOM 31223 C CG . PHE F 1 344 ? -3.447 -2.073 50.147 1.00 76.25 ? 344 PHE F CG 1 +ATOM 31224 C CD1 . PHE F 1 344 ? -2.974 -1.690 51.401 1.00 76.31 ? 344 PHE F CD1 1 +ATOM 31225 C CD2 . PHE F 1 344 ? -4.778 -1.806 49.822 1.00 76.28 ? 344 PHE F CD2 1 +ATOM 31226 C CE1 . PHE F 1 344 ? -3.810 -1.047 52.316 1.00 76.65 ? 344 PHE F CE1 1 +ATOM 31227 C CE2 . PHE F 1 344 ? -5.623 -1.166 50.728 1.00 76.05 ? 344 PHE F CE2 1 +ATOM 31228 C CZ . PHE F 1 344 ? -5.137 -0.785 51.977 1.00 76.84 ? 344 PHE F CZ 1 +ATOM 31229 N N . ARG F 1 345 ? 0.427 -3.775 48.280 1.00 75.51 ? 345 ARG F N 1 +ATOM 31230 C CA . ARG F 1 345 ? 1.202 -4.565 47.331 1.00 76.41 ? 345 ARG F CA 1 +ATOM 31231 C C . ARG F 1 345 ? 0.200 -5.556 46.766 1.00 75.66 ? 345 ARG F C 1 +ATOM 31232 O O . ARG F 1 345 ? -0.758 -5.927 47.447 1.00 75.30 ? 345 ARG F O 1 +ATOM 31233 C CB . ARG F 1 345 ? 2.328 -5.311 48.049 1.00 78.45 ? 345 ARG F CB 1 +ATOM 31234 C CG . ARG F 1 345 ? 1.835 -6.306 49.082 1.00 80.98 ? 345 ARG F CG 1 +ATOM 31235 C CD . ARG F 1 345 ? 2.973 -6.848 49.922 1.00 83.17 ? 345 ARG F CD 1 +ATOM 31236 N NE . ARG F 1 345 ? 2.478 -7.798 50.912 1.00 86.75 ? 345 ARG F NE 1 +ATOM 31237 C CZ . ARG F 1 345 ? 3.200 -8.277 51.920 1.00 87.98 ? 345 ARG F CZ 1 +ATOM 31238 N NH1 . ARG F 1 345 ? 4.461 -7.891 52.073 1.00 88.87 ? 345 ARG F NH1 1 +ATOM 31239 N NH2 . ARG F 1 345 ? 2.660 -9.138 52.778 1.00 88.20 ? 345 ARG F NH2 1 +ATOM 31240 N N . ASP F 1 346 ? 0.406 -5.986 45.530 1.00 74.68 ? 346 ASP F N 1 +ATOM 31241 C CA . ASP F 1 346 ? -0.530 -6.918 44.926 1.00 73.38 ? 346 ASP F CA 1 +ATOM 31242 C C . ASP F 1 346 ? -0.088 -8.368 45.075 1.00 71.05 ? 346 ASP F C 1 +ATOM 31243 O O . ASP F 1 346 ? 0.501 -8.943 44.157 1.00 71.46 ? 346 ASP F O 1 +ATOM 31244 C CB . ASP F 1 346 ? -0.732 -6.586 43.441 1.00 75.52 ? 346 ASP F CB 1 +ATOM 31245 C CG . ASP F 1 346 ? -1.889 -7.362 42.822 1.00 77.43 ? 346 ASP F CG 1 +ATOM 31246 O OD1 . ASP F 1 346 ? -1.876 -8.612 42.895 1.00 78.52 ? 346 ASP F OD1 1 +ATOM 31247 O OD2 . ASP F 1 346 ? -2.808 -6.722 42.261 1.00 77.05 ? 346 ASP F OD2 1 +ATOM 31248 N N . ASP F 1 347 ? -0.366 -8.953 46.237 1.00 67.47 ? 347 ASP F N 1 +ATOM 31249 C CA . ASP F 1 347 ? -0.027 -10.348 46.478 1.00 62.98 ? 347 ASP F CA 1 +ATOM 31250 C C . ASP F 1 347 ? -1.241 -11.192 46.094 1.00 58.44 ? 347 ASP F C 1 +ATOM 31251 O O . ASP F 1 347 ? -2.233 -11.255 46.821 1.00 56.67 ? 347 ASP F O 1 +ATOM 31252 C CB . ASP F 1 347 ? 0.344 -10.575 47.947 1.00 65.49 ? 347 ASP F CB 1 +ATOM 31253 C CG . ASP F 1 347 ? 0.619 -12.042 48.260 1.00 68.17 ? 347 ASP F CG 1 +ATOM 31254 O OD1 . ASP F 1 347 ? 1.179 -12.747 47.388 1.00 69.18 ? 347 ASP F OD1 1 +ATOM 31255 O OD2 . ASP F 1 347 ? 0.284 -12.489 49.381 1.00 69.16 ? 347 ASP F OD2 1 +ATOM 31256 N N . ARG F 1 348 ? -1.147 -11.831 44.936 1.00 53.70 ? 348 ARG F N 1 +ATOM 31257 C CA . ARG F 1 348 ? -2.227 -12.651 44.412 1.00 50.05 ? 348 ARG F CA 1 +ATOM 31258 C C . ARG F 1 348 ? -2.598 -13.836 45.296 1.00 47.73 ? 348 ARG F C 1 +ATOM 31259 O O . ARG F 1 348 ? -3.745 -14.276 45.298 1.00 46.03 ? 348 ARG F O 1 +ATOM 31260 C CB . ARG F 1 348 ? -1.855 -13.129 43.014 1.00 49.80 ? 348 ARG F CB 1 +ATOM 31261 C CG . ARG F 1 348 ? -1.790 -12.003 41.980 1.00 49.37 ? 348 ARG F CG 1 +ATOM 31262 C CD . ARG F 1 348 ? -3.158 -11.741 41.397 1.00 49.08 ? 348 ARG F CD 1 +ATOM 31263 N NE . ARG F 1 348 ? -3.845 -10.593 41.971 1.00 47.16 ? 348 ARG F NE 1 +ATOM 31264 C CZ . ARG F 1 348 ? -5.157 -10.389 41.870 1.00 47.18 ? 348 ARG F CZ 1 +ATOM 31265 N NH1 . ARG F 1 348 ? -5.925 -11.261 41.233 1.00 44.98 ? 348 ARG F NH1 1 +ATOM 31266 N NH2 . ARG F 1 348 ? -5.702 -9.289 42.370 1.00 47.94 ? 348 ARG F NH2 1 +ATOM 31267 N N . LEU F 1 349 ? -1.634 -14.348 46.052 1.00 45.36 ? 349 LEU F N 1 +ATOM 31268 C CA . LEU F 1 349 ? -1.901 -15.480 46.929 1.00 44.04 ? 349 LEU F CA 1 +ATOM 31269 C C . LEU F 1 349 ? -2.966 -15.169 47.965 1.00 40.92 ? 349 LEU F C 1 +ATOM 31270 O O . LEU F 1 349 ? -3.516 -16.076 48.582 1.00 39.25 ? 349 LEU F O 1 +ATOM 31271 C CB . LEU F 1 349 ? -0.620 -15.929 47.631 1.00 45.41 ? 349 LEU F CB 1 +ATOM 31272 C CG . LEU F 1 349 ? 0.421 -16.551 46.694 1.00 48.28 ? 349 LEU F CG 1 +ATOM 31273 C CD1 . LEU F 1 349 ? 1.696 -16.860 47.478 1.00 48.73 ? 349 LEU F CD1 1 +ATOM 31274 C CD2 . LEU F 1 349 ? -0.149 -17.818 46.061 1.00 47.68 ? 349 LEU F CD2 1 +ATOM 31275 N N . VAL F 1 350 ? -3.266 -13.889 48.151 1.00 39.11 ? 350 VAL F N 1 +ATOM 31276 C CA . VAL F 1 350 ? -4.278 -13.493 49.125 1.00 37.25 ? 350 VAL F CA 1 +ATOM 31277 C C . VAL F 1 350 ? -5.679 -13.904 48.662 1.00 35.78 ? 350 VAL F C 1 +ATOM 31278 O O . VAL F 1 350 ? -6.600 -13.988 49.474 1.00 33.25 ? 350 VAL F O 1 +ATOM 31279 C CB . VAL F 1 350 ? -4.268 -11.963 49.374 1.00 37.80 ? 350 VAL F CB 1 +ATOM 31280 C CG1 . VAL F 1 350 ? -4.843 -11.228 48.164 1.00 38.74 ? 350 VAL F CG1 1 +ATOM 31281 C CG2 . VAL F 1 350 ? -5.074 -11.630 50.617 1.00 36.88 ? 350 VAL F CG2 1 +ATOM 31282 N N . THR F 1 351 ? -5.834 -14.164 47.363 1.00 35.53 ? 351 THR F N 1 +ATOM 31283 C CA . THR F 1 351 ? -7.135 -14.557 46.816 1.00 37.07 ? 351 THR F CA 1 +ATOM 31284 C C . THR F 1 351 ? -7.404 -16.061 46.837 1.00 36.74 ? 351 THR F C 1 +ATOM 31285 O O . THR F 1 351 ? -8.436 -16.512 46.340 1.00 37.01 ? 351 THR F O 1 +ATOM 31286 C CB . THR F 1 351 ? -7.324 -14.077 45.361 1.00 37.45 ? 351 THR F CB 1 +ATOM 31287 O OG1 . THR F 1 351 ? -6.427 -14.789 44.505 1.00 38.97 ? 351 THR F OG1 1 +ATOM 31288 C CG2 . THR F 1 351 ? -7.065 -12.577 45.248 1.00 37.28 ? 351 THR F CG2 1 +ATOM 31289 N N . THR F 1 352 ? -6.482 -16.840 47.393 1.00 35.64 ? 352 THR F N 1 +ATOM 31290 C CA . THR F 1 352 ? -6.686 -18.280 47.471 1.00 34.80 ? 352 THR F CA 1 +ATOM 31291 C C . THR F 1 352 ? -7.461 -18.560 48.743 1.00 34.38 ? 352 THR F C 1 +ATOM 31292 O O . THR F 1 352 ? -7.640 -17.663 49.562 1.00 37.96 ? 352 THR F O 1 +ATOM 31293 C CB . THR F 1 352 ? -5.349 -19.054 47.541 1.00 34.74 ? 352 THR F CB 1 +ATOM 31294 O OG1 . THR F 1 352 ? -4.682 -18.762 48.776 1.00 35.61 ? 352 THR F OG1 1 +ATOM 31295 C CG2 . THR F 1 352 ? -4.458 -18.673 46.386 1.00 33.37 ? 352 THR F CG2 1 +ATOM 31296 N N . PHE F 1 353 ? -7.918 -19.795 48.917 1.00 33.18 ? 353 PHE F N 1 +ATOM 31297 C CA . PHE F 1 353 ? -8.647 -20.164 50.126 1.00 33.89 ? 353 PHE F CA 1 +ATOM 31298 C C . PHE F 1 353 ? -7.706 -20.051 51.322 1.00 34.48 ? 353 PHE F C 1 +ATOM 31299 O O . PHE F 1 353 ? -6.502 -20.229 51.189 1.00 32.09 ? 353 PHE F O 1 +ATOM 31300 C CB . PHE F 1 353 ? -9.164 -21.609 50.033 1.00 32.46 ? 353 PHE F CB 1 +ATOM 31301 C CG . PHE F 1 353 ? -10.513 -21.741 49.380 1.00 34.85 ? 353 PHE F CG 1 +ATOM 31302 C CD1 . PHE F 1 353 ? -11.058 -20.691 48.627 1.00 32.42 ? 353 PHE F CD1 1 +ATOM 31303 C CD2 . PHE F 1 353 ? -11.237 -22.931 49.500 1.00 34.52 ? 353 PHE F CD2 1 +ATOM 31304 C CE1 . PHE F 1 353 ? -12.305 -20.827 48.003 1.00 34.59 ? 353 PHE F CE1 1 +ATOM 31305 C CE2 . PHE F 1 353 ? -12.482 -23.079 48.882 1.00 35.51 ? 353 PHE F CE2 1 +ATOM 31306 C CZ . PHE F 1 353 ? -13.020 -22.022 48.128 1.00 35.03 ? 353 PHE F CZ 1 +ATOM 31307 N N . PRO F 1 354 ? -8.248 -19.728 52.505 1.00 36.41 ? 354 PRO F N 1 +ATOM 31308 C CA . PRO F 1 354 ? -7.421 -19.610 53.709 1.00 38.11 ? 354 PRO F CA 1 +ATOM 31309 C C . PRO F 1 354 ? -6.782 -20.974 54.027 1.00 40.51 ? 354 PRO F C 1 +ATOM 31310 O O . PRO F 1 354 ? -7.145 -21.996 53.441 1.00 40.84 ? 354 PRO F O 1 +ATOM 31311 C CB . PRO F 1 354 ? -8.431 -19.185 54.777 1.00 36.57 ? 354 PRO F CB 1 +ATOM 31312 C CG . PRO F 1 354 ? -9.437 -18.428 54.009 1.00 35.73 ? 354 PRO F CG 1 +ATOM 31313 C CD . PRO F 1 354 ? -9.625 -19.278 52.772 1.00 36.05 ? 354 PRO F CD 1 +ATOM 31314 N N . ASP F 1 355 ? -5.841 -20.999 54.961 1.00 42.60 ? 355 ASP F N 1 +ATOM 31315 C CA . ASP F 1 355 ? -5.183 -22.255 55.303 1.00 45.83 ? 355 ASP F CA 1 +ATOM 31316 C C . ASP F 1 355 ? -5.977 -23.218 56.181 1.00 43.97 ? 355 ASP F C 1 +ATOM 31317 O O . ASP F 1 355 ? -5.708 -24.419 56.187 1.00 46.68 ? 355 ASP F O 1 +ATOM 31318 C CB . ASP F 1 355 ? -3.831 -21.972 55.954 1.00 51.12 ? 355 ASP F CB 1 +ATOM 31319 C CG . ASP F 1 355 ? -2.779 -21.572 54.940 1.00 56.69 ? 355 ASP F CG 1 +ATOM 31320 O OD1 . ASP F 1 355 ? -2.439 -22.409 54.066 1.00 57.80 ? 355 ASP F OD1 1 +ATOM 31321 O OD2 . ASP F 1 355 ? -2.296 -20.418 55.015 1.00 62.12 ? 355 ASP F OD2 1 +ATOM 31322 N N . ASN F 1 356 ? -6.965 -22.715 56.903 1.00 40.17 ? 356 ASN F N 1 +ATOM 31323 C CA . ASN F 1 356 ? -7.739 -23.576 57.779 1.00 37.33 ? 356 ASN F CA 1 +ATOM 31324 C C . ASN F 1 356 ? -8.915 -24.293 57.110 1.00 35.16 ? 356 ASN F C 1 +ATOM 31325 O O . ASN F 1 356 ? -9.726 -24.913 57.792 1.00 34.14 ? 356 ASN F O 1 +ATOM 31326 C CB . ASN F 1 356 ? -8.227 -22.760 58.979 1.00 37.37 ? 356 ASN F CB 1 +ATOM 31327 C CG . ASN F 1 356 ? -9.141 -21.620 58.575 1.00 39.68 ? 356 ASN F CG 1 +ATOM 31328 O OD1 . ASN F 1 356 ? -9.010 -21.064 57.485 1.00 41.71 ? 356 ASN F OD1 1 +ATOM 31329 N ND2 . ASN F 1 356 ? -10.065 -21.258 59.455 1.00 39.62 ? 356 ASN F ND2 1 +ATOM 31330 N N . VAL F 1 357 ? -9.011 -24.209 55.787 1.00 33.40 ? 357 VAL F N 1 +ATOM 31331 C CA . VAL F 1 357 ? -10.101 -24.859 55.060 1.00 32.83 ? 357 VAL F CA 1 +ATOM 31332 C C . VAL F 1 357 ? -9.810 -26.347 54.832 1.00 33.38 ? 357 VAL F C 1 +ATOM 31333 O O . VAL F 1 357 ? -8.698 -26.721 54.464 1.00 33.00 ? 357 VAL F O 1 +ATOM 31334 C CB . VAL F 1 357 ? -10.354 -24.173 53.675 1.00 32.60 ? 357 VAL F CB 1 +ATOM 31335 C CG1 . VAL F 1 357 ? -11.331 -24.993 52.844 1.00 28.63 ? 357 VAL F CG1 1 +ATOM 31336 C CG2 . VAL F 1 357 ? -10.902 -22.765 53.877 1.00 32.40 ? 357 VAL F CG2 1 +ATOM 31337 N N . VAL F 1 358 ? -10.819 -27.188 55.038 1.00 33.65 ? 358 VAL F N 1 +ATOM 31338 C CA . VAL F 1 358 ? -10.652 -28.623 54.862 1.00 36.01 ? 358 VAL F CA 1 +ATOM 31339 C C . VAL F 1 358 ? -11.684 -29.239 53.920 1.00 36.85 ? 358 VAL F C 1 +ATOM 31340 O O . VAL F 1 358 ? -12.771 -28.697 53.727 1.00 39.24 ? 358 VAL F O 1 +ATOM 31341 C CB . VAL F 1 358 ? -10.741 -29.358 56.219 1.00 36.13 ? 358 VAL F CB 1 +ATOM 31342 C CG1 . VAL F 1 358 ? -9.649 -28.847 57.152 1.00 35.60 ? 358 VAL F CG1 1 +ATOM 31343 C CG2 . VAL F 1 358 ? -12.119 -29.151 56.846 1.00 33.75 ? 358 VAL F CG2 1 +ATOM 31344 N N . HIS F 1 359 ? -11.332 -30.384 53.349 1.00 36.04 ? 359 HIS F N 1 +ATOM 31345 C CA . HIS F 1 359 ? -12.207 -31.105 52.435 1.00 36.64 ? 359 HIS F CA 1 +ATOM 31346 C C . HIS F 1 359 ? -12.238 -32.575 52.847 1.00 37.38 ? 359 HIS F C 1 +ATOM 31347 O O . HIS F 1 359 ? -11.420 -33.017 53.652 1.00 36.27 ? 359 HIS F O 1 +ATOM 31348 C CB . HIS F 1 359 ? -11.664 -31.033 51.005 1.00 36.00 ? 359 HIS F CB 1 +ATOM 31349 C CG . HIS F 1 359 ? -11.505 -29.645 50.473 1.00 37.31 ? 359 HIS F CG 1 +ATOM 31350 N ND1 . HIS F 1 359 ? -12.569 -28.885 50.033 1.00 38.16 ? 359 HIS F ND1 1 +ATOM 31351 C CD2 . HIS F 1 359 ? -10.400 -28.882 50.299 1.00 36.21 ? 359 HIS F CD2 1 +ATOM 31352 C CE1 . HIS F 1 359 ? -12.124 -27.713 49.613 1.00 36.54 ? 359 HIS F CE1 1 +ATOM 31353 N NE2 . HIS F 1 359 ? -10.812 -27.687 49.763 1.00 35.64 ? 359 HIS F NE2 1 +ATOM 31354 N N . TYR F 1 360 ? -13.183 -33.325 52.289 1.00 38.88 ? 360 TYR F N 1 +ATOM 31355 C CA . TYR F 1 360 ? -13.275 -34.756 52.549 1.00 39.16 ? 360 TYR F CA 1 +ATOM 31356 C C . TYR F 1 360 ? -13.008 -35.451 51.231 1.00 39.07 ? 360 TYR F C 1 +ATOM 31357 O O . TYR F 1 360 ? -13.850 -35.460 50.335 1.00 39.36 ? 360 TYR F O 1 +ATOM 31358 C CB . TYR F 1 360 ? -14.648 -35.151 53.085 1.00 39.94 ? 360 TYR F CB 1 +ATOM 31359 C CG . TYR F 1 360 ? -14.854 -34.707 54.508 1.00 44.94 ? 360 TYR F CG 1 +ATOM 31360 C CD1 . TYR F 1 360 ? -15.356 -33.439 54.799 1.00 48.08 ? 360 TYR F CD1 1 +ATOM 31361 C CD2 . TYR F 1 360 ? -14.491 -35.531 55.574 1.00 46.85 ? 360 TYR F CD2 1 +ATOM 31362 C CE1 . TYR F 1 360 ? -15.491 -33.000 56.116 1.00 50.05 ? 360 TYR F CE1 1 +ATOM 31363 C CE2 . TYR F 1 360 ? -14.619 -35.102 56.895 1.00 48.20 ? 360 TYR F CE2 1 +ATOM 31364 C CZ . TYR F 1 360 ? -15.118 -33.837 57.156 1.00 51.16 ? 360 TYR F CZ 1 +ATOM 31365 O OH . TYR F 1 360 ? -15.223 -33.393 58.456 1.00 55.50 ? 360 TYR F OH 1 +ATOM 31366 N N . LEU F 1 361 ? -11.808 -36.002 51.107 1.00 38.81 ? 361 LEU F N 1 +ATOM 31367 C CA . LEU F 1 361 ? -11.410 -36.705 49.897 1.00 39.46 ? 361 LEU F CA 1 +ATOM 31368 C C . LEU F 1 361 ? -11.439 -38.205 50.179 1.00 39.57 ? 361 LEU F C 1 +ATOM 31369 O O . LEU F 1 361 ? -10.751 -38.689 51.085 1.00 40.42 ? 361 LEU F O 1 +ATOM 31370 C CB . LEU F 1 361 ? -10.009 -36.260 49.478 1.00 36.97 ? 361 LEU F CB 1 +ATOM 31371 C CG . LEU F 1 361 ? -9.433 -36.943 48.238 1.00 39.07 ? 361 LEU F CG 1 +ATOM 31372 C CD1 . LEU F 1 361 ? -10.336 -36.696 47.034 1.00 38.15 ? 361 LEU F CD1 1 +ATOM 31373 C CD2 . LEU F 1 361 ? -8.032 -36.408 47.978 1.00 36.89 ? 361 LEU F CD2 1 +ATOM 31374 N N . ARG F 1 362 ? -12.243 -38.934 49.413 1.00 38.73 ? 362 ARG F N 1 +ATOM 31375 C CA . ARG F 1 362 ? -12.371 -40.376 49.599 1.00 38.66 ? 362 ARG F CA 1 +ATOM 31376 C C . ARG F 1 362 ? -12.567 -40.706 51.082 1.00 39.77 ? 362 ARG F C 1 +ATOM 31377 O O . ARG F 1 362 ? -11.912 -41.589 51.644 1.00 40.10 ? 362 ARG F O 1 +ATOM 31378 C CB . ARG F 1 362 ? -11.145 -41.104 49.024 1.00 35.37 ? 362 ARG F CB 1 +ATOM 31379 C CG . ARG F 1 362 ? -10.999 -40.926 47.513 1.00 35.80 ? 362 ARG F CG 1 +ATOM 31380 C CD . ARG F 1 362 ? -9.970 -41.867 46.914 1.00 34.78 ? 362 ARG F CD 1 +ATOM 31381 N NE . ARG F 1 362 ? -8.624 -41.660 47.443 1.00 35.23 ? 362 ARG F NE 1 +ATOM 31382 C CZ . ARG F 1 362 ? -7.815 -40.662 47.092 1.00 37.30 ? 362 ARG F CZ 1 +ATOM 31383 N NH1 . ARG F 1 362 ? -8.207 -39.757 46.199 1.00 35.78 ? 362 ARG F NH1 1 +ATOM 31384 N NH2 . ARG F 1 362 ? -6.601 -40.575 47.631 1.00 35.75 ? 362 ARG F NH2 1 +ATOM 31385 N N . GLY F 1 363 ? -13.467 -39.958 51.715 1.00 41.19 ? 363 GLY F N 1 +ATOM 31386 C CA . GLY F 1 363 ? -13.777 -40.178 53.117 1.00 41.95 ? 363 GLY F CA 1 +ATOM 31387 C C . GLY F 1 363 ? -12.789 -39.639 54.131 1.00 42.64 ? 363 GLY F C 1 +ATOM 31388 O O . GLY F 1 363 ? -13.063 -39.644 55.324 1.00 43.45 ? 363 GLY F O 1 +ATOM 31389 N N . LYS F 1 364 ? -11.639 -39.171 53.673 1.00 43.37 ? 364 LYS F N 1 +ATOM 31390 C CA . LYS F 1 364 ? -10.636 -38.648 54.586 1.00 43.75 ? 364 LYS F CA 1 +ATOM 31391 C C . LYS F 1 364 ? -10.633 -37.118 54.627 1.00 43.21 ? 364 LYS F C 1 +ATOM 31392 O O . LYS F 1 364 ? -10.796 -36.449 53.610 1.00 43.32 ? 364 LYS F O 1 +ATOM 31393 C CB . LYS F 1 364 ? -9.255 -39.176 54.181 1.00 44.81 ? 364 LYS F CB 1 +ATOM 31394 C CG . LYS F 1 364 ? -8.117 -38.715 55.068 1.00 47.76 ? 364 LYS F CG 1 +ATOM 31395 C CD . LYS F 1 364 ? -6.789 -39.286 54.583 1.00 52.17 ? 364 LYS F CD 1 +ATOM 31396 C CE . LYS F 1 364 ? -5.642 -38.940 55.525 1.00 53.85 ? 364 LYS F CE 1 +ATOM 31397 N NZ . LYS F 1 364 ? -4.352 -39.535 55.060 1.00 55.72 ? 364 LYS F NZ 1 +ATOM 31398 N N . ARG F 1 365 ? -10.443 -36.571 55.817 1.00 43.16 ? 365 ARG F N 1 +ATOM 31399 C CA . ARG F 1 365 ? -10.409 -35.126 56.021 1.00 42.74 ? 365 ARG F CA 1 +ATOM 31400 C C . ARG F 1 365 ? -9.000 -34.614 55.712 1.00 41.72 ? 365 ARG F C 1 +ATOM 31401 O O . ARG F 1 365 ? -8.032 -35.033 56.344 1.00 42.31 ? 365 ARG F O 1 +ATOM 31402 C CB . ARG F 1 365 ? -10.783 -34.839 57.465 1.00 44.52 ? 365 ARG F CB 1 +ATOM 31403 C CG . ARG F 1 365 ? -11.131 -33.420 57.796 1.00 48.86 ? 365 ARG F CG 1 +ATOM 31404 C CD . ARG F 1 365 ? -12.046 -33.423 59.019 1.00 53.89 ? 365 ARG F CD 1 +ATOM 31405 N NE . ARG F 1 365 ? -12.097 -32.135 59.703 1.00 57.63 ? 365 ARG F NE 1 +ATOM 31406 C CZ . ARG F 1 365 ? -11.057 -31.579 60.318 1.00 59.19 ? 365 ARG F CZ 1 +ATOM 31407 N NH1 . ARG F 1 365 ? -9.880 -32.199 60.334 1.00 60.13 ? 365 ARG F NH1 1 +ATOM 31408 N NH2 . ARG F 1 365 ? -11.195 -30.405 60.918 1.00 59.57 ? 365 ARG F NH2 1 +ATOM 31409 N N . VAL F 1 366 ? -8.889 -33.722 54.730 1.00 39.78 ? 366 VAL F N 1 +ATOM 31410 C CA . VAL F 1 366 ? -7.597 -33.177 54.319 1.00 38.51 ? 366 VAL F CA 1 +ATOM 31411 C C . VAL F 1 366 ? -7.569 -31.645 54.248 1.00 38.56 ? 366 VAL F C 1 +ATOM 31412 O O . VAL F 1 366 ? -8.591 -30.986 54.052 1.00 38.48 ? 366 VAL F O 1 +ATOM 31413 C CB . VAL F 1 366 ? -7.179 -33.724 52.931 1.00 39.47 ? 366 VAL F CB 1 +ATOM 31414 C CG1 . VAL F 1 366 ? -7.079 -35.238 52.974 1.00 41.57 ? 366 VAL F CG1 1 +ATOM 31415 C CG2 . VAL F 1 366 ? -8.197 -33.312 51.872 1.00 39.27 ? 366 VAL F CG2 1 +ATOM 31416 N N . LYS F 1 367 ? -6.382 -31.077 54.408 1.00 38.57 ? 367 LYS F N 1 +ATOM 31417 C CA . LYS F 1 367 ? -6.225 -29.634 54.347 1.00 37.32 ? 367 LYS F CA 1 +ATOM 31418 C C . LYS F 1 367 ? -6.305 -29.155 52.904 1.00 36.74 ? 367 LYS F C 1 +ATOM 31419 O O . LYS F 1 367 ? -5.810 -29.814 51.984 1.00 34.53 ? 367 LYS F O 1 +ATOM 31420 C CB . LYS F 1 367 ? -4.880 -29.216 54.936 1.00 40.72 ? 367 LYS F CB 1 +ATOM 31421 C CG . LYS F 1 367 ? -4.767 -29.369 56.437 1.00 45.01 ? 367 LYS F CG 1 +ATOM 31422 C CD . LYS F 1 367 ? -3.432 -28.824 56.918 1.00 48.31 ? 367 LYS F CD 1 +ATOM 31423 C CE . LYS F 1 367 ? -3.323 -28.874 58.435 1.00 52.47 ? 367 LYS F CE 1 +ATOM 31424 N NZ . LYS F 1 367 ? -2.039 -28.262 58.900 1.00 55.66 ? 367 LYS F NZ 1 +ATOM 31425 N N . HIS F 1 368 ? -6.919 -27.991 52.715 1.00 34.96 ? 368 HIS F N 1 +ATOM 31426 C CA . HIS F 1 368 ? -7.063 -27.414 51.392 1.00 33.02 ? 368 HIS F CA 1 +ATOM 31427 C C . HIS F 1 368 ? -5.724 -27.253 50.666 1.00 32.83 ? 368 HIS F C 1 +ATOM 31428 O O . HIS F 1 368 ? -5.634 -27.459 49.455 1.00 30.62 ? 368 HIS F O 1 +ATOM 31429 C CB . HIS F 1 368 ? -7.752 -26.052 51.482 1.00 32.39 ? 368 HIS F CB 1 +ATOM 31430 C CG . HIS F 1 368 ? -7.884 -25.364 50.162 1.00 32.09 ? 368 HIS F CG 1 +ATOM 31431 N ND1 . HIS F 1 368 ? -8.805 -25.753 49.211 1.00 31.41 ? 368 HIS F ND1 1 +ATOM 31432 C CD2 . HIS F 1 368 ? -7.147 -24.379 49.593 1.00 31.48 ? 368 HIS F CD2 1 +ATOM 31433 C CE1 . HIS F 1 368 ? -8.626 -25.041 48.113 1.00 32.52 ? 368 HIS F CE1 1 +ATOM 31434 N NE2 . HIS F 1 368 ? -7.626 -24.200 48.317 1.00 31.75 ? 368 HIS F NE2 1 +ATOM 31435 N N . GLU F 1 369 ? -4.684 -26.881 51.402 1.00 34.35 ? 369 GLU F N 1 +ATOM 31436 C CA . GLU F 1 369 ? -3.368 -26.688 50.796 1.00 36.99 ? 369 GLU F CA 1 +ATOM 31437 C C . GLU F 1 369 ? -2.739 -27.965 50.243 1.00 36.80 ? 369 GLU F C 1 +ATOM 31438 O O . GLU F 1 369 ? -1.821 -27.893 49.422 1.00 35.88 ? 369 GLU F O 1 +ATOM 31439 C CB . GLU F 1 369 ? -2.408 -26.041 51.789 1.00 39.62 ? 369 GLU F CB 1 +ATOM 31440 C CG . GLU F 1 369 ? -2.158 -26.862 53.032 1.00 48.20 ? 369 GLU F CG 1 +ATOM 31441 C CD . GLU F 1 369 ? -1.339 -26.106 54.062 1.00 52.90 ? 369 GLU F CD 1 +ATOM 31442 O OE1 . GLU F 1 369 ? -0.101 -26.015 53.902 1.00 54.94 ? 369 GLU F OE1 1 +ATOM 31443 O OE2 . GLU F 1 369 ? -1.942 -25.587 55.027 1.00 57.26 ? 369 GLU F OE2 1 +ATOM 31444 N N . LYS F 1 370 ? -3.220 -29.126 50.684 1.00 36.73 ? 370 LYS F N 1 +ATOM 31445 C CA . LYS F 1 370 ? -2.686 -30.392 50.192 1.00 36.78 ? 370 LYS F CA 1 +ATOM 31446 C C . LYS F 1 370 ? -3.330 -30.792 48.864 1.00 35.56 ? 370 LYS F C 1 +ATOM 31447 O O . LYS F 1 370 ? -2.694 -31.438 48.032 1.00 33.55 ? 370 LYS F O 1 +ATOM 31448 C CB . LYS F 1 370 ? -2.928 -31.518 51.203 1.00 40.77 ? 370 LYS F CB 1 +ATOM 31449 C CG . LYS F 1 370 ? -2.219 -31.362 52.537 1.00 46.98 ? 370 LYS F CG 1 +ATOM 31450 C CD . LYS F 1 370 ? -0.702 -31.450 52.384 1.00 52.46 ? 370 LYS F CD 1 +ATOM 31451 C CE . LYS F 1 370 ? -0.004 -31.371 53.746 1.00 55.35 ? 370 LYS F CE 1 +ATOM 31452 N NZ . LYS F 1 370 ? -0.321 -30.093 54.473 1.00 57.52 ? 370 LYS F NZ 1 +ATOM 31453 N N . VAL F 1 371 ? -4.587 -30.398 48.664 1.00 34.47 ? 371 VAL F N 1 +ATOM 31454 C CA . VAL F 1 371 ? -5.317 -30.771 47.458 1.00 33.69 ? 371 VAL F CA 1 +ATOM 31455 C C . VAL F 1 371 ? -5.896 -29.625 46.620 1.00 34.00 ? 371 VAL F C 1 +ATOM 31456 O O . VAL F 1 371 ? -6.645 -29.867 45.672 1.00 34.14 ? 371 VAL F O 1 +ATOM 31457 C CB . VAL F 1 371 ? -6.471 -31.710 47.832 1.00 32.91 ? 371 VAL F CB 1 +ATOM 31458 C CG1 . VAL F 1 371 ? -5.944 -32.890 48.609 1.00 31.19 ? 371 VAL F CG1 1 +ATOM 31459 C CG2 . VAL F 1 371 ? -7.505 -30.957 48.656 1.00 32.83 ? 371 VAL F CG2 1 +ATOM 31460 N N . ARG F 1 372 ? -5.539 -28.389 46.959 1.00 33.42 ? 372 ARG F N 1 +ATOM 31461 C CA . ARG F 1 372 ? -6.058 -27.215 46.272 1.00 30.58 ? 372 ARG F CA 1 +ATOM 31462 C C . ARG F 1 372 ? -6.222 -27.278 44.760 1.00 30.63 ? 372 ARG F C 1 +ATOM 31463 O O . ARG F 1 372 ? -7.316 -27.068 44.241 1.00 31.40 ? 372 ARG F O 1 +ATOM 31464 C CB . ARG F 1 372 ? -5.209 -25.987 46.605 1.00 30.78 ? 372 ARG F CB 1 +ATOM 31465 C CG . ARG F 1 372 ? -5.651 -24.739 45.835 1.00 30.23 ? 372 ARG F CG 1 +ATOM 31466 C CD . ARG F 1 372 ? -4.929 -23.469 46.256 1.00 29.48 ? 372 ARG F CD 1 +ATOM 31467 N NE . ARG F 1 372 ? -5.323 -22.353 45.399 1.00 28.70 ? 372 ARG F NE 1 +ATOM 31468 C CZ . ARG F 1 372 ? -6.468 -21.677 45.504 1.00 27.99 ? 372 ARG F CZ 1 +ATOM 31469 N NH1 . ARG F 1 372 ? -7.359 -21.977 46.446 1.00 26.99 ? 372 ARG F NH1 1 +ATOM 31470 N NH2 . ARG F 1 372 ? -6.738 -20.713 44.636 1.00 24.64 ? 372 ARG F NH2 1 +ATOM 31471 N N . ASN F 1 373 ? -5.139 -27.552 44.049 1.00 29.32 ? 373 ASN F N 1 +ATOM 31472 C CA . ASN F 1 373 ? -5.179 -27.562 42.604 1.00 28.52 ? 373 ASN F CA 1 +ATOM 31473 C C . ASN F 1 373 ? -6.146 -28.523 41.942 1.00 30.46 ? 373 ASN F C 1 +ATOM 31474 O O . ASN F 1 373 ? -6.507 -28.333 40.777 1.00 30.52 ? 373 ASN F O 1 +ATOM 31475 C CB . ASN F 1 373 ? -3.773 -27.776 42.060 1.00 28.07 ? 373 ASN F CB 1 +ATOM 31476 C CG . ASN F 1 373 ? -2.807 -26.731 42.565 1.00 29.48 ? 373 ASN F CG 1 +ATOM 31477 O OD1 . ASN F 1 373 ? -3.201 -25.596 42.835 1.00 27.67 ? 373 ASN F OD1 1 +ATOM 31478 N ND2 . ASN F 1 373 ? -1.535 -27.100 42.689 1.00 30.99 ? 373 ASN F ND2 1 +ATOM 31479 N N . ALA F 1 374 ? -6.583 -29.547 42.663 1.00 29.52 ? 374 ALA F N 1 +ATOM 31480 C CA . ALA F 1 374 ? -7.505 -30.498 42.060 1.00 30.87 ? 374 ALA F CA 1 +ATOM 31481 C C . ALA F 1 374 ? -8.969 -30.047 42.190 1.00 30.34 ? 374 ALA F C 1 +ATOM 31482 O O . ALA F 1 374 ? -9.875 -30.666 41.616 1.00 28.61 ? 374 ALA F O 1 +ATOM 31483 C CB . ALA F 1 374 ? -7.312 -31.883 42.685 1.00 28.38 ? 374 ALA F CB 1 +ATOM 31484 N N . TYR F 1 375 ? -9.198 -28.969 42.932 1.00 29.66 ? 375 TYR F N 1 +ATOM 31485 C CA . TYR F 1 375 ? -10.564 -28.466 43.121 1.00 31.68 ? 375 TYR F CA 1 +ATOM 31486 C C . TYR F 1 375 ? -11.301 -28.244 41.779 1.00 30.33 ? 375 TYR F C 1 +ATOM 31487 O O . TYR F 1 375 ? -12.406 -28.738 41.579 1.00 28.91 ? 375 TYR F O 1 +ATOM 31488 C CB . TYR F 1 375 ? -10.542 -27.160 43.918 1.00 31.52 ? 375 TYR F CB 1 +ATOM 31489 C CG . TYR F 1 375 ? -11.912 -26.651 44.322 1.00 32.17 ? 375 TYR F CG 1 +ATOM 31490 C CD1 . TYR F 1 375 ? -12.504 -27.053 45.524 1.00 32.88 ? 375 TYR F CD1 1 +ATOM 31491 C CD2 . TYR F 1 375 ? -12.608 -25.748 43.515 1.00 31.96 ? 375 TYR F CD2 1 +ATOM 31492 C CE1 . TYR F 1 375 ? -13.752 -26.564 45.913 1.00 31.38 ? 375 TYR F CE1 1 +ATOM 31493 C CE2 . TYR F 1 375 ? -13.857 -25.255 43.892 1.00 30.85 ? 375 TYR F CE2 1 +ATOM 31494 C CZ . TYR F 1 375 ? -14.418 -25.664 45.089 1.00 32.19 ? 375 TYR F CZ 1 +ATOM 31495 O OH . TYR F 1 375 ? -15.638 -25.164 45.470 1.00 33.56 ? 375 TYR F OH 1 +ATOM 31496 N N . PRO F 1 376 ? -10.692 -27.496 40.846 1.00 30.01 ? 376 PRO F N 1 +ATOM 31497 C CA . PRO F 1 376 ? -11.380 -27.277 39.569 1.00 30.70 ? 376 PRO F CA 1 +ATOM 31498 C C . PRO F 1 376 ? -11.620 -28.576 38.794 1.00 31.77 ? 376 PRO F C 1 +ATOM 31499 O O . PRO F 1 376 ? -12.595 -28.698 38.043 1.00 31.74 ? 376 PRO F O 1 +ATOM 31500 C CB . PRO F 1 376 ? -10.445 -26.322 38.838 1.00 29.90 ? 376 PRO F CB 1 +ATOM 31501 C CG . PRO F 1 376 ? -9.090 -26.711 39.383 1.00 29.92 ? 376 PRO F CG 1 +ATOM 31502 C CD . PRO F 1 376 ? -9.372 -26.844 40.850 1.00 28.85 ? 376 PRO F CD 1 +ATOM 31503 N N . LEU F 1 377 ? -10.729 -29.547 38.970 1.00 31.86 ? 377 LEU F N 1 +ATOM 31504 C CA . LEU F 1 377 ? -10.883 -30.817 38.283 1.00 31.32 ? 377 LEU F CA 1 +ATOM 31505 C C . LEU F 1 377 ? -12.180 -31.497 38.726 1.00 31.30 ? 377 LEU F C 1 +ATOM 31506 O O . LEU F 1 377 ? -12.952 -31.977 37.898 1.00 31.66 ? 377 LEU F O 1 +ATOM 31507 C CB . LEU F 1 377 ? -9.697 -31.737 38.578 1.00 31.99 ? 377 LEU F CB 1 +ATOM 31508 C CG . LEU F 1 377 ? -9.826 -33.189 38.086 1.00 32.55 ? 377 LEU F CG 1 +ATOM 31509 C CD1 . LEU F 1 377 ? -9.840 -33.227 36.560 1.00 31.94 ? 377 LEU F CD1 1 +ATOM 31510 C CD2 . LEU F 1 377 ? -8.669 -34.010 38.616 1.00 32.71 ? 377 LEU F CD2 1 +ATOM 31511 N N . TYR F 1 378 ? -12.418 -31.531 40.030 1.00 30.28 ? 378 TYR F N 1 +ATOM 31512 C CA . TYR F 1 378 ? -13.614 -32.165 40.556 1.00 31.88 ? 378 TYR F CA 1 +ATOM 31513 C C . TYR F 1 378 ? -14.883 -31.390 40.228 1.00 32.47 ? 378 TYR F C 1 +ATOM 31514 O O . TYR F 1 378 ? -15.946 -31.980 40.088 1.00 32.10 ? 378 TYR F O 1 +ATOM 31515 C CB . TYR F 1 378 ? -13.474 -32.387 42.067 1.00 31.50 ? 378 TYR F CB 1 +ATOM 31516 C CG . TYR F 1 378 ? -12.605 -33.581 42.398 1.00 32.72 ? 378 TYR F CG 1 +ATOM 31517 C CD1 . TYR F 1 378 ? -13.081 -34.881 42.245 1.00 34.28 ? 378 TYR F CD1 1 +ATOM 31518 C CD2 . TYR F 1 378 ? -11.292 -33.415 42.813 1.00 34.50 ? 378 TYR F CD2 1 +ATOM 31519 C CE1 . TYR F 1 378 ? -12.269 -35.985 42.497 1.00 34.56 ? 378 TYR F CE1 1 +ATOM 31520 C CE2 . TYR F 1 378 ? -10.467 -34.515 43.067 1.00 35.05 ? 378 TYR F CE2 1 +ATOM 31521 C CZ . TYR F 1 378 ? -10.965 -35.796 42.906 1.00 34.22 ? 378 TYR F CZ 1 +ATOM 31522 O OH . TYR F 1 378 ? -10.156 -36.881 43.148 1.00 34.18 ? 378 TYR F OH 1 +ATOM 31523 N N . GLU F 1 379 ? -14.779 -30.070 40.102 1.00 33.43 ? 379 GLU F N 1 +ATOM 31524 C CA . GLU F 1 379 ? -15.949 -29.276 39.752 1.00 32.28 ? 379 GLU F CA 1 +ATOM 31525 C C . GLU F 1 379 ? -16.304 -29.585 38.292 1.00 30.43 ? 379 GLU F C 1 +ATOM 31526 O O . GLU F 1 379 ? -17.470 -29.774 37.955 1.00 28.14 ? 379 GLU F O 1 +ATOM 31527 C CB . GLU F 1 379 ? -15.670 -27.778 39.911 1.00 34.67 ? 379 GLU F CB 1 +ATOM 31528 C CG . GLU F 1 379 ? -16.842 -26.905 39.479 1.00 35.94 ? 379 GLU F CG 1 +ATOM 31529 C CD . GLU F 1 379 ? -16.471 -25.437 39.314 1.00 39.72 ? 379 GLU F CD 1 +ATOM 31530 O OE1 . GLU F 1 379 ? -15.355 -25.155 38.818 1.00 41.73 ? 379 GLU F OE1 1 +ATOM 31531 O OE2 . GLU F 1 379 ? -17.305 -24.565 39.656 1.00 39.93 ? 379 GLU F OE2 1 +ATOM 31532 N N . ALA F 1 380 ? -15.291 -29.641 37.430 1.00 28.29 ? 380 ALA F N 1 +ATOM 31533 C CA . ALA F 1 380 ? -15.513 -29.946 36.021 1.00 28.91 ? 380 ALA F CA 1 +ATOM 31534 C C . ALA F 1 380 ? -16.107 -31.350 35.879 1.00 31.72 ? 380 ALA F C 1 +ATOM 31535 O O . ALA F 1 380 ? -16.990 -31.586 35.046 1.00 32.58 ? 380 ALA F O 1 +ATOM 31536 C CB . ALA F 1 380 ? -14.202 -29.849 35.246 1.00 26.20 ? 380 ALA F CB 1 +ATOM 31537 N N . MET F 1 381 ? -15.615 -32.277 36.699 1.00 31.50 ? 381 MET F N 1 +ATOM 31538 C CA . MET F 1 381 ? -16.081 -33.652 36.696 1.00 31.65 ? 381 MET F CA 1 +ATOM 31539 C C . MET F 1 381 ? -17.583 -33.697 36.984 1.00 31.61 ? 381 MET F C 1 +ATOM 31540 O O . MET F 1 381 ? -18.349 -34.353 36.274 1.00 32.81 ? 381 MET F O 1 +ATOM 31541 C CB . MET F 1 381 ? -15.326 -34.441 37.768 1.00 32.66 ? 381 MET F CB 1 +ATOM 31542 C CG . MET F 1 381 ? -15.659 -35.909 37.843 1.00 31.76 ? 381 MET F CG 1 +ATOM 31543 S SD . MET F 1 381 ? -14.807 -36.632 39.238 1.00 37.85 ? 381 MET F SD 1 +ATOM 31544 C CE . MET F 1 381 ? -13.057 -36.630 38.653 1.00 34.33 ? 381 MET F CE 1 +ATOM 31545 N N . ALA F 1 382 ? -17.994 -33.001 38.034 1.00 30.59 ? 382 ALA F N 1 +ATOM 31546 C CA . ALA F 1 382 ? -19.389 -32.953 38.429 1.00 31.70 ? 382 ALA F CA 1 +ATOM 31547 C C . ALA F 1 382 ? -20.234 -32.261 37.371 1.00 32.28 ? 382 ALA F C 1 +ATOM 31548 O O . ALA F 1 382 ? -21.393 -32.611 37.171 1.00 31.95 ? 382 ALA F O 1 +ATOM 31549 C CB . ALA F 1 382 ? -19.531 -32.218 39.753 1.00 31.74 ? 382 ALA F CB 1 +ATOM 31550 N N . THR F 1 383 ? -19.649 -31.275 36.701 1.00 31.85 ? 383 THR F N 1 +ATOM 31551 C CA . THR F 1 383 ? -20.374 -30.539 35.685 1.00 33.17 ? 383 THR F CA 1 +ATOM 31552 C C . THR F 1 383 ? -20.566 -31.429 34.460 1.00 33.25 ? 383 THR F C 1 +ATOM 31553 O O . THR F 1 383 ? -21.615 -31.407 33.823 1.00 30.75 ? 383 THR F O 1 +ATOM 31554 C CB . THR F 1 383 ? -19.612 -29.230 35.313 1.00 31.84 ? 383 THR F CB 1 +ATOM 31555 O OG1 . THR F 1 383 ? -19.468 -28.424 36.489 1.00 30.90 ? 383 THR F OG1 1 +ATOM 31556 C CG2 . THR F 1 383 ? -20.370 -28.435 34.273 1.00 29.80 ? 383 THR F CG2 1 +ATOM 31557 N N . PHE F 1 384 ? -19.541 -32.217 34.148 1.00 34.14 ? 384 PHE F N 1 +ATOM 31558 C CA . PHE F 1 384 ? -19.583 -33.128 33.013 1.00 34.55 ? 384 PHE F CA 1 +ATOM 31559 C C . PHE F 1 384 ? -20.672 -34.151 33.302 1.00 34.47 ? 384 PHE F C 1 +ATOM 31560 O O . PHE F 1 384 ? -21.450 -34.517 32.435 1.00 33.95 ? 384 PHE F O 1 +ATOM 31561 C CB . PHE F 1 384 ? -18.233 -33.834 32.869 1.00 34.47 ? 384 PHE F CB 1 +ATOM 31562 C CG . PHE F 1 384 ? -18.069 -34.585 31.581 1.00 34.44 ? 384 PHE F CG 1 +ATOM 31563 C CD1 . PHE F 1 384 ? -17.621 -33.934 30.434 1.00 34.58 ? 384 PHE F CD1 1 +ATOM 31564 C CD2 . PHE F 1 384 ? -18.344 -35.950 31.515 1.00 33.99 ? 384 PHE F CD2 1 +ATOM 31565 C CE1 . PHE F 1 384 ? -17.444 -34.635 29.239 1.00 35.54 ? 384 PHE F CE1 1 +ATOM 31566 C CE2 . PHE F 1 384 ? -18.172 -36.657 30.329 1.00 34.52 ? 384 PHE F CE2 1 +ATOM 31567 C CZ . PHE F 1 384 ? -17.720 -36.000 29.187 1.00 34.67 ? 384 PHE F CZ 1 +ATOM 31568 N N . LYS F 1 385 ? -20.712 -34.606 34.542 1.00 35.92 ? 385 LYS F N 1 +ATOM 31569 C CA . LYS F 1 385 ? -21.700 -35.578 34.973 1.00 38.86 ? 385 LYS F CA 1 +ATOM 31570 C C . LYS F 1 385 ? -23.093 -34.970 34.798 1.00 38.96 ? 385 LYS F C 1 +ATOM 31571 O O . LYS F 1 385 ? -24.074 -35.679 34.572 1.00 38.71 ? 385 LYS F O 1 +ATOM 31572 C CB . LYS F 1 385 ? -21.445 -35.937 36.440 1.00 41.08 ? 385 LYS F CB 1 +ATOM 31573 C CG . LYS F 1 385 ? -22.433 -36.908 37.060 1.00 46.15 ? 385 LYS F CG 1 +ATOM 31574 C CD . LYS F 1 385 ? -22.126 -37.080 38.552 1.00 51.82 ? 385 LYS F CD 1 +ATOM 31575 C CE . LYS F 1 385 ? -23.174 -37.950 39.256 1.00 53.94 ? 385 LYS F CE 1 +ATOM 31576 N NZ . LYS F 1 385 ? -23.233 -39.335 38.691 1.00 55.91 ? 385 LYS F NZ 1 +ATOM 31577 N N . GLY F 1 386 ? -23.168 -33.647 34.909 1.00 38.42 ? 386 GLY F N 1 +ATOM 31578 C CA . GLY F 1 386 ? -24.435 -32.963 34.755 1.00 37.31 ? 386 GLY F CA 1 +ATOM 31579 C C . GLY F 1 386 ? -24.945 -33.072 33.330 1.00 37.27 ? 386 GLY F C 1 +ATOM 31580 O O . GLY F 1 386 ? -26.152 -33.108 33.104 1.00 36.28 ? 386 GLY F O 1 +ATOM 31581 N N . PHE F 1 387 ? -24.025 -33.110 32.369 1.00 36.91 ? 387 PHE F N 1 +ATOM 31582 C CA . PHE F 1 387 ? -24.403 -33.234 30.973 1.00 38.49 ? 387 PHE F CA 1 +ATOM 31583 C C . PHE F 1 387 ? -24.928 -34.639 30.714 1.00 39.48 ? 387 PHE F C 1 +ATOM 31584 O O . PHE F 1 387 ? -25.909 -34.810 29.990 1.00 38.62 ? 387 PHE F O 1 +ATOM 31585 C CB . PHE F 1 387 ? -23.216 -32.937 30.044 1.00 37.73 ? 387 PHE F CB 1 +ATOM 31586 C CG . PHE F 1 387 ? -23.028 -31.473 29.743 1.00 36.43 ? 387 PHE F CG 1 +ATOM 31587 C CD1 . PHE F 1 387 ? -22.481 -30.613 30.692 1.00 34.92 ? 387 PHE F CD1 1 +ATOM 31588 C CD2 . PHE F 1 387 ? -23.433 -30.945 28.519 1.00 34.81 ? 387 PHE F CD2 1 +ATOM 31589 C CE1 . PHE F 1 387 ? -22.344 -29.247 30.424 1.00 34.13 ? 387 PHE F CE1 1 +ATOM 31590 C CE2 . PHE F 1 387 ? -23.302 -29.582 28.241 1.00 33.05 ? 387 PHE F CE2 1 +ATOM 31591 C CZ . PHE F 1 387 ? -22.760 -28.732 29.189 1.00 33.27 ? 387 PHE F CZ 1 +ATOM 31592 N N . ARG F 1 388 ? -24.272 -35.636 31.308 1.00 40.58 ? 388 ARG F N 1 +ATOM 31593 C CA . ARG F 1 388 ? -24.682 -37.033 31.166 1.00 42.64 ? 388 ARG F CA 1 +ATOM 31594 C C . ARG F 1 388 ? -26.089 -37.216 31.729 1.00 43.28 ? 388 ARG F C 1 +ATOM 31595 O O . ARG F 1 388 ? -26.936 -37.844 31.107 1.00 44.15 ? 388 ARG F O 1 +ATOM 31596 C CB . ARG F 1 388 ? -23.726 -37.958 31.917 1.00 42.83 ? 388 ARG F CB 1 +ATOM 31597 C CG . ARG F 1 388 ? -22.311 -37.989 31.383 1.00 44.88 ? 388 ARG F CG 1 +ATOM 31598 C CD . ARG F 1 388 ? -22.277 -38.376 29.924 1.00 47.79 ? 388 ARG F CD 1 +ATOM 31599 N NE . ARG F 1 388 ? -20.958 -38.867 29.527 1.00 51.34 ? 388 ARG F NE 1 +ATOM 31600 C CZ . ARG F 1 388 ? -20.502 -38.870 28.276 1.00 51.88 ? 388 ARG F CZ 1 +ATOM 31601 N NH1 . ARG F 1 388 ? -21.260 -38.401 27.293 1.00 52.35 ? 388 ARG F NH1 1 +ATOM 31602 N NH2 . ARG F 1 388 ? -19.285 -39.332 28.010 1.00 51.55 ? 388 ARG F NH2 1 +ATOM 31603 N N . THR F 1 389 ? -26.323 -36.662 32.914 1.00 44.08 ? 389 THR F N 1 +ATOM 31604 C CA . THR F 1 389 ? -27.619 -36.744 33.570 1.00 45.21 ? 389 THR F CA 1 +ATOM 31605 C C . THR F 1 389 ? -28.725 -36.193 32.675 1.00 45.44 ? 389 THR F C 1 +ATOM 31606 O O . THR F 1 389 ? -29.884 -36.571 32.807 1.00 44.95 ? 389 THR F O 1 +ATOM 31607 C CB . THR F 1 389 ? -27.613 -35.956 34.893 1.00 46.23 ? 389 THR F CB 1 +ATOM 31608 O OG1 . THR F 1 389 ? -26.667 -36.546 35.791 1.00 48.12 ? 389 THR F OG1 1 +ATOM 31609 C CG2 . THR F 1 389 ? -28.993 -35.960 35.532 1.00 45.36 ? 389 THR F CG2 1 +ATOM 31610 N N . SER F 1 390 ? -28.356 -35.293 31.771 1.00 45.99 ? 390 SER F N 1 +ATOM 31611 C CA . SER F 1 390 ? -29.311 -34.689 30.851 1.00 46.69 ? 390 SER F CA 1 +ATOM 31612 C C . SER F 1 390 ? -29.317 -35.407 29.505 1.00 47.26 ? 390 SER F C 1 +ATOM 31613 O O . SER F 1 390 ? -29.999 -34.985 28.571 1.00 45.57 ? 390 SER F O 1 +ATOM 31614 C CB . SER F 1 390 ? -28.970 -33.215 30.629 1.00 46.91 ? 390 SER F CB 1 +ATOM 31615 O OG . SER F 1 390 ? -29.173 -32.456 31.802 1.00 47.35 ? 390 SER F OG 1 +ATOM 31616 N N . HIS F 1 391 ? -28.552 -36.490 29.409 1.00 48.92 ? 391 HIS F N 1 +ATOM 31617 C CA . HIS F 1 391 ? -28.463 -37.253 28.166 1.00 51.86 ? 391 HIS F CA 1 +ATOM 31618 C C . HIS F 1 391 ? -28.077 -36.308 27.033 1.00 51.22 ? 391 HIS F C 1 +ATOM 31619 O O . HIS F 1 391 ? -28.588 -36.405 25.917 1.00 51.24 ? 391 HIS F O 1 +ATOM 31620 C CB . HIS F 1 391 ? -29.807 -37.922 27.851 1.00 54.56 ? 391 HIS F CB 1 +ATOM 31621 C CG . HIS F 1 391 ? -30.305 -38.811 28.946 1.00 57.77 ? 391 HIS F CG 1 +ATOM 31622 N ND1 . HIS F 1 391 ? -29.600 -39.910 29.387 1.00 59.27 ? 391 HIS F ND1 1 +ATOM 31623 C CD2 . HIS F 1 391 ? -31.420 -38.745 29.710 1.00 59.06 ? 391 HIS F CD2 1 +ATOM 31624 C CE1 . HIS F 1 391 ? -30.259 -40.483 30.378 1.00 60.47 ? 391 HIS F CE1 1 +ATOM 31625 N NE2 . HIS F 1 391 ? -31.367 -39.796 30.594 1.00 61.22 ? 391 HIS F NE2 1 +ATOM 31626 N N . ARG F 1 392 ? -27.169 -35.391 27.344 1.00 49.68 ? 392 ARG F N 1 +ATOM 31627 C CA . ARG F 1 392 ? -26.689 -34.412 26.389 1.00 47.90 ? 392 ARG F CA 1 +ATOM 31628 C C . ARG F 1 392 ? -25.399 -34.959 25.790 1.00 48.54 ? 392 ARG F C 1 +ATOM 31629 O O . ARG F 1 392 ? -24.404 -35.110 26.490 1.00 49.99 ? 392 ARG F O 1 +ATOM 31630 C CB . ARG F 1 392 ? -26.422 -33.099 27.119 1.00 47.27 ? 392 ARG F CB 1 +ATOM 31631 C CG . ARG F 1 392 ? -26.337 -31.893 26.235 1.00 45.33 ? 392 ARG F CG 1 +ATOM 31632 C CD . ARG F 1 392 ? -27.690 -31.570 25.655 1.00 42.95 ? 392 ARG F CD 1 +ATOM 31633 N NE . ARG F 1 392 ? -27.918 -30.133 25.677 1.00 43.23 ? 392 ARG F NE 1 +ATOM 31634 C CZ . ARG F 1 392 ? -28.649 -29.506 26.586 1.00 40.10 ? 392 ARG F CZ 1 +ATOM 31635 N NH1 . ARG F 1 392 ? -29.241 -30.174 27.551 1.00 43.02 ? 392 ARG F NH1 1 +ATOM 31636 N NH2 . ARG F 1 392 ? -28.780 -28.203 26.532 1.00 44.20 ? 392 ARG F NH2 1 +ATOM 31637 N N . ASN F 1 393 ? -25.412 -35.264 24.498 1.00 49.06 ? 393 ASN F N 1 +ATOM 31638 C CA . ASN F 1 393 ? -24.229 -35.810 23.845 1.00 49.88 ? 393 ASN F CA 1 +ATOM 31639 C C . ASN F 1 393 ? -23.227 -34.738 23.447 1.00 48.74 ? 393 ASN F C 1 +ATOM 31640 O O . ASN F 1 393 ? -22.020 -34.984 23.444 1.00 48.68 ? 393 ASN F O 1 +ATOM 31641 C CB . ASN F 1 393 ? -24.638 -36.616 22.618 1.00 53.90 ? 393 ASN F CB 1 +ATOM 31642 C CG . ASN F 1 393 ? -25.653 -37.695 22.953 1.00 58.77 ? 393 ASN F CG 1 +ATOM 31643 O OD1 . ASN F 1 393 ? -25.393 -38.581 23.782 1.00 59.43 ? 393 ASN F OD1 1 +ATOM 31644 N ND2 . ASN F 1 393 ? -26.825 -37.621 22.319 1.00 60.04 ? 393 ASN F ND2 1 +ATOM 31645 N N . GLU F 1 394 ? -23.728 -33.557 23.094 1.00 46.49 ? 394 GLU F N 1 +ATOM 31646 C CA . GLU F 1 394 ? -22.857 -32.449 22.723 1.00 44.24 ? 394 GLU F CA 1 +ATOM 31647 C C . GLU F 1 394 ? -22.515 -31.714 24.008 1.00 41.72 ? 394 GLU F C 1 +ATOM 31648 O O . GLU F 1 394 ? -23.319 -30.963 24.556 1.00 41.21 ? 394 GLU F O 1 +ATOM 31649 C CB . GLU F 1 394 ? -23.557 -31.506 21.742 1.00 46.17 ? 394 GLU F CB 1 +ATOM 31650 C CG . GLU F 1 394 ? -24.122 -32.207 20.524 1.00 49.26 ? 394 GLU F CG 1 +ATOM 31651 C CD . GLU F 1 394 ? -24.424 -31.254 19.384 1.00 52.04 ? 394 GLU F CD 1 +ATOM 31652 O OE1 . GLU F 1 394 ? -25.017 -30.176 19.625 1.00 53.70 ? 394 GLU F OE1 1 +ATOM 31653 O OE2 . GLU F 1 394 ? -24.070 -31.594 18.236 1.00 53.62 ? 394 GLU F OE2 1 +ATOM 31654 N N . ILE F 1 395 ? -21.309 -31.950 24.496 1.00 40.54 ? 395 ILE F N 1 +ATOM 31655 C CA . ILE F 1 395 ? -20.864 -31.337 25.734 1.00 38.17 ? 395 ILE F CA 1 +ATOM 31656 C C . ILE F 1 395 ? -19.890 -30.186 25.517 1.00 36.42 ? 395 ILE F C 1 +ATOM 31657 O O . ILE F 1 395 ? -18.965 -30.276 24.704 1.00 35.31 ? 395 ILE F O 1 +ATOM 31658 C CB . ILE F 1 395 ? -20.195 -32.394 26.631 1.00 38.26 ? 395 ILE F CB 1 +ATOM 31659 C CG1 . ILE F 1 395 ? -21.203 -33.512 26.925 1.00 38.39 ? 395 ILE F CG1 1 +ATOM 31660 C CG2 . ILE F 1 395 ? -19.679 -31.754 27.915 1.00 37.30 ? 395 ILE F CG2 1 +ATOM 31661 C CD1 . ILE F 1 395 ? -20.639 -34.676 27.718 1.00 37.06 ? 395 ILE F CD1 1 +ATOM 31662 N N . PHE F 1 396 ? -20.126 -29.087 26.222 1.00 33.96 ? 396 PHE F N 1 +ATOM 31663 C CA . PHE F 1 396 ? -19.221 -27.954 26.157 1.00 33.28 ? 396 PHE F CA 1 +ATOM 31664 C C . PHE F 1 396 ? -18.999 -27.373 27.547 1.00 31.77 ? 396 PHE F C 1 +ATOM 31665 O O . PHE F 1 396 ? -19.926 -26.881 28.190 1.00 30.59 ? 396 PHE F O 1 +ATOM 31666 C CB . PHE F 1 396 ? -19.723 -26.843 25.238 1.00 33.83 ? 396 PHE F CB 1 +ATOM 31667 C CG . PHE F 1 396 ? -18.782 -25.679 25.170 1.00 35.48 ? 396 PHE F CG 1 +ATOM 31668 C CD1 . PHE F 1 396 ? -17.589 -25.777 24.457 1.00 36.79 ? 396 PHE F CD1 1 +ATOM 31669 C CD2 . PHE F 1 396 ? -19.011 -24.536 25.932 1.00 36.00 ? 396 PHE F CD2 1 +ATOM 31670 C CE1 . PHE F 1 396 ? -16.632 -24.756 24.510 1.00 36.64 ? 396 PHE F CE1 1 +ATOM 31671 C CE2 . PHE F 1 396 ? -18.063 -23.515 25.993 1.00 35.81 ? 396 PHE F CE2 1 +ATOM 31672 C CZ . PHE F 1 396 ? -16.869 -23.627 25.280 1.00 37.29 ? 396 PHE F CZ 1 +ATOM 31673 N N . ILE F 1 397 ? -17.759 -27.442 28.009 1.00 31.44 ? 397 ILE F N 1 +ATOM 31674 C CA . ILE F 1 397 ? -17.408 -26.902 29.318 1.00 30.25 ? 397 ILE F CA 1 +ATOM 31675 C C . ILE F 1 397 ? -16.107 -26.139 29.198 1.00 29.96 ? 397 ILE F C 1 +ATOM 31676 O O . ILE F 1 397 ? -15.136 -26.629 28.619 1.00 28.32 ? 397 ILE F O 1 +ATOM 31677 C CB . ILE F 1 397 ? -17.249 -28.006 30.371 1.00 29.41 ? 397 ILE F CB 1 +ATOM 31678 C CG1 . ILE F 1 397 ? -18.568 -28.778 30.503 1.00 29.62 ? 397 ILE F CG1 1 +ATOM 31679 C CG2 . ILE F 1 397 ? -16.865 -27.400 31.710 1.00 27.74 ? 397 ILE F CG2 1 +ATOM 31680 C CD1 . ILE F 1 397 ? -18.480 -29.980 31.433 1.00 29.13 ? 397 ILE F CD1 1 +ATOM 31681 N N . LEU F 1 398 ? -16.117 -24.914 29.720 1.00 30.64 ? 398 LEU F N 1 +ATOM 31682 C CA . LEU F 1 398 ? -14.953 -24.036 29.695 1.00 29.92 ? 398 LEU F CA 1 +ATOM 31683 C C . LEU F 1 398 ? -14.569 -23.847 31.158 1.00 30.32 ? 398 LEU F C 1 +ATOM 31684 O O . LEU F 1 398 ? -15.435 -23.611 32.006 1.00 29.07 ? 398 LEU F O 1 +ATOM 31685 C CB . LEU F 1 398 ? -15.331 -22.679 29.102 1.00 30.12 ? 398 LEU F CB 1 +ATOM 31686 C CG . LEU F 1 398 ? -14.369 -21.888 28.204 1.00 34.08 ? 398 LEU F CG 1 +ATOM 31687 C CD1 . LEU F 1 398 ? -14.673 -20.394 28.379 1.00 31.66 ? 398 LEU F CD1 1 +ATOM 31688 C CD2 . LEU F 1 398 ? -12.907 -22.171 28.543 1.00 35.11 ? 398 LEU F CD2 1 +ATOM 31689 N N . SER F 1 399 ? -13.283 -23.964 31.463 1.00 29.88 ? 399 SER F N 1 +ATOM 31690 C CA . SER F 1 399 ? -12.826 -23.781 32.835 1.00 29.12 ? 399 SER F CA 1 +ATOM 31691 C C . SER F 1 399 ? -11.630 -22.843 32.851 1.00 28.94 ? 399 SER F C 1 +ATOM 31692 O O . SER F 1 399 ? -10.861 -22.795 31.892 1.00 29.15 ? 399 SER F O 1 +ATOM 31693 C CB . SER F 1 399 ? -12.428 -25.116 33.448 1.00 28.67 ? 399 SER F CB 1 +ATOM 31694 O OG . SER F 1 399 ? -12.016 -24.944 34.795 1.00 29.67 ? 399 SER F OG 1 +ATOM 31695 N N . ARG F 1 400 ? -11.483 -22.080 33.928 1.00 28.87 ? 400 ARG F N 1 +ATOM 31696 C CA . ARG F 1 400 ? -10.353 -21.175 34.025 1.00 29.32 ? 400 ARG F CA 1 +ATOM 31697 C C . ARG F 1 400 ? -9.179 -21.880 34.674 1.00 28.17 ? 400 ARG F C 1 +ATOM 31698 O O . ARG F 1 400 ? -8.053 -21.786 34.197 1.00 27.91 ? 400 ARG F O 1 +ATOM 31699 C CB . ARG F 1 400 ? -10.711 -19.927 34.833 1.00 30.71 ? 400 ARG F CB 1 +ATOM 31700 C CG . ARG F 1 400 ? -9.684 -18.824 34.669 1.00 29.81 ? 400 ARG F CG 1 +ATOM 31701 C CD . ARG F 1 400 ? -10.179 -17.502 35.199 1.00 33.14 ? 400 ARG F CD 1 +ATOM 31702 N NE . ARG F 1 400 ? -10.153 -17.452 36.658 1.00 36.43 ? 400 ARG F NE 1 +ATOM 31703 C CZ . ARG F 1 400 ? -10.333 -16.342 37.366 1.00 35.57 ? 400 ARG F CZ 1 +ATOM 31704 N NH1 . ARG F 1 400 ? -10.556 -15.192 36.743 1.00 34.93 ? 400 ARG F NH1 1 +ATOM 31705 N NH2 . ARG F 1 400 ? -10.278 -16.380 38.690 1.00 34.62 ? 400 ARG F NH2 1 +ATOM 31706 N N . ALA F 1 401 ? -9.445 -22.588 35.764 1.00 27.74 ? 401 ALA F N 1 +ATOM 31707 C CA . ALA F 1 401 ? -8.390 -23.308 36.463 1.00 29.86 ? 401 ALA F CA 1 +ATOM 31708 C C . ALA F 1 401 ? -8.385 -24.794 36.076 1.00 30.83 ? 401 ALA F C 1 +ATOM 31709 O O . ALA F 1 401 ? -9.278 -25.274 35.377 1.00 30.05 ? 401 ALA F O 1 +ATOM 31710 C CB . ALA F 1 401 ? -8.570 -23.154 37.966 1.00 29.20 ? 401 ALA F CB 1 +ATOM 31711 N N . GLY F 1 402 ? -7.374 -25.519 36.538 1.00 31.98 ? 402 GLY F N 1 +ATOM 31712 C CA . GLY F 1 402 ? -7.296 -26.930 36.220 1.00 31.97 ? 402 GLY F CA 1 +ATOM 31713 C C . GLY F 1 402 ? -6.145 -27.647 36.898 1.00 31.59 ? 402 GLY F C 1 +ATOM 31714 O O . GLY F 1 402 ? -5.309 -27.042 37.574 1.00 29.80 ? 402 GLY F O 1 +ATOM 31715 N N . TYR F 1 403 ? -6.118 -28.959 36.698 1.00 31.30 ? 403 TYR F N 1 +ATOM 31716 C CA . TYR F 1 403 ? -5.095 -29.831 37.249 1.00 30.77 ? 403 TYR F CA 1 +ATOM 31717 C C . TYR F 1 403 ? -4.991 -30.976 36.250 1.00 30.96 ? 403 TYR F C 1 +ATOM 31718 O O . TYR F 1 403 ? -5.810 -31.069 35.344 1.00 30.20 ? 403 TYR F O 1 +ATOM 31719 C CB . TYR F 1 403 ? -5.543 -30.360 38.613 1.00 29.31 ? 403 TYR F CB 1 +ATOM 31720 C CG . TYR F 1 403 ? -4.575 -31.317 39.247 1.00 29.61 ? 403 TYR F CG 1 +ATOM 31721 C CD1 . TYR F 1 403 ? -3.310 -30.890 39.655 1.00 30.59 ? 403 TYR F CD1 1 +ATOM 31722 C CD2 . TYR F 1 403 ? -4.912 -32.660 39.429 1.00 29.42 ? 403 TYR F CD2 1 +ATOM 31723 C CE1 . TYR F 1 403 ? -2.402 -31.778 40.232 1.00 30.23 ? 403 TYR F CE1 1 +ATOM 31724 C CE2 . TYR F 1 403 ? -4.022 -33.554 39.999 1.00 29.32 ? 403 TYR F CE2 1 +ATOM 31725 C CZ . TYR F 1 403 ? -2.767 -33.109 40.400 1.00 31.25 ? 403 TYR F CZ 1 +ATOM 31726 O OH . TYR F 1 403 ? -1.884 -33.992 40.967 1.00 29.18 ? 403 TYR F OH 1 +ATOM 31727 N N . ALA F 1 404 ? -3.981 -31.831 36.399 1.00 31.85 ? 404 ALA F N 1 +ATOM 31728 C CA . ALA F 1 404 ? -3.821 -32.977 35.506 1.00 31.88 ? 404 ALA F CA 1 +ATOM 31729 C C . ALA F 1 404 ? -5.154 -33.731 35.412 1.00 31.58 ? 404 ALA F C 1 +ATOM 31730 O O . ALA F 1 404 ? -5.790 -34.013 36.428 1.00 30.79 ? 404 ALA F O 1 +ATOM 31731 C CB . ALA F 1 404 ? -2.738 -33.901 36.037 1.00 29.55 ? 404 ALA F CB 1 +ATOM 31732 N N . GLY F 1 405 ? -5.579 -34.045 34.193 1.00 31.65 ? 405 GLY F N 1 +ATOM 31733 C CA . GLY F 1 405 ? -6.836 -34.751 34.025 1.00 31.85 ? 405 GLY F CA 1 +ATOM 31734 C C . GLY F 1 405 ? -7.995 -33.849 33.641 1.00 31.92 ? 405 GLY F C 1 +ATOM 31735 O O . GLY F 1 405 ? -9.051 -34.326 33.217 1.00 29.81 ? 405 GLY F O 1 +ATOM 31736 N N . ILE F 1 406 ? -7.807 -32.540 33.792 1.00 32.24 ? 406 ILE F N 1 +ATOM 31737 C CA . ILE F 1 406 ? -8.856 -31.585 33.452 1.00 32.30 ? 406 ILE F CA 1 +ATOM 31738 C C . ILE F 1 406 ? -9.276 -31.759 31.982 1.00 31.92 ? 406 ILE F C 1 +ATOM 31739 O O . ILE F 1 406 ? -10.418 -31.471 31.628 1.00 31.96 ? 406 ILE F O 1 +ATOM 31740 C CB . ILE F 1 406 ? -8.396 -30.111 33.705 1.00 31.38 ? 406 ILE F CB 1 +ATOM 31741 C CG1 . ILE F 1 406 ? -9.572 -29.150 33.555 1.00 32.83 ? 406 ILE F CG1 1 +ATOM 31742 C CG2 . ILE F 1 406 ? -7.315 -29.716 32.729 1.00 30.39 ? 406 ILE F CG2 1 +ATOM 31743 C CD1 . ILE F 1 406 ? -10.620 -29.275 34.636 1.00 29.06 ? 406 ILE F CD1 1 +ATOM 31744 N N . GLN F 1 407 ? -8.370 -32.261 31.143 1.00 30.46 ? 407 GLN F N 1 +ATOM 31745 C CA . GLN F 1 407 ? -8.680 -32.453 29.729 1.00 30.85 ? 407 GLN F CA 1 +ATOM 31746 C C . GLN F 1 407 ? -9.832 -33.432 29.506 1.00 30.71 ? 407 GLN F C 1 +ATOM 31747 O O . GLN F 1 407 ? -10.426 -33.447 28.443 1.00 32.28 ? 407 GLN F O 1 +ATOM 31748 C CB . GLN F 1 407 ? -7.439 -32.908 28.933 1.00 30.68 ? 407 GLN F CB 1 +ATOM 31749 C CG . GLN F 1 407 ? -6.945 -34.318 29.221 1.00 33.50 ? 407 GLN F CG 1 +ATOM 31750 C CD . GLN F 1 407 ? -6.061 -34.412 30.463 1.00 34.95 ? 407 GLN F CD 1 +ATOM 31751 O OE1 . GLN F 1 407 ? -5.891 -33.441 31.200 1.00 36.64 ? 407 GLN F OE1 1 +ATOM 31752 N NE2 . GLN F 1 407 ? -5.501 -35.592 30.696 1.00 33.94 ? 407 GLN F NE2 1 +ATOM 31753 N N . ARG F 1 408 ? -10.147 -34.249 30.501 1.00 31.12 ? 408 ARG F N 1 +ATOM 31754 C CA . ARG F 1 408 ? -11.255 -35.194 30.373 1.00 32.74 ? 408 ARG F CA 1 +ATOM 31755 C C . ARG F 1 408 ? -12.585 -34.447 30.276 1.00 33.29 ? 408 ARG F C 1 +ATOM 31756 O O . ARG F 1 408 ? -13.533 -34.933 29.674 1.00 31.82 ? 408 ARG F O 1 +ATOM 31757 C CB . ARG F 1 408 ? -11.420 -36.079 31.615 1.00 32.02 ? 408 ARG F CB 1 +ATOM 31758 C CG . ARG F 1 408 ? -10.281 -36.947 32.054 1.00 33.52 ? 408 ARG F CG 1 +ATOM 31759 C CD . ARG F 1 408 ? -10.653 -37.492 33.434 1.00 33.14 ? 408 ARG F CD 1 +ATOM 31760 N NE . ARG F 1 408 ? -9.677 -38.436 33.967 1.00 35.02 ? 408 ARG F NE 1 +ATOM 31761 C CZ . ARG F 1 408 ? -9.811 -39.075 35.126 1.00 34.83 ? 408 ARG F CZ 1 +ATOM 31762 N NH1 . ARG F 1 408 ? -10.882 -38.880 35.893 1.00 32.01 ? 408 ARG F NH1 1 +ATOM 31763 N NH2 . ARG F 1 408 ? -8.864 -39.911 35.517 1.00 36.38 ? 408 ARG F NH2 1 +ATOM 31764 N N . TYR F 1 409 ? -12.655 -33.272 30.893 1.00 33.45 ? 409 TYR F N 1 +ATOM 31765 C CA . TYR F 1 409 ? -13.916 -32.571 30.963 1.00 32.76 ? 409 TYR F CA 1 +ATOM 31766 C C . TYR F 1 409 ? -14.065 -31.177 30.408 1.00 32.45 ? 409 TYR F C 1 +ATOM 31767 O O . TYR F 1 409 ? -15.200 -30.727 30.231 1.00 32.53 ? 409 TYR F O 1 +ATOM 31768 C CB . TYR F 1 409 ? -14.364 -32.521 32.419 1.00 32.98 ? 409 TYR F CB 1 +ATOM 31769 C CG . TYR F 1 409 ? -14.122 -33.795 33.194 1.00 33.76 ? 409 TYR F CG 1 +ATOM 31770 C CD1 . TYR F 1 409 ? -14.823 -34.968 32.898 1.00 33.83 ? 409 TYR F CD1 1 +ATOM 31771 C CD2 . TYR F 1 409 ? -13.188 -33.829 34.227 1.00 34.45 ? 409 TYR F CD2 1 +ATOM 31772 C CE1 . TYR F 1 409 ? -14.596 -36.139 33.611 1.00 32.81 ? 409 TYR F CE1 1 +ATOM 31773 C CE2 . TYR F 1 409 ? -12.948 -34.990 34.952 1.00 33.31 ? 409 TYR F CE2 1 +ATOM 31774 C CZ . TYR F 1 409 ? -13.652 -36.144 34.640 1.00 36.28 ? 409 TYR F CZ 1 +ATOM 31775 O OH . TYR F 1 409 ? -13.396 -37.297 35.352 1.00 35.09 ? 409 TYR F OH 1 +ATOM 31776 N N . ALA F 1 410 ? -12.974 -30.477 30.125 1.00 31.46 ? 410 ALA F N 1 +ATOM 31777 C CA . ALA F 1 410 ? -13.168 -29.117 29.660 1.00 31.14 ? 410 ALA F CA 1 +ATOM 31778 C C . ALA F 1 410 ? -12.110 -28.449 28.813 1.00 31.18 ? 410 ALA F C 1 +ATOM 31779 O O . ALA F 1 410 ? -10.979 -28.924 28.693 1.00 31.09 ? 410 ALA F O 1 +ATOM 31780 C CB . ALA F 1 410 ? -13.470 -28.233 30.868 1.00 29.30 ? 410 ALA F CB 1 +ATOM 31781 N N . PHE F 1 411 ? -12.530 -27.338 28.210 1.00 32.06 ? 411 PHE F N 1 +ATOM 31782 C CA . PHE F 1 411 ? -11.667 -26.476 27.411 1.00 32.16 ? 411 PHE F CA 1 +ATOM 31783 C C . PHE F 1 411 ? -11.083 -25.553 28.474 1.00 31.94 ? 411 PHE F C 1 +ATOM 31784 O O . PHE F 1 411 ? -11.672 -25.377 29.544 1.00 29.54 ? 411 PHE F O 1 +ATOM 31785 C CB . PHE F 1 411 ? -12.479 -25.576 26.475 1.00 33.08 ? 411 PHE F CB 1 +ATOM 31786 C CG . PHE F 1 411 ? -12.834 -26.187 25.157 1.00 36.14 ? 411 PHE F CG 1 +ATOM 31787 C CD1 . PHE F 1 411 ? -13.535 -27.381 25.081 1.00 35.38 ? 411 PHE F CD1 1 +ATOM 31788 C CD2 . PHE F 1 411 ? -12.515 -25.520 23.976 1.00 38.00 ? 411 PHE F CD2 1 +ATOM 31789 C CE1 . PHE F 1 411 ? -13.912 -27.897 23.850 1.00 36.57 ? 411 PHE F CE1 1 +ATOM 31790 C CE2 . PHE F 1 411 ? -12.892 -26.033 22.740 1.00 36.79 ? 411 PHE F CE2 1 +ATOM 31791 C CZ . PHE F 1 411 ? -13.591 -27.221 22.677 1.00 35.98 ? 411 PHE F CZ 1 +ATOM 31792 N N . ILE F 1 412 ? -9.937 -24.956 28.182 1.00 33.40 ? 412 ILE F N 1 +ATOM 31793 C CA . ILE F 1 412 ? -9.347 -24.005 29.108 1.00 33.50 ? 412 ILE F CA 1 +ATOM 31794 C C . ILE F 1 412 ? -8.943 -22.779 28.320 1.00 32.69 ? 412 ILE F C 1 +ATOM 31795 O O . ILE F 1 412 ? -8.368 -22.897 27.242 1.00 32.91 ? 412 ILE F O 1 +ATOM 31796 C CB . ILE F 1 412 ? -8.113 -24.596 29.824 1.00 35.30 ? 412 ILE F CB 1 +ATOM 31797 C CG1 . ILE F 1 412 ? -8.572 -25.619 30.864 1.00 34.74 ? 412 ILE F CG1 1 +ATOM 31798 C CG2 . ILE F 1 412 ? -7.298 -23.489 30.488 1.00 33.32 ? 412 ILE F CG2 1 +ATOM 31799 C CD1 . ILE F 1 412 ? -7.465 -26.131 31.732 1.00 38.41 ? 412 ILE F CD1 1 +ATOM 31800 N N . TRP F 1 413 ? -9.285 -21.600 28.828 1.00 32.85 ? 413 TRP F N 1 +ATOM 31801 C CA . TRP F 1 413 ? -8.884 -20.365 28.163 1.00 32.40 ? 413 TRP F CA 1 +ATOM 31802 C C . TRP F 1 413 ? -7.941 -19.670 29.155 1.00 32.02 ? 413 TRP F C 1 +ATOM 31803 O O . TRP F 1 413 ? -8.016 -19.906 30.365 1.00 30.91 ? 413 TRP F O 1 +ATOM 31804 C CB . TRP F 1 413 ? -10.113 -19.519 27.792 1.00 32.50 ? 413 TRP F CB 1 +ATOM 31805 C CG . TRP F 1 413 ? -10.455 -18.405 28.716 1.00 33.45 ? 413 TRP F CG 1 +ATOM 31806 C CD1 . TRP F 1 413 ? -10.144 -17.082 28.562 1.00 32.24 ? 413 TRP F CD1 1 +ATOM 31807 C CD2 . TRP F 1 413 ? -11.196 -18.507 29.933 1.00 33.42 ? 413 TRP F CD2 1 +ATOM 31808 N NE1 . TRP F 1 413 ? -10.652 -16.353 29.612 1.00 33.49 ? 413 TRP F NE1 1 +ATOM 31809 C CE2 . TRP F 1 413 ? -11.300 -17.204 30.469 1.00 33.87 ? 413 TRP F CE2 1 +ATOM 31810 C CE3 . TRP F 1 413 ? -11.784 -19.574 30.625 1.00 34.97 ? 413 TRP F CE3 1 +ATOM 31811 C CZ2 . TRP F 1 413 ? -11.969 -16.940 31.670 1.00 35.08 ? 413 TRP F CZ2 1 +ATOM 31812 C CZ3 . TRP F 1 413 ? -12.453 -19.308 31.825 1.00 34.17 ? 413 TRP F CZ3 1 +ATOM 31813 C CH2 . TRP F 1 413 ? -12.538 -18.004 32.331 1.00 32.93 ? 413 TRP F CH2 1 +ATOM 31814 N N . THR F 1 414 ? -7.053 -18.834 28.639 1.00 31.37 ? 414 THR F N 1 +ATOM 31815 C CA . THR F 1 414 ? -6.048 -18.167 29.455 1.00 30.84 ? 414 THR F CA 1 +ATOM 31816 C C . THR F 1 414 ? -6.432 -16.995 30.353 1.00 32.19 ? 414 THR F C 1 +ATOM 31817 O O . THR F 1 414 ? -5.579 -16.179 30.690 1.00 33.24 ? 414 THR F O 1 +ATOM 31818 C CB . THR F 1 414 ? -4.879 -17.728 28.580 1.00 30.00 ? 414 THR F CB 1 +ATOM 31819 O OG1 . THR F 1 414 ? -5.347 -16.797 27.598 1.00 30.84 ? 414 THR F OG1 1 +ATOM 31820 C CG2 . THR F 1 414 ? -4.267 -18.932 27.880 1.00 27.59 ? 414 THR F CG2 1 +ATOM 31821 N N . GLY F 1 415 ? -7.701 -16.892 30.730 1.00 31.53 ? 415 GLY F N 1 +ATOM 31822 C CA . GLY F 1 415 ? -8.095 -15.827 31.632 1.00 33.12 ? 415 GLY F CA 1 +ATOM 31823 C C . GLY F 1 415 ? -8.036 -14.372 31.193 1.00 36.05 ? 415 GLY F C 1 +ATOM 31824 O O . GLY F 1 415 ? -8.164 -14.050 30.008 1.00 36.13 ? 415 GLY F O 1 +ATOM 31825 N N . ASP F 1 416 ? -7.828 -13.491 32.173 1.00 36.62 ? 416 ASP F N 1 +ATOM 31826 C CA . ASP F 1 416 ? -7.815 -12.045 31.965 1.00 35.36 ? 416 ASP F CA 1 +ATOM 31827 C C . ASP F 1 416 ? -6.573 -11.398 31.359 1.00 34.91 ? 416 ASP F C 1 +ATOM 31828 O O . ASP F 1 416 ? -5.849 -10.673 32.047 1.00 35.50 ? 416 ASP F O 1 +ATOM 31829 C CB . ASP F 1 416 ? -8.135 -11.355 33.292 1.00 36.98 ? 416 ASP F CB 1 +ATOM 31830 C CG . ASP F 1 416 ? -9.439 -11.862 33.930 1.00 41.32 ? 416 ASP F CG 1 +ATOM 31831 O OD1 . ASP F 1 416 ? -10.294 -12.459 33.225 1.00 41.02 ? 416 ASP F OD1 1 +ATOM 31832 O OD2 . ASP F 1 416 ? -9.618 -11.649 35.150 1.00 42.46 ? 416 ASP F OD2 1 +ATOM 31833 N N . ASN F 1 417 ? -6.339 -11.618 30.070 1.00 32.26 ? 417 ASN F N 1 +ATOM 31834 C CA . ASN F 1 417 ? -5.173 -11.039 29.423 1.00 32.07 ? 417 ASN F CA 1 +ATOM 31835 C C . ASN F 1 417 ? -5.357 -9.541 29.118 1.00 33.32 ? 417 ASN F C 1 +ATOM 31836 O O . ASN F 1 417 ? -6.479 -9.013 29.132 1.00 31.05 ? 417 ASN F O 1 +ATOM 31837 C CB . ASN F 1 417 ? -4.840 -11.824 28.150 1.00 31.46 ? 417 ASN F CB 1 +ATOM 31838 C CG . ASN F 1 417 ? -5.937 -11.740 27.096 1.00 34.40 ? 417 ASN F CG 1 +ATOM 31839 O OD1 . ASN F 1 417 ? -7.134 -11.692 27.409 1.00 34.43 ? 417 ASN F OD1 1 +ATOM 31840 N ND2 . ASN F 1 417 ? -5.529 -11.739 25.835 1.00 32.96 ? 417 ASN F ND2 1 +ATOM 31841 N N . THR F 1 418 ? -4.238 -8.868 28.862 1.00 32.34 ? 418 THR F N 1 +ATOM 31842 C CA . THR F 1 418 ? -4.217 -7.442 28.572 1.00 32.77 ? 418 THR F CA 1 +ATOM 31843 C C . THR F 1 418 ? -3.861 -7.191 27.109 1.00 32.82 ? 418 THR F C 1 +ATOM 31844 O O . THR F 1 418 ? -2.847 -7.676 26.615 1.00 33.96 ? 418 THR F O 1 +ATOM 31845 C CB . THR F 1 418 ? -3.161 -6.701 29.451 1.00 32.47 ? 418 THR F CB 1 +ATOM 31846 O OG1 . THR F 1 418 ? -3.524 -6.803 30.834 1.00 33.75 ? 418 THR F OG1 1 +ATOM 31847 C CG2 . THR F 1 418 ? -3.067 -5.236 29.063 1.00 29.49 ? 418 THR F CG2 1 +ATOM 31848 N N . PRO F 1 419 ? -4.682 -6.406 26.401 1.00 32.25 ? 419 PRO F N 1 +ATOM 31849 C CA . PRO F 1 419 ? -4.407 -6.115 24.991 1.00 32.08 ? 419 PRO F CA 1 +ATOM 31850 C C . PRO F 1 419 ? -3.104 -5.340 24.828 1.00 31.59 ? 419 PRO F C 1 +ATOM 31851 O O . PRO F 1 419 ? -2.946 -4.264 25.398 1.00 31.15 ? 419 PRO F O 1 +ATOM 31852 C CB . PRO F 1 419 ? -5.606 -5.262 24.567 1.00 30.86 ? 419 PRO F CB 1 +ATOM 31853 C CG . PRO F 1 419 ? -6.667 -5.602 25.567 1.00 31.68 ? 419 PRO F CG 1 +ATOM 31854 C CD . PRO F 1 419 ? -5.922 -5.746 26.846 1.00 30.82 ? 419 PRO F CD 1 +ATOM 31855 N N . SER F 1 420 ? -2.179 -5.884 24.054 1.00 31.67 ? 420 SER F N 1 +ATOM 31856 C CA . SER F 1 420 ? -0.909 -5.215 23.796 1.00 33.61 ? 420 SER F CA 1 +ATOM 31857 C C . SER F 1 420 ? -0.123 -6.063 22.820 1.00 34.62 ? 420 SER F C 1 +ATOM 31858 O O . SER F 1 420 ? -0.371 -7.263 22.693 1.00 35.35 ? 420 SER F O 1 +ATOM 31859 C CB . SER F 1 420 ? -0.100 -5.045 25.077 1.00 33.15 ? 420 SER F CB 1 +ATOM 31860 O OG . SER F 1 420 ? 0.579 -6.238 25.397 1.00 36.46 ? 420 SER F OG 1 +ATOM 31861 N N . TRP F 1 421 ? 0.825 -5.448 22.127 1.00 34.85 ? 421 TRP F N 1 +ATOM 31862 C CA . TRP F 1 421 ? 1.622 -6.196 21.173 1.00 36.36 ? 421 TRP F CA 1 +ATOM 31863 C C . TRP F 1 421 ? 2.418 -7.301 21.837 1.00 37.42 ? 421 TRP F C 1 +ATOM 31864 O O . TRP F 1 421 ? 2.565 -8.384 21.274 1.00 39.09 ? 421 TRP F O 1 +ATOM 31865 C CB . TRP F 1 421 ? 2.531 -5.258 20.382 1.00 34.85 ? 421 TRP F CB 1 +ATOM 31866 C CG . TRP F 1 421 ? 1.737 -4.423 19.434 1.00 34.72 ? 421 TRP F CG 1 +ATOM 31867 C CD1 . TRP F 1 421 ? 1.222 -3.183 19.667 1.00 34.00 ? 421 TRP F CD1 1 +ATOM 31868 C CD2 . TRP F 1 421 ? 1.292 -4.802 18.123 1.00 33.86 ? 421 TRP F CD2 1 +ATOM 31869 N NE1 . TRP F 1 421 ? 0.482 -2.763 18.587 1.00 33.18 ? 421 TRP F NE1 1 +ATOM 31870 C CE2 . TRP F 1 421 ? 0.509 -3.735 17.623 1.00 34.33 ? 421 TRP F CE2 1 +ATOM 31871 C CE3 . TRP F 1 421 ? 1.479 -5.935 17.324 1.00 33.59 ? 421 TRP F CE3 1 +ATOM 31872 C CZ2 . TRP F 1 421 ? -0.087 -3.768 16.353 1.00 35.51 ? 421 TRP F CZ2 1 +ATOM 31873 C CZ3 . TRP F 1 421 ? 0.886 -5.971 16.059 1.00 34.90 ? 421 TRP F CZ3 1 +ATOM 31874 C CH2 . TRP F 1 421 ? 0.113 -4.892 15.588 1.00 36.04 ? 421 TRP F CH2 1 +ATOM 31875 N N . ASP F 1 422 ? 2.921 -7.048 23.037 1.00 39.36 ? 422 ASP F N 1 +ATOM 31876 C CA . ASP F 1 422 ? 3.670 -8.078 23.741 1.00 41.14 ? 422 ASP F CA 1 +ATOM 31877 C C . ASP F 1 422 ? 2.768 -9.251 24.128 1.00 39.46 ? 422 ASP F C 1 +ATOM 31878 O O . ASP F 1 422 ? 3.213 -10.398 24.156 1.00 38.63 ? 422 ASP F O 1 +ATOM 31879 C CB . ASP F 1 422 ? 4.333 -7.510 24.999 1.00 45.19 ? 422 ASP F CB 1 +ATOM 31880 C CG . ASP F 1 422 ? 5.379 -6.457 24.682 1.00 50.60 ? 422 ASP F CG 1 +ATOM 31881 O OD1 . ASP F 1 422 ? 6.101 -6.620 23.673 1.00 53.63 ? 422 ASP F OD1 1 +ATOM 31882 O OD2 . ASP F 1 422 ? 5.487 -5.470 25.446 1.00 53.96 ? 422 ASP F OD2 1 +ATOM 31883 N N . ASP F 1 423 ? 1.501 -8.969 24.417 1.00 37.79 ? 423 ASP F N 1 +ATOM 31884 C CA . ASP F 1 423 ? 0.590 -10.032 24.801 1.00 37.30 ? 423 ASP F CA 1 +ATOM 31885 C C . ASP F 1 423 ? 0.412 -11.072 23.697 1.00 36.10 ? 423 ASP F C 1 +ATOM 31886 O O . ASP F 1 423 ? 0.072 -12.219 23.978 1.00 36.28 ? 423 ASP F O 1 +ATOM 31887 C CB . ASP F 1 423 ? -0.770 -9.464 25.215 1.00 39.13 ? 423 ASP F CB 1 +ATOM 31888 C CG . ASP F 1 423 ? -1.703 -10.536 25.810 1.00 43.02 ? 423 ASP F CG 1 +ATOM 31889 O OD1 . ASP F 1 423 ? -1.301 -11.208 26.797 1.00 43.41 ? 423 ASP F OD1 1 +ATOM 31890 O OD2 . ASP F 1 423 ? -2.838 -10.705 25.298 1.00 42.15 ? 423 ASP F OD2 1 +ATOM 31891 N N . LEU F 1 424 ? 0.638 -10.683 22.445 1.00 35.29 ? 424 LEU F N 1 +ATOM 31892 C CA . LEU F 1 424 ? 0.498 -11.635 21.350 1.00 36.23 ? 424 LEU F CA 1 +ATOM 31893 C C . LEU F 1 424 ? 1.460 -12.804 21.564 1.00 36.54 ? 424 LEU F C 1 +ATOM 31894 O O . LEU F 1 424 ? 1.078 -13.961 21.426 1.00 36.39 ? 424 LEU F O 1 +ATOM 31895 C CB . LEU F 1 424 ? 0.780 -10.968 20.002 1.00 35.14 ? 424 LEU F CB 1 +ATOM 31896 C CG . LEU F 1 424 ? -0.198 -9.894 19.522 1.00 34.44 ? 424 LEU F CG 1 +ATOM 31897 C CD1 . LEU F 1 424 ? 0.261 -9.372 18.166 1.00 31.18 ? 424 LEU F CD1 1 +ATOM 31898 C CD2 . LEU F 1 424 ? -1.613 -10.466 19.437 1.00 34.11 ? 424 LEU F CD2 1 +ATOM 31899 N N . LYS F 1 425 ? 2.704 -12.497 21.912 1.00 37.05 ? 425 LYS F N 1 +ATOM 31900 C CA . LYS F 1 425 ? 3.690 -13.533 22.152 1.00 37.72 ? 425 LYS F CA 1 +ATOM 31901 C C . LYS F 1 425 ? 3.369 -14.294 23.423 1.00 36.32 ? 425 LYS F C 1 +ATOM 31902 O O . LYS F 1 425 ? 3.533 -15.510 23.484 1.00 38.09 ? 425 LYS F O 1 +ATOM 31903 C CB . LYS F 1 425 ? 5.089 -12.934 22.264 1.00 40.48 ? 425 LYS F CB 1 +ATOM 31904 C CG . LYS F 1 425 ? 5.640 -12.373 20.963 1.00 46.42 ? 425 LYS F CG 1 +ATOM 31905 C CD . LYS F 1 425 ? 7.130 -12.066 21.099 1.00 51.39 ? 425 LYS F CD 1 +ATOM 31906 C CE . LYS F 1 425 ? 7.717 -11.542 19.796 1.00 53.05 ? 425 LYS F CE 1 +ATOM 31907 N NZ . LYS F 1 425 ? 7.102 -10.242 19.415 1.00 56.69 ? 425 LYS F NZ 1 +ATOM 31908 N N . LEU F 1 426 ? 2.891 -13.584 24.437 1.00 34.06 ? 426 LEU F N 1 +ATOM 31909 C CA . LEU F 1 426 ? 2.574 -14.217 25.711 1.00 33.48 ? 426 LEU F CA 1 +ATOM 31910 C C . LEU F 1 426 ? 1.484 -15.275 25.554 1.00 33.79 ? 426 LEU F C 1 +ATOM 31911 O O . LEU F 1 426 ? 1.625 -16.404 26.041 1.00 34.10 ? 426 LEU F O 1 +ATOM 31912 C CB . LEU F 1 426 ? 2.118 -13.173 26.734 1.00 31.93 ? 426 LEU F CB 1 +ATOM 31913 C CG . LEU F 1 426 ? 2.506 -13.354 28.212 1.00 33.89 ? 426 LEU F CG 1 +ATOM 31914 C CD1 . LEU F 1 426 ? 1.402 -12.761 29.086 1.00 31.13 ? 426 LEU F CD1 1 +ATOM 31915 C CD2 . LEU F 1 426 ? 2.728 -14.806 28.555 1.00 30.95 ? 426 LEU F CD2 1 +ATOM 31916 N N . GLN F 1 427 ? 0.395 -14.911 24.881 1.00 32.46 ? 427 GLN F N 1 +ATOM 31917 C CA . GLN F 1 427 ? -0.717 -15.839 24.687 1.00 32.21 ? 427 GLN F CA 1 +ATOM 31918 C C . GLN F 1 427 ? -0.265 -17.101 23.969 1.00 31.37 ? 427 GLN F C 1 +ATOM 31919 O O . GLN F 1 427 ? -0.737 -18.194 24.256 1.00 31.02 ? 427 GLN F O 1 +ATOM 31920 C CB . GLN F 1 427 ? -1.852 -15.162 23.905 1.00 31.80 ? 427 GLN F CB 1 +ATOM 31921 C CG . GLN F 1 427 ? -2.536 -14.068 24.687 1.00 31.67 ? 427 GLN F CG 1 +ATOM 31922 C CD . GLN F 1 427 ? -2.875 -14.522 26.094 1.00 32.54 ? 427 GLN F CD 1 +ATOM 31923 O OE1 . GLN F 1 427 ? -3.491 -15.569 26.278 1.00 31.68 ? 427 GLN F OE1 1 +ATOM 31924 N NE2 . GLN F 1 427 ? -2.470 -13.741 27.094 1.00 31.49 ? 427 GLN F NE2 1 +ATOM 31925 N N . LEU F 1 428 ? 0.669 -16.947 23.045 1.00 31.36 ? 428 LEU F N 1 +ATOM 31926 C CA . LEU F 1 428 ? 1.171 -18.081 22.304 1.00 33.70 ? 428 LEU F CA 1 +ATOM 31927 C C . LEU F 1 428 ? 1.913 -19.055 23.230 1.00 33.66 ? 428 LEU F C 1 +ATOM 31928 O O . LEU F 1 428 ? 1.765 -20.267 23.109 1.00 34.01 ? 428 LEU F O 1 +ATOM 31929 C CB . LEU F 1 428 ? 2.070 -17.581 21.182 1.00 34.66 ? 428 LEU F CB 1 +ATOM 31930 C CG . LEU F 1 428 ? 2.117 -18.418 19.904 1.00 38.26 ? 428 LEU F CG 1 +ATOM 31931 C CD1 . LEU F 1 428 ? 0.733 -18.952 19.559 1.00 39.74 ? 428 LEU F CD1 1 +ATOM 31932 C CD2 . LEU F 1 428 ? 2.658 -17.554 18.782 1.00 38.22 ? 428 LEU F CD2 1 +ATOM 31933 N N . GLN F 1 429 ? 2.689 -18.524 24.167 1.00 33.56 ? 429 GLN F N 1 +ATOM 31934 C CA . GLN F 1 429 ? 3.423 -19.363 25.103 1.00 34.02 ? 429 GLN F CA 1 +ATOM 31935 C C . GLN F 1 429 ? 2.455 -20.050 26.056 1.00 32.80 ? 429 GLN F C 1 +ATOM 31936 O O . GLN F 1 429 ? 2.640 -21.210 26.425 1.00 33.00 ? 429 GLN F O 1 +ATOM 31937 C CB . GLN F 1 429 ? 4.414 -18.527 25.927 1.00 36.36 ? 429 GLN F CB 1 +ATOM 31938 C CG . GLN F 1 429 ? 5.468 -17.815 25.122 1.00 39.32 ? 429 GLN F CG 1 +ATOM 31939 C CD . GLN F 1 429 ? 6.312 -16.900 25.984 1.00 41.95 ? 429 GLN F CD 1 +ATOM 31940 O OE1 . GLN F 1 429 ? 5.785 -16.096 26.751 1.00 42.08 ? 429 GLN F OE1 1 +ATOM 31941 N NE2 . GLN F 1 429 ? 7.633 -17.016 25.861 1.00 44.63 ? 429 GLN F NE2 1 +ATOM 31942 N N . LEU F 1 430 ? 1.429 -19.321 26.469 1.00 31.87 ? 430 LEU F N 1 +ATOM 31943 C CA . LEU F 1 430 ? 0.432 -19.856 27.385 1.00 31.06 ? 430 LEU F CA 1 +ATOM 31944 C C . LEU F 1 430 ? -0.347 -21.026 26.794 1.00 31.16 ? 430 LEU F C 1 +ATOM 31945 O O . LEU F 1 430 ? -0.449 -22.079 27.420 1.00 30.66 ? 430 LEU F O 1 +ATOM 31946 C CB . LEU F 1 430 ? -0.552 -18.759 27.786 1.00 32.22 ? 430 LEU F CB 1 +ATOM 31947 C CG . LEU F 1 430 ? -0.427 -18.062 29.142 1.00 34.39 ? 430 LEU F CG 1 +ATOM 31948 C CD1 . LEU F 1 430 ? 0.947 -18.267 29.753 1.00 33.53 ? 430 LEU F CD1 1 +ATOM 31949 C CD2 . LEU F 1 430 ? -0.724 -16.583 28.948 1.00 34.89 ? 430 LEU F CD2 1 +ATOM 31950 N N . VAL F 1 431 ? -0.901 -20.853 25.596 1.00 29.05 ? 431 VAL F N 1 +ATOM 31951 C CA . VAL F 1 431 ? -1.675 -21.931 25.002 1.00 29.50 ? 431 VAL F CA 1 +ATOM 31952 C C . VAL F 1 431 ? -0.794 -23.103 24.597 1.00 29.44 ? 431 VAL F C 1 +ATOM 31953 O O . VAL F 1 431 ? -1.217 -24.251 24.713 1.00 27.53 ? 431 VAL F O 1 +ATOM 31954 C CB . VAL F 1 431 ? -2.532 -21.448 23.778 1.00 30.02 ? 431 VAL F CB 1 +ATOM 31955 C CG1 . VAL F 1 431 ? -3.465 -20.331 24.220 1.00 31.16 ? 431 VAL F CG1 1 +ATOM 31956 C CG2 . VAL F 1 431 ? -1.646 -20.971 22.638 1.00 28.75 ? 431 VAL F CG2 1 +ATOM 31957 N N . LEU F 1 432 ? 0.429 -22.825 24.142 1.00 28.71 ? 432 LEU F N 1 +ATOM 31958 C CA . LEU F 1 432 ? 1.323 -23.901 23.746 1.00 29.87 ? 432 LEU F CA 1 +ATOM 31959 C C . LEU F 1 432 ? 1.826 -24.674 24.953 1.00 30.36 ? 432 LEU F C 1 +ATOM 31960 O O . LEU F 1 432 ? 2.036 -25.879 24.873 1.00 30.19 ? 432 LEU F O 1 +ATOM 31961 C CB . LEU F 1 432 ? 2.504 -23.368 22.935 1.00 29.99 ? 432 LEU F CB 1 +ATOM 31962 C CG . LEU F 1 432 ? 2.157 -22.889 21.518 1.00 30.34 ? 432 LEU F CG 1 +ATOM 31963 C CD1 . LEU F 1 432 ? 3.425 -22.547 20.753 1.00 28.69 ? 432 LEU F CD1 1 +ATOM 31964 C CD2 . LEU F 1 432 ? 1.386 -23.963 20.790 1.00 27.19 ? 432 LEU F CD2 1 +ATOM 31965 N N . GLY F 1 433 ? 2.011 -23.983 26.073 1.00 31.11 ? 433 GLY F N 1 +ATOM 31966 C CA . GLY F 1 433 ? 2.482 -24.655 27.271 1.00 32.34 ? 433 GLY F CA 1 +ATOM 31967 C C . GLY F 1 433 ? 1.415 -25.600 27.784 1.00 33.17 ? 433 GLY F C 1 +ATOM 31968 O O . GLY F 1 433 ? 1.705 -26.711 28.232 1.00 34.05 ? 433 GLY F O 1 +ATOM 31969 N N . LEU F 1 434 ? 0.172 -25.148 27.716 1.00 32.85 ? 434 LEU F N 1 +ATOM 31970 C CA . LEU F 1 434 ? -0.982 -25.925 28.149 1.00 34.25 ? 434 LEU F CA 1 +ATOM 31971 C C . LEU F 1 434 ? -1.148 -27.138 27.229 1.00 34.72 ? 434 LEU F C 1 +ATOM 31972 O O . LEU F 1 434 ? -1.386 -28.265 27.666 1.00 33.91 ? 434 LEU F O 1 +ATOM 31973 C CB . LEU F 1 434 ? -2.221 -25.041 28.046 1.00 35.92 ? 434 LEU F CB 1 +ATOM 31974 C CG . LEU F 1 434 ? -3.187 -24.842 29.209 1.00 36.45 ? 434 LEU F CG 1 +ATOM 31975 C CD1 . LEU F 1 434 ? -2.513 -25.073 30.538 1.00 34.94 ? 434 LEU F CD1 1 +ATOM 31976 C CD2 . LEU F 1 434 ? -3.743 -23.437 29.100 1.00 34.95 ? 434 LEU F CD2 1 +ATOM 31977 N N . SER F 1 435 ? -1.011 -26.880 25.938 1.00 35.41 ? 435 SER F N 1 +ATOM 31978 C CA . SER F 1 435 ? -1.162 -27.893 24.915 1.00 36.93 ? 435 SER F CA 1 +ATOM 31979 C C . SER F 1 435 ? -0.113 -29.009 25.037 1.00 37.84 ? 435 SER F C 1 +ATOM 31980 O O . SER F 1 435 ? -0.436 -30.196 24.931 1.00 36.57 ? 435 SER F O 1 +ATOM 31981 C CB . SER F 1 435 ? -1.082 -27.207 23.543 1.00 37.65 ? 435 SER F CB 1 +ATOM 31982 O OG . SER F 1 435 ? -1.355 -28.101 22.485 1.00 41.62 ? 435 SER F OG 1 +ATOM 31983 N N . ILE F 1 436 ? 1.139 -28.629 25.267 1.00 37.79 ? 436 ILE F N 1 +ATOM 31984 C CA . ILE F 1 436 ? 2.206 -29.608 25.384 1.00 37.70 ? 436 ILE F CA 1 +ATOM 31985 C C . ILE F 1 436 ? 2.118 -30.344 26.721 1.00 37.53 ? 436 ILE F C 1 +ATOM 31986 O O . ILE F 1 436 ? 2.835 -31.315 26.954 1.00 38.47 ? 436 ILE F O 1 +ATOM 31987 C CB . ILE F 1 436 ? 3.595 -28.928 25.243 1.00 38.55 ? 436 ILE F CB 1 +ATOM 31988 C CG1 . ILE F 1 436 ? 4.650 -29.969 24.884 1.00 39.46 ? 436 ILE F CG1 1 +ATOM 31989 C CG2 . ILE F 1 436 ? 3.981 -28.222 26.534 1.00 38.89 ? 436 ILE F CG2 1 +ATOM 31990 C CD1 . ILE F 1 436 ? 4.442 -30.577 23.519 1.00 39.77 ? 436 ILE F CD1 1 +ATOM 31991 N N . SER F 1 437 ? 1.216 -29.891 27.586 1.00 37.21 ? 437 SER F N 1 +ATOM 31992 C CA . SER F 1 437 ? 1.035 -30.489 28.906 1.00 35.19 ? 437 SER F CA 1 +ATOM 31993 C C . SER F 1 437 ? -0.234 -31.329 29.044 1.00 35.65 ? 437 SER F C 1 +ATOM 31994 O O . SER F 1 437 ? -0.714 -31.562 30.163 1.00 33.69 ? 437 SER F O 1 +ATOM 31995 C CB . SER F 1 437 ? 1.035 -29.393 29.984 1.00 36.61 ? 437 SER F CB 1 +ATOM 31996 O OG . SER F 1 437 ? 2.288 -28.721 30.079 1.00 35.61 ? 437 SER F OG 1 +ATOM 31997 N N . GLY F 1 438 ? -0.796 -31.771 27.919 1.00 34.86 ? 438 GLY F N 1 +ATOM 31998 C CA . GLY F 1 438 ? -1.985 -32.607 27.990 1.00 33.91 ? 438 GLY F CA 1 +ATOM 31999 C C . GLY F 1 438 ? -3.354 -31.959 27.874 1.00 34.71 ? 438 GLY F C 1 +ATOM 32000 O O . GLY F 1 438 ? -4.367 -32.656 27.900 1.00 34.99 ? 438 GLY F O 1 +ATOM 32001 N N . VAL F 1 439 ? -3.411 -30.639 27.765 1.00 35.20 ? 439 VAL F N 1 +ATOM 32002 C CA . VAL F 1 439 ? -4.699 -29.969 27.622 1.00 36.10 ? 439 VAL F CA 1 +ATOM 32003 C C . VAL F 1 439 ? -4.741 -29.428 26.206 1.00 35.81 ? 439 VAL F C 1 +ATOM 32004 O O . VAL F 1 439 ? -4.208 -28.362 25.920 1.00 36.85 ? 439 VAL F O 1 +ATOM 32005 C CB . VAL F 1 439 ? -4.847 -28.823 28.620 1.00 37.83 ? 439 VAL F CB 1 +ATOM 32006 C CG1 . VAL F 1 439 ? -6.267 -28.288 28.564 1.00 38.06 ? 439 VAL F CG1 1 +ATOM 32007 C CG2 . VAL F 1 439 ? -4.510 -29.315 30.029 1.00 37.84 ? 439 VAL F CG2 1 +ATOM 32008 N N . PRO F 1 440 ? -5.387 -30.163 25.297 1.00 36.12 ? 440 PRO F N 1 +ATOM 32009 C CA . PRO F 1 440 ? -5.502 -29.793 23.883 1.00 35.43 ? 440 PRO F CA 1 +ATOM 32010 C C . PRO F 1 440 ? -6.463 -28.679 23.484 1.00 35.23 ? 440 PRO F C 1 +ATOM 32011 O O . PRO F 1 440 ? -6.163 -27.895 22.589 1.00 35.86 ? 440 PRO F O 1 +ATOM 32012 C CB . PRO F 1 440 ? -5.872 -31.118 23.226 1.00 34.96 ? 440 PRO F CB 1 +ATOM 32013 C CG . PRO F 1 440 ? -6.792 -31.714 24.246 1.00 35.51 ? 440 PRO F CG 1 +ATOM 32014 C CD . PRO F 1 440 ? -6.060 -31.449 25.559 1.00 35.79 ? 440 PRO F CD 1 +ATOM 32015 N N . PHE F 1 441 ? -7.618 -28.607 24.127 1.00 34.56 ? 441 PHE F N 1 +ATOM 32016 C CA . PHE F 1 441 ? -8.586 -27.597 23.750 1.00 34.41 ? 441 PHE F CA 1 +ATOM 32017 C C . PHE F 1 441 ? -8.410 -26.321 24.542 1.00 34.53 ? 441 PHE F C 1 +ATOM 32018 O O . PHE F 1 441 ? -8.943 -26.165 25.645 1.00 34.93 ? 441 PHE F O 1 +ATOM 32019 C CB . PHE F 1 441 ? -9.991 -28.178 23.879 1.00 33.41 ? 441 PHE F CB 1 +ATOM 32020 C CG . PHE F 1 441 ? -10.145 -29.495 23.176 1.00 32.76 ? 441 PHE F CG 1 +ATOM 32021 C CD1 . PHE F 1 441 ? -9.527 -29.710 21.948 1.00 33.56 ? 441 PHE F CD1 1 +ATOM 32022 C CD2 . PHE F 1 441 ? -10.879 -30.529 23.747 1.00 32.60 ? 441 PHE F CD2 1 +ATOM 32023 C CE1 . PHE F 1 441 ? -9.638 -30.945 21.296 1.00 34.78 ? 441 PHE F CE1 1 +ATOM 32024 C CE2 . PHE F 1 441 ? -10.994 -31.763 23.108 1.00 30.77 ? 441 PHE F CE2 1 +ATOM 32025 C CZ . PHE F 1 441 ? -10.373 -31.972 21.882 1.00 32.19 ? 441 PHE F CZ 1 +ATOM 32026 N N . VAL F 1 442 ? -7.653 -25.405 23.944 1.00 33.35 ? 442 VAL F N 1 +ATOM 32027 C CA . VAL F 1 442 ? -7.330 -24.139 24.569 1.00 33.69 ? 442 VAL F CA 1 +ATOM 32028 C C . VAL F 1 442 ? -7.493 -22.934 23.642 1.00 34.22 ? 442 VAL F C 1 +ATOM 32029 O O . VAL F 1 442 ? -7.646 -23.072 22.424 1.00 31.86 ? 442 VAL F O 1 +ATOM 32030 C CB . VAL F 1 442 ? -5.882 -24.180 25.071 1.00 32.66 ? 442 VAL F CB 1 +ATOM 32031 C CG1 . VAL F 1 442 ? -5.723 -25.288 26.090 1.00 33.35 ? 442 VAL F CG1 1 +ATOM 32032 C CG2 . VAL F 1 442 ? -4.950 -24.432 23.899 1.00 30.79 ? 442 VAL F CG2 1 +ATOM 32033 N N . GLY F 1 443 ? -7.442 -21.750 24.244 1.00 35.50 ? 443 GLY F N 1 +ATOM 32034 C CA . GLY F 1 443 ? -7.567 -20.511 23.505 1.00 36.18 ? 443 GLY F CA 1 +ATOM 32035 C C . GLY F 1 443 ? -7.350 -19.341 24.441 1.00 37.44 ? 443 GLY F C 1 +ATOM 32036 O O . GLY F 1 443 ? -7.059 -19.526 25.622 1.00 36.73 ? 443 GLY F O 1 +ATOM 32037 N N . CYS F 1 444 ? -7.483 -18.133 23.915 1.00 38.62 ? 444 CYS F N 1 +ATOM 32038 C CA . CYS F 1 444 ? -7.319 -16.936 24.716 1.00 40.65 ? 444 CYS F CA 1 +ATOM 32039 C C . CYS F 1 444 ? -8.398 -15.965 24.277 1.00 40.43 ? 444 CYS F C 1 +ATOM 32040 O O . CYS F 1 444 ? -9.023 -16.177 23.238 1.00 41.75 ? 444 CYS F O 1 +ATOM 32041 C CB . CYS F 1 444 ? -5.943 -16.325 24.471 1.00 42.15 ? 444 CYS F CB 1 +ATOM 32042 S SG . CYS F 1 444 ? -5.756 -15.607 22.831 1.00 48.95 ? 444 CYS F SG 1 +ATOM 32043 N N . ASP F 1 445 ? -8.623 -14.909 25.055 1.00 40.87 ? 445 ASP F N 1 +ATOM 32044 C CA . ASP F 1 445 ? -9.640 -13.923 24.693 1.00 41.69 ? 445 ASP F CA 1 +ATOM 32045 C C . ASP F 1 445 ? -9.121 -13.055 23.556 1.00 40.69 ? 445 ASP F C 1 +ATOM 32046 O O . ASP F 1 445 ? -8.174 -12.279 23.734 1.00 39.94 ? 445 ASP F O 1 +ATOM 32047 C CB . ASP F 1 445 ? -10.019 -13.023 25.885 1.00 44.19 ? 445 ASP F CB 1 +ATOM 32048 C CG . ASP F 1 445 ? -10.814 -13.761 26.961 1.00 46.87 ? 445 ASP F CG 1 +ATOM 32049 O OD1 . ASP F 1 445 ? -11.553 -14.715 26.631 1.00 48.44 ? 445 ASP F OD1 1 +ATOM 32050 O OD2 . ASP F 1 445 ? -10.711 -13.371 28.144 1.00 49.63 ? 445 ASP F OD2 1 +ATOM 32051 N N . ILE F 1 446 ? -9.736 -13.198 22.385 1.00 38.78 ? 446 ILE F N 1 +ATOM 32052 C CA . ILE F 1 446 ? -9.340 -12.419 21.220 1.00 37.40 ? 446 ILE F CA 1 +ATOM 32053 C C . ILE F 1 446 ? -9.608 -10.938 21.495 1.00 36.77 ? 446 ILE F C 1 +ATOM 32054 O O . ILE F 1 446 ? -10.726 -10.544 21.841 1.00 33.77 ? 446 ILE F O 1 +ATOM 32055 C CB . ILE F 1 446 ? -10.112 -12.882 19.978 1.00 36.71 ? 446 ILE F CB 1 +ATOM 32056 C CG1 . ILE F 1 446 ? -9.751 -14.337 19.688 1.00 35.78 ? 446 ILE F CG1 1 +ATOM 32057 C CG2 . ILE F 1 446 ? -9.800 -11.988 18.787 1.00 35.07 ? 446 ILE F CG2 1 +ATOM 32058 C CD1 . ILE F 1 446 ? -10.559 -14.948 18.580 1.00 39.27 ? 446 ILE F CD1 1 +ATOM 32059 N N . GLY F 1 447 ? -8.567 -10.126 21.363 1.00 35.80 ? 447 GLY F N 1 +ATOM 32060 C CA . GLY F 1 447 ? -8.709 -8.709 21.629 1.00 36.11 ? 447 GLY F CA 1 +ATOM 32061 C C . GLY F 1 447 ? -8.340 -8.344 23.058 1.00 36.25 ? 447 GLY F C 1 +ATOM 32062 O O . GLY F 1 447 ? -8.282 -7.164 23.403 1.00 37.03 ? 447 GLY F O 1 +ATOM 32063 N N . GLY F 1 448 ? -8.089 -9.347 23.894 1.00 35.50 ? 448 GLY F N 1 +ATOM 32064 C CA . GLY F 1 448 ? -7.724 -9.077 25.276 1.00 35.13 ? 448 GLY F CA 1 +ATOM 32065 C C . GLY F 1 448 ? -8.914 -8.761 26.166 1.00 34.87 ? 448 GLY F C 1 +ATOM 32066 O O . GLY F 1 448 ? -9.829 -8.036 25.780 1.00 35.53 ? 448 GLY F O 1 +ATOM 32067 N N . PHE F 1 449 ? -8.902 -9.299 27.376 1.00 33.52 ? 449 PHE F N 1 +ATOM 32068 C CA . PHE F 1 449 ? -9.991 -9.069 28.309 1.00 31.87 ? 449 PHE F CA 1 +ATOM 32069 C C . PHE F 1 449 ? -10.044 -7.656 28.918 1.00 32.82 ? 449 PHE F C 1 +ATOM 32070 O O . PHE F 1 449 ? -11.097 -7.016 28.906 1.00 31.63 ? 449 PHE F O 1 +ATOM 32071 C CB . PHE F 1 449 ? -9.918 -10.088 29.442 1.00 29.29 ? 449 PHE F CB 1 +ATOM 32072 C CG . PHE F 1 449 ? -10.857 -9.797 30.567 1.00 29.42 ? 449 PHE F CG 1 +ATOM 32073 C CD1 . PHE F 1 449 ? -12.228 -10.038 30.431 1.00 29.52 ? 449 PHE F CD1 1 +ATOM 32074 C CD2 . PHE F 1 449 ? -10.382 -9.264 31.765 1.00 28.92 ? 449 PHE F CD2 1 +ATOM 32075 C CE1 . PHE F 1 449 ? -13.113 -9.759 31.468 1.00 27.91 ? 449 PHE F CE1 1 +ATOM 32076 C CE2 . PHE F 1 449 ? -11.261 -8.977 32.816 1.00 28.70 ? 449 PHE F CE2 1 +ATOM 32077 C CZ . PHE F 1 449 ? -12.630 -9.227 32.667 1.00 28.99 ? 449 PHE F CZ 1 +ATOM 32078 N N . GLN F 1 450 ? -8.921 -7.188 29.465 1.00 32.49 ? 450 GLN F N 1 +ATOM 32079 C CA . GLN F 1 450 ? -8.855 -5.879 30.115 1.00 33.35 ? 450 GLN F CA 1 +ATOM 32080 C C . GLN F 1 450 ? -9.431 -4.737 29.278 1.00 34.94 ? 450 GLN F C 1 +ATOM 32081 O O . GLN F 1 450 ? -9.167 -4.626 28.078 1.00 35.58 ? 450 GLN F O 1 +ATOM 32082 C CB . GLN F 1 450 ? -7.408 -5.556 30.516 1.00 32.32 ? 450 GLN F CB 1 +ATOM 32083 C CG . GLN F 1 450 ? -6.735 -6.594 31.426 1.00 32.14 ? 450 GLN F CG 1 +ATOM 32084 C CD . GLN F 1 450 ? -7.454 -6.810 32.752 1.00 33.21 ? 450 GLN F CD 1 +ATOM 32085 O OE1 . GLN F 1 450 ? -8.077 -5.894 33.294 1.00 35.95 ? 450 GLN F OE1 1 +ATOM 32086 N NE2 . GLN F 1 450 ? -7.351 -8.025 33.294 1.00 32.33 ? 450 GLN F NE2 1 +ATOM 32087 N N . GLY F 1 451 ? -10.214 -3.883 29.928 1.00 36.09 ? 451 GLY F N 1 +ATOM 32088 C CA . GLY F 1 451 ? -10.846 -2.777 29.235 1.00 38.55 ? 451 GLY F CA 1 +ATOM 32089 C C . GLY F 1 451 ? -10.079 -1.469 29.232 1.00 39.36 ? 451 GLY F C 1 +ATOM 32090 O O . GLY F 1 451 ? -9.217 -1.260 28.378 1.00 40.57 ? 451 GLY F O 1 +ATOM 32091 N N . ARG F 1 452 ? -10.399 -0.582 30.171 1.00 38.76 ? 452 ARG F N 1 +ATOM 32092 C CA . ARG F 1 452 ? -9.731 0.715 30.261 1.00 37.87 ? 452 ARG F CA 1 +ATOM 32093 C C . ARG F 1 452 ? -9.601 1.153 31.700 1.00 37.47 ? 452 ARG F C 1 +ATOM 32094 O O . ARG F 1 452 ? -9.824 2.316 32.021 1.00 37.89 ? 452 ARG F O 1 +ATOM 32095 C CB . ARG F 1 452 ? -10.508 1.786 29.492 1.00 35.69 ? 452 ARG F CB 1 +ATOM 32096 C CG . ARG F 1 452 ? -10.551 1.568 27.989 1.00 35.80 ? 452 ARG F CG 1 +ATOM 32097 C CD . ARG F 1 452 ? -11.978 1.527 27.532 1.00 35.52 ? 452 ARG F CD 1 +ATOM 32098 N NE . ARG F 1 452 ? -12.349 2.703 26.777 1.00 35.30 ? 452 ARG F NE 1 +ATOM 32099 C CZ . ARG F 1 452 ? -13.598 3.131 26.629 1.00 36.34 ? 452 ARG F CZ 1 +ATOM 32100 N NH1 . ARG F 1 452 ? -14.608 2.478 27.201 1.00 33.33 ? 452 ARG F NH1 1 +ATOM 32101 N NH2 . ARG F 1 452 ? -13.836 4.206 25.889 1.00 37.22 ? 452 ARG F NH2 1 +ATOM 32102 N N . ASN F 1 453 ? -9.244 0.220 32.570 1.00 38.97 ? 453 ASN F N 1 +ATOM 32103 C CA . ASN F 1 453 ? -9.104 0.543 33.980 1.00 39.94 ? 453 ASN F CA 1 +ATOM 32104 C C . ASN F 1 453 ? -7.673 0.890 34.356 1.00 38.98 ? 453 ASN F C 1 +ATOM 32105 O O . ASN F 1 453 ? -7.393 1.141 35.521 1.00 39.12 ? 453 ASN F O 1 +ATOM 32106 C CB . ASN F 1 453 ? -9.648 -0.598 34.853 1.00 42.37 ? 453 ASN F CB 1 +ATOM 32107 C CG . ASN F 1 453 ? -9.072 -1.952 34.479 1.00 44.64 ? 453 ASN F CG 1 +ATOM 32108 O OD1 . ASN F 1 453 ? -9.120 -2.363 33.318 1.00 47.92 ? 453 ASN F OD1 1 +ATOM 32109 N ND2 . ASN F 1 453 ? -8.531 -2.658 35.465 1.00 46.24 ? 453 ASN F ND2 1 +ATOM 32110 N N . PHE F 1 454 ? -6.771 0.890 33.371 1.00 38.90 ? 454 PHE F N 1 +ATOM 32111 C CA . PHE F 1 454 ? -5.373 1.283 33.593 1.00 38.42 ? 454 PHE F CA 1 +ATOM 32112 C C . PHE F 1 454 ? -4.693 1.613 32.268 1.00 39.88 ? 454 PHE F C 1 +ATOM 32113 O O . PHE F 1 454 ? -5.038 1.059 31.226 1.00 40.95 ? 454 PHE F O 1 +ATOM 32114 C CB . PHE F 1 454 ? -4.590 0.231 34.410 1.00 35.78 ? 454 PHE F CB 1 +ATOM 32115 C CG . PHE F 1 454 ? -4.470 -1.111 33.758 1.00 35.27 ? 454 PHE F CG 1 +ATOM 32116 C CD1 . PHE F 1 454 ? -3.411 -1.390 32.912 1.00 34.11 ? 454 PHE F CD1 1 +ATOM 32117 C CD2 . PHE F 1 454 ? -5.406 -2.116 34.021 1.00 35.62 ? 454 PHE F CD2 1 +ATOM 32118 C CE1 . PHE F 1 454 ? -3.272 -2.654 32.333 1.00 34.95 ? 454 PHE F CE1 1 +ATOM 32119 C CE2 . PHE F 1 454 ? -5.281 -3.377 33.452 1.00 34.11 ? 454 PHE F CE2 1 +ATOM 32120 C CZ . PHE F 1 454 ? -4.208 -3.650 32.604 1.00 34.08 ? 454 PHE F CZ 1 +ATOM 32121 N N . ALA F 1 455 ? -3.737 2.540 32.330 1.00 41.06 ? 455 ALA F N 1 +ATOM 32122 C CA . ALA F 1 455 ? -3.003 3.070 31.175 1.00 41.18 ? 455 ALA F CA 1 +ATOM 32123 C C . ALA F 1 455 ? -2.308 2.138 30.197 1.00 43.15 ? 455 ALA F C 1 +ATOM 32124 O O . ALA F 1 455 ? -2.298 2.392 28.990 1.00 44.63 ? 455 ALA F O 1 +ATOM 32125 C CB . ALA F 1 455 ? -1.994 4.112 31.660 1.00 37.88 ? 455 ALA F CB 1 +ATOM 32126 N N . GLU F 1 456 ? -1.708 1.074 30.705 1.00 44.38 ? 456 GLU F N 1 +ATOM 32127 C CA . GLU F 1 456 ? -0.981 0.152 29.850 1.00 45.23 ? 456 GLU F CA 1 +ATOM 32128 C C . GLU F 1 456 ? -1.845 -0.808 29.038 1.00 44.86 ? 456 GLU F C 1 +ATOM 32129 O O . GLU F 1 456 ? -1.524 -1.986 28.929 1.00 48.25 ? 456 GLU F O 1 +ATOM 32130 C CB . GLU F 1 456 ? 0.020 -0.642 30.689 1.00 46.77 ? 456 GLU F CB 1 +ATOM 32131 C CG . GLU F 1 456 ? 1.018 0.217 31.480 1.00 50.84 ? 456 GLU F CG 1 +ATOM 32132 C CD . GLU F 1 456 ? 0.360 1.075 32.564 1.00 54.13 ? 456 GLU F CD 1 +ATOM 32133 O OE1 . GLU F 1 456 ? -0.585 0.584 33.232 1.00 54.16 ? 456 GLU F OE1 1 +ATOM 32134 O OE2 . GLU F 1 456 ? 0.802 2.236 32.758 1.00 55.38 ? 456 GLU F OE2 1 +ATOM 32135 N N . ILE F 1 457 ? -2.933 -0.312 28.468 1.00 42.06 ? 457 ILE F N 1 +ATOM 32136 C CA . ILE F 1 457 ? -3.806 -1.141 27.652 1.00 41.06 ? 457 ILE F CA 1 +ATOM 32137 C C . ILE F 1 457 ? -3.847 -0.541 26.244 1.00 41.09 ? 457 ILE F C 1 +ATOM 32138 O O . ILE F 1 457 ? -4.054 0.662 26.080 1.00 39.85 ? 457 ILE F O 1 +ATOM 32139 C CB . ILE F 1 457 ? -5.240 -1.188 28.231 1.00 41.13 ? 457 ILE F CB 1 +ATOM 32140 C CG1 . ILE F 1 457 ? -5.216 -1.788 29.635 1.00 39.18 ? 457 ILE F CG1 1 +ATOM 32141 C CG2 . ILE F 1 457 ? -6.143 -2.022 27.340 1.00 38.08 ? 457 ILE F CG2 1 +ATOM 32142 C CD1 . ILE F 1 457 ? -6.574 -1.853 30.299 1.00 38.28 ? 457 ILE F CD1 1 +ATOM 32143 N N . ASP F 1 458 ? -3.648 -1.383 25.235 1.00 40.30 ? 458 ASP F N 1 +ATOM 32144 C CA . ASP F 1 458 ? -3.646 -0.934 23.848 1.00 40.69 ? 458 ASP F CA 1 +ATOM 32145 C C . ASP F 1 458 ? -4.886 -1.411 23.091 1.00 40.70 ? 458 ASP F C 1 +ATOM 32146 O O . ASP F 1 458 ? -4.986 -2.585 22.729 1.00 40.36 ? 458 ASP F O 1 +ATOM 32147 C CB . ASP F 1 458 ? -2.397 -1.453 23.145 1.00 41.43 ? 458 ASP F CB 1 +ATOM 32148 C CG . ASP F 1 458 ? -2.218 -0.862 21.761 1.00 43.70 ? 458 ASP F CG 1 +ATOM 32149 O OD1 . ASP F 1 458 ? -3.237 -0.440 21.159 1.00 42.76 ? 458 ASP F OD1 1 +ATOM 32150 O OD2 . ASP F 1 458 ? -1.060 -0.835 21.274 1.00 41.56 ? 458 ASP F OD2 1 +ATOM 32151 N N . ASN F 1 459 ? -5.823 -0.499 22.841 1.00 40.94 ? 459 ASN F N 1 +ATOM 32152 C CA . ASN F 1 459 ? -7.051 -0.852 22.135 1.00 40.80 ? 459 ASN F CA 1 +ATOM 32153 C C . ASN F 1 459 ? -7.071 -0.494 20.656 1.00 39.73 ? 459 ASN F C 1 +ATOM 32154 O O . ASN F 1 459 ? -8.139 -0.331 20.076 1.00 42.79 ? 459 ASN F O 1 +ATOM 32155 C CB . ASN F 1 459 ? -8.260 -0.214 22.825 1.00 40.58 ? 459 ASN F CB 1 +ATOM 32156 C CG . ASN F 1 459 ? -8.528 -0.808 24.189 1.00 42.79 ? 459 ASN F CG 1 +ATOM 32157 O OD1 . ASN F 1 459 ? -8.786 -2.006 24.318 1.00 45.17 ? 459 ASN F OD1 1 +ATOM 32158 N ND2 . ASN F 1 459 ? -8.471 0.025 25.218 1.00 43.14 ? 459 ASN F ND2 1 +ATOM 32159 N N . SER F 1 460 ? -5.907 -0.376 20.034 1.00 39.16 ? 460 SER F N 1 +ATOM 32160 C CA . SER F 1 460 ? -5.869 -0.050 18.616 1.00 39.58 ? 460 SER F CA 1 +ATOM 32161 C C . SER F 1 460 ? -6.512 -1.180 17.797 1.00 39.25 ? 460 SER F C 1 +ATOM 32162 O O . SER F 1 460 ? -6.458 -2.355 18.174 1.00 38.28 ? 460 SER F O 1 +ATOM 32163 C CB . SER F 1 460 ? -4.429 0.178 18.170 1.00 39.81 ? 460 SER F CB 1 +ATOM 32164 O OG . SER F 1 460 ? -3.682 -1.005 18.306 1.00 43.53 ? 460 SER F OG 1 +ATOM 32165 N N . MET F 1 461 ? -7.122 -0.819 16.676 1.00 39.08 ? 461 MET F N 1 +ATOM 32166 C CA . MET F 1 461 ? -7.796 -1.791 15.829 1.00 39.08 ? 461 MET F CA 1 +ATOM 32167 C C . MET F 1 461 ? -6.894 -2.733 15.054 1.00 38.33 ? 461 MET F C 1 +ATOM 32168 O O . MET F 1 461 ? -7.273 -3.870 14.802 1.00 37.19 ? 461 MET F O 1 +ATOM 32169 C CB . MET F 1 461 ? -8.746 -1.073 14.877 1.00 39.98 ? 461 MET F CB 1 +ATOM 32170 C CG . MET F 1 461 ? -9.855 -0.366 15.625 1.00 43.78 ? 461 MET F CG 1 +ATOM 32171 S SD . MET F 1 461 ? -10.903 0.613 14.561 1.00 47.40 ? 461 MET F SD 1 +ATOM 32172 C CE . MET F 1 461 ? -9.811 2.046 14.233 1.00 44.24 ? 461 MET F CE 1 +ATOM 32173 N N . ASP F 1 462 ? -5.707 -2.286 14.670 1.00 37.96 ? 462 ASP F N 1 +ATOM 32174 C CA . ASP F 1 462 ? -4.830 -3.183 13.942 1.00 40.58 ? 462 ASP F CA 1 +ATOM 32175 C C . ASP F 1 462 ? -4.289 -4.270 14.881 1.00 39.33 ? 462 ASP F C 1 +ATOM 32176 O O . ASP F 1 462 ? -3.979 -5.373 14.441 1.00 40.14 ? 462 ASP F O 1 +ATOM 32177 C CB . ASP F 1 462 ? -3.704 -2.408 13.259 1.00 43.92 ? 462 ASP F CB 1 +ATOM 32178 C CG . ASP F 1 462 ? -2.805 -1.716 14.233 1.00 50.43 ? 462 ASP F CG 1 +ATOM 32179 O OD1 . ASP F 1 462 ? -3.315 -1.138 15.222 1.00 54.40 ? 462 ASP F OD1 1 +ATOM 32180 O OD2 . ASP F 1 462 ? -1.577 -1.738 13.999 1.00 56.05 ? 462 ASP F OD2 1 +ATOM 32181 N N . LEU F 1 463 ? -4.202 -3.966 16.173 1.00 36.71 ? 463 LEU F N 1 +ATOM 32182 C CA . LEU F 1 463 ? -3.744 -4.945 17.147 1.00 34.48 ? 463 LEU F CA 1 +ATOM 32183 C C . LEU F 1 463 ? -4.874 -5.973 17.279 1.00 32.84 ? 463 LEU F C 1 +ATOM 32184 O O . LEU F 1 463 ? -4.632 -7.180 17.340 1.00 32.27 ? 463 LEU F O 1 +ATOM 32185 C CB . LEU F 1 463 ? -3.498 -4.293 18.512 1.00 32.78 ? 463 LEU F CB 1 +ATOM 32186 C CG . LEU F 1 463 ? -2.557 -4.958 19.532 1.00 33.32 ? 463 LEU F CG 1 +ATOM 32187 C CD1 . LEU F 1 463 ? -3.006 -4.553 20.917 1.00 31.55 ? 463 LEU F CD1 1 +ATOM 32188 C CD2 . LEU F 1 463 ? -2.541 -6.468 19.420 1.00 31.39 ? 463 LEU F CD2 1 +ATOM 32189 N N . LEU F 1 464 ? -6.110 -5.485 17.331 1.00 31.60 ? 464 LEU F N 1 +ATOM 32190 C CA . LEU F 1 464 ? -7.274 -6.360 17.445 1.00 30.19 ? 464 LEU F CA 1 +ATOM 32191 C C . LEU F 1 464 ? -7.298 -7.346 16.277 1.00 30.84 ? 464 LEU F C 1 +ATOM 32192 O O . LEU F 1 464 ? -7.565 -8.535 16.453 1.00 31.73 ? 464 LEU F O 1 +ATOM 32193 C CB . LEU F 1 464 ? -8.556 -5.537 17.452 1.00 29.04 ? 464 LEU F CB 1 +ATOM 32194 C CG . LEU F 1 464 ? -9.865 -6.322 17.417 1.00 29.62 ? 464 LEU F CG 1 +ATOM 32195 C CD1 . LEU F 1 464 ? -9.977 -7.186 18.663 1.00 28.56 ? 464 LEU F CD1 1 +ATOM 32196 C CD2 . LEU F 1 464 ? -11.034 -5.372 17.339 1.00 28.91 ? 464 LEU F CD2 1 +ATOM 32197 N N . VAL F 1 465 ? -7.008 -6.851 15.082 1.00 29.86 ? 465 VAL F N 1 +ATOM 32198 C CA . VAL F 1 465 ? -6.981 -7.700 13.908 1.00 29.70 ? 465 VAL F CA 1 +ATOM 32199 C C . VAL F 1 465 ? -5.902 -8.761 14.070 1.00 30.28 ? 465 VAL F C 1 +ATOM 32200 O O . VAL F 1 465 ? -6.107 -9.911 13.676 1.00 30.76 ? 465 VAL F O 1 +ATOM 32201 C CB . VAL F 1 465 ? -6.729 -6.869 12.626 1.00 30.16 ? 465 VAL F CB 1 +ATOM 32202 C CG1 . VAL F 1 465 ? -6.460 -7.771 11.448 1.00 28.06 ? 465 VAL F CG1 1 +ATOM 32203 C CG2 . VAL F 1 465 ? -7.942 -6.006 12.345 1.00 29.50 ? 465 VAL F CG2 1 +ATOM 32204 N N . LYS F 1 466 ? -4.763 -8.385 14.652 1.00 29.24 ? 466 LYS F N 1 +ATOM 32205 C CA . LYS F 1 466 ? -3.677 -9.339 14.859 1.00 30.53 ? 466 LYS F CA 1 +ATOM 32206 C C . LYS F 1 466 ? -4.062 -10.448 15.842 1.00 29.79 ? 466 LYS F C 1 +ATOM 32207 O O . LYS F 1 466 ? -3.547 -11.554 15.759 1.00 29.35 ? 466 LYS F O 1 +ATOM 32208 C CB . LYS F 1 466 ? -2.415 -8.636 15.359 1.00 32.52 ? 466 LYS F CB 1 +ATOM 32209 C CG . LYS F 1 466 ? -1.750 -7.757 14.327 1.00 35.36 ? 466 LYS F CG 1 +ATOM 32210 C CD . LYS F 1 466 ? -1.448 -8.515 13.067 1.00 37.94 ? 466 LYS F CD 1 +ATOM 32211 C CE . LYS F 1 466 ? -0.724 -7.631 12.068 1.00 41.83 ? 466 LYS F CE 1 +ATOM 32212 N NZ . LYS F 1 466 ? -0.544 -8.337 10.764 1.00 45.81 ? 466 LYS F NZ 1 +ATOM 32213 N N . TYR F 1 467 ? -4.956 -10.148 16.776 1.00 29.56 ? 467 TYR F N 1 +ATOM 32214 C CA . TYR F 1 467 ? -5.413 -11.153 17.732 1.00 31.38 ? 467 TYR F CA 1 +ATOM 32215 C C . TYR F 1 467 ? -6.240 -12.210 16.988 1.00 31.61 ? 467 TYR F C 1 +ATOM 32216 O O . TYR F 1 467 ? -6.051 -13.411 17.168 1.00 30.88 ? 467 TYR F O 1 +ATOM 32217 C CB . TYR F 1 467 ? -6.271 -10.507 18.816 1.00 31.21 ? 467 TYR F CB 1 +ATOM 32218 C CG . TYR F 1 467 ? -5.520 -10.135 20.069 1.00 34.03 ? 467 TYR F CG 1 +ATOM 32219 C CD1 . TYR F 1 467 ? -5.202 -11.099 21.030 1.00 33.87 ? 467 TYR F CD1 1 +ATOM 32220 C CD2 . TYR F 1 467 ? -5.141 -8.814 20.308 1.00 34.57 ? 467 TYR F CD2 1 +ATOM 32221 C CE1 . TYR F 1 467 ? -4.532 -10.754 22.199 1.00 34.56 ? 467 TYR F CE1 1 +ATOM 32222 C CE2 . TYR F 1 467 ? -4.466 -8.458 21.467 1.00 34.41 ? 467 TYR F CE2 1 +ATOM 32223 C CZ . TYR F 1 467 ? -4.162 -9.431 22.410 1.00 36.05 ? 467 TYR F CZ 1 +ATOM 32224 O OH . TYR F 1 467 ? -3.458 -9.076 23.547 1.00 37.31 ? 467 TYR F OH 1 +ATOM 32225 N N . TYR F 1 468 ? -7.159 -11.747 16.149 1.00 30.95 ? 468 TYR F N 1 +ATOM 32226 C CA . TYR F 1 468 ? -7.988 -12.646 15.358 1.00 31.29 ? 468 TYR F CA 1 +ATOM 32227 C C . TYR F 1 468 ? -7.109 -13.547 14.501 1.00 30.25 ? 468 TYR F C 1 +ATOM 32228 O O . TYR F 1 468 ? -7.385 -14.735 14.341 1.00 30.13 ? 468 TYR F O 1 +ATOM 32229 C CB . TYR F 1 468 ? -8.931 -11.846 14.454 1.00 28.96 ? 468 TYR F CB 1 +ATOM 32230 C CG . TYR F 1 468 ? -10.223 -11.468 15.122 1.00 28.40 ? 468 TYR F CG 1 +ATOM 32231 C CD1 . TYR F 1 468 ? -11.282 -12.371 15.186 1.00 29.14 ? 468 TYR F CD1 1 +ATOM 32232 C CD2 . TYR F 1 468 ? -10.388 -10.214 15.706 1.00 28.72 ? 468 TYR F CD2 1 +ATOM 32233 C CE1 . TYR F 1 468 ? -12.478 -12.034 15.813 1.00 28.47 ? 468 TYR F CE1 1 +ATOM 32234 C CE2 . TYR F 1 468 ? -11.577 -9.864 16.338 1.00 28.78 ? 468 TYR F CE2 1 +ATOM 32235 C CZ . TYR F 1 468 ? -12.618 -10.778 16.385 1.00 29.86 ? 468 TYR F CZ 1 +ATOM 32236 O OH . TYR F 1 468 ? -13.803 -10.428 16.991 1.00 31.92 ? 468 TYR F OH 1 +ATOM 32237 N N . ALA F 1 469 ? -6.047 -12.972 13.959 1.00 29.30 ? 469 ALA F N 1 +ATOM 32238 C CA . ALA F 1 469 ? -5.134 -13.719 13.107 1.00 30.39 ? 469 ALA F CA 1 +ATOM 32239 C C . ALA F 1 469 ? -4.254 -14.671 13.907 1.00 30.45 ? 469 ALA F C 1 +ATOM 32240 O O . ALA F 1 469 ? -3.933 -15.762 13.437 1.00 31.71 ? 469 ALA F O 1 +ATOM 32241 C CB . ALA F 1 469 ? -4.266 -12.759 12.295 1.00 25.61 ? 469 ALA F CB 1 +ATOM 32242 N N . LEU F 1 470 ? -3.869 -14.259 15.110 1.00 30.34 ? 470 LEU F N 1 +ATOM 32243 C CA . LEU F 1 470 ? -3.007 -15.074 15.960 1.00 30.23 ? 470 LEU F CA 1 +ATOM 32244 C C . LEU F 1 470 ? -3.669 -16.395 16.338 1.00 30.07 ? 470 LEU F C 1 +ATOM 32245 O O . LEU F 1 470 ? -3.049 -17.450 16.289 1.00 28.61 ? 470 LEU F O 1 +ATOM 32246 C CB . LEU F 1 470 ? -2.657 -14.316 17.245 1.00 31.29 ? 470 LEU F CB 1 +ATOM 32247 C CG . LEU F 1 470 ? -1.877 -15.142 18.271 1.00 32.46 ? 470 LEU F CG 1 +ATOM 32248 C CD1 . LEU F 1 470 ? -0.434 -15.271 17.818 1.00 33.03 ? 470 LEU F CD1 1 +ATOM 32249 C CD2 . LEU F 1 470 ? -1.947 -14.488 19.642 1.00 33.18 ? 470 LEU F CD2 1 +ATOM 32250 N N . ALA F 1 471 ? -4.938 -16.316 16.718 1.00 30.16 ? 471 ALA F N 1 +ATOM 32251 C CA . ALA F 1 471 ? -5.691 -17.471 17.150 1.00 30.06 ? 471 ALA F CA 1 +ATOM 32252 C C . ALA F 1 471 ? -6.413 -18.173 16.014 1.00 32.18 ? 471 ALA F C 1 +ATOM 32253 O O . ALA F 1 471 ? -7.297 -18.999 16.252 1.00 32.24 ? 471 ALA F O 1 +ATOM 32254 C CB . ALA F 1 471 ? -6.685 -17.050 18.208 1.00 30.16 ? 471 ALA F CB 1 +ATOM 32255 N N . LEU F 1 472 ? -6.045 -17.843 14.780 1.00 33.59 ? 472 LEU F N 1 +ATOM 32256 C CA . LEU F 1 472 ? -6.666 -18.447 13.600 1.00 34.54 ? 472 LEU F CA 1 +ATOM 32257 C C . LEU F 1 472 ? -6.871 -19.950 13.738 1.00 34.53 ? 472 LEU F C 1 +ATOM 32258 O O . LEU F 1 472 ? -7.932 -20.471 13.393 1.00 33.62 ? 472 LEU F O 1 +ATOM 32259 C CB . LEU F 1 472 ? -5.809 -18.179 12.361 1.00 35.63 ? 472 LEU F CB 1 +ATOM 32260 C CG . LEU F 1 472 ? -6.276 -18.815 11.045 1.00 35.09 ? 472 LEU F CG 1 +ATOM 32261 C CD1 . LEU F 1 472 ? -7.699 -18.382 10.740 1.00 33.24 ? 472 LEU F CD1 1 +ATOM 32262 C CD2 . LEU F 1 472 ? -5.329 -18.398 9.916 1.00 34.27 ? 472 LEU F CD2 1 +ATOM 32263 N N . PHE F 1 473 ? -5.857 -20.643 14.248 1.00 33.80 ? 473 PHE F N 1 +ATOM 32264 C CA . PHE F 1 473 ? -5.937 -22.086 14.406 1.00 33.99 ? 473 PHE F CA 1 +ATOM 32265 C C . PHE F 1 473 ? -6.064 -22.598 15.836 1.00 34.80 ? 473 PHE F C 1 +ATOM 32266 O O . PHE F 1 473 ? -5.976 -23.799 16.060 1.00 36.77 ? 473 PHE F O 1 +ATOM 32267 C CB . PHE F 1 473 ? -4.737 -22.734 13.734 1.00 33.89 ? 473 PHE F CB 1 +ATOM 32268 C CG . PHE F 1 473 ? -4.692 -22.515 12.246 1.00 34.31 ? 473 PHE F CG 1 +ATOM 32269 C CD1 . PHE F 1 473 ? -5.589 -23.165 11.406 1.00 34.93 ? 473 PHE F CD1 1 +ATOM 32270 C CD2 . PHE F 1 473 ? -3.761 -21.647 11.687 1.00 33.60 ? 473 PHE F CD2 1 +ATOM 32271 C CE1 . PHE F 1 473 ? -5.559 -22.954 10.026 1.00 35.72 ? 473 PHE F CE1 1 +ATOM 32272 C CE2 . PHE F 1 473 ? -3.721 -21.427 10.314 1.00 34.53 ? 473 PHE F CE2 1 +ATOM 32273 C CZ . PHE F 1 473 ? -4.623 -22.081 9.479 1.00 35.96 ? 473 PHE F CZ 1 +ATOM 32274 N N . PHE F 1 474 ? -6.263 -21.709 16.806 1.00 34.21 ? 474 PHE F N 1 +ATOM 32275 C CA . PHE F 1 474 ? -6.429 -22.158 18.186 1.00 34.74 ? 474 PHE F CA 1 +ATOM 32276 C C . PHE F 1 474 ? -7.740 -22.947 18.242 1.00 35.34 ? 474 PHE F C 1 +ATOM 32277 O O . PHE F 1 474 ? -8.677 -22.645 17.513 1.00 35.67 ? 474 PHE F O 1 +ATOM 32278 C CB . PHE F 1 474 ? -6.537 -20.970 19.156 1.00 34.18 ? 474 PHE F CB 1 +ATOM 32279 C CG . PHE F 1 474 ? -5.244 -20.234 19.393 1.00 33.44 ? 474 PHE F CG 1 +ATOM 32280 C CD1 . PHE F 1 474 ? -4.077 -20.584 18.715 1.00 33.29 ? 474 PHE F CD1 1 +ATOM 32281 C CD2 . PHE F 1 474 ? -5.203 -19.166 20.288 1.00 32.00 ? 474 PHE F CD2 1 +ATOM 32282 C CE1 . PHE F 1 474 ? -2.892 -19.881 18.924 1.00 32.15 ? 474 PHE F CE1 1 +ATOM 32283 C CE2 . PHE F 1 474 ? -4.027 -18.460 20.501 1.00 31.98 ? 474 PHE F CE2 1 +ATOM 32284 C CZ . PHE F 1 474 ? -2.866 -18.817 19.817 1.00 31.04 ? 474 PHE F CZ 1 +ATOM 32285 N N . PRO F 1 475 ? -7.814 -23.980 19.093 1.00 35.65 ? 475 PRO F N 1 +ATOM 32286 C CA . PRO F 1 475 ? -9.047 -24.767 19.198 1.00 35.75 ? 475 PRO F CA 1 +ATOM 32287 C C . PRO F 1 475 ? -10.233 -23.907 19.644 1.00 36.82 ? 475 PRO F C 1 +ATOM 32288 O O . PRO F 1 475 ? -11.309 -23.952 19.044 1.00 37.85 ? 475 PRO F O 1 +ATOM 32289 C CB . PRO F 1 475 ? -8.686 -25.829 20.225 1.00 34.58 ? 475 PRO F CB 1 +ATOM 32290 C CG . PRO F 1 475 ? -7.236 -26.089 19.906 1.00 36.35 ? 475 PRO F CG 1 +ATOM 32291 C CD . PRO F 1 475 ? -6.690 -24.674 19.750 1.00 36.23 ? 475 PRO F CD 1 +ATOM 32292 N N . PHE F 1 476 ? -10.030 -23.125 20.700 1.00 36.52 ? 476 PHE F N 1 +ATOM 32293 C CA . PHE F 1 476 ? -11.070 -22.254 21.240 1.00 34.96 ? 476 PHE F CA 1 +ATOM 32294 C C . PHE F 1 476 ? -10.879 -20.830 20.688 1.00 36.11 ? 476 PHE F C 1 +ATOM 32295 O O . PHE F 1 476 ? -9.862 -20.171 20.948 1.00 37.13 ? 476 PHE F O 1 +ATOM 32296 C CB . PHE F 1 476 ? -11.001 -22.265 22.766 1.00 32.98 ? 476 PHE F CB 1 +ATOM 32297 C CG . PHE F 1 476 ? -12.147 -21.570 23.432 1.00 33.37 ? 476 PHE F CG 1 +ATOM 32298 C CD1 . PHE F 1 476 ? -13.455 -21.962 23.181 1.00 32.99 ? 476 PHE F CD1 1 +ATOM 32299 C CD2 . PHE F 1 476 ? -11.922 -20.507 24.302 1.00 33.59 ? 476 PHE F CD2 1 +ATOM 32300 C CE1 . PHE F 1 476 ? -14.523 -21.309 23.782 1.00 32.22 ? 476 PHE F CE1 1 +ATOM 32301 C CE2 . PHE F 1 476 ? -12.979 -19.850 24.905 1.00 33.07 ? 476 PHE F CE2 1 +ATOM 32302 C CZ . PHE F 1 476 ? -14.288 -20.254 24.644 1.00 32.18 ? 476 PHE F CZ 1 +ATOM 32303 N N . TYR F 1 477 ? -11.873 -20.364 19.932 1.00 34.54 ? 477 TYR F N 1 +ATOM 32304 C CA . TYR F 1 477 ? -11.842 -19.054 19.272 1.00 33.31 ? 477 TYR F CA 1 +ATOM 32305 C C . TYR F 1 477 ? -12.954 -18.127 19.786 1.00 33.06 ? 477 TYR F C 1 +ATOM 32306 O O . TYR F 1 477 ? -14.047 -18.079 19.222 1.00 29.41 ? 477 TYR F O 1 +ATOM 32307 C CB . TYR F 1 477 ? -12.018 -19.277 17.772 1.00 32.32 ? 477 TYR F CB 1 +ATOM 32308 C CG . TYR F 1 477 ? -11.493 -18.188 16.876 1.00 31.71 ? 477 TYR F CG 1 +ATOM 32309 C CD1 . TYR F 1 477 ? -10.121 -18.036 16.654 1.00 29.30 ? 477 TYR F CD1 1 +ATOM 32310 C CD2 . TYR F 1 477 ? -12.370 -17.338 16.204 1.00 32.10 ? 477 TYR F CD2 1 +ATOM 32311 C CE1 . TYR F 1 477 ? -9.643 -17.070 15.783 1.00 31.04 ? 477 TYR F CE1 1 +ATOM 32312 C CE2 . TYR F 1 477 ? -11.901 -16.366 15.329 1.00 31.11 ? 477 TYR F CE2 1 +ATOM 32313 C CZ . TYR F 1 477 ? -10.539 -16.238 15.119 1.00 30.62 ? 477 TYR F CZ 1 +ATOM 32314 O OH . TYR F 1 477 ? -10.073 -15.290 14.242 1.00 31.79 ? 477 TYR F OH 1 +ATOM 32315 N N . ARG F 1 478 ? -12.663 -17.378 20.842 1.00 33.99 ? 478 ARG F N 1 +ATOM 32316 C CA . ARG F 1 478 ? -13.654 -16.488 21.426 1.00 34.68 ? 478 ARG F CA 1 +ATOM 32317 C C . ARG F 1 478 ? -13.172 -15.059 21.669 1.00 36.61 ? 478 ARG F C 1 +ATOM 32318 O O . ARG F 1 478 ? -12.038 -14.816 22.091 1.00 37.73 ? 478 ARG F O 1 +ATOM 32319 C CB . ARG F 1 478 ? -14.151 -17.067 22.753 1.00 33.69 ? 478 ARG F CB 1 +ATOM 32320 C CG . ARG F 1 478 ? -15.158 -16.192 23.459 1.00 33.73 ? 478 ARG F CG 1 +ATOM 32321 C CD . ARG F 1 478 ? -15.531 -16.728 24.834 1.00 36.89 ? 478 ARG F CD 1 +ATOM 32322 N NE . ARG F 1 478 ? -14.441 -16.592 25.798 1.00 38.14 ? 478 ARG F NE 1 +ATOM 32323 C CZ . ARG F 1 478 ? -14.619 -16.484 27.112 1.00 40.12 ? 478 ARG F CZ 1 +ATOM 32324 N NH1 . ARG F 1 478 ? -15.850 -16.495 27.621 1.00 39.39 ? 478 ARG F NH1 1 +ATOM 32325 N NH2 . ARG F 1 478 ? -13.567 -16.351 27.917 1.00 39.74 ? 478 ARG F NH2 1 +ATOM 32326 N N . SER F 1 479 ? -14.065 -14.115 21.408 1.00 37.29 ? 479 SER F N 1 +ATOM 32327 C CA . SER F 1 479 ? -13.805 -12.704 21.626 1.00 36.90 ? 479 SER F CA 1 +ATOM 32328 C C . SER F 1 479 ? -14.499 -12.380 22.939 1.00 37.46 ? 479 SER F C 1 +ATOM 32329 O O . SER F 1 479 ? -15.702 -12.597 23.077 1.00 36.99 ? 479 SER F O 1 +ATOM 32330 C CB . SER F 1 479 ? -14.424 -11.877 20.512 1.00 37.86 ? 479 SER F CB 1 +ATOM 32331 O OG . SER F 1 479 ? -14.306 -10.502 20.809 1.00 42.70 ? 479 SER F OG 1 +ATOM 32332 N N . HIS F 1 480 ? -13.746 -11.867 23.904 1.00 36.92 ? 480 HIS F N 1 +ATOM 32333 C CA . HIS F 1 480 ? -14.303 -11.541 25.211 1.00 36.95 ? 480 HIS F CA 1 +ATOM 32334 C C . HIS F 1 480 ? -13.667 -10.236 25.686 1.00 36.97 ? 480 HIS F C 1 +ATOM 32335 O O . HIS F 1 480 ? -12.469 -10.021 25.495 1.00 37.31 ? 480 HIS F O 1 +ATOM 32336 C CB . HIS F 1 480 ? -14.006 -12.687 26.188 1.00 35.71 ? 480 HIS F CB 1 +ATOM 32337 C CG . HIS F 1 480 ? -14.632 -12.517 27.536 1.00 36.92 ? 480 HIS F CG 1 +ATOM 32338 N ND1 . HIS F 1 480 ? -15.970 -12.235 27.705 1.00 36.09 ? 480 HIS F ND1 1 +ATOM 32339 C CD2 . HIS F 1 480 ? -14.113 -12.636 28.782 1.00 37.10 ? 480 HIS F CD2 1 +ATOM 32340 C CE1 . HIS F 1 480 ? -16.251 -12.189 28.995 1.00 37.01 ? 480 HIS F CE1 1 +ATOM 32341 N NE2 . HIS F 1 480 ? -15.142 -12.428 29.672 1.00 37.94 ? 480 HIS F NE2 1 +ATOM 32342 N N . LYS F 1 481 ? -14.464 -9.373 26.308 1.00 35.02 ? 481 LYS F N 1 +ATOM 32343 C CA . LYS F 1 481 ? -13.968 -8.082 26.757 1.00 33.80 ? 481 LYS F CA 1 +ATOM 32344 C C . LYS F 1 481 ? -14.609 -7.653 28.072 1.00 33.22 ? 481 LYS F C 1 +ATOM 32345 O O . LYS F 1 481 ? -15.762 -7.986 28.343 1.00 33.60 ? 481 LYS F O 1 +ATOM 32346 C CB . LYS F 1 481 ? -14.243 -7.046 25.663 1.00 34.51 ? 481 LYS F CB 1 +ATOM 32347 C CG . LYS F 1 481 ? -13.917 -5.614 26.025 1.00 37.29 ? 481 LYS F CG 1 +ATOM 32348 C CD . LYS F 1 481 ? -12.418 -5.386 26.227 1.00 38.36 ? 481 LYS F CD 1 +ATOM 32349 C CE . LYS F 1 481 ? -11.644 -5.444 24.926 1.00 39.93 ? 481 LYS F CE 1 +ATOM 32350 N NZ . LYS F 1 481 ? -10.198 -5.100 25.142 1.00 42.85 ? 481 LYS F NZ 1 +ATOM 32351 N N . ALA F 1 482 ? -13.852 -6.918 28.888 1.00 32.21 ? 482 ALA F N 1 +ATOM 32352 C CA . ALA F 1 482 ? -14.330 -6.435 30.185 1.00 31.65 ? 482 ALA F CA 1 +ATOM 32353 C C . ALA F 1 482 ? -15.413 -5.368 30.044 1.00 31.63 ? 482 ALA F C 1 +ATOM 32354 O O . ALA F 1 482 ? -15.579 -4.768 28.983 1.00 31.05 ? 482 ALA F O 1 +ATOM 32355 C CB . ALA F 1 482 ? -13.171 -5.895 30.998 1.00 29.47 ? 482 ALA F CB 1 +ATOM 32356 N N . THR F 1 483 ? -16.134 -5.123 31.130 1.00 32.56 ? 483 THR F N 1 +ATOM 32357 C CA . THR F 1 483 ? -17.234 -4.160 31.131 1.00 34.48 ? 483 THR F CA 1 +ATOM 32358 C C . THR F 1 483 ? -16.922 -2.765 30.611 1.00 36.36 ? 483 THR F C 1 +ATOM 32359 O O . THR F 1 483 ? -17.694 -2.213 29.836 1.00 36.14 ? 483 THR F O 1 +ATOM 32360 C CB . THR F 1 483 ? -17.822 -4.005 32.530 1.00 33.41 ? 483 THR F CB 1 +ATOM 32361 O OG1 . THR F 1 483 ? -17.790 -5.270 33.198 1.00 35.86 ? 483 THR F OG1 1 +ATOM 32362 C CG2 . THR F 1 483 ? -19.258 -3.552 32.446 1.00 34.25 ? 483 THR F CG2 1 +ATOM 32363 N N . ASP F 1 484 ? -15.795 -2.193 31.022 1.00 38.43 ? 484 ASP F N 1 +ATOM 32364 C CA . ASP F 1 484 ? -15.449 -0.846 30.586 1.00 39.63 ? 484 ASP F CA 1 +ATOM 32365 C C . ASP F 1 484 ? -14.559 -0.789 29.354 1.00 39.28 ? 484 ASP F C 1 +ATOM 32366 O O . ASP F 1 484 ? -13.989 0.252 29.041 1.00 40.08 ? 484 ASP F O 1 +ATOM 32367 C CB . ASP F 1 484 ? -14.797 -0.071 31.739 1.00 42.49 ? 484 ASP F CB 1 +ATOM 32368 C CG . ASP F 1 484 ? -13.365 -0.517 32.022 1.00 45.48 ? 484 ASP F CG 1 +ATOM 32369 O OD1 . ASP F 1 484 ? -13.045 -1.714 31.840 1.00 46.85 ? 484 ASP F OD1 1 +ATOM 32370 O OD2 . ASP F 1 484 ? -12.565 0.342 32.453 1.00 48.58 ? 484 ASP F OD2 1 +ATOM 32371 N N . GLY F 1 485 ? -14.436 -1.903 28.652 1.00 38.65 ? 485 GLY F N 1 +ATOM 32372 C CA . GLY F 1 485 ? -13.617 -1.903 27.459 1.00 40.04 ? 485 GLY F CA 1 +ATOM 32373 C C . GLY F 1 485 ? -14.456 -1.464 26.280 1.00 40.81 ? 485 GLY F C 1 +ATOM 32374 O O . GLY F 1 485 ? -15.675 -1.572 26.311 1.00 41.02 ? 485 GLY F O 1 +ATOM 32375 N N . ILE F 1 486 ? -13.813 -0.954 25.242 1.00 43.33 ? 486 ILE F N 1 +ATOM 32376 C CA . ILE F 1 486 ? -14.537 -0.515 24.052 1.00 46.04 ? 486 ILE F CA 1 +ATOM 32377 C C . ILE F 1 486 ? -15.238 -1.730 23.450 1.00 45.96 ? 486 ILE F C 1 +ATOM 32378 O O . ILE F 1 486 ? -14.859 -2.868 23.741 1.00 44.61 ? 486 ILE F O 1 +ATOM 32379 C CB . ILE F 1 486 ? -13.564 0.067 22.994 1.00 47.77 ? 486 ILE F CB 1 +ATOM 32380 C CG1 . ILE F 1 486 ? -12.496 -0.980 22.642 1.00 49.40 ? 486 ILE F CG1 1 +ATOM 32381 C CG2 . ILE F 1 486 ? -12.904 1.335 23.529 1.00 46.83 ? 486 ILE F CG2 1 +ATOM 32382 C CD1 . ILE F 1 486 ? -11.530 -0.543 21.558 1.00 51.51 ? 486 ILE F CD1 1 +ATOM 32383 N N . ASP F 1 487 ? -16.260 -1.496 22.629 1.00 47.02 ? 487 ASP F N 1 +ATOM 32384 C CA . ASP F 1 487 ? -16.975 -2.598 21.977 1.00 48.70 ? 487 ASP F CA 1 +ATOM 32385 C C . ASP F 1 487 ? -16.027 -3.184 20.935 1.00 48.10 ? 487 ASP F C 1 +ATOM 32386 O O . ASP F 1 487 ? -15.555 -2.472 20.062 1.00 48.51 ? 487 ASP F O 1 +ATOM 32387 C CB . ASP F 1 487 ? -18.254 -2.095 21.300 1.00 50.54 ? 487 ASP F CB 1 +ATOM 32388 C CG . ASP F 1 487 ? -19.353 -1.743 22.302 1.00 54.59 ? 487 ASP F CG 1 +ATOM 32389 O OD1 . ASP F 1 487 ? -19.803 -2.651 23.049 1.00 55.66 ? 487 ASP F OD1 1 +ATOM 32390 O OD2 . ASP F 1 487 ? -19.771 -0.563 22.339 1.00 55.24 ? 487 ASP F OD2 1 +ATOM 32391 N N . THR F 1 488 ? -15.739 -4.477 21.030 1.00 48.27 ? 488 THR F N 1 +ATOM 32392 C CA . THR F 1 488 ? -14.817 -5.095 20.094 1.00 47.18 ? 488 THR F CA 1 +ATOM 32393 C C . THR F 1 488 ? -15.444 -6.012 19.057 1.00 46.53 ? 488 THR F C 1 +ATOM 32394 O O . THR F 1 488 ? -14.724 -6.672 18.309 1.00 46.05 ? 488 THR F O 1 +ATOM 32395 C CB . THR F 1 488 ? -13.715 -5.874 20.837 1.00 47.75 ? 488 THR F CB 1 +ATOM 32396 O OG1 . THR F 1 488 ? -14.306 -6.886 21.665 1.00 46.93 ? 488 THR F OG1 1 +ATOM 32397 C CG2 . THR F 1 488 ? -12.891 -4.924 21.685 1.00 47.02 ? 488 THR F CG2 1 +ATOM 32398 N N . GLU F 1 489 ? -16.770 -6.070 19.011 1.00 46.67 ? 489 GLU F N 1 +ATOM 32399 C CA . GLU F 1 489 ? -17.431 -6.910 18.010 1.00 48.19 ? 489 GLU F CA 1 +ATOM 32400 C C . GLU F 1 489 ? -17.074 -6.328 16.639 1.00 46.21 ? 489 GLU F C 1 +ATOM 32401 O O . GLU F 1 489 ? -17.050 -5.110 16.461 1.00 44.26 ? 489 GLU F O 1 +ATOM 32402 C CB . GLU F 1 489 ? -18.959 -6.907 18.185 1.00 50.17 ? 489 GLU F CB 1 +ATOM 32403 C CG . GLU F 1 489 ? -19.468 -7.426 19.524 1.00 53.54 ? 489 GLU F CG 1 +ATOM 32404 C CD . GLU F 1 489 ? -19.096 -6.521 20.698 1.00 56.37 ? 489 GLU F CD 1 +ATOM 32405 O OE1 . GLU F 1 489 ? -19.178 -5.281 20.556 1.00 56.12 ? 489 GLU F OE1 1 +ATOM 32406 O OE2 . GLU F 1 489 ? -18.734 -7.050 21.771 1.00 57.27 ? 489 GLU F OE2 1 +ATOM 32407 N N . PRO F 1 490 ? -16.784 -7.195 15.657 1.00 45.35 ? 490 PRO F N 1 +ATOM 32408 C CA . PRO F 1 490 ? -16.419 -6.802 14.292 1.00 45.58 ? 490 PRO F CA 1 +ATOM 32409 C C . PRO F 1 490 ? -17.382 -5.821 13.624 1.00 44.65 ? 490 PRO F C 1 +ATOM 32410 O O . PRO F 1 490 ? -16.955 -4.949 12.869 1.00 44.89 ? 490 PRO F O 1 +ATOM 32411 C CB . PRO F 1 490 ? -16.363 -8.135 13.561 1.00 45.45 ? 490 PRO F CB 1 +ATOM 32412 C CG . PRO F 1 490 ? -15.947 -9.076 14.631 1.00 47.28 ? 490 PRO F CG 1 +ATOM 32413 C CD . PRO F 1 490 ? -16.805 -8.658 15.781 1.00 45.14 ? 490 PRO F CD 1 +ATOM 32414 N N . VAL F 1 491 ? -18.674 -5.965 13.905 1.00 43.54 ? 491 VAL F N 1 +ATOM 32415 C CA . VAL F 1 491 ? -19.676 -5.094 13.310 1.00 44.80 ? 491 VAL F CA 1 +ATOM 32416 C C . VAL F 1 491 ? -19.516 -3.625 13.688 1.00 44.61 ? 491 VAL F C 1 +ATOM 32417 O O . VAL F 1 491 ? -20.118 -2.761 13.051 1.00 45.82 ? 491 VAL F O 1 +ATOM 32418 C CB . VAL F 1 491 ? -21.116 -5.539 13.680 1.00 45.99 ? 491 VAL F CB 1 +ATOM 32419 C CG1 . VAL F 1 491 ? -21.426 -6.883 13.044 1.00 45.41 ? 491 VAL F CG1 1 +ATOM 32420 C CG2 . VAL F 1 491 ? -21.267 -5.610 15.195 1.00 45.63 ? 491 VAL F CG2 1 +ATOM 32421 N N . PHE F 1 492 ? -18.713 -3.341 14.711 1.00 42.83 ? 492 PHE F N 1 +ATOM 32422 C CA . PHE F 1 492 ? -18.493 -1.964 15.144 1.00 42.42 ? 492 PHE F CA 1 +ATOM 32423 C C . PHE F 1 492 ? -17.187 -1.379 14.621 1.00 41.53 ? 492 PHE F C 1 +ATOM 32424 O O . PHE F 1 492 ? -16.811 -0.273 14.982 1.00 41.86 ? 492 PHE F O 1 +ATOM 32425 C CB . PHE F 1 492 ? -18.501 -1.871 16.672 1.00 43.54 ? 492 PHE F CB 1 +ATOM 32426 C CG . PHE F 1 492 ? -19.800 -2.280 17.299 1.00 45.17 ? 492 PHE F CG 1 +ATOM 32427 C CD1 . PHE F 1 492 ? -20.978 -1.609 16.992 1.00 45.85 ? 492 PHE F CD1 1 +ATOM 32428 C CD2 . PHE F 1 492 ? -19.852 -3.347 18.191 1.00 46.08 ? 492 PHE F CD2 1 +ATOM 32429 C CE1 . PHE F 1 492 ? -22.191 -1.997 17.562 1.00 46.18 ? 492 PHE F CE1 1 +ATOM 32430 C CE2 . PHE F 1 492 ? -21.061 -3.743 18.768 1.00 46.14 ? 492 PHE F CE2 1 +ATOM 32431 C CZ . PHE F 1 492 ? -22.230 -3.067 18.452 1.00 45.84 ? 492 PHE F CZ 1 +ATOM 32432 N N . LEU F 1 493 ? -16.501 -2.119 13.763 1.00 41.49 ? 493 LEU F N 1 +ATOM 32433 C CA . LEU F 1 493 ? -15.232 -1.664 13.206 1.00 41.67 ? 493 LEU F CA 1 +ATOM 32434 C C . LEU F 1 493 ? -15.404 -0.963 11.861 1.00 41.90 ? 493 LEU F C 1 +ATOM 32435 O O . LEU F 1 493 ? -16.348 -1.233 11.122 1.00 41.93 ? 493 LEU F O 1 +ATOM 32436 C CB . LEU F 1 493 ? -14.292 -2.859 13.000 1.00 40.95 ? 493 LEU F CB 1 +ATOM 32437 C CG . LEU F 1 493 ? -13.730 -3.613 14.200 1.00 41.90 ? 493 LEU F CG 1 +ATOM 32438 C CD1 . LEU F 1 493 ? -13.083 -4.904 13.727 1.00 40.14 ? 493 LEU F CD1 1 +ATOM 32439 C CD2 . LEU F 1 493 ? -12.721 -2.732 14.922 1.00 42.54 ? 493 LEU F CD2 1 +ATOM 32440 N N . PRO F 1 494 ? -14.489 -0.042 11.527 1.00 43.12 ? 494 PRO F N 1 +ATOM 32441 C CA . PRO F 1 494 ? -14.595 0.651 10.237 1.00 42.26 ? 494 PRO F CA 1 +ATOM 32442 C C . PRO F 1 494 ? -14.468 -0.435 9.180 1.00 43.39 ? 494 PRO F C 1 +ATOM 32443 O O . PRO F 1 494 ? -13.780 -1.431 9.403 1.00 42.94 ? 494 PRO F O 1 +ATOM 32444 C CB . PRO F 1 494 ? -13.389 1.581 10.244 1.00 40.91 ? 494 PRO F CB 1 +ATOM 32445 C CG . PRO F 1 494 ? -13.227 1.900 11.700 1.00 43.51 ? 494 PRO F CG 1 +ATOM 32446 C CD . PRO F 1 494 ? -13.446 0.563 12.375 1.00 41.89 ? 494 PRO F CD 1 +ATOM 32447 N N . ASP F 1 495 ? -15.118 -0.251 8.035 1.00 45.11 ? 495 ASP F N 1 +ATOM 32448 C CA . ASP F 1 495 ? -15.080 -1.250 6.971 1.00 46.11 ? 495 ASP F CA 1 +ATOM 32449 C C . ASP F 1 495 ? -13.696 -1.854 6.715 1.00 43.52 ? 495 ASP F C 1 +ATOM 32450 O O . ASP F 1 495 ? -13.563 -3.051 6.533 1.00 42.14 ? 495 ASP F O 1 +ATOM 32451 C CB . ASP F 1 495 ? -15.642 -0.653 5.673 1.00 51.25 ? 495 ASP F CB 1 +ATOM 32452 C CG . ASP F 1 495 ? -17.127 -0.318 5.780 1.00 57.94 ? 495 ASP F CG 1 +ATOM 32453 O OD1 . ASP F 1 495 ? -17.907 -1.230 6.150 1.00 61.70 ? 495 ASP F OD1 1 +ATOM 32454 O OD2 . ASP F 1 495 ? -17.518 0.847 5.496 1.00 61.39 ? 495 ASP F OD2 1 +ATOM 32455 N N . TYR F 1 496 ? -12.664 -1.025 6.710 1.00 42.33 ? 496 TYR F N 1 +ATOM 32456 C CA . TYR F 1 496 ? -11.311 -1.509 6.465 1.00 41.70 ? 496 TYR F CA 1 +ATOM 32457 C C . TYR F 1 496 ? -10.923 -2.668 7.395 1.00 41.16 ? 496 TYR F C 1 +ATOM 32458 O O . TYR F 1 496 ? -10.451 -3.709 6.945 1.00 39.69 ? 496 TYR F O 1 +ATOM 32459 C CB . TYR F 1 496 ? -10.310 -0.365 6.633 1.00 41.11 ? 496 TYR F CB 1 +ATOM 32460 C CG . TYR F 1 496 ? -8.878 -0.785 6.429 1.00 41.23 ? 496 TYR F CG 1 +ATOM 32461 C CD1 . TYR F 1 496 ? -8.365 -0.993 5.150 1.00 40.79 ? 496 TYR F CD1 1 +ATOM 32462 C CD2 . TYR F 1 496 ? -8.041 -1.011 7.521 1.00 41.56 ? 496 TYR F CD2 1 +ATOM 32463 C CE1 . TYR F 1 496 ? -7.047 -1.419 4.963 1.00 40.44 ? 496 TYR F CE1 1 +ATOM 32464 C CE2 . TYR F 1 496 ? -6.730 -1.439 7.346 1.00 41.76 ? 496 TYR F CE2 1 +ATOM 32465 C CZ . TYR F 1 496 ? -6.238 -1.642 6.066 1.00 42.06 ? 496 TYR F CZ 1 +ATOM 32466 O OH . TYR F 1 496 ? -4.940 -2.087 5.905 1.00 43.85 ? 496 TYR F OH 1 +ATOM 32467 N N . TYR F 1 497 ? -11.121 -2.476 8.694 1.00 40.68 ? 497 TYR F N 1 +ATOM 32468 C CA . TYR F 1 497 ? -10.784 -3.498 9.680 1.00 40.63 ? 497 TYR F CA 1 +ATOM 32469 C C . TYR F 1 497 ? -11.825 -4.609 9.749 1.00 39.85 ? 497 TYR F C 1 +ATOM 32470 O O . TYR F 1 497 ? -11.480 -5.772 9.940 1.00 37.46 ? 497 TYR F O 1 +ATOM 32471 C CB . TYR F 1 497 ? -10.609 -2.857 11.058 1.00 39.26 ? 497 TYR F CB 1 +ATOM 32472 C CG . TYR F 1 497 ? -9.409 -1.951 11.122 1.00 41.38 ? 497 TYR F CG 1 +ATOM 32473 C CD1 . TYR F 1 497 ? -8.118 -2.474 11.071 1.00 42.58 ? 497 TYR F CD1 1 +ATOM 32474 C CD2 . TYR F 1 497 ? -9.557 -0.566 11.191 1.00 41.83 ? 497 TYR F CD2 1 +ATOM 32475 C CE1 . TYR F 1 497 ? -7.000 -1.641 11.085 1.00 43.05 ? 497 TYR F CE1 1 +ATOM 32476 C CE2 . TYR F 1 497 ? -8.449 0.276 11.208 1.00 42.43 ? 497 TYR F CE2 1 +ATOM 32477 C CZ . TYR F 1 497 ? -7.176 -0.265 11.153 1.00 43.98 ? 497 TYR F CZ 1 +ATOM 32478 O OH . TYR F 1 497 ? -6.077 0.570 11.158 1.00 45.95 ? 497 TYR F OH 1 +ATOM 32479 N N . LYS F 1 498 ? -13.094 -4.245 9.590 1.00 39.88 ? 498 LYS F N 1 +ATOM 32480 C CA . LYS F 1 498 ? -14.174 -5.215 9.636 1.00 40.00 ? 498 LYS F CA 1 +ATOM 32481 C C . LYS F 1 498 ? -13.985 -6.289 8.567 1.00 40.49 ? 498 LYS F C 1 +ATOM 32482 O O . LYS F 1 498 ? -14.192 -7.474 8.830 1.00 38.50 ? 498 LYS F O 1 +ATOM 32483 C CB . LYS F 1 498 ? -15.522 -4.515 9.450 1.00 41.37 ? 498 LYS F CB 1 +ATOM 32484 C CG . LYS F 1 498 ? -16.702 -5.460 9.304 1.00 43.58 ? 498 LYS F CG 1 +ATOM 32485 C CD . LYS F 1 498 ? -18.019 -4.758 9.550 1.00 45.68 ? 498 LYS F CD 1 +ATOM 32486 C CE . LYS F 1 498 ? -18.262 -3.648 8.545 1.00 51.17 ? 498 LYS F CE 1 +ATOM 32487 N NZ . LYS F 1 498 ? -19.498 -2.854 8.864 1.00 53.81 ? 498 LYS F NZ 1 +ATOM 32488 N N . GLU F 1 499 ? -13.577 -5.877 7.370 1.00 40.81 ? 499 GLU F N 1 +ATOM 32489 C CA . GLU F 1 499 ? -13.367 -6.819 6.284 1.00 41.47 ? 499 GLU F CA 1 +ATOM 32490 C C . GLU F 1 499 ? -12.230 -7.773 6.593 1.00 40.92 ? 499 GLU F C 1 +ATOM 32491 O O . GLU F 1 499 ? -12.286 -8.941 6.224 1.00 41.06 ? 499 GLU F O 1 +ATOM 32492 C CB . GLU F 1 499 ? -13.069 -6.094 4.966 1.00 43.71 ? 499 GLU F CB 1 +ATOM 32493 C CG . GLU F 1 499 ? -14.234 -6.088 3.979 1.00 51.74 ? 499 GLU F CG 1 +ATOM 32494 C CD . GLU F 1 499 ? -14.814 -7.486 3.713 1.00 56.11 ? 499 GLU F CD 1 +ATOM 32495 O OE1 . GLU F 1 499 ? -14.070 -8.383 3.235 1.00 57.01 ? 499 GLU F OE1 1 +ATOM 32496 O OE2 . GLU F 1 499 ? -16.023 -7.681 3.987 1.00 57.61 ? 499 GLU F OE2 1 +ATOM 32497 N N . LYS F 1 500 ? -11.194 -7.279 7.260 1.00 39.76 ? 500 LYS F N 1 +ATOM 32498 C CA . LYS F 1 500 ? -10.070 -8.128 7.599 1.00 38.63 ? 500 LYS F CA 1 +ATOM 32499 C C . LYS F 1 500 ? -10.473 -9.213 8.594 1.00 37.48 ? 500 LYS F C 1 +ATOM 32500 O O . LYS F 1 500 ? -10.075 -10.365 8.448 1.00 37.18 ? 500 LYS F O 1 +ATOM 32501 C CB . LYS F 1 500 ? -8.914 -7.296 8.159 1.00 38.85 ? 500 LYS F CB 1 +ATOM 32502 C CG . LYS F 1 500 ? -8.142 -6.530 7.094 1.00 39.86 ? 500 LYS F CG 1 +ATOM 32503 C CD . LYS F 1 500 ? -6.950 -5.807 7.696 1.00 43.77 ? 500 LYS F CD 1 +ATOM 32504 C CE . LYS F 1 500 ? -6.227 -4.958 6.669 1.00 45.06 ? 500 LYS F CE 1 +ATOM 32505 N NZ . LYS F 1 500 ? -5.748 -5.773 5.519 1.00 49.21 ? 500 LYS F NZ 1 +ATOM 32506 N N . VAL F 1 501 ? -11.263 -8.850 9.597 1.00 36.22 ? 501 VAL F N 1 +ATOM 32507 C CA . VAL F 1 501 ? -11.700 -9.811 10.595 1.00 35.93 ? 501 VAL F CA 1 +ATOM 32508 C C . VAL F 1 501 ? -12.626 -10.834 9.941 1.00 37.58 ? 501 VAL F C 1 +ATOM 32509 O O . VAL F 1 501 ? -12.567 -12.026 10.230 1.00 35.99 ? 501 VAL F O 1 +ATOM 32510 C CB . VAL F 1 501 ? -12.442 -9.111 11.754 1.00 35.71 ? 501 VAL F CB 1 +ATOM 32511 C CG1 . VAL F 1 501 ? -13.033 -10.153 12.711 1.00 34.04 ? 501 VAL F CG1 1 +ATOM 32512 C CG2 . VAL F 1 501 ? -11.479 -8.192 12.500 1.00 34.03 ? 501 VAL F CG2 1 +ATOM 32513 N N . LYS F 1 502 ? -13.480 -10.349 9.049 1.00 39.05 ? 502 LYS F N 1 +ATOM 32514 C CA . LYS F 1 502 ? -14.424 -11.187 8.322 1.00 38.69 ? 502 LYS F CA 1 +ATOM 32515 C C . LYS F 1 502 ? -13.681 -12.253 7.512 1.00 38.35 ? 502 LYS F C 1 +ATOM 32516 O O . LYS F 1 502 ? -14.059 -13.422 7.524 1.00 37.50 ? 502 LYS F O 1 +ATOM 32517 C CB . LYS F 1 502 ? -15.265 -10.304 7.393 1.00 40.33 ? 502 LYS F CB 1 +ATOM 32518 C CG . LYS F 1 502 ? -16.491 -10.948 6.780 1.00 41.39 ? 502 LYS F CG 1 +ATOM 32519 C CD . LYS F 1 502 ? -17.280 -9.886 6.026 1.00 45.63 ? 502 LYS F CD 1 +ATOM 32520 C CE . LYS F 1 502 ? -18.573 -10.433 5.459 1.00 47.71 ? 502 LYS F CE 1 +ATOM 32521 N NZ . LYS F 1 502 ? -18.318 -11.498 4.449 1.00 51.27 ? 502 LYS F NZ 1 +ATOM 32522 N N . GLU F 1 503 ? -12.618 -11.858 6.822 1.00 37.32 ? 503 GLU F N 1 +ATOM 32523 C CA . GLU F 1 503 ? -11.859 -12.809 6.017 1.00 39.43 ? 503 GLU F CA 1 +ATOM 32524 C C . GLU F 1 503 ? -11.089 -13.810 6.871 1.00 37.62 ? 503 GLU F C 1 +ATOM 32525 O O . GLU F 1 503 ? -10.903 -14.954 6.472 1.00 35.94 ? 503 GLU F O 1 +ATOM 32526 C CB . GLU F 1 503 ? -10.898 -12.075 5.075 1.00 42.88 ? 503 GLU F CB 1 +ATOM 32527 C CG . GLU F 1 503 ? -11.615 -11.066 4.189 1.00 52.47 ? 503 GLU F CG 1 +ATOM 32528 C CD . GLU F 1 503 ? -10.691 -10.339 3.218 1.00 57.69 ? 503 GLU F CD 1 +ATOM 32529 O OE1 . GLU F 1 503 ? -9.542 -9.999 3.604 1.00 58.86 ? 503 GLU F OE1 1 +ATOM 32530 O OE2 . GLU F 1 503 ? -11.132 -10.090 2.070 1.00 59.43 ? 503 GLU F OE2 1 +ATOM 32531 N N . ILE F 1 504 ? -10.641 -13.382 8.046 1.00 36.10 ? 504 ILE F N 1 +ATOM 32532 C CA . ILE F 1 504 ? -9.915 -14.269 8.940 1.00 33.57 ? 504 ILE F CA 1 +ATOM 32533 C C . ILE F 1 504 ? -10.864 -15.333 9.488 1.00 32.42 ? 504 ILE F C 1 +ATOM 32534 O O . ILE F 1 504 ? -10.531 -16.513 9.509 1.00 30.91 ? 504 ILE F O 1 +ATOM 32535 C CB . ILE F 1 504 ? -9.277 -13.482 10.099 1.00 33.49 ? 504 ILE F CB 1 +ATOM 32536 C CG1 . ILE F 1 504 ? -8.118 -12.641 9.563 1.00 33.48 ? 504 ILE F CG1 1 +ATOM 32537 C CG2 . ILE F 1 504 ? -8.790 -14.431 11.182 1.00 32.33 ? 504 ILE F CG2 1 +ATOM 32538 C CD1 . ILE F 1 504 ? -7.581 -11.623 10.567 1.00 33.09 ? 504 ILE F CD1 1 +ATOM 32539 N N . VAL F 1 505 ? -12.048 -14.915 9.920 1.00 32.05 ? 505 VAL F N 1 +ATOM 32540 C CA . VAL F 1 505 ? -13.036 -15.844 10.445 1.00 32.58 ? 505 VAL F CA 1 +ATOM 32541 C C . VAL F 1 505 ? -13.490 -16.824 9.363 1.00 34.15 ? 505 VAL F C 1 +ATOM 32542 O O . VAL F 1 505 ? -13.678 -18.015 9.630 1.00 35.71 ? 505 VAL F O 1 +ATOM 32543 C CB . VAL F 1 505 ? -14.265 -15.096 11.012 1.00 32.95 ? 505 VAL F CB 1 +ATOM 32544 C CG1 . VAL F 1 505 ? -15.330 -16.092 11.458 1.00 31.71 ? 505 VAL F CG1 1 +ATOM 32545 C CG2 . VAL F 1 505 ? -13.839 -14.229 12.191 1.00 32.79 ? 505 VAL F CG2 1 +ATOM 32546 N N . GLU F 1 506 ? -13.658 -16.340 8.137 1.00 34.51 ? 506 GLU F N 1 +ATOM 32547 C CA . GLU F 1 506 ? -14.073 -17.226 7.057 1.00 36.02 ? 506 GLU F CA 1 +ATOM 32548 C C . GLU F 1 506 ? -12.978 -18.255 6.791 1.00 34.55 ? 506 GLU F C 1 +ATOM 32549 O O . GLU F 1 506 ? -13.267 -19.420 6.513 1.00 33.66 ? 506 GLU F O 1 +ATOM 32550 C CB . GLU F 1 506 ? -14.381 -16.429 5.779 1.00 37.82 ? 506 GLU F CB 1 +ATOM 32551 C CG . GLU F 1 506 ? -15.555 -15.487 5.959 1.00 46.08 ? 506 GLU F CG 1 +ATOM 32552 C CD . GLU F 1 506 ? -15.830 -14.607 4.746 1.00 51.75 ? 506 GLU F CD 1 +ATOM 32553 O OE1 . GLU F 1 506 ? -14.862 -14.185 4.059 1.00 56.01 ? 506 GLU F OE1 1 +ATOM 32554 O OE2 . GLU F 1 506 ? -17.022 -14.315 4.497 1.00 52.01 ? 506 GLU F OE2 1 +ATOM 32555 N N . LEU F 1 507 ? -11.721 -17.827 6.886 1.00 33.34 ? 507 LEU F N 1 +ATOM 32556 C CA . LEU F 1 507 ? -10.608 -18.730 6.656 1.00 31.72 ? 507 LEU F CA 1 +ATOM 32557 C C . LEU F 1 507 ? -10.581 -19.792 7.758 1.00 32.27 ? 507 LEU F C 1 +ATOM 32558 O O . LEU F 1 507 ? -10.215 -20.943 7.509 1.00 30.79 ? 507 LEU F O 1 +ATOM 32559 C CB . LEU F 1 507 ? -9.283 -17.966 6.626 1.00 32.31 ? 507 LEU F CB 1 +ATOM 32560 C CG . LEU F 1 507 ? -8.057 -18.824 6.271 1.00 33.25 ? 507 LEU F CG 1 +ATOM 32561 C CD1 . LEU F 1 507 ? -8.206 -19.349 4.853 1.00 31.49 ? 507 LEU F CD1 1 +ATOM 32562 C CD2 . LEU F 1 507 ? -6.778 -18.013 6.392 1.00 32.32 ? 507 LEU F CD2 1 +ATOM 32563 N N . ARG F 1 508 ? -10.978 -19.420 8.971 1.00 31.36 ? 508 ARG F N 1 +ATOM 32564 C CA . ARG F 1 508 ? -10.990 -20.395 10.054 1.00 32.78 ? 508 ARG F CA 1 +ATOM 32565 C C . ARG F 1 508 ? -12.035 -21.464 9.749 1.00 32.95 ? 508 ARG F C 1 +ATOM 32566 O O . ARG F 1 508 ? -11.763 -22.655 9.861 1.00 31.55 ? 508 ARG F O 1 +ATOM 32567 C CB . ARG F 1 508 ? -11.317 -19.744 11.398 1.00 32.85 ? 508 ARG F CB 1 +ATOM 32568 C CG . ARG F 1 508 ? -11.337 -20.737 12.548 1.00 30.68 ? 508 ARG F CG 1 +ATOM 32569 C CD . ARG F 1 508 ? -11.910 -20.119 13.809 1.00 31.53 ? 508 ARG F CD 1 +ATOM 32570 N NE . ARG F 1 508 ? -12.088 -21.118 14.859 1.00 32.77 ? 508 ARG F NE 1 +ATOM 32571 C CZ . ARG F 1 508 ? -11.093 -21.711 15.512 1.00 31.01 ? 508 ARG F CZ 1 +ATOM 32572 N NH1 . ARG F 1 508 ? -9.836 -21.406 15.226 1.00 30.47 ? 508 ARG F NH1 1 +ATOM 32573 N NH2 . ARG F 1 508 ? -11.360 -22.603 16.454 1.00 28.56 ? 508 ARG F NH2 1 +ATOM 32574 N N . TYR F 1 509 ? -13.233 -21.038 9.360 1.00 32.48 ? 509 TYR F N 1 +ATOM 32575 C CA . TYR F 1 509 ? -14.291 -21.988 9.045 1.00 32.76 ? 509 TYR F CA 1 +ATOM 32576 C C . TYR F 1 509 ? -13.903 -22.874 7.861 1.00 32.77 ? 509 TYR F C 1 +ATOM 32577 O O . TYR F 1 509 ? -14.338 -24.019 7.757 1.00 31.28 ? 509 TYR F O 1 +ATOM 32578 C CB . TYR F 1 509 ? -15.601 -21.251 8.768 1.00 32.84 ? 509 TYR F CB 1 +ATOM 32579 C CG . TYR F 1 509 ? -16.352 -20.894 10.027 1.00 32.13 ? 509 TYR F CG 1 +ATOM 32580 C CD1 . TYR F 1 509 ? -16.968 -21.882 10.797 1.00 33.27 ? 509 TYR F CD1 1 +ATOM 32581 C CD2 . TYR F 1 509 ? -16.429 -19.575 10.465 1.00 33.54 ? 509 TYR F CD2 1 +ATOM 32582 C CE1 . TYR F 1 509 ? -17.647 -21.559 11.978 1.00 34.75 ? 509 TYR F CE1 1 +ATOM 32583 C CE2 . TYR F 1 509 ? -17.101 -19.238 11.640 1.00 34.14 ? 509 TYR F CE2 1 +ATOM 32584 C CZ . TYR F 1 509 ? -17.708 -20.229 12.392 1.00 35.34 ? 509 TYR F CZ 1 +ATOM 32585 O OH . TYR F 1 509 ? -18.373 -19.890 13.554 1.00 35.82 ? 509 TYR F OH 1 +ATOM 32586 N N . LYS F 1 510 ? -13.067 -22.352 6.976 1.00 32.78 ? 510 LYS F N 1 +ATOM 32587 C CA . LYS F 1 510 ? -12.614 -23.133 5.835 1.00 33.39 ? 510 LYS F CA 1 +ATOM 32588 C C . LYS F 1 510 ? -11.705 -24.287 6.294 1.00 34.02 ? 510 LYS F C 1 +ATOM 32589 O O . LYS F 1 510 ? -11.677 -25.361 5.681 1.00 31.43 ? 510 LYS F O 1 +ATOM 32590 C CB . LYS F 1 510 ? -11.863 -22.240 4.856 1.00 34.11 ? 510 LYS F CB 1 +ATOM 32591 C CG . LYS F 1 510 ? -11.328 -22.984 3.654 1.00 36.56 ? 510 LYS F CG 1 +ATOM 32592 C CD . LYS F 1 510 ? -10.814 -22.042 2.601 1.00 40.23 ? 510 LYS F CD 1 +ATOM 32593 C CE . LYS F 1 510 ? -10.376 -22.801 1.373 1.00 43.15 ? 510 LYS F CE 1 +ATOM 32594 N NZ . LYS F 1 510 ? -10.011 -21.878 0.265 1.00 48.38 ? 510 LYS F NZ 1 +ATOM 32595 N N . PHE F 1 511 ? -10.971 -24.060 7.379 1.00 34.71 ? 511 PHE F N 1 +ATOM 32596 C CA . PHE F 1 511 ? -10.070 -25.069 7.929 1.00 34.20 ? 511 PHE F CA 1 +ATOM 32597 C C . PHE F 1 511 ? -10.686 -25.858 9.075 1.00 34.29 ? 511 PHE F C 1 +ATOM 32598 O O . PHE F 1 511 ? -10.058 -26.774 9.597 1.00 33.54 ? 511 PHE F O 1 +ATOM 32599 C CB . PHE F 1 511 ? -8.782 -24.412 8.416 1.00 33.87 ? 511 PHE F CB 1 +ATOM 32600 C CG . PHE F 1 511 ? -7.764 -24.217 7.341 1.00 34.62 ? 511 PHE F CG 1 +ATOM 32601 C CD1 . PHE F 1 511 ? -6.887 -25.239 7.013 1.00 33.94 ? 511 PHE F CD1 1 +ATOM 32602 C CD2 . PHE F 1 511 ? -7.684 -23.017 6.643 1.00 35.21 ? 511 PHE F CD2 1 +ATOM 32603 C CE1 . PHE F 1 511 ? -5.937 -25.071 6.002 1.00 33.88 ? 511 PHE F CE1 1 +ATOM 32604 C CE2 . PHE F 1 511 ? -6.740 -22.841 5.632 1.00 34.34 ? 511 PHE F CE2 1 +ATOM 32605 C CZ . PHE F 1 511 ? -5.865 -23.874 5.313 1.00 33.20 ? 511 PHE F CZ 1 +ATOM 32606 N N . LEU F 1 512 ? -11.912 -25.519 9.462 1.00 34.33 ? 512 LEU F N 1 +ATOM 32607 C CA . LEU F 1 512 ? -12.555 -26.214 10.568 1.00 35.51 ? 512 LEU F CA 1 +ATOM 32608 C C . LEU F 1 512 ? -12.514 -27.749 10.454 1.00 36.13 ? 512 LEU F C 1 +ATOM 32609 O O . LEU F 1 512 ? -12.245 -28.447 11.436 1.00 36.46 ? 512 LEU F O 1 +ATOM 32610 C CB . LEU F 1 512 ? -14.001 -25.738 10.728 1.00 36.84 ? 512 LEU F CB 1 +ATOM 32611 C CG . LEU F 1 512 ? -14.588 -25.990 12.119 1.00 39.46 ? 512 LEU F CG 1 +ATOM 32612 C CD1 . LEU F 1 512 ? -13.752 -25.237 13.157 1.00 40.66 ? 512 LEU F CD1 1 +ATOM 32613 C CD2 . LEU F 1 512 ? -16.038 -25.532 12.172 1.00 39.89 ? 512 LEU F CD2 1 +ATOM 32614 N N . PRO F 1 513 ? -12.791 -28.301 9.260 1.00 36.33 ? 513 PRO F N 1 +ATOM 32615 C CA . PRO F 1 513 ? -12.763 -29.761 9.093 1.00 35.29 ? 513 PRO F CA 1 +ATOM 32616 C C . PRO F 1 513 ? -11.436 -30.389 9.519 1.00 34.19 ? 513 PRO F C 1 +ATOM 32617 O O . PRO F 1 513 ? -11.408 -31.464 10.107 1.00 34.52 ? 513 PRO F O 1 +ATOM 32618 C CB . PRO F 1 513 ? -13.035 -29.934 7.605 1.00 34.49 ? 513 PRO F CB 1 +ATOM 32619 C CG . PRO F 1 513 ? -13.981 -28.815 7.328 1.00 35.42 ? 513 PRO F CG 1 +ATOM 32620 C CD . PRO F 1 513 ? -13.332 -27.652 8.051 1.00 35.96 ? 513 PRO F CD 1 +ATOM 32621 N N . TYR F 1 514 ? -10.334 -29.718 9.211 1.00 34.71 ? 514 TYR F N 1 +ATOM 32622 C CA . TYR F 1 514 ? -9.016 -30.211 9.585 1.00 34.40 ? 514 TYR F CA 1 +ATOM 32623 C C . TYR F 1 514 ? -8.848 -30.096 11.097 1.00 34.97 ? 514 TYR F C 1 +ATOM 32624 O O . TYR F 1 514 ? -8.420 -31.038 11.759 1.00 35.73 ? 514 TYR F O 1 +ATOM 32625 C CB . TYR F 1 514 ? -7.934 -29.400 8.870 1.00 33.06 ? 514 TYR F CB 1 +ATOM 32626 C CG . TYR F 1 514 ? -6.522 -29.760 9.263 1.00 32.70 ? 514 TYR F CG 1 +ATOM 32627 C CD1 . TYR F 1 514 ? -6.072 -31.076 9.200 1.00 32.06 ? 514 TYR F CD1 1 +ATOM 32628 C CD2 . TYR F 1 514 ? -5.619 -28.775 9.675 1.00 33.04 ? 514 TYR F CD2 1 +ATOM 32629 C CE1 . TYR F 1 514 ? -4.753 -31.408 9.535 1.00 30.24 ? 514 TYR F CE1 1 +ATOM 32630 C CE2 . TYR F 1 514 ? -4.302 -29.094 10.011 1.00 31.36 ? 514 TYR F CE2 1 +ATOM 32631 C CZ . TYR F 1 514 ? -3.876 -30.413 9.940 1.00 31.60 ? 514 TYR F CZ 1 +ATOM 32632 O OH . TYR F 1 514 ? -2.577 -30.729 10.284 1.00 29.76 ? 514 TYR F OH 1 +ATOM 32633 N N . ILE F 1 515 ? -9.201 -28.938 11.639 1.00 34.28 ? 515 ILE F N 1 +ATOM 32634 C CA . ILE F 1 515 ? -9.088 -28.709 13.063 1.00 35.04 ? 515 ILE F CA 1 +ATOM 32635 C C . ILE F 1 515 ? -9.915 -29.737 13.826 1.00 34.67 ? 515 ILE F C 1 +ATOM 32636 O O . ILE F 1 515 ? -9.448 -30.316 14.807 1.00 34.85 ? 515 ILE F O 1 +ATOM 32637 C CB . ILE F 1 515 ? -9.568 -27.280 13.438 1.00 35.98 ? 515 ILE F CB 1 +ATOM 32638 C CG1 . ILE F 1 515 ? -8.598 -26.245 12.867 1.00 37.29 ? 515 ILE F CG1 1 +ATOM 32639 C CG2 . ILE F 1 515 ? -9.673 -27.127 14.952 1.00 34.24 ? 515 ILE F CG2 1 +ATOM 32640 C CD1 . ILE F 1 515 ? -9.114 -24.805 12.950 1.00 39.32 ? 515 ILE F CD1 1 +ATOM 32641 N N . TYR F 1 516 ? -11.142 -29.972 13.379 1.00 33.50 ? 516 TYR F N 1 +ATOM 32642 C CA . TYR F 1 516 ? -11.997 -30.925 14.076 1.00 34.18 ? 516 TYR F CA 1 +ATOM 32643 C C . TYR F 1 516 ? -11.465 -32.355 13.982 1.00 34.10 ? 516 TYR F C 1 +ATOM 32644 O O . TYR F 1 516 ? -11.644 -33.148 14.907 1.00 32.44 ? 516 TYR F O 1 +ATOM 32645 C CB . TYR F 1 516 ? -13.426 -30.868 13.542 1.00 34.71 ? 516 TYR F CB 1 +ATOM 32646 C CG . TYR F 1 516 ? -14.404 -31.515 14.480 1.00 35.06 ? 516 TYR F CG 1 +ATOM 32647 C CD1 . TYR F 1 516 ? -14.425 -31.170 15.833 1.00 35.00 ? 516 TYR F CD1 1 +ATOM 32648 C CD2 . TYR F 1 516 ? -15.315 -32.466 14.028 1.00 36.55 ? 516 TYR F CD2 1 +ATOM 32649 C CE1 . TYR F 1 516 ? -15.330 -31.753 16.714 1.00 34.26 ? 516 TYR F CE1 1 +ATOM 32650 C CE2 . TYR F 1 516 ? -16.231 -33.062 14.905 1.00 35.60 ? 516 TYR F CE2 1 +ATOM 32651 C CZ . TYR F 1 516 ? -16.228 -32.695 16.246 1.00 35.24 ? 516 TYR F CZ 1 +ATOM 32652 O OH . TYR F 1 516 ? -17.127 -33.257 17.113 1.00 35.18 ? 516 TYR F OH 1 +ATOM 32653 N N . SER F 1 517 ? -10.827 -32.687 12.862 1.00 32.47 ? 517 SER F N 1 +ATOM 32654 C CA . SER F 1 517 ? -10.251 -34.013 12.704 1.00 32.75 ? 517 SER F CA 1 +ATOM 32655 C C . SER F 1 517 ? -9.124 -34.169 13.730 1.00 32.51 ? 517 SER F C 1 +ATOM 32656 O O . SER F 1 517 ? -8.940 -35.241 14.300 1.00 33.41 ? 517 SER F O 1 +ATOM 32657 C CB . SER F 1 517 ? -9.695 -34.196 11.287 1.00 33.75 ? 517 SER F CB 1 +ATOM 32658 O OG . SER F 1 517 ? -10.721 -34.077 10.320 1.00 35.65 ? 517 SER F OG 1 +ATOM 32659 N N . LEU F 1 518 ? -8.371 -33.096 13.967 1.00 31.16 ? 518 LEU F N 1 +ATOM 32660 C CA . LEU F 1 518 ? -7.281 -33.137 14.939 1.00 30.48 ? 518 LEU F CA 1 +ATOM 32661 C C . LEU F 1 518 ? -7.869 -33.264 16.344 1.00 31.04 ? 518 LEU F C 1 +ATOM 32662 O O . LEU F 1 518 ? -7.263 -33.867 17.236 1.00 29.28 ? 518 LEU F O 1 +ATOM 32663 C CB . LEU F 1 518 ? -6.417 -31.878 14.832 1.00 28.93 ? 518 LEU F CB 1 +ATOM 32664 C CG . LEU F 1 518 ? -5.634 -31.754 13.522 1.00 30.02 ? 518 LEU F CG 1 +ATOM 32665 C CD1 . LEU F 1 518 ? -4.995 -30.364 13.427 1.00 29.04 ? 518 LEU F CD1 1 +ATOM 32666 C CD2 . LEU F 1 518 ? -4.592 -32.854 13.445 1.00 25.83 ? 518 LEU F CD2 1 +ATOM 32667 N N . ALA F 1 519 ? -9.062 -32.704 16.532 1.00 30.57 ? 519 ALA F N 1 +ATOM 32668 C CA . ALA F 1 519 ? -9.738 -32.789 17.813 1.00 30.47 ? 519 ALA F CA 1 +ATOM 32669 C C . ALA F 1 519 ? -10.107 -34.245 18.061 1.00 31.63 ? 519 ALA F C 1 +ATOM 32670 O O . ALA F 1 519 ? -9.985 -34.736 19.179 1.00 32.30 ? 519 ALA F O 1 +ATOM 32671 C CB . ALA F 1 519 ? -10.987 -31.919 17.814 1.00 30.92 ? 519 ALA F CB 1 +ATOM 32672 N N . LEU F 1 520 ? -10.566 -34.935 17.018 1.00 32.61 ? 520 LEU F N 1 +ATOM 32673 C CA . LEU F 1 520 ? -10.925 -36.344 17.144 1.00 33.79 ? 520 LEU F CA 1 +ATOM 32674 C C . LEU F 1 520 ? -9.669 -37.134 17.521 1.00 34.86 ? 520 LEU F C 1 +ATOM 32675 O O . LEU F 1 520 ? -9.703 -38.009 18.393 1.00 32.37 ? 520 LEU F O 1 +ATOM 32676 C CB . LEU F 1 520 ? -11.487 -36.881 15.825 1.00 34.87 ? 520 LEU F CB 1 +ATOM 32677 C CG . LEU F 1 520 ? -11.697 -38.409 15.768 1.00 36.54 ? 520 LEU F CG 1 +ATOM 32678 C CD1 . LEU F 1 520 ? -12.743 -38.837 16.803 1.00 34.71 ? 520 LEU F CD1 1 +ATOM 32679 C CD2 . LEU F 1 520 ? -12.134 -38.817 14.363 1.00 36.39 ? 520 LEU F CD2 1 +ATOM 32680 N N . GLU F 1 521 ? -8.566 -36.816 16.850 1.00 35.65 ? 521 GLU F N 1 +ATOM 32681 C CA . GLU F 1 521 ? -7.281 -37.462 17.104 1.00 37.52 ? 521 GLU F CA 1 +ATOM 32682 C C . GLU F 1 521 ? -6.869 -37.217 18.563 1.00 38.91 ? 521 GLU F C 1 +ATOM 32683 O O . GLU F 1 521 ? -6.339 -38.107 19.228 1.00 38.94 ? 521 GLU F O 1 +ATOM 32684 C CB . GLU F 1 521 ? -6.233 -36.887 16.149 1.00 40.23 ? 521 GLU F CB 1 +ATOM 32685 C CG . GLU F 1 521 ? -4.863 -37.552 16.177 1.00 46.45 ? 521 GLU F CG 1 +ATOM 32686 C CD . GLU F 1 521 ? -3.818 -36.768 15.367 1.00 50.96 ? 521 GLU F CD 1 +ATOM 32687 O OE1 . GLU F 1 521 ? -4.083 -36.464 14.180 1.00 52.92 ? 521 GLU F OE1 1 +ATOM 32688 O OE2 . GLU F 1 521 ? -2.730 -36.454 15.912 1.00 52.65 ? 521 GLU F OE2 1 +ATOM 32689 N N . ALA F 1 522 ? -7.118 -36.009 19.063 1.00 38.87 ? 522 ALA F N 1 +ATOM 32690 C CA . ALA F 1 522 ? -6.775 -35.682 20.442 1.00 38.62 ? 522 ALA F CA 1 +ATOM 32691 C C . ALA F 1 522 ? -7.570 -36.550 21.418 1.00 38.84 ? 522 ALA F C 1 +ATOM 32692 O O . ALA F 1 522 ? -7.010 -37.113 22.351 1.00 38.56 ? 522 ALA F O 1 +ATOM 32693 C CB . ALA F 1 522 ? -7.048 -34.201 20.714 1.00 37.97 ? 522 ALA F CB 1 +ATOM 32694 N N . SER F 1 523 ? -8.874 -36.665 21.193 1.00 39.94 ? 523 SER F N 1 +ATOM 32695 C CA . SER F 1 523 ? -9.735 -37.453 22.068 1.00 41.48 ? 523 SER F CA 1 +ATOM 32696 C C . SER F 1 523 ? -9.478 -38.952 21.965 1.00 42.23 ? 523 SER F C 1 +ATOM 32697 O O . SER F 1 523 ? -9.844 -39.702 22.858 1.00 41.66 ? 523 SER F O 1 +ATOM 32698 C CB . SER F 1 523 ? -11.213 -37.178 21.759 1.00 40.05 ? 523 SER F CB 1 +ATOM 32699 O OG . SER F 1 523 ? -11.557 -37.648 20.468 1.00 43.25 ? 523 SER F OG 1 +ATOM 32700 N N . GLU F 1 524 ? -8.858 -39.391 20.876 1.00 44.89 ? 524 GLU F N 1 +ATOM 32701 C CA . GLU F 1 524 ? -8.582 -40.818 20.697 1.00 47.18 ? 524 GLU F CA 1 +ATOM 32702 C C . GLU F 1 524 ? -7.161 -41.217 21.091 1.00 47.32 ? 524 GLU F C 1 +ATOM 32703 O O . GLU F 1 524 ? -6.951 -42.289 21.660 1.00 47.31 ? 524 GLU F O 1 +ATOM 32704 C CB . GLU F 1 524 ? -8.814 -41.245 19.243 1.00 48.51 ? 524 GLU F CB 1 +ATOM 32705 C CG . GLU F 1 524 ? -10.219 -41.018 18.729 1.00 53.51 ? 524 GLU F CG 1 +ATOM 32706 C CD . GLU F 1 524 ? -10.439 -41.609 17.338 1.00 56.62 ? 524 GLU F CD 1 +ATOM 32707 O OE1 . GLU F 1 524 ? -9.611 -41.358 16.431 1.00 58.04 ? 524 GLU F OE1 1 +ATOM 32708 O OE2 . GLU F 1 524 ? -11.452 -42.318 17.152 1.00 57.65 ? 524 GLU F OE2 1 +ATOM 32709 N N . LYS F 1 525 ? -6.186 -40.364 20.797 1.00 46.32 ? 525 LYS F N 1 +ATOM 32710 C CA . LYS F 1 525 ? -4.808 -40.695 21.109 1.00 47.54 ? 525 LYS F CA 1 +ATOM 32711 C C . LYS F 1 525 ? -4.121 -39.735 22.066 1.00 46.95 ? 525 LYS F C 1 +ATOM 32712 O O . LYS F 1 525 ? -3.026 -40.019 22.545 1.00 45.73 ? 525 LYS F O 1 +ATOM 32713 C CB . LYS F 1 525 ? -4.009 -40.806 19.811 1.00 49.15 ? 525 LYS F CB 1 +ATOM 32714 C CG . LYS F 1 525 ? -4.586 -41.834 18.851 1.00 53.61 ? 525 LYS F CG 1 +ATOM 32715 C CD . LYS F 1 525 ? -3.825 -41.875 17.531 1.00 57.99 ? 525 LYS F CD 1 +ATOM 32716 C CE . LYS F 1 525 ? -4.367 -42.971 16.604 1.00 60.40 ? 525 LYS F CE 1 +ATOM 32717 N NZ . LYS F 1 525 ? -5.822 -42.800 16.290 1.00 63.41 ? 525 LYS F NZ 1 +ATOM 32718 N N . GLY F 1 526 ? -4.760 -38.604 22.346 1.00 46.14 ? 526 GLY F N 1 +ATOM 32719 C CA . GLY F 1 526 ? -4.162 -37.646 23.250 1.00 44.97 ? 526 GLY F CA 1 +ATOM 32720 C C . GLY F 1 526 ? -3.108 -36.763 22.609 1.00 44.83 ? 526 GLY F C 1 +ATOM 32721 O O . GLY F 1 526 ? -2.238 -36.240 23.300 1.00 46.07 ? 526 GLY F O 1 +ATOM 32722 N N . HIS F 1 527 ? -3.162 -36.604 21.292 1.00 43.30 ? 527 HIS F N 1 +ATOM 32723 C CA . HIS F 1 527 ? -2.209 -35.737 20.604 1.00 42.15 ? 527 HIS F CA 1 +ATOM 32724 C C . HIS F 1 527 ? -2.778 -34.322 20.641 1.00 41.39 ? 527 HIS F C 1 +ATOM 32725 O O . HIS F 1 527 ? -3.970 -34.116 20.399 1.00 40.72 ? 527 HIS F O 1 +ATOM 32726 C CB . HIS F 1 527 ? -2.037 -36.162 19.148 1.00 43.29 ? 527 HIS F CB 1 +ATOM 32727 C CG . HIS F 1 527 ? -1.491 -37.543 18.977 1.00 45.15 ? 527 HIS F CG 1 +ATOM 32728 N ND1 . HIS F 1 527 ? -1.515 -38.207 17.768 1.00 44.50 ? 527 HIS F ND1 1 +ATOM 32729 C CD2 . HIS F 1 527 ? -0.896 -38.383 19.856 1.00 45.48 ? 527 HIS F CD2 1 +ATOM 32730 C CE1 . HIS F 1 527 ? -0.959 -39.396 17.911 1.00 45.57 ? 527 HIS F CE1 1 +ATOM 32731 N NE2 . HIS F 1 527 ? -0.574 -39.527 19.169 1.00 46.70 ? 527 HIS F NE2 1 +ATOM 32732 N N . PRO F 1 528 ? -1.943 -33.328 20.961 1.00 40.29 ? 528 PRO F N 1 +ATOM 32733 C CA . PRO F 1 528 ? -2.473 -31.962 20.996 1.00 38.85 ? 528 PRO F CA 1 +ATOM 32734 C C . PRO F 1 528 ? -2.813 -31.423 19.600 1.00 38.12 ? 528 PRO F C 1 +ATOM 32735 O O . PRO F 1 528 ? -2.209 -31.821 18.608 1.00 38.37 ? 528 PRO F O 1 +ATOM 32736 C CB . PRO F 1 528 ? -1.352 -31.178 21.673 1.00 38.36 ? 528 PRO F CB 1 +ATOM 32737 C CG . PRO F 1 528 ? -0.123 -31.943 21.292 1.00 39.04 ? 528 PRO F CG 1 +ATOM 32738 C CD . PRO F 1 528 ? -0.554 -33.375 21.450 1.00 39.09 ? 528 PRO F CD 1 +ATOM 32739 N N . VAL F 1 529 ? -3.788 -30.526 19.530 1.00 37.08 ? 529 VAL F N 1 +ATOM 32740 C CA . VAL F 1 529 ? -4.187 -29.932 18.262 1.00 35.30 ? 529 VAL F CA 1 +ATOM 32741 C C . VAL F 1 529 ? -3.116 -28.954 17.776 1.00 34.74 ? 529 VAL F C 1 +ATOM 32742 O O . VAL F 1 529 ? -2.580 -29.117 16.679 1.00 35.02 ? 529 VAL F O 1 +ATOM 32743 C CB . VAL F 1 529 ? -5.533 -29.199 18.395 1.00 35.05 ? 529 VAL F CB 1 +ATOM 32744 C CG1 . VAL F 1 529 ? -5.889 -28.531 17.085 1.00 33.13 ? 529 VAL F CG1 1 +ATOM 32745 C CG2 . VAL F 1 529 ? -6.613 -30.188 18.807 1.00 34.69 ? 529 VAL F CG2 1 +ATOM 32746 N N . ILE F 1 530 ? -2.800 -27.936 18.575 1.00 32.73 ? 530 ILE F N 1 +ATOM 32747 C CA . ILE F 1 530 ? -1.761 -26.996 18.167 1.00 31.91 ? 530 ILE F CA 1 +ATOM 32748 C C . ILE F 1 530 ? -0.489 -27.422 18.878 1.00 31.87 ? 530 ILE F C 1 +ATOM 32749 O O . ILE F 1 530 ? -0.535 -27.867 20.022 1.00 30.52 ? 530 ILE F O 1 +ATOM 32750 C CB . ILE F 1 530 ? -2.108 -25.535 18.520 1.00 31.10 ? 530 ILE F CB 1 +ATOM 32751 C CG1 . ILE F 1 530 ? -2.383 -25.403 20.008 1.00 30.01 ? 530 ILE F CG1 1 +ATOM 32752 C CG2 . ILE F 1 530 ? -3.305 -25.066 17.680 1.00 31.13 ? 530 ILE F CG2 1 +ATOM 32753 C CD1 . ILE F 1 530 ? -2.563 -23.969 20.439 1.00 32.12 ? 530 ILE F CD1 1 +ATOM 32754 N N . ARG F 1 531 ? 0.647 -27.293 18.205 1.00 31.10 ? 531 ARG F N 1 +ATOM 32755 C CA . ARG F 1 531 ? 1.895 -27.745 18.795 1.00 33.04 ? 531 ARG F CA 1 +ATOM 32756 C C . ARG F 1 531 ? 3.082 -26.853 18.533 1.00 32.93 ? 531 ARG F C 1 +ATOM 32757 O O . ARG F 1 531 ? 3.186 -26.219 17.483 1.00 31.95 ? 531 ARG F O 1 +ATOM 32758 C CB . ARG F 1 531 ? 2.252 -29.127 18.238 1.00 33.68 ? 531 ARG F CB 1 +ATOM 32759 C CG . ARG F 1 531 ? 1.048 -30.011 18.026 1.00 37.42 ? 531 ARG F CG 1 +ATOM 32760 C CD . ARG F 1 531 ? 1.300 -31.145 17.046 1.00 37.10 ? 531 ARG F CD 1 +ATOM 32761 N NE . ARG F 1 531 ? 0.118 -31.994 16.981 1.00 37.48 ? 531 ARG F NE 1 +ATOM 32762 C CZ . ARG F 1 531 ? 0.037 -33.129 16.307 1.00 36.80 ? 531 ARG F CZ 1 +ATOM 32763 N NH1 . ARG F 1 531 ? 1.078 -33.575 15.623 1.00 37.39 ? 531 ARG F NH1 1 +ATOM 32764 N NH2 . ARG F 1 531 ? -1.096 -33.816 16.321 1.00 38.45 ? 531 ARG F NH2 1 +ATOM 32765 N N . PRO F 1 532 ? 4.001 -26.793 19.495 1.00 32.83 ? 532 PRO F N 1 +ATOM 32766 C CA . PRO F 1 532 ? 5.195 -25.973 19.306 1.00 33.11 ? 532 PRO F CA 1 +ATOM 32767 C C . PRO F 1 532 ? 6.023 -26.749 18.287 1.00 32.64 ? 532 PRO F C 1 +ATOM 32768 O O . PRO F 1 532 ? 5.844 -27.957 18.147 1.00 32.36 ? 532 PRO F O 1 +ATOM 32769 C CB . PRO F 1 532 ? 5.828 -25.950 20.706 1.00 34.47 ? 532 PRO F CB 1 +ATOM 32770 C CG . PRO F 1 532 ? 5.359 -27.233 21.331 1.00 33.31 ? 532 PRO F CG 1 +ATOM 32771 C CD . PRO F 1 532 ? 3.919 -27.313 20.873 1.00 34.04 ? 532 PRO F CD 1 +ATOM 32772 N N . LEU F 1 533 ? 6.918 -26.077 17.573 1.00 33.80 ? 533 LEU F N 1 +ATOM 32773 C CA . LEU F 1 533 ? 7.727 -26.761 16.570 1.00 34.51 ? 533 LEU F CA 1 +ATOM 32774 C C . LEU F 1 533 ? 8.553 -27.920 17.112 1.00 35.57 ? 533 LEU F C 1 +ATOM 32775 O O . LEU F 1 533 ? 8.723 -28.929 16.424 1.00 37.87 ? 533 LEU F O 1 +ATOM 32776 C CB . LEU F 1 533 ? 8.661 -25.780 15.849 1.00 33.48 ? 533 LEU F CB 1 +ATOM 32777 C CG . LEU F 1 533 ? 8.010 -24.581 15.152 1.00 36.17 ? 533 LEU F CG 1 +ATOM 32778 C CD1 . LEU F 1 533 ? 8.975 -23.997 14.133 1.00 34.68 ? 533 LEU F CD1 1 +ATOM 32779 C CD2 . LEU F 1 533 ? 6.721 -25.005 14.477 1.00 36.62 ? 533 LEU F CD2 1 +ATOM 32780 N N . PHE F 1 534 ? 9.066 -27.803 18.333 1.00 33.94 ? 534 PHE F N 1 +ATOM 32781 C CA . PHE F 1 534 ? 9.888 -28.881 18.852 1.00 35.34 ? 534 PHE F CA 1 +ATOM 32782 C C . PHE F 1 534 ? 9.121 -30.181 19.047 1.00 36.22 ? 534 PHE F C 1 +ATOM 32783 O O . PHE F 1 534 ? 9.716 -31.245 19.198 1.00 36.20 ? 534 PHE F O 1 +ATOM 32784 C CB . PHE F 1 534 ? 10.624 -28.461 20.149 1.00 33.92 ? 534 PHE F CB 1 +ATOM 32785 C CG . PHE F 1 534 ? 9.724 -28.065 21.282 1.00 32.58 ? 534 PHE F CG 1 +ATOM 32786 C CD1 . PHE F 1 534 ? 8.966 -29.010 21.954 1.00 31.91 ? 534 PHE F CD1 1 +ATOM 32787 C CD2 . PHE F 1 534 ? 9.651 -26.739 21.690 1.00 33.20 ? 534 PHE F CD2 1 +ATOM 32788 C CE1 . PHE F 1 534 ? 8.149 -28.646 23.012 1.00 31.37 ? 534 PHE F CE1 1 +ATOM 32789 C CE2 . PHE F 1 534 ? 8.834 -26.363 22.752 1.00 31.93 ? 534 PHE F CE2 1 +ATOM 32790 C CZ . PHE F 1 534 ? 8.083 -27.318 23.412 1.00 33.27 ? 534 PHE F CZ 1 +ATOM 32791 N N . TYR F 1 535 ? 7.796 -30.112 19.020 1.00 37.75 ? 535 TYR F N 1 +ATOM 32792 C CA . TYR F 1 535 ? 7.002 -31.324 19.193 1.00 37.01 ? 535 TYR F CA 1 +ATOM 32793 C C . TYR F 1 535 ? 7.164 -32.263 18.000 1.00 37.68 ? 535 TYR F C 1 +ATOM 32794 O O . TYR F 1 535 ? 7.240 -33.478 18.170 1.00 37.29 ? 535 TYR F O 1 +ATOM 32795 C CB . TYR F 1 535 ? 5.534 -30.970 19.392 1.00 35.10 ? 535 TYR F CB 1 +ATOM 32796 C CG . TYR F 1 535 ? 4.615 -32.159 19.485 1.00 34.05 ? 535 TYR F CG 1 +ATOM 32797 C CD1 . TYR F 1 535 ? 4.170 -32.814 18.335 1.00 33.77 ? 535 TYR F CD1 1 +ATOM 32798 C CD2 . TYR F 1 535 ? 4.165 -32.618 20.720 1.00 34.79 ? 535 TYR F CD2 1 +ATOM 32799 C CE1 . TYR F 1 535 ? 3.295 -33.890 18.410 1.00 32.50 ? 535 TYR F CE1 1 +ATOM 32800 C CE2 . TYR F 1 535 ? 3.280 -33.701 20.811 1.00 34.58 ? 535 TYR F CE2 1 +ATOM 32801 C CZ . TYR F 1 535 ? 2.849 -34.327 19.645 1.00 35.31 ? 535 TYR F CZ 1 +ATOM 32802 O OH . TYR F 1 535 ? 1.947 -35.365 19.706 1.00 34.98 ? 535 TYR F OH 1 +ATOM 32803 N N . GLU F 1 536 ? 7.229 -31.696 16.799 1.00 38.75 ? 536 GLU F N 1 +ATOM 32804 C CA . GLU F 1 536 ? 7.385 -32.482 15.577 1.00 38.59 ? 536 GLU F CA 1 +ATOM 32805 C C . GLU F 1 536 ? 8.859 -32.655 15.211 1.00 38.07 ? 536 GLU F C 1 +ATOM 32806 O O . GLU F 1 536 ? 9.215 -33.573 14.476 1.00 36.54 ? 536 GLU F O 1 +ATOM 32807 C CB . GLU F 1 536 ? 6.663 -31.799 14.414 1.00 39.06 ? 536 GLU F CB 1 +ATOM 32808 C CG . GLU F 1 536 ? 5.157 -31.912 14.447 1.00 43.98 ? 536 GLU F CG 1 +ATOM 32809 C CD . GLU F 1 536 ? 4.687 -33.354 14.325 1.00 46.71 ? 536 GLU F CD 1 +ATOM 32810 O OE1 . GLU F 1 536 ? 5.235 -34.098 13.477 1.00 47.64 ? 536 GLU F OE1 1 +ATOM 32811 O OE2 . GLU F 1 536 ? 3.763 -33.744 15.067 1.00 47.19 ? 536 GLU F OE2 1 +ATOM 32812 N N . PHE F 1 537 ? 9.708 -31.766 15.720 1.00 37.39 ? 537 PHE F N 1 +ATOM 32813 C CA . PHE F 1 537 ? 11.138 -31.813 15.417 1.00 37.14 ? 537 PHE F CA 1 +ATOM 32814 C C . PHE F 1 537 ? 11.950 -31.686 16.696 1.00 36.27 ? 537 PHE F C 1 +ATOM 32815 O O . PHE F 1 537 ? 12.781 -30.794 16.824 1.00 34.65 ? 537 PHE F O 1 +ATOM 32816 C CB . PHE F 1 537 ? 11.505 -30.672 14.451 1.00 37.32 ? 537 PHE F CB 1 +ATOM 32817 C CG . PHE F 1 537 ? 10.593 -30.569 13.266 1.00 37.37 ? 537 PHE F CG 1 +ATOM 32818 C CD1 . PHE F 1 537 ? 9.416 -29.827 13.343 1.00 36.86 ? 537 PHE F CD1 1 +ATOM 32819 C CD2 . PHE F 1 537 ? 10.868 -31.275 12.097 1.00 37.02 ? 537 PHE F CD2 1 +ATOM 32820 C CE1 . PHE F 1 537 ? 8.519 -29.794 12.273 1.00 38.02 ? 537 PHE F CE1 1 +ATOM 32821 C CE2 . PHE F 1 537 ? 9.974 -31.251 11.016 1.00 37.47 ? 537 PHE F CE2 1 +ATOM 32822 C CZ . PHE F 1 537 ? 8.798 -30.511 11.106 1.00 37.40 ? 537 PHE F CZ 1 +ATOM 32823 N N . GLN F 1 538 ? 11.709 -32.601 17.628 1.00 36.87 ? 538 GLN F N 1 +ATOM 32824 C CA . GLN F 1 538 ? 12.368 -32.594 18.928 1.00 38.00 ? 538 GLN F CA 1 +ATOM 32825 C C . GLN F 1 538 ? 13.874 -32.785 18.924 1.00 39.83 ? 538 GLN F C 1 +ATOM 32826 O O . GLN F 1 538 ? 14.535 -32.499 19.922 1.00 39.42 ? 538 GLN F O 1 +ATOM 32827 C CB . GLN F 1 538 ? 11.744 -33.652 19.834 1.00 35.93 ? 538 GLN F CB 1 +ATOM 32828 C CG . GLN F 1 538 ? 12.037 -35.079 19.420 1.00 34.88 ? 538 GLN F CG 1 +ATOM 32829 C CD . GLN F 1 538 ? 11.355 -36.076 20.326 1.00 35.73 ? 538 GLN F CD 1 +ATOM 32830 O OE1 . GLN F 1 538 ? 10.128 -36.223 20.304 1.00 35.37 ? 538 GLN F OE1 1 +ATOM 32831 N NE2 . GLN F 1 538 ? 12.144 -36.757 21.147 1.00 35.65 ? 538 GLN F NE2 1 +ATOM 32832 N N . ASP F 1 539 ? 14.415 -33.254 17.809 1.00 42.21 ? 539 ASP F N 1 +ATOM 32833 C CA . ASP F 1 539 ? 15.848 -33.500 17.700 1.00 45.54 ? 539 ASP F CA 1 +ATOM 32834 C C . ASP F 1 539 ? 16.668 -32.287 17.278 1.00 45.14 ? 539 ASP F C 1 +ATOM 32835 O O . ASP F 1 539 ? 17.889 -32.352 17.254 1.00 45.57 ? 539 ASP F O 1 +ATOM 32836 C CB . ASP F 1 539 ? 16.090 -34.644 16.719 1.00 49.53 ? 539 ASP F CB 1 +ATOM 32837 C CG . ASP F 1 539 ? 15.582 -34.327 15.320 1.00 55.88 ? 539 ASP F CG 1 +ATOM 32838 O OD1 . ASP F 1 539 ? 14.409 -33.884 15.184 1.00 56.27 ? 539 ASP F OD1 1 +ATOM 32839 O OD2 . ASP F 1 539 ? 16.357 -34.522 14.353 1.00 59.28 ? 539 ASP F OD2 1 +ATOM 32840 N N . ASP F 1 540 ? 16.001 -31.188 16.943 1.00 45.78 ? 540 ASP F N 1 +ATOM 32841 C CA . ASP F 1 540 ? 16.688 -29.975 16.513 1.00 46.59 ? 540 ASP F CA 1 +ATOM 32842 C C . ASP F 1 540 ? 16.617 -28.911 17.606 1.00 46.03 ? 540 ASP F C 1 +ATOM 32843 O O . ASP F 1 540 ? 15.564 -28.328 17.848 1.00 47.31 ? 540 ASP F O 1 +ATOM 32844 C CB . ASP F 1 540 ? 16.061 -29.470 15.204 1.00 48.71 ? 540 ASP F CB 1 +ATOM 32845 C CG . ASP F 1 540 ? 16.642 -28.133 14.738 1.00 53.39 ? 540 ASP F CG 1 +ATOM 32846 O OD1 . ASP F 1 540 ? 17.786 -27.785 15.125 1.00 55.25 ? 540 ASP F OD1 1 +ATOM 32847 O OD2 . ASP F 1 540 ? 15.947 -27.432 13.963 1.00 55.52 ? 540 ASP F OD2 1 +ATOM 32848 N N . ASP F 1 541 ? 17.744 -28.658 18.263 1.00 45.41 ? 541 ASP F N 1 +ATOM 32849 C CA . ASP F 1 541 ? 17.800 -27.683 19.350 1.00 46.73 ? 541 ASP F CA 1 +ATOM 32850 C C . ASP F 1 541 ? 17.242 -26.297 19.012 1.00 46.78 ? 541 ASP F C 1 +ATOM 32851 O O . ASP F 1 541 ? 16.656 -25.638 19.871 1.00 46.39 ? 541 ASP F O 1 +ATOM 32852 C CB . ASP F 1 541 ? 19.236 -27.550 19.870 1.00 47.02 ? 541 ASP F CB 1 +ATOM 32853 C CG . ASP F 1 541 ? 19.751 -28.839 20.499 1.00 50.39 ? 541 ASP F CG 1 +ATOM 32854 O OD1 . ASP F 1 541 ? 18.924 -29.657 20.968 1.00 51.48 ? 541 ASP F OD1 1 +ATOM 32855 O OD2 . ASP F 1 541 ? 20.987 -29.031 20.538 1.00 51.74 ? 541 ASP F OD2 1 +ATOM 32856 N N . ASP F 1 542 ? 17.429 -25.858 17.771 1.00 46.51 ? 542 ASP F N 1 +ATOM 32857 C CA . ASP F 1 542 ? 16.930 -24.560 17.319 1.00 46.08 ? 542 ASP F CA 1 +ATOM 32858 C C . ASP F 1 542 ? 15.437 -24.399 17.607 1.00 43.95 ? 542 ASP F C 1 +ATOM 32859 O O . ASP F 1 542 ? 14.975 -23.337 18.004 1.00 40.90 ? 542 ASP F O 1 +ATOM 32860 C CB . ASP F 1 542 ? 17.142 -24.421 15.810 1.00 50.26 ? 542 ASP F CB 1 +ATOM 32861 C CG . ASP F 1 542 ? 18.573 -24.097 15.442 1.00 53.59 ? 542 ASP F CG 1 +ATOM 32862 O OD1 . ASP F 1 542 ? 19.498 -24.599 16.118 1.00 54.96 ? 542 ASP F OD1 1 +ATOM 32863 O OD2 . ASP F 1 542 ? 18.765 -23.346 14.459 1.00 55.70 ? 542 ASP F OD2 1 +ATOM 32864 N N . MET F 1 543 ? 14.693 -25.475 17.386 1.00 42.48 ? 543 MET F N 1 +ATOM 32865 C CA . MET F 1 543 ? 13.254 -25.483 17.575 1.00 41.42 ? 543 MET F CA 1 +ATOM 32866 C C . MET F 1 543 ? 12.768 -25.072 18.955 1.00 40.14 ? 543 MET F C 1 +ATOM 32867 O O . MET F 1 543 ? 11.647 -24.584 19.092 1.00 40.63 ? 543 MET F O 1 +ATOM 32868 C CB . MET F 1 543 ? 12.702 -26.866 17.230 1.00 42.76 ? 543 MET F CB 1 +ATOM 32869 C CG . MET F 1 543 ? 13.029 -27.323 15.820 1.00 43.17 ? 543 MET F CG 1 +ATOM 32870 S SD . MET F 1 543 ? 12.330 -26.227 14.584 1.00 46.53 ? 543 MET F SD 1 +ATOM 32871 C CE . MET F 1 543 ? 13.737 -25.206 14.148 1.00 45.41 ? 543 MET F CE 1 +ATOM 32872 N N . TYR F 1 544 ? 13.591 -25.262 19.979 1.00 38.50 ? 544 TYR F N 1 +ATOM 32873 C CA . TYR F 1 544 ? 13.168 -24.900 21.323 1.00 38.07 ? 544 TYR F CA 1 +ATOM 32874 C C . TYR F 1 544 ? 13.247 -23.408 21.614 1.00 38.95 ? 544 TYR F C 1 +ATOM 32875 O O . TYR F 1 544 ? 12.900 -22.977 22.705 1.00 39.62 ? 544 TYR F O 1 +ATOM 32876 C CB . TYR F 1 544 ? 13.970 -25.679 22.365 1.00 35.81 ? 544 TYR F CB 1 +ATOM 32877 C CG . TYR F 1 544 ? 13.770 -27.167 22.272 1.00 33.86 ? 544 TYR F CG 1 +ATOM 32878 C CD1 . TYR F 1 544 ? 14.404 -27.913 21.281 1.00 32.68 ? 544 TYR F CD1 1 +ATOM 32879 C CD2 . TYR F 1 544 ? 12.910 -27.826 23.148 1.00 31.98 ? 544 TYR F CD2 1 +ATOM 32880 C CE1 . TYR F 1 544 ? 14.184 -29.275 21.166 1.00 32.98 ? 544 TYR F CE1 1 +ATOM 32881 C CE2 . TYR F 1 544 ? 12.681 -29.186 23.041 1.00 31.42 ? 544 TYR F CE2 1 +ATOM 32882 C CZ . TYR F 1 544 ? 13.320 -29.904 22.050 1.00 32.41 ? 544 TYR F CZ 1 +ATOM 32883 O OH . TYR F 1 544 ? 13.098 -31.248 21.948 1.00 32.87 ? 544 TYR F OH 1 +ATOM 32884 N N . ARG F 1 545 ? 13.698 -22.625 20.642 1.00 41.14 ? 545 ARG F N 1 +ATOM 32885 C CA . ARG F 1 545 ? 13.794 -21.179 20.813 1.00 43.11 ? 545 ARG F CA 1 +ATOM 32886 C C . ARG F 1 545 ? 12.788 -20.460 19.922 1.00 43.94 ? 545 ARG F C 1 +ATOM 32887 O O . ARG F 1 545 ? 12.667 -19.238 19.973 1.00 43.86 ? 545 ARG F O 1 +ATOM 32888 C CB . ARG F 1 545 ? 15.206 -20.686 20.484 1.00 43.63 ? 545 ARG F CB 1 +ATOM 32889 C CG . ARG F 1 545 ? 16.285 -21.192 21.429 1.00 46.96 ? 545 ARG F CG 1 +ATOM 32890 C CD . ARG F 1 545 ? 15.975 -20.850 22.878 1.00 46.26 ? 545 ARG F CD 1 +ATOM 32891 N NE . ARG F 1 545 ? 15.963 -19.411 23.133 1.00 49.47 ? 545 ARG F NE 1 +ATOM 32892 C CZ . ARG F 1 545 ? 17.051 -18.651 23.255 1.00 50.85 ? 545 ARG F CZ 1 +ATOM 32893 N NH1 . ARG F 1 545 ? 18.259 -19.187 23.143 1.00 50.16 ? 545 ARG F NH1 1 +ATOM 32894 N NH2 . ARG F 1 545 ? 16.928 -17.349 23.503 1.00 51.07 ? 545 ARG F NH2 1 +ATOM 32895 N N . ILE F 1 546 ? 12.074 -21.216 19.094 1.00 44.91 ? 546 ILE F N 1 +ATOM 32896 C CA . ILE F 1 546 ? 11.080 -20.624 18.207 1.00 46.62 ? 546 ILE F CA 1 +ATOM 32897 C C . ILE F 1 546 ? 9.751 -20.603 18.949 1.00 47.58 ? 546 ILE F C 1 +ATOM 32898 O O . ILE F 1 546 ? 9.195 -21.654 19.259 1.00 49.23 ? 546 ILE F O 1 +ATOM 32899 C CB . ILE F 1 546 ? 10.937 -21.441 16.892 1.00 47.14 ? 546 ILE F CB 1 +ATOM 32900 C CG1 . ILE F 1 546 ? 12.036 -21.057 15.893 1.00 47.62 ? 546 ILE F CG1 1 +ATOM 32901 C CG2 . ILE F 1 546 ? 9.594 -21.153 16.249 1.00 48.37 ? 546 ILE F CG2 1 +ATOM 32902 C CD1 . ILE F 1 546 ? 13.450 -21.062 16.442 1.00 49.53 ? 546 ILE F CD1 1 +ATOM 32903 N N . GLU F 1 547 ? 9.233 -19.412 19.232 1.00 48.48 ? 547 GLU F N 1 +ATOM 32904 C CA . GLU F 1 547 ? 7.977 -19.320 19.972 1.00 49.08 ? 547 GLU F CA 1 +ATOM 32905 C C . GLU F 1 547 ? 6.878 -18.480 19.338 1.00 47.47 ? 547 GLU F C 1 +ATOM 32906 O O . GLU F 1 547 ? 5.780 -18.395 19.882 1.00 48.06 ? 547 GLU F O 1 +ATOM 32907 C CB . GLU F 1 547 ? 8.246 -18.804 21.386 1.00 51.95 ? 547 GLU F CB 1 +ATOM 32908 C CG . GLU F 1 547 ? 9.332 -19.572 22.110 1.00 55.90 ? 547 GLU F CG 1 +ATOM 32909 C CD . GLU F 1 547 ? 9.345 -19.304 23.602 1.00 58.08 ? 547 GLU F CD 1 +ATOM 32910 O OE1 . GLU F 1 547 ? 9.349 -18.118 24.001 1.00 60.36 ? 547 GLU F OE1 1 +ATOM 32911 O OE2 . GLU F 1 547 ? 9.356 -20.284 24.373 1.00 58.32 ? 547 GLU F OE2 1 +ATOM 32912 N N . ASP F 1 548 ? 7.166 -17.844 18.210 1.00 45.39 ? 548 ASP F N 1 +ATOM 32913 C CA . ASP F 1 548 ? 6.150 -17.048 17.526 1.00 43.04 ? 548 ASP F CA 1 +ATOM 32914 C C . ASP F 1 548 ? 5.648 -17.811 16.302 1.00 40.53 ? 548 ASP F C 1 +ATOM 32915 O O . ASP F 1 548 ? 5.151 -17.222 15.339 1.00 40.82 ? 548 ASP F O 1 +ATOM 32916 C CB . ASP F 1 548 ? 6.706 -15.678 17.109 1.00 43.83 ? 548 ASP F CB 1 +ATOM 32917 C CG . ASP F 1 548 ? 8.079 -15.769 16.460 1.00 45.17 ? 548 ASP F CG 1 +ATOM 32918 O OD1 . ASP F 1 548 ? 8.467 -16.868 15.993 1.00 42.14 ? 548 ASP F OD1 1 +ATOM 32919 O OD2 . ASP F 1 548 ? 8.763 -14.721 16.414 1.00 47.62 ? 548 ASP F OD2 1 +ATOM 32920 N N . GLU F 1 549 ? 5.796 -19.130 16.352 1.00 37.33 ? 549 GLU F N 1 +ATOM 32921 C CA . GLU F 1 549 ? 5.351 -20.016 15.282 1.00 35.46 ? 549 GLU F CA 1 +ATOM 32922 C C . GLU F 1 549 ? 4.762 -21.244 15.946 1.00 33.41 ? 549 GLU F C 1 +ATOM 32923 O O . GLU F 1 549 ? 5.167 -21.604 17.045 1.00 32.00 ? 549 GLU F O 1 +ATOM 32924 C CB . GLU F 1 549 ? 6.528 -20.465 14.402 1.00 35.05 ? 549 GLU F CB 1 +ATOM 32925 C CG . GLU F 1 549 ? 7.071 -19.419 13.455 1.00 36.16 ? 549 GLU F CG 1 +ATOM 32926 C CD . GLU F 1 549 ? 8.301 -19.895 12.726 1.00 36.09 ? 549 GLU F CD 1 +ATOM 32927 O OE1 . GLU F 1 549 ? 8.308 -21.048 12.256 1.00 38.96 ? 549 GLU F OE1 1 +ATOM 32928 O OE2 . GLU F 1 549 ? 9.265 -19.119 12.607 1.00 38.60 ? 549 GLU F OE2 1 +ATOM 32929 N N . TYR F 1 550 ? 3.788 -21.870 15.299 1.00 31.96 ? 550 TYR F N 1 +ATOM 32930 C CA . TYR F 1 550 ? 3.231 -23.098 15.834 1.00 31.82 ? 550 TYR F CA 1 +ATOM 32931 C C . TYR F 1 550 ? 2.682 -24.012 14.746 1.00 32.29 ? 550 TYR F C 1 +ATOM 32932 O O . TYR F 1 550 ? 2.339 -23.565 13.655 1.00 31.57 ? 550 TYR F O 1 +ATOM 32933 C CB . TYR F 1 550 ? 2.169 -22.823 16.902 1.00 30.09 ? 550 TYR F CB 1 +ATOM 32934 C CG . TYR F 1 550 ? 0.904 -22.128 16.460 1.00 31.54 ? 550 TYR F CG 1 +ATOM 32935 C CD1 . TYR F 1 550 ? 0.825 -20.735 16.406 1.00 31.63 ? 550 TYR F CD1 1 +ATOM 32936 C CD2 . TYR F 1 550 ? -0.254 -22.862 16.186 1.00 30.71 ? 550 TYR F CD2 1 +ATOM 32937 C CE1 . TYR F 1 550 ? -0.384 -20.086 16.104 1.00 30.14 ? 550 TYR F CE1 1 +ATOM 32938 C CE2 . TYR F 1 550 ? -1.461 -22.231 15.885 1.00 29.93 ? 550 TYR F CE2 1 +ATOM 32939 C CZ . TYR F 1 550 ? -1.522 -20.843 15.850 1.00 31.41 ? 550 TYR F CZ 1 +ATOM 32940 O OH . TYR F 1 550 ? -2.724 -20.223 15.597 1.00 26.93 ? 550 TYR F OH 1 +ATOM 32941 N N . MET F 1 551 ? 2.653 -25.307 15.045 1.00 33.65 ? 551 MET F N 1 +ATOM 32942 C CA . MET F 1 551 ? 2.146 -26.327 14.126 1.00 31.64 ? 551 MET F CA 1 +ATOM 32943 C C . MET F 1 551 ? 0.690 -26.605 14.446 1.00 29.67 ? 551 MET F C 1 +ATOM 32944 O O . MET F 1 551 ? 0.291 -26.628 15.610 1.00 28.55 ? 551 MET F O 1 +ATOM 32945 C CB . MET F 1 551 ? 2.901 -27.643 14.300 1.00 33.93 ? 551 MET F CB 1 +ATOM 32946 C CG . MET F 1 551 ? 4.386 -27.598 14.060 1.00 38.08 ? 551 MET F CG 1 +ATOM 32947 S SD . MET F 1 551 ? 4.774 -27.526 12.345 1.00 42.53 ? 551 MET F SD 1 +ATOM 32948 C CE . MET F 1 551 ? 4.347 -29.219 11.777 1.00 41.51 ? 551 MET F CE 1 +ATOM 32949 N N . VAL F 1 552 ? -0.111 -26.802 13.411 1.00 29.65 ? 552 VAL F N 1 +ATOM 32950 C CA . VAL F 1 552 ? -1.513 -27.141 13.600 1.00 28.66 ? 552 VAL F CA 1 +ATOM 32951 C C . VAL F 1 552 ? -1.524 -28.573 13.110 1.00 28.89 ? 552 VAL F C 1 +ATOM 32952 O O . VAL F 1 552 ? -1.456 -28.835 11.914 1.00 29.26 ? 552 VAL F O 1 +ATOM 32953 C CB . VAL F 1 552 ? -2.429 -26.263 12.741 1.00 29.55 ? 552 VAL F CB 1 +ATOM 32954 C CG1 . VAL F 1 552 ? -3.894 -26.682 12.925 1.00 27.03 ? 552 VAL F CG1 1 +ATOM 32955 C CG2 . VAL F 1 552 ? -2.226 -24.798 13.125 1.00 26.12 ? 552 VAL F CG2 1 +ATOM 32956 N N . GLY F 1 553 ? -1.567 -29.503 14.049 1.00 30.13 ? 553 GLY F N 1 +ATOM 32957 C CA . GLY F 1 553 ? -1.526 -30.899 13.686 1.00 32.64 ? 553 GLY F CA 1 +ATOM 32958 C C . GLY F 1 553 ? -0.100 -31.208 13.263 1.00 34.94 ? 553 GLY F C 1 +ATOM 32959 O O . GLY F 1 553 ? 0.850 -30.536 13.667 1.00 34.04 ? 553 GLY F O 1 +ATOM 32960 N N . LYS F 1 554 ? 0.053 -32.202 12.407 1.00 36.60 ? 554 LYS F N 1 +ATOM 32961 C CA . LYS F 1 554 ? 1.364 -32.616 11.959 1.00 37.07 ? 554 LYS F CA 1 +ATOM 32962 C C . LYS F 1 554 ? 1.772 -31.975 10.640 1.00 36.58 ? 554 LYS F C 1 +ATOM 32963 O O . LYS F 1 554 ? 2.961 -31.923 10.302 1.00 36.98 ? 554 LYS F O 1 +ATOM 32964 C CB . LYS F 1 554 ? 1.342 -34.142 11.832 1.00 39.09 ? 554 LYS F CB 1 +ATOM 32965 C CG . LYS F 1 554 ? 2.664 -34.815 11.588 1.00 42.39 ? 554 LYS F CG 1 +ATOM 32966 C CD . LYS F 1 554 ? 2.479 -36.330 11.627 1.00 45.03 ? 554 LYS F CD 1 +ATOM 32967 C CE . LYS F 1 554 ? 3.808 -37.050 11.471 1.00 47.74 ? 554 LYS F CE 1 +ATOM 32968 N NZ . LYS F 1 554 ? 4.731 -36.766 12.618 1.00 49.58 ? 554 LYS F NZ 1 +ATOM 32969 N N . TYR F 1 555 ? 0.793 -31.436 9.924 1.00 35.65 ? 555 TYR F N 1 +ATOM 32970 C CA . TYR F 1 555 ? 1.040 -30.890 8.597 1.00 35.05 ? 555 TYR F CA 1 +ATOM 32971 C C . TYR F 1 555 ? 1.155 -29.389 8.364 1.00 34.99 ? 555 TYR F C 1 +ATOM 32972 O O . TYR F 1 555 ? 1.820 -28.957 7.423 1.00 34.74 ? 555 TYR F O 1 +ATOM 32973 C CB . TYR F 1 555 ? -0.042 -31.401 7.645 1.00 35.15 ? 555 TYR F CB 1 +ATOM 32974 C CG . TYR F 1 555 ? -0.380 -32.864 7.761 1.00 34.72 ? 555 TYR F CG 1 +ATOM 32975 C CD1 . TYR F 1 555 ? 0.621 -33.826 7.865 1.00 34.50 ? 555 TYR F CD1 1 +ATOM 32976 C CD2 . TYR F 1 555 ? -1.707 -33.293 7.691 1.00 33.87 ? 555 TYR F CD2 1 +ATOM 32977 C CE1 . TYR F 1 555 ? 0.311 -35.176 7.890 1.00 35.38 ? 555 TYR F CE1 1 +ATOM 32978 C CE2 . TYR F 1 555 ? -2.029 -34.644 7.713 1.00 34.72 ? 555 TYR F CE2 1 +ATOM 32979 C CZ . TYR F 1 555 ? -1.019 -35.581 7.808 1.00 35.80 ? 555 TYR F CZ 1 +ATOM 32980 O OH . TYR F 1 555 ? -1.339 -36.922 7.797 1.00 36.91 ? 555 TYR F OH 1 +ATOM 32981 N N . LEU F 1 556 ? 0.519 -28.588 9.200 1.00 34.39 ? 556 LEU F N 1 +ATOM 32982 C CA . LEU F 1 556 ? 0.515 -27.159 8.956 1.00 32.98 ? 556 LEU F CA 1 +ATOM 32983 C C . LEU F 1 556 ? 1.352 -26.281 9.886 1.00 32.72 ? 556 LEU F C 1 +ATOM 32984 O O . LEU F 1 556 ? 1.220 -26.340 11.107 1.00 32.15 ? 556 LEU F O 1 +ATOM 32985 C CB . LEU F 1 556 ? -0.952 -26.706 8.937 1.00 31.88 ? 556 LEU F CB 1 +ATOM 32986 C CG . LEU F 1 556 ? -1.332 -25.331 8.411 1.00 34.04 ? 556 LEU F CG 1 +ATOM 32987 C CD1 . LEU F 1 556 ? -2.809 -25.326 8.022 1.00 32.57 ? 556 LEU F CD1 1 +ATOM 32988 C CD2 . LEU F 1 556 ? -1.030 -24.280 9.478 1.00 33.67 ? 556 LEU F CD2 1 +ATOM 32989 N N . LEU F 1 557 ? 2.220 -25.464 9.296 1.00 31.98 ? 557 LEU F N 1 +ATOM 32990 C CA . LEU F 1 557 ? 3.045 -24.551 10.073 1.00 31.95 ? 557 LEU F CA 1 +ATOM 32991 C C . LEU F 1 557 ? 2.496 -23.139 9.894 1.00 31.39 ? 557 LEU F C 1 +ATOM 32992 O O . LEU F 1 557 ? 2.346 -22.650 8.772 1.00 30.33 ? 557 LEU F O 1 +ATOM 32993 C CB . LEU F 1 557 ? 4.505 -24.592 9.619 1.00 34.68 ? 557 LEU F CB 1 +ATOM 32994 C CG . LEU F 1 557 ? 5.477 -23.779 10.496 1.00 37.76 ? 557 LEU F CG 1 +ATOM 32995 C CD1 . LEU F 1 557 ? 6.896 -24.239 10.271 1.00 40.70 ? 557 LEU F CD1 1 +ATOM 32996 C CD2 . LEU F 1 557 ? 5.375 -22.309 10.168 1.00 39.37 ? 557 LEU F CD2 1 +ATOM 32997 N N . TYR F 1 558 ? 2.193 -22.490 11.006 1.00 30.01 ? 558 TYR F N 1 +ATOM 32998 C CA . TYR F 1 558 ? 1.657 -21.145 10.968 1.00 31.81 ? 558 TYR F CA 1 +ATOM 32999 C C . TYR F 1 558 ? 2.571 -20.197 11.718 1.00 31.18 ? 558 TYR F C 1 +ATOM 33000 O O . TYR F 1 558 ? 2.884 -20.427 12.884 1.00 30.47 ? 558 TYR F O 1 +ATOM 33001 C CB . TYR F 1 558 ? 0.250 -21.124 11.586 1.00 32.63 ? 558 TYR F CB 1 +ATOM 33002 C CG . TYR F 1 558 ? -0.415 -19.763 11.594 1.00 32.96 ? 558 TYR F CG 1 +ATOM 33003 C CD1 . TYR F 1 558 ? -0.347 -18.923 10.482 1.00 33.75 ? 558 TYR F CD1 1 +ATOM 33004 C CD2 . TYR F 1 558 ? -1.144 -19.331 12.699 1.00 32.62 ? 558 TYR F CD2 1 +ATOM 33005 C CE1 . TYR F 1 558 ? -0.986 -17.690 10.473 1.00 34.46 ? 558 TYR F CE1 1 +ATOM 33006 C CE2 . TYR F 1 558 ? -1.791 -18.102 12.702 1.00 32.71 ? 558 TYR F CE2 1 +ATOM 33007 C CZ . TYR F 1 558 ? -1.707 -17.286 11.590 1.00 35.01 ? 558 TYR F CZ 1 +ATOM 33008 O OH . TYR F 1 558 ? -2.326 -16.056 11.605 1.00 35.70 ? 558 TYR F OH 1 +ATOM 33009 N N . ALA F 1 559 ? 3.008 -19.142 11.038 1.00 31.42 ? 559 ALA F N 1 +ATOM 33010 C CA . ALA F 1 559 ? 3.880 -18.143 11.647 1.00 31.83 ? 559 ALA F CA 1 +ATOM 33011 C C . ALA F 1 559 ? 3.126 -16.820 11.681 1.00 32.11 ? 559 ALA F C 1 +ATOM 33012 O O . ALA F 1 559 ? 3.305 -15.969 10.812 1.00 32.86 ? 559 ALA F O 1 +ATOM 33013 C CB . ALA F 1 559 ? 5.159 -18.004 10.841 1.00 30.60 ? 559 ALA F CB 1 +ATOM 33014 N N . PRO F 1 560 ? 2.263 -16.630 12.688 1.00 32.58 ? 560 PRO F N 1 +ATOM 33015 C CA . PRO F 1 560 ? 1.496 -15.384 12.786 1.00 34.62 ? 560 PRO F CA 1 +ATOM 33016 C C . PRO F 1 560 ? 2.356 -14.134 12.929 1.00 36.52 ? 560 PRO F C 1 +ATOM 33017 O O . PRO F 1 560 ? 3.427 -14.160 13.541 1.00 37.90 ? 560 PRO F O 1 +ATOM 33018 C CB . PRO F 1 560 ? 0.604 -15.616 14.005 1.00 34.03 ? 560 PRO F CB 1 +ATOM 33019 C CG . PRO F 1 560 ? 1.452 -16.507 14.868 1.00 35.22 ? 560 PRO F CG 1 +ATOM 33020 C CD . PRO F 1 560 ? 2.030 -17.487 13.863 1.00 33.03 ? 560 PRO F CD 1 +ATOM 33021 N N . ILE F 1 561 ? 1.886 -13.042 12.342 1.00 37.44 ? 561 ILE F N 1 +ATOM 33022 C CA . ILE F 1 561 ? 2.600 -11.786 12.416 1.00 39.84 ? 561 ILE F CA 1 +ATOM 33023 C C . ILE F 1 561 ? 2.251 -11.156 13.752 1.00 40.56 ? 561 ILE F C 1 +ATOM 33024 O O . ILE F 1 561 ? 1.109 -10.768 13.983 1.00 41.43 ? 561 ILE F O 1 +ATOM 33025 C CB . ILE F 1 561 ? 2.198 -10.870 11.243 1.00 41.47 ? 561 ILE F CB 1 +ATOM 33026 C CG1 . ILE F 1 561 ? 2.750 -11.463 9.939 1.00 41.45 ? 561 ILE F CG1 1 +ATOM 33027 C CG2 . ILE F 1 561 ? 2.717 -9.461 11.469 1.00 40.20 ? 561 ILE F CG2 1 +ATOM 33028 C CD1 . ILE F 1 561 ? 2.361 -10.703 8.706 1.00 44.34 ? 561 ILE F CD1 1 +ATOM 33029 N N . VAL F 1 562 ? 3.237 -11.079 14.638 1.00 41.30 ? 562 VAL F N 1 +ATOM 33030 C CA . VAL F 1 562 ? 3.025 -10.526 15.971 1.00 43.18 ? 562 VAL F CA 1 +ATOM 33031 C C . VAL F 1 562 ? 3.697 -9.169 16.195 1.00 45.16 ? 562 VAL F C 1 +ATOM 33032 O O . VAL F 1 562 ? 4.118 -8.855 17.298 1.00 45.34 ? 562 VAL F O 1 +ATOM 33033 C CB . VAL F 1 562 ? 3.511 -11.524 17.055 1.00 41.63 ? 562 VAL F CB 1 +ATOM 33034 C CG1 . VAL F 1 562 ? 2.702 -12.795 16.969 1.00 41.55 ? 562 VAL F CG1 1 +ATOM 33035 C CG2 . VAL F 1 562 ? 4.988 -11.833 16.868 1.00 38.82 ? 562 VAL F CG2 1 +ATOM 33036 N N . SER F 1 563 ? 3.792 -8.372 15.140 1.00 48.70 ? 563 SER F N 1 +ATOM 33037 C CA . SER F 1 563 ? 4.394 -7.048 15.213 1.00 53.09 ? 563 SER F CA 1 +ATOM 33038 C C . SER F 1 563 ? 3.684 -6.149 14.206 1.00 55.39 ? 563 SER F C 1 +ATOM 33039 O O . SER F 1 563 ? 2.807 -6.600 13.471 1.00 56.78 ? 563 SER F O 1 +ATOM 33040 C CB . SER F 1 563 ? 5.886 -7.113 14.877 1.00 53.30 ? 563 SER F CB 1 +ATOM 33041 O OG . SER F 1 563 ? 6.082 -7.398 13.499 1.00 57.51 ? 563 SER F OG 1 +ATOM 33042 N N . LYS F 1 564 ? 4.069 -4.880 14.162 1.00 58.56 ? 564 LYS F N 1 +ATOM 33043 C CA . LYS F 1 564 ? 3.446 -3.934 13.246 1.00 61.32 ? 564 LYS F CA 1 +ATOM 33044 C C . LYS F 1 564 ? 3.949 -4.092 11.812 1.00 62.81 ? 564 LYS F C 1 +ATOM 33045 O O . LYS F 1 564 ? 3.333 -3.586 10.877 1.00 63.44 ? 564 LYS F O 1 +ATOM 33046 C CB . LYS F 1 564 ? 3.679 -2.499 13.727 1.00 62.40 ? 564 LYS F CB 1 +ATOM 33047 C CG . LYS F 1 564 ? 3.045 -2.165 15.086 1.00 64.31 ? 564 LYS F CG 1 +ATOM 33048 C CD . LYS F 1 564 ? 4.034 -2.284 16.265 1.00 65.41 ? 564 LYS F CD 1 +ATOM 33049 C CE . LYS F 1 564 ? 4.477 -3.724 16.542 1.00 64.66 ? 564 LYS F CE 1 +ATOM 33050 N NZ . LYS F 1 564 ? 5.371 -3.848 17.730 1.00 64.79 ? 564 LYS F NZ 1 +ATOM 33051 N N . GLU F 1 565 ? 5.066 -4.794 11.641 1.00 64.38 ? 565 GLU F N 1 +ATOM 33052 C CA . GLU F 1 565 ? 5.633 -5.026 10.315 1.00 65.07 ? 565 GLU F CA 1 +ATOM 33053 C C . GLU F 1 565 ? 4.601 -5.610 9.347 1.00 64.47 ? 565 GLU F C 1 +ATOM 33054 O O . GLU F 1 565 ? 3.540 -6.090 9.751 1.00 63.94 ? 565 GLU F O 1 +ATOM 33055 C CB . GLU F 1 565 ? 6.801 -6.004 10.391 1.00 67.93 ? 565 GLU F CB 1 +ATOM 33056 C CG . GLU F 1 565 ? 8.000 -5.557 11.195 1.00 71.84 ? 565 GLU F CG 1 +ATOM 33057 C CD . GLU F 1 565 ? 9.122 -6.597 11.152 1.00 74.64 ? 565 GLU F CD 1 +ATOM 33058 O OE1 . GLU F 1 565 ? 8.884 -7.759 11.573 1.00 74.52 ? 565 GLU F OE1 1 +ATOM 33059 O OE2 . GLU F 1 565 ? 10.234 -6.254 10.688 1.00 75.56 ? 565 GLU F OE2 1 +ATOM 33060 N N . GLU F 1 566 ? 4.938 -5.587 8.064 1.00 63.96 ? 566 GLU F N 1 +ATOM 33061 C CA . GLU F 1 566 ? 4.055 -6.106 7.030 1.00 63.50 ? 566 GLU F CA 1 +ATOM 33062 C C . GLU F 1 566 ? 4.453 -7.541 6.692 1.00 60.93 ? 566 GLU F C 1 +ATOM 33063 O O . GLU F 1 566 ? 3.667 -8.307 6.134 1.00 60.87 ? 566 GLU F O 1 +ATOM 33064 C CB . GLU F 1 566 ? 4.144 -5.220 5.786 1.00 66.82 ? 566 GLU F CB 1 +ATOM 33065 C CG . GLU F 1 566 ? 3.095 -5.521 4.733 1.00 72.87 ? 566 GLU F CG 1 +ATOM 33066 C CD . GLU F 1 566 ? 3.033 -4.460 3.646 1.00 76.17 ? 566 GLU F CD 1 +ATOM 33067 O OE1 . GLU F 1 566 ? 4.057 -4.252 2.952 1.00 77.30 ? 566 GLU F OE1 1 +ATOM 33068 O OE2 . GLU F 1 566 ? 1.957 -3.837 3.490 1.00 77.49 ? 566 GLU F OE2 1 +ATOM 33069 N N . SER F 1 567 ? 5.689 -7.891 7.033 1.00 57.26 ? 567 SER F N 1 +ATOM 33070 C CA . SER F 1 567 ? 6.207 -9.228 6.798 1.00 53.53 ? 567 SER F CA 1 +ATOM 33071 C C . SER F 1 567 ? 7.128 -9.576 7.962 1.00 50.41 ? 567 SER F C 1 +ATOM 33072 O O . SER F 1 567 ? 7.514 -8.705 8.737 1.00 50.24 ? 567 SER F O 1 +ATOM 33073 C CB . SER F 1 567 ? 6.984 -9.283 5.486 1.00 53.73 ? 567 SER F CB 1 +ATOM 33074 O OG . SER F 1 567 ? 8.185 -8.549 5.585 1.00 55.25 ? 567 SER F OG 1 +ATOM 33075 N N . ARG F 1 568 ? 7.481 -10.848 8.083 1.00 46.24 ? 568 ARG F N 1 +ATOM 33076 C CA . ARG F 1 568 ? 8.341 -11.285 9.169 1.00 41.35 ? 568 ARG F CA 1 +ATOM 33077 C C . ARG F 1 568 ? 9.248 -12.400 8.703 1.00 40.61 ? 568 ARG F C 1 +ATOM 33078 O O . ARG F 1 568 ? 9.064 -12.954 7.618 1.00 40.62 ? 568 ARG F O 1 +ATOM 33079 C CB . ARG F 1 568 ? 7.495 -11.813 10.317 1.00 38.30 ? 568 ARG F CB 1 +ATOM 33080 C CG . ARG F 1 568 ? 6.572 -12.936 9.883 1.00 36.41 ? 568 ARG F CG 1 +ATOM 33081 C CD . ARG F 1 568 ? 6.085 -13.753 11.059 1.00 34.74 ? 568 ARG F CD 1 +ATOM 33082 N NE . ARG F 1 568 ? 7.149 -14.574 11.619 1.00 32.39 ? 568 ARG F NE 1 +ATOM 33083 C CZ . ARG F 1 568 ? 7.022 -15.299 12.725 1.00 32.92 ? 568 ARG F CZ 1 +ATOM 33084 N NH1 . ARG F 1 568 ? 5.873 -15.300 13.391 1.00 29.71 ? 568 ARG F NH1 1 +ATOM 33085 N NH2 . ARG F 1 568 ? 8.042 -16.024 13.166 1.00 31.38 ? 568 ARG F NH2 1 +ATOM 33086 N N . LEU F 1 569 ? 10.231 -12.727 9.535 1.00 39.72 ? 569 LEU F N 1 +ATOM 33087 C CA . LEU F 1 569 ? 11.143 -13.811 9.228 1.00 37.89 ? 569 LEU F CA 1 +ATOM 33088 C C . LEU F 1 569 ? 10.472 -15.081 9.743 1.00 35.83 ? 569 LEU F C 1 +ATOM 33089 O O . LEU F 1 569 ? 9.954 -15.111 10.857 1.00 32.62 ? 569 LEU F O 1 +ATOM 33090 C CB . LEU F 1 569 ? 12.491 -13.599 9.925 1.00 39.13 ? 569 LEU F CB 1 +ATOM 33091 C CG . LEU F 1 569 ? 13.365 -12.465 9.378 1.00 41.13 ? 569 LEU F CG 1 +ATOM 33092 C CD1 . LEU F 1 569 ? 14.665 -12.397 10.155 1.00 40.74 ? 569 LEU F CD1 1 +ATOM 33093 C CD2 . LEU F 1 569 ? 13.653 -12.702 7.895 1.00 41.15 ? 569 LEU F CD2 1 +ATOM 33094 N N . VAL F 1 570 ? 10.459 -16.117 8.914 1.00 34.21 ? 570 VAL F N 1 +ATOM 33095 C CA . VAL F 1 570 ? 9.856 -17.383 9.294 1.00 33.90 ? 570 VAL F CA 1 +ATOM 33096 C C . VAL F 1 570 ? 10.920 -18.455 9.315 1.00 34.79 ? 570 VAL F C 1 +ATOM 33097 O O . VAL F 1 570 ? 11.646 -18.634 8.333 1.00 35.86 ? 570 VAL F O 1 +ATOM 33098 C CB . VAL F 1 570 ? 8.761 -17.806 8.298 1.00 33.23 ? 570 VAL F CB 1 +ATOM 33099 C CG1 . VAL F 1 570 ? 8.208 -19.159 8.675 1.00 31.22 ? 570 VAL F CG1 1 +ATOM 33100 C CG2 . VAL F 1 570 ? 7.654 -16.764 8.277 1.00 32.57 ? 570 VAL F CG2 1 +ATOM 33101 N N . THR F 1 571 ? 11.026 -19.158 10.438 1.00 34.55 ? 571 THR F N 1 +ATOM 33102 C CA . THR F 1 571 ? 11.993 -20.237 10.556 1.00 35.40 ? 571 THR F CA 1 +ATOM 33103 C C . THR F 1 571 ? 11.301 -21.541 10.185 1.00 34.52 ? 571 THR F C 1 +ATOM 33104 O O . THR F 1 571 ? 10.298 -21.908 10.789 1.00 33.09 ? 571 THR F O 1 +ATOM 33105 C CB . THR F 1 571 ? 12.533 -20.355 11.988 1.00 37.09 ? 571 THR F CB 1 +ATOM 33106 O OG1 . THR F 1 571 ? 13.231 -19.158 12.334 1.00 34.81 ? 571 THR F OG1 1 +ATOM 33107 C CG2 . THR F 1 571 ? 13.487 -21.547 12.098 1.00 38.46 ? 571 THR F CG2 1 +ATOM 33108 N N . LEU F 1 572 ? 11.834 -22.224 9.182 1.00 34.99 ? 572 LEU F N 1 +ATOM 33109 C CA . LEU F 1 572 ? 11.258 -23.482 8.735 1.00 37.73 ? 572 LEU F CA 1 +ATOM 33110 C C . LEU F 1 572 ? 12.098 -24.660 9.216 1.00 38.81 ? 572 LEU F C 1 +ATOM 33111 O O . LEU F 1 572 ? 13.325 -24.643 9.120 1.00 37.89 ? 572 LEU F O 1 +ATOM 33112 C CB . LEU F 1 572 ? 11.174 -23.516 7.204 1.00 37.85 ? 572 LEU F CB 1 +ATOM 33113 C CG . LEU F 1 572 ? 10.303 -22.472 6.512 1.00 37.52 ? 572 LEU F CG 1 +ATOM 33114 C CD1 . LEU F 1 572 ? 10.490 -22.592 5.016 1.00 38.10 ? 572 LEU F CD1 1 +ATOM 33115 C CD2 . LEU F 1 572 ? 8.846 -22.671 6.895 1.00 38.16 ? 572 LEU F CD2 1 +ATOM 33116 N N . PRO F 1 573 ? 11.445 -25.692 9.765 1.00 39.47 ? 573 PRO F N 1 +ATOM 33117 C CA . PRO F 1 573 ? 12.175 -26.872 10.245 1.00 40.59 ? 573 PRO F CA 1 +ATOM 33118 C C . PRO F 1 573 ? 12.680 -27.698 9.061 1.00 41.63 ? 573 PRO F C 1 +ATOM 33119 O O . PRO F 1 573 ? 12.403 -27.384 7.915 1.00 40.76 ? 573 PRO F O 1 +ATOM 33120 C CB . PRO F 1 573 ? 11.123 -27.636 11.048 1.00 39.60 ? 573 PRO F CB 1 +ATOM 33121 C CG . PRO F 1 573 ? 10.154 -26.563 11.465 1.00 41.02 ? 573 PRO F CG 1 +ATOM 33122 C CD . PRO F 1 573 ? 10.052 -25.706 10.233 1.00 38.23 ? 573 PRO F CD 1 +ATOM 33123 N N . ARG F 1 574 ? 13.412 -28.762 9.355 1.00 45.07 ? 574 ARG F N 1 +ATOM 33124 C CA . ARG F 1 574 ? 13.942 -29.652 8.332 1.00 48.23 ? 574 ARG F CA 1 +ATOM 33125 C C . ARG F 1 574 ? 12.810 -30.168 7.427 1.00 46.67 ? 574 ARG F C 1 +ATOM 33126 O O . ARG F 1 574 ? 11.683 -30.350 7.878 1.00 47.20 ? 574 ARG F O 1 +ATOM 33127 C CB . ARG F 1 574 ? 14.643 -30.817 9.029 1.00 53.39 ? 574 ARG F CB 1 +ATOM 33128 C CG . ARG F 1 574 ? 15.415 -31.758 8.123 1.00 61.89 ? 574 ARG F CG 1 +ATOM 33129 C CD . ARG F 1 574 ? 16.206 -32.766 8.961 1.00 67.50 ? 574 ARG F CD 1 +ATOM 33130 N NE . ARG F 1 574 ? 16.877 -33.776 8.144 1.00 72.66 ? 574 ARG F NE 1 +ATOM 33131 C CZ . ARG F 1 574 ? 17.630 -34.760 8.634 1.00 75.19 ? 574 ARG F CZ 1 +ATOM 33132 N NH1 . ARG F 1 574 ? 17.817 -34.871 9.948 1.00 75.39 ? 574 ARG F NH1 1 +ATOM 33133 N NH2 . ARG F 1 574 ? 18.190 -35.643 7.810 1.00 76.36 ? 574 ARG F NH2 1 +ATOM 33134 N N . GLY F 1 575 ? 13.106 -30.395 6.151 1.00 45.69 ? 575 GLY F N 1 +ATOM 33135 C CA . GLY F 1 575 ? 12.090 -30.892 5.233 1.00 43.14 ? 575 GLY F CA 1 +ATOM 33136 C C . GLY F 1 575 ? 11.626 -29.845 4.243 1.00 41.67 ? 575 GLY F C 1 +ATOM 33137 O O . GLY F 1 575 ? 12.083 -28.726 4.268 1.00 41.30 ? 575 GLY F O 1 +ATOM 33138 N N . LYS F 1 576 ? 10.712 -30.199 3.358 1.00 43.04 ? 576 LYS F N 1 +ATOM 33139 C CA . LYS F 1 576 ? 10.225 -29.231 2.384 1.00 43.02 ? 576 LYS F CA 1 +ATOM 33140 C C . LYS F 1 576 ? 8.906 -28.609 2.834 1.00 41.20 ? 576 LYS F C 1 +ATOM 33141 O O . LYS F 1 576 ? 8.075 -29.266 3.458 1.00 40.12 ? 576 LYS F O 1 +ATOM 33142 C CB . LYS F 1 576 ? 10.060 -29.891 1.009 1.00 44.61 ? 576 LYS F CB 1 +ATOM 33143 C CG . LYS F 1 576 ? 11.371 -30.172 0.310 1.00 46.51 ? 576 LYS F CG 1 +ATOM 33144 C CD . LYS F 1 576 ? 11.141 -30.813 -1.044 1.00 50.84 ? 576 LYS F CD 1 +ATOM 33145 C CE . LYS F 1 576 ? 12.444 -30.964 -1.812 1.00 53.13 ? 576 LYS F CE 1 +ATOM 33146 N NZ . LYS F 1 576 ? 12.241 -31.651 -3.123 1.00 55.72 ? 576 LYS F NZ 1 +ATOM 33147 N N . TRP F 1 577 ? 8.726 -27.330 2.521 1.00 38.93 ? 577 TRP F N 1 +ATOM 33148 C CA . TRP F 1 577 ? 7.509 -26.634 2.897 1.00 36.92 ? 577 TRP F CA 1 +ATOM 33149 C C . TRP F 1 577 ? 6.876 -25.911 1.723 1.00 35.80 ? 577 TRP F C 1 +ATOM 33150 O O . TRP F 1 577 ? 7.560 -25.291 0.915 1.00 36.19 ? 577 TRP F O 1 +ATOM 33151 C CB . TRP F 1 577 ? 7.798 -25.659 4.028 1.00 35.70 ? 577 TRP F CB 1 +ATOM 33152 C CG . TRP F 1 577 ? 8.341 -26.353 5.226 1.00 34.29 ? 577 TRP F CG 1 +ATOM 33153 C CD1 . TRP F 1 577 ? 9.646 -26.691 5.461 1.00 33.02 ? 577 TRP F CD1 1 +ATOM 33154 C CD2 . TRP F 1 577 ? 7.591 -26.848 6.338 1.00 32.96 ? 577 TRP F CD2 1 +ATOM 33155 N NE1 . TRP F 1 577 ? 9.751 -27.365 6.649 1.00 31.71 ? 577 TRP F NE1 1 +ATOM 33156 C CE2 . TRP F 1 577 ? 8.506 -27.477 7.210 1.00 33.25 ? 577 TRP F CE2 1 +ATOM 33157 C CE3 . TRP F 1 577 ? 6.236 -26.819 6.683 1.00 32.76 ? 577 TRP F CE3 1 +ATOM 33158 C CZ2 . TRP F 1 577 ? 8.109 -28.074 8.408 1.00 33.41 ? 577 TRP F CZ2 1 +ATOM 33159 C CZ3 . TRP F 1 577 ? 5.840 -27.410 7.875 1.00 34.25 ? 577 TRP F CZ3 1 +ATOM 33160 C CH2 . TRP F 1 577 ? 6.776 -28.030 8.724 1.00 35.46 ? 577 TRP F CH2 1 +ATOM 33161 N N . TYR F 1 578 ? 5.555 -26.004 1.648 1.00 34.53 ? 578 TYR F N 1 +ATOM 33162 C CA . TYR F 1 578 ? 4.773 -25.404 0.574 1.00 32.94 ? 578 TYR F CA 1 +ATOM 33163 C C . TYR F 1 578 ? 4.071 -24.150 1.073 1.00 32.44 ? 578 TYR F C 1 +ATOM 33164 O O . TYR F 1 578 ? 3.331 -24.205 2.053 1.00 32.97 ? 578 TYR F O 1 +ATOM 33165 C CB . TYR F 1 578 ? 3.746 -26.431 0.089 1.00 33.84 ? 578 TYR F CB 1 +ATOM 33166 C CG . TYR F 1 578 ? 2.686 -25.915 -0.846 1.00 33.75 ? 578 TYR F CG 1 +ATOM 33167 C CD1 . TYR F 1 578 ? 2.962 -25.674 -2.192 1.00 32.50 ? 578 TYR F CD1 1 +ATOM 33168 C CD2 . TYR F 1 578 ? 1.392 -25.701 -0.390 1.00 32.55 ? 578 TYR F CD2 1 +ATOM 33169 C CE1 . TYR F 1 578 ? 1.967 -25.241 -3.053 1.00 33.18 ? 578 TYR F CE1 1 +ATOM 33170 C CE2 . TYR F 1 578 ? 0.398 -25.264 -1.237 1.00 33.81 ? 578 TYR F CE2 1 +ATOM 33171 C CZ . TYR F 1 578 ? 0.687 -25.039 -2.564 1.00 34.06 ? 578 TYR F CZ 1 +ATOM 33172 O OH . TYR F 1 578 ? -0.316 -24.623 -3.391 1.00 35.18 ? 578 TYR F OH 1 +ATOM 33173 N N . ASN F 1 579 ? 4.316 -23.016 0.413 1.00 30.59 ? 579 ASN F N 1 +ATOM 33174 C CA . ASN F 1 579 ? 3.685 -21.745 0.780 1.00 29.48 ? 579 ASN F CA 1 +ATOM 33175 C C . ASN F 1 579 ? 2.209 -21.817 0.363 1.00 28.77 ? 579 ASN F C 1 +ATOM 33176 O O . ASN F 1 579 ? 1.881 -21.832 -0.822 1.00 26.83 ? 579 ASN F O 1 +ATOM 33177 C CB . ASN F 1 579 ? 4.386 -20.591 0.063 1.00 30.37 ? 579 ASN F CB 1 +ATOM 33178 C CG . ASN F 1 579 ? 3.841 -19.236 0.466 1.00 32.75 ? 579 ASN F CG 1 +ATOM 33179 O OD1 . ASN F 1 579 ? 2.623 -18.997 0.441 1.00 31.04 ? 579 ASN F OD1 1 +ATOM 33180 N ND2 . ASN F 1 579 ? 4.743 -18.330 0.834 1.00 32.26 ? 579 ASN F ND2 1 +ATOM 33181 N N . TYR F 1 580 ? 1.322 -21.860 1.344 1.00 28.63 ? 580 TYR F N 1 +ATOM 33182 C CA . TYR F 1 580 ? -0.101 -21.992 1.070 1.00 30.01 ? 580 TYR F CA 1 +ATOM 33183 C C . TYR F 1 580 ? -0.652 -20.986 0.065 1.00 29.93 ? 580 TYR F C 1 +ATOM 33184 O O . TYR F 1 580 ? -1.433 -21.350 -0.830 1.00 29.47 ? 580 TYR F O 1 +ATOM 33185 C CB . TYR F 1 580 ? -0.898 -21.902 2.376 1.00 29.73 ? 580 TYR F CB 1 +ATOM 33186 C CG . TYR F 1 580 ? -2.389 -22.070 2.185 1.00 31.03 ? 580 TYR F CG 1 +ATOM 33187 C CD1 . TYR F 1 580 ? -2.939 -23.306 1.835 1.00 32.71 ? 580 TYR F CD1 1 +ATOM 33188 C CD2 . TYR F 1 580 ? -3.247 -20.984 2.317 1.00 32.27 ? 580 TYR F CD2 1 +ATOM 33189 C CE1 . TYR F 1 580 ? -4.317 -23.450 1.619 1.00 33.36 ? 580 TYR F CE1 1 +ATOM 33190 C CE2 . TYR F 1 580 ? -4.617 -21.112 2.102 1.00 33.57 ? 580 TYR F CE2 1 +ATOM 33191 C CZ . TYR F 1 580 ? -5.148 -22.343 1.752 1.00 33.17 ? 580 TYR F CZ 1 +ATOM 33192 O OH . TYR F 1 580 ? -6.505 -22.444 1.522 1.00 36.71 ? 580 TYR F OH 1 +ATOM 33193 N N . TRP F 1 581 ? -0.215 -19.736 0.207 1.00 29.26 ? 581 TRP F N 1 +ATOM 33194 C CA . TRP F 1 581 ? -0.674 -18.637 -0.626 1.00 27.81 ? 581 TRP F CA 1 +ATOM 33195 C C . TRP F 1 581 ? -0.038 -18.443 -2.001 1.00 28.46 ? 581 TRP F C 1 +ATOM 33196 O O . TRP F 1 581 ? -0.721 -18.019 -2.923 1.00 29.99 ? 581 TRP F O 1 +ATOM 33197 C CB . TRP F 1 581 ? -0.586 -17.343 0.174 1.00 27.11 ? 581 TRP F CB 1 +ATOM 33198 C CG . TRP F 1 581 ? -1.407 -17.371 1.434 1.00 29.36 ? 581 TRP F CG 1 +ATOM 33199 C CD1 . TRP F 1 581 ? -0.945 -17.348 2.722 1.00 27.48 ? 581 TRP F CD1 1 +ATOM 33200 C CD2 . TRP F 1 581 ? -2.840 -17.408 1.525 1.00 31.27 ? 581 TRP F CD2 1 +ATOM 33201 N NE1 . TRP F 1 581 ? -1.998 -17.362 3.606 1.00 27.81 ? 581 TRP F NE1 1 +ATOM 33202 C CE2 . TRP F 1 581 ? -3.173 -17.398 2.904 1.00 29.68 ? 581 TRP F CE2 1 +ATOM 33203 C CE3 . TRP F 1 581 ? -3.875 -17.448 0.577 1.00 29.77 ? 581 TRP F CE3 1 +ATOM 33204 C CZ2 . TRP F 1 581 ? -4.504 -17.424 3.362 1.00 32.04 ? 581 TRP F CZ2 1 +ATOM 33205 C CZ3 . TRP F 1 581 ? -5.211 -17.475 1.036 1.00 32.44 ? 581 TRP F CZ3 1 +ATOM 33206 C CH2 . TRP F 1 581 ? -5.506 -17.461 2.417 1.00 31.47 ? 581 TRP F CH2 1 +ATOM 33207 N N . ASN F 1 582 ? 1.249 -18.727 -2.171 1.00 29.34 ? 582 ASN F N 1 +ATOM 33208 C CA . ASN F 1 582 ? 1.826 -18.545 -3.498 1.00 29.71 ? 582 ASN F CA 1 +ATOM 33209 C C . ASN F 1 582 ? 2.426 -19.818 -4.093 1.00 31.09 ? 582 ASN F C 1 +ATOM 33210 O O . ASN F 1 582 ? 3.052 -19.780 -5.160 1.00 31.14 ? 582 ASN F O 1 +ATOM 33211 C CB . ASN F 1 582 ? 2.872 -17.418 -3.509 1.00 29.68 ? 582 ASN F CB 1 +ATOM 33212 C CG . ASN F 1 582 ? 4.132 -17.772 -2.751 1.00 33.85 ? 582 ASN F CG 1 +ATOM 33213 O OD1 . ASN F 1 582 ? 4.376 -18.936 -2.404 1.00 36.00 ? 582 ASN F OD1 1 +ATOM 33214 N ND2 . ASN F 1 582 ? 4.953 -16.770 -2.502 1.00 33.18 ? 582 ASN F ND2 1 +ATOM 33215 N N . GLY F 1 583 ? 2.244 -20.943 -3.405 1.00 30.62 ? 583 GLY F N 1 +ATOM 33216 C CA . GLY F 1 583 ? 2.754 -22.204 -3.913 1.00 31.38 ? 583 GLY F CA 1 +ATOM 33217 C C . GLY F 1 583 ? 4.262 -22.438 -3.955 1.00 32.60 ? 583 GLY F C 1 +ATOM 33218 O O . GLY F 1 583 ? 4.710 -23.490 -4.405 1.00 31.65 ? 583 GLY F O 1 +ATOM 33219 N N . GLU F 1 584 ? 5.061 -21.484 -3.502 1.00 34.54 ? 584 GLU F N 1 +ATOM 33220 C CA . GLU F 1 584 ? 6.501 -21.690 -3.523 1.00 37.69 ? 584 GLU F CA 1 +ATOM 33221 C C . GLU F 1 584 ? 6.887 -22.790 -2.521 1.00 37.98 ? 584 GLU F C 1 +ATOM 33222 O O . GLU F 1 584 ? 6.318 -22.874 -1.434 1.00 37.27 ? 584 GLU F O 1 +ATOM 33223 C CB . GLU F 1 584 ? 7.211 -20.379 -3.189 1.00 39.82 ? 584 GLU F CB 1 +ATOM 33224 C CG . GLU F 1 584 ? 8.705 -20.497 -3.048 1.00 45.91 ? 584 GLU F CG 1 +ATOM 33225 C CD . GLU F 1 584 ? 9.383 -19.140 -2.941 1.00 51.80 ? 584 GLU F CD 1 +ATOM 33226 O OE1 . GLU F 1 584 ? 8.816 -18.230 -2.283 1.00 55.81 ? 584 GLU F OE1 1 +ATOM 33227 O OE2 . GLU F 1 584 ? 10.490 -18.980 -3.503 1.00 53.08 ? 584 GLU F OE2 1 +ATOM 33228 N N . ILE F 1 585 ? 7.826 -23.652 -2.903 1.00 38.60 ? 585 ILE F N 1 +ATOM 33229 C CA . ILE F 1 585 ? 8.281 -24.720 -2.017 1.00 39.72 ? 585 ILE F CA 1 +ATOM 33230 C C . ILE F 1 585 ? 9.707 -24.433 -1.573 1.00 41.01 ? 585 ILE F C 1 +ATOM 33231 O O . ILE F 1 585 ? 10.609 -24.306 -2.399 1.00 39.39 ? 585 ILE F O 1 +ATOM 33232 C CB . ILE F 1 585 ? 8.256 -26.095 -2.706 1.00 39.34 ? 585 ILE F CB 1 +ATOM 33233 C CG1 . ILE F 1 585 ? 6.812 -26.526 -2.970 1.00 37.51 ? 585 ILE F CG1 1 +ATOM 33234 C CG2 . ILE F 1 585 ? 8.953 -27.114 -1.829 1.00 38.02 ? 585 ILE F CG2 1 +ATOM 33235 C CD1 . ILE F 1 585 ? 6.712 -27.783 -3.797 1.00 37.39 ? 585 ILE F CD1 1 +ATOM 33236 N N . ILE F 1 586 ? 9.898 -24.327 -0.262 1.00 42.98 ? 586 ILE F N 1 +ATOM 33237 C CA . ILE F 1 586 ? 11.202 -24.033 0.298 1.00 45.90 ? 586 ILE F CA 1 +ATOM 33238 C C . ILE F 1 586 ? 11.777 -25.204 1.074 1.00 47.00 ? 586 ILE F C 1 +ATOM 33239 O O . ILE F 1 586 ? 11.056 -25.936 1.754 1.00 45.13 ? 586 ILE F O 1 +ATOM 33240 C CB . ILE F 1 586 ? 11.150 -22.828 1.269 1.00 47.96 ? 586 ILE F CB 1 +ATOM 33241 C CG1 . ILE F 1 586 ? 10.477 -21.628 0.595 1.00 50.10 ? 586 ILE F CG1 1 +ATOM 33242 C CG2 . ILE F 1 586 ? 12.570 -22.475 1.738 1.00 45.44 ? 586 ILE F CG2 1 +ATOM 33243 C CD1 . ILE F 1 586 ? 8.948 -21.667 0.642 1.00 53.34 ? 586 ILE F CD1 1 +ATOM 33244 N N . ASN F 1 587 ? 13.091 -25.356 0.975 1.00 49.47 ? 587 ASN F N 1 +ATOM 33245 C CA . ASN F 1 587 ? 13.783 -26.411 1.682 1.00 53.21 ? 587 ASN F CA 1 +ATOM 33246 C C . ASN F 1 587 ? 13.975 -26.046 3.137 1.00 54.21 ? 587 ASN F C 1 +ATOM 33247 O O . ASN F 1 587 ? 14.425 -24.954 3.471 1.00 54.07 ? 587 ASN F O 1 +ATOM 33248 C CB . ASN F 1 587 ? 15.130 -26.694 1.033 1.00 55.85 ? 587 ASN F CB 1 +ATOM 33249 C CG . ASN F 1 587 ? 15.008 -27.631 -0.141 1.00 58.76 ? 587 ASN F CG 1 +ATOM 33250 O OD1 . ASN F 1 587 ? 14.576 -28.779 0.012 1.00 60.77 ? 587 ASN F OD1 1 +ATOM 33251 N ND2 . ASN F 1 587 ? 15.373 -27.150 -1.326 1.00 58.80 ? 587 ASN F ND2 1 +ATOM 33252 N N . GLY F 1 588 ? 13.636 -26.994 3.995 1.00 55.24 ? 588 GLY F N 1 +ATOM 33253 C CA . GLY F 1 588 ? 13.723 -26.798 5.423 1.00 55.66 ? 588 GLY F CA 1 +ATOM 33254 C C . GLY F 1 588 ? 15.071 -26.468 6.006 1.00 56.09 ? 588 GLY F C 1 +ATOM 33255 O O . GLY F 1 588 ? 16.110 -26.620 5.369 1.00 57.12 ? 588 GLY F O 1 +ATOM 33256 N N . LYS F 1 589 ? 15.026 -26.028 7.257 1.00 56.31 ? 589 LYS F N 1 +ATOM 33257 C CA . LYS F 1 589 ? 16.200 -25.636 7.999 1.00 54.74 ? 589 LYS F CA 1 +ATOM 33258 C C . LYS F 1 589 ? 16.719 -24.389 7.311 1.00 52.73 ? 589 LYS F C 1 +ATOM 33259 O O . LYS F 1 589 ? 17.820 -24.357 6.773 1.00 52.60 ? 589 LYS F O 1 +ATOM 33260 C CB . LYS F 1 589 ? 17.234 -26.756 7.986 1.00 58.33 ? 589 LYS F CB 1 +ATOM 33261 C CG . LYS F 1 589 ? 18.248 -26.642 9.101 1.00 61.50 ? 589 LYS F CG 1 +ATOM 33262 C CD . LYS F 1 589 ? 17.558 -26.524 10.455 1.00 62.52 ? 589 LYS F CD 1 +ATOM 33263 C CE . LYS F 1 589 ? 18.568 -26.272 11.566 1.00 63.55 ? 589 LYS F CE 1 +ATOM 33264 N NZ . LYS F 1 589 ? 17.888 -25.907 12.835 1.00 64.15 ? 589 LYS F NZ 1 +ATOM 33265 N N . SER F 1 590 ? 15.881 -23.362 7.317 1.00 50.41 ? 590 SER F N 1 +ATOM 33266 C CA . SER F 1 590 ? 16.216 -22.087 6.710 1.00 48.09 ? 590 SER F CA 1 +ATOM 33267 C C . SER F 1 590 ? 15.287 -21.016 7.258 1.00 46.60 ? 590 SER F C 1 +ATOM 33268 O O . SER F 1 590 ? 14.307 -21.312 7.942 1.00 45.32 ? 590 SER F O 1 +ATOM 33269 C CB . SER F 1 590 ? 16.063 -22.159 5.188 1.00 48.14 ? 590 SER F CB 1 +ATOM 33270 O OG . SER F 1 590 ? 14.707 -22.354 4.827 1.00 47.26 ? 590 SER F OG 1 +ATOM 33271 N N . VAL F 1 591 ? 15.609 -19.767 6.955 1.00 46.07 ? 591 VAL F N 1 +ATOM 33272 C CA . VAL F 1 591 ? 14.803 -18.640 7.390 1.00 44.82 ? 591 VAL F CA 1 +ATOM 33273 C C . VAL F 1 591 ? 14.358 -17.892 6.142 1.00 44.85 ? 591 VAL F C 1 +ATOM 33274 O O . VAL F 1 591 ? 15.175 -17.561 5.284 1.00 46.01 ? 591 VAL F O 1 +ATOM 33275 C CB . VAL F 1 591 ? 15.609 -17.696 8.316 1.00 42.92 ? 591 VAL F CB 1 +ATOM 33276 C CG1 . VAL F 1 591 ? 14.790 -16.463 8.643 1.00 44.31 ? 591 VAL F CG1 1 +ATOM 33277 C CG2 . VAL F 1 591 ? 15.968 -18.419 9.603 1.00 40.38 ? 591 VAL F CG2 1 +ATOM 33278 N N . VAL F 1 592 ? 13.060 -17.645 6.030 1.00 44.14 ? 592 VAL F N 1 +ATOM 33279 C CA . VAL F 1 592 ? 12.528 -16.938 4.870 1.00 43.26 ? 592 VAL F CA 1 +ATOM 33280 C C . VAL F 1 592 ? 11.610 -15.810 5.303 1.00 42.73 ? 592 VAL F C 1 +ATOM 33281 O O . VAL F 1 592 ? 11.139 -15.770 6.433 1.00 41.74 ? 592 VAL F O 1 +ATOM 33282 C CB . VAL F 1 592 ? 11.731 -17.890 3.935 1.00 41.98 ? 592 VAL F CB 1 +ATOM 33283 C CG1 . VAL F 1 592 ? 12.612 -19.035 3.495 1.00 41.70 ? 592 VAL F CG1 1 +ATOM 33284 C CG2 . VAL F 1 592 ? 10.487 -18.409 4.643 1.00 39.47 ? 592 VAL F CG2 1 +ATOM 33285 N N . LYS F 1 593 ? 11.349 -14.897 4.384 1.00 44.59 ? 593 LYS F N 1 +ATOM 33286 C CA . LYS F 1 593 ? 10.481 -13.765 4.663 1.00 46.03 ? 593 LYS F CA 1 +ATOM 33287 C C . LYS F 1 593 ? 9.055 -14.154 4.287 1.00 44.05 ? 593 LYS F C 1 +ATOM 33288 O O . LYS F 1 593 ? 8.842 -14.805 3.261 1.00 43.90 ? 593 LYS F O 1 +ATOM 33289 C CB . LYS F 1 593 ? 10.959 -12.562 3.851 1.00 48.83 ? 593 LYS F CB 1 +ATOM 33290 C CG . LYS F 1 593 ? 10.272 -11.248 4.160 1.00 55.26 ? 593 LYS F CG 1 +ATOM 33291 C CD . LYS F 1 593 ? 10.841 -10.143 3.266 1.00 59.32 ? 593 LYS F CD 1 +ATOM 33292 C CE . LYS F 1 593 ? 10.130 -8.811 3.473 1.00 61.40 ? 593 LYS F CE 1 +ATOM 33293 N NZ . LYS F 1 593 ? 10.667 -7.738 2.576 1.00 64.02 ? 593 LYS F NZ 1 +ATOM 33294 N N . SER F 1 594 ? 8.090 -13.784 5.128 1.00 40.93 ? 594 SER F N 1 +ATOM 33295 C CA . SER F 1 594 ? 6.697 -14.109 4.850 1.00 39.94 ? 594 SER F CA 1 +ATOM 33296 C C . SER F 1 594 ? 6.230 -13.335 3.617 1.00 40.98 ? 594 SER F C 1 +ATOM 33297 O O . SER F 1 594 ? 6.778 -12.286 3.291 1.00 41.17 ? 594 SER F O 1 +ATOM 33298 C CB . SER F 1 594 ? 5.815 -13.782 6.055 1.00 36.95 ? 594 SER F CB 1 +ATOM 33299 O OG . SER F 1 594 ? 5.979 -12.441 6.464 1.00 36.20 ? 594 SER F OG 1 +ATOM 33300 N N . THR F 1 595 ? 5.213 -13.848 2.934 1.00 41.56 ? 595 THR F N 1 +ATOM 33301 C CA . THR F 1 595 ? 4.722 -13.205 1.727 1.00 41.90 ? 595 THR F CA 1 +ATOM 33302 C C . THR F 1 595 ? 3.278 -12.724 1.828 1.00 43.98 ? 595 THR F C 1 +ATOM 33303 O O . THR F 1 595 ? 2.847 -11.873 1.057 1.00 43.41 ? 595 THR F O 1 +ATOM 33304 C CB . THR F 1 595 ? 4.828 -14.163 0.531 1.00 40.97 ? 595 THR F CB 1 +ATOM 33305 O OG1 . THR F 1 595 ? 3.931 -15.266 0.716 1.00 42.67 ? 595 THR F OG1 1 +ATOM 33306 C CG2 . THR F 1 595 ? 6.239 -14.695 0.399 1.00 39.33 ? 595 THR F CG2 1 +ATOM 33307 N N . HIS F 1 596 ? 2.538 -13.267 2.787 1.00 46.63 ? 596 HIS F N 1 +ATOM 33308 C CA . HIS F 1 596 ? 1.132 -12.918 2.974 1.00 48.29 ? 596 HIS F CA 1 +ATOM 33309 C C . HIS F 1 596 ? 0.932 -12.440 4.410 1.00 48.35 ? 596 HIS F C 1 +ATOM 33310 O O . HIS F 1 596 ? 1.829 -12.565 5.243 1.00 47.25 ? 596 HIS F O 1 +ATOM 33311 C CB . HIS F 1 596 ? 0.265 -14.161 2.702 1.00 50.85 ? 596 HIS F CB 1 +ATOM 33312 C CG . HIS F 1 596 ? -1.214 -13.900 2.698 1.00 55.36 ? 596 HIS F CG 1 +ATOM 33313 N ND1 . HIS F 1 596 ? -1.885 -13.409 1.595 1.00 58.05 ? 596 HIS F ND1 1 +ATOM 33314 C CD2 . HIS F 1 596 ? -2.157 -14.088 3.656 1.00 55.17 ? 596 HIS F CD2 1 +ATOM 33315 C CE1 . HIS F 1 596 ? -3.175 -13.311 1.873 1.00 57.15 ? 596 HIS F CE1 1 +ATOM 33316 N NE2 . HIS F 1 596 ? -3.366 -13.716 3.117 1.00 56.08 ? 596 HIS F NE2 1 +ATOM 33317 N N . GLU F 1 597 ? -0.243 -11.890 4.697 1.00 49.23 ? 597 GLU F N 1 +ATOM 33318 C CA . GLU F 1 597 ? -0.540 -11.422 6.044 1.00 50.02 ? 597 GLU F CA 1 +ATOM 33319 C C . GLU F 1 597 ? -0.689 -12.605 6.999 1.00 48.32 ? 597 GLU F C 1 +ATOM 33320 O O . GLU F 1 597 ? -0.464 -12.472 8.205 1.00 47.88 ? 597 GLU F O 1 +ATOM 33321 C CB . GLU F 1 597 ? -1.828 -10.595 6.061 1.00 53.93 ? 597 GLU F CB 1 +ATOM 33322 C CG . GLU F 1 597 ? -1.743 -9.280 5.305 1.00 59.98 ? 597 GLU F CG 1 +ATOM 33323 C CD . GLU F 1 597 ? -3.014 -8.452 5.427 1.00 64.10 ? 597 GLU F CD 1 +ATOM 33324 O OE1 . GLU F 1 597 ? -3.300 -7.934 6.532 1.00 65.63 ? 597 GLU F OE1 1 +ATOM 33325 O OE2 . GLU F 1 597 ? -3.736 -8.324 4.414 1.00 67.55 ? 597 GLU F OE2 1 +ATOM 33326 N N . LEU F 1 598 ? -1.070 -13.759 6.456 1.00 45.74 ? 598 LEU F N 1 +ATOM 33327 C CA . LEU F 1 598 ? -1.242 -14.976 7.247 1.00 43.01 ? 598 LEU F CA 1 +ATOM 33328 C C . LEU F 1 598 ? -0.282 -16.042 6.721 1.00 41.27 ? 598 LEU F C 1 +ATOM 33329 O O . LEU F 1 598 ? -0.655 -16.849 5.876 1.00 41.83 ? 598 LEU F O 1 +ATOM 33330 C CB . LEU F 1 598 ? -2.682 -15.476 7.131 1.00 41.39 ? 598 LEU F CB 1 +ATOM 33331 C CG . LEU F 1 598 ? -3.800 -14.469 7.431 1.00 41.32 ? 598 LEU F CG 1 +ATOM 33332 C CD1 . LEU F 1 598 ? -5.137 -15.123 7.144 1.00 40.58 ? 598 LEU F CD1 1 +ATOM 33333 C CD2 . LEU F 1 598 ? -3.737 -13.998 8.878 1.00 39.90 ? 598 LEU F CD2 1 +ATOM 33334 N N . PRO F 1 599 ? 0.968 -16.059 7.224 1.00 39.62 ? 599 PRO F N 1 +ATOM 33335 C CA . PRO F 1 599 ? 2.025 -17.005 6.828 1.00 37.81 ? 599 PRO F CA 1 +ATOM 33336 C C . PRO F 1 599 ? 1.738 -18.477 7.136 1.00 36.30 ? 599 PRO F C 1 +ATOM 33337 O O . PRO F 1 599 ? 2.019 -18.956 8.232 1.00 34.94 ? 599 PRO F O 1 +ATOM 33338 C CB . PRO F 1 599 ? 3.251 -16.490 7.586 1.00 38.21 ? 599 PRO F CB 1 +ATOM 33339 C CG . PRO F 1 599 ? 2.945 -15.036 7.809 1.00 38.34 ? 599 PRO F CG 1 +ATOM 33340 C CD . PRO F 1 599 ? 1.493 -15.080 8.188 1.00 38.05 ? 599 PRO F CD 1 +ATOM 33341 N N . ILE F 1 600 ? 1.194 -19.188 6.151 1.00 35.02 ? 600 ILE F N 1 +ATOM 33342 C CA . ILE F 1 600 ? 0.853 -20.601 6.302 1.00 33.85 ? 600 ILE F CA 1 +ATOM 33343 C C . ILE F 1 600 ? 1.686 -21.485 5.371 1.00 33.30 ? 600 ILE F C 1 +ATOM 33344 O O . ILE F 1 600 ? 1.819 -21.201 4.188 1.00 31.41 ? 600 ILE F O 1 +ATOM 33345 C CB . ILE F 1 600 ? -0.634 -20.837 5.998 1.00 32.32 ? 600 ILE F CB 1 +ATOM 33346 C CG1 . ILE F 1 600 ? -1.496 -20.058 6.992 1.00 31.28 ? 600 ILE F CG1 1 +ATOM 33347 C CG2 . ILE F 1 600 ? -0.940 -22.325 6.041 1.00 31.09 ? 600 ILE F CG2 1 +ATOM 33348 C CD1 . ILE F 1 600 ? -2.951 -19.941 6.582 1.00 32.11 ? 600 ILE F CD1 1 +ATOM 33349 N N . TYR F 1 601 ? 2.251 -22.555 5.915 1.00 33.31 ? 601 TYR F N 1 +ATOM 33350 C CA . TYR F 1 601 ? 3.062 -23.466 5.115 1.00 34.60 ? 601 TYR F CA 1 +ATOM 33351 C C . TYR F 1 601 ? 2.648 -24.915 5.343 1.00 35.06 ? 601 TYR F C 1 +ATOM 33352 O O . TYR F 1 601 ? 2.391 -25.326 6.484 1.00 33.21 ? 601 TYR F O 1 +ATOM 33353 C CB . TYR F 1 601 ? 4.548 -23.306 5.455 1.00 34.46 ? 601 TYR F CB 1 +ATOM 33354 C CG . TYR F 1 601 ? 5.066 -21.900 5.279 1.00 34.14 ? 601 TYR F CG 1 +ATOM 33355 C CD1 . TYR F 1 601 ? 4.808 -20.917 6.231 1.00 34.27 ? 601 TYR F CD1 1 +ATOM 33356 C CD2 . TYR F 1 601 ? 5.794 -21.547 4.147 1.00 33.30 ? 601 TYR F CD2 1 +ATOM 33357 C CE1 . TYR F 1 601 ? 5.262 -19.614 6.059 1.00 35.87 ? 601 TYR F CE1 1 +ATOM 33358 C CE2 . TYR F 1 601 ? 6.254 -20.254 3.962 1.00 34.38 ? 601 TYR F CE2 1 +ATOM 33359 C CZ . TYR F 1 601 ? 5.987 -19.286 4.919 1.00 36.94 ? 601 TYR F CZ 1 +ATOM 33360 O OH . TYR F 1 601 ? 6.439 -17.991 4.735 1.00 36.79 ? 601 TYR F OH 1 +ATOM 33361 N N . LEU F 1 602 ? 2.567 -25.678 4.256 1.00 35.86 ? 602 LEU F N 1 +ATOM 33362 C CA . LEU F 1 602 ? 2.205 -27.082 4.354 1.00 35.88 ? 602 LEU F CA 1 +ATOM 33363 C C . LEU F 1 602 ? 3.458 -27.919 4.244 1.00 36.22 ? 602 LEU F C 1 +ATOM 33364 O O . LEU F 1 602 ? 4.320 -27.694 3.397 1.00 34.35 ? 602 LEU F O 1 +ATOM 33365 C CB . LEU F 1 602 ? 1.211 -27.476 3.261 1.00 37.01 ? 602 LEU F CB 1 +ATOM 33366 C CG . LEU F 1 602 ? -0.103 -26.696 3.267 1.00 39.48 ? 602 LEU F CG 1 +ATOM 33367 C CD1 . LEU F 1 602 ? -1.064 -27.329 2.283 1.00 38.96 ? 602 LEU F CD1 1 +ATOM 33368 C CD2 . LEU F 1 602 ? -0.707 -26.695 4.672 1.00 40.06 ? 602 LEU F CD2 1 +ATOM 33369 N N . ARG F 1 603 ? 3.544 -28.887 5.138 1.00 38.53 ? 603 ARG F N 1 +ATOM 33370 C CA . ARG F 1 603 ? 4.665 -29.795 5.210 1.00 40.02 ? 603 ARG F CA 1 +ATOM 33371 C C . ARG F 1 603 ? 4.586 -30.850 4.123 1.00 40.47 ? 603 ARG F C 1 +ATOM 33372 O O . ARG F 1 603 ? 3.506 -31.321 3.745 1.00 39.82 ? 603 ARG F O 1 +ATOM 33373 C CB . ARG F 1 603 ? 4.652 -30.461 6.577 1.00 40.12 ? 603 ARG F CB 1 +ATOM 33374 C CG . ARG F 1 603 ? 5.814 -31.354 6.896 1.00 40.17 ? 603 ARG F CG 1 +ATOM 33375 C CD . ARG F 1 603 ? 5.540 -31.989 8.234 1.00 41.01 ? 603 ARG F CD 1 +ATOM 33376 N NE . ARG F 1 603 ? 6.669 -32.745 8.752 1.00 40.81 ? 603 ARG F NE 1 +ATOM 33377 C CZ . ARG F 1 603 ? 6.691 -33.283 9.962 1.00 39.46 ? 603 ARG F CZ 1 +ATOM 33378 N NH1 . ARG F 1 603 ? 5.643 -33.137 10.758 1.00 39.91 ? 603 ARG F NH1 1 +ATOM 33379 N NH2 . ARG F 1 603 ? 7.756 -33.956 10.374 1.00 41.75 ? 603 ARG F NH2 1 +ATOM 33380 N N . GLU F 1 604 ? 5.753 -31.204 3.624 1.00 41.04 ? 604 GLU F N 1 +ATOM 33381 C CA . GLU F 1 604 ? 5.795 -32.230 2.624 1.00 42.40 ? 604 GLU F CA 1 +ATOM 33382 C C . GLU F 1 604 ? 5.357 -33.472 3.387 1.00 42.39 ? 604 GLU F C 1 +ATOM 33383 O O . GLU F 1 604 ? 6.024 -33.903 4.331 1.00 41.78 ? 604 GLU F O 1 +ATOM 33384 C CB . GLU F 1 604 ? 7.201 -32.388 2.085 1.00 44.68 ? 604 GLU F CB 1 +ATOM 33385 C CG . GLU F 1 604 ? 7.269 -33.384 0.968 1.00 48.83 ? 604 GLU F CG 1 +ATOM 33386 C CD . GLU F 1 604 ? 8.628 -33.423 0.319 1.00 51.73 ? 604 GLU F CD 1 +ATOM 33387 O OE1 . GLU F 1 604 ? 9.627 -33.618 1.044 1.00 54.50 ? 604 GLU F OE1 1 +ATOM 33388 O OE2 . GLU F 1 604 ? 8.701 -33.260 -0.919 1.00 53.65 ? 604 GLU F OE2 1 +ATOM 33389 N N . GLY F 1 605 ? 4.220 -34.026 2.977 1.00 40.13 ? 605 GLY F N 1 +ATOM 33390 C CA . GLY F 1 605 ? 3.663 -35.179 3.646 1.00 37.90 ? 605 GLY F CA 1 +ATOM 33391 C C . GLY F 1 605 ? 2.465 -34.671 4.429 1.00 38.85 ? 605 GLY F C 1 +ATOM 33392 O O . GLY F 1 605 ? 2.415 -34.793 5.652 1.00 38.88 ? 605 GLY F O 1 +ATOM 33393 N N . SER F 1 606 ? 1.497 -34.094 3.718 1.00 37.19 ? 606 SER F N 1 +ATOM 33394 C CA . SER F 1 606 ? 0.309 -33.542 4.342 1.00 36.37 ? 606 SER F CA 1 +ATOM 33395 C C . SER F 1 606 ? -0.970 -33.875 3.596 1.00 36.16 ? 606 SER F C 1 +ATOM 33396 O O . SER F 1 606 ? -0.989 -33.986 2.374 1.00 35.09 ? 606 SER F O 1 +ATOM 33397 C CB . SER F 1 606 ? 0.407 -32.012 4.410 1.00 37.59 ? 606 SER F CB 1 +ATOM 33398 O OG . SER F 1 606 ? 1.556 -31.573 5.097 1.00 41.11 ? 606 SER F OG 1 +ATOM 33399 N N . ILE F 1 607 ? -2.049 -34.011 4.351 1.00 36.02 ? 607 ILE F N 1 +ATOM 33400 C CA . ILE F 1 607 ? -3.369 -34.242 3.781 1.00 36.48 ? 607 ILE F CA 1 +ATOM 33401 C C . ILE F 1 607 ? -4.283 -33.355 4.611 1.00 36.13 ? 607 ILE F C 1 +ATOM 33402 O O . ILE F 1 607 ? -4.414 -33.538 5.822 1.00 34.48 ? 607 ILE F O 1 +ATOM 33403 C CB . ILE F 1 607 ? -3.825 -35.697 3.909 1.00 37.26 ? 607 ILE F CB 1 +ATOM 33404 C CG1 . ILE F 1 607 ? -2.973 -36.590 3.012 1.00 37.85 ? 607 ILE F CG1 1 +ATOM 33405 C CG2 . ILE F 1 607 ? -5.287 -35.815 3.519 1.00 36.95 ? 607 ILE F CG2 1 +ATOM 33406 C CD1 . ILE F 1 607 ? -3.244 -38.082 3.202 1.00 38.57 ? 607 ILE F CD1 1 +ATOM 33407 N N . ILE F 1 608 ? -4.906 -32.381 3.967 1.00 35.71 ? 608 ILE F N 1 +ATOM 33408 C CA . ILE F 1 608 ? -5.766 -31.482 4.706 1.00 36.15 ? 608 ILE F CA 1 +ATOM 33409 C C . ILE F 1 608 ? -7.184 -31.391 4.181 1.00 36.03 ? 608 ILE F C 1 +ATOM 33410 O O . ILE F 1 608 ? -7.419 -30.960 3.054 1.00 36.73 ? 608 ILE F O 1 +ATOM 33411 C CB . ILE F 1 608 ? -5.135 -30.072 4.757 1.00 36.57 ? 608 ILE F CB 1 +ATOM 33412 C CG1 . ILE F 1 608 ? -3.808 -30.149 5.521 1.00 36.22 ? 608 ILE F CG1 1 +ATOM 33413 C CG2 . ILE F 1 608 ? -6.088 -29.085 5.421 1.00 34.25 ? 608 ILE F CG2 1 +ATOM 33414 C CD1 . ILE F 1 608 ? -3.003 -28.908 5.462 1.00 38.58 ? 608 ILE F CD1 1 +ATOM 33415 N N . PRO F 1 609 ? -8.153 -31.828 4.986 1.00 36.28 ? 609 PRO F N 1 +ATOM 33416 C CA . PRO F 1 609 ? -9.548 -31.762 4.556 1.00 36.95 ? 609 PRO F CA 1 +ATOM 33417 C C . PRO F 1 609 ? -10.043 -30.338 4.793 1.00 37.97 ? 609 PRO F C 1 +ATOM 33418 O O . PRO F 1 609 ? -9.786 -29.746 5.845 1.00 37.53 ? 609 PRO F O 1 +ATOM 33419 C CB . PRO F 1 609 ? -10.233 -32.776 5.464 1.00 36.79 ? 609 PRO F CB 1 +ATOM 33420 C CG . PRO F 1 609 ? -9.468 -32.648 6.725 1.00 35.76 ? 609 PRO F CG 1 +ATOM 33421 C CD . PRO F 1 609 ? -8.028 -32.572 6.250 1.00 36.52 ? 609 PRO F CD 1 +ATOM 33422 N N . LEU F 1 610 ? -10.732 -29.781 3.807 1.00 39.38 ? 610 LEU F N 1 +ATOM 33423 C CA . LEU F 1 610 ? -11.264 -28.432 3.919 1.00 39.62 ? 610 LEU F CA 1 +ATOM 33424 C C . LEU F 1 610 ? -12.777 -28.428 3.817 1.00 39.53 ? 610 LEU F C 1 +ATOM 33425 O O . LEU F 1 610 ? -13.389 -29.430 3.457 1.00 40.02 ? 610 LEU F O 1 +ATOM 33426 C CB . LEU F 1 610 ? -10.680 -27.539 2.828 1.00 39.11 ? 610 LEU F CB 1 +ATOM 33427 C CG . LEU F 1 610 ? -9.164 -27.378 2.876 1.00 40.83 ? 610 LEU F CG 1 +ATOM 33428 C CD1 . LEU F 1 610 ? -8.714 -26.555 1.687 1.00 40.44 ? 610 LEU F CD1 1 +ATOM 33429 C CD2 . LEU F 1 610 ? -8.747 -26.714 4.187 1.00 39.62 ? 610 LEU F CD2 1 +ATOM 33430 N N . GLU F 1 611 ? -13.373 -27.288 4.143 1.00 40.97 ? 611 GLU F N 1 +ATOM 33431 C CA . GLU F 1 611 ? -14.817 -27.123 4.092 1.00 42.07 ? 611 GLU F CA 1 +ATOM 33432 C C . GLU F 1 611 ? -15.375 -27.460 2.703 1.00 41.45 ? 611 GLU F C 1 +ATOM 33433 O O . GLU F 1 611 ? -14.749 -27.185 1.680 1.00 38.43 ? 611 GLU F O 1 +ATOM 33434 C CB . GLU F 1 611 ? -15.152 -25.687 4.476 1.00 43.88 ? 611 GLU F CB 1 +ATOM 33435 C CG . GLU F 1 611 ? -16.610 -25.313 4.409 1.00 49.86 ? 611 GLU F CG 1 +ATOM 33436 C CD . GLU F 1 611 ? -16.847 -23.878 4.878 1.00 53.70 ? 611 GLU F CD 1 +ATOM 33437 O OE1 . GLU F 1 611 ? -16.152 -22.955 4.377 1.00 53.39 ? 611 GLU F OE1 1 +ATOM 33438 O OE2 . GLU F 1 611 ? -17.727 -23.675 5.748 1.00 55.14 ? 611 GLU F OE2 1 +ATOM 33439 N N . GLY F 1 612 ? -16.550 -28.076 2.677 1.00 41.55 ? 612 GLY F N 1 +ATOM 33440 C CA . GLY F 1 612 ? -17.163 -28.424 1.410 1.00 42.60 ? 612 GLY F CA 1 +ATOM 33441 C C . GLY F 1 612 ? -16.506 -29.588 0.698 1.00 43.02 ? 612 GLY F C 1 +ATOM 33442 O O . GLY F 1 612 ? -16.438 -29.609 -0.527 1.00 42.43 ? 612 GLY F O 1 +ATOM 33443 N N . ASP F 1 613 ? -16.013 -30.550 1.469 1.00 44.29 ? 613 ASP F N 1 +ATOM 33444 C CA . ASP F 1 613 ? -15.366 -31.739 0.922 1.00 44.92 ? 613 ASP F CA 1 +ATOM 33445 C C . ASP F 1 613 ? -14.126 -31.485 0.068 1.00 44.08 ? 613 ASP F C 1 +ATOM 33446 O O . ASP F 1 613 ? -13.734 -32.334 -0.730 1.00 43.83 ? 613 ASP F O 1 +ATOM 33447 C CB . ASP F 1 613 ? -16.384 -32.557 0.128 1.00 47.62 ? 613 ASP F CB 1 +ATOM 33448 C CG . ASP F 1 613 ? -17.544 -33.025 0.986 1.00 50.96 ? 613 ASP F CG 1 +ATOM 33449 O OD1 . ASP F 1 613 ? -17.327 -33.886 1.866 1.00 52.04 ? 613 ASP F OD1 1 +ATOM 33450 O OD2 . ASP F 1 613 ? -18.672 -32.522 0.790 1.00 52.63 ? 613 ASP F OD2 1 +ATOM 33451 N N . GLU F 1 614 ? -13.514 -30.317 0.220 1.00 44.25 ? 614 GLU F N 1 +ATOM 33452 C CA . GLU F 1 614 ? -12.300 -30.017 -0.527 1.00 44.54 ? 614 GLU F CA 1 +ATOM 33453 C C . GLU F 1 614 ? -11.197 -30.836 0.120 1.00 42.82 ? 614 GLU F C 1 +ATOM 33454 O O . GLU F 1 614 ? -11.327 -31.285 1.261 1.00 40.45 ? 614 GLU F O 1 +ATOM 33455 C CB . GLU F 1 614 ? -11.935 -28.532 -0.438 1.00 47.57 ? 614 GLU F CB 1 +ATOM 33456 C CG . GLU F 1 614 ? -12.353 -27.687 -1.626 1.00 52.62 ? 614 GLU F CG 1 +ATOM 33457 C CD . GLU F 1 614 ? -11.717 -26.297 -1.614 1.00 56.62 ? 614 GLU F CD 1 +ATOM 33458 O OE1 . GLU F 1 614 ? -10.472 -26.202 -1.507 1.00 58.15 ? 614 GLU F OE1 1 +ATOM 33459 O OE2 . GLU F 1 614 ? -12.457 -25.294 -1.721 1.00 58.85 ? 614 GLU F OE2 1 +ATOM 33460 N N . LEU F 1 615 ? -10.100 -31.011 -0.600 1.00 42.61 ? 615 LEU F N 1 +ATOM 33461 C CA . LEU F 1 615 ? -8.992 -31.792 -0.087 1.00 41.91 ? 615 LEU F CA 1 +ATOM 33462 C C . LEU F 1 615 ? -7.659 -31.312 -0.659 1.00 41.22 ? 615 LEU F C 1 +ATOM 33463 O O . LEU F 1 615 ? -7.539 -31.091 -1.863 1.00 40.84 ? 615 LEU F O 1 +ATOM 33464 C CB . LEU F 1 615 ? -9.223 -33.260 -0.449 1.00 42.96 ? 615 LEU F CB 1 +ATOM 33465 C CG . LEU F 1 615 ? -8.469 -34.345 0.314 1.00 45.13 ? 615 LEU F CG 1 +ATOM 33466 C CD1 . LEU F 1 615 ? -8.892 -34.327 1.776 1.00 44.20 ? 615 LEU F CD1 1 +ATOM 33467 C CD2 . LEU F 1 615 ? -8.779 -35.704 -0.306 1.00 46.08 ? 615 LEU F CD2 1 +ATOM 33468 N N . ILE F 1 616 ? -6.665 -31.137 0.208 1.00 40.57 ? 616 ILE F N 1 +ATOM 33469 C CA . ILE F 1 616 ? -5.332 -30.723 -0.226 1.00 40.14 ? 616 ILE F CA 1 +ATOM 33470 C C . ILE F 1 616 ? -4.376 -31.853 0.125 1.00 39.30 ? 616 ILE F C 1 +ATOM 33471 O O . ILE F 1 616 ? -4.370 -32.341 1.257 1.00 38.03 ? 616 ILE F O 1 +ATOM 33472 C CB . ILE F 1 616 ? -4.811 -29.474 0.515 1.00 42.46 ? 616 ILE F CB 1 +ATOM 33473 C CG1 . ILE F 1 616 ? -5.786 -28.312 0.376 1.00 44.67 ? 616 ILE F CG1 1 +ATOM 33474 C CG2 . ILE F 1 616 ? -3.459 -29.064 -0.054 1.00 42.85 ? 616 ILE F CG2 1 +ATOM 33475 C CD1 . ILE F 1 616 ? -5.358 -27.091 1.162 1.00 45.00 ? 616 ILE F CD1 1 +ATOM 33476 N N . VAL F 1 617 ? -3.557 -32.256 -0.837 1.00 38.08 ? 617 VAL F N 1 +ATOM 33477 C CA . VAL F 1 617 ? -2.606 -33.323 -0.607 1.00 35.92 ? 617 VAL F CA 1 +ATOM 33478 C C . VAL F 1 617 ? -1.235 -32.905 -1.091 1.00 36.94 ? 617 VAL F C 1 +ATOM 33479 O O . VAL F 1 617 ? -1.094 -32.419 -2.212 1.00 37.95 ? 617 VAL F O 1 +ATOM 33480 C CB . VAL F 1 617 ? -3.020 -34.607 -1.344 1.00 35.31 ? 617 VAL F CB 1 +ATOM 33481 C CG1 . VAL F 1 617 ? -1.956 -35.688 -1.165 1.00 31.97 ? 617 VAL F CG1 1 +ATOM 33482 C CG2 . VAL F 1 617 ? -4.356 -35.083 -0.819 1.00 31.85 ? 617 VAL F CG2 1 +ATOM 33483 N N . TYR F 1 618 ? -0.232 -33.096 -0.237 1.00 35.93 ? 618 TYR F N 1 +ATOM 33484 C CA . TYR F 1 618 ? 1.148 -32.761 -0.563 1.00 37.06 ? 618 TYR F CA 1 +ATOM 33485 C C . TYR F 1 618 ? 2.061 -33.854 -0.013 1.00 38.01 ? 618 TYR F C 1 +ATOM 33486 O O . TYR F 1 618 ? 2.276 -33.956 1.194 1.00 37.82 ? 618 TYR F O 1 +ATOM 33487 C CB . TYR F 1 618 ? 1.521 -31.398 0.043 1.00 36.33 ? 618 TYR F CB 1 +ATOM 33488 C CG . TYR F 1 618 ? 2.975 -30.995 -0.114 1.00 34.73 ? 618 TYR F CG 1 +ATOM 33489 C CD1 . TYR F 1 618 ? 3.759 -31.503 -1.152 1.00 34.90 ? 618 TYR F CD1 1 +ATOM 33490 C CD2 . TYR F 1 618 ? 3.558 -30.080 0.757 1.00 35.90 ? 618 TYR F CD2 1 +ATOM 33491 C CE1 . TYR F 1 618 ? 5.085 -31.115 -1.315 1.00 34.88 ? 618 TYR F CE1 1 +ATOM 33492 C CE2 . TYR F 1 618 ? 4.888 -29.677 0.601 1.00 36.11 ? 618 TYR F CE2 1 +ATOM 33493 C CZ . TYR F 1 618 ? 5.645 -30.204 -0.436 1.00 36.60 ? 618 TYR F CZ 1 +ATOM 33494 O OH . TYR F 1 618 ? 6.964 -29.845 -0.589 1.00 36.29 ? 618 TYR F OH 1 +ATOM 33495 N N . GLY F 1 619 ? 2.596 -34.674 -0.903 1.00 38.12 ? 619 GLY F N 1 +ATOM 33496 C CA . GLY F 1 619 ? 3.471 -35.742 -0.464 1.00 41.08 ? 619 GLY F CA 1 +ATOM 33497 C C . GLY F 1 619 ? 2.761 -36.992 0.032 1.00 42.34 ? 619 GLY F C 1 +ATOM 33498 O O . GLY F 1 619 ? 1.578 -37.208 -0.241 1.00 41.15 ? 619 GLY F O 1 +ATOM 33499 N N . GLU F 1 620 ? 3.489 -37.810 0.785 1.00 44.39 ? 620 GLU F N 1 +ATOM 33500 C CA . GLU F 1 620 ? 2.960 -39.062 1.308 1.00 46.49 ? 620 GLU F CA 1 +ATOM 33501 C C . GLU F 1 620 ? 2.734 -39.045 2.809 1.00 45.94 ? 620 GLU F C 1 +ATOM 33502 O O . GLU F 1 620 ? 3.602 -38.644 3.581 1.00 46.11 ? 620 GLU F O 1 +ATOM 33503 C CB . GLU F 1 620 ? 3.913 -40.201 0.953 1.00 49.40 ? 620 GLU F CB 1 +ATOM 33504 C CG . GLU F 1 620 ? 4.246 -40.257 -0.524 1.00 55.52 ? 620 GLU F CG 1 +ATOM 33505 C CD . GLU F 1 620 ? 5.317 -41.273 -0.842 1.00 59.25 ? 620 GLU F CD 1 +ATOM 33506 O OE1 . GLU F 1 620 ? 6.431 -41.147 -0.282 1.00 61.10 ? 620 GLU F OE1 1 +ATOM 33507 O OE2 . GLU F 1 620 ? 5.042 -42.193 -1.650 1.00 61.44 ? 620 GLU F OE2 1 +ATOM 33508 N N . THR F 1 621 ? 1.557 -39.491 3.218 1.00 44.91 ? 621 THR F N 1 +ATOM 33509 C CA . THR F 1 621 ? 1.205 -39.546 4.629 1.00 44.73 ? 621 THR F CA 1 +ATOM 33510 C C . THR F 1 621 ? -0.143 -40.243 4.741 1.00 43.87 ? 621 THR F C 1 +ATOM 33511 O O . THR F 1 621 ? -0.756 -40.599 3.738 1.00 43.53 ? 621 THR F O 1 +ATOM 33512 C CB . THR F 1 621 ? 1.111 -38.112 5.262 1.00 45.94 ? 621 THR F CB 1 +ATOM 33513 O OG1 . THR F 1 621 ? 0.897 -38.211 6.681 1.00 44.43 ? 621 THR F OG1 1 +ATOM 33514 C CG2 . THR F 1 621 ? -0.047 -37.322 4.650 1.00 44.61 ? 621 THR F CG2 1 +ATOM 33515 N N . SER F 1 622 ? -0.595 -40.443 5.967 1.00 43.66 ? 622 SER F N 1 +ATOM 33516 C CA . SER F 1 622 ? -1.876 -41.085 6.213 1.00 43.78 ? 622 SER F CA 1 +ATOM 33517 C C . SER F 1 622 ? -2.624 -40.196 7.193 1.00 42.64 ? 622 SER F C 1 +ATOM 33518 O O . SER F 1 622 ? -2.035 -39.694 8.137 1.00 42.33 ? 622 SER F O 1 +ATOM 33519 C CB . SER F 1 622 ? -1.660 -42.467 6.808 1.00 44.18 ? 622 SER F CB 1 +ATOM 33520 O OG . SER F 1 622 ? -2.890 -43.142 6.903 1.00 47.59 ? 622 SER F OG 1 +ATOM 33521 N N . PHE F 1 623 ? -3.918 -40.010 6.976 1.00 42.38 ? 623 PHE F N 1 +ATOM 33522 C CA . PHE F 1 623 ? -4.702 -39.126 7.824 1.00 42.31 ? 623 PHE F CA 1 +ATOM 33523 C C . PHE F 1 623 ? -6.122 -39.630 8.058 1.00 42.14 ? 623 PHE F C 1 +ATOM 33524 O O . PHE F 1 623 ? -6.788 -40.119 7.148 1.00 41.22 ? 623 PHE F O 1 +ATOM 33525 C CB . PHE F 1 623 ? -4.745 -37.729 7.171 1.00 44.62 ? 623 PHE F CB 1 +ATOM 33526 C CG . PHE F 1 623 ? -5.528 -36.702 7.948 1.00 45.39 ? 623 PHE F CG 1 +ATOM 33527 C CD1 . PHE F 1 623 ? -5.033 -36.185 9.143 1.00 46.05 ? 623 PHE F CD1 1 +ATOM 33528 C CD2 . PHE F 1 623 ? -6.760 -36.250 7.477 1.00 45.77 ? 623 PHE F CD2 1 +ATOM 33529 C CE1 . PHE F 1 623 ? -5.749 -35.230 9.859 1.00 47.34 ? 623 PHE F CE1 1 +ATOM 33530 C CE2 . PHE F 1 623 ? -7.490 -35.296 8.183 1.00 47.45 ? 623 PHE F CE2 1 +ATOM 33531 C CZ . PHE F 1 623 ? -6.984 -34.783 9.377 1.00 47.40 ? 623 PHE F CZ 1 +ATOM 33532 N N . LYS F 1 624 ? -6.593 -39.481 9.285 1.00 42.20 ? 624 LYS F N 1 +ATOM 33533 C CA . LYS F 1 624 ? -7.934 -39.901 9.629 1.00 43.45 ? 624 LYS F CA 1 +ATOM 33534 C C . LYS F 1 624 ? -8.849 -38.680 9.768 1.00 43.42 ? 624 LYS F C 1 +ATOM 33535 O O . LYS F 1 624 ? -8.653 -37.842 10.637 1.00 42.72 ? 624 LYS F O 1 +ATOM 33536 C CB . LYS F 1 624 ? -7.897 -40.695 10.937 1.00 44.33 ? 624 LYS F CB 1 +ATOM 33537 C CG . LYS F 1 624 ? -9.242 -41.235 11.390 1.00 47.48 ? 624 LYS F CG 1 +ATOM 33538 C CD . LYS F 1 624 ? -9.080 -42.096 12.620 1.00 48.45 ? 624 LYS F CD 1 +ATOM 33539 C CE . LYS F 1 624 ? -10.400 -42.683 13.049 1.00 51.47 ? 624 LYS F CE 1 +ATOM 33540 N NZ . LYS F 1 624 ? -10.226 -43.581 14.227 1.00 53.33 ? 624 LYS F NZ 1 +ATOM 33541 N N . ARG F 1 625 ? -9.849 -38.576 8.904 1.00 44.77 ? 625 ARG F N 1 +ATOM 33542 C CA . ARG F 1 625 ? -10.771 -37.454 8.968 1.00 44.93 ? 625 ARG F CA 1 +ATOM 33543 C C . ARG F 1 625 ? -11.717 -37.670 10.144 1.00 44.80 ? 625 ARG F C 1 +ATOM 33544 O O . ARG F 1 625 ? -11.878 -38.793 10.604 1.00 45.03 ? 625 ARG F O 1 +ATOM 33545 C CB . ARG F 1 625 ? -11.542 -37.328 7.659 1.00 44.66 ? 625 ARG F CB 1 +ATOM 33546 C CG . ARG F 1 625 ? -12.126 -35.956 7.466 1.00 47.96 ? 625 ARG F CG 1 +ATOM 33547 C CD . ARG F 1 625 ? -12.586 -35.739 6.051 1.00 49.58 ? 625 ARG F CD 1 +ATOM 33548 N NE . ARG F 1 625 ? -13.673 -36.638 5.685 1.00 52.46 ? 625 ARG F NE 1 +ATOM 33549 C CZ . ARG F 1 625 ? -14.290 -36.618 4.508 1.00 51.81 ? 625 ARG F CZ 1 +ATOM 33550 N NH1 . ARG F 1 625 ? -13.929 -35.743 3.581 1.00 50.79 ? 625 ARG F NH1 1 +ATOM 33551 N NH2 . ARG F 1 625 ? -15.266 -37.477 4.257 1.00 53.38 ? 625 ARG F NH2 1 +ATOM 33552 N N . TYR F 1 626 ? -12.339 -36.599 10.628 1.00 45.34 ? 626 TYR F N 1 +ATOM 33553 C CA . TYR F 1 626 ? -13.235 -36.684 11.783 1.00 46.83 ? 626 TYR F CA 1 +ATOM 33554 C C . TYR F 1 626 ? -14.428 -37.614 11.631 1.00 47.73 ? 626 TYR F C 1 +ATOM 33555 O O . TYR F 1 626 ? -14.975 -38.095 12.624 1.00 47.88 ? 626 TYR F O 1 +ATOM 33556 C CB . TYR F 1 626 ? -13.730 -35.288 12.173 1.00 45.61 ? 626 TYR F CB 1 +ATOM 33557 C CG . TYR F 1 626 ? -14.736 -34.693 11.225 1.00 45.34 ? 626 TYR F CG 1 +ATOM 33558 C CD1 . TYR F 1 626 ? -16.085 -35.024 11.312 1.00 45.01 ? 626 TYR F CD1 1 +ATOM 33559 C CD2 . TYR F 1 626 ? -14.338 -33.802 10.232 1.00 45.61 ? 626 TYR F CD2 1 +ATOM 33560 C CE1 . TYR F 1 626 ? -17.013 -34.481 10.437 1.00 45.59 ? 626 TYR F CE1 1 +ATOM 33561 C CE2 . TYR F 1 626 ? -15.256 -33.254 9.348 1.00 45.50 ? 626 TYR F CE2 1 +ATOM 33562 C CZ . TYR F 1 626 ? -16.593 -33.595 9.456 1.00 46.89 ? 626 TYR F CZ 1 +ATOM 33563 O OH . TYR F 1 626 ? -17.512 -33.038 8.588 1.00 47.87 ? 626 TYR F OH 1 +ATOM 33564 N N . ASP F 1 627 ? -14.841 -37.860 10.397 1.00 49.74 ? 627 ASP F N 1 +ATOM 33565 C CA . ASP F 1 627 ? -15.970 -38.747 10.155 1.00 52.17 ? 627 ASP F CA 1 +ATOM 33566 C C . ASP F 1 627 ? -15.497 -40.193 10.002 1.00 52.34 ? 627 ASP F C 1 +ATOM 33567 O O . ASP F 1 627 ? -16.208 -41.039 9.465 1.00 51.52 ? 627 ASP F O 1 +ATOM 33568 C CB . ASP F 1 627 ? -16.738 -38.290 8.911 1.00 53.23 ? 627 ASP F CB 1 +ATOM 33569 C CG . ASP F 1 627 ? -15.915 -38.392 7.644 1.00 55.00 ? 627 ASP F CG 1 +ATOM 33570 O OD1 . ASP F 1 627 ? -14.668 -38.357 7.731 1.00 55.92 ? 627 ASP F OD1 1 +ATOM 33571 O OD2 . ASP F 1 627 ? -16.521 -38.493 6.556 1.00 56.25 ? 627 ASP F OD2 1 +ATOM 33572 N N . ASN F 1 628 ? -14.283 -40.457 10.480 1.00 53.88 ? 628 ASN F N 1 +ATOM 33573 C CA . ASN F 1 628 ? -13.687 -41.787 10.442 1.00 55.94 ? 628 ASN F CA 1 +ATOM 33574 C C . ASN F 1 628 ? -13.049 -42.211 9.110 1.00 54.71 ? 628 ASN F C 1 +ATOM 33575 O O . ASN F 1 628 ? -12.328 -43.205 9.061 1.00 55.52 ? 628 ASN F O 1 +ATOM 33576 C CB . ASN F 1 628 ? -14.725 -42.821 10.895 1.00 60.05 ? 628 ASN F CB 1 +ATOM 33577 C CG . ASN F 1 628 ? -14.534 -44.168 10.235 1.00 64.66 ? 628 ASN F CG 1 +ATOM 33578 O OD1 . ASN F 1 628 ? -14.799 -44.328 9.035 1.00 67.24 ? 628 ASN F OD1 1 +ATOM 33579 N ND2 . ASN F 1 628 ? -14.061 -45.149 11.008 1.00 66.98 ? 628 ASN F ND2 1 +ATOM 33580 N N . ALA F 1 629 ? -13.298 -41.467 8.039 1.00 53.02 ? 629 ALA F N 1 +ATOM 33581 C CA . ALA F 1 629 ? -12.720 -41.802 6.743 1.00 51.38 ? 629 ALA F CA 1 +ATOM 33582 C C . ALA F 1 629 ? -11.200 -41.599 6.747 1.00 50.79 ? 629 ALA F C 1 +ATOM 33583 O O . ALA F 1 629 ? -10.713 -40.506 7.013 1.00 50.09 ? 629 ALA F O 1 +ATOM 33584 C CB . ALA F 1 629 ? -13.358 -40.952 5.660 1.00 50.74 ? 629 ALA F CB 1 +ATOM 33585 N N . GLU F 1 630 ? -10.453 -42.655 6.454 1.00 50.22 ? 630 GLU F N 1 +ATOM 33586 C CA . GLU F 1 630 ? -9.000 -42.565 6.428 1.00 51.07 ? 630 GLU F CA 1 +ATOM 33587 C C . GLU F 1 630 ? -8.509 -42.342 5.012 1.00 48.90 ? 630 GLU F C 1 +ATOM 33588 O O . GLU F 1 630 ? -8.972 -42.987 4.084 1.00 48.52 ? 630 GLU F O 1 +ATOM 33589 C CB . GLU F 1 630 ? -8.396 -43.841 6.994 1.00 55.18 ? 630 GLU F CB 1 +ATOM 33590 C CG . GLU F 1 630 ? -8.754 -44.068 8.452 1.00 62.13 ? 630 GLU F CG 1 +ATOM 33591 C CD . GLU F 1 630 ? -8.482 -45.491 8.913 1.00 66.16 ? 630 GLU F CD 1 +ATOM 33592 O OE1 . GLU F 1 630 ? -7.305 -45.926 8.881 1.00 68.69 ? 630 GLU F OE1 1 +ATOM 33593 O OE2 . GLU F 1 630 ? -9.453 -46.177 9.304 1.00 68.25 ? 630 GLU F OE2 1 +ATOM 33594 N N . ILE F 1 631 ? -7.572 -41.420 4.848 1.00 47.33 ? 631 ILE F N 1 +ATOM 33595 C CA . ILE F 1 631 ? -7.030 -41.103 3.534 1.00 46.50 ? 631 ILE F CA 1 +ATOM 33596 C C . ILE F 1 631 ? -5.532 -41.350 3.556 1.00 46.13 ? 631 ILE F C 1 +ATOM 33597 O O . ILE F 1 631 ? -4.854 -40.993 4.512 1.00 47.01 ? 631 ILE F O 1 +ATOM 33598 C CB . ILE F 1 631 ? -7.300 -39.627 3.179 1.00 46.23 ? 631 ILE F CB 1 +ATOM 33599 C CG1 . ILE F 1 631 ? -8.794 -39.337 3.301 1.00 45.97 ? 631 ILE F CG1 1 +ATOM 33600 C CG2 . ILE F 1 631 ? -6.814 -39.323 1.786 1.00 45.11 ? 631 ILE F CG2 1 +ATOM 33601 C CD1 . ILE F 1 631 ? -9.153 -37.879 3.147 1.00 47.43 ? 631 ILE F CD1 1 +ATOM 33602 N N . THR F 1 632 ? -5.010 -41.960 2.505 1.00 45.99 ? 632 THR F N 1 +ATOM 33603 C CA . THR F 1 632 ? -3.588 -42.244 2.454 1.00 48.01 ? 632 THR F CA 1 +ATOM 33604 C C . THR F 1 632 ? -3.016 -41.849 1.110 1.00 48.30 ? 632 THR F C 1 +ATOM 33605 O O . THR F 1 632 ? -3.641 -42.063 0.078 1.00 48.60 ? 632 THR F O 1 +ATOM 33606 C CB . THR F 1 632 ? -3.306 -43.751 2.670 1.00 48.93 ? 632 THR F CB 1 +ATOM 33607 O OG1 . THR F 1 632 ? -3.961 -44.200 3.864 1.00 50.28 ? 632 THR F OG1 1 +ATOM 33608 C CG2 . THR F 1 632 ? -1.807 -43.998 2.797 1.00 48.76 ? 632 THR F CG2 1 +ATOM 33609 N N . SER F 1 633 ? -1.831 -41.261 1.123 1.00 48.95 ? 633 SER F N 1 +ATOM 33610 C CA . SER F 1 633 ? -1.196 -40.880 -0.120 1.00 50.91 ? 633 SER F CA 1 +ATOM 33611 C C . SER F 1 633 ? 0.181 -41.500 -0.140 1.00 49.81 ? 633 SER F C 1 +ATOM 33612 O O . SER F 1 633 ? 0.904 -41.482 0.852 1.00 50.75 ? 633 SER F O 1 +ATOM 33613 C CB . SER F 1 633 ? -1.089 -39.357 -0.254 1.00 51.09 ? 633 SER F CB 1 +ATOM 33614 O OG . SER F 1 633 ? -0.149 -38.834 0.659 1.00 56.96 ? 633 SER F OG 1 +ATOM 33615 N N . SER F 1 634 ? 0.531 -42.070 -1.277 1.00 48.68 ? 634 SER F N 1 +ATOM 33616 C CA . SER F 1 634 ? 1.829 -42.688 -1.443 1.00 48.12 ? 634 SER F CA 1 +ATOM 33617 C C . SER F 1 634 ? 1.921 -43.258 -2.837 1.00 48.06 ? 634 SER F C 1 +ATOM 33618 O O . SER F 1 634 ? 0.929 -43.728 -3.391 1.00 46.53 ? 634 SER F O 1 +ATOM 33619 C CB . SER F 1 634 ? 2.029 -43.789 -0.406 1.00 48.18 ? 634 SER F CB 1 +ATOM 33620 O OG . SER F 1 634 ? 0.911 -44.657 -0.366 1.00 48.94 ? 634 SER F OG 1 +ATOM 33621 N N . SER F 1 635 ? 3.113 -43.187 -3.415 1.00 50.27 ? 635 SER F N 1 +ATOM 33622 C CA . SER F 1 635 ? 3.327 -43.713 -4.748 1.00 51.07 ? 635 SER F CA 1 +ATOM 33623 C C . SER F 1 635 ? 2.320 -43.098 -5.728 1.00 52.83 ? 635 SER F C 1 +ATOM 33624 O O . SER F 1 635 ? 1.723 -43.801 -6.550 1.00 53.08 ? 635 SER F O 1 +ATOM 33625 C CB . SER F 1 635 ? 3.180 -45.236 -4.711 1.00 51.40 ? 635 SER F CB 1 +ATOM 33626 O OG . SER F 1 635 ? 3.986 -45.803 -3.686 1.00 53.16 ? 635 SER F OG 1 +ATOM 33627 N N . ASN F 1 636 ? 2.121 -41.787 -5.619 1.00 53.58 ? 636 ASN F N 1 +ATOM 33628 C CA . ASN F 1 636 ? 1.208 -41.060 -6.498 1.00 55.10 ? 636 ASN F CA 1 +ATOM 33629 C C . ASN F 1 636 ? -0.217 -41.584 -6.507 1.00 56.89 ? 636 ASN F C 1 +ATOM 33630 O O . ASN F 1 636 ? -0.977 -41.331 -7.440 1.00 56.99 ? 636 ASN F O 1 +ATOM 33631 C CB . ASN F 1 636 ? 1.759 -41.060 -7.917 1.00 54.33 ? 636 ASN F CB 1 +ATOM 33632 C CG . ASN F 1 636 ? 3.023 -40.258 -8.035 1.00 55.17 ? 636 ASN F CG 1 +ATOM 33633 O OD1 . ASN F 1 636 ? 3.926 -40.616 -8.784 1.00 57.60 ? 636 ASN F OD1 1 +ATOM 33634 N ND2 . ASN F 1 636 ? 3.097 -39.155 -7.300 1.00 54.63 ? 636 ASN F ND2 1 +ATOM 33635 N N . GLU F 1 637 ? -0.576 -42.314 -5.465 1.00 59.87 ? 637 GLU F N 1 +ATOM 33636 C CA . GLU F 1 637 ? -1.912 -42.865 -5.335 1.00 62.86 ? 637 GLU F CA 1 +ATOM 33637 C C . GLU F 1 637 ? -2.512 -42.356 -4.020 1.00 61.27 ? 637 GLU F C 1 +ATOM 33638 O O . GLU F 1 637 ? -1.810 -42.233 -3.021 1.00 60.55 ? 637 GLU F O 1 +ATOM 33639 C CB . GLU F 1 637 ? -1.826 -44.395 -5.348 1.00 66.61 ? 637 GLU F CB 1 +ATOM 33640 C CG . GLU F 1 637 ? -3.131 -45.137 -5.142 1.00 73.52 ? 637 GLU F CG 1 +ATOM 33641 C CD . GLU F 1 637 ? -2.952 -46.656 -5.222 1.00 78.38 ? 637 GLU F CD 1 +ATOM 33642 O OE1 . GLU F 1 637 ? -2.084 -47.198 -4.497 1.00 79.75 ? 637 GLU F OE1 1 +ATOM 33643 O OE2 . GLU F 1 637 ? -3.679 -47.311 -6.006 1.00 80.91 ? 637 GLU F OE2 1 +ATOM 33644 N N . ILE F 1 638 ? -3.799 -42.034 -4.036 1.00 59.34 ? 638 ILE F N 1 +ATOM 33645 C CA . ILE F 1 638 ? -4.489 -41.565 -2.844 1.00 57.95 ? 638 ILE F CA 1 +ATOM 33646 C C . ILE F 1 638 ? -5.598 -42.568 -2.554 1.00 58.15 ? 638 ILE F C 1 +ATOM 33647 O O . ILE F 1 638 ? -6.589 -42.623 -3.280 1.00 57.46 ? 638 ILE F O 1 +ATOM 33648 C CB . ILE F 1 638 ? -5.127 -40.176 -3.061 1.00 56.82 ? 638 ILE F CB 1 +ATOM 33649 C CG1 . ILE F 1 638 ? -4.049 -39.161 -3.442 1.00 54.95 ? 638 ILE F CG1 1 +ATOM 33650 C CG2 . ILE F 1 638 ? -5.852 -39.733 -1.801 1.00 54.72 ? 638 ILE F CG2 1 +ATOM 33651 C CD1 . ILE F 1 638 ? -4.591 -37.802 -3.807 1.00 53.31 ? 638 ILE F CD1 1 +ATOM 33652 N N . LYS F 1 639 ? -5.427 -43.360 -1.500 1.00 57.78 ? 639 LYS F N 1 +ATOM 33653 C CA . LYS F 1 639 ? -6.414 -44.368 -1.132 1.00 57.73 ? 639 LYS F CA 1 +ATOM 33654 C C . LYS F 1 639 ? -7.404 -43.852 -0.092 1.00 56.36 ? 639 LYS F C 1 +ATOM 33655 O O . LYS F 1 639 ? -7.067 -43.012 0.737 1.00 55.04 ? 639 LYS F O 1 +ATOM 33656 C CB . LYS F 1 639 ? -5.710 -45.613 -0.582 1.00 61.09 ? 639 LYS F CB 1 +ATOM 33657 C CG . LYS F 1 639 ? -4.730 -46.282 -1.537 1.00 64.36 ? 639 LYS F CG 1 +ATOM 33658 C CD . LYS F 1 639 ? -3.956 -47.394 -0.826 1.00 67.28 ? 639 LYS F CD 1 +ATOM 33659 C CE . LYS F 1 639 ? -3.014 -48.147 -1.763 1.00 68.59 ? 639 LYS F CE 1 +ATOM 33660 N NZ . LYS F 1 639 ? -3.729 -48.907 -2.844 1.00 69.86 ? 639 LYS F NZ 1 +ATOM 33661 N N . PHE F 1 640 ? -8.627 -44.369 -0.145 1.00 55.82 ? 640 PHE F N 1 +ATOM 33662 C CA . PHE F 1 640 ? -9.684 -43.994 0.794 1.00 55.80 ? 640 PHE F CA 1 +ATOM 33663 C C . PHE F 1 640 ? -10.237 -45.242 1.476 1.00 54.76 ? 640 PHE F C 1 +ATOM 33664 O O . PHE F 1 640 ? -10.599 -46.201 0.806 1.00 55.05 ? 640 PHE F O 1 +ATOM 33665 C CB . PHE F 1 640 ? -10.820 -43.265 0.070 1.00 56.49 ? 640 PHE F CB 1 +ATOM 33666 C CG . PHE F 1 640 ? -10.405 -41.964 -0.559 1.00 58.85 ? 640 PHE F CG 1 +ATOM 33667 C CD1 . PHE F 1 640 ? -9.609 -41.944 -1.701 1.00 59.38 ? 640 PHE F CD1 1 +ATOM 33668 C CD2 . PHE F 1 640 ? -10.796 -40.752 -0.002 1.00 58.85 ? 640 PHE F CD2 1 +ATOM 33669 C CE1 . PHE F 1 640 ? -9.211 -40.736 -2.272 1.00 59.21 ? 640 PHE F CE1 1 +ATOM 33670 C CE2 . PHE F 1 640 ? -10.399 -39.541 -0.571 1.00 57.94 ? 640 PHE F CE2 1 +ATOM 33671 C CZ . PHE F 1 640 ? -9.609 -39.535 -1.702 1.00 57.38 ? 640 PHE F CZ 1 +ATOM 33672 N N . SER F 1 641 ? -10.313 -45.220 2.807 1.00 54.55 ? 641 SER F N 1 +ATOM 33673 C CA . SER F 1 641 ? -10.804 -46.366 3.571 1.00 53.86 ? 641 SER F CA 1 +ATOM 33674 C C . SER F 1 641 ? -12.251 -46.698 3.246 1.00 53.87 ? 641 SER F C 1 +ATOM 33675 O O . SER F 1 641 ? -12.703 -47.813 3.485 1.00 53.97 ? 641 SER F O 1 +ATOM 33676 C CB . SER F 1 641 ? -10.649 -46.129 5.082 1.00 52.45 ? 641 SER F CB 1 +ATOM 33677 O OG . SER F 1 641 ? -11.526 -45.126 5.554 1.00 52.52 ? 641 SER F OG 1 +ATOM 33678 N N . ARG F 1 642 ? -12.980 -45.730 2.707 1.00 53.90 ? 642 ARG F N 1 +ATOM 33679 C CA . ARG F 1 642 ? -14.365 -45.959 2.328 1.00 54.20 ? 642 ARG F CA 1 +ATOM 33680 C C . ARG F 1 642 ? -14.809 -44.901 1.342 1.00 53.99 ? 642 ARG F C 1 +ATOM 33681 O O . ARG F 1 642 ? -14.152 -43.881 1.179 1.00 53.36 ? 642 ARG F O 1 +ATOM 33682 C CB . ARG F 1 642 ? -15.276 -45.957 3.552 1.00 55.18 ? 642 ARG F CB 1 +ATOM 33683 C CG . ARG F 1 642 ? -15.377 -44.638 4.286 1.00 58.05 ? 642 ARG F CG 1 +ATOM 33684 C CD . ARG F 1 642 ? -16.179 -44.819 5.571 1.00 61.75 ? 642 ARG F CD 1 +ATOM 33685 N NE . ARG F 1 642 ? -16.351 -43.572 6.315 1.00 64.92 ? 642 ARG F NE 1 +ATOM 33686 C CZ . ARG F 1 642 ? -17.049 -42.528 5.873 1.00 66.48 ? 642 ARG F CZ 1 +ATOM 33687 N NH1 . ARG F 1 642 ? -17.646 -42.577 4.689 1.00 67.48 ? 642 ARG F NH1 1 +ATOM 33688 N NH2 . ARG F 1 642 ? -17.147 -41.431 6.611 1.00 67.42 ? 642 ARG F NH2 1 +ATOM 33689 N N . GLU F 1 643 ? -15.929 -45.155 0.680 1.00 54.81 ? 643 GLU F N 1 +ATOM 33690 C CA . GLU F 1 643 ? -16.458 -44.233 -0.312 1.00 55.19 ? 643 GLU F CA 1 +ATOM 33691 C C . GLU F 1 643 ? -16.827 -42.876 0.273 1.00 53.40 ? 643 GLU F C 1 +ATOM 33692 O O . GLU F 1 643 ? -17.612 -42.793 1.219 1.00 52.77 ? 643 GLU F O 1 +ATOM 33693 C CB . GLU F 1 643 ? -17.680 -44.851 -0.979 1.00 58.02 ? 643 GLU F CB 1 +ATOM 33694 C CG . GLU F 1 643 ? -18.336 -43.957 -2.010 1.00 64.84 ? 643 GLU F CG 1 +ATOM 33695 C CD . GLU F 1 643 ? -19.599 -44.571 -2.580 1.00 68.73 ? 643 GLU F CD 1 +ATOM 33696 O OE1 . GLU F 1 643 ? -19.502 -45.639 -3.228 1.00 70.68 ? 643 GLU F OE1 1 +ATOM 33697 O OE2 . GLU F 1 643 ? -20.689 -43.990 -2.374 1.00 71.58 ? 643 GLU F OE2 1 +ATOM 33698 N N . ILE F 1 644 ? -16.253 -41.816 -0.290 1.00 51.57 ? 644 ILE F N 1 +ATOM 33699 C CA . ILE F 1 644 ? -16.536 -40.462 0.173 1.00 50.85 ? 644 ILE F CA 1 +ATOM 33700 C C . ILE F 1 644 ? -16.614 -39.483 -0.987 1.00 49.08 ? 644 ILE F C 1 +ATOM 33701 O O . ILE F 1 644 ? -15.972 -39.670 -2.015 1.00 47.06 ? 644 ILE F O 1 +ATOM 33702 C CB . ILE F 1 644 ? -15.455 -39.925 1.158 1.00 51.46 ? 644 ILE F CB 1 +ATOM 33703 C CG1 . ILE F 1 644 ? -14.130 -39.715 0.422 1.00 51.89 ? 644 ILE F CG1 1 +ATOM 33704 C CG2 . ILE F 1 644 ? -15.281 -40.885 2.326 1.00 50.83 ? 644 ILE F CG2 1 +ATOM 33705 C CD1 . ILE F 1 644 ? -13.146 -38.882 1.194 1.00 52.49 ? 644 ILE F CD1 1 +ATOM 33706 N N . TYR F 1 645 ? -17.407 -38.433 -0.807 1.00 48.76 ? 645 TYR F N 1 +ATOM 33707 C CA . TYR F 1 645 ? -17.549 -37.404 -1.823 1.00 47.25 ? 645 TYR F CA 1 +ATOM 33708 C C . TYR F 1 645 ? -16.331 -36.485 -1.764 1.00 45.94 ? 645 TYR F C 1 +ATOM 33709 O O . TYR F 1 645 ? -15.798 -36.209 -0.688 1.00 45.05 ? 645 TYR F O 1 +ATOM 33710 C CB . TYR F 1 645 ? -18.809 -36.579 -1.574 1.00 47.30 ? 645 TYR F CB 1 +ATOM 33711 C CG . TYR F 1 645 ? -19.103 -35.579 -2.666 1.00 48.89 ? 645 TYR F CG 1 +ATOM 33712 C CD1 . TYR F 1 645 ? -19.767 -35.964 -3.833 1.00 48.67 ? 645 TYR F CD1 1 +ATOM 33713 C CD2 . TYR F 1 645 ? -18.712 -34.244 -2.541 1.00 48.85 ? 645 TYR F CD2 1 +ATOM 33714 C CE1 . TYR F 1 645 ? -20.037 -35.046 -4.846 1.00 48.10 ? 645 TYR F CE1 1 +ATOM 33715 C CE2 . TYR F 1 645 ? -18.979 -33.320 -3.551 1.00 49.67 ? 645 TYR F CE2 1 +ATOM 33716 C CZ . TYR F 1 645 ? -19.641 -33.730 -4.699 1.00 48.78 ? 645 TYR F CZ 1 +ATOM 33717 O OH . TYR F 1 645 ? -19.900 -32.827 -5.702 1.00 50.71 ? 645 TYR F OH 1 +ATOM 33718 N N . VAL F 1 646 ? -15.888 -36.028 -2.927 1.00 44.31 ? 646 VAL F N 1 +ATOM 33719 C CA . VAL F 1 646 ? -14.759 -35.122 -3.012 1.00 43.07 ? 646 VAL F CA 1 +ATOM 33720 C C . VAL F 1 646 ? -15.124 -34.055 -4.019 1.00 43.62 ? 646 VAL F C 1 +ATOM 33721 O O . VAL F 1 646 ? -15.485 -34.365 -5.150 1.00 43.69 ? 646 VAL F O 1 +ATOM 33722 C CB . VAL F 1 646 ? -13.487 -35.840 -3.488 1.00 43.03 ? 646 VAL F CB 1 +ATOM 33723 C CG1 . VAL F 1 646 ? -12.366 -34.831 -3.698 1.00 39.50 ? 646 VAL F CG1 1 +ATOM 33724 C CG2 . VAL F 1 646 ? -13.082 -36.901 -2.474 1.00 40.42 ? 646 VAL F CG2 1 +ATOM 33725 N N . SER F 1 647 ? -15.053 -32.796 -3.609 1.00 43.49 ? 647 SER F N 1 +ATOM 33726 C CA . SER F 1 647 ? -15.383 -31.720 -4.521 1.00 43.47 ? 647 SER F CA 1 +ATOM 33727 C C . SER F 1 647 ? -14.133 -31.310 -5.263 1.00 43.36 ? 647 SER F C 1 +ATOM 33728 O O . SER F 1 647 ? -13.845 -31.833 -6.330 1.00 43.48 ? 647 SER F O 1 +ATOM 33729 C CB . SER F 1 647 ? -15.975 -30.530 -3.762 1.00 43.29 ? 647 SER F CB 1 +ATOM 33730 O OG . SER F 1 647 ? -15.081 -30.056 -2.778 1.00 43.70 ? 647 SER F OG 1 +ATOM 33731 N N . LYS F 1 648 ? -13.375 -30.390 -4.683 1.00 44.79 ? 648 LYS F N 1 +ATOM 33732 C CA . LYS F 1 648 ? -12.151 -29.893 -5.300 1.00 44.86 ? 648 LYS F CA 1 +ATOM 33733 C C . LYS F 1 648 ? -10.938 -30.562 -4.663 1.00 44.00 ? 648 LYS F C 1 +ATOM 33734 O O . LYS F 1 648 ? -10.852 -30.671 -3.446 1.00 43.12 ? 648 LYS F O 1 +ATOM 33735 C CB . LYS F 1 648 ? -12.107 -28.371 -5.125 1.00 46.41 ? 648 LYS F CB 1 +ATOM 33736 C CG . LYS F 1 648 ? -10.920 -27.625 -5.704 1.00 50.04 ? 648 LYS F CG 1 +ATOM 33737 C CD . LYS F 1 648 ? -11.212 -26.119 -5.619 1.00 54.62 ? 648 LYS F CD 1 +ATOM 33738 C CE . LYS F 1 648 ? -9.990 -25.248 -5.890 1.00 58.23 ? 648 LYS F CE 1 +ATOM 33739 N NZ . LYS F 1 648 ? -8.994 -25.296 -4.779 1.00 59.55 ? 648 LYS F NZ 1 +ATOM 33740 N N . LEU F 1 649 ? -10.019 -31.040 -5.494 1.00 42.83 ? 649 LEU F N 1 +ATOM 33741 C CA . LEU F 1 649 ? -8.806 -31.678 -5.002 1.00 42.06 ? 649 LEU F CA 1 +ATOM 33742 C C . LEU F 1 649 ? -7.600 -30.854 -5.417 1.00 41.87 ? 649 LEU F C 1 +ATOM 33743 O O . LEU F 1 649 ? -7.433 -30.543 -6.591 1.00 40.91 ? 649 LEU F O 1 +ATOM 33744 C CB . LEU F 1 649 ? -8.658 -33.092 -5.575 1.00 42.33 ? 649 LEU F CB 1 +ATOM 33745 C CG . LEU F 1 649 ? -7.299 -33.764 -5.337 1.00 40.81 ? 649 LEU F CG 1 +ATOM 33746 C CD1 . LEU F 1 649 ? -7.085 -33.989 -3.855 1.00 40.81 ? 649 LEU F CD1 1 +ATOM 33747 C CD2 . LEU F 1 649 ? -7.231 -35.073 -6.087 1.00 41.21 ? 649 LEU F CD2 1 +ATOM 33748 N N . THR F 1 650 ? -6.762 -30.495 -4.453 1.00 42.07 ? 650 THR F N 1 +ATOM 33749 C CA . THR F 1 650 ? -5.570 -29.716 -4.758 1.00 42.51 ? 650 THR F CA 1 +ATOM 33750 C C . THR F 1 650 ? -4.341 -30.546 -4.452 1.00 43.15 ? 650 THR F C 1 +ATOM 33751 O O . THR F 1 650 ? -4.183 -31.072 -3.349 1.00 43.42 ? 650 THR F O 1 +ATOM 33752 C CB . THR F 1 650 ? -5.504 -28.412 -3.939 1.00 42.32 ? 650 THR F CB 1 +ATOM 33753 O OG1 . THR F 1 650 ? -6.672 -27.628 -4.198 1.00 42.90 ? 650 THR F OG1 1 +ATOM 33754 C CG2 . THR F 1 650 ? -4.264 -27.605 -4.321 1.00 40.85 ? 650 THR F CG2 1 +ATOM 33755 N N . ILE F 1 651 ? -3.473 -30.667 -5.442 1.00 43.60 ? 651 ILE F N 1 +ATOM 33756 C CA . ILE F 1 651 ? -2.263 -31.437 -5.286 1.00 45.80 ? 651 ILE F CA 1 +ATOM 33757 C C . ILE F 1 651 ? -1.071 -30.523 -5.448 1.00 46.11 ? 651 ILE F C 1 +ATOM 33758 O O . ILE F 1 651 ? -0.937 -29.849 -6.465 1.00 46.29 ? 651 ILE F O 1 +ATOM 33759 C CB . ILE F 1 651 ? -2.196 -32.564 -6.343 1.00 46.82 ? 651 ILE F CB 1 +ATOM 33760 C CG1 . ILE F 1 651 ? -3.353 -33.534 -6.123 1.00 48.30 ? 651 ILE F CG1 1 +ATOM 33761 C CG2 . ILE F 1 651 ? -0.873 -33.305 -6.254 1.00 46.14 ? 651 ILE F CG2 1 +ATOM 33762 C CD1 . ILE F 1 651 ? -3.472 -34.592 -7.188 1.00 52.16 ? 651 ILE F CD1 1 +ATOM 33763 N N . THR F 1 652 ? -0.217 -30.468 -4.438 1.00 46.34 ? 652 THR F N 1 +ATOM 33764 C CA . THR F 1 652 ? 0.962 -29.636 -4.569 1.00 48.31 ? 652 THR F CA 1 +ATOM 33765 C C . THR F 1 652 ? 2.068 -30.619 -4.937 1.00 47.73 ? 652 THR F C 1 +ATOM 33766 O O . THR F 1 652 ? 2.180 -31.685 -4.342 1.00 46.24 ? 652 THR F O 1 +ATOM 33767 C CB . THR F 1 652 ? 1.287 -28.851 -3.253 1.00 47.73 ? 652 THR F CB 1 +ATOM 33768 O OG1 . THR F 1 652 ? 2.062 -29.659 -2.378 1.00 50.43 ? 652 THR F OG1 1 +ATOM 33769 C CG2 . THR F 1 652 ? 0.012 -28.454 -2.535 1.00 47.58 ? 652 THR F CG2 1 +ATOM 33770 N N . SER F 1 653 ? 2.859 -30.274 -5.945 1.00 49.39 ? 653 SER F N 1 +ATOM 33771 C CA . SER F 1 653 ? 3.924 -31.152 -6.401 1.00 50.97 ? 653 SER F CA 1 +ATOM 33772 C C . SER F 1 653 ? 4.976 -30.398 -7.201 1.00 51.80 ? 653 SER F C 1 +ATOM 33773 O O . SER F 1 653 ? 4.653 -29.489 -7.958 1.00 50.30 ? 653 SER F O 1 +ATOM 33774 C CB . SER F 1 653 ? 3.320 -32.266 -7.261 1.00 51.05 ? 653 SER F CB 1 +ATOM 33775 O OG . SER F 1 653 ? 4.312 -33.137 -7.757 1.00 51.14 ? 653 SER F OG 1 +ATOM 33776 N N . GLU F 1 654 ? 6.237 -30.776 -7.023 1.00 54.78 ? 654 GLU F N 1 +ATOM 33777 C CA . GLU F 1 654 ? 7.328 -30.143 -7.751 1.00 56.99 ? 654 GLU F CA 1 +ATOM 33778 C C . GLU F 1 654 ? 7.350 -30.714 -9.164 1.00 58.18 ? 654 GLU F C 1 +ATOM 33779 O O . GLU F 1 654 ? 7.788 -30.055 -10.098 1.00 58.68 ? 654 GLU F O 1 +ATOM 33780 C CB . GLU F 1 654 ? 8.660 -30.396 -7.046 1.00 57.31 ? 654 GLU F CB 1 +ATOM 33781 C CG . GLU F 1 654 ? 8.725 -29.788 -5.655 1.00 61.06 ? 654 GLU F CG 1 +ATOM 33782 C CD . GLU F 1 654 ? 10.081 -29.953 -4.988 1.00 62.05 ? 654 GLU F CD 1 +ATOM 33783 O OE1 . GLU F 1 654 ? 11.069 -29.374 -5.482 1.00 63.58 ? 654 GLU F OE1 1 +ATOM 33784 O OE2 . GLU F 1 654 ? 10.159 -30.662 -3.965 1.00 63.07 ? 654 GLU F OE2 1 +ATOM 33785 N N . LYS F 1 655 ? 6.870 -31.943 -9.312 1.00 59.53 ? 655 LYS F N 1 +ATOM 33786 C CA . LYS F 1 655 ? 6.801 -32.587 -10.615 1.00 61.52 ? 655 LYS F CA 1 +ATOM 33787 C C . LYS F 1 655 ? 5.403 -32.324 -11.158 1.00 61.59 ? 655 LYS F C 1 +ATOM 33788 O O . LYS F 1 655 ? 4.422 -32.402 -10.425 1.00 62.09 ? 655 LYS F O 1 +ATOM 33789 C CB . LYS F 1 655 ? 7.060 -34.092 -10.483 1.00 63.41 ? 655 LYS F CB 1 +ATOM 33790 C CG . LYS F 1 655 ? 8.466 -34.406 -9.984 1.00 66.62 ? 655 LYS F CG 1 +ATOM 33791 C CD . LYS F 1 655 ? 8.755 -35.895 -9.932 1.00 68.75 ? 655 LYS F CD 1 +ATOM 33792 C CE . LYS F 1 655 ? 10.188 -36.147 -9.477 1.00 69.85 ? 655 LYS F CE 1 +ATOM 33793 N NZ . LYS F 1 655 ? 10.527 -37.601 -9.453 1.00 72.03 ? 655 LYS F NZ 1 +ATOM 33794 N N . PRO F 1 656 ? 5.291 -32.000 -12.451 1.00 61.70 ? 656 PRO F N 1 +ATOM 33795 C CA . PRO F 1 656 ? 3.984 -31.723 -13.058 1.00 61.87 ? 656 PRO F CA 1 +ATOM 33796 C C . PRO F 1 656 ? 2.971 -32.870 -12.999 1.00 60.83 ? 656 PRO F C 1 +ATOM 33797 O O . PRO F 1 656 ? 3.336 -34.040 -13.023 1.00 59.50 ? 656 PRO F O 1 +ATOM 33798 C CB . PRO F 1 656 ? 4.351 -31.328 -14.489 1.00 61.76 ? 656 PRO F CB 1 +ATOM 33799 C CG . PRO F 1 656 ? 5.582 -32.143 -14.750 1.00 61.66 ? 656 PRO F CG 1 +ATOM 33800 C CD . PRO F 1 656 ? 6.358 -31.969 -13.467 1.00 62.17 ? 656 PRO F CD 1 +ATOM 33801 N N . VAL F 1 657 ? 1.697 -32.508 -12.908 1.00 60.71 ? 657 VAL F N 1 +ATOM 33802 C CA . VAL F 1 657 ? 0.606 -33.470 -12.852 1.00 61.22 ? 657 VAL F CA 1 +ATOM 33803 C C . VAL F 1 657 ? -0.345 -33.115 -13.982 1.00 61.61 ? 657 VAL F C 1 +ATOM 33804 O O . VAL F 1 657 ? -1.005 -32.081 -13.948 1.00 62.18 ? 657 VAL F O 1 +ATOM 33805 C CB . VAL F 1 657 ? -0.159 -33.382 -11.513 1.00 61.19 ? 657 VAL F CB 1 +ATOM 33806 C CG1 . VAL F 1 657 ? -1.251 -34.441 -11.462 1.00 60.50 ? 657 VAL F CG1 1 +ATOM 33807 C CG2 . VAL F 1 657 ? 0.801 -33.556 -10.355 1.00 60.36 ? 657 VAL F CG2 1 +ATOM 33808 N N . SER F 1 658 ? -0.416 -33.974 -14.987 1.00 62.45 ? 658 SER F N 1 +ATOM 33809 C CA . SER F 1 658 ? -1.276 -33.722 -16.133 1.00 63.19 ? 658 SER F CA 1 +ATOM 33810 C C . SER F 1 658 ? -2.710 -34.203 -15.950 1.00 63.14 ? 658 SER F C 1 +ATOM 33811 O O . SER F 1 658 ? -3.642 -33.597 -16.476 1.00 63.41 ? 658 SER F O 1 +ATOM 33812 C CB . SER F 1 658 ? -0.671 -34.370 -17.379 1.00 63.74 ? 658 SER F CB 1 +ATOM 33813 O OG . SER F 1 658 ? -0.421 -35.752 -17.171 1.00 65.24 ? 658 SER F OG 1 +ATOM 33814 N N . LYS F 1 659 ? -2.889 -35.285 -15.201 1.00 63.28 ? 659 LYS F N 1 +ATOM 33815 C CA . LYS F 1 659 ? -4.222 -35.828 -14.988 1.00 63.01 ? 659 LYS F CA 1 +ATOM 33816 C C . LYS F 1 659 ? -4.299 -36.747 -13.777 1.00 62.42 ? 659 LYS F C 1 +ATOM 33817 O O . LYS F 1 659 ? -3.285 -37.227 -13.270 1.00 61.95 ? 659 LYS F O 1 +ATOM 33818 C CB . LYS F 1 659 ? -4.655 -36.617 -16.224 1.00 64.16 ? 659 LYS F CB 1 +ATOM 33819 C CG . LYS F 1 659 ? -3.768 -37.832 -16.496 1.00 65.64 ? 659 LYS F CG 1 +ATOM 33820 C CD . LYS F 1 659 ? -4.226 -38.648 -17.697 1.00 68.90 ? 659 LYS F CD 1 +ATOM 33821 C CE . LYS F 1 659 ? -4.018 -37.910 -19.024 1.00 71.32 ? 659 LYS F CE 1 +ATOM 33822 N NZ . LYS F 1 659 ? -4.913 -36.719 -19.198 1.00 73.05 ? 659 LYS F NZ 1 +ATOM 33823 N N . ILE F 1 660 ? -5.520 -36.978 -13.317 1.00 61.52 ? 660 ILE F N 1 +ATOM 33824 C CA . ILE F 1 660 ? -5.763 -37.885 -12.208 1.00 61.59 ? 660 ILE F CA 1 +ATOM 33825 C C . ILE F 1 660 ? -6.785 -38.898 -12.713 1.00 60.72 ? 660 ILE F C 1 +ATOM 33826 O O . ILE F 1 660 ? -7.546 -38.612 -13.641 1.00 59.72 ? 660 ILE F O 1 +ATOM 33827 C CB . ILE F 1 660 ? -6.343 -37.167 -10.968 1.00 61.77 ? 660 ILE F CB 1 +ATOM 33828 C CG1 . ILE F 1 660 ? -7.693 -36.543 -11.309 1.00 62.01 ? 660 ILE F CG1 1 +ATOM 33829 C CG2 . ILE F 1 660 ? -5.368 -36.126 -10.471 1.00 61.05 ? 660 ILE F CG2 1 +ATOM 33830 C CD1 . ILE F 1 660 ? -8.438 -36.044 -10.109 1.00 63.13 ? 660 ILE F CD1 1 +ATOM 33831 N N . ILE F 1 661 ? -6.796 -40.078 -12.109 1.00 60.23 ? 661 ILE F N 1 +ATOM 33832 C CA . ILE F 1 661 ? -7.723 -41.119 -12.512 1.00 60.52 ? 661 ILE F CA 1 +ATOM 33833 C C . ILE F 1 661 ? -8.496 -41.618 -11.309 1.00 60.23 ? 661 ILE F C 1 +ATOM 33834 O O . ILE F 1 661 ? -7.910 -42.099 -10.348 1.00 59.42 ? 661 ILE F O 1 +ATOM 33835 C CB . ILE F 1 661 ? -6.976 -42.290 -13.161 1.00 60.71 ? 661 ILE F CB 1 +ATOM 33836 C CG1 . ILE F 1 661 ? -6.186 -41.772 -14.363 1.00 60.60 ? 661 ILE F CG1 1 +ATOM 33837 C CG2 . ILE F 1 661 ? -7.962 -43.369 -13.583 1.00 60.58 ? 661 ILE F CG2 1 +ATOM 33838 C CD1 . ILE F 1 661 ? -5.193 -42.747 -14.898 1.00 63.83 ? 661 ILE F CD1 1 +ATOM 33839 N N . VAL F 1 662 ? -9.816 -41.489 -11.370 1.00 60.44 ? 662 VAL F N 1 +ATOM 33840 C CA . VAL F 1 662 ? -10.683 -41.921 -10.288 1.00 60.75 ? 662 VAL F CA 1 +ATOM 33841 C C . VAL F 1 662 ? -11.072 -43.391 -10.431 1.00 60.90 ? 662 VAL F C 1 +ATOM 33842 O O . VAL F 1 662 ? -11.726 -43.785 -11.394 1.00 60.30 ? 662 VAL F O 1 +ATOM 33843 C CB . VAL F 1 662 ? -11.959 -41.052 -10.231 1.00 60.61 ? 662 VAL F CB 1 +ATOM 33844 C CG1 . VAL F 1 662 ? -12.895 -41.553 -9.141 1.00 60.28 ? 662 VAL F CG1 1 +ATOM 33845 C CG2 . VAL F 1 662 ? -11.576 -39.606 -9.987 1.00 61.08 ? 662 VAL F CG2 1 +ATOM 33846 N N . ASP F 1 663 ? -10.647 -44.195 -9.460 1.00 61.42 ? 663 ASP F N 1 +ATOM 33847 C CA . ASP F 1 663 ? -10.936 -45.627 -9.416 1.00 61.18 ? 663 ASP F CA 1 +ATOM 33848 C C . ASP F 1 663 ? -10.527 -46.393 -10.680 1.00 59.20 ? 663 ASP F C 1 +ATOM 33849 O O . ASP F 1 663 ? -11.254 -47.268 -11.157 1.00 58.85 ? 663 ASP F O 1 +ATOM 33850 C CB . ASP F 1 663 ? -12.424 -45.846 -9.092 1.00 63.60 ? 663 ASP F CB 1 +ATOM 33851 C CG . ASP F 1 663 ? -12.823 -45.263 -7.729 1.00 65.32 ? 663 ASP F CG 1 +ATOM 33852 O OD1 . ASP F 1 663 ? -12.200 -45.623 -6.708 1.00 65.28 ? 663 ASP F OD1 1 +ATOM 33853 O OD2 . ASP F 1 663 ? -13.763 -44.441 -7.674 1.00 66.07 ? 663 ASP F OD2 1 +ATOM 33854 N N . ASP F 1 664 ? -9.338 -46.050 -11.181 1.00 54.37 ? 664 ASP F N 1 +ATOM 33855 C CA . ASP F 1 664 ? -8.712 -46.641 -12.366 1.00 51.99 ? 664 ASP F CA 1 +ATOM 33856 C C . ASP F 1 664 ? -9.459 -46.559 -13.686 1.00 50.05 ? 664 ASP F C 1 +ATOM 33857 O O . ASP F 1 664 ? -8.919 -46.925 -14.728 1.00 49.26 ? 664 ASP F O 1 +ATOM 33858 C CB . ASP F 1 664 ? -8.399 -48.113 -12.122 1.00 53.31 ? 664 ASP F CB 1 +ATOM 33859 C CG . ASP F 1 664 ? -7.302 -48.319 -11.104 1.00 55.88 ? 664 ASP F CG 1 +ATOM 33860 O OD1 . ASP F 1 664 ? -6.255 -47.637 -11.195 1.00 57.69 ? 664 ASP F OD1 1 +ATOM 33861 O OD2 . ASP F 1 664 ? -7.483 -49.182 -10.218 1.00 57.88 ? 664 ASP F OD2 1 +ATOM 33862 N N . SER F 1 665 ? -10.682 -46.053 -13.652 1.00 47.80 ? 665 SER F N 1 +ATOM 33863 C CA . SER F 1 665 ? -11.517 -46.015 -14.836 1.00 45.92 ? 665 SER F CA 1 +ATOM 33864 C C . SER F 1 665 ? -11.949 -44.665 -15.387 1.00 45.51 ? 665 SER F C 1 +ATOM 33865 O O . SER F 1 665 ? -12.527 -44.608 -16.474 1.00 44.83 ? 665 SER F O 1 +ATOM 33866 C CB . SER F 1 665 ? -12.766 -46.829 -14.541 1.00 46.71 ? 665 SER F CB 1 +ATOM 33867 O OG . SER F 1 665 ? -13.384 -46.334 -13.360 1.00 46.03 ? 665 SER F OG 1 +ATOM 33868 N N . LYS F 1 666 ? -11.690 -43.588 -14.653 1.00 44.94 ? 666 LYS F N 1 +ATOM 33869 C CA . LYS F 1 666 ? -12.109 -42.259 -15.096 1.00 45.10 ? 666 LYS F CA 1 +ATOM 33870 C C . LYS F 1 666 ? -10.988 -41.226 -15.002 1.00 45.18 ? 666 LYS F C 1 +ATOM 33871 O O . LYS F 1 666 ? -10.351 -41.052 -13.964 1.00 43.77 ? 666 LYS F O 1 +ATOM 33872 C CB . LYS F 1 666 ? -13.317 -41.805 -14.267 1.00 44.63 ? 666 LYS F CB 1 +ATOM 33873 C CG . LYS F 1 666 ? -14.163 -40.690 -14.873 1.00 45.75 ? 666 LYS F CG 1 +ATOM 33874 C CD . LYS F 1 666 ? -15.462 -40.542 -14.061 1.00 48.48 ? 666 LYS F CD 1 +ATOM 33875 C CE . LYS F 1 666 ? -16.475 -39.591 -14.693 1.00 50.07 ? 666 LYS F CE 1 +ATOM 33876 N NZ . LYS F 1 666 ? -16.013 -38.171 -14.729 1.00 50.64 ? 666 LYS F NZ 1 +ATOM 33877 N N . GLU F 1 667 ? -10.744 -40.543 -16.106 1.00 45.79 ? 667 GLU F N 1 +ATOM 33878 C CA . GLU F 1 667 ? -9.710 -39.528 -16.135 1.00 46.64 ? 667 GLU F CA 1 +ATOM 33879 C C . GLU F 1 667 ? -10.352 -38.172 -15.877 1.00 45.74 ? 667 GLU F C 1 +ATOM 33880 O O . GLU F 1 667 ? -11.395 -37.860 -16.438 1.00 45.09 ? 667 GLU F O 1 +ATOM 33881 C CB . GLU F 1 667 ? -9.021 -39.550 -17.493 1.00 48.29 ? 667 GLU F CB 1 +ATOM 33882 C CG . GLU F 1 667 ? -8.179 -38.335 -17.805 1.00 54.43 ? 667 GLU F CG 1 +ATOM 33883 C CD . GLU F 1 667 ? -7.501 -38.461 -19.155 1.00 57.18 ? 667 GLU F CD 1 +ATOM 33884 O OE1 . GLU F 1 667 ? -6.546 -39.265 -19.264 1.00 58.25 ? 667 GLU F OE1 1 +ATOM 33885 O OE2 . GLU F 1 667 ? -7.935 -37.774 -20.107 1.00 58.00 ? 667 GLU F OE2 1 +ATOM 33886 N N . ILE F 1 668 ? -9.750 -37.384 -14.998 1.00 45.39 ? 668 ILE F N 1 +ATOM 33887 C CA . ILE F 1 668 ? -10.283 -36.067 -14.709 1.00 46.08 ? 668 ILE F CA 1 +ATOM 33888 C C . ILE F 1 668 ? -9.196 -35.040 -14.917 1.00 47.15 ? 668 ILE F C 1 +ATOM 33889 O O . ILE F 1 668 ? -8.095 -35.171 -14.387 1.00 47.36 ? 668 ILE F O 1 +ATOM 33890 C CB . ILE F 1 668 ? -10.828 -35.980 -13.287 1.00 46.08 ? 668 ILE F CB 1 +ATOM 33891 C CG1 . ILE F 1 668 ? -11.998 -36.961 -13.143 1.00 44.62 ? 668 ILE F CG1 1 +ATOM 33892 C CG2 . ILE F 1 668 ? -11.297 -34.556 -12.997 1.00 46.02 ? 668 ILE F CG2 1 +ATOM 33893 C CD1 . ILE F 1 668 ? -12.747 -36.854 -11.842 1.00 43.74 ? 668 ILE F CD1 1 +ATOM 33894 N N . GLN F 1 669 ? -9.512 -34.024 -15.710 1.00 48.66 ? 669 GLN F N 1 +ATOM 33895 C CA . GLN F 1 669 ? -8.557 -32.975 -16.033 1.00 50.95 ? 669 GLN F CA 1 +ATOM 33896 C C . GLN F 1 669 ? -8.035 -32.183 -14.845 1.00 49.98 ? 669 GLN F C 1 +ATOM 33897 O O . GLN F 1 669 ? -8.767 -31.898 -13.897 1.00 48.10 ? 669 GLN F O 1 +ATOM 33898 C CB . GLN F 1 669 ? -9.152 -32.021 -17.072 1.00 54.87 ? 669 GLN F CB 1 +ATOM 33899 C CG . GLN F 1 669 ? -8.940 -32.496 -18.508 1.00 60.73 ? 669 GLN F CG 1 +ATOM 33900 C CD . GLN F 1 669 ? -7.513 -33.004 -18.744 1.00 64.23 ? 669 GLN F CD 1 +ATOM 33901 O OE1 . GLN F 1 669 ? -6.529 -32.330 -18.394 1.00 67.14 ? 669 GLN F OE1 1 +ATOM 33902 N NE2 . GLN F 1 669 ? -7.396 -34.193 -19.338 1.00 63.64 ? 669 GLN F NE2 1 +ATOM 33903 N N . VAL F 1 670 ? -6.752 -31.839 -14.916 1.00 48.96 ? 670 VAL F N 1 +ATOM 33904 C CA . VAL F 1 670 ? -6.091 -31.080 -13.868 1.00 49.01 ? 670 VAL F CA 1 +ATOM 33905 C C . VAL F 1 670 ? -5.548 -29.760 -14.397 1.00 49.21 ? 670 VAL F C 1 +ATOM 33906 O O . VAL F 1 670 ? -4.931 -29.708 -15.459 1.00 49.92 ? 670 VAL F O 1 +ATOM 33907 C CB . VAL F 1 670 ? -4.953 -31.906 -13.249 1.00 49.26 ? 670 VAL F CB 1 +ATOM 33908 C CG1 . VAL F 1 670 ? -4.051 -31.028 -12.414 1.00 47.65 ? 670 VAL F CG1 1 +ATOM 33909 C CG2 . VAL F 1 670 ? -5.552 -33.000 -12.383 1.00 50.08 ? 670 VAL F CG2 1 +ATOM 33910 N N . GLU F 1 671 ? -5.781 -28.694 -13.643 1.00 49.04 ? 671 GLU F N 1 +ATOM 33911 C CA . GLU F 1 671 ? -5.331 -27.363 -14.029 1.00 49.48 ? 671 GLU F CA 1 +ATOM 33912 C C . GLU F 1 671 ? -4.256 -26.810 -13.092 1.00 47.89 ? 671 GLU F C 1 +ATOM 33913 O O . GLU F 1 671 ? -4.411 -26.842 -11.875 1.00 47.86 ? 671 GLU F O 1 +ATOM 33914 C CB . GLU F 1 671 ? -6.528 -26.403 -14.043 1.00 52.09 ? 671 GLU F CB 1 +ATOM 33915 C CG . GLU F 1 671 ? -6.145 -24.919 -14.104 1.00 58.58 ? 671 GLU F CG 1 +ATOM 33916 C CD . GLU F 1 671 ? -7.325 -23.985 -13.836 1.00 62.00 ? 671 GLU F CD 1 +ATOM 33917 O OE1 . GLU F 1 671 ? -8.032 -24.198 -12.822 1.00 65.16 ? 671 GLU F OE1 1 +ATOM 33918 O OE2 . GLU F 1 671 ? -7.542 -23.036 -14.627 1.00 62.64 ? 671 GLU F OE2 1 +ATOM 33919 N N . LYS F 1 672 ? -3.167 -26.305 -13.658 1.00 46.20 ? 672 LYS F N 1 +ATOM 33920 C CA . LYS F 1 672 ? -2.114 -25.708 -12.848 1.00 46.56 ? 672 LYS F CA 1 +ATOM 33921 C C . LYS F 1 672 ? -2.568 -24.295 -12.496 1.00 46.58 ? 672 LYS F C 1 +ATOM 33922 O O . LYS F 1 672 ? -2.662 -23.440 -13.366 1.00 48.44 ? 672 LYS F O 1 +ATOM 33923 C CB . LYS F 1 672 ? -0.812 -25.653 -13.635 1.00 47.50 ? 672 LYS F CB 1 +ATOM 33924 C CG . LYS F 1 672 ? 0.277 -24.836 -12.989 1.00 48.16 ? 672 LYS F CG 1 +ATOM 33925 C CD . LYS F 1 672 ? 1.593 -25.104 -13.677 1.00 51.11 ? 672 LYS F CD 1 +ATOM 33926 C CE . LYS F 1 672 ? 2.688 -24.185 -13.164 1.00 53.93 ? 672 LYS F CE 1 +ATOM 33927 N NZ . LYS F 1 672 ? 4.030 -24.633 -13.651 1.00 56.36 ? 672 LYS F NZ 1 +ATOM 33928 N N . THR F 1 673 ? -2.859 -24.049 -11.226 1.00 45.94 ? 673 THR F N 1 +ATOM 33929 C CA . THR F 1 673 ? -3.325 -22.735 -10.809 1.00 45.00 ? 673 THR F CA 1 +ATOM 33930 C C . THR F 1 673 ? -2.190 -21.782 -10.458 1.00 43.98 ? 673 THR F C 1 +ATOM 33931 O O . THR F 1 673 ? -2.323 -20.568 -10.591 1.00 43.60 ? 673 THR F O 1 +ATOM 33932 C CB . THR F 1 673 ? -4.277 -22.847 -9.613 1.00 45.39 ? 673 THR F CB 1 +ATOM 33933 O OG1 . THR F 1 673 ? -3.631 -23.565 -8.556 1.00 46.13 ? 673 THR F OG1 1 +ATOM 33934 C CG2 . THR F 1 673 ? -5.559 -23.556 -10.018 1.00 44.18 ? 673 THR F CG2 1 +ATOM 33935 N N . MET F 1 674 ? -1.076 -22.334 -10.001 1.00 42.97 ? 674 MET F N 1 +ATOM 33936 C CA . MET F 1 674 ? 0.094 -21.535 -9.663 1.00 41.66 ? 674 MET F CA 1 +ATOM 33937 C C . MET F 1 674 ? 1.247 -22.495 -9.485 1.00 39.16 ? 674 MET F C 1 +ATOM 33938 O O . MET F 1 674 ? 1.044 -23.697 -9.544 1.00 38.05 ? 674 MET F O 1 +ATOM 33939 C CB . MET F 1 674 ? -0.142 -20.708 -8.394 1.00 42.80 ? 674 MET F CB 1 +ATOM 33940 C CG . MET F 1 674 ? -0.335 -21.499 -7.120 1.00 43.72 ? 674 MET F CG 1 +ATOM 33941 S SD . MET F 1 674 ? -0.679 -20.400 -5.718 1.00 45.96 ? 674 MET F SD 1 +ATOM 33942 C CE . MET F 1 674 ? -1.338 -21.584 -4.512 1.00 44.25 ? 674 MET F CE 1 +ATOM 33943 N N . GLN F 1 675 ? 2.451 -21.981 -9.275 1.00 37.52 ? 675 GLN F N 1 +ATOM 33944 C CA . GLN F 1 675 ? 3.604 -22.865 -9.134 1.00 38.83 ? 675 GLN F CA 1 +ATOM 33945 C C . GLN F 1 675 ? 3.346 -24.011 -8.158 1.00 39.08 ? 675 GLN F C 1 +ATOM 33946 O O . GLN F 1 675 ? 2.776 -23.811 -7.077 1.00 37.53 ? 675 GLN F O 1 +ATOM 33947 C CB . GLN F 1 675 ? 4.844 -22.083 -8.686 1.00 36.19 ? 675 GLN F CB 1 +ATOM 33948 C CG . GLN F 1 675 ? 4.771 -21.562 -7.277 1.00 37.15 ? 675 GLN F CG 1 +ATOM 33949 C CD . GLN F 1 675 ? 5.814 -20.506 -6.993 1.00 35.65 ? 675 GLN F CD 1 +ATOM 33950 O OE1 . GLN F 1 675 ? 6.978 -20.661 -7.354 1.00 37.78 ? 675 GLN F OE1 1 +ATOM 33951 N NE2 . GLN F 1 675 ? 5.406 -19.432 -6.339 1.00 32.26 ? 675 GLN F NE2 1 +ATOM 33952 N N . ASN F 1 676 ? 3.751 -25.212 -8.573 1.00 38.60 ? 676 ASN F N 1 +ATOM 33953 C CA . ASN F 1 676 ? 3.617 -26.423 -7.777 1.00 38.98 ? 676 ASN F CA 1 +ATOM 33954 C C . ASN F 1 676 ? 2.184 -26.763 -7.370 1.00 39.90 ? 676 ASN F C 1 +ATOM 33955 O O . ASN F 1 676 ? 1.969 -27.680 -6.586 1.00 39.84 ? 676 ASN F O 1 +ATOM 33956 C CB . ASN F 1 676 ? 4.479 -26.293 -6.515 1.00 38.92 ? 676 ASN F CB 1 +ATOM 33957 C CG . ASN F 1 676 ? 5.906 -25.871 -6.823 1.00 39.71 ? 676 ASN F CG 1 +ATOM 33958 O OD1 . ASN F 1 676 ? 6.617 -26.542 -7.567 1.00 39.84 ? 676 ASN F OD1 1 +ATOM 33959 N ND2 . ASN F 1 676 ? 6.332 -24.755 -6.246 1.00 39.41 ? 676 ASN F ND2 1 +ATOM 33960 N N . THR F 1 677 ? 1.203 -26.048 -7.908 1.00 40.90 ? 677 THR F N 1 +ATOM 33961 C CA . THR F 1 677 ? -0.189 -26.270 -7.518 1.00 41.60 ? 677 THR F CA 1 +ATOM 33962 C C . THR F 1 677 ? -1.107 -26.743 -8.647 1.00 42.16 ? 677 THR F C 1 +ATOM 33963 O O . THR F 1 677 ? -1.318 -26.043 -9.637 1.00 42.22 ? 677 THR F O 1 +ATOM 33964 C CB . THR F 1 677 ? -0.762 -24.974 -6.905 1.00 42.85 ? 677 THR F CB 1 +ATOM 33965 O OG1 . THR F 1 677 ? 0.210 -24.407 -6.013 1.00 41.27 ? 677 THR F OG1 1 +ATOM 33966 C CG2 . THR F 1 677 ? -2.065 -25.251 -6.148 1.00 39.71 ? 677 THR F CG2 1 +ATOM 33967 N N . TYR F 1 678 ? -1.674 -27.928 -8.474 1.00 42.36 ? 678 TYR F N 1 +ATOM 33968 C CA . TYR F 1 678 ? -2.551 -28.511 -9.477 1.00 42.45 ? 678 TYR F CA 1 +ATOM 33969 C C . TYR F 1 678 ? -3.927 -28.782 -8.901 1.00 41.98 ? 678 TYR F C 1 +ATOM 33970 O O . TYR F 1 678 ? -4.060 -29.355 -7.826 1.00 41.92 ? 678 TYR F O 1 +ATOM 33971 C CB . TYR F 1 678 ? -1.907 -29.787 -9.996 1.00 43.72 ? 678 TYR F CB 1 +ATOM 33972 C CG . TYR F 1 678 ? -0.544 -29.523 -10.585 1.00 45.93 ? 678 TYR F CG 1 +ATOM 33973 C CD1 . TYR F 1 678 ? -0.411 -28.972 -11.860 1.00 45.57 ? 678 TYR F CD1 1 +ATOM 33974 C CD2 . TYR F 1 678 ? 0.613 -29.769 -9.849 1.00 45.97 ? 678 TYR F CD2 1 +ATOM 33975 C CE1 . TYR F 1 678 ? 0.836 -28.672 -12.384 1.00 46.55 ? 678 TYR F CE1 1 +ATOM 33976 C CE2 . TYR F 1 678 ? 1.862 -29.474 -10.363 1.00 47.92 ? 678 TYR F CE2 1 +ATOM 33977 C CZ . TYR F 1 678 ? 1.968 -28.923 -11.630 1.00 48.04 ? 678 TYR F CZ 1 +ATOM 33978 O OH . TYR F 1 678 ? 3.211 -28.614 -12.128 1.00 50.16 ? 678 TYR F OH 1 +ATOM 33979 N N . VAL F 1 679 ? -4.954 -28.366 -9.628 1.00 42.49 ? 679 VAL F N 1 +ATOM 33980 C CA . VAL F 1 679 ? -6.325 -28.528 -9.174 1.00 43.39 ? 679 VAL F CA 1 +ATOM 33981 C C . VAL F 1 679 ? -7.192 -29.398 -10.068 1.00 44.44 ? 679 VAL F C 1 +ATOM 33982 O O . VAL F 1 679 ? -7.104 -29.341 -11.288 1.00 46.18 ? 679 VAL F O 1 +ATOM 33983 C CB . VAL F 1 679 ? -6.999 -27.163 -9.033 1.00 43.14 ? 679 VAL F CB 1 +ATOM 33984 C CG1 . VAL F 1 679 ? -8.438 -27.330 -8.575 1.00 44.67 ? 679 VAL F CG1 1 +ATOM 33985 C CG2 . VAL F 1 679 ? -6.226 -26.323 -8.049 1.00 42.64 ? 679 VAL F CG2 1 +ATOM 33986 N N . ALA F 1 680 ? -8.038 -30.203 -9.442 1.00 45.10 ? 680 ALA F N 1 +ATOM 33987 C CA . ALA F 1 680 ? -8.946 -31.076 -10.160 1.00 46.45 ? 680 ALA F CA 1 +ATOM 33988 C C . ALA F 1 680 ? -10.346 -30.936 -9.577 1.00 47.30 ? 680 ALA F C 1 +ATOM 33989 O O . ALA F 1 680 ? -10.565 -31.171 -8.391 1.00 46.26 ? 680 ALA F O 1 +ATOM 33990 C CB . ALA F 1 680 ? -8.477 -32.523 -10.057 1.00 46.80 ? 680 ALA F CB 1 +ATOM 33991 N N . LYS F 1 681 ? -11.293 -30.532 -10.411 1.00 49.37 ? 681 LYS F N 1 +ATOM 33992 C CA . LYS F 1 681 ? -12.673 -30.387 -9.967 1.00 52.27 ? 681 LYS F CA 1 +ATOM 33993 C C . LYS F 1 681 ? -13.317 -31.761 -10.123 1.00 51.94 ? 681 LYS F C 1 +ATOM 33994 O O . LYS F 1 681 ? -13.799 -32.104 -11.197 1.00 53.19 ? 681 LYS F O 1 +ATOM 33995 C CB . LYS F 1 681 ? -13.415 -29.375 -10.842 1.00 53.71 ? 681 LYS F CB 1 +ATOM 33996 C CG . LYS F 1 681 ? -12.729 -28.027 -11.001 1.00 57.68 ? 681 LYS F CG 1 +ATOM 33997 C CD . LYS F 1 681 ? -12.891 -27.128 -9.778 1.00 62.25 ? 681 LYS F CD 1 +ATOM 33998 C CE . LYS F 1 681 ? -12.477 -25.686 -10.098 1.00 63.60 ? 681 LYS F CE 1 +ATOM 33999 N NZ . LYS F 1 681 ? -12.727 -24.754 -8.956 1.00 66.84 ? 681 LYS F NZ 1 +ATOM 34000 N N . ILE F 1 682 ? -13.316 -32.549 -9.056 1.00 51.97 ? 682 ILE F N 1 +ATOM 34001 C CA . ILE F 1 682 ? -13.882 -33.891 -9.092 1.00 52.08 ? 682 ILE F CA 1 +ATOM 34002 C C . ILE F 1 682 ? -15.399 -33.921 -8.894 1.00 52.43 ? 682 ILE F C 1 +ATOM 34003 O O . ILE F 1 682 ? -16.124 -34.511 -9.683 1.00 53.13 ? 682 ILE F O 1 +ATOM 34004 C CB . ILE F 1 682 ? -13.202 -34.786 -8.037 1.00 51.07 ? 682 ILE F CB 1 +ATOM 34005 C CG1 . ILE F 1 682 ? -11.715 -34.926 -8.374 1.00 51.26 ? 682 ILE F CG1 1 +ATOM 34006 C CG2 . ILE F 1 682 ? -13.873 -36.145 -7.986 1.00 51.06 ? 682 ILE F CG2 1 +ATOM 34007 C CD1 . ILE F 1 682 ? -10.923 -35.731 -7.362 1.00 51.31 ? 682 ILE F CD1 1 +ATOM 34008 N N . ASN F 1 683 ? -15.874 -33.289 -7.835 1.00 53.15 ? 683 ASN F N 1 +ATOM 34009 C CA . ASN F 1 683 ? -17.299 -33.239 -7.553 1.00 54.96 ? 683 ASN F CA 1 +ATOM 34010 C C . ASN F 1 683 ? -18.050 -34.549 -7.763 1.00 54.80 ? 683 ASN F C 1 +ATOM 34011 O O . ASN F 1 683 ? -19.010 -34.606 -8.519 1.00 54.44 ? 683 ASN F O 1 +ATOM 34012 C CB . ASN F 1 683 ? -17.958 -32.137 -8.389 1.00 56.04 ? 683 ASN F CB 1 +ATOM 34013 C CG . ASN F 1 683 ? -17.343 -30.772 -8.143 1.00 56.39 ? 683 ASN F CG 1 +ATOM 34014 O OD1 . ASN F 1 683 ? -17.176 -30.353 -6.997 1.00 56.97 ? 683 ASN F OD1 1 +ATOM 34015 N ND2 . ASN F 1 683 ? -17.007 -30.070 -9.217 1.00 56.77 ? 683 ASN F ND2 1 +ATOM 34016 N N . GLN F 1 684 ? -17.613 -35.602 -7.089 1.00 56.21 ? 684 GLN F N 1 +ATOM 34017 C CA . GLN F 1 684 ? -18.282 -36.894 -7.185 1.00 57.00 ? 684 GLN F CA 1 +ATOM 34018 C C . GLN F 1 684 ? -17.738 -37.840 -6.127 1.00 56.70 ? 684 GLN F C 1 +ATOM 34019 O O . GLN F 1 684 ? -16.662 -37.612 -5.578 1.00 55.96 ? 684 GLN F O 1 +ATOM 34020 C CB . GLN F 1 684 ? -18.078 -37.509 -8.563 1.00 56.79 ? 684 GLN F CB 1 +ATOM 34021 C CG . GLN F 1 684 ? -16.686 -38.034 -8.791 1.00 58.83 ? 684 GLN F CG 1 +ATOM 34022 C CD . GLN F 1 684 ? -16.555 -38.755 -10.116 1.00 59.73 ? 684 GLN F CD 1 +ATOM 34023 O OE1 . GLN F 1 684 ? -16.738 -38.158 -11.183 1.00 60.36 ? 684 GLN F OE1 1 +ATOM 34024 N NE2 . GLN F 1 684 ? -16.239 -40.046 -10.057 1.00 58.04 ? 684 GLN F NE2 1 +ATOM 34025 N N . LYS F 1 685 ? -18.487 -38.897 -5.840 1.00 57.21 ? 685 LYS F N 1 +ATOM 34026 C CA . LYS F 1 685 ? -18.058 -39.875 -4.853 1.00 57.71 ? 685 LYS F CA 1 +ATOM 34027 C C . LYS F 1 685 ? -16.909 -40.713 -5.403 1.00 56.92 ? 685 LYS F C 1 +ATOM 34028 O O . LYS F 1 685 ? -16.815 -40.951 -6.602 1.00 56.79 ? 685 LYS F O 1 +ATOM 34029 C CB . LYS F 1 685 ? -19.227 -40.775 -4.443 1.00 58.33 ? 685 LYS F CB 1 +ATOM 34030 C CG . LYS F 1 685 ? -20.303 -40.047 -3.656 1.00 61.13 ? 685 LYS F CG 1 +ATOM 34031 C CD . LYS F 1 685 ? -21.256 -41.006 -2.967 1.00 64.55 ? 685 LYS F CD 1 +ATOM 34032 C CE . LYS F 1 685 ? -22.061 -41.824 -3.968 1.00 67.17 ? 685 LYS F CE 1 +ATOM 34033 N NZ . LYS F 1 685 ? -22.941 -40.967 -4.812 1.00 69.95 ? 685 LYS F NZ 1 +ATOM 34034 N N . ILE F 1 686 ? -16.028 -41.146 -4.514 1.00 56.66 ? 686 ILE F N 1 +ATOM 34035 C CA . ILE F 1 686 ? -14.883 -41.951 -4.898 1.00 56.50 ? 686 ILE F CA 1 +ATOM 34036 C C . ILE F 1 686 ? -14.896 -43.263 -4.127 1.00 56.46 ? 686 ILE F C 1 +ATOM 34037 O O . ILE F 1 686 ? -14.850 -43.280 -2.898 1.00 56.65 ? 686 ILE F O 1 +ATOM 34038 C CB . ILE F 1 686 ? -13.573 -41.180 -4.634 1.00 57.22 ? 686 ILE F CB 1 +ATOM 34039 C CG1 . ILE F 1 686 ? -13.538 -39.941 -5.536 1.00 55.76 ? 686 ILE F CG1 1 +ATOM 34040 C CG2 . ILE F 1 686 ? -12.362 -42.077 -4.881 1.00 56.93 ? 686 ILE F CG2 1 +ATOM 34041 C CD1 . ILE F 1 686 ? -12.368 -39.054 -5.309 1.00 57.07 ? 686 ILE F CD1 1 +ATOM 34042 N N . ARG F 1 687 ? -14.966 -44.358 -4.873 1.00 56.17 ? 687 ARG F N 1 +ATOM 34043 C CA . ARG F 1 687 ? -15.011 -45.701 -4.310 1.00 56.76 ? 687 ARG F CA 1 +ATOM 34044 C C . ARG F 1 687 ? -13.848 -45.996 -3.374 1.00 55.94 ? 687 ARG F C 1 +ATOM 34045 O O . ARG F 1 687 ? -14.045 -46.388 -2.224 1.00 54.40 ? 687 ARG F O 1 +ATOM 34046 C CB . ARG F 1 687 ? -15.008 -46.732 -5.436 1.00 59.13 ? 687 ARG F CB 1 +ATOM 34047 C CG . ARG F 1 687 ? -16.058 -46.486 -6.500 1.00 64.51 ? 687 ARG F CG 1 +ATOM 34048 C CD . ARG F 1 687 ? -17.413 -47.024 -6.094 1.00 68.22 ? 687 ARG F CD 1 +ATOM 34049 N NE . ARG F 1 687 ? -17.402 -48.482 -5.974 1.00 72.88 ? 687 ARG F NE 1 +ATOM 34050 C CZ . ARG F 1 687 ? -16.934 -49.313 -6.905 1.00 73.60 ? 687 ARG F CZ 1 +ATOM 34051 N NH1 . ARG F 1 687 ? -16.428 -48.834 -8.038 1.00 73.88 ? 687 ARG F NH1 1 +ATOM 34052 N NH2 . ARG F 1 687 ? -16.977 -50.627 -6.706 1.00 73.82 ? 687 ARG F NH2 1 +ATOM 34053 N N . GLY F 1 688 ? -12.631 -45.816 -3.871 1.00 55.88 ? 688 GLY F N 1 +ATOM 34054 C CA . GLY F 1 688 ? -11.488 -46.108 -3.041 1.00 55.50 ? 688 GLY F CA 1 +ATOM 34055 C C . GLY F 1 688 ? -10.147 -45.535 -3.436 1.00 55.25 ? 688 GLY F C 1 +ATOM 34056 O O . GLY F 1 688 ? -9.216 -45.615 -2.646 1.00 55.39 ? 688 GLY F O 1 +ATOM 34057 N N . LYS F 1 689 ? -10.007 -44.969 -4.628 1.00 55.23 ? 689 LYS F N 1 +ATOM 34058 C CA . LYS F 1 689 ? -8.703 -44.427 -4.970 1.00 56.08 ? 689 LYS F CA 1 +ATOM 34059 C C . LYS F 1 689 ? -8.602 -43.455 -6.135 1.00 55.59 ? 689 LYS F C 1 +ATOM 34060 O O . LYS F 1 689 ? -9.469 -43.397 -6.998 1.00 55.04 ? 689 LYS F O 1 +ATOM 34061 C CB . LYS F 1 689 ? -7.708 -45.566 -5.200 1.00 58.10 ? 689 LYS F CB 1 +ATOM 34062 C CG . LYS F 1 689 ? -7.748 -46.174 -6.582 1.00 60.05 ? 689 LYS F CG 1 +ATOM 34063 C CD . LYS F 1 689 ? -6.522 -47.043 -6.798 1.00 62.23 ? 689 LYS F CD 1 +ATOM 34064 C CE . LYS F 1 689 ? -6.411 -47.496 -8.236 1.00 62.65 ? 689 LYS F CE 1 +ATOM 34065 N NZ . LYS F 1 689 ? -5.190 -48.302 -8.471 1.00 62.24 ? 689 LYS F NZ 1 +ATOM 34066 N N . ILE F 1 690 ? -7.508 -42.697 -6.132 1.00 56.24 ? 690 ILE F N 1 +ATOM 34067 C CA . ILE F 1 690 ? -7.198 -41.714 -7.162 1.00 56.06 ? 690 ILE F CA 1 +ATOM 34068 C C . ILE F 1 690 ? -5.723 -41.875 -7.513 1.00 56.79 ? 690 ILE F C 1 +ATOM 34069 O O . ILE F 1 690 ? -4.889 -42.012 -6.628 1.00 55.97 ? 690 ILE F O 1 +ATOM 34070 C CB . ILE F 1 690 ? -7.401 -40.279 -6.655 1.00 55.32 ? 690 ILE F CB 1 +ATOM 34071 C CG1 . ILE F 1 690 ? -8.861 -40.057 -6.281 1.00 55.77 ? 690 ILE F CG1 1 +ATOM 34072 C CG2 . ILE F 1 690 ? -6.957 -39.285 -7.716 1.00 55.62 ? 690 ILE F CG2 1 +ATOM 34073 C CD1 . ILE F 1 690 ? -9.129 -38.676 -5.746 1.00 55.71 ? 690 ILE F CD1 1 +ATOM 34074 N N . ASN F 1 691 ? -5.401 -41.865 -8.801 1.00 58.32 ? 691 ASN F N 1 +ATOM 34075 C CA . ASN F 1 691 ? -4.016 -41.997 -9.228 1.00 59.89 ? 691 ASN F CA 1 +ATOM 34076 C C . ASN F 1 691 ? -3.590 -40.720 -9.920 1.00 60.71 ? 691 ASN F C 1 +ATOM 34077 O O . ASN F 1 691 ? -4.398 -40.044 -10.541 1.00 59.83 ? 691 ASN F O 1 +ATOM 34078 C CB . ASN F 1 691 ? -3.840 -43.182 -10.191 1.00 61.67 ? 691 ASN F CB 1 +ATOM 34079 C CG . ASN F 1 691 ? -3.979 -44.525 -9.504 1.00 62.89 ? 691 ASN F CG 1 +ATOM 34080 O OD1 . ASN F 1 691 ? -5.085 -45.006 -9.255 1.00 64.39 ? 691 ASN F OD1 1 +ATOM 34081 N ND2 . ASN F 1 691 ? -2.850 -45.136 -9.182 1.00 63.59 ? 691 ASN F ND2 1 +ATOM 34082 N N . LEU F 1 692 ? -2.312 -40.390 -9.807 1.00 63.67 ? 692 LEU F N 1 +ATOM 34083 C CA . LEU F 1 692 ? -1.775 -39.195 -10.434 1.00 67.04 ? 692 LEU F CA 1 +ATOM 34084 C C . LEU F 1 692 ? -0.842 -39.557 -11.580 1.00 69.61 ? 692 LEU F C 1 +ATOM 34085 O O . LEU F 1 692 ? -0.123 -40.550 -11.505 1.00 69.86 ? 692 LEU F O 1 +ATOM 34086 C CB . LEU F 1 692 ? -1.017 -38.363 -9.405 1.00 67.43 ? 692 LEU F CB 1 +ATOM 34087 C CG . LEU F 1 692 ? -1.845 -37.552 -8.405 1.00 68.84 ? 692 LEU F CG 1 +ATOM 34088 C CD1 . LEU F 1 692 ? -2.800 -38.438 -7.627 1.00 68.70 ? 692 LEU F CD1 1 +ATOM 34089 C CD2 . LEU F 1 692 ? -0.895 -36.842 -7.463 1.00 69.18 ? 692 LEU F CD2 1 +ATOM 34090 N N . GLU F 1 693 ? -0.863 -38.750 -12.637 1.00 72.65 ? 693 GLU F N 1 +ATOM 34091 C CA . GLU F 1 693 ? -0.008 -38.975 -13.802 1.00 75.70 ? 693 GLU F CA 1 +ATOM 34092 C C . GLU F 1 693 ? 0.551 -37.659 -14.354 1.00 76.17 ? 693 GLU F C 1 +ATOM 34093 O O . GLU F 1 693 ? -0.066 -36.597 -14.224 1.00 76.20 ? 693 GLU F O 1 +ATOM 34094 C CB . GLU F 1 693 ? -0.785 -39.706 -14.902 1.00 77.35 ? 693 GLU F CB 1 +ATOM 34095 C CG . GLU F 1 693 ? -1.377 -41.039 -14.471 1.00 80.94 ? 693 GLU F CG 1 +ATOM 34096 C CD . GLU F 1 693 ? -2.020 -41.801 -15.626 1.00 83.90 ? 693 GLU F CD 1 +ATOM 34097 O OE1 . GLU F 1 693 ? -2.836 -41.199 -16.362 1.00 85.00 ? 693 GLU F OE1 1 +ATOM 34098 O OE2 . GLU F 1 693 ? -1.714 -43.005 -15.793 1.00 84.40 ? 693 GLU F OE2 1 +HETATM 34099 C C1 . BOG G 2 . ? -6.826 19.629 76.813 1.00 64.49 ? 2000 BOG A C1 1 +HETATM 34100 O O1 . BOG G 2 . ? -6.710 19.092 75.492 1.00 65.20 ? 2000 BOG A O1 1 +HETATM 34101 C C2 . BOG G 2 . ? -5.617 20.573 77.080 1.00 64.47 ? 2000 BOG A C2 1 +HETATM 34102 O O2 . BOG G 2 . ? -4.404 19.840 76.941 1.00 64.78 ? 2000 BOG A O2 1 +HETATM 34103 C C3 . BOG G 2 . ? -5.732 21.191 78.503 1.00 64.16 ? 2000 BOG A C3 1 +HETATM 34104 O O3 . BOG G 2 . ? -4.634 22.055 78.751 1.00 64.04 ? 2000 BOG A O3 1 +HETATM 34105 C C4 . BOG G 2 . ? -7.065 21.974 78.607 1.00 64.02 ? 2000 BOG A C4 1 +HETATM 34106 O O4 . BOG G 2 . ? -7.200 22.568 79.912 1.00 60.98 ? 2000 BOG A O4 1 +HETATM 34107 C C5 . BOG G 2 . ? -8.265 20.996 78.323 1.00 64.24 ? 2000 BOG A C5 1 +HETATM 34108 O O5 . BOG G 2 . ? -8.081 20.405 76.979 1.00 65.01 ? 2000 BOG A O5 1 +HETATM 34109 C C6 . BOG G 2 . ? -9.602 21.758 78.395 1.00 65.02 ? 2000 BOG A C6 1 +HETATM 34110 O O6 . BOG G 2 . ? -10.646 21.088 77.670 1.00 66.08 ? 2000 BOG A O6 1 +HETATM 34111 C "C1'" . BOG G 2 . ? -7.764 18.209 75.118 1.00 65.03 ? 2000 BOG A "C1'" 1 +HETATM 34112 C "C2'" . BOG G 2 . ? -8.031 18.485 73.657 1.00 64.77 ? 2000 BOG A "C2'" 1 +HETATM 34113 C C1 . BOG H 2 . ? 15.840 -2.114 81.006 1.00 65.01 ? 2000 BOG B C1 1 +HETATM 34114 O O1 . BOG H 2 . ? 15.667 -1.836 79.610 1.00 64.69 ? 2000 BOG B O1 1 +HETATM 34115 C C2 . BOG H 2 . ? 16.018 -3.648 81.195 1.00 64.80 ? 2000 BOG B C2 1 +HETATM 34116 O O2 . BOG H 2 . ? 14.867 -4.325 80.682 1.00 64.83 ? 2000 BOG B O2 1 +HETATM 34117 C C3 . BOG H 2 . ? 16.232 -3.976 82.706 1.00 65.27 ? 2000 BOG B C3 1 +HETATM 34118 O O3 . BOG H 2 . ? 16.398 -5.374 82.889 1.00 65.35 ? 2000 BOG B O3 1 +HETATM 34119 C C4 . BOG H 2 . ? 17.487 -3.219 83.214 1.00 65.67 ? 2000 BOG B C4 1 +HETATM 34120 O O4 . BOG H 2 . ? 17.724 -3.513 84.604 1.00 64.26 ? 2000 BOG B O4 1 +HETATM 34121 C C5 . BOG H 2 . ? 17.278 -1.666 83.001 1.00 65.61 ? 2000 BOG B C5 1 +HETATM 34122 O O5 . BOG H 2 . ? 17.036 -1.417 81.562 1.00 65.76 ? 2000 BOG B O5 1 +HETATM 34123 C C6 . BOG H 2 . ? 18.519 -0.886 83.477 1.00 66.26 ? 2000 BOG B C6 1 +HETATM 34124 O O6 . BOG H 2 . ? 18.600 0.419 82.880 1.00 66.41 ? 2000 BOG B O6 1 +HETATM 34125 C "C1'" . BOG H 2 . ? 15.494 -0.458 79.305 1.00 64.31 ? 2000 BOG B "C1'" 1 +HETATM 34126 C "C2'" . BOG H 2 . ? 16.232 -0.231 78.014 1.00 64.91 ? 2000 BOG B "C2'" 1 +HETATM 34127 C C1 . BOG I 2 . ? -14.199 -11.025 76.589 1.00 64.28 ? 2000 BOG C C1 1 +HETATM 34128 O O1 . BOG I 2 . ? -13.537 -10.894 75.325 1.00 64.54 ? 2000 BOG C O1 1 +HETATM 34129 C C2 . BOG I 2 . ? -15.632 -10.432 76.471 1.00 64.21 ? 2000 BOG C C2 1 +HETATM 34130 O O2 . BOG I 2 . ? -15.548 -9.056 76.088 1.00 65.14 ? 2000 BOG C O2 1 +HETATM 34131 C C3 . BOG I 2 . ? -16.379 -10.588 77.827 1.00 64.45 ? 2000 BOG C C3 1 +HETATM 34132 O O3 . BOG I 2 . ? -17.689 -10.052 77.732 1.00 63.70 ? 2000 BOG C O3 1 +HETATM 34133 C C4 . BOG I 2 . ? -16.443 -12.093 78.195 1.00 64.66 ? 2000 BOG C C4 1 +HETATM 34134 O O4 . BOG I 2 . ? -17.140 -12.282 79.437 1.00 63.99 ? 2000 BOG C O4 1 +HETATM 34135 C C5 . BOG I 2 . ? -14.981 -12.664 78.298 1.00 64.29 ? 2000 BOG C C5 1 +HETATM 34136 O O5 . BOG I 2 . ? -14.302 -12.446 77.007 1.00 65.14 ? 2000 BOG C O5 1 +HETATM 34137 C C6 . BOG I 2 . ? -15.018 -14.166 78.641 1.00 64.84 ? 2000 BOG C C6 1 +HETATM 34138 O O6 . BOG I 2 . ? -13.808 -14.840 78.267 1.00 64.70 ? 2000 BOG C O6 1 +HETATM 34139 C "C1'" . BOG I 2 . ? -12.208 -11.409 75.299 1.00 64.37 ? 2000 BOG C "C1'" 1 +HETATM 34140 C "C2'" . BOG I 2 . ? -12.040 -12.062 73.946 1.00 63.78 ? 2000 BOG C "C2'" 1 +HETATM 34141 C C1 . BOG J 2 . ? 20.297 -6.880 44.516 1.00 63.64 ? 2000 BOG D C1 1 +HETATM 34142 O O1 . BOG J 2 . ? 19.604 -6.836 45.768 1.00 64.62 ? 2000 BOG D O1 1 +HETATM 34143 C C2 . BOG J 2 . ? 21.430 -5.819 44.539 1.00 64.06 ? 2000 BOG D C2 1 +HETATM 34144 O O2 . BOG J 2 . ? 20.860 -4.525 44.758 1.00 63.38 ? 2000 BOG D O2 1 +HETATM 34145 C C3 . BOG J 2 . ? 22.227 -5.860 43.198 1.00 64.47 ? 2000 BOG D C3 1 +HETATM 34146 O O3 . BOG J 2 . ? 23.275 -4.894 43.214 1.00 62.43 ? 2000 BOG D O3 1 +HETATM 34147 C C4 . BOG J 2 . ? 22.813 -7.285 43.008 1.00 64.67 ? 2000 BOG D C4 1 +HETATM 34148 O O4 . BOG J 2 . ? 23.562 -7.358 41.786 1.00 65.16 ? 2000 BOG D O4 1 +HETATM 34149 C C5 . BOG J 2 . ? 21.636 -8.336 42.994 1.00 64.16 ? 2000 BOG D C5 1 +HETATM 34150 O O5 . BOG J 2 . ? 20.893 -8.218 44.267 1.00 64.50 ? 2000 BOG D O5 1 +HETATM 34151 C C6 . BOG J 2 . ? 22.195 -9.764 42.826 1.00 64.80 ? 2000 BOG D C6 1 +HETATM 34152 O O6 . BOG J 2 . ? 21.292 -10.772 43.318 1.00 64.74 ? 2000 BOG D O6 1 +HETATM 34153 C "C1'" . BOG J 2 . ? 18.527 -7.768 45.890 1.00 64.65 ? 2000 BOG D "C1'" 1 +HETATM 34154 C "C2'" . BOG J 2 . ? 18.560 -8.262 47.318 1.00 63.50 ? 2000 BOG D "C2'" 1 +HETATM 34155 C C1 . BOG K 2 . ? 2.802 19.152 40.799 1.00 64.35 ? 2000 BOG E C1 1 +HETATM 34156 O O1 . BOG K 2 . ? 2.832 18.762 42.181 1.00 64.82 ? 2000 BOG E O1 1 +HETATM 34157 C C2 . BOG K 2 . ? 1.358 19.592 40.435 1.00 63.69 ? 2000 BOG E C2 1 +HETATM 34158 O O2 . BOG K 2 . ? 0.467 18.507 40.676 1.00 62.50 ? 2000 BOG E O2 1 +HETATM 34159 C C3 . BOG K 2 . ? 1.297 20.047 38.944 1.00 63.69 ? 2000 BOG E C3 1 +HETATM 34160 O O3 . BOG K 2 . ? -0.019 20.456 38.609 1.00 62.13 ? 2000 BOG E O3 1 +HETATM 34161 C C4 . BOG K 2 . ? 2.285 21.219 38.734 1.00 64.63 ? 2000 BOG E C4 1 +HETATM 34162 O O4 . BOG K 2 . ? 2.242 21.670 37.371 1.00 63.36 ? 2000 BOG E O4 1 +HETATM 34163 C C5 . BOG K 2 . ? 3.744 20.741 39.116 1.00 65.41 ? 2000 BOG E C5 1 +HETATM 34164 O O5 . BOG K 2 . ? 3.731 20.283 40.524 1.00 65.34 ? 2000 BOG E O5 1 +HETATM 34165 C C6 . BOG K 2 . ? 4.751 21.896 38.936 1.00 65.57 ? 2000 BOG E C6 1 +HETATM 34166 O O6 . BOG K 2 . ? 5.949 21.691 39.697 1.00 66.00 ? 2000 BOG E O6 1 +HETATM 34167 C "C1'" . BOG K 2 . ? 4.110 18.334 42.646 1.00 64.74 ? 2000 BOG E "C1'" 1 +HETATM 34168 C "C2'" . BOG K 2 . ? 4.236 18.867 44.054 1.00 64.87 ? 2000 BOG E "C2'" 1 +HETATM 34169 C C1 . BOG L 2 . ? -10.993 -9.242 39.628 1.00 64.98 ? 2000 BOG F C1 1 +HETATM 34170 O O1 . BOG L 2 . ? -10.968 -8.746 40.974 1.00 65.77 ? 2000 BOG F O1 1 +HETATM 34171 C C2 . BOG L 2 . ? -10.626 -10.756 39.643 1.00 63.67 ? 2000 BOG F C2 1 +HETATM 34172 O O2 . BOG L 2 . ? -9.328 -10.920 40.214 1.00 62.16 ? 2000 BOG F O2 1 +HETATM 34173 C C3 . BOG L 2 . ? -10.670 -11.325 38.196 1.00 64.54 ? 2000 BOG F C3 1 +HETATM 34174 O O3 . BOG L 2 . ? -10.348 -12.708 38.198 1.00 64.15 ? 2000 BOG F O3 1 +HETATM 34175 C C4 . BOG L 2 . ? -12.085 -11.118 37.616 1.00 65.17 ? 2000 BOG F C4 1 +HETATM 34176 O O4 . BOG L 2 . ? -12.156 -11.643 36.283 1.00 65.01 ? 2000 BOG F O4 1 +HETATM 34177 C C5 . BOG L 2 . ? -12.436 -9.576 37.621 1.00 65.49 ? 2000 BOG F C5 1 +HETATM 34178 O O5 . BOG L 2 . ? -12.337 -9.078 39.012 1.00 65.78 ? 2000 BOG F O5 1 +HETATM 34179 C C6 . BOG L 2 . ? -13.862 -9.348 37.066 1.00 65.45 ? 2000 BOG F C6 1 +HETATM 34180 O O6 . BOG L 2 . ? -14.420 -8.087 37.482 1.00 65.67 ? 2000 BOG F O6 1 +HETATM 34181 C "C1'" . BOG L 2 . ? -11.290 -7.365 41.103 1.00 64.90 ? 2000 BOG F "C1'" 1 +HETATM 34182 C "C2'" . BOG L 2 . ? -12.092 -7.245 42.376 1.00 63.58 ? 2000 BOG F "C2'" 1 +HETATM 34183 O O . HOH M 3 . ? -2.910 20.865 80.904 1.00 30.54 ? 2001 HOH A O 1 +HETATM 34184 O O . HOH M 3 . ? -6.927 24.101 85.523 1.00 57.43 ? 2002 HOH A O 1 +HETATM 34185 O O . HOH M 3 . ? -8.577 27.927 77.942 1.00 36.29 ? 2003 HOH A O 1 +HETATM 34186 O O . HOH M 3 . ? -8.250 25.086 80.440 1.00 40.49 ? 2004 HOH A O 1 +HETATM 34187 O O . HOH M 3 . ? -10.314 26.211 79.679 1.00 42.18 ? 2005 HOH A O 1 +HETATM 34188 O O . HOH M 3 . ? -9.870 25.486 82.221 1.00 40.94 ? 2006 HOH A O 1 +HETATM 34189 O O . HOH M 3 . ? 4.626 31.804 98.501 1.00 34.78 ? 2007 HOH A O 1 +HETATM 34190 O O . HOH M 3 . ? 1.176 26.109 86.045 1.00 36.13 ? 2008 HOH A O 1 +HETATM 34191 O O . HOH M 3 . ? 25.141 14.867 86.430 1.00 35.56 ? 2009 HOH A O 1 +HETATM 34192 O O . HOH M 3 . ? 0.769 33.698 64.258 1.00 26.04 ? 2010 HOH A O 1 +HETATM 34193 O O . HOH M 3 . ? 8.197 21.447 92.791 1.00 34.24 ? 2011 HOH A O 1 +HETATM 34194 O O . HOH M 3 . ? 8.032 18.194 86.436 1.00 35.57 ? 2012 HOH A O 1 +HETATM 34195 O O . HOH M 3 . ? 3.948 37.572 57.588 1.00 30.48 ? 2013 HOH A O 1 +HETATM 34196 O O . HOH M 3 . ? 12.892 22.648 95.326 1.00 41.96 ? 2014 HOH A O 1 +HETATM 34197 O O . HOH M 3 . ? 2.279 23.420 75.137 1.00 35.56 ? 2015 HOH A O 1 +HETATM 34198 O O . HOH M 3 . ? -9.895 34.526 69.100 1.00 34.97 ? 2016 HOH A O 1 +HETATM 34199 O O . HOH M 3 . ? 11.130 44.155 74.331 1.00 42.64 ? 2017 HOH A O 1 +HETATM 34200 O O . HOH M 3 . ? -2.330 22.234 116.175 1.00 40.35 ? 2018 HOH A O 1 +HETATM 34201 O O . HOH M 3 . ? -7.576 33.413 96.221 1.00 44.23 ? 2019 HOH A O 1 +HETATM 34202 O O . HOH M 3 . ? 12.948 16.361 99.046 1.00 42.56 ? 2020 HOH A O 1 +HETATM 34203 O O . HOH M 3 . ? -5.257 18.420 104.094 1.00 41.07 ? 2021 HOH A O 1 +HETATM 34204 O O . HOH M 3 . ? -1.939 19.351 115.946 1.00 36.97 ? 2022 HOH A O 1 +HETATM 34205 O O . HOH M 3 . ? -31.968 27.299 88.742 1.00 47.12 ? 2023 HOH A O 1 +HETATM 34206 O O . HOH M 3 . ? -16.924 29.633 84.387 1.00 34.71 ? 2024 HOH A O 1 +HETATM 34207 O O . HOH M 3 . ? 16.589 32.328 75.636 1.00 43.19 ? 2025 HOH A O 1 +HETATM 34208 O O . HOH M 3 . ? 7.401 14.356 103.696 1.00 50.85 ? 2026 HOH A O 1 +HETATM 34209 O O . HOH M 3 . ? 15.694 25.196 72.729 1.00 40.08 ? 2027 HOH A O 1 +HETATM 34210 O O . HOH M 3 . ? -6.339 18.304 81.141 1.00 44.86 ? 2028 HOH A O 1 +HETATM 34211 O O . HOH M 3 . ? -3.797 15.440 86.099 1.00 53.31 ? 2029 HOH A O 1 +HETATM 34212 O O . HOH M 3 . ? -3.499 33.731 77.472 1.00 43.31 ? 2030 HOH A O 1 +HETATM 34213 O O . HOH M 3 . ? -17.939 22.708 90.351 1.00 35.07 ? 2031 HOH A O 1 +HETATM 34214 O O . HOH M 3 . ? -9.495 45.216 88.910 1.00 37.25 ? 2032 HOH A O 1 +HETATM 34215 O O . HOH M 3 . ? 6.133 39.323 64.462 1.00 35.17 ? 2033 HOH A O 1 +HETATM 34216 O O . HOH M 3 . ? -17.250 30.108 73.337 1.00 31.53 ? 2034 HOH A O 1 +HETATM 34217 O O . HOH M 3 . ? 1.811 22.446 66.932 1.00 49.37 ? 2035 HOH A O 1 +HETATM 34218 O O . HOH M 3 . ? 16.577 31.241 104.488 1.00 53.90 ? 2036 HOH A O 1 +HETATM 34219 O O . HOH M 3 . ? 22.067 41.639 83.707 1.00 43.32 ? 2037 HOH A O 1 +HETATM 34220 O O . HOH M 3 . ? -2.756 45.515 92.657 1.00 38.02 ? 2038 HOH A O 1 +HETATM 34221 O O . HOH M 3 . ? 32.035 22.449 92.291 1.00 47.74 ? 2039 HOH A O 1 +HETATM 34222 O O . HOH M 3 . ? -15.294 41.454 66.172 1.00 51.05 ? 2040 HOH A O 1 +HETATM 34223 O O . HOH M 3 . ? 15.495 33.245 107.185 1.00 39.00 ? 2041 HOH A O 1 +HETATM 34224 O O . HOH M 3 . ? -5.426 19.425 106.791 1.00 45.39 ? 2042 HOH A O 1 +HETATM 34225 O O . HOH M 3 . ? 17.114 31.877 66.796 1.00 45.12 ? 2043 HOH A O 1 +HETATM 34226 O O . HOH M 3 . ? 9.329 23.203 81.610 1.00 42.72 ? 2044 HOH A O 1 +HETATM 34227 O O . HOH M 3 . ? -15.248 36.643 106.689 1.00 50.50 ? 2045 HOH A O 1 +HETATM 34228 O O . HOH M 3 . ? -6.743 37.278 120.044 1.00 42.78 ? 2046 HOH A O 1 +HETATM 34229 O O . HOH M 3 . ? -19.806 23.058 83.455 1.00 39.32 ? 2047 HOH A O 1 +HETATM 34230 O O . HOH M 3 . ? 7.031 53.718 127.031 1.00 50.61 ? 2048 HOH A O 1 +HETATM 34231 O O . HOH M 3 . ? -0.079 11.146 89.672 1.00 44.10 ? 2049 HOH A O 1 +HETATM 34232 O O . HOH M 3 . ? -30.250 38.033 80.883 1.00 52.90 ? 2050 HOH A O 1 +HETATM 34233 O O . HOH M 3 . ? 38.371 35.954 77.701 1.00 47.35 ? 2051 HOH A O 1 +HETATM 34234 O O . HOH M 3 . ? -2.095 15.533 72.632 1.00 50.98 ? 2052 HOH A O 1 +HETATM 34235 O O . HOH M 3 . ? 15.810 18.838 72.045 1.00 45.70 ? 2053 HOH A O 1 +HETATM 34236 O O . HOH M 3 . ? -4.932 23.966 128.715 1.00 45.01 ? 2054 HOH A O 1 +HETATM 34237 O O . HOH M 3 . ? 8.061 46.753 68.154 1.00 44.13 ? 2055 HOH A O 1 +HETATM 34238 O O . HOH M 3 . ? -16.671 10.668 101.156 1.00 44.70 ? 2056 HOH A O 1 +HETATM 34239 O O . HOH M 3 . ? 17.584 20.782 74.845 1.00 37.28 ? 2057 HOH A O 1 +HETATM 34240 O O . HOH M 3 . ? -0.661 48.285 91.197 1.00 58.19 ? 2058 HOH A O 1 +HETATM 34241 O O . HOH M 3 . ? 1.239 46.816 91.792 1.00 52.03 ? 2059 HOH A O 1 +HETATM 34242 O O . HOH M 3 . ? -5.432 42.716 112.379 1.00 49.99 ? 2060 HOH A O 1 +HETATM 34243 O O . HOH M 3 . ? -7.469 43.440 111.174 1.00 41.31 ? 2061 HOH A O 1 +HETATM 34244 O O . HOH M 3 . ? 26.447 13.697 94.777 1.00 40.97 ? 2062 HOH A O 1 +HETATM 34245 O O . HOH M 3 . ? -28.949 33.869 81.533 1.00 40.61 ? 2063 HOH A O 1 +HETATM 34246 O O . HOH M 3 . ? 11.703 42.919 72.080 1.00 58.40 ? 2064 HOH A O 1 +HETATM 34247 O O . HOH M 3 . ? 17.017 28.773 107.025 1.00 48.55 ? 2065 HOH A O 1 +HETATM 34248 O O . HOH M 3 . ? -6.693 27.193 91.130 1.00 48.94 ? 2066 HOH A O 1 +HETATM 34249 O O . HOH M 3 . ? 7.857 12.348 81.967 1.00 41.81 ? 2067 HOH A O 1 +HETATM 34250 O O . HOH M 3 . ? 5.118 16.511 80.033 1.00 46.97 ? 2068 HOH A O 1 +HETATM 34251 O O . HOH M 3 . ? -14.813 9.225 92.585 1.00 43.96 ? 2069 HOH A O 1 +HETATM 34252 O O . HOH M 3 . ? -18.046 10.936 98.962 1.00 45.88 ? 2070 HOH A O 1 +HETATM 34253 O O . HOH M 3 . ? 23.471 38.680 102.064 1.00 49.52 ? 2071 HOH A O 1 +HETATM 34254 O O . HOH M 3 . ? -5.172 15.316 114.234 1.00 52.73 ? 2072 HOH A O 1 +HETATM 34255 O O . HOH M 3 . ? -7.678 8.685 95.573 1.00 38.89 ? 2073 HOH A O 1 +HETATM 34256 O O . HOH M 3 . ? -2.449 15.483 89.753 1.00 54.92 ? 2074 HOH A O 1 +HETATM 34257 O O . HOH M 3 . ? -5.959 25.127 82.081 1.00 49.01 ? 2075 HOH A O 1 +HETATM 34258 O O . HOH M 3 . ? 13.492 43.841 82.628 1.00 52.08 ? 2076 HOH A O 1 +HETATM 34259 O O . HOH M 3 . ? -10.734 38.952 106.281 1.00 41.74 ? 2077 HOH A O 1 +HETATM 34260 O O . HOH M 3 . ? 11.594 12.632 100.600 1.00 49.28 ? 2078 HOH A O 1 +HETATM 34261 O O . HOH M 3 . ? 10.779 10.354 100.315 1.00 44.44 ? 2079 HOH A O 1 +HETATM 34262 O O . HOH M 3 . ? 26.567 31.939 98.972 1.00 51.25 ? 2080 HOH A O 1 +HETATM 34263 O O . HOH M 3 . ? 20.274 40.496 81.012 1.00 50.80 ? 2081 HOH A O 1 +HETATM 34264 O O . HOH M 3 . ? -23.416 39.683 74.143 1.00 39.92 ? 2082 HOH A O 1 +HETATM 34265 O O . HOH M 3 . ? -15.683 39.753 100.543 1.00 51.18 ? 2083 HOH A O 1 +HETATM 34266 O O . HOH N 3 . ? 23.346 -4.862 83.967 1.00 35.52 ? 2001 HOH B O 1 +HETATM 34267 O O . HOH N 3 . ? 20.137 -3.885 85.818 1.00 40.71 ? 2002 HOH B O 1 +HETATM 34268 O O . HOH N 3 . ? 22.319 -2.607 85.662 1.00 44.75 ? 2003 HOH B O 1 +HETATM 34269 O O . HOH N 3 . ? 20.868 -2.842 87.920 1.00 38.32 ? 2004 HOH B O 1 +HETATM 34270 O O . HOH N 3 . ? 15.346 -19.965 101.794 1.00 37.40 ? 2005 HOH B O 1 +HETATM 34271 O O . HOH N 3 . ? 15.248 -13.082 89.437 1.00 38.92 ? 2006 HOH B O 1 +HETATM 34272 O O . HOH N 3 . ? -5.331 -28.189 82.958 1.00 32.07 ? 2007 HOH B O 1 +HETATM 34273 O O . HOH N 3 . ? 27.501 -14.600 69.931 1.00 27.49 ? 2008 HOH B O 1 +HETATM 34274 O O . HOH N 3 . ? 6.397 -17.424 93.652 1.00 36.40 ? 2009 HOH B O 1 +HETATM 34275 O O . HOH N 3 . ? 5.302 -15.123 87.048 1.00 34.19 ? 2010 HOH B O 1 +HETATM 34276 O O . HOH N 3 . ? 31.074 -18.579 63.605 1.00 37.23 ? 2011 HOH B O 1 +HETATM 34277 O O . HOH N 3 . ? 4.618 -22.267 95.380 1.00 35.96 ? 2012 HOH B O 1 +HETATM 34278 O O . HOH N 3 . ? 15.293 -11.711 78.302 1.00 34.53 ? 2013 HOH B O 1 +HETATM 34279 O O . HOH N 3 . ? 31.880 -6.146 76.964 1.00 32.57 ? 2014 HOH B O 1 +HETATM 34280 O O . HOH N 3 . ? 29.027 -29.505 79.425 1.00 43.90 ? 2015 HOH B O 1 +HETATM 34281 O O . HOH N 3 . ? 5.846 -10.720 118.499 1.00 41.14 ? 2016 HOH B O 1 +HETATM 34282 O O . HOH N 3 . ? 22.910 -10.030 102.377 1.00 36.96 ? 2017 HOH B O 1 +HETATM 34283 O O . HOH N 3 . ? -1.741 -19.580 97.824 1.00 45.83 ? 2018 HOH B O 1 +HETATM 34284 O O . HOH N 3 . ? 7.146 -5.256 106.726 1.00 38.83 ? 2019 HOH B O 1 +HETATM 34285 O O . HOH N 3 . ? 3.328 -9.643 117.662 1.00 38.12 ? 2020 HOH B O 1 +HETATM 34286 O O . HOH N 3 . ? 30.847 14.806 98.959 1.00 50.32 ? 2021 HOH B O 1 +HETATM 34287 O O . HOH N 3 . ? 27.002 0.950 92.186 1.00 44.37 ? 2022 HOH B O 1 +HETATM 34288 O O . HOH N 3 . ? 16.207 -28.553 77.459 1.00 38.95 ? 2023 HOH B O 1 +HETATM 34289 O O . HOH N 3 . ? -2.085 -14.190 103.118 1.00 54.75 ? 2024 HOH B O 1 +HETATM 34290 O O . HOH N 3 . ? 11.261 -23.973 73.567 1.00 35.94 ? 2025 HOH B O 1 +HETATM 34291 O O . HOH N 3 . ? 13.378 -2.223 84.863 1.00 45.02 ? 2026 HOH B O 1 +HETATM 34292 O O . HOH N 3 . ? 27.924 -2.250 64.707 1.00 36.87 ? 2027 HOH B O 1 +HETATM 34293 O O . HOH N 3 . ? 8.605 -3.839 88.925 1.00 41.00 ? 2028 HOH B O 1 +HETATM 34294 O O . HOH N 3 . ? 3.537 -18.670 104.294 1.00 33.91 ? 2029 HOH B O 1 +HETATM 34295 O O . HOH N 3 . ? 24.090 7.649 84.741 1.00 40.56 ? 2030 HOH B O 1 +HETATM 34296 O O . HOH N 3 . ? 16.153 -25.565 92.035 1.00 31.17 ? 2031 HOH B O 1 +HETATM 34297 O O . HOH N 3 . ? 23.461 -32.829 91.045 1.00 42.49 ? 2032 HOH B O 1 +HETATM 34298 O O . HOH N 3 . ? 10.797 -20.388 87.963 1.00 53.03 ? 2033 HOH B O 1 +HETATM 34299 O O . HOH N 3 . ? 29.647 -22.005 70.065 1.00 42.76 ? 2034 HOH B O 1 +HETATM 34300 O O . HOH N 3 . ? 14.016 -7.243 93.652 1.00 41.10 ? 2035 HOH B O 1 +HETATM 34301 O O . HOH N 3 . ? 8.099 -30.719 105.141 1.00 41.83 ? 2036 HOH B O 1 +HETATM 34302 O O . HOH N 3 . ? 27.678 -4.616 79.823 1.00 38.15 ? 2037 HOH B O 1 +HETATM 34303 O O . HOH N 3 . ? 1.931 5.922 94.001 1.00 52.05 ? 2038 HOH B O 1 +HETATM 34304 O O . HOH N 3 . ? -3.067 -38.934 88.254 1.00 41.53 ? 2039 HOH B O 1 +HETATM 34305 O O . HOH N 3 . ? 28.848 -29.129 76.978 1.00 41.52 ? 2040 HOH B O 1 +HETATM 34306 O O . HOH N 3 . ? 38.310 -11.122 104.552 1.00 48.45 ? 2041 HOH B O 1 +HETATM 34307 O O . HOH N 3 . ? 15.758 -7.562 71.504 1.00 41.55 ? 2042 HOH B O 1 +HETATM 34308 O O . HOH N 3 . ? 4.207 -32.365 108.683 1.00 50.49 ? 2043 HOH B O 1 +HETATM 34309 O O . HOH N 3 . ? 31.556 -29.175 75.940 1.00 49.14 ? 2044 HOH B O 1 +HETATM 34310 O O . HOH N 3 . ? 16.153 -21.402 68.836 1.00 40.17 ? 2045 HOH B O 1 +HETATM 34311 O O . HOH N 3 . ? -4.780 -4.211 113.219 1.00 51.12 ? 2046 HOH B O 1 +HETATM 34312 O O . HOH N 3 . ? 39.628 -22.400 76.938 1.00 35.41 ? 2047 HOH B O 1 +HETATM 34313 O O . HOH N 3 . ? 7.292 -11.159 81.524 1.00 34.79 ? 2048 HOH B O 1 +HETATM 34314 O O . HOH N 3 . ? 32.227 -17.139 106.993 1.00 39.16 ? 2049 HOH B O 1 +HETATM 34315 O O . HOH N 3 . ? 25.780 -32.209 86.717 1.00 48.04 ? 2050 HOH B O 1 +HETATM 34316 O O . HOH N 3 . ? 8.963 -2.582 81.462 1.00 39.92 ? 2051 HOH B O 1 +HETATM 34317 O O . HOH N 3 . ? 5.495 -39.208 98.078 1.00 49.81 ? 2052 HOH B O 1 +HETATM 34318 O O . HOH N 3 . ? 9.358 3.404 99.281 1.00 31.45 ? 2053 HOH B O 1 +HETATM 34319 O O . HOH N 3 . ? -3.636 -13.793 109.457 1.00 37.16 ? 2054 HOH B O 1 +HETATM 34320 O O . HOH N 3 . ? 25.340 -17.959 119.209 1.00 59.41 ? 2055 HOH B O 1 +HETATM 34321 O O . HOH N 3 . ? 12.361 -13.130 124.411 1.00 52.77 ? 2056 HOH B O 1 +HETATM 34322 O O . HOH N 3 . ? -0.353 -37.559 91.811 1.00 43.74 ? 2057 HOH B O 1 +HETATM 34323 O O . HOH N 3 . ? 18.558 -7.039 96.060 1.00 48.80 ? 2058 HOH B O 1 +HETATM 34324 O O . HOH N 3 . ? 24.770 -29.513 134.870 1.00 53.72 ? 2059 HOH B O 1 +HETATM 34325 O O . HOH N 3 . ? 27.803 -16.931 118.085 1.00 54.84 ? 2060 HOH B O 1 +HETATM 34326 O O . HOH N 3 . ? 11.378 1.105 83.945 1.00 47.71 ? 2061 HOH B O 1 +HETATM 34327 O O . HOH N 3 . ? 9.560 -30.823 108.276 1.00 51.93 ? 2062 HOH B O 1 +HETATM 34328 O O . HOH N 3 . ? 32.095 -25.497 132.261 1.00 48.34 ? 2063 HOH B O 1 +HETATM 34329 O O . HOH N 3 . ? 13.690 2.863 86.905 1.00 39.05 ? 2064 HOH B O 1 +HETATM 34330 O O . HOH N 3 . ? 19.510 -38.538 85.885 1.00 55.68 ? 2065 HOH B O 1 +HETATM 34331 O O . HOH N 3 . ? 31.823 -19.714 100.623 1.00 44.09 ? 2066 HOH B O 1 +HETATM 34332 O O . HOH N 3 . ? 26.063 -23.267 63.343 1.00 34.15 ? 2067 HOH B O 1 +HETATM 34333 O O . HOH N 3 . ? 17.443 1.998 101.528 1.00 57.04 ? 2068 HOH B O 1 +HETATM 34334 O O . HOH N 3 . ? 26.472 -10.705 113.631 1.00 48.44 ? 2069 HOH B O 1 +HETATM 34335 O O . HOH N 3 . ? 27.820 -30.892 85.873 1.00 50.12 ? 2070 HOH B O 1 +HETATM 34336 O O . HOH N 3 . ? -13.650 -23.570 92.069 1.00 59.53 ? 2071 HOH B O 1 +HETATM 34337 O O . HOH N 3 . ? 19.978 -36.607 83.553 1.00 50.01 ? 2072 HOH B O 1 +HETATM 34338 O O . HOH N 3 . ? 38.942 -17.681 100.703 1.00 50.62 ? 2073 HOH B O 1 +HETATM 34339 O O . HOH N 3 . ? 13.215 -9.267 123.644 1.00 42.66 ? 2074 HOH B O 1 +HETATM 34340 O O . HOH O 3 . ? -20.762 -16.446 77.458 1.00 37.43 ? 2001 HOH C O 1 +HETATM 34341 O O . HOH O 3 . ? -18.893 -14.325 80.037 1.00 38.38 ? 2002 HOH C O 1 +HETATM 34342 O O . HOH O 3 . ? -18.779 -16.759 79.702 1.00 36.91 ? 2003 HOH C O 1 +HETATM 34343 O O . HOH O 3 . ? -18.844 -15.578 82.119 1.00 37.43 ? 2004 HOH C O 1 +HETATM 34344 O O . HOH O 3 . ? -34.222 -3.555 93.695 1.00 37.09 ? 2005 HOH C O 1 +HETATM 34345 O O . HOH O 3 . ? -25.299 -5.864 82.986 1.00 30.06 ? 2006 HOH C O 1 +HETATM 34346 O O . HOH O 3 . ? -26.979 20.090 78.234 1.00 33.85 ? 2007 HOH C O 1 +HETATM 34347 O O . HOH O 3 . ? -27.454 -13.846 61.448 1.00 33.15 ? 2008 HOH C O 1 +HETATM 34348 O O . HOH O 3 . ? -25.894 3.639 88.080 1.00 31.63 ? 2009 HOH C O 1 +HETATM 34349 O O . HOH O 3 . ? -21.774 4.009 82.297 1.00 34.63 ? 2010 HOH C O 1 +HETATM 34350 O O . HOH O 3 . ? -30.930 -14.322 53.991 1.00 31.66 ? 2011 HOH C O 1 +HETATM 34351 O O . HOH O 3 . ? -29.632 7.469 89.319 1.00 35.73 ? 2012 HOH C O 1 +HETATM 34352 O O . HOH O 3 . ? -21.457 -5.500 72.440 1.00 33.27 ? 2013 HOH C O 1 +HETATM 34353 O O . HOH O 3 . ? -24.072 -22.472 68.763 1.00 34.28 ? 2014 HOH C O 1 +HETATM 34354 O O . HOH O 3 . ? -43.274 -8.544 67.774 1.00 42.70 ? 2015 HOH C O 1 +HETATM 34355 O O . HOH O 3 . ? -26.045 -1.509 113.234 1.00 37.70 ? 2016 HOH C O 1 +HETATM 34356 O O . HOH O 3 . ? -29.443 -15.130 94.433 1.00 40.68 ? 2017 HOH C O 1 +HETATM 34357 O O . HOH O 3 . ? -24.961 11.327 93.389 1.00 40.95 ? 2018 HOH C O 1 +HETATM 34358 O O . HOH O 3 . ? -19.091 -4.308 102.630 1.00 46.61 ? 2019 HOH C O 1 +HETATM 34359 O O . HOH O 3 . ? -23.736 0.201 113.160 1.00 39.73 ? 2020 HOH C O 1 +HETATM 34360 O O . HOH O 3 . ? -11.245 -34.046 93.718 1.00 45.73 ? 2021 HOH C O 1 +HETATM 34361 O O . HOH O 3 . ? -19.558 -23.237 85.644 1.00 30.75 ? 2022 HOH C O 1 +HETATM 34362 O O . HOH O 3 . ? -35.965 2.218 68.586 1.00 42.92 ? 2023 HOH C O 1 +HETATM 34363 O O . HOH O 3 . ? -21.517 8.463 99.435 1.00 51.99 ? 2024 HOH C O 1 +HETATM 34364 O O . HOH O 3 . ? -28.797 4.526 66.637 1.00 38.84 ? 2025 HOH C O 1 +HETATM 34365 O O . HOH O 3 . ? -14.071 -9.212 80.726 1.00 37.89 ? 2026 HOH C O 1 +HETATM 34366 O O . HOH O 3 . ? -15.939 -19.617 58.481 1.00 38.66 ? 2027 HOH C O 1 +HETATM 34367 O O . HOH O 3 . ? -28.139 5.958 98.736 1.00 37.68 ? 2028 HOH C O 1 +HETATM 34368 O O . HOH O 3 . ? -31.929 3.299 73.848 1.00 28.30 ? 2029 HOH C O 1 +HETATM 34369 O O . HOH O 3 . ? -27.937 -14.900 75.333 1.00 31.72 ? 2030 HOH C O 1 +HETATM 34370 O O . HOH O 3 . ? -36.541 -0.903 83.131 1.00 31.63 ? 2031 HOH C O 1 +HETATM 34371 O O . HOH O 3 . ? -46.828 -3.582 79.086 1.00 41.56 ? 2032 HOH C O 1 +HETATM 34372 O O . HOH O 3 . ? -29.174 1.811 81.369 1.00 47.62 ? 2033 HOH C O 1 +HETATM 34373 O O . HOH O 3 . ? -17.722 -25.641 75.079 1.00 35.75 ? 2034 HOH C O 1 +HETATM 34374 O O . HOH O 3 . ? -18.386 -7.121 65.096 1.00 47.53 ? 2035 HOH C O 1 +HETATM 34375 O O . HOH O 3 . ? -20.835 -8.250 88.369 1.00 37.83 ? 2036 HOH C O 1 +HETATM 34376 O O . HOH O 3 . ? -22.997 -18.742 71.016 1.00 56.81 ? 2037 HOH C O 1 +HETATM 34377 O O . HOH O 3 . ? -19.759 21.877 77.148 1.00 44.44 ? 2038 HOH C O 1 +HETATM 34378 O O . HOH O 3 . ? -45.752 2.007 72.694 1.00 48.46 ? 2039 HOH C O 1 +HETATM 34379 O O . HOH O 3 . ? -6.589 -2.531 93.212 1.00 38.51 ? 2040 HOH C O 1 +HETATM 34380 O O . HOH O 3 . ? -32.047 -25.029 96.091 1.00 37.63 ? 2041 HOH C O 1 +HETATM 34381 O O . HOH O 3 . ? -27.160 -31.319 66.103 1.00 56.94 ? 2042 HOH C O 1 +HETATM 34382 O O . HOH O 3 . ? -16.222 -7.188 66.752 1.00 38.23 ? 2043 HOH C O 1 +HETATM 34383 O O . HOH O 3 . ? -27.497 -0.618 61.554 1.00 33.54 ? 2044 HOH C O 1 +HETATM 34384 O O . HOH O 3 . ? -20.444 -4.547 105.118 1.00 37.32 ? 2045 HOH C O 1 +HETATM 34385 O O . HOH O 3 . ? -34.767 1.445 60.023 1.00 39.72 ? 2046 HOH C O 1 +HETATM 34386 O O . HOH O 3 . ? -41.427 -9.401 61.863 1.00 42.38 ? 2047 HOH C O 1 +HETATM 34387 O O . HOH O 3 . ? -30.454 -21.680 106.074 1.00 45.23 ? 2048 HOH C O 1 +HETATM 34388 O O . HOH O 3 . ? -42.052 4.047 107.857 1.00 42.21 ? 2049 HOH C O 1 +HETATM 34389 O O . HOH O 3 . ? -46.236 -0.623 118.332 1.00 54.98 ? 2050 HOH C O 1 +HETATM 34390 O O . HOH O 3 . ? -33.176 -0.734 55.811 1.00 41.90 ? 2051 HOH C O 1 +HETATM 34391 O O . HOH O 3 . ? -29.207 -9.816 116.963 1.00 48.48 ? 2052 HOH C O 1 +HETATM 34392 O O . HOH O 3 . ? -41.369 -15.107 108.791 1.00 41.79 ? 2053 HOH C O 1 +HETATM 34393 O O . HOH O 3 . ? -24.572 3.260 115.003 1.00 41.19 ? 2054 HOH C O 1 +HETATM 34394 O O . HOH O 3 . ? -43.200 -5.184 68.892 1.00 34.80 ? 2055 HOH C O 1 +HETATM 34395 O O . HOH O 3 . ? -30.556 29.927 83.101 1.00 44.56 ? 2056 HOH C O 1 +HETATM 34396 O O . HOH O 3 . ? -21.891 22.521 81.619 1.00 38.77 ? 2057 HOH C O 1 +HETATM 34397 O O . HOH O 3 . ? -8.300 -6.722 68.911 1.00 52.84 ? 2058 HOH C O 1 +HETATM 34398 O O . HOH O 3 . ? -30.030 9.810 62.743 1.00 40.65 ? 2059 HOH C O 1 +HETATM 34399 O O . HOH O 3 . ? -15.577 -37.829 92.351 1.00 45.70 ? 2060 HOH C O 1 +HETATM 34400 O O . HOH O 3 . ? -45.702 -18.292 109.687 1.00 52.45 ? 2061 HOH C O 1 +HETATM 34401 O O . HOH O 3 . ? -28.103 23.696 86.147 1.00 37.70 ? 2062 HOH C O 1 +HETATM 34402 O O . HOH O 3 . ? -33.598 9.885 121.083 1.00 42.48 ? 2063 HOH C O 1 +HETATM 34403 O O . HOH O 3 . ? -25.002 -15.030 110.842 1.00 34.55 ? 2064 HOH C O 1 +HETATM 34404 O O . HOH O 3 . ? -35.518 -24.260 58.754 1.00 46.62 ? 2065 HOH C O 1 +HETATM 34405 O O . HOH O 3 . ? -32.151 -7.990 54.038 1.00 40.21 ? 2066 HOH C O 1 +HETATM 34406 O O . HOH O 3 . ? -27.889 15.423 73.451 1.00 34.40 ? 2067 HOH C O 1 +HETATM 34407 O O . HOH O 3 . ? -15.214 -3.039 88.056 1.00 39.39 ? 2068 HOH C O 1 +HETATM 34408 O O . HOH O 3 . ? -10.558 -10.091 96.613 1.00 32.84 ? 2069 HOH C O 1 +HETATM 34409 O O . HOH O 3 . ? -22.094 17.562 75.220 1.00 41.25 ? 2070 HOH C O 1 +HETATM 34410 O O . HOH O 3 . ? -37.956 23.162 81.267 1.00 45.86 ? 2071 HOH C O 1 +HETATM 34411 O O . HOH O 3 . ? -45.039 -20.944 83.300 1.00 38.82 ? 2072 HOH C O 1 +HETATM 34412 O O . HOH O 3 . ? -48.099 3.766 74.420 1.00 39.54 ? 2073 HOH C O 1 +HETATM 34413 O O . HOH O 3 . ? -39.446 20.061 83.950 1.00 45.62 ? 2074 HOH C O 1 +HETATM 34414 O O . HOH O 3 . ? -12.342 -20.483 77.181 1.00 40.55 ? 2075 HOH C O 1 +HETATM 34415 O O . HOH O 3 . ? -25.080 -33.179 73.266 1.00 39.05 ? 2076 HOH C O 1 +HETATM 34416 O O . HOH O 3 . ? -17.957 -0.832 112.569 1.00 49.49 ? 2077 HOH C O 1 +HETATM 34417 O O . HOH O 3 . ? -37.480 -23.882 86.975 1.00 41.63 ? 2078 HOH C O 1 +HETATM 34418 O O . HOH O 3 . ? -52.762 16.822 71.118 1.00 40.72 ? 2079 HOH C O 1 +HETATM 34419 O O . HOH O 3 . ? -37.920 -25.118 68.168 1.00 37.93 ? 2080 HOH C O 1 +HETATM 34420 O O . HOH O 3 . ? -25.151 1.958 79.833 1.00 44.22 ? 2081 HOH C O 1 +HETATM 34421 O O . HOH O 3 . ? -45.431 -11.066 76.570 1.00 50.91 ? 2082 HOH C O 1 +HETATM 34422 O O . HOH O 3 . ? -35.632 -28.748 90.832 1.00 35.84 ? 2083 HOH C O 1 +HETATM 34423 O O . HOH O 3 . ? -42.158 -8.462 65.480 1.00 45.70 ? 2084 HOH C O 1 +HETATM 34424 O O . HOH O 3 . ? -44.953 -4.503 70.581 1.00 33.49 ? 2085 HOH C O 1 +HETATM 34425 O O . HOH O 3 . ? -43.779 -10.912 83.308 1.00 51.04 ? 2086 HOH C O 1 +HETATM 34426 O O . HOH O 3 . ? -40.230 17.392 88.778 1.00 45.25 ? 2087 HOH C O 1 +HETATM 34427 O O . HOH O 3 . ? -6.207 -14.612 98.613 1.00 59.95 ? 2088 HOH C O 1 +HETATM 34428 O O . HOH O 3 . ? -31.262 4.602 123.061 1.00 52.38 ? 2089 HOH C O 1 +HETATM 34429 O O . HOH O 3 . ? -18.061 -5.437 106.489 1.00 53.36 ? 2090 HOH C O 1 +HETATM 34430 O O . HOH O 3 . ? -12.439 -7.627 105.632 1.00 49.41 ? 2091 HOH C O 1 +HETATM 34431 O O . HOH O 3 . ? -40.150 -3.874 96.874 1.00 39.05 ? 2092 HOH C O 1 +HETATM 34432 O O . HOH O 3 . ? -47.753 -19.881 109.523 1.00 46.32 ? 2093 HOH C O 1 +HETATM 34433 O O . HOH O 3 . ? -41.614 -28.126 83.825 1.00 41.24 ? 2094 HOH C O 1 +HETATM 34434 O O . HOH O 3 . ? -35.581 18.595 94.550 1.00 44.92 ? 2095 HOH C O 1 +HETATM 34435 O O . HOH O 3 . ? -25.106 -11.309 92.582 1.00 51.17 ? 2096 HOH C O 1 +HETATM 34436 O O . HOH P 3 . ? 24.442 -12.411 63.452 1.00 38.77 ? 2001 HOH D O 1 +HETATM 34437 O O . HOH P 3 . ? 28.350 -9.772 44.185 1.00 34.29 ? 2002 HOH D O 1 +HETATM 34438 O O . HOH P 3 . ? 25.940 -8.742 41.419 1.00 41.44 ? 2003 HOH D O 1 +HETATM 34439 O O . HOH P 3 . ? 26.665 -10.995 42.003 1.00 37.64 ? 2004 HOH D O 1 +HETATM 34440 O O . HOH P 3 . ? 26.411 -10.206 39.506 1.00 38.02 ? 2005 HOH D O 1 +HETATM 34441 O O . HOH P 3 . ? 36.987 4.964 26.318 1.00 33.05 ? 2006 HOH D O 1 +HETATM 34442 O O . HOH P 3 . ? 29.087 1.050 37.364 1.00 36.51 ? 2007 HOH D O 1 +HETATM 34443 O O . HOH P 3 . ? 21.638 26.290 39.028 1.00 30.18 ? 2008 HOH D O 1 +HETATM 34444 O O . HOH P 3 . ? 33.394 -3.189 59.624 1.00 30.47 ? 2009 HOH D O 1 +HETATM 34445 O O . HOH P 3 . ? 26.523 9.460 31.173 1.00 36.65 ? 2010 HOH D O 1 +HETATM 34446 O O . HOH P 3 . ? 22.377 9.028 36.954 1.00 38.55 ? 2011 HOH D O 1 +HETATM 34447 O O . HOH P 3 . ? 36.625 -1.570 67.017 1.00 28.01 ? 2012 HOH D O 1 +HETATM 34448 O O . HOH P 3 . ? 28.736 14.121 29.454 1.00 40.37 ? 2013 HOH D O 1 +HETATM 34449 O O . HOH P 3 . ? 25.097 1.223 47.847 1.00 34.63 ? 2014 HOH D O 1 +HETATM 34450 O O . HOH P 3 . ? 33.359 -13.276 53.453 1.00 34.45 ? 2015 HOH D O 1 +HETATM 34451 O O . HOH P 3 . ? 46.545 6.453 52.443 1.00 44.74 ? 2016 HOH D O 1 +HETATM 34452 O O . HOH P 3 . ? 29.006 1.810 6.780 1.00 35.87 ? 2017 HOH D O 1 +HETATM 34453 O O . HOH P 3 . ? 36.436 -7.485 26.979 1.00 39.15 ? 2018 HOH D O 1 +HETATM 34454 O O . HOH P 3 . ? 23.120 15.677 25.022 1.00 37.17 ? 2019 HOH D O 1 +HETATM 34455 O O . HOH P 3 . ? 23.208 -1.958 17.827 1.00 39.75 ? 2020 HOH D O 1 +HETATM 34456 O O . HOH P 3 . ? 26.231 2.568 6.705 1.00 33.62 ? 2021 HOH D O 1 +HETATM 34457 O O . HOH P 3 . ? 25.829 -31.382 30.262 1.00 46.48 ? 2022 HOH D O 1 +HETATM 34458 O O . HOH P 3 . ? 29.722 -17.493 36.886 1.00 35.62 ? 2023 HOH D O 1 +HETATM 34459 O O . HOH P 3 . ? 36.003 13.821 50.509 1.00 43.89 ? 2024 HOH D O 1 +HETATM 34460 O O . HOH P 3 . ? 21.002 11.168 19.463 1.00 51.68 ? 2025 HOH D O 1 +HETATM 34461 O O . HOH P 3 . ? 28.403 13.751 52.327 1.00 39.81 ? 2026 HOH D O 1 +HETATM 34462 O O . HOH P 3 . ? 19.700 -5.663 40.177 1.00 40.39 ? 2027 HOH D O 1 +HETATM 34463 O O . HOH P 3 . ? 18.418 -2.184 35.265 1.00 44.13 ? 2028 HOH D O 1 +HETATM 34464 O O . HOH P 3 . ? 28.157 10.876 20.313 1.00 36.59 ? 2029 HOH D O 1 +HETATM 34465 O O . HOH P 3 . ? 26.346 -6.413 40.247 1.00 39.85 ? 2030 HOH D O 1 +HETATM 34466 O O . HOH P 3 . ? 32.021 12.934 45.588 1.00 28.20 ? 2031 HOH D O 1 +HETATM 34467 O O . HOH P 3 . ? 34.438 -5.913 46.030 1.00 39.61 ? 2032 HOH D O 1 +HETATM 34468 O O . HOH P 3 . ? 38.180 9.894 36.566 1.00 37.96 ? 2033 HOH D O 1 +HETATM 34469 O O . HOH P 3 . ? 23.528 -16.728 30.114 1.00 35.40 ? 2034 HOH D O 1 +HETATM 34470 O O . HOH P 3 . ? 47.753 10.997 40.253 1.00 28.22 ? 2035 HOH D O 1 +HETATM 34471 O O . HOH P 3 . ? 46.653 -12.189 35.203 1.00 35.16 ? 2036 HOH D O 1 +HETATM 34472 O O . HOH P 3 . ? 39.873 1.269 60.937 1.00 38.36 ? 2037 HOH D O 1 +HETATM 34473 O O . HOH P 3 . ? 28.656 -19.166 47.594 1.00 29.43 ? 2038 HOH D O 1 +HETATM 34474 O O . HOH P 3 . ? 39.081 17.390 21.982 1.00 30.50 ? 2039 HOH D O 1 +HETATM 34475 O O . HOH P 3 . ? 30.961 -10.433 50.677 1.00 42.99 ? 2040 HOH D O 1 +HETATM 34476 O O . HOH P 3 . ? 14.288 25.767 39.766 1.00 40.88 ? 2041 HOH D O 1 +HETATM 34477 O O . HOH P 3 . ? 6.296 -7.223 36.945 1.00 37.94 ? 2042 HOH D O 1 +HETATM 34478 O O . HOH P 3 . ? 48.516 -5.263 32.511 1.00 42.01 ? 2043 HOH D O 1 +HETATM 34479 O O . HOH P 3 . ? 31.583 31.967 34.481 1.00 48.25 ? 2044 HOH D O 1 +HETATM 34480 O O . HOH P 3 . ? 39.298 -20.118 57.125 1.00 47.90 ? 2045 HOH D O 1 +HETATM 34481 O O . HOH P 3 . ? 45.220 6.724 54.515 1.00 32.03 ? 2046 HOH D O 1 +HETATM 34482 O O . HOH P 3 . ? 28.703 9.197 57.857 1.00 41.41 ? 2047 HOH D O 1 +HETATM 34483 O O . HOH P 3 . ? 24.693 -1.919 15.323 1.00 44.00 ? 2048 HOH D O 1 +HETATM 34484 O O . HOH P 3 . ? 50.527 -6.296 29.477 1.00 44.79 ? 2049 HOH D O 1 +HETATM 34485 O O . HOH P 3 . ? 16.922 17.758 39.377 1.00 42.53 ? 2050 HOH D O 1 +HETATM 34486 O O . HOH P 3 . ? 36.734 -1.096 3.114 1.00 40.88 ? 2051 HOH D O 1 +HETATM 34487 O O . HOH P 3 . ? 17.509 23.091 42.158 1.00 36.43 ? 2052 HOH D O 1 +HETATM 34488 O O . HOH P 3 . ? 38.835 11.861 0.275 1.00 46.45 ? 2053 HOH D O 1 +HETATM 34489 O O . HOH P 3 . ? 17.523 -3.616 48.638 1.00 55.56 ? 2054 HOH D O 1 +HETATM 34490 O O . HOH P 3 . ? 28.475 13.756 20.584 1.00 44.18 ? 2055 HOH D O 1 +HETATM 34491 O O . HOH P 3 . ? 19.660 5.267 42.388 1.00 40.26 ? 2056 HOH D O 1 +HETATM 34492 O O . HOH P 3 . ? 31.184 18.877 12.780 1.00 39.21 ? 2057 HOH D O 1 +HETATM 34493 O O . HOH P 3 . ? 20.966 11.189 12.981 1.00 42.11 ? 2058 HOH D O 1 +HETATM 34494 O O . HOH P 3 . ? 22.454 17.731 11.836 1.00 36.75 ? 2059 HOH D O 1 +HETATM 34495 O O . HOH P 3 . ? 42.219 13.054 11.193 1.00 52.75 ? 2060 HOH D O 1 +HETATM 34496 O O . HOH P 3 . ? 25.339 15.886 52.948 1.00 38.66 ? 2061 HOH D O 1 +HETATM 34497 O O . HOH P 3 . ? 49.249 -8.199 25.895 1.00 35.00 ? 2062 HOH D O 1 +HETATM 34498 O O . HOH P 3 . ? 39.052 -4.747 5.412 1.00 41.28 ? 2063 HOH D O 1 +HETATM 34499 O O . HOH P 3 . ? 47.937 9.903 44.834 1.00 37.16 ? 2064 HOH D O 1 +HETATM 34500 O O . HOH P 3 . ? 47.359 -10.896 54.058 1.00 36.08 ? 2065 HOH D O 1 +HETATM 34501 O O . HOH P 3 . ? 42.924 6.486 23.398 1.00 34.31 ? 2066 HOH D O 1 +HETATM 34502 O O . HOH P 3 . ? 49.087 2.841 43.781 1.00 45.91 ? 2067 HOH D O 1 +HETATM 34503 O O . HOH P 3 . ? 32.778 -11.405 10.604 1.00 37.22 ? 2068 HOH D O 1 +HETATM 34504 O O . HOH P 3 . ? 18.705 -0.431 32.011 1.00 32.55 ? 2069 HOH D O 1 +HETATM 34505 O O . HOH P 3 . ? 26.363 8.499 39.332 1.00 35.12 ? 2070 HOH D O 1 +HETATM 34506 O O . HOH P 3 . ? 22.188 24.370 45.296 1.00 49.38 ? 2071 HOH D O 1 +HETATM 34507 O O . HOH P 3 . ? 19.132 14.548 22.473 1.00 56.32 ? 2072 HOH D O 1 +HETATM 34508 O O . HOH P 3 . ? 50.118 -0.368 34.122 1.00 46.92 ? 2073 HOH D O 1 +HETATM 34509 O O . HOH P 3 . ? 25.164 16.861 50.059 1.00 41.28 ? 2074 HOH D O 1 +HETATM 34510 O O . HOH P 3 . ? 37.238 18.777 19.802 1.00 39.91 ? 2075 HOH D O 1 +HETATM 34511 O O . HOH P 3 . ? 48.207 7.399 45.684 1.00 37.71 ? 2076 HOH D O 1 +HETATM 34512 O O . HOH P 3 . ? 21.587 -0.206 7.691 1.00 41.94 ? 2077 HOH D O 1 +HETATM 34513 O O . HOH P 3 . ? 22.114 36.037 33.038 1.00 45.41 ? 2078 HOH D O 1 +HETATM 34514 O O . HOH P 3 . ? 46.768 10.516 49.099 1.00 34.14 ? 2079 HOH D O 1 +HETATM 34515 O O . HOH P 3 . ? 16.459 8.844 40.805 1.00 36.92 ? 2080 HOH D O 1 +HETATM 34516 O O . HOH P 3 . ? 37.995 -23.224 50.094 1.00 40.49 ? 2081 HOH D O 1 +HETATM 34517 O O . HOH P 3 . ? 33.901 28.490 32.529 1.00 46.50 ? 2082 HOH D O 1 +HETATM 34518 O O . HOH P 3 . ? 40.618 27.055 28.676 1.00 35.14 ? 2083 HOH D O 1 +HETATM 34519 O O . HOH P 3 . ? 25.511 5.584 4.648 1.00 41.77 ? 2084 HOH D O 1 +HETATM 34520 O O . HOH P 3 . ? 15.472 7.539 24.795 1.00 45.08 ? 2085 HOH D O 1 +HETATM 34521 O O . HOH P 3 . ? 48.625 0.120 44.379 1.00 42.08 ? 2086 HOH D O 1 +HETATM 34522 O O . HOH P 3 . ? 22.543 -0.152 55.905 1.00 52.01 ? 2087 HOH D O 1 +HETATM 34523 O O . HOH P 3 . ? 24.890 -13.360 25.165 1.00 46.82 ? 2088 HOH D O 1 +HETATM 34524 O O . HOH P 3 . ? 47.033 -17.242 35.891 1.00 50.52 ? 2089 HOH D O 1 +HETATM 34525 O O . HOH P 3 . ? 48.932 11.224 50.485 1.00 49.53 ? 2090 HOH D O 1 +HETATM 34526 O O . HOH P 3 . ? 35.529 27.299 28.329 1.00 41.25 ? 2091 HOH D O 1 +HETATM 34527 O O . HOH P 3 . ? 38.673 18.820 49.126 1.00 43.37 ? 2092 HOH D O 1 +HETATM 34528 O O . HOH P 3 . ? 20.297 10.398 15.418 1.00 48.47 ? 2093 HOH D O 1 +HETATM 34529 O O . HOH P 3 . ? 38.185 15.885 5.289 1.00 47.56 ? 2094 HOH D O 1 +HETATM 34530 O O . HOH P 3 . ? 17.903 -20.322 12.617 1.00 34.43 ? 2095 HOH D O 1 +HETATM 34531 O O . HOH P 3 . ? 37.047 29.277 35.055 1.00 44.04 ? 2096 HOH D O 1 +HETATM 34532 O O . HOH P 3 . ? 36.291 -17.861 14.699 1.00 41.17 ? 2097 HOH D O 1 +HETATM 34533 O O . HOH P 3 . ? 34.511 11.246 63.638 1.00 43.71 ? 2098 HOH D O 1 +HETATM 34534 O O . HOH P 3 . ? 24.516 22.886 44.112 1.00 39.63 ? 2099 HOH D O 1 +HETATM 34535 O O . HOH P 3 . ? 57.343 4.194 19.261 1.00 55.44 ? 2100 HOH D O 1 +HETATM 34536 O O . HOH P 3 . ? 31.494 -30.567 38.440 1.00 38.59 ? 2101 HOH D O 1 +HETATM 34537 O O . HOH P 3 . ? 51.095 -2.502 34.940 1.00 59.96 ? 2102 HOH D O 1 +HETATM 34538 O O . HOH P 3 . ? 25.799 12.898 53.628 1.00 52.48 ? 2103 HOH D O 1 +HETATM 34539 O O . HOH Q 3 . ? 1.756 28.809 58.576 1.00 31.93 ? 2001 HOH E O 1 +HETATM 34540 O O . HOH Q 3 . ? 1.649 27.351 38.663 1.00 33.50 ? 2002 HOH E O 1 +HETATM 34541 O O . HOH Q 3 . ? 2.412 24.325 36.518 1.00 35.79 ? 2003 HOH E O 1 +HETATM 34542 O O . HOH Q 3 . ? 3.945 26.166 37.107 1.00 42.56 ? 2004 HOH E O 1 +HETATM 34543 O O . HOH Q 3 . ? 3.870 25.051 34.682 1.00 35.10 ? 2005 HOH E O 1 +HETATM 34544 O O . HOH Q 3 . ? -11.498 24.052 17.948 1.00 30.46 ? 2006 HOH E O 1 +HETATM 34545 O O . HOH Q 3 . ? -6.654 21.401 30.942 1.00 34.73 ? 2007 HOH E O 1 +HETATM 34546 O O . HOH Q 3 . ? -25.387 2.813 32.318 1.00 29.77 ? 2008 HOH E O 1 +HETATM 34547 O O . HOH Q 3 . ? -9.442 31.214 51.645 1.00 29.95 ? 2009 HOH E O 1 +HETATM 34548 O O . HOH Q 3 . ? -11.489 13.880 24.944 1.00 31.81 ? 2010 HOH E O 1 +HETATM 34549 O O . HOH Q 3 . ? -10.430 11.618 31.632 1.00 35.94 ? 2011 HOH E O 1 +HETATM 34550 O O . HOH Q 3 . ? -13.858 34.570 57.835 1.00 33.81 ? 2012 HOH E O 1 +HETATM 34551 O O . HOH Q 3 . ? -16.248 13.100 22.342 1.00 31.49 ? 2013 HOH E O 1 +HETATM 34552 O O . HOH Q 3 . ? -7.140 19.817 42.100 1.00 34.04 ? 2014 HOH E O 1 +HETATM 34553 O O . HOH Q 3 . ? 0.488 35.021 46.528 1.00 28.31 ? 2015 HOH E O 1 +HETATM 34554 O O . HOH Q 3 . ? -22.368 36.271 40.589 1.00 41.65 ? 2016 HOH E O 1 +HETATM 34555 O O . HOH Q 3 . ? -1.210 15.333 1.464 1.00 37.40 ? 2017 HOH E O 1 +HETATM 34556 O O . HOH Q 3 . ? -0.612 29.956 19.820 1.00 40.36 ? 2018 HOH E O 1 +HETATM 34557 O O . HOH Q 3 . ? -14.110 6.761 19.415 1.00 38.54 ? 2019 HOH E O 1 +HETATM 34558 O O . HOH Q 3 . ? 2.508 14.285 13.909 1.00 41.57 ? 2020 HOH E O 1 +HETATM 34559 O O . HOH Q 3 . ? -0.603 12.570 2.066 1.00 38.82 ? 2021 HOH E O 1 +HETATM 34560 O O . HOH Q 3 . ? 24.185 33.410 27.659 1.00 46.38 ? 2022 HOH E O 1 +HETATM 34561 O O . HOH Q 3 . ? 9.145 30.977 31.886 1.00 26.29 ? 2023 HOH E O 1 +HETATM 34562 O O . HOH Q 3 . ? -23.527 23.277 40.766 1.00 38.43 ? 2024 HOH E O 1 +HETATM 34563 O O . HOH Q 3 . ? -8.853 27.117 57.921 1.00 40.40 ? 2025 HOH E O 1 +HETATM 34564 O O . HOH Q 3 . ? -8.087 6.192 14.933 1.00 49.31 ? 2026 HOH E O 1 +HETATM 34565 O O . HOH Q 3 . ? -20.340 17.239 44.474 1.00 37.61 ? 2027 HOH E O 1 +HETATM 34566 O O . HOH Q 3 . ? 2.911 17.246 36.651 1.00 46.27 ? 2028 HOH E O 1 +HETATM 34567 O O . HOH Q 3 . ? -1.084 18.636 36.564 1.00 39.87 ? 2029 HOH E O 1 +HETATM 34568 O O . HOH Q 3 . ? 1.345 13.377 32.087 1.00 44.25 ? 2030 HOH E O 1 +HETATM 34569 O O . HOH Q 3 . ? -11.394 12.469 13.990 1.00 34.53 ? 2031 HOH E O 1 +HETATM 34570 O O . HOH Q 3 . ? -19.822 19.373 36.903 1.00 33.91 ? 2032 HOH E O 1 +HETATM 34571 O O . HOH Q 3 . ? -4.958 30.925 38.606 1.00 37.26 ? 2033 HOH E O 1 +HETATM 34572 O O . HOH Q 3 . ? -18.385 24.702 26.781 1.00 35.25 ? 2034 HOH E O 1 +HETATM 34573 O O . HOH Q 3 . ? 12.582 24.173 26.852 1.00 30.27 ? 2035 HOH E O 1 +HETATM 34574 O O . HOH Q 3 . ? -24.374 34.158 32.397 1.00 32.27 ? 2036 HOH E O 1 +HETATM 34575 O O . HOH Q 3 . ? -14.728 18.048 30.739 1.00 35.28 ? 2037 HOH E O 1 +HETATM 34576 O O . HOH Q 3 . ? -2.964 42.595 25.494 1.00 37.58 ? 2038 HOH E O 1 +HETATM 34577 O O . HOH Q 3 . ? -16.011 34.551 51.144 1.00 30.01 ? 2039 HOH E O 1 +HETATM 34578 O O . HOH Q 3 . ? 9.153 32.845 42.732 1.00 34.57 ? 2040 HOH E O 1 +HETATM 34579 O O . HOH Q 3 . ? -0.658 19.941 27.213 1.00 42.64 ? 2041 HOH E O 1 +HETATM 34580 O O . HOH Q 3 . ? 1.907 31.492 43.252 1.00 43.81 ? 2042 HOH E O 1 +HETATM 34581 O O . HOH Q 3 . ? -31.863 29.062 31.489 1.00 52.59 ? 2043 HOH E O 1 +HETATM 34582 O O . HOH Q 3 . ? 7.666 6.570 23.642 1.00 33.41 ? 2044 HOH E O 1 +HETATM 34583 O O . HOH Q 3 . ? -9.089 40.302 21.974 1.00 32.12 ? 2045 HOH E O 1 +HETATM 34584 O O . HOH Q 3 . ? -34.603 7.134 25.817 1.00 36.38 ? 2046 HOH E O 1 +HETATM 34585 O O . HOH Q 3 . ? -22.468 36.178 36.030 1.00 47.33 ? 2047 HOH E O 1 +HETATM 34586 O O . HOH Q 3 . ? 4.087 39.415 18.843 1.00 38.94 ? 2048 HOH E O 1 +HETATM 34587 O O . HOH Q 3 . ? 2.905 44.138 49.056 1.00 45.23 ? 2049 HOH E O 1 +HETATM 34588 O O . HOH Q 3 . ? -22.214 16.106 10.113 1.00 34.42 ? 2050 HOH E O 1 +HETATM 34589 O O . HOH Q 3 . ? -15.633 3.134 20.231 1.00 43.77 ? 2051 HOH E O 1 +HETATM 34590 O O . HOH Q 3 . ? -17.223 20.812 50.055 1.00 49.36 ? 2052 HOH E O 1 +HETATM 34591 O O . HOH Q 3 . ? 2.281 14.813 11.156 1.00 36.22 ? 2053 HOH E O 1 +HETATM 34592 O O . HOH Q 3 . ? 15.505 26.325 27.642 1.00 55.57 ? 2054 HOH E O 1 +HETATM 34593 O O . HOH Q 3 . ? -24.166 24.195 49.835 1.00 42.31 ? 2055 HOH E O 1 +HETATM 34594 O O . HOH Q 3 . ? -12.250 15.631 33.266 1.00 46.95 ? 2056 HOH E O 1 +HETATM 34595 O O . HOH Q 3 . ? -22.294 36.375 46.742 1.00 30.39 ? 2057 HOH E O 1 +HETATM 34596 O O . HOH Q 3 . ? 6.268 34.079 9.027 1.00 39.35 ? 2058 HOH E O 1 +HETATM 34597 O O . HOH Q 3 . ? -14.699 38.554 -14.138 1.00 36.18 ? 2059 HOH E O 1 +HETATM 34598 O O . HOH Q 3 . ? 9.440 37.194 15.960 1.00 22.21 ? 2060 HOH E O 1 +HETATM 34599 O O . HOH Q 3 . ? -31.247 5.623 22.754 1.00 48.64 ? 2061 HOH E O 1 +HETATM 34600 O O . HOH Q 3 . ? -11.507 11.189 -9.458 1.00 48.99 ? 2062 HOH E O 1 +HETATM 34601 O O . HOH Q 3 . ? -2.576 29.934 -3.835 1.00 45.49 ? 2063 HOH E O 1 +HETATM 34602 O O . HOH Q 3 . ? -20.981 12.189 43.020 1.00 34.53 ? 2064 HOH E O 1 +HETATM 34603 O O . HOH Q 3 . ? 8.576 17.034 35.290 1.00 46.68 ? 2065 HOH E O 1 +HETATM 34604 O O . HOH Q 3 . ? -34.322 14.063 24.432 1.00 32.39 ? 2066 HOH E O 1 +HETATM 34605 O O . HOH Q 3 . ? 0.284 14.908 45.636 1.00 39.83 ? 2067 HOH E O 1 +HETATM 34606 O O . HOH Q 3 . ? -12.879 19.762 -10.004 1.00 39.06 ? 2068 HOH E O 1 +HETATM 34607 O O . HOH Q 3 . ? -13.007 17.499 -7.782 1.00 37.17 ? 2069 HOH E O 1 +HETATM 34608 O O . HOH Q 3 . ? -6.798 5.101 8.477 1.00 37.57 ? 2070 HOH E O 1 +HETATM 34609 O O . HOH Q 3 . ? -18.051 21.597 1.278 1.00 45.12 ? 2071 HOH E O 1 +HETATM 34610 O O . HOH Q 3 . ? -15.326 33.829 9.557 1.00 41.97 ? 2072 HOH E O 1 +HETATM 34611 O O . HOH Q 3 . ? 0.485 12.289 28.892 1.00 36.24 ? 2073 HOH E O 1 +HETATM 34612 O O . HOH Q 3 . ? -10.885 3.834 18.069 1.00 48.92 ? 2074 HOH E O 1 +HETATM 34613 O O . HOH Q 3 . ? -2.794 10.227 -0.184 1.00 42.80 ? 2075 HOH E O 1 +HETATM 34614 O O . HOH Q 3 . ? -15.028 26.457 7.316 1.00 35.28 ? 2076 HOH E O 1 +HETATM 34615 O O . HOH Q 3 . ? 8.724 18.231 8.370 1.00 47.61 ? 2077 HOH E O 1 +HETATM 34616 O O . HOH Q 3 . ? 8.645 21.301 25.251 1.00 44.48 ? 2078 HOH E O 1 +HETATM 34617 O O . HOH Q 3 . ? -17.496 36.442 55.176 1.00 44.71 ? 2079 HOH E O 1 +HETATM 34618 O O . HOH Q 3 . ? -3.220 45.369 46.722 1.00 42.59 ? 2080 HOH E O 1 +HETATM 34619 O O . HOH Q 3 . ? -6.790 41.046 0.633 1.00 54.45 ? 2081 HOH E O 1 +HETATM 34620 O O . HOH Q 3 . ? -25.558 33.922 36.921 1.00 36.91 ? 2082 HOH E O 1 +HETATM 34621 O O . HOH Q 3 . ? 4.726 5.339 23.466 1.00 31.46 ? 2083 HOH E O 1 +HETATM 34622 O O . HOH Q 3 . ? 2.153 15.400 -8.384 1.00 42.62 ? 2084 HOH E O 1 +HETATM 34623 O O . HOH Q 3 . ? 20.626 42.122 48.281 1.00 42.16 ? 2085 HOH E O 1 +HETATM 34624 O O . HOH Q 3 . ? -14.505 25.636 -9.357 1.00 47.85 ? 2086 HOH E O 1 +HETATM 34625 O O . HOH Q 3 . ? -11.897 28.449 23.646 1.00 46.21 ? 2087 HOH E O 1 +HETATM 34626 O O . HOH Q 3 . ? 3.750 10.168 4.133 1.00 31.71 ? 2088 HOH E O 1 +HETATM 34627 O O . HOH Q 3 . ? -21.208 1.789 36.801 1.00 36.19 ? 2089 HOH E O 1 +HETATM 34628 O O . HOH Q 3 . ? -24.634 7.869 37.009 1.00 29.95 ? 2090 HOH E O 1 +HETATM 34629 O O . HOH Q 3 . ? -28.684 23.059 38.313 1.00 37.92 ? 2091 HOH E O 1 +HETATM 34630 O O . HOH Q 3 . ? -39.494 9.893 35.013 1.00 34.79 ? 2092 HOH E O 1 +HETATM 34631 O O . HOH Q 3 . ? 7.049 25.498 5.325 1.00 31.87 ? 2093 HOH E O 1 +HETATM 34632 O O . HOH Q 3 . ? 0.782 45.761 26.243 1.00 37.30 ? 2094 HOH E O 1 +HETATM 34633 O O . HOH Q 3 . ? -12.981 16.949 35.563 1.00 44.99 ? 2095 HOH E O 1 +HETATM 34634 O O . HOH Q 3 . ? -12.495 24.239 -8.696 1.00 49.11 ? 2096 HOH E O 1 +HETATM 34635 O O . HOH Q 3 . ? -32.106 16.783 17.885 1.00 35.73 ? 2097 HOH E O 1 +HETATM 34636 O O . HOH Q 3 . ? -24.719 5.346 38.027 1.00 43.31 ? 2098 HOH E O 1 +HETATM 34637 O O . HOH Q 3 . ? -29.572 29.003 34.362 1.00 40.91 ? 2099 HOH E O 1 +HETATM 34638 O O . HOH Q 3 . ? -0.550 43.767 18.672 1.00 47.70 ? 2100 HOH E O 1 +HETATM 34639 O O . HOH Q 3 . ? -17.589 43.677 -4.147 1.00 41.56 ? 2101 HOH E O 1 +HETATM 34640 O O . HOH Q 3 . ? -17.324 27.723 6.099 1.00 46.42 ? 2102 HOH E O 1 +HETATM 34641 O O . HOH Q 3 . ? 16.100 39.979 18.014 1.00 43.17 ? 2103 HOH E O 1 +HETATM 34642 O O . HOH Q 3 . ? -26.425 7.635 14.076 1.00 42.15 ? 2104 HOH E O 1 +HETATM 34643 O O . HOH Q 3 . ? -26.114 -0.023 24.079 1.00 34.02 ? 2105 HOH E O 1 +HETATM 34644 O O . HOH Q 3 . ? -23.615 25.430 53.983 1.00 47.23 ? 2106 HOH E O 1 +HETATM 34645 O O . HOH Q 3 . ? 1.356 40.418 -4.678 1.00 37.93 ? 2107 HOH E O 1 +HETATM 34646 O O . HOH Q 3 . ? 18.903 43.561 33.867 1.00 55.87 ? 2108 HOH E O 1 +HETATM 34647 O O . HOH Q 3 . ? -15.635 3.369 34.473 1.00 38.08 ? 2109 HOH E O 1 +HETATM 34648 O O . HOH Q 3 . ? 5.385 31.464 6.567 1.00 39.37 ? 2110 HOH E O 1 +HETATM 34649 O O . HOH Q 3 . ? 0.253 44.884 57.974 1.00 37.53 ? 2111 HOH E O 1 +HETATM 34650 O O . HOH Q 3 . ? 10.008 12.713 13.206 1.00 40.89 ? 2112 HOH E O 1 +HETATM 34651 O O . HOH Q 3 . ? -7.034 19.120 -14.519 1.00 47.02 ? 2113 HOH E O 1 +HETATM 34652 O O . HOH Q 3 . ? -2.238 6.905 23.690 1.00 49.75 ? 2114 HOH E O 1 +HETATM 34653 O O . HOH Q 3 . ? -10.094 3.085 8.526 1.00 39.76 ? 2115 HOH E O 1 +HETATM 34654 O O . HOH Q 3 . ? 11.440 5.657 22.060 1.00 57.04 ? 2116 HOH E O 1 +HETATM 34655 O O . HOH Q 3 . ? 7.066 38.590 16.748 1.00 34.58 ? 2117 HOH E O 1 +HETATM 34656 O O . HOH Q 3 . ? -26.586 31.906 53.129 1.00 43.54 ? 2118 HOH E O 1 +HETATM 34657 O O . HOH Q 3 . ? -30.431 12.230 18.736 1.00 41.55 ? 2119 HOH E O 1 +HETATM 34658 O O . HOH Q 3 . ? 0.393 34.735 9.018 1.00 43.63 ? 2120 HOH E O 1 +HETATM 34659 O O . HOH Q 3 . ? -24.324 7.803 12.443 1.00 37.33 ? 2121 HOH E O 1 +HETATM 34660 O O . HOH Q 3 . ? -22.725 35.822 33.327 1.00 47.61 ? 2122 HOH E O 1 +HETATM 34661 O O . HOH Q 3 . ? -20.544 40.427 46.554 1.00 37.07 ? 2123 HOH E O 1 +HETATM 34662 O O . HOH Q 3 . ? -1.967 6.686 12.221 1.00 34.41 ? 2124 HOH E O 1 +HETATM 34663 O O . HOH Q 3 . ? -44.577 21.240 35.227 1.00 62.32 ? 2125 HOH E O 1 +HETATM 34664 O O . HOH Q 3 . ? -14.195 21.855 -9.242 1.00 51.66 ? 2126 HOH E O 1 +HETATM 34665 O O . HOH Q 3 . ? -18.531 25.206 9.666 1.00 52.41 ? 2127 HOH E O 1 +HETATM 34666 O O . HOH R 3 . ? -22.589 -11.675 56.171 1.00 39.58 ? 2001 HOH F O 1 +HETATM 34667 O O . HOH R 3 . ? -17.071 -14.760 37.196 1.00 32.06 ? 2002 HOH F O 1 +HETATM 34668 O O . HOH R 3 . ? -14.343 -13.039 35.211 1.00 37.22 ? 2003 HOH F O 1 +HETATM 34669 O O . HOH R 3 . ? -16.747 -12.529 35.193 1.00 32.83 ? 2004 HOH F O 1 +HETATM 34670 O O . HOH R 3 . ? -15.265 -12.516 32.948 1.00 33.23 ? 2005 HOH F O 1 +HETATM 34671 O O . HOH R 3 . ? -3.771 -28.240 21.231 1.00 30.66 ? 2006 HOH F O 1 +HETATM 34672 O O . HOH R 3 . ? -6.457 -20.321 32.616 1.00 31.57 ? 2007 HOH F O 1 +HETATM 34673 O O . HOH R 3 . ? 17.949 -26.442 40.575 1.00 27.49 ? 2008 HOH F O 1 +HETATM 34674 O O . HOH R 3 . ? -17.901 -23.470 52.401 1.00 25.85 ? 2009 HOH F O 1 +HETATM 34675 O O . HOH R 3 . ? 3.535 -21.755 28.841 1.00 33.44 ? 2010 HOH F O 1 +HETATM 34676 O O . HOH R 3 . ? 3.564 -18.398 35.115 1.00 31.69 ? 2011 HOH F O 1 +HETATM 34677 O O . HOH R 3 . ? -20.054 -27.650 59.271 1.00 28.89 ? 2012 HOH F O 1 +HETATM 34678 O O . HOH R 3 . ? 6.934 -25.868 27.702 1.00 34.04 ? 2013 HOH F O 1 +HETATM 34679 O O . HOH R 3 . ? -7.186 -17.620 43.523 1.00 26.93 ? 2014 HOH F O 1 +HETATM 34680 O O . HOH R 3 . ? -24.710 -17.993 44.438 1.00 29.04 ? 2015 HOH F O 1 +HETATM 34681 O O . HOH R 3 . ? -13.892 -39.144 44.897 1.00 37.75 ? 2016 HOH F O 1 +HETATM 34682 O O . HOH R 3 . ? 2.370 -18.447 3.392 1.00 40.06 ? 2017 HOH F O 1 +HETATM 34683 O O . HOH R 3 . ? -14.310 -21.676 19.532 1.00 36.46 ? 2018 HOH F O 1 +HETATM 34684 O O . HOH R 3 . ? 11.997 -21.430 24.804 1.00 43.73 ? 2019 HOH F O 1 +HETATM 34685 O O . HOH R 3 . ? -1.052 -12.290 14.367 1.00 43.96 ? 2020 HOH F O 1 +HETATM 34686 O O . HOH R 3 . ? 4.329 -16.395 4.027 1.00 36.88 ? 2021 HOH F O 1 +HETATM 34687 O O . HOH R 3 . ? -30.418 -0.942 20.008 1.00 44.52 ? 2022 HOH F O 1 +HETATM 34688 O O . HOH R 3 . ? -22.221 -11.624 28.372 1.00 28.39 ? 2023 HOH F O 1 +HETATM 34689 O O . HOH R 3 . ? -2.261 -33.492 46.502 1.00 41.18 ? 2024 HOH F O 1 +HETATM 34690 O O . HOH R 3 . ? 10.634 -17.020 18.925 1.00 47.68 ? 2025 HOH F O 1 +HETATM 34691 O O . HOH R 3 . ? 0.659 -27.006 49.646 1.00 33.22 ? 2026 HOH F O 1 +HETATM 34692 O O . HOH R 3 . ? -8.527 -8.957 35.776 1.00 42.77 ? 2027 HOH F O 1 +HETATM 34693 O O . HOH R 3 . ? -7.738 -12.967 36.724 1.00 34.34 ? 2028 HOH F O 1 +HETATM 34694 O O . HOH R 3 . ? -11.128 -13.804 30.783 1.00 42.40 ? 2029 HOH F O 1 +HETATM 34695 O O . HOH R 3 . ? -3.439 -9.346 31.786 1.00 43.49 ? 2030 HOH F O 1 +HETATM 34696 O O . HOH R 3 . ? 7.023 -23.113 18.599 1.00 30.66 ? 2031 HOH F O 1 +HETATM 34697 O O . HOH R 3 . ? -21.996 -3.373 35.067 1.00 32.43 ? 2032 HOH F O 1 +HETATM 34698 O O . HOH R 3 . ? 0.118 -29.199 41.981 1.00 36.27 ? 2033 HOH F O 1 +HETATM 34699 O O . HOH R 3 . ? -3.094 -32.516 31.734 1.00 31.91 ? 2034 HOH F O 1 +HETATM 34700 O O . HOH R 3 . ? -16.943 -6.110 23.116 1.00 38.82 ? 2035 HOH F O 1 +HETATM 34701 O O . HOH R 3 . ? -7.338 -41.820 34.034 1.00 36.37 ? 2036 HOH F O 1 +HETATM 34702 O O . HOH R 3 . ? 0.320 -25.212 35.084 1.00 43.73 ? 2037 HOH F O 1 +HETATM 34703 O O . HOH R 3 . ? -25.102 -28.856 24.624 1.00 37.90 ? 2038 HOH F O 1 +HETATM 34704 O O . HOH R 3 . ? -25.959 -10.760 38.199 1.00 34.86 ? 2039 HOH F O 1 +HETATM 34705 O O . HOH R 3 . ? 6.999 -36.030 19.262 1.00 29.59 ? 2040 HOH F O 1 +HETATM 34706 O O . HOH R 3 . ? -21.574 -15.334 41.075 1.00 33.44 ? 2041 HOH F O 1 +HETATM 34707 O O . HOH R 3 . ? 1.076 -2.369 22.707 1.00 31.87 ? 2042 HOH F O 1 +HETATM 34708 O O . HOH R 3 . ? -19.355 -33.698 22.805 1.00 29.05 ? 2043 HOH F O 1 +HETATM 34709 O O . HOH R 3 . ? -23.928 -22.778 16.422 1.00 28.27 ? 2044 HOH F O 1 +HETATM 34710 O O . HOH R 3 . ? -34.308 -19.992 45.356 1.00 44.79 ? 2045 HOH F O 1 +HETATM 34711 O O . HOH R 3 . ? -9.069 -12.851 49.685 1.00 22.00 ? 2046 HOH F O 1 +HETATM 34712 O O . HOH R 3 . ? 10.193 -38.507 15.530 1.00 55.87 ? 2047 HOH F O 1 +HETATM 34713 O O . HOH R 3 . ? -17.084 -38.937 48.442 1.00 40.64 ? 2048 HOH F O 1 +HETATM 34714 O O . HOH R 3 . ? -1.307 -10.677 10.461 1.00 45.64 ? 2049 HOH F O 1 +HETATM 34715 O O . HOH R 3 . ? -4.336 -32.749 55.258 1.00 31.78 ? 2050 HOH F O 1 +HETATM 34716 O O . HOH R 3 . ? -0.396 -22.662 39.601 1.00 47.28 ? 2051 HOH F O 1 +HETATM 34717 O O . HOH R 3 . ? -15.318 -37.978 50.198 1.00 31.82 ? 2052 HOH F O 1 +HETATM 34718 O O . HOH R 3 . ? -18.378 -20.068 6.812 1.00 44.01 ? 2053 HOH F O 1 +HETATM 34719 O O . HOH R 3 . ? -3.738 -46.076 -12.829 1.00 51.63 ? 2054 HOH F O 1 +HETATM 34720 O O . HOH R 3 . ? -4.412 -33.973 17.597 1.00 31.52 ? 2055 HOH F O 1 +HETATM 34721 O O . HOH R 3 . ? -16.554 -36.202 1.659 1.00 26.72 ? 2056 HOH F O 1 +HETATM 34722 O O . HOH R 3 . ? -10.808 -30.627 -13.298 1.00 30.01 ? 2057 HOH F O 1 +HETATM 34723 O O . HOH R 3 . ? 7.905 -31.181 -2.442 1.00 28.85 ? 2058 HOH F O 1 +HETATM 34724 O O . HOH R 3 . ? 5.905 -25.277 48.780 1.00 32.25 ? 2059 HOH F O 1 +HETATM 34725 O O . HOH R 3 . ? -1.762 -10.082 29.268 1.00 34.28 ? 2060 HOH F O 1 +HETATM 34726 O O . HOH R 3 . ? -20.001 -35.086 19.558 1.00 43.21 ? 2061 HOH F O 1 +HETATM 34727 O O . HOH R 3 . ? -1.180 -6.297 32.344 1.00 38.22 ? 2062 HOH F O 1 +HETATM 34728 O O . HOH R 3 . ? 1.073 -38.045 45.593 1.00 34.91 ? 2063 HOH F O 1 +HETATM 34729 O O . HOH R 3 . ? -2.570 -23.509 -2.082 1.00 35.98 ? 2064 HOH F O 1 +HETATM 34730 O O . HOH R 3 . ? -10.378 -39.364 44.489 1.00 40.04 ? 2065 HOH F O 1 +HETATM 34731 O O . HOH R 3 . ? -14.018 -30.015 59.513 1.00 43.41 ? 2066 HOH F O 1 +HETATM 34732 O O . HOH R 3 . ? -8.954 -29.982 26.437 1.00 35.26 ? 2067 HOH F O 1 +HETATM 34733 O O . HOH R 3 . ? -26.301 -28.217 22.201 1.00 36.78 ? 2068 HOH F O 1 +HETATM 34734 O O . HOH R 3 . ? -6.639 -3.979 20.721 1.00 24.68 ? 2069 HOH F O 1 +HETATM 34735 O O . HOH R 3 . ? 11.016 -33.850 -2.789 1.00 36.90 ? 2070 HOH F O 1 +HETATM 34736 O O . HOH R 3 . ? 0.518 -21.605 36.797 1.00 54.32 ? 2071 HOH F O 1 +HETATM 34737 O O . HOH R 3 . ? -19.562 -38.097 49.893 1.00 32.06 ? 2072 HOH F O 1 +HETATM 34738 O O . HOH R 3 . ? -1.881 -33.882 11.452 1.00 32.15 ? 2073 HOH F O 1 +HETATM 34739 O O . HOH R 3 . ? -3.019 -5.353 11.744 1.00 37.24 ? 2074 HOH F O 1 +HETATM 34740 O O . HOH R 3 . ? 14.116 -29.188 12.139 1.00 41.07 ? 2075 HOH F O 1 +HETATM 34741 O O . HOH R 3 . ? 12.229 -17.954 40.158 1.00 47.11 ? 2076 HOH F O 1 +HETATM 34742 O O . HOH R 3 . ? 8.969 -23.353 -5.874 1.00 44.86 ? 2077 HOH F O 1 +HETATM 34743 O O . HOH R 3 . ? -2.816 -34.905 50.788 1.00 43.82 ? 2078 HOH F O 1 +HETATM 34744 O O . HOH R 3 . ? -29.261 -31.273 42.714 1.00 32.22 ? 2079 HOH F O 1 +HETATM 34745 O O . HOH R 3 . ? 6.939 -32.459 -4.571 1.00 38.19 ? 2080 HOH F O 1 +HETATM 34746 O O . HOH R 3 . ? -5.648 -10.184 7.481 1.00 38.15 ? 2081 HOH F O 1 +HETATM 34747 O O . HOH R 3 . ? -9.843 -40.996 42.418 1.00 34.57 ? 2082 HOH F O 1 +HETATM 34748 O O . HOH R 3 . ? 3.987 -35.966 7.744 1.00 41.95 ? 2083 HOH F O 1 +HETATM 34749 O O . HOH R 3 . ? -15.341 -39.774 35.758 1.00 52.63 ? 2084 HOH F O 1 +HETATM 34750 O O . HOH R 3 . ? -32.133 -24.608 41.117 1.00 49.36 ? 2085 HOH F O 1 +HETATM 34751 O O . HOH R 3 . ? -8.487 -28.050 -2.642 1.00 34.19 ? 2086 HOH F O 1 +HETATM 34752 O O . HOH R 3 . ? -13.426 -32.373 3.764 1.00 42.02 ? 2087 HOH F O 1 +HETATM 34753 O O . HOH R 3 . ? 7.744 -12.507 14.760 1.00 38.62 ? 2088 HOH F O 1 +HETATM 34754 O O . HOH R 3 . ? -12.157 -14.233 34.120 1.00 56.45 ? 2089 HOH F O 1 +HETATM 34755 O O . HOH R 3 . ? -0.097 -1.957 34.391 1.00 47.24 ? 2090 HOH F O 1 +HETATM 34756 O O . HOH R 3 . ? -37.900 -8.662 26.418 1.00 47.56 ? 2091 HOH F O 1 +HETATM 34757 O O . HOH R 3 . ? -34.747 -7.278 26.926 1.00 38.04 ? 2092 HOH F O 1 +HETATM 34758 O O . HOH R 3 . ? 4.680 -9.548 20.230 1.00 49.83 ? 2093 HOH F O 1 +HETATM 34759 O O . HOH R 3 . ? -15.845 -31.843 4.674 1.00 42.74 ? 2094 HOH F O 1 +HETATM 34760 O O . HOH R 3 . ? -13.716 -37.724 29.176 1.00 33.62 ? 2095 HOH F O 1 +HETATM 34761 O O . HOH R 3 . ? -11.895 -39.281 29.256 1.00 35.27 ? 2096 HOH F O 1 +HETATM 34762 O O . HOH R 3 . ? -20.921 -4.865 29.218 1.00 39.15 ? 2097 HOH F O 1 +HETATM 34763 O O . HOH R 3 . ? 4.226 -10.858 5.184 1.00 50.87 ? 2098 HOH F O 1 +HETATM 34764 O O . HOH R 3 . ? 12.414 -16.508 12.625 1.00 33.25 ? 2099 HOH F O 1 +HETATM 34765 O O . HOH R 3 . ? -13.548 -38.290 47.049 1.00 47.34 ? 2100 HOH F O 1 +HETATM 34766 O O . HOH R 3 . ? -7.329 -44.573 -9.763 1.00 29.59 ? 2101 HOH F O 1 +HETATM 34767 O O . HOH R 3 . ? 20.012 -37.484 40.419 1.00 44.32 ? 2102 HOH F O 1 +HETATM 34768 O O . HOH R 3 . ? 19.625 -37.778 36.679 1.00 42.77 ? 2103 HOH F O 1 +HETATM 34769 O O . HOH R 3 . ? 7.677 -17.136 2.770 1.00 44.29 ? 2104 HOH F O 1 +HETATM 34770 O O . HOH R 3 . ? 6.460 -35.977 7.202 1.00 46.40 ? 2105 HOH F O 1 +HETATM 34771 O O . HOH R 3 . ? -23.592 -39.748 45.177 1.00 37.52 ? 2106 HOH F O 1 +HETATM 34772 O O . HOH R 3 . ? -20.497 -37.469 24.753 1.00 46.87 ? 2107 HOH F O 1 +HETATM 34773 O O . HOH R 3 . ? 9.580 -34.346 17.701 1.00 39.70 ? 2108 HOH F O 1 +HETATM 34774 O O . HOH R 3 . ? 14.511 -23.369 -0.932 1.00 30.28 ? 2109 HOH F O 1 +HETATM 34775 O O . HOH R 3 . ? -5.493 -43.512 48.291 1.00 34.67 ? 2110 HOH F O 1 +HETATM 34776 O O . HOH R 3 . ? -24.130 -38.063 27.266 1.00 43.69 ? 2111 HOH F O 1 +HETATM 34777 O O . HOH R 3 . ? -11.789 -40.955 31.783 1.00 51.42 ? 2112 HOH F O 1 +HETATM 34778 O O . HOH R 3 . ? 14.451 -25.905 45.453 1.00 41.27 ? 2113 HOH F O 1 +HETATM 34779 O O . HOH R 3 . ? -11.295 -47.948 -6.590 1.00 45.95 ? 2114 HOH F O 1 +HETATM 34780 O O . HOH R 3 . ? -19.434 -32.975 56.996 1.00 46.93 ? 2115 HOH F O 1 +HETATM 34781 O O . HOH R 3 . ? 15.620 -18.405 13.703 1.00 41.70 ? 2116 HOH F O 1 +HETATM 34782 O O . HOH R 3 . ? 12.530 -27.513 44.403 1.00 38.51 ? 2117 HOH F O 1 +HETATM 34783 O O . HOH R 3 . ? -1.439 -44.871 39.200 1.00 45.01 ? 2118 HOH F O 1 +HETATM 34784 O O . HOH R 3 . ? -28.634 -26.311 20.685 1.00 36.18 ? 2119 HOH F O 1 +HETATM 34785 O O . HOH R 3 . ? -29.846 -27.218 24.052 1.00 39.71 ? 2120 HOH F O 1 +HETATM 34786 O O . HOH R 3 . ? -16.987 -24.971 8.051 1.00 46.07 ? 2121 HOH F O 1 +HETATM 34787 O O . HOH R 3 . ? -9.747 1.740 18.825 1.00 50.61 ? 2122 HOH F O 1 +HETATM 34788 O O . HOH R 3 . ? -11.597 -40.634 38.005 1.00 46.92 ? 2123 HOH F O 1 +HETATM 34789 O O . HOH R 3 . ? -35.436 -20.878 55.062 1.00 52.67 ? 2124 HOH F O 1 +HETATM 34790 O O . HOH R 3 . ? 17.174 -41.897 46.098 1.00 48.80 ? 2125 HOH F O 1 +HETATM 34791 O O . HOH R 3 . ? 5.731 -11.023 13.531 1.00 44.71 ? 2126 HOH F O 1 +HETATM 34792 O O . HOH R 3 . ? -11.431 -16.938 25.123 1.00 49.84 ? 2127 HOH F O 1 +HETATM 34793 O O . HOH R 3 . ? -39.028 -17.590 30.145 1.00 40.21 ? 2128 HOH F O 1 +HETATM 34794 O O . HOH R 3 . ? -6.733 -31.761 59.041 1.00 58.92 ? 2129 HOH F O 1 +HETATM 34795 O O . HOH R 3 . ? 14.909 -31.972 12.819 1.00 37.60 ? 2130 HOH F O 1 +HETATM 34796 O O . HOH R 3 . ? -15.657 -20.183 5.035 1.00 38.16 ? 2131 HOH F O 1 +HETATM 34797 O O . HOH R 3 . ? -18.385 -36.951 39.832 1.00 45.19 ? 2132 HOH F O 1 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 MET 1 1 ? ? ? A . n +A 1 2 ARG 2 2 ? ? ? A . n +A 1 3 ILE 3 3 3 ILE ILE A . n +A 1 4 LEU 4 4 4 LEU LEU A . n +A 1 5 LYS 5 5 5 LYS LYS A . n +A 1 6 ILE 6 6 6 ILE ILE A . n +A 1 7 TYR 7 7 7 TYR TYR A . n +A 1 8 GLU 8 8 8 GLU GLU A . n +A 1 9 ASN 9 9 9 ASN ASN A . n +A 1 10 LYS 10 10 10 LYS LYS A . n +A 1 11 GLY 11 11 11 GLY GLY A . n +A 1 12 VAL 12 12 12 VAL VAL A . n +A 1 13 TYR 13 13 13 TYR TYR A . n +A 1 14 LYS 14 14 14 LYS LYS A . n +A 1 15 VAL 15 15 15 VAL VAL A . n +A 1 16 VAL 16 16 16 VAL VAL A . n +A 1 17 ILE 17 17 17 ILE ILE A . n +A 1 18 GLY 18 18 18 GLY GLY A . n +A 1 19 GLU 19 19 19 GLU GLU A . n +A 1 20 PRO 20 20 20 PRO PRO A . n +A 1 21 PHE 21 21 21 PHE PHE A . n +A 1 22 PRO 22 22 22 PRO PRO A . n +A 1 23 PRO 23 23 23 PRO PRO A . n +A 1 24 ILE 24 24 24 ILE ILE A . n +A 1 25 GLU 25 25 25 GLU GLU A . n +A 1 26 PHE 26 26 26 PHE PHE A . n +A 1 27 PRO 27 27 27 PRO PRO A . n +A 1 28 LEU 28 28 28 LEU LEU A . n +A 1 29 GLU 29 29 29 GLU GLU A . n +A 1 30 GLN 30 30 30 GLN GLN A . n +A 1 31 LYS 31 31 31 LYS LYS A . n +A 1 32 ILE 32 32 32 ILE ILE A . n +A 1 33 SER 33 33 33 SER SER A . n +A 1 34 SER 34 34 34 SER SER A . n +A 1 35 ASN 35 35 35 ASN ASN A . n +A 1 36 LYS 36 36 36 LYS LYS A . n +A 1 37 SER 37 37 37 SER SER A . n +A 1 38 LEU 38 38 38 LEU LEU A . n +A 1 39 SER 39 39 39 SER SER A . n +A 1 40 GLU 40 40 40 GLU GLU A . n +A 1 41 LEU 41 41 41 LEU LEU A . n +A 1 42 GLY 42 42 42 GLY GLY A . n +A 1 43 LEU 43 43 43 LEU LEU A . n +A 1 44 THR 44 44 44 THR THR A . n +A 1 45 ILE 45 45 45 ILE ILE A . n +A 1 46 VAL 46 46 46 VAL VAL A . n +A 1 47 GLN 47 47 47 GLN GLN A . n +A 1 48 GLN 48 48 48 GLN GLN A . n +A 1 49 GLY 49 49 49 GLY GLY A . n +A 1 50 ASN 50 50 50 ASN ASN A . n +A 1 51 LYS 51 51 51 LYS LYS A . n +A 1 52 VAL 52 52 52 VAL VAL A . n +A 1 53 ILE 53 53 53 ILE ILE A . n +A 1 54 VAL 54 54 54 VAL VAL A . n +A 1 55 GLU 55 55 55 GLU GLU A . n +A 1 56 LYS 56 56 56 LYS LYS A . n +A 1 57 SER 57 57 57 SER SER A . n +A 1 58 LEU 58 58 58 LEU LEU A . n +A 1 59 ASP 59 59 59 ASP ASP A . n +A 1 60 LEU 60 60 60 LEU LEU A . n +A 1 61 LYS 61 61 61 LYS LYS A . n +A 1 62 GLU 62 62 62 GLU GLU A . n +A 1 63 HIS 63 63 63 HIS HIS A . n +A 1 64 ILE 64 64 64 ILE ILE A . n +A 1 65 ILE 65 65 65 ILE ILE A . n +A 1 66 GLY 66 66 66 GLY GLY A . n +A 1 67 LEU 67 67 67 LEU LEU A . n +A 1 68 GLY 68 68 68 GLY GLY A . n +A 1 69 GLU 69 69 69 GLU GLU A . n +A 1 70 LYS 70 70 70 LYS LYS A . n +A 1 71 ALA 71 71 71 ALA ALA A . n +A 1 72 PHE 72 72 72 PHE PHE A . n +A 1 73 GLU 73 73 73 GLU GLU A . n +A 1 74 LEU 74 74 74 LEU LEU A . n +A 1 75 ASP 75 75 75 ASP ASP A . n +A 1 76 ARG 76 76 76 ARG ARG A . n +A 1 77 LYS 77 77 77 LYS LYS A . n +A 1 78 ARG 78 78 78 ARG ARG A . n +A 1 79 LYS 79 79 79 LYS LYS A . n +A 1 80 ARG 80 80 80 ARG ARG A . n +A 1 81 TYR 81 81 81 TYR TYR A . n +A 1 82 VAL 82 82 82 VAL VAL A . n +A 1 83 MET 83 83 83 MET MET A . n +A 1 84 TYR 84 84 84 TYR TYR A . n +A 1 85 ASN 85 85 85 ASN ASN A . n +A 1 86 VAL 86 86 86 VAL VAL A . n +A 1 87 ASP 87 87 87 ASP ASP A . n +A 1 88 ALA 88 88 88 ALA ALA A . n +A 1 89 GLY 89 89 89 GLY GLY A . n +A 1 90 ALA 90 90 90 ALA ALA A . n +A 1 91 TYR 91 91 91 TYR TYR A . n +A 1 92 LYS 92 92 92 LYS LYS A . n +A 1 93 LYS 93 93 93 LYS LYS A . n +A 1 94 TYR 94 94 94 TYR TYR A . n +A 1 95 GLN 95 95 95 GLN GLN A . n +A 1 96 ASP 96 96 96 ASP ASP A . n +A 1 97 PRO 97 97 97 PRO PRO A . n +A 1 98 LEU 98 98 98 LEU LEU A . n +A 1 99 TYR 99 99 99 TYR TYR A . n +A 1 100 VAL 100 100 100 VAL VAL A . n +A 1 101 SER 101 101 101 SER SER A . n +A 1 102 ILE 102 102 102 ILE ILE A . n +A 1 103 PRO 103 103 103 PRO PRO A . n +A 1 104 LEU 104 104 104 LEU LEU A . n +A 1 105 PHE 105 105 105 PHE PHE A . n +A 1 106 ILE 106 106 106 ILE ILE A . n +A 1 107 SER 107 107 107 SER SER A . n +A 1 108 VAL 108 108 108 VAL VAL A . n +A 1 109 LYS 109 109 109 LYS LYS A . n +A 1 110 ASP 110 110 110 ASP ASP A . n +A 1 111 GLY 111 111 111 GLY GLY A . n +A 1 112 VAL 112 112 112 VAL VAL A . n +A 1 113 ALA 113 113 113 ALA ALA A . n +A 1 114 THR 114 114 114 THR THR A . n +A 1 115 GLY 115 115 115 GLY GLY A . n +A 1 116 TYR 116 116 116 TYR TYR A . n +A 1 117 PHE 117 117 117 PHE PHE A . n +A 1 118 PHE 118 118 118 PHE PHE A . n +A 1 119 ASN 119 119 119 ASN ASN A . n +A 1 120 SER 120 120 120 SER SER A . n +A 1 121 ALA 121 121 121 ALA ALA A . n +A 1 122 SER 122 122 122 SER SER A . n +A 1 123 LYS 123 123 123 LYS LYS A . n +A 1 124 VAL 124 124 124 VAL VAL A . n +A 1 125 ILE 125 125 125 ILE ILE A . n +A 1 126 PHE 126 126 126 PHE PHE A . n +A 1 127 ASP 127 127 127 ASP ASP A . n +A 1 128 VAL 128 128 128 VAL VAL A . n +A 1 129 GLY 129 129 129 GLY GLY A . n +A 1 130 LEU 130 130 130 LEU LEU A . n +A 1 131 GLU 131 131 131 GLU GLU A . n +A 1 132 GLU 132 132 132 GLU GLU A . n +A 1 133 TYR 133 133 133 TYR TYR A . n +A 1 134 ASP 134 134 134 ASP ASP A . n +A 1 135 LYS 135 135 135 LYS LYS A . n +A 1 136 VAL 136 136 136 VAL VAL A . n +A 1 137 ILE 137 137 137 ILE ILE A . n +A 1 138 VAL 138 138 138 VAL VAL A . n +A 1 139 THR 139 139 139 THR THR A . n +A 1 140 ILE 140 140 140 ILE ILE A . n +A 1 141 PRO 141 141 141 PRO PRO A . n +A 1 142 GLU 142 142 142 GLU GLU A . n +A 1 143 ASP 143 143 143 ASP ASP A . n +A 1 144 SER 144 144 144 SER SER A . n +A 1 145 VAL 145 145 145 VAL VAL A . n +A 1 146 GLU 146 146 146 GLU GLU A . n +A 1 147 PHE 147 147 147 PHE PHE A . n +A 1 148 TYR 148 148 148 TYR TYR A . n +A 1 149 VAL 149 149 149 VAL VAL A . n +A 1 150 ILE 150 150 150 ILE ILE A . n +A 1 151 GLU 151 151 151 GLU GLU A . n +A 1 152 GLY 152 152 152 GLY GLY A . n +A 1 153 PRO 153 153 153 PRO PRO A . n +A 1 154 ARG 154 154 154 ARG ARG A . n +A 1 155 ILE 155 155 155 ILE ILE A . n +A 1 156 GLU 156 156 156 GLU GLU A . n +A 1 157 ASP 157 157 157 ASP ASP A . n +A 1 158 VAL 158 158 158 VAL VAL A . n +A 1 159 LEU 159 159 159 LEU LEU A . n +A 1 160 GLU 160 160 160 GLU GLU A . n +A 1 161 LYS 161 161 161 LYS LYS A . n +A 1 162 TYR 162 162 162 TYR TYR A . n +A 1 163 THR 163 163 163 THR THR A . n +A 1 164 GLU 164 164 164 GLU GLU A . n +A 1 165 LEU 165 165 165 LEU LEU A . n +A 1 166 THR 166 166 166 THR THR A . n +A 1 167 GLY 167 167 167 GLY GLY A . n +A 1 168 LYS 168 168 168 LYS LYS A . n +A 1 169 PRO 169 169 169 PRO PRO A . n +A 1 170 PHE 170 170 170 PHE PHE A . n +A 1 171 LEU 171 171 171 LEU LEU A . n +A 1 172 PRO 172 172 172 PRO PRO A . n +A 1 173 PRO 173 173 173 PRO PRO A . n +A 1 174 MET 174 174 174 MET MET A . n +A 1 175 TRP 175 175 175 TRP TRP A . n +A 1 176 ALA 176 176 176 ALA ALA A . n +A 1 177 PHE 177 177 177 PHE PHE A . n +A 1 178 GLY 178 178 178 GLY GLY A . n +A 1 179 TYR 179 179 179 TYR TYR A . n +A 1 180 MET 180 180 180 MET MET A . n +A 1 181 ILE 181 181 181 ILE ILE A . n +A 1 182 SER 182 182 182 SER SER A . n +A 1 183 ARG 183 183 183 ARG ARG A . n +A 1 184 TYR 184 184 184 TYR TYR A . n +A 1 185 SER 185 185 185 SER SER A . n +A 1 186 TYR 186 186 186 TYR TYR A . n +A 1 187 TYR 187 187 187 TYR TYR A . n +A 1 188 PRO 188 188 188 PRO PRO A . n +A 1 189 GLN 189 189 189 GLN GLN A . n +A 1 190 ASP 190 190 190 ASP ASP A . n +A 1 191 LYS 191 191 191 LYS LYS A . n +A 1 192 VAL 192 192 192 VAL VAL A . n +A 1 193 VAL 193 193 193 VAL VAL A . n +A 1 194 GLU 194 194 194 GLU GLU A . n +A 1 195 LEU 195 195 195 LEU LEU A . n +A 1 196 VAL 196 196 196 VAL VAL A . n +A 1 197 ASP 197 197 197 ASP ASP A . n +A 1 198 ILE 198 198 198 ILE ILE A . n +A 1 199 MET 199 199 199 MET MET A . n +A 1 200 GLN 200 200 200 GLN GLN A . n +A 1 201 LYS 201 201 201 LYS LYS A . n +A 1 202 GLU 202 202 202 GLU GLU A . n +A 1 203 GLY 203 203 203 GLY GLY A . n +A 1 204 PHE 204 204 204 PHE PHE A . n +A 1 205 ARG 205 205 205 ARG ARG A . n +A 1 206 VAL 206 206 206 VAL VAL A . n +A 1 207 ALA 207 207 207 ALA ALA A . n +A 1 208 GLY 208 208 208 GLY GLY A . n +A 1 209 VAL 209 209 209 VAL VAL A . n +A 1 210 PHE 210 210 210 PHE PHE A . n +A 1 211 LEU 211 211 211 LEU LEU A . n +A 1 212 ASP 212 212 212 ASP ASP A . n +A 1 213 ILE 213 213 213 ILE ILE A . n +A 1 214 HIS 214 214 214 HIS HIS A . n +A 1 215 TYR 215 215 215 TYR TYR A . n +A 1 216 MET 216 216 216 MET MET A . n +A 1 217 ASP 217 217 217 ASP ASP A . n +A 1 218 SER 218 218 218 SER SER A . n +A 1 219 TYR 219 219 219 TYR TYR A . n +A 1 220 LYS 220 220 220 LYS LYS A . n +A 1 221 LEU 221 221 221 LEU LEU A . n +A 1 222 PHE 222 222 222 PHE PHE A . n +A 1 223 THR 223 223 223 THR THR A . n +A 1 224 TRP 224 224 224 TRP TRP A . n +A 1 225 HIS 225 225 225 HIS HIS A . n +A 1 226 PRO 226 226 226 PRO PRO A . n +A 1 227 TYR 227 227 227 TYR TYR A . n +A 1 228 ARG 228 228 228 ARG ARG A . n +A 1 229 PHE 229 229 229 PHE PHE A . n +A 1 230 PRO 230 230 230 PRO PRO A . n +A 1 231 GLU 231 231 231 GLU GLU A . n +A 1 232 PRO 232 232 232 PRO PRO A . n +A 1 233 LYS 233 233 233 LYS LYS A . n +A 1 234 LYS 234 234 234 LYS LYS A . n +A 1 235 LEU 235 235 235 LEU LEU A . n +A 1 236 ILE 236 236 236 ILE ILE A . n +A 1 237 ASP 237 237 237 ASP ASP A . n +A 1 238 GLU 238 238 238 GLU GLU A . n +A 1 239 LEU 239 239 239 LEU LEU A . n +A 1 240 HIS 240 240 240 HIS HIS A . n +A 1 241 LYS 241 241 241 LYS LYS A . n +A 1 242 ARG 242 242 242 ARG ARG A . n +A 1 243 ASN 243 243 243 ASN ASN A . n +A 1 244 VAL 244 244 244 VAL VAL A . n +A 1 245 LYS 245 245 245 LYS LYS A . n +A 1 246 LEU 246 246 246 LEU LEU A . n +A 1 247 ILE 247 247 247 ILE ILE A . n +A 1 248 THR 248 248 248 THR THR A . n +A 1 249 ILE 249 249 249 ILE ILE A . n +A 1 250 VAL 250 250 250 VAL VAL A . n +A 1 251 ASP 251 251 251 ASP ASP A . n +A 1 252 HIS 252 252 252 HIS HIS A . n +A 1 253 GLY 253 253 253 GLY GLY A . n +A 1 254 ILE 254 254 254 ILE ILE A . n +A 1 255 ARG 255 255 255 ARG ARG A . n +A 1 256 VAL 256 256 256 VAL VAL A . n +A 1 257 ASP 257 257 257 ASP ASP A . n +A 1 258 GLN 258 258 258 GLN GLN A . n +A 1 259 ASN 259 259 259 ASN ASN A . n +A 1 260 TYR 260 260 260 TYR TYR A . n +A 1 261 SER 261 261 261 SER SER A . n +A 1 262 PRO 262 262 262 PRO PRO A . n +A 1 263 PHE 263 263 263 PHE PHE A . n +A 1 264 LEU 264 264 264 LEU LEU A . n +A 1 265 SER 265 265 265 SER SER A . n +A 1 266 GLY 266 266 266 GLY GLY A . n +A 1 267 MET 267 267 267 MET MET A . n +A 1 268 GLY 268 268 268 GLY GLY A . n +A 1 269 LYS 269 269 269 LYS LYS A . n +A 1 270 PHE 270 270 270 PHE PHE A . n +A 1 271 CYS 271 271 271 CYS CYS A . n +A 1 272 GLU 272 272 272 GLU GLU A . n +A 1 273 ILE 273 273 273 ILE ILE A . n +A 1 274 GLU 274 274 274 GLU GLU A . n +A 1 275 SER 275 275 275 SER SER A . n +A 1 276 GLY 276 276 276 GLY GLY A . n +A 1 277 GLU 277 277 277 GLU GLU A . n +A 1 278 LEU 278 278 278 LEU LEU A . n +A 1 279 PHE 279 279 279 PHE PHE A . n +A 1 280 VAL 280 280 280 VAL VAL A . n +A 1 281 GLY 281 281 281 GLY GLY A . n +A 1 282 LYS 282 282 282 LYS LYS A . n +A 1 283 MET 283 283 283 MET MET A . n +A 1 284 TRP 284 284 284 TRP TRP A . n +A 1 285 PRO 285 285 285 PRO PRO A . n +A 1 286 GLY 286 286 286 GLY GLY A . n +A 1 287 THR 287 287 287 THR THR A . n +A 1 288 THR 288 288 288 THR THR A . n +A 1 289 VAL 289 289 289 VAL VAL A . n +A 1 290 TYR 290 290 290 TYR TYR A . n +A 1 291 PRO 291 291 291 PRO PRO A . n +A 1 292 ASP 292 292 292 ASP ASP A . n +A 1 293 PHE 293 293 293 PHE PHE A . n +A 1 294 PHE 294 294 294 PHE PHE A . n +A 1 295 ARG 295 295 295 ARG ARG A . n +A 1 296 GLU 296 296 296 GLU GLU A . n +A 1 297 ASP 297 297 297 ASP ASP A . n +A 1 298 THR 298 298 298 THR THR A . n +A 1 299 ARG 299 299 299 ARG ARG A . n +A 1 300 GLU 300 300 300 GLU GLU A . n +A 1 301 TRP 301 301 301 TRP TRP A . n +A 1 302 TRP 302 302 302 TRP TRP A . n +A 1 303 ALA 303 303 303 ALA ALA A . n +A 1 304 GLY 304 304 304 GLY GLY A . n +A 1 305 LEU 305 305 305 LEU LEU A . n +A 1 306 ILE 306 306 306 ILE ILE A . n +A 1 307 SER 307 307 307 SER SER A . n +A 1 308 GLU 308 308 308 GLU GLU A . n +A 1 309 TRP 309 309 309 TRP TRP A . n +A 1 310 LEU 310 310 310 LEU LEU A . n +A 1 311 SER 311 311 311 SER SER A . n +A 1 312 GLN 312 312 312 GLN GLN A . n +A 1 313 GLY 313 313 313 GLY GLY A . n +A 1 314 VAL 314 314 314 VAL VAL A . n +A 1 315 ASP 315 315 315 ASP ASP A . n +A 1 316 GLY 316 316 316 GLY GLY A . n +A 1 317 ILE 317 317 317 ILE ILE A . n +A 1 318 TRP 318 318 318 TRP TRP A . n +A 1 319 LEU 319 319 319 LEU LEU A . n +A 1 320 ASP 320 320 320 ASP ASP A . n +A 1 321 MET 321 321 321 MET MET A . n +A 1 322 ASN 322 322 322 ASN ASN A . n +A 1 323 GLU 323 323 323 GLU GLU A . n +A 1 324 PRO 324 324 324 PRO PRO A . n +A 1 325 THR 325 325 325 THR THR A . n +A 1 326 ASP 326 326 326 ASP ASP A . n +A 1 327 PHE 327 327 327 PHE PHE A . n +A 1 328 SER 328 328 328 SER SER A . n +A 1 329 ARG 329 329 329 ARG ARG A . n +A 1 330 ALA 330 330 330 ALA ALA A . n +A 1 331 ILE 331 331 331 ILE ILE A . n +A 1 332 GLU 332 332 332 GLU GLU A . n +A 1 333 ILE 333 333 333 ILE ILE A . n +A 1 334 ARG 334 334 334 ARG ARG A . n +A 1 335 ASP 335 335 335 ASP ASP A . n +A 1 336 VAL 336 336 336 VAL VAL A . n +A 1 337 LEU 337 337 337 LEU LEU A . n +A 1 338 SER 338 338 338 SER SER A . n +A 1 339 SER 339 339 339 SER SER A . n +A 1 340 LEU 340 340 340 LEU LEU A . n +A 1 341 PRO 341 341 341 PRO PRO A . n +A 1 342 VAL 342 342 342 VAL VAL A . n +A 1 343 GLN 343 343 343 GLN GLN A . n +A 1 344 PHE 344 344 344 PHE PHE A . n +A 1 345 ARG 345 345 345 ARG ARG A . n +A 1 346 ASP 346 346 346 ASP ASP A . n +A 1 347 ASP 347 347 347 ASP ASP A . n +A 1 348 ARG 348 348 348 ARG ARG A . n +A 1 349 LEU 349 349 349 LEU LEU A . n +A 1 350 VAL 350 350 350 VAL VAL A . n +A 1 351 THR 351 351 351 THR THR A . n +A 1 352 THR 352 352 352 THR THR A . n +A 1 353 PHE 353 353 353 PHE PHE A . n +A 1 354 PRO 354 354 354 PRO PRO A . n +A 1 355 ASP 355 355 355 ASP ASP A . n +A 1 356 ASN 356 356 356 ASN ASN A . n +A 1 357 VAL 357 357 357 VAL VAL A . n +A 1 358 VAL 358 358 358 VAL VAL A . n +A 1 359 HIS 359 359 359 HIS HIS A . n +A 1 360 TYR 360 360 360 TYR TYR A . n +A 1 361 LEU 361 361 361 LEU LEU A . n +A 1 362 ARG 362 362 362 ARG ARG A . n +A 1 363 GLY 363 363 363 GLY GLY A . n +A 1 364 LYS 364 364 364 LYS LYS A . n +A 1 365 ARG 365 365 365 ARG ARG A . n +A 1 366 VAL 366 366 366 VAL VAL A . n +A 1 367 LYS 367 367 367 LYS LYS A . n +A 1 368 HIS 368 368 368 HIS HIS A . n +A 1 369 GLU 369 369 369 GLU GLU A . n +A 1 370 LYS 370 370 370 LYS LYS A . n +A 1 371 VAL 371 371 371 VAL VAL A . n +A 1 372 ARG 372 372 372 ARG ARG A . n +A 1 373 ASN 373 373 373 ASN ASN A . n +A 1 374 ALA 374 374 374 ALA ALA A . n +A 1 375 TYR 375 375 375 TYR TYR A . n +A 1 376 PRO 376 376 376 PRO PRO A . n +A 1 377 LEU 377 377 377 LEU LEU A . n +A 1 378 TYR 378 378 378 TYR TYR A . n +A 1 379 GLU 379 379 379 GLU GLU A . n +A 1 380 ALA 380 380 380 ALA ALA A . n +A 1 381 MET 381 381 381 MET MET A . n +A 1 382 ALA 382 382 382 ALA ALA A . n +A 1 383 THR 383 383 383 THR THR A . n +A 1 384 PHE 384 384 384 PHE PHE A . n +A 1 385 LYS 385 385 385 LYS LYS A . n +A 1 386 GLY 386 386 386 GLY GLY A . n +A 1 387 PHE 387 387 387 PHE PHE A . n +A 1 388 ARG 388 388 388 ARG ARG A . n +A 1 389 THR 389 389 389 THR THR A . n +A 1 390 SER 390 390 390 SER SER A . n +A 1 391 HIS 391 391 391 HIS HIS A . n +A 1 392 ARG 392 392 392 ARG ARG A . n +A 1 393 ASN 393 393 393 ASN ASN A . n +A 1 394 GLU 394 394 394 GLU GLU A . n +A 1 395 ILE 395 395 395 ILE ILE A . n +A 1 396 PHE 396 396 396 PHE PHE A . n +A 1 397 ILE 397 397 397 ILE ILE A . n +A 1 398 LEU 398 398 398 LEU LEU A . n +A 1 399 SER 399 399 399 SER SER A . n +A 1 400 ARG 400 400 400 ARG ARG A . n +A 1 401 ALA 401 401 401 ALA ALA A . n +A 1 402 GLY 402 402 402 GLY GLY A . n +A 1 403 TYR 403 403 403 TYR TYR A . n +A 1 404 ALA 404 404 404 ALA ALA A . n +A 1 405 GLY 405 405 405 GLY GLY A . n +A 1 406 ILE 406 406 406 ILE ILE A . n +A 1 407 GLN 407 407 407 GLN GLN A . n +A 1 408 ARG 408 408 408 ARG ARG A . n +A 1 409 TYR 409 409 409 TYR TYR A . n +A 1 410 ALA 410 410 410 ALA ALA A . n +A 1 411 PHE 411 411 411 PHE PHE A . n +A 1 412 ILE 412 412 412 ILE ILE A . n +A 1 413 TRP 413 413 413 TRP TRP A . n +A 1 414 THR 414 414 414 THR THR A . n +A 1 415 GLY 415 415 415 GLY GLY A . n +A 1 416 ASP 416 416 416 ASP ASP A . n +A 1 417 ASN 417 417 417 ASN ASN A . n +A 1 418 THR 418 418 418 THR THR A . n +A 1 419 PRO 419 419 419 PRO PRO A . n +A 1 420 SER 420 420 420 SER SER A . n +A 1 421 TRP 421 421 421 TRP TRP A . n +A 1 422 ASP 422 422 422 ASP ASP A . n +A 1 423 ASP 423 423 423 ASP ASP A . n +A 1 424 LEU 424 424 424 LEU LEU A . n +A 1 425 LYS 425 425 425 LYS LYS A . n +A 1 426 LEU 426 426 426 LEU LEU A . n +A 1 427 GLN 427 427 427 GLN GLN A . n +A 1 428 LEU 428 428 428 LEU LEU A . n +A 1 429 GLN 429 429 429 GLN GLN A . n +A 1 430 LEU 430 430 430 LEU LEU A . n +A 1 431 VAL 431 431 431 VAL VAL A . n +A 1 432 LEU 432 432 432 LEU LEU A . n +A 1 433 GLY 433 433 433 GLY GLY A . n +A 1 434 LEU 434 434 434 LEU LEU A . n +A 1 435 SER 435 435 435 SER SER A . n +A 1 436 ILE 436 436 436 ILE ILE A . n +A 1 437 SER 437 437 437 SER SER A . n +A 1 438 GLY 438 438 438 GLY GLY A . n +A 1 439 VAL 439 439 439 VAL VAL A . n +A 1 440 PRO 440 440 440 PRO PRO A . n +A 1 441 PHE 441 441 441 PHE PHE A . n +A 1 442 VAL 442 442 442 VAL VAL A . n +A 1 443 GLY 443 443 443 GLY GLY A . n +A 1 444 CYS 444 444 444 CYS CYS A . n +A 1 445 ASP 445 445 445 ASP ASP A . n +A 1 446 ILE 446 446 446 ILE ILE A . n +A 1 447 GLY 447 447 447 GLY GLY A . n +A 1 448 GLY 448 448 448 GLY GLY A . n +A 1 449 PHE 449 449 449 PHE PHE A . n +A 1 450 GLN 450 450 450 GLN GLN A . n +A 1 451 GLY 451 451 451 GLY GLY A . n +A 1 452 ARG 452 452 452 ARG ARG A . n +A 1 453 ASN 453 453 453 ASN ASN A . n +A 1 454 PHE 454 454 454 PHE PHE A . n +A 1 455 ALA 455 455 455 ALA ALA A . n +A 1 456 GLU 456 456 456 GLU GLU A . n +A 1 457 ILE 457 457 457 ILE ILE A . n +A 1 458 ASP 458 458 458 ASP ASP A . n +A 1 459 ASN 459 459 459 ASN ASN A . n +A 1 460 SER 460 460 460 SER SER A . n +A 1 461 MET 461 461 461 MET MET A . n +A 1 462 ASP 462 462 462 ASP ASP A . n +A 1 463 LEU 463 463 463 LEU LEU A . n +A 1 464 LEU 464 464 464 LEU LEU A . n +A 1 465 VAL 465 465 465 VAL VAL A . n +A 1 466 LYS 466 466 466 LYS LYS A . n +A 1 467 TYR 467 467 467 TYR TYR A . n +A 1 468 TYR 468 468 468 TYR TYR A . n +A 1 469 ALA 469 469 469 ALA ALA A . n +A 1 470 LEU 470 470 470 LEU LEU A . n +A 1 471 ALA 471 471 471 ALA ALA A . n +A 1 472 LEU 472 472 472 LEU LEU A . n +A 1 473 PHE 473 473 473 PHE PHE A . n +A 1 474 PHE 474 474 474 PHE PHE A . n +A 1 475 PRO 475 475 475 PRO PRO A . n +A 1 476 PHE 476 476 476 PHE PHE A . n +A 1 477 TYR 477 477 477 TYR TYR A . n +A 1 478 ARG 478 478 478 ARG ARG A . n +A 1 479 SER 479 479 479 SER SER A . n +A 1 480 HIS 480 480 480 HIS HIS A . n +A 1 481 LYS 481 481 481 LYS LYS A . n +A 1 482 ALA 482 482 482 ALA ALA A . n +A 1 483 THR 483 483 483 THR THR A . n +A 1 484 ASP 484 484 484 ASP ASP A . n +A 1 485 GLY 485 485 485 GLY GLY A . n +A 1 486 ILE 486 486 486 ILE ILE A . n +A 1 487 ASP 487 487 487 ASP ASP A . n +A 1 488 THR 488 488 488 THR THR A . n +A 1 489 GLU 489 489 489 GLU GLU A . n +A 1 490 PRO 490 490 490 PRO PRO A . n +A 1 491 VAL 491 491 491 VAL VAL A . n +A 1 492 PHE 492 492 492 PHE PHE A . n +A 1 493 LEU 493 493 493 LEU LEU A . n +A 1 494 PRO 494 494 494 PRO PRO A . n +A 1 495 ASP 495 495 495 ASP ASP A . n +A 1 496 TYR 496 496 496 TYR TYR A . n +A 1 497 TYR 497 497 497 TYR TYR A . n +A 1 498 LYS 498 498 498 LYS LYS A . n +A 1 499 GLU 499 499 499 GLU GLU A . n +A 1 500 LYS 500 500 500 LYS LYS A . n +A 1 501 VAL 501 501 501 VAL VAL A . n +A 1 502 LYS 502 502 502 LYS LYS A . n +A 1 503 GLU 503 503 503 GLU GLU A . n +A 1 504 ILE 504 504 504 ILE ILE A . n +A 1 505 VAL 505 505 505 VAL VAL A . n +A 1 506 GLU 506 506 506 GLU GLU A . n +A 1 507 LEU 507 507 507 LEU LEU A . n +A 1 508 ARG 508 508 508 ARG ARG A . n +A 1 509 TYR 509 509 509 TYR TYR A . n +A 1 510 LYS 510 510 510 LYS LYS A . n +A 1 511 PHE 511 511 511 PHE PHE A . n +A 1 512 LEU 512 512 512 LEU LEU A . n +A 1 513 PRO 513 513 513 PRO PRO A . n +A 1 514 TYR 514 514 514 TYR TYR A . n +A 1 515 ILE 515 515 515 ILE ILE A . n +A 1 516 TYR 516 516 516 TYR TYR A . n +A 1 517 SER 517 517 517 SER SER A . n +A 1 518 LEU 518 518 518 LEU LEU A . n +A 1 519 ALA 519 519 519 ALA ALA A . n +A 1 520 LEU 520 520 520 LEU LEU A . n +A 1 521 GLU 521 521 521 GLU GLU A . n +A 1 522 ALA 522 522 522 ALA ALA A . n +A 1 523 SER 523 523 523 SER SER A . n +A 1 524 GLU 524 524 524 GLU GLU A . n +A 1 525 LYS 525 525 525 LYS LYS A . n +A 1 526 GLY 526 526 526 GLY GLY A . n +A 1 527 HIS 527 527 527 HIS HIS A . n +A 1 528 PRO 528 528 528 PRO PRO A . n +A 1 529 VAL 529 529 529 VAL VAL A . n +A 1 530 ILE 530 530 530 ILE ILE A . n +A 1 531 ARG 531 531 531 ARG ARG A . n +A 1 532 PRO 532 532 532 PRO PRO A . n +A 1 533 LEU 533 533 533 LEU LEU A . n +A 1 534 PHE 534 534 534 PHE PHE A . n +A 1 535 TYR 535 535 535 TYR TYR A . n +A 1 536 GLU 536 536 536 GLU GLU A . n +A 1 537 PHE 537 537 537 PHE PHE A . n +A 1 538 GLN 538 538 538 GLN GLN A . n +A 1 539 ASP 539 539 539 ASP ASP A . n +A 1 540 ASP 540 540 540 ASP ASP A . n +A 1 541 ASP 541 541 541 ASP ASP A . n +A 1 542 ASP 542 542 542 ASP ASP A . n +A 1 543 MET 543 543 543 MET MET A . n +A 1 544 TYR 544 544 544 TYR TYR A . n +A 1 545 ARG 545 545 545 ARG ARG A . n +A 1 546 ILE 546 546 546 ILE ILE A . n +A 1 547 GLU 547 547 547 GLU GLU A . n +A 1 548 ASP 548 548 548 ASP ASP A . n +A 1 549 GLU 549 549 549 GLU GLU A . n +A 1 550 TYR 550 550 550 TYR TYR A . n +A 1 551 MET 551 551 551 MET MET A . n +A 1 552 VAL 552 552 552 VAL VAL A . n +A 1 553 GLY 553 553 553 GLY GLY A . n +A 1 554 LYS 554 554 554 LYS LYS A . n +A 1 555 TYR 555 555 555 TYR TYR A . n +A 1 556 LEU 556 556 556 LEU LEU A . n +A 1 557 LEU 557 557 557 LEU LEU A . n +A 1 558 TYR 558 558 558 TYR TYR A . n +A 1 559 ALA 559 559 559 ALA ALA A . n +A 1 560 PRO 560 560 560 PRO PRO A . n +A 1 561 ILE 561 561 561 ILE ILE A . n +A 1 562 VAL 562 562 562 VAL VAL A . n +A 1 563 SER 563 563 563 SER SER A . n +A 1 564 LYS 564 564 564 LYS LYS A . n +A 1 565 GLU 565 565 565 GLU GLU A . n +A 1 566 GLU 566 566 566 GLU GLU A . n +A 1 567 SER 567 567 567 SER SER A . n +A 1 568 ARG 568 568 568 ARG ARG A . n +A 1 569 LEU 569 569 569 LEU LEU A . n +A 1 570 VAL 570 570 570 VAL VAL A . n +A 1 571 THR 571 571 571 THR THR A . n +A 1 572 LEU 572 572 572 LEU LEU A . n +A 1 573 PRO 573 573 573 PRO PRO A . n +A 1 574 ARG 574 574 574 ARG ARG A . n +A 1 575 GLY 575 575 575 GLY GLY A . n +A 1 576 LYS 576 576 576 LYS LYS A . n +A 1 577 TRP 577 577 577 TRP TRP A . n +A 1 578 TYR 578 578 578 TYR TYR A . n +A 1 579 ASN 579 579 579 ASN ASN A . n +A 1 580 TYR 580 580 580 TYR TYR A . n +A 1 581 TRP 581 581 581 TRP TRP A . n +A 1 582 ASN 582 582 582 ASN ASN A . n +A 1 583 GLY 583 583 583 GLY GLY A . n +A 1 584 GLU 584 584 584 GLU GLU A . n +A 1 585 ILE 585 585 585 ILE ILE A . n +A 1 586 ILE 586 586 586 ILE ILE A . n +A 1 587 ASN 587 587 587 ASN ASN A . n +A 1 588 GLY 588 588 588 GLY GLY A . n +A 1 589 LYS 589 589 589 LYS LYS A . n +A 1 590 SER 590 590 590 SER SER A . n +A 1 591 VAL 591 591 591 VAL VAL A . n +A 1 592 VAL 592 592 592 VAL VAL A . n +A 1 593 LYS 593 593 593 LYS LYS A . n +A 1 594 SER 594 594 594 SER SER A . n +A 1 595 THR 595 595 595 THR THR A . n +A 1 596 HIS 596 596 596 HIS HIS A . n +A 1 597 GLU 597 597 597 GLU GLU A . n +A 1 598 LEU 598 598 598 LEU LEU A . n +A 1 599 PRO 599 599 599 PRO PRO A . n +A 1 600 ILE 600 600 600 ILE ILE A . n +A 1 601 TYR 601 601 601 TYR TYR A . n +A 1 602 LEU 602 602 602 LEU LEU A . n +A 1 603 ARG 603 603 603 ARG ARG A . n +A 1 604 GLU 604 604 604 GLU GLU A . n +A 1 605 GLY 605 605 605 GLY GLY A . n +A 1 606 SER 606 606 606 SER SER A . n +A 1 607 ILE 607 607 607 ILE ILE A . n +A 1 608 ILE 608 608 608 ILE ILE A . n +A 1 609 PRO 609 609 609 PRO PRO A . n +A 1 610 LEU 610 610 610 LEU LEU A . n +A 1 611 GLU 611 611 611 GLU GLU A . n +A 1 612 GLY 612 612 612 GLY GLY A . n +A 1 613 ASP 613 613 613 ASP ASP A . n +A 1 614 GLU 614 614 614 GLU GLU A . n +A 1 615 LEU 615 615 615 LEU LEU A . n +A 1 616 ILE 616 616 616 ILE ILE A . n +A 1 617 VAL 617 617 617 VAL VAL A . n +A 1 618 TYR 618 618 618 TYR TYR A . n +A 1 619 GLY 619 619 619 GLY GLY A . n +A 1 620 GLU 620 620 620 GLU GLU A . n +A 1 621 THR 621 621 621 THR THR A . n +A 1 622 SER 622 622 622 SER SER A . n +A 1 623 PHE 623 623 623 PHE PHE A . n +A 1 624 LYS 624 624 624 LYS LYS A . n +A 1 625 ARG 625 625 625 ARG ARG A . n +A 1 626 TYR 626 626 626 TYR TYR A . n +A 1 627 ASP 627 627 627 ASP ASP A . n +A 1 628 ASN 628 628 628 ASN ASN A . n +A 1 629 ALA 629 629 629 ALA ALA A . n +A 1 630 GLU 630 630 630 GLU GLU A . n +A 1 631 ILE 631 631 631 ILE ILE A . n +A 1 632 THR 632 632 632 THR THR A . n +A 1 633 SER 633 633 633 SER SER A . n +A 1 634 SER 634 634 634 SER SER A . n +A 1 635 SER 635 635 635 SER SER A . n +A 1 636 ASN 636 636 636 ASN ASN A . n +A 1 637 GLU 637 637 637 GLU GLU A . n +A 1 638 ILE 638 638 638 ILE ILE A . n +A 1 639 LYS 639 639 639 LYS LYS A . n +A 1 640 PHE 640 640 640 PHE PHE A . n +A 1 641 SER 641 641 641 SER SER A . n +A 1 642 ARG 642 642 642 ARG ARG A . n +A 1 643 GLU 643 643 643 GLU GLU A . n +A 1 644 ILE 644 644 644 ILE ILE A . n +A 1 645 TYR 645 645 645 TYR TYR A . n +A 1 646 VAL 646 646 646 VAL VAL A . n +A 1 647 SER 647 647 647 SER SER A . n +A 1 648 LYS 648 648 648 LYS LYS A . n +A 1 649 LEU 649 649 649 LEU LEU A . n +A 1 650 THR 650 650 650 THR THR A . n +A 1 651 ILE 651 651 651 ILE ILE A . n +A 1 652 THR 652 652 652 THR THR A . n +A 1 653 SER 653 653 653 SER SER A . n +A 1 654 GLU 654 654 654 GLU GLU A . n +A 1 655 LYS 655 655 655 LYS LYS A . n +A 1 656 PRO 656 656 656 PRO PRO A . n +A 1 657 VAL 657 657 657 VAL VAL A . n +A 1 658 SER 658 658 658 SER SER A . n +A 1 659 LYS 659 659 659 LYS LYS A . n +A 1 660 ILE 660 660 660 ILE ILE A . n +A 1 661 ILE 661 661 661 ILE ILE A . n +A 1 662 VAL 662 662 662 VAL VAL A . n +A 1 663 ASP 663 663 663 ASP ASP A . n +A 1 664 ASP 664 664 664 ASP ASP A . n +A 1 665 SER 665 665 665 SER SER A . n +A 1 666 LYS 666 666 666 LYS LYS A . n +A 1 667 GLU 667 667 667 GLU GLU A . n +A 1 668 ILE 668 668 668 ILE ILE A . n +A 1 669 GLN 669 669 669 GLN GLN A . n +A 1 670 VAL 670 670 670 VAL VAL A . n +A 1 671 GLU 671 671 671 GLU GLU A . n +A 1 672 LYS 672 672 672 LYS LYS A . n +A 1 673 THR 673 673 673 THR THR A . n +A 1 674 MET 674 674 674 MET MET A . n +A 1 675 GLN 675 675 675 GLN GLN A . n +A 1 676 ASN 676 676 676 ASN ASN A . n +A 1 677 THR 677 677 677 THR THR A . n +A 1 678 TYR 678 678 678 TYR TYR A . n +A 1 679 VAL 679 679 679 VAL VAL A . n +A 1 680 ALA 680 680 680 ALA ALA A . n +A 1 681 LYS 681 681 681 LYS LYS A . n +A 1 682 ILE 682 682 682 ILE ILE A . n +A 1 683 ASN 683 683 683 ASN ASN A . n +A 1 684 GLN 684 684 684 GLN GLN A . n +A 1 685 LYS 685 685 685 LYS LYS A . n +A 1 686 ILE 686 686 686 ILE ILE A . n +A 1 687 ARG 687 687 687 ARG ARG A . n +A 1 688 GLY 688 688 688 GLY GLY A . n +A 1 689 LYS 689 689 689 LYS LYS A . n +A 1 690 ILE 690 690 690 ILE ILE A . n +A 1 691 ASN 691 691 691 ASN ASN A . n +A 1 692 LEU 692 692 692 LEU LEU A . n +A 1 693 GLU 693 693 693 GLU GLU A . n +B 1 1 MET 1 1 ? ? ? B . n +B 1 2 ARG 2 2 ? ? ? B . n +B 1 3 ILE 3 3 3 ILE ILE B . n +B 1 4 LEU 4 4 4 LEU LEU B . n +B 1 5 LYS 5 5 5 LYS LYS B . n +B 1 6 ILE 6 6 6 ILE ILE B . n +B 1 7 TYR 7 7 7 TYR TYR B . n +B 1 8 GLU 8 8 8 GLU GLU B . n +B 1 9 ASN 9 9 9 ASN ASN B . n +B 1 10 LYS 10 10 10 LYS LYS B . n +B 1 11 GLY 11 11 11 GLY GLY B . n +B 1 12 VAL 12 12 12 VAL VAL B . n +B 1 13 TYR 13 13 13 TYR TYR B . n +B 1 14 LYS 14 14 14 LYS LYS B . n +B 1 15 VAL 15 15 15 VAL VAL B . n +B 1 16 VAL 16 16 16 VAL VAL B . n +B 1 17 ILE 17 17 17 ILE ILE B . n +B 1 18 GLY 18 18 18 GLY GLY B . n +B 1 19 GLU 19 19 19 GLU GLU B . n +B 1 20 PRO 20 20 20 PRO PRO B . n +B 1 21 PHE 21 21 21 PHE PHE B . n +B 1 22 PRO 22 22 22 PRO PRO B . n +B 1 23 PRO 23 23 23 PRO PRO B . n +B 1 24 ILE 24 24 24 ILE ILE B . n +B 1 25 GLU 25 25 25 GLU GLU B . n +B 1 26 PHE 26 26 26 PHE PHE B . n +B 1 27 PRO 27 27 27 PRO PRO B . n +B 1 28 LEU 28 28 28 LEU LEU B . n +B 1 29 GLU 29 29 29 GLU GLU B . n +B 1 30 GLN 30 30 30 GLN GLN B . n +B 1 31 LYS 31 31 31 LYS LYS B . n +B 1 32 ILE 32 32 32 ILE ILE B . n +B 1 33 SER 33 33 33 SER SER B . n +B 1 34 SER 34 34 34 SER SER B . n +B 1 35 ASN 35 35 35 ASN ASN B . n +B 1 36 LYS 36 36 36 LYS LYS B . n +B 1 37 SER 37 37 37 SER SER B . n +B 1 38 LEU 38 38 38 LEU LEU B . n +B 1 39 SER 39 39 39 SER SER B . n +B 1 40 GLU 40 40 40 GLU GLU B . n +B 1 41 LEU 41 41 41 LEU LEU B . n +B 1 42 GLY 42 42 42 GLY GLY B . n +B 1 43 LEU 43 43 43 LEU LEU B . n +B 1 44 THR 44 44 44 THR THR B . n +B 1 45 ILE 45 45 45 ILE ILE B . n +B 1 46 VAL 46 46 46 VAL VAL B . n +B 1 47 GLN 47 47 47 GLN GLN B . n +B 1 48 GLN 48 48 48 GLN GLN B . n +B 1 49 GLY 49 49 49 GLY GLY B . n +B 1 50 ASN 50 50 50 ASN ASN B . n +B 1 51 LYS 51 51 51 LYS LYS B . n +B 1 52 VAL 52 52 52 VAL VAL B . n +B 1 53 ILE 53 53 53 ILE ILE B . n +B 1 54 VAL 54 54 54 VAL VAL B . n +B 1 55 GLU 55 55 55 GLU GLU B . n +B 1 56 LYS 56 56 56 LYS LYS B . n +B 1 57 SER 57 57 57 SER SER B . n +B 1 58 LEU 58 58 58 LEU LEU B . n +B 1 59 ASP 59 59 59 ASP ASP B . n +B 1 60 LEU 60 60 60 LEU LEU B . n +B 1 61 LYS 61 61 61 LYS LYS B . n +B 1 62 GLU 62 62 62 GLU GLU B . n +B 1 63 HIS 63 63 63 HIS HIS B . n +B 1 64 ILE 64 64 64 ILE ILE B . n +B 1 65 ILE 65 65 65 ILE ILE B . n +B 1 66 GLY 66 66 66 GLY GLY B . n +B 1 67 LEU 67 67 67 LEU LEU B . n +B 1 68 GLY 68 68 68 GLY GLY B . n +B 1 69 GLU 69 69 69 GLU GLU B . n +B 1 70 LYS 70 70 70 LYS LYS B . n +B 1 71 ALA 71 71 71 ALA ALA B . n +B 1 72 PHE 72 72 72 PHE PHE B . n +B 1 73 GLU 73 73 73 GLU GLU B . n +B 1 74 LEU 74 74 74 LEU LEU B . n +B 1 75 ASP 75 75 75 ASP ASP B . n +B 1 76 ARG 76 76 76 ARG ARG B . n +B 1 77 LYS 77 77 77 LYS LYS B . n +B 1 78 ARG 78 78 78 ARG ARG B . n +B 1 79 LYS 79 79 79 LYS LYS B . n +B 1 80 ARG 80 80 80 ARG ARG B . n +B 1 81 TYR 81 81 81 TYR TYR B . n +B 1 82 VAL 82 82 82 VAL VAL B . n +B 1 83 MET 83 83 83 MET MET B . n +B 1 84 TYR 84 84 84 TYR TYR B . n +B 1 85 ASN 85 85 85 ASN ASN B . n +B 1 86 VAL 86 86 86 VAL VAL B . n +B 1 87 ASP 87 87 87 ASP ASP B . n +B 1 88 ALA 88 88 88 ALA ALA B . n +B 1 89 GLY 89 89 89 GLY GLY B . n +B 1 90 ALA 90 90 90 ALA ALA B . n +B 1 91 TYR 91 91 91 TYR TYR B . n +B 1 92 LYS 92 92 92 LYS LYS B . n +B 1 93 LYS 93 93 93 LYS LYS B . n +B 1 94 TYR 94 94 94 TYR TYR B . n +B 1 95 GLN 95 95 95 GLN GLN B . n +B 1 96 ASP 96 96 96 ASP ASP B . n +B 1 97 PRO 97 97 97 PRO PRO B . n +B 1 98 LEU 98 98 98 LEU LEU B . n +B 1 99 TYR 99 99 99 TYR TYR B . n +B 1 100 VAL 100 100 100 VAL VAL B . n +B 1 101 SER 101 101 101 SER SER B . n +B 1 102 ILE 102 102 102 ILE ILE B . n +B 1 103 PRO 103 103 103 PRO PRO B . n +B 1 104 LEU 104 104 104 LEU LEU B . n +B 1 105 PHE 105 105 105 PHE PHE B . n +B 1 106 ILE 106 106 106 ILE ILE B . n +B 1 107 SER 107 107 107 SER SER B . n +B 1 108 VAL 108 108 108 VAL VAL B . n +B 1 109 LYS 109 109 109 LYS LYS B . n +B 1 110 ASP 110 110 110 ASP ASP B . n +B 1 111 GLY 111 111 111 GLY GLY B . n +B 1 112 VAL 112 112 112 VAL VAL B . n +B 1 113 ALA 113 113 113 ALA ALA B . n +B 1 114 THR 114 114 114 THR THR B . n +B 1 115 GLY 115 115 115 GLY GLY B . n +B 1 116 TYR 116 116 116 TYR TYR B . n +B 1 117 PHE 117 117 117 PHE PHE B . n +B 1 118 PHE 118 118 118 PHE PHE B . n +B 1 119 ASN 119 119 119 ASN ASN B . n +B 1 120 SER 120 120 120 SER SER B . n +B 1 121 ALA 121 121 121 ALA ALA B . n +B 1 122 SER 122 122 122 SER SER B . n +B 1 123 LYS 123 123 123 LYS LYS B . n +B 1 124 VAL 124 124 124 VAL VAL B . n +B 1 125 ILE 125 125 125 ILE ILE B . n +B 1 126 PHE 126 126 126 PHE PHE B . n +B 1 127 ASP 127 127 127 ASP ASP B . n +B 1 128 VAL 128 128 128 VAL VAL B . n +B 1 129 GLY 129 129 129 GLY GLY B . n +B 1 130 LEU 130 130 130 LEU LEU B . n +B 1 131 GLU 131 131 131 GLU GLU B . n +B 1 132 GLU 132 132 132 GLU GLU B . n +B 1 133 TYR 133 133 133 TYR TYR B . n +B 1 134 ASP 134 134 134 ASP ASP B . n +B 1 135 LYS 135 135 135 LYS LYS B . n +B 1 136 VAL 136 136 136 VAL VAL B . n +B 1 137 ILE 137 137 137 ILE ILE B . n +B 1 138 VAL 138 138 138 VAL VAL B . n +B 1 139 THR 139 139 139 THR THR B . n +B 1 140 ILE 140 140 140 ILE ILE B . n +B 1 141 PRO 141 141 141 PRO PRO B . n +B 1 142 GLU 142 142 142 GLU GLU B . n +B 1 143 ASP 143 143 143 ASP ASP B . n +B 1 144 SER 144 144 144 SER SER B . n +B 1 145 VAL 145 145 145 VAL VAL B . n +B 1 146 GLU 146 146 146 GLU GLU B . n +B 1 147 PHE 147 147 147 PHE PHE B . n +B 1 148 TYR 148 148 148 TYR TYR B . n +B 1 149 VAL 149 149 149 VAL VAL B . n +B 1 150 ILE 150 150 150 ILE ILE B . n +B 1 151 GLU 151 151 151 GLU GLU B . n +B 1 152 GLY 152 152 152 GLY GLY B . n +B 1 153 PRO 153 153 153 PRO PRO B . n +B 1 154 ARG 154 154 154 ARG ARG B . n +B 1 155 ILE 155 155 155 ILE ILE B . n +B 1 156 GLU 156 156 156 GLU GLU B . n +B 1 157 ASP 157 157 157 ASP ASP B . n +B 1 158 VAL 158 158 158 VAL VAL B . n +B 1 159 LEU 159 159 159 LEU LEU B . n +B 1 160 GLU 160 160 160 GLU GLU B . n +B 1 161 LYS 161 161 161 LYS LYS B . n +B 1 162 TYR 162 162 162 TYR TYR B . n +B 1 163 THR 163 163 163 THR THR B . n +B 1 164 GLU 164 164 164 GLU GLU B . n +B 1 165 LEU 165 165 165 LEU LEU B . n +B 1 166 THR 166 166 166 THR THR B . n +B 1 167 GLY 167 167 167 GLY GLY B . n +B 1 168 LYS 168 168 168 LYS LYS B . n +B 1 169 PRO 169 169 169 PRO PRO B . n +B 1 170 PHE 170 170 170 PHE PHE B . n +B 1 171 LEU 171 171 171 LEU LEU B . n +B 1 172 PRO 172 172 172 PRO PRO B . n +B 1 173 PRO 173 173 173 PRO PRO B . n +B 1 174 MET 174 174 174 MET MET B . n +B 1 175 TRP 175 175 175 TRP TRP B . n +B 1 176 ALA 176 176 176 ALA ALA B . n +B 1 177 PHE 177 177 177 PHE PHE B . n +B 1 178 GLY 178 178 178 GLY GLY B . n +B 1 179 TYR 179 179 179 TYR TYR B . n +B 1 180 MET 180 180 180 MET MET B . n +B 1 181 ILE 181 181 181 ILE ILE B . n +B 1 182 SER 182 182 182 SER SER B . n +B 1 183 ARG 183 183 183 ARG ARG B . n +B 1 184 TYR 184 184 184 TYR TYR B . n +B 1 185 SER 185 185 185 SER SER B . n +B 1 186 TYR 186 186 186 TYR TYR B . n +B 1 187 TYR 187 187 187 TYR TYR B . n +B 1 188 PRO 188 188 188 PRO PRO B . n +B 1 189 GLN 189 189 189 GLN GLN B . n +B 1 190 ASP 190 190 190 ASP ASP B . n +B 1 191 LYS 191 191 191 LYS LYS B . n +B 1 192 VAL 192 192 192 VAL VAL B . n +B 1 193 VAL 193 193 193 VAL VAL B . n +B 1 194 GLU 194 194 194 GLU GLU B . n +B 1 195 LEU 195 195 195 LEU LEU B . n +B 1 196 VAL 196 196 196 VAL VAL B . n +B 1 197 ASP 197 197 197 ASP ASP B . n +B 1 198 ILE 198 198 198 ILE ILE B . n +B 1 199 MET 199 199 199 MET MET B . n +B 1 200 GLN 200 200 200 GLN GLN B . n +B 1 201 LYS 201 201 201 LYS LYS B . n +B 1 202 GLU 202 202 202 GLU GLU B . n +B 1 203 GLY 203 203 203 GLY GLY B . n +B 1 204 PHE 204 204 204 PHE PHE B . n +B 1 205 ARG 205 205 205 ARG ARG B . n +B 1 206 VAL 206 206 206 VAL VAL B . n +B 1 207 ALA 207 207 207 ALA ALA B . n +B 1 208 GLY 208 208 208 GLY GLY B . n +B 1 209 VAL 209 209 209 VAL VAL B . n +B 1 210 PHE 210 210 210 PHE PHE B . n +B 1 211 LEU 211 211 211 LEU LEU B . n +B 1 212 ASP 212 212 212 ASP ASP B . n +B 1 213 ILE 213 213 213 ILE ILE B . n +B 1 214 HIS 214 214 214 HIS HIS B . n +B 1 215 TYR 215 215 215 TYR TYR B . n +B 1 216 MET 216 216 216 MET MET B . n +B 1 217 ASP 217 217 217 ASP ASP B . n +B 1 218 SER 218 218 218 SER SER B . n +B 1 219 TYR 219 219 219 TYR TYR B . n +B 1 220 LYS 220 220 220 LYS LYS B . n +B 1 221 LEU 221 221 221 LEU LEU B . n +B 1 222 PHE 222 222 222 PHE PHE B . n +B 1 223 THR 223 223 223 THR THR B . n +B 1 224 TRP 224 224 224 TRP TRP B . n +B 1 225 HIS 225 225 225 HIS HIS B . n +B 1 226 PRO 226 226 226 PRO PRO B . n +B 1 227 TYR 227 227 227 TYR TYR B . n +B 1 228 ARG 228 228 228 ARG ARG B . n +B 1 229 PHE 229 229 229 PHE PHE B . n +B 1 230 PRO 230 230 230 PRO PRO B . n +B 1 231 GLU 231 231 231 GLU GLU B . n +B 1 232 PRO 232 232 232 PRO PRO B . n +B 1 233 LYS 233 233 233 LYS LYS B . n +B 1 234 LYS 234 234 234 LYS LYS B . n +B 1 235 LEU 235 235 235 LEU LEU B . n +B 1 236 ILE 236 236 236 ILE ILE B . n +B 1 237 ASP 237 237 237 ASP ASP B . n +B 1 238 GLU 238 238 238 GLU GLU B . n +B 1 239 LEU 239 239 239 LEU LEU B . n +B 1 240 HIS 240 240 240 HIS HIS B . n +B 1 241 LYS 241 241 241 LYS LYS B . n +B 1 242 ARG 242 242 242 ARG ARG B . n +B 1 243 ASN 243 243 243 ASN ASN B . n +B 1 244 VAL 244 244 244 VAL VAL B . n +B 1 245 LYS 245 245 245 LYS LYS B . n +B 1 246 LEU 246 246 246 LEU LEU B . n +B 1 247 ILE 247 247 247 ILE ILE B . n +B 1 248 THR 248 248 248 THR THR B . n +B 1 249 ILE 249 249 249 ILE ILE B . n +B 1 250 VAL 250 250 250 VAL VAL B . n +B 1 251 ASP 251 251 251 ASP ASP B . n +B 1 252 HIS 252 252 252 HIS HIS B . n +B 1 253 GLY 253 253 253 GLY GLY B . n +B 1 254 ILE 254 254 254 ILE ILE B . n +B 1 255 ARG 255 255 255 ARG ARG B . n +B 1 256 VAL 256 256 256 VAL VAL B . n +B 1 257 ASP 257 257 257 ASP ASP B . n +B 1 258 GLN 258 258 258 GLN GLN B . n +B 1 259 ASN 259 259 259 ASN ASN B . n +B 1 260 TYR 260 260 260 TYR TYR B . n +B 1 261 SER 261 261 261 SER SER B . n +B 1 262 PRO 262 262 262 PRO PRO B . n +B 1 263 PHE 263 263 263 PHE PHE B . n +B 1 264 LEU 264 264 264 LEU LEU B . n +B 1 265 SER 265 265 265 SER SER B . n +B 1 266 GLY 266 266 266 GLY GLY B . n +B 1 267 MET 267 267 267 MET MET B . n +B 1 268 GLY 268 268 268 GLY GLY B . n +B 1 269 LYS 269 269 269 LYS LYS B . n +B 1 270 PHE 270 270 270 PHE PHE B . n +B 1 271 CYS 271 271 271 CYS CYS B . n +B 1 272 GLU 272 272 272 GLU GLU B . n +B 1 273 ILE 273 273 273 ILE ILE B . n +B 1 274 GLU 274 274 274 GLU GLU B . n +B 1 275 SER 275 275 275 SER SER B . n +B 1 276 GLY 276 276 276 GLY GLY B . n +B 1 277 GLU 277 277 277 GLU GLU B . n +B 1 278 LEU 278 278 278 LEU LEU B . n +B 1 279 PHE 279 279 279 PHE PHE B . n +B 1 280 VAL 280 280 280 VAL VAL B . n +B 1 281 GLY 281 281 281 GLY GLY B . n +B 1 282 LYS 282 282 282 LYS LYS B . n +B 1 283 MET 283 283 283 MET MET B . n +B 1 284 TRP 284 284 284 TRP TRP B . n +B 1 285 PRO 285 285 285 PRO PRO B . n +B 1 286 GLY 286 286 286 GLY GLY B . n +B 1 287 THR 287 287 287 THR THR B . n +B 1 288 THR 288 288 288 THR THR B . n +B 1 289 VAL 289 289 289 VAL VAL B . n +B 1 290 TYR 290 290 290 TYR TYR B . n +B 1 291 PRO 291 291 291 PRO PRO B . n +B 1 292 ASP 292 292 292 ASP ASP B . n +B 1 293 PHE 293 293 293 PHE PHE B . n +B 1 294 PHE 294 294 294 PHE PHE B . n +B 1 295 ARG 295 295 295 ARG ARG B . n +B 1 296 GLU 296 296 296 GLU GLU B . n +B 1 297 ASP 297 297 297 ASP ASP B . n +B 1 298 THR 298 298 298 THR THR B . n +B 1 299 ARG 299 299 299 ARG ARG B . n +B 1 300 GLU 300 300 300 GLU GLU B . n +B 1 301 TRP 301 301 301 TRP TRP B . n +B 1 302 TRP 302 302 302 TRP TRP B . n +B 1 303 ALA 303 303 303 ALA ALA B . n +B 1 304 GLY 304 304 304 GLY GLY B . n +B 1 305 LEU 305 305 305 LEU LEU B . n +B 1 306 ILE 306 306 306 ILE ILE B . n +B 1 307 SER 307 307 307 SER SER B . n +B 1 308 GLU 308 308 308 GLU GLU B . n +B 1 309 TRP 309 309 309 TRP TRP B . n +B 1 310 LEU 310 310 310 LEU LEU B . n +B 1 311 SER 311 311 311 SER SER B . n +B 1 312 GLN 312 312 312 GLN GLN B . n +B 1 313 GLY 313 313 313 GLY GLY B . n +B 1 314 VAL 314 314 314 VAL VAL B . n +B 1 315 ASP 315 315 315 ASP ASP B . n +B 1 316 GLY 316 316 316 GLY GLY B . n +B 1 317 ILE 317 317 317 ILE ILE B . n +B 1 318 TRP 318 318 318 TRP TRP B . n +B 1 319 LEU 319 319 319 LEU LEU B . n +B 1 320 ASP 320 320 320 ASP ASP B . n +B 1 321 MET 321 321 321 MET MET B . n +B 1 322 ASN 322 322 322 ASN ASN B . n +B 1 323 GLU 323 323 323 GLU GLU B . n +B 1 324 PRO 324 324 324 PRO PRO B . n +B 1 325 THR 325 325 325 THR THR B . n +B 1 326 ASP 326 326 326 ASP ASP B . n +B 1 327 PHE 327 327 327 PHE PHE B . n +B 1 328 SER 328 328 328 SER SER B . n +B 1 329 ARG 329 329 329 ARG ARG B . n +B 1 330 ALA 330 330 330 ALA ALA B . n +B 1 331 ILE 331 331 331 ILE ILE B . n +B 1 332 GLU 332 332 332 GLU GLU B . n +B 1 333 ILE 333 333 333 ILE ILE B . n +B 1 334 ARG 334 334 334 ARG ARG B . n +B 1 335 ASP 335 335 335 ASP ASP B . n +B 1 336 VAL 336 336 336 VAL VAL B . n +B 1 337 LEU 337 337 337 LEU LEU B . n +B 1 338 SER 338 338 338 SER SER B . n +B 1 339 SER 339 339 339 SER SER B . n +B 1 340 LEU 340 340 340 LEU LEU B . n +B 1 341 PRO 341 341 341 PRO PRO B . n +B 1 342 VAL 342 342 342 VAL VAL B . n +B 1 343 GLN 343 343 343 GLN GLN B . n +B 1 344 PHE 344 344 344 PHE PHE B . n +B 1 345 ARG 345 345 345 ARG ARG B . n +B 1 346 ASP 346 346 346 ASP ASP B . n +B 1 347 ASP 347 347 347 ASP ASP B . n +B 1 348 ARG 348 348 348 ARG ARG B . n +B 1 349 LEU 349 349 349 LEU LEU B . n +B 1 350 VAL 350 350 350 VAL VAL B . n +B 1 351 THR 351 351 351 THR THR B . n +B 1 352 THR 352 352 352 THR THR B . n +B 1 353 PHE 353 353 353 PHE PHE B . n +B 1 354 PRO 354 354 354 PRO PRO B . n +B 1 355 ASP 355 355 355 ASP ASP B . n +B 1 356 ASN 356 356 356 ASN ASN B . n +B 1 357 VAL 357 357 357 VAL VAL B . n +B 1 358 VAL 358 358 358 VAL VAL B . n +B 1 359 HIS 359 359 359 HIS HIS B . n +B 1 360 TYR 360 360 360 TYR TYR B . n +B 1 361 LEU 361 361 361 LEU LEU B . n +B 1 362 ARG 362 362 362 ARG ARG B . n +B 1 363 GLY 363 363 363 GLY GLY B . n +B 1 364 LYS 364 364 364 LYS LYS B . n +B 1 365 ARG 365 365 365 ARG ARG B . n +B 1 366 VAL 366 366 366 VAL VAL B . n +B 1 367 LYS 367 367 367 LYS LYS B . n +B 1 368 HIS 368 368 368 HIS HIS B . n +B 1 369 GLU 369 369 369 GLU GLU B . n +B 1 370 LYS 370 370 370 LYS LYS B . n +B 1 371 VAL 371 371 371 VAL VAL B . n +B 1 372 ARG 372 372 372 ARG ARG B . n +B 1 373 ASN 373 373 373 ASN ASN B . n +B 1 374 ALA 374 374 374 ALA ALA B . n +B 1 375 TYR 375 375 375 TYR TYR B . n +B 1 376 PRO 376 376 376 PRO PRO B . n +B 1 377 LEU 377 377 377 LEU LEU B . n +B 1 378 TYR 378 378 378 TYR TYR B . n +B 1 379 GLU 379 379 379 GLU GLU B . n +B 1 380 ALA 380 380 380 ALA ALA B . n +B 1 381 MET 381 381 381 MET MET B . n +B 1 382 ALA 382 382 382 ALA ALA B . n +B 1 383 THR 383 383 383 THR THR B . n +B 1 384 PHE 384 384 384 PHE PHE B . n +B 1 385 LYS 385 385 385 LYS LYS B . n +B 1 386 GLY 386 386 386 GLY GLY B . n +B 1 387 PHE 387 387 387 PHE PHE B . n +B 1 388 ARG 388 388 388 ARG ARG B . n +B 1 389 THR 389 389 389 THR THR B . n +B 1 390 SER 390 390 390 SER SER B . n +B 1 391 HIS 391 391 391 HIS HIS B . n +B 1 392 ARG 392 392 392 ARG ARG B . n +B 1 393 ASN 393 393 393 ASN ASN B . n +B 1 394 GLU 394 394 394 GLU GLU B . n +B 1 395 ILE 395 395 395 ILE ILE B . n +B 1 396 PHE 396 396 396 PHE PHE B . n +B 1 397 ILE 397 397 397 ILE ILE B . n +B 1 398 LEU 398 398 398 LEU LEU B . n +B 1 399 SER 399 399 399 SER SER B . n +B 1 400 ARG 400 400 400 ARG ARG B . n +B 1 401 ALA 401 401 401 ALA ALA B . n +B 1 402 GLY 402 402 402 GLY GLY B . n +B 1 403 TYR 403 403 403 TYR TYR B . n +B 1 404 ALA 404 404 404 ALA ALA B . n +B 1 405 GLY 405 405 405 GLY GLY B . n +B 1 406 ILE 406 406 406 ILE ILE B . n +B 1 407 GLN 407 407 407 GLN GLN B . n +B 1 408 ARG 408 408 408 ARG ARG B . n +B 1 409 TYR 409 409 409 TYR TYR B . n +B 1 410 ALA 410 410 410 ALA ALA B . n +B 1 411 PHE 411 411 411 PHE PHE B . n +B 1 412 ILE 412 412 412 ILE ILE B . n +B 1 413 TRP 413 413 413 TRP TRP B . n +B 1 414 THR 414 414 414 THR THR B . n +B 1 415 GLY 415 415 415 GLY GLY B . n +B 1 416 ASP 416 416 416 ASP ASP B . n +B 1 417 ASN 417 417 417 ASN ASN B . n +B 1 418 THR 418 418 418 THR THR B . n +B 1 419 PRO 419 419 419 PRO PRO B . n +B 1 420 SER 420 420 420 SER SER B . n +B 1 421 TRP 421 421 421 TRP TRP B . n +B 1 422 ASP 422 422 422 ASP ASP B . n +B 1 423 ASP 423 423 423 ASP ASP B . n +B 1 424 LEU 424 424 424 LEU LEU B . n +B 1 425 LYS 425 425 425 LYS LYS B . n +B 1 426 LEU 426 426 426 LEU LEU B . n +B 1 427 GLN 427 427 427 GLN GLN B . n +B 1 428 LEU 428 428 428 LEU LEU B . n +B 1 429 GLN 429 429 429 GLN GLN B . n +B 1 430 LEU 430 430 430 LEU LEU B . n +B 1 431 VAL 431 431 431 VAL VAL B . n +B 1 432 LEU 432 432 432 LEU LEU B . n +B 1 433 GLY 433 433 433 GLY GLY B . n +B 1 434 LEU 434 434 434 LEU LEU B . n +B 1 435 SER 435 435 435 SER SER B . n +B 1 436 ILE 436 436 436 ILE ILE B . n +B 1 437 SER 437 437 437 SER SER B . n +B 1 438 GLY 438 438 438 GLY GLY B . n +B 1 439 VAL 439 439 439 VAL VAL B . n +B 1 440 PRO 440 440 440 PRO PRO B . n +B 1 441 PHE 441 441 441 PHE PHE B . n +B 1 442 VAL 442 442 442 VAL VAL B . n +B 1 443 GLY 443 443 443 GLY GLY B . n +B 1 444 CYS 444 444 444 CYS CYS B . n +B 1 445 ASP 445 445 445 ASP ASP B . n +B 1 446 ILE 446 446 446 ILE ILE B . n +B 1 447 GLY 447 447 447 GLY GLY B . n +B 1 448 GLY 448 448 448 GLY GLY B . n +B 1 449 PHE 449 449 449 PHE PHE B . n +B 1 450 GLN 450 450 450 GLN GLN B . n +B 1 451 GLY 451 451 451 GLY GLY B . n +B 1 452 ARG 452 452 452 ARG ARG B . n +B 1 453 ASN 453 453 453 ASN ASN B . n +B 1 454 PHE 454 454 454 PHE PHE B . n +B 1 455 ALA 455 455 455 ALA ALA B . n +B 1 456 GLU 456 456 456 GLU GLU B . n +B 1 457 ILE 457 457 457 ILE ILE B . n +B 1 458 ASP 458 458 458 ASP ASP B . n +B 1 459 ASN 459 459 459 ASN ASN B . n +B 1 460 SER 460 460 460 SER SER B . n +B 1 461 MET 461 461 461 MET MET B . n +B 1 462 ASP 462 462 462 ASP ASP B . n +B 1 463 LEU 463 463 463 LEU LEU B . n +B 1 464 LEU 464 464 464 LEU LEU B . n +B 1 465 VAL 465 465 465 VAL VAL B . n +B 1 466 LYS 466 466 466 LYS LYS B . n +B 1 467 TYR 467 467 467 TYR TYR B . n +B 1 468 TYR 468 468 468 TYR TYR B . n +B 1 469 ALA 469 469 469 ALA ALA B . n +B 1 470 LEU 470 470 470 LEU LEU B . n +B 1 471 ALA 471 471 471 ALA ALA B . n +B 1 472 LEU 472 472 472 LEU LEU B . n +B 1 473 PHE 473 473 473 PHE PHE B . n +B 1 474 PHE 474 474 474 PHE PHE B . n +B 1 475 PRO 475 475 475 PRO PRO B . n +B 1 476 PHE 476 476 476 PHE PHE B . n +B 1 477 TYR 477 477 477 TYR TYR B . n +B 1 478 ARG 478 478 478 ARG ARG B . n +B 1 479 SER 479 479 479 SER SER B . n +B 1 480 HIS 480 480 480 HIS HIS B . n +B 1 481 LYS 481 481 481 LYS LYS B . n +B 1 482 ALA 482 482 482 ALA ALA B . n +B 1 483 THR 483 483 483 THR THR B . n +B 1 484 ASP 484 484 484 ASP ASP B . n +B 1 485 GLY 485 485 485 GLY GLY B . n +B 1 486 ILE 486 486 486 ILE ILE B . n +B 1 487 ASP 487 487 487 ASP ASP B . n +B 1 488 THR 488 488 488 THR THR B . n +B 1 489 GLU 489 489 489 GLU GLU B . n +B 1 490 PRO 490 490 490 PRO PRO B . n +B 1 491 VAL 491 491 491 VAL VAL B . n +B 1 492 PHE 492 492 492 PHE PHE B . n +B 1 493 LEU 493 493 493 LEU LEU B . n +B 1 494 PRO 494 494 494 PRO PRO B . n +B 1 495 ASP 495 495 495 ASP ASP B . n +B 1 496 TYR 496 496 496 TYR TYR B . n +B 1 497 TYR 497 497 497 TYR TYR B . n +B 1 498 LYS 498 498 498 LYS LYS B . n +B 1 499 GLU 499 499 499 GLU GLU B . n +B 1 500 LYS 500 500 500 LYS LYS B . n +B 1 501 VAL 501 501 501 VAL VAL B . n +B 1 502 LYS 502 502 502 LYS LYS B . n +B 1 503 GLU 503 503 503 GLU GLU B . n +B 1 504 ILE 504 504 504 ILE ILE B . n +B 1 505 VAL 505 505 505 VAL VAL B . n +B 1 506 GLU 506 506 506 GLU GLU B . n +B 1 507 LEU 507 507 507 LEU LEU B . n +B 1 508 ARG 508 508 508 ARG ARG B . n +B 1 509 TYR 509 509 509 TYR TYR B . n +B 1 510 LYS 510 510 510 LYS LYS B . n +B 1 511 PHE 511 511 511 PHE PHE B . n +B 1 512 LEU 512 512 512 LEU LEU B . n +B 1 513 PRO 513 513 513 PRO PRO B . n +B 1 514 TYR 514 514 514 TYR TYR B . n +B 1 515 ILE 515 515 515 ILE ILE B . n +B 1 516 TYR 516 516 516 TYR TYR B . n +B 1 517 SER 517 517 517 SER SER B . n +B 1 518 LEU 518 518 518 LEU LEU B . n +B 1 519 ALA 519 519 519 ALA ALA B . n +B 1 520 LEU 520 520 520 LEU LEU B . n +B 1 521 GLU 521 521 521 GLU GLU B . n +B 1 522 ALA 522 522 522 ALA ALA B . n +B 1 523 SER 523 523 523 SER SER B . n +B 1 524 GLU 524 524 524 GLU GLU B . n +B 1 525 LYS 525 525 525 LYS LYS B . n +B 1 526 GLY 526 526 526 GLY GLY B . n +B 1 527 HIS 527 527 527 HIS HIS B . n +B 1 528 PRO 528 528 528 PRO PRO B . n +B 1 529 VAL 529 529 529 VAL VAL B . n +B 1 530 ILE 530 530 530 ILE ILE B . n +B 1 531 ARG 531 531 531 ARG ARG B . n +B 1 532 PRO 532 532 532 PRO PRO B . n +B 1 533 LEU 533 533 533 LEU LEU B . n +B 1 534 PHE 534 534 534 PHE PHE B . n +B 1 535 TYR 535 535 535 TYR TYR B . n +B 1 536 GLU 536 536 536 GLU GLU B . n +B 1 537 PHE 537 537 537 PHE PHE B . n +B 1 538 GLN 538 538 538 GLN GLN B . n +B 1 539 ASP 539 539 539 ASP ASP B . n +B 1 540 ASP 540 540 540 ASP ASP B . n +B 1 541 ASP 541 541 541 ASP ASP B . n +B 1 542 ASP 542 542 542 ASP ASP B . n +B 1 543 MET 543 543 543 MET MET B . n +B 1 544 TYR 544 544 544 TYR TYR B . n +B 1 545 ARG 545 545 545 ARG ARG B . n +B 1 546 ILE 546 546 546 ILE ILE B . n +B 1 547 GLU 547 547 547 GLU GLU B . n +B 1 548 ASP 548 548 548 ASP ASP B . n +B 1 549 GLU 549 549 549 GLU GLU B . n +B 1 550 TYR 550 550 550 TYR TYR B . n +B 1 551 MET 551 551 551 MET MET B . n +B 1 552 VAL 552 552 552 VAL VAL B . n +B 1 553 GLY 553 553 553 GLY GLY B . n +B 1 554 LYS 554 554 554 LYS LYS B . n +B 1 555 TYR 555 555 555 TYR TYR B . n +B 1 556 LEU 556 556 556 LEU LEU B . n +B 1 557 LEU 557 557 557 LEU LEU B . n +B 1 558 TYR 558 558 558 TYR TYR B . n +B 1 559 ALA 559 559 559 ALA ALA B . n +B 1 560 PRO 560 560 560 PRO PRO B . n +B 1 561 ILE 561 561 561 ILE ILE B . n +B 1 562 VAL 562 562 562 VAL VAL B . n +B 1 563 SER 563 563 563 SER SER B . n +B 1 564 LYS 564 564 564 LYS LYS B . n +B 1 565 GLU 565 565 565 GLU GLU B . n +B 1 566 GLU 566 566 566 GLU GLU B . n +B 1 567 SER 567 567 567 SER SER B . n +B 1 568 ARG 568 568 568 ARG ARG B . n +B 1 569 LEU 569 569 569 LEU LEU B . n +B 1 570 VAL 570 570 570 VAL VAL B . n +B 1 571 THR 571 571 571 THR THR B . n +B 1 572 LEU 572 572 572 LEU LEU B . n +B 1 573 PRO 573 573 573 PRO PRO B . n +B 1 574 ARG 574 574 574 ARG ARG B . n +B 1 575 GLY 575 575 575 GLY GLY B . n +B 1 576 LYS 576 576 576 LYS LYS B . n +B 1 577 TRP 577 577 577 TRP TRP B . n +B 1 578 TYR 578 578 578 TYR TYR B . n +B 1 579 ASN 579 579 579 ASN ASN B . n +B 1 580 TYR 580 580 580 TYR TYR B . n +B 1 581 TRP 581 581 581 TRP TRP B . n +B 1 582 ASN 582 582 582 ASN ASN B . n +B 1 583 GLY 583 583 583 GLY GLY B . n +B 1 584 GLU 584 584 584 GLU GLU B . n +B 1 585 ILE 585 585 585 ILE ILE B . n +B 1 586 ILE 586 586 586 ILE ILE B . n +B 1 587 ASN 587 587 587 ASN ASN B . n +B 1 588 GLY 588 588 588 GLY GLY B . n +B 1 589 LYS 589 589 589 LYS LYS B . n +B 1 590 SER 590 590 590 SER SER B . n +B 1 591 VAL 591 591 591 VAL VAL B . n +B 1 592 VAL 592 592 592 VAL VAL B . n +B 1 593 LYS 593 593 593 LYS LYS B . n +B 1 594 SER 594 594 594 SER SER B . n +B 1 595 THR 595 595 595 THR THR B . n +B 1 596 HIS 596 596 596 HIS HIS B . n +B 1 597 GLU 597 597 597 GLU GLU B . n +B 1 598 LEU 598 598 598 LEU LEU B . n +B 1 599 PRO 599 599 599 PRO PRO B . n +B 1 600 ILE 600 600 600 ILE ILE B . n +B 1 601 TYR 601 601 601 TYR TYR B . n +B 1 602 LEU 602 602 602 LEU LEU B . n +B 1 603 ARG 603 603 603 ARG ARG B . n +B 1 604 GLU 604 604 604 GLU GLU B . n +B 1 605 GLY 605 605 605 GLY GLY B . n +B 1 606 SER 606 606 606 SER SER B . n +B 1 607 ILE 607 607 607 ILE ILE B . n +B 1 608 ILE 608 608 608 ILE ILE B . n +B 1 609 PRO 609 609 609 PRO PRO B . n +B 1 610 LEU 610 610 610 LEU LEU B . n +B 1 611 GLU 611 611 611 GLU GLU B . n +B 1 612 GLY 612 612 612 GLY GLY B . n +B 1 613 ASP 613 613 613 ASP ASP B . n +B 1 614 GLU 614 614 614 GLU GLU B . n +B 1 615 LEU 615 615 615 LEU LEU B . n +B 1 616 ILE 616 616 616 ILE ILE B . n +B 1 617 VAL 617 617 617 VAL VAL B . n +B 1 618 TYR 618 618 618 TYR TYR B . n +B 1 619 GLY 619 619 619 GLY GLY B . n +B 1 620 GLU 620 620 620 GLU GLU B . n +B 1 621 THR 621 621 621 THR THR B . n +B 1 622 SER 622 622 622 SER SER B . n +B 1 623 PHE 623 623 623 PHE PHE B . n +B 1 624 LYS 624 624 624 LYS LYS B . n +B 1 625 ARG 625 625 625 ARG ARG B . n +B 1 626 TYR 626 626 626 TYR TYR B . n +B 1 627 ASP 627 627 627 ASP ASP B . n +B 1 628 ASN 628 628 628 ASN ASN B . n +B 1 629 ALA 629 629 629 ALA ALA B . n +B 1 630 GLU 630 630 630 GLU GLU B . n +B 1 631 ILE 631 631 631 ILE ILE B . n +B 1 632 THR 632 632 632 THR THR B . n +B 1 633 SER 633 633 633 SER SER B . n +B 1 634 SER 634 634 634 SER SER B . n +B 1 635 SER 635 635 635 SER SER B . n +B 1 636 ASN 636 636 636 ASN ASN B . n +B 1 637 GLU 637 637 637 GLU GLU B . n +B 1 638 ILE 638 638 638 ILE ILE B . n +B 1 639 LYS 639 639 639 LYS LYS B . n +B 1 640 PHE 640 640 640 PHE PHE B . n +B 1 641 SER 641 641 641 SER SER B . n +B 1 642 ARG 642 642 642 ARG ARG B . n +B 1 643 GLU 643 643 643 GLU GLU B . n +B 1 644 ILE 644 644 644 ILE ILE B . n +B 1 645 TYR 645 645 645 TYR TYR B . n +B 1 646 VAL 646 646 646 VAL VAL B . n +B 1 647 SER 647 647 647 SER SER B . n +B 1 648 LYS 648 648 648 LYS LYS B . n +B 1 649 LEU 649 649 649 LEU LEU B . n +B 1 650 THR 650 650 650 THR THR B . n +B 1 651 ILE 651 651 651 ILE ILE B . n +B 1 652 THR 652 652 652 THR THR B . n +B 1 653 SER 653 653 653 SER SER B . n +B 1 654 GLU 654 654 654 GLU GLU B . n +B 1 655 LYS 655 655 655 LYS LYS B . n +B 1 656 PRO 656 656 656 PRO PRO B . n +B 1 657 VAL 657 657 657 VAL VAL B . n +B 1 658 SER 658 658 658 SER SER B . n +B 1 659 LYS 659 659 659 LYS LYS B . n +B 1 660 ILE 660 660 660 ILE ILE B . n +B 1 661 ILE 661 661 661 ILE ILE B . n +B 1 662 VAL 662 662 662 VAL VAL B . n +B 1 663 ASP 663 663 663 ASP ASP B . n +B 1 664 ASP 664 664 664 ASP ASP B . n +B 1 665 SER 665 665 665 SER SER B . n +B 1 666 LYS 666 666 666 LYS LYS B . n +B 1 667 GLU 667 667 667 GLU GLU B . n +B 1 668 ILE 668 668 668 ILE ILE B . n +B 1 669 GLN 669 669 669 GLN GLN B . n +B 1 670 VAL 670 670 670 VAL VAL B . n +B 1 671 GLU 671 671 671 GLU GLU B . n +B 1 672 LYS 672 672 672 LYS LYS B . n +B 1 673 THR 673 673 673 THR THR B . n +B 1 674 MET 674 674 674 MET MET B . n +B 1 675 GLN 675 675 675 GLN GLN B . n +B 1 676 ASN 676 676 676 ASN ASN B . n +B 1 677 THR 677 677 677 THR THR B . n +B 1 678 TYR 678 678 678 TYR TYR B . n +B 1 679 VAL 679 679 679 VAL VAL B . n +B 1 680 ALA 680 680 680 ALA ALA B . n +B 1 681 LYS 681 681 681 LYS LYS B . n +B 1 682 ILE 682 682 682 ILE ILE B . n +B 1 683 ASN 683 683 683 ASN ASN B . n +B 1 684 GLN 684 684 684 GLN GLN B . n +B 1 685 LYS 685 685 685 LYS LYS B . n +B 1 686 ILE 686 686 686 ILE ILE B . n +B 1 687 ARG 687 687 687 ARG ARG B . n +B 1 688 GLY 688 688 688 GLY GLY B . n +B 1 689 LYS 689 689 689 LYS LYS B . n +B 1 690 ILE 690 690 690 ILE ILE B . n +B 1 691 ASN 691 691 691 ASN ASN B . n +B 1 692 LEU 692 692 692 LEU LEU B . n +B 1 693 GLU 693 693 693 GLU GLU B . n +C 1 1 MET 1 1 ? ? ? C . n +C 1 2 ARG 2 2 ? ? ? C . n +C 1 3 ILE 3 3 3 ILE ILE C . n +C 1 4 LEU 4 4 4 LEU LEU C . n +C 1 5 LYS 5 5 5 LYS LYS C . n +C 1 6 ILE 6 6 6 ILE ILE C . n +C 1 7 TYR 7 7 7 TYR TYR C . n +C 1 8 GLU 8 8 8 GLU GLU C . n +C 1 9 ASN 9 9 9 ASN ASN C . n +C 1 10 LYS 10 10 10 LYS LYS C . n +C 1 11 GLY 11 11 11 GLY GLY C . n +C 1 12 VAL 12 12 12 VAL VAL C . n +C 1 13 TYR 13 13 13 TYR TYR C . n +C 1 14 LYS 14 14 14 LYS LYS C . n +C 1 15 VAL 15 15 15 VAL VAL C . n +C 1 16 VAL 16 16 16 VAL VAL C . n +C 1 17 ILE 17 17 17 ILE ILE C . n +C 1 18 GLY 18 18 18 GLY GLY C . n +C 1 19 GLU 19 19 19 GLU GLU C . n +C 1 20 PRO 20 20 20 PRO PRO C . n +C 1 21 PHE 21 21 21 PHE PHE C . n +C 1 22 PRO 22 22 22 PRO PRO C . n +C 1 23 PRO 23 23 23 PRO PRO C . n +C 1 24 ILE 24 24 24 ILE ILE C . n +C 1 25 GLU 25 25 25 GLU GLU C . n +C 1 26 PHE 26 26 26 PHE PHE C . n +C 1 27 PRO 27 27 27 PRO PRO C . n +C 1 28 LEU 28 28 28 LEU LEU C . n +C 1 29 GLU 29 29 29 GLU GLU C . n +C 1 30 GLN 30 30 30 GLN GLN C . n +C 1 31 LYS 31 31 31 LYS LYS C . n +C 1 32 ILE 32 32 32 ILE ILE C . n +C 1 33 SER 33 33 33 SER SER C . n +C 1 34 SER 34 34 34 SER SER C . n +C 1 35 ASN 35 35 35 ASN ASN C . n +C 1 36 LYS 36 36 36 LYS LYS C . n +C 1 37 SER 37 37 37 SER SER C . n +C 1 38 LEU 38 38 38 LEU LEU C . n +C 1 39 SER 39 39 39 SER SER C . n +C 1 40 GLU 40 40 40 GLU GLU C . n +C 1 41 LEU 41 41 41 LEU LEU C . n +C 1 42 GLY 42 42 42 GLY GLY C . n +C 1 43 LEU 43 43 43 LEU LEU C . n +C 1 44 THR 44 44 44 THR THR C . n +C 1 45 ILE 45 45 45 ILE ILE C . n +C 1 46 VAL 46 46 46 VAL VAL C . n +C 1 47 GLN 47 47 47 GLN GLN C . n +C 1 48 GLN 48 48 48 GLN GLN C . n +C 1 49 GLY 49 49 49 GLY GLY C . n +C 1 50 ASN 50 50 50 ASN ASN C . n +C 1 51 LYS 51 51 51 LYS LYS C . n +C 1 52 VAL 52 52 52 VAL VAL C . n +C 1 53 ILE 53 53 53 ILE ILE C . n +C 1 54 VAL 54 54 54 VAL VAL C . n +C 1 55 GLU 55 55 55 GLU GLU C . n +C 1 56 LYS 56 56 56 LYS LYS C . n +C 1 57 SER 57 57 57 SER SER C . n +C 1 58 LEU 58 58 58 LEU LEU C . n +C 1 59 ASP 59 59 59 ASP ASP C . n +C 1 60 LEU 60 60 60 LEU LEU C . n +C 1 61 LYS 61 61 61 LYS LYS C . n +C 1 62 GLU 62 62 62 GLU GLU C . n +C 1 63 HIS 63 63 63 HIS HIS C . n +C 1 64 ILE 64 64 64 ILE ILE C . n +C 1 65 ILE 65 65 65 ILE ILE C . n +C 1 66 GLY 66 66 66 GLY GLY C . n +C 1 67 LEU 67 67 67 LEU LEU C . n +C 1 68 GLY 68 68 68 GLY GLY C . n +C 1 69 GLU 69 69 69 GLU GLU C . n +C 1 70 LYS 70 70 70 LYS LYS C . n +C 1 71 ALA 71 71 71 ALA ALA C . n +C 1 72 PHE 72 72 72 PHE PHE C . n +C 1 73 GLU 73 73 73 GLU GLU C . n +C 1 74 LEU 74 74 74 LEU LEU C . n +C 1 75 ASP 75 75 75 ASP ASP C . n +C 1 76 ARG 76 76 76 ARG ARG C . n +C 1 77 LYS 77 77 77 LYS LYS C . n +C 1 78 ARG 78 78 78 ARG ARG C . n +C 1 79 LYS 79 79 79 LYS LYS C . n +C 1 80 ARG 80 80 80 ARG ARG C . n +C 1 81 TYR 81 81 81 TYR TYR C . n +C 1 82 VAL 82 82 82 VAL VAL C . n +C 1 83 MET 83 83 83 MET MET C . n +C 1 84 TYR 84 84 84 TYR TYR C . n +C 1 85 ASN 85 85 85 ASN ASN C . n +C 1 86 VAL 86 86 86 VAL VAL C . n +C 1 87 ASP 87 87 87 ASP ASP C . n +C 1 88 ALA 88 88 88 ALA ALA C . n +C 1 89 GLY 89 89 89 GLY GLY C . n +C 1 90 ALA 90 90 90 ALA ALA C . n +C 1 91 TYR 91 91 91 TYR TYR C . n +C 1 92 LYS 92 92 92 LYS LYS C . n +C 1 93 LYS 93 93 93 LYS LYS C . n +C 1 94 TYR 94 94 94 TYR TYR C . n +C 1 95 GLN 95 95 95 GLN GLN C . n +C 1 96 ASP 96 96 96 ASP ASP C . n +C 1 97 PRO 97 97 97 PRO PRO C . n +C 1 98 LEU 98 98 98 LEU LEU C . n +C 1 99 TYR 99 99 99 TYR TYR C . n +C 1 100 VAL 100 100 100 VAL VAL C . n +C 1 101 SER 101 101 101 SER SER C . n +C 1 102 ILE 102 102 102 ILE ILE C . n +C 1 103 PRO 103 103 103 PRO PRO C . n +C 1 104 LEU 104 104 104 LEU LEU C . n +C 1 105 PHE 105 105 105 PHE PHE C . n +C 1 106 ILE 106 106 106 ILE ILE C . n +C 1 107 SER 107 107 107 SER SER C . n +C 1 108 VAL 108 108 108 VAL VAL C . n +C 1 109 LYS 109 109 109 LYS LYS C . n +C 1 110 ASP 110 110 110 ASP ASP C . n +C 1 111 GLY 111 111 111 GLY GLY C . n +C 1 112 VAL 112 112 112 VAL VAL C . n +C 1 113 ALA 113 113 113 ALA ALA C . n +C 1 114 THR 114 114 114 THR THR C . n +C 1 115 GLY 115 115 115 GLY GLY C . n +C 1 116 TYR 116 116 116 TYR TYR C . n +C 1 117 PHE 117 117 117 PHE PHE C . n +C 1 118 PHE 118 118 118 PHE PHE C . n +C 1 119 ASN 119 119 119 ASN ASN C . n +C 1 120 SER 120 120 120 SER SER C . n +C 1 121 ALA 121 121 121 ALA ALA C . n +C 1 122 SER 122 122 122 SER SER C . n +C 1 123 LYS 123 123 123 LYS LYS C . n +C 1 124 VAL 124 124 124 VAL VAL C . n +C 1 125 ILE 125 125 125 ILE ILE C . n +C 1 126 PHE 126 126 126 PHE PHE C . n +C 1 127 ASP 127 127 127 ASP ASP C . n +C 1 128 VAL 128 128 128 VAL VAL C . n +C 1 129 GLY 129 129 129 GLY GLY C . n +C 1 130 LEU 130 130 130 LEU LEU C . n +C 1 131 GLU 131 131 131 GLU GLU C . n +C 1 132 GLU 132 132 132 GLU GLU C . n +C 1 133 TYR 133 133 133 TYR TYR C . n +C 1 134 ASP 134 134 134 ASP ASP C . n +C 1 135 LYS 135 135 135 LYS LYS C . n +C 1 136 VAL 136 136 136 VAL VAL C . n +C 1 137 ILE 137 137 137 ILE ILE C . n +C 1 138 VAL 138 138 138 VAL VAL C . n +C 1 139 THR 139 139 139 THR THR C . n +C 1 140 ILE 140 140 140 ILE ILE C . n +C 1 141 PRO 141 141 141 PRO PRO C . n +C 1 142 GLU 142 142 142 GLU GLU C . n +C 1 143 ASP 143 143 143 ASP ASP C . n +C 1 144 SER 144 144 144 SER SER C . n +C 1 145 VAL 145 145 145 VAL VAL C . n +C 1 146 GLU 146 146 146 GLU GLU C . n +C 1 147 PHE 147 147 147 PHE PHE C . n +C 1 148 TYR 148 148 148 TYR TYR C . n +C 1 149 VAL 149 149 149 VAL VAL C . n +C 1 150 ILE 150 150 150 ILE ILE C . n +C 1 151 GLU 151 151 151 GLU GLU C . n +C 1 152 GLY 152 152 152 GLY GLY C . n +C 1 153 PRO 153 153 153 PRO PRO C . n +C 1 154 ARG 154 154 154 ARG ARG C . n +C 1 155 ILE 155 155 155 ILE ILE C . n +C 1 156 GLU 156 156 156 GLU GLU C . n +C 1 157 ASP 157 157 157 ASP ASP C . n +C 1 158 VAL 158 158 158 VAL VAL C . n +C 1 159 LEU 159 159 159 LEU LEU C . n +C 1 160 GLU 160 160 160 GLU GLU C . n +C 1 161 LYS 161 161 161 LYS LYS C . n +C 1 162 TYR 162 162 162 TYR TYR C . n +C 1 163 THR 163 163 163 THR THR C . n +C 1 164 GLU 164 164 164 GLU GLU C . n +C 1 165 LEU 165 165 165 LEU LEU C . n +C 1 166 THR 166 166 166 THR THR C . n +C 1 167 GLY 167 167 167 GLY GLY C . n +C 1 168 LYS 168 168 168 LYS LYS C . n +C 1 169 PRO 169 169 169 PRO PRO C . n +C 1 170 PHE 170 170 170 PHE PHE C . n +C 1 171 LEU 171 171 171 LEU LEU C . n +C 1 172 PRO 172 172 172 PRO PRO C . n +C 1 173 PRO 173 173 173 PRO PRO C . n +C 1 174 MET 174 174 174 MET MET C . n +C 1 175 TRP 175 175 175 TRP TRP C . n +C 1 176 ALA 176 176 176 ALA ALA C . n +C 1 177 PHE 177 177 177 PHE PHE C . n +C 1 178 GLY 178 178 178 GLY GLY C . n +C 1 179 TYR 179 179 179 TYR TYR C . n +C 1 180 MET 180 180 180 MET MET C . n +C 1 181 ILE 181 181 181 ILE ILE C . n +C 1 182 SER 182 182 182 SER SER C . n +C 1 183 ARG 183 183 183 ARG ARG C . n +C 1 184 TYR 184 184 184 TYR TYR C . n +C 1 185 SER 185 185 185 SER SER C . n +C 1 186 TYR 186 186 186 TYR TYR C . n +C 1 187 TYR 187 187 187 TYR TYR C . n +C 1 188 PRO 188 188 188 PRO PRO C . n +C 1 189 GLN 189 189 189 GLN GLN C . n +C 1 190 ASP 190 190 190 ASP ASP C . n +C 1 191 LYS 191 191 191 LYS LYS C . n +C 1 192 VAL 192 192 192 VAL VAL C . n +C 1 193 VAL 193 193 193 VAL VAL C . n +C 1 194 GLU 194 194 194 GLU GLU C . n +C 1 195 LEU 195 195 195 LEU LEU C . n +C 1 196 VAL 196 196 196 VAL VAL C . n +C 1 197 ASP 197 197 197 ASP ASP C . n +C 1 198 ILE 198 198 198 ILE ILE C . n +C 1 199 MET 199 199 199 MET MET C . n +C 1 200 GLN 200 200 200 GLN GLN C . n +C 1 201 LYS 201 201 201 LYS LYS C . n +C 1 202 GLU 202 202 202 GLU GLU C . n +C 1 203 GLY 203 203 203 GLY GLY C . n +C 1 204 PHE 204 204 204 PHE PHE C . n +C 1 205 ARG 205 205 205 ARG ARG C . n +C 1 206 VAL 206 206 206 VAL VAL C . n +C 1 207 ALA 207 207 207 ALA ALA C . n +C 1 208 GLY 208 208 208 GLY GLY C . n +C 1 209 VAL 209 209 209 VAL VAL C . n +C 1 210 PHE 210 210 210 PHE PHE C . n +C 1 211 LEU 211 211 211 LEU LEU C . n +C 1 212 ASP 212 212 212 ASP ASP C . n +C 1 213 ILE 213 213 213 ILE ILE C . n +C 1 214 HIS 214 214 214 HIS HIS C . n +C 1 215 TYR 215 215 215 TYR TYR C . n +C 1 216 MET 216 216 216 MET MET C . n +C 1 217 ASP 217 217 217 ASP ASP C . n +C 1 218 SER 218 218 218 SER SER C . n +C 1 219 TYR 219 219 219 TYR TYR C . n +C 1 220 LYS 220 220 220 LYS LYS C . n +C 1 221 LEU 221 221 221 LEU LEU C . n +C 1 222 PHE 222 222 222 PHE PHE C . n +C 1 223 THR 223 223 223 THR THR C . n +C 1 224 TRP 224 224 224 TRP TRP C . n +C 1 225 HIS 225 225 225 HIS HIS C . n +C 1 226 PRO 226 226 226 PRO PRO C . n +C 1 227 TYR 227 227 227 TYR TYR C . n +C 1 228 ARG 228 228 228 ARG ARG C . n +C 1 229 PHE 229 229 229 PHE PHE C . n +C 1 230 PRO 230 230 230 PRO PRO C . n +C 1 231 GLU 231 231 231 GLU GLU C . n +C 1 232 PRO 232 232 232 PRO PRO C . n +C 1 233 LYS 233 233 233 LYS LYS C . n +C 1 234 LYS 234 234 234 LYS LYS C . n +C 1 235 LEU 235 235 235 LEU LEU C . n +C 1 236 ILE 236 236 236 ILE ILE C . n +C 1 237 ASP 237 237 237 ASP ASP C . n +C 1 238 GLU 238 238 238 GLU GLU C . n +C 1 239 LEU 239 239 239 LEU LEU C . n +C 1 240 HIS 240 240 240 HIS HIS C . n +C 1 241 LYS 241 241 241 LYS LYS C . n +C 1 242 ARG 242 242 242 ARG ARG C . n +C 1 243 ASN 243 243 243 ASN ASN C . n +C 1 244 VAL 244 244 244 VAL VAL C . n +C 1 245 LYS 245 245 245 LYS LYS C . n +C 1 246 LEU 246 246 246 LEU LEU C . n +C 1 247 ILE 247 247 247 ILE ILE C . n +C 1 248 THR 248 248 248 THR THR C . n +C 1 249 ILE 249 249 249 ILE ILE C . n +C 1 250 VAL 250 250 250 VAL VAL C . n +C 1 251 ASP 251 251 251 ASP ASP C . n +C 1 252 HIS 252 252 252 HIS HIS C . n +C 1 253 GLY 253 253 253 GLY GLY C . n +C 1 254 ILE 254 254 254 ILE ILE C . n +C 1 255 ARG 255 255 255 ARG ARG C . n +C 1 256 VAL 256 256 256 VAL VAL C . n +C 1 257 ASP 257 257 257 ASP ASP C . n +C 1 258 GLN 258 258 258 GLN GLN C . n +C 1 259 ASN 259 259 259 ASN ASN C . n +C 1 260 TYR 260 260 260 TYR TYR C . n +C 1 261 SER 261 261 261 SER SER C . n +C 1 262 PRO 262 262 262 PRO PRO C . n +C 1 263 PHE 263 263 263 PHE PHE C . n +C 1 264 LEU 264 264 264 LEU LEU C . n +C 1 265 SER 265 265 265 SER SER C . n +C 1 266 GLY 266 266 266 GLY GLY C . n +C 1 267 MET 267 267 267 MET MET C . n +C 1 268 GLY 268 268 268 GLY GLY C . n +C 1 269 LYS 269 269 269 LYS LYS C . n +C 1 270 PHE 270 270 270 PHE PHE C . n +C 1 271 CYS 271 271 271 CYS CYS C . n +C 1 272 GLU 272 272 272 GLU GLU C . n +C 1 273 ILE 273 273 273 ILE ILE C . n +C 1 274 GLU 274 274 274 GLU GLU C . n +C 1 275 SER 275 275 275 SER SER C . n +C 1 276 GLY 276 276 276 GLY GLY C . n +C 1 277 GLU 277 277 277 GLU GLU C . n +C 1 278 LEU 278 278 278 LEU LEU C . n +C 1 279 PHE 279 279 279 PHE PHE C . n +C 1 280 VAL 280 280 280 VAL VAL C . n +C 1 281 GLY 281 281 281 GLY GLY C . n +C 1 282 LYS 282 282 282 LYS LYS C . n +C 1 283 MET 283 283 283 MET MET C . n +C 1 284 TRP 284 284 284 TRP TRP C . n +C 1 285 PRO 285 285 285 PRO PRO C . n +C 1 286 GLY 286 286 286 GLY GLY C . n +C 1 287 THR 287 287 287 THR THR C . n +C 1 288 THR 288 288 288 THR THR C . n +C 1 289 VAL 289 289 289 VAL VAL C . n +C 1 290 TYR 290 290 290 TYR TYR C . n +C 1 291 PRO 291 291 291 PRO PRO C . n +C 1 292 ASP 292 292 292 ASP ASP C . n +C 1 293 PHE 293 293 293 PHE PHE C . n +C 1 294 PHE 294 294 294 PHE PHE C . n +C 1 295 ARG 295 295 295 ARG ARG C . n +C 1 296 GLU 296 296 296 GLU GLU C . n +C 1 297 ASP 297 297 297 ASP ASP C . n +C 1 298 THR 298 298 298 THR THR C . n +C 1 299 ARG 299 299 299 ARG ARG C . n +C 1 300 GLU 300 300 300 GLU GLU C . n +C 1 301 TRP 301 301 301 TRP TRP C . n +C 1 302 TRP 302 302 302 TRP TRP C . n +C 1 303 ALA 303 303 303 ALA ALA C . n +C 1 304 GLY 304 304 304 GLY GLY C . n +C 1 305 LEU 305 305 305 LEU LEU C . n +C 1 306 ILE 306 306 306 ILE ILE C . n +C 1 307 SER 307 307 307 SER SER C . n +C 1 308 GLU 308 308 308 GLU GLU C . n +C 1 309 TRP 309 309 309 TRP TRP C . n +C 1 310 LEU 310 310 310 LEU LEU C . n +C 1 311 SER 311 311 311 SER SER C . n +C 1 312 GLN 312 312 312 GLN GLN C . n +C 1 313 GLY 313 313 313 GLY GLY C . n +C 1 314 VAL 314 314 314 VAL VAL C . n +C 1 315 ASP 315 315 315 ASP ASP C . n +C 1 316 GLY 316 316 316 GLY GLY C . n +C 1 317 ILE 317 317 317 ILE ILE C . n +C 1 318 TRP 318 318 318 TRP TRP C . n +C 1 319 LEU 319 319 319 LEU LEU C . n +C 1 320 ASP 320 320 320 ASP ASP C . n +C 1 321 MET 321 321 321 MET MET C . n +C 1 322 ASN 322 322 322 ASN ASN C . n +C 1 323 GLU 323 323 323 GLU GLU C . n +C 1 324 PRO 324 324 324 PRO PRO C . n +C 1 325 THR 325 325 325 THR THR C . n +C 1 326 ASP 326 326 326 ASP ASP C . n +C 1 327 PHE 327 327 327 PHE PHE C . n +C 1 328 SER 328 328 328 SER SER C . n +C 1 329 ARG 329 329 329 ARG ARG C . n +C 1 330 ALA 330 330 330 ALA ALA C . n +C 1 331 ILE 331 331 331 ILE ILE C . n +C 1 332 GLU 332 332 332 GLU GLU C . n +C 1 333 ILE 333 333 333 ILE ILE C . n +C 1 334 ARG 334 334 334 ARG ARG C . n +C 1 335 ASP 335 335 335 ASP ASP C . n +C 1 336 VAL 336 336 336 VAL VAL C . n +C 1 337 LEU 337 337 337 LEU LEU C . n +C 1 338 SER 338 338 338 SER SER C . n +C 1 339 SER 339 339 339 SER SER C . n +C 1 340 LEU 340 340 340 LEU LEU C . n +C 1 341 PRO 341 341 341 PRO PRO C . n +C 1 342 VAL 342 342 342 VAL VAL C . n +C 1 343 GLN 343 343 343 GLN GLN C . n +C 1 344 PHE 344 344 344 PHE PHE C . n +C 1 345 ARG 345 345 345 ARG ARG C . n +C 1 346 ASP 346 346 346 ASP ASP C . n +C 1 347 ASP 347 347 347 ASP ASP C . n +C 1 348 ARG 348 348 348 ARG ARG C . n +C 1 349 LEU 349 349 349 LEU LEU C . n +C 1 350 VAL 350 350 350 VAL VAL C . n +C 1 351 THR 351 351 351 THR THR C . n +C 1 352 THR 352 352 352 THR THR C . n +C 1 353 PHE 353 353 353 PHE PHE C . n +C 1 354 PRO 354 354 354 PRO PRO C . n +C 1 355 ASP 355 355 355 ASP ASP C . n +C 1 356 ASN 356 356 356 ASN ASN C . n +C 1 357 VAL 357 357 357 VAL VAL C . n +C 1 358 VAL 358 358 358 VAL VAL C . n +C 1 359 HIS 359 359 359 HIS HIS C . n +C 1 360 TYR 360 360 360 TYR TYR C . n +C 1 361 LEU 361 361 361 LEU LEU C . n +C 1 362 ARG 362 362 362 ARG ARG C . n +C 1 363 GLY 363 363 363 GLY GLY C . n +C 1 364 LYS 364 364 364 LYS LYS C . n +C 1 365 ARG 365 365 365 ARG ARG C . n +C 1 366 VAL 366 366 366 VAL VAL C . n +C 1 367 LYS 367 367 367 LYS LYS C . n +C 1 368 HIS 368 368 368 HIS HIS C . n +C 1 369 GLU 369 369 369 GLU GLU C . n +C 1 370 LYS 370 370 370 LYS LYS C . n +C 1 371 VAL 371 371 371 VAL VAL C . n +C 1 372 ARG 372 372 372 ARG ARG C . n +C 1 373 ASN 373 373 373 ASN ASN C . n +C 1 374 ALA 374 374 374 ALA ALA C . n +C 1 375 TYR 375 375 375 TYR TYR C . n +C 1 376 PRO 376 376 376 PRO PRO C . n +C 1 377 LEU 377 377 377 LEU LEU C . n +C 1 378 TYR 378 378 378 TYR TYR C . n +C 1 379 GLU 379 379 379 GLU GLU C . n +C 1 380 ALA 380 380 380 ALA ALA C . n +C 1 381 MET 381 381 381 MET MET C . n +C 1 382 ALA 382 382 382 ALA ALA C . n +C 1 383 THR 383 383 383 THR THR C . n +C 1 384 PHE 384 384 384 PHE PHE C . n +C 1 385 LYS 385 385 385 LYS LYS C . n +C 1 386 GLY 386 386 386 GLY GLY C . n +C 1 387 PHE 387 387 387 PHE PHE C . n +C 1 388 ARG 388 388 388 ARG ARG C . n +C 1 389 THR 389 389 389 THR THR C . n +C 1 390 SER 390 390 390 SER SER C . n +C 1 391 HIS 391 391 391 HIS HIS C . n +C 1 392 ARG 392 392 392 ARG ARG C . n +C 1 393 ASN 393 393 393 ASN ASN C . n +C 1 394 GLU 394 394 394 GLU GLU C . n +C 1 395 ILE 395 395 395 ILE ILE C . n +C 1 396 PHE 396 396 396 PHE PHE C . n +C 1 397 ILE 397 397 397 ILE ILE C . n +C 1 398 LEU 398 398 398 LEU LEU C . n +C 1 399 SER 399 399 399 SER SER C . n +C 1 400 ARG 400 400 400 ARG ARG C . n +C 1 401 ALA 401 401 401 ALA ALA C . n +C 1 402 GLY 402 402 402 GLY GLY C . n +C 1 403 TYR 403 403 403 TYR TYR C . n +C 1 404 ALA 404 404 404 ALA ALA C . n +C 1 405 GLY 405 405 405 GLY GLY C . n +C 1 406 ILE 406 406 406 ILE ILE C . n +C 1 407 GLN 407 407 407 GLN GLN C . n +C 1 408 ARG 408 408 408 ARG ARG C . n +C 1 409 TYR 409 409 409 TYR TYR C . n +C 1 410 ALA 410 410 410 ALA ALA C . n +C 1 411 PHE 411 411 411 PHE PHE C . n +C 1 412 ILE 412 412 412 ILE ILE C . n +C 1 413 TRP 413 413 413 TRP TRP C . n +C 1 414 THR 414 414 414 THR THR C . n +C 1 415 GLY 415 415 415 GLY GLY C . n +C 1 416 ASP 416 416 416 ASP ASP C . n +C 1 417 ASN 417 417 417 ASN ASN C . n +C 1 418 THR 418 418 418 THR THR C . n +C 1 419 PRO 419 419 419 PRO PRO C . n +C 1 420 SER 420 420 420 SER SER C . n +C 1 421 TRP 421 421 421 TRP TRP C . n +C 1 422 ASP 422 422 422 ASP ASP C . n +C 1 423 ASP 423 423 423 ASP ASP C . n +C 1 424 LEU 424 424 424 LEU LEU C . n +C 1 425 LYS 425 425 425 LYS LYS C . n +C 1 426 LEU 426 426 426 LEU LEU C . n +C 1 427 GLN 427 427 427 GLN GLN C . n +C 1 428 LEU 428 428 428 LEU LEU C . n +C 1 429 GLN 429 429 429 GLN GLN C . n +C 1 430 LEU 430 430 430 LEU LEU C . n +C 1 431 VAL 431 431 431 VAL VAL C . n +C 1 432 LEU 432 432 432 LEU LEU C . n +C 1 433 GLY 433 433 433 GLY GLY C . n +C 1 434 LEU 434 434 434 LEU LEU C . n +C 1 435 SER 435 435 435 SER SER C . n +C 1 436 ILE 436 436 436 ILE ILE C . n +C 1 437 SER 437 437 437 SER SER C . n +C 1 438 GLY 438 438 438 GLY GLY C . n +C 1 439 VAL 439 439 439 VAL VAL C . n +C 1 440 PRO 440 440 440 PRO PRO C . n +C 1 441 PHE 441 441 441 PHE PHE C . n +C 1 442 VAL 442 442 442 VAL VAL C . n +C 1 443 GLY 443 443 443 GLY GLY C . n +C 1 444 CYS 444 444 444 CYS CYS C . n +C 1 445 ASP 445 445 445 ASP ASP C . n +C 1 446 ILE 446 446 446 ILE ILE C . n +C 1 447 GLY 447 447 447 GLY GLY C . n +C 1 448 GLY 448 448 448 GLY GLY C . n +C 1 449 PHE 449 449 449 PHE PHE C . n +C 1 450 GLN 450 450 450 GLN GLN C . n +C 1 451 GLY 451 451 451 GLY GLY C . n +C 1 452 ARG 452 452 452 ARG ARG C . n +C 1 453 ASN 453 453 453 ASN ASN C . n +C 1 454 PHE 454 454 454 PHE PHE C . n +C 1 455 ALA 455 455 455 ALA ALA C . n +C 1 456 GLU 456 456 456 GLU GLU C . n +C 1 457 ILE 457 457 457 ILE ILE C . n +C 1 458 ASP 458 458 458 ASP ASP C . n +C 1 459 ASN 459 459 459 ASN ASN C . n +C 1 460 SER 460 460 460 SER SER C . n +C 1 461 MET 461 461 461 MET MET C . n +C 1 462 ASP 462 462 462 ASP ASP C . n +C 1 463 LEU 463 463 463 LEU LEU C . n +C 1 464 LEU 464 464 464 LEU LEU C . n +C 1 465 VAL 465 465 465 VAL VAL C . n +C 1 466 LYS 466 466 466 LYS LYS C . n +C 1 467 TYR 467 467 467 TYR TYR C . n +C 1 468 TYR 468 468 468 TYR TYR C . n +C 1 469 ALA 469 469 469 ALA ALA C . n +C 1 470 LEU 470 470 470 LEU LEU C . n +C 1 471 ALA 471 471 471 ALA ALA C . n +C 1 472 LEU 472 472 472 LEU LEU C . n +C 1 473 PHE 473 473 473 PHE PHE C . n +C 1 474 PHE 474 474 474 PHE PHE C . n +C 1 475 PRO 475 475 475 PRO PRO C . n +C 1 476 PHE 476 476 476 PHE PHE C . n +C 1 477 TYR 477 477 477 TYR TYR C . n +C 1 478 ARG 478 478 478 ARG ARG C . n +C 1 479 SER 479 479 479 SER SER C . n +C 1 480 HIS 480 480 480 HIS HIS C . n +C 1 481 LYS 481 481 481 LYS LYS C . n +C 1 482 ALA 482 482 482 ALA ALA C . n +C 1 483 THR 483 483 483 THR THR C . n +C 1 484 ASP 484 484 484 ASP ASP C . n +C 1 485 GLY 485 485 485 GLY GLY C . n +C 1 486 ILE 486 486 486 ILE ILE C . n +C 1 487 ASP 487 487 487 ASP ASP C . n +C 1 488 THR 488 488 488 THR THR C . n +C 1 489 GLU 489 489 489 GLU GLU C . n +C 1 490 PRO 490 490 490 PRO PRO C . n +C 1 491 VAL 491 491 491 VAL VAL C . n +C 1 492 PHE 492 492 492 PHE PHE C . n +C 1 493 LEU 493 493 493 LEU LEU C . n +C 1 494 PRO 494 494 494 PRO PRO C . n +C 1 495 ASP 495 495 495 ASP ASP C . n +C 1 496 TYR 496 496 496 TYR TYR C . n +C 1 497 TYR 497 497 497 TYR TYR C . n +C 1 498 LYS 498 498 498 LYS LYS C . n +C 1 499 GLU 499 499 499 GLU GLU C . n +C 1 500 LYS 500 500 500 LYS LYS C . n +C 1 501 VAL 501 501 501 VAL VAL C . n +C 1 502 LYS 502 502 502 LYS LYS C . n +C 1 503 GLU 503 503 503 GLU GLU C . n +C 1 504 ILE 504 504 504 ILE ILE C . n +C 1 505 VAL 505 505 505 VAL VAL C . n +C 1 506 GLU 506 506 506 GLU GLU C . n +C 1 507 LEU 507 507 507 LEU LEU C . n +C 1 508 ARG 508 508 508 ARG ARG C . n +C 1 509 TYR 509 509 509 TYR TYR C . n +C 1 510 LYS 510 510 510 LYS LYS C . n +C 1 511 PHE 511 511 511 PHE PHE C . n +C 1 512 LEU 512 512 512 LEU LEU C . n +C 1 513 PRO 513 513 513 PRO PRO C . n +C 1 514 TYR 514 514 514 TYR TYR C . n +C 1 515 ILE 515 515 515 ILE ILE C . n +C 1 516 TYR 516 516 516 TYR TYR C . n +C 1 517 SER 517 517 517 SER SER C . n +C 1 518 LEU 518 518 518 LEU LEU C . n +C 1 519 ALA 519 519 519 ALA ALA C . n +C 1 520 LEU 520 520 520 LEU LEU C . n +C 1 521 GLU 521 521 521 GLU GLU C . n +C 1 522 ALA 522 522 522 ALA ALA C . n +C 1 523 SER 523 523 523 SER SER C . n +C 1 524 GLU 524 524 524 GLU GLU C . n +C 1 525 LYS 525 525 525 LYS LYS C . n +C 1 526 GLY 526 526 526 GLY GLY C . n +C 1 527 HIS 527 527 527 HIS HIS C . n +C 1 528 PRO 528 528 528 PRO PRO C . n +C 1 529 VAL 529 529 529 VAL VAL C . n +C 1 530 ILE 530 530 530 ILE ILE C . n +C 1 531 ARG 531 531 531 ARG ARG C . n +C 1 532 PRO 532 532 532 PRO PRO C . n +C 1 533 LEU 533 533 533 LEU LEU C . n +C 1 534 PHE 534 534 534 PHE PHE C . n +C 1 535 TYR 535 535 535 TYR TYR C . n +C 1 536 GLU 536 536 536 GLU GLU C . n +C 1 537 PHE 537 537 537 PHE PHE C . n +C 1 538 GLN 538 538 538 GLN GLN C . n +C 1 539 ASP 539 539 539 ASP ASP C . n +C 1 540 ASP 540 540 540 ASP ASP C . n +C 1 541 ASP 541 541 541 ASP ASP C . n +C 1 542 ASP 542 542 542 ASP ASP C . n +C 1 543 MET 543 543 543 MET MET C . n +C 1 544 TYR 544 544 544 TYR TYR C . n +C 1 545 ARG 545 545 545 ARG ARG C . n +C 1 546 ILE 546 546 546 ILE ILE C . n +C 1 547 GLU 547 547 547 GLU GLU C . n +C 1 548 ASP 548 548 548 ASP ASP C . n +C 1 549 GLU 549 549 549 GLU GLU C . n +C 1 550 TYR 550 550 550 TYR TYR C . n +C 1 551 MET 551 551 551 MET MET C . n +C 1 552 VAL 552 552 552 VAL VAL C . n +C 1 553 GLY 553 553 553 GLY GLY C . n +C 1 554 LYS 554 554 554 LYS LYS C . n +C 1 555 TYR 555 555 555 TYR TYR C . n +C 1 556 LEU 556 556 556 LEU LEU C . n +C 1 557 LEU 557 557 557 LEU LEU C . n +C 1 558 TYR 558 558 558 TYR TYR C . n +C 1 559 ALA 559 559 559 ALA ALA C . n +C 1 560 PRO 560 560 560 PRO PRO C . n +C 1 561 ILE 561 561 561 ILE ILE C . n +C 1 562 VAL 562 562 562 VAL VAL C . n +C 1 563 SER 563 563 563 SER SER C . n +C 1 564 LYS 564 564 564 LYS LYS C . n +C 1 565 GLU 565 565 565 GLU GLU C . n +C 1 566 GLU 566 566 566 GLU GLU C . n +C 1 567 SER 567 567 567 SER SER C . n +C 1 568 ARG 568 568 568 ARG ARG C . n +C 1 569 LEU 569 569 569 LEU LEU C . n +C 1 570 VAL 570 570 570 VAL VAL C . n +C 1 571 THR 571 571 571 THR THR C . n +C 1 572 LEU 572 572 572 LEU LEU C . n +C 1 573 PRO 573 573 573 PRO PRO C . n +C 1 574 ARG 574 574 574 ARG ARG C . n +C 1 575 GLY 575 575 575 GLY GLY C . n +C 1 576 LYS 576 576 576 LYS LYS C . n +C 1 577 TRP 577 577 577 TRP TRP C . n +C 1 578 TYR 578 578 578 TYR TYR C . n +C 1 579 ASN 579 579 579 ASN ASN C . n +C 1 580 TYR 580 580 580 TYR TYR C . n +C 1 581 TRP 581 581 581 TRP TRP C . n +C 1 582 ASN 582 582 582 ASN ASN C . n +C 1 583 GLY 583 583 583 GLY GLY C . n +C 1 584 GLU 584 584 584 GLU GLU C . n +C 1 585 ILE 585 585 585 ILE ILE C . n +C 1 586 ILE 586 586 586 ILE ILE C . n +C 1 587 ASN 587 587 587 ASN ASN C . n +C 1 588 GLY 588 588 588 GLY GLY C . n +C 1 589 LYS 589 589 589 LYS LYS C . n +C 1 590 SER 590 590 590 SER SER C . n +C 1 591 VAL 591 591 591 VAL VAL C . n +C 1 592 VAL 592 592 592 VAL VAL C . n +C 1 593 LYS 593 593 593 LYS LYS C . n +C 1 594 SER 594 594 594 SER SER C . n +C 1 595 THR 595 595 595 THR THR C . n +C 1 596 HIS 596 596 596 HIS HIS C . n +C 1 597 GLU 597 597 597 GLU GLU C . n +C 1 598 LEU 598 598 598 LEU LEU C . n +C 1 599 PRO 599 599 599 PRO PRO C . n +C 1 600 ILE 600 600 600 ILE ILE C . n +C 1 601 TYR 601 601 601 TYR TYR C . n +C 1 602 LEU 602 602 602 LEU LEU C . n +C 1 603 ARG 603 603 603 ARG ARG C . n +C 1 604 GLU 604 604 604 GLU GLU C . n +C 1 605 GLY 605 605 605 GLY GLY C . n +C 1 606 SER 606 606 606 SER SER C . n +C 1 607 ILE 607 607 607 ILE ILE C . n +C 1 608 ILE 608 608 608 ILE ILE C . n +C 1 609 PRO 609 609 609 PRO PRO C . n +C 1 610 LEU 610 610 610 LEU LEU C . n +C 1 611 GLU 611 611 611 GLU GLU C . n +C 1 612 GLY 612 612 612 GLY GLY C . n +C 1 613 ASP 613 613 613 ASP ASP C . n +C 1 614 GLU 614 614 614 GLU GLU C . n +C 1 615 LEU 615 615 615 LEU LEU C . n +C 1 616 ILE 616 616 616 ILE ILE C . n +C 1 617 VAL 617 617 617 VAL VAL C . n +C 1 618 TYR 618 618 618 TYR TYR C . n +C 1 619 GLY 619 619 619 GLY GLY C . n +C 1 620 GLU 620 620 620 GLU GLU C . n +C 1 621 THR 621 621 621 THR THR C . n +C 1 622 SER 622 622 622 SER SER C . n +C 1 623 PHE 623 623 623 PHE PHE C . n +C 1 624 LYS 624 624 624 LYS LYS C . n +C 1 625 ARG 625 625 625 ARG ARG C . n +C 1 626 TYR 626 626 626 TYR TYR C . n +C 1 627 ASP 627 627 627 ASP ASP C . n +C 1 628 ASN 628 628 628 ASN ASN C . n +C 1 629 ALA 629 629 629 ALA ALA C . n +C 1 630 GLU 630 630 630 GLU GLU C . n +C 1 631 ILE 631 631 631 ILE ILE C . n +C 1 632 THR 632 632 632 THR THR C . n +C 1 633 SER 633 633 633 SER SER C . n +C 1 634 SER 634 634 634 SER SER C . n +C 1 635 SER 635 635 635 SER SER C . n +C 1 636 ASN 636 636 636 ASN ASN C . n +C 1 637 GLU 637 637 637 GLU GLU C . n +C 1 638 ILE 638 638 638 ILE ILE C . n +C 1 639 LYS 639 639 639 LYS LYS C . n +C 1 640 PHE 640 640 640 PHE PHE C . n +C 1 641 SER 641 641 641 SER SER C . n +C 1 642 ARG 642 642 642 ARG ARG C . n +C 1 643 GLU 643 643 643 GLU GLU C . n +C 1 644 ILE 644 644 644 ILE ILE C . n +C 1 645 TYR 645 645 645 TYR TYR C . n +C 1 646 VAL 646 646 646 VAL VAL C . n +C 1 647 SER 647 647 647 SER SER C . n +C 1 648 LYS 648 648 648 LYS LYS C . n +C 1 649 LEU 649 649 649 LEU LEU C . n +C 1 650 THR 650 650 650 THR THR C . n +C 1 651 ILE 651 651 651 ILE ILE C . n +C 1 652 THR 652 652 652 THR THR C . n +C 1 653 SER 653 653 653 SER SER C . n +C 1 654 GLU 654 654 654 GLU GLU C . n +C 1 655 LYS 655 655 655 LYS LYS C . n +C 1 656 PRO 656 656 656 PRO PRO C . n +C 1 657 VAL 657 657 657 VAL VAL C . n +C 1 658 SER 658 658 658 SER SER C . n +C 1 659 LYS 659 659 659 LYS LYS C . n +C 1 660 ILE 660 660 660 ILE ILE C . n +C 1 661 ILE 661 661 661 ILE ILE C . n +C 1 662 VAL 662 662 662 VAL VAL C . n +C 1 663 ASP 663 663 663 ASP ASP C . n +C 1 664 ASP 664 664 664 ASP ASP C . n +C 1 665 SER 665 665 665 SER SER C . n +C 1 666 LYS 666 666 666 LYS LYS C . n +C 1 667 GLU 667 667 667 GLU GLU C . n +C 1 668 ILE 668 668 668 ILE ILE C . n +C 1 669 GLN 669 669 669 GLN GLN C . n +C 1 670 VAL 670 670 670 VAL VAL C . n +C 1 671 GLU 671 671 671 GLU GLU C . n +C 1 672 LYS 672 672 672 LYS LYS C . n +C 1 673 THR 673 673 673 THR THR C . n +C 1 674 MET 674 674 674 MET MET C . n +C 1 675 GLN 675 675 675 GLN GLN C . n +C 1 676 ASN 676 676 676 ASN ASN C . n +C 1 677 THR 677 677 677 THR THR C . n +C 1 678 TYR 678 678 678 TYR TYR C . n +C 1 679 VAL 679 679 679 VAL VAL C . n +C 1 680 ALA 680 680 680 ALA ALA C . n +C 1 681 LYS 681 681 681 LYS LYS C . n +C 1 682 ILE 682 682 682 ILE ILE C . n +C 1 683 ASN 683 683 683 ASN ASN C . n +C 1 684 GLN 684 684 684 GLN GLN C . n +C 1 685 LYS 685 685 685 LYS LYS C . n +C 1 686 ILE 686 686 686 ILE ILE C . n +C 1 687 ARG 687 687 687 ARG ARG C . n +C 1 688 GLY 688 688 688 GLY GLY C . n +C 1 689 LYS 689 689 689 LYS LYS C . n +C 1 690 ILE 690 690 690 ILE ILE C . n +C 1 691 ASN 691 691 691 ASN ASN C . n +C 1 692 LEU 692 692 692 LEU LEU C . n +C 1 693 GLU 693 693 693 GLU GLU C . n +D 1 1 MET 1 1 ? ? ? D . n +D 1 2 ARG 2 2 ? ? ? D . n +D 1 3 ILE 3 3 3 ILE ILE D . n +D 1 4 LEU 4 4 4 LEU LEU D . n +D 1 5 LYS 5 5 5 LYS LYS D . n +D 1 6 ILE 6 6 6 ILE ILE D . n +D 1 7 TYR 7 7 7 TYR TYR D . n +D 1 8 GLU 8 8 8 GLU GLU D . n +D 1 9 ASN 9 9 9 ASN ASN D . n +D 1 10 LYS 10 10 10 LYS LYS D . n +D 1 11 GLY 11 11 11 GLY GLY D . n +D 1 12 VAL 12 12 12 VAL VAL D . n +D 1 13 TYR 13 13 13 TYR TYR D . n +D 1 14 LYS 14 14 14 LYS LYS D . n +D 1 15 VAL 15 15 15 VAL VAL D . n +D 1 16 VAL 16 16 16 VAL VAL D . n +D 1 17 ILE 17 17 17 ILE ILE D . n +D 1 18 GLY 18 18 18 GLY GLY D . n +D 1 19 GLU 19 19 19 GLU GLU D . n +D 1 20 PRO 20 20 20 PRO PRO D . n +D 1 21 PHE 21 21 21 PHE PHE D . n +D 1 22 PRO 22 22 22 PRO PRO D . n +D 1 23 PRO 23 23 23 PRO PRO D . n +D 1 24 ILE 24 24 24 ILE ILE D . n +D 1 25 GLU 25 25 25 GLU GLU D . n +D 1 26 PHE 26 26 26 PHE PHE D . n +D 1 27 PRO 27 27 27 PRO PRO D . n +D 1 28 LEU 28 28 28 LEU LEU D . n +D 1 29 GLU 29 29 29 GLU GLU D . n +D 1 30 GLN 30 30 30 GLN GLN D . n +D 1 31 LYS 31 31 31 LYS LYS D . n +D 1 32 ILE 32 32 32 ILE ILE D . n +D 1 33 SER 33 33 33 SER SER D . n +D 1 34 SER 34 34 34 SER SER D . n +D 1 35 ASN 35 35 35 ASN ASN D . n +D 1 36 LYS 36 36 36 LYS LYS D . n +D 1 37 SER 37 37 37 SER SER D . n +D 1 38 LEU 38 38 38 LEU LEU D . n +D 1 39 SER 39 39 39 SER SER D . n +D 1 40 GLU 40 40 40 GLU GLU D . n +D 1 41 LEU 41 41 41 LEU LEU D . n +D 1 42 GLY 42 42 42 GLY GLY D . n +D 1 43 LEU 43 43 43 LEU LEU D . n +D 1 44 THR 44 44 44 THR THR D . n +D 1 45 ILE 45 45 45 ILE ILE D . n +D 1 46 VAL 46 46 46 VAL VAL D . n +D 1 47 GLN 47 47 47 GLN GLN D . n +D 1 48 GLN 48 48 48 GLN GLN D . n +D 1 49 GLY 49 49 49 GLY GLY D . n +D 1 50 ASN 50 50 50 ASN ASN D . n +D 1 51 LYS 51 51 51 LYS LYS D . n +D 1 52 VAL 52 52 52 VAL VAL D . n +D 1 53 ILE 53 53 53 ILE ILE D . n +D 1 54 VAL 54 54 54 VAL VAL D . n +D 1 55 GLU 55 55 55 GLU GLU D . n +D 1 56 LYS 56 56 56 LYS LYS D . n +D 1 57 SER 57 57 57 SER SER D . n +D 1 58 LEU 58 58 58 LEU LEU D . n +D 1 59 ASP 59 59 59 ASP ASP D . n +D 1 60 LEU 60 60 60 LEU LEU D . n +D 1 61 LYS 61 61 61 LYS LYS D . n +D 1 62 GLU 62 62 62 GLU GLU D . n +D 1 63 HIS 63 63 63 HIS HIS D . n +D 1 64 ILE 64 64 64 ILE ILE D . n +D 1 65 ILE 65 65 65 ILE ILE D . n +D 1 66 GLY 66 66 66 GLY GLY D . n +D 1 67 LEU 67 67 67 LEU LEU D . n +D 1 68 GLY 68 68 68 GLY GLY D . n +D 1 69 GLU 69 69 69 GLU GLU D . n +D 1 70 LYS 70 70 70 LYS LYS D . n +D 1 71 ALA 71 71 71 ALA ALA D . n +D 1 72 PHE 72 72 72 PHE PHE D . n +D 1 73 GLU 73 73 73 GLU GLU D . n +D 1 74 LEU 74 74 74 LEU LEU D . n +D 1 75 ASP 75 75 75 ASP ASP D . n +D 1 76 ARG 76 76 76 ARG ARG D . n +D 1 77 LYS 77 77 77 LYS LYS D . n +D 1 78 ARG 78 78 78 ARG ARG D . n +D 1 79 LYS 79 79 79 LYS LYS D . n +D 1 80 ARG 80 80 80 ARG ARG D . n +D 1 81 TYR 81 81 81 TYR TYR D . n +D 1 82 VAL 82 82 82 VAL VAL D . n +D 1 83 MET 83 83 83 MET MET D . n +D 1 84 TYR 84 84 84 TYR TYR D . n +D 1 85 ASN 85 85 85 ASN ASN D . n +D 1 86 VAL 86 86 86 VAL VAL D . n +D 1 87 ASP 87 87 87 ASP ASP D . n +D 1 88 ALA 88 88 88 ALA ALA D . n +D 1 89 GLY 89 89 89 GLY GLY D . n +D 1 90 ALA 90 90 90 ALA ALA D . n +D 1 91 TYR 91 91 91 TYR TYR D . n +D 1 92 LYS 92 92 92 LYS LYS D . n +D 1 93 LYS 93 93 93 LYS LYS D . n +D 1 94 TYR 94 94 94 TYR TYR D . n +D 1 95 GLN 95 95 95 GLN GLN D . n +D 1 96 ASP 96 96 96 ASP ASP D . n +D 1 97 PRO 97 97 97 PRO PRO D . n +D 1 98 LEU 98 98 98 LEU LEU D . n +D 1 99 TYR 99 99 99 TYR TYR D . n +D 1 100 VAL 100 100 100 VAL VAL D . n +D 1 101 SER 101 101 101 SER SER D . n +D 1 102 ILE 102 102 102 ILE ILE D . n +D 1 103 PRO 103 103 103 PRO PRO D . n +D 1 104 LEU 104 104 104 LEU LEU D . n +D 1 105 PHE 105 105 105 PHE PHE D . n +D 1 106 ILE 106 106 106 ILE ILE D . n +D 1 107 SER 107 107 107 SER SER D . n +D 1 108 VAL 108 108 108 VAL VAL D . n +D 1 109 LYS 109 109 109 LYS LYS D . n +D 1 110 ASP 110 110 110 ASP ASP D . n +D 1 111 GLY 111 111 111 GLY GLY D . n +D 1 112 VAL 112 112 112 VAL VAL D . n +D 1 113 ALA 113 113 113 ALA ALA D . n +D 1 114 THR 114 114 114 THR THR D . n +D 1 115 GLY 115 115 115 GLY GLY D . n +D 1 116 TYR 116 116 116 TYR TYR D . n +D 1 117 PHE 117 117 117 PHE PHE D . n +D 1 118 PHE 118 118 118 PHE PHE D . n +D 1 119 ASN 119 119 119 ASN ASN D . n +D 1 120 SER 120 120 120 SER SER D . n +D 1 121 ALA 121 121 121 ALA ALA D . n +D 1 122 SER 122 122 122 SER SER D . n +D 1 123 LYS 123 123 123 LYS LYS D . n +D 1 124 VAL 124 124 124 VAL VAL D . n +D 1 125 ILE 125 125 125 ILE ILE D . n +D 1 126 PHE 126 126 126 PHE PHE D . n +D 1 127 ASP 127 127 127 ASP ASP D . n +D 1 128 VAL 128 128 128 VAL VAL D . n +D 1 129 GLY 129 129 129 GLY GLY D . n +D 1 130 LEU 130 130 130 LEU LEU D . n +D 1 131 GLU 131 131 131 GLU GLU D . n +D 1 132 GLU 132 132 132 GLU GLU D . n +D 1 133 TYR 133 133 133 TYR TYR D . n +D 1 134 ASP 134 134 134 ASP ASP D . n +D 1 135 LYS 135 135 135 LYS LYS D . n +D 1 136 VAL 136 136 136 VAL VAL D . n +D 1 137 ILE 137 137 137 ILE ILE D . n +D 1 138 VAL 138 138 138 VAL VAL D . n +D 1 139 THR 139 139 139 THR THR D . n +D 1 140 ILE 140 140 140 ILE ILE D . n +D 1 141 PRO 141 141 141 PRO PRO D . n +D 1 142 GLU 142 142 142 GLU GLU D . n +D 1 143 ASP 143 143 143 ASP ASP D . n +D 1 144 SER 144 144 144 SER SER D . n +D 1 145 VAL 145 145 145 VAL VAL D . n +D 1 146 GLU 146 146 146 GLU GLU D . n +D 1 147 PHE 147 147 147 PHE PHE D . n +D 1 148 TYR 148 148 148 TYR TYR D . n +D 1 149 VAL 149 149 149 VAL VAL D . n +D 1 150 ILE 150 150 150 ILE ILE D . n +D 1 151 GLU 151 151 151 GLU GLU D . n +D 1 152 GLY 152 152 152 GLY GLY D . n +D 1 153 PRO 153 153 153 PRO PRO D . n +D 1 154 ARG 154 154 154 ARG ARG D . n +D 1 155 ILE 155 155 155 ILE ILE D . n +D 1 156 GLU 156 156 156 GLU GLU D . n +D 1 157 ASP 157 157 157 ASP ASP D . n +D 1 158 VAL 158 158 158 VAL VAL D . n +D 1 159 LEU 159 159 159 LEU LEU D . n +D 1 160 GLU 160 160 160 GLU GLU D . n +D 1 161 LYS 161 161 161 LYS LYS D . n +D 1 162 TYR 162 162 162 TYR TYR D . n +D 1 163 THR 163 163 163 THR THR D . n +D 1 164 GLU 164 164 164 GLU GLU D . n +D 1 165 LEU 165 165 165 LEU LEU D . n +D 1 166 THR 166 166 166 THR THR D . n +D 1 167 GLY 167 167 167 GLY GLY D . n +D 1 168 LYS 168 168 168 LYS LYS D . n +D 1 169 PRO 169 169 169 PRO PRO D . n +D 1 170 PHE 170 170 170 PHE PHE D . n +D 1 171 LEU 171 171 171 LEU LEU D . n +D 1 172 PRO 172 172 172 PRO PRO D . n +D 1 173 PRO 173 173 173 PRO PRO D . n +D 1 174 MET 174 174 174 MET MET D . n +D 1 175 TRP 175 175 175 TRP TRP D . n +D 1 176 ALA 176 176 176 ALA ALA D . n +D 1 177 PHE 177 177 177 PHE PHE D . n +D 1 178 GLY 178 178 178 GLY GLY D . n +D 1 179 TYR 179 179 179 TYR TYR D . n +D 1 180 MET 180 180 180 MET MET D . n +D 1 181 ILE 181 181 181 ILE ILE D . n +D 1 182 SER 182 182 182 SER SER D . n +D 1 183 ARG 183 183 183 ARG ARG D . n +D 1 184 TYR 184 184 184 TYR TYR D . n +D 1 185 SER 185 185 185 SER SER D . n +D 1 186 TYR 186 186 186 TYR TYR D . n +D 1 187 TYR 187 187 187 TYR TYR D . n +D 1 188 PRO 188 188 188 PRO PRO D . n +D 1 189 GLN 189 189 189 GLN GLN D . n +D 1 190 ASP 190 190 190 ASP ASP D . n +D 1 191 LYS 191 191 191 LYS LYS D . n +D 1 192 VAL 192 192 192 VAL VAL D . n +D 1 193 VAL 193 193 193 VAL VAL D . n +D 1 194 GLU 194 194 194 GLU GLU D . n +D 1 195 LEU 195 195 195 LEU LEU D . n +D 1 196 VAL 196 196 196 VAL VAL D . n +D 1 197 ASP 197 197 197 ASP ASP D . n +D 1 198 ILE 198 198 198 ILE ILE D . n +D 1 199 MET 199 199 199 MET MET D . n +D 1 200 GLN 200 200 200 GLN GLN D . n +D 1 201 LYS 201 201 201 LYS LYS D . n +D 1 202 GLU 202 202 202 GLU GLU D . n +D 1 203 GLY 203 203 203 GLY GLY D . n +D 1 204 PHE 204 204 204 PHE PHE D . n +D 1 205 ARG 205 205 205 ARG ARG D . n +D 1 206 VAL 206 206 206 VAL VAL D . n +D 1 207 ALA 207 207 207 ALA ALA D . n +D 1 208 GLY 208 208 208 GLY GLY D . n +D 1 209 VAL 209 209 209 VAL VAL D . n +D 1 210 PHE 210 210 210 PHE PHE D . n +D 1 211 LEU 211 211 211 LEU LEU D . n +D 1 212 ASP 212 212 212 ASP ASP D . n +D 1 213 ILE 213 213 213 ILE ILE D . n +D 1 214 HIS 214 214 214 HIS HIS D . n +D 1 215 TYR 215 215 215 TYR TYR D . n +D 1 216 MET 216 216 216 MET MET D . n +D 1 217 ASP 217 217 217 ASP ASP D . n +D 1 218 SER 218 218 218 SER SER D . n +D 1 219 TYR 219 219 219 TYR TYR D . n +D 1 220 LYS 220 220 220 LYS LYS D . n +D 1 221 LEU 221 221 221 LEU LEU D . n +D 1 222 PHE 222 222 222 PHE PHE D . n +D 1 223 THR 223 223 223 THR THR D . n +D 1 224 TRP 224 224 224 TRP TRP D . n +D 1 225 HIS 225 225 225 HIS HIS D . n +D 1 226 PRO 226 226 226 PRO PRO D . n +D 1 227 TYR 227 227 227 TYR TYR D . n +D 1 228 ARG 228 228 228 ARG ARG D . n +D 1 229 PHE 229 229 229 PHE PHE D . n +D 1 230 PRO 230 230 230 PRO PRO D . n +D 1 231 GLU 231 231 231 GLU GLU D . n +D 1 232 PRO 232 232 232 PRO PRO D . n +D 1 233 LYS 233 233 233 LYS LYS D . n +D 1 234 LYS 234 234 234 LYS LYS D . n +D 1 235 LEU 235 235 235 LEU LEU D . n +D 1 236 ILE 236 236 236 ILE ILE D . n +D 1 237 ASP 237 237 237 ASP ASP D . n +D 1 238 GLU 238 238 238 GLU GLU D . n +D 1 239 LEU 239 239 239 LEU LEU D . n +D 1 240 HIS 240 240 240 HIS HIS D . n +D 1 241 LYS 241 241 241 LYS LYS D . n +D 1 242 ARG 242 242 242 ARG ARG D . n +D 1 243 ASN 243 243 243 ASN ASN D . n +D 1 244 VAL 244 244 244 VAL VAL D . n +D 1 245 LYS 245 245 245 LYS LYS D . n +D 1 246 LEU 246 246 246 LEU LEU D . n +D 1 247 ILE 247 247 247 ILE ILE D . n +D 1 248 THR 248 248 248 THR THR D . n +D 1 249 ILE 249 249 249 ILE ILE D . n +D 1 250 VAL 250 250 250 VAL VAL D . n +D 1 251 ASP 251 251 251 ASP ASP D . n +D 1 252 HIS 252 252 252 HIS HIS D . n +D 1 253 GLY 253 253 253 GLY GLY D . n +D 1 254 ILE 254 254 254 ILE ILE D . n +D 1 255 ARG 255 255 255 ARG ARG D . n +D 1 256 VAL 256 256 256 VAL VAL D . n +D 1 257 ASP 257 257 257 ASP ASP D . n +D 1 258 GLN 258 258 258 GLN GLN D . n +D 1 259 ASN 259 259 259 ASN ASN D . n +D 1 260 TYR 260 260 260 TYR TYR D . n +D 1 261 SER 261 261 261 SER SER D . n +D 1 262 PRO 262 262 262 PRO PRO D . n +D 1 263 PHE 263 263 263 PHE PHE D . n +D 1 264 LEU 264 264 264 LEU LEU D . n +D 1 265 SER 265 265 265 SER SER D . n +D 1 266 GLY 266 266 266 GLY GLY D . n +D 1 267 MET 267 267 267 MET MET D . n +D 1 268 GLY 268 268 268 GLY GLY D . n +D 1 269 LYS 269 269 269 LYS LYS D . n +D 1 270 PHE 270 270 270 PHE PHE D . n +D 1 271 CYS 271 271 271 CYS CYS D . n +D 1 272 GLU 272 272 272 GLU GLU D . n +D 1 273 ILE 273 273 273 ILE ILE D . n +D 1 274 GLU 274 274 274 GLU GLU D . n +D 1 275 SER 275 275 275 SER SER D . n +D 1 276 GLY 276 276 276 GLY GLY D . n +D 1 277 GLU 277 277 277 GLU GLU D . n +D 1 278 LEU 278 278 278 LEU LEU D . n +D 1 279 PHE 279 279 279 PHE PHE D . n +D 1 280 VAL 280 280 280 VAL VAL D . n +D 1 281 GLY 281 281 281 GLY GLY D . n +D 1 282 LYS 282 282 282 LYS LYS D . n +D 1 283 MET 283 283 283 MET MET D . n +D 1 284 TRP 284 284 284 TRP TRP D . n +D 1 285 PRO 285 285 285 PRO PRO D . n +D 1 286 GLY 286 286 286 GLY GLY D . n +D 1 287 THR 287 287 287 THR THR D . n +D 1 288 THR 288 288 288 THR THR D . n +D 1 289 VAL 289 289 289 VAL VAL D . n +D 1 290 TYR 290 290 290 TYR TYR D . n +D 1 291 PRO 291 291 291 PRO PRO D . n +D 1 292 ASP 292 292 292 ASP ASP D . n +D 1 293 PHE 293 293 293 PHE PHE D . n +D 1 294 PHE 294 294 294 PHE PHE D . n +D 1 295 ARG 295 295 295 ARG ARG D . n +D 1 296 GLU 296 296 296 GLU GLU D . n +D 1 297 ASP 297 297 297 ASP ASP D . n +D 1 298 THR 298 298 298 THR THR D . n +D 1 299 ARG 299 299 299 ARG ARG D . n +D 1 300 GLU 300 300 300 GLU GLU D . n +D 1 301 TRP 301 301 301 TRP TRP D . n +D 1 302 TRP 302 302 302 TRP TRP D . n +D 1 303 ALA 303 303 303 ALA ALA D . n +D 1 304 GLY 304 304 304 GLY GLY D . n +D 1 305 LEU 305 305 305 LEU LEU D . n +D 1 306 ILE 306 306 306 ILE ILE D . n +D 1 307 SER 307 307 307 SER SER D . n +D 1 308 GLU 308 308 308 GLU GLU D . n +D 1 309 TRP 309 309 309 TRP TRP D . n +D 1 310 LEU 310 310 310 LEU LEU D . n +D 1 311 SER 311 311 311 SER SER D . n +D 1 312 GLN 312 312 312 GLN GLN D . n +D 1 313 GLY 313 313 313 GLY GLY D . n +D 1 314 VAL 314 314 314 VAL VAL D . n +D 1 315 ASP 315 315 315 ASP ASP D . n +D 1 316 GLY 316 316 316 GLY GLY D . n +D 1 317 ILE 317 317 317 ILE ILE D . n +D 1 318 TRP 318 318 318 TRP TRP D . n +D 1 319 LEU 319 319 319 LEU LEU D . n +D 1 320 ASP 320 320 320 ASP ASP D . n +D 1 321 MET 321 321 321 MET MET D . n +D 1 322 ASN 322 322 322 ASN ASN D . n +D 1 323 GLU 323 323 323 GLU GLU D . n +D 1 324 PRO 324 324 324 PRO PRO D . n +D 1 325 THR 325 325 325 THR THR D . n +D 1 326 ASP 326 326 326 ASP ASP D . n +D 1 327 PHE 327 327 327 PHE PHE D . n +D 1 328 SER 328 328 328 SER SER D . n +D 1 329 ARG 329 329 329 ARG ARG D . n +D 1 330 ALA 330 330 330 ALA ALA D . n +D 1 331 ILE 331 331 331 ILE ILE D . n +D 1 332 GLU 332 332 332 GLU GLU D . n +D 1 333 ILE 333 333 333 ILE ILE D . n +D 1 334 ARG 334 334 334 ARG ARG D . n +D 1 335 ASP 335 335 335 ASP ASP D . n +D 1 336 VAL 336 336 336 VAL VAL D . n +D 1 337 LEU 337 337 337 LEU LEU D . n +D 1 338 SER 338 338 338 SER SER D . n +D 1 339 SER 339 339 339 SER SER D . n +D 1 340 LEU 340 340 340 LEU LEU D . n +D 1 341 PRO 341 341 341 PRO PRO D . n +D 1 342 VAL 342 342 342 VAL VAL D . n +D 1 343 GLN 343 343 343 GLN GLN D . n +D 1 344 PHE 344 344 344 PHE PHE D . n +D 1 345 ARG 345 345 345 ARG ARG D . n +D 1 346 ASP 346 346 346 ASP ASP D . n +D 1 347 ASP 347 347 347 ASP ASP D . n +D 1 348 ARG 348 348 348 ARG ARG D . n +D 1 349 LEU 349 349 349 LEU LEU D . n +D 1 350 VAL 350 350 350 VAL VAL D . n +D 1 351 THR 351 351 351 THR THR D . n +D 1 352 THR 352 352 352 THR THR D . n +D 1 353 PHE 353 353 353 PHE PHE D . n +D 1 354 PRO 354 354 354 PRO PRO D . n +D 1 355 ASP 355 355 355 ASP ASP D . n +D 1 356 ASN 356 356 356 ASN ASN D . n +D 1 357 VAL 357 357 357 VAL VAL D . n +D 1 358 VAL 358 358 358 VAL VAL D . n +D 1 359 HIS 359 359 359 HIS HIS D . n +D 1 360 TYR 360 360 360 TYR TYR D . n +D 1 361 LEU 361 361 361 LEU LEU D . n +D 1 362 ARG 362 362 362 ARG ARG D . n +D 1 363 GLY 363 363 363 GLY GLY D . n +D 1 364 LYS 364 364 364 LYS LYS D . n +D 1 365 ARG 365 365 365 ARG ARG D . n +D 1 366 VAL 366 366 366 VAL VAL D . n +D 1 367 LYS 367 367 367 LYS LYS D . n +D 1 368 HIS 368 368 368 HIS HIS D . n +D 1 369 GLU 369 369 369 GLU GLU D . n +D 1 370 LYS 370 370 370 LYS LYS D . n +D 1 371 VAL 371 371 371 VAL VAL D . n +D 1 372 ARG 372 372 372 ARG ARG D . n +D 1 373 ASN 373 373 373 ASN ASN D . n +D 1 374 ALA 374 374 374 ALA ALA D . n +D 1 375 TYR 375 375 375 TYR TYR D . n +D 1 376 PRO 376 376 376 PRO PRO D . n +D 1 377 LEU 377 377 377 LEU LEU D . n +D 1 378 TYR 378 378 378 TYR TYR D . n +D 1 379 GLU 379 379 379 GLU GLU D . n +D 1 380 ALA 380 380 380 ALA ALA D . n +D 1 381 MET 381 381 381 MET MET D . n +D 1 382 ALA 382 382 382 ALA ALA D . n +D 1 383 THR 383 383 383 THR THR D . n +D 1 384 PHE 384 384 384 PHE PHE D . n +D 1 385 LYS 385 385 385 LYS LYS D . n +D 1 386 GLY 386 386 386 GLY GLY D . n +D 1 387 PHE 387 387 387 PHE PHE D . n +D 1 388 ARG 388 388 388 ARG ARG D . n +D 1 389 THR 389 389 389 THR THR D . n +D 1 390 SER 390 390 390 SER SER D . n +D 1 391 HIS 391 391 391 HIS HIS D . n +D 1 392 ARG 392 392 392 ARG ARG D . n +D 1 393 ASN 393 393 393 ASN ASN D . n +D 1 394 GLU 394 394 394 GLU GLU D . n +D 1 395 ILE 395 395 395 ILE ILE D . n +D 1 396 PHE 396 396 396 PHE PHE D . n +D 1 397 ILE 397 397 397 ILE ILE D . n +D 1 398 LEU 398 398 398 LEU LEU D . n +D 1 399 SER 399 399 399 SER SER D . n +D 1 400 ARG 400 400 400 ARG ARG D . n +D 1 401 ALA 401 401 401 ALA ALA D . n +D 1 402 GLY 402 402 402 GLY GLY D . n +D 1 403 TYR 403 403 403 TYR TYR D . n +D 1 404 ALA 404 404 404 ALA ALA D . n +D 1 405 GLY 405 405 405 GLY GLY D . n +D 1 406 ILE 406 406 406 ILE ILE D . n +D 1 407 GLN 407 407 407 GLN GLN D . n +D 1 408 ARG 408 408 408 ARG ARG D . n +D 1 409 TYR 409 409 409 TYR TYR D . n +D 1 410 ALA 410 410 410 ALA ALA D . n +D 1 411 PHE 411 411 411 PHE PHE D . n +D 1 412 ILE 412 412 412 ILE ILE D . n +D 1 413 TRP 413 413 413 TRP TRP D . n +D 1 414 THR 414 414 414 THR THR D . n +D 1 415 GLY 415 415 415 GLY GLY D . n +D 1 416 ASP 416 416 416 ASP ASP D . n +D 1 417 ASN 417 417 417 ASN ASN D . n +D 1 418 THR 418 418 418 THR THR D . n +D 1 419 PRO 419 419 419 PRO PRO D . n +D 1 420 SER 420 420 420 SER SER D . n +D 1 421 TRP 421 421 421 TRP TRP D . n +D 1 422 ASP 422 422 422 ASP ASP D . n +D 1 423 ASP 423 423 423 ASP ASP D . n +D 1 424 LEU 424 424 424 LEU LEU D . n +D 1 425 LYS 425 425 425 LYS LYS D . n +D 1 426 LEU 426 426 426 LEU LEU D . n +D 1 427 GLN 427 427 427 GLN GLN D . n +D 1 428 LEU 428 428 428 LEU LEU D . n +D 1 429 GLN 429 429 429 GLN GLN D . n +D 1 430 LEU 430 430 430 LEU LEU D . n +D 1 431 VAL 431 431 431 VAL VAL D . n +D 1 432 LEU 432 432 432 LEU LEU D . n +D 1 433 GLY 433 433 433 GLY GLY D . n +D 1 434 LEU 434 434 434 LEU LEU D . n +D 1 435 SER 435 435 435 SER SER D . n +D 1 436 ILE 436 436 436 ILE ILE D . n +D 1 437 SER 437 437 437 SER SER D . n +D 1 438 GLY 438 438 438 GLY GLY D . n +D 1 439 VAL 439 439 439 VAL VAL D . n +D 1 440 PRO 440 440 440 PRO PRO D . n +D 1 441 PHE 441 441 441 PHE PHE D . n +D 1 442 VAL 442 442 442 VAL VAL D . n +D 1 443 GLY 443 443 443 GLY GLY D . n +D 1 444 CYS 444 444 444 CYS CYS D . n +D 1 445 ASP 445 445 445 ASP ASP D . n +D 1 446 ILE 446 446 446 ILE ILE D . n +D 1 447 GLY 447 447 447 GLY GLY D . n +D 1 448 GLY 448 448 448 GLY GLY D . n +D 1 449 PHE 449 449 449 PHE PHE D . n +D 1 450 GLN 450 450 450 GLN GLN D . n +D 1 451 GLY 451 451 451 GLY GLY D . n +D 1 452 ARG 452 452 452 ARG ARG D . n +D 1 453 ASN 453 453 453 ASN ASN D . n +D 1 454 PHE 454 454 454 PHE PHE D . n +D 1 455 ALA 455 455 455 ALA ALA D . n +D 1 456 GLU 456 456 456 GLU GLU D . n +D 1 457 ILE 457 457 457 ILE ILE D . n +D 1 458 ASP 458 458 458 ASP ASP D . n +D 1 459 ASN 459 459 459 ASN ASN D . n +D 1 460 SER 460 460 460 SER SER D . n +D 1 461 MET 461 461 461 MET MET D . n +D 1 462 ASP 462 462 462 ASP ASP D . n +D 1 463 LEU 463 463 463 LEU LEU D . n +D 1 464 LEU 464 464 464 LEU LEU D . n +D 1 465 VAL 465 465 465 VAL VAL D . n +D 1 466 LYS 466 466 466 LYS LYS D . n +D 1 467 TYR 467 467 467 TYR TYR D . n +D 1 468 TYR 468 468 468 TYR TYR D . n +D 1 469 ALA 469 469 469 ALA ALA D . n +D 1 470 LEU 470 470 470 LEU LEU D . n +D 1 471 ALA 471 471 471 ALA ALA D . n +D 1 472 LEU 472 472 472 LEU LEU D . n +D 1 473 PHE 473 473 473 PHE PHE D . n +D 1 474 PHE 474 474 474 PHE PHE D . n +D 1 475 PRO 475 475 475 PRO PRO D . n +D 1 476 PHE 476 476 476 PHE PHE D . n +D 1 477 TYR 477 477 477 TYR TYR D . n +D 1 478 ARG 478 478 478 ARG ARG D . n +D 1 479 SER 479 479 479 SER SER D . n +D 1 480 HIS 480 480 480 HIS HIS D . n +D 1 481 LYS 481 481 481 LYS LYS D . n +D 1 482 ALA 482 482 482 ALA ALA D . n +D 1 483 THR 483 483 483 THR THR D . n +D 1 484 ASP 484 484 484 ASP ASP D . n +D 1 485 GLY 485 485 485 GLY GLY D . n +D 1 486 ILE 486 486 486 ILE ILE D . n +D 1 487 ASP 487 487 487 ASP ASP D . n +D 1 488 THR 488 488 488 THR THR D . n +D 1 489 GLU 489 489 489 GLU GLU D . n +D 1 490 PRO 490 490 490 PRO PRO D . n +D 1 491 VAL 491 491 491 VAL VAL D . n +D 1 492 PHE 492 492 492 PHE PHE D . n +D 1 493 LEU 493 493 493 LEU LEU D . n +D 1 494 PRO 494 494 494 PRO PRO D . n +D 1 495 ASP 495 495 495 ASP ASP D . n +D 1 496 TYR 496 496 496 TYR TYR D . n +D 1 497 TYR 497 497 497 TYR TYR D . n +D 1 498 LYS 498 498 498 LYS LYS D . n +D 1 499 GLU 499 499 499 GLU GLU D . n +D 1 500 LYS 500 500 500 LYS LYS D . n +D 1 501 VAL 501 501 501 VAL VAL D . n +D 1 502 LYS 502 502 502 LYS LYS D . n +D 1 503 GLU 503 503 503 GLU GLU D . n +D 1 504 ILE 504 504 504 ILE ILE D . n +D 1 505 VAL 505 505 505 VAL VAL D . n +D 1 506 GLU 506 506 506 GLU GLU D . n +D 1 507 LEU 507 507 507 LEU LEU D . n +D 1 508 ARG 508 508 508 ARG ARG D . n +D 1 509 TYR 509 509 509 TYR TYR D . n +D 1 510 LYS 510 510 510 LYS LYS D . n +D 1 511 PHE 511 511 511 PHE PHE D . n +D 1 512 LEU 512 512 512 LEU LEU D . n +D 1 513 PRO 513 513 513 PRO PRO D . n +D 1 514 TYR 514 514 514 TYR TYR D . n +D 1 515 ILE 515 515 515 ILE ILE D . n +D 1 516 TYR 516 516 516 TYR TYR D . n +D 1 517 SER 517 517 517 SER SER D . n +D 1 518 LEU 518 518 518 LEU LEU D . n +D 1 519 ALA 519 519 519 ALA ALA D . n +D 1 520 LEU 520 520 520 LEU LEU D . n +D 1 521 GLU 521 521 521 GLU GLU D . n +D 1 522 ALA 522 522 522 ALA ALA D . n +D 1 523 SER 523 523 523 SER SER D . n +D 1 524 GLU 524 524 524 GLU GLU D . n +D 1 525 LYS 525 525 525 LYS LYS D . n +D 1 526 GLY 526 526 526 GLY GLY D . n +D 1 527 HIS 527 527 527 HIS HIS D . n +D 1 528 PRO 528 528 528 PRO PRO D . n +D 1 529 VAL 529 529 529 VAL VAL D . n +D 1 530 ILE 530 530 530 ILE ILE D . n +D 1 531 ARG 531 531 531 ARG ARG D . n +D 1 532 PRO 532 532 532 PRO PRO D . n +D 1 533 LEU 533 533 533 LEU LEU D . n +D 1 534 PHE 534 534 534 PHE PHE D . n +D 1 535 TYR 535 535 535 TYR TYR D . n +D 1 536 GLU 536 536 536 GLU GLU D . n +D 1 537 PHE 537 537 537 PHE PHE D . n +D 1 538 GLN 538 538 538 GLN GLN D . n +D 1 539 ASP 539 539 539 ASP ASP D . n +D 1 540 ASP 540 540 540 ASP ASP D . n +D 1 541 ASP 541 541 541 ASP ASP D . n +D 1 542 ASP 542 542 542 ASP ASP D . n +D 1 543 MET 543 543 543 MET MET D . n +D 1 544 TYR 544 544 544 TYR TYR D . n +D 1 545 ARG 545 545 545 ARG ARG D . n +D 1 546 ILE 546 546 546 ILE ILE D . n +D 1 547 GLU 547 547 547 GLU GLU D . n +D 1 548 ASP 548 548 548 ASP ASP D . n +D 1 549 GLU 549 549 549 GLU GLU D . n +D 1 550 TYR 550 550 550 TYR TYR D . n +D 1 551 MET 551 551 551 MET MET D . n +D 1 552 VAL 552 552 552 VAL VAL D . n +D 1 553 GLY 553 553 553 GLY GLY D . n +D 1 554 LYS 554 554 554 LYS LYS D . n +D 1 555 TYR 555 555 555 TYR TYR D . n +D 1 556 LEU 556 556 556 LEU LEU D . n +D 1 557 LEU 557 557 557 LEU LEU D . n +D 1 558 TYR 558 558 558 TYR TYR D . n +D 1 559 ALA 559 559 559 ALA ALA D . n +D 1 560 PRO 560 560 560 PRO PRO D . n +D 1 561 ILE 561 561 561 ILE ILE D . n +D 1 562 VAL 562 562 562 VAL VAL D . n +D 1 563 SER 563 563 563 SER SER D . n +D 1 564 LYS 564 564 564 LYS LYS D . n +D 1 565 GLU 565 565 565 GLU GLU D . n +D 1 566 GLU 566 566 566 GLU GLU D . n +D 1 567 SER 567 567 567 SER SER D . n +D 1 568 ARG 568 568 568 ARG ARG D . n +D 1 569 LEU 569 569 569 LEU LEU D . n +D 1 570 VAL 570 570 570 VAL VAL D . n +D 1 571 THR 571 571 571 THR THR D . n +D 1 572 LEU 572 572 572 LEU LEU D . n +D 1 573 PRO 573 573 573 PRO PRO D . n +D 1 574 ARG 574 574 574 ARG ARG D . n +D 1 575 GLY 575 575 575 GLY GLY D . n +D 1 576 LYS 576 576 576 LYS LYS D . n +D 1 577 TRP 577 577 577 TRP TRP D . n +D 1 578 TYR 578 578 578 TYR TYR D . n +D 1 579 ASN 579 579 579 ASN ASN D . n +D 1 580 TYR 580 580 580 TYR TYR D . n +D 1 581 TRP 581 581 581 TRP TRP D . n +D 1 582 ASN 582 582 582 ASN ASN D . n +D 1 583 GLY 583 583 583 GLY GLY D . n +D 1 584 GLU 584 584 584 GLU GLU D . n +D 1 585 ILE 585 585 585 ILE ILE D . n +D 1 586 ILE 586 586 586 ILE ILE D . n +D 1 587 ASN 587 587 587 ASN ASN D . n +D 1 588 GLY 588 588 588 GLY GLY D . n +D 1 589 LYS 589 589 589 LYS LYS D . n +D 1 590 SER 590 590 590 SER SER D . n +D 1 591 VAL 591 591 591 VAL VAL D . n +D 1 592 VAL 592 592 592 VAL VAL D . n +D 1 593 LYS 593 593 593 LYS LYS D . n +D 1 594 SER 594 594 594 SER SER D . n +D 1 595 THR 595 595 595 THR THR D . n +D 1 596 HIS 596 596 596 HIS HIS D . n +D 1 597 GLU 597 597 597 GLU GLU D . n +D 1 598 LEU 598 598 598 LEU LEU D . n +D 1 599 PRO 599 599 599 PRO PRO D . n +D 1 600 ILE 600 600 600 ILE ILE D . n +D 1 601 TYR 601 601 601 TYR TYR D . n +D 1 602 LEU 602 602 602 LEU LEU D . n +D 1 603 ARG 603 603 603 ARG ARG D . n +D 1 604 GLU 604 604 604 GLU GLU D . n +D 1 605 GLY 605 605 605 GLY GLY D . n +D 1 606 SER 606 606 606 SER SER D . n +D 1 607 ILE 607 607 607 ILE ILE D . n +D 1 608 ILE 608 608 608 ILE ILE D . n +D 1 609 PRO 609 609 609 PRO PRO D . n +D 1 610 LEU 610 610 610 LEU LEU D . n +D 1 611 GLU 611 611 611 GLU GLU D . n +D 1 612 GLY 612 612 612 GLY GLY D . n +D 1 613 ASP 613 613 613 ASP ASP D . n +D 1 614 GLU 614 614 614 GLU GLU D . n +D 1 615 LEU 615 615 615 LEU LEU D . n +D 1 616 ILE 616 616 616 ILE ILE D . n +D 1 617 VAL 617 617 617 VAL VAL D . n +D 1 618 TYR 618 618 618 TYR TYR D . n +D 1 619 GLY 619 619 619 GLY GLY D . n +D 1 620 GLU 620 620 620 GLU GLU D . n +D 1 621 THR 621 621 621 THR THR D . n +D 1 622 SER 622 622 622 SER SER D . n +D 1 623 PHE 623 623 623 PHE PHE D . n +D 1 624 LYS 624 624 624 LYS LYS D . n +D 1 625 ARG 625 625 625 ARG ARG D . n +D 1 626 TYR 626 626 626 TYR TYR D . n +D 1 627 ASP 627 627 627 ASP ASP D . n +D 1 628 ASN 628 628 628 ASN ASN D . n +D 1 629 ALA 629 629 629 ALA ALA D . n +D 1 630 GLU 630 630 630 GLU GLU D . n +D 1 631 ILE 631 631 631 ILE ILE D . n +D 1 632 THR 632 632 632 THR THR D . n +D 1 633 SER 633 633 633 SER SER D . n +D 1 634 SER 634 634 634 SER SER D . n +D 1 635 SER 635 635 635 SER SER D . n +D 1 636 ASN 636 636 636 ASN ASN D . n +D 1 637 GLU 637 637 637 GLU GLU D . n +D 1 638 ILE 638 638 638 ILE ILE D . n +D 1 639 LYS 639 639 639 LYS LYS D . n +D 1 640 PHE 640 640 640 PHE PHE D . n +D 1 641 SER 641 641 641 SER SER D . n +D 1 642 ARG 642 642 642 ARG ARG D . n +D 1 643 GLU 643 643 643 GLU GLU D . n +D 1 644 ILE 644 644 644 ILE ILE D . n +D 1 645 TYR 645 645 645 TYR TYR D . n +D 1 646 VAL 646 646 646 VAL VAL D . n +D 1 647 SER 647 647 647 SER SER D . n +D 1 648 LYS 648 648 648 LYS LYS D . n +D 1 649 LEU 649 649 649 LEU LEU D . n +D 1 650 THR 650 650 650 THR THR D . n +D 1 651 ILE 651 651 651 ILE ILE D . n +D 1 652 THR 652 652 652 THR THR D . n +D 1 653 SER 653 653 653 SER SER D . n +D 1 654 GLU 654 654 654 GLU GLU D . n +D 1 655 LYS 655 655 655 LYS LYS D . n +D 1 656 PRO 656 656 656 PRO PRO D . n +D 1 657 VAL 657 657 657 VAL VAL D . n +D 1 658 SER 658 658 658 SER SER D . n +D 1 659 LYS 659 659 659 LYS LYS D . n +D 1 660 ILE 660 660 660 ILE ILE D . n +D 1 661 ILE 661 661 661 ILE ILE D . n +D 1 662 VAL 662 662 662 VAL VAL D . n +D 1 663 ASP 663 663 663 ASP ASP D . n +D 1 664 ASP 664 664 664 ASP ASP D . n +D 1 665 SER 665 665 665 SER SER D . n +D 1 666 LYS 666 666 666 LYS LYS D . n +D 1 667 GLU 667 667 667 GLU GLU D . n +D 1 668 ILE 668 668 668 ILE ILE D . n +D 1 669 GLN 669 669 669 GLN GLN D . n +D 1 670 VAL 670 670 670 VAL VAL D . n +D 1 671 GLU 671 671 671 GLU GLU D . n +D 1 672 LYS 672 672 672 LYS LYS D . n +D 1 673 THR 673 673 673 THR THR D . n +D 1 674 MET 674 674 674 MET MET D . n +D 1 675 GLN 675 675 675 GLN GLN D . n +D 1 676 ASN 676 676 676 ASN ASN D . n +D 1 677 THR 677 677 677 THR THR D . n +D 1 678 TYR 678 678 678 TYR TYR D . n +D 1 679 VAL 679 679 679 VAL VAL D . n +D 1 680 ALA 680 680 680 ALA ALA D . n +D 1 681 LYS 681 681 681 LYS LYS D . n +D 1 682 ILE 682 682 682 ILE ILE D . n +D 1 683 ASN 683 683 683 ASN ASN D . n +D 1 684 GLN 684 684 684 GLN GLN D . n +D 1 685 LYS 685 685 685 LYS LYS D . n +D 1 686 ILE 686 686 686 ILE ILE D . n +D 1 687 ARG 687 687 687 ARG ARG D . n +D 1 688 GLY 688 688 688 GLY GLY D . n +D 1 689 LYS 689 689 689 LYS LYS D . n +D 1 690 ILE 690 690 690 ILE ILE D . n +D 1 691 ASN 691 691 691 ASN ASN D . n +D 1 692 LEU 692 692 692 LEU LEU D . n +D 1 693 GLU 693 693 693 GLU GLU D . n +E 1 1 MET 1 1 ? ? ? E . n +E 1 2 ARG 2 2 ? ? ? E . n +E 1 3 ILE 3 3 3 ILE ILE E . n +E 1 4 LEU 4 4 4 LEU LEU E . n +E 1 5 LYS 5 5 5 LYS LYS E . n +E 1 6 ILE 6 6 6 ILE ILE E . n +E 1 7 TYR 7 7 7 TYR TYR E . n +E 1 8 GLU 8 8 8 GLU GLU E . n +E 1 9 ASN 9 9 9 ASN ASN E . n +E 1 10 LYS 10 10 10 LYS LYS E . n +E 1 11 GLY 11 11 11 GLY GLY E . n +E 1 12 VAL 12 12 12 VAL VAL E . n +E 1 13 TYR 13 13 13 TYR TYR E . n +E 1 14 LYS 14 14 14 LYS LYS E . n +E 1 15 VAL 15 15 15 VAL VAL E . n +E 1 16 VAL 16 16 16 VAL VAL E . n +E 1 17 ILE 17 17 17 ILE ILE E . n +E 1 18 GLY 18 18 18 GLY GLY E . n +E 1 19 GLU 19 19 19 GLU GLU E . n +E 1 20 PRO 20 20 20 PRO PRO E . n +E 1 21 PHE 21 21 21 PHE PHE E . n +E 1 22 PRO 22 22 22 PRO PRO E . n +E 1 23 PRO 23 23 23 PRO PRO E . n +E 1 24 ILE 24 24 24 ILE ILE E . n +E 1 25 GLU 25 25 25 GLU GLU E . n +E 1 26 PHE 26 26 26 PHE PHE E . n +E 1 27 PRO 27 27 27 PRO PRO E . n +E 1 28 LEU 28 28 28 LEU LEU E . n +E 1 29 GLU 29 29 29 GLU GLU E . n +E 1 30 GLN 30 30 30 GLN GLN E . n +E 1 31 LYS 31 31 31 LYS LYS E . n +E 1 32 ILE 32 32 32 ILE ILE E . n +E 1 33 SER 33 33 33 SER SER E . n +E 1 34 SER 34 34 34 SER SER E . n +E 1 35 ASN 35 35 35 ASN ASN E . n +E 1 36 LYS 36 36 36 LYS LYS E . n +E 1 37 SER 37 37 37 SER SER E . n +E 1 38 LEU 38 38 38 LEU LEU E . n +E 1 39 SER 39 39 39 SER SER E . n +E 1 40 GLU 40 40 40 GLU GLU E . n +E 1 41 LEU 41 41 41 LEU LEU E . n +E 1 42 GLY 42 42 42 GLY GLY E . n +E 1 43 LEU 43 43 43 LEU LEU E . n +E 1 44 THR 44 44 44 THR THR E . n +E 1 45 ILE 45 45 45 ILE ILE E . n +E 1 46 VAL 46 46 46 VAL VAL E . n +E 1 47 GLN 47 47 47 GLN GLN E . n +E 1 48 GLN 48 48 48 GLN GLN E . n +E 1 49 GLY 49 49 49 GLY GLY E . n +E 1 50 ASN 50 50 50 ASN ASN E . n +E 1 51 LYS 51 51 51 LYS LYS E . n +E 1 52 VAL 52 52 52 VAL VAL E . n +E 1 53 ILE 53 53 53 ILE ILE E . n +E 1 54 VAL 54 54 54 VAL VAL E . n +E 1 55 GLU 55 55 55 GLU GLU E . n +E 1 56 LYS 56 56 56 LYS LYS E . n +E 1 57 SER 57 57 57 SER SER E . n +E 1 58 LEU 58 58 58 LEU LEU E . n +E 1 59 ASP 59 59 59 ASP ASP E . n +E 1 60 LEU 60 60 60 LEU LEU E . n +E 1 61 LYS 61 61 61 LYS LYS E . n +E 1 62 GLU 62 62 62 GLU GLU E . n +E 1 63 HIS 63 63 63 HIS HIS E . n +E 1 64 ILE 64 64 64 ILE ILE E . n +E 1 65 ILE 65 65 65 ILE ILE E . n +E 1 66 GLY 66 66 66 GLY GLY E . n +E 1 67 LEU 67 67 67 LEU LEU E . n +E 1 68 GLY 68 68 68 GLY GLY E . n +E 1 69 GLU 69 69 69 GLU GLU E . n +E 1 70 LYS 70 70 70 LYS LYS E . n +E 1 71 ALA 71 71 71 ALA ALA E . n +E 1 72 PHE 72 72 72 PHE PHE E . n +E 1 73 GLU 73 73 73 GLU GLU E . n +E 1 74 LEU 74 74 74 LEU LEU E . n +E 1 75 ASP 75 75 75 ASP ASP E . n +E 1 76 ARG 76 76 76 ARG ARG E . n +E 1 77 LYS 77 77 77 LYS LYS E . n +E 1 78 ARG 78 78 78 ARG ARG E . n +E 1 79 LYS 79 79 79 LYS LYS E . n +E 1 80 ARG 80 80 80 ARG ARG E . n +E 1 81 TYR 81 81 81 TYR TYR E . n +E 1 82 VAL 82 82 82 VAL VAL E . n +E 1 83 MET 83 83 83 MET MET E . n +E 1 84 TYR 84 84 84 TYR TYR E . n +E 1 85 ASN 85 85 85 ASN ASN E . n +E 1 86 VAL 86 86 86 VAL VAL E . n +E 1 87 ASP 87 87 87 ASP ASP E . n +E 1 88 ALA 88 88 88 ALA ALA E . n +E 1 89 GLY 89 89 89 GLY GLY E . n +E 1 90 ALA 90 90 90 ALA ALA E . n +E 1 91 TYR 91 91 91 TYR TYR E . n +E 1 92 LYS 92 92 92 LYS LYS E . n +E 1 93 LYS 93 93 93 LYS LYS E . n +E 1 94 TYR 94 94 94 TYR TYR E . n +E 1 95 GLN 95 95 95 GLN GLN E . n +E 1 96 ASP 96 96 96 ASP ASP E . n +E 1 97 PRO 97 97 97 PRO PRO E . n +E 1 98 LEU 98 98 98 LEU LEU E . n +E 1 99 TYR 99 99 99 TYR TYR E . n +E 1 100 VAL 100 100 100 VAL VAL E . n +E 1 101 SER 101 101 101 SER SER E . n +E 1 102 ILE 102 102 102 ILE ILE E . n +E 1 103 PRO 103 103 103 PRO PRO E . n +E 1 104 LEU 104 104 104 LEU LEU E . n +E 1 105 PHE 105 105 105 PHE PHE E . n +E 1 106 ILE 106 106 106 ILE ILE E . n +E 1 107 SER 107 107 107 SER SER E . n +E 1 108 VAL 108 108 108 VAL VAL E . n +E 1 109 LYS 109 109 109 LYS LYS E . n +E 1 110 ASP 110 110 110 ASP ASP E . n +E 1 111 GLY 111 111 111 GLY GLY E . n +E 1 112 VAL 112 112 112 VAL VAL E . n +E 1 113 ALA 113 113 113 ALA ALA E . n +E 1 114 THR 114 114 114 THR THR E . n +E 1 115 GLY 115 115 115 GLY GLY E . n +E 1 116 TYR 116 116 116 TYR TYR E . n +E 1 117 PHE 117 117 117 PHE PHE E . n +E 1 118 PHE 118 118 118 PHE PHE E . n +E 1 119 ASN 119 119 119 ASN ASN E . n +E 1 120 SER 120 120 120 SER SER E . n +E 1 121 ALA 121 121 121 ALA ALA E . n +E 1 122 SER 122 122 122 SER SER E . n +E 1 123 LYS 123 123 123 LYS LYS E . n +E 1 124 VAL 124 124 124 VAL VAL E . n +E 1 125 ILE 125 125 125 ILE ILE E . n +E 1 126 PHE 126 126 126 PHE PHE E . n +E 1 127 ASP 127 127 127 ASP ASP E . n +E 1 128 VAL 128 128 128 VAL VAL E . n +E 1 129 GLY 129 129 129 GLY GLY E . n +E 1 130 LEU 130 130 130 LEU LEU E . n +E 1 131 GLU 131 131 131 GLU GLU E . n +E 1 132 GLU 132 132 132 GLU GLU E . n +E 1 133 TYR 133 133 133 TYR TYR E . n +E 1 134 ASP 134 134 134 ASP ASP E . n +E 1 135 LYS 135 135 135 LYS LYS E . n +E 1 136 VAL 136 136 136 VAL VAL E . n +E 1 137 ILE 137 137 137 ILE ILE E . n +E 1 138 VAL 138 138 138 VAL VAL E . n +E 1 139 THR 139 139 139 THR THR E . n +E 1 140 ILE 140 140 140 ILE ILE E . n +E 1 141 PRO 141 141 141 PRO PRO E . n +E 1 142 GLU 142 142 142 GLU GLU E . n +E 1 143 ASP 143 143 143 ASP ASP E . n +E 1 144 SER 144 144 144 SER SER E . n +E 1 145 VAL 145 145 145 VAL VAL E . n +E 1 146 GLU 146 146 146 GLU GLU E . n +E 1 147 PHE 147 147 147 PHE PHE E . n +E 1 148 TYR 148 148 148 TYR TYR E . n +E 1 149 VAL 149 149 149 VAL VAL E . n +E 1 150 ILE 150 150 150 ILE ILE E . n +E 1 151 GLU 151 151 151 GLU GLU E . n +E 1 152 GLY 152 152 152 GLY GLY E . n +E 1 153 PRO 153 153 153 PRO PRO E . n +E 1 154 ARG 154 154 154 ARG ARG E . n +E 1 155 ILE 155 155 155 ILE ILE E . n +E 1 156 GLU 156 156 156 GLU GLU E . n +E 1 157 ASP 157 157 157 ASP ASP E . n +E 1 158 VAL 158 158 158 VAL VAL E . n +E 1 159 LEU 159 159 159 LEU LEU E . n +E 1 160 GLU 160 160 160 GLU GLU E . n +E 1 161 LYS 161 161 161 LYS LYS E . n +E 1 162 TYR 162 162 162 TYR TYR E . n +E 1 163 THR 163 163 163 THR THR E . n +E 1 164 GLU 164 164 164 GLU GLU E . n +E 1 165 LEU 165 165 165 LEU LEU E . n +E 1 166 THR 166 166 166 THR THR E . n +E 1 167 GLY 167 167 167 GLY GLY E . n +E 1 168 LYS 168 168 168 LYS LYS E . n +E 1 169 PRO 169 169 169 PRO PRO E . n +E 1 170 PHE 170 170 170 PHE PHE E . n +E 1 171 LEU 171 171 171 LEU LEU E . n +E 1 172 PRO 172 172 172 PRO PRO E . n +E 1 173 PRO 173 173 173 PRO PRO E . n +E 1 174 MET 174 174 174 MET MET E . n +E 1 175 TRP 175 175 175 TRP TRP E . n +E 1 176 ALA 176 176 176 ALA ALA E . n +E 1 177 PHE 177 177 177 PHE PHE E . n +E 1 178 GLY 178 178 178 GLY GLY E . n +E 1 179 TYR 179 179 179 TYR TYR E . n +E 1 180 MET 180 180 180 MET MET E . n +E 1 181 ILE 181 181 181 ILE ILE E . n +E 1 182 SER 182 182 182 SER SER E . n +E 1 183 ARG 183 183 183 ARG ARG E . n +E 1 184 TYR 184 184 184 TYR TYR E . n +E 1 185 SER 185 185 185 SER SER E . n +E 1 186 TYR 186 186 186 TYR TYR E . n +E 1 187 TYR 187 187 187 TYR TYR E . n +E 1 188 PRO 188 188 188 PRO PRO E . n +E 1 189 GLN 189 189 189 GLN GLN E . n +E 1 190 ASP 190 190 190 ASP ASP E . n +E 1 191 LYS 191 191 191 LYS LYS E . n +E 1 192 VAL 192 192 192 VAL VAL E . n +E 1 193 VAL 193 193 193 VAL VAL E . n +E 1 194 GLU 194 194 194 GLU GLU E . n +E 1 195 LEU 195 195 195 LEU LEU E . n +E 1 196 VAL 196 196 196 VAL VAL E . n +E 1 197 ASP 197 197 197 ASP ASP E . n +E 1 198 ILE 198 198 198 ILE ILE E . n +E 1 199 MET 199 199 199 MET MET E . n +E 1 200 GLN 200 200 200 GLN GLN E . n +E 1 201 LYS 201 201 201 LYS LYS E . n +E 1 202 GLU 202 202 202 GLU GLU E . n +E 1 203 GLY 203 203 203 GLY GLY E . n +E 1 204 PHE 204 204 204 PHE PHE E . n +E 1 205 ARG 205 205 205 ARG ARG E . n +E 1 206 VAL 206 206 206 VAL VAL E . n +E 1 207 ALA 207 207 207 ALA ALA E . n +E 1 208 GLY 208 208 208 GLY GLY E . n +E 1 209 VAL 209 209 209 VAL VAL E . n +E 1 210 PHE 210 210 210 PHE PHE E . n +E 1 211 LEU 211 211 211 LEU LEU E . n +E 1 212 ASP 212 212 212 ASP ASP E . n +E 1 213 ILE 213 213 213 ILE ILE E . n +E 1 214 HIS 214 214 214 HIS HIS E . n +E 1 215 TYR 215 215 215 TYR TYR E . n +E 1 216 MET 216 216 216 MET MET E . n +E 1 217 ASP 217 217 217 ASP ASP E . n +E 1 218 SER 218 218 218 SER SER E . n +E 1 219 TYR 219 219 219 TYR TYR E . n +E 1 220 LYS 220 220 220 LYS LYS E . n +E 1 221 LEU 221 221 221 LEU LEU E . n +E 1 222 PHE 222 222 222 PHE PHE E . n +E 1 223 THR 223 223 223 THR THR E . n +E 1 224 TRP 224 224 224 TRP TRP E . n +E 1 225 HIS 225 225 225 HIS HIS E . n +E 1 226 PRO 226 226 226 PRO PRO E . n +E 1 227 TYR 227 227 227 TYR TYR E . n +E 1 228 ARG 228 228 228 ARG ARG E . n +E 1 229 PHE 229 229 229 PHE PHE E . n +E 1 230 PRO 230 230 230 PRO PRO E . n +E 1 231 GLU 231 231 231 GLU GLU E . n +E 1 232 PRO 232 232 232 PRO PRO E . n +E 1 233 LYS 233 233 233 LYS LYS E . n +E 1 234 LYS 234 234 234 LYS LYS E . n +E 1 235 LEU 235 235 235 LEU LEU E . n +E 1 236 ILE 236 236 236 ILE ILE E . n +E 1 237 ASP 237 237 237 ASP ASP E . n +E 1 238 GLU 238 238 238 GLU GLU E . n +E 1 239 LEU 239 239 239 LEU LEU E . n +E 1 240 HIS 240 240 240 HIS HIS E . n +E 1 241 LYS 241 241 241 LYS LYS E . n +E 1 242 ARG 242 242 242 ARG ARG E . n +E 1 243 ASN 243 243 243 ASN ASN E . n +E 1 244 VAL 244 244 244 VAL VAL E . n +E 1 245 LYS 245 245 245 LYS LYS E . n +E 1 246 LEU 246 246 246 LEU LEU E . n +E 1 247 ILE 247 247 247 ILE ILE E . n +E 1 248 THR 248 248 248 THR THR E . n +E 1 249 ILE 249 249 249 ILE ILE E . n +E 1 250 VAL 250 250 250 VAL VAL E . n +E 1 251 ASP 251 251 251 ASP ASP E . n +E 1 252 HIS 252 252 252 HIS HIS E . n +E 1 253 GLY 253 253 253 GLY GLY E . n +E 1 254 ILE 254 254 254 ILE ILE E . n +E 1 255 ARG 255 255 255 ARG ARG E . n +E 1 256 VAL 256 256 256 VAL VAL E . n +E 1 257 ASP 257 257 257 ASP ASP E . n +E 1 258 GLN 258 258 258 GLN GLN E . n +E 1 259 ASN 259 259 259 ASN ASN E . n +E 1 260 TYR 260 260 260 TYR TYR E . n +E 1 261 SER 261 261 261 SER SER E . n +E 1 262 PRO 262 262 262 PRO PRO E . n +E 1 263 PHE 263 263 263 PHE PHE E . n +E 1 264 LEU 264 264 264 LEU LEU E . n +E 1 265 SER 265 265 265 SER SER E . n +E 1 266 GLY 266 266 266 GLY GLY E . n +E 1 267 MET 267 267 267 MET MET E . n +E 1 268 GLY 268 268 268 GLY GLY E . n +E 1 269 LYS 269 269 269 LYS LYS E . n +E 1 270 PHE 270 270 270 PHE PHE E . n +E 1 271 CYS 271 271 271 CYS CYS E . n +E 1 272 GLU 272 272 272 GLU GLU E . n +E 1 273 ILE 273 273 273 ILE ILE E . n +E 1 274 GLU 274 274 274 GLU GLU E . n +E 1 275 SER 275 275 275 SER SER E . n +E 1 276 GLY 276 276 276 GLY GLY E . n +E 1 277 GLU 277 277 277 GLU GLU E . n +E 1 278 LEU 278 278 278 LEU LEU E . n +E 1 279 PHE 279 279 279 PHE PHE E . n +E 1 280 VAL 280 280 280 VAL VAL E . n +E 1 281 GLY 281 281 281 GLY GLY E . n +E 1 282 LYS 282 282 282 LYS LYS E . n +E 1 283 MET 283 283 283 MET MET E . n +E 1 284 TRP 284 284 284 TRP TRP E . n +E 1 285 PRO 285 285 285 PRO PRO E . n +E 1 286 GLY 286 286 286 GLY GLY E . n +E 1 287 THR 287 287 287 THR THR E . n +E 1 288 THR 288 288 288 THR THR E . n +E 1 289 VAL 289 289 289 VAL VAL E . n +E 1 290 TYR 290 290 290 TYR TYR E . n +E 1 291 PRO 291 291 291 PRO PRO E . n +E 1 292 ASP 292 292 292 ASP ASP E . n +E 1 293 PHE 293 293 293 PHE PHE E . n +E 1 294 PHE 294 294 294 PHE PHE E . n +E 1 295 ARG 295 295 295 ARG ARG E . n +E 1 296 GLU 296 296 296 GLU GLU E . n +E 1 297 ASP 297 297 297 ASP ASP E . n +E 1 298 THR 298 298 298 THR THR E . n +E 1 299 ARG 299 299 299 ARG ARG E . n +E 1 300 GLU 300 300 300 GLU GLU E . n +E 1 301 TRP 301 301 301 TRP TRP E . n +E 1 302 TRP 302 302 302 TRP TRP E . n +E 1 303 ALA 303 303 303 ALA ALA E . n +E 1 304 GLY 304 304 304 GLY GLY E . n +E 1 305 LEU 305 305 305 LEU LEU E . n +E 1 306 ILE 306 306 306 ILE ILE E . n +E 1 307 SER 307 307 307 SER SER E . n +E 1 308 GLU 308 308 308 GLU GLU E . n +E 1 309 TRP 309 309 309 TRP TRP E . n +E 1 310 LEU 310 310 310 LEU LEU E . n +E 1 311 SER 311 311 311 SER SER E . n +E 1 312 GLN 312 312 312 GLN GLN E . n +E 1 313 GLY 313 313 313 GLY GLY E . n +E 1 314 VAL 314 314 314 VAL VAL E . n +E 1 315 ASP 315 315 315 ASP ASP E . n +E 1 316 GLY 316 316 316 GLY GLY E . n +E 1 317 ILE 317 317 317 ILE ILE E . n +E 1 318 TRP 318 318 318 TRP TRP E . n +E 1 319 LEU 319 319 319 LEU LEU E . n +E 1 320 ASP 320 320 320 ASP ASP E . n +E 1 321 MET 321 321 321 MET MET E . n +E 1 322 ASN 322 322 322 ASN ASN E . n +E 1 323 GLU 323 323 323 GLU GLU E . n +E 1 324 PRO 324 324 324 PRO PRO E . n +E 1 325 THR 325 325 325 THR THR E . n +E 1 326 ASP 326 326 326 ASP ASP E . n +E 1 327 PHE 327 327 327 PHE PHE E . n +E 1 328 SER 328 328 328 SER SER E . n +E 1 329 ARG 329 329 329 ARG ARG E . n +E 1 330 ALA 330 330 330 ALA ALA E . n +E 1 331 ILE 331 331 331 ILE ILE E . n +E 1 332 GLU 332 332 332 GLU GLU E . n +E 1 333 ILE 333 333 333 ILE ILE E . n +E 1 334 ARG 334 334 334 ARG ARG E . n +E 1 335 ASP 335 335 335 ASP ASP E . n +E 1 336 VAL 336 336 336 VAL VAL E . n +E 1 337 LEU 337 337 337 LEU LEU E . n +E 1 338 SER 338 338 338 SER SER E . n +E 1 339 SER 339 339 339 SER SER E . n +E 1 340 LEU 340 340 340 LEU LEU E . n +E 1 341 PRO 341 341 341 PRO PRO E . n +E 1 342 VAL 342 342 342 VAL VAL E . n +E 1 343 GLN 343 343 343 GLN GLN E . n +E 1 344 PHE 344 344 344 PHE PHE E . n +E 1 345 ARG 345 345 345 ARG ARG E . n +E 1 346 ASP 346 346 346 ASP ASP E . n +E 1 347 ASP 347 347 347 ASP ASP E . n +E 1 348 ARG 348 348 348 ARG ARG E . n +E 1 349 LEU 349 349 349 LEU LEU E . n +E 1 350 VAL 350 350 350 VAL VAL E . n +E 1 351 THR 351 351 351 THR THR E . n +E 1 352 THR 352 352 352 THR THR E . n +E 1 353 PHE 353 353 353 PHE PHE E . n +E 1 354 PRO 354 354 354 PRO PRO E . n +E 1 355 ASP 355 355 355 ASP ASP E . n +E 1 356 ASN 356 356 356 ASN ASN E . n +E 1 357 VAL 357 357 357 VAL VAL E . n +E 1 358 VAL 358 358 358 VAL VAL E . n +E 1 359 HIS 359 359 359 HIS HIS E . n +E 1 360 TYR 360 360 360 TYR TYR E . n +E 1 361 LEU 361 361 361 LEU LEU E . n +E 1 362 ARG 362 362 362 ARG ARG E . n +E 1 363 GLY 363 363 363 GLY GLY E . n +E 1 364 LYS 364 364 364 LYS LYS E . n +E 1 365 ARG 365 365 365 ARG ARG E . n +E 1 366 VAL 366 366 366 VAL VAL E . n +E 1 367 LYS 367 367 367 LYS LYS E . n +E 1 368 HIS 368 368 368 HIS HIS E . n +E 1 369 GLU 369 369 369 GLU GLU E . n +E 1 370 LYS 370 370 370 LYS LYS E . n +E 1 371 VAL 371 371 371 VAL VAL E . n +E 1 372 ARG 372 372 372 ARG ARG E . n +E 1 373 ASN 373 373 373 ASN ASN E . n +E 1 374 ALA 374 374 374 ALA ALA E . n +E 1 375 TYR 375 375 375 TYR TYR E . n +E 1 376 PRO 376 376 376 PRO PRO E . n +E 1 377 LEU 377 377 377 LEU LEU E . n +E 1 378 TYR 378 378 378 TYR TYR E . n +E 1 379 GLU 379 379 379 GLU GLU E . n +E 1 380 ALA 380 380 380 ALA ALA E . n +E 1 381 MET 381 381 381 MET MET E . n +E 1 382 ALA 382 382 382 ALA ALA E . n +E 1 383 THR 383 383 383 THR THR E . n +E 1 384 PHE 384 384 384 PHE PHE E . n +E 1 385 LYS 385 385 385 LYS LYS E . n +E 1 386 GLY 386 386 386 GLY GLY E . n +E 1 387 PHE 387 387 387 PHE PHE E . n +E 1 388 ARG 388 388 388 ARG ARG E . n +E 1 389 THR 389 389 389 THR THR E . n +E 1 390 SER 390 390 390 SER SER E . n +E 1 391 HIS 391 391 391 HIS HIS E . n +E 1 392 ARG 392 392 392 ARG ARG E . n +E 1 393 ASN 393 393 393 ASN ASN E . n +E 1 394 GLU 394 394 394 GLU GLU E . n +E 1 395 ILE 395 395 395 ILE ILE E . n +E 1 396 PHE 396 396 396 PHE PHE E . n +E 1 397 ILE 397 397 397 ILE ILE E . n +E 1 398 LEU 398 398 398 LEU LEU E . n +E 1 399 SER 399 399 399 SER SER E . n +E 1 400 ARG 400 400 400 ARG ARG E . n +E 1 401 ALA 401 401 401 ALA ALA E . n +E 1 402 GLY 402 402 402 GLY GLY E . n +E 1 403 TYR 403 403 403 TYR TYR E . n +E 1 404 ALA 404 404 404 ALA ALA E . n +E 1 405 GLY 405 405 405 GLY GLY E . n +E 1 406 ILE 406 406 406 ILE ILE E . n +E 1 407 GLN 407 407 407 GLN GLN E . n +E 1 408 ARG 408 408 408 ARG ARG E . n +E 1 409 TYR 409 409 409 TYR TYR E . n +E 1 410 ALA 410 410 410 ALA ALA E . n +E 1 411 PHE 411 411 411 PHE PHE E . n +E 1 412 ILE 412 412 412 ILE ILE E . n +E 1 413 TRP 413 413 413 TRP TRP E . n +E 1 414 THR 414 414 414 THR THR E . n +E 1 415 GLY 415 415 415 GLY GLY E . n +E 1 416 ASP 416 416 416 ASP ASP E . n +E 1 417 ASN 417 417 417 ASN ASN E . n +E 1 418 THR 418 418 418 THR THR E . n +E 1 419 PRO 419 419 419 PRO PRO E . n +E 1 420 SER 420 420 420 SER SER E . n +E 1 421 TRP 421 421 421 TRP TRP E . n +E 1 422 ASP 422 422 422 ASP ASP E . n +E 1 423 ASP 423 423 423 ASP ASP E . n +E 1 424 LEU 424 424 424 LEU LEU E . n +E 1 425 LYS 425 425 425 LYS LYS E . n +E 1 426 LEU 426 426 426 LEU LEU E . n +E 1 427 GLN 427 427 427 GLN GLN E . n +E 1 428 LEU 428 428 428 LEU LEU E . n +E 1 429 GLN 429 429 429 GLN GLN E . n +E 1 430 LEU 430 430 430 LEU LEU E . n +E 1 431 VAL 431 431 431 VAL VAL E . n +E 1 432 LEU 432 432 432 LEU LEU E . n +E 1 433 GLY 433 433 433 GLY GLY E . n +E 1 434 LEU 434 434 434 LEU LEU E . n +E 1 435 SER 435 435 435 SER SER E . n +E 1 436 ILE 436 436 436 ILE ILE E . n +E 1 437 SER 437 437 437 SER SER E . n +E 1 438 GLY 438 438 438 GLY GLY E . n +E 1 439 VAL 439 439 439 VAL VAL E . n +E 1 440 PRO 440 440 440 PRO PRO E . n +E 1 441 PHE 441 441 441 PHE PHE E . n +E 1 442 VAL 442 442 442 VAL VAL E . n +E 1 443 GLY 443 443 443 GLY GLY E . n +E 1 444 CYS 444 444 444 CYS CYS E . n +E 1 445 ASP 445 445 445 ASP ASP E . n +E 1 446 ILE 446 446 446 ILE ILE E . n +E 1 447 GLY 447 447 447 GLY GLY E . n +E 1 448 GLY 448 448 448 GLY GLY E . n +E 1 449 PHE 449 449 449 PHE PHE E . n +E 1 450 GLN 450 450 450 GLN GLN E . n +E 1 451 GLY 451 451 451 GLY GLY E . n +E 1 452 ARG 452 452 452 ARG ARG E . n +E 1 453 ASN 453 453 453 ASN ASN E . n +E 1 454 PHE 454 454 454 PHE PHE E . n +E 1 455 ALA 455 455 455 ALA ALA E . n +E 1 456 GLU 456 456 456 GLU GLU E . n +E 1 457 ILE 457 457 457 ILE ILE E . n +E 1 458 ASP 458 458 458 ASP ASP E . n +E 1 459 ASN 459 459 459 ASN ASN E . n +E 1 460 SER 460 460 460 SER SER E . n +E 1 461 MET 461 461 461 MET MET E . n +E 1 462 ASP 462 462 462 ASP ASP E . n +E 1 463 LEU 463 463 463 LEU LEU E . n +E 1 464 LEU 464 464 464 LEU LEU E . n +E 1 465 VAL 465 465 465 VAL VAL E . n +E 1 466 LYS 466 466 466 LYS LYS E . n +E 1 467 TYR 467 467 467 TYR TYR E . n +E 1 468 TYR 468 468 468 TYR TYR E . n +E 1 469 ALA 469 469 469 ALA ALA E . n +E 1 470 LEU 470 470 470 LEU LEU E . n +E 1 471 ALA 471 471 471 ALA ALA E . n +E 1 472 LEU 472 472 472 LEU LEU E . n +E 1 473 PHE 473 473 473 PHE PHE E . n +E 1 474 PHE 474 474 474 PHE PHE E . n +E 1 475 PRO 475 475 475 PRO PRO E . n +E 1 476 PHE 476 476 476 PHE PHE E . n +E 1 477 TYR 477 477 477 TYR TYR E . n +E 1 478 ARG 478 478 478 ARG ARG E . n +E 1 479 SER 479 479 479 SER SER E . n +E 1 480 HIS 480 480 480 HIS HIS E . n +E 1 481 LYS 481 481 481 LYS LYS E . n +E 1 482 ALA 482 482 482 ALA ALA E . n +E 1 483 THR 483 483 483 THR THR E . n +E 1 484 ASP 484 484 484 ASP ASP E . n +E 1 485 GLY 485 485 485 GLY GLY E . n +E 1 486 ILE 486 486 486 ILE ILE E . n +E 1 487 ASP 487 487 487 ASP ASP E . n +E 1 488 THR 488 488 488 THR THR E . n +E 1 489 GLU 489 489 489 GLU GLU E . n +E 1 490 PRO 490 490 490 PRO PRO E . n +E 1 491 VAL 491 491 491 VAL VAL E . n +E 1 492 PHE 492 492 492 PHE PHE E . n +E 1 493 LEU 493 493 493 LEU LEU E . n +E 1 494 PRO 494 494 494 PRO PRO E . n +E 1 495 ASP 495 495 495 ASP ASP E . n +E 1 496 TYR 496 496 496 TYR TYR E . n +E 1 497 TYR 497 497 497 TYR TYR E . n +E 1 498 LYS 498 498 498 LYS LYS E . n +E 1 499 GLU 499 499 499 GLU GLU E . n +E 1 500 LYS 500 500 500 LYS LYS E . n +E 1 501 VAL 501 501 501 VAL VAL E . n +E 1 502 LYS 502 502 502 LYS LYS E . n +E 1 503 GLU 503 503 503 GLU GLU E . n +E 1 504 ILE 504 504 504 ILE ILE E . n +E 1 505 VAL 505 505 505 VAL VAL E . n +E 1 506 GLU 506 506 506 GLU GLU E . n +E 1 507 LEU 507 507 507 LEU LEU E . n +E 1 508 ARG 508 508 508 ARG ARG E . n +E 1 509 TYR 509 509 509 TYR TYR E . n +E 1 510 LYS 510 510 510 LYS LYS E . n +E 1 511 PHE 511 511 511 PHE PHE E . n +E 1 512 LEU 512 512 512 LEU LEU E . n +E 1 513 PRO 513 513 513 PRO PRO E . n +E 1 514 TYR 514 514 514 TYR TYR E . n +E 1 515 ILE 515 515 515 ILE ILE E . n +E 1 516 TYR 516 516 516 TYR TYR E . n +E 1 517 SER 517 517 517 SER SER E . n +E 1 518 LEU 518 518 518 LEU LEU E . n +E 1 519 ALA 519 519 519 ALA ALA E . n +E 1 520 LEU 520 520 520 LEU LEU E . n +E 1 521 GLU 521 521 521 GLU GLU E . n +E 1 522 ALA 522 522 522 ALA ALA E . n +E 1 523 SER 523 523 523 SER SER E . n +E 1 524 GLU 524 524 524 GLU GLU E . n +E 1 525 LYS 525 525 525 LYS LYS E . n +E 1 526 GLY 526 526 526 GLY GLY E . n +E 1 527 HIS 527 527 527 HIS HIS E . n +E 1 528 PRO 528 528 528 PRO PRO E . n +E 1 529 VAL 529 529 529 VAL VAL E . n +E 1 530 ILE 530 530 530 ILE ILE E . n +E 1 531 ARG 531 531 531 ARG ARG E . n +E 1 532 PRO 532 532 532 PRO PRO E . n +E 1 533 LEU 533 533 533 LEU LEU E . n +E 1 534 PHE 534 534 534 PHE PHE E . n +E 1 535 TYR 535 535 535 TYR TYR E . n +E 1 536 GLU 536 536 536 GLU GLU E . n +E 1 537 PHE 537 537 537 PHE PHE E . n +E 1 538 GLN 538 538 538 GLN GLN E . n +E 1 539 ASP 539 539 539 ASP ASP E . n +E 1 540 ASP 540 540 540 ASP ASP E . n +E 1 541 ASP 541 541 541 ASP ASP E . n +E 1 542 ASP 542 542 542 ASP ASP E . n +E 1 543 MET 543 543 543 MET MET E . n +E 1 544 TYR 544 544 544 TYR TYR E . n +E 1 545 ARG 545 545 545 ARG ARG E . n +E 1 546 ILE 546 546 546 ILE ILE E . n +E 1 547 GLU 547 547 547 GLU GLU E . n +E 1 548 ASP 548 548 548 ASP ASP E . n +E 1 549 GLU 549 549 549 GLU GLU E . n +E 1 550 TYR 550 550 550 TYR TYR E . n +E 1 551 MET 551 551 551 MET MET E . n +E 1 552 VAL 552 552 552 VAL VAL E . n +E 1 553 GLY 553 553 553 GLY GLY E . n +E 1 554 LYS 554 554 554 LYS LYS E . n +E 1 555 TYR 555 555 555 TYR TYR E . n +E 1 556 LEU 556 556 556 LEU LEU E . n +E 1 557 LEU 557 557 557 LEU LEU E . n +E 1 558 TYR 558 558 558 TYR TYR E . n +E 1 559 ALA 559 559 559 ALA ALA E . n +E 1 560 PRO 560 560 560 PRO PRO E . n +E 1 561 ILE 561 561 561 ILE ILE E . n +E 1 562 VAL 562 562 562 VAL VAL E . n +E 1 563 SER 563 563 563 SER SER E . n +E 1 564 LYS 564 564 564 LYS LYS E . n +E 1 565 GLU 565 565 565 GLU GLU E . n +E 1 566 GLU 566 566 566 GLU GLU E . n +E 1 567 SER 567 567 567 SER SER E . n +E 1 568 ARG 568 568 568 ARG ARG E . n +E 1 569 LEU 569 569 569 LEU LEU E . n +E 1 570 VAL 570 570 570 VAL VAL E . n +E 1 571 THR 571 571 571 THR THR E . n +E 1 572 LEU 572 572 572 LEU LEU E . n +E 1 573 PRO 573 573 573 PRO PRO E . n +E 1 574 ARG 574 574 574 ARG ARG E . n +E 1 575 GLY 575 575 575 GLY GLY E . n +E 1 576 LYS 576 576 576 LYS LYS E . n +E 1 577 TRP 577 577 577 TRP TRP E . n +E 1 578 TYR 578 578 578 TYR TYR E . n +E 1 579 ASN 579 579 579 ASN ASN E . n +E 1 580 TYR 580 580 580 TYR TYR E . n +E 1 581 TRP 581 581 581 TRP TRP E . n +E 1 582 ASN 582 582 582 ASN ASN E . n +E 1 583 GLY 583 583 583 GLY GLY E . n +E 1 584 GLU 584 584 584 GLU GLU E . n +E 1 585 ILE 585 585 585 ILE ILE E . n +E 1 586 ILE 586 586 586 ILE ILE E . n +E 1 587 ASN 587 587 587 ASN ASN E . n +E 1 588 GLY 588 588 588 GLY GLY E . n +E 1 589 LYS 589 589 589 LYS LYS E . n +E 1 590 SER 590 590 590 SER SER E . n +E 1 591 VAL 591 591 591 VAL VAL E . n +E 1 592 VAL 592 592 592 VAL VAL E . n +E 1 593 LYS 593 593 593 LYS LYS E . n +E 1 594 SER 594 594 594 SER SER E . n +E 1 595 THR 595 595 595 THR THR E . n +E 1 596 HIS 596 596 596 HIS HIS E . n +E 1 597 GLU 597 597 597 GLU GLU E . n +E 1 598 LEU 598 598 598 LEU LEU E . n +E 1 599 PRO 599 599 599 PRO PRO E . n +E 1 600 ILE 600 600 600 ILE ILE E . n +E 1 601 TYR 601 601 601 TYR TYR E . n +E 1 602 LEU 602 602 602 LEU LEU E . n +E 1 603 ARG 603 603 603 ARG ARG E . n +E 1 604 GLU 604 604 604 GLU GLU E . n +E 1 605 GLY 605 605 605 GLY GLY E . n +E 1 606 SER 606 606 606 SER SER E . n +E 1 607 ILE 607 607 607 ILE ILE E . n +E 1 608 ILE 608 608 608 ILE ILE E . n +E 1 609 PRO 609 609 609 PRO PRO E . n +E 1 610 LEU 610 610 610 LEU LEU E . n +E 1 611 GLU 611 611 611 GLU GLU E . n +E 1 612 GLY 612 612 612 GLY GLY E . n +E 1 613 ASP 613 613 613 ASP ASP E . n +E 1 614 GLU 614 614 614 GLU GLU E . n +E 1 615 LEU 615 615 615 LEU LEU E . n +E 1 616 ILE 616 616 616 ILE ILE E . n +E 1 617 VAL 617 617 617 VAL VAL E . n +E 1 618 TYR 618 618 618 TYR TYR E . n +E 1 619 GLY 619 619 619 GLY GLY E . n +E 1 620 GLU 620 620 620 GLU GLU E . n +E 1 621 THR 621 621 621 THR THR E . n +E 1 622 SER 622 622 622 SER SER E . n +E 1 623 PHE 623 623 623 PHE PHE E . n +E 1 624 LYS 624 624 624 LYS LYS E . n +E 1 625 ARG 625 625 625 ARG ARG E . n +E 1 626 TYR 626 626 626 TYR TYR E . n +E 1 627 ASP 627 627 627 ASP ASP E . n +E 1 628 ASN 628 628 628 ASN ASN E . n +E 1 629 ALA 629 629 629 ALA ALA E . n +E 1 630 GLU 630 630 630 GLU GLU E . n +E 1 631 ILE 631 631 631 ILE ILE E . n +E 1 632 THR 632 632 632 THR THR E . n +E 1 633 SER 633 633 633 SER SER E . n +E 1 634 SER 634 634 634 SER SER E . n +E 1 635 SER 635 635 635 SER SER E . n +E 1 636 ASN 636 636 636 ASN ASN E . n +E 1 637 GLU 637 637 637 GLU GLU E . n +E 1 638 ILE 638 638 638 ILE ILE E . n +E 1 639 LYS 639 639 639 LYS LYS E . n +E 1 640 PHE 640 640 640 PHE PHE E . n +E 1 641 SER 641 641 641 SER SER E . n +E 1 642 ARG 642 642 642 ARG ARG E . n +E 1 643 GLU 643 643 643 GLU GLU E . n +E 1 644 ILE 644 644 644 ILE ILE E . n +E 1 645 TYR 645 645 645 TYR TYR E . n +E 1 646 VAL 646 646 646 VAL VAL E . n +E 1 647 SER 647 647 647 SER SER E . n +E 1 648 LYS 648 648 648 LYS LYS E . n +E 1 649 LEU 649 649 649 LEU LEU E . n +E 1 650 THR 650 650 650 THR THR E . n +E 1 651 ILE 651 651 651 ILE ILE E . n +E 1 652 THR 652 652 652 THR THR E . n +E 1 653 SER 653 653 653 SER SER E . n +E 1 654 GLU 654 654 654 GLU GLU E . n +E 1 655 LYS 655 655 655 LYS LYS E . n +E 1 656 PRO 656 656 656 PRO PRO E . n +E 1 657 VAL 657 657 657 VAL VAL E . n +E 1 658 SER 658 658 658 SER SER E . n +E 1 659 LYS 659 659 659 LYS LYS E . n +E 1 660 ILE 660 660 660 ILE ILE E . n +E 1 661 ILE 661 661 661 ILE ILE E . n +E 1 662 VAL 662 662 662 VAL VAL E . n +E 1 663 ASP 663 663 663 ASP ASP E . n +E 1 664 ASP 664 664 664 ASP ASP E . n +E 1 665 SER 665 665 665 SER SER E . n +E 1 666 LYS 666 666 666 LYS LYS E . n +E 1 667 GLU 667 667 667 GLU GLU E . n +E 1 668 ILE 668 668 668 ILE ILE E . n +E 1 669 GLN 669 669 669 GLN GLN E . n +E 1 670 VAL 670 670 670 VAL VAL E . n +E 1 671 GLU 671 671 671 GLU GLU E . n +E 1 672 LYS 672 672 672 LYS LYS E . n +E 1 673 THR 673 673 673 THR THR E . n +E 1 674 MET 674 674 674 MET MET E . n +E 1 675 GLN 675 675 675 GLN GLN E . n +E 1 676 ASN 676 676 676 ASN ASN E . n +E 1 677 THR 677 677 677 THR THR E . n +E 1 678 TYR 678 678 678 TYR TYR E . n +E 1 679 VAL 679 679 679 VAL VAL E . n +E 1 680 ALA 680 680 680 ALA ALA E . n +E 1 681 LYS 681 681 681 LYS LYS E . n +E 1 682 ILE 682 682 682 ILE ILE E . n +E 1 683 ASN 683 683 683 ASN ASN E . n +E 1 684 GLN 684 684 684 GLN GLN E . n +E 1 685 LYS 685 685 685 LYS LYS E . n +E 1 686 ILE 686 686 686 ILE ILE E . n +E 1 687 ARG 687 687 687 ARG ARG E . n +E 1 688 GLY 688 688 688 GLY GLY E . n +E 1 689 LYS 689 689 689 LYS LYS E . n +E 1 690 ILE 690 690 690 ILE ILE E . n +E 1 691 ASN 691 691 691 ASN ASN E . n +E 1 692 LEU 692 692 692 LEU LEU E . n +E 1 693 GLU 693 693 693 GLU GLU E . n +F 1 1 MET 1 1 ? ? ? F . n +F 1 2 ARG 2 2 ? ? ? F . n +F 1 3 ILE 3 3 3 ILE ILE F . n +F 1 4 LEU 4 4 4 LEU LEU F . n +F 1 5 LYS 5 5 5 LYS LYS F . n +F 1 6 ILE 6 6 6 ILE ILE F . n +F 1 7 TYR 7 7 7 TYR TYR F . n +F 1 8 GLU 8 8 8 GLU GLU F . n +F 1 9 ASN 9 9 9 ASN ASN F . n +F 1 10 LYS 10 10 10 LYS LYS F . n +F 1 11 GLY 11 11 11 GLY GLY F . n +F 1 12 VAL 12 12 12 VAL VAL F . n +F 1 13 TYR 13 13 13 TYR TYR F . n +F 1 14 LYS 14 14 14 LYS LYS F . n +F 1 15 VAL 15 15 15 VAL VAL F . n +F 1 16 VAL 16 16 16 VAL VAL F . n +F 1 17 ILE 17 17 17 ILE ILE F . n +F 1 18 GLY 18 18 18 GLY GLY F . n +F 1 19 GLU 19 19 19 GLU GLU F . n +F 1 20 PRO 20 20 20 PRO PRO F . n +F 1 21 PHE 21 21 21 PHE PHE F . n +F 1 22 PRO 22 22 22 PRO PRO F . n +F 1 23 PRO 23 23 23 PRO PRO F . n +F 1 24 ILE 24 24 24 ILE ILE F . n +F 1 25 GLU 25 25 25 GLU GLU F . n +F 1 26 PHE 26 26 26 PHE PHE F . n +F 1 27 PRO 27 27 27 PRO PRO F . n +F 1 28 LEU 28 28 28 LEU LEU F . n +F 1 29 GLU 29 29 29 GLU GLU F . n +F 1 30 GLN 30 30 30 GLN GLN F . n +F 1 31 LYS 31 31 31 LYS LYS F . n +F 1 32 ILE 32 32 32 ILE ILE F . n +F 1 33 SER 33 33 33 SER SER F . n +F 1 34 SER 34 34 34 SER SER F . n +F 1 35 ASN 35 35 35 ASN ASN F . n +F 1 36 LYS 36 36 36 LYS LYS F . n +F 1 37 SER 37 37 37 SER SER F . n +F 1 38 LEU 38 38 38 LEU LEU F . n +F 1 39 SER 39 39 39 SER SER F . n +F 1 40 GLU 40 40 40 GLU GLU F . n +F 1 41 LEU 41 41 41 LEU LEU F . n +F 1 42 GLY 42 42 42 GLY GLY F . n +F 1 43 LEU 43 43 43 LEU LEU F . n +F 1 44 THR 44 44 44 THR THR F . n +F 1 45 ILE 45 45 45 ILE ILE F . n +F 1 46 VAL 46 46 46 VAL VAL F . n +F 1 47 GLN 47 47 47 GLN GLN F . n +F 1 48 GLN 48 48 48 GLN GLN F . n +F 1 49 GLY 49 49 49 GLY GLY F . n +F 1 50 ASN 50 50 50 ASN ASN F . n +F 1 51 LYS 51 51 51 LYS LYS F . n +F 1 52 VAL 52 52 52 VAL VAL F . n +F 1 53 ILE 53 53 53 ILE ILE F . n +F 1 54 VAL 54 54 54 VAL VAL F . n +F 1 55 GLU 55 55 55 GLU GLU F . n +F 1 56 LYS 56 56 56 LYS LYS F . n +F 1 57 SER 57 57 57 SER SER F . n +F 1 58 LEU 58 58 58 LEU LEU F . n +F 1 59 ASP 59 59 59 ASP ASP F . n +F 1 60 LEU 60 60 60 LEU LEU F . n +F 1 61 LYS 61 61 61 LYS LYS F . n +F 1 62 GLU 62 62 62 GLU GLU F . n +F 1 63 HIS 63 63 63 HIS HIS F . n +F 1 64 ILE 64 64 64 ILE ILE F . n +F 1 65 ILE 65 65 65 ILE ILE F . n +F 1 66 GLY 66 66 66 GLY GLY F . n +F 1 67 LEU 67 67 67 LEU LEU F . n +F 1 68 GLY 68 68 68 GLY GLY F . n +F 1 69 GLU 69 69 69 GLU GLU F . n +F 1 70 LYS 70 70 70 LYS LYS F . n +F 1 71 ALA 71 71 71 ALA ALA F . n +F 1 72 PHE 72 72 72 PHE PHE F . n +F 1 73 GLU 73 73 73 GLU GLU F . n +F 1 74 LEU 74 74 74 LEU LEU F . n +F 1 75 ASP 75 75 75 ASP ASP F . n +F 1 76 ARG 76 76 76 ARG ARG F . n +F 1 77 LYS 77 77 77 LYS LYS F . n +F 1 78 ARG 78 78 78 ARG ARG F . n +F 1 79 LYS 79 79 79 LYS LYS F . n +F 1 80 ARG 80 80 80 ARG ARG F . n +F 1 81 TYR 81 81 81 TYR TYR F . n +F 1 82 VAL 82 82 82 VAL VAL F . n +F 1 83 MET 83 83 83 MET MET F . n +F 1 84 TYR 84 84 84 TYR TYR F . n +F 1 85 ASN 85 85 85 ASN ASN F . n +F 1 86 VAL 86 86 86 VAL VAL F . n +F 1 87 ASP 87 87 87 ASP ASP F . n +F 1 88 ALA 88 88 88 ALA ALA F . n +F 1 89 GLY 89 89 89 GLY GLY F . n +F 1 90 ALA 90 90 90 ALA ALA F . n +F 1 91 TYR 91 91 91 TYR TYR F . n +F 1 92 LYS 92 92 92 LYS LYS F . n +F 1 93 LYS 93 93 93 LYS LYS F . n +F 1 94 TYR 94 94 94 TYR TYR F . n +F 1 95 GLN 95 95 95 GLN GLN F . n +F 1 96 ASP 96 96 96 ASP ASP F . n +F 1 97 PRO 97 97 97 PRO PRO F . n +F 1 98 LEU 98 98 98 LEU LEU F . n +F 1 99 TYR 99 99 99 TYR TYR F . n +F 1 100 VAL 100 100 100 VAL VAL F . n +F 1 101 SER 101 101 101 SER SER F . n +F 1 102 ILE 102 102 102 ILE ILE F . n +F 1 103 PRO 103 103 103 PRO PRO F . n +F 1 104 LEU 104 104 104 LEU LEU F . n +F 1 105 PHE 105 105 105 PHE PHE F . n +F 1 106 ILE 106 106 106 ILE ILE F . n +F 1 107 SER 107 107 107 SER SER F . n +F 1 108 VAL 108 108 108 VAL VAL F . n +F 1 109 LYS 109 109 109 LYS LYS F . n +F 1 110 ASP 110 110 110 ASP ASP F . n +F 1 111 GLY 111 111 111 GLY GLY F . n +F 1 112 VAL 112 112 112 VAL VAL F . n +F 1 113 ALA 113 113 113 ALA ALA F . n +F 1 114 THR 114 114 114 THR THR F . n +F 1 115 GLY 115 115 115 GLY GLY F . n +F 1 116 TYR 116 116 116 TYR TYR F . n +F 1 117 PHE 117 117 117 PHE PHE F . n +F 1 118 PHE 118 118 118 PHE PHE F . n +F 1 119 ASN 119 119 119 ASN ASN F . n +F 1 120 SER 120 120 120 SER SER F . n +F 1 121 ALA 121 121 121 ALA ALA F . n +F 1 122 SER 122 122 122 SER SER F . n +F 1 123 LYS 123 123 123 LYS LYS F . n +F 1 124 VAL 124 124 124 VAL VAL F . n +F 1 125 ILE 125 125 125 ILE ILE F . n +F 1 126 PHE 126 126 126 PHE PHE F . n +F 1 127 ASP 127 127 127 ASP ASP F . n +F 1 128 VAL 128 128 128 VAL VAL F . n +F 1 129 GLY 129 129 129 GLY GLY F . n +F 1 130 LEU 130 130 130 LEU LEU F . n +F 1 131 GLU 131 131 131 GLU GLU F . n +F 1 132 GLU 132 132 132 GLU GLU F . n +F 1 133 TYR 133 133 133 TYR TYR F . n +F 1 134 ASP 134 134 134 ASP ASP F . n +F 1 135 LYS 135 135 135 LYS LYS F . n +F 1 136 VAL 136 136 136 VAL VAL F . n +F 1 137 ILE 137 137 137 ILE ILE F . n +F 1 138 VAL 138 138 138 VAL VAL F . n +F 1 139 THR 139 139 139 THR THR F . n +F 1 140 ILE 140 140 140 ILE ILE F . n +F 1 141 PRO 141 141 141 PRO PRO F . n +F 1 142 GLU 142 142 142 GLU GLU F . n +F 1 143 ASP 143 143 143 ASP ASP F . n +F 1 144 SER 144 144 144 SER SER F . n +F 1 145 VAL 145 145 145 VAL VAL F . n +F 1 146 GLU 146 146 146 GLU GLU F . n +F 1 147 PHE 147 147 147 PHE PHE F . n +F 1 148 TYR 148 148 148 TYR TYR F . n +F 1 149 VAL 149 149 149 VAL VAL F . n +F 1 150 ILE 150 150 150 ILE ILE F . n +F 1 151 GLU 151 151 151 GLU GLU F . n +F 1 152 GLY 152 152 152 GLY GLY F . n +F 1 153 PRO 153 153 153 PRO PRO F . n +F 1 154 ARG 154 154 154 ARG ARG F . n +F 1 155 ILE 155 155 155 ILE ILE F . n +F 1 156 GLU 156 156 156 GLU GLU F . n +F 1 157 ASP 157 157 157 ASP ASP F . n +F 1 158 VAL 158 158 158 VAL VAL F . n +F 1 159 LEU 159 159 159 LEU LEU F . n +F 1 160 GLU 160 160 160 GLU GLU F . n +F 1 161 LYS 161 161 161 LYS LYS F . n +F 1 162 TYR 162 162 162 TYR TYR F . n +F 1 163 THR 163 163 163 THR THR F . n +F 1 164 GLU 164 164 164 GLU GLU F . n +F 1 165 LEU 165 165 165 LEU LEU F . n +F 1 166 THR 166 166 166 THR THR F . n +F 1 167 GLY 167 167 167 GLY GLY F . n +F 1 168 LYS 168 168 168 LYS LYS F . n +F 1 169 PRO 169 169 169 PRO PRO F . n +F 1 170 PHE 170 170 170 PHE PHE F . n +F 1 171 LEU 171 171 171 LEU LEU F . n +F 1 172 PRO 172 172 172 PRO PRO F . n +F 1 173 PRO 173 173 173 PRO PRO F . n +F 1 174 MET 174 174 174 MET MET F . n +F 1 175 TRP 175 175 175 TRP TRP F . n +F 1 176 ALA 176 176 176 ALA ALA F . n +F 1 177 PHE 177 177 177 PHE PHE F . n +F 1 178 GLY 178 178 178 GLY GLY F . n +F 1 179 TYR 179 179 179 TYR TYR F . n +F 1 180 MET 180 180 180 MET MET F . n +F 1 181 ILE 181 181 181 ILE ILE F . n +F 1 182 SER 182 182 182 SER SER F . n +F 1 183 ARG 183 183 183 ARG ARG F . n +F 1 184 TYR 184 184 184 TYR TYR F . n +F 1 185 SER 185 185 185 SER SER F . n +F 1 186 TYR 186 186 186 TYR TYR F . n +F 1 187 TYR 187 187 187 TYR TYR F . n +F 1 188 PRO 188 188 188 PRO PRO F . n +F 1 189 GLN 189 189 189 GLN GLN F . n +F 1 190 ASP 190 190 190 ASP ASP F . n +F 1 191 LYS 191 191 191 LYS LYS F . n +F 1 192 VAL 192 192 192 VAL VAL F . n +F 1 193 VAL 193 193 193 VAL VAL F . n +F 1 194 GLU 194 194 194 GLU GLU F . n +F 1 195 LEU 195 195 195 LEU LEU F . n +F 1 196 VAL 196 196 196 VAL VAL F . n +F 1 197 ASP 197 197 197 ASP ASP F . n +F 1 198 ILE 198 198 198 ILE ILE F . n +F 1 199 MET 199 199 199 MET MET F . n +F 1 200 GLN 200 200 200 GLN GLN F . n +F 1 201 LYS 201 201 201 LYS LYS F . n +F 1 202 GLU 202 202 202 GLU GLU F . n +F 1 203 GLY 203 203 203 GLY GLY F . n +F 1 204 PHE 204 204 204 PHE PHE F . n +F 1 205 ARG 205 205 205 ARG ARG F . n +F 1 206 VAL 206 206 206 VAL VAL F . n +F 1 207 ALA 207 207 207 ALA ALA F . n +F 1 208 GLY 208 208 208 GLY GLY F . n +F 1 209 VAL 209 209 209 VAL VAL F . n +F 1 210 PHE 210 210 210 PHE PHE F . n +F 1 211 LEU 211 211 211 LEU LEU F . n +F 1 212 ASP 212 212 212 ASP ASP F . n +F 1 213 ILE 213 213 213 ILE ILE F . n +F 1 214 HIS 214 214 214 HIS HIS F . n +F 1 215 TYR 215 215 215 TYR TYR F . n +F 1 216 MET 216 216 216 MET MET F . n +F 1 217 ASP 217 217 217 ASP ASP F . n +F 1 218 SER 218 218 218 SER SER F . n +F 1 219 TYR 219 219 219 TYR TYR F . n +F 1 220 LYS 220 220 220 LYS LYS F . n +F 1 221 LEU 221 221 221 LEU LEU F . n +F 1 222 PHE 222 222 222 PHE PHE F . n +F 1 223 THR 223 223 223 THR THR F . n +F 1 224 TRP 224 224 224 TRP TRP F . n +F 1 225 HIS 225 225 225 HIS HIS F . n +F 1 226 PRO 226 226 226 PRO PRO F . n +F 1 227 TYR 227 227 227 TYR TYR F . n +F 1 228 ARG 228 228 228 ARG ARG F . n +F 1 229 PHE 229 229 229 PHE PHE F . n +F 1 230 PRO 230 230 230 PRO PRO F . n +F 1 231 GLU 231 231 231 GLU GLU F . n +F 1 232 PRO 232 232 232 PRO PRO F . n +F 1 233 LYS 233 233 233 LYS LYS F . n +F 1 234 LYS 234 234 234 LYS LYS F . n +F 1 235 LEU 235 235 235 LEU LEU F . n +F 1 236 ILE 236 236 236 ILE ILE F . n +F 1 237 ASP 237 237 237 ASP ASP F . n +F 1 238 GLU 238 238 238 GLU GLU F . n +F 1 239 LEU 239 239 239 LEU LEU F . n +F 1 240 HIS 240 240 240 HIS HIS F . n +F 1 241 LYS 241 241 241 LYS LYS F . n +F 1 242 ARG 242 242 242 ARG ARG F . n +F 1 243 ASN 243 243 243 ASN ASN F . n +F 1 244 VAL 244 244 244 VAL VAL F . n +F 1 245 LYS 245 245 245 LYS LYS F . n +F 1 246 LEU 246 246 246 LEU LEU F . n +F 1 247 ILE 247 247 247 ILE ILE F . n +F 1 248 THR 248 248 248 THR THR F . n +F 1 249 ILE 249 249 249 ILE ILE F . n +F 1 250 VAL 250 250 250 VAL VAL F . n +F 1 251 ASP 251 251 251 ASP ASP F . n +F 1 252 HIS 252 252 252 HIS HIS F . n +F 1 253 GLY 253 253 253 GLY GLY F . n +F 1 254 ILE 254 254 254 ILE ILE F . n +F 1 255 ARG 255 255 255 ARG ARG F . n +F 1 256 VAL 256 256 256 VAL VAL F . n +F 1 257 ASP 257 257 257 ASP ASP F . n +F 1 258 GLN 258 258 258 GLN GLN F . n +F 1 259 ASN 259 259 259 ASN ASN F . n +F 1 260 TYR 260 260 260 TYR TYR F . n +F 1 261 SER 261 261 261 SER SER F . n +F 1 262 PRO 262 262 262 PRO PRO F . n +F 1 263 PHE 263 263 263 PHE PHE F . n +F 1 264 LEU 264 264 264 LEU LEU F . n +F 1 265 SER 265 265 265 SER SER F . n +F 1 266 GLY 266 266 266 GLY GLY F . n +F 1 267 MET 267 267 267 MET MET F . n +F 1 268 GLY 268 268 268 GLY GLY F . n +F 1 269 LYS 269 269 269 LYS LYS F . n +F 1 270 PHE 270 270 270 PHE PHE F . n +F 1 271 CYS 271 271 271 CYS CYS F . n +F 1 272 GLU 272 272 272 GLU GLU F . n +F 1 273 ILE 273 273 273 ILE ILE F . n +F 1 274 GLU 274 274 274 GLU GLU F . n +F 1 275 SER 275 275 275 SER SER F . n +F 1 276 GLY 276 276 276 GLY GLY F . n +F 1 277 GLU 277 277 277 GLU GLU F . n +F 1 278 LEU 278 278 278 LEU LEU F . n +F 1 279 PHE 279 279 279 PHE PHE F . n +F 1 280 VAL 280 280 280 VAL VAL F . n +F 1 281 GLY 281 281 281 GLY GLY F . n +F 1 282 LYS 282 282 282 LYS LYS F . n +F 1 283 MET 283 283 283 MET MET F . n +F 1 284 TRP 284 284 284 TRP TRP F . n +F 1 285 PRO 285 285 285 PRO PRO F . n +F 1 286 GLY 286 286 286 GLY GLY F . n +F 1 287 THR 287 287 287 THR THR F . n +F 1 288 THR 288 288 288 THR THR F . n +F 1 289 VAL 289 289 289 VAL VAL F . n +F 1 290 TYR 290 290 290 TYR TYR F . n +F 1 291 PRO 291 291 291 PRO PRO F . n +F 1 292 ASP 292 292 292 ASP ASP F . n +F 1 293 PHE 293 293 293 PHE PHE F . n +F 1 294 PHE 294 294 294 PHE PHE F . n +F 1 295 ARG 295 295 295 ARG ARG F . n +F 1 296 GLU 296 296 296 GLU GLU F . n +F 1 297 ASP 297 297 297 ASP ASP F . n +F 1 298 THR 298 298 298 THR THR F . n +F 1 299 ARG 299 299 299 ARG ARG F . n +F 1 300 GLU 300 300 300 GLU GLU F . n +F 1 301 TRP 301 301 301 TRP TRP F . n +F 1 302 TRP 302 302 302 TRP TRP F . n +F 1 303 ALA 303 303 303 ALA ALA F . n +F 1 304 GLY 304 304 304 GLY GLY F . n +F 1 305 LEU 305 305 305 LEU LEU F . n +F 1 306 ILE 306 306 306 ILE ILE F . n +F 1 307 SER 307 307 307 SER SER F . n +F 1 308 GLU 308 308 308 GLU GLU F . n +F 1 309 TRP 309 309 309 TRP TRP F . n +F 1 310 LEU 310 310 310 LEU LEU F . n +F 1 311 SER 311 311 311 SER SER F . n +F 1 312 GLN 312 312 312 GLN GLN F . n +F 1 313 GLY 313 313 313 GLY GLY F . n +F 1 314 VAL 314 314 314 VAL VAL F . n +F 1 315 ASP 315 315 315 ASP ASP F . n +F 1 316 GLY 316 316 316 GLY GLY F . n +F 1 317 ILE 317 317 317 ILE ILE F . n +F 1 318 TRP 318 318 318 TRP TRP F . n +F 1 319 LEU 319 319 319 LEU LEU F . n +F 1 320 ASP 320 320 320 ASP ASP F . n +F 1 321 MET 321 321 321 MET MET F . n +F 1 322 ASN 322 322 322 ASN ASN F . n +F 1 323 GLU 323 323 323 GLU GLU F . n +F 1 324 PRO 324 324 324 PRO PRO F . n +F 1 325 THR 325 325 325 THR THR F . n +F 1 326 ASP 326 326 326 ASP ASP F . n +F 1 327 PHE 327 327 327 PHE PHE F . n +F 1 328 SER 328 328 328 SER SER F . n +F 1 329 ARG 329 329 329 ARG ARG F . n +F 1 330 ALA 330 330 330 ALA ALA F . n +F 1 331 ILE 331 331 331 ILE ILE F . n +F 1 332 GLU 332 332 332 GLU GLU F . n +F 1 333 ILE 333 333 333 ILE ILE F . n +F 1 334 ARG 334 334 334 ARG ARG F . n +F 1 335 ASP 335 335 335 ASP ASP F . n +F 1 336 VAL 336 336 336 VAL VAL F . n +F 1 337 LEU 337 337 337 LEU LEU F . n +F 1 338 SER 338 338 338 SER SER F . n +F 1 339 SER 339 339 339 SER SER F . n +F 1 340 LEU 340 340 340 LEU LEU F . n +F 1 341 PRO 341 341 341 PRO PRO F . n +F 1 342 VAL 342 342 342 VAL VAL F . n +F 1 343 GLN 343 343 343 GLN GLN F . n +F 1 344 PHE 344 344 344 PHE PHE F . n +F 1 345 ARG 345 345 345 ARG ARG F . n +F 1 346 ASP 346 346 346 ASP ASP F . n +F 1 347 ASP 347 347 347 ASP ASP F . n +F 1 348 ARG 348 348 348 ARG ARG F . n +F 1 349 LEU 349 349 349 LEU LEU F . n +F 1 350 VAL 350 350 350 VAL VAL F . n +F 1 351 THR 351 351 351 THR THR F . n +F 1 352 THR 352 352 352 THR THR F . n +F 1 353 PHE 353 353 353 PHE PHE F . n +F 1 354 PRO 354 354 354 PRO PRO F . n +F 1 355 ASP 355 355 355 ASP ASP F . n +F 1 356 ASN 356 356 356 ASN ASN F . n +F 1 357 VAL 357 357 357 VAL VAL F . n +F 1 358 VAL 358 358 358 VAL VAL F . n +F 1 359 HIS 359 359 359 HIS HIS F . n +F 1 360 TYR 360 360 360 TYR TYR F . n +F 1 361 LEU 361 361 361 LEU LEU F . n +F 1 362 ARG 362 362 362 ARG ARG F . n +F 1 363 GLY 363 363 363 GLY GLY F . n +F 1 364 LYS 364 364 364 LYS LYS F . n +F 1 365 ARG 365 365 365 ARG ARG F . n +F 1 366 VAL 366 366 366 VAL VAL F . n +F 1 367 LYS 367 367 367 LYS LYS F . n +F 1 368 HIS 368 368 368 HIS HIS F . n +F 1 369 GLU 369 369 369 GLU GLU F . n +F 1 370 LYS 370 370 370 LYS LYS F . n +F 1 371 VAL 371 371 371 VAL VAL F . n +F 1 372 ARG 372 372 372 ARG ARG F . n +F 1 373 ASN 373 373 373 ASN ASN F . n +F 1 374 ALA 374 374 374 ALA ALA F . n +F 1 375 TYR 375 375 375 TYR TYR F . n +F 1 376 PRO 376 376 376 PRO PRO F . n +F 1 377 LEU 377 377 377 LEU LEU F . n +F 1 378 TYR 378 378 378 TYR TYR F . n +F 1 379 GLU 379 379 379 GLU GLU F . n +F 1 380 ALA 380 380 380 ALA ALA F . n +F 1 381 MET 381 381 381 MET MET F . n +F 1 382 ALA 382 382 382 ALA ALA F . n +F 1 383 THR 383 383 383 THR THR F . n +F 1 384 PHE 384 384 384 PHE PHE F . n +F 1 385 LYS 385 385 385 LYS LYS F . n +F 1 386 GLY 386 386 386 GLY GLY F . n +F 1 387 PHE 387 387 387 PHE PHE F . n +F 1 388 ARG 388 388 388 ARG ARG F . n +F 1 389 THR 389 389 389 THR THR F . n +F 1 390 SER 390 390 390 SER SER F . n +F 1 391 HIS 391 391 391 HIS HIS F . n +F 1 392 ARG 392 392 392 ARG ARG F . n +F 1 393 ASN 393 393 393 ASN ASN F . n +F 1 394 GLU 394 394 394 GLU GLU F . n +F 1 395 ILE 395 395 395 ILE ILE F . n +F 1 396 PHE 396 396 396 PHE PHE F . n +F 1 397 ILE 397 397 397 ILE ILE F . n +F 1 398 LEU 398 398 398 LEU LEU F . n +F 1 399 SER 399 399 399 SER SER F . n +F 1 400 ARG 400 400 400 ARG ARG F . n +F 1 401 ALA 401 401 401 ALA ALA F . n +F 1 402 GLY 402 402 402 GLY GLY F . n +F 1 403 TYR 403 403 403 TYR TYR F . n +F 1 404 ALA 404 404 404 ALA ALA F . n +F 1 405 GLY 405 405 405 GLY GLY F . n +F 1 406 ILE 406 406 406 ILE ILE F . n +F 1 407 GLN 407 407 407 GLN GLN F . n +F 1 408 ARG 408 408 408 ARG ARG F . n +F 1 409 TYR 409 409 409 TYR TYR F . n +F 1 410 ALA 410 410 410 ALA ALA F . n +F 1 411 PHE 411 411 411 PHE PHE F . n +F 1 412 ILE 412 412 412 ILE ILE F . n +F 1 413 TRP 413 413 413 TRP TRP F . n +F 1 414 THR 414 414 414 THR THR F . n +F 1 415 GLY 415 415 415 GLY GLY F . n +F 1 416 ASP 416 416 416 ASP ASP F . n +F 1 417 ASN 417 417 417 ASN ASN F . n +F 1 418 THR 418 418 418 THR THR F . n +F 1 419 PRO 419 419 419 PRO PRO F . n +F 1 420 SER 420 420 420 SER SER F . n +F 1 421 TRP 421 421 421 TRP TRP F . n +F 1 422 ASP 422 422 422 ASP ASP F . n +F 1 423 ASP 423 423 423 ASP ASP F . n +F 1 424 LEU 424 424 424 LEU LEU F . n +F 1 425 LYS 425 425 425 LYS LYS F . n +F 1 426 LEU 426 426 426 LEU LEU F . n +F 1 427 GLN 427 427 427 GLN GLN F . n +F 1 428 LEU 428 428 428 LEU LEU F . n +F 1 429 GLN 429 429 429 GLN GLN F . n +F 1 430 LEU 430 430 430 LEU LEU F . n +F 1 431 VAL 431 431 431 VAL VAL F . n +F 1 432 LEU 432 432 432 LEU LEU F . n +F 1 433 GLY 433 433 433 GLY GLY F . n +F 1 434 LEU 434 434 434 LEU LEU F . n +F 1 435 SER 435 435 435 SER SER F . n +F 1 436 ILE 436 436 436 ILE ILE F . n +F 1 437 SER 437 437 437 SER SER F . n +F 1 438 GLY 438 438 438 GLY GLY F . n +F 1 439 VAL 439 439 439 VAL VAL F . n +F 1 440 PRO 440 440 440 PRO PRO F . n +F 1 441 PHE 441 441 441 PHE PHE F . n +F 1 442 VAL 442 442 442 VAL VAL F . n +F 1 443 GLY 443 443 443 GLY GLY F . n +F 1 444 CYS 444 444 444 CYS CYS F . n +F 1 445 ASP 445 445 445 ASP ASP F . n +F 1 446 ILE 446 446 446 ILE ILE F . n +F 1 447 GLY 447 447 447 GLY GLY F . n +F 1 448 GLY 448 448 448 GLY GLY F . n +F 1 449 PHE 449 449 449 PHE PHE F . n +F 1 450 GLN 450 450 450 GLN GLN F . n +F 1 451 GLY 451 451 451 GLY GLY F . n +F 1 452 ARG 452 452 452 ARG ARG F . n +F 1 453 ASN 453 453 453 ASN ASN F . n +F 1 454 PHE 454 454 454 PHE PHE F . n +F 1 455 ALA 455 455 455 ALA ALA F . n +F 1 456 GLU 456 456 456 GLU GLU F . n +F 1 457 ILE 457 457 457 ILE ILE F . n +F 1 458 ASP 458 458 458 ASP ASP F . n +F 1 459 ASN 459 459 459 ASN ASN F . n +F 1 460 SER 460 460 460 SER SER F . n +F 1 461 MET 461 461 461 MET MET F . n +F 1 462 ASP 462 462 462 ASP ASP F . n +F 1 463 LEU 463 463 463 LEU LEU F . n +F 1 464 LEU 464 464 464 LEU LEU F . n +F 1 465 VAL 465 465 465 VAL VAL F . n +F 1 466 LYS 466 466 466 LYS LYS F . n +F 1 467 TYR 467 467 467 TYR TYR F . n +F 1 468 TYR 468 468 468 TYR TYR F . n +F 1 469 ALA 469 469 469 ALA ALA F . n +F 1 470 LEU 470 470 470 LEU LEU F . n +F 1 471 ALA 471 471 471 ALA ALA F . n +F 1 472 LEU 472 472 472 LEU LEU F . n +F 1 473 PHE 473 473 473 PHE PHE F . n +F 1 474 PHE 474 474 474 PHE PHE F . n +F 1 475 PRO 475 475 475 PRO PRO F . n +F 1 476 PHE 476 476 476 PHE PHE F . n +F 1 477 TYR 477 477 477 TYR TYR F . n +F 1 478 ARG 478 478 478 ARG ARG F . n +F 1 479 SER 479 479 479 SER SER F . n +F 1 480 HIS 480 480 480 HIS HIS F . n +F 1 481 LYS 481 481 481 LYS LYS F . n +F 1 482 ALA 482 482 482 ALA ALA F . n +F 1 483 THR 483 483 483 THR THR F . n +F 1 484 ASP 484 484 484 ASP ASP F . n +F 1 485 GLY 485 485 485 GLY GLY F . n +F 1 486 ILE 486 486 486 ILE ILE F . n +F 1 487 ASP 487 487 487 ASP ASP F . n +F 1 488 THR 488 488 488 THR THR F . n +F 1 489 GLU 489 489 489 GLU GLU F . n +F 1 490 PRO 490 490 490 PRO PRO F . n +F 1 491 VAL 491 491 491 VAL VAL F . n +F 1 492 PHE 492 492 492 PHE PHE F . n +F 1 493 LEU 493 493 493 LEU LEU F . n +F 1 494 PRO 494 494 494 PRO PRO F . n +F 1 495 ASP 495 495 495 ASP ASP F . n +F 1 496 TYR 496 496 496 TYR TYR F . n +F 1 497 TYR 497 497 497 TYR TYR F . n +F 1 498 LYS 498 498 498 LYS LYS F . n +F 1 499 GLU 499 499 499 GLU GLU F . n +F 1 500 LYS 500 500 500 LYS LYS F . n +F 1 501 VAL 501 501 501 VAL VAL F . n +F 1 502 LYS 502 502 502 LYS LYS F . n +F 1 503 GLU 503 503 503 GLU GLU F . n +F 1 504 ILE 504 504 504 ILE ILE F . n +F 1 505 VAL 505 505 505 VAL VAL F . n +F 1 506 GLU 506 506 506 GLU GLU F . n +F 1 507 LEU 507 507 507 LEU LEU F . n +F 1 508 ARG 508 508 508 ARG ARG F . n +F 1 509 TYR 509 509 509 TYR TYR F . n +F 1 510 LYS 510 510 510 LYS LYS F . n +F 1 511 PHE 511 511 511 PHE PHE F . n +F 1 512 LEU 512 512 512 LEU LEU F . n +F 1 513 PRO 513 513 513 PRO PRO F . n +F 1 514 TYR 514 514 514 TYR TYR F . n +F 1 515 ILE 515 515 515 ILE ILE F . n +F 1 516 TYR 516 516 516 TYR TYR F . n +F 1 517 SER 517 517 517 SER SER F . n +F 1 518 LEU 518 518 518 LEU LEU F . n +F 1 519 ALA 519 519 519 ALA ALA F . n +F 1 520 LEU 520 520 520 LEU LEU F . n +F 1 521 GLU 521 521 521 GLU GLU F . n +F 1 522 ALA 522 522 522 ALA ALA F . n +F 1 523 SER 523 523 523 SER SER F . n +F 1 524 GLU 524 524 524 GLU GLU F . n +F 1 525 LYS 525 525 525 LYS LYS F . n +F 1 526 GLY 526 526 526 GLY GLY F . n +F 1 527 HIS 527 527 527 HIS HIS F . n +F 1 528 PRO 528 528 528 PRO PRO F . n +F 1 529 VAL 529 529 529 VAL VAL F . n +F 1 530 ILE 530 530 530 ILE ILE F . n +F 1 531 ARG 531 531 531 ARG ARG F . n +F 1 532 PRO 532 532 532 PRO PRO F . n +F 1 533 LEU 533 533 533 LEU LEU F . n +F 1 534 PHE 534 534 534 PHE PHE F . n +F 1 535 TYR 535 535 535 TYR TYR F . n +F 1 536 GLU 536 536 536 GLU GLU F . n +F 1 537 PHE 537 537 537 PHE PHE F . n +F 1 538 GLN 538 538 538 GLN GLN F . n +F 1 539 ASP 539 539 539 ASP ASP F . n +F 1 540 ASP 540 540 540 ASP ASP F . n +F 1 541 ASP 541 541 541 ASP ASP F . n +F 1 542 ASP 542 542 542 ASP ASP F . n +F 1 543 MET 543 543 543 MET MET F . n +F 1 544 TYR 544 544 544 TYR TYR F . n +F 1 545 ARG 545 545 545 ARG ARG F . n +F 1 546 ILE 546 546 546 ILE ILE F . n +F 1 547 GLU 547 547 547 GLU GLU F . n +F 1 548 ASP 548 548 548 ASP ASP F . n +F 1 549 GLU 549 549 549 GLU GLU F . n +F 1 550 TYR 550 550 550 TYR TYR F . n +F 1 551 MET 551 551 551 MET MET F . n +F 1 552 VAL 552 552 552 VAL VAL F . n +F 1 553 GLY 553 553 553 GLY GLY F . n +F 1 554 LYS 554 554 554 LYS LYS F . n +F 1 555 TYR 555 555 555 TYR TYR F . n +F 1 556 LEU 556 556 556 LEU LEU F . n +F 1 557 LEU 557 557 557 LEU LEU F . n +F 1 558 TYR 558 558 558 TYR TYR F . n +F 1 559 ALA 559 559 559 ALA ALA F . n +F 1 560 PRO 560 560 560 PRO PRO F . n +F 1 561 ILE 561 561 561 ILE ILE F . n +F 1 562 VAL 562 562 562 VAL VAL F . n +F 1 563 SER 563 563 563 SER SER F . n +F 1 564 LYS 564 564 564 LYS LYS F . n +F 1 565 GLU 565 565 565 GLU GLU F . n +F 1 566 GLU 566 566 566 GLU GLU F . n +F 1 567 SER 567 567 567 SER SER F . n +F 1 568 ARG 568 568 568 ARG ARG F . n +F 1 569 LEU 569 569 569 LEU LEU F . n +F 1 570 VAL 570 570 570 VAL VAL F . n +F 1 571 THR 571 571 571 THR THR F . n +F 1 572 LEU 572 572 572 LEU LEU F . n +F 1 573 PRO 573 573 573 PRO PRO F . n +F 1 574 ARG 574 574 574 ARG ARG F . n +F 1 575 GLY 575 575 575 GLY GLY F . n +F 1 576 LYS 576 576 576 LYS LYS F . n +F 1 577 TRP 577 577 577 TRP TRP F . n +F 1 578 TYR 578 578 578 TYR TYR F . n +F 1 579 ASN 579 579 579 ASN ASN F . n +F 1 580 TYR 580 580 580 TYR TYR F . n +F 1 581 TRP 581 581 581 TRP TRP F . n +F 1 582 ASN 582 582 582 ASN ASN F . n +F 1 583 GLY 583 583 583 GLY GLY F . n +F 1 584 GLU 584 584 584 GLU GLU F . n +F 1 585 ILE 585 585 585 ILE ILE F . n +F 1 586 ILE 586 586 586 ILE ILE F . n +F 1 587 ASN 587 587 587 ASN ASN F . n +F 1 588 GLY 588 588 588 GLY GLY F . n +F 1 589 LYS 589 589 589 LYS LYS F . n +F 1 590 SER 590 590 590 SER SER F . n +F 1 591 VAL 591 591 591 VAL VAL F . n +F 1 592 VAL 592 592 592 VAL VAL F . n +F 1 593 LYS 593 593 593 LYS LYS F . n +F 1 594 SER 594 594 594 SER SER F . n +F 1 595 THR 595 595 595 THR THR F . n +F 1 596 HIS 596 596 596 HIS HIS F . n +F 1 597 GLU 597 597 597 GLU GLU F . n +F 1 598 LEU 598 598 598 LEU LEU F . n +F 1 599 PRO 599 599 599 PRO PRO F . n +F 1 600 ILE 600 600 600 ILE ILE F . n +F 1 601 TYR 601 601 601 TYR TYR F . n +F 1 602 LEU 602 602 602 LEU LEU F . n +F 1 603 ARG 603 603 603 ARG ARG F . n +F 1 604 GLU 604 604 604 GLU GLU F . n +F 1 605 GLY 605 605 605 GLY GLY F . n +F 1 606 SER 606 606 606 SER SER F . n +F 1 607 ILE 607 607 607 ILE ILE F . n +F 1 608 ILE 608 608 608 ILE ILE F . n +F 1 609 PRO 609 609 609 PRO PRO F . n +F 1 610 LEU 610 610 610 LEU LEU F . n +F 1 611 GLU 611 611 611 GLU GLU F . n +F 1 612 GLY 612 612 612 GLY GLY F . n +F 1 613 ASP 613 613 613 ASP ASP F . n +F 1 614 GLU 614 614 614 GLU GLU F . n +F 1 615 LEU 615 615 615 LEU LEU F . n +F 1 616 ILE 616 616 616 ILE ILE F . n +F 1 617 VAL 617 617 617 VAL VAL F . n +F 1 618 TYR 618 618 618 TYR TYR F . n +F 1 619 GLY 619 619 619 GLY GLY F . n +F 1 620 GLU 620 620 620 GLU GLU F . n +F 1 621 THR 621 621 621 THR THR F . n +F 1 622 SER 622 622 622 SER SER F . n +F 1 623 PHE 623 623 623 PHE PHE F . n +F 1 624 LYS 624 624 624 LYS LYS F . n +F 1 625 ARG 625 625 625 ARG ARG F . n +F 1 626 TYR 626 626 626 TYR TYR F . n +F 1 627 ASP 627 627 627 ASP ASP F . n +F 1 628 ASN 628 628 628 ASN ASN F . n +F 1 629 ALA 629 629 629 ALA ALA F . n +F 1 630 GLU 630 630 630 GLU GLU F . n +F 1 631 ILE 631 631 631 ILE ILE F . n +F 1 632 THR 632 632 632 THR THR F . n +F 1 633 SER 633 633 633 SER SER F . n +F 1 634 SER 634 634 634 SER SER F . n +F 1 635 SER 635 635 635 SER SER F . n +F 1 636 ASN 636 636 636 ASN ASN F . n +F 1 637 GLU 637 637 637 GLU GLU F . n +F 1 638 ILE 638 638 638 ILE ILE F . n +F 1 639 LYS 639 639 639 LYS LYS F . n +F 1 640 PHE 640 640 640 PHE PHE F . n +F 1 641 SER 641 641 641 SER SER F . n +F 1 642 ARG 642 642 642 ARG ARG F . n +F 1 643 GLU 643 643 643 GLU GLU F . n +F 1 644 ILE 644 644 644 ILE ILE F . n +F 1 645 TYR 645 645 645 TYR TYR F . n +F 1 646 VAL 646 646 646 VAL VAL F . n +F 1 647 SER 647 647 647 SER SER F . n +F 1 648 LYS 648 648 648 LYS LYS F . n +F 1 649 LEU 649 649 649 LEU LEU F . n +F 1 650 THR 650 650 650 THR THR F . n +F 1 651 ILE 651 651 651 ILE ILE F . n +F 1 652 THR 652 652 652 THR THR F . n +F 1 653 SER 653 653 653 SER SER F . n +F 1 654 GLU 654 654 654 GLU GLU F . n +F 1 655 LYS 655 655 655 LYS LYS F . n +F 1 656 PRO 656 656 656 PRO PRO F . n +F 1 657 VAL 657 657 657 VAL VAL F . n +F 1 658 SER 658 658 658 SER SER F . n +F 1 659 LYS 659 659 659 LYS LYS F . n +F 1 660 ILE 660 660 660 ILE ILE F . n +F 1 661 ILE 661 661 661 ILE ILE F . n +F 1 662 VAL 662 662 662 VAL VAL F . n +F 1 663 ASP 663 663 663 ASP ASP F . n +F 1 664 ASP 664 664 664 ASP ASP F . n +F 1 665 SER 665 665 665 SER SER F . n +F 1 666 LYS 666 666 666 LYS LYS F . n +F 1 667 GLU 667 667 667 GLU GLU F . n +F 1 668 ILE 668 668 668 ILE ILE F . n +F 1 669 GLN 669 669 669 GLN GLN F . n +F 1 670 VAL 670 670 670 VAL VAL F . n +F 1 671 GLU 671 671 671 GLU GLU F . n +F 1 672 LYS 672 672 672 LYS LYS F . n +F 1 673 THR 673 673 673 THR THR F . n +F 1 674 MET 674 674 674 MET MET F . n +F 1 675 GLN 675 675 675 GLN GLN F . n +F 1 676 ASN 676 676 676 ASN ASN F . n +F 1 677 THR 677 677 677 THR THR F . n +F 1 678 TYR 678 678 678 TYR TYR F . n +F 1 679 VAL 679 679 679 VAL VAL F . n +F 1 680 ALA 680 680 680 ALA ALA F . n +F 1 681 LYS 681 681 681 LYS LYS F . n +F 1 682 ILE 682 682 682 ILE ILE F . n +F 1 683 ASN 683 683 683 ASN ASN F . n +F 1 684 GLN 684 684 684 GLN GLN F . n +F 1 685 LYS 685 685 685 LYS LYS F . n +F 1 686 ILE 686 686 686 ILE ILE F . n +F 1 687 ARG 687 687 687 ARG ARG F . n +F 1 688 GLY 688 688 688 GLY GLY F . n +F 1 689 LYS 689 689 689 LYS LYS F . n +F 1 690 ILE 690 690 690 ILE ILE F . n +F 1 691 ASN 691 691 691 ASN ASN F . n +F 1 692 LEU 692 692 692 LEU LEU F . n +F 1 693 GLU 693 693 693 GLU GLU F . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +G 2 BOG 1 2000 2000 BOG BOG A . +H 2 BOG 1 2000 2000 BOG BOG B . +I 2 BOG 1 2000 2000 BOG BOG C . +J 2 BOG 1 2000 2000 BOG BOG D . +K 2 BOG 1 2000 2000 BOG BOG E . +L 2 BOG 1 2000 2000 BOG BOG F . +M 3 HOH 1 2001 1 HOH HOH A . +M 3 HOH 2 2002 2 HOH HOH A . +M 3 HOH 3 2003 3 HOH HOH A . +M 3 HOH 4 2004 4 HOH HOH A . +M 3 HOH 5 2005 5 HOH HOH A . +M 3 HOH 6 2006 6 HOH HOH A . +M 3 HOH 7 2007 7 HOH HOH A . +M 3 HOH 8 2008 8 HOH HOH A . +M 3 HOH 9 2009 9 HOH HOH A . +M 3 HOH 10 2010 10 HOH HOH A . +M 3 HOH 11 2011 11 HOH HOH A . +M 3 HOH 12 2012 12 HOH HOH A . +M 3 HOH 13 2013 13 HOH HOH A . +M 3 HOH 14 2014 14 HOH HOH A . +M 3 HOH 15 2015 15 HOH HOH A . +M 3 HOH 16 2016 16 HOH HOH A . +M 3 HOH 17 2017 17 HOH HOH A . +M 3 HOH 18 2018 18 HOH HOH A . +M 3 HOH 19 2019 19 HOH HOH A . +M 3 HOH 20 2020 20 HOH HOH A . +M 3 HOH 21 2021 21 HOH HOH A . +M 3 HOH 22 2022 22 HOH HOH A . +M 3 HOH 23 2023 23 HOH HOH A . +M 3 HOH 24 2024 24 HOH HOH A . +M 3 HOH 25 2025 25 HOH HOH A . +M 3 HOH 26 2026 27 HOH HOH A . +M 3 HOH 27 2027 28 HOH HOH A . +M 3 HOH 28 2028 29 HOH HOH A . +M 3 HOH 29 2029 165 HOH HOH A . +M 3 HOH 30 2030 178 HOH HOH A . +M 3 HOH 31 2031 179 HOH HOH A . +M 3 HOH 32 2032 180 HOH HOH A . +M 3 HOH 33 2033 181 HOH HOH A . +M 3 HOH 34 2034 182 HOH HOH A . +M 3 HOH 35 2035 183 HOH HOH A . +M 3 HOH 36 2036 184 HOH HOH A . +M 3 HOH 37 2037 186 HOH HOH A . +M 3 HOH 38 2038 187 HOH HOH A . +M 3 HOH 39 2039 188 HOH HOH A . +M 3 HOH 40 2040 189 HOH HOH A . +M 3 HOH 41 2041 190 HOH HOH A . +M 3 HOH 42 2042 191 HOH HOH A . +M 3 HOH 43 2043 192 HOH HOH A . +M 3 HOH 44 2044 193 HOH HOH A . +M 3 HOH 45 2045 194 HOH HOH A . +M 3 HOH 46 2046 322 HOH HOH A . +M 3 HOH 47 2047 323 HOH HOH A . +M 3 HOH 48 2048 324 HOH HOH A . +M 3 HOH 49 2049 340 HOH HOH A . +M 3 HOH 50 2050 350 HOH HOH A . +M 3 HOH 51 2051 355 HOH HOH A . +M 3 HOH 52 2052 364 HOH HOH A . +M 3 HOH 53 2053 389 HOH HOH A . +M 3 HOH 54 2054 393 HOH HOH A . +M 3 HOH 55 2055 403 HOH HOH A . +M 3 HOH 56 2056 409 HOH HOH A . +M 3 HOH 57 2057 417 HOH HOH A . +M 3 HOH 58 2058 424 HOH HOH A . +M 3 HOH 59 2059 425 HOH HOH A . +M 3 HOH 60 2060 446 HOH HOH A . +M 3 HOH 61 2061 447 HOH HOH A . +M 3 HOH 62 2062 450 HOH HOH A . +M 3 HOH 63 2063 453 HOH HOH A . +M 3 HOH 64 2064 465 HOH HOH A . +M 3 HOH 65 2065 471 HOH HOH A . +M 3 HOH 66 2066 488 HOH HOH A . +M 3 HOH 67 2067 505 HOH HOH A . +M 3 HOH 68 2068 506 HOH HOH A . +M 3 HOH 69 2069 519 HOH HOH A . +M 3 HOH 70 2070 522 HOH HOH A . +M 3 HOH 71 2071 524 HOH HOH A . +M 3 HOH 72 2072 538 HOH HOH A . +M 3 HOH 73 2073 539 HOH HOH A . +M 3 HOH 74 2074 540 HOH HOH A . +M 3 HOH 75 2075 541 HOH HOH A . +M 3 HOH 76 2076 542 HOH HOH A . +M 3 HOH 77 2077 543 HOH HOH A . +M 3 HOH 78 2078 544 HOH HOH A . +M 3 HOH 79 2079 550 HOH HOH A . +M 3 HOH 80 2080 575 HOH HOH A . +M 3 HOH 81 2081 583 HOH HOH A . +M 3 HOH 82 2082 594 HOH HOH A . +M 3 HOH 83 2083 605 HOH HOH A . +N 3 HOH 1 2001 30 HOH HOH B . +N 3 HOH 2 2002 31 HOH HOH B . +N 3 HOH 3 2003 32 HOH HOH B . +N 3 HOH 4 2004 33 HOH HOH B . +N 3 HOH 5 2005 34 HOH HOH B . +N 3 HOH 6 2006 35 HOH HOH B . +N 3 HOH 7 2007 36 HOH HOH B . +N 3 HOH 8 2008 37 HOH HOH B . +N 3 HOH 9 2009 38 HOH HOH B . +N 3 HOH 10 2010 39 HOH HOH B . +N 3 HOH 11 2011 40 HOH HOH B . +N 3 HOH 12 2012 41 HOH HOH B . +N 3 HOH 13 2013 42 HOH HOH B . +N 3 HOH 14 2014 43 HOH HOH B . +N 3 HOH 15 2015 44 HOH HOH B . +N 3 HOH 16 2016 45 HOH HOH B . +N 3 HOH 17 2017 46 HOH HOH B . +N 3 HOH 18 2018 47 HOH HOH B . +N 3 HOH 19 2019 48 HOH HOH B . +N 3 HOH 20 2020 49 HOH HOH B . +N 3 HOH 21 2021 50 HOH HOH B . +N 3 HOH 22 2022 51 HOH HOH B . +N 3 HOH 23 2023 52 HOH HOH B . +N 3 HOH 24 2024 54 HOH HOH B . +N 3 HOH 25 2025 55 HOH HOH B . +N 3 HOH 26 2026 56 HOH HOH B . +N 3 HOH 27 2027 107 HOH HOH B . +N 3 HOH 28 2028 166 HOH HOH B . +N 3 HOH 29 2029 167 HOH HOH B . +N 3 HOH 30 2030 185 HOH HOH B . +N 3 HOH 31 2031 195 HOH HOH B . +N 3 HOH 32 2032 196 HOH HOH B . +N 3 HOH 33 2033 197 HOH HOH B . +N 3 HOH 34 2034 198 HOH HOH B . +N 3 HOH 35 2035 199 HOH HOH B . +N 3 HOH 36 2036 200 HOH HOH B . +N 3 HOH 37 2037 201 HOH HOH B . +N 3 HOH 38 2038 202 HOH HOH B . +N 3 HOH 39 2039 203 HOH HOH B . +N 3 HOH 40 2040 204 HOH HOH B . +N 3 HOH 41 2041 205 HOH HOH B . +N 3 HOH 42 2042 206 HOH HOH B . +N 3 HOH 43 2043 207 HOH HOH B . +N 3 HOH 44 2044 208 HOH HOH B . +N 3 HOH 45 2045 209 HOH HOH B . +N 3 HOH 46 2046 313 HOH HOH B . +N 3 HOH 47 2047 363 HOH HOH B . +N 3 HOH 48 2048 372 HOH HOH B . +N 3 HOH 49 2049 384 HOH HOH B . +N 3 HOH 50 2050 408 HOH HOH B . +N 3 HOH 51 2051 412 HOH HOH B . +N 3 HOH 52 2052 431 HOH HOH B . +N 3 HOH 53 2053 438 HOH HOH B . +N 3 HOH 54 2054 445 HOH HOH B . +N 3 HOH 55 2055 451 HOH HOH B . +N 3 HOH 56 2056 460 HOH HOH B . +N 3 HOH 57 2057 467 HOH HOH B . +N 3 HOH 58 2058 468 HOH HOH B . +N 3 HOH 59 2059 470 HOH HOH B . +N 3 HOH 60 2060 479 HOH HOH B . +N 3 HOH 61 2061 498 HOH HOH B . +N 3 HOH 62 2062 513 HOH HOH B . +N 3 HOH 63 2063 520 HOH HOH B . +N 3 HOH 64 2064 527 HOH HOH B . +N 3 HOH 65 2065 545 HOH HOH B . +N 3 HOH 66 2066 546 HOH HOH B . +N 3 HOH 67 2067 547 HOH HOH B . +N 3 HOH 68 2068 548 HOH HOH B . +N 3 HOH 69 2069 549 HOH HOH B . +N 3 HOH 70 2070 551 HOH HOH B . +N 3 HOH 71 2071 576 HOH HOH B . +N 3 HOH 72 2072 582 HOH HOH B . +N 3 HOH 73 2073 595 HOH HOH B . +N 3 HOH 74 2074 613 HOH HOH B . +O 3 HOH 1 2001 57 HOH HOH C . +O 3 HOH 2 2002 58 HOH HOH C . +O 3 HOH 3 2003 59 HOH HOH C . +O 3 HOH 4 2004 60 HOH HOH C . +O 3 HOH 5 2005 61 HOH HOH C . +O 3 HOH 6 2006 62 HOH HOH C . +O 3 HOH 7 2007 63 HOH HOH C . +O 3 HOH 8 2008 64 HOH HOH C . +O 3 HOH 9 2009 65 HOH HOH C . +O 3 HOH 10 2010 66 HOH HOH C . +O 3 HOH 11 2011 67 HOH HOH C . +O 3 HOH 12 2012 68 HOH HOH C . +O 3 HOH 13 2013 69 HOH HOH C . +O 3 HOH 14 2014 70 HOH HOH C . +O 3 HOH 15 2015 71 HOH HOH C . +O 3 HOH 16 2016 72 HOH HOH C . +O 3 HOH 17 2017 73 HOH HOH C . +O 3 HOH 18 2018 74 HOH HOH C . +O 3 HOH 19 2019 75 HOH HOH C . +O 3 HOH 20 2020 76 HOH HOH C . +O 3 HOH 21 2021 77 HOH HOH C . +O 3 HOH 22 2022 78 HOH HOH C . +O 3 HOH 23 2023 79 HOH HOH C . +O 3 HOH 24 2024 81 HOH HOH C . +O 3 HOH 25 2025 82 HOH HOH C . +O 3 HOH 26 2026 83 HOH HOH C . +O 3 HOH 27 2027 161 HOH HOH C . +O 3 HOH 28 2028 168 HOH HOH C . +O 3 HOH 29 2029 210 HOH HOH C . +O 3 HOH 30 2030 211 HOH HOH C . +O 3 HOH 31 2031 212 HOH HOH C . +O 3 HOH 32 2032 213 HOH HOH C . +O 3 HOH 33 2033 214 HOH HOH C . +O 3 HOH 34 2034 215 HOH HOH C . +O 3 HOH 35 2035 216 HOH HOH C . +O 3 HOH 36 2036 217 HOH HOH C . +O 3 HOH 37 2037 218 HOH HOH C . +O 3 HOH 38 2038 219 HOH HOH C . +O 3 HOH 39 2039 220 HOH HOH C . +O 3 HOH 40 2040 221 HOH HOH C . +O 3 HOH 41 2041 222 HOH HOH C . +O 3 HOH 42 2042 223 HOH HOH C . +O 3 HOH 43 2043 224 HOH HOH C . +O 3 HOH 44 2044 225 HOH HOH C . +O 3 HOH 45 2045 226 HOH HOH C . +O 3 HOH 46 2046 227 HOH HOH C . +O 3 HOH 47 2047 228 HOH HOH C . +O 3 HOH 48 2048 229 HOH HOH C . +O 3 HOH 49 2049 302 HOH HOH C . +O 3 HOH 50 2050 314 HOH HOH C . +O 3 HOH 51 2051 320 HOH HOH C . +O 3 HOH 52 2052 331 HOH HOH C . +O 3 HOH 53 2053 342 HOH HOH C . +O 3 HOH 54 2054 343 HOH HOH C . +O 3 HOH 55 2055 351 HOH HOH C . +O 3 HOH 56 2056 352 HOH HOH C . +O 3 HOH 57 2057 353 HOH HOH C . +O 3 HOH 58 2058 356 HOH HOH C . +O 3 HOH 59 2059 359 HOH HOH C . +O 3 HOH 60 2060 365 HOH HOH C . +O 3 HOH 61 2061 371 HOH HOH C . +O 3 HOH 62 2062 379 HOH HOH C . +O 3 HOH 63 2063 380 HOH HOH C . +O 3 HOH 64 2064 397 HOH HOH C . +O 3 HOH 65 2065 410 HOH HOH C . +O 3 HOH 66 2066 429 HOH HOH C . +O 3 HOH 67 2067 432 HOH HOH C . +O 3 HOH 68 2068 439 HOH HOH C . +O 3 HOH 69 2069 440 HOH HOH C . +O 3 HOH 70 2070 443 HOH HOH C . +O 3 HOH 71 2071 459 HOH HOH C . +O 3 HOH 72 2072 461 HOH HOH C . +O 3 HOH 73 2073 462 HOH HOH C . +O 3 HOH 74 2074 481 HOH HOH C . +O 3 HOH 75 2075 490 HOH HOH C . +O 3 HOH 76 2076 493 HOH HOH C . +O 3 HOH 77 2077 502 HOH HOH C . +O 3 HOH 78 2078 516 HOH HOH C . +O 3 HOH 79 2079 530 HOH HOH C . +O 3 HOH 80 2080 534 HOH HOH C . +O 3 HOH 81 2081 535 HOH HOH C . +O 3 HOH 82 2082 537 HOH HOH C . +O 3 HOH 83 2083 552 HOH HOH C . +O 3 HOH 84 2084 553 HOH HOH C . +O 3 HOH 85 2085 554 HOH HOH C . +O 3 HOH 86 2086 555 HOH HOH C . +O 3 HOH 87 2087 556 HOH HOH C . +O 3 HOH 88 2088 557 HOH HOH C . +O 3 HOH 89 2089 580 HOH HOH C . +O 3 HOH 90 2090 588 HOH HOH C . +O 3 HOH 91 2091 589 HOH HOH C . +O 3 HOH 92 2092 592 HOH HOH C . +O 3 HOH 93 2093 593 HOH HOH C . +O 3 HOH 94 2094 600 HOH HOH C . +O 3 HOH 95 2095 604 HOH HOH C . +O 3 HOH 96 2096 609 HOH HOH C . +P 3 HOH 1 2001 53 HOH HOH D . +P 3 HOH 2 2002 84 HOH HOH D . +P 3 HOH 3 2003 85 HOH HOH D . +P 3 HOH 4 2004 86 HOH HOH D . +P 3 HOH 5 2005 87 HOH HOH D . +P 3 HOH 6 2006 88 HOH HOH D . +P 3 HOH 7 2007 89 HOH HOH D . +P 3 HOH 8 2008 90 HOH HOH D . +P 3 HOH 9 2009 91 HOH HOH D . +P 3 HOH 10 2010 92 HOH HOH D . +P 3 HOH 11 2011 93 HOH HOH D . +P 3 HOH 12 2012 94 HOH HOH D . +P 3 HOH 13 2013 95 HOH HOH D . +P 3 HOH 14 2014 96 HOH HOH D . +P 3 HOH 15 2015 97 HOH HOH D . +P 3 HOH 16 2016 98 HOH HOH D . +P 3 HOH 17 2017 99 HOH HOH D . +P 3 HOH 18 2018 100 HOH HOH D . +P 3 HOH 19 2019 101 HOH HOH D . +P 3 HOH 20 2020 102 HOH HOH D . +P 3 HOH 21 2021 103 HOH HOH D . +P 3 HOH 22 2022 104 HOH HOH D . +P 3 HOH 23 2023 105 HOH HOH D . +P 3 HOH 24 2024 106 HOH HOH D . +P 3 HOH 25 2025 108 HOH HOH D . +P 3 HOH 26 2026 109 HOH HOH D . +P 3 HOH 27 2027 110 HOH HOH D . +P 3 HOH 28 2028 169 HOH HOH D . +P 3 HOH 29 2029 170 HOH HOH D . +P 3 HOH 30 2030 230 HOH HOH D . +P 3 HOH 31 2031 231 HOH HOH D . +P 3 HOH 32 2032 232 HOH HOH D . +P 3 HOH 33 2033 233 HOH HOH D . +P 3 HOH 34 2034 234 HOH HOH D . +P 3 HOH 35 2035 235 HOH HOH D . +P 3 HOH 36 2036 236 HOH HOH D . +P 3 HOH 37 2037 237 HOH HOH D . +P 3 HOH 38 2038 238 HOH HOH D . +P 3 HOH 39 2039 239 HOH HOH D . +P 3 HOH 40 2040 240 HOH HOH D . +P 3 HOH 41 2041 241 HOH HOH D . +P 3 HOH 42 2042 242 HOH HOH D . +P 3 HOH 43 2043 243 HOH HOH D . +P 3 HOH 44 2044 244 HOH HOH D . +P 3 HOH 45 2045 245 HOH HOH D . +P 3 HOH 46 2046 246 HOH HOH D . +P 3 HOH 47 2047 247 HOH HOH D . +P 3 HOH 48 2048 248 HOH HOH D . +P 3 HOH 49 2049 304 HOH HOH D . +P 3 HOH 50 2050 309 HOH HOH D . +P 3 HOH 51 2051 311 HOH HOH D . +P 3 HOH 52 2052 315 HOH HOH D . +P 3 HOH 53 2053 318 HOH HOH D . +P 3 HOH 54 2054 327 HOH HOH D . +P 3 HOH 55 2055 333 HOH HOH D . +P 3 HOH 56 2056 337 HOH HOH D . +P 3 HOH 57 2057 347 HOH HOH D . +P 3 HOH 58 2058 368 HOH HOH D . +P 3 HOH 59 2059 369 HOH HOH D . +P 3 HOH 60 2060 377 HOH HOH D . +P 3 HOH 61 2061 382 HOH HOH D . +P 3 HOH 62 2062 392 HOH HOH D . +P 3 HOH 63 2063 398 HOH HOH D . +P 3 HOH 64 2064 400 HOH HOH D . +P 3 HOH 65 2065 405 HOH HOH D . +P 3 HOH 66 2066 406 HOH HOH D . +P 3 HOH 67 2067 407 HOH HOH D . +P 3 HOH 68 2068 415 HOH HOH D . +P 3 HOH 69 2069 422 HOH HOH D . +P 3 HOH 70 2070 430 HOH HOH D . +P 3 HOH 71 2071 433 HOH HOH D . +P 3 HOH 72 2072 442 HOH HOH D . +P 3 HOH 73 2073 444 HOH HOH D . +P 3 HOH 74 2074 455 HOH HOH D . +P 3 HOH 75 2075 473 HOH HOH D . +P 3 HOH 76 2076 474 HOH HOH D . +P 3 HOH 77 2077 475 HOH HOH D . +P 3 HOH 78 2078 477 HOH HOH D . +P 3 HOH 79 2079 478 HOH HOH D . +P 3 HOH 80 2080 483 HOH HOH D . +P 3 HOH 81 2081 494 HOH HOH D . +P 3 HOH 82 2082 497 HOH HOH D . +P 3 HOH 83 2083 503 HOH HOH D . +P 3 HOH 84 2084 528 HOH HOH D . +P 3 HOH 85 2085 529 HOH HOH D . +P 3 HOH 86 2086 532 HOH HOH D . +P 3 HOH 87 2087 558 HOH HOH D . +P 3 HOH 88 2088 559 HOH HOH D . +P 3 HOH 89 2089 560 HOH HOH D . +P 3 HOH 90 2090 561 HOH HOH D . +P 3 HOH 91 2091 562 HOH HOH D . +P 3 HOH 92 2092 563 HOH HOH D . +P 3 HOH 93 2093 581 HOH HOH D . +P 3 HOH 94 2094 585 HOH HOH D . +P 3 HOH 95 2095 586 HOH HOH D . +P 3 HOH 96 2096 587 HOH HOH D . +P 3 HOH 97 2097 599 HOH HOH D . +P 3 HOH 98 2098 601 HOH HOH D . +P 3 HOH 99 2099 607 HOH HOH D . +P 3 HOH 100 2100 608 HOH HOH D . +P 3 HOH 101 2101 610 HOH HOH D . +P 3 HOH 102 2102 611 HOH HOH D . +P 3 HOH 103 2103 615 HOH HOH D . +Q 3 HOH 1 2001 26 HOH HOH E . +Q 3 HOH 2 2002 111 HOH HOH E . +Q 3 HOH 3 2003 112 HOH HOH E . +Q 3 HOH 4 2004 113 HOH HOH E . +Q 3 HOH 5 2005 114 HOH HOH E . +Q 3 HOH 6 2006 115 HOH HOH E . +Q 3 HOH 7 2007 116 HOH HOH E . +Q 3 HOH 8 2008 117 HOH HOH E . +Q 3 HOH 9 2009 118 HOH HOH E . +Q 3 HOH 10 2010 119 HOH HOH E . +Q 3 HOH 11 2011 120 HOH HOH E . +Q 3 HOH 12 2012 121 HOH HOH E . +Q 3 HOH 13 2013 122 HOH HOH E . +Q 3 HOH 14 2014 123 HOH HOH E . +Q 3 HOH 15 2015 124 HOH HOH E . +Q 3 HOH 16 2016 125 HOH HOH E . +Q 3 HOH 17 2017 126 HOH HOH E . +Q 3 HOH 18 2018 127 HOH HOH E . +Q 3 HOH 19 2019 128 HOH HOH E . +Q 3 HOH 20 2020 129 HOH HOH E . +Q 3 HOH 21 2021 130 HOH HOH E . +Q 3 HOH 22 2022 131 HOH HOH E . +Q 3 HOH 23 2023 132 HOH HOH E . +Q 3 HOH 24 2024 133 HOH HOH E . +Q 3 HOH 25 2025 134 HOH HOH E . +Q 3 HOH 26 2026 135 HOH HOH E . +Q 3 HOH 27 2027 136 HOH HOH E . +Q 3 HOH 28 2028 137 HOH HOH E . +Q 3 HOH 29 2029 171 HOH HOH E . +Q 3 HOH 30 2030 172 HOH HOH E . +Q 3 HOH 31 2031 173 HOH HOH E . +Q 3 HOH 32 2032 249 HOH HOH E . +Q 3 HOH 33 2033 250 HOH HOH E . +Q 3 HOH 34 2034 251 HOH HOH E . +Q 3 HOH 35 2035 252 HOH HOH E . +Q 3 HOH 36 2036 253 HOH HOH E . +Q 3 HOH 37 2037 254 HOH HOH E . +Q 3 HOH 38 2038 255 HOH HOH E . +Q 3 HOH 39 2039 256 HOH HOH E . +Q 3 HOH 40 2040 257 HOH HOH E . +Q 3 HOH 41 2041 258 HOH HOH E . +Q 3 HOH 42 2042 259 HOH HOH E . +Q 3 HOH 43 2043 261 HOH HOH E . +Q 3 HOH 44 2044 262 HOH HOH E . +Q 3 HOH 45 2045 263 HOH HOH E . +Q 3 HOH 46 2046 264 HOH HOH E . +Q 3 HOH 47 2047 265 HOH HOH E . +Q 3 HOH 48 2048 266 HOH HOH E . +Q 3 HOH 49 2049 267 HOH HOH E . +Q 3 HOH 50 2050 268 HOH HOH E . +Q 3 HOH 51 2051 269 HOH HOH E . +Q 3 HOH 52 2052 270 HOH HOH E . +Q 3 HOH 53 2053 271 HOH HOH E . +Q 3 HOH 54 2054 272 HOH HOH E . +Q 3 HOH 55 2055 273 HOH HOH E . +Q 3 HOH 56 2056 274 HOH HOH E . +Q 3 HOH 57 2057 275 HOH HOH E . +Q 3 HOH 58 2058 276 HOH HOH E . +Q 3 HOH 59 2059 298 HOH HOH E . +Q 3 HOH 60 2060 300 HOH HOH E . +Q 3 HOH 61 2061 307 HOH HOH E . +Q 3 HOH 62 2062 308 HOH HOH E . +Q 3 HOH 63 2063 312 HOH HOH E . +Q 3 HOH 64 2064 316 HOH HOH E . +Q 3 HOH 65 2065 326 HOH HOH E . +Q 3 HOH 66 2066 328 HOH HOH E . +Q 3 HOH 67 2067 329 HOH HOH E . +Q 3 HOH 68 2068 332 HOH HOH E . +Q 3 HOH 69 2069 334 HOH HOH E . +Q 3 HOH 70 2070 336 HOH HOH E . +Q 3 HOH 71 2071 338 HOH HOH E . +Q 3 HOH 72 2072 341 HOH HOH E . +Q 3 HOH 73 2073 346 HOH HOH E . +Q 3 HOH 74 2074 349 HOH HOH E . +Q 3 HOH 75 2075 357 HOH HOH E . +Q 3 HOH 76 2076 358 HOH HOH E . +Q 3 HOH 77 2077 360 HOH HOH E . +Q 3 HOH 78 2078 362 HOH HOH E . +Q 3 HOH 79 2079 367 HOH HOH E . +Q 3 HOH 80 2080 376 HOH HOH E . +Q 3 HOH 81 2081 383 HOH HOH E . +Q 3 HOH 82 2082 387 HOH HOH E . +Q 3 HOH 83 2083 388 HOH HOH E . +Q 3 HOH 84 2084 390 HOH HOH E . +Q 3 HOH 85 2085 399 HOH HOH E . +Q 3 HOH 86 2086 404 HOH HOH E . +Q 3 HOH 87 2087 416 HOH HOH E . +Q 3 HOH 88 2088 420 HOH HOH E . +Q 3 HOH 89 2089 434 HOH HOH E . +Q 3 HOH 90 2090 436 HOH HOH E . +Q 3 HOH 91 2091 437 HOH HOH E . +Q 3 HOH 92 2092 441 HOH HOH E . +Q 3 HOH 93 2093 452 HOH HOH E . +Q 3 HOH 94 2094 464 HOH HOH E . +Q 3 HOH 95 2095 466 HOH HOH E . +Q 3 HOH 96 2096 469 HOH HOH E . +Q 3 HOH 97 2097 472 HOH HOH E . +Q 3 HOH 98 2098 480 HOH HOH E . +Q 3 HOH 99 2099 486 HOH HOH E . +Q 3 HOH 100 2100 487 HOH HOH E . +Q 3 HOH 101 2101 489 HOH HOH E . +Q 3 HOH 102 2102 492 HOH HOH E . +Q 3 HOH 103 2103 495 HOH HOH E . +Q 3 HOH 104 2104 496 HOH HOH E . +Q 3 HOH 105 2105 499 HOH HOH E . +Q 3 HOH 106 2106 507 HOH HOH E . +Q 3 HOH 107 2107 508 HOH HOH E . +Q 3 HOH 108 2108 509 HOH HOH E . +Q 3 HOH 109 2109 510 HOH HOH E . +Q 3 HOH 110 2110 511 HOH HOH E . +Q 3 HOH 111 2111 512 HOH HOH E . +Q 3 HOH 112 2112 515 HOH HOH E . +Q 3 HOH 113 2113 517 HOH HOH E . +Q 3 HOH 114 2114 518 HOH HOH E . +Q 3 HOH 115 2115 523 HOH HOH E . +Q 3 HOH 116 2116 525 HOH HOH E . +Q 3 HOH 117 2117 526 HOH HOH E . +Q 3 HOH 118 2118 531 HOH HOH E . +Q 3 HOH 119 2119 564 HOH HOH E . +Q 3 HOH 120 2120 565 HOH HOH E . +Q 3 HOH 121 2121 566 HOH HOH E . +Q 3 HOH 122 2122 567 HOH HOH E . +Q 3 HOH 123 2123 577 HOH HOH E . +Q 3 HOH 124 2124 584 HOH HOH E . +Q 3 HOH 125 2125 590 HOH HOH E . +Q 3 HOH 126 2126 596 HOH HOH E . +Q 3 HOH 127 2127 614 HOH HOH E . +R 3 HOH 1 2001 80 HOH HOH F . +R 3 HOH 2 2002 138 HOH HOH F . +R 3 HOH 3 2003 139 HOH HOH F . +R 3 HOH 4 2004 140 HOH HOH F . +R 3 HOH 5 2005 141 HOH HOH F . +R 3 HOH 6 2006 142 HOH HOH F . +R 3 HOH 7 2007 143 HOH HOH F . +R 3 HOH 8 2008 144 HOH HOH F . +R 3 HOH 9 2009 145 HOH HOH F . +R 3 HOH 10 2010 146 HOH HOH F . +R 3 HOH 11 2011 147 HOH HOH F . +R 3 HOH 12 2012 148 HOH HOH F . +R 3 HOH 13 2013 149 HOH HOH F . +R 3 HOH 14 2014 150 HOH HOH F . +R 3 HOH 15 2015 151 HOH HOH F . +R 3 HOH 16 2016 152 HOH HOH F . +R 3 HOH 17 2017 153 HOH HOH F . +R 3 HOH 18 2018 154 HOH HOH F . +R 3 HOH 19 2019 155 HOH HOH F . +R 3 HOH 20 2020 156 HOH HOH F . +R 3 HOH 21 2021 157 HOH HOH F . +R 3 HOH 22 2022 158 HOH HOH F . +R 3 HOH 23 2023 159 HOH HOH F . +R 3 HOH 24 2024 160 HOH HOH F . +R 3 HOH 25 2025 162 HOH HOH F . +R 3 HOH 26 2026 163 HOH HOH F . +R 3 HOH 27 2027 164 HOH HOH F . +R 3 HOH 28 2028 174 HOH HOH F . +R 3 HOH 29 2029 175 HOH HOH F . +R 3 HOH 30 2030 176 HOH HOH F . +R 3 HOH 31 2031 177 HOH HOH F . +R 3 HOH 32 2032 260 HOH HOH F . +R 3 HOH 33 2033 277 HOH HOH F . +R 3 HOH 34 2034 278 HOH HOH F . +R 3 HOH 35 2035 279 HOH HOH F . +R 3 HOH 36 2036 280 HOH HOH F . +R 3 HOH 37 2037 281 HOH HOH F . +R 3 HOH 38 2038 282 HOH HOH F . +R 3 HOH 39 2039 283 HOH HOH F . +R 3 HOH 40 2040 284 HOH HOH F . +R 3 HOH 41 2041 285 HOH HOH F . +R 3 HOH 42 2042 286 HOH HOH F . +R 3 HOH 43 2043 287 HOH HOH F . +R 3 HOH 44 2044 288 HOH HOH F . +R 3 HOH 45 2045 289 HOH HOH F . +R 3 HOH 46 2046 290 HOH HOH F . +R 3 HOH 47 2047 291 HOH HOH F . +R 3 HOH 48 2048 292 HOH HOH F . +R 3 HOH 49 2049 293 HOH HOH F . +R 3 HOH 50 2050 294 HOH HOH F . +R 3 HOH 51 2051 295 HOH HOH F . +R 3 HOH 52 2052 296 HOH HOH F . +R 3 HOH 53 2053 297 HOH HOH F . +R 3 HOH 54 2054 299 HOH HOH F . +R 3 HOH 55 2055 301 HOH HOH F . +R 3 HOH 56 2056 303 HOH HOH F . +R 3 HOH 57 2057 305 HOH HOH F . +R 3 HOH 58 2058 306 HOH HOH F . +R 3 HOH 59 2059 310 HOH HOH F . +R 3 HOH 60 2060 317 HOH HOH F . +R 3 HOH 61 2061 319 HOH HOH F . +R 3 HOH 62 2062 321 HOH HOH F . +R 3 HOH 63 2063 325 HOH HOH F . +R 3 HOH 64 2064 330 HOH HOH F . +R 3 HOH 65 2065 335 HOH HOH F . +R 3 HOH 66 2066 339 HOH HOH F . +R 3 HOH 67 2067 344 HOH HOH F . +R 3 HOH 68 2068 345 HOH HOH F . +R 3 HOH 69 2069 348 HOH HOH F . +R 3 HOH 70 2070 354 HOH HOH F . +R 3 HOH 71 2071 361 HOH HOH F . +R 3 HOH 72 2072 366 HOH HOH F . +R 3 HOH 73 2073 370 HOH HOH F . +R 3 HOH 74 2074 373 HOH HOH F . +R 3 HOH 75 2075 374 HOH HOH F . +R 3 HOH 76 2076 375 HOH HOH F . +R 3 HOH 77 2077 378 HOH HOH F . +R 3 HOH 78 2078 381 HOH HOH F . +R 3 HOH 79 2079 385 HOH HOH F . +R 3 HOH 80 2080 386 HOH HOH F . +R 3 HOH 81 2081 391 HOH HOH F . +R 3 HOH 82 2082 394 HOH HOH F . +R 3 HOH 83 2083 395 HOH HOH F . +R 3 HOH 84 2084 396 HOH HOH F . +R 3 HOH 85 2085 401 HOH HOH F . +R 3 HOH 86 2086 402 HOH HOH F . +R 3 HOH 87 2087 411 HOH HOH F . +R 3 HOH 88 2088 413 HOH HOH F . +R 3 HOH 89 2089 414 HOH HOH F . +R 3 HOH 90 2090 418 HOH HOH F . +R 3 HOH 91 2091 419 HOH HOH F . +R 3 HOH 92 2092 421 HOH HOH F . +R 3 HOH 93 2093 423 HOH HOH F . +R 3 HOH 94 2094 426 HOH HOH F . +R 3 HOH 95 2095 427 HOH HOH F . +R 3 HOH 96 2096 428 HOH HOH F . +R 3 HOH 97 2097 435 HOH HOH F . +R 3 HOH 98 2098 448 HOH HOH F . +R 3 HOH 99 2099 449 HOH HOH F . +R 3 HOH 100 2100 454 HOH HOH F . +R 3 HOH 101 2101 456 HOH HOH F . +R 3 HOH 102 2102 457 HOH HOH F . +R 3 HOH 103 2103 458 HOH HOH F . +R 3 HOH 104 2104 463 HOH HOH F . +R 3 HOH 105 2105 476 HOH HOH F . +R 3 HOH 106 2106 482 HOH HOH F . +R 3 HOH 107 2107 484 HOH HOH F . +R 3 HOH 108 2108 485 HOH HOH F . +R 3 HOH 109 2109 491 HOH HOH F . +R 3 HOH 110 2110 500 HOH HOH F . +R 3 HOH 111 2111 501 HOH HOH F . +R 3 HOH 112 2112 504 HOH HOH F . +R 3 HOH 113 2113 514 HOH HOH F . +R 3 HOH 114 2114 521 HOH HOH F . +R 3 HOH 115 2115 533 HOH HOH F . +R 3 HOH 116 2116 536 HOH HOH F . +R 3 HOH 117 2117 568 HOH HOH F . +R 3 HOH 118 2118 569 HOH HOH F . +R 3 HOH 119 2119 570 HOH HOH F . +R 3 HOH 120 2120 571 HOH HOH F . +R 3 HOH 121 2121 572 HOH HOH F . +R 3 HOH 122 2122 573 HOH HOH F . +R 3 HOH 123 2123 574 HOH HOH F . +R 3 HOH 124 2124 578 HOH HOH F . +R 3 HOH 125 2125 579 HOH HOH F . +R 3 HOH 126 2126 591 HOH HOH F . +R 3 HOH 127 2127 597 HOH HOH F . +R 3 HOH 128 2128 598 HOH HOH F . +R 3 HOH 129 2129 602 HOH HOH F . +R 3 HOH 130 2130 603 HOH HOH F . +R 3 HOH 131 2131 606 HOH HOH F . +R 3 HOH 132 2132 612 HOH HOH F . +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_and_software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details hexameric +_pdbx_struct_assembly.oligomeric_count 6 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 26590 ? +1 MORE -84 ? +1 'SSA (A^2)' 131740 ? +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2006-05-02 +2 'Structure model' 1 1 2008-05-01 +3 'Structure model' 1 2 2011-07-13 +4 'Structure model' 1 3 2020-07-29 +5 'Structure model' 1 4 2023-08-30 +# +loop_ +_pdbx_audit_revision_details.ordinal +_pdbx_audit_revision_details.revision_ordinal +_pdbx_audit_revision_details.data_content_type +_pdbx_audit_revision_details.provider +_pdbx_audit_revision_details.type +_pdbx_audit_revision_details.description +_pdbx_audit_revision_details.details +1 1 'Structure model' repository 'Initial release' ? ? +2 4 'Structure model' repository Remediation 'Carbohydrate remediation' ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Version format compliance' +3 4 'Structure model' 'Data collection' +4 4 'Structure model' 'Database references' +5 4 'Structure model' 'Derived calculations' +6 4 'Structure model' 'Structure summary' +7 5 'Structure model' 'Data collection' +8 5 'Structure model' 'Database references' +9 5 'Structure model' 'Refinement description' +10 5 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 4 'Structure model' chem_comp +2 4 'Structure model' entity +3 4 'Structure model' pdbx_chem_comp_identifier +4 4 'Structure model' pdbx_entity_nonpoly +5 4 'Structure model' struct_ref_seq_dif +6 4 'Structure model' struct_site +7 4 'Structure model' struct_site_gen +8 5 'Structure model' chem_comp +9 5 'Structure model' chem_comp_atom +10 5 'Structure model' chem_comp_bond +11 5 'Structure model' database_2 +12 5 'Structure model' pdbx_initial_refinement_model +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 4 'Structure model' '_chem_comp.mon_nstd_flag' +2 4 'Structure model' '_chem_comp.name' +3 4 'Structure model' '_chem_comp.type' +4 4 'Structure model' '_entity.pdbx_description' +5 4 'Structure model' '_pdbx_entity_nonpoly.name' +6 4 'Structure model' '_struct_ref_seq_dif.details' +7 5 'Structure model' '_chem_comp.pdbx_synonyms' +8 5 'Structure model' '_database_2.pdbx_DOI' +9 5 'Structure model' '_database_2.pdbx_database_accession' +# +_pdbx_phasing_MR.entry_id 2G3N +_pdbx_phasing_MR.method_rotation ? +_pdbx_phasing_MR.method_translation ? +_pdbx_phasing_MR.model_details ? +_pdbx_phasing_MR.R_factor 0.391 +_pdbx_phasing_MR.R_rigid_body ? +_pdbx_phasing_MR.correlation_coeff_Fo_to_Fc 0.643 +_pdbx_phasing_MR.correlation_coeff_Io_to_Ic ? +_pdbx_phasing_MR.d_res_high_rotation 2.500 +_pdbx_phasing_MR.d_res_low_rotation 24.160 +_pdbx_phasing_MR.d_res_high_translation 2.500 +_pdbx_phasing_MR.d_res_low_translation 24.160 +_pdbx_phasing_MR.packing ? +_pdbx_phasing_MR.reflns_percent_rotation ? +_pdbx_phasing_MR.reflns_percent_translation ? +_pdbx_phasing_MR.sigma_F_rotation ? +_pdbx_phasing_MR.sigma_F_translation ? +_pdbx_phasing_MR.sigma_I_rotation ? +_pdbx_phasing_MR.sigma_I_translation ? +# +loop_ +_software.name +_software.version +_software.date +_software.type +_software.contact_author +_software.contact_author_email +_software.classification +_software.location +_software.language +_software.citation_id +_software.pdbx_ordinal +XSCALE . ? ? 'Wolfgang Kabsch' ? 'data scaling' +http://www.mpimf-heidelberg.mpg.de/~kabsch/xds/xscale_program.html ? ? 1 +MOLREP . ? ? 'A. Vagin' alexei@ysbl.york.ac.uk phasing +http://www.ccp4.ac.uk/dist/html/molrep.html Fortran ? 2 +CNS 1.1 ? package 'Axel T. Brunger' axel.brunger@yale.edu refinement +http://cns.csb.yale.edu/v1.1/ Fortran_77 ? 3 +PDB_EXTRACT 1.701 'Nov. 1, 2005' package PDB sw-help@rcsb.rutgers.edu 'data extraction' +http://pdb.rutgers.edu/software/ C++ ? 4 +XDS . ? ? ? ? 'data reduction' ? ? ? 5 +# +_pdbx_validate_close_contact.id 1 +_pdbx_validate_close_contact.PDB_model_num 1 +_pdbx_validate_close_contact.auth_atom_id_1 OD1 +_pdbx_validate_close_contact.auth_asym_id_1 E +_pdbx_validate_close_contact.auth_comp_id_1 ASP +_pdbx_validate_close_contact.auth_seq_id_1 487 +_pdbx_validate_close_contact.PDB_ins_code_1 ? +_pdbx_validate_close_contact.label_alt_id_1 ? +_pdbx_validate_close_contact.auth_atom_id_2 O +_pdbx_validate_close_contact.auth_asym_id_2 E +_pdbx_validate_close_contact.auth_comp_id_2 HOH +_pdbx_validate_close_contact.auth_seq_id_2 2054 +_pdbx_validate_close_contact.PDB_ins_code_2 ? +_pdbx_validate_close_contact.label_alt_id_2 ? +_pdbx_validate_close_contact.dist 2.18 +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 ASN A 9 ? ? -162.06 107.37 +2 1 GLU A 29 ? ? 10.78 -88.16 +3 1 GLN A 48 ? ? -128.84 -146.10 +4 1 ARG A 78 ? ? 70.58 45.78 +5 1 LEU A 98 ? ? -117.82 -153.16 +6 1 ILE A 213 ? ? -48.06 -14.75 +7 1 PHE A 293 ? ? -58.54 -9.73 +8 1 ASN A 322 ? ? -84.72 33.21 +9 1 PRO A 341 ? ? -66.33 8.96 +10 1 THR A 414 ? ? -76.14 24.39 +11 1 ARG A 452 ? ? -144.52 42.44 +12 1 GLU A 456 ? ? -77.13 43.42 +13 1 LYS A 589 ? ? 67.19 61.18 +14 1 PRO A 599 ? ? -63.33 93.97 +15 1 ASN A 628 ? ? 79.10 -11.34 +16 1 SER A 634 ? ? -139.81 -152.25 +17 1 SER A 635 ? ? -10.58 -84.33 +18 1 ASN A 636 ? ? -150.94 34.95 +19 1 SER A 647 ? ? -84.56 -88.21 +20 1 ASP A 664 ? ? 65.68 -11.20 +21 1 SER A 665 ? ? -84.58 -101.89 +22 1 ASN A 676 ? ? 59.28 7.91 +23 1 ASN B 9 ? ? -170.18 114.55 +24 1 GLU B 29 ? ? -26.44 -70.84 +25 1 GLN B 30 ? ? -101.10 -165.07 +26 1 LYS B 31 ? ? -151.61 38.03 +27 1 GLN B 48 ? ? -128.75 -145.56 +28 1 LEU B 98 ? ? -118.15 -152.67 +29 1 TYR B 187 ? ? 178.88 162.22 +30 1 ILE B 213 ? ? -47.23 -16.09 +31 1 PHE B 293 ? ? -58.47 -9.37 +32 1 MET B 321 ? ? 59.66 15.36 +33 1 ASN B 322 ? ? -85.79 34.19 +34 1 THR B 414 ? ? -74.12 22.27 +35 1 ARG B 452 ? ? -144.58 42.05 +36 1 GLU B 456 ? ? -77.22 43.05 +37 1 LYS B 589 ? ? 67.16 61.33 +38 1 PRO B 599 ? ? -63.99 94.26 +39 1 ASN B 628 ? ? 80.16 -13.21 +40 1 SER B 634 ? ? -129.69 -152.34 +41 1 SER B 635 ? ? -30.20 -72.17 +42 1 ASN B 636 ? ? -146.47 42.22 +43 1 SER B 647 ? ? -84.29 -88.97 +44 1 ASP B 664 ? ? 55.49 0.32 +45 1 SER B 665 ? ? -109.16 -99.09 +46 1 ASN B 676 ? ? 58.35 10.29 +47 1 LEU C 28 ? ? -119.82 51.13 +48 1 GLU C 29 ? ? 13.43 -96.26 +49 1 GLN C 48 ? ? -128.05 -145.85 +50 1 LEU C 98 ? ? -116.77 -153.81 +51 1 TYR C 187 ? ? 179.37 161.72 +52 1 ILE C 213 ? ? -48.05 -15.28 +53 1 MET C 321 ? ? 59.78 15.61 +54 1 ASN C 322 ? ? -86.15 33.91 +55 1 PRO C 341 ? ? -59.95 22.59 +56 1 THR C 414 ? ? -76.07 23.01 +57 1 ARG C 452 ? ? -145.69 42.61 +58 1 GLU C 456 ? ? -75.41 41.68 +59 1 LYS C 589 ? ? 67.32 61.96 +60 1 PRO C 599 ? ? -63.74 93.75 +61 1 ASN C 628 ? ? 79.35 -12.63 +62 1 SER C 634 ? ? -136.70 -158.73 +63 1 SER C 635 ? ? -13.11 -76.79 +64 1 ASN C 636 ? ? -154.04 39.80 +65 1 SER C 647 ? ? -83.23 -91.14 +66 1 SER C 665 ? ? 170.74 -122.25 +67 1 LYS C 666 ? ? -23.43 99.49 +68 1 ASN D 9 ? ? 155.51 124.43 +69 1 GLN D 30 ? ? -168.99 97.71 +70 1 GLN D 48 ? ? -129.16 -146.05 +71 1 LEU D 98 ? ? -116.69 -152.87 +72 1 TYR D 187 ? ? 179.29 161.89 +73 1 ILE D 213 ? ? -47.85 -16.31 +74 1 ASN D 322 ? ? -87.24 34.99 +75 1 PRO D 341 ? ? -79.84 28.28 +76 1 THR D 414 ? ? -75.71 22.25 +77 1 ARG D 452 ? ? -145.54 42.49 +78 1 GLU D 456 ? ? -76.69 42.90 +79 1 LYS D 589 ? ? 67.06 62.18 +80 1 PRO D 599 ? ? -63.80 94.24 +81 1 ASP D 613 ? ? 59.31 19.68 +82 1 ASN D 628 ? ? 80.54 -12.45 +83 1 SER D 634 ? ? -137.58 -150.29 +84 1 SER D 635 ? ? -24.60 -88.47 +85 1 SER D 647 ? ? -83.63 -87.89 +86 1 ASP D 664 ? ? 76.34 -19.49 +87 1 SER D 665 ? ? -102.29 -74.86 +88 1 ASN E 9 ? ? 160.63 123.33 +89 1 GLU E 29 ? ? -22.90 -50.57 +90 1 GLN E 48 ? ? -128.33 -146.09 +91 1 LEU E 98 ? ? -117.05 -153.48 +92 1 TYR E 187 ? ? 179.59 162.38 +93 1 ILE E 213 ? ? -48.68 -16.66 +94 1 PHE E 293 ? ? -58.98 -8.52 +95 1 MET E 321 ? ? 59.18 15.50 +96 1 ASN E 322 ? ? -86.41 34.21 +97 1 PRO E 341 ? ? -74.79 25.90 +98 1 THR E 414 ? ? -76.39 23.98 +99 1 ARG E 452 ? ? -146.29 41.43 +100 1 GLU E 456 ? ? -76.16 42.77 +101 1 LYS E 589 ? ? 67.61 61.32 +102 1 PRO E 599 ? ? -64.80 94.17 +103 1 ASN E 628 ? ? 78.80 -9.33 +104 1 SER E 635 ? ? 24.90 -107.36 +105 1 SER E 647 ? ? -85.24 -87.24 +106 1 SER E 665 ? ? -106.43 -92.04 +107 1 ASN E 676 ? ? 59.74 9.33 +108 1 ASN F 9 ? ? -177.67 107.37 +109 1 GLU F 29 ? ? -45.14 -116.23 +110 1 GLN F 30 ? ? -62.34 86.58 +111 1 LYS F 31 ? ? -61.32 -104.58 +112 1 ILE F 32 ? ? 82.04 137.21 +113 1 GLN F 48 ? ? -129.06 -146.17 +114 1 ARG F 78 ? ? 70.04 46.45 +115 1 LEU F 98 ? ? -117.31 -153.77 +116 1 TYR F 187 ? ? 179.19 161.78 +117 1 ILE F 213 ? ? -48.44 -16.14 +118 1 ASN F 322 ? ? -85.70 33.42 +119 1 THR F 414 ? ? -75.35 22.75 +120 1 ARG F 452 ? ? -145.88 42.27 +121 1 GLU F 456 ? ? -76.99 42.43 +122 1 LYS F 589 ? ? 67.10 61.75 +123 1 PRO F 599 ? ? -63.29 94.21 +124 1 ASN F 628 ? ? 80.84 -12.31 +125 1 SER F 634 ? ? 179.45 144.39 +126 1 SER F 647 ? ? -89.27 -87.68 +127 1 ASP F 664 ? ? 58.85 -5.45 +128 1 ASN F 676 ? ? 58.41 8.49 +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 N 1 A BOG 2000 ? "C3'" ? G BOG 1 "C3'" +2 1 N 1 A BOG 2000 ? "C4'" ? G BOG 1 "C4'" +3 1 N 1 A BOG 2000 ? "C5'" ? G BOG 1 "C5'" +4 1 N 1 A BOG 2000 ? "C6'" ? G BOG 1 "C6'" +5 1 N 1 A BOG 2000 ? "C7'" ? G BOG 1 "C7'" +6 1 N 1 A BOG 2000 ? "C8'" ? G BOG 1 "C8'" +7 1 N 1 B BOG 2000 ? "C3'" ? H BOG 1 "C3'" +8 1 N 1 B BOG 2000 ? "C4'" ? H BOG 1 "C4'" +9 1 N 1 B BOG 2000 ? "C5'" ? H BOG 1 "C5'" +10 1 N 1 B BOG 2000 ? "C6'" ? H BOG 1 "C6'" +11 1 N 1 B BOG 2000 ? "C7'" ? H BOG 1 "C7'" +12 1 N 1 B BOG 2000 ? "C8'" ? H BOG 1 "C8'" +13 1 N 1 C BOG 2000 ? "C3'" ? I BOG 1 "C3'" +14 1 N 1 C BOG 2000 ? "C4'" ? I BOG 1 "C4'" +15 1 N 1 C BOG 2000 ? "C5'" ? I BOG 1 "C5'" +16 1 N 1 C BOG 2000 ? "C6'" ? I BOG 1 "C6'" +17 1 N 1 C BOG 2000 ? "C7'" ? I BOG 1 "C7'" +18 1 N 1 C BOG 2000 ? "C8'" ? I BOG 1 "C8'" +19 1 N 1 D BOG 2000 ? "C3'" ? J BOG 1 "C3'" +20 1 N 1 D BOG 2000 ? "C4'" ? J BOG 1 "C4'" +21 1 N 1 D BOG 2000 ? "C5'" ? J BOG 1 "C5'" +22 1 N 1 D BOG 2000 ? "C6'" ? J BOG 1 "C6'" +23 1 N 1 D BOG 2000 ? "C7'" ? J BOG 1 "C7'" +24 1 N 1 D BOG 2000 ? "C8'" ? J BOG 1 "C8'" +25 1 N 1 E BOG 2000 ? "C3'" ? K BOG 1 "C3'" +26 1 N 1 E BOG 2000 ? "C4'" ? K BOG 1 "C4'" +27 1 N 1 E BOG 2000 ? "C5'" ? K BOG 1 "C5'" +28 1 N 1 E BOG 2000 ? "C6'" ? K BOG 1 "C6'" +29 1 N 1 E BOG 2000 ? "C7'" ? K BOG 1 "C7'" +30 1 N 1 E BOG 2000 ? "C8'" ? K BOG 1 "C8'" +31 1 N 1 F BOG 2000 ? "C3'" ? L BOG 1 "C3'" +32 1 N 1 F BOG 2000 ? "C4'" ? L BOG 1 "C4'" +33 1 N 1 F BOG 2000 ? "C5'" ? L BOG 1 "C5'" +34 1 N 1 F BOG 2000 ? "C6'" ? L BOG 1 "C6'" +35 1 N 1 F BOG 2000 ? "C7'" ? L BOG 1 "C7'" +36 1 N 1 F BOG 2000 ? "C8'" ? L BOG 1 "C8'" +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A MET 1 ? A MET 1 +2 1 Y 1 A ARG 2 ? A ARG 2 +3 1 Y 1 B MET 1 ? B MET 1 +4 1 Y 1 B ARG 2 ? B ARG 2 +5 1 Y 1 C MET 1 ? C MET 1 +6 1 Y 1 C ARG 2 ? C ARG 2 +7 1 Y 1 D MET 1 ? D MET 1 +8 1 Y 1 D ARG 2 ? D ARG 2 +9 1 Y 1 E MET 1 ? E MET 1 +10 1 Y 1 E ARG 2 ? E ARG 2 +11 1 Y 1 F MET 1 ? F MET 1 +12 1 Y 1 F ARG 2 ? F ARG 2 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +BOG C1 C N R 74 +BOG O1 O N N 75 +BOG C2 C N R 76 +BOG O2 O N N 77 +BOG C3 C N S 78 +BOG O3 O N N 79 +BOG C4 C N S 80 +BOG O4 O N N 81 +BOG C5 C N R 82 +BOG O5 O N N 83 +BOG C6 C N N 84 +BOG O6 O N N 85 +BOG "C1'" C N N 86 +BOG "C2'" C N N 87 +BOG "C3'" C N N 88 +BOG "C4'" C N N 89 +BOG "C5'" C N N 90 +BOG "C6'" C N N 91 +BOG "C7'" C N N 92 +BOG "C8'" C N N 93 +BOG H1 H N N 94 +BOG H2 H N N 95 +BOG HO2 H N N 96 +BOG H3 H N N 97 +BOG HO3 H N N 98 +BOG H4 H N N 99 +BOG HO4 H N N 100 +BOG H5 H N N 101 +BOG H61 H N N 102 +BOG H62 H N N 103 +BOG HO6 H N N 104 +BOG "H1'1" H N N 105 +BOG "H1'2" H N N 106 +BOG "H2'1" H N N 107 +BOG "H2'2" H N N 108 +BOG "H3'1" H N N 109 +BOG "H3'2" H N N 110 +BOG "H4'1" H N N 111 +BOG "H4'2" H N N 112 +BOG "H5'1" H N N 113 +BOG "H5'2" H N N 114 +BOG "H6'1" H N N 115 +BOG "H6'2" H N N 116 +BOG "H7'1" H N N 117 +BOG "H7'2" H N N 118 +BOG "H8'1" H N N 119 +BOG "H8'2" H N N 120 +BOG "H8'3" H N N 121 +CYS N N N N 122 +CYS CA C N R 123 +CYS C C N N 124 +CYS O O N N 125 +CYS CB C N N 126 +CYS SG S N N 127 +CYS OXT O N N 128 +CYS H H N N 129 +CYS H2 H N N 130 +CYS HA H N N 131 +CYS HB2 H N N 132 +CYS HB3 H N N 133 +CYS HG H N N 134 +CYS HXT H N N 135 +GLN N N N N 136 +GLN CA C N S 137 +GLN C C N N 138 +GLN O O N N 139 +GLN CB C N N 140 +GLN CG C N N 141 +GLN CD C N N 142 +GLN OE1 O N N 143 +GLN NE2 N N N 144 +GLN OXT O N N 145 +GLN H H N N 146 +GLN H2 H N N 147 +GLN HA H N N 148 +GLN HB2 H N N 149 +GLN HB3 H N N 150 +GLN HG2 H N N 151 +GLN HG3 H N N 152 +GLN HE21 H N N 153 +GLN HE22 H N N 154 +GLN HXT H N N 155 +GLU N N N N 156 +GLU CA C N S 157 +GLU C C N N 158 +GLU O O N N 159 +GLU CB C N N 160 +GLU CG C N N 161 +GLU CD C N N 162 +GLU OE1 O N N 163 +GLU OE2 O N N 164 +GLU OXT O N N 165 +GLU H H N N 166 +GLU H2 H N N 167 +GLU HA H N N 168 +GLU HB2 H N N 169 +GLU HB3 H N N 170 +GLU HG2 H N N 171 +GLU HG3 H N N 172 +GLU HE2 H N N 173 +GLU HXT H N N 174 +GLY N N N N 175 +GLY CA C N N 176 +GLY C C N N 177 +GLY O O N N 178 +GLY OXT O N N 179 +GLY H H N N 180 +GLY H2 H N N 181 +GLY HA2 H N N 182 +GLY HA3 H N N 183 +GLY HXT H N N 184 +HIS N N N N 185 +HIS CA C N S 186 +HIS C C N N 187 +HIS O O N N 188 +HIS CB C N N 189 +HIS CG C Y N 190 +HIS ND1 N Y N 191 +HIS CD2 C Y N 192 +HIS CE1 C Y N 193 +HIS NE2 N Y N 194 +HIS OXT O N N 195 +HIS H H N N 196 +HIS H2 H N N 197 +HIS HA H N N 198 +HIS HB2 H N N 199 +HIS HB3 H N N 200 +HIS HD1 H N N 201 +HIS HD2 H N N 202 +HIS HE1 H N N 203 +HIS HE2 H N N 204 +HIS HXT H N N 205 +HOH O O N N 206 +HOH H1 H N N 207 +HOH H2 H N N 208 +ILE N N N N 209 +ILE CA C N S 210 +ILE C C N N 211 +ILE O O N N 212 +ILE CB C N S 213 +ILE CG1 C N N 214 +ILE CG2 C N N 215 +ILE CD1 C N N 216 +ILE OXT O N N 217 +ILE H H N N 218 +ILE H2 H N N 219 +ILE HA H N N 220 +ILE HB H N N 221 +ILE HG12 H N N 222 +ILE HG13 H N N 223 +ILE HG21 H N N 224 +ILE HG22 H N N 225 +ILE HG23 H N N 226 +ILE HD11 H N N 227 +ILE HD12 H N N 228 +ILE HD13 H N N 229 +ILE HXT H N N 230 +LEU N N N N 231 +LEU CA C N S 232 +LEU C C N N 233 +LEU O O N N 234 +LEU CB C N N 235 +LEU CG C N N 236 +LEU CD1 C N N 237 +LEU CD2 C N N 238 +LEU OXT O N N 239 +LEU H H N N 240 +LEU H2 H N N 241 +LEU HA H N N 242 +LEU HB2 H N N 243 +LEU HB3 H N N 244 +LEU HG H N N 245 +LEU HD11 H N N 246 +LEU HD12 H N N 247 +LEU HD13 H N N 248 +LEU HD21 H N N 249 +LEU HD22 H N N 250 +LEU HD23 H N N 251 +LEU HXT H N N 252 +LYS N N N N 253 +LYS CA C N S 254 +LYS C C N N 255 +LYS O O N N 256 +LYS CB C N N 257 +LYS CG C N N 258 +LYS CD C N N 259 +LYS CE C N N 260 +LYS NZ N N N 261 +LYS OXT O N N 262 +LYS H H N N 263 +LYS H2 H N N 264 +LYS HA H N N 265 +LYS HB2 H N N 266 +LYS HB3 H N N 267 +LYS HG2 H N N 268 +LYS HG3 H N N 269 +LYS HD2 H N N 270 +LYS HD3 H N N 271 +LYS HE2 H N N 272 +LYS HE3 H N N 273 +LYS HZ1 H N N 274 +LYS HZ2 H N N 275 +LYS HZ3 H N N 276 +LYS HXT H N N 277 +MET N N N N 278 +MET CA C N S 279 +MET C C N N 280 +MET O O N N 281 +MET CB C N N 282 +MET CG C N N 283 +MET SD S N N 284 +MET CE C N N 285 +MET OXT O N N 286 +MET H H N N 287 +MET H2 H N N 288 +MET HA H N N 289 +MET HB2 H N N 290 +MET HB3 H N N 291 +MET HG2 H N N 292 +MET HG3 H N N 293 +MET HE1 H N N 294 +MET HE2 H N N 295 +MET HE3 H N N 296 +MET HXT H N N 297 +PHE N N N N 298 +PHE CA C N S 299 +PHE C C N N 300 +PHE O O N N 301 +PHE CB C N N 302 +PHE CG C Y N 303 +PHE CD1 C Y N 304 +PHE CD2 C Y N 305 +PHE CE1 C Y N 306 +PHE CE2 C Y N 307 +PHE CZ C Y N 308 +PHE OXT O N N 309 +PHE H H N N 310 +PHE H2 H N N 311 +PHE HA H N N 312 +PHE HB2 H N N 313 +PHE HB3 H N N 314 +PHE HD1 H N N 315 +PHE HD2 H N N 316 +PHE HE1 H N N 317 +PHE HE2 H N N 318 +PHE HZ H N N 319 +PHE HXT H N N 320 +PRO N N N N 321 +PRO CA C N S 322 +PRO C C N N 323 +PRO O O N N 324 +PRO CB C N N 325 +PRO CG C N N 326 +PRO CD C N N 327 +PRO OXT O N N 328 +PRO H H N N 329 +PRO HA H N N 330 +PRO HB2 H N N 331 +PRO HB3 H N N 332 +PRO HG2 H N N 333 +PRO HG3 H N N 334 +PRO HD2 H N N 335 +PRO HD3 H N N 336 +PRO HXT H N N 337 +SER N N N N 338 +SER CA C N S 339 +SER C C N N 340 +SER O O N N 341 +SER CB C N N 342 +SER OG O N N 343 +SER OXT O N N 344 +SER H H N N 345 +SER H2 H N N 346 +SER HA H N N 347 +SER HB2 H N N 348 +SER HB3 H N N 349 +SER HG H N N 350 +SER HXT H N N 351 +THR N N N N 352 +THR CA C N S 353 +THR C C N N 354 +THR O O N N 355 +THR CB C N R 356 +THR OG1 O N N 357 +THR CG2 C N N 358 +THR OXT O N N 359 +THR H H N N 360 +THR H2 H N N 361 +THR HA H N N 362 +THR HB H N N 363 +THR HG1 H N N 364 +THR HG21 H N N 365 +THR HG22 H N N 366 +THR HG23 H N N 367 +THR HXT H N N 368 +TRP N N N N 369 +TRP CA C N S 370 +TRP C C N N 371 +TRP O O N N 372 +TRP CB C N N 373 +TRP CG C Y N 374 +TRP CD1 C Y N 375 +TRP CD2 C Y N 376 +TRP NE1 N Y N 377 +TRP CE2 C Y N 378 +TRP CE3 C Y N 379 +TRP CZ2 C Y N 380 +TRP CZ3 C Y N 381 +TRP CH2 C Y N 382 +TRP OXT O N N 383 +TRP H H N N 384 +TRP H2 H N N 385 +TRP HA H N N 386 +TRP HB2 H N N 387 +TRP HB3 H N N 388 +TRP HD1 H N N 389 +TRP HE1 H N N 390 +TRP HE3 H N N 391 +TRP HZ2 H N N 392 +TRP HZ3 H N N 393 +TRP HH2 H N N 394 +TRP HXT H N N 395 +TYR N N N N 396 +TYR CA C N S 397 +TYR C C N N 398 +TYR O O N N 399 +TYR CB C N N 400 +TYR CG C Y N 401 +TYR CD1 C Y N 402 +TYR CD2 C Y N 403 +TYR CE1 C Y N 404 +TYR CE2 C Y N 405 +TYR CZ C Y N 406 +TYR OH O N N 407 +TYR OXT O N N 408 +TYR H H N N 409 +TYR H2 H N N 410 +TYR HA H N N 411 +TYR HB2 H N N 412 +TYR HB3 H N N 413 +TYR HD1 H N N 414 +TYR HD2 H N N 415 +TYR HE1 H N N 416 +TYR HE2 H N N 417 +TYR HH H N N 418 +TYR HXT H N N 419 +VAL N N N N 420 +VAL CA C N S 421 +VAL C C N N 422 +VAL O O N N 423 +VAL CB C N N 424 +VAL CG1 C N N 425 +VAL CG2 C N N 426 +VAL OXT O N N 427 +VAL H H N N 428 +VAL H2 H N N 429 +VAL HA H N N 430 +VAL HB H N N 431 +VAL HG11 H N N 432 +VAL HG12 H N N 433 +VAL HG13 H N N 434 +VAL HG21 H N N 435 +VAL HG22 H N N 436 +VAL HG23 H N N 437 +VAL HXT H N N 438 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +BOG C1 O1 sing N N 70 +BOG C1 C2 sing N N 71 +BOG C1 O5 sing N N 72 +BOG C1 H1 sing N N 73 +BOG O1 "C1'" sing N N 74 +BOG C2 O2 sing N N 75 +BOG C2 C3 sing N N 76 +BOG C2 H2 sing N N 77 +BOG O2 HO2 sing N N 78 +BOG C3 O3 sing N N 79 +BOG C3 C4 sing N N 80 +BOG C3 H3 sing N N 81 +BOG O3 HO3 sing N N 82 +BOG C4 O4 sing N N 83 +BOG C4 C5 sing N N 84 +BOG C4 H4 sing N N 85 +BOG O4 HO4 sing N N 86 +BOG C5 O5 sing N N 87 +BOG C5 C6 sing N N 88 +BOG C5 H5 sing N N 89 +BOG C6 O6 sing N N 90 +BOG C6 H61 sing N N 91 +BOG C6 H62 sing N N 92 +BOG O6 HO6 sing N N 93 +BOG "C1'" "C2'" sing N N 94 +BOG "C1'" "H1'1" sing N N 95 +BOG "C1'" "H1'2" sing N N 96 +BOG "C2'" "C3'" sing N N 97 +BOG "C2'" "H2'1" sing N N 98 +BOG "C2'" "H2'2" sing N N 99 +BOG "C3'" "C4'" sing N N 100 +BOG "C3'" "H3'1" sing N N 101 +BOG "C3'" "H3'2" sing N N 102 +BOG "C4'" "C5'" sing N N 103 +BOG "C4'" "H4'1" sing N N 104 +BOG "C4'" "H4'2" sing N N 105 +BOG "C5'" "C6'" sing N N 106 +BOG "C5'" "H5'1" sing N N 107 +BOG "C5'" "H5'2" sing N N 108 +BOG "C6'" "C7'" sing N N 109 +BOG "C6'" "H6'1" sing N N 110 +BOG "C6'" "H6'2" sing N N 111 +BOG "C7'" "C8'" sing N N 112 +BOG "C7'" "H7'1" sing N N 113 +BOG "C7'" "H7'2" sing N N 114 +BOG "C8'" "H8'1" sing N N 115 +BOG "C8'" "H8'2" sing N N 116 +BOG "C8'" "H8'3" sing N N 117 +CYS N CA sing N N 118 +CYS N H sing N N 119 +CYS N H2 sing N N 120 +CYS CA C sing N N 121 +CYS CA CB sing N N 122 +CYS CA HA sing N N 123 +CYS C O doub N N 124 +CYS C OXT sing N N 125 +CYS CB SG sing N N 126 +CYS CB HB2 sing N N 127 +CYS CB HB3 sing N N 128 +CYS SG HG sing N N 129 +CYS OXT HXT sing N N 130 +GLN N CA sing N N 131 +GLN N H sing N N 132 +GLN N H2 sing N N 133 +GLN CA C sing N N 134 +GLN CA CB sing N N 135 +GLN CA HA sing N N 136 +GLN C O doub N N 137 +GLN C OXT sing N N 138 +GLN CB CG sing N N 139 +GLN CB HB2 sing N N 140 +GLN CB HB3 sing N N 141 +GLN CG CD sing N N 142 +GLN CG HG2 sing N N 143 +GLN CG HG3 sing N N 144 +GLN CD OE1 doub N N 145 +GLN CD NE2 sing N N 146 +GLN NE2 HE21 sing N N 147 +GLN NE2 HE22 sing N N 148 +GLN OXT HXT sing N N 149 +GLU N CA sing N N 150 +GLU N H sing N N 151 +GLU N H2 sing N N 152 +GLU CA C sing N N 153 +GLU CA CB sing N N 154 +GLU CA HA sing N N 155 +GLU C O doub N N 156 +GLU C OXT sing N N 157 +GLU CB CG sing N N 158 +GLU CB HB2 sing N N 159 +GLU CB HB3 sing N N 160 +GLU CG CD sing N N 161 +GLU CG HG2 sing N N 162 +GLU CG HG3 sing N N 163 +GLU CD OE1 doub N N 164 +GLU CD OE2 sing N N 165 +GLU OE2 HE2 sing N N 166 +GLU OXT HXT sing N N 167 +GLY N CA sing N N 168 +GLY N H sing N N 169 +GLY N H2 sing N N 170 +GLY CA C sing N N 171 +GLY CA HA2 sing N N 172 +GLY CA HA3 sing N N 173 +GLY C O doub N N 174 +GLY C OXT sing N N 175 +GLY OXT HXT sing N N 176 +HIS N CA sing N N 177 +HIS N H sing N N 178 +HIS N H2 sing N N 179 +HIS CA C sing N N 180 +HIS CA CB sing N N 181 +HIS CA HA sing N N 182 +HIS C O doub N N 183 +HIS C OXT sing N N 184 +HIS CB CG sing N N 185 +HIS CB HB2 sing N N 186 +HIS CB HB3 sing N N 187 +HIS CG ND1 sing Y N 188 +HIS CG CD2 doub Y N 189 +HIS ND1 CE1 doub Y N 190 +HIS ND1 HD1 sing N N 191 +HIS CD2 NE2 sing Y N 192 +HIS CD2 HD2 sing N N 193 +HIS CE1 NE2 sing Y N 194 +HIS CE1 HE1 sing N N 195 +HIS NE2 HE2 sing N N 196 +HIS OXT HXT sing N N 197 +HOH O H1 sing N N 198 +HOH O H2 sing N N 199 +ILE N CA sing N N 200 +ILE N H sing N N 201 +ILE N H2 sing N N 202 +ILE CA C sing N N 203 +ILE CA CB sing N N 204 +ILE CA HA sing N N 205 +ILE C O doub N N 206 +ILE C OXT sing N N 207 +ILE CB CG1 sing N N 208 +ILE CB CG2 sing N N 209 +ILE CB HB sing N N 210 +ILE CG1 CD1 sing N N 211 +ILE CG1 HG12 sing N N 212 +ILE CG1 HG13 sing N N 213 +ILE CG2 HG21 sing N N 214 +ILE CG2 HG22 sing N N 215 +ILE CG2 HG23 sing N N 216 +ILE CD1 HD11 sing N N 217 +ILE CD1 HD12 sing N N 218 +ILE CD1 HD13 sing N N 219 +ILE OXT HXT sing N N 220 +LEU N CA sing N N 221 +LEU N H sing N N 222 +LEU N H2 sing N N 223 +LEU CA C sing N N 224 +LEU CA CB sing N N 225 +LEU CA HA sing N N 226 +LEU C O doub N N 227 +LEU C OXT sing N N 228 +LEU CB CG sing N N 229 +LEU CB HB2 sing N N 230 +LEU CB HB3 sing N N 231 +LEU CG CD1 sing N N 232 +LEU CG CD2 sing N N 233 +LEU CG HG sing N N 234 +LEU CD1 HD11 sing N N 235 +LEU CD1 HD12 sing N N 236 +LEU CD1 HD13 sing N N 237 +LEU CD2 HD21 sing N N 238 +LEU CD2 HD22 sing N N 239 +LEU CD2 HD23 sing N N 240 +LEU OXT HXT sing N N 241 +LYS N CA sing N N 242 +LYS N H sing N N 243 +LYS N H2 sing N N 244 +LYS CA C sing N N 245 +LYS CA CB sing N N 246 +LYS CA HA sing N N 247 +LYS C O doub N N 248 +LYS C OXT sing N N 249 +LYS CB CG sing N N 250 +LYS CB HB2 sing N N 251 +LYS CB HB3 sing N N 252 +LYS CG CD sing N N 253 +LYS CG HG2 sing N N 254 +LYS CG HG3 sing N N 255 +LYS CD CE sing N N 256 +LYS CD HD2 sing N N 257 +LYS CD HD3 sing N N 258 +LYS CE NZ sing N N 259 +LYS CE HE2 sing N N 260 +LYS CE HE3 sing N N 261 +LYS NZ HZ1 sing N N 262 +LYS NZ HZ2 sing N N 263 +LYS NZ HZ3 sing N N 264 +LYS OXT HXT sing N N 265 +MET N CA sing N N 266 +MET N H sing N N 267 +MET N H2 sing N N 268 +MET CA C sing N N 269 +MET CA CB sing N N 270 +MET CA HA sing N N 271 +MET C O doub N N 272 +MET C OXT sing N N 273 +MET CB CG sing N N 274 +MET CB HB2 sing N N 275 +MET CB HB3 sing N N 276 +MET CG SD sing N N 277 +MET CG HG2 sing N N 278 +MET CG HG3 sing N N 279 +MET SD CE sing N N 280 +MET CE HE1 sing N N 281 +MET CE HE2 sing N N 282 +MET CE HE3 sing N N 283 +MET OXT HXT sing N N 284 +PHE N CA sing N N 285 +PHE N H sing N N 286 +PHE N H2 sing N N 287 +PHE CA C sing N N 288 +PHE CA CB sing N N 289 +PHE CA HA sing N N 290 +PHE C O doub N N 291 +PHE C OXT sing N N 292 +PHE CB CG sing N N 293 +PHE CB HB2 sing N N 294 +PHE CB HB3 sing N N 295 +PHE CG CD1 doub Y N 296 +PHE CG CD2 sing Y N 297 +PHE CD1 CE1 sing Y N 298 +PHE CD1 HD1 sing N N 299 +PHE CD2 CE2 doub Y N 300 +PHE CD2 HD2 sing N N 301 +PHE CE1 CZ doub Y N 302 +PHE CE1 HE1 sing N N 303 +PHE CE2 CZ sing Y N 304 +PHE CE2 HE2 sing N N 305 +PHE CZ HZ sing N N 306 +PHE OXT HXT sing N N 307 +PRO N CA sing N N 308 +PRO N CD sing N N 309 +PRO N H sing N N 310 +PRO CA C sing N N 311 +PRO CA CB sing N N 312 +PRO CA HA sing N N 313 +PRO C O doub N N 314 +PRO C OXT sing N N 315 +PRO CB CG sing N N 316 +PRO CB HB2 sing N N 317 +PRO CB HB3 sing N N 318 +PRO CG CD sing N N 319 +PRO CG HG2 sing N N 320 +PRO CG HG3 sing N N 321 +PRO CD HD2 sing N N 322 +PRO CD HD3 sing N N 323 +PRO OXT HXT sing N N 324 +SER N CA sing N N 325 +SER N H sing N N 326 +SER N H2 sing N N 327 +SER CA C sing N N 328 +SER CA CB sing N N 329 +SER CA HA sing N N 330 +SER C O doub N N 331 +SER C OXT sing N N 332 +SER CB OG sing N N 333 +SER CB HB2 sing N N 334 +SER CB HB3 sing N N 335 +SER OG HG sing N N 336 +SER OXT HXT sing N N 337 +THR N CA sing N N 338 +THR N H sing N N 339 +THR N H2 sing N N 340 +THR CA C sing N N 341 +THR CA CB sing N N 342 +THR CA HA sing N N 343 +THR C O doub N N 344 +THR C OXT sing N N 345 +THR CB OG1 sing N N 346 +THR CB CG2 sing N N 347 +THR CB HB sing N N 348 +THR OG1 HG1 sing N N 349 +THR CG2 HG21 sing N N 350 +THR CG2 HG22 sing N N 351 +THR CG2 HG23 sing N N 352 +THR OXT HXT sing N N 353 +TRP N CA sing N N 354 +TRP N H sing N N 355 +TRP N H2 sing N N 356 +TRP CA C sing N N 357 +TRP CA CB sing N N 358 +TRP CA HA sing N N 359 +TRP C O doub N N 360 +TRP C OXT sing N N 361 +TRP CB CG sing N N 362 +TRP CB HB2 sing N N 363 +TRP CB HB3 sing N N 364 +TRP CG CD1 doub Y N 365 +TRP CG CD2 sing Y N 366 +TRP CD1 NE1 sing Y N 367 +TRP CD1 HD1 sing N N 368 +TRP CD2 CE2 doub Y N 369 +TRP CD2 CE3 sing Y N 370 +TRP NE1 CE2 sing Y N 371 +TRP NE1 HE1 sing N N 372 +TRP CE2 CZ2 sing Y N 373 +TRP CE3 CZ3 doub Y N 374 +TRP CE3 HE3 sing N N 375 +TRP CZ2 CH2 doub Y N 376 +TRP CZ2 HZ2 sing N N 377 +TRP CZ3 CH2 sing Y N 378 +TRP CZ3 HZ3 sing N N 379 +TRP CH2 HH2 sing N N 380 +TRP OXT HXT sing N N 381 +TYR N CA sing N N 382 +TYR N H sing N N 383 +TYR N H2 sing N N 384 +TYR CA C sing N N 385 +TYR CA CB sing N N 386 +TYR CA HA sing N N 387 +TYR C O doub N N 388 +TYR C OXT sing N N 389 +TYR CB CG sing N N 390 +TYR CB HB2 sing N N 391 +TYR CB HB3 sing N N 392 +TYR CG CD1 doub Y N 393 +TYR CG CD2 sing Y N 394 +TYR CD1 CE1 sing Y N 395 +TYR CD1 HD1 sing N N 396 +TYR CD2 CE2 doub Y N 397 +TYR CD2 HD2 sing N N 398 +TYR CE1 CZ doub Y N 399 +TYR CE1 HE1 sing N N 400 +TYR CE2 CZ sing Y N 401 +TYR CE2 HE2 sing N N 402 +TYR CZ OH sing N N 403 +TYR OH HH sing N N 404 +TYR OXT HXT sing N N 405 +VAL N CA sing N N 406 +VAL N H sing N N 407 +VAL N H2 sing N N 408 +VAL CA C sing N N 409 +VAL CA CB sing N N 410 +VAL CA HA sing N N 411 +VAL C O doub N N 412 +VAL C OXT sing N N 413 +VAL CB CG1 sing N N 414 +VAL CB CG2 sing N N 415 +VAL CB HB sing N N 416 +VAL CG1 HG11 sing N N 417 +VAL CG1 HG12 sing N N 418 +VAL CG1 HG13 sing N N 419 +VAL CG2 HG21 sing N N 420 +VAL CG2 HG22 sing N N 421 +VAL CG2 HG23 sing N N 422 +VAL OXT HXT sing N N 423 +# +_pdbx_chem_comp_identifier.comp_id BOG +_pdbx_chem_comp_identifier.type 'IUPAC CARBOHYDRATE SYMBOL' +_pdbx_chem_comp_identifier.program PDB-CARE +_pdbx_chem_comp_identifier.program_version 1.0 +_pdbx_chem_comp_identifier.identifier b-octylglucoside +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +2 'octyl beta-D-glucopyranoside' BOG +3 water HOH +# +_pdbx_initial_refinement_model.id 1 +_pdbx_initial_refinement_model.entity_id_list ? +_pdbx_initial_refinement_model.type 'experimental model' +_pdbx_initial_refinement_model.source_name PDB +_pdbx_initial_refinement_model.accession_code 2G3M +_pdbx_initial_refinement_model.details 'A trimmed version of the trimer in PDB code 2G3M' +# diff --git a/tests/resources/3bdi.cif b/tests/resources/3bdi.cif new file mode 100644 index 0000000..536d075 --- /dev/null +++ b/tests/resources/3bdi.cif @@ -0,0 +1,4540 @@ +data_3BDI +# +_entry.id 3BDI +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.399 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 3BDI pdb_00003bdi 10.2210/pdb3bdi/pdb +RCSB RCSB045385 ? ? +WWPDB D_1000045385 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2007-11-27 +2 'Structure model' 1 1 2011-07-13 +3 'Structure model' 1 2 2017-10-25 +4 'Structure model' 1 3 2019-07-24 +5 'Structure model' 1 4 2023-01-25 +6 'Structure model' 1 5 2024-11-20 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' Advisory +2 2 'Structure model' 'Version format compliance' +3 3 'Structure model' 'Refinement description' +4 4 'Structure model' 'Data collection' +5 4 'Structure model' 'Derived calculations' +6 4 'Structure model' 'Refinement description' +7 5 'Structure model' 'Database references' +8 5 'Structure model' 'Derived calculations' +9 6 'Structure model' 'Data collection' +10 6 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 3 'Structure model' software +2 4 'Structure model' software +3 4 'Structure model' struct_conn +4 5 'Structure model' database_2 +5 5 'Structure model' struct_ref_seq_dif +6 5 'Structure model' struct_site +7 6 'Structure model' chem_comp_atom +8 6 'Structure model' chem_comp_bond +9 6 'Structure model' pdbx_entry_details +10 6 'Structure model' pdbx_modification_feature +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 3 'Structure model' '_software.classification' +2 3 'Structure model' '_software.name' +3 4 'Structure model' '_software.classification' +4 4 'Structure model' '_software.contact_author' +5 4 'Structure model' '_software.contact_author_email' +6 4 'Structure model' '_software.language' +7 4 'Structure model' '_software.location' +8 4 'Structure model' '_software.name' +9 4 'Structure model' '_software.type' +10 4 'Structure model' '_software.version' +11 4 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +12 5 'Structure model' '_database_2.pdbx_DOI' +13 5 'Structure model' '_database_2.pdbx_database_accession' +14 5 'Structure model' '_struct_ref_seq_dif.details' +15 5 'Structure model' '_struct_site.pdbx_auth_asym_id' +16 5 'Structure model' '_struct_site.pdbx_auth_comp_id' +17 5 'Structure model' '_struct_site.pdbx_auth_seq_id' +18 6 'Structure model' '_pdbx_entry_details.has_protein_modification' +# +_pdbx_database_status.SG_entry Y +_pdbx_database_status.entry_id 3BDI +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.recvd_initial_deposition_date 2007-11-14 +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.status_code_nmr_data ? +# +_pdbx_database_related.db_name TargetDB +_pdbx_database_related.db_id 388819 +_pdbx_database_related.details . +_pdbx_database_related.content_type unspecified +# +_audit_author.name 'Joint Center for Structural Genomics (JCSG)' +_audit_author.pdbx_ordinal 1 +# +_citation.id primary +_citation.title +'Crystal structure of predicted CIB-like hydrolase (NP_393672.1) from Thermoplasma acidophilum at 1.45 A resolution' +_citation.journal_abbrev 'To be published' +_citation.journal_volume ? +_citation.page_first ? +_citation.page_last ? +_citation.year ? +_citation.journal_id_ASTM ? +_citation.country ? +_citation.journal_id_ISSN ? +_citation.journal_id_CSD 0353 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed ? +_citation.pdbx_database_id_DOI ? +# +_citation_author.citation_id primary +_citation_author.name 'Joint Center for Structural Genomics (JCSG)' +_citation_author.ordinal 1 +_citation_author.identifier_ORCID ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Uncharacterized protein Ta0194' 23516.635 1 ? ? ? ? +2 non-polymer syn 'DI(HYDROXYETHYL)ETHER' 106.120 3 ? ? ? ? +3 water nat water 18.015 203 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer yes +_entity_poly.pdbx_seq_one_letter_code +;G(MSE)ALQEEFIDVNGTRVFQRK(MSE)VTDSNRRSIALFHGYSFTS(MSE)DWDKADLFNNYSKIGYNVYAPDYPGFG +RSASSEKYGIDRGDLKHAAEFIRDYLKANGVARSVI(MSE)GAS(MSE)GGG(MSE)VI(MSE)TTLQYPDIVDGIIAVA +PAWVESLKGD(MSE)KKIRQKTLLVWGSKDHVVPIALSKEYASIISGSRLEIVEGSGHPVYIEKPEEFVRITVDFLRNL +; +_entity_poly.pdbx_seq_one_letter_code_can +;GMALQEEFIDVNGTRVFQRKMVTDSNRRSIALFHGYSFTSMDWDKADLFNNYSKIGYNVYAPDYPGFGRSASSEKYGIDR +GDLKHAAEFIRDYLKANGVARSVIMGASMGGGMVIMTTLQYPDIVDGIIAVAPAWVESLKGDMKKIRQKTLLVWGSKDHV +VPIALSKEYASIISGSRLEIVEGSGHPVYIEKPEEFVRITVDFLRNL +; +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier 388819 +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +2 'DI(HYDROXYETHYL)ETHER' PEG +3 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 GLY n +1 2 MSE n +1 3 ALA n +1 4 LEU n +1 5 GLN n +1 6 GLU n +1 7 GLU n +1 8 PHE n +1 9 ILE n +1 10 ASP n +1 11 VAL n +1 12 ASN n +1 13 GLY n +1 14 THR n +1 15 ARG n +1 16 VAL n +1 17 PHE n +1 18 GLN n +1 19 ARG n +1 20 LYS n +1 21 MSE n +1 22 VAL n +1 23 THR n +1 24 ASP n +1 25 SER n +1 26 ASN n +1 27 ARG n +1 28 ARG n +1 29 SER n +1 30 ILE n +1 31 ALA n +1 32 LEU n +1 33 PHE n +1 34 HIS n +1 35 GLY n +1 36 TYR n +1 37 SER n +1 38 PHE n +1 39 THR n +1 40 SER n +1 41 MSE n +1 42 ASP n +1 43 TRP n +1 44 ASP n +1 45 LYS n +1 46 ALA n +1 47 ASP n +1 48 LEU n +1 49 PHE n +1 50 ASN n +1 51 ASN n +1 52 TYR n +1 53 SER n +1 54 LYS n +1 55 ILE n +1 56 GLY n +1 57 TYR n +1 58 ASN n +1 59 VAL n +1 60 TYR n +1 61 ALA n +1 62 PRO n +1 63 ASP n +1 64 TYR n +1 65 PRO n +1 66 GLY n +1 67 PHE n +1 68 GLY n +1 69 ARG n +1 70 SER n +1 71 ALA n +1 72 SER n +1 73 SER n +1 74 GLU n +1 75 LYS n +1 76 TYR n +1 77 GLY n +1 78 ILE n +1 79 ASP n +1 80 ARG n +1 81 GLY n +1 82 ASP n +1 83 LEU n +1 84 LYS n +1 85 HIS n +1 86 ALA n +1 87 ALA n +1 88 GLU n +1 89 PHE n +1 90 ILE n +1 91 ARG n +1 92 ASP n +1 93 TYR n +1 94 LEU n +1 95 LYS n +1 96 ALA n +1 97 ASN n +1 98 GLY n +1 99 VAL n +1 100 ALA n +1 101 ARG n +1 102 SER n +1 103 VAL n +1 104 ILE n +1 105 MSE n +1 106 GLY n +1 107 ALA n +1 108 SER n +1 109 MSE n +1 110 GLY n +1 111 GLY n +1 112 GLY n +1 113 MSE n +1 114 VAL n +1 115 ILE n +1 116 MSE n +1 117 THR n +1 118 THR n +1 119 LEU n +1 120 GLN n +1 121 TYR n +1 122 PRO n +1 123 ASP n +1 124 ILE n +1 125 VAL n +1 126 ASP n +1 127 GLY n +1 128 ILE n +1 129 ILE n +1 130 ALA n +1 131 VAL n +1 132 ALA n +1 133 PRO n +1 134 ALA n +1 135 TRP n +1 136 VAL n +1 137 GLU n +1 138 SER n +1 139 LEU n +1 140 LYS n +1 141 GLY n +1 142 ASP n +1 143 MSE n +1 144 LYS n +1 145 LYS n +1 146 ILE n +1 147 ARG n +1 148 GLN n +1 149 LYS n +1 150 THR n +1 151 LEU n +1 152 LEU n +1 153 VAL n +1 154 TRP n +1 155 GLY n +1 156 SER n +1 157 LYS n +1 158 ASP n +1 159 HIS n +1 160 VAL n +1 161 VAL n +1 162 PRO n +1 163 ILE n +1 164 ALA n +1 165 LEU n +1 166 SER n +1 167 LYS n +1 168 GLU n +1 169 TYR n +1 170 ALA n +1 171 SER n +1 172 ILE n +1 173 ILE n +1 174 SER n +1 175 GLY n +1 176 SER n +1 177 ARG n +1 178 LEU n +1 179 GLU n +1 180 ILE n +1 181 VAL n +1 182 GLU n +1 183 GLY n +1 184 SER n +1 185 GLY n +1 186 HIS n +1 187 PRO n +1 188 VAL n +1 189 TYR n +1 190 ILE n +1 191 GLU n +1 192 LYS n +1 193 PRO n +1 194 GLU n +1 195 GLU n +1 196 PHE n +1 197 VAL n +1 198 ARG n +1 199 ILE n +1 200 THR n +1 201 VAL n +1 202 ASP n +1 203 PHE n +1 204 LEU n +1 205 ARG n +1 206 ASN n +1 207 LEU n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus Thermoplasma +_entity_src_gen.pdbx_gene_src_gene 'NP_393672.1, Ta0194' +_entity_src_gen.gene_src_species 'Thermoplasma acidophilum' +_entity_src_gen.gene_src_strain 'DSM 1728, AMRC-C165, IFO 15155, JCM 9062' +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Thermoplasma acidophilum DSM 1728' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 273075 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc 25905 +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 +_entity_src_gen.host_org_genus Escherichia +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain HK100 +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type Plasmid +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name speedET +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MSE 'L-peptide linking' n SELENOMETHIONINE ? 'C5 H11 N O2 Se' 196.106 +PEG non-polymer . 'DI(HYDROXYETHYL)ETHER' ? 'C4 H10 O3' 106.120 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 GLY 1 0 0 GLY GLY A . n +A 1 2 MSE 2 1 1 MSE MSE A . n +A 1 3 ALA 3 2 2 ALA ALA A . n +A 1 4 LEU 4 3 3 LEU LEU A . n +A 1 5 GLN 5 4 4 GLN GLN A . n +A 1 6 GLU 6 5 5 GLU GLU A . n +A 1 7 GLU 7 6 6 GLU GLU A . n +A 1 8 PHE 8 7 7 PHE PHE A . n +A 1 9 ILE 9 8 8 ILE ILE A . n +A 1 10 ASP 10 9 9 ASP ASP A . n +A 1 11 VAL 11 10 10 VAL VAL A . n +A 1 12 ASN 12 11 11 ASN ASN A . n +A 1 13 GLY 13 12 12 GLY GLY A . n +A 1 14 THR 14 13 13 THR THR A . n +A 1 15 ARG 15 14 14 ARG ARG A . n +A 1 16 VAL 16 15 15 VAL VAL A . n +A 1 17 PHE 17 16 16 PHE PHE A . n +A 1 18 GLN 18 17 17 GLN GLN A . n +A 1 19 ARG 19 18 18 ARG ARG A . n +A 1 20 LYS 20 19 19 LYS LYS A . n +A 1 21 MSE 21 20 20 MSE MSE A . n +A 1 22 VAL 22 21 21 VAL VAL A . n +A 1 23 THR 23 22 22 THR THR A . n +A 1 24 ASP 24 23 23 ASP ASP A . n +A 1 25 SER 25 24 24 SER SER A . n +A 1 26 ASN 26 25 25 ASN ASN A . n +A 1 27 ARG 27 26 26 ARG ARG A . n +A 1 28 ARG 28 27 27 ARG ARG A . n +A 1 29 SER 29 28 28 SER SER A . n +A 1 30 ILE 30 29 29 ILE ILE A . n +A 1 31 ALA 31 30 30 ALA ALA A . n +A 1 32 LEU 32 31 31 LEU LEU A . n +A 1 33 PHE 33 32 32 PHE PHE A . n +A 1 34 HIS 34 33 33 HIS HIS A . n +A 1 35 GLY 35 34 34 GLY GLY A . n +A 1 36 TYR 36 35 35 TYR TYR A . n +A 1 37 SER 37 36 36 SER SER A . n +A 1 38 PHE 38 37 37 PHE PHE A . n +A 1 39 THR 39 38 38 THR THR A . n +A 1 40 SER 40 39 39 SER SER A . n +A 1 41 MSE 41 40 40 MSE MSE A . n +A 1 42 ASP 42 41 41 ASP ASP A . n +A 1 43 TRP 43 42 42 TRP TRP A . n +A 1 44 ASP 44 43 43 ASP ASP A . n +A 1 45 LYS 45 44 44 LYS LYS A . n +A 1 46 ALA 46 45 45 ALA ALA A . n +A 1 47 ASP 47 46 46 ASP ASP A . n +A 1 48 LEU 48 47 47 LEU LEU A . n +A 1 49 PHE 49 48 48 PHE PHE A . n +A 1 50 ASN 50 49 49 ASN ASN A . n +A 1 51 ASN 51 50 50 ASN ASN A . n +A 1 52 TYR 52 51 51 TYR TYR A . n +A 1 53 SER 53 52 52 SER SER A . n +A 1 54 LYS 54 53 53 LYS LYS A . n +A 1 55 ILE 55 54 54 ILE ILE A . n +A 1 56 GLY 56 55 55 GLY GLY A . n +A 1 57 TYR 57 56 56 TYR TYR A . n +A 1 58 ASN 58 57 57 ASN ASN A . n +A 1 59 VAL 59 58 58 VAL VAL A . n +A 1 60 TYR 60 59 59 TYR TYR A . n +A 1 61 ALA 61 60 60 ALA ALA A . n +A 1 62 PRO 62 61 61 PRO PRO A . n +A 1 63 ASP 63 62 62 ASP ASP A . n +A 1 64 TYR 64 63 63 TYR TYR A . n +A 1 65 PRO 65 64 64 PRO PRO A . n +A 1 66 GLY 66 65 65 GLY GLY A . n +A 1 67 PHE 67 66 66 PHE PHE A . n +A 1 68 GLY 68 67 67 GLY GLY A . n +A 1 69 ARG 69 68 68 ARG ARG A . n +A 1 70 SER 70 69 69 SER SER A . n +A 1 71 ALA 71 70 70 ALA ALA A . n +A 1 72 SER 72 71 71 SER SER A . n +A 1 73 SER 73 72 72 SER SER A . n +A 1 74 GLU 74 73 73 GLU GLU A . n +A 1 75 LYS 75 74 74 LYS LYS A . n +A 1 76 TYR 76 75 75 TYR TYR A . n +A 1 77 GLY 77 76 76 GLY GLY A . n +A 1 78 ILE 78 77 77 ILE ILE A . n +A 1 79 ASP 79 78 78 ASP ASP A . n +A 1 80 ARG 80 79 79 ARG ARG A . n +A 1 81 GLY 81 80 80 GLY GLY A . n +A 1 82 ASP 82 81 81 ASP ASP A . n +A 1 83 LEU 83 82 82 LEU LEU A . n +A 1 84 LYS 84 83 83 LYS LYS A . n +A 1 85 HIS 85 84 84 HIS HIS A . n +A 1 86 ALA 86 85 85 ALA ALA A . n +A 1 87 ALA 87 86 86 ALA ALA A . n +A 1 88 GLU 88 87 87 GLU GLU A . n +A 1 89 PHE 89 88 88 PHE PHE A . n +A 1 90 ILE 90 89 89 ILE ILE A . n +A 1 91 ARG 91 90 90 ARG ARG A . n +A 1 92 ASP 92 91 91 ASP ASP A . n +A 1 93 TYR 93 92 92 TYR TYR A . n +A 1 94 LEU 94 93 93 LEU LEU A . n +A 1 95 LYS 95 94 94 LYS LYS A . n +A 1 96 ALA 96 95 95 ALA ALA A . n +A 1 97 ASN 97 96 96 ASN ASN A . n +A 1 98 GLY 98 97 97 GLY GLY A . n +A 1 99 VAL 99 98 98 VAL VAL A . n +A 1 100 ALA 100 99 99 ALA ALA A . n +A 1 101 ARG 101 100 100 ARG ARG A . n +A 1 102 SER 102 101 101 SER SER A . n +A 1 103 VAL 103 102 102 VAL VAL A . n +A 1 104 ILE 104 103 103 ILE ILE A . n +A 1 105 MSE 105 104 104 MSE MSE A . n +A 1 106 GLY 106 105 105 GLY GLY A . n +A 1 107 ALA 107 106 106 ALA ALA A . n +A 1 108 SER 108 107 107 SER SER A . n +A 1 109 MSE 109 108 108 MSE MSE A . n +A 1 110 GLY 110 109 109 GLY GLY A . n +A 1 111 GLY 111 110 110 GLY GLY A . n +A 1 112 GLY 112 111 111 GLY GLY A . n +A 1 113 MSE 113 112 112 MSE MSE A . n +A 1 114 VAL 114 113 113 VAL VAL A . n +A 1 115 ILE 115 114 114 ILE ILE A . n +A 1 116 MSE 116 115 115 MSE MSE A . n +A 1 117 THR 117 116 116 THR THR A . n +A 1 118 THR 118 117 117 THR THR A . n +A 1 119 LEU 119 118 118 LEU LEU A . n +A 1 120 GLN 120 119 119 GLN GLN A . n +A 1 121 TYR 121 120 120 TYR TYR A . n +A 1 122 PRO 122 121 121 PRO PRO A . n +A 1 123 ASP 123 122 122 ASP ASP A . n +A 1 124 ILE 124 123 123 ILE ILE A . n +A 1 125 VAL 125 124 124 VAL VAL A . n +A 1 126 ASP 126 125 125 ASP ASP A . n +A 1 127 GLY 127 126 126 GLY GLY A . n +A 1 128 ILE 128 127 127 ILE ILE A . n +A 1 129 ILE 129 128 128 ILE ILE A . n +A 1 130 ALA 130 129 129 ALA ALA A . n +A 1 131 VAL 131 130 130 VAL VAL A . n +A 1 132 ALA 132 131 131 ALA ALA A . n +A 1 133 PRO 133 132 132 PRO PRO A . n +A 1 134 ALA 134 133 133 ALA ALA A . n +A 1 135 TRP 135 134 134 TRP TRP A . n +A 1 136 VAL 136 135 135 VAL VAL A . n +A 1 137 GLU 137 136 136 GLU GLU A . n +A 1 138 SER 138 137 137 SER SER A . n +A 1 139 LEU 139 138 138 LEU LEU A . n +A 1 140 LYS 140 139 139 LYS LYS A . n +A 1 141 GLY 141 140 140 GLY GLY A . n +A 1 142 ASP 142 141 141 ASP ASP A . n +A 1 143 MSE 143 142 142 MSE MSE A . n +A 1 144 LYS 144 143 143 LYS LYS A . n +A 1 145 LYS 145 144 144 LYS LYS A . n +A 1 146 ILE 146 145 145 ILE ILE A . n +A 1 147 ARG 147 146 146 ARG ARG A . n +A 1 148 GLN 148 147 147 GLN GLN A . n +A 1 149 LYS 149 148 148 LYS LYS A . n +A 1 150 THR 150 149 149 THR THR A . n +A 1 151 LEU 151 150 150 LEU LEU A . n +A 1 152 LEU 152 151 151 LEU LEU A . n +A 1 153 VAL 153 152 152 VAL VAL A . n +A 1 154 TRP 154 153 153 TRP TRP A . n +A 1 155 GLY 155 154 154 GLY GLY A . n +A 1 156 SER 156 155 155 SER SER A . n +A 1 157 LYS 157 156 156 LYS LYS A . n +A 1 158 ASP 158 157 157 ASP ASP A . n +A 1 159 HIS 159 158 158 HIS HIS A . n +A 1 160 VAL 160 159 159 VAL VAL A . n +A 1 161 VAL 161 160 160 VAL VAL A . n +A 1 162 PRO 162 161 161 PRO PRO A . n +A 1 163 ILE 163 162 162 ILE ILE A . n +A 1 164 ALA 164 163 163 ALA ALA A . n +A 1 165 LEU 165 164 164 LEU LEU A . n +A 1 166 SER 166 165 165 SER SER A . n +A 1 167 LYS 167 166 166 LYS LYS A . n +A 1 168 GLU 168 167 167 GLU GLU A . n +A 1 169 TYR 169 168 168 TYR TYR A . n +A 1 170 ALA 170 169 169 ALA ALA A . n +A 1 171 SER 171 170 170 SER SER A . n +A 1 172 ILE 172 171 171 ILE ILE A . n +A 1 173 ILE 173 172 172 ILE ILE A . n +A 1 174 SER 174 173 173 SER SER A . n +A 1 175 GLY 175 174 174 GLY GLY A . n +A 1 176 SER 176 175 175 SER SER A . n +A 1 177 ARG 177 176 176 ARG ARG A . n +A 1 178 LEU 178 177 177 LEU LEU A . n +A 1 179 GLU 179 178 178 GLU GLU A . n +A 1 180 ILE 180 179 179 ILE ILE A . n +A 1 181 VAL 181 180 180 VAL VAL A . n +A 1 182 GLU 182 181 181 GLU GLU A . n +A 1 183 GLY 183 182 182 GLY GLY A . n +A 1 184 SER 184 183 183 SER SER A . n +A 1 185 GLY 185 184 184 GLY GLY A . n +A 1 186 HIS 186 185 185 HIS HIS A . n +A 1 187 PRO 187 186 186 PRO PRO A . n +A 1 188 VAL 188 187 187 VAL VAL A . n +A 1 189 TYR 189 188 188 TYR TYR A . n +A 1 190 ILE 190 189 189 ILE ILE A . n +A 1 191 GLU 191 190 190 GLU GLU A . n +A 1 192 LYS 192 191 191 LYS LYS A . n +A 1 193 PRO 193 192 192 PRO PRO A . n +A 1 194 GLU 194 193 193 GLU GLU A . n +A 1 195 GLU 195 194 194 GLU GLU A . n +A 1 196 PHE 196 195 195 PHE PHE A . n +A 1 197 VAL 197 196 196 VAL VAL A . n +A 1 198 ARG 198 197 197 ARG ARG A . n +A 1 199 ILE 199 198 198 ILE ILE A . n +A 1 200 THR 200 199 199 THR THR A . n +A 1 201 VAL 201 200 200 VAL VAL A . n +A 1 202 ASP 202 201 201 ASP ASP A . n +A 1 203 PHE 203 202 202 PHE PHE A . n +A 1 204 LEU 204 203 203 LEU LEU A . n +A 1 205 ARG 205 204 204 ARG ARG A . n +A 1 206 ASN 206 205 205 ASN ASN A . n +A 1 207 LEU 207 206 206 LEU LEU A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +B 2 PEG 1 207 1 PEG PEG A . +C 2 PEG 1 208 2 PEG PEG A . +D 2 PEG 1 209 3 PEG PEG A . +E 3 HOH 1 210 4 HOH HOH A . +E 3 HOH 2 211 5 HOH HOH A . +E 3 HOH 3 212 6 HOH HOH A . +E 3 HOH 4 213 7 HOH HOH A . +E 3 HOH 5 214 8 HOH HOH A . +E 3 HOH 6 215 9 HOH HOH A . +E 3 HOH 7 216 10 HOH HOH A . +E 3 HOH 8 217 11 HOH HOH A . +E 3 HOH 9 218 12 HOH HOH A . +E 3 HOH 10 219 13 HOH HOH A . +E 3 HOH 11 220 14 HOH HOH A . +E 3 HOH 12 221 15 HOH HOH A . +E 3 HOH 13 222 16 HOH HOH A . +E 3 HOH 14 223 17 HOH HOH A . +E 3 HOH 15 224 18 HOH HOH A . +E 3 HOH 16 225 19 HOH HOH A . +E 3 HOH 17 226 20 HOH HOH A . +E 3 HOH 18 227 21 HOH HOH A . +E 3 HOH 19 228 22 HOH HOH A . +E 3 HOH 20 229 23 HOH HOH A . +E 3 HOH 21 230 24 HOH HOH A . +E 3 HOH 22 231 25 HOH HOH A . +E 3 HOH 23 232 26 HOH HOH A . +E 3 HOH 24 233 27 HOH HOH A . +E 3 HOH 25 234 28 HOH HOH A . +E 3 HOH 26 235 29 HOH HOH A . +E 3 HOH 27 236 30 HOH HOH A . +E 3 HOH 28 237 31 HOH HOH A . +E 3 HOH 29 238 32 HOH HOH A . +E 3 HOH 30 239 33 HOH HOH A . +E 3 HOH 31 240 34 HOH HOH A . +E 3 HOH 32 241 35 HOH HOH A . +E 3 HOH 33 242 36 HOH HOH A . +E 3 HOH 34 243 37 HOH HOH A . +E 3 HOH 35 244 38 HOH HOH A . +E 3 HOH 36 245 39 HOH HOH A . +E 3 HOH 37 246 40 HOH HOH A . +E 3 HOH 38 247 41 HOH HOH A . +E 3 HOH 39 248 42 HOH HOH A . +E 3 HOH 40 249 43 HOH HOH A . +E 3 HOH 41 250 44 HOH HOH A . +E 3 HOH 42 251 45 HOH HOH A . +E 3 HOH 43 252 46 HOH HOH A . +E 3 HOH 44 253 47 HOH HOH A . +E 3 HOH 45 254 48 HOH HOH A . +E 3 HOH 46 255 49 HOH HOH A . +E 3 HOH 47 256 50 HOH HOH A . +E 3 HOH 48 257 51 HOH HOH A . +E 3 HOH 49 258 52 HOH HOH A . +E 3 HOH 50 259 53 HOH HOH A . +E 3 HOH 51 260 54 HOH HOH A . +E 3 HOH 52 261 55 HOH HOH A . +E 3 HOH 53 262 56 HOH HOH A . +E 3 HOH 54 263 57 HOH HOH A . +E 3 HOH 55 264 58 HOH HOH A . +E 3 HOH 56 265 59 HOH HOH A . +E 3 HOH 57 266 60 HOH HOH A . +E 3 HOH 58 267 61 HOH HOH A . +E 3 HOH 59 268 62 HOH HOH A . +E 3 HOH 60 269 63 HOH HOH A . +E 3 HOH 61 270 64 HOH HOH A . +E 3 HOH 62 271 65 HOH HOH A . +E 3 HOH 63 272 66 HOH HOH A . +E 3 HOH 64 273 67 HOH HOH A . +E 3 HOH 65 274 68 HOH HOH A . +E 3 HOH 66 275 69 HOH HOH A . +E 3 HOH 67 276 70 HOH HOH A . +E 3 HOH 68 277 71 HOH HOH A . +E 3 HOH 69 278 72 HOH HOH A . +E 3 HOH 70 279 73 HOH HOH A . +E 3 HOH 71 280 74 HOH HOH A . +E 3 HOH 72 281 75 HOH HOH A . +E 3 HOH 73 282 76 HOH HOH A . +E 3 HOH 74 283 77 HOH HOH A . +E 3 HOH 75 284 78 HOH HOH A . +E 3 HOH 76 285 79 HOH HOH A . +E 3 HOH 77 286 80 HOH HOH A . +E 3 HOH 78 287 81 HOH HOH A . +E 3 HOH 79 288 82 HOH HOH A . +E 3 HOH 80 289 83 HOH HOH A . +E 3 HOH 81 290 84 HOH HOH A . +E 3 HOH 82 291 85 HOH HOH A . +E 3 HOH 83 292 86 HOH HOH A . +E 3 HOH 84 293 87 HOH HOH A . +E 3 HOH 85 294 88 HOH HOH A . +E 3 HOH 86 295 89 HOH HOH A . +E 3 HOH 87 296 90 HOH HOH A . +E 3 HOH 88 297 91 HOH HOH A . +E 3 HOH 89 298 92 HOH HOH A . +E 3 HOH 90 299 93 HOH HOH A . +E 3 HOH 91 300 94 HOH HOH A . +E 3 HOH 92 301 95 HOH HOH A . +E 3 HOH 93 302 96 HOH HOH A . +E 3 HOH 94 303 97 HOH HOH A . +E 3 HOH 95 304 98 HOH HOH A . +E 3 HOH 96 305 99 HOH HOH A . +E 3 HOH 97 306 100 HOH HOH A . +E 3 HOH 98 307 101 HOH HOH A . +E 3 HOH 99 308 102 HOH HOH A . +E 3 HOH 100 309 103 HOH HOH A . +E 3 HOH 101 310 104 HOH HOH A . +E 3 HOH 102 311 105 HOH HOH A . +E 3 HOH 103 312 106 HOH HOH A . +E 3 HOH 104 313 107 HOH HOH A . +E 3 HOH 105 314 108 HOH HOH A . +E 3 HOH 106 315 109 HOH HOH A . +E 3 HOH 107 316 110 HOH HOH A . +E 3 HOH 108 317 111 HOH HOH A . +E 3 HOH 109 318 112 HOH HOH A . +E 3 HOH 110 319 113 HOH HOH A . +E 3 HOH 111 320 114 HOH HOH A . +E 3 HOH 112 321 115 HOH HOH A . +E 3 HOH 113 322 116 HOH HOH A . +E 3 HOH 114 323 117 HOH HOH A . +E 3 HOH 115 324 118 HOH HOH A . +E 3 HOH 116 325 119 HOH HOH A . +E 3 HOH 117 326 120 HOH HOH A . +E 3 HOH 118 327 121 HOH HOH A . +E 3 HOH 119 328 122 HOH HOH A . +E 3 HOH 120 329 123 HOH HOH A . +E 3 HOH 121 330 124 HOH HOH A . +E 3 HOH 122 331 125 HOH HOH A . +E 3 HOH 123 332 126 HOH HOH A . +E 3 HOH 124 333 127 HOH HOH A . +E 3 HOH 125 334 128 HOH HOH A . +E 3 HOH 126 335 129 HOH HOH A . +E 3 HOH 127 336 130 HOH HOH A . +E 3 HOH 128 337 131 HOH HOH A . +E 3 HOH 129 338 132 HOH HOH A . +E 3 HOH 130 339 133 HOH HOH A . +E 3 HOH 131 340 134 HOH HOH A . +E 3 HOH 132 341 135 HOH HOH A . +E 3 HOH 133 342 136 HOH HOH A . +E 3 HOH 134 343 137 HOH HOH A . +E 3 HOH 135 344 138 HOH HOH A . +E 3 HOH 136 345 139 HOH HOH A . +E 3 HOH 137 346 140 HOH HOH A . +E 3 HOH 138 347 141 HOH HOH A . +E 3 HOH 139 348 142 HOH HOH A . +E 3 HOH 140 349 143 HOH HOH A . +E 3 HOH 141 350 144 HOH HOH A . +E 3 HOH 142 351 145 HOH HOH A . +E 3 HOH 143 352 146 HOH HOH A . +E 3 HOH 144 353 147 HOH HOH A . +E 3 HOH 145 354 148 HOH HOH A . +E 3 HOH 146 355 149 HOH HOH A . +E 3 HOH 147 356 150 HOH HOH A . +E 3 HOH 148 357 151 HOH HOH A . +E 3 HOH 149 358 152 HOH HOH A . +E 3 HOH 150 359 153 HOH HOH A . +E 3 HOH 151 360 154 HOH HOH A . +E 3 HOH 152 361 155 HOH HOH A . +E 3 HOH 153 362 156 HOH HOH A . +E 3 HOH 154 363 157 HOH HOH A . +E 3 HOH 155 364 158 HOH HOH A . +E 3 HOH 156 365 159 HOH HOH A . +E 3 HOH 157 366 160 HOH HOH A . +E 3 HOH 158 367 161 HOH HOH A . +E 3 HOH 159 368 162 HOH HOH A . +E 3 HOH 160 369 163 HOH HOH A . +E 3 HOH 161 370 164 HOH HOH A . +E 3 HOH 162 371 165 HOH HOH A . +E 3 HOH 163 372 166 HOH HOH A . +E 3 HOH 164 373 167 HOH HOH A . +E 3 HOH 165 374 168 HOH HOH A . +E 3 HOH 166 375 169 HOH HOH A . +E 3 HOH 167 376 170 HOH HOH A . +E 3 HOH 168 377 171 HOH HOH A . +E 3 HOH 169 378 172 HOH HOH A . +E 3 HOH 170 379 173 HOH HOH A . +E 3 HOH 171 380 174 HOH HOH A . +E 3 HOH 172 381 175 HOH HOH A . +E 3 HOH 173 382 176 HOH HOH A . +E 3 HOH 174 383 177 HOH HOH A . +E 3 HOH 175 384 178 HOH HOH A . +E 3 HOH 176 385 179 HOH HOH A . +E 3 HOH 177 386 180 HOH HOH A . +E 3 HOH 178 387 181 HOH HOH A . +E 3 HOH 179 388 182 HOH HOH A . +E 3 HOH 180 389 183 HOH HOH A . +E 3 HOH 181 390 184 HOH HOH A . +E 3 HOH 182 391 185 HOH HOH A . +E 3 HOH 183 392 186 HOH HOH A . +E 3 HOH 184 393 187 HOH HOH A . +E 3 HOH 185 394 188 HOH HOH A . +E 3 HOH 186 395 189 HOH HOH A . +E 3 HOH 187 396 190 HOH HOH A . +E 3 HOH 188 397 191 HOH HOH A . +E 3 HOH 189 398 192 HOH HOH A . +E 3 HOH 190 399 193 HOH HOH A . +E 3 HOH 191 400 194 HOH HOH A . +E 3 HOH 192 401 195 HOH HOH A . +E 3 HOH 193 402 196 HOH HOH A . +E 3 HOH 194 403 197 HOH HOH A . +E 3 HOH 195 404 198 HOH HOH A . +E 3 HOH 196 405 199 HOH HOH A . +E 3 HOH 197 406 200 HOH HOH A . +E 3 HOH 198 407 201 HOH HOH A . +E 3 HOH 199 408 202 HOH HOH A . +E 3 HOH 200 409 203 HOH HOH A . +E 3 HOH 201 410 204 HOH HOH A . +E 3 HOH 202 411 205 HOH HOH A . +E 3 HOH 203 412 206 HOH HOH A . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A ASP 23 ? CG ? A ASP 24 CG +2 1 Y 1 A ASP 23 ? OD1 ? A ASP 24 OD1 +3 1 Y 1 A ASP 23 ? OD2 ? A ASP 24 OD2 +4 1 Y 1 A ARG 26 ? CD ? A ARG 27 CD +5 1 Y 1 A ARG 26 ? NE ? A ARG 27 NE +6 1 Y 1 A ARG 26 ? CZ ? A ARG 27 CZ +7 1 Y 1 A ARG 26 ? NH1 ? A ARG 27 NH1 +8 1 Y 1 A ARG 26 ? NH2 ? A ARG 27 NH2 +9 1 Y 1 A ARG 27 ? CZ ? A ARG 28 CZ +10 1 Y 1 A ARG 27 ? NH1 ? A ARG 28 NH1 +11 1 Y 1 A ARG 27 ? NH2 ? A ARG 28 NH2 +12 1 Y 1 A LYS 83 ? CE ? A LYS 84 CE +13 1 Y 1 A LYS 83 ? NZ ? A LYS 84 NZ +14 1 Y 1 A LYS 94 ? CE ? A LYS 95 CE +15 1 Y 1 A LYS 94 ? NZ ? A LYS 95 NZ +16 1 Y 1 A ARG 100 ? CD ? A ARG 101 CD +17 1 Y 1 A ARG 100 ? NE ? A ARG 101 NE +18 1 Y 1 A ARG 100 ? CZ ? A ARG 101 CZ +19 1 Y 1 A ARG 100 ? NH1 ? A ARG 101 NH1 +20 1 Y 1 A ARG 100 ? NH2 ? A ARG 101 NH2 +21 1 Y 1 A LYS 144 ? CG ? A LYS 145 CG +22 1 Y 1 A LYS 144 ? CD ? A LYS 145 CD +23 1 Y 1 A LYS 144 ? CE ? A LYS 145 CE +24 1 Y 1 A LYS 144 ? NZ ? A LYS 145 NZ +25 1 Y 1 A ARG 146 ? NH1 ? A ARG 147 NH1 +26 1 Y 1 A ARG 146 ? NH2 ? A ARG 147 NH2 +27 1 Y 1 A LYS 166 ? CD ? A LYS 167 CD +28 1 Y 1 A LYS 166 ? CE ? A LYS 167 CE +29 1 Y 1 A LYS 166 ? NZ ? A LYS 167 NZ +30 1 Y 1 A GLU 193 ? CD ? A GLU 194 CD +31 1 Y 1 A GLU 193 ? OE1 ? A GLU 194 OE1 +32 1 Y 1 A GLU 193 ? OE2 ? A GLU 194 OE2 +# +loop_ +_software.name +_software.version +_software.date +_software.type +_software.contact_author +_software.contact_author_email +_software.classification +_software.location +_software.language +_software.citation_id +_software.pdbx_ordinal +REFMAC 5.2.0019 ? program 'Murshudov, G.N.' ccp4@dl.ac.uk refinement +http://www.ccp4.ac.uk/main.html Fortran_77 ? 1 +PHENIX . ? package 'P.D. Adams' PDAdams@lbl.gov refinement +http://www.phenix-online.org/ C++ ? 2 +SOLVE . ? package 'Tom Terwilliger' terwilliger@LANL.gov phasing +http://www.solve.lanl.gov/ ? ? 3 +MolProbity 3beta29 ? package 'D.C. & J.S. Richardson lab' molprobity@kinemage.biochem.duke.edu 'model building' +http://kinemage.biochem.duke.edu/molprobity/ ? ? 4 +SCALA . ? other 'Phil Evans' pre@mrc-lmb.cam.ac.uk 'data scaling' +http://www.ccp4.ac.uk/dist/html/INDEX.html Fortran_77 ? 5 +PDB_EXTRACT 3.000 'July 2, 2007' package PDB sw-help@rcsb.rutgers.edu 'data extraction' +http://pdb.rutgers.edu/software/ C++ ? 6 +MAR345 CCD ? ? ? ? 'data collection' ? +? ? 7 +MOSFLM . ? ? ? ? 'data reduction' ? +? ? 8 +# +_cell.entry_id 3BDI +_cell.length_a 43.384 +_cell.length_b 46.292 +_cell.length_c 101.644 +_cell.angle_alpha 90.000 +_cell.angle_beta 90.000 +_cell.angle_gamma 90.000 +_cell.pdbx_unique_axis ? +_cell.Z_PDB 4 +_cell.length_a_esd ? +_cell.length_b_esd ? +_cell.length_c_esd ? +_cell.angle_alpha_esd ? +_cell.angle_beta_esd ? +_cell.angle_gamma_esd ? +# +_symmetry.entry_id 3BDI +_symmetry.Int_Tables_number 19 +_symmetry.space_group_name_H-M 'P 21 21 21' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.space_group_name_Hall ? +# +_exptl.crystals_number 1 +_exptl.method 'X-RAY DIFFRACTION' +_exptl.entry_id 3BDI +# +_exptl_crystal.id 1 +_exptl_crystal.density_Matthews 2.17 +_exptl_crystal.density_meas ? +_exptl_crystal.density_percent_sol 43.32 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.preparation ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' +_exptl_crystal_grow.pH 6.5 +_exptl_crystal_grow.temp 293 +_exptl_crystal_grow.pdbx_details +'NANODROP, 5.0% PEG 3000, 44.0% PEG 400, 0.1M MES pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K' +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pdbx_pH_range . +# +_diffrn.id 1 +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'MARMOSAIC 300 mm CCD' +_diffrn_detector.details 'Adjustable focusing mirrors in K-B geometry' +_diffrn_detector.pdbx_collection_date 2007-10-25 +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator 'Si(111) Double crystal' +_diffrn_radiation.pdbx_diffrn_protocol MAD +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_scattering_type x-ray +# +loop_ +_diffrn_radiation_wavelength.id +_diffrn_radiation_wavelength.wavelength +_diffrn_radiation_wavelength.wt +1 0.94939 1.0 +2 0.97939 1.0 +3 0.97953 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.pdbx_synchrotron_beamline 23-ID-D +_diffrn_source.type 'APS BEAMLINE 23-ID-D' +_diffrn_source.pdbx_wavelength_list '0.94939, 0.97939, 0.97953' +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_site APS +# +_reflns.entry_id 3BDI +_reflns.d_resolution_high 1.45 +_reflns.d_resolution_low 27.338 +_reflns.number_obs 37089 +_reflns.pdbx_Rmerge_I_obs 0.087 +_reflns.pdbx_netI_over_sigmaI 3.100 +_reflns.pdbx_Rsym_value 0.087 +_reflns.pdbx_redundancy 3.500 +_reflns.percent_possible_obs 99.900 +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.number_all ? +_reflns.B_iso_Wilson_estimate 12.90 +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_ordinal 1 +_reflns.pdbx_diffrn_id 1 +# +loop_ +_reflns_shell.d_res_high +_reflns_shell.d_res_low +_reflns_shell.number_measured_obs +_reflns_shell.number_measured_all +_reflns_shell.number_unique_obs +_reflns_shell.Rmerge_I_obs +_reflns_shell.meanI_over_sigI_obs +_reflns_shell.pdbx_Rsym_value +_reflns_shell.pdbx_chi_squared +_reflns_shell.pdbx_redundancy +_reflns_shell.percent_possible_obs +_reflns_shell.number_unique_all +_reflns_shell.percent_possible_all +_reflns_shell.pdbx_ordinal +_reflns_shell.pdbx_diffrn_id +1.45 1.49 ? 6659 ? 0.194 3.5 0.194 ? 2.50 ? 2676 99.90 1 1 +1.49 1.53 ? 8367 ? 0.190 3.7 0.190 ? 3.20 ? 2614 100.00 2 1 +1.53 1.57 ? 9280 ? 0.170 4.1 0.170 ? 3.60 ? 2580 100.00 3 1 +1.57 1.62 ? 9007 ? 0.143 4.7 0.143 ? 3.60 ? 2499 100.00 4 1 +1.62 1.67 ? 8776 ? 0.130 5.2 0.130 ? 3.60 ? 2430 100.00 5 1 +1.67 1.73 ? 8416 ? 0.121 5.5 0.121 ? 3.60 ? 2327 100.00 6 1 +1.73 1.80 ? 8194 ? 0.112 5.7 0.112 ? 3.60 ? 2256 100.00 7 1 +1.80 1.87 ? 7941 ? 0.106 6.1 0.106 ? 3.60 ? 2196 100.00 8 1 +1.87 1.96 ? 7503 ? 0.106 6.1 0.106 ? 3.60 ? 2076 100.00 9 1 +1.96 2.05 ? 7380 ? 0.097 6.4 0.097 ? 3.60 ? 2039 100.00 10 1 +2.05 2.16 ? 6853 ? 0.081 7.6 0.081 ? 3.60 ? 1897 100.00 11 1 +2.16 2.29 ? 6637 ? 0.079 8.1 0.079 ? 3.60 ? 1836 100.00 12 1 +2.29 2.45 ? 6222 ? 0.082 7.4 0.082 ? 3.60 ? 1717 100.00 13 1 +2.45 2.65 ? 5662 ? 0.094 6.2 0.094 ? 3.60 ? 1587 100.00 14 1 +2.65 2.90 ? 5340 ? 0.088 5.1 0.088 ? 3.50 ? 1506 100.00 15 1 +2.90 3.24 ? 4720 ? 0.077 7.1 0.077 ? 3.50 ? 1330 100.00 16 1 +3.24 3.74 ? 4275 ? 0.072 6.4 0.072 ? 3.50 ? 1209 100.00 17 1 +3.74 4.59 ? 3641 ? 0.078 5.6 0.078 ? 3.50 ? 1034 99.90 18 1 +4.59 6.48 ? 2745 ? 0.085 5.0 0.085 ? 3.40 ? 808 99.40 19 1 +6.48 27.338 ? 1474 ? 0.096 4.6 0.096 ? 3.10 ? 472 96.90 20 1 +# +_refine.entry_id 3BDI +_refine.ls_d_res_high 1.450 +_refine.ls_d_res_low 27.338 +_refine.pdbx_ls_sigma_F 0.00 +_refine.ls_percent_reflns_obs 99.880 +_refine.ls_number_reflns_obs 37039 +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.pdbx_R_Free_selection_details RANDOM +_refine.details +;1. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. + 2. ATOM RECORD CONTAINS RESIDUAL B FACTORS ONLY. + 3. A MET-INHIBITION PROTOCOL WAS USED FOR SELENOMETHIONINE + INCORPORATION DURING PROTEIN EXPRESSION. THE OCCUPANCY + OF THE SE ATOMS IN THE MSE RESIDUES WAS REDUCED TO 0.75 + TO ACCOUNT FOR THE REDUCED SCATTERING POWER DUE TO PARTIAL + S-MET INCORPORATION. + 4. POLYETHYLENE GLYCOL MOLECULES FROM THE CRYSTALLIZATION + CONDITIONS WERE MODELED. +; +_refine.ls_R_factor_obs 0.164 +_refine.ls_R_factor_R_work 0.163 +_refine.ls_R_factor_R_free 0.189 +_refine.ls_percent_reflns_R_free 5.000 +_refine.ls_number_reflns_R_free 1851 +_refine.B_iso_mean 11.878 +_refine.aniso_B[1][1] 0.780 +_refine.aniso_B[2][2] -0.640 +_refine.aniso_B[3][3] -0.140 +_refine.aniso_B[1][2] 0.000 +_refine.aniso_B[1][3] 0.000 +_refine.aniso_B[2][3] 0.000 +_refine.correlation_coeff_Fo_to_Fc 0.966 +_refine.correlation_coeff_Fo_to_Fc_free 0.951 +_refine.pdbx_overall_ESU_R 0.064 +_refine.pdbx_overall_ESU_R_Free 0.066 +_refine.overall_SU_ML 0.041 +_refine.overall_SU_B 2.094 +_refine.solvent_model_details MASK +_refine.pdbx_solvent_vdw_probe_radii 1.200 +_refine.pdbx_solvent_ion_probe_radii 0.800 +_refine.pdbx_solvent_shrinkage_radii 0.800 +_refine.pdbx_method_to_determine_struct MAD +_refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD WITH PHASES' +_refine.pdbx_ls_sigma_I ? +_refine.ls_number_reflns_all ? +_refine.ls_R_factor_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.pdbx_starting_model ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.pdbx_isotropic_thermal_model ? +_refine.B_iso_min ? +_refine.B_iso_max ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_TLS_residual_ADP_flag 'LIKELY RESIDUAL' +_refine.pdbx_diffrn_id 1 +_refine.pdbx_overall_phase_error ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 1596 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 21 +_refine_hist.number_atoms_solvent 203 +_refine_hist.number_atoms_total 1820 +_refine_hist.d_res_high 1.450 +_refine_hist.d_res_low 27.338 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.number +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +r_bond_refined_d 1779 0.016 0.022 ? 'X-RAY DIFFRACTION' ? +r_bond_other_d 1211 0.001 0.020 ? 'X-RAY DIFFRACTION' ? +r_angle_refined_deg 2414 1.622 1.956 ? 'X-RAY DIFFRACTION' ? +r_angle_other_deg 2953 0.973 3.000 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_1_deg 232 6.481 5.000 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_2_deg 75 40.007 23.867 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_3_deg 301 12.771 15.000 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_4_deg 11 12.993 15.000 ? 'X-RAY DIFFRACTION' ? +r_chiral_restr 260 0.102 0.200 ? 'X-RAY DIFFRACTION' ? +r_gen_planes_refined 2038 0.008 0.020 ? 'X-RAY DIFFRACTION' ? +r_gen_planes_other 373 0.002 0.020 ? 'X-RAY DIFFRACTION' ? +r_nbd_refined 366 0.221 0.200 ? 'X-RAY DIFFRACTION' ? +r_nbd_other 1255 0.196 0.200 ? 'X-RAY DIFFRACTION' ? +r_nbtor_refined 878 0.185 0.200 ? 'X-RAY DIFFRACTION' ? +r_nbtor_other 895 0.086 0.200 ? 'X-RAY DIFFRACTION' ? +r_xyhbond_nbd_refined 154 0.219 0.200 ? 'X-RAY DIFFRACTION' ? +r_symmetry_vdw_refined 8 0.145 0.200 ? 'X-RAY DIFFRACTION' ? +r_symmetry_vdw_other 67 0.292 0.200 ? 'X-RAY DIFFRACTION' ? +r_symmetry_hbond_refined 22 0.115 0.200 ? 'X-RAY DIFFRACTION' ? +r_mcbond_it 1191 1.847 3.000 ? 'X-RAY DIFFRACTION' ? +r_mcbond_other 453 0.478 3.000 ? 'X-RAY DIFFRACTION' ? +r_mcangle_it 1795 2.415 5.000 ? 'X-RAY DIFFRACTION' ? +r_scbond_it 752 3.791 7.000 ? 'X-RAY DIFFRACTION' ? +r_scangle_it 619 4.910 9.000 ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_shell.d_res_high 1.450 +_refine_ls_shell.d_res_low 1.488 +_refine_ls_shell.pdbx_total_number_of_bins_used 20 +_refine_ls_shell.percent_reflns_obs 99.780 +_refine_ls_shell.number_reflns_R_work 2548 +_refine_ls_shell.R_factor_all ? +_refine_ls_shell.R_factor_R_work 0.196 +_refine_ls_shell.R_factor_R_free 0.267 +_refine_ls_shell.percent_reflns_R_free ? +_refine_ls_shell.number_reflns_R_free 127 +_refine_ls_shell.R_factor_R_free_error ? +_refine_ls_shell.number_reflns_all 2675 +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +# +_struct.entry_id 3BDI +_struct.title +'Crystal structure of predicted CIB-like hydrolase (NP_393672.1) from Thermoplasma acidophilum at 1.45 A resolution' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.text +;NP_393672.1, predicted CIB-like hydrolase, Structural Genomics, Joint Center for Structural Genomics, JCSG, Protein Structure Initiative, PSI-2, HYDROLASE +; +_struct_keywords.pdbx_keywords HYDROLASE +_struct_keywords.entry_id 3BDI +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 2 ? +D N N 2 ? +E N N 3 ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code Q9HLN3_THEAC +_struct_ref.pdbx_db_accession Q9HLN3 +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code +;NGTRVFQRKMVTDSNRRSIALFHGYSFTSMDWDKADLFNNYSKIGYNVYAPDYPGFGRSASSEKYGIDRGDLKHAAEFIR +DYLKANGVARSVIMGASMGGGMVIMTTLQYPDIVDGIIAVAPAWVESLKGDMKKIRQKTLLVWGSKDHVVPIALSKEYAS +IISGSRLEIVEGSGHPVYIKKPEEFVRITVDFLRNL +; +_struct_ref.pdbx_align_begin 2 +_struct_ref.pdbx_db_isoform ? +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 3BDI +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 12 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 207 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession Q9HLN3 +_struct_ref_seq.db_align_beg 2 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 197 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 11 +_struct_ref_seq.pdbx_auth_seq_align_end 206 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +1 3BDI GLY A 1 ? UNP Q9HLN3 ? ? 'expression tag' 0 1 +1 3BDI MSE A 2 ? UNP Q9HLN3 ? ? variant 1 2 +1 3BDI ALA A 3 ? UNP Q9HLN3 ? ? variant 2 3 +1 3BDI LEU A 4 ? UNP Q9HLN3 ? ? variant 3 4 +1 3BDI GLN A 5 ? UNP Q9HLN3 ? ? variant 4 5 +1 3BDI GLU A 6 ? UNP Q9HLN3 ? ? variant 5 6 +1 3BDI GLU A 7 ? UNP Q9HLN3 ? ? variant 6 7 +1 3BDI PHE A 8 ? UNP Q9HLN3 ? ? variant 7 8 +1 3BDI ILE A 9 ? UNP Q9HLN3 ? ? variant 8 9 +1 3BDI ASP A 10 ? UNP Q9HLN3 ? ? variant 9 10 +1 3BDI VAL A 11 ? UNP Q9HLN3 ? ? variant 10 11 +1 3BDI GLU A 191 ? UNP Q9HLN3 LYS 181 'SEE REMARK 999' 190 12 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_struct_biol.id 1 +_struct_biol.details ? +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 THR A 39 ? ALA A 46 ? THR A 38 ALA A 45 5 ? 8 +HELX_P HELX_P2 2 ASP A 47 ? LYS A 54 ? ASP A 46 LYS A 53 1 ? 8 +HELX_P HELX_P3 3 ASP A 82 ? ASN A 97 ? ASP A 81 ASN A 96 1 ? 16 +HELX_P HELX_P4 4 SER A 108 ? TYR A 121 ? SER A 107 TYR A 120 1 ? 14 +HELX_P HELX_P5 5 VAL A 136 ? SER A 138 ? VAL A 135 SER A 137 5 ? 3 +HELX_P HELX_P6 6 LEU A 139 ? LYS A 144 ? LEU A 138 LYS A 143 1 ? 6 +HELX_P HELX_P7 7 PRO A 162 ? ILE A 173 ? PRO A 161 ILE A 172 1 ? 12 +HELX_P HELX_P8 8 PRO A 187 ? LYS A 192 ? PRO A 186 LYS A 191 1 ? 6 +HELX_P HELX_P9 9 LYS A 192 ? ASN A 206 ? LYS A 191 ASN A 205 1 ? 15 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +covale1 covale both ? A GLY 1 C ? ? ? 1_555 A MSE 2 N ? ? A GLY 0 A MSE 1 1_555 ? ? ? ? ? ? ? 1.340 ? ? +covale2 covale both ? A MSE 2 C ? ? ? 1_555 A ALA 3 N ? ? A MSE 1 A ALA 2 1_555 ? ? ? ? ? ? ? 1.333 ? ? +covale3 covale both ? A LYS 20 C ? ? ? 1_555 A MSE 21 N ? ? A LYS 19 A MSE 20 1_555 ? ? ? ? ? ? ? 1.327 ? ? +covale4 covale both ? A MSE 21 C ? ? ? 1_555 A VAL 22 N ? ? A MSE 20 A VAL 21 1_555 ? ? ? ? ? ? ? 1.321 ? ? +covale5 covale both ? A SER 40 C ? ? ? 1_555 A MSE 41 N ? ? A SER 39 A MSE 40 1_555 ? ? ? ? ? ? ? 1.340 ? ? +covale6 covale both ? A MSE 41 C ? ? ? 1_555 A ASP 42 N ? ? A MSE 40 A ASP 41 1_555 ? ? ? ? ? ? ? 1.327 ? ? +covale7 covale both ? A ILE 104 C ? ? ? 1_555 A MSE 105 N A ? A ILE 103 A MSE 104 1_555 ? ? ? ? ? ? ? 1.325 ? ? +covale8 covale both ? A ILE 104 C ? ? ? 1_555 A MSE 105 N B ? A ILE 103 A MSE 104 1_555 ? ? ? ? ? ? ? 1.333 ? ? +covale9 covale both ? A MSE 105 C A ? ? 1_555 A GLY 106 N ? ? A MSE 104 A GLY 105 1_555 ? ? ? ? ? ? ? 1.326 ? ? +covale10 covale both ? A MSE 105 C B ? ? 1_555 A GLY 106 N ? ? A MSE 104 A GLY 105 1_555 ? ? ? ? ? ? ? 1.334 ? ? +covale11 covale both ? A SER 108 C ? ? ? 1_555 A MSE 109 N A ? A SER 107 A MSE 108 1_555 ? ? ? ? ? ? ? 1.329 ? ? +covale12 covale both ? A SER 108 C ? ? ? 1_555 A MSE 109 N B ? A SER 107 A MSE 108 1_555 ? ? ? ? ? ? ? 1.342 ? ? +covale13 covale both ? A MSE 109 C A ? ? 1_555 A GLY 110 N ? ? A MSE 108 A GLY 109 1_555 ? ? ? ? ? ? ? 1.342 ? ? +covale14 covale both ? A MSE 109 C B ? ? 1_555 A GLY 110 N ? ? A MSE 108 A GLY 109 1_555 ? ? ? ? ? ? ? 1.331 ? ? +covale15 covale both ? A GLY 112 C ? ? ? 1_555 A MSE 113 N ? ? A GLY 111 A MSE 112 1_555 ? ? ? ? ? ? ? 1.328 ? ? +covale16 covale both ? A MSE 113 C ? ? ? 1_555 A VAL 114 N ? ? A MSE 112 A VAL 113 1_555 ? ? ? ? ? ? ? 1.342 ? ? +covale17 covale both ? A ILE 115 C ? ? ? 1_555 A MSE 116 N ? ? A ILE 114 A MSE 115 1_555 ? ? ? ? ? ? ? 1.324 ? ? +covale18 covale both ? A MSE 116 C ? ? ? 1_555 A THR 117 N ? ? A MSE 115 A THR 116 1_555 ? ? ? ? ? ? ? 1.319 ? ? +covale19 covale both ? A ASP 142 C ? ? ? 1_555 A MSE 143 N ? ? A ASP 141 A MSE 142 1_555 ? ? ? ? ? ? ? 1.330 ? ? +covale20 covale both ? A MSE 143 C ? ? ? 1_555 A LYS 144 N ? ? A MSE 142 A LYS 143 1_555 ? ? ? ? ? ? ? 1.346 ? ? +# +_struct_conn_type.id covale +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 MSE A 2 ? . . . . MSE A 1 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +2 MSE A 21 ? . . . . MSE A 20 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +3 MSE A 41 ? . . . . MSE A 40 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +4 MSE A 105 A . . . . MSE A 104 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +5 MSE A 105 B . . . . MSE A 104 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +6 MSE A 109 A . . . . MSE A 108 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +7 MSE A 109 B . . . . MSE A 108 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +8 MSE A 113 ? . . . . MSE A 112 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +9 MSE A 116 ? . . . . MSE A 115 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +10 MSE A 143 ? . . . . MSE A 142 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +# +_struct_sheet.id A +_struct_sheet.type ? +_struct_sheet.number_strands 8 +_struct_sheet.details ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? parallel +A 4 5 ? parallel +A 5 6 ? parallel +A 6 7 ? parallel +A 7 8 ? parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 GLN A 5 ? VAL A 11 ? GLN A 4 VAL A 10 +A 2 THR A 14 ? MSE A 21 ? THR A 13 MSE A 20 +A 3 TYR A 57 ? PRO A 62 ? TYR A 56 PRO A 61 +A 4 ARG A 28 ? PHE A 33 ? ARG A 27 PHE A 32 +A 5 SER A 102 ? ALA A 107 ? SER A 101 ALA A 106 +A 6 VAL A 125 ? VAL A 131 ? VAL A 124 VAL A 130 +A 7 THR A 150 ? GLY A 155 ? THR A 149 GLY A 154 +A 8 ARG A 177 ? VAL A 181 ? ARG A 176 VAL A 180 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 N GLU A 7 ? N GLU A 6 O GLN A 18 ? O GLN A 17 +A 2 3 N MSE A 21 ? N MSE A 20 O VAL A 59 ? O VAL A 58 +A 3 4 O ASN A 58 ? O ASN A 57 N ARG A 28 ? N ARG A 27 +A 4 5 N SER A 29 ? N SER A 28 O VAL A 103 ? O VAL A 102 +A 5 6 N GLY A 106 ? N GLY A 105 O VAL A 131 ? O VAL A 130 +A 6 7 N ALA A 130 ? N ALA A 129 O LEU A 151 ? O LEU A 150 +A 7 8 N LEU A 152 ? N LEU A 151 O ARG A 177 ? O ARG A 176 +# +loop_ +_struct_site.id +_struct_site.pdbx_evidence_code +_struct_site.pdbx_auth_asym_id +_struct_site.pdbx_auth_comp_id +_struct_site.pdbx_auth_seq_id +_struct_site.pdbx_auth_ins_code +_struct_site.pdbx_num_residues +_struct_site.details +AC1 Software A PEG 207 ? 2 'BINDING SITE FOR RESIDUE PEG A 207' +AC2 Software A PEG 208 ? 2 'BINDING SITE FOR RESIDUE PEG A 208' +AC3 Software A PEG 209 ? 6 'BINDING SITE FOR RESIDUE PEG A 209' +# +loop_ +_struct_site_gen.id +_struct_site_gen.site_id +_struct_site_gen.pdbx_num_res +_struct_site_gen.label_comp_id +_struct_site_gen.label_asym_id +_struct_site_gen.label_seq_id +_struct_site_gen.pdbx_auth_ins_code +_struct_site_gen.auth_comp_id +_struct_site_gen.auth_asym_id +_struct_site_gen.auth_seq_id +_struct_site_gen.label_atom_id +_struct_site_gen.label_alt_id +_struct_site_gen.symmetry +_struct_site_gen.details +1 AC1 2 ASN A 12 ? ASN A 11 . ? 1_555 ? +2 AC1 2 LYS A 75 ? LYS A 74 . ? 1_555 ? +3 AC2 2 TYR A 36 ? TYR A 35 . ? 1_555 ? +4 AC2 2 GLY A 66 ? GLY A 65 . ? 1_555 ? +5 AC3 6 GLY A 68 ? GLY A 67 . ? 3_655 ? +6 AC3 6 ARG A 69 ? ARG A 68 . ? 3_655 ? +7 AC3 6 GLU A 191 ? GLU A 190 . ? 1_555 ? +8 AC3 6 LYS A 192 ? LYS A 191 . ? 1_555 ? +9 AC3 6 HOH E . ? HOH A 366 . ? 1_565 ? +10 AC3 6 HOH E . ? HOH A 397 . ? 1_565 ? +# +_pdbx_entry_details.entry_id 3BDI +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details +;REMARK 999 SEQUENCE: THE CONSTRUCT WAS EXPRESSED WITH A PURIFICATION +REMARK 999 TAG MGSDKIHHHHHHENLYFQG. THE TAG WAS REMOVED WITH TEV PROTEASE +REMARK 999 LEAVING ONLY A GLYCINE (0) FOLLOWED BY THE TARGET SEQUENCE. +REMARK 999 DNA SEQUENCING OF THE CLONED CONSTRUCT REVEALS A GLU AT POSITION +REMARK 999 190 INSTEAD OF LYS. THIS IS CONSISTENT WITH THE OBSERVED ELECTRON +REMARK 999 DENSITY AT THIS POSITION. +REMARK 999 +; +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 OE1 A GLU 87 ? B O A HOH 318 ? ? 2.14 +2 1 OE2 A GLU 87 ? A OH A TYR 120 ? ? 2.18 +# +_pdbx_validate_rmsd_bond.id 1 +_pdbx_validate_rmsd_bond.PDB_model_num 1 +_pdbx_validate_rmsd_bond.auth_atom_id_1 CD +_pdbx_validate_rmsd_bond.auth_asym_id_1 A +_pdbx_validate_rmsd_bond.auth_comp_id_1 GLU +_pdbx_validate_rmsd_bond.auth_seq_id_1 178 +_pdbx_validate_rmsd_bond.PDB_ins_code_1 ? +_pdbx_validate_rmsd_bond.label_alt_id_1 A +_pdbx_validate_rmsd_bond.auth_atom_id_2 OE2 +_pdbx_validate_rmsd_bond.auth_asym_id_2 A +_pdbx_validate_rmsd_bond.auth_comp_id_2 GLU +_pdbx_validate_rmsd_bond.auth_seq_id_2 178 +_pdbx_validate_rmsd_bond.PDB_ins_code_2 ? +_pdbx_validate_rmsd_bond.label_alt_id_2 A +_pdbx_validate_rmsd_bond.bond_value 1.171 +_pdbx_validate_rmsd_bond.bond_target_value 1.252 +_pdbx_validate_rmsd_bond.bond_deviation -0.081 +_pdbx_validate_rmsd_bond.bond_standard_deviation 0.011 +_pdbx_validate_rmsd_bond.linker_flag N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 SER A 107 ? ? 62.67 -122.66 +2 1 SER A 107 ? ? 62.67 -119.55 +# +_pdbx_SG_project.project_name 'PSI, Protein Structure Initiative' +_pdbx_SG_project.full_name_of_center 'Joint Center for Structural Genomics' +_pdbx_SG_project.id 1 +_pdbx_SG_project.initial_of_center JCSG +# +loop_ +_pdbx_struct_mod_residue.id +_pdbx_struct_mod_residue.label_asym_id +_pdbx_struct_mod_residue.label_comp_id +_pdbx_struct_mod_residue.label_seq_id +_pdbx_struct_mod_residue.auth_asym_id +_pdbx_struct_mod_residue.auth_comp_id +_pdbx_struct_mod_residue.auth_seq_id +_pdbx_struct_mod_residue.PDB_ins_code +_pdbx_struct_mod_residue.parent_comp_id +_pdbx_struct_mod_residue.details +1 A MSE 2 A MSE 1 ? MET SELENOMETHIONINE +2 A MSE 21 A MSE 20 ? MET SELENOMETHIONINE +3 A MSE 41 A MSE 40 ? MET SELENOMETHIONINE +4 A MSE 105 A MSE 104 ? MET SELENOMETHIONINE +5 A MSE 109 A MSE 108 ? MET SELENOMETHIONINE +6 A MSE 113 A MSE 112 ? MET SELENOMETHIONINE +7 A MSE 116 A MSE 115 ? MET SELENOMETHIONINE +8 A MSE 143 A MSE 142 ? MET SELENOMETHIONINE +# +_pdbx_refine_tls.id 1 +_pdbx_refine_tls.details ? +_pdbx_refine_tls.method refined +_pdbx_refine_tls.origin_x 29.5682 +_pdbx_refine_tls.origin_y 26.7390 +_pdbx_refine_tls.origin_z 13.5602 +_pdbx_refine_tls.T[1][1] -0.0013 +_pdbx_refine_tls.T[2][2] -0.0114 +_pdbx_refine_tls.T[3][3] -0.0160 +_pdbx_refine_tls.T[1][2] -0.0016 +_pdbx_refine_tls.T[1][3] 0.0182 +_pdbx_refine_tls.T[2][3] 0.0010 +_pdbx_refine_tls.L[1][1] 0.2299 +_pdbx_refine_tls.L[2][2] 0.4640 +_pdbx_refine_tls.L[3][3] 0.1473 +_pdbx_refine_tls.L[1][2] 0.1697 +_pdbx_refine_tls.L[1][3] -0.0316 +_pdbx_refine_tls.L[2][3] -0.1047 +_pdbx_refine_tls.S[1][1] -0.0213 +_pdbx_refine_tls.S[2][2] 0.0053 +_pdbx_refine_tls.S[3][3] 0.0161 +_pdbx_refine_tls.S[1][2] -0.0236 +_pdbx_refine_tls.S[1][3] -0.0248 +_pdbx_refine_tls.S[2][3] -0.0359 +_pdbx_refine_tls.S[2][1] -0.1118 +_pdbx_refine_tls.S[3][1] -0.0081 +_pdbx_refine_tls.S[3][2] 0.0068 +_pdbx_refine_tls.pdbx_refine_id 'X-RAY DIFFRACTION' +# +_pdbx_refine_tls_group.id 1 +_pdbx_refine_tls_group.refine_tls_id 1 +_pdbx_refine_tls_group.beg_label_asym_id A +_pdbx_refine_tls_group.beg_label_seq_id 1 +_pdbx_refine_tls_group.end_label_asym_id A +_pdbx_refine_tls_group.end_label_seq_id 207 +_pdbx_refine_tls_group.selection ? +_pdbx_refine_tls_group.beg_auth_asym_id A +_pdbx_refine_tls_group.beg_auth_seq_id 0 +_pdbx_refine_tls_group.end_auth_asym_id A +_pdbx_refine_tls_group.end_auth_seq_id 206 +_pdbx_refine_tls_group.pdbx_refine_id 'X-RAY DIFFRACTION' +_pdbx_refine_tls_group.selection_details ? +# +_phasing.method MAD +# +_pdbx_database_remark.id 999 +_pdbx_database_remark.text +; +SEQUENCE +1. THE CONSTRUCT WAS EXPRESSED WITH A PURIFICATION TAG +MGSDKIHHHHHHENLYFQG. THE TAG WAS REMOVED WITH TEV PROTEASE +LEAVING ONLY A GLYCINE (0) FOLLOWED BY THE TARGET SEQUENCE. +2. DNA SEQUENCING OF THE CLONED CONSTRUCT REVEALS A GLU AT +POSITION 190 INSTEAD OF LYS. THIS IS CONSISTENT WITH THE +OBSERVED ELECTRON DENSITY AT THIS POSITION. +; +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +GLN N N N N 74 +GLN CA C N S 75 +GLN C C N N 76 +GLN O O N N 77 +GLN CB C N N 78 +GLN CG C N N 79 +GLN CD C N N 80 +GLN OE1 O N N 81 +GLN NE2 N N N 82 +GLN OXT O N N 83 +GLN H H N N 84 +GLN H2 H N N 85 +GLN HA H N N 86 +GLN HB2 H N N 87 +GLN HB3 H N N 88 +GLN HG2 H N N 89 +GLN HG3 H N N 90 +GLN HE21 H N N 91 +GLN HE22 H N N 92 +GLN HXT H N N 93 +GLU N N N N 94 +GLU CA C N S 95 +GLU C C N N 96 +GLU O O N N 97 +GLU CB C N N 98 +GLU CG C N N 99 +GLU CD C N N 100 +GLU OE1 O N N 101 +GLU OE2 O N N 102 +GLU OXT O N N 103 +GLU H H N N 104 +GLU H2 H N N 105 +GLU HA H N N 106 +GLU HB2 H N N 107 +GLU HB3 H N N 108 +GLU HG2 H N N 109 +GLU HG3 H N N 110 +GLU HE2 H N N 111 +GLU HXT H N N 112 +GLY N N N N 113 +GLY CA C N N 114 +GLY C C N N 115 +GLY O O N N 116 +GLY OXT O N N 117 +GLY H H N N 118 +GLY H2 H N N 119 +GLY HA2 H N N 120 +GLY HA3 H N N 121 +GLY HXT H N N 122 +HIS N N N N 123 +HIS CA C N S 124 +HIS C C N N 125 +HIS O O N N 126 +HIS CB C N N 127 +HIS CG C Y N 128 +HIS ND1 N Y N 129 +HIS CD2 C Y N 130 +HIS CE1 C Y N 131 +HIS NE2 N Y N 132 +HIS OXT O N N 133 +HIS H H N N 134 +HIS H2 H N N 135 +HIS HA H N N 136 +HIS HB2 H N N 137 +HIS HB3 H N N 138 +HIS HD1 H N N 139 +HIS HD2 H N N 140 +HIS HE1 H N N 141 +HIS HE2 H N N 142 +HIS HXT H N N 143 +HOH O O N N 144 +HOH H1 H N N 145 +HOH H2 H N N 146 +ILE N N N N 147 +ILE CA C N S 148 +ILE C C N N 149 +ILE O O N N 150 +ILE CB C N S 151 +ILE CG1 C N N 152 +ILE CG2 C N N 153 +ILE CD1 C N N 154 +ILE OXT O N N 155 +ILE H H N N 156 +ILE H2 H N N 157 +ILE HA H N N 158 +ILE HB H N N 159 +ILE HG12 H N N 160 +ILE HG13 H N N 161 +ILE HG21 H N N 162 +ILE HG22 H N N 163 +ILE HG23 H N N 164 +ILE HD11 H N N 165 +ILE HD12 H N N 166 +ILE HD13 H N N 167 +ILE HXT H N N 168 +LEU N N N N 169 +LEU CA C N S 170 +LEU C C N N 171 +LEU O O N N 172 +LEU CB C N N 173 +LEU CG C N N 174 +LEU CD1 C N N 175 +LEU CD2 C N N 176 +LEU OXT O N N 177 +LEU H H N N 178 +LEU H2 H N N 179 +LEU HA H N N 180 +LEU HB2 H N N 181 +LEU HB3 H N N 182 +LEU HG H N N 183 +LEU HD11 H N N 184 +LEU HD12 H N N 185 +LEU HD13 H N N 186 +LEU HD21 H N N 187 +LEU HD22 H N N 188 +LEU HD23 H N N 189 +LEU HXT H N N 190 +LYS N N N N 191 +LYS CA C N S 192 +LYS C C N N 193 +LYS O O N N 194 +LYS CB C N N 195 +LYS CG C N N 196 +LYS CD C N N 197 +LYS CE C N N 198 +LYS NZ N N N 199 +LYS OXT O N N 200 +LYS H H N N 201 +LYS H2 H N N 202 +LYS HA H N N 203 +LYS HB2 H N N 204 +LYS HB3 H N N 205 +LYS HG2 H N N 206 +LYS HG3 H N N 207 +LYS HD2 H N N 208 +LYS HD3 H N N 209 +LYS HE2 H N N 210 +LYS HE3 H N N 211 +LYS HZ1 H N N 212 +LYS HZ2 H N N 213 +LYS HZ3 H N N 214 +LYS HXT H N N 215 +MSE N N N N 216 +MSE CA C N S 217 +MSE C C N N 218 +MSE O O N N 219 +MSE OXT O N N 220 +MSE CB C N N 221 +MSE CG C N N 222 +MSE SE SE N N 223 +MSE CE C N N 224 +MSE H H N N 225 +MSE H2 H N N 226 +MSE HA H N N 227 +MSE HXT H N N 228 +MSE HB2 H N N 229 +MSE HB3 H N N 230 +MSE HG2 H N N 231 +MSE HG3 H N N 232 +MSE HE1 H N N 233 +MSE HE2 H N N 234 +MSE HE3 H N N 235 +PEG C1 C N N 236 +PEG O1 O N N 237 +PEG C2 C N N 238 +PEG O2 O N N 239 +PEG C3 C N N 240 +PEG C4 C N N 241 +PEG O4 O N N 242 +PEG H11 H N N 243 +PEG H12 H N N 244 +PEG HO1 H N N 245 +PEG H21 H N N 246 +PEG H22 H N N 247 +PEG H31 H N N 248 +PEG H32 H N N 249 +PEG H41 H N N 250 +PEG H42 H N N 251 +PEG HO4 H N N 252 +PHE N N N N 253 +PHE CA C N S 254 +PHE C C N N 255 +PHE O O N N 256 +PHE CB C N N 257 +PHE CG C Y N 258 +PHE CD1 C Y N 259 +PHE CD2 C Y N 260 +PHE CE1 C Y N 261 +PHE CE2 C Y N 262 +PHE CZ C Y N 263 +PHE OXT O N N 264 +PHE H H N N 265 +PHE H2 H N N 266 +PHE HA H N N 267 +PHE HB2 H N N 268 +PHE HB3 H N N 269 +PHE HD1 H N N 270 +PHE HD2 H N N 271 +PHE HE1 H N N 272 +PHE HE2 H N N 273 +PHE HZ H N N 274 +PHE HXT H N N 275 +PRO N N N N 276 +PRO CA C N S 277 +PRO C C N N 278 +PRO O O N N 279 +PRO CB C N N 280 +PRO CG C N N 281 +PRO CD C N N 282 +PRO OXT O N N 283 +PRO H H N N 284 +PRO HA H N N 285 +PRO HB2 H N N 286 +PRO HB3 H N N 287 +PRO HG2 H N N 288 +PRO HG3 H N N 289 +PRO HD2 H N N 290 +PRO HD3 H N N 291 +PRO HXT H N N 292 +SER N N N N 293 +SER CA C N S 294 +SER C C N N 295 +SER O O N N 296 +SER CB C N N 297 +SER OG O N N 298 +SER OXT O N N 299 +SER H H N N 300 +SER H2 H N N 301 +SER HA H N N 302 +SER HB2 H N N 303 +SER HB3 H N N 304 +SER HG H N N 305 +SER HXT H N N 306 +THR N N N N 307 +THR CA C N S 308 +THR C C N N 309 +THR O O N N 310 +THR CB C N R 311 +THR OG1 O N N 312 +THR CG2 C N N 313 +THR OXT O N N 314 +THR H H N N 315 +THR H2 H N N 316 +THR HA H N N 317 +THR HB H N N 318 +THR HG1 H N N 319 +THR HG21 H N N 320 +THR HG22 H N N 321 +THR HG23 H N N 322 +THR HXT H N N 323 +TRP N N N N 324 +TRP CA C N S 325 +TRP C C N N 326 +TRP O O N N 327 +TRP CB C N N 328 +TRP CG C Y N 329 +TRP CD1 C Y N 330 +TRP CD2 C Y N 331 +TRP NE1 N Y N 332 +TRP CE2 C Y N 333 +TRP CE3 C Y N 334 +TRP CZ2 C Y N 335 +TRP CZ3 C Y N 336 +TRP CH2 C Y N 337 +TRP OXT O N N 338 +TRP H H N N 339 +TRP H2 H N N 340 +TRP HA H N N 341 +TRP HB2 H N N 342 +TRP HB3 H N N 343 +TRP HD1 H N N 344 +TRP HE1 H N N 345 +TRP HE3 H N N 346 +TRP HZ2 H N N 347 +TRP HZ3 H N N 348 +TRP HH2 H N N 349 +TRP HXT H N N 350 +TYR N N N N 351 +TYR CA C N S 352 +TYR C C N N 353 +TYR O O N N 354 +TYR CB C N N 355 +TYR CG C Y N 356 +TYR CD1 C Y N 357 +TYR CD2 C Y N 358 +TYR CE1 C Y N 359 +TYR CE2 C Y N 360 +TYR CZ C Y N 361 +TYR OH O N N 362 +TYR OXT O N N 363 +TYR H H N N 364 +TYR H2 H N N 365 +TYR HA H N N 366 +TYR HB2 H N N 367 +TYR HB3 H N N 368 +TYR HD1 H N N 369 +TYR HD2 H N N 370 +TYR HE1 H N N 371 +TYR HE2 H N N 372 +TYR HH H N N 373 +TYR HXT H N N 374 +VAL N N N N 375 +VAL CA C N S 376 +VAL C C N N 377 +VAL O O N N 378 +VAL CB C N N 379 +VAL CG1 C N N 380 +VAL CG2 C N N 381 +VAL OXT O N N 382 +VAL H H N N 383 +VAL H2 H N N 384 +VAL HA H N N 385 +VAL HB H N N 386 +VAL HG11 H N N 387 +VAL HG12 H N N 388 +VAL HG13 H N N 389 +VAL HG21 H N N 390 +VAL HG22 H N N 391 +VAL HG23 H N N 392 +VAL HXT H N N 393 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +GLN N CA sing N N 70 +GLN N H sing N N 71 +GLN N H2 sing N N 72 +GLN CA C sing N N 73 +GLN CA CB sing N N 74 +GLN CA HA sing N N 75 +GLN C O doub N N 76 +GLN C OXT sing N N 77 +GLN CB CG sing N N 78 +GLN CB HB2 sing N N 79 +GLN CB HB3 sing N N 80 +GLN CG CD sing N N 81 +GLN CG HG2 sing N N 82 +GLN CG HG3 sing N N 83 +GLN CD OE1 doub N N 84 +GLN CD NE2 sing N N 85 +GLN NE2 HE21 sing N N 86 +GLN NE2 HE22 sing N N 87 +GLN OXT HXT sing N N 88 +GLU N CA sing N N 89 +GLU N H sing N N 90 +GLU N H2 sing N N 91 +GLU CA C sing N N 92 +GLU CA CB sing N N 93 +GLU CA HA sing N N 94 +GLU C O doub N N 95 +GLU C OXT sing N N 96 +GLU CB CG sing N N 97 +GLU CB HB2 sing N N 98 +GLU CB HB3 sing N N 99 +GLU CG CD sing N N 100 +GLU CG HG2 sing N N 101 +GLU CG HG3 sing N N 102 +GLU CD OE1 doub N N 103 +GLU CD OE2 sing N N 104 +GLU OE2 HE2 sing N N 105 +GLU OXT HXT sing N N 106 +GLY N CA sing N N 107 +GLY N H sing N N 108 +GLY N H2 sing N N 109 +GLY CA C sing N N 110 +GLY CA HA2 sing N N 111 +GLY CA HA3 sing N N 112 +GLY C O doub N N 113 +GLY C OXT sing N N 114 +GLY OXT HXT sing N N 115 +HIS N CA sing N N 116 +HIS N H sing N N 117 +HIS N H2 sing N N 118 +HIS CA C sing N N 119 +HIS CA CB sing N N 120 +HIS CA HA sing N N 121 +HIS C O doub N N 122 +HIS C OXT sing N N 123 +HIS CB CG sing N N 124 +HIS CB HB2 sing N N 125 +HIS CB HB3 sing N N 126 +HIS CG ND1 sing Y N 127 +HIS CG CD2 doub Y N 128 +HIS ND1 CE1 doub Y N 129 +HIS ND1 HD1 sing N N 130 +HIS CD2 NE2 sing Y N 131 +HIS CD2 HD2 sing N N 132 +HIS CE1 NE2 sing Y N 133 +HIS CE1 HE1 sing N N 134 +HIS NE2 HE2 sing N N 135 +HIS OXT HXT sing N N 136 +HOH O H1 sing N N 137 +HOH O H2 sing N N 138 +ILE N CA sing N N 139 +ILE N H sing N N 140 +ILE N H2 sing N N 141 +ILE CA C sing N N 142 +ILE CA CB sing N N 143 +ILE CA HA sing N N 144 +ILE C O doub N N 145 +ILE C OXT sing N N 146 +ILE CB CG1 sing N N 147 +ILE CB CG2 sing N N 148 +ILE CB HB sing N N 149 +ILE CG1 CD1 sing N N 150 +ILE CG1 HG12 sing N N 151 +ILE CG1 HG13 sing N N 152 +ILE CG2 HG21 sing N N 153 +ILE CG2 HG22 sing N N 154 +ILE CG2 HG23 sing N N 155 +ILE CD1 HD11 sing N N 156 +ILE CD1 HD12 sing N N 157 +ILE CD1 HD13 sing N N 158 +ILE OXT HXT sing N N 159 +LEU N CA sing N N 160 +LEU N H sing N N 161 +LEU N H2 sing N N 162 +LEU CA C sing N N 163 +LEU CA CB sing N N 164 +LEU CA HA sing N N 165 +LEU C O doub N N 166 +LEU C OXT sing N N 167 +LEU CB CG sing N N 168 +LEU CB HB2 sing N N 169 +LEU CB HB3 sing N N 170 +LEU CG CD1 sing N N 171 +LEU CG CD2 sing N N 172 +LEU CG HG sing N N 173 +LEU CD1 HD11 sing N N 174 +LEU CD1 HD12 sing N N 175 +LEU CD1 HD13 sing N N 176 +LEU CD2 HD21 sing N N 177 +LEU CD2 HD22 sing N N 178 +LEU CD2 HD23 sing N N 179 +LEU OXT HXT sing N N 180 +LYS N CA sing N N 181 +LYS N H sing N N 182 +LYS N H2 sing N N 183 +LYS CA C sing N N 184 +LYS CA CB sing N N 185 +LYS CA HA sing N N 186 +LYS C O doub N N 187 +LYS C OXT sing N N 188 +LYS CB CG sing N N 189 +LYS CB HB2 sing N N 190 +LYS CB HB3 sing N N 191 +LYS CG CD sing N N 192 +LYS CG HG2 sing N N 193 +LYS CG HG3 sing N N 194 +LYS CD CE sing N N 195 +LYS CD HD2 sing N N 196 +LYS CD HD3 sing N N 197 +LYS CE NZ sing N N 198 +LYS CE HE2 sing N N 199 +LYS CE HE3 sing N N 200 +LYS NZ HZ1 sing N N 201 +LYS NZ HZ2 sing N N 202 +LYS NZ HZ3 sing N N 203 +LYS OXT HXT sing N N 204 +MSE N CA sing N N 205 +MSE N H sing N N 206 +MSE N H2 sing N N 207 +MSE CA C sing N N 208 +MSE CA CB sing N N 209 +MSE CA HA sing N N 210 +MSE C O doub N N 211 +MSE C OXT sing N N 212 +MSE OXT HXT sing N N 213 +MSE CB CG sing N N 214 +MSE CB HB2 sing N N 215 +MSE CB HB3 sing N N 216 +MSE CG SE sing N N 217 +MSE CG HG2 sing N N 218 +MSE CG HG3 sing N N 219 +MSE SE CE sing N N 220 +MSE CE HE1 sing N N 221 +MSE CE HE2 sing N N 222 +MSE CE HE3 sing N N 223 +PEG C1 O1 sing N N 224 +PEG C1 C2 sing N N 225 +PEG C1 H11 sing N N 226 +PEG C1 H12 sing N N 227 +PEG O1 HO1 sing N N 228 +PEG C2 O2 sing N N 229 +PEG C2 H21 sing N N 230 +PEG C2 H22 sing N N 231 +PEG O2 C3 sing N N 232 +PEG C3 C4 sing N N 233 +PEG C3 H31 sing N N 234 +PEG C3 H32 sing N N 235 +PEG C4 O4 sing N N 236 +PEG C4 H41 sing N N 237 +PEG C4 H42 sing N N 238 +PEG O4 HO4 sing N N 239 +PHE N CA sing N N 240 +PHE N H sing N N 241 +PHE N H2 sing N N 242 +PHE CA C sing N N 243 +PHE CA CB sing N N 244 +PHE CA HA sing N N 245 +PHE C O doub N N 246 +PHE C OXT sing N N 247 +PHE CB CG sing N N 248 +PHE CB HB2 sing N N 249 +PHE CB HB3 sing N N 250 +PHE CG CD1 doub Y N 251 +PHE CG CD2 sing Y N 252 +PHE CD1 CE1 sing Y N 253 +PHE CD1 HD1 sing N N 254 +PHE CD2 CE2 doub Y N 255 +PHE CD2 HD2 sing N N 256 +PHE CE1 CZ doub Y N 257 +PHE CE1 HE1 sing N N 258 +PHE CE2 CZ sing Y N 259 +PHE CE2 HE2 sing N N 260 +PHE CZ HZ sing N N 261 +PHE OXT HXT sing N N 262 +PRO N CA sing N N 263 +PRO N CD sing N N 264 +PRO N H sing N N 265 +PRO CA C sing N N 266 +PRO CA CB sing N N 267 +PRO CA HA sing N N 268 +PRO C O doub N N 269 +PRO C OXT sing N N 270 +PRO CB CG sing N N 271 +PRO CB HB2 sing N N 272 +PRO CB HB3 sing N N 273 +PRO CG CD sing N N 274 +PRO CG HG2 sing N N 275 +PRO CG HG3 sing N N 276 +PRO CD HD2 sing N N 277 +PRO CD HD3 sing N N 278 +PRO OXT HXT sing N N 279 +SER N CA sing N N 280 +SER N H sing N N 281 +SER N H2 sing N N 282 +SER CA C sing N N 283 +SER CA CB sing N N 284 +SER CA HA sing N N 285 +SER C O doub N N 286 +SER C OXT sing N N 287 +SER CB OG sing N N 288 +SER CB HB2 sing N N 289 +SER CB HB3 sing N N 290 +SER OG HG sing N N 291 +SER OXT HXT sing N N 292 +THR N CA sing N N 293 +THR N H sing N N 294 +THR N H2 sing N N 295 +THR CA C sing N N 296 +THR CA CB sing N N 297 +THR CA HA sing N N 298 +THR C O doub N N 299 +THR C OXT sing N N 300 +THR CB OG1 sing N N 301 +THR CB CG2 sing N N 302 +THR CB HB sing N N 303 +THR OG1 HG1 sing N N 304 +THR CG2 HG21 sing N N 305 +THR CG2 HG22 sing N N 306 +THR CG2 HG23 sing N N 307 +THR OXT HXT sing N N 308 +TRP N CA sing N N 309 +TRP N H sing N N 310 +TRP N H2 sing N N 311 +TRP CA C sing N N 312 +TRP CA CB sing N N 313 +TRP CA HA sing N N 314 +TRP C O doub N N 315 +TRP C OXT sing N N 316 +TRP CB CG sing N N 317 +TRP CB HB2 sing N N 318 +TRP CB HB3 sing N N 319 +TRP CG CD1 doub Y N 320 +TRP CG CD2 sing Y N 321 +TRP CD1 NE1 sing Y N 322 +TRP CD1 HD1 sing N N 323 +TRP CD2 CE2 doub Y N 324 +TRP CD2 CE3 sing Y N 325 +TRP NE1 CE2 sing Y N 326 +TRP NE1 HE1 sing N N 327 +TRP CE2 CZ2 sing Y N 328 +TRP CE3 CZ3 doub Y N 329 +TRP CE3 HE3 sing N N 330 +TRP CZ2 CH2 doub Y N 331 +TRP CZ2 HZ2 sing N N 332 +TRP CZ3 CH2 sing Y N 333 +TRP CZ3 HZ3 sing N N 334 +TRP CH2 HH2 sing N N 335 +TRP OXT HXT sing N N 336 +TYR N CA sing N N 337 +TYR N H sing N N 338 +TYR N H2 sing N N 339 +TYR CA C sing N N 340 +TYR CA CB sing N N 341 +TYR CA HA sing N N 342 +TYR C O doub N N 343 +TYR C OXT sing N N 344 +TYR CB CG sing N N 345 +TYR CB HB2 sing N N 346 +TYR CB HB3 sing N N 347 +TYR CG CD1 doub Y N 348 +TYR CG CD2 sing Y N 349 +TYR CD1 CE1 sing Y N 350 +TYR CD1 HD1 sing N N 351 +TYR CD2 CE2 doub Y N 352 +TYR CD2 HD2 sing N N 353 +TYR CE1 CZ doub Y N 354 +TYR CE1 HE1 sing N N 355 +TYR CE2 CZ sing Y N 356 +TYR CE2 HE2 sing N N 357 +TYR CZ OH sing N N 358 +TYR OH HH sing N N 359 +TYR OXT HXT sing N N 360 +VAL N CA sing N N 361 +VAL N H sing N N 362 +VAL N H2 sing N N 363 +VAL CA C sing N N 364 +VAL CA CB sing N N 365 +VAL CA HA sing N N 366 +VAL C O doub N N 367 +VAL C OXT sing N N 368 +VAL CB CG1 sing N N 369 +VAL CB CG2 sing N N 370 +VAL CB HB sing N N 371 +VAL CG1 HG11 sing N N 372 +VAL CG1 HG12 sing N N 373 +VAL CG1 HG13 sing N N 374 +VAL CG2 HG21 sing N N 375 +VAL CG2 HG22 sing N N 376 +VAL CG2 HG23 sing N N 377 +VAL OXT HXT sing N N 378 +# +_atom_sites.entry_id 3BDI +_atom_sites.fract_transf_matrix[1][1] 0.023050 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.021602 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.009838 +_atom_sites.fract_transf_vector[1] 0.000000 +_atom_sites.fract_transf_vector[2] 0.000000 +_atom_sites.fract_transf_vector[3] 0.000000 +# +loop_ +_atom_type.symbol +C +N +O +SE +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . GLY A 1 1 ? 5.110 29.360 4.226 1.00 17.85 ? 0 GLY A N 1 +ATOM 2 C CA . GLY A 1 1 ? 5.976 30.564 4.544 1.00 16.48 ? 0 GLY A CA 1 +ATOM 3 C C . GLY A 1 1 ? 7.170 30.089 5.331 1.00 19.57 ? 0 GLY A C 1 +ATOM 4 O O . GLY A 1 1 ? 7.274 28.861 5.530 1.00 22.27 ? 0 GLY A O 1 +HETATM 5 N N . MSE A 1 2 ? 8.028 31.003 5.805 1.00 21.38 ? 1 MSE A N 1 +HETATM 6 C CA . MSE A 1 2 ? 9.233 30.546 6.565 1.00 16.72 ? 1 MSE A CA 1 +HETATM 7 C C . MSE A 1 2 ? 8.891 30.205 8.015 1.00 15.92 ? 1 MSE A C 1 +HETATM 8 O O . MSE A 1 2 ? 8.186 30.949 8.704 1.00 21.51 ? 1 MSE A O 1 +HETATM 9 C CB . MSE A 1 2 ? 10.451 31.470 6.500 1.00 19.71 ? 1 MSE A CB 1 +HETATM 10 C CG . MSE A 1 2 ? 11.024 31.744 5.057 1.00 22.08 ? 1 MSE A CG 1 +HETATM 11 SE SE . MSE A 1 2 ? 11.398 30.288 3.787 0.75 22.68 ? 1 MSE A SE 1 +HETATM 12 C CE . MSE A 1 2 ? 12.693 29.348 4.855 1.00 15.37 ? 1 MSE A CE 1 +ATOM 13 N N . ALA A 1 3 ? 9.374 29.046 8.462 1.00 12.26 ? 2 ALA A N 1 +ATOM 14 C CA . ALA A 1 3 ? 9.062 28.516 9.791 1.00 12.43 ? 2 ALA A CA 1 +ATOM 15 C C . ALA A 1 3 ? 10.333 28.074 10.467 1.00 11.01 ? 2 ALA A C 1 +ATOM 16 O O . ALA A 1 3 ? 11.174 27.456 9.812 1.00 13.67 ? 2 ALA A O 1 +ATOM 17 C CB . ALA A 1 3 ? 8.171 27.310 9.660 1.00 14.85 ? 2 ALA A CB 1 +ATOM 18 N N . LEU A 1 4 ? 10.467 28.381 11.752 1.00 12.74 ? 3 LEU A N 1 +ATOM 19 C CA . LEU A 1 4 ? 11.575 27.789 12.528 1.00 13.93 ? 3 LEU A CA 1 +ATOM 20 C C . LEU A 1 4 ? 11.063 26.484 13.113 1.00 14.61 ? 3 LEU A C 1 +ATOM 21 O O . LEU A 1 4 ? 10.223 26.487 14.007 1.00 18.10 ? 3 LEU A O 1 +ATOM 22 C CB . LEU A 1 4 ? 12.050 28.702 13.627 1.00 13.96 ? 3 LEU A CB 1 +ATOM 23 C CG . LEU A 1 4 ? 13.178 28.037 14.465 1.00 20.56 ? 3 LEU A CG 1 +ATOM 24 C CD1 . LEU A 1 4 ? 14.475 28.114 13.720 1.00 20.15 ? 3 LEU A CD1 1 +ATOM 25 C CD2 . LEU A 1 4 ? 13.228 28.719 15.794 1.00 28.28 ? 3 LEU A CD2 1 +ATOM 26 N N . GLN A 1 5 ? 11.613 25.377 12.608 1.00 11.57 ? 4 GLN A N 1 +ATOM 27 C CA . GLN A 1 5 ? 11.228 24.032 13.007 1.00 12.04 ? 4 GLN A CA 1 +ATOM 28 C C . GLN A 1 5 ? 12.185 23.581 14.090 1.00 12.26 ? 4 GLN A C 1 +ATOM 29 O O . GLN A 1 5 ? 13.386 23.760 13.949 1.00 15.43 ? 4 GLN A O 1 +ATOM 30 C CB . GLN A 1 5 ? 11.296 23.078 11.844 1.00 12.20 ? 4 GLN A CB 1 +ATOM 31 C CG . GLN A 1 5 ? 10.231 23.336 10.800 1.00 15.73 ? 4 GLN A CG 1 +ATOM 32 C CD . GLN A 1 5 ? 10.377 22.379 9.652 1.00 15.26 ? 4 GLN A CD 1 +ATOM 33 O OE1 . GLN A 1 5 ? 10.022 21.173 9.760 1.00 20.17 ? 4 GLN A OE1 1 +ATOM 34 N NE2 . GLN A 1 5 ? 10.931 22.859 8.581 1.00 15.89 ? 4 GLN A NE2 1 +ATOM 35 N N . GLU A 1 6 ? 11.634 23.024 15.136 1.00 12.39 ? 5 GLU A N 1 +ATOM 36 C CA . GLU A 1 6 ? 12.432 22.487 16.257 1.00 11.64 ? 5 GLU A CA 1 +ATOM 37 C C . GLU A 1 6 ? 12.031 21.020 16.385 1.00 12.69 ? 5 GLU A C 1 +ATOM 38 O O . GLU A 1 6 ? 10.844 20.698 16.438 1.00 13.52 ? 5 GLU A O 1 +ATOM 39 C CB . GLU A 1 6 ? 12.193 23.259 17.530 1.00 12.19 ? 5 GLU A CB 1 +ATOM 40 C CG . GLU A 1 6 ? 12.549 24.720 17.419 1.00 11.92 ? 5 GLU A CG 1 +ATOM 41 C CD . GLU A 1 6 ? 12.255 25.524 18.656 1.00 18.61 ? 5 GLU A CD 1 +ATOM 42 O OE1 . GLU A 1 6 ? 11.114 25.430 19.164 1.00 24.38 ? 5 GLU A OE1 1 +ATOM 43 O OE2 . GLU A 1 6 ? 13.120 26.280 19.135 1.00 17.05 ? 5 GLU A OE2 1 +ATOM 44 N N . GLU A 1 7 ? 12.989 20.112 16.366 1.00 10.09 ? 6 GLU A N 1 +ATOM 45 C CA . GLU A 1 7 ? 12.678 18.695 16.244 1.00 10.66 ? 6 GLU A CA 1 +ATOM 46 C C . GLU A 1 7 ? 13.868 17.868 16.688 1.00 10.93 ? 6 GLU A C 1 +ATOM 47 O O . GLU A 1 7 ? 14.982 18.375 16.884 1.00 11.15 ? 6 GLU A O 1 +ATOM 48 C CB . GLU A 1 7 ? 12.362 18.338 14.792 1.00 10.16 ? 6 GLU A CB 1 +ATOM 49 C CG . GLU A 1 7 ? 13.527 18.528 13.849 1.00 12.43 ? 6 GLU A CG 1 +ATOM 50 C CD . GLU A 1 7 ? 13.201 18.358 12.357 1.00 15.08 ? 6 GLU A CD 1 +ATOM 51 O OE1 . GLU A 1 7 ? 12.000 18.382 11.991 1.00 16.19 ? 6 GLU A OE1 1 +ATOM 52 O OE2 . GLU A 1 7 ? 14.159 18.258 11.561 1.00 13.70 ? 6 GLU A OE2 1 +ATOM 53 N N . PHE A 1 8 ? 13.658 16.577 16.842 1.00 9.40 ? 7 PHE A N 1 +ATOM 54 C CA . PHE A 1 8 ? 14.718 15.643 17.126 1.00 9.83 ? 7 PHE A CA 1 +ATOM 55 C C . PHE A 1 8 ? 14.950 14.771 15.904 1.00 11.34 ? 7 PHE A C 1 +ATOM 56 O O . PHE A 1 8 ? 13.999 14.357 15.233 1.00 15.37 ? 7 PHE A O 1 +ATOM 57 C CB . PHE A 1 8 ? 14.413 14.808 18.353 1.00 10.21 ? 7 PHE A CB 1 +ATOM 58 C CG . PHE A 1 8 ? 14.326 15.611 19.610 1.00 10.31 ? 7 PHE A CG 1 +ATOM 59 C CD1 . PHE A 1 8 ? 13.146 16.248 19.996 1.00 10.90 ? 7 PHE A CD1 1 +ATOM 60 C CD2 . PHE A 1 8 ? 15.426 15.746 20.414 1.00 11.11 ? 7 PHE A CD2 1 +ATOM 61 C CE1 . PHE A 1 8 ? 13.136 17.034 21.123 1.00 12.20 ? 7 PHE A CE1 1 +ATOM 62 C CE2 . PHE A 1 8 ? 15.384 16.506 21.556 1.00 11.03 ? 7 PHE A CE2 1 +ATOM 63 C CZ . PHE A 1 8 ? 14.219 17.132 21.895 1.00 11.70 ? 7 PHE A CZ 1 +ATOM 64 N N A ILE A 1 9 ? 16.222 14.581 15.574 0.50 8.76 ? 8 ILE A N 1 +ATOM 65 N N B ILE A 1 9 ? 16.204 14.449 15.664 0.50 11.13 ? 8 ILE A N 1 +ATOM 66 C CA A ILE A 1 9 ? 16.695 13.780 14.425 0.50 8.98 ? 8 ILE A CA 1 +ATOM 67 C CA B ILE A 1 9 ? 16.596 13.668 14.504 0.50 13.41 ? 8 ILE A CA 1 +ATOM 68 C C A ILE A 1 9 ? 17.562 12.638 14.991 0.50 9.30 ? 8 ILE A C 1 +ATOM 69 C C B ILE A 1 9 ? 17.687 12.682 14.860 0.50 11.32 ? 8 ILE A C 1 +ATOM 70 O O A ILE A 1 9 ? 18.234 12.796 16.033 0.50 10.44 ? 8 ILE A O 1 +ATOM 71 O O B ILE A 1 9 ? 18.673 13.017 15.564 0.50 9.08 ? 8 ILE A O 1 +ATOM 72 C CB A ILE A 1 9 ? 17.467 14.668 13.380 0.50 8.80 ? 8 ILE A CB 1 +ATOM 73 C CB B ILE A 1 9 ? 17.038 14.562 13.352 0.50 14.93 ? 8 ILE A CB 1 +ATOM 74 C CG1 A ILE A 1 9 ? 17.682 13.916 12.057 0.50 7.01 ? 8 ILE A CG1 1 +ATOM 75 C CG1 B ILE A 1 9 ? 18.255 15.435 13.716 0.50 14.73 ? 8 ILE A CG1 1 +ATOM 76 C CG2 A ILE A 1 9 ? 18.760 15.263 13.968 0.50 13.34 ? 8 ILE A CG2 1 +ATOM 77 C CG2 B ILE A 1 9 ? 15.862 15.447 12.946 0.50 19.18 ? 8 ILE A CG2 1 +ATOM 78 C CD1 A ILE A 1 9 ? 18.010 14.808 10.919 0.50 8.08 ? 8 ILE A CD1 1 +ATOM 79 C CD1 B ILE A 1 9 ? 19.348 15.372 12.663 0.50 19.29 ? 8 ILE A CD1 1 +ATOM 80 N N . ASP A 1 10 ? 17.525 11.461 14.360 1.00 10.37 ? 9 ASP A N 1 +ATOM 81 C CA . ASP A 1 10 ? 18.467 10.420 14.658 1.00 10.20 ? 9 ASP A CA 1 +ATOM 82 C C . ASP A 1 10 ? 19.686 10.594 13.822 1.00 11.85 ? 9 ASP A C 1 +ATOM 83 O O . ASP A 1 10 ? 19.600 10.618 12.578 1.00 12.99 ? 9 ASP A O 1 +ATOM 84 C CB . ASP A 1 10 ? 17.898 9.042 14.370 1.00 12.02 ? 9 ASP A CB 1 +ATOM 85 C CG . ASP A 1 10 ? 18.895 7.920 14.763 1.00 14.39 ? 9 ASP A CG 1 +ATOM 86 O OD1 . ASP A 1 10 ? 19.094 7.736 15.970 1.00 26.88 ? 9 ASP A OD1 1 +ATOM 87 O OD2 . ASP A 1 10 ? 19.458 7.300 13.881 1.00 29.77 ? 9 ASP A OD2 1 +ATOM 88 N N . VAL A 1 11 ? 20.846 10.694 14.474 1.00 9.56 ? 10 VAL A N 1 +ATOM 89 C CA . VAL A 1 11 ? 22.138 10.712 13.809 1.00 10.78 ? 10 VAL A CA 1 +ATOM 90 C C . VAL A 1 11 ? 22.866 9.439 14.234 1.00 10.57 ? 10 VAL A C 1 +ATOM 91 O O . VAL A 1 11 ? 23.475 9.348 15.301 1.00 9.95 ? 10 VAL A O 1 +ATOM 92 C CB . VAL A 1 11 ? 22.942 12.005 14.108 1.00 9.95 ? 10 VAL A CB 1 +ATOM 93 C CG1 . VAL A 1 11 ? 24.234 12.009 13.265 1.00 11.43 ? 10 VAL A CG1 1 +ATOM 94 C CG2 . VAL A 1 11 ? 22.073 13.243 13.808 1.00 11.99 ? 10 VAL A CG2 1 +ATOM 95 N N . ASN A 1 12 ? 22.760 8.401 13.409 1.00 10.73 ? 11 ASN A N 1 +ATOM 96 C CA . ASN A 1 12 ? 23.390 7.104 13.664 1.00 11.50 ? 11 ASN A CA 1 +ATOM 97 C C . ASN A 1 12 ? 23.221 6.610 15.075 1.00 9.77 ? 11 ASN A C 1 +ATOM 98 O O . ASN A 1 12 ? 24.151 6.102 15.682 1.00 11.97 ? 11 ASN A O 1 +ATOM 99 C CB . ASN A 1 12 ? 24.854 7.105 13.234 1.00 11.13 ? 11 ASN A CB 1 +ATOM 100 C CG . ASN A 1 12 ? 24.995 7.234 11.750 1.00 18.59 ? 11 ASN A CG 1 +ATOM 101 O OD1 . ASN A 1 12 ? 24.337 6.504 10.995 1.00 19.50 ? 11 ASN A OD1 1 +ATOM 102 N ND2 . ASN A 1 12 ? 25.804 8.158 11.304 1.00 21.66 ? 11 ASN A ND2 1 +ATOM 103 N N . GLY A 1 13 ? 22.008 6.725 15.588 1.00 10.16 ? 12 GLY A N 1 +ATOM 104 C CA . GLY A 1 13 ? 21.672 6.139 16.880 1.00 10.24 ? 12 GLY A CA 1 +ATOM 105 C C . GLY A 1 13 ? 21.667 7.130 18.042 1.00 12.80 ? 12 GLY A C 1 +ATOM 106 O O . GLY A 1 13 ? 21.274 6.781 19.151 1.00 14.76 ? 12 GLY A O 1 +ATOM 107 N N . THR A 1 14 ? 22.072 8.364 17.774 1.00 9.93 ? 13 THR A N 1 +ATOM 108 C CA . THR A 1 14 ? 22.059 9.419 18.795 1.00 8.93 ? 13 THR A CA 1 +ATOM 109 C C . THR A 1 14 ? 20.923 10.372 18.512 1.00 9.01 ? 13 THR A C 1 +ATOM 110 O O . THR A 1 14 ? 20.828 10.917 17.389 1.00 10.12 ? 13 THR A O 1 +ATOM 111 C CB . THR A 1 14 ? 23.397 10.159 18.817 1.00 10.51 ? 13 THR A CB 1 +ATOM 112 O OG1 . THR A 1 14 ? 24.412 9.241 19.221 1.00 10.98 ? 13 THR A OG1 1 +ATOM 113 C CG2 . THR A 1 14 ? 23.386 11.339 19.827 1.00 10.59 ? 13 THR A CG2 1 +ATOM 114 N N . ARG A 1 15 ? 20.091 10.608 19.523 1.00 8.40 ? 14 ARG A N 1 +ATOM 115 C CA . ARG A 1 15 ? 18.956 11.505 19.416 1.00 8.49 ? 14 ARG A CA 1 +ATOM 116 C C . ARG A 1 15 ? 19.352 12.977 19.581 1.00 7.98 ? 14 ARG A C 1 +ATOM 117 O O . ARG A 1 15 ? 19.618 13.439 20.689 1.00 9.51 ? 14 ARG A O 1 +ATOM 118 C CB . ARG A 1 15 ? 17.876 11.104 20.424 1.00 8.59 ? 14 ARG A CB 1 +ATOM 119 C CG . ARG A 1 15 ? 16.542 11.829 20.318 1.00 10.25 ? 14 ARG A CG 1 +ATOM 120 C CD . ARG A 1 15 ? 15.640 11.382 21.387 1.00 10.90 ? 14 ARG A CD 1 +ATOM 121 N NE . ARG A 1 15 ? 14.292 11.933 21.346 1.00 12.69 ? 14 ARG A NE 1 +ATOM 122 C CZ . ARG A 1 15 ? 13.853 12.924 22.116 1.00 11.16 ? 14 ARG A CZ 1 +ATOM 123 N NH1 . ARG A 1 15 ? 14.624 13.559 22.958 1.00 10.35 ? 14 ARG A NH1 1 +ATOM 124 N NH2 . ARG A 1 15 ? 12.571 13.285 21.997 1.00 12.67 ? 14 ARG A NH2 1 +ATOM 125 N N . VAL A 1 16 ? 19.394 13.696 18.470 1.00 7.65 ? 15 VAL A N 1 +ATOM 126 C CA . VAL A 1 16 ? 19.910 15.045 18.381 1.00 8.23 ? 15 VAL A CA 1 +ATOM 127 C C . VAL A 1 16 ? 18.758 16.027 18.272 1.00 8.06 ? 15 VAL A C 1 +ATOM 128 O O . VAL A 1 16 ? 17.903 15.872 17.403 1.00 8.98 ? 15 VAL A O 1 +ATOM 129 C CB . VAL A 1 16 ? 20.828 15.156 17.146 1.00 8.83 ? 15 VAL A CB 1 +ATOM 130 C CG1 . VAL A 1 16 ? 21.289 16.586 16.920 1.00 9.34 ? 15 VAL A CG1 1 +ATOM 131 C CG2 . VAL A 1 16 ? 22.017 14.242 17.348 1.00 11.04 ? 15 VAL A CG2 1 +ATOM 132 N N . PHE A 1 17 ? 18.741 17.036 19.130 1.00 7.95 ? 16 PHE A N 1 +ATOM 133 C CA . PHE A 1 17 ? 17.837 18.164 18.974 1.00 7.78 ? 16 PHE A CA 1 +ATOM 134 C C . PHE A 1 17 ? 18.402 19.120 17.941 1.00 7.60 ? 16 PHE A C 1 +ATOM 135 O O . PHE A 1 17 ? 19.583 19.428 17.942 1.00 8.13 ? 16 PHE A O 1 +ATOM 136 C CB . PHE A 1 17 ? 17.686 18.921 20.293 1.00 7.37 ? 16 PHE A CB 1 +ATOM 137 C CG . PHE A 1 17 ? 16.824 20.158 20.192 1.00 7.96 ? 16 PHE A CG 1 +ATOM 138 C CD1 . PHE A 1 17 ? 15.467 20.026 20.013 1.00 8.20 ? 16 PHE A CD1 1 +ATOM 139 C CD2 . PHE A 1 17 ? 17.361 21.445 20.295 1.00 9.08 ? 16 PHE A CD2 1 +ATOM 140 C CE1 . PHE A 1 17 ? 14.671 21.126 19.879 1.00 9.69 ? 16 PHE A CE1 1 +ATOM 141 C CE2 . PHE A 1 17 ? 16.576 22.564 20.187 1.00 10.02 ? 16 PHE A CE2 1 +ATOM 142 C CZ . PHE A 1 17 ? 15.193 22.397 20.004 1.00 8.13 ? 16 PHE A CZ 1 +ATOM 143 N N . GLN A 1 18 ? 17.538 19.592 17.042 1.00 8.32 ? 17 GLN A N 1 +ATOM 144 C CA . GLN A 1 18 ? 17.938 20.653 16.127 1.00 8.58 ? 17 GLN A CA 1 +ATOM 145 C C . GLN A 1 18 ? 16.862 21.653 15.867 1.00 8.02 ? 17 GLN A C 1 +ATOM 146 O O . GLN A 1 18 ? 15.669 21.373 16.003 1.00 7.94 ? 17 GLN A O 1 +ATOM 147 C CB . GLN A 1 18 ? 18.432 20.076 14.773 1.00 9.31 ? 17 GLN A CB 1 +ATOM 148 C CG . GLN A 1 18 ? 17.333 19.470 13.907 1.00 9.46 ? 17 GLN A CG 1 +ATOM 149 C CD . GLN A 1 18 ? 17.854 18.991 12.541 1.00 8.96 ? 17 GLN A CD 1 +ATOM 150 O OE1 . GLN A 1 18 ? 19.045 19.043 12.269 1.00 10.85 ? 17 GLN A OE1 1 +ATOM 151 N NE2 . GLN A 1 18 ? 16.972 18.451 11.698 1.00 9.72 ? 17 GLN A NE2 1 +ATOM 152 N N . ARG A 1 19 ? 17.303 22.819 15.455 1.00 8.39 ? 18 ARG A N 1 +ATOM 153 C CA . ARG A 1 19 ? 16.457 23.917 14.968 1.00 8.39 ? 18 ARG A CA 1 +ATOM 154 C C . ARG A 1 19 ? 16.833 24.211 13.539 1.00 8.20 ? 18 ARG A C 1 +ATOM 155 O O . ARG A 1 19 ? 18.006 24.245 13.206 1.00 9.87 ? 18 ARG A O 1 +ATOM 156 C CB . ARG A 1 19 ? 16.688 25.149 15.825 1.00 9.11 ? 18 ARG A CB 1 +ATOM 157 C CG . ARG A 1 19 ? 16.698 24.849 17.324 1.00 9.68 ? 18 ARG A CG 1 +ATOM 158 C CD . ARG A 1 19 ? 16.937 26.086 18.134 1.00 10.82 ? 18 ARG A CD 1 +ATOM 159 N NE . ARG A 1 19 ? 15.741 26.926 18.226 1.00 10.14 ? 18 ARG A NE 1 +ATOM 160 C CZ . ARG A 1 19 ? 15.778 28.245 18.432 1.00 10.23 ? 18 ARG A CZ 1 +ATOM 161 N NH1 . ARG A 1 19 ? 16.935 28.892 18.414 1.00 11.49 ? 18 ARG A NH1 1 +ATOM 162 N NH2 . ARG A 1 19 ? 14.634 28.916 18.563 1.00 14.20 ? 18 ARG A NH2 1 +ATOM 163 N N . LYS A 1 20 ? 15.823 24.405 12.673 1.00 10.25 ? 19 LYS A N 1 +ATOM 164 C CA . LYS A 1 20 ? 16.148 24.648 11.271 1.00 9.55 ? 19 LYS A CA 1 +ATOM 165 C C . LYS A 1 20 ? 15.141 25.568 10.625 1.00 10.51 ? 19 LYS A C 1 +ATOM 166 O O . LYS A 1 20 ? 14.017 25.592 11.046 1.00 11.71 ? 19 LYS A O 1 +ATOM 167 C CB . LYS A 1 20 ? 16.247 23.342 10.476 1.00 8.97 ? 19 LYS A CB 1 +ATOM 168 C CG . LYS A 1 20 ? 14.932 22.634 10.312 1.00 10.89 ? 19 LYS A CG 1 +ATOM 169 C CD . LYS A 1 20 ? 15.107 21.275 9.662 1.00 11.76 ? 19 LYS A CD 1 +ATOM 170 C CE . LYS A 1 20 ? 13.766 20.626 9.339 1.00 12.84 ? 19 LYS A CE 1 +ATOM 171 N NZ . LYS A 1 20 ? 13.880 19.180 8.916 1.00 13.33 ? 19 LYS A NZ 1 +HETATM 172 N N . MSE A 1 21 ? 15.604 26.316 9.632 1.00 10.32 ? 20 MSE A N 1 +HETATM 173 C CA . MSE A 1 21 ? 14.734 27.129 8.776 1.00 10.86 ? 20 MSE A CA 1 +HETATM 174 C C . MSE A 1 21 ? 15.149 26.873 7.332 1.00 9.76 ? 20 MSE A C 1 +HETATM 175 O O . MSE A 1 21 ? 16.195 27.285 6.904 1.00 12.41 ? 20 MSE A O 1 +HETATM 176 C CB . MSE A 1 21 ? 14.886 28.584 9.148 1.00 10.26 ? 20 MSE A CB 1 +HETATM 177 C CG . MSE A 1 21 ? 13.928 29.505 8.382 1.00 12.18 ? 20 MSE A CG 1 +HETATM 178 SE SE . MSE A 1 21 ? 13.829 31.342 8.980 0.75 13.32 ? 20 MSE A SE 1 +HETATM 179 C CE . MSE A 1 21 ? 12.711 31.165 10.523 1.00 13.09 ? 20 MSE A CE 1 +ATOM 180 N N . VAL A 1 22 ? 14.310 26.121 6.643 1.00 15.14 ? 21 VAL A N 1 +ATOM 181 C CA . VAL A 1 22 ? 14.718 25.651 5.321 1.00 14.69 ? 21 VAL A CA 1 +ATOM 182 C C . VAL A 1 22 ? 13.559 25.742 4.314 1.00 14.64 ? 21 VAL A C 1 +ATOM 183 O O . VAL A 1 22 ? 12.399 25.717 4.697 1.00 15.88 ? 21 VAL A O 1 +ATOM 184 C CB . VAL A 1 22 ? 15.205 24.180 5.408 1.00 18.04 ? 21 VAL A CB 1 +ATOM 185 C CG1 . VAL A 1 22 ? 16.359 24.028 6.453 1.00 15.48 ? 21 VAL A CG1 1 +ATOM 186 C CG2 . VAL A 1 22 ? 14.082 23.304 5.771 1.00 14.48 ? 21 VAL A CG2 1 +ATOM 187 N N A THR A 1 23 ? 13.919 25.782 3.046 0.50 16.15 ? 22 THR A N 1 +ATOM 188 N N B THR A 1 23 ? 13.954 25.863 3.043 0.50 14.66 ? 22 THR A N 1 +ATOM 189 C CA A THR A 1 23 ? 12.955 25.615 1.958 0.50 17.04 ? 22 THR A CA 1 +ATOM 190 C CA B THR A 1 23 ? 13.082 25.680 1.853 0.50 14.72 ? 22 THR A CA 1 +ATOM 191 C C A THR A 1 23 ? 13.661 24.819 0.862 0.50 15.98 ? 22 THR A C 1 +ATOM 192 C C B THR A 1 23 ? 13.722 24.661 0.933 0.50 14.64 ? 22 THR A C 1 +ATOM 193 O O A THR A 1 23 ? 14.857 24.999 0.647 0.50 16.31 ? 22 THR A O 1 +ATOM 194 O O B THR A 1 23 ? 14.934 24.503 0.899 0.50 16.80 ? 22 THR A O 1 +ATOM 195 C CB A THR A 1 23 ? 12.428 26.981 1.481 0.50 15.52 ? 22 THR A CB 1 +ATOM 196 C CB B THR A 1 23 ? 12.919 26.979 1.056 0.50 13.19 ? 22 THR A CB 1 +ATOM 197 O OG1 A THR A 1 23 ? 11.421 26.769 0.478 0.50 17.94 ? 22 THR A OG1 1 +ATOM 198 O OG1 B THR A 1 23 ? 14.054 27.178 0.185 0.50 16.83 ? 22 THR A OG1 1 +ATOM 199 C CG2 A THR A 1 23 ? 13.552 27.870 0.933 0.50 17.54 ? 22 THR A CG2 1 +ATOM 200 C CG2 B THR A 1 23 ? 12.765 28.139 1.983 0.50 18.07 ? 22 THR A CG2 1 +ATOM 201 N N . ASP A 1 24 ? 12.904 23.954 0.162 1.00 19.34 ? 23 ASP A N 1 +ATOM 202 C CA . ASP A 1 24 ? 13.455 23.021 -0.835 1.00 21.47 ? 23 ASP A CA 1 +ATOM 203 C C . ASP A 1 24 ? 14.107 23.692 -2.032 1.00 23.69 ? 23 ASP A C 1 +ATOM 204 O O . ASP A 1 24 ? 14.874 23.052 -2.731 1.00 28.86 ? 23 ASP A O 1 +ATOM 205 C CB . ASP A 1 24 ? 12.385 22.014 -1.311 1.00 22.73 ? 23 ASP A CB 1 +ATOM 206 N N . SER A 1 25 ? 13.781 24.972 -2.270 1.00 24.73 ? 24 SER A N 1 +ATOM 207 C CA . SER A 1 25 ? 14.353 25.821 -3.331 1.00 24.50 ? 24 SER A CA 1 +ATOM 208 C C . SER A 1 25 ? 15.746 26.380 -3.086 1.00 21.56 ? 24 SER A C 1 +ATOM 209 O O . SER A 1 25 ? 16.485 26.688 -4.017 1.00 23.94 ? 24 SER A O 1 +ATOM 210 C CB . SER A 1 25 ? 13.445 27.074 -3.557 1.00 24.06 ? 24 SER A CB 1 +ATOM 211 O OG . SER A 1 25 ? 12.119 26.937 -3.014 1.00 29.07 ? 24 SER A OG 1 +ATOM 212 N N A ASN A 1 26 ? 16.116 26.564 -1.815 0.50 18.78 ? 25 ASN A N 1 +ATOM 213 N N B ASN A 1 26 ? 16.098 26.605 -1.821 0.50 20.00 ? 25 ASN A N 1 +ATOM 214 C CA A ASN A 1 26 ? 17.410 27.125 -1.538 0.50 18.45 ? 25 ASN A CA 1 +ATOM 215 C CA B ASN A 1 26 ? 17.378 27.195 -1.556 0.50 20.49 ? 25 ASN A CA 1 +ATOM 216 C C A ASN A 1 26 ? 18.508 26.198 -2.004 0.50 18.86 ? 25 ASN A C 1 +ATOM 217 C C B ASN A 1 26 ? 18.477 26.232 -2.013 0.50 19.90 ? 25 ASN A C 1 +ATOM 218 O O A ASN A 1 26 ? 18.400 24.970 -1.869 0.50 21.08 ? 25 ASN A O 1 +ATOM 219 O O B ASN A 1 26 ? 18.326 25.006 -1.881 0.50 22.51 ? 25 ASN A O 1 +ATOM 220 C CB A ASN A 1 26 ? 17.588 27.455 -0.049 0.50 17.05 ? 25 ASN A CB 1 +ATOM 221 C CB B ASN A 1 26 ? 17.542 27.518 -0.070 0.50 19.76 ? 25 ASN A CB 1 +ATOM 222 C CG A ASN A 1 26 ? 16.881 28.744 0.358 0.50 14.19 ? 25 ASN A CG 1 +ATOM 223 C CG B ASN A 1 26 ? 16.749 28.767 0.400 0.50 22.08 ? 25 ASN A CG 1 +ATOM 224 O OD1 A ASN A 1 26 ? 16.893 29.755 -0.399 0.50 18.49 ? 25 ASN A OD1 1 +ATOM 225 O OD1 B ASN A 1 26 ? 15.925 29.249 -0.384 0.50 17.31 ? 25 ASN A OD1 1 +ATOM 226 N ND2 A ASN A 1 26 ? 16.313 28.750 1.562 0.50 8.21 ? 25 ASN A ND2 1 +ATOM 227 N ND2 B ASN A 1 26 ? 17.016 29.320 1.618 0.50 11.51 ? 25 ASN A ND2 1 +ATOM 228 N N . ARG A 1 27 ? 19.563 26.779 -2.544 1.00 20.08 ? 26 ARG A N 1 +ATOM 229 C CA . ARG A 1 27 ? 20.678 25.998 -3.068 1.00 23.23 ? 26 ARG A CA 1 +ATOM 230 C C . ARG A 1 27 ? 21.921 26.271 -2.250 1.00 22.25 ? 26 ARG A C 1 +ATOM 231 O O . ARG A 1 27 ? 23.052 25.968 -2.657 1.00 25.59 ? 26 ARG A O 1 +ATOM 232 C CB . ARG A 1 27 ? 20.829 26.346 -4.555 1.00 26.28 ? 26 ARG A CB 1 +ATOM 233 C CG . ARG A 1 27 ? 19.579 25.945 -5.351 1.00 29.31 ? 26 ARG A CG 1 +ATOM 234 N N . ARG A 1 28 ? 21.685 26.873 -1.070 1.00 18.81 ? 27 ARG A N 1 +ATOM 235 C CA . ARG A 1 28 ? 22.696 27.231 -0.142 1.00 20.38 ? 27 ARG A CA 1 +ATOM 236 C C . ARG A 1 28 ? 22.269 26.754 1.253 1.00 11.44 ? 27 ARG A C 1 +ATOM 237 O O . ARG A 1 28 ? 21.137 26.913 1.634 1.00 15.45 ? 27 ARG A O 1 +ATOM 238 C CB . ARG A 1 28 ? 22.807 28.739 -0.091 1.00 19.05 ? 27 ARG A CB 1 +ATOM 239 C CG . ARG A 1 28 ? 22.909 29.359 -1.481 1.00 20.84 ? 27 ARG A CG 1 +ATOM 240 C CD . ARG A 1 28 ? 23.274 30.819 -1.403 1.00 19.97 ? 27 ARG A CD 1 +ATOM 241 N NE . ARG A 1 28 ? 23.488 31.366 -2.750 1.00 23.38 ? 27 ARG A NE 1 +ATOM 242 N N . SER A 1 29 ? 23.246 26.179 1.952 1.00 14.88 ? 28 SER A N 1 +ATOM 243 C CA . SER A 1 29 ? 23.075 25.744 3.351 1.00 13.65 ? 28 SER A CA 1 +ATOM 244 C C . SER A 1 29 ? 24.153 26.286 4.261 1.00 11.68 ? 28 SER A C 1 +ATOM 245 O O . SER A 1 29 ? 25.322 26.492 3.904 1.00 12.06 ? 28 SER A O 1 +ATOM 246 C CB . SER A 1 29 ? 23.109 24.213 3.423 1.00 13.29 ? 28 SER A CB 1 +ATOM 247 O OG . SER A 1 29 ? 22.053 23.668 2.645 1.00 15.45 ? 28 SER A OG 1 +ATOM 248 N N . ILE A 1 30 ? 23.735 26.529 5.519 1.00 12.29 ? 29 ILE A N 1 +ATOM 249 C CA . ILE A 1 30 ? 24.648 26.841 6.583 1.00 11.53 ? 29 ILE A CA 1 +ATOM 250 C C . ILE A 1 30 ? 24.193 26.100 7.854 1.00 10.36 ? 29 ILE A C 1 +ATOM 251 O O . ILE A 1 30 ? 23.004 25.989 8.137 1.00 11.35 ? 29 ILE A O 1 +ATOM 252 C CB . ILE A 1 30 ? 24.803 28.385 6.836 1.00 12.14 ? 29 ILE A CB 1 +ATOM 253 C CG1 . ILE A 1 30 ? 25.926 28.652 7.839 1.00 11.29 ? 29 ILE A CG1 1 +ATOM 254 C CG2 . ILE A 1 30 ? 23.452 29.007 7.223 1.00 12.80 ? 29 ILE A CG2 1 +ATOM 255 C CD1 . ILE A 1 30 ? 26.264 30.177 8.036 1.00 13.10 ? 29 ILE A CD1 1 +ATOM 256 N N . ALA A 1 31 ? 25.162 25.529 8.537 1.00 9.35 ? 30 ALA A N 1 +ATOM 257 C CA . ALA A 1 31 ? 24.932 24.812 9.809 1.00 8.47 ? 30 ALA A CA 1 +ATOM 258 C C . ALA A 1 31 ? 25.786 25.479 10.887 1.00 9.79 ? 30 ALA A C 1 +ATOM 259 O O . ALA A 1 31 ? 26.933 25.841 10.650 1.00 9.85 ? 30 ALA A O 1 +ATOM 260 C CB . ALA A 1 31 ? 25.300 23.317 9.658 1.00 10.51 ? 30 ALA A CB 1 +ATOM 261 N N . LEU A 1 32 ? 25.188 25.650 12.066 1.00 8.85 ? 31 LEU A N 1 +ATOM 262 C CA . LEU A 1 32 ? 25.707 26.406 13.188 1.00 9.40 ? 31 LEU A CA 1 +ATOM 263 C C . LEU A 1 32 ? 25.979 25.499 14.361 1.00 7.29 ? 31 LEU A C 1 +ATOM 264 O O . LEU A 1 32 ? 25.093 24.753 14.765 1.00 9.37 ? 31 LEU A O 1 +ATOM 265 C CB . LEU A 1 32 ? 24.714 27.471 13.646 1.00 9.35 ? 31 LEU A CB 1 +ATOM 266 C CG . LEU A 1 32 ? 23.960 28.267 12.592 1.00 10.96 ? 31 LEU A CG 1 +ATOM 267 C CD1 . LEU A 1 32 ? 22.989 29.270 13.222 1.00 11.29 ? 31 LEU A CD1 1 +ATOM 268 C CD2 . LEU A 1 32 ? 24.841 28.966 11.613 1.00 12.58 ? 31 LEU A CD2 1 +ATOM 269 N N . PHE A 1 33 ? 27.178 25.602 14.928 1.00 8.14 ? 32 PHE A N 1 +ATOM 270 C CA . PHE A 1 33 ? 27.650 24.705 16.027 1.00 8.90 ? 32 PHE A CA 1 +ATOM 271 C C . PHE A 1 33 ? 28.091 25.550 17.208 1.00 10.09 ? 32 PHE A C 1 +ATOM 272 O O . PHE A 1 33 ? 28.970 26.380 17.115 1.00 10.52 ? 32 PHE A O 1 +ATOM 273 C CB . PHE A 1 33 ? 28.739 23.750 15.506 1.00 10.06 ? 32 PHE A CB 1 +ATOM 274 C CG . PHE A 1 33 ? 28.277 22.944 14.342 1.00 9.67 ? 32 PHE A CG 1 +ATOM 275 C CD1 . PHE A 1 33 ? 27.536 21.803 14.521 1.00 9.68 ? 32 PHE A CD1 1 +ATOM 276 C CD2 . PHE A 1 33 ? 28.506 23.387 13.045 1.00 8.86 ? 32 PHE A CD2 1 +ATOM 277 C CE1 . PHE A 1 33 ? 27.044 21.098 13.436 1.00 10.97 ? 32 PHE A CE1 1 +ATOM 278 C CE2 . PHE A 1 33 ? 28.017 22.683 11.984 1.00 9.88 ? 32 PHE A CE2 1 +ATOM 279 C CZ . PHE A 1 33 ? 27.301 21.547 12.166 1.00 9.82 ? 32 PHE A CZ 1 +ATOM 280 N N . HIS A 1 34 ? 27.419 25.326 18.342 1.00 8.36 ? 33 HIS A N 1 +ATOM 281 C CA . HIS A 1 34 ? 27.556 26.141 19.529 1.00 8.82 ? 33 HIS A CA 1 +ATOM 282 C C . HIS A 1 34 ? 28.841 25.861 20.345 1.00 9.66 ? 33 HIS A C 1 +ATOM 283 O O . HIS A 1 34 ? 29.518 24.843 20.209 1.00 8.84 ? 33 HIS A O 1 +ATOM 284 C CB . HIS A 1 34 ? 26.291 25.979 20.374 1.00 8.13 ? 33 HIS A CB 1 +ATOM 285 C CG . HIS A 1 34 ? 26.108 24.606 20.895 1.00 7.71 ? 33 HIS A CG 1 +ATOM 286 N ND1 . HIS A 1 34 ? 26.856 24.107 21.946 1.00 7.91 ? 33 HIS A ND1 1 +ATOM 287 C CD2 . HIS A 1 34 ? 25.285 23.617 20.489 1.00 8.15 ? 33 HIS A CD2 1 +ATOM 288 C CE1 . HIS A 1 34 ? 26.498 22.844 22.132 1.00 9.31 ? 33 HIS A CE1 1 +ATOM 289 N NE2 . HIS A 1 34 ? 25.554 22.519 21.260 1.00 8.30 ? 33 HIS A NE2 1 +ATOM 290 N N . GLY A 1 35 ? 29.091 26.781 21.269 1.00 9.12 ? 34 GLY A N 1 +ATOM 291 C CA . GLY A 1 35 ? 30.141 26.663 22.270 1.00 10.36 ? 34 GLY A CA 1 +ATOM 292 C C . GLY A 1 35 ? 29.729 25.854 23.471 1.00 9.45 ? 34 GLY A C 1 +ATOM 293 O O . GLY A 1 35 ? 28.554 25.505 23.637 1.00 9.21 ? 34 GLY A O 1 +ATOM 294 N N . TYR A 1 36 ? 30.700 25.557 24.306 1.00 9.59 ? 35 TYR A N 1 +ATOM 295 C CA . TYR A 1 36 ? 30.526 24.728 25.487 1.00 8.52 ? 35 TYR A CA 1 +ATOM 296 C C . TYR A 1 36 ? 29.361 25.233 26.379 1.00 9.24 ? 35 TYR A C 1 +ATOM 297 O O . TYR A 1 36 ? 28.628 24.425 26.973 1.00 10.90 ? 35 TYR A O 1 +ATOM 298 C CB . TYR A 1 36 ? 31.821 24.690 26.311 1.00 12.04 ? 35 TYR A CB 1 +ATOM 299 C CG . TYR A 1 36 ? 31.777 23.814 27.521 1.00 13.42 ? 35 TYR A CG 1 +ATOM 300 C CD1 . TYR A 1 36 ? 32.069 22.478 27.424 1.00 15.17 ? 35 TYR A CD1 1 +ATOM 301 C CD2 . TYR A 1 36 ? 31.421 24.335 28.743 1.00 13.65 ? 35 TYR A CD2 1 +ATOM 302 C CE1 . TYR A 1 36 ? 32.011 21.652 28.571 1.00 17.33 ? 35 TYR A CE1 1 +ATOM 303 C CE2 . TYR A 1 36 ? 31.387 23.548 29.877 1.00 15.95 ? 35 TYR A CE2 1 +ATOM 304 C CZ . TYR A 1 36 ? 31.682 22.229 29.768 1.00 16.91 ? 35 TYR A CZ 1 +ATOM 305 O OH . TYR A 1 36 ? 31.626 21.481 30.955 1.00 25.06 ? 35 TYR A OH 1 +ATOM 306 N N . SER A 1 37 ? 29.201 26.567 26.486 1.00 10.62 ? 36 SER A N 1 +ATOM 307 C CA . SER A 1 37 ? 28.340 27.167 27.471 1.00 11.26 ? 36 SER A CA 1 +ATOM 308 C C . SER A 1 37 ? 26.958 27.478 26.948 1.00 10.76 ? 36 SER A C 1 +ATOM 309 O O . SER A 1 37 ? 26.122 27.937 27.732 1.00 12.17 ? 36 SER A O 1 +ATOM 310 C CB . SER A 1 37 ? 28.952 28.456 28.019 1.00 15.20 ? 36 SER A CB 1 +ATOM 311 O OG . SER A 1 37 ? 30.181 28.166 28.689 1.00 20.51 ? 36 SER A OG 1 +ATOM 312 N N . PHE A 1 38 ? 26.714 27.236 25.647 1.00 10.07 ? 37 PHE A N 1 +ATOM 313 C CA . PHE A 1 38 ? 25.453 27.661 25.010 1.00 8.41 ? 37 PHE A CA 1 +ATOM 314 C C . PHE A 1 38 ? 24.862 26.495 24.227 1.00 9.03 ? 37 PHE A C 1 +ATOM 315 O O . PHE A 1 38 ? 25.397 25.372 24.240 1.00 10.44 ? 37 PHE A O 1 +ATOM 316 C CB . PHE A 1 38 ? 25.710 28.868 24.116 1.00 9.01 ? 37 PHE A CB 1 +ATOM 317 C CG . PHE A 1 38 ? 26.329 30.029 24.887 1.00 10.48 ? 37 PHE A CG 1 +ATOM 318 C CD1 . PHE A 1 38 ? 25.549 30.713 25.817 1.00 11.72 ? 37 PHE A CD1 1 +ATOM 319 C CD2 . PHE A 1 38 ? 27.675 30.369 24.750 1.00 11.41 ? 37 PHE A CD2 1 +ATOM 320 C CE1 . PHE A 1 38 ? 26.091 31.720 26.597 1.00 12.85 ? 37 PHE A CE1 1 +ATOM 321 C CE2 . PHE A 1 38 ? 28.213 31.397 25.536 1.00 13.07 ? 37 PHE A CE2 1 +ATOM 322 C CZ . PHE A 1 38 ? 27.422 32.049 26.454 1.00 11.76 ? 37 PHE A CZ 1 +ATOM 323 N N . THR A 1 39 ? 23.688 26.728 23.644 1.00 8.10 ? 38 THR A N 1 +ATOM 324 C CA . THR A 1 39 ? 23.039 25.708 22.839 1.00 7.75 ? 38 THR A CA 1 +ATOM 325 C C . THR A 1 39 ? 22.498 26.314 21.569 1.00 7.73 ? 38 THR A C 1 +ATOM 326 O O . THR A 1 39 ? 22.655 27.523 21.314 1.00 8.50 ? 38 THR A O 1 +ATOM 327 C CB . THR A 1 39 ? 21.884 24.988 23.615 1.00 8.08 ? 38 THR A CB 1 +ATOM 328 O OG1 . THR A 1 39 ? 20.695 25.797 23.708 1.00 10.28 ? 38 THR A OG1 1 +ATOM 329 C CG2 . THR A 1 39 ? 22.315 24.544 24.996 1.00 9.48 ? 38 THR A CG2 1 +ATOM 330 N N . SER A 1 40 ? 21.769 25.511 20.775 1.00 8.52 ? 39 SER A N 1 +ATOM 331 C CA . SER A 1 40 ? 21.120 26.014 19.574 1.00 8.13 ? 39 SER A CA 1 +ATOM 332 C C . SER A 1 40 ? 20.053 27.060 19.868 1.00 7.67 ? 39 SER A C 1 +ATOM 333 O O . SER A 1 40 ? 19.696 27.836 18.953 1.00 9.37 ? 39 SER A O 1 +ATOM 334 C CB . SER A 1 40 ? 20.510 24.873 18.781 1.00 7.95 ? 39 SER A CB 1 +ATOM 335 O OG . SER A 1 40 ? 19.472 24.273 19.514 1.00 9.59 ? 39 SER A OG 1 +HETATM 336 N N . MSE A 1 41 ? 19.554 27.130 21.110 1.00 8.07 ? 40 MSE A N 1 +HETATM 337 C CA . MSE A 1 41 ? 18.601 28.188 21.492 1.00 8.67 ? 40 MSE A CA 1 +HETATM 338 C C . MSE A 1 41 ? 19.243 29.570 21.480 1.00 8.97 ? 40 MSE A C 1 +HETATM 339 O O . MSE A 1 41 ? 18.559 30.572 21.227 1.00 10.09 ? 40 MSE A O 1 +HETATM 340 C CB . MSE A 1 41 ? 17.978 27.913 22.856 1.00 10.51 ? 40 MSE A CB 1 +HETATM 341 C CG . MSE A 1 41 ? 17.251 26.602 22.959 1.00 8.73 ? 40 MSE A CG 1 +HETATM 342 SE SE . MSE A 1 41 ? 15.694 26.493 21.797 0.75 13.49 ? 40 MSE A SE 1 +HETATM 343 C CE . MSE A 1 41 ? 14.693 27.910 22.602 1.00 20.86 ? 40 MSE A CE 1 +ATOM 344 N N . ASP A 1 42 ? 20.548 29.636 21.713 1.00 8.81 ? 41 ASP A N 1 +ATOM 345 C CA . ASP A 1 42 ? 21.178 30.925 21.933 1.00 7.81 ? 41 ASP A CA 1 +ATOM 346 C C . ASP A 1 42 ? 21.397 31.737 20.669 1.00 8.26 ? 41 ASP A C 1 +ATOM 347 O O . ASP A 1 42 ? 21.680 32.935 20.745 1.00 9.69 ? 41 ASP A O 1 +ATOM 348 C CB . ASP A 1 42 ? 22.447 30.729 22.732 1.00 9.33 ? 41 ASP A CB 1 +ATOM 349 C CG . ASP A 1 42 ? 22.140 30.311 24.121 1.00 8.89 ? 41 ASP A CG 1 +ATOM 350 O OD1 . ASP A 1 42 ? 21.648 31.164 24.900 1.00 11.55 ? 41 ASP A OD1 1 +ATOM 351 O OD2 . ASP A 1 42 ? 22.334 29.147 24.496 1.00 9.94 ? 41 ASP A OD2 1 +ATOM 352 N N . TRP A 1 43 ? 21.243 31.138 19.490 1.00 8.92 ? 42 TRP A N 1 +ATOM 353 C CA . TRP A 1 43 ? 21.291 31.832 18.240 1.00 9.11 ? 42 TRP A CA 1 +ATOM 354 C C . TRP A 1 43 ? 20.048 32.756 18.094 1.00 9.35 ? 42 TRP A C 1 +ATOM 355 O O . TRP A 1 43 ? 20.032 33.567 17.154 1.00 9.39 ? 42 TRP A O 1 +ATOM 356 C CB . TRP A 1 43 ? 21.325 30.828 17.061 1.00 9.01 ? 42 TRP A CB 1 +ATOM 357 C CG . TRP A 1 43 ? 22.403 29.777 17.106 1.00 8.07 ? 42 TRP A CG 1 +ATOM 358 C CD1 . TRP A 1 43 ? 22.186 28.438 17.017 1.00 8.43 ? 42 TRP A CD1 1 +ATOM 359 C CD2 . TRP A 1 43 ? 23.844 29.949 17.225 1.00 7.62 ? 42 TRP A CD2 1 +ATOM 360 N NE1 . TRP A 1 43 ? 23.387 27.761 17.081 1.00 8.45 ? 42 TRP A NE1 1 +ATOM 361 C CE2 . TRP A 1 43 ? 24.415 28.654 17.221 1.00 9.03 ? 42 TRP A CE2 1 +ATOM 362 C CE3 . TRP A 1 43 ? 24.689 31.052 17.426 1.00 8.94 ? 42 TRP A CE3 1 +ATOM 363 C CZ2 . TRP A 1 43 ? 25.779 28.444 17.285 1.00 9.39 ? 42 TRP A CZ2 1 +ATOM 364 C CZ3 . TRP A 1 43 ? 26.060 30.831 17.493 1.00 8.37 ? 42 TRP A CZ3 1 +ATOM 365 C CH2 . TRP A 1 43 ? 26.588 29.513 17.437 1.00 9.09 ? 42 TRP A CH2 1 +ATOM 366 N N . ASP A 1 44 ? 19.053 32.620 18.957 1.00 10.20 ? 43 ASP A N 1 +ATOM 367 C CA . ASP A 1 44 ? 17.890 33.537 18.958 1.00 9.67 ? 43 ASP A CA 1 +ATOM 368 C C . ASP A 1 44 ? 18.373 34.969 19.181 1.00 9.44 ? 43 ASP A C 1 +ATOM 369 O O . ASP A 1 44 ? 17.746 35.915 18.693 1.00 10.28 ? 43 ASP A O 1 +ATOM 370 C CB . ASP A 1 44 ? 16.910 33.227 20.125 1.00 11.41 ? 43 ASP A CB 1 +ATOM 371 C CG . ASP A 1 44 ? 15.986 32.047 19.900 1.00 14.87 ? 43 ASP A CG 1 +ATOM 372 O OD1 . ASP A 1 44 ? 15.942 31.557 18.764 1.00 15.76 ? 43 ASP A OD1 1 +ATOM 373 O OD2 . ASP A 1 44 ? 15.297 31.707 20.913 1.00 19.43 ? 43 ASP A OD2 1 +ATOM 374 N N . LYS A 1 45 ? 19.430 35.175 19.966 1.00 9.57 ? 44 LYS A N 1 +ATOM 375 C CA . LYS A 1 45 ? 19.763 36.540 20.375 1.00 8.38 ? 44 LYS A CA 1 +ATOM 376 C C . LYS A 1 45 ? 20.111 37.402 19.162 1.00 9.68 ? 44 LYS A C 1 +ATOM 377 O O . LYS A 1 45 ? 19.797 38.596 19.160 1.00 12.38 ? 44 LYS A O 1 +ATOM 378 C CB . LYS A 1 45 ? 20.946 36.497 21.360 1.00 10.77 ? 44 LYS A CB 1 +ATOM 379 C CG . LYS A 1 45 ? 21.435 37.815 21.860 1.00 11.15 ? 44 LYS A CG 1 +ATOM 380 C CD . LYS A 1 45 ? 20.420 38.542 22.738 1.00 8.85 ? 44 LYS A CD 1 +ATOM 381 C CE . LYS A 1 45 ? 20.860 39.959 23.028 1.00 9.48 ? 44 LYS A CE 1 +ATOM 382 N NZ . LYS A 1 45 ? 22.115 39.931 23.890 1.00 8.46 ? 44 LYS A NZ 1 +ATOM 383 N N . ALA A 1 46 ? 20.785 36.816 18.164 1.00 8.16 ? 45 ALA A N 1 +ATOM 384 C CA . ALA A 1 46 ? 21.110 37.502 16.937 1.00 8.48 ? 45 ALA A CA 1 +ATOM 385 C C . ALA A 1 46 ? 20.191 37.183 15.786 1.00 9.83 ? 45 ALA A C 1 +ATOM 386 O O . ALA A 1 46 ? 20.451 37.582 14.632 1.00 12.16 ? 45 ALA A O 1 +ATOM 387 C CB . ALA A 1 46 ? 22.582 37.185 16.571 1.00 10.21 ? 45 ALA A CB 1 +ATOM 388 N N . ASP A 1 47 ? 19.085 36.492 16.072 1.00 10.45 ? 46 ASP A N 1 +ATOM 389 C CA . ASP A 1 47 ? 18.066 36.197 15.064 1.00 9.41 ? 46 ASP A CA 1 +ATOM 390 C C . ASP A 1 47 ? 18.713 35.567 13.826 1.00 10.53 ? 46 ASP A C 1 +ATOM 391 O O . ASP A 1 47 ? 18.392 35.924 12.692 1.00 11.46 ? 46 ASP A O 1 +ATOM 392 C CB . ASP A 1 47 ? 17.302 37.506 14.738 1.00 10.87 ? 46 ASP A CB 1 +ATOM 393 C CG . ASP A 1 47 ? 15.975 37.299 13.978 1.00 17.41 ? 46 ASP A CG 1 +ATOM 394 O OD1 . ASP A 1 47 ? 15.415 36.223 14.016 1.00 16.13 ? 46 ASP A OD1 1 +ATOM 395 O OD2 . ASP A 1 47 ? 15.531 38.277 13.331 1.00 19.82 ? 46 ASP A OD2 1 +ATOM 396 N N . LEU A 1 48 ? 19.623 34.596 14.013 1.00 8.96 ? 47 LEU A N 1 +ATOM 397 C CA . LEU A 1 48 ? 20.421 34.075 12.891 1.00 9.67 ? 47 LEU A CA 1 +ATOM 398 C C . LEU A 1 48 ? 19.646 33.290 11.877 1.00 11.46 ? 47 LEU A C 1 +ATOM 399 O O . LEU A 1 48 ? 19.991 33.300 10.707 1.00 12.04 ? 47 LEU A O 1 +ATOM 400 C CB . LEU A 1 48 ? 21.621 33.299 13.396 1.00 11.15 ? 47 LEU A CB 1 +ATOM 401 C CG . LEU A 1 48 ? 22.648 34.036 14.251 1.00 10.12 ? 47 LEU A CG 1 +ATOM 402 C CD1 . LEU A 1 48 ? 23.855 33.137 14.560 1.00 11.27 ? 47 LEU A CD1 1 +ATOM 403 C CD2 . LEU A 1 48 ? 23.116 35.293 13.532 1.00 10.58 ? 47 LEU A CD2 1 +ATOM 404 N N . PHE A 1 49 ? 18.555 32.641 12.290 1.00 9.41 ? 48 PHE A N 1 +ATOM 405 C CA . PHE A 1 49 ? 17.800 31.853 11.328 1.00 10.14 ? 48 PHE A CA 1 +ATOM 406 C C . PHE A 1 49 ? 17.175 32.782 10.293 1.00 11.21 ? 48 PHE A C 1 +ATOM 407 O O . PHE A 1 49 ? 17.374 32.587 9.094 1.00 11.95 ? 48 PHE A O 1 +ATOM 408 C CB . PHE A 1 49 ? 16.757 30.910 11.969 1.00 8.83 ? 48 PHE A CB 1 +ATOM 409 C CG . PHE A 1 49 ? 17.367 29.939 12.938 1.00 9.26 ? 48 PHE A CG 1 +ATOM 410 C CD1 . PHE A 1 49 ? 17.545 30.307 14.279 1.00 13.17 ? 48 PHE A CD1 1 +ATOM 411 C CD2 . PHE A 1 49 ? 17.766 28.695 12.522 1.00 11.53 ? 48 PHE A CD2 1 +ATOM 412 C CE1 . PHE A 1 49 ? 18.108 29.456 15.205 1.00 14.58 ? 48 PHE A CE1 1 +ATOM 413 C CE2 . PHE A 1 49 ? 18.389 27.824 13.463 1.00 13.61 ? 48 PHE A CE2 1 +ATOM 414 C CZ . PHE A 1 49 ? 18.568 28.247 14.795 1.00 11.59 ? 48 PHE A CZ 1 +ATOM 415 N N . ASN A 1 50 ? 16.468 33.795 10.764 1.00 10.68 ? 49 ASN A N 1 +ATOM 416 C CA . ASN A 1 50 ? 15.849 34.755 9.846 1.00 10.13 ? 49 ASN A CA 1 +ATOM 417 C C . ASN A 1 50 ? 16.918 35.498 9.060 1.00 10.80 ? 49 ASN A C 1 +ATOM 418 O O . ASN A 1 50 ? 16.759 35.687 7.849 1.00 13.02 ? 49 ASN A O 1 +ATOM 419 C CB . ASN A 1 50 ? 14.897 35.714 10.536 1.00 10.38 ? 49 ASN A CB 1 +ATOM 420 C CG . ASN A 1 50 ? 13.635 35.066 10.957 1.00 14.20 ? 49 ASN A CG 1 +ATOM 421 O OD1 . ASN A 1 50 ? 12.929 34.473 10.124 1.00 14.28 ? 49 ASN A OD1 1 +ATOM 422 N ND2 . ASN A 1 50 ? 13.307 35.167 12.253 1.00 15.52 ? 49 ASN A ND2 1 +ATOM 423 N N . ASN A 1 51 ? 17.975 35.956 9.692 1.00 11.65 ? 50 ASN A N 1 +ATOM 424 C CA . ASN A 1 51 ? 18.985 36.731 8.961 1.00 12.66 ? 50 ASN A CA 1 +ATOM 425 C C . ASN A 1 51 ? 19.731 35.958 7.870 1.00 14.22 ? 50 ASN A C 1 +ATOM 426 O O . ASN A 1 51 ? 20.073 36.520 6.804 1.00 15.44 ? 50 ASN A O 1 +ATOM 427 C CB . ASN A 1 51 ? 19.977 37.386 9.927 1.00 14.65 ? 50 ASN A CB 1 +ATOM 428 C CG . ASN A 1 51 ? 19.405 38.628 10.570 1.00 13.83 ? 50 ASN A CG 1 +ATOM 429 O OD1 . ASN A 1 51 ? 19.076 39.587 9.864 1.00 17.16 ? 50 ASN A OD1 1 +ATOM 430 N ND2 . ASN A 1 51 ? 19.424 38.684 11.878 1.00 15.43 ? 50 ASN A ND2 1 +ATOM 431 N N . TYR A 1 52 ? 20.025 34.684 8.102 1.00 13.00 ? 51 TYR A N 1 +ATOM 432 C CA . TYR A 1 52 ? 20.677 33.877 7.063 1.00 13.25 ? 51 TYR A CA 1 +ATOM 433 C C . TYR A 1 52 ? 19.723 33.340 6.047 1.00 14.46 ? 51 TYR A C 1 +ATOM 434 O O . TYR A 1 52 ? 20.093 33.201 4.871 1.00 14.42 ? 51 TYR A O 1 +ATOM 435 C CB . TYR A 1 52 ? 21.532 32.778 7.656 1.00 11.45 ? 51 TYR A CB 1 +ATOM 436 C CG . TYR A 1 52 ? 22.651 33.238 8.562 1.00 11.53 ? 51 TYR A CG 1 +ATOM 437 C CD1 . TYR A 1 52 ? 23.206 34.533 8.477 1.00 10.70 ? 51 TYR A CD1 1 +ATOM 438 C CD2 . TYR A 1 52 ? 23.191 32.395 9.551 1.00 11.01 ? 51 TYR A CD2 1 +ATOM 439 C CE1 . TYR A 1 52 ? 24.194 34.938 9.324 1.00 10.77 ? 51 TYR A CE1 1 +ATOM 440 C CE2 . TYR A 1 52 ? 24.215 32.801 10.379 1.00 12.31 ? 51 TYR A CE2 1 +ATOM 441 C CZ . TYR A 1 52 ? 24.717 34.093 10.287 1.00 9.95 ? 51 TYR A CZ 1 +ATOM 442 O OH . TYR A 1 52 ? 25.703 34.433 11.161 1.00 11.58 ? 51 TYR A OH 1 +ATOM 443 N N . SER A 1 53 ? 18.481 33.082 6.439 1.00 11.99 ? 52 SER A N 1 +ATOM 444 C CA . SER A 1 53 ? 17.456 32.658 5.500 1.00 12.42 ? 52 SER A CA 1 +ATOM 445 C C . SER A 1 53 ? 17.141 33.735 4.459 1.00 14.07 ? 52 SER A C 1 +ATOM 446 O O . SER A 1 53 ? 16.816 33.440 3.315 1.00 16.52 ? 52 SER A O 1 +ATOM 447 C CB . SER A 1 53 ? 16.190 32.265 6.260 1.00 13.88 ? 52 SER A CB 1 +ATOM 448 O OG . SER A 1 53 ? 15.254 31.727 5.385 1.00 17.36 ? 52 SER A OG 1 +ATOM 449 N N . LYS A 1 54 ? 17.200 34.996 4.876 1.00 13.41 ? 53 LYS A N 1 +ATOM 450 C CA . LYS A 1 54 ? 16.836 36.105 4.008 1.00 15.93 ? 53 LYS A CA 1 +ATOM 451 C C . LYS A 1 54 ? 17.863 36.324 2.910 1.00 13.77 ? 53 LYS A C 1 +ATOM 452 O O . LYS A 1 54 ? 17.536 37.062 1.952 1.00 16.04 ? 53 LYS A O 1 +ATOM 453 C CB . LYS A 1 54 ? 16.659 37.377 4.842 1.00 16.70 ? 53 LYS A CB 1 +ATOM 454 C CG . LYS A 1 54 ? 15.283 37.456 5.457 1.00 21.94 ? 53 LYS A CG 1 +ATOM 455 C CD . LYS A 1 54 ? 15.177 38.574 6.501 1.00 24.21 ? 53 LYS A CD 1 +ATOM 456 C CE . LYS A 1 54 ? 13.712 38.790 6.858 1.00 30.37 ? 53 LYS A CE 1 +ATOM 457 N NZ . LYS A 1 54 ? 13.537 39.936 7.814 1.00 33.03 ? 53 LYS A NZ 1 +ATOM 458 N N . ILE A 1 55 ? 19.060 35.752 3.034 1.00 15.03 ? 54 ILE A N 1 +ATOM 459 C CA . ILE A 1 55 ? 20.085 35.789 1.959 1.00 13.89 ? 54 ILE A CA 1 +ATOM 460 C C . ILE A 1 55 ? 20.180 34.412 1.266 1.00 16.16 ? 54 ILE A C 1 +ATOM 461 O O . ILE A 1 55 ? 21.207 34.096 0.675 1.00 17.46 ? 54 ILE A O 1 +ATOM 462 C CB . ILE A 1 55 ? 21.488 36.341 2.435 1.00 16.61 ? 54 ILE A CB 1 +ATOM 463 C CG1 . ILE A 1 55 ? 22.093 35.515 3.563 1.00 14.21 ? 54 ILE A CG1 1 +ATOM 464 C CG2 . ILE A 1 55 ? 21.336 37.813 2.895 1.00 19.67 ? 54 ILE A CG2 1 +ATOM 465 C CD1 . ILE A 1 55 ? 23.554 35.760 3.854 1.00 15.00 ? 54 ILE A CD1 1 +ATOM 466 N N . GLY A 1 56 ? 19.118 33.603 1.365 1.00 17.38 ? 55 GLY A N 1 +ATOM 467 C CA . GLY A 1 56 ? 18.989 32.359 0.599 1.00 18.20 ? 55 GLY A CA 1 +ATOM 468 C C . GLY A 1 56 ? 19.670 31.101 1.117 1.00 21.44 ? 55 GLY A C 1 +ATOM 469 O O . GLY A 1 56 ? 19.782 30.124 0.381 1.00 20.10 ? 55 GLY A O 1 +ATOM 470 N N . TYR A 1 57 ? 20.109 31.111 2.381 1.00 18.69 ? 56 TYR A N 1 +ATOM 471 C CA . TYR A 1 57 ? 20.653 29.913 3.037 1.00 17.67 ? 56 TYR A CA 1 +ATOM 472 C C . TYR A 1 57 ? 19.573 29.114 3.799 1.00 16.07 ? 56 TYR A C 1 +ATOM 473 O O . TYR A 1 57 ? 18.748 29.660 4.528 1.00 17.80 ? 56 TYR A O 1 +ATOM 474 C CB . TYR A 1 57 ? 21.804 30.282 3.996 1.00 17.25 ? 56 TYR A CB 1 +ATOM 475 C CG . TYR A 1 57 ? 23.119 30.635 3.332 1.00 17.26 ? 56 TYR A CG 1 +ATOM 476 C CD1 . TYR A 1 57 ? 23.326 31.904 2.759 1.00 19.65 ? 56 TYR A CD1 1 +ATOM 477 C CD2 . TYR A 1 57 ? 24.179 29.754 3.243 1.00 17.59 ? 56 TYR A CD2 1 +ATOM 478 C CE1 . TYR A 1 57 ? 24.532 32.245 2.145 1.00 19.89 ? 56 TYR A CE1 1 +ATOM 479 C CE2 . TYR A 1 57 ? 25.391 30.099 2.636 1.00 21.14 ? 56 TYR A CE2 1 +ATOM 480 C CZ . TYR A 1 57 ? 25.581 31.334 2.028 1.00 11.97 ? 56 TYR A CZ 1 +ATOM 481 O OH . TYR A 1 57 ? 26.795 31.682 1.466 1.00 22.59 ? 56 TYR A OH 1 +ATOM 482 N N . ASN A 1 58 ? 19.572 27.792 3.613 1.00 13.78 ? 57 ASN A N 1 +ATOM 483 C CA . ASN A 1 58 ? 18.911 26.870 4.536 1.00 14.38 ? 57 ASN A CA 1 +ATOM 484 C C . ASN A 1 58 ? 19.785 26.825 5.788 1.00 10.32 ? 57 ASN A C 1 +ATOM 485 O O . ASN A 1 58 ? 20.987 26.654 5.688 1.00 12.92 ? 57 ASN A O 1 +ATOM 486 C CB . ASN A 1 58 ? 18.768 25.490 3.901 1.00 14.15 ? 57 ASN A CB 1 +ATOM 487 C CG . ASN A 1 58 ? 17.614 25.431 2.940 1.00 14.32 ? 57 ASN A CG 1 +ATOM 488 O OD1 . ASN A 1 58 ? 16.722 26.266 2.968 1.00 14.42 ? 57 ASN A OD1 1 +ATOM 489 N ND2 . ASN A 1 58 ? 17.589 24.390 2.139 1.00 15.80 ? 57 ASN A ND2 1 +ATOM 490 N N . VAL A 1 59 ? 19.144 26.968 6.948 1.00 10.39 ? 58 VAL A N 1 +ATOM 491 C CA . VAL A 1 59 ? 19.858 27.094 8.231 1.00 9.51 ? 58 VAL A CA 1 +ATOM 492 C C . VAL A 1 59 ? 19.540 25.917 9.169 1.00 8.14 ? 58 VAL A C 1 +ATOM 493 O O . VAL A 1 59 ? 18.393 25.623 9.433 1.00 9.77 ? 58 VAL A O 1 +ATOM 494 C CB . VAL A 1 59 ? 19.517 28.411 8.934 1.00 8.49 ? 58 VAL A CB 1 +ATOM 495 C CG1 . VAL A 1 59 ? 20.416 28.624 10.159 1.00 10.04 ? 58 VAL A CG1 1 +ATOM 496 C CG2 . VAL A 1 59 ? 19.635 29.589 7.957 1.00 10.84 ? 58 VAL A CG2 1 +ATOM 497 N N . TYR A 1 60 ? 20.607 25.306 9.676 1.00 9.98 ? 59 TYR A N 1 +ATOM 498 C CA . TYR A 1 60 ? 20.483 24.143 10.577 1.00 10.22 ? 59 TYR A CA 1 +ATOM 499 C C . TYR A 1 60 ? 21.314 24.405 11.824 1.00 10.08 ? 59 TYR A C 1 +ATOM 500 O O . TYR A 1 60 ? 22.427 24.902 11.710 1.00 9.46 ? 59 TYR A O 1 +ATOM 501 C CB . TYR A 1 60 ? 21.054 22.896 9.905 1.00 9.10 ? 59 TYR A CB 1 +ATOM 502 C CG . TYR A 1 60 ? 20.387 22.534 8.600 1.00 10.27 ? 59 TYR A CG 1 +ATOM 503 C CD1 . TYR A 1 60 ? 20.801 23.087 7.404 1.00 10.17 ? 59 TYR A CD1 1 +ATOM 504 C CD2 . TYR A 1 60 ? 19.317 21.676 8.584 1.00 9.90 ? 59 TYR A CD2 1 +ATOM 505 C CE1 . TYR A 1 60 ? 20.175 22.750 6.205 1.00 10.41 ? 59 TYR A CE1 1 +ATOM 506 C CE2 . TYR A 1 60 ? 18.697 21.328 7.367 1.00 10.54 ? 59 TYR A CE2 1 +ATOM 507 C CZ . TYR A 1 60 ? 19.132 21.892 6.210 1.00 11.82 ? 59 TYR A CZ 1 +ATOM 508 O OH . TYR A 1 60 ? 18.507 21.574 4.992 1.00 13.50 ? 59 TYR A OH 1 +ATOM 509 N N . ALA A 1 61 ? 20.804 24.068 13.008 1.00 8.34 ? 60 ALA A N 1 +ATOM 510 C CA . ALA A 1 61 ? 21.594 24.248 14.234 1.00 8.38 ? 60 ALA A CA 1 +ATOM 511 C C . ALA A 1 61 ? 21.248 23.148 15.242 1.00 7.76 ? 60 ALA A C 1 +ATOM 512 O O . ALA A 1 61 ? 20.143 23.166 15.789 1.00 8.11 ? 60 ALA A O 1 +ATOM 513 C CB . ALA A 1 61 ? 21.306 25.611 14.862 1.00 8.94 ? 60 ALA A CB 1 +ATOM 514 N N . PRO A 1 62 ? 22.133 22.181 15.471 1.00 8.25 ? 61 PRO A N 1 +ATOM 515 C CA . PRO A 1 62 ? 21.897 21.146 16.496 1.00 7.25 ? 61 PRO A CA 1 +ATOM 516 C C . PRO A 1 62 ? 22.488 21.489 17.849 1.00 8.17 ? 61 PRO A C 1 +ATOM 517 O O . PRO A 1 62 ? 23.411 22.305 17.957 1.00 8.21 ? 61 PRO A O 1 +ATOM 518 C CB . PRO A 1 62 ? 22.639 19.953 15.929 1.00 8.08 ? 61 PRO A CB 1 +ATOM 519 C CG . PRO A 1 62 ? 23.808 20.555 15.223 1.00 7.51 ? 61 PRO A CG 1 +ATOM 520 C CD . PRO A 1 62 ? 23.385 21.945 14.732 1.00 7.91 ? 61 PRO A CD 1 +ATOM 521 N N . ASP A 1 63 ? 21.971 20.823 18.880 1.00 7.47 ? 62 ASP A N 1 +ATOM 522 C CA . ASP A 1 63 ? 22.683 20.714 20.166 1.00 7.01 ? 62 ASP A CA 1 +ATOM 523 C C . ASP A 1 63 ? 23.667 19.561 20.004 1.00 7.30 ? 62 ASP A C 1 +ATOM 524 O O . ASP A 1 63 ? 23.282 18.463 19.554 1.00 8.97 ? 62 ASP A O 1 +ATOM 525 C CB . ASP A 1 63 ? 21.756 20.480 21.325 1.00 7.75 ? 62 ASP A CB 1 +ATOM 526 C CG . ASP A 1 63 ? 20.890 21.682 21.650 1.00 7.99 ? 62 ASP A CG 1 +ATOM 527 O OD1 . ASP A 1 63 ? 21.101 22.768 21.095 1.00 8.05 ? 62 ASP A OD1 1 +ATOM 528 O OD2 . ASP A 1 63 ? 19.969 21.507 22.489 1.00 8.31 ? 62 ASP A OD2 1 +ATOM 529 N N . TYR A 1 64 ? 24.938 19.813 20.286 1.00 8.23 ? 63 TYR A N 1 +ATOM 530 C CA . TYR A 1 64 ? 25.976 18.791 20.158 1.00 8.14 ? 63 TYR A CA 1 +ATOM 531 C C . TYR A 1 64 ? 25.618 17.645 21.113 1.00 8.54 ? 63 TYR A C 1 +ATOM 532 O O . TYR A 1 64 ? 25.191 17.898 22.218 1.00 9.06 ? 63 TYR A O 1 +ATOM 533 C CB . TYR A 1 64 ? 27.376 19.360 20.459 1.00 8.22 ? 63 TYR A CB 1 +ATOM 534 C CG . TYR A 1 64 ? 28.460 18.400 19.950 1.00 8.81 ? 63 TYR A CG 1 +ATOM 535 C CD1 . TYR A 1 64 ? 28.789 18.349 18.608 1.00 7.43 ? 63 TYR A CD1 1 +ATOM 536 C CD2 . TYR A 1 64 ? 28.960 17.435 20.782 1.00 8.74 ? 63 TYR A CD2 1 +ATOM 537 C CE1 . TYR A 1 64 ? 29.613 17.405 18.125 1.00 9.93 ? 63 TYR A CE1 1 +ATOM 538 C CE2 . TYR A 1 64 ? 29.810 16.459 20.292 1.00 8.80 ? 63 TYR A CE2 1 +ATOM 539 C CZ . TYR A 1 64 ? 30.165 16.474 18.978 1.00 7.87 ? 63 TYR A CZ 1 +ATOM 540 O OH . TYR A 1 64 ? 30.953 15.526 18.427 1.00 10.19 ? 63 TYR A OH 1 +ATOM 541 N N . PRO A 1 65 ? 25.820 16.376 20.705 1.00 7.60 ? 64 PRO A N 1 +ATOM 542 C CA . PRO A 1 65 ? 25.598 15.274 21.658 1.00 7.81 ? 64 PRO A CA 1 +ATOM 543 C C . PRO A 1 65 ? 26.235 15.502 23.022 1.00 9.04 ? 64 PRO A C 1 +ATOM 544 O O . PRO A 1 65 ? 27.399 15.845 23.092 1.00 8.73 ? 64 PRO A O 1 +ATOM 545 C CB . PRO A 1 65 ? 26.188 14.058 20.913 1.00 9.21 ? 64 PRO A CB 1 +ATOM 546 C CG . PRO A 1 65 ? 25.931 14.398 19.449 1.00 8.42 ? 64 PRO A CG 1 +ATOM 547 C CD . PRO A 1 65 ? 26.187 15.869 19.350 1.00 8.27 ? 64 PRO A CD 1 +ATOM 548 N N . GLY A 1 66 ? 25.459 15.310 24.081 1.00 8.43 ? 65 GLY A N 1 +ATOM 549 C CA . GLY A 1 66 ? 25.936 15.573 25.405 1.00 7.36 ? 65 GLY A CA 1 +ATOM 550 C C . GLY A 1 66 ? 25.677 16.959 25.918 1.00 8.42 ? 65 GLY A C 1 +ATOM 551 O O . GLY A 1 66 ? 25.927 17.217 27.115 1.00 9.87 ? 65 GLY A O 1 +ATOM 552 N N . PHE A 1 67 ? 25.095 17.832 25.093 1.00 7.84 ? 66 PHE A N 1 +ATOM 553 C CA . PHE A 1 67 ? 24.851 19.240 25.421 1.00 8.11 ? 66 PHE A CA 1 +ATOM 554 C C . PHE A 1 67 ? 23.385 19.541 25.147 1.00 8.14 ? 66 PHE A C 1 +ATOM 555 O O . PHE A 1 67 ? 22.727 18.876 24.350 1.00 9.18 ? 66 PHE A O 1 +ATOM 556 C CB . PHE A 1 67 ? 25.715 20.170 24.550 1.00 7.96 ? 66 PHE A CB 1 +ATOM 557 C CG . PHE A 1 67 ? 27.172 20.081 24.871 1.00 8.56 ? 66 PHE A CG 1 +ATOM 558 C CD1 . PHE A 1 67 ? 27.965 19.038 24.380 1.00 9.88 ? 66 PHE A CD1 1 +ATOM 559 C CD2 . PHE A 1 67 ? 27.755 21.023 25.694 1.00 8.60 ? 66 PHE A CD2 1 +ATOM 560 C CE1 . PHE A 1 67 ? 29.291 18.979 24.679 1.00 10.40 ? 66 PHE A CE1 1 +ATOM 561 C CE2 . PHE A 1 67 ? 29.094 20.939 25.986 1.00 8.86 ? 66 PHE A CE2 1 +ATOM 562 C CZ . PHE A 1 67 ? 29.836 19.892 25.520 1.00 10.64 ? 66 PHE A CZ 1 +ATOM 563 N N . GLY A 1 68 ? 22.869 20.598 25.749 1.00 9.20 ? 67 GLY A N 1 +ATOM 564 C CA . GLY A 1 68 ? 21.514 21.068 25.491 1.00 8.34 ? 67 GLY A CA 1 +ATOM 565 C C . GLY A 1 68 ? 20.493 19.967 25.663 1.00 7.00 ? 67 GLY A C 1 +ATOM 566 O O . GLY A 1 68 ? 20.417 19.345 26.712 1.00 9.03 ? 67 GLY A O 1 +ATOM 567 N N . ARG A 1 69 ? 19.720 19.738 24.606 1.00 8.61 ? 68 ARG A N 1 +ATOM 568 C CA . ARG A 1 69 ? 18.622 18.759 24.584 1.00 8.06 ? 68 ARG A CA 1 +ATOM 569 C C . ARG A 1 69 ? 19.014 17.436 23.903 1.00 8.30 ? 68 ARG A C 1 +ATOM 570 O O . ARG A 1 69 ? 18.186 16.553 23.790 1.00 9.44 ? 68 ARG A O 1 +ATOM 571 C CB . ARG A 1 69 ? 17.411 19.345 23.856 1.00 8.76 ? 68 ARG A CB 1 +ATOM 572 C CG . ARG A 1 69 ? 16.749 20.445 24.648 1.00 9.20 ? 68 ARG A CG 1 +ATOM 573 C CD . ARG A 1 69 ? 15.747 21.179 23.731 1.00 10.40 ? 68 ARG A CD 1 +ATOM 574 N NE . ARG A 1 69 ? 14.729 21.833 24.523 1.00 10.35 ? 68 ARG A NE 1 +ATOM 575 C CZ . ARG A 1 69 ? 14.824 23.055 25.050 1.00 11.19 ? 68 ARG A CZ 1 +ATOM 576 N NH1 . ARG A 1 69 ? 15.936 23.770 24.947 1.00 10.42 ? 68 ARG A NH1 1 +ATOM 577 N NH2 . ARG A 1 69 ? 13.820 23.487 25.812 1.00 10.12 ? 68 ARG A NH2 1 +ATOM 578 N N . SER A 1 70 ? 20.273 17.279 23.505 1.00 7.40 ? 69 SER A N 1 +ATOM 579 C CA . SER A 1 70 ? 20.706 16.100 22.759 1.00 8.13 ? 69 SER A CA 1 +ATOM 580 C C . SER A 1 70 ? 21.211 15.010 23.697 1.00 7.93 ? 69 SER A C 1 +ATOM 581 O O . SER A 1 70 ? 21.847 15.260 24.726 1.00 9.41 ? 69 SER A O 1 +ATOM 582 C CB . SER A 1 70 ? 21.797 16.463 21.755 1.00 8.92 ? 69 SER A CB 1 +ATOM 583 O OG . SER A 1 70 ? 21.233 17.241 20.709 1.00 7.38 ? 69 SER A OG 1 +ATOM 584 N N . ALA A 1 71 ? 21.020 13.773 23.286 1.00 8.09 ? 70 ALA A N 1 +ATOM 585 C CA . ALA A 1 71 ? 21.490 12.654 24.084 1.00 7.67 ? 70 ALA A CA 1 +ATOM 586 C C . ALA A 1 71 ? 22.991 12.627 24.123 1.00 7.84 ? 70 ALA A C 1 +ATOM 587 O O . ALA A 1 71 ? 23.659 13.078 23.163 1.00 9.57 ? 70 ALA A O 1 +ATOM 588 C CB . ALA A 1 71 ? 20.936 11.339 23.471 1.00 9.07 ? 70 ALA A CB 1 +ATOM 589 N N . SER A 1 72 ? 23.523 12.046 25.210 1.00 8.51 ? 71 SER A N 1 +ATOM 590 C CA . SER A 1 72 ? 24.921 11.664 25.222 1.00 9.15 ? 71 SER A CA 1 +ATOM 591 C C . SER A 1 72 ? 25.205 10.646 24.127 1.00 11.14 ? 71 SER A C 1 +ATOM 592 O O . SER A 1 72 ? 24.315 9.988 23.616 1.00 11.34 ? 71 SER A O 1 +ATOM 593 C CB . SER A 1 72 ? 25.230 11.032 26.555 1.00 12.53 ? 71 SER A CB 1 +ATOM 594 O OG . SER A 1 72 ? 25.075 11.981 27.621 1.00 17.17 ? 71 SER A OG 1 +ATOM 595 N N . SER A 1 73 ? 26.460 10.504 23.741 1.00 9.48 ? 72 SER A N 1 +ATOM 596 C CA . SER A 1 73 ? 26.793 9.663 22.573 1.00 9.70 ? 72 SER A CA 1 +ATOM 597 C C . SER A 1 73 ? 28.164 9.015 22.723 1.00 9.45 ? 72 SER A C 1 +ATOM 598 O O . SER A 1 73 ? 29.168 9.719 22.900 1.00 10.20 ? 72 SER A O 1 +ATOM 599 C CB . SER A 1 73 ? 26.781 10.473 21.303 1.00 8.80 ? 72 SER A CB 1 +ATOM 600 O OG . SER A 1 73 ? 27.129 9.643 20.186 1.00 9.99 ? 72 SER A OG 1 +ATOM 601 N N . GLU A 1 74 ? 28.246 7.693 22.586 1.00 8.77 ? 73 GLU A N 1 +ATOM 602 C CA . GLU A 1 74 ? 29.540 7.045 22.534 1.00 9.12 ? 73 GLU A CA 1 +ATOM 603 C C . GLU A 1 74 ? 30.276 7.385 21.267 1.00 11.05 ? 73 GLU A C 1 +ATOM 604 O O . GLU A 1 74 ? 31.485 7.598 21.318 1.00 13.02 ? 73 GLU A O 1 +ATOM 605 C CB . GLU A 1 74 ? 29.411 5.521 22.645 1.00 9.72 ? 73 GLU A CB 1 +ATOM 606 C CG . GLU A 1 74 ? 28.887 5.078 23.996 1.00 9.88 ? 73 GLU A CG 1 +ATOM 607 C CD . GLU A 1 74 ? 28.582 3.616 24.076 1.00 11.79 ? 73 GLU A CD 1 +ATOM 608 O OE1 . GLU A 1 74 ? 29.378 2.803 23.583 1.00 12.31 ? 73 GLU A OE1 1 +ATOM 609 O OE2 . GLU A 1 74 ? 27.516 3.256 24.626 1.00 10.47 ? 73 GLU A OE2 1 +ATOM 610 N N . LYS A 1 75 ? 29.580 7.393 20.135 1.00 11.34 ? 74 LYS A N 1 +ATOM 611 C CA . LYS A 1 75 ? 30.218 7.637 18.837 1.00 11.54 ? 74 LYS A CA 1 +ATOM 612 C C . LYS A 1 75 ? 30.752 9.082 18.691 1.00 11.31 ? 74 LYS A C 1 +ATOM 613 O O . LYS A 1 75 ? 31.835 9.328 18.092 1.00 11.87 ? 74 LYS A O 1 +ATOM 614 C CB . LYS A 1 75 ? 29.177 7.359 17.735 1.00 11.51 ? 74 LYS A CB 1 +ATOM 615 C CG . LYS A 1 75 ? 29.656 7.506 16.311 1.00 14.77 ? 74 LYS A CG 1 +ATOM 616 C CD . LYS A 1 75 ? 28.598 7.036 15.320 1.00 16.01 ? 74 LYS A CD 1 +ATOM 617 C CE . LYS A 1 75 ? 29.088 7.215 13.898 1.00 19.51 ? 74 LYS A CE 1 +ATOM 618 N NZ . LYS A 1 75 ? 30.107 6.151 13.528 1.00 21.04 ? 74 LYS A NZ 1 +ATOM 619 N N . TYR A 1 76 ? 29.983 10.051 19.202 1.00 9.55 ? 75 TYR A N 1 +ATOM 620 C CA . TYR A 1 76 ? 30.246 11.472 18.954 1.00 9.33 ? 75 TYR A CA 1 +ATOM 621 C C . TYR A 1 76 ? 30.669 12.234 20.169 1.00 10.69 ? 75 TYR A C 1 +ATOM 622 O O . TYR A 1 76 ? 31.002 13.415 20.062 1.00 11.88 ? 75 TYR A O 1 +ATOM 623 C CB . TYR A 1 76 ? 28.983 12.126 18.375 1.00 8.90 ? 75 TYR A CB 1 +ATOM 624 C CG . TYR A 1 76 ? 28.506 11.491 17.070 1.00 8.72 ? 75 TYR A CG 1 +ATOM 625 C CD1 . TYR A 1 76 ? 29.341 11.419 15.957 1.00 10.21 ? 75 TYR A CD1 1 +ATOM 626 C CD2 . TYR A 1 76 ? 27.186 11.012 16.933 1.00 9.78 ? 75 TYR A CD2 1 +ATOM 627 C CE1 . TYR A 1 76 ? 28.900 10.837 14.786 1.00 10.68 ? 75 TYR A CE1 1 +ATOM 628 C CE2 . TYR A 1 76 ? 26.753 10.435 15.765 1.00 12.02 ? 75 TYR A CE2 1 +ATOM 629 C CZ . TYR A 1 76 ? 27.592 10.383 14.683 1.00 10.98 ? 75 TYR A CZ 1 +ATOM 630 O OH . TYR A 1 76 ? 27.115 9.818 13.505 1.00 11.34 ? 75 TYR A OH 1 +ATOM 631 N N . GLY A 1 77 ? 30.655 11.622 21.342 1.00 11.70 ? 76 GLY A N 1 +ATOM 632 C CA . GLY A 1 77 ? 30.894 12.366 22.570 1.00 13.81 ? 76 GLY A CA 1 +ATOM 633 C C . GLY A 1 77 ? 32.287 12.936 22.583 1.00 13.08 ? 76 GLY A C 1 +ATOM 634 O O . GLY A 1 77 ? 33.229 12.331 22.047 1.00 13.33 ? 76 GLY A O 1 +ATOM 635 N N . ILE A 1 78 ? 32.423 14.114 23.190 1.00 11.68 ? 77 ILE A N 1 +ATOM 636 C CA . ILE A 1 78 ? 33.725 14.793 23.247 1.00 15.27 ? 77 ILE A CA 1 +ATOM 637 C C . ILE A 1 78 ? 34.299 14.800 24.654 1.00 18.36 ? 77 ILE A C 1 +ATOM 638 O O . ILE A 1 78 ? 35.307 15.475 24.882 1.00 19.03 ? 77 ILE A O 1 +ATOM 639 C CB . ILE A 1 78 ? 33.751 16.188 22.550 1.00 20.00 ? 77 ILE A CB 1 +ATOM 640 C CG1 . ILE A 1 78 ? 32.640 17.083 23.053 1.00 20.25 ? 77 ILE A CG1 1 +ATOM 641 C CG2 . ILE A 1 78 ? 33.698 16.021 21.008 1.00 20.09 ? 77 ILE A CG2 1 +ATOM 642 C CD1 . ILE A 1 78 ? 32.877 17.579 24.395 1.00 25.23 ? 77 ILE A CD1 1 +ATOM 643 N N . ASP A 1 79 ? 33.758 13.980 25.554 1.00 19.49 ? 78 ASP A N 1 +ATOM 644 C CA . ASP A 1 79 ? 34.281 13.873 26.922 1.00 24.49 ? 78 ASP A CA 1 +ATOM 645 C C . ASP A 1 79 ? 35.776 13.595 26.983 1.00 25.91 ? 78 ASP A C 1 +ATOM 646 O O . ASP A 1 79 ? 36.418 14.062 27.921 1.00 28.83 ? 78 ASP A O 1 +ATOM 647 C CB . ASP A 1 79 ? 33.642 12.713 27.682 1.00 26.68 ? 78 ASP A CB 1 +ATOM 648 C CG . ASP A 1 79 ? 32.169 12.875 27.882 1.00 35.41 ? 78 ASP A CG 1 +ATOM 649 O OD1 . ASP A 1 79 ? 31.691 14.030 27.896 1.00 38.43 ? 78 ASP A OD1 1 +ATOM 650 O OD2 . ASP A 1 79 ? 31.495 11.828 28.053 1.00 43.44 ? 78 ASP A OD2 1 +ATOM 651 N N . ARG A 1 80 ? 36.307 12.812 26.033 1.00 24.86 ? 79 ARG A N 1 +ATOM 652 C CA . ARG A 1 80 ? 37.720 12.386 26.056 1.00 27.13 ? 79 ARG A CA 1 +ATOM 653 C C . ARG A 1 80 ? 38.577 13.235 25.145 1.00 29.20 ? 79 ARG A C 1 +ATOM 654 O O . ARG A 1 80 ? 39.710 12.870 24.837 1.00 32.00 ? 79 ARG A O 1 +ATOM 655 C CB . ARG A 1 80 ? 37.865 10.923 25.631 1.00 28.50 ? 79 ARG A CB 1 +ATOM 656 C CG . ARG A 1 80 ? 37.085 9.930 26.468 1.00 30.33 ? 79 ARG A CG 1 +ATOM 657 C CD . ARG A 1 80 ? 37.071 8.546 25.811 1.00 32.91 ? 79 ARG A CD 1 +ATOM 658 N NE . ARG A 1 80 ? 38.397 7.920 25.746 1.00 36.47 ? 79 ARG A NE 1 +ATOM 659 C CZ . ARG A 1 80 ? 38.940 7.160 26.702 1.00 30.52 ? 79 ARG A CZ 1 +ATOM 660 N NH1 . ARG A 1 80 ? 38.291 6.939 27.838 1.00 30.84 ? 79 ARG A NH1 1 +ATOM 661 N NH2 . ARG A 1 80 ? 40.147 6.643 26.515 1.00 37.52 ? 79 ARG A NH2 1 +ATOM 662 N N . GLY A 1 81 ? 38.046 14.351 24.682 1.00 27.25 ? 80 GLY A N 1 +ATOM 663 C CA . GLY A 1 81 ? 38.804 15.290 23.886 1.00 30.08 ? 80 GLY A CA 1 +ATOM 664 C C . GLY A 1 81 ? 39.055 14.869 22.447 1.00 30.44 ? 80 GLY A C 1 +ATOM 665 O O . GLY A 1 81 ? 39.988 15.375 21.819 1.00 31.40 ? 80 GLY A O 1 +ATOM 666 N N . ASP A 1 82 ? 38.237 13.975 21.886 1.00 27.92 ? 81 ASP A N 1 +ATOM 667 C CA . ASP A 1 82 ? 38.512 13.537 20.511 1.00 26.31 ? 81 ASP A CA 1 +ATOM 668 C C . ASP A 1 82 ? 37.755 14.380 19.498 1.00 23.20 ? 81 ASP A C 1 +ATOM 669 O O . ASP A 1 82 ? 36.621 14.094 19.164 1.00 22.98 ? 81 ASP A O 1 +ATOM 670 C CB . ASP A 1 82 ? 38.235 12.055 20.288 1.00 29.21 ? 81 ASP A CB 1 +ATOM 671 C CG . ASP A 1 82 ? 38.857 11.545 18.982 1.00 36.19 ? 81 ASP A CG 1 +ATOM 672 O OD1 . ASP A 1 82 ? 39.449 12.364 18.225 1.00 37.02 ? 81 ASP A OD1 1 +ATOM 673 O OD2 . ASP A 1 82 ? 38.757 10.330 18.721 1.00 42.29 ? 81 ASP A OD2 1 +ATOM 674 N N . LEU A 1 83 ? 38.415 15.391 18.989 1.00 21.56 ? 82 LEU A N 1 +ATOM 675 C CA . LEU A 1 83 ? 37.822 16.308 18.042 1.00 21.19 ? 82 LEU A CA 1 +ATOM 676 C C . LEU A 1 83 ? 37.504 15.645 16.705 1.00 18.19 ? 82 LEU A C 1 +ATOM 677 O O . LEU A 1 83 ? 36.632 16.102 15.961 1.00 15.97 ? 82 LEU A O 1 +ATOM 678 C CB . LEU A 1 83 ? 38.776 17.496 17.859 1.00 22.14 ? 82 LEU A CB 1 +ATOM 679 C CG . LEU A 1 83 ? 38.237 18.853 17.428 1.00 26.92 ? 82 LEU A CG 1 +ATOM 680 C CD1 . LEU A 1 83 ? 39.293 19.966 17.597 1.00 21.84 ? 82 LEU A CD1 1 +ATOM 681 C CD2 . LEU A 1 83 ? 37.841 18.858 16.057 1.00 28.30 ? 82 LEU A CD2 1 +ATOM 682 N N . LYS A 1 84 ? 38.201 14.573 16.370 1.00 17.12 ? 83 LYS A N 1 +ATOM 683 C CA . LYS A 1 84 ? 37.804 13.812 15.184 1.00 15.52 ? 83 LYS A CA 1 +ATOM 684 C C . LYS A 1 84 ? 36.385 13.226 15.352 1.00 14.48 ? 83 LYS A C 1 +ATOM 685 O O . LYS A 1 84 ? 35.731 13.046 14.365 1.00 15.80 ? 83 LYS A O 1 +ATOM 686 C CB . LYS A 1 84 ? 38.858 12.775 14.784 1.00 19.52 ? 83 LYS A CB 1 +ATOM 687 C CG . LYS A 1 84 ? 40.123 13.430 14.202 1.00 22.67 ? 83 LYS A CG 1 +ATOM 688 C CD . LYS A 1 84 ? 41.079 12.419 13.568 1.00 22.60 ? 83 LYS A CD 1 +ATOM 689 N N . HIS A 1 85 ? 35.922 12.959 16.571 1.00 13.34 ? 84 HIS A N 1 +ATOM 690 C CA . HIS A 1 85 ? 34.524 12.563 16.783 1.00 13.22 ? 84 HIS A CA 1 +ATOM 691 C C . HIS A 1 85 ? 33.568 13.642 16.326 1.00 12.46 ? 84 HIS A C 1 +ATOM 692 O O . HIS A 1 85 ? 32.480 13.339 15.825 1.00 11.04 ? 84 HIS A O 1 +ATOM 693 C CB . HIS A 1 85 ? 34.209 12.332 18.262 1.00 16.57 ? 84 HIS A CB 1 +ATOM 694 C CG . HIS A 1 85 ? 34.569 10.982 18.758 1.00 20.15 ? 84 HIS A CG 1 +ATOM 695 N ND1 . HIS A 1 85 ? 34.158 10.514 19.990 1.00 24.64 ? 84 HIS A ND1 1 +ATOM 696 C CD2 . HIS A 1 85 ? 35.250 9.975 18.170 1.00 20.85 ? 84 HIS A CD2 1 +ATOM 697 C CE1 . HIS A 1 85 ? 34.616 9.284 20.155 1.00 32.80 ? 84 HIS A CE1 1 +ATOM 698 N NE2 . HIS A 1 85 ? 35.284 8.935 19.068 1.00 23.59 ? 84 HIS A NE2 1 +ATOM 699 N N . ALA A 1 86 ? 33.944 14.903 16.546 1.00 12.38 ? 85 ALA A N 1 +ATOM 700 C CA . ALA A 1 86 ? 33.101 16.005 16.141 1.00 11.42 ? 85 ALA A CA 1 +ATOM 701 C C . ALA A 1 86 ? 33.081 16.207 14.633 1.00 11.14 ? 85 ALA A C 1 +ATOM 702 O O . ALA A 1 86 ? 32.069 16.591 14.098 1.00 12.55 ? 85 ALA A O 1 +ATOM 703 C CB . ALA A 1 86 ? 33.530 17.285 16.822 1.00 12.80 ? 85 ALA A CB 1 +ATOM 704 N N . ALA A 1 87 ? 34.185 15.932 13.942 1.00 11.40 ? 86 ALA A N 1 +ATOM 705 C CA . ALA A 1 87 ? 34.148 15.962 12.474 1.00 11.41 ? 86 ALA A CA 1 +ATOM 706 C C . ALA A 1 87 ? 33.207 14.909 11.902 1.00 10.19 ? 86 ALA A C 1 +ATOM 707 O O . ALA A 1 87 ? 32.465 15.148 10.943 1.00 12.39 ? 86 ALA A O 1 +ATOM 708 C CB . ALA A 1 87 ? 35.605 15.789 11.901 1.00 12.40 ? 86 ALA A CB 1 +ATOM 709 N N A GLU A 1 88 ? 33.276 13.702 12.471 0.50 10.06 ? 87 GLU A N 1 +ATOM 710 N N B GLU A 1 88 ? 33.261 13.725 12.489 0.50 11.41 ? 87 GLU A N 1 +ATOM 711 C CA A GLU A 1 88 ? 32.313 12.635 12.137 0.50 10.25 ? 87 GLU A CA 1 +ATOM 712 C CA B GLU A 1 88 ? 32.340 12.665 12.117 0.50 12.30 ? 87 GLU A CA 1 +ATOM 713 C C A GLU A 1 88 ? 30.895 13.120 12.374 0.50 9.42 ? 87 GLU A C 1 +ATOM 714 C C B GLU A 1 88 ? 30.891 13.046 12.416 0.50 10.78 ? 87 GLU A C 1 +ATOM 715 O O A GLU A 1 88 ? 30.036 12.999 11.505 0.50 8.85 ? 87 GLU A O 1 +ATOM 716 O O B GLU A 1 88 ? 29.997 12.751 11.637 0.50 11.76 ? 87 GLU A O 1 +ATOM 717 C CB A GLU A 1 88 ? 32.559 11.365 12.957 0.50 11.41 ? 87 GLU A CB 1 +ATOM 718 C CB B GLU A 1 88 ? 32.722 11.400 12.848 0.50 14.23 ? 87 GLU A CB 1 +ATOM 719 C CG A GLU A 1 88 ? 33.861 10.658 12.658 0.50 10.38 ? 87 GLU A CG 1 +ATOM 720 C CG B GLU A 1 88 ? 32.149 10.163 12.248 0.50 16.09 ? 87 GLU A CG 1 +ATOM 721 C CD A GLU A 1 88 ? 34.022 10.362 11.219 0.50 13.95 ? 87 GLU A CD 1 +ATOM 722 C CD B GLU A 1 88 ? 32.972 8.939 12.583 0.50 21.26 ? 87 GLU A CD 1 +ATOM 723 O OE1 A GLU A 1 88 ? 33.128 9.718 10.602 0.50 17.96 ? 87 GLU A OE1 1 +ATOM 724 O OE1 B GLU A 1 88 ? 32.493 7.826 12.288 0.50 32.75 ? 87 GLU A OE1 1 +ATOM 725 O OE2 A GLU A 1 88 ? 35.077 10.756 10.710 0.50 19.72 ? 87 GLU A OE2 1 +ATOM 726 O OE2 B GLU A 1 88 ? 34.091 9.084 13.130 0.50 31.34 ? 87 GLU A OE2 1 +ATOM 727 N N . PHE A 1 89 ? 30.660 13.725 13.539 1.00 10.11 ? 88 PHE A N 1 +ATOM 728 C CA . PHE A 1 89 ? 29.328 14.237 13.832 1.00 9.62 ? 88 PHE A CA 1 +ATOM 729 C C . PHE A 1 89 ? 28.857 15.202 12.767 1.00 9.45 ? 88 PHE A C 1 +ATOM 730 O O . PHE A 1 89 ? 27.753 15.083 12.264 1.00 9.68 ? 88 PHE A O 1 +ATOM 731 C CB . PHE A 1 89 ? 29.233 14.923 15.180 1.00 9.75 ? 88 PHE A CB 1 +ATOM 732 C CG . PHE A 1 89 ? 27.864 15.437 15.435 1.00 9.07 ? 88 PHE A CG 1 +ATOM 733 C CD1 . PHE A 1 89 ? 26.827 14.593 15.701 1.00 9.84 ? 88 PHE A CD1 1 +ATOM 734 C CD2 . PHE A 1 89 ? 27.597 16.796 15.326 1.00 10.78 ? 88 PHE A CD2 1 +ATOM 735 C CE1 . PHE A 1 89 ? 25.542 15.096 15.849 1.00 9.92 ? 88 PHE A CE1 1 +ATOM 736 C CE2 . PHE A 1 89 ? 26.336 17.283 15.497 1.00 9.59 ? 88 PHE A CE2 1 +ATOM 737 C CZ . PHE A 1 89 ? 25.319 16.415 15.764 1.00 10.20 ? 88 PHE A CZ 1 +ATOM 738 N N . ILE A 1 90 ? 29.684 16.200 12.426 1.00 9.89 ? 89 ILE A N 1 +ATOM 739 C CA . ILE A 1 90 ? 29.212 17.220 11.489 1.00 9.81 ? 89 ILE A CA 1 +ATOM 740 C C . ILE A 1 90 ? 28.900 16.634 10.103 1.00 9.32 ? 89 ILE A C 1 +ATOM 741 O O . ILE A 1 90 ? 27.842 16.909 9.512 1.00 11.10 ? 89 ILE A O 1 +ATOM 742 C CB . ILE A 1 90 ? 30.158 18.435 11.443 1.00 10.58 ? 89 ILE A CB 1 +ATOM 743 C CG1 . ILE A 1 90 ? 30.093 19.125 12.805 1.00 11.04 ? 89 ILE A CG1 1 +ATOM 744 C CG2 . ILE A 1 90 ? 29.786 19.381 10.263 1.00 12.26 ? 89 ILE A CG2 1 +ATOM 745 C CD1 . ILE A 1 90 ? 30.972 20.370 12.978 1.00 12.50 ? 89 ILE A CD1 1 +ATOM 746 N N A ARG A 1 91 ? 29.798 15.768 9.629 0.50 10.47 ? 90 ARG A N 1 +ATOM 747 N N B ARG A 1 91 ? 29.785 15.758 9.624 0.50 11.41 ? 90 ARG A N 1 +ATOM 748 C CA A ARG A 1 91 ? 29.559 15.050 8.365 0.50 11.17 ? 90 ARG A CA 1 +ATOM 749 C CA B ARG A 1 91 ? 29.523 15.080 8.343 0.50 12.67 ? 90 ARG A CA 1 +ATOM 750 C C A ARG A 1 91 ? 28.251 14.258 8.410 0.50 10.79 ? 90 ARG A C 1 +ATOM 751 C C B ARG A 1 91 ? 28.242 14.246 8.399 0.50 11.59 ? 90 ARG A C 1 +ATOM 752 O O A ARG A 1 91 ? 27.417 14.354 7.511 0.50 12.43 ? 90 ARG A O 1 +ATOM 753 O O B ARG A 1 91 ? 27.409 14.306 7.495 0.50 13.10 ? 90 ARG A O 1 +ATOM 754 C CB A ARG A 1 91 ? 30.712 14.114 8.083 0.50 12.13 ? 90 ARG A CB 1 +ATOM 755 C CB B ARG A 1 91 ? 30.696 14.212 7.934 0.50 14.35 ? 90 ARG A CB 1 +ATOM 756 C CG A ARG A 1 91 ? 30.584 13.405 6.752 0.50 13.07 ? 90 ARG A CG 1 +ATOM 757 C CG B ARG A 1 91 ? 30.566 13.714 6.496 0.50 18.00 ? 90 ARG A CG 1 +ATOM 758 C CD A ARG A 1 91 ? 31.685 12.423 6.588 0.50 18.63 ? 90 ARG A CD 1 +ATOM 759 C CD B ARG A 1 91 ? 31.875 13.201 5.977 0.50 26.27 ? 90 ARG A CD 1 +ATOM 760 N NE A ARG A 1 91 ? 31.361 11.105 7.131 0.50 23.86 ? 90 ARG A NE 1 +ATOM 761 N NE B ARG A 1 91 ? 32.280 11.970 6.650 0.50 32.70 ? 90 ARG A NE 1 +ATOM 762 C CZ A ARG A 1 91 ? 31.700 10.644 8.330 0.50 21.26 ? 90 ARG A CZ 1 +ATOM 763 C CZ B ARG A 1 91 ? 32.192 10.741 6.136 0.50 31.70 ? 90 ARG A CZ 1 +ATOM 764 N NH1 A ARG A 1 91 ? 32.348 11.384 9.215 0.50 34.17 ? 90 ARG A NH1 1 +ATOM 765 N NH1 B ARG A 1 91 ? 31.696 10.526 4.921 0.50 32.33 ? 90 ARG A NH1 1 +ATOM 766 N NH2 A ARG A 1 91 ? 31.369 9.411 8.655 0.50 28.10 ? 90 ARG A NH2 1 +ATOM 767 N NH2 B ARG A 1 91 ? 32.607 9.713 6.858 0.50 30.58 ? 90 ARG A NH2 1 +ATOM 768 N N . ASP A 1 92 ? 28.090 13.473 9.473 1.00 9.90 ? 91 ASP A N 1 +ATOM 769 C CA . ASP A 1 92 ? 26.916 12.592 9.610 1.00 11.68 ? 91 ASP A CA 1 +ATOM 770 C C . ASP A 1 92 ? 25.621 13.359 9.795 1.00 10.31 ? 91 ASP A C 1 +ATOM 771 O O . ASP A 1 92 ? 24.561 12.938 9.359 1.00 10.82 ? 91 ASP A O 1 +ATOM 772 C CB . ASP A 1 92 ? 27.139 11.610 10.766 1.00 11.67 ? 91 ASP A CB 1 +ATOM 773 C CG . ASP A 1 92 ? 28.223 10.558 10.471 1.00 12.02 ? 91 ASP A CG 1 +ATOM 774 O OD1 . ASP A 1 92 ? 28.736 10.531 9.327 1.00 14.01 ? 91 ASP A OD1 1 +ATOM 775 O OD2 . ASP A 1 92 ? 28.639 9.831 11.398 1.00 11.73 ? 91 ASP A OD2 1 +ATOM 776 N N . TYR A 1 93 ? 25.714 14.488 10.507 1.00 10.41 ? 92 TYR A N 1 +ATOM 777 C CA . TYR A 1 93 ? 24.585 15.381 10.765 1.00 11.48 ? 92 TYR A CA 1 +ATOM 778 C C . TYR A 1 93 ? 24.100 16.041 9.474 1.00 9.57 ? 92 TYR A C 1 +ATOM 779 O O . TYR A 1 93 ? 22.907 16.071 9.218 1.00 10.75 ? 92 TYR A O 1 +ATOM 780 C CB . TYR A 1 93 ? 25.016 16.447 11.786 1.00 10.41 ? 92 TYR A CB 1 +ATOM 781 C CG . TYR A 1 93 ? 23.989 17.527 12.002 1.00 9.58 ? 92 TYR A CG 1 +ATOM 782 C CD1 . TYR A 1 93 ? 22.812 17.287 12.670 1.00 9.18 ? 92 TYR A CD1 1 +ATOM 783 C CD2 . TYR A 1 93 ? 24.200 18.800 11.451 1.00 9.78 ? 92 TYR A CD2 1 +ATOM 784 C CE1 . TYR A 1 93 ? 21.910 18.290 12.842 1.00 8.44 ? 92 TYR A CE1 1 +ATOM 785 C CE2 . TYR A 1 93 ? 23.312 19.812 11.630 1.00 9.84 ? 92 TYR A CE2 1 +ATOM 786 C CZ . TYR A 1 93 ? 22.124 19.557 12.301 1.00 7.90 ? 92 TYR A CZ 1 +ATOM 787 O OH . TYR A 1 93 ? 21.193 20.552 12.476 1.00 10.16 ? 92 TYR A OH 1 +ATOM 788 N N . LEU A 1 94 ? 25.034 16.517 8.650 1.00 10.90 ? 93 LEU A N 1 +ATOM 789 C CA . LEU A 1 94 ? 24.639 17.045 7.366 1.00 11.45 ? 93 LEU A CA 1 +ATOM 790 C C . LEU A 1 94 ? 23.984 15.956 6.505 1.00 12.30 ? 93 LEU A C 1 +ATOM 791 O O . LEU A 1 94 ? 22.922 16.181 5.933 1.00 12.54 ? 93 LEU A O 1 +ATOM 792 C CB . LEU A 1 94 ? 25.838 17.674 6.676 1.00 12.15 ? 93 LEU A CB 1 +ATOM 793 C CG . LEU A 1 94 ? 26.420 18.959 7.285 1.00 14.01 ? 93 LEU A CG 1 +ATOM 794 C CD1 . LEU A 1 94 ? 27.667 19.376 6.512 1.00 16.41 ? 93 LEU A CD1 1 +ATOM 795 C CD2 . LEU A 1 94 ? 25.373 20.089 7.286 1.00 13.66 ? 93 LEU A CD2 1 +ATOM 796 N N . LYS A 1 95 ? 24.572 14.759 6.488 1.00 14.60 ? 94 LYS A N 1 +ATOM 797 C CA . LYS A 1 95 ? 24.023 13.633 5.712 1.00 14.27 ? 94 LYS A CA 1 +ATOM 798 C C . LYS A 1 95 ? 22.632 13.278 6.191 1.00 12.92 ? 94 LYS A C 1 +ATOM 799 O O . LYS A 1 95 ? 21.731 13.030 5.394 1.00 14.34 ? 94 LYS A O 1 +ATOM 800 C CB . LYS A 1 95 ? 24.939 12.414 5.814 1.00 14.84 ? 94 LYS A CB 1 +ATOM 801 C CG . LYS A 1 95 ? 24.464 11.177 5.036 1.00 20.47 ? 94 LYS A CG 1 +ATOM 802 C CD . LYS A 1 95 ? 25.488 10.047 5.077 1.00 23.47 ? 94 LYS A CD 1 +ATOM 803 N N . ALA A 1 96 ? 22.413 13.274 7.509 1.00 11.13 ? 95 ALA A N 1 +ATOM 804 C CA . ALA A 1 96 ? 21.094 12.947 8.035 1.00 11.60 ? 95 ALA A CA 1 +ATOM 805 C C . ALA A 1 96 ? 20.009 13.908 7.585 1.00 11.77 ? 95 ALA A C 1 +ATOM 806 O O . ALA A 1 96 ? 18.852 13.546 7.481 1.00 13.93 ? 95 ALA A O 1 +ATOM 807 C CB . ALA A 1 96 ? 21.131 12.867 9.580 1.00 12.02 ? 95 ALA A CB 1 +ATOM 808 N N . ASN A 1 97 ? 20.396 15.162 7.360 1.00 12.40 ? 96 ASN A N 1 +ATOM 809 C CA . ASN A 1 97 ? 19.501 16.206 6.882 1.00 11.23 ? 96 ASN A CA 1 +ATOM 810 C C . ASN A 1 97 ? 19.443 16.284 5.345 1.00 12.22 ? 96 ASN A C 1 +ATOM 811 O O . ASN A 1 97 ? 18.790 17.157 4.816 1.00 13.25 ? 96 ASN A O 1 +ATOM 812 C CB . ASN A 1 97 ? 19.906 17.585 7.432 1.00 11.77 ? 96 ASN A CB 1 +ATOM 813 C CG . ASN A 1 97 ? 19.412 17.800 8.841 1.00 10.49 ? 96 ASN A CG 1 +ATOM 814 O OD1 . ASN A 1 97 ? 18.194 17.929 9.065 1.00 11.77 ? 96 ASN A OD1 1 +ATOM 815 N ND2 . ASN A 1 97 ? 20.354 17.802 9.822 1.00 11.52 ? 96 ASN A ND2 1 +ATOM 816 N N . GLY A 1 98 ? 20.151 15.385 4.654 1.00 13.26 ? 97 GLY A N 1 +ATOM 817 C CA . GLY A 1 98 ? 20.078 15.362 3.202 1.00 13.58 ? 97 GLY A CA 1 +ATOM 818 C C . GLY A 1 98 ? 20.917 16.433 2.562 1.00 14.16 ? 97 GLY A C 1 +ATOM 819 O O . GLY A 1 98 ? 20.687 16.798 1.396 1.00 16.87 ? 97 GLY A O 1 +ATOM 820 N N . VAL A 1 99 ? 21.901 16.969 3.286 1.00 13.18 ? 98 VAL A N 1 +ATOM 821 C CA . VAL A 1 99 ? 22.705 18.117 2.831 1.00 13.27 ? 98 VAL A CA 1 +ATOM 822 C C . VAL A 1 99 ? 24.054 17.621 2.374 1.00 14.82 ? 98 VAL A C 1 +ATOM 823 O O . VAL A 1 99 ? 24.822 17.027 3.133 1.00 15.71 ? 98 VAL A O 1 +ATOM 824 C CB . VAL A 1 99 ? 22.903 19.154 3.963 1.00 12.29 ? 98 VAL A CB 1 +ATOM 825 C CG1 . VAL A 1 99 ? 23.863 20.265 3.488 1.00 14.64 ? 98 VAL A CG1 1 +ATOM 826 C CG2 . VAL A 1 99 ? 21.541 19.680 4.403 1.00 15.54 ? 98 VAL A CG2 1 +ATOM 827 N N . ALA A 1 100 ? 24.356 17.846 1.092 1.00 16.25 ? 99 ALA A N 1 +ATOM 828 C CA . ALA A 1 100 ? 25.602 17.360 0.528 1.00 16.63 ? 99 ALA A CA 1 +ATOM 829 C C . ALA A 1 100 ? 26.841 18.224 0.836 1.00 16.14 ? 99 ALA A C 1 +ATOM 830 O O . ALA A 1 100 ? 27.959 17.722 1.042 1.00 15.94 ? 99 ALA A O 1 +ATOM 831 C CB . ALA A 1 100 ? 25.432 17.229 -1.030 1.00 18.49 ? 99 ALA A CB 1 +ATOM 832 N N . ARG A 1 101 ? 26.617 19.521 0.840 1.00 16.22 ? 100 ARG A N 1 +ATOM 833 C CA . ARG A 1 101 ? 27.649 20.495 1.107 1.00 15.56 ? 100 ARG A CA 1 +ATOM 834 C C . ARG A 1 101 ? 27.005 21.671 1.842 1.00 11.12 ? 100 ARG A C 1 +ATOM 835 O O . ARG A 1 101 ? 25.833 22.011 1.612 1.00 13.91 ? 100 ARG A O 1 +ATOM 836 C CB . ARG A 1 101 ? 28.281 21.009 -0.206 1.00 19.58 ? 100 ARG A CB 1 +ATOM 837 C CG . ARG A 1 101 ? 29.242 20.053 -0.867 1.00 23.77 ? 100 ARG A CG 1 +ATOM 838 N N . SER A 1 102 ? 27.795 22.321 2.703 1.00 12.99 ? 101 SER A N 1 +ATOM 839 C CA . SER A 1 102 ? 27.296 23.416 3.514 1.00 11.06 ? 101 SER A CA 1 +ATOM 840 C C . SER A 1 102 ? 28.426 24.353 3.955 1.00 10.27 ? 101 SER A C 1 +ATOM 841 O O . SER A 1 102 ? 29.574 23.949 4.119 1.00 12.82 ? 101 SER A O 1 +ATOM 842 C CB . SER A 1 102 ? 26.566 22.810 4.749 1.00 12.57 ? 101 SER A CB 1 +ATOM 843 O OG . SER A 1 102 ? 25.877 23.799 5.509 1.00 12.25 ? 101 SER A OG 1 +ATOM 844 N N . VAL A 1 103 ? 28.060 25.611 4.145 1.00 12.79 ? 102 VAL A N 1 +ATOM 845 C CA . VAL A 1 103 ? 28.873 26.500 4.998 1.00 12.13 ? 102 VAL A CA 1 +ATOM 846 C C . VAL A 1 103 ? 28.719 26.007 6.453 1.00 10.12 ? 102 VAL A C 1 +ATOM 847 O O . VAL A 1 103 ? 27.622 25.544 6.834 1.00 11.80 ? 102 VAL A O 1 +ATOM 848 C CB . VAL A 1 103 ? 28.437 27.960 4.891 1.00 11.90 ? 102 VAL A CB 1 +ATOM 849 C CG1 . VAL A 1 103 ? 29.245 28.835 5.835 1.00 11.81 ? 102 VAL A CG1 1 +ATOM 850 C CG2 . VAL A 1 103 ? 28.633 28.471 3.421 1.00 13.63 ? 102 VAL A CG2 1 +ATOM 851 N N . ILE A 1 104 ? 29.807 25.995 7.206 1.00 11.94 ? 103 ILE A N 1 +ATOM 852 C CA . ILE A 1 104 ? 29.706 25.611 8.625 1.00 9.77 ? 103 ILE A CA 1 +ATOM 853 C C . ILE A 1 104 ? 30.293 26.719 9.485 1.00 10.91 ? 103 ILE A C 1 +ATOM 854 O O . ILE A 1 104 ? 31.381 27.252 9.193 1.00 11.25 ? 103 ILE A O 1 +ATOM 855 C CB . ILE A 1 104 ? 30.309 24.219 8.864 1.00 11.42 ? 103 ILE A CB 1 +ATOM 856 C CG1 . ILE A 1 104 ? 31.776 24.146 8.434 1.00 11.83 ? 103 ILE A CG1 1 +ATOM 857 C CG2 . ILE A 1 104 ? 29.442 23.163 8.174 1.00 11.80 ? 103 ILE A CG2 1 +ATOM 858 C CD1 . ILE A 1 104 ? 32.418 22.770 8.682 1.00 11.64 ? 103 ILE A CD1 1 +HETATM 859 N N A MSE A 1 105 ? 29.520 27.099 10.492 0.67 11.04 ? 104 MSE A N 1 +HETATM 860 N N B MSE A 1 105 ? 29.553 27.029 10.549 0.33 10.54 ? 104 MSE A N 1 +HETATM 861 C CA A MSE A 1 105 ? 29.908 28.113 11.456 0.67 11.33 ? 104 MSE A CA 1 +HETATM 862 C CA B MSE A 1 105 ? 29.829 28.129 11.468 0.33 10.19 ? 104 MSE A CA 1 +HETATM 863 C C A MSE A 1 105 ? 30.014 27.475 12.814 0.67 10.17 ? 104 MSE A C 1 +HETATM 864 C C B MSE A 1 105 ? 29.927 27.588 12.881 0.33 8.26 ? 104 MSE A C 1 +HETATM 865 O O A MSE A 1 105 ? 29.194 26.621 13.145 0.67 10.59 ? 104 MSE A O 1 +HETATM 866 O O B MSE A 1 105 ? 28.972 26.953 13.350 0.33 6.02 ? 104 MSE A O 1 +HETATM 867 C CB A MSE A 1 105 ? 28.846 29.214 11.498 0.67 11.75 ? 104 MSE A CB 1 +HETATM 868 C CB B MSE A 1 105 ? 28.677 29.142 11.411 0.33 10.38 ? 104 MSE A CB 1 +HETATM 869 C CG A MSE A 1 105 ? 29.019 30.174 12.656 0.67 8.79 ? 104 MSE A CG 1 +HETATM 870 C CG B MSE A 1 105 ? 28.841 30.329 12.361 0.33 11.38 ? 104 MSE A CG 1 +HETATM 871 SE SE A MSE A 1 105 ? 27.840 31.714 12.503 0.50 11.76 ? 104 MSE A SE 1 +HETATM 872 SE SE B MSE A 1 105 ? 28.225 30.089 14.217 0.25 17.12 ? 104 MSE A SE 1 +HETATM 873 C CE A MSE A 1 105 ? 27.173 31.710 14.302 0.67 12.68 ? 104 MSE A CE 1 +HETATM 874 C CE B MSE A 1 105 ? 26.636 31.211 14.207 0.33 13.61 ? 104 MSE A CE 1 +ATOM 875 N N . GLY A 1 106 ? 31.049 27.842 13.557 1.00 9.58 ? 105 GLY A N 1 +ATOM 876 C CA . GLY A 1 106 ? 31.213 27.350 14.908 1.00 10.21 ? 105 GLY A CA 1 +ATOM 877 C C . GLY A 1 106 ? 31.721 28.421 15.837 1.00 10.59 ? 105 GLY A C 1 +ATOM 878 O O . GLY A 1 106 ? 32.637 29.202 15.491 1.00 11.32 ? 105 GLY A O 1 +ATOM 879 N N . ALA A 1 107 ? 31.181 28.425 17.066 1.00 10.06 ? 106 ALA A N 1 +ATOM 880 C CA . ALA A 1 107 ? 31.650 29.300 18.108 1.00 8.97 ? 106 ALA A CA 1 +ATOM 881 C C . ALA A 1 107 ? 32.448 28.511 19.136 1.00 9.93 ? 106 ALA A C 1 +ATOM 882 O O . ALA A 1 107 ? 32.000 27.502 19.641 1.00 10.37 ? 106 ALA A O 1 +ATOM 883 C CB . ALA A 1 107 ? 30.478 29.964 18.795 1.00 11.79 ? 106 ALA A CB 1 +ATOM 884 N N . SER A 1 108 ? 33.672 28.970 19.451 1.00 10.47 ? 107 SER A N 1 +ATOM 885 C CA . SER A 1 108 ? 34.453 28.462 20.584 1.00 10.83 ? 107 SER A CA 1 +ATOM 886 C C . SER A 1 108 ? 34.748 26.961 20.330 1.00 10.13 ? 107 SER A C 1 +ATOM 887 O O . SER A 1 108 ? 35.370 26.647 19.298 1.00 9.71 ? 107 SER A O 1 +ATOM 888 C CB . SER A 1 108 ? 33.797 28.816 21.900 1.00 12.45 ? 107 SER A CB 1 +ATOM 889 O OG . SER A 1 108 ? 34.682 28.628 22.993 1.00 12.19 ? 107 SER A OG 1 +HETATM 890 N N A MSE A 1 109 ? 34.351 26.074 21.236 0.50 10.32 ? 108 MSE A N 1 +HETATM 891 N N B MSE A 1 109 ? 34.327 25.999 21.165 0.50 9.59 ? 108 MSE A N 1 +HETATM 892 C CA A MSE A 1 109 ? 34.446 24.649 20.993 0.50 9.15 ? 108 MSE A CA 1 +HETATM 893 C CA B MSE A 1 109 ? 34.596 24.585 20.800 0.50 8.61 ? 108 MSE A CA 1 +HETATM 894 C C A MSE A 1 109 ? 33.990 24.330 19.555 0.50 10.90 ? 108 MSE A C 1 +HETATM 895 C C B MSE A 1 109 ? 33.975 24.261 19.451 0.50 10.37 ? 108 MSE A C 1 +HETATM 896 O O A MSE A 1 109 ? 34.659 23.606 18.832 0.50 12.60 ? 108 MSE A O 1 +HETATM 897 O O B MSE A 1 109 ? 34.473 23.428 18.699 0.50 8.84 ? 108 MSE A O 1 +HETATM 898 C CB A MSE A 1 109 ? 33.564 23.915 22.026 0.50 10.06 ? 108 MSE A CB 1 +HETATM 899 C CB B MSE A 1 109 ? 34.103 23.566 21.845 0.50 9.76 ? 108 MSE A CB 1 +HETATM 900 C CG A MSE A 1 109 ? 33.429 22.435 21.792 0.50 6.83 ? 108 MSE A CG 1 +HETATM 901 C CG B MSE A 1 109 ? 32.632 23.208 21.729 0.50 9.38 ? 108 MSE A CG 1 +HETATM 902 SE SE A MSE A 1 109 ? 32.189 21.632 23.078 0.38 11.01 ? 108 MSE A SE 1 +HETATM 903 SE SE B MSE A 1 109 ? 32.000 22.173 23.246 0.37 13.12 ? 108 MSE A SE 1 +HETATM 904 C CE A MSE A 1 109 ? 30.451 22.201 22.447 0.50 9.39 ? 108 MSE A CE 1 +HETATM 905 C CE B MSE A 1 109 ? 30.178 21.914 22.668 0.50 14.39 ? 108 MSE A CE 1 +ATOM 906 N N . GLY A 1 110 ? 32.810 24.840 19.169 1.00 9.76 ? 109 GLY A N 1 +ATOM 907 C CA . GLY A 1 110 ? 32.209 24.603 17.869 1.00 10.77 ? 109 GLY A CA 1 +ATOM 908 C C . GLY A 1 110 ? 33.079 25.092 16.730 1.00 9.58 ? 109 GLY A C 1 +ATOM 909 O O . GLY A 1 110 ? 33.052 24.550 15.627 1.00 9.45 ? 109 GLY A O 1 +ATOM 910 N N . GLY A 1 111 ? 33.805 26.175 16.969 1.00 10.27 ? 110 GLY A N 1 +ATOM 911 C CA . GLY A 1 111 ? 34.768 26.677 15.973 1.00 9.86 ? 110 GLY A CA 1 +ATOM 912 C C . GLY A 1 111 ? 35.890 25.682 15.755 1.00 11.76 ? 110 GLY A C 1 +ATOM 913 O O . GLY A 1 111 ? 36.319 25.467 14.605 1.00 11.98 ? 110 GLY A O 1 +ATOM 914 N N . GLY A 1 112 ? 36.421 25.101 16.822 1.00 11.00 ? 111 GLY A N 1 +ATOM 915 C CA . GLY A 1 112 ? 37.326 23.983 16.655 1.00 10.68 ? 111 GLY A CA 1 +ATOM 916 C C . GLY A 1 112 ? 36.731 22.844 15.870 1.00 13.06 ? 111 GLY A C 1 +ATOM 917 O O . GLY A 1 112 ? 37.390 22.243 14.987 1.00 13.31 ? 111 GLY A O 1 +HETATM 918 N N . MSE A 1 113 ? 35.468 22.529 16.135 1.00 11.55 ? 112 MSE A N 1 +HETATM 919 C CA . MSE A 1 113 ? 34.834 21.445 15.432 1.00 11.14 ? 112 MSE A CA 1 +HETATM 920 C C . MSE A 1 113 ? 34.746 21.704 13.940 1.00 12.41 ? 112 MSE A C 1 +HETATM 921 O O . MSE A 1 113 ? 34.955 20.774 13.129 1.00 11.29 ? 112 MSE A O 1 +HETATM 922 C CB . MSE A 1 113 ? 33.437 21.185 15.990 1.00 12.78 ? 112 MSE A CB 1 +HETATM 923 C CG . MSE A 1 113 ? 33.416 20.713 17.395 1.00 9.02 ? 112 MSE A CG 1 +HETATM 924 SE SE . MSE A 1 113 ? 31.610 20.395 17.993 0.75 11.80 ? 112 MSE A SE 1 +HETATM 925 C CE . MSE A 1 113 ? 32.071 19.603 19.685 1.00 12.93 ? 112 MSE A CE 1 +ATOM 926 N N . VAL A 1 114 ? 34.358 22.930 13.557 1.00 10.11 ? 113 VAL A N 1 +ATOM 927 C CA . VAL A 1 114 ? 34.209 23.193 12.121 1.00 11.10 ? 113 VAL A CA 1 +ATOM 928 C C . VAL A 1 114 ? 35.565 23.225 11.410 1.00 12.91 ? 113 VAL A C 1 +ATOM 929 O O . VAL A 1 114 ? 35.649 22.821 10.233 1.00 12.11 ? 113 VAL A O 1 +ATOM 930 C CB . VAL A 1 114 ? 33.420 24.453 11.806 1.00 13.13 ? 113 VAL A CB 1 +ATOM 931 C CG1 . VAL A 1 114 ? 32.015 24.323 12.349 1.00 11.81 ? 113 VAL A CG1 1 +ATOM 932 C CG2 . VAL A 1 114 ? 34.100 25.738 12.291 1.00 15.94 ? 113 VAL A CG2 1 +ATOM 933 N N . ILE A 1 115 ? 36.604 23.673 12.102 1.00 11.99 ? 114 ILE A N 1 +ATOM 934 C CA . ILE A 1 115 ? 37.967 23.593 11.523 1.00 12.34 ? 114 ILE A CA 1 +ATOM 935 C C . ILE A 1 115 ? 38.324 22.119 11.274 1.00 13.64 ? 114 ILE A C 1 +ATOM 936 O O . ILE A 1 115 ? 38.718 21.737 10.141 1.00 15.01 ? 114 ILE A O 1 +ATOM 937 C CB . ILE A 1 115 ? 38.985 24.375 12.388 1.00 12.77 ? 114 ILE A CB 1 +ATOM 938 C CG1 . ILE A 1 115 ? 38.711 25.886 12.161 1.00 16.71 ? 114 ILE A CG1 1 +ATOM 939 C CG2 . ILE A 1 115 ? 40.456 24.016 12.039 1.00 14.82 ? 114 ILE A CG2 1 +ATOM 940 C CD1 . ILE A 1 115 ? 39.407 26.813 13.072 1.00 16.94 ? 114 ILE A CD1 1 +HETATM 941 N N . MSE A 1 116 ? 38.164 21.285 12.290 1.00 13.30 ? 115 MSE A N 1 +HETATM 942 C CA . MSE A 1 116 ? 38.487 19.890 12.135 1.00 12.67 ? 115 MSE A CA 1 +HETATM 943 C C . MSE A 1 116 ? 37.687 19.226 11.035 1.00 14.23 ? 115 MSE A C 1 +HETATM 944 O O . MSE A 1 116 ? 38.217 18.396 10.264 1.00 13.05 ? 115 MSE A O 1 +HETATM 945 C CB . MSE A 1 116 ? 38.294 19.107 13.435 1.00 15.75 ? 115 MSE A CB 1 +HETATM 946 C CG . MSE A 1 116 ? 38.691 17.611 13.307 1.00 13.93 ? 115 MSE A CG 1 +HETATM 947 SE SE . MSE A 1 116 ? 40.594 17.331 12.930 0.75 22.63 ? 115 MSE A SE 1 +HETATM 948 C CE . MSE A 1 116 ? 41.129 17.425 14.686 1.00 19.80 ? 115 MSE A CE 1 +ATOM 949 N N . THR A 1 117 ? 36.410 19.540 10.932 1.00 12.46 ? 116 THR A N 1 +ATOM 950 C CA . THR A 1 117 ? 35.596 18.999 9.847 1.00 11.79 ? 116 THR A CA 1 +ATOM 951 C C . THR A 1 117 ? 36.131 19.375 8.454 1.00 15.23 ? 116 THR A C 1 +ATOM 952 O O . THR A 1 117 ? 36.121 18.549 7.534 1.00 13.55 ? 116 THR A O 1 +ATOM 953 C CB . THR A 1 117 ? 34.152 19.480 9.975 1.00 12.14 ? 116 THR A CB 1 +ATOM 954 O OG1 . THR A 1 117 ? 33.672 19.117 11.272 1.00 12.27 ? 116 THR A OG1 1 +ATOM 955 C CG2 . THR A 1 117 ? 33.247 18.908 8.901 1.00 13.38 ? 116 THR A CG2 1 +ATOM 956 N N . THR A 1 118 ? 36.637 20.597 8.320 1.00 13.39 ? 117 THR A N 1 +ATOM 957 C CA . THR A 1 118 ? 37.230 21.039 7.041 1.00 12.96 ? 117 THR A CA 1 +ATOM 958 C C . THR A 1 118 ? 38.549 20.328 6.758 1.00 15.19 ? 117 THR A C 1 +ATOM 959 O O . THR A 1 118 ? 38.812 19.991 5.610 1.00 14.30 ? 117 THR A O 1 +ATOM 960 C CB . THR A 1 118 ? 37.395 22.565 7.034 1.00 13.25 ? 117 THR A CB 1 +ATOM 961 O OG1 . THR A 1 118 ? 36.144 23.178 7.388 1.00 12.80 ? 117 THR A OG1 1 +ATOM 962 C CG2 . THR A 1 118 ? 37.771 23.061 5.659 1.00 12.76 ? 117 THR A CG2 1 +ATOM 963 N N . LEU A 1 119 ? 39.319 20.033 7.788 1.00 13.55 ? 118 LEU A N 1 +ATOM 964 C CA . LEU A 1 119 ? 40.586 19.288 7.631 1.00 13.74 ? 118 LEU A CA 1 +ATOM 965 C C . LEU A 1 119 ? 40.315 17.843 7.226 1.00 15.12 ? 118 LEU A C 1 +ATOM 966 O O . LEU A 1 119 ? 41.060 17.275 6.430 1.00 16.86 ? 118 LEU A O 1 +ATOM 967 C CB . LEU A 1 119 ? 41.420 19.328 8.916 1.00 16.44 ? 118 LEU A CB 1 +ATOM 968 C CG . LEU A 1 119 ? 41.879 20.719 9.350 1.00 21.64 ? 118 LEU A CG 1 +ATOM 969 C CD1 . LEU A 1 119 ? 42.621 20.656 10.694 1.00 16.86 ? 118 LEU A CD1 1 +ATOM 970 C CD2 . LEU A 1 119 ? 42.711 21.369 8.266 1.00 25.89 ? 118 LEU A CD2 1 +ATOM 971 N N . GLN A 1 120 ? 39.243 17.240 7.733 1.00 14.47 ? 119 GLN A N 1 +ATOM 972 C CA . GLN A 1 120 ? 38.940 15.827 7.488 1.00 14.49 ? 119 GLN A CA 1 +ATOM 973 C C . GLN A 1 120 ? 38.136 15.592 6.235 1.00 15.64 ? 119 GLN A C 1 +ATOM 974 O O . GLN A 1 120 ? 38.412 14.631 5.499 1.00 16.73 ? 119 GLN A O 1 +ATOM 975 C CB . GLN A 1 120 ? 38.171 15.228 8.656 1.00 17.08 ? 119 GLN A CB 1 +ATOM 976 C CG . GLN A 1 120 ? 38.937 15.149 9.936 1.00 18.15 ? 119 GLN A CG 1 +ATOM 977 C CD . GLN A 1 120 ? 39.926 13.997 9.993 1.00 30.77 ? 119 GLN A CD 1 +ATOM 978 O OE1 . GLN A 1 120 ? 41.097 14.150 9.646 1.00 33.02 ? 119 GLN A OE1 1 +ATOM 979 N NE2 . GLN A 1 120 ? 39.459 12.846 10.438 1.00 29.02 ? 119 GLN A NE2 1 +ATOM 980 N N . TYR A 1 121 ? 37.152 16.453 5.978 1.00 13.65 ? 120 TYR A N 1 +ATOM 981 C CA . TYR A 1 121 ? 36.142 16.288 4.965 1.00 13.16 ? 120 TYR A CA 1 +ATOM 982 C C . TYR A 1 121 ? 35.964 17.589 4.190 1.00 14.07 ? 120 TYR A C 1 +ATOM 983 O O . TYR A 1 121 ? 34.889 18.176 4.114 1.00 14.93 ? 120 TYR A O 1 +ATOM 984 C CB . TYR A 1 121 ? 34.813 15.885 5.630 1.00 14.14 ? 120 TYR A CB 1 +ATOM 985 C CG . TYR A 1 121 ? 34.905 14.616 6.421 1.00 16.88 ? 120 TYR A CG 1 +ATOM 986 C CD1 . TYR A 1 121 ? 35.255 13.423 5.792 1.00 18.51 ? 120 TYR A CD1 1 +ATOM 987 C CD2 . TYR A 1 121 ? 34.672 14.588 7.801 1.00 16.73 ? 120 TYR A CD2 1 +ATOM 988 C CE1 . TYR A 1 121 ? 35.368 12.252 6.513 1.00 21.00 ? 120 TYR A CE1 1 +ATOM 989 C CE2 . TYR A 1 121 ? 34.760 13.418 8.522 1.00 19.08 ? 120 TYR A CE2 1 +ATOM 990 C CZ . TYR A 1 121 ? 35.122 12.248 7.881 1.00 22.29 ? 120 TYR A CZ 1 +ATOM 991 O OH . TYR A 1 121 ? 35.225 11.033 8.548 1.00 26.94 ? 120 TYR A OH 1 +ATOM 992 N N . PRO A 1 122 ? 37.043 18.035 3.541 1.00 14.97 ? 121 PRO A N 1 +ATOM 993 C CA . PRO A 1 122 ? 36.945 19.330 2.873 1.00 14.49 ? 121 PRO A CA 1 +ATOM 994 C C . PRO A 1 122 ? 35.903 19.418 1.780 1.00 14.93 ? 121 PRO A C 1 +ATOM 995 O O . PRO A 1 122 ? 35.422 20.506 1.463 1.00 16.98 ? 121 PRO A O 1 +ATOM 996 C CB . PRO A 1 122 ? 38.364 19.540 2.304 1.00 15.59 ? 121 PRO A CB 1 +ATOM 997 C CG . PRO A 1 122 ? 38.936 18.176 2.209 1.00 15.85 ? 121 PRO A CG 1 +ATOM 998 C CD . PRO A 1 122 ? 38.378 17.442 3.419 1.00 17.36 ? 121 PRO A CD 1 +ATOM 999 N N . ASP A 1 123 ? 35.561 18.273 1.179 1.00 15.07 ? 122 ASP A N 1 +ATOM 1000 C CA . ASP A 1 123 ? 34.634 18.280 0.064 1.00 17.84 ? 122 ASP A CA 1 +ATOM 1001 C C . ASP A 1 123 ? 33.197 18.580 0.443 1.00 16.81 ? 122 ASP A C 1 +ATOM 1002 O O . ASP A 1 123 ? 32.371 18.895 -0.418 1.00 19.99 ? 122 ASP A O 1 +ATOM 1003 C CB . ASP A 1 123 ? 34.750 16.979 -0.736 1.00 21.15 ? 122 ASP A CB 1 +ATOM 1004 C CG . ASP A 1 123 ? 36.166 16.777 -1.295 1.00 30.84 ? 122 ASP A CG 1 +ATOM 1005 O OD1 . ASP A 1 123 ? 36.793 17.777 -1.745 1.00 38.52 ? 122 ASP A OD1 1 +ATOM 1006 O OD2 . ASP A 1 123 ? 36.659 15.631 -1.255 1.00 43.23 ? 122 ASP A OD2 1 +ATOM 1007 N N . ILE A 1 124 ? 32.901 18.553 1.749 1.00 15.40 ? 123 ILE A N 1 +ATOM 1008 C CA . ILE A 1 124 ? 31.557 18.894 2.203 1.00 14.91 ? 123 ILE A CA 1 +ATOM 1009 C C . ILE A 1 124 ? 31.396 20.362 2.647 1.00 13.54 ? 123 ILE A C 1 +ATOM 1010 O O . ILE A 1 124 ? 30.257 20.791 2.957 1.00 15.32 ? 123 ILE A O 1 +ATOM 1011 C CB . ILE A 1 124 ? 31.029 17.924 3.310 1.00 14.85 ? 123 ILE A CB 1 +ATOM 1012 C CG1 . ILE A 1 124 ? 31.649 18.180 4.672 1.00 17.19 ? 123 ILE A CG1 1 +ATOM 1013 C CG2 . ILE A 1 124 ? 31.289 16.455 2.899 1.00 16.34 ? 123 ILE A CG2 1 +ATOM 1014 C CD1 . ILE A 1 124 ? 31.075 17.276 5.782 1.00 16.30 ? 123 ILE A CD1 1 +ATOM 1015 N N . VAL A 1 125 ? 32.500 21.122 2.649 1.00 14.36 ? 124 VAL A N 1 +ATOM 1016 C CA . VAL A 1 125 ? 32.532 22.459 3.298 1.00 12.28 ? 124 VAL A CA 1 +ATOM 1017 C C . VAL A 1 125 ? 32.597 23.549 2.230 1.00 12.72 ? 124 VAL A C 1 +ATOM 1018 O O . VAL A 1 125 ? 33.564 23.598 1.470 1.00 15.27 ? 124 VAL A O 1 +ATOM 1019 C CB . VAL A 1 125 ? 33.699 22.585 4.291 1.00 11.80 ? 124 VAL A CB 1 +ATOM 1020 C CG1 . VAL A 1 125 ? 33.693 23.976 4.957 1.00 12.46 ? 124 VAL A CG1 1 +ATOM 1021 C CG2 . VAL A 1 125 ? 33.620 21.487 5.367 1.00 12.63 ? 124 VAL A CG2 1 +ATOM 1022 N N . ASP A 1 126 ? 31.559 24.375 2.149 1.00 12.67 ? 125 ASP A N 1 +ATOM 1023 C CA . ASP A 1 126 ? 31.492 25.501 1.187 1.00 12.29 ? 125 ASP A CA 1 +ATOM 1024 C C . ASP A 1 126 ? 32.194 26.775 1.699 1.00 16.24 ? 125 ASP A C 1 +ATOM 1025 O O . ASP A 1 126 ? 32.499 27.677 0.904 1.00 14.86 ? 125 ASP A O 1 +ATOM 1026 C CB . ASP A 1 126 ? 30.061 25.869 0.864 1.00 14.76 ? 125 ASP A CB 1 +ATOM 1027 C CG . ASP A 1 126 ? 29.340 24.844 -0.006 1.00 21.53 ? 125 ASP A CG 1 +ATOM 1028 O OD1 . ASP A 1 126 ? 30.009 24.146 -0.776 1.00 23.69 ? 125 ASP A OD1 1 +ATOM 1029 O OD2 . ASP A 1 126 ? 28.087 24.768 0.078 1.00 22.23 ? 125 ASP A OD2 1 +ATOM 1030 N N . GLY A 1 127 ? 32.440 26.868 3.005 1.00 12.18 ? 126 GLY A N 1 +ATOM 1031 C CA . GLY A 1 127 ? 33.010 28.048 3.654 1.00 11.65 ? 126 GLY A CA 1 +ATOM 1032 C C . GLY A 1 127 ? 32.976 27.819 5.150 1.00 11.92 ? 126 GLY A C 1 +ATOM 1033 O O . GLY A 1 127 ? 32.198 26.961 5.625 1.00 13.04 ? 126 GLY A O 1 +ATOM 1034 N N . ILE A 1 128 ? 33.786 28.582 5.873 1.00 11.50 ? 127 ILE A N 1 +ATOM 1035 C CA . ILE A 1 128 ? 33.890 28.464 7.354 1.00 10.44 ? 127 ILE A CA 1 +ATOM 1036 C C . ILE A 1 128 ? 33.635 29.824 7.984 1.00 11.02 ? 127 ILE A C 1 +ATOM 1037 O O . ILE A 1 128 ? 34.185 30.836 7.514 1.00 10.41 ? 127 ILE A O 1 +ATOM 1038 C CB . ILE A 1 128 ? 35.339 28.049 7.766 1.00 10.48 ? 127 ILE A CB 1 +ATOM 1039 C CG1 . ILE A 1 128 ? 35.678 26.651 7.237 1.00 13.60 ? 127 ILE A CG1 1 +ATOM 1040 C CG2 . ILE A 1 128 ? 35.545 28.078 9.311 1.00 13.43 ? 127 ILE A CG2 1 +ATOM 1041 C CD1 . ILE A 1 128 ? 37.132 26.291 7.397 1.00 14.83 ? 127 ILE A CD1 1 +ATOM 1042 N N . ILE A 1 129 ? 32.849 29.848 9.066 1.00 9.93 ? 128 ILE A N 1 +ATOM 1043 C CA . ILE A 1 129 ? 32.843 30.967 9.988 1.00 8.10 ? 128 ILE A CA 1 +ATOM 1044 C C . ILE A 1 129 ? 33.255 30.399 11.339 1.00 9.58 ? 128 ILE A C 1 +ATOM 1045 O O . ILE A 1 129 ? 32.657 29.438 11.802 1.00 10.86 ? 128 ILE A O 1 +ATOM 1046 C CB . ILE A 1 129 ? 31.446 31.621 10.152 1.00 8.52 ? 128 ILE A CB 1 +ATOM 1047 C CG1 . ILE A 1 129 ? 30.943 32.178 8.800 1.00 12.07 ? 128 ILE A CG1 1 +ATOM 1048 C CG2 . ILE A 1 129 ? 31.502 32.758 11.157 1.00 10.68 ? 128 ILE A CG2 1 +ATOM 1049 C CD1 . ILE A 1 129 ? 29.521 32.714 8.798 1.00 11.48 ? 128 ILE A CD1 1 +ATOM 1050 N N . ALA A 1 130 ? 34.273 30.958 11.944 1.00 9.35 ? 129 ALA A N 1 +ATOM 1051 C CA . ALA A 1 130 ? 34.751 30.488 13.239 1.00 10.25 ? 129 ALA A CA 1 +ATOM 1052 C C . ALA A 1 130 ? 34.889 31.658 14.165 1.00 10.32 ? 129 ALA A C 1 +ATOM 1053 O O . ALA A 1 130 ? 35.606 32.633 13.872 1.00 11.76 ? 129 ALA A O 1 +ATOM 1054 C CB . ALA A 1 130 ? 36.077 29.750 13.085 1.00 10.90 ? 129 ALA A CB 1 +ATOM 1055 N N . VAL A 1 131 ? 34.156 31.609 15.257 1.00 9.33 ? 130 VAL A N 1 +ATOM 1056 C CA . VAL A 1 131 ? 34.106 32.661 16.251 1.00 8.39 ? 130 VAL A CA 1 +ATOM 1057 C C . VAL A 1 131 ? 35.026 32.251 17.394 1.00 10.33 ? 130 VAL A C 1 +ATOM 1058 O O . VAL A 1 131 ? 34.677 31.391 18.204 1.00 11.58 ? 130 VAL A O 1 +ATOM 1059 C CB . VAL A 1 131 ? 32.681 32.904 16.779 1.00 9.52 ? 130 VAL A CB 1 +ATOM 1060 C CG1 . VAL A 1 131 ? 32.597 34.212 17.596 1.00 10.52 ? 130 VAL A CG1 1 +ATOM 1061 C CG2 . VAL A 1 131 ? 31.669 32.944 15.608 1.00 11.85 ? 130 VAL A CG2 1 +ATOM 1062 N N . ALA A 1 132 ? 36.229 32.843 17.436 1.00 8.67 ? 131 ALA A N 1 +ATOM 1063 C CA . ALA A 1 132 ? 37.229 32.532 18.457 1.00 10.08 ? 131 ALA A CA 1 +ATOM 1064 C C . ALA A 1 132 ? 37.354 31.031 18.693 1.00 9.13 ? 131 ALA A C 1 +ATOM 1065 O O . ALA A 1 132 ? 37.165 30.526 19.805 1.00 10.40 ? 131 ALA A O 1 +ATOM 1066 C CB . ALA A 1 132 ? 37.010 33.313 19.740 1.00 11.44 ? 131 ALA A CB 1 +ATOM 1067 N N . PRO A 1 133 ? 37.721 30.288 17.639 1.00 10.67 ? 132 PRO A N 1 +ATOM 1068 C CA . PRO A 1 133 ? 37.799 28.831 17.756 1.00 11.29 ? 132 PRO A CA 1 +ATOM 1069 C C . PRO A 1 133 ? 38.748 28.325 18.804 1.00 11.58 ? 132 PRO A C 1 +ATOM 1070 O O . PRO A 1 133 ? 39.901 28.763 18.851 1.00 13.06 ? 132 PRO A O 1 +ATOM 1071 C CB . PRO A 1 133 ? 38.279 28.395 16.374 1.00 13.35 ? 132 PRO A CB 1 +ATOM 1072 C CG . PRO A 1 133 ? 38.913 29.645 15.741 1.00 11.52 ? 132 PRO A CG 1 +ATOM 1073 C CD . PRO A 1 133 ? 38.066 30.760 16.282 1.00 10.39 ? 132 PRO A CD 1 +ATOM 1074 N N . ALA A 1 134 ? 38.248 27.449 19.666 1.00 11.08 ? 133 ALA A N 1 +ATOM 1075 C CA . ALA A 1 134 ? 39.002 26.777 20.707 1.00 11.68 ? 133 ALA A CA 1 +ATOM 1076 C C . ALA A 1 134 ? 39.436 25.414 20.208 1.00 13.28 ? 133 ALA A C 1 +ATOM 1077 O O . ALA A 1 134 ? 38.924 24.889 19.234 1.00 15.38 ? 133 ALA A O 1 +ATOM 1078 C CB . ALA A 1 134 ? 38.129 26.626 21.936 1.00 11.94 ? 133 ALA A CB 1 +ATOM 1079 N N . TRP A 1 135 ? 40.466 24.884 20.863 1.00 15.77 ? 134 TRP A N 1 +ATOM 1080 C CA . TRP A 1 135 ? 40.942 23.489 20.696 1.00 17.87 ? 134 TRP A CA 1 +ATOM 1081 C C . TRP A 1 135 ? 41.666 23.178 19.378 1.00 18.76 ? 134 TRP A C 1 +ATOM 1082 O O . TRP A 1 135 ? 41.817 21.987 19.011 1.00 21.70 ? 134 TRP A O 1 +ATOM 1083 C CB . TRP A 1 135 ? 39.813 22.465 20.921 1.00 20.49 ? 134 TRP A CB 1 +ATOM 1084 C CG . TRP A 1 135 ? 39.042 22.589 22.219 1.00 21.05 ? 134 TRP A CG 1 +ATOM 1085 C CD1 . TRP A 1 135 ? 39.334 23.379 23.299 1.00 22.18 ? 134 TRP A CD1 1 +ATOM 1086 C CD2 . TRP A 1 135 ? 37.851 21.852 22.580 1.00 26.49 ? 134 TRP A CD2 1 +ATOM 1087 N NE1 . TRP A 1 135 ? 38.389 23.211 24.288 1.00 27.61 ? 134 TRP A NE1 1 +ATOM 1088 C CE2 . TRP A 1 135 ? 37.478 22.270 23.878 1.00 24.97 ? 134 TRP A CE2 1 +ATOM 1089 C CE3 . TRP A 1 135 ? 37.070 20.889 21.925 1.00 26.68 ? 134 TRP A CE3 1 +ATOM 1090 C CZ2 . TRP A 1 135 ? 36.356 21.750 24.554 1.00 28.87 ? 134 TRP A CZ2 1 +ATOM 1091 C CZ3 . TRP A 1 135 ? 35.944 20.361 22.600 1.00 25.73 ? 134 TRP A CZ3 1 +ATOM 1092 C CH2 . TRP A 1 135 ? 35.610 20.806 23.908 1.00 25.17 ? 134 TRP A CH2 1 +ATOM 1093 N N . VAL A 1 136 ? 42.128 24.190 18.669 1.00 17.92 ? 135 VAL A N 1 +ATOM 1094 C CA . VAL A 1 136 ? 42.763 23.944 17.368 1.00 17.90 ? 135 VAL A CA 1 +ATOM 1095 C C . VAL A 1 136 ? 44.254 24.322 17.319 1.00 16.74 ? 135 VAL A C 1 +ATOM 1096 O O . VAL A 1 136 ? 44.849 24.317 16.257 1.00 15.26 ? 135 VAL A O 1 +ATOM 1097 C CB . VAL A 1 136 ? 41.990 24.612 16.178 1.00 20.14 ? 135 VAL A CB 1 +ATOM 1098 C CG1 . VAL A 1 136 ? 40.609 24.005 16.051 1.00 26.00 ? 135 VAL A CG1 1 +ATOM 1099 C CG2 . VAL A 1 136 ? 41.932 26.129 16.318 1.00 24.45 ? 135 VAL A CG2 1 +ATOM 1100 N N . GLU A 1 137 ? 44.825 24.706 18.453 1.00 15.66 ? 136 GLU A N 1 +ATOM 1101 C CA . GLU A 1 137 ? 46.215 25.186 18.437 1.00 16.84 ? 136 GLU A CA 1 +ATOM 1102 C C . GLU A 1 137 ? 47.184 24.138 17.962 1.00 17.55 ? 136 GLU A C 1 +ATOM 1103 O O . GLU A 1 137 ? 48.203 24.495 17.424 1.00 15.93 ? 136 GLU A O 1 +ATOM 1104 C CB . GLU A 1 137 ? 46.627 25.688 19.802 1.00 18.32 ? 136 GLU A CB 1 +ATOM 1105 C CG . GLU A 1 137 ? 45.924 26.957 20.202 1.00 21.30 ? 136 GLU A CG 1 +ATOM 1106 C CD . GLU A 1 137 ? 46.459 27.575 21.463 1.00 21.84 ? 136 GLU A CD 1 +ATOM 1107 O OE1 . GLU A 1 137 ? 47.663 27.886 21.473 1.00 24.87 ? 136 GLU A OE1 1 +ATOM 1108 O OE2 . GLU A 1 137 ? 45.690 27.767 22.432 1.00 22.96 ? 136 GLU A OE2 1 +ATOM 1109 N N . SER A 1 138 ? 46.839 22.870 18.075 1.00 18.06 ? 137 SER A N 1 +ATOM 1110 C CA . SER A 1 138 ? 47.704 21.796 17.567 1.00 17.71 ? 137 SER A CA 1 +ATOM 1111 C C . SER A 1 138 ? 47.546 21.472 16.080 1.00 19.62 ? 137 SER A C 1 +ATOM 1112 O O . SER A 1 138 ? 48.239 20.572 15.562 1.00 19.84 ? 137 SER A O 1 +ATOM 1113 C CB . SER A 1 138 ? 47.418 20.520 18.359 1.00 19.29 ? 137 SER A CB 1 +ATOM 1114 O OG . SER A 1 138 ? 46.172 19.945 17.971 1.00 25.13 ? 137 SER A OG 1 +ATOM 1115 N N . LEU A 1 139 ? 46.647 22.174 15.391 1.00 15.86 ? 138 LEU A N 1 +ATOM 1116 C CA . LEU A 1 139 ? 46.280 21.872 14.009 1.00 17.77 ? 138 LEU A CA 1 +ATOM 1117 C C . LEU A 1 139 ? 46.778 22.881 12.999 1.00 15.08 ? 138 LEU A C 1 +ATOM 1118 O O . LEU A 1 139 ? 46.365 22.857 11.857 1.00 18.60 ? 138 LEU A O 1 +ATOM 1119 C CB . LEU A 1 139 ? 44.757 21.823 13.929 1.00 15.47 ? 138 LEU A CB 1 +ATOM 1120 C CG . LEU A 1 139 ? 44.102 20.823 14.873 1.00 19.86 ? 138 LEU A CG 1 +ATOM 1121 C CD1 . LEU A 1 139 ? 42.573 20.886 14.764 1.00 20.79 ? 138 LEU A CD1 1 +ATOM 1122 C CD2 . LEU A 1 139 ? 44.623 19.450 14.524 1.00 21.20 ? 138 LEU A CD2 1 +ATOM 1123 N N . LYS A 1 140 ? 47.728 23.725 13.375 1.00 19.17 ? 139 LYS A N 1 +ATOM 1124 C CA . LYS A 1 140 ? 48.184 24.829 12.505 1.00 17.46 ? 139 LYS A CA 1 +ATOM 1125 C C . LYS A 1 140 ? 48.746 24.322 11.181 1.00 18.01 ? 139 LYS A C 1 +ATOM 1126 O O . LYS A 1 140 ? 48.532 24.944 10.119 1.00 16.37 ? 139 LYS A O 1 +ATOM 1127 C CB . LYS A 1 140 ? 49.253 25.650 13.230 1.00 16.71 ? 139 LYS A CB 1 +ATOM 1128 C CG . LYS A 1 140 ? 48.748 26.319 14.483 1.00 21.32 ? 139 LYS A CG 1 +ATOM 1129 C CD . LYS A 1 140 ? 49.874 27.076 15.174 1.00 19.01 ? 139 LYS A CD 1 +ATOM 1130 C CE . LYS A 1 140 ? 49.393 27.584 16.512 1.00 20.40 ? 139 LYS A CE 1 +ATOM 1131 N NZ . LYS A 1 140 ? 50.490 28.335 17.221 1.00 23.62 ? 139 LYS A NZ 1 +ATOM 1132 N N . GLY A 1 141 ? 49.481 23.203 11.216 1.00 18.10 ? 140 GLY A N 1 +ATOM 1133 C CA . GLY A 1 141 ? 50.107 22.689 10.007 1.00 20.46 ? 140 GLY A CA 1 +ATOM 1134 C C . GLY A 1 141 ? 49.051 22.189 9.035 1.00 19.15 ? 140 GLY A C 1 +ATOM 1135 O O . GLY A 1 141 ? 49.243 22.232 7.821 1.00 21.36 ? 140 GLY A O 1 +ATOM 1136 N N . ASP A 1 142 ? 47.897 21.762 9.551 1.00 18.03 ? 141 ASP A N 1 +ATOM 1137 C CA . ASP A 1 142 ? 46.843 21.296 8.659 1.00 19.26 ? 141 ASP A CA 1 +ATOM 1138 C C . ASP A 1 142 ? 45.960 22.461 8.213 1.00 16.79 ? 141 ASP A C 1 +ATOM 1139 O O . ASP A 1 142 ? 45.462 22.509 7.076 1.00 17.06 ? 141 ASP A O 1 +ATOM 1140 C CB . ASP A 1 142 ? 46.005 20.246 9.395 1.00 22.26 ? 141 ASP A CB 1 +ATOM 1141 C CG . ASP A 1 142 ? 46.868 19.157 10.028 1.00 32.73 ? 141 ASP A CG 1 +ATOM 1142 O OD1 . ASP A 1 142 ? 47.202 18.204 9.298 1.00 34.56 ? 141 ASP A OD1 1 +ATOM 1143 O OD2 . ASP A 1 142 ? 47.224 19.272 11.236 1.00 41.30 ? 141 ASP A OD2 1 +HETATM 1144 N N . MSE A 1 143 ? 45.743 23.404 9.125 1.00 17.67 ? 142 MSE A N 1 +HETATM 1145 C CA . MSE A 1 143 ? 45.002 24.607 8.834 1.00 17.55 ? 142 MSE A CA 1 +HETATM 1146 C C . MSE A 1 143 ? 45.633 25.370 7.708 1.00 14.97 ? 142 MSE A C 1 +HETATM 1147 O O . MSE A 1 143 ? 44.923 25.990 6.944 1.00 14.50 ? 142 MSE A O 1 +HETATM 1148 C CB . MSE A 1 143 ? 44.883 25.509 10.067 1.00 17.30 ? 142 MSE A CB 1 +HETATM 1149 C CG . MSE A 1 143 ? 43.887 24.973 11.079 1.00 13.64 ? 142 MSE A CG 1 +HETATM 1150 SE SE . MSE A 1 143 ? 43.866 25.920 12.777 0.75 26.91 ? 142 MSE A SE 1 +HETATM 1151 C CE . MSE A 1 143 ? 44.549 27.578 12.373 1.00 19.34 ? 142 MSE A CE 1 +ATOM 1152 N N . LYS A 1 144 ? 46.972 25.327 7.580 1.00 15.51 ? 143 LYS A N 1 +ATOM 1153 C CA . LYS A 1 144 ? 47.595 26.027 6.473 1.00 14.46 ? 143 LYS A CA 1 +ATOM 1154 C C . LYS A 1 144 ? 47.086 25.568 5.111 1.00 14.14 ? 143 LYS A C 1 +ATOM 1155 O O . LYS A 1 144 ? 47.141 26.371 4.153 1.00 17.55 ? 143 LYS A O 1 +ATOM 1156 C CB . LYS A 1 144 ? 49.143 26.017 6.542 1.00 15.73 ? 143 LYS A CB 1 +ATOM 1157 C CG . LYS A 1 144 ? 49.834 24.757 6.169 1.00 20.45 ? 143 LYS A CG 1 +ATOM 1158 C CD . LYS A 1 144 ? 51.381 24.926 6.253 1.00 21.82 ? 143 LYS A CD 1 +ATOM 1159 C CE . LYS A 1 144 ? 52.088 23.648 5.887 1.00 28.73 ? 143 LYS A CE 1 +ATOM 1160 N NZ . LYS A 1 144 ? 53.567 23.809 5.678 1.00 34.91 ? 143 LYS A NZ 1 +ATOM 1161 N N . LYS A 1 145 ? 46.534 24.355 5.057 1.00 17.04 ? 144 LYS A N 1 +ATOM 1162 C CA . LYS A 1 145 ? 46.010 23.748 3.841 1.00 19.12 ? 144 LYS A CA 1 +ATOM 1163 C C . LYS A 1 145 ? 44.583 24.146 3.453 1.00 21.18 ? 144 LYS A C 1 +ATOM 1164 O O . LYS A 1 145 ? 44.176 23.951 2.301 1.00 20.97 ? 144 LYS A O 1 +ATOM 1165 C CB . LYS A 1 145 ? 46.119 22.230 3.941 1.00 22.73 ? 144 LYS A CB 1 +ATOM 1166 N N . ILE A 1 146 ? 43.828 24.712 4.387 1.00 17.59 ? 145 ILE A N 1 +ATOM 1167 C CA . ILE A 1 146 ? 42.427 25.051 4.104 1.00 16.90 ? 145 ILE A CA 1 +ATOM 1168 C C . ILE A 1 146 ? 42.277 25.979 2.911 1.00 17.01 ? 145 ILE A C 1 +ATOM 1169 O O . ILE A 1 146 ? 42.845 27.077 2.863 1.00 16.02 ? 145 ILE A O 1 +ATOM 1170 C CB . ILE A 1 146 ? 41.728 25.664 5.371 1.00 17.74 ? 145 ILE A CB 1 +ATOM 1171 C CG1 . ILE A 1 146 ? 41.631 24.591 6.460 1.00 16.68 ? 145 ILE A CG1 1 +ATOM 1172 C CG2 . ILE A 1 146 ? 40.343 26.184 5.071 1.00 14.99 ? 145 ILE A CG2 1 +ATOM 1173 C CD1 . ILE A 1 146 ? 41.275 25.172 7.876 1.00 14.78 ? 145 ILE A CD1 1 +ATOM 1174 N N . ARG A 1 147 ? 41.466 25.567 1.944 1.00 16.14 ? 146 ARG A N 1 +ATOM 1175 C CA . ARG A 1 147 ? 41.212 26.394 0.777 1.00 16.91 ? 146 ARG A CA 1 +ATOM 1176 C C . ARG A 1 147 ? 39.922 27.203 0.813 1.00 15.87 ? 146 ARG A C 1 +ATOM 1177 O O . ARG A 1 147 ? 39.726 28.127 0.036 1.00 16.15 ? 146 ARG A O 1 +ATOM 1178 C CB . ARG A 1 147 ? 41.216 25.493 -0.460 1.00 18.62 ? 146 ARG A CB 1 +ATOM 1179 C CG . ARG A 1 147 ? 42.493 24.663 -0.619 1.00 22.49 ? 146 ARG A CG 1 +ATOM 1180 C CD . ARG A 1 147 ? 43.777 25.519 -0.754 1.00 29.04 ? 146 ARG A CD 1 +ATOM 1181 N NE . ARG A 1 147 ? 44.980 24.734 -1.080 1.00 38.02 ? 146 ARG A NE 1 +ATOM 1182 C CZ . ARG A 1 147 ? 45.693 24.023 -0.202 1.00 31.87 ? 146 ARG A CZ 1 +ATOM 1183 N N . GLN A 1 148 ? 38.981 26.823 1.708 1.00 13.19 ? 147 GLN A N 1 +ATOM 1184 C CA . GLN A 1 148 ? 37.713 27.524 1.812 1.00 15.57 ? 147 GLN A CA 1 +ATOM 1185 C C . GLN A 1 148 ? 37.857 28.966 2.248 1.00 11.78 ? 147 GLN A C 1 +ATOM 1186 O O . GLN A 1 148 ? 38.764 29.277 3.056 1.00 13.94 ? 147 GLN A O 1 +ATOM 1187 C CB . GLN A 1 148 ? 36.824 26.817 2.846 1.00 15.78 ? 147 GLN A CB 1 +ATOM 1188 C CG . GLN A 1 148 ? 36.140 25.547 2.322 1.00 18.72 ? 147 GLN A CG 1 +ATOM 1189 C CD . GLN A 1 148 ? 37.006 24.317 2.281 1.00 15.16 ? 147 GLN A CD 1 +ATOM 1190 O OE1 . GLN A 1 148 ? 38.177 24.325 2.660 1.00 13.46 ? 147 GLN A OE1 1 +ATOM 1191 N NE2 . GLN A 1 148 ? 36.422 23.221 1.827 1.00 13.75 ? 147 GLN A NE2 1 +ATOM 1192 N N . LYS A 1 149 ? 36.979 29.807 1.720 1.00 13.06 ? 148 LYS A N 1 +ATOM 1193 C CA . LYS A 1 149 ? 36.785 31.151 2.258 1.00 15.11 ? 148 LYS A CA 1 +ATOM 1194 C C . LYS A 1 149 ? 36.456 30.957 3.737 1.00 12.37 ? 148 LYS A C 1 +ATOM 1195 O O . LYS A 1 149 ? 35.548 30.187 4.060 1.00 12.21 ? 148 LYS A O 1 +ATOM 1196 C CB . LYS A 1 149 ? 35.648 31.916 1.549 1.00 16.53 ? 148 LYS A CB 1 +ATOM 1197 C CG . LYS A 1 149 ? 36.041 32.449 0.148 1.00 19.87 ? 148 LYS A CG 1 +ATOM 1198 C CD . LYS A 1 149 ? 34.971 33.314 -0.542 1.00 19.27 ? 148 LYS A CD 1 +ATOM 1199 C CE . LYS A 1 149 ? 35.439 33.719 -1.930 1.00 20.71 ? 148 LYS A CE 1 +ATOM 1200 N NZ . LYS A 1 149 ? 34.460 34.538 -2.720 1.00 16.04 ? 148 LYS A NZ 1 +ATOM 1201 N N . THR A 1 150 ? 37.126 31.725 4.595 1.00 12.45 ? 149 THR A N 1 +ATOM 1202 C CA . THR A 1 150 ? 36.995 31.615 6.037 1.00 11.32 ? 149 THR A CA 1 +ATOM 1203 C C . THR A 1 150 ? 36.853 32.992 6.674 1.00 11.94 ? 149 THR A C 1 +ATOM 1204 O O . THR A 1 150 ? 37.610 33.887 6.356 1.00 13.50 ? 149 THR A O 1 +ATOM 1205 C CB . THR A 1 150 ? 38.254 30.911 6.605 1.00 12.57 ? 149 THR A CB 1 +ATOM 1206 O OG1 . THR A 1 150 ? 38.342 29.569 6.088 1.00 12.04 ? 149 THR A OG1 1 +ATOM 1207 C CG2 . THR A 1 150 ? 38.266 30.836 8.117 1.00 11.01 ? 149 THR A CG2 1 +ATOM 1208 N N . LEU A 1 151 ? 35.863 33.157 7.546 1.00 9.44 ? 150 LEU A N 1 +ATOM 1209 C CA . LEU A 1 151 ? 35.705 34.323 8.366 1.00 9.24 ? 150 LEU A CA 1 +ATOM 1210 C C . LEU A 1 151 ? 36.036 33.943 9.802 1.00 10.30 ? 150 LEU A C 1 +ATOM 1211 O O . LEU A 1 151 ? 35.437 33.017 10.358 1.00 10.65 ? 150 LEU A O 1 +ATOM 1212 C CB . LEU A 1 151 ? 34.259 34.822 8.303 1.00 10.56 ? 150 LEU A CB 1 +ATOM 1213 C CG . LEU A 1 151 ? 33.857 36.002 9.191 1.00 12.01 ? 150 LEU A CG 1 +ATOM 1214 C CD1 . LEU A 1 151 ? 34.578 37.246 8.722 1.00 15.36 ? 150 LEU A CD1 1 +ATOM 1215 C CD2 . LEU A 1 151 ? 32.338 36.196 9.209 1.00 11.49 ? 150 LEU A CD2 1 +ATOM 1216 N N . LEU A 1 152 ? 37.000 34.652 10.370 1.00 9.20 ? 151 LEU A N 1 +ATOM 1217 C CA . LEU A 1 152 ? 37.378 34.563 11.778 1.00 9.26 ? 151 LEU A CA 1 +ATOM 1218 C C . LEU A 1 152 ? 36.838 35.779 12.486 1.00 9.41 ? 151 LEU A C 1 +ATOM 1219 O O . LEU A 1 152 ? 37.084 36.920 12.092 1.00 9.08 ? 151 LEU A O 1 +ATOM 1220 C CB . LEU A 1 152 ? 38.906 34.541 11.891 1.00 10.41 ? 151 LEU A CB 1 +ATOM 1221 C CG . LEU A 1 152 ? 39.596 33.360 11.222 1.00 12.16 ? 151 LEU A CG 1 +ATOM 1222 C CD1 . LEU A 1 152 ? 41.105 33.519 11.200 1.00 14.09 ? 151 LEU A CD1 1 +ATOM 1223 C CD2 . LEU A 1 152 ? 39.269 32.026 11.839 1.00 12.78 ? 151 LEU A CD2 1 +ATOM 1224 N N . VAL A 1 153 ? 36.029 35.559 13.528 1.00 10.67 ? 152 VAL A N 1 +ATOM 1225 C CA . VAL A 1 153 ? 35.394 36.623 14.306 1.00 9.89 ? 152 VAL A CA 1 +ATOM 1226 C C . VAL A 1 153 ? 35.899 36.528 15.717 1.00 8.76 ? 152 VAL A C 1 +ATOM 1227 O O . VAL A 1 153 ? 35.866 35.468 16.308 1.00 9.98 ? 152 VAL A O 1 +ATOM 1228 C CB . VAL A 1 153 ? 33.854 36.532 14.273 1.00 9.99 ? 152 VAL A CB 1 +ATOM 1229 C CG1 . VAL A 1 153 ? 33.259 37.689 15.059 1.00 10.56 ? 152 VAL A CG1 1 +ATOM 1230 C CG2 . VAL A 1 153 ? 33.321 36.548 12.824 1.00 12.38 ? 152 VAL A CG2 1 +ATOM 1231 N N . TRP A 1 154 ? 36.345 37.649 16.277 1.00 9.71 ? 153 TRP A N 1 +ATOM 1232 C CA . TRP A 1 154 ? 36.778 37.702 17.659 1.00 9.05 ? 153 TRP A CA 1 +ATOM 1233 C C . TRP A 1 154 ? 36.217 38.962 18.288 1.00 10.45 ? 153 TRP A C 1 +ATOM 1234 O O . TRP A 1 154 ? 36.156 40.004 17.648 1.00 11.86 ? 153 TRP A O 1 +ATOM 1235 C CB . TRP A 1 154 ? 38.317 37.794 17.779 1.00 9.87 ? 153 TRP A CB 1 +ATOM 1236 C CG . TRP A 1 154 ? 39.027 36.632 18.392 1.00 10.29 ? 153 TRP A CG 1 +ATOM 1237 C CD1 . TRP A 1 154 ? 39.424 36.479 19.710 1.00 10.96 ? 153 TRP A CD1 1 +ATOM 1238 C CD2 . TRP A 1 154 ? 39.509 35.490 17.704 1.00 11.19 ? 153 TRP A CD2 1 +ATOM 1239 N NE1 . TRP A 1 154 ? 40.097 35.319 19.864 1.00 13.86 ? 153 TRP A NE1 1 +ATOM 1240 C CE2 . TRP A 1 154 ? 40.187 34.688 18.649 1.00 11.82 ? 153 TRP A CE2 1 +ATOM 1241 C CE3 . TRP A 1 154 ? 39.440 35.065 16.380 1.00 12.69 ? 153 TRP A CE3 1 +ATOM 1242 C CZ2 . TRP A 1 154 ? 40.818 33.483 18.276 1.00 11.19 ? 153 TRP A CZ2 1 +ATOM 1243 C CZ3 . TRP A 1 154 ? 40.055 33.900 16.019 1.00 13.46 ? 153 TRP A CZ3 1 +ATOM 1244 C CH2 . TRP A 1 154 ? 40.725 33.120 16.963 1.00 11.54 ? 153 TRP A CH2 1 +ATOM 1245 N N . GLY A 1 155 ? 35.885 38.893 19.561 1.00 8.65 ? 154 GLY A N 1 +ATOM 1246 C CA . GLY A 1 155 ? 35.618 40.085 20.351 1.00 10.90 ? 154 GLY A CA 1 +ATOM 1247 C C . GLY A 1 155 ? 36.896 40.740 20.844 1.00 11.94 ? 154 GLY A C 1 +ATOM 1248 O O . GLY A 1 155 ? 37.829 40.046 21.211 1.00 11.47 ? 154 GLY A O 1 +ATOM 1249 N N . SER A 1 156 ? 36.912 42.060 20.894 1.00 11.71 ? 155 SER A N 1 +ATOM 1250 C CA . SER A 1 156 ? 38.113 42.832 21.276 1.00 12.55 ? 155 SER A CA 1 +ATOM 1251 C C . SER A 1 156 ? 38.497 42.595 22.714 1.00 13.64 ? 155 SER A C 1 +ATOM 1252 O O . SER A 1 156 ? 39.667 42.754 23.068 1.00 15.40 ? 155 SER A O 1 +ATOM 1253 C CB . SER A 1 156 ? 37.887 44.326 21.050 1.00 14.33 ? 155 SER A CB 1 +ATOM 1254 O OG . SER A 1 156 ? 36.924 44.862 21.917 1.00 14.87 ? 155 SER A OG 1 +ATOM 1255 N N . LYS A 1 157 ? 37.545 42.150 23.519 1.00 12.44 ? 156 LYS A N 1 +ATOM 1256 C CA . LYS A 1 157 ? 37.760 41.911 24.960 1.00 14.49 ? 156 LYS A CA 1 +ATOM 1257 C C . LYS A 1 157 ? 37.865 40.417 25.292 1.00 13.35 ? 156 LYS A C 1 +ATOM 1258 O O . LYS A 1 157 ? 37.718 40.015 26.456 1.00 17.02 ? 156 LYS A O 1 +ATOM 1259 C CB . LYS A 1 157 ? 36.626 42.549 25.794 1.00 15.14 ? 156 LYS A CB 1 +ATOM 1260 C CG . LYS A 1 157 ? 36.425 44.004 25.515 1.00 17.14 ? 156 LYS A CG 1 +ATOM 1261 C CD . LYS A 1 157 ? 35.201 44.558 26.241 1.00 21.71 ? 156 LYS A CD 1 +ATOM 1262 C CE . LYS A 1 157 ? 35.504 45.089 27.582 1.00 31.43 ? 156 LYS A CE 1 +ATOM 1263 N NZ . LYS A 1 157 ? 34.514 46.189 27.912 1.00 29.33 ? 156 LYS A NZ 1 +ATOM 1264 N N . ASP A 1 158 ? 38.056 39.566 24.293 1.00 13.70 ? 157 ASP A N 1 +ATOM 1265 C CA . ASP A 1 158 ? 38.138 38.128 24.532 1.00 14.43 ? 157 ASP A CA 1 +ATOM 1266 C C . ASP A 1 158 ? 39.445 37.751 25.220 1.00 15.38 ? 157 ASP A C 1 +ATOM 1267 O O . ASP A 1 158 ? 40.531 37.906 24.636 1.00 16.99 ? 157 ASP A O 1 +ATOM 1268 C CB . ASP A 1 158 ? 37.995 37.405 23.190 1.00 14.16 ? 157 ASP A CB 1 +ATOM 1269 C CG . ASP A 1 158 ? 37.816 35.897 23.312 1.00 14.83 ? 157 ASP A CG 1 +ATOM 1270 O OD1 . ASP A 1 158 ? 38.076 35.294 24.403 1.00 14.99 ? 157 ASP A OD1 1 +ATOM 1271 O OD2 . ASP A 1 158 ? 37.483 35.284 22.284 1.00 12.47 ? 157 ASP A OD2 1 +ATOM 1272 N N . HIS A 1 159 ? 39.325 37.257 26.437 1.00 17.27 ? 158 HIS A N 1 +ATOM 1273 C CA . HIS A 1 159 ? 40.453 36.687 27.180 1.00 18.17 ? 158 HIS A CA 1 +ATOM 1274 C C . HIS A 1 159 ? 40.296 35.192 27.410 1.00 20.66 ? 158 HIS A C 1 +ATOM 1275 O O . HIS A 1 159 ? 41.037 34.611 28.214 1.00 24.20 ? 158 HIS A O 1 +ATOM 1276 C CB . HIS A 1 159 ? 40.609 37.414 28.523 1.00 19.58 ? 158 HIS A CB 1 +ATOM 1277 C CG . HIS A 1 159 ? 40.786 38.899 28.399 1.00 26.59 ? 158 HIS A CG 1 +ATOM 1278 N ND1 . HIS A 1 159 ? 41.928 39.474 27.877 1.00 34.39 ? 158 HIS A ND1 1 +ATOM 1279 C CD2 . HIS A 1 159 ? 39.960 39.926 28.716 1.00 34.02 ? 158 HIS A CD2 1 +ATOM 1280 C CE1 . HIS A 1 159 ? 41.792 40.789 27.872 1.00 33.47 ? 158 HIS A CE1 1 +ATOM 1281 N NE2 . HIS A 1 159 ? 40.612 41.091 28.384 1.00 33.22 ? 158 HIS A NE2 1 +ATOM 1282 N N . VAL A 1 160 ? 39.311 34.568 26.753 1.00 15.22 ? 159 VAL A N 1 +ATOM 1283 C CA . VAL A 1 160 ? 39.102 33.118 26.836 1.00 15.16 ? 159 VAL A CA 1 +ATOM 1284 C C . VAL A 1 160 ? 39.975 32.392 25.820 1.00 16.70 ? 159 VAL A C 1 +ATOM 1285 O O . VAL A 1 160 ? 40.665 31.385 26.134 1.00 16.52 ? 159 VAL A O 1 +ATOM 1286 C CB . VAL A 1 160 ? 37.609 32.769 26.627 1.00 16.41 ? 159 VAL A CB 1 +ATOM 1287 C CG1 . VAL A 1 160 ? 37.371 31.232 26.521 1.00 19.19 ? 159 VAL A CG1 1 +ATOM 1288 C CG2 . VAL A 1 160 ? 36.771 33.394 27.751 1.00 17.60 ? 159 VAL A CG2 1 +ATOM 1289 N N . VAL A 1 161 ? 39.905 32.854 24.581 1.00 14.22 ? 160 VAL A N 1 +ATOM 1290 C CA . VAL A 1 161 ? 40.787 32.392 23.535 1.00 15.95 ? 160 VAL A CA 1 +ATOM 1291 C C . VAL A 1 161 ? 41.546 33.634 23.094 1.00 18.72 ? 160 VAL A C 1 +ATOM 1292 O O . VAL A 1 161 ? 40.984 34.559 22.517 1.00 16.18 ? 160 VAL A O 1 +ATOM 1293 C CB . VAL A 1 161 ? 40.053 31.711 22.340 1.00 14.96 ? 160 VAL A CB 1 +ATOM 1294 C CG1 . VAL A 1 161 ? 41.044 31.322 21.241 1.00 14.06 ? 160 VAL A CG1 1 +ATOM 1295 C CG2 . VAL A 1 161 ? 39.240 30.496 22.783 1.00 15.12 ? 160 VAL A CG2 1 +ATOM 1296 N N . PRO A 1 162 ? 42.834 33.692 23.423 1.00 20.58 ? 161 PRO A N 1 +ATOM 1297 C CA . PRO A 1 162 ? 43.572 34.922 23.277 1.00 20.89 ? 161 PRO A CA 1 +ATOM 1298 C C . PRO A 1 162 ? 43.499 35.583 21.898 1.00 18.68 ? 161 PRO A C 1 +ATOM 1299 O O . PRO A 1 162 ? 43.588 34.913 20.890 1.00 18.07 ? 161 PRO A O 1 +ATOM 1300 C CB . PRO A 1 162 ? 45.025 34.485 23.513 1.00 22.65 ? 161 PRO A CB 1 +ATOM 1301 C CG . PRO A 1 162 ? 44.976 33.229 24.221 1.00 26.85 ? 161 PRO A CG 1 +ATOM 1302 C CD . PRO A 1 162 ? 43.651 32.609 23.999 1.00 21.65 ? 161 PRO A CD 1 +ATOM 1303 N N A ILE A 1 163 ? 43.385 36.897 21.885 0.50 21.36 ? 162 ILE A N 1 +ATOM 1304 N N B ILE A 1 163 ? 43.361 36.904 21.872 0.50 21.30 ? 162 ILE A N 1 +ATOM 1305 C CA A ILE A 1 163 ? 43.280 37.646 20.645 0.50 21.60 ? 162 ILE A CA 1 +ATOM 1306 C CA B ILE A 1 163 ? 43.313 37.661 20.613 0.50 21.44 ? 162 ILE A CA 1 +ATOM 1307 C C A ILE A 1 163 ? 44.571 37.547 19.799 0.50 21.35 ? 162 ILE A C 1 +ATOM 1308 C C B ILE A 1 163 ? 44.578 37.485 19.780 0.50 20.95 ? 162 ILE A C 1 +ATOM 1309 O O A ILE A 1 163 ? 44.524 37.691 18.583 0.50 21.19 ? 162 ILE A O 1 +ATOM 1310 O O B ILE A 1 163 ? 44.527 37.512 18.554 0.50 20.03 ? 162 ILE A O 1 +ATOM 1311 C CB A ILE A 1 163 ? 42.855 39.096 20.945 0.50 24.48 ? 162 ILE A CB 1 +ATOM 1312 C CB B ILE A 1 163 ? 43.019 39.162 20.851 0.50 24.34 ? 162 ILE A CB 1 +ATOM 1313 C CG1 A ILE A 1 163 ? 42.334 39.794 19.685 0.50 24.05 ? 162 ILE A CG1 1 +ATOM 1314 C CG1 B ILE A 1 163 ? 41.512 39.384 21.005 0.50 22.65 ? 162 ILE A CG1 1 +ATOM 1315 C CG2 A ILE A 1 163 ? 43.985 39.866 21.598 0.50 22.81 ? 162 ILE A CG2 1 +ATOM 1316 C CG2 B ILE A 1 163 ? 43.556 40.042 19.707 0.50 25.79 ? 162 ILE A CG2 1 +ATOM 1317 C CD1 A ILE A 1 163 ? 40.875 39.559 19.421 0.50 20.83 ? 162 ILE A CD1 1 +ATOM 1318 C CD1 B ILE A 1 163 ? 40.973 40.486 20.112 0.50 21.47 ? 162 ILE A CD1 1 +ATOM 1319 N N . ALA A 1 164 ? 45.720 37.284 20.432 1.00 21.86 ? 163 ALA A N 1 +ATOM 1320 C CA . ALA A 1 164 ? 46.942 36.991 19.702 1.00 23.07 ? 163 ALA A CA 1 +ATOM 1321 C C . ALA A 1 164 ? 46.786 35.831 18.712 1.00 22.28 ? 163 ALA A C 1 +ATOM 1322 O O . ALA A 1 164 ? 47.356 35.873 17.630 1.00 22.00 ? 163 ALA A O 1 +ATOM 1323 C CB . ALA A 1 164 ? 48.104 36.722 20.683 1.00 25.45 ? 163 ALA A CB 1 +ATOM 1324 N N . LEU A 1 165 ? 45.978 34.816 19.056 1.00 17.74 ? 164 LEU A N 1 +ATOM 1325 C CA . LEU A 1 165 ? 45.739 33.706 18.143 1.00 17.08 ? 164 LEU A CA 1 +ATOM 1326 C C . LEU A 1 165 ? 44.924 34.105 16.937 1.00 17.47 ? 164 LEU A C 1 +ATOM 1327 O O . LEU A 1 165 ? 45.031 33.472 15.895 1.00 19.71 ? 164 LEU A O 1 +ATOM 1328 C CB . LEU A 1 165 ? 45.028 32.532 18.861 1.00 19.02 ? 164 LEU A CB 1 +ATOM 1329 C CG . LEU A 1 165 ? 45.861 31.705 19.826 1.00 20.81 ? 164 LEU A CG 1 +ATOM 1330 C CD1 . LEU A 1 165 ? 44.927 30.828 20.629 1.00 19.00 ? 164 LEU A CD1 1 +ATOM 1331 C CD2 . LEU A 1 165 ? 46.893 30.859 19.056 1.00 23.82 ? 164 LEU A CD2 1 +ATOM 1332 N N . SER A 1 166 ? 44.059 35.116 17.093 1.00 15.80 ? 165 SER A N 1 +ATOM 1333 C CA . SER A 1 166 ? 43.304 35.634 15.961 1.00 16.41 ? 165 SER A CA 1 +ATOM 1334 C C . SER A 1 166 ? 44.217 36.004 14.775 1.00 16.46 ? 165 SER A C 1 +ATOM 1335 O O . SER A 1 166 ? 43.949 35.627 13.638 1.00 14.94 ? 165 SER A O 1 +ATOM 1336 C CB . SER A 1 166 ? 42.396 36.810 16.353 1.00 17.51 ? 165 SER A CB 1 +ATOM 1337 O OG . SER A 1 166 ? 43.095 38.018 16.535 1.00 15.37 ? 165 SER A OG 1 +ATOM 1338 N N . LYS A 1 167 ? 45.272 36.755 15.064 1.00 18.07 ? 166 LYS A N 1 +ATOM 1339 C CA . LYS A 1 167 ? 46.172 37.249 14.029 1.00 18.57 ? 166 LYS A CA 1 +ATOM 1340 C C . LYS A 1 167 ? 47.001 36.092 13.471 1.00 16.77 ? 166 LYS A C 1 +ATOM 1341 O O . LYS A 1 167 ? 47.250 36.004 12.268 1.00 16.34 ? 166 LYS A O 1 +ATOM 1342 C CB . LYS A 1 167 ? 47.049 38.373 14.602 1.00 21.50 ? 166 LYS A CB 1 +ATOM 1343 C CG . LYS A 1 167 ? 46.227 39.575 15.055 1.00 25.12 ? 166 LYS A CG 1 +ATOM 1344 N N . GLU A 1 168 ? 47.368 35.172 14.335 1.00 15.94 ? 167 GLU A N 1 +ATOM 1345 C CA . GLU A 1 168 ? 48.074 33.995 13.898 1.00 16.29 ? 167 GLU A CA 1 +ATOM 1346 C C . GLU A 1 168 ? 47.211 33.083 13.003 1.00 15.22 ? 167 GLU A C 1 +ATOM 1347 O O . GLU A 1 168 ? 47.598 32.667 11.928 1.00 15.32 ? 167 GLU A O 1 +ATOM 1348 C CB . GLU A 1 168 ? 48.602 33.228 15.083 1.00 19.16 ? 167 GLU A CB 1 +ATOM 1349 C CG . GLU A 1 168 ? 49.595 32.203 14.621 1.00 26.43 ? 167 GLU A CG 1 +ATOM 1350 C CD . GLU A 1 168 ? 50.208 31.404 15.723 1.00 29.05 ? 167 GLU A CD 1 +ATOM 1351 O OE1 . GLU A 1 168 ? 49.888 31.668 16.910 1.00 25.61 ? 167 GLU A OE1 1 +ATOM 1352 O OE2 . GLU A 1 168 ? 51.017 30.516 15.361 1.00 26.29 ? 167 GLU A OE2 1 +ATOM 1353 N N . TYR A 1 169 ? 45.976 32.797 13.414 1.00 12.97 ? 168 TYR A N 1 +ATOM 1354 C CA . TYR A 1 169 ? 45.129 31.961 12.582 1.00 13.33 ? 168 TYR A CA 1 +ATOM 1355 C C . TYR A 1 169 ? 44.800 32.644 11.260 1.00 13.65 ? 168 TYR A C 1 +ATOM 1356 O O . TYR A 1 169 ? 44.650 31.966 10.241 1.00 14.20 ? 168 TYR A O 1 +ATOM 1357 C CB . TYR A 1 169 ? 43.841 31.603 13.325 1.00 12.93 ? 168 TYR A CB 1 +ATOM 1358 C CG . TYR A 1 169 ? 43.983 30.675 14.500 1.00 15.04 ? 168 TYR A CG 1 +ATOM 1359 C CD1 . TYR A 1 169 ? 45.181 30.014 14.790 1.00 18.00 ? 168 TYR A CD1 1 +ATOM 1360 C CD2 . TYR A 1 169 ? 42.892 30.432 15.341 1.00 12.54 ? 168 TYR A CD2 1 +ATOM 1361 C CE1 . TYR A 1 169 ? 45.284 29.157 15.881 1.00 17.34 ? 168 TYR A CE1 1 +ATOM 1362 C CE2 . TYR A 1 169 ? 42.990 29.593 16.412 1.00 14.07 ? 168 TYR A CE2 1 +ATOM 1363 C CZ . TYR A 1 169 ? 44.182 28.951 16.701 1.00 15.63 ? 168 TYR A CZ 1 +ATOM 1364 O OH . TYR A 1 169 ? 44.276 28.101 17.782 1.00 18.52 ? 168 TYR A OH 1 +ATOM 1365 N N . ALA A 1 170 ? 44.698 33.972 11.260 1.00 14.44 ? 169 ALA A N 1 +ATOM 1366 C CA . ALA A 1 170 ? 44.389 34.716 10.052 1.00 13.19 ? 169 ALA A CA 1 +ATOM 1367 C C . ALA A 1 170 ? 45.537 34.611 9.046 1.00 17.32 ? 169 ALA A C 1 +ATOM 1368 O O . ALA A 1 170 ? 45.333 34.605 7.835 1.00 18.70 ? 169 ALA A O 1 +ATOM 1369 C CB . ALA A 1 170 ? 44.127 36.166 10.386 1.00 16.29 ? 169 ALA A CB 1 +ATOM 1370 N N . SER A 1 171 ? 46.733 34.521 9.570 1.00 15.64 ? 170 SER A N 1 +ATOM 1371 C CA . SER A 1 171 ? 47.904 34.316 8.704 1.00 16.09 ? 170 SER A CA 1 +ATOM 1372 C C . SER A 1 171 ? 47.998 32.903 8.151 1.00 15.98 ? 170 SER A C 1 +ATOM 1373 O O . SER A 1 171 ? 48.372 32.677 6.988 1.00 17.77 ? 170 SER A O 1 +ATOM 1374 C CB . SER A 1 171 ? 49.152 34.581 9.525 1.00 19.08 ? 170 SER A CB 1 +ATOM 1375 O OG . SER A 1 171 ? 49.144 35.873 10.067 1.00 29.80 ? 170 SER A OG 1 +ATOM 1376 N N . ILE A 1 172 ? 47.719 31.925 8.990 1.00 13.78 ? 171 ILE A N 1 +ATOM 1377 C CA . ILE A 1 172 ? 47.758 30.536 8.592 1.00 13.19 ? 171 ILE A CA 1 +ATOM 1378 C C . ILE A 1 172 ? 46.726 30.216 7.499 1.00 15.58 ? 171 ILE A C 1 +ATOM 1379 O O . ILE A 1 172 ? 47.026 29.489 6.542 1.00 15.76 ? 171 ILE A O 1 +ATOM 1380 C CB . ILE A 1 172 ? 47.566 29.602 9.829 1.00 16.37 ? 171 ILE A CB 1 +ATOM 1381 C CG1 . ILE A 1 172 ? 48.755 29.771 10.788 1.00 15.52 ? 171 ILE A CG1 1 +ATOM 1382 C CG2 . ILE A 1 172 ? 47.404 28.152 9.424 1.00 17.52 ? 171 ILE A CG2 1 +ATOM 1383 C CD1 . ILE A 1 172 ? 48.522 29.175 12.183 1.00 18.59 ? 171 ILE A CD1 1 +ATOM 1384 N N . ILE A 1 173 ? 45.485 30.680 7.651 1.00 13.90 ? 172 ILE A N 1 +ATOM 1385 C CA . ILE A 1 173 ? 44.447 30.337 6.678 1.00 12.32 ? 172 ILE A CA 1 +ATOM 1386 C C . ILE A 1 173 ? 44.428 31.410 5.599 1.00 11.05 ? 172 ILE A C 1 +ATOM 1387 O O . ILE A 1 173 ? 44.005 32.519 5.795 1.00 13.82 ? 172 ILE A O 1 +ATOM 1388 C CB . ILE A 1 173 ? 43.046 30.187 7.367 1.00 12.09 ? 172 ILE A CB 1 +ATOM 1389 C CG1 . ILE A 1 173 ? 43.130 29.131 8.453 1.00 14.31 ? 172 ILE A CG1 1 +ATOM 1390 C CG2 . ILE A 1 173 ? 42.019 29.833 6.339 1.00 14.70 ? 172 ILE A CG2 1 +ATOM 1391 C CD1 . ILE A 1 173 ? 41.837 29.017 9.325 1.00 15.12 ? 172 ILE A CD1 1 +ATOM 1392 N N . SER A 1 174 ? 44.965 31.077 4.406 1.00 13.07 ? 173 SER A N 1 +ATOM 1393 C CA . SER A 1 174 ? 45.077 32.072 3.323 1.00 13.79 ? 173 SER A CA 1 +ATOM 1394 C C . SER A 1 174 ? 43.754 32.604 2.869 1.00 17.70 ? 173 SER A C 1 +ATOM 1395 O O . SER A 1 174 ? 42.835 31.832 2.708 1.00 14.84 ? 173 SER A O 1 +ATOM 1396 C CB . SER A 1 174 ? 45.760 31.484 2.115 1.00 19.14 ? 173 SER A CB 1 +ATOM 1397 O OG . SER A 1 174 ? 46.948 30.868 2.524 1.00 17.19 ? 173 SER A OG 1 +ATOM 1398 N N . GLY A 1 175 ? 43.637 33.922 2.690 1.00 17.26 ? 174 GLY A N 1 +ATOM 1399 C CA . GLY A 1 175 ? 42.368 34.522 2.236 1.00 19.17 ? 174 GLY A CA 1 +ATOM 1400 C C . GLY A 1 175 ? 41.340 34.723 3.328 1.00 19.50 ? 174 GLY A C 1 +ATOM 1401 O O . GLY A 1 175 ? 40.271 35.401 3.085 1.00 19.05 ? 174 GLY A O 1 +ATOM 1402 N N . SER A 1 176 ? 41.612 34.134 4.513 1.00 18.80 ? 175 SER A N 1 +ATOM 1403 C CA . SER A 1 176 ? 40.737 34.345 5.677 1.00 14.31 ? 175 SER A CA 1 +ATOM 1404 C C . SER A 1 176 ? 40.494 35.823 5.905 1.00 16.43 ? 175 SER A C 1 +ATOM 1405 O O . SER A 1 176 ? 41.367 36.671 5.602 1.00 20.46 ? 175 SER A O 1 +ATOM 1406 C CB . SER A 1 176 ? 41.247 33.624 6.939 1.00 15.21 ? 175 SER A CB 1 +ATOM 1407 O OG . SER A 1 176 ? 42.466 34.141 7.454 1.00 16.36 ? 175 SER A OG 1 +ATOM 1408 N N . ARG A 1 177 ? 39.262 36.155 6.288 1.00 15.34 ? 176 ARG A N 1 +ATOM 1409 C CA . ARG A 1 177 ? 38.804 37.535 6.647 1.00 15.54 ? 176 ARG A CA 1 +ATOM 1410 C C . ARG A 1 177 ? 38.788 37.517 8.221 1.00 16.25 ? 176 ARG A C 1 +ATOM 1411 O O . ARG A 1 177 ? 38.069 36.726 8.785 1.00 14.28 ? 176 ARG A O 1 +ATOM 1412 C CB . ARG A 1 177 ? 37.370 37.822 6.074 1.00 15.89 ? 176 ARG A CB 1 +ATOM 1413 C CG . ARG A 1 177 ? 36.672 39.066 6.625 1.00 14.30 ? 176 ARG A CG 1 +ATOM 1414 C CD . ARG A 1 177 ? 35.431 39.453 5.754 1.00 16.53 ? 176 ARG A CD 1 +ATOM 1415 N NE . ARG A 1 177 ? 34.714 40.540 6.390 1.00 14.16 ? 176 ARG A NE 1 +ATOM 1416 C CZ . ARG A 1 177 ? 33.456 40.871 6.007 1.00 20.96 ? 176 ARG A CZ 1 +ATOM 1417 N NH1 . ARG A 1 177 ? 32.865 40.260 4.962 1.00 19.73 ? 176 ARG A NH1 1 +ATOM 1418 N NH2 . ARG A 1 177 ? 32.848 41.906 6.549 1.00 20.75 ? 176 ARG A NH2 1 +ATOM 1419 N N . LEU A 1 178 ? 39.640 38.304 8.898 1.00 15.50 ? 177 LEU A N 1 +ATOM 1420 C CA . LEU A 1 178 ? 39.571 38.493 10.384 1.00 12.77 ? 177 LEU A CA 1 +ATOM 1421 C C . LEU A 1 178 ? 38.823 39.763 10.720 1.00 14.36 ? 177 LEU A C 1 +ATOM 1422 O O . LEU A 1 178 ? 39.162 40.851 10.239 1.00 14.68 ? 177 LEU A O 1 +ATOM 1423 C CB . LEU A 1 178 ? 40.954 38.586 11.025 1.00 14.40 ? 177 LEU A CB 1 +ATOM 1424 C CG . LEU A 1 178 ? 41.037 38.877 12.529 1.00 14.99 ? 177 LEU A CG 1 +ATOM 1425 C CD1 . LEU A 1 178 ? 40.258 37.783 13.304 1.00 13.65 ? 177 LEU A CD1 1 +ATOM 1426 C CD2 . LEU A 1 178 ? 42.489 39.006 12.992 1.00 18.15 ? 177 LEU A CD2 1 +ATOM 1427 N N A GLU A 1 179 ? 37.811 39.636 11.545 0.50 11.13 ? 178 GLU A N 1 +ATOM 1428 N N B GLU A 1 179 ? 37.760 39.619 11.517 0.50 11.73 ? 178 GLU A N 1 +ATOM 1429 C CA A GLU A 1 179 ? 37.115 40.797 12.054 0.50 11.02 ? 178 GLU A CA 1 +ATOM 1430 C CA B GLU A 1 179 ? 36.928 40.717 11.996 0.50 12.38 ? 178 GLU A CA 1 +ATOM 1431 C C A GLU A 1 179 ? 37.077 40.830 13.585 0.50 10.47 ? 178 GLU A C 1 +ATOM 1432 C C B GLU A 1 179 ? 36.889 40.791 13.523 0.50 11.24 ? 178 GLU A C 1 +ATOM 1433 O O A GLU A 1 179 ? 36.593 39.944 14.158 0.50 9.71 ? 178 GLU A O 1 +ATOM 1434 O O B GLU A 1 179 ? 36.257 39.961 14.183 0.50 11.25 ? 178 GLU A O 1 +ATOM 1435 C CB A GLU A 1 179 ? 35.712 40.848 11.518 0.50 11.05 ? 178 GLU A CB 1 +ATOM 1436 C CB B GLU A 1 179 ? 35.495 40.566 11.472 0.50 12.03 ? 178 GLU A CB 1 +ATOM 1437 C CG A GLU A 1 179 ? 35.591 40.735 9.920 0.50 10.59 ? 178 GLU A CG 1 +ATOM 1438 C CG B GLU A 1 179 ? 35.297 41.192 10.080 0.50 16.74 ? 178 GLU A CG 1 +ATOM 1439 C CD A GLU A 1 179 ? 36.002 41.926 8.967 0.50 24.99 ? 178 GLU A CD 1 +ATOM 1440 C CD B GLU A 1 179 ? 35.620 42.700 10.084 0.50 15.06 ? 178 GLU A CD 1 +ATOM 1441 O OE1 A GLU A 1 179 ? 37.141 42.100 8.483 0.50 14.68 ? 178 GLU A OE1 1 +ATOM 1442 O OE1 B GLU A 1 179 ? 34.707 43.493 10.234 0.50 24.92 ? 178 GLU A OE1 1 +ATOM 1443 O OE2 A GLU A 1 179 ? 35.127 42.513 8.457 0.50 17.16 ? 178 GLU A OE2 1 +ATOM 1444 O OE2 B GLU A 1 179 ? 36.822 43.093 10.006 0.50 14.65 ? 178 GLU A OE2 1 +ATOM 1445 N N A ILE A 1 180 ? 37.589 41.896 14.193 0.50 11.09 ? 179 ILE A N 1 +ATOM 1446 N N B ILE A 1 180 ? 37.570 41.794 14.077 0.50 10.83 ? 179 ILE A N 1 +ATOM 1447 C CA A ILE A 1 180 ? 37.591 42.012 15.630 0.50 11.28 ? 179 ILE A CA 1 +ATOM 1448 C CA B ILE A 1 180 ? 37.524 42.092 15.510 0.50 9.57 ? 179 ILE A CA 1 +ATOM 1449 C C A ILE A 1 180 ? 36.487 43.017 15.978 0.50 11.47 ? 179 ILE A C 1 +ATOM 1450 C C B ILE A 1 180 ? 36.324 42.968 15.782 0.50 10.74 ? 179 ILE A C 1 +ATOM 1451 O O A ILE A 1 180 ? 36.508 44.176 15.545 0.50 12.43 ? 179 ILE A O 1 +ATOM 1452 O O B ILE A 1 180 ? 36.119 43.986 15.102 0.50 9.73 ? 179 ILE A O 1 +ATOM 1453 C CB A ILE A 1 180 ? 39.009 42.431 16.191 0.50 10.34 ? 179 ILE A CB 1 +ATOM 1454 C CB B ILE A 1 180 ? 38.809 42.833 16.020 0.50 9.49 ? 179 ILE A CB 1 +ATOM 1455 C CG1 A ILE A 1 180 ? 40.100 41.393 15.844 0.50 11.06 ? 179 ILE A CG1 1 +ATOM 1456 C CG1 B ILE A 1 180 ? 40.088 42.044 15.706 0.50 9.87 ? 179 ILE A CG1 1 +ATOM 1457 C CG2 A ILE A 1 180 ? 38.948 42.566 17.684 0.50 11.96 ? 179 ILE A CG2 1 +ATOM 1458 C CG2 B ILE A 1 180 ? 38.702 43.106 17.521 0.50 10.10 ? 179 ILE A CG2 1 +ATOM 1459 C CD1 A ILE A 1 180 ? 41.543 41.832 16.150 0.50 12.78 ? 179 ILE A CD1 1 +ATOM 1460 C CD1 B ILE A 1 180 ? 40.086 40.587 16.182 0.50 13.16 ? 179 ILE A CD1 1 +ATOM 1461 N N . VAL A 1 181 ? 35.498 42.548 16.745 1.00 10.42 ? 180 VAL A N 1 +ATOM 1462 C CA . VAL A 1 181 ? 34.315 43.311 17.086 1.00 11.43 ? 180 VAL A CA 1 +ATOM 1463 C C . VAL A 1 181 ? 34.545 44.034 18.410 1.00 11.78 ? 180 VAL A C 1 +ATOM 1464 O O . VAL A 1 181 ? 34.720 43.407 19.448 1.00 11.07 ? 180 VAL A O 1 +ATOM 1465 C CB . VAL A 1 181 ? 33.092 42.374 17.150 1.00 12.45 ? 180 VAL A CB 1 +ATOM 1466 C CG1 . VAL A 1 181 ? 31.822 43.138 17.561 1.00 13.02 ? 180 VAL A CG1 1 +ATOM 1467 C CG2 . VAL A 1 181 ? 32.896 41.650 15.829 1.00 13.35 ? 180 VAL A CG2 1 +ATOM 1468 N N A GLU A 1 182 ? 34.517 45.364 18.334 0.50 11.14 ? 181 GLU A N 1 +ATOM 1469 N N B GLU A 1 182 ? 34.556 45.369 18.357 0.50 12.57 ? 181 GLU A N 1 +ATOM 1470 C CA A GLU A 1 182 ? 34.690 46.231 19.476 0.50 10.88 ? 181 GLU A CA 1 +ATOM 1471 C CA B GLU A 1 182 ? 34.793 46.162 19.547 0.50 13.74 ? 181 GLU A CA 1 +ATOM 1472 C C A GLU A 1 182 ? 33.634 46.013 20.544 0.50 11.37 ? 181 GLU A C 1 +ATOM 1473 C C B GLU A 1 182 ? 33.675 46.023 20.539 0.50 12.85 ? 181 GLU A C 1 +ATOM 1474 O O A GLU A 1 182 ? 32.452 45.899 20.238 0.50 11.98 ? 181 GLU A O 1 +ATOM 1475 O O B GLU A 1 182 ? 32.507 45.989 20.177 0.50 13.92 ? 181 GLU A O 1 +ATOM 1476 C CB A GLU A 1 182 ? 34.655 47.696 18.975 0.50 11.50 ? 181 GLU A CB 1 +ATOM 1477 C CB B GLU A 1 182 ? 34.972 47.654 19.209 0.50 16.14 ? 181 GLU A CB 1 +ATOM 1478 C CG A GLU A 1 182 ? 34.846 48.774 20.038 0.50 14.26 ? 181 GLU A CG 1 +ATOM 1479 C CG B GLU A 1 182 ? 36.179 47.951 18.366 0.50 19.57 ? 181 GLU A CG 1 +ATOM 1480 C CD A GLU A 1 182 ? 36.150 48.666 20.812 0.50 19.43 ? 181 GLU A CD 1 +ATOM 1481 C CD B GLU A 1 182 ? 37.463 47.455 18.994 0.50 24.31 ? 181 GLU A CD 1 +ATOM 1482 O OE1 A GLU A 1 182 ? 37.162 48.254 20.217 0.50 17.51 ? 181 GLU A OE1 1 +ATOM 1483 O OE1 B GLU A 1 182 ? 37.699 47.756 20.191 0.50 32.45 ? 181 GLU A OE1 1 +ATOM 1484 O OE2 A GLU A 1 182 ? 36.176 49.029 22.017 0.50 22.20 ? 181 GLU A OE2 1 +ATOM 1485 O OE2 B GLU A 1 182 ? 38.218 46.738 18.296 0.50 19.31 ? 181 GLU A OE2 1 +ATOM 1486 N N . GLY A 1 183 ? 34.041 45.955 21.806 1.00 12.58 ? 182 GLY A N 1 +ATOM 1487 C CA . GLY A 1 183 ? 33.080 45.959 22.870 1.00 12.21 ? 182 GLY A CA 1 +ATOM 1488 C C . GLY A 1 183 ? 32.481 44.632 23.239 1.00 11.80 ? 182 GLY A C 1 +ATOM 1489 O O . GLY A 1 183 ? 31.603 44.570 24.068 1.00 11.72 ? 182 GLY A O 1 +ATOM 1490 N N . SER A 1 184 ? 32.990 43.553 22.648 1.00 11.25 ? 183 SER A N 1 +ATOM 1491 C CA . SER A 1 184 ? 32.531 42.186 22.912 1.00 9.88 ? 183 SER A CA 1 +ATOM 1492 C C . SER A 1 184 ? 33.634 41.348 23.512 1.00 9.90 ? 183 SER A C 1 +ATOM 1493 O O . SER A 1 184 ? 34.788 41.457 23.117 1.00 10.85 ? 183 SER A O 1 +ATOM 1494 C CB . SER A 1 184 ? 32.091 41.528 21.623 1.00 10.29 ? 183 SER A CB 1 +ATOM 1495 O OG . SER A 1 184 ? 31.726 40.160 21.861 1.00 11.07 ? 183 SER A OG 1 +ATOM 1496 N N . GLY A 1 185 ? 33.297 40.502 24.470 1.00 11.22 ? 184 GLY A N 1 +ATOM 1497 C CA . GLY A 1 185 ? 34.165 39.366 24.873 1.00 10.74 ? 184 GLY A CA 1 +ATOM 1498 C C . GLY A 1 185 ? 33.967 38.159 23.966 1.00 12.54 ? 184 GLY A C 1 +ATOM 1499 O O . GLY A 1 185 ? 33.636 38.295 22.791 1.00 11.47 ? 184 GLY A O 1 +ATOM 1500 N N . HIS A 1 186 ? 34.130 36.972 24.523 1.00 10.80 ? 185 HIS A N 1 +ATOM 1501 C CA . HIS A 1 186 ? 34.236 35.763 23.756 1.00 11.86 ? 185 HIS A CA 1 +ATOM 1502 C C . HIS A 1 186 ? 32.971 35.433 22.892 1.00 11.98 ? 185 HIS A C 1 +ATOM 1503 O O . HIS A 1 186 ? 33.207 35.185 21.680 1.00 14.66 ? 185 HIS A O 1 +ATOM 1504 C CB . HIS A 1 186 ? 34.743 34.666 24.702 1.00 11.71 ? 185 HIS A CB 1 +ATOM 1505 C CG . HIS A 1 186 ? 35.017 33.341 24.075 1.00 12.19 ? 185 HIS A CG 1 +ATOM 1506 N ND1 . HIS A 1 186 ? 35.996 33.140 23.122 1.00 11.65 ? 185 HIS A ND1 1 +ATOM 1507 C CD2 . HIS A 1 186 ? 34.472 32.131 24.321 1.00 13.24 ? 185 HIS A CD2 1 +ATOM 1508 C CE1 . HIS A 1 186 ? 35.985 31.860 22.764 1.00 11.90 ? 185 HIS A CE1 1 +ATOM 1509 N NE2 . HIS A 1 186 ? 35.089 31.229 23.496 1.00 14.19 ? 185 HIS A NE2 1 +ATOM 1510 N N . PRO A 1 187 ? 31.702 35.414 23.412 1.00 15.21 ? 186 PRO A N 1 +ATOM 1511 C CA . PRO A 1 187 ? 30.423 35.120 22.653 1.00 15.41 ? 186 PRO A CA 1 +ATOM 1512 C C . PRO A 1 187 ? 29.806 36.331 21.888 1.00 12.32 ? 186 PRO A C 1 +ATOM 1513 O O . PRO A 1 187 ? 28.853 37.021 22.304 1.00 11.03 ? 186 PRO A O 1 +ATOM 1514 C CB . PRO A 1 187 ? 29.463 34.675 23.743 1.00 16.30 ? 186 PRO A CB 1 +ATOM 1515 C CG . PRO A 1 187 ? 29.909 35.297 24.881 1.00 17.44 ? 186 PRO A CG 1 +ATOM 1516 C CD . PRO A 1 187 ? 31.385 35.540 24.831 1.00 13.77 ? 186 PRO A CD 1 +ATOM 1517 N N . VAL A 1 188 ? 30.417 36.575 20.759 1.00 11.53 ? 187 VAL A N 1 +ATOM 1518 C CA . VAL A 1 188 ? 30.175 37.789 20.059 1.00 9.30 ? 187 VAL A CA 1 +ATOM 1519 C C . VAL A 1 188 ? 28.733 37.921 19.593 1.00 9.67 ? 187 VAL A C 1 +ATOM 1520 O O . VAL A 1 188 ? 28.157 39.021 19.556 1.00 8.80 ? 187 VAL A O 1 +ATOM 1521 C CB . VAL A 1 188 ? 31.157 37.930 18.830 1.00 11.23 ? 187 VAL A CB 1 +ATOM 1522 C CG1 . VAL A 1 188 ? 30.968 39.270 18.147 1.00 11.17 ? 187 VAL A CG1 1 +ATOM 1523 C CG2 . VAL A 1 188 ? 32.642 37.752 19.273 1.00 13.41 ? 187 VAL A CG2 1 +ATOM 1524 N N . TYR A 1 189 ? 28.176 36.780 19.188 1.00 8.38 ? 188 TYR A N 1 +ATOM 1525 C CA . TYR A 1 189 ? 26.803 36.656 18.694 1.00 9.35 ? 188 TYR A CA 1 +ATOM 1526 C C . TYR A 1 189 ? 25.753 36.868 19.805 1.00 8.51 ? 188 TYR A C 1 +ATOM 1527 O O . TYR A 1 189 ? 24.572 36.949 19.525 1.00 10.27 ? 188 TYR A O 1 +ATOM 1528 C CB . TYR A 1 189 ? 26.608 35.272 17.988 1.00 9.19 ? 188 TYR A CB 1 +ATOM 1529 C CG . TYR A 1 189 ? 27.133 34.180 18.863 1.00 9.63 ? 188 TYR A CG 1 +ATOM 1530 C CD1 . TYR A 1 189 ? 26.342 33.574 19.823 1.00 9.45 ? 188 TYR A CD1 1 +ATOM 1531 C CD2 . TYR A 1 189 ? 28.469 33.829 18.821 1.00 10.56 ? 188 TYR A CD2 1 +ATOM 1532 C CE1 . TYR A 1 189 ? 26.865 32.643 20.700 1.00 9.41 ? 188 TYR A CE1 1 +ATOM 1533 C CE2 . TYR A 1 189 ? 28.998 32.921 19.695 1.00 10.26 ? 188 TYR A CE2 1 +ATOM 1534 C CZ . TYR A 1 189 ? 28.214 32.314 20.640 1.00 10.58 ? 188 TYR A CZ 1 +ATOM 1535 O OH . TYR A 1 189 ? 28.668 31.424 21.594 1.00 13.13 ? 188 TYR A OH 1 +ATOM 1536 N N . ILE A 1 190 ? 26.197 36.957 21.058 1.00 9.57 ? 189 ILE A N 1 +ATOM 1537 C CA . ILE A 1 190 ? 25.327 37.317 22.186 1.00 9.01 ? 189 ILE A CA 1 +ATOM 1538 C C . ILE A 1 190 ? 25.568 38.760 22.610 1.00 9.47 ? 189 ILE A C 1 +ATOM 1539 O O . ILE A 1 190 ? 24.629 39.515 22.872 1.00 10.72 ? 189 ILE A O 1 +ATOM 1540 C CB . ILE A 1 190 ? 25.538 36.380 23.379 1.00 9.43 ? 189 ILE A CB 1 +ATOM 1541 C CG1 . ILE A 1 190 ? 24.960 34.988 23.033 1.00 12.27 ? 189 ILE A CG1 1 +ATOM 1542 C CG2 . ILE A 1 190 ? 24.826 36.900 24.631 1.00 10.68 ? 189 ILE A CG2 1 +ATOM 1543 C CD1 . ILE A 1 190 ? 25.291 33.870 24.064 1.00 13.19 ? 189 ILE A CD1 1 +ATOM 1544 N N . GLU A 1 191 ? 26.832 39.182 22.695 1.00 8.62 ? 190 GLU A N 1 +ATOM 1545 C CA . GLU A 1 191 ? 27.115 40.479 23.261 1.00 9.43 ? 190 GLU A CA 1 +ATOM 1546 C C . GLU A 1 191 ? 27.023 41.621 22.255 1.00 9.86 ? 190 GLU A C 1 +ATOM 1547 O O . GLU A 1 191 ? 26.705 42.732 22.632 1.00 10.97 ? 190 GLU A O 1 +ATOM 1548 C CB . GLU A 1 191 ? 28.520 40.490 23.870 1.00 9.09 ? 190 GLU A CB 1 +ATOM 1549 C CG . GLU A 1 191 ? 28.664 39.531 25.019 1.00 10.60 ? 190 GLU A CG 1 +ATOM 1550 C CD . GLU A 1 191 ? 30.040 39.509 25.664 1.00 10.94 ? 190 GLU A CD 1 +ATOM 1551 O OE1 . GLU A 1 191 ? 30.737 40.552 25.616 1.00 10.73 ? 190 GLU A OE1 1 +ATOM 1552 O OE2 . GLU A 1 191 ? 30.379 38.471 26.286 1.00 11.56 ? 190 GLU A OE2 1 +ATOM 1553 N N . LYS A 1 192 ? 27.329 41.378 20.982 1.00 8.69 ? 191 LYS A N 1 +ATOM 1554 C CA . LYS A 1 192 ? 27.233 42.378 19.900 1.00 9.92 ? 191 LYS A CA 1 +ATOM 1555 C C . LYS A 1 192 ? 26.489 41.743 18.717 1.00 9.34 ? 191 LYS A C 1 +ATOM 1556 O O . LYS A 1 192 ? 27.030 41.582 17.621 1.00 10.67 ? 191 LYS A O 1 +ATOM 1557 C CB . LYS A 1 192 ? 28.618 42.906 19.494 1.00 10.12 ? 191 LYS A CB 1 +ATOM 1558 C CG . LYS A 1 192 ? 29.232 43.832 20.529 1.00 11.74 ? 191 LYS A CG 1 +ATOM 1559 C CD . LYS A 1 192 ? 28.543 45.197 20.511 1.00 14.52 ? 191 LYS A CD 1 +ATOM 1560 C CE . LYS A 1 192 ? 29.040 46.105 21.590 1.00 14.88 ? 191 LYS A CE 1 +ATOM 1561 N NZ . LYS A 1 192 ? 28.075 47.290 21.773 1.00 14.19 ? 191 LYS A NZ 1 +ATOM 1562 N N . PRO A 1 193 ? 25.224 41.364 18.933 1.00 9.28 ? 192 PRO A N 1 +ATOM 1563 C CA . PRO A 1 193 ? 24.535 40.621 17.917 1.00 9.53 ? 192 PRO A CA 1 +ATOM 1564 C C . PRO A 1 193 ? 24.337 41.346 16.600 1.00 11.17 ? 192 PRO A C 1 +ATOM 1565 O O . PRO A 1 193 ? 24.410 40.726 15.528 1.00 10.99 ? 192 PRO A O 1 +ATOM 1566 C CB . PRO A 1 193 ? 23.186 40.293 18.575 1.00 11.54 ? 192 PRO A CB 1 +ATOM 1567 C CG . PRO A 1 193 ? 23.029 41.258 19.661 1.00 10.81 ? 192 PRO A CG 1 +ATOM 1568 C CD . PRO A 1 193 ? 24.400 41.560 20.141 1.00 9.01 ? 192 PRO A CD 1 +ATOM 1569 N N A GLU A 1 194 ? 24.078 42.650 16.647 0.50 11.11 ? 193 GLU A N 1 +ATOM 1570 N N B GLU A 1 194 ? 24.091 42.651 16.629 0.50 11.32 ? 193 GLU A N 1 +ATOM 1571 C CA A GLU A 1 194 ? 23.852 43.406 15.413 0.50 11.68 ? 193 GLU A CA 1 +ATOM 1572 C CA B GLU A 1 194 ? 23.840 43.361 15.373 0.50 12.26 ? 193 GLU A CA 1 +ATOM 1573 C C A GLU A 1 194 ? 25.090 43.408 14.535 0.50 10.90 ? 193 GLU A C 1 +ATOM 1574 C C B GLU A 1 194 ? 25.091 43.447 14.510 0.50 11.41 ? 193 GLU A C 1 +ATOM 1575 O O A GLU A 1 194 ? 25.018 43.128 13.337 0.50 10.33 ? 193 GLU A O 1 +ATOM 1576 O O B GLU A 1 194 ? 25.029 43.284 13.286 0.50 11.26 ? 193 GLU A O 1 +ATOM 1577 C CB A GLU A 1 194 ? 23.365 44.830 15.724 0.50 13.60 ? 193 GLU A CB 1 +ATOM 1578 C CB B GLU A 1 194 ? 23.225 44.739 15.635 0.50 13.83 ? 193 GLU A CB 1 +ATOM 1579 C CG A GLU A 1 194 ? 21.920 44.894 16.214 0.50 14.35 ? 193 GLU A CG 1 +ATOM 1580 C CG B GLU A 1 194 ? 22.696 45.407 14.378 0.50 18.03 ? 193 GLU A CG 1 +ATOM 1581 N N . GLU A 1 195 ? 26.236 43.686 15.132 1.00 11.78 ? 194 GLU A N 1 +ATOM 1582 C CA . GLU A 1 195 ? 27.489 43.718 14.400 1.00 12.52 ? 194 GLU A CA 1 +ATOM 1583 C C . GLU A 1 195 ? 27.888 42.314 13.935 1.00 11.72 ? 194 GLU A C 1 +ATOM 1584 O O . GLU A 1 195 ? 28.327 42.138 12.819 1.00 10.90 ? 194 GLU A O 1 +ATOM 1585 C CB . GLU A 1 195 ? 28.589 44.378 15.226 1.00 14.62 ? 194 GLU A CB 1 +ATOM 1586 C CG . GLU A 1 195 ? 29.870 44.666 14.492 1.00 19.09 ? 194 GLU A CG 1 +ATOM 1587 C CD . GLU A 1 195 ? 29.749 45.628 13.293 1.00 16.73 ? 194 GLU A CD 1 +ATOM 1588 O OE1 . GLU A 1 195 ? 28.661 46.193 12.978 1.00 22.11 ? 194 GLU A OE1 1 +ATOM 1589 O OE2 . GLU A 1 195 ? 30.804 45.773 12.648 1.00 24.98 ? 194 GLU A OE2 1 +ATOM 1590 N N . PHE A 1 196 ? 27.637 41.307 14.759 1.00 10.71 ? 195 PHE A N 1 +ATOM 1591 C CA . PHE A 1 196 ? 27.824 39.935 14.346 1.00 9.90 ? 195 PHE A CA 1 +ATOM 1592 C C . PHE A 1 196 ? 27.048 39.615 13.072 1.00 9.51 ? 195 PHE A C 1 +ATOM 1593 O O . PHE A 1 196 ? 27.605 38.974 12.149 1.00 10.79 ? 195 PHE A O 1 +ATOM 1594 C CB . PHE A 1 196 ? 27.469 38.968 15.477 1.00 10.74 ? 195 PHE A CB 1 +ATOM 1595 C CG . PHE A 1 196 ? 27.837 37.550 15.160 1.00 9.85 ? 195 PHE A CG 1 +ATOM 1596 C CD1 . PHE A 1 196 ? 29.097 37.087 15.425 1.00 10.96 ? 195 PHE A CD1 1 +ATOM 1597 C CD2 . PHE A 1 196 ? 26.933 36.703 14.547 1.00 9.21 ? 195 PHE A CD2 1 +ATOM 1598 C CE1 . PHE A 1 196 ? 29.464 35.779 15.084 1.00 10.50 ? 195 PHE A CE1 1 +ATOM 1599 C CE2 . PHE A 1 196 ? 27.277 35.376 14.226 1.00 9.67 ? 195 PHE A CE2 1 +ATOM 1600 C CZ . PHE A 1 196 ? 28.558 34.937 14.477 1.00 10.52 ? 195 PHE A CZ 1 +ATOM 1601 N N . VAL A 1 197 ? 25.769 39.993 13.018 1.00 9.87 ? 196 VAL A N 1 +ATOM 1602 C CA . VAL A 1 197 ? 24.958 39.785 11.853 1.00 10.08 ? 196 VAL A CA 1 +ATOM 1603 C C . VAL A 1 197 ? 25.487 40.574 10.669 1.00 10.56 ? 196 VAL A C 1 +ATOM 1604 O O . VAL A 1 197 ? 25.592 40.027 9.555 1.00 11.20 ? 196 VAL A O 1 +ATOM 1605 C CB . VAL A 1 197 ? 23.511 40.121 12.133 1.00 11.32 ? 196 VAL A CB 1 +ATOM 1606 C CG1 . VAL A 1 197 ? 22.691 40.235 10.860 1.00 12.12 ? 196 VAL A CG1 1 +ATOM 1607 C CG2 . VAL A 1 197 ? 22.924 39.052 13.067 1.00 12.61 ? 196 VAL A CG2 1 +ATOM 1608 N N . ARG A 1 198 ? 25.858 41.827 10.866 1.00 9.92 ? 197 ARG A N 1 +ATOM 1609 C CA . ARG A 1 198 ? 26.296 42.645 9.720 1.00 12.49 ? 197 ARG A CA 1 +ATOM 1610 C C . ARG A 1 198 ? 27.507 42.005 9.059 1.00 11.31 ? 197 ARG A C 1 +ATOM 1611 O O . ARG A 1 198 ? 27.580 41.876 7.832 1.00 11.96 ? 197 ARG A O 1 +ATOM 1612 C CB . ARG A 1 198 ? 26.641 44.049 10.200 1.00 12.71 ? 197 ARG A CB 1 +ATOM 1613 C CG . ARG A 1 198 ? 26.893 45.029 9.057 1.00 16.67 ? 197 ARG A CG 1 +ATOM 1614 C CD . ARG A 1 198 ? 27.294 46.417 9.532 1.00 17.23 ? 197 ARG A CD 1 +ATOM 1615 N NE . ARG A 1 198 ? 28.626 46.437 10.137 1.00 20.46 ? 197 ARG A NE 1 +ATOM 1616 C CZ . ARG A 1 198 ? 29.776 46.323 9.470 1.00 30.19 ? 197 ARG A CZ 1 +ATOM 1617 N NH1 . ARG A 1 198 ? 29.795 46.197 8.148 1.00 35.91 ? 197 ARG A NH1 1 +ATOM 1618 N NH2 . ARG A 1 198 ? 30.926 46.347 10.129 1.00 30.22 ? 197 ARG A NH2 1 +ATOM 1619 N N . ILE A 1 199 ? 28.471 41.587 9.872 1.00 11.30 ? 198 ILE A N 1 +ATOM 1620 C CA . ILE A 1 199 ? 29.725 41.034 9.374 1.00 11.68 ? 198 ILE A CA 1 +ATOM 1621 C C . ILE A 1 199 ? 29.493 39.653 8.737 1.00 10.72 ? 198 ILE A C 1 +ATOM 1622 O O . ILE A 1 199 ? 30.012 39.350 7.644 1.00 12.27 ? 198 ILE A O 1 +ATOM 1623 C CB . ILE A 1 199 ? 30.782 40.930 10.494 1.00 14.20 ? 198 ILE A CB 1 +ATOM 1624 C CG1 . ILE A 1 199 ? 31.239 42.321 10.933 1.00 15.01 ? 198 ILE A CG1 1 +ATOM 1625 C CG2 . ILE A 1 199 ? 31.981 40.033 10.064 1.00 19.52 ? 198 ILE A CG2 1 +ATOM 1626 C CD1 . ILE A 1 199 ? 31.831 42.250 12.346 1.00 20.96 ? 198 ILE A CD1 1 +ATOM 1627 N N . THR A 1 200 ? 28.728 38.764 9.396 1.00 10.91 ? 199 THR A N 1 +ATOM 1628 C CA . THR A 1 200 ? 28.539 37.426 8.870 1.00 8.87 ? 199 THR A CA 1 +ATOM 1629 C C . THR A 1 200 ? 27.664 37.419 7.622 1.00 9.57 ? 199 THR A C 1 +ATOM 1630 O O . THR A 1 200 ? 27.940 36.699 6.683 1.00 9.75 ? 199 THR A O 1 +ATOM 1631 C CB . THR A 1 200 ? 28.029 36.416 9.904 1.00 10.18 ? 199 THR A CB 1 +ATOM 1632 O OG1 . THR A 1 200 ? 26.768 36.868 10.450 1.00 11.23 ? 199 THR A OG1 1 +ATOM 1633 C CG2 . THR A 1 200 ? 29.114 36.138 11.000 1.00 12.84 ? 199 THR A CG2 1 +ATOM 1634 N N . VAL A 1 201 ? 26.633 38.253 7.573 1.00 9.62 ? 200 VAL A N 1 +ATOM 1635 C CA . VAL A 1 201 ? 25.828 38.384 6.375 1.00 8.32 ? 200 VAL A CA 1 +ATOM 1636 C C . VAL A 1 201 ? 26.675 38.907 5.205 1.00 8.84 ? 200 VAL A C 1 +ATOM 1637 O O . VAL A 1 201 ? 26.549 38.432 4.074 1.00 10.09 ? 200 VAL A O 1 +ATOM 1638 C CB . VAL A 1 201 ? 24.576 39.257 6.623 1.00 10.55 ? 200 VAL A CB 1 +ATOM 1639 C CG1 . VAL A 1 201 ? 23.904 39.692 5.300 1.00 12.59 ? 200 VAL A CG1 1 +ATOM 1640 C CG2 . VAL A 1 201 ? 23.579 38.505 7.512 1.00 11.11 ? 200 VAL A CG2 1 +ATOM 1641 N N . ASP A 1 202 ? 27.513 39.910 5.463 1.00 9.81 ? 201 ASP A N 1 +ATOM 1642 C CA . ASP A 1 202 ? 28.347 40.434 4.394 1.00 10.93 ? 201 ASP A CA 1 +ATOM 1643 C C . ASP A 1 202 ? 29.285 39.335 3.839 1.00 10.95 ? 201 ASP A C 1 +ATOM 1644 O O . ASP A 1 202 ? 29.440 39.180 2.617 1.00 11.36 ? 201 ASP A O 1 +ATOM 1645 C CB . ASP A 1 202 ? 29.154 41.594 4.908 1.00 11.43 ? 201 ASP A CB 1 +ATOM 1646 C CG . ASP A 1 202 ? 29.938 42.235 3.849 1.00 19.29 ? 201 ASP A CG 1 +ATOM 1647 O OD1 . ASP A 1 202 ? 29.347 42.957 2.996 1.00 18.64 ? 201 ASP A OD1 1 +ATOM 1648 O OD2 . ASP A 1 202 ? 31.127 41.964 3.837 1.00 19.54 ? 201 ASP A OD2 1 +ATOM 1649 N N . PHE A 1 203 ? 29.924 38.552 4.720 1.00 9.01 ? 202 PHE A N 1 +ATOM 1650 C CA . PHE A 1 203 ? 30.747 37.458 4.298 1.00 8.26 ? 202 PHE A CA 1 +ATOM 1651 C C . PHE A 1 203 ? 29.996 36.445 3.447 1.00 10.07 ? 202 PHE A C 1 +ATOM 1652 O O . PHE A 1 203 ? 30.442 36.013 2.400 1.00 10.39 ? 202 PHE A O 1 +ATOM 1653 C CB . PHE A 1 203 ? 31.356 36.773 5.537 1.00 9.95 ? 202 PHE A CB 1 +ATOM 1654 C CG . PHE A 1 203 ? 32.107 35.503 5.240 1.00 9.72 ? 202 PHE A CG 1 +ATOM 1655 C CD1 . PHE A 1 203 ? 33.388 35.523 4.717 1.00 9.46 ? 202 PHE A CD1 1 +ATOM 1656 C CD2 . PHE A 1 203 ? 31.568 34.264 5.520 1.00 9.72 ? 202 PHE A CD2 1 +ATOM 1657 C CE1 . PHE A 1 203 ? 34.032 34.358 4.452 1.00 10.85 ? 202 PHE A CE1 1 +ATOM 1658 C CE2 . PHE A 1 203 ? 32.242 33.110 5.264 1.00 12.27 ? 202 PHE A CE2 1 +ATOM 1659 C CZ . PHE A 1 203 ? 33.475 33.170 4.732 1.00 10.69 ? 202 PHE A CZ 1 +ATOM 1660 N N . LEU A 1 204 ? 28.818 36.032 3.925 1.00 8.64 ? 203 LEU A N 1 +ATOM 1661 C CA . LEU A 1 204 ? 28.050 35.015 3.221 1.00 10.58 ? 203 LEU A CA 1 +ATOM 1662 C C . LEU A 1 204 ? 27.550 35.526 1.883 1.00 9.88 ? 203 LEU A C 1 +ATOM 1663 O O . LEU A 1 204 ? 27.487 34.758 0.894 1.00 11.97 ? 203 LEU A O 1 +ATOM 1664 C CB . LEU A 1 204 ? 26.868 34.536 4.089 1.00 12.64 ? 203 LEU A CB 1 +ATOM 1665 C CG . LEU A 1 204 ? 27.249 33.785 5.325 1.00 13.79 ? 203 LEU A CG 1 +ATOM 1666 C CD1 . LEU A 1 204 ? 26.044 33.533 6.290 1.00 17.81 ? 203 LEU A CD1 1 +ATOM 1667 C CD2 . LEU A 1 204 ? 27.874 32.407 4.966 1.00 15.31 ? 203 LEU A CD2 1 +ATOM 1668 N N A ARG A 1 205 ? 27.166 36.792 1.807 0.50 8.42 ? 204 ARG A N 1 +ATOM 1669 N N B ARG A 1 205 ? 27.229 36.813 1.837 0.50 10.28 ? 204 ARG A N 1 +ATOM 1670 C CA A ARG A 1 205 ? 26.683 37.337 0.526 0.50 7.98 ? 204 ARG A CA 1 +ATOM 1671 C CA B ARG A 1 205 ? 26.809 37.471 0.594 0.50 10.02 ? 204 ARG A CA 1 +ATOM 1672 C C A ARG A 1 205 ? 27.766 37.163 -0.551 0.50 4.07 ? 204 ARG A C 1 +ATOM 1673 C C B ARG A 1 205 ? 27.925 37.632 -0.442 0.50 11.98 ? 204 ARG A C 1 +ATOM 1674 O O A ARG A 1 205 ? 27.488 36.897 -1.710 0.50 5.10 ? 204 ARG A O 1 +ATOM 1675 O O B ARG A 1 205 ? 27.645 37.737 -1.629 0.50 6.81 ? 204 ARG A O 1 +ATOM 1676 C CB A ARG A 1 205 ? 26.256 38.821 0.623 0.50 7.76 ? 204 ARG A CB 1 +ATOM 1677 C CB B ARG A 1 205 ? 26.223 38.833 0.872 0.50 11.88 ? 204 ARG A CB 1 +ATOM 1678 C CG A ARG A 1 205 ? 24.815 39.119 1.246 0.50 8.05 ? 204 ARG A CG 1 +ATOM 1679 C CG B ARG A 1 205 ? 24.881 38.804 1.592 0.50 10.33 ? 204 ARG A CG 1 +ATOM 1680 C CD A ARG A 1 205 ? 24.342 40.593 1.118 0.50 10.30 ? 204 ARG A CD 1 +ATOM 1681 C CD B ARG A 1 205 ? 24.370 40.224 1.750 0.50 7.54 ? 204 ARG A CD 1 +ATOM 1682 N NE A ARG A 1 205 ? 22.965 40.839 1.612 0.50 13.03 ? 204 ARG A NE 1 +ATOM 1683 N NE B ARG A 1 205 ? 24.165 40.829 0.430 0.50 13.07 ? 204 ARG A NE 1 +ATOM 1684 C CZ A ARG A 1 205 ? 21.828 40.671 0.910 0.50 13.38 ? 204 ARG A CZ 1 +ATOM 1685 C CZ B ARG A 1 205 ? 24.980 41.703 -0.147 0.50 12.14 ? 204 ARG A CZ 1 +ATOM 1686 N NH1 A ARG A 1 205 ? 21.804 40.221 -0.354 0.50 8.98 ? 204 ARG A NH1 1 +ATOM 1687 N NH1 B ARG A 1 205 ? 26.053 42.170 0.494 0.50 15.77 ? 204 ARG A NH1 1 +ATOM 1688 N NH2 A ARG A 1 205 ? 20.683 40.956 1.512 0.50 14.44 ? 204 ARG A NH2 1 +ATOM 1689 N NH2 B ARG A 1 205 ? 24.720 42.141 -1.383 0.50 11.72 ? 204 ARG A NH2 1 +ATOM 1690 N N A ASN A 1 206 ? 29.032 37.288 -0.113 0.50 8.58 ? 205 ASN A N 1 +ATOM 1691 N N B ASN A 1 206 ? 29.183 37.652 0.018 0.50 10.62 ? 205 ASN A N 1 +ATOM 1692 C CA A ASN A 1 206 ? 30.173 37.479 -1.042 0.50 7.38 ? 205 ASN A CA 1 +ATOM 1693 C CA B ASN A 1 206 ? 30.382 37.633 -0.876 0.50 11.10 ? 205 ASN A CA 1 +ATOM 1694 C C A ASN A 1 206 ? 30.988 36.238 -1.203 0.50 11.25 ? 205 ASN A C 1 +ATOM 1695 C C B ASN A 1 206 ? 30.948 36.232 -1.280 0.50 13.28 ? 205 ASN A C 1 +ATOM 1696 O O A ASN A 1 206 ? 32.095 36.267 -1.785 0.50 11.03 ? 205 ASN A O 1 +ATOM 1697 O O B ASN A 1 206 ? 31.865 36.148 -2.125 0.50 12.62 ? 205 ASN A O 1 +ATOM 1698 C CB A ASN A 1 206 ? 31.024 38.653 -0.562 0.50 6.09 ? 205 ASN A CB 1 +ATOM 1699 C CB B ASN A 1 206 ? 31.517 38.437 -0.201 0.50 11.02 ? 205 ASN A CB 1 +ATOM 1700 C CG A ASN A 1 206 ? 30.349 39.953 -0.818 0.50 6.86 ? 205 ASN A CG 1 +ATOM 1701 C CG B ASN A 1 206 ? 31.203 39.921 -0.039 0.50 13.95 ? 205 ASN A CG 1 +ATOM 1702 O OD1 A ASN A 1 206 ? 29.998 40.223 -1.944 0.50 11.42 ? 205 ASN A OD1 1 +ATOM 1703 O OD1 B ASN A 1 206 ? 30.359 40.479 -0.740 0.50 17.67 ? 205 ASN A OD1 1 +ATOM 1704 N ND2 A ASN A 1 206 ? 30.098 40.741 0.221 0.50 13.12 ? 205 ASN A ND2 1 +ATOM 1705 N ND2 B ASN A 1 206 ? 31.909 40.574 0.884 0.50 12.81 ? 205 ASN A ND2 1 +ATOM 1706 N N . LEU A 1 207 ? 30.422 35.135 -0.727 1.00 14.67 ? 206 LEU A N 1 +ATOM 1707 C CA . LEU A 1 207 ? 31.080 33.816 -0.803 1.00 16.35 ? 206 LEU A CA 1 +ATOM 1708 C C . LEU A 1 207 ? 31.041 33.280 -2.215 1.00 22.14 ? 206 LEU A C 1 +ATOM 1709 O O . LEU A 1 207 ? 29.993 33.186 -2.860 1.00 25.02 ? 206 LEU A O 1 +ATOM 1710 C CB . LEU A 1 207 ? 30.460 32.829 0.230 1.00 19.20 ? 206 LEU A CB 1 +ATOM 1711 C CG . LEU A 1 207 ? 31.263 31.579 0.604 1.00 18.47 ? 206 LEU A CG 1 +ATOM 1712 C CD1 . LEU A 1 207 ? 32.653 31.877 1.021 1.00 33.89 ? 206 LEU A CD1 1 +ATOM 1713 C CD2 . LEU A 1 207 ? 30.541 30.877 1.755 1.00 24.26 ? 206 LEU A CD2 1 +ATOM 1714 O OXT . LEU A 1 207 ? 32.086 32.943 -2.793 1.00 20.20 ? 206 LEU A OXT 1 +HETATM 1715 C C1 . PEG B 2 . ? 27.452 4.568 11.790 1.00 54.33 ? 207 PEG A C1 1 +HETATM 1716 O O1 . PEG B 2 . ? 28.738 4.623 11.154 1.00 58.08 ? 207 PEG A O1 1 +HETATM 1717 C C2 . PEG B 2 . ? 27.391 3.456 12.833 1.00 55.25 ? 207 PEG A C2 1 +HETATM 1718 O O2 . PEG B 2 . ? 27.632 3.996 14.139 1.00 55.75 ? 207 PEG A O2 1 +HETATM 1719 C C3 . PEG B 2 . ? 28.513 3.263 15.007 1.00 46.62 ? 207 PEG A C3 1 +HETATM 1720 C C4 . PEG B 2 . ? 29.917 3.088 14.429 1.00 45.78 ? 207 PEG A C4 1 +HETATM 1721 O O4 . PEG B 2 . ? 30.915 3.518 15.359 1.00 41.48 ? 207 PEG A O4 1 +HETATM 1722 C C1 . PEG C 2 . ? 26.098 19.188 30.003 1.00 43.61 ? 208 PEG A C1 1 +HETATM 1723 O O1 . PEG C 2 . ? 24.736 19.225 30.468 1.00 47.54 ? 208 PEG A O1 1 +HETATM 1724 C C2 . PEG C 2 . ? 26.448 20.525 29.365 1.00 42.08 ? 208 PEG A C2 1 +HETATM 1725 O O2 . PEG C 2 . ? 27.745 20.993 29.763 1.00 41.28 ? 208 PEG A O2 1 +HETATM 1726 C C3 . PEG C 2 . ? 27.886 22.393 29.519 1.00 40.92 ? 208 PEG A C3 1 +HETATM 1727 C C4 . PEG C 2 . ? 27.454 23.191 30.738 1.00 39.39 ? 208 PEG A C4 1 +HETATM 1728 O O4 . PEG C 2 . ? 26.659 24.310 30.334 1.00 48.83 ? 208 PEG A O4 1 +HETATM 1729 C C1 . PEG D 2 . ? 25.154 49.177 20.196 1.00 38.81 ? 209 PEG A C1 1 +HETATM 1730 O O1 . PEG D 2 . ? 23.912 49.219 19.490 1.00 46.03 ? 209 PEG A O1 1 +HETATM 1731 C C2 . PEG D 2 . ? 24.891 48.904 21.673 1.00 34.77 ? 209 PEG A C2 1 +HETATM 1732 O O2 . PEG D 2 . ? 25.137 47.519 21.942 1.00 32.40 ? 209 PEG A O2 1 +HETATM 1733 C C3 . PEG D 2 . ? 24.638 47.104 23.224 1.00 34.50 ? 209 PEG A C3 1 +HETATM 1734 C C4 . PEG D 2 . ? 24.903 45.612 23.331 1.00 30.69 ? 209 PEG A C4 1 +HETATM 1735 O O4 . PEG D 2 . ? 26.293 45.418 23.055 1.00 17.53 ? 209 PEG A O4 1 +HETATM 1736 O O . HOH E 3 . ? 24.007 24.936 17.246 1.00 8.50 ? 210 HOH A O 1 +HETATM 1737 O O . HOH E 3 . ? 24.701 29.282 20.537 1.00 8.80 ? 211 HOH A O 1 +HETATM 1738 O O . HOH E 3 . ? 17.555 13.921 22.747 1.00 9.02 ? 212 HOH A O 1 +HETATM 1739 O O . HOH E 3 . ? 27.509 29.120 21.108 1.00 9.28 ? 213 HOH A O 1 +HETATM 1740 O O . HOH E 3 . ? 28.883 22.420 19.072 1.00 9.69 ? 214 HOH A O 1 +HETATM 1741 O O . HOH E 3 . ? 26.405 22.140 17.748 1.00 9.83 ? 215 HOH A O 1 +HETATM 1742 O O . HOH E 3 . ? 33.550 26.486 24.177 1.00 9.99 ? 216 HOH A O 1 +HETATM 1743 O O . HOH E 3 . ? 21.582 33.785 23.891 1.00 10.32 ? 217 HOH A O 1 +HETATM 1744 O O . HOH E 3 . ? 18.614 23.564 23.776 1.00 10.53 ? 218 HOH A O 1 +HETATM 1745 O O . HOH E 3 . ? 22.893 34.714 18.829 1.00 11.03 ? 219 HOH A O 1 +HETATM 1746 O O . HOH E 3 . ? 35.713 36.309 20.529 1.00 11.76 ? 220 HOH A O 1 +HETATM 1747 O O . HOH E 3 . ? 25.692 6.235 22.158 1.00 11.93 ? 221 HOH A O 1 +HETATM 1748 O O . HOH E 3 . ? 20.647 27.437 25.817 1.00 12.34 ? 222 HOH A O 1 +HETATM 1749 O O . HOH E 3 . ? 24.422 22.177 27.543 1.00 13.03 ? 223 HOH A O 1 +HETATM 1750 O O . HOH E 3 . ? 25.311 5.001 24.485 1.00 13.08 ? 224 HOH A O 1 +HETATM 1751 O O . HOH E 3 . ? 34.484 36.667 27.434 1.00 13.31 ? 225 HOH A O 1 +HETATM 1752 O O . HOH E 3 . ? 26.009 24.015 26.583 1.00 13.66 ? 226 HOH A O 1 +HETATM 1753 O O . HOH E 3 . ? 19.929 8.659 21.569 1.00 13.87 ? 227 HOH A O 1 +HETATM 1754 O O . HOH E 3 . ? 32.564 38.597 27.854 1.00 15.06 ? 228 HOH A O 1 +HETATM 1755 O O . HOH E 3 . ? 32.986 32.432 20.593 1.00 15.12 ? 229 HOH A O 1 +HETATM 1756 O O . HOH E 3 . ? 19.679 22.393 2.716 1.00 15.35 ? 230 HOH A O 1 +HETATM 1757 O O . HOH E 3 . ? 29.845 15.064 24.232 1.00 15.46 ? 231 HOH A O 1 +HETATM 1758 O O . HOH E 3 . ? 31.144 31.485 22.422 1.00 15.50 ? 232 HOH A O 1 +HETATM 1759 O O . HOH E 3 . ? 25.591 7.224 17.821 1.00 15.58 ? 233 HOH A O 1 +HETATM 1760 O O . HOH E 3 . ? 27.041 5.957 19.796 1.00 15.62 ? 234 HOH A O 1 +HETATM 1761 O O . HOH E 3 . ? 23.706 8.102 21.748 1.00 15.74 ? 235 HOH A O 1 +HETATM 1762 O O . HOH E 3 . ? 31.120 28.962 24.748 1.00 15.78 ? 236 HOH A O 1 +HETATM 1763 O O . HOH E 3 . ? 30.838 43.092 26.258 1.00 16.20 ? 237 HOH A O 1 +HETATM 1764 O O . HOH E 3 . ? 16.121 33.721 13.779 1.00 16.25 ? 238 HOH A O 1 +HETATM 1765 O O . HOH E 3 . ? 16.077 18.410 7.549 1.00 16.63 ? 239 HOH A O 1 +HETATM 1766 O O . HOH E 3 . ? 18.491 30.548 24.997 1.00 16.70 ? 240 HOH A O 1 +HETATM 1767 O O . HOH E 3 . ? 31.263 46.886 17.907 1.00 16.72 ? 241 HOH A O 1 +HETATM 1768 O O . HOH E 3 . ? 11.639 25.433 8.022 1.00 16.91 ? 242 HOH A O 1 +HETATM 1769 O O . HOH E 3 . ? 10.745 27.587 6.342 1.00 17.23 ? 243 HOH A O 1 +HETATM 1770 O O . HOH E 3 . ? 42.196 27.524 19.432 1.00 17.42 ? 244 HOH A O 1 +HETATM 1771 O O . HOH E 3 . ? 28.271 12.456 25.065 1.00 18.04 ? 245 HOH A O 1 +HETATM 1772 O O . HOH E 3 . ? 31.660 2.732 22.063 1.00 18.26 ? 246 HOH A O 1 +HETATM 1773 O O . HOH E 3 . ? 21.714 30.660 27.509 1.00 18.30 ? 247 HOH A O 1 +HETATM 1774 O O . HOH E 3 . ? 33.387 46.746 16.053 1.00 18.34 ? 248 HOH A O 1 +HETATM 1775 O O . HOH E 3 . ? 10.849 15.691 16.677 1.00 18.41 ? 249 HOH A O 1 +HETATM 1776 O O . HOH E 3 . ? 15.442 11.011 12.368 1.00 18.51 ? 250 HOH A O 1 +HETATM 1777 O O . HOH E 3 . ? 25.693 43.103 6.099 1.00 18.80 ? 251 HOH A O 1 +HETATM 1778 O O . HOH E 3 . ? 45.080 28.196 3.845 1.00 19.11 ? 252 HOH A O 1 +HETATM 1779 O O . HOH E 3 . ? 40.353 22.774 2.157 1.00 19.65 ? 253 HOH A O 1 +HETATM 1780 O O . HOH E 3 . ? 41.061 21.249 4.316 1.00 19.80 ? 254 HOH A O 1 +HETATM 1781 O O . HOH E 3 . ? 21.265 20.677 29.155 1.00 20.47 ? 255 HOH A O 1 +HETATM 1782 O O . HOH E 3 . ? 33.762 38.958 2.431 1.00 20.53 ? 256 HOH A O 1 +HETATM 1783 O O . HOH E 3 . ? 8.696 30.226 12.956 1.00 20.56 ? 257 HOH A O 1 +HETATM 1784 O O . HOH E 3 . ? 16.237 29.292 4.843 1.00 20.62 ? 258 HOH A O 1 +HETATM 1785 O O . HOH E 3 . ? 24.124 10.161 8.909 1.00 20.62 ? 259 HOH A O 1 +HETATM 1786 O O . HOH E 3 . ? 33.261 36.380 1.361 1.00 20.73 ? 260 HOH A O 1 +HETATM 1787 O O . HOH E 3 . ? 36.916 37.236 28.209 1.00 20.73 ? 261 HOH A O 1 +HETATM 1788 O O . HOH E 3 . ? 15.538 31.622 1.945 1.00 20.87 ? 262 HOH A O 1 +HETATM 1789 O O . HOH E 3 . ? 13.967 34.117 4.972 1.00 20.87 ? 263 HOH A O 1 +HETATM 1790 O O . HOH E 3 . ? 23.917 35.088 -0.169 1.00 21.01 ? 264 HOH A O 1 +HETATM 1791 O O . HOH E 3 . ? 17.795 35.914 -0.449 1.00 21.18 ? 265 HOH A O 1 +HETATM 1792 O O . HOH E 3 . ? 8.651 34.132 7.142 1.00 21.39 ? 266 HOH A O 1 +HETATM 1793 O O . HOH E 3 . ? 16.196 31.294 23.517 1.00 21.54 ? 267 HOH A O 1 +HETATM 1794 O O . HOH E 3 . ? 37.674 34.573 3.358 1.00 21.56 ? 268 HOH A O 1 +HETATM 1795 O O . HOH E 3 . ? 34.751 37.265 -1.307 1.00 21.96 ? 269 HOH A O 1 +HETATM 1796 O O . HOH E 3 . ? 35.906 12.190 23.080 1.00 22.26 ? 270 HOH A O 1 +HETATM 1797 O O . HOH E 3 . ? 34.850 28.681 0.064 1.00 22.57 ? 271 HOH A O 1 +HETATM 1798 O O . HOH E 3 . ? 10.163 11.196 22.358 1.00 22.96 ? 272 HOH A O 1 +HETATM 1799 O O . HOH E 3 . ? 26.127 44.979 17.905 1.00 23.18 ? 273 HOH A O 1 +HETATM 1800 O O . HOH E 3 . ? 39.907 31.895 3.074 1.00 23.32 ? 274 HOH A O 1 +HETATM 1801 O O . HOH E 3 . ? 18.129 29.299 -4.782 1.00 23.44 ? 275 HOH A O 1 +HETATM 1802 O O . HOH E 3 . ? 9.098 24.496 15.722 1.00 23.51 ? 276 HOH A O 1 +HETATM 1803 O O . HOH E 3 . ? 16.918 19.358 5.113 1.00 24.35 ? 277 HOH A O 1 +HETATM 1804 O O . HOH E 3 . ? 22.868 43.902 11.531 1.00 24.39 ? 278 HOH A O 1 +HETATM 1805 O O . HOH E 3 . ? 19.062 29.753 -2.358 1.00 24.54 ? 279 HOH A O 1 +HETATM 1806 O O . HOH E 3 . ? 27.211 15.493 28.728 1.00 24.58 ? 280 HOH A O 1 +HETATM 1807 O O . HOH E 3 . ? 25.689 30.084 29.576 1.00 24.68 ? 281 HOH A O 1 +HETATM 1808 O O . HOH E 3 . ? 17.683 31.424 -2.889 1.00 24.73 ? 282 HOH A O 1 +HETATM 1809 O O . HOH E 3 . ? 12.808 30.734 20.935 1.00 24.96 ? 283 HOH A O 1 +HETATM 1810 O O . HOH E 3 . ? 30.465 8.043 11.083 1.00 24.98 ? 284 HOH A O 1 +HETATM 1811 O O . HOH E 3 . ? 25.705 26.601 0.875 1.00 25.47 ? 285 HOH A O 1 +HETATM 1812 O O . HOH E 3 . ? 27.662 31.125 30.826 1.00 25.49 ? 286 HOH A O 1 +HETATM 1813 O O . HOH E 3 . ? 42.113 29.292 2.955 1.00 25.56 ? 287 HOH A O 1 +HETATM 1814 O O . HOH E 3 . ? 21.880 8.915 10.678 1.00 25.59 ? 288 HOH A O 1 +HETATM 1815 O O . HOH E 3 . ? 36.418 40.117 28.692 1.00 25.66 ? 289 HOH A O 1 +HETATM 1816 O O . HOH E 3 . ? 44.014 24.240 21.394 1.00 25.72 ? 290 HOH A O 1 +HETATM 1817 O O . HOH E 3 . ? 38.611 44.035 12.406 1.00 25.73 ? 291 HOH A O 1 +HETATM 1818 O O . HOH E 3 . ? 36.951 12.328 11.669 1.00 25.94 ? 292 HOH A O 1 +HETATM 1819 O O . HOH E 3 . ? 16.413 39.406 1.655 1.00 25.96 ? 293 HOH A O 1 +HETATM 1820 O O . HOH E 3 . ? 15.067 32.750 16.366 1.00 25.98 ? 294 HOH A O 1 +HETATM 1821 O O . HOH E 3 . ? 26.428 28.981 -0.311 1.00 25.99 ? 295 HOH A O 1 +HETATM 1822 O O . HOH E 3 . ? 28.038 14.484 4.761 1.00 26.21 ? 296 HOH A O 1 +HETATM 1823 O O . HOH E 3 . ? 12.894 35.126 7.352 1.00 26.23 ? 297 HOH A O 1 +HETATM 1824 O O . HOH E 3 . ? 11.763 28.207 20.522 1.00 26.44 ? 298 HOH A O 1 +HETATM 1825 O O . HOH E 3 . ? 42.995 27.993 22.167 1.00 26.60 ? 299 HOH A O 1 +HETATM 1826 O O . HOH E 3 . ? 37.639 46.415 15.800 1.00 26.67 ? 300 HOH A O 1 +HETATM 1827 O O . HOH E 3 . ? 33.834 40.762 28.741 1.00 26.93 ? 301 HOH A O 1 +HETATM 1828 O O . HOH E 3 . ? 44.003 36.770 6.613 1.00 26.97 ? 302 HOH A O 1 +HETATM 1829 O O . HOH E 3 . ? 40.932 40.203 7.191 1.00 26.99 ? 303 HOH A O 1 +HETATM 1830 O O . HOH E 3 . ? 33.049 45.105 14.004 1.00 27.14 ? 304 HOH A O 1 +HETATM 1831 O O . HOH E 3 . ? 29.886 7.707 26.340 1.00 27.22 ? 305 HOH A O 1 +HETATM 1832 O O . HOH E 3 . ? 31.043 49.526 19.483 1.00 27.79 ? 306 HOH A O 1 +HETATM 1833 O O . HOH E 3 . ? 28.894 11.006 28.307 1.00 27.89 ? 307 HOH A O 1 +HETATM 1834 O O . HOH E 3 . ? 19.988 39.278 6.522 1.00 28.02 ? 308 HOH A O 1 +HETATM 1835 O O . HOH E 3 . ? 27.386 44.572 -1.385 1.00 28.52 ? 309 HOH A O 1 +HETATM 1836 O O . HOH E 3 . ? 44.678 21.504 19.360 1.00 28.53 ? 310 HOH A O 1 +HETATM 1837 O O . HOH E 3 . ? 28.176 49.539 19.361 1.00 28.71 ? 311 HOH A O 1 +HETATM 1838 O O . HOH E 3 . ? 22.045 23.615 28.538 1.00 28.77 ? 312 HOH A O 1 +HETATM 1839 O O . HOH E 3 . ? 34.918 44.276 12.797 1.00 28.97 ? 313 HOH A O 1 +HETATM 1840 O O . HOH E 3 . ? 36.560 44.100 6.493 1.00 29.52 ? 314 HOH A O 1 +HETATM 1841 O O . HOH E 3 . ? 7.224 33.441 5.410 1.00 29.63 ? 315 HOH A O 1 +HETATM 1842 O O . HOH E 3 . ? 46.818 34.462 5.367 1.00 29.64 ? 316 HOH A O 1 +HETATM 1843 O O . HOH E 3 . ? 25.736 33.290 -0.587 1.00 29.72 ? 317 HOH A O 1 +HETATM 1844 O O . HOH E 3 . ? 32.245 6.681 14.082 1.00 29.91 ? 318 HOH A O 1 +HETATM 1845 O O . HOH E 3 . ? 23.310 28.129 28.136 1.00 29.93 ? 319 HOH A O 1 +HETATM 1846 O O . HOH E 3 . ? 8.338 32.272 11.005 1.00 29.99 ? 320 HOH A O 1 +HETATM 1847 O O . HOH E 3 . ? 36.108 15.359 1.665 1.00 30.04 ? 321 HOH A O 1 +HETATM 1848 O O . HOH E 3 . ? 27.343 13.005 28.048 1.00 30.10 ? 322 HOH A O 1 +HETATM 1849 O O . HOH E 3 . ? 36.046 36.629 2.461 1.00 30.16 ? 323 HOH A O 1 +HETATM 1850 O O . HOH E 3 . ? 28.137 41.733 -2.731 1.00 30.20 ? 324 HOH A O 1 +HETATM 1851 O O . HOH E 3 . ? 50.079 23.240 15.579 1.00 30.45 ? 325 HOH A O 1 +HETATM 1852 O O . HOH E 3 . ? 18.366 38.581 -0.099 1.00 30.54 ? 326 HOH A O 1 +HETATM 1853 O O . HOH E 3 . ? 24.075 44.593 19.029 1.00 30.84 ? 327 HOH A O 1 +HETATM 1854 O O . HOH E 3 . ? 9.625 19.858 12.215 1.00 30.85 ? 328 HOH A O 1 +HETATM 1855 O O . HOH E 3 . ? 37.989 35.898 0.257 1.00 31.05 ? 329 HOH A O 1 +HETATM 1856 O O . HOH E 3 . ? 12.726 10.940 19.162 1.00 31.16 ? 330 HOH A O 1 +HETATM 1857 O O . HOH E 3 . ? 11.285 19.113 7.655 1.00 31.31 ? 331 HOH A O 1 +HETATM 1858 O O . HOH E 3 . ? 11.995 33.654 5.977 1.00 31.66 ? 332 HOH A O 1 +HETATM 1859 O O . HOH E 3 . ? 27.587 16.637 3.630 1.00 31.66 ? 333 HOH A O 1 +HETATM 1860 O O . HOH E 3 . ? 26.180 42.931 3.433 1.00 31.73 ? 334 HOH A O 1 +HETATM 1861 O O . HOH E 3 . ? 31.165 32.528 27.481 1.00 31.76 ? 335 HOH A O 1 +HETATM 1862 O O . HOH E 3 . ? 10.325 34.337 10.171 1.00 31.89 ? 336 HOH A O 1 +HETATM 1863 O O . HOH E 3 . ? 25.925 46.750 13.174 1.00 32.02 ? 337 HOH A O 1 +HETATM 1864 O O . HOH E 3 . ? 17.415 10.635 10.608 1.00 32.04 ? 338 HOH A O 1 +HETATM 1865 O O . HOH E 3 . ? 38.401 46.448 23.522 1.00 32.34 ? 339 HOH A O 1 +HETATM 1866 O O . HOH E 3 . ? 26.100 8.507 8.381 1.00 32.46 ? 340 HOH A O 1 +HETATM 1867 O O . HOH E 3 . ? 49.532 28.345 19.974 1.00 32.73 ? 341 HOH A O 1 +HETATM 1868 O O . HOH E 3 . ? 17.780 11.200 8.327 1.00 32.79 ? 342 HOH A O 1 +HETATM 1869 O O . HOH E 3 . ? 41.567 26.369 23.366 1.00 33.11 ? 343 HOH A O 1 +HETATM 1870 O O . HOH E 3 . ? 28.004 34.811 -3.150 1.00 33.20 ? 344 HOH A O 1 +HETATM 1871 O O . HOH E 3 . ? 22.914 23.095 0.209 1.00 33.85 ? 345 HOH A O 1 +HETATM 1872 O O . HOH E 3 . ? 19.449 4.505 14.357 1.00 33.96 ? 346 HOH A O 1 +HETATM 1873 O O . HOH E 3 . ? 41.763 43.801 21.625 1.00 34.07 ? 347 HOH A O 1 +HETATM 1874 O O . HOH E 3 . ? 20.534 30.792 -4.243 1.00 34.24 ? 348 HOH A O 1 +HETATM 1875 O O . HOH E 3 . ? 29.847 15.507 26.950 1.00 34.47 ? 349 HOH A O 1 +HETATM 1876 O O . HOH E 3 . ? 21.794 26.502 28.097 1.00 34.63 ? 350 HOH A O 1 +HETATM 1877 O O . HOH E 3 . ? 36.195 47.346 23.624 1.00 34.63 ? 351 HOH A O 1 +HETATM 1878 O O . HOH E 3 . ? 42.404 29.458 24.971 1.00 34.89 ? 352 HOH A O 1 +HETATM 1879 O O . HOH E 3 . ? 13.933 32.133 14.120 1.00 35.12 ? 353 HOH A O 1 +HETATM 1880 O O . HOH E 3 . ? 37.738 13.553 3.003 1.00 36.30 ? 354 HOH A O 1 +HETATM 1881 O O . HOH E 3 . ? 16.804 40.639 13.559 1.00 36.61 ? 355 HOH A O 1 +HETATM 1882 O O . HOH E 3 . ? 32.922 9.078 23.121 1.00 36.69 ? 356 HOH A O 1 +HETATM 1883 O O . HOH E 3 . ? 39.491 46.017 14.045 1.00 36.83 ? 357 HOH A O 1 +HETATM 1884 O O . HOH E 3 . ? 31.584 44.773 6.301 1.00 36.86 ? 358 HOH A O 1 +HETATM 1885 O O . HOH E 3 . ? 30.050 31.657 29.614 1.00 36.87 ? 359 HOH A O 1 +HETATM 1886 O O . HOH E 3 . ? 33.768 4.152 22.262 1.00 36.88 ? 360 HOH A O 1 +HETATM 1887 O O . HOH E 3 . ? 9.917 25.321 -1.458 1.00 36.89 ? 361 HOH A O 1 +HETATM 1888 O O . HOH E 3 . ? 46.281 37.830 23.124 1.00 37.00 ? 362 HOH A O 1 +HETATM 1889 O O . HOH E 3 . ? 31.696 28.309 -1.804 1.00 37.05 ? 363 HOH A O 1 +HETATM 1890 O O . HOH E 3 . ? 20.283 43.375 12.617 1.00 37.08 ? 364 HOH A O 1 +HETATM 1891 O O . HOH E 3 . ? 42.993 39.350 7.364 1.00 37.13 ? 365 HOH A O 1 +HETATM 1892 O O . HOH E 3 . ? 21.920 4.483 20.449 1.00 38.14 ? 366 HOH A O 1 +HETATM 1893 O O . HOH E 3 . ? 39.571 43.755 27.904 1.00 38.15 ? 367 HOH A O 1 +HETATM 1894 O O . HOH E 3 . ? 28.346 47.062 17.365 1.00 38.70 ? 368 HOH A O 1 +HETATM 1895 O O . HOH E 3 . ? 16.838 38.989 19.381 1.00 38.80 ? 369 HOH A O 1 +HETATM 1896 O O . HOH E 3 . ? 43.036 38.155 24.343 1.00 38.91 ? 370 HOH A O 1 +HETATM 1897 O O . HOH E 3 . ? 19.369 9.564 10.242 1.00 39.10 ? 371 HOH A O 1 +HETATM 1898 O O . HOH E 3 . ? 33.325 8.032 16.332 1.00 39.12 ? 372 HOH A O 1 +HETATM 1899 O O . HOH E 3 . ? 23.251 19.855 -0.437 1.00 39.74 ? 373 HOH A O 1 +HETATM 1900 O O . HOH E 3 . ? 18.674 42.204 10.350 1.00 40.19 ? 374 HOH A O 1 +HETATM 1901 O O . HOH E 3 . ? 30.593 41.867 -4.126 1.00 40.26 ? 375 HOH A O 1 +HETATM 1902 O O . HOH E 3 . ? 35.519 48.602 15.205 1.00 40.74 ? 376 HOH A O 1 +HETATM 1903 O O . HOH E 3 . ? 33.455 45.200 8.630 1.00 40.78 ? 377 HOH A O 1 +HETATM 1904 O O . HOH E 3 . ? 27.561 45.665 5.625 1.00 40.91 ? 378 HOH A O 1 +HETATM 1905 O O . HOH E 3 . ? 23.370 43.021 7.269 1.00 40.97 ? 379 HOH A O 1 +HETATM 1906 O O . HOH E 3 . ? 35.632 29.631 -2.604 1.00 41.29 ? 380 HOH A O 1 +HETATM 1907 O O . HOH E 3 . ? 50.081 21.526 13.445 1.00 41.44 ? 381 HOH A O 1 +HETATM 1908 O O . HOH E 3 . ? 23.455 4.031 11.816 1.00 42.09 ? 382 HOH A O 1 +HETATM 1909 O O . HOH E 3 . ? 14.673 39.206 10.205 1.00 42.11 ? 383 HOH A O 1 +HETATM 1910 O O . HOH E 3 . ? 21.896 9.234 8.103 1.00 42.25 ? 384 HOH A O 1 +HETATM 1911 O O . HOH E 3 . ? 13.956 19.393 5.926 1.00 42.39 ? 385 HOH A O 1 +HETATM 1912 O O . HOH E 3 . ? 14.428 29.756 -2.202 1.00 42.48 ? 386 HOH A O 1 +HETATM 1913 O O . HOH E 3 . ? 33.340 30.384 -2.760 1.00 43.21 ? 387 HOH A O 1 +HETATM 1914 O O . HOH E 3 . ? 35.651 23.954 28.302 1.00 43.43 ? 388 HOH A O 1 +HETATM 1915 O O . HOH E 3 . ? 45.178 21.887 21.487 1.00 43.46 ? 389 HOH A O 1 +HETATM 1916 O O . HOH E 3 . ? 19.662 20.250 0.874 1.00 43.57 ? 390 HOH A O 1 +HETATM 1917 O O . HOH E 3 . ? 49.761 36.778 17.098 1.00 43.92 ? 391 HOH A O 1 +HETATM 1918 O O . HOH E 3 . ? 47.448 38.198 10.813 1.00 44.04 ? 392 HOH A O 1 +HETATM 1919 O O . HOH E 3 . ? 51.222 20.252 6.891 1.00 44.17 ? 393 HOH A O 1 +HETATM 1920 O O . HOH E 3 . ? 33.977 13.795 2.226 1.00 44.18 ? 394 HOH A O 1 +HETATM 1921 O O . HOH E 3 . ? 31.619 31.207 25.428 1.00 44.40 ? 395 HOH A O 1 +HETATM 1922 O O . HOH E 3 . ? 36.822 9.910 22.496 1.00 44.87 ? 396 HOH A O 1 +HETATM 1923 O O . HOH E 3 . ? 24.339 3.281 16.694 1.00 45.06 ? 397 HOH A O 1 +HETATM 1924 O O . HOH E 3 . ? 29.936 10.404 25.827 1.00 45.40 ? 398 HOH A O 1 +HETATM 1925 O O . HOH E 3 . ? 33.377 6.592 23.485 1.00 45.42 ? 399 HOH A O 1 +HETATM 1926 O O . HOH E 3 . ? 51.434 30.930 19.132 1.00 45.98 ? 400 HOH A O 1 +HETATM 1927 O O . HOH E 3 . ? 34.614 21.687 -1.114 1.00 46.09 ? 401 HOH A O 1 +HETATM 1928 O O . HOH E 3 . ? 28.936 28.550 -2.006 1.00 46.42 ? 402 HOH A O 1 +HETATM 1929 O O . HOH E 3 . ? 17.999 40.645 4.093 1.00 47.37 ? 403 HOH A O 1 +HETATM 1930 O O . HOH E 3 . ? 35.604 25.096 25.528 1.00 47.51 ? 404 HOH A O 1 +HETATM 1931 O O . HOH E 3 . ? 33.418 5.294 19.026 1.00 47.82 ? 405 HOH A O 1 +HETATM 1932 O O . HOH E 3 . ? 32.676 11.116 25.237 1.00 49.33 ? 406 HOH A O 1 +HETATM 1933 O O . HOH E 3 . ? 35.272 14.859 30.350 1.00 49.79 ? 407 HOH A O 1 +HETATM 1934 O O . HOH E 3 . ? 37.279 47.474 28.842 1.00 51.23 ? 408 HOH A O 1 +HETATM 1935 O O . HOH E 3 . ? 29.302 27.050 31.468 1.00 52.59 ? 409 HOH A O 1 +HETATM 1936 O O . HOH E 3 . ? 14.888 35.339 17.448 1.00 54.85 ? 410 HOH A O 1 +HETATM 1937 O O . HOH E 3 . ? 37.955 26.983 25.926 1.00 56.44 ? 411 HOH A O 1 +HETATM 1938 O O . HOH E 3 . ? 15.479 42.063 7.104 1.00 57.70 ? 412 HOH A O 1 +# diff --git a/tests/resources/3hn3.cif b/tests/resources/3hn3.cif new file mode 100644 index 0000000..d794505 --- /dev/null +++ b/tests/resources/3hn3.cif @@ -0,0 +1,32354 @@ +data_3HN3 +# +_entry.id 3HN3 +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.397 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 3HN3 pdb_00003hn3 10.2210/pdb3hn3/pdb +RCSB RCSB053336 ? ? +WWPDB D_1000053336 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2009-12-01 +2 'Structure model' 1 1 2011-07-13 +3 'Structure model' 1 2 2017-10-04 +4 'Structure model' 2 0 2020-07-29 +5 'Structure model' 2 1 2024-10-16 +# +loop_ +_pdbx_audit_revision_details.ordinal +_pdbx_audit_revision_details.revision_ordinal +_pdbx_audit_revision_details.data_content_type +_pdbx_audit_revision_details.provider +_pdbx_audit_revision_details.type +_pdbx_audit_revision_details.description +_pdbx_audit_revision_details.details +1 1 'Structure model' repository 'Initial release' ? ? +2 4 'Structure model' repository Remediation 'Carbohydrate remediation' ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Non-polymer description' +2 2 'Structure model' 'Version format compliance' +3 3 'Structure model' Advisory +4 3 'Structure model' 'Data collection' +5 3 'Structure model' 'Refinement description' +6 4 'Structure model' Advisory +7 4 'Structure model' 'Atomic model' +8 4 'Structure model' 'Data collection' +9 4 'Structure model' 'Derived calculations' +10 4 'Structure model' 'Non-polymer description' +11 4 'Structure model' 'Structure summary' +12 5 'Structure model' Advisory +13 5 'Structure model' 'Data collection' +14 5 'Structure model' 'Database references' +15 5 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 3 'Structure model' diffrn_detector +2 3 'Structure model' pdbx_unobs_or_zero_occ_atoms +3 3 'Structure model' software +4 4 'Structure model' atom_site +5 4 'Structure model' chem_comp +6 4 'Structure model' database_PDB_caveat +7 4 'Structure model' entity +8 4 'Structure model' pdbx_branch_scheme +9 4 'Structure model' pdbx_chem_comp_identifier +10 4 'Structure model' pdbx_entity_branch +11 4 'Structure model' pdbx_entity_branch_descriptor +12 4 'Structure model' pdbx_entity_branch_link +13 4 'Structure model' pdbx_entity_branch_list +14 4 'Structure model' pdbx_entity_nonpoly +15 4 'Structure model' pdbx_nonpoly_scheme +16 4 'Structure model' pdbx_struct_assembly_gen +17 4 'Structure model' pdbx_validate_chiral +18 4 'Structure model' struct_asym +19 4 'Structure model' struct_conn +20 4 'Structure model' struct_site +21 4 'Structure model' struct_site_gen +22 5 'Structure model' chem_comp +23 5 'Structure model' chem_comp_atom +24 5 'Structure model' chem_comp_bond +25 5 'Structure model' database_2 +26 5 'Structure model' pdbx_entry_details +27 5 'Structure model' pdbx_modification_feature +28 5 'Structure model' pdbx_unobs_or_zero_occ_atoms +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 3 'Structure model' '_diffrn_detector.detector' +2 4 'Structure model' '_atom_site.B_iso_or_equiv' +3 4 'Structure model' '_atom_site.Cartn_x' +4 4 'Structure model' '_atom_site.Cartn_y' +5 4 'Structure model' '_atom_site.Cartn_z' +6 4 'Structure model' '_atom_site.auth_asym_id' +7 4 'Structure model' '_atom_site.auth_atom_id' +8 4 'Structure model' '_atom_site.auth_comp_id' +9 4 'Structure model' '_atom_site.auth_seq_id' +10 4 'Structure model' '_atom_site.label_asym_id' +11 4 'Structure model' '_atom_site.label_atom_id' +12 4 'Structure model' '_atom_site.label_comp_id' +13 4 'Structure model' '_atom_site.label_entity_id' +14 4 'Structure model' '_atom_site.type_symbol' +15 4 'Structure model' '_chem_comp.formula' +16 4 'Structure model' '_chem_comp.formula_weight' +17 4 'Structure model' '_chem_comp.id' +18 4 'Structure model' '_chem_comp.mon_nstd_flag' +19 4 'Structure model' '_chem_comp.name' +20 4 'Structure model' '_chem_comp.type' +21 4 'Structure model' '_pdbx_struct_assembly_gen.asym_id_list' +22 4 'Structure model' '_struct_conn.pdbx_dist_value' +23 4 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +24 4 'Structure model' '_struct_conn.pdbx_role' +25 4 'Structure model' '_struct_conn.ptnr1_auth_asym_id' +26 4 'Structure model' '_struct_conn.ptnr1_auth_comp_id' +27 4 'Structure model' '_struct_conn.ptnr1_auth_seq_id' +28 4 'Structure model' '_struct_conn.ptnr1_label_asym_id' +29 4 'Structure model' '_struct_conn.ptnr1_label_atom_id' +30 4 'Structure model' '_struct_conn.ptnr1_label_comp_id' +31 4 'Structure model' '_struct_conn.ptnr1_label_seq_id' +32 4 'Structure model' '_struct_conn.ptnr2_auth_asym_id' +33 4 'Structure model' '_struct_conn.ptnr2_auth_comp_id' +34 4 'Structure model' '_struct_conn.ptnr2_auth_seq_id' +35 4 'Structure model' '_struct_conn.ptnr2_label_asym_id' +36 4 'Structure model' '_struct_conn.ptnr2_label_atom_id' +37 4 'Structure model' '_struct_conn.ptnr2_label_comp_id' +38 4 'Structure model' '_struct_conn.ptnr2_label_seq_id' +39 5 'Structure model' '_chem_comp.pdbx_synonyms' +40 5 'Structure model' '_database_2.pdbx_DOI' +41 5 'Structure model' '_database_2.pdbx_database_accession' +# +_database_PDB_caveat.id 1 +_database_PDB_caveat.text 'NAG A 650 HAS WRONG CHIRALITY AT ATOM C1' +# +_pdbx_database_status.entry_id 3HN3 +_pdbx_database_status.status_code REL +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site PDBJ +_pdbx_database_status.recvd_initial_deposition_date 2009-05-29 +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.SG_entry ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Klei, H.E.' 1 +'Ghosh, K.' 2 +'Anumula, R.' 3 +# +_citation.id primary +_citation.title 'Human beta-glucuronidasel at 1.7 A resolution' +_citation.journal_abbrev 'To be Published' +_citation.journal_volume ? +_citation.page_first ? +_citation.page_last ? +_citation.year ? +_citation.journal_id_ASTM ? +_citation.country ? +_citation.journal_id_ISSN ? +_citation.journal_id_CSD 0353 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed ? +_citation.pdbx_database_id_DOI ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Klei, H.E.' 1 ? +primary 'Ghosh, K.' 2 ? +primary 'Anumula, R.' 3 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man Beta-glucuronidase 70762.867 4 3.2.1.31 ? ? ? +2 branched man +;alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-6)-[alpha-L-gulopyranose-(1-2)-alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose +; +1721.527 1 ? ? ? ? +3 branched man +;alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-6)-[beta-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose +; +1721.527 1 ? ? ? ? +4 branched man +;alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose +; +1721.527 1 ? ? ? ? +5 branched man +;alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-3)]alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose +; +1721.527 1 ? ? ? ? +6 non-polymer man 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208 4 ? ? ? ? +7 non-polymer syn '(4R)-2-METHYLPENTANE-2,4-DIOL' 118.174 3 ? ? ? ? +8 non-polymer syn '(4S)-2-METHYL-2,4-PENTANEDIOL' 118.174 2 ? ? ? ? +9 non-polymer man beta-D-mannopyranose 180.156 1 ? ? ? ? +10 water nat water 18.015 2807 ? ? ? ? +# +_entity_name_com.entity_id 1 +_entity_name_com.name Beta-G1 +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer no +_entity_poly.pdbx_seq_one_letter_code +;LGLQGGMLYPQESPSRECKELDGLWSFRADFSDNRRRGFEEQWYRRPLWESGPTVDMPVPSSFNDISQDWRLRHFVGWVW +YEREVILPERWTQDLRTRVVLRIGSAHSYAIVWVNGVDTLEHEGGYLPFEADISNLVQVGPLPSRLRITIAINNTLTPTT +LPPGTIQYLTDTSKYPKGYFVQNTYFDFFNYAGLQRSVLLYTTPTTYIDDITVTTSVEQDSGLVNYQISVKGSNLFKLEV +RLLDAENKVVANGTGTQGQLKVPGVSLWWPYLMHERPAYLYSLEVQLTAQTSLGPVSDFYTLPVGIRTVAVTKSQFLING +KPFYFHGVNKHEDADIRGKGFDWPLLVKDFNLLRWLGANAFRTSHYPYAEEVMQMCDRYGIVVIDECPGVGLALPQFFNN +VSLHHHMQVMEEVVRRDKNHPAVVMWSVANEPASHLESAGYYLKMVIAHTKSLDPSRPVTFVSNSNYAADKGAPYVDVIC +LNSYYSWYHDYGHLELIQLQLATQFENWYKKYQKPIIQSEYGAETIAGFHQDPPLMFTEEYQKSLLEQYHLGLDQKRRKY +VVGELIWNFADFMTEQSPTRVLGNKKGIFTRQRQPKSAAFLLRERYWKIANET +; +_entity_poly.pdbx_seq_one_letter_code_can +;LGLQGGMLYPQESPSRECKELDGLWSFRADFSDNRRRGFEEQWYRRPLWESGPTVDMPVPSSFNDISQDWRLRHFVGWVW +YEREVILPERWTQDLRTRVVLRIGSAHSYAIVWVNGVDTLEHEGGYLPFEADISNLVQVGPLPSRLRITIAINNTLTPTT +LPPGTIQYLTDTSKYPKGYFVQNTYFDFFNYAGLQRSVLLYTTPTTYIDDITVTTSVEQDSGLVNYQISVKGSNLFKLEV +RLLDAENKVVANGTGTQGQLKVPGVSLWWPYLMHERPAYLYSLEVQLTAQTSLGPVSDFYTLPVGIRTVAVTKSQFLING +KPFYFHGVNKHEDADIRGKGFDWPLLVKDFNLLRWLGANAFRTSHYPYAEEVMQMCDRYGIVVIDECPGVGLALPQFFNN +VSLHHHMQVMEEVVRRDKNHPAVVMWSVANEPASHLESAGYYLKMVIAHTKSLDPSRPVTFVSNSNYAADKGAPYVDVIC +LNSYYSWYHDYGHLELIQLQLATQFENWYKKYQKPIIQSEYGAETIAGFHQDPPLMFTEEYQKSLLEQYHLGLDQKRRKY +VVGELIWNFADFMTEQSPTRVLGNKKGIFTRQRQPKSAAFLLRERYWKIANET +; +_entity_poly.pdbx_strand_id A,B,D,E +_entity_poly.pdbx_target_identifier ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +6 2-acetamido-2-deoxy-beta-D-glucopyranose NAG +7 '(4R)-2-METHYLPENTANE-2,4-DIOL' MRD +8 '(4S)-2-METHYL-2,4-PENTANEDIOL' MPD +9 beta-D-mannopyranose BMA +10 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 LEU n +1 2 GLY n +1 3 LEU n +1 4 GLN n +1 5 GLY n +1 6 GLY n +1 7 MET n +1 8 LEU n +1 9 TYR n +1 10 PRO n +1 11 GLN n +1 12 GLU n +1 13 SER n +1 14 PRO n +1 15 SER n +1 16 ARG n +1 17 GLU n +1 18 CYS n +1 19 LYS n +1 20 GLU n +1 21 LEU n +1 22 ASP n +1 23 GLY n +1 24 LEU n +1 25 TRP n +1 26 SER n +1 27 PHE n +1 28 ARG n +1 29 ALA n +1 30 ASP n +1 31 PHE n +1 32 SER n +1 33 ASP n +1 34 ASN n +1 35 ARG n +1 36 ARG n +1 37 ARG n +1 38 GLY n +1 39 PHE n +1 40 GLU n +1 41 GLU n +1 42 GLN n +1 43 TRP n +1 44 TYR n +1 45 ARG n +1 46 ARG n +1 47 PRO n +1 48 LEU n +1 49 TRP n +1 50 GLU n +1 51 SER n +1 52 GLY n +1 53 PRO n +1 54 THR n +1 55 VAL n +1 56 ASP n +1 57 MET n +1 58 PRO n +1 59 VAL n +1 60 PRO n +1 61 SER n +1 62 SER n +1 63 PHE n +1 64 ASN n +1 65 ASP n +1 66 ILE n +1 67 SER n +1 68 GLN n +1 69 ASP n +1 70 TRP n +1 71 ARG n +1 72 LEU n +1 73 ARG n +1 74 HIS n +1 75 PHE n +1 76 VAL n +1 77 GLY n +1 78 TRP n +1 79 VAL n +1 80 TRP n +1 81 TYR n +1 82 GLU n +1 83 ARG n +1 84 GLU n +1 85 VAL n +1 86 ILE n +1 87 LEU n +1 88 PRO n +1 89 GLU n +1 90 ARG n +1 91 TRP n +1 92 THR n +1 93 GLN n +1 94 ASP n +1 95 LEU n +1 96 ARG n +1 97 THR n +1 98 ARG n +1 99 VAL n +1 100 VAL n +1 101 LEU n +1 102 ARG n +1 103 ILE n +1 104 GLY n +1 105 SER n +1 106 ALA n +1 107 HIS n +1 108 SER n +1 109 TYR n +1 110 ALA n +1 111 ILE n +1 112 VAL n +1 113 TRP n +1 114 VAL n +1 115 ASN n +1 116 GLY n +1 117 VAL n +1 118 ASP n +1 119 THR n +1 120 LEU n +1 121 GLU n +1 122 HIS n +1 123 GLU n +1 124 GLY n +1 125 GLY n +1 126 TYR n +1 127 LEU n +1 128 PRO n +1 129 PHE n +1 130 GLU n +1 131 ALA n +1 132 ASP n +1 133 ILE n +1 134 SER n +1 135 ASN n +1 136 LEU n +1 137 VAL n +1 138 GLN n +1 139 VAL n +1 140 GLY n +1 141 PRO n +1 142 LEU n +1 143 PRO n +1 144 SER n +1 145 ARG n +1 146 LEU n +1 147 ARG n +1 148 ILE n +1 149 THR n +1 150 ILE n +1 151 ALA n +1 152 ILE n +1 153 ASN n +1 154 ASN n +1 155 THR n +1 156 LEU n +1 157 THR n +1 158 PRO n +1 159 THR n +1 160 THR n +1 161 LEU n +1 162 PRO n +1 163 PRO n +1 164 GLY n +1 165 THR n +1 166 ILE n +1 167 GLN n +1 168 TYR n +1 169 LEU n +1 170 THR n +1 171 ASP n +1 172 THR n +1 173 SER n +1 174 LYS n +1 175 TYR n +1 176 PRO n +1 177 LYS n +1 178 GLY n +1 179 TYR n +1 180 PHE n +1 181 VAL n +1 182 GLN n +1 183 ASN n +1 184 THR n +1 185 TYR n +1 186 PHE n +1 187 ASP n +1 188 PHE n +1 189 PHE n +1 190 ASN n +1 191 TYR n +1 192 ALA n +1 193 GLY n +1 194 LEU n +1 195 GLN n +1 196 ARG n +1 197 SER n +1 198 VAL n +1 199 LEU n +1 200 LEU n +1 201 TYR n +1 202 THR n +1 203 THR n +1 204 PRO n +1 205 THR n +1 206 THR n +1 207 TYR n +1 208 ILE n +1 209 ASP n +1 210 ASP n +1 211 ILE n +1 212 THR n +1 213 VAL n +1 214 THR n +1 215 THR n +1 216 SER n +1 217 VAL n +1 218 GLU n +1 219 GLN n +1 220 ASP n +1 221 SER n +1 222 GLY n +1 223 LEU n +1 224 VAL n +1 225 ASN n +1 226 TYR n +1 227 GLN n +1 228 ILE n +1 229 SER n +1 230 VAL n +1 231 LYS n +1 232 GLY n +1 233 SER n +1 234 ASN n +1 235 LEU n +1 236 PHE n +1 237 LYS n +1 238 LEU n +1 239 GLU n +1 240 VAL n +1 241 ARG n +1 242 LEU n +1 243 LEU n +1 244 ASP n +1 245 ALA n +1 246 GLU n +1 247 ASN n +1 248 LYS n +1 249 VAL n +1 250 VAL n +1 251 ALA n +1 252 ASN n +1 253 GLY n +1 254 THR n +1 255 GLY n +1 256 THR n +1 257 GLN n +1 258 GLY n +1 259 GLN n +1 260 LEU n +1 261 LYS n +1 262 VAL n +1 263 PRO n +1 264 GLY n +1 265 VAL n +1 266 SER n +1 267 LEU n +1 268 TRP n +1 269 TRP n +1 270 PRO n +1 271 TYR n +1 272 LEU n +1 273 MET n +1 274 HIS n +1 275 GLU n +1 276 ARG n +1 277 PRO n +1 278 ALA n +1 279 TYR n +1 280 LEU n +1 281 TYR n +1 282 SER n +1 283 LEU n +1 284 GLU n +1 285 VAL n +1 286 GLN n +1 287 LEU n +1 288 THR n +1 289 ALA n +1 290 GLN n +1 291 THR n +1 292 SER n +1 293 LEU n +1 294 GLY n +1 295 PRO n +1 296 VAL n +1 297 SER n +1 298 ASP n +1 299 PHE n +1 300 TYR n +1 301 THR n +1 302 LEU n +1 303 PRO n +1 304 VAL n +1 305 GLY n +1 306 ILE n +1 307 ARG n +1 308 THR n +1 309 VAL n +1 310 ALA n +1 311 VAL n +1 312 THR n +1 313 LYS n +1 314 SER n +1 315 GLN n +1 316 PHE n +1 317 LEU n +1 318 ILE n +1 319 ASN n +1 320 GLY n +1 321 LYS n +1 322 PRO n +1 323 PHE n +1 324 TYR n +1 325 PHE n +1 326 HIS n +1 327 GLY n +1 328 VAL n +1 329 ASN n +1 330 LYS n +1 331 HIS n +1 332 GLU n +1 333 ASP n +1 334 ALA n +1 335 ASP n +1 336 ILE n +1 337 ARG n +1 338 GLY n +1 339 LYS n +1 340 GLY n +1 341 PHE n +1 342 ASP n +1 343 TRP n +1 344 PRO n +1 345 LEU n +1 346 LEU n +1 347 VAL n +1 348 LYS n +1 349 ASP n +1 350 PHE n +1 351 ASN n +1 352 LEU n +1 353 LEU n +1 354 ARG n +1 355 TRP n +1 356 LEU n +1 357 GLY n +1 358 ALA n +1 359 ASN n +1 360 ALA n +1 361 PHE n +1 362 ARG n +1 363 THR n +1 364 SER n +1 365 HIS n +1 366 TYR n +1 367 PRO n +1 368 TYR n +1 369 ALA n +1 370 GLU n +1 371 GLU n +1 372 VAL n +1 373 MET n +1 374 GLN n +1 375 MET n +1 376 CYS n +1 377 ASP n +1 378 ARG n +1 379 TYR n +1 380 GLY n +1 381 ILE n +1 382 VAL n +1 383 VAL n +1 384 ILE n +1 385 ASP n +1 386 GLU n +1 387 CYS n +1 388 PRO n +1 389 GLY n +1 390 VAL n +1 391 GLY n +1 392 LEU n +1 393 ALA n +1 394 LEU n +1 395 PRO n +1 396 GLN n +1 397 PHE n +1 398 PHE n +1 399 ASN n +1 400 ASN n +1 401 VAL n +1 402 SER n +1 403 LEU n +1 404 HIS n +1 405 HIS n +1 406 HIS n +1 407 MET n +1 408 GLN n +1 409 VAL n +1 410 MET n +1 411 GLU n +1 412 GLU n +1 413 VAL n +1 414 VAL n +1 415 ARG n +1 416 ARG n +1 417 ASP n +1 418 LYS n +1 419 ASN n +1 420 HIS n +1 421 PRO n +1 422 ALA n +1 423 VAL n +1 424 VAL n +1 425 MET n +1 426 TRP n +1 427 SER n +1 428 VAL n +1 429 ALA n +1 430 ASN n +1 431 GLU n +1 432 PRO n +1 433 ALA n +1 434 SER n +1 435 HIS n +1 436 LEU n +1 437 GLU n +1 438 SER n +1 439 ALA n +1 440 GLY n +1 441 TYR n +1 442 TYR n +1 443 LEU n +1 444 LYS n +1 445 MET n +1 446 VAL n +1 447 ILE n +1 448 ALA n +1 449 HIS n +1 450 THR n +1 451 LYS n +1 452 SER n +1 453 LEU n +1 454 ASP n +1 455 PRO n +1 456 SER n +1 457 ARG n +1 458 PRO n +1 459 VAL n +1 460 THR n +1 461 PHE n +1 462 VAL n +1 463 SER n +1 464 ASN n +1 465 SER n +1 466 ASN n +1 467 TYR n +1 468 ALA n +1 469 ALA n +1 470 ASP n +1 471 LYS n +1 472 GLY n +1 473 ALA n +1 474 PRO n +1 475 TYR n +1 476 VAL n +1 477 ASP n +1 478 VAL n +1 479 ILE n +1 480 CYS n +1 481 LEU n +1 482 ASN n +1 483 SER n +1 484 TYR n +1 485 TYR n +1 486 SER n +1 487 TRP n +1 488 TYR n +1 489 HIS n +1 490 ASP n +1 491 TYR n +1 492 GLY n +1 493 HIS n +1 494 LEU n +1 495 GLU n +1 496 LEU n +1 497 ILE n +1 498 GLN n +1 499 LEU n +1 500 GLN n +1 501 LEU n +1 502 ALA n +1 503 THR n +1 504 GLN n +1 505 PHE n +1 506 GLU n +1 507 ASN n +1 508 TRP n +1 509 TYR n +1 510 LYS n +1 511 LYS n +1 512 TYR n +1 513 GLN n +1 514 LYS n +1 515 PRO n +1 516 ILE n +1 517 ILE n +1 518 GLN n +1 519 SER n +1 520 GLU n +1 521 TYR n +1 522 GLY n +1 523 ALA n +1 524 GLU n +1 525 THR n +1 526 ILE n +1 527 ALA n +1 528 GLY n +1 529 PHE n +1 530 HIS n +1 531 GLN n +1 532 ASP n +1 533 PRO n +1 534 PRO n +1 535 LEU n +1 536 MET n +1 537 PHE n +1 538 THR n +1 539 GLU n +1 540 GLU n +1 541 TYR n +1 542 GLN n +1 543 LYS n +1 544 SER n +1 545 LEU n +1 546 LEU n +1 547 GLU n +1 548 GLN n +1 549 TYR n +1 550 HIS n +1 551 LEU n +1 552 GLY n +1 553 LEU n +1 554 ASP n +1 555 GLN n +1 556 LYS n +1 557 ARG n +1 558 ARG n +1 559 LYS n +1 560 TYR n +1 561 VAL n +1 562 VAL n +1 563 GLY n +1 564 GLU n +1 565 LEU n +1 566 ILE n +1 567 TRP n +1 568 ASN n +1 569 PHE n +1 570 ALA n +1 571 ASP n +1 572 PHE n +1 573 MET n +1 574 THR n +1 575 GLU n +1 576 GLN n +1 577 SER n +1 578 PRO n +1 579 THR n +1 580 ARG n +1 581 VAL n +1 582 LEU n +1 583 GLY n +1 584 ASN n +1 585 LYS n +1 586 LYS n +1 587 GLY n +1 588 ILE n +1 589 PHE n +1 590 THR n +1 591 ARG n +1 592 GLN n +1 593 ARG n +1 594 GLN n +1 595 PRO n +1 596 LYS n +1 597 SER n +1 598 ALA n +1 599 ALA n +1 600 PHE n +1 601 LEU n +1 602 LEU n +1 603 ARG n +1 604 GLU n +1 605 ARG n +1 606 TYR n +1 607 TRP n +1 608 LYS n +1 609 ILE n +1 610 ALA n +1 611 ASN n +1 612 GLU n +1 613 THR n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name human +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene 'PLACENTAL GUS' +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Mus musculus' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 10090 +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain ? +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type Plasmid +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name PMSXND +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_pdbx_entity_branch.entity_id +_pdbx_entity_branch.type +2 oligosaccharide +3 oligosaccharide +4 oligosaccharide +5 oligosaccharide +# +loop_ +_pdbx_entity_branch_descriptor.ordinal +_pdbx_entity_branch_descriptor.entity_id +_pdbx_entity_branch_descriptor.descriptor +_pdbx_entity_branch_descriptor.type +_pdbx_entity_branch_descriptor.program +_pdbx_entity_branch_descriptor.program_version +1 2 'DManpa1-2DManpa1-3[DManpa1-2DManpa1-6]DManpa1-6[LGulpa1-2DManpa1-3]DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-' +'Glycam Condensed Sequence' GMML 1.0 +2 2 +;WURCS=2.0/4,10,9/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a1121h-1a_1-5]/1-1-2-3-4-3-3-3-3-3/a4-b1_b4-c1_c3-d1_c6-f1_d2-e1_f3-g1_f6-i1_g2-h1_i2-j1 +; +WURCS PDB2Glycan 1.1.0 +3 2 +;[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][a-L-Gulp]{}}[(6+1)][a-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}[(6+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}}}}}} +; +LINUCS PDB-CARE ? +4 3 'DManpa1-2DManpa1-3[DManpa1-2DManpa1-6]DManpa1-6[DManpb1-2DManpa1-3]DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-' +'Glycam Condensed Sequence' GMML 1.0 +5 3 +;WURCS=2.0/3,10,9/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-1-2-3-2-3-3-3-3-3/a4-b1_b4-c1_c3-d1_c6-f1_d2-e1_f3-g1_f6-i1_g2-h1_i2-j1 +; +WURCS PDB2Glycan 1.1.0 +6 3 +;[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][b-D-Manp]{}}[(6+1)][a-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}[(6+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}}}}}} +; +LINUCS PDB-CARE ? +7 4 'DManpa1-2DManpa1-3[DManpa1-2DManpa1-6]DManpa1-6[DManpa1-2DManpa1-3]DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-' +'Glycam Condensed Sequence' GMML 1.0 +8 4 +;WURCS=2.0/3,10,9/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-1-2-3-3-3-3-3-3-3/a4-b1_b4-c1_c3-d1_c6-f1_d2-e1_f3-g1_f6-i1_g2-h1_i2-j1 +; +WURCS PDB2Glycan 1.1.0 +9 4 +;[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}[(6+1)][a-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}[(6+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}}}}}} +; +LINUCS PDB-CARE ? +10 5 'DManpa1-2DManpa1-2DManpa1-3[DManpa1-2DManpa1-6[DManpa1-3]DManpa1-6]DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-' +'Glycam Condensed Sequence' GMML 1.0 +11 5 +;WURCS=2.0/3,10,9/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-1-2-3-3-3-3-3-3-3/a4-b1_b4-c1_c3-d1_c6-g1_d2-e1_e2-f1_g3-h1_g6-i1_i2-j1 +; +WURCS PDB2Glycan 1.1.0 +12 5 +;[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-Manp]{[(3+1)][a-D-Manp]{[(2+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}}[(6+1)][a-D-Manp]{[(3+1)][a-D-Manp]{}[(6+1)][a-D-Manp]{[(2+1)][a-D-Manp]{}}}}}}} +; +LINUCS PDB-CARE ? +# +loop_ +_pdbx_entity_branch_link.link_id +_pdbx_entity_branch_link.entity_id +_pdbx_entity_branch_link.entity_branch_list_num_1 +_pdbx_entity_branch_link.comp_id_1 +_pdbx_entity_branch_link.atom_id_1 +_pdbx_entity_branch_link.leaving_atom_id_1 +_pdbx_entity_branch_link.entity_branch_list_num_2 +_pdbx_entity_branch_link.comp_id_2 +_pdbx_entity_branch_link.atom_id_2 +_pdbx_entity_branch_link.leaving_atom_id_2 +_pdbx_entity_branch_link.value_order +_pdbx_entity_branch_link.details +1 2 2 NAG C1 O1 1 NAG O4 HO4 sing ? +2 2 3 BMA C1 O1 2 NAG O4 HO4 sing ? +3 2 4 MAN C1 O1 3 BMA O6 HO6 sing ? +4 2 5 MAN C1 O1 4 MAN O3 HO3 sing ? +5 2 6 MAN C1 O1 5 MAN O2 HO2 sing ? +6 2 7 MAN C1 O1 4 MAN O6 HO6 sing ? +7 2 8 MAN C1 O1 7 MAN O2 HO2 sing ? +8 2 9 MAN C1 O1 3 BMA O3 HO3 sing ? +9 2 10 GUP C1 O1 9 MAN O2 HO2 sing ? +10 3 2 NAG C1 O1 1 NAG O4 HO4 sing ? +11 3 3 BMA C1 O1 2 NAG O4 HO4 sing ? +12 3 4 MAN C1 O1 3 BMA O6 HO6 sing ? +13 3 5 MAN C1 O1 4 MAN O3 HO3 sing ? +14 3 6 MAN C1 O1 5 MAN O2 HO2 sing ? +15 3 7 MAN C1 O1 4 MAN O6 HO6 sing ? +16 3 8 MAN C1 O1 7 MAN O2 HO2 sing ? +17 3 9 MAN C1 O1 3 BMA O3 HO3 sing ? +18 3 10 BMA C1 O1 9 MAN O2 HO2 sing ? +19 4 2 NAG C1 O1 1 NAG O4 HO4 sing ? +20 4 3 BMA C1 O1 2 NAG O4 HO4 sing ? +21 4 4 MAN C1 O1 3 BMA O6 HO6 sing ? +22 4 5 MAN C1 O1 4 MAN O3 HO3 sing ? +23 4 6 MAN C1 O1 5 MAN O2 HO2 sing ? +24 4 7 MAN C1 O1 4 MAN O6 HO6 sing ? +25 4 8 MAN C1 O1 7 MAN O2 HO2 sing ? +26 4 9 MAN C1 O1 3 BMA O3 HO3 sing ? +27 4 10 MAN C1 O1 9 MAN O2 HO2 sing ? +28 5 2 NAG C1 O1 1 NAG O4 HO4 sing ? +29 5 3 BMA C1 O1 2 NAG O4 HO4 sing ? +30 5 4 MAN C1 O1 3 BMA O3 HO3 sing ? +31 5 5 MAN C1 O1 4 MAN O2 HO2 sing ? +32 5 6 MAN C1 O1 5 MAN O2 HO2 sing ? +33 5 7 MAN C1 O1 3 BMA O6 HO6 sing ? +34 5 8 MAN C1 O1 7 MAN O6 HO6 sing ? +35 5 9 MAN C1 O1 8 MAN O2 HO2 sing ? +36 5 10 MAN C1 O1 7 MAN O3 HO3 sing ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +BMA 'D-saccharide, beta linking' . beta-D-mannopyranose 'beta-D-mannose; D-mannose; mannose' 'C6 H12 O6' +180.156 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +GUP 'L-saccharide, alpha linking' . alpha-L-gulopyranose +'alpha-L-gulose; L-gulose; gulose; ALPHA-L-GULOPYRANOSIDE' 'C6 H12 O6' 180.156 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MAN 'D-saccharide, alpha linking' . alpha-D-mannopyranose 'alpha-D-mannose; D-mannose; mannose' 'C6 H12 O6' +180.156 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +MPD non-polymer . '(4S)-2-METHYL-2,4-PENTANEDIOL' ? 'C6 H14 O2' 118.174 +MRD non-polymer . '(4R)-2-METHYLPENTANE-2,4-DIOL' ? 'C6 H14 O2' 118.174 +NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose +;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE +; +'C8 H15 N O6' 221.208 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_chem_comp_identifier.comp_id +_pdbx_chem_comp_identifier.type +_pdbx_chem_comp_identifier.program +_pdbx_chem_comp_identifier.program_version +_pdbx_chem_comp_identifier.identifier +BMA 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DManpb +BMA 'COMMON NAME' GMML 1.0 b-D-mannopyranose +BMA 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 b-D-Manp +BMA 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 Man +GUP 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 LGulpa +GUP 'COMMON NAME' GMML 1.0 a-L-gulopyranose +GUP 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 a-L-Gulp +GUP 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 Gul +MAN 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DManpa +MAN 'COMMON NAME' GMML 1.0 a-D-mannopyranose +MAN 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 a-D-Manp +MAN 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 Man +NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DGlcpNAcb +NAG 'COMMON NAME' GMML 1.0 N-acetyl-b-D-glucopyranosamine +NAG 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 b-D-GlcpNAc +NAG 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 GlcNAc +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 LEU 1 21 ? ? ? A . n +A 1 2 GLY 2 22 22 GLY GLY A . n +A 1 3 LEU 3 23 23 LEU LEU A . n +A 1 4 GLN 4 24 24 GLN GLN A . n +A 1 5 GLY 5 25 25 GLY GLY A . n +A 1 6 GLY 6 26 26 GLY GLY A . n +A 1 7 MET 7 27 27 MET MET A . n +A 1 8 LEU 8 28 28 LEU LEU A . n +A 1 9 TYR 9 29 29 TYR TYR A . n +A 1 10 PRO 10 30 30 PRO PRO A . n +A 1 11 GLN 11 31 31 GLN GLN A . n +A 1 12 GLU 12 32 32 GLU GLU A . n +A 1 13 SER 13 33 33 SER SER A . n +A 1 14 PRO 14 34 34 PRO PRO A . n +A 1 15 SER 15 35 35 SER SER A . n +A 1 16 ARG 16 36 36 ARG ARG A . n +A 1 17 GLU 17 37 37 GLU GLU A . n +A 1 18 CYS 18 38 38 CYS CYS A . n +A 1 19 LYS 19 39 39 LYS LYS A . n +A 1 20 GLU 20 40 40 GLU GLU A . n +A 1 21 LEU 21 41 41 LEU LEU A . n +A 1 22 ASP 22 42 42 ASP ASP A . n +A 1 23 GLY 23 43 43 GLY GLY A . n +A 1 24 LEU 24 44 44 LEU LEU A . n +A 1 25 TRP 25 45 45 TRP TRP A . n +A 1 26 SER 26 46 46 SER SER A . n +A 1 27 PHE 27 47 47 PHE PHE A . n +A 1 28 ARG 28 48 48 ARG ARG A . n +A 1 29 ALA 29 49 49 ALA ALA A . n +A 1 30 ASP 30 50 50 ASP ASP A . n +A 1 31 PHE 31 51 51 PHE PHE A . n +A 1 32 SER 32 52 52 SER SER A . n +A 1 33 ASP 33 53 53 ASP ASP A . n +A 1 34 ASN 34 54 54 ASN ASN A . n +A 1 35 ARG 35 55 55 ARG ARG A . n +A 1 36 ARG 36 56 56 ARG ARG A . n +A 1 37 ARG 37 57 57 ARG ARG A . n +A 1 38 GLY 38 58 58 GLY GLY A . n +A 1 39 PHE 39 59 59 PHE PHE A . n +A 1 40 GLU 40 60 60 GLU GLU A . n +A 1 41 GLU 41 61 61 GLU GLU A . n +A 1 42 GLN 42 62 62 GLN GLN A . n +A 1 43 TRP 43 63 63 TRP TRP A . n +A 1 44 TYR 44 64 64 TYR TYR A . n +A 1 45 ARG 45 65 65 ARG ARG A . n +A 1 46 ARG 46 66 66 ARG ARG A . n +A 1 47 PRO 47 67 67 PRO PRO A . n +A 1 48 LEU 48 68 68 LEU LEU A . n +A 1 49 TRP 49 69 69 TRP TRP A . n +A 1 50 GLU 50 70 70 GLU GLU A . n +A 1 51 SER 51 71 71 SER SER A . n +A 1 52 GLY 52 72 72 GLY GLY A . n +A 1 53 PRO 53 73 73 PRO PRO A . n +A 1 54 THR 54 74 74 THR THR A . n +A 1 55 VAL 55 75 75 VAL VAL A . n +A 1 56 ASP 56 76 76 ASP ASP A . n +A 1 57 MET 57 77 77 MET MET A . n +A 1 58 PRO 58 78 78 PRO PRO A . n +A 1 59 VAL 59 79 79 VAL VAL A . n +A 1 60 PRO 60 80 80 PRO PRO A . n +A 1 61 SER 61 81 81 SER SER A . n +A 1 62 SER 62 82 82 SER SER A . n +A 1 63 PHE 63 83 83 PHE PHE A . n +A 1 64 ASN 64 84 84 ASN ASN A . n +A 1 65 ASP 65 85 85 ASP ASP A . n +A 1 66 ILE 66 86 86 ILE ILE A . n +A 1 67 SER 67 87 87 SER SER A . n +A 1 68 GLN 68 88 88 GLN GLN A . n +A 1 69 ASP 69 89 89 ASP ASP A . n +A 1 70 TRP 70 90 90 TRP TRP A . n +A 1 71 ARG 71 91 91 ARG ARG A . n +A 1 72 LEU 72 92 92 LEU LEU A . n +A 1 73 ARG 73 93 93 ARG ARG A . n +A 1 74 HIS 74 94 94 HIS HIS A . n +A 1 75 PHE 75 95 95 PHE PHE A . n +A 1 76 VAL 76 96 96 VAL VAL A . n +A 1 77 GLY 77 97 97 GLY GLY A . n +A 1 78 TRP 78 98 98 TRP TRP A . n +A 1 79 VAL 79 99 99 VAL VAL A . n +A 1 80 TRP 80 100 100 TRP TRP A . n +A 1 81 TYR 81 101 101 TYR TYR A . n +A 1 82 GLU 82 102 102 GLU GLU A . n +A 1 83 ARG 83 103 103 ARG ARG A . n +A 1 84 GLU 84 104 104 GLU GLU A . n +A 1 85 VAL 85 105 105 VAL VAL A . n +A 1 86 ILE 86 106 106 ILE ILE A . n +A 1 87 LEU 87 107 107 LEU LEU A . n +A 1 88 PRO 88 108 108 PRO PRO A . n +A 1 89 GLU 89 109 109 GLU GLU A . n +A 1 90 ARG 90 110 110 ARG ARG A . n +A 1 91 TRP 91 111 111 TRP TRP A . n +A 1 92 THR 92 112 112 THR THR A . n +A 1 93 GLN 93 113 113 GLN GLN A . n +A 1 94 ASP 94 114 114 ASP ASP A . n +A 1 95 LEU 95 115 115 LEU LEU A . n +A 1 96 ARG 96 116 116 ARG ARG A . n +A 1 97 THR 97 117 117 THR THR A . n +A 1 98 ARG 98 118 118 ARG ARG A . n +A 1 99 VAL 99 119 119 VAL VAL A . n +A 1 100 VAL 100 120 120 VAL VAL A . n +A 1 101 LEU 101 121 121 LEU LEU A . n +A 1 102 ARG 102 122 122 ARG ARG A . n +A 1 103 ILE 103 123 123 ILE ILE A . n +A 1 104 GLY 104 124 124 GLY GLY A . n +A 1 105 SER 105 125 125 SER SER A . n +A 1 106 ALA 106 126 126 ALA ALA A . n +A 1 107 HIS 107 127 127 HIS HIS A . n +A 1 108 SER 108 128 128 SER SER A . n +A 1 109 TYR 109 129 129 TYR TYR A . n +A 1 110 ALA 110 130 130 ALA ALA A . n +A 1 111 ILE 111 131 131 ILE ILE A . n +A 1 112 VAL 112 132 132 VAL VAL A . n +A 1 113 TRP 113 133 133 TRP TRP A . n +A 1 114 VAL 114 134 134 VAL VAL A . n +A 1 115 ASN 115 135 135 ASN ASN A . n +A 1 116 GLY 116 136 136 GLY GLY A . n +A 1 117 VAL 117 137 137 VAL VAL A . n +A 1 118 ASP 118 138 138 ASP ASP A . n +A 1 119 THR 119 139 139 THR THR A . n +A 1 120 LEU 120 140 140 LEU LEU A . n +A 1 121 GLU 121 141 141 GLU GLU A . n +A 1 122 HIS 122 142 142 HIS HIS A . n +A 1 123 GLU 123 143 143 GLU GLU A . n +A 1 124 GLY 124 144 144 GLY GLY A . n +A 1 125 GLY 125 145 145 GLY GLY A . n +A 1 126 TYR 126 146 146 TYR TYR A . n +A 1 127 LEU 127 147 147 LEU LEU A . n +A 1 128 PRO 128 148 148 PRO PRO A . n +A 1 129 PHE 129 149 149 PHE PHE A . n +A 1 130 GLU 130 150 150 GLU GLU A . n +A 1 131 ALA 131 151 151 ALA ALA A . n +A 1 132 ASP 132 152 152 ASP ASP A . n +A 1 133 ILE 133 153 153 ILE ILE A . n +A 1 134 SER 134 154 154 SER SER A . n +A 1 135 ASN 135 155 155 ASN ASN A . n +A 1 136 LEU 136 156 156 LEU LEU A . n +A 1 137 VAL 137 157 157 VAL VAL A . n +A 1 138 GLN 138 158 158 GLN GLN A . n +A 1 139 VAL 139 159 159 VAL VAL A . n +A 1 140 GLY 140 160 160 GLY GLY A . n +A 1 141 PRO 141 161 ? ? ? A . n +A 1 142 LEU 142 162 ? ? ? A . n +A 1 143 PRO 143 163 ? ? ? A . n +A 1 144 SER 144 164 164 SER SER A . n +A 1 145 ARG 145 165 165 ARG ARG A . n +A 1 146 LEU 146 166 166 LEU LEU A . n +A 1 147 ARG 147 167 167 ARG ARG A . n +A 1 148 ILE 148 168 168 ILE ILE A . n +A 1 149 THR 149 169 169 THR THR A . n +A 1 150 ILE 150 170 170 ILE ILE A . n +A 1 151 ALA 151 171 171 ALA ALA A . n +A 1 152 ILE 152 172 172 ILE ILE A . n +A 1 153 ASN 153 173 173 ASN ASN A . n +A 1 154 ASN 154 174 174 ASN ASN A . n +A 1 155 THR 155 175 175 THR THR A . n +A 1 156 LEU 156 176 176 LEU LEU A . n +A 1 157 THR 157 177 177 THR THR A . n +A 1 158 PRO 158 178 178 PRO PRO A . n +A 1 159 THR 159 179 179 THR THR A . n +A 1 160 THR 160 180 180 THR THR A . n +A 1 161 LEU 161 181 181 LEU LEU A . n +A 1 162 PRO 162 182 182 PRO PRO A . n +A 1 163 PRO 163 183 183 PRO PRO A . n +A 1 164 GLY 164 184 184 GLY GLY A . n +A 1 165 THR 165 185 185 THR THR A . n +A 1 166 ILE 166 186 186 ILE ILE A . n +A 1 167 GLN 167 187 187 GLN GLN A . n +A 1 168 TYR 168 188 188 TYR TYR A . n +A 1 169 LEU 169 189 189 LEU LEU A . n +A 1 170 THR 170 190 190 THR THR A . n +A 1 171 ASP 171 191 191 ASP ASP A . n +A 1 172 THR 172 192 192 THR THR A . n +A 1 173 SER 173 193 193 SER SER A . n +A 1 174 LYS 174 194 194 LYS LYS A . n +A 1 175 TYR 175 195 195 TYR TYR A . n +A 1 176 PRO 176 196 196 PRO PRO A . n +A 1 177 LYS 177 197 197 LYS LYS A . n +A 1 178 GLY 178 198 198 GLY GLY A . n +A 1 179 TYR 179 199 199 TYR TYR A . n +A 1 180 PHE 180 200 200 PHE PHE A . n +A 1 181 VAL 181 201 201 VAL VAL A . n +A 1 182 GLN 182 202 202 GLN GLN A . n +A 1 183 ASN 183 203 203 ASN ASN A . n +A 1 184 THR 184 204 204 THR THR A . n +A 1 185 TYR 185 205 205 TYR TYR A . n +A 1 186 PHE 186 206 206 PHE PHE A . n +A 1 187 ASP 187 207 207 ASP ASP A . n +A 1 188 PHE 188 208 208 PHE PHE A . n +A 1 189 PHE 189 209 209 PHE PHE A . n +A 1 190 ASN 190 210 210 ASN ASN A . n +A 1 191 TYR 191 211 211 TYR TYR A . n +A 1 192 ALA 192 212 212 ALA ALA A . n +A 1 193 GLY 193 213 213 GLY GLY A . n +A 1 194 LEU 194 214 214 LEU LEU A . n +A 1 195 GLN 195 215 215 GLN GLN A . n +A 1 196 ARG 196 216 216 ARG ARG A . n +A 1 197 SER 197 217 217 SER SER A . n +A 1 198 VAL 198 218 218 VAL VAL A . n +A 1 199 LEU 199 219 219 LEU LEU A . n +A 1 200 LEU 200 220 220 LEU LEU A . n +A 1 201 TYR 201 221 221 TYR TYR A . n +A 1 202 THR 202 222 222 THR THR A . n +A 1 203 THR 203 223 223 THR THR A . n +A 1 204 PRO 204 224 224 PRO PRO A . n +A 1 205 THR 205 225 225 THR THR A . n +A 1 206 THR 206 226 226 THR THR A . n +A 1 207 TYR 207 227 227 TYR TYR A . n +A 1 208 ILE 208 228 228 ILE ILE A . n +A 1 209 ASP 209 229 229 ASP ASP A . n +A 1 210 ASP 210 230 230 ASP ASP A . n +A 1 211 ILE 211 231 231 ILE ILE A . n +A 1 212 THR 212 232 232 THR THR A . n +A 1 213 VAL 213 233 233 VAL VAL A . n +A 1 214 THR 214 234 234 THR THR A . n +A 1 215 THR 215 235 235 THR THR A . n +A 1 216 SER 216 236 236 SER SER A . n +A 1 217 VAL 217 237 237 VAL VAL A . n +A 1 218 GLU 218 238 238 GLU GLU A . n +A 1 219 GLN 219 239 239 GLN GLN A . n +A 1 220 ASP 220 240 240 ASP ASP A . n +A 1 221 SER 221 241 241 SER SER A . n +A 1 222 GLY 222 242 242 GLY GLY A . n +A 1 223 LEU 223 243 243 LEU LEU A . n +A 1 224 VAL 224 244 244 VAL VAL A . n +A 1 225 ASN 225 245 245 ASN ASN A . n +A 1 226 TYR 226 246 246 TYR TYR A . n +A 1 227 GLN 227 247 247 GLN GLN A . n +A 1 228 ILE 228 248 248 ILE ILE A . n +A 1 229 SER 229 249 249 SER SER A . n +A 1 230 VAL 230 250 250 VAL VAL A . n +A 1 231 LYS 231 251 251 LYS LYS A . n +A 1 232 GLY 232 252 252 GLY GLY A . n +A 1 233 SER 233 253 253 SER SER A . n +A 1 234 ASN 234 254 254 ASN ASN A . n +A 1 235 LEU 235 255 255 LEU LEU A . n +A 1 236 PHE 236 256 256 PHE PHE A . n +A 1 237 LYS 237 257 257 LYS LYS A . n +A 1 238 LEU 238 258 258 LEU LEU A . n +A 1 239 GLU 239 259 259 GLU GLU A . n +A 1 240 VAL 240 260 260 VAL VAL A . n +A 1 241 ARG 241 261 261 ARG ARG A . n +A 1 242 LEU 242 262 262 LEU LEU A . n +A 1 243 LEU 243 263 263 LEU LEU A . n +A 1 244 ASP 244 264 264 ASP ASP A . n +A 1 245 ALA 245 265 265 ALA ALA A . n +A 1 246 GLU 246 266 266 GLU GLU A . n +A 1 247 ASN 247 267 267 ASN ASN A . n +A 1 248 LYS 248 268 268 LYS LYS A . n +A 1 249 VAL 249 269 269 VAL VAL A . n +A 1 250 VAL 250 270 270 VAL VAL A . n +A 1 251 ALA 251 271 271 ALA ALA A . n +A 1 252 ASN 252 272 272 ASN ASN A . n +A 1 253 GLY 253 273 273 GLY GLY A . n +A 1 254 THR 254 274 274 THR THR A . n +A 1 255 GLY 255 275 275 GLY GLY A . n +A 1 256 THR 256 276 276 THR THR A . n +A 1 257 GLN 257 277 277 GLN GLN A . n +A 1 258 GLY 258 278 278 GLY GLY A . n +A 1 259 GLN 259 279 279 GLN GLN A . n +A 1 260 LEU 260 280 280 LEU LEU A . n +A 1 261 LYS 261 281 281 LYS LYS A . n +A 1 262 VAL 262 282 282 VAL VAL A . n +A 1 263 PRO 263 283 283 PRO PRO A . n +A 1 264 GLY 264 284 284 GLY GLY A . n +A 1 265 VAL 265 285 285 VAL VAL A . n +A 1 266 SER 266 286 286 SER SER A . n +A 1 267 LEU 267 287 287 LEU LEU A . n +A 1 268 TRP 268 288 288 TRP TRP A . n +A 1 269 TRP 269 289 289 TRP TRP A . n +A 1 270 PRO 270 290 290 PRO PRO A . n +A 1 271 TYR 271 291 291 TYR TYR A . n +A 1 272 LEU 272 292 292 LEU LEU A . n +A 1 273 MET 273 293 293 MET MET A . n +A 1 274 HIS 274 294 294 HIS HIS A . n +A 1 275 GLU 275 295 295 GLU GLU A . n +A 1 276 ARG 276 296 296 ARG ARG A . n +A 1 277 PRO 277 297 297 PRO PRO A . n +A 1 278 ALA 278 298 298 ALA ALA A . n +A 1 279 TYR 279 299 299 TYR TYR A . n +A 1 280 LEU 280 300 300 LEU LEU A . n +A 1 281 TYR 281 301 301 TYR TYR A . n +A 1 282 SER 282 302 302 SER SER A . n +A 1 283 LEU 283 303 303 LEU LEU A . n +A 1 284 GLU 284 304 304 GLU GLU A . n +A 1 285 VAL 285 305 305 VAL VAL A . n +A 1 286 GLN 286 306 306 GLN GLN A . n +A 1 287 LEU 287 307 307 LEU LEU A . n +A 1 288 THR 288 308 308 THR THR A . n +A 1 289 ALA 289 309 309 ALA ALA A . n +A 1 290 GLN 290 310 310 GLN GLN A . n +A 1 291 THR 291 311 311 THR THR A . n +A 1 292 SER 292 312 312 SER SER A . n +A 1 293 LEU 293 313 313 LEU LEU A . n +A 1 294 GLY 294 314 314 GLY GLY A . n +A 1 295 PRO 295 315 315 PRO PRO A . n +A 1 296 VAL 296 316 316 VAL VAL A . n +A 1 297 SER 297 317 317 SER SER A . n +A 1 298 ASP 298 318 318 ASP ASP A . n +A 1 299 PHE 299 319 319 PHE PHE A . n +A 1 300 TYR 300 320 320 TYR TYR A . n +A 1 301 THR 301 321 321 THR THR A . n +A 1 302 LEU 302 322 322 LEU LEU A . n +A 1 303 PRO 303 323 323 PRO PRO A . n +A 1 304 VAL 304 324 324 VAL VAL A . n +A 1 305 GLY 305 325 325 GLY GLY A . n +A 1 306 ILE 306 326 326 ILE ILE A . n +A 1 307 ARG 307 327 327 ARG ARG A . n +A 1 308 THR 308 328 328 THR THR A . n +A 1 309 VAL 309 329 329 VAL VAL A . n +A 1 310 ALA 310 330 330 ALA ALA A . n +A 1 311 VAL 311 331 331 VAL VAL A . n +A 1 312 THR 312 332 332 THR THR A . n +A 1 313 LYS 313 333 333 LYS LYS A . n +A 1 314 SER 314 334 334 SER SER A . n +A 1 315 GLN 315 335 335 GLN GLN A . n +A 1 316 PHE 316 336 336 PHE PHE A . n +A 1 317 LEU 317 337 337 LEU LEU A . n +A 1 318 ILE 318 338 338 ILE ILE A . n +A 1 319 ASN 319 339 339 ASN ASN A . n +A 1 320 GLY 320 340 340 GLY GLY A . n +A 1 321 LYS 321 341 341 LYS LYS A . n +A 1 322 PRO 322 342 342 PRO PRO A . n +A 1 323 PHE 323 343 343 PHE PHE A . n +A 1 324 TYR 324 344 344 TYR TYR A . n +A 1 325 PHE 325 345 345 PHE PHE A . n +A 1 326 HIS 326 346 346 HIS HIS A . n +A 1 327 GLY 327 347 347 GLY GLY A . n +A 1 328 VAL 328 348 348 VAL VAL A . n +A 1 329 ASN 329 349 349 ASN ASN A . n +A 1 330 LYS 330 350 350 LYS LYS A . n +A 1 331 HIS 331 351 351 HIS HIS A . n +A 1 332 GLU 332 352 352 GLU GLU A . n +A 1 333 ASP 333 353 353 ASP ASP A . n +A 1 334 ALA 334 354 354 ALA ALA A . n +A 1 335 ASP 335 355 355 ASP ASP A . n +A 1 336 ILE 336 356 356 ILE ILE A . n +A 1 337 ARG 337 357 357 ARG ARG A . n +A 1 338 GLY 338 358 358 GLY GLY A . n +A 1 339 LYS 339 359 359 LYS LYS A . n +A 1 340 GLY 340 360 360 GLY GLY A . n +A 1 341 PHE 341 361 361 PHE PHE A . n +A 1 342 ASP 342 362 362 ASP ASP A . n +A 1 343 TRP 343 363 363 TRP TRP A . n +A 1 344 PRO 344 364 364 PRO PRO A . n +A 1 345 LEU 345 365 365 LEU LEU A . n +A 1 346 LEU 346 366 366 LEU LEU A . n +A 1 347 VAL 347 367 367 VAL VAL A . n +A 1 348 LYS 348 368 368 LYS LYS A . n +A 1 349 ASP 349 369 369 ASP ASP A . n +A 1 350 PHE 350 370 370 PHE PHE A . n +A 1 351 ASN 351 371 371 ASN ASN A . n +A 1 352 LEU 352 372 372 LEU LEU A . n +A 1 353 LEU 353 373 373 LEU LEU A . n +A 1 354 ARG 354 374 374 ARG ARG A . n +A 1 355 TRP 355 375 375 TRP TRP A . n +A 1 356 LEU 356 376 376 LEU LEU A . n +A 1 357 GLY 357 377 377 GLY GLY A . n +A 1 358 ALA 358 378 378 ALA ALA A . n +A 1 359 ASN 359 379 379 ASN ASN A . n +A 1 360 ALA 360 380 380 ALA ALA A . n +A 1 361 PHE 361 381 381 PHE PHE A . n +A 1 362 ARG 362 382 382 ARG ARG A . n +A 1 363 THR 363 383 383 THR THR A . n +A 1 364 SER 364 384 384 SER SER A . n +A 1 365 HIS 365 385 385 HIS HIS A . n +A 1 366 TYR 366 386 386 TYR TYR A . n +A 1 367 PRO 367 387 387 PRO PRO A . n +A 1 368 TYR 368 388 388 TYR TYR A . n +A 1 369 ALA 369 389 389 ALA ALA A . n +A 1 370 GLU 370 390 390 GLU GLU A . n +A 1 371 GLU 371 391 391 GLU GLU A . n +A 1 372 VAL 372 392 392 VAL VAL A . n +A 1 373 MET 373 393 393 MET MET A . n +A 1 374 GLN 374 394 394 GLN GLN A . n +A 1 375 MET 375 395 395 MET MET A . n +A 1 376 CYS 376 396 396 CYS CYS A . n +A 1 377 ASP 377 397 397 ASP ASP A . n +A 1 378 ARG 378 398 398 ARG ARG A . n +A 1 379 TYR 379 399 399 TYR TYR A . n +A 1 380 GLY 380 400 400 GLY GLY A . n +A 1 381 ILE 381 401 401 ILE ILE A . n +A 1 382 VAL 382 402 402 VAL VAL A . n +A 1 383 VAL 383 403 403 VAL VAL A . n +A 1 384 ILE 384 404 404 ILE ILE A . n +A 1 385 ASP 385 405 405 ASP ASP A . n +A 1 386 GLU 386 406 406 GLU GLU A . n +A 1 387 CYS 387 407 407 CYS CYS A . n +A 1 388 PRO 388 408 408 PRO PRO A . n +A 1 389 GLY 389 409 409 GLY GLY A . n +A 1 390 VAL 390 410 410 VAL VAL A . n +A 1 391 GLY 391 411 411 GLY GLY A . n +A 1 392 LEU 392 412 412 LEU LEU A . n +A 1 393 ALA 393 413 413 ALA ALA A . n +A 1 394 LEU 394 414 414 LEU LEU A . n +A 1 395 PRO 395 415 415 PRO PRO A . n +A 1 396 GLN 396 416 416 GLN GLN A . n +A 1 397 PHE 397 417 417 PHE PHE A . n +A 1 398 PHE 398 418 418 PHE PHE A . n +A 1 399 ASN 399 419 419 ASN ASN A . n +A 1 400 ASN 400 420 420 ASN ASN A . n +A 1 401 VAL 401 421 421 VAL VAL A . n +A 1 402 SER 402 422 422 SER SER A . n +A 1 403 LEU 403 423 423 LEU LEU A . n +A 1 404 HIS 404 424 424 HIS HIS A . n +A 1 405 HIS 405 425 425 HIS HIS A . n +A 1 406 HIS 406 426 426 HIS HIS A . n +A 1 407 MET 407 427 427 MET MET A . n +A 1 408 GLN 408 428 428 GLN GLN A . n +A 1 409 VAL 409 429 429 VAL VAL A . n +A 1 410 MET 410 430 430 MET MET A . n +A 1 411 GLU 411 431 431 GLU GLU A . n +A 1 412 GLU 412 432 432 GLU GLU A . n +A 1 413 VAL 413 433 433 VAL VAL A . n +A 1 414 VAL 414 434 434 VAL VAL A . n +A 1 415 ARG 415 435 435 ARG ARG A . n +A 1 416 ARG 416 436 436 ARG ARG A . n +A 1 417 ASP 417 437 437 ASP ASP A . n +A 1 418 LYS 418 438 438 LYS LYS A . n +A 1 419 ASN 419 439 439 ASN ASN A . n +A 1 420 HIS 420 440 440 HIS HIS A . n +A 1 421 PRO 421 441 441 PRO PRO A . n +A 1 422 ALA 422 442 442 ALA ALA A . n +A 1 423 VAL 423 443 443 VAL VAL A . n +A 1 424 VAL 424 444 444 VAL VAL A . n +A 1 425 MET 425 445 445 MET MET A . n +A 1 426 TRP 426 446 446 TRP TRP A . n +A 1 427 SER 427 447 447 SER SER A . n +A 1 428 VAL 428 448 448 VAL VAL A . n +A 1 429 ALA 429 449 449 ALA ALA A . n +A 1 430 ASN 430 450 450 ASN ASN A . n +A 1 431 GLU 431 451 451 GLU GLU A . n +A 1 432 PRO 432 452 452 PRO PRO A . n +A 1 433 ALA 433 453 453 ALA ALA A . n +A 1 434 SER 434 454 454 SER SER A . n +A 1 435 HIS 435 455 455 HIS HIS A . n +A 1 436 LEU 436 456 456 LEU LEU A . n +A 1 437 GLU 437 457 457 GLU GLU A . n +A 1 438 SER 438 458 458 SER SER A . n +A 1 439 ALA 439 459 459 ALA ALA A . n +A 1 440 GLY 440 460 460 GLY GLY A . n +A 1 441 TYR 441 461 461 TYR TYR A . n +A 1 442 TYR 442 462 462 TYR TYR A . n +A 1 443 LEU 443 463 463 LEU LEU A . n +A 1 444 LYS 444 464 464 LYS LYS A . n +A 1 445 MET 445 465 465 MET MET A . n +A 1 446 VAL 446 466 466 VAL VAL A . n +A 1 447 ILE 447 467 467 ILE ILE A . n +A 1 448 ALA 448 468 468 ALA ALA A . n +A 1 449 HIS 449 469 469 HIS HIS A . n +A 1 450 THR 450 470 470 THR THR A . n +A 1 451 LYS 451 471 471 LYS LYS A . n +A 1 452 SER 452 472 472 SER SER A . n +A 1 453 LEU 453 473 473 LEU LEU A . n +A 1 454 ASP 454 474 474 ASP ASP A . n +A 1 455 PRO 455 475 475 PRO PRO A . n +A 1 456 SER 456 476 476 SER SER A . n +A 1 457 ARG 457 477 477 ARG ARG A . n +A 1 458 PRO 458 478 478 PRO PRO A . n +A 1 459 VAL 459 479 479 VAL VAL A . n +A 1 460 THR 460 480 480 THR THR A . n +A 1 461 PHE 461 481 481 PHE PHE A . n +A 1 462 VAL 462 482 482 VAL VAL A . n +A 1 463 SER 463 483 483 SER SER A . n +A 1 464 ASN 464 484 484 ASN ASN A . n +A 1 465 SER 465 485 485 SER SER A . n +A 1 466 ASN 466 486 486 ASN ASN A . n +A 1 467 TYR 467 487 487 TYR TYR A . n +A 1 468 ALA 468 488 488 ALA ALA A . n +A 1 469 ALA 469 489 489 ALA ALA A . n +A 1 470 ASP 470 490 490 ASP ASP A . n +A 1 471 LYS 471 491 491 LYS LYS A . n +A 1 472 GLY 472 492 492 GLY GLY A . n +A 1 473 ALA 473 493 493 ALA ALA A . n +A 1 474 PRO 474 494 494 PRO PRO A . n +A 1 475 TYR 475 495 495 TYR TYR A . n +A 1 476 VAL 476 496 496 VAL VAL A . n +A 1 477 ASP 477 497 497 ASP ASP A . n +A 1 478 VAL 478 498 498 VAL VAL A . n +A 1 479 ILE 479 499 499 ILE ILE A . n +A 1 480 CYS 480 500 500 CYS CYS A . n +A 1 481 LEU 481 501 501 LEU LEU A . n +A 1 482 ASN 482 502 502 ASN ASN A . n +A 1 483 SER 483 503 503 SER SER A . n +A 1 484 TYR 484 504 504 TYR TYR A . n +A 1 485 TYR 485 505 505 TYR TYR A . n +A 1 486 SER 486 506 506 SER SER A . n +A 1 487 TRP 487 507 507 TRP TRP A . n +A 1 488 TYR 488 508 508 TYR TYR A . n +A 1 489 HIS 489 509 509 HIS HIS A . n +A 1 490 ASP 490 510 510 ASP ASP A . n +A 1 491 TYR 491 511 511 TYR TYR A . n +A 1 492 GLY 492 512 512 GLY GLY A . n +A 1 493 HIS 493 513 513 HIS HIS A . n +A 1 494 LEU 494 514 514 LEU LEU A . n +A 1 495 GLU 495 515 515 GLU GLU A . n +A 1 496 LEU 496 516 516 LEU LEU A . n +A 1 497 ILE 497 517 517 ILE ILE A . n +A 1 498 GLN 498 518 518 GLN GLN A . n +A 1 499 LEU 499 519 519 LEU LEU A . n +A 1 500 GLN 500 520 520 GLN GLN A . n +A 1 501 LEU 501 521 521 LEU LEU A . n +A 1 502 ALA 502 522 522 ALA ALA A . n +A 1 503 THR 503 523 523 THR THR A . n +A 1 504 GLN 504 524 524 GLN GLN A . n +A 1 505 PHE 505 525 525 PHE PHE A . n +A 1 506 GLU 506 526 526 GLU GLU A . n +A 1 507 ASN 507 527 527 ASN ASN A . n +A 1 508 TRP 508 528 528 TRP TRP A . n +A 1 509 TYR 509 529 529 TYR TYR A . n +A 1 510 LYS 510 530 530 LYS LYS A . n +A 1 511 LYS 511 531 531 LYS LYS A . n +A 1 512 TYR 512 532 532 TYR TYR A . n +A 1 513 GLN 513 533 533 GLN GLN A . n +A 1 514 LYS 514 534 534 LYS LYS A . n +A 1 515 PRO 515 535 535 PRO PRO A . n +A 1 516 ILE 516 536 536 ILE ILE A . n +A 1 517 ILE 517 537 537 ILE ILE A . n +A 1 518 GLN 518 538 538 GLN GLN A . n +A 1 519 SER 519 539 539 SER SER A . n +A 1 520 GLU 520 540 540 GLU GLU A . n +A 1 521 TYR 521 541 541 TYR TYR A . n +A 1 522 GLY 522 542 542 GLY GLY A . n +A 1 523 ALA 523 543 543 ALA ALA A . n +A 1 524 GLU 524 544 544 GLU GLU A . n +A 1 525 THR 525 545 545 THR THR A . n +A 1 526 ILE 526 546 546 ILE ILE A . n +A 1 527 ALA 527 547 547 ALA ALA A . n +A 1 528 GLY 528 548 548 GLY GLY A . n +A 1 529 PHE 529 549 549 PHE PHE A . n +A 1 530 HIS 530 550 550 HIS HIS A . n +A 1 531 GLN 531 551 551 GLN GLN A . n +A 1 532 ASP 532 552 552 ASP ASP A . n +A 1 533 PRO 533 553 553 PRO PRO A . n +A 1 534 PRO 534 554 554 PRO PRO A . n +A 1 535 LEU 535 555 555 LEU LEU A . n +A 1 536 MET 536 556 556 MET MET A . n +A 1 537 PHE 537 557 557 PHE PHE A . n +A 1 538 THR 538 558 558 THR THR A . n +A 1 539 GLU 539 559 559 GLU GLU A . n +A 1 540 GLU 540 560 560 GLU GLU A . n +A 1 541 TYR 541 561 561 TYR TYR A . n +A 1 542 GLN 542 562 562 GLN GLN A . n +A 1 543 LYS 543 563 563 LYS LYS A . n +A 1 544 SER 544 564 564 SER SER A . n +A 1 545 LEU 545 565 565 LEU LEU A . n +A 1 546 LEU 546 566 566 LEU LEU A . n +A 1 547 GLU 547 567 567 GLU GLU A . n +A 1 548 GLN 548 568 568 GLN GLN A . n +A 1 549 TYR 549 569 569 TYR TYR A . n +A 1 550 HIS 550 570 570 HIS HIS A . n +A 1 551 LEU 551 571 571 LEU LEU A . n +A 1 552 GLY 552 572 572 GLY GLY A . n +A 1 553 LEU 553 573 573 LEU LEU A . n +A 1 554 ASP 554 574 574 ASP ASP A . n +A 1 555 GLN 555 575 575 GLN GLN A . n +A 1 556 LYS 556 576 576 LYS LYS A . n +A 1 557 ARG 557 577 577 ARG ARG A . n +A 1 558 ARG 558 578 578 ARG ARG A . n +A 1 559 LYS 559 579 579 LYS LYS A . n +A 1 560 TYR 560 580 580 TYR TYR A . n +A 1 561 VAL 561 581 581 VAL VAL A . n +A 1 562 VAL 562 582 582 VAL VAL A . n +A 1 563 GLY 563 583 583 GLY GLY A . n +A 1 564 GLU 564 584 584 GLU GLU A . n +A 1 565 LEU 565 585 585 LEU LEU A . n +A 1 566 ILE 566 586 586 ILE ILE A . n +A 1 567 TRP 567 587 587 TRP TRP A . n +A 1 568 ASN 568 588 588 ASN ASN A . n +A 1 569 PHE 569 589 589 PHE PHE A . n +A 1 570 ALA 570 590 590 ALA ALA A . n +A 1 571 ASP 571 591 591 ASP ASP A . n +A 1 572 PHE 572 592 592 PHE PHE A . n +A 1 573 MET 573 593 593 MET MET A . n +A 1 574 THR 574 594 594 THR THR A . n +A 1 575 GLU 575 595 595 GLU GLU A . n +A 1 576 GLN 576 596 596 GLN GLN A . n +A 1 577 SER 577 597 597 SER SER A . n +A 1 578 PRO 578 598 598 PRO PRO A . n +A 1 579 THR 579 599 599 THR THR A . n +A 1 580 ARG 580 600 600 ARG ARG A . n +A 1 581 VAL 581 601 601 VAL VAL A . n +A 1 582 LEU 582 602 602 LEU LEU A . n +A 1 583 GLY 583 603 603 GLY GLY A . n +A 1 584 ASN 584 604 604 ASN ASN A . n +A 1 585 LYS 585 605 605 LYS LYS A . n +A 1 586 LYS 586 606 606 LYS LYS A . n +A 1 587 GLY 587 607 607 GLY GLY A . n +A 1 588 ILE 588 608 608 ILE ILE A . n +A 1 589 PHE 589 609 609 PHE PHE A . n +A 1 590 THR 590 610 610 THR THR A . n +A 1 591 ARG 591 611 611 ARG ARG A . n +A 1 592 GLN 592 612 612 GLN GLN A . n +A 1 593 ARG 593 613 613 ARG ARG A . n +A 1 594 GLN 594 614 614 GLN GLN A . n +A 1 595 PRO 595 615 615 PRO PRO A . n +A 1 596 LYS 596 616 616 LYS LYS A . n +A 1 597 SER 597 617 617 SER SER A . n +A 1 598 ALA 598 618 618 ALA ALA A . n +A 1 599 ALA 599 619 619 ALA ALA A . n +A 1 600 PHE 600 620 620 PHE PHE A . n +A 1 601 LEU 601 621 621 LEU LEU A . n +A 1 602 LEU 602 622 622 LEU LEU A . n +A 1 603 ARG 603 623 623 ARG ARG A . n +A 1 604 GLU 604 624 624 GLU GLU A . n +A 1 605 ARG 605 625 625 ARG ARG A . n +A 1 606 TYR 606 626 626 TYR TYR A . n +A 1 607 TRP 607 627 627 TRP TRP A . n +A 1 608 LYS 608 628 628 LYS LYS A . n +A 1 609 ILE 609 629 629 ILE ILE A . n +A 1 610 ALA 610 630 630 ALA ALA A . n +A 1 611 ASN 611 631 631 ASN ASN A . n +A 1 612 GLU 612 632 632 GLU GLU A . n +A 1 613 THR 613 633 ? ? ? A . n +B 1 1 LEU 1 21 ? ? ? B . n +B 1 2 GLY 2 22 22 GLY GLY B . n +B 1 3 LEU 3 23 23 LEU LEU B . n +B 1 4 GLN 4 24 24 GLN GLN B . n +B 1 5 GLY 5 25 25 GLY GLY B . n +B 1 6 GLY 6 26 26 GLY GLY B . n +B 1 7 MET 7 27 27 MET MET B . n +B 1 8 LEU 8 28 28 LEU LEU B . n +B 1 9 TYR 9 29 29 TYR TYR B . n +B 1 10 PRO 10 30 30 PRO PRO B . n +B 1 11 GLN 11 31 31 GLN GLN B . n +B 1 12 GLU 12 32 32 GLU GLU B . n +B 1 13 SER 13 33 33 SER SER B . n +B 1 14 PRO 14 34 34 PRO PRO B . n +B 1 15 SER 15 35 35 SER SER B . n +B 1 16 ARG 16 36 36 ARG ARG B . n +B 1 17 GLU 17 37 37 GLU GLU B . n +B 1 18 CYS 18 38 38 CYS CYS B . n +B 1 19 LYS 19 39 39 LYS LYS B . n +B 1 20 GLU 20 40 40 GLU GLU B . n +B 1 21 LEU 21 41 41 LEU LEU B . n +B 1 22 ASP 22 42 42 ASP ASP B . n +B 1 23 GLY 23 43 43 GLY GLY B . n +B 1 24 LEU 24 44 44 LEU LEU B . n +B 1 25 TRP 25 45 45 TRP TRP B . n +B 1 26 SER 26 46 46 SER SER B . n +B 1 27 PHE 27 47 47 PHE PHE B . n +B 1 28 ARG 28 48 48 ARG ARG B . n +B 1 29 ALA 29 49 49 ALA ALA B . n +B 1 30 ASP 30 50 50 ASP ASP B . n +B 1 31 PHE 31 51 51 PHE PHE B . n +B 1 32 SER 32 52 52 SER SER B . n +B 1 33 ASP 33 53 53 ASP ASP B . n +B 1 34 ASN 34 54 54 ASN ASN B . n +B 1 35 ARG 35 55 55 ARG ARG B . n +B 1 36 ARG 36 56 56 ARG ARG B . n +B 1 37 ARG 37 57 57 ARG ARG B . n +B 1 38 GLY 38 58 58 GLY GLY B . n +B 1 39 PHE 39 59 59 PHE PHE B . n +B 1 40 GLU 40 60 60 GLU GLU B . n +B 1 41 GLU 41 61 61 GLU GLU B . n +B 1 42 GLN 42 62 62 GLN GLN B . n +B 1 43 TRP 43 63 63 TRP TRP B . n +B 1 44 TYR 44 64 64 TYR TYR B . n +B 1 45 ARG 45 65 65 ARG ARG B . n +B 1 46 ARG 46 66 66 ARG ARG B . n +B 1 47 PRO 47 67 67 PRO PRO B . n +B 1 48 LEU 48 68 68 LEU LEU B . n +B 1 49 TRP 49 69 69 TRP TRP B . n +B 1 50 GLU 50 70 70 GLU GLU B . n +B 1 51 SER 51 71 71 SER SER B . n +B 1 52 GLY 52 72 72 GLY GLY B . n +B 1 53 PRO 53 73 73 PRO PRO B . n +B 1 54 THR 54 74 74 THR THR B . n +B 1 55 VAL 55 75 75 VAL VAL B . n +B 1 56 ASP 56 76 76 ASP ASP B . n +B 1 57 MET 57 77 77 MET MET B . n +B 1 58 PRO 58 78 78 PRO PRO B . n +B 1 59 VAL 59 79 79 VAL VAL B . n +B 1 60 PRO 60 80 80 PRO PRO B . n +B 1 61 SER 61 81 81 SER SER B . n +B 1 62 SER 62 82 82 SER SER B . n +B 1 63 PHE 63 83 83 PHE PHE B . n +B 1 64 ASN 64 84 84 ASN ASN B . n +B 1 65 ASP 65 85 85 ASP ASP B . n +B 1 66 ILE 66 86 86 ILE ILE B . n +B 1 67 SER 67 87 87 SER SER B . n +B 1 68 GLN 68 88 88 GLN GLN B . n +B 1 69 ASP 69 89 89 ASP ASP B . n +B 1 70 TRP 70 90 90 TRP TRP B . n +B 1 71 ARG 71 91 91 ARG ARG B . n +B 1 72 LEU 72 92 92 LEU LEU B . n +B 1 73 ARG 73 93 93 ARG ARG B . n +B 1 74 HIS 74 94 94 HIS HIS B . n +B 1 75 PHE 75 95 95 PHE PHE B . n +B 1 76 VAL 76 96 96 VAL VAL B . n +B 1 77 GLY 77 97 97 GLY GLY B . n +B 1 78 TRP 78 98 98 TRP TRP B . n +B 1 79 VAL 79 99 99 VAL VAL B . n +B 1 80 TRP 80 100 100 TRP TRP B . n +B 1 81 TYR 81 101 101 TYR TYR B . n +B 1 82 GLU 82 102 102 GLU GLU B . n +B 1 83 ARG 83 103 103 ARG ARG B . n +B 1 84 GLU 84 104 104 GLU GLU B . n +B 1 85 VAL 85 105 105 VAL VAL B . n +B 1 86 ILE 86 106 106 ILE ILE B . n +B 1 87 LEU 87 107 107 LEU LEU B . n +B 1 88 PRO 88 108 108 PRO PRO B . n +B 1 89 GLU 89 109 109 GLU GLU B . n +B 1 90 ARG 90 110 110 ARG ARG B . n +B 1 91 TRP 91 111 111 TRP TRP B . n +B 1 92 THR 92 112 112 THR THR B . n +B 1 93 GLN 93 113 113 GLN GLN B . n +B 1 94 ASP 94 114 114 ASP ASP B . n +B 1 95 LEU 95 115 115 LEU LEU B . n +B 1 96 ARG 96 116 116 ARG ARG B . n +B 1 97 THR 97 117 117 THR THR B . n +B 1 98 ARG 98 118 118 ARG ARG B . n +B 1 99 VAL 99 119 119 VAL VAL B . n +B 1 100 VAL 100 120 120 VAL VAL B . n +B 1 101 LEU 101 121 121 LEU LEU B . n +B 1 102 ARG 102 122 122 ARG ARG B . n +B 1 103 ILE 103 123 123 ILE ILE B . n +B 1 104 GLY 104 124 124 GLY GLY B . n +B 1 105 SER 105 125 125 SER SER B . n +B 1 106 ALA 106 126 126 ALA ALA B . n +B 1 107 HIS 107 127 127 HIS HIS B . n +B 1 108 SER 108 128 128 SER SER B . n +B 1 109 TYR 109 129 129 TYR TYR B . n +B 1 110 ALA 110 130 130 ALA ALA B . n +B 1 111 ILE 111 131 131 ILE ILE B . n +B 1 112 VAL 112 132 132 VAL VAL B . n +B 1 113 TRP 113 133 133 TRP TRP B . n +B 1 114 VAL 114 134 134 VAL VAL B . n +B 1 115 ASN 115 135 135 ASN ASN B . n +B 1 116 GLY 116 136 136 GLY GLY B . n +B 1 117 VAL 117 137 137 VAL VAL B . n +B 1 118 ASP 118 138 138 ASP ASP B . n +B 1 119 THR 119 139 139 THR THR B . n +B 1 120 LEU 120 140 140 LEU LEU B . n +B 1 121 GLU 121 141 141 GLU GLU B . n +B 1 122 HIS 122 142 142 HIS HIS B . n +B 1 123 GLU 123 143 143 GLU GLU B . n +B 1 124 GLY 124 144 144 GLY GLY B . n +B 1 125 GLY 125 145 145 GLY GLY B . n +B 1 126 TYR 126 146 146 TYR TYR B . n +B 1 127 LEU 127 147 147 LEU LEU B . n +B 1 128 PRO 128 148 148 PRO PRO B . n +B 1 129 PHE 129 149 149 PHE PHE B . n +B 1 130 GLU 130 150 150 GLU GLU B . n +B 1 131 ALA 131 151 151 ALA ALA B . n +B 1 132 ASP 132 152 152 ASP ASP B . n +B 1 133 ILE 133 153 153 ILE ILE B . n +B 1 134 SER 134 154 154 SER SER B . n +B 1 135 ASN 135 155 155 ASN ASN B . n +B 1 136 LEU 136 156 156 LEU LEU B . n +B 1 137 VAL 137 157 157 VAL VAL B . n +B 1 138 GLN 138 158 158 GLN GLN B . n +B 1 139 VAL 139 159 159 VAL VAL B . n +B 1 140 GLY 140 160 160 GLY GLY B . n +B 1 141 PRO 141 161 ? ? ? B . n +B 1 142 LEU 142 162 ? ? ? B . n +B 1 143 PRO 143 163 ? ? ? B . n +B 1 144 SER 144 164 164 SER SER B . n +B 1 145 ARG 145 165 165 ARG ARG B . n +B 1 146 LEU 146 166 166 LEU LEU B . n +B 1 147 ARG 147 167 167 ARG ARG B . n +B 1 148 ILE 148 168 168 ILE ILE B . n +B 1 149 THR 149 169 169 THR THR B . n +B 1 150 ILE 150 170 170 ILE ILE B . n +B 1 151 ALA 151 171 171 ALA ALA B . n +B 1 152 ILE 152 172 172 ILE ILE B . n +B 1 153 ASN 153 173 173 ASN ASN B . n +B 1 154 ASN 154 174 174 ASN ASN B . n +B 1 155 THR 155 175 175 THR THR B . n +B 1 156 LEU 156 176 176 LEU LEU B . n +B 1 157 THR 157 177 177 THR THR B . n +B 1 158 PRO 158 178 178 PRO PRO B . n +B 1 159 THR 159 179 179 THR THR B . n +B 1 160 THR 160 180 180 THR THR B . n +B 1 161 LEU 161 181 181 LEU LEU B . n +B 1 162 PRO 162 182 182 PRO PRO B . n +B 1 163 PRO 163 183 183 PRO PRO B . n +B 1 164 GLY 164 184 184 GLY GLY B . n +B 1 165 THR 165 185 185 THR THR B . n +B 1 166 ILE 166 186 186 ILE ILE B . n +B 1 167 GLN 167 187 187 GLN GLN B . n +B 1 168 TYR 168 188 188 TYR TYR B . n +B 1 169 LEU 169 189 189 LEU LEU B . n +B 1 170 THR 170 190 190 THR THR B . n +B 1 171 ASP 171 191 191 ASP ASP B . n +B 1 172 THR 172 192 192 THR THR B . n +B 1 173 SER 173 193 193 SER SER B . n +B 1 174 LYS 174 194 194 LYS LYS B . n +B 1 175 TYR 175 195 195 TYR TYR B . n +B 1 176 PRO 176 196 196 PRO PRO B . n +B 1 177 LYS 177 197 197 LYS LYS B . n +B 1 178 GLY 178 198 198 GLY GLY B . n +B 1 179 TYR 179 199 199 TYR TYR B . n +B 1 180 PHE 180 200 200 PHE PHE B . n +B 1 181 VAL 181 201 201 VAL VAL B . n +B 1 182 GLN 182 202 202 GLN GLN B . n +B 1 183 ASN 183 203 203 ASN ASN B . n +B 1 184 THR 184 204 204 THR THR B . n +B 1 185 TYR 185 205 205 TYR TYR B . n +B 1 186 PHE 186 206 206 PHE PHE B . n +B 1 187 ASP 187 207 207 ASP ASP B . n +B 1 188 PHE 188 208 208 PHE PHE B . n +B 1 189 PHE 189 209 209 PHE PHE B . n +B 1 190 ASN 190 210 210 ASN ASN B . n +B 1 191 TYR 191 211 211 TYR TYR B . n +B 1 192 ALA 192 212 212 ALA ALA B . n +B 1 193 GLY 193 213 213 GLY GLY B . n +B 1 194 LEU 194 214 214 LEU LEU B . n +B 1 195 GLN 195 215 215 GLN GLN B . n +B 1 196 ARG 196 216 216 ARG ARG B . n +B 1 197 SER 197 217 217 SER SER B . n +B 1 198 VAL 198 218 218 VAL VAL B . n +B 1 199 LEU 199 219 219 LEU LEU B . n +B 1 200 LEU 200 220 220 LEU LEU B . n +B 1 201 TYR 201 221 221 TYR TYR B . n +B 1 202 THR 202 222 222 THR THR B . n +B 1 203 THR 203 223 223 THR THR B . n +B 1 204 PRO 204 224 224 PRO PRO B . n +B 1 205 THR 205 225 225 THR THR B . n +B 1 206 THR 206 226 226 THR THR B . n +B 1 207 TYR 207 227 227 TYR TYR B . n +B 1 208 ILE 208 228 228 ILE ILE B . n +B 1 209 ASP 209 229 229 ASP ASP B . n +B 1 210 ASP 210 230 230 ASP ASP B . n +B 1 211 ILE 211 231 231 ILE ILE B . n +B 1 212 THR 212 232 232 THR THR B . n +B 1 213 VAL 213 233 233 VAL VAL B . n +B 1 214 THR 214 234 234 THR THR B . n +B 1 215 THR 215 235 235 THR THR B . n +B 1 216 SER 216 236 236 SER SER B . n +B 1 217 VAL 217 237 237 VAL VAL B . n +B 1 218 GLU 218 238 238 GLU GLU B . n +B 1 219 GLN 219 239 239 GLN GLN B . n +B 1 220 ASP 220 240 240 ASP ASP B . n +B 1 221 SER 221 241 241 SER SER B . n +B 1 222 GLY 222 242 242 GLY GLY B . n +B 1 223 LEU 223 243 243 LEU LEU B . n +B 1 224 VAL 224 244 244 VAL VAL B . n +B 1 225 ASN 225 245 245 ASN ASN B . n +B 1 226 TYR 226 246 246 TYR TYR B . n +B 1 227 GLN 227 247 247 GLN GLN B . n +B 1 228 ILE 228 248 248 ILE ILE B . n +B 1 229 SER 229 249 249 SER SER B . n +B 1 230 VAL 230 250 250 VAL VAL B . n +B 1 231 LYS 231 251 251 LYS LYS B . n +B 1 232 GLY 232 252 252 GLY GLY B . n +B 1 233 SER 233 253 253 SER SER B . n +B 1 234 ASN 234 254 254 ASN ASN B . n +B 1 235 LEU 235 255 255 LEU LEU B . n +B 1 236 PHE 236 256 256 PHE PHE B . n +B 1 237 LYS 237 257 257 LYS LYS B . n +B 1 238 LEU 238 258 258 LEU LEU B . n +B 1 239 GLU 239 259 259 GLU GLU B . n +B 1 240 VAL 240 260 260 VAL VAL B . n +B 1 241 ARG 241 261 261 ARG ARG B . n +B 1 242 LEU 242 262 262 LEU LEU B . n +B 1 243 LEU 243 263 263 LEU LEU B . n +B 1 244 ASP 244 264 264 ASP ASP B . n +B 1 245 ALA 245 265 265 ALA ALA B . n +B 1 246 GLU 246 266 266 GLU GLU B . n +B 1 247 ASN 247 267 267 ASN ASN B . n +B 1 248 LYS 248 268 268 LYS LYS B . n +B 1 249 VAL 249 269 269 VAL VAL B . n +B 1 250 VAL 250 270 270 VAL VAL B . n +B 1 251 ALA 251 271 271 ALA ALA B . n +B 1 252 ASN 252 272 272 ASN ASN B . n +B 1 253 GLY 253 273 273 GLY GLY B . n +B 1 254 THR 254 274 274 THR THR B . n +B 1 255 GLY 255 275 275 GLY GLY B . n +B 1 256 THR 256 276 276 THR THR B . n +B 1 257 GLN 257 277 277 GLN GLN B . n +B 1 258 GLY 258 278 278 GLY GLY B . n +B 1 259 GLN 259 279 279 GLN GLN B . n +B 1 260 LEU 260 280 280 LEU LEU B . n +B 1 261 LYS 261 281 281 LYS LYS B . n +B 1 262 VAL 262 282 282 VAL VAL B . n +B 1 263 PRO 263 283 283 PRO PRO B . n +B 1 264 GLY 264 284 284 GLY GLY B . n +B 1 265 VAL 265 285 285 VAL VAL B . n +B 1 266 SER 266 286 286 SER SER B . n +B 1 267 LEU 267 287 287 LEU LEU B . n +B 1 268 TRP 268 288 288 TRP TRP B . n +B 1 269 TRP 269 289 289 TRP TRP B . n +B 1 270 PRO 270 290 290 PRO PRO B . n +B 1 271 TYR 271 291 291 TYR TYR B . n +B 1 272 LEU 272 292 292 LEU LEU B . n +B 1 273 MET 273 293 293 MET MET B . n +B 1 274 HIS 274 294 294 HIS HIS B . n +B 1 275 GLU 275 295 295 GLU GLU B . n +B 1 276 ARG 276 296 296 ARG ARG B . n +B 1 277 PRO 277 297 297 PRO PRO B . n +B 1 278 ALA 278 298 298 ALA ALA B . n +B 1 279 TYR 279 299 299 TYR TYR B . n +B 1 280 LEU 280 300 300 LEU LEU B . n +B 1 281 TYR 281 301 301 TYR TYR B . n +B 1 282 SER 282 302 302 SER SER B . n +B 1 283 LEU 283 303 303 LEU LEU B . n +B 1 284 GLU 284 304 304 GLU GLU B . n +B 1 285 VAL 285 305 305 VAL VAL B . n +B 1 286 GLN 286 306 306 GLN GLN B . n +B 1 287 LEU 287 307 307 LEU LEU B . n +B 1 288 THR 288 308 308 THR THR B . n +B 1 289 ALA 289 309 309 ALA ALA B . n +B 1 290 GLN 290 310 310 GLN GLN B . n +B 1 291 THR 291 311 311 THR THR B . n +B 1 292 SER 292 312 312 SER SER B . n +B 1 293 LEU 293 313 313 LEU LEU B . n +B 1 294 GLY 294 314 314 GLY GLY B . n +B 1 295 PRO 295 315 315 PRO PRO B . n +B 1 296 VAL 296 316 316 VAL VAL B . n +B 1 297 SER 297 317 317 SER SER B . n +B 1 298 ASP 298 318 318 ASP ASP B . n +B 1 299 PHE 299 319 319 PHE PHE B . n +B 1 300 TYR 300 320 320 TYR TYR B . n +B 1 301 THR 301 321 321 THR THR B . n +B 1 302 LEU 302 322 322 LEU LEU B . n +B 1 303 PRO 303 323 323 PRO PRO B . n +B 1 304 VAL 304 324 324 VAL VAL B . n +B 1 305 GLY 305 325 325 GLY GLY B . n +B 1 306 ILE 306 326 326 ILE ILE B . n +B 1 307 ARG 307 327 327 ARG ARG B . n +B 1 308 THR 308 328 328 THR THR B . n +B 1 309 VAL 309 329 329 VAL VAL B . n +B 1 310 ALA 310 330 330 ALA ALA B . n +B 1 311 VAL 311 331 331 VAL VAL B . n +B 1 312 THR 312 332 332 THR THR B . n +B 1 313 LYS 313 333 333 LYS LYS B . n +B 1 314 SER 314 334 334 SER SER B . n +B 1 315 GLN 315 335 335 GLN GLN B . n +B 1 316 PHE 316 336 336 PHE PHE B . n +B 1 317 LEU 317 337 337 LEU LEU B . n +B 1 318 ILE 318 338 338 ILE ILE B . n +B 1 319 ASN 319 339 339 ASN ASN B . n +B 1 320 GLY 320 340 340 GLY GLY B . n +B 1 321 LYS 321 341 341 LYS LYS B . n +B 1 322 PRO 322 342 342 PRO PRO B . n +B 1 323 PHE 323 343 343 PHE PHE B . n +B 1 324 TYR 324 344 344 TYR TYR B . n +B 1 325 PHE 325 345 345 PHE PHE B . n +B 1 326 HIS 326 346 346 HIS HIS B . n +B 1 327 GLY 327 347 347 GLY GLY B . n +B 1 328 VAL 328 348 348 VAL VAL B . n +B 1 329 ASN 329 349 349 ASN ASN B . n +B 1 330 LYS 330 350 350 LYS LYS B . n +B 1 331 HIS 331 351 351 HIS HIS B . n +B 1 332 GLU 332 352 352 GLU GLU B . n +B 1 333 ASP 333 353 353 ASP ASP B . n +B 1 334 ALA 334 354 354 ALA ALA B . n +B 1 335 ASP 335 355 355 ASP ASP B . n +B 1 336 ILE 336 356 356 ILE ILE B . n +B 1 337 ARG 337 357 357 ARG ARG B . n +B 1 338 GLY 338 358 358 GLY GLY B . n +B 1 339 LYS 339 359 359 LYS LYS B . n +B 1 340 GLY 340 360 360 GLY GLY B . n +B 1 341 PHE 341 361 361 PHE PHE B . n +B 1 342 ASP 342 362 362 ASP ASP B . n +B 1 343 TRP 343 363 363 TRP TRP B . n +B 1 344 PRO 344 364 364 PRO PRO B . n +B 1 345 LEU 345 365 365 LEU LEU B . n +B 1 346 LEU 346 366 366 LEU LEU B . n +B 1 347 VAL 347 367 367 VAL VAL B . n +B 1 348 LYS 348 368 368 LYS LYS B . n +B 1 349 ASP 349 369 369 ASP ASP B . n +B 1 350 PHE 350 370 370 PHE PHE B . n +B 1 351 ASN 351 371 371 ASN ASN B . n +B 1 352 LEU 352 372 372 LEU LEU B . n +B 1 353 LEU 353 373 373 LEU LEU B . n +B 1 354 ARG 354 374 374 ARG ARG B . n +B 1 355 TRP 355 375 375 TRP TRP B . n +B 1 356 LEU 356 376 376 LEU LEU B . n +B 1 357 GLY 357 377 377 GLY GLY B . n +B 1 358 ALA 358 378 378 ALA ALA B . n +B 1 359 ASN 359 379 379 ASN ASN B . n +B 1 360 ALA 360 380 380 ALA ALA B . n +B 1 361 PHE 361 381 381 PHE PHE B . n +B 1 362 ARG 362 382 382 ARG ARG B . n +B 1 363 THR 363 383 383 THR THR B . n +B 1 364 SER 364 384 384 SER SER B . n +B 1 365 HIS 365 385 385 HIS HIS B . n +B 1 366 TYR 366 386 386 TYR TYR B . n +B 1 367 PRO 367 387 387 PRO PRO B . n +B 1 368 TYR 368 388 388 TYR TYR B . n +B 1 369 ALA 369 389 389 ALA ALA B . n +B 1 370 GLU 370 390 390 GLU GLU B . n +B 1 371 GLU 371 391 391 GLU GLU B . n +B 1 372 VAL 372 392 392 VAL VAL B . n +B 1 373 MET 373 393 393 MET MET B . n +B 1 374 GLN 374 394 394 GLN GLN B . n +B 1 375 MET 375 395 395 MET MET B . n +B 1 376 CYS 376 396 396 CYS CYS B . n +B 1 377 ASP 377 397 397 ASP ASP B . n +B 1 378 ARG 378 398 398 ARG ARG B . n +B 1 379 TYR 379 399 399 TYR TYR B . n +B 1 380 GLY 380 400 400 GLY GLY B . n +B 1 381 ILE 381 401 401 ILE ILE B . n +B 1 382 VAL 382 402 402 VAL VAL B . n +B 1 383 VAL 383 403 403 VAL VAL B . n +B 1 384 ILE 384 404 404 ILE ILE B . n +B 1 385 ASP 385 405 405 ASP ASP B . n +B 1 386 GLU 386 406 406 GLU GLU B . n +B 1 387 CYS 387 407 407 CYS CYS B . n +B 1 388 PRO 388 408 408 PRO PRO B . n +B 1 389 GLY 389 409 409 GLY GLY B . n +B 1 390 VAL 390 410 410 VAL VAL B . n +B 1 391 GLY 391 411 411 GLY GLY B . n +B 1 392 LEU 392 412 412 LEU LEU B . n +B 1 393 ALA 393 413 413 ALA ALA B . n +B 1 394 LEU 394 414 414 LEU LEU B . n +B 1 395 PRO 395 415 415 PRO PRO B . n +B 1 396 GLN 396 416 416 GLN GLN B . n +B 1 397 PHE 397 417 417 PHE PHE B . n +B 1 398 PHE 398 418 418 PHE PHE B . n +B 1 399 ASN 399 419 419 ASN ASN B . n +B 1 400 ASN 400 420 420 ASN ASN B . n +B 1 401 VAL 401 421 421 VAL VAL B . n +B 1 402 SER 402 422 422 SER SER B . n +B 1 403 LEU 403 423 423 LEU LEU B . n +B 1 404 HIS 404 424 424 HIS HIS B . n +B 1 405 HIS 405 425 425 HIS HIS B . n +B 1 406 HIS 406 426 426 HIS HIS B . n +B 1 407 MET 407 427 427 MET MET B . n +B 1 408 GLN 408 428 428 GLN GLN B . n +B 1 409 VAL 409 429 429 VAL VAL B . n +B 1 410 MET 410 430 430 MET MET B . n +B 1 411 GLU 411 431 431 GLU GLU B . n +B 1 412 GLU 412 432 432 GLU GLU B . n +B 1 413 VAL 413 433 433 VAL VAL B . n +B 1 414 VAL 414 434 434 VAL VAL B . n +B 1 415 ARG 415 435 435 ARG ARG B . n +B 1 416 ARG 416 436 436 ARG ARG B . n +B 1 417 ASP 417 437 437 ASP ASP B . n +B 1 418 LYS 418 438 438 LYS LYS B . n +B 1 419 ASN 419 439 439 ASN ASN B . n +B 1 420 HIS 420 440 440 HIS HIS B . n +B 1 421 PRO 421 441 441 PRO PRO B . n +B 1 422 ALA 422 442 442 ALA ALA B . n +B 1 423 VAL 423 443 443 VAL VAL B . n +B 1 424 VAL 424 444 444 VAL VAL B . n +B 1 425 MET 425 445 445 MET MET B . n +B 1 426 TRP 426 446 446 TRP TRP B . n +B 1 427 SER 427 447 447 SER SER B . n +B 1 428 VAL 428 448 448 VAL VAL B . n +B 1 429 ALA 429 449 449 ALA ALA B . n +B 1 430 ASN 430 450 450 ASN ASN B . n +B 1 431 GLU 431 451 451 GLU GLU B . n +B 1 432 PRO 432 452 452 PRO PRO B . n +B 1 433 ALA 433 453 453 ALA ALA B . n +B 1 434 SER 434 454 454 SER SER B . n +B 1 435 HIS 435 455 455 HIS HIS B . n +B 1 436 LEU 436 456 456 LEU LEU B . n +B 1 437 GLU 437 457 457 GLU GLU B . n +B 1 438 SER 438 458 458 SER SER B . n +B 1 439 ALA 439 459 459 ALA ALA B . n +B 1 440 GLY 440 460 460 GLY GLY B . n +B 1 441 TYR 441 461 461 TYR TYR B . n +B 1 442 TYR 442 462 462 TYR TYR B . n +B 1 443 LEU 443 463 463 LEU LEU B . n +B 1 444 LYS 444 464 464 LYS LYS B . n +B 1 445 MET 445 465 465 MET MET B . n +B 1 446 VAL 446 466 466 VAL VAL B . n +B 1 447 ILE 447 467 467 ILE ILE B . n +B 1 448 ALA 448 468 468 ALA ALA B . n +B 1 449 HIS 449 469 469 HIS HIS B . n +B 1 450 THR 450 470 470 THR THR B . n +B 1 451 LYS 451 471 471 LYS LYS B . n +B 1 452 SER 452 472 472 SER SER B . n +B 1 453 LEU 453 473 473 LEU LEU B . n +B 1 454 ASP 454 474 474 ASP ASP B . n +B 1 455 PRO 455 475 475 PRO PRO B . n +B 1 456 SER 456 476 476 SER SER B . n +B 1 457 ARG 457 477 477 ARG ARG B . n +B 1 458 PRO 458 478 478 PRO PRO B . n +B 1 459 VAL 459 479 479 VAL VAL B . n +B 1 460 THR 460 480 480 THR THR B . n +B 1 461 PHE 461 481 481 PHE PHE B . n +B 1 462 VAL 462 482 482 VAL VAL B . n +B 1 463 SER 463 483 483 SER SER B . n +B 1 464 ASN 464 484 484 ASN ASN B . n +B 1 465 SER 465 485 485 SER SER B . n +B 1 466 ASN 466 486 486 ASN ASN B . n +B 1 467 TYR 467 487 487 TYR TYR B . n +B 1 468 ALA 468 488 488 ALA ALA B . n +B 1 469 ALA 469 489 489 ALA ALA B . n +B 1 470 ASP 470 490 490 ASP ASP B . n +B 1 471 LYS 471 491 491 LYS LYS B . n +B 1 472 GLY 472 492 492 GLY GLY B . n +B 1 473 ALA 473 493 493 ALA ALA B . n +B 1 474 PRO 474 494 494 PRO PRO B . n +B 1 475 TYR 475 495 495 TYR TYR B . n +B 1 476 VAL 476 496 496 VAL VAL B . n +B 1 477 ASP 477 497 497 ASP ASP B . n +B 1 478 VAL 478 498 498 VAL VAL B . n +B 1 479 ILE 479 499 499 ILE ILE B . n +B 1 480 CYS 480 500 500 CYS CYS B . n +B 1 481 LEU 481 501 501 LEU LEU B . n +B 1 482 ASN 482 502 502 ASN ASN B . n +B 1 483 SER 483 503 503 SER SER B . n +B 1 484 TYR 484 504 504 TYR TYR B . n +B 1 485 TYR 485 505 505 TYR TYR B . n +B 1 486 SER 486 506 506 SER SER B . n +B 1 487 TRP 487 507 507 TRP TRP B . n +B 1 488 TYR 488 508 508 TYR TYR B . n +B 1 489 HIS 489 509 509 HIS HIS B . n +B 1 490 ASP 490 510 510 ASP ASP B . n +B 1 491 TYR 491 511 511 TYR TYR B . n +B 1 492 GLY 492 512 512 GLY GLY B . n +B 1 493 HIS 493 513 513 HIS HIS B . n +B 1 494 LEU 494 514 514 LEU LEU B . n +B 1 495 GLU 495 515 515 GLU GLU B . n +B 1 496 LEU 496 516 516 LEU LEU B . n +B 1 497 ILE 497 517 517 ILE ILE B . n +B 1 498 GLN 498 518 518 GLN GLN B . n +B 1 499 LEU 499 519 519 LEU LEU B . n +B 1 500 GLN 500 520 520 GLN GLN B . n +B 1 501 LEU 501 521 521 LEU LEU B . n +B 1 502 ALA 502 522 522 ALA ALA B . n +B 1 503 THR 503 523 523 THR THR B . n +B 1 504 GLN 504 524 524 GLN GLN B . n +B 1 505 PHE 505 525 525 PHE PHE B . n +B 1 506 GLU 506 526 526 GLU GLU B . n +B 1 507 ASN 507 527 527 ASN ASN B . n +B 1 508 TRP 508 528 528 TRP TRP B . n +B 1 509 TYR 509 529 529 TYR TYR B . n +B 1 510 LYS 510 530 530 LYS LYS B . n +B 1 511 LYS 511 531 531 LYS LYS B . n +B 1 512 TYR 512 532 532 TYR TYR B . n +B 1 513 GLN 513 533 533 GLN GLN B . n +B 1 514 LYS 514 534 534 LYS LYS B . n +B 1 515 PRO 515 535 535 PRO PRO B . n +B 1 516 ILE 516 536 536 ILE ILE B . n +B 1 517 ILE 517 537 537 ILE ILE B . n +B 1 518 GLN 518 538 538 GLN GLN B . n +B 1 519 SER 519 539 539 SER SER B . n +B 1 520 GLU 520 540 540 GLU GLU B . n +B 1 521 TYR 521 541 541 TYR TYR B . n +B 1 522 GLY 522 542 542 GLY GLY B . n +B 1 523 ALA 523 543 543 ALA ALA B . n +B 1 524 GLU 524 544 544 GLU GLU B . n +B 1 525 THR 525 545 545 THR THR B . n +B 1 526 ILE 526 546 546 ILE ILE B . n +B 1 527 ALA 527 547 547 ALA ALA B . n +B 1 528 GLY 528 548 548 GLY GLY B . n +B 1 529 PHE 529 549 549 PHE PHE B . n +B 1 530 HIS 530 550 550 HIS HIS B . n +B 1 531 GLN 531 551 551 GLN GLN B . n +B 1 532 ASP 532 552 552 ASP ASP B . n +B 1 533 PRO 533 553 553 PRO PRO B . n +B 1 534 PRO 534 554 554 PRO PRO B . n +B 1 535 LEU 535 555 555 LEU LEU B . n +B 1 536 MET 536 556 556 MET MET B . n +B 1 537 PHE 537 557 557 PHE PHE B . n +B 1 538 THR 538 558 558 THR THR B . n +B 1 539 GLU 539 559 559 GLU GLU B . n +B 1 540 GLU 540 560 560 GLU GLU B . n +B 1 541 TYR 541 561 561 TYR TYR B . n +B 1 542 GLN 542 562 562 GLN GLN B . n +B 1 543 LYS 543 563 563 LYS LYS B . n +B 1 544 SER 544 564 564 SER SER B . n +B 1 545 LEU 545 565 565 LEU LEU B . n +B 1 546 LEU 546 566 566 LEU LEU B . n +B 1 547 GLU 547 567 567 GLU GLU B . n +B 1 548 GLN 548 568 568 GLN GLN B . n +B 1 549 TYR 549 569 569 TYR TYR B . n +B 1 550 HIS 550 570 570 HIS HIS B . n +B 1 551 LEU 551 571 571 LEU LEU B . n +B 1 552 GLY 552 572 572 GLY GLY B . n +B 1 553 LEU 553 573 573 LEU LEU B . n +B 1 554 ASP 554 574 574 ASP ASP B . n +B 1 555 GLN 555 575 575 GLN GLN B . n +B 1 556 LYS 556 576 576 LYS LYS B . n +B 1 557 ARG 557 577 577 ARG ARG B . n +B 1 558 ARG 558 578 578 ARG ARG B . n +B 1 559 LYS 559 579 579 LYS LYS B . n +B 1 560 TYR 560 580 580 TYR TYR B . n +B 1 561 VAL 561 581 581 VAL VAL B . n +B 1 562 VAL 562 582 582 VAL VAL B . n +B 1 563 GLY 563 583 583 GLY GLY B . n +B 1 564 GLU 564 584 584 GLU GLU B . n +B 1 565 LEU 565 585 585 LEU LEU B . n +B 1 566 ILE 566 586 586 ILE ILE B . n +B 1 567 TRP 567 587 587 TRP TRP B . n +B 1 568 ASN 568 588 588 ASN ASN B . n +B 1 569 PHE 569 589 589 PHE PHE B . n +B 1 570 ALA 570 590 590 ALA ALA B . n +B 1 571 ASP 571 591 591 ASP ASP B . n +B 1 572 PHE 572 592 592 PHE PHE B . n +B 1 573 MET 573 593 593 MET MET B . n +B 1 574 THR 574 594 594 THR THR B . n +B 1 575 GLU 575 595 595 GLU GLU B . n +B 1 576 GLN 576 596 596 GLN GLN B . n +B 1 577 SER 577 597 597 SER SER B . n +B 1 578 PRO 578 598 598 PRO PRO B . n +B 1 579 THR 579 599 599 THR THR B . n +B 1 580 ARG 580 600 600 ARG ARG B . n +B 1 581 VAL 581 601 601 VAL VAL B . n +B 1 582 LEU 582 602 602 LEU LEU B . n +B 1 583 GLY 583 603 603 GLY GLY B . n +B 1 584 ASN 584 604 604 ASN ASN B . n +B 1 585 LYS 585 605 605 LYS LYS B . n +B 1 586 LYS 586 606 606 LYS LYS B . n +B 1 587 GLY 587 607 607 GLY GLY B . n +B 1 588 ILE 588 608 608 ILE ILE B . n +B 1 589 PHE 589 609 609 PHE PHE B . n +B 1 590 THR 590 610 610 THR THR B . n +B 1 591 ARG 591 611 611 ARG ARG B . n +B 1 592 GLN 592 612 612 GLN GLN B . n +B 1 593 ARG 593 613 613 ARG ARG B . n +B 1 594 GLN 594 614 614 GLN GLN B . n +B 1 595 PRO 595 615 615 PRO PRO B . n +B 1 596 LYS 596 616 616 LYS LYS B . n +B 1 597 SER 597 617 617 SER SER B . n +B 1 598 ALA 598 618 618 ALA ALA B . n +B 1 599 ALA 599 619 619 ALA ALA B . n +B 1 600 PHE 600 620 620 PHE PHE B . n +B 1 601 LEU 601 621 621 LEU LEU B . n +B 1 602 LEU 602 622 622 LEU LEU B . n +B 1 603 ARG 603 623 623 ARG ARG B . n +B 1 604 GLU 604 624 624 GLU GLU B . n +B 1 605 ARG 605 625 625 ARG ARG B . n +B 1 606 TYR 606 626 626 TYR TYR B . n +B 1 607 TRP 607 627 627 TRP TRP B . n +B 1 608 LYS 608 628 628 LYS LYS B . n +B 1 609 ILE 609 629 629 ILE ILE B . n +B 1 610 ALA 610 630 630 ALA ALA B . n +B 1 611 ASN 611 631 631 ASN ASN B . n +B 1 612 GLU 612 632 632 GLU GLU B . n +B 1 613 THR 613 633 633 THR THR B . n +C 1 1 LEU 1 21 ? ? ? D . n +C 1 2 GLY 2 22 ? ? ? D . n +C 1 3 LEU 3 23 23 LEU LEU D . n +C 1 4 GLN 4 24 24 GLN GLN D . n +C 1 5 GLY 5 25 25 GLY GLY D . n +C 1 6 GLY 6 26 26 GLY GLY D . n +C 1 7 MET 7 27 27 MET MET D . n +C 1 8 LEU 8 28 28 LEU LEU D . n +C 1 9 TYR 9 29 29 TYR TYR D . n +C 1 10 PRO 10 30 30 PRO PRO D . n +C 1 11 GLN 11 31 31 GLN GLN D . n +C 1 12 GLU 12 32 32 GLU GLU D . n +C 1 13 SER 13 33 33 SER SER D . n +C 1 14 PRO 14 34 34 PRO PRO D . n +C 1 15 SER 15 35 35 SER SER D . n +C 1 16 ARG 16 36 36 ARG ARG D . n +C 1 17 GLU 17 37 37 GLU GLU D . n +C 1 18 CYS 18 38 38 CYS CYS D . n +C 1 19 LYS 19 39 39 LYS LYS D . n +C 1 20 GLU 20 40 40 GLU GLU D . n +C 1 21 LEU 21 41 41 LEU LEU D . n +C 1 22 ASP 22 42 42 ASP ASP D . n +C 1 23 GLY 23 43 43 GLY GLY D . n +C 1 24 LEU 24 44 44 LEU LEU D . n +C 1 25 TRP 25 45 45 TRP TRP D . n +C 1 26 SER 26 46 46 SER SER D . n +C 1 27 PHE 27 47 47 PHE PHE D . n +C 1 28 ARG 28 48 48 ARG ARG D . n +C 1 29 ALA 29 49 49 ALA ALA D . n +C 1 30 ASP 30 50 50 ASP ASP D . n +C 1 31 PHE 31 51 51 PHE PHE D . n +C 1 32 SER 32 52 52 SER SER D . n +C 1 33 ASP 33 53 53 ASP ASP D . n +C 1 34 ASN 34 54 54 ASN ASN D . n +C 1 35 ARG 35 55 55 ARG ARG D . n +C 1 36 ARG 36 56 56 ARG ARG D . n +C 1 37 ARG 37 57 57 ARG ARG D . n +C 1 38 GLY 38 58 58 GLY GLY D . n +C 1 39 PHE 39 59 59 PHE PHE D . n +C 1 40 GLU 40 60 60 GLU GLU D . n +C 1 41 GLU 41 61 61 GLU GLU D . n +C 1 42 GLN 42 62 62 GLN GLN D . n +C 1 43 TRP 43 63 63 TRP TRP D . n +C 1 44 TYR 44 64 64 TYR TYR D . n +C 1 45 ARG 45 65 65 ARG ARG D . n +C 1 46 ARG 46 66 66 ARG ARG D . n +C 1 47 PRO 47 67 67 PRO PRO D . n +C 1 48 LEU 48 68 68 LEU LEU D . n +C 1 49 TRP 49 69 69 TRP TRP D . n +C 1 50 GLU 50 70 70 GLU GLU D . n +C 1 51 SER 51 71 71 SER SER D . n +C 1 52 GLY 52 72 72 GLY GLY D . n +C 1 53 PRO 53 73 73 PRO PRO D . n +C 1 54 THR 54 74 74 THR THR D . n +C 1 55 VAL 55 75 75 VAL VAL D . n +C 1 56 ASP 56 76 76 ASP ASP D . n +C 1 57 MET 57 77 77 MET MET D . n +C 1 58 PRO 58 78 78 PRO PRO D . n +C 1 59 VAL 59 79 79 VAL VAL D . n +C 1 60 PRO 60 80 80 PRO PRO D . n +C 1 61 SER 61 81 81 SER SER D . n +C 1 62 SER 62 82 82 SER SER D . n +C 1 63 PHE 63 83 83 PHE PHE D . n +C 1 64 ASN 64 84 84 ASN ASN D . n +C 1 65 ASP 65 85 85 ASP ASP D . n +C 1 66 ILE 66 86 86 ILE ILE D . n +C 1 67 SER 67 87 87 SER SER D . n +C 1 68 GLN 68 88 88 GLN GLN D . n +C 1 69 ASP 69 89 89 ASP ASP D . n +C 1 70 TRP 70 90 90 TRP TRP D . n +C 1 71 ARG 71 91 91 ARG ARG D . n +C 1 72 LEU 72 92 92 LEU LEU D . n +C 1 73 ARG 73 93 93 ARG ARG D . n +C 1 74 HIS 74 94 94 HIS HIS D . n +C 1 75 PHE 75 95 95 PHE PHE D . n +C 1 76 VAL 76 96 96 VAL VAL D . n +C 1 77 GLY 77 97 97 GLY GLY D . n +C 1 78 TRP 78 98 98 TRP TRP D . n +C 1 79 VAL 79 99 99 VAL VAL D . n +C 1 80 TRP 80 100 100 TRP TRP D . n +C 1 81 TYR 81 101 101 TYR TYR D . n +C 1 82 GLU 82 102 102 GLU GLU D . n +C 1 83 ARG 83 103 103 ARG ARG D . n +C 1 84 GLU 84 104 104 GLU GLU D . n +C 1 85 VAL 85 105 105 VAL VAL D . n +C 1 86 ILE 86 106 106 ILE ILE D . n +C 1 87 LEU 87 107 107 LEU LEU D . n +C 1 88 PRO 88 108 108 PRO PRO D . n +C 1 89 GLU 89 109 109 GLU GLU D . n +C 1 90 ARG 90 110 110 ARG ARG D . n +C 1 91 TRP 91 111 111 TRP TRP D . n +C 1 92 THR 92 112 112 THR THR D . n +C 1 93 GLN 93 113 113 GLN GLN D . n +C 1 94 ASP 94 114 114 ASP ASP D . n +C 1 95 LEU 95 115 115 LEU LEU D . n +C 1 96 ARG 96 116 116 ARG ARG D . n +C 1 97 THR 97 117 117 THR THR D . n +C 1 98 ARG 98 118 118 ARG ARG D . n +C 1 99 VAL 99 119 119 VAL VAL D . n +C 1 100 VAL 100 120 120 VAL VAL D . n +C 1 101 LEU 101 121 121 LEU LEU D . n +C 1 102 ARG 102 122 122 ARG ARG D . n +C 1 103 ILE 103 123 123 ILE ILE D . n +C 1 104 GLY 104 124 124 GLY GLY D . n +C 1 105 SER 105 125 125 SER SER D . n +C 1 106 ALA 106 126 126 ALA ALA D . n +C 1 107 HIS 107 127 127 HIS HIS D . n +C 1 108 SER 108 128 128 SER SER D . n +C 1 109 TYR 109 129 129 TYR TYR D . n +C 1 110 ALA 110 130 130 ALA ALA D . n +C 1 111 ILE 111 131 131 ILE ILE D . n +C 1 112 VAL 112 132 132 VAL VAL D . n +C 1 113 TRP 113 133 133 TRP TRP D . n +C 1 114 VAL 114 134 134 VAL VAL D . n +C 1 115 ASN 115 135 135 ASN ASN D . n +C 1 116 GLY 116 136 136 GLY GLY D . n +C 1 117 VAL 117 137 137 VAL VAL D . n +C 1 118 ASP 118 138 138 ASP ASP D . n +C 1 119 THR 119 139 139 THR THR D . n +C 1 120 LEU 120 140 140 LEU LEU D . n +C 1 121 GLU 121 141 141 GLU GLU D . n +C 1 122 HIS 122 142 142 HIS HIS D . n +C 1 123 GLU 123 143 143 GLU GLU D . n +C 1 124 GLY 124 144 144 GLY GLY D . n +C 1 125 GLY 125 145 145 GLY GLY D . n +C 1 126 TYR 126 146 146 TYR TYR D . n +C 1 127 LEU 127 147 147 LEU LEU D . n +C 1 128 PRO 128 148 148 PRO PRO D . n +C 1 129 PHE 129 149 149 PHE PHE D . n +C 1 130 GLU 130 150 150 GLU GLU D . n +C 1 131 ALA 131 151 151 ALA ALA D . n +C 1 132 ASP 132 152 152 ASP ASP D . n +C 1 133 ILE 133 153 153 ILE ILE D . n +C 1 134 SER 134 154 154 SER SER D . n +C 1 135 ASN 135 155 155 ASN ASN D . n +C 1 136 LEU 136 156 156 LEU LEU D . n +C 1 137 VAL 137 157 157 VAL VAL D . n +C 1 138 GLN 138 158 158 GLN GLN D . n +C 1 139 VAL 139 159 159 VAL VAL D . n +C 1 140 GLY 140 160 ? ? ? D . n +C 1 141 PRO 141 161 ? ? ? D . n +C 1 142 LEU 142 162 ? ? ? D . n +C 1 143 PRO 143 163 ? ? ? D . n +C 1 144 SER 144 164 164 SER SER D . n +C 1 145 ARG 145 165 165 ARG ARG D . n +C 1 146 LEU 146 166 166 LEU LEU D . n +C 1 147 ARG 147 167 167 ARG ARG D . n +C 1 148 ILE 148 168 168 ILE ILE D . n +C 1 149 THR 149 169 169 THR THR D . n +C 1 150 ILE 150 170 170 ILE ILE D . n +C 1 151 ALA 151 171 171 ALA ALA D . n +C 1 152 ILE 152 172 172 ILE ILE D . n +C 1 153 ASN 153 173 173 ASN ASN D . n +C 1 154 ASN 154 174 174 ASN ASN D . n +C 1 155 THR 155 175 175 THR THR D . n +C 1 156 LEU 156 176 176 LEU LEU D . n +C 1 157 THR 157 177 177 THR THR D . n +C 1 158 PRO 158 178 178 PRO PRO D . n +C 1 159 THR 159 179 179 THR THR D . n +C 1 160 THR 160 180 180 THR THR D . n +C 1 161 LEU 161 181 181 LEU LEU D . n +C 1 162 PRO 162 182 182 PRO PRO D . n +C 1 163 PRO 163 183 183 PRO PRO D . n +C 1 164 GLY 164 184 184 GLY GLY D . n +C 1 165 THR 165 185 185 THR THR D . n +C 1 166 ILE 166 186 186 ILE ILE D . n +C 1 167 GLN 167 187 187 GLN GLN D . n +C 1 168 TYR 168 188 188 TYR TYR D . n +C 1 169 LEU 169 189 189 LEU LEU D . n +C 1 170 THR 170 190 190 THR THR D . n +C 1 171 ASP 171 191 191 ASP ASP D . n +C 1 172 THR 172 192 192 THR THR D . n +C 1 173 SER 173 193 193 SER SER D . n +C 1 174 LYS 174 194 194 LYS LYS D . n +C 1 175 TYR 175 195 195 TYR TYR D . n +C 1 176 PRO 176 196 196 PRO PRO D . n +C 1 177 LYS 177 197 197 LYS LYS D . n +C 1 178 GLY 178 198 198 GLY GLY D . n +C 1 179 TYR 179 199 199 TYR TYR D . n +C 1 180 PHE 180 200 200 PHE PHE D . n +C 1 181 VAL 181 201 201 VAL VAL D . n +C 1 182 GLN 182 202 202 GLN GLN D . n +C 1 183 ASN 183 203 203 ASN ASN D . n +C 1 184 THR 184 204 204 THR THR D . n +C 1 185 TYR 185 205 205 TYR TYR D . n +C 1 186 PHE 186 206 206 PHE PHE D . n +C 1 187 ASP 187 207 207 ASP ASP D . n +C 1 188 PHE 188 208 208 PHE PHE D . n +C 1 189 PHE 189 209 209 PHE PHE D . n +C 1 190 ASN 190 210 210 ASN ASN D . n +C 1 191 TYR 191 211 211 TYR TYR D . n +C 1 192 ALA 192 212 212 ALA ALA D . n +C 1 193 GLY 193 213 213 GLY GLY D . n +C 1 194 LEU 194 214 214 LEU LEU D . n +C 1 195 GLN 195 215 215 GLN GLN D . n +C 1 196 ARG 196 216 216 ARG ARG D . n +C 1 197 SER 197 217 217 SER SER D . n +C 1 198 VAL 198 218 218 VAL VAL D . n +C 1 199 LEU 199 219 219 LEU LEU D . n +C 1 200 LEU 200 220 220 LEU LEU D . n +C 1 201 TYR 201 221 221 TYR TYR D . n +C 1 202 THR 202 222 222 THR THR D . n +C 1 203 THR 203 223 223 THR THR D . n +C 1 204 PRO 204 224 224 PRO PRO D . n +C 1 205 THR 205 225 225 THR THR D . n +C 1 206 THR 206 226 226 THR THR D . n +C 1 207 TYR 207 227 227 TYR TYR D . n +C 1 208 ILE 208 228 228 ILE ILE D . n +C 1 209 ASP 209 229 229 ASP ASP D . n +C 1 210 ASP 210 230 230 ASP ASP D . n +C 1 211 ILE 211 231 231 ILE ILE D . n +C 1 212 THR 212 232 232 THR THR D . n +C 1 213 VAL 213 233 233 VAL VAL D . n +C 1 214 THR 214 234 234 THR THR D . n +C 1 215 THR 215 235 235 THR THR D . n +C 1 216 SER 216 236 236 SER SER D . n +C 1 217 VAL 217 237 237 VAL VAL D . n +C 1 218 GLU 218 238 238 GLU GLU D . n +C 1 219 GLN 219 239 239 GLN GLN D . n +C 1 220 ASP 220 240 240 ASP ASP D . n +C 1 221 SER 221 241 241 SER SER D . n +C 1 222 GLY 222 242 242 GLY GLY D . n +C 1 223 LEU 223 243 243 LEU LEU D . n +C 1 224 VAL 224 244 244 VAL VAL D . n +C 1 225 ASN 225 245 245 ASN ASN D . n +C 1 226 TYR 226 246 246 TYR TYR D . n +C 1 227 GLN 227 247 247 GLN GLN D . n +C 1 228 ILE 228 248 248 ILE ILE D . n +C 1 229 SER 229 249 249 SER SER D . n +C 1 230 VAL 230 250 250 VAL VAL D . n +C 1 231 LYS 231 251 251 LYS LYS D . n +C 1 232 GLY 232 252 252 GLY GLY D . n +C 1 233 SER 233 253 253 SER SER D . n +C 1 234 ASN 234 254 254 ASN ASN D . n +C 1 235 LEU 235 255 255 LEU LEU D . n +C 1 236 PHE 236 256 256 PHE PHE D . n +C 1 237 LYS 237 257 257 LYS LYS D . n +C 1 238 LEU 238 258 258 LEU LEU D . n +C 1 239 GLU 239 259 259 GLU GLU D . n +C 1 240 VAL 240 260 260 VAL VAL D . n +C 1 241 ARG 241 261 261 ARG ARG D . n +C 1 242 LEU 242 262 262 LEU LEU D . n +C 1 243 LEU 243 263 263 LEU LEU D . n +C 1 244 ASP 244 264 264 ASP ASP D . n +C 1 245 ALA 245 265 265 ALA ALA D . n +C 1 246 GLU 246 266 266 GLU GLU D . n +C 1 247 ASN 247 267 267 ASN ASN D . n +C 1 248 LYS 248 268 268 LYS LYS D . n +C 1 249 VAL 249 269 269 VAL VAL D . n +C 1 250 VAL 250 270 270 VAL VAL D . n +C 1 251 ALA 251 271 271 ALA ALA D . n +C 1 252 ASN 252 272 272 ASN ASN D . n +C 1 253 GLY 253 273 273 GLY GLY D . n +C 1 254 THR 254 274 274 THR THR D . n +C 1 255 GLY 255 275 275 GLY GLY D . n +C 1 256 THR 256 276 276 THR THR D . n +C 1 257 GLN 257 277 277 GLN GLN D . n +C 1 258 GLY 258 278 278 GLY GLY D . n +C 1 259 GLN 259 279 279 GLN GLN D . n +C 1 260 LEU 260 280 280 LEU LEU D . n +C 1 261 LYS 261 281 281 LYS LYS D . n +C 1 262 VAL 262 282 282 VAL VAL D . n +C 1 263 PRO 263 283 283 PRO PRO D . n +C 1 264 GLY 264 284 284 GLY GLY D . n +C 1 265 VAL 265 285 285 VAL VAL D . n +C 1 266 SER 266 286 286 SER SER D . n +C 1 267 LEU 267 287 287 LEU LEU D . n +C 1 268 TRP 268 288 288 TRP TRP D . n +C 1 269 TRP 269 289 289 TRP TRP D . n +C 1 270 PRO 270 290 290 PRO PRO D . n +C 1 271 TYR 271 291 291 TYR TYR D . n +C 1 272 LEU 272 292 292 LEU LEU D . n +C 1 273 MET 273 293 293 MET MET D . n +C 1 274 HIS 274 294 294 HIS HIS D . n +C 1 275 GLU 275 295 295 GLU GLU D . n +C 1 276 ARG 276 296 296 ARG ARG D . n +C 1 277 PRO 277 297 297 PRO PRO D . n +C 1 278 ALA 278 298 298 ALA ALA D . n +C 1 279 TYR 279 299 299 TYR TYR D . n +C 1 280 LEU 280 300 300 LEU LEU D . n +C 1 281 TYR 281 301 301 TYR TYR D . n +C 1 282 SER 282 302 302 SER SER D . n +C 1 283 LEU 283 303 303 LEU LEU D . n +C 1 284 GLU 284 304 304 GLU GLU D . n +C 1 285 VAL 285 305 305 VAL VAL D . n +C 1 286 GLN 286 306 306 GLN GLN D . n +C 1 287 LEU 287 307 307 LEU LEU D . n +C 1 288 THR 288 308 308 THR THR D . n +C 1 289 ALA 289 309 309 ALA ALA D . n +C 1 290 GLN 290 310 310 GLN GLN D . n +C 1 291 THR 291 311 311 THR THR D . n +C 1 292 SER 292 312 312 SER SER D . n +C 1 293 LEU 293 313 313 LEU LEU D . n +C 1 294 GLY 294 314 314 GLY GLY D . n +C 1 295 PRO 295 315 315 PRO PRO D . n +C 1 296 VAL 296 316 316 VAL VAL D . n +C 1 297 SER 297 317 317 SER SER D . n +C 1 298 ASP 298 318 318 ASP ASP D . n +C 1 299 PHE 299 319 319 PHE PHE D . n +C 1 300 TYR 300 320 320 TYR TYR D . n +C 1 301 THR 301 321 321 THR THR D . n +C 1 302 LEU 302 322 322 LEU LEU D . n +C 1 303 PRO 303 323 323 PRO PRO D . n +C 1 304 VAL 304 324 324 VAL VAL D . n +C 1 305 GLY 305 325 325 GLY GLY D . n +C 1 306 ILE 306 326 326 ILE ILE D . n +C 1 307 ARG 307 327 327 ARG ARG D . n +C 1 308 THR 308 328 328 THR THR D . n +C 1 309 VAL 309 329 329 VAL VAL D . n +C 1 310 ALA 310 330 330 ALA ALA D . n +C 1 311 VAL 311 331 331 VAL VAL D . n +C 1 312 THR 312 332 332 THR THR D . n +C 1 313 LYS 313 333 333 LYS LYS D . n +C 1 314 SER 314 334 334 SER SER D . n +C 1 315 GLN 315 335 335 GLN GLN D . n +C 1 316 PHE 316 336 336 PHE PHE D . n +C 1 317 LEU 317 337 337 LEU LEU D . n +C 1 318 ILE 318 338 338 ILE ILE D . n +C 1 319 ASN 319 339 339 ASN ASN D . n +C 1 320 GLY 320 340 340 GLY GLY D . n +C 1 321 LYS 321 341 341 LYS LYS D . n +C 1 322 PRO 322 342 342 PRO PRO D . n +C 1 323 PHE 323 343 343 PHE PHE D . n +C 1 324 TYR 324 344 344 TYR TYR D . n +C 1 325 PHE 325 345 345 PHE PHE D . n +C 1 326 HIS 326 346 346 HIS HIS D . n +C 1 327 GLY 327 347 347 GLY GLY D . n +C 1 328 VAL 328 348 348 VAL VAL D . n +C 1 329 ASN 329 349 349 ASN ASN D . n +C 1 330 LYS 330 350 350 LYS LYS D . n +C 1 331 HIS 331 351 351 HIS HIS D . n +C 1 332 GLU 332 352 352 GLU GLU D . n +C 1 333 ASP 333 353 353 ASP ASP D . n +C 1 334 ALA 334 354 354 ALA ALA D . n +C 1 335 ASP 335 355 355 ASP ASP D . n +C 1 336 ILE 336 356 356 ILE ILE D . n +C 1 337 ARG 337 357 357 ARG ARG D . n +C 1 338 GLY 338 358 358 GLY GLY D . n +C 1 339 LYS 339 359 359 LYS LYS D . n +C 1 340 GLY 340 360 360 GLY GLY D . n +C 1 341 PHE 341 361 361 PHE PHE D . n +C 1 342 ASP 342 362 362 ASP ASP D . n +C 1 343 TRP 343 363 363 TRP TRP D . n +C 1 344 PRO 344 364 364 PRO PRO D . n +C 1 345 LEU 345 365 365 LEU LEU D . n +C 1 346 LEU 346 366 366 LEU LEU D . n +C 1 347 VAL 347 367 367 VAL VAL D . n +C 1 348 LYS 348 368 368 LYS LYS D . n +C 1 349 ASP 349 369 369 ASP ASP D . n +C 1 350 PHE 350 370 370 PHE PHE D . n +C 1 351 ASN 351 371 371 ASN ASN D . n +C 1 352 LEU 352 372 372 LEU LEU D . n +C 1 353 LEU 353 373 373 LEU LEU D . n +C 1 354 ARG 354 374 374 ARG ARG D . n +C 1 355 TRP 355 375 375 TRP TRP D . n +C 1 356 LEU 356 376 376 LEU LEU D . n +C 1 357 GLY 357 377 377 GLY GLY D . n +C 1 358 ALA 358 378 378 ALA ALA D . n +C 1 359 ASN 359 379 379 ASN ASN D . n +C 1 360 ALA 360 380 380 ALA ALA D . n +C 1 361 PHE 361 381 381 PHE PHE D . n +C 1 362 ARG 362 382 382 ARG ARG D . n +C 1 363 THR 363 383 383 THR THR D . n +C 1 364 SER 364 384 384 SER SER D . n +C 1 365 HIS 365 385 385 HIS HIS D . n +C 1 366 TYR 366 386 386 TYR TYR D . n +C 1 367 PRO 367 387 387 PRO PRO D . n +C 1 368 TYR 368 388 388 TYR TYR D . n +C 1 369 ALA 369 389 389 ALA ALA D . n +C 1 370 GLU 370 390 390 GLU GLU D . n +C 1 371 GLU 371 391 391 GLU GLU D . n +C 1 372 VAL 372 392 392 VAL VAL D . n +C 1 373 MET 373 393 393 MET MET D . n +C 1 374 GLN 374 394 394 GLN GLN D . n +C 1 375 MET 375 395 395 MET MET D . n +C 1 376 CYS 376 396 396 CYS CYS D . n +C 1 377 ASP 377 397 397 ASP ASP D . n +C 1 378 ARG 378 398 398 ARG ARG D . n +C 1 379 TYR 379 399 399 TYR TYR D . n +C 1 380 GLY 380 400 400 GLY GLY D . n +C 1 381 ILE 381 401 401 ILE ILE D . n +C 1 382 VAL 382 402 402 VAL VAL D . n +C 1 383 VAL 383 403 403 VAL VAL D . n +C 1 384 ILE 384 404 404 ILE ILE D . n +C 1 385 ASP 385 405 405 ASP ASP D . n +C 1 386 GLU 386 406 406 GLU GLU D . n +C 1 387 CYS 387 407 407 CYS CYS D . n +C 1 388 PRO 388 408 408 PRO PRO D . n +C 1 389 GLY 389 409 409 GLY GLY D . n +C 1 390 VAL 390 410 410 VAL VAL D . n +C 1 391 GLY 391 411 411 GLY GLY D . n +C 1 392 LEU 392 412 412 LEU LEU D . n +C 1 393 ALA 393 413 413 ALA ALA D . n +C 1 394 LEU 394 414 414 LEU LEU D . n +C 1 395 PRO 395 415 415 PRO PRO D . n +C 1 396 GLN 396 416 416 GLN GLN D . n +C 1 397 PHE 397 417 417 PHE PHE D . n +C 1 398 PHE 398 418 418 PHE PHE D . n +C 1 399 ASN 399 419 419 ASN ASN D . n +C 1 400 ASN 400 420 420 ASN ASN D . n +C 1 401 VAL 401 421 421 VAL VAL D . n +C 1 402 SER 402 422 422 SER SER D . n +C 1 403 LEU 403 423 423 LEU LEU D . n +C 1 404 HIS 404 424 424 HIS HIS D . n +C 1 405 HIS 405 425 425 HIS HIS D . n +C 1 406 HIS 406 426 426 HIS HIS D . n +C 1 407 MET 407 427 427 MET MET D . n +C 1 408 GLN 408 428 428 GLN GLN D . n +C 1 409 VAL 409 429 429 VAL VAL D . n +C 1 410 MET 410 430 430 MET MET D . n +C 1 411 GLU 411 431 431 GLU GLU D . n +C 1 412 GLU 412 432 432 GLU GLU D . n +C 1 413 VAL 413 433 433 VAL VAL D . n +C 1 414 VAL 414 434 434 VAL VAL D . n +C 1 415 ARG 415 435 435 ARG ARG D . n +C 1 416 ARG 416 436 436 ARG ARG D . n +C 1 417 ASP 417 437 437 ASP ASP D . n +C 1 418 LYS 418 438 438 LYS LYS D . n +C 1 419 ASN 419 439 439 ASN ASN D . n +C 1 420 HIS 420 440 440 HIS HIS D . n +C 1 421 PRO 421 441 441 PRO PRO D . n +C 1 422 ALA 422 442 442 ALA ALA D . n +C 1 423 VAL 423 443 443 VAL VAL D . n +C 1 424 VAL 424 444 444 VAL VAL D . n +C 1 425 MET 425 445 445 MET MET D . n +C 1 426 TRP 426 446 446 TRP TRP D . n +C 1 427 SER 427 447 447 SER SER D . n +C 1 428 VAL 428 448 448 VAL VAL D . n +C 1 429 ALA 429 449 449 ALA ALA D . n +C 1 430 ASN 430 450 450 ASN ASN D . n +C 1 431 GLU 431 451 451 GLU GLU D . n +C 1 432 PRO 432 452 452 PRO PRO D . n +C 1 433 ALA 433 453 453 ALA ALA D . n +C 1 434 SER 434 454 454 SER SER D . n +C 1 435 HIS 435 455 455 HIS HIS D . n +C 1 436 LEU 436 456 456 LEU LEU D . n +C 1 437 GLU 437 457 457 GLU GLU D . n +C 1 438 SER 438 458 458 SER SER D . n +C 1 439 ALA 439 459 459 ALA ALA D . n +C 1 440 GLY 440 460 460 GLY GLY D . n +C 1 441 TYR 441 461 461 TYR TYR D . n +C 1 442 TYR 442 462 462 TYR TYR D . n +C 1 443 LEU 443 463 463 LEU LEU D . n +C 1 444 LYS 444 464 464 LYS LYS D . n +C 1 445 MET 445 465 465 MET MET D . n +C 1 446 VAL 446 466 466 VAL VAL D . n +C 1 447 ILE 447 467 467 ILE ILE D . n +C 1 448 ALA 448 468 468 ALA ALA D . n +C 1 449 HIS 449 469 469 HIS HIS D . n +C 1 450 THR 450 470 470 THR THR D . n +C 1 451 LYS 451 471 471 LYS LYS D . n +C 1 452 SER 452 472 472 SER SER D . n +C 1 453 LEU 453 473 473 LEU LEU D . n +C 1 454 ASP 454 474 474 ASP ASP D . n +C 1 455 PRO 455 475 475 PRO PRO D . n +C 1 456 SER 456 476 476 SER SER D . n +C 1 457 ARG 457 477 477 ARG ARG D . n +C 1 458 PRO 458 478 478 PRO PRO D . n +C 1 459 VAL 459 479 479 VAL VAL D . n +C 1 460 THR 460 480 480 THR THR D . n +C 1 461 PHE 461 481 481 PHE PHE D . n +C 1 462 VAL 462 482 482 VAL VAL D . n +C 1 463 SER 463 483 483 SER SER D . n +C 1 464 ASN 464 484 484 ASN ASN D . n +C 1 465 SER 465 485 485 SER SER D . n +C 1 466 ASN 466 486 486 ASN ASN D . n +C 1 467 TYR 467 487 487 TYR TYR D . n +C 1 468 ALA 468 488 488 ALA ALA D . n +C 1 469 ALA 469 489 489 ALA ALA D . n +C 1 470 ASP 470 490 490 ASP ASP D . n +C 1 471 LYS 471 491 491 LYS LYS D . n +C 1 472 GLY 472 492 492 GLY GLY D . n +C 1 473 ALA 473 493 493 ALA ALA D . n +C 1 474 PRO 474 494 494 PRO PRO D . n +C 1 475 TYR 475 495 495 TYR TYR D . n +C 1 476 VAL 476 496 496 VAL VAL D . n +C 1 477 ASP 477 497 497 ASP ASP D . n +C 1 478 VAL 478 498 498 VAL VAL D . n +C 1 479 ILE 479 499 499 ILE ILE D . n +C 1 480 CYS 480 500 500 CYS CYS D . n +C 1 481 LEU 481 501 501 LEU LEU D . n +C 1 482 ASN 482 502 502 ASN ASN D . n +C 1 483 SER 483 503 503 SER SER D . n +C 1 484 TYR 484 504 504 TYR TYR D . n +C 1 485 TYR 485 505 505 TYR TYR D . n +C 1 486 SER 486 506 506 SER SER D . n +C 1 487 TRP 487 507 507 TRP TRP D . n +C 1 488 TYR 488 508 508 TYR TYR D . n +C 1 489 HIS 489 509 509 HIS HIS D . n +C 1 490 ASP 490 510 510 ASP ASP D . n +C 1 491 TYR 491 511 511 TYR TYR D . n +C 1 492 GLY 492 512 512 GLY GLY D . n +C 1 493 HIS 493 513 513 HIS HIS D . n +C 1 494 LEU 494 514 514 LEU LEU D . n +C 1 495 GLU 495 515 515 GLU GLU D . n +C 1 496 LEU 496 516 516 LEU LEU D . n +C 1 497 ILE 497 517 517 ILE ILE D . n +C 1 498 GLN 498 518 518 GLN GLN D . n +C 1 499 LEU 499 519 519 LEU LEU D . n +C 1 500 GLN 500 520 520 GLN GLN D . n +C 1 501 LEU 501 521 521 LEU LEU D . n +C 1 502 ALA 502 522 522 ALA ALA D . n +C 1 503 THR 503 523 523 THR THR D . n +C 1 504 GLN 504 524 524 GLN GLN D . n +C 1 505 PHE 505 525 525 PHE PHE D . n +C 1 506 GLU 506 526 526 GLU GLU D . n +C 1 507 ASN 507 527 527 ASN ASN D . n +C 1 508 TRP 508 528 528 TRP TRP D . n +C 1 509 TYR 509 529 529 TYR TYR D . n +C 1 510 LYS 510 530 530 LYS LYS D . n +C 1 511 LYS 511 531 531 LYS LYS D . n +C 1 512 TYR 512 532 532 TYR TYR D . n +C 1 513 GLN 513 533 533 GLN GLN D . n +C 1 514 LYS 514 534 534 LYS LYS D . n +C 1 515 PRO 515 535 535 PRO PRO D . n +C 1 516 ILE 516 536 536 ILE ILE D . n +C 1 517 ILE 517 537 537 ILE ILE D . n +C 1 518 GLN 518 538 538 GLN GLN D . n +C 1 519 SER 519 539 539 SER SER D . n +C 1 520 GLU 520 540 540 GLU GLU D . n +C 1 521 TYR 521 541 541 TYR TYR D . n +C 1 522 GLY 522 542 542 GLY GLY D . n +C 1 523 ALA 523 543 543 ALA ALA D . n +C 1 524 GLU 524 544 544 GLU GLU D . n +C 1 525 THR 525 545 545 THR THR D . n +C 1 526 ILE 526 546 546 ILE ILE D . n +C 1 527 ALA 527 547 547 ALA ALA D . n +C 1 528 GLY 528 548 548 GLY GLY D . n +C 1 529 PHE 529 549 549 PHE PHE D . n +C 1 530 HIS 530 550 550 HIS HIS D . n +C 1 531 GLN 531 551 551 GLN GLN D . n +C 1 532 ASP 532 552 552 ASP ASP D . n +C 1 533 PRO 533 553 553 PRO PRO D . n +C 1 534 PRO 534 554 554 PRO PRO D . n +C 1 535 LEU 535 555 555 LEU LEU D . n +C 1 536 MET 536 556 556 MET MET D . n +C 1 537 PHE 537 557 557 PHE PHE D . n +C 1 538 THR 538 558 558 THR THR D . n +C 1 539 GLU 539 559 559 GLU GLU D . n +C 1 540 GLU 540 560 560 GLU GLU D . n +C 1 541 TYR 541 561 561 TYR TYR D . n +C 1 542 GLN 542 562 562 GLN GLN D . n +C 1 543 LYS 543 563 563 LYS LYS D . n +C 1 544 SER 544 564 564 SER SER D . n +C 1 545 LEU 545 565 565 LEU LEU D . n +C 1 546 LEU 546 566 566 LEU LEU D . n +C 1 547 GLU 547 567 567 GLU GLU D . n +C 1 548 GLN 548 568 568 GLN GLN D . n +C 1 549 TYR 549 569 569 TYR TYR D . n +C 1 550 HIS 550 570 570 HIS HIS D . n +C 1 551 LEU 551 571 571 LEU LEU D . n +C 1 552 GLY 552 572 572 GLY GLY D . n +C 1 553 LEU 553 573 573 LEU LEU D . n +C 1 554 ASP 554 574 574 ASP ASP D . n +C 1 555 GLN 555 575 575 GLN GLN D . n +C 1 556 LYS 556 576 576 LYS LYS D . n +C 1 557 ARG 557 577 577 ARG ARG D . n +C 1 558 ARG 558 578 578 ARG ARG D . n +C 1 559 LYS 559 579 579 LYS LYS D . n +C 1 560 TYR 560 580 580 TYR TYR D . n +C 1 561 VAL 561 581 581 VAL VAL D . n +C 1 562 VAL 562 582 582 VAL VAL D . n +C 1 563 GLY 563 583 583 GLY GLY D . n +C 1 564 GLU 564 584 584 GLU GLU D . n +C 1 565 LEU 565 585 585 LEU LEU D . n +C 1 566 ILE 566 586 586 ILE ILE D . n +C 1 567 TRP 567 587 587 TRP TRP D . n +C 1 568 ASN 568 588 588 ASN ASN D . n +C 1 569 PHE 569 589 589 PHE PHE D . n +C 1 570 ALA 570 590 590 ALA ALA D . n +C 1 571 ASP 571 591 591 ASP ASP D . n +C 1 572 PHE 572 592 592 PHE PHE D . n +C 1 573 MET 573 593 593 MET MET D . n +C 1 574 THR 574 594 594 THR THR D . n +C 1 575 GLU 575 595 595 GLU GLU D . n +C 1 576 GLN 576 596 596 GLN GLN D . n +C 1 577 SER 577 597 597 SER SER D . n +C 1 578 PRO 578 598 598 PRO PRO D . n +C 1 579 THR 579 599 599 THR THR D . n +C 1 580 ARG 580 600 600 ARG ARG D . n +C 1 581 VAL 581 601 601 VAL VAL D . n +C 1 582 LEU 582 602 602 LEU LEU D . n +C 1 583 GLY 583 603 603 GLY GLY D . n +C 1 584 ASN 584 604 604 ASN ASN D . n +C 1 585 LYS 585 605 605 LYS LYS D . n +C 1 586 LYS 586 606 606 LYS LYS D . n +C 1 587 GLY 587 607 607 GLY GLY D . n +C 1 588 ILE 588 608 608 ILE ILE D . n +C 1 589 PHE 589 609 609 PHE PHE D . n +C 1 590 THR 590 610 610 THR THR D . n +C 1 591 ARG 591 611 611 ARG ARG D . n +C 1 592 GLN 592 612 612 GLN GLN D . n +C 1 593 ARG 593 613 613 ARG ARG D . n +C 1 594 GLN 594 614 614 GLN GLN D . n +C 1 595 PRO 595 615 615 PRO PRO D . n +C 1 596 LYS 596 616 616 LYS LYS D . n +C 1 597 SER 597 617 617 SER SER D . n +C 1 598 ALA 598 618 618 ALA ALA D . n +C 1 599 ALA 599 619 619 ALA ALA D . n +C 1 600 PHE 600 620 620 PHE PHE D . n +C 1 601 LEU 601 621 621 LEU LEU D . n +C 1 602 LEU 602 622 622 LEU LEU D . n +C 1 603 ARG 603 623 623 ARG ARG D . n +C 1 604 GLU 604 624 624 GLU GLU D . n +C 1 605 ARG 605 625 625 ARG ARG D . n +C 1 606 TYR 606 626 626 TYR TYR D . n +C 1 607 TRP 607 627 627 TRP TRP D . n +C 1 608 LYS 608 628 628 LYS LYS D . n +C 1 609 ILE 609 629 629 ILE ILE D . n +C 1 610 ALA 610 630 630 ALA ALA D . n +C 1 611 ASN 611 631 631 ASN ASN D . n +C 1 612 GLU 612 632 632 GLU GLU D . n +C 1 613 THR 613 633 633 THR THR D . n +D 1 1 LEU 1 21 ? ? ? E . n +D 1 2 GLY 2 22 ? ? ? E . n +D 1 3 LEU 3 23 23 LEU LEU E . n +D 1 4 GLN 4 24 24 GLN GLN E . n +D 1 5 GLY 5 25 25 GLY GLY E . n +D 1 6 GLY 6 26 26 GLY GLY E . n +D 1 7 MET 7 27 27 MET MET E . n +D 1 8 LEU 8 28 28 LEU LEU E . n +D 1 9 TYR 9 29 29 TYR TYR E . n +D 1 10 PRO 10 30 30 PRO PRO E . n +D 1 11 GLN 11 31 31 GLN GLN E . n +D 1 12 GLU 12 32 32 GLU GLU E . n +D 1 13 SER 13 33 33 SER SER E . n +D 1 14 PRO 14 34 34 PRO PRO E . n +D 1 15 SER 15 35 35 SER SER E . n +D 1 16 ARG 16 36 36 ARG ARG E . n +D 1 17 GLU 17 37 37 GLU GLU E . n +D 1 18 CYS 18 38 38 CYS CYS E . n +D 1 19 LYS 19 39 39 LYS LYS E . n +D 1 20 GLU 20 40 40 GLU GLU E . n +D 1 21 LEU 21 41 41 LEU LEU E . n +D 1 22 ASP 22 42 42 ASP ASP E . n +D 1 23 GLY 23 43 43 GLY GLY E . n +D 1 24 LEU 24 44 44 LEU LEU E . n +D 1 25 TRP 25 45 45 TRP TRP E . n +D 1 26 SER 26 46 46 SER SER E . n +D 1 27 PHE 27 47 47 PHE PHE E . n +D 1 28 ARG 28 48 48 ARG ARG E . n +D 1 29 ALA 29 49 49 ALA ALA E . n +D 1 30 ASP 30 50 50 ASP ASP E . n +D 1 31 PHE 31 51 51 PHE PHE E . n +D 1 32 SER 32 52 52 SER SER E . n +D 1 33 ASP 33 53 53 ASP ASP E . n +D 1 34 ASN 34 54 54 ASN ASN E . n +D 1 35 ARG 35 55 55 ARG ARG E . n +D 1 36 ARG 36 56 56 ARG ARG E . n +D 1 37 ARG 37 57 57 ARG ARG E . n +D 1 38 GLY 38 58 58 GLY GLY E . n +D 1 39 PHE 39 59 59 PHE PHE E . n +D 1 40 GLU 40 60 60 GLU GLU E . n +D 1 41 GLU 41 61 61 GLU GLU E . n +D 1 42 GLN 42 62 62 GLN GLN E . n +D 1 43 TRP 43 63 63 TRP TRP E . n +D 1 44 TYR 44 64 64 TYR TYR E . n +D 1 45 ARG 45 65 65 ARG ARG E . n +D 1 46 ARG 46 66 66 ARG ARG E . n +D 1 47 PRO 47 67 67 PRO PRO E . n +D 1 48 LEU 48 68 68 LEU LEU E . n +D 1 49 TRP 49 69 69 TRP TRP E . n +D 1 50 GLU 50 70 70 GLU GLU E . n +D 1 51 SER 51 71 71 SER SER E . n +D 1 52 GLY 52 72 72 GLY GLY E . n +D 1 53 PRO 53 73 73 PRO PRO E . n +D 1 54 THR 54 74 74 THR THR E . n +D 1 55 VAL 55 75 75 VAL VAL E . n +D 1 56 ASP 56 76 76 ASP ASP E . n +D 1 57 MET 57 77 77 MET MET E . n +D 1 58 PRO 58 78 78 PRO PRO E . n +D 1 59 VAL 59 79 79 VAL VAL E . n +D 1 60 PRO 60 80 80 PRO PRO E . n +D 1 61 SER 61 81 81 SER SER E . n +D 1 62 SER 62 82 82 SER SER E . n +D 1 63 PHE 63 83 83 PHE PHE E . n +D 1 64 ASN 64 84 84 ASN ASN E . n +D 1 65 ASP 65 85 85 ASP ASP E . n +D 1 66 ILE 66 86 86 ILE ILE E . n +D 1 67 SER 67 87 87 SER SER E . n +D 1 68 GLN 68 88 88 GLN GLN E . n +D 1 69 ASP 69 89 89 ASP ASP E . n +D 1 70 TRP 70 90 90 TRP TRP E . n +D 1 71 ARG 71 91 91 ARG ARG E . n +D 1 72 LEU 72 92 92 LEU LEU E . n +D 1 73 ARG 73 93 93 ARG ARG E . n +D 1 74 HIS 74 94 94 HIS HIS E . n +D 1 75 PHE 75 95 95 PHE PHE E . n +D 1 76 VAL 76 96 96 VAL VAL E . n +D 1 77 GLY 77 97 97 GLY GLY E . n +D 1 78 TRP 78 98 98 TRP TRP E . n +D 1 79 VAL 79 99 99 VAL VAL E . n +D 1 80 TRP 80 100 100 TRP TRP E . n +D 1 81 TYR 81 101 101 TYR TYR E . n +D 1 82 GLU 82 102 102 GLU GLU E . n +D 1 83 ARG 83 103 103 ARG ARG E . n +D 1 84 GLU 84 104 104 GLU GLU E . n +D 1 85 VAL 85 105 105 VAL VAL E . n +D 1 86 ILE 86 106 106 ILE ILE E . n +D 1 87 LEU 87 107 107 LEU LEU E . n +D 1 88 PRO 88 108 108 PRO PRO E . n +D 1 89 GLU 89 109 109 GLU GLU E . n +D 1 90 ARG 90 110 110 ARG ARG E . n +D 1 91 TRP 91 111 111 TRP TRP E . n +D 1 92 THR 92 112 112 THR THR E . n +D 1 93 GLN 93 113 113 GLN GLN E . n +D 1 94 ASP 94 114 114 ASP ASP E . n +D 1 95 LEU 95 115 115 LEU LEU E . n +D 1 96 ARG 96 116 116 ARG ARG E . n +D 1 97 THR 97 117 117 THR THR E . n +D 1 98 ARG 98 118 118 ARG ARG E . n +D 1 99 VAL 99 119 119 VAL VAL E . n +D 1 100 VAL 100 120 120 VAL VAL E . n +D 1 101 LEU 101 121 121 LEU LEU E . n +D 1 102 ARG 102 122 122 ARG ARG E . n +D 1 103 ILE 103 123 123 ILE ILE E . n +D 1 104 GLY 104 124 124 GLY GLY E . n +D 1 105 SER 105 125 125 SER SER E . n +D 1 106 ALA 106 126 126 ALA ALA E . n +D 1 107 HIS 107 127 127 HIS HIS E . n +D 1 108 SER 108 128 128 SER SER E . n +D 1 109 TYR 109 129 129 TYR TYR E . n +D 1 110 ALA 110 130 130 ALA ALA E . n +D 1 111 ILE 111 131 131 ILE ILE E . n +D 1 112 VAL 112 132 132 VAL VAL E . n +D 1 113 TRP 113 133 133 TRP TRP E . n +D 1 114 VAL 114 134 134 VAL VAL E . n +D 1 115 ASN 115 135 135 ASN ASN E . n +D 1 116 GLY 116 136 136 GLY GLY E . n +D 1 117 VAL 117 137 137 VAL VAL E . n +D 1 118 ASP 118 138 138 ASP ASP E . n +D 1 119 THR 119 139 139 THR THR E . n +D 1 120 LEU 120 140 140 LEU LEU E . n +D 1 121 GLU 121 141 141 GLU GLU E . n +D 1 122 HIS 122 142 142 HIS HIS E . n +D 1 123 GLU 123 143 143 GLU GLU E . n +D 1 124 GLY 124 144 144 GLY GLY E . n +D 1 125 GLY 125 145 145 GLY GLY E . n +D 1 126 TYR 126 146 146 TYR TYR E . n +D 1 127 LEU 127 147 147 LEU LEU E . n +D 1 128 PRO 128 148 148 PRO PRO E . n +D 1 129 PHE 129 149 149 PHE PHE E . n +D 1 130 GLU 130 150 150 GLU GLU E . n +D 1 131 ALA 131 151 151 ALA ALA E . n +D 1 132 ASP 132 152 152 ASP ASP E . n +D 1 133 ILE 133 153 153 ILE ILE E . n +D 1 134 SER 134 154 154 SER SER E . n +D 1 135 ASN 135 155 155 ASN ASN E . n +D 1 136 LEU 136 156 156 LEU LEU E . n +D 1 137 VAL 137 157 157 VAL VAL E . n +D 1 138 GLN 138 158 158 GLN GLN E . n +D 1 139 VAL 139 159 159 VAL VAL E . n +D 1 140 GLY 140 160 ? ? ? E . n +D 1 141 PRO 141 161 ? ? ? E . n +D 1 142 LEU 142 162 ? ? ? E . n +D 1 143 PRO 143 163 ? ? ? E . n +D 1 144 SER 144 164 164 SER SER E . n +D 1 145 ARG 145 165 165 ARG ALA E . n +D 1 146 LEU 146 166 166 LEU LEU E . n +D 1 147 ARG 147 167 167 ARG ARG E . n +D 1 148 ILE 148 168 168 ILE ILE E . n +D 1 149 THR 149 169 169 THR THR E . n +D 1 150 ILE 150 170 170 ILE ILE E . n +D 1 151 ALA 151 171 171 ALA ALA E . n +D 1 152 ILE 152 172 172 ILE ILE E . n +D 1 153 ASN 153 173 173 ASN ASN E . n +D 1 154 ASN 154 174 174 ASN ASN E . n +D 1 155 THR 155 175 175 THR THR E . n +D 1 156 LEU 156 176 176 LEU LEU E . n +D 1 157 THR 157 177 177 THR THR E . n +D 1 158 PRO 158 178 178 PRO PRO E . n +D 1 159 THR 159 179 179 THR THR E . n +D 1 160 THR 160 180 180 THR THR E . n +D 1 161 LEU 161 181 181 LEU LEU E . n +D 1 162 PRO 162 182 182 PRO PRO E . n +D 1 163 PRO 163 183 183 PRO PRO E . n +D 1 164 GLY 164 184 184 GLY GLY E . n +D 1 165 THR 165 185 185 THR THR E . n +D 1 166 ILE 166 186 186 ILE ILE E . n +D 1 167 GLN 167 187 187 GLN GLN E . n +D 1 168 TYR 168 188 188 TYR TYR E . n +D 1 169 LEU 169 189 189 LEU LEU E . n +D 1 170 THR 170 190 190 THR THR E . n +D 1 171 ASP 171 191 191 ASP ASP E . n +D 1 172 THR 172 192 192 THR THR E . n +D 1 173 SER 173 193 193 SER SER E . n +D 1 174 LYS 174 194 194 LYS LYS E . n +D 1 175 TYR 175 195 195 TYR TYR E . n +D 1 176 PRO 176 196 196 PRO PRO E . n +D 1 177 LYS 177 197 197 LYS LYS E . n +D 1 178 GLY 178 198 198 GLY GLY E . n +D 1 179 TYR 179 199 199 TYR TYR E . n +D 1 180 PHE 180 200 200 PHE PHE E . n +D 1 181 VAL 181 201 201 VAL VAL E . n +D 1 182 GLN 182 202 202 GLN GLN E . n +D 1 183 ASN 183 203 203 ASN ASN E . n +D 1 184 THR 184 204 204 THR THR E . n +D 1 185 TYR 185 205 205 TYR TYR E . n +D 1 186 PHE 186 206 206 PHE PHE E . n +D 1 187 ASP 187 207 207 ASP ASP E . n +D 1 188 PHE 188 208 208 PHE PHE E . n +D 1 189 PHE 189 209 209 PHE PHE E . n +D 1 190 ASN 190 210 210 ASN ASN E . n +D 1 191 TYR 191 211 211 TYR TYR E . n +D 1 192 ALA 192 212 212 ALA ALA E . n +D 1 193 GLY 193 213 213 GLY GLY E . n +D 1 194 LEU 194 214 214 LEU LEU E . n +D 1 195 GLN 195 215 215 GLN GLN E . n +D 1 196 ARG 196 216 216 ARG ARG E . n +D 1 197 SER 197 217 217 SER SER E . n +D 1 198 VAL 198 218 218 VAL VAL E . n +D 1 199 LEU 199 219 219 LEU LEU E . n +D 1 200 LEU 200 220 220 LEU LEU E . n +D 1 201 TYR 201 221 221 TYR TYR E . n +D 1 202 THR 202 222 222 THR THR E . n +D 1 203 THR 203 223 223 THR THR E . n +D 1 204 PRO 204 224 224 PRO PRO E . n +D 1 205 THR 205 225 225 THR THR E . n +D 1 206 THR 206 226 226 THR THR E . n +D 1 207 TYR 207 227 227 TYR TYR E . n +D 1 208 ILE 208 228 228 ILE ILE E . n +D 1 209 ASP 209 229 229 ASP ASP E . n +D 1 210 ASP 210 230 230 ASP ASP E . n +D 1 211 ILE 211 231 231 ILE ILE E . n +D 1 212 THR 212 232 232 THR THR E . n +D 1 213 VAL 213 233 233 VAL VAL E . n +D 1 214 THR 214 234 234 THR THR E . n +D 1 215 THR 215 235 235 THR THR E . n +D 1 216 SER 216 236 236 SER SER E . n +D 1 217 VAL 217 237 237 VAL VAL E . n +D 1 218 GLU 218 238 238 GLU GLU E . n +D 1 219 GLN 219 239 239 GLN GLN E . n +D 1 220 ASP 220 240 240 ASP ASP E . n +D 1 221 SER 221 241 241 SER SER E . n +D 1 222 GLY 222 242 242 GLY GLY E . n +D 1 223 LEU 223 243 243 LEU LEU E . n +D 1 224 VAL 224 244 244 VAL VAL E . n +D 1 225 ASN 225 245 245 ASN ASN E . n +D 1 226 TYR 226 246 246 TYR TYR E . n +D 1 227 GLN 227 247 247 GLN GLN E . n +D 1 228 ILE 228 248 248 ILE ILE E . n +D 1 229 SER 229 249 249 SER SER E . n +D 1 230 VAL 230 250 250 VAL VAL E . n +D 1 231 LYS 231 251 251 LYS LYS E . n +D 1 232 GLY 232 252 252 GLY GLY E . n +D 1 233 SER 233 253 253 SER SER E . n +D 1 234 ASN 234 254 254 ASN ASN E . n +D 1 235 LEU 235 255 255 LEU LEU E . n +D 1 236 PHE 236 256 256 PHE PHE E . n +D 1 237 LYS 237 257 257 LYS LYS E . n +D 1 238 LEU 238 258 258 LEU LEU E . n +D 1 239 GLU 239 259 259 GLU GLU E . n +D 1 240 VAL 240 260 260 VAL VAL E . n +D 1 241 ARG 241 261 261 ARG ARG E . n +D 1 242 LEU 242 262 262 LEU LEU E . n +D 1 243 LEU 243 263 263 LEU LEU E . n +D 1 244 ASP 244 264 264 ASP ASP E . n +D 1 245 ALA 245 265 265 ALA ALA E . n +D 1 246 GLU 246 266 266 GLU GLU E . n +D 1 247 ASN 247 267 267 ASN ASN E . n +D 1 248 LYS 248 268 268 LYS LYS E . n +D 1 249 VAL 249 269 269 VAL VAL E . n +D 1 250 VAL 250 270 270 VAL VAL E . n +D 1 251 ALA 251 271 271 ALA ALA E . n +D 1 252 ASN 252 272 272 ASN ASN E . n +D 1 253 GLY 253 273 273 GLY GLY E . n +D 1 254 THR 254 274 274 THR THR E . n +D 1 255 GLY 255 275 275 GLY GLY E . n +D 1 256 THR 256 276 276 THR THR E . n +D 1 257 GLN 257 277 277 GLN GLN E . n +D 1 258 GLY 258 278 278 GLY GLY E . n +D 1 259 GLN 259 279 279 GLN GLN E . n +D 1 260 LEU 260 280 280 LEU LEU E . n +D 1 261 LYS 261 281 281 LYS LYS E . n +D 1 262 VAL 262 282 282 VAL VAL E . n +D 1 263 PRO 263 283 283 PRO PRO E . n +D 1 264 GLY 264 284 284 GLY GLY E . n +D 1 265 VAL 265 285 285 VAL VAL E . n +D 1 266 SER 266 286 286 SER SER E . n +D 1 267 LEU 267 287 287 LEU LEU E . n +D 1 268 TRP 268 288 288 TRP TRP E . n +D 1 269 TRP 269 289 289 TRP TRP E . n +D 1 270 PRO 270 290 290 PRO PRO E . n +D 1 271 TYR 271 291 291 TYR TYR E . n +D 1 272 LEU 272 292 292 LEU LEU E . n +D 1 273 MET 273 293 293 MET MET E . n +D 1 274 HIS 274 294 294 HIS HIS E . n +D 1 275 GLU 275 295 295 GLU GLU E . n +D 1 276 ARG 276 296 296 ARG ARG E . n +D 1 277 PRO 277 297 297 PRO PRO E . n +D 1 278 ALA 278 298 298 ALA ALA E . n +D 1 279 TYR 279 299 299 TYR TYR E . n +D 1 280 LEU 280 300 300 LEU LEU E . n +D 1 281 TYR 281 301 301 TYR TYR E . n +D 1 282 SER 282 302 302 SER SER E . n +D 1 283 LEU 283 303 303 LEU LEU E . n +D 1 284 GLU 284 304 304 GLU GLU E . n +D 1 285 VAL 285 305 305 VAL VAL E . n +D 1 286 GLN 286 306 306 GLN GLN E . n +D 1 287 LEU 287 307 307 LEU LEU E . n +D 1 288 THR 288 308 308 THR THR E . n +D 1 289 ALA 289 309 309 ALA ALA E . n +D 1 290 GLN 290 310 310 GLN GLN E . n +D 1 291 THR 291 311 311 THR THR E . n +D 1 292 SER 292 312 312 SER SER E . n +D 1 293 LEU 293 313 313 LEU LEU E . n +D 1 294 GLY 294 314 314 GLY GLY E . n +D 1 295 PRO 295 315 315 PRO PRO E . n +D 1 296 VAL 296 316 316 VAL VAL E . n +D 1 297 SER 297 317 317 SER SER E . n +D 1 298 ASP 298 318 318 ASP ASP E . n +D 1 299 PHE 299 319 319 PHE PHE E . n +D 1 300 TYR 300 320 320 TYR TYR E . n +D 1 301 THR 301 321 321 THR THR E . n +D 1 302 LEU 302 322 322 LEU LEU E . n +D 1 303 PRO 303 323 323 PRO PRO E . n +D 1 304 VAL 304 324 324 VAL VAL E . n +D 1 305 GLY 305 325 325 GLY GLY E . n +D 1 306 ILE 306 326 326 ILE ILE E . n +D 1 307 ARG 307 327 327 ARG ARG E . n +D 1 308 THR 308 328 328 THR THR E . n +D 1 309 VAL 309 329 329 VAL VAL E . n +D 1 310 ALA 310 330 330 ALA ALA E . n +D 1 311 VAL 311 331 331 VAL VAL E . n +D 1 312 THR 312 332 332 THR THR E . n +D 1 313 LYS 313 333 333 LYS LYS E . n +D 1 314 SER 314 334 334 SER SER E . n +D 1 315 GLN 315 335 335 GLN GLN E . n +D 1 316 PHE 316 336 336 PHE PHE E . n +D 1 317 LEU 317 337 337 LEU LEU E . n +D 1 318 ILE 318 338 338 ILE ILE E . n +D 1 319 ASN 319 339 339 ASN ASN E . n +D 1 320 GLY 320 340 340 GLY GLY E . n +D 1 321 LYS 321 341 341 LYS LYS E . n +D 1 322 PRO 322 342 342 PRO PRO E . n +D 1 323 PHE 323 343 343 PHE PHE E . n +D 1 324 TYR 324 344 344 TYR TYR E . n +D 1 325 PHE 325 345 345 PHE PHE E . n +D 1 326 HIS 326 346 346 HIS HIS E . n +D 1 327 GLY 327 347 347 GLY GLY E . n +D 1 328 VAL 328 348 348 VAL VAL E . n +D 1 329 ASN 329 349 349 ASN ASN E . n +D 1 330 LYS 330 350 350 LYS LYS E . n +D 1 331 HIS 331 351 351 HIS HIS E . n +D 1 332 GLU 332 352 352 GLU GLU E . n +D 1 333 ASP 333 353 353 ASP ASP E . n +D 1 334 ALA 334 354 354 ALA ALA E . n +D 1 335 ASP 335 355 355 ASP ASP E . n +D 1 336 ILE 336 356 356 ILE ILE E . n +D 1 337 ARG 337 357 357 ARG ARG E . n +D 1 338 GLY 338 358 358 GLY GLY E . n +D 1 339 LYS 339 359 359 LYS LYS E . n +D 1 340 GLY 340 360 360 GLY GLY E . n +D 1 341 PHE 341 361 361 PHE PHE E . n +D 1 342 ASP 342 362 362 ASP ASP E . n +D 1 343 TRP 343 363 363 TRP TRP E . n +D 1 344 PRO 344 364 364 PRO PRO E . n +D 1 345 LEU 345 365 365 LEU LEU E . n +D 1 346 LEU 346 366 366 LEU LEU E . n +D 1 347 VAL 347 367 367 VAL VAL E . n +D 1 348 LYS 348 368 368 LYS LYS E . n +D 1 349 ASP 349 369 369 ASP ASP E . n +D 1 350 PHE 350 370 370 PHE PHE E . n +D 1 351 ASN 351 371 371 ASN ASN E . n +D 1 352 LEU 352 372 372 LEU LEU E . n +D 1 353 LEU 353 373 373 LEU LEU E . n +D 1 354 ARG 354 374 374 ARG ARG E . n +D 1 355 TRP 355 375 375 TRP TRP E . n +D 1 356 LEU 356 376 376 LEU LEU E . n +D 1 357 GLY 357 377 377 GLY GLY E . n +D 1 358 ALA 358 378 378 ALA ALA E . n +D 1 359 ASN 359 379 379 ASN ASN E . n +D 1 360 ALA 360 380 380 ALA ALA E . n +D 1 361 PHE 361 381 381 PHE PHE E . n +D 1 362 ARG 362 382 382 ARG ARG E . n +D 1 363 THR 363 383 383 THR THR E . n +D 1 364 SER 364 384 384 SER SER E . n +D 1 365 HIS 365 385 385 HIS HIS E . n +D 1 366 TYR 366 386 386 TYR TYR E . n +D 1 367 PRO 367 387 387 PRO PRO E . n +D 1 368 TYR 368 388 388 TYR TYR E . n +D 1 369 ALA 369 389 389 ALA ALA E . n +D 1 370 GLU 370 390 390 GLU GLU E . n +D 1 371 GLU 371 391 391 GLU GLU E . n +D 1 372 VAL 372 392 392 VAL VAL E . n +D 1 373 MET 373 393 393 MET MET E . n +D 1 374 GLN 374 394 394 GLN GLN E . n +D 1 375 MET 375 395 395 MET MET E . n +D 1 376 CYS 376 396 396 CYS CYS E . n +D 1 377 ASP 377 397 397 ASP ASP E . n +D 1 378 ARG 378 398 398 ARG ARG E . n +D 1 379 TYR 379 399 399 TYR TYR E . n +D 1 380 GLY 380 400 400 GLY GLY E . n +D 1 381 ILE 381 401 401 ILE ILE E . n +D 1 382 VAL 382 402 402 VAL VAL E . n +D 1 383 VAL 383 403 403 VAL VAL E . n +D 1 384 ILE 384 404 404 ILE ILE E . n +D 1 385 ASP 385 405 405 ASP ASP E . n +D 1 386 GLU 386 406 406 GLU GLU E . n +D 1 387 CYS 387 407 407 CYS CYS E . n +D 1 388 PRO 388 408 408 PRO PRO E . n +D 1 389 GLY 389 409 409 GLY GLY E . n +D 1 390 VAL 390 410 410 VAL VAL E . n +D 1 391 GLY 391 411 411 GLY GLY E . n +D 1 392 LEU 392 412 412 LEU LEU E . n +D 1 393 ALA 393 413 413 ALA ALA E . n +D 1 394 LEU 394 414 414 LEU LEU E . n +D 1 395 PRO 395 415 415 PRO PRO E . n +D 1 396 GLN 396 416 416 GLN GLN E . n +D 1 397 PHE 397 417 417 PHE PHE E . n +D 1 398 PHE 398 418 418 PHE PHE E . n +D 1 399 ASN 399 419 419 ASN ASN E . n +D 1 400 ASN 400 420 420 ASN ASN E . n +D 1 401 VAL 401 421 421 VAL VAL E . n +D 1 402 SER 402 422 422 SER SER E . n +D 1 403 LEU 403 423 423 LEU LEU E . n +D 1 404 HIS 404 424 424 HIS HIS E . n +D 1 405 HIS 405 425 425 HIS HIS E . n +D 1 406 HIS 406 426 426 HIS HIS E . n +D 1 407 MET 407 427 427 MET MET E . n +D 1 408 GLN 408 428 428 GLN GLN E . n +D 1 409 VAL 409 429 429 VAL VAL E . n +D 1 410 MET 410 430 430 MET MET E . n +D 1 411 GLU 411 431 431 GLU GLU E . n +D 1 412 GLU 412 432 432 GLU GLU E . n +D 1 413 VAL 413 433 433 VAL VAL E . n +D 1 414 VAL 414 434 434 VAL VAL E . n +D 1 415 ARG 415 435 435 ARG ARG E . n +D 1 416 ARG 416 436 436 ARG ARG E . n +D 1 417 ASP 417 437 437 ASP ASP E . n +D 1 418 LYS 418 438 438 LYS LYS E . n +D 1 419 ASN 419 439 439 ASN ASN E . n +D 1 420 HIS 420 440 440 HIS HIS E . n +D 1 421 PRO 421 441 441 PRO PRO E . n +D 1 422 ALA 422 442 442 ALA ALA E . n +D 1 423 VAL 423 443 443 VAL VAL E . n +D 1 424 VAL 424 444 444 VAL VAL E . n +D 1 425 MET 425 445 445 MET MET E . n +D 1 426 TRP 426 446 446 TRP TRP E . n +D 1 427 SER 427 447 447 SER SER E . n +D 1 428 VAL 428 448 448 VAL VAL E . n +D 1 429 ALA 429 449 449 ALA ALA E . n +D 1 430 ASN 430 450 450 ASN ASN E . n +D 1 431 GLU 431 451 451 GLU GLU E . n +D 1 432 PRO 432 452 452 PRO PRO E . n +D 1 433 ALA 433 453 453 ALA ALA E . n +D 1 434 SER 434 454 454 SER SER E . n +D 1 435 HIS 435 455 455 HIS HIS E . n +D 1 436 LEU 436 456 456 LEU LEU E . n +D 1 437 GLU 437 457 457 GLU GLU E . n +D 1 438 SER 438 458 458 SER SER E . n +D 1 439 ALA 439 459 459 ALA ALA E . n +D 1 440 GLY 440 460 460 GLY GLY E . n +D 1 441 TYR 441 461 461 TYR TYR E . n +D 1 442 TYR 442 462 462 TYR TYR E . n +D 1 443 LEU 443 463 463 LEU LEU E . n +D 1 444 LYS 444 464 464 LYS LYS E . n +D 1 445 MET 445 465 465 MET MET E . n +D 1 446 VAL 446 466 466 VAL VAL E . n +D 1 447 ILE 447 467 467 ILE ILE E . n +D 1 448 ALA 448 468 468 ALA ALA E . n +D 1 449 HIS 449 469 469 HIS HIS E . n +D 1 450 THR 450 470 470 THR THR E . n +D 1 451 LYS 451 471 471 LYS LYS E . n +D 1 452 SER 452 472 472 SER SER E . n +D 1 453 LEU 453 473 473 LEU LEU E . n +D 1 454 ASP 454 474 474 ASP ASP E . n +D 1 455 PRO 455 475 475 PRO PRO E . n +D 1 456 SER 456 476 476 SER SER E . n +D 1 457 ARG 457 477 477 ARG ARG E . n +D 1 458 PRO 458 478 478 PRO PRO E . n +D 1 459 VAL 459 479 479 VAL VAL E . n +D 1 460 THR 460 480 480 THR THR E . n +D 1 461 PHE 461 481 481 PHE PHE E . n +D 1 462 VAL 462 482 482 VAL VAL E . n +D 1 463 SER 463 483 483 SER SER E . n +D 1 464 ASN 464 484 484 ASN ASN E . n +D 1 465 SER 465 485 485 SER SER E . n +D 1 466 ASN 466 486 486 ASN ASN E . n +D 1 467 TYR 467 487 487 TYR TYR E . n +D 1 468 ALA 468 488 488 ALA ALA E . n +D 1 469 ALA 469 489 489 ALA ALA E . n +D 1 470 ASP 470 490 490 ASP ASP E . n +D 1 471 LYS 471 491 491 LYS LYS E . n +D 1 472 GLY 472 492 492 GLY GLY E . n +D 1 473 ALA 473 493 493 ALA ALA E . n +D 1 474 PRO 474 494 494 PRO PRO E . n +D 1 475 TYR 475 495 495 TYR TYR E . n +D 1 476 VAL 476 496 496 VAL VAL E . n +D 1 477 ASP 477 497 497 ASP ASP E . n +D 1 478 VAL 478 498 498 VAL VAL E . n +D 1 479 ILE 479 499 499 ILE ILE E . n +D 1 480 CYS 480 500 500 CYS CYS E . n +D 1 481 LEU 481 501 501 LEU LEU E . n +D 1 482 ASN 482 502 502 ASN ASN E . n +D 1 483 SER 483 503 503 SER SER E . n +D 1 484 TYR 484 504 504 TYR TYR E . n +D 1 485 TYR 485 505 505 TYR TYR E . n +D 1 486 SER 486 506 506 SER SER E . n +D 1 487 TRP 487 507 507 TRP TRP E . n +D 1 488 TYR 488 508 508 TYR TYR E . n +D 1 489 HIS 489 509 509 HIS HIS E . n +D 1 490 ASP 490 510 510 ASP ASP E . n +D 1 491 TYR 491 511 511 TYR TYR E . n +D 1 492 GLY 492 512 512 GLY GLY E . n +D 1 493 HIS 493 513 513 HIS HIS E . n +D 1 494 LEU 494 514 514 LEU LEU E . n +D 1 495 GLU 495 515 515 GLU GLU E . n +D 1 496 LEU 496 516 516 LEU LEU E . n +D 1 497 ILE 497 517 517 ILE ILE E . n +D 1 498 GLN 498 518 518 GLN GLN E . n +D 1 499 LEU 499 519 519 LEU LEU E . n +D 1 500 GLN 500 520 520 GLN GLN E . n +D 1 501 LEU 501 521 521 LEU LEU E . n +D 1 502 ALA 502 522 522 ALA ALA E . n +D 1 503 THR 503 523 523 THR THR E . n +D 1 504 GLN 504 524 524 GLN GLN E . n +D 1 505 PHE 505 525 525 PHE PHE E . n +D 1 506 GLU 506 526 526 GLU GLU E . n +D 1 507 ASN 507 527 527 ASN ASN E . n +D 1 508 TRP 508 528 528 TRP TRP E . n +D 1 509 TYR 509 529 529 TYR TYR E . n +D 1 510 LYS 510 530 530 LYS LYS E . n +D 1 511 LYS 511 531 531 LYS LYS E . n +D 1 512 TYR 512 532 532 TYR TYR E . n +D 1 513 GLN 513 533 533 GLN GLN E . n +D 1 514 LYS 514 534 534 LYS LYS E . n +D 1 515 PRO 515 535 535 PRO PRO E . n +D 1 516 ILE 516 536 536 ILE ILE E . n +D 1 517 ILE 517 537 537 ILE ILE E . n +D 1 518 GLN 518 538 538 GLN GLN E . n +D 1 519 SER 519 539 539 SER SER E . n +D 1 520 GLU 520 540 540 GLU GLU E . n +D 1 521 TYR 521 541 541 TYR TYR E . n +D 1 522 GLY 522 542 542 GLY GLY E . n +D 1 523 ALA 523 543 543 ALA ALA E . n +D 1 524 GLU 524 544 544 GLU GLU E . n +D 1 525 THR 525 545 545 THR THR E . n +D 1 526 ILE 526 546 546 ILE ILE E . n +D 1 527 ALA 527 547 547 ALA ALA E . n +D 1 528 GLY 528 548 548 GLY GLY E . n +D 1 529 PHE 529 549 549 PHE PHE E . n +D 1 530 HIS 530 550 550 HIS HIS E . n +D 1 531 GLN 531 551 551 GLN GLN E . n +D 1 532 ASP 532 552 552 ASP ASP E . n +D 1 533 PRO 533 553 553 PRO PRO E . n +D 1 534 PRO 534 554 554 PRO PRO E . n +D 1 535 LEU 535 555 555 LEU LEU E . n +D 1 536 MET 536 556 556 MET MET E . n +D 1 537 PHE 537 557 557 PHE PHE E . n +D 1 538 THR 538 558 558 THR THR E . n +D 1 539 GLU 539 559 559 GLU GLU E . n +D 1 540 GLU 540 560 560 GLU GLU E . n +D 1 541 TYR 541 561 561 TYR TYR E . n +D 1 542 GLN 542 562 562 GLN GLN E . n +D 1 543 LYS 543 563 563 LYS LYS E . n +D 1 544 SER 544 564 564 SER SER E . n +D 1 545 LEU 545 565 565 LEU LEU E . n +D 1 546 LEU 546 566 566 LEU LEU E . n +D 1 547 GLU 547 567 567 GLU GLU E . n +D 1 548 GLN 548 568 568 GLN GLN E . n +D 1 549 TYR 549 569 569 TYR TYR E . n +D 1 550 HIS 550 570 570 HIS HIS E . n +D 1 551 LEU 551 571 571 LEU LEU E . n +D 1 552 GLY 552 572 572 GLY GLY E . n +D 1 553 LEU 553 573 573 LEU LEU E . n +D 1 554 ASP 554 574 574 ASP ASP E . n +D 1 555 GLN 555 575 575 GLN GLN E . n +D 1 556 LYS 556 576 576 LYS LYS E . n +D 1 557 ARG 557 577 577 ARG ARG E . n +D 1 558 ARG 558 578 578 ARG ARG E . n +D 1 559 LYS 559 579 579 LYS LYS E . n +D 1 560 TYR 560 580 580 TYR TYR E . n +D 1 561 VAL 561 581 581 VAL VAL E . n +D 1 562 VAL 562 582 582 VAL VAL E . n +D 1 563 GLY 563 583 583 GLY GLY E . n +D 1 564 GLU 564 584 584 GLU GLU E . n +D 1 565 LEU 565 585 585 LEU LEU E . n +D 1 566 ILE 566 586 586 ILE ILE E . n +D 1 567 TRP 567 587 587 TRP TRP E . n +D 1 568 ASN 568 588 588 ASN ASN E . n +D 1 569 PHE 569 589 589 PHE PHE E . n +D 1 570 ALA 570 590 590 ALA ALA E . n +D 1 571 ASP 571 591 591 ASP ASP E . n +D 1 572 PHE 572 592 592 PHE PHE E . n +D 1 573 MET 573 593 593 MET MET E . n +D 1 574 THR 574 594 594 THR THR E . n +D 1 575 GLU 575 595 595 GLU GLU E . n +D 1 576 GLN 576 596 596 GLN GLN E . n +D 1 577 SER 577 597 597 SER SER E . n +D 1 578 PRO 578 598 598 PRO PRO E . n +D 1 579 THR 579 599 599 THR THR E . n +D 1 580 ARG 580 600 600 ARG ARG E . n +D 1 581 VAL 581 601 601 VAL VAL E . n +D 1 582 LEU 582 602 602 LEU LEU E . n +D 1 583 GLY 583 603 603 GLY GLY E . n +D 1 584 ASN 584 604 604 ASN ASN E . n +D 1 585 LYS 585 605 605 LYS LYS E . n +D 1 586 LYS 586 606 606 LYS LYS E . n +D 1 587 GLY 587 607 607 GLY GLY E . n +D 1 588 ILE 588 608 608 ILE ILE E . n +D 1 589 PHE 589 609 609 PHE PHE E . n +D 1 590 THR 590 610 610 THR THR E . n +D 1 591 ARG 591 611 611 ARG ARG E . n +D 1 592 GLN 592 612 612 GLN GLN E . n +D 1 593 ARG 593 613 613 ARG ARG E . n +D 1 594 GLN 594 614 614 GLN GLN E . n +D 1 595 PRO 595 615 615 PRO PRO E . n +D 1 596 LYS 596 616 616 LYS LYS E . n +D 1 597 SER 597 617 617 SER SER E . n +D 1 598 ALA 598 618 618 ALA ALA E . n +D 1 599 ALA 599 619 619 ALA ALA E . n +D 1 600 PHE 600 620 620 PHE PHE E . n +D 1 601 LEU 601 621 621 LEU LEU E . n +D 1 602 LEU 602 622 622 LEU LEU E . n +D 1 603 ARG 603 623 623 ARG ARG E . n +D 1 604 GLU 604 624 624 GLU GLU E . n +D 1 605 ARG 605 625 625 ARG ARG E . n +D 1 606 TYR 606 626 626 TYR TYR E . n +D 1 607 TRP 607 627 627 TRP TRP E . n +D 1 608 LYS 608 628 628 LYS LYS E . n +D 1 609 ILE 609 629 629 ILE ILE E . n +D 1 610 ALA 610 630 630 ALA ALA E . n +D 1 611 ASN 611 631 631 ASN ASN E . n +D 1 612 GLU 612 632 632 GLU GLU E . n +D 1 613 THR 613 633 ? ? ? E . n +# +loop_ +_pdbx_branch_scheme.asym_id +_pdbx_branch_scheme.entity_id +_pdbx_branch_scheme.mon_id +_pdbx_branch_scheme.num +_pdbx_branch_scheme.pdb_asym_id +_pdbx_branch_scheme.pdb_mon_id +_pdbx_branch_scheme.pdb_seq_num +_pdbx_branch_scheme.auth_asym_id +_pdbx_branch_scheme.auth_mon_id +_pdbx_branch_scheme.auth_seq_num +_pdbx_branch_scheme.hetero +E 2 NAG 1 C NAG 1 A NAG 651 n +E 2 NAG 2 C NAG 2 A NAG 652 n +E 2 BMA 3 C BMA 3 A BMA 653 n +E 2 MAN 4 C MAN 4 A MAN 654 n +E 2 MAN 5 C MAN 5 A MAN 655 n +E 2 MAN 6 C MAN 6 A MAN 656 n +E 2 MAN 7 C MAN 7 A MAN 659 n +E 2 MAN 8 C MAN 8 A MAN 660 n +E 2 MAN 9 C MAN 9 A MAN 657 n +E 2 GUP 10 C GUP 10 A MAN 658 n +F 3 NAG 1 F NAG 1 B NAG 651 n +F 3 NAG 2 F NAG 2 B NAG 652 n +F 3 BMA 3 F BMA 3 B BMA 653 n +F 3 MAN 4 F MAN 4 B MAN 654 n +F 3 MAN 5 F MAN 5 B MAN 655 n +F 3 MAN 6 F MAN 6 B MAN 660 n +F 3 MAN 7 F MAN 7 B MAN 658 n +F 3 MAN 8 F MAN 8 B MAN 659 n +F 3 MAN 9 F MAN 9 B MAN 656 n +F 3 BMA 10 F BMA 10 B MAN 657 n +G 4 NAG 1 G NAG 1 D NAG 651 n +G 4 NAG 2 G NAG 2 D NAG 652 n +G 4 BMA 3 G BMA 3 D BMA 653 n +G 4 MAN 4 G MAN 4 D MAN 654 n +G 4 MAN 5 G MAN 5 D MAN 655 n +G 4 MAN 6 G MAN 6 D MAN 660 n +G 4 MAN 7 G MAN 7 D MAN 658 n +G 4 MAN 8 G MAN 8 D MAN 659 n +G 4 MAN 9 G MAN 9 D MAN 656 n +G 4 MAN 10 G MAN 10 D MAN 657 n +H 5 NAG 1 H NAG 1 E NAG 651 n +H 5 NAG 2 H NAG 2 E NAG 652 n +H 5 BMA 3 H BMA 3 E BMA 653 n +H 5 MAN 4 H MAN 4 E MAN 658 n +H 5 MAN 5 H MAN 5 E MAN 659 n +H 5 MAN 6 H MAN 6 E MAN 660 n +H 5 MAN 7 H MAN 7 E MAN 654 n +H 5 MAN 8 H MAN 8 E MAN 656 n +H 5 MAN 9 H MAN 9 E MAN 657 n +H 5 MAN 10 H MAN 10 E MAN 655 n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +I 6 NAG 1 650 650 NAG NAG A . +J 7 MRD 1 1 1 MRD MPD A . +K 6 NAG 1 650 650 NAG NAG B . +L 8 MPD 1 2 2 MPD MPD B . +M 6 NAG 1 650 650 NAG NAG D . +N 7 MRD 1 3 3 MRD MPD D . +O 6 NAG 1 650 650 NAG NAG E . +P 9 BMA 1 661 661 BMA MAN E . +Q 8 MPD 1 4 4 MPD MPD E . +R 7 MRD 1 5 5 MRD MPD E . +S 10 HOH 1 3 3 HOH HOH A . +S 10 HOH 2 5 5 HOH HOH A . +S 10 HOH 3 14 14 HOH HOH A . +S 10 HOH 4 16 16 HOH HOH A . +S 10 HOH 5 17 17 HOH HOH A . +S 10 HOH 6 634 23 HOH HOH A . +S 10 HOH 7 635 24 HOH HOH A . +S 10 HOH 8 636 636 HOH HOH A . +S 10 HOH 9 637 26 HOH HOH A . +S 10 HOH 10 638 638 HOH HOH A . +S 10 HOH 11 639 27 HOH HOH A . +S 10 HOH 12 640 640 HOH HOH A . +S 10 HOH 13 641 37 HOH HOH A . +S 10 HOH 14 642 642 HOH HOH A . +S 10 HOH 15 643 39 HOH HOH A . +S 10 HOH 16 644 45 HOH HOH A . +S 10 HOH 17 645 645 HOH HOH A . +S 10 HOH 18 646 59 HOH HOH A . +S 10 HOH 19 647 60 HOH HOH A . +S 10 HOH 20 648 648 HOH HOH A . +S 10 HOH 21 649 61 HOH HOH A . +S 10 HOH 22 661 67 HOH HOH A . +S 10 HOH 23 662 69 HOH HOH A . +S 10 HOH 24 663 77 HOH HOH A . +S 10 HOH 25 664 79 HOH HOH A . +S 10 HOH 26 665 82 HOH HOH A . +S 10 HOH 27 666 84 HOH HOH A . +S 10 HOH 28 667 102 HOH HOH A . +S 10 HOH 29 668 103 HOH HOH A . +S 10 HOH 30 669 105 HOH HOH A . +S 10 HOH 31 670 107 HOH HOH A . +S 10 HOH 32 671 108 HOH HOH A . +S 10 HOH 33 672 111 HOH HOH A . +S 10 HOH 34 673 113 HOH HOH A . +S 10 HOH 35 674 114 HOH HOH A . +S 10 HOH 36 675 675 HOH HOH A . +S 10 HOH 37 676 117 HOH HOH A . +S 10 HOH 38 677 123 HOH HOH A . +S 10 HOH 39 678 127 HOH HOH A . +S 10 HOH 40 679 679 HOH HOH A . +S 10 HOH 41 680 131 HOH HOH A . +S 10 HOH 42 681 136 HOH HOH A . +S 10 HOH 43 682 140 HOH HOH A . +S 10 HOH 44 683 145 HOH HOH A . +S 10 HOH 45 684 154 HOH HOH A . +S 10 HOH 46 685 685 HOH HOH A . +S 10 HOH 47 686 686 HOH HOH A . +S 10 HOH 48 687 687 HOH HOH A . +S 10 HOH 49 688 165 HOH HOH A . +S 10 HOH 50 689 166 HOH HOH A . +S 10 HOH 51 690 690 HOH HOH A . +S 10 HOH 52 691 169 HOH HOH A . +S 10 HOH 53 692 173 HOH HOH A . +S 10 HOH 54 693 175 HOH HOH A . +S 10 HOH 55 694 180 HOH HOH A . +S 10 HOH 56 695 695 HOH HOH A . +S 10 HOH 57 696 187 HOH HOH A . +S 10 HOH 58 697 697 HOH HOH A . +S 10 HOH 59 698 191 HOH HOH A . +S 10 HOH 60 699 192 HOH HOH A . +S 10 HOH 61 700 193 HOH HOH A . +S 10 HOH 62 701 197 HOH HOH A . +S 10 HOH 63 702 202 HOH HOH A . +S 10 HOH 64 703 204 HOH HOH A . +S 10 HOH 65 704 704 HOH HOH A . +S 10 HOH 66 705 214 HOH HOH A . +S 10 HOH 67 706 222 HOH HOH A . +S 10 HOH 68 707 225 HOH HOH A . +S 10 HOH 69 708 708 HOH HOH A . +S 10 HOH 70 709 234 HOH HOH A . +S 10 HOH 71 710 235 HOH HOH A . +S 10 HOH 72 711 240 HOH HOH A . +S 10 HOH 73 712 712 HOH HOH A . +S 10 HOH 74 713 241 HOH HOH A . +S 10 HOH 75 714 714 HOH HOH A . +S 10 HOH 76 715 242 HOH HOH A . +S 10 HOH 77 716 716 HOH HOH A . +S 10 HOH 78 717 247 HOH HOH A . +S 10 HOH 79 718 248 HOH HOH A . +S 10 HOH 80 719 251 HOH HOH A . +S 10 HOH 81 720 260 HOH HOH A . +S 10 HOH 82 721 274 HOH HOH A . +S 10 HOH 83 722 281 HOH HOH A . +S 10 HOH 84 723 290 HOH HOH A . +S 10 HOH 85 724 293 HOH HOH A . +S 10 HOH 86 725 297 HOH HOH A . +S 10 HOH 87 726 300 HOH HOH A . +S 10 HOH 88 727 727 HOH HOH A . +S 10 HOH 89 728 308 HOH HOH A . +S 10 HOH 90 729 729 HOH HOH A . +S 10 HOH 91 730 309 HOH HOH A . +S 10 HOH 92 731 312 HOH HOH A . +S 10 HOH 93 732 316 HOH HOH A . +S 10 HOH 94 733 317 HOH HOH A . +S 10 HOH 95 734 318 HOH HOH A . +S 10 HOH 96 735 324 HOH HOH A . +S 10 HOH 97 736 326 HOH HOH A . +S 10 HOH 98 737 329 HOH HOH A . +S 10 HOH 99 738 333 HOH HOH A . +S 10 HOH 100 739 347 HOH HOH A . +S 10 HOH 101 740 348 HOH HOH A . +S 10 HOH 102 741 351 HOH HOH A . +S 10 HOH 103 742 352 HOH HOH A . +S 10 HOH 104 743 356 HOH HOH A . +S 10 HOH 105 744 358 HOH HOH A . +S 10 HOH 106 745 363 HOH HOH A . +S 10 HOH 107 746 371 HOH HOH A . +S 10 HOH 108 747 372 HOH HOH A . +S 10 HOH 109 748 381 HOH HOH A . +S 10 HOH 110 749 382 HOH HOH A . +S 10 HOH 111 750 386 HOH HOH A . +S 10 HOH 112 751 389 HOH HOH A . +S 10 HOH 113 752 390 HOH HOH A . +S 10 HOH 114 753 393 HOH HOH A . +S 10 HOH 115 754 754 HOH HOH A . +S 10 HOH 116 755 395 HOH HOH A . +S 10 HOH 117 756 403 HOH HOH A . +S 10 HOH 118 757 405 HOH HOH A . +S 10 HOH 119 758 407 HOH HOH A . +S 10 HOH 120 759 414 HOH HOH A . +S 10 HOH 121 760 416 HOH HOH A . +S 10 HOH 122 761 417 HOH HOH A . +S 10 HOH 123 762 419 HOH HOH A . +S 10 HOH 124 763 430 HOH HOH A . +S 10 HOH 125 764 432 HOH HOH A . +S 10 HOH 126 765 434 HOH HOH A . +S 10 HOH 127 766 766 HOH HOH A . +S 10 HOH 128 767 436 HOH HOH A . +S 10 HOH 129 768 438 HOH HOH A . +S 10 HOH 130 769 442 HOH HOH A . +S 10 HOH 131 770 443 HOH HOH A . +S 10 HOH 132 771 448 HOH HOH A . +S 10 HOH 133 772 462 HOH HOH A . +S 10 HOH 134 773 464 HOH HOH A . +S 10 HOH 135 774 468 HOH HOH A . +S 10 HOH 136 775 472 HOH HOH A . +S 10 HOH 137 776 477 HOH HOH A . +S 10 HOH 138 777 480 HOH HOH A . +S 10 HOH 139 778 778 HOH HOH A . +S 10 HOH 140 779 489 HOH HOH A . +S 10 HOH 141 780 780 HOH HOH A . +S 10 HOH 142 781 498 HOH HOH A . +S 10 HOH 143 782 782 HOH HOH A . +S 10 HOH 144 783 509 HOH HOH A . +S 10 HOH 145 784 514 HOH HOH A . +S 10 HOH 146 785 516 HOH HOH A . +S 10 HOH 147 786 517 HOH HOH A . +S 10 HOH 148 787 518 HOH HOH A . +S 10 HOH 149 788 531 HOH HOH A . +S 10 HOH 150 789 532 HOH HOH A . +S 10 HOH 151 790 790 HOH HOH A . +S 10 HOH 152 791 791 HOH HOH A . +S 10 HOH 153 792 533 HOH HOH A . +S 10 HOH 154 793 540 HOH HOH A . +S 10 HOH 155 794 541 HOH HOH A . +S 10 HOH 156 795 795 HOH HOH A . +S 10 HOH 157 796 543 HOH HOH A . +S 10 HOH 158 797 545 HOH HOH A . +S 10 HOH 159 798 798 HOH HOH A . +S 10 HOH 160 799 799 HOH HOH A . +S 10 HOH 161 800 551 HOH HOH A . +S 10 HOH 162 801 801 HOH HOH A . +S 10 HOH 163 802 553 HOH HOH A . +S 10 HOH 164 803 556 HOH HOH A . +S 10 HOH 165 804 558 HOH HOH A . +S 10 HOH 166 805 559 HOH HOH A . +S 10 HOH 167 806 566 HOH HOH A . +S 10 HOH 168 807 569 HOH HOH A . +S 10 HOH 169 808 572 HOH HOH A . +S 10 HOH 170 809 573 HOH HOH A . +S 10 HOH 171 810 576 HOH HOH A . +S 10 HOH 172 811 577 HOH HOH A . +S 10 HOH 173 812 812 HOH HOH A . +S 10 HOH 174 813 578 HOH HOH A . +S 10 HOH 175 814 581 HOH HOH A . +S 10 HOH 176 815 815 HOH HOH A . +S 10 HOH 177 816 589 HOH HOH A . +S 10 HOH 178 817 595 HOH HOH A . +S 10 HOH 179 818 818 HOH HOH A . +S 10 HOH 180 819 819 HOH HOH A . +S 10 HOH 181 820 597 HOH HOH A . +S 10 HOH 182 821 602 HOH HOH A . +S 10 HOH 183 822 603 HOH HOH A . +S 10 HOH 184 823 609 HOH HOH A . +S 10 HOH 185 824 613 HOH HOH A . +S 10 HOH 186 825 825 HOH HOH A . +S 10 HOH 187 826 826 HOH HOH A . +S 10 HOH 188 827 619 HOH HOH A . +S 10 HOH 189 828 627 HOH HOH A . +S 10 HOH 190 829 632 HOH HOH A . +S 10 HOH 191 830 654 HOH HOH A . +S 10 HOH 192 831 655 HOH HOH A . +S 10 HOH 193 832 832 HOH HOH A . +S 10 HOH 194 840 840 HOH HOH A . +S 10 HOH 195 842 842 HOH HOH A . +S 10 HOH 196 847 847 HOH HOH A . +S 10 HOH 197 850 850 HOH HOH A . +S 10 HOH 198 852 852 HOH HOH A . +S 10 HOH 199 856 856 HOH HOH A . +S 10 HOH 200 876 876 HOH HOH A . +S 10 HOH 201 879 879 HOH HOH A . +S 10 HOH 202 881 881 HOH HOH A . +S 10 HOH 203 883 883 HOH HOH A . +S 10 HOH 204 893 893 HOH HOH A . +S 10 HOH 205 895 895 HOH HOH A . +S 10 HOH 206 909 909 HOH HOH A . +S 10 HOH 207 911 911 HOH HOH A . +S 10 HOH 208 913 913 HOH HOH A . +S 10 HOH 209 914 914 HOH HOH A . +S 10 HOH 210 915 915 HOH HOH A . +S 10 HOH 211 916 916 HOH HOH A . +S 10 HOH 212 917 917 HOH HOH A . +S 10 HOH 213 919 919 HOH HOH A . +S 10 HOH 214 924 924 HOH HOH A . +S 10 HOH 215 925 925 HOH HOH A . +S 10 HOH 216 931 931 HOH HOH A . +S 10 HOH 217 934 934 HOH HOH A . +S 10 HOH 218 937 937 HOH HOH A . +S 10 HOH 219 939 939 HOH HOH A . +S 10 HOH 220 940 940 HOH HOH A . +S 10 HOH 221 943 943 HOH HOH A . +S 10 HOH 222 947 947 HOH HOH A . +S 10 HOH 223 950 950 HOH HOH A . +S 10 HOH 224 956 956 HOH HOH A . +S 10 HOH 225 960 960 HOH HOH A . +S 10 HOH 226 968 968 HOH HOH A . +S 10 HOH 227 974 974 HOH HOH A . +S 10 HOH 228 979 979 HOH HOH A . +S 10 HOH 229 980 980 HOH HOH A . +S 10 HOH 230 985 985 HOH HOH A . +S 10 HOH 231 990 990 HOH HOH A . +S 10 HOH 232 992 992 HOH HOH A . +S 10 HOH 233 993 993 HOH HOH A . +S 10 HOH 234 1007 1007 HOH HOH A . +S 10 HOH 235 1011 1011 HOH HOH A . +S 10 HOH 236 1017 1017 HOH HOH A . +S 10 HOH 237 1025 1025 HOH HOH A . +S 10 HOH 238 1027 1027 HOH HOH A . +S 10 HOH 239 1030 1030 HOH HOH A . +S 10 HOH 240 1032 1032 HOH HOH A . +S 10 HOH 241 1036 1036 HOH HOH A . +S 10 HOH 242 1044 1044 HOH HOH A . +S 10 HOH 243 1048 1048 HOH HOH A . +S 10 HOH 244 1055 1055 HOH HOH A . +S 10 HOH 245 1059 1059 HOH HOH A . +S 10 HOH 246 1064 1064 HOH HOH A . +S 10 HOH 247 1066 1066 HOH HOH A . +S 10 HOH 248 1067 1067 HOH HOH A . +S 10 HOH 249 1068 1068 HOH HOH A . +S 10 HOH 250 1074 1074 HOH HOH A . +S 10 HOH 251 1090 1090 HOH HOH A . +S 10 HOH 252 1091 1091 HOH HOH A . +S 10 HOH 253 1092 1092 HOH HOH A . +S 10 HOH 254 1095 1095 HOH HOH A . +S 10 HOH 255 1096 1096 HOH HOH A . +S 10 HOH 256 1097 1097 HOH HOH A . +S 10 HOH 257 1098 1098 HOH HOH A . +S 10 HOH 258 1100 1100 HOH HOH A . +S 10 HOH 259 1101 1101 HOH HOH A . +S 10 HOH 260 1108 1108 HOH HOH A . +S 10 HOH 261 1109 1109 HOH HOH A . +S 10 HOH 262 1113 1113 HOH HOH A . +S 10 HOH 263 1119 1119 HOH HOH A . +S 10 HOH 264 1121 1121 HOH HOH A . +S 10 HOH 265 1126 1126 HOH HOH A . +S 10 HOH 266 1130 1130 HOH HOH A . +S 10 HOH 267 1141 1141 HOH HOH A . +S 10 HOH 268 1148 1148 HOH HOH A . +S 10 HOH 269 1150 1150 HOH HOH A . +S 10 HOH 270 1159 1159 HOH HOH A . +S 10 HOH 271 1162 1162 HOH HOH A . +S 10 HOH 272 1163 1163 HOH HOH A . +S 10 HOH 273 1172 1172 HOH HOH A . +S 10 HOH 274 1174 1174 HOH HOH A . +S 10 HOH 275 1180 1180 HOH HOH A . +S 10 HOH 276 1182 1182 HOH HOH A . +S 10 HOH 277 1184 1184 HOH HOH A . +S 10 HOH 278 1186 1186 HOH HOH A . +S 10 HOH 279 1189 1189 HOH HOH A . +S 10 HOH 280 1199 1199 HOH HOH A . +S 10 HOH 281 1200 1200 HOH HOH A . +S 10 HOH 282 1201 1201 HOH HOH A . +S 10 HOH 283 1202 1202 HOH HOH A . +S 10 HOH 284 1204 1204 HOH HOH A . +S 10 HOH 285 1209 1209 HOH HOH A . +S 10 HOH 286 1214 1214 HOH HOH A . +S 10 HOH 287 1219 1219 HOH HOH A . +S 10 HOH 288 1220 1220 HOH HOH A . +S 10 HOH 289 1228 1228 HOH HOH A . +S 10 HOH 290 1231 1231 HOH HOH A . +S 10 HOH 291 1241 1241 HOH HOH A . +S 10 HOH 292 1250 1250 HOH HOH A . +S 10 HOH 293 1256 1256 HOH HOH A . +S 10 HOH 294 1260 1260 HOH HOH A . +S 10 HOH 295 1262 1262 HOH HOH A . +S 10 HOH 296 1264 1264 HOH HOH A . +S 10 HOH 297 1266 1266 HOH HOH A . +S 10 HOH 298 1270 1270 HOH HOH A . +S 10 HOH 299 1275 1275 HOH HOH A . +S 10 HOH 300 1276 1276 HOH HOH A . +S 10 HOH 301 1281 1281 HOH HOH A . +S 10 HOH 302 1288 1288 HOH HOH A . +S 10 HOH 303 1290 1290 HOH HOH A . +S 10 HOH 304 1293 1293 HOH HOH A . +S 10 HOH 305 1295 1295 HOH HOH A . +S 10 HOH 306 1296 1296 HOH HOH A . +S 10 HOH 307 1305 1305 HOH HOH A . +S 10 HOH 308 1307 1307 HOH HOH A . +S 10 HOH 309 1311 1311 HOH HOH A . +S 10 HOH 310 1313 1313 HOH HOH A . +S 10 HOH 311 1314 1314 HOH HOH A . +S 10 HOH 312 1345 1345 HOH HOH A . +S 10 HOH 313 1348 1348 HOH HOH A . +S 10 HOH 314 1351 1351 HOH HOH A . +S 10 HOH 315 1354 1354 HOH HOH A . +S 10 HOH 316 1358 1358 HOH HOH A . +S 10 HOH 317 1364 1364 HOH HOH A . +S 10 HOH 318 1372 1372 HOH HOH A . +S 10 HOH 319 1374 1374 HOH HOH A . +S 10 HOH 320 1375 1375 HOH HOH A . +S 10 HOH 321 1376 1376 HOH HOH A . +S 10 HOH 322 1377 1377 HOH HOH A . +S 10 HOH 323 1386 1386 HOH HOH A . +S 10 HOH 324 1389 1389 HOH HOH A . +S 10 HOH 325 1396 1396 HOH HOH A . +S 10 HOH 326 1400 1400 HOH HOH A . +S 10 HOH 327 1405 1405 HOH HOH A . +S 10 HOH 328 1416 1416 HOH HOH A . +S 10 HOH 329 1420 1420 HOH HOH A . +S 10 HOH 330 1427 1427 HOH HOH A . +S 10 HOH 331 1432 1432 HOH HOH A . +S 10 HOH 332 1434 1434 HOH HOH A . +S 10 HOH 333 1438 1438 HOH HOH A . +S 10 HOH 334 1439 1439 HOH HOH A . +S 10 HOH 335 1442 1442 HOH HOH A . +S 10 HOH 336 1445 1445 HOH HOH A . +S 10 HOH 337 1446 1446 HOH HOH A . +S 10 HOH 338 1451 1451 HOH HOH A . +S 10 HOH 339 1453 1453 HOH HOH A . +S 10 HOH 340 1458 1458 HOH HOH A . +S 10 HOH 341 1460 1460 HOH HOH A . +S 10 HOH 342 1463 1463 HOH HOH A . +S 10 HOH 343 1466 1466 HOH HOH A . +S 10 HOH 344 1470 1470 HOH HOH A . +S 10 HOH 345 1477 1477 HOH HOH A . +S 10 HOH 346 1481 1481 HOH HOH A . +S 10 HOH 347 1483 1483 HOH HOH A . +S 10 HOH 348 1486 1486 HOH HOH A . +S 10 HOH 349 1490 1490 HOH HOH A . +S 10 HOH 350 1500 1500 HOH HOH A . +S 10 HOH 351 1501 1501 HOH HOH A . +S 10 HOH 352 1502 1502 HOH HOH A . +S 10 HOH 353 1514 1514 HOH HOH A . +S 10 HOH 354 1519 1519 HOH HOH A . +S 10 HOH 355 1520 1520 HOH HOH A . +S 10 HOH 356 1533 1533 HOH HOH A . +S 10 HOH 357 1534 1534 HOH HOH A . +S 10 HOH 358 1535 1535 HOH HOH A . +S 10 HOH 359 1543 1543 HOH HOH A . +S 10 HOH 360 1553 1553 HOH HOH A . +S 10 HOH 361 1554 1554 HOH HOH A . +S 10 HOH 362 1555 1555 HOH HOH A . +S 10 HOH 363 1557 1557 HOH HOH A . +S 10 HOH 364 1560 1560 HOH HOH A . +S 10 HOH 365 1562 1562 HOH HOH A . +S 10 HOH 366 1565 1565 HOH HOH A . +S 10 HOH 367 1568 1568 HOH HOH A . +S 10 HOH 368 1582 1582 HOH HOH A . +S 10 HOH 369 1583 1583 HOH HOH A . +S 10 HOH 370 1597 1597 HOH HOH A . +S 10 HOH 371 1599 1599 HOH HOH A . +S 10 HOH 372 1606 1606 HOH HOH A . +S 10 HOH 373 1611 1611 HOH HOH A . +S 10 HOH 374 1614 1614 HOH HOH A . +S 10 HOH 375 1619 1619 HOH HOH A . +S 10 HOH 376 1620 1620 HOH HOH A . +S 10 HOH 377 1627 1627 HOH HOH A . +S 10 HOH 378 1640 1640 HOH HOH A . +S 10 HOH 379 1649 1649 HOH HOH A . +S 10 HOH 380 1650 1650 HOH HOH A . +S 10 HOH 381 1654 1654 HOH HOH A . +S 10 HOH 382 1658 1658 HOH HOH A . +S 10 HOH 383 1660 1660 HOH HOH A . +S 10 HOH 384 1663 1663 HOH HOH A . +S 10 HOH 385 1665 1665 HOH HOH A . +S 10 HOH 386 1667 1667 HOH HOH A . +S 10 HOH 387 1670 1670 HOH HOH A . +S 10 HOH 388 1677 1677 HOH HOH A . +S 10 HOH 389 1678 1678 HOH HOH A . +S 10 HOH 390 1685 1685 HOH HOH A . +S 10 HOH 391 1686 1686 HOH HOH A . +S 10 HOH 392 1687 1687 HOH HOH A . +S 10 HOH 393 1689 1689 HOH HOH A . +S 10 HOH 394 1693 1693 HOH HOH A . +S 10 HOH 395 1694 1694 HOH HOH A . +S 10 HOH 396 1695 1695 HOH HOH A . +S 10 HOH 397 1701 1701 HOH HOH A . +S 10 HOH 398 1703 1703 HOH HOH A . +S 10 HOH 399 1713 1713 HOH HOH A . +S 10 HOH 400 1718 1718 HOH HOH A . +S 10 HOH 401 1719 1719 HOH HOH A . +S 10 HOH 402 1727 1727 HOH HOH A . +S 10 HOH 403 1731 1731 HOH HOH A . +S 10 HOH 404 1734 1734 HOH HOH A . +S 10 HOH 405 1736 1736 HOH HOH A . +S 10 HOH 406 1741 1741 HOH HOH A . +S 10 HOH 407 1742 1742 HOH HOH A . +S 10 HOH 408 1744 1744 HOH HOH A . +S 10 HOH 409 1748 1748 HOH HOH A . +S 10 HOH 410 1753 1753 HOH HOH A . +S 10 HOH 411 1771 1771 HOH HOH A . +S 10 HOH 412 1778 1778 HOH HOH A . +S 10 HOH 413 1780 1780 HOH HOH A . +S 10 HOH 414 1781 1781 HOH HOH A . +S 10 HOH 415 1785 1785 HOH HOH A . +S 10 HOH 416 1787 1787 HOH HOH A . +S 10 HOH 417 1790 1790 HOH HOH A . +S 10 HOH 418 1795 1795 HOH HOH A . +S 10 HOH 419 1796 1796 HOH HOH A . +S 10 HOH 420 1797 1797 HOH HOH A . +S 10 HOH 421 1798 1798 HOH HOH A . +S 10 HOH 422 1801 1801 HOH HOH A . +S 10 HOH 423 1804 1804 HOH HOH A . +S 10 HOH 424 1815 1815 HOH HOH A . +S 10 HOH 425 1817 1817 HOH HOH A . +S 10 HOH 426 1818 1818 HOH HOH A . +S 10 HOH 427 1820 1820 HOH HOH A . +S 10 HOH 428 1822 1822 HOH HOH A . +S 10 HOH 429 1827 1827 HOH HOH A . +S 10 HOH 430 1832 1832 HOH HOH A . +S 10 HOH 431 1836 1836 HOH HOH A . +S 10 HOH 432 1839 1839 HOH HOH A . +S 10 HOH 433 1841 1841 HOH HOH A . +S 10 HOH 434 1844 1844 HOH HOH A . +S 10 HOH 435 1845 1845 HOH HOH A . +S 10 HOH 436 1850 1850 HOH HOH A . +S 10 HOH 437 1853 1853 HOH HOH A . +S 10 HOH 438 1857 1857 HOH HOH A . +S 10 HOH 439 1866 1866 HOH HOH A . +S 10 HOH 440 1867 1867 HOH HOH A . +S 10 HOH 441 1869 1869 HOH HOH A . +S 10 HOH 442 1872 1872 HOH HOH A . +S 10 HOH 443 1875 1875 HOH HOH A . +S 10 HOH 444 1876 1876 HOH HOH A . +S 10 HOH 445 1882 1882 HOH HOH A . +S 10 HOH 446 1884 1884 HOH HOH A . +S 10 HOH 447 1885 1885 HOH HOH A . +S 10 HOH 448 1889 1889 HOH HOH A . +S 10 HOH 449 1890 1890 HOH HOH A . +S 10 HOH 450 1893 1893 HOH HOH A . +S 10 HOH 451 1898 1898 HOH HOH A . +S 10 HOH 452 1899 1899 HOH HOH A . +S 10 HOH 453 1901 1901 HOH HOH A . +S 10 HOH 454 1903 1903 HOH HOH A . +S 10 HOH 455 1907 1907 HOH HOH A . +S 10 HOH 456 1912 1912 HOH HOH A . +S 10 HOH 457 1918 1918 HOH HOH A . +S 10 HOH 458 1919 1919 HOH HOH A . +S 10 HOH 459 1924 1924 HOH HOH A . +S 10 HOH 460 1927 1927 HOH HOH A . +S 10 HOH 461 1929 1929 HOH HOH A . +S 10 HOH 462 1932 1932 HOH HOH A . +S 10 HOH 463 1934 1934 HOH HOH A . +S 10 HOH 464 1938 1938 HOH HOH A . +S 10 HOH 465 1941 1941 HOH HOH A . +S 10 HOH 466 1943 1943 HOH HOH A . +S 10 HOH 467 1944 1944 HOH HOH A . +S 10 HOH 468 1951 1951 HOH HOH A . +S 10 HOH 469 1952 1952 HOH HOH A . +S 10 HOH 470 1962 1962 HOH HOH A . +S 10 HOH 471 1966 1966 HOH HOH A . +S 10 HOH 472 1972 1972 HOH HOH A . +S 10 HOH 473 1978 1978 HOH HOH A . +S 10 HOH 474 1990 1990 HOH HOH A . +S 10 HOH 475 1993 1993 HOH HOH A . +S 10 HOH 476 1997 1997 HOH HOH A . +S 10 HOH 477 2000 2000 HOH HOH A . +S 10 HOH 478 2002 2002 HOH HOH A . +S 10 HOH 479 2009 2009 HOH HOH A . +S 10 HOH 480 2011 2011 HOH HOH A . +S 10 HOH 481 2012 2012 HOH HOH A . +S 10 HOH 482 2014 2014 HOH HOH A . +S 10 HOH 483 2015 2015 HOH HOH A . +S 10 HOH 484 2018 2018 HOH HOH A . +S 10 HOH 485 2023 2023 HOH HOH A . +S 10 HOH 486 2024 2024 HOH HOH A . +S 10 HOH 487 2030 2030 HOH HOH A . +S 10 HOH 488 2032 2032 HOH HOH A . +S 10 HOH 489 2033 2033 HOH HOH A . +S 10 HOH 490 2036 2036 HOH HOH A . +S 10 HOH 491 2043 2043 HOH HOH A . +S 10 HOH 492 2044 2044 HOH HOH A . +S 10 HOH 493 2047 2047 HOH HOH A . +S 10 HOH 494 2049 2049 HOH HOH A . +S 10 HOH 495 2052 2052 HOH HOH A . +S 10 HOH 496 2055 2055 HOH HOH A . +S 10 HOH 497 2071 2071 HOH HOH A . +S 10 HOH 498 2075 2075 HOH HOH A . +S 10 HOH 499 2079 2079 HOH HOH A . +S 10 HOH 500 2081 2081 HOH HOH A . +S 10 HOH 501 2083 2083 HOH HOH A . +S 10 HOH 502 2086 2086 HOH HOH A . +S 10 HOH 503 2098 2098 HOH HOH A . +S 10 HOH 504 2100 2100 HOH HOH A . +S 10 HOH 505 2103 2103 HOH HOH A . +S 10 HOH 506 2112 2112 HOH HOH A . +S 10 HOH 507 2120 2120 HOH HOH A . +S 10 HOH 508 2123 2123 HOH HOH A . +S 10 HOH 509 2125 2125 HOH HOH A . +S 10 HOH 510 2127 2127 HOH HOH A . +S 10 HOH 511 2133 2133 HOH HOH A . +S 10 HOH 512 2144 2144 HOH HOH A . +S 10 HOH 513 2150 2150 HOH HOH A . +S 10 HOH 514 2152 2152 HOH HOH A . +S 10 HOH 515 2156 2156 HOH HOH A . +S 10 HOH 516 2159 2159 HOH HOH A . +S 10 HOH 517 2161 2161 HOH HOH A . +S 10 HOH 518 2162 2162 HOH HOH A . +S 10 HOH 519 2168 2168 HOH HOH A . +S 10 HOH 520 2170 2170 HOH HOH A . +S 10 HOH 521 2172 2172 HOH HOH A . +S 10 HOH 522 2178 2178 HOH HOH A . +S 10 HOH 523 2180 2180 HOH HOH A . +S 10 HOH 524 2182 2182 HOH HOH A . +S 10 HOH 525 2185 2185 HOH HOH A . +S 10 HOH 526 2190 2190 HOH HOH A . +S 10 HOH 527 2191 2191 HOH HOH A . +S 10 HOH 528 2194 2194 HOH HOH A . +S 10 HOH 529 2203 2203 HOH HOH A . +S 10 HOH 530 2204 2204 HOH HOH A . +S 10 HOH 531 2207 2207 HOH HOH A . +S 10 HOH 532 2208 2208 HOH HOH A . +S 10 HOH 533 2210 2210 HOH HOH A . +S 10 HOH 534 2219 2219 HOH HOH A . +S 10 HOH 535 2221 2221 HOH HOH A . +S 10 HOH 536 2226 2226 HOH HOH A . +S 10 HOH 537 2231 2231 HOH HOH A . +S 10 HOH 538 2232 2232 HOH HOH A . +S 10 HOH 539 2238 2238 HOH HOH A . +S 10 HOH 540 2239 2239 HOH HOH A . +S 10 HOH 541 2240 2240 HOH HOH A . +S 10 HOH 542 2242 2242 HOH HOH A . +S 10 HOH 543 2253 2253 HOH HOH A . +S 10 HOH 544 2256 2256 HOH HOH A . +S 10 HOH 545 2263 2263 HOH HOH A . +S 10 HOH 546 2269 2269 HOH HOH A . +S 10 HOH 547 2271 2271 HOH HOH A . +S 10 HOH 548 2272 2272 HOH HOH A . +S 10 HOH 549 2277 2277 HOH HOH A . +S 10 HOH 550 2281 2281 HOH HOH A . +S 10 HOH 551 2283 2283 HOH HOH A . +S 10 HOH 552 2289 2289 HOH HOH A . +S 10 HOH 553 2290 2290 HOH HOH A . +S 10 HOH 554 2296 2296 HOH HOH A . +S 10 HOH 555 2298 2298 HOH HOH A . +S 10 HOH 556 2307 2307 HOH HOH A . +S 10 HOH 557 2317 2317 HOH HOH A . +S 10 HOH 558 2318 2318 HOH HOH A . +S 10 HOH 559 2319 2319 HOH HOH A . +S 10 HOH 560 2323 2323 HOH HOH A . +S 10 HOH 561 2326 2326 HOH HOH A . +S 10 HOH 562 2329 2329 HOH HOH A . +S 10 HOH 563 2334 2334 HOH HOH A . +S 10 HOH 564 2337 2337 HOH HOH A . +S 10 HOH 565 2341 2341 HOH HOH A . +S 10 HOH 566 2343 2343 HOH HOH A . +S 10 HOH 567 2346 2346 HOH HOH A . +S 10 HOH 568 2352 2352 HOH HOH A . +S 10 HOH 569 2357 2357 HOH HOH A . +S 10 HOH 570 2362 2362 HOH HOH A . +S 10 HOH 571 2363 2363 HOH HOH A . +S 10 HOH 572 2365 2365 HOH HOH A . +S 10 HOH 573 2366 2366 HOH HOH A . +S 10 HOH 574 2370 2370 HOH HOH A . +S 10 HOH 575 2377 2377 HOH HOH A . +S 10 HOH 576 2378 2378 HOH HOH A . +S 10 HOH 577 2384 2384 HOH HOH A . +S 10 HOH 578 2389 2389 HOH HOH A . +S 10 HOH 579 2402 2402 HOH HOH A . +S 10 HOH 580 2407 2407 HOH HOH A . +S 10 HOH 581 2409 2409 HOH HOH A . +S 10 HOH 582 2427 2427 HOH HOH A . +S 10 HOH 583 2440 2440 HOH HOH A . +S 10 HOH 584 2443 2443 HOH HOH A . +S 10 HOH 585 2448 2448 HOH HOH A . +S 10 HOH 586 2449 2449 HOH HOH A . +S 10 HOH 587 2450 2450 HOH HOH A . +S 10 HOH 588 2451 2451 HOH HOH A . +S 10 HOH 589 2458 2458 HOH HOH A . +S 10 HOH 590 2462 2462 HOH HOH A . +S 10 HOH 591 2464 2464 HOH HOH A . +S 10 HOH 592 2484 2484 HOH HOH A . +S 10 HOH 593 2492 2492 HOH HOH A . +S 10 HOH 594 2493 2493 HOH HOH A . +S 10 HOH 595 2494 2494 HOH HOH A . +S 10 HOH 596 2495 2495 HOH HOH A . +S 10 HOH 597 2500 2500 HOH HOH A . +S 10 HOH 598 2507 2507 HOH HOH A . +S 10 HOH 599 2510 2510 HOH HOH A . +S 10 HOH 600 2513 2513 HOH HOH A . +S 10 HOH 601 2516 2516 HOH HOH A . +S 10 HOH 602 2521 2521 HOH HOH A . +S 10 HOH 603 2523 2523 HOH HOH A . +S 10 HOH 604 2525 2525 HOH HOH A . +S 10 HOH 605 2526 2526 HOH HOH A . +S 10 HOH 606 2528 2528 HOH HOH A . +S 10 HOH 607 2530 2530 HOH HOH A . +S 10 HOH 608 2532 2532 HOH HOH A . +S 10 HOH 609 2536 2536 HOH HOH A . +S 10 HOH 610 2541 2541 HOH HOH A . +S 10 HOH 611 2544 2544 HOH HOH A . +S 10 HOH 612 2545 2545 HOH HOH A . +S 10 HOH 613 2546 2546 HOH HOH A . +S 10 HOH 614 2547 2547 HOH HOH A . +S 10 HOH 615 2548 2548 HOH HOH A . +S 10 HOH 616 2549 2549 HOH HOH A . +S 10 HOH 617 2550 2550 HOH HOH A . +S 10 HOH 618 2551 2551 HOH HOH A . +S 10 HOH 619 2552 2552 HOH HOH A . +S 10 HOH 620 2553 2553 HOH HOH A . +S 10 HOH 621 2554 2554 HOH HOH A . +S 10 HOH 622 2555 2555 HOH HOH A . +S 10 HOH 623 2556 2556 HOH HOH A . +S 10 HOH 624 2557 2557 HOH HOH A . +S 10 HOH 625 2558 2558 HOH HOH A . +S 10 HOH 626 2559 2559 HOH HOH A . +S 10 HOH 627 2568 2568 HOH HOH A . +S 10 HOH 628 2569 2569 HOH HOH A . +S 10 HOH 629 2570 2570 HOH HOH A . +S 10 HOH 630 2571 2571 HOH HOH A . +S 10 HOH 631 2580 2580 HOH HOH A . +S 10 HOH 632 2581 2581 HOH HOH A . +S 10 HOH 633 2583 2583 HOH HOH A . +S 10 HOH 634 2584 2584 HOH HOH A . +S 10 HOH 635 2585 2585 HOH HOH A . +S 10 HOH 636 2586 2586 HOH HOH A . +S 10 HOH 637 2597 2597 HOH HOH A . +S 10 HOH 638 2598 2598 HOH HOH A . +S 10 HOH 639 2609 2609 HOH HOH A . +S 10 HOH 640 2611 2611 HOH HOH A . +S 10 HOH 641 2615 2615 HOH HOH A . +S 10 HOH 642 2623 2623 HOH HOH A . +S 10 HOH 643 2637 2637 HOH HOH A . +S 10 HOH 644 2641 2641 HOH HOH A . +S 10 HOH 645 2650 2650 HOH HOH A . +S 10 HOH 646 2653 2653 HOH HOH A . +S 10 HOH 647 2654 2654 HOH HOH A . +S 10 HOH 648 2655 2655 HOH HOH A . +S 10 HOH 649 2657 2657 HOH HOH A . +S 10 HOH 650 2658 2658 HOH HOH A . +S 10 HOH 651 2659 2659 HOH HOH A . +S 10 HOH 652 2660 2660 HOH HOH A . +S 10 HOH 653 2665 2665 HOH HOH A . +S 10 HOH 654 2669 2669 HOH HOH A . +S 10 HOH 655 2671 2671 HOH HOH A . +S 10 HOH 656 2672 2672 HOH HOH A . +S 10 HOH 657 2675 2675 HOH HOH A . +S 10 HOH 658 2676 2676 HOH HOH A . +S 10 HOH 659 2678 2678 HOH HOH A . +S 10 HOH 660 2685 2685 HOH HOH A . +S 10 HOH 661 2689 2689 HOH HOH A . +S 10 HOH 662 2699 2699 HOH HOH A . +S 10 HOH 663 2703 2703 HOH HOH A . +S 10 HOH 664 2707 2707 HOH HOH A . +S 10 HOH 665 2710 2710 HOH HOH A . +S 10 HOH 666 2712 2712 HOH HOH A . +S 10 HOH 667 2713 2713 HOH HOH A . +S 10 HOH 668 2716 2716 HOH HOH A . +S 10 HOH 669 2726 2726 HOH HOH A . +S 10 HOH 670 2737 2737 HOH HOH A . +S 10 HOH 671 2738 2738 HOH HOH A . +S 10 HOH 672 2743 2743 HOH HOH A . +S 10 HOH 673 2745 2745 HOH HOH A . +S 10 HOH 674 2752 2752 HOH HOH A . +S 10 HOH 675 2754 2754 HOH HOH A . +S 10 HOH 676 2760 2760 HOH HOH A . +S 10 HOH 677 2761 2761 HOH HOH A . +S 10 HOH 678 2762 2762 HOH HOH A . +S 10 HOH 679 2763 2763 HOH HOH A . +S 10 HOH 680 2766 2766 HOH HOH A . +S 10 HOH 681 2770 2770 HOH HOH A . +S 10 HOH 682 2777 2777 HOH HOH A . +S 10 HOH 683 2785 2785 HOH HOH A . +S 10 HOH 684 2791 2791 HOH HOH A . +S 10 HOH 685 2799 2799 HOH HOH A . +S 10 HOH 686 2800 2800 HOH HOH A . +S 10 HOH 687 2801 2801 HOH HOH A . +S 10 HOH 688 2804 2804 HOH HOH A . +S 10 HOH 689 2806 2806 HOH HOH A . +S 10 HOH 690 2808 2808 HOH HOH A . +S 10 HOH 691 2809 2809 HOH HOH A . +T 10 HOH 1 6 6 HOH HOH B . +T 10 HOH 2 12 12 HOH HOH B . +T 10 HOH 3 634 634 HOH HOH B . +T 10 HOH 4 635 635 HOH HOH B . +T 10 HOH 5 636 2 HOH HOH B . +T 10 HOH 6 637 30 HOH HOH B . +T 10 HOH 7 638 31 HOH HOH B . +T 10 HOH 8 639 33 HOH HOH B . +T 10 HOH 9 640 35 HOH HOH B . +T 10 HOH 10 641 641 HOH HOH B . +T 10 HOH 11 642 36 HOH HOH B . +T 10 HOH 12 643 38 HOH HOH B . +T 10 HOH 13 644 40 HOH HOH B . +T 10 HOH 14 645 43 HOH HOH B . +T 10 HOH 15 646 646 HOH HOH B . +T 10 HOH 16 647 647 HOH HOH B . +T 10 HOH 17 648 46 HOH HOH B . +T 10 HOH 18 649 48 HOH HOH B . +T 10 HOH 19 661 50 HOH HOH B . +T 10 HOH 20 662 51 HOH HOH B . +T 10 HOH 21 663 53 HOH HOH B . +T 10 HOH 22 664 62 HOH HOH B . +T 10 HOH 23 665 665 HOH HOH B . +T 10 HOH 24 666 70 HOH HOH B . +T 10 HOH 25 667 72 HOH HOH B . +T 10 HOH 26 668 668 HOH HOH B . +T 10 HOH 27 669 669 HOH HOH B . +T 10 HOH 28 670 75 HOH HOH B . +T 10 HOH 29 671 85 HOH HOH B . +T 10 HOH 30 672 672 HOH HOH B . +T 10 HOH 31 673 88 HOH HOH B . +T 10 HOH 32 674 674 HOH HOH B . +T 10 HOH 33 675 89 HOH HOH B . +T 10 HOH 34 676 96 HOH HOH B . +T 10 HOH 35 677 97 HOH HOH B . +T 10 HOH 36 678 678 HOH HOH B . +T 10 HOH 37 679 98 HOH HOH B . +T 10 HOH 38 680 99 HOH HOH B . +T 10 HOH 39 681 101 HOH HOH B . +T 10 HOH 40 682 104 HOH HOH B . +T 10 HOH 41 683 115 HOH HOH B . +T 10 HOH 42 684 116 HOH HOH B . +T 10 HOH 43 685 119 HOH HOH B . +T 10 HOH 44 686 126 HOH HOH B . +T 10 HOH 45 687 128 HOH HOH B . +T 10 HOH 46 688 137 HOH HOH B . +T 10 HOH 47 689 139 HOH HOH B . +T 10 HOH 48 690 142 HOH HOH B . +T 10 HOH 49 691 691 HOH HOH B . +T 10 HOH 50 692 692 HOH HOH B . +T 10 HOH 51 693 150 HOH HOH B . +T 10 HOH 52 694 694 HOH HOH B . +T 10 HOH 53 695 155 HOH HOH B . +T 10 HOH 54 696 696 HOH HOH B . +T 10 HOH 55 697 164 HOH HOH B . +T 10 HOH 56 698 167 HOH HOH B . +T 10 HOH 57 699 699 HOH HOH B . +T 10 HOH 58 700 172 HOH HOH B . +T 10 HOH 59 701 174 HOH HOH B . +T 10 HOH 60 702 178 HOH HOH B . +T 10 HOH 61 703 703 HOH HOH B . +T 10 HOH 62 704 182 HOH HOH B . +T 10 HOH 63 705 705 HOH HOH B . +T 10 HOH 64 706 184 HOH HOH B . +T 10 HOH 65 707 196 HOH HOH B . +T 10 HOH 66 708 198 HOH HOH B . +T 10 HOH 67 709 200 HOH HOH B . +T 10 HOH 68 710 201 HOH HOH B . +T 10 HOH 69 711 711 HOH HOH B . +T 10 HOH 70 712 206 HOH HOH B . +T 10 HOH 71 713 207 HOH HOH B . +T 10 HOH 72 714 210 HOH HOH B . +T 10 HOH 73 715 211 HOH HOH B . +T 10 HOH 74 716 216 HOH HOH B . +T 10 HOH 75 717 219 HOH HOH B . +T 10 HOH 76 718 220 HOH HOH B . +T 10 HOH 77 719 226 HOH HOH B . +T 10 HOH 78 720 229 HOH HOH B . +T 10 HOH 79 721 721 HOH HOH B . +T 10 HOH 80 722 722 HOH HOH B . +T 10 HOH 81 723 723 HOH HOH B . +T 10 HOH 82 724 724 HOH HOH B . +T 10 HOH 83 725 232 HOH HOH B . +T 10 HOH 84 726 726 HOH HOH B . +T 10 HOH 85 727 233 HOH HOH B . +T 10 HOH 86 728 244 HOH HOH B . +T 10 HOH 87 729 252 HOH HOH B . +T 10 HOH 88 730 263 HOH HOH B . +T 10 HOH 89 731 264 HOH HOH B . +T 10 HOH 90 732 732 HOH HOH B . +T 10 HOH 91 733 265 HOH HOH B . +T 10 HOH 92 734 267 HOH HOH B . +T 10 HOH 93 735 269 HOH HOH B . +T 10 HOH 94 736 270 HOH HOH B . +T 10 HOH 95 737 277 HOH HOH B . +T 10 HOH 96 738 282 HOH HOH B . +T 10 HOH 97 739 739 HOH HOH B . +T 10 HOH 98 740 283 HOH HOH B . +T 10 HOH 99 741 289 HOH HOH B . +T 10 HOH 100 742 303 HOH HOH B . +T 10 HOH 101 743 307 HOH HOH B . +T 10 HOH 102 744 314 HOH HOH B . +T 10 HOH 103 745 323 HOH HOH B . +T 10 HOH 104 746 746 HOH HOH B . +T 10 HOH 105 747 327 HOH HOH B . +T 10 HOH 106 748 330 HOH HOH B . +T 10 HOH 107 749 334 HOH HOH B . +T 10 HOH 108 750 750 HOH HOH B . +T 10 HOH 109 751 751 HOH HOH B . +T 10 HOH 110 752 337 HOH HOH B . +T 10 HOH 111 753 753 HOH HOH B . +T 10 HOH 112 754 343 HOH HOH B . +T 10 HOH 113 755 755 HOH HOH B . +T 10 HOH 114 756 345 HOH HOH B . +T 10 HOH 115 757 346 HOH HOH B . +T 10 HOH 116 758 355 HOH HOH B . +T 10 HOH 117 759 357 HOH HOH B . +T 10 HOH 118 760 361 HOH HOH B . +T 10 HOH 119 761 362 HOH HOH B . +T 10 HOH 120 762 364 HOH HOH B . +T 10 HOH 121 763 366 HOH HOH B . +T 10 HOH 122 764 377 HOH HOH B . +T 10 HOH 123 765 379 HOH HOH B . +T 10 HOH 124 766 387 HOH HOH B . +T 10 HOH 125 767 767 HOH HOH B . +T 10 HOH 126 768 392 HOH HOH B . +T 10 HOH 127 769 769 HOH HOH B . +T 10 HOH 128 770 394 HOH HOH B . +T 10 HOH 129 771 398 HOH HOH B . +T 10 HOH 130 772 772 HOH HOH B . +T 10 HOH 131 773 401 HOH HOH B . +T 10 HOH 132 774 408 HOH HOH B . +T 10 HOH 133 775 775 HOH HOH B . +T 10 HOH 134 776 418 HOH HOH B . +T 10 HOH 135 777 421 HOH HOH B . +T 10 HOH 136 778 422 HOH HOH B . +T 10 HOH 137 779 427 HOH HOH B . +T 10 HOH 138 780 428 HOH HOH B . +T 10 HOH 139 781 435 HOH HOH B . +T 10 HOH 140 782 441 HOH HOH B . +T 10 HOH 141 783 783 HOH HOH B . +T 10 HOH 142 784 444 HOH HOH B . +T 10 HOH 143 785 785 HOH HOH B . +T 10 HOH 144 786 445 HOH HOH B . +T 10 HOH 145 787 446 HOH HOH B . +T 10 HOH 146 788 457 HOH HOH B . +T 10 HOH 147 789 459 HOH HOH B . +T 10 HOH 148 790 463 HOH HOH B . +T 10 HOH 149 791 467 HOH HOH B . +T 10 HOH 150 792 476 HOH HOH B . +T 10 HOH 151 793 478 HOH HOH B . +T 10 HOH 152 794 481 HOH HOH B . +T 10 HOH 153 795 483 HOH HOH B . +T 10 HOH 154 796 484 HOH HOH B . +T 10 HOH 155 797 485 HOH HOH B . +T 10 HOH 156 798 486 HOH HOH B . +T 10 HOH 157 799 490 HOH HOH B . +T 10 HOH 158 800 501 HOH HOH B . +T 10 HOH 159 801 502 HOH HOH B . +T 10 HOH 160 802 802 HOH HOH B . +T 10 HOH 161 803 803 HOH HOH B . +T 10 HOH 162 804 504 HOH HOH B . +T 10 HOH 163 805 505 HOH HOH B . +T 10 HOH 164 806 506 HOH HOH B . +T 10 HOH 165 807 511 HOH HOH B . +T 10 HOH 166 808 808 HOH HOH B . +T 10 HOH 167 809 513 HOH HOH B . +T 10 HOH 168 810 519 HOH HOH B . +T 10 HOH 169 811 520 HOH HOH B . +T 10 HOH 170 812 526 HOH HOH B . +T 10 HOH 171 813 528 HOH HOH B . +T 10 HOH 172 814 529 HOH HOH B . +T 10 HOH 173 815 530 HOH HOH B . +T 10 HOH 174 816 816 HOH HOH B . +T 10 HOH 175 817 534 HOH HOH B . +T 10 HOH 176 818 536 HOH HOH B . +T 10 HOH 177 819 538 HOH HOH B . +T 10 HOH 178 820 820 HOH HOH B . +T 10 HOH 179 821 544 HOH HOH B . +T 10 HOH 180 822 546 HOH HOH B . +T 10 HOH 181 823 550 HOH HOH B . +T 10 HOH 182 824 554 HOH HOH B . +T 10 HOH 183 825 555 HOH HOH B . +T 10 HOH 184 826 563 HOH HOH B . +T 10 HOH 185 827 564 HOH HOH B . +T 10 HOH 186 828 828 HOH HOH B . +T 10 HOH 187 829 829 HOH HOH B . +T 10 HOH 188 830 830 HOH HOH B . +T 10 HOH 189 831 568 HOH HOH B . +T 10 HOH 190 832 571 HOH HOH B . +T 10 HOH 191 833 574 HOH HOH B . +T 10 HOH 192 834 575 HOH HOH B . +T 10 HOH 193 835 835 HOH HOH B . +T 10 HOH 194 836 580 HOH HOH B . +T 10 HOH 195 837 582 HOH HOH B . +T 10 HOH 196 838 583 HOH HOH B . +T 10 HOH 197 839 584 HOH HOH B . +T 10 HOH 198 840 586 HOH HOH B . +T 10 HOH 199 841 841 HOH HOH B . +T 10 HOH 200 842 598 HOH HOH B . +T 10 HOH 201 843 599 HOH HOH B . +T 10 HOH 202 844 604 HOH HOH B . +T 10 HOH 203 845 606 HOH HOH B . +T 10 HOH 204 846 607 HOH HOH B . +T 10 HOH 205 847 612 HOH HOH B . +T 10 HOH 206 848 614 HOH HOH B . +T 10 HOH 207 849 615 HOH HOH B . +T 10 HOH 208 850 616 HOH HOH B . +T 10 HOH 209 851 617 HOH HOH B . +T 10 HOH 210 852 622 HOH HOH B . +T 10 HOH 211 853 624 HOH HOH B . +T 10 HOH 212 854 854 HOH HOH B . +T 10 HOH 213 855 855 HOH HOH B . +T 10 HOH 214 856 626 HOH HOH B . +T 10 HOH 215 857 633 HOH HOH B . +T 10 HOH 216 858 651 HOH HOH B . +T 10 HOH 217 859 859 HOH HOH B . +T 10 HOH 218 860 653 HOH HOH B . +T 10 HOH 219 861 658 HOH HOH B . +T 10 HOH 220 862 659 HOH HOH B . +T 10 HOH 221 866 866 HOH HOH B . +T 10 HOH 222 867 867 HOH HOH B . +T 10 HOH 223 868 868 HOH HOH B . +T 10 HOH 224 869 869 HOH HOH B . +T 10 HOH 225 872 872 HOH HOH B . +T 10 HOH 226 888 888 HOH HOH B . +T 10 HOH 227 889 889 HOH HOH B . +T 10 HOH 228 890 890 HOH HOH B . +T 10 HOH 229 891 891 HOH HOH B . +T 10 HOH 230 897 897 HOH HOH B . +T 10 HOH 231 898 898 HOH HOH B . +T 10 HOH 232 900 900 HOH HOH B . +T 10 HOH 233 902 902 HOH HOH B . +T 10 HOH 234 903 903 HOH HOH B . +T 10 HOH 235 905 905 HOH HOH B . +T 10 HOH 236 907 907 HOH HOH B . +T 10 HOH 237 918 918 HOH HOH B . +T 10 HOH 238 922 922 HOH HOH B . +T 10 HOH 239 927 927 HOH HOH B . +T 10 HOH 240 930 930 HOH HOH B . +T 10 HOH 241 932 932 HOH HOH B . +T 10 HOH 242 941 941 HOH HOH B . +T 10 HOH 243 942 942 HOH HOH B . +T 10 HOH 244 955 955 HOH HOH B . +T 10 HOH 245 957 957 HOH HOH B . +T 10 HOH 246 959 959 HOH HOH B . +T 10 HOH 247 964 964 HOH HOH B . +T 10 HOH 248 965 965 HOH HOH B . +T 10 HOH 249 966 966 HOH HOH B . +T 10 HOH 250 969 969 HOH HOH B . +T 10 HOH 251 971 971 HOH HOH B . +T 10 HOH 252 977 977 HOH HOH B . +T 10 HOH 253 981 981 HOH HOH B . +T 10 HOH 254 982 982 HOH HOH B . +T 10 HOH 255 987 987 HOH HOH B . +T 10 HOH 256 994 994 HOH HOH B . +T 10 HOH 257 996 996 HOH HOH B . +T 10 HOH 258 1003 1003 HOH HOH B . +T 10 HOH 259 1010 1010 HOH HOH B . +T 10 HOH 260 1012 1012 HOH HOH B . +T 10 HOH 261 1015 1015 HOH HOH B . +T 10 HOH 262 1018 1018 HOH HOH B . +T 10 HOH 263 1023 1023 HOH HOH B . +T 10 HOH 264 1033 1033 HOH HOH B . +T 10 HOH 265 1037 1037 HOH HOH B . +T 10 HOH 266 1039 1039 HOH HOH B . +T 10 HOH 267 1040 1040 HOH HOH B . +T 10 HOH 268 1043 1043 HOH HOH B . +T 10 HOH 269 1050 1050 HOH HOH B . +T 10 HOH 270 1051 1051 HOH HOH B . +T 10 HOH 271 1057 1057 HOH HOH B . +T 10 HOH 272 1061 1061 HOH HOH B . +T 10 HOH 273 1062 1062 HOH HOH B . +T 10 HOH 274 1075 1075 HOH HOH B . +T 10 HOH 275 1077 1077 HOH HOH B . +T 10 HOH 276 1083 1083 HOH HOH B . +T 10 HOH 277 1086 1086 HOH HOH B . +T 10 HOH 278 1089 1089 HOH HOH B . +T 10 HOH 279 1099 1099 HOH HOH B . +T 10 HOH 280 1111 1111 HOH HOH B . +T 10 HOH 281 1115 1115 HOH HOH B . +T 10 HOH 282 1116 1116 HOH HOH B . +T 10 HOH 283 1128 1128 HOH HOH B . +T 10 HOH 284 1134 1134 HOH HOH B . +T 10 HOH 285 1135 1135 HOH HOH B . +T 10 HOH 286 1143 1143 HOH HOH B . +T 10 HOH 287 1145 1145 HOH HOH B . +T 10 HOH 288 1147 1147 HOH HOH B . +T 10 HOH 289 1149 1149 HOH HOH B . +T 10 HOH 290 1154 1154 HOH HOH B . +T 10 HOH 291 1160 1160 HOH HOH B . +T 10 HOH 292 1164 1164 HOH HOH B . +T 10 HOH 293 1167 1167 HOH HOH B . +T 10 HOH 294 1169 1169 HOH HOH B . +T 10 HOH 295 1175 1175 HOH HOH B . +T 10 HOH 296 1176 1176 HOH HOH B . +T 10 HOH 297 1181 1181 HOH HOH B . +T 10 HOH 298 1185 1185 HOH HOH B . +T 10 HOH 299 1187 1187 HOH HOH B . +T 10 HOH 300 1190 1190 HOH HOH B . +T 10 HOH 301 1191 1191 HOH HOH B . +T 10 HOH 302 1194 1194 HOH HOH B . +T 10 HOH 303 1196 1196 HOH HOH B . +T 10 HOH 304 1208 1208 HOH HOH B . +T 10 HOH 305 1210 1210 HOH HOH B . +T 10 HOH 306 1216 1216 HOH HOH B . +T 10 HOH 307 1225 1225 HOH HOH B . +T 10 HOH 308 1227 1227 HOH HOH B . +T 10 HOH 309 1229 1229 HOH HOH B . +T 10 HOH 310 1232 1232 HOH HOH B . +T 10 HOH 311 1242 1242 HOH HOH B . +T 10 HOH 312 1248 1248 HOH HOH B . +T 10 HOH 313 1249 1249 HOH HOH B . +T 10 HOH 314 1253 1253 HOH HOH B . +T 10 HOH 315 1255 1255 HOH HOH B . +T 10 HOH 316 1258 1258 HOH HOH B . +T 10 HOH 317 1259 1259 HOH HOH B . +T 10 HOH 318 1261 1261 HOH HOH B . +T 10 HOH 319 1267 1267 HOH HOH B . +T 10 HOH 320 1269 1269 HOH HOH B . +T 10 HOH 321 1277 1277 HOH HOH B . +T 10 HOH 322 1278 1278 HOH HOH B . +T 10 HOH 323 1285 1285 HOH HOH B . +T 10 HOH 324 1286 1286 HOH HOH B . +T 10 HOH 325 1287 1287 HOH HOH B . +T 10 HOH 326 1291 1291 HOH HOH B . +T 10 HOH 327 1297 1297 HOH HOH B . +T 10 HOH 328 1300 1300 HOH HOH B . +T 10 HOH 329 1302 1302 HOH HOH B . +T 10 HOH 330 1304 1304 HOH HOH B . +T 10 HOH 331 1306 1306 HOH HOH B . +T 10 HOH 332 1312 1312 HOH HOH B . +T 10 HOH 333 1315 1315 HOH HOH B . +T 10 HOH 334 1319 1319 HOH HOH B . +T 10 HOH 335 1322 1322 HOH HOH B . +T 10 HOH 336 1323 1323 HOH HOH B . +T 10 HOH 337 1324 1324 HOH HOH B . +T 10 HOH 338 1326 1326 HOH HOH B . +T 10 HOH 339 1329 1329 HOH HOH B . +T 10 HOH 340 1331 1331 HOH HOH B . +T 10 HOH 341 1338 1338 HOH HOH B . +T 10 HOH 342 1340 1340 HOH HOH B . +T 10 HOH 343 1342 1342 HOH HOH B . +T 10 HOH 344 1343 1343 HOH HOH B . +T 10 HOH 345 1344 1344 HOH HOH B . +T 10 HOH 346 1352 1352 HOH HOH B . +T 10 HOH 347 1361 1361 HOH HOH B . +T 10 HOH 348 1365 1365 HOH HOH B . +T 10 HOH 349 1366 1366 HOH HOH B . +T 10 HOH 350 1368 1368 HOH HOH B . +T 10 HOH 351 1378 1378 HOH HOH B . +T 10 HOH 352 1380 1380 HOH HOH B . +T 10 HOH 353 1387 1387 HOH HOH B . +T 10 HOH 354 1388 1388 HOH HOH B . +T 10 HOH 355 1390 1390 HOH HOH B . +T 10 HOH 356 1395 1395 HOH HOH B . +T 10 HOH 357 1397 1397 HOH HOH B . +T 10 HOH 358 1398 1398 HOH HOH B . +T 10 HOH 359 1406 1406 HOH HOH B . +T 10 HOH 360 1410 1410 HOH HOH B . +T 10 HOH 361 1414 1414 HOH HOH B . +T 10 HOH 362 1417 1417 HOH HOH B . +T 10 HOH 363 1426 1426 HOH HOH B . +T 10 HOH 364 1429 1429 HOH HOH B . +T 10 HOH 365 1433 1433 HOH HOH B . +T 10 HOH 366 1440 1440 HOH HOH B . +T 10 HOH 367 1443 1443 HOH HOH B . +T 10 HOH 368 1448 1448 HOH HOH B . +T 10 HOH 369 1456 1456 HOH HOH B . +T 10 HOH 370 1457 1457 HOH HOH B . +T 10 HOH 371 1461 1461 HOH HOH B . +T 10 HOH 372 1462 1462 HOH HOH B . +T 10 HOH 373 1467 1467 HOH HOH B . +T 10 HOH 374 1469 1469 HOH HOH B . +T 10 HOH 375 1472 1472 HOH HOH B . +T 10 HOH 376 1474 1474 HOH HOH B . +T 10 HOH 377 1485 1485 HOH HOH B . +T 10 HOH 378 1492 1492 HOH HOH B . +T 10 HOH 379 1493 1493 HOH HOH B . +T 10 HOH 380 1495 1495 HOH HOH B . +T 10 HOH 381 1506 1506 HOH HOH B . +T 10 HOH 382 1510 1510 HOH HOH B . +T 10 HOH 383 1511 1511 HOH HOH B . +T 10 HOH 384 1513 1513 HOH HOH B . +T 10 HOH 385 1517 1517 HOH HOH B . +T 10 HOH 386 1525 1525 HOH HOH B . +T 10 HOH 387 1528 1528 HOH HOH B . +T 10 HOH 388 1530 1530 HOH HOH B . +T 10 HOH 389 1536 1536 HOH HOH B . +T 10 HOH 390 1538 1538 HOH HOH B . +T 10 HOH 391 1539 1539 HOH HOH B . +T 10 HOH 392 1546 1546 HOH HOH B . +T 10 HOH 393 1548 1548 HOH HOH B . +T 10 HOH 394 1549 1549 HOH HOH B . +T 10 HOH 395 1550 1550 HOH HOH B . +T 10 HOH 396 1551 1551 HOH HOH B . +T 10 HOH 397 1559 1559 HOH HOH B . +T 10 HOH 398 1564 1564 HOH HOH B . +T 10 HOH 399 1569 1569 HOH HOH B . +T 10 HOH 400 1570 1570 HOH HOH B . +T 10 HOH 401 1571 1571 HOH HOH B . +T 10 HOH 402 1572 1572 HOH HOH B . +T 10 HOH 403 1573 1573 HOH HOH B . +T 10 HOH 404 1585 1585 HOH HOH B . +T 10 HOH 405 1586 1586 HOH HOH B . +T 10 HOH 406 1587 1587 HOH HOH B . +T 10 HOH 407 1588 1588 HOH HOH B . +T 10 HOH 408 1595 1595 HOH HOH B . +T 10 HOH 409 1596 1596 HOH HOH B . +T 10 HOH 410 1598 1598 HOH HOH B . +T 10 HOH 411 1600 1600 HOH HOH B . +T 10 HOH 412 1601 1601 HOH HOH B . +T 10 HOH 413 1602 1602 HOH HOH B . +T 10 HOH 414 1604 1604 HOH HOH B . +T 10 HOH 415 1605 1605 HOH HOH B . +T 10 HOH 416 1607 1607 HOH HOH B . +T 10 HOH 417 1608 1608 HOH HOH B . +T 10 HOH 418 1609 1609 HOH HOH B . +T 10 HOH 419 1613 1613 HOH HOH B . +T 10 HOH 420 1616 1616 HOH HOH B . +T 10 HOH 421 1618 1618 HOH HOH B . +T 10 HOH 422 1624 1624 HOH HOH B . +T 10 HOH 423 1625 1625 HOH HOH B . +T 10 HOH 424 1626 1626 HOH HOH B . +T 10 HOH 425 1629 1629 HOH HOH B . +T 10 HOH 426 1630 1630 HOH HOH B . +T 10 HOH 427 1631 1631 HOH HOH B . +T 10 HOH 428 1636 1636 HOH HOH B . +T 10 HOH 429 1644 1644 HOH HOH B . +T 10 HOH 430 1648 1648 HOH HOH B . +T 10 HOH 431 1653 1653 HOH HOH B . +T 10 HOH 432 1664 1664 HOH HOH B . +T 10 HOH 433 1673 1673 HOH HOH B . +T 10 HOH 434 1676 1676 HOH HOH B . +T 10 HOH 435 1682 1682 HOH HOH B . +T 10 HOH 436 1690 1690 HOH HOH B . +T 10 HOH 437 1697 1697 HOH HOH B . +T 10 HOH 438 1706 1706 HOH HOH B . +T 10 HOH 439 1711 1711 HOH HOH B . +T 10 HOH 440 1714 1714 HOH HOH B . +T 10 HOH 441 1715 1715 HOH HOH B . +T 10 HOH 442 1716 1716 HOH HOH B . +T 10 HOH 443 1717 1717 HOH HOH B . +T 10 HOH 444 1732 1732 HOH HOH B . +T 10 HOH 445 1733 1733 HOH HOH B . +T 10 HOH 446 1735 1735 HOH HOH B . +T 10 HOH 447 1745 1745 HOH HOH B . +T 10 HOH 448 1747 1747 HOH HOH B . +T 10 HOH 449 1749 1749 HOH HOH B . +T 10 HOH 450 1750 1750 HOH HOH B . +T 10 HOH 451 1751 1751 HOH HOH B . +T 10 HOH 452 1752 1752 HOH HOH B . +T 10 HOH 453 1755 1755 HOH HOH B . +T 10 HOH 454 1766 1766 HOH HOH B . +T 10 HOH 455 1767 1767 HOH HOH B . +T 10 HOH 456 1772 1772 HOH HOH B . +T 10 HOH 457 1774 1774 HOH HOH B . +T 10 HOH 458 1777 1777 HOH HOH B . +T 10 HOH 459 1779 1779 HOH HOH B . +T 10 HOH 460 1784 1784 HOH HOH B . +T 10 HOH 461 1786 1786 HOH HOH B . +T 10 HOH 462 1788 1788 HOH HOH B . +T 10 HOH 463 1792 1792 HOH HOH B . +T 10 HOH 464 1793 1793 HOH HOH B . +T 10 HOH 465 1799 1799 HOH HOH B . +T 10 HOH 466 1802 1802 HOH HOH B . +T 10 HOH 467 1805 1805 HOH HOH B . +T 10 HOH 468 1807 1807 HOH HOH B . +T 10 HOH 469 1808 1808 HOH HOH B . +T 10 HOH 470 1810 1810 HOH HOH B . +T 10 HOH 471 1812 1812 HOH HOH B . +T 10 HOH 472 1813 1813 HOH HOH B . +T 10 HOH 473 1816 1816 HOH HOH B . +T 10 HOH 474 1821 1821 HOH HOH B . +T 10 HOH 475 1823 1823 HOH HOH B . +T 10 HOH 476 1830 1830 HOH HOH B . +T 10 HOH 477 1833 1833 HOH HOH B . +T 10 HOH 478 1834 1834 HOH HOH B . +T 10 HOH 479 1835 1835 HOH HOH B . +T 10 HOH 480 1837 1837 HOH HOH B . +T 10 HOH 481 1843 1843 HOH HOH B . +T 10 HOH 482 1849 1849 HOH HOH B . +T 10 HOH 483 1852 1852 HOH HOH B . +T 10 HOH 484 1855 1855 HOH HOH B . +T 10 HOH 485 1856 1856 HOH HOH B . +T 10 HOH 486 1859 1859 HOH HOH B . +T 10 HOH 487 1863 1863 HOH HOH B . +T 10 HOH 488 1864 1864 HOH HOH B . +T 10 HOH 489 1878 1878 HOH HOH B . +T 10 HOH 490 1879 1879 HOH HOH B . +T 10 HOH 491 1883 1883 HOH HOH B . +T 10 HOH 492 1886 1886 HOH HOH B . +T 10 HOH 493 1892 1892 HOH HOH B . +T 10 HOH 494 1895 1895 HOH HOH B . +T 10 HOH 495 1900 1900 HOH HOH B . +T 10 HOH 496 1904 1904 HOH HOH B . +T 10 HOH 497 1909 1909 HOH HOH B . +T 10 HOH 498 1914 1914 HOH HOH B . +T 10 HOH 499 1915 1915 HOH HOH B . +T 10 HOH 500 1917 1917 HOH HOH B . +T 10 HOH 501 1933 1933 HOH HOH B . +T 10 HOH 502 1937 1937 HOH HOH B . +T 10 HOH 503 1946 1946 HOH HOH B . +T 10 HOH 504 1948 1948 HOH HOH B . +T 10 HOH 505 1949 1949 HOH HOH B . +T 10 HOH 506 1950 1950 HOH HOH B . +T 10 HOH 507 1956 1956 HOH HOH B . +T 10 HOH 508 1963 1963 HOH HOH B . +T 10 HOH 509 1965 1965 HOH HOH B . +T 10 HOH 510 1967 1967 HOH HOH B . +T 10 HOH 511 1969 1969 HOH HOH B . +T 10 HOH 512 1970 1970 HOH HOH B . +T 10 HOH 513 1971 1971 HOH HOH B . +T 10 HOH 514 1974 1974 HOH HOH B . +T 10 HOH 515 1976 1976 HOH HOH B . +T 10 HOH 516 1977 1977 HOH HOH B . +T 10 HOH 517 1980 1980 HOH HOH B . +T 10 HOH 518 1984 1984 HOH HOH B . +T 10 HOH 519 1987 1987 HOH HOH B . +T 10 HOH 520 1994 1994 HOH HOH B . +T 10 HOH 521 2003 2003 HOH HOH B . +T 10 HOH 522 2004 2004 HOH HOH B . +T 10 HOH 523 2006 2006 HOH HOH B . +T 10 HOH 524 2010 2010 HOH HOH B . +T 10 HOH 525 2016 2016 HOH HOH B . +T 10 HOH 526 2019 2019 HOH HOH B . +T 10 HOH 527 2028 2028 HOH HOH B . +T 10 HOH 528 2035 2035 HOH HOH B . +T 10 HOH 529 2038 2038 HOH HOH B . +T 10 HOH 530 2046 2046 HOH HOH B . +T 10 HOH 531 2050 2050 HOH HOH B . +T 10 HOH 532 2051 2051 HOH HOH B . +T 10 HOH 533 2061 2061 HOH HOH B . +T 10 HOH 534 2070 2070 HOH HOH B . +T 10 HOH 535 2072 2072 HOH HOH B . +T 10 HOH 536 2080 2080 HOH HOH B . +T 10 HOH 537 2082 2082 HOH HOH B . +T 10 HOH 538 2087 2087 HOH HOH B . +T 10 HOH 539 2088 2088 HOH HOH B . +T 10 HOH 540 2089 2089 HOH HOH B . +T 10 HOH 541 2097 2097 HOH HOH B . +T 10 HOH 542 2099 2099 HOH HOH B . +T 10 HOH 543 2102 2102 HOH HOH B . +T 10 HOH 544 2104 2104 HOH HOH B . +T 10 HOH 545 2110 2110 HOH HOH B . +T 10 HOH 546 2111 2111 HOH HOH B . +T 10 HOH 547 2114 2114 HOH HOH B . +T 10 HOH 548 2116 2116 HOH HOH B . +T 10 HOH 549 2119 2119 HOH HOH B . +T 10 HOH 550 2121 2121 HOH HOH B . +T 10 HOH 551 2129 2129 HOH HOH B . +T 10 HOH 552 2130 2130 HOH HOH B . +T 10 HOH 553 2131 2131 HOH HOH B . +T 10 HOH 554 2135 2135 HOH HOH B . +T 10 HOH 555 2139 2139 HOH HOH B . +T 10 HOH 556 2140 2140 HOH HOH B . +T 10 HOH 557 2142 2142 HOH HOH B . +T 10 HOH 558 2145 2145 HOH HOH B . +T 10 HOH 559 2147 2147 HOH HOH B . +T 10 HOH 560 2148 2148 HOH HOH B . +T 10 HOH 561 2151 2151 HOH HOH B . +T 10 HOH 562 2160 2160 HOH HOH B . +T 10 HOH 563 2167 2167 HOH HOH B . +T 10 HOH 564 2171 2171 HOH HOH B . +T 10 HOH 565 2179 2179 HOH HOH B . +T 10 HOH 566 2181 2181 HOH HOH B . +T 10 HOH 567 2192 2192 HOH HOH B . +T 10 HOH 568 2193 2193 HOH HOH B . +T 10 HOH 569 2202 2202 HOH HOH B . +T 10 HOH 570 2214 2214 HOH HOH B . +T 10 HOH 571 2225 2225 HOH HOH B . +T 10 HOH 572 2229 2229 HOH HOH B . +T 10 HOH 573 2233 2233 HOH HOH B . +T 10 HOH 574 2235 2235 HOH HOH B . +T 10 HOH 575 2237 2237 HOH HOH B . +T 10 HOH 576 2241 2241 HOH HOH B . +T 10 HOH 577 2244 2244 HOH HOH B . +T 10 HOH 578 2247 2247 HOH HOH B . +T 10 HOH 579 2248 2248 HOH HOH B . +T 10 HOH 580 2251 2251 HOH HOH B . +T 10 HOH 581 2260 2260 HOH HOH B . +T 10 HOH 582 2262 2262 HOH HOH B . +T 10 HOH 583 2266 2266 HOH HOH B . +T 10 HOH 584 2267 2267 HOH HOH B . +T 10 HOH 585 2268 2268 HOH HOH B . +T 10 HOH 586 2270 2270 HOH HOH B . +T 10 HOH 587 2274 2274 HOH HOH B . +T 10 HOH 588 2276 2276 HOH HOH B . +T 10 HOH 589 2279 2279 HOH HOH B . +T 10 HOH 590 2284 2284 HOH HOH B . +T 10 HOH 591 2285 2285 HOH HOH B . +T 10 HOH 592 2292 2292 HOH HOH B . +T 10 HOH 593 2293 2293 HOH HOH B . +T 10 HOH 594 2299 2299 HOH HOH B . +T 10 HOH 595 2303 2303 HOH HOH B . +T 10 HOH 596 2308 2308 HOH HOH B . +T 10 HOH 597 2316 2316 HOH HOH B . +T 10 HOH 598 2327 2327 HOH HOH B . +T 10 HOH 599 2331 2331 HOH HOH B . +T 10 HOH 600 2350 2350 HOH HOH B . +T 10 HOH 601 2354 2354 HOH HOH B . +T 10 HOH 602 2356 2356 HOH HOH B . +T 10 HOH 603 2374 2374 HOH HOH B . +T 10 HOH 604 2379 2379 HOH HOH B . +T 10 HOH 605 2380 2380 HOH HOH B . +T 10 HOH 606 2387 2387 HOH HOH B . +T 10 HOH 607 2391 2391 HOH HOH B . +T 10 HOH 608 2392 2392 HOH HOH B . +T 10 HOH 609 2410 2410 HOH HOH B . +T 10 HOH 610 2414 2414 HOH HOH B . +T 10 HOH 611 2416 2416 HOH HOH B . +T 10 HOH 612 2422 2422 HOH HOH B . +T 10 HOH 613 2425 2425 HOH HOH B . +T 10 HOH 614 2432 2432 HOH HOH B . +T 10 HOH 615 2433 2433 HOH HOH B . +T 10 HOH 616 2435 2435 HOH HOH B . +T 10 HOH 617 2436 2436 HOH HOH B . +T 10 HOH 618 2437 2437 HOH HOH B . +T 10 HOH 619 2447 2447 HOH HOH B . +T 10 HOH 620 2452 2452 HOH HOH B . +T 10 HOH 621 2453 2453 HOH HOH B . +T 10 HOH 622 2455 2455 HOH HOH B . +T 10 HOH 623 2466 2466 HOH HOH B . +T 10 HOH 624 2467 2467 HOH HOH B . +T 10 HOH 625 2468 2468 HOH HOH B . +T 10 HOH 626 2472 2472 HOH HOH B . +T 10 HOH 627 2474 2474 HOH HOH B . +T 10 HOH 628 2478 2478 HOH HOH B . +T 10 HOH 629 2483 2483 HOH HOH B . +T 10 HOH 630 2486 2486 HOH HOH B . +T 10 HOH 631 2488 2488 HOH HOH B . +T 10 HOH 632 2504 2504 HOH HOH B . +T 10 HOH 633 2505 2505 HOH HOH B . +T 10 HOH 634 2506 2506 HOH HOH B . +T 10 HOH 635 2509 2509 HOH HOH B . +T 10 HOH 636 2511 2511 HOH HOH B . +T 10 HOH 637 2512 2512 HOH HOH B . +T 10 HOH 638 2514 2514 HOH HOH B . +T 10 HOH 639 2517 2517 HOH HOH B . +T 10 HOH 640 2524 2524 HOH HOH B . +T 10 HOH 641 2531 2531 HOH HOH B . +T 10 HOH 642 2540 2540 HOH HOH B . +T 10 HOH 643 2542 2542 HOH HOH B . +T 10 HOH 644 2543 2543 HOH HOH B . +T 10 HOH 645 2560 2560 HOH HOH B . +T 10 HOH 646 2576 2576 HOH HOH B . +T 10 HOH 647 2577 2577 HOH HOH B . +T 10 HOH 648 2587 2587 HOH HOH B . +T 10 HOH 649 2588 2588 HOH HOH B . +T 10 HOH 650 2595 2595 HOH HOH B . +T 10 HOH 651 2599 2599 HOH HOH B . +T 10 HOH 652 2603 2603 HOH HOH B . +T 10 HOH 653 2604 2604 HOH HOH B . +T 10 HOH 654 2612 2612 HOH HOH B . +T 10 HOH 655 2613 2613 HOH HOH B . +T 10 HOH 656 2619 2619 HOH HOH B . +T 10 HOH 657 2626 2626 HOH HOH B . +T 10 HOH 658 2631 2631 HOH HOH B . +T 10 HOH 659 2632 2632 HOH HOH B . +T 10 HOH 660 2633 2633 HOH HOH B . +T 10 HOH 661 2634 2634 HOH HOH B . +T 10 HOH 662 2639 2639 HOH HOH B . +T 10 HOH 663 2648 2648 HOH HOH B . +T 10 HOH 664 2656 2656 HOH HOH B . +T 10 HOH 665 2663 2663 HOH HOH B . +T 10 HOH 666 2673 2673 HOH HOH B . +T 10 HOH 667 2674 2674 HOH HOH B . +T 10 HOH 668 2677 2677 HOH HOH B . +T 10 HOH 669 2682 2682 HOH HOH B . +T 10 HOH 670 2687 2687 HOH HOH B . +T 10 HOH 671 2691 2691 HOH HOH B . +T 10 HOH 672 2692 2692 HOH HOH B . +T 10 HOH 673 2708 2708 HOH HOH B . +T 10 HOH 674 2717 2717 HOH HOH B . +T 10 HOH 675 2718 2718 HOH HOH B . +T 10 HOH 676 2719 2719 HOH HOH B . +T 10 HOH 677 2722 2722 HOH HOH B . +T 10 HOH 678 2725 2725 HOH HOH B . +T 10 HOH 679 2733 2733 HOH HOH B . +T 10 HOH 680 2734 2734 HOH HOH B . +T 10 HOH 681 2735 2735 HOH HOH B . +T 10 HOH 682 2739 2739 HOH HOH B . +T 10 HOH 683 2741 2741 HOH HOH B . +T 10 HOH 684 2748 2748 HOH HOH B . +T 10 HOH 685 2750 2750 HOH HOH B . +T 10 HOH 686 2756 2756 HOH HOH B . +T 10 HOH 687 2764 2764 HOH HOH B . +T 10 HOH 688 2765 2765 HOH HOH B . +T 10 HOH 689 2767 2767 HOH HOH B . +T 10 HOH 690 2769 2769 HOH HOH B . +T 10 HOH 691 2771 2771 HOH HOH B . +T 10 HOH 692 2773 2773 HOH HOH B . +T 10 HOH 693 2780 2780 HOH HOH B . +T 10 HOH 694 2781 2781 HOH HOH B . +T 10 HOH 695 2783 2783 HOH HOH B . +T 10 HOH 696 2784 2784 HOH HOH B . +T 10 HOH 697 2787 2787 HOH HOH B . +T 10 HOH 698 2789 2789 HOH HOH B . +T 10 HOH 699 2790 2790 HOH HOH B . +T 10 HOH 700 2792 2792 HOH HOH B . +T 10 HOH 701 2798 2798 HOH HOH B . +T 10 HOH 702 2802 2802 HOH HOH B . +T 10 HOH 703 2807 2807 HOH HOH B . +T 10 HOH 704 2810 2810 HOH HOH B . +T 10 HOH 705 2811 2811 HOH HOH B . +T 10 HOH 706 2812 2812 HOH HOH B . +U 10 HOH 1 13 13 HOH HOH D . +U 10 HOH 2 15 15 HOH HOH D . +U 10 HOH 3 18 18 HOH HOH D . +U 10 HOH 4 19 19 HOH HOH D . +U 10 HOH 5 634 21 HOH HOH D . +U 10 HOH 6 635 25 HOH HOH D . +U 10 HOH 7 636 28 HOH HOH D . +U 10 HOH 8 637 29 HOH HOH D . +U 10 HOH 9 638 32 HOH HOH D . +U 10 HOH 10 639 639 HOH HOH D . +U 10 HOH 11 640 44 HOH HOH D . +U 10 HOH 12 641 47 HOH HOH D . +U 10 HOH 13 642 49 HOH HOH D . +U 10 HOH 14 643 56 HOH HOH D . +U 10 HOH 15 644 64 HOH HOH D . +U 10 HOH 16 645 66 HOH HOH D . +U 10 HOH 17 646 76 HOH HOH D . +U 10 HOH 18 647 78 HOH HOH D . +U 10 HOH 19 648 80 HOH HOH D . +U 10 HOH 20 649 649 HOH HOH D . +U 10 HOH 21 661 661 HOH HOH D . +U 10 HOH 22 662 86 HOH HOH D . +U 10 HOH 23 663 663 HOH HOH D . +U 10 HOH 24 664 664 HOH HOH D . +U 10 HOH 25 665 90 HOH HOH D . +U 10 HOH 26 666 91 HOH HOH D . +U 10 HOH 27 667 667 HOH HOH D . +U 10 HOH 28 668 92 HOH HOH D . +U 10 HOH 29 669 94 HOH HOH D . +U 10 HOH 30 670 670 HOH HOH D . +U 10 HOH 31 671 671 HOH HOH D . +U 10 HOH 32 672 95 HOH HOH D . +U 10 HOH 33 673 100 HOH HOH D . +U 10 HOH 34 674 109 HOH HOH D . +U 10 HOH 35 675 120 HOH HOH D . +U 10 HOH 36 676 676 HOH HOH D . +U 10 HOH 37 677 121 HOH HOH D . +U 10 HOH 38 678 125 HOH HOH D . +U 10 HOH 39 679 132 HOH HOH D . +U 10 HOH 40 680 680 HOH HOH D . +U 10 HOH 41 681 133 HOH HOH D . +U 10 HOH 42 682 682 HOH HOH D . +U 10 HOH 43 683 134 HOH HOH D . +U 10 HOH 44 684 684 HOH HOH D . +U 10 HOH 45 685 135 HOH HOH D . +U 10 HOH 46 686 138 HOH HOH D . +U 10 HOH 47 687 141 HOH HOH D . +U 10 HOH 48 688 688 HOH HOH D . +U 10 HOH 49 689 143 HOH HOH D . +U 10 HOH 50 690 146 HOH HOH D . +U 10 HOH 51 691 168 HOH HOH D . +U 10 HOH 52 692 171 HOH HOH D . +U 10 HOH 53 693 176 HOH HOH D . +U 10 HOH 54 694 179 HOH HOH D . +U 10 HOH 55 695 183 HOH HOH D . +U 10 HOH 56 696 185 HOH HOH D . +U 10 HOH 57 697 188 HOH HOH D . +U 10 HOH 58 698 698 HOH HOH D . +U 10 HOH 59 699 190 HOH HOH D . +U 10 HOH 60 700 194 HOH HOH D . +U 10 HOH 61 701 205 HOH HOH D . +U 10 HOH 62 702 702 HOH HOH D . +U 10 HOH 63 703 213 HOH HOH D . +U 10 HOH 64 704 217 HOH HOH D . +U 10 HOH 65 705 221 HOH HOH D . +U 10 HOH 66 706 228 HOH HOH D . +U 10 HOH 67 707 230 HOH HOH D . +U 10 HOH 68 708 231 HOH HOH D . +U 10 HOH 69 709 709 HOH HOH D . +U 10 HOH 70 710 710 HOH HOH D . +U 10 HOH 71 711 236 HOH HOH D . +U 10 HOH 72 712 243 HOH HOH D . +U 10 HOH 73 713 249 HOH HOH D . +U 10 HOH 74 714 254 HOH HOH D . +U 10 HOH 75 715 715 HOH HOH D . +U 10 HOH 76 716 255 HOH HOH D . +U 10 HOH 77 717 717 HOH HOH D . +U 10 HOH 78 718 256 HOH HOH D . +U 10 HOH 79 719 719 HOH HOH D . +U 10 HOH 80 720 720 HOH HOH D . +U 10 HOH 81 721 257 HOH HOH D . +U 10 HOH 82 722 261 HOH HOH D . +U 10 HOH 83 723 266 HOH HOH D . +U 10 HOH 84 724 268 HOH HOH D . +U 10 HOH 85 725 725 HOH HOH D . +U 10 HOH 86 726 271 HOH HOH D . +U 10 HOH 87 727 272 HOH HOH D . +U 10 HOH 88 728 728 HOH HOH D . +U 10 HOH 89 729 276 HOH HOH D . +U 10 HOH 90 730 284 HOH HOH D . +U 10 HOH 91 731 285 HOH HOH D . +U 10 HOH 92 732 286 HOH HOH D . +U 10 HOH 93 733 733 HOH HOH D . +U 10 HOH 94 734 287 HOH HOH D . +U 10 HOH 95 735 288 HOH HOH D . +U 10 HOH 96 736 296 HOH HOH D . +U 10 HOH 97 737 298 HOH HOH D . +U 10 HOH 98 738 299 HOH HOH D . +U 10 HOH 99 739 306 HOH HOH D . +U 10 HOH 100 740 740 HOH HOH D . +U 10 HOH 101 741 313 HOH HOH D . +U 10 HOH 102 742 742 HOH HOH D . +U 10 HOH 103 743 321 HOH HOH D . +U 10 HOH 104 744 744 HOH HOH D . +U 10 HOH 105 745 335 HOH HOH D . +U 10 HOH 106 746 336 HOH HOH D . +U 10 HOH 107 747 747 HOH HOH D . +U 10 HOH 108 748 748 HOH HOH D . +U 10 HOH 109 749 338 HOH HOH D . +U 10 HOH 110 750 342 HOH HOH D . +U 10 HOH 111 751 350 HOH HOH D . +U 10 HOH 112 752 353 HOH HOH D . +U 10 HOH 113 753 359 HOH HOH D . +U 10 HOH 114 754 360 HOH HOH D . +U 10 HOH 115 755 365 HOH HOH D . +U 10 HOH 116 756 374 HOH HOH D . +U 10 HOH 117 757 375 HOH HOH D . +U 10 HOH 118 758 758 HOH HOH D . +U 10 HOH 119 759 376 HOH HOH D . +U 10 HOH 120 760 378 HOH HOH D . +U 10 HOH 121 761 761 HOH HOH D . +U 10 HOH 122 762 385 HOH HOH D . +U 10 HOH 123 763 763 HOH HOH D . +U 10 HOH 124 764 388 HOH HOH D . +U 10 HOH 125 765 765 HOH HOH D . +U 10 HOH 126 766 396 HOH HOH D . +U 10 HOH 127 767 399 HOH HOH D . +U 10 HOH 128 768 768 HOH HOH D . +U 10 HOH 129 769 400 HOH HOH D . +U 10 HOH 130 770 770 HOH HOH D . +U 10 HOH 131 771 410 HOH HOH D . +U 10 HOH 132 772 411 HOH HOH D . +U 10 HOH 133 773 773 HOH HOH D . +U 10 HOH 134 774 420 HOH HOH D . +U 10 HOH 135 775 424 HOH HOH D . +U 10 HOH 136 776 776 HOH HOH D . +U 10 HOH 137 777 426 HOH HOH D . +U 10 HOH 138 778 429 HOH HOH D . +U 10 HOH 139 779 431 HOH HOH D . +U 10 HOH 140 780 433 HOH HOH D . +U 10 HOH 141 781 437 HOH HOH D . +U 10 HOH 142 782 439 HOH HOH D . +U 10 HOH 143 783 447 HOH HOH D . +U 10 HOH 144 784 784 HOH HOH D . +U 10 HOH 145 785 450 HOH HOH D . +U 10 HOH 146 786 451 HOH HOH D . +U 10 HOH 147 787 787 HOH HOH D . +U 10 HOH 148 788 453 HOH HOH D . +U 10 HOH 149 789 454 HOH HOH D . +U 10 HOH 150 790 455 HOH HOH D . +U 10 HOH 151 791 456 HOH HOH D . +U 10 HOH 152 792 458 HOH HOH D . +U 10 HOH 153 793 460 HOH HOH D . +U 10 HOH 154 794 465 HOH HOH D . +U 10 HOH 155 795 466 HOH HOH D . +U 10 HOH 156 796 796 HOH HOH D . +U 10 HOH 157 797 797 HOH HOH D . +U 10 HOH 158 798 470 HOH HOH D . +U 10 HOH 159 799 471 HOH HOH D . +U 10 HOH 160 800 473 HOH HOH D . +U 10 HOH 161 801 474 HOH HOH D . +U 10 HOH 162 802 482 HOH HOH D . +U 10 HOH 163 803 487 HOH HOH D . +U 10 HOH 164 804 804 HOH HOH D . +U 10 HOH 165 805 805 HOH HOH D . +U 10 HOH 166 806 488 HOH HOH D . +U 10 HOH 167 807 493 HOH HOH D . +U 10 HOH 168 808 495 HOH HOH D . +U 10 HOH 169 809 809 HOH HOH D . +U 10 HOH 170 810 810 HOH HOH D . +U 10 HOH 171 811 500 HOH HOH D . +U 10 HOH 172 812 503 HOH HOH D . +U 10 HOH 173 813 813 HOH HOH D . +U 10 HOH 174 814 508 HOH HOH D . +U 10 HOH 175 815 510 HOH HOH D . +U 10 HOH 176 816 515 HOH HOH D . +U 10 HOH 177 817 521 HOH HOH D . +U 10 HOH 178 818 523 HOH HOH D . +U 10 HOH 179 819 524 HOH HOH D . +U 10 HOH 180 820 527 HOH HOH D . +U 10 HOH 181 821 821 HOH HOH D . +U 10 HOH 182 822 535 HOH HOH D . +U 10 HOH 183 823 823 HOH HOH D . +U 10 HOH 184 824 824 HOH HOH D . +U 10 HOH 185 825 539 HOH HOH D . +U 10 HOH 186 826 557 HOH HOH D . +U 10 HOH 187 827 827 HOH HOH D . +U 10 HOH 188 828 560 HOH HOH D . +U 10 HOH 189 829 561 HOH HOH D . +U 10 HOH 190 830 562 HOH HOH D . +U 10 HOH 191 831 831 HOH HOH D . +U 10 HOH 192 832 565 HOH HOH D . +U 10 HOH 193 833 585 HOH HOH D . +U 10 HOH 194 834 587 HOH HOH D . +U 10 HOH 195 835 588 HOH HOH D . +U 10 HOH 196 836 596 HOH HOH D . +U 10 HOH 197 837 837 HOH HOH D . +U 10 HOH 198 838 838 HOH HOH D . +U 10 HOH 199 839 839 HOH HOH D . +U 10 HOH 200 840 600 HOH HOH D . +U 10 HOH 201 841 601 HOH HOH D . +U 10 HOH 202 842 605 HOH HOH D . +U 10 HOH 203 843 610 HOH HOH D . +U 10 HOH 204 844 844 HOH HOH D . +U 10 HOH 205 845 845 HOH HOH D . +U 10 HOH 206 846 611 HOH HOH D . +U 10 HOH 207 847 618 HOH HOH D . +U 10 HOH 208 848 848 HOH HOH D . +U 10 HOH 209 849 849 HOH HOH D . +U 10 HOH 210 850 620 HOH HOH D . +U 10 HOH 211 851 630 HOH HOH D . +U 10 HOH 212 852 650 HOH HOH D . +U 10 HOH 213 853 652 HOH HOH D . +U 10 HOH 214 854 656 HOH HOH D . +U 10 HOH 215 855 657 HOH HOH D . +U 10 HOH 216 857 857 HOH HOH D . +U 10 HOH 217 860 860 HOH HOH D . +U 10 HOH 218 862 862 HOH HOH D . +U 10 HOH 219 863 863 HOH HOH D . +U 10 HOH 220 864 864 HOH HOH D . +U 10 HOH 221 865 865 HOH HOH D . +U 10 HOH 222 877 877 HOH HOH D . +U 10 HOH 223 884 884 HOH HOH D . +U 10 HOH 224 886 886 HOH HOH D . +U 10 HOH 225 894 894 HOH HOH D . +U 10 HOH 226 896 896 HOH HOH D . +U 10 HOH 227 901 901 HOH HOH D . +U 10 HOH 228 908 908 HOH HOH D . +U 10 HOH 229 920 920 HOH HOH D . +U 10 HOH 230 921 921 HOH HOH D . +U 10 HOH 231 923 923 HOH HOH D . +U 10 HOH 232 926 926 HOH HOH D . +U 10 HOH 233 935 935 HOH HOH D . +U 10 HOH 234 938 938 HOH HOH D . +U 10 HOH 235 944 944 HOH HOH D . +U 10 HOH 236 946 946 HOH HOH D . +U 10 HOH 237 949 949 HOH HOH D . +U 10 HOH 238 954 954 HOH HOH D . +U 10 HOH 239 961 961 HOH HOH D . +U 10 HOH 240 962 962 HOH HOH D . +U 10 HOH 241 970 970 HOH HOH D . +U 10 HOH 242 973 973 HOH HOH D . +U 10 HOH 243 983 983 HOH HOH D . +U 10 HOH 244 984 984 HOH HOH D . +U 10 HOH 245 986 986 HOH HOH D . +U 10 HOH 246 999 999 HOH HOH D . +U 10 HOH 247 1001 1001 HOH HOH D . +U 10 HOH 248 1002 1002 HOH HOH D . +U 10 HOH 249 1005 1005 HOH HOH D . +U 10 HOH 250 1006 1006 HOH HOH D . +U 10 HOH 251 1009 1009 HOH HOH D . +U 10 HOH 252 1013 1013 HOH HOH D . +U 10 HOH 253 1014 1014 HOH HOH D . +U 10 HOH 254 1022 1022 HOH HOH D . +U 10 HOH 255 1031 1031 HOH HOH D . +U 10 HOH 256 1038 1038 HOH HOH D . +U 10 HOH 257 1041 1041 HOH HOH D . +U 10 HOH 258 1042 1042 HOH HOH D . +U 10 HOH 259 1052 1052 HOH HOH D . +U 10 HOH 260 1060 1060 HOH HOH D . +U 10 HOH 261 1065 1065 HOH HOH D . +U 10 HOH 262 1069 1069 HOH HOH D . +U 10 HOH 263 1071 1071 HOH HOH D . +U 10 HOH 264 1072 1072 HOH HOH D . +U 10 HOH 265 1078 1078 HOH HOH D . +U 10 HOH 266 1084 1084 HOH HOH D . +U 10 HOH 267 1104 1104 HOH HOH D . +U 10 HOH 268 1107 1107 HOH HOH D . +U 10 HOH 269 1112 1112 HOH HOH D . +U 10 HOH 270 1118 1118 HOH HOH D . +U 10 HOH 271 1127 1127 HOH HOH D . +U 10 HOH 272 1132 1132 HOH HOH D . +U 10 HOH 273 1138 1138 HOH HOH D . +U 10 HOH 274 1140 1140 HOH HOH D . +U 10 HOH 275 1151 1151 HOH HOH D . +U 10 HOH 276 1155 1155 HOH HOH D . +U 10 HOH 277 1157 1157 HOH HOH D . +U 10 HOH 278 1161 1161 HOH HOH D . +U 10 HOH 279 1166 1166 HOH HOH D . +U 10 HOH 280 1168 1168 HOH HOH D . +U 10 HOH 281 1177 1177 HOH HOH D . +U 10 HOH 282 1178 1178 HOH HOH D . +U 10 HOH 283 1188 1188 HOH HOH D . +U 10 HOH 284 1192 1192 HOH HOH D . +U 10 HOH 285 1205 1205 HOH HOH D . +U 10 HOH 286 1206 1206 HOH HOH D . +U 10 HOH 287 1212 1212 HOH HOH D . +U 10 HOH 288 1217 1217 HOH HOH D . +U 10 HOH 289 1226 1226 HOH HOH D . +U 10 HOH 290 1233 1233 HOH HOH D . +U 10 HOH 291 1234 1234 HOH HOH D . +U 10 HOH 292 1236 1236 HOH HOH D . +U 10 HOH 293 1237 1237 HOH HOH D . +U 10 HOH 294 1238 1238 HOH HOH D . +U 10 HOH 295 1239 1239 HOH HOH D . +U 10 HOH 296 1243 1243 HOH HOH D . +U 10 HOH 297 1245 1245 HOH HOH D . +U 10 HOH 298 1247 1247 HOH HOH D . +U 10 HOH 299 1251 1251 HOH HOH D . +U 10 HOH 300 1254 1254 HOH HOH D . +U 10 HOH 301 1257 1257 HOH HOH D . +U 10 HOH 302 1271 1271 HOH HOH D . +U 10 HOH 303 1272 1272 HOH HOH D . +U 10 HOH 304 1273 1273 HOH HOH D . +U 10 HOH 305 1280 1280 HOH HOH D . +U 10 HOH 306 1282 1282 HOH HOH D . +U 10 HOH 307 1283 1283 HOH HOH D . +U 10 HOH 308 1292 1292 HOH HOH D . +U 10 HOH 309 1298 1298 HOH HOH D . +U 10 HOH 310 1301 1301 HOH HOH D . +U 10 HOH 311 1303 1303 HOH HOH D . +U 10 HOH 312 1309 1309 HOH HOH D . +U 10 HOH 313 1317 1317 HOH HOH D . +U 10 HOH 314 1318 1318 HOH HOH D . +U 10 HOH 315 1325 1325 HOH HOH D . +U 10 HOH 316 1332 1332 HOH HOH D . +U 10 HOH 317 1334 1334 HOH HOH D . +U 10 HOH 318 1335 1335 HOH HOH D . +U 10 HOH 319 1339 1339 HOH HOH D . +U 10 HOH 320 1353 1353 HOH HOH D . +U 10 HOH 321 1355 1355 HOH HOH D . +U 10 HOH 322 1356 1356 HOH HOH D . +U 10 HOH 323 1357 1357 HOH HOH D . +U 10 HOH 324 1359 1359 HOH HOH D . +U 10 HOH 325 1362 1362 HOH HOH D . +U 10 HOH 326 1363 1363 HOH HOH D . +U 10 HOH 327 1367 1367 HOH HOH D . +U 10 HOH 328 1369 1369 HOH HOH D . +U 10 HOH 329 1385 1385 HOH HOH D . +U 10 HOH 330 1394 1394 HOH HOH D . +U 10 HOH 331 1399 1399 HOH HOH D . +U 10 HOH 332 1401 1401 HOH HOH D . +U 10 HOH 333 1407 1407 HOH HOH D . +U 10 HOH 334 1408 1408 HOH HOH D . +U 10 HOH 335 1411 1411 HOH HOH D . +U 10 HOH 336 1413 1413 HOH HOH D . +U 10 HOH 337 1415 1415 HOH HOH D . +U 10 HOH 338 1422 1422 HOH HOH D . +U 10 HOH 339 1425 1425 HOH HOH D . +U 10 HOH 340 1431 1431 HOH HOH D . +U 10 HOH 341 1437 1437 HOH HOH D . +U 10 HOH 342 1447 1447 HOH HOH D . +U 10 HOH 343 1450 1450 HOH HOH D . +U 10 HOH 344 1455 1455 HOH HOH D . +U 10 HOH 345 1468 1468 HOH HOH D . +U 10 HOH 346 1471 1471 HOH HOH D . +U 10 HOH 347 1476 1476 HOH HOH D . +U 10 HOH 348 1480 1480 HOH HOH D . +U 10 HOH 349 1484 1484 HOH HOH D . +U 10 HOH 350 1487 1487 HOH HOH D . +U 10 HOH 351 1496 1496 HOH HOH D . +U 10 HOH 352 1497 1497 HOH HOH D . +U 10 HOH 353 1498 1498 HOH HOH D . +U 10 HOH 354 1499 1499 HOH HOH D . +U 10 HOH 355 1504 1504 HOH HOH D . +U 10 HOH 356 1507 1507 HOH HOH D . +U 10 HOH 357 1508 1508 HOH HOH D . +U 10 HOH 358 1516 1516 HOH HOH D . +U 10 HOH 359 1518 1518 HOH HOH D . +U 10 HOH 360 1521 1521 HOH HOH D . +U 10 HOH 361 1523 1523 HOH HOH D . +U 10 HOH 362 1524 1524 HOH HOH D . +U 10 HOH 363 1527 1527 HOH HOH D . +U 10 HOH 364 1529 1529 HOH HOH D . +U 10 HOH 365 1531 1531 HOH HOH D . +U 10 HOH 366 1540 1540 HOH HOH D . +U 10 HOH 367 1542 1542 HOH HOH D . +U 10 HOH 368 1545 1545 HOH HOH D . +U 10 HOH 369 1547 1547 HOH HOH D . +U 10 HOH 370 1552 1552 HOH HOH D . +U 10 HOH 371 1558 1558 HOH HOH D . +U 10 HOH 372 1574 1574 HOH HOH D . +U 10 HOH 373 1575 1575 HOH HOH D . +U 10 HOH 374 1579 1579 HOH HOH D . +U 10 HOH 375 1581 1581 HOH HOH D . +U 10 HOH 376 1591 1591 HOH HOH D . +U 10 HOH 377 1593 1593 HOH HOH D . +U 10 HOH 378 1594 1594 HOH HOH D . +U 10 HOH 379 1610 1610 HOH HOH D . +U 10 HOH 380 1615 1615 HOH HOH D . +U 10 HOH 381 1623 1623 HOH HOH D . +U 10 HOH 382 1632 1632 HOH HOH D . +U 10 HOH 383 1635 1635 HOH HOH D . +U 10 HOH 384 1639 1639 HOH HOH D . +U 10 HOH 385 1641 1641 HOH HOH D . +U 10 HOH 386 1643 1643 HOH HOH D . +U 10 HOH 387 1646 1646 HOH HOH D . +U 10 HOH 388 1651 1651 HOH HOH D . +U 10 HOH 389 1652 1652 HOH HOH D . +U 10 HOH 390 1655 1655 HOH HOH D . +U 10 HOH 391 1656 1656 HOH HOH D . +U 10 HOH 392 1666 1666 HOH HOH D . +U 10 HOH 393 1668 1668 HOH HOH D . +U 10 HOH 394 1671 1671 HOH HOH D . +U 10 HOH 395 1674 1674 HOH HOH D . +U 10 HOH 396 1679 1679 HOH HOH D . +U 10 HOH 397 1684 1684 HOH HOH D . +U 10 HOH 398 1698 1698 HOH HOH D . +U 10 HOH 399 1704 1704 HOH HOH D . +U 10 HOH 400 1709 1709 HOH HOH D . +U 10 HOH 401 1710 1710 HOH HOH D . +U 10 HOH 402 1720 1720 HOH HOH D . +U 10 HOH 403 1724 1724 HOH HOH D . +U 10 HOH 404 1725 1725 HOH HOH D . +U 10 HOH 405 1726 1726 HOH HOH D . +U 10 HOH 406 1730 1730 HOH HOH D . +U 10 HOH 407 1739 1739 HOH HOH D . +U 10 HOH 408 1743 1743 HOH HOH D . +U 10 HOH 409 1746 1746 HOH HOH D . +U 10 HOH 410 1757 1757 HOH HOH D . +U 10 HOH 411 1759 1759 HOH HOH D . +U 10 HOH 412 1760 1760 HOH HOH D . +U 10 HOH 413 1764 1764 HOH HOH D . +U 10 HOH 414 1769 1769 HOH HOH D . +U 10 HOH 415 1770 1770 HOH HOH D . +U 10 HOH 416 1776 1776 HOH HOH D . +U 10 HOH 417 1782 1782 HOH HOH D . +U 10 HOH 418 1791 1791 HOH HOH D . +U 10 HOH 419 1794 1794 HOH HOH D . +U 10 HOH 420 1800 1800 HOH HOH D . +U 10 HOH 421 1806 1806 HOH HOH D . +U 10 HOH 422 1809 1809 HOH HOH D . +U 10 HOH 423 1811 1811 HOH HOH D . +U 10 HOH 424 1819 1819 HOH HOH D . +U 10 HOH 425 1825 1825 HOH HOH D . +U 10 HOH 426 1826 1826 HOH HOH D . +U 10 HOH 427 1828 1828 HOH HOH D . +U 10 HOH 428 1838 1838 HOH HOH D . +U 10 HOH 429 1842 1842 HOH HOH D . +U 10 HOH 430 1847 1847 HOH HOH D . +U 10 HOH 431 1848 1848 HOH HOH D . +U 10 HOH 432 1854 1854 HOH HOH D . +U 10 HOH 433 1860 1860 HOH HOH D . +U 10 HOH 434 1868 1868 HOH HOH D . +U 10 HOH 435 1871 1871 HOH HOH D . +U 10 HOH 436 1881 1881 HOH HOH D . +U 10 HOH 437 1894 1894 HOH HOH D . +U 10 HOH 438 1896 1896 HOH HOH D . +U 10 HOH 439 1897 1897 HOH HOH D . +U 10 HOH 440 1905 1905 HOH HOH D . +U 10 HOH 441 1908 1908 HOH HOH D . +U 10 HOH 442 1911 1911 HOH HOH D . +U 10 HOH 443 1920 1920 HOH HOH D . +U 10 HOH 444 1922 1922 HOH HOH D . +U 10 HOH 445 1925 1925 HOH HOH D . +U 10 HOH 446 1928 1928 HOH HOH D . +U 10 HOH 447 1935 1935 HOH HOH D . +U 10 HOH 448 1939 1939 HOH HOH D . +U 10 HOH 449 1940 1940 HOH HOH D . +U 10 HOH 450 1942 1942 HOH HOH D . +U 10 HOH 451 1945 1945 HOH HOH D . +U 10 HOH 452 1954 1954 HOH HOH D . +U 10 HOH 453 1957 1957 HOH HOH D . +U 10 HOH 454 1961 1961 HOH HOH D . +U 10 HOH 455 1964 1964 HOH HOH D . +U 10 HOH 456 1973 1973 HOH HOH D . +U 10 HOH 457 1981 1981 HOH HOH D . +U 10 HOH 458 1983 1983 HOH HOH D . +U 10 HOH 459 1989 1989 HOH HOH D . +U 10 HOH 460 1995 1995 HOH HOH D . +U 10 HOH 461 1996 1996 HOH HOH D . +U 10 HOH 462 1999 1999 HOH HOH D . +U 10 HOH 463 2001 2001 HOH HOH D . +U 10 HOH 464 2005 2005 HOH HOH D . +U 10 HOH 465 2007 2007 HOH HOH D . +U 10 HOH 466 2013 2013 HOH HOH D . +U 10 HOH 467 2017 2017 HOH HOH D . +U 10 HOH 468 2021 2021 HOH HOH D . +U 10 HOH 469 2027 2027 HOH HOH D . +U 10 HOH 470 2031 2031 HOH HOH D . +U 10 HOH 471 2034 2034 HOH HOH D . +U 10 HOH 472 2037 2037 HOH HOH D . +U 10 HOH 473 2042 2042 HOH HOH D . +U 10 HOH 474 2053 2053 HOH HOH D . +U 10 HOH 475 2054 2054 HOH HOH D . +U 10 HOH 476 2057 2057 HOH HOH D . +U 10 HOH 477 2058 2058 HOH HOH D . +U 10 HOH 478 2059 2059 HOH HOH D . +U 10 HOH 479 2062 2062 HOH HOH D . +U 10 HOH 480 2065 2065 HOH HOH D . +U 10 HOH 481 2068 2068 HOH HOH D . +U 10 HOH 482 2073 2073 HOH HOH D . +U 10 HOH 483 2076 2076 HOH HOH D . +U 10 HOH 484 2077 2077 HOH HOH D . +U 10 HOH 485 2078 2078 HOH HOH D . +U 10 HOH 486 2085 2085 HOH HOH D . +U 10 HOH 487 2090 2090 HOH HOH D . +U 10 HOH 488 2091 2091 HOH HOH D . +U 10 HOH 489 2092 2092 HOH HOH D . +U 10 HOH 490 2093 2093 HOH HOH D . +U 10 HOH 491 2101 2101 HOH HOH D . +U 10 HOH 492 2106 2106 HOH HOH D . +U 10 HOH 493 2107 2107 HOH HOH D . +U 10 HOH 494 2108 2108 HOH HOH D . +U 10 HOH 495 2113 2113 HOH HOH D . +U 10 HOH 496 2122 2122 HOH HOH D . +U 10 HOH 497 2124 2124 HOH HOH D . +U 10 HOH 498 2126 2126 HOH HOH D . +U 10 HOH 499 2128 2128 HOH HOH D . +U 10 HOH 500 2132 2132 HOH HOH D . +U 10 HOH 501 2134 2134 HOH HOH D . +U 10 HOH 502 2143 2143 HOH HOH D . +U 10 HOH 503 2146 2146 HOH HOH D . +U 10 HOH 504 2153 2153 HOH HOH D . +U 10 HOH 505 2155 2155 HOH HOH D . +U 10 HOH 506 2158 2158 HOH HOH D . +U 10 HOH 507 2164 2164 HOH HOH D . +U 10 HOH 508 2165 2165 HOH HOH D . +U 10 HOH 509 2166 2166 HOH HOH D . +U 10 HOH 510 2169 2169 HOH HOH D . +U 10 HOH 511 2174 2174 HOH HOH D . +U 10 HOH 512 2176 2176 HOH HOH D . +U 10 HOH 513 2177 2177 HOH HOH D . +U 10 HOH 514 2184 2184 HOH HOH D . +U 10 HOH 515 2187 2187 HOH HOH D . +U 10 HOH 516 2198 2198 HOH HOH D . +U 10 HOH 517 2200 2200 HOH HOH D . +U 10 HOH 518 2205 2205 HOH HOH D . +U 10 HOH 519 2206 2206 HOH HOH D . +U 10 HOH 520 2209 2209 HOH HOH D . +U 10 HOH 521 2212 2212 HOH HOH D . +U 10 HOH 522 2216 2216 HOH HOH D . +U 10 HOH 523 2217 2217 HOH HOH D . +U 10 HOH 524 2218 2218 HOH HOH D . +U 10 HOH 525 2220 2220 HOH HOH D . +U 10 HOH 526 2222 2222 HOH HOH D . +U 10 HOH 527 2224 2224 HOH HOH D . +U 10 HOH 528 2228 2228 HOH HOH D . +U 10 HOH 529 2234 2234 HOH HOH D . +U 10 HOH 530 2245 2245 HOH HOH D . +U 10 HOH 531 2258 2258 HOH HOH D . +U 10 HOH 532 2259 2259 HOH HOH D . +U 10 HOH 533 2264 2264 HOH HOH D . +U 10 HOH 534 2278 2278 HOH HOH D . +U 10 HOH 535 2280 2280 HOH HOH D . +U 10 HOH 536 2286 2286 HOH HOH D . +U 10 HOH 537 2288 2288 HOH HOH D . +U 10 HOH 538 2294 2294 HOH HOH D . +U 10 HOH 539 2295 2295 HOH HOH D . +U 10 HOH 540 2300 2300 HOH HOH D . +U 10 HOH 541 2305 2305 HOH HOH D . +U 10 HOH 542 2306 2306 HOH HOH D . +U 10 HOH 543 2309 2309 HOH HOH D . +U 10 HOH 544 2310 2310 HOH HOH D . +U 10 HOH 545 2311 2311 HOH HOH D . +U 10 HOH 546 2312 2312 HOH HOH D . +U 10 HOH 547 2315 2315 HOH HOH D . +U 10 HOH 548 2320 2320 HOH HOH D . +U 10 HOH 549 2321 2321 HOH HOH D . +U 10 HOH 550 2322 2322 HOH HOH D . +U 10 HOH 551 2325 2325 HOH HOH D . +U 10 HOH 552 2332 2332 HOH HOH D . +U 10 HOH 553 2333 2333 HOH HOH D . +U 10 HOH 554 2340 2340 HOH HOH D . +U 10 HOH 555 2342 2342 HOH HOH D . +U 10 HOH 556 2348 2348 HOH HOH D . +U 10 HOH 557 2351 2351 HOH HOH D . +U 10 HOH 558 2353 2353 HOH HOH D . +U 10 HOH 559 2355 2355 HOH HOH D . +U 10 HOH 560 2364 2364 HOH HOH D . +U 10 HOH 561 2367 2367 HOH HOH D . +U 10 HOH 562 2371 2371 HOH HOH D . +U 10 HOH 563 2373 2373 HOH HOH D . +U 10 HOH 564 2376 2376 HOH HOH D . +U 10 HOH 565 2382 2382 HOH HOH D . +U 10 HOH 566 2386 2386 HOH HOH D . +U 10 HOH 567 2390 2390 HOH HOH D . +U 10 HOH 568 2394 2394 HOH HOH D . +U 10 HOH 569 2395 2395 HOH HOH D . +U 10 HOH 570 2398 2398 HOH HOH D . +U 10 HOH 571 2399 2399 HOH HOH D . +U 10 HOH 572 2401 2401 HOH HOH D . +U 10 HOH 573 2415 2415 HOH HOH D . +U 10 HOH 574 2420 2420 HOH HOH D . +U 10 HOH 575 2421 2421 HOH HOH D . +U 10 HOH 576 2428 2428 HOH HOH D . +U 10 HOH 577 2430 2430 HOH HOH D . +U 10 HOH 578 2431 2431 HOH HOH D . +U 10 HOH 579 2442 2442 HOH HOH D . +U 10 HOH 580 2444 2444 HOH HOH D . +U 10 HOH 581 2445 2445 HOH HOH D . +U 10 HOH 582 2446 2446 HOH HOH D . +U 10 HOH 583 2456 2456 HOH HOH D . +U 10 HOH 584 2459 2459 HOH HOH D . +U 10 HOH 585 2469 2469 HOH HOH D . +U 10 HOH 586 2476 2476 HOH HOH D . +U 10 HOH 587 2479 2479 HOH HOH D . +U 10 HOH 588 2481 2481 HOH HOH D . +U 10 HOH 589 2496 2496 HOH HOH D . +U 10 HOH 590 2497 2497 HOH HOH D . +U 10 HOH 591 2498 2498 HOH HOH D . +U 10 HOH 592 2499 2499 HOH HOH D . +U 10 HOH 593 2502 2502 HOH HOH D . +U 10 HOH 594 2503 2503 HOH HOH D . +U 10 HOH 595 2520 2520 HOH HOH D . +U 10 HOH 596 2522 2522 HOH HOH D . +U 10 HOH 597 2538 2538 HOH HOH D . +U 10 HOH 598 2561 2561 HOH HOH D . +U 10 HOH 599 2563 2563 HOH HOH D . +U 10 HOH 600 2565 2565 HOH HOH D . +U 10 HOH 601 2566 2566 HOH HOH D . +U 10 HOH 602 2567 2567 HOH HOH D . +U 10 HOH 603 2572 2572 HOH HOH D . +U 10 HOH 604 2573 2573 HOH HOH D . +U 10 HOH 605 2574 2574 HOH HOH D . +U 10 HOH 606 2578 2578 HOH HOH D . +U 10 HOH 607 2579 2579 HOH HOH D . +U 10 HOH 608 2593 2593 HOH HOH D . +U 10 HOH 609 2594 2594 HOH HOH D . +U 10 HOH 610 2605 2605 HOH HOH D . +U 10 HOH 611 2606 2606 HOH HOH D . +U 10 HOH 612 2616 2616 HOH HOH D . +U 10 HOH 613 2622 2622 HOH HOH D . +U 10 HOH 614 2627 2627 HOH HOH D . +U 10 HOH 615 2628 2628 HOH HOH D . +U 10 HOH 616 2638 2638 HOH HOH D . +U 10 HOH 617 2642 2642 HOH HOH D . +U 10 HOH 618 2645 2645 HOH HOH D . +U 10 HOH 619 2646 2646 HOH HOH D . +U 10 HOH 620 2647 2647 HOH HOH D . +U 10 HOH 621 2649 2649 HOH HOH D . +U 10 HOH 622 2662 2662 HOH HOH D . +U 10 HOH 623 2670 2670 HOH HOH D . +U 10 HOH 624 2686 2686 HOH HOH D . +U 10 HOH 625 2690 2690 HOH HOH D . +U 10 HOH 626 2696 2696 HOH HOH D . +U 10 HOH 627 2698 2698 HOH HOH D . +U 10 HOH 628 2711 2711 HOH HOH D . +U 10 HOH 629 2714 2714 HOH HOH D . +U 10 HOH 630 2720 2720 HOH HOH D . +U 10 HOH 631 2724 2724 HOH HOH D . +U 10 HOH 632 2729 2729 HOH HOH D . +U 10 HOH 633 2736 2736 HOH HOH D . +U 10 HOH 634 2740 2740 HOH HOH D . +U 10 HOH 635 2749 2749 HOH HOH D . +U 10 HOH 636 2751 2751 HOH HOH D . +U 10 HOH 637 2759 2759 HOH HOH D . +U 10 HOH 638 2776 2776 HOH HOH D . +U 10 HOH 639 2778 2778 HOH HOH D . +U 10 HOH 640 2779 2779 HOH HOH D . +U 10 HOH 641 2782 2782 HOH HOH D . +U 10 HOH 642 2793 2793 HOH HOH D . +U 10 HOH 643 2794 2794 HOH HOH D . +U 10 HOH 644 2795 2795 HOH HOH D . +U 10 HOH 645 2796 2796 HOH HOH D . +U 10 HOH 646 2797 2797 HOH HOH D . +V 10 HOH 1 1 1 HOH HOH E . +V 10 HOH 2 7 7 HOH HOH E . +V 10 HOH 3 8 8 HOH HOH E . +V 10 HOH 4 9 9 HOH HOH E . +V 10 HOH 5 10 10 HOH HOH E . +V 10 HOH 6 11 11 HOH HOH E . +V 10 HOH 7 20 20 HOH HOH E . +V 10 HOH 8 634 4 HOH HOH E . +V 10 HOH 9 635 22 HOH HOH E . +V 10 HOH 10 636 34 HOH HOH E . +V 10 HOH 11 637 637 HOH HOH E . +V 10 HOH 12 638 41 HOH HOH E . +V 10 HOH 13 639 42 HOH HOH E . +V 10 HOH 14 640 52 HOH HOH E . +V 10 HOH 15 641 54 HOH HOH E . +V 10 HOH 16 642 55 HOH HOH E . +V 10 HOH 17 643 643 HOH HOH E . +V 10 HOH 18 644 644 HOH HOH E . +V 10 HOH 19 645 57 HOH HOH E . +V 10 HOH 20 646 58 HOH HOH E . +V 10 HOH 21 647 63 HOH HOH E . +V 10 HOH 22 648 65 HOH HOH E . +V 10 HOH 23 649 68 HOH HOH E . +V 10 HOH 24 662 662 HOH HOH E . +V 10 HOH 25 663 71 HOH HOH E . +V 10 HOH 26 664 73 HOH HOH E . +V 10 HOH 27 665 74 HOH HOH E . +V 10 HOH 28 666 666 HOH HOH E . +V 10 HOH 29 667 81 HOH HOH E . +V 10 HOH 30 668 83 HOH HOH E . +V 10 HOH 31 669 87 HOH HOH E . +V 10 HOH 32 670 93 HOH HOH E . +V 10 HOH 33 671 106 HOH HOH E . +V 10 HOH 34 672 110 HOH HOH E . +V 10 HOH 35 673 673 HOH HOH E . +V 10 HOH 36 674 112 HOH HOH E . +V 10 HOH 37 675 118 HOH HOH E . +V 10 HOH 38 676 122 HOH HOH E . +V 10 HOH 39 677 677 HOH HOH E . +V 10 HOH 40 678 124 HOH HOH E . +V 10 HOH 41 679 129 HOH HOH E . +V 10 HOH 42 680 130 HOH HOH E . +V 10 HOH 43 681 681 HOH HOH E . +V 10 HOH 44 682 144 HOH HOH E . +V 10 HOH 45 683 683 HOH HOH E . +V 10 HOH 46 684 147 HOH HOH E . +V 10 HOH 47 685 148 HOH HOH E . +V 10 HOH 48 686 149 HOH HOH E . +V 10 HOH 49 687 151 HOH HOH E . +V 10 HOH 50 688 152 HOH HOH E . +V 10 HOH 51 689 689 HOH HOH E . +V 10 HOH 52 690 153 HOH HOH E . +V 10 HOH 53 691 156 HOH HOH E . +V 10 HOH 54 692 157 HOH HOH E . +V 10 HOH 55 693 693 HOH HOH E . +V 10 HOH 56 694 158 HOH HOH E . +V 10 HOH 57 695 159 HOH HOH E . +V 10 HOH 58 696 160 HOH HOH E . +V 10 HOH 59 697 161 HOH HOH E . +V 10 HOH 60 698 162 HOH HOH E . +V 10 HOH 61 699 163 HOH HOH E . +V 10 HOH 62 700 700 HOH HOH E . +V 10 HOH 63 701 701 HOH HOH E . +V 10 HOH 64 702 170 HOH HOH E . +V 10 HOH 65 703 177 HOH HOH E . +V 10 HOH 66 704 181 HOH HOH E . +V 10 HOH 67 705 186 HOH HOH E . +V 10 HOH 68 706 706 HOH HOH E . +V 10 HOH 69 707 707 HOH HOH E . +V 10 HOH 70 708 189 HOH HOH E . +V 10 HOH 71 709 195 HOH HOH E . +V 10 HOH 72 710 199 HOH HOH E . +V 10 HOH 73 711 203 HOH HOH E . +V 10 HOH 74 712 208 HOH HOH E . +V 10 HOH 75 713 713 HOH HOH E . +V 10 HOH 76 714 209 HOH HOH E . +V 10 HOH 77 715 212 HOH HOH E . +V 10 HOH 78 716 215 HOH HOH E . +V 10 HOH 79 717 218 HOH HOH E . +V 10 HOH 80 718 718 HOH HOH E . +V 10 HOH 81 719 223 HOH HOH E . +V 10 HOH 82 720 224 HOH HOH E . +V 10 HOH 83 721 227 HOH HOH E . +V 10 HOH 84 722 237 HOH HOH E . +V 10 HOH 85 723 238 HOH HOH E . +V 10 HOH 86 724 239 HOH HOH E . +V 10 HOH 87 725 245 HOH HOH E . +V 10 HOH 88 726 246 HOH HOH E . +V 10 HOH 89 727 250 HOH HOH E . +V 10 HOH 90 728 253 HOH HOH E . +V 10 HOH 91 729 258 HOH HOH E . +V 10 HOH 92 730 730 HOH HOH E . +V 10 HOH 93 731 731 HOH HOH E . +V 10 HOH 94 732 259 HOH HOH E . +V 10 HOH 95 733 262 HOH HOH E . +V 10 HOH 96 734 734 HOH HOH E . +V 10 HOH 97 735 735 HOH HOH E . +V 10 HOH 98 736 736 HOH HOH E . +V 10 HOH 99 737 737 HOH HOH E . +V 10 HOH 100 738 738 HOH HOH E . +V 10 HOH 101 739 273 HOH HOH E . +V 10 HOH 102 740 275 HOH HOH E . +V 10 HOH 103 741 741 HOH HOH E . +V 10 HOH 104 742 278 HOH HOH E . +V 10 HOH 105 743 743 HOH HOH E . +V 10 HOH 106 744 279 HOH HOH E . +V 10 HOH 107 745 745 HOH HOH E . +V 10 HOH 108 746 280 HOH HOH E . +V 10 HOH 109 747 291 HOH HOH E . +V 10 HOH 110 748 292 HOH HOH E . +V 10 HOH 111 749 749 HOH HOH E . +V 10 HOH 112 750 294 HOH HOH E . +V 10 HOH 113 751 295 HOH HOH E . +V 10 HOH 114 752 752 HOH HOH E . +V 10 HOH 115 753 301 HOH HOH E . +V 10 HOH 116 754 302 HOH HOH E . +V 10 HOH 117 755 304 HOH HOH E . +V 10 HOH 118 756 756 HOH HOH E . +V 10 HOH 119 757 757 HOH HOH E . +V 10 HOH 120 758 305 HOH HOH E . +V 10 HOH 121 759 759 HOH HOH E . +V 10 HOH 122 760 760 HOH HOH E . +V 10 HOH 123 761 310 HOH HOH E . +V 10 HOH 124 762 762 HOH HOH E . +V 10 HOH 125 763 311 HOH HOH E . +V 10 HOH 126 764 764 HOH HOH E . +V 10 HOH 127 765 315 HOH HOH E . +V 10 HOH 128 766 319 HOH HOH E . +V 10 HOH 129 767 320 HOH HOH E . +V 10 HOH 130 768 322 HOH HOH E . +V 10 HOH 131 769 325 HOH HOH E . +V 10 HOH 132 770 328 HOH HOH E . +V 10 HOH 133 771 771 HOH HOH E . +V 10 HOH 134 772 331 HOH HOH E . +V 10 HOH 135 773 332 HOH HOH E . +V 10 HOH 136 774 774 HOH HOH E . +V 10 HOH 137 775 339 HOH HOH E . +V 10 HOH 138 776 340 HOH HOH E . +V 10 HOH 139 777 777 HOH HOH E . +V 10 HOH 140 778 341 HOH HOH E . +V 10 HOH 141 779 779 HOH HOH E . +V 10 HOH 142 780 344 HOH HOH E . +V 10 HOH 143 781 781 HOH HOH E . +V 10 HOH 144 782 349 HOH HOH E . +V 10 HOH 145 783 354 HOH HOH E . +V 10 HOH 146 784 367 HOH HOH E . +V 10 HOH 147 785 368 HOH HOH E . +V 10 HOH 148 786 786 HOH HOH E . +V 10 HOH 149 787 369 HOH HOH E . +V 10 HOH 150 788 788 HOH HOH E . +V 10 HOH 151 789 789 HOH HOH E . +V 10 HOH 152 790 370 HOH HOH E . +V 10 HOH 153 791 373 HOH HOH E . +V 10 HOH 154 792 792 HOH HOH E . +V 10 HOH 155 793 793 HOH HOH E . +V 10 HOH 156 794 794 HOH HOH E . +V 10 HOH 157 795 380 HOH HOH E . +V 10 HOH 158 796 383 HOH HOH E . +V 10 HOH 159 797 384 HOH HOH E . +V 10 HOH 160 798 391 HOH HOH E . +V 10 HOH 161 799 397 HOH HOH E . +V 10 HOH 162 800 800 HOH HOH E . +V 10 HOH 163 801 402 HOH HOH E . +V 10 HOH 164 802 404 HOH HOH E . +V 10 HOH 165 803 406 HOH HOH E . +V 10 HOH 166 804 409 HOH HOH E . +V 10 HOH 167 805 412 HOH HOH E . +V 10 HOH 168 806 806 HOH HOH E . +V 10 HOH 169 807 807 HOH HOH E . +V 10 HOH 170 808 413 HOH HOH E . +V 10 HOH 171 809 415 HOH HOH E . +V 10 HOH 172 810 423 HOH HOH E . +V 10 HOH 173 811 811 HOH HOH E . +V 10 HOH 174 812 425 HOH HOH E . +V 10 HOH 175 813 440 HOH HOH E . +V 10 HOH 176 814 449 HOH HOH E . +V 10 HOH 177 815 452 HOH HOH E . +V 10 HOH 178 816 461 HOH HOH E . +V 10 HOH 179 817 817 HOH HOH E . +V 10 HOH 180 818 469 HOH HOH E . +V 10 HOH 181 819 475 HOH HOH E . +V 10 HOH 182 820 479 HOH HOH E . +V 10 HOH 183 821 491 HOH HOH E . +V 10 HOH 184 822 822 HOH HOH E . +V 10 HOH 185 823 492 HOH HOH E . +V 10 HOH 186 824 494 HOH HOH E . +V 10 HOH 187 825 496 HOH HOH E . +V 10 HOH 188 826 497 HOH HOH E . +V 10 HOH 189 827 499 HOH HOH E . +V 10 HOH 190 828 507 HOH HOH E . +V 10 HOH 191 829 512 HOH HOH E . +V 10 HOH 192 830 522 HOH HOH E . +V 10 HOH 193 831 525 HOH HOH E . +V 10 HOH 194 832 537 HOH HOH E . +V 10 HOH 195 833 833 HOH HOH E . +V 10 HOH 196 834 834 HOH HOH E . +V 10 HOH 197 835 542 HOH HOH E . +V 10 HOH 198 836 836 HOH HOH E . +V 10 HOH 199 837 547 HOH HOH E . +V 10 HOH 200 838 548 HOH HOH E . +V 10 HOH 201 839 549 HOH HOH E . +V 10 HOH 202 840 552 HOH HOH E . +V 10 HOH 203 841 567 HOH HOH E . +V 10 HOH 204 842 570 HOH HOH E . +V 10 HOH 205 843 843 HOH HOH E . +V 10 HOH 206 844 579 HOH HOH E . +V 10 HOH 207 845 590 HOH HOH E . +V 10 HOH 208 846 846 HOH HOH E . +V 10 HOH 209 847 591 HOH HOH E . +V 10 HOH 210 848 592 HOH HOH E . +V 10 HOH 211 849 593 HOH HOH E . +V 10 HOH 212 850 594 HOH HOH E . +V 10 HOH 213 851 851 HOH HOH E . +V 10 HOH 214 852 608 HOH HOH E . +V 10 HOH 215 853 853 HOH HOH E . +V 10 HOH 216 854 621 HOH HOH E . +V 10 HOH 217 855 623 HOH HOH E . +V 10 HOH 218 856 625 HOH HOH E . +V 10 HOH 219 857 628 HOH HOH E . +V 10 HOH 220 858 858 HOH HOH E . +V 10 HOH 221 859 629 HOH HOH E . +V 10 HOH 222 860 631 HOH HOH E . +V 10 HOH 223 861 861 HOH HOH E . +V 10 HOH 224 862 660 HOH HOH E . +V 10 HOH 225 870 870 HOH HOH E . +V 10 HOH 226 871 871 HOH HOH E . +V 10 HOH 227 873 873 HOH HOH E . +V 10 HOH 228 874 874 HOH HOH E . +V 10 HOH 229 875 875 HOH HOH E . +V 10 HOH 230 878 878 HOH HOH E . +V 10 HOH 231 880 880 HOH HOH E . +V 10 HOH 232 882 882 HOH HOH E . +V 10 HOH 233 885 885 HOH HOH E . +V 10 HOH 234 887 887 HOH HOH E . +V 10 HOH 235 892 892 HOH HOH E . +V 10 HOH 236 899 899 HOH HOH E . +V 10 HOH 237 904 904 HOH HOH E . +V 10 HOH 238 906 906 HOH HOH E . +V 10 HOH 239 910 910 HOH HOH E . +V 10 HOH 240 912 912 HOH HOH E . +V 10 HOH 241 928 928 HOH HOH E . +V 10 HOH 242 929 929 HOH HOH E . +V 10 HOH 243 933 933 HOH HOH E . +V 10 HOH 244 936 936 HOH HOH E . +V 10 HOH 245 945 945 HOH HOH E . +V 10 HOH 246 948 948 HOH HOH E . +V 10 HOH 247 951 951 HOH HOH E . +V 10 HOH 248 952 952 HOH HOH E . +V 10 HOH 249 953 953 HOH HOH E . +V 10 HOH 250 958 958 HOH HOH E . +V 10 HOH 251 963 963 HOH HOH E . +V 10 HOH 252 967 967 HOH HOH E . +V 10 HOH 253 972 972 HOH HOH E . +V 10 HOH 254 975 975 HOH HOH E . +V 10 HOH 255 976 976 HOH HOH E . +V 10 HOH 256 978 978 HOH HOH E . +V 10 HOH 257 988 988 HOH HOH E . +V 10 HOH 258 989 989 HOH HOH E . +V 10 HOH 259 991 991 HOH HOH E . +V 10 HOH 260 995 995 HOH HOH E . +V 10 HOH 261 997 997 HOH HOH E . +V 10 HOH 262 998 998 HOH HOH E . +V 10 HOH 263 1000 1000 HOH HOH E . +V 10 HOH 264 1004 1004 HOH HOH E . +V 10 HOH 265 1016 1016 HOH HOH E . +V 10 HOH 266 1019 1019 HOH HOH E . +V 10 HOH 267 1020 1020 HOH HOH E . +V 10 HOH 268 1021 1021 HOH HOH E . +V 10 HOH 269 1024 1024 HOH HOH E . +V 10 HOH 270 1026 1026 HOH HOH E . +V 10 HOH 271 1028 1028 HOH HOH E . +V 10 HOH 272 1029 1029 HOH HOH E . +V 10 HOH 273 1034 1034 HOH HOH E . +V 10 HOH 274 1035 1035 HOH HOH E . +V 10 HOH 275 1045 1045 HOH HOH E . +V 10 HOH 276 1046 1046 HOH HOH E . +V 10 HOH 277 1047 1047 HOH HOH E . +V 10 HOH 278 1049 1049 HOH HOH E . +V 10 HOH 279 1053 1053 HOH HOH E . +V 10 HOH 280 1054 1054 HOH HOH E . +V 10 HOH 281 1056 1056 HOH HOH E . +V 10 HOH 282 1058 1058 HOH HOH E . +V 10 HOH 283 1063 1063 HOH HOH E . +V 10 HOH 284 1070 1070 HOH HOH E . +V 10 HOH 285 1073 1073 HOH HOH E . +V 10 HOH 286 1076 1076 HOH HOH E . +V 10 HOH 287 1079 1079 HOH HOH E . +V 10 HOH 288 1080 1080 HOH HOH E . +V 10 HOH 289 1081 1081 HOH HOH E . +V 10 HOH 290 1082 1082 HOH HOH E . +V 10 HOH 291 1085 1085 HOH HOH E . +V 10 HOH 292 1087 1087 HOH HOH E . +V 10 HOH 293 1088 1088 HOH HOH E . +V 10 HOH 294 1093 1093 HOH HOH E . +V 10 HOH 295 1094 1094 HOH HOH E . +V 10 HOH 296 1102 1102 HOH HOH E . +V 10 HOH 297 1103 1103 HOH HOH E . +V 10 HOH 298 1105 1105 HOH HOH E . +V 10 HOH 299 1106 1106 HOH HOH E . +V 10 HOH 300 1110 1110 HOH HOH E . +V 10 HOH 301 1114 1114 HOH HOH E . +V 10 HOH 302 1117 1117 HOH HOH E . +V 10 HOH 303 1120 1120 HOH HOH E . +V 10 HOH 304 1122 1122 HOH HOH E . +V 10 HOH 305 1123 1123 HOH HOH E . +V 10 HOH 306 1124 1124 HOH HOH E . +V 10 HOH 307 1125 1125 HOH HOH E . +V 10 HOH 308 1129 1129 HOH HOH E . +V 10 HOH 309 1131 1131 HOH HOH E . +V 10 HOH 310 1133 1133 HOH HOH E . +V 10 HOH 311 1136 1136 HOH HOH E . +V 10 HOH 312 1137 1137 HOH HOH E . +V 10 HOH 313 1139 1139 HOH HOH E . +V 10 HOH 314 1142 1142 HOH HOH E . +V 10 HOH 315 1144 1144 HOH HOH E . +V 10 HOH 316 1146 1146 HOH HOH E . +V 10 HOH 317 1152 1152 HOH HOH E . +V 10 HOH 318 1153 1153 HOH HOH E . +V 10 HOH 319 1156 1156 HOH HOH E . +V 10 HOH 320 1165 1165 HOH HOH E . +V 10 HOH 321 1170 1170 HOH HOH E . +V 10 HOH 322 1171 1171 HOH HOH E . +V 10 HOH 323 1173 1173 HOH HOH E . +V 10 HOH 324 1179 1179 HOH HOH E . +V 10 HOH 325 1183 1183 HOH HOH E . +V 10 HOH 326 1193 1193 HOH HOH E . +V 10 HOH 327 1195 1195 HOH HOH E . +V 10 HOH 328 1197 1197 HOH HOH E . +V 10 HOH 329 1198 1198 HOH HOH E . +V 10 HOH 330 1203 1203 HOH HOH E . +V 10 HOH 331 1207 1207 HOH HOH E . +V 10 HOH 332 1211 1211 HOH HOH E . +V 10 HOH 333 1213 1213 HOH HOH E . +V 10 HOH 334 1215 1215 HOH HOH E . +V 10 HOH 335 1218 1218 HOH HOH E . +V 10 HOH 336 1221 1221 HOH HOH E . +V 10 HOH 337 1222 1222 HOH HOH E . +V 10 HOH 338 1223 1223 HOH HOH E . +V 10 HOH 339 1224 1224 HOH HOH E . +V 10 HOH 340 1230 1230 HOH HOH E . +V 10 HOH 341 1235 1235 HOH HOH E . +V 10 HOH 342 1240 1240 HOH HOH E . +V 10 HOH 343 1244 1244 HOH HOH E . +V 10 HOH 344 1246 1246 HOH HOH E . +V 10 HOH 345 1252 1252 HOH HOH E . +V 10 HOH 346 1263 1263 HOH HOH E . +V 10 HOH 347 1265 1265 HOH HOH E . +V 10 HOH 348 1268 1268 HOH HOH E . +V 10 HOH 349 1274 1274 HOH HOH E . +V 10 HOH 350 1279 1279 HOH HOH E . +V 10 HOH 351 1284 1284 HOH HOH E . +V 10 HOH 352 1289 1289 HOH HOH E . +V 10 HOH 353 1294 1294 HOH HOH E . +V 10 HOH 354 1299 1299 HOH HOH E . +V 10 HOH 355 1308 1308 HOH HOH E . +V 10 HOH 356 1310 1310 HOH HOH E . +V 10 HOH 357 1316 1316 HOH HOH E . +V 10 HOH 358 1320 1320 HOH HOH E . +V 10 HOH 359 1321 1321 HOH HOH E . +V 10 HOH 360 1327 1327 HOH HOH E . +V 10 HOH 361 1328 1328 HOH HOH E . +V 10 HOH 362 1330 1330 HOH HOH E . +V 10 HOH 363 1333 1333 HOH HOH E . +V 10 HOH 364 1336 1336 HOH HOH E . +V 10 HOH 365 1337 1337 HOH HOH E . +V 10 HOH 366 1341 1341 HOH HOH E . +V 10 HOH 367 1346 1346 HOH HOH E . +V 10 HOH 368 1347 1347 HOH HOH E . +V 10 HOH 369 1349 1349 HOH HOH E . +V 10 HOH 370 1350 1350 HOH HOH E . +V 10 HOH 371 1360 1360 HOH HOH E . +V 10 HOH 372 1370 1370 HOH HOH E . +V 10 HOH 373 1371 1371 HOH HOH E . +V 10 HOH 374 1373 1373 HOH HOH E . +V 10 HOH 375 1379 1379 HOH HOH E . +V 10 HOH 376 1381 1381 HOH HOH E . +V 10 HOH 377 1382 1382 HOH HOH E . +V 10 HOH 378 1383 1383 HOH HOH E . +V 10 HOH 379 1384 1384 HOH HOH E . +V 10 HOH 380 1391 1391 HOH HOH E . +V 10 HOH 381 1392 1392 HOH HOH E . +V 10 HOH 382 1393 1393 HOH HOH E . +V 10 HOH 383 1402 1402 HOH HOH E . +V 10 HOH 384 1403 1403 HOH HOH E . +V 10 HOH 385 1404 1404 HOH HOH E . +V 10 HOH 386 1409 1409 HOH HOH E . +V 10 HOH 387 1412 1412 HOH HOH E . +V 10 HOH 388 1418 1418 HOH HOH E . +V 10 HOH 389 1419 1419 HOH HOH E . +V 10 HOH 390 1421 1421 HOH HOH E . +V 10 HOH 391 1423 1423 HOH HOH E . +V 10 HOH 392 1424 1424 HOH HOH E . +V 10 HOH 393 1428 1428 HOH HOH E . +V 10 HOH 394 1430 1430 HOH HOH E . +V 10 HOH 395 1435 1435 HOH HOH E . +V 10 HOH 396 1436 1436 HOH HOH E . +V 10 HOH 397 1441 1441 HOH HOH E . +V 10 HOH 398 1444 1444 HOH HOH E . +V 10 HOH 399 1449 1449 HOH HOH E . +V 10 HOH 400 1452 1452 HOH HOH E . +V 10 HOH 401 1454 1454 HOH HOH E . +V 10 HOH 402 1459 1459 HOH HOH E . +V 10 HOH 403 1464 1464 HOH HOH E . +V 10 HOH 404 1465 1465 HOH HOH E . +V 10 HOH 405 1473 1473 HOH HOH E . +V 10 HOH 406 1475 1475 HOH HOH E . +V 10 HOH 407 1478 1478 HOH HOH E . +V 10 HOH 408 1479 1479 HOH HOH E . +V 10 HOH 409 1482 1482 HOH HOH E . +V 10 HOH 410 1488 1488 HOH HOH E . +V 10 HOH 411 1489 1489 HOH HOH E . +V 10 HOH 412 1491 1491 HOH HOH E . +V 10 HOH 413 1494 1494 HOH HOH E . +V 10 HOH 414 1503 1503 HOH HOH E . +V 10 HOH 415 1505 1505 HOH HOH E . +V 10 HOH 416 1509 1509 HOH HOH E . +V 10 HOH 417 1512 1512 HOH HOH E . +V 10 HOH 418 1515 1515 HOH HOH E . +V 10 HOH 419 1522 1522 HOH HOH E . +V 10 HOH 420 1526 1526 HOH HOH E . +V 10 HOH 421 1532 1532 HOH HOH E . +V 10 HOH 422 1537 1537 HOH HOH E . +V 10 HOH 423 1541 1541 HOH HOH E . +V 10 HOH 424 1544 1544 HOH HOH E . +V 10 HOH 425 1556 1556 HOH HOH E . +V 10 HOH 426 1561 1561 HOH HOH E . +V 10 HOH 427 1563 1563 HOH HOH E . +V 10 HOH 428 1566 1566 HOH HOH E . +V 10 HOH 429 1567 1567 HOH HOH E . +V 10 HOH 430 1576 1576 HOH HOH E . +V 10 HOH 431 1577 1577 HOH HOH E . +V 10 HOH 432 1578 1578 HOH HOH E . +V 10 HOH 433 1580 1580 HOH HOH E . +V 10 HOH 434 1584 1584 HOH HOH E . +V 10 HOH 435 1589 1589 HOH HOH E . +V 10 HOH 436 1590 1590 HOH HOH E . +V 10 HOH 437 1592 1592 HOH HOH E . +V 10 HOH 438 1603 1603 HOH HOH E . +V 10 HOH 439 1612 1612 HOH HOH E . +V 10 HOH 440 1617 1617 HOH HOH E . +V 10 HOH 441 1621 1621 HOH HOH E . +V 10 HOH 442 1622 1622 HOH HOH E . +V 10 HOH 443 1628 1628 HOH HOH E . +V 10 HOH 444 1633 1633 HOH HOH E . +V 10 HOH 445 1634 1634 HOH HOH E . +V 10 HOH 446 1637 1637 HOH HOH E . +V 10 HOH 447 1638 1638 HOH HOH E . +V 10 HOH 448 1642 1642 HOH HOH E . +V 10 HOH 449 1645 1645 HOH HOH E . +V 10 HOH 450 1647 1647 HOH HOH E . +V 10 HOH 451 1657 1657 HOH HOH E . +V 10 HOH 452 1659 1659 HOH HOH E . +V 10 HOH 453 1661 1661 HOH HOH E . +V 10 HOH 454 1662 1662 HOH HOH E . +V 10 HOH 455 1669 1669 HOH HOH E . +V 10 HOH 456 1672 1672 HOH HOH E . +V 10 HOH 457 1675 1675 HOH HOH E . +V 10 HOH 458 1680 1680 HOH HOH E . +V 10 HOH 459 1681 1681 HOH HOH E . +V 10 HOH 460 1683 1683 HOH HOH E . +V 10 HOH 461 1688 1688 HOH HOH E . +V 10 HOH 462 1691 1691 HOH HOH E . +V 10 HOH 463 1692 1692 HOH HOH E . +V 10 HOH 464 1696 1696 HOH HOH E . +V 10 HOH 465 1699 1699 HOH HOH E . +V 10 HOH 466 1700 1700 HOH HOH E . +V 10 HOH 467 1702 1702 HOH HOH E . +V 10 HOH 468 1705 1705 HOH HOH E . +V 10 HOH 469 1707 1707 HOH HOH E . +V 10 HOH 470 1708 1708 HOH HOH E . +V 10 HOH 471 1712 1712 HOH HOH E . +V 10 HOH 472 1721 1721 HOH HOH E . +V 10 HOH 473 1722 1722 HOH HOH E . +V 10 HOH 474 1723 1723 HOH HOH E . +V 10 HOH 475 1728 1728 HOH HOH E . +V 10 HOH 476 1729 1729 HOH HOH E . +V 10 HOH 477 1737 1737 HOH HOH E . +V 10 HOH 478 1738 1738 HOH HOH E . +V 10 HOH 479 1740 1740 HOH HOH E . +V 10 HOH 480 1754 1754 HOH HOH E . +V 10 HOH 481 1756 1756 HOH HOH E . +V 10 HOH 482 1758 1758 HOH HOH E . +V 10 HOH 483 1761 1761 HOH HOH E . +V 10 HOH 484 1762 1762 HOH HOH E . +V 10 HOH 485 1763 1763 HOH HOH E . +V 10 HOH 486 1765 1765 HOH HOH E . +V 10 HOH 487 1768 1768 HOH HOH E . +V 10 HOH 488 1773 1773 HOH HOH E . +V 10 HOH 489 1775 1775 HOH HOH E . +V 10 HOH 490 1783 1783 HOH HOH E . +V 10 HOH 491 1789 1789 HOH HOH E . +V 10 HOH 492 1803 1803 HOH HOH E . +V 10 HOH 493 1814 1814 HOH HOH E . +V 10 HOH 494 1824 1824 HOH HOH E . +V 10 HOH 495 1829 1829 HOH HOH E . +V 10 HOH 496 1831 1831 HOH HOH E . +V 10 HOH 497 1840 1840 HOH HOH E . +V 10 HOH 498 1846 1846 HOH HOH E . +V 10 HOH 499 1851 1851 HOH HOH E . +V 10 HOH 500 1858 1858 HOH HOH E . +V 10 HOH 501 1861 1861 HOH HOH E . +V 10 HOH 502 1862 1862 HOH HOH E . +V 10 HOH 503 1865 1865 HOH HOH E . +V 10 HOH 504 1870 1870 HOH HOH E . +V 10 HOH 505 1873 1873 HOH HOH E . +V 10 HOH 506 1874 1874 HOH HOH E . +V 10 HOH 507 1877 1877 HOH HOH E . +V 10 HOH 508 1880 1880 HOH HOH E . +V 10 HOH 509 1887 1887 HOH HOH E . +V 10 HOH 510 1888 1888 HOH HOH E . +V 10 HOH 511 1891 1891 HOH HOH E . +V 10 HOH 512 1902 1902 HOH HOH E . +V 10 HOH 513 1906 1906 HOH HOH E . +V 10 HOH 514 1910 1910 HOH HOH E . +V 10 HOH 515 1913 1913 HOH HOH E . +V 10 HOH 516 1916 1916 HOH HOH E . +V 10 HOH 517 1921 1921 HOH HOH E . +V 10 HOH 518 1923 1923 HOH HOH E . +V 10 HOH 519 1926 1926 HOH HOH E . +V 10 HOH 520 1930 1930 HOH HOH E . +V 10 HOH 521 1931 1931 HOH HOH E . +V 10 HOH 522 1936 1936 HOH HOH E . +V 10 HOH 523 1947 1947 HOH HOH E . +V 10 HOH 524 1953 1953 HOH HOH E . +V 10 HOH 525 1955 1955 HOH HOH E . +V 10 HOH 526 1958 1958 HOH HOH E . +V 10 HOH 527 1959 1959 HOH HOH E . +V 10 HOH 528 1960 1960 HOH HOH E . +V 10 HOH 529 1968 1968 HOH HOH E . +V 10 HOH 530 1975 1975 HOH HOH E . +V 10 HOH 531 1979 1979 HOH HOH E . +V 10 HOH 532 1982 1982 HOH HOH E . +V 10 HOH 533 1985 1985 HOH HOH E . +V 10 HOH 534 1986 1986 HOH HOH E . +V 10 HOH 535 1988 1988 HOH HOH E . +V 10 HOH 536 1991 1991 HOH HOH E . +V 10 HOH 537 1992 1992 HOH HOH E . +V 10 HOH 538 1998 1998 HOH HOH E . +V 10 HOH 539 2008 2008 HOH HOH E . +V 10 HOH 540 2020 2020 HOH HOH E . +V 10 HOH 541 2022 2022 HOH HOH E . +V 10 HOH 542 2025 2025 HOH HOH E . +V 10 HOH 543 2026 2026 HOH HOH E . +V 10 HOH 544 2029 2029 HOH HOH E . +V 10 HOH 545 2039 2039 HOH HOH E . +V 10 HOH 546 2040 2040 HOH HOH E . +V 10 HOH 547 2041 2041 HOH HOH E . +V 10 HOH 548 2045 2045 HOH HOH E . +V 10 HOH 549 2048 2048 HOH HOH E . +V 10 HOH 550 2056 2056 HOH HOH E . +V 10 HOH 551 2060 2060 HOH HOH E . +V 10 HOH 552 2063 2063 HOH HOH E . +V 10 HOH 553 2064 2064 HOH HOH E . +V 10 HOH 554 2066 2066 HOH HOH E . +V 10 HOH 555 2067 2067 HOH HOH E . +V 10 HOH 556 2069 2069 HOH HOH E . +V 10 HOH 557 2074 2074 HOH HOH E . +V 10 HOH 558 2084 2084 HOH HOH E . +V 10 HOH 559 2094 2094 HOH HOH E . +V 10 HOH 560 2095 2095 HOH HOH E . +V 10 HOH 561 2096 2096 HOH HOH E . +V 10 HOH 562 2105 2105 HOH HOH E . +V 10 HOH 563 2109 2109 HOH HOH E . +V 10 HOH 564 2115 2115 HOH HOH E . +V 10 HOH 565 2117 2117 HOH HOH E . +V 10 HOH 566 2118 2118 HOH HOH E . +V 10 HOH 567 2136 2136 HOH HOH E . +V 10 HOH 568 2137 2137 HOH HOH E . +V 10 HOH 569 2138 2138 HOH HOH E . +V 10 HOH 570 2141 2141 HOH HOH E . +V 10 HOH 571 2149 2149 HOH HOH E . +V 10 HOH 572 2154 2154 HOH HOH E . +V 10 HOH 573 2157 2157 HOH HOH E . +V 10 HOH 574 2163 2163 HOH HOH E . +V 10 HOH 575 2173 2173 HOH HOH E . +V 10 HOH 576 2175 2175 HOH HOH E . +V 10 HOH 577 2183 2183 HOH HOH E . +V 10 HOH 578 2186 2186 HOH HOH E . +V 10 HOH 579 2188 2188 HOH HOH E . +V 10 HOH 580 2189 2189 HOH HOH E . +V 10 HOH 581 2195 2195 HOH HOH E . +V 10 HOH 582 2196 2196 HOH HOH E . +V 10 HOH 583 2197 2197 HOH HOH E . +V 10 HOH 584 2199 2199 HOH HOH E . +V 10 HOH 585 2201 2201 HOH HOH E . +V 10 HOH 586 2211 2211 HOH HOH E . +V 10 HOH 587 2213 2213 HOH HOH E . +V 10 HOH 588 2215 2215 HOH HOH E . +V 10 HOH 589 2227 2227 HOH HOH E . +V 10 HOH 590 2230 2230 HOH HOH E . +V 10 HOH 591 2236 2236 HOH HOH E . +V 10 HOH 592 2243 2243 HOH HOH E . +V 10 HOH 593 2246 2246 HOH HOH E . +V 10 HOH 594 2249 2249 HOH HOH E . +V 10 HOH 595 2250 2250 HOH HOH E . +V 10 HOH 596 2252 2252 HOH HOH E . +V 10 HOH 597 2254 2254 HOH HOH E . +V 10 HOH 598 2255 2255 HOH HOH E . +V 10 HOH 599 2257 2257 HOH HOH E . +V 10 HOH 600 2261 2261 HOH HOH E . +V 10 HOH 601 2265 2265 HOH HOH E . +V 10 HOH 602 2273 2273 HOH HOH E . +V 10 HOH 603 2275 2275 HOH HOH E . +V 10 HOH 604 2282 2282 HOH HOH E . +V 10 HOH 605 2287 2287 HOH HOH E . +V 10 HOH 606 2291 2291 HOH HOH E . +V 10 HOH 607 2297 2297 HOH HOH E . +V 10 HOH 608 2301 2301 HOH HOH E . +V 10 HOH 609 2302 2302 HOH HOH E . +V 10 HOH 610 2304 2304 HOH HOH E . +V 10 HOH 611 2313 2313 HOH HOH E . +V 10 HOH 612 2314 2314 HOH HOH E . +V 10 HOH 613 2324 2324 HOH HOH E . +V 10 HOH 614 2328 2328 HOH HOH E . +V 10 HOH 615 2330 2330 HOH HOH E . +V 10 HOH 616 2335 2335 HOH HOH E . +V 10 HOH 617 2336 2336 HOH HOH E . +V 10 HOH 618 2338 2338 HOH HOH E . +V 10 HOH 619 2339 2339 HOH HOH E . +V 10 HOH 620 2344 2344 HOH HOH E . +V 10 HOH 621 2345 2345 HOH HOH E . +V 10 HOH 622 2347 2347 HOH HOH E . +V 10 HOH 623 2349 2349 HOH HOH E . +V 10 HOH 624 2358 2358 HOH HOH E . +V 10 HOH 625 2359 2359 HOH HOH E . +V 10 HOH 626 2360 2360 HOH HOH E . +V 10 HOH 627 2361 2361 HOH HOH E . +V 10 HOH 628 2368 2368 HOH HOH E . +V 10 HOH 629 2369 2369 HOH HOH E . +V 10 HOH 630 2372 2372 HOH HOH E . +V 10 HOH 631 2375 2375 HOH HOH E . +V 10 HOH 632 2381 2381 HOH HOH E . +V 10 HOH 633 2383 2383 HOH HOH E . +V 10 HOH 634 2385 2385 HOH HOH E . +V 10 HOH 635 2388 2388 HOH HOH E . +V 10 HOH 636 2393 2393 HOH HOH E . +V 10 HOH 637 2396 2396 HOH HOH E . +V 10 HOH 638 2397 2397 HOH HOH E . +V 10 HOH 639 2400 2400 HOH HOH E . +V 10 HOH 640 2403 2403 HOH HOH E . +V 10 HOH 641 2404 2404 HOH HOH E . +V 10 HOH 642 2405 2405 HOH HOH E . +V 10 HOH 643 2406 2406 HOH HOH E . +V 10 HOH 644 2408 2408 HOH HOH E . +V 10 HOH 645 2411 2411 HOH HOH E . +V 10 HOH 646 2412 2412 HOH HOH E . +V 10 HOH 647 2413 2413 HOH HOH E . +V 10 HOH 648 2417 2417 HOH HOH E . +V 10 HOH 649 2418 2418 HOH HOH E . +V 10 HOH 650 2419 2419 HOH HOH E . +V 10 HOH 651 2423 2423 HOH HOH E . +V 10 HOH 652 2424 2424 HOH HOH E . +V 10 HOH 653 2426 2426 HOH HOH E . +V 10 HOH 654 2429 2429 HOH HOH E . +V 10 HOH 655 2434 2434 HOH HOH E . +V 10 HOH 656 2438 2438 HOH HOH E . +V 10 HOH 657 2439 2439 HOH HOH E . +V 10 HOH 658 2441 2441 HOH HOH E . +V 10 HOH 659 2454 2454 HOH HOH E . +V 10 HOH 660 2457 2457 HOH HOH E . +V 10 HOH 661 2460 2460 HOH HOH E . +V 10 HOH 662 2461 2461 HOH HOH E . +V 10 HOH 663 2463 2463 HOH HOH E . +V 10 HOH 664 2465 2465 HOH HOH E . +V 10 HOH 665 2470 2470 HOH HOH E . +V 10 HOH 666 2471 2471 HOH HOH E . +V 10 HOH 667 2473 2473 HOH HOH E . +V 10 HOH 668 2475 2475 HOH HOH E . +V 10 HOH 669 2477 2477 HOH HOH E . +V 10 HOH 670 2480 2480 HOH HOH E . +V 10 HOH 671 2482 2482 HOH HOH E . +V 10 HOH 672 2485 2485 HOH HOH E . +V 10 HOH 673 2487 2487 HOH HOH E . +V 10 HOH 674 2489 2489 HOH HOH E . +V 10 HOH 675 2490 2490 HOH HOH E . +V 10 HOH 676 2491 2491 HOH HOH E . +V 10 HOH 677 2501 2501 HOH HOH E . +V 10 HOH 678 2508 2508 HOH HOH E . +V 10 HOH 679 2518 2518 HOH HOH E . +V 10 HOH 680 2519 2519 HOH HOH E . +V 10 HOH 681 2527 2527 HOH HOH E . +V 10 HOH 682 2529 2529 HOH HOH E . +V 10 HOH 683 2533 2533 HOH HOH E . +V 10 HOH 684 2534 2534 HOH HOH E . +V 10 HOH 685 2535 2535 HOH HOH E . +V 10 HOH 686 2537 2537 HOH HOH E . +V 10 HOH 687 2539 2539 HOH HOH E . +V 10 HOH 688 2562 2562 HOH HOH E . +V 10 HOH 689 2564 2564 HOH HOH E . +V 10 HOH 690 2575 2575 HOH HOH E . +V 10 HOH 691 2582 2582 HOH HOH E . +V 10 HOH 692 2589 2589 HOH HOH E . +V 10 HOH 693 2590 2590 HOH HOH E . +V 10 HOH 694 2591 2591 HOH HOH E . +V 10 HOH 695 2592 2592 HOH HOH E . +V 10 HOH 696 2596 2596 HOH HOH E . +V 10 HOH 697 2600 2600 HOH HOH E . +V 10 HOH 698 2601 2601 HOH HOH E . +V 10 HOH 699 2602 2602 HOH HOH E . +V 10 HOH 700 2607 2607 HOH HOH E . +V 10 HOH 701 2608 2608 HOH HOH E . +V 10 HOH 702 2610 2610 HOH HOH E . +V 10 HOH 703 2614 2614 HOH HOH E . +V 10 HOH 704 2617 2617 HOH HOH E . +V 10 HOH 705 2618 2618 HOH HOH E . +V 10 HOH 706 2620 2620 HOH HOH E . +V 10 HOH 707 2621 2621 HOH HOH E . +V 10 HOH 708 2624 2624 HOH HOH E . +V 10 HOH 709 2625 2625 HOH HOH E . +V 10 HOH 710 2629 2629 HOH HOH E . +V 10 HOH 711 2630 2630 HOH HOH E . +V 10 HOH 712 2635 2635 HOH HOH E . +V 10 HOH 713 2636 2636 HOH HOH E . +V 10 HOH 714 2640 2640 HOH HOH E . +V 10 HOH 715 2643 2643 HOH HOH E . +V 10 HOH 716 2644 2644 HOH HOH E . +V 10 HOH 717 2651 2651 HOH HOH E . +V 10 HOH 718 2652 2652 HOH HOH E . +V 10 HOH 719 2661 2661 HOH HOH E . +V 10 HOH 720 2664 2664 HOH HOH E . +V 10 HOH 721 2666 2666 HOH HOH E . +V 10 HOH 722 2667 2667 HOH HOH E . +V 10 HOH 723 2668 2668 HOH HOH E . +V 10 HOH 724 2679 2679 HOH HOH E . +V 10 HOH 725 2680 2680 HOH HOH E . +V 10 HOH 726 2681 2681 HOH HOH E . +V 10 HOH 727 2683 2683 HOH HOH E . +V 10 HOH 728 2684 2684 HOH HOH E . +V 10 HOH 729 2688 2688 HOH HOH E . +V 10 HOH 730 2693 2693 HOH HOH E . +V 10 HOH 731 2694 2694 HOH HOH E . +V 10 HOH 732 2695 2695 HOH HOH E . +V 10 HOH 733 2697 2697 HOH HOH E . +V 10 HOH 734 2700 2700 HOH HOH E . +V 10 HOH 735 2701 2701 HOH HOH E . +V 10 HOH 736 2702 2702 HOH HOH E . +V 10 HOH 737 2704 2704 HOH HOH E . +V 10 HOH 738 2705 2705 HOH HOH E . +V 10 HOH 739 2706 2706 HOH HOH E . +V 10 HOH 740 2709 2709 HOH HOH E . +V 10 HOH 741 2715 2715 HOH HOH E . +V 10 HOH 742 2721 2721 HOH HOH E . +V 10 HOH 743 2723 2723 HOH HOH E . +V 10 HOH 744 2727 2727 HOH HOH E . +V 10 HOH 745 2728 2728 HOH HOH E . +V 10 HOH 746 2730 2730 HOH HOH E . +V 10 HOH 747 2731 2731 HOH HOH E . +V 10 HOH 748 2732 2732 HOH HOH E . +V 10 HOH 749 2742 2742 HOH HOH E . +V 10 HOH 750 2744 2744 HOH HOH E . +V 10 HOH 751 2746 2746 HOH HOH E . +V 10 HOH 752 2747 2747 HOH HOH E . +V 10 HOH 753 2753 2753 HOH HOH E . +V 10 HOH 754 2755 2755 HOH HOH E . +V 10 HOH 755 2757 2757 HOH HOH E . +V 10 HOH 756 2758 2758 HOH HOH E . +V 10 HOH 757 2768 2768 HOH HOH E . +V 10 HOH 758 2772 2772 HOH HOH E . +V 10 HOH 759 2774 2774 HOH HOH E . +V 10 HOH 760 2775 2775 HOH HOH E . +V 10 HOH 761 2786 2786 HOH HOH E . +V 10 HOH 762 2788 2788 HOH HOH E . +V 10 HOH 763 2803 2803 HOH HOH E . +V 10 HOH 764 2805 2805 HOH HOH E . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 0 A HIS 424 ? CG ? A HIS 404 CG +2 1 Y 0 A HIS 424 ? ND1 ? A HIS 404 ND1 +3 1 Y 0 A HIS 424 ? CD2 ? A HIS 404 CD2 +4 1 Y 0 A HIS 424 ? CE1 ? A HIS 404 CE1 +5 1 Y 0 A HIS 424 ? NE2 ? A HIS 404 NE2 +6 1 Y 0 A LYS 628 ? CE ? A LYS 608 CE +7 1 Y 0 A LYS 628 ? NZ ? A LYS 608 NZ +8 1 Y 1 B LEU 23 ? CG ? B LEU 3 CG +9 1 Y 1 B LEU 23 ? CD1 ? B LEU 3 CD1 +10 1 Y 1 B LEU 23 ? CD2 ? B LEU 3 CD2 +11 1 Y 0 B ARG 110 ? CD ? B ARG 90 CD +12 1 Y 0 B ARG 110 ? NE ? B ARG 90 NE +13 1 Y 0 B ARG 110 ? CZ ? B ARG 90 CZ +14 1 Y 0 B ARG 110 ? NH1 ? B ARG 90 NH1 +15 1 Y 0 B ARG 110 ? NH2 ? B ARG 90 NH2 +16 1 Y 0 B GLN 239 ? CG ? B GLN 219 CG +17 1 Y 0 B GLN 239 ? CD ? B GLN 219 CD +18 1 Y 0 B GLN 239 ? NE2 ? B GLN 219 NE2 +19 1 Y 0 B LYS 281 ? CE ? B LYS 261 CE +20 1 Y 0 B LYS 281 ? NZ ? B LYS 261 NZ +21 1 Y 0 D GLU 295 ? CG ? C GLU 275 CG +22 1 Y 0 D GLU 295 ? CD ? C GLU 275 CD +23 1 Y 0 D GLU 295 ? OE1 ? C GLU 275 OE1 +24 1 Y 0 D GLU 295 ? OE2 ? C GLU 275 OE2 +25 1 Y 1 E LEU 23 ? CG ? D LEU 3 CG +26 1 Y 1 E LEU 23 ? CD1 ? D LEU 3 CD1 +27 1 Y 1 E LEU 23 ? CD2 ? D LEU 3 CD2 +28 1 Y 1 E ARG 165 ? CG ? D ARG 145 CG +29 1 Y 1 E ARG 165 ? CD ? D ARG 145 CD +30 1 Y 1 E ARG 165 ? NE ? D ARG 145 NE +31 1 Y 1 E ARG 165 ? CZ ? D ARG 145 CZ +32 1 Y 1 E ARG 165 ? NH1 ? D ARG 145 NH1 +33 1 Y 1 E ARG 165 ? NH2 ? D ARG 145 NH2 +34 1 Y 0 E LYS 194 ? CE ? D LYS 174 CE +35 1 Y 0 E LYS 194 ? NZ ? D LYS 174 NZ +36 1 Y 0 E GLU 266 ? OE1 ? D GLU 246 OE1 +37 1 Y 0 E GLU 266 ? OE2 ? D GLU 246 OE2 +38 1 Y 0 E GLU 295 ? OE1 ? D GLU 275 OE1 +39 1 Y 0 E GLU 295 ? OE2 ? D GLU 275 OE2 +40 1 Y 0 E LYS 563 ? NZ ? D LYS 543 NZ +41 1 Y 0 E GLU 624 ? CD ? D GLU 604 CD +42 1 Y 0 E GLU 624 ? OE1 ? D GLU 604 OE1 +43 1 Y 0 E GLU 624 ? OE2 ? D GLU 604 OE2 +# +loop_ +_software.pdbx_ordinal +_software.name +_software.version +_software.date +_software.type +_software.contact_author +_software.contact_author_email +_software.classification +_software.location +_software.language +_software.citation_id +1 DENZO . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data reduction' +http://www.hkl-xray.com/ ? ? +2 SCALEPACK . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data scaling' +http://www.hkl-xray.com/ ? ? +3 AMoRE . ? program 'Jorge Navaza' ccp4@ccp4.ac.uk phasing http://www.ccp4.ac.uk/ +Fortran_77 ? +4 REFMAC 5.2.0019 ? program 'Garib N. Murshudov' garib@ysbl.york.ac.uk refinement +http://www.ccp4.ac.uk/dist/html/refmac5.html Fortran_77 ? +5 PDB_EXTRACT 3.005 'June 11, 2008' package PDB help@deposit.rcsb.org 'data extraction' +http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? +6 HKL-2000 . ? ? ? ? 'data reduction' ? ? ? +7 HKL-2000 . ? ? ? ? 'data scaling' ? ? ? +# +_cell.length_a 93.578 +_cell.length_b 123.115 +_cell.length_c 266.135 +_cell.angle_alpha 90.000 +_cell.angle_beta 90.000 +_cell.angle_gamma 90.000 +_cell.entry_id 3HN3 +_cell.pdbx_unique_axis ? +_cell.Z_PDB 16 +_cell.length_a_esd ? +_cell.length_b_esd ? +_cell.length_c_esd ? +_cell.angle_alpha_esd ? +_cell.angle_beta_esd ? +_cell.angle_gamma_esd ? +# +_symmetry.space_group_name_H-M 'P 21 21 21' +_symmetry.entry_id 3HN3 +_symmetry.Int_Tables_number 19 +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.space_group_name_Hall ? +# +_exptl.crystals_number 1 +_exptl.entry_id 3HN3 +_exptl.method 'X-RAY DIFFRACTION' +# +_exptl_crystal.id 1 +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +_exptl_crystal.density_Matthews 2.71 +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_percent_sol 54.58 +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.preparation ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' +_exptl_crystal_grow.pH 7.5 +_exptl_crystal_grow.temp 277 +_exptl_crystal_grow.pdbx_details '10mM Tris-HCl pH 7.5, 15% v/v MPD, VAPOR DIFFUSION, HANGING DROP, temperature 277K' +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pdbx_pH_range . +# +_diffrn.id 1 +_diffrn.ambient_temp 100.000000 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'Bruker AXIOM 200' +_diffrn_detector.pdbx_collection_date 1998-06-19 +_diffrn_detector.details ? +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.monochromator ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1.0 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'APS BEAMLINE 17-ID' +_diffrn_source.pdbx_synchrotron_beamline 17-ID +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_wavelength_list 1.0 +_diffrn_source.pdbx_synchrotron_site APS +# +_reflns.entry_id 3HN3 +_reflns.d_resolution_high 1.670 +_reflns.d_resolution_low 20.000 +_reflns.number_obs 316019 +_reflns.pdbx_Rmerge_I_obs 0.103 +_reflns.pdbx_netI_over_sigmaI 11.182 +_reflns.pdbx_chi_squared 1.119 +_reflns.percent_possible_obs 88.400 +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.number_all ? +_reflns.pdbx_Rsym_value ? +_reflns.B_iso_Wilson_estimate ? +_reflns.pdbx_redundancy ? +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_ordinal 1 +_reflns.pdbx_diffrn_id 1 +# +loop_ +_reflns_shell.d_res_high +_reflns_shell.d_res_low +_reflns_shell.number_measured_obs +_reflns_shell.number_measured_all +_reflns_shell.number_unique_obs +_reflns_shell.Rmerge_I_obs +_reflns_shell.meanI_over_sigI_obs +_reflns_shell.pdbx_Rsym_value +_reflns_shell.pdbx_chi_squared +_reflns_shell.pdbx_redundancy +_reflns_shell.percent_possible_obs +_reflns_shell.number_unique_all +_reflns_shell.percent_possible_all +_reflns_shell.pdbx_ordinal +_reflns_shell.pdbx_diffrn_id +1.67 1.73 ? ? ? 0.488 ? ? 0.321 ? ? 26041 73.60 1 1 +1.73 1.80 ? ? ? 0.366 ? ? 0.341 ? ? 27282 76.80 2 1 +1.80 1.88 ? ? ? 0.297 ? ? 0.379 ? ? 28506 80.30 3 1 +1.88 1.98 ? ? ? 0.264 ? ? 0.559 ? ? 29898 84.10 4 1 +1.98 2.10 ? ? ? 0.183 ? ? 0.626 ? ? 31176 87.60 5 1 +2.10 2.27 ? ? ? 0.154 ? ? 0.837 ? ? 32314 90.60 6 1 +2.27 2.49 ? ? ? 0.126 ? ? 1.082 ? ? 33621 94.10 7 1 +2.49 2.85 ? ? ? 0.111 ? ? 1.360 ? ? 34549 96.40 8 1 +2.85 3.59 ? ? ? 0.087 ? ? 1.981 ? ? 35810 99.40 9 1 +3.59 20.00 ? ? ? 0.068 ? ? 2.044 ? ? 36822 99.90 10 1 +# +_refine.entry_id 3HN3 +_refine.ls_d_res_high 1.700 +_refine.ls_d_res_low 19.90 +_refine.pdbx_ls_sigma_F 0.00 +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.ls_percent_reflns_obs 90.660 +_refine.ls_number_reflns_obs 304658 +_refine.ls_number_reflns_all ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.pdbx_R_Free_selection_details RANDOM +_refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.205 +_refine.ls_R_factor_R_work 0.203 +_refine.ls_wR_factor_R_work ? +_refine.ls_R_factor_R_free 0.240 +_refine.ls_wR_factor_R_free ? +_refine.ls_percent_reflns_R_free 5.100 +_refine.ls_number_reflns_R_free 15434 +_refine.ls_R_factor_R_free_error ? +_refine.B_iso_mean 15.528 +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.pdbx_isotropic_thermal_model ? +_refine.aniso_B[1][1] 0.470 +_refine.aniso_B[2][2] 0.040 +_refine.aniso_B[3][3] -0.500 +_refine.aniso_B[1][2] 0.000 +_refine.aniso_B[1][3] 0.000 +_refine.aniso_B[2][3] 0.000 +_refine.correlation_coeff_Fo_to_Fc 0.923 +_refine.correlation_coeff_Fo_to_Fc_free 0.898 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.pdbx_overall_ESU_R 0.126 +_refine.pdbx_overall_ESU_R_Free 0.122 +_refine.overall_SU_ML 0.076 +_refine.overall_SU_B 2.220 +_refine.solvent_model_details 'BABINET MODEL WITH MASK' +_refine.pdbx_solvent_vdw_probe_radii 1.200 +_refine.pdbx_solvent_ion_probe_radii 0.800 +_refine.pdbx_solvent_shrinkage_radii 0.800 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.pdbx_starting_model ? +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.overall_FOM_work_R_set ? +_refine.B_iso_max 63.93 +_refine.B_iso_min 3.84 +_refine.occupancy_max 1.00 +_refine.occupancy_min 0.00 +_refine.pdbx_ls_sigma_I ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_R_factor_R_free_error_details ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.overall_FOM_free_R_set ? +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_overall_phase_error ? +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 19858 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 572 +_refine_hist.number_atoms_solvent 2807 +_refine_hist.number_atoms_total 23237 +_refine_hist.d_res_high 1.700 +_refine_hist.d_res_low 19.90 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.number +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +r_bond_refined_d 21189 0.009 0.022 ? 'X-RAY DIFFRACTION' ? +r_bond_other_d 14299 0.002 0.020 ? 'X-RAY DIFFRACTION' ? +r_angle_refined_deg 28940 1.264 1.972 ? 'X-RAY DIFFRACTION' ? +r_angle_other_deg 34524 1.031 3.000 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_1_deg 2454 6.397 5.000 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_2_deg 1036 36.007 23.523 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_3_deg 3332 13.420 15.000 ? 'X-RAY DIFFRACTION' ? +r_dihedral_angle_4_deg 140 17.811 15.000 ? 'X-RAY DIFFRACTION' ? +r_chiral_restr 3197 0.080 0.200 ? 'X-RAY DIFFRACTION' ? +r_gen_planes_refined 22999 0.004 0.020 ? 'X-RAY DIFFRACTION' ? +r_gen_planes_other 4477 0.001 0.020 ? 'X-RAY DIFFRACTION' ? +r_nbd_refined 4127 0.197 0.200 ? 'X-RAY DIFFRACTION' ? +r_nbd_other 15652 0.199 0.200 ? 'X-RAY DIFFRACTION' ? +r_nbtor_refined 10276 0.182 0.200 ? 'X-RAY DIFFRACTION' ? +r_nbtor_other 10802 0.086 0.200 ? 'X-RAY DIFFRACTION' ? +r_xyhbond_nbd_refined 2399 0.144 0.200 ? 'X-RAY DIFFRACTION' ? +r_xyhbond_nbd_other 1 0.056 0.200 ? 'X-RAY DIFFRACTION' ? +r_symmetry_vdw_refined 16 0.216 0.200 ? 'X-RAY DIFFRACTION' ? +r_symmetry_vdw_other 57 0.195 0.200 ? 'X-RAY DIFFRACTION' ? +r_symmetry_hbond_refined 51 0.149 0.200 ? 'X-RAY DIFFRACTION' ? +r_mcbond_it 12420 0.582 1.500 ? 'X-RAY DIFFRACTION' ? +r_mcbond_other 4898 0.135 1.500 ? 'X-RAY DIFFRACTION' ? +r_mcangle_it 19790 0.944 2.000 ? 'X-RAY DIFFRACTION' ? +r_scbond_it 10050 1.359 3.000 ? 'X-RAY DIFFRACTION' ? +r_scangle_it 9136 2.034 4.500 ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_shell.d_res_high 1.700 +_refine_ls_shell.d_res_low 1.744 +_refine_ls_shell.pdbx_total_number_of_bins_used 20 +_refine_ls_shell.percent_reflns_obs 80.070 +_refine_ls_shell.number_reflns_R_work 18712 +_refine_ls_shell.R_factor_all ? +_refine_ls_shell.R_factor_R_work 0.233 +_refine_ls_shell.R_factor_R_free 0.310 +_refine_ls_shell.percent_reflns_R_free ? +_refine_ls_shell.number_reflns_R_free 976 +_refine_ls_shell.R_factor_R_free_error ? +_refine_ls_shell.number_reflns_all 19688 +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +# +_struct.entry_id 3HN3 +_struct.title 'Human beta-glucuronidase at 1.7 A resolution' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 3HN3 +_struct_keywords.text +'LYSOSOMAL ENZYME, ACID HYDROLASE, GLYCOSIDASE, Disease mutation, Glycoprotein, Hydrolase, Lysosome, Mucopolysaccharidosis' +_struct_keywords.pdbx_keywords HYDROLASE +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 1 ? +C N N 1 ? +D N N 1 ? +E N N 2 ? +F N N 3 ? +G N N 4 ? +H N N 5 ? +I N N 6 ? +J N N 7 ? +K N N 6 ? +L N N 8 ? +M N N 6 ? +N N N 7 ? +O N N 6 ? +P N N 9 ? +Q N N 8 ? +R N N 7 ? +S N N 10 ? +T N N 10 ? +U N N 10 ? +V N N 10 ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code BGLR_HUMAN +_struct_ref.pdbx_db_accession P08236 +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code +;LGLQGGMLYPQESPSRECKELDGLWSFRADFSDNRRRGFEEQWYRRPLWESGPTVDMPVPSSFNDISQDWRLRHFVGWVW +YEREVILPERWTQDLRTRVVLRIGSAHSYAIVWVNGVDTLEHEGGYLPFEADISNLVQVGPLPSRLRITIAINNTLTPTT +LPPGTIQYLTDTSKYPKGYFVQNTYFDFFNYAGLQRSVLLYTTPTTYIDDITVTTSVEQDSGLVNYQISVKGSNLFKLEV +RLLDAENKVVANGTGTQGQLKVPGVSLWWPYLMHERPAYLYSLEVQLTAQTSLGPVSDFYTLPVGIRTVAVTKSQFLING +KPFYFHGVNKHEDADIRGKGFDWPLLVKDFNLLRWLGANAFRTSHYPYAEEVMQMCDRYGIVVIDECPGVGLALPQFFNN +VSLHHHMQVMEEVVRRDKNHPAVVMWSVANEPASHLESAGYYLKMVIAHTKSLDPSRPVTFVSNSNYAADKGAPYVDVIC +LNSYYSWYHDYGHLELIQLQLATQFENWYKKYQKPIIQSEYGAETIAGFHQDPPLMFTEEYQKSLLEQYHLGLDQKRRKY +VVGELIWNFADFMTEQSPTRVLGNKKGIFTRQRQPKSAAFLLRERYWKIANET +; +_struct_ref.pdbx_align_begin 21 +_struct_ref.pdbx_db_isoform ? +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 3HN3 A 1 ? 613 ? P08236 21 ? 633 ? 21 633 +2 1 3HN3 B 1 ? 613 ? P08236 21 ? 633 ? 21 633 +3 1 3HN3 D 1 ? 613 ? P08236 21 ? 633 ? 21 633 +4 1 3HN3 E 1 ? 613 ? P08236 21 ? 633 ? 21 633 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_and_software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details tetrameric +_pdbx_struct_assembly.oligomeric_count 4 +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 31630 ? +1 MORE 56 ? +1 'SSA (A^2)' 83950 ? +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 ARG A 36 ? GLU A 41 ? ARG A 56 GLU A 61 1 ? 6 +HELX_P HELX_P2 2 GLN A 42 ? ARG A 46 ? GLN A 62 ARG A 66 5 ? 5 +HELX_P HELX_P3 3 PRO A 47 ? GLY A 52 ? PRO A 67 GLY A 72 5 ? 6 +HELX_P HELX_P4 4 ASP A 69 ? HIS A 74 ? ASP A 89 HIS A 94 1 ? 6 +HELX_P HELX_P5 5 PRO A 88 ? ASP A 94 ? PRO A 108 ASP A 114 1 ? 7 +HELX_P HELX_P6 6 ILE A 133 ? GLN A 138 ? ILE A 153 GLN A 158 1 ? 6 +HELX_P HELX_P7 7 ASP A 342 ? GLY A 357 ? ASP A 362 GLY A 377 1 ? 16 +HELX_P HELX_P8 8 ALA A 369 ? GLY A 380 ? ALA A 389 GLY A 400 1 ? 12 +HELX_P HELX_P9 9 LEU A 394 ? PHE A 398 ? LEU A 414 PHE A 418 5 ? 5 +HELX_P HELX_P10 10 ASN A 399 ? LYS A 418 ? ASN A 419 LYS A 438 1 ? 20 +HELX_P HELX_P11 11 LEU A 436 ? ASP A 454 ? LEU A 456 ASP A 474 1 ? 19 +HELX_P HELX_P12 12 GLY A 472 ? VAL A 476 ? GLY A 492 VAL A 496 5 ? 5 +HELX_P HELX_P13 13 HIS A 493 ? GLU A 495 ? HIS A 513 GLU A 515 5 ? 3 +HELX_P HELX_P14 14 LEU A 496 ? GLN A 513 ? LEU A 516 GLN A 533 1 ? 18 +HELX_P HELX_P15 15 THR A 538 ? GLN A 555 ? THR A 558 GLN A 575 1 ? 18 +HELX_P HELX_P16 16 LYS A 596 ? GLU A 612 ? LYS A 616 GLU A 632 1 ? 17 +HELX_P HELX_P17 17 ARG B 36 ? GLU B 41 ? ARG B 56 GLU B 61 1 ? 6 +HELX_P HELX_P18 18 GLN B 42 ? ARG B 46 ? GLN B 62 ARG B 66 5 ? 5 +HELX_P HELX_P19 19 PRO B 47 ? GLY B 52 ? PRO B 67 GLY B 72 5 ? 6 +HELX_P HELX_P20 20 ASP B 69 ? HIS B 74 ? ASP B 89 HIS B 94 1 ? 6 +HELX_P HELX_P21 21 PRO B 88 ? ASP B 94 ? PRO B 108 ASP B 114 1 ? 7 +HELX_P HELX_P22 22 ILE B 133 ? GLN B 138 ? ILE B 153 GLN B 158 1 ? 6 +HELX_P HELX_P23 23 ASP B 342 ? GLY B 357 ? ASP B 362 GLY B 377 1 ? 16 +HELX_P HELX_P24 24 ALA B 369 ? GLY B 380 ? ALA B 389 GLY B 400 1 ? 12 +HELX_P HELX_P25 25 LEU B 394 ? PHE B 398 ? LEU B 414 PHE B 418 5 ? 5 +HELX_P HELX_P26 26 ASN B 399 ? LYS B 418 ? ASN B 419 LYS B 438 1 ? 20 +HELX_P HELX_P27 27 LEU B 436 ? ASP B 454 ? LEU B 456 ASP B 474 1 ? 19 +HELX_P HELX_P28 28 GLY B 472 ? VAL B 476 ? GLY B 492 VAL B 496 5 ? 5 +HELX_P HELX_P29 29 HIS B 493 ? GLU B 495 ? HIS B 513 GLU B 515 5 ? 3 +HELX_P HELX_P30 30 LEU B 496 ? GLN B 513 ? LEU B 516 GLN B 533 1 ? 18 +HELX_P HELX_P31 31 THR B 538 ? ARG B 557 ? THR B 558 ARG B 577 1 ? 20 +HELX_P HELX_P32 32 LYS B 596 ? THR B 613 ? LYS B 616 THR B 633 1 ? 18 +HELX_P HELX_P33 33 ARG C 36 ? GLU C 41 ? ARG D 56 GLU D 61 1 ? 6 +HELX_P HELX_P34 34 GLN C 42 ? ARG C 46 ? GLN D 62 ARG D 66 5 ? 5 +HELX_P HELX_P35 35 PRO C 47 ? GLY C 52 ? PRO D 67 GLY D 72 5 ? 6 +HELX_P HELX_P36 36 PRO C 88 ? ASP C 94 ? PRO D 108 ASP D 114 1 ? 7 +HELX_P HELX_P37 37 ILE C 133 ? GLN C 138 ? ILE D 153 GLN D 158 1 ? 6 +HELX_P HELX_P38 38 ASP C 342 ? GLY C 357 ? ASP D 362 GLY D 377 1 ? 16 +HELX_P HELX_P39 39 ALA C 369 ? GLY C 380 ? ALA D 389 GLY D 400 1 ? 12 +HELX_P HELX_P40 40 LEU C 394 ? PHE C 398 ? LEU D 414 PHE D 418 5 ? 5 +HELX_P HELX_P41 41 ASN C 399 ? LYS C 418 ? ASN D 419 LYS D 438 1 ? 20 +HELX_P HELX_P42 42 LEU C 436 ? ASP C 454 ? LEU D 456 ASP D 474 1 ? 19 +HELX_P HELX_P43 43 GLY C 472 ? VAL C 476 ? GLY D 492 VAL D 496 5 ? 5 +HELX_P HELX_P44 44 HIS C 493 ? GLU C 495 ? HIS D 513 GLU D 515 5 ? 3 +HELX_P HELX_P45 45 LEU C 496 ? GLN C 513 ? LEU D 516 GLN D 533 1 ? 18 +HELX_P HELX_P46 46 THR C 538 ? ARG C 557 ? THR D 558 ARG D 577 1 ? 20 +HELX_P HELX_P47 47 LYS C 596 ? GLU C 612 ? LYS D 616 GLU D 632 1 ? 17 +HELX_P HELX_P48 48 ARG D 36 ? GLU D 41 ? ARG E 56 GLU E 61 1 ? 6 +HELX_P HELX_P49 49 GLN D 42 ? ARG D 46 ? GLN E 62 ARG E 66 5 ? 5 +HELX_P HELX_P50 50 PRO D 47 ? GLY D 52 ? PRO E 67 GLY E 72 5 ? 6 +HELX_P HELX_P51 51 PRO D 88 ? ASP D 94 ? PRO E 108 ASP E 114 1 ? 7 +HELX_P HELX_P52 52 ILE D 133 ? GLN D 138 ? ILE E 153 GLN E 158 1 ? 6 +HELX_P HELX_P53 53 ASP D 342 ? GLY D 357 ? ASP E 362 GLY E 377 1 ? 16 +HELX_P HELX_P54 54 ALA D 369 ? GLY D 380 ? ALA E 389 GLY E 400 1 ? 12 +HELX_P HELX_P55 55 LEU D 394 ? PHE D 398 ? LEU E 414 PHE E 418 5 ? 5 +HELX_P HELX_P56 56 ASN D 399 ? LYS D 418 ? ASN E 419 LYS E 438 1 ? 20 +HELX_P HELX_P57 57 LEU D 436 ? ASP D 454 ? LEU E 456 ASP E 474 1 ? 19 +HELX_P HELX_P58 58 GLY D 472 ? VAL D 476 ? GLY E 492 VAL E 496 5 ? 5 +HELX_P HELX_P59 59 HIS D 493 ? GLU D 495 ? HIS E 513 GLU E 515 5 ? 3 +HELX_P HELX_P60 60 LEU D 496 ? GLN D 513 ? LEU E 516 GLN E 533 1 ? 18 +HELX_P HELX_P61 61 THR D 538 ? GLN D 555 ? THR E 558 GLN E 575 1 ? 18 +HELX_P HELX_P62 62 LYS D 596 ? GLU D 612 ? LYS E 616 GLU E 632 1 ? 17 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +covale1 covale one ? A ASN 153 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 173 C NAG 1 1_555 ? ? ? ? ? ? ? 1.447 ? N-Glycosylation +covale2 covale one ? A ASN 252 ND2 ? ? ? 1_555 I NAG . C1 ? ? A ASN 272 A NAG 650 1_555 ? ? ? ? ? ? ? 1.453 ? N-Glycosylation +covale3 covale one ? B ASN 153 ND2 ? ? ? 1_555 F NAG . C1 ? ? B ASN 173 F NAG 1 1_555 ? ? ? ? ? ? ? 1.452 ? N-Glycosylation +covale4 covale one ? B ASN 252 ND2 ? ? ? 1_555 K NAG . C1 ? ? B ASN 272 B NAG 650 1_555 ? ? ? ? ? ? ? 1.460 ? N-Glycosylation +covale5 covale one ? C ASN 153 ND2 ? ? ? 1_555 G NAG . C1 ? ? D ASN 173 G NAG 1 1_555 ? ? ? ? ? ? ? 1.444 ? N-Glycosylation +covale6 covale one ? C ASN 252 ND2 ? ? ? 1_555 M NAG . C1 ? ? D ASN 272 D NAG 650 1_555 ? ? ? ? ? ? ? 1.457 ? N-Glycosylation +covale7 covale one ? D ASN 153 ND2 ? ? ? 1_555 H NAG . C1 ? ? E ASN 173 H NAG 1 1_555 ? ? ? ? ? ? ? 1.435 ? N-Glycosylation +covale8 covale one ? D ASN 252 ND2 ? ? ? 1_555 O NAG . C1 ? ? E ASN 272 E NAG 650 1_555 ? ? ? ? ? ? ? 1.463 ? N-Glycosylation +covale9 covale both ? E NAG . O4 ? ? ? 1_555 E NAG . C1 ? ? C NAG 1 C NAG 2 1_555 ? ? ? ? ? ? ? 1.432 ? ? +covale10 covale both ? E NAG . O4 ? ? ? 1_555 E BMA . C1 ? ? C NAG 2 C BMA 3 1_555 ? ? ? ? ? ? ? 1.428 ? ? +covale11 covale both ? E BMA . O6 ? ? ? 1_555 E MAN . C1 ? ? C BMA 3 C MAN 4 1_555 ? ? ? ? ? ? ? 1.433 ? ? +covale12 covale both ? E BMA . O3 ? ? ? 1_555 E MAN . C1 ? ? C BMA 3 C MAN 9 1_555 ? ? ? ? ? ? ? 1.429 ? ? +covale13 covale both ? E MAN . O3 ? ? ? 1_555 E MAN . C1 ? ? C MAN 4 C MAN 5 1_555 ? ? ? ? ? ? ? 1.444 ? ? +covale14 covale both ? E MAN . O6 ? ? ? 1_555 E MAN . C1 ? ? C MAN 4 C MAN 7 1_555 ? ? ? ? ? ? ? 1.434 ? ? +covale15 covale both ? E MAN . O2 ? ? ? 1_555 E MAN . C1 ? ? C MAN 5 C MAN 6 1_555 ? ? ? ? ? ? ? 1.440 ? ? +covale16 covale both ? E MAN . O2 ? ? ? 1_555 E MAN . C1 ? ? C MAN 7 C MAN 8 1_555 ? ? ? ? ? ? ? 1.440 ? ? +covale17 covale both ? E MAN . O2 ? ? ? 1_555 E GUP . C1 ? ? C MAN 9 C GUP 10 1_555 ? ? ? ? ? ? ? 1.437 ? ? +covale18 covale both ? F NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? F NAG 1 F NAG 2 1_555 ? ? ? ? ? ? ? 1.433 ? ? +covale19 covale both ? F NAG . O4 ? ? ? 1_555 F BMA . C1 ? ? F NAG 2 F BMA 3 1_555 ? ? ? ? ? ? ? 1.416 ? ? +covale20 covale both ? F BMA . O6 ? ? ? 1_555 F MAN . C1 ? ? F BMA 3 F MAN 4 1_555 ? ? ? ? ? ? ? 1.442 ? ? +covale21 covale both ? F BMA . O3 ? ? ? 1_555 F MAN . C1 ? ? F BMA 3 F MAN 9 1_555 ? ? ? ? ? ? ? 1.420 ? ? +covale22 covale both ? F MAN . O3 ? ? ? 1_555 F MAN . C1 ? ? F MAN 4 F MAN 5 1_555 ? ? ? ? ? ? ? 1.437 ? ? +covale23 covale both ? F MAN . O6 ? ? ? 1_555 F MAN . C1 ? ? F MAN 4 F MAN 7 1_555 ? ? ? ? ? ? ? 1.442 ? ? +covale24 covale both ? F MAN . O2 ? ? ? 1_555 F MAN . C1 ? ? F MAN 5 F MAN 6 1_555 ? ? ? ? ? ? ? 1.434 ? ? +covale25 covale both ? F MAN . O2 ? ? ? 1_555 F MAN . C1 ? ? F MAN 7 F MAN 8 1_555 ? ? ? ? ? ? ? 1.447 ? ? +covale26 covale both ? F MAN . O2 ? ? ? 1_555 F BMA . C1 ? ? F MAN 9 F BMA 10 1_555 ? ? ? ? ? ? ? 1.427 ? ? +covale27 covale both ? G NAG . O4 ? ? ? 1_555 G NAG . C1 ? ? G NAG 1 G NAG 2 1_555 ? ? ? ? ? ? ? 1.436 ? ? +covale28 covale both ? G NAG . O4 ? ? ? 1_555 G BMA . C1 ? ? G NAG 2 G BMA 3 1_555 ? ? ? ? ? ? ? 1.441 ? ? +covale29 covale both ? G BMA . O6 ? ? ? 1_555 G MAN . C1 ? ? G BMA 3 G MAN 4 1_555 ? ? ? ? ? ? ? 1.441 ? ? +covale30 covale both ? G BMA . O3 ? ? ? 1_555 G MAN . C1 ? ? G BMA 3 G MAN 9 1_555 ? ? ? ? ? ? ? 1.422 ? ? +covale31 covale both ? G MAN . O3 ? ? ? 1_555 G MAN . C1 ? ? G MAN 4 G MAN 5 1_555 ? ? ? ? ? ? ? 1.454 ? ? +covale32 covale both ? G MAN . O6 ? ? ? 1_555 G MAN . C1 ? ? G MAN 4 G MAN 7 1_555 ? ? ? ? ? ? ? 1.444 ? ? +covale33 covale both ? G MAN . O2 ? ? ? 1_555 G MAN . C1 ? ? G MAN 5 G MAN 6 1_555 ? ? ? ? ? ? ? 1.440 ? ? +covale34 covale both ? G MAN . O2 ? ? ? 1_555 G MAN . C1 ? ? G MAN 7 G MAN 8 1_555 ? ? ? ? ? ? ? 1.437 ? ? +covale35 covale both ? G MAN . O2 ? ? ? 1_555 G MAN . C1 ? ? G MAN 9 G MAN 10 1_555 ? ? ? ? ? ? ? 1.437 ? ? +covale36 covale both ? H NAG . O4 ? ? ? 1_555 H NAG . C1 ? ? H NAG 1 H NAG 2 1_555 ? ? ? ? ? ? ? 1.440 ? ? +covale37 covale both ? H NAG . O4 ? ? ? 1_555 H BMA . C1 ? ? H NAG 2 H BMA 3 1_555 ? ? ? ? ? ? ? 1.437 ? ? +covale38 covale both ? H BMA . O3 ? ? ? 1_555 H MAN . C1 ? ? H BMA 3 H MAN 4 1_555 ? ? ? ? ? ? ? 1.434 ? ? +covale39 covale both ? H BMA . O6 ? ? ? 1_555 H MAN . C1 ? ? H BMA 3 H MAN 7 1_555 ? ? ? ? ? ? ? 1.438 ? ? +covale40 covale both ? H MAN . O2 ? ? ? 1_555 H MAN . C1 ? ? H MAN 4 H MAN 5 1_555 ? ? ? ? ? ? ? 1.431 ? ? +covale41 covale both ? H MAN . O2 ? ? ? 1_555 H MAN . C1 ? ? H MAN 5 H MAN 6 1_555 ? ? ? ? ? ? ? 1.441 ? ? +covale42 covale both ? H MAN . O6 ? ? ? 1_555 H MAN . C1 ? ? H MAN 7 H MAN 8 1_555 ? ? ? ? ? ? ? 1.440 ? ? +covale43 covale both ? H MAN . O3 ? ? ? 1_555 H MAN . C1 ? ? H MAN 7 H MAN 10 1_555 ? ? ? ? ? ? ? 1.435 ? ? +covale44 covale both ? H MAN . O2 ? ? ? 1_555 H MAN . C1 ? ? H MAN 8 H MAN 9 1_555 ? ? ? ? ? ? ? 1.435 ? ? +# +_struct_conn_type.id covale +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 NAG E . ? ASN A 153 ? NAG C 1 ? 1_555 ASN A 173 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +2 NAG F . ? ASN B 153 ? NAG F 1 ? 1_555 ASN B 173 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +3 NAG G . ? ASN C 153 ? NAG G 1 ? 1_555 ASN D 173 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +4 NAG H . ? ASN D 153 ? NAG H 1 ? 1_555 ASN E 173 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +5 NAG I . ? ASN A 252 ? NAG A 650 ? 1_555 ASN A 272 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +6 NAG K . ? ASN B 252 ? NAG B 650 ? 1_555 ASN B 272 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +7 NAG M . ? ASN C 252 ? NAG D 650 ? 1_555 ASN D 272 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +8 NAG O . ? ASN D 252 ? NAG E 650 ? 1_555 ASN E 272 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +# +loop_ +_struct_mon_prot_cis.pdbx_id +_struct_mon_prot_cis.label_comp_id +_struct_mon_prot_cis.label_seq_id +_struct_mon_prot_cis.label_asym_id +_struct_mon_prot_cis.label_alt_id +_struct_mon_prot_cis.pdbx_PDB_ins_code +_struct_mon_prot_cis.auth_comp_id +_struct_mon_prot_cis.auth_seq_id +_struct_mon_prot_cis.auth_asym_id +_struct_mon_prot_cis.pdbx_label_comp_id_2 +_struct_mon_prot_cis.pdbx_label_seq_id_2 +_struct_mon_prot_cis.pdbx_label_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 +_struct_mon_prot_cis.pdbx_auth_comp_id_2 +_struct_mon_prot_cis.pdbx_auth_seq_id_2 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_model_num +_struct_mon_prot_cis.pdbx_omega_angle +1 VAL 59 A . ? VAL 79 A PRO 60 A ? PRO 80 A 1 -5.10 +2 LEU 161 A . ? LEU 181 A PRO 162 A ? PRO 182 A 1 1.88 +3 SER 364 A . ? SER 384 A HIS 365 A ? HIS 385 A 1 -11.78 +4 ASP 532 A . ? ASP 552 A PRO 533 A ? PRO 553 A 1 -11.34 +5 TRP 567 A . ? TRP 587 A ASN 568 A ? ASN 588 A 1 1.99 +6 VAL 59 B . ? VAL 79 B PRO 60 B ? PRO 80 B 1 0.98 +7 LEU 161 B . ? LEU 181 B PRO 162 B ? PRO 182 B 1 6.75 +8 SER 364 B . ? SER 384 B HIS 365 B ? HIS 385 B 1 -12.75 +9 ASP 532 B . ? ASP 552 B PRO 533 B ? PRO 553 B 1 -6.59 +10 TRP 567 B . ? TRP 587 B ASN 568 B ? ASN 588 B 1 5.29 +11 VAL 59 C . ? VAL 79 D PRO 60 C ? PRO 80 D 1 -1.97 +12 LEU 161 C . ? LEU 181 D PRO 162 C ? PRO 182 D 1 3.82 +13 SER 364 C . ? SER 384 D HIS 365 C ? HIS 385 D 1 -11.22 +14 ASP 532 C . ? ASP 552 D PRO 533 C ? PRO 553 D 1 -6.14 +15 TRP 567 C . ? TRP 587 D ASN 568 C ? ASN 588 D 1 0.57 +16 VAL 59 D . ? VAL 79 E PRO 60 D ? PRO 80 E 1 -0.61 +17 LEU 161 D . ? LEU 181 E PRO 162 D ? PRO 182 E 1 -2.24 +18 SER 364 D . ? SER 384 E HIS 365 D ? HIS 385 E 1 -13.55 +19 ASP 532 D . ? ASP 552 E PRO 533 D ? PRO 553 E 1 -6.64 +20 TRP 567 D . ? TRP 587 E ASN 568 D ? ASN 588 E 1 2.96 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +A ? 4 ? +B ? 6 ? +C ? 2 ? +D ? 3 ? +E ? 4 ? +F ? 3 ? +G ? 9 ? +H ? 4 ? +I ? 6 ? +J ? 2 ? +K ? 3 ? +L ? 4 ? +M ? 3 ? +N ? 9 ? +O ? 4 ? +P ? 6 ? +Q ? 2 ? +R ? 3 ? +S ? 4 ? +T ? 3 ? +U ? 9 ? +V ? 4 ? +W ? 6 ? +X ? 2 ? +Y ? 3 ? +Z ? 4 ? +AA ? 3 ? +AB ? 9 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? anti-parallel +B 1 2 ? anti-parallel +B 2 3 ? anti-parallel +B 3 4 ? anti-parallel +B 4 5 ? anti-parallel +B 5 6 ? anti-parallel +C 1 2 ? anti-parallel +D 1 2 ? anti-parallel +D 2 3 ? anti-parallel +E 1 2 ? anti-parallel +E 2 3 ? anti-parallel +E 3 4 ? anti-parallel +F 1 2 ? anti-parallel +F 2 3 ? anti-parallel +G 1 2 ? parallel +G 2 3 ? parallel +G 3 4 ? parallel +G 4 5 ? parallel +G 5 6 ? parallel +G 6 7 ? parallel +G 7 8 ? parallel +G 8 9 ? parallel +H 1 2 ? anti-parallel +H 2 3 ? anti-parallel +H 3 4 ? anti-parallel +I 1 2 ? anti-parallel +I 2 3 ? anti-parallel +I 3 4 ? anti-parallel +I 4 5 ? anti-parallel +I 5 6 ? anti-parallel +J 1 2 ? anti-parallel +K 1 2 ? anti-parallel +K 2 3 ? anti-parallel +L 1 2 ? anti-parallel +L 2 3 ? anti-parallel +L 3 4 ? anti-parallel +M 1 2 ? anti-parallel +M 2 3 ? anti-parallel +N 1 2 ? parallel +N 2 3 ? parallel +N 3 4 ? parallel +N 4 5 ? parallel +N 5 6 ? parallel +N 6 7 ? parallel +N 7 8 ? parallel +N 8 9 ? parallel +O 1 2 ? anti-parallel +O 2 3 ? anti-parallel +O 3 4 ? anti-parallel +P 1 2 ? anti-parallel +P 2 3 ? anti-parallel +P 3 4 ? anti-parallel +P 4 5 ? anti-parallel +P 5 6 ? anti-parallel +Q 1 2 ? anti-parallel +R 1 2 ? anti-parallel +R 2 3 ? anti-parallel +S 1 2 ? anti-parallel +S 2 3 ? anti-parallel +S 3 4 ? anti-parallel +T 1 2 ? anti-parallel +T 2 3 ? anti-parallel +U 1 2 ? parallel +U 2 3 ? parallel +U 3 4 ? parallel +U 4 5 ? parallel +U 5 6 ? parallel +U 6 7 ? parallel +U 7 8 ? parallel +U 8 9 ? parallel +V 1 2 ? anti-parallel +V 2 3 ? anti-parallel +V 3 4 ? anti-parallel +W 1 2 ? anti-parallel +W 2 3 ? anti-parallel +W 3 4 ? anti-parallel +W 4 5 ? anti-parallel +W 5 6 ? anti-parallel +X 1 2 ? anti-parallel +Y 1 2 ? anti-parallel +Y 2 3 ? anti-parallel +Z 1 2 ? anti-parallel +Z 2 3 ? anti-parallel +Z 3 4 ? anti-parallel +AA 1 2 ? anti-parallel +AA 2 3 ? anti-parallel +AB 1 2 ? parallel +AB 2 3 ? parallel +AB 3 4 ? parallel +AB 4 5 ? parallel +AB 5 6 ? parallel +AB 6 7 ? parallel +AB 7 8 ? parallel +AB 8 9 ? parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 CYS A 18 ? GLU A 20 ? CYS A 38 GLU A 40 +A 2 VAL A 198 ? PRO A 204 ? VAL A 218 PRO A 224 +A 3 THR A 97 ? ILE A 103 ? THR A 117 ILE A 123 +A 4 PHE A 129 ? ASP A 132 ? PHE A 149 ASP A 152 +B 1 VAL A 55 ? VAL A 59 ? VAL A 75 VAL A 79 +B 2 GLY A 23 ? ALA A 29 ? GLY A 43 ALA A 49 +B 3 TRP A 78 ? VAL A 85 ? TRP A 98 VAL A 105 +B 4 LEU A 146 ? ASN A 153 ? LEU A 166 ASN A 173 +B 5 TYR A 109 ? VAL A 114 ? TYR A 129 VAL A 134 +B 6 VAL A 117 ? GLU A 123 ? VAL A 137 GLU A 143 +C 1 THR A 165 ? TYR A 168 ? THR A 185 TYR A 188 +C 2 PHE A 180 ? ASN A 183 ? PHE A 200 ASN A 203 +D 1 TYR A 207 ? GLU A 218 ? TYR A 227 GLU A 238 +D 2 SER A 221 ? LYS A 231 ? SER A 241 LYS A 251 +D 3 GLN A 257 ? VAL A 262 ? GLN A 277 VAL A 282 +E 1 VAL A 249 ? THR A 254 ? VAL A 269 THR A 274 +E 2 PHE A 236 ? LEU A 243 ? PHE A 256 LEU A 263 +E 3 TYR A 281 ? THR A 291 ? TYR A 301 THR A 311 +E 4 GLY A 294 ? VAL A 304 ? GLY A 314 VAL A 324 +F 1 VAL A 309 ? VAL A 311 ? VAL A 329 VAL A 331 +F 2 PHE A 316 ? ILE A 318 ? PHE A 336 ILE A 338 +F 3 LYS A 321 ? PHE A 323 ? LYS A 341 PHE A 343 +G 1 PHE A 325 ? ASN A 329 ? PHE A 345 ASN A 349 +G 2 ALA A 360 ? ARG A 362 ? ALA A 380 ARG A 382 +G 3 VAL A 382 ? GLU A 386 ? VAL A 402 GLU A 406 +G 4 VAL A 423 ? ASN A 430 ? VAL A 443 ASN A 450 +G 5 VAL A 459 ? SER A 463 ? VAL A 479 SER A 483 +G 6 ILE A 479 ? ASN A 482 ? ILE A 499 ASN A 502 +G 7 ILE A 516 ? GLU A 520 ? ILE A 536 GLU A 540 +G 8 VAL A 561 ? ILE A 566 ? VAL A 581 ILE A 586 +G 9 PHE A 325 ? ASN A 329 ? PHE A 345 ASN A 349 +H 1 CYS B 18 ? GLU B 20 ? CYS B 38 GLU B 40 +H 2 VAL B 198 ? THR B 203 ? VAL B 218 THR B 223 +H 3 ARG B 98 ? ILE B 103 ? ARG B 118 ILE B 123 +H 4 PHE B 129 ? ASP B 132 ? PHE B 149 ASP B 152 +I 1 VAL B 55 ? VAL B 59 ? VAL B 75 VAL B 79 +I 2 GLY B 23 ? ALA B 29 ? GLY B 43 ALA B 49 +I 3 TRP B 78 ? VAL B 85 ? TRP B 98 VAL B 105 +I 4 LEU B 146 ? ASN B 153 ? LEU B 166 ASN B 173 +I 5 TYR B 109 ? VAL B 114 ? TYR B 129 VAL B 134 +I 6 VAL B 117 ? GLU B 123 ? VAL B 137 GLU B 143 +J 1 THR B 165 ? TYR B 168 ? THR B 185 TYR B 188 +J 2 PHE B 180 ? ASN B 183 ? PHE B 200 ASN B 203 +K 1 TYR B 207 ? GLU B 218 ? TYR B 227 GLU B 238 +K 2 SER B 221 ? LYS B 231 ? SER B 241 LYS B 251 +K 3 GLN B 257 ? PRO B 263 ? GLN B 277 PRO B 283 +L 1 VAL B 249 ? THR B 254 ? VAL B 269 THR B 274 +L 2 PHE B 236 ? LEU B 243 ? PHE B 256 LEU B 263 +L 3 TYR B 281 ? THR B 291 ? TYR B 301 THR B 311 +L 4 GLY B 294 ? VAL B 304 ? GLY B 314 VAL B 324 +M 1 VAL B 309 ? VAL B 311 ? VAL B 329 VAL B 331 +M 2 PHE B 316 ? ILE B 318 ? PHE B 336 ILE B 338 +M 3 LYS B 321 ? PRO B 322 ? LYS B 341 PRO B 342 +N 1 PHE B 325 ? ASN B 329 ? PHE B 345 ASN B 349 +N 2 ALA B 360 ? ARG B 362 ? ALA B 380 ARG B 382 +N 3 VAL B 382 ? GLU B 386 ? VAL B 402 GLU B 406 +N 4 VAL B 423 ? ASN B 430 ? VAL B 443 ASN B 450 +N 5 VAL B 459 ? SER B 463 ? VAL B 479 SER B 483 +N 6 ILE B 479 ? ASN B 482 ? ILE B 499 ASN B 502 +N 7 ILE B 516 ? GLU B 520 ? ILE B 536 GLU B 540 +N 8 VAL B 561 ? ILE B 566 ? VAL B 581 ILE B 586 +N 9 PHE B 325 ? ASN B 329 ? PHE B 345 ASN B 349 +O 1 CYS C 18 ? GLU C 20 ? CYS D 38 GLU D 40 +O 2 VAL C 198 ? PRO C 204 ? VAL D 218 PRO D 224 +O 3 THR C 97 ? ILE C 103 ? THR D 117 ILE D 123 +O 4 PHE C 129 ? ASP C 132 ? PHE D 149 ASP D 152 +P 1 VAL C 55 ? VAL C 59 ? VAL D 75 VAL D 79 +P 2 GLY C 23 ? ALA C 29 ? GLY D 43 ALA D 49 +P 3 TRP C 78 ? VAL C 85 ? TRP D 98 VAL D 105 +P 4 LEU C 146 ? ASN C 153 ? LEU D 166 ASN D 173 +P 5 TYR C 109 ? VAL C 114 ? TYR D 129 VAL D 134 +P 6 VAL C 117 ? GLU C 123 ? VAL D 137 GLU D 143 +Q 1 THR C 165 ? TYR C 168 ? THR D 185 TYR D 188 +Q 2 PHE C 180 ? ASN C 183 ? PHE D 200 ASN D 203 +R 1 TYR C 207 ? GLU C 218 ? TYR D 227 GLU D 238 +R 2 SER C 221 ? LYS C 231 ? SER D 241 LYS D 251 +R 3 GLN C 257 ? VAL C 262 ? GLN D 277 VAL D 282 +S 1 VAL C 249 ? THR C 254 ? VAL D 269 THR D 274 +S 2 PHE C 236 ? LEU C 243 ? PHE D 256 LEU D 263 +S 3 TYR C 281 ? THR C 291 ? TYR D 301 THR D 311 +S 4 GLY C 294 ? VAL C 304 ? GLY D 314 VAL D 324 +T 1 VAL C 309 ? VAL C 311 ? VAL D 329 VAL D 331 +T 2 PHE C 316 ? ILE C 318 ? PHE D 336 ILE D 338 +T 3 LYS C 321 ? PHE C 323 ? LYS D 341 PHE D 343 +U 1 PHE C 325 ? ASN C 329 ? PHE D 345 ASN D 349 +U 2 ALA C 360 ? ARG C 362 ? ALA D 380 ARG D 382 +U 3 VAL C 382 ? GLU C 386 ? VAL D 402 GLU D 406 +U 4 VAL C 423 ? ASN C 430 ? VAL D 443 ASN D 450 +U 5 VAL C 459 ? SER C 463 ? VAL D 479 SER D 483 +U 6 ILE C 479 ? ASN C 482 ? ILE D 499 ASN D 502 +U 7 ILE C 516 ? GLU C 520 ? ILE D 536 GLU D 540 +U 8 VAL C 561 ? ILE C 566 ? VAL D 581 ILE D 586 +U 9 PHE C 325 ? ASN C 329 ? PHE D 345 ASN D 349 +V 1 CYS D 18 ? GLU D 20 ? CYS E 38 GLU E 40 +V 2 VAL D 198 ? PRO D 204 ? VAL E 218 PRO E 224 +V 3 THR D 97 ? ILE D 103 ? THR E 117 ILE E 123 +V 4 PHE D 129 ? ASP D 132 ? PHE E 149 ASP E 152 +W 1 VAL D 55 ? VAL D 59 ? VAL E 75 VAL E 79 +W 2 GLY D 23 ? ALA D 29 ? GLY E 43 ALA E 49 +W 3 TRP D 78 ? VAL D 85 ? TRP E 98 VAL E 105 +W 4 LEU D 146 ? ASN D 153 ? LEU E 166 ASN E 173 +W 5 TYR D 109 ? VAL D 114 ? TYR E 129 VAL E 134 +W 6 VAL D 117 ? GLU D 123 ? VAL E 137 GLU E 143 +X 1 THR D 165 ? TYR D 168 ? THR E 185 TYR E 188 +X 2 PHE D 180 ? ASN D 183 ? PHE E 200 ASN E 203 +Y 1 TYR D 207 ? GLU D 218 ? TYR E 227 GLU E 238 +Y 2 SER D 221 ? LYS D 231 ? SER E 241 LYS E 251 +Y 3 GLN D 257 ? VAL D 262 ? GLN E 277 VAL E 282 +Z 1 VAL D 249 ? THR D 254 ? VAL E 269 THR E 274 +Z 2 PHE D 236 ? LEU D 243 ? PHE E 256 LEU E 263 +Z 3 TYR D 281 ? THR D 291 ? TYR E 301 THR E 311 +Z 4 GLY D 294 ? VAL D 304 ? GLY E 314 VAL E 324 +AA 1 VAL D 309 ? VAL D 311 ? VAL E 329 VAL E 331 +AA 2 PHE D 316 ? ILE D 318 ? PHE E 336 ILE E 338 +AA 3 LYS D 321 ? PHE D 323 ? LYS E 341 PHE E 343 +AB 1 PHE D 325 ? ASN D 329 ? PHE E 345 ASN E 349 +AB 2 ALA D 360 ? ARG D 362 ? ALA E 380 ARG E 382 +AB 3 VAL D 382 ? GLU D 386 ? VAL E 402 GLU E 406 +AB 4 VAL D 423 ? ASN D 430 ? VAL E 443 ASN E 450 +AB 5 VAL D 459 ? SER D 463 ? VAL E 479 SER E 483 +AB 6 ILE D 479 ? ASN D 482 ? ILE E 499 ASN E 502 +AB 7 ILE D 516 ? GLU D 520 ? ILE E 536 GLU E 540 +AB 8 VAL D 561 ? ILE D 566 ? VAL E 581 ILE E 586 +AB 9 PHE D 325 ? ASN D 329 ? PHE E 345 ASN E 349 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 N LYS A 19 ? N LYS A 39 O LEU A 200 ? O LEU A 220 +A 2 3 O TYR A 201 ? O TYR A 221 N VAL A 100 ? N VAL A 120 +A 3 4 N ILE A 103 ? N ILE A 123 O PHE A 129 ? O PHE A 149 +B 1 2 O VAL A 59 ? O VAL A 79 N GLY A 23 ? N GLY A 43 +B 2 3 N SER A 26 ? N SER A 46 O GLU A 82 ? O GLU A 102 +B 3 4 N VAL A 85 ? N VAL A 105 O LEU A 146 ? O LEU A 166 +B 4 5 O ASN A 153 ? O ASN A 173 N TYR A 109 ? N TYR A 129 +B 5 6 N VAL A 112 ? N VAL A 132 O LEU A 120 ? O LEU A 140 +C 1 2 N THR A 165 ? N THR A 185 O ASN A 183 ? O ASN A 203 +D 1 2 N GLU A 218 ? N GLU A 238 O SER A 221 ? O SER A 241 +D 2 3 N GLY A 222 ? N GLY A 242 O VAL A 262 ? O VAL A 282 +E 1 2 O VAL A 250 ? O VAL A 270 N LEU A 242 ? N LEU A 262 +E 2 3 N ARG A 241 ? N ARG A 261 O GLU A 284 ? O GLU A 304 +E 3 4 N LEU A 287 ? N LEU A 307 O ASP A 298 ? O ASP A 318 +F 1 2 N ALA A 310 ? N ALA A 330 O LEU A 317 ? O LEU A 337 +F 2 3 N PHE A 316 ? N PHE A 336 O PHE A 323 ? O PHE A 343 +G 1 2 N VAL A 328 ? N VAL A 348 O ALA A 360 ? O ALA A 380 +G 2 3 N PHE A 361 ? N PHE A 381 O VAL A 382 ? O VAL A 402 +G 3 4 N ASP A 385 ? N ASP A 405 O MET A 425 ? O MET A 445 +G 4 5 N TRP A 426 ? N TRP A 446 O THR A 460 ? O THR A 480 +G 5 6 N SER A 463 ? N SER A 483 O CYS A 480 ? O CYS A 500 +G 6 7 N ILE A 479 ? N ILE A 499 O ILE A 517 ? O ILE A 537 +G 7 8 N GLN A 518 ? N GLN A 538 O LEU A 565 ? O LEU A 585 +G 8 9 O GLU A 564 ? O GLU A 584 N GLY A 327 ? N GLY A 347 +H 1 2 N LYS B 19 ? N LYS B 39 O LEU B 200 ? O LEU B 220 +H 2 3 O TYR B 201 ? O TYR B 221 N VAL B 100 ? N VAL B 120 +H 3 4 N ILE B 103 ? N ILE B 123 O PHE B 129 ? O PHE B 149 +I 1 2 O VAL B 59 ? O VAL B 79 N GLY B 23 ? N GLY B 43 +I 2 3 N SER B 26 ? N SER B 46 O GLU B 82 ? O GLU B 102 +I 3 4 N VAL B 85 ? N VAL B 105 O LEU B 146 ? O LEU B 166 +I 4 5 O THR B 149 ? O THR B 169 N TRP B 113 ? N TRP B 133 +I 5 6 N VAL B 112 ? N VAL B 132 O LEU B 120 ? O LEU B 140 +J 1 2 N THR B 165 ? N THR B 185 O ASN B 183 ? O ASN B 203 +K 1 2 N GLU B 218 ? N GLU B 238 O SER B 221 ? O SER B 241 +K 2 3 N GLY B 222 ? N GLY B 242 O VAL B 262 ? O VAL B 282 +L 1 2 O VAL B 250 ? O VAL B 270 N LEU B 242 ? N LEU B 262 +L 2 3 N GLU B 239 ? N GLU B 259 O GLN B 286 ? O GLN B 306 +L 3 4 N LEU B 287 ? N LEU B 307 O ASP B 298 ? O ASP B 318 +M 1 2 N ALA B 310 ? N ALA B 330 O LEU B 317 ? O LEU B 337 +M 2 3 N ILE B 318 ? N ILE B 338 O LYS B 321 ? O LYS B 341 +N 1 2 N VAL B 328 ? N VAL B 348 O ALA B 360 ? O ALA B 380 +N 2 3 N PHE B 361 ? N PHE B 381 O VAL B 382 ? O VAL B 402 +N 3 4 N ASP B 385 ? N ASP B 405 O SER B 427 ? O SER B 447 +N 4 5 N ALA B 429 ? N ALA B 449 O VAL B 462 ? O VAL B 482 +N 5 6 N SER B 463 ? N SER B 483 O CYS B 480 ? O CYS B 500 +N 6 7 N ILE B 479 ? N ILE B 499 O ILE B 517 ? O ILE B 537 +N 7 8 N GLN B 518 ? N GLN B 538 O LEU B 565 ? O LEU B 585 +N 8 9 O VAL B 562 ? O VAL B 582 N PHE B 325 ? N PHE B 345 +O 1 2 N LYS C 19 ? N LYS D 39 O LEU C 200 ? O LEU D 220 +O 2 3 O TYR C 201 ? O TYR D 221 N VAL C 100 ? N VAL D 120 +O 3 4 N ILE C 103 ? N ILE D 123 O PHE C 129 ? O PHE D 149 +P 1 2 O VAL C 59 ? O VAL D 79 N GLY C 23 ? N GLY D 43 +P 2 3 N SER C 26 ? N SER D 46 O GLU C 82 ? O GLU D 102 +P 3 4 N ARG C 83 ? N ARG D 103 O ILE C 148 ? O ILE D 168 +P 4 5 O ASN C 153 ? O ASN D 173 N TYR C 109 ? N TYR D 129 +P 5 6 N VAL C 112 ? N VAL D 132 O LEU C 120 ? O LEU D 140 +Q 1 2 N THR C 165 ? N THR D 185 O ASN C 183 ? O ASN D 203 +R 1 2 N GLU C 218 ? N GLU D 238 O SER C 221 ? O SER D 241 +R 2 3 N GLY C 222 ? N GLY D 242 O VAL C 262 ? O VAL D 282 +S 1 2 O GLY C 253 ? O GLY D 273 N VAL C 240 ? N VAL D 260 +S 2 3 N LYS C 237 ? N LYS D 257 O THR C 288 ? O THR D 308 +S 3 4 N LEU C 283 ? N LEU D 303 O LEU C 302 ? O LEU D 322 +T 1 2 N ALA C 310 ? N ALA D 330 O LEU C 317 ? O LEU D 337 +T 2 3 N PHE C 316 ? N PHE D 336 O PHE C 323 ? O PHE D 343 +U 1 2 N VAL C 328 ? N VAL D 348 O ALA C 360 ? O ALA D 380 +U 2 3 N PHE C 361 ? N PHE D 381 O VAL C 382 ? O VAL D 402 +U 3 4 N ASP C 385 ? N ASP D 405 O SER C 427 ? O SER D 447 +U 4 5 N TRP C 426 ? N TRP D 446 O THR C 460 ? O THR D 480 +U 5 6 N SER C 463 ? N SER D 483 O CYS C 480 ? O CYS D 500 +U 6 7 N ILE C 479 ? N ILE D 499 O ILE C 517 ? O ILE D 537 +U 7 8 N GLN C 518 ? N GLN D 538 O GLY C 563 ? O GLY D 583 +U 8 9 O GLU C 564 ? O GLU D 584 N GLY C 327 ? N GLY D 347 +V 1 2 N LYS D 19 ? N LYS E 39 O LEU D 200 ? O LEU E 220 +V 2 3 O TYR D 201 ? O TYR E 221 N VAL D 100 ? N VAL E 120 +V 3 4 N ILE D 103 ? N ILE E 123 O PHE D 129 ? O PHE E 149 +W 1 2 O VAL D 59 ? O VAL E 79 N GLY D 23 ? N GLY E 43 +W 2 3 N ARG D 28 ? N ARG E 48 O TRP D 80 ? O TRP E 100 +W 3 4 N VAL D 85 ? N VAL E 105 O LEU D 146 ? O LEU E 166 +W 4 5 O THR D 149 ? O THR E 169 N TRP D 113 ? N TRP E 133 +W 5 6 N VAL D 112 ? N VAL E 132 O LEU D 120 ? O LEU E 140 +X 1 2 N THR D 165 ? N THR E 185 O ASN D 183 ? O ASN E 203 +Y 1 2 N THR D 214 ? N THR E 234 O ASN D 225 ? O ASN E 245 +Y 2 3 N GLY D 222 ? N GLY E 242 O VAL D 262 ? O VAL E 282 +Z 1 2 O ALA D 251 ? O ALA E 271 N LEU D 242 ? N LEU E 262 +Z 2 3 N LEU D 243 ? N LEU E 263 O SER D 282 ? O SER E 302 +Z 3 4 N TYR D 281 ? N TYR E 301 O VAL D 304 ? O VAL E 324 +AA 1 2 N ALA D 310 ? N ALA E 330 O LEU D 317 ? O LEU E 337 +AA 2 3 N PHE D 316 ? N PHE E 336 O PHE D 323 ? O PHE E 343 +AB 1 2 N VAL D 328 ? N VAL E 348 O ALA D 360 ? O ALA E 380 +AB 2 3 N PHE D 361 ? N PHE E 381 O VAL D 382 ? O VAL E 402 +AB 3 4 N VAL D 383 ? N VAL E 403 O VAL D 424 ? O VAL E 444 +AB 4 5 N ALA D 429 ? N ALA E 449 O VAL D 462 ? O VAL E 482 +AB 5 6 N SER D 463 ? N SER E 483 O CYS D 480 ? O CYS E 500 +AB 6 7 N ILE D 479 ? N ILE E 499 O ILE D 517 ? O ILE E 537 +AB 7 8 N GLN D 518 ? N GLN E 538 O LEU D 565 ? O LEU E 585 +AB 8 9 O GLU D 564 ? O GLU E 584 N GLY D 327 ? N GLY E 347 +# +_pdbx_entry_details.entry_id 3HN3 +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 OE1 D GLU 390 ? B O D HOH 2481 ? ? 1.91 +2 1 OE2 A GLU 390 ? B O A HOH 2523 ? ? 2.03 +3 1 OD1 B ASP 42 ? ? O B HOH 2467 ? ? 2.03 +4 1 OE1 B GLU 143 ? B NE2 B HIS 425 ? ? 2.10 +5 1 OD1 D ASP 42 ? ? O D HOH 2498 ? ? 2.10 +6 1 O D HOH 2479 ? ? O D HOH 2503 ? ? 2.18 +7 1 OH A TYR 532 ? ? O A HOH 2494 ? ? 2.18 +# +loop_ +_pdbx_validate_rmsd_bond.id +_pdbx_validate_rmsd_bond.PDB_model_num +_pdbx_validate_rmsd_bond.auth_atom_id_1 +_pdbx_validate_rmsd_bond.auth_asym_id_1 +_pdbx_validate_rmsd_bond.auth_comp_id_1 +_pdbx_validate_rmsd_bond.auth_seq_id_1 +_pdbx_validate_rmsd_bond.PDB_ins_code_1 +_pdbx_validate_rmsd_bond.label_alt_id_1 +_pdbx_validate_rmsd_bond.auth_atom_id_2 +_pdbx_validate_rmsd_bond.auth_asym_id_2 +_pdbx_validate_rmsd_bond.auth_comp_id_2 +_pdbx_validate_rmsd_bond.auth_seq_id_2 +_pdbx_validate_rmsd_bond.PDB_ins_code_2 +_pdbx_validate_rmsd_bond.label_alt_id_2 +_pdbx_validate_rmsd_bond.bond_value +_pdbx_validate_rmsd_bond.bond_target_value +_pdbx_validate_rmsd_bond.bond_deviation +_pdbx_validate_rmsd_bond.bond_standard_deviation +_pdbx_validate_rmsd_bond.linker_flag +1 1 CB A HIS 424 ? ? CG A HIS 424 ? ? 1.292 1.492 -0.200 0.016 N +2 1 CG B ARG 110 ? ? CD B ARG 110 ? ? 1.294 1.515 -0.221 0.025 N +3 1 CD B GLN 239 ? ? OE1 B GLN 239 ? ? 1.036 1.235 -0.199 0.022 N +4 1 CD B LYS 281 ? ? CE B LYS 281 ? ? 1.338 1.508 -0.170 0.025 N +5 1 CD E LYS 194 ? ? CE E LYS 194 ? ? 1.200 1.508 -0.308 0.025 N +6 1 CD E GLU 266 ? ? OE1 E GLU 266 ? ? 1.550 1.252 0.298 0.011 N +7 1 CD E GLU 266 ? ? OE2 E GLU 266 ? ? 0.992 1.252 -0.260 0.011 N +8 1 CD E GLU 295 ? ? OE1 E GLU 295 ? ? 1.326 1.252 0.074 0.011 N +9 1 CD E GLU 295 ? ? OE2 E GLU 295 ? ? 1.346 1.252 0.094 0.011 N +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 CB B ARG 110 ? ? CG B ARG 110 ? ? CD B ARG 110 ? ? 138.14 111.60 26.54 2.60 N +2 1 CG E LYS 194 ? ? CD E LYS 194 ? ? CE E LYS 194 ? ? 136.97 111.90 25.07 3.00 N +3 1 CG E GLU 266 ? ? CD E GLU 266 ? ? OE2 E GLU 266 ? ? 132.93 118.30 14.63 2.00 N +4 1 OE1 E GLU 295 ? ? CD E GLU 295 ? ? OE2 E GLU 295 ? ? 111.28 123.30 -12.02 1.20 N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 MET A 27 ? ? -155.65 57.67 +2 1 ALA A 126 ? ? -136.67 -110.27 +3 1 HIS A 127 ? ? -160.33 -152.71 +4 1 ASP A 191 ? ? -69.89 93.44 +5 1 ASP A 207 ? ? -100.19 55.81 +6 1 GLN A 239 ? ? 49.56 -98.87 +7 1 LEU A 292 ? ? 74.06 -2.47 +8 1 THR A 332 ? ? -107.59 -166.64 +9 1 ILE A 356 ? ? 70.82 -53.02 +10 1 PRO A 408 ? ? -77.43 37.82 +11 1 SER A 506 ? ? 76.48 -11.67 +12 1 TRP A 507 ? ? -104.45 -61.06 +13 1 PHE A 557 ? ? 86.07 -10.64 +14 1 LYS A 579 ? ? -123.39 -77.61 +15 1 MET B 27 ? ? -151.91 62.42 +16 1 LEU B 41 ? ? -109.52 46.25 +17 1 ARG B 55 ? ? 59.88 16.88 +18 1 ALA B 126 ? ? -140.21 -115.37 +19 1 HIS B 127 ? ? -161.60 -151.04 +20 1 GLN B 158 ? ? -102.85 44.44 +21 1 PRO B 178 ? ? -59.98 -9.05 +22 1 ASP B 207 ? ? -98.02 53.75 +23 1 GLN B 239 ? ? 56.83 -115.75 +24 1 LEU B 292 ? ? 72.89 -1.58 +25 1 THR B 332 ? ? -105.36 -165.14 +26 1 ILE B 356 ? ? 69.52 -54.23 +27 1 PRO B 408 ? ? -72.86 29.29 +28 1 PHE B 418 ? ? -100.47 76.60 +29 1 SER B 506 ? ? 76.44 -14.68 +30 1 TRP B 507 ? ? -100.40 -65.80 +31 1 PHE B 557 ? ? 85.49 -12.70 +32 1 LYS B 579 ? ? -113.95 -89.13 +33 1 MET D 27 ? ? -154.47 63.54 +34 1 ALA D 126 ? ? -139.54 -111.51 +35 1 HIS D 127 ? ? -158.39 -148.29 +36 1 ASP D 207 ? ? -99.94 56.67 +37 1 GLN D 239 ? ? 46.22 -114.71 +38 1 THR D 332 ? ? -108.75 -165.70 +39 1 ILE D 356 ? ? 72.01 -47.68 +40 1 PRO D 408 ? ? -67.88 34.21 +41 1 PRO D 408 ? ? -74.34 34.21 +42 1 SER D 506 ? ? 72.86 -11.99 +43 1 PHE D 557 ? ? 86.76 -11.62 +44 1 LYS D 579 ? ? -121.62 -79.67 +45 1 GLN E 24 ? ? 55.05 -121.45 +46 1 MET E 27 ? ? -157.17 58.18 +47 1 ARG E 55 ? ? 59.83 14.21 +48 1 ALA E 126 ? ? -143.32 -114.59 +49 1 HIS E 127 ? ? -158.83 -148.95 +50 1 PRO E 178 ? ? -57.91 -9.67 +51 1 ASP E 207 ? ? -96.60 58.35 +52 1 TYR E 211 ? ? -49.98 151.13 +53 1 GLN E 239 ? ? 49.69 -126.77 +54 1 ASN E 267 ? ? 43.75 29.61 +55 1 THR E 332 ? ? -110.98 -165.18 +56 1 ILE E 356 ? ? 74.00 -51.83 +57 1 PRO E 408 ? ? -68.32 28.23 +58 1 SER E 506 ? ? 74.03 -8.59 +59 1 TRP E 507 ? ? -105.48 -60.41 +60 1 PHE E 557 ? ? 87.72 -9.09 +61 1 LYS E 579 ? ? -123.12 -64.56 +62 1 TYR E 580 ? ? -145.76 -2.93 +# +_pdbx_validate_chiral.id 1 +_pdbx_validate_chiral.PDB_model_num 1 +_pdbx_validate_chiral.auth_atom_id C1 +_pdbx_validate_chiral.label_alt_id ? +_pdbx_validate_chiral.auth_asym_id A +_pdbx_validate_chiral.auth_comp_id NAG +_pdbx_validate_chiral.auth_seq_id 650 +_pdbx_validate_chiral.PDB_ins_code ? +_pdbx_validate_chiral.details 'WRONG HAND' +_pdbx_validate_chiral.omega . +# +_pdbx_validate_planes.id 1 +_pdbx_validate_planes.PDB_model_num 1 +_pdbx_validate_planes.auth_comp_id GLU +_pdbx_validate_planes.auth_asym_id E +_pdbx_validate_planes.auth_seq_id 295 +_pdbx_validate_planes.PDB_ins_code ? +_pdbx_validate_planes.label_alt_id ? +_pdbx_validate_planes.rmsd 0.100 +_pdbx_validate_planes.type 'SIDE CHAIN' +# +loop_ +_pdbx_struct_mod_residue.id +_pdbx_struct_mod_residue.label_asym_id +_pdbx_struct_mod_residue.label_comp_id +_pdbx_struct_mod_residue.label_seq_id +_pdbx_struct_mod_residue.auth_asym_id +_pdbx_struct_mod_residue.auth_comp_id +_pdbx_struct_mod_residue.auth_seq_id +_pdbx_struct_mod_residue.PDB_ins_code +_pdbx_struct_mod_residue.parent_comp_id +_pdbx_struct_mod_residue.details +1 A ASN 153 A ASN 173 ? ASN 'GLYCOSYLATION SITE' +2 B ASN 153 B ASN 173 ? ASN 'GLYCOSYLATION SITE' +3 B ASN 252 B ASN 272 ? ASN 'GLYCOSYLATION SITE' +4 C ASN 153 D ASN 173 ? ASN 'GLYCOSYLATION SITE' +5 C ASN 252 D ASN 272 ? ASN 'GLYCOSYLATION SITE' +6 D ASN 153 E ASN 173 ? ASN 'GLYCOSYLATION SITE' +7 D ASN 252 E ASN 272 ? ASN 'GLYCOSYLATION SITE' +8 A ASN 252 A ASN 272 ? ASN 'GLYCOSYLATION SITE' +# +_phasing.method MR +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A LEU 21 ? A LEU 1 +2 1 Y 1 A PRO 161 ? A PRO 141 +3 1 Y 1 A LEU 162 ? A LEU 142 +4 1 Y 1 A PRO 163 ? A PRO 143 +5 1 Y 1 A THR 633 ? A THR 613 +6 1 Y 1 B LEU 21 ? B LEU 1 +7 1 Y 1 B PRO 161 ? B PRO 141 +8 1 Y 1 B LEU 162 ? B LEU 142 +9 1 Y 1 B PRO 163 ? B PRO 143 +10 1 Y 1 D LEU 21 ? C LEU 1 +11 1 Y 1 D GLY 22 ? C GLY 2 +12 1 Y 1 D GLY 160 ? C GLY 140 +13 1 Y 1 D PRO 161 ? C PRO 141 +14 1 Y 1 D LEU 162 ? C LEU 142 +15 1 Y 1 D PRO 163 ? C PRO 143 +16 1 Y 1 E LEU 21 ? D LEU 1 +17 1 Y 1 E GLY 22 ? D GLY 2 +18 1 Y 1 E GLY 160 ? D GLY 140 +19 1 Y 1 E PRO 161 ? D PRO 141 +20 1 Y 1 E LEU 162 ? D LEU 142 +21 1 Y 1 E PRO 163 ? D PRO 143 +22 1 Y 1 E THR 633 ? D THR 613 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +BMA C1 C N R 74 +BMA C2 C N S 75 +BMA C3 C N S 76 +BMA C4 C N S 77 +BMA C5 C N R 78 +BMA C6 C N N 79 +BMA O1 O N N 80 +BMA O2 O N N 81 +BMA O3 O N N 82 +BMA O4 O N N 83 +BMA O5 O N N 84 +BMA O6 O N N 85 +BMA H1 H N N 86 +BMA H2 H N N 87 +BMA H3 H N N 88 +BMA H4 H N N 89 +BMA H5 H N N 90 +BMA H61 H N N 91 +BMA H62 H N N 92 +BMA HO1 H N N 93 +BMA HO2 H N N 94 +BMA HO3 H N N 95 +BMA HO4 H N N 96 +BMA HO6 H N N 97 +CYS N N N N 98 +CYS CA C N R 99 +CYS C C N N 100 +CYS O O N N 101 +CYS CB C N N 102 +CYS SG S N N 103 +CYS OXT O N N 104 +CYS H H N N 105 +CYS H2 H N N 106 +CYS HA H N N 107 +CYS HB2 H N N 108 +CYS HB3 H N N 109 +CYS HG H N N 110 +CYS HXT H N N 111 +GLN N N N N 112 +GLN CA C N S 113 +GLN C C N N 114 +GLN O O N N 115 +GLN CB C N N 116 +GLN CG C N N 117 +GLN CD C N N 118 +GLN OE1 O N N 119 +GLN NE2 N N N 120 +GLN OXT O N N 121 +GLN H H N N 122 +GLN H2 H N N 123 +GLN HA H N N 124 +GLN HB2 H N N 125 +GLN HB3 H N N 126 +GLN HG2 H N N 127 +GLN HG3 H N N 128 +GLN HE21 H N N 129 +GLN HE22 H N N 130 +GLN HXT H N N 131 +GLU N N N N 132 +GLU CA C N S 133 +GLU C C N N 134 +GLU O O N N 135 +GLU CB C N N 136 +GLU CG C N N 137 +GLU CD C N N 138 +GLU OE1 O N N 139 +GLU OE2 O N N 140 +GLU OXT O N N 141 +GLU H H N N 142 +GLU H2 H N N 143 +GLU HA H N N 144 +GLU HB2 H N N 145 +GLU HB3 H N N 146 +GLU HG2 H N N 147 +GLU HG3 H N N 148 +GLU HE2 H N N 149 +GLU HXT H N N 150 +GLY N N N N 151 +GLY CA C N N 152 +GLY C C N N 153 +GLY O O N N 154 +GLY OXT O N N 155 +GLY H H N N 156 +GLY H2 H N N 157 +GLY HA2 H N N 158 +GLY HA3 H N N 159 +GLY HXT H N N 160 +GUP O5 O N N 161 +GUP C1 C N R 162 +GUP O1 O N N 163 +GUP C2 C N S 164 +GUP O2 O N N 165 +GUP C3 C N S 166 +GUP O3 O N N 167 +GUP C4 C N S 168 +GUP O4 O N N 169 +GUP C5 C N S 170 +GUP C6 C N N 171 +GUP O6 O N N 172 +GUP H1 H N N 173 +GUP HO1 H N N 174 +GUP H2 H N N 175 +GUP HO2 H N N 176 +GUP H3 H N N 177 +GUP HO3 H N N 178 +GUP H4 H N N 179 +GUP HO4 H N N 180 +GUP H5 H N N 181 +GUP H61 H N N 182 +GUP H62 H N N 183 +GUP HO6 H N N 184 +HIS N N N N 185 +HIS CA C N S 186 +HIS C C N N 187 +HIS O O N N 188 +HIS CB C N N 189 +HIS CG C Y N 190 +HIS ND1 N Y N 191 +HIS CD2 C Y N 192 +HIS CE1 C Y N 193 +HIS NE2 N Y N 194 +HIS OXT O N N 195 +HIS H H N N 196 +HIS H2 H N N 197 +HIS HA H N N 198 +HIS HB2 H N N 199 +HIS HB3 H N N 200 +HIS HD1 H N N 201 +HIS HD2 H N N 202 +HIS HE1 H N N 203 +HIS HE2 H N N 204 +HIS HXT H N N 205 +HOH O O N N 206 +HOH H1 H N N 207 +HOH H2 H N N 208 +ILE N N N N 209 +ILE CA C N S 210 +ILE C C N N 211 +ILE O O N N 212 +ILE CB C N S 213 +ILE CG1 C N N 214 +ILE CG2 C N N 215 +ILE CD1 C N N 216 +ILE OXT O N N 217 +ILE H H N N 218 +ILE H2 H N N 219 +ILE HA H N N 220 +ILE HB H N N 221 +ILE HG12 H N N 222 +ILE HG13 H N N 223 +ILE HG21 H N N 224 +ILE HG22 H N N 225 +ILE HG23 H N N 226 +ILE HD11 H N N 227 +ILE HD12 H N N 228 +ILE HD13 H N N 229 +ILE HXT H N N 230 +LEU N N N N 231 +LEU CA C N S 232 +LEU C C N N 233 +LEU O O N N 234 +LEU CB C N N 235 +LEU CG C N N 236 +LEU CD1 C N N 237 +LEU CD2 C N N 238 +LEU OXT O N N 239 +LEU H H N N 240 +LEU H2 H N N 241 +LEU HA H N N 242 +LEU HB2 H N N 243 +LEU HB3 H N N 244 +LEU HG H N N 245 +LEU HD11 H N N 246 +LEU HD12 H N N 247 +LEU HD13 H N N 248 +LEU HD21 H N N 249 +LEU HD22 H N N 250 +LEU HD23 H N N 251 +LEU HXT H N N 252 +LYS N N N N 253 +LYS CA C N S 254 +LYS C C N N 255 +LYS O O N N 256 +LYS CB C N N 257 +LYS CG C N N 258 +LYS CD C N N 259 +LYS CE C N N 260 +LYS NZ N N N 261 +LYS OXT O N N 262 +LYS H H N N 263 +LYS H2 H N N 264 +LYS HA H N N 265 +LYS HB2 H N N 266 +LYS HB3 H N N 267 +LYS HG2 H N N 268 +LYS HG3 H N N 269 +LYS HD2 H N N 270 +LYS HD3 H N N 271 +LYS HE2 H N N 272 +LYS HE3 H N N 273 +LYS HZ1 H N N 274 +LYS HZ2 H N N 275 +LYS HZ3 H N N 276 +LYS HXT H N N 277 +MAN C1 C N S 278 +MAN C2 C N S 279 +MAN C3 C N S 280 +MAN C4 C N S 281 +MAN C5 C N R 282 +MAN C6 C N N 283 +MAN O1 O N N 284 +MAN O2 O N N 285 +MAN O3 O N N 286 +MAN O4 O N N 287 +MAN O5 O N N 288 +MAN O6 O N N 289 +MAN H1 H N N 290 +MAN H2 H N N 291 +MAN H3 H N N 292 +MAN H4 H N N 293 +MAN H5 H N N 294 +MAN H61 H N N 295 +MAN H62 H N N 296 +MAN HO1 H N N 297 +MAN HO2 H N N 298 +MAN HO3 H N N 299 +MAN HO4 H N N 300 +MAN HO6 H N N 301 +MET N N N N 302 +MET CA C N S 303 +MET C C N N 304 +MET O O N N 305 +MET CB C N N 306 +MET CG C N N 307 +MET SD S N N 308 +MET CE C N N 309 +MET OXT O N N 310 +MET H H N N 311 +MET H2 H N N 312 +MET HA H N N 313 +MET HB2 H N N 314 +MET HB3 H N N 315 +MET HG2 H N N 316 +MET HG3 H N N 317 +MET HE1 H N N 318 +MET HE2 H N N 319 +MET HE3 H N N 320 +MET HXT H N N 321 +MPD C1 C N N 322 +MPD C2 C N N 323 +MPD O2 O N N 324 +MPD CM C N N 325 +MPD C3 C N N 326 +MPD C4 C N S 327 +MPD O4 O N N 328 +MPD C5 C N N 329 +MPD H11 H N N 330 +MPD H12 H N N 331 +MPD H13 H N N 332 +MPD HO2 H N N 333 +MPD HM1 H N N 334 +MPD HM2 H N N 335 +MPD HM3 H N N 336 +MPD H31 H N N 337 +MPD H32 H N N 338 +MPD H4 H N N 339 +MPD HO4 H N N 340 +MPD H51 H N N 341 +MPD H52 H N N 342 +MPD H53 H N N 343 +MRD C1 C N N 344 +MRD C2 C N N 345 +MRD O2 O N N 346 +MRD CM C N N 347 +MRD C3 C N N 348 +MRD C4 C N R 349 +MRD O4 O N N 350 +MRD C5 C N N 351 +MRD H1C1 H N N 352 +MRD H1C2 H N N 353 +MRD H1C3 H N N 354 +MRD H2 H N N 355 +MRD HMC1 H N N 356 +MRD HMC2 H N N 357 +MRD HMC3 H N N 358 +MRD H3C1 H N N 359 +MRD H3C2 H N N 360 +MRD H4 H N N 361 +MRD HA H N N 362 +MRD H5C1 H N N 363 +MRD H5C2 H N N 364 +MRD H5C3 H N N 365 +NAG C1 C N R 366 +NAG C2 C N R 367 +NAG C3 C N R 368 +NAG C4 C N S 369 +NAG C5 C N R 370 +NAG C6 C N N 371 +NAG C7 C N N 372 +NAG C8 C N N 373 +NAG N2 N N N 374 +NAG O1 O N N 375 +NAG O3 O N N 376 +NAG O4 O N N 377 +NAG O5 O N N 378 +NAG O6 O N N 379 +NAG O7 O N N 380 +NAG H1 H N N 381 +NAG H2 H N N 382 +NAG H3 H N N 383 +NAG H4 H N N 384 +NAG H5 H N N 385 +NAG H61 H N N 386 +NAG H62 H N N 387 +NAG H81 H N N 388 +NAG H82 H N N 389 +NAG H83 H N N 390 +NAG HN2 H N N 391 +NAG HO1 H N N 392 +NAG HO3 H N N 393 +NAG HO4 H N N 394 +NAG HO6 H N N 395 +PHE N N N N 396 +PHE CA C N S 397 +PHE C C N N 398 +PHE O O N N 399 +PHE CB C N N 400 +PHE CG C Y N 401 +PHE CD1 C Y N 402 +PHE CD2 C Y N 403 +PHE CE1 C Y N 404 +PHE CE2 C Y N 405 +PHE CZ C Y N 406 +PHE OXT O N N 407 +PHE H H N N 408 +PHE H2 H N N 409 +PHE HA H N N 410 +PHE HB2 H N N 411 +PHE HB3 H N N 412 +PHE HD1 H N N 413 +PHE HD2 H N N 414 +PHE HE1 H N N 415 +PHE HE2 H N N 416 +PHE HZ H N N 417 +PHE HXT H N N 418 +PRO N N N N 419 +PRO CA C N S 420 +PRO C C N N 421 +PRO O O N N 422 +PRO CB C N N 423 +PRO CG C N N 424 +PRO CD C N N 425 +PRO OXT O N N 426 +PRO H H N N 427 +PRO HA H N N 428 +PRO HB2 H N N 429 +PRO HB3 H N N 430 +PRO HG2 H N N 431 +PRO HG3 H N N 432 +PRO HD2 H N N 433 +PRO HD3 H N N 434 +PRO HXT H N N 435 +SER N N N N 436 +SER CA C N S 437 +SER C C N N 438 +SER O O N N 439 +SER CB C N N 440 +SER OG O N N 441 +SER OXT O N N 442 +SER H H N N 443 +SER H2 H N N 444 +SER HA H N N 445 +SER HB2 H N N 446 +SER HB3 H N N 447 +SER HG H N N 448 +SER HXT H N N 449 +THR N N N N 450 +THR CA C N S 451 +THR C C N N 452 +THR O O N N 453 +THR CB C N R 454 +THR OG1 O N N 455 +THR CG2 C N N 456 +THR OXT O N N 457 +THR H H N N 458 +THR H2 H N N 459 +THR HA H N N 460 +THR HB H N N 461 +THR HG1 H N N 462 +THR HG21 H N N 463 +THR HG22 H N N 464 +THR HG23 H N N 465 +THR HXT H N N 466 +TRP N N N N 467 +TRP CA C N S 468 +TRP C C N N 469 +TRP O O N N 470 +TRP CB C N N 471 +TRP CG C Y N 472 +TRP CD1 C Y N 473 +TRP CD2 C Y N 474 +TRP NE1 N Y N 475 +TRP CE2 C Y N 476 +TRP CE3 C Y N 477 +TRP CZ2 C Y N 478 +TRP CZ3 C Y N 479 +TRP CH2 C Y N 480 +TRP OXT O N N 481 +TRP H H N N 482 +TRP H2 H N N 483 +TRP HA H N N 484 +TRP HB2 H N N 485 +TRP HB3 H N N 486 +TRP HD1 H N N 487 +TRP HE1 H N N 488 +TRP HE3 H N N 489 +TRP HZ2 H N N 490 +TRP HZ3 H N N 491 +TRP HH2 H N N 492 +TRP HXT H N N 493 +TYR N N N N 494 +TYR CA C N S 495 +TYR C C N N 496 +TYR O O N N 497 +TYR CB C N N 498 +TYR CG C Y N 499 +TYR CD1 C Y N 500 +TYR CD2 C Y N 501 +TYR CE1 C Y N 502 +TYR CE2 C Y N 503 +TYR CZ C Y N 504 +TYR OH O N N 505 +TYR OXT O N N 506 +TYR H H N N 507 +TYR H2 H N N 508 +TYR HA H N N 509 +TYR HB2 H N N 510 +TYR HB3 H N N 511 +TYR HD1 H N N 512 +TYR HD2 H N N 513 +TYR HE1 H N N 514 +TYR HE2 H N N 515 +TYR HH H N N 516 +TYR HXT H N N 517 +VAL N N N N 518 +VAL CA C N S 519 +VAL C C N N 520 +VAL O O N N 521 +VAL CB C N N 522 +VAL CG1 C N N 523 +VAL CG2 C N N 524 +VAL OXT O N N 525 +VAL H H N N 526 +VAL H2 H N N 527 +VAL HA H N N 528 +VAL HB H N N 529 +VAL HG11 H N N 530 +VAL HG12 H N N 531 +VAL HG13 H N N 532 +VAL HG21 H N N 533 +VAL HG22 H N N 534 +VAL HG23 H N N 535 +VAL HXT H N N 536 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +BMA C1 C2 sing N N 70 +BMA C1 O1 sing N N 71 +BMA C1 O5 sing N N 72 +BMA C1 H1 sing N N 73 +BMA C2 C3 sing N N 74 +BMA C2 O2 sing N N 75 +BMA C2 H2 sing N N 76 +BMA C3 C4 sing N N 77 +BMA C3 O3 sing N N 78 +BMA C3 H3 sing N N 79 +BMA C4 C5 sing N N 80 +BMA C4 O4 sing N N 81 +BMA C4 H4 sing N N 82 +BMA C5 C6 sing N N 83 +BMA C5 O5 sing N N 84 +BMA C5 H5 sing N N 85 +BMA C6 O6 sing N N 86 +BMA C6 H61 sing N N 87 +BMA C6 H62 sing N N 88 +BMA O1 HO1 sing N N 89 +BMA O2 HO2 sing N N 90 +BMA O3 HO3 sing N N 91 +BMA O4 HO4 sing N N 92 +BMA O6 HO6 sing N N 93 +CYS N CA sing N N 94 +CYS N H sing N N 95 +CYS N H2 sing N N 96 +CYS CA C sing N N 97 +CYS CA CB sing N N 98 +CYS CA HA sing N N 99 +CYS C O doub N N 100 +CYS C OXT sing N N 101 +CYS CB SG sing N N 102 +CYS CB HB2 sing N N 103 +CYS CB HB3 sing N N 104 +CYS SG HG sing N N 105 +CYS OXT HXT sing N N 106 +GLN N CA sing N N 107 +GLN N H sing N N 108 +GLN N H2 sing N N 109 +GLN CA C sing N N 110 +GLN CA CB sing N N 111 +GLN CA HA sing N N 112 +GLN C O doub N N 113 +GLN C OXT sing N N 114 +GLN CB CG sing N N 115 +GLN CB HB2 sing N N 116 +GLN CB HB3 sing N N 117 +GLN CG CD sing N N 118 +GLN CG HG2 sing N N 119 +GLN CG HG3 sing N N 120 +GLN CD OE1 doub N N 121 +GLN CD NE2 sing N N 122 +GLN NE2 HE21 sing N N 123 +GLN NE2 HE22 sing N N 124 +GLN OXT HXT sing N N 125 +GLU N CA sing N N 126 +GLU N H sing N N 127 +GLU N H2 sing N N 128 +GLU CA C sing N N 129 +GLU CA CB sing N N 130 +GLU CA HA sing N N 131 +GLU C O doub N N 132 +GLU C OXT sing N N 133 +GLU CB CG sing N N 134 +GLU CB HB2 sing N N 135 +GLU CB HB3 sing N N 136 +GLU CG CD sing N N 137 +GLU CG HG2 sing N N 138 +GLU CG HG3 sing N N 139 +GLU CD OE1 doub N N 140 +GLU CD OE2 sing N N 141 +GLU OE2 HE2 sing N N 142 +GLU OXT HXT sing N N 143 +GLY N CA sing N N 144 +GLY N H sing N N 145 +GLY N H2 sing N N 146 +GLY CA C sing N N 147 +GLY CA HA2 sing N N 148 +GLY CA HA3 sing N N 149 +GLY C O doub N N 150 +GLY C OXT sing N N 151 +GLY OXT HXT sing N N 152 +GUP O5 C1 sing N N 153 +GUP O5 C5 sing N N 154 +GUP C1 O1 sing N N 155 +GUP C1 C2 sing N N 156 +GUP C1 H1 sing N N 157 +GUP O1 HO1 sing N N 158 +GUP C2 O2 sing N N 159 +GUP C2 C3 sing N N 160 +GUP C2 H2 sing N N 161 +GUP O2 HO2 sing N N 162 +GUP C3 O3 sing N N 163 +GUP C3 C4 sing N N 164 +GUP C3 H3 sing N N 165 +GUP O3 HO3 sing N N 166 +GUP C4 O4 sing N N 167 +GUP C4 C5 sing N N 168 +GUP C4 H4 sing N N 169 +GUP O4 HO4 sing N N 170 +GUP C5 C6 sing N N 171 +GUP C5 H5 sing N N 172 +GUP C6 O6 sing N N 173 +GUP C6 H61 sing N N 174 +GUP C6 H62 sing N N 175 +GUP O6 HO6 sing N N 176 +HIS N CA sing N N 177 +HIS N H sing N N 178 +HIS N H2 sing N N 179 +HIS CA C sing N N 180 +HIS CA CB sing N N 181 +HIS CA HA sing N N 182 +HIS C O doub N N 183 +HIS C OXT sing N N 184 +HIS CB CG sing N N 185 +HIS CB HB2 sing N N 186 +HIS CB HB3 sing N N 187 +HIS CG ND1 sing Y N 188 +HIS CG CD2 doub Y N 189 +HIS ND1 CE1 doub Y N 190 +HIS ND1 HD1 sing N N 191 +HIS CD2 NE2 sing Y N 192 +HIS CD2 HD2 sing N N 193 +HIS CE1 NE2 sing Y N 194 +HIS CE1 HE1 sing N N 195 +HIS NE2 HE2 sing N N 196 +HIS OXT HXT sing N N 197 +HOH O H1 sing N N 198 +HOH O H2 sing N N 199 +ILE N CA sing N N 200 +ILE N H sing N N 201 +ILE N H2 sing N N 202 +ILE CA C sing N N 203 +ILE CA CB sing N N 204 +ILE CA HA sing N N 205 +ILE C O doub N N 206 +ILE C OXT sing N N 207 +ILE CB CG1 sing N N 208 +ILE CB CG2 sing N N 209 +ILE CB HB sing N N 210 +ILE CG1 CD1 sing N N 211 +ILE CG1 HG12 sing N N 212 +ILE CG1 HG13 sing N N 213 +ILE CG2 HG21 sing N N 214 +ILE CG2 HG22 sing N N 215 +ILE CG2 HG23 sing N N 216 +ILE CD1 HD11 sing N N 217 +ILE CD1 HD12 sing N N 218 +ILE CD1 HD13 sing N N 219 +ILE OXT HXT sing N N 220 +LEU N CA sing N N 221 +LEU N H sing N N 222 +LEU N H2 sing N N 223 +LEU CA C sing N N 224 +LEU CA CB sing N N 225 +LEU CA HA sing N N 226 +LEU C O doub N N 227 +LEU C OXT sing N N 228 +LEU CB CG sing N N 229 +LEU CB HB2 sing N N 230 +LEU CB HB3 sing N N 231 +LEU CG CD1 sing N N 232 +LEU CG CD2 sing N N 233 +LEU CG HG sing N N 234 +LEU CD1 HD11 sing N N 235 +LEU CD1 HD12 sing N N 236 +LEU CD1 HD13 sing N N 237 +LEU CD2 HD21 sing N N 238 +LEU CD2 HD22 sing N N 239 +LEU CD2 HD23 sing N N 240 +LEU OXT HXT sing N N 241 +LYS N CA sing N N 242 +LYS N H sing N N 243 +LYS N H2 sing N N 244 +LYS CA C sing N N 245 +LYS CA CB sing N N 246 +LYS CA HA sing N N 247 +LYS C O doub N N 248 +LYS C OXT sing N N 249 +LYS CB CG sing N N 250 +LYS CB HB2 sing N N 251 +LYS CB HB3 sing N N 252 +LYS CG CD sing N N 253 +LYS CG HG2 sing N N 254 +LYS CG HG3 sing N N 255 +LYS CD CE sing N N 256 +LYS CD HD2 sing N N 257 +LYS CD HD3 sing N N 258 +LYS CE NZ sing N N 259 +LYS CE HE2 sing N N 260 +LYS CE HE3 sing N N 261 +LYS NZ HZ1 sing N N 262 +LYS NZ HZ2 sing N N 263 +LYS NZ HZ3 sing N N 264 +LYS OXT HXT sing N N 265 +MAN C1 C2 sing N N 266 +MAN C1 O1 sing N N 267 +MAN C1 O5 sing N N 268 +MAN C1 H1 sing N N 269 +MAN C2 C3 sing N N 270 +MAN C2 O2 sing N N 271 +MAN C2 H2 sing N N 272 +MAN C3 C4 sing N N 273 +MAN C3 O3 sing N N 274 +MAN C3 H3 sing N N 275 +MAN C4 C5 sing N N 276 +MAN C4 O4 sing N N 277 +MAN C4 H4 sing N N 278 +MAN C5 C6 sing N N 279 +MAN C5 O5 sing N N 280 +MAN C5 H5 sing N N 281 +MAN C6 O6 sing N N 282 +MAN C6 H61 sing N N 283 +MAN C6 H62 sing N N 284 +MAN O1 HO1 sing N N 285 +MAN O2 HO2 sing N N 286 +MAN O3 HO3 sing N N 287 +MAN O4 HO4 sing N N 288 +MAN O6 HO6 sing N N 289 +MET N CA sing N N 290 +MET N H sing N N 291 +MET N H2 sing N N 292 +MET CA C sing N N 293 +MET CA CB sing N N 294 +MET CA HA sing N N 295 +MET C O doub N N 296 +MET C OXT sing N N 297 +MET CB CG sing N N 298 +MET CB HB2 sing N N 299 +MET CB HB3 sing N N 300 +MET CG SD sing N N 301 +MET CG HG2 sing N N 302 +MET CG HG3 sing N N 303 +MET SD CE sing N N 304 +MET CE HE1 sing N N 305 +MET CE HE2 sing N N 306 +MET CE HE3 sing N N 307 +MET OXT HXT sing N N 308 +MPD C1 C2 sing N N 309 +MPD C1 H11 sing N N 310 +MPD C1 H12 sing N N 311 +MPD C1 H13 sing N N 312 +MPD C2 O2 sing N N 313 +MPD C2 CM sing N N 314 +MPD C2 C3 sing N N 315 +MPD O2 HO2 sing N N 316 +MPD CM HM1 sing N N 317 +MPD CM HM2 sing N N 318 +MPD CM HM3 sing N N 319 +MPD C3 C4 sing N N 320 +MPD C3 H31 sing N N 321 +MPD C3 H32 sing N N 322 +MPD C4 O4 sing N N 323 +MPD C4 C5 sing N N 324 +MPD C4 H4 sing N N 325 +MPD O4 HO4 sing N N 326 +MPD C5 H51 sing N N 327 +MPD C5 H52 sing N N 328 +MPD C5 H53 sing N N 329 +MRD C1 C2 sing N N 330 +MRD C1 H1C1 sing N N 331 +MRD C1 H1C2 sing N N 332 +MRD C1 H1C3 sing N N 333 +MRD C2 O2 sing N N 334 +MRD C2 CM sing N N 335 +MRD C2 C3 sing N N 336 +MRD O2 H2 sing N N 337 +MRD CM HMC1 sing N N 338 +MRD CM HMC2 sing N N 339 +MRD CM HMC3 sing N N 340 +MRD C3 C4 sing N N 341 +MRD C3 H3C1 sing N N 342 +MRD C3 H3C2 sing N N 343 +MRD C4 O4 sing N N 344 +MRD C4 C5 sing N N 345 +MRD C4 H4 sing N N 346 +MRD O4 HA sing N N 347 +MRD C5 H5C1 sing N N 348 +MRD C5 H5C2 sing N N 349 +MRD C5 H5C3 sing N N 350 +NAG C1 C2 sing N N 351 +NAG C1 O1 sing N N 352 +NAG C1 O5 sing N N 353 +NAG C1 H1 sing N N 354 +NAG C2 C3 sing N N 355 +NAG C2 N2 sing N N 356 +NAG C2 H2 sing N N 357 +NAG C3 C4 sing N N 358 +NAG C3 O3 sing N N 359 +NAG C3 H3 sing N N 360 +NAG C4 C5 sing N N 361 +NAG C4 O4 sing N N 362 +NAG C4 H4 sing N N 363 +NAG C5 C6 sing N N 364 +NAG C5 O5 sing N N 365 +NAG C5 H5 sing N N 366 +NAG C6 O6 sing N N 367 +NAG C6 H61 sing N N 368 +NAG C6 H62 sing N N 369 +NAG C7 C8 sing N N 370 +NAG C7 N2 sing N N 371 +NAG C7 O7 doub N N 372 +NAG C8 H81 sing N N 373 +NAG C8 H82 sing N N 374 +NAG C8 H83 sing N N 375 +NAG N2 HN2 sing N N 376 +NAG O1 HO1 sing N N 377 +NAG O3 HO3 sing N N 378 +NAG O4 HO4 sing N N 379 +NAG O6 HO6 sing N N 380 +PHE N CA sing N N 381 +PHE N H sing N N 382 +PHE N H2 sing N N 383 +PHE CA C sing N N 384 +PHE CA CB sing N N 385 +PHE CA HA sing N N 386 +PHE C O doub N N 387 +PHE C OXT sing N N 388 +PHE CB CG sing N N 389 +PHE CB HB2 sing N N 390 +PHE CB HB3 sing N N 391 +PHE CG CD1 doub Y N 392 +PHE CG CD2 sing Y N 393 +PHE CD1 CE1 sing Y N 394 +PHE CD1 HD1 sing N N 395 +PHE CD2 CE2 doub Y N 396 +PHE CD2 HD2 sing N N 397 +PHE CE1 CZ doub Y N 398 +PHE CE1 HE1 sing N N 399 +PHE CE2 CZ sing Y N 400 +PHE CE2 HE2 sing N N 401 +PHE CZ HZ sing N N 402 +PHE OXT HXT sing N N 403 +PRO N CA sing N N 404 +PRO N CD sing N N 405 +PRO N H sing N N 406 +PRO CA C sing N N 407 +PRO CA CB sing N N 408 +PRO CA HA sing N N 409 +PRO C O doub N N 410 +PRO C OXT sing N N 411 +PRO CB CG sing N N 412 +PRO CB HB2 sing N N 413 +PRO CB HB3 sing N N 414 +PRO CG CD sing N N 415 +PRO CG HG2 sing N N 416 +PRO CG HG3 sing N N 417 +PRO CD HD2 sing N N 418 +PRO CD HD3 sing N N 419 +PRO OXT HXT sing N N 420 +SER N CA sing N N 421 +SER N H sing N N 422 +SER N H2 sing N N 423 +SER CA C sing N N 424 +SER CA CB sing N N 425 +SER CA HA sing N N 426 +SER C O doub N N 427 +SER C OXT sing N N 428 +SER CB OG sing N N 429 +SER CB HB2 sing N N 430 +SER CB HB3 sing N N 431 +SER OG HG sing N N 432 +SER OXT HXT sing N N 433 +THR N CA sing N N 434 +THR N H sing N N 435 +THR N H2 sing N N 436 +THR CA C sing N N 437 +THR CA CB sing N N 438 +THR CA HA sing N N 439 +THR C O doub N N 440 +THR C OXT sing N N 441 +THR CB OG1 sing N N 442 +THR CB CG2 sing N N 443 +THR CB HB sing N N 444 +THR OG1 HG1 sing N N 445 +THR CG2 HG21 sing N N 446 +THR CG2 HG22 sing N N 447 +THR CG2 HG23 sing N N 448 +THR OXT HXT sing N N 449 +TRP N CA sing N N 450 +TRP N H sing N N 451 +TRP N H2 sing N N 452 +TRP CA C sing N N 453 +TRP CA CB sing N N 454 +TRP CA HA sing N N 455 +TRP C O doub N N 456 +TRP C OXT sing N N 457 +TRP CB CG sing N N 458 +TRP CB HB2 sing N N 459 +TRP CB HB3 sing N N 460 +TRP CG CD1 doub Y N 461 +TRP CG CD2 sing Y N 462 +TRP CD1 NE1 sing Y N 463 +TRP CD1 HD1 sing N N 464 +TRP CD2 CE2 doub Y N 465 +TRP CD2 CE3 sing Y N 466 +TRP NE1 CE2 sing Y N 467 +TRP NE1 HE1 sing N N 468 +TRP CE2 CZ2 sing Y N 469 +TRP CE3 CZ3 doub Y N 470 +TRP CE3 HE3 sing N N 471 +TRP CZ2 CH2 doub Y N 472 +TRP CZ2 HZ2 sing N N 473 +TRP CZ3 CH2 sing Y N 474 +TRP CZ3 HZ3 sing N N 475 +TRP CH2 HH2 sing N N 476 +TRP OXT HXT sing N N 477 +TYR N CA sing N N 478 +TYR N H sing N N 479 +TYR N H2 sing N N 480 +TYR CA C sing N N 481 +TYR CA CB sing N N 482 +TYR CA HA sing N N 483 +TYR C O doub N N 484 +TYR C OXT sing N N 485 +TYR CB CG sing N N 486 +TYR CB HB2 sing N N 487 +TYR CB HB3 sing N N 488 +TYR CG CD1 doub Y N 489 +TYR CG CD2 sing Y N 490 +TYR CD1 CE1 sing Y N 491 +TYR CD1 HD1 sing N N 492 +TYR CD2 CE2 doub Y N 493 +TYR CD2 HD2 sing N N 494 +TYR CE1 CZ doub Y N 495 +TYR CE1 HE1 sing N N 496 +TYR CE2 CZ sing Y N 497 +TYR CE2 HE2 sing N N 498 +TYR CZ OH sing N N 499 +TYR OH HH sing N N 500 +TYR OXT HXT sing N N 501 +VAL N CA sing N N 502 +VAL N H sing N N 503 +VAL N H2 sing N N 504 +VAL CA C sing N N 505 +VAL CA CB sing N N 506 +VAL CA HA sing N N 507 +VAL C O doub N N 508 +VAL C OXT sing N N 509 +VAL CB CG1 sing N N 510 +VAL CB CG2 sing N N 511 +VAL CB HB sing N N 512 +VAL CG1 HG11 sing N N 513 +VAL CG1 HG12 sing N N 514 +VAL CG1 HG13 sing N N 515 +VAL CG2 HG21 sing N N 516 +VAL CG2 HG22 sing N N 517 +VAL CG2 HG23 sing N N 518 +VAL OXT HXT sing N N 519 +# +loop_ +_pdbx_entity_branch_list.entity_id +_pdbx_entity_branch_list.comp_id +_pdbx_entity_branch_list.num +_pdbx_entity_branch_list.hetero +2 NAG 1 n +2 NAG 2 n +2 BMA 3 n +2 MAN 4 n +2 MAN 5 n +2 MAN 6 n +2 MAN 7 n +2 MAN 8 n +2 MAN 9 n +2 GUP 10 n +3 NAG 1 n +3 NAG 2 n +3 BMA 3 n +3 MAN 4 n +3 MAN 5 n +3 MAN 6 n +3 MAN 7 n +3 MAN 8 n +3 MAN 9 n +3 BMA 10 n +4 NAG 1 n +4 NAG 2 n +4 BMA 3 n +4 MAN 4 n +4 MAN 5 n +4 MAN 6 n +4 MAN 7 n +4 MAN 8 n +4 MAN 9 n +4 MAN 10 n +5 NAG 1 n +5 NAG 2 n +5 BMA 3 n +5 MAN 4 n +5 MAN 5 n +5 MAN 6 n +5 MAN 7 n +5 MAN 8 n +5 MAN 9 n +5 MAN 10 n +# +_atom_sites.entry_id 3HN3 +_atom_sites.fract_transf_matrix[1][1] 0.010686 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.008122 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.003757 +_atom_sites.fract_transf_vector[1] 0.000000 +_atom_sites.fract_transf_vector[2] 0.000000 +_atom_sites.fract_transf_vector[3] 0.000000 +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . GLY A 1 2 ? 78.913 85.993 139.085 1.00 36.13 ? 22 GLY A N 1 +ATOM 2 C CA . GLY A 1 2 ? 77.679 86.780 139.349 1.00 36.20 ? 22 GLY A CA 1 +ATOM 3 C C . GLY A 1 2 ? 77.804 87.549 140.649 1.00 36.19 ? 22 GLY A C 1 +ATOM 4 O O . GLY A 1 2 ? 78.690 87.258 141.461 1.00 36.48 ? 22 GLY A O 1 +ATOM 5 N N . LEU A 1 3 ? 76.915 88.520 140.854 1.00 36.07 ? 23 LEU A N 1 +ATOM 6 C CA . LEU A 1 3 ? 76.981 89.394 142.035 1.00 35.66 ? 23 LEU A CA 1 +ATOM 7 C C . LEU A 1 3 ? 76.867 88.586 143.323 1.00 35.03 ? 23 LEU A C 1 +ATOM 8 O O . LEU A 1 3 ? 77.693 88.713 144.233 1.00 35.16 ? 23 LEU A O 1 +ATOM 9 C CB . LEU A 1 3 ? 75.856 90.445 142.037 1.00 35.89 ? 23 LEU A CB 1 +ATOM 10 C CG . LEU A 1 3 ? 75.531 91.272 140.791 1.00 36.32 ? 23 LEU A CG 1 +ATOM 11 C CD1 . LEU A 1 3 ? 74.521 90.542 139.911 1.00 36.86 ? 23 LEU A CD1 1 +ATOM 12 C CD2 . LEU A 1 3 ? 75.011 92.662 141.177 1.00 36.86 ? 23 LEU A CD2 1 +ATOM 13 N N . GLN A 1 4 ? 75.837 87.746 143.379 1.00 34.00 ? 24 GLN A N 1 +ATOM 14 C CA . GLN A 1 4 ? 75.417 87.122 144.627 1.00 33.11 ? 24 GLN A CA 1 +ATOM 15 C C . GLN A 1 4 ? 76.143 85.819 144.923 1.00 31.59 ? 24 GLN A C 1 +ATOM 16 O O . GLN A 1 4 ? 75.713 84.760 144.473 1.00 32.36 ? 24 GLN A O 1 +ATOM 17 C CB . GLN A 1 4 ? 73.897 86.885 144.614 1.00 33.36 ? 24 GLN A CB 1 +ATOM 18 C CG . GLN A 1 4 ? 73.119 87.892 145.428 1.00 34.42 ? 24 GLN A CG 1 +ATOM 19 C CD . GLN A 1 4 ? 73.325 87.711 146.920 1.00 35.75 ? 24 GLN A CD 1 +ATOM 20 O OE1 . GLN A 1 4 ? 74.245 87.009 147.359 1.00 37.11 ? 24 GLN A OE1 1 +ATOM 21 N NE2 . GLN A 1 4 ? 72.467 88.347 147.712 1.00 36.57 ? 24 GLN A NE2 1 +ATOM 22 N N . GLY A 1 5 ? 77.243 85.903 145.671 1.00 29.56 ? 25 GLY A N 1 +ATOM 23 C CA . GLY A 1 5 ? 77.919 84.713 146.204 1.00 27.59 ? 25 GLY A CA 1 +ATOM 24 C C . GLY A 1 5 ? 78.406 83.713 145.165 1.00 25.93 ? 25 GLY A C 1 +ATOM 25 O O . GLY A 1 5 ? 78.546 84.041 143.990 1.00 25.28 ? 25 GLY A O 1 +ATOM 26 N N . GLY A 1 6 ? 78.653 82.484 145.612 1.00 23.98 ? 26 GLY A N 1 +ATOM 27 C CA . GLY A 1 6 ? 79.225 81.444 144.762 1.00 22.49 ? 26 GLY A CA 1 +ATOM 28 C C . GLY A 1 6 ? 78.219 80.719 143.886 1.00 21.34 ? 26 GLY A C 1 +ATOM 29 O O . GLY A 1 6 ? 77.010 80.985 143.929 1.00 21.22 ? 26 GLY A O 1 +ATOM 30 N N . MET A 1 7 ? 78.736 79.804 143.075 1.00 19.61 ? 27 MET A N 1 +ATOM 31 C CA . MET A 1 7 ? 77.910 78.973 142.209 1.00 18.76 ? 27 MET A CA 1 +ATOM 32 C C . MET A 1 7 ? 78.671 77.686 141.894 1.00 17.58 ? 27 MET A C 1 +ATOM 33 O O . MET A 1 7 ? 78.944 77.374 140.728 1.00 17.28 ? 27 MET A O 1 +ATOM 34 C CB . MET A 1 7 ? 77.536 79.736 140.935 1.00 18.71 ? 27 MET A CB 1 +ATOM 35 C CG . MET A 1 7 ? 76.375 79.129 140.160 1.00 19.95 ? 27 MET A CG 1 +ATOM 36 S SD . MET A 1 7 ? 74.812 79.123 141.070 1.00 20.53 ? 27 MET A SD 1 +ATOM 37 C CE . MET A 1 7 ? 74.491 80.885 141.226 1.00 21.73 ? 27 MET A CE 1 +ATOM 38 N N . LEU A 1 8 ? 79.037 76.967 142.955 1.00 16.36 ? 28 LEU A N 1 +ATOM 39 C CA . LEU A 1 8 ? 79.748 75.688 142.849 1.00 15.82 ? 28 LEU A CA 1 +ATOM 40 C C . LEU A 1 8 ? 78.829 74.606 142.303 1.00 15.99 ? 28 LEU A C 1 +ATOM 41 O O . LEU A 1 8 ? 77.660 74.534 142.688 1.00 15.11 ? 28 LEU A O 1 +ATOM 42 C CB . LEU A 1 8 ? 80.262 75.233 144.227 1.00 15.42 ? 28 LEU A CB 1 +ATOM 43 C CG . LEU A 1 8 ? 81.391 76.039 144.877 1.00 14.88 ? 28 LEU A CG 1 +ATOM 44 C CD1 . LEU A 1 8 ? 81.730 75.465 146.249 1.00 14.01 ? 28 LEU A CD1 1 +ATOM 45 C CD2 . LEU A 1 8 ? 82.626 76.058 143.992 1.00 14.28 ? 28 LEU A CD2 1 +ATOM 46 N N . TYR A 1 9 ? 79.363 73.740 141.441 1.00 16.10 ? 29 TYR A N 1 +ATOM 47 C CA . TYR A 1 9 ? 78.548 72.664 140.841 1.00 16.61 ? 29 TYR A CA 1 +ATOM 48 C C . TYR A 1 9 ? 78.123 71.637 141.893 1.00 16.13 ? 29 TYR A C 1 +ATOM 49 O O . TYR A 1 9 ? 78.979 71.028 142.531 1.00 15.02 ? 29 TYR A O 1 +ATOM 50 C CB . TYR A 1 9 ? 79.300 71.950 139.724 1.00 17.59 ? 29 TYR A CB 1 +ATOM 51 C CG . TYR A 1 9 ? 78.427 70.993 138.948 1.00 18.96 ? 29 TYR A CG 1 +ATOM 52 C CD1 . TYR A 1 9 ? 77.339 71.461 138.220 1.00 19.83 ? 29 TYR A CD1 1 +ATOM 53 C CD2 . TYR A 1 9 ? 78.683 69.621 138.942 1.00 21.53 ? 29 TYR A CD2 1 +ATOM 54 C CE1 . TYR A 1 9 ? 76.525 70.601 137.508 1.00 20.81 ? 29 TYR A CE1 1 +ATOM 55 C CE2 . TYR A 1 9 ? 77.873 68.750 138.224 1.00 20.92 ? 29 TYR A CE2 1 +ATOM 56 C CZ . TYR A 1 9 ? 76.798 69.252 137.509 1.00 20.60 ? 29 TYR A CZ 1 +ATOM 57 O OH . TYR A 1 9 ? 75.987 68.403 136.797 1.00 22.11 ? 29 TYR A OH 1 +ATOM 58 N N . PRO A 1 10 ? 76.798 71.439 142.071 1.00 16.32 ? 30 PRO A N 1 +ATOM 59 C CA . PRO A 1 10 ? 76.322 70.542 143.125 1.00 16.50 ? 30 PRO A CA 1 +ATOM 60 C C . PRO A 1 10 ? 76.896 69.128 143.048 1.00 16.94 ? 30 PRO A C 1 +ATOM 61 O O . PRO A 1 10 ? 77.017 68.553 141.960 1.00 17.08 ? 30 PRO A O 1 +ATOM 62 C CB . PRO A 1 10 ? 74.791 70.529 142.929 1.00 16.50 ? 30 PRO A CB 1 +ATOM 63 C CG . PRO A 1 10 ? 74.485 71.775 142.215 1.00 16.43 ? 30 PRO A CG 1 +ATOM 64 C CD . PRO A 1 10 ? 75.679 72.060 141.341 1.00 16.35 ? 30 PRO A CD 1 +ATOM 65 N N . GLN A 1 11 ? 77.254 68.585 144.210 1.00 17.40 ? 31 GLN A N 1 +ATOM 66 C CA . GLN A 1 11 ? 77.784 67.220 144.318 1.00 17.64 ? 31 GLN A CA 1 +ATOM 67 C C . GLN A 1 11 ? 77.381 66.604 145.655 1.00 17.82 ? 31 GLN A C 1 +ATOM 68 O O . GLN A 1 11 ? 77.176 67.321 146.640 1.00 18.29 ? 31 GLN A O 1 +ATOM 69 C CB . GLN A 1 11 ? 79.310 67.240 144.248 1.00 17.73 ? 31 GLN A CB 1 +ATOM 70 C CG . GLN A 1 11 ? 79.949 67.739 145.535 1.00 17.64 ? 31 GLN A CG 1 +ATOM 71 C CD . GLN A 1 11 ? 81.442 67.935 145.449 1.00 17.97 ? 31 GLN A CD 1 +ATOM 72 O OE1 . GLN A 1 11 ? 82.146 67.699 146.430 1.00 16.30 ? 31 GLN A OE1 1 +ATOM 73 N NE2 . GLN A 1 11 ? 81.940 68.384 144.282 1.00 17.88 ? 31 GLN A NE2 1 +ATOM 74 N N . GLU A 1 12 ? 77.295 65.282 145.703 1.00 18.02 ? 32 GLU A N 1 +ATOM 75 C CA . GLU A 1 12 ? 77.081 64.600 146.978 1.00 18.17 ? 32 GLU A CA 1 +ATOM 76 C C . GLU A 1 12 ? 78.384 64.553 147.758 1.00 17.95 ? 32 GLU A C 1 +ATOM 77 O O . GLU A 1 12 ? 79.451 64.366 147.186 1.00 17.29 ? 32 GLU A O 1 +ATOM 78 C CB . GLU A 1 12 ? 76.576 63.165 146.796 1.00 18.74 ? 32 GLU A CB 1 +ATOM 79 C CG . GLU A 1 12 ? 75.243 63.052 146.085 1.00 21.16 ? 32 GLU A CG 1 +ATOM 80 C CD . GLU A 1 12 ? 75.383 62.745 144.614 1.00 25.18 ? 32 GLU A CD 1 +ATOM 81 O OE1 . GLU A 1 12 ? 76.518 62.799 144.093 1.00 28.13 ? 32 GLU A OE1 1 +ATOM 82 O OE2 . GLU A 1 12 ? 74.358 62.429 143.975 1.00 28.12 ? 32 GLU A OE2 1 +ATOM 83 N N . SER A 1 13 ? 78.275 64.707 149.070 1.00 17.88 ? 33 SER A N 1 +ATOM 84 C CA . SER A 1 13 ? 79.418 64.556 149.969 1.00 17.60 ? 33 SER A CA 1 +ATOM 85 C C . SER A 1 13 ? 78.854 64.117 151.315 1.00 17.87 ? 33 SER A C 1 +ATOM 86 O O . SER A 1 13 ? 77.637 64.070 151.480 1.00 17.96 ? 33 SER A O 1 +ATOM 87 C CB . SER A 1 13 ? 80.215 65.864 150.059 1.00 17.35 ? 33 SER A CB 1 +ATOM 88 O OG . SER A 1 13 ? 79.669 66.763 151.003 1.00 16.56 ? 33 SER A OG 1 +ATOM 89 N N . PRO A 1 14 ? 79.717 63.757 152.277 1.00 17.94 ? 34 PRO A N 1 +ATOM 90 C CA . PRO A 1 14 ? 79.202 63.400 153.602 1.00 18.06 ? 34 PRO A CA 1 +ATOM 91 C C . PRO A 1 14 ? 78.197 64.393 154.193 1.00 18.04 ? 34 PRO A C 1 +ATOM 92 O O . PRO A 1 14 ? 77.339 63.984 154.978 1.00 18.22 ? 34 PRO A O 1 +ATOM 93 C CB . PRO A 1 14 ? 80.471 63.353 154.453 1.00 18.22 ? 34 PRO A CB 1 +ATOM 94 C CG . PRO A 1 14 ? 81.513 62.918 153.504 1.00 18.26 ? 34 PRO A CG 1 +ATOM 95 C CD . PRO A 1 14 ? 81.183 63.614 152.213 1.00 18.42 ? 34 PRO A CD 1 +ATOM 96 N N . SER A 1 15 ? 78.304 65.669 153.802 1.00 16.98 ? 35 SER A N 1 +ATOM 97 C CA . SER A 1 15 ? 77.441 66.744 154.294 1.00 16.30 ? 35 SER A CA 1 +ATOM 98 C C . SER A 1 15 ? 76.400 67.267 153.285 1.00 15.88 ? 35 SER A C 1 +ATOM 99 O O . SER A 1 15 ? 75.662 68.197 153.608 1.00 15.11 ? 35 SER A O 1 +ATOM 100 C CB . SER A 1 15 ? 78.311 67.925 154.711 1.00 16.51 ? 35 SER A CB 1 +ATOM 101 O OG . SER A 1 15 ? 79.059 68.403 153.607 1.00 15.30 ? 35 SER A OG 1 +ATOM 102 N N . ARG A 1 16 ? 76.347 66.701 152.075 1.00 15.03 ? 36 ARG A N 1 +ATOM 103 C CA . ARG A 1 16 ? 75.480 67.224 151.016 1.00 14.86 ? 36 ARG A CA 1 +ATOM 104 C C . ARG A 1 16 ? 74.793 66.133 150.205 1.00 14.92 ? 36 ARG A C 1 +ATOM 105 O O . ARG A 1 16 ? 75.443 65.217 149.740 1.00 15.28 ? 36 ARG A O 1 +ATOM 106 C CB . ARG A 1 16 ? 76.285 68.099 150.039 1.00 14.76 ? 36 ARG A CB 1 +ATOM 107 C CG . ARG A 1 16 ? 77.035 69.239 150.671 1.00 14.89 ? 36 ARG A CG 1 +ATOM 108 C CD . ARG A 1 16 ? 77.668 70.142 149.616 1.00 14.85 ? 36 ARG A CD 1 +ATOM 109 N NE . ARG A 1 16 ? 78.237 71.330 150.241 1.00 14.70 ? 36 ARG A NE 1 +ATOM 110 C CZ . ARG A 1 16 ? 78.451 72.493 149.628 1.00 14.65 ? 36 ARG A CZ 1 +ATOM 111 N NH1 . ARG A 1 16 ? 78.160 72.670 148.339 1.00 15.22 ? 36 ARG A NH1 1 +ATOM 112 N NH2 . ARG A 1 16 ? 78.948 73.503 150.321 1.00 13.32 ? 36 ARG A NH2 1 +ATOM 113 N N . GLU A 1 17 ? 73.484 66.278 149.999 1.00 15.29 ? 37 GLU A N 1 +ATOM 114 C CA . GLU A 1 17 ? 72.709 65.375 149.150 1.00 15.68 ? 37 GLU A CA 1 +ATOM 115 C C . GLU A 1 17 ? 72.304 66.076 147.859 1.00 16.19 ? 37 GLU A C 1 +ATOM 116 O O . GLU A 1 17 ? 72.326 67.305 147.794 1.00 15.83 ? 37 GLU A O 1 +ATOM 117 C CB . GLU A 1 17 ? 71.447 64.934 149.873 1.00 15.59 ? 37 GLU A CB 1 +ATOM 118 C CG . GLU A 1 17 ? 71.713 64.110 151.130 1.00 17.03 ? 37 GLU A CG 1 +ATOM 119 C CD . GLU A 1 17 ? 70.444 63.775 151.853 1.00 17.48 ? 37 GLU A CD 1 +ATOM 120 O OE1 . GLU A 1 17 ? 69.499 63.329 151.182 1.00 18.62 ? 37 GLU A OE1 1 +ATOM 121 O OE2 . GLU A 1 17 ? 70.384 63.961 153.084 1.00 17.18 ? 37 GLU A OE2 1 +ATOM 122 N N . CYS A 1 18 ? 71.921 65.275 146.860 1.00 16.82 ? 38 CYS A N 1 +ATOM 123 C CA . CYS A 1 18 ? 71.457 65.748 145.556 1.00 18.38 ? 38 CYS A CA 1 +ATOM 124 C C . CYS A 1 18 ? 70.249 64.948 145.091 1.00 18.29 ? 38 CYS A C 1 +ATOM 125 O O . CYS A 1 18 ? 70.313 63.729 145.049 1.00 19.15 ? 38 CYS A O 1 +ATOM 126 C CB . CYS A 1 18 ? 72.530 65.531 144.508 1.00 18.60 ? 38 CYS A CB 1 +ATOM 127 S SG . CYS A 1 18 ? 73.871 66.609 144.628 1.00 23.21 ? 38 CYS A SG 1 +ATOM 128 N N . LYS A 1 19 ? 69.172 65.635 144.708 1.00 18.64 ? 39 LYS A N 1 +ATOM 129 C CA . LYS A 1 19 ? 67.998 64.976 144.138 1.00 18.87 ? 39 LYS A CA 1 +ATOM 130 C C . LYS A 1 19 ? 67.649 65.643 142.808 1.00 18.62 ? 39 LYS A C 1 +ATOM 131 O O . LYS A 1 19 ? 67.179 66.777 142.779 1.00 18.19 ? 39 LYS A O 1 +ATOM 132 C CB . LYS A 1 19 ? 66.806 65.037 145.099 1.00 19.22 ? 39 LYS A CB 1 +ATOM 133 C CG . LYS A 1 19 ? 65.598 64.229 144.634 1.00 19.29 ? 39 LYS A CG 1 +ATOM 134 C CD . LYS A 1 19 ? 64.481 64.178 145.686 1.00 19.67 ? 39 LYS A CD 1 +ATOM 135 C CE . LYS A 1 19 ? 63.257 63.418 145.168 1.00 20.89 ? 39 LYS A CE 1 +ATOM 136 N NZ . LYS A 1 19 ? 63.539 61.988 144.834 1.00 20.35 ? 39 LYS A NZ 1 +ATOM 137 N N . GLU A 1 20 ? 67.893 64.922 141.719 1.00 18.47 ? 40 GLU A N 1 +ATOM 138 C CA . GLU A 1 20 ? 67.635 65.412 140.383 1.00 18.61 ? 40 GLU A CA 1 +ATOM 139 C C . GLU A 1 20 ? 66.138 65.411 140.142 1.00 17.66 ? 40 GLU A C 1 +ATOM 140 O O . GLU A 1 20 ? 65.437 64.500 140.589 1.00 17.54 ? 40 GLU A O 1 +ATOM 141 C CB . GLU A 1 20 ? 68.319 64.515 139.351 1.00 19.27 ? 40 GLU A CB 1 +ATOM 142 C CG . GLU A 1 20 ? 69.847 64.460 139.471 1.00 21.05 ? 40 GLU A CG 1 +ATOM 143 C CD . GLU A 1 20 ? 70.362 63.323 140.363 1.00 24.20 ? 40 GLU A CD 1 +ATOM 144 O OE1 . GLU A 1 20 ? 69.561 62.712 141.110 1.00 25.53 ? 40 GLU A OE1 1 +ATOM 145 O OE2 . GLU A 1 20 ? 71.584 63.052 140.320 1.00 25.88 ? 40 GLU A OE2 1 +ATOM 146 N N . LEU A 1 21 ? 65.652 66.421 139.431 1.00 16.42 ? 41 LEU A N 1 +ATOM 147 C CA . LEU A 1 21 ? 64.235 66.514 139.104 1.00 16.29 ? 41 LEU A CA 1 +ATOM 148 C C . LEU A 1 21 ? 64.019 66.372 137.612 1.00 16.60 ? 41 LEU A C 1 +ATOM 149 O O . LEU A 1 21 ? 63.200 67.082 137.039 1.00 16.76 ? 41 LEU A O 1 +ATOM 150 C CB . LEU A 1 21 ? 63.645 67.843 139.596 1.00 16.24 ? 41 LEU A CB 1 +ATOM 151 C CG . LEU A 1 21 ? 63.732 68.105 141.098 1.00 16.64 ? 41 LEU A CG 1 +ATOM 152 C CD1 . LEU A 1 21 ? 63.260 69.518 141.398 1.00 16.25 ? 41 LEU A CD1 1 +ATOM 153 C CD2 . LEU A 1 21 ? 62.927 67.064 141.907 1.00 16.61 ? 41 LEU A CD2 1 +ATOM 154 N N . ASP A 1 22 ? 64.732 65.436 136.992 1.00 16.83 ? 42 ASP A N 1 +ATOM 155 C CA . ASP A 1 22 ? 64.541 65.122 135.576 1.00 16.83 ? 42 ASP A CA 1 +ATOM 156 C C . ASP A 1 22 ? 63.270 64.312 135.344 1.00 16.30 ? 42 ASP A C 1 +ATOM 157 O O . ASP A 1 22 ? 62.750 63.647 136.257 1.00 16.60 ? 42 ASP A O 1 +ATOM 158 C CB . ASP A 1 22 ? 65.726 64.315 135.027 1.00 17.09 ? 42 ASP A CB 1 +ATOM 159 C CG . ASP A 1 22 ? 67.044 65.062 135.096 1.00 19.44 ? 42 ASP A CG 1 +ATOM 160 O OD1 . ASP A 1 22 ? 67.054 66.301 135.261 1.00 21.60 ? 42 ASP A OD1 1 +ATOM 161 O OD2 . ASP A 1 22 ? 68.086 64.382 134.969 1.00 22.47 ? 42 ASP A OD2 1 +ATOM 162 N N . GLY A 1 23 ? 62.785 64.348 134.107 1.00 15.04 ? 43 GLY A N 1 +ATOM 163 C CA . GLY A 1 23 ? 61.625 63.551 133.717 1.00 14.17 ? 43 GLY A CA 1 +ATOM 164 C C . GLY A 1 23 ? 60.507 64.452 133.276 1.00 13.29 ? 43 GLY A C 1 +ATOM 165 O O . GLY A 1 23 ? 60.746 65.531 132.715 1.00 12.59 ? 43 GLY A O 1 +ATOM 166 N N . LEU A 1 24 ? 59.274 64.033 133.537 1.00 12.76 ? 44 LEU A N 1 +ATOM 167 C CA . LEU A 1 24 ? 58.126 64.781 133.036 1.00 12.53 ? 44 LEU A CA 1 +ATOM 168 C C . LEU A 1 24 ? 57.744 65.957 133.937 1.00 12.55 ? 44 LEU A C 1 +ATOM 169 O O . LEU A 1 24 ? 57.658 65.818 135.165 1.00 13.06 ? 44 LEU A O 1 +ATOM 170 C CB . LEU A 1 24 ? 56.923 63.858 132.887 1.00 12.53 ? 44 LEU A CB 1 +ATOM 171 C CG . LEU A 1 24 ? 57.108 62.642 131.996 1.00 12.72 ? 44 LEU A CG 1 +ATOM 172 C CD1 . LEU A 1 24 ? 55.884 61.703 132.136 1.00 12.38 ? 44 LEU A CD1 1 +ATOM 173 C CD2 . LEU A 1 24 ? 57.341 63.074 130.542 1.00 13.14 ? 44 LEU A CD2 1 +ATOM 174 N N . TRP A 1 25 ? 57.506 67.102 133.307 1.00 12.00 ? 45 TRP A N 1 +ATOM 175 C CA . TRP A 1 25 ? 56.908 68.263 133.969 1.00 11.83 ? 45 TRP A CA 1 +ATOM 176 C C . TRP A 1 25 ? 55.633 68.604 133.225 1.00 11.92 ? 45 TRP A C 1 +ATOM 177 O O . TRP A 1 25 ? 55.506 68.298 132.033 1.00 12.03 ? 45 TRP A O 1 +ATOM 178 C CB . TRP A 1 25 ? 57.837 69.468 133.927 1.00 11.47 ? 45 TRP A CB 1 +ATOM 179 C CG . TRP A 1 25 ? 59.065 69.358 134.779 1.00 11.66 ? 45 TRP A CG 1 +ATOM 180 C CD1 . TRP A 1 25 ? 59.992 68.347 134.778 1.00 11.83 ? 45 TRP A CD1 1 +ATOM 181 C CD2 . TRP A 1 25 ? 59.525 70.322 135.723 1.00 11.22 ? 45 TRP A CD2 1 +ATOM 182 N NE1 . TRP A 1 25 ? 60.992 68.625 135.682 1.00 12.28 ? 45 TRP A NE1 1 +ATOM 183 C CE2 . TRP A 1 25 ? 60.732 69.838 136.266 1.00 11.81 ? 45 TRP A CE2 1 +ATOM 184 C CE3 . TRP A 1 25 ? 59.037 71.563 136.163 1.00 11.43 ? 45 TRP A CE3 1 +ATOM 185 C CZ2 . TRP A 1 25 ? 61.445 70.538 137.249 1.00 11.60 ? 45 TRP A CZ2 1 +ATOM 186 C CZ3 . TRP A 1 25 ? 59.755 72.263 137.134 1.00 11.55 ? 45 TRP A CZ3 1 +ATOM 187 C CH2 . TRP A 1 25 ? 60.940 71.750 137.663 1.00 11.77 ? 45 TRP A CH2 1 +ATOM 188 N N . SER A 1 26 ? 54.687 69.218 133.933 1.00 11.40 ? 46 SER A N 1 +ATOM 189 C CA . SER A 1 26 ? 53.484 69.742 133.307 1.00 11.18 ? 46 SER A CA 1 +ATOM 190 C C . SER A 1 26 ? 53.848 71.072 132.652 1.00 10.46 ? 46 SER A C 1 +ATOM 191 O O . SER A 1 26 ? 54.733 71.772 133.124 1.00 9.48 ? 46 SER A O 1 +ATOM 192 C CB . SER A 1 26 ? 52.355 69.891 134.342 1.00 11.31 ? 46 SER A CB 1 +ATOM 193 O OG . SER A 1 26 ? 52.051 68.616 134.915 1.00 14.88 ? 46 SER A OG 1 +ATOM 194 N N . PHE A 1 27 ? 53.192 71.382 131.543 1.00 10.35 ? 47 PHE A N 1 +ATOM 195 C CA . PHE A 1 27 ? 53.624 72.474 130.669 1.00 10.06 ? 47 PHE A CA 1 +ATOM 196 C C . PHE A 1 27 ? 52.435 73.094 129.964 1.00 10.71 ? 47 PHE A C 1 +ATOM 197 O O . PHE A 1 27 ? 51.515 72.390 129.554 1.00 10.91 ? 47 PHE A O 1 +ATOM 198 C CB . PHE A 1 27 ? 54.595 71.901 129.632 1.00 9.53 ? 47 PHE A CB 1 +ATOM 199 C CG . PHE A 1 27 ? 55.064 72.884 128.589 1.00 9.66 ? 47 PHE A CG 1 +ATOM 200 C CD1 . PHE A 1 27 ? 54.312 73.115 127.451 1.00 9.87 ? 47 PHE A CD1 1 +ATOM 201 C CD2 . PHE A 1 27 ? 56.299 73.502 128.707 1.00 8.83 ? 47 PHE A CD2 1 +ATOM 202 C CE1 . PHE A 1 27 ? 54.760 73.987 126.463 1.00 9.54 ? 47 PHE A CE1 1 +ATOM 203 C CE2 . PHE A 1 27 ? 56.746 74.377 127.733 1.00 9.14 ? 47 PHE A CE2 1 +ATOM 204 C CZ . PHE A 1 27 ? 55.974 74.620 126.613 1.00 9.08 ? 47 PHE A CZ 1 +ATOM 205 N N . ARG A 1 28 ? 52.466 74.416 129.837 1.00 11.52 ? 48 ARG A N 1 +ATOM 206 C CA . ARG A 1 28 ? 51.528 75.145 129.003 1.00 12.53 ? 48 ARG A CA 1 +ATOM 207 C C . ARG A 1 28 ? 52.213 76.406 128.489 1.00 11.95 ? 48 ARG A C 1 +ATOM 208 O O . ARG A 1 28 ? 52.900 77.095 129.244 1.00 11.83 ? 48 ARG A O 1 +ATOM 209 C CB . ARG A 1 28 ? 50.248 75.521 129.777 1.00 12.96 ? 48 ARG A CB 1 +ATOM 210 C CG A ARG A 1 28 ? 49.164 76.165 128.926 0.50 15.12 ? 48 ARG A CG 1 +ATOM 211 C CG B ARG A 1 28 ? 49.262 76.318 128.923 0.50 14.49 ? 48 ARG A CG 1 +ATOM 212 C CD A ARG A 1 28 ? 48.229 77.005 129.766 0.50 16.63 ? 48 ARG A CD 1 +ATOM 213 C CD B ARG A 1 28 ? 47.844 76.376 129.467 0.50 14.43 ? 48 ARG A CD 1 +ATOM 214 N NE A ARG A 1 28 ? 46.874 77.062 129.219 0.50 18.38 ? 48 ARG A NE 1 +ATOM 215 N NE B ARG A 1 28 ? 47.741 76.996 130.787 0.50 16.97 ? 48 ARG A NE 1 +ATOM 216 C CZ A ARG A 1 28 ? 45.839 77.609 129.849 0.50 18.83 ? 48 ARG A CZ 1 +ATOM 217 C CZ B ARG A 1 28 ? 47.506 76.355 131.935 0.50 16.77 ? 48 ARG A CZ 1 +ATOM 218 N NH1 A ARG A 1 28 ? 46.002 78.153 131.050 0.50 19.96 ? 48 ARG A NH1 1 +ATOM 219 N NH1 B ARG A 1 28 ? 47.330 75.041 131.984 0.50 17.30 ? 48 ARG A NH1 1 +ATOM 220 N NH2 A ARG A 1 28 ? 44.638 77.613 129.281 0.50 18.80 ? 48 ARG A NH2 1 +ATOM 221 N NH2 B ARG A 1 28 ? 47.427 77.050 133.059 0.50 15.26 ? 48 ARG A NH2 1 +ATOM 222 N N . ALA A 1 29 ? 52.044 76.685 127.199 1.00 11.14 ? 49 ALA A N 1 +ATOM 223 C CA . ALA A 1 29 ? 52.450 77.983 126.640 1.00 11.30 ? 49 ALA A CA 1 +ATOM 224 C C . ALA A 1 29 ? 51.289 78.931 126.863 1.00 11.40 ? 49 ALA A C 1 +ATOM 225 O O . ALA A 1 29 ? 50.128 78.516 126.739 1.00 11.83 ? 49 ALA A O 1 +ATOM 226 C CB . ALA A 1 29 ? 52.764 77.846 125.158 1.00 11.42 ? 49 ALA A CB 1 +ATOM 227 N N . ASP A 1 30 ? 51.585 80.189 127.191 1.00 11.47 ? 50 ASP A N 1 +ATOM 228 C CA . ASP A 1 30 ? 50.536 81.199 127.341 1.00 11.12 ? 50 ASP A CA 1 +ATOM 229 C C . ASP A 1 30 ? 50.333 81.915 126.017 1.00 11.25 ? 50 ASP A C 1 +ATOM 230 O O . ASP A 1 30 ? 51.041 82.867 125.718 1.00 10.51 ? 50 ASP A O 1 +ATOM 231 C CB . ASP A 1 30 ? 50.888 82.196 128.453 1.00 11.05 ? 50 ASP A CB 1 +ATOM 232 C CG . ASP A 1 30 ? 49.786 83.234 128.688 1.00 10.69 ? 50 ASP A CG 1 +ATOM 233 O OD1 . ASP A 1 30 ? 48.767 83.213 127.953 1.00 11.49 ? 50 ASP A OD1 1 +ATOM 234 O OD2 . ASP A 1 30 ? 49.946 84.066 129.615 1.00 10.45 ? 50 ASP A OD2 1 +ATOM 235 N N . PHE A 1 31 ? 49.373 81.438 125.219 1.00 12.11 ? 51 PHE A N 1 +ATOM 236 C CA . PHE A 1 31 ? 49.071 82.035 123.908 1.00 13.11 ? 51 PHE A CA 1 +ATOM 237 C C . PHE A 1 31 ? 48.071 83.208 123.951 1.00 13.25 ? 51 PHE A C 1 +ATOM 238 O O . PHE A 1 31 ? 47.522 83.572 122.915 1.00 14.07 ? 51 PHE A O 1 +ATOM 239 C CB . PHE A 1 31 ? 48.477 80.997 122.954 1.00 13.73 ? 51 PHE A CB 1 +ATOM 240 C CG . PHE A 1 31 ? 49.420 79.908 122.550 1.00 15.05 ? 51 PHE A CG 1 +ATOM 241 C CD1 . PHE A 1 31 ? 50.366 80.126 121.562 1.00 17.34 ? 51 PHE A CD1 1 +ATOM 242 C CD2 . PHE A 1 31 ? 49.306 78.643 123.097 1.00 16.66 ? 51 PHE A CD2 1 +ATOM 243 C CE1 . PHE A 1 31 ? 51.224 79.104 121.166 1.00 17.60 ? 51 PHE A CE1 1 +ATOM 244 C CE2 . PHE A 1 31 ? 50.163 77.627 122.709 1.00 17.21 ? 51 PHE A CE2 1 +ATOM 245 C CZ . PHE A 1 31 ? 51.117 77.863 121.740 1.00 14.74 ? 51 PHE A CZ 1 +ATOM 246 N N . SER A 1 32 ? 47.812 83.794 125.114 1.00 13.59 ? 52 SER A N 1 +ATOM 247 C CA . SER A 1 32 ? 46.965 85.004 125.162 1.00 13.52 ? 52 SER A CA 1 +ATOM 248 C C . SER A 1 32 ? 47.552 86.117 124.280 1.00 14.49 ? 52 SER A C 1 +ATOM 249 O O . SER A 1 32 ? 48.763 86.213 124.136 1.00 14.10 ? 52 SER A O 1 +ATOM 250 C CB . SER A 1 32 ? 46.764 85.492 126.606 1.00 13.78 ? 52 SER A CB 1 +ATOM 251 O OG . SER A 1 32 ? 47.978 85.766 127.281 1.00 11.77 ? 52 SER A OG 1 +ATOM 252 N N . ASP A 1 33 ? 46.692 86.945 123.689 1.00 14.49 ? 53 ASP A N 1 +ATOM 253 C CA . ASP A 1 33 ? 47.138 88.030 122.799 1.00 15.01 ? 53 ASP A CA 1 +ATOM 254 C C . ASP A 1 33 ? 48.170 88.930 123.472 1.00 14.31 ? 53 ASP A C 1 +ATOM 255 O O . ASP A 1 33 ? 49.192 89.265 122.877 1.00 15.13 ? 53 ASP A O 1 +ATOM 256 C CB . ASP A 1 33 ? 45.943 88.859 122.309 1.00 15.74 ? 53 ASP A CB 1 +ATOM 257 C CG . ASP A 1 33 ? 45.106 88.129 121.265 1.00 18.51 ? 53 ASP A CG 1 +ATOM 258 O OD1 . ASP A 1 33 ? 45.624 87.204 120.599 1.00 21.21 ? 53 ASP A OD1 1 +ATOM 259 O OD2 . ASP A 1 33 ? 43.916 88.489 121.107 1.00 23.43 ? 53 ASP A OD2 1 +ATOM 260 N N . ASN A 1 34 ? 47.930 89.293 124.726 1.00 13.61 ? 54 ASN A N 1 +ATOM 261 C CA . ASN A 1 34 ? 48.900 90.122 125.447 1.00 13.68 ? 54 ASN A CA 1 +ATOM 262 C C . ASN A 1 34 ? 50.004 89.308 126.127 1.00 13.38 ? 54 ASN A C 1 +ATOM 263 O O . ASN A 1 34 ? 50.864 89.882 126.791 1.00 13.65 ? 54 ASN A O 1 +ATOM 264 C CB . ASN A 1 34 ? 48.222 91.090 126.429 1.00 13.36 ? 54 ASN A CB 1 +ATOM 265 C CG . ASN A 1 34 ? 47.613 90.401 127.651 1.00 13.53 ? 54 ASN A CG 1 +ATOM 266 O OD1 . ASN A 1 34 ? 47.815 89.213 127.891 1.00 13.19 ? 54 ASN A OD1 1 +ATOM 267 N ND2 . ASN A 1 34 ? 46.850 91.173 128.435 1.00 13.30 ? 54 ASN A ND2 1 +ATOM 268 N N . ARG A 1 35 ? 49.958 87.985 125.961 1.00 13.54 ? 55 ARG A N 1 +ATOM 269 C CA . ARG A 1 35 ? 50.984 87.052 126.461 1.00 13.27 ? 55 ARG A CA 1 +ATOM 270 C C . ARG A 1 35 ? 51.133 87.057 127.987 1.00 13.67 ? 55 ARG A C 1 +ATOM 271 O O . ARG A 1 35 ? 52.099 86.494 128.510 1.00 12.95 ? 55 ARG A O 1 +ATOM 272 C CB . ARG A 1 35 ? 52.347 87.318 125.776 1.00 13.10 ? 55 ARG A CB 1 +ATOM 273 C CG . ARG A 1 35 ? 52.362 87.065 124.277 1.00 12.46 ? 55 ARG A CG 1 +ATOM 274 C CD . ARG A 1 35 ? 52.233 85.589 123.961 1.00 12.98 ? 55 ARG A CD 1 +ATOM 275 N NE . ARG A 1 35 ? 52.463 85.235 122.570 1.00 13.87 ? 55 ARG A NE 1 +ATOM 276 C CZ . ARG A 1 35 ? 51.569 85.343 121.588 1.00 15.00 ? 55 ARG A CZ 1 +ATOM 277 N NH1 . ARG A 1 35 ? 50.347 85.832 121.804 1.00 16.07 ? 55 ARG A NH1 1 +ATOM 278 N NH2 . ARG A 1 35 ? 51.908 84.951 120.368 1.00 15.45 ? 55 ARG A NH2 1 +ATOM 279 N N . ARG A 1 36 ? 50.148 87.630 128.697 1.00 13.19 ? 56 ARG A N 1 +ATOM 280 C CA . ARG A 1 36 ? 50.242 87.869 130.142 1.00 13.44 ? 56 ARG A CA 1 +ATOM 281 C C . ARG A 1 36 ? 49.105 87.243 130.974 1.00 13.12 ? 56 ARG A C 1 +ATOM 282 O O . ARG A 1 36 ? 49.077 87.421 132.193 1.00 12.61 ? 56 ARG A O 1 +ATOM 283 C CB . ARG A 1 36 ? 50.218 89.380 130.429 1.00 14.60 ? 56 ARG A CB 1 +ATOM 284 C CG . ARG A 1 36 ? 51.461 90.115 130.120 1.00 16.60 ? 56 ARG A CG 1 +ATOM 285 C CD . ARG A 1 36 ? 51.387 91.555 130.652 1.00 17.62 ? 56 ARG A CD 1 +ATOM 286 N NE . ARG A 1 36 ? 50.242 92.338 130.150 1.00 18.77 ? 56 ARG A NE 1 +ATOM 287 C CZ . ARG A 1 36 ? 50.217 93.011 128.994 1.00 18.13 ? 56 ARG A CZ 1 +ATOM 288 N NH1 . ARG A 1 36 ? 51.244 92.980 128.160 1.00 17.75 ? 56 ARG A NH1 1 +ATOM 289 N NH2 . ARG A 1 36 ? 49.138 93.707 128.653 1.00 18.82 ? 56 ARG A NH2 1 +ATOM 290 N N . ARG A 1 37 ? 48.189 86.522 130.339 1.00 12.77 ? 57 ARG A N 1 +ATOM 291 C CA . ARG A 1 37 ? 47.059 85.905 131.057 1.00 13.52 ? 57 ARG A CA 1 +ATOM 292 C C . ARG A 1 37 ? 47.501 85.142 132.310 1.00 13.27 ? 57 ARG A C 1 +ATOM 293 O O . ARG A 1 37 ? 46.821 85.170 133.343 1.00 13.10 ? 57 ARG A O 1 +ATOM 294 C CB . ARG A 1 37 ? 46.283 85.000 130.107 1.00 14.12 ? 57 ARG A CB 1 +ATOM 295 C CG . ARG A 1 37 ? 45.094 84.257 130.732 1.00 16.10 ? 57 ARG A CG 1 +ATOM 296 C CD A ARG A 1 37 ? 44.097 83.786 129.667 0.50 17.26 ? 57 ARG A CD 1 +ATOM 297 C CD B ARG A 1 37 ? 44.044 83.946 129.688 0.50 18.43 ? 57 ARG A CD 1 +ATOM 298 N NE A ARG A 1 37 ? 43.058 82.917 130.229 0.50 17.51 ? 57 ARG A NE 1 +ATOM 299 N NE B ARG A 1 37 ? 43.385 85.178 129.236 0.50 19.64 ? 57 ARG A NE 1 +ATOM 300 C CZ A ARG A 1 37 ? 42.126 82.272 129.526 0.50 18.21 ? 57 ARG A CZ 1 +ATOM 301 C CZ B ARG A 1 37 ? 42.163 85.248 128.716 0.50 20.47 ? 57 ARG A CZ 1 +ATOM 302 N NH1 A ARG A 1 37 ? 42.081 82.360 128.202 0.50 18.38 ? 57 ARG A NH1 1 +ATOM 303 N NH1 B ARG A 1 37 ? 41.421 84.156 128.558 0.50 21.04 ? 57 ARG A NH1 1 +ATOM 304 N NH2 A ARG A 1 37 ? 41.234 81.513 130.156 0.50 18.71 ? 57 ARG A NH2 1 +ATOM 305 N NH2 B ARG A 1 37 ? 41.675 86.430 128.348 0.50 20.80 ? 57 ARG A NH2 1 +ATOM 306 N N . GLY A 1 38 ? 48.650 84.479 132.233 1.00 12.75 ? 58 GLY A N 1 +ATOM 307 C CA . GLY A 1 38 ? 49.148 83.674 133.353 1.00 12.85 ? 58 GLY A CA 1 +ATOM 308 C C . GLY A 1 38 ? 49.490 84.496 134.583 1.00 12.86 ? 58 GLY A C 1 +ATOM 309 O O . GLY A 1 38 ? 49.336 84.020 135.714 1.00 12.97 ? 58 GLY A O 1 +ATOM 310 N N . PHE A 1 39 ? 49.943 85.727 134.360 1.00 12.35 ? 59 PHE A N 1 +ATOM 311 C CA . PHE A 1 39 ? 50.207 86.671 135.449 1.00 12.74 ? 59 PHE A CA 1 +ATOM 312 C C . PHE A 1 39 ? 48.924 87.356 135.915 1.00 13.33 ? 59 PHE A C 1 +ATOM 313 O O . PHE A 1 39 ? 48.747 87.569 137.113 1.00 14.24 ? 59 PHE A O 1 +ATOM 314 C CB . PHE A 1 39 ? 51.269 87.693 135.032 1.00 12.71 ? 59 PHE A CB 1 +ATOM 315 C CG . PHE A 1 39 ? 52.605 87.069 134.789 1.00 13.07 ? 59 PHE A CG 1 +ATOM 316 C CD1 . PHE A 1 39 ? 53.462 86.823 135.851 1.00 13.34 ? 59 PHE A CD1 1 +ATOM 317 C CD2 . PHE A 1 39 ? 52.969 86.641 133.522 1.00 13.66 ? 59 PHE A CD2 1 +ATOM 318 C CE1 . PHE A 1 39 ? 54.683 86.212 135.646 1.00 13.22 ? 59 PHE A CE1 1 +ATOM 319 C CE2 . PHE A 1 39 ? 54.179 86.011 133.320 1.00 10.93 ? 59 PHE A CE2 1 +ATOM 320 C CZ . PHE A 1 39 ? 55.034 85.804 134.377 1.00 12.44 ? 59 PHE A CZ 1 +ATOM 321 N N . GLU A 1 40 ? 48.033 87.670 134.974 1.00 13.77 ? 60 GLU A N 1 +ATOM 322 C CA . GLU A 1 40 ? 46.738 88.297 135.299 1.00 14.32 ? 60 GLU A CA 1 +ATOM 323 C C . GLU A 1 40 ? 45.913 87.371 136.184 1.00 14.45 ? 60 GLU A C 1 +ATOM 324 O O . GLU A 1 40 ? 45.306 87.812 137.165 1.00 14.98 ? 60 GLU A O 1 +ATOM 325 C CB . GLU A 1 40 ? 45.951 88.599 134.032 1.00 14.18 ? 60 GLU A CB 1 +ATOM 326 C CG . GLU A 1 40 ? 46.576 89.663 133.137 1.00 15.28 ? 60 GLU A CG 1 +ATOM 327 C CD . GLU A 1 40 ? 45.903 89.769 131.774 1.00 15.50 ? 60 GLU A CD 1 +ATOM 328 O OE1 . GLU A 1 40 ? 45.125 88.853 131.394 1.00 18.94 ? 60 GLU A OE1 1 +ATOM 329 O OE2 . GLU A 1 40 ? 46.175 90.767 131.077 1.00 17.50 ? 60 GLU A OE2 1 +ATOM 330 N N . GLU A 1 41 ? 45.898 86.092 135.824 1.00 14.16 ? 61 GLU A N 1 +ATOM 331 C CA . GLU A 1 41 ? 45.161 85.058 136.568 1.00 14.33 ? 61 GLU A CA 1 +ATOM 332 C C . GLU A 1 41 ? 45.996 84.373 137.658 1.00 13.83 ? 61 GLU A C 1 +ATOM 333 O O . GLU A 1 41 ? 45.497 83.494 138.376 1.00 13.15 ? 61 GLU A O 1 +ATOM 334 C CB . GLU A 1 41 ? 44.634 83.999 135.589 1.00 14.78 ? 61 GLU A CB 1 +ATOM 335 C CG . GLU A 1 41 ? 43.686 84.535 134.500 1.00 15.82 ? 61 GLU A CG 1 +ATOM 336 C CD . GLU A 1 41 ? 43.003 83.423 133.711 1.00 15.65 ? 61 GLU A CD 1 +ATOM 337 O OE1 . GLU A 1 41 ? 43.549 82.298 133.657 1.00 16.09 ? 61 GLU A OE1 1 +ATOM 338 O OE2 . GLU A 1 41 ? 41.918 83.669 133.125 1.00 18.06 ? 61 GLU A OE2 1 +ATOM 339 N N . GLN A 1 42 ? 47.276 84.731 137.751 1.00 13.04 ? 62 GLN A N 1 +ATOM 340 C CA . GLN A 1 42 ? 48.179 84.161 138.749 1.00 13.24 ? 62 GLN A CA 1 +ATOM 341 C C . GLN A 1 42 ? 48.138 82.626 138.796 1.00 13.15 ? 62 GLN A C 1 +ATOM 342 O O . GLN A 1 42 ? 47.863 82.014 139.839 1.00 13.12 ? 62 GLN A O 1 +ATOM 343 C CB . GLN A 1 42 ? 47.885 84.751 140.129 1.00 13.64 ? 62 GLN A CB 1 +ATOM 344 C CG . GLN A 1 42 ? 48.016 86.267 140.172 1.00 13.97 ? 62 GLN A CG 1 +ATOM 345 C CD . GLN A 1 42 ? 48.139 86.826 141.591 1.00 14.79 ? 62 GLN A CD 1 +ATOM 346 O OE1 . GLN A 1 42 ? 48.219 86.084 142.565 1.00 17.06 ? 62 GLN A OE1 1 +ATOM 347 N NE2 . GLN A 1 42 ? 48.157 88.143 141.698 1.00 14.03 ? 62 GLN A NE2 1 +ATOM 348 N N . TRP A 1 43 ? 48.441 82.008 137.656 1.00 13.07 ? 63 TRP A N 1 +ATOM 349 C CA . TRP A 1 43 ? 48.411 80.552 137.526 1.00 13.28 ? 63 TRP A CA 1 +ATOM 350 C C . TRP A 1 43 ? 49.223 79.836 138.611 1.00 13.61 ? 63 TRP A C 1 +ATOM 351 O O . TRP A 1 43 ? 48.844 78.756 139.074 1.00 13.50 ? 63 TRP A O 1 +ATOM 352 C CB . TRP A 1 43 ? 48.912 80.129 136.135 1.00 13.20 ? 63 TRP A CB 1 +ATOM 353 C CG . TRP A 1 43 ? 47.997 80.519 134.979 1.00 13.21 ? 63 TRP A CG 1 +ATOM 354 C CD1 . TRP A 1 43 ? 46.715 80.990 135.063 1.00 13.39 ? 63 TRP A CD1 1 +ATOM 355 C CD2 . TRP A 1 43 ? 48.288 80.420 133.577 1.00 13.53 ? 63 TRP A CD2 1 +ATOM 356 N NE1 . TRP A 1 43 ? 46.199 81.201 133.811 1.00 12.56 ? 63 TRP A NE1 1 +ATOM 357 C CE2 . TRP A 1 43 ? 47.145 80.861 132.879 1.00 13.03 ? 63 TRP A CE2 1 +ATOM 358 C CE3 . TRP A 1 43 ? 49.407 80.009 132.843 1.00 13.88 ? 63 TRP A CE3 1 +ATOM 359 C CZ2 . TRP A 1 43 ? 47.093 80.912 131.484 1.00 12.98 ? 63 TRP A CZ2 1 +ATOM 360 C CZ3 . TRP A 1 43 ? 49.349 80.056 131.457 1.00 13.25 ? 63 TRP A CZ3 1 +ATOM 361 C CH2 . TRP A 1 43 ? 48.209 80.503 130.794 1.00 13.52 ? 63 TRP A CH2 1 +ATOM 362 N N . TYR A 1 44 ? 50.329 80.457 139.014 1.00 13.56 ? 64 TYR A N 1 +ATOM 363 C CA . TYR A 1 44 ? 51.246 79.900 140.017 1.00 13.92 ? 64 TYR A CA 1 +ATOM 364 C C . TYR A 1 44 ? 50.636 79.625 141.409 1.00 14.90 ? 64 TYR A C 1 +ATOM 365 O O . TYR A 1 44 ? 51.193 78.859 142.181 1.00 13.98 ? 64 TYR A O 1 +ATOM 366 C CB . TYR A 1 44 ? 52.461 80.816 140.175 1.00 13.89 ? 64 TYR A CB 1 +ATOM 367 C CG . TYR A 1 44 ? 52.119 82.269 140.388 1.00 13.19 ? 64 TYR A CG 1 +ATOM 368 C CD1 . TYR A 1 44 ? 52.070 83.155 139.314 1.00 12.86 ? 64 TYR A CD1 1 +ATOM 369 C CD2 . TYR A 1 44 ? 51.843 82.763 141.657 1.00 13.33 ? 64 TYR A CD2 1 +ATOM 370 C CE1 . TYR A 1 44 ? 51.742 84.500 139.497 1.00 13.03 ? 64 TYR A CE1 1 +ATOM 371 C CE2 . TYR A 1 44 ? 51.525 84.114 141.847 1.00 13.37 ? 64 TYR A CE2 1 +ATOM 372 C CZ . TYR A 1 44 ? 51.479 84.976 140.759 1.00 13.04 ? 64 TYR A CZ 1 +ATOM 373 O OH . TYR A 1 44 ? 51.160 86.321 140.921 1.00 13.94 ? 64 TYR A OH 1 +ATOM 374 N N . ARG A 1 45 ? 49.512 80.267 141.723 1.00 15.60 ? 65 ARG A N 1 +ATOM 375 C CA . ARG A 1 45 ? 48.849 80.102 143.019 1.00 16.92 ? 65 ARG A CA 1 +ATOM 376 C C . ARG A 1 45 ? 48.201 78.724 143.229 1.00 17.38 ? 65 ARG A C 1 +ATOM 377 O O . ARG A 1 45 ? 47.917 78.329 144.364 1.00 17.51 ? 65 ARG A O 1 +ATOM 378 C CB . ARG A 1 45 ? 47.768 81.174 143.174 1.00 16.99 ? 65 ARG A CB 1 +ATOM 379 C CG . ARG A 1 45 ? 48.308 82.589 143.226 1.00 19.65 ? 65 ARG A CG 1 +ATOM 380 C CD . ARG A 1 45 ? 48.833 82.943 144.597 1.00 22.77 ? 65 ARG A CD 1 +ATOM 381 N NE . ARG A 1 45 ? 49.154 84.366 144.711 1.00 24.85 ? 65 ARG A NE 1 +ATOM 382 C CZ . ARG A 1 45 ? 49.652 84.935 145.808 1.00 25.01 ? 65 ARG A CZ 1 +ATOM 383 N NH1 . ARG A 1 45 ? 49.922 86.236 145.815 1.00 25.43 ? 65 ARG A NH1 1 +ATOM 384 N NH2 . ARG A 1 45 ? 49.892 84.212 146.894 1.00 27.91 ? 65 ARG A NH2 1 +ATOM 385 N N . ARG A 1 46 ? 47.932 78.018 142.137 1.00 17.99 ? 66 ARG A N 1 +ATOM 386 C CA . ARG A 1 46 ? 47.337 76.687 142.193 1.00 18.80 ? 66 ARG A CA 1 +ATOM 387 C C . ARG A 1 46 ? 48.070 75.786 141.216 1.00 18.85 ? 66 ARG A C 1 +ATOM 388 O O . ARG A 1 46 ? 48.731 76.282 140.298 1.00 18.57 ? 66 ARG A O 1 +ATOM 389 C CB . ARG A 1 46 ? 45.867 76.743 141.780 1.00 19.19 ? 66 ARG A CB 1 +ATOM 390 C CG . ARG A 1 46 ? 44.993 77.685 142.606 1.00 21.95 ? 66 ARG A CG 1 +ATOM 391 C CD . ARG A 1 46 ? 44.787 77.162 144.010 1.00 25.48 ? 66 ARG A CD 1 +ATOM 392 N NE . ARG A 1 46 ? 44.048 75.900 144.010 1.00 27.58 ? 66 ARG A NE 1 +ATOM 393 C CZ . ARG A 1 46 ? 44.050 75.018 145.009 1.00 28.81 ? 66 ARG A CZ 1 +ATOM 394 N NH1 . ARG A 1 46 ? 44.738 75.241 146.129 1.00 30.05 ? 66 ARG A NH1 1 +ATOM 395 N NH2 . ARG A 1 46 ? 43.346 73.899 144.891 1.00 29.08 ? 66 ARG A NH2 1 +ATOM 396 N N . PRO A 1 47 ? 47.945 74.463 141.393 1.00 19.19 ? 67 PRO A N 1 +ATOM 397 C CA . PRO A 1 47 ? 48.435 73.527 140.377 1.00 19.19 ? 67 PRO A CA 1 +ATOM 398 C C . PRO A 1 47 ? 48.082 73.991 138.961 1.00 19.21 ? 67 PRO A C 1 +ATOM 399 O O . PRO A 1 47 ? 46.980 74.492 138.712 1.00 19.03 ? 67 PRO A O 1 +ATOM 400 C CB . PRO A 1 47 ? 47.715 72.229 140.730 1.00 19.30 ? 67 PRO A CB 1 +ATOM 401 C CG . PRO A 1 47 ? 47.572 72.305 142.226 1.00 19.20 ? 67 PRO A CG 1 +ATOM 402 C CD . PRO A 1 47 ? 47.360 73.760 142.552 1.00 19.12 ? 67 PRO A CD 1 +ATOM 403 N N . LEU A 1 48 ? 49.027 73.821 138.043 1.00 19.01 ? 68 LEU A N 1 +ATOM 404 C CA . LEU A 1 48 ? 48.924 74.421 136.728 1.00 19.02 ? 68 LEU A CA 1 +ATOM 405 C C . LEU A 1 48 ? 47.710 73.907 135.949 1.00 19.61 ? 68 LEU A C 1 +ATOM 406 O O . LEU A 1 48 ? 47.069 74.676 135.239 1.00 19.30 ? 68 LEU A O 1 +ATOM 407 C CB . LEU A 1 48 ? 50.225 74.185 135.949 1.00 18.75 ? 68 LEU A CB 1 +ATOM 408 C CG . LEU A 1 48 ? 50.457 75.005 134.682 1.00 19.22 ? 68 LEU A CG 1 +ATOM 409 C CD1 . LEU A 1 48 ? 50.358 76.496 134.967 1.00 16.77 ? 68 LEU A CD1 1 +ATOM 410 C CD2 . LEU A 1 48 ? 51.833 74.655 134.097 1.00 18.82 ? 68 LEU A CD2 1 +ATOM 411 N N . TRP A 1 49 ? 47.379 72.627 136.110 1.00 20.38 ? 69 TRP A N 1 +ATOM 412 C CA . TRP A 1 49 ? 46.257 72.032 135.376 1.00 21.24 ? 69 TRP A CA 1 +ATOM 413 C C . TRP A 1 49 ? 44.926 72.739 135.672 1.00 21.62 ? 69 TRP A C 1 +ATOM 414 O O . TRP A 1 49 ? 44.009 72.710 134.850 1.00 21.96 ? 69 TRP A O 1 +ATOM 415 C CB . TRP A 1 49 ? 46.137 70.523 135.677 1.00 21.99 ? 69 TRP A CB 1 +ATOM 416 C CG . TRP A 1 49 ? 45.691 70.210 137.067 1.00 22.49 ? 69 TRP A CG 1 +ATOM 417 C CD1 . TRP A 1 49 ? 46.481 69.902 138.129 1.00 23.83 ? 69 TRP A CD1 1 +ATOM 418 C CD2 . TRP A 1 49 ? 44.341 70.185 137.548 1.00 23.86 ? 69 TRP A CD2 1 +ATOM 419 N NE1 . TRP A 1 49 ? 45.713 69.684 139.249 1.00 24.04 ? 69 TRP A NE1 1 +ATOM 420 C CE2 . TRP A 1 49 ? 44.394 69.852 138.918 1.00 24.62 ? 69 TRP A CE2 1 +ATOM 421 C CE3 . TRP A 1 49 ? 43.092 70.418 136.956 1.00 24.36 ? 69 TRP A CE3 1 +ATOM 422 C CZ2 . TRP A 1 49 ? 43.248 69.744 139.706 1.00 23.94 ? 69 TRP A CZ2 1 +ATOM 423 C CZ3 . TRP A 1 49 ? 41.948 70.309 137.744 1.00 23.96 ? 69 TRP A CZ3 1 +ATOM 424 C CH2 . TRP A 1 49 ? 42.039 69.972 139.103 1.00 23.65 ? 69 TRP A CH2 1 +ATOM 425 N N . GLU A 1 50 ? 44.817 73.358 136.843 1.00 21.96 ? 70 GLU A N 1 +ATOM 426 C CA . GLU A 1 50 ? 43.580 74.059 137.224 1.00 22.64 ? 70 GLU A CA 1 +ATOM 427 C C . GLU A 1 50 ? 43.259 75.280 136.372 1.00 22.82 ? 70 GLU A C 1 +ATOM 428 O O . GLU A 1 50 ? 42.098 75.676 136.260 1.00 23.64 ? 70 GLU A O 1 +ATOM 429 C CB . GLU A 1 50 ? 43.625 74.463 138.697 1.00 22.76 ? 70 GLU A CB 1 +ATOM 430 C CG . GLU A 1 50 ? 43.656 73.274 139.638 1.00 23.51 ? 70 GLU A CG 1 +ATOM 431 C CD . GLU A 1 50 ? 43.370 73.645 141.072 1.00 25.52 ? 70 GLU A CD 1 +ATOM 432 O OE1 . GLU A 1 50 ? 43.042 74.820 141.337 1.00 26.80 ? 70 GLU A OE1 1 +ATOM 433 O OE2 . GLU A 1 50 ? 43.478 72.753 141.938 1.00 28.47 ? 70 GLU A OE2 1 +ATOM 434 N N . SER A 1 51 ? 44.278 75.879 135.772 1.00 22.73 ? 71 SER A N 1 +ATOM 435 C CA . SER A 1 51 ? 44.093 77.086 134.970 1.00 22.72 ? 71 SER A CA 1 +ATOM 436 C C . SER A 1 51 ? 43.861 76.806 133.479 1.00 22.32 ? 71 SER A C 1 +ATOM 437 O O . SER A 1 51 ? 43.594 77.734 132.712 1.00 22.09 ? 71 SER A O 1 +ATOM 438 C CB . SER A 1 51 ? 45.282 78.021 135.183 1.00 23.13 ? 71 SER A CB 1 +ATOM 439 O OG . SER A 1 51 ? 46.397 77.290 135.642 1.00 23.57 ? 71 SER A OG 1 +ATOM 440 N N . GLY A 1 52 ? 43.933 75.531 133.080 1.00 21.91 ? 72 GLY A N 1 +ATOM 441 C CA . GLY A 1 52 ? 43.634 75.130 131.707 1.00 21.67 ? 72 GLY A CA 1 +ATOM 442 C C . GLY A 1 52 ? 44.366 73.873 131.263 1.00 21.11 ? 72 GLY A C 1 +ATOM 443 O O . GLY A 1 52 ? 45.011 73.220 132.077 1.00 20.77 ? 72 GLY A O 1 +ATOM 444 N N . PRO A 1 53 ? 44.286 73.546 129.957 1.00 20.72 ? 73 PRO A N 1 +ATOM 445 C CA . PRO A 1 53 ? 44.943 72.357 129.417 1.00 19.97 ? 73 PRO A CA 1 +ATOM 446 C C . PRO A 1 53 ? 46.452 72.430 129.600 1.00 18.83 ? 73 PRO A C 1 +ATOM 447 O O . PRO A 1 53 ? 47.046 73.484 129.382 1.00 18.61 ? 73 PRO A O 1 +ATOM 448 C CB . PRO A 1 53 ? 44.615 72.408 127.916 1.00 20.13 ? 73 PRO A CB 1 +ATOM 449 C CG . PRO A 1 53 ? 43.457 73.334 127.784 1.00 21.15 ? 73 PRO A CG 1 +ATOM 450 C CD . PRO A 1 53 ? 43.590 74.313 128.906 1.00 21.00 ? 73 PRO A CD 1 +ATOM 451 N N . THR A 1 54 ? 47.049 71.308 129.980 1.00 17.45 ? 74 THR A N 1 +ATOM 452 C CA . THR A 1 54 ? 48.506 71.190 130.067 1.00 16.11 ? 74 THR A CA 1 +ATOM 453 C C . THR A 1 54 ? 48.934 69.943 129.336 1.00 14.85 ? 74 THR A C 1 +ATOM 454 O O . THR A 1 54 ? 48.124 69.045 129.079 1.00 14.79 ? 74 THR A O 1 +ATOM 455 C CB . THR A 1 54 ? 49.006 71.047 131.510 1.00 16.34 ? 74 THR A CB 1 +ATOM 456 O OG1 . THR A 1 54 ? 48.417 69.882 132.114 1.00 17.31 ? 74 THR A OG1 1 +ATOM 457 C CG2 . THR A 1 54 ? 48.678 72.283 132.323 1.00 16.90 ? 74 THR A CG2 1 +ATOM 458 N N . VAL A 1 55 ? 50.224 69.875 129.025 1.00 13.62 ? 75 VAL A N 1 +ATOM 459 C CA . VAL A 1 55 ? 50.788 68.702 128.382 1.00 12.88 ? 75 VAL A CA 1 +ATOM 460 C C . VAL A 1 55 ? 52.076 68.319 129.104 1.00 12.14 ? 75 VAL A C 1 +ATOM 461 O O . VAL A 1 55 ? 52.617 69.107 129.869 1.00 12.17 ? 75 VAL A O 1 +ATOM 462 C CB . VAL A 1 55 ? 51.070 68.957 126.888 1.00 13.30 ? 75 VAL A CB 1 +ATOM 463 C CG1 . VAL A 1 55 ? 49.783 69.326 126.151 1.00 14.13 ? 75 VAL A CG1 1 +ATOM 464 C CG2 . VAL A 1 55 ? 52.131 70.037 126.714 1.00 11.86 ? 75 VAL A CG2 1 +ATOM 465 N N . ASP A 1 56 ? 52.556 67.109 128.853 1.00 11.33 ? 76 ASP A N 1 +ATOM 466 C CA . ASP A 1 56 ? 53.839 66.657 129.392 1.00 10.97 ? 76 ASP A CA 1 +ATOM 467 C C . ASP A 1 56 ? 54.967 67.342 128.638 1.00 10.22 ? 76 ASP A C 1 +ATOM 468 O O . ASP A 1 56 ? 54.891 67.520 127.418 1.00 10.56 ? 76 ASP A O 1 +ATOM 469 C CB . ASP A 1 56 ? 54.016 65.144 129.202 1.00 10.41 ? 76 ASP A CB 1 +ATOM 470 C CG . ASP A 1 56 ? 53.124 64.308 130.104 1.00 11.75 ? 76 ASP A CG 1 +ATOM 471 O OD1 . ASP A 1 56 ? 52.784 64.743 131.240 1.00 10.69 ? 76 ASP A OD1 1 +ATOM 472 O OD2 . ASP A 1 56 ? 52.786 63.185 129.666 1.00 10.97 ? 76 ASP A OD2 1 +ATOM 473 N N . MET A 1 57 ? 56.029 67.698 129.354 1.00 9.68 ? 77 MET A N 1 +ATOM 474 C CA . MET A 1 57 ? 57.227 68.229 128.715 1.00 9.58 ? 77 MET A CA 1 +ATOM 475 C C . MET A 1 57 ? 58.441 67.658 129.422 1.00 9.82 ? 77 MET A C 1 +ATOM 476 O O . MET A 1 57 ? 58.550 67.772 130.626 1.00 10.13 ? 77 MET A O 1 +ATOM 477 C CB . MET A 1 57 ? 57.228 69.766 128.771 1.00 9.87 ? 77 MET A CB 1 +ATOM 478 C CG . MET A 1 57 ? 58.285 70.443 127.890 1.00 11.12 ? 77 MET A CG 1 +ATOM 479 S SD . MET A 1 57 ? 58.185 69.998 126.149 1.00 11.31 ? 77 MET A SD 1 +ATOM 480 C CE . MET A 1 57 ? 56.518 70.481 125.715 1.00 11.37 ? 77 MET A CE 1 +ATOM 481 N N . PRO A 1 58 ? 59.351 67.006 128.671 1.00 9.26 ? 78 PRO A N 1 +ATOM 482 C CA . PRO A 1 58 ? 60.521 66.377 129.284 1.00 9.41 ? 78 PRO A CA 1 +ATOM 483 C C . PRO A 1 58 ? 61.505 67.437 129.750 1.00 10.08 ? 78 PRO A C 1 +ATOM 484 O O . PRO A 1 58 ? 61.598 68.509 129.146 1.00 9.14 ? 78 PRO A O 1 +ATOM 485 C CB . PRO A 1 58 ? 61.097 65.528 128.141 1.00 9.76 ? 78 PRO A CB 1 +ATOM 486 C CG . PRO A 1 58 ? 60.660 66.235 126.901 1.00 8.21 ? 78 PRO A CG 1 +ATOM 487 C CD . PRO A 1 58 ? 59.324 66.814 127.213 1.00 9.68 ? 78 PRO A CD 1 +ATOM 488 N N . VAL A 1 59 ? 62.173 67.165 130.861 1.00 10.21 ? 79 VAL A N 1 +ATOM 489 C CA . VAL A 1 59 ? 63.227 68.028 131.383 1.00 10.58 ? 79 VAL A CA 1 +ATOM 490 C C . VAL A 1 59 ? 64.429 67.155 131.754 1.00 10.54 ? 79 VAL A C 1 +ATOM 491 O O . VAL A 1 59 ? 64.275 66.141 132.448 1.00 10.14 ? 79 VAL A O 1 +ATOM 492 C CB . VAL A 1 59 ? 62.754 68.847 132.614 1.00 10.95 ? 79 VAL A CB 1 +ATOM 493 C CG1 . VAL A 1 59 ? 63.918 69.601 133.242 1.00 11.56 ? 79 VAL A CG1 1 +ATOM 494 C CG2 . VAL A 1 59 ? 61.605 69.826 132.223 1.00 11.01 ? 79 VAL A CG2 1 +ATOM 495 N N . PRO A 1 60 ? 65.634 67.515 131.278 1.00 10.40 ? 80 PRO A N 1 +ATOM 496 C CA . PRO A 1 60 ? 65.977 68.598 130.345 1.00 9.74 ? 80 PRO A CA 1 +ATOM 497 C C . PRO A 1 60 ? 65.642 68.338 128.864 1.00 9.46 ? 80 PRO A C 1 +ATOM 498 O O . PRO A 1 60 ? 65.790 67.217 128.364 1.00 8.35 ? 80 PRO A O 1 +ATOM 499 C CB . PRO A 1 60 ? 67.494 68.762 130.544 1.00 9.99 ? 80 PRO A CB 1 +ATOM 500 C CG . PRO A 1 60 ? 67.950 67.477 131.089 1.00 10.44 ? 80 PRO A CG 1 +ATOM 501 C CD . PRO A 1 60 ? 66.830 66.830 131.800 1.00 10.64 ? 80 PRO A CD 1 +ATOM 502 N N . SER A 1 61 ? 65.205 69.400 128.189 1.00 8.33 ? 81 SER A N 1 +ATOM 503 C CA . SER A 1 61 ? 64.898 69.401 126.753 1.00 7.93 ? 81 SER A CA 1 +ATOM 504 C C . SER A 1 61 ? 64.506 70.825 126.342 1.00 7.57 ? 81 SER A C 1 +ATOM 505 O O . SER A 1 61 ? 64.036 71.606 127.165 1.00 6.70 ? 81 SER A O 1 +ATOM 506 C CB . SER A 1 61 ? 63.708 68.514 126.437 1.00 7.89 ? 81 SER A CB 1 +ATOM 507 O OG . SER A 1 61 ? 63.563 68.383 125.031 1.00 9.01 ? 81 SER A OG 1 +ATOM 508 N N . SER A 1 62 ? 64.636 71.139 125.063 1.00 7.63 ? 82 SER A N 1 +ATOM 509 C CA . SER A 1 62 ? 63.956 72.320 124.531 1.00 7.08 ? 82 SER A CA 1 +ATOM 510 C C . SER A 1 62 ? 62.511 71.880 124.304 1.00 7.23 ? 82 SER A C 1 +ATOM 511 O O . SER A 1 62 ? 62.249 70.677 124.095 1.00 7.48 ? 82 SER A O 1 +ATOM 512 C CB . SER A 1 62 ? 64.582 72.753 123.221 1.00 6.97 ? 82 SER A CB 1 +ATOM 513 O OG . SER A 1 62 ? 65.965 73.051 123.400 1.00 5.70 ? 82 SER A OG 1 +ATOM 514 N N . PHE A 1 63 ? 61.571 72.820 124.326 1.00 7.51 ? 83 PHE A N 1 +ATOM 515 C CA . PHE A 1 63 ? 60.171 72.457 124.100 1.00 7.84 ? 83 PHE A CA 1 +ATOM 516 C C . PHE A 1 63 ? 59.809 72.412 122.613 1.00 7.88 ? 83 PHE A C 1 +ATOM 517 O O . PHE A 1 63 ? 58.775 71.839 122.218 1.00 8.25 ? 83 PHE A O 1 +ATOM 518 C CB . PHE A 1 63 ? 59.203 73.378 124.884 1.00 7.86 ? 83 PHE A CB 1 +ATOM 519 C CG . PHE A 1 63 ? 59.215 74.828 124.457 1.00 7.58 ? 83 PHE A CG 1 +ATOM 520 C CD1 . PHE A 1 63 ? 58.660 75.228 123.253 1.00 8.15 ? 83 PHE A CD1 1 +ATOM 521 C CD2 . PHE A 1 63 ? 59.726 75.803 125.301 1.00 9.17 ? 83 PHE A CD2 1 +ATOM 522 C CE1 . PHE A 1 63 ? 58.664 76.557 122.895 1.00 6.45 ? 83 PHE A CE1 1 +ATOM 523 C CE2 . PHE A 1 63 ? 59.722 77.130 124.945 1.00 7.32 ? 83 PHE A CE2 1 +ATOM 524 C CZ . PHE A 1 63 ? 59.191 77.508 123.732 1.00 7.17 ? 83 PHE A CZ 1 +ATOM 525 N N . ASN A 1 64 ? 60.659 73.001 121.778 1.00 8.35 ? 84 ASN A N 1 +ATOM 526 C CA . ASN A 1 64 ? 60.203 73.442 120.456 1.00 7.90 ? 84 ASN A CA 1 +ATOM 527 C C . ASN A 1 64 ? 59.906 72.310 119.492 1.00 8.19 ? 84 ASN A C 1 +ATOM 528 O O . ASN A 1 64 ? 59.054 72.455 118.616 1.00 8.29 ? 84 ASN A O 1 +ATOM 529 C CB . ASN A 1 64 ? 61.198 74.403 119.811 1.00 8.18 ? 84 ASN A CB 1 +ATOM 530 C CG . ASN A 1 64 ? 61.590 75.530 120.731 1.00 8.56 ? 84 ASN A CG 1 +ATOM 531 O OD1 . ASN A 1 64 ? 62.298 75.306 121.714 1.00 5.68 ? 84 ASN A OD1 1 +ATOM 532 N ND2 . ASN A 1 64 ? 61.117 76.753 120.441 1.00 9.34 ? 84 ASN A ND2 1 +ATOM 533 N N . ASP A 1 65 ? 60.612 71.194 119.625 1.00 7.82 ? 85 ASP A N 1 +ATOM 534 C CA . ASP A 1 65 ? 60.484 70.102 118.671 1.00 8.16 ? 85 ASP A CA 1 +ATOM 535 C C . ASP A 1 65 ? 59.802 68.862 119.242 1.00 8.81 ? 85 ASP A C 1 +ATOM 536 O O . ASP A 1 65 ? 59.711 67.856 118.568 1.00 9.42 ? 85 ASP A O 1 +ATOM 537 C CB . ASP A 1 65 ? 61.856 69.720 118.090 1.00 8.50 ? 85 ASP A CB 1 +ATOM 538 C CG . ASP A 1 65 ? 62.387 70.755 117.090 1.00 8.76 ? 85 ASP A CG 1 +ATOM 539 O OD1 . ASP A 1 65 ? 61.582 71.547 116.565 1.00 10.93 ? 85 ASP A OD1 1 +ATOM 540 O OD2 . ASP A 1 65 ? 63.616 70.749 116.830 1.00 8.29 ? 85 ASP A OD2 1 +ATOM 541 N N . ILE A 1 66 ? 59.314 68.953 120.468 1.00 9.00 ? 86 ILE A N 1 +ATOM 542 C CA . ILE A 1 66 ? 58.724 67.805 121.155 1.00 9.35 ? 86 ILE A CA 1 +ATOM 543 C C . ILE A 1 66 ? 57.303 67.506 120.639 1.00 10.01 ? 86 ILE A C 1 +ATOM 544 O O . ILE A 1 66 ? 56.897 66.338 120.563 1.00 10.20 ? 86 ILE A O 1 +ATOM 545 C CB . ILE A 1 66 ? 58.700 68.064 122.672 1.00 9.63 ? 86 ILE A CB 1 +ATOM 546 C CG1 . ILE A 1 66 ? 60.123 68.071 123.214 1.00 10.48 ? 86 ILE A CG1 1 +ATOM 547 C CG2 . ILE A 1 66 ? 57.847 67.029 123.408 1.00 9.82 ? 86 ILE A CG2 1 +ATOM 548 C CD1 . ILE A 1 66 ? 60.828 66.749 122.992 1.00 10.63 ? 86 ILE A CD1 1 +ATOM 549 N N . SER A 1 67 ? 56.559 68.548 120.280 1.00 10.91 ? 87 SER A N 1 +ATOM 550 C CA . SER A 1 67 ? 55.174 68.385 119.835 1.00 11.99 ? 87 SER A CA 1 +ATOM 551 C C . SER A 1 67 ? 55.008 68.540 118.318 1.00 12.58 ? 87 SER A C 1 +ATOM 552 O O . SER A 1 67 ? 55.951 68.857 117.601 1.00 12.35 ? 87 SER A O 1 +ATOM 553 C CB . SER A 1 67 ? 54.255 69.369 120.575 1.00 11.86 ? 87 SER A CB 1 +ATOM 554 O OG . SER A 1 67 ? 54.260 70.624 119.957 1.00 14.49 ? 87 SER A OG 1 +ATOM 555 N N . GLN A 1 68 ? 53.793 68.289 117.833 1.00 13.67 ? 88 GLN A N 1 +ATOM 556 C CA . GLN A 1 68 ? 53.466 68.534 116.437 1.00 14.81 ? 88 GLN A CA 1 +ATOM 557 C C . GLN A 1 68 ? 52.730 69.866 116.266 1.00 17.14 ? 88 GLN A C 1 +ATOM 558 O O . GLN A 1 68 ? 52.178 70.122 115.190 1.00 17.65 ? 88 GLN A O 1 +ATOM 559 C CB . GLN A 1 68 ? 52.613 67.389 115.874 1.00 14.80 ? 88 GLN A CB 1 +ATOM 560 C CG . GLN A 1 68 ? 53.186 65.995 116.118 1.00 13.04 ? 88 GLN A CG 1 +ATOM 561 C CD . GLN A 1 68 ? 54.660 65.896 115.791 1.00 12.11 ? 88 GLN A CD 1 +ATOM 562 O OE1 . GLN A 1 68 ? 55.471 65.659 116.676 1.00 11.68 ? 88 GLN A OE1 1 +ATOM 563 N NE2 . GLN A 1 68 ? 55.017 66.088 114.521 1.00 11.61 ? 88 GLN A NE2 1 +ATOM 564 N N . ASP A 1 69 ? 52.729 70.699 117.313 1.00 18.39 ? 89 ASP A N 1 +ATOM 565 C CA . ASP A 1 69 ? 52.036 71.993 117.295 1.00 19.86 ? 89 ASP A CA 1 +ATOM 566 C C . ASP A 1 69 ? 52.901 73.043 116.617 1.00 20.18 ? 89 ASP A C 1 +ATOM 567 O O . ASP A 1 69 ? 53.919 73.501 117.144 1.00 20.14 ? 89 ASP A O 1 +ATOM 568 C CB . ASP A 1 69 ? 51.641 72.453 118.707 1.00 20.07 ? 89 ASP A CB 1 +ATOM 569 C CG . ASP A 1 69 ? 50.670 73.648 118.701 1.00 22.22 ? 89 ASP A CG 1 +ATOM 570 O OD1 . ASP A 1 69 ? 50.725 74.487 117.776 1.00 24.66 ? 89 ASP A OD1 1 +ATOM 571 O OD2 . ASP A 1 69 ? 49.858 73.758 119.642 1.00 24.02 ? 89 ASP A OD2 1 +ATOM 572 N N . TRP A 1 70 ? 52.430 73.427 115.444 1.00 21.45 ? 90 TRP A N 1 +ATOM 573 C CA . TRP A 1 70 ? 53.060 74.399 114.571 1.00 21.63 ? 90 TRP A CA 1 +ATOM 574 C C . TRP A 1 70 ? 53.403 75.679 115.352 1.00 20.89 ? 90 TRP A C 1 +ATOM 575 O O . TRP A 1 70 ? 54.522 76.194 115.298 1.00 21.29 ? 90 TRP A O 1 +ATOM 576 C CB . TRP A 1 70 ? 52.070 74.716 113.425 1.00 22.78 ? 90 TRP A CB 1 +ATOM 577 C CG . TRP A 1 70 ? 51.729 73.526 112.476 1.00 23.89 ? 90 TRP A CG 1 +ATOM 578 C CD1 . TRP A 1 70 ? 51.441 72.221 112.823 1.00 24.51 ? 90 TRP A CD1 1 +ATOM 579 C CD2 . TRP A 1 70 ? 51.625 73.580 111.045 1.00 25.26 ? 90 TRP A CD2 1 +ATOM 580 N NE1 . TRP A 1 70 ? 51.208 71.468 111.693 1.00 25.11 ? 90 TRP A NE1 1 +ATOM 581 C CE2 . TRP A 1 70 ? 51.301 72.275 110.592 1.00 25.03 ? 90 TRP A CE2 1 +ATOM 582 C CE3 . TRP A 1 70 ? 51.791 74.601 110.098 1.00 25.16 ? 90 TRP A CE3 1 +ATOM 583 C CZ2 . TRP A 1 70 ? 51.128 71.971 109.237 1.00 24.30 ? 90 TRP A CZ2 1 +ATOM 584 C CZ3 . TRP A 1 70 ? 51.625 74.293 108.750 1.00 24.72 ? 90 TRP A CZ3 1 +ATOM 585 C CH2 . TRP A 1 70 ? 51.293 72.992 108.335 1.00 24.64 ? 90 TRP A CH2 1 +ATOM 586 N N . ARG A 1 71 ? 52.448 76.147 116.140 1.00 19.47 ? 91 ARG A N 1 +ATOM 587 C CA . ARG A 1 71 ? 52.565 77.466 116.774 1.00 18.41 ? 91 ARG A CA 1 +ATOM 588 C C . ARG A 1 71 ? 53.484 77.430 117.994 1.00 16.62 ? 91 ARG A C 1 +ATOM 589 O O . ARG A 1 71 ? 54.026 78.456 118.416 1.00 15.77 ? 91 ARG A O 1 +ATOM 590 C CB . ARG A 1 71 ? 51.170 77.998 117.127 1.00 19.27 ? 91 ARG A CB 1 +ATOM 591 C CG . ARG A 1 71 ? 50.189 77.918 115.953 1.00 22.03 ? 91 ARG A CG 1 +ATOM 592 C CD . ARG A 1 71 ? 49.468 79.240 115.683 1.00 26.03 ? 91 ARG A CD 1 +ATOM 593 N NE . ARG A 1 71 ? 48.519 79.110 114.571 1.00 28.07 ? 91 ARG A NE 1 +ATOM 594 C CZ . ARG A 1 71 ? 47.216 79.395 114.619 1.00 28.79 ? 91 ARG A CZ 1 +ATOM 595 N NH1 . ARG A 1 71 ? 46.644 79.874 115.724 1.00 29.72 ? 91 ARG A NH1 1 +ATOM 596 N NH2 . ARG A 1 71 ? 46.474 79.223 113.529 1.00 29.24 ? 91 ARG A NH2 1 +ATOM 597 N N . LEU A 1 72 ? 53.686 76.238 118.550 1.00 14.25 ? 92 LEU A N 1 +ATOM 598 C CA . LEU A 1 72 ? 54.573 76.102 119.694 1.00 12.80 ? 92 LEU A CA 1 +ATOM 599 C C . LEU A 1 72 ? 56.042 76.221 119.311 1.00 12.28 ? 92 LEU A C 1 +ATOM 600 O O . LEU A 1 72 ? 56.807 76.819 120.038 1.00 10.95 ? 92 LEU A O 1 +ATOM 601 C CB . LEU A 1 72 ? 54.343 74.771 120.422 1.00 12.21 ? 92 LEU A CB 1 +ATOM 602 C CG . LEU A 1 72 ? 55.163 74.623 121.712 1.00 12.41 ? 92 LEU A CG 1 +ATOM 603 C CD1 . LEU A 1 72 ? 54.998 75.841 122.654 1.00 12.51 ? 92 LEU A CD1 1 +ATOM 604 C CD2 . LEU A 1 72 ? 54.792 73.349 122.434 1.00 12.23 ? 92 LEU A CD2 1 +ATOM 605 N N . ARG A 1 73 ? 56.444 75.630 118.190 1.00 12.35 ? 93 ARG A N 1 +ATOM 606 C CA . ARG A 1 73 ? 57.857 75.657 117.810 1.00 12.84 ? 93 ARG A CA 1 +ATOM 607 C C . ARG A 1 73 ? 58.386 77.088 117.691 1.00 12.82 ? 93 ARG A C 1 +ATOM 608 O O . ARG A 1 73 ? 59.503 77.382 118.128 1.00 12.50 ? 93 ARG A O 1 +ATOM 609 C CB . ARG A 1 73 ? 58.084 74.880 116.509 1.00 13.13 ? 93 ARG A CB 1 +ATOM 610 C CG . ARG A 1 73 ? 59.557 74.704 116.148 1.00 14.13 ? 93 ARG A CG 1 +ATOM 611 C CD . ARG A 1 73 ? 59.749 74.077 114.761 1.00 14.47 ? 93 ARG A CD 1 +ATOM 612 N NE . ARG A 1 73 ? 61.156 73.741 114.499 1.00 17.30 ? 93 ARG A NE 1 +ATOM 613 C CZ . ARG A 1 73 ? 62.047 74.515 113.875 1.00 17.12 ? 93 ARG A CZ 1 +ATOM 614 N NH1 . ARG A 1 73 ? 61.722 75.715 113.413 1.00 17.20 ? 93 ARG A NH1 1 +ATOM 615 N NH2 . ARG A 1 73 ? 63.287 74.074 113.711 1.00 17.40 ? 93 ARG A NH2 1 +ATOM 616 N N . HIS A 1 74 ? 57.577 77.984 117.125 1.00 12.64 ? 94 HIS A N 1 +ATOM 617 C CA . HIS A 1 74 ? 57.998 79.361 116.901 1.00 12.56 ? 94 HIS A CA 1 +ATOM 618 C C . HIS A 1 74 ? 57.355 80.357 117.866 1.00 12.02 ? 94 HIS A C 1 +ATOM 619 O O . HIS A 1 74 ? 57.392 81.579 117.628 1.00 12.01 ? 94 HIS A O 1 +ATOM 620 C CB . HIS A 1 74 ? 57.699 79.762 115.464 1.00 13.22 ? 94 HIS A CB 1 +ATOM 621 C CG . HIS A 1 74 ? 58.348 78.869 114.460 1.00 13.77 ? 94 HIS A CG 1 +ATOM 622 N ND1 . HIS A 1 74 ? 57.650 77.912 113.762 1.00 14.61 ? 94 HIS A ND1 1 +ATOM 623 C CD2 . HIS A 1 74 ? 59.638 78.756 114.072 1.00 14.02 ? 94 HIS A CD2 1 +ATOM 624 C CE1 . HIS A 1 74 ? 58.478 77.266 112.960 1.00 14.61 ? 94 HIS A CE1 1 +ATOM 625 N NE2 . HIS A 1 74 ? 59.692 77.757 113.134 1.00 14.42 ? 94 HIS A NE2 1 +ATOM 626 N N . PHE A 1 75 ? 56.809 79.826 118.960 1.00 11.57 ? 95 PHE A N 1 +ATOM 627 C CA . PHE A 1 75 ? 56.190 80.622 120.020 1.00 11.13 ? 95 PHE A CA 1 +ATOM 628 C C . PHE A 1 75 ? 57.156 81.647 120.607 1.00 10.62 ? 95 PHE A C 1 +ATOM 629 O O . PHE A 1 75 ? 58.339 81.358 120.827 1.00 10.64 ? 95 PHE A O 1 +ATOM 630 C CB . PHE A 1 75 ? 55.691 79.712 121.151 1.00 11.13 ? 95 PHE A CB 1 +ATOM 631 C CG . PHE A 1 75 ? 55.150 80.464 122.345 1.00 10.59 ? 95 PHE A CG 1 +ATOM 632 C CD1 . PHE A 1 75 ? 53.922 81.116 122.274 1.00 10.46 ? 95 PHE A CD1 1 +ATOM 633 C CD2 . PHE A 1 75 ? 55.870 80.528 123.531 1.00 11.27 ? 95 PHE A CD2 1 +ATOM 634 C CE1 . PHE A 1 75 ? 53.424 81.811 123.374 1.00 10.51 ? 95 PHE A CE1 1 +ATOM 635 C CE2 . PHE A 1 75 ? 55.378 81.226 124.625 1.00 12.85 ? 95 PHE A CE2 1 +ATOM 636 C CZ . PHE A 1 75 ? 54.153 81.859 124.545 1.00 11.07 ? 95 PHE A CZ 1 +ATOM 637 N N . VAL A 1 76 ? 56.628 82.840 120.872 1.00 10.13 ? 96 VAL A N 1 +ATOM 638 C CA . VAL A 1 76 ? 57.369 83.909 121.518 1.00 9.54 ? 96 VAL A CA 1 +ATOM 639 C C . VAL A 1 76 ? 56.519 84.442 122.662 1.00 9.75 ? 96 VAL A C 1 +ATOM 640 O O . VAL A 1 76 ? 55.390 84.880 122.445 1.00 9.77 ? 96 VAL A O 1 +ATOM 641 C CB . VAL A 1 76 ? 57.641 85.075 120.548 1.00 9.50 ? 96 VAL A CB 1 +ATOM 642 C CG1 . VAL A 1 76 ? 58.271 86.247 121.286 1.00 10.12 ? 96 VAL A CG1 1 +ATOM 643 C CG2 . VAL A 1 76 ? 58.529 84.631 119.412 1.00 8.42 ? 96 VAL A CG2 1 +ATOM 644 N N . GLY A 1 77 ? 57.059 84.406 123.871 1.00 9.46 ? 97 GLY A N 1 +ATOM 645 C CA . GLY A 1 77 ? 56.293 84.751 125.067 1.00 9.68 ? 97 GLY A CA 1 +ATOM 646 C C . GLY A 1 77 ? 56.694 83.930 126.277 1.00 9.58 ? 97 GLY A C 1 +ATOM 647 O O . GLY A 1 77 ? 57.863 83.551 126.418 1.00 10.16 ? 97 GLY A O 1 +ATOM 648 N N . TRP A 1 78 ? 55.722 83.654 127.145 1.00 9.11 ? 98 TRP A N 1 +ATOM 649 C CA . TRP A 1 78 ? 55.941 82.908 128.384 1.00 8.60 ? 98 TRP A CA 1 +ATOM 650 C C . TRP A 1 78 ? 55.463 81.460 128.235 1.00 8.81 ? 98 TRP A C 1 +ATOM 651 O O . TRP A 1 78 ? 54.331 81.199 127.780 1.00 8.65 ? 98 TRP A O 1 +ATOM 652 C CB . TRP A 1 78 ? 55.192 83.543 129.575 1.00 8.59 ? 98 TRP A CB 1 +ATOM 653 C CG . TRP A 1 78 ? 55.668 84.903 130.045 1.00 8.32 ? 98 TRP A CG 1 +ATOM 654 C CD1 . TRP A 1 78 ? 55.128 86.111 129.720 1.00 9.14 ? 98 TRP A CD1 1 +ATOM 655 C CD2 . TRP A 1 78 ? 56.722 85.184 130.980 1.00 7.26 ? 98 TRP A CD2 1 +ATOM 656 N NE1 . TRP A 1 78 ? 55.794 87.125 130.354 1.00 10.16 ? 98 TRP A NE1 1 +ATOM 657 C CE2 . TRP A 1 78 ? 56.775 86.592 131.138 1.00 7.96 ? 98 TRP A CE2 1 +ATOM 658 C CE3 . TRP A 1 78 ? 57.633 84.395 131.683 1.00 9.01 ? 98 TRP A CE3 1 +ATOM 659 C CZ2 . TRP A 1 78 ? 57.703 87.219 131.972 1.00 9.32 ? 98 TRP A CZ2 1 +ATOM 660 C CZ3 . TRP A 1 78 ? 58.547 85.016 132.515 1.00 8.83 ? 98 TRP A CZ3 1 +ATOM 661 C CH2 . TRP A 1 78 ? 58.585 86.417 132.640 1.00 9.22 ? 98 TRP A CH2 1 +ATOM 662 N N . VAL A 1 79 ? 56.318 80.526 128.636 1.00 8.71 ? 99 VAL A N 1 +ATOM 663 C CA . VAL A 1 79 ? 55.914 79.143 128.821 1.00 8.12 ? 99 VAL A CA 1 +ATOM 664 C C . VAL A 1 79 ? 55.988 78.825 130.318 1.00 8.79 ? 99 VAL A C 1 +ATOM 665 O O . VAL A 1 79 ? 56.804 79.423 131.057 1.00 8.89 ? 99 VAL A O 1 +ATOM 666 C CB . VAL A 1 79 ? 56.779 78.163 128.016 1.00 8.45 ? 99 VAL A CB 1 +ATOM 667 C CG1 . VAL A 1 79 ? 56.641 78.425 126.519 1.00 8.03 ? 99 VAL A CG1 1 +ATOM 668 C CG2 . VAL A 1 79 ? 58.224 78.247 128.441 1.00 6.79 ? 99 VAL A CG2 1 +ATOM 669 N N . TRP A 1 80 ? 55.140 77.891 130.751 1.00 8.85 ? 100 TRP A N 1 +ATOM 670 C CA . TRP A 1 80 ? 54.970 77.593 132.174 1.00 8.57 ? 100 TRP A CA 1 +ATOM 671 C C . TRP A 1 80 ? 55.224 76.110 132.398 1.00 8.98 ? 100 TRP A C 1 +ATOM 672 O O . TRP A 1 80 ? 54.641 75.283 131.712 1.00 9.58 ? 100 TRP A O 1 +ATOM 673 C CB . TRP A 1 80 ? 53.546 77.946 132.630 1.00 8.72 ? 100 TRP A CB 1 +ATOM 674 C CG . TRP A 1 80 ? 53.273 79.413 132.575 1.00 8.76 ? 100 TRP A CG 1 +ATOM 675 C CD1 . TRP A 1 80 ? 53.167 80.188 131.462 1.00 9.24 ? 100 TRP A CD1 1 +ATOM 676 C CD2 . TRP A 1 80 ? 53.090 80.280 133.688 1.00 7.72 ? 100 TRP A CD2 1 +ATOM 677 N NE1 . TRP A 1 80 ? 52.936 81.494 131.811 1.00 7.97 ? 100 TRP A NE1 1 +ATOM 678 C CE2 . TRP A 1 80 ? 52.878 81.579 133.176 1.00 8.88 ? 100 TRP A CE2 1 +ATOM 679 C CE3 . TRP A 1 80 ? 53.080 80.088 135.073 1.00 8.58 ? 100 TRP A CE3 1 +ATOM 680 C CZ2 . TRP A 1 80 ? 52.663 82.681 134.005 1.00 9.69 ? 100 TRP A CZ2 1 +ATOM 681 C CZ3 . TRP A 1 80 ? 52.860 81.177 135.894 1.00 9.96 ? 100 TRP A CZ3 1 +ATOM 682 C CH2 . TRP A 1 80 ? 52.653 82.453 135.362 1.00 9.09 ? 100 TRP A CH2 1 +ATOM 683 N N . TYR A 1 81 ? 56.116 75.817 133.343 1.00 9.04 ? 101 TYR A N 1 +ATOM 684 C CA . TYR A 1 81 ? 56.469 74.471 133.756 1.00 9.30 ? 101 TYR A CA 1 +ATOM 685 C C . TYR A 1 81 ? 56.089 74.257 135.221 1.00 10.03 ? 101 TYR A C 1 +ATOM 686 O O . TYR A 1 81 ? 56.191 75.185 136.038 1.00 9.38 ? 101 TYR A O 1 +ATOM 687 C CB . TYR A 1 81 ? 57.981 74.293 133.686 1.00 8.81 ? 101 TYR A CB 1 +ATOM 688 C CG . TYR A 1 81 ? 58.583 74.069 132.318 1.00 8.59 ? 101 TYR A CG 1 +ATOM 689 C CD1 . TYR A 1 81 ? 58.859 72.788 131.876 1.00 7.91 ? 101 TYR A CD1 1 +ATOM 690 C CD2 . TYR A 1 81 ? 58.929 75.141 131.490 1.00 7.61 ? 101 TYR A CD2 1 +ATOM 691 C CE1 . TYR A 1 81 ? 59.438 72.563 130.643 1.00 8.93 ? 101 TYR A CE1 1 +ATOM 692 C CE2 . TYR A 1 81 ? 59.512 74.923 130.239 1.00 8.32 ? 101 TYR A CE2 1 +ATOM 693 C CZ . TYR A 1 81 ? 59.768 73.624 129.830 1.00 7.94 ? 101 TYR A CZ 1 +ATOM 694 O OH . TYR A 1 81 ? 60.349 73.366 128.612 1.00 8.64 ? 101 TYR A OH 1 +ATOM 695 N N . GLU A 1 82 ? 55.734 73.025 135.564 1.00 11.12 ? 102 GLU A N 1 +ATOM 696 C CA . GLU A 1 82 ? 55.452 72.677 136.953 1.00 12.42 ? 102 GLU A CA 1 +ATOM 697 C C . GLU A 1 82 ? 55.725 71.206 137.274 1.00 13.45 ? 102 GLU A C 1 +ATOM 698 O O . GLU A 1 82 ? 55.429 70.318 136.481 1.00 13.01 ? 102 GLU A O 1 +ATOM 699 C CB . GLU A 1 82 ? 54.011 73.010 137.310 1.00 12.44 ? 102 GLU A CB 1 +ATOM 700 C CG . GLU A 1 82 ? 53.717 72.928 138.811 1.00 13.49 ? 102 GLU A CG 1 +ATOM 701 C CD . GLU A 1 82 ? 52.350 73.445 139.142 1.00 13.65 ? 102 GLU A CD 1 +ATOM 702 O OE1 . GLU A 1 82 ? 52.250 74.641 139.462 1.00 15.32 ? 102 GLU A OE1 1 +ATOM 703 O OE2 . GLU A 1 82 ? 51.371 72.678 139.047 1.00 14.15 ? 102 GLU A OE2 1 +ATOM 704 N N . ARG A 1 83 ? 56.289 70.988 138.459 1.00 15.04 ? 103 ARG A N 1 +ATOM 705 C CA . ARG A 1 83 ? 56.576 69.658 138.993 1.00 16.38 ? 103 ARG A CA 1 +ATOM 706 C C . ARG A 1 83 ? 56.194 69.646 140.463 1.00 17.00 ? 103 ARG A C 1 +ATOM 707 O O . ARG A 1 83 ? 56.391 70.641 141.158 1.00 16.20 ? 103 ARG A O 1 +ATOM 708 C CB . ARG A 1 83 ? 58.073 69.380 138.881 1.00 16.75 ? 103 ARG A CB 1 +ATOM 709 C CG . ARG A 1 83 ? 58.547 68.061 139.468 1.00 19.61 ? 103 ARG A CG 1 +ATOM 710 C CD . ARG A 1 83 ? 59.027 67.129 138.390 1.00 22.60 ? 103 ARG A CD 1 +ATOM 711 N NE . ARG A 1 83 ? 59.784 66.007 138.931 1.00 24.84 ? 103 ARG A NE 1 +ATOM 712 C CZ . ARG A 1 83 ? 60.310 65.043 138.183 1.00 25.34 ? 103 ARG A CZ 1 +ATOM 713 N NH1 . ARG A 1 83 ? 60.168 65.061 136.859 1.00 25.82 ? 103 ARG A NH1 1 +ATOM 714 N NH2 . ARG A 1 83 ? 60.985 64.057 138.759 1.00 25.71 ? 103 ARG A NH2 1 +ATOM 715 N N . GLU A 1 84 ? 55.663 68.518 140.930 1.00 17.55 ? 104 GLU A N 1 +ATOM 716 C CA . GLU A 1 84 ? 55.443 68.302 142.356 1.00 18.63 ? 104 GLU A CA 1 +ATOM 717 C C . GLU A 1 84 ? 56.470 67.307 142.880 1.00 18.48 ? 104 GLU A C 1 +ATOM 718 O O . GLU A 1 84 ? 56.734 66.300 142.233 1.00 18.48 ? 104 GLU A O 1 +ATOM 719 C CB . GLU A 1 84 ? 54.019 67.818 142.625 1.00 19.25 ? 104 GLU A CB 1 +ATOM 720 C CG . GLU A 1 84 ? 52.962 68.874 142.318 1.00 21.95 ? 104 GLU A CG 1 +ATOM 721 C CD . GLU A 1 84 ? 51.718 68.749 143.177 1.00 25.41 ? 104 GLU A CD 1 +ATOM 722 O OE1 . GLU A 1 84 ? 51.404 67.627 143.640 1.00 29.07 ? 104 GLU A OE1 1 +ATOM 723 O OE2 . GLU A 1 84 ? 51.049 69.779 143.384 1.00 27.38 ? 104 GLU A OE2 1 +ATOM 724 N N . VAL A 1 85 ? 57.053 67.607 144.038 1.00 18.88 ? 105 VAL A N 1 +ATOM 725 C CA . VAL A 1 85 ? 58.116 66.789 144.635 1.00 19.64 ? 105 VAL A CA 1 +ATOM 726 C C . VAL A 1 85 ? 57.773 66.390 146.068 1.00 19.87 ? 105 VAL A C 1 +ATOM 727 O O . VAL A 1 85 ? 57.416 67.238 146.884 1.00 19.16 ? 105 VAL A O 1 +ATOM 728 C CB . VAL A 1 85 ? 59.446 67.563 144.702 1.00 19.50 ? 105 VAL A CB 1 +ATOM 729 C CG1 . VAL A 1 85 ? 60.585 66.644 145.120 1.00 20.49 ? 105 VAL A CG1 1 +ATOM 730 C CG2 . VAL A 1 85 ? 59.745 68.247 143.372 1.00 20.60 ? 105 VAL A CG2 1 +ATOM 731 N N . ILE A 1 86 ? 57.895 65.099 146.371 1.00 20.28 ? 106 ILE A N 1 +ATOM 732 C CA . ILE A 1 86 ? 57.901 64.634 147.759 1.00 20.99 ? 106 ILE A CA 1 +ATOM 733 C C . ILE A 1 86 ? 59.335 64.670 148.299 1.00 21.27 ? 106 ILE A C 1 +ATOM 734 O O . ILE A 1 86 ? 60.206 63.957 147.800 1.00 20.50 ? 106 ILE A O 1 +ATOM 735 C CB . ILE A 1 86 ? 57.349 63.203 147.892 1.00 21.26 ? 106 ILE A CB 1 +ATOM 736 C CG1 . ILE A 1 86 ? 55.862 63.173 147.528 1.00 21.95 ? 106 ILE A CG1 1 +ATOM 737 C CG2 . ILE A 1 86 ? 57.529 62.698 149.311 1.00 21.06 ? 106 ILE A CG2 1 +ATOM 738 C CD1 . ILE A 1 86 ? 55.239 61.794 147.608 1.00 22.91 ? 106 ILE A CD1 1 +ATOM 739 N N . LEU A 1 87 ? 59.567 65.496 149.318 1.00 21.60 ? 107 LEU A N 1 +ATOM 740 C CA . LEU A 1 87 ? 60.898 65.657 149.905 1.00 22.16 ? 107 LEU A CA 1 +ATOM 741 C C . LEU A 1 87 ? 61.107 64.713 151.087 1.00 22.82 ? 107 LEU A C 1 +ATOM 742 O O . LEU A 1 87 ? 60.148 64.362 151.771 1.00 23.02 ? 107 LEU A O 1 +ATOM 743 C CB . LEU A 1 87 ? 61.107 67.100 150.381 1.00 22.05 ? 107 LEU A CB 1 +ATOM 744 C CG . LEU A 1 87 ? 61.091 68.189 149.299 1.00 23.05 ? 107 LEU A CG 1 +ATOM 745 C CD1 . LEU A 1 87 ? 61.581 69.503 149.858 1.00 23.39 ? 107 LEU A CD1 1 +ATOM 746 C CD2 . LEU A 1 87 ? 61.923 67.787 148.091 1.00 23.66 ? 107 LEU A CD2 1 +ATOM 747 N N . PRO A 1 88 ? 62.368 64.305 151.337 1.00 23.37 ? 108 PRO A N 1 +ATOM 748 C CA . PRO A 1 88 ? 62.667 63.498 152.527 1.00 23.94 ? 108 PRO A CA 1 +ATOM 749 C C . PRO A 1 88 ? 62.253 64.212 153.810 1.00 24.52 ? 108 PRO A C 1 +ATOM 750 O O . PRO A 1 88 ? 62.428 65.426 153.928 1.00 24.24 ? 108 PRO A O 1 +ATOM 751 C CB . PRO A 1 88 ? 64.192 63.323 152.476 1.00 23.70 ? 108 PRO A CB 1 +ATOM 752 C CG . PRO A 1 88 ? 64.594 63.633 151.092 1.00 23.54 ? 108 PRO A CG 1 +ATOM 753 C CD . PRO A 1 88 ? 63.562 64.544 150.508 1.00 23.52 ? 108 PRO A CD 1 +ATOM 754 N N . GLU A 1 89 ? 61.718 63.461 154.768 1.00 25.33 ? 109 GLU A N 1 +ATOM 755 C CA . GLU A 1 89 ? 61.222 64.051 156.012 1.00 26.18 ? 109 GLU A CA 1 +ATOM 756 C C . GLU A 1 89 ? 62.310 64.815 156.768 1.00 25.82 ? 109 GLU A C 1 +ATOM 757 O O . GLU A 1 89 ? 62.049 65.889 157.315 1.00 25.88 ? 109 GLU A O 1 +ATOM 758 C CB . GLU A 1 89 ? 60.580 62.981 156.907 1.00 26.17 ? 109 GLU A CB 1 +ATOM 759 C CG . GLU A 1 89 ? 59.284 62.404 156.325 1.00 27.58 ? 109 GLU A CG 1 +ATOM 760 C CD . GLU A 1 89 ? 58.431 61.653 157.347 1.00 28.08 ? 109 GLU A CD 1 +ATOM 761 O OE1 . GLU A 1 89 ? 58.906 61.414 158.480 1.00 31.54 ? 109 GLU A OE1 1 +ATOM 762 O OE2 . GLU A 1 89 ? 57.279 61.291 157.011 1.00 30.96 ? 109 GLU A OE2 1 +ATOM 763 N N . ARG A 1 90 ? 63.532 64.283 156.759 1.00 25.60 ? 110 ARG A N 1 +ATOM 764 C CA . ARG A 1 90 ? 64.657 64.915 157.456 1.00 25.56 ? 110 ARG A CA 1 +ATOM 765 C C . ARG A 1 90 ? 64.959 66.326 156.939 1.00 25.69 ? 110 ARG A C 1 +ATOM 766 O O . ARG A 1 90 ? 65.376 67.186 157.712 1.00 26.09 ? 110 ARG A O 1 +ATOM 767 C CB . ARG A 1 90 ? 65.925 64.035 157.390 1.00 25.54 ? 110 ARG A CB 1 +ATOM 768 C CG . ARG A 1 90 ? 66.477 63.853 155.987 1.00 25.70 ? 110 ARG A CG 1 +ATOM 769 C CD . ARG A 1 90 ? 67.759 63.024 155.888 1.00 25.25 ? 110 ARG A CD 1 +ATOM 770 N NE . ARG A 1 90 ? 68.029 62.769 154.471 1.00 24.55 ? 110 ARG A NE 1 +ATOM 771 C CZ . ARG A 1 90 ? 67.488 61.770 153.770 1.00 23.89 ? 110 ARG A CZ 1 +ATOM 772 N NH1 . ARG A 1 90 ? 66.677 60.884 154.347 1.00 23.77 ? 110 ARG A NH1 1 +ATOM 773 N NH2 . ARG A 1 90 ? 67.764 61.651 152.482 1.00 21.79 ? 110 ARG A NH2 1 +ATOM 774 N N . TRP A 1 91 ? 64.745 66.568 155.645 1.00 25.50 ? 111 TRP A N 1 +ATOM 775 C CA . TRP A 1 91 ? 64.938 67.906 155.066 1.00 25.25 ? 111 TRP A CA 1 +ATOM 776 C C . TRP A 1 91 ? 63.964 68.910 155.684 1.00 25.90 ? 111 TRP A C 1 +ATOM 777 O O . TRP A 1 91 ? 64.344 70.036 156.004 1.00 26.29 ? 111 TRP A O 1 +ATOM 778 C CB . TRP A 1 91 ? 64.754 67.890 153.540 1.00 24.58 ? 111 TRP A CB 1 +ATOM 779 C CG . TRP A 1 91 ? 65.835 67.174 152.746 1.00 23.70 ? 111 TRP A CG 1 +ATOM 780 C CD1 . TRP A 1 91 ? 66.780 66.311 153.223 1.00 23.72 ? 111 TRP A CD1 1 +ATOM 781 C CD2 . TRP A 1 91 ? 66.040 67.244 151.326 1.00 22.83 ? 111 TRP A CD2 1 +ATOM 782 N NE1 . TRP A 1 91 ? 67.573 65.854 152.190 1.00 23.41 ? 111 TRP A NE1 1 +ATOM 783 C CE2 . TRP A 1 91 ? 67.135 66.409 151.016 1.00 23.59 ? 111 TRP A CE2 1 +ATOM 784 C CE3 . TRP A 1 91 ? 65.409 67.937 150.290 1.00 22.59 ? 111 TRP A CE3 1 +ATOM 785 C CZ2 . TRP A 1 91 ? 67.614 66.255 149.715 1.00 23.73 ? 111 TRP A CZ2 1 +ATOM 786 C CZ3 . TRP A 1 91 ? 65.883 67.781 148.996 1.00 23.77 ? 111 TRP A CZ3 1 +ATOM 787 C CH2 . TRP A 1 91 ? 66.975 66.945 148.720 1.00 23.53 ? 111 TRP A CH2 1 +ATOM 788 N N . THR A 1 92 ? 62.710 68.496 155.854 1.00 26.63 ? 112 THR A N 1 +ATOM 789 C CA . THR A 1 92 ? 61.670 69.378 156.387 1.00 27.25 ? 112 THR A CA 1 +ATOM 790 C C . THR A 1 92 ? 61.689 69.475 157.916 1.00 27.80 ? 112 THR A C 1 +ATOM 791 O O . THR A 1 92 ? 61.387 70.538 158.470 1.00 28.38 ? 112 THR A O 1 +ATOM 792 C CB . THR A 1 92 ? 60.262 68.946 155.916 1.00 27.03 ? 112 THR A CB 1 +ATOM 793 O OG1 . THR A 1 92 ? 60.022 67.581 156.271 1.00 27.21 ? 112 THR A OG1 1 +ATOM 794 C CG2 . THR A 1 92 ? 60.139 69.094 154.405 1.00 27.60 ? 112 THR A CG2 1 +ATOM 795 N N . GLN A 1 93 ? 62.059 68.379 158.584 1.00 28.40 ? 113 GLN A N 1 +ATOM 796 C CA . GLN A 1 93 ? 61.986 68.269 160.047 1.00 28.79 ? 113 GLN A CA 1 +ATOM 797 C C . GLN A 1 93 ? 63.272 68.696 160.774 1.00 28.52 ? 113 GLN A C 1 +ATOM 798 O O . GLN A 1 93 ? 63.203 69.262 161.872 1.00 28.79 ? 113 GLN A O 1 +ATOM 799 C CB . GLN A 1 93 ? 61.632 66.830 160.456 1.00 29.15 ? 113 GLN A CB 1 +ATOM 800 C CG . GLN A 1 93 ? 60.345 66.264 159.829 1.00 30.66 ? 113 GLN A CG 1 +ATOM 801 C CD . GLN A 1 93 ? 59.139 67.163 160.012 1.00 32.57 ? 113 GLN A CD 1 +ATOM 802 O OE1 . GLN A 1 93 ? 58.774 67.517 161.135 1.00 34.49 ? 113 GLN A OE1 1 +ATOM 803 N NE2 . GLN A 1 93 ? 58.503 67.527 158.905 1.00 33.53 ? 113 GLN A NE2 1 +ATOM 804 N N . ASP A 1 94 ? 64.434 68.421 160.179 1.00 27.74 ? 114 ASP A N 1 +ATOM 805 C CA . ASP A 1 94 ? 65.726 68.781 160.781 1.00 27.04 ? 114 ASP A CA 1 +ATOM 806 C C . ASP A 1 94 ? 66.178 70.186 160.363 1.00 26.66 ? 114 ASP A C 1 +ATOM 807 O O . ASP A 1 94 ? 66.684 70.373 159.252 1.00 26.52 ? 114 ASP A O 1 +ATOM 808 C CB . ASP A 1 94 ? 66.780 67.755 160.371 1.00 26.96 ? 114 ASP A CB 1 +ATOM 809 C CG . ASP A 1 94 ? 68.067 67.884 161.150 1.00 27.09 ? 114 ASP A CG 1 +ATOM 810 O OD1 . ASP A 1 94 ? 68.330 68.951 161.745 1.00 26.91 ? 114 ASP A OD1 1 +ATOM 811 O OD2 . ASP A 1 94 ? 68.830 66.901 161.141 1.00 27.50 ? 114 ASP A OD2 1 +ATOM 812 N N . LEU A 1 95 ? 66.040 71.159 161.267 1.00 26.13 ? 115 LEU A N 1 +ATOM 813 C CA . LEU A 1 95 ? 66.331 72.573 160.952 1.00 25.65 ? 115 LEU A CA 1 +ATOM 814 C C . LEU A 1 95 ? 67.811 72.892 160.692 1.00 25.26 ? 115 LEU A C 1 +ATOM 815 O O . LEU A 1 95 ? 68.150 74.024 160.317 1.00 24.94 ? 115 LEU A O 1 +ATOM 816 C CB . LEU A 1 95 ? 65.784 73.498 162.051 1.00 25.59 ? 115 LEU A CB 1 +ATOM 817 C CG . LEU A 1 95 ? 64.267 73.450 162.285 1.00 25.90 ? 115 LEU A CG 1 +ATOM 818 C CD1 . LEU A 1 95 ? 63.812 74.551 163.229 1.00 26.87 ? 115 LEU A CD1 1 +ATOM 819 C CD2 . LEU A 1 95 ? 63.503 73.532 160.963 1.00 26.48 ? 115 LEU A CD2 1 +ATOM 820 N N . ARG A 1 96 ? 68.685 71.911 160.882 1.00 24.75 ? 116 ARG A N 1 +ATOM 821 C CA . ARG A 1 96 ? 70.087 72.047 160.477 1.00 24.49 ? 116 ARG A CA 1 +ATOM 822 C C . ARG A 1 96 ? 70.296 71.888 158.950 1.00 23.45 ? 116 ARG A C 1 +ATOM 823 O O . ARG A 1 96 ? 71.385 72.176 158.434 1.00 23.30 ? 116 ARG A O 1 +ATOM 824 C CB . ARG A 1 96 ? 70.943 71.026 161.227 1.00 24.94 ? 116 ARG A CB 1 +ATOM 825 C CG . ARG A 1 96 ? 70.987 71.240 162.731 1.00 26.22 ? 116 ARG A CG 1 +ATOM 826 C CD . ARG A 1 96 ? 71.622 70.053 163.425 1.00 29.28 ? 116 ARG A CD 1 +ATOM 827 N NE . ARG A 1 96 ? 70.713 68.902 163.464 1.00 30.36 ? 116 ARG A NE 1 +ATOM 828 C CZ . ARG A 1 96 ? 71.094 67.634 163.632 1.00 31.86 ? 116 ARG A CZ 1 +ATOM 829 N NH1 . ARG A 1 96 ? 72.379 67.313 163.789 1.00 33.44 ? 116 ARG A NH1 1 +ATOM 830 N NH2 . ARG A 1 96 ? 70.179 66.672 163.644 1.00 32.02 ? 116 ARG A NH2 1 +ATOM 831 N N . THR A 1 97 ? 69.261 71.439 158.237 1.00 22.12 ? 117 THR A N 1 +ATOM 832 C CA . THR A 1 97 ? 69.335 71.254 156.791 1.00 21.04 ? 117 THR A CA 1 +ATOM 833 C C . THR A 1 97 ? 69.062 72.562 156.043 1.00 20.26 ? 117 THR A C 1 +ATOM 834 O O . THR A 1 97 ? 68.078 73.256 156.319 1.00 20.25 ? 117 THR A O 1 +ATOM 835 C CB . THR A 1 97 ? 68.330 70.184 156.293 1.00 21.12 ? 117 THR A CB 1 +ATOM 836 O OG1 . THR A 1 97 ? 68.372 69.029 157.145 1.00 21.15 ? 117 THR A OG1 1 +ATOM 837 C CG2 . THR A 1 97 ? 68.655 69.770 154.864 1.00 20.61 ? 117 THR A CG2 1 +ATOM 838 N N . ARG A 1 98 ? 69.951 72.889 155.106 1.00 19.01 ? 118 ARG A N 1 +ATOM 839 C CA . ARG A 1 98 ? 69.726 73.954 154.122 1.00 18.01 ? 118 ARG A CA 1 +ATOM 840 C C . ARG A 1 98 ? 69.301 73.316 152.797 1.00 17.22 ? 118 ARG A C 1 +ATOM 841 O O . ARG A 1 98 ? 70.031 72.498 152.238 1.00 16.87 ? 118 ARG A O 1 +ATOM 842 C CB . ARG A 1 98 ? 70.997 74.786 153.930 1.00 18.05 ? 118 ARG A CB 1 +ATOM 843 C CG . ARG A 1 98 ? 70.920 75.817 152.810 1.00 17.60 ? 118 ARG A CG 1 +ATOM 844 C CD . ARG A 1 98 ? 72.002 76.863 152.965 1.00 17.50 ? 118 ARG A CD 1 +ATOM 845 N NE . ARG A 1 98 ? 72.116 77.704 151.777 1.00 15.76 ? 118 ARG A NE 1 +ATOM 846 C CZ . ARG A 1 98 ? 72.856 77.424 150.710 1.00 16.69 ? 118 ARG A CZ 1 +ATOM 847 N NH1 . ARG A 1 98 ? 73.608 76.335 150.671 1.00 14.82 ? 118 ARG A NH1 1 +ATOM 848 N NH2 . ARG A 1 98 ? 72.877 78.276 149.686 1.00 18.50 ? 118 ARG A NH2 1 +ATOM 849 N N . VAL A 1 99 ? 68.120 73.677 152.302 1.00 16.24 ? 119 VAL A N 1 +ATOM 850 C CA . VAL A 1 99 ? 67.598 73.101 151.065 1.00 15.74 ? 119 VAL A CA 1 +ATOM 851 C C . VAL A 1 99 ? 67.692 74.124 149.934 1.00 15.67 ? 119 VAL A C 1 +ATOM 852 O O . VAL A 1 99 ? 67.193 75.253 150.059 1.00 15.13 ? 119 VAL A O 1 +ATOM 853 C CB . VAL A 1 99 ? 66.130 72.650 151.205 1.00 15.97 ? 119 VAL A CB 1 +ATOM 854 C CG1 . VAL A 1 99 ? 65.649 72.075 149.885 1.00 14.68 ? 119 VAL A CG1 1 +ATOM 855 C CG2 . VAL A 1 99 ? 65.978 71.618 152.332 1.00 15.46 ? 119 VAL A CG2 1 +ATOM 856 N N . VAL A 1 100 ? 68.341 73.730 148.837 1.00 15.15 ? 120 VAL A N 1 +ATOM 857 C CA . VAL A 1 100 ? 68.563 74.633 147.700 1.00 14.61 ? 120 VAL A CA 1 +ATOM 858 C C . VAL A 1 100 ? 67.916 74.110 146.425 1.00 14.21 ? 120 VAL A C 1 +ATOM 859 O O . VAL A 1 100 ? 68.074 72.945 146.093 1.00 14.29 ? 120 VAL A O 1 +ATOM 860 C CB . VAL A 1 100 ? 70.065 74.815 147.404 1.00 14.81 ? 120 VAL A CB 1 +ATOM 861 C CG1 . VAL A 1 100 ? 70.271 75.823 146.276 1.00 15.40 ? 120 VAL A CG1 1 +ATOM 862 C CG2 . VAL A 1 100 ? 70.800 75.253 148.646 1.00 15.14 ? 120 VAL A CG2 1 +ATOM 863 N N . LEU A 1 101 ? 67.216 74.999 145.721 1.00 13.93 ? 121 LEU A N 1 +ATOM 864 C CA . LEU A 1 101 ? 66.646 74.728 144.397 1.00 13.24 ? 121 LEU A CA 1 +ATOM 865 C C . LEU A 1 101 ? 67.543 75.346 143.333 1.00 13.08 ? 121 LEU A C 1 +ATOM 866 O O . LEU A 1 101 ? 67.685 76.571 143.276 1.00 12.58 ? 121 LEU A O 1 +ATOM 867 C CB . LEU A 1 101 ? 65.248 75.332 144.272 1.00 13.58 ? 121 LEU A CB 1 +ATOM 868 C CG . LEU A 1 101 ? 64.586 75.117 142.908 1.00 13.14 ? 121 LEU A CG 1 +ATOM 869 C CD1 . LEU A 1 101 ? 64.348 73.615 142.609 1.00 15.82 ? 121 LEU A CD1 1 +ATOM 870 C CD2 . LEU A 1 101 ? 63.286 75.916 142.814 1.00 13.43 ? 121 LEU A CD2 1 +ATOM 871 N N . ARG A 1 102 ? 68.110 74.497 142.484 1.00 12.55 ? 122 ARG A N 1 +ATOM 872 C CA . ARG A 1 102 ? 69.066 74.906 141.454 1.00 12.79 ? 122 ARG A CA 1 +ATOM 873 C C . ARG A 1 102 ? 68.506 74.634 140.058 1.00 12.36 ? 122 ARG A C 1 +ATOM 874 O O . ARG A 1 102 ? 68.187 73.490 139.727 1.00 12.62 ? 122 ARG A O 1 +ATOM 875 C CB . ARG A 1 102 ? 70.374 74.134 141.621 1.00 12.88 ? 122 ARG A CB 1 +ATOM 876 C CG . ARG A 1 102 ? 71.314 74.193 140.418 1.00 13.85 ? 122 ARG A CG 1 +ATOM 877 C CD . ARG A 1 102 ? 71.962 75.553 140.244 1.00 13.91 ? 122 ARG A CD 1 +ATOM 878 N NE . ARG A 1 102 ? 72.975 75.779 141.277 1.00 15.48 ? 122 ARG A NE 1 +ATOM 879 C CZ . ARG A 1 102 ? 74.285 75.535 141.171 1.00 15.07 ? 122 ARG A CZ 1 +ATOM 880 N NH1 . ARG A 1 102 ? 74.809 75.045 140.061 1.00 14.86 ? 122 ARG A NH1 1 +ATOM 881 N NH2 . ARG A 1 102 ? 75.090 75.794 142.198 1.00 15.47 ? 122 ARG A NH2 1 +ATOM 882 N N . ILE A 1 103 ? 68.417 75.690 139.253 1.00 12.42 ? 123 ILE A N 1 +ATOM 883 C CA . ILE A 1 103 ? 67.989 75.617 137.859 1.00 11.89 ? 123 ILE A CA 1 +ATOM 884 C C . ILE A 1 103 ? 69.246 75.728 136.998 1.00 11.12 ? 123 ILE A C 1 +ATOM 885 O O . ILE A 1 103 ? 69.934 76.730 137.057 1.00 10.75 ? 123 ILE A O 1 +ATOM 886 C CB . ILE A 1 103 ? 67.065 76.808 137.486 1.00 12.75 ? 123 ILE A CB 1 +ATOM 887 C CG1 . ILE A 1 103 ? 65.892 76.962 138.472 1.00 14.07 ? 123 ILE A CG1 1 +ATOM 888 C CG2 . ILE A 1 103 ? 66.567 76.681 136.051 1.00 12.52 ? 123 ILE A CG2 1 +ATOM 889 C CD1 . ILE A 1 103 ? 65.128 75.745 138.694 1.00 14.66 ? 123 ILE A CD1 1 +ATOM 890 N N . GLY A 1 104 ? 69.551 74.695 136.212 1.00 10.42 ? 124 GLY A N 1 +ATOM 891 C CA . GLY A 1 104 ? 70.742 74.709 135.341 1.00 10.14 ? 124 GLY A CA 1 +ATOM 892 C C . GLY A 1 104 ? 70.799 75.883 134.363 1.00 9.80 ? 124 GLY A C 1 +ATOM 893 O O . GLY A 1 104 ? 71.853 76.497 134.152 1.00 9.42 ? 124 GLY A O 1 +ATOM 894 N N . SER A 1 105 ? 69.672 76.174 133.720 1.00 9.54 ? 125 SER A N 1 +ATOM 895 C CA . SER A 1 105 ? 69.557 77.327 132.835 1.00 9.32 ? 125 SER A CA 1 +ATOM 896 C C . SER A 1 105 ? 68.100 77.585 132.506 1.00 9.91 ? 125 SER A C 1 +ATOM 897 O O . SER A 1 105 ? 67.255 76.710 132.698 1.00 9.42 ? 125 SER A O 1 +ATOM 898 C CB . SER A 1 105 ? 70.309 77.101 131.516 1.00 10.03 ? 125 SER A CB 1 +ATOM 899 O OG . SER A 1 105 ? 69.771 76.003 130.783 1.00 8.91 ? 125 SER A OG 1 +ATOM 900 N N . ALA A 1 106 ? 67.818 78.781 132.000 1.00 9.70 ? 126 ALA A N 1 +ATOM 901 C CA . ALA A 1 106 ? 66.475 79.088 131.497 1.00 10.50 ? 126 ALA A CA 1 +ATOM 902 C C . ALA A 1 106 ? 66.535 79.850 130.166 1.00 10.91 ? 126 ALA A C 1 +ATOM 903 O O . ALA A 1 106 ? 66.911 79.262 129.145 1.00 11.98 ? 126 ALA A O 1 +ATOM 904 C CB . ALA A 1 106 ? 65.656 79.830 132.545 1.00 10.53 ? 126 ALA A CB 1 +ATOM 905 N N . HIS A 1 107 ? 66.165 81.132 130.161 1.00 10.97 ? 127 HIS A N 1 +ATOM 906 C CA . HIS A 1 107 ? 66.155 81.942 128.936 1.00 10.59 ? 127 HIS A CA 1 +ATOM 907 C C . HIS A 1 107 ? 66.171 83.444 129.306 1.00 10.83 ? 127 HIS A C 1 +ATOM 908 O O . HIS A 1 107 ? 66.689 83.801 130.365 1.00 10.78 ? 127 HIS A O 1 +ATOM 909 C CB . HIS A 1 107 ? 64.960 81.564 128.048 1.00 10.14 ? 127 HIS A CB 1 +ATOM 910 C CG . HIS A 1 107 ? 65.252 81.629 126.578 1.00 10.27 ? 127 HIS A CG 1 +ATOM 911 N ND1 . HIS A 1 107 ? 65.369 82.821 125.895 1.00 10.04 ? 127 HIS A ND1 1 +ATOM 912 C CD2 . HIS A 1 107 ? 65.444 80.651 125.660 1.00 10.93 ? 127 HIS A CD2 1 +ATOM 913 C CE1 . HIS A 1 107 ? 65.612 82.577 124.622 1.00 10.81 ? 127 HIS A CE1 1 +ATOM 914 N NE2 . HIS A 1 107 ? 65.686 81.268 124.455 1.00 10.31 ? 127 HIS A NE2 1 +ATOM 915 N N . SER A 1 108 ? 65.629 84.323 128.456 1.00 10.72 ? 128 SER A N 1 +ATOM 916 C CA . SER A 1 108 ? 65.754 85.779 128.667 1.00 11.61 ? 128 SER A CA 1 +ATOM 917 C C . SER A 1 108 ? 65.290 86.173 130.044 1.00 11.32 ? 128 SER A C 1 +ATOM 918 O O . SER A 1 108 ? 65.923 86.992 130.709 1.00 12.26 ? 128 SER A O 1 +ATOM 919 C CB . SER A 1 108 ? 64.936 86.575 127.644 1.00 11.35 ? 128 SER A CB 1 +ATOM 920 O OG . SER A 1 108 ? 65.459 86.421 126.350 1.00 13.57 ? 128 SER A OG 1 +ATOM 921 N N . TYR A 1 109 ? 64.166 85.605 130.457 1.00 11.37 ? 129 TYR A N 1 +ATOM 922 C CA . TYR A 1 109 ? 63.693 85.755 131.821 1.00 11.84 ? 129 TYR A CA 1 +ATOM 923 C C . TYR A 1 109 ? 63.078 84.461 132.341 1.00 11.43 ? 129 TYR A C 1 +ATOM 924 O O . TYR A 1 109 ? 62.448 83.711 131.588 1.00 10.56 ? 129 TYR A O 1 +ATOM 925 C CB . TYR A 1 109 ? 62.676 86.886 131.933 1.00 12.88 ? 129 TYR A CB 1 +ATOM 926 C CG . TYR A 1 109 ? 62.830 87.617 133.232 1.00 13.79 ? 129 TYR A CG 1 +ATOM 927 C CD1 . TYR A 1 109 ? 63.750 88.653 133.354 1.00 16.06 ? 129 TYR A CD1 1 +ATOM 928 C CD2 . TYR A 1 109 ? 62.105 87.241 134.354 1.00 15.27 ? 129 TYR A CD2 1 +ATOM 929 C CE1 . TYR A 1 109 ? 63.923 89.318 134.553 1.00 16.05 ? 129 TYR A CE1 1 +ATOM 930 C CE2 . TYR A 1 109 ? 62.270 87.904 135.569 1.00 16.12 ? 129 TYR A CE2 1 +ATOM 931 C CZ . TYR A 1 109 ? 63.187 88.940 135.658 1.00 16.27 ? 129 TYR A CZ 1 +ATOM 932 O OH . TYR A 1 109 ? 63.372 89.618 136.846 1.00 17.03 ? 129 TYR A OH 1 +ATOM 933 N N . ALA A 1 110 ? 63.294 84.218 133.628 1.00 11.45 ? 130 ALA A N 1 +ATOM 934 C CA . ALA A 1 110 ? 62.660 83.112 134.340 1.00 11.37 ? 130 ALA A CA 1 +ATOM 935 C C . ALA A 1 110 ? 62.252 83.544 135.755 1.00 11.33 ? 130 ALA A C 1 +ATOM 936 O O . ALA A 1 110 ? 63.017 84.181 136.473 1.00 11.17 ? 130 ALA A O 1 +ATOM 937 C CB . ALA A 1 110 ? 63.581 81.885 134.396 1.00 11.58 ? 130 ALA A CB 1 +ATOM 938 N N . ILE A 1 111 ? 61.022 83.212 136.127 1.00 11.68 ? 131 ILE A N 1 +ATOM 939 C CA . ILE A 1 111 ? 60.544 83.410 137.489 1.00 11.67 ? 131 ILE A CA 1 +ATOM 940 C C . ILE A 1 111 ? 60.183 82.044 138.047 1.00 11.68 ? 131 ILE A C 1 +ATOM 941 O O . ILE A 1 111 ? 59.624 81.201 137.334 1.00 12.07 ? 131 ILE A O 1 +ATOM 942 C CB . ILE A 1 111 ? 59.304 84.307 137.551 1.00 11.90 ? 131 ILE A CB 1 +ATOM 943 C CG1 . ILE A 1 111 ? 59.565 85.670 136.902 1.00 12.86 ? 131 ILE A CG1 1 +ATOM 944 C CG2 . ILE A 1 111 ? 58.891 84.513 138.986 1.00 11.69 ? 131 ILE A CG2 1 +ATOM 945 C CD1 . ILE A 1 111 ? 58.294 86.451 136.579 1.00 14.31 ? 131 ILE A CD1 1 +ATOM 946 N N . VAL A 1 112 ? 60.510 81.834 139.317 1.00 12.05 ? 132 VAL A N 1 +ATOM 947 C CA . VAL A 1 112 ? 60.266 80.562 139.988 1.00 12.01 ? 132 VAL A CA 1 +ATOM 948 C C . VAL A 1 112 ? 59.431 80.760 141.259 1.00 12.46 ? 132 VAL A C 1 +ATOM 949 O O . VAL A 1 112 ? 59.768 81.598 142.113 1.00 12.66 ? 132 VAL A O 1 +ATOM 950 C CB . VAL A 1 112 ? 61.602 79.860 140.363 1.00 11.99 ? 132 VAL A CB 1 +ATOM 951 C CG1 . VAL A 1 112 ? 61.343 78.505 140.950 1.00 11.50 ? 132 VAL A CG1 1 +ATOM 952 C CG2 . VAL A 1 112 ? 62.535 79.731 139.138 1.00 10.35 ? 132 VAL A CG2 1 +ATOM 953 N N . TRP A 1 113 ? 58.342 79.992 141.367 1.00 12.57 ? 133 TRP A N 1 +ATOM 954 C CA . TRP A 1 113 ? 57.486 79.975 142.556 1.00 12.40 ? 133 TRP A CA 1 +ATOM 955 C C . TRP A 1 113 ? 57.637 78.622 143.252 1.00 12.70 ? 133 TRP A C 1 +ATOM 956 O O . TRP A 1 113 ? 57.756 77.586 142.589 1.00 12.49 ? 133 TRP A O 1 +ATOM 957 C CB . TRP A 1 113 ? 56.014 80.177 142.176 1.00 12.43 ? 133 TRP A CB 1 +ATOM 958 C CG . TRP A 1 113 ? 55.707 81.505 141.565 1.00 11.90 ? 133 TRP A CG 1 +ATOM 959 C CD1 . TRP A 1 113 ? 55.324 82.637 142.217 1.00 12.81 ? 133 TRP A CD1 1 +ATOM 960 C CD2 . TRP A 1 113 ? 55.751 81.838 140.171 1.00 12.46 ? 133 TRP A CD2 1 +ATOM 961 N NE1 . TRP A 1 113 ? 55.132 83.661 141.323 1.00 13.38 ? 133 TRP A NE1 1 +ATOM 962 C CE2 . TRP A 1 113 ? 55.390 83.198 140.056 1.00 12.99 ? 133 TRP A CE2 1 +ATOM 963 C CE3 . TRP A 1 113 ? 56.061 81.117 139.007 1.00 11.91 ? 133 TRP A CE3 1 +ATOM 964 C CZ2 . TRP A 1 113 ? 55.321 83.852 138.826 1.00 12.25 ? 133 TRP A CZ2 1 +ATOM 965 C CZ3 . TRP A 1 113 ? 55.999 81.772 137.779 1.00 12.24 ? 133 TRP A CZ3 1 +ATOM 966 C CH2 . TRP A 1 113 ? 55.634 83.131 137.700 1.00 12.56 ? 133 TRP A CH2 1 +ATOM 967 N N . VAL A 1 114 ? 57.628 78.645 144.584 1.00 13.23 ? 134 VAL A N 1 +ATOM 968 C CA . VAL A 1 114 ? 57.592 77.435 145.414 1.00 14.26 ? 134 VAL A CA 1 +ATOM 969 C C . VAL A 1 114 ? 56.331 77.507 146.260 1.00 14.83 ? 134 VAL A C 1 +ATOM 970 O O . VAL A 1 114 ? 56.143 78.450 147.048 1.00 13.90 ? 134 VAL A O 1 +ATOM 971 C CB . VAL A 1 114 ? 58.850 77.324 146.303 1.00 14.56 ? 134 VAL A CB 1 +ATOM 972 C CG1 . VAL A 1 114 ? 58.731 76.183 147.319 1.00 15.65 ? 134 VAL A CG1 1 +ATOM 973 C CG2 . VAL A 1 114 ? 60.091 77.132 145.431 1.00 15.29 ? 134 VAL A CG2 1 +ATOM 974 N N . ASN A 1 115 ? 55.454 76.531 146.049 1.00 15.21 ? 135 ASN A N 1 +ATOM 975 C CA . ASN A 1 115 ? 54.143 76.496 146.677 1.00 16.20 ? 135 ASN A CA 1 +ATOM 976 C C . ASN A 1 115 ? 53.429 77.851 146.503 1.00 16.33 ? 135 ASN A C 1 +ATOM 977 O O . ASN A 1 115 ? 52.774 78.343 147.422 1.00 16.66 ? 135 ASN A O 1 +ATOM 978 C CB . ASN A 1 115 ? 54.269 76.096 148.153 1.00 16.22 ? 135 ASN A CB 1 +ATOM 979 C CG . ASN A 1 115 ? 54.869 74.700 148.348 1.00 17.41 ? 135 ASN A CG 1 +ATOM 980 O OD1 . ASN A 1 115 ? 54.686 73.805 147.520 1.00 19.19 ? 135 ASN A OD1 1 +ATOM 981 N ND2 . ASN A 1 115 ? 55.584 74.514 149.450 1.00 20.40 ? 135 ASN A ND2 1 +ATOM 982 N N . GLY A 1 116 ? 53.552 78.436 145.311 1.00 16.26 ? 136 GLY A N 1 +ATOM 983 C CA . GLY A 1 116 ? 52.888 79.695 144.987 1.00 16.43 ? 136 GLY A CA 1 +ATOM 984 C C . GLY A 1 116 ? 53.589 80.959 145.443 1.00 16.29 ? 136 GLY A C 1 +ATOM 985 O O . GLY A 1 116 ? 53.132 82.057 145.136 1.00 17.19 ? 136 GLY A O 1 +ATOM 986 N N . VAL A 1 117 ? 54.705 80.819 146.153 1.00 16.00 ? 137 VAL A N 1 +ATOM 987 C CA . VAL A 1 117 ? 55.459 81.964 146.654 1.00 16.01 ? 137 VAL A CA 1 +ATOM 988 C C . VAL A 1 117 ? 56.596 82.342 145.706 1.00 16.45 ? 137 VAL A C 1 +ATOM 989 O O . VAL A 1 117 ? 57.443 81.503 145.385 1.00 16.39 ? 137 VAL A O 1 +ATOM 990 C CB . VAL A 1 117 ? 56.060 81.683 148.033 1.00 16.05 ? 137 VAL A CB 1 +ATOM 991 C CG1 . VAL A 1 117 ? 56.665 82.958 148.618 1.00 15.26 ? 137 VAL A CG1 1 +ATOM 992 C CG2 . VAL A 1 117 ? 54.995 81.103 148.975 1.00 16.82 ? 137 VAL A CG2 1 +ATOM 993 N N . ASP A 1 118 ? 56.584 83.597 145.253 1.00 17.00 ? 138 ASP A N 1 +ATOM 994 C CA . ASP A 1 118 ? 57.667 84.184 144.445 1.00 17.66 ? 138 ASP A CA 1 +ATOM 995 C C . ASP A 1 118 ? 59.019 84.020 145.156 1.00 17.26 ? 138 ASP A C 1 +ATOM 996 O O . ASP A 1 118 ? 59.202 84.550 146.243 1.00 17.70 ? 138 ASP A O 1 +ATOM 997 C CB . ASP A 1 118 ? 57.393 85.690 144.165 1.00 18.26 ? 138 ASP A CB 1 +ATOM 998 C CG A ASP A 1 118 ? 56.416 86.297 145.182 0.50 19.09 ? 138 ASP A CG 1 +ATOM 999 C CG B ASP A 1 118 ? 58.223 86.206 142.993 0.50 18.69 ? 138 ASP A CG 1 +ATOM 1000 O OD1 A ASP A 1 118 ? 56.234 87.533 145.144 0.50 21.55 ? 138 ASP A OD1 1 +ATOM 1001 O OD1 B ASP A 1 118 ? 59.076 85.474 142.457 0.50 20.40 ? 138 ASP A OD1 1 +ATOM 1002 O OD2 A ASP A 1 118 ? 55.823 85.565 146.008 0.50 21.20 ? 138 ASP A OD2 1 +ATOM 1003 O OD2 B ASP A 1 118 ? 58.027 87.384 142.616 0.50 20.68 ? 138 ASP A OD2 1 +ATOM 1004 N N . THR A 1 119 ? 59.962 83.306 144.538 1.00 16.83 ? 139 THR A N 1 +ATOM 1005 C CA . THR A 1 119 ? 61.186 82.882 145.241 1.00 16.51 ? 139 THR A CA 1 +ATOM 1006 C C . THR A 1 119 ? 62.507 83.143 144.513 1.00 15.77 ? 139 THR A C 1 +ATOM 1007 O O . THR A 1 119 ? 63.561 83.288 145.145 1.00 15.53 ? 139 THR A O 1 +ATOM 1008 C CB . THR A 1 119 ? 61.107 81.366 145.548 1.00 16.55 ? 139 THR A CB 1 +ATOM 1009 O OG1 . THR A 1 119 ? 59.886 81.085 146.243 1.00 17.45 ? 139 THR A OG1 1 +ATOM 1010 C CG2 . THR A 1 119 ? 62.289 80.906 146.392 1.00 18.06 ? 139 THR A CG2 1 +ATOM 1011 N N . LEU A 1 120 ? 62.475 83.187 143.194 1.00 15.04 ? 140 LEU A N 1 +ATOM 1012 C CA . LEU A 1 120 ? 63.726 83.250 142.429 1.00 14.72 ? 140 LEU A CA 1 +ATOM 1013 C C . LEU A 1 120 ? 63.467 83.768 141.034 1.00 14.88 ? 140 LEU A C 1 +ATOM 1014 O O . LEU A 1 120 ? 62.500 83.369 140.386 1.00 14.68 ? 140 LEU A O 1 +ATOM 1015 C CB . LEU A 1 120 ? 64.360 81.856 142.378 1.00 14.55 ? 140 LEU A CB 1 +ATOM 1016 C CG . LEU A 1 120 ? 65.650 81.639 141.587 1.00 15.11 ? 140 LEU A CG 1 +ATOM 1017 C CD1 . LEU A 1 120 ? 66.816 82.435 142.185 1.00 16.46 ? 140 LEU A CD1 1 +ATOM 1018 C CD2 . LEU A 1 120 ? 65.959 80.139 141.561 1.00 14.51 ? 140 LEU A CD2 1 +ATOM 1019 N N . GLU A 1 121 ? 64.327 84.678 140.585 1.00 14.81 ? 141 GLU A N 1 +ATOM 1020 C CA . GLU A 1 121 ? 64.216 85.262 139.255 1.00 14.98 ? 141 GLU A CA 1 +ATOM 1021 C C . GLU A 1 121 ? 65.617 85.356 138.673 1.00 14.01 ? 141 GLU A C 1 +ATOM 1022 O O . GLU A 1 121 ? 66.594 85.500 139.426 1.00 13.95 ? 141 GLU A O 1 +ATOM 1023 C CB . GLU A 1 121 ? 63.589 86.657 139.312 1.00 15.11 ? 141 GLU A CB 1 +ATOM 1024 C CG . GLU A 1 121 ? 62.120 86.720 139.731 1.00 16.87 ? 141 GLU A CG 1 +ATOM 1025 C CD . GLU A 1 121 ? 61.537 88.143 139.603 1.00 17.10 ? 141 GLU A CD 1 +ATOM 1026 O OE1 . GLU A 1 121 ? 62.292 89.066 139.253 1.00 20.80 ? 141 GLU A OE1 1 +ATOM 1027 O OE2 . GLU A 1 121 ? 60.323 88.338 139.825 1.00 21.66 ? 141 GLU A OE2 1 +ATOM 1028 N N . HIS A 1 122 ? 65.716 85.231 137.353 1.00 13.32 ? 142 HIS A N 1 +ATOM 1029 C CA . HIS A 1 122 ? 66.997 85.285 136.659 1.00 13.16 ? 142 HIS A CA 1 +ATOM 1030 C C . HIS A 1 122 ? 66.838 85.823 135.253 1.00 12.91 ? 142 HIS A C 1 +ATOM 1031 O O . HIS A 1 122 ? 65.848 85.523 134.572 1.00 13.48 ? 142 HIS A O 1 +ATOM 1032 C CB . HIS A 1 122 ? 67.640 83.899 136.595 1.00 12.88 ? 142 HIS A CB 1 +ATOM 1033 C CG . HIS A 1 122 ? 69.032 83.921 136.049 1.00 12.84 ? 142 HIS A CG 1 +ATOM 1034 N ND1 . HIS A 1 122 ? 69.314 83.667 134.724 1.00 12.87 ? 142 HIS A ND1 1 +ATOM 1035 C CD2 . HIS A 1 122 ? 70.215 84.219 136.637 1.00 13.51 ? 142 HIS A CD2 1 +ATOM 1036 C CE1 . HIS A 1 122 ? 70.620 83.773 134.530 1.00 12.07 ? 142 HIS A CE1 1 +ATOM 1037 N NE2 . HIS A 1 122 ? 71.187 84.113 135.674 1.00 13.38 ? 142 HIS A NE2 1 +ATOM 1038 N N . GLU A 1 123 ? 67.806 86.628 134.826 1.00 13.23 ? 143 GLU A N 1 +ATOM 1039 C CA . GLU A 1 123 ? 67.798 87.200 133.488 1.00 13.04 ? 143 GLU A CA 1 +ATOM 1040 C C . GLU A 1 123 ? 68.939 86.588 132.683 1.00 12.27 ? 143 GLU A C 1 +ATOM 1041 O O . GLU A 1 123 ? 70.081 86.548 133.155 1.00 11.86 ? 143 GLU A O 1 +ATOM 1042 C CB . GLU A 1 123 ? 67.964 88.715 133.573 1.00 13.77 ? 143 GLU A CB 1 +ATOM 1043 C CG A GLU A 1 123 ? 67.703 89.471 132.292 0.50 15.20 ? 143 GLU A CG 1 +ATOM 1044 C CG B GLU A 1 123 ? 67.608 89.476 132.282 0.50 13.93 ? 143 GLU A CG 1 +ATOM 1045 C CD A GLU A 1 123 ? 67.695 90.970 132.524 0.50 16.92 ? 143 GLU A CD 1 +ATOM 1046 C CD B GLU A 1 123 ? 68.592 89.262 131.145 0.50 13.95 ? 143 GLU A CD 1 +ATOM 1047 O OE1 A GLU A 1 123 ? 66.746 91.465 133.176 0.50 18.94 ? 143 GLU A OE1 1 +ATOM 1048 O OE1 B GLU A 1 123 ? 69.805 89.133 131.420 0.50 14.10 ? 143 GLU A OE1 1 +ATOM 1049 O OE2 A GLU A 1 123 ? 68.640 91.645 132.059 0.50 18.99 ? 143 GLU A OE2 1 +ATOM 1050 O OE2 B GLU A 1 123 ? 68.156 89.227 129.970 0.50 12.64 ? 143 GLU A OE2 1 +ATOM 1051 N N . GLY A 1 124 ? 68.622 86.120 131.478 1.00 10.98 ? 144 GLY A N 1 +ATOM 1052 C CA . GLY A 1 124 ? 69.626 85.617 130.545 1.00 10.20 ? 144 GLY A CA 1 +ATOM 1053 C C . GLY A 1 124 ? 69.696 84.106 130.556 1.00 10.07 ? 144 GLY A C 1 +ATOM 1054 O O . GLY A 1 124 ? 69.502 83.480 131.597 1.00 10.79 ? 144 GLY A O 1 +ATOM 1055 N N . GLY A 1 125 ? 69.980 83.523 129.399 1.00 9.25 ? 145 GLY A N 1 +ATOM 1056 C CA . GLY A 1 125 ? 70.047 82.066 129.245 1.00 9.41 ? 145 GLY A CA 1 +ATOM 1057 C C . GLY A 1 125 ? 71.429 81.482 129.441 1.00 9.26 ? 145 GLY A C 1 +ATOM 1058 O O . GLY A 1 125 ? 72.413 82.208 129.606 1.00 9.83 ? 145 GLY A O 1 +ATOM 1059 N N . TYR A 1 126 ? 71.492 80.150 129.447 1.00 8.96 ? 146 TYR A N 1 +ATOM 1060 C CA . TYR A 1 126 ? 72.760 79.398 129.436 1.00 8.96 ? 146 TYR A CA 1 +ATOM 1061 C C . TYR A 1 126 ? 73.558 79.443 130.734 1.00 8.77 ? 146 TYR A C 1 +ATOM 1062 O O . TYR A 1 126 ? 74.723 79.024 130.759 1.00 9.20 ? 146 TYR A O 1 +ATOM 1063 C CB . TYR A 1 126 ? 73.627 79.828 128.234 1.00 8.88 ? 146 TYR A CB 1 +ATOM 1064 C CG . TYR A 1 126 ? 72.835 79.817 126.943 1.00 8.67 ? 146 TYR A CG 1 +ATOM 1065 C CD1 . TYR A 1 126 ? 72.415 78.604 126.387 1.00 8.17 ? 146 TYR A CD1 1 +ATOM 1066 C CD2 . TYR A 1 126 ? 72.488 80.990 126.297 1.00 9.16 ? 146 TYR A CD2 1 +ATOM 1067 C CE1 . TYR A 1 126 ? 71.667 78.567 125.221 1.00 9.72 ? 146 TYR A CE1 1 +ATOM 1068 C CE2 . TYR A 1 126 ? 71.724 80.969 125.112 1.00 9.32 ? 146 TYR A CE2 1 +ATOM 1069 C CZ . TYR A 1 126 ? 71.325 79.742 124.587 1.00 8.02 ? 146 TYR A CZ 1 +ATOM 1070 O OH . TYR A 1 126 ? 70.587 79.668 123.420 1.00 8.89 ? 146 TYR A OH 1 +ATOM 1071 N N . LEU A 1 127 ? 72.942 79.923 131.816 1.00 8.89 ? 147 LEU A N 1 +ATOM 1072 C CA . LEU A 1 127 ? 73.651 80.102 133.085 1.00 8.99 ? 147 LEU A CA 1 +ATOM 1073 C C . LEU A 1 127 ? 72.739 79.737 134.252 1.00 9.08 ? 147 LEU A C 1 +ATOM 1074 O O . LEU A 1 127 ? 71.531 80.040 134.220 1.00 8.53 ? 147 LEU A O 1 +ATOM 1075 C CB . LEU A 1 127 ? 74.168 81.534 133.231 1.00 9.10 ? 147 LEU A CB 1 +ATOM 1076 C CG . LEU A 1 127 ? 75.388 81.885 132.377 1.00 9.00 ? 147 LEU A CG 1 +ATOM 1077 C CD1 . LEU A 1 127 ? 75.594 83.387 132.277 1.00 9.07 ? 147 LEU A CD1 1 +ATOM 1078 C CD2 . LEU A 1 127 ? 76.643 81.223 132.929 1.00 9.50 ? 147 LEU A CD2 1 +ATOM 1079 N N . PRO A 1 128 ? 73.308 79.078 135.274 1.00 9.03 ? 148 PRO A N 1 +ATOM 1080 C CA . PRO A 1 128 ? 72.560 78.549 136.411 1.00 9.58 ? 148 PRO A CA 1 +ATOM 1081 C C . PRO A 1 128 ? 72.137 79.611 137.411 1.00 10.36 ? 148 PRO A C 1 +ATOM 1082 O O . PRO A 1 128 ? 72.759 80.665 137.520 1.00 11.04 ? 148 PRO A O 1 +ATOM 1083 C CB . PRO A 1 128 ? 73.564 77.579 137.048 1.00 9.97 ? 148 PRO A CB 1 +ATOM 1084 C CG . PRO A 1 128 ? 74.867 78.194 136.753 1.00 9.08 ? 148 PRO A CG 1 +ATOM 1085 C CD . PRO A 1 128 ? 74.750 78.776 135.396 1.00 8.64 ? 148 PRO A CD 1 +ATOM 1086 N N . PHE A 1 129 ? 71.074 79.318 138.147 1.00 10.70 ? 149 PHE A N 1 +ATOM 1087 C CA . PHE A 1 129 ? 70.649 80.192 139.234 1.00 11.32 ? 149 PHE A CA 1 +ATOM 1088 C C . PHE A 1 129 ? 69.961 79.349 140.296 1.00 11.88 ? 149 PHE A C 1 +ATOM 1089 O O . PHE A 1 129 ? 69.482 78.252 140.007 1.00 11.29 ? 149 PHE A O 1 +ATOM 1090 C CB . PHE A 1 129 ? 69.755 81.323 138.719 1.00 11.30 ? 149 PHE A CB 1 +ATOM 1091 C CG . PHE A 1 129 ? 68.618 80.868 137.852 1.00 11.61 ? 149 PHE A CG 1 +ATOM 1092 C CD1 . PHE A 1 129 ? 68.812 80.591 136.504 1.00 11.45 ? 149 PHE A CD1 1 +ATOM 1093 C CD2 . PHE A 1 129 ? 67.336 80.746 138.383 1.00 11.14 ? 149 PHE A CD2 1 +ATOM 1094 C CE1 . PHE A 1 129 ? 67.749 80.186 135.709 1.00 11.95 ? 149 PHE A CE1 1 +ATOM 1095 C CE2 . PHE A 1 129 ? 66.273 80.339 137.599 1.00 12.22 ? 149 PHE A CE2 1 +ATOM 1096 C CZ . PHE A 1 129 ? 66.472 80.048 136.261 1.00 11.74 ? 149 PHE A CZ 1 +ATOM 1097 N N . GLU A 1 130 ? 69.942 79.850 141.531 1.00 12.97 ? 150 GLU A N 1 +ATOM 1098 C CA . GLU A 1 130 ? 69.444 79.054 142.650 1.00 13.73 ? 150 GLU A CA 1 +ATOM 1099 C C . GLU A 1 130 ? 68.886 79.883 143.787 1.00 13.97 ? 150 GLU A C 1 +ATOM 1100 O O . GLU A 1 130 ? 69.176 81.075 143.898 1.00 13.64 ? 150 GLU A O 1 +ATOM 1101 C CB . GLU A 1 130 ? 70.556 78.150 143.195 1.00 13.81 ? 150 GLU A CB 1 +ATOM 1102 C CG . GLU A 1 130 ? 71.756 78.878 143.810 1.00 14.79 ? 150 GLU A CG 1 +ATOM 1103 C CD . GLU A 1 130 ? 72.710 77.938 144.517 1.00 15.26 ? 150 GLU A CD 1 +ATOM 1104 O OE1 . GLU A 1 130 ? 72.784 76.749 144.131 1.00 15.24 ? 150 GLU A OE1 1 +ATOM 1105 O OE2 . GLU A 1 130 ? 73.377 78.383 145.484 1.00 15.23 ? 150 GLU A OE2 1 +ATOM 1106 N N . ALA A 1 131 ? 68.121 79.228 144.662 1.00 14.27 ? 151 ALA A N 1 +ATOM 1107 C CA . ALA A 1 131 ? 67.611 79.894 145.869 1.00 14.81 ? 151 ALA A CA 1 +ATOM 1108 C C . ALA A 1 131 ? 67.526 78.922 147.041 1.00 15.06 ? 151 ALA A C 1 +ATOM 1109 O O . ALA A 1 131 ? 67.218 77.746 146.862 1.00 14.71 ? 151 ALA A O 1 +ATOM 1110 C CB . ALA A 1 131 ? 66.260 80.507 145.606 1.00 14.77 ? 151 ALA A CB 1 +ATOM 1111 N N . ASP A 1 132 ? 67.822 79.437 148.229 1.00 16.08 ? 152 ASP A N 1 +ATOM 1112 C CA . ASP A 1 132 ? 67.664 78.700 149.474 1.00 16.53 ? 152 ASP A CA 1 +ATOM 1113 C C . ASP A 1 132 ? 66.170 78.667 149.778 1.00 17.23 ? 152 ASP A C 1 +ATOM 1114 O O . ASP A 1 132 ? 65.562 79.715 149.997 1.00 17.17 ? 152 ASP A O 1 +ATOM 1115 C CB . ASP A 1 132 ? 68.452 79.407 150.586 1.00 16.91 ? 152 ASP A CB 1 +ATOM 1116 C CG . ASP A 1 132 ? 68.447 78.650 151.906 1.00 17.21 ? 152 ASP A CG 1 +ATOM 1117 O OD1 . ASP A 1 132 ? 67.488 77.894 152.178 1.00 17.90 ? 152 ASP A OD1 1 +ATOM 1118 O OD2 . ASP A 1 132 ? 69.407 78.844 152.679 1.00 16.76 ? 152 ASP A OD2 1 +ATOM 1119 N N . ILE A 1 133 ? 65.572 77.476 149.758 1.00 17.45 ? 153 ILE A N 1 +ATOM 1120 C CA . ILE A 1 133 ? 64.126 77.341 149.972 1.00 18.33 ? 153 ILE A CA 1 +ATOM 1121 C C . ILE A 1 133 ? 63.785 76.695 151.329 1.00 18.86 ? 153 ILE A C 1 +ATOM 1122 O O . ILE A 1 133 ? 62.635 76.331 151.570 1.00 19.68 ? 153 ILE A O 1 +ATOM 1123 C CB . ILE A 1 133 ? 63.432 76.575 148.790 1.00 17.85 ? 153 ILE A CB 1 +ATOM 1124 C CG1 . ILE A 1 133 ? 63.982 75.151 148.635 1.00 18.24 ? 153 ILE A CG1 1 +ATOM 1125 C CG2 . ILE A 1 133 ? 63.600 77.345 147.490 1.00 19.05 ? 153 ILE A CG2 1 +ATOM 1126 C CD1 . ILE A 1 133 ? 63.142 74.274 147.709 1.00 18.28 ? 153 ILE A CD1 1 +ATOM 1127 N N . SER A 1 134 ? 64.777 76.597 152.221 1.00 19.98 ? 154 SER A N 1 +ATOM 1128 C CA . SER A 1 134 ? 64.621 75.924 153.520 1.00 20.62 ? 154 SER A CA 1 +ATOM 1129 C C . SER A 1 134 ? 63.358 76.365 154.264 1.00 21.82 ? 154 SER A C 1 +ATOM 1130 O O . SER A 1 134 ? 62.574 75.531 154.724 1.00 21.44 ? 154 SER A O 1 +ATOM 1131 C CB . SER A 1 134 ? 65.840 76.191 154.417 1.00 20.53 ? 154 SER A CB 1 +ATOM 1132 O OG . SER A 1 134 ? 67.062 75.828 153.778 1.00 18.88 ? 154 SER A OG 1 +ATOM 1133 N N . ASN A 1 135 ? 63.181 77.677 154.376 1.00 23.01 ? 155 ASN A N 1 +ATOM 1134 C CA . ASN A 1 135 ? 62.034 78.250 155.079 1.00 24.32 ? 155 ASN A CA 1 +ATOM 1135 C C . ASN A 1 135 ? 60.693 77.785 154.502 1.00 25.13 ? 155 ASN A C 1 +ATOM 1136 O O . ASN A 1 135 ? 59.733 77.545 155.248 1.00 25.71 ? 155 ASN A O 1 +ATOM 1137 C CB . ASN A 1 135 ? 62.109 79.780 155.062 1.00 24.64 ? 155 ASN A CB 1 +ATOM 1138 C CG . ASN A 1 135 ? 61.883 80.356 153.683 1.00 25.19 ? 155 ASN A CG 1 +ATOM 1139 O OD1 . ASN A 1 135 ? 62.564 79.985 152.725 1.00 28.23 ? 155 ASN A OD1 1 +ATOM 1140 N ND2 . ASN A 1 135 ? 60.907 81.250 153.566 1.00 27.88 ? 155 ASN A ND2 1 +ATOM 1141 N N . LEU A 1 136 ? 60.626 77.652 153.180 1.00 25.46 ? 156 LEU A N 1 +ATOM 1142 C CA . LEU A 1 136 ? 59.395 77.240 152.522 1.00 26.18 ? 156 LEU A CA 1 +ATOM 1143 C C . LEU A 1 136 ? 59.132 75.743 152.703 1.00 26.74 ? 156 LEU A C 1 +ATOM 1144 O O . LEU A 1 136 ? 57.977 75.308 152.688 1.00 27.15 ? 156 LEU A O 1 +ATOM 1145 C CB . LEU A 1 136 ? 59.427 77.620 151.038 1.00 26.25 ? 156 LEU A CB 1 +ATOM 1146 C CG . LEU A 1 136 ? 59.568 79.120 150.753 1.00 26.47 ? 156 LEU A CG 1 +ATOM 1147 C CD1 . LEU A 1 136 ? 59.791 79.358 149.271 1.00 27.16 ? 156 LEU A CD1 1 +ATOM 1148 C CD2 . LEU A 1 136 ? 58.335 79.902 151.237 1.00 27.01 ? 156 LEU A CD2 1 +ATOM 1149 N N . VAL A 1 137 ? 60.190 74.957 152.888 1.00 27.32 ? 157 VAL A N 1 +ATOM 1150 C CA . VAL A 1 137 ? 60.038 73.511 153.059 1.00 27.95 ? 157 VAL A CA 1 +ATOM 1151 C C . VAL A 1 137 ? 59.887 73.125 154.535 1.00 28.64 ? 157 VAL A C 1 +ATOM 1152 O O . VAL A 1 137 ? 59.322 72.075 154.847 1.00 28.71 ? 157 VAL A O 1 +ATOM 1153 C CB . VAL A 1 137 ? 61.214 72.714 152.422 1.00 28.09 ? 157 VAL A CB 1 +ATOM 1154 C CG1 . VAL A 1 137 ? 61.627 73.333 151.092 1.00 28.61 ? 157 VAL A CG1 1 +ATOM 1155 C CG2 . VAL A 1 137 ? 62.405 72.637 153.365 1.00 27.91 ? 157 VAL A CG2 1 +ATOM 1156 N N . GLN A 1 138 ? 60.377 73.978 155.435 1.00 29.57 ? 158 GLN A N 1 +ATOM 1157 C CA . GLN A 1 138 ? 60.413 73.666 156.866 1.00 30.24 ? 158 GLN A CA 1 +ATOM 1158 C C . GLN A 1 138 ? 59.237 74.322 157.591 1.00 31.33 ? 158 GLN A C 1 +ATOM 1159 O O . GLN A 1 138 ? 59.415 75.196 158.441 1.00 31.78 ? 158 GLN A O 1 +ATOM 1160 C CB . GLN A 1 138 ? 61.766 74.081 157.463 1.00 30.16 ? 158 GLN A CB 1 +ATOM 1161 C CG . GLN A 1 138 ? 62.919 73.211 156.951 1.00 29.69 ? 158 GLN A CG 1 +ATOM 1162 C CD . GLN A 1 138 ? 64.300 73.756 157.279 1.00 29.36 ? 158 GLN A CD 1 +ATOM 1163 O OE1 . GLN A 1 138 ? 64.470 74.933 157.565 1.00 27.10 ? 158 GLN A OE1 1 +ATOM 1164 N NE2 . GLN A 1 138 ? 65.296 72.889 157.224 1.00 28.35 ? 158 GLN A NE2 1 +ATOM 1165 N N . VAL A 1 139 ? 58.039 73.856 157.245 1.00 32.54 ? 159 VAL A N 1 +ATOM 1166 C CA . VAL A 1 139 ? 56.771 74.451 157.683 1.00 33.32 ? 159 VAL A CA 1 +ATOM 1167 C C . VAL A 1 139 ? 56.212 73.826 158.973 1.00 33.81 ? 159 VAL A C 1 +ATOM 1168 O O . VAL A 1 139 ? 55.644 74.534 159.807 1.00 34.28 ? 159 VAL A O 1 +ATOM 1169 C CB . VAL A 1 139 ? 55.702 74.364 156.552 1.00 33.52 ? 159 VAL A CB 1 +ATOM 1170 C CG1 . VAL A 1 139 ? 55.508 72.922 156.085 1.00 33.85 ? 159 VAL A CG1 1 +ATOM 1171 C CG2 . VAL A 1 139 ? 54.380 74.968 157.008 1.00 33.90 ? 159 VAL A CG2 1 +ATOM 1172 N N . GLY A 1 140 ? 56.365 72.510 159.125 1.00 34.18 ? 160 GLY A N 1 +ATOM 1173 C CA . GLY A 1 140 ? 55.945 71.803 160.341 1.00 34.25 ? 160 GLY A CA 1 +ATOM 1174 C C . GLY A 1 140 ? 54.837 70.793 160.096 1.00 34.53 ? 160 GLY A C 1 +ATOM 1175 O O . GLY A 1 140 ? 54.114 70.411 161.021 1.00 34.76 ? 160 GLY A O 1 +ATOM 1176 N N . SER A 1 144 ? 53.528 66.770 152.714 1.00 29.55 ? 164 SER A N 1 +ATOM 1177 C CA . SER A 1 144 ? 53.035 67.550 151.576 1.00 29.70 ? 164 SER A CA 1 +ATOM 1178 C C . SER A 1 144 ? 54.096 67.714 150.486 1.00 29.23 ? 164 SER A C 1 +ATOM 1179 O O . SER A 1 144 ? 55.244 68.072 150.778 1.00 29.48 ? 164 SER A O 1 +ATOM 1180 C CB . SER A 1 144 ? 52.574 68.935 152.044 1.00 29.89 ? 164 SER A CB 1 +ATOM 1181 O OG . SER A 1 144 ? 53.652 69.668 152.610 1.00 30.88 ? 164 SER A OG 1 +ATOM 1182 N N . ARG A 1 145 ? 53.709 67.468 149.233 1.00 28.46 ? 165 ARG A N 1 +ATOM 1183 C CA . ARG A 1 145 ? 54.647 67.625 148.111 1.00 27.67 ? 165 ARG A CA 1 +ATOM 1184 C C . ARG A 1 145 ? 54.924 69.098 147.766 1.00 26.26 ? 165 ARG A C 1 +ATOM 1185 O O . ARG A 1 145 ? 54.010 69.918 147.664 1.00 26.70 ? 165 ARG A O 1 +ATOM 1186 C CB . ARG A 1 145 ? 54.251 66.840 146.831 1.00 27.86 ? 165 ARG A CB 1 +ATOM 1187 C CG . ARG A 1 145 ? 52.788 66.426 146.625 1.00 29.45 ? 165 ARG A CG 1 +ATOM 1188 C CD . ARG A 1 145 ? 52.533 64.975 147.047 1.00 32.03 ? 165 ARG A CD 1 +ATOM 1189 N NE . ARG A 1 145 ? 51.656 64.244 146.120 1.00 33.88 ? 165 ARG A NE 1 +ATOM 1190 C CZ . ARG A 1 145 ? 52.058 63.584 145.028 1.00 34.36 ? 165 ARG A CZ 1 +ATOM 1191 N NH1 . ARG A 1 145 ? 53.343 63.552 144.670 1.00 35.22 ? 165 ARG A NH1 1 +ATOM 1192 N NH2 . ARG A 1 145 ? 51.161 62.952 144.270 1.00 34.57 ? 165 ARG A NH2 1 +ATOM 1193 N N . LEU A 1 146 ? 56.209 69.398 147.606 1.00 24.03 ? 166 LEU A N 1 +ATOM 1194 C CA . LEU A 1 146 ? 56.713 70.682 147.125 1.00 22.66 ? 166 LEU A CA 1 +ATOM 1195 C C . LEU A 1 146 ? 56.293 70.890 145.670 1.00 21.03 ? 166 LEU A C 1 +ATOM 1196 O O . LEU A 1 146 ? 56.580 70.043 144.817 1.00 20.94 ? 166 LEU A O 1 +ATOM 1197 C CB . LEU A 1 146 ? 58.246 70.659 147.230 1.00 22.70 ? 166 LEU A CB 1 +ATOM 1198 C CG . LEU A 1 146 ? 59.104 71.870 146.879 1.00 23.04 ? 166 LEU A CG 1 +ATOM 1199 C CD1 . LEU A 1 146 ? 58.947 72.957 147.922 1.00 25.27 ? 166 LEU A CD1 1 +ATOM 1200 C CD2 . LEU A 1 146 ? 60.563 71.439 146.769 1.00 22.53 ? 166 LEU A CD2 1 +ATOM 1201 N N . ARG A 1 147 ? 55.618 72.006 145.390 1.00 19.24 ? 167 ARG A N 1 +ATOM 1202 C CA . ARG A 1 147 ? 55.213 72.349 144.031 1.00 17.64 ? 167 ARG A CA 1 +ATOM 1203 C C . ARG A 1 147 ? 56.113 73.463 143.502 1.00 16.63 ? 167 ARG A C 1 +ATOM 1204 O O . ARG A 1 147 ? 56.163 74.553 144.062 1.00 16.12 ? 167 ARG A O 1 +ATOM 1205 C CB . ARG A 1 147 ? 53.740 72.762 143.987 1.00 17.88 ? 167 ARG A CB 1 +ATOM 1206 C CG . ARG A 1 147 ? 53.217 73.100 142.596 1.00 16.89 ? 167 ARG A CG 1 +ATOM 1207 C CD . ARG A 1 147 ? 51.701 73.232 142.588 1.00 16.51 ? 167 ARG A CD 1 +ATOM 1208 N NE . ARG A 1 147 ? 51.229 74.299 143.466 1.00 15.82 ? 167 ARG A NE 1 +ATOM 1209 C CZ . ARG A 1 147 ? 51.172 75.592 143.142 1.00 16.78 ? 167 ARG A CZ 1 +ATOM 1210 N NH1 . ARG A 1 147 ? 51.567 76.027 141.944 1.00 16.35 ? 167 ARG A NH1 1 +ATOM 1211 N NH2 . ARG A 1 147 ? 50.717 76.467 144.032 1.00 17.62 ? 167 ARG A NH2 1 +ATOM 1212 N N . ILE A 1 148 ? 56.844 73.163 142.432 1.00 14.82 ? 168 ILE A N 1 +ATOM 1213 C CA . ILE A 1 148 ? 57.779 74.110 141.824 1.00 13.62 ? 168 ILE A CA 1 +ATOM 1214 C C . ILE A 1 148 ? 57.196 74.548 140.489 1.00 12.47 ? 168 ILE A C 1 +ATOM 1215 O O . ILE A 1 148 ? 56.961 73.719 139.626 1.00 11.92 ? 168 ILE A O 1 +ATOM 1216 C CB . ILE A 1 148 ? 59.154 73.454 141.583 1.00 13.64 ? 168 ILE A CB 1 +ATOM 1217 C CG1 . ILE A 1 148 ? 59.853 73.150 142.911 1.00 13.58 ? 168 ILE A CG1 1 +ATOM 1218 C CG2 . ILE A 1 148 ? 60.039 74.344 140.744 1.00 13.46 ? 168 ILE A CG2 1 +ATOM 1219 C CD1 . ILE A 1 148 ? 60.873 72.018 142.801 1.00 15.15 ? 168 ILE A CD1 1 +ATOM 1220 N N . THR A 1 149 ? 56.963 75.853 140.344 1.00 11.92 ? 169 THR A N 1 +ATOM 1221 C CA . THR A 1 149 ? 56.400 76.442 139.131 1.00 11.49 ? 169 THR A CA 1 +ATOM 1222 C C . THR A 1 149 ? 57.434 77.397 138.548 1.00 10.89 ? 169 THR A C 1 +ATOM 1223 O O . THR A 1 149 ? 57.987 78.215 139.272 1.00 10.49 ? 169 THR A O 1 +ATOM 1224 C CB . THR A 1 149 ? 55.120 77.234 139.461 1.00 11.57 ? 169 THR A CB 1 +ATOM 1225 O OG1 . THR A 1 149 ? 54.203 76.376 140.150 1.00 11.05 ? 169 THR A OG1 1 +ATOM 1226 C CG2 . THR A 1 149 ? 54.448 77.769 138.192 1.00 11.94 ? 169 THR A CG2 1 +ATOM 1227 N N . ILE A 1 150 ? 57.697 77.283 137.250 1.00 10.64 ? 170 ILE A N 1 +ATOM 1228 C CA . ILE A 1 150 ? 58.689 78.125 136.577 1.00 10.90 ? 170 ILE A CA 1 +ATOM 1229 C C . ILE A 1 150 ? 58.106 78.681 135.270 1.00 10.41 ? 170 ILE A C 1 +ATOM 1230 O O . ILE A 1 150 ? 57.672 77.910 134.409 1.00 9.97 ? 170 ILE A O 1 +ATOM 1231 C CB . ILE A 1 150 ? 59.982 77.344 136.269 1.00 11.38 ? 170 ILE A CB 1 +ATOM 1232 C CG1 . ILE A 1 150 ? 60.491 76.603 137.518 1.00 11.40 ? 170 ILE A CG1 1 +ATOM 1233 C CG2 . ILE A 1 150 ? 61.048 78.301 135.720 1.00 10.61 ? 170 ILE A CG2 1 +ATOM 1234 C CD1 . ILE A 1 150 ? 61.722 75.749 137.248 1.00 10.90 ? 170 ILE A CD1 1 +ATOM 1235 N N . ALA A 1 151 ? 58.084 80.012 135.144 1.00 10.16 ? 171 ALA A N 1 +ATOM 1236 C CA . ALA A 1 151 ? 57.677 80.687 133.910 1.00 9.68 ? 171 ALA A CA 1 +ATOM 1237 C C . ALA A 1 151 ? 58.927 81.249 133.213 1.00 9.57 ? 171 ALA A C 1 +ATOM 1238 O O . ALA A 1 151 ? 59.737 81.936 133.836 1.00 9.14 ? 171 ALA A O 1 +ATOM 1239 C CB . ALA A 1 151 ? 56.707 81.817 134.206 1.00 9.86 ? 171 ALA A CB 1 +ATOM 1240 N N . ILE A 1 152 ? 59.063 80.939 131.930 1.00 9.28 ? 172 ILE A N 1 +ATOM 1241 C CA . ILE A 1 152 ? 60.265 81.239 131.155 1.00 8.49 ? 172 ILE A CA 1 +ATOM 1242 C C . ILE A 1 152 ? 59.855 82.042 129.944 1.00 8.48 ? 172 ILE A C 1 +ATOM 1243 O O . ILE A 1 152 ? 58.985 81.596 129.177 1.00 8.62 ? 172 ILE A O 1 +ATOM 1244 C CB . ILE A 1 152 ? 60.960 79.949 130.655 1.00 8.54 ? 172 ILE A CB 1 +ATOM 1245 C CG1 . ILE A 1 152 ? 61.407 79.089 131.839 1.00 8.00 ? 172 ILE A CG1 1 +ATOM 1246 C CG2 . ILE A 1 152 ? 62.141 80.306 129.743 1.00 7.19 ? 172 ILE A CG2 1 +ATOM 1247 C CD1 . ILE A 1 152 ? 61.880 77.691 131.461 1.00 9.93 ? 172 ILE A CD1 1 +ATOM 1248 N N . ASN A 1 153 ? 60.461 83.223 129.785 1.00 8.71 ? 173 ASN A N 1 +ATOM 1249 C CA . ASN A 1 153 ? 60.205 84.097 128.652 1.00 8.61 ? 173 ASN A CA 1 +ATOM 1250 C C . ASN A 1 153 ? 61.377 83.979 127.674 1.00 7.96 ? 173 ASN A C 1 +ATOM 1251 O O . ASN A 1 153 ? 62.540 84.064 128.077 1.00 7.60 ? 173 ASN A O 1 +ATOM 1252 C CB . ASN A 1 153 ? 60.036 85.545 129.132 1.00 8.51 ? 173 ASN A CB 1 +ATOM 1253 C CG . ASN A 1 153 ? 59.416 86.449 128.087 1.00 10.03 ? 173 ASN A CG 1 +ATOM 1254 O OD1 . ASN A 1 153 ? 59.978 86.644 127.008 1.00 10.59 ? 173 ASN A OD1 1 +ATOM 1255 N ND2 . ASN A 1 153 ? 58.235 86.995 128.409 1.00 11.04 ? 173 ASN A ND2 1 +ATOM 1256 N N . ASN A 1 154 ? 61.065 83.778 126.399 1.00 8.06 ? 174 ASN A N 1 +ATOM 1257 C CA . ASN A 1 154 ? 62.087 83.523 125.372 1.00 8.08 ? 174 ASN A CA 1 +ATOM 1258 C C . ASN A 1 154 ? 62.230 84.699 124.409 1.00 8.35 ? 174 ASN A C 1 +ATOM 1259 O O . ASN A 1 154 ? 62.836 84.574 123.349 1.00 7.79 ? 174 ASN A O 1 +ATOM 1260 C CB . ASN A 1 154 ? 61.797 82.225 124.600 1.00 8.68 ? 174 ASN A CB 1 +ATOM 1261 C CG . ASN A 1 154 ? 60.547 82.323 123.738 1.00 8.91 ? 174 ASN A CG 1 +ATOM 1262 O OD1 . ASN A 1 154 ? 59.770 83.260 123.891 1.00 10.21 ? 174 ASN A OD1 1 +ATOM 1263 N ND2 . ASN A 1 154 ? 60.343 81.359 122.844 1.00 9.94 ? 174 ASN A ND2 1 +ATOM 1264 N N . THR A 1 155 ? 61.661 85.845 124.773 1.00 8.51 ? 175 THR A N 1 +ATOM 1265 C CA . THR A 1 155 ? 61.750 87.032 123.919 1.00 9.21 ? 175 THR A CA 1 +ATOM 1266 C C . THR A 1 155 ? 63.132 87.677 123.991 1.00 9.91 ? 175 THR A C 1 +ATOM 1267 O O . THR A 1 155 ? 63.603 88.039 125.075 1.00 9.26 ? 175 THR A O 1 +ATOM 1268 C CB . THR A 1 155 ? 60.714 88.101 124.304 1.00 9.42 ? 175 THR A CB 1 +ATOM 1269 O OG1 . THR A 1 155 ? 59.408 87.515 124.330 1.00 9.40 ? 175 THR A OG1 1 +ATOM 1270 C CG2 . THR A 1 155 ? 60.714 89.235 123.294 1.00 10.82 ? 175 THR A CG2 1 +ATOM 1271 N N . LEU A 1 156 ? 63.747 87.854 122.826 1.00 10.91 ? 176 LEU A N 1 +ATOM 1272 C CA . LEU A 1 156 ? 65.018 88.583 122.702 1.00 12.10 ? 176 LEU A CA 1 +ATOM 1273 C C . LEU A 1 156 ? 64.766 90.051 122.329 1.00 12.89 ? 176 LEU A C 1 +ATOM 1274 O O . LEU A 1 156 ? 63.902 90.354 121.497 1.00 13.72 ? 176 LEU A O 1 +ATOM 1275 C CB . LEU A 1 156 ? 65.909 87.922 121.648 1.00 12.37 ? 176 LEU A CB 1 +ATOM 1276 C CG . LEU A 1 156 ? 66.203 86.451 121.937 1.00 13.15 ? 176 LEU A CG 1 +ATOM 1277 C CD1 . LEU A 1 156 ? 66.959 85.803 120.785 1.00 14.26 ? 176 LEU A CD1 1 +ATOM 1278 C CD2 . LEU A 1 156 ? 66.944 86.305 123.260 1.00 12.63 ? 176 LEU A CD2 1 +ATOM 1279 N N . THR A 1 157 ? 65.552 90.929 122.944 1.00 13.27 ? 177 THR A N 1 +ATOM 1280 C CA . THR A 1 157 ? 65.366 92.383 122.889 1.00 14.47 ? 177 THR A CA 1 +ATOM 1281 C C . THR A 1 157 ? 66.705 93.083 122.645 1.00 14.21 ? 177 THR A C 1 +ATOM 1282 O O . THR A 1 157 ? 67.758 92.450 122.697 1.00 13.86 ? 177 THR A O 1 +ATOM 1283 C CB . THR A 1 157 ? 64.760 92.918 124.212 1.00 14.38 ? 177 THR A CB 1 +ATOM 1284 O OG1 . THR A 1 157 ? 65.783 93.048 125.205 1.00 17.06 ? 177 THR A OG1 1 +ATOM 1285 C CG2 . THR A 1 157 ? 63.655 91.999 124.720 1.00 15.79 ? 177 THR A CG2 1 +ATOM 1286 N N . PRO A 1 158 ? 66.680 94.401 122.358 1.00 14.77 ? 178 PRO A N 1 +ATOM 1287 C CA . PRO A 1 158 ? 67.944 95.116 122.197 1.00 15.05 ? 178 PRO A CA 1 +ATOM 1288 C C . PRO A 1 158 ? 68.907 95.057 123.388 1.00 15.96 ? 178 PRO A C 1 +ATOM 1289 O O . PRO A 1 158 ? 70.081 95.386 123.227 1.00 15.97 ? 178 PRO A O 1 +ATOM 1290 C CB . PRO A 1 158 ? 67.494 96.562 121.942 1.00 14.92 ? 178 PRO A CB 1 +ATOM 1291 C CG . PRO A 1 158 ? 66.155 96.419 121.331 1.00 15.26 ? 178 PRO A CG 1 +ATOM 1292 C CD . PRO A 1 158 ? 65.531 95.276 122.087 1.00 14.54 ? 178 PRO A CD 1 +ATOM 1293 N N . THR A 1 159 ? 68.426 94.660 124.565 1.00 16.45 ? 179 THR A N 1 +ATOM 1294 C CA . THR A 1 159 ? 69.268 94.605 125.754 1.00 17.48 ? 179 THR A CA 1 +ATOM 1295 C C . THR A 1 159 ? 69.472 93.177 126.288 1.00 17.35 ? 179 THR A C 1 +ATOM 1296 O O . THR A 1 159 ? 70.074 92.996 127.355 1.00 18.62 ? 179 THR A O 1 +ATOM 1297 C CB . THR A 1 159 ? 68.683 95.476 126.882 1.00 17.75 ? 179 THR A CB 1 +ATOM 1298 O OG1 . THR A 1 159 ? 67.382 94.997 127.229 1.00 18.90 ? 179 THR A OG1 1 +ATOM 1299 C CG2 . THR A 1 159 ? 68.583 96.927 126.439 1.00 18.50 ? 179 THR A CG2 1 +ATOM 1300 N N . THR A 1 160 ? 68.983 92.169 125.566 1.00 16.65 ? 180 THR A N 1 +ATOM 1301 C CA . THR A 1 160 ? 69.305 90.768 125.904 1.00 15.52 ? 180 THR A CA 1 +ATOM 1302 C C . THR A 1 160 ? 70.574 90.344 125.189 1.00 14.70 ? 180 THR A C 1 +ATOM 1303 O O . THR A 1 160 ? 70.983 90.987 124.227 1.00 14.07 ? 180 THR A O 1 +ATOM 1304 C CB . THR A 1 160 ? 68.173 89.781 125.536 1.00 15.69 ? 180 THR A CB 1 +ATOM 1305 O OG1 . THR A 1 160 ? 67.867 89.875 124.142 1.00 15.11 ? 180 THR A OG1 1 +ATOM 1306 C CG2 . THR A 1 160 ? 66.909 90.055 126.360 1.00 16.48 ? 180 THR A CG2 1 +ATOM 1307 N N . LEU A 1 161 ? 71.202 89.286 125.694 1.00 13.67 ? 181 LEU A N 1 +ATOM 1308 C CA . LEU A 1 161 ? 72.333 88.627 125.041 1.00 13.05 ? 181 LEU A CA 1 +ATOM 1309 C C . LEU A 1 161 ? 71.998 87.135 124.872 1.00 11.94 ? 181 LEU A C 1 +ATOM 1310 O O . LEU A 1 161 ? 71.928 86.415 125.876 1.00 11.51 ? 181 LEU A O 1 +ATOM 1311 C CB . LEU A 1 161 ? 73.596 88.733 125.896 1.00 13.15 ? 181 LEU A CB 1 +ATOM 1312 C CG . LEU A 1 161 ? 74.391 90.028 126.034 1.00 14.23 ? 181 LEU A CG 1 +ATOM 1313 C CD1 . LEU A 1 161 ? 75.661 89.692 126.820 1.00 13.54 ? 181 LEU A CD1 1 +ATOM 1314 C CD2 . LEU A 1 161 ? 74.755 90.665 124.689 1.00 12.64 ? 181 LEU A CD2 1 +ATOM 1315 N N . PRO A 1 162 ? 71.787 86.668 123.622 1.00 10.97 ? 182 PRO A N 1 +ATOM 1316 C CA . PRO A 1 162 ? 71.887 87.455 122.395 1.00 11.13 ? 182 PRO A CA 1 +ATOM 1317 C C . PRO A 1 162 ? 70.747 88.441 122.259 1.00 10.47 ? 182 PRO A C 1 +ATOM 1318 O O . PRO A 1 162 ? 69.646 88.167 122.752 1.00 10.81 ? 182 PRO A O 1 +ATOM 1319 C CB . PRO A 1 162 ? 71.783 86.399 121.286 1.00 10.88 ? 182 PRO A CB 1 +ATOM 1320 C CG . PRO A 1 162 ? 71.036 85.335 121.873 1.00 12.44 ? 182 PRO A CG 1 +ATOM 1321 C CD . PRO A 1 162 ? 71.430 85.270 123.319 1.00 11.33 ? 182 PRO A CD 1 +ATOM 1322 N N . PRO A 1 163 ? 71.003 89.578 121.592 1.00 10.56 ? 183 PRO A N 1 +ATOM 1323 C CA . PRO A 1 163 ? 69.969 90.573 121.335 1.00 10.36 ? 183 PRO A CA 1 +ATOM 1324 C C . PRO A 1 163 ? 69.018 90.145 120.210 1.00 10.31 ? 183 PRO A C 1 +ATOM 1325 O O . PRO A 1 163 ? 69.277 89.172 119.506 1.00 10.80 ? 183 PRO A O 1 +ATOM 1326 C CB . PRO A 1 163 ? 70.772 91.803 120.930 1.00 11.27 ? 183 PRO A CB 1 +ATOM 1327 C CG . PRO A 1 163 ? 71.977 91.233 120.255 1.00 10.02 ? 183 PRO A CG 1 +ATOM 1328 C CD . PRO A 1 163 ? 72.311 89.984 121.046 1.00 10.31 ? 183 PRO A CD 1 +ATOM 1329 N N . GLY A 1 164 ? 67.914 90.858 120.080 1.00 10.41 ? 184 GLY A N 1 +ATOM 1330 C CA . GLY A 1 164 ? 66.981 90.681 118.983 1.00 10.48 ? 184 GLY A CA 1 +ATOM 1331 C C . GLY A 1 164 ? 65.998 91.837 118.956 1.00 11.10 ? 184 GLY A C 1 +ATOM 1332 O O . GLY A 1 164 ? 66.074 92.727 119.787 1.00 10.97 ? 184 GLY A O 1 +ATOM 1333 N N . THR A 1 165 ? 65.072 91.834 118.003 1.00 11.09 ? 185 THR A N 1 +ATOM 1334 C CA . THR A 1 165 ? 63.992 92.821 118.023 1.00 11.15 ? 185 THR A CA 1 +ATOM 1335 C C . THR A 1 165 ? 62.667 92.157 117.693 1.00 10.89 ? 185 THR A C 1 +ATOM 1336 O O . THR A 1 165 ? 62.632 91.100 117.059 1.00 11.09 ? 185 THR A O 1 +ATOM 1337 C CB . THR A 1 165 ? 64.244 93.961 117.023 1.00 11.26 ? 185 THR A CB 1 +ATOM 1338 O OG1 . THR A 1 165 ? 64.198 93.442 115.687 1.00 12.25 ? 185 THR A OG1 1 +ATOM 1339 C CG2 . THR A 1 165 ? 65.617 94.631 117.275 1.00 11.71 ? 185 THR A CG2 1 +ATOM 1340 N N . ILE A 1 166 ? 61.585 92.775 118.152 1.00 10.42 ? 186 ILE A N 1 +ATOM 1341 C CA . ILE A 1 166 ? 60.224 92.327 117.828 1.00 10.27 ? 186 ILE A CA 1 +ATOM 1342 C C . ILE A 1 166 ? 59.579 93.338 116.881 1.00 11.40 ? 186 ILE A C 1 +ATOM 1343 O O . ILE A 1 166 ? 59.632 94.543 117.115 1.00 10.85 ? 186 ILE A O 1 +ATOM 1344 C CB . ILE A 1 166 ? 59.389 92.183 119.111 1.00 10.08 ? 186 ILE A CB 1 +ATOM 1345 C CG1 . ILE A 1 166 ? 59.874 90.952 119.897 1.00 9.85 ? 186 ILE A CG1 1 +ATOM 1346 C CG2 . ILE A 1 166 ? 57.895 92.094 118.785 1.00 10.16 ? 186 ILE A CG2 1 +ATOM 1347 C CD1 . ILE A 1 166 ? 59.487 89.618 119.279 1.00 10.22 ? 186 ILE A CD1 1 +ATOM 1348 N N . GLN A 1 167 ? 58.969 92.838 115.811 1.00 12.71 ? 187 GLN A N 1 +ATOM 1349 C CA . GLN A 1 167 ? 58.374 93.705 114.808 1.00 13.96 ? 187 GLN A CA 1 +ATOM 1350 C C . GLN A 1 167 ? 56.905 93.335 114.678 1.00 14.34 ? 187 GLN A C 1 +ATOM 1351 O O . GLN A 1 167 ? 56.578 92.197 114.363 1.00 13.10 ? 187 GLN A O 1 +ATOM 1352 C CB . GLN A 1 167 ? 59.075 93.517 113.465 1.00 14.84 ? 187 GLN A CB 1 +ATOM 1353 C CG . GLN A 1 167 ? 60.598 93.691 113.510 1.00 16.67 ? 187 GLN A CG 1 +ATOM 1354 C CD . GLN A 1 167 ? 61.035 95.044 114.042 1.00 21.33 ? 187 GLN A CD 1 +ATOM 1355 O OE1 . GLN A 1 167 ? 61.921 95.130 114.899 1.00 23.61 ? 187 GLN A OE1 1 +ATOM 1356 N NE2 . GLN A 1 167 ? 60.416 96.111 113.534 1.00 20.92 ? 187 GLN A NE2 1 +ATOM 1357 N N . TYR A 1 168 ? 56.030 94.302 114.950 1.00 15.42 ? 188 TYR A N 1 +ATOM 1358 C CA . TYR A 1 168 ? 54.597 94.149 114.688 1.00 16.01 ? 188 TYR A CA 1 +ATOM 1359 C C . TYR A 1 168 ? 54.322 94.658 113.284 1.00 16.08 ? 188 TYR A C 1 +ATOM 1360 O O . TYR A 1 168 ? 54.692 95.782 112.951 1.00 16.36 ? 188 TYR A O 1 +ATOM 1361 C CB . TYR A 1 168 ? 53.757 94.923 115.711 1.00 16.76 ? 188 TYR A CB 1 +ATOM 1362 C CG . TYR A 1 168 ? 53.590 94.169 117.008 1.00 17.32 ? 188 TYR A CG 1 +ATOM 1363 C CD1 . TYR A 1 168 ? 54.469 94.366 118.073 1.00 18.01 ? 188 TYR A CD1 1 +ATOM 1364 C CD2 . TYR A 1 168 ? 52.574 93.238 117.160 1.00 17.50 ? 188 TYR A CD2 1 +ATOM 1365 C CE1 . TYR A 1 168 ? 54.319 93.656 119.256 1.00 19.39 ? 188 TYR A CE1 1 +ATOM 1366 C CE2 . TYR A 1 168 ? 52.422 92.530 118.330 1.00 19.24 ? 188 TYR A CE2 1 +ATOM 1367 C CZ . TYR A 1 168 ? 53.297 92.737 119.376 1.00 18.91 ? 188 TYR A CZ 1 +ATOM 1368 O OH . TYR A 1 168 ? 53.134 92.009 120.539 1.00 19.91 ? 188 TYR A OH 1 +ATOM 1369 N N . LEU A 1 169 ? 53.688 93.827 112.463 1.00 16.14 ? 189 LEU A N 1 +ATOM 1370 C CA . LEU A 1 169 ? 53.387 94.189 111.083 1.00 16.32 ? 189 LEU A CA 1 +ATOM 1371 C C . LEU A 1 169 ? 51.875 94.377 110.962 1.00 16.53 ? 189 LEU A C 1 +ATOM 1372 O O . LEU A 1 169 ? 51.094 93.423 111.092 1.00 15.83 ? 189 LEU A O 1 +ATOM 1373 C CB . LEU A 1 169 ? 53.932 93.150 110.094 1.00 16.21 ? 189 LEU A CB 1 +ATOM 1374 C CG . LEU A 1 169 ? 55.453 92.926 110.133 1.00 16.46 ? 189 LEU A CG 1 +ATOM 1375 C CD1 . LEU A 1 169 ? 55.881 91.968 109.026 1.00 17.58 ? 189 LEU A CD1 1 +ATOM 1376 C CD2 . LEU A 1 169 ? 56.232 94.232 110.016 1.00 18.05 ? 189 LEU A CD2 1 +ATOM 1377 N N . THR A 1 170 ? 51.490 95.632 110.726 1.00 16.89 ? 190 THR A N 1 +ATOM 1378 C CA . THR A 1 170 ? 50.110 96.096 110.862 1.00 17.33 ? 190 THR A CA 1 +ATOM 1379 C C . THR A 1 170 ? 49.375 96.184 109.528 1.00 18.03 ? 190 THR A C 1 +ATOM 1380 O O . THR A 1 170 ? 48.171 96.468 109.500 1.00 18.28 ? 190 THR A O 1 +ATOM 1381 C CB . THR A 1 170 ? 50.096 97.501 111.523 1.00 17.45 ? 190 THR A CB 1 +ATOM 1382 O OG1 . THR A 1 170 ? 51.041 98.331 110.850 1.00 17.12 ? 190 THR A OG1 1 +ATOM 1383 C CG2 . THR A 1 170 ? 50.495 97.413 112.994 1.00 18.24 ? 190 THR A CG2 1 +ATOM 1384 N N . ASP A 1 171 ? 50.085 95.935 108.429 1.00 18.38 ? 191 ASP A N 1 +ATOM 1385 C CA . ASP A 1 171 ? 49.483 95.872 107.097 1.00 18.76 ? 191 ASP A CA 1 +ATOM 1386 C C . ASP A 1 171 ? 48.592 94.628 106.930 1.00 18.90 ? 191 ASP A C 1 +ATOM 1387 O O . ASP A 1 171 ? 49.061 93.564 106.528 1.00 18.58 ? 191 ASP A O 1 +ATOM 1388 C CB . ASP A 1 171 ? 50.594 95.885 106.038 1.00 18.94 ? 191 ASP A CB 1 +ATOM 1389 C CG . ASP A 1 171 ? 50.069 96.006 104.630 1.00 19.83 ? 191 ASP A CG 1 +ATOM 1390 O OD1 . ASP A 1 171 ? 48.831 95.994 104.430 1.00 20.93 ? 191 ASP A OD1 1 +ATOM 1391 O OD2 . ASP A 1 171 ? 50.913 96.114 103.710 1.00 21.28 ? 191 ASP A OD2 1 +ATOM 1392 N N . THR A 1 172 ? 47.295 94.790 107.194 1.00 18.91 ? 192 THR A N 1 +ATOM 1393 C CA . THR A 1 172 ? 46.345 93.680 107.195 1.00 19.02 ? 192 THR A CA 1 +ATOM 1394 C C . THR A 1 172 ? 45.997 93.127 105.797 1.00 18.80 ? 192 THR A C 1 +ATOM 1395 O O . THR A 1 172 ? 45.273 92.136 105.688 1.00 19.12 ? 192 THR A O 1 +ATOM 1396 C CB . THR A 1 172 ? 45.034 94.077 107.918 1.00 19.67 ? 192 THR A CB 1 +ATOM 1397 O OG1 . THR A 1 172 ? 44.470 95.229 107.289 1.00 20.09 ? 192 THR A OG1 1 +ATOM 1398 C CG2 . THR A 1 172 ? 45.301 94.376 109.376 1.00 19.44 ? 192 THR A CG2 1 +ATOM 1399 N N . SER A 1 173 ? 46.511 93.758 104.742 1.00 18.40 ? 193 SER A N 1 +ATOM 1400 C CA . SER A 1 173 ? 46.417 93.205 103.391 1.00 18.30 ? 193 SER A CA 1 +ATOM 1401 C C . SER A 1 173 ? 47.489 92.139 103.165 1.00 17.88 ? 193 SER A C 1 +ATOM 1402 O O . SER A 1 173 ? 47.415 91.392 102.182 1.00 18.05 ? 193 SER A O 1 +ATOM 1403 C CB . SER A 1 173 ? 46.555 94.310 102.336 1.00 18.28 ? 193 SER A CB 1 +ATOM 1404 O OG . SER A 1 173 ? 47.908 94.666 102.117 1.00 17.75 ? 193 SER A OG 1 +ATOM 1405 N N . LYS A 1 174 ? 48.483 92.091 104.062 1.00 17.49 ? 194 LYS A N 1 +ATOM 1406 C CA . LYS A 1 174 ? 49.570 91.102 104.007 1.00 17.07 ? 194 LYS A CA 1 +ATOM 1407 C C . LYS A 1 174 ? 49.724 90.198 105.241 1.00 16.18 ? 194 LYS A C 1 +ATOM 1408 O O . LYS A 1 174 ? 50.326 89.139 105.143 1.00 15.23 ? 194 LYS A O 1 +ATOM 1409 C CB . LYS A 1 174 ? 50.897 91.822 103.807 1.00 17.56 ? 194 LYS A CB 1 +ATOM 1410 C CG . LYS A 1 174 ? 51.011 92.582 102.492 1.00 18.95 ? 194 LYS A CG 1 +ATOM 1411 C CD . LYS A 1 174 ? 52.339 93.311 102.405 1.00 21.07 ? 194 LYS A CD 1 +ATOM 1412 C CE . LYS A 1 174 ? 53.524 92.377 102.302 1.00 22.86 ? 194 LYS A CE 1 +ATOM 1413 N NZ . LYS A 1 174 ? 54.730 93.087 101.841 1.00 24.18 ? 194 LYS A NZ 1 +ATOM 1414 N N . TYR A 1 175 ? 49.227 90.630 106.401 1.00 15.42 ? 195 TYR A N 1 +ATOM 1415 C CA . TYR A 1 175 ? 49.445 89.904 107.656 1.00 15.37 ? 195 TYR A CA 1 +ATOM 1416 C C . TYR A 1 175 ? 48.170 89.927 108.483 1.00 15.96 ? 195 TYR A C 1 +ATOM 1417 O O . TYR A 1 175 ? 47.511 90.966 108.533 1.00 16.28 ? 195 TYR A O 1 +ATOM 1418 C CB . TYR A 1 175 ? 50.568 90.566 108.470 1.00 14.90 ? 195 TYR A CB 1 +ATOM 1419 C CG . TYR A 1 175 ? 51.882 90.629 107.739 1.00 14.07 ? 195 TYR A CG 1 +ATOM 1420 C CD1 . TYR A 1 175 ? 52.255 91.764 107.039 1.00 14.70 ? 195 TYR A CD1 1 +ATOM 1421 C CD2 . TYR A 1 175 ? 52.740 89.539 107.725 1.00 14.44 ? 195 TYR A CD2 1 +ATOM 1422 C CE1 . TYR A 1 175 ? 53.461 91.820 106.355 1.00 12.92 ? 195 TYR A CE1 1 +ATOM 1423 C CE2 . TYR A 1 175 ? 53.939 89.584 107.042 1.00 12.73 ? 195 TYR A CE2 1 +ATOM 1424 C CZ . TYR A 1 175 ? 54.296 90.726 106.359 1.00 13.14 ? 195 TYR A CZ 1 +ATOM 1425 O OH . TYR A 1 175 ? 55.488 90.774 105.681 1.00 12.90 ? 195 TYR A OH 1 +ATOM 1426 N N . PRO A 1 176 ? 47.846 88.808 109.160 1.00 16.51 ? 196 PRO A N 1 +ATOM 1427 C CA . PRO A 1 176 ? 46.665 88.771 110.028 1.00 16.70 ? 196 PRO A CA 1 +ATOM 1428 C C . PRO A 1 176 ? 46.830 89.687 111.233 1.00 16.68 ? 196 PRO A C 1 +ATOM 1429 O O . PRO A 1 176 ? 47.954 90.001 111.630 1.00 16.26 ? 196 PRO A O 1 +ATOM 1430 C CB . PRO A 1 176 ? 46.609 87.311 110.472 1.00 16.81 ? 196 PRO A CB 1 +ATOM 1431 C CG . PRO A 1 176 ? 48.024 86.856 110.415 1.00 17.23 ? 196 PRO A CG 1 +ATOM 1432 C CD . PRO A 1 176 ? 48.568 87.522 109.193 1.00 16.46 ? 196 PRO A CD 1 +ATOM 1433 N N . LYS A 1 177 ? 45.709 90.115 111.804 1.00 16.93 ? 197 LYS A N 1 +ATOM 1434 C CA . LYS A 1 177 ? 45.727 91.062 112.909 1.00 17.27 ? 197 LYS A CA 1 +ATOM 1435 C C . LYS A 1 177 ? 46.514 90.453 114.056 1.00 16.58 ? 197 LYS A C 1 +ATOM 1436 O O . LYS A 1 177 ? 46.298 89.296 114.415 1.00 16.88 ? 197 LYS A O 1 +ATOM 1437 C CB . LYS A 1 177 ? 44.302 91.397 113.362 1.00 17.51 ? 197 LYS A CB 1 +ATOM 1438 C CG . LYS A 1 177 ? 44.223 92.519 114.383 1.00 18.65 ? 197 LYS A CG 1 +ATOM 1439 C CD . LYS A 1 177 ? 42.776 92.847 114.731 1.00 19.97 ? 197 LYS A CD 1 +ATOM 1440 C CE . LYS A 1 177 ? 42.169 91.784 115.644 1.00 22.02 ? 197 LYS A CE 1 +ATOM 1441 N NZ . LYS A 1 177 ? 40.854 92.205 116.234 1.00 24.83 ? 197 LYS A NZ 1 +ATOM 1442 N N . GLY A 1 178 ? 47.450 91.221 114.595 1.00 16.00 ? 198 GLY A N 1 +ATOM 1443 C CA . GLY A 1 178 ? 48.264 90.772 115.713 1.00 15.40 ? 198 GLY A CA 1 +ATOM 1444 C C . GLY A 1 178 ? 49.600 90.178 115.331 1.00 14.94 ? 198 GLY A C 1 +ATOM 1445 O O . GLY A 1 178 ? 50.401 89.876 116.206 1.00 14.64 ? 198 GLY A O 1 +ATOM 1446 N N . TYR A 1 179 ? 49.856 90.029 114.032 1.00 14.25 ? 199 TYR A N 1 +ATOM 1447 C CA . TYR A 1 179 ? 51.099 89.404 113.557 1.00 13.94 ? 199 TYR A CA 1 +ATOM 1448 C C . TYR A 1 179 ? 52.340 90.143 114.056 1.00 13.74 ? 199 TYR A C 1 +ATOM 1449 O O . TYR A 1 179 ? 52.441 91.379 113.943 1.00 13.87 ? 199 TYR A O 1 +ATOM 1450 C CB . TYR A 1 179 ? 51.097 89.359 112.032 1.00 13.81 ? 199 TYR A CB 1 +ATOM 1451 C CG . TYR A 1 179 ? 52.245 88.601 111.389 1.00 12.47 ? 199 TYR A CG 1 +ATOM 1452 C CD1 . TYR A 1 179 ? 53.448 89.226 111.098 1.00 14.33 ? 199 TYR A CD1 1 +ATOM 1453 C CD2 . TYR A 1 179 ? 52.108 87.259 111.049 1.00 13.55 ? 199 TYR A CD2 1 +ATOM 1454 C CE1 . TYR A 1 179 ? 54.495 88.530 110.486 1.00 14.14 ? 199 TYR A CE1 1 +ATOM 1455 C CE2 . TYR A 1 179 ? 53.147 86.554 110.445 1.00 13.46 ? 199 TYR A CE2 1 +ATOM 1456 C CZ . TYR A 1 179 ? 54.338 87.194 110.173 1.00 14.09 ? 199 TYR A CZ 1 +ATOM 1457 O OH . TYR A 1 179 ? 55.354 86.480 109.561 1.00 13.49 ? 199 TYR A OH 1 +ATOM 1458 N N . PHE A 1 180 ? 53.269 89.380 114.630 1.00 13.59 ? 200 PHE A N 1 +ATOM 1459 C CA . PHE A 1 180 ? 54.602 89.874 114.939 1.00 13.49 ? 200 PHE A CA 1 +ATOM 1460 C C . PHE A 1 180 ? 55.656 88.790 114.714 1.00 13.40 ? 200 PHE A C 1 +ATOM 1461 O O . PHE A 1 180 ? 55.345 87.592 114.704 1.00 13.50 ? 200 PHE A O 1 +ATOM 1462 C CB . PHE A 1 180 ? 54.678 90.418 116.367 1.00 13.85 ? 200 PHE A CB 1 +ATOM 1463 C CG . PHE A 1 180 ? 54.597 89.366 117.445 1.00 14.04 ? 200 PHE A CG 1 +ATOM 1464 C CD1 . PHE A 1 180 ? 53.371 88.832 117.829 1.00 16.21 ? 200 PHE A CD1 1 +ATOM 1465 C CD2 . PHE A 1 180 ? 55.733 88.945 118.110 1.00 15.26 ? 200 PHE A CD2 1 +ATOM 1466 C CE1 . PHE A 1 180 ? 53.289 87.867 118.833 1.00 15.12 ? 200 PHE A CE1 1 +ATOM 1467 C CE2 . PHE A 1 180 ? 55.659 87.979 119.115 1.00 14.32 ? 200 PHE A CE2 1 +ATOM 1468 C CZ . PHE A 1 180 ? 54.435 87.443 119.476 1.00 15.10 ? 200 PHE A CZ 1 +ATOM 1469 N N . VAL A 1 181 ? 56.897 89.231 114.517 1.00 13.42 ? 201 VAL A N 1 +ATOM 1470 C CA . VAL A 1 181 ? 58.032 88.328 114.391 1.00 13.75 ? 201 VAL A CA 1 +ATOM 1471 C C . VAL A 1 181 ? 59.188 88.774 115.279 1.00 13.24 ? 201 VAL A C 1 +ATOM 1472 O O . VAL A 1 181 ? 59.339 89.962 115.580 1.00 13.14 ? 201 VAL A O 1 +ATOM 1473 C CB . VAL A 1 181 ? 58.510 88.220 112.929 1.00 14.04 ? 201 VAL A CB 1 +ATOM 1474 C CG1 . VAL A 1 181 ? 57.425 87.596 112.053 1.00 14.63 ? 201 VAL A CG1 1 +ATOM 1475 C CG2 . VAL A 1 181 ? 58.896 89.593 112.395 1.00 13.55 ? 201 VAL A CG2 1 +ATOM 1476 N N . GLN A 1 182 ? 59.978 87.795 115.715 1.00 12.79 ? 202 GLN A N 1 +ATOM 1477 C CA . GLN A 1 182 ? 61.235 88.040 116.403 1.00 12.24 ? 202 GLN A CA 1 +ATOM 1478 C C . GLN A 1 182 ? 62.307 88.070 115.324 1.00 12.14 ? 202 GLN A C 1 +ATOM 1479 O O . GLN A 1 182 ? 62.463 87.078 114.584 1.00 12.44 ? 202 GLN A O 1 +ATOM 1480 C CB . GLN A 1 182 ? 61.528 86.900 117.380 1.00 12.37 ? 202 GLN A CB 1 +ATOM 1481 C CG . GLN A 1 182 ? 62.918 86.927 118.041 1.00 11.05 ? 202 GLN A CG 1 +ATOM 1482 C CD . GLN A 1 182 ? 62.943 87.713 119.319 1.00 11.90 ? 202 GLN A CD 1 +ATOM 1483 O OE1 . GLN A 1 182 ? 62.486 87.243 120.371 1.00 11.41 ? 202 GLN A OE1 1 +ATOM 1484 N NE2 . GLN A 1 182 ? 63.479 88.921 119.249 1.00 10.79 ? 202 GLN A NE2 1 +ATOM 1485 N N . ASN A 1 183 ? 62.996 89.201 115.206 1.00 12.62 ? 203 ASN A N 1 +ATOM 1486 C CA . ASN A 1 183 ? 64.184 89.324 114.359 1.00 12.54 ? 203 ASN A CA 1 +ATOM 1487 C C . ASN A 1 183 ? 65.418 89.013 115.182 1.00 12.05 ? 203 ASN A C 1 +ATOM 1488 O O . ASN A 1 183 ? 65.551 89.498 116.306 1.00 11.55 ? 203 ASN A O 1 +ATOM 1489 C CB . ASN A 1 183 ? 64.333 90.736 113.801 1.00 12.77 ? 203 ASN A CB 1 +ATOM 1490 C CG . ASN A 1 183 ? 63.365 91.035 112.676 1.00 15.17 ? 203 ASN A CG 1 +ATOM 1491 O OD1 . ASN A 1 183 ? 62.655 90.159 112.190 1.00 16.88 ? 203 ASN A OD1 1 +ATOM 1492 N ND2 . ASN A 1 183 ? 63.355 92.295 112.240 1.00 20.49 ? 203 ASN A ND2 1 +ATOM 1493 N N . THR A 1 184 ? 66.311 88.191 114.625 1.00 11.99 ? 204 THR A N 1 +ATOM 1494 C CA . THR A 1 184 ? 67.613 87.916 115.250 1.00 11.60 ? 204 THR A CA 1 +ATOM 1495 C C . THR A 1 184 ? 68.733 88.000 114.226 1.00 11.53 ? 204 THR A C 1 +ATOM 1496 O O . THR A 1 184 ? 68.482 87.952 113.020 1.00 11.21 ? 204 THR A O 1 +ATOM 1497 C CB . THR A 1 184 ? 67.644 86.535 115.912 1.00 12.02 ? 204 THR A CB 1 +ATOM 1498 O OG1 . THR A 1 184 ? 67.394 85.525 114.935 1.00 10.98 ? 204 THR A OG1 1 +ATOM 1499 C CG2 . THR A 1 184 ? 66.604 86.457 117.021 1.00 12.04 ? 204 THR A CG2 1 +ATOM 1500 N N . TYR A 1 185 ? 69.967 88.150 114.718 1.00 10.90 ? 205 TYR A N 1 +ATOM 1501 C CA . TYR A 1 185 ? 71.131 88.300 113.857 1.00 11.03 ? 205 TYR A CA 1 +ATOM 1502 C C . TYR A 1 185 ? 72.232 87.284 114.171 1.00 10.96 ? 205 TYR A C 1 +ATOM 1503 O O . TYR A 1 185 ? 73.401 87.524 113.892 1.00 11.84 ? 205 TYR A O 1 +ATOM 1504 C CB . TYR A 1 185 ? 71.640 89.746 113.953 1.00 11.68 ? 205 TYR A CB 1 +ATOM 1505 C CG . TYR A 1 185 ? 70.579 90.729 113.531 1.00 13.38 ? 205 TYR A CG 1 +ATOM 1506 C CD1 . TYR A 1 185 ? 70.530 91.201 112.229 1.00 15.04 ? 205 TYR A CD1 1 +ATOM 1507 C CD2 . TYR A 1 185 ? 69.603 91.159 114.422 1.00 13.95 ? 205 TYR A CD2 1 +ATOM 1508 C CE1 . TYR A 1 185 ? 69.553 92.092 111.825 1.00 14.70 ? 205 TYR A CE1 1 +ATOM 1509 C CE2 . TYR A 1 185 ? 68.604 92.050 114.025 1.00 13.84 ? 205 TYR A CE2 1 +ATOM 1510 C CZ . TYR A 1 185 ? 68.592 92.510 112.729 1.00 14.51 ? 205 TYR A CZ 1 +ATOM 1511 O OH . TYR A 1 185 ? 67.625 93.397 112.319 1.00 15.90 ? 205 TYR A OH 1 +ATOM 1512 N N . PHE A 1 186 ? 71.839 86.129 114.707 1.00 10.02 ? 206 PHE A N 1 +ATOM 1513 C CA . PHE A 1 186 ? 72.765 85.030 114.979 1.00 9.41 ? 206 PHE A CA 1 +ATOM 1514 C C . PHE A 1 186 ? 72.267 83.758 114.286 1.00 8.50 ? 206 PHE A C 1 +ATOM 1515 O O . PHE A 1 186 ? 71.078 83.613 114.021 1.00 8.37 ? 206 PHE A O 1 +ATOM 1516 C CB . PHE A 1 186 ? 72.944 84.798 116.477 1.00 9.59 ? 206 PHE A CB 1 +ATOM 1517 C CG . PHE A 1 186 ? 71.655 84.652 117.237 1.00 10.18 ? 206 PHE A CG 1 +ATOM 1518 C CD1 . PHE A 1 186 ? 71.054 83.403 117.382 1.00 11.02 ? 206 PHE A CD1 1 +ATOM 1519 C CD2 . PHE A 1 186 ? 71.059 85.765 117.839 1.00 9.22 ? 206 PHE A CD2 1 +ATOM 1520 C CE1 . PHE A 1 186 ? 69.869 83.257 118.099 1.00 10.75 ? 206 PHE A CE1 1 +ATOM 1521 C CE2 . PHE A 1 186 ? 69.874 85.633 118.543 1.00 10.71 ? 206 PHE A CE2 1 +ATOM 1522 C CZ . PHE A 1 186 ? 69.275 84.368 118.677 1.00 10.90 ? 206 PHE A CZ 1 +ATOM 1523 N N . ASP A 1 187 ? 73.197 82.875 113.970 1.00 8.42 ? 207 ASP A N 1 +ATOM 1524 C CA . ASP A 1 187 ? 72.934 81.727 113.097 1.00 7.85 ? 207 ASP A CA 1 +ATOM 1525 C C . ASP A 1 187 ? 72.717 80.427 113.865 1.00 8.20 ? 207 ASP A C 1 +ATOM 1526 O O . ASP A 1 187 ? 73.388 79.409 113.611 1.00 8.61 ? 207 ASP A O 1 +ATOM 1527 C CB . ASP A 1 187 ? 74.102 81.588 112.112 1.00 7.70 ? 207 ASP A CB 1 +ATOM 1528 C CG . ASP A 1 187 ? 73.849 80.558 111.033 1.00 7.55 ? 207 ASP A CG 1 +ATOM 1529 O OD1 . ASP A 1 187 ? 72.699 80.377 110.611 1.00 7.29 ? 207 ASP A OD1 1 +ATOM 1530 O OD2 . ASP A 1 187 ? 74.829 79.943 110.581 1.00 9.17 ? 207 ASP A OD2 1 +ATOM 1531 N N . PHE A 1 188 ? 71.757 80.440 114.783 1.00 8.30 ? 208 PHE A N 1 +ATOM 1532 C CA . PHE A 1 188 ? 71.299 79.207 115.425 1.00 7.20 ? 208 PHE A CA 1 +ATOM 1533 C C . PHE A 1 188 ? 69.889 79.408 115.967 1.00 7.28 ? 208 PHE A C 1 +ATOM 1534 O O . PHE A 1 188 ? 69.529 80.531 116.326 1.00 6.67 ? 208 PHE A O 1 +ATOM 1535 C CB . PHE A 1 188 ? 72.256 78.734 116.523 1.00 7.58 ? 208 PHE A CB 1 +ATOM 1536 C CG . PHE A 1 188 ? 72.513 79.724 117.627 1.00 7.80 ? 208 PHE A CG 1 +ATOM 1537 C CD1 . PHE A 1 188 ? 71.720 79.744 118.769 1.00 7.73 ? 208 PHE A CD1 1 +ATOM 1538 C CD2 . PHE A 1 188 ? 73.603 80.597 117.566 1.00 7.98 ? 208 PHE A CD2 1 +ATOM 1539 C CE1 . PHE A 1 188 ? 71.980 80.651 119.802 1.00 7.78 ? 208 PHE A CE1 1 +ATOM 1540 C CE2 . PHE A 1 188 ? 73.861 81.489 118.595 1.00 8.09 ? 208 PHE A CE2 1 +ATOM 1541 C CZ . PHE A 1 188 ? 73.063 81.505 119.713 1.00 7.31 ? 208 PHE A CZ 1 +ATOM 1542 N N . PHE A 1 189 ? 69.107 78.329 116.024 1.00 6.50 ? 209 PHE A N 1 +ATOM 1543 C CA . PHE A 1 189 ? 67.704 78.445 116.438 1.00 7.11 ? 209 PHE A CA 1 +ATOM 1544 C C . PHE A 1 189 ? 67.574 78.808 117.901 1.00 7.29 ? 209 PHE A C 1 +ATOM 1545 O O . PHE A 1 189 ? 68.170 78.175 118.782 1.00 6.85 ? 209 PHE A O 1 +ATOM 1546 C CB . PHE A 1 189 ? 66.916 77.168 116.188 1.00 7.73 ? 209 PHE A CB 1 +ATOM 1547 C CG . PHE A 1 189 ? 65.418 77.353 116.293 1.00 6.95 ? 209 PHE A CG 1 +ATOM 1548 C CD1 . PHE A 1 189 ? 64.749 78.183 115.407 1.00 9.38 ? 209 PHE A CD1 1 +ATOM 1549 C CD2 . PHE A 1 189 ? 64.684 76.684 117.262 1.00 9.17 ? 209 PHE A CD2 1 +ATOM 1550 C CE1 . PHE A 1 189 ? 63.345 78.337 115.484 1.00 8.58 ? 209 PHE A CE1 1 +ATOM 1551 C CE2 . PHE A 1 189 ? 63.293 76.843 117.354 1.00 8.76 ? 209 PHE A CE2 1 +ATOM 1552 C CZ . PHE A 1 189 ? 62.636 77.681 116.464 1.00 9.51 ? 209 PHE A CZ 1 +ATOM 1553 N N . ASN A 1 190 ? 66.717 79.785 118.160 1.00 7.89 ? 210 ASN A N 1 +ATOM 1554 C CA . ASN A 1 190 ? 66.455 80.236 119.508 1.00 7.81 ? 210 ASN A CA 1 +ATOM 1555 C C . ASN A 1 190 ? 65.534 79.279 120.283 1.00 7.99 ? 210 ASN A C 1 +ATOM 1556 O O . ASN A 1 190 ? 64.461 79.679 120.744 1.00 8.21 ? 210 ASN A O 1 +ATOM 1557 C CB . ASN A 1 190 ? 65.862 81.646 119.452 1.00 8.48 ? 210 ASN A CB 1 +ATOM 1558 C CG . ASN A 1 190 ? 65.665 82.245 120.813 1.00 8.01 ? 210 ASN A CG 1 +ATOM 1559 O OD1 . ASN A 1 190 ? 66.503 82.089 121.708 1.00 8.26 ? 210 ASN A OD1 1 +ATOM 1560 N ND2 . ASN A 1 190 ? 64.543 82.940 120.991 1.00 8.24 ? 210 ASN A ND2 1 +ATOM 1561 N N . TYR A 1 191 ? 65.953 78.012 120.405 1.00 7.51 ? 211 TYR A N 1 +ATOM 1562 C CA . TYR A 1 191 ? 65.293 77.025 121.268 1.00 7.44 ? 211 TYR A CA 1 +ATOM 1563 C C . TYR A 1 191 ? 65.112 77.570 122.685 1.00 7.78 ? 211 TYR A C 1 +ATOM 1564 O O . TYR A 1 191 ? 65.901 78.388 123.144 1.00 8.66 ? 211 TYR A O 1 +ATOM 1565 C CB . TYR A 1 191 ? 66.128 75.730 121.372 1.00 7.33 ? 211 TYR A CB 1 +ATOM 1566 C CG . TYR A 1 191 ? 66.071 74.772 120.194 1.00 6.63 ? 211 TYR A CG 1 +ATOM 1567 C CD1 . TYR A 1 191 ? 64.916 74.025 119.929 1.00 6.76 ? 211 TYR A CD1 1 +ATOM 1568 C CD2 . TYR A 1 191 ? 67.186 74.565 119.374 1.00 6.51 ? 211 TYR A CD2 1 +ATOM 1569 C CE1 . TYR A 1 191 ? 64.851 73.135 118.858 1.00 6.77 ? 211 TYR A CE1 1 +ATOM 1570 C CE2 . TYR A 1 191 ? 67.141 73.665 118.322 1.00 5.65 ? 211 TYR A CE2 1 +ATOM 1571 C CZ . TYR A 1 191 ? 65.977 72.948 118.060 1.00 7.56 ? 211 TYR A CZ 1 +ATOM 1572 O OH . TYR A 1 191 ? 65.897 72.045 117.009 1.00 7.67 ? 211 TYR A OH 1 +ATOM 1573 N N . ALA A 1 192 ? 64.080 77.090 123.382 1.00 8.44 ? 212 ALA A N 1 +ATOM 1574 C CA . ALA A 1 192 ? 63.847 77.464 124.770 1.00 8.00 ? 212 ALA A CA 1 +ATOM 1575 C C . ALA A 1 192 ? 63.292 76.274 125.538 1.00 8.20 ? 212 ALA A C 1 +ATOM 1576 O O . ALA A 1 192 ? 62.888 75.288 124.958 1.00 6.20 ? 212 ALA A O 1 +ATOM 1577 C CB . ALA A 1 192 ? 62.866 78.624 124.860 1.00 8.49 ? 212 ALA A CB 1 +ATOM 1578 N N . GLY A 1 193 ? 63.230 76.438 126.850 1.00 8.36 ? 213 GLY A N 1 +ATOM 1579 C CA . GLY A 1 193 ? 62.771 75.419 127.763 1.00 9.08 ? 213 GLY A CA 1 +ATOM 1580 C C . GLY A 1 193 ? 63.714 75.310 128.941 1.00 9.12 ? 213 GLY A C 1 +ATOM 1581 O O . GLY A 1 193 ? 64.599 76.175 129.129 1.00 9.75 ? 213 GLY A O 1 +ATOM 1582 N N . LEU A 1 194 ? 63.480 74.261 129.738 1.00 9.44 ? 214 LEU A N 1 +ATOM 1583 C CA . LEU A 1 194 ? 64.396 73.817 130.786 1.00 9.29 ? 214 LEU A CA 1 +ATOM 1584 C C . LEU A 1 194 ? 65.343 72.812 130.142 1.00 9.68 ? 214 LEU A C 1 +ATOM 1585 O O . LEU A 1 194 ? 65.126 71.572 130.175 1.00 8.09 ? 214 LEU A O 1 +ATOM 1586 C CB . LEU A 1 194 ? 63.638 73.217 131.975 1.00 9.85 ? 214 LEU A CB 1 +ATOM 1587 C CG . LEU A 1 194 ? 62.811 74.214 132.804 1.00 10.61 ? 214 LEU A CG 1 +ATOM 1588 C CD1 . LEU A 1 194 ? 61.956 73.485 133.847 1.00 11.73 ? 214 LEU A CD1 1 +ATOM 1589 C CD2 . LEU A 1 194 ? 63.674 75.272 133.486 1.00 10.82 ? 214 LEU A CD2 1 +ATOM 1590 N N . GLN A 1 195 ? 66.383 73.372 129.520 1.00 8.99 ? 215 GLN A N 1 +ATOM 1591 C CA . GLN A 1 195 ? 67.303 72.607 128.675 1.00 8.93 ? 215 GLN A CA 1 +ATOM 1592 C C . GLN A 1 195 ? 68.434 71.942 129.460 1.00 9.37 ? 215 GLN A C 1 +ATOM 1593 O O . GLN A 1 195 ? 69.151 71.101 128.918 1.00 8.70 ? 215 GLN A O 1 +ATOM 1594 C CB . GLN A 1 195 ? 67.846 73.493 127.551 1.00 9.03 ? 215 GLN A CB 1 +ATOM 1595 C CG . GLN A 1 195 ? 66.725 74.115 126.730 1.00 8.96 ? 215 GLN A CG 1 +ATOM 1596 C CD . GLN A 1 195 ? 67.163 75.265 125.870 1.00 7.19 ? 215 GLN A CD 1 +ATOM 1597 O OE1 . GLN A 1 195 ? 67.858 76.183 126.321 1.00 11.88 ? 215 GLN A OE1 1 +ATOM 1598 N NE2 . GLN A 1 195 ? 66.743 75.243 124.635 1.00 5.96 ? 215 GLN A NE2 1 +ATOM 1599 N N . ARG A 1 196 ? 68.569 72.307 130.732 1.00 8.98 ? 216 ARG A N 1 +ATOM 1600 C CA . ARG A 1 196 ? 69.571 71.716 131.610 1.00 10.09 ? 216 ARG A CA 1 +ATOM 1601 C C . ARG A 1 196 ? 68.920 71.217 132.887 1.00 10.72 ? 216 ARG A C 1 +ATOM 1602 O O . ARG A 1 196 ? 67.789 71.580 133.191 1.00 10.16 ? 216 ARG A O 1 +ATOM 1603 C CB . ARG A 1 196 ? 70.666 72.725 131.893 1.00 10.12 ? 216 ARG A CB 1 +ATOM 1604 C CG . ARG A 1 196 ? 71.519 72.961 130.678 1.00 11.02 ? 216 ARG A CG 1 +ATOM 1605 C CD . ARG A 1 196 ? 72.704 73.828 130.944 1.00 10.96 ? 216 ARG A CD 1 +ATOM 1606 N NE . ARG A 1 196 ? 73.229 74.308 129.670 1.00 11.04 ? 216 ARG A NE 1 +ATOM 1607 C CZ . ARG A 1 196 ? 73.955 75.405 129.481 1.00 10.50 ? 216 ARG A CZ 1 +ATOM 1608 N NH1 . ARG A 1 196 ? 74.318 76.187 130.487 1.00 9.05 ? 216 ARG A NH1 1 +ATOM 1609 N NH2 . ARG A 1 196 ? 74.312 75.720 128.248 1.00 9.62 ? 216 ARG A NH2 1 +ATOM 1610 N N . SER A 1 197 ? 69.632 70.376 133.632 1.00 11.97 ? 217 SER A N 1 +ATOM 1611 C CA . SER A 1 197 ? 69.021 69.716 134.787 1.00 13.37 ? 217 SER A CA 1 +ATOM 1612 C C . SER A 1 197 ? 68.636 70.673 135.904 1.00 13.36 ? 217 SER A C 1 +ATOM 1613 O O . SER A 1 197 ? 69.318 71.683 136.149 1.00 13.67 ? 217 SER A O 1 +ATOM 1614 C CB . SER A 1 197 ? 69.918 68.611 135.326 1.00 14.14 ? 217 SER A CB 1 +ATOM 1615 O OG . SER A 1 197 ? 69.399 67.355 134.947 1.00 16.50 ? 217 SER A OG 1 +ATOM 1616 N N . VAL A 1 198 ? 67.490 70.366 136.516 1.00 13.56 ? 218 VAL A N 1 +ATOM 1617 C CA . VAL A 1 198 ? 66.949 71.077 137.655 1.00 13.86 ? 218 VAL A CA 1 +ATOM 1618 C C . VAL A 1 198 ? 67.069 70.125 138.826 1.00 14.05 ? 218 VAL A C 1 +ATOM 1619 O O . VAL A 1 198 ? 66.697 68.967 138.716 1.00 13.81 ? 218 VAL A O 1 +ATOM 1620 C CB . VAL A 1 198 ? 65.455 71.422 137.443 1.00 14.21 ? 218 VAL A CB 1 +ATOM 1621 C CG1 . VAL A 1 198 ? 64.900 72.180 138.629 1.00 14.50 ? 218 VAL A CG1 1 +ATOM 1622 C CG2 . VAL A 1 198 ? 65.290 72.246 136.181 1.00 14.51 ? 218 VAL A CG2 1 +ATOM 1623 N N . LEU A 1 199 ? 67.630 70.592 139.931 1.00 14.15 ? 219 LEU A N 1 +ATOM 1624 C CA . LEU A 1 199 ? 67.773 69.724 141.094 1.00 14.64 ? 219 LEU A CA 1 +ATOM 1625 C C . LEU A 1 199 ? 67.584 70.459 142.397 1.00 14.08 ? 219 LEU A C 1 +ATOM 1626 O O . LEU A 1 199 ? 67.618 71.689 142.455 1.00 13.95 ? 219 LEU A O 1 +ATOM 1627 C CB . LEU A 1 199 ? 69.126 69.001 141.108 1.00 14.91 ? 219 LEU A CB 1 +ATOM 1628 C CG . LEU A 1 199 ? 70.395 69.833 141.306 1.00 15.84 ? 219 LEU A CG 1 +ATOM 1629 C CD1 . LEU A 1 199 ? 71.533 68.944 141.834 1.00 16.25 ? 219 LEU A CD1 1 +ATOM 1630 C CD2 . LEU A 1 199 ? 70.814 70.534 140.017 1.00 17.53 ? 219 LEU A CD2 1 +ATOM 1631 N N . LEU A 1 200 ? 67.366 69.661 143.430 1.00 13.66 ? 220 LEU A N 1 +ATOM 1632 C CA . LEU A 1 200 ? 67.395 70.109 144.798 1.00 13.42 ? 220 LEU A CA 1 +ATOM 1633 C C . LEU A 1 200 ? 68.666 69.526 145.379 1.00 13.42 ? 220 LEU A C 1 +ATOM 1634 O O . LEU A 1 200 ? 69.038 68.392 145.061 1.00 14.04 ? 220 LEU A O 1 +ATOM 1635 C CB . LEU A 1 200 ? 66.185 69.579 145.565 1.00 13.31 ? 220 LEU A CB 1 +ATOM 1636 C CG . LEU A 1 200 ? 64.826 70.185 145.223 1.00 14.39 ? 220 LEU A CG 1 +ATOM 1637 C CD1 . LEU A 1 200 ? 63.693 69.230 145.637 1.00 14.89 ? 220 LEU A CD1 1 +ATOM 1638 C CD2 . LEU A 1 200 ? 64.673 71.567 145.872 1.00 15.24 ? 220 LEU A CD2 1 +ATOM 1639 N N . TYR A 1 201 ? 69.329 70.293 146.222 1.00 13.49 ? 221 TYR A N 1 +ATOM 1640 C CA . TYR A 1 201 ? 70.471 69.780 146.950 1.00 13.27 ? 221 TYR A CA 1 +ATOM 1641 C C . TYR A 1 201 ? 70.504 70.372 148.346 1.00 13.38 ? 221 TYR A C 1 +ATOM 1642 O O . TYR A 1 201 ? 69.829 71.367 148.636 1.00 14.19 ? 221 TYR A O 1 +ATOM 1643 C CB . TYR A 1 201 ? 71.761 70.024 146.164 1.00 13.24 ? 221 TYR A CB 1 +ATOM 1644 C CG . TYR A 1 201 ? 72.304 71.447 146.109 1.00 13.02 ? 221 TYR A CG 1 +ATOM 1645 C CD1 . TYR A 1 201 ? 73.235 71.879 147.046 1.00 14.17 ? 221 TYR A CD1 1 +ATOM 1646 C CD2 . TYR A 1 201 ? 71.954 72.322 145.085 1.00 14.26 ? 221 TYR A CD2 1 +ATOM 1647 C CE1 . TYR A 1 201 ? 73.769 73.143 147.005 1.00 14.88 ? 221 TYR A CE1 1 +ATOM 1648 C CE2 . TYR A 1 201 ? 72.488 73.609 145.032 1.00 14.08 ? 221 TYR A CE2 1 +ATOM 1649 C CZ . TYR A 1 201 ? 73.398 74.008 145.999 1.00 14.33 ? 221 TYR A CZ 1 +ATOM 1650 O OH . TYR A 1 201 ? 73.957 75.254 145.970 1.00 12.77 ? 221 TYR A OH 1 +ATOM 1651 N N . THR A 1 202 ? 71.251 69.738 149.234 1.00 13.03 ? 222 THR A N 1 +ATOM 1652 C CA . THR A 1 202 ? 71.343 70.225 150.595 1.00 12.86 ? 222 THR A CA 1 +ATOM 1653 C C . THR A 1 202 ? 72.777 70.512 151.006 1.00 12.29 ? 222 THR A C 1 +ATOM 1654 O O . THR A 1 202 ? 73.725 69.989 150.425 1.00 11.93 ? 222 THR A O 1 +ATOM 1655 C CB . THR A 1 202 ? 70.742 69.225 151.603 1.00 12.95 ? 222 THR A CB 1 +ATOM 1656 O OG1 . THR A 1 202 ? 71.557 68.040 151.662 1.00 13.29 ? 222 THR A OG1 1 +ATOM 1657 C CG2 . THR A 1 202 ? 69.305 68.878 151.220 1.00 13.82 ? 222 THR A CG2 1 +ATOM 1658 N N . THR A 1 203 ? 72.902 71.368 152.008 1.00 12.75 ? 223 THR A N 1 +ATOM 1659 C CA . THR A 1 203 ? 74.151 71.628 152.706 1.00 13.03 ? 223 THR A CA 1 +ATOM 1660 C C . THR A 1 203 ? 73.797 71.942 154.161 1.00 13.65 ? 223 THR A C 1 +ATOM 1661 O O . THR A 1 203 ? 72.615 72.083 154.499 1.00 13.57 ? 223 THR A O 1 +ATOM 1662 C CB . THR A 1 203 ? 74.889 72.841 152.129 1.00 13.25 ? 223 THR A CB 1 +ATOM 1663 O OG1 . THR A 1 203 ? 74.206 74.044 152.510 1.00 13.57 ? 223 THR A OG1 1 +ATOM 1664 C CG2 . THR A 1 203 ? 74.990 72.757 150.602 1.00 11.65 ? 223 THR A CG2 1 +ATOM 1665 N N . PRO A 1 204 ? 74.808 72.059 155.033 1.00 14.23 ? 224 PRO A N 1 +ATOM 1666 C CA . PRO A 1 204 ? 74.503 72.620 156.342 1.00 15.00 ? 224 PRO A CA 1 +ATOM 1667 C C . PRO A 1 204 ? 74.186 74.110 156.231 1.00 15.88 ? 224 PRO A C 1 +ATOM 1668 O O . PRO A 1 204 ? 74.390 74.718 155.175 1.00 16.32 ? 224 PRO A O 1 +ATOM 1669 C CB . PRO A 1 204 ? 75.798 72.390 157.138 1.00 14.96 ? 224 PRO A CB 1 +ATOM 1670 C CG . PRO A 1 204 ? 76.601 71.430 156.341 1.00 14.67 ? 224 PRO A CG 1 +ATOM 1671 C CD . PRO A 1 204 ? 76.230 71.709 154.921 1.00 14.23 ? 224 PRO A CD 1 +ATOM 1672 N N . THR A 1 205 ? 73.694 74.695 157.318 1.00 16.63 ? 225 THR A N 1 +ATOM 1673 C CA . THR A 1 205 ? 73.298 76.093 157.316 1.00 17.25 ? 225 THR A CA 1 +ATOM 1674 C C . THR A 1 205 ? 74.493 77.050 157.302 1.00 17.28 ? 225 THR A C 1 +ATOM 1675 O O . THR A 1 205 ? 74.378 78.197 156.860 1.00 17.38 ? 225 THR A O 1 +ATOM 1676 C CB . THR A 1 205 ? 72.382 76.385 158.507 1.00 17.28 ? 225 THR A CB 1 +ATOM 1677 O OG1 . THR A 1 205 ? 73.062 76.071 159.727 1.00 18.24 ? 225 THR A OG1 1 +ATOM 1678 C CG2 . THR A 1 205 ? 71.115 75.545 158.392 1.00 18.11 ? 225 THR A CG2 1 +ATOM 1679 N N . THR A 1 206 ? 75.634 76.573 157.800 1.00 17.49 ? 226 THR A N 1 +ATOM 1680 C CA . THR A 1 206 ? 76.925 77.195 157.554 1.00 17.87 ? 226 THR A CA 1 +ATOM 1681 C C . THR A 1 206 ? 77.687 76.279 156.599 1.00 17.53 ? 226 THR A C 1 +ATOM 1682 O O . THR A 1 206 ? 77.882 75.097 156.887 1.00 17.86 ? 226 THR A O 1 +ATOM 1683 C CB . THR A 1 206 ? 77.718 77.397 158.868 1.00 17.90 ? 226 THR A CB 1 +ATOM 1684 O OG1 . THR A 1 206 ? 77.028 78.337 159.702 1.00 19.36 ? 226 THR A OG1 1 +ATOM 1685 C CG2 . THR A 1 206 ? 79.122 77.906 158.591 1.00 18.84 ? 226 THR A CG2 1 +ATOM 1686 N N . TYR A 1 207 ? 78.109 76.832 155.465 1.00 17.37 ? 227 TYR A N 1 +ATOM 1687 C CA . TYR A 1 207 ? 78.578 76.032 154.333 1.00 17.25 ? 227 TYR A CA 1 +ATOM 1688 C C . TYR A 1 207 ? 79.622 76.744 153.484 1.00 16.73 ? 227 TYR A C 1 +ATOM 1689 O O . TYR A 1 207 ? 79.726 77.977 153.483 1.00 16.58 ? 227 TYR A O 1 +ATOM 1690 C CB . TYR A 1 207 ? 77.388 75.683 153.433 1.00 17.45 ? 227 TYR A CB 1 +ATOM 1691 C CG . TYR A 1 207 ? 76.672 76.902 152.911 1.00 17.95 ? 227 TYR A CG 1 +ATOM 1692 C CD1 . TYR A 1 207 ? 75.692 77.532 153.669 1.00 18.27 ? 227 TYR A CD1 1 +ATOM 1693 C CD2 . TYR A 1 207 ? 76.980 77.436 151.666 1.00 18.48 ? 227 TYR A CD2 1 +ATOM 1694 C CE1 . TYR A 1 207 ? 75.040 78.659 153.203 1.00 19.08 ? 227 TYR A CE1 1 +ATOM 1695 C CE2 . TYR A 1 207 ? 76.331 78.564 151.195 1.00 18.91 ? 227 TYR A CE2 1 +ATOM 1696 C CZ . TYR A 1 207 ? 75.363 79.168 151.968 1.00 18.71 ? 227 TYR A CZ 1 +ATOM 1697 O OH . TYR A 1 207 ? 74.698 80.282 151.508 1.00 19.84 ? 227 TYR A OH 1 +ATOM 1698 N N . ILE A 1 208 ? 80.373 75.939 152.744 1.00 16.23 ? 228 ILE A N 1 +ATOM 1699 C CA . ILE A 1 208 ? 81.344 76.429 151.762 1.00 15.95 ? 228 ILE A CA 1 +ATOM 1700 C C . ILE A 1 208 ? 80.569 77.013 150.586 1.00 15.88 ? 228 ILE A C 1 +ATOM 1701 O O . ILE A 1 208 ? 79.865 76.279 149.891 1.00 15.12 ? 228 ILE A O 1 +ATOM 1702 C CB . ILE A 1 208 ? 82.227 75.267 151.260 1.00 16.17 ? 228 ILE A CB 1 +ATOM 1703 C CG1 . ILE A 1 208 ? 83.013 74.643 152.426 1.00 15.65 ? 228 ILE A CG1 1 +ATOM 1704 C CG2 . ILE A 1 208 ? 83.176 75.741 150.164 1.00 16.42 ? 228 ILE A CG2 1 +ATOM 1705 C CD1 . ILE A 1 208 ? 83.416 73.179 152.201 1.00 17.16 ? 228 ILE A CD1 1 +ATOM 1706 N N . ASP A 1 209 ? 80.679 78.325 150.373 1.00 15.32 ? 229 ASP A N 1 +ATOM 1707 C CA . ASP A 1 209 ? 79.872 79.000 149.345 1.00 15.82 ? 229 ASP A CA 1 +ATOM 1708 C C . ASP A 1 209 ? 80.614 79.183 148.020 1.00 15.65 ? 229 ASP A C 1 +ATOM 1709 O O . ASP A 1 209 ? 80.017 79.071 146.954 1.00 15.56 ? 229 ASP A O 1 +ATOM 1710 C CB . ASP A 1 209 ? 79.392 80.364 149.837 1.00 16.05 ? 229 ASP A CB 1 +ATOM 1711 C CG . ASP A 1 209 ? 78.432 81.022 148.867 1.00 16.63 ? 229 ASP A CG 1 +ATOM 1712 O OD1 . ASP A 1 209 ? 77.282 80.561 148.769 1.00 18.72 ? 229 ASP A OD1 1 +ATOM 1713 O OD2 . ASP A 1 209 ? 78.825 82.006 148.203 1.00 18.83 ? 229 ASP A OD2 1 +ATOM 1714 N N . ASP A 1 210 ? 81.910 79.484 148.089 1.00 15.15 ? 230 ASP A N 1 +ATOM 1715 C CA . ASP A 1 210 ? 82.709 79.726 146.888 1.00 14.90 ? 230 ASP A CA 1 +ATOM 1716 C C . ASP A 1 210 ? 84.114 79.176 147.103 1.00 14.26 ? 230 ASP A C 1 +ATOM 1717 O O . ASP A 1 210 ? 84.588 79.077 148.236 1.00 14.17 ? 230 ASP A O 1 +ATOM 1718 C CB . ASP A 1 210 ? 82.776 81.234 146.607 1.00 14.75 ? 230 ASP A CB 1 +ATOM 1719 C CG . ASP A 1 210 ? 82.908 81.579 145.123 1.00 16.17 ? 230 ASP A CG 1 +ATOM 1720 O OD1 . ASP A 1 210 ? 83.263 80.724 144.279 1.00 15.59 ? 230 ASP A OD1 1 +ATOM 1721 O OD2 . ASP A 1 210 ? 82.648 82.755 144.804 1.00 18.70 ? 230 ASP A OD2 1 +ATOM 1722 N N . ILE A 1 211 ? 84.758 78.813 146.003 1.00 14.12 ? 231 ILE A N 1 +ATOM 1723 C CA . ILE A 1 211 ? 86.158 78.402 145.984 1.00 13.74 ? 231 ILE A CA 1 +ATOM 1724 C C . ILE A 1 211 ? 86.730 79.014 144.710 1.00 14.42 ? 231 ILE A C 1 +ATOM 1725 O O . ILE A 1 211 ? 86.072 79.009 143.661 1.00 13.30 ? 231 ILE A O 1 +ATOM 1726 C CB . ILE A 1 211 ? 86.312 76.846 145.912 1.00 13.94 ? 231 ILE A CB 1 +ATOM 1727 C CG1 . ILE A 1 211 ? 85.564 76.154 147.052 1.00 13.46 ? 231 ILE A CG1 1 +ATOM 1728 C CG2 . ILE A 1 211 ? 87.801 76.417 145.913 1.00 13.89 ? 231 ILE A CG2 1 +ATOM 1729 C CD1 . ILE A 1 211 ? 85.531 74.636 146.920 1.00 13.09 ? 231 ILE A CD1 1 +ATOM 1730 N N . THR A 1 212 ? 87.926 79.585 144.804 1.00 14.92 ? 232 THR A N 1 +ATOM 1731 C CA . THR A 1 212 ? 88.676 79.988 143.627 1.00 15.56 ? 232 THR A CA 1 +ATOM 1732 C C . THR A 1 212 ? 90.056 79.382 143.727 1.00 15.40 ? 232 THR A C 1 +ATOM 1733 O O . THR A 1 212 ? 90.739 79.583 144.727 1.00 15.84 ? 232 THR A O 1 +ATOM 1734 C CB . THR A 1 212 ? 88.831 81.501 143.525 1.00 15.71 ? 232 THR A CB 1 +ATOM 1735 O OG1 . THR A 1 212 ? 87.537 82.132 143.503 1.00 17.60 ? 232 THR A OG1 1 +ATOM 1736 C CG2 . THR A 1 212 ? 89.616 81.864 142.269 1.00 16.19 ? 232 THR A CG2 1 +ATOM 1737 N N . VAL A 1 213 ? 90.461 78.654 142.690 1.00 15.23 ? 233 VAL A N 1 +ATOM 1738 C CA . VAL A 1 213 ? 91.799 78.059 142.621 1.00 15.35 ? 233 VAL A CA 1 +ATOM 1739 C C . VAL A 1 213 ? 92.535 78.600 141.394 1.00 15.51 ? 233 VAL A C 1 +ATOM 1740 O O . VAL A 1 213 ? 91.964 78.684 140.315 1.00 15.10 ? 233 VAL A O 1 +ATOM 1741 C CB . VAL A 1 213 ? 91.723 76.520 142.541 1.00 15.61 ? 233 VAL A CB 1 +ATOM 1742 C CG1 . VAL A 1 213 ? 93.032 75.940 142.027 1.00 15.91 ? 233 VAL A CG1 1 +ATOM 1743 C CG2 . VAL A 1 213 ? 91.365 75.930 143.900 1.00 14.91 ? 233 VAL A CG2 1 +ATOM 1744 N N . THR A 1 214 ? 93.798 78.982 141.566 1.00 15.65 ? 234 THR A N 1 +ATOM 1745 C CA . THR A 1 214 ? 94.681 79.240 140.433 1.00 16.15 ? 234 THR A CA 1 +ATOM 1746 C C . THR A 1 214 ? 95.957 78.440 140.647 1.00 16.75 ? 234 THR A C 1 +ATOM 1747 O O . THR A 1 214 ? 96.313 78.119 141.781 1.00 16.57 ? 234 THR A O 1 +ATOM 1748 C CB . THR A 1 214 ? 95.037 80.731 140.264 1.00 16.35 ? 234 THR A CB 1 +ATOM 1749 O OG1 . THR A 1 214 ? 95.725 81.204 141.433 1.00 17.63 ? 234 THR A OG1 1 +ATOM 1750 C CG2 . THR A 1 214 ? 93.785 81.577 140.017 1.00 15.78 ? 234 THR A CG2 1 +ATOM 1751 N N . THR A 1 215 ? 96.629 78.107 139.554 1.00 17.22 ? 235 THR A N 1 +ATOM 1752 C CA . THR A 1 215 ? 97.763 77.194 139.609 1.00 18.06 ? 235 THR A CA 1 +ATOM 1753 C C . THR A 1 215 ? 98.938 77.725 138.799 1.00 18.95 ? 235 THR A C 1 +ATOM 1754 O O . THR A 1 215 ? 98.773 78.343 137.748 1.00 18.78 ? 235 THR A O 1 +ATOM 1755 C CB . THR A 1 215 ? 97.392 75.786 139.094 1.00 17.75 ? 235 THR A CB 1 +ATOM 1756 O OG1 . THR A 1 215 ? 97.074 75.844 137.698 1.00 17.38 ? 235 THR A OG1 1 +ATOM 1757 C CG2 . THR A 1 215 ? 96.198 75.211 139.865 1.00 18.25 ? 235 THR A CG2 1 +ATOM 1758 N N . SER A 1 216 ? 100.133 77.483 139.318 1.00 20.12 ? 236 SER A N 1 +ATOM 1759 C CA . SER A 1 216 ? 101.360 77.878 138.653 1.00 20.76 ? 236 SER A CA 1 +ATOM 1760 C C . SER A 1 216 ? 102.429 76.862 138.993 1.00 21.77 ? 236 SER A C 1 +ATOM 1761 O O . SER A 1 216 ? 102.208 75.960 139.801 1.00 21.47 ? 236 SER A O 1 +ATOM 1762 C CB . SER A 1 216 ? 101.783 79.269 139.115 1.00 20.71 ? 236 SER A CB 1 +ATOM 1763 O OG . SER A 1 216 ? 102.047 79.265 140.506 1.00 20.15 ? 236 SER A OG 1 +ATOM 1764 N N . VAL A 1 217 ? 103.589 77.024 138.371 1.00 23.53 ? 237 VAL A N 1 +ATOM 1765 C CA . VAL A 1 217 ? 104.663 76.056 138.432 1.00 24.63 ? 237 VAL A CA 1 +ATOM 1766 C C . VAL A 1 217 ? 105.911 76.777 138.906 1.00 26.10 ? 237 VAL A C 1 +ATOM 1767 O O . VAL A 1 217 ? 106.143 77.924 138.522 1.00 26.06 ? 237 VAL A O 1 +ATOM 1768 C CB . VAL A 1 217 ? 104.919 75.462 137.036 1.00 24.94 ? 237 VAL A CB 1 +ATOM 1769 C CG1 . VAL A 1 217 ? 106.040 74.434 137.071 1.00 25.51 ? 237 VAL A CG1 1 +ATOM 1770 C CG2 . VAL A 1 217 ? 103.624 74.850 136.473 1.00 25.13 ? 237 VAL A CG2 1 +ATOM 1771 N N . GLU A 1 218 ? 106.682 76.122 139.768 1.00 27.54 ? 238 GLU A N 1 +ATOM 1772 C CA . GLU A 1 218 ? 108.006 76.607 140.156 1.00 29.03 ? 238 GLU A CA 1 +ATOM 1773 C C . GLU A 1 218 ? 108.994 75.471 140.021 1.00 29.69 ? 238 GLU A C 1 +ATOM 1774 O O . GLU A 1 218 ? 108.938 74.505 140.779 1.00 29.77 ? 238 GLU A O 1 +ATOM 1775 C CB . GLU A 1 218 ? 108.017 77.136 141.588 1.00 29.35 ? 238 GLU A CB 1 +ATOM 1776 C CG . GLU A 1 218 ? 107.645 78.593 141.704 1.00 31.12 ? 238 GLU A CG 1 +ATOM 1777 C CD . GLU A 1 218 ? 108.340 79.277 142.858 1.00 32.77 ? 238 GLU A CD 1 +ATOM 1778 O OE1 . GLU A 1 218 ? 109.559 79.528 142.741 1.00 34.69 ? 238 GLU A OE1 1 +ATOM 1779 O OE2 . GLU A 1 218 ? 107.671 79.562 143.874 1.00 34.32 ? 238 GLU A OE2 1 +ATOM 1780 N N . GLN A 1 219 ? 109.897 75.600 139.052 1.00 30.60 ? 239 GLN A N 1 +ATOM 1781 C CA . GLN A 1 219 ? 110.820 74.531 138.697 1.00 31.21 ? 239 GLN A CA 1 +ATOM 1782 C C . GLN A 1 219 ? 110.058 73.209 138.501 1.00 31.21 ? 239 GLN A C 1 +ATOM 1783 O O . GLN A 1 219 ? 109.442 72.997 137.454 1.00 31.53 ? 239 GLN A O 1 +ATOM 1784 C CB . GLN A 1 219 ? 111.946 74.409 139.742 1.00 31.59 ? 239 GLN A CB 1 +ATOM 1785 C CG . GLN A 1 219 ? 112.804 75.671 139.899 1.00 32.80 ? 239 GLN A CG 1 +ATOM 1786 C CD . GLN A 1 219 ? 112.181 76.717 140.823 1.00 34.40 ? 239 GLN A CD 1 +ATOM 1787 O OE1 . GLN A 1 219 ? 111.783 76.414 141.951 1.00 35.86 ? 239 GLN A OE1 1 +ATOM 1788 N NE2 . GLN A 1 219 ? 112.103 77.956 140.347 1.00 35.32 ? 239 GLN A NE2 1 +ATOM 1789 N N . ASP A 1 220 ? 110.065 72.358 139.524 1.00 30.73 ? 240 ASP A N 1 +ATOM 1790 C CA . ASP A 1 220 ? 109.545 70.999 139.439 1.00 30.71 ? 240 ASP A CA 1 +ATOM 1791 C C . ASP A 1 220 ? 108.295 70.856 140.316 1.00 29.70 ? 240 ASP A C 1 +ATOM 1792 O O . ASP A 1 220 ? 107.734 69.767 140.433 1.00 29.49 ? 240 ASP A O 1 +ATOM 1793 C CB . ASP A 1 220 ? 110.633 70.030 139.935 1.00 31.13 ? 240 ASP A CB 1 +ATOM 1794 C CG . ASP A 1 220 ? 110.860 68.850 139.004 1.00 32.69 ? 240 ASP A CG 1 +ATOM 1795 O OD1 . ASP A 1 220 ? 110.748 69.016 137.769 1.00 34.89 ? 240 ASP A OD1 1 +ATOM 1796 O OD2 . ASP A 1 220 ? 111.199 67.759 139.518 1.00 34.83 ? 240 ASP A OD2 1 +ATOM 1797 N N . SER A 1 221 ? 107.876 71.962 140.933 1.00 28.80 ? 241 SER A N 1 +ATOM 1798 C CA . SER A 1 221 ? 106.818 71.946 141.933 1.00 28.08 ? 241 SER A CA 1 +ATOM 1799 C C . SER A 1 221 ? 105.574 72.630 141.402 1.00 27.10 ? 241 SER A C 1 +ATOM 1800 O O . SER A 1 221 ? 105.665 73.596 140.649 1.00 27.00 ? 241 SER A O 1 +ATOM 1801 C CB . SER A 1 221 ? 107.275 72.645 143.220 1.00 28.34 ? 241 SER A CB 1 +ATOM 1802 O OG . SER A 1 221 ? 108.030 71.765 144.034 1.00 28.84 ? 241 SER A OG 1 +ATOM 1803 N N . GLY A 1 222 ? 104.415 72.131 141.816 1.00 25.87 ? 242 GLY A N 1 +ATOM 1804 C CA . GLY A 1 222 ? 103.151 72.777 141.498 1.00 25.15 ? 242 GLY A CA 1 +ATOM 1805 C C . GLY A 1 222 ? 102.756 73.686 142.638 1.00 24.00 ? 242 GLY A C 1 +ATOM 1806 O O . GLY A 1 222 ? 102.992 73.367 143.795 1.00 23.82 ? 242 GLY A O 1 +ATOM 1807 N N . LEU A 1 223 ? 102.169 74.832 142.323 1.00 23.26 ? 243 LEU A N 1 +ATOM 1808 C CA . LEU A 1 223 ? 101.615 75.695 143.352 1.00 22.48 ? 243 LEU A CA 1 +ATOM 1809 C C . LEU A 1 223 ? 100.119 75.790 143.141 1.00 22.12 ? 243 LEU A C 1 +ATOM 1810 O O . LEU A 1 223 ? 99.678 76.066 142.029 1.00 22.09 ? 243 LEU A O 1 +ATOM 1811 C CB . LEU A 1 223 ? 102.252 77.080 143.291 1.00 22.75 ? 243 LEU A CB 1 +ATOM 1812 C CG . LEU A 1 223 ? 103.758 77.108 143.543 1.00 23.26 ? 243 LEU A CG 1 +ATOM 1813 C CD1 . LEU A 1 223 ? 104.312 78.459 143.124 1.00 23.70 ? 243 LEU A CD1 1 +ATOM 1814 C CD2 . LEU A 1 223 ? 104.072 76.827 144.995 1.00 24.68 ? 243 LEU A CD2 1 +ATOM 1815 N N . VAL A 1 224 ? 99.351 75.559 144.207 1.00 21.34 ? 244 VAL A N 1 +ATOM 1816 C CA . VAL A 1 224 ? 97.898 75.656 144.155 1.00 20.75 ? 244 VAL A CA 1 +ATOM 1817 C C . VAL A 1 224 ? 97.447 76.716 145.146 1.00 20.46 ? 244 VAL A C 1 +ATOM 1818 O O . VAL A 1 224 ? 97.539 76.541 146.365 1.00 19.73 ? 244 VAL A O 1 +ATOM 1819 C CB . VAL A 1 224 ? 97.208 74.310 144.459 1.00 21.22 ? 244 VAL A CB 1 +ATOM 1820 C CG1 . VAL A 1 224 ? 95.686 74.435 144.258 1.00 20.57 ? 244 VAL A CG1 1 +ATOM 1821 C CG2 . VAL A 1 224 ? 97.785 73.212 143.589 1.00 20.76 ? 244 VAL A CG2 1 +ATOM 1822 N N . ASN A 1 225 ? 96.979 77.831 144.600 1.00 20.07 ? 245 ASN A N 1 +ATOM 1823 C CA . ASN A 1 225 ? 96.533 78.963 145.388 1.00 19.90 ? 245 ASN A CA 1 +ATOM 1824 C C . ASN A 1 225 ? 95.021 78.960 145.558 1.00 20.02 ? 245 ASN A C 1 +ATOM 1825 O O . ASN A 1 225 ? 94.288 79.128 144.588 1.00 20.29 ? 245 ASN A O 1 +ATOM 1826 C CB . ASN A 1 225 ? 97.020 80.236 144.728 1.00 20.45 ? 245 ASN A CB 1 +ATOM 1827 C CG . ASN A 1 225 ? 98.539 80.302 144.690 1.00 20.91 ? 245 ASN A CG 1 +ATOM 1828 O OD1 . ASN A 1 225 ? 99.146 81.026 145.464 1.00 25.55 ? 245 ASN A OD1 1 +ATOM 1829 N ND2 . ASN A 1 225 ? 99.152 79.491 143.837 1.00 24.20 ? 245 ASN A ND2 1 +ATOM 1830 N N . TYR A 1 226 ? 94.563 78.751 146.792 1.00 19.86 ? 246 TYR A N 1 +ATOM 1831 C CA . TYR A 1 226 ? 93.131 78.625 147.067 1.00 19.74 ? 246 TYR A CA 1 +ATOM 1832 C C . TYR A 1 226 ? 92.579 79.802 147.852 1.00 19.43 ? 246 TYR A C 1 +ATOM 1833 O O . TYR A 1 226 ? 93.282 80.450 148.629 1.00 18.41 ? 246 TYR A O 1 +ATOM 1834 C CB . TYR A 1 226 ? 92.812 77.315 147.801 1.00 20.22 ? 246 TYR A CB 1 +ATOM 1835 C CG . TYR A 1 226 ? 93.513 77.132 149.133 1.00 21.08 ? 246 TYR A CG 1 +ATOM 1836 C CD1 . TYR A 1 226 ? 92.919 77.551 150.321 1.00 21.46 ? 246 TYR A CD1 1 +ATOM 1837 C CD2 . TYR A 1 226 ? 94.763 76.530 149.202 1.00 21.29 ? 246 TYR A CD2 1 +ATOM 1838 C CE1 . TYR A 1 226 ? 93.561 77.380 151.550 1.00 21.47 ? 246 TYR A CE1 1 +ATOM 1839 C CE2 . TYR A 1 226 ? 95.418 76.361 150.426 1.00 20.91 ? 246 TYR A CE2 1 +ATOM 1840 C CZ . TYR A 1 226 ? 94.808 76.783 151.590 1.00 21.32 ? 246 TYR A CZ 1 +ATOM 1841 O OH . TYR A 1 226 ? 95.445 76.614 152.798 1.00 22.11 ? 246 TYR A OH 1 +ATOM 1842 N N . GLN A 1 227 ? 91.301 80.069 147.614 1.00 19.11 ? 247 GLN A N 1 +ATOM 1843 C CA . GLN A 1 227 ? 90.547 81.087 148.327 1.00 19.76 ? 247 GLN A CA 1 +ATOM 1844 C C . GLN A 1 227 ? 89.178 80.476 148.525 1.00 19.49 ? 247 GLN A C 1 +ATOM 1845 O O . GLN A 1 227 ? 88.573 80.009 147.552 1.00 19.62 ? 247 GLN A O 1 +ATOM 1846 C CB . GLN A 1 227 ? 90.425 82.368 147.501 1.00 19.71 ? 247 GLN A CB 1 +ATOM 1847 C CG . GLN A 1 227 ? 91.769 82.973 147.115 1.00 21.45 ? 247 GLN A CG 1 +ATOM 1848 C CD . GLN A 1 227 ? 91.657 84.191 146.211 1.00 21.25 ? 247 GLN A CD 1 +ATOM 1849 O OE1 . GLN A 1 227 ? 90.566 84.626 145.847 1.00 25.38 ? 247 GLN A OE1 1 +ATOM 1850 N NE2 . GLN A 1 227 ? 92.801 84.736 145.833 1.00 24.41 ? 247 GLN A NE2 1 +ATOM 1851 N N . ILE A 1 228 ? 88.704 80.467 149.770 1.00 19.57 ? 248 ILE A N 1 +ATOM 1852 C CA . ILE A 1 228 ? 87.425 79.861 150.118 1.00 19.43 ? 248 ILE A CA 1 +ATOM 1853 C C . ILE A 1 228 ? 86.519 80.876 150.821 1.00 20.11 ? 248 ILE A C 1 +ATOM 1854 O O . ILE A 1 228 ? 86.971 81.651 151.661 1.00 19.75 ? 248 ILE A O 1 +ATOM 1855 C CB . ILE A 1 228 ? 87.630 78.628 151.032 1.00 19.60 ? 248 ILE A CB 1 +ATOM 1856 C CG1 . ILE A 1 228 ? 88.540 77.590 150.359 1.00 18.87 ? 248 ILE A CG1 1 +ATOM 1857 C CG2 . ILE A 1 228 ? 86.291 77.992 151.376 1.00 18.04 ? 248 ILE A CG2 1 +ATOM 1858 C CD1 . ILE A 1 228 ? 89.224 76.647 151.323 1.00 18.23 ? 248 ILE A CD1 1 +ATOM 1859 N N . SER A 1 229 ? 85.238 80.873 150.460 1.00 20.48 ? 249 SER A N 1 +ATOM 1860 C CA . SER A 1 229 ? 84.247 81.718 151.103 1.00 21.10 ? 249 SER A CA 1 +ATOM 1861 C C . SER A 1 229 ? 83.228 80.833 151.819 1.00 21.06 ? 249 SER A C 1 +ATOM 1862 O O . SER A 1 229 ? 82.704 79.882 151.229 1.00 20.73 ? 249 SER A O 1 +ATOM 1863 C CB . SER A 1 229 ? 83.539 82.586 150.068 1.00 21.60 ? 249 SER A CB 1 +ATOM 1864 O OG . SER A 1 229 ? 82.541 81.841 149.394 1.00 23.84 ? 249 SER A OG 1 +ATOM 1865 N N . VAL A 1 230 ? 82.965 81.151 153.084 1.00 20.74 ? 250 VAL A N 1 +ATOM 1866 C CA . VAL A 1 230 ? 81.979 80.450 153.897 1.00 20.98 ? 250 VAL A CA 1 +ATOM 1867 C C . VAL A 1 230 ? 80.838 81.407 154.248 1.00 21.47 ? 250 VAL A C 1 +ATOM 1868 O O . VAL A 1 230 ? 81.075 82.571 154.574 1.00 21.09 ? 250 VAL A O 1 +ATOM 1869 C CB . VAL A 1 230 ? 82.620 79.933 155.188 1.00 20.62 ? 250 VAL A CB 1 +ATOM 1870 C CG1 . VAL A 1 230 ? 81.629 79.086 155.989 1.00 20.64 ? 250 VAL A CG1 1 +ATOM 1871 C CG2 . VAL A 1 230 ? 83.853 79.142 154.868 1.00 20.31 ? 250 VAL A CG2 1 +ATOM 1872 N N . LYS A 1 231 ? 79.597 80.936 154.133 1.00 22.13 ? 251 LYS A N 1 +ATOM 1873 C CA . LYS A 1 231 ? 78.431 81.730 154.531 1.00 22.75 ? 251 LYS A CA 1 +ATOM 1874 C C . LYS A 1 231 ? 77.740 81.027 155.691 1.00 23.64 ? 251 LYS A C 1 +ATOM 1875 O O . LYS A 1 231 ? 77.838 79.804 155.836 1.00 23.11 ? 251 LYS A O 1 +ATOM 1876 C CB . LYS A 1 231 ? 77.447 81.909 153.370 1.00 22.97 ? 251 LYS A CB 1 +ATOM 1877 C CG . LYS A 1 231 ? 77.897 82.890 152.307 1.00 23.50 ? 251 LYS A CG 1 +ATOM 1878 C CD . LYS A 1 231 ? 76.729 83.324 151.444 1.00 25.19 ? 251 LYS A CD 1 +ATOM 1879 C CE . LYS A 1 231 ? 77.136 84.344 150.397 1.00 26.03 ? 251 LYS A CE 1 +ATOM 1880 N NZ . LYS A 1 231 ? 75.949 84.789 149.615 1.00 27.59 ? 251 LYS A NZ 1 +ATOM 1881 N N . GLY A 1 232 ? 77.031 81.811 156.496 1.00 24.87 ? 252 GLY A N 1 +ATOM 1882 C CA . GLY A 1 232 ? 76.407 81.330 157.723 1.00 26.24 ? 252 GLY A CA 1 +ATOM 1883 C C . GLY A 1 232 ? 77.157 81.901 158.905 1.00 27.44 ? 252 GLY A C 1 +ATOM 1884 O O . GLY A 1 232 ? 77.408 83.113 158.966 1.00 27.92 ? 252 GLY A O 1 +ATOM 1885 N N . SER A 1 233 ? 77.554 81.033 159.828 1.00 28.65 ? 253 SER A N 1 +ATOM 1886 C CA . SER A 1 233 ? 78.281 81.463 161.018 1.00 29.31 ? 253 SER A CA 1 +ATOM 1887 C C . SER A 1 233 ? 79.604 82.142 160.689 1.00 29.66 ? 253 SER A C 1 +ATOM 1888 O O . SER A 1 233 ? 80.173 81.942 159.617 1.00 29.82 ? 253 SER A O 1 +ATOM 1889 C CB . SER A 1 233 ? 78.557 80.277 161.935 1.00 29.51 ? 253 SER A CB 1 +ATOM 1890 O OG . SER A 1 233 ? 79.409 80.660 163.004 1.00 30.09 ? 253 SER A OG 1 +ATOM 1891 N N . ASN A 1 234 ? 80.083 82.929 161.650 1.00 30.20 ? 254 ASN A N 1 +ATOM 1892 C CA . ASN A 1 234 ? 81.325 83.684 161.533 1.00 30.43 ? 254 ASN A CA 1 +ATOM 1893 C C . ASN A 1 234 ? 82.502 82.930 162.157 1.00 30.04 ? 254 ASN A C 1 +ATOM 1894 O O . ASN A 1 234 ? 83.654 83.175 161.803 1.00 30.12 ? 254 ASN A O 1 +ATOM 1895 C CB . ASN A 1 234 ? 81.168 85.050 162.223 1.00 30.73 ? 254 ASN A CB 1 +ATOM 1896 C CG . ASN A 1 234 ? 81.521 86.212 161.312 1.00 32.01 ? 254 ASN A CG 1 +ATOM 1897 O OD1 . ASN A 1 234 ? 80.796 86.510 160.356 1.00 33.71 ? 254 ASN A OD1 1 +ATOM 1898 N ND2 . ASN A 1 234 ? 82.627 86.890 161.615 1.00 33.20 ? 254 ASN A ND2 1 +ATOM 1899 N N . LEU A 1 235 ? 82.201 82.029 163.096 1.00 29.74 ? 255 LEU A N 1 +ATOM 1900 C CA . LEU A 1 235 ? 83.213 81.214 163.774 1.00 29.54 ? 255 LEU A CA 1 +ATOM 1901 C C . LEU A 1 235 ? 83.341 79.848 163.108 1.00 28.88 ? 255 LEU A C 1 +ATOM 1902 O O . LEU A 1 235 ? 82.414 79.039 163.156 1.00 28.72 ? 255 LEU A O 1 +ATOM 1903 C CB . LEU A 1 235 ? 82.856 81.024 165.262 1.00 29.70 ? 255 LEU A CB 1 +ATOM 1904 C CG . LEU A 1 235 ? 83.446 82.026 166.268 1.00 30.24 ? 255 LEU A CG 1 +ATOM 1905 C CD1 . LEU A 1 235 ? 84.944 81.786 166.453 1.00 30.79 ? 255 LEU A CD1 1 +ATOM 1906 C CD2 . LEU A 1 235 ? 83.181 83.470 165.849 1.00 29.82 ? 255 LEU A CD2 1 +ATOM 1907 N N . PHE A 1 236 ? 84.493 79.597 162.495 1.00 27.99 ? 256 PHE A N 1 +ATOM 1908 C CA . PHE A 1 236 ? 84.760 78.320 161.850 1.00 27.49 ? 256 PHE A CA 1 +ATOM 1909 C C . PHE A 1 236 ? 86.250 78.137 161.591 1.00 27.40 ? 256 PHE A C 1 +ATOM 1910 O O . PHE A 1 236 ? 87.030 79.083 161.717 1.00 27.62 ? 256 PHE A O 1 +ATOM 1911 C CB . PHE A 1 236 ? 83.994 78.229 160.521 1.00 27.18 ? 256 PHE A CB 1 +ATOM 1912 C CG . PHE A 1 236 ? 84.422 79.252 159.507 1.00 26.47 ? 256 PHE A CG 1 +ATOM 1913 C CD1 . PHE A 1 236 ? 83.743 80.454 159.386 1.00 25.65 ? 256 PHE A CD1 1 +ATOM 1914 C CD2 . PHE A 1 236 ? 85.520 79.015 158.684 1.00 25.77 ? 256 PHE A CD2 1 +ATOM 1915 C CE1 . PHE A 1 236 ? 84.141 81.399 158.466 1.00 25.51 ? 256 PHE A CE1 1 +ATOM 1916 C CE2 . PHE A 1 236 ? 85.927 79.960 157.761 1.00 26.15 ? 256 PHE A CE2 1 +ATOM 1917 C CZ . PHE A 1 236 ? 85.238 81.151 157.651 1.00 26.41 ? 256 PHE A CZ 1 +ATOM 1918 N N . LYS A 1 237 ? 86.635 76.917 161.224 1.00 27.03 ? 257 LYS A N 1 +ATOM 1919 C CA . LYS A 1 237 ? 87.975 76.653 160.695 1.00 26.72 ? 257 LYS A CA 1 +ATOM 1920 C C . LYS A 1 237 ? 87.883 75.764 159.455 1.00 26.05 ? 257 LYS A C 1 +ATOM 1921 O O . LYS A 1 237 ? 86.952 74.969 159.311 1.00 25.96 ? 257 LYS A O 1 +ATOM 1922 C CB . LYS A 1 237 ? 88.883 76.017 161.750 1.00 26.84 ? 257 LYS A CB 1 +ATOM 1923 C CG . LYS A 1 237 ? 88.323 74.749 162.362 1.00 27.38 ? 257 LYS A CG 1 +ATOM 1924 C CD . LYS A 1 237 ? 89.395 73.863 163.006 1.00 28.87 ? 257 LYS A CD 1 +ATOM 1925 C CE . LYS A 1 237 ? 88.911 72.413 163.126 1.00 29.07 ? 257 LYS A CE 1 +ATOM 1926 N NZ . LYS A 1 237 ? 89.957 71.496 163.663 1.00 30.38 ? 257 LYS A NZ 1 +ATOM 1927 N N . LEU A 1 238 ? 88.855 75.919 158.561 1.00 25.43 ? 258 LEU A N 1 +ATOM 1928 C CA . LEU A 1 238 ? 88.897 75.169 157.310 1.00 25.20 ? 258 LEU A CA 1 +ATOM 1929 C C . LEU A 1 238 ? 90.144 74.305 157.273 1.00 24.76 ? 258 LEU A C 1 +ATOM 1930 O O . LEU A 1 238 ? 91.199 74.702 157.756 1.00 24.71 ? 258 LEU A O 1 +ATOM 1931 C CB . LEU A 1 238 ? 88.904 76.135 156.120 1.00 25.09 ? 258 LEU A CB 1 +ATOM 1932 C CG . LEU A 1 238 ? 87.539 76.711 155.731 1.00 25.39 ? 258 LEU A CG 1 +ATOM 1933 C CD1 . LEU A 1 238 ? 87.677 78.023 154.976 1.00 24.11 ? 258 LEU A CD1 1 +ATOM 1934 C CD2 . LEU A 1 238 ? 86.765 75.681 154.904 1.00 24.64 ? 258 LEU A CD2 1 +ATOM 1935 N N . GLU A 1 239 ? 90.000 73.109 156.719 1.00 24.74 ? 259 GLU A N 1 +ATOM 1936 C CA . GLU A 1 239 ? 91.128 72.265 156.379 1.00 24.75 ? 259 GLU A CA 1 +ATOM 1937 C C . GLU A 1 239 ? 91.032 72.040 154.884 1.00 24.74 ? 259 GLU A C 1 +ATOM 1938 O O . GLU A 1 239 ? 89.930 71.871 154.354 1.00 24.99 ? 259 GLU A O 1 +ATOM 1939 C CB . GLU A 1 239 ? 91.044 70.926 157.100 1.00 24.89 ? 259 GLU A CB 1 +ATOM 1940 C CG . GLU A 1 239 ? 91.218 70.990 158.601 1.00 25.75 ? 259 GLU A CG 1 +ATOM 1941 C CD . GLU A 1 239 ? 90.771 69.699 159.274 1.00 27.26 ? 259 GLU A CD 1 +ATOM 1942 O OE1 . GLU A 1 239 ? 91.524 68.699 159.221 1.00 27.33 ? 259 GLU A OE1 1 +ATOM 1943 O OE2 . GLU A 1 239 ? 89.654 69.683 159.839 1.00 29.19 ? 259 GLU A OE2 1 +ATOM 1944 N N . VAL A 1 240 ? 92.174 72.060 154.205 1.00 24.23 ? 260 VAL A N 1 +ATOM 1945 C CA . VAL A 1 240 ? 92.226 71.814 152.772 1.00 24.02 ? 260 VAL A CA 1 +ATOM 1946 C C . VAL A 1 240 ? 93.320 70.795 152.494 1.00 23.67 ? 260 VAL A C 1 +ATOM 1947 O O . VAL A 1 240 ? 94.426 70.910 153.024 1.00 23.58 ? 260 VAL A O 1 +ATOM 1948 C CB . VAL A 1 240 ? 92.492 73.121 151.985 1.00 24.07 ? 260 VAL A CB 1 +ATOM 1949 C CG1 . VAL A 1 240 ? 92.450 72.871 150.499 1.00 24.41 ? 260 VAL A CG1 1 +ATOM 1950 C CG2 . VAL A 1 240 ? 91.467 74.191 152.372 1.00 23.75 ? 260 VAL A CG2 1 +ATOM 1951 N N . ARG A 1 241 ? 92.991 69.789 151.690 1.00 23.41 ? 261 ARG A N 1 +ATOM 1952 C CA . ARG A 1 241 ? 93.937 68.751 151.284 1.00 23.45 ? 261 ARG A CA 1 +ATOM 1953 C C . ARG A 1 241 ? 93.891 68.553 149.775 1.00 22.93 ? 261 ARG A C 1 +ATOM 1954 O O . ARG A 1 241 ? 92.811 68.534 149.174 1.00 22.76 ? 261 ARG A O 1 +ATOM 1955 C CB . ARG A 1 241 ? 93.621 67.422 151.973 1.00 23.30 ? 261 ARG A CB 1 +ATOM 1956 C CG . ARG A 1 241 ? 93.732 67.451 153.488 1.00 24.09 ? 261 ARG A CG 1 +ATOM 1957 C CD . ARG A 1 241 ? 93.273 66.125 154.113 1.00 24.55 ? 261 ARG A CD 1 +ATOM 1958 N NE . ARG A 1 241 ? 91.819 65.984 154.119 1.00 25.13 ? 261 ARG A NE 1 +ATOM 1959 C CZ . ARG A 1 241 ? 90.994 66.638 154.938 1.00 26.24 ? 261 ARG A CZ 1 +ATOM 1960 N NH1 . ARG A 1 241 ? 91.460 67.510 155.833 1.00 27.38 ? 261 ARG A NH1 1 +ATOM 1961 N NH2 . ARG A 1 241 ? 89.684 66.427 154.863 1.00 26.71 ? 261 ARG A NH2 1 +ATOM 1962 N N . LEU A 1 242 ? 95.066 68.423 149.164 1.00 22.41 ? 262 LEU A N 1 +ATOM 1963 C CA . LEU A 1 242 ? 95.162 68.076 147.753 1.00 22.24 ? 262 LEU A CA 1 +ATOM 1964 C C . LEU A 1 242 ? 95.500 66.602 147.631 1.00 22.37 ? 262 LEU A C 1 +ATOM 1965 O O . LEU A 1 242 ? 96.499 66.140 148.182 1.00 21.84 ? 262 LEU A O 1 +ATOM 1966 C CB . LEU A 1 242 ? 96.228 68.908 147.028 1.00 21.96 ? 262 LEU A CB 1 +ATOM 1967 C CG . LEU A 1 242 ? 96.135 68.824 145.496 1.00 21.78 ? 262 LEU A CG 1 +ATOM 1968 C CD1 . LEU A 1 242 ? 94.907 69.574 144.990 1.00 20.53 ? 262 LEU A CD1 1 +ATOM 1969 C CD2 . LEU A 1 242 ? 97.390 69.349 144.820 1.00 21.44 ? 262 LEU A CD2 1 +ATOM 1970 N N . LEU A 1 243 ? 94.668 65.880 146.885 1.00 22.46 ? 263 LEU A N 1 +ATOM 1971 C CA . LEU A 1 243 ? 94.840 64.452 146.662 1.00 22.96 ? 263 LEU A CA 1 +ATOM 1972 C C . LEU A 1 243 ? 95.221 64.190 145.211 1.00 23.32 ? 263 LEU A C 1 +ATOM 1973 O O . LEU A 1 243 ? 94.695 64.836 144.287 1.00 22.99 ? 263 LEU A O 1 +ATOM 1974 C CB . LEU A 1 243 ? 93.552 63.705 147.006 1.00 22.98 ? 263 LEU A CB 1 +ATOM 1975 C CG . LEU A 1 243 ? 93.321 63.407 148.488 1.00 24.43 ? 263 LEU A CG 1 +ATOM 1976 C CD1 . LEU A 1 243 ? 93.261 64.668 149.330 1.00 24.82 ? 263 LEU A CD1 1 +ATOM 1977 C CD2 . LEU A 1 243 ? 92.043 62.606 148.647 1.00 25.03 ? 263 LEU A CD2 1 +ATOM 1978 N N . ASP A 1 244 ? 96.142 63.251 145.012 1.00 23.61 ? 264 ASP A N 1 +ATOM 1979 C CA . ASP A 1 244 ? 96.568 62.873 143.673 1.00 24.61 ? 264 ASP A CA 1 +ATOM 1980 C C . ASP A 1 244 ? 95.529 61.946 143.035 1.00 25.35 ? 264 ASP A C 1 +ATOM 1981 O O . ASP A 1 244 ? 94.486 61.673 143.638 1.00 25.51 ? 264 ASP A O 1 +ATOM 1982 C CB . ASP A 1 244 ? 97.974 62.242 143.698 1.00 24.61 ? 264 ASP A CB 1 +ATOM 1983 C CG . ASP A 1 244 ? 98.003 60.852 144.332 1.00 25.10 ? 264 ASP A CG 1 +ATOM 1984 O OD1 . ASP A 1 244 ? 96.955 60.364 144.793 1.00 25.19 ? 264 ASP A OD1 1 +ATOM 1985 O OD2 . ASP A 1 244 ? 99.098 60.246 144.368 1.00 26.11 ? 264 ASP A OD2 1 +ATOM 1986 N N . ALA A 1 245 ? 95.815 61.467 141.828 1.00 26.28 ? 265 ALA A N 1 +ATOM 1987 C CA . ALA A 1 245 ? 94.860 60.653 141.067 1.00 27.22 ? 265 ALA A CA 1 +ATOM 1988 C C . ALA A 1 245 ? 94.562 59.306 141.714 1.00 28.22 ? 265 ALA A C 1 +ATOM 1989 O O . ALA A 1 245 ? 93.553 58.688 141.391 1.00 28.33 ? 265 ALA A O 1 +ATOM 1990 C CB . ALA A 1 245 ? 95.359 60.448 139.643 1.00 27.23 ? 265 ALA A CB 1 +ATOM 1991 N N . GLU A 1 246 ? 95.437 58.855 142.614 1.00 29.29 ? 266 GLU A N 1 +ATOM 1992 C CA . GLU A 1 246 ? 95.222 57.617 143.370 1.00 30.29 ? 266 GLU A CA 1 +ATOM 1993 C C . GLU A 1 246 ? 94.663 57.892 144.772 1.00 30.51 ? 266 GLU A C 1 +ATOM 1994 O O . GLU A 1 246 ? 94.629 56.996 145.616 1.00 30.91 ? 266 GLU A O 1 +ATOM 1995 C CB . GLU A 1 246 ? 96.526 56.821 143.470 1.00 30.59 ? 266 GLU A CB 1 +ATOM 1996 C CG . GLU A 1 246 ? 97.124 56.415 142.121 1.00 31.75 ? 266 GLU A CG 1 +ATOM 1997 C CD . GLU A 1 246 ? 98.006 57.489 141.488 1.00 32.86 ? 266 GLU A CD 1 +ATOM 1998 O OE1 . GLU A 1 246 ? 98.855 58.084 142.191 1.00 34.45 ? 266 GLU A OE1 1 +ATOM 1999 O OE2 . GLU A 1 246 ? 97.865 57.726 140.270 1.00 34.42 ? 266 GLU A OE2 1 +ATOM 2000 N N . ASN A 1 247 ? 94.237 59.135 145.002 1.00 30.58 ? 267 ASN A N 1 +ATOM 2001 C CA . ASN A 1 247 ? 93.591 59.572 146.248 1.00 30.80 ? 267 ASN A CA 1 +ATOM 2002 C C . ASN A 1 247 ? 94.486 59.655 147.490 1.00 30.38 ? 267 ASN A C 1 +ATOM 2003 O O . ASN A 1 247 ? 93.981 59.676 148.615 1.00 30.65 ? 267 ASN A O 1 +ATOM 2004 C CB . ASN A 1 247 ? 92.361 58.713 146.557 1.00 31.10 ? 267 ASN A CB 1 +ATOM 2005 C CG . ASN A 1 247 ? 91.388 58.676 145.411 1.00 32.17 ? 267 ASN A CG 1 +ATOM 2006 O OD1 . ASN A 1 247 ? 90.872 59.715 144.989 1.00 33.53 ? 267 ASN A OD1 1 +ATOM 2007 N ND2 . ASN A 1 247 ? 91.135 57.479 144.886 1.00 33.36 ? 267 ASN A ND2 1 +ATOM 2008 N N . LYS A 1 248 ? 95.798 59.731 147.305 1.00 29.70 ? 268 LYS A N 1 +ATOM 2009 C CA . LYS A 1 248 ? 96.680 59.976 148.443 1.00 29.07 ? 268 LYS A CA 1 +ATOM 2010 C C . LYS A 1 248 ? 96.988 61.467 148.570 1.00 28.43 ? 268 LYS A C 1 +ATOM 2011 O O . LYS A 1 248 ? 97.166 62.168 147.573 1.00 27.94 ? 268 LYS A O 1 +ATOM 2012 C CB . LYS A 1 248 ? 97.960 59.149 148.356 1.00 29.37 ? 268 LYS A CB 1 +ATOM 2013 C CG . LYS A 1 248 ? 98.921 59.518 147.248 1.00 29.88 ? 268 LYS A CG 1 +ATOM 2014 C CD . LYS A 1 248 ? 100.343 59.081 147.590 1.00 30.85 ? 268 LYS A CD 1 +ATOM 2015 C CE . LYS A 1 248 ? 101.383 59.794 146.737 1.00 31.24 ? 268 LYS A CE 1 +ATOM 2016 N NZ . LYS A 1 248 ? 101.498 61.246 147.059 1.00 30.93 ? 268 LYS A NZ 1 +ATOM 2017 N N . VAL A 1 249 ? 97.031 61.943 149.809 1.00 27.57 ? 269 VAL A N 1 +ATOM 2018 C CA . VAL A 1 249 ? 97.252 63.354 150.087 1.00 27.06 ? 269 VAL A CA 1 +ATOM 2019 C C . VAL A 1 249 ? 98.693 63.740 149.748 1.00 26.45 ? 269 VAL A C 1 +ATOM 2020 O O . VAL A 1 249 ? 99.640 63.099 150.210 1.00 26.43 ? 269 VAL A O 1 +ATOM 2021 C CB . VAL A 1 249 ? 96.909 63.698 151.558 1.00 26.99 ? 269 VAL A CB 1 +ATOM 2022 C CG1 . VAL A 1 249 ? 97.732 62.863 152.514 1.00 27.14 ? 269 VAL A CG1 1 +ATOM 2023 C CG2 . VAL A 1 249 ? 97.106 65.179 151.835 1.00 26.88 ? 269 VAL A CG2 1 +ATOM 2024 N N . VAL A 1 250 ? 98.843 64.774 148.919 1.00 25.70 ? 270 VAL A N 1 +ATOM 2025 C CA . VAL A 1 250 ? 100.160 65.270 148.491 1.00 25.26 ? 270 VAL A CA 1 +ATOM 2026 C C . VAL A 1 250 ? 100.519 66.623 149.114 1.00 24.81 ? 270 VAL A C 1 +ATOM 2027 O O . VAL A 1 250 ? 101.700 66.982 149.172 1.00 24.62 ? 270 VAL A O 1 +ATOM 2028 C CB . VAL A 1 250 ? 100.250 65.389 146.949 1.00 25.07 ? 270 VAL A CB 1 +ATOM 2029 C CG1 . VAL A 1 250 ? 100.184 64.013 146.307 1.00 25.32 ? 270 VAL A CG1 1 +ATOM 2030 C CG2 . VAL A 1 250 ? 99.148 66.302 146.404 1.00 25.10 ? 270 VAL A CG2 1 +ATOM 2031 N N . ALA A 1 251 ? 99.501 67.371 149.547 1.00 24.54 ? 271 ALA A N 1 +ATOM 2032 C CA . ALA A 1 251 ? 99.677 68.667 150.205 1.00 24.53 ? 271 ALA A CA 1 +ATOM 2033 C C . ALA A 1 251 ? 98.461 68.974 151.071 1.00 24.52 ? 271 ALA A C 1 +ATOM 2034 O O . ALA A 1 251 ? 97.382 68.418 150.854 1.00 24.85 ? 271 ALA A O 1 +ATOM 2035 C CB . ALA A 1 251 ? 99.876 69.769 149.175 1.00 24.18 ? 271 ALA A CB 1 +ATOM 2036 N N . ASN A 1 252 ? 98.629 69.856 152.054 1.00 24.42 ? 272 ASN A N 1 +ATOM 2037 C CA . ASN A 1 252 ? 97.502 70.270 152.888 1.00 24.39 ? 272 ASN A CA 1 +ATOM 2038 C C . ASN A 1 252 ? 97.746 71.583 153.620 1.00 23.62 ? 272 ASN A C 1 +ATOM 2039 O O . ASN A 1 252 ? 98.885 71.974 153.851 1.00 23.39 ? 272 ASN A O 1 +ATOM 2040 C CB . ASN A 1 252 ? 97.126 69.165 153.887 1.00 24.84 ? 272 ASN A CB 1 +ATOM 2041 C CG . ASN A 1 252 ? 98.232 68.889 154.898 1.00 27.30 ? 272 ASN A CG 1 +ATOM 2042 O OD1 . ASN A 1 252 ? 99.071 68.005 154.692 1.00 28.29 ? 272 ASN A OD1 1 +ATOM 2043 N ND2 . ASN A 1 252 ? 98.269 69.689 155.966 1.00 31.58 ? 272 ASN A ND2 1 +ATOM 2044 N N . GLY A 1 253 ? 96.657 72.239 154.003 1.00 22.81 ? 273 GLY A N 1 +ATOM 2045 C CA . GLY A 1 253 ? 96.713 73.527 154.678 1.00 22.31 ? 273 GLY A CA 1 +ATOM 2046 C C . GLY A 1 253 ? 95.404 73.868 155.360 1.00 21.91 ? 273 GLY A C 1 +ATOM 2047 O O . GLY A 1 253 ? 94.550 73.004 155.554 1.00 21.41 ? 273 GLY A O 1 +ATOM 2048 N N . THR A 1 254 ? 95.247 75.136 155.723 1.00 21.51 ? 274 THR A N 1 +ATOM 2049 C CA . THR A 1 254 ? 94.076 75.594 156.466 1.00 21.80 ? 274 THR A CA 1 +ATOM 2050 C C . THR A 1 254 ? 93.681 77.009 156.044 1.00 21.68 ? 274 THR A C 1 +ATOM 2051 O O . THR A 1 254 ? 94.332 77.626 155.196 1.00 21.79 ? 274 THR A O 1 +ATOM 2052 C CB . THR A 1 254 ? 94.344 75.601 158.002 1.00 21.87 ? 274 THR A CB 1 +ATOM 2053 O OG1 . THR A 1 254 ? 95.325 76.599 158.317 1.00 22.95 ? 274 THR A OG1 1 +ATOM 2054 C CG2 . THR A 1 254 ? 94.834 74.242 158.487 1.00 21.65 ? 274 THR A CG2 1 +ATOM 2055 N N . GLY A 1 255 ? 92.609 77.519 156.639 1.00 21.78 ? 275 GLY A N 1 +ATOM 2056 C CA . GLY A 1 255 ? 92.210 78.914 156.458 1.00 21.63 ? 275 GLY A CA 1 +ATOM 2057 C C . GLY A 1 255 ? 91.422 79.212 155.195 1.00 21.80 ? 275 GLY A C 1 +ATOM 2058 O O . GLY A 1 255 ? 91.198 78.333 154.365 1.00 22.01 ? 275 GLY A O 1 +ATOM 2059 N N . THR A 1 256 ? 91.030 80.477 155.047 1.00 22.08 ? 276 THR A N 1 +ATOM 2060 C CA . THR A 1 256 ? 90.231 80.928 153.904 1.00 22.25 ? 276 THR A CA 1 +ATOM 2061 C C . THR A 1 256 ? 91.073 81.172 152.652 1.00 22.66 ? 276 THR A C 1 +ATOM 2062 O O . THR A 1 256 ? 90.529 81.297 151.557 1.00 22.60 ? 276 THR A O 1 +ATOM 2063 C CB . THR A 1 256 ? 89.479 82.212 154.224 1.00 22.12 ? 276 THR A CB 1 +ATOM 2064 O OG1 . THR A 1 256 ? 90.415 83.203 154.668 1.00 22.17 ? 276 THR A OG1 1 +ATOM 2065 C CG2 . THR A 1 256 ? 88.444 81.962 155.304 1.00 22.05 ? 276 THR A CG2 1 +ATOM 2066 N N . GLN A 1 257 ? 92.392 81.251 152.821 1.00 22.84 ? 277 GLN A N 1 +ATOM 2067 C CA . GLN A 1 257 ? 93.302 81.356 151.693 1.00 23.14 ? 277 GLN A CA 1 +ATOM 2068 C C . GLN A 1 257 ? 94.641 80.715 152.007 1.00 22.78 ? 277 GLN A C 1 +ATOM 2069 O O . GLN A 1 257 ? 94.994 80.510 153.168 1.00 22.88 ? 277 GLN A O 1 +ATOM 2070 C CB . GLN A 1 257 ? 93.491 82.814 151.277 1.00 23.27 ? 277 GLN A CB 1 +ATOM 2071 C CG . GLN A 1 257 ? 94.047 83.744 152.354 1.00 24.26 ? 277 GLN A CG 1 +ATOM 2072 C CD . GLN A 1 257 ? 94.136 85.196 151.876 1.00 24.46 ? 277 GLN A CD 1 +ATOM 2073 O OE1 . GLN A 1 257 ? 94.644 85.476 150.788 1.00 26.40 ? 277 GLN A OE1 1 +ATOM 2074 N NE2 . GLN A 1 257 ? 93.640 86.125 152.696 1.00 26.89 ? 277 GLN A NE2 1 +ATOM 2075 N N . GLY A 1 258 ? 95.389 80.396 150.963 1.00 22.39 ? 278 GLY A N 1 +ATOM 2076 C CA . GLY A 1 258 ? 96.678 79.753 151.143 1.00 22.03 ? 278 GLY A CA 1 +ATOM 2077 C C . GLY A 1 258 ? 97.212 79.192 149.849 1.00 22.00 ? 278 GLY A C 1 +ATOM 2078 O O . GLY A 1 258 ? 96.560 79.293 148.799 1.00 21.77 ? 278 GLY A O 1 +ATOM 2079 N N . GLN A 1 259 ? 98.401 78.603 149.936 1.00 21.64 ? 279 GLN A N 1 +ATOM 2080 C CA . GLN A 1 259 ? 99.090 78.054 148.784 1.00 21.68 ? 279 GLN A CA 1 +ATOM 2081 C C . GLN A 1 259 ? 99.653 76.688 149.122 1.00 21.56 ? 279 GLN A C 1 +ATOM 2082 O O . GLN A 1 259 ? 100.519 76.560 149.995 1.00 21.44 ? 279 GLN A O 1 +ATOM 2083 C CB . GLN A 1 259 ? 100.216 78.992 148.345 1.00 22.10 ? 279 GLN A CB 1 +ATOM 2084 C CG . GLN A 1 259 ? 100.858 78.612 147.030 1.00 22.87 ? 279 GLN A CG 1 +ATOM 2085 C CD . GLN A 1 259 ? 102.097 79.427 146.747 1.00 24.60 ? 279 GLN A CD 1 +ATOM 2086 O OE1 . GLN A 1 259 ? 103.038 79.436 147.543 1.00 24.08 ? 279 GLN A OE1 1 +ATOM 2087 N NE2 . GLN A 1 259 ? 102.113 80.110 145.604 1.00 26.25 ? 279 GLN A NE2 1 +ATOM 2088 N N . LEU A 1 260 ? 99.161 75.662 148.435 1.00 21.17 ? 280 LEU A N 1 +ATOM 2089 C CA . LEU A 1 260 ? 99.669 74.317 148.609 1.00 20.96 ? 280 LEU A CA 1 +ATOM 2090 C C . LEU A 1 260 ? 100.803 74.092 147.610 1.00 21.07 ? 280 LEU A C 1 +ATOM 2091 O O . LEU A 1 260 ? 100.654 74.346 146.414 1.00 20.87 ? 280 LEU A O 1 +ATOM 2092 C CB . LEU A 1 260 ? 98.552 73.282 148.407 1.00 20.99 ? 280 LEU A CB 1 +ATOM 2093 C CG . LEU A 1 260 ? 97.293 73.471 149.266 1.00 20.77 ? 280 LEU A CG 1 +ATOM 2094 C CD1 . LEU A 1 260 ? 96.257 72.398 148.948 1.00 20.84 ? 280 LEU A CD1 1 +ATOM 2095 C CD2 . LEU A 1 260 ? 97.614 73.481 150.763 1.00 20.74 ? 280 LEU A CD2 1 +ATOM 2096 N N . LYS A 1 261 ? 101.952 73.654 148.108 1.00 20.91 ? 281 LYS A N 1 +ATOM 2097 C CA . LYS A 1 261 ? 103.072 73.318 147.238 1.00 21.23 ? 281 LYS A CA 1 +ATOM 2098 C C . LYS A 1 261 ? 103.030 71.815 146.952 1.00 21.17 ? 281 LYS A C 1 +ATOM 2099 O O . LYS A 1 261 ? 102.864 71.012 147.871 1.00 21.22 ? 281 LYS A O 1 +ATOM 2100 C CB . LYS A 1 261 ? 104.400 73.724 147.889 1.00 21.30 ? 281 LYS A CB 1 +ATOM 2101 C CG . LYS A 1 261 ? 105.518 73.999 146.892 1.00 22.73 ? 281 LYS A CG 1 +ATOM 2102 C CD . LYS A 1 261 ? 106.665 74.781 147.545 1.00 24.78 ? 281 LYS A CD 1 +ATOM 2103 C CE . LYS A 1 261 ? 107.918 74.777 146.683 1.00 25.57 ? 281 LYS A CE 1 +ATOM 2104 N NZ . LYS A 1 261 ? 109.155 74.704 147.525 1.00 27.44 ? 281 LYS A NZ 1 +ATOM 2105 N N . VAL A 1 262 ? 103.153 71.444 145.678 1.00 21.37 ? 282 VAL A N 1 +ATOM 2106 C CA . VAL A 1 262 ? 103.063 70.046 145.248 1.00 21.72 ? 282 VAL A CA 1 +ATOM 2107 C C . VAL A 1 262 ? 104.401 69.588 144.677 1.00 21.77 ? 282 VAL A C 1 +ATOM 2108 O O . VAL A 1 262 ? 104.736 69.913 143.535 1.00 21.46 ? 282 VAL A O 1 +ATOM 2109 C CB . VAL A 1 262 ? 101.965 69.849 144.175 1.00 21.64 ? 282 VAL A CB 1 +ATOM 2110 C CG1 . VAL A 1 262 ? 101.880 68.386 143.760 1.00 21.53 ? 282 VAL A CG1 1 +ATOM 2111 C CG2 . VAL A 1 262 ? 100.627 70.315 144.712 1.00 22.17 ? 282 VAL A CG2 1 +ATOM 2112 N N . PRO A 1 263 ? 105.184 68.844 145.474 1.00 22.08 ? 283 PRO A N 1 +ATOM 2113 C CA . PRO A 1 263 ? 106.494 68.404 144.993 1.00 22.05 ? 283 PRO A CA 1 +ATOM 2114 C C . PRO A 1 263 ? 106.394 67.482 143.785 1.00 21.58 ? 283 PRO A C 1 +ATOM 2115 O O . PRO A 1 263 ? 105.545 66.608 143.780 1.00 22.33 ? 283 PRO A O 1 +ATOM 2116 C CB . PRO A 1 263 ? 107.066 67.634 146.192 1.00 22.05 ? 283 PRO A CB 1 +ATOM 2117 C CG . PRO A 1 263 ? 106.273 68.094 147.374 1.00 22.91 ? 283 PRO A CG 1 +ATOM 2118 C CD . PRO A 1 263 ? 104.922 68.392 146.855 1.00 21.91 ? 283 PRO A CD 1 +ATOM 2119 N N . GLY A 1 264 ? 107.237 67.692 142.774 1.00 21.19 ? 284 GLY A N 1 +ATOM 2120 C CA . GLY A 1 264 ? 107.339 66.768 141.630 1.00 20.84 ? 284 GLY A CA 1 +ATOM 2121 C C . GLY A 1 264 ? 106.001 66.563 140.927 1.00 20.31 ? 284 GLY A C 1 +ATOM 2122 O O . GLY A 1 264 ? 105.599 65.434 140.640 1.00 19.52 ? 284 GLY A O 1 +ATOM 2123 N N . VAL A 1 265 ? 105.345 67.683 140.644 1.00 19.75 ? 285 VAL A N 1 +ATOM 2124 C CA . VAL A 1 265 ? 103.961 67.729 140.163 1.00 19.45 ? 285 VAL A CA 1 +ATOM 2125 C C . VAL A 1 265 ? 103.734 67.016 138.832 1.00 19.38 ? 285 VAL A C 1 +ATOM 2126 O O . VAL A 1 265 ? 104.632 66.940 137.984 1.00 19.89 ? 285 VAL A O 1 +ATOM 2127 C CB . VAL A 1 265 ? 103.513 69.204 140.020 1.00 19.63 ? 285 VAL A CB 1 +ATOM 2128 C CG1 . VAL A 1 265 ? 104.368 69.931 138.977 1.00 18.75 ? 285 VAL A CG1 1 +ATOM 2129 C CG2 . VAL A 1 265 ? 102.030 69.309 139.672 1.00 20.08 ? 285 VAL A CG2 1 +ATOM 2130 N N . SER A 1 266 ? 102.516 66.500 138.661 1.00 18.63 ? 286 SER A N 1 +ATOM 2131 C CA . SER A 1 266 ? 102.052 65.971 137.388 1.00 17.98 ? 286 SER A CA 1 +ATOM 2132 C C . SER A 1 266 ? 101.131 67.025 136.792 1.00 17.17 ? 286 SER A C 1 +ATOM 2133 O O . SER A 1 266 ? 99.985 67.196 137.239 1.00 16.52 ? 286 SER A O 1 +ATOM 2134 C CB . SER A 1 266 ? 101.315 64.639 137.575 1.00 18.16 ? 286 SER A CB 1 +ATOM 2135 O OG . SER A 1 266 ? 102.202 63.589 137.951 1.00 18.82 ? 286 SER A OG 1 +ATOM 2136 N N . LEU A 1 267 ? 101.659 67.760 135.816 1.00 16.16 ? 287 LEU A N 1 +ATOM 2137 C CA . LEU A 1 267 ? 100.934 68.846 135.180 1.00 15.57 ? 287 LEU A CA 1 +ATOM 2138 C C . LEU A 1 267 ? 99.766 68.308 134.359 1.00 14.17 ? 287 LEU A C 1 +ATOM 2139 O O . LEU A 1 267 ? 99.788 67.154 133.891 1.00 13.03 ? 287 LEU A O 1 +ATOM 2140 C CB . LEU A 1 267 ? 101.863 69.678 134.289 1.00 15.86 ? 287 LEU A CB 1 +ATOM 2141 C CG . LEU A 1 267 ? 103.042 70.412 134.950 1.00 16.60 ? 287 LEU A CG 1 +ATOM 2142 C CD1 . LEU A 1 267 ? 103.689 71.361 133.939 1.00 16.62 ? 287 LEU A CD1 1 +ATOM 2143 C CD2 . LEU A 1 267 ? 102.620 71.160 136.189 1.00 18.10 ? 287 LEU A CD2 1 +ATOM 2144 N N . TRP A 1 268 ? 98.737 69.146 134.250 1.00 13.36 ? 288 TRP A N 1 +ATOM 2145 C CA . TRP A 1 268 ? 97.595 68.911 133.373 1.00 13.02 ? 288 TRP A CA 1 +ATOM 2146 C C . TRP A 1 268 ? 98.014 69.304 131.964 1.00 12.94 ? 288 TRP A C 1 +ATOM 2147 O O . TRP A 1 268 ? 98.388 70.459 131.710 1.00 12.60 ? 288 TRP A O 1 +ATOM 2148 C CB . TRP A 1 268 ? 96.400 69.748 133.845 1.00 12.87 ? 288 TRP A CB 1 +ATOM 2149 C CG . TRP A 1 268 ? 95.067 69.448 133.187 1.00 12.06 ? 288 TRP A CG 1 +ATOM 2150 C CD1 . TRP A 1 268 ? 94.047 68.685 133.706 1.00 12.31 ? 288 TRP A CD1 1 +ATOM 2151 C CD2 . TRP A 1 268 ? 94.601 69.923 131.912 1.00 11.76 ? 288 TRP A CD2 1 +ATOM 2152 N NE1 . TRP A 1 268 ? 92.984 68.654 132.827 1.00 10.75 ? 288 TRP A NE1 1 +ATOM 2153 C CE2 . TRP A 1 268 ? 93.297 69.400 131.721 1.00 11.57 ? 288 TRP A CE2 1 +ATOM 2154 C CE3 . TRP A 1 268 ? 95.148 70.744 130.919 1.00 13.00 ? 288 TRP A CE3 1 +ATOM 2155 C CZ2 . TRP A 1 268 ? 92.547 69.667 130.578 1.00 12.59 ? 288 TRP A CZ2 1 +ATOM 2156 C CZ3 . TRP A 1 268 ? 94.399 71.002 129.785 1.00 12.45 ? 288 TRP A CZ3 1 +ATOM 2157 C CH2 . TRP A 1 268 ? 93.106 70.463 129.625 1.00 12.03 ? 288 TRP A CH2 1 +ATOM 2158 N N . TRP A 1 269 ? 97.968 68.330 131.061 1.00 13.11 ? 289 TRP A N 1 +ATOM 2159 C CA . TRP A 1 269 ? 98.325 68.522 129.669 1.00 13.12 ? 289 TRP A CA 1 +ATOM 2160 C C . TRP A 1 269 ? 97.114 68.281 128.767 1.00 12.63 ? 289 TRP A C 1 +ATOM 2161 O O . TRP A 1 269 ? 96.375 67.326 128.981 1.00 12.64 ? 289 TRP A O 1 +ATOM 2162 C CB . TRP A 1 269 ? 99.429 67.543 129.248 1.00 13.88 ? 289 TRP A CB 1 +ATOM 2163 C CG . TRP A 1 269 ? 100.753 67.820 129.870 1.00 15.16 ? 289 TRP A CG 1 +ATOM 2164 C CD1 . TRP A 1 269 ? 101.344 67.131 130.890 1.00 16.15 ? 289 TRP A CD1 1 +ATOM 2165 C CD2 . TRP A 1 269 ? 101.664 68.871 129.511 1.00 16.04 ? 289 TRP A CD2 1 +ATOM 2166 N NE1 . TRP A 1 269 ? 102.563 67.695 131.198 1.00 16.45 ? 289 TRP A NE1 1 +ATOM 2167 C CE2 . TRP A 1 269 ? 102.784 68.763 130.365 1.00 16.60 ? 289 TRP A CE2 1 +ATOM 2168 C CE3 . TRP A 1 269 ? 101.643 69.892 128.548 1.00 16.12 ? 289 TRP A CE3 1 +ATOM 2169 C CZ2 . TRP A 1 269 ? 103.877 69.642 130.284 1.00 15.65 ? 289 TRP A CZ2 1 +ATOM 2170 C CZ3 . TRP A 1 269 ? 102.734 70.768 128.467 1.00 16.72 ? 289 TRP A CZ3 1 +ATOM 2171 C CH2 . TRP A 1 269 ? 103.836 70.628 129.330 1.00 15.84 ? 289 TRP A CH2 1 +ATOM 2172 N N . PRO A 1 270 ? 96.931 69.127 127.737 1.00 12.33 ? 290 PRO A N 1 +ATOM 2173 C CA . PRO A 1 270 ? 95.909 68.816 126.732 1.00 11.90 ? 290 PRO A CA 1 +ATOM 2174 C C . PRO A 1 270 ? 96.071 67.447 126.057 1.00 11.67 ? 290 PRO A C 1 +ATOM 2175 O O . PRO A 1 270 ? 97.188 66.924 125.911 1.00 11.33 ? 290 PRO A O 1 +ATOM 2176 C CB . PRO A 1 270 ? 96.080 69.935 125.703 1.00 11.89 ? 290 PRO A CB 1 +ATOM 2177 C CG . PRO A 1 270 ? 96.652 71.071 126.475 1.00 12.18 ? 290 PRO A CG 1 +ATOM 2178 C CD . PRO A 1 270 ? 97.586 70.423 127.461 1.00 11.52 ? 290 PRO A CD 1 +ATOM 2179 N N . TYR A 1 271 ? 94.948 66.893 125.634 1.00 11.50 ? 291 TYR A N 1 +ATOM 2180 C CA . TYR A 1 271 ? 94.918 65.691 124.814 1.00 11.76 ? 291 TYR A CA 1 +ATOM 2181 C C . TYR A 1 271 ? 95.925 65.801 123.670 1.00 12.68 ? 291 TYR A C 1 +ATOM 2182 O O . TYR A 1 271 ? 95.933 66.795 122.965 1.00 12.28 ? 291 TYR A O 1 +ATOM 2183 C CB . TYR A 1 271 ? 93.503 65.516 124.258 1.00 11.72 ? 291 TYR A CB 1 +ATOM 2184 C CG . TYR A 1 271 ? 93.306 64.356 123.309 1.00 11.65 ? 291 TYR A CG 1 +ATOM 2185 C CD1 . TYR A 1 271 ? 93.676 63.062 123.665 1.00 11.97 ? 291 TYR A CD1 1 +ATOM 2186 C CD2 . TYR A 1 271 ? 92.722 64.555 122.055 1.00 10.90 ? 291 TYR A CD2 1 +ATOM 2187 C CE1 . TYR A 1 271 ? 93.480 61.991 122.796 1.00 12.04 ? 291 TYR A CE1 1 +ATOM 2188 C CE2 . TYR A 1 271 ? 92.521 63.513 121.187 1.00 10.42 ? 291 TYR A CE2 1 +ATOM 2189 C CZ . TYR A 1 271 ? 92.897 62.222 121.560 1.00 11.54 ? 291 TYR A CZ 1 +ATOM 2190 O OH . TYR A 1 271 ? 92.705 61.170 120.704 1.00 11.51 ? 291 TYR A OH 1 +ATOM 2191 N N . LEU A 1 272 ? 96.771 64.778 123.531 1.00 13.62 ? 292 LEU A N 1 +ATOM 2192 C CA . LEU A 1 272 ? 97.790 64.647 122.478 1.00 14.43 ? 292 LEU A CA 1 +ATOM 2193 C C . LEU A 1 272 ? 99.015 65.552 122.649 1.00 15.75 ? 292 LEU A C 1 +ATOM 2194 O O . LEU A 1 272 ? 99.950 65.468 121.850 1.00 16.13 ? 292 LEU A O 1 +ATOM 2195 C CB . LEU A 1 272 ? 97.195 64.795 121.065 1.00 14.68 ? 292 LEU A CB 1 +ATOM 2196 C CG . LEU A 1 272 ? 96.117 63.776 120.677 1.00 14.22 ? 292 LEU A CG 1 +ATOM 2197 C CD1 . LEU A 1 272 ? 95.543 64.075 119.288 1.00 14.29 ? 292 LEU A CD1 1 +ATOM 2198 C CD2 . LEU A 1 272 ? 96.637 62.334 120.746 1.00 13.19 ? 292 LEU A CD2 1 +ATOM 2199 N N . MET A 1 273 ? 99.025 66.394 123.683 1.00 16.62 ? 293 MET A N 1 +ATOM 2200 C CA . MET A 1 273 ? 100.219 67.177 124.016 1.00 17.79 ? 293 MET A CA 1 +ATOM 2201 C C . MET A 1 273 ? 101.165 66.356 124.898 1.00 18.63 ? 293 MET A C 1 +ATOM 2202 O O . MET A 1 273 ? 102.361 66.663 125.005 1.00 19.63 ? 293 MET A O 1 +ATOM 2203 C CB . MET A 1 273 ? 99.833 68.488 124.711 1.00 17.15 ? 293 MET A CB 1 +ATOM 2204 C CG . MET A 1 273 ? 100.955 69.514 124.711 1.00 18.27 ? 293 MET A CG 1 +ATOM 2205 S SD . MET A 1 273 ? 100.493 71.190 125.147 1.00 18.30 ? 293 MET A SD 1 +ATOM 2206 C CE . MET A 1 273 ? 102.063 71.979 124.798 1.00 17.81 ? 293 MET A CE 1 +ATOM 2207 N N . HIS A 1 274 ? 100.630 65.307 125.516 1.00 19.27 ? 294 HIS A N 1 +ATOM 2208 C CA . HIS A 1 274 ? 101.365 64.456 126.442 1.00 20.03 ? 294 HIS A CA 1 +ATOM 2209 C C . HIS A 1 274 ? 100.728 63.065 126.423 1.00 20.25 ? 294 HIS A C 1 +ATOM 2210 O O . HIS A 1 274 ? 99.525 62.940 126.183 1.00 19.79 ? 294 HIS A O 1 +ATOM 2211 C CB . HIS A 1 274 ? 101.288 65.055 127.844 1.00 20.11 ? 294 HIS A CB 1 +ATOM 2212 C CG . HIS A 1 274 ? 102.261 64.468 128.819 1.00 21.50 ? 294 HIS A CG 1 +ATOM 2213 N ND1 . HIS A 1 274 ? 102.097 63.216 129.373 1.00 21.07 ? 294 HIS A ND1 1 +ATOM 2214 C CD2 . HIS A 1 274 ? 103.390 64.977 129.367 1.00 22.39 ? 294 HIS A CD2 1 +ATOM 2215 C CE1 . HIS A 1 274 ? 103.094 62.972 130.206 1.00 23.18 ? 294 HIS A CE1 1 +ATOM 2216 N NE2 . HIS A 1 274 ? 103.892 64.025 130.220 1.00 22.27 ? 294 HIS A NE2 1 +ATOM 2217 N N . GLU A 1 275 ? 101.522 62.024 126.671 1.00 20.95 ? 295 GLU A N 1 +ATOM 2218 C CA . GLU A 1 275 ? 101.026 60.634 126.646 1.00 22.07 ? 295 GLU A CA 1 +ATOM 2219 C C . GLU A 1 275 ? 99.968 60.338 127.717 1.00 21.41 ? 295 GLU A C 1 +ATOM 2220 O O . GLU A 1 275 ? 99.167 59.413 127.570 1.00 22.08 ? 295 GLU A O 1 +ATOM 2221 C CB . GLU A 1 275 ? 102.175 59.636 126.817 1.00 22.12 ? 295 GLU A CB 1 +ATOM 2222 C CG . GLU A 1 275 ? 103.060 59.430 125.600 1.00 24.04 ? 295 GLU A CG 1 +ATOM 2223 C CD . GLU A 1 275 ? 104.206 58.480 125.905 1.00 24.62 ? 295 GLU A CD 1 +ATOM 2224 O OE1 . GLU A 1 275 ? 103.930 57.310 126.248 1.00 29.27 ? 295 GLU A OE1 1 +ATOM 2225 O OE2 . GLU A 1 275 ? 105.384 58.902 125.818 1.00 28.40 ? 295 GLU A OE2 1 +ATOM 2226 N N . ARG A 1 276 ? 99.987 61.106 128.804 1.00 20.82 ? 296 ARG A N 1 +ATOM 2227 C CA . ARG A 1 276 ? 99.031 60.941 129.886 1.00 20.32 ? 296 ARG A CA 1 +ATOM 2228 C C . ARG A 1 276 ? 98.465 62.311 130.198 1.00 18.65 ? 296 ARG A C 1 +ATOM 2229 O O . ARG A 1 276 ? 98.879 62.975 131.144 1.00 18.25 ? 296 ARG A O 1 +ATOM 2230 C CB . ARG A 1 276 ? 99.675 60.262 131.096 1.00 21.10 ? 296 ARG A CB 1 +ATOM 2231 C CG . ARG A 1 276 ? 99.678 58.742 130.935 1.00 23.60 ? 296 ARG A CG 1 +ATOM 2232 C CD . ARG A 1 276 ? 100.898 58.048 131.488 1.00 27.51 ? 296 ARG A CD 1 +ATOM 2233 N NE . ARG A 1 276 ? 100.633 57.509 132.818 1.00 29.43 ? 296 ARG A NE 1 +ATOM 2234 C CZ . ARG A 1 276 ? 101.081 56.342 133.281 1.00 30.29 ? 296 ARG A CZ 1 +ATOM 2235 N NH1 . ARG A 1 276 ? 101.839 55.540 132.534 1.00 32.32 ? 296 ARG A NH1 1 +ATOM 2236 N NH2 . ARG A 1 276 ? 100.764 55.969 134.517 1.00 30.94 ? 296 ARG A NH2 1 +ATOM 2237 N N . PRO A 1 277 ? 97.502 62.739 129.374 1.00 16.88 ? 297 PRO A N 1 +ATOM 2238 C CA . PRO A 1 277 ? 96.968 64.077 129.467 1.00 15.75 ? 297 PRO A CA 1 +ATOM 2239 C C . PRO A 1 277 ? 95.972 64.208 130.608 1.00 15.03 ? 297 PRO A C 1 +ATOM 2240 O O . PRO A 1 277 ? 95.540 63.210 131.192 1.00 13.65 ? 297 PRO A O 1 +ATOM 2241 C CB . PRO A 1 277 ? 96.238 64.235 128.133 1.00 15.88 ? 297 PRO A CB 1 +ATOM 2242 C CG . PRO A 1 277 ? 95.744 62.895 127.838 1.00 16.22 ? 297 PRO A CG 1 +ATOM 2243 C CD . PRO A 1 277 ? 96.818 61.957 128.324 1.00 16.49 ? 297 PRO A CD 1 +ATOM 2244 N N . ALA A 1 278 ? 95.625 65.451 130.915 1.00 14.17 ? 298 ALA A N 1 +ATOM 2245 C CA . ALA A 1 278 ? 94.469 65.747 131.734 1.00 14.29 ? 298 ALA A CA 1 +ATOM 2246 C C . ALA A 1 278 ? 94.615 65.254 133.170 1.00 14.61 ? 298 ALA A C 1 +ATOM 2247 O O . ALA A 1 278 ? 93.629 64.896 133.794 1.00 14.12 ? 298 ALA A O 1 +ATOM 2248 C CB . ALA A 1 278 ? 93.211 65.155 131.091 1.00 13.98 ? 298 ALA A CB 1 +ATOM 2249 N N . TYR A 1 279 ? 95.837 65.266 133.706 1.00 15.07 ? 299 TYR A N 1 +ATOM 2250 C CA . TYR A 1 279 ? 96.055 64.849 135.085 1.00 15.46 ? 299 TYR A CA 1 +ATOM 2251 C C . TYR A 1 279 ? 95.301 65.717 136.080 1.00 15.43 ? 299 TYR A C 1 +ATOM 2252 O O . TYR A 1 279 ? 95.554 66.918 136.168 1.00 15.64 ? 299 TYR A O 1 +ATOM 2253 C CB . TYR A 1 279 ? 97.545 64.855 135.454 1.00 15.98 ? 299 TYR A CB 1 +ATOM 2254 C CG . TYR A 1 279 ? 97.770 64.080 136.719 1.00 16.39 ? 299 TYR A CG 1 +ATOM 2255 C CD1 . TYR A 1 279 ? 97.555 64.668 137.969 1.00 17.62 ? 299 TYR A CD1 1 +ATOM 2256 C CD2 . TYR A 1 279 ? 98.137 62.742 136.676 1.00 17.84 ? 299 TYR A CD2 1 +ATOM 2257 C CE1 . TYR A 1 279 ? 97.737 63.950 139.135 1.00 16.85 ? 299 TYR A CE1 1 +ATOM 2258 C CE2 . TYR A 1 279 ? 98.316 62.013 137.840 1.00 18.08 ? 299 TYR A CE2 1 +ATOM 2259 C CZ . TYR A 1 279 ? 98.118 62.626 139.063 1.00 18.02 ? 299 TYR A CZ 1 +ATOM 2260 O OH . TYR A 1 279 ? 98.289 61.910 140.216 1.00 17.77 ? 299 TYR A OH 1 +ATOM 2261 N N . LEU A 1 280 ? 94.394 65.115 136.852 1.00 15.69 ? 300 LEU A N 1 +ATOM 2262 C CA . LEU A 1 280 ? 93.629 65.880 137.838 1.00 16.08 ? 300 LEU A CA 1 +ATOM 2263 C C . LEU A 1 280 ? 93.931 65.478 139.278 1.00 16.70 ? 300 LEU A C 1 +ATOM 2264 O O . LEU A 1 280 ? 93.871 64.300 139.627 1.00 16.56 ? 300 LEU A O 1 +ATOM 2265 C CB . LEU A 1 280 ? 92.124 65.751 137.586 1.00 16.14 ? 300 LEU A CB 1 +ATOM 2266 C CG . LEU A 1 280 ? 91.587 66.505 136.369 1.00 15.89 ? 300 LEU A CG 1 +ATOM 2267 C CD1 . LEU A 1 280 ? 90.220 65.944 135.960 1.00 15.15 ? 300 LEU A CD1 1 +ATOM 2268 C CD2 . LEU A 1 280 ? 91.521 68.009 136.640 1.00 15.55 ? 300 LEU A CD2 1 +ATOM 2269 N N . TYR A 1 281 ? 94.238 66.480 140.100 1.00 17.17 ? 301 TYR A N 1 +ATOM 2270 C CA . TYR A 1 281 ? 94.238 66.326 141.546 1.00 17.36 ? 301 TYR A CA 1 +ATOM 2271 C C . TYR A 1 281 ? 92.851 66.681 142.044 1.00 17.57 ? 301 TYR A C 1 +ATOM 2272 O O . TYR A 1 281 ? 92.024 67.192 141.274 1.00 17.36 ? 301 TYR A O 1 +ATOM 2273 C CB . TYR A 1 281 ? 95.258 67.263 142.190 1.00 17.36 ? 301 TYR A CB 1 +ATOM 2274 C CG . TYR A 1 281 ? 96.692 66.940 141.837 1.00 17.38 ? 301 TYR A CG 1 +ATOM 2275 C CD1 . TYR A 1 281 ? 97.497 66.226 142.715 1.00 16.43 ? 301 TYR A CD1 1 +ATOM 2276 C CD2 . TYR A 1 281 ? 97.243 67.345 140.622 1.00 17.37 ? 301 TYR A CD2 1 +ATOM 2277 C CE1 . TYR A 1 281 ? 98.818 65.928 142.398 1.00 17.00 ? 301 TYR A CE1 1 +ATOM 2278 C CE2 . TYR A 1 281 ? 98.570 67.039 140.291 1.00 17.20 ? 301 TYR A CE2 1 +ATOM 2279 C CZ . TYR A 1 281 ? 99.346 66.333 141.183 1.00 17.41 ? 301 TYR A CZ 1 +ATOM 2280 O OH . TYR A 1 281 ? 100.656 66.039 140.872 1.00 16.94 ? 301 TYR A OH 1 +ATOM 2281 N N . SER A 1 282 ? 92.585 66.414 143.323 1.00 17.68 ? 302 SER A N 1 +ATOM 2282 C CA . SER A 1 282 ? 91.345 66.888 143.944 1.00 17.91 ? 302 SER A CA 1 +ATOM 2283 C C . SER A 1 282 ? 91.655 67.707 145.189 1.00 17.69 ? 302 SER A C 1 +ATOM 2284 O O . SER A 1 282 ? 92.501 67.310 146.010 1.00 17.01 ? 302 SER A O 1 +ATOM 2285 C CB . SER A 1 282 ? 90.387 65.739 144.252 1.00 18.25 ? 302 SER A CB 1 +ATOM 2286 O OG . SER A 1 282 ? 91.019 64.686 144.938 1.00 20.07 ? 302 SER A OG 1 +ATOM 2287 N N . LEU A 1 283 ? 90.985 68.861 145.286 1.00 17.44 ? 303 LEU A N 1 +ATOM 2288 C CA . LEU A 1 283 ? 91.060 69.757 146.433 1.00 17.29 ? 303 LEU A CA 1 +ATOM 2289 C C . LEU A 1 283 ? 89.864 69.465 147.314 1.00 17.42 ? 303 LEU A C 1 +ATOM 2290 O O . LEU A 1 283 ? 88.725 69.748 146.946 1.00 16.50 ? 303 LEU A O 1 +ATOM 2291 C CB . LEU A 1 283 ? 91.039 71.227 145.996 1.00 17.45 ? 303 LEU A CB 1 +ATOM 2292 C CG . LEU A 1 283 ? 91.330 72.266 147.092 1.00 17.92 ? 303 LEU A CG 1 +ATOM 2293 C CD1 . LEU A 1 283 ? 92.838 72.436 147.271 1.00 18.98 ? 303 LEU A CD1 1 +ATOM 2294 C CD2 . LEU A 1 283 ? 90.676 73.619 146.808 1.00 17.90 ? 303 LEU A CD2 1 +ATOM 2295 N N . GLU A 1 284 ? 90.134 68.883 148.471 1.00 17.69 ? 304 GLU A N 1 +ATOM 2296 C CA . GLU A 1 284 ? 89.093 68.477 149.404 1.00 18.31 ? 304 GLU A CA 1 +ATOM 2297 C C . GLU A 1 284 ? 89.021 69.517 150.504 1.00 18.05 ? 304 GLU A C 1 +ATOM 2298 O O . GLU A 1 284 ? 89.956 69.646 151.294 1.00 18.07 ? 304 GLU A O 1 +ATOM 2299 C CB . GLU A 1 284 ? 89.441 67.111 149.989 1.00 18.82 ? 304 GLU A CB 1 +ATOM 2300 C CG . GLU A 1 284 ? 88.438 66.563 150.974 1.00 20.72 ? 304 GLU A CG 1 +ATOM 2301 C CD . GLU A 1 284 ? 88.818 65.170 151.446 1.00 25.47 ? 304 GLU A CD 1 +ATOM 2302 O OE1 . GLU A 1 284 ? 89.042 64.278 150.598 1.00 27.86 ? 304 GLU A OE1 1 +ATOM 2303 O OE2 . GLU A 1 284 ? 88.904 64.964 152.669 1.00 28.84 ? 304 GLU A OE2 1 +ATOM 2304 N N . VAL A 1 285 ? 87.918 70.258 150.555 1.00 18.26 ? 305 VAL A N 1 +ATOM 2305 C CA . VAL A 1 285 ? 87.729 71.292 151.566 1.00 17.98 ? 305 VAL A CA 1 +ATOM 2306 C C . VAL A 1 285 ? 86.800 70.755 152.650 1.00 18.51 ? 305 VAL A C 1 +ATOM 2307 O O . VAL A 1 285 ? 85.674 70.358 152.365 1.00 18.00 ? 305 VAL A O 1 +ATOM 2308 C CB . VAL A 1 285 ? 87.143 72.591 150.960 1.00 18.15 ? 305 VAL A CB 1 +ATOM 2309 C CG1 . VAL A 1 285 ? 87.057 73.678 152.005 1.00 17.21 ? 305 VAL A CG1 1 +ATOM 2310 C CG2 . VAL A 1 285 ? 87.986 73.054 149.782 1.00 18.80 ? 305 VAL A CG2 1 +ATOM 2311 N N . GLN A 1 286 ? 87.293 70.729 153.884 1.00 18.75 ? 306 GLN A N 1 +ATOM 2312 C CA . GLN A 1 286 ? 86.493 70.340 155.029 1.00 19.06 ? 306 GLN A CA 1 +ATOM 2313 C C . GLN A 1 286 ? 86.287 71.526 155.960 1.00 19.11 ? 306 GLN A C 1 +ATOM 2314 O O . GLN A 1 286 ? 87.244 72.038 156.554 1.00 18.83 ? 306 GLN A O 1 +ATOM 2315 C CB . GLN A 1 286 ? 87.166 69.213 155.794 1.00 19.28 ? 306 GLN A CB 1 +ATOM 2316 C CG . GLN A 1 286 ? 86.484 68.913 157.121 1.00 19.66 ? 306 GLN A CG 1 +ATOM 2317 C CD . GLN A 1 286 ? 87.091 67.726 157.841 1.00 20.55 ? 306 GLN A CD 1 +ATOM 2318 O OE1 . GLN A 1 286 ? 88.123 67.195 157.430 1.00 20.88 ? 306 GLN A OE1 1 +ATOM 2319 N NE2 . GLN A 1 286 ? 86.468 67.323 158.938 1.00 21.16 ? 306 GLN A NE2 1 +ATOM 2320 N N . LEU A 1 287 ? 85.031 71.935 156.108 1.00 19.67 ? 307 LEU A N 1 +ATOM 2321 C CA . LEU A 1 287 ? 84.657 73.007 157.026 1.00 20.25 ? 307 LEU A CA 1 +ATOM 2322 C C . LEU A 1 287 ? 84.127 72.436 158.340 1.00 21.39 ? 307 LEU A C 1 +ATOM 2323 O O . LEU A 1 287 ? 83.390 71.446 158.344 1.00 21.29 ? 307 LEU A O 1 +ATOM 2324 C CB . LEU A 1 287 ? 83.584 73.893 156.396 1.00 20.31 ? 307 LEU A CB 1 +ATOM 2325 C CG . LEU A 1 287 ? 82.982 75.041 157.203 1.00 19.95 ? 307 LEU A CG 1 +ATOM 2326 C CD1 . LEU A 1 287 ? 84.023 76.115 157.453 1.00 20.71 ? 307 LEU A CD1 1 +ATOM 2327 C CD2 . LEU A 1 287 ? 81.778 75.616 156.454 1.00 19.70 ? 307 LEU A CD2 1 +ATOM 2328 N N . THR A 1 288 ? 84.561 73.054 159.437 1.00 22.17 ? 308 THR A N 1 +ATOM 2329 C CA A THR A 1 288 ? 84.012 72.816 160.765 0.50 22.78 ? 308 THR A CA 1 +ATOM 2330 C CA B THR A 1 288 ? 84.007 72.814 160.763 0.50 22.59 ? 308 THR A CA 1 +ATOM 2331 C C . THR A 1 288 ? 83.561 74.163 161.337 1.00 23.31 ? 308 THR A C 1 +ATOM 2332 O O . THR A 1 288 ? 84.372 75.072 161.529 1.00 23.07 ? 308 THR A O 1 +ATOM 2333 C CB A THR A 1 288 ? 85.057 72.208 161.695 0.50 22.88 ? 308 THR A CB 1 +ATOM 2334 C CB B THR A 1 288 ? 85.032 72.147 161.694 0.50 22.66 ? 308 THR A CB 1 +ATOM 2335 O OG1 A THR A 1 288 ? 86.210 73.048 161.710 0.50 23.26 ? 308 THR A OG1 1 +ATOM 2336 O OG1 B THR A 1 288 ? 85.594 71.006 161.038 0.50 22.03 ? 308 THR A OG1 1 +ATOM 2337 C CG2 A THR A 1 288 ? 85.458 70.833 161.220 0.50 22.67 ? 308 THR A CG2 1 +ATOM 2338 C CG2 B THR A 1 288 ? 84.366 71.702 162.999 0.50 22.08 ? 308 THR A CG2 1 +ATOM 2339 N N . ALA A 1 289 ? 82.265 74.291 161.598 1.00 24.29 ? 309 ALA A N 1 +ATOM 2340 C CA . ALA A 1 289 ? 81.688 75.555 162.006 1.00 25.35 ? 309 ALA A CA 1 +ATOM 2341 C C . ALA A 1 289 ? 80.790 75.356 163.206 1.00 26.40 ? 309 ALA A C 1 +ATOM 2342 O O . ALA A 1 289 ? 80.163 74.309 163.358 1.00 26.58 ? 309 ALA A O 1 +ATOM 2343 C CB . ALA A 1 289 ? 80.890 76.149 160.853 1.00 25.35 ? 309 ALA A CB 1 +ATOM 2344 N N . GLN A 1 290 ? 80.737 76.379 164.051 1.00 27.65 ? 310 GLN A N 1 +ATOM 2345 C CA . GLN A 1 290 ? 79.841 76.405 165.194 1.00 28.62 ? 310 GLN A CA 1 +ATOM 2346 C C . GLN A 1 290 ? 78.616 77.235 164.822 1.00 28.82 ? 310 GLN A C 1 +ATOM 2347 O O . GLN A 1 290 ? 78.747 78.357 164.318 1.00 29.09 ? 310 GLN A O 1 +ATOM 2348 C CB . GLN A 1 290 ? 80.558 76.985 166.416 1.00 28.97 ? 310 GLN A CB 1 +ATOM 2349 C CG . GLN A 1 290 ? 81.581 76.026 167.053 1.00 30.12 ? 310 GLN A CG 1 +ATOM 2350 C CD . GLN A 1 290 ? 82.705 75.615 166.108 1.00 31.29 ? 310 GLN A CD 1 +ATOM 2351 O OE1 . GLN A 1 290 ? 82.980 76.289 165.112 1.00 33.14 ? 310 GLN A OE1 1 +ATOM 2352 N NE2 . GLN A 1 290 ? 83.357 74.496 166.417 1.00 31.51 ? 310 GLN A NE2 1 +ATOM 2353 N N . THR A 1 291 ? 77.432 76.670 165.050 1.00 29.10 ? 311 THR A N 1 +ATOM 2354 C CA . THR A 1 291 ? 76.169 77.293 164.648 1.00 29.21 ? 311 THR A CA 1 +ATOM 2355 C C . THR A 1 291 ? 75.183 77.364 165.819 1.00 29.36 ? 311 THR A C 1 +ATOM 2356 O O . THR A 1 291 ? 75.504 76.966 166.941 1.00 28.98 ? 311 THR A O 1 +ATOM 2357 C CB . THR A 1 291 ? 75.511 76.524 163.457 1.00 29.16 ? 311 THR A CB 1 +ATOM 2358 O OG1 . THR A 1 291 ? 74.906 75.303 163.916 1.00 29.05 ? 311 THR A OG1 1 +ATOM 2359 C CG2 . THR A 1 291 ? 76.545 76.210 162.378 1.00 29.28 ? 311 THR A CG2 1 +ATOM 2360 N N . SER A 1 292 ? 73.987 77.878 165.539 1.00 29.70 ? 312 SER A N 1 +ATOM 2361 C CA . SER A 1 292 ? 72.911 77.982 166.528 1.00 29.97 ? 312 SER A CA 1 +ATOM 2362 C C . SER A 1 292 ? 72.356 76.612 166.924 1.00 29.92 ? 312 SER A C 1 +ATOM 2363 O O . SER A 1 292 ? 71.810 76.453 168.017 1.00 30.19 ? 312 SER A O 1 +ATOM 2364 C CB . SER A 1 292 ? 71.770 78.848 165.984 1.00 29.87 ? 312 SER A CB 1 +ATOM 2365 O OG . SER A 1 292 ? 72.177 80.196 165.838 1.00 30.97 ? 312 SER A OG 1 +ATOM 2366 N N . LEU A 1 293 ? 72.482 75.634 166.031 1.00 29.85 ? 313 LEU A N 1 +ATOM 2367 C CA . LEU A 1 293 ? 72.056 74.261 166.308 1.00 29.54 ? 313 LEU A CA 1 +ATOM 2368 C C . LEU A 1 293 ? 73.256 73.332 166.512 1.00 29.31 ? 313 LEU A C 1 +ATOM 2369 O O . LEU A 1 293 ? 73.156 72.116 166.298 1.00 29.60 ? 313 LEU A O 1 +ATOM 2370 C CB . LEU A 1 293 ? 71.163 73.752 165.174 1.00 29.52 ? 313 LEU A CB 1 +ATOM 2371 C CG . LEU A 1 293 ? 69.935 74.612 164.865 1.00 29.99 ? 313 LEU A CG 1 +ATOM 2372 C CD1 . LEU A 1 293 ? 69.152 74.033 163.707 1.00 30.52 ? 313 LEU A CD1 1 +ATOM 2373 C CD2 . LEU A 1 293 ? 69.040 74.759 166.093 1.00 30.41 ? 313 LEU A CD2 1 +ATOM 2374 N N . GLY A 1 294 ? 74.384 73.907 166.924 1.00 28.88 ? 314 GLY A N 1 +ATOM 2375 C CA . GLY A 1 294 ? 75.585 73.136 167.244 1.00 28.42 ? 314 GLY A CA 1 +ATOM 2376 C C . GLY A 1 294 ? 76.646 73.174 166.160 1.00 28.05 ? 314 GLY A C 1 +ATOM 2377 O O . GLY A 1 294 ? 76.493 73.866 165.149 1.00 28.05 ? 314 GLY A O 1 +ATOM 2378 N N . PRO A 1 295 ? 77.744 72.430 166.365 1.00 27.49 ? 315 PRO A N 1 +ATOM 2379 C CA . PRO A 1 295 ? 78.765 72.369 165.334 1.00 27.03 ? 315 PRO A CA 1 +ATOM 2380 C C . PRO A 1 295 ? 78.294 71.554 164.128 1.00 26.43 ? 315 PRO A C 1 +ATOM 2381 O O . PRO A 1 295 ? 77.518 70.606 164.272 1.00 26.65 ? 315 PRO A O 1 +ATOM 2382 C CB . PRO A 1 295 ? 79.949 71.703 166.043 1.00 26.99 ? 315 PRO A CB 1 +ATOM 2383 C CG . PRO A 1 295 ? 79.326 70.871 167.092 1.00 27.43 ? 315 PRO A CG 1 +ATOM 2384 C CD . PRO A 1 295 ? 78.092 71.602 167.533 1.00 27.63 ? 315 PRO A CD 1 +ATOM 2385 N N . VAL A 1 296 ? 78.744 71.953 162.944 1.00 25.71 ? 316 VAL A N 1 +ATOM 2386 C CA . VAL A 1 296 ? 78.438 71.239 161.715 1.00 24.67 ? 316 VAL A CA 1 +ATOM 2387 C C . VAL A 1 296 ? 79.724 71.036 160.936 1.00 23.89 ? 316 VAL A C 1 +ATOM 2388 O O . VAL A 1 296 ? 80.726 71.720 161.175 1.00 24.01 ? 316 VAL A O 1 +ATOM 2389 C CB . VAL A 1 296 ? 77.403 72.006 160.837 1.00 24.53 ? 316 VAL A CB 1 +ATOM 2390 C CG1 . VAL A 1 296 ? 76.197 72.434 161.671 1.00 24.72 ? 316 VAL A CG1 1 +ATOM 2391 C CG2 . VAL A 1 296 ? 78.039 73.214 160.155 1.00 24.63 ? 316 VAL A CG2 1 +ATOM 2392 N N . SER A 1 297 ? 79.693 70.075 160.020 1.00 23.08 ? 317 SER A N 1 +ATOM 2393 C CA . SER A 1 297 ? 80.787 69.847 159.081 1.00 22.54 ? 317 SER A CA 1 +ATOM 2394 C C . SER A 1 297 ? 80.272 69.973 157.654 1.00 21.59 ? 317 SER A C 1 +ATOM 2395 O O . SER A 1 297 ? 79.162 69.517 157.351 1.00 21.39 ? 317 SER A O 1 +ATOM 2396 C CB . SER A 1 297 ? 81.385 68.461 159.287 1.00 22.42 ? 317 SER A CB 1 +ATOM 2397 O OG . SER A 1 297 ? 81.874 68.329 160.607 1.00 23.65 ? 317 SER A OG 1 +ATOM 2398 N N . ASP A 1 298 ? 81.071 70.603 156.789 1.00 20.22 ? 318 ASP A N 1 +ATOM 2399 C CA . ASP A 1 298 ? 80.763 70.690 155.373 1.00 19.77 ? 318 ASP A CA 1 +ATOM 2400 C C . ASP A 1 298 ? 81.960 70.203 154.568 1.00 19.44 ? 318 ASP A C 1 +ATOM 2401 O O . ASP A 1 298 ? 83.097 70.544 154.889 1.00 19.30 ? 318 ASP A O 1 +ATOM 2402 C CB . ASP A 1 298 ? 80.415 72.127 154.995 1.00 19.37 ? 318 ASP A CB 1 +ATOM 2403 C CG . ASP A 1 298 ? 79.723 72.237 153.651 1.00 18.92 ? 318 ASP A CG 1 +ATOM 2404 O OD1 . ASP A 1 298 ? 78.986 71.312 153.257 1.00 20.13 ? 318 ASP A OD1 1 +ATOM 2405 O OD2 . ASP A 1 298 ? 79.904 73.284 152.995 1.00 17.97 ? 318 ASP A OD2 1 +ATOM 2406 N N . PHE A 1 299 ? 81.684 69.391 153.547 1.00 19.34 ? 319 PHE A N 1 +ATOM 2407 C CA . PHE A 1 299 ? 82.700 68.808 152.665 1.00 18.88 ? 319 PHE A CA 1 +ATOM 2408 C C . PHE A 1 299 ? 82.384 69.147 151.214 1.00 18.07 ? 319 PHE A C 1 +ATOM 2409 O O . PHE A 1 299 ? 81.260 68.915 150.758 1.00 17.07 ? 319 PHE A O 1 +ATOM 2410 C CB . PHE A 1 299 ? 82.706 67.280 152.774 1.00 19.85 ? 319 PHE A CB 1 +ATOM 2411 C CG . PHE A 1 299 ? 83.417 66.743 153.980 1.00 20.92 ? 319 PHE A CG 1 +ATOM 2412 C CD1 . PHE A 1 299 ? 82.725 66.462 155.146 1.00 22.11 ? 319 PHE A CD1 1 +ATOM 2413 C CD2 . PHE A 1 299 ? 84.778 66.490 153.934 1.00 22.59 ? 319 PHE A CD2 1 +ATOM 2414 C CE1 . PHE A 1 299 ? 83.385 65.948 156.253 1.00 22.24 ? 319 PHE A CE1 1 +ATOM 2415 C CE2 . PHE A 1 299 ? 85.440 65.982 155.035 1.00 22.74 ? 319 PHE A CE2 1 +ATOM 2416 C CZ . PHE A 1 299 ? 84.741 65.708 156.195 1.00 22.20 ? 319 PHE A CZ 1 +ATOM 2417 N N . TYR A 1 300 ? 83.366 69.694 150.497 1.00 17.04 ? 320 TYR A N 1 +ATOM 2418 C CA . TYR A 1 300 ? 83.269 69.873 149.042 1.00 16.34 ? 320 TYR A CA 1 +ATOM 2419 C C . TYR A 1 300 ? 84.619 69.556 148.412 1.00 16.32 ? 320 TYR A C 1 +ATOM 2420 O O . TYR A 1 300 ? 85.662 69.936 148.951 1.00 16.21 ? 320 TYR A O 1 +ATOM 2421 C CB . TYR A 1 300 ? 82.835 71.298 148.668 1.00 15.79 ? 320 TYR A CB 1 +ATOM 2422 C CG . TYR A 1 300 ? 82.470 71.440 147.206 1.00 15.31 ? 320 TYR A CG 1 +ATOM 2423 C CD1 . TYR A 1 300 ? 83.437 71.739 146.252 1.00 15.61 ? 320 TYR A CD1 1 +ATOM 2424 C CD2 . TYR A 1 300 ? 81.155 71.264 146.772 1.00 14.07 ? 320 TYR A CD2 1 +ATOM 2425 C CE1 . TYR A 1 300 ? 83.113 71.851 144.904 1.00 14.82 ? 320 TYR A CE1 1 +ATOM 2426 C CE2 . TYR A 1 300 ? 80.815 71.383 145.427 1.00 13.64 ? 320 TYR A CE2 1 +ATOM 2427 C CZ . TYR A 1 300 ? 81.802 71.681 144.497 1.00 14.41 ? 320 TYR A CZ 1 +ATOM 2428 O OH . TYR A 1 300 ? 81.480 71.804 143.165 1.00 15.37 ? 320 TYR A OH 1 +ATOM 2429 N N . THR A 1 301 ? 84.597 68.845 147.284 1.00 15.46 ? 321 THR A N 1 +ATOM 2430 C CA . THR A 1 301 ? 85.822 68.451 146.593 1.00 15.11 ? 321 THR A CA 1 +ATOM 2431 C C . THR A 1 301 ? 85.851 68.937 145.147 1.00 15.18 ? 321 THR A C 1 +ATOM 2432 O O . THR A 1 301 ? 84.988 68.572 144.342 1.00 14.89 ? 321 THR A O 1 +ATOM 2433 C CB . THR A 1 301 ? 86.000 66.933 146.596 1.00 15.56 ? 321 THR A CB 1 +ATOM 2434 O OG1 . THR A 1 301 ? 85.991 66.473 147.947 1.00 14.79 ? 321 THR A OG1 1 +ATOM 2435 C CG2 . THR A 1 301 ? 87.332 66.555 145.949 1.00 15.14 ? 321 THR A CG2 1 +ATOM 2436 N N . LEU A 1 302 ? 86.874 69.729 144.830 1.00 15.22 ? 322 LEU A N 1 +ATOM 2437 C CA . LEU A 1 302 ? 87.007 70.400 143.536 1.00 14.67 ? 322 LEU A CA 1 +ATOM 2438 C C . LEU A 1 302 ? 88.153 69.763 142.761 1.00 14.48 ? 322 LEU A C 1 +ATOM 2439 O O . LEU A 1 302 ? 89.264 69.707 143.275 1.00 14.85 ? 322 LEU A O 1 +ATOM 2440 C CB . LEU A 1 302 ? 87.306 71.884 143.765 1.00 14.74 ? 322 LEU A CB 1 +ATOM 2441 C CG . LEU A 1 302 ? 87.463 72.817 142.556 1.00 14.90 ? 322 LEU A CG 1 +ATOM 2442 C CD1 . LEU A 1 302 ? 86.127 73.068 141.867 1.00 14.12 ? 322 LEU A CD1 1 +ATOM 2443 C CD2 . LEU A 1 302 ? 88.070 74.169 142.977 1.00 14.59 ? 322 LEU A CD2 1 +ATOM 2444 N N . PRO A 1 303 ? 87.895 69.259 141.540 1.00 13.98 ? 323 PRO A N 1 +ATOM 2445 C CA . PRO A 1 303 ? 89.025 68.784 140.727 1.00 14.01 ? 323 PRO A CA 1 +ATOM 2446 C C . PRO A 1 303 ? 89.987 69.918 140.369 1.00 14.22 ? 323 PRO A C 1 +ATOM 2447 O O . PRO A 1 303 ? 89.550 71.047 140.103 1.00 13.71 ? 323 PRO A O 1 +ATOM 2448 C CB . PRO A 1 303 ? 88.357 68.208 139.473 1.00 13.91 ? 323 PRO A CB 1 +ATOM 2449 C CG . PRO A 1 303 ? 86.927 68.021 139.835 1.00 13.90 ? 323 PRO A CG 1 +ATOM 2450 C CD . PRO A 1 303 ? 86.605 69.048 140.860 1.00 13.84 ? 323 PRO A CD 1 +ATOM 2451 N N . VAL A 1 304 ? 91.288 69.621 140.376 1.00 13.85 ? 324 VAL A N 1 +ATOM 2452 C CA . VAL A 1 304 ? 92.297 70.638 140.097 1.00 13.31 ? 324 VAL A CA 1 +ATOM 2453 C C . VAL A 1 304 ? 93.308 70.130 139.071 1.00 12.93 ? 324 VAL A C 1 +ATOM 2454 O O . VAL A 1 304 ? 93.874 69.042 139.222 1.00 12.54 ? 324 VAL A O 1 +ATOM 2455 C CB . VAL A 1 304 ? 93.040 71.089 141.396 1.00 13.65 ? 324 VAL A CB 1 +ATOM 2456 C CG1 . VAL A 1 304 ? 94.228 71.993 141.070 1.00 12.73 ? 324 VAL A CG1 1 +ATOM 2457 C CG2 . VAL A 1 304 ? 92.086 71.796 142.324 1.00 14.02 ? 324 VAL A CG2 1 +ATOM 2458 N N . GLY A 1 305 ? 93.509 70.922 138.024 1.00 12.97 ? 325 GLY A N 1 +ATOM 2459 C CA . GLY A 1 305 ? 94.503 70.634 136.992 1.00 13.13 ? 325 GLY A CA 1 +ATOM 2460 C C . GLY A 1 305 ? 95.578 71.695 137.047 1.00 13.58 ? 325 GLY A C 1 +ATOM 2461 O O . GLY A 1 305 ? 95.320 72.895 136.812 1.00 12.84 ? 325 GLY A O 1 +ATOM 2462 N N . ILE A 1 306 ? 96.792 71.258 137.366 1.00 13.28 ? 326 ILE A N 1 +ATOM 2463 C CA . ILE A 1 306 ? 97.896 72.175 137.550 1.00 13.75 ? 326 ILE A CA 1 +ATOM 2464 C C . ILE A 1 306 ? 98.483 72.482 136.185 1.00 13.18 ? 326 ILE A C 1 +ATOM 2465 O O . ILE A 1 306 ? 99.127 71.633 135.563 1.00 12.95 ? 326 ILE A O 1 +ATOM 2466 C CB . ILE A 1 306 ? 98.951 71.588 138.502 1.00 13.65 ? 326 ILE A CB 1 +ATOM 2467 C CG1 . ILE A 1 306 ? 98.359 71.488 139.911 1.00 16.26 ? 326 ILE A CG1 1 +ATOM 2468 C CG2 . ILE A 1 306 ? 100.216 72.439 138.498 1.00 14.62 ? 326 ILE A CG2 1 +ATOM 2469 C CD1 . ILE A 1 306 ? 99.238 70.784 140.907 1.00 16.96 ? 326 ILE A CD1 1 +ATOM 2470 N N . ARG A 1 307 ? 98.206 73.695 135.715 1.00 13.34 ? 327 ARG A N 1 +ATOM 2471 C CA . ARG A 1 307 ? 98.628 74.124 134.397 1.00 13.81 ? 327 ARG A CA 1 +ATOM 2472 C C . ARG A 1 307 ? 98.616 75.653 134.312 1.00 13.65 ? 327 ARG A C 1 +ATOM 2473 O O . ARG A 1 307 ? 97.875 76.317 135.049 1.00 13.83 ? 327 ARG A O 1 +ATOM 2474 C CB . ARG A 1 307 ? 97.723 73.502 133.320 1.00 13.76 ? 327 ARG A CB 1 +ATOM 2475 C CG . ARG A 1 307 ? 96.274 74.029 133.308 1.00 13.72 ? 327 ARG A CG 1 +ATOM 2476 C CD . ARG A 1 307 ? 96.107 75.116 132.252 1.00 14.59 ? 327 ARG A CD 1 +ATOM 2477 N NE . ARG A 1 307 ? 94.804 75.779 132.264 1.00 14.73 ? 327 ARG A NE 1 +ATOM 2478 C CZ . ARG A 1 307 ? 94.469 76.813 133.036 1.00 14.86 ? 327 ARG A CZ 1 +ATOM 2479 N NH1 . ARG A 1 307 ? 95.324 77.336 133.909 1.00 15.46 ? 327 ARG A NH1 1 +ATOM 2480 N NH2 . ARG A 1 307 ? 93.252 77.339 132.921 1.00 13.90 ? 327 ARG A NH2 1 +ATOM 2481 N N . THR A 1 308 ? 99.439 76.201 133.419 1.00 13.77 ? 328 THR A N 1 +ATOM 2482 C CA . THR A 1 308 ? 99.486 77.641 133.172 1.00 13.62 ? 328 THR A CA 1 +ATOM 2483 C C . THR A 1 308 ? 99.187 77.966 131.714 1.00 13.98 ? 328 THR A C 1 +ATOM 2484 O O . THR A 1 308 ? 99.356 77.123 130.839 1.00 13.99 ? 328 THR A O 1 +ATOM 2485 C CB . THR A 1 308 ? 100.871 78.234 133.485 1.00 14.03 ? 328 THR A CB 1 +ATOM 2486 O OG1 . THR A 1 308 ? 101.851 77.613 132.646 1.00 14.39 ? 328 THR A OG1 1 +ATOM 2487 C CG2 . THR A 1 308 ? 101.222 78.024 134.945 1.00 12.70 ? 328 THR A CG2 1 +ATOM 2488 N N . VAL A 1 309 ? 98.743 79.199 131.479 1.00 14.25 ? 329 VAL A N 1 +ATOM 2489 C CA . VAL A 1 309 ? 98.477 79.713 130.138 1.00 14.03 ? 329 VAL A CA 1 +ATOM 2490 C C . VAL A 1 309 ? 99.086 81.114 129.986 1.00 14.45 ? 329 VAL A C 1 +ATOM 2491 O O . VAL A 1 309 ? 98.949 81.972 130.871 1.00 14.38 ? 329 VAL A O 1 +ATOM 2492 C CB . VAL A 1 309 ? 96.948 79.783 129.822 1.00 14.50 ? 329 VAL A CB 1 +ATOM 2493 C CG1 . VAL A 1 309 ? 96.720 80.159 128.357 1.00 13.89 ? 329 VAL A CG1 1 +ATOM 2494 C CG2 . VAL A 1 309 ? 96.258 78.461 130.143 1.00 14.12 ? 329 VAL A CG2 1 +ATOM 2495 N N . ALA A 1 310 ? 99.757 81.333 128.859 1.00 14.76 ? 330 ALA A N 1 +ATOM 2496 C CA . ALA A 1 310 ? 100.346 82.628 128.554 1.00 15.34 ? 330 ALA A CA 1 +ATOM 2497 C C . ALA A 1 310 ? 100.383 82.856 127.053 1.00 15.66 ? 330 ALA A C 1 +ATOM 2498 O O . ALA A 1 310 ? 100.459 81.909 126.276 1.00 15.89 ? 330 ALA A O 1 +ATOM 2499 C CB . ALA A 1 310 ? 101.756 82.721 129.138 1.00 15.83 ? 330 ALA A CB 1 +ATOM 2500 N N . VAL A 1 311 ? 100.311 84.125 126.664 1.00 15.99 ? 331 VAL A N 1 +ATOM 2501 C CA . VAL A 1 311 ? 100.317 84.528 125.264 1.00 16.33 ? 331 VAL A CA 1 +ATOM 2502 C C . VAL A 1 311 ? 101.498 85.467 125.004 1.00 16.54 ? 331 VAL A C 1 +ATOM 2503 O O . VAL A 1 311 ? 101.696 86.458 125.721 1.00 16.64 ? 331 VAL A O 1 +ATOM 2504 C CB . VAL A 1 311 ? 98.999 85.246 124.903 1.00 16.45 ? 331 VAL A CB 1 +ATOM 2505 C CG1 . VAL A 1 311 ? 98.901 85.481 123.408 1.00 17.18 ? 331 VAL A CG1 1 +ATOM 2506 C CG2 . VAL A 1 311 ? 97.810 84.442 125.398 1.00 15.86 ? 331 VAL A CG2 1 +ATOM 2507 N N . THR A 1 312 ? 102.277 85.149 123.976 1.00 16.93 ? 332 THR A N 1 +ATOM 2508 C CA . THR A 1 312 ? 103.410 85.982 123.563 1.00 17.38 ? 332 THR A CA 1 +ATOM 2509 C C . THR A 1 312 ? 103.017 86.670 122.256 1.00 17.37 ? 332 THR A C 1 +ATOM 2510 O O . THR A 1 312 ? 101.838 86.676 121.903 1.00 17.77 ? 332 THR A O 1 +ATOM 2511 C CB . THR A 1 312 ? 104.702 85.132 123.442 1.00 17.28 ? 332 THR A CB 1 +ATOM 2512 O OG1 . THR A 1 312 ? 104.661 84.322 122.269 1.00 17.16 ? 332 THR A OG1 1 +ATOM 2513 C CG2 . THR A 1 312 ? 104.860 84.222 124.659 1.00 17.91 ? 332 THR A CG2 1 +ATOM 2514 N N . LYS A 1 313 ? 103.963 87.267 121.537 1.00 17.34 ? 333 LYS A N 1 +ATOM 2515 C CA . LYS A 1 313 ? 103.617 87.961 120.296 1.00 17.56 ? 333 LYS A CA 1 +ATOM 2516 C C . LYS A 1 313 ? 103.325 86.999 119.147 1.00 16.70 ? 333 LYS A C 1 +ATOM 2517 O O . LYS A 1 313 ? 102.711 87.394 118.156 1.00 17.16 ? 333 LYS A O 1 +ATOM 2518 C CB . LYS A 1 313 ? 104.715 88.949 119.880 1.00 17.70 ? 333 LYS A CB 1 +ATOM 2519 C CG . LYS A 1 313 ? 104.791 90.205 120.755 1.00 18.55 ? 333 LYS A CG 1 +ATOM 2520 C CD . LYS A 1 313 ? 105.782 91.208 120.169 1.00 19.07 ? 333 LYS A CD 1 +ATOM 2521 C CE . LYS A 1 313 ? 106.556 91.950 121.226 1.00 21.38 ? 333 LYS A CE 1 +ATOM 2522 N NZ . LYS A 1 313 ? 107.918 92.263 120.738 1.00 23.30 ? 333 LYS A NZ 1 +ATOM 2523 N N . SER A 1 314 ? 103.763 85.752 119.274 1.00 16.47 ? 334 SER A N 1 +ATOM 2524 C CA . SER A 1 314 ? 103.553 84.754 118.226 1.00 16.12 ? 334 SER A CA 1 +ATOM 2525 C C . SER A 1 314 ? 103.148 83.356 118.714 1.00 15.60 ? 334 SER A C 1 +ATOM 2526 O O . SER A 1 314 ? 102.924 82.473 117.887 1.00 15.19 ? 334 SER A O 1 +ATOM 2527 C CB . SER A 1 314 ? 104.844 84.628 117.420 1.00 16.40 ? 334 SER A CB 1 +ATOM 2528 O OG . SER A 1 314 ? 105.842 84.007 118.213 1.00 17.66 ? 334 SER A OG 1 +ATOM 2529 N N . GLN A 1 315 ? 103.053 83.144 120.026 1.00 15.21 ? 335 GLN A N 1 +ATOM 2530 C CA . GLN A 1 315 ? 102.794 81.797 120.573 1.00 15.17 ? 335 GLN A CA 1 +ATOM 2531 C C . GLN A 1 315 ? 101.715 81.810 121.652 1.00 14.17 ? 335 GLN A C 1 +ATOM 2532 O O . GLN A 1 315 ? 101.498 82.814 122.322 1.00 14.25 ? 335 GLN A O 1 +ATOM 2533 C CB . GLN A 1 315 ? 104.081 81.181 121.134 1.00 15.49 ? 335 GLN A CB 1 +ATOM 2534 C CG . GLN A 1 315 ? 105.132 80.905 120.078 1.00 16.39 ? 335 GLN A CG 1 +ATOM 2535 C CD . GLN A 1 315 ? 106.404 80.294 120.646 1.00 16.89 ? 335 GLN A CD 1 +ATOM 2536 O OE1 . GLN A 1 315 ? 106.898 80.710 121.694 1.00 21.28 ? 335 GLN A OE1 1 +ATOM 2537 N NE2 . GLN A 1 315 ? 106.936 79.302 119.953 1.00 20.77 ? 335 GLN A NE2 1 +ATOM 2538 N N . PHE A 1 316 ? 101.030 80.681 121.788 1.00 13.69 ? 336 PHE A N 1 +ATOM 2539 C CA . PHE A 1 316 ? 100.093 80.456 122.872 1.00 13.48 ? 336 PHE A CA 1 +ATOM 2540 C C . PHE A 1 316 ? 100.733 79.336 123.677 1.00 13.85 ? 336 PHE A C 1 +ATOM 2541 O O . PHE A 1 316 ? 100.906 78.232 123.170 1.00 13.98 ? 336 PHE A O 1 +ATOM 2542 C CB . PHE A 1 316 ? 98.726 80.042 122.296 1.00 13.19 ? 336 PHE A CB 1 +ATOM 2543 C CG . PHE A 1 316 ? 97.603 80.053 123.297 1.00 12.10 ? 336 PHE A CG 1 +ATOM 2544 C CD1 . PHE A 1 316 ? 97.465 79.023 124.217 1.00 12.74 ? 336 PHE A CD1 1 +ATOM 2545 C CD2 . PHE A 1 316 ? 96.668 81.097 123.316 1.00 12.12 ? 336 PHE A CD2 1 +ATOM 2546 C CE1 . PHE A 1 316 ? 96.419 79.026 125.143 1.00 11.99 ? 336 PHE A CE1 1 +ATOM 2547 C CE2 . PHE A 1 316 ? 95.620 81.105 124.244 1.00 12.02 ? 336 PHE A CE2 1 +ATOM 2548 C CZ . PHE A 1 316 ? 95.500 80.060 125.152 1.00 11.72 ? 336 PHE A CZ 1 +ATOM 2549 N N . LEU A 1 317 ? 101.134 79.641 124.912 1.00 14.05 ? 337 LEU A N 1 +ATOM 2550 C CA . LEU A 1 317 ? 101.878 78.695 125.727 1.00 14.14 ? 337 LEU A CA 1 +ATOM 2551 C C . LEU A 1 317 ? 101.008 78.041 126.792 1.00 13.91 ? 337 LEU A C 1 +ATOM 2552 O O . LEU A 1 317 ? 100.343 78.724 127.565 1.00 14.12 ? 337 LEU A O 1 +ATOM 2553 C CB . LEU A 1 317 ? 103.058 79.390 126.408 1.00 14.55 ? 337 LEU A CB 1 +ATOM 2554 C CG . LEU A 1 317 ? 104.094 80.068 125.510 1.00 14.75 ? 337 LEU A CG 1 +ATOM 2555 C CD1 . LEU A 1 317 ? 105.095 80.866 126.354 1.00 14.91 ? 337 LEU A CD1 1 +ATOM 2556 C CD2 . LEU A 1 317 ? 104.796 79.013 124.658 1.00 15.02 ? 337 LEU A CD2 1 +ATOM 2557 N N . ILE A 1 318 ? 101.038 76.716 126.830 1.00 13.66 ? 338 ILE A N 1 +ATOM 2558 C CA . ILE A 1 318 ? 100.445 75.953 127.911 1.00 13.57 ? 338 ILE A CA 1 +ATOM 2559 C C . ILE A 1 318 ? 101.590 75.287 128.659 1.00 13.79 ? 338 ILE A C 1 +ATOM 2560 O O . ILE A 1 318 ? 102.390 74.558 128.068 1.00 14.09 ? 338 ILE A O 1 +ATOM 2561 C CB . ILE A 1 318 ? 99.410 74.944 127.372 1.00 13.64 ? 338 ILE A CB 1 +ATOM 2562 C CG1 . ILE A 1 318 ? 98.222 75.722 126.810 1.00 12.85 ? 338 ILE A CG1 1 +ATOM 2563 C CG2 . ILE A 1 318 ? 98.936 73.982 128.465 1.00 13.11 ? 338 ILE A CG2 1 +ATOM 2564 C CD1 . ILE A 1 318 ? 96.973 74.893 126.541 1.00 13.22 ? 338 ILE A CD1 1 +ATOM 2565 N N . ASN A 1 319 ? 101.701 75.597 129.948 1.00 13.77 ? 339 ASN A N 1 +ATOM 2566 C CA . ASN A 1 319 ? 102.812 75.113 130.762 1.00 14.54 ? 339 ASN A CA 1 +ATOM 2567 C C . ASN A 1 319 ? 104.156 75.489 130.156 1.00 14.90 ? 339 ASN A C 1 +ATOM 2568 O O . ASN A 1 319 ? 105.118 74.701 130.195 1.00 15.69 ? 339 ASN A O 1 +ATOM 2569 C CB . ASN A 1 319 ? 102.719 73.593 130.922 1.00 14.12 ? 339 ASN A CB 1 +ATOM 2570 C CG . ASN A 1 319 ? 101.430 73.159 131.574 1.00 13.69 ? 339 ASN A CG 1 +ATOM 2571 O OD1 . ASN A 1 319 ? 100.825 73.924 132.328 1.00 15.43 ? 339 ASN A OD1 1 +ATOM 2572 N ND2 . ASN A 1 319 ? 101.002 71.937 131.294 1.00 13.85 ? 339 ASN A ND2 1 +ATOM 2573 N N . GLY A 1 320 ? 104.221 76.695 129.602 1.00 15.36 ? 340 GLY A N 1 +ATOM 2574 C CA . GLY A 1 320 ? 105.430 77.187 128.947 1.00 15.59 ? 340 GLY A CA 1 +ATOM 2575 C C . GLY A 1 320 ? 105.823 76.553 127.617 1.00 15.87 ? 340 GLY A C 1 +ATOM 2576 O O . GLY A 1 320 ? 106.893 76.878 127.081 1.00 16.27 ? 340 GLY A O 1 +ATOM 2577 N N . LYS A 1 321 ? 104.992 75.656 127.072 1.00 15.45 ? 341 LYS A N 1 +ATOM 2578 C CA . LYS A 1 321 ? 105.286 75.001 125.791 1.00 15.65 ? 341 LYS A CA 1 +ATOM 2579 C C . LYS A 1 321 ? 104.322 75.503 124.717 1.00 14.83 ? 341 LYS A C 1 +ATOM 2580 O O . LYS A 1 321 ? 103.141 75.705 125.019 1.00 14.57 ? 341 LYS A O 1 +ATOM 2581 C CB . LYS A 1 321 ? 105.160 73.489 125.925 1.00 15.65 ? 341 LYS A CB 1 +ATOM 2582 C CG . LYS A 1 321 ? 106.188 72.866 126.862 1.00 18.20 ? 341 LYS A CG 1 +ATOM 2583 C CD . LYS A 1 321 ? 106.530 71.421 126.459 1.00 21.05 ? 341 LYS A CD 1 +ATOM 2584 C CE . LYS A 1 321 ? 107.472 71.368 125.261 1.00 22.47 ? 341 LYS A CE 1 +ATOM 2585 N NZ . LYS A 1 321 ? 108.844 71.884 125.561 1.00 23.39 ? 341 LYS A NZ 1 +ATOM 2586 N N . PRO A 1 322 ? 104.813 75.708 123.473 1.00 14.51 ? 342 PRO A N 1 +ATOM 2587 C CA . PRO A 1 322 ? 103.926 76.140 122.384 1.00 14.52 ? 342 PRO A CA 1 +ATOM 2588 C C . PRO A 1 322 ? 102.768 75.171 122.177 1.00 13.70 ? 342 PRO A C 1 +ATOM 2589 O O . PRO A 1 322 ? 102.985 73.971 122.066 1.00 14.07 ? 342 PRO A O 1 +ATOM 2590 C CB . PRO A 1 322 ? 104.829 76.139 121.147 1.00 14.64 ? 342 PRO A CB 1 +ATOM 2591 C CG . PRO A 1 322 ? 106.221 76.083 121.640 1.00 14.93 ? 342 PRO A CG 1 +ATOM 2592 C CD . PRO A 1 322 ? 106.211 75.556 123.028 1.00 14.67 ? 342 PRO A CD 1 +ATOM 2593 N N . PHE A 1 323 ? 101.557 75.714 122.122 1.00 13.14 ? 343 PHE A N 1 +ATOM 2594 C CA . PHE A 1 323 ? 100.354 74.945 121.882 1.00 12.22 ? 343 PHE A CA 1 +ATOM 2595 C C . PHE A 1 323 ? 99.714 75.408 120.580 1.00 11.43 ? 343 PHE A C 1 +ATOM 2596 O O . PHE A 1 323 ? 99.757 76.603 120.232 1.00 11.16 ? 343 PHE A O 1 +ATOM 2597 C CB . PHE A 1 323 ? 99.390 75.155 123.052 1.00 12.39 ? 343 PHE A CB 1 +ATOM 2598 C CG . PHE A 1 323 ? 98.069 74.463 122.890 1.00 12.08 ? 343 PHE A CG 1 +ATOM 2599 C CD1 . PHE A 1 323 ? 97.980 73.093 122.995 1.00 11.80 ? 343 PHE A CD1 1 +ATOM 2600 C CD2 . PHE A 1 323 ? 96.915 75.192 122.636 1.00 12.16 ? 343 PHE A CD2 1 +ATOM 2601 C CE1 . PHE A 1 323 ? 96.757 72.448 122.858 1.00 12.36 ? 343 PHE A CE1 1 +ATOM 2602 C CE2 . PHE A 1 323 ? 95.693 74.552 122.501 1.00 11.56 ? 343 PHE A CE2 1 +ATOM 2603 C CZ . PHE A 1 323 ? 95.620 73.185 122.606 1.00 11.70 ? 343 PHE A CZ 1 +ATOM 2604 N N . TYR A 1 324 ? 99.140 74.453 119.860 1.00 10.85 ? 344 TYR A N 1 +ATOM 2605 C CA . TYR A 1 324 ? 98.399 74.744 118.655 1.00 10.24 ? 344 TYR A CA 1 +ATOM 2606 C C . TYR A 1 324 ? 97.013 74.153 118.811 1.00 10.11 ? 344 TYR A C 1 +ATOM 2607 O O . TYR A 1 324 ? 96.864 72.939 119.061 1.00 10.28 ? 344 TYR A O 1 +ATOM 2608 C CB . TYR A 1 324 ? 99.093 74.166 117.425 1.00 10.16 ? 344 TYR A CB 1 +ATOM 2609 C CG . TYR A 1 324 ? 98.491 74.610 116.116 1.00 9.93 ? 344 TYR A CG 1 +ATOM 2610 C CD1 . TYR A 1 324 ? 97.694 73.752 115.366 1.00 10.10 ? 344 TYR A CD1 1 +ATOM 2611 C CD2 . TYR A 1 324 ? 98.707 75.895 115.626 1.00 9.04 ? 344 TYR A CD2 1 +ATOM 2612 C CE1 . TYR A 1 324 ? 97.137 74.168 114.160 1.00 10.09 ? 344 TYR A CE1 1 +ATOM 2613 C CE2 . TYR A 1 324 ? 98.161 76.313 114.439 1.00 10.22 ? 344 TYR A CE2 1 +ATOM 2614 C CZ . TYR A 1 324 ? 97.366 75.450 113.704 1.00 10.24 ? 344 TYR A CZ 1 +ATOM 2615 O OH . TYR A 1 324 ? 96.824 75.886 112.515 1.00 11.36 ? 344 TYR A OH 1 +ATOM 2616 N N . PHE A 1 325 ? 96.008 75.014 118.709 1.00 10.22 ? 345 PHE A N 1 +ATOM 2617 C CA . PHE A 1 325 ? 94.615 74.555 118.715 1.00 9.87 ? 345 PHE A CA 1 +ATOM 2618 C C . PHE A 1 325 ? 94.364 73.851 117.394 1.00 9.67 ? 345 PHE A C 1 +ATOM 2619 O O . PHE A 1 325 ? 94.522 74.464 116.337 1.00 9.44 ? 345 PHE A O 1 +ATOM 2620 C CB . PHE A 1 325 ? 93.630 75.721 118.803 1.00 10.41 ? 345 PHE A CB 1 +ATOM 2621 C CG . PHE A 1 325 ? 93.656 76.471 120.097 1.00 10.62 ? 345 PHE A CG 1 +ATOM 2622 C CD1 . PHE A 1 325 ? 92.625 76.326 121.020 1.00 10.63 ? 345 PHE A CD1 1 +ATOM 2623 C CD2 . PHE A 1 325 ? 94.677 77.366 120.375 1.00 11.03 ? 345 PHE A CD2 1 +ATOM 2624 C CE1 . PHE A 1 325 ? 92.638 77.032 122.203 1.00 10.67 ? 345 PHE A CE1 1 +ATOM 2625 C CE2 . PHE A 1 325 ? 94.691 78.067 121.547 1.00 10.94 ? 345 PHE A CE2 1 +ATOM 2626 C CZ . PHE A 1 325 ? 93.677 77.902 122.466 1.00 11.03 ? 345 PHE A CZ 1 +ATOM 2627 N N . HIS A 1 326 ? 93.967 72.584 117.441 1.00 9.39 ? 346 HIS A N 1 +ATOM 2628 C CA . HIS A 1 326 ? 93.468 71.910 116.240 1.00 8.75 ? 346 HIS A CA 1 +ATOM 2629 C C . HIS A 1 326 ? 92.146 71.263 116.593 1.00 8.24 ? 346 HIS A C 1 +ATOM 2630 O O . HIS A 1 326 ? 92.110 70.128 117.061 1.00 8.17 ? 346 HIS A O 1 +ATOM 2631 C CB . HIS A 1 326 ? 94.484 70.952 115.587 1.00 9.54 ? 346 HIS A CB 1 +ATOM 2632 C CG . HIS A 1 326 ? 95.190 70.002 116.516 1.00 8.77 ? 346 HIS A CG 1 +ATOM 2633 N ND1 . HIS A 1 326 ? 94.620 68.836 116.976 1.00 8.68 ? 346 HIS A ND1 1 +ATOM 2634 C CD2 . HIS A 1 326 ? 96.466 69.997 116.975 1.00 10.93 ? 346 HIS A CD2 1 +ATOM 2635 C CE1 . HIS A 1 326 ? 95.500 68.170 117.709 1.00 9.91 ? 346 HIS A CE1 1 +ATOM 2636 N NE2 . HIS A 1 326 ? 96.633 68.853 117.718 1.00 10.94 ? 346 HIS A NE2 1 +ATOM 2637 N N . GLY A 1 327 ? 91.061 72.000 116.368 1.00 7.37 ? 347 GLY A N 1 +ATOM 2638 C CA . GLY A 1 327 ? 89.808 71.670 117.025 1.00 7.36 ? 347 GLY A CA 1 +ATOM 2639 C C . GLY A 1 327 ? 88.578 71.974 116.227 1.00 6.95 ? 347 GLY A C 1 +ATOM 2640 O O . GLY A 1 327 ? 88.616 71.977 114.990 1.00 7.81 ? 347 GLY A O 1 +ATOM 2641 N N . VAL A 1 328 ? 87.483 72.213 116.942 1.00 7.36 ? 348 VAL A N 1 +ATOM 2642 C CA . VAL A 1 328 ? 86.198 72.457 116.296 1.00 7.04 ? 348 VAL A CA 1 +ATOM 2643 C C . VAL A 1 328 ? 85.399 73.543 117.024 1.00 7.24 ? 348 VAL A C 1 +ATOM 2644 O O . VAL A 1 328 ? 85.734 73.941 118.136 1.00 6.53 ? 348 VAL A O 1 +ATOM 2645 C CB . VAL A 1 328 ? 85.363 71.138 116.269 1.00 6.94 ? 348 VAL A CB 1 +ATOM 2646 C CG1 . VAL A 1 328 ? 86.137 69.992 115.615 1.00 7.14 ? 348 VAL A CG1 1 +ATOM 2647 C CG2 . VAL A 1 328 ? 84.915 70.754 117.673 1.00 6.81 ? 348 VAL A CG2 1 +ATOM 2648 N N . ASN A 1 329 ? 84.350 74.017 116.371 1.00 7.55 ? 349 ASN A N 1 +ATOM 2649 C CA . ASN A 1 329 ? 83.272 74.737 117.031 1.00 7.85 ? 349 ASN A CA 1 +ATOM 2650 C C . ASN A 1 329 ? 82.139 73.730 117.232 1.00 8.38 ? 349 ASN A C 1 +ATOM 2651 O O . ASN A 1 329 ? 81.997 72.798 116.441 1.00 7.31 ? 349 ASN A O 1 +ATOM 2652 C CB . ASN A 1 329 ? 82.820 75.895 116.156 1.00 7.97 ? 349 ASN A CB 1 +ATOM 2653 C CG . ASN A 1 329 ? 83.906 76.939 115.977 1.00 7.68 ? 349 ASN A CG 1 +ATOM 2654 O OD1 . ASN A 1 329 ? 84.080 77.795 116.833 1.00 8.25 ? 349 ASN A OD1 1 +ATOM 2655 N ND2 . ASN A 1 329 ? 84.615 76.885 114.858 1.00 4.91 ? 349 ASN A ND2 1 +ATOM 2656 N N . LYS A 1 330 ? 81.350 73.892 118.290 1.00 7.97 ? 350 LYS A N 1 +ATOM 2657 C CA . LYS A 1 330 ? 80.232 72.981 118.504 1.00 8.56 ? 350 LYS A CA 1 +ATOM 2658 C C . LYS A 1 330 ? 78.950 73.770 118.629 1.00 8.25 ? 350 LYS A C 1 +ATOM 2659 O O . LYS A 1 330 ? 78.916 74.965 118.367 1.00 8.27 ? 350 LYS A O 1 +ATOM 2660 C CB . LYS A 1 330 ? 80.483 72.100 119.744 1.00 8.95 ? 350 LYS A CB 1 +ATOM 2661 C CG . LYS A 1 330 ? 81.628 71.133 119.598 1.00 8.80 ? 350 LYS A CG 1 +ATOM 2662 C CD . LYS A 1 330 ? 81.739 70.209 120.798 1.00 9.55 ? 350 LYS A CD 1 +ATOM 2663 C CE . LYS A 1 330 ? 81.167 68.841 120.517 1.00 10.02 ? 350 LYS A CE 1 +ATOM 2664 N NZ . LYS A 1 330 ? 79.691 68.872 120.406 1.00 11.48 ? 350 LYS A NZ 1 +ATOM 2665 N N . HIS A 1 331 ? 77.873 73.078 118.961 1.00 7.65 ? 351 HIS A N 1 +ATOM 2666 C CA . HIS A 1 331 ? 76.642 73.697 119.422 1.00 7.76 ? 351 HIS A CA 1 +ATOM 2667 C C . HIS A 1 331 ? 75.985 72.678 120.339 1.00 8.41 ? 351 HIS A C 1 +ATOM 2668 O O . HIS A 1 331 ? 76.221 71.456 120.206 1.00 9.05 ? 351 HIS A O 1 +ATOM 2669 C CB . HIS A 1 331 ? 75.688 74.031 118.254 1.00 7.57 ? 351 HIS A CB 1 +ATOM 2670 C CG . HIS A 1 331 ? 75.694 75.471 117.843 1.00 6.52 ? 351 HIS A CG 1 +ATOM 2671 N ND1 . HIS A 1 331 ? 75.351 76.497 118.700 1.00 6.88 ? 351 HIS A ND1 1 +ATOM 2672 C CD2 . HIS A 1 331 ? 75.972 76.057 116.653 1.00 7.63 ? 351 HIS A CD2 1 +ATOM 2673 C CE1 . HIS A 1 331 ? 75.411 77.649 118.056 1.00 6.05 ? 351 HIS A CE1 1 +ATOM 2674 N NE2 . HIS A 1 331 ? 75.801 77.415 116.818 1.00 7.86 ? 351 HIS A NE2 1 +ATOM 2675 N N . GLU A 1 332 ? 75.199 73.173 121.280 1.00 7.95 ? 352 GLU A N 1 +ATOM 2676 C CA . GLU A 1 332 ? 74.309 72.311 122.049 1.00 7.59 ? 352 GLU A CA 1 +ATOM 2677 C C . GLU A 1 332 ? 73.066 72.119 121.204 1.00 7.59 ? 352 GLU A C 1 +ATOM 2678 O O . GLU A 1 332 ? 72.164 72.959 121.166 1.00 7.98 ? 352 GLU A O 1 +ATOM 2679 C CB . GLU A 1 332 ? 73.980 72.882 123.413 1.00 8.13 ? 352 GLU A CB 1 +ATOM 2680 C CG . GLU A 1 332 ? 75.172 72.822 124.347 1.00 9.04 ? 352 GLU A CG 1 +ATOM 2681 C CD . GLU A 1 332 ? 74.832 73.239 125.757 1.00 10.19 ? 352 GLU A CD 1 +ATOM 2682 O OE1 . GLU A 1 332 ? 74.115 74.248 125.920 1.00 10.91 ? 352 GLU A OE1 1 +ATOM 2683 O OE2 . GLU A 1 332 ? 75.308 72.577 126.702 1.00 13.58 ? 352 GLU A OE2 1 +ATOM 2684 N N . ASP A 1 333 ? 73.061 71.019 120.466 1.00 6.96 ? 353 ASP A N 1 +ATOM 2685 C CA . ASP A 1 333 ? 72.028 70.803 119.463 1.00 7.32 ? 353 ASP A CA 1 +ATOM 2686 C C . ASP A 1 333 ? 71.939 69.314 119.081 1.00 7.26 ? 353 ASP A C 1 +ATOM 2687 O O . ASP A 1 333 ? 72.948 68.683 118.785 1.00 7.33 ? 353 ASP A O 1 +ATOM 2688 C CB . ASP A 1 333 ? 72.310 71.665 118.232 1.00 6.91 ? 353 ASP A CB 1 +ATOM 2689 C CG . ASP A 1 333 ? 71.440 71.291 117.050 1.00 9.13 ? 353 ASP A CG 1 +ATOM 2690 O OD1 . ASP A 1 333 ? 71.705 70.237 116.430 1.00 7.75 ? 353 ASP A OD1 1 +ATOM 2691 O OD2 . ASP A 1 333 ? 70.495 72.051 116.759 1.00 8.51 ? 353 ASP A OD2 1 +ATOM 2692 N N . ALA A 1 334 ? 70.727 68.762 119.108 1.00 6.43 ? 354 ALA A N 1 +ATOM 2693 C CA . ALA A 1 334 ? 70.491 67.397 118.609 1.00 6.45 ? 354 ALA A CA 1 +ATOM 2694 C C . ALA A 1 334 ? 69.024 67.229 118.224 1.00 7.03 ? 354 ALA A C 1 +ATOM 2695 O O . ALA A 1 334 ? 68.202 68.075 118.549 1.00 7.32 ? 354 ALA A O 1 +ATOM 2696 C CB . ALA A 1 334 ? 70.891 66.351 119.655 1.00 6.82 ? 354 ALA A CB 1 +ATOM 2697 N N . ASP A 1 335 ? 68.717 66.158 117.497 1.00 7.19 ? 355 ASP A N 1 +ATOM 2698 C CA . ASP A 1 335 ? 67.346 65.856 117.115 1.00 7.53 ? 355 ASP A CA 1 +ATOM 2699 C C . ASP A 1 335 ? 66.425 65.783 118.321 1.00 7.79 ? 355 ASP A C 1 +ATOM 2700 O O . ASP A 1 335 ? 66.798 65.275 119.384 1.00 7.21 ? 355 ASP A O 1 +ATOM 2701 C CB . ASP A 1 335 ? 67.251 64.529 116.356 1.00 7.30 ? 355 ASP A CB 1 +ATOM 2702 C CG . ASP A 1 335 ? 67.891 64.598 114.991 1.00 8.32 ? 355 ASP A CG 1 +ATOM 2703 O OD1 . ASP A 1 335 ? 67.872 65.678 114.364 1.00 9.11 ? 355 ASP A OD1 1 +ATOM 2704 O OD2 . ASP A 1 335 ? 68.432 63.576 114.550 1.00 9.01 ? 355 ASP A OD2 1 +ATOM 2705 N N . ILE A 1 336 ? 65.224 66.317 118.113 1.00 8.13 ? 356 ILE A N 1 +ATOM 2706 C CA . ILE A 1 336 ? 64.108 66.224 119.045 1.00 8.73 ? 356 ILE A CA 1 +ATOM 2707 C C . ILE A 1 336 ? 64.266 67.045 120.317 1.00 8.81 ? 356 ILE A C 1 +ATOM 2708 O O . ILE A 1 336 ? 63.368 67.819 120.641 1.00 8.17 ? 356 ILE A O 1 +ATOM 2709 C CB . ILE A 1 336 ? 63.775 64.754 119.385 1.00 9.70 ? 356 ILE A CB 1 +ATOM 2710 C CG1 . ILE A 1 336 ? 63.572 63.954 118.096 1.00 10.45 ? 356 ILE A CG1 1 +ATOM 2711 C CG2 . ILE A 1 336 ? 62.518 64.679 120.249 1.00 9.33 ? 356 ILE A CG2 1 +ATOM 2712 C CD1 . ILE A 1 336 ? 62.561 64.575 117.137 1.00 13.58 ? 356 ILE A CD1 1 +ATOM 2713 N N . ARG A 1 337 ? 65.377 66.876 121.036 1.00 8.00 ? 357 ARG A N 1 +ATOM 2714 C CA . ARG A 1 337 ? 65.562 67.539 122.326 1.00 8.39 ? 357 ARG A CA 1 +ATOM 2715 C C . ARG A 1 337 ? 66.107 68.959 122.187 1.00 8.26 ? 357 ARG A C 1 +ATOM 2716 O O . ARG A 1 337 ? 66.271 69.668 123.193 1.00 8.75 ? 357 ARG A O 1 +ATOM 2717 C CB . ARG A 1 337 ? 66.543 66.749 123.191 1.00 8.51 ? 357 ARG A CB 1 +ATOM 2718 C CG . ARG A 1 337 ? 68.012 66.891 122.737 1.00 8.63 ? 357 ARG A CG 1 +ATOM 2719 C CD . ARG A 1 337 ? 68.897 65.785 123.287 1.00 8.62 ? 357 ARG A CD 1 +ATOM 2720 N NE . ARG A 1 337 ? 68.406 64.494 122.797 1.00 8.24 ? 357 ARG A NE 1 +ATOM 2721 C CZ . ARG A 1 337 ? 67.779 63.558 123.520 1.00 9.34 ? 357 ARG A CZ 1 +ATOM 2722 N NH1 . ARG A 1 337 ? 67.341 62.470 122.906 1.00 8.07 ? 357 ARG A NH1 1 +ATOM 2723 N NH2 . ARG A 1 337 ? 67.554 63.692 124.824 1.00 9.33 ? 357 ARG A NH2 1 +ATOM 2724 N N . GLY A 1 338 ? 66.462 69.351 120.963 1.00 8.31 ? 358 GLY A N 1 +ATOM 2725 C CA . GLY A 1 338 ? 67.012 70.681 120.720 1.00 8.15 ? 358 GLY A CA 1 +ATOM 2726 C C . GLY A 1 338 ? 68.330 70.888 121.436 1.00 7.61 ? 358 GLY A C 1 +ATOM 2727 O O . GLY A 1 338 ? 69.311 70.193 121.131 1.00 8.25 ? 358 GLY A O 1 +ATOM 2728 N N . LYS A 1 339 ? 68.356 71.822 122.401 1.00 7.34 ? 359 LYS A N 1 +ATOM 2729 C CA . LYS A 1 339 ? 69.576 72.120 123.182 1.00 7.76 ? 359 LYS A CA 1 +ATOM 2730 C C . LYS A 1 339 ? 69.617 71.344 124.512 1.00 8.43 ? 359 LYS A C 1 +ATOM 2731 O O . LYS A 1 339 ? 70.501 71.558 125.356 1.00 9.44 ? 359 LYS A O 1 +ATOM 2732 C CB . LYS A 1 339 ? 69.715 73.625 123.445 1.00 7.94 ? 359 LYS A CB 1 +ATOM 2733 C CG . LYS A 1 339 ? 69.447 74.483 122.198 1.00 7.65 ? 359 LYS A CG 1 +ATOM 2734 C CD . LYS A 1 339 ? 69.817 75.938 122.374 1.00 7.73 ? 359 LYS A CD 1 +ATOM 2735 C CE . LYS A 1 339 ? 71.312 76.135 122.353 1.00 7.75 ? 359 LYS A CE 1 +ATOM 2736 N NZ . LYS A 1 339 ? 71.880 75.620 121.060 1.00 8.76 ? 359 LYS A NZ 1 +ATOM 2737 N N . GLY A 1 340 ? 68.677 70.434 124.687 1.00 8.31 ? 360 GLY A N 1 +ATOM 2738 C CA . GLY A 1 340 ? 68.589 69.634 125.904 1.00 8.07 ? 360 GLY A CA 1 +ATOM 2739 C C . GLY A 1 340 ? 69.837 68.819 126.185 1.00 8.11 ? 360 GLY A C 1 +ATOM 2740 O O . GLY A 1 340 ? 70.406 68.169 125.287 1.00 7.96 ? 360 GLY A O 1 +ATOM 2741 N N . PHE A 1 341 ? 70.255 68.833 127.443 1.00 8.24 ? 361 PHE A N 1 +ATOM 2742 C CA . PHE A 1 341 ? 71.369 68.010 127.871 1.00 8.82 ? 361 PHE A CA 1 +ATOM 2743 C C . PHE A 1 341 ? 71.054 66.514 127.769 1.00 8.57 ? 361 PHE A C 1 +ATOM 2744 O O . PHE A 1 341 ? 69.943 66.079 128.097 1.00 8.68 ? 361 PHE A O 1 +ATOM 2745 C CB . PHE A 1 341 ? 71.792 68.348 129.301 1.00 8.85 ? 361 PHE A CB 1 +ATOM 2746 C CG . PHE A 1 341 ? 72.953 67.527 129.770 1.00 8.85 ? 361 PHE A CG 1 +ATOM 2747 C CD1 . PHE A 1 341 ? 74.246 67.871 129.413 1.00 8.91 ? 361 PHE A CD1 1 +ATOM 2748 C CD2 . PHE A 1 341 ? 72.751 66.375 130.508 1.00 11.33 ? 361 PHE A CD2 1 +ATOM 2749 C CE1 . PHE A 1 341 ? 75.321 67.093 129.802 1.00 10.67 ? 361 PHE A CE1 1 +ATOM 2750 C CE2 . PHE A 1 341 ? 73.829 65.588 130.906 1.00 10.43 ? 361 PHE A CE2 1 +ATOM 2751 C CZ . PHE A 1 341 ? 75.107 65.950 130.561 1.00 9.83 ? 361 PHE A CZ 1 +ATOM 2752 N N . ASP A 1 342 ? 72.049 65.730 127.367 1.00 8.85 ? 362 ASP A N 1 +ATOM 2753 C CA . ASP A 1 342 ? 71.881 64.277 127.150 1.00 9.01 ? 362 ASP A CA 1 +ATOM 2754 C C . ASP A 1 342 ? 73.187 63.530 127.361 1.00 9.29 ? 362 ASP A C 1 +ATOM 2755 O O . ASP A 1 342 ? 74.179 63.818 126.679 1.00 9.14 ? 362 ASP A O 1 +ATOM 2756 C CB . ASP A 1 342 ? 71.366 64.017 125.732 1.00 8.97 ? 362 ASP A CB 1 +ATOM 2757 C CG . ASP A 1 342 ? 71.133 62.555 125.443 1.00 10.95 ? 362 ASP A CG 1 +ATOM 2758 O OD1 . ASP A 1 342 ? 70.215 61.964 126.038 1.00 9.21 ? 362 ASP A OD1 1 +ATOM 2759 O OD2 . ASP A 1 342 ? 71.876 61.987 124.612 1.00 11.10 ? 362 ASP A OD2 1 +ATOM 2760 N N . TRP A 1 343 ? 73.184 62.534 128.254 1.00 9.45 ? 363 TRP A N 1 +ATOM 2761 C CA . TRP A 1 343 ? 74.424 61.815 128.571 1.00 9.63 ? 363 TRP A CA 1 +ATOM 2762 C C . TRP A 1 343 ? 75.000 61.019 127.392 1.00 8.99 ? 363 TRP A C 1 +ATOM 2763 O O . TRP A 1 343 ? 76.202 61.119 127.119 1.00 8.75 ? 363 TRP A O 1 +ATOM 2764 C CB . TRP A 1 343 ? 74.252 60.907 129.798 1.00 10.54 ? 363 TRP A CB 1 +ATOM 2765 C CG . TRP A 1 343 ? 74.329 61.650 131.076 1.00 11.70 ? 363 TRP A CG 1 +ATOM 2766 C CD1 . TRP A 1 343 ? 73.315 61.874 131.943 1.00 12.42 ? 363 TRP A CD1 1 +ATOM 2767 C CD2 . TRP A 1 343 ? 75.483 62.278 131.631 1.00 12.78 ? 363 TRP A CD2 1 +ATOM 2768 N NE1 . TRP A 1 343 ? 73.761 62.595 133.017 1.00 13.23 ? 363 TRP A NE1 1 +ATOM 2769 C CE2 . TRP A 1 343 ? 75.090 62.860 132.852 1.00 13.95 ? 363 TRP A CE2 1 +ATOM 2770 C CE3 . TRP A 1 343 ? 76.813 62.395 131.224 1.00 13.97 ? 363 TRP A CE3 1 +ATOM 2771 C CZ2 . TRP A 1 343 ? 75.973 63.571 133.661 1.00 13.78 ? 363 TRP A CZ2 1 +ATOM 2772 C CZ3 . TRP A 1 343 ? 77.697 63.105 132.040 1.00 13.68 ? 363 TRP A CZ3 1 +ATOM 2773 C CH2 . TRP A 1 343 ? 77.270 63.674 133.240 1.00 12.98 ? 363 TRP A CH2 1 +ATOM 2774 N N . PRO A 1 344 ? 74.176 60.202 126.710 1.00 8.39 ? 364 PRO A N 1 +ATOM 2775 C CA . PRO A 1 344 ? 74.724 59.481 125.552 1.00 8.56 ? 364 PRO A CA 1 +ATOM 2776 C C . PRO A 1 344 ? 75.364 60.347 124.454 1.00 8.83 ? 364 PRO A C 1 +ATOM 2777 O O . PRO A 1 344 ? 76.463 60.018 123.989 1.00 9.25 ? 364 PRO A O 1 +ATOM 2778 C CB . PRO A 1 344 ? 73.518 58.731 125.019 1.00 8.28 ? 364 PRO A CB 1 +ATOM 2779 C CG . PRO A 1 344 ? 72.680 58.484 126.250 1.00 8.27 ? 364 PRO A CG 1 +ATOM 2780 C CD . PRO A 1 344 ? 72.780 59.802 126.965 1.00 8.93 ? 364 PRO A CD 1 +ATOM 2781 N N . LEU A 1 345 ? 74.695 61.429 124.042 1.00 9.05 ? 365 LEU A N 1 +ATOM 2782 C CA . LEU A 1 345 ? 75.267 62.307 123.002 1.00 9.42 ? 365 LEU A CA 1 +ATOM 2783 C C . LEU A 1 345 ? 76.530 63.011 123.491 1.00 9.05 ? 365 LEU A C 1 +ATOM 2784 O O . LEU A 1 345 ? 77.462 63.223 122.714 1.00 8.70 ? 365 LEU A O 1 +ATOM 2785 C CB . LEU A 1 345 ? 74.253 63.351 122.519 1.00 9.96 ? 365 LEU A CB 1 +ATOM 2786 C CG . LEU A 1 345 ? 73.183 62.810 121.575 1.00 10.89 ? 365 LEU A CG 1 +ATOM 2787 C CD1 . LEU A 1 345 ? 71.980 63.754 121.487 1.00 11.44 ? 365 LEU A CD1 1 +ATOM 2788 C CD2 . LEU A 1 345 ? 73.774 62.512 120.196 1.00 14.25 ? 365 LEU A CD2 1 +ATOM 2789 N N . LEU A 1 346 ? 76.559 63.381 124.768 1.00 8.72 ? 366 LEU A N 1 +ATOM 2790 C CA . LEU A 1 346 ? 77.770 63.938 125.382 1.00 8.64 ? 366 LEU A CA 1 +ATOM 2791 C C . LEU A 1 346 ? 78.966 62.985 125.269 1.00 8.42 ? 366 LEU A C 1 +ATOM 2792 O O . LEU A 1 346 ? 80.034 63.372 124.801 1.00 7.95 ? 366 LEU A O 1 +ATOM 2793 C CB . LEU A 1 346 ? 77.533 64.234 126.862 1.00 9.05 ? 366 LEU A CB 1 +ATOM 2794 C CG . LEU A 1 346 ? 78.735 64.828 127.606 1.00 10.13 ? 366 LEU A CG 1 +ATOM 2795 C CD1 . LEU A 1 346 ? 78.997 66.267 127.164 1.00 11.41 ? 366 LEU A CD1 1 +ATOM 2796 C CD2 . LEU A 1 346 ? 78.499 64.732 129.114 1.00 11.64 ? 366 LEU A CD2 1 +ATOM 2797 N N . VAL A 1 347 ? 78.795 61.740 125.709 1.00 8.03 ? 367 VAL A N 1 +ATOM 2798 C CA . VAL A 1 347 ? 79.905 60.801 125.646 1.00 7.70 ? 367 VAL A CA 1 +ATOM 2799 C C . VAL A 1 347 ? 80.274 60.524 124.189 1.00 7.58 ? 367 VAL A C 1 +ATOM 2800 O O . VAL A 1 347 ? 81.458 60.489 123.838 1.00 8.42 ? 367 VAL A O 1 +ATOM 2801 C CB . VAL A 1 347 ? 79.612 59.490 126.412 1.00 7.34 ? 367 VAL A CB 1 +ATOM 2802 C CG1 . VAL A 1 347 ? 80.797 58.504 126.252 1.00 7.15 ? 367 VAL A CG1 1 +ATOM 2803 C CG2 . VAL A 1 347 ? 79.333 59.817 127.891 1.00 7.32 ? 367 VAL A CG2 1 +ATOM 2804 N N . LYS A 1 348 ? 79.264 60.381 123.331 1.00 7.34 ? 368 LYS A N 1 +ATOM 2805 C CA . LYS A 1 348 ? 79.501 60.138 121.911 1.00 7.78 ? 368 LYS A CA 1 +ATOM 2806 C C . LYS A 1 348 ? 80.356 61.231 121.321 1.00 8.43 ? 368 LYS A C 1 +ATOM 2807 O O . LYS A 1 348 ? 81.341 60.952 120.624 1.00 9.71 ? 368 LYS A O 1 +ATOM 2808 C CB . LYS A 1 348 ? 78.186 60.054 121.132 1.00 7.25 ? 368 LYS A CB 1 +ATOM 2809 C CG . LYS A 1 348 ? 78.369 59.764 119.645 1.00 7.47 ? 368 LYS A CG 1 +ATOM 2810 C CD . LYS A 1 348 ? 79.060 58.414 119.408 1.00 9.68 ? 368 LYS A CD 1 +ATOM 2811 C CE . LYS A 1 348 ? 79.123 58.075 117.934 1.00 9.21 ? 368 LYS A CE 1 +ATOM 2812 N NZ . LYS A 1 348 ? 79.626 56.662 117.718 1.00 8.44 ? 368 LYS A NZ 1 +ATOM 2813 N N . ASP A 1 349 ? 79.984 62.480 121.604 1.00 8.72 ? 369 ASP A N 1 +ATOM 2814 C CA . ASP A 1 349 ? 80.703 63.634 121.071 1.00 8.55 ? 369 ASP A CA 1 +ATOM 2815 C C . ASP A 1 349 ? 82.162 63.628 121.507 1.00 8.52 ? 369 ASP A C 1 +ATOM 2816 O O . ASP A 1 349 ? 83.052 63.864 120.679 1.00 9.02 ? 369 ASP A O 1 +ATOM 2817 C CB . ASP A 1 349 ? 80.031 64.945 121.477 1.00 8.56 ? 369 ASP A CB 1 +ATOM 2818 C CG . ASP A 1 349 ? 78.829 65.273 120.616 1.00 10.21 ? 369 ASP A CG 1 +ATOM 2819 O OD1 . ASP A 1 349 ? 78.467 64.427 119.782 1.00 9.07 ? 369 ASP A OD1 1 +ATOM 2820 O OD2 . ASP A 1 349 ? 78.263 66.380 120.750 1.00 10.61 ? 369 ASP A OD2 1 +ATOM 2821 N N . PHE A 1 350 ? 82.422 63.330 122.775 1.00 7.67 ? 370 PHE A N 1 +ATOM 2822 C CA . PHE A 1 350 ? 83.813 63.271 123.244 1.00 8.34 ? 370 PHE A CA 1 +ATOM 2823 C C . PHE A 1 350 ? 84.607 62.139 122.621 1.00 8.59 ? 370 PHE A C 1 +ATOM 2824 O O . PHE A 1 350 ? 85.791 62.311 122.291 1.00 8.83 ? 370 PHE A O 1 +ATOM 2825 C CB . PHE A 1 350 ? 83.893 63.288 124.762 1.00 8.28 ? 370 PHE A CB 1 +ATOM 2826 C CG . PHE A 1 350 ? 83.807 64.680 125.317 1.00 8.53 ? 370 PHE A CG 1 +ATOM 2827 C CD1 . PHE A 1 350 ? 84.954 65.417 125.557 1.00 7.42 ? 370 PHE A CD1 1 +ATOM 2828 C CD2 . PHE A 1 350 ? 82.574 65.284 125.520 1.00 7.92 ? 370 PHE A CD2 1 +ATOM 2829 C CE1 . PHE A 1 350 ? 84.884 66.721 126.027 1.00 7.06 ? 370 PHE A CE1 1 +ATOM 2830 C CE2 . PHE A 1 350 ? 82.494 66.590 125.971 1.00 8.52 ? 370 PHE A CE2 1 +ATOM 2831 C CZ . PHE A 1 350 ? 83.655 67.310 126.228 1.00 9.40 ? 370 PHE A CZ 1 +ATOM 2832 N N . ASN A 1 351 ? 83.962 60.995 122.418 1.00 8.23 ? 371 ASN A N 1 +ATOM 2833 C CA . ASN A 1 351 ? 84.597 59.935 121.655 1.00 8.45 ? 371 ASN A CA 1 +ATOM 2834 C C . ASN A 1 351 ? 84.938 60.387 120.223 1.00 7.96 ? 371 ASN A C 1 +ATOM 2835 O O . ASN A 1 351 ? 86.027 60.094 119.698 1.00 7.18 ? 371 ASN A O 1 +ATOM 2836 C CB . ASN A 1 351 ? 83.746 58.664 121.712 1.00 8.61 ? 371 ASN A CB 1 +ATOM 2837 C CG . ASN A 1 351 ? 83.779 58.004 123.090 1.00 10.44 ? 371 ASN A CG 1 +ATOM 2838 O OD1 . ASN A 1 351 ? 84.734 58.188 123.855 1.00 10.99 ? 371 ASN A OD1 1 +ATOM 2839 N ND2 . ASN A 1 351 ? 82.752 57.217 123.403 1.00 7.40 ? 371 ASN A ND2 1 +ATOM 2840 N N . LEU A 1 352 ? 84.037 61.139 119.597 1.00 7.04 ? 372 LEU A N 1 +ATOM 2841 C CA . LEU A 1 352 ? 84.295 61.597 118.234 1.00 7.16 ? 372 LEU A CA 1 +ATOM 2842 C C . LEU A 1 352 ? 85.417 62.626 118.212 1.00 7.27 ? 372 LEU A C 1 +ATOM 2843 O O . LEU A 1 352 ? 86.271 62.594 117.317 1.00 7.98 ? 372 LEU A O 1 +ATOM 2844 C CB . LEU A 1 352 ? 83.024 62.153 117.603 1.00 8.18 ? 372 LEU A CB 1 +ATOM 2845 C CG . LEU A 1 352 ? 81.992 61.088 117.236 1.00 7.61 ? 372 LEU A CG 1 +ATOM 2846 C CD1 . LEU A 1 352 ? 80.671 61.755 116.828 1.00 9.54 ? 372 LEU A CD1 1 +ATOM 2847 C CD2 . LEU A 1 352 ? 82.492 60.168 116.113 1.00 10.85 ? 372 LEU A CD2 1 +ATOM 2848 N N . LEU A 1 353 ? 85.430 63.527 119.200 1.00 7.21 ? 373 LEU A N 1 +ATOM 2849 C CA . LEU A 1 353 ? 86.523 64.503 119.293 1.00 7.45 ? 373 LEU A CA 1 +ATOM 2850 C C . LEU A 1 353 ? 87.850 63.783 119.408 1.00 7.46 ? 373 LEU A C 1 +ATOM 2851 O O . LEU A 1 353 ? 88.776 64.091 118.687 1.00 7.88 ? 373 LEU A O 1 +ATOM 2852 C CB . LEU A 1 353 ? 86.351 65.455 120.488 1.00 7.00 ? 373 LEU A CB 1 +ATOM 2853 C CG . LEU A 1 353 ? 85.175 66.441 120.434 1.00 7.81 ? 373 LEU A CG 1 +ATOM 2854 C CD1 . LEU A 1 353 ? 84.973 67.078 121.804 1.00 10.87 ? 373 LEU A CD1 1 +ATOM 2855 C CD2 . LEU A 1 353 ? 85.389 67.523 119.361 1.00 8.75 ? 373 LEU A CD2 1 +ATOM 2856 N N . ARG A 1 354 ? 87.962 62.811 120.302 1.00 8.09 ? 374 ARG A N 1 +ATOM 2857 C CA A ARG A 1 354 ? 89.250 62.142 120.465 0.50 8.76 ? 374 ARG A CA 1 +ATOM 2858 C CA B ARG A 1 354 ? 89.236 62.101 120.476 0.50 8.56 ? 374 ARG A CA 1 +ATOM 2859 C C . ARG A 1 354 ? 89.615 61.306 119.229 1.00 8.99 ? 374 ARG A C 1 +ATOM 2860 O O . ARG A 1 354 ? 90.776 61.285 118.840 1.00 8.88 ? 374 ARG A O 1 +ATOM 2861 C CB A ARG A 1 354 ? 89.316 61.364 121.781 0.50 9.06 ? 374 ARG A CB 1 +ATOM 2862 C CB B ARG A 1 354 ? 89.208 61.196 121.705 0.50 8.82 ? 374 ARG A CB 1 +ATOM 2863 C CG A ARG A 1 354 ? 89.412 62.307 122.977 0.50 10.09 ? 374 ARG A CG 1 +ATOM 2864 C CG B ARG A 1 354 ? 89.129 61.965 123.006 0.50 8.68 ? 374 ARG A CG 1 +ATOM 2865 C CD A ARG A 1 354 ? 89.745 61.641 124.299 0.50 11.98 ? 374 ARG A CD 1 +ATOM 2866 C CD B ARG A 1 354 ? 90.030 61.381 124.077 0.50 9.69 ? 374 ARG A CD 1 +ATOM 2867 N NE A ARG A 1 354 ? 90.915 60.766 124.239 0.50 12.87 ? 374 ARG A NE 1 +ATOM 2868 N NE B ARG A 1 354 ? 89.415 60.225 124.727 0.50 9.04 ? 374 ARG A NE 1 +ATOM 2869 C CZ A ARG A 1 354 ? 90.870 59.433 124.213 0.50 13.68 ? 374 ARG A CZ 1 +ATOM 2870 C CZ B ARG A 1 354 ? 89.800 58.955 124.601 0.50 10.79 ? 374 ARG A CZ 1 +ATOM 2871 N NH1 A ARG A 1 354 ? 89.707 58.786 124.262 0.50 13.27 ? 374 ARG A NH1 1 +ATOM 2872 N NH1 B ARG A 1 354 ? 90.832 58.600 123.824 0.50 11.81 ? 374 ARG A NH1 1 +ATOM 2873 N NH2 A ARG A 1 354 ? 91.998 58.738 124.158 0.50 12.53 ? 374 ARG A NH2 1 +ATOM 2874 N NH2 B ARG A 1 354 ? 89.132 58.020 125.272 0.50 11.92 ? 374 ARG A NH2 1 +ATOM 2875 N N . TRP A 1 355 ? 88.626 60.676 118.594 1.00 9.12 ? 375 TRP A N 1 +ATOM 2876 C CA . TRP A 1 355 ? 88.812 59.967 117.294 1.00 9.06 ? 375 TRP A CA 1 +ATOM 2877 C C . TRP A 1 355 ? 89.345 60.928 116.229 1.00 8.88 ? 375 TRP A C 1 +ATOM 2878 O O . TRP A 1 355 ? 90.270 60.612 115.480 1.00 8.53 ? 375 TRP A O 1 +ATOM 2879 C CB . TRP A 1 355 ? 87.467 59.393 116.830 1.00 9.44 ? 375 TRP A CB 1 +ATOM 2880 C CG . TRP A 1 355 ? 87.436 58.743 115.474 1.00 9.48 ? 375 TRP A CG 1 +ATOM 2881 C CD1 . TRP A 1 355 ? 87.767 57.460 115.189 1.00 10.70 ? 375 TRP A CD1 1 +ATOM 2882 C CD2 . TRP A 1 355 ? 86.988 59.326 114.231 1.00 10.67 ? 375 TRP A CD2 1 +ATOM 2883 N NE1 . TRP A 1 355 ? 87.597 57.205 113.851 1.00 10.03 ? 375 TRP A NE1 1 +ATOM 2884 C CE2 . TRP A 1 355 ? 87.106 58.323 113.239 1.00 10.65 ? 375 TRP A CE2 1 +ATOM 2885 C CE3 . TRP A 1 355 ? 86.509 60.585 113.865 1.00 10.90 ? 375 TRP A CE3 1 +ATOM 2886 C CZ2 . TRP A 1 355 ? 86.771 58.545 111.896 1.00 10.76 ? 375 TRP A CZ2 1 +ATOM 2887 C CZ3 . TRP A 1 355 ? 86.175 60.813 112.525 1.00 10.20 ? 375 TRP A CZ3 1 +ATOM 2888 C CH2 . TRP A 1 355 ? 86.303 59.791 111.561 1.00 9.60 ? 375 TRP A CH2 1 +ATOM 2889 N N . LEU A 1 356 ? 88.748 62.111 116.176 1.00 8.76 ? 376 LEU A N 1 +ATOM 2890 C CA . LEU A 1 356 ? 89.136 63.146 115.227 1.00 8.86 ? 376 LEU A CA 1 +ATOM 2891 C C . LEU A 1 356 ? 90.574 63.634 115.418 1.00 9.24 ? 376 LEU A C 1 +ATOM 2892 O O . LEU A 1 356 ? 91.180 64.153 114.480 1.00 10.09 ? 376 LEU A O 1 +ATOM 2893 C CB . LEU A 1 356 ? 88.171 64.334 115.371 1.00 9.06 ? 376 LEU A CB 1 +ATOM 2894 C CG . LEU A 1 356 ? 88.185 65.497 114.374 1.00 8.46 ? 376 LEU A CG 1 +ATOM 2895 C CD1 . LEU A 1 356 ? 87.931 64.947 112.975 1.00 10.29 ? 376 LEU A CD1 1 +ATOM 2896 C CD2 . LEU A 1 356 ? 87.120 66.548 114.757 1.00 8.62 ? 376 LEU A CD2 1 +ATOM 2897 N N . GLY A 1 357 ? 91.118 63.499 116.627 1.00 8.60 ? 377 GLY A N 1 +ATOM 2898 C CA . GLY A 1 357 ? 92.381 64.162 116.956 1.00 9.26 ? 377 GLY A CA 1 +ATOM 2899 C C . GLY A 1 357 ? 92.184 65.627 117.319 1.00 8.93 ? 377 GLY A C 1 +ATOM 2900 O O . GLY A 1 357 ? 93.139 66.430 117.307 1.00 9.14 ? 377 GLY A O 1 +ATOM 2901 N N . ALA A 1 358 ? 90.946 66.004 117.653 1.00 8.91 ? 378 ALA A N 1 +ATOM 2902 C CA . ALA A 1 358 ? 90.664 67.375 118.104 1.00 8.71 ? 378 ALA A CA 1 +ATOM 2903 C C . ALA A 1 358 ? 91.155 67.567 119.540 1.00 8.80 ? 378 ALA A C 1 +ATOM 2904 O O . ALA A 1 358 ? 90.844 66.757 120.405 1.00 9.50 ? 378 ALA A O 1 +ATOM 2905 C CB . ALA A 1 358 ? 89.150 67.674 118.035 1.00 7.96 ? 378 ALA A CB 1 +ATOM 2906 N N . ASN A 1 359 ? 91.919 68.630 119.786 1.00 8.51 ? 379 ASN A N 1 +ATOM 2907 C CA . ASN A 1 359 ? 92.375 68.947 121.148 1.00 8.43 ? 379 ASN A CA 1 +ATOM 2908 C C . ASN A 1 359 ? 91.669 70.148 121.810 1.00 8.73 ? 379 ASN A C 1 +ATOM 2909 O O . ASN A 1 359 ? 92.032 70.542 122.914 1.00 8.92 ? 379 ASN A O 1 +ATOM 2910 C CB . ASN A 1 359 ? 93.897 69.160 121.149 1.00 8.77 ? 379 ASN A CB 1 +ATOM 2911 C CG . ASN A 1 359 ? 94.322 70.408 120.389 1.00 8.50 ? 379 ASN A CG 1 +ATOM 2912 O OD1 . ASN A 1 359 ? 93.495 71.132 119.826 1.00 10.30 ? 379 ASN A OD1 1 +ATOM 2913 N ND2 . ASN A 1 359 ? 95.632 70.672 120.372 1.00 8.06 ? 379 ASN A ND2 1 +ATOM 2914 N N . ALA A 1 360 ? 90.635 70.690 121.171 1.00 8.30 ? 380 ALA A N 1 +ATOM 2915 C CA . ALA A 1 360 ? 90.037 71.942 121.598 1.00 7.95 ? 380 ALA A CA 1 +ATOM 2916 C C . ALA A 1 360 ? 88.658 72.157 121.013 1.00 7.83 ? 380 ALA A C 1 +ATOM 2917 O O . ALA A 1 360 ? 88.385 71.708 119.902 1.00 7.55 ? 380 ALA A O 1 +ATOM 2918 C CB . ALA A 1 360 ? 90.950 73.118 121.171 1.00 8.47 ? 380 ALA A CB 1 +ATOM 2919 N N . PHE A 1 361 ? 87.784 72.844 121.746 1.00 7.08 ? 381 PHE A N 1 +ATOM 2920 C CA . PHE A 1 361 ? 86.647 73.504 121.080 1.00 8.11 ? 381 PHE A CA 1 +ATOM 2921 C C . PHE A 1 361 ? 86.312 74.855 121.674 1.00 7.56 ? 381 PHE A C 1 +ATOM 2922 O O . PHE A 1 361 ? 86.712 75.167 122.795 1.00 7.72 ? 381 PHE A O 1 +ATOM 2923 C CB . PHE A 1 361 ? 85.411 72.595 120.931 1.00 8.82 ? 381 PHE A CB 1 +ATOM 2924 C CG . PHE A 1 361 ? 84.821 72.097 122.226 1.00 9.55 ? 381 PHE A CG 1 +ATOM 2925 C CD1 . PHE A 1 361 ? 83.840 72.816 122.882 1.00 10.32 ? 381 PHE A CD1 1 +ATOM 2926 C CD2 . PHE A 1 361 ? 85.181 70.865 122.743 1.00 9.91 ? 381 PHE A CD2 1 +ATOM 2927 C CE1 . PHE A 1 361 ? 83.279 72.342 124.063 1.00 10.36 ? 381 PHE A CE1 1 +ATOM 2928 C CE2 . PHE A 1 361 ? 84.620 70.387 123.924 1.00 10.54 ? 381 PHE A CE2 1 +ATOM 2929 C CZ . PHE A 1 361 ? 83.660 71.117 124.574 1.00 10.96 ? 381 PHE A CZ 1 +ATOM 2930 N N . ARG A 1 362 ? 85.606 75.663 120.883 1.00 7.68 ? 382 ARG A N 1 +ATOM 2931 C CA . ARG A 1 362 ? 85.041 76.899 121.352 1.00 7.24 ? 382 ARG A CA 1 +ATOM 2932 C C . ARG A 1 362 ? 83.587 76.608 121.648 1.00 7.48 ? 382 ARG A C 1 +ATOM 2933 O O . ARG A 1 362 ? 82.941 75.867 120.883 1.00 7.81 ? 382 ARG A O 1 +ATOM 2934 C CB . ARG A 1 362 ? 85.156 77.984 120.289 1.00 7.27 ? 382 ARG A CB 1 +ATOM 2935 C CG . ARG A 1 362 ? 84.484 79.252 120.676 1.00 7.91 ? 382 ARG A CG 1 +ATOM 2936 C CD . ARG A 1 362 ? 84.852 80.406 119.774 1.00 8.82 ? 382 ARG A CD 1 +ATOM 2937 N NE . ARG A 1 362 ? 84.439 80.194 118.384 1.00 10.85 ? 382 ARG A NE 1 +ATOM 2938 C CZ . ARG A 1 362 ? 83.622 80.970 117.674 1.00 10.11 ? 382 ARG A CZ 1 +ATOM 2939 N NH1 . ARG A 1 362 ? 83.088 82.077 118.168 1.00 7.59 ? 382 ARG A NH1 1 +ATOM 2940 N NH2 . ARG A 1 362 ? 83.367 80.645 116.415 1.00 7.85 ? 382 ARG A NH2 1 +ATOM 2941 N N . THR A 1 363 ? 83.081 77.173 122.739 1.00 7.06 ? 383 THR A N 1 +ATOM 2942 C CA . THR A 1 363 ? 81.670 77.016 123.095 1.00 8.02 ? 383 THR A CA 1 +ATOM 2943 C C . THR A 1 363 ? 80.851 78.030 122.280 1.00 7.75 ? 383 THR A C 1 +ATOM 2944 O O . THR A 1 363 ? 80.201 78.937 122.811 1.00 7.48 ? 383 THR A O 1 +ATOM 2945 C CB . THR A 1 363 ? 81.365 77.103 124.641 1.00 7.68 ? 383 THR A CB 1 +ATOM 2946 O OG1 . THR A 1 363 ? 81.494 78.437 125.122 1.00 8.12 ? 383 THR A OG1 1 +ATOM 2947 C CG2 . THR A 1 363 ? 82.267 76.175 125.471 1.00 8.79 ? 383 THR A CG2 1 +ATOM 2948 N N . SER A 1 364 ? 80.870 77.858 120.964 1.00 7.93 ? 384 SER A N 1 +ATOM 2949 C CA . SER A 1 364 ? 80.062 78.709 120.109 1.00 7.58 ? 384 SER A CA 1 +ATOM 2950 C C . SER A 1 364 ? 78.593 78.411 120.451 1.00 7.48 ? 384 SER A C 1 +ATOM 2951 O O . SER A 1 364 ? 78.218 77.230 120.490 1.00 7.33 ? 384 SER A O 1 +ATOM 2952 C CB . SER A 1 364 ? 80.339 78.394 118.653 1.00 8.15 ? 384 SER A CB 1 +ATOM 2953 O OG . SER A 1 364 ? 80.517 76.993 118.487 1.00 8.53 ? 384 SER A OG 1 +ATOM 2954 N N . HIS A 1 365 ? 77.762 79.409 120.776 1.00 7.81 ? 385 HIS A N 1 +ATOM 2955 C CA . HIS A 1 365 ? 78.106 80.790 121.088 1.00 8.11 ? 385 HIS A CA 1 +ATOM 2956 C C . HIS A 1 365 ? 77.463 81.188 122.432 1.00 8.12 ? 385 HIS A C 1 +ATOM 2957 O O . HIS A 1 365 ? 76.734 82.160 122.528 1.00 8.64 ? 385 HIS A O 1 +ATOM 2958 C CB . HIS A 1 365 ? 77.576 81.703 119.994 1.00 8.05 ? 385 HIS A CB 1 +ATOM 2959 C CG . HIS A 1 365 ? 78.182 81.455 118.654 1.00 8.46 ? 385 HIS A CG 1 +ATOM 2960 N ND1 . HIS A 1 365 ? 79.529 81.627 118.402 1.00 4.92 ? 385 HIS A ND1 1 +ATOM 2961 C CD2 . HIS A 1 365 ? 77.623 81.086 117.480 1.00 6.39 ? 385 HIS A CD2 1 +ATOM 2962 C CE1 . HIS A 1 365 ? 79.768 81.366 117.130 1.00 7.32 ? 385 HIS A CE1 1 +ATOM 2963 N NE2 . HIS A 1 365 ? 78.627 81.040 116.548 1.00 6.86 ? 385 HIS A NE2 1 +ATOM 2964 N N . TYR A 1 366 ? 77.749 80.412 123.462 1.00 7.38 ? 386 TYR A N 1 +ATOM 2965 C CA . TYR A 1 366 ? 77.120 80.552 124.773 1.00 7.36 ? 386 TYR A CA 1 +ATOM 2966 C C . TYR A 1 366 ? 77.823 79.511 125.633 1.00 7.73 ? 386 TYR A C 1 +ATOM 2967 O O . TYR A 1 366 ? 78.377 78.557 125.096 1.00 8.86 ? 386 TYR A O 1 +ATOM 2968 C CB . TYR A 1 366 ? 75.598 80.289 124.694 1.00 7.17 ? 386 TYR A CB 1 +ATOM 2969 C CG . TYR A 1 366 ? 75.238 79.189 123.731 1.00 6.26 ? 386 TYR A CG 1 +ATOM 2970 C CD1 . TYR A 1 366 ? 75.374 77.844 124.104 1.00 7.10 ? 386 TYR A CD1 1 +ATOM 2971 C CD2 . TYR A 1 366 ? 74.806 79.466 122.433 1.00 5.78 ? 386 TYR A CD2 1 +ATOM 2972 C CE1 . TYR A 1 366 ? 75.105 76.827 123.225 1.00 6.47 ? 386 TYR A CE1 1 +ATOM 2973 C CE2 . TYR A 1 366 ? 74.531 78.423 121.525 1.00 6.30 ? 386 TYR A CE2 1 +ATOM 2974 C CZ . TYR A 1 366 ? 74.685 77.109 121.941 1.00 5.93 ? 386 TYR A CZ 1 +ATOM 2975 O OH . TYR A 1 366 ? 74.438 76.055 121.075 1.00 7.42 ? 386 TYR A OH 1 +ATOM 2976 N N . PRO A 1 367 ? 77.836 79.693 126.962 1.00 8.00 ? 387 PRO A N 1 +ATOM 2977 C CA . PRO A 1 367 ? 78.450 78.643 127.765 1.00 8.23 ? 387 PRO A CA 1 +ATOM 2978 C C . PRO A 1 367 ? 77.620 77.387 127.687 1.00 8.05 ? 387 PRO A C 1 +ATOM 2979 O O . PRO A 1 367 ? 76.380 77.473 127.628 1.00 7.42 ? 387 PRO A O 1 +ATOM 2980 C CB . PRO A 1 367 ? 78.452 79.213 129.182 1.00 8.35 ? 387 PRO A CB 1 +ATOM 2981 C CG . PRO A 1 367 ? 77.586 80.350 129.178 1.00 9.00 ? 387 PRO A CG 1 +ATOM 2982 C CD . PRO A 1 367 ? 77.341 80.806 127.777 1.00 8.19 ? 387 PRO A CD 1 +ATOM 2983 N N . TYR A 1 368 ? 78.290 76.238 127.669 1.00 8.54 ? 388 TYR A N 1 +ATOM 2984 C CA . TYR A 1 368 ? 77.625 74.934 127.620 1.00 8.88 ? 388 TYR A CA 1 +ATOM 2985 C C . TYR A 1 368 ? 77.305 74.400 129.031 1.00 9.24 ? 388 TYR A C 1 +ATOM 2986 O O . TYR A 1 368 ? 77.708 74.976 130.032 1.00 8.57 ? 388 TYR A O 1 +ATOM 2987 C CB . TYR A 1 368 ? 78.508 73.925 126.876 1.00 9.39 ? 388 TYR A CB 1 +ATOM 2988 C CG . TYR A 1 368 ? 78.727 74.204 125.400 1.00 9.17 ? 388 TYR A CG 1 +ATOM 2989 C CD1 . TYR A 1 368 ? 78.117 75.283 124.751 1.00 9.13 ? 388 TYR A CD1 1 +ATOM 2990 C CD2 . TYR A 1 368 ? 79.556 73.368 124.640 1.00 10.26 ? 388 TYR A CD2 1 +ATOM 2991 C CE1 . TYR A 1 368 ? 78.318 75.522 123.408 1.00 10.29 ? 388 TYR A CE1 1 +ATOM 2992 C CE2 . TYR A 1 368 ? 79.754 73.601 123.293 1.00 10.41 ? 388 TYR A CE2 1 +ATOM 2993 C CZ . TYR A 1 368 ? 79.132 74.671 122.676 1.00 10.89 ? 388 TYR A CZ 1 +ATOM 2994 O OH . TYR A 1 368 ? 79.334 74.902 121.332 1.00 10.78 ? 388 TYR A OH 1 +ATOM 2995 N N . ALA A 1 369 ? 76.550 73.312 129.100 1.00 8.72 ? 389 ALA A N 1 +ATOM 2996 C CA . ALA A 1 369 ? 76.251 72.646 130.377 1.00 8.91 ? 389 ALA A CA 1 +ATOM 2997 C C . ALA A 1 369 ? 77.551 72.412 131.152 1.00 8.76 ? 389 ALA A C 1 +ATOM 2998 O O . ALA A 1 369 ? 78.578 72.089 130.560 1.00 7.48 ? 389 ALA A O 1 +ATOM 2999 C CB . ALA A 1 369 ? 75.532 71.305 130.130 1.00 9.02 ? 389 ALA A CB 1 +ATOM 3000 N N . GLU A 1 370 ? 77.488 72.563 132.477 1.00 8.83 ? 390 GLU A N 1 +ATOM 3001 C CA . GLU A 1 370 ? 78.658 72.334 133.343 1.00 9.11 ? 390 GLU A CA 1 +ATOM 3002 C C . GLU A 1 370 ? 79.276 70.941 133.126 1.00 9.38 ? 390 GLU A C 1 +ATOM 3003 O O . GLU A 1 370 ? 80.507 70.772 133.091 1.00 9.43 ? 390 GLU A O 1 +ATOM 3004 C CB . GLU A 1 370 ? 78.263 72.547 134.809 1.00 8.91 ? 390 GLU A CB 1 +ATOM 3005 C CG A GLU A 1 370 ? 77.843 73.969 135.167 0.50 9.14 ? 390 GLU A CG 1 +ATOM 3006 C CG B GLU A 1 370 ? 77.919 74.016 135.102 0.50 10.43 ? 390 GLU A CG 1 +ATOM 3007 C CD A GLU A 1 370 ? 76.332 74.169 135.163 0.50 7.20 ? 390 GLU A CD 1 +ATOM 3008 C CD B GLU A 1 370 ? 77.033 74.220 136.309 0.50 10.55 ? 390 GLU A CD 1 +ATOM 3009 O OE1 A GLU A 1 370 ? 75.637 73.668 134.236 0.50 8.03 ? 390 GLU A OE1 1 +ATOM 3010 O OE1 B GLU A 1 370 ? 75.848 73.828 136.273 0.50 14.38 ? 390 GLU A OE1 1 +ATOM 3011 O OE2 A GLU A 1 370 ? 75.832 74.823 136.105 0.50 8.81 ? 390 GLU A OE2 1 +ATOM 3012 O OE2 B GLU A 1 370 ? 77.513 74.808 137.295 0.50 11.83 ? 390 GLU A OE2 1 +ATOM 3013 N N . GLU A 1 371 ? 78.411 69.954 132.923 1.00 9.34 ? 391 GLU A N 1 +ATOM 3014 C CA . GLU A 1 371 ? 78.843 68.581 132.699 1.00 10.10 ? 391 GLU A CA 1 +ATOM 3015 C C . GLU A 1 371 ? 79.831 68.497 131.518 1.00 9.72 ? 391 GLU A C 1 +ATOM 3016 O O . GLU A 1 371 ? 80.773 67.715 131.548 1.00 10.82 ? 391 GLU A O 1 +ATOM 3017 C CB . GLU A 1 371 ? 77.626 67.684 132.460 1.00 10.49 ? 391 GLU A CB 1 +ATOM 3018 C CG . GLU A 1 371 ? 76.648 67.548 133.658 1.00 12.62 ? 391 GLU A CG 1 +ATOM 3019 C CD . GLU A 1 371 ? 75.459 68.511 133.619 1.00 16.55 ? 391 GLU A CD 1 +ATOM 3020 O OE1 . GLU A 1 371 ? 75.671 69.736 133.433 1.00 15.30 ? 391 GLU A OE1 1 +ATOM 3021 O OE2 . GLU A 1 371 ? 74.293 68.036 133.783 1.00 18.58 ? 391 GLU A OE2 1 +ATOM 3022 N N . VAL A 1 372 ? 79.621 69.321 130.494 1.00 9.78 ? 392 VAL A N 1 +ATOM 3023 C CA . VAL A 1 372 ? 80.523 69.366 129.318 1.00 9.41 ? 392 VAL A CA 1 +ATOM 3024 C C . VAL A 1 372 ? 81.918 69.837 129.727 1.00 9.23 ? 392 VAL A C 1 +ATOM 3025 O O . VAL A 1 372 ? 82.931 69.295 129.279 1.00 9.01 ? 392 VAL A O 1 +ATOM 3026 C CB . VAL A 1 372 ? 79.987 70.309 128.208 1.00 9.14 ? 392 VAL A CB 1 +ATOM 3027 C CG1 . VAL A 1 372 ? 80.886 70.283 126.979 1.00 9.09 ? 392 VAL A CG1 1 +ATOM 3028 C CG2 . VAL A 1 372 ? 78.553 69.926 127.801 1.00 9.97 ? 392 VAL A CG2 1 +ATOM 3029 N N . MET A 1 373 ? 81.958 70.842 130.595 1.00 9.12 ? 393 MET A N 1 +ATOM 3030 C CA . MET A 1 373 ? 83.221 71.422 131.034 1.00 9.73 ? 393 MET A CA 1 +ATOM 3031 C C . MET A 1 373 ? 83.955 70.430 131.914 1.00 9.78 ? 393 MET A C 1 +ATOM 3032 O O . MET A 1 373 ? 85.173 70.307 131.837 1.00 9.76 ? 393 MET A O 1 +ATOM 3033 C CB . MET A 1 373 ? 82.978 72.738 131.782 1.00 9.27 ? 393 MET A CB 1 +ATOM 3034 C CG . MET A 1 373 ? 82.337 73.865 130.936 1.00 10.77 ? 393 MET A CG 1 +ATOM 3035 S SD . MET A 1 373 ? 83.361 74.414 129.547 1.00 10.69 ? 393 MET A SD 1 +ATOM 3036 C CE . MET A 1 373 ? 82.659 73.519 128.178 1.00 11.10 ? 393 MET A CE 1 +ATOM 3037 N N . GLN A 1 374 ? 83.203 69.700 132.734 1.00 10.68 ? 394 GLN A N 1 +ATOM 3038 C CA . GLN A 1 374 ? 83.763 68.633 133.569 1.00 11.32 ? 394 GLN A CA 1 +ATOM 3039 C C . GLN A 1 374 ? 84.414 67.548 132.717 1.00 11.56 ? 394 GLN A C 1 +ATOM 3040 O O . GLN A 1 374 ? 85.493 67.025 133.051 1.00 11.70 ? 394 GLN A O 1 +ATOM 3041 C CB . GLN A 1 374 ? 82.671 68.021 134.456 1.00 11.48 ? 394 GLN A CB 1 +ATOM 3042 C CG A GLN A 1 374 ? 82.126 69.002 135.462 0.50 12.74 ? 394 GLN A CG 1 +ATOM 3043 C CG B GLN A 1 374 ? 81.967 68.983 135.432 0.50 11.69 ? 394 GLN A CG 1 +ATOM 3044 C CD A GLN A 1 374 ? 80.891 68.507 136.135 0.50 14.05 ? 394 GLN A CD 1 +ATOM 3045 C CD B GLN A 1 374 ? 82.732 69.224 136.721 0.50 12.12 ? 394 GLN A CD 1 +ATOM 3046 O OE1 A GLN A 1 374 ? 80.696 67.304 136.294 0.50 16.92 ? 394 GLN A OE1 1 +ATOM 3047 O OE1 B GLN A 1 374 ? 83.347 70.275 136.900 0.50 11.37 ? 394 GLN A OE1 1 +ATOM 3048 N NE2 A GLN A 1 374 ? 80.034 69.432 136.534 0.50 15.12 ? 394 GLN A NE2 1 +ATOM 3049 N NE2 B GLN A 1 374 ? 82.682 68.264 137.632 0.50 12.27 ? 394 GLN A NE2 1 +ATOM 3050 N N . MET A 1 375 ? 83.778 67.220 131.597 1.00 11.43 ? 395 MET A N 1 +ATOM 3051 C CA . MET A 1 375 ? 84.347 66.259 130.653 1.00 11.56 ? 395 MET A CA 1 +ATOM 3052 C C . MET A 1 375 ? 85.618 66.794 129.987 1.00 11.28 ? 395 MET A C 1 +ATOM 3053 O O . MET A 1 375 ? 86.579 66.044 129.811 1.00 11.02 ? 395 MET A O 1 +ATOM 3054 C CB . MET A 1 375 ? 83.320 65.899 129.588 1.00 11.57 ? 395 MET A CB 1 +ATOM 3055 C CG . MET A 1 375 ? 82.145 65.128 130.139 1.00 13.01 ? 395 MET A CG 1 +ATOM 3056 S SD . MET A 1 375 ? 82.420 63.353 130.046 1.00 16.63 ? 395 MET A SD 1 +ATOM 3057 C CE . MET A 1 375 ? 82.354 63.153 128.277 1.00 8.15 ? 395 MET A CE 1 +ATOM 3058 N N . CYS A 1 376 ? 85.627 68.079 129.623 1.00 10.71 ? 396 CYS A N 1 +ATOM 3059 C CA . CYS A 1 376 ? 86.826 68.690 129.041 1.00 10.34 ? 396 CYS A CA 1 +ATOM 3060 C C . CYS A 1 376 ? 88.007 68.605 129.997 1.00 10.92 ? 396 CYS A C 1 +ATOM 3061 O O . CYS A 1 376 ? 89.118 68.289 129.578 1.00 10.74 ? 396 CYS A O 1 +ATOM 3062 C CB . CYS A 1 376 ? 86.570 70.145 128.663 1.00 10.58 ? 396 CYS A CB 1 +ATOM 3063 S SG . CYS A 1 376 ? 85.395 70.320 127.314 1.00 9.51 ? 396 CYS A SG 1 +ATOM 3064 N N . ASP A 1 377 ? 87.778 68.888 131.276 1.00 10.49 ? 397 ASP A N 1 +ATOM 3065 C CA . ASP A 1 377 ? 88.844 68.684 132.274 1.00 10.59 ? 397 ASP A CA 1 +ATOM 3066 C C . ASP A 1 377 ? 89.385 67.245 132.258 1.00 10.63 ? 397 ASP A C 1 +ATOM 3067 O O . ASP A 1 377 ? 90.590 67.022 132.339 1.00 10.31 ? 397 ASP A O 1 +ATOM 3068 C CB . ASP A 1 377 ? 88.328 69.006 133.673 1.00 10.98 ? 397 ASP A CB 1 +ATOM 3069 C CG . ASP A 1 377 ? 88.045 70.483 133.869 1.00 10.49 ? 397 ASP A CG 1 +ATOM 3070 O OD1 . ASP A 1 377 ? 88.528 71.320 133.086 1.00 10.87 ? 397 ASP A OD1 1 +ATOM 3071 O OD2 . ASP A 1 377 ? 87.318 70.810 134.822 1.00 13.05 ? 397 ASP A OD2 1 +ATOM 3072 N N . ARG A 1 378 ? 88.498 66.266 132.149 1.00 10.54 ? 398 ARG A N 1 +ATOM 3073 C CA . ARG A 1 378 ? 88.910 64.874 132.287 1.00 10.73 ? 398 ARG A CA 1 +ATOM 3074 C C . ARG A 1 378 ? 89.491 64.273 131.011 1.00 10.66 ? 398 ARG A C 1 +ATOM 3075 O O . ARG A 1 378 ? 90.306 63.367 131.097 1.00 11.07 ? 398 ARG A O 1 +ATOM 3076 C CB . ARG A 1 378 ? 87.754 64.023 132.805 1.00 10.82 ? 398 ARG A CB 1 +ATOM 3077 C CG . ARG A 1 378 ? 87.285 64.414 134.202 1.00 12.05 ? 398 ARG A CG 1 +ATOM 3078 C CD . ARG A 1 378 ? 85.986 63.723 134.535 1.00 13.65 ? 398 ARG A CD 1 +ATOM 3079 N NE . ARG A 1 378 ? 86.142 62.272 134.483 1.00 14.53 ? 398 ARG A NE 1 +ATOM 3080 C CZ . ARG A 1 378 ? 85.509 61.439 133.653 1.00 15.30 ? 398 ARG A CZ 1 +ATOM 3081 N NH1 . ARG A 1 378 ? 84.587 61.871 132.789 1.00 13.89 ? 398 ARG A NH1 1 +ATOM 3082 N NH2 . ARG A 1 378 ? 85.781 60.135 133.725 1.00 14.98 ? 398 ARG A NH2 1 +ATOM 3083 N N . TYR A 1 379 ? 89.091 64.795 129.849 1.00 10.51 ? 399 TYR A N 1 +ATOM 3084 C CA . TYR A 1 379 ? 89.561 64.294 128.555 1.00 10.32 ? 399 TYR A CA 1 +ATOM 3085 C C . TYR A 1 379 ? 90.704 65.133 127.963 1.00 10.68 ? 399 TYR A C 1 +ATOM 3086 O O . TYR A 1 379 ? 91.304 64.748 126.953 1.00 10.99 ? 399 TYR A O 1 +ATOM 3087 C CB . TYR A 1 379 ? 88.385 64.239 127.562 1.00 10.94 ? 399 TYR A CB 1 +ATOM 3088 C CG . TYR A 1 379 ? 87.414 63.098 127.800 1.00 11.32 ? 399 TYR A CG 1 +ATOM 3089 C CD1 . TYR A 1 379 ? 86.706 62.992 128.985 1.00 11.94 ? 399 TYR A CD1 1 +ATOM 3090 C CD2 . TYR A 1 379 ? 87.195 62.134 126.819 1.00 11.88 ? 399 TYR A CD2 1 +ATOM 3091 C CE1 . TYR A 1 379 ? 85.814 61.936 129.198 1.00 12.36 ? 399 TYR A CE1 1 +ATOM 3092 C CE2 . TYR A 1 379 ? 86.314 61.085 127.012 1.00 11.44 ? 399 TYR A CE2 1 +ATOM 3093 C CZ . TYR A 1 379 ? 85.624 60.989 128.203 1.00 11.87 ? 399 TYR A CZ 1 +ATOM 3094 O OH . TYR A 1 379 ? 84.753 59.951 128.396 1.00 13.19 ? 399 TYR A OH 1 +ATOM 3095 N N . GLY A 1 380 ? 90.996 66.281 128.568 1.00 10.28 ? 400 GLY A N 1 +ATOM 3096 C CA . GLY A 1 380 ? 92.069 67.155 128.067 1.00 10.67 ? 400 GLY A CA 1 +ATOM 3097 C C . GLY A 1 380 ? 91.729 67.974 126.835 1.00 10.92 ? 400 GLY A C 1 +ATOM 3098 O O . GLY A 1 380 ? 92.621 68.397 126.091 1.00 11.55 ? 400 GLY A O 1 +ATOM 3099 N N . ILE A 1 381 ? 90.440 68.213 126.614 1.00 9.97 ? 401 ILE A N 1 +ATOM 3100 C CA . ILE A 1 381 ? 90.013 69.027 125.483 1.00 10.07 ? 401 ILE A CA 1 +ATOM 3101 C C . ILE A 1 381 ? 89.955 70.457 125.993 1.00 9.58 ? 401 ILE A C 1 +ATOM 3102 O O . ILE A 1 381 ? 89.119 70.785 126.843 1.00 9.22 ? 401 ILE A O 1 +ATOM 3103 C CB . ILE A 1 381 ? 88.631 68.574 124.943 1.00 9.63 ? 401 ILE A CB 1 +ATOM 3104 C CG1 . ILE A 1 381 ? 88.629 67.071 124.628 1.00 9.41 ? 401 ILE A CG1 1 +ATOM 3105 C CG2 . ILE A 1 381 ? 88.272 69.331 123.689 1.00 10.50 ? 401 ILE A CG2 1 +ATOM 3106 C CD1 . ILE A 1 381 ? 89.635 66.625 123.564 1.00 10.99 ? 401 ILE A CD1 1 +ATOM 3107 N N . VAL A 1 382 ? 90.848 71.317 125.498 1.00 9.61 ? 402 VAL A N 1 +ATOM 3108 C CA . VAL A 1 382 ? 90.847 72.720 125.926 1.00 9.54 ? 402 VAL A CA 1 +ATOM 3109 C C . VAL A 1 382 ? 89.629 73.480 125.369 1.00 9.68 ? 402 VAL A C 1 +ATOM 3110 O O . VAL A 1 382 ? 89.002 73.059 124.376 1.00 10.23 ? 402 VAL A O 1 +ATOM 3111 C CB . VAL A 1 382 ? 92.200 73.456 125.621 1.00 9.15 ? 402 VAL A CB 1 +ATOM 3112 C CG1 . VAL A 1 382 ? 93.343 72.766 126.375 1.00 8.84 ? 402 VAL A CG1 1 +ATOM 3113 C CG2 . VAL A 1 382 ? 92.504 73.515 124.133 1.00 9.94 ? 402 VAL A CG2 1 +ATOM 3114 N N . VAL A 1 383 ? 89.272 74.576 126.034 1.00 9.28 ? 403 VAL A N 1 +ATOM 3115 C CA . VAL A 1 383 ? 88.049 75.298 125.733 1.00 8.42 ? 403 VAL A CA 1 +ATOM 3116 C C . VAL A 1 383 ? 88.278 76.797 125.658 1.00 8.51 ? 403 VAL A C 1 +ATOM 3117 O O . VAL A 1 383 ? 88.894 77.389 126.550 1.00 8.59 ? 403 VAL A O 1 +ATOM 3118 C CB . VAL A 1 383 ? 86.943 75.018 126.787 1.00 7.80 ? 403 VAL A CB 1 +ATOM 3119 C CG1 . VAL A 1 383 ? 85.668 75.805 126.473 1.00 8.55 ? 403 VAL A CG1 1 +ATOM 3120 C CG2 . VAL A 1 383 ? 86.655 73.531 126.873 1.00 6.54 ? 403 VAL A CG2 1 +ATOM 3121 N N . ILE A 1 384 ? 87.763 77.403 124.598 1.00 7.41 ? 404 ILE A N 1 +ATOM 3122 C CA . ILE A 1 384 ? 87.607 78.851 124.538 1.00 7.48 ? 404 ILE A CA 1 +ATOM 3123 C C . ILE A 1 384 ? 86.157 79.016 124.963 1.00 7.61 ? 404 ILE A C 1 +ATOM 3124 O O . ILE A 1 384 ? 85.232 78.602 124.234 1.00 7.05 ? 404 ILE A O 1 +ATOM 3125 C CB . ILE A 1 384 ? 87.854 79.405 123.138 1.00 7.09 ? 404 ILE A CB 1 +ATOM 3126 C CG1 . ILE A 1 384 ? 89.305 79.154 122.721 1.00 7.79 ? 404 ILE A CG1 1 +ATOM 3127 C CG2 . ILE A 1 384 ? 87.506 80.901 123.089 1.00 7.46 ? 404 ILE A CG2 1 +ATOM 3128 C CD1 . ILE A 1 384 ? 89.539 79.302 121.240 1.00 8.19 ? 404 ILE A CD1 1 +ATOM 3129 N N . ASP A 1 385 ? 85.974 79.544 126.171 1.00 7.31 ? 405 ASP A N 1 +ATOM 3130 C CA . ASP A 1 385 ? 84.671 79.591 126.823 1.00 7.68 ? 405 ASP A CA 1 +ATOM 3131 C C . ASP A 1 385 ? 83.995 80.918 126.489 1.00 8.32 ? 405 ASP A C 1 +ATOM 3132 O O . ASP A 1 385 ? 84.458 81.980 126.898 1.00 8.56 ? 405 ASP A O 1 +ATOM 3133 C CB . ASP A 1 385 ? 84.870 79.438 128.333 1.00 8.37 ? 405 ASP A CB 1 +ATOM 3134 C CG . ASP A 1 385 ? 83.621 78.989 129.064 1.00 8.61 ? 405 ASP A CG 1 +ATOM 3135 O OD1 . ASP A 1 385 ? 82.507 78.949 128.467 1.00 7.96 ? 405 ASP A OD1 1 +ATOM 3136 O OD2 . ASP A 1 385 ? 83.782 78.667 130.262 1.00 10.08 ? 405 ASP A OD2 1 +ATOM 3137 N N . GLU A 1 386 ? 82.895 80.853 125.746 1.00 8.27 ? 406 GLU A N 1 +ATOM 3138 C CA . GLU A 1 386 ? 82.330 82.041 125.106 1.00 7.95 ? 406 GLU A CA 1 +ATOM 3139 C C . GLU A 1 386 ? 80.952 82.383 125.648 1.00 8.58 ? 406 GLU A C 1 +ATOM 3140 O O . GLU A 1 386 ? 80.098 81.524 125.709 1.00 8.74 ? 406 GLU A O 1 +ATOM 3141 C CB . GLU A 1 386 ? 82.228 81.799 123.600 1.00 8.29 ? 406 GLU A CB 1 +ATOM 3142 C CG . GLU A 1 386 ? 81.729 83.010 122.814 1.00 9.10 ? 406 GLU A CG 1 +ATOM 3143 C CD . GLU A 1 386 ? 81.909 82.837 121.323 1.00 8.02 ? 406 GLU A CD 1 +ATOM 3144 O OE1 . GLU A 1 386 ? 83.045 83.003 120.844 1.00 8.22 ? 406 GLU A OE1 1 +ATOM 3145 O OE2 . GLU A 1 386 ? 80.904 82.550 120.631 1.00 8.43 ? 406 GLU A OE2 1 +ATOM 3146 N N . CYS A 1 387 ? 80.729 83.643 126.032 1.00 9.15 ? 407 CYS A N 1 +ATOM 3147 C CA . CYS A 1 387 ? 79.421 84.021 126.535 1.00 10.11 ? 407 CYS A CA 1 +ATOM 3148 C C . CYS A 1 387 ? 78.470 84.250 125.367 1.00 10.00 ? 407 CYS A C 1 +ATOM 3149 O O . CYS A 1 387 ? 78.905 84.290 124.224 1.00 10.38 ? 407 CYS A O 1 +ATOM 3150 C CB . CYS A 1 387 ? 79.538 85.282 127.356 1.00 10.81 ? 407 CYS A CB 1 +ATOM 3151 S SG . CYS A 1 387 ? 79.773 86.676 126.302 1.00 14.46 ? 407 CYS A SG 1 +ATOM 3152 N N . PRO A 1 388 ? 77.165 84.416 125.643 1.00 9.88 ? 408 PRO A N 1 +ATOM 3153 C CA . PRO A 1 388 ? 76.218 84.561 124.534 1.00 10.18 ? 408 PRO A CA 1 +ATOM 3154 C C . PRO A 1 388 ? 76.187 85.938 123.856 1.00 10.21 ? 408 PRO A C 1 +ATOM 3155 O O . PRO A 1 388 ? 75.107 86.377 123.424 1.00 10.84 ? 408 PRO A O 1 +ATOM 3156 C CB . PRO A 1 388 ? 74.863 84.234 125.180 1.00 10.48 ? 408 PRO A CB 1 +ATOM 3157 C CG . PRO A 1 388 ? 75.188 83.680 126.536 1.00 10.50 ? 408 PRO A CG 1 +ATOM 3158 C CD . PRO A 1 388 ? 76.457 84.375 126.923 1.00 10.48 ? 408 PRO A CD 1 +ATOM 3159 N N . GLY A 1 389 ? 77.354 86.568 123.709 1.00 9.92 ? 409 GLY A N 1 +ATOM 3160 C CA . GLY A 1 389 ? 77.502 87.857 123.015 1.00 9.99 ? 409 GLY A CA 1 +ATOM 3161 C C . GLY A 1 389 ? 77.567 87.723 121.500 1.00 10.32 ? 409 GLY A C 1 +ATOM 3162 O O . GLY A 1 389 ? 78.518 88.179 120.836 1.00 10.59 ? 409 GLY A O 1 +ATOM 3163 N N . VAL A 1 390 ? 76.539 87.102 120.949 1.00 10.15 ? 410 VAL A N 1 +ATOM 3164 C CA . VAL A 1 390 ? 76.456 86.867 119.525 1.00 10.26 ? 410 VAL A CA 1 +ATOM 3165 C C . VAL A 1 390 ? 75.247 87.602 118.995 1.00 10.25 ? 410 VAL A C 1 +ATOM 3166 O O . VAL A 1 390 ? 74.283 87.783 119.725 1.00 11.17 ? 410 VAL A O 1 +ATOM 3167 C CB . VAL A 1 390 ? 76.345 85.357 119.222 1.00 10.25 ? 410 VAL A CB 1 +ATOM 3168 C CG1 . VAL A 1 390 ? 75.067 84.752 119.884 1.00 9.71 ? 410 VAL A CG1 1 +ATOM 3169 C CG2 . VAL A 1 390 ? 76.401 85.110 117.713 1.00 10.70 ? 410 VAL A CG2 1 +ATOM 3170 N N . GLY A 1 391 ? 75.317 88.028 117.731 1.00 9.88 ? 411 GLY A N 1 +ATOM 3171 C CA . GLY A 1 391 ? 74.233 88.747 117.059 1.00 9.73 ? 411 GLY A CA 1 +ATOM 3172 C C . GLY A 1 391 ? 74.168 90.237 117.370 1.00 10.07 ? 411 GLY A C 1 +ATOM 3173 O O . GLY A 1 391 ? 73.134 90.874 117.161 1.00 10.09 ? 411 GLY A O 1 +ATOM 3174 N N . LEU A 1 392 ? 75.271 90.788 117.873 1.00 9.67 ? 412 LEU A N 1 +ATOM 3175 C CA . LEU A 1 392 ? 75.349 92.215 118.179 1.00 10.25 ? 412 LEU A CA 1 +ATOM 3176 C C . LEU A 1 392 ? 75.639 92.930 116.874 1.00 10.33 ? 412 LEU A C 1 +ATOM 3177 O O . LEU A 1 392 ? 76.734 93.435 116.675 1.00 10.97 ? 412 LEU A O 1 +ATOM 3178 C CB . LEU A 1 392 ? 76.437 92.509 119.216 1.00 9.85 ? 412 LEU A CB 1 +ATOM 3179 C CG . LEU A 1 392 ? 76.140 92.087 120.648 1.00 10.28 ? 412 LEU A CG 1 +ATOM 3180 C CD1 . LEU A 1 392 ? 77.453 92.064 121.449 1.00 12.28 ? 412 LEU A CD1 1 +ATOM 3181 C CD2 . LEU A 1 392 ? 75.129 93.035 121.268 1.00 11.29 ? 412 LEU A CD2 1 +ATOM 3182 N N . ALA A 1 393 ? 74.636 92.953 115.997 1.00 11.49 ? 413 ALA A N 1 +ATOM 3183 C CA . ALA A 1 393 ? 74.793 93.375 114.603 1.00 12.25 ? 413 ALA A CA 1 +ATOM 3184 C C . ALA A 1 393 ? 74.399 94.813 114.338 1.00 12.79 ? 413 ALA A C 1 +ATOM 3185 O O . ALA A 1 393 ? 74.829 95.363 113.334 1.00 12.52 ? 413 ALA A O 1 +ATOM 3186 C CB . ALA A 1 393 ? 73.977 92.462 113.684 1.00 12.43 ? 413 ALA A CB 1 +ATOM 3187 N N . LEU A 1 394 ? 73.565 95.410 115.196 1.00 13.79 ? 414 LEU A N 1 +ATOM 3188 C CA . LEU A 1 394 ? 72.968 96.722 114.926 1.00 14.02 ? 414 LEU A CA 1 +ATOM 3189 C C . LEU A 1 394 ? 73.514 97.777 115.883 1.00 14.90 ? 414 LEU A C 1 +ATOM 3190 O O . LEU A 1 394 ? 73.762 97.467 117.055 1.00 14.53 ? 414 LEU A O 1 +ATOM 3191 C CB . LEU A 1 394 ? 71.448 96.650 115.071 1.00 14.11 ? 414 LEU A CB 1 +ATOM 3192 C CG . LEU A 1 394 ? 70.675 95.606 114.254 1.00 13.52 ? 414 LEU A CG 1 +ATOM 3193 C CD1 . LEU A 1 394 ? 69.167 95.662 114.558 1.00 15.09 ? 414 LEU A CD1 1 +ATOM 3194 C CD2 . LEU A 1 394 ? 70.921 95.789 112.770 1.00 14.84 ? 414 LEU A CD2 1 +ATOM 3195 N N . PRO A 1 395 ? 73.698 99.032 115.400 1.00 16.08 ? 415 PRO A N 1 +ATOM 3196 C CA . PRO A 1 395 ? 74.154 100.098 116.293 1.00 16.72 ? 415 PRO A CA 1 +ATOM 3197 C C . PRO A 1 395 ? 73.402 100.200 117.629 1.00 17.61 ? 415 PRO A C 1 +ATOM 3198 O O . PRO A 1 395 ? 74.024 100.473 118.652 1.00 17.75 ? 415 PRO A O 1 +ATOM 3199 C CB . PRO A 1 395 ? 73.963 101.373 115.458 1.00 16.98 ? 415 PRO A CB 1 +ATOM 3200 C CG . PRO A 1 395 ? 74.060 100.927 114.047 1.00 17.14 ? 415 PRO A CG 1 +ATOM 3201 C CD . PRO A 1 395 ? 73.550 99.503 114.008 1.00 15.58 ? 415 PRO A CD 1 +ATOM 3202 N N . GLN A 1 396 ? 72.089 99.964 117.615 1.00 18.80 ? 416 GLN A N 1 +ATOM 3203 C CA . GLN A 1 396 ? 71.258 100.095 118.823 1.00 19.43 ? 416 GLN A CA 1 +ATOM 3204 C C . GLN A 1 396 ? 71.558 99.103 119.948 1.00 19.24 ? 416 GLN A C 1 +ATOM 3205 O O . GLN A 1 396 ? 71.147 99.330 121.090 1.00 19.23 ? 416 GLN A O 1 +ATOM 3206 C CB . GLN A 1 396 ? 69.765 100.004 118.469 1.00 19.66 ? 416 GLN A CB 1 +ATOM 3207 C CG . GLN A 1 396 ? 69.300 98.638 117.977 1.00 20.51 ? 416 GLN A CG 1 +ATOM 3208 C CD . GLN A 1 396 ? 67.831 98.620 117.589 1.00 21.32 ? 416 GLN A CD 1 +ATOM 3209 O OE1 . GLN A 1 396 ? 66.944 98.519 118.446 1.00 25.07 ? 416 GLN A OE1 1 +ATOM 3210 N NE2 . GLN A 1 396 ? 67.566 98.706 116.290 1.00 21.83 ? 416 GLN A NE2 1 +ATOM 3211 N N . PHE A 1 397 ? 72.249 98.005 119.635 1.00 18.74 ? 417 PHE A N 1 +ATOM 3212 C CA . PHE A 1 397 ? 72.574 96.990 120.637 1.00 18.57 ? 417 PHE A CA 1 +ATOM 3213 C C . PHE A 1 397 ? 73.768 97.369 121.504 1.00 19.21 ? 417 PHE A C 1 +ATOM 3214 O O . PHE A 1 397 ? 74.040 96.679 122.488 1.00 19.41 ? 417 PHE A O 1 +ATOM 3215 C CB . PHE A 1 397 ? 72.855 95.616 119.996 1.00 17.57 ? 417 PHE A CB 1 +ATOM 3216 C CG . PHE A 1 397 ? 71.706 95.043 119.201 1.00 16.90 ? 417 PHE A CG 1 +ATOM 3217 C CD1 . PHE A 1 397 ? 70.389 95.399 119.455 1.00 16.03 ? 417 PHE A CD1 1 +ATOM 3218 C CD2 . PHE A 1 397 ? 71.954 94.102 118.214 1.00 16.02 ? 417 PHE A CD2 1 +ATOM 3219 C CE1 . PHE A 1 397 ? 69.345 94.851 118.711 1.00 14.87 ? 417 PHE A CE1 1 +ATOM 3220 C CE2 . PHE A 1 397 ? 70.923 93.552 117.476 1.00 15.77 ? 417 PHE A CE2 1 +ATOM 3221 C CZ . PHE A 1 397 ? 69.612 93.932 117.731 1.00 16.55 ? 417 PHE A CZ 1 +ATOM 3222 N N . PHE A 1 398 ? 74.471 98.445 121.144 1.00 19.78 ? 418 PHE A N 1 +ATOM 3223 C CA . PHE A 1 398 ? 75.590 98.946 121.929 1.00 20.40 ? 418 PHE A CA 1 +ATOM 3224 C C . PHE A 1 398 ? 75.123 100.169 122.693 1.00 22.00 ? 418 PHE A C 1 +ATOM 3225 O O . PHE A 1 398 ? 75.219 101.302 122.209 1.00 22.25 ? 418 PHE A O 1 +ATOM 3226 C CB . PHE A 1 398 ? 76.780 99.251 121.023 1.00 19.77 ? 418 PHE A CB 1 +ATOM 3227 C CG . PHE A 1 398 ? 77.204 98.075 120.209 1.00 18.89 ? 418 PHE A CG 1 +ATOM 3228 C CD1 . PHE A 1 398 ? 78.033 97.108 120.752 1.00 17.77 ? 418 PHE A CD1 1 +ATOM 3229 C CD2 . PHE A 1 398 ? 76.720 97.895 118.923 1.00 17.33 ? 418 PHE A CD2 1 +ATOM 3230 C CE1 . PHE A 1 398 ? 78.403 96.001 120.016 1.00 17.05 ? 418 PHE A CE1 1 +ATOM 3231 C CE2 . PHE A 1 398 ? 77.091 96.782 118.175 1.00 17.58 ? 418 PHE A CE2 1 +ATOM 3232 C CZ . PHE A 1 398 ? 77.930 95.841 118.721 1.00 17.87 ? 418 PHE A CZ 1 +ATOM 3233 N N . ASN A 1 399 ? 74.580 99.899 123.875 1.00 23.84 ? 419 ASN A N 1 +ATOM 3234 C CA . ASN A 1 399 ? 74.057 100.906 124.789 1.00 25.32 ? 419 ASN A CA 1 +ATOM 3235 C C . ASN A 1 399 ? 74.645 100.687 126.185 1.00 26.10 ? 419 ASN A C 1 +ATOM 3236 O O . ASN A 1 399 ? 74.960 99.557 126.558 1.00 26.47 ? 419 ASN A O 1 +ATOM 3237 C CB . ASN A 1 399 ? 72.514 100.884 124.799 1.00 25.64 ? 419 ASN A CB 1 +ATOM 3238 C CG . ASN A 1 399 ? 71.920 99.475 124.964 1.00 26.48 ? 419 ASN A CG 1 +ATOM 3239 O OD1 . ASN A 1 399 ? 71.796 98.976 126.078 1.00 27.34 ? 419 ASN A OD1 1 +ATOM 3240 N ND2 . ASN A 1 399 ? 71.507 98.858 123.858 1.00 25.94 ? 419 ASN A ND2 1 +ATOM 3241 N N . ASN A 1 400 ? 74.819 101.769 126.945 1.00 26.97 ? 420 ASN A N 1 +ATOM 3242 C CA . ASN A 1 400 ? 75.321 101.677 128.326 1.00 27.13 ? 420 ASN A CA 1 +ATOM 3243 C C . ASN A 1 400 ? 74.603 100.589 129.134 1.00 26.79 ? 420 ASN A C 1 +ATOM 3244 O O . ASN A 1 400 ? 75.208 99.943 129.996 1.00 26.97 ? 420 ASN A O 1 +ATOM 3245 C CB . ASN A 1 400 ? 75.185 103.028 129.049 1.00 27.53 ? 420 ASN A CB 1 +ATOM 3246 C CG . ASN A 1 400 ? 76.000 103.096 130.342 1.00 28.63 ? 420 ASN A CG 1 +ATOM 3247 O OD1 . ASN A 1 400 ? 75.478 103.456 131.402 1.00 30.99 ? 420 ASN A OD1 1 +ATOM 3248 N ND2 . ASN A 1 400 ? 77.284 102.756 130.256 1.00 30.01 ? 420 ASN A ND2 1 +ATOM 3249 N N . VAL A 1 401 ? 73.316 100.404 128.849 1.00 26.44 ? 421 VAL A N 1 +ATOM 3250 C CA . VAL A 1 401 ? 72.512 99.358 129.471 1.00 26.12 ? 421 VAL A CA 1 +ATOM 3251 C C . VAL A 1 401 ? 72.935 97.957 129.011 1.00 25.36 ? 421 VAL A C 1 +ATOM 3252 O O . VAL A 1 401 ? 73.003 97.039 129.823 1.00 25.52 ? 421 VAL A O 1 +ATOM 3253 C CB . VAL A 1 401 ? 71.004 99.537 129.164 1.00 26.27 ? 421 VAL A CB 1 +ATOM 3254 C CG1 . VAL A 1 401 ? 70.189 98.500 129.897 1.00 26.16 ? 421 VAL A CG1 1 +ATOM 3255 C CG2 . VAL A 1 401 ? 70.535 100.943 129.533 1.00 27.19 ? 421 VAL A CG2 1 +ATOM 3256 N N . SER A 1 402 ? 73.190 97.798 127.711 1.00 24.32 ? 422 SER A N 1 +ATOM 3257 C CA . SER A 1 402 ? 73.654 96.515 127.148 1.00 23.39 ? 422 SER A CA 1 +ATOM 3258 C C . SER A 1 402 ? 75.016 96.168 127.728 1.00 22.29 ? 422 SER A C 1 +ATOM 3259 O O . SER A 1 402 ? 75.290 95.009 128.054 1.00 21.95 ? 422 SER A O 1 +ATOM 3260 C CB . SER A 1 402 ? 73.770 96.571 125.613 1.00 23.25 ? 422 SER A CB 1 +ATOM 3261 O OG . SER A 1 402 ? 72.533 96.296 124.959 1.00 24.77 ? 422 SER A OG 1 +ATOM 3262 N N . LEU A 1 403 ? 75.859 97.187 127.855 1.00 21.72 ? 423 LEU A N 1 +ATOM 3263 C CA . LEU A 1 403 ? 77.212 97.032 128.381 1.00 21.10 ? 423 LEU A CA 1 +ATOM 3264 C C . LEU A 1 403 ? 77.224 96.531 129.822 1.00 20.76 ? 423 LEU A C 1 +ATOM 3265 O O . LEU A 1 403 ? 78.003 95.641 130.156 1.00 20.59 ? 423 LEU A O 1 +ATOM 3266 C CB . LEU A 1 403 ? 77.982 98.348 128.283 1.00 20.99 ? 423 LEU A CB 1 +ATOM 3267 C CG . LEU A 1 403 ? 79.431 98.356 128.788 1.00 21.01 ? 423 LEU A CG 1 +ATOM 3268 C CD1 . LEU A 1 403 ? 80.235 97.164 128.276 1.00 20.79 ? 423 LEU A CD1 1 +ATOM 3269 C CD2 . LEU A 1 403 ? 80.091 99.675 128.391 1.00 20.98 ? 423 LEU A CD2 1 +ATOM 3270 N N . HIS A 1 404 ? 76.367 97.099 130.676 1.00 20.14 ? 424 HIS A N 1 +ATOM 3271 C CA . HIS A 1 404 ? 76.267 96.634 132.066 1.00 19.67 ? 424 HIS A CA 1 +ATOM 3272 C C . HIS A 1 404 ? 75.794 95.183 132.128 1.00 19.13 ? 424 HIS A C 1 +ATOM 3273 O O . HIS A 1 404 ? 76.362 94.371 132.852 1.00 19.13 ? 424 HIS A O 1 +ATOM 3274 C CB . HIS A 1 404 ? 75.344 97.530 132.899 1.00 19.71 ? 424 HIS A CB 1 +ATOM 3275 C CG . HIS A 1 404 ? 75.280 97.486 134.189 0.00 24.38 ? 424 HIS A CG 1 +ATOM 3276 N ND1 . HIS A 1 404 ? 74.515 96.649 134.973 0.00 26.99 ? 424 HIS A ND1 1 +ATOM 3277 C CD2 . HIS A 1 404 ? 76.003 98.244 135.047 0.00 26.71 ? 424 HIS A CD2 1 +ATOM 3278 C CE1 . HIS A 1 404 ? 74.793 96.865 136.246 0.00 26.44 ? 424 HIS A CE1 1 +ATOM 3279 N NE2 . HIS A 1 404 ? 75.693 97.827 136.317 0.00 26.32 ? 424 HIS A NE2 1 +ATOM 3280 N N . HIS A 1 405 ? 74.757 94.851 131.368 1.00 18.24 ? 425 HIS A N 1 +ATOM 3281 C CA . HIS A 1 405 ? 74.261 93.487 131.363 1.00 17.99 ? 425 HIS A CA 1 +ATOM 3282 C C . HIS A 1 405 ? 75.350 92.518 130.881 1.00 16.51 ? 425 HIS A C 1 +ATOM 3283 O O . HIS A 1 405 ? 75.528 91.464 131.467 1.00 15.50 ? 425 HIS A O 1 +ATOM 3284 C CB . HIS A 1 405 ? 72.991 93.347 130.514 1.00 18.35 ? 425 HIS A CB 1 +ATOM 3285 C CG . HIS A 1 405 ? 72.510 91.936 130.389 1.00 19.35 ? 425 HIS A CG 1 +ATOM 3286 N ND1 . HIS A 1 405 ? 72.590 91.228 129.211 1.00 20.89 ? 425 HIS A ND1 1 +ATOM 3287 C CD2 . HIS A 1 405 ? 71.985 91.085 131.302 1.00 20.77 ? 425 HIS A CD2 1 +ATOM 3288 C CE1 . HIS A 1 405 ? 72.116 90.009 129.396 1.00 20.48 ? 425 HIS A CE1 1 +ATOM 3289 N NE2 . HIS A 1 405 ? 71.751 89.894 130.659 1.00 21.27 ? 425 HIS A NE2 1 +ATOM 3290 N N . HIS A 1 406 ? 76.086 92.902 129.840 1.00 15.88 ? 426 HIS A N 1 +ATOM 3291 C CA . HIS A 1 406 ? 77.148 92.054 129.262 1.00 15.41 ? 426 HIS A CA 1 +ATOM 3292 C C . HIS A 1 406 ? 78.256 91.829 130.290 1.00 15.38 ? 426 HIS A C 1 +ATOM 3293 O O . HIS A 1 406 ? 78.753 90.703 130.460 1.00 14.21 ? 426 HIS A O 1 +ATOM 3294 C CB . HIS A 1 406 ? 77.722 92.702 127.992 1.00 14.95 ? 426 HIS A CB 1 +ATOM 3295 C CG . HIS A 1 406 ? 78.404 91.746 127.048 1.00 14.59 ? 426 HIS A CG 1 +ATOM 3296 N ND1 . HIS A 1 406 ? 78.310 91.872 125.678 1.00 14.70 ? 426 HIS A ND1 1 +ATOM 3297 C CD2 . HIS A 1 406 ? 79.210 90.681 127.269 1.00 14.97 ? 426 HIS A CD2 1 +ATOM 3298 C CE1 . HIS A 1 406 ? 79.026 90.925 125.096 1.00 13.42 ? 426 HIS A CE1 1 +ATOM 3299 N NE2 . HIS A 1 406 ? 79.579 90.185 126.038 1.00 14.00 ? 426 HIS A NE2 1 +ATOM 3300 N N . MET A 1 407 ? 78.626 92.897 130.989 1.00 15.98 ? 427 MET A N 1 +ATOM 3301 C CA . MET A 1 407 ? 79.618 92.785 132.059 1.00 16.41 ? 427 MET A CA 1 +ATOM 3302 C C . MET A 1 407 ? 79.141 91.812 133.145 1.00 15.96 ? 427 MET A C 1 +ATOM 3303 O O . MET A 1 407 ? 79.920 91.012 133.634 1.00 14.98 ? 427 MET A O 1 +ATOM 3304 C CB . MET A 1 407 ? 79.934 94.171 132.668 1.00 16.25 ? 427 MET A CB 1 +ATOM 3305 C CG . MET A 1 407 ? 80.792 95.034 131.760 1.00 16.82 ? 427 MET A CG 1 +ATOM 3306 S SD . MET A 1 407 ? 81.082 96.747 132.295 1.00 20.31 ? 427 MET A SD 1 +ATOM 3307 C CE . MET A 1 407 ? 79.443 97.378 132.498 1.00 21.11 ? 427 MET A CE 1 +ATOM 3308 N N . GLN A 1 408 ? 77.860 91.896 133.515 1.00 16.01 ? 428 GLN A N 1 +ATOM 3309 C CA . GLN A 1 408 ? 77.283 91.000 134.511 1.00 16.14 ? 428 GLN A CA 1 +ATOM 3310 C C . GLN A 1 408 ? 77.277 89.562 134.001 1.00 15.32 ? 428 GLN A C 1 +ATOM 3311 O O . GLN A 1 408 ? 77.553 88.623 134.753 1.00 14.87 ? 428 GLN A O 1 +ATOM 3312 C CB . GLN A 1 408 ? 75.865 91.432 134.877 1.00 16.99 ? 428 GLN A CB 1 +ATOM 3313 C CG . GLN A 1 408 ? 75.808 92.766 135.596 1.00 19.81 ? 428 GLN A CG 1 +ATOM 3314 C CD . GLN A 1 408 ? 75.050 92.679 136.894 1.00 24.06 ? 428 GLN A CD 1 +ATOM 3315 O OE1 . GLN A 1 408 ? 75.637 92.773 137.973 1.00 29.27 ? 428 GLN A OE1 1 +ATOM 3316 N NE2 . GLN A 1 408 ? 73.740 92.484 136.803 1.00 27.19 ? 428 GLN A NE2 1 +ATOM 3317 N N . VAL A 1 409 ? 76.950 89.397 132.723 1.00 14.26 ? 429 VAL A N 1 +ATOM 3318 C CA . VAL A 1 409 ? 76.913 88.069 132.112 1.00 14.40 ? 429 VAL A CA 1 +ATOM 3319 C C . VAL A 1 409 ? 78.319 87.450 132.129 1.00 14.16 ? 429 VAL A C 1 +ATOM 3320 O O . VAL A 1 409 ? 78.486 86.296 132.504 1.00 13.26 ? 429 VAL A O 1 +ATOM 3321 C CB . VAL A 1 409 ? 76.307 88.122 130.690 1.00 14.38 ? 429 VAL A CB 1 +ATOM 3322 C CG1 . VAL A 1 409 ? 76.509 86.811 129.950 1.00 15.31 ? 429 VAL A CG1 1 +ATOM 3323 C CG2 . VAL A 1 409 ? 74.807 88.457 130.778 1.00 13.58 ? 429 VAL A CG2 1 +ATOM 3324 N N . MET A 1 410 ? 79.335 88.224 131.775 1.00 15.01 ? 430 MET A N 1 +ATOM 3325 C CA . MET A 1 410 ? 80.709 87.713 131.871 1.00 15.05 ? 430 MET A CA 1 +ATOM 3326 C C . MET A 1 410 ? 81.074 87.339 133.303 1.00 15.62 ? 430 MET A C 1 +ATOM 3327 O O . MET A 1 410 ? 81.753 86.334 133.519 1.00 15.77 ? 430 MET A O 1 +ATOM 3328 C CB . MET A 1 410 ? 81.738 88.705 131.325 1.00 15.79 ? 430 MET A CB 1 +ATOM 3329 C CG . MET A 1 410 ? 81.894 88.680 129.825 1.00 15.79 ? 430 MET A CG 1 +ATOM 3330 S SD . MET A 1 410 ? 82.167 87.024 129.179 1.00 16.77 ? 430 MET A SD 1 +ATOM 3331 C CE . MET A 1 410 ? 83.723 86.513 129.892 1.00 16.24 ? 430 MET A CE 1 +ATOM 3332 N N . GLU A 1 411 ? 80.628 88.137 134.276 1.00 15.80 ? 431 GLU A N 1 +ATOM 3333 C CA . GLU A 1 411 ? 80.835 87.797 135.690 1.00 15.49 ? 431 GLU A CA 1 +ATOM 3334 C C . GLU A 1 411 ? 80.253 86.434 136.057 1.00 14.75 ? 431 GLU A C 1 +ATOM 3335 O O . GLU A 1 411 ? 80.877 85.674 136.791 1.00 13.70 ? 431 GLU A O 1 +ATOM 3336 C CB . GLU A 1 411 ? 80.252 88.867 136.620 1.00 16.14 ? 431 GLU A CB 1 +ATOM 3337 C CG . GLU A 1 411 ? 81.083 90.118 136.682 1.00 18.73 ? 431 GLU A CG 1 +ATOM 3338 C CD . GLU A 1 411 ? 80.714 91.029 137.827 1.00 21.99 ? 431 GLU A CD 1 +ATOM 3339 O OE1 . GLU A 1 411 ? 80.907 90.608 138.995 1.00 24.68 ? 431 GLU A OE1 1 +ATOM 3340 O OE2 . GLU A 1 411 ? 80.262 92.172 137.557 1.00 24.55 ? 431 GLU A OE2 1 +ATOM 3341 N N . GLU A 1 412 ? 79.051 86.143 135.556 1.00 13.80 ? 432 GLU A N 1 +ATOM 3342 C CA . GLU A 1 412 ? 78.409 84.854 135.786 1.00 13.25 ? 432 GLU A CA 1 +ATOM 3343 C C . GLU A 1 412 ? 79.204 83.740 135.131 1.00 12.26 ? 432 GLU A C 1 +ATOM 3344 O O . GLU A 1 412 ? 79.386 82.679 135.707 1.00 11.99 ? 432 GLU A O 1 +ATOM 3345 C CB . GLU A 1 412 ? 76.986 84.851 135.220 1.00 13.44 ? 432 GLU A CB 1 +ATOM 3346 C CG . GLU A 1 412 ? 75.954 85.485 136.113 1.00 14.36 ? 432 GLU A CG 1 +ATOM 3347 C CD . GLU A 1 412 ? 74.551 85.330 135.552 1.00 15.21 ? 432 GLU A CD 1 +ATOM 3348 O OE1 . GLU A 1 412 ? 73.892 84.294 135.848 1.00 14.13 ? 432 GLU A OE1 1 +ATOM 3349 O OE2 . GLU A 1 412 ? 74.136 86.235 134.785 1.00 14.35 ? 432 GLU A OE2 1 +ATOM 3350 N N . VAL A 1 413 ? 79.681 84.001 133.916 1.00 12.34 ? 433 VAL A N 1 +ATOM 3351 C CA . VAL A 1 413 ? 80.440 83.025 133.160 1.00 11.49 ? 433 VAL A CA 1 +ATOM 3352 C C . VAL A 1 413 ? 81.746 82.682 133.888 1.00 11.41 ? 433 VAL A C 1 +ATOM 3353 O O . VAL A 1 413 ? 82.053 81.508 134.129 1.00 10.92 ? 433 VAL A O 1 +ATOM 3354 C CB . VAL A 1 413 ? 80.700 83.514 131.708 1.00 10.84 ? 433 VAL A CB 1 +ATOM 3355 C CG1 . VAL A 1 413 ? 81.589 82.553 130.966 1.00 10.82 ? 433 VAL A CG1 1 +ATOM 3356 C CG2 . VAL A 1 413 ? 79.365 83.649 130.954 1.00 10.14 ? 433 VAL A CG2 1 +ATOM 3357 N N . VAL A 1 414 ? 82.488 83.718 134.263 1.00 11.00 ? 434 VAL A N 1 +ATOM 3358 C CA . VAL A 1 414 ? 83.724 83.541 135.019 1.00 11.20 ? 434 VAL A CA 1 +ATOM 3359 C C . VAL A 1 414 ? 83.489 82.839 136.362 1.00 10.93 ? 434 VAL A C 1 +ATOM 3360 O O . VAL A 1 414 ? 84.212 81.901 136.706 1.00 11.76 ? 434 VAL A O 1 +ATOM 3361 C CB . VAL A 1 414 ? 84.428 84.889 135.235 1.00 11.32 ? 434 VAL A CB 1 +ATOM 3362 C CG1 . VAL A 1 414 ? 85.642 84.738 136.171 1.00 11.09 ? 434 VAL A CG1 1 +ATOM 3363 C CG2 . VAL A 1 414 ? 84.837 85.483 133.886 1.00 11.52 ? 434 VAL A CG2 1 +ATOM 3364 N N . ARG A 1 415 ? 82.474 83.273 137.117 1.00 10.91 ? 435 ARG A N 1 +ATOM 3365 C CA . ARG A 1 415 ? 82.131 82.614 138.391 1.00 10.47 ? 435 ARG A CA 1 +ATOM 3366 C C . ARG A 1 415 ? 81.890 81.117 138.207 1.00 10.60 ? 435 ARG A C 1 +ATOM 3367 O O . ARG A 1 415 ? 82.329 80.297 139.008 1.00 10.50 ? 435 ARG A O 1 +ATOM 3368 C CB . ARG A 1 415 ? 80.877 83.239 139.004 1.00 10.74 ? 435 ARG A CB 1 +ATOM 3369 C CG . ARG A 1 415 ? 80.366 82.507 140.240 1.00 10.31 ? 435 ARG A CG 1 +ATOM 3370 C CD . ARG A 1 415 ? 79.203 83.201 140.926 1.00 10.87 ? 435 ARG A CD 1 +ATOM 3371 N NE . ARG A 1 415 ? 77.978 83.214 140.124 1.00 11.12 ? 435 ARG A NE 1 +ATOM 3372 C CZ . ARG A 1 415 ? 76.793 83.600 140.580 1.00 12.53 ? 435 ARG A CZ 1 +ATOM 3373 N NH1 . ARG A 1 415 ? 76.649 83.993 141.836 1.00 12.62 ? 435 ARG A NH1 1 +ATOM 3374 N NH2 . ARG A 1 415 ? 75.742 83.596 139.778 1.00 13.47 ? 435 ARG A NH2 1 +ATOM 3375 N N . ARG A 1 416 ? 81.170 80.760 137.147 1.00 10.70 ? 436 ARG A N 1 +ATOM 3376 C CA . ARG A 1 416 ? 80.774 79.384 136.966 1.00 10.83 ? 436 ARG A CA 1 +ATOM 3377 C C . ARG A 1 416 ? 81.951 78.523 136.551 1.00 10.86 ? 436 ARG A C 1 +ATOM 3378 O O . ARG A 1 416 ? 82.081 77.397 137.029 1.00 10.33 ? 436 ARG A O 1 +ATOM 3379 C CB . ARG A 1 416 ? 79.639 79.243 135.940 1.00 10.50 ? 436 ARG A CB 1 +ATOM 3380 C CG . ARG A 1 416 ? 78.911 77.905 136.034 1.00 10.90 ? 436 ARG A CG 1 +ATOM 3381 C CD . ARG A 1 416 ? 78.039 77.616 134.796 1.00 11.67 ? 436 ARG A CD 1 +ATOM 3382 N NE . ARG A 1 416 ? 78.869 77.288 133.639 1.00 10.83 ? 436 ARG A NE 1 +ATOM 3383 C CZ . ARG A 1 416 ? 78.415 76.799 132.489 1.00 10.63 ? 436 ARG A CZ 1 +ATOM 3384 N NH1 . ARG A 1 416 ? 77.115 76.603 132.287 1.00 7.96 ? 436 ARG A NH1 1 +ATOM 3385 N NH2 . ARG A 1 416 ? 79.286 76.540 131.527 1.00 10.20 ? 436 ARG A NH2 1 +ATOM 3386 N N . ASP A 1 417 ? 82.818 79.055 135.684 1.00 11.04 ? 437 ASP A N 1 +ATOM 3387 C CA . ASP A 1 417 ? 83.809 78.215 135.020 1.00 11.50 ? 437 ASP A CA 1 +ATOM 3388 C C . ASP A 1 417 ? 85.260 78.492 135.368 1.00 11.47 ? 437 ASP A C 1 +ATOM 3389 O O . ASP A 1 417 ? 86.119 77.820 134.834 1.00 10.92 ? 437 ASP A O 1 +ATOM 3390 C CB . ASP A 1 417 ? 83.636 78.297 133.498 1.00 11.95 ? 437 ASP A CB 1 +ATOM 3391 C CG . ASP A 1 417 ? 82.358 77.632 133.024 1.00 12.17 ? 437 ASP A CG 1 +ATOM 3392 O OD1 . ASP A 1 417 ? 81.663 77.005 133.847 1.00 11.48 ? 437 ASP A OD1 1 +ATOM 3393 O OD2 . ASP A 1 417 ? 82.049 77.742 131.833 1.00 12.89 ? 437 ASP A OD2 1 +ATOM 3394 N N . LYS A 1 418 ? 85.510 79.467 136.250 1.00 11.57 ? 438 LYS A N 1 +ATOM 3395 C CA . LYS A 1 418 ? 86.882 79.883 136.628 1.00 12.30 ? 438 LYS A CA 1 +ATOM 3396 C C . LYS A 1 418 ? 87.822 78.777 137.084 1.00 12.55 ? 438 LYS A C 1 +ATOM 3397 O O . LYS A 1 418 ? 89.046 78.946 137.015 1.00 12.45 ? 438 LYS A O 1 +ATOM 3398 C CB . LYS A 1 418 ? 86.827 80.923 137.744 1.00 12.34 ? 438 LYS A CB 1 +ATOM 3399 C CG . LYS A 1 418 ? 86.184 80.415 139.039 1.00 14.12 ? 438 LYS A CG 1 +ATOM 3400 C CD . LYS A 1 418 ? 85.819 81.552 139.971 1.00 14.92 ? 438 LYS A CD 1 +ATOM 3401 C CE . LYS A 1 418 ? 85.062 81.038 141.172 1.00 15.67 ? 438 LYS A CE 1 +ATOM 3402 N NZ . LYS A 1 418 ? 84.908 82.046 142.242 1.00 15.19 ? 438 LYS A NZ 1 +ATOM 3403 N N . ASN A 1 419 ? 87.279 77.674 137.595 1.00 12.27 ? 439 ASN A N 1 +ATOM 3404 C CA . ASN A 1 419 ? 88.114 76.606 138.164 1.00 12.35 ? 439 ASN A CA 1 +ATOM 3405 C C . ASN A 1 419 ? 88.393 75.427 137.221 1.00 12.24 ? 439 ASN A C 1 +ATOM 3406 O O . ASN A 1 419 ? 89.022 74.444 137.623 1.00 12.48 ? 439 ASN A O 1 +ATOM 3407 C CB . ASN A 1 419 ? 87.512 76.111 139.492 1.00 12.83 ? 439 ASN A CB 1 +ATOM 3408 C CG . ASN A 1 419 ? 87.532 77.184 140.577 1.00 12.40 ? 439 ASN A CG 1 +ATOM 3409 O OD1 . ASN A 1 419 ? 88.533 77.884 140.742 1.00 15.13 ? 439 ASN A OD1 1 +ATOM 3410 N ND2 . ASN A 1 419 ? 86.423 77.327 141.309 1.00 13.14 ? 439 ASN A ND2 1 +ATOM 3411 N N . HIS A 1 420 ? 87.946 75.518 135.966 1.00 11.67 ? 440 HIS A N 1 +ATOM 3412 C CA . HIS A 1 420 ? 88.167 74.444 135.009 1.00 11.53 ? 440 HIS A CA 1 +ATOM 3413 C C . HIS A 1 420 ? 89.536 74.590 134.352 1.00 11.35 ? 440 HIS A C 1 +ATOM 3414 O O . HIS A 1 420 ? 89.742 75.549 133.624 1.00 10.81 ? 440 HIS A O 1 +ATOM 3415 C CB . HIS A 1 420 ? 87.097 74.482 133.921 1.00 11.58 ? 440 HIS A CB 1 +ATOM 3416 C CG . HIS A 1 420 ? 85.762 74.020 134.386 1.00 11.25 ? 440 HIS A CG 1 +ATOM 3417 N ND1 . HIS A 1 420 ? 85.545 72.742 134.843 1.00 11.27 ? 440 HIS A ND1 1 +ATOM 3418 C CD2 . HIS A 1 420 ? 84.577 74.663 134.475 1.00 13.55 ? 440 HIS A CD2 1 +ATOM 3419 C CE1 . HIS A 1 420 ? 84.273 72.610 135.172 1.00 12.44 ? 440 HIS A CE1 1 +ATOM 3420 N NE2 . HIS A 1 420 ? 83.668 73.764 134.974 1.00 10.54 ? 440 HIS A NE2 1 +ATOM 3421 N N . PRO A 1 421 ? 90.464 73.631 134.574 1.00 11.45 ? 441 PRO A N 1 +ATOM 3422 C CA . PRO A 1 421 ? 91.757 73.725 133.886 1.00 11.12 ? 441 PRO A CA 1 +ATOM 3423 C C . PRO A 1 421 ? 91.638 73.694 132.369 1.00 10.79 ? 441 PRO A C 1 +ATOM 3424 O O . PRO A 1 421 ? 92.476 74.263 131.685 1.00 11.16 ? 441 PRO A O 1 +ATOM 3425 C CB . PRO A 1 421 ? 92.517 72.493 134.383 1.00 11.10 ? 441 PRO A CB 1 +ATOM 3426 C CG . PRO A 1 421 ? 91.484 71.555 134.862 1.00 11.79 ? 441 PRO A CG 1 +ATOM 3427 C CD . PRO A 1 421 ? 90.421 72.443 135.444 1.00 11.55 ? 441 PRO A CD 1 +ATOM 3428 N N . ALA A 1 422 ? 90.587 73.059 131.848 1.00 9.79 ? 442 ALA A N 1 +ATOM 3429 C CA . ALA A 1 422 ? 90.401 72.955 130.409 1.00 9.67 ? 442 ALA A CA 1 +ATOM 3430 C C . ALA A 1 422 ? 90.094 74.304 129.761 1.00 9.18 ? 442 ALA A C 1 +ATOM 3431 O O . ALA A 1 422 ? 90.349 74.484 128.574 1.00 9.51 ? 442 ALA A O 1 +ATOM 3432 C CB . ALA A 1 422 ? 89.272 71.973 130.082 1.00 8.77 ? 442 ALA A CB 1 +ATOM 3433 N N . VAL A 1 423 ? 89.509 75.237 130.508 1.00 9.02 ? 443 VAL A N 1 +ATOM 3434 C CA . VAL A 1 423 ? 89.202 76.539 129.939 1.00 9.14 ? 443 VAL A CA 1 +ATOM 3435 C C . VAL A 1 423 ? 90.499 77.314 129.888 1.00 9.57 ? 443 VAL A C 1 +ATOM 3436 O O . VAL A 1 423 ? 91.123 77.538 130.926 1.00 10.62 ? 443 VAL A O 1 +ATOM 3437 C CB . VAL A 1 423 ? 88.190 77.328 130.758 1.00 9.21 ? 443 VAL A CB 1 +ATOM 3438 C CG1 . VAL A 1 423 ? 87.993 78.717 130.162 1.00 8.46 ? 443 VAL A CG1 1 +ATOM 3439 C CG2 . VAL A 1 423 ? 86.871 76.571 130.812 1.00 9.68 ? 443 VAL A CG2 1 +ATOM 3440 N N . VAL A 1 424 ? 90.919 77.678 128.684 1.00 9.53 ? 444 VAL A N 1 +ATOM 3441 C CA . VAL A 1 424 ? 92.191 78.381 128.493 1.00 9.60 ? 444 VAL A CA 1 +ATOM 3442 C C . VAL A 1 424 ? 92.038 79.833 127.997 1.00 9.69 ? 444 VAL A C 1 +ATOM 3443 O O . VAL A 1 424 ? 93.013 80.577 127.973 1.00 9.55 ? 444 VAL A O 1 +ATOM 3444 C CB . VAL A 1 424 ? 93.125 77.577 127.559 1.00 9.37 ? 444 VAL A CB 1 +ATOM 3445 C CG1 . VAL A 1 424 ? 93.468 76.249 128.206 1.00 9.22 ? 444 VAL A CG1 1 +ATOM 3446 C CG2 . VAL A 1 424 ? 92.505 77.358 126.179 1.00 10.13 ? 444 VAL A CG2 1 +ATOM 3447 N N . MET A 1 425 ? 90.828 80.247 127.635 1.00 10.01 ? 445 MET A N 1 +ATOM 3448 C CA . MET A 1 425 ? 90.597 81.608 127.154 1.00 9.85 ? 445 MET A CA 1 +ATOM 3449 C C . MET A 1 425 ? 89.118 81.930 127.222 1.00 10.12 ? 445 MET A C 1 +ATOM 3450 O O . MET A 1 425 ? 88.283 81.051 127.029 1.00 10.15 ? 445 MET A O 1 +ATOM 3451 C CB . MET A 1 425 ? 91.095 81.762 125.707 1.00 9.81 ? 445 MET A CB 1 +ATOM 3452 C CG . MET A 1 425 ? 91.001 83.172 125.147 1.00 9.06 ? 445 MET A CG 1 +ATOM 3453 S SD . MET A 1 425 ? 92.145 83.507 123.767 1.00 10.86 ? 445 MET A SD 1 +ATOM 3454 C CE . MET A 1 425 ? 91.714 82.292 122.522 1.00 7.93 ? 445 MET A CE 1 +ATOM 3455 N N . TRP A 1 426 ? 88.816 83.183 127.513 1.00 9.62 ? 446 TRP A N 1 +ATOM 3456 C CA . TRP A 1 426 ? 87.440 83.688 127.508 1.00 9.90 ? 446 TRP A CA 1 +ATOM 3457 C C . TRP A 1 426 ? 87.188 84.379 126.175 1.00 9.83 ? 446 TRP A C 1 +ATOM 3458 O O . TRP A 1 426 ? 88.048 85.111 125.675 1.00 9.50 ? 446 TRP A O 1 +ATOM 3459 C CB . TRP A 1 426 ? 87.204 84.709 128.632 1.00 10.22 ? 446 TRP A CB 1 +ATOM 3460 C CG . TRP A 1 426 ? 87.555 84.237 130.000 1.00 11.00 ? 446 TRP A CG 1 +ATOM 3461 C CD1 . TRP A 1 426 ? 88.604 84.670 130.771 1.00 11.17 ? 446 TRP A CD1 1 +ATOM 3462 C CD2 . TRP A 1 426 ? 86.874 83.233 130.777 1.00 11.54 ? 446 TRP A CD2 1 +ATOM 3463 N NE1 . TRP A 1 426 ? 88.615 84.000 131.970 1.00 11.62 ? 446 TRP A NE1 1 +ATOM 3464 C CE2 . TRP A 1 426 ? 87.564 83.115 132.001 1.00 12.21 ? 446 TRP A CE2 1 +ATOM 3465 C CE3 . TRP A 1 426 ? 85.740 82.435 130.560 1.00 11.54 ? 446 TRP A CE3 1 +ATOM 3466 C CZ2 . TRP A 1 426 ? 87.168 82.214 133.005 1.00 12.01 ? 446 TRP A CZ2 1 +ATOM 3467 C CZ3 . TRP A 1 426 ? 85.352 81.533 131.556 1.00 11.42 ? 446 TRP A CZ3 1 +ATOM 3468 C CH2 . TRP A 1 426 ? 86.062 81.439 132.763 1.00 11.69 ? 446 TRP A CH2 1 +ATOM 3469 N N . SER A 1 427 ? 86.009 84.157 125.599 1.00 9.29 ? 447 SER A N 1 +ATOM 3470 C CA . SER A 1 427 ? 85.558 84.929 124.452 1.00 9.26 ? 447 SER A CA 1 +ATOM 3471 C C . SER A 1 427 ? 84.298 85.710 124.842 1.00 9.15 ? 447 SER A C 1 +ATOM 3472 O O . SER A 1 427 ? 83.313 85.112 125.292 1.00 9.21 ? 447 SER A O 1 +ATOM 3473 C CB . SER A 1 427 ? 85.267 84.014 123.263 1.00 9.60 ? 447 SER A CB 1 +ATOM 3474 O OG . SER A 1 427 ? 84.683 84.725 122.195 1.00 9.76 ? 447 SER A OG 1 +ATOM 3475 N N . VAL A 1 428 ? 84.332 87.029 124.665 1.00 8.55 ? 448 VAL A N 1 +ATOM 3476 C CA . VAL A 1 428 ? 83.250 87.898 125.136 1.00 8.32 ? 448 VAL A CA 1 +ATOM 3477 C C . VAL A 1 428 ? 82.187 88.148 124.070 1.00 8.35 ? 448 VAL A C 1 +ATOM 3478 O O . VAL A 1 428 ? 81.104 88.652 124.384 1.00 7.72 ? 448 VAL A O 1 +ATOM 3479 C CB . VAL A 1 428 ? 83.786 89.249 125.688 1.00 9.21 ? 448 VAL A CB 1 +ATOM 3480 C CG1 . VAL A 1 428 ? 84.919 89.002 126.703 1.00 8.49 ? 448 VAL A CG1 1 +ATOM 3481 C CG2 . VAL A 1 428 ? 84.272 90.152 124.562 1.00 7.59 ? 448 VAL A CG2 1 +ATOM 3482 N N . ALA A 1 429 ? 82.484 87.799 122.814 1.00 8.64 ? 449 ALA A N 1 +ATOM 3483 C CA . ALA A 1 429 ? 81.523 87.991 121.725 1.00 8.57 ? 449 ALA A CA 1 +ATOM 3484 C C . ALA A 1 429 ? 81.893 87.206 120.475 1.00 8.51 ? 449 ALA A C 1 +ATOM 3485 O O . ALA A 1 429 ? 83.031 86.783 120.291 1.00 7.79 ? 449 ALA A O 1 +ATOM 3486 C CB . ALA A 1 429 ? 81.420 89.454 121.372 1.00 9.90 ? 449 ALA A CB 1 +ATOM 3487 N N . ASN A 1 430 ? 80.911 87.051 119.598 1.00 8.12 ? 450 ASN A N 1 +ATOM 3488 C CA . ASN A 1 430 ? 81.134 86.510 118.270 1.00 8.08 ? 450 ASN A CA 1 +ATOM 3489 C C . ASN A 1 430 ? 80.533 87.388 117.185 1.00 7.82 ? 450 ASN A C 1 +ATOM 3490 O O . ASN A 1 430 ? 79.312 87.621 117.169 1.00 7.50 ? 450 ASN A O 1 +ATOM 3491 C CB . ASN A 1 430 ? 80.540 85.100 118.143 1.00 8.07 ? 450 ASN A CB 1 +ATOM 3492 C CG . ASN A 1 430 ? 80.744 84.522 116.775 1.00 7.65 ? 450 ASN A CG 1 +ATOM 3493 O OD1 . ASN A 1 430 ? 81.830 84.022 116.439 1.00 6.71 ? 450 ASN A OD1 1 +ATOM 3494 N ND2 . ASN A 1 430 ? 79.705 84.605 115.950 1.00 8.41 ? 450 ASN A ND2 1 +ATOM 3495 N N . GLU A 1 431 ? 81.376 87.845 116.263 1.00 7.71 ? 451 GLU A N 1 +ATOM 3496 C CA . GLU A 1 431 ? 80.966 88.687 115.148 1.00 8.78 ? 451 GLU A CA 1 +ATOM 3497 C C . GLU A 1 431 ? 80.077 89.869 115.555 1.00 8.89 ? 451 GLU A C 1 +ATOM 3498 O O . GLU A 1 431 ? 79.007 90.104 114.964 1.00 9.90 ? 451 GLU A O 1 +ATOM 3499 C CB . GLU A 1 431 ? 80.296 87.847 114.063 1.00 8.94 ? 451 GLU A CB 1 +ATOM 3500 C CG . GLU A 1 431 ? 81.178 86.741 113.562 1.00 10.35 ? 451 GLU A CG 1 +ATOM 3501 C CD . GLU A 1 431 ? 80.582 85.990 112.403 1.00 9.95 ? 451 GLU A CD 1 +ATOM 3502 O OE1 . GLU A 1 431 ? 79.333 85.967 112.253 1.00 9.47 ? 451 GLU A OE1 1 +ATOM 3503 O OE2 . GLU A 1 431 ? 81.381 85.430 111.643 1.00 9.98 ? 451 GLU A OE2 1 +ATOM 3504 N N . PRO A 1 432 ? 80.529 90.648 116.544 1.00 8.82 ? 452 PRO A N 1 +ATOM 3505 C CA . PRO A 1 432 ? 79.853 91.914 116.846 1.00 8.94 ? 452 PRO A CA 1 +ATOM 3506 C C . PRO A 1 432 ? 80.151 92.896 115.730 1.00 9.56 ? 452 PRO A C 1 +ATOM 3507 O O . PRO A 1 432 ? 81.103 92.689 114.988 1.00 9.37 ? 452 PRO A O 1 +ATOM 3508 C CB . PRO A 1 432 ? 80.524 92.371 118.145 1.00 8.41 ? 452 PRO A CB 1 +ATOM 3509 C CG . PRO A 1 432 ? 81.904 91.844 118.040 1.00 7.84 ? 452 PRO A CG 1 +ATOM 3510 C CD . PRO A 1 432 ? 81.744 90.474 117.364 1.00 8.77 ? 452 PRO A CD 1 +ATOM 3511 N N . ALA A 1 433 ? 79.347 93.951 115.620 1.00 10.56 ? 453 ALA A N 1 +ATOM 3512 C CA . ALA A 1 433 ? 79.604 95.044 114.674 1.00 11.46 ? 453 ALA A CA 1 +ATOM 3513 C C . ALA A 1 433 ? 80.786 95.899 115.134 1.00 12.18 ? 453 ALA A C 1 +ATOM 3514 O O . ALA A 1 433 ? 80.620 97.076 115.478 1.00 12.35 ? 453 ALA A O 1 +ATOM 3515 C CB . ALA A 1 433 ? 78.331 95.900 114.519 1.00 11.31 ? 453 ALA A CB 1 +ATOM 3516 N N . SER A 1 434 ? 81.981 95.307 115.113 1.00 13.17 ? 454 SER A N 1 +ATOM 3517 C CA . SER A 1 434 ? 83.168 95.900 115.741 1.00 14.27 ? 454 SER A CA 1 +ATOM 3518 C C . SER A 1 434 ? 83.851 96.951 114.865 1.00 14.91 ? 454 SER A C 1 +ATOM 3519 O O . SER A 1 434 ? 84.827 97.583 115.294 1.00 14.87 ? 454 SER A O 1 +ATOM 3520 C CB . SER A 1 434 ? 84.169 94.818 116.175 1.00 14.74 ? 454 SER A CB 1 +ATOM 3521 O OG . SER A 1 434 ? 84.337 93.815 115.186 1.00 15.83 ? 454 SER A OG 1 +ATOM 3522 N N . HIS A 1 435 ? 83.331 97.149 113.651 1.00 15.00 ? 455 HIS A N 1 +ATOM 3523 C CA . HIS A 1 435 ? 83.669 98.333 112.844 1.00 15.68 ? 455 HIS A CA 1 +ATOM 3524 C C . HIS A 1 435 ? 83.157 99.649 113.473 1.00 16.13 ? 455 HIS A C 1 +ATOM 3525 O O . HIS A 1 435 ? 83.652 100.738 113.145 1.00 16.24 ? 455 HIS A O 1 +ATOM 3526 C CB . HIS A 1 435 ? 83.155 98.185 111.406 1.00 15.42 ? 455 HIS A CB 1 +ATOM 3527 C CG . HIS A 1 435 ? 81.677 97.974 111.309 1.00 15.98 ? 455 HIS A CG 1 +ATOM 3528 N ND1 . HIS A 1 435 ? 81.085 96.756 111.560 1.00 14.55 ? 455 HIS A ND1 1 +ATOM 3529 C CD2 . HIS A 1 435 ? 80.673 98.828 110.999 1.00 15.64 ? 455 HIS A CD2 1 +ATOM 3530 C CE1 . HIS A 1 435 ? 79.778 96.866 111.393 1.00 15.59 ? 455 HIS A CE1 1 +ATOM 3531 N NE2 . HIS A 1 435 ? 79.501 98.117 111.068 1.00 16.50 ? 455 HIS A NE2 1 +ATOM 3532 N N . LEU A 1 436 ? 82.168 99.549 114.364 1.00 16.51 ? 456 LEU A N 1 +ATOM 3533 C CA . LEU A 1 436 ? 81.577 100.710 115.034 1.00 17.25 ? 456 LEU A CA 1 +ATOM 3534 C C . LEU A 1 436 ? 82.440 101.216 116.197 1.00 17.70 ? 456 LEU A C 1 +ATOM 3535 O O . LEU A 1 436 ? 82.953 100.416 116.982 1.00 18.54 ? 456 LEU A O 1 +ATOM 3536 C CB . LEU A 1 436 ? 80.190 100.334 115.564 1.00 17.07 ? 456 LEU A CB 1 +ATOM 3537 C CG . LEU A 1 436 ? 79.141 99.937 114.528 1.00 16.34 ? 456 LEU A CG 1 +ATOM 3538 C CD1 . LEU A 1 436 ? 77.841 99.491 115.203 1.00 15.61 ? 456 LEU A CD1 1 +ATOM 3539 C CD2 . LEU A 1 436 ? 78.881 101.116 113.598 1.00 16.59 ? 456 LEU A CD2 1 +ATOM 3540 N N . GLU A 1 437 ? 82.597 102.537 116.320 1.00 18.35 ? 457 GLU A N 1 +ATOM 3541 C CA . GLU A 1 437 ? 83.397 103.098 117.419 1.00 18.70 ? 457 GLU A CA 1 +ATOM 3542 C C . GLU A 1 437 ? 82.763 102.787 118.774 1.00 17.94 ? 457 GLU A C 1 +ATOM 3543 O O . GLU A 1 437 ? 83.469 102.458 119.721 1.00 18.00 ? 457 GLU A O 1 +ATOM 3544 C CB . GLU A 1 437 ? 83.626 104.605 117.247 1.00 19.32 ? 457 GLU A CB 1 +ATOM 3545 C CG . GLU A 1 437 ? 84.678 104.961 116.183 1.00 21.29 ? 457 GLU A CG 1 +ATOM 3546 C CD . GLU A 1 437 ? 86.111 104.753 116.642 1.00 24.15 ? 457 GLU A CD 1 +ATOM 3547 O OE1 . GLU A 1 437 ? 86.335 104.498 117.845 1.00 27.28 ? 457 GLU A OE1 1 +ATOM 3548 O OE2 . GLU A 1 437 ? 87.026 104.853 115.793 1.00 27.00 ? 457 GLU A OE2 1 +ATOM 3549 N N . SER A 1 438 ? 81.434 102.867 118.852 1.00 17.91 ? 458 SER A N 1 +ATOM 3550 C CA . SER A 1 438 ? 80.702 102.475 120.058 1.00 17.25 ? 458 SER A CA 1 +ATOM 3551 C C . SER A 1 438 ? 80.959 101.015 120.419 1.00 16.80 ? 458 SER A C 1 +ATOM 3552 O O . SER A 1 438 ? 81.076 100.688 121.593 1.00 16.48 ? 458 SER A O 1 +ATOM 3553 C CB . SER A 1 438 ? 79.199 102.707 119.900 1.00 17.43 ? 458 SER A CB 1 +ATOM 3554 O OG . SER A 1 438 ? 78.670 102.011 118.786 1.00 17.13 ? 458 SER A OG 1 +ATOM 3555 N N . ALA A 1 439 ? 81.030 100.145 119.411 1.00 15.98 ? 459 ALA A N 1 +ATOM 3556 C CA . ALA A 1 439 ? 81.290 98.723 119.649 1.00 16.28 ? 459 ALA A CA 1 +ATOM 3557 C C . ALA A 1 439 ? 82.708 98.513 120.178 1.00 15.90 ? 459 ALA A C 1 +ATOM 3558 O O . ALA A 1 439 ? 82.928 97.693 121.057 1.00 16.35 ? 459 ALA A O 1 +ATOM 3559 C CB . ALA A 1 439 ? 81.071 97.917 118.374 1.00 15.10 ? 459 ALA A CB 1 +ATOM 3560 N N . GLY A 1 440 ? 83.662 99.259 119.635 1.00 16.60 ? 460 GLY A N 1 +ATOM 3561 C CA . GLY A 1 440 ? 85.052 99.198 120.100 1.00 16.96 ? 460 GLY A CA 1 +ATOM 3562 C C . GLY A 1 440 ? 85.212 99.532 121.578 1.00 17.14 ? 460 GLY A C 1 +ATOM 3563 O O . GLY A 1 440 ? 85.926 98.835 122.303 1.00 17.55 ? 460 GLY A O 1 +ATOM 3564 N N . TYR A 1 441 ? 84.546 100.591 122.033 1.00 17.64 ? 461 TYR A N 1 +ATOM 3565 C CA . TYR A 1 441 ? 84.569 100.967 123.454 1.00 17.72 ? 461 TYR A CA 1 +ATOM 3566 C C . TYR A 1 441 ? 83.887 99.901 124.304 1.00 16.71 ? 461 TYR A C 1 +ATOM 3567 O O . TYR A 1 441 ? 84.421 99.463 125.313 1.00 15.73 ? 461 TYR A O 1 +ATOM 3568 C CB . TYR A 1 441 ? 83.852 102.292 123.677 1.00 19.05 ? 461 TYR A CB 1 +ATOM 3569 C CG . TYR A 1 441 ? 83.757 102.688 125.136 1.00 20.61 ? 461 TYR A CG 1 +ATOM 3570 C CD1 . TYR A 1 441 ? 84.817 103.332 125.773 1.00 23.29 ? 461 TYR A CD1 1 +ATOM 3571 C CD2 . TYR A 1 441 ? 82.616 102.410 125.881 1.00 22.97 ? 461 TYR A CD2 1 +ATOM 3572 C CE1 . TYR A 1 441 ? 84.734 103.701 127.108 1.00 22.69 ? 461 TYR A CE1 1 +ATOM 3573 C CE2 . TYR A 1 441 ? 82.528 102.773 127.220 1.00 22.90 ? 461 TYR A CE2 1 +ATOM 3574 C CZ . TYR A 1 441 ? 83.591 103.419 127.823 1.00 22.73 ? 461 TYR A CZ 1 +ATOM 3575 O OH . TYR A 1 441 ? 83.502 103.786 129.153 1.00 23.94 ? 461 TYR A OH 1 +ATOM 3576 N N . TYR A 1 442 ? 82.678 99.534 123.894 1.00 15.50 ? 462 TYR A N 1 +ATOM 3577 C CA . TYR A 1 442 ? 81.887 98.479 124.536 1.00 15.00 ? 462 TYR A CA 1 +ATOM 3578 C C . TYR A 1 442 ? 82.754 97.245 124.755 1.00 14.35 ? 462 TYR A C 1 +ATOM 3579 O O . TYR A 1 442 ? 82.853 96.742 125.864 1.00 14.76 ? 462 TYR A O 1 +ATOM 3580 C CB . TYR A 1 442 ? 80.681 98.177 123.637 1.00 14.58 ? 462 TYR A CB 1 +ATOM 3581 C CG . TYR A 1 442 ? 79.731 97.055 124.023 1.00 13.91 ? 462 TYR A CG 1 +ATOM 3582 C CD1 . TYR A 1 442 ? 80.066 95.712 123.816 1.00 13.55 ? 462 TYR A CD1 1 +ATOM 3583 C CD2 . TYR A 1 442 ? 78.445 97.343 124.486 1.00 13.94 ? 462 TYR A CD2 1 +ATOM 3584 C CE1 . TYR A 1 442 ? 79.168 94.691 124.127 1.00 13.05 ? 462 TYR A CE1 1 +ATOM 3585 C CE2 . TYR A 1 442 ? 77.551 96.343 124.799 1.00 14.12 ? 462 TYR A CE2 1 +ATOM 3586 C CZ . TYR A 1 442 ? 77.903 95.018 124.619 1.00 13.78 ? 462 TYR A CZ 1 +ATOM 3587 O OH . TYR A 1 442 ? 76.978 94.032 124.916 1.00 14.07 ? 462 TYR A OH 1 +ATOM 3588 N N . LEU A 1 443 ? 83.427 96.791 123.708 1.00 14.06 ? 463 LEU A N 1 +ATOM 3589 C CA . LEU A 1 443 ? 84.265 95.588 123.806 1.00 13.62 ? 463 LEU A CA 1 +ATOM 3590 C C . LEU A 1 443 ? 85.487 95.821 124.695 1.00 13.74 ? 463 LEU A C 1 +ATOM 3591 O O . LEU A 1 443 ? 85.890 94.935 125.449 1.00 13.51 ? 463 LEU A O 1 +ATOM 3592 C CB . LEU A 1 443 ? 84.714 95.131 122.418 1.00 13.14 ? 463 LEU A CB 1 +ATOM 3593 C CG . LEU A 1 443 ? 83.590 94.549 121.543 1.00 13.28 ? 463 LEU A CG 1 +ATOM 3594 C CD1 . LEU A 1 443 ? 84.029 94.535 120.088 1.00 13.21 ? 463 LEU A CD1 1 +ATOM 3595 C CD2 . LEU A 1 443 ? 83.159 93.137 122.018 1.00 12.19 ? 463 LEU A CD2 1 +ATOM 3596 N N . LYS A 1 444 ? 86.084 97.005 124.578 1.00 14.01 ? 464 LYS A N 1 +ATOM 3597 C CA . LYS A 1 444 ? 87.212 97.398 125.437 1.00 14.49 ? 464 LYS A CA 1 +ATOM 3598 C C . LYS A 1 444 ? 86.844 97.203 126.908 1.00 13.88 ? 464 LYS A C 1 +ATOM 3599 O O . LYS A 1 444 ? 87.608 96.609 127.680 1.00 14.60 ? 464 LYS A O 1 +ATOM 3600 C CB . LYS A 1 444 ? 87.627 98.868 125.149 1.00 14.43 ? 464 LYS A CB 1 +ATOM 3601 C CG . LYS A 1 444 ? 88.337 99.613 126.308 1.00 16.46 ? 464 LYS A CG 1 +ATOM 3602 C CD . LYS A 1 444 ? 89.152 100.823 125.796 1.00 17.10 ? 464 LYS A CD 1 +ATOM 3603 C CE . LYS A 1 444 ? 89.266 101.976 126.782 1.00 20.93 ? 464 LYS A CE 1 +ATOM 3604 N NZ . LYS A 1 444 ? 88.438 103.169 126.394 1.00 20.49 ? 464 LYS A NZ 1 +ATOM 3605 N N . MET A 1 445 ? 85.670 97.694 127.295 1.00 13.52 ? 465 MET A N 1 +ATOM 3606 C CA . MET A 1 445 ? 85.246 97.630 128.696 1.00 13.53 ? 465 MET A CA 1 +ATOM 3607 C C . MET A 1 445 ? 84.825 96.219 129.117 1.00 13.05 ? 465 MET A C 1 +ATOM 3608 O O . MET A 1 445 ? 85.141 95.798 130.228 1.00 12.70 ? 465 MET A O 1 +ATOM 3609 C CB . MET A 1 445 ? 84.141 98.653 128.983 1.00 13.51 ? 465 MET A CB 1 +ATOM 3610 C CG . MET A 1 445 ? 84.589 100.100 128.792 1.00 15.34 ? 465 MET A CG 1 +ATOM 3611 S SD . MET A 1 445 ? 86.161 100.492 129.620 1.00 19.28 ? 465 MET A SD 1 +ATOM 3612 C CE . MET A 1 445 ? 85.668 100.408 131.335 1.00 20.78 ? 465 MET A CE 1 +ATOM 3613 N N . VAL A 1 446 ? 84.125 95.482 128.255 1.00 12.81 ? 466 VAL A N 1 +ATOM 3614 C CA . VAL A 1 446 ? 83.777 94.088 128.589 1.00 12.46 ? 466 VAL A CA 1 +ATOM 3615 C C . VAL A 1 446 ? 85.039 93.258 128.812 1.00 12.23 ? 466 VAL A C 1 +ATOM 3616 O O . VAL A 1 446 ? 85.119 92.467 129.767 1.00 11.94 ? 466 VAL A O 1 +ATOM 3617 C CB . VAL A 1 446 ? 82.885 93.414 127.510 1.00 12.45 ? 466 VAL A CB 1 +ATOM 3618 C CG1 . VAL A 1 446 ? 82.637 91.942 127.862 1.00 13.05 ? 466 VAL A CG1 1 +ATOM 3619 C CG2 . VAL A 1 446 ? 81.568 94.162 127.367 1.00 13.76 ? 466 VAL A CG2 1 +ATOM 3620 N N . ILE A 1 447 ? 86.018 93.439 127.928 1.00 11.93 ? 467 ILE A N 1 +ATOM 3621 C CA . ILE A 1 447 ? 87.281 92.726 128.010 1.00 11.59 ? 467 ILE A CA 1 +ATOM 3622 C C . ILE A 1 447 ? 88.063 93.134 129.250 1.00 11.66 ? 467 ILE A C 1 +ATOM 3623 O O . ILE A 1 447 ? 88.515 92.269 130.002 1.00 11.56 ? 467 ILE A O 1 +ATOM 3624 C CB . ILE A 1 447 ? 88.116 92.917 126.737 1.00 11.58 ? 467 ILE A CB 1 +ATOM 3625 C CG1 . ILE A 1 447 ? 87.489 92.085 125.601 1.00 11.69 ? 467 ILE A CG1 1 +ATOM 3626 C CG2 . ILE A 1 447 ? 89.581 92.498 126.969 1.00 12.23 ? 467 ILE A CG2 1 +ATOM 3627 C CD1 . ILE A 1 447 ? 88.125 92.304 124.243 1.00 10.32 ? 467 ILE A CD1 1 +ATOM 3628 N N . ALA A 1 448 ? 88.196 94.439 129.484 1.00 11.64 ? 468 ALA A N 1 +ATOM 3629 C CA . ALA A 1 448 ? 88.859 94.909 130.709 1.00 11.40 ? 468 ALA A CA 1 +ATOM 3630 C C . ALA A 1 448 ? 88.165 94.352 131.971 1.00 11.35 ? 468 ALA A C 1 +ATOM 3631 O O . ALA A 1 448 ? 88.829 93.876 132.902 1.00 11.77 ? 468 ALA A O 1 +ATOM 3632 C CB . ALA A 1 448 ? 88.897 96.416 130.738 1.00 11.36 ? 468 ALA A CB 1 +ATOM 3633 N N . HIS A 1 449 ? 86.832 94.367 131.993 1.00 11.76 ? 469 HIS A N 1 +ATOM 3634 C CA . HIS A 1 449 ? 86.088 93.811 133.132 1.00 12.11 ? 469 HIS A CA 1 +ATOM 3635 C C . HIS A 1 449 ? 86.470 92.369 133.368 1.00 12.75 ? 469 HIS A C 1 +ATOM 3636 O O . HIS A 1 449 ? 86.731 91.976 134.493 1.00 11.68 ? 469 HIS A O 1 +ATOM 3637 C CB . HIS A 1 449 ? 84.578 93.886 132.910 1.00 12.48 ? 469 HIS A CB 1 +ATOM 3638 C CG . HIS A 1 449 ? 83.771 93.570 134.134 1.00 14.24 ? 469 HIS A CG 1 +ATOM 3639 N ND1 . HIS A 1 449 ? 83.857 94.315 135.290 1.00 16.25 ? 469 HIS A ND1 1 +ATOM 3640 C CD2 . HIS A 1 449 ? 82.857 92.602 134.379 1.00 15.97 ? 469 HIS A CD2 1 +ATOM 3641 C CE1 . HIS A 1 449 ? 83.032 93.820 136.195 1.00 16.98 ? 469 HIS A CE1 1 +ATOM 3642 N NE2 . HIS A 1 449 ? 82.409 92.783 135.667 1.00 16.94 ? 469 HIS A NE2 1 +ATOM 3643 N N . THR A 1 450 ? 86.507 91.596 132.283 1.00 12.49 ? 470 THR A N 1 +ATOM 3644 C CA . THR A 1 450 ? 86.819 90.165 132.350 1.00 12.64 ? 470 THR A CA 1 +ATOM 3645 C C . THR A 1 450 ? 88.233 89.962 132.903 1.00 12.56 ? 470 THR A C 1 +ATOM 3646 O O . THR A 1 450 ? 88.429 89.214 133.853 1.00 12.48 ? 470 THR A O 1 +ATOM 3647 C CB . THR A 1 450 ? 86.675 89.486 130.972 1.00 12.48 ? 470 THR A CB 1 +ATOM 3648 O OG1 . THR A 1 450 ? 85.366 89.755 130.439 1.00 14.20 ? 470 THR A OG1 1 +ATOM 3649 C CG2 . THR A 1 450 ? 86.871 87.988 131.090 1.00 11.87 ? 470 THR A CG2 1 +ATOM 3650 N N . LYS A 1 451 ? 89.207 90.658 132.327 1.00 13.11 ? 471 LYS A N 1 +ATOM 3651 C CA . LYS A 1 451 ? 90.589 90.580 132.817 1.00 13.75 ? 471 LYS A CA 1 +ATOM 3652 C C . LYS A 1 451 ? 90.692 90.869 134.319 1.00 13.66 ? 471 LYS A C 1 +ATOM 3653 O O . LYS A 1 451 ? 91.470 90.210 135.044 1.00 14.16 ? 471 LYS A O 1 +ATOM 3654 C CB . LYS A 1 451 ? 91.484 91.540 132.030 1.00 13.51 ? 471 LYS A CB 1 +ATOM 3655 C CG . LYS A 1 451 ? 91.709 91.072 130.608 1.00 15.19 ? 471 LYS A CG 1 +ATOM 3656 C CD . LYS A 1 451 ? 92.613 91.988 129.811 1.00 15.41 ? 471 LYS A CD 1 +ATOM 3657 C CE . LYS A 1 451 ? 93.257 91.227 128.657 1.00 17.57 ? 471 LYS A CE 1 +ATOM 3658 N NZ . LYS A 1 451 ? 94.096 92.100 127.786 1.00 19.43 ? 471 LYS A NZ 1 +ATOM 3659 N N . SER A 1 452 ? 89.908 91.829 134.798 1.00 13.70 ? 472 SER A N 1 +ATOM 3660 C CA . SER A 1 452 ? 89.957 92.189 136.226 1.00 14.27 ? 472 SER A CA 1 +ATOM 3661 C C . SER A 1 452 ? 89.355 91.084 137.106 1.00 14.30 ? 472 SER A C 1 +ATOM 3662 O O . SER A 1 452 ? 89.796 90.870 138.238 1.00 15.36 ? 472 SER A O 1 +ATOM 3663 C CB . SER A 1 452 ? 89.289 93.544 136.498 1.00 14.39 ? 472 SER A CB 1 +ATOM 3664 O OG . SER A 1 452 ? 87.887 93.509 136.341 1.00 15.56 ? 472 SER A OG 1 +ATOM 3665 N N . LEU A 1 453 ? 88.356 90.383 136.581 1.00 14.16 ? 473 LEU A N 1 +ATOM 3666 C CA . LEU A 1 453 ? 87.766 89.237 137.283 1.00 13.94 ? 473 LEU A CA 1 +ATOM 3667 C C . LEU A 1 453 ? 88.704 88.061 137.383 1.00 13.80 ? 473 LEU A C 1 +ATOM 3668 O O . LEU A 1 453 ? 88.790 87.429 138.435 1.00 14.75 ? 473 LEU A O 1 +ATOM 3669 C CB . LEU A 1 453 ? 86.464 88.797 136.602 1.00 13.62 ? 473 LEU A CB 1 +ATOM 3670 C CG . LEU A 1 453 ? 85.316 89.785 136.782 1.00 14.30 ? 473 LEU A CG 1 +ATOM 3671 C CD1 . LEU A 1 453 ? 84.199 89.471 135.789 1.00 14.27 ? 473 LEU A CD1 1 +ATOM 3672 C CD2 . LEU A 1 453 ? 84.805 89.756 138.215 1.00 15.14 ? 473 LEU A CD2 1 +ATOM 3673 N N . ASP A 1 454 ? 89.415 87.756 136.297 1.00 13.43 ? 474 ASP A N 1 +ATOM 3674 C CA . ASP A 1 454 ? 90.233 86.551 136.244 1.00 13.34 ? 474 ASP A CA 1 +ATOM 3675 C C . ASP A 1 454 ? 91.615 86.915 135.744 1.00 13.19 ? 474 ASP A C 1 +ATOM 3676 O O . ASP A 1 454 ? 91.798 87.156 134.561 1.00 13.62 ? 474 ASP A O 1 +ATOM 3677 C CB . ASP A 1 454 ? 89.597 85.486 135.330 1.00 13.23 ? 474 ASP A CB 1 +ATOM 3678 C CG . ASP A 1 454 ? 90.420 84.225 135.239 1.00 13.93 ? 474 ASP A CG 1 +ATOM 3679 O OD1 . ASP A 1 454 ? 91.371 84.072 136.042 1.00 12.50 ? 474 ASP A OD1 1 +ATOM 3680 O OD2 . ASP A 1 454 ? 90.130 83.376 134.363 1.00 11.87 ? 474 ASP A OD2 1 +ATOM 3681 N N . PRO A 1 455 ? 92.599 86.957 136.649 1.00 13.58 ? 475 PRO A N 1 +ATOM 3682 C CA . PRO A 1 455 ? 93.973 87.230 136.224 1.00 13.38 ? 475 PRO A CA 1 +ATOM 3683 C C . PRO A 1 455 ? 94.673 86.103 135.460 1.00 12.94 ? 475 PRO A C 1 +ATOM 3684 O O . PRO A 1 455 ? 95.759 86.322 134.924 1.00 13.03 ? 475 PRO A O 1 +ATOM 3685 C CB . PRO A 1 455 ? 94.700 87.461 137.551 1.00 13.34 ? 475 PRO A CB 1 +ATOM 3686 C CG . PRO A 1 455 ? 93.934 86.671 138.536 1.00 13.85 ? 475 PRO A CG 1 +ATOM 3687 C CD . PRO A 1 455 ? 92.501 86.775 138.109 1.00 13.21 ? 475 PRO A CD 1 +ATOM 3688 N N . SER A 1 456 ? 94.076 84.909 135.397 1.00 12.20 ? 476 SER A N 1 +ATOM 3689 C CA . SER A 1 456 ? 94.812 83.718 135.007 1.00 11.84 ? 476 SER A CA 1 +ATOM 3690 C C . SER A 1 456 ? 94.698 83.286 133.534 1.00 11.84 ? 476 SER A C 1 +ATOM 3691 O O . SER A 1 456 ? 95.423 82.385 133.107 1.00 11.22 ? 476 SER A O 1 +ATOM 3692 C CB . SER A 1 456 ? 94.378 82.558 135.897 1.00 12.42 ? 476 SER A CB 1 +ATOM 3693 O OG . SER A 1 456 ? 93.058 82.148 135.573 1.00 11.82 ? 476 SER A OG 1 +ATOM 3694 N N . ARG A 1 457 ? 93.784 83.898 132.775 1.00 11.46 ? 477 ARG A N 1 +ATOM 3695 C CA . ARG A 1 457 ? 93.536 83.532 131.378 1.00 11.43 ? 477 ARG A CA 1 +ATOM 3696 C C . ARG A 1 457 ? 93.474 84.743 130.444 1.00 11.13 ? 477 ARG A C 1 +ATOM 3697 O O . ARG A 1 457 ? 93.040 85.831 130.863 1.00 11.64 ? 477 ARG A O 1 +ATOM 3698 C CB . ARG A 1 457 ? 92.192 82.813 131.242 1.00 11.37 ? 477 ARG A CB 1 +ATOM 3699 C CG . ARG A 1 457 ? 91.999 81.649 132.143 1.00 12.27 ? 477 ARG A CG 1 +ATOM 3700 C CD . ARG A 1 457 ? 90.597 81.091 131.966 1.00 13.05 ? 477 ARG A CD 1 +ATOM 3701 N NE . ARG A 1 457 ? 90.486 79.769 132.566 1.00 14.01 ? 477 ARG A NE 1 +ATOM 3702 C CZ . ARG A 1 457 ? 90.299 79.545 133.861 1.00 13.85 ? 477 ARG A CZ 1 +ATOM 3703 N NH1 . ARG A 1 457 ? 90.190 80.565 134.706 1.00 13.78 ? 477 ARG A NH1 1 +ATOM 3704 N NH2 . ARG A 1 457 ? 90.213 78.294 134.307 1.00 14.47 ? 477 ARG A NH2 1 +ATOM 3705 N N . PRO A 1 458 ? 93.843 84.540 129.158 1.00 10.65 ? 478 PRO A N 1 +ATOM 3706 C CA . PRO A 1 458 ? 93.659 85.548 128.127 1.00 10.58 ? 478 PRO A CA 1 +ATOM 3707 C C . PRO A 1 458 ? 92.195 85.698 127.739 1.00 11.03 ? 478 PRO A C 1 +ATOM 3708 O O . PRO A 1 458 ? 91.384 84.781 127.985 1.00 9.92 ? 478 PRO A O 1 +ATOM 3709 C CB . PRO A 1 458 ? 94.465 85.009 126.953 1.00 10.83 ? 478 PRO A CB 1 +ATOM 3710 C CG . PRO A 1 458 ? 94.486 83.542 127.147 1.00 10.42 ? 478 PRO A CG 1 +ATOM 3711 C CD . PRO A 1 458 ? 94.461 83.313 128.619 1.00 10.77 ? 478 PRO A CD 1 +ATOM 3712 N N . VAL A 1 459 ? 91.889 86.838 127.127 1.00 10.41 ? 479 VAL A N 1 +ATOM 3713 C CA . VAL A 1 459 ? 90.531 87.188 126.703 1.00 10.50 ? 479 VAL A CA 1 +ATOM 3714 C C . VAL A 1 459 ? 90.552 87.576 125.226 1.00 10.30 ? 479 VAL A C 1 +ATOM 3715 O O . VAL A 1 459 ? 91.486 88.244 124.772 1.00 10.40 ? 479 VAL A O 1 +ATOM 3716 C CB . VAL A 1 459 ? 89.987 88.382 127.513 1.00 10.30 ? 479 VAL A CB 1 +ATOM 3717 C CG1 . VAL A 1 459 ? 88.492 88.597 127.249 1.00 10.83 ? 479 VAL A CG1 1 +ATOM 3718 C CG2 . VAL A 1 459 ? 90.231 88.188 128.988 1.00 11.11 ? 479 VAL A CG2 1 +ATOM 3719 N N . THR A 1 460 ? 89.510 87.169 124.492 1.00 9.82 ? 480 THR A N 1 +ATOM 3720 C CA . THR A 1 460 ? 89.357 87.500 123.081 1.00 9.79 ? 480 THR A CA 1 +ATOM 3721 C C . THR A 1 460 ? 87.896 87.825 122.783 1.00 9.62 ? 480 THR A C 1 +ATOM 3722 O O . THR A 1 460 ? 87.035 87.793 123.672 1.00 8.96 ? 480 THR A O 1 +ATOM 3723 C CB . THR A 1 460 ? 89.814 86.333 122.189 1.00 10.11 ? 480 THR A CB 1 +ATOM 3724 O OG1 . THR A 1 460 ? 89.945 86.772 120.821 1.00 10.05 ? 480 THR A OG1 1 +ATOM 3725 C CG2 . THR A 1 460 ? 88.835 85.136 122.298 1.00 9.97 ? 480 THR A CG2 1 +ATOM 3726 N N . PHE A 1 461 ? 87.648 88.208 121.538 1.00 10.09 ? 481 PHE A N 1 +ATOM 3727 C CA . PHE A 1 461 ? 86.320 88.075 120.936 1.00 10.58 ? 481 PHE A CA 1 +ATOM 3728 C C . PHE A 1 461 ? 86.586 87.593 119.521 1.00 10.70 ? 481 PHE A C 1 +ATOM 3729 O O . PHE A 1 461 ? 87.714 87.741 119.002 1.00 11.38 ? 481 PHE A O 1 +ATOM 3730 C CB . PHE A 1 461 ? 85.493 89.380 120.995 1.00 11.11 ? 481 PHE A CB 1 +ATOM 3731 C CG . PHE A 1 461 ? 85.837 90.371 119.921 1.00 11.33 ? 481 PHE A CG 1 +ATOM 3732 C CD1 . PHE A 1 461 ? 86.862 91.282 120.109 1.00 11.51 ? 481 PHE A CD1 1 +ATOM 3733 C CD2 . PHE A 1 461 ? 85.134 90.404 118.728 1.00 11.72 ? 481 PHE A CD2 1 +ATOM 3734 C CE1 . PHE A 1 461 ? 87.180 92.202 119.124 1.00 12.33 ? 481 PHE A CE1 1 +ATOM 3735 C CE2 . PHE A 1 461 ? 85.458 91.319 117.733 1.00 11.96 ? 481 PHE A CE2 1 +ATOM 3736 C CZ . PHE A 1 461 ? 86.480 92.213 117.924 1.00 11.43 ? 481 PHE A CZ 1 +ATOM 3737 N N . VAL A 1 462 ? 85.571 86.994 118.909 1.00 10.83 ? 482 VAL A N 1 +ATOM 3738 C CA . VAL A 1 462 ? 85.723 86.398 117.593 1.00 10.63 ? 482 VAL A CA 1 +ATOM 3739 C C . VAL A 1 462 ? 85.163 87.354 116.543 1.00 10.60 ? 482 VAL A C 1 +ATOM 3740 O O . VAL A 1 462 ? 84.017 87.799 116.651 1.00 11.31 ? 482 VAL A O 1 +ATOM 3741 C CB . VAL A 1 462 ? 85.016 85.035 117.537 1.00 10.46 ? 482 VAL A CB 1 +ATOM 3742 C CG1 . VAL A 1 462 ? 85.085 84.464 116.137 1.00 11.29 ? 482 VAL A CG1 1 +ATOM 3743 C CG2 . VAL A 1 462 ? 85.630 84.073 118.573 1.00 11.15 ? 482 VAL A CG2 1 +ATOM 3744 N N . SER A 1 463 ? 85.964 87.657 115.519 1.00 10.42 ? 483 SER A N 1 +ATOM 3745 C CA . SER A 1 463 ? 85.642 88.739 114.583 1.00 10.76 ? 483 SER A CA 1 +ATOM 3746 C C . SER A 1 463 ? 85.490 88.293 113.141 1.00 11.16 ? 483 SER A C 1 +ATOM 3747 O O . SER A 1 463 ? 86.205 87.397 112.694 1.00 10.80 ? 483 SER A O 1 +ATOM 3748 C CB . SER A 1 463 ? 86.731 89.815 114.634 1.00 11.40 ? 483 SER A CB 1 +ATOM 3749 O OG . SER A 1 463 ? 86.388 90.919 113.811 1.00 10.49 ? 483 SER A OG 1 +ATOM 3750 N N . ASN A 1 464 ? 84.552 88.921 112.424 1.00 11.20 ? 484 ASN A N 1 +ATOM 3751 C CA . ASN A 1 464 ? 84.492 88.824 110.965 1.00 11.75 ? 484 ASN A CA 1 +ATOM 3752 C C . ASN A 1 464 ? 84.695 90.211 110.332 1.00 12.18 ? 484 ASN A C 1 +ATOM 3753 O O . ASN A 1 464 ? 84.357 90.438 109.161 1.00 12.98 ? 484 ASN A O 1 +ATOM 3754 C CB . ASN A 1 464 ? 83.177 88.180 110.488 1.00 11.48 ? 484 ASN A CB 1 +ATOM 3755 C CG . ASN A 1 464 ? 81.957 89.010 110.813 1.00 11.96 ? 484 ASN A CG 1 +ATOM 3756 O OD1 . ASN A 1 464 ? 81.999 89.935 111.644 1.00 12.27 ? 484 ASN A OD1 1 +ATOM 3757 N ND2 . ASN A 1 464 ? 80.844 88.688 110.159 1.00 12.63 ? 484 ASN A ND2 1 +ATOM 3758 N N . SER A 1 465 ? 85.248 91.134 111.116 1.00 12.96 ? 485 SER A N 1 +ATOM 3759 C CA . SER A 1 465 ? 85.473 92.502 110.659 1.00 13.28 ? 485 SER A CA 1 +ATOM 3760 C C . SER A 1 465 ? 86.653 92.548 109.705 1.00 13.91 ? 485 SER A C 1 +ATOM 3761 O O . SER A 1 465 ? 87.471 91.627 109.666 1.00 13.24 ? 485 SER A O 1 +ATOM 3762 C CB . SER A 1 465 ? 85.754 93.441 111.844 1.00 13.30 ? 485 SER A CB 1 +ATOM 3763 O OG . SER A 1 465 ? 84.642 93.506 112.698 1.00 14.83 ? 485 SER A OG 1 +ATOM 3764 N N . ASN A 1 466 ? 86.730 93.634 108.935 1.00 14.53 ? 486 ASN A N 1 +ATOM 3765 C CA . ASN A 1 466 ? 87.897 93.900 108.094 1.00 15.45 ? 486 ASN A CA 1 +ATOM 3766 C C . ASN A 1 466 ? 89.013 94.358 109.022 1.00 15.26 ? 486 ASN A C 1 +ATOM 3767 O O . ASN A 1 466 ? 88.756 95.120 109.953 1.00 15.34 ? 486 ASN A O 1 +ATOM 3768 C CB . ASN A 1 466 ? 87.575 94.971 107.044 1.00 15.63 ? 486 ASN A CB 1 +ATOM 3769 C CG . ASN A 1 466 ? 88.787 95.356 106.201 1.00 17.40 ? 486 ASN A CG 1 +ATOM 3770 O OD1 . ASN A 1 466 ? 89.659 96.089 106.654 1.00 20.20 ? 486 ASN A OD1 1 +ATOM 3771 N ND2 . ASN A 1 466 ? 88.837 94.863 104.968 1.00 20.81 ? 486 ASN A ND2 1 +ATOM 3772 N N . TYR A 1 467 ? 90.240 93.899 108.778 1.00 15.40 ? 487 TYR A N 1 +ATOM 3773 C CA . TYR A 1 467 ? 91.379 94.200 109.668 1.00 15.58 ? 487 TYR A CA 1 +ATOM 3774 C C . TYR A 1 467 ? 91.585 95.704 109.921 1.00 15.99 ? 487 TYR A C 1 +ATOM 3775 O O . TYR A 1 467 ? 92.001 96.104 111.007 1.00 16.29 ? 487 TYR A O 1 +ATOM 3776 C CB . TYR A 1 467 ? 92.674 93.584 109.116 1.00 15.77 ? 487 TYR A CB 1 +ATOM 3777 C CG . TYR A 1 467 ? 93.334 94.427 108.047 1.00 15.33 ? 487 TYR A CG 1 +ATOM 3778 C CD1 . TYR A 1 467 ? 92.863 94.420 106.738 1.00 15.06 ? 487 TYR A CD1 1 +ATOM 3779 C CD2 . TYR A 1 467 ? 94.418 95.251 108.354 1.00 15.73 ? 487 TYR A CD2 1 +ATOM 3780 C CE1 . TYR A 1 467 ? 93.464 95.206 105.753 1.00 16.14 ? 487 TYR A CE1 1 +ATOM 3781 C CE2 . TYR A 1 467 ? 95.017 96.044 107.382 1.00 15.02 ? 487 TYR A CE2 1 +ATOM 3782 C CZ . TYR A 1 467 ? 94.531 96.024 106.088 1.00 15.77 ? 487 TYR A CZ 1 +ATOM 3783 O OH . TYR A 1 467 ? 95.126 96.806 105.122 1.00 16.91 ? 487 TYR A OH 1 +ATOM 3784 N N . ALA A 1 468 ? 91.307 96.537 108.924 1.00 15.96 ? 488 ALA A N 1 +ATOM 3785 C CA . ALA A 1 468 ? 91.510 97.979 109.071 1.00 16.40 ? 488 ALA A CA 1 +ATOM 3786 C C . ALA A 1 468 ? 90.404 98.651 109.873 1.00 16.41 ? 488 ALA A C 1 +ATOM 3787 O O . ALA A 1 468 ? 90.628 99.714 110.469 1.00 17.61 ? 488 ALA A O 1 +ATOM 3788 C CB . ALA A 1 468 ? 91.623 98.635 107.703 1.00 16.66 ? 488 ALA A CB 1 +ATOM 3789 N N . ALA A 1 469 ? 89.218 98.043 109.886 1.00 16.01 ? 489 ALA A N 1 +ATOM 3790 C CA . ALA A 1 469 ? 88.021 98.672 110.442 1.00 15.52 ? 489 ALA A CA 1 +ATOM 3791 C C . ALA A 1 469 ? 87.733 98.257 111.879 1.00 15.16 ? 489 ALA A C 1 +ATOM 3792 O O . ALA A 1 469 ? 86.955 98.919 112.560 1.00 14.81 ? 489 ALA A O 1 +ATOM 3793 C CB . ALA A 1 469 ? 86.795 98.351 109.564 1.00 15.62 ? 489 ALA A CB 1 +ATOM 3794 N N . ASP A 1 470 ? 88.348 97.161 112.322 1.00 14.76 ? 490 ASP A N 1 +ATOM 3795 C CA . ASP A 1 470 ? 88.003 96.522 113.593 1.00 14.81 ? 490 ASP A CA 1 +ATOM 3796 C C . ASP A 1 470 ? 88.464 97.367 114.778 1.00 15.02 ? 490 ASP A C 1 +ATOM 3797 O O . ASP A 1 470 ? 89.663 97.464 115.059 1.00 15.50 ? 490 ASP A O 1 +ATOM 3798 C CB . ASP A 1 470 ? 88.589 95.094 113.659 1.00 14.54 ? 490 ASP A CB 1 +ATOM 3799 C CG . ASP A 1 470 ? 87.999 94.262 114.790 1.00 15.46 ? 490 ASP A CG 1 +ATOM 3800 O OD1 . ASP A 1 470 ? 87.525 94.860 115.783 1.00 15.72 ? 490 ASP A OD1 1 +ATOM 3801 O OD2 . ASP A 1 470 ? 88.028 93.000 114.701 1.00 14.08 ? 490 ASP A OD2 1 +ATOM 3802 N N . LYS A 1 471 ? 87.500 97.968 115.468 1.00 15.16 ? 491 LYS A N 1 +ATOM 3803 C CA . LYS A 1 471 ? 87.796 98.870 116.592 1.00 15.58 ? 491 LYS A CA 1 +ATOM 3804 C C . LYS A 1 471 ? 87.975 98.087 117.894 1.00 15.25 ? 491 LYS A C 1 +ATOM 3805 O O . LYS A 1 471 ? 88.452 98.639 118.889 1.00 15.57 ? 491 LYS A O 1 +ATOM 3806 C CB . LYS A 1 471 ? 86.688 99.904 116.769 1.00 15.87 ? 491 LYS A CB 1 +ATOM 3807 C CG . LYS A 1 471 ? 86.299 100.654 115.501 1.00 17.13 ? 491 LYS A CG 1 +ATOM 3808 C CD . LYS A 1 471 ? 87.373 101.602 115.010 1.00 19.50 ? 491 LYS A CD 1 +ATOM 3809 C CE . LYS A 1 471 ? 86.895 102.369 113.766 1.00 20.70 ? 491 LYS A CE 1 +ATOM 3810 N NZ . LYS A 1 471 ? 86.542 101.470 112.604 1.00 21.05 ? 491 LYS A NZ 1 +ATOM 3811 N N . GLY A 1 472 ? 87.559 96.820 117.898 1.00 14.42 ? 492 GLY A N 1 +ATOM 3812 C CA . GLY A 1 472 ? 87.744 95.933 119.051 1.00 14.09 ? 492 GLY A CA 1 +ATOM 3813 C C . GLY A 1 472 ? 89.093 95.224 119.088 1.00 13.37 ? 492 GLY A C 1 +ATOM 3814 O O . GLY A 1 472 ? 89.568 94.835 120.157 1.00 12.74 ? 492 GLY A O 1 +ATOM 3815 N N . ALA A 1 473 ? 89.722 95.065 117.925 1.00 13.57 ? 493 ALA A N 1 +ATOM 3816 C CA . ALA A 1 473 ? 90.912 94.225 117.796 1.00 13.54 ? 493 ALA A CA 1 +ATOM 3817 C C . ALA A 1 473 ? 92.087 94.618 118.691 1.00 13.29 ? 493 ALA A C 1 +ATOM 3818 O O . ALA A 1 473 ? 92.860 93.754 119.122 1.00 13.18 ? 493 ALA A O 1 +ATOM 3819 C CB . ALA A 1 473 ? 91.361 94.163 116.336 1.00 13.76 ? 493 ALA A CB 1 +ATOM 3820 N N . PRO A 1 474 ? 92.252 95.918 118.966 1.00 12.76 ? 494 PRO A N 1 +ATOM 3821 C CA . PRO A 1 474 ? 93.368 96.252 119.854 1.00 12.72 ? 494 PRO A CA 1 +ATOM 3822 C C . PRO A 1 474 ? 93.329 95.605 121.243 1.00 12.24 ? 494 PRO A C 1 +ATOM 3823 O O . PRO A 1 474 ? 94.378 95.434 121.869 1.00 12.12 ? 494 PRO A O 1 +ATOM 3824 C CB . PRO A 1 474 ? 93.239 97.769 119.998 1.00 12.56 ? 494 PRO A CB 1 +ATOM 3825 C CG . PRO A 1 474 ? 92.541 98.204 118.768 1.00 12.41 ? 494 PRO A CG 1 +ATOM 3826 C CD . PRO A 1 474 ? 91.557 97.126 118.485 1.00 13.08 ? 494 PRO A CD 1 +ATOM 3827 N N . TYR A 1 475 ? 92.134 95.282 121.737 1.00 12.33 ? 495 TYR A N 1 +ATOM 3828 C CA . TYR A 1 475 ? 91.963 94.860 123.132 1.00 12.84 ? 495 TYR A CA 1 +ATOM 3829 C C . TYR A 1 475 ? 92.054 93.346 123.379 1.00 12.75 ? 495 TYR A C 1 +ATOM 3830 O O . TYR A 1 475 ? 92.052 92.909 124.535 1.00 12.69 ? 495 TYR A O 1 +ATOM 3831 C CB . TYR A 1 475 ? 90.627 95.412 123.651 1.00 13.38 ? 495 TYR A CB 1 +ATOM 3832 C CG . TYR A 1 475 ? 90.522 96.898 123.375 1.00 13.73 ? 495 TYR A CG 1 +ATOM 3833 C CD1 . TYR A 1 475 ? 91.332 97.806 124.054 1.00 15.55 ? 495 TYR A CD1 1 +ATOM 3834 C CD2 . TYR A 1 475 ? 89.675 97.384 122.388 1.00 15.62 ? 495 TYR A CD2 1 +ATOM 3835 C CE1 . TYR A 1 475 ? 91.272 99.167 123.776 1.00 16.19 ? 495 TYR A CE1 1 +ATOM 3836 C CE2 . TYR A 1 475 ? 89.596 98.742 122.109 1.00 15.73 ? 495 TYR A CE2 1 +ATOM 3837 C CZ . TYR A 1 475 ? 90.393 99.628 122.805 1.00 16.29 ? 495 TYR A CZ 1 +ATOM 3838 O OH . TYR A 1 475 ? 90.314 100.970 122.514 1.00 16.41 ? 495 TYR A OH 1 +ATOM 3839 N N . VAL A 1 476 ? 92.128 92.554 122.304 1.00 12.38 ? 496 VAL A N 1 +ATOM 3840 C CA . VAL A 1 476 ? 92.185 91.095 122.420 1.00 12.25 ? 496 VAL A CA 1 +ATOM 3841 C C . VAL A 1 476 ? 93.626 90.600 122.585 1.00 12.15 ? 496 VAL A C 1 +ATOM 3842 O O . VAL A 1 476 ? 94.543 91.142 121.980 1.00 12.31 ? 496 VAL A O 1 +ATOM 3843 C CB . VAL A 1 476 ? 91.534 90.394 121.197 1.00 11.75 ? 496 VAL A CB 1 +ATOM 3844 C CG1 . VAL A 1 476 ? 90.079 90.813 121.058 1.00 12.53 ? 496 VAL A CG1 1 +ATOM 3845 C CG2 . VAL A 1 476 ? 92.293 90.685 119.912 1.00 12.24 ? 496 VAL A CG2 1 +ATOM 3846 N N . ASP A 1 477 ? 93.805 89.581 123.421 1.00 12.14 ? 497 ASP A N 1 +ATOM 3847 C CA . ASP A 1 477 ? 95.109 88.943 123.645 1.00 11.99 ? 497 ASP A CA 1 +ATOM 3848 C C . ASP A 1 477 ? 95.486 88.035 122.498 1.00 11.78 ? 497 ASP A C 1 +ATOM 3849 O O . ASP A 1 477 ? 96.679 87.867 122.167 1.00 11.26 ? 497 ASP A O 1 +ATOM 3850 C CB . ASP A 1 477 ? 95.081 88.136 124.953 1.00 12.42 ? 497 ASP A CB 1 +ATOM 3851 C CG . ASP A 1 477 ? 94.831 89.012 126.159 1.00 13.65 ? 497 ASP A CG 1 +ATOM 3852 O OD1 . ASP A 1 477 ? 95.231 90.200 126.130 1.00 16.75 ? 497 ASP A OD1 1 +ATOM 3853 O OD2 . ASP A 1 477 ? 94.223 88.527 127.129 1.00 13.44 ? 497 ASP A OD2 1 +ATOM 3854 N N . VAL A 1 478 ? 94.457 87.424 121.913 1.00 10.88 ? 498 VAL A N 1 +ATOM 3855 C CA . VAL A 1 478 ? 94.589 86.570 120.743 1.00 10.19 ? 498 VAL A CA 1 +ATOM 3856 C C . VAL A 1 478 ? 93.528 87.037 119.750 1.00 9.85 ? 498 VAL A C 1 +ATOM 3857 O O . VAL A 1 478 ? 92.388 87.283 120.130 1.00 8.86 ? 498 VAL A O 1 +ATOM 3858 C CB . VAL A 1 478 ? 94.390 85.060 121.088 1.00 10.31 ? 498 VAL A CB 1 +ATOM 3859 C CG1 . VAL A 1 478 ? 94.428 84.225 119.844 1.00 9.98 ? 498 VAL A CG1 1 +ATOM 3860 C CG2 . VAL A 1 478 ? 95.444 84.570 122.074 1.00 10.27 ? 498 VAL A CG2 1 +ATOM 3861 N N . ILE A 1 479 ? 93.931 87.199 118.494 1.00 8.83 ? 499 ILE A N 1 +ATOM 3862 C CA . ILE A 1 479 ? 93.017 87.589 117.430 1.00 9.71 ? 499 ILE A CA 1 +ATOM 3863 C C . ILE A 1 479 ? 92.370 86.326 116.859 1.00 9.45 ? 499 ILE A C 1 +ATOM 3864 O O . ILE A 1 479 ? 93.072 85.426 116.435 1.00 10.38 ? 499 ILE A O 1 +ATOM 3865 C CB . ILE A 1 479 ? 93.775 88.304 116.297 1.00 9.58 ? 499 ILE A CB 1 +ATOM 3866 C CG1 . ILE A 1 479 ? 94.388 89.621 116.798 1.00 11.27 ? 499 ILE A CG1 1 +ATOM 3867 C CG2 . ILE A 1 479 ? 92.853 88.592 115.120 1.00 8.97 ? 499 ILE A CG2 1 +ATOM 3868 C CD1 . ILE A 1 479 ? 95.561 90.054 115.962 1.00 12.24 ? 499 ILE A CD1 1 +ATOM 3869 N N . CYS A 1 480 ? 91.036 86.285 116.844 1.00 10.00 ? 500 CYS A N 1 +ATOM 3870 C CA . CYS A 1 480 ? 90.283 85.143 116.349 1.00 9.70 ? 500 CYS A CA 1 +ATOM 3871 C C . CYS A 1 480 ? 89.452 85.599 115.152 1.00 9.39 ? 500 CYS A C 1 +ATOM 3872 O O . CYS A 1 480 ? 88.602 86.502 115.272 1.00 9.21 ? 500 CYS A O 1 +ATOM 3873 C CB . CYS A 1 480 ? 89.380 84.585 117.454 1.00 9.90 ? 500 CYS A CB 1 +ATOM 3874 S SG . CYS A 1 480 ? 90.277 83.857 118.846 1.00 11.23 ? 500 CYS A SG 1 +ATOM 3875 N N . LEU A 1 481 ? 89.715 84.967 114.011 1.00 8.65 ? 501 LEU A N 1 +ATOM 3876 C CA . LEU A 1 481 ? 89.180 85.378 112.714 1.00 8.20 ? 501 LEU A CA 1 +ATOM 3877 C C . LEU A 1 481 ? 88.284 84.313 112.093 1.00 7.98 ? 501 LEU A C 1 +ATOM 3878 O O . LEU A 1 481 ? 88.669 83.158 111.954 1.00 8.21 ? 501 LEU A O 1 +ATOM 3879 C CB . LEU A 1 481 ? 90.334 85.643 111.754 1.00 8.51 ? 501 LEU A CB 1 +ATOM 3880 C CG . LEU A 1 481 ? 91.311 86.712 112.247 1.00 8.40 ? 501 LEU A CG 1 +ATOM 3881 C CD1 . LEU A 1 481 ? 92.372 86.893 111.198 1.00 8.36 ? 501 LEU A CD1 1 +ATOM 3882 C CD2 . LEU A 1 481 ? 90.555 87.988 112.549 1.00 10.07 ? 501 LEU A CD2 1 +ATOM 3883 N N . ASN A 1 482 ? 87.088 84.736 111.723 1.00 8.35 ? 502 ASN A N 1 +ATOM 3884 C CA . ASN A 1 482 ? 86.158 83.975 110.910 1.00 8.41 ? 502 ASN A CA 1 +ATOM 3885 C C . ASN A 1 482 ? 86.222 84.382 109.441 1.00 8.31 ? 502 ASN A C 1 +ATOM 3886 O O . ASN A 1 482 ? 86.005 85.542 109.110 1.00 9.19 ? 502 ASN A O 1 +ATOM 3887 C CB . ASN A 1 482 ? 84.734 84.243 111.397 1.00 8.17 ? 502 ASN A CB 1 +ATOM 3888 C CG . ASN A 1 482 ? 84.491 83.747 112.799 1.00 8.59 ? 502 ASN A CG 1 +ATOM 3889 O OD1 . ASN A 1 482 ? 85.345 83.095 113.401 1.00 8.64 ? 502 ASN A OD1 1 +ATOM 3890 N ND2 . ASN A 1 482 ? 83.316 84.046 113.324 1.00 8.04 ? 502 ASN A ND2 1 +ATOM 3891 N N . SER A 1 483 ? 86.473 83.408 108.566 1.00 9.13 ? 503 SER A N 1 +ATOM 3892 C CA . SER A 1 483 ? 86.449 83.646 107.133 1.00 8.97 ? 503 SER A CA 1 +ATOM 3893 C C . SER A 1 483 ? 86.054 82.381 106.363 1.00 9.27 ? 503 SER A C 1 +ATOM 3894 O O . SER A 1 483 ? 86.384 81.264 106.766 1.00 10.33 ? 503 SER A O 1 +ATOM 3895 C CB . SER A 1 483 ? 87.809 84.161 106.653 1.00 9.25 ? 503 SER A CB 1 +ATOM 3896 O OG . SER A 1 483 ? 88.802 83.167 106.732 1.00 7.98 ? 503 SER A OG 1 +ATOM 3897 N N . TYR A 1 484 ? 85.360 82.594 105.249 1.00 9.42 ? 504 TYR A N 1 +ATOM 3898 C CA . TYR A 1 484 ? 84.761 81.528 104.463 1.00 9.21 ? 504 TYR A CA 1 +ATOM 3899 C C . TYR A 1 484 ? 84.973 81.829 102.979 1.00 8.91 ? 504 TYR A C 1 +ATOM 3900 O O . TYR A 1 484 ? 84.021 81.978 102.212 1.00 9.40 ? 504 TYR A O 1 +ATOM 3901 C CB . TYR A 1 484 ? 83.272 81.448 104.751 1.00 9.42 ? 504 TYR A CB 1 +ATOM 3902 C CG . TYR A 1 484 ? 82.869 80.977 106.133 1.00 8.70 ? 504 TYR A CG 1 +ATOM 3903 C CD1 . TYR A 1 484 ? 82.758 81.876 107.206 1.00 10.03 ? 504 TYR A CD1 1 +ATOM 3904 C CD2 . TYR A 1 484 ? 82.551 79.641 106.358 1.00 8.58 ? 504 TYR A CD2 1 +ATOM 3905 C CE1 . TYR A 1 484 ? 82.341 81.434 108.472 1.00 9.05 ? 504 TYR A CE1 1 +ATOM 3906 C CE2 . TYR A 1 484 ? 82.146 79.198 107.595 1.00 9.05 ? 504 TYR A CE2 1 +ATOM 3907 C CZ . TYR A 1 484 ? 82.038 80.085 108.648 1.00 8.32 ? 504 TYR A CZ 1 +ATOM 3908 O OH . TYR A 1 484 ? 81.620 79.590 109.872 1.00 7.83 ? 504 TYR A OH 1 +ATOM 3909 N N . TYR A 1 485 ? 86.228 81.923 102.577 1.00 8.17 ? 505 TYR A N 1 +ATOM 3910 C CA . TYR A 1 485 ? 86.560 82.270 101.190 1.00 8.55 ? 505 TYR A CA 1 +ATOM 3911 C C . TYR A 1 485 ? 86.034 81.205 100.232 1.00 8.11 ? 505 TYR A C 1 +ATOM 3912 O O . TYR A 1 485 ? 86.101 80.021 100.536 1.00 8.52 ? 505 TYR A O 1 +ATOM 3913 C CB . TYR A 1 485 ? 88.073 82.455 101.044 1.00 8.64 ? 505 TYR A CB 1 +ATOM 3914 C CG . TYR A 1 485 ? 88.608 83.520 101.977 1.00 9.93 ? 505 TYR A CG 1 +ATOM 3915 C CD1 . TYR A 1 485 ? 88.074 84.803 101.961 1.00 10.49 ? 505 TYR A CD1 1 +ATOM 3916 C CD2 . TYR A 1 485 ? 89.626 83.246 102.880 1.00 10.16 ? 505 TYR A CD2 1 +ATOM 3917 C CE1 . TYR A 1 485 ? 88.525 85.783 102.822 1.00 10.80 ? 505 TYR A CE1 1 +ATOM 3918 C CE2 . TYR A 1 485 ? 90.095 84.228 103.755 1.00 12.13 ? 505 TYR A CE2 1 +ATOM 3919 C CZ . TYR A 1 485 ? 89.542 85.495 103.713 1.00 11.01 ? 505 TYR A CZ 1 +ATOM 3920 O OH . TYR A 1 485 ? 89.970 86.512 104.552 1.00 11.08 ? 505 TYR A OH 1 +ATOM 3921 N N . SER A 1 486 ? 85.481 81.663 99.102 1.00 7.94 ? 506 SER A N 1 +ATOM 3922 C CA . SER A 1 486 ? 84.783 80.835 98.101 1.00 7.49 ? 506 SER A CA 1 +ATOM 3923 C C . SER A 1 486 ? 83.367 80.411 98.505 1.00 7.97 ? 506 SER A C 1 +ATOM 3924 O O . SER A 1 486 ? 82.644 79.879 97.670 1.00 8.01 ? 506 SER A O 1 +ATOM 3925 C CB . SER A 1 486 ? 85.593 79.603 97.678 1.00 7.70 ? 506 SER A CB 1 +ATOM 3926 O OG . SER A 1 486 ? 85.369 78.490 98.524 1.00 6.88 ? 506 SER A OG 1 +ATOM 3927 N N . TRP A 1 487 ? 82.992 80.607 99.768 1.00 8.20 ? 507 TRP A N 1 +ATOM 3928 C CA . TRP A 1 487 ? 81.684 80.198 100.245 1.00 8.28 ? 507 TRP A CA 1 +ATOM 3929 C C . TRP A 1 487 ? 80.741 81.403 100.411 1.00 9.21 ? 507 TRP A C 1 +ATOM 3930 O O . TRP A 1 487 ? 79.676 81.466 99.801 1.00 8.90 ? 507 TRP A O 1 +ATOM 3931 C CB . TRP A 1 487 ? 81.761 79.388 101.558 1.00 8.07 ? 507 TRP A CB 1 +ATOM 3932 C CG . TRP A 1 487 ? 80.399 78.943 101.838 1.00 7.45 ? 507 TRP A CG 1 +ATOM 3933 C CD1 . TRP A 1 487 ? 79.449 79.609 102.552 1.00 7.86 ? 507 TRP A CD1 1 +ATOM 3934 C CD2 . TRP A 1 487 ? 79.751 77.823 101.239 1.00 7.21 ? 507 TRP A CD2 1 +ATOM 3935 N NE1 . TRP A 1 487 ? 78.250 78.934 102.490 1.00 7.08 ? 507 TRP A NE1 1 +ATOM 3936 C CE2 . TRP A 1 487 ? 78.407 77.838 101.679 1.00 6.30 ? 507 TRP A CE2 1 +ATOM 3937 C CE3 . TRP A 1 487 ? 80.182 76.789 100.394 1.00 7.70 ? 507 TRP A CE3 1 +ATOM 3938 C CZ2 . TRP A 1 487 ? 77.495 76.871 101.296 1.00 7.89 ? 507 TRP A CZ2 1 +ATOM 3939 C CZ3 . TRP A 1 487 ? 79.287 75.829 100.025 1.00 7.55 ? 507 TRP A CZ3 1 +ATOM 3940 C CH2 . TRP A 1 487 ? 77.954 75.870 100.473 1.00 7.63 ? 507 TRP A CH2 1 +ATOM 3941 N N . TYR A 1 488 ? 81.107 82.340 101.274 1.00 10.11 ? 508 TYR A N 1 +ATOM 3942 C CA . TYR A 1 488 ? 80.269 83.515 101.492 1.00 11.11 ? 508 TYR A CA 1 +ATOM 3943 C C . TYR A 1 488 ? 80.531 84.644 100.490 1.00 11.51 ? 508 TYR A C 1 +ATOM 3944 O O . TYR A 1 488 ? 79.798 85.633 100.469 1.00 12.23 ? 508 TYR A O 1 +ATOM 3945 C CB . TYR A 1 488 ? 80.430 84.035 102.917 1.00 12.13 ? 508 TYR A CB 1 +ATOM 3946 C CG . TYR A 1 488 ? 79.655 83.270 103.975 1.00 11.85 ? 508 TYR A CG 1 +ATOM 3947 C CD1 . TYR A 1 488 ? 78.322 82.915 103.786 1.00 11.93 ? 508 TYR A CD1 1 +ATOM 3948 C CD2 . TYR A 1 488 ? 80.238 82.964 105.191 1.00 11.78 ? 508 TYR A CD2 1 +ATOM 3949 C CE1 . TYR A 1 488 ? 77.615 82.246 104.766 1.00 13.03 ? 508 TYR A CE1 1 +ATOM 3950 C CE2 . TYR A 1 488 ? 79.542 82.300 106.174 1.00 13.59 ? 508 TYR A CE2 1 +ATOM 3951 C CZ . TYR A 1 488 ? 78.225 81.943 105.958 1.00 13.11 ? 508 TYR A CZ 1 +ATOM 3952 O OH . TYR A 1 488 ? 77.527 81.285 106.937 1.00 13.68 ? 508 TYR A OH 1 +ATOM 3953 N N . HIS A 1 489 ? 81.571 84.493 99.667 1.00 11.87 ? 509 HIS A N 1 +ATOM 3954 C CA . HIS A 1 489 ? 81.837 85.380 98.533 1.00 11.37 ? 509 HIS A CA 1 +ATOM 3955 C C . HIS A 1 489 ? 82.677 84.624 97.515 1.00 10.51 ? 509 HIS A C 1 +ATOM 3956 O O . HIS A 1 489 ? 83.256 83.573 97.832 1.00 9.98 ? 509 HIS A O 1 +ATOM 3957 C CB . HIS A 1 489 ? 82.540 86.682 98.968 1.00 12.49 ? 509 HIS A CB 1 +ATOM 3958 C CG . HIS A 1 489 ? 83.143 86.605 100.331 1.00 14.28 ? 509 HIS A CG 1 +ATOM 3959 N ND1 . HIS A 1 489 ? 84.356 85.997 100.577 1.00 15.91 ? 509 HIS A ND1 1 +ATOM 3960 C CD2 . HIS A 1 489 ? 82.678 87.021 101.532 1.00 16.58 ? 509 HIS A CD2 1 +ATOM 3961 C CE1 . HIS A 1 489 ? 84.618 86.055 101.870 1.00 16.31 ? 509 HIS A CE1 1 +ATOM 3962 N NE2 . HIS A 1 489 ? 83.613 86.666 102.473 1.00 17.74 ? 509 HIS A NE2 1 +ATOM 3963 N N . ASP A 1 490 ? 82.720 85.155 96.295 1.00 9.57 ? 510 ASP A N 1 +ATOM 3964 C CA . ASP A 1 490 ? 83.378 84.507 95.158 1.00 9.12 ? 510 ASP A CA 1 +ATOM 3965 C C . ASP A 1 490 ? 82.933 83.047 95.055 1.00 8.27 ? 510 ASP A C 1 +ATOM 3966 O O . ASP A 1 490 ? 83.740 82.126 95.033 1.00 8.59 ? 510 ASP A O 1 +ATOM 3967 C CB . ASP A 1 490 ? 84.886 84.613 95.289 1.00 8.80 ? 510 ASP A CB 1 +ATOM 3968 C CG . ASP A 1 490 ? 85.330 86.034 95.565 1.00 9.38 ? 510 ASP A CG 1 +ATOM 3969 O OD1 . ASP A 1 490 ? 84.959 86.920 94.770 1.00 10.91 ? 510 ASP A OD1 1 +ATOM 3970 O OD2 . ASP A 1 490 ? 86.011 86.256 96.582 1.00 10.61 ? 510 ASP A OD2 1 +ATOM 3971 N N . TYR A 1 491 ? 81.620 82.863 94.984 1.00 7.84 ? 511 TYR A N 1 +ATOM 3972 C CA . TYR A 1 491 ? 81.001 81.536 95.097 1.00 7.94 ? 511 TYR A CA 1 +ATOM 3973 C C . TYR A 1 491 ? 81.618 80.493 94.175 1.00 7.31 ? 511 TYR A C 1 +ATOM 3974 O O . TYR A 1 491 ? 81.615 80.650 92.945 1.00 7.63 ? 511 TYR A O 1 +ATOM 3975 C CB . TYR A 1 491 ? 79.492 81.637 94.815 1.00 7.98 ? 511 TYR A CB 1 +ATOM 3976 C CG . TYR A 1 491 ? 78.768 82.704 95.603 1.00 8.60 ? 511 TYR A CG 1 +ATOM 3977 C CD1 . TYR A 1 491 ? 79.065 82.933 96.944 1.00 8.51 ? 511 TYR A CD1 1 +ATOM 3978 C CD2 . TYR A 1 491 ? 77.777 83.481 95.013 1.00 9.31 ? 511 TYR A CD2 1 +ATOM 3979 C CE1 . TYR A 1 491 ? 78.395 83.906 97.667 1.00 9.44 ? 511 TYR A CE1 1 +ATOM 3980 C CE2 . TYR A 1 491 ? 77.109 84.447 95.725 1.00 9.90 ? 511 TYR A CE2 1 +ATOM 3981 C CZ . TYR A 1 491 ? 77.425 84.660 97.055 1.00 10.70 ? 511 TYR A CZ 1 +ATOM 3982 O OH . TYR A 1 491 ? 76.763 85.639 97.756 1.00 11.15 ? 511 TYR A OH 1 +ATOM 3983 N N . GLY A 1 492 ? 82.156 79.425 94.766 1.00 7.58 ? 512 GLY A N 1 +ATOM 3984 C CA . GLY A 1 492 ? 82.663 78.300 93.988 1.00 6.91 ? 512 GLY A CA 1 +ATOM 3985 C C . GLY A 1 492 ? 84.160 78.403 93.703 1.00 6.95 ? 512 GLY A C 1 +ATOM 3986 O O . GLY A 1 492 ? 84.778 77.432 93.285 1.00 7.25 ? 512 GLY A O 1 +ATOM 3987 N N . HIS A 1 493 ? 84.746 79.569 93.963 1.00 6.96 ? 513 HIS A N 1 +ATOM 3988 C CA . HIS A 1 493 ? 86.121 79.857 93.535 1.00 7.06 ? 513 HIS A CA 1 +ATOM 3989 C C . HIS A 1 493 ? 87.183 79.383 94.515 1.00 7.64 ? 513 HIS A C 1 +ATOM 3990 O O . HIS A 1 493 ? 87.869 80.179 95.174 1.00 8.45 ? 513 HIS A O 1 +ATOM 3991 C CB . HIS A 1 493 ? 86.286 81.337 93.221 1.00 7.51 ? 513 HIS A CB 1 +ATOM 3992 C CG . HIS A 1 493 ? 85.610 81.754 91.959 1.00 7.03 ? 513 HIS A CG 1 +ATOM 3993 N ND1 . HIS A 1 493 ? 86.277 81.814 90.756 1.00 7.12 ? 513 HIS A ND1 1 +ATOM 3994 C CD2 . HIS A 1 493 ? 84.331 82.110 91.701 1.00 8.89 ? 513 HIS A CD2 1 +ATOM 3995 C CE1 . HIS A 1 493 ? 85.442 82.212 89.817 1.00 7.37 ? 513 HIS A CE1 1 +ATOM 3996 N NE2 . HIS A 1 493 ? 84.248 82.382 90.359 1.00 8.52 ? 513 HIS A NE2 1 +ATOM 3997 N N . LEU A 1 494 ? 87.334 78.067 94.573 1.00 8.16 ? 514 LEU A N 1 +ATOM 3998 C CA . LEU A 1 494 ? 88.299 77.430 95.465 1.00 8.07 ? 514 LEU A CA 1 +ATOM 3999 C C . LEU A 1 494 ? 89.712 77.904 95.199 1.00 8.73 ? 514 LEU A C 1 +ATOM 4000 O O . LEU A 1 494 ? 90.542 77.907 96.105 1.00 8.97 ? 514 LEU A O 1 +ATOM 4001 C CB . LEU A 1 494 ? 88.268 75.914 95.269 1.00 8.37 ? 514 LEU A CB 1 +ATOM 4002 C CG . LEU A 1 494 ? 86.964 75.230 95.656 1.00 9.36 ? 514 LEU A CG 1 +ATOM 4003 C CD1 . LEU A 1 494 ? 86.836 73.910 94.925 1.00 9.66 ? 514 LEU A CD1 1 +ATOM 4004 C CD2 . LEU A 1 494 ? 86.912 75.019 97.159 1.00 10.37 ? 514 LEU A CD2 1 +ATOM 4005 N N . GLU A 1 495 ? 89.987 78.282 93.957 1.00 8.83 ? 515 GLU A N 1 +ATOM 4006 C CA . GLU A 1 495 ? 91.342 78.679 93.559 1.00 9.86 ? 515 GLU A CA 1 +ATOM 4007 C C . GLU A 1 495 ? 91.833 79.981 94.208 1.00 10.31 ? 515 GLU A C 1 +ATOM 4008 O O . GLU A 1 495 ? 93.019 80.314 94.091 1.00 11.37 ? 515 GLU A O 1 +ATOM 4009 C CB . GLU A 1 495 ? 91.436 78.773 92.027 1.00 10.06 ? 515 GLU A CB 1 +ATOM 4010 C CG . GLU A 1 495 ? 90.910 80.063 91.380 1.00 10.33 ? 515 GLU A CG 1 +ATOM 4011 C CD . GLU A 1 495 ? 89.397 80.153 91.246 1.00 13.28 ? 515 GLU A CD 1 +ATOM 4012 O OE1 . GLU A 1 495 ? 88.676 79.267 91.749 1.00 11.94 ? 515 GLU A OE1 1 +ATOM 4013 O OE2 . GLU A 1 495 ? 88.938 81.147 90.641 1.00 12.84 ? 515 GLU A OE2 1 +ATOM 4014 N N . LEU A 1 496 ? 90.927 80.718 94.852 1.00 10.43 ? 516 LEU A N 1 +ATOM 4015 C CA . LEU A 1 496 ? 91.229 82.015 95.462 1.00 10.28 ? 516 LEU A CA 1 +ATOM 4016 C C . LEU A 1 496 ? 91.615 81.918 96.925 1.00 10.33 ? 516 LEU A C 1 +ATOM 4017 O O . LEU A 1 496 ? 92.104 82.898 97.504 1.00 10.86 ? 516 LEU A O 1 +ATOM 4018 C CB . LEU A 1 496 ? 89.998 82.909 95.373 1.00 10.50 ? 516 LEU A CB 1 +ATOM 4019 C CG . LEU A 1 496 ? 89.469 83.229 93.989 1.00 10.68 ? 516 LEU A CG 1 +ATOM 4020 C CD1 . LEU A 1 496 ? 88.282 84.191 94.097 1.00 11.10 ? 516 LEU A CD1 1 +ATOM 4021 C CD2 . LEU A 1 496 ? 90.562 83.855 93.110 1.00 10.49 ? 516 LEU A CD2 1 +ATOM 4022 N N . ILE A 1 497 ? 91.386 80.749 97.522 1.00 10.21 ? 517 ILE A N 1 +ATOM 4023 C CA . ILE A 1 497 ? 91.417 80.601 98.970 1.00 9.45 ? 517 ILE A CA 1 +ATOM 4024 C C . ILE A 1 497 ? 92.812 80.835 99.552 1.00 9.47 ? 517 ILE A C 1 +ATOM 4025 O O . ILE A 1 497 ? 92.947 81.542 100.542 1.00 8.67 ? 517 ILE A O 1 +ATOM 4026 C CB . ILE A 1 497 ? 90.907 79.190 99.398 1.00 9.39 ? 517 ILE A CB 1 +ATOM 4027 C CG1 . ILE A 1 497 ? 89.395 79.089 99.162 1.00 8.56 ? 517 ILE A CG1 1 +ATOM 4028 C CG2 . ILE A 1 497 ? 91.215 78.938 100.843 1.00 9.05 ? 517 ILE A CG2 1 +ATOM 4029 C CD1 . ILE A 1 497 ? 88.838 77.693 99.394 1.00 8.07 ? 517 ILE A CD1 1 +ATOM 4030 N N . GLN A 1 498 ? 93.840 80.212 98.976 1.00 9.70 ? 518 GLN A N 1 +ATOM 4031 C CA . GLN A 1 498 ? 95.204 80.383 99.523 1.00 10.34 ? 518 GLN A CA 1 +ATOM 4032 C C . GLN A 1 498 ? 95.650 81.859 99.451 1.00 10.63 ? 518 GLN A C 1 +ATOM 4033 O O . GLN A 1 498 ? 96.238 82.388 100.405 1.00 10.23 ? 518 GLN A O 1 +ATOM 4034 C CB . GLN A 1 498 ? 96.216 79.454 98.830 1.00 10.27 ? 518 GLN A CB 1 +ATOM 4035 C CG . GLN A 1 498 ? 96.080 77.971 99.203 1.00 11.12 ? 518 GLN A CG 1 +ATOM 4036 C CD . GLN A 1 498 ? 97.214 77.101 98.680 1.00 10.80 ? 518 GLN A CD 1 +ATOM 4037 O OE1 . GLN A 1 498 ? 98.390 77.316 99.007 1.00 14.05 ? 518 GLN A OE1 1 +ATOM 4038 N NE2 . GLN A 1 498 ? 96.866 76.093 97.877 1.00 12.29 ? 518 GLN A NE2 1 +ATOM 4039 N N . LEU A 1 499 ? 95.345 82.528 98.346 1.00 10.53 ? 519 LEU A N 1 +ATOM 4040 C CA . LEU A 1 499 ? 95.707 83.952 98.192 1.00 10.79 ? 519 LEU A CA 1 +ATOM 4041 C C . LEU A 1 499 ? 94.998 84.813 99.239 1.00 10.58 ? 519 LEU A C 1 +ATOM 4042 O O . LEU A 1 499 ? 95.627 85.610 99.937 1.00 10.40 ? 519 LEU A O 1 +ATOM 4043 C CB . LEU A 1 499 ? 95.372 84.450 96.779 1.00 11.03 ? 519 LEU A CB 1 +ATOM 4044 C CG . LEU A 1 499 ? 95.696 85.900 96.426 1.00 11.89 ? 519 LEU A CG 1 +ATOM 4045 C CD1 . LEU A 1 499 ? 97.224 86.103 96.458 1.00 14.63 ? 519 LEU A CD1 1 +ATOM 4046 C CD2 . LEU A 1 499 ? 95.106 86.309 95.071 1.00 11.80 ? 519 LEU A CD2 1 +ATOM 4047 N N . GLN A 1 500 ? 93.679 84.658 99.352 1.00 10.30 ? 520 GLN A N 1 +ATOM 4048 C CA . GLN A 1 500 ? 92.917 85.505 100.267 1.00 9.95 ? 520 GLN A CA 1 +ATOM 4049 C C . GLN A 1 500 ? 93.275 85.237 101.731 1.00 9.80 ? 520 GLN A C 1 +ATOM 4050 O O . GLN A 1 500 ? 93.260 86.152 102.547 1.00 9.69 ? 520 GLN A O 1 +ATOM 4051 C CB . GLN A 1 500 ? 91.416 85.365 100.016 1.00 9.91 ? 520 GLN A CB 1 +ATOM 4052 C CG . GLN A 1 500 ? 91.057 85.802 98.621 1.00 10.42 ? 520 GLN A CG 1 +ATOM 4053 C CD . GLN A 1 500 ? 89.595 85.642 98.292 1.00 12.51 ? 520 GLN A CD 1 +ATOM 4054 O OE1 . GLN A 1 500 ? 88.826 85.081 99.071 1.00 14.25 ? 520 GLN A OE1 1 +ATOM 4055 N NE2 . GLN A 1 500 ? 89.200 86.151 97.137 1.00 11.80 ? 520 GLN A NE2 1 +ATOM 4056 N N . LEU A 1 501 ? 93.625 83.993 102.055 1.00 9.96 ? 521 LEU A N 1 +ATOM 4057 C CA . LEU A 1 501 ? 94.050 83.643 103.413 1.00 10.54 ? 521 LEU A CA 1 +ATOM 4058 C C . LEU A 1 501 ? 95.422 84.224 103.740 1.00 10.67 ? 521 LEU A C 1 +ATOM 4059 O O . LEU A 1 501 ? 95.668 84.711 104.850 1.00 10.60 ? 521 LEU A O 1 +ATOM 4060 C CB . LEU A 1 501 ? 94.071 82.121 103.569 1.00 10.97 ? 521 LEU A CB 1 +ATOM 4061 C CG . LEU A 1 501 ? 93.933 81.544 104.976 1.00 11.90 ? 521 LEU A CG 1 +ATOM 4062 C CD1 . LEU A 1 501 ? 92.761 82.180 105.751 1.00 11.11 ? 521 LEU A CD1 1 +ATOM 4063 C CD2 . LEU A 1 501 ? 93.789 80.011 104.894 1.00 11.57 ? 521 LEU A CD2 1 +ATOM 4064 N N . ALA A 1 502 ? 96.324 84.164 102.767 1.00 10.92 ? 522 ALA A N 1 +ATOM 4065 C CA . ALA A 1 502 ? 97.666 84.728 102.929 1.00 11.18 ? 522 ALA A CA 1 +ATOM 4066 C C . ALA A 1 502 ? 97.553 86.217 103.210 1.00 12.01 ? 522 ALA A C 1 +ATOM 4067 O O . ALA A 1 502 ? 98.196 86.751 104.112 1.00 12.43 ? 522 ALA A O 1 +ATOM 4068 C CB . ALA A 1 502 ? 98.494 84.492 101.668 1.00 11.11 ? 522 ALA A CB 1 +ATOM 4069 N N . THR A 1 503 ? 96.721 86.883 102.423 1.00 11.92 ? 523 THR A N 1 +ATOM 4070 C CA . THR A 1 503 ? 96.476 88.292 102.589 1.00 11.89 ? 523 THR A CA 1 +ATOM 4071 C C . THR A 1 503 ? 95.877 88.585 103.970 1.00 12.04 ? 523 THR A C 1 +ATOM 4072 O O . THR A 1 503 ? 96.308 89.510 104.663 1.00 11.88 ? 523 THR A O 1 +ATOM 4073 C CB . THR A 1 503 ? 95.592 88.796 101.437 1.00 11.90 ? 523 THR A CB 1 +ATOM 4074 O OG1 . THR A 1 503 ? 96.323 88.637 100.205 1.00 13.26 ? 523 THR A OG1 1 +ATOM 4075 C CG2 . THR A 1 503 ? 95.185 90.250 101.647 1.00 11.61 ? 523 THR A CG2 1 +ATOM 4076 N N . GLN A 1 504 ? 94.926 87.749 104.384 1.00 12.02 ? 524 GLN A N 1 +ATOM 4077 C CA . GLN A 1 504 ? 94.284 87.872 105.683 1.00 11.55 ? 524 GLN A CA 1 +ATOM 4078 C C . GLN A 1 504 ? 95.330 87.887 106.791 1.00 11.64 ? 524 GLN A C 1 +ATOM 4079 O O . GLN A 1 504 ? 95.395 88.827 107.589 1.00 11.28 ? 524 GLN A O 1 +ATOM 4080 C CB . GLN A 1 504 ? 93.345 86.686 105.892 1.00 11.27 ? 524 GLN A CB 1 +ATOM 4081 C CG . GLN A 1 504 ? 92.651 86.650 107.222 1.00 11.61 ? 524 GLN A CG 1 +ATOM 4082 C CD . GLN A 1 504 ? 91.850 85.377 107.366 1.00 13.00 ? 524 GLN A CD 1 +ATOM 4083 O OE1 . GLN A 1 504 ? 90.830 85.188 106.691 1.00 12.72 ? 524 GLN A OE1 1 +ATOM 4084 N NE2 . GLN A 1 504 ? 92.322 84.486 108.220 1.00 13.70 ? 524 GLN A NE2 1 +ATOM 4085 N N . PHE A 1 505 ? 96.152 86.848 106.818 1.00 11.70 ? 525 PHE A N 1 +ATOM 4086 C CA . PHE A 1 505 ? 97.113 86.671 107.898 1.00 12.30 ? 525 PHE A CA 1 +ATOM 4087 C C . PHE A 1 505 ? 98.165 87.780 107.877 1.00 12.74 ? 525 PHE A C 1 +ATOM 4088 O O . PHE A 1 505 ? 98.470 88.351 108.924 1.00 13.11 ? 525 PHE A O 1 +ATOM 4089 C CB . PHE A 1 505 ? 97.770 85.283 107.839 1.00 11.87 ? 525 PHE A CB 1 +ATOM 4090 C CG . PHE A 1 505 ? 96.831 84.134 108.177 1.00 12.01 ? 525 PHE A CG 1 +ATOM 4091 C CD1 . PHE A 1 505 ? 95.942 84.218 109.253 1.00 11.99 ? 525 PHE A CD1 1 +ATOM 4092 C CD2 . PHE A 1 505 ? 96.856 82.967 107.433 1.00 12.21 ? 525 PHE A CD2 1 +ATOM 4093 C CE1 . PHE A 1 505 ? 95.086 83.158 109.558 1.00 12.26 ? 525 PHE A CE1 1 +ATOM 4094 C CE2 . PHE A 1 505 ? 95.998 81.892 107.752 1.00 12.22 ? 525 PHE A CE2 1 +ATOM 4095 C CZ . PHE A 1 505 ? 95.122 82.002 108.809 1.00 11.54 ? 525 PHE A CZ 1 +ATOM 4096 N N . GLU A 1 506 ? 98.681 88.107 106.695 1.00 13.52 ? 526 GLU A N 1 +ATOM 4097 C CA . GLU A 1 506 ? 99.677 89.197 106.565 1.00 14.79 ? 526 GLU A CA 1 +ATOM 4098 C C . GLU A 1 506 ? 99.131 90.534 107.059 1.00 14.04 ? 526 GLU A C 1 +ATOM 4099 O O . GLU A 1 506 ? 99.742 91.199 107.903 1.00 13.59 ? 526 GLU A O 1 +ATOM 4100 C CB . GLU A 1 506 ? 100.167 89.308 105.112 1.00 15.07 ? 526 GLU A CB 1 +ATOM 4101 C CG . GLU A 1 506 ? 101.010 88.118 104.650 1.00 18.05 ? 526 GLU A CG 1 +ATOM 4102 C CD . GLU A 1 506 ? 101.206 88.040 103.126 1.00 18.21 ? 526 GLU A CD 1 +ATOM 4103 O OE1 . GLU A 1 506 ? 100.286 88.420 102.379 1.00 24.10 ? 526 GLU A OE1 1 +ATOM 4104 O OE2 . GLU A 1 506 ? 102.287 87.573 102.677 1.00 24.92 ? 526 GLU A OE2 1 +ATOM 4105 N N . ASN A 1 507 ? 97.968 90.920 106.548 1.00 13.60 ? 527 ASN A N 1 +ATOM 4106 C CA . ASN A 1 507 ? 97.306 92.156 106.956 1.00 13.88 ? 527 ASN A CA 1 +ATOM 4107 C C . ASN A 1 507 ? 97.067 92.231 108.461 1.00 13.52 ? 527 ASN A C 1 +ATOM 4108 O O . ASN A 1 507 ? 97.413 93.232 109.105 1.00 12.76 ? 527 ASN A O 1 +ATOM 4109 C CB . ASN A 1 507 ? 95.964 92.325 106.213 1.00 13.91 ? 527 ASN A CB 1 +ATOM 4110 C CG . ASN A 1 507 ? 96.143 92.675 104.733 1.00 16.59 ? 527 ASN A CG 1 +ATOM 4111 O OD1 . ASN A 1 507 ? 97.238 93.024 104.288 1.00 20.05 ? 527 ASN A OD1 1 +ATOM 4112 N ND2 . ASN A 1 507 ? 95.049 92.588 103.967 1.00 17.26 ? 527 ASN A ND2 1 +ATOM 4113 N N . TRP A 1 508 ? 96.463 91.181 109.023 1.00 13.07 ? 528 TRP A N 1 +ATOM 4114 C CA . TRP A 1 508 ? 96.112 91.193 110.440 1.00 13.26 ? 528 TRP A CA 1 +ATOM 4115 C C . TRP A 1 508 ? 97.352 91.222 111.331 1.00 13.78 ? 528 TRP A C 1 +ATOM 4116 O O . TRP A 1 508 ? 97.366 91.939 112.327 1.00 14.07 ? 528 TRP A O 1 +ATOM 4117 C CB . TRP A 1 508 ? 95.239 89.991 110.828 1.00 12.59 ? 528 TRP A CB 1 +ATOM 4118 C CG . TRP A 1 508 ? 93.780 90.223 110.548 1.00 11.97 ? 528 TRP A CG 1 +ATOM 4119 C CD1 . TRP A 1 508 ? 93.112 89.905 109.408 1.00 11.17 ? 528 TRP A CD1 1 +ATOM 4120 C CD2 . TRP A 1 508 ? 92.815 90.832 111.424 1.00 11.63 ? 528 TRP A CD2 1 +ATOM 4121 N NE1 . TRP A 1 508 ? 91.790 90.253 109.521 1.00 11.54 ? 528 TRP A NE1 1 +ATOM 4122 C CE2 . TRP A 1 508 ? 91.580 90.834 110.742 1.00 12.27 ? 528 TRP A CE2 1 +ATOM 4123 C CE3 . TRP A 1 508 ? 92.875 91.372 112.712 1.00 11.95 ? 528 TRP A CE3 1 +ATOM 4124 C CZ2 . TRP A 1 508 ? 90.408 91.352 111.307 1.00 11.61 ? 528 TRP A CZ2 1 +ATOM 4125 C CZ3 . TRP A 1 508 ? 91.705 91.894 113.272 1.00 11.81 ? 528 TRP A CZ3 1 +ATOM 4126 C CH2 . TRP A 1 508 ? 90.497 91.884 112.566 1.00 11.60 ? 528 TRP A CH2 1 +ATOM 4127 N N . TYR A 1 509 ? 98.370 90.436 110.984 1.00 14.66 ? 529 TYR A N 1 +ATOM 4128 C CA . TYR A 1 509 ? 99.572 90.363 111.822 1.00 14.97 ? 529 TYR A CA 1 +ATOM 4129 C C . TYR A 1 509 ? 100.411 91.623 111.701 1.00 15.90 ? 529 TYR A C 1 +ATOM 4130 O O . TYR A 1 509 ? 100.978 92.078 112.694 1.00 14.87 ? 529 TYR A O 1 +ATOM 4131 C CB . TYR A 1 509 ? 100.435 89.140 111.509 1.00 15.53 ? 529 TYR A CB 1 +ATOM 4132 C CG . TYR A 1 509 ? 101.393 88.789 112.636 1.00 15.60 ? 529 TYR A CG 1 +ATOM 4133 C CD1 . TYR A 1 509 ? 100.914 88.367 113.870 1.00 15.75 ? 529 TYR A CD1 1 +ATOM 4134 C CD2 . TYR A 1 509 ? 102.775 88.889 112.474 1.00 15.65 ? 529 TYR A CD2 1 +ATOM 4135 C CE1 . TYR A 1 509 ? 101.775 88.054 114.923 1.00 15.80 ? 529 TYR A CE1 1 +ATOM 4136 C CE2 . TYR A 1 509 ? 103.648 88.576 113.525 1.00 15.83 ? 529 TYR A CE2 1 +ATOM 4137 C CZ . TYR A 1 509 ? 103.135 88.152 114.747 1.00 16.42 ? 529 TYR A CZ 1 +ATOM 4138 O OH . TYR A 1 509 ? 103.968 87.827 115.806 1.00 17.08 ? 529 TYR A OH 1 +ATOM 4139 N N . LYS A 1 510 ? 100.512 92.180 110.496 1.00 16.48 ? 530 LYS A N 1 +ATOM 4140 C CA . LYS A 1 510 ? 101.258 93.434 110.317 1.00 18.03 ? 530 LYS A CA 1 +ATOM 4141 C C . LYS A 1 510 ? 100.643 94.561 111.154 1.00 17.77 ? 530 LYS A C 1 +ATOM 4142 O O . LYS A 1 510 ? 101.362 95.374 111.732 1.00 18.09 ? 530 LYS A O 1 +ATOM 4143 C CB . LYS A 1 510 ? 101.309 93.829 108.838 1.00 17.62 ? 530 LYS A CB 1 +ATOM 4144 C CG . LYS A 1 510 ? 102.300 94.947 108.515 1.00 19.31 ? 530 LYS A CG 1 +ATOM 4145 C CD . LYS A 1 510 ? 102.155 95.426 107.071 1.00 20.42 ? 530 LYS A CD 1 +ATOM 4146 C CE . LYS A 1 510 ? 103.003 96.676 106.803 1.00 23.31 ? 530 LYS A CE 1 +ATOM 4147 N NZ . LYS A 1 510 ? 102.942 97.686 107.902 1.00 25.53 ? 530 LYS A NZ 1 +ATOM 4148 N N . LYS A 1 511 ? 99.318 94.609 111.231 1.00 17.96 ? 531 LYS A N 1 +ATOM 4149 C CA . LYS A 1 511 ? 98.666 95.667 111.985 1.00 18.26 ? 531 LYS A CA 1 +ATOM 4150 C C . LYS A 1 511 ? 98.801 95.481 113.492 1.00 18.19 ? 531 LYS A C 1 +ATOM 4151 O O . LYS A 1 511 ? 98.950 96.463 114.210 1.00 18.32 ? 531 LYS A O 1 +ATOM 4152 C CB . LYS A 1 511 ? 97.189 95.772 111.625 1.00 18.30 ? 531 LYS A CB 1 +ATOM 4153 C CG . LYS A 1 511 ? 96.564 97.080 112.081 1.00 19.65 ? 531 LYS A CG 1 +ATOM 4154 C CD . LYS A 1 511 ? 95.301 97.389 111.308 1.00 21.35 ? 531 LYS A CD 1 +ATOM 4155 C CE . LYS A 1 511 ? 94.757 98.771 111.618 1.00 23.70 ? 531 LYS A CE 1 +ATOM 4156 N NZ . LYS A 1 511 ? 94.375 98.909 113.035 1.00 25.08 ? 531 LYS A NZ 1 +ATOM 4157 N N . TYR A 1 512 ? 98.755 94.229 113.962 1.00 18.82 ? 532 TYR A N 1 +ATOM 4158 C CA . TYR A 1 512 ? 98.574 93.938 115.399 1.00 19.26 ? 532 TYR A CA 1 +ATOM 4159 C C . TYR A 1 512 ? 99.662 93.153 116.123 1.00 19.01 ? 532 TYR A C 1 +ATOM 4160 O O . TYR A 1 512 ? 99.740 93.234 117.350 1.00 19.44 ? 532 TYR A O 1 +ATOM 4161 C CB . TYR A 1 512 ? 97.223 93.249 115.617 1.00 19.89 ? 532 TYR A CB 1 +ATOM 4162 C CG . TYR A 1 512 ? 96.100 94.232 115.501 1.00 20.37 ? 532 TYR A CG 1 +ATOM 4163 C CD1 . TYR A 1 512 ? 95.930 95.209 116.471 1.00 21.00 ? 532 TYR A CD1 1 +ATOM 4164 C CD2 . TYR A 1 512 ? 95.247 94.231 114.408 1.00 20.39 ? 532 TYR A CD2 1 +ATOM 4165 C CE1 . TYR A 1 512 ? 94.934 96.127 116.382 1.00 20.93 ? 532 TYR A CE1 1 +ATOM 4166 C CE2 . TYR A 1 512 ? 94.231 95.159 114.304 1.00 21.19 ? 532 TYR A CE2 1 +ATOM 4167 C CZ . TYR A 1 512 ? 94.088 96.111 115.301 1.00 20.50 ? 532 TYR A CZ 1 +ATOM 4168 O OH . TYR A 1 512 ? 93.099 97.062 115.250 1.00 21.96 ? 532 TYR A OH 1 +ATOM 4169 N N . GLN A 1 513 ? 100.453 92.372 115.396 1.00 18.29 ? 533 GLN A N 1 +ATOM 4170 C CA . GLN A 1 513 ? 101.556 91.611 115.981 1.00 18.14 ? 533 GLN A CA 1 +ATOM 4171 C C . GLN A 1 513 ? 101.162 90.792 117.226 1.00 17.34 ? 533 GLN A C 1 +ATOM 4172 O O . GLN A 1 513 ? 101.875 90.779 118.233 1.00 17.11 ? 533 GLN A O 1 +ATOM 4173 C CB . GLN A 1 513 ? 102.718 92.559 116.288 1.00 18.54 ? 533 GLN A CB 1 +ATOM 4174 C CG . GLN A 1 513 ? 103.210 93.293 115.046 1.00 20.72 ? 533 GLN A CG 1 +ATOM 4175 C CD . GLN A 1 513 ? 104.721 93.283 114.912 1.00 24.20 ? 533 GLN A CD 1 +ATOM 4176 O OE1 . GLN A 1 513 ? 105.383 92.312 115.288 1.00 27.70 ? 533 GLN A OE1 1 +ATOM 4177 N NE2 . GLN A 1 513 ? 105.278 94.362 114.350 1.00 27.27 ? 533 GLN A NE2 1 +ATOM 4178 N N . LYS A 1 514 ? 100.020 90.110 117.118 1.00 16.08 ? 534 LYS A N 1 +ATOM 4179 C CA . LYS A 1 514 ? 99.456 89.260 118.168 1.00 15.08 ? 534 LYS A CA 1 +ATOM 4180 C C . LYS A 1 514 ? 99.099 87.901 117.534 1.00 13.70 ? 534 LYS A C 1 +ATOM 4181 O O . LYS A 1 514 ? 98.773 87.861 116.344 1.00 13.15 ? 534 LYS A O 1 +ATOM 4182 C CB . LYS A 1 514 ? 98.194 89.917 118.729 1.00 15.20 ? 534 LYS A CB 1 +ATOM 4183 C CG . LYS A 1 514 ? 98.401 90.704 120.008 1.00 16.99 ? 534 LYS A CG 1 +ATOM 4184 C CD . LYS A 1 514 ? 97.640 92.021 120.065 1.00 17.13 ? 534 LYS A CD 1 +ATOM 4185 C CE . LYS A 1 514 ? 96.218 91.972 119.550 1.00 16.58 ? 534 LYS A CE 1 +ATOM 4186 N NZ . LYS A 1 514 ? 95.382 93.056 120.149 1.00 17.22 ? 534 LYS A NZ 1 +ATOM 4187 N N . PRO A 1 515 ? 99.161 86.792 118.309 1.00 12.18 ? 535 PRO A N 1 +ATOM 4188 C CA . PRO A 1 515 ? 98.865 85.483 117.698 1.00 11.56 ? 535 PRO A CA 1 +ATOM 4189 C C . PRO A 1 515 ? 97.446 85.447 117.134 1.00 11.17 ? 535 PRO A C 1 +ATOM 4190 O O . PRO A 1 515 ? 96.573 86.176 117.621 1.00 10.66 ? 535 PRO A O 1 +ATOM 4191 C CB . PRO A 1 515 ? 99.017 84.486 118.858 1.00 11.42 ? 535 PRO A CB 1 +ATOM 4192 C CG . PRO A 1 515 ? 99.802 85.208 119.910 1.00 12.17 ? 535 PRO A CG 1 +ATOM 4193 C CD . PRO A 1 515 ? 99.504 86.670 119.738 1.00 11.75 ? 535 PRO A CD 1 +ATOM 4194 N N . ILE A 1 516 ? 97.247 84.613 116.115 1.00 10.90 ? 536 ILE A N 1 +ATOM 4195 C CA . ILE A 1 516 ? 95.972 84.526 115.394 1.00 10.66 ? 536 ILE A CA 1 +ATOM 4196 C C . ILE A 1 516 ? 95.453 83.097 115.392 1.00 9.81 ? 536 ILE A C 1 +ATOM 4197 O O . ILE A 1 516 ? 96.207 82.168 115.158 1.00 9.13 ? 536 ILE A O 1 +ATOM 4198 C CB . ILE A 1 516 ? 96.139 84.969 113.929 1.00 10.58 ? 536 ILE A CB 1 +ATOM 4199 C CG1 . ILE A 1 516 ? 96.473 86.459 113.839 1.00 9.61 ? 536 ILE A CG1 1 +ATOM 4200 C CG2 . ILE A 1 516 ? 94.859 84.720 113.133 1.00 11.28 ? 536 ILE A CG2 1 +ATOM 4201 C CD1 . ILE A 1 516 ? 96.924 86.904 112.485 1.00 11.22 ? 536 ILE A CD1 1 +ATOM 4202 N N . ILE A 1 517 ? 94.149 82.937 115.630 1.00 8.87 ? 537 ILE A N 1 +ATOM 4203 C CA . ILE A 1 517 ? 93.461 81.657 115.452 1.00 8.87 ? 537 ILE A CA 1 +ATOM 4204 C C . ILE A 1 517 ? 92.438 81.814 114.322 1.00 8.36 ? 537 ILE A C 1 +ATOM 4205 O O . ILE A 1 517 ? 91.684 82.782 114.332 1.00 8.21 ? 537 ILE A O 1 +ATOM 4206 C CB . ILE A 1 517 ? 92.698 81.258 116.743 1.00 8.70 ? 537 ILE A CB 1 +ATOM 4207 C CG1 . ILE A 1 517 ? 93.680 80.869 117.849 1.00 9.07 ? 537 ILE A CG1 1 +ATOM 4208 C CG2 . ILE A 1 517 ? 91.742 80.122 116.485 1.00 8.48 ? 537 ILE A CG2 1 +ATOM 4209 C CD1 . ILE A 1 517 ? 93.059 80.772 119.199 1.00 9.58 ? 537 ILE A CD1 1 +ATOM 4210 N N . GLN A 1 518 ? 92.434 80.891 113.361 1.00 8.23 ? 538 GLN A N 1 +ATOM 4211 C CA . GLN A 1 518 ? 91.350 80.800 112.373 1.00 8.23 ? 538 GLN A CA 1 +ATOM 4212 C C . GLN A 1 518 ? 90.215 80.089 113.098 1.00 7.59 ? 538 GLN A C 1 +ATOM 4213 O O . GLN A 1 518 ? 90.200 78.868 113.162 1.00 8.10 ? 538 GLN A O 1 +ATOM 4214 C CB . GLN A 1 518 ? 91.791 80.013 111.132 1.00 8.27 ? 538 GLN A CB 1 +ATOM 4215 C CG . GLN A 1 518 ? 90.766 79.957 110.002 1.00 7.98 ? 538 GLN A CG 1 +ATOM 4216 C CD . GLN A 1 518 ? 90.585 81.294 109.286 1.00 9.52 ? 538 GLN A CD 1 +ATOM 4217 O OE1 . GLN A 1 518 ? 91.546 82.023 109.063 1.00 10.68 ? 538 GLN A OE1 1 +ATOM 4218 N NE2 . GLN A 1 518 ? 89.342 81.614 108.912 1.00 7.22 ? 538 GLN A NE2 1 +ATOM 4219 N N . SER A 1 519 ? 89.286 80.866 113.656 1.00 7.39 ? 539 SER A N 1 +ATOM 4220 C CA . SER A 1 519 ? 88.247 80.348 114.547 1.00 7.37 ? 539 SER A CA 1 +ATOM 4221 C C . SER A 1 519 ? 87.001 79.803 113.830 1.00 8.11 ? 539 SER A C 1 +ATOM 4222 O O . SER A 1 519 ? 86.219 79.028 114.425 1.00 8.13 ? 539 SER A O 1 +ATOM 4223 C CB . SER A 1 519 ? 87.854 81.407 115.570 1.00 7.25 ? 539 SER A CB 1 +ATOM 4224 O OG . SER A 1 519 ? 87.712 82.677 114.986 1.00 7.00 ? 539 SER A OG 1 +ATOM 4225 N N . GLU A 1 520 ? 86.815 80.192 112.574 1.00 8.12 ? 540 GLU A N 1 +ATOM 4226 C CA . GLU A 1 520 ? 85.791 79.575 111.719 1.00 7.96 ? 540 GLU A CA 1 +ATOM 4227 C C . GLU A 1 520 ? 86.241 79.531 110.266 1.00 8.06 ? 540 GLU A C 1 +ATOM 4228 O O . GLU A 1 520 ? 86.855 80.481 109.787 1.00 7.54 ? 540 GLU A O 1 +ATOM 4229 C CB . GLU A 1 520 ? 84.474 80.350 111.758 1.00 7.99 ? 540 GLU A CB 1 +ATOM 4230 C CG . GLU A 1 520 ? 83.793 80.432 113.111 1.00 8.35 ? 540 GLU A CG 1 +ATOM 4231 C CD . GLU A 1 520 ? 82.401 81.031 113.051 1.00 8.14 ? 540 GLU A CD 1 +ATOM 4232 O OE1 . GLU A 1 520 ? 81.810 81.158 111.949 1.00 8.00 ? 540 GLU A OE1 1 +ATOM 4233 O OE2 . GLU A 1 520 ? 81.866 81.365 114.119 1.00 9.67 ? 540 GLU A OE2 1 +ATOM 4234 N N . TYR A 1 521 ? 85.920 78.415 109.612 1.00 7.57 ? 541 TYR A N 1 +ATOM 4235 C CA . TYR A 1 521 ? 85.933 78.250 108.159 1.00 7.24 ? 541 TYR A CA 1 +ATOM 4236 C C . TYR A 1 521 ? 85.126 76.976 107.841 1.00 7.21 ? 541 TYR A C 1 +ATOM 4237 O O . TYR A 1 521 ? 84.934 76.120 108.709 1.00 8.21 ? 541 TYR A O 1 +ATOM 4238 C CB . TYR A 1 521 ? 87.358 78.100 107.620 1.00 7.29 ? 541 TYR A CB 1 +ATOM 4239 C CG . TYR A 1 521 ? 88.010 76.758 107.961 1.00 8.15 ? 541 TYR A CG 1 +ATOM 4240 C CD1 . TYR A 1 521 ? 88.576 76.531 109.214 1.00 8.47 ? 541 TYR A CD1 1 +ATOM 4241 C CD2 . TYR A 1 521 ? 88.068 75.721 107.025 1.00 9.22 ? 541 TYR A CD2 1 +ATOM 4242 C CE1 . TYR A 1 521 ? 89.178 75.284 109.531 1.00 8.33 ? 541 TYR A CE1 1 +ATOM 4243 C CE2 . TYR A 1 521 ? 88.653 74.497 107.326 1.00 9.14 ? 541 TYR A CE2 1 +ATOM 4244 C CZ . TYR A 1 521 ? 89.211 74.275 108.581 1.00 8.18 ? 541 TYR A CZ 1 +ATOM 4245 O OH . TYR A 1 521 ? 89.771 73.048 108.881 1.00 8.02 ? 541 TYR A OH 1 +ATOM 4246 N N . GLY A 1 522 ? 84.650 76.865 106.611 1.00 6.67 ? 542 GLY A N 1 +ATOM 4247 C CA . GLY A 1 522 ? 83.942 75.659 106.168 1.00 6.81 ? 542 GLY A CA 1 +ATOM 4248 C C . GLY A 1 522 ? 82.997 75.840 105.008 1.00 6.49 ? 542 GLY A C 1 +ATOM 4249 O O . GLY A 1 522 ? 83.024 76.849 104.323 1.00 5.99 ? 542 GLY A O 1 +ATOM 4250 N N . ALA A 1 523 ? 82.140 74.836 104.803 1.00 6.52 ? 543 ALA A N 1 +ATOM 4251 C CA . ALA A 1 523 ? 81.240 74.836 103.668 1.00 6.67 ? 543 ALA A CA 1 +ATOM 4252 C C . ALA A 1 523 ? 79.946 74.112 104.027 1.00 6.58 ? 543 ALA A C 1 +ATOM 4253 O O . ALA A 1 523 ? 79.970 73.076 104.696 1.00 7.33 ? 543 ALA A O 1 +ATOM 4254 C CB . ALA A 1 523 ? 81.904 74.183 102.464 1.00 7.71 ? 543 ALA A CB 1 +ATOM 4255 N N . GLU A 1 524 ? 78.814 74.653 103.590 1.00 6.60 ? 544 GLU A N 1 +ATOM 4256 C CA . GLU A 1 524 ? 77.561 73.936 103.796 1.00 6.76 ? 544 GLU A CA 1 +ATOM 4257 C C . GLU A 1 524 ? 77.662 72.680 102.936 1.00 6.45 ? 544 GLU A C 1 +ATOM 4258 O O . GLU A 1 524 ? 78.052 72.754 101.773 1.00 7.00 ? 544 GLU A O 1 +ATOM 4259 C CB . GLU A 1 524 ? 76.324 74.727 103.375 1.00 5.91 ? 544 GLU A CB 1 +ATOM 4260 C CG . GLU A 1 524 ? 76.116 76.062 104.054 1.00 7.65 ? 544 GLU A CG 1 +ATOM 4261 C CD . GLU A 1 524 ? 75.453 75.967 105.414 1.00 9.33 ? 544 GLU A CD 1 +ATOM 4262 O OE1 . GLU A 1 524 ? 74.618 75.054 105.587 1.00 8.41 ? 544 GLU A OE1 1 +ATOM 4263 O OE2 . GLU A 1 524 ? 75.729 76.853 106.276 1.00 10.30 ? 544 GLU A OE2 1 +ATOM 4264 N N . THR A 1 525 ? 77.289 71.545 103.501 1.00 6.80 ? 545 THR A N 1 +ATOM 4265 C CA . THR A 1 525 ? 77.497 70.240 102.856 1.00 7.00 ? 545 THR A CA 1 +ATOM 4266 C C . THR A 1 525 ? 76.343 69.298 103.145 1.00 6.99 ? 545 THR A C 1 +ATOM 4267 O O . THR A 1 525 ? 76.140 68.908 104.287 1.00 7.07 ? 545 THR A O 1 +ATOM 4268 C CB . THR A 1 525 ? 78.798 69.601 103.371 1.00 7.02 ? 545 THR A CB 1 +ATOM 4269 O OG1 . THR A 1 525 ? 79.881 70.522 103.174 1.00 7.00 ? 545 THR A OG1 1 +ATOM 4270 C CG2 . THR A 1 525 ? 79.128 68.245 102.664 1.00 6.53 ? 545 THR A CG2 1 +ATOM 4271 N N . ILE A 1 526 ? 75.589 68.948 102.107 1.00 7.24 ? 546 ILE A N 1 +ATOM 4272 C CA . ILE A 1 526 ? 74.509 67.968 102.215 1.00 7.40 ? 546 ILE A CA 1 +ATOM 4273 C C . ILE A 1 526 ? 75.050 66.560 102.010 1.00 7.04 ? 546 ILE A C 1 +ATOM 4274 O O . ILE A 1 526 ? 75.500 66.206 100.922 1.00 6.76 ? 546 ILE A O 1 +ATOM 4275 C CB . ILE A 1 526 ? 73.405 68.241 101.181 1.00 7.52 ? 546 ILE A CB 1 +ATOM 4276 C CG1 . ILE A 1 526 ? 72.983 69.732 101.183 1.00 8.09 ? 546 ILE A CG1 1 +ATOM 4277 C CG2 . ILE A 1 526 ? 72.221 67.345 101.419 1.00 8.55 ? 546 ILE A CG2 1 +ATOM 4278 C CD1 . ILE A 1 526 ? 72.564 70.255 102.562 1.00 8.00 ? 546 ILE A CD1 1 +ATOM 4279 N N . ALA A 1 527 ? 75.027 65.753 103.060 1.00 7.45 ? 547 ALA A N 1 +ATOM 4280 C CA . ALA A 1 527 ? 75.524 64.379 102.955 1.00 7.76 ? 547 ALA A CA 1 +ATOM 4281 C C . ALA A 1 527 ? 74.877 63.668 101.763 1.00 7.17 ? 547 ALA A C 1 +ATOM 4282 O O . ALA A 1 527 ? 73.667 63.719 101.586 1.00 7.34 ? 547 ALA A O 1 +ATOM 4283 C CB . ALA A 1 527 ? 75.269 63.600 104.259 1.00 8.18 ? 547 ALA A CB 1 +ATOM 4284 N N . GLY A 1 528 ? 75.694 63.036 100.923 1.00 7.67 ? 548 GLY A N 1 +ATOM 4285 C CA . GLY A 1 528 ? 75.211 62.350 99.719 1.00 7.96 ? 548 GLY A CA 1 +ATOM 4286 C C . GLY A 1 528 ? 75.328 63.112 98.411 1.00 7.88 ? 548 GLY A C 1 +ATOM 4287 O O . GLY A 1 528 ? 75.244 62.533 97.341 1.00 8.53 ? 548 GLY A O 1 +ATOM 4288 N N . PHE A 1 529 ? 75.525 64.421 98.475 1.00 7.62 ? 549 PHE A N 1 +ATOM 4289 C CA . PHE A 1 529 ? 75.648 65.210 97.267 1.00 7.71 ? 549 PHE A CA 1 +ATOM 4290 C C . PHE A 1 529 ? 77.090 65.098 96.816 1.00 7.55 ? 549 PHE A C 1 +ATOM 4291 O O . PHE A 1 529 ? 78.004 65.387 97.588 1.00 7.62 ? 549 PHE A O 1 +ATOM 4292 C CB . PHE A 1 529 ? 75.275 66.666 97.556 1.00 8.01 ? 549 PHE A CB 1 +ATOM 4293 C CG . PHE A 1 529 ? 73.782 66.958 97.496 1.00 8.81 ? 549 PHE A CG 1 +ATOM 4294 C CD1 . PHE A 1 529 ? 72.865 66.134 98.098 1.00 11.41 ? 549 PHE A CD1 1 +ATOM 4295 C CD2 . PHE A 1 529 ? 73.329 68.116 96.871 1.00 10.55 ? 549 PHE A CD2 1 +ATOM 4296 C CE1 . PHE A 1 529 ? 71.500 66.420 98.043 1.00 11.79 ? 549 PHE A CE1 1 +ATOM 4297 C CE2 . PHE A 1 529 ? 71.961 68.406 96.816 1.00 12.52 ? 549 PHE A CE2 1 +ATOM 4298 C CZ . PHE A 1 529 ? 71.061 67.555 97.397 1.00 10.99 ? 549 PHE A CZ 1 +ATOM 4299 N N . HIS A 1 530 ? 77.278 64.653 95.574 1.00 7.87 ? 550 HIS A N 1 +ATOM 4300 C CA . HIS A 1 530 ? 78.602 64.404 95.002 1.00 7.16 ? 550 HIS A CA 1 +ATOM 4301 C C . HIS A 1 530 ? 78.743 65.038 93.629 1.00 7.21 ? 550 HIS A C 1 +ATOM 4302 O O . HIS A 1 530 ? 77.810 64.998 92.842 1.00 7.50 ? 550 HIS A O 1 +ATOM 4303 C CB . HIS A 1 530 ? 78.828 62.908 94.814 1.00 7.83 ? 550 HIS A CB 1 +ATOM 4304 C CG . HIS A 1 530 ? 78.986 62.146 96.095 1.00 7.30 ? 550 HIS A CG 1 +ATOM 4305 N ND1 . HIS A 1 530 ? 80.168 62.112 96.804 1.00 9.03 ? 550 HIS A ND1 1 +ATOM 4306 C CD2 . HIS A 1 530 ? 78.109 61.387 96.789 1.00 9.42 ? 550 HIS A CD2 1 +ATOM 4307 C CE1 . HIS A 1 530 ? 80.012 61.359 97.879 1.00 7.57 ? 550 HIS A CE1 1 +ATOM 4308 N NE2 . HIS A 1 530 ? 78.770 60.905 97.892 1.00 7.94 ? 550 HIS A NE2 1 +ATOM 4309 N N . GLN A 1 531 ? 79.911 65.609 93.340 1.00 7.23 ? 551 GLN A N 1 +ATOM 4310 C CA . GLN A 1 531 ? 80.225 66.067 91.987 1.00 7.76 ? 551 GLN A CA 1 +ATOM 4311 C C . GLN A 1 531 ? 81.724 66.236 91.801 1.00 7.67 ? 551 GLN A C 1 +ATOM 4312 O O . GLN A 1 531 ? 82.427 66.647 92.721 1.00 8.32 ? 551 GLN A O 1 +ATOM 4313 C CB . GLN A 1 531 ? 79.479 67.348 91.597 1.00 7.99 ? 551 GLN A CB 1 +ATOM 4314 C CG . GLN A 1 531 ? 79.691 67.742 90.112 1.00 9.83 ? 551 GLN A CG 1 +ATOM 4315 C CD . GLN A 1 531 ? 78.455 68.272 89.404 1.00 12.04 ? 551 GLN A CD 1 +ATOM 4316 O OE1 . GLN A 1 531 ? 77.323 68.013 89.803 1.00 14.23 ? 551 GLN A OE1 1 +ATOM 4317 N NE2 . GLN A 1 531 ? 78.678 69.006 88.315 1.00 13.95 ? 551 GLN A NE2 1 +ATOM 4318 N N . ASP A 1 532 ? 82.203 65.828 90.630 1.00 7.98 ? 552 ASP A N 1 +ATOM 4319 C CA . ASP A 1 532 ? 83.537 66.182 90.152 1.00 8.53 ? 552 ASP A CA 1 +ATOM 4320 C C . ASP A 1 532 ? 83.385 66.798 88.780 1.00 8.50 ? 552 ASP A C 1 +ATOM 4321 O O . ASP A 1 532 ? 82.659 66.260 87.949 1.00 8.58 ? 552 ASP A O 1 +ATOM 4322 C CB . ASP A 1 532 ? 84.449 64.965 90.026 1.00 8.17 ? 552 ASP A CB 1 +ATOM 4323 C CG . ASP A 1 532 ? 85.862 65.366 89.677 1.00 9.45 ? 552 ASP A CG 1 +ATOM 4324 O OD1 . ASP A 1 532 ? 86.524 65.901 90.577 1.00 11.61 ? 552 ASP A OD1 1 +ATOM 4325 O OD2 . ASP A 1 532 ? 86.285 65.214 88.503 1.00 12.34 ? 552 ASP A OD2 1 +ATOM 4326 N N . PRO A 1 533 ? 84.044 67.945 88.535 1.00 8.76 ? 553 PRO A N 1 +ATOM 4327 C CA . PRO A 1 533 ? 84.712 68.787 89.528 1.00 8.65 ? 553 PRO A CA 1 +ATOM 4328 C C . PRO A 1 533 ? 83.726 69.255 90.598 1.00 8.16 ? 553 PRO A C 1 +ATOM 4329 O O . PRO A 1 533 ? 82.511 69.238 90.363 1.00 7.90 ? 553 PRO A O 1 +ATOM 4330 C CB . PRO A 1 533 ? 85.255 69.959 88.697 1.00 8.41 ? 553 PRO A CB 1 +ATOM 4331 C CG . PRO A 1 533 ? 85.311 69.419 87.276 1.00 8.97 ? 553 PRO A CG 1 +ATOM 4332 C CD . PRO A 1 533 ? 84.161 68.484 87.172 1.00 9.47 ? 553 PRO A CD 1 +ATOM 4333 N N . PRO A 1 534 ? 84.230 69.643 91.782 1.00 8.93 ? 554 PRO A N 1 +ATOM 4334 C CA . PRO A 1 534 ? 83.335 69.913 92.895 1.00 8.45 ? 554 PRO A CA 1 +ATOM 4335 C C . PRO A 1 534 ? 82.518 71.192 92.764 1.00 8.56 ? 554 PRO A C 1 +ATOM 4336 O O . PRO A 1 534 ? 83.004 72.204 92.257 1.00 8.73 ? 554 PRO A O 1 +ATOM 4337 C CB . PRO A 1 534 ? 84.279 69.996 94.100 1.00 8.85 ? 554 PRO A CB 1 +ATOM 4338 C CG . PRO A 1 534 ? 85.576 70.415 93.544 1.00 9.47 ? 554 PRO A CG 1 +ATOM 4339 C CD . PRO A 1 534 ? 85.644 69.814 92.161 1.00 9.08 ? 554 PRO A CD 1 +ATOM 4340 N N . LEU A 1 535 ? 81.288 71.137 93.270 1.00 8.43 ? 555 LEU A N 1 +ATOM 4341 C CA . LEU A 1 535 ? 80.412 72.304 93.350 1.00 8.22 ? 555 LEU A CA 1 +ATOM 4342 C C . LEU A 1 535 ? 79.955 72.483 94.791 1.00 7.93 ? 555 LEU A C 1 +ATOM 4343 O O . LEU A 1 535 ? 79.836 71.513 95.534 1.00 7.72 ? 555 LEU A O 1 +ATOM 4344 C CB . LEU A 1 535 ? 79.186 72.104 92.447 1.00 8.82 ? 555 LEU A CB 1 +ATOM 4345 C CG . LEU A 1 535 ? 79.485 72.043 90.950 1.00 8.94 ? 555 LEU A CG 1 +ATOM 4346 C CD1 . LEU A 1 535 ? 78.247 71.611 90.186 1.00 10.31 ? 555 LEU A CD1 1 +ATOM 4347 C CD2 . LEU A 1 535 ? 80.001 73.377 90.469 1.00 12.67 ? 555 LEU A CD2 1 +ATOM 4348 N N . MET A 1 536 ? 79.663 73.722 95.173 1.00 7.64 ? 556 MET A N 1 +ATOM 4349 C CA . MET A 1 536 ? 79.135 74.012 96.506 1.00 7.54 ? 556 MET A CA 1 +ATOM 4350 C C . MET A 1 536 ? 78.034 73.037 96.919 1.00 6.29 ? 556 MET A C 1 +ATOM 4351 O O . MET A 1 536 ? 77.192 72.686 96.106 1.00 5.10 ? 556 MET A O 1 +ATOM 4352 C CB . MET A 1 536 ? 78.584 75.437 96.561 1.00 7.42 ? 556 MET A CB 1 +ATOM 4353 C CG . MET A 1 536 ? 79.648 76.507 96.555 1.00 8.22 ? 556 MET A CG 1 +ATOM 4354 S SD . MET A 1 536 ? 78.978 78.197 96.358 1.00 9.42 ? 556 MET A SD 1 +ATOM 4355 C CE . MET A 1 536 ? 78.233 78.539 97.966 1.00 9.05 ? 556 MET A CE 1 +ATOM 4356 N N . PHE A 1 537 ? 78.048 72.667 98.200 1.00 6.32 ? 557 PHE A N 1 +ATOM 4357 C CA . PHE A 1 537 ? 77.081 71.776 98.865 1.00 5.76 ? 557 PHE A CA 1 +ATOM 4358 C C . PHE A 1 537 ? 77.430 70.289 98.727 1.00 6.49 ? 557 PHE A C 1 +ATOM 4359 O O . PHE A 1 537 ? 76.817 69.465 99.403 1.00 7.14 ? 557 PHE A O 1 +ATOM 4360 C CB . PHE A 1 537 ? 75.633 71.989 98.414 1.00 6.01 ? 557 PHE A CB 1 +ATOM 4361 C CG . PHE A 1 537 ? 75.048 73.313 98.851 1.00 5.33 ? 557 PHE A CG 1 +ATOM 4362 C CD1 . PHE A 1 537 ? 74.530 73.467 100.142 1.00 5.52 ? 557 PHE A CD1 1 +ATOM 4363 C CD2 . PHE A 1 537 ? 75.038 74.395 97.985 1.00 5.24 ? 557 PHE A CD2 1 +ATOM 4364 C CE1 . PHE A 1 537 ? 73.986 74.666 100.551 1.00 7.35 ? 557 PHE A CE1 1 +ATOM 4365 C CE2 . PHE A 1 537 ? 74.506 75.629 98.393 1.00 6.11 ? 557 PHE A CE2 1 +ATOM 4366 C CZ . PHE A 1 537 ? 73.972 75.762 99.681 1.00 6.67 ? 557 PHE A CZ 1 +ATOM 4367 N N . THR A 1 538 ? 78.399 69.955 97.871 1.00 6.33 ? 558 THR A N 1 +ATOM 4368 C CA . THR A 1 538 ? 78.841 68.565 97.728 1.00 6.60 ? 558 THR A CA 1 +ATOM 4369 C C . THR A 1 538 ? 79.904 68.251 98.777 1.00 6.94 ? 558 THR A C 1 +ATOM 4370 O O . THR A 1 538 ? 80.576 69.149 99.309 1.00 7.56 ? 558 THR A O 1 +ATOM 4371 C CB . THR A 1 538 ? 79.422 68.246 96.319 1.00 6.29 ? 558 THR A CB 1 +ATOM 4372 O OG1 . THR A 1 538 ? 80.614 68.994 96.080 1.00 5.12 ? 558 THR A OG1 1 +ATOM 4373 C CG2 . THR A 1 538 ? 78.401 68.545 95.227 1.00 5.26 ? 558 THR A CG2 1 +ATOM 4374 N N . GLU A 1 539 ? 80.063 66.967 99.071 1.00 7.59 ? 559 GLU A N 1 +ATOM 4375 C CA . GLU A 1 539 ? 81.078 66.524 100.017 1.00 7.60 ? 559 GLU A CA 1 +ATOM 4376 C C . GLU A 1 539 ? 82.480 66.816 99.468 1.00 7.43 ? 559 GLU A C 1 +ATOM 4377 O O . GLU A 1 539 ? 83.396 67.132 100.218 1.00 6.90 ? 559 GLU A O 1 +ATOM 4378 C CB . GLU A 1 539 ? 80.907 65.036 100.327 1.00 8.04 ? 559 GLU A CB 1 +ATOM 4379 C CG . GLU A 1 539 ? 79.519 64.699 100.923 1.00 8.47 ? 559 GLU A CG 1 +ATOM 4380 C CD . GLU A 1 539 ? 79.477 63.395 101.683 1.00 9.30 ? 559 GLU A CD 1 +ATOM 4381 O OE1 . GLU A 1 539 ? 80.547 62.932 102.137 1.00 14.11 ? 559 GLU A OE1 1 +ATOM 4382 O OE2 . GLU A 1 539 ? 78.368 62.834 101.827 1.00 6.98 ? 559 GLU A OE2 1 +ATOM 4383 N N . GLU A 1 540 ? 82.616 66.749 98.150 1.00 7.76 ? 560 GLU A N 1 +ATOM 4384 C CA . GLU A 1 540 ? 83.898 67.014 97.475 1.00 7.99 ? 560 GLU A CA 1 +ATOM 4385 C C . GLU A 1 540 ? 84.299 68.477 97.596 1.00 8.38 ? 560 GLU A C 1 +ATOM 4386 O O . GLU A 1 540 ? 85.487 68.795 97.773 1.00 8.77 ? 560 GLU A O 1 +ATOM 4387 C CB . GLU A 1 540 ? 83.834 66.649 95.999 1.00 8.19 ? 560 GLU A CB 1 +ATOM 4388 C CG . GLU A 1 540 ? 83.760 65.166 95.706 1.00 8.41 ? 560 GLU A CG 1 +ATOM 4389 C CD . GLU A 1 540 ? 82.451 64.554 96.118 1.00 8.02 ? 560 GLU A CD 1 +ATOM 4390 O OE1 . GLU A 1 540 ? 81.419 65.231 95.979 1.00 8.06 ? 560 GLU A OE1 1 +ATOM 4391 O OE2 . GLU A 1 540 ? 82.474 63.403 96.584 1.00 9.54 ? 560 GLU A OE2 1 +ATOM 4392 N N . TYR A 1 541 ? 83.317 69.371 97.521 1.00 8.39 ? 561 TYR A N 1 +ATOM 4393 C CA . TYR A 1 541 ? 83.601 70.798 97.737 1.00 7.76 ? 561 TYR A CA 1 +ATOM 4394 C C . TYR A 1 541 ? 84.050 71.034 99.165 1.00 7.98 ? 561 TYR A C 1 +ATOM 4395 O O . TYR A 1 541 ? 84.990 71.766 99.378 1.00 8.23 ? 561 TYR A O 1 +ATOM 4396 C CB . TYR A 1 541 ? 82.404 71.683 97.417 1.00 7.65 ? 561 TYR A CB 1 +ATOM 4397 C CG . TYR A 1 541 ? 82.766 73.151 97.248 1.00 7.22 ? 561 TYR A CG 1 +ATOM 4398 C CD1 . TYR A 1 541 ? 82.801 74.026 98.337 1.00 8.27 ? 561 TYR A CD1 1 +ATOM 4399 C CD2 . TYR A 1 541 ? 83.075 73.652 95.989 1.00 6.30 ? 561 TYR A CD2 1 +ATOM 4400 C CE1 . TYR A 1 541 ? 83.113 75.384 98.170 1.00 7.41 ? 561 TYR A CE1 1 +ATOM 4401 C CE2 . TYR A 1 541 ? 83.403 74.992 95.809 1.00 5.44 ? 561 TYR A CE2 1 +ATOM 4402 C CZ . TYR A 1 541 ? 83.441 75.847 96.904 1.00 7.20 ? 561 TYR A CZ 1 +ATOM 4403 O OH . TYR A 1 541 ? 83.748 77.161 96.679 1.00 8.51 ? 561 TYR A OH 1 +ATOM 4404 N N . GLN A 1 542 ? 83.383 70.419 100.141 1.00 7.57 ? 562 GLN A N 1 +ATOM 4405 C CA . GLN A 1 542 ? 83.804 70.556 101.534 1.00 7.65 ? 562 GLN A CA 1 +ATOM 4406 C C . GLN A 1 542 ? 85.251 70.104 101.682 1.00 7.99 ? 562 GLN A C 1 +ATOM 4407 O O . GLN A 1 542 ? 86.053 70.783 102.297 1.00 8.31 ? 562 GLN A O 1 +ATOM 4408 C CB . GLN A 1 542 ? 82.929 69.739 102.480 1.00 7.62 ? 562 GLN A CB 1 +ATOM 4409 C CG . GLN A 1 542 ? 83.184 70.050 103.967 1.00 7.43 ? 562 GLN A CG 1 +ATOM 4410 C CD . GLN A 1 542 ? 82.227 69.304 104.895 1.00 6.50 ? 562 GLN A CD 1 +ATOM 4411 O OE1 . GLN A 1 542 ? 81.782 68.199 104.581 1.00 6.95 ? 562 GLN A OE1 1 +ATOM 4412 N NE2 . GLN A 1 542 ? 81.929 69.894 106.041 1.00 7.74 ? 562 GLN A NE2 1 +ATOM 4413 N N . LYS A 1 543 ? 85.562 68.942 101.117 1.00 8.64 ? 563 LYS A N 1 +ATOM 4414 C CA . LYS A 1 543 ? 86.926 68.416 101.164 1.00 9.51 ? 563 LYS A CA 1 +ATOM 4415 C C . LYS A 1 543 ? 87.925 69.400 100.549 1.00 9.47 ? 563 LYS A C 1 +ATOM 4416 O O . LYS A 1 543 ? 88.965 69.713 101.154 1.00 9.15 ? 563 LYS A O 1 +ATOM 4417 C CB . LYS A 1 543 ? 86.985 67.037 100.479 1.00 9.41 ? 563 LYS A CB 1 +ATOM 4418 C CG . LYS A 1 543 ? 86.276 65.934 101.287 1.00 11.69 ? 563 LYS A CG 1 +ATOM 4419 C CD . LYS A 1 543 ? 86.137 64.612 100.516 1.00 13.02 ? 563 LYS A CD 1 +ATOM 4420 C CE . LYS A 1 543 ? 87.383 63.788 100.592 1.00 16.56 ? 563 LYS A CE 1 +ATOM 4421 N NZ . LYS A 1 543 ? 88.455 64.298 99.725 1.00 19.27 ? 563 LYS A NZ 1 +ATOM 4422 N N . SER A 1 544 ? 87.611 69.915 99.363 1.00 9.01 ? 564 SER A N 1 +ATOM 4423 C CA A SER A 1 544 ? 88.525 70.800 98.639 0.50 8.73 ? 564 SER A CA 1 +ATOM 4424 C CA B SER A 1 544 ? 88.524 70.804 98.637 0.50 8.77 ? 564 SER A CA 1 +ATOM 4425 C C . SER A 1 544 ? 88.715 72.129 99.363 1.00 8.43 ? 564 SER A C 1 +ATOM 4426 O O . SER A 1 544 ? 89.844 72.616 99.499 1.00 8.67 ? 564 SER A O 1 +ATOM 4427 C CB A SER A 1 544 ? 88.028 71.045 97.211 0.50 8.66 ? 564 SER A CB 1 +ATOM 4428 C CB B SER A 1 544 ? 88.027 71.058 97.207 0.50 8.71 ? 564 SER A CB 1 +ATOM 4429 O OG A SER A 1 544 ? 89.067 71.553 96.398 0.50 9.04 ? 564 SER A OG 1 +ATOM 4430 O OG B SER A 1 544 ? 88.031 69.862 96.444 0.50 9.33 ? 564 SER A OG 1 +ATOM 4431 N N . LEU A 1 545 ? 87.622 72.716 99.843 1.00 7.75 ? 565 LEU A N 1 +ATOM 4432 C CA . LEU A 1 545 ? 87.716 73.973 100.603 1.00 7.11 ? 565 LEU A CA 1 +ATOM 4433 C C . LEU A 1 545 ? 88.611 73.766 101.826 1.00 7.73 ? 565 LEU A C 1 +ATOM 4434 O O . LEU A 1 545 ? 89.496 74.607 102.109 1.00 7.44 ? 565 LEU A O 1 +ATOM 4435 C CB . LEU A 1 545 ? 86.320 74.472 101.008 1.00 7.21 ? 565 LEU A CB 1 +ATOM 4436 C CG . LEU A 1 545 ? 86.308 75.845 101.689 1.00 6.70 ? 565 LEU A CG 1 +ATOM 4437 C CD1 . LEU A 1 545 ? 85.106 76.681 101.274 1.00 7.36 ? 565 LEU A CD1 1 +ATOM 4438 C CD2 . LEU A 1 545 ? 86.403 75.750 103.207 1.00 7.07 ? 565 LEU A CD2 1 +ATOM 4439 N N . LEU A 1 546 ? 88.425 72.631 102.520 1.00 8.18 ? 566 LEU A N 1 +ATOM 4440 C CA . LEU A 1 546 ? 89.246 72.303 103.711 1.00 8.64 ? 566 LEU A CA 1 +ATOM 4441 C C . LEU A 1 546 ? 90.725 72.179 103.324 1.00 9.12 ? 566 LEU A C 1 +ATOM 4442 O O . LEU A 1 546 ? 91.606 72.785 103.967 1.00 8.69 ? 566 LEU A O 1 +ATOM 4443 C CB . LEU A 1 546 ? 88.773 71.025 104.426 1.00 8.98 ? 566 LEU A CB 1 +ATOM 4444 C CG . LEU A 1 546 ? 87.787 71.195 105.589 1.00 7.80 ? 566 LEU A CG 1 +ATOM 4445 C CD1 . LEU A 1 546 ? 86.586 72.064 105.182 1.00 9.51 ? 566 LEU A CD1 1 +ATOM 4446 C CD2 . LEU A 1 546 ? 87.323 69.840 106.149 1.00 9.00 ? 566 LEU A CD2 1 +ATOM 4447 N N . GLU A 1 547 ? 90.988 71.429 102.261 1.00 9.51 ? 567 GLU A N 1 +ATOM 4448 C CA . GLU A 1 547 ? 92.357 71.238 101.759 1.00 10.98 ? 567 GLU A CA 1 +ATOM 4449 C C . GLU A 1 547 ? 93.054 72.570 101.486 1.00 10.76 ? 567 GLU A C 1 +ATOM 4450 O O . GLU A 1 547 ? 94.217 72.756 101.850 1.00 10.66 ? 567 GLU A O 1 +ATOM 4451 C CB . GLU A 1 547 ? 92.338 70.401 100.484 1.00 10.99 ? 567 GLU A CB 1 +ATOM 4452 C CG . GLU A 1 547 ? 92.133 68.903 100.722 1.00 13.24 ? 567 GLU A CG 1 +ATOM 4453 C CD . GLU A 1 547 ? 91.944 68.116 99.427 1.00 13.95 ? 567 GLU A CD 1 +ATOM 4454 O OE1 . GLU A 1 547 ? 91.842 68.739 98.345 1.00 18.32 ? 567 GLU A OE1 1 +ATOM 4455 O OE2 . GLU A 1 547 ? 91.901 66.869 99.499 1.00 19.35 ? 567 GLU A OE2 1 +ATOM 4456 N N . GLN A 1 548 ? 92.352 73.485 100.830 1.00 10.37 ? 568 GLN A N 1 +ATOM 4457 C CA . GLN A 1 548 ? 92.923 74.797 100.497 1.00 10.04 ? 568 GLN A CA 1 +ATOM 4458 C C . GLN A 1 548 ? 93.172 75.637 101.751 1.00 9.81 ? 568 GLN A C 1 +ATOM 4459 O O . GLN A 1 548 ? 94.215 76.269 101.873 1.00 9.51 ? 568 GLN A O 1 +ATOM 4460 C CB . GLN A 1 548 ? 92.018 75.556 99.506 1.00 10.08 ? 568 GLN A CB 1 +ATOM 4461 C CG . GLN A 1 548 ? 92.000 74.940 98.097 1.00 9.81 ? 568 GLN A CG 1 +ATOM 4462 C CD . GLN A 1 548 ? 93.400 74.782 97.497 1.00 10.96 ? 568 GLN A CD 1 +ATOM 4463 O OE1 . GLN A 1 548 ? 94.118 75.769 97.271 1.00 11.50 ? 568 GLN A OE1 1 +ATOM 4464 N NE2 . GLN A 1 548 ? 93.785 73.543 97.240 1.00 13.12 ? 568 GLN A NE2 1 +ATOM 4465 N N . TYR A 1 549 ? 92.215 75.638 102.683 1.00 9.82 ? 569 TYR A N 1 +ATOM 4466 C CA . TYR A 1 549 ? 92.413 76.309 103.978 1.00 10.16 ? 569 TYR A CA 1 +ATOM 4467 C C . TYR A 1 549 ? 93.632 75.735 104.702 1.00 10.03 ? 569 TYR A C 1 +ATOM 4468 O O . TYR A 1 549 ? 94.458 76.483 105.249 1.00 10.59 ? 569 TYR A O 1 +ATOM 4469 C CB . TYR A 1 549 ? 91.152 76.246 104.866 1.00 10.75 ? 569 TYR A CB 1 +ATOM 4470 C CG . TYR A 1 549 ? 90.321 77.517 104.776 1.00 9.58 ? 569 TYR A CG 1 +ATOM 4471 C CD1 . TYR A 1 549 ? 89.401 77.710 103.746 1.00 11.45 ? 569 TYR A CD1 1 +ATOM 4472 C CD2 . TYR A 1 549 ? 90.477 78.536 105.704 1.00 11.58 ? 569 TYR A CD2 1 +ATOM 4473 C CE1 . TYR A 1 549 ? 88.660 78.882 103.656 1.00 11.19 ? 569 TYR A CE1 1 +ATOM 4474 C CE2 . TYR A 1 549 ? 89.740 79.717 105.620 1.00 11.76 ? 569 TYR A CE2 1 +ATOM 4475 C CZ . TYR A 1 549 ? 88.828 79.880 104.593 1.00 12.09 ? 569 TYR A CZ 1 +ATOM 4476 O OH . TYR A 1 549 ? 88.109 81.062 104.504 1.00 10.91 ? 569 TYR A OH 1 +ATOM 4477 N N . HIS A 1 550 ? 93.748 74.415 104.692 1.00 9.66 ? 570 HIS A N 1 +ATOM 4478 C CA . HIS A 1 550 ? 94.835 73.724 105.388 1.00 9.45 ? 570 HIS A CA 1 +ATOM 4479 C C . HIS A 1 550 ? 96.187 74.125 104.815 1.00 9.78 ? 570 HIS A C 1 +ATOM 4480 O O . HIS A 1 550 ? 97.133 74.366 105.565 1.00 9.79 ? 570 HIS A O 1 +ATOM 4481 C CB . HIS A 1 550 ? 94.628 72.205 105.308 1.00 9.62 ? 570 HIS A CB 1 +ATOM 4482 C CG . HIS A 1 550 ? 93.382 71.740 105.999 1.00 9.69 ? 570 HIS A CG 1 +ATOM 4483 N ND1 . HIS A 1 550 ? 92.840 70.486 105.806 1.00 10.76 ? 570 HIS A ND1 1 +ATOM 4484 C CD2 . HIS A 1 550 ? 92.577 72.366 106.887 1.00 10.05 ? 570 HIS A CD2 1 +ATOM 4485 C CE1 . HIS A 1 550 ? 91.758 70.361 106.557 1.00 10.59 ? 570 HIS A CE1 1 +ATOM 4486 N NE2 . HIS A 1 550 ? 91.563 71.497 107.203 1.00 9.70 ? 570 HIS A NE2 1 +ATOM 4487 N N . LEU A 1 551 ? 96.259 74.241 103.497 1.00 9.35 ? 571 LEU A N 1 +ATOM 4488 C CA . LEU A 1 551 ? 97.493 74.675 102.830 1.00 9.72 ? 571 LEU A CA 1 +ATOM 4489 C C . LEU A 1 551 ? 97.860 76.126 103.203 1.00 9.98 ? 571 LEU A C 1 +ATOM 4490 O O . LEU A 1 551 ? 99.032 76.431 103.454 1.00 10.53 ? 571 LEU A O 1 +ATOM 4491 C CB . LEU A 1 551 ? 97.358 74.501 101.320 1.00 9.94 ? 571 LEU A CB 1 +ATOM 4492 C CG . LEU A 1 551 ? 97.399 73.031 100.884 1.00 10.50 ? 571 LEU A CG 1 +ATOM 4493 C CD1 . LEU A 1 551 ? 96.811 72.834 99.480 1.00 11.45 ? 571 LEU A CD1 1 +ATOM 4494 C CD2 . LEU A 1 551 ? 98.820 72.503 100.956 1.00 11.88 ? 571 LEU A CD2 1 +ATOM 4495 N N . GLY A 1 552 ? 96.861 77.001 103.282 1.00 10.18 ? 572 GLY A N 1 +ATOM 4496 C CA . GLY A 1 552 ? 97.078 78.360 103.771 1.00 10.59 ? 572 GLY A CA 1 +ATOM 4497 C C . GLY A 1 552 ? 97.534 78.358 105.220 1.00 11.18 ? 572 GLY A C 1 +ATOM 4498 O O . GLY A 1 552 ? 98.433 79.113 105.614 1.00 11.37 ? 572 GLY A O 1 +ATOM 4499 N N . LEU A 1 553 ? 96.903 77.512 106.026 1.00 10.46 ? 573 LEU A N 1 +ATOM 4500 C CA . LEU A 1 553 ? 97.217 77.457 107.446 1.00 10.99 ? 573 LEU A CA 1 +ATOM 4501 C C . LEU A 1 553 ? 98.649 76.991 107.654 1.00 11.46 ? 573 LEU A C 1 +ATOM 4502 O O . LEU A 1 553 ? 99.365 77.534 108.491 1.00 11.39 ? 573 LEU A O 1 +ATOM 4503 C CB . LEU A 1 553 ? 96.231 76.564 108.195 1.00 11.02 ? 573 LEU A CB 1 +ATOM 4504 C CG . LEU A 1 553 ? 94.852 77.213 108.370 1.00 10.28 ? 573 LEU A CG 1 +ATOM 4505 C CD1 . LEU A 1 553 ? 93.819 76.135 108.686 1.00 9.63 ? 573 LEU A CD1 1 +ATOM 4506 C CD2 . LEU A 1 553 ? 94.855 78.325 109.451 1.00 10.31 ? 573 LEU A CD2 1 +ATOM 4507 N N . ASP A 1 554 ? 99.060 75.997 106.878 1.00 11.76 ? 574 ASP A N 1 +ATOM 4508 C CA . ASP A 1 554 ? 100.426 75.453 106.972 1.00 12.30 ? 574 ASP A CA 1 +ATOM 4509 C C . ASP A 1 554 ? 101.508 76.521 106.792 1.00 13.18 ? 574 ASP A C 1 +ATOM 4510 O O . ASP A 1 554 ? 102.593 76.411 107.386 1.00 13.03 ? 574 ASP A O 1 +ATOM 4511 C CB . ASP A 1 554 ? 100.626 74.361 105.934 1.00 12.31 ? 574 ASP A CB 1 +ATOM 4512 C CG . ASP A 1 554 ? 99.841 73.111 106.241 1.00 12.81 ? 574 ASP A CG 1 +ATOM 4513 O OD1 . ASP A 1 554 ? 99.273 73.015 107.354 1.00 11.31 ? 574 ASP A OD1 1 +ATOM 4514 O OD2 . ASP A 1 554 ? 99.799 72.225 105.369 1.00 12.93 ? 574 ASP A OD2 1 +ATOM 4515 N N . GLN A 1 555 ? 101.227 77.541 105.979 1.00 13.96 ? 575 GLN A N 1 +ATOM 4516 C CA . GLN A 1 555 ? 102.221 78.599 105.715 1.00 15.01 ? 575 GLN A CA 1 +ATOM 4517 C C . GLN A 1 555 ? 102.484 79.559 106.894 1.00 15.54 ? 575 GLN A C 1 +ATOM 4518 O O . GLN A 1 555 ? 103.481 80.285 106.872 1.00 15.17 ? 575 GLN A O 1 +ATOM 4519 C CB . GLN A 1 555 ? 101.839 79.406 104.470 1.00 15.18 ? 575 GLN A CB 1 +ATOM 4520 C CG . GLN A 1 555 ? 101.863 78.606 103.164 1.00 16.61 ? 575 GLN A CG 1 +ATOM 4521 C CD . GLN A 1 555 ? 103.237 78.074 102.811 1.00 18.56 ? 575 GLN A CD 1 +ATOM 4522 O OE1 . GLN A 1 555 ? 103.403 76.890 102.519 1.00 21.54 ? 575 GLN A OE1 1 +ATOM 4523 N NE2 . GLN A 1 555 ? 104.232 78.937 102.863 1.00 19.82 ? 575 GLN A NE2 1 +ATOM 4524 N N . LYS A 1 556 ? 101.609 79.572 107.906 1.00 16.09 ? 576 LYS A N 1 +ATOM 4525 C CA . LYS A 1 556 ? 101.769 80.478 109.061 1.00 16.64 ? 576 LYS A CA 1 +ATOM 4526 C C . LYS A 1 556 ? 101.652 79.793 110.435 1.00 16.58 ? 576 LYS A C 1 +ATOM 4527 O O . LYS A 1 556 ? 101.856 80.441 111.466 1.00 15.86 ? 576 LYS A O 1 +ATOM 4528 C CB . LYS A 1 556 ? 100.740 81.617 108.999 1.00 16.89 ? 576 LYS A CB 1 +ATOM 4529 C CG . LYS A 1 556 ? 100.529 82.235 107.628 1.00 18.65 ? 576 LYS A CG 1 +ATOM 4530 C CD . LYS A 1 556 ? 101.685 83.082 107.189 1.00 20.10 ? 576 LYS A CD 1 +ATOM 4531 C CE . LYS A 1 556 ? 101.317 83.933 105.947 1.00 20.99 ? 576 LYS A CE 1 +ATOM 4532 N NZ . LYS A 1 556 ? 101.043 83.128 104.688 1.00 19.87 ? 576 LYS A NZ 1 +ATOM 4533 N N . ARG A 1 557 ? 101.343 78.496 110.468 1.00 17.24 ? 577 ARG A N 1 +ATOM 4534 C CA . ARG A 1 557 ? 101.073 77.824 111.738 1.00 18.08 ? 577 ARG A CA 1 +ATOM 4535 C C . ARG A 1 557 ? 102.333 77.452 112.523 1.00 18.87 ? 577 ARG A C 1 +ATOM 4536 O O . ARG A 1 557 ? 102.238 76.999 113.664 1.00 19.99 ? 577 ARG A O 1 +ATOM 4537 C CB . ARG A 1 557 ? 100.175 76.595 111.542 1.00 17.93 ? 577 ARG A CB 1 +ATOM 4538 C CG . ARG A 1 557 ? 100.816 75.398 110.901 1.00 18.78 ? 577 ARG A CG 1 +ATOM 4539 C CD . ARG A 1 557 ? 99.818 74.260 110.890 1.00 19.24 ? 577 ARG A CD 1 +ATOM 4540 N NE . ARG A 1 557 ? 100.266 73.108 110.122 1.00 19.50 ? 577 ARG A NE 1 +ATOM 4541 C CZ . ARG A 1 557 ? 101.198 72.247 110.520 1.00 18.62 ? 577 ARG A CZ 1 +ATOM 4542 N NH1 . ARG A 1 557 ? 101.799 72.383 111.690 1.00 19.26 ? 577 ARG A NH1 1 +ATOM 4543 N NH2 . ARG A 1 557 ? 101.521 71.228 109.739 1.00 19.76 ? 577 ARG A NH2 1 +ATOM 4544 N N . ARG A 1 558 ? 103.500 77.643 111.921 1.00 19.62 ? 578 ARG A N 1 +ATOM 4545 C CA . ARG A 1 558 ? 104.763 77.554 112.651 1.00 20.16 ? 578 ARG A CA 1 +ATOM 4546 C C . ARG A 1 558 ? 105.352 78.951 112.889 1.00 19.45 ? 578 ARG A C 1 +ATOM 4547 O O . ARG A 1 558 ? 106.529 79.077 113.264 1.00 19.83 ? 578 ARG A O 1 +ATOM 4548 C CB . ARG A 1 558 ? 105.758 76.664 111.885 1.00 20.96 ? 578 ARG A CB 1 +ATOM 4549 C CG . ARG A 1 558 ? 105.200 75.284 111.486 1.00 23.85 ? 578 ARG A CG 1 +ATOM 4550 C CD . ARG A 1 558 ? 105.144 74.320 112.671 1.00 27.95 ? 578 ARG A CD 1 +ATOM 4551 N NE . ARG A 1 558 ? 106.428 73.645 112.871 1.00 29.43 ? 578 ARG A NE 1 +ATOM 4552 C CZ . ARG A 1 558 ? 106.736 72.423 112.429 1.00 31.16 ? 578 ARG A CZ 1 +ATOM 4553 N NH1 . ARG A 1 558 ? 105.853 71.690 111.752 1.00 32.53 ? 578 ARG A NH1 1 +ATOM 4554 N NH2 . ARG A 1 558 ? 107.947 71.926 112.671 1.00 31.29 ? 578 ARG A NH2 1 +ATOM 4555 N N . LYS A 1 559 ? 104.534 79.996 112.705 1.00 18.14 ? 579 LYS A N 1 +ATOM 4556 C CA . LYS A 1 559 ? 104.985 81.394 112.823 1.00 17.55 ? 579 LYS A CA 1 +ATOM 4557 C C . LYS A 1 559 ? 104.192 82.205 113.843 1.00 16.23 ? 579 LYS A C 1 +ATOM 4558 O O . LYS A 1 559 ? 104.681 82.446 114.947 1.00 16.84 ? 579 LYS A O 1 +ATOM 4559 C CB . LYS A 1 559 ? 104.975 82.086 111.457 1.00 17.94 ? 579 LYS A CB 1 +ATOM 4560 C CG . LYS A 1 559 ? 106.268 81.898 110.707 1.00 19.30 ? 579 LYS A CG 1 +ATOM 4561 C CD . LYS A 1 559 ? 106.092 81.949 109.207 1.00 21.34 ? 579 LYS A CD 1 +ATOM 4562 C CE . LYS A 1 559 ? 107.450 81.928 108.497 1.00 22.35 ? 579 LYS A CE 1 +ATOM 4563 N NZ . LYS A 1 559 ? 108.413 80.918 109.062 1.00 25.25 ? 579 LYS A NZ 1 +ATOM 4564 N N . TYR A 1 560 ? 102.985 82.637 113.477 1.00 13.81 ? 580 TYR A N 1 +ATOM 4565 C CA . TYR A 1 560 ? 102.115 83.360 114.403 1.00 12.39 ? 580 TYR A CA 1 +ATOM 4566 C C . TYR A 1 560 ? 100.645 82.928 114.370 1.00 11.71 ? 580 TYR A C 1 +ATOM 4567 O O . TYR A 1 560 ? 99.825 83.497 115.086 1.00 11.36 ? 580 TYR A O 1 +ATOM 4568 C CB . TYR A 1 560 ? 102.206 84.859 114.141 1.00 12.61 ? 580 TYR A CB 1 +ATOM 4569 C CG . TYR A 1 560 ? 101.916 85.248 112.714 1.00 12.76 ? 580 TYR A CG 1 +ATOM 4570 C CD1 . TYR A 1 560 ? 100.607 85.402 112.266 1.00 11.18 ? 580 TYR A CD1 1 +ATOM 4571 C CD2 . TYR A 1 560 ? 102.952 85.499 111.812 1.00 13.09 ? 580 TYR A CD2 1 +ATOM 4572 C CE1 . TYR A 1 560 ? 100.342 85.761 110.963 1.00 12.04 ? 580 TYR A CE1 1 +ATOM 4573 C CE2 . TYR A 1 560 ? 102.693 85.876 110.504 1.00 13.46 ? 580 TYR A CE2 1 +ATOM 4574 C CZ . TYR A 1 560 ? 101.377 86.000 110.083 1.00 12.46 ? 580 TYR A CZ 1 +ATOM 4575 O OH . TYR A 1 560 ? 101.095 86.371 108.789 1.00 14.00 ? 580 TYR A OH 1 +ATOM 4576 N N . VAL A 1 561 ? 100.309 81.927 113.562 1.00 10.55 ? 581 VAL A N 1 +ATOM 4577 C CA . VAL A 1 561 ? 98.962 81.344 113.645 1.00 10.11 ? 581 VAL A CA 1 +ATOM 4578 C C . VAL A 1 561 ? 99.010 80.213 114.673 1.00 9.74 ? 581 VAL A C 1 +ATOM 4579 O O . VAL A 1 561 ? 99.770 79.250 114.516 1.00 10.36 ? 581 VAL A O 1 +ATOM 4580 C CB . VAL A 1 561 ? 98.460 80.879 112.269 1.00 10.27 ? 581 VAL A CB 1 +ATOM 4581 C CG1 . VAL A 1 561 ? 97.235 79.967 112.416 1.00 10.10 ? 581 VAL A CG1 1 +ATOM 4582 C CG2 . VAL A 1 561 ? 98.165 82.100 111.399 1.00 8.24 ? 581 VAL A CG2 1 +ATOM 4583 N N . VAL A 1 562 ? 98.208 80.344 115.736 1.00 8.95 ? 582 VAL A N 1 +ATOM 4584 C CA . VAL A 1 562 ? 98.265 79.417 116.862 1.00 8.75 ? 582 VAL A CA 1 +ATOM 4585 C C . VAL A 1 562 ? 97.063 78.475 116.969 1.00 8.19 ? 582 VAL A C 1 +ATOM 4586 O O . VAL A 1 562 ? 96.956 77.739 117.925 1.00 7.90 ? 582 VAL A O 1 +ATOM 4587 C CB . VAL A 1 562 ? 98.460 80.152 118.217 1.00 8.24 ? 582 VAL A CB 1 +ATOM 4588 C CG1 . VAL A 1 562 ? 99.790 80.901 118.224 1.00 7.69 ? 582 VAL A CG1 1 +ATOM 4589 C CG2 . VAL A 1 562 ? 97.304 81.091 118.533 1.00 8.47 ? 582 VAL A CG2 1 +ATOM 4590 N N . GLY A 1 563 ? 96.162 78.512 115.999 1.00 8.36 ? 583 GLY A N 1 +ATOM 4591 C CA . GLY A 1 563 ? 95.011 77.632 116.059 1.00 8.65 ? 583 GLY A CA 1 +ATOM 4592 C C . GLY A 1 563 ? 94.151 77.620 114.813 1.00 8.82 ? 583 GLY A C 1 +ATOM 4593 O O . GLY A 1 563 ? 94.147 78.568 114.011 1.00 8.70 ? 583 GLY A O 1 +ATOM 4594 N N . GLU A 1 564 ? 93.401 76.533 114.681 1.00 8.48 ? 584 GLU A N 1 +ATOM 4595 C CA . GLU A 1 564 ? 92.385 76.398 113.662 1.00 8.60 ? 584 GLU A CA 1 +ATOM 4596 C C . GLU A 1 564 ? 91.224 75.612 114.254 1.00 9.18 ? 584 GLU A C 1 +ATOM 4597 O O . GLU A 1 564 ? 91.417 74.580 114.919 1.00 7.94 ? 584 GLU A O 1 +ATOM 4598 C CB . GLU A 1 564 ? 92.943 75.711 112.417 1.00 8.92 ? 584 GLU A CB 1 +ATOM 4599 C CG . GLU A 1 564 ? 93.554 74.352 112.687 1.00 7.92 ? 584 GLU A CG 1 +ATOM 4600 C CD . GLU A 1 564 ? 94.196 73.749 111.472 1.00 9.74 ? 584 GLU A CD 1 +ATOM 4601 O OE1 . GLU A 1 564 ? 93.546 72.902 110.818 1.00 8.89 ? 584 GLU A OE1 1 +ATOM 4602 O OE2 . GLU A 1 564 ? 95.356 74.112 111.183 1.00 9.82 ? 584 GLU A OE2 1 +ATOM 4603 N N . LEU A 1 565 ? 90.023 76.123 114.027 1.00 9.56 ? 585 LEU A N 1 +ATOM 4604 C CA . LEU A 1 565 ? 88.796 75.484 114.489 1.00 9.02 ? 585 LEU A CA 1 +ATOM 4605 C C . LEU A 1 565 ? 87.796 75.432 113.330 1.00 8.48 ? 585 LEU A C 1 +ATOM 4606 O O . LEU A 1 565 ? 87.370 76.485 112.842 1.00 9.40 ? 585 LEU A O 1 +ATOM 4607 C CB . LEU A 1 565 ? 88.188 76.297 115.642 1.00 8.97 ? 585 LEU A CB 1 +ATOM 4608 C CG . LEU A 1 565 ? 89.028 76.629 116.886 1.00 9.04 ? 585 LEU A CG 1 +ATOM 4609 C CD1 . LEU A 1 565 ? 88.231 77.584 117.783 1.00 9.50 ? 585 LEU A CD1 1 +ATOM 4610 C CD2 . LEU A 1 565 ? 89.430 75.378 117.644 1.00 10.48 ? 585 LEU A CD2 1 +ATOM 4611 N N . ILE A 1 566 ? 87.446 74.232 112.892 1.00 8.33 ? 586 ILE A N 1 +ATOM 4612 C CA . ILE A 1 566 ? 86.476 74.059 111.805 1.00 7.27 ? 586 ILE A CA 1 +ATOM 4613 C C . ILE A 1 566 ? 85.070 74.417 112.278 1.00 7.50 ? 586 ILE A C 1 +ATOM 4614 O O . ILE A 1 566 ? 84.679 74.044 113.377 1.00 7.47 ? 586 ILE A O 1 +ATOM 4615 C CB . ILE A 1 566 ? 86.534 72.609 111.202 1.00 7.90 ? 586 ILE A CB 1 +ATOM 4616 C CG1 . ILE A 1 566 ? 85.725 72.541 109.903 1.00 9.17 ? 586 ILE A CG1 1 +ATOM 4617 C CG2 . ILE A 1 566 ? 86.143 71.517 112.215 1.00 5.42 ? 586 ILE A CG2 1 +ATOM 4618 C CD1 . ILE A 1 566 ? 86.137 71.359 109.050 1.00 13.82 ? 586 ILE A CD1 1 +ATOM 4619 N N . TRP A 1 567 ? 84.344 75.186 111.463 1.00 7.45 ? 587 TRP A N 1 +ATOM 4620 C CA . TRP A 1 567 ? 82.895 75.322 111.610 1.00 7.43 ? 587 TRP A CA 1 +ATOM 4621 C C . TRP A 1 567 ? 82.260 74.268 110.700 1.00 7.26 ? 587 TRP A C 1 +ATOM 4622 O O . TRP A 1 567 ? 82.400 74.391 109.482 1.00 7.77 ? 587 TRP A O 1 +ATOM 4623 C CB . TRP A 1 567 ? 82.398 76.707 111.176 1.00 7.40 ? 587 TRP A CB 1 +ATOM 4624 C CG . TRP A 1 567 ? 81.009 76.863 111.597 1.00 6.98 ? 587 TRP A CG 1 +ATOM 4625 C CD1 . TRP A 1 567 ? 79.893 76.466 110.916 1.00 7.67 ? 587 TRP A CD1 1 +ATOM 4626 C CD2 . TRP A 1 567 ? 80.563 77.330 112.868 1.00 6.58 ? 587 TRP A CD2 1 +ATOM 4627 N NE1 . TRP A 1 567 ? 78.776 76.697 111.670 1.00 7.94 ? 587 TRP A NE1 1 +ATOM 4628 C CE2 . TRP A 1 567 ? 79.156 77.243 112.870 1.00 6.69 ? 587 TRP A CE2 1 +ATOM 4629 C CE3 . TRP A 1 567 ? 81.213 77.863 113.991 1.00 7.21 ? 587 TRP A CE3 1 +ATOM 4630 C CZ2 . TRP A 1 567 ? 78.381 77.650 113.961 1.00 8.72 ? 587 TRP A CZ2 1 +ATOM 4631 C CZ3 . TRP A 1 567 ? 80.443 78.269 115.070 1.00 6.48 ? 587 TRP A CZ3 1 +ATOM 4632 C CH2 . TRP A 1 567 ? 79.039 78.163 115.046 1.00 8.34 ? 587 TRP A CH2 1 +ATOM 4633 N N . ASN A 1 568 ? 81.555 73.256 111.221 1.00 7.02 ? 588 ASN A N 1 +ATOM 4634 C CA . ASN A 1 568 ? 81.249 73.012 112.631 1.00 7.24 ? 588 ASN A CA 1 +ATOM 4635 C C . ASN A 1 568 ? 81.417 71.504 112.882 1.00 7.54 ? 588 ASN A C 1 +ATOM 4636 O O . ASN A 1 568 ? 81.487 70.720 111.944 1.00 7.99 ? 588 ASN A O 1 +ATOM 4637 C CB . ASN A 1 568 ? 79.788 73.425 112.915 1.00 7.60 ? 588 ASN A CB 1 +ATOM 4638 C CG . ASN A 1 568 ? 79.419 73.396 114.396 1.00 8.31 ? 588 ASN A CG 1 +ATOM 4639 O OD1 . ASN A 1 568 ? 79.116 72.345 114.945 1.00 8.05 ? 588 ASN A OD1 1 +ATOM 4640 N ND2 . ASN A 1 568 ? 79.413 74.580 115.042 1.00 8.33 ? 588 ASN A ND2 1 +ATOM 4641 N N . PHE A 1 569 ? 81.517 71.128 114.149 1.00 7.60 ? 589 PHE A N 1 +ATOM 4642 C CA . PHE A 1 569 ? 81.510 69.732 114.558 1.00 7.67 ? 589 PHE A CA 1 +ATOM 4643 C C . PHE A 1 569 ? 80.358 68.993 113.891 1.00 7.60 ? 589 PHE A C 1 +ATOM 4644 O O . PHE A 1 569 ? 80.568 67.949 113.262 1.00 7.48 ? 589 PHE A O 1 +ATOM 4645 C CB . PHE A 1 569 ? 81.397 69.649 116.079 1.00 8.19 ? 589 PHE A CB 1 +ATOM 4646 C CG . PHE A 1 569 ? 81.373 68.252 116.626 1.00 7.86 ? 589 PHE A CG 1 +ATOM 4647 C CD1 . PHE A 1 569 ? 80.171 67.662 117.021 1.00 7.03 ? 589 PHE A CD1 1 +ATOM 4648 C CD2 . PHE A 1 569 ? 82.547 67.536 116.781 1.00 8.28 ? 589 PHE A CD2 1 +ATOM 4649 C CE1 . PHE A 1 569 ? 80.148 66.379 117.572 1.00 6.62 ? 589 PHE A CE1 1 +ATOM 4650 C CE2 . PHE A 1 569 ? 82.527 66.226 117.305 1.00 8.24 ? 589 PHE A CE2 1 +ATOM 4651 C CZ . PHE A 1 569 ? 81.313 65.655 117.693 1.00 8.79 ? 589 PHE A CZ 1 +ATOM 4652 N N . ALA A 1 570 ? 79.144 69.531 114.018 1.00 7.67 ? 590 ALA A N 1 +ATOM 4653 C CA . ALA A 1 570 ? 77.967 68.866 113.445 1.00 7.59 ? 590 ALA A CA 1 +ATOM 4654 C C . ALA A 1 570 ? 76.871 69.811 112.951 1.00 7.16 ? 590 ALA A C 1 +ATOM 4655 O O . ALA A 1 570 ? 76.717 70.946 113.447 1.00 8.37 ? 590 ALA A O 1 +ATOM 4656 C CB . ALA A 1 570 ? 77.366 67.840 114.455 1.00 7.85 ? 590 ALA A CB 1 +ATOM 4657 N N . ASP A 1 571 ? 76.136 69.325 111.950 1.00 6.83 ? 591 ASP A N 1 +ATOM 4658 C CA . ASP A 1 571 ? 74.925 69.960 111.424 1.00 6.06 ? 591 ASP A CA 1 +ATOM 4659 C C . ASP A 1 571 ? 73.984 70.299 112.591 1.00 6.27 ? 591 ASP A C 1 +ATOM 4660 O O . ASP A 1 571 ? 73.769 69.469 113.475 1.00 5.44 ? 591 ASP A O 1 +ATOM 4661 C CB . ASP A 1 571 ? 74.194 69.000 110.462 1.00 5.82 ? 591 ASP A CB 1 +ATOM 4662 C CG . ASP A 1 571 ? 74.986 68.681 109.202 1.00 6.14 ? 591 ASP A CG 1 +ATOM 4663 O OD1 . ASP A 1 571 ? 76.024 69.336 108.959 1.00 6.99 ? 591 ASP A OD1 1 +ATOM 4664 O OD2 . ASP A 1 571 ? 74.566 67.763 108.432 1.00 5.16 ? 591 ASP A OD2 1 +ATOM 4665 N N . PHE A 1 572 ? 73.428 71.509 112.590 1.00 6.65 ? 592 PHE A N 1 +ATOM 4666 C CA . PHE A 1 572 ? 72.560 71.971 113.684 1.00 7.23 ? 592 PHE A CA 1 +ATOM 4667 C C . PHE A 1 572 ? 71.439 72.866 113.153 1.00 7.84 ? 592 PHE A C 1 +ATOM 4668 O O . PHE A 1 572 ? 71.490 73.293 112.000 1.00 7.30 ? 592 PHE A O 1 +ATOM 4669 C CB . PHE A 1 572 ? 73.393 72.699 114.730 1.00 7.42 ? 592 PHE A CB 1 +ATOM 4670 C CG . PHE A 1 572 ? 74.037 73.960 114.217 1.00 6.39 ? 592 PHE A CG 1 +ATOM 4671 C CD1 . PHE A 1 572 ? 73.359 75.160 114.284 1.00 6.74 ? 592 PHE A CD1 1 +ATOM 4672 C CD2 . PHE A 1 572 ? 75.308 73.943 113.649 1.00 6.29 ? 592 PHE A CD2 1 +ATOM 4673 C CE1 . PHE A 1 572 ? 73.912 76.302 113.816 1.00 6.21 ? 592 PHE A CE1 1 +ATOM 4674 C CE2 . PHE A 1 572 ? 75.876 75.112 113.172 1.00 7.15 ? 592 PHE A CE2 1 +ATOM 4675 C CZ . PHE A 1 572 ? 75.172 76.292 113.260 1.00 5.99 ? 592 PHE A CZ 1 +ATOM 4676 N N . MET A 1 573 ? 70.436 73.151 113.988 1.00 7.95 ? 593 MET A N 1 +ATOM 4677 C CA . MET A 1 573 ? 69.239 73.848 113.527 1.00 8.03 ? 593 MET A CA 1 +ATOM 4678 C C . MET A 1 573 ? 69.359 75.370 113.605 1.00 7.97 ? 593 MET A C 1 +ATOM 4679 O O . MET A 1 573 ? 69.987 75.917 114.517 1.00 7.77 ? 593 MET A O 1 +ATOM 4680 C CB . MET A 1 573 ? 68.025 73.372 114.325 1.00 8.81 ? 593 MET A CB 1 +ATOM 4681 C CG . MET A 1 573 ? 66.694 73.917 113.841 1.00 9.00 ? 593 MET A CG 1 +ATOM 4682 S SD . MET A 1 573 ? 66.338 73.599 112.109 1.00 12.02 ? 593 MET A SD 1 +ATOM 4683 C CE . MET A 1 573 ? 66.146 71.826 112.029 1.00 12.46 ? 593 MET A CE 1 +ATOM 4684 N N . THR A 1 574 ? 68.750 76.030 112.626 1.00 7.24 ? 594 THR A N 1 +ATOM 4685 C CA . THR A 1 574 ? 68.676 77.488 112.566 1.00 6.90 ? 594 THR A CA 1 +ATOM 4686 C C . THR A 1 574 ? 67.249 77.860 112.232 1.00 7.49 ? 594 THR A C 1 +ATOM 4687 O O . THR A 1 574 ? 66.429 76.983 111.971 1.00 7.37 ? 594 THR A O 1 +ATOM 4688 C CB . THR A 1 574 ? 69.570 78.067 111.470 1.00 6.77 ? 594 THR A CB 1 +ATOM 4689 O OG1 . THR A 1 574 ? 69.119 77.622 110.168 1.00 7.93 ? 594 THR A OG1 1 +ATOM 4690 C CG2 . THR A 1 574 ? 71.047 77.724 111.721 1.00 4.49 ? 594 THR A CG2 1 +ATOM 4691 N N . GLU A 1 575 ? 66.974 79.168 112.221 1.00 8.40 ? 595 GLU A N 1 +ATOM 4692 C CA . GLU A 1 575 ? 65.738 79.680 111.638 1.00 9.46 ? 595 GLU A CA 1 +ATOM 4693 C C . GLU A 1 575 ? 65.669 79.393 110.149 1.00 8.59 ? 595 GLU A C 1 +ATOM 4694 O O . GLU A 1 575 ? 66.672 79.194 109.491 1.00 8.13 ? 595 GLU A O 1 +ATOM 4695 C CB . GLU A 1 575 ? 65.633 81.201 111.827 1.00 10.18 ? 595 GLU A CB 1 +ATOM 4696 C CG . GLU A 1 575 ? 65.194 81.607 113.192 1.00 15.08 ? 595 GLU A CG 1 +ATOM 4697 C CD . GLU A 1 575 ? 63.724 81.307 113.451 1.00 18.76 ? 595 GLU A CD 1 +ATOM 4698 O OE1 . GLU A 1 575 ? 63.010 80.920 112.503 1.00 22.79 ? 595 GLU A OE1 1 +ATOM 4699 O OE2 . GLU A 1 575 ? 63.283 81.458 114.605 1.00 22.42 ? 595 GLU A OE2 1 +ATOM 4700 N N . GLN A 1 576 ? 64.451 79.404 109.630 1.00 9.18 ? 596 GLN A N 1 +ATOM 4701 C CA . GLN A 1 576 ? 64.198 79.187 108.226 1.00 9.05 ? 596 GLN A CA 1 +ATOM 4702 C C . GLN A 1 576 ? 64.652 80.375 107.407 1.00 9.72 ? 596 GLN A C 1 +ATOM 4703 O O . GLN A 1 576 ? 64.431 81.510 107.791 1.00 9.84 ? 596 GLN A O 1 +ATOM 4704 C CB . GLN A 1 576 ? 62.698 78.951 108.000 1.00 9.40 ? 596 GLN A CB 1 +ATOM 4705 C CG . GLN A 1 576 ? 62.234 77.592 108.479 1.00 9.54 ? 596 GLN A CG 1 +ATOM 4706 C CD . GLN A 1 576 ? 60.756 77.403 108.313 1.00 10.24 ? 596 GLN A CD 1 +ATOM 4707 O OE1 . GLN A 1 576 ? 60.301 76.803 107.330 1.00 11.17 ? 596 GLN A OE1 1 +ATOM 4708 N NE2 . GLN A 1 576 ? 59.987 77.908 109.272 1.00 9.13 ? 596 GLN A NE2 1 +ATOM 4709 N N . SER A 1 577 ? 65.312 80.091 106.290 1.00 9.97 ? 597 SER A N 1 +ATOM 4710 C CA . SER A 1 577 ? 65.667 81.105 105.309 1.00 10.54 ? 597 SER A CA 1 +ATOM 4711 C C . SER A 1 577 ? 66.150 80.363 104.069 1.00 9.93 ? 597 SER A C 1 +ATOM 4712 O O . SER A 1 577 ? 66.522 79.210 104.166 1.00 9.19 ? 597 SER A O 1 +ATOM 4713 C CB . SER A 1 577 ? 66.741 82.057 105.833 1.00 10.52 ? 597 SER A CB 1 +ATOM 4714 O OG . SER A 1 577 ? 68.041 81.523 105.711 1.00 11.89 ? 597 SER A OG 1 +ATOM 4715 N N . PRO A 1 578 ? 66.166 81.035 102.901 1.00 9.85 ? 598 PRO A N 1 +ATOM 4716 C CA . PRO A 1 578 ? 66.637 80.395 101.666 1.00 9.39 ? 598 PRO A CA 1 +ATOM 4717 C C . PRO A 1 578 ? 68.108 79.945 101.636 1.00 9.29 ? 598 PRO A C 1 +ATOM 4718 O O . PRO A 1 578 ? 68.482 79.210 100.712 1.00 9.00 ? 598 PRO A O 1 +ATOM 4719 C CB . PRO A 1 578 ? 66.398 81.479 100.601 1.00 9.06 ? 598 PRO A CB 1 +ATOM 4720 C CG . PRO A 1 578 ? 65.345 82.330 101.182 1.00 9.88 ? 598 PRO A CG 1 +ATOM 4721 C CD . PRO A 1 578 ? 65.697 82.403 102.633 1.00 9.88 ? 598 PRO A CD 1 +ATOM 4722 N N . THR A 1 579 ? 68.921 80.365 102.603 1.00 9.04 ? 599 THR A N 1 +ATOM 4723 C CA . THR A 1 579 ? 70.312 79.900 102.673 1.00 9.30 ? 599 THR A CA 1 +ATOM 4724 C C . THR A 1 579 ? 70.544 78.817 103.727 1.00 9.57 ? 599 THR A C 1 +ATOM 4725 O O . THR A 1 579 ? 71.692 78.440 103.968 1.00 8.77 ? 599 THR A O 1 +ATOM 4726 C CB . THR A 1 579 ? 71.285 81.011 103.001 1.00 10.07 ? 599 THR A CB 1 +ATOM 4727 O OG1 . THR A 1 579 ? 71.052 81.464 104.342 1.00 10.96 ? 599 THR A OG1 1 +ATOM 4728 C CG2 . THR A 1 579 ? 71.154 82.157 102.009 1.00 11.41 ? 599 THR A CG2 1 +ATOM 4729 N N . ARG A 1 580 ? 69.479 78.326 104.351 1.00 9.45 ? 600 ARG A N 1 +ATOM 4730 C CA . ARG A 1 580 ? 69.604 77.313 105.407 1.00 9.38 ? 600 ARG A CA 1 +ATOM 4731 C C . ARG A 1 580 ? 68.692 76.134 105.133 1.00 9.72 ? 600 ARG A C 1 +ATOM 4732 O O . ARG A 1 580 ? 67.480 76.207 105.332 1.00 8.31 ? 600 ARG A O 1 +ATOM 4733 C CB . ARG A 1 580 ? 69.343 77.957 106.777 1.00 9.65 ? 600 ARG A CB 1 +ATOM 4734 C CG . ARG A 1 580 ? 70.437 78.935 107.197 1.00 10.03 ? 600 ARG A CG 1 +ATOM 4735 C CD . ARG A 1 580 ? 71.662 78.162 107.568 1.00 7.93 ? 600 ARG A CD 1 +ATOM 4736 N NE . ARG A 1 580 ? 72.843 78.951 107.916 1.00 8.12 ? 600 ARG A NE 1 +ATOM 4737 C CZ . ARG A 1 580 ? 73.755 79.400 107.052 1.00 9.43 ? 600 ARG A CZ 1 +ATOM 4738 N NH1 . ARG A 1 580 ? 73.638 79.202 105.746 1.00 9.22 ? 600 ARG A NH1 1 +ATOM 4739 N NH2 . ARG A 1 580 ? 74.815 80.059 107.502 1.00 8.82 ? 600 ARG A NH2 1 +ATOM 4740 N N . VAL A 1 581 ? 69.302 75.050 104.649 1.00 10.55 ? 601 VAL A N 1 +ATOM 4741 C CA . VAL A 1 581 ? 68.581 73.834 104.314 1.00 11.47 ? 601 VAL A CA 1 +ATOM 4742 C C . VAL A 1 581 ? 68.352 73.053 105.592 1.00 11.68 ? 601 VAL A C 1 +ATOM 4743 O O . VAL A 1 581 ? 69.225 72.293 106.040 1.00 12.79 ? 601 VAL A O 1 +ATOM 4744 C CB . VAL A 1 581 ? 69.338 72.945 103.315 1.00 11.82 ? 601 VAL A CB 1 +ATOM 4745 C CG1 . VAL A 1 581 ? 68.462 71.731 102.932 1.00 12.45 ? 601 VAL A CG1 1 +ATOM 4746 C CG2 . VAL A 1 581 ? 69.730 73.718 102.102 1.00 13.06 ? 601 VAL A CG2 1 +ATOM 4747 N N . LEU A 1 582 ? 67.180 73.230 106.196 1.00 11.62 ? 602 LEU A N 1 +ATOM 4748 C CA . LEU A 1 582 ? 66.913 72.624 107.496 1.00 11.87 ? 602 LEU A CA 1 +ATOM 4749 C C . LEU A 1 582 ? 68.084 72.859 108.461 1.00 11.13 ? 602 LEU A C 1 +ATOM 4750 O O . LEU A 1 582 ? 68.602 71.928 109.088 1.00 11.96 ? 602 LEU A O 1 +ATOM 4751 C CB . LEU A 1 582 ? 66.609 71.115 107.361 1.00 12.55 ? 602 LEU A CB 1 +ATOM 4752 C CG . LEU A 1 582 ? 65.173 70.650 107.117 1.00 14.00 ? 602 LEU A CG 1 +ATOM 4753 C CD1 . LEU A 1 582 ? 65.040 69.118 107.103 1.00 15.51 ? 602 LEU A CD1 1 +ATOM 4754 C CD2 . LEU A 1 582 ? 64.219 71.214 108.149 1.00 15.92 ? 602 LEU A CD2 1 +ATOM 4755 N N . GLY A 1 583 ? 68.487 74.116 108.590 1.00 9.66 ? 603 GLY A N 1 +ATOM 4756 C CA . GLY A 1 583 ? 69.555 74.475 109.508 1.00 8.61 ? 603 GLY A CA 1 +ATOM 4757 C C . GLY A 1 583 ? 70.865 74.682 108.776 1.00 8.13 ? 603 GLY A C 1 +ATOM 4758 O O . GLY A 1 583 ? 70.888 74.851 107.559 1.00 8.06 ? 603 GLY A O 1 +ATOM 4759 N N . ASN A 1 584 ? 71.939 74.673 109.554 1.00 7.23 ? 604 ASN A N 1 +ATOM 4760 C CA . ASN A 1 584 ? 73.299 74.870 109.092 1.00 7.20 ? 604 ASN A CA 1 +ATOM 4761 C C . ASN A 1 584 ? 73.927 73.513 108.817 1.00 6.74 ? 604 ASN A C 1 +ATOM 4762 O O . ASN A 1 584 ? 73.947 72.656 109.699 1.00 7.39 ? 604 ASN A O 1 +ATOM 4763 C CB . ASN A 1 584 ? 74.061 75.623 110.186 1.00 7.32 ? 604 ASN A CB 1 +ATOM 4764 C CG . ASN A 1 584 ? 75.503 75.964 109.807 1.00 6.66 ? 604 ASN A CG 1 +ATOM 4765 O OD1 . ASN A 1 584 ? 76.290 75.098 109.472 1.00 7.17 ? 604 ASN A OD1 1 +ATOM 4766 N ND2 . ASN A 1 584 ? 75.845 77.253 109.876 1.00 8.78 ? 604 ASN A ND2 1 +ATOM 4767 N N . LYS A 1 585 ? 74.405 73.313 107.585 1.00 5.91 ? 605 LYS A N 1 +ATOM 4768 C CA . LYS A 1 585 ? 74.903 71.994 107.131 1.00 5.38 ? 605 LYS A CA 1 +ATOM 4769 C C . LYS A 1 585 ? 76.421 71.981 106.984 1.00 5.43 ? 605 LYS A C 1 +ATOM 4770 O O . LYS A 1 585 ? 76.950 71.215 106.202 1.00 3.84 ? 605 LYS A O 1 +ATOM 4771 C CB . LYS A 1 585 ? 74.218 71.601 105.816 1.00 5.78 ? 605 LYS A CB 1 +ATOM 4772 C CG . LYS A 1 585 ? 72.744 71.213 105.983 1.00 6.65 ? 605 LYS A CG 1 +ATOM 4773 C CD . LYS A 1 585 ? 72.574 69.774 106.517 1.00 8.01 ? 605 LYS A CD 1 +ATOM 4774 C CE . LYS A 1 585 ? 71.111 69.337 106.615 1.00 7.36 ? 605 LYS A CE 1 +ATOM 4775 N NZ . LYS A 1 585 ? 70.225 70.211 107.474 1.00 7.36 ? 605 LYS A NZ 1 +ATOM 4776 N N . LYS A 1 586 ? 77.109 72.845 107.735 1.00 5.74 ? 606 LYS A N 1 +ATOM 4777 C CA . LYS A 1 586 ? 78.587 72.906 107.675 1.00 5.92 ? 606 LYS A CA 1 +ATOM 4778 C C . LYS A 1 586 ? 79.282 71.864 108.567 1.00 6.56 ? 606 LYS A C 1 +ATOM 4779 O O . LYS A 1 586 ? 80.511 71.833 108.664 1.00 6.05 ? 606 LYS A O 1 +ATOM 4780 C CB . LYS A 1 586 ? 79.091 74.312 108.019 1.00 6.34 ? 606 LYS A CB 1 +ATOM 4781 C CG . LYS A 1 586 ? 78.603 75.401 107.080 1.00 6.56 ? 606 LYS A CG 1 +ATOM 4782 C CD . LYS A 1 586 ? 79.542 76.597 107.107 1.00 7.97 ? 606 LYS A CD 1 +ATOM 4783 C CE . LYS A 1 586 ? 79.112 77.693 106.162 1.00 9.40 ? 606 LYS A CE 1 +ATOM 4784 N NZ . LYS A 1 586 ? 77.894 78.349 106.599 1.00 9.22 ? 606 LYS A NZ 1 +ATOM 4785 N N . GLY A 1 587 ? 78.512 70.991 109.216 1.00 7.29 ? 607 GLY A N 1 +ATOM 4786 C CA . GLY A 1 587 ? 79.088 69.924 110.016 1.00 7.18 ? 607 GLY A CA 1 +ATOM 4787 C C . GLY A 1 587 ? 80.050 69.062 109.227 1.00 6.96 ? 607 GLY A C 1 +ATOM 4788 O O . GLY A 1 587 ? 79.856 68.822 108.024 1.00 6.36 ? 607 GLY A O 1 +ATOM 4789 N N . ILE A 1 588 ? 81.114 68.612 109.888 1.00 6.80 ? 608 ILE A N 1 +ATOM 4790 C CA . ILE A 1 588 ? 81.888 67.469 109.367 1.00 6.86 ? 608 ILE A CA 1 +ATOM 4791 C C . ILE A 1 588 ? 81.251 66.145 109.813 1.00 6.63 ? 608 ILE A C 1 +ATOM 4792 O O . ILE A 1 588 ? 81.519 65.081 109.235 1.00 7.45 ? 608 ILE A O 1 +ATOM 4793 C CB . ILE A 1 588 ? 83.354 67.521 109.799 1.00 6.91 ? 608 ILE A CB 1 +ATOM 4794 C CG1 . ILE A 1 588 ? 83.476 67.700 111.314 1.00 6.62 ? 608 ILE A CG1 1 +ATOM 4795 C CG2 . ILE A 1 588 ? 84.067 68.646 109.055 1.00 7.61 ? 608 ILE A CG2 1 +ATOM 4796 C CD1 . ILE A 1 588 ? 84.886 67.387 111.839 1.00 4.92 ? 608 ILE A CD1 1 +ATOM 4797 N N . PHE A 1 589 ? 80.404 66.222 110.844 1.00 6.83 ? 609 PHE A N 1 +ATOM 4798 C CA . PHE A 1 589 ? 79.496 65.154 111.209 1.00 5.93 ? 609 PHE A CA 1 +ATOM 4799 C C . PHE A 1 589 ? 78.071 65.581 110.933 1.00 6.25 ? 609 PHE A C 1 +ATOM 4800 O O . PHE A 1 589 ? 77.731 66.801 110.973 1.00 5.44 ? 609 PHE A O 1 +ATOM 4801 C CB . PHE A 1 589 ? 79.618 64.817 112.701 1.00 6.58 ? 609 PHE A CB 1 +ATOM 4802 C CG . PHE A 1 589 ? 80.971 64.313 113.090 1.00 6.84 ? 609 PHE A CG 1 +ATOM 4803 C CD1 . PHE A 1 589 ? 81.892 65.137 113.684 1.00 7.71 ? 609 PHE A CD1 1 +ATOM 4804 C CD2 . PHE A 1 589 ? 81.323 62.986 112.853 1.00 7.85 ? 609 PHE A CD2 1 +ATOM 4805 C CE1 . PHE A 1 589 ? 83.173 64.653 114.027 1.00 6.22 ? 609 PHE A CE1 1 +ATOM 4806 C CE2 . PHE A 1 589 ? 82.584 62.517 113.182 1.00 8.11 ? 609 PHE A CE2 1 +ATOM 4807 C CZ . PHE A 1 589 ? 83.500 63.344 113.777 1.00 7.54 ? 609 PHE A CZ 1 +ATOM 4808 N N . THR A 1 590 ? 77.237 64.603 110.647 1.00 6.26 ? 610 THR A N 1 +ATOM 4809 C CA . THR A 1 590 ? 75.800 64.831 110.572 1.00 6.60 ? 610 THR A CA 1 +ATOM 4810 C C . THR A 1 590 ? 75.260 65.160 111.972 1.00 6.54 ? 610 THR A C 1 +ATOM 4811 O O . THR A 1 590 ? 75.915 64.910 112.991 1.00 6.61 ? 610 THR A O 1 +ATOM 4812 C CB . THR A 1 590 ? 75.060 63.606 110.011 1.00 6.79 ? 610 THR A CB 1 +ATOM 4813 O OG1 . THR A 1 590 ? 75.207 62.512 110.929 1.00 6.80 ? 610 THR A OG1 1 +ATOM 4814 C CG2 . THR A 1 590 ? 75.592 63.215 108.610 1.00 6.85 ? 610 THR A CG2 1 +ATOM 4815 N N . ARG A 1 591 ? 74.032 65.674 112.036 1.00 6.63 ? 611 ARG A N 1 +ATOM 4816 C CA . ARG A 1 591 ? 73.391 65.902 113.336 1.00 6.49 ? 611 ARG A CA 1 +ATOM 4817 C C . ARG A 1 591 ? 73.250 64.577 114.134 1.00 6.56 ? 611 ARG A C 1 +ATOM 4818 O O . ARG A 1 591 ? 73.169 64.601 115.367 1.00 6.67 ? 611 ARG A O 1 +ATOM 4819 C CB . ARG A 1 591 ? 72.021 66.534 113.135 1.00 6.12 ? 611 ARG A CB 1 +ATOM 4820 C CG . ARG A 1 591 ? 71.509 67.300 114.345 1.00 6.29 ? 611 ARG A CG 1 +ATOM 4821 C CD . ARG A 1 591 ? 70.186 67.942 114.038 1.00 7.33 ? 611 ARG A CD 1 +ATOM 4822 N NE . ARG A 1 591 ? 69.763 68.913 115.044 1.00 7.78 ? 611 ARG A NE 1 +ATOM 4823 C CZ . ARG A 1 591 ? 68.496 69.290 115.232 1.00 9.25 ? 611 ARG A CZ 1 +ATOM 4824 N NH1 . ARG A 1 591 ? 67.503 68.743 114.538 1.00 10.79 ? 611 ARG A NH1 1 +ATOM 4825 N NH2 . ARG A 1 591 ? 68.210 70.228 116.134 1.00 8.37 ? 611 ARG A NH2 1 +ATOM 4826 N N . GLN A 1 592 ? 73.216 63.442 113.427 1.00 6.30 ? 612 GLN A N 1 +ATOM 4827 C CA . GLN A 1 592 ? 73.145 62.116 114.059 1.00 6.61 ? 612 GLN A CA 1 +ATOM 4828 C C . GLN A 1 592 ? 74.530 61.522 114.424 1.00 7.11 ? 612 GLN A C 1 +ATOM 4829 O O . GLN A 1 592 ? 74.634 60.340 114.821 1.00 7.11 ? 612 GLN A O 1 +ATOM 4830 C CB . GLN A 1 592 ? 72.349 61.156 113.178 1.00 7.02 ? 612 GLN A CB 1 +ATOM 4831 C CG . GLN A 1 592 ? 70.905 61.626 112.941 1.00 6.19 ? 612 GLN A CG 1 +ATOM 4832 C CD . GLN A 1 592 ? 70.790 62.693 111.856 1.00 6.46 ? 612 GLN A CD 1 +ATOM 4833 O OE1 . GLN A 1 592 ? 71.520 62.669 110.852 1.00 7.60 ? 612 GLN A OE1 1 +ATOM 4834 N NE2 . GLN A 1 592 ? 69.851 63.610 112.036 1.00 5.95 ? 612 GLN A NE2 1 +ATOM 4835 N N . ARG A 1 593 ? 75.565 62.353 114.337 1.00 7.10 ? 613 ARG A N 1 +ATOM 4836 C CA . ARG A 1 593 ? 76.916 62.030 114.808 1.00 7.62 ? 613 ARG A CA 1 +ATOM 4837 C C . ARG A 1 593 ? 77.635 60.936 113.992 1.00 7.75 ? 613 ARG A C 1 +ATOM 4838 O O . ARG A 1 593 ? 78.355 60.098 114.544 1.00 8.24 ? 613 ARG A O 1 +ATOM 4839 C CB . ARG A 1 593 ? 76.922 61.712 116.314 1.00 8.29 ? 613 ARG A CB 1 +ATOM 4840 C CG . ARG A 1 593 ? 77.178 62.932 117.215 1.00 8.75 ? 613 ARG A CG 1 +ATOM 4841 C CD . ARG A 1 593 ? 76.154 64.045 117.007 1.00 10.55 ? 613 ARG A CD 1 +ATOM 4842 N NE . ARG A 1 593 ? 76.267 65.044 118.071 1.00 11.79 ? 613 ARG A NE 1 +ATOM 4843 C CZ . ARG A 1 593 ? 75.530 66.145 118.160 1.00 14.15 ? 613 ARG A CZ 1 +ATOM 4844 N NH1 . ARG A 1 593 ? 74.576 66.415 117.268 1.00 13.25 ? 613 ARG A NH1 1 +ATOM 4845 N NH2 . ARG A 1 593 ? 75.736 66.972 119.176 1.00 14.91 ? 613 ARG A NH2 1 +ATOM 4846 N N . GLN A 1 594 ? 77.451 60.976 112.674 1.00 6.93 ? 614 GLN A N 1 +ATOM 4847 C CA . GLN A 1 594 ? 78.253 60.171 111.750 1.00 7.80 ? 614 GLN A CA 1 +ATOM 4848 C C . GLN A 1 594 ? 79.041 61.049 110.773 1.00 7.64 ? 614 GLN A C 1 +ATOM 4849 O O . GLN A 1 594 ? 78.564 62.104 110.362 1.00 8.99 ? 614 GLN A O 1 +ATOM 4850 C CB . GLN A 1 594 ? 77.364 59.172 111.008 1.00 7.37 ? 614 GLN A CB 1 +ATOM 4851 C CG . GLN A 1 594 ? 76.585 58.216 111.915 1.00 7.68 ? 614 GLN A CG 1 +ATOM 4852 C CD . GLN A 1 594 ? 77.460 57.270 112.740 1.00 8.15 ? 614 GLN A CD 1 +ATOM 4853 O OE1 . GLN A 1 594 ? 78.655 57.119 112.493 1.00 8.29 ? 614 GLN A OE1 1 +ATOM 4854 N NE2 . GLN A 1 594 ? 76.857 56.632 113.730 1.00 7.80 ? 614 GLN A NE2 1 +ATOM 4855 N N . PRO A 1 595 ? 80.265 60.613 110.404 1.00 7.50 ? 615 PRO A N 1 +ATOM 4856 C CA . PRO A 1 595 ? 81.174 61.436 109.639 1.00 7.34 ? 615 PRO A CA 1 +ATOM 4857 C C . PRO A 1 595 ? 80.784 61.566 108.180 1.00 7.37 ? 615 PRO A C 1 +ATOM 4858 O O . PRO A 1 595 ? 80.497 60.568 107.519 1.00 6.86 ? 615 PRO A O 1 +ATOM 4859 C CB . PRO A 1 595 ? 82.510 60.700 109.773 1.00 7.14 ? 615 PRO A CB 1 +ATOM 4860 C CG . PRO A 1 595 ? 82.138 59.257 109.935 1.00 7.87 ? 615 PRO A CG 1 +ATOM 4861 C CD . PRO A 1 595 ? 80.838 59.282 110.695 1.00 7.45 ? 615 PRO A CD 1 +ATOM 4862 N N . LYS A 1 596 ? 80.800 62.804 107.689 1.00 7.19 ? 616 LYS A N 1 +ATOM 4863 C CA . LYS A 1 596 ? 80.823 63.080 106.266 1.00 7.41 ? 616 LYS A CA 1 +ATOM 4864 C C . LYS A 1 596 ? 82.236 62.768 105.790 1.00 8.30 ? 616 LYS A C 1 +ATOM 4865 O O . LYS A 1 596 ? 83.132 62.606 106.609 1.00 8.21 ? 616 LYS A O 1 +ATOM 4866 C CB . LYS A 1 596 ? 80.462 64.535 105.969 1.00 7.27 ? 616 LYS A CB 1 +ATOM 4867 C CG . LYS A 1 596 ? 79.080 64.958 106.475 1.00 6.11 ? 616 LYS A CG 1 +ATOM 4868 C CD . LYS A 1 596 ? 78.761 66.414 106.195 1.00 6.62 ? 616 LYS A CD 1 +ATOM 4869 C CE . LYS A 1 596 ? 77.605 66.909 107.026 1.00 5.71 ? 616 LYS A CE 1 +ATOM 4870 N NZ . LYS A 1 596 ? 77.449 68.385 106.877 1.00 6.46 ? 616 LYS A NZ 1 +ATOM 4871 N N . SER A 1 597 ? 82.442 62.637 104.483 1.00 8.56 ? 617 SER A N 1 +ATOM 4872 C CA . SER A 1 597 ? 83.790 62.287 103.990 1.00 9.47 ? 617 SER A CA 1 +ATOM 4873 C C . SER A 1 597 ? 84.893 63.256 104.431 1.00 9.60 ? 617 SER A C 1 +ATOM 4874 O O . SER A 1 597 ? 86.037 62.834 104.655 1.00 9.90 ? 617 SER A O 1 +ATOM 4875 C CB . SER A 1 597 ? 83.793 62.129 102.473 1.00 10.18 ? 617 SER A CB 1 +ATOM 4876 O OG . SER A 1 597 ? 83.012 60.997 102.089 1.00 13.85 ? 617 SER A OG 1 +ATOM 4877 N N . ALA A 1 598 ? 84.574 64.552 104.529 1.00 9.20 ? 618 ALA A N 1 +ATOM 4878 C CA . ALA A 1 598 ? 85.525 65.558 105.024 1.00 9.12 ? 618 ALA A CA 1 +ATOM 4879 C C . ALA A 1 598 ? 86.043 65.287 106.458 1.00 9.31 ? 618 ALA A C 1 +ATOM 4880 O O . ALA A 1 598 ? 87.132 65.746 106.850 1.00 8.84 ? 618 ALA A O 1 +ATOM 4881 C CB . ALA A 1 598 ? 84.883 66.979 104.946 1.00 9.41 ? 618 ALA A CB 1 +ATOM 4882 N N . ALA A 1 599 ? 85.265 64.569 107.265 1.00 9.01 ? 619 ALA A N 1 +ATOM 4883 C CA . ALA A 1 599 ? 85.682 64.291 108.640 1.00 9.59 ? 619 ALA A CA 1 +ATOM 4884 C C . ALA A 1 599 ? 86.998 63.510 108.648 1.00 9.88 ? 619 ALA A C 1 +ATOM 4885 O O . ALA A 1 599 ? 87.903 63.792 109.440 1.00 10.92 ? 619 ALA A O 1 +ATOM 4886 C CB . ALA A 1 599 ? 84.614 63.519 109.372 1.00 9.14 ? 619 ALA A CB 1 +ATOM 4887 N N . PHE A 1 600 ? 87.091 62.528 107.753 1.00 10.48 ? 620 PHE A N 1 +ATOM 4888 C CA . PHE A 1 600 ? 88.279 61.680 107.610 1.00 10.57 ? 620 PHE A CA 1 +ATOM 4889 C C . PHE A 1 600 ? 89.491 62.488 107.186 1.00 11.17 ? 620 PHE A C 1 +ATOM 4890 O O . PHE A 1 600 ? 90.613 62.213 107.630 1.00 10.44 ? 620 PHE A O 1 +ATOM 4891 C CB . PHE A 1 600 ? 88.016 60.569 106.599 1.00 11.03 ? 620 PHE A CB 1 +ATOM 4892 C CG . PHE A 1 600 ? 87.003 59.590 107.066 1.00 9.87 ? 620 PHE A CG 1 +ATOM 4893 C CD1 . PHE A 1 600 ? 85.663 59.763 106.762 1.00 10.46 ? 620 PHE A CD1 1 +ATOM 4894 C CD2 . PHE A 1 600 ? 87.384 58.492 107.834 1.00 11.11 ? 620 PHE A CD2 1 +ATOM 4895 C CE1 . PHE A 1 600 ? 84.724 58.871 107.225 1.00 12.28 ? 620 PHE A CE1 1 +ATOM 4896 C CE2 . PHE A 1 600 ? 86.446 57.590 108.290 1.00 12.25 ? 620 PHE A CE2 1 +ATOM 4897 C CZ . PHE A 1 600 ? 85.119 57.778 107.981 1.00 12.17 ? 620 PHE A CZ 1 +ATOM 4898 N N . LEU A 1 601 ? 89.248 63.484 106.342 1.00 11.35 ? 621 LEU A N 1 +ATOM 4899 C CA A LEU A 1 601 ? 90.308 64.372 105.877 0.50 11.21 ? 621 LEU A CA 1 +ATOM 4900 C CA B LEU A 1 601 ? 90.304 64.378 105.878 0.50 11.41 ? 621 LEU A CA 1 +ATOM 4901 C C . LEU A 1 601 ? 90.864 65.174 107.054 1.00 11.05 ? 621 LEU A C 1 +ATOM 4902 O O . LEU A 1 601 ? 92.078 65.197 107.294 1.00 10.43 ? 621 LEU A O 1 +ATOM 4903 C CB A LEU A 1 601 ? 89.768 65.299 104.781 0.50 11.35 ? 621 LEU A CB 1 +ATOM 4904 C CB B LEU A 1 601 ? 89.757 65.331 104.811 0.50 11.63 ? 621 LEU A CB 1 +ATOM 4905 C CG A LEU A 1 601 ? 90.697 66.293 104.088 0.50 11.48 ? 621 LEU A CG 1 +ATOM 4906 C CG B LEU A 1 601 ? 90.751 66.111 103.964 0.50 12.18 ? 621 LEU A CG 1 +ATOM 4907 C CD1 A LEU A 1 601 ? 90.845 67.559 104.910 0.50 10.71 ? 621 LEU A CD1 1 +ATOM 4908 C CD1 B LEU A 1 601 ? 91.680 65.163 103.225 0.50 13.74 ? 621 LEU A CD1 1 +ATOM 4909 C CD2 A LEU A 1 601 ? 92.055 65.666 103.801 0.50 11.80 ? 621 LEU A CD2 1 +ATOM 4910 C CD2 B LEU A 1 601 ? 89.996 67.001 102.988 0.50 11.88 ? 621 LEU A CD2 1 +ATOM 4911 N N . LEU A 1 602 ? 89.973 65.816 107.803 1.00 10.45 ? 622 LEU A N 1 +ATOM 4912 C CA . LEU A 1 602 ? 90.387 66.635 108.947 1.00 9.71 ? 622 LEU A CA 1 +ATOM 4913 C C . LEU A 1 602 ? 91.108 65.773 109.987 1.00 9.34 ? 622 LEU A C 1 +ATOM 4914 O O . LEU A 1 602 ? 92.131 66.156 110.544 1.00 9.23 ? 622 LEU A O 1 +ATOM 4915 C CB . LEU A 1 602 ? 89.173 67.311 109.575 1.00 9.95 ? 622 LEU A CB 1 +ATOM 4916 C CG . LEU A 1 602 ? 89.555 68.461 110.484 1.00 9.73 ? 622 LEU A CG 1 +ATOM 4917 C CD1 . LEU A 1 602 ? 90.144 69.596 109.655 1.00 11.00 ? 622 LEU A CD1 1 +ATOM 4918 C CD2 . LEU A 1 602 ? 88.356 68.897 111.262 1.00 8.60 ? 622 LEU A CD2 1 +ATOM 4919 N N . ARG A 1 603 ? 90.563 64.596 110.236 1.00 9.18 ? 623 ARG A N 1 +ATOM 4920 C CA . ARG A 1 603 ? 91.172 63.619 111.133 1.00 9.35 ? 623 ARG A CA 1 +ATOM 4921 C C . ARG A 1 603 ? 92.627 63.309 110.766 1.00 9.69 ? 623 ARG A C 1 +ATOM 4922 O O . ARG A 1 603 ? 93.515 63.438 111.603 1.00 9.32 ? 623 ARG A O 1 +ATOM 4923 C CB . ARG A 1 603 ? 90.350 62.339 111.121 1.00 9.54 ? 623 ARG A CB 1 +ATOM 4924 C CG . ARG A 1 603 ? 90.905 61.219 111.965 1.00 9.56 ? 623 ARG A CG 1 +ATOM 4925 C CD . ARG A 1 603 ? 89.888 60.126 112.112 1.00 11.32 ? 623 ARG A CD 1 +ATOM 4926 N NE . ARG A 1 603 ? 90.385 58.992 112.882 1.00 11.97 ? 623 ARG A NE 1 +ATOM 4927 C CZ . ARG A 1 603 ? 90.800 57.835 112.364 1.00 13.80 ? 623 ARG A CZ 1 +ATOM 4928 N NH1 . ARG A 1 603 ? 90.787 57.610 111.054 1.00 16.59 ? 623 ARG A NH1 1 +ATOM 4929 N NH2 . ARG A 1 603 ? 91.218 56.876 113.171 1.00 15.47 ? 623 ARG A NH2 1 +ATOM 4930 N N . GLU A 1 604 ? 92.875 62.907 109.523 1.00 10.03 ? 624 GLU A N 1 +ATOM 4931 C CA . GLU A 1 604 ? 94.257 62.691 109.087 1.00 10.50 ? 624 GLU A CA 1 +ATOM 4932 C C . GLU A 1 604 ? 95.151 63.925 109.368 1.00 10.19 ? 624 GLU A C 1 +ATOM 4933 O O . GLU A 1 604 ? 96.283 63.782 109.847 1.00 9.92 ? 624 GLU A O 1 +ATOM 4934 C CB . GLU A 1 604 ? 94.312 62.313 107.604 1.00 11.35 ? 624 GLU A CB 1 +ATOM 4935 C CG . GLU A 1 604 ? 93.758 60.937 107.256 1.00 14.10 ? 624 GLU A CG 1 +ATOM 4936 C CD . GLU A 1 604 ? 94.391 59.807 108.042 1.00 17.12 ? 624 GLU A CD 1 +ATOM 4937 O OE1 . GLU A 1 604 ? 95.619 59.620 107.942 1.00 20.02 ? 624 GLU A OE1 1 +ATOM 4938 O OE2 . GLU A 1 604 ? 93.658 59.112 108.776 1.00 21.21 ? 624 GLU A OE2 1 +ATOM 4939 N N . ARG A 1 605 ? 94.656 65.130 109.101 1.00 10.17 ? 625 ARG A N 1 +ATOM 4940 C CA . ARG A 1 605 ? 95.448 66.351 109.368 1.00 9.68 ? 625 ARG A CA 1 +ATOM 4941 C C . ARG A 1 605 ? 95.786 66.527 110.859 1.00 9.82 ? 625 ARG A C 1 +ATOM 4942 O O . ARG A 1 605 ? 96.933 66.782 111.215 1.00 9.47 ? 625 ARG A O 1 +ATOM 4943 C CB . ARG A 1 605 ? 94.720 67.591 108.842 1.00 10.25 ? 625 ARG A CB 1 +ATOM 4944 C CG . ARG A 1 605 ? 95.326 68.918 109.285 1.00 9.93 ? 625 ARG A CG 1 +ATOM 4945 C CD . ARG A 1 605 ? 94.631 70.093 108.593 1.00 10.62 ? 625 ARG A CD 1 +ATOM 4946 N NE . ARG A 1 605 ? 95.200 71.383 108.938 1.00 10.18 ? 625 ARG A NE 1 +ATOM 4947 C CZ . ARG A 1 605 ? 96.383 71.840 108.512 1.00 11.12 ? 625 ARG A CZ 1 +ATOM 4948 N NH1 . ARG A 1 605 ? 97.148 71.119 107.706 1.00 10.33 ? 625 ARG A NH1 1 +ATOM 4949 N NH2 . ARG A 1 605 ? 96.786 73.038 108.888 1.00 11.98 ? 625 ARG A NH2 1 +ATOM 4950 N N . TYR A 1 606 ? 94.775 66.412 111.716 1.00 9.07 ? 626 TYR A N 1 +ATOM 4951 C CA . TYR A 1 606 ? 94.924 66.656 113.145 1.00 9.10 ? 626 TYR A CA 1 +ATOM 4952 C C . TYR A 1 606 ? 95.913 65.665 113.778 1.00 9.95 ? 626 TYR A C 1 +ATOM 4953 O O . TYR A 1 606 ? 96.783 66.063 114.573 1.00 10.69 ? 626 TYR A O 1 +ATOM 4954 C CB . TYR A 1 606 ? 93.539 66.609 113.820 1.00 9.31 ? 626 TYR A CB 1 +ATOM 4955 C CG . TYR A 1 606 ? 92.695 67.868 113.636 1.00 8.52 ? 626 TYR A CG 1 +ATOM 4956 C CD1 . TYR A 1 606 ? 93.066 68.868 112.736 1.00 7.31 ? 626 TYR A CD1 1 +ATOM 4957 C CD2 . TYR A 1 606 ? 91.505 68.047 114.357 1.00 7.80 ? 626 TYR A CD2 1 +ATOM 4958 C CE1 . TYR A 1 606 ? 92.289 70.031 112.574 1.00 7.41 ? 626 TYR A CE1 1 +ATOM 4959 C CE2 . TYR A 1 606 ? 90.730 69.191 114.191 1.00 9.75 ? 626 TYR A CE2 1 +ATOM 4960 C CZ . TYR A 1 606 ? 91.116 70.171 113.307 1.00 9.15 ? 626 TYR A CZ 1 +ATOM 4961 O OH . TYR A 1 606 ? 90.358 71.309 113.144 1.00 9.26 ? 626 TYR A OH 1 +ATOM 4962 N N . TRP A 1 607 ? 95.829 64.396 113.386 1.00 10.29 ? 627 TRP A N 1 +ATOM 4963 C CA . TRP A 1 607 ? 96.777 63.406 113.896 1.00 11.15 ? 627 TRP A CA 1 +ATOM 4964 C C . TRP A 1 607 ? 98.188 63.711 113.391 1.00 12.01 ? 627 TRP A C 1 +ATOM 4965 O O . TRP A 1 607 ? 99.157 63.672 114.164 1.00 12.94 ? 627 TRP A O 1 +ATOM 4966 C CB . TRP A 1 607 ? 96.324 61.983 113.576 1.00 11.55 ? 627 TRP A CB 1 +ATOM 4967 C CG . TRP A 1 607 ? 95.227 61.556 114.499 1.00 11.62 ? 627 TRP A CG 1 +ATOM 4968 C CD1 . TRP A 1 607 ? 93.885 61.658 114.284 1.00 12.30 ? 627 TRP A CD1 1 +ATOM 4969 C CD2 . TRP A 1 607 ? 95.382 61.006 115.809 1.00 11.36 ? 627 TRP A CD2 1 +ATOM 4970 N NE1 . TRP A 1 607 ? 93.193 61.189 115.374 1.00 11.45 ? 627 TRP A NE1 1 +ATOM 4971 C CE2 . TRP A 1 607 ? 94.088 60.775 116.322 1.00 12.28 ? 627 TRP A CE2 1 +ATOM 4972 C CE3 . TRP A 1 607 ? 96.494 60.658 116.592 1.00 12.01 ? 627 TRP A CE3 1 +ATOM 4973 C CZ2 . TRP A 1 607 ? 93.870 60.217 117.577 1.00 12.13 ? 627 TRP A CZ2 1 +ATOM 4974 C CZ3 . TRP A 1 607 ? 96.281 60.119 117.838 1.00 12.56 ? 627 TRP A CZ3 1 +ATOM 4975 C CH2 . TRP A 1 607 ? 94.972 59.901 118.326 1.00 12.36 ? 627 TRP A CH2 1 +ATOM 4976 N N . LYS A 1 608 ? 98.291 64.088 112.124 1.00 12.45 ? 628 LYS A N 1 +ATOM 4977 C CA . LYS A 1 608 ? 99.576 64.480 111.551 1.00 13.00 ? 628 LYS A CA 1 +ATOM 4978 C C . LYS A 1 608 ? 100.175 65.657 112.320 1.00 13.48 ? 628 LYS A C 1 +ATOM 4979 O O . LYS A 1 608 ? 101.352 65.616 112.689 1.00 13.44 ? 628 LYS A O 1 +ATOM 4980 C CB . LYS A 1 608 ? 99.406 64.818 110.067 1.00 13.40 ? 628 LYS A CB 1 +ATOM 4981 C CG . LYS A 1 608 ? 100.680 64.763 109.272 1.00 14.84 ? 628 LYS A CG 1 +ATOM 4982 C CD . LYS A 1 608 ? 100.400 64.937 107.793 1.00 15.91 ? 628 LYS A CD 1 +ATOM 4983 C CE . LYS A 1 608 ? 101.523 65.105 106.838 0.00 18.70 ? 628 LYS A CE 1 +ATOM 4984 N NZ . LYS A 1 608 ? 101.171 65.329 105.385 0.00 26.08 ? 628 LYS A NZ 1 +ATOM 4985 N N . ILE A 1 609 ? 99.376 66.697 112.577 1.00 12.99 ? 629 ILE A N 1 +ATOM 4986 C CA . ILE A 1 609 ? 99.859 67.862 113.340 1.00 13.22 ? 629 ILE A CA 1 +ATOM 4987 C C . ILE A 1 609 ? 100.268 67.455 114.757 1.00 14.21 ? 629 ILE A C 1 +ATOM 4988 O O . ILE A 1 609 ? 101.281 67.934 115.276 1.00 14.62 ? 629 ILE A O 1 +ATOM 4989 C CB . ILE A 1 609 ? 98.792 68.991 113.419 1.00 13.10 ? 629 ILE A CB 1 +ATOM 4990 C CG1 . ILE A 1 609 ? 98.610 69.648 112.052 1.00 12.17 ? 629 ILE A CG1 1 +ATOM 4991 C CG2 . ILE A 1 609 ? 99.162 70.057 114.481 1.00 12.11 ? 629 ILE A CG2 1 +ATOM 4992 C CD1 . ILE A 1 609 ? 97.573 70.787 112.032 1.00 12.82 ? 629 ILE A CD1 1 +ATOM 4993 N N . ALA A 1 610 ? 99.484 66.567 115.379 1.00 14.91 ? 630 ALA A N 1 +ATOM 4994 C CA . ALA A 1 610 ? 99.757 66.115 116.749 1.00 16.27 ? 630 ALA A CA 1 +ATOM 4995 C C . ALA A 1 610 ? 101.084 65.366 116.841 1.00 17.34 ? 630 ALA A C 1 +ATOM 4996 O O . ALA A 1 610 ? 101.782 65.444 117.860 1.00 18.19 ? 630 ALA A O 1 +ATOM 4997 C CB . ALA A 1 610 ? 98.629 65.218 117.259 1.00 15.89 ? 630 ALA A CB 1 +ATOM 4998 N N . ASN A 1 611 ? 101.432 64.647 115.783 1.00 18.80 ? 631 ASN A N 1 +ATOM 4999 C CA . ASN A 1 611 ? 102.641 63.819 115.792 1.00 20.06 ? 631 ASN A CA 1 +ATOM 5000 C C . ASN A 1 611 ? 103.927 64.576 115.440 1.00 20.80 ? 631 ASN A C 1 +ATOM 5001 O O . ASN A 1 611 ? 105.033 64.023 115.567 1.00 20.43 ? 631 ASN A O 1 +ATOM 5002 C CB . ASN A 1 611 ? 102.461 62.635 114.850 1.00 20.61 ? 631 ASN A CB 1 +ATOM 5003 C CG . ASN A 1 611 ? 103.518 61.575 115.046 1.00 22.62 ? 631 ASN A CG 1 +ATOM 5004 O OD1 . ASN A 1 611 ? 103.858 61.222 116.177 1.00 25.84 ? 631 ASN A OD1 1 +ATOM 5005 N ND2 . ASN A 1 611 ? 104.053 61.069 113.946 1.00 25.66 ? 631 ASN A ND2 1 +ATOM 5006 N N . GLU A 1 612 ? 103.793 65.829 115.008 1.00 21.38 ? 632 GLU A N 1 +ATOM 5007 C CA . GLU A 1 612 ? 104.958 66.682 114.742 1.00 22.23 ? 632 GLU A CA 1 +ATOM 5008 C C . GLU A 1 612 ? 105.698 67.035 116.034 1.00 22.80 ? 632 GLU A C 1 +ATOM 5009 O O . GLU A 1 612 ? 105.240 67.879 116.814 1.00 24.20 ? 632 GLU A O 1 +ATOM 5010 C CB . GLU A 1 612 ? 104.535 67.967 114.012 1.00 22.18 ? 632 GLU A CB 1 +ATOM 5011 C CG . GLU A 1 612 ? 104.117 67.716 112.584 1.00 22.28 ? 632 GLU A CG 1 +ATOM 5012 C CD . GLU A 1 612 ? 103.576 68.938 111.879 1.00 22.18 ? 632 GLU A CD 1 +ATOM 5013 O OE1 . GLU A 1 612 ? 103.532 70.040 112.484 1.00 20.81 ? 632 GLU A OE1 1 +ATOM 5014 O OE2 . GLU A 1 612 ? 103.201 68.785 110.701 1.00 22.37 ? 632 GLU A OE2 1 +ATOM 5015 N N . GLY B 1 2 ? 76.636 34.198 61.419 1.00 33.31 ? 22 GLY B N 1 +ATOM 5016 C CA . GLY B 1 2 ? 78.093 33.950 61.621 1.00 33.34 ? 22 GLY B CA 1 +ATOM 5017 C C . GLY B 1 2 ? 78.836 33.702 60.320 1.00 33.32 ? 22 GLY B C 1 +ATOM 5018 O O . GLY B 1 2 ? 79.574 34.569 59.847 1.00 33.56 ? 22 GLY B O 1 +ATOM 5019 N N . LEU B 1 3 ? 78.643 32.514 59.742 1.00 33.13 ? 23 LEU B N 1 +ATOM 5020 C CA . LEU B 1 3 ? 79.346 32.119 58.513 1.00 32.60 ? 23 LEU B CA 1 +ATOM 5021 C C . LEU B 1 3 ? 78.956 32.990 57.321 1.00 32.00 ? 23 LEU B C 1 +ATOM 5022 O O . LEU B 1 3 ? 79.761 33.205 56.411 1.00 32.47 ? 23 LEU B O 1 +ATOM 5023 C CB . LEU B 1 3 ? 79.072 30.648 58.182 1.00 32.78 ? 23 LEU B CB 1 +ATOM 5024 N N . GLN B 1 4 ? 77.722 33.485 57.332 1.00 30.95 ? 24 GLN B N 1 +ATOM 5025 C CA . GLN B 1 4 ? 77.213 34.328 56.253 1.00 30.02 ? 24 GLN B CA 1 +ATOM 5026 C C . GLN B 1 4 ? 77.817 35.737 56.281 1.00 28.03 ? 24 GLN B C 1 +ATOM 5027 O O . GLN B 1 4 ? 77.193 36.677 56.775 1.00 28.57 ? 24 GLN B O 1 +ATOM 5028 C CB . GLN B 1 4 ? 75.681 34.401 56.325 1.00 30.31 ? 24 GLN B CB 1 +ATOM 5029 C CG . GLN B 1 4 ? 75.003 35.169 55.186 1.00 32.36 ? 24 GLN B CG 1 +ATOM 5030 C CD . GLN B 1 4 ? 75.031 34.423 53.866 1.00 34.16 ? 24 GLN B CD 1 +ATOM 5031 O OE1 . GLN B 1 4 ? 76.075 34.321 53.213 1.00 35.28 ? 24 GLN B OE1 1 +ATOM 5032 N NE2 . GLN B 1 4 ? 73.874 33.909 53.455 1.00 35.24 ? 24 GLN B NE2 1 +ATOM 5033 N N . GLY B 1 5 ? 79.038 35.863 55.764 1.00 25.69 ? 25 GLY B N 1 +ATOM 5034 C CA . GLY B 1 5 ? 79.593 37.161 55.369 1.00 23.71 ? 25 GLY B CA 1 +ATOM 5035 C C . GLY B 1 5 ? 80.119 38.089 56.461 1.00 21.76 ? 25 GLY B C 1 +ATOM 5036 O O . GLY B 1 5 ? 80.145 37.748 57.637 1.00 20.29 ? 25 GLY B O 1 +ATOM 5037 N N . GLY B 1 6 ? 80.539 39.275 56.038 1.00 19.81 ? 26 GLY B N 1 +ATOM 5038 C CA . GLY B 1 6 ? 81.140 40.258 56.932 1.00 18.57 ? 26 GLY B CA 1 +ATOM 5039 C C . GLY B 1 6 ? 80.096 41.119 57.604 1.00 17.51 ? 26 GLY B C 1 +ATOM 5040 O O . GLY B 1 6 ? 78.915 41.022 57.292 1.00 17.58 ? 26 GLY B O 1 +ATOM 5041 N N . MET B 1 7 ? 80.551 41.953 58.534 1.00 16.60 ? 27 MET B N 1 +ATOM 5042 C CA . MET B 1 7 ? 79.693 42.900 59.245 1.00 16.42 ? 27 MET B CA 1 +ATOM 5043 C C . MET B 1 7 ? 80.550 44.099 59.659 1.00 15.47 ? 27 MET B C 1 +ATOM 5044 O O . MET B 1 7 ? 80.745 44.371 60.844 1.00 15.49 ? 27 MET B O 1 +ATOM 5045 C CB . MET B 1 7 ? 79.065 42.226 60.473 1.00 16.72 ? 27 MET B CB 1 +ATOM 5046 C CG . MET B 1 7 ? 77.870 42.986 61.063 1.00 17.49 ? 27 MET B CG 1 +ATOM 5047 S SD . MET B 1 7 ? 76.424 42.975 60.005 1.00 18.36 ? 27 MET B SD 1 +ATOM 5048 C CE . MET B 1 7 ? 76.108 41.228 59.877 1.00 18.91 ? 27 MET B CE 1 +ATOM 5049 N N . LEU B 1 8 ? 81.086 44.795 58.663 1.00 14.82 ? 28 LEU B N 1 +ATOM 5050 C CA . LEU B 1 8 ? 81.903 45.980 58.911 1.00 13.61 ? 28 LEU B CA 1 +ATOM 5051 C C . LEU B 1 8 ? 81.032 47.126 59.419 1.00 13.80 ? 28 LEU B C 1 +ATOM 5052 O O . LEU B 1 8 ? 79.897 47.293 58.986 1.00 12.78 ? 28 LEU B O 1 +ATOM 5053 C CB . LEU B 1 8 ? 82.645 46.397 57.644 1.00 13.81 ? 28 LEU B CB 1 +ATOM 5054 C CG . LEU B 1 8 ? 83.656 45.364 57.131 1.00 12.66 ? 28 LEU B CG 1 +ATOM 5055 C CD1 . LEU B 1 8 ? 84.119 45.750 55.740 1.00 14.27 ? 28 LEU B CD1 1 +ATOM 5056 C CD2 . LEU B 1 8 ? 84.846 45.205 58.095 1.00 11.80 ? 28 LEU B CD2 1 +ATOM 5057 N N . TYR B 1 9 ? 81.563 47.908 60.346 1.00 13.39 ? 29 TYR B N 1 +ATOM 5058 C CA . TYR B 1 9 ? 80.809 49.034 60.882 1.00 14.04 ? 29 TYR B CA 1 +ATOM 5059 C C . TYR B 1 9 ? 80.616 50.057 59.758 1.00 13.75 ? 29 TYR B C 1 +ATOM 5060 O O . TYR B 1 9 ? 81.593 50.531 59.175 1.00 13.51 ? 29 TYR B O 1 +ATOM 5061 C CB . TYR B 1 9 ? 81.523 49.675 62.071 1.00 14.91 ? 29 TYR B CB 1 +ATOM 5062 C CG . TYR B 1 9 ? 80.705 50.787 62.686 1.00 16.27 ? 29 TYR B CG 1 +ATOM 5063 C CD1 . TYR B 1 9 ? 79.543 50.507 63.389 1.00 16.25 ? 29 TYR B CD1 1 +ATOM 5064 C CD2 . TYR B 1 9 ? 81.072 52.119 62.524 1.00 18.20 ? 29 TYR B CD2 1 +ATOM 5065 C CE1 . TYR B 1 9 ? 78.767 51.528 63.946 1.00 17.54 ? 29 TYR B CE1 1 +ATOM 5066 C CE2 . TYR B 1 9 ? 80.312 53.141 63.069 1.00 17.95 ? 29 TYR B CE2 1 +ATOM 5067 C CZ . TYR B 1 9 ? 79.172 52.845 63.778 1.00 18.43 ? 29 TYR B CZ 1 +ATOM 5068 O OH . TYR B 1 9 ? 78.448 53.890 64.309 1.00 19.80 ? 29 TYR B OH 1 +ATOM 5069 N N . PRO B 1 10 ? 79.365 50.406 59.450 1.00 13.67 ? 30 PRO B N 1 +ATOM 5070 C CA . PRO B 1 10 ? 79.123 51.276 58.311 1.00 13.74 ? 30 PRO B CA 1 +ATOM 5071 C C . PRO B 1 10 ? 79.780 52.646 58.440 1.00 14.03 ? 30 PRO B C 1 +ATOM 5072 O O . PRO B 1 10 ? 79.794 53.228 59.524 1.00 13.86 ? 30 PRO B O 1 +ATOM 5073 C CB . PRO B 1 10 ? 77.601 51.429 58.288 1.00 13.57 ? 30 PRO B CB 1 +ATOM 5074 C CG . PRO B 1 10 ? 77.083 50.375 59.104 1.00 13.81 ? 30 PRO B CG 1 +ATOM 5075 C CD . PRO B 1 10 ? 78.110 50.025 60.114 1.00 13.77 ? 30 PRO B CD 1 +ATOM 5076 N N . GLN B 1 11 ? 80.296 53.151 57.325 1.00 14.18 ? 31 GLN B N 1 +ATOM 5077 C CA . GLN B 1 11 ? 80.928 54.468 57.280 1.00 14.53 ? 31 GLN B CA 1 +ATOM 5078 C C . GLN B 1 11 ? 80.673 55.084 55.926 1.00 14.61 ? 31 GLN B C 1 +ATOM 5079 O O . GLN B 1 11 ? 80.471 54.373 54.941 1.00 14.65 ? 31 GLN B O 1 +ATOM 5080 C CB . GLN B 1 11 ? 82.437 54.344 57.486 1.00 14.72 ? 31 GLN B CB 1 +ATOM 5081 C CG . GLN B 1 11 ? 83.099 53.396 56.491 1.00 16.12 ? 31 GLN B CG 1 +ATOM 5082 C CD . GLN B 1 11 ? 84.603 53.358 56.604 1.00 17.11 ? 31 GLN B CD 1 +ATOM 5083 O OE1 . GLN B 1 11 ? 85.313 53.572 55.610 1.00 17.04 ? 31 GLN B OE1 1 +ATOM 5084 N NE2 . GLN B 1 11 ? 85.107 53.093 57.808 1.00 15.32 ? 31 GLN B NE2 1 +ATOM 5085 N N . GLU B 1 12 ? 80.682 56.413 55.877 1.00 14.26 ? 32 GLU B N 1 +ATOM 5086 C CA . GLU B 1 12 ? 80.603 57.105 54.605 1.00 14.60 ? 32 GLU B CA 1 +ATOM 5087 C C . GLU B 1 12 ? 81.967 57.008 53.956 1.00 13.94 ? 32 GLU B C 1 +ATOM 5088 O O . GLU B 1 12 ? 82.990 57.022 54.639 1.00 14.46 ? 32 GLU B O 1 +ATOM 5089 C CB . GLU B 1 12 ? 80.233 58.576 54.775 1.00 14.92 ? 32 GLU B CB 1 +ATOM 5090 C CG . GLU B 1 12 ? 78.844 58.822 55.364 1.00 16.30 ? 32 GLU B CG 1 +ATOM 5091 C CD . GLU B 1 12 ? 78.852 59.064 56.859 1.00 18.78 ? 32 GLU B CD 1 +ATOM 5092 O OE1 . GLU B 1 12 ? 79.924 58.946 57.486 1.00 20.70 ? 32 GLU B OE1 1 +ATOM 5093 O OE2 . GLU B 1 12 ? 77.776 59.385 57.418 1.00 21.88 ? 32 GLU B OE2 1 +ATOM 5094 N N . SER B 1 13 ? 81.970 56.904 52.639 1.00 13.86 ? 33 SER B N 1 +ATOM 5095 C CA . SER B 1 13 ? 83.206 56.955 51.860 1.00 14.02 ? 33 SER B CA 1 +ATOM 5096 C C . SER B 1 13 ? 82.830 57.454 50.466 1.00 14.34 ? 33 SER B C 1 +ATOM 5097 O O . SER B 1 13 ? 81.646 57.599 50.173 1.00 14.41 ? 33 SER B O 1 +ATOM 5098 C CB . SER B 1 13 ? 83.860 55.575 51.794 1.00 13.59 ? 33 SER B CB 1 +ATOM 5099 O OG . SER B 1 13 ? 83.279 54.768 50.787 1.00 12.93 ? 33 SER B OG 1 +ATOM 5100 N N . PRO B 1 14 ? 83.820 57.741 49.606 1.00 14.54 ? 34 PRO B N 1 +ATOM 5101 C CA . PRO B 1 14 ? 83.487 58.132 48.238 1.00 14.91 ? 34 PRO B CA 1 +ATOM 5102 C C . PRO B 1 14 ? 82.458 57.244 47.527 1.00 15.00 ? 34 PRO B C 1 +ATOM 5103 O O . PRO B 1 14 ? 81.745 57.729 46.644 1.00 15.97 ? 34 PRO B O 1 +ATOM 5104 C CB . PRO B 1 14 ? 84.841 58.062 47.538 1.00 14.91 ? 34 PRO B CB 1 +ATOM 5105 C CG . PRO B 1 14 ? 85.798 58.385 48.588 1.00 14.95 ? 34 PRO B CG 1 +ATOM 5106 C CD . PRO B 1 14 ? 85.277 57.774 49.834 1.00 14.77 ? 34 PRO B CD 1 +ATOM 5107 N N . SER B 1 15 ? 82.379 55.965 47.915 1.00 14.75 ? 35 SER B N 1 +ATOM 5108 C CA . SER B 1 15 ? 81.438 54.998 47.341 1.00 14.17 ? 35 SER B CA 1 +ATOM 5109 C C . SER B 1 15 ? 80.287 54.578 48.263 1.00 13.64 ? 35 SER B C 1 +ATOM 5110 O O . SER B 1 15 ? 79.499 53.714 47.881 1.00 14.10 ? 35 SER B O 1 +ATOM 5111 C CB . SER B 1 15 ? 82.192 53.719 46.959 1.00 13.76 ? 35 SER B CB 1 +ATOM 5112 O OG . SER B 1 15 ? 82.682 53.088 48.127 1.00 14.18 ? 35 SER B OG 1 +ATOM 5113 N N . ARG B 1 16 ? 80.189 55.150 49.463 1.00 13.43 ? 36 ARG B N 1 +ATOM 5114 C CA . ARG B 1 16 ? 79.178 54.702 50.440 1.00 13.38 ? 36 ARG B CA 1 +ATOM 5115 C C . ARG B 1 16 ? 78.510 55.873 51.156 1.00 13.14 ? 36 ARG B C 1 +ATOM 5116 O O . ARG B 1 16 ? 79.188 56.792 51.601 1.00 13.08 ? 36 ARG B O 1 +ATOM 5117 C CB . ARG B 1 16 ? 79.810 53.785 51.499 1.00 13.00 ? 36 ARG B CB 1 +ATOM 5118 C CG . ARG B 1 16 ? 80.647 52.665 50.944 1.00 12.98 ? 36 ARG B CG 1 +ATOM 5119 C CD . ARG B 1 16 ? 80.997 51.630 52.007 1.00 12.50 ? 36 ARG B CD 1 +ATOM 5120 N NE . ARG B 1 16 ? 81.476 50.387 51.397 1.00 12.28 ? 36 ARG B NE 1 +ATOM 5121 C CZ . ARG B 1 16 ? 81.544 49.209 52.019 1.00 12.44 ? 36 ARG B CZ 1 +ATOM 5122 N NH1 . ARG B 1 16 ? 81.173 49.073 53.290 1.00 12.55 ? 36 ARG B NH1 1 +ATOM 5123 N NH2 . ARG B 1 16 ? 81.988 48.146 51.361 1.00 12.33 ? 36 ARG B NH2 1 +ATOM 5124 N N . GLU B 1 17 ? 77.188 55.798 51.283 1.00 12.67 ? 37 GLU B N 1 +ATOM 5125 C CA . GLU B 1 17 ? 76.404 56.762 52.049 1.00 13.41 ? 37 GLU B CA 1 +ATOM 5126 C C . GLU B 1 17 ? 75.829 56.072 53.268 1.00 13.95 ? 37 GLU B C 1 +ATOM 5127 O O . GLU B 1 17 ? 75.680 54.845 53.268 1.00 13.77 ? 37 GLU B O 1 +ATOM 5128 C CB . GLU B 1 17 ? 75.259 57.302 51.195 1.00 12.59 ? 37 GLU B CB 1 +ATOM 5129 C CG . GLU B 1 17 ? 75.739 58.041 49.963 1.00 14.65 ? 37 GLU B CG 1 +ATOM 5130 C CD . GLU B 1 17 ? 74.613 58.588 49.125 1.00 16.14 ? 37 GLU B CD 1 +ATOM 5131 O OE1 . GLU B 1 17 ? 73.610 59.078 49.690 1.00 16.97 ? 37 GLU B OE1 1 +ATOM 5132 O OE2 . GLU B 1 17 ? 74.738 58.541 47.889 1.00 17.92 ? 37 GLU B OE2 1 +ATOM 5133 N N . CYS B 1 18 ? 75.532 56.858 54.305 1.00 14.59 ? 38 CYS B N 1 +ATOM 5134 C CA . CYS B 1 18 ? 74.768 56.385 55.458 1.00 15.78 ? 38 CYS B CA 1 +ATOM 5135 C C . CYS B 1 18 ? 73.653 57.352 55.803 1.00 15.89 ? 38 CYS B C 1 +ATOM 5136 O O . CYS B 1 18 ? 73.823 58.582 55.744 1.00 15.98 ? 38 CYS B O 1 +ATOM 5137 C CB . CYS B 1 18 ? 75.639 56.279 56.694 1.00 16.20 ? 38 CYS B CB 1 +ATOM 5138 S SG . CYS B 1 18 ? 77.138 55.444 56.460 1.00 20.98 ? 38 CYS B SG 1 +ATOM 5139 N N . LYS B 1 19 ? 72.526 56.790 56.215 1.00 15.83 ? 39 LYS B N 1 +ATOM 5140 C CA . LYS B 1 19 ? 71.406 57.569 56.718 1.00 16.15 ? 39 LYS B CA 1 +ATOM 5141 C C . LYS B 1 19 ? 70.895 56.933 58.000 1.00 16.56 ? 39 LYS B C 1 +ATOM 5142 O O . LYS B 1 19 ? 70.335 55.845 57.978 1.00 16.12 ? 39 LYS B O 1 +ATOM 5143 C CB . LYS B 1 19 ? 70.295 57.650 55.683 1.00 16.48 ? 39 LYS B CB 1 +ATOM 5144 C CG . LYS B 1 19 ? 69.089 58.475 56.112 1.00 17.01 ? 39 LYS B CG 1 +ATOM 5145 C CD . LYS B 1 19 ? 68.195 58.772 54.920 1.00 20.50 ? 39 LYS B CD 1 +ATOM 5146 C CE . LYS B 1 19 ? 67.134 59.819 55.241 1.00 21.58 ? 39 LYS B CE 1 +ATOM 5147 N NZ . LYS B 1 19 ? 66.101 59.283 56.149 1.00 24.35 ? 39 LYS B NZ 1 +ATOM 5148 N N . GLU B 1 20 ? 71.103 57.635 59.111 1.00 16.88 ? 40 GLU B N 1 +ATOM 5149 C CA . GLU B 1 20 ? 70.643 57.213 60.425 1.00 16.96 ? 40 GLU B CA 1 +ATOM 5150 C C . GLU B 1 20 ? 69.135 57.414 60.543 1.00 16.22 ? 40 GLU B C 1 +ATOM 5151 O O . GLU B 1 20 ? 68.605 58.438 60.104 1.00 15.61 ? 40 GLU B O 1 +ATOM 5152 C CB . GLU B 1 20 ? 71.329 58.045 61.518 1.00 17.68 ? 40 GLU B CB 1 +ATOM 5153 C CG . GLU B 1 20 ? 72.875 58.022 61.489 1.00 20.39 ? 40 GLU B CG 1 +ATOM 5154 C CD . GLU B 1 20 ? 73.503 59.183 60.715 1.00 23.58 ? 40 GLU B CD 1 +ATOM 5155 O OE1 . GLU B 1 20 ? 72.817 59.790 59.856 1.00 25.86 ? 40 GLU B OE1 1 +ATOM 5156 O OE2 . GLU B 1 20 ? 74.703 59.479 60.964 1.00 26.20 ? 40 GLU B OE2 1 +ATOM 5157 N N . LEU B 1 21 ? 68.457 56.432 61.137 1.00 15.65 ? 41 LEU B N 1 +ATOM 5158 C CA . LEU B 1 21 ? 67.017 56.505 61.398 1.00 15.27 ? 41 LEU B CA 1 +ATOM 5159 C C . LEU B 1 21 ? 66.740 56.655 62.895 1.00 15.06 ? 41 LEU B C 1 +ATOM 5160 O O . LEU B 1 21 ? 65.877 55.981 63.449 1.00 15.52 ? 41 LEU B O 1 +ATOM 5161 C CB . LEU B 1 21 ? 66.306 55.260 60.849 1.00 15.49 ? 41 LEU B CB 1 +ATOM 5162 C CG . LEU B 1 21 ? 66.478 55.000 59.347 1.00 15.52 ? 41 LEU B CG 1 +ATOM 5163 C CD1 . LEU B 1 21 ? 65.808 53.688 58.935 1.00 15.43 ? 41 LEU B CD1 1 +ATOM 5164 C CD2 . LEU B 1 21 ? 65.940 56.165 58.527 1.00 17.42 ? 41 LEU B CD2 1 +ATOM 5165 N N . ASP B 1 22 ? 67.464 57.552 63.555 1.00 14.51 ? 42 ASP B N 1 +ATOM 5166 C CA . ASP B 1 22 ? 67.219 57.847 64.963 1.00 14.17 ? 42 ASP B CA 1 +ATOM 5167 C C . ASP B 1 22 ? 66.045 58.807 65.087 1.00 13.61 ? 42 ASP B C 1 +ATOM 5168 O O . ASP B 1 22 ? 65.661 59.464 64.120 1.00 14.48 ? 42 ASP B O 1 +ATOM 5169 C CB . ASP B 1 22 ? 68.457 58.457 65.634 1.00 14.95 ? 42 ASP B CB 1 +ATOM 5170 C CG . ASP B 1 22 ? 69.671 57.525 65.603 1.00 16.22 ? 42 ASP B CG 1 +ATOM 5171 O OD1 . ASP B 1 22 ? 69.508 56.316 65.383 1.00 19.28 ? 42 ASP B OD1 1 +ATOM 5172 O OD2 . ASP B 1 22 ? 70.805 58.015 65.792 1.00 20.48 ? 42 ASP B OD2 1 +ATOM 5173 N N . GLY B 1 23 ? 65.475 58.879 66.280 1.00 12.09 ? 43 GLY B N 1 +ATOM 5174 C CA . GLY B 1 23 ? 64.350 59.771 66.553 1.00 11.59 ? 43 GLY B CA 1 +ATOM 5175 C C . GLY B 1 23 ? 63.098 58.982 66.850 1.00 10.69 ? 43 GLY B C 1 +ATOM 5176 O O . GLY B 1 23 ? 63.153 57.883 67.436 1.00 10.68 ? 43 GLY B O 1 +ATOM 5177 N N . LEU B 1 24 ? 61.958 59.509 66.419 1.00 10.58 ? 44 LEU B N 1 +ATOM 5178 C CA . LEU B 1 24 ? 60.682 58.900 66.773 1.00 10.76 ? 44 LEU B CA 1 +ATOM 5179 C C . LEU B 1 24 ? 60.253 57.789 65.807 1.00 10.68 ? 44 LEU B C 1 +ATOM 5180 O O . LEU B 1 24 ? 60.270 57.958 64.570 1.00 10.23 ? 44 LEU B O 1 +ATOM 5181 C CB . LEU B 1 24 ? 59.603 59.976 66.854 1.00 11.06 ? 44 LEU B CB 1 +ATOM 5182 C CG . LEU B 1 24 ? 59.894 61.123 67.827 1.00 11.94 ? 44 LEU B CG 1 +ATOM 5183 C CD1 . LEU B 1 24 ? 58.778 62.158 67.814 1.00 13.89 ? 44 LEU B CD1 1 +ATOM 5184 C CD2 . LEU B 1 24 ? 60.140 60.589 69.237 1.00 13.00 ? 44 LEU B CD2 1 +ATOM 5185 N N . TRP B 1 25 ? 59.890 56.648 66.389 1.00 10.32 ? 45 TRP B N 1 +ATOM 5186 C CA . TRP B 1 25 ? 59.251 55.553 65.671 1.00 10.38 ? 45 TRP B CA 1 +ATOM 5187 C C . TRP B 1 25 ? 57.872 55.316 66.288 1.00 10.77 ? 45 TRP B C 1 +ATOM 5188 O O . TRP B 1 25 ? 57.657 55.646 67.450 1.00 10.96 ? 45 TRP B O 1 +ATOM 5189 C CB . TRP B 1 25 ? 60.074 54.284 65.814 1.00 10.53 ? 45 TRP B CB 1 +ATOM 5190 C CG . TRP B 1 25 ? 61.352 54.243 65.024 1.00 9.73 ? 45 TRP B CG 1 +ATOM 5191 C CD1 . TRP B 1 25 ? 62.377 55.135 65.074 1.00 11.59 ? 45 TRP B CD1 1 +ATOM 5192 C CD2 . TRP B 1 25 ? 61.766 53.200 64.132 1.00 10.66 ? 45 TRP B CD2 1 +ATOM 5193 N NE1 . TRP B 1 25 ? 63.394 54.731 64.237 1.00 9.96 ? 45 TRP B NE1 1 +ATOM 5194 C CE2 . TRP B 1 25 ? 63.046 53.542 63.651 1.00 10.24 ? 45 TRP B CE2 1 +ATOM 5195 C CE3 . TRP B 1 25 ? 61.172 52.020 63.680 1.00 11.00 ? 45 TRP B CE3 1 +ATOM 5196 C CZ2 . TRP B 1 25 ? 63.739 52.743 62.735 1.00 9.49 ? 45 TRP B CZ2 1 +ATOM 5197 C CZ3 . TRP B 1 25 ? 61.856 51.223 62.768 1.00 10.36 ? 45 TRP B CZ3 1 +ATOM 5198 C CH2 . TRP B 1 25 ? 63.134 51.586 62.306 1.00 10.56 ? 45 TRP B CH2 1 +ATOM 5199 N N . SER B 1 26 ? 56.950 54.741 65.521 1.00 10.89 ? 46 SER B N 1 +ATOM 5200 C CA . SER B 1 26 ? 55.648 54.351 66.061 1.00 11.35 ? 46 SER B CA 1 +ATOM 5201 C C . SER B 1 26 ? 55.836 53.036 66.780 1.00 10.44 ? 46 SER B C 1 +ATOM 5202 O O . SER B 1 26 ? 56.656 52.236 66.356 1.00 10.89 ? 46 SER B O 1 +ATOM 5203 C CB . SER B 1 26 ? 54.616 54.210 64.948 1.00 11.53 ? 46 SER B CB 1 +ATOM 5204 O OG . SER B 1 26 ? 54.331 55.485 64.412 1.00 13.97 ? 46 SER B OG 1 +ATOM 5205 N N . PHE B 1 27 ? 55.061 52.803 67.834 1.00 10.45 ? 47 PHE B N 1 +ATOM 5206 C CA . PHE B 1 27 ? 55.299 51.675 68.746 1.00 10.45 ? 47 PHE B CA 1 +ATOM 5207 C C . PHE B 1 27 ? 53.989 51.148 69.343 1.00 10.65 ? 47 PHE B C 1 +ATOM 5208 O O . PHE B 1 27 ? 53.071 51.917 69.639 1.00 10.51 ? 47 PHE B O 1 +ATOM 5209 C CB . PHE B 1 27 ? 56.270 52.132 69.845 1.00 10.17 ? 47 PHE B CB 1 +ATOM 5210 C CG . PHE B 1 27 ? 56.557 51.104 70.918 1.00 10.65 ? 47 PHE B CG 1 +ATOM 5211 C CD1 . PHE B 1 27 ? 55.754 51.023 72.044 1.00 10.50 ? 47 PHE B CD1 1 +ATOM 5212 C CD2 . PHE B 1 27 ? 57.676 50.272 70.838 1.00 10.72 ? 47 PHE B CD2 1 +ATOM 5213 C CE1 . PHE B 1 27 ? 56.019 50.119 73.059 1.00 10.92 ? 47 PHE B CE1 1 +ATOM 5214 C CE2 . PHE B 1 27 ? 57.956 49.359 71.852 1.00 10.79 ? 47 PHE B CE2 1 +ATOM 5215 C CZ . PHE B 1 27 ? 57.117 49.274 72.963 1.00 10.55 ? 47 PHE B CZ 1 +ATOM 5216 N N . ARG B 1 28 ? 53.910 49.827 69.480 1.00 11.56 ? 48 ARG B N 1 +ATOM 5217 C CA . ARG B 1 28 ? 52.834 49.175 70.199 1.00 12.82 ? 48 ARG B CA 1 +ATOM 5218 C C . ARG B 1 28 ? 53.359 47.869 70.755 1.00 11.64 ? 48 ARG B C 1 +ATOM 5219 O O . ARG B 1 28 ? 54.008 47.101 70.038 1.00 11.40 ? 48 ARG B O 1 +ATOM 5220 C CB . ARG B 1 28 ? 51.642 48.879 69.274 1.00 13.30 ? 48 ARG B CB 1 +ATOM 5221 C CG . ARG B 1 28 ? 50.449 48.222 69.991 1.00 15.84 ? 48 ARG B CG 1 +ATOM 5222 C CD . ARG B 1 28 ? 49.322 47.767 69.055 1.00 15.89 ? 48 ARG B CD 1 +ATOM 5223 N NE . ARG B 1 28 ? 48.983 48.768 68.040 1.00 18.91 ? 48 ARG B NE 1 +ATOM 5224 C CZ . ARG B 1 28 ? 48.830 48.524 66.738 1.00 21.49 ? 48 ARG B CZ 1 +ATOM 5225 N NH1 . ARG B 1 28 ? 48.970 47.299 66.232 1.00 23.06 ? 48 ARG B NH1 1 +ATOM 5226 N NH2 . ARG B 1 28 ? 48.522 49.516 65.928 1.00 21.92 ? 48 ARG B NH2 1 +ATOM 5227 N N . ALA B 1 29 ? 53.088 47.619 72.033 1.00 10.85 ? 49 ALA B N 1 +ATOM 5228 C CA . ALA B 1 29 ? 53.315 46.285 72.585 1.00 10.41 ? 49 ALA B CA 1 +ATOM 5229 C C . ALA B 1 29 ? 52.041 45.484 72.357 1.00 10.81 ? 49 ALA B C 1 +ATOM 5230 O O . ALA B 1 29 ? 50.934 46.028 72.480 1.00 11.23 ? 49 ALA B O 1 +ATOM 5231 C CB . ALA B 1 29 ? 53.648 46.353 74.043 1.00 10.62 ? 49 ALA B CB 1 +ATOM 5232 N N . ASP B 1 30 ? 52.205 44.212 71.999 1.00 10.19 ? 50 ASP B N 1 +ATOM 5233 C CA . ASP B 1 30 ? 51.063 43.311 71.763 1.00 10.14 ? 50 ASP B CA 1 +ATOM 5234 C C . ASP B 1 30 ? 50.720 42.564 73.054 1.00 10.23 ? 50 ASP B C 1 +ATOM 5235 O O . ASP B 1 30 ? 51.328 41.540 73.385 1.00 9.79 ? 50 ASP B O 1 +ATOM 5236 C CB . ASP B 1 30 ? 51.375 42.345 70.620 1.00 10.10 ? 50 ASP B CB 1 +ATOM 5237 C CG . ASP B 1 30 ? 50.267 41.323 70.373 1.00 11.09 ? 50 ASP B CG 1 +ATOM 5238 O OD1 . ASP B 1 30 ? 49.200 41.409 71.013 1.00 9.78 ? 50 ASP B OD1 1 +ATOM 5239 O OD2 . ASP B 1 30 ? 50.484 40.435 69.535 1.00 12.26 ? 50 ASP B OD2 1 +ATOM 5240 N N . PHE B 1 31 ? 49.715 43.087 73.754 1.00 10.18 ? 51 PHE B N 1 +ATOM 5241 C CA . PHE B 1 31 ? 49.273 42.564 75.032 1.00 11.77 ? 51 PHE B CA 1 +ATOM 5242 C C . PHE B 1 31 ? 48.210 41.470 74.892 1.00 11.88 ? 51 PHE B C 1 +ATOM 5243 O O . PHE B 1 31 ? 47.586 41.093 75.882 1.00 12.82 ? 51 PHE B O 1 +ATOM 5244 C CB . PHE B 1 31 ? 48.696 43.698 75.882 1.00 12.32 ? 51 PHE B CB 1 +ATOM 5245 C CG . PHE B 1 31 ? 49.731 44.636 76.430 1.00 13.86 ? 51 PHE B CG 1 +ATOM 5246 C CD1 . PHE B 1 31 ? 50.455 44.298 77.562 1.00 16.40 ? 51 PHE B CD1 1 +ATOM 5247 C CD2 . PHE B 1 31 ? 49.936 45.885 75.847 1.00 15.41 ? 51 PHE B CD2 1 +ATOM 5248 C CE1 . PHE B 1 31 ? 51.403 45.182 78.089 1.00 16.17 ? 51 PHE B CE1 1 +ATOM 5249 C CE2 . PHE B 1 31 ? 50.883 46.768 76.367 1.00 17.24 ? 51 PHE B CE2 1 +ATOM 5250 C CZ . PHE B 1 31 ? 51.610 46.413 77.487 1.00 15.47 ? 51 PHE B CZ 1 +ATOM 5251 N N . SER B 1 32 ? 47.999 40.957 73.684 1.00 12.15 ? 52 SER B N 1 +ATOM 5252 C CA . SER B 1 32 ? 47.084 39.825 73.492 1.00 12.43 ? 52 SER B CA 1 +ATOM 5253 C C . SER B 1 32 ? 47.483 38.645 74.373 1.00 12.93 ? 52 SER B C 1 +ATOM 5254 O O . SER B 1 32 ? 48.666 38.407 74.591 1.00 12.98 ? 52 SER B O 1 +ATOM 5255 C CB . SER B 1 32 ? 47.033 39.403 72.024 1.00 12.16 ? 52 SER B CB 1 +ATOM 5256 O OG . SER B 1 32 ? 48.288 38.951 71.535 1.00 12.13 ? 52 SER B OG 1 +ATOM 5257 N N . ASP B 1 33 ? 46.504 37.914 74.899 1.00 13.20 ? 53 ASP B N 1 +ATOM 5258 C CA . ASP B 1 33 ? 46.802 36.842 75.854 1.00 13.31 ? 53 ASP B CA 1 +ATOM 5259 C C . ASP B 1 33 ? 47.772 35.821 75.273 1.00 13.39 ? 53 ASP B C 1 +ATOM 5260 O O . ASP B 1 33 ? 48.691 35.364 75.961 1.00 13.50 ? 53 ASP B O 1 +ATOM 5261 C CB . ASP B 1 33 ? 45.515 36.139 76.302 1.00 14.02 ? 53 ASP B CB 1 +ATOM 5262 C CG . ASP B 1 33 ? 44.738 36.929 77.310 1.00 15.78 ? 53 ASP B CG 1 +ATOM 5263 O OD1 . ASP B 1 33 ? 45.346 37.737 78.035 1.00 17.65 ? 53 ASP B OD1 1 +ATOM 5264 O OD2 . ASP B 1 33 ? 43.502 36.737 77.386 1.00 19.85 ? 53 ASP B OD2 1 +ATOM 5265 N N . ASN B 1 34 ? 47.602 35.470 74.005 1.00 13.03 ? 54 ASN B N 1 +ATOM 5266 C CA . ASN B 1 34 ? 48.521 34.502 73.391 1.00 13.24 ? 54 ASN B CA 1 +ATOM 5267 C C . ASN B 1 34 ? 49.733 35.195 72.766 1.00 12.82 ? 54 ASN B C 1 +ATOM 5268 O O . ASN B 1 34 ? 50.562 34.541 72.136 1.00 12.57 ? 54 ASN B O 1 +ATOM 5269 C CB . ASN B 1 34 ? 47.821 33.560 72.398 1.00 13.64 ? 54 ASN B CB 1 +ATOM 5270 C CG . ASN B 1 34 ? 47.374 34.257 71.120 1.00 14.51 ? 54 ASN B CG 1 +ATOM 5271 O OD1 . ASN B 1 34 ? 47.587 35.461 70.931 1.00 14.08 ? 54 ASN B OD1 1 +ATOM 5272 N ND2 . ASN B 1 34 ? 46.727 33.491 70.234 1.00 16.27 ? 54 ASN B ND2 1 +ATOM 5273 N N . ARG B 1 35 ? 49.808 36.518 72.947 1.00 13.26 ? 55 ARG B N 1 +ATOM 5274 C CA . ARG B 1 35 ? 50.953 37.346 72.535 1.00 13.24 ? 55 ARG B CA 1 +ATOM 5275 C C . ARG B 1 35 ? 51.236 37.294 71.025 1.00 13.61 ? 55 ARG B C 1 +ATOM 5276 O O . ARG B 1 35 ? 52.303 37.716 70.557 1.00 12.49 ? 55 ARG B O 1 +ATOM 5277 C CB . ARG B 1 35 ? 52.202 36.950 73.350 1.00 13.18 ? 55 ARG B CB 1 +ATOM 5278 C CG . ARG B 1 35 ? 52.057 37.190 74.840 1.00 13.09 ? 55 ARG B CG 1 +ATOM 5279 C CD . ARG B 1 35 ? 52.013 38.690 75.140 1.00 13.36 ? 55 ARG B CD 1 +ATOM 5280 N NE . ARG B 1 35 ? 52.248 39.032 76.547 1.00 13.50 ? 55 ARG B NE 1 +ATOM 5281 C CZ . ARG B 1 35 ? 51.317 39.404 77.431 1.00 14.99 ? 55 ARG B CZ 1 +ATOM 5282 N NH1 . ARG B 1 35 ? 50.026 39.442 77.122 1.00 16.85 ? 55 ARG B NH1 1 +ATOM 5283 N NH2 . ARG B 1 35 ? 51.682 39.707 78.670 1.00 14.55 ? 55 ARG B NH2 1 +ATOM 5284 N N . ARG B 1 36 ? 50.244 36.823 70.270 1.00 13.62 ? 56 ARG B N 1 +ATOM 5285 C CA . ARG B 1 36 ? 50.410 36.467 68.873 1.00 14.27 ? 56 ARG B CA 1 +ATOM 5286 C C . ARG B 1 36 ? 49.470 37.250 67.952 1.00 13.46 ? 56 ARG B C 1 +ATOM 5287 O O . ARG B 1 36 ? 49.490 37.044 66.745 1.00 13.14 ? 56 ARG B O 1 +ATOM 5288 C CB . ARG B 1 36 ? 50.121 34.961 68.732 1.00 15.61 ? 56 ARG B CB 1 +ATOM 5289 C CG . ARG B 1 36 ? 51.068 34.209 67.854 1.00 19.34 ? 56 ARG B CG 1 +ATOM 5290 C CD . ARG B 1 36 ? 51.195 32.712 68.228 1.00 22.02 ? 56 ARG B CD 1 +ATOM 5291 N NE . ARG B 1 36 ? 49.962 32.076 68.729 1.00 24.92 ? 56 ARG B NE 1 +ATOM 5292 C CZ . ARG B 1 36 ? 49.772 31.626 69.975 1.00 24.81 ? 56 ARG B CZ 1 +ATOM 5293 N NH1 . ARG B 1 36 ? 50.720 31.723 70.904 1.00 24.18 ? 56 ARG B NH1 1 +ATOM 5294 N NH2 . ARG B 1 36 ? 48.611 31.054 70.299 1.00 24.92 ? 56 ARG B NH2 1 +ATOM 5295 N N . ARG B 1 37 ? 48.659 38.145 68.515 1.00 12.74 ? 57 ARG B N 1 +ATOM 5296 C CA . ARG B 1 37 ? 47.631 38.859 67.751 1.00 13.34 ? 57 ARG B CA 1 +ATOM 5297 C C . ARG B 1 37 ? 48.204 39.562 66.526 1.00 12.69 ? 57 ARG B C 1 +ATOM 5298 O O . ARG B 1 37 ? 47.593 39.557 65.460 1.00 12.81 ? 57 ARG B O 1 +ATOM 5299 C CB . ARG B 1 37 ? 46.892 39.858 68.654 1.00 13.29 ? 57 ARG B CB 1 +ATOM 5300 C CG . ARG B 1 37 ? 45.777 40.639 67.951 1.00 14.16 ? 57 ARG B CG 1 +ATOM 5301 C CD . ARG B 1 37 ? 44.937 41.491 68.903 1.00 16.33 ? 57 ARG B CD 1 +ATOM 5302 N NE . ARG B 1 37 ? 43.818 42.120 68.187 1.00 18.94 ? 57 ARG B NE 1 +ATOM 5303 C CZ . ARG B 1 37 ? 42.863 42.873 68.740 1.00 21.15 ? 57 ARG B CZ 1 +ATOM 5304 N NH1 . ARG B 1 37 ? 42.861 43.137 70.038 1.00 22.92 ? 57 ARG B NH1 1 +ATOM 5305 N NH2 . ARG B 1 37 ? 41.894 43.376 67.976 1.00 22.61 ? 57 ARG B NH2 1 +ATOM 5306 N N . GLY B 1 38 ? 49.381 40.169 66.680 1.00 11.91 ? 58 GLY B N 1 +ATOM 5307 C CA . GLY B 1 38 ? 49.994 40.916 65.588 1.00 11.74 ? 58 GLY B CA 1 +ATOM 5308 C C . GLY B 1 38 ? 50.363 40.058 64.397 1.00 11.44 ? 58 GLY B C 1 +ATOM 5309 O O . GLY B 1 38 ? 50.348 40.537 63.257 1.00 11.71 ? 58 GLY B O 1 +ATOM 5310 N N . PHE B 1 39 ? 50.688 38.792 64.646 1.00 11.02 ? 59 PHE B N 1 +ATOM 5311 C CA . PHE B 1 39 ? 50.962 37.868 63.550 1.00 11.44 ? 59 PHE B CA 1 +ATOM 5312 C C . PHE B 1 39 ? 49.652 37.368 62.948 1.00 11.86 ? 59 PHE B C 1 +ATOM 5313 O O . PHE B 1 39 ? 49.486 37.390 61.725 1.00 11.93 ? 59 PHE B O 1 +ATOM 5314 C CB . PHE B 1 39 ? 51.868 36.731 64.016 1.00 11.66 ? 59 PHE B CB 1 +ATOM 5315 C CG . PHE B 1 39 ? 53.251 37.203 64.381 1.00 11.02 ? 59 PHE B CG 1 +ATOM 5316 C CD1 . PHE B 1 39 ? 54.204 37.417 63.402 1.00 13.55 ? 59 PHE B CD1 1 +ATOM 5317 C CD2 . PHE B 1 39 ? 53.565 37.506 65.685 1.00 11.54 ? 59 PHE B CD2 1 +ATOM 5318 C CE1 . PHE B 1 39 ? 55.476 37.894 63.730 1.00 13.43 ? 59 PHE B CE1 1 +ATOM 5319 C CE2 . PHE B 1 39 ? 54.837 37.971 66.018 1.00 12.90 ? 59 PHE B CE2 1 +ATOM 5320 C CZ . PHE B 1 39 ? 55.782 38.161 65.037 1.00 12.27 ? 59 PHE B CZ 1 +ATOM 5321 N N . GLU B 1 40 ? 48.723 36.951 63.809 1.00 12.47 ? 60 GLU B N 1 +ATOM 5322 C CA . GLU B 1 40 ? 47.396 36.476 63.375 1.00 12.52 ? 60 GLU B CA 1 +ATOM 5323 C C . GLU B 1 40 ? 46.715 37.498 62.460 1.00 12.67 ? 60 GLU B C 1 +ATOM 5324 O O . GLU B 1 40 ? 46.133 37.143 61.415 1.00 12.51 ? 60 GLU B O 1 +ATOM 5325 C CB . GLU B 1 40 ? 46.497 36.195 64.586 1.00 12.66 ? 60 GLU B CB 1 +ATOM 5326 C CG . GLU B 1 40 ? 46.947 35.027 65.469 1.00 12.78 ? 60 GLU B CG 1 +ATOM 5327 C CD . GLU B 1 40 ? 46.093 34.841 66.715 1.00 14.06 ? 60 GLU B CD 1 +ATOM 5328 O OE1 . GLU B 1 40 ? 45.204 35.668 66.985 1.00 17.52 ? 60 GLU B OE1 1 +ATOM 5329 O OE2 . GLU B 1 40 ? 46.335 33.860 67.437 1.00 18.54 ? 60 GLU B OE2 1 +ATOM 5330 N N . GLU B 1 41 ? 46.799 38.766 62.851 1.00 12.27 ? 61 GLU B N 1 +ATOM 5331 C CA . GLU B 1 41 ? 46.205 39.872 62.101 1.00 13.09 ? 61 GLU B CA 1 +ATOM 5332 C C . GLU B 1 41 ? 47.123 40.493 61.041 1.00 13.14 ? 61 GLU B C 1 +ATOM 5333 O O . GLU B 1 41 ? 46.749 41.473 60.397 1.00 13.84 ? 61 GLU B O 1 +ATOM 5334 C CB . GLU B 1 41 ? 45.745 40.963 63.070 1.00 13.22 ? 61 GLU B CB 1 +ATOM 5335 C CG . GLU B 1 41 ? 44.639 40.506 63.999 1.00 14.03 ? 61 GLU B CG 1 +ATOM 5336 C CD . GLU B 1 41 ? 44.002 41.626 64.772 1.00 15.61 ? 61 GLU B CD 1 +ATOM 5337 O OE1 . GLU B 1 41 ? 44.638 42.675 64.976 1.00 13.65 ? 61 GLU B OE1 1 +ATOM 5338 O OE2 . GLU B 1 41 ? 42.853 41.448 65.210 1.00 16.18 ? 61 GLU B OE2 1 +ATOM 5339 N N . GLN B 1 42 ? 48.325 39.950 60.885 1.00 12.98 ? 62 GLN B N 1 +ATOM 5340 C CA . GLN B 1 42 ? 49.259 40.399 59.859 1.00 13.01 ? 62 GLN B CA 1 +ATOM 5341 C C . GLN B 1 42 ? 49.454 41.927 59.900 1.00 13.04 ? 62 GLN B C 1 +ATOM 5342 O O . GLN B 1 42 ? 49.328 42.598 58.878 1.00 13.07 ? 62 GLN B O 1 +ATOM 5343 C CB . GLN B 1 42 ? 48.774 39.967 58.464 1.00 12.98 ? 62 GLN B CB 1 +ATOM 5344 C CG . GLN B 1 42 ? 48.456 38.477 58.290 1.00 13.21 ? 62 GLN B CG 1 +ATOM 5345 C CD . GLN B 1 42 ? 47.846 38.179 56.925 1.00 12.80 ? 62 GLN B CD 1 +ATOM 5346 O OE1 . GLN B 1 42 ? 48.547 38.142 55.906 1.00 13.16 ? 62 GLN B OE1 1 +ATOM 5347 N NE2 . GLN B 1 42 ? 46.536 37.955 56.899 1.00 11.18 ? 62 GLN B NE2 1 +ATOM 5348 N N . TRP B 1 43 ? 49.754 42.482 61.078 1.00 12.60 ? 63 TRP B N 1 +ATOM 5349 C CA . TRP B 1 43 ? 49.842 43.941 61.222 1.00 12.63 ? 63 TRP B CA 1 +ATOM 5350 C C . TRP B 1 43 ? 50.811 44.576 60.233 1.00 12.56 ? 63 TRP B C 1 +ATOM 5351 O O . TRP B 1 43 ? 50.571 45.680 59.738 1.00 13.07 ? 63 TRP B O 1 +ATOM 5352 C CB . TRP B 1 43 ? 50.274 44.349 62.637 1.00 12.47 ? 63 TRP B CB 1 +ATOM 5353 C CG . TRP B 1 43 ? 49.284 44.070 63.728 1.00 12.02 ? 63 TRP B CG 1 +ATOM 5354 C CD1 . TRP B 1 43 ? 47.961 43.736 63.583 1.00 11.58 ? 63 TRP B CD1 1 +ATOM 5355 C CD2 . TRP B 1 43 ? 49.525 44.157 65.135 1.00 10.87 ? 63 TRP B CD2 1 +ATOM 5356 N NE1 . TRP B 1 43 ? 47.378 43.579 64.815 1.00 11.68 ? 63 TRP B NE1 1 +ATOM 5357 C CE2 . TRP B 1 43 ? 48.314 43.824 65.787 1.00 11.54 ? 63 TRP B CE2 1 +ATOM 5358 C CE3 . TRP B 1 43 ? 50.658 44.452 65.913 1.00 11.59 ? 63 TRP B CE3 1 +ATOM 5359 C CZ2 . TRP B 1 43 ? 48.203 43.774 67.176 1.00 10.86 ? 63 TRP B CZ2 1 +ATOM 5360 C CZ3 . TRP B 1 43 ? 50.547 44.408 67.299 1.00 11.58 ? 63 TRP B CZ3 1 +ATOM 5361 C CH2 . TRP B 1 43 ? 49.325 44.075 67.920 1.00 12.09 ? 63 TRP B CH2 1 +ATOM 5362 N N . TYR B 1 44 ? 51.908 43.875 59.970 1.00 12.97 ? 64 TYR B N 1 +ATOM 5363 C CA . TYR B 1 44 ? 52.991 44.363 59.090 1.00 13.08 ? 64 TYR B CA 1 +ATOM 5364 C C . TYR B 1 44 ? 52.549 44.663 57.651 1.00 14.11 ? 64 TYR B C 1 +ATOM 5365 O O . TYR B 1 44 ? 53.230 45.399 56.946 1.00 13.66 ? 64 TYR B O 1 +ATOM 5366 C CB . TYR B 1 44 ? 54.145 43.351 59.061 1.00 13.06 ? 64 TYR B CB 1 +ATOM 5367 C CG . TYR B 1 44 ? 53.684 41.941 58.796 1.00 12.53 ? 64 TYR B CG 1 +ATOM 5368 C CD1 . TYR B 1 44 ? 53.410 41.077 59.845 1.00 12.35 ? 64 TYR B CD1 1 +ATOM 5369 C CD2 . TYR B 1 44 ? 53.473 41.486 57.497 1.00 13.42 ? 64 TYR B CD2 1 +ATOM 5370 C CE1 . TYR B 1 44 ? 52.945 39.780 59.614 1.00 14.21 ? 64 TYR B CE1 1 +ATOM 5371 C CE2 . TYR B 1 44 ? 53.021 40.199 57.254 1.00 13.67 ? 64 TYR B CE2 1 +ATOM 5372 C CZ . TYR B 1 44 ? 52.759 39.354 58.316 1.00 14.43 ? 64 TYR B CZ 1 +ATOM 5373 O OH . TYR B 1 44 ? 52.311 38.090 58.072 1.00 13.34 ? 64 TYR B OH 1 +ATOM 5374 N N . ARG B 1 45 ? 51.429 44.094 57.202 1.00 14.86 ? 65 ARG B N 1 +ATOM 5375 C CA . ARG B 1 45 ? 50.968 44.332 55.833 1.00 16.11 ? 65 ARG B CA 1 +ATOM 5376 C C . ARG B 1 45 ? 50.395 45.733 55.629 1.00 16.09 ? 65 ARG B C 1 +ATOM 5377 O O . ARG B 1 45 ? 50.267 46.173 54.490 1.00 17.03 ? 65 ARG B O 1 +ATOM 5378 C CB . ARG B 1 45 ? 49.940 43.286 55.390 1.00 16.35 ? 65 ARG B CB 1 +ATOM 5379 C CG . ARG B 1 45 ? 50.508 41.877 55.278 1.00 19.34 ? 65 ARG B CG 1 +ATOM 5380 C CD . ARG B 1 45 ? 51.517 41.736 54.144 1.00 23.35 ? 65 ARG B CD 1 +ATOM 5381 N NE . ARG B 1 45 ? 50.880 41.821 52.830 1.00 26.35 ? 65 ARG B NE 1 +ATOM 5382 C CZ . ARG B 1 45 ? 50.335 40.793 52.176 1.00 27.63 ? 65 ARG B CZ 1 +ATOM 5383 N NH1 . ARG B 1 45 ? 50.329 39.570 52.706 1.00 29.64 ? 65 ARG B NH1 1 +ATOM 5384 N NH2 . ARG B 1 45 ? 49.787 40.986 50.978 1.00 28.27 ? 65 ARG B NH2 1 +ATOM 5385 N N . ARG B 1 46 ? 50.054 46.427 56.715 1.00 16.38 ? 66 ARG B N 1 +ATOM 5386 C CA . ARG B 1 46 ? 49.574 47.809 56.625 1.00 16.36 ? 66 ARG B CA 1 +ATOM 5387 C C . ARG B 1 46 ? 50.285 48.706 57.635 1.00 16.35 ? 66 ARG B C 1 +ATOM 5388 O O . ARG B 1 46 ? 50.840 48.225 58.636 1.00 15.03 ? 66 ARG B O 1 +ATOM 5389 C CB . ARG B 1 46 ? 48.061 47.878 56.879 1.00 17.20 ? 66 ARG B CB 1 +ATOM 5390 C CG . ARG B 1 46 ? 47.208 47.064 55.905 1.00 18.88 ? 66 ARG B CG 1 +ATOM 5391 C CD . ARG B 1 46 ? 47.270 47.609 54.486 1.00 22.41 ? 66 ARG B CD 1 +ATOM 5392 N NE . ARG B 1 46 ? 46.723 48.963 54.403 1.00 24.03 ? 66 ARG B NE 1 +ATOM 5393 C CZ . ARG B 1 46 ? 46.870 49.774 53.357 1.00 25.85 ? 66 ARG B CZ 1 +ATOM 5394 N NH1 . ARG B 1 46 ? 47.546 49.388 52.276 1.00 27.15 ? 66 ARG B NH1 1 +ATOM 5395 N NH2 . ARG B 1 46 ? 46.334 50.988 53.387 1.00 26.96 ? 66 ARG B NH2 1 +ATOM 5396 N N . PRO B 1 47 ? 50.249 50.028 57.400 1.00 15.72 ? 67 PRO B N 1 +ATOM 5397 C CA . PRO B 1 47 ? 50.853 50.884 58.411 1.00 15.60 ? 67 PRO B CA 1 +ATOM 5398 C C . PRO B 1 47 ? 50.299 50.542 59.797 1.00 15.54 ? 67 PRO B C 1 +ATOM 5399 O O . PRO B 1 47 ? 49.104 50.281 59.956 1.00 15.27 ? 67 PRO B O 1 +ATOM 5400 C CB . PRO B 1 47 ? 50.464 52.292 57.960 1.00 15.76 ? 67 PRO B CB 1 +ATOM 5401 C CG . PRO B 1 47 ? 50.343 52.157 56.467 1.00 15.92 ? 67 PRO B CG 1 +ATOM 5402 C CD . PRO B 1 47 ? 49.705 50.812 56.277 1.00 15.94 ? 67 PRO B CD 1 +ATOM 5403 N N . LEU B 1 48 ? 51.194 50.512 60.777 1.00 15.69 ? 68 LEU B N 1 +ATOM 5404 C CA . LEU B 1 48 ? 50.894 50.024 62.111 1.00 16.23 ? 68 LEU B CA 1 +ATOM 5405 C C . LEU B 1 48 ? 49.669 50.664 62.768 1.00 16.98 ? 68 LEU B C 1 +ATOM 5406 O O . LEU B 1 48 ? 48.932 49.971 63.463 1.00 17.64 ? 68 LEU B O 1 +ATOM 5407 C CB . LEU B 1 48 ? 52.123 50.212 63.015 1.00 15.78 ? 68 LEU B CB 1 +ATOM 5408 C CG . LEU B 1 48 ? 52.140 49.432 64.322 1.00 16.17 ? 68 LEU B CG 1 +ATOM 5409 C CD1 . LEU B 1 48 ? 52.193 47.932 64.044 1.00 15.32 ? 68 LEU B CD1 1 +ATOM 5410 C CD2 . LEU B 1 48 ? 53.341 49.873 65.163 1.00 15.36 ? 68 LEU B CD2 1 +ATOM 5411 N N . TRP B 1 49 ? 49.452 51.962 62.552 1.00 18.05 ? 69 TRP B N 1 +ATOM 5412 C CA . TRP B 1 49 ? 48.347 52.685 63.207 1.00 19.34 ? 69 TRP B CA 1 +ATOM 5413 C C . TRP B 1 49 ? 46.971 52.152 62.791 1.00 19.94 ? 69 TRP B C 1 +ATOM 5414 O O . TRP B 1 49 ? 45.998 52.246 63.551 1.00 19.94 ? 69 TRP B O 1 +ATOM 5415 C CB . TRP B 1 49 ? 48.423 54.191 62.916 1.00 20.24 ? 69 TRP B CB 1 +ATOM 5416 C CG . TRP B 1 49 ? 48.187 54.569 61.478 1.00 20.49 ? 69 TRP B CG 1 +ATOM 5417 C CD1 . TRP B 1 49 ? 49.131 54.761 60.521 1.00 21.85 ? 69 TRP B CD1 1 +ATOM 5418 C CD2 . TRP B 1 49 ? 46.922 54.815 60.847 1.00 21.21 ? 69 TRP B CD2 1 +ATOM 5419 N NE1 . TRP B 1 49 ? 48.538 55.096 59.323 1.00 22.28 ? 69 TRP B NE1 1 +ATOM 5420 C CE2 . TRP B 1 49 ? 47.182 55.136 59.496 1.00 21.88 ? 69 TRP B CE2 1 +ATOM 5421 C CE3 . TRP B 1 49 ? 45.597 54.776 61.286 1.00 22.05 ? 69 TRP B CE3 1 +ATOM 5422 C CZ2 . TRP B 1 49 ? 46.163 55.427 58.580 1.00 22.10 ? 69 TRP B CZ2 1 +ATOM 5423 C CZ3 . TRP B 1 49 ? 44.583 55.074 60.379 1.00 22.09 ? 69 TRP B CZ3 1 +ATOM 5424 C CH2 . TRP B 1 49 ? 44.874 55.391 59.041 1.00 21.65 ? 69 TRP B CH2 1 +ATOM 5425 N N . GLU B 1 50 ? 46.893 51.596 61.588 1.00 20.77 ? 70 GLU B N 1 +ATOM 5426 C CA . GLU B 1 50 ? 45.634 51.033 61.093 1.00 21.71 ? 70 GLU B CA 1 +ATOM 5427 C C . GLU B 1 50 ? 45.099 49.907 61.965 1.00 22.16 ? 70 GLU B C 1 +ATOM 5428 O O . GLU B 1 50 ? 43.882 49.705 62.038 1.00 23.53 ? 70 GLU B O 1 +ATOM 5429 C CB . GLU B 1 50 ? 45.802 50.503 59.669 1.00 21.88 ? 70 GLU B CB 1 +ATOM 5430 C CG . GLU B 1 50 ? 46.077 51.567 58.645 1.00 22.79 ? 70 GLU B CG 1 +ATOM 5431 C CD . GLU B 1 50 ? 45.798 51.099 57.241 1.00 24.06 ? 70 GLU B CD 1 +ATOM 5432 O OE1 . GLU B 1 50 ? 45.400 49.912 57.061 1.00 24.24 ? 70 GLU B OE1 1 +ATOM 5433 O OE2 . GLU B 1 50 ? 45.985 51.917 56.321 1.00 27.05 ? 70 GLU B OE2 1 +ATOM 5434 N N . SER B 1 51 ? 45.989 49.155 62.612 1.00 22.08 ? 71 SER B N 1 +ATOM 5435 C CA . SER B 1 51 ? 45.564 48.019 63.425 1.00 21.66 ? 71 SER B CA 1 +ATOM 5436 C C . SER B 1 51 ? 45.339 48.359 64.904 1.00 20.90 ? 71 SER B C 1 +ATOM 5437 O O . SER B 1 51 ? 45.054 47.469 65.710 1.00 20.89 ? 71 SER B O 1 +ATOM 5438 C CB . SER B 1 51 ? 46.540 46.851 63.263 1.00 22.21 ? 71 SER B CB 1 +ATOM 5439 O OG . SER B 1 51 ? 47.856 47.257 63.557 1.00 23.09 ? 71 SER B OG 1 +ATOM 5440 N N . GLY B 1 52 ? 45.423 49.644 65.255 1.00 20.20 ? 72 GLY B N 1 +ATOM 5441 C CA . GLY B 1 52 ? 45.092 50.095 66.611 1.00 19.51 ? 72 GLY B CA 1 +ATOM 5442 C C . GLY B 1 52 ? 45.977 51.236 67.090 1.00 18.93 ? 72 GLY B C 1 +ATOM 5443 O O . GLY B 1 52 ? 46.841 51.694 66.352 1.00 18.35 ? 72 GLY B O 1 +ATOM 5444 N N . PRO B 1 53 ? 45.749 51.715 68.325 1.00 18.14 ? 73 PRO B N 1 +ATOM 5445 C CA . PRO B 1 53 ? 46.581 52.782 68.886 1.00 17.47 ? 73 PRO B CA 1 +ATOM 5446 C C . PRO B 1 53 ? 48.081 52.471 68.909 1.00 16.32 ? 73 PRO B C 1 +ATOM 5447 O O . PRO B 1 53 ? 48.483 51.319 69.111 1.00 16.21 ? 73 PRO B O 1 +ATOM 5448 C CB . PRO B 1 53 ? 46.048 52.925 70.316 1.00 17.61 ? 73 PRO B CB 1 +ATOM 5449 C CG . PRO B 1 53 ? 44.617 52.519 70.212 1.00 18.35 ? 73 PRO B CG 1 +ATOM 5450 C CD . PRO B 1 53 ? 44.660 51.340 69.250 1.00 18.65 ? 73 PRO B CD 1 +ATOM 5451 N N . THR B 1 54 ? 48.880 53.511 68.711 1.00 15.45 ? 74 THR B N 1 +ATOM 5452 C CA . THR B 1 54 ? 50.338 53.439 68.807 1.00 14.56 ? 74 THR B CA 1 +ATOM 5453 C C . THR B 1 54 ? 50.796 54.604 69.664 1.00 14.02 ? 74 THR B C 1 +ATOM 5454 O O . THR B 1 54 ? 50.022 55.529 69.926 1.00 13.87 ? 74 THR B O 1 +ATOM 5455 C CB . THR B 1 54 ? 51.011 53.538 67.413 1.00 14.53 ? 74 THR B CB 1 +ATOM 5456 O OG1 . THR B 1 54 ? 50.572 54.723 66.743 1.00 15.58 ? 74 THR B OG1 1 +ATOM 5457 C CG2 . THR B 1 54 ? 50.680 52.333 66.544 1.00 14.59 ? 74 THR B CG2 1 +ATOM 5458 N N . VAL B 1 55 ? 52.057 54.574 70.098 1.00 13.03 ? 75 VAL B N 1 +ATOM 5459 C CA . VAL B 1 55 ? 52.666 55.722 70.776 1.00 12.37 ? 75 VAL B CA 1 +ATOM 5460 C C . VAL B 1 55 ? 54.008 56.006 70.126 1.00 12.11 ? 75 VAL B C 1 +ATOM 5461 O O . VAL B 1 55 ? 54.507 55.193 69.356 1.00 12.72 ? 75 VAL B O 1 +ATOM 5462 C CB . VAL B 1 55 ? 52.896 55.456 72.282 1.00 12.62 ? 75 VAL B CB 1 +ATOM 5463 C CG1 . VAL B 1 55 ? 51.573 55.202 72.991 1.00 12.90 ? 75 VAL B CG1 1 +ATOM 5464 C CG2 . VAL B 1 55 ? 53.837 54.276 72.488 1.00 11.74 ? 75 VAL B CG2 1 +ATOM 5465 N N . ASP B 1 56 ? 54.585 57.155 70.441 1.00 11.70 ? 76 ASP B N 1 +ATOM 5466 C CA . ASP B 1 56 ? 55.953 57.452 70.035 1.00 11.13 ? 76 ASP B CA 1 +ATOM 5467 C C . ASP B 1 56 ? 56.926 56.681 70.912 1.00 10.56 ? 76 ASP B C 1 +ATOM 5468 O O . ASP B 1 56 ? 56.745 56.607 72.113 1.00 10.02 ? 76 ASP B O 1 +ATOM 5469 C CB . ASP B 1 56 ? 56.253 58.945 70.213 1.00 10.52 ? 76 ASP B CB 1 +ATOM 5470 C CG . ASP B 1 56 ? 55.495 59.824 69.246 1.00 11.09 ? 76 ASP B CG 1 +ATOM 5471 O OD1 . ASP B 1 56 ? 55.221 59.421 68.081 1.00 11.93 ? 76 ASP B OD1 1 +ATOM 5472 O OD2 . ASP B 1 56 ? 55.206 60.949 69.661 1.00 12.77 ? 76 ASP B OD2 1 +ATOM 5473 N N . MET B 1 57 ? 57.954 56.101 70.301 1.00 10.16 ? 77 MET B N 1 +ATOM 5474 C CA . MET B 1 57 ? 59.073 55.549 71.041 1.00 10.17 ? 77 MET B CA 1 +ATOM 5475 C C . MET B 1 57 ? 60.342 56.112 70.418 1.00 9.81 ? 77 MET B C 1 +ATOM 5476 O O . MET B 1 57 ? 60.501 56.043 69.203 1.00 10.26 ? 77 MET B O 1 +ATOM 5477 C CB . MET B 1 57 ? 59.070 54.029 70.946 1.00 10.22 ? 77 MET B CB 1 +ATOM 5478 C CG . MET B 1 57 ? 59.943 53.327 71.968 1.00 11.43 ? 77 MET B CG 1 +ATOM 5479 S SD . MET B 1 57 ? 59.580 53.828 73.654 1.00 11.05 ? 77 MET B SD 1 +ATOM 5480 C CE . MET B 1 57 ? 57.840 53.422 73.788 1.00 11.96 ? 77 MET B CE 1 +ATOM 5481 N N . PRO B 1 58 ? 61.235 56.678 71.242 1.00 9.22 ? 78 PRO B N 1 +ATOM 5482 C CA . PRO B 1 58 ? 62.520 57.156 70.746 1.00 9.07 ? 78 PRO B CA 1 +ATOM 5483 C C . PRO B 1 58 ? 63.447 55.988 70.382 1.00 8.94 ? 78 PRO B C 1 +ATOM 5484 O O . PRO B 1 58 ? 63.417 54.941 71.035 1.00 7.26 ? 78 PRO B O 1 +ATOM 5485 C CB . PRO B 1 58 ? 63.068 57.966 71.925 1.00 9.38 ? 78 PRO B CB 1 +ATOM 5486 C CG . PRO B 1 58 ? 62.455 57.343 73.133 1.00 9.50 ? 78 PRO B CG 1 +ATOM 5487 C CD . PRO B 1 58 ? 61.082 56.905 72.690 1.00 9.11 ? 78 PRO B CD 1 +ATOM 5488 N N . VAL B 1 59 ? 64.230 56.169 69.324 1.00 8.97 ? 79 VAL B N 1 +ATOM 5489 C CA . VAL B 1 59 ? 65.265 55.224 68.928 1.00 9.01 ? 79 VAL B CA 1 +ATOM 5490 C C . VAL B 1 59 ? 66.564 55.993 68.654 1.00 9.37 ? 79 VAL B C 1 +ATOM 5491 O O . VAL B 1 59 ? 66.559 56.994 67.927 1.00 9.11 ? 79 VAL B O 1 +ATOM 5492 C CB . VAL B 1 59 ? 64.866 54.382 67.667 1.00 9.21 ? 79 VAL B CB 1 +ATOM 5493 C CG1 . VAL B 1 59 ? 66.048 53.578 67.175 1.00 8.51 ? 79 VAL B CG1 1 +ATOM 5494 C CG2 . VAL B 1 59 ? 63.681 53.461 67.965 1.00 10.02 ? 79 VAL B CG2 1 +ATOM 5495 N N . PRO B 1 60 ? 67.694 55.523 69.223 1.00 9.59 ? 80 PRO B N 1 +ATOM 5496 C CA . PRO B 1 60 ? 67.875 54.343 70.073 1.00 9.29 ? 80 PRO B CA 1 +ATOM 5497 C C . PRO B 1 60 ? 67.466 54.564 71.534 1.00 9.10 ? 80 PRO B C 1 +ATOM 5498 O O . PRO B 1 60 ? 67.688 55.634 72.090 1.00 9.57 ? 80 PRO B O 1 +ATOM 5499 C CB . PRO B 1 60 ? 69.382 54.093 69.989 1.00 8.94 ? 80 PRO B CB 1 +ATOM 5500 C CG . PRO B 1 60 ? 69.961 55.449 69.789 1.00 9.53 ? 80 PRO B CG 1 +ATOM 5501 C CD . PRO B 1 60 ? 68.966 56.227 68.983 1.00 10.20 ? 80 PRO B CD 1 +ATOM 5502 N N . SER B 1 61 ? 66.842 53.552 72.132 1.00 8.92 ? 81 SER B N 1 +ATOM 5503 C CA . SER B 1 61 ? 66.422 53.608 73.530 1.00 8.26 ? 81 SER B CA 1 +ATOM 5504 C C . SER B 1 61 ? 65.845 52.260 73.895 1.00 7.32 ? 81 SER B C 1 +ATOM 5505 O O . SER B 1 61 ? 65.372 51.538 73.025 1.00 8.26 ? 81 SER B O 1 +ATOM 5506 C CB . SER B 1 61 ? 65.311 54.631 73.748 1.00 7.85 ? 81 SER B CB 1 +ATOM 5507 O OG . SER B 1 61 ? 65.000 54.781 75.126 1.00 8.67 ? 81 SER B OG 1 +ATOM 5508 N N . SER B 1 62 ? 65.867 51.945 75.182 1.00 7.48 ? 82 SER B N 1 +ATOM 5509 C CA . SER B 1 62 ? 64.997 50.912 75.730 1.00 7.06 ? 82 SER B CA 1 +ATOM 5510 C C . SER B 1 62 ? 63.606 51.539 75.853 1.00 6.54 ? 82 SER B C 1 +ATOM 5511 O O . SER B 1 62 ? 63.486 52.742 76.067 1.00 6.05 ? 82 SER B O 1 +ATOM 5512 C CB . SER B 1 62 ? 65.477 50.465 77.113 1.00 7.04 ? 82 SER B CB 1 +ATOM 5513 O OG . SER B 1 62 ? 66.790 49.905 77.031 1.00 7.73 ? 82 SER B OG 1 +ATOM 5514 N N . PHE B 1 63 ? 62.562 50.741 75.702 1.00 7.27 ? 83 PHE B N 1 +ATOM 5515 C CA . PHE B 1 63 ? 61.196 51.265 75.855 1.00 6.90 ? 83 PHE B CA 1 +ATOM 5516 C C . PHE B 1 63 ? 60.697 51.287 77.298 1.00 7.43 ? 83 PHE B C 1 +ATOM 5517 O O . PHE B 1 63 ? 59.696 51.943 77.602 1.00 6.52 ? 83 PHE B O 1 +ATOM 5518 C CB . PHE B 1 63 ? 60.210 50.484 74.961 1.00 7.55 ? 83 PHE B CB 1 +ATOM 5519 C CG . PHE B 1 63 ? 60.044 49.028 75.321 1.00 6.55 ? 83 PHE B CG 1 +ATOM 5520 C CD1 . PHE B 1 63 ? 59.374 48.639 76.482 1.00 7.00 ? 83 PHE B CD1 1 +ATOM 5521 C CD2 . PHE B 1 63 ? 60.496 48.040 74.466 1.00 7.74 ? 83 PHE B CD2 1 +ATOM 5522 C CE1 . PHE B 1 63 ? 59.190 47.276 76.787 1.00 5.66 ? 83 PHE B CE1 1 +ATOM 5523 C CE2 . PHE B 1 63 ? 60.335 46.706 74.769 1.00 5.79 ? 83 PHE B CE2 1 +ATOM 5524 C CZ . PHE B 1 63 ? 59.690 46.318 75.931 1.00 7.72 ? 83 PHE B CZ 1 +ATOM 5525 N N . ASN B 1 64 ? 61.394 50.611 78.210 1.00 7.44 ? 84 ASN B N 1 +ATOM 5526 C CA . ASN B 1 64 ? 60.781 50.236 79.493 1.00 8.22 ? 84 ASN B CA 1 +ATOM 5527 C C . ASN B 1 64 ? 60.510 51.400 80.435 1.00 8.74 ? 84 ASN B C 1 +ATOM 5528 O O . ASN B 1 64 ? 59.529 51.376 81.174 1.00 9.53 ? 84 ASN B O 1 +ATOM 5529 C CB . ASN B 1 64 ? 61.615 49.187 80.240 1.00 7.81 ? 84 ASN B CB 1 +ATOM 5530 C CG . ASN B 1 64 ? 61.959 48.005 79.383 1.00 7.45 ? 84 ASN B CG 1 +ATOM 5531 O OD1 . ASN B 1 64 ? 62.786 48.123 78.481 1.00 7.19 ? 84 ASN B OD1 1 +ATOM 5532 N ND2 . ASN B 1 64 ? 61.354 46.833 79.673 1.00 6.05 ? 84 ASN B ND2 1 +ATOM 5533 N N . ASP B 1 65 ? 61.385 52.402 80.432 1.00 8.94 ? 85 ASP B N 1 +ATOM 5534 C CA . ASP B 1 65 ? 61.223 53.544 81.330 1.00 8.96 ? 85 ASP B CA 1 +ATOM 5535 C C . ASP B 1 65 ? 60.714 54.817 80.649 1.00 8.73 ? 85 ASP B C 1 +ATOM 5536 O O . ASP B 1 65 ? 60.698 55.876 81.269 1.00 8.16 ? 85 ASP B O 1 +ATOM 5537 C CB . ASP B 1 65 ? 62.554 53.837 82.039 1.00 9.45 ? 85 ASP B CB 1 +ATOM 5538 C CG . ASP B 1 65 ? 62.923 52.761 83.052 1.00 10.72 ? 85 ASP B CG 1 +ATOM 5539 O OD1 . ASP B 1 65 ? 62.020 52.022 83.484 1.00 12.01 ? 85 ASP B OD1 1 +ATOM 5540 O OD2 . ASP B 1 65 ? 64.107 52.673 83.438 1.00 10.89 ? 85 ASP B OD2 1 +ATOM 5541 N N . ILE B 1 66 ? 60.293 54.719 79.394 1.00 8.32 ? 86 ILE B N 1 +ATOM 5542 C CA . ILE B 1 66 ? 59.902 55.909 78.639 1.00 9.08 ? 86 ILE B CA 1 +ATOM 5543 C C . ILE B 1 66 ? 58.516 56.397 79.037 1.00 9.53 ? 86 ILE B C 1 +ATOM 5544 O O . ILE B 1 66 ? 58.243 57.588 79.002 1.00 9.78 ? 86 ILE B O 1 +ATOM 5545 C CB . ILE B 1 66 ? 59.938 55.660 77.120 1.00 8.96 ? 86 ILE B CB 1 +ATOM 5546 C CG1 . ILE B 1 66 ? 61.377 55.386 76.665 1.00 10.07 ? 86 ILE B CG1 1 +ATOM 5547 C CG2 . ILE B 1 66 ? 59.356 56.864 76.355 1.00 9.34 ? 86 ILE B CG2 1 +ATOM 5548 C CD1 . ILE B 1 66 ? 62.343 56.509 76.957 1.00 10.94 ? 86 ILE B CD1 1 +ATOM 5549 N N . SER B 1 67 ? 57.642 55.473 79.419 1.00 11.02 ? 87 SER B N 1 +ATOM 5550 C CA . SER B 1 67 ? 56.264 55.840 79.731 1.00 11.59 ? 87 SER B CA 1 +ATOM 5551 C C . SER B 1 67 ? 55.971 55.682 81.213 1.00 12.53 ? 87 SER B C 1 +ATOM 5552 O O . SER B 1 67 ? 56.847 55.304 81.996 1.00 12.41 ? 87 SER B O 1 +ATOM 5553 C CB . SER B 1 67 ? 55.296 55.012 78.877 1.00 12.34 ? 87 SER B CB 1 +ATOM 5554 O OG . SER B 1 67 ? 55.145 53.700 79.381 1.00 13.31 ? 87 SER B OG 1 +ATOM 5555 N N . GLN B 1 68 ? 54.729 55.971 81.595 1.00 13.03 ? 88 GLN B N 1 +ATOM 5556 C CA . GLN B 1 68 ? 54.282 55.764 82.965 1.00 14.21 ? 88 GLN B CA 1 +ATOM 5557 C C . GLN B 1 68 ? 53.355 54.541 83.042 1.00 15.84 ? 88 GLN B C 1 +ATOM 5558 O O . GLN B 1 68 ? 52.452 54.518 83.868 1.00 16.48 ? 88 GLN B O 1 +ATOM 5559 C CB . GLN B 1 68 ? 53.551 57.006 83.492 1.00 13.61 ? 88 GLN B CB 1 +ATOM 5560 C CG . GLN B 1 68 ? 54.263 58.339 83.294 1.00 12.71 ? 88 GLN B CG 1 +ATOM 5561 C CD . GLN B 1 68 ? 55.713 58.332 83.752 1.00 10.78 ? 88 GLN B CD 1 +ATOM 5562 O OE1 . GLN B 1 68 ? 56.618 58.457 82.938 1.00 10.15 ? 88 GLN B OE1 1 +ATOM 5563 N NE2 . GLN B 1 68 ? 55.935 58.150 85.050 1.00 11.35 ? 88 GLN B NE2 1 +ATOM 5564 N N . ASP B 1 69 ? 53.568 53.557 82.163 1.00 16.86 ? 89 ASP B N 1 +ATOM 5565 C CA . ASP B 1 69 ? 52.726 52.366 82.088 1.00 18.26 ? 89 ASP B CA 1 +ATOM 5566 C C . ASP B 1 69 ? 53.445 51.177 82.719 1.00 18.53 ? 89 ASP B C 1 +ATOM 5567 O O . ASP B 1 69 ? 54.402 50.625 82.164 1.00 17.92 ? 89 ASP B O 1 +ATOM 5568 C CB . ASP B 1 69 ? 52.347 52.053 80.640 1.00 18.60 ? 89 ASP B CB 1 +ATOM 5569 C CG . ASP B 1 69 ? 51.327 50.916 80.528 1.00 21.55 ? 89 ASP B CG 1 +ATOM 5570 O OD1 . ASP B 1 69 ? 51.168 50.133 81.494 1.00 23.80 ? 89 ASP B OD1 1 +ATOM 5571 O OD2 . ASP B 1 69 ? 50.686 50.809 79.462 1.00 23.86 ? 89 ASP B OD2 1 +ATOM 5572 N N . TRP B 1 70 ? 52.908 50.786 83.869 1.00 19.76 ? 90 TRP B N 1 +ATOM 5573 C CA . TRP B 1 70 ? 53.411 49.754 84.743 1.00 20.25 ? 90 TRP B CA 1 +ATOM 5574 C C . TRP B 1 70 ? 53.562 48.435 83.974 1.00 19.10 ? 90 TRP B C 1 +ATOM 5575 O O . TRP B 1 70 ? 54.540 47.716 84.120 1.00 18.55 ? 90 TRP B O 1 +ATOM 5576 C CB . TRP B 1 70 ? 52.392 49.529 85.885 1.00 22.01 ? 90 TRP B CB 1 +ATOM 5577 C CG . TRP B 1 70 ? 51.971 50.761 86.755 1.00 23.57 ? 90 TRP B CG 1 +ATOM 5578 C CD1 . TRP B 1 70 ? 51.774 52.070 86.353 1.00 24.44 ? 90 TRP B CD1 1 +ATOM 5579 C CD2 . TRP B 1 70 ? 51.648 50.736 88.159 1.00 25.39 ? 90 TRP B CD2 1 +ATOM 5580 N NE1 . TRP B 1 70 ? 51.394 52.845 87.431 1.00 25.12 ? 90 TRP B NE1 1 +ATOM 5581 C CE2 . TRP B 1 70 ? 51.305 52.051 88.543 1.00 25.09 ? 90 TRP B CE2 1 +ATOM 5582 C CE3 . TRP B 1 70 ? 51.637 49.727 89.133 1.00 25.14 ? 90 TRP B CE3 1 +ATOM 5583 C CZ2 . TRP B 1 70 ? 50.948 52.381 89.855 1.00 24.81 ? 90 TRP B CZ2 1 +ATOM 5584 C CZ3 . TRP B 1 70 ? 51.287 50.057 90.436 1.00 24.79 ? 90 TRP B CZ3 1 +ATOM 5585 C CH2 . TRP B 1 70 ? 50.943 51.372 90.784 1.00 24.26 ? 90 TRP B CH2 1 +ATOM 5586 N N . ARG B 1 71 ? 52.578 48.134 83.140 1.00 17.61 ? 91 ARG B N 1 +ATOM 5587 C CA . ARG B 1 71 ? 52.568 46.858 82.404 1.00 17.06 ? 91 ARG B CA 1 +ATOM 5588 C C . ARG B 1 71 ? 53.550 46.822 81.238 1.00 15.33 ? 91 ARG B C 1 +ATOM 5589 O O . ARG B 1 71 ? 53.931 45.733 80.781 1.00 15.17 ? 91 ARG B O 1 +ATOM 5590 C CB . ARG B 1 71 ? 51.174 46.567 81.876 1.00 17.70 ? 91 ARG B CB 1 +ATOM 5591 C CG . ARG B 1 71 ? 50.114 46.458 82.962 1.00 20.79 ? 91 ARG B CG 1 +ATOM 5592 C CD . ARG B 1 71 ? 48.717 46.661 82.413 1.00 24.74 ? 91 ARG B CD 1 +ATOM 5593 N NE . ARG B 1 71 ? 48.641 47.839 81.544 1.00 26.60 ? 91 ARG B NE 1 +ATOM 5594 C CZ . ARG B 1 71 ? 48.530 47.826 80.211 1.00 27.57 ? 91 ARG B CZ 1 +ATOM 5595 N NH1 . ARG B 1 71 ? 48.456 46.684 79.525 1.00 28.82 ? 91 ARG B NH1 1 +ATOM 5596 N NH2 . ARG B 1 71 ? 48.487 48.980 79.555 1.00 27.95 ? 91 ARG B NH2 1 +ATOM 5597 N N . LEU B 1 72 ? 53.921 47.996 80.732 1.00 14.52 ? 92 LEU B N 1 +ATOM 5598 C CA . LEU B 1 72 ? 54.907 48.083 79.656 1.00 13.24 ? 92 LEU B CA 1 +ATOM 5599 C C . LEU B 1 72 ? 56.299 47.850 80.208 1.00 12.58 ? 92 LEU B C 1 +ATOM 5600 O O . LEU B 1 72 ? 57.112 47.160 79.582 1.00 11.83 ? 92 LEU B O 1 +ATOM 5601 C CB . LEU B 1 72 ? 54.834 49.437 78.927 1.00 13.56 ? 92 LEU B CB 1 +ATOM 5602 C CG . LEU B 1 72 ? 55.693 49.539 77.661 1.00 13.20 ? 92 LEU B CG 1 +ATOM 5603 C CD1 . LEU B 1 72 ? 55.479 48.312 76.770 1.00 12.59 ? 92 LEU B CD1 1 +ATOM 5604 C CD2 . LEU B 1 72 ? 55.453 50.850 76.892 1.00 13.46 ? 92 LEU B CD2 1 +ATOM 5605 N N . ARG B 1 73 ? 56.595 48.417 81.375 1.00 11.92 ? 93 ARG B N 1 +ATOM 5606 C CA . ARG B 1 73 ? 57.943 48.260 81.945 1.00 11.88 ? 93 ARG B CA 1 +ATOM 5607 C C . ARG B 1 73 ? 58.308 46.792 82.136 1.00 11.58 ? 93 ARG B C 1 +ATOM 5608 O O . ARG B 1 73 ? 59.436 46.404 81.864 1.00 11.56 ? 93 ARG B O 1 +ATOM 5609 C CB . ARG B 1 73 ? 58.119 49.019 83.263 1.00 11.50 ? 93 ARG B CB 1 +ATOM 5610 C CG . ARG B 1 73 ? 59.554 48.955 83.805 1.00 12.85 ? 93 ARG B CG 1 +ATOM 5611 C CD . ARG B 1 73 ? 59.717 49.646 85.155 1.00 13.32 ? 93 ARG B CD 1 +ATOM 5612 N NE . ARG B 1 73 ? 61.137 49.790 85.521 1.00 14.86 ? 93 ARG B NE 1 +ATOM 5613 C CZ . ARG B 1 73 ? 61.849 48.929 86.263 1.00 14.50 ? 93 ARG B CZ 1 +ATOM 5614 N NH1 . ARG B 1 73 ? 61.302 47.845 86.775 1.00 15.52 ? 93 ARG B NH1 1 +ATOM 5615 N NH2 . ARG B 1 73 ? 63.122 49.184 86.526 1.00 14.12 ? 93 ARG B NH2 1 +ATOM 5616 N N . HIS B 1 74 ? 57.354 45.967 82.566 1.00 11.63 ? 94 HIS B N 1 +ATOM 5617 C CA . HIS B 1 74 ? 57.624 44.543 82.811 1.00 11.86 ? 94 HIS B CA 1 +ATOM 5618 C C . HIS B 1 74 ? 57.032 43.602 81.754 1.00 11.42 ? 94 HIS B C 1 +ATOM 5619 O O . HIS B 1 74 ? 56.893 42.404 81.987 1.00 10.87 ? 94 HIS B O 1 +ATOM 5620 C CB . HIS B 1 74 ? 57.126 44.182 84.211 1.00 12.59 ? 94 HIS B CB 1 +ATOM 5621 C CG . HIS B 1 74 ? 57.712 45.047 85.282 1.00 13.42 ? 94 HIS B CG 1 +ATOM 5622 N ND1 . HIS B 1 74 ? 57.013 46.073 85.876 1.00 14.39 ? 94 HIS B ND1 1 +ATOM 5623 C CD2 . HIS B 1 74 ? 58.948 45.064 85.832 1.00 14.94 ? 94 HIS B CD2 1 +ATOM 5624 C CE1 . HIS B 1 74 ? 57.789 46.671 86.764 1.00 13.87 ? 94 HIS B CE1 1 +ATOM 5625 N NE2 . HIS B 1 74 ? 58.970 46.086 86.748 1.00 14.58 ? 94 HIS B NE2 1 +ATOM 5626 N N . PHE B 1 75 ? 56.729 44.161 80.586 1.00 11.09 ? 95 PHE B N 1 +ATOM 5627 C CA . PHE B 1 75 ? 56.102 43.435 79.474 1.00 10.81 ? 95 PHE B CA 1 +ATOM 5628 C C . PHE B 1 75 ? 57.009 42.326 78.970 1.00 10.55 ? 95 PHE B C 1 +ATOM 5629 O O . PHE B 1 75 ? 58.227 42.518 78.905 1.00 11.33 ? 95 PHE B O 1 +ATOM 5630 C CB . PHE B 1 75 ? 55.784 44.415 78.330 1.00 10.92 ? 95 PHE B CB 1 +ATOM 5631 C CG . PHE B 1 75 ? 55.277 43.755 77.080 1.00 11.57 ? 95 PHE B CG 1 +ATOM 5632 C CD1 . PHE B 1 75 ? 53.979 43.287 77.011 1.00 11.31 ? 95 PHE B CD1 1 +ATOM 5633 C CD2 . PHE B 1 75 ? 56.098 43.610 75.970 1.00 11.77 ? 95 PHE B CD2 1 +ATOM 5634 C CE1 . PHE B 1 75 ? 53.502 42.668 75.862 1.00 12.11 ? 95 PHE B CE1 1 +ATOM 5635 C CE2 . PHE B 1 75 ? 55.635 42.997 74.814 1.00 12.27 ? 95 PHE B CE2 1 +ATOM 5636 C CZ . PHE B 1 75 ? 54.319 42.514 74.770 1.00 12.56 ? 95 PHE B CZ 1 +ATOM 5637 N N . VAL B 1 76 ? 56.406 41.173 78.655 1.00 10.00 ? 96 VAL B N 1 +ATOM 5638 C CA . VAL B 1 76 ? 57.097 39.996 78.122 1.00 9.88 ? 96 VAL B CA 1 +ATOM 5639 C C . VAL B 1 76 ? 56.337 39.497 76.892 1.00 10.10 ? 96 VAL B C 1 +ATOM 5640 O O . VAL B 1 76 ? 55.172 39.101 77.001 1.00 9.33 ? 96 VAL B O 1 +ATOM 5641 C CB . VAL B 1 76 ? 57.165 38.871 79.178 1.00 9.93 ? 96 VAL B CB 1 +ATOM 5642 C CG1 . VAL B 1 76 ? 57.782 37.595 78.590 1.00 10.09 ? 96 VAL B CG1 1 +ATOM 5643 C CG2 . VAL B 1 76 ? 57.923 39.346 80.424 1.00 10.27 ? 96 VAL B CG2 1 +ATOM 5644 N N . GLY B 1 77 ? 56.984 39.530 75.725 1.00 10.19 ? 97 GLY B N 1 +ATOM 5645 C CA . GLY B 1 77 ? 56.343 39.168 74.458 1.00 9.81 ? 97 GLY B CA 1 +ATOM 5646 C C . GLY B 1 77 ? 56.899 39.987 73.304 1.00 10.26 ? 97 GLY B C 1 +ATOM 5647 O O . GLY B 1 77 ? 58.085 40.347 73.313 1.00 10.51 ? 97 GLY B O 1 +ATOM 5648 N N . TRP B 1 78 ? 56.046 40.285 72.324 1.00 9.87 ? 98 TRP B N 1 +ATOM 5649 C CA . TRP B 1 78 ? 56.447 41.008 71.111 1.00 9.38 ? 98 TRP B CA 1 +ATOM 5650 C C . TRP B 1 78 ? 56.077 42.488 71.201 1.00 9.40 ? 98 TRP B C 1 +ATOM 5651 O O . TRP B 1 78 ? 54.913 42.828 71.454 1.00 9.25 ? 98 TRP B O 1 +ATOM 5652 C CB . TRP B 1 78 ? 55.739 40.433 69.865 1.00 9.77 ? 98 TRP B CB 1 +ATOM 5653 C CG . TRP B 1 78 ? 56.118 39.052 69.433 1.00 9.22 ? 98 TRP B CG 1 +ATOM 5654 C CD1 . TRP B 1 78 ? 55.455 37.895 69.726 1.00 9.66 ? 98 TRP B CD1 1 +ATOM 5655 C CD2 . TRP B 1 78 ? 57.199 38.685 68.569 1.00 9.11 ? 98 TRP B CD2 1 +ATOM 5656 N NE1 . TRP B 1 78 ? 56.078 36.826 69.138 1.00 9.45 ? 98 TRP B NE1 1 +ATOM 5657 C CE2 . TRP B 1 78 ? 57.149 37.277 68.414 1.00 9.05 ? 98 TRP B CE2 1 +ATOM 5658 C CE3 . TRP B 1 78 ? 58.211 39.404 67.917 1.00 9.98 ? 98 TRP B CE3 1 +ATOM 5659 C CZ2 . TRP B 1 78 ? 58.069 36.574 67.632 1.00 9.98 ? 98 TRP B CZ2 1 +ATOM 5660 C CZ3 . TRP B 1 78 ? 59.131 38.705 67.140 1.00 9.35 ? 98 TRP B CZ3 1 +ATOM 5661 C CH2 . TRP B 1 78 ? 59.061 37.303 67.015 1.00 9.54 ? 98 TRP B CH2 1 +ATOM 5662 N N . VAL B 1 79 ? 57.041 43.374 70.958 1.00 8.84 ? 99 VAL B N 1 +ATOM 5663 C CA . VAL B 1 79 ? 56.733 44.775 70.710 1.00 7.90 ? 99 VAL B CA 1 +ATOM 5664 C C . VAL B 1 79 ? 56.993 45.073 69.237 1.00 8.19 ? 99 VAL B C 1 +ATOM 5665 O O . VAL B 1 79 ? 57.804 44.375 68.594 1.00 8.39 ? 99 VAL B O 1 +ATOM 5666 C CB . VAL B 1 79 ? 57.545 45.750 71.613 1.00 7.62 ? 99 VAL B CB 1 +ATOM 5667 C CG1 . VAL B 1 79 ? 57.351 45.360 73.078 1.00 6.16 ? 99 VAL B CG1 1 +ATOM 5668 C CG2 . VAL B 1 79 ? 59.026 45.755 71.220 1.00 8.57 ? 99 VAL B CG2 1 +ATOM 5669 N N . TRP B 1 80 ? 56.295 46.098 68.732 1.00 8.30 ? 100 TRP B N 1 +ATOM 5670 C CA . TRP B 1 80 ? 56.262 46.460 67.323 1.00 8.51 ? 100 TRP B CA 1 +ATOM 5671 C C . TRP B 1 80 ? 56.640 47.918 67.103 1.00 8.86 ? 100 TRP B C 1 +ATOM 5672 O O . TRP B 1 80 ? 56.035 48.819 67.672 1.00 8.83 ? 100 TRP B O 1 +ATOM 5673 C CB . TRP B 1 80 ? 54.862 46.231 66.749 1.00 8.40 ? 100 TRP B CB 1 +ATOM 5674 C CG . TRP B 1 80 ? 54.461 44.778 66.706 1.00 8.49 ? 100 TRP B CG 1 +ATOM 5675 C CD1 . TRP B 1 80 ? 54.115 44.001 67.770 1.00 8.59 ? 100 TRP B CD1 1 +ATOM 5676 C CD2 . TRP B 1 80 ? 54.320 43.951 65.538 1.00 9.45 ? 100 TRP B CD2 1 +ATOM 5677 N NE1 . TRP B 1 80 ? 53.803 42.728 67.347 1.00 7.99 ? 100 TRP B NE1 1 +ATOM 5678 C CE2 . TRP B 1 80 ? 53.903 42.677 65.979 1.00 8.80 ? 100 TRP B CE2 1 +ATOM 5679 C CE3 . TRP B 1 80 ? 54.494 44.163 64.160 1.00 8.84 ? 100 TRP B CE3 1 +ATOM 5680 C CZ2 . TRP B 1 80 ? 53.681 41.616 65.097 1.00 9.37 ? 100 TRP B CZ2 1 +ATOM 5681 C CZ3 . TRP B 1 80 ? 54.283 43.102 63.283 1.00 9.00 ? 100 TRP B CZ3 1 +ATOM 5682 C CH2 . TRP B 1 80 ? 53.871 41.848 63.755 1.00 9.12 ? 100 TRP B CH2 1 +ATOM 5683 N N . TYR B 1 81 ? 57.652 48.119 66.261 1.00 8.90 ? 101 TYR B N 1 +ATOM 5684 C CA . TYR B 1 81 ? 58.189 49.429 65.921 1.00 9.19 ? 101 TYR B CA 1 +ATOM 5685 C C . TYR B 1 81 ? 57.940 49.681 64.439 1.00 9.18 ? 101 TYR B C 1 +ATOM 5686 O O . TYR B 1 81 ? 58.008 48.758 63.628 1.00 9.86 ? 101 TYR B O 1 +ATOM 5687 C CB . TYR B 1 81 ? 59.706 49.417 66.135 1.00 8.60 ? 101 TYR B CB 1 +ATOM 5688 C CG . TYR B 1 81 ? 60.205 49.610 67.551 1.00 7.66 ? 101 TYR B CG 1 +ATOM 5689 C CD1 . TYR B 1 81 ? 60.607 50.867 67.988 1.00 6.92 ? 101 TYR B CD1 1 +ATOM 5690 C CD2 . TYR B 1 81 ? 60.331 48.533 68.436 1.00 7.03 ? 101 TYR B CD2 1 +ATOM 5691 C CE1 . TYR B 1 81 ? 61.112 51.071 69.277 1.00 7.39 ? 101 TYR B CE1 1 +ATOM 5692 C CE2 . TYR B 1 81 ? 60.828 48.729 69.745 1.00 5.89 ? 101 TYR B CE2 1 +ATOM 5693 C CZ . TYR B 1 81 ? 61.223 50.002 70.150 1.00 7.32 ? 101 TYR B CZ 1 +ATOM 5694 O OH . TYR B 1 81 ? 61.723 50.242 71.410 1.00 6.72 ? 101 TYR B OH 1 +ATOM 5695 N N . GLU B 1 82 ? 57.693 50.930 64.071 1.00 10.52 ? 102 GLU B N 1 +ATOM 5696 C CA . GLU B 1 82 ? 57.573 51.270 62.659 1.00 10.92 ? 102 GLU B CA 1 +ATOM 5697 C C . GLU B 1 82 ? 58.026 52.692 62.347 1.00 11.76 ? 102 GLU B C 1 +ATOM 5698 O O . GLU B 1 82 ? 57.790 53.621 63.116 1.00 12.91 ? 102 GLU B O 1 +ATOM 5699 C CB . GLU B 1 82 ? 56.143 51.058 62.175 1.00 10.59 ? 102 GLU B CB 1 +ATOM 5700 C CG . GLU B 1 82 ? 56.000 51.208 60.676 1.00 10.90 ? 102 GLU B CG 1 +ATOM 5701 C CD . GLU B 1 82 ? 54.673 50.714 60.190 1.00 11.20 ? 102 GLU B CD 1 +ATOM 5702 O OE1 . GLU B 1 82 ? 54.567 49.483 59.948 1.00 11.38 ? 102 GLU B OE1 1 +ATOM 5703 O OE2 . GLU B 1 82 ? 53.740 51.542 60.075 1.00 10.18 ? 102 GLU B OE2 1 +ATOM 5704 N N . ARG B 1 83 ? 58.694 52.840 61.206 1.00 13.12 ? 103 ARG B N 1 +ATOM 5705 C CA . ARG B 1 83 ? 59.166 54.132 60.714 1.00 15.11 ? 103 ARG B CA 1 +ATOM 5706 C C . ARG B 1 83 ? 58.931 54.206 59.210 1.00 15.65 ? 103 ARG B C 1 +ATOM 5707 O O . ARG B 1 83 ? 59.189 53.235 58.496 1.00 15.55 ? 103 ARG B O 1 +ATOM 5708 C CB . ARG B 1 83 ? 60.668 54.233 61.002 1.00 15.29 ? 103 ARG B CB 1 +ATOM 5709 C CG . ARG B 1 83 ? 61.386 55.389 60.381 1.00 17.75 ? 103 ARG B CG 1 +ATOM 5710 C CD . ARG B 1 83 ? 61.379 56.589 61.274 1.00 21.05 ? 103 ARG B CD 1 +ATOM 5711 N NE . ARG B 1 83 ? 62.496 57.453 60.929 1.00 22.67 ? 103 ARG B NE 1 +ATOM 5712 C CZ . ARG B 1 83 ? 63.271 58.087 61.801 1.00 24.06 ? 103 ARG B CZ 1 +ATOM 5713 N NH1 . ARG B 1 83 ? 63.071 57.979 63.117 1.00 24.27 ? 103 ARG B NH1 1 +ATOM 5714 N NH2 . ARG B 1 83 ? 64.260 58.836 61.345 1.00 24.90 ? 103 ARG B NH2 1 +ATOM 5715 N N . GLU B 1 84 ? 58.453 55.351 58.724 1.00 16.22 ? 104 GLU B N 1 +ATOM 5716 C CA . GLU B 1 84 ? 58.424 55.608 57.284 1.00 17.63 ? 104 GLU B CA 1 +ATOM 5717 C C . GLU B 1 84 ? 59.600 56.505 56.880 1.00 17.89 ? 104 GLU B C 1 +ATOM 5718 O O . GLU B 1 84 ? 59.905 57.477 57.572 1.00 18.02 ? 104 GLU B O 1 +ATOM 5719 C CB . GLU B 1 84 ? 57.093 56.222 56.872 1.00 18.34 ? 104 GLU B CB 1 +ATOM 5720 C CG . GLU B 1 84 ? 55.912 55.380 57.329 1.00 20.56 ? 104 GLU B CG 1 +ATOM 5721 C CD . GLU B 1 84 ? 54.749 55.349 56.351 1.00 24.17 ? 104 GLU B CD 1 +ATOM 5722 O OE1 . GLU B 1 84 ? 54.766 56.082 55.336 1.00 28.35 ? 104 GLU B OE1 1 +ATOM 5723 O OE2 . GLU B 1 84 ? 53.803 54.580 56.611 1.00 26.87 ? 104 GLU B OE2 1 +ATOM 5724 N N . VAL B 1 85 ? 60.256 56.163 55.772 1.00 17.95 ? 105 VAL B N 1 +ATOM 5725 C CA . VAL B 1 85 ? 61.440 56.891 55.310 1.00 18.54 ? 105 VAL B CA 1 +ATOM 5726 C C . VAL B 1 85 ? 61.301 57.311 53.855 1.00 18.25 ? 105 VAL B C 1 +ATOM 5727 O O . VAL B 1 85 ? 60.803 56.545 53.033 1.00 18.11 ? 105 VAL B O 1 +ATOM 5728 C CB . VAL B 1 85 ? 62.709 56.015 55.406 1.00 18.51 ? 105 VAL B CB 1 +ATOM 5729 C CG1 . VAL B 1 85 ? 63.950 56.890 55.306 1.00 20.20 ? 105 VAL B CG1 1 +ATOM 5730 C CG2 . VAL B 1 85 ? 62.712 55.188 56.694 1.00 19.29 ? 105 VAL B CG2 1 +ATOM 5731 N N . ILE B 1 86 ? 61.740 58.533 53.546 1.00 18.67 ? 106 ILE B N 1 +ATOM 5732 C CA . ILE B 1 86 ? 61.843 58.994 52.160 1.00 18.90 ? 106 ILE B CA 1 +ATOM 5733 C C . ILE B 1 86 ? 63.298 58.860 51.724 1.00 19.12 ? 106 ILE B C 1 +ATOM 5734 O O . ILE B 1 86 ? 64.191 59.459 52.322 1.00 18.91 ? 106 ILE B O 1 +ATOM 5735 C CB . ILE B 1 86 ? 61.343 60.445 51.995 1.00 18.73 ? 106 ILE B CB 1 +ATOM 5736 C CG1 . ILE B 1 86 ? 59.831 60.493 52.201 1.00 19.40 ? 106 ILE B CG1 1 +ATOM 5737 C CG2 . ILE B 1 86 ? 61.675 60.985 50.606 1.00 19.30 ? 106 ILE B CG2 1 +ATOM 5738 C CD1 . ILE B 1 86 ? 59.248 61.888 52.117 1.00 20.93 ? 106 ILE B CD1 1 +ATOM 5739 N N . LEU B 1 87 ? 63.527 58.025 50.717 1.00 19.44 ? 107 LEU B N 1 +ATOM 5740 C CA . LEU B 1 87 ? 64.874 57.725 50.244 1.00 20.33 ? 107 LEU B CA 1 +ATOM 5741 C C . LEU B 1 87 ? 65.211 58.648 49.098 1.00 20.90 ? 107 LEU B C 1 +ATOM 5742 O O . LEU B 1 87 ? 64.330 58.962 48.305 1.00 20.70 ? 107 LEU B O 1 +ATOM 5743 C CB . LEU B 1 87 ? 64.947 56.289 49.727 1.00 20.62 ? 107 LEU B CB 1 +ATOM 5744 C CG . LEU B 1 87 ? 64.594 55.200 50.735 1.00 21.40 ? 107 LEU B CG 1 +ATOM 5745 C CD1 . LEU B 1 87 ? 64.745 53.826 50.084 1.00 20.97 ? 107 LEU B CD1 1 +ATOM 5746 C CD2 . LEU B 1 87 ? 65.454 55.327 51.989 1.00 23.04 ? 107 LEU B CD2 1 +ATOM 5747 N N . PRO B 1 88 ? 66.489 59.071 48.995 1.00 21.31 ? 108 PRO B N 1 +ATOM 5748 C CA . PRO B 1 88 ? 66.957 59.807 47.820 1.00 21.61 ? 108 PRO B CA 1 +ATOM 5749 C C . PRO B 1 88 ? 66.587 59.089 46.518 1.00 22.11 ? 108 PRO B C 1 +ATOM 5750 O O . PRO B 1 88 ? 66.651 57.857 46.444 1.00 21.47 ? 108 PRO B O 1 +ATOM 5751 C CB . PRO B 1 88 ? 68.480 59.844 48.009 1.00 21.55 ? 108 PRO B CB 1 +ATOM 5752 C CG . PRO B 1 88 ? 68.675 59.751 49.483 1.00 21.41 ? 108 PRO B CG 1 +ATOM 5753 C CD . PRO B 1 88 ? 67.552 58.895 50.002 1.00 21.51 ? 108 PRO B CD 1 +ATOM 5754 N N . GLU B 1 89 ? 66.196 59.847 45.496 1.00 22.71 ? 109 GLU B N 1 +ATOM 5755 C CA . GLU B 1 89 ? 65.747 59.220 44.254 1.00 23.35 ? 109 GLU B CA 1 +ATOM 5756 C C . GLU B 1 89 ? 66.883 58.425 43.612 1.00 23.02 ? 109 GLU B C 1 +ATOM 5757 O O . GLU B 1 89 ? 66.637 57.407 42.983 1.00 23.30 ? 109 GLU B O 1 +ATOM 5758 C CB . GLU B 1 89 ? 65.129 60.243 43.282 1.00 24.01 ? 109 GLU B CB 1 +ATOM 5759 C CG . GLU B 1 89 ? 64.057 61.121 43.960 1.00 26.08 ? 109 GLU B CG 1 +ATOM 5760 C CD . GLU B 1 89 ? 62.764 61.309 43.164 1.00 28.60 ? 109 GLU B CD 1 +ATOM 5761 O OE1 . GLU B 1 89 ? 61.730 61.617 43.806 1.00 31.24 ? 109 GLU B OE1 1 +ATOM 5762 O OE2 . GLU B 1 89 ? 62.768 61.166 41.920 1.00 30.19 ? 109 GLU B OE2 1 +ATOM 5763 N N . ARG B 1 90 ? 68.123 58.860 43.822 1.00 22.76 ? 110 ARG B N 1 +ATOM 5764 C CA . ARG B 1 90 ? 69.276 58.177 43.254 1.00 22.61 ? 110 ARG B CA 1 +ATOM 5765 C C . ARG B 1 90 ? 69.421 56.746 43.771 1.00 22.52 ? 110 ARG B C 1 +ATOM 5766 O O . ARG B 1 90 ? 69.885 55.873 43.044 1.00 22.52 ? 110 ARG B O 1 +ATOM 5767 C CB . ARG B 1 90 ? 70.559 58.968 43.528 1.00 22.69 ? 110 ARG B CB 1 +ATOM 5768 C CG . ARG B 1 90 ? 71.724 58.582 42.638 1.00 23.19 ? 110 ARG B CG 1 +ATOM 5769 C CD . ARG B 1 90 ? 72.619 59.171 41.913 0.00 24.33 ? 110 ARG B CD 1 +ATOM 5770 N NE . ARG B 1 90 ? 72.744 58.861 40.489 0.00 24.33 ? 110 ARG B NE 1 +ATOM 5771 C CZ . ARG B 1 90 ? 73.857 58.905 39.756 0.00 24.33 ? 110 ARG B CZ 1 +ATOM 5772 N NH1 . ARG B 1 90 ? 73.808 58.605 38.445 0.00 24.33 ? 110 ARG B NH1 1 +ATOM 5773 N NH2 . ARG B 1 90 ? 75.023 59.236 40.284 0.00 44.25 ? 110 ARG B NH2 1 +ATOM 5774 N N . TRP B 1 91 ? 69.022 56.503 45.020 1.00 22.22 ? 111 TRP B N 1 +ATOM 5775 C CA . TRP B 1 91 ? 69.082 55.151 45.600 1.00 22.08 ? 111 TRP B CA 1 +ATOM 5776 C C . TRP B 1 91 ? 68.104 54.196 44.922 1.00 22.97 ? 111 TRP B C 1 +ATOM 5777 O O . TRP B 1 91 ? 68.369 52.995 44.812 1.00 23.33 ? 111 TRP B O 1 +ATOM 5778 C CB . TRP B 1 91 ? 68.739 55.184 47.091 1.00 21.22 ? 111 TRP B CB 1 +ATOM 5779 C CG . TRP B 1 91 ? 69.751 55.840 47.961 1.00 20.38 ? 111 TRP B CG 1 +ATOM 5780 C CD1 . TRP B 1 91 ? 70.723 56.721 47.578 1.00 19.76 ? 111 TRP B CD1 1 +ATOM 5781 C CD2 . TRP B 1 91 ? 69.876 55.697 49.379 1.00 19.49 ? 111 TRP B CD2 1 +ATOM 5782 N NE1 . TRP B 1 91 ? 71.451 57.119 48.665 1.00 19.42 ? 111 TRP B NE1 1 +ATOM 5783 C CE2 . TRP B 1 91 ? 70.950 56.515 49.787 1.00 19.14 ? 111 TRP B CE2 1 +ATOM 5784 C CE3 . TRP B 1 91 ? 69.180 54.962 50.347 1.00 19.98 ? 111 TRP B CE3 1 +ATOM 5785 C CZ2 . TRP B 1 91 ? 71.353 56.613 51.123 1.00 19.50 ? 111 TRP B CZ2 1 +ATOM 5786 C CZ3 . TRP B 1 91 ? 69.580 55.057 51.677 1.00 19.85 ? 111 TRP B CZ3 1 +ATOM 5787 C CH2 . TRP B 1 91 ? 70.659 55.878 52.051 1.00 19.62 ? 111 TRP B CH2 1 +ATOM 5788 N N . THR B 1 92 ? 66.965 54.747 44.508 1.00 23.86 ? 112 THR B N 1 +ATOM 5789 C CA . THR B 1 92 ? 65.859 53.980 43.948 1.00 24.52 ? 112 THR B CA 1 +ATOM 5790 C C . THR B 1 92 ? 65.878 53.930 42.416 1.00 25.30 ? 112 THR B C 1 +ATOM 5791 O O . THR B 1 92 ? 65.260 53.041 41.823 1.00 25.86 ? 112 THR B O 1 +ATOM 5792 C CB . THR B 1 92 ? 64.508 54.577 44.394 1.00 24.30 ? 112 THR B CB 1 +ATOM 5793 O OG1 . THR B 1 92 ? 64.320 55.862 43.787 1.00 24.53 ? 112 THR B OG1 1 +ATOM 5794 C CG2 . THR B 1 92 ? 64.461 54.742 45.908 1.00 24.39 ? 112 THR B CG2 1 +ATOM 5795 N N . GLN B 1 93 ? 66.568 54.884 41.788 1.00 26.13 ? 113 GLN B N 1 +ATOM 5796 C CA . GLN B 1 93 ? 66.609 55.009 40.327 1.00 26.56 ? 113 GLN B CA 1 +ATOM 5797 C C . GLN B 1 93 ? 67.916 54.506 39.723 1.00 26.60 ? 113 GLN B C 1 +ATOM 5798 O O . GLN B 1 93 ? 67.914 53.962 38.613 1.00 27.29 ? 113 GLN B O 1 +ATOM 5799 C CB . GLN B 1 93 ? 66.402 56.467 39.903 1.00 26.84 ? 113 GLN B CB 1 +ATOM 5800 C CG . GLN B 1 93 ? 65.138 57.131 40.452 1.00 28.40 ? 113 GLN B CG 1 +ATOM 5801 C CD . GLN B 1 93 ? 63.884 56.333 40.198 1.00 30.65 ? 113 GLN B CD 1 +ATOM 5802 O OE1 . GLN B 1 93 ? 63.176 55.953 41.134 1.00 32.49 ? 113 GLN B OE1 1 +ATOM 5803 N NE2 . GLN B 1 93 ? 63.596 56.070 38.927 1.00 32.87 ? 113 GLN B NE2 1 +ATOM 5804 N N . ASP B 1 94 ? 69.024 54.696 40.435 1.00 26.18 ? 114 ASP B N 1 +ATOM 5805 C CA . ASP B 1 94 ? 70.331 54.233 39.976 1.00 26.08 ? 114 ASP B CA 1 +ATOM 5806 C C . ASP B 1 94 ? 70.551 52.794 40.438 1.00 25.54 ? 114 ASP B C 1 +ATOM 5807 O O . ASP B 1 94 ? 70.862 52.544 41.607 1.00 26.10 ? 114 ASP B O 1 +ATOM 5808 C CB . ASP B 1 94 ? 71.433 55.142 40.513 1.00 25.95 ? 114 ASP B CB 1 +ATOM 5809 C CG . ASP B 1 94 ? 72.752 54.956 39.795 1.00 26.95 ? 114 ASP B CG 1 +ATOM 5810 O OD1 . ASP B 1 94 ? 73.058 53.827 39.350 1.00 25.24 ? 114 ASP B OD1 1 +ATOM 5811 O OD2 . ASP B 1 94 ? 73.493 55.954 39.693 1.00 29.31 ? 114 ASP B OD2 1 +ATOM 5812 N N . LEU B 1 95 ? 70.414 51.853 39.510 1.00 24.82 ? 115 LEU B N 1 +ATOM 5813 C CA . LEU B 1 95 ? 70.515 50.424 39.835 1.00 24.28 ? 115 LEU B CA 1 +ATOM 5814 C C . LEU B 1 95 ? 71.938 49.970 40.181 1.00 23.63 ? 115 LEU B C 1 +ATOM 5815 O O . LEU B 1 95 ? 72.138 48.813 40.543 1.00 24.16 ? 115 LEU B O 1 +ATOM 5816 C CB . LEU B 1 95 ? 69.949 49.571 38.691 1.00 24.16 ? 115 LEU B CB 1 +ATOM 5817 C CG . LEU B 1 95 ? 68.497 49.863 38.289 1.00 24.30 ? 115 LEU B CG 1 +ATOM 5818 C CD1 . LEU B 1 95 ? 68.060 48.912 37.192 1.00 25.30 ? 115 LEU B CD1 1 +ATOM 5819 C CD2 . LEU B 1 95 ? 67.552 49.779 39.476 1.00 23.58 ? 115 LEU B CD2 1 +ATOM 5820 N N . ARG B 1 96 ? 72.916 50.868 40.066 1.00 22.92 ? 116 ARG B N 1 +ATOM 5821 C CA . ARG B 1 96 ? 74.259 50.623 40.595 1.00 22.30 ? 116 ARG B CA 1 +ATOM 5822 C C . ARG B 1 96 ? 74.322 50.806 42.116 1.00 21.09 ? 116 ARG B C 1 +ATOM 5823 O O . ARG B 1 96 ? 75.363 50.580 42.720 1.00 21.18 ? 116 ARG B O 1 +ATOM 5824 C CB . ARG B 1 96 ? 75.282 51.564 39.946 1.00 22.75 ? 116 ARG B CB 1 +ATOM 5825 C CG . ARG B 1 96 ? 75.428 51.421 38.428 1.00 23.57 ? 116 ARG B CG 1 +ATOM 5826 C CD . ARG B 1 96 ? 76.076 52.665 37.835 1.00 25.77 ? 116 ARG B CD 1 +ATOM 5827 N NE . ARG B 1 96 ? 75.087 53.704 37.541 1.00 26.83 ? 116 ARG B NE 1 +ATOM 5828 C CZ . ARG B 1 96 ? 75.358 55.003 37.407 1.00 28.14 ? 116 ARG B CZ 1 +ATOM 5829 N NH1 . ARG B 1 96 ? 76.593 55.470 37.547 1.00 29.95 ? 116 ARG B NH1 1 +ATOM 5830 N NH2 . ARG B 1 96 ? 74.375 55.850 37.140 1.00 28.66 ? 116 ARG B NH2 1 +ATOM 5831 N N . THR B 1 97 ? 73.222 51.222 42.736 1.00 19.80 ? 117 THR B N 1 +ATOM 5832 C CA . THR B 1 97 ? 73.175 51.372 44.186 1.00 18.74 ? 117 THR B CA 1 +ATOM 5833 C C . THR B 1 97 ? 72.741 50.058 44.856 1.00 17.93 ? 117 THR B C 1 +ATOM 5834 O O . THR B 1 97 ? 71.704 49.483 44.518 1.00 17.80 ? 117 THR B O 1 +ATOM 5835 C CB . THR B 1 97 ? 72.205 52.498 44.607 1.00 18.99 ? 117 THR B CB 1 +ATOM 5836 O OG1 . THR B 1 97 ? 72.425 53.666 43.802 1.00 18.22 ? 117 THR B OG1 1 +ATOM 5837 C CG2 . THR B 1 97 ? 72.403 52.848 46.068 1.00 19.33 ? 117 THR B CG2 1 +ATOM 5838 N N . ARG B 1 98 ? 73.565 49.577 45.779 1.00 16.15 ? 118 ARG B N 1 +ATOM 5839 C CA . ARG B 1 98 ? 73.167 48.541 46.723 1.00 15.58 ? 118 ARG B CA 1 +ATOM 5840 C C . ARG B 1 98 ? 72.705 49.237 48.011 1.00 15.02 ? 118 ARG B C 1 +ATOM 5841 O O . ARG B 1 98 ? 73.462 50.022 48.600 1.00 14.91 ? 118 ARG B O 1 +ATOM 5842 C CB . ARG B 1 98 ? 74.334 47.576 46.988 1.00 15.57 ? 118 ARG B CB 1 +ATOM 5843 C CG . ARG B 1 98 ? 74.102 46.596 48.118 1.00 15.02 ? 118 ARG B CG 1 +ATOM 5844 C CD . ARG B 1 98 ? 75.108 45.447 48.085 1.00 15.30 ? 118 ARG B CD 1 +ATOM 5845 N NE . ARG B 1 98 ? 75.057 44.672 49.322 1.00 15.52 ? 118 ARG B NE 1 +ATOM 5846 C CZ . ARG B 1 98 ? 75.696 44.983 50.449 1.00 15.36 ? 118 ARG B CZ 1 +ATOM 5847 N NH1 . ARG B 1 98 ? 76.491 46.047 50.524 1.00 15.80 ? 118 ARG B NH1 1 +ATOM 5848 N NH2 . ARG B 1 98 ? 75.559 44.203 51.507 1.00 16.97 ? 118 ARG B NH2 1 +ATOM 5849 N N . VAL B 1 99 ? 71.466 48.970 48.432 1.00 14.10 ? 119 VAL B N 1 +ATOM 5850 C CA . VAL B 1 99 ? 70.896 49.573 49.644 1.00 13.66 ? 119 VAL B CA 1 +ATOM 5851 C C . VAL B 1 99 ? 70.758 48.512 50.742 1.00 13.44 ? 119 VAL B C 1 +ATOM 5852 O O . VAL B 1 99 ? 70.157 47.455 50.530 1.00 13.45 ? 119 VAL B O 1 +ATOM 5853 C CB . VAL B 1 99 ? 69.512 50.214 49.379 1.00 13.45 ? 119 VAL B CB 1 +ATOM 5854 C CG1 . VAL B 1 99 ? 68.944 50.803 50.658 1.00 13.63 ? 119 VAL B CG1 1 +ATOM 5855 C CG2 . VAL B 1 99 ? 69.609 51.280 48.288 1.00 13.86 ? 119 VAL B CG2 1 +ATOM 5856 N N . VAL B 1 100 ? 71.318 48.802 51.911 1.00 12.64 ? 120 VAL B N 1 +ATOM 5857 C CA . VAL B 1 100 ? 71.331 47.869 53.033 1.00 12.67 ? 120 VAL B CA 1 +ATOM 5858 C C . VAL B 1 100 ? 70.647 48.497 54.247 1.00 11.99 ? 120 VAL B C 1 +ATOM 5859 O O . VAL B 1 100 ? 70.871 49.667 54.553 1.00 12.02 ? 120 VAL B O 1 +ATOM 5860 C CB . VAL B 1 100 ? 72.774 47.491 53.407 1.00 12.99 ? 120 VAL B CB 1 +ATOM 5861 C CG1 . VAL B 1 100 ? 72.799 46.453 54.530 1.00 12.81 ? 120 VAL B CG1 1 +ATOM 5862 C CG2 . VAL B 1 100 ? 73.510 46.957 52.194 1.00 13.59 ? 120 VAL B CG2 1 +ATOM 5863 N N . LEU B 1 101 ? 69.808 47.709 54.914 1.00 11.80 ? 121 LEU B N 1 +ATOM 5864 C CA . LEU B 1 101 ? 69.201 48.078 56.187 1.00 11.93 ? 121 LEU B CA 1 +ATOM 5865 C C . LEU B 1 101 ? 69.944 47.375 57.322 1.00 11.55 ? 121 LEU B C 1 +ATOM 5866 O O . LEU B 1 101 ? 69.982 46.136 57.365 1.00 11.46 ? 121 LEU B O 1 +ATOM 5867 C CB . LEU B 1 101 ? 67.732 47.642 56.210 1.00 12.16 ? 121 LEU B CB 1 +ATOM 5868 C CG . LEU B 1 101 ? 66.966 47.782 57.521 1.00 11.90 ? 121 LEU B CG 1 +ATOM 5869 C CD1 . LEU B 1 101 ? 67.030 49.222 58.044 1.00 11.12 ? 121 LEU B CD1 1 +ATOM 5870 C CD2 . LEU B 1 101 ? 65.523 47.342 57.311 1.00 12.16 ? 121 LEU B CD2 1 +ATOM 5871 N N . ARG B 1 102 ? 70.509 48.160 58.232 1.00 11.47 ? 122 ARG B N 1 +ATOM 5872 C CA . ARG B 1 102 ? 71.317 47.641 59.329 1.00 11.49 ? 122 ARG B CA 1 +ATOM 5873 C C . ARG B 1 102 ? 70.643 47.939 60.663 1.00 11.53 ? 122 ARG B C 1 +ATOM 5874 O O . ARG B 1 102 ? 70.322 49.095 60.952 1.00 11.72 ? 122 ARG B O 1 +ATOM 5875 C CB . ARG B 1 102 ? 72.702 48.291 59.287 1.00 11.95 ? 122 ARG B CB 1 +ATOM 5876 C CG . ARG B 1 102 ? 73.516 48.206 60.569 1.00 13.04 ? 122 ARG B CG 1 +ATOM 5877 C CD . ARG B 1 102 ? 74.007 46.802 60.794 1.00 14.75 ? 122 ARG B CD 1 +ATOM 5878 N NE . ARG B 1 102 ? 75.056 46.420 59.842 1.00 16.09 ? 122 ARG B NE 1 +ATOM 5879 C CZ . ARG B 1 102 ? 76.370 46.543 60.038 1.00 16.78 ? 122 ARG B CZ 1 +ATOM 5880 N NH1 . ARG B 1 102 ? 76.848 47.073 61.160 1.00 14.95 ? 122 ARG B NH1 1 +ATOM 5881 N NH2 . ARG B 1 102 ? 77.225 46.131 59.097 1.00 16.52 ? 122 ARG B NH2 1 +ATOM 5882 N N . ILE B 1 103 ? 70.433 46.898 61.466 1.00 11.36 ? 123 ILE B N 1 +ATOM 5883 C CA . ILE B 1 103 ? 69.870 47.044 62.822 1.00 10.98 ? 123 ILE B CA 1 +ATOM 5884 C C . ILE B 1 103 ? 70.973 46.803 63.852 1.00 10.23 ? 123 ILE B C 1 +ATOM 5885 O O . ILE B 1 103 ? 71.528 45.706 63.910 1.00 10.16 ? 123 ILE B O 1 +ATOM 5886 C CB . ILE B 1 103 ? 68.728 46.039 63.066 1.00 11.71 ? 123 ILE B CB 1 +ATOM 5887 C CG1 . ILE B 1 103 ? 67.634 46.142 61.990 1.00 12.98 ? 123 ILE B CG1 1 +ATOM 5888 C CG2 . ILE B 1 103 ? 68.126 46.238 64.435 1.00 10.93 ? 123 ILE B CG2 1 +ATOM 5889 C CD1 . ILE B 1 103 ? 67.185 47.523 61.680 1.00 13.96 ? 123 ILE B CD1 1 +ATOM 5890 N N . GLY B 1 104 ? 71.293 47.810 64.665 1.00 10.24 ? 124 GLY B N 1 +ATOM 5891 C CA . GLY B 1 104 ? 72.429 47.699 65.588 1.00 9.84 ? 124 GLY B CA 1 +ATOM 5892 C C . GLY B 1 104 ? 72.262 46.591 66.609 1.00 9.36 ? 124 GLY B C 1 +ATOM 5893 O O . GLY B 1 104 ? 73.219 45.891 66.946 1.00 9.25 ? 124 GLY B O 1 +ATOM 5894 N N . SER B 1 105 ? 71.039 46.422 67.099 1.00 8.91 ? 125 SER B N 1 +ATOM 5895 C CA . SER B 1 105 ? 70.733 45.337 68.020 1.00 9.20 ? 125 SER B CA 1 +ATOM 5896 C C . SER B 1 105 ? 69.231 45.171 68.210 1.00 9.35 ? 125 SER B C 1 +ATOM 5897 O O . SER B 1 105 ? 68.467 46.075 67.901 1.00 8.43 ? 125 SER B O 1 +ATOM 5898 C CB . SER B 1 105 ? 71.372 45.565 69.391 1.00 9.74 ? 125 SER B CB 1 +ATOM 5899 O OG . SER B 1 105 ? 70.817 46.687 70.049 1.00 9.39 ? 125 SER B OG 1 +ATOM 5900 N N . ALA B 1 106 ? 68.841 44.002 68.721 1.00 9.52 ? 126 ALA B N 1 +ATOM 5901 C CA . ALA B 1 106 ? 67.447 43.736 69.053 1.00 9.94 ? 126 ALA B CA 1 +ATOM 5902 C C . ALA B 1 106 ? 67.352 42.948 70.368 1.00 9.83 ? 126 ALA B C 1 +ATOM 5903 O O . ALA B 1 106 ? 67.738 43.444 71.426 1.00 10.04 ? 126 ALA B O 1 +ATOM 5904 C CB . ALA B 1 106 ? 66.774 43.006 67.900 1.00 9.75 ? 126 ALA B CB 1 +ATOM 5905 N N . HIS B 1 107 ? 66.856 41.719 70.311 1.00 9.40 ? 127 HIS B N 1 +ATOM 5906 C CA . HIS B 1 107 ? 66.642 40.927 71.518 1.00 9.84 ? 127 HIS B CA 1 +ATOM 5907 C C . HIS B 1 107 ? 66.514 39.456 71.125 1.00 10.40 ? 127 HIS B C 1 +ATOM 5908 O O . HIS B 1 107 ? 67.100 39.050 70.125 1.00 12.10 ? 127 HIS B O 1 +ATOM 5909 C CB . HIS B 1 107 ? 65.424 41.468 72.304 1.00 8.76 ? 127 HIS B CB 1 +ATOM 5910 C CG . HIS B 1 107 ? 65.550 41.303 73.786 1.00 8.45 ? 127 HIS B CG 1 +ATOM 5911 N ND1 . HIS B 1 107 ? 65.685 42.370 74.651 1.00 10.09 ? 127 HIS B ND1 1 +ATOM 5912 C CD2 . HIS B 1 107 ? 65.607 40.189 74.554 1.00 7.36 ? 127 HIS B CD2 1 +ATOM 5913 C CE1 . HIS B 1 107 ? 65.794 41.915 75.889 1.00 8.56 ? 127 HIS B CE1 1 +ATOM 5914 N NE2 . HIS B 1 107 ? 65.767 40.597 75.856 1.00 9.44 ? 127 HIS B NE2 1 +ATOM 5915 N N . SER B 1 108 ? 65.773 38.644 71.881 1.00 11.01 ? 128 SER B N 1 +ATOM 5916 C CA . SER B 1 108 ? 65.785 37.183 71.695 1.00 11.51 ? 128 SER B CA 1 +ATOM 5917 C C . SER B 1 108 ? 65.391 36.793 70.278 1.00 11.65 ? 128 SER B C 1 +ATOM 5918 O O . SER B 1 108 ? 65.977 35.879 69.699 1.00 12.10 ? 128 SER B O 1 +ATOM 5919 C CB . SER B 1 108 ? 64.849 36.492 72.700 1.00 11.60 ? 128 SER B CB 1 +ATOM 5920 O OG . SER B 1 108 ? 65.225 36.811 74.023 1.00 13.30 ? 128 SER B OG 1 +ATOM 5921 N N . TYR B 1 109 ? 64.380 37.469 69.736 1.00 11.83 ? 129 TYR B N 1 +ATOM 5922 C CA . TYR B 1 109 ? 64.051 37.348 68.321 1.00 12.30 ? 129 TYR B CA 1 +ATOM 5923 C C . TYR B 1 109 ? 63.628 38.687 67.740 1.00 11.68 ? 129 TYR B C 1 +ATOM 5924 O O . TYR B 1 109 ? 63.052 39.531 68.432 1.00 12.12 ? 129 TYR B O 1 +ATOM 5925 C CB . TYR B 1 109 ? 62.971 36.286 68.072 1.00 13.02 ? 129 TYR B CB 1 +ATOM 5926 C CG . TYR B 1 109 ? 63.158 35.575 66.750 1.00 14.16 ? 129 TYR B CG 1 +ATOM 5927 C CD1 . TYR B 1 109 ? 63.999 34.461 66.645 1.00 16.83 ? 129 TYR B CD1 1 +ATOM 5928 C CD2 . TYR B 1 109 ? 62.548 36.043 65.593 1.00 15.11 ? 129 TYR B CD2 1 +ATOM 5929 C CE1 . TYR B 1 109 ? 64.196 33.828 65.430 1.00 17.06 ? 129 TYR B CE1 1 +ATOM 5930 C CE2 . TYR B 1 109 ? 62.731 35.405 64.377 1.00 15.57 ? 129 TYR B CE2 1 +ATOM 5931 C CZ . TYR B 1 109 ? 63.553 34.308 64.301 1.00 16.15 ? 129 TYR B CZ 1 +ATOM 5932 O OH . TYR B 1 109 ? 63.744 33.694 63.081 1.00 18.28 ? 129 TYR B OH 1 +ATOM 5933 N N . ALA B 1 110 ? 63.965 38.894 66.471 1.00 10.85 ? 130 ALA B N 1 +ATOM 5934 C CA . ALA B 1 110 ? 63.533 40.086 65.755 1.00 10.70 ? 130 ALA B CA 1 +ATOM 5935 C C . ALA B 1 110 ? 63.219 39.706 64.311 1.00 10.31 ? 130 ALA B C 1 +ATOM 5936 O O . ALA B 1 110 ? 63.953 38.932 63.681 1.00 9.88 ? 130 ALA B O 1 +ATOM 5937 C CB . ALA B 1 110 ? 64.594 41.187 65.833 1.00 10.27 ? 130 ALA B CB 1 +ATOM 5938 N N . ILE B 1 111 ? 62.095 40.221 63.823 1.00 9.88 ? 131 ILE B N 1 +ATOM 5939 C CA . ILE B 1 111 ? 61.682 40.061 62.439 1.00 10.17 ? 131 ILE B CA 1 +ATOM 5940 C C . ILE B 1 111 ? 61.510 41.457 61.852 1.00 9.73 ? 131 ILE B C 1 +ATOM 5941 O O . ILE B 1 111 ? 60.950 42.342 62.508 1.00 9.74 ? 131 ILE B O 1 +ATOM 5942 C CB . ILE B 1 111 ? 60.356 39.281 62.326 1.00 10.46 ? 131 ILE B CB 1 +ATOM 5943 C CG1 . ILE B 1 111 ? 60.480 37.904 62.998 1.00 11.66 ? 131 ILE B CG1 1 +ATOM 5944 C CG2 . ILE B 1 111 ? 59.982 39.089 60.850 1.00 11.83 ? 131 ILE B CG2 1 +ATOM 5945 C CD1 . ILE B 1 111 ? 59.152 37.186 63.162 1.00 12.42 ? 131 ILE B CD1 1 +ATOM 5946 N N . VAL B 1 112 ? 62.000 41.655 60.632 1.00 9.79 ? 132 VAL B N 1 +ATOM 5947 C CA . VAL B 1 112 ? 61.921 42.961 59.969 1.00 10.07 ? 132 VAL B CA 1 +ATOM 5948 C C . VAL B 1 112 ? 61.187 42.803 58.634 1.00 10.49 ? 132 VAL B C 1 +ATOM 5949 O O . VAL B 1 112 ? 61.514 41.913 57.829 1.00 10.22 ? 132 VAL B O 1 +ATOM 5950 C CB . VAL B 1 112 ? 63.328 43.557 59.726 1.00 10.06 ? 132 VAL B CB 1 +ATOM 5951 C CG1 . VAL B 1 112 ? 63.237 44.918 59.038 1.00 9.60 ? 132 VAL B CG1 1 +ATOM 5952 C CG2 . VAL B 1 112 ? 64.091 43.666 61.046 1.00 9.56 ? 132 VAL B CG2 1 +ATOM 5953 N N . TRP B 1 113 ? 60.176 43.645 58.434 1.00 11.19 ? 133 TRP B N 1 +ATOM 5954 C CA . TRP B 1 113 ? 59.498 43.747 57.161 1.00 11.54 ? 133 TRP B CA 1 +ATOM 5955 C C . TRP B 1 113 ? 59.811 45.076 56.499 1.00 12.13 ? 133 TRP B C 1 +ATOM 5956 O O . TRP B 1 113 ? 59.918 46.114 57.167 1.00 12.65 ? 133 TRP B O 1 +ATOM 5957 C CB . TRP B 1 113 ? 57.987 43.671 57.344 1.00 11.56 ? 133 TRP B CB 1 +ATOM 5958 C CG . TRP B 1 113 ? 57.487 42.422 57.959 1.00 11.39 ? 133 TRP B CG 1 +ATOM 5959 C CD1 . TRP B 1 113 ? 56.999 41.329 57.293 1.00 12.44 ? 133 TRP B CD1 1 +ATOM 5960 C CD2 . TRP B 1 113 ? 57.371 42.122 59.359 1.00 11.97 ? 133 TRP B CD2 1 +ATOM 5961 N NE1 . TRP B 1 113 ? 56.601 40.366 58.190 1.00 12.83 ? 133 TRP B NE1 1 +ATOM 5962 C CE2 . TRP B 1 113 ? 56.822 40.818 59.463 1.00 12.93 ? 133 TRP B CE2 1 +ATOM 5963 C CE3 . TRP B 1 113 ? 57.681 42.815 60.535 1.00 11.81 ? 133 TRP B CE3 1 +ATOM 5964 C CZ2 . TRP B 1 113 ? 56.566 40.201 60.703 1.00 11.56 ? 133 TRP B CZ2 1 +ATOM 5965 C CZ3 . TRP B 1 113 ? 57.420 42.194 61.769 1.00 11.65 ? 133 TRP B CZ3 1 +ATOM 5966 C CH2 . TRP B 1 113 ? 56.877 40.903 61.837 1.00 12.47 ? 133 TRP B CH2 1 +ATOM 5967 N N . VAL B 1 114 ? 59.897 45.047 55.173 1.00 12.40 ? 134 VAL B N 1 +ATOM 5968 C CA . VAL B 1 114 ? 60.072 46.266 54.389 1.00 12.71 ? 134 VAL B CA 1 +ATOM 5969 C C . VAL B 1 114 ? 58.889 46.326 53.431 1.00 13.24 ? 134 VAL B C 1 +ATOM 5970 O O . VAL B 1 114 ? 58.714 45.425 52.617 1.00 13.21 ? 134 VAL B O 1 +ATOM 5971 C CB . VAL B 1 114 ? 61.429 46.272 53.664 1.00 12.94 ? 134 VAL B CB 1 +ATOM 5972 C CG1 . VAL B 1 114 ? 61.539 47.431 52.702 1.00 12.84 ? 134 VAL B CG1 1 +ATOM 5973 C CG2 . VAL B 1 114 ? 62.545 46.362 54.685 1.00 13.73 ? 134 VAL B CG2 1 +ATOM 5974 N N . ASN B 1 115 ? 58.069 47.364 53.580 1.00 13.69 ? 135 ASN B N 1 +ATOM 5975 C CA . ASN B 1 115 ? 56.802 47.508 52.842 1.00 14.20 ? 135 ASN B CA 1 +ATOM 5976 C C . ASN B 1 115 ? 55.909 46.264 52.949 1.00 14.25 ? 135 ASN B C 1 +ATOM 5977 O O . ASN B 1 115 ? 55.273 45.838 51.967 1.00 14.19 ? 135 ASN B O 1 +ATOM 5978 C CB . ASN B 1 115 ? 57.080 47.873 51.380 1.00 14.41 ? 135 ASN B CB 1 +ATOM 5979 C CG . ASN B 1 115 ? 57.716 49.240 51.238 1.00 16.21 ? 135 ASN B CG 1 +ATOM 5980 O OD1 . ASN B 1 115 ? 57.504 50.113 52.075 1.00 18.80 ? 135 ASN B OD1 1 +ATOM 5981 N ND2 . ASN B 1 115 ? 58.501 49.434 50.172 1.00 17.73 ? 135 ASN B ND2 1 +ATOM 5982 N N . GLY B 1 116 ? 55.850 45.694 54.151 1.00 14.31 ? 136 GLY B N 1 +ATOM 5983 C CA . GLY B 1 116 ? 55.028 44.509 54.418 1.00 14.50 ? 136 GLY B CA 1 +ATOM 5984 C C . GLY B 1 116 ? 55.649 43.182 54.025 1.00 14.73 ? 136 GLY B C 1 +ATOM 5985 O O . GLY B 1 116 ? 55.061 42.131 54.286 1.00 15.59 ? 136 GLY B O 1 +ATOM 5986 N N . VAL B 1 117 ? 56.839 43.213 53.421 1.00 14.74 ? 137 VAL B N 1 +ATOM 5987 C CA . VAL B 1 117 ? 57.524 41.997 52.960 1.00 14.70 ? 137 VAL B CA 1 +ATOM 5988 C C . VAL B 1 117 ? 58.626 41.585 53.938 1.00 14.90 ? 137 VAL B C 1 +ATOM 5989 O O . VAL B 1 117 ? 59.544 42.362 54.195 1.00 13.89 ? 137 VAL B O 1 +ATOM 5990 C CB . VAL B 1 117 ? 58.163 42.216 51.582 1.00 14.60 ? 137 VAL B CB 1 +ATOM 5991 C CG1 . VAL B 1 117 ? 58.897 40.955 51.113 1.00 16.16 ? 137 VAL B CG1 1 +ATOM 5992 C CG2 . VAL B 1 117 ? 57.110 42.659 50.568 1.00 15.51 ? 137 VAL B CG2 1 +ATOM 5993 N N . ASP B 1 118 ? 58.543 40.379 54.492 1.00 14.97 ? 138 ASP B N 1 +ATOM 5994 C CA . ASP B 1 118 ? 59.561 39.963 55.454 1.00 15.52 ? 138 ASP B CA 1 +ATOM 5995 C C . ASP B 1 118 ? 60.901 39.782 54.744 1.00 15.40 ? 138 ASP B C 1 +ATOM 5996 O O . ASP B 1 118 ? 60.991 39.097 53.721 1.00 15.50 ? 138 ASP B O 1 +ATOM 5997 C CB . ASP B 1 118 ? 59.165 38.700 56.223 1.00 16.15 ? 138 ASP B CB 1 +ATOM 5998 C CG . ASP B 1 118 ? 59.020 37.492 55.329 1.00 17.80 ? 138 ASP B CG 1 +ATOM 5999 O OD1 . ASP B 1 118 ? 58.027 37.447 54.576 1.00 21.61 ? 138 ASP B OD1 1 +ATOM 6000 O OD2 . ASP B 1 118 ? 59.887 36.593 55.390 1.00 20.60 ? 138 ASP B OD2 1 +ATOM 6001 N N . THR B 1 119 ? 61.937 40.411 55.293 1.00 15.08 ? 139 THR B N 1 +ATOM 6002 C CA . THR B 1 119 ? 63.250 40.455 54.658 1.00 14.66 ? 139 THR B CA 1 +ATOM 6003 C C . THR B 1 119 ? 64.419 40.128 55.572 1.00 13.98 ? 139 THR B C 1 +ATOM 6004 O O . THR B 1 119 ? 65.541 39.969 55.080 1.00 13.44 ? 139 THR B O 1 +ATOM 6005 C CB . THR B 1 119 ? 63.548 41.884 54.078 1.00 15.37 ? 139 THR B CB 1 +ATOM 6006 O OG1 A THR B 1 119 ? 63.100 42.983 54.890 0.50 16.51 ? 139 THR B OG1 1 +ATOM 6007 O OG1 B THR B 1 119 ? 64.593 41.825 53.089 0.50 14.58 ? 139 THR B OG1 1 +ATOM 6008 C CG2 A THR B 1 119 ? 63.724 42.063 52.549 0.50 15.82 ? 139 THR B CG2 1 +ATOM 6009 C CG2 B THR B 1 119 ? 63.865 42.900 55.174 0.50 15.69 ? 139 THR B CG2 1 +ATOM 6010 N N . LEU B 1 120 ? 64.199 40.067 56.883 1.00 12.73 ? 140 LEU B N 1 +ATOM 6011 C CA . LEU B 1 120 ? 65.319 39.916 57.813 1.00 12.57 ? 140 LEU B CA 1 +ATOM 6012 C C . LEU B 1 120 ? 64.847 39.388 59.178 1.00 12.55 ? 140 LEU B C 1 +ATOM 6013 O O . LEU B 1 120 ? 63.826 39.826 59.716 1.00 12.24 ? 140 LEU B O 1 +ATOM 6014 C CB . LEU B 1 120 ? 66.056 41.255 57.953 1.00 12.20 ? 140 LEU B CB 1 +ATOM 6015 C CG . LEU B 1 120 ? 67.228 41.354 58.931 1.00 12.92 ? 140 LEU B CG 1 +ATOM 6016 C CD1 . LEU B 1 120 ? 68.337 40.325 58.604 1.00 13.28 ? 140 LEU B CD1 1 +ATOM 6017 C CD2 . LEU B 1 120 ? 67.763 42.794 58.960 1.00 12.21 ? 140 LEU B CD2 1 +ATOM 6018 N N . GLU B 1 121 ? 65.601 38.434 59.718 1.00 12.62 ? 141 GLU B N 1 +ATOM 6019 C CA . GLU B 1 121 ? 65.343 37.902 61.041 1.00 12.88 ? 141 GLU B CA 1 +ATOM 6020 C C . GLU B 1 121 ? 66.651 37.682 61.791 1.00 12.58 ? 141 GLU B C 1 +ATOM 6021 O O . GLU B 1 121 ? 67.706 37.520 61.177 1.00 13.17 ? 141 GLU B O 1 +ATOM 6022 C CB . GLU B 1 121 ? 64.563 36.592 60.938 1.00 12.64 ? 141 GLU B CB 1 +ATOM 6023 C CG . GLU B 1 121 ? 63.166 36.746 60.350 1.00 13.47 ? 141 GLU B CG 1 +ATOM 6024 C CD . GLU B 1 121 ? 62.358 35.455 60.348 1.00 15.40 ? 141 GLU B CD 1 +ATOM 6025 O OE1 . GLU B 1 121 ? 62.778 34.465 60.990 1.00 19.03 ? 141 GLU B OE1 1 +ATOM 6026 O OE2 . GLU B 1 121 ? 61.276 35.449 59.710 1.00 19.81 ? 141 GLU B OE2 1 +ATOM 6027 N N . HIS B 1 122 ? 66.591 37.707 63.116 1.00 11.98 ? 142 HIS B N 1 +ATOM 6028 C CA . HIS B 1 122 ? 67.798 37.549 63.932 1.00 12.24 ? 142 HIS B CA 1 +ATOM 6029 C C . HIS B 1 122 ? 67.493 37.032 65.334 1.00 12.00 ? 142 HIS B C 1 +ATOM 6030 O O . HIS B 1 122 ? 66.537 37.478 65.977 1.00 11.45 ? 142 HIS B O 1 +ATOM 6031 C CB . HIS B 1 122 ? 68.569 38.874 64.026 1.00 12.11 ? 142 HIS B CB 1 +ATOM 6032 C CG . HIS B 1 122 ? 69.878 38.761 64.747 1.00 12.03 ? 142 HIS B CG 1 +ATOM 6033 N ND1 . HIS B 1 122 ? 70.020 39.048 66.089 1.00 11.79 ? 142 HIS B ND1 1 +ATOM 6034 C CD2 . HIS B 1 122 ? 71.106 38.389 64.309 1.00 13.03 ? 142 HIS B CD2 1 +ATOM 6035 C CE1 . HIS B 1 122 ? 71.278 38.850 66.447 1.00 11.60 ? 142 HIS B CE1 1 +ATOM 6036 N NE2 . HIS B 1 122 ? 71.958 38.454 65.386 1.00 11.89 ? 142 HIS B NE2 1 +ATOM 6037 N N . GLU B 1 123 ? 68.334 36.107 65.791 1.00 11.91 ? 143 GLU B N 1 +ATOM 6038 C CA . GLU B 1 123 ? 68.203 35.487 67.107 1.00 12.07 ? 143 GLU B CA 1 +ATOM 6039 C C . GLU B 1 123 ? 69.270 36.052 68.024 1.00 11.71 ? 143 GLU B C 1 +ATOM 6040 O O . GLU B 1 123 ? 70.451 35.886 67.752 1.00 11.84 ? 143 GLU B O 1 +ATOM 6041 C CB . GLU B 1 123 ? 68.399 33.971 66.960 1.00 12.81 ? 143 GLU B CB 1 +ATOM 6042 C CG A GLU B 1 123 ? 67.984 33.053 68.091 0.50 12.93 ? 143 GLU B CG 1 +ATOM 6043 C CG B GLU B 1 123 ? 67.846 33.179 68.161 0.50 13.36 ? 143 GLU B CG 1 +ATOM 6044 C CD A GLU B 1 123 ? 68.221 31.568 67.732 0.50 12.76 ? 143 GLU B CD 1 +ATOM 6045 C CD B GLU B 1 123 ? 68.493 33.548 69.494 0.50 14.02 ? 143 GLU B CD 1 +ATOM 6046 O OE1 A GLU B 1 123 ? 68.309 31.238 66.521 0.50 11.83 ? 143 GLU B OE1 1 +ATOM 6047 O OE1 B GLU B 1 123 ? 69.713 33.756 69.496 0.50 15.00 ? 143 GLU B OE1 1 +ATOM 6048 O OE2 A GLU B 1 123 ? 68.331 30.727 68.652 0.50 14.25 ? 143 GLU B OE2 1 +ATOM 6049 O OE2 B GLU B 1 123 ? 67.799 33.620 70.543 0.50 12.77 ? 143 GLU B OE2 1 +ATOM 6050 N N . GLY B 1 124 ? 68.864 36.710 69.104 1.00 10.81 ? 144 GLY B N 1 +ATOM 6051 C CA . GLY B 1 124 ? 69.795 37.106 70.157 1.00 10.83 ? 144 GLY B CA 1 +ATOM 6052 C C . GLY B 1 124 ? 70.047 38.602 70.169 1.00 10.01 ? 144 GLY B C 1 +ATOM 6053 O O . GLY B 1 124 ? 69.982 39.261 69.134 1.00 9.93 ? 144 GLY B O 1 +ATOM 6054 N N . GLY B 1 125 ? 70.343 39.142 71.347 1.00 9.75 ? 145 GLY B N 1 +ATOM 6055 C CA . GLY B 1 125 ? 70.509 40.584 71.500 1.00 9.52 ? 145 GLY B CA 1 +ATOM 6056 C C . GLY B 1 125 ? 71.947 41.034 71.385 1.00 9.08 ? 145 GLY B C 1 +ATOM 6057 O O . GLY B 1 125 ? 72.855 40.209 71.201 1.00 9.07 ? 145 GLY B O 1 +ATOM 6058 N N . TYR B 1 126 ? 72.128 42.351 71.446 1.00 8.72 ? 146 TYR B N 1 +ATOM 6059 C CA . TYR B 1 126 ? 73.436 42.991 71.637 1.00 8.62 ? 146 TYR B CA 1 +ATOM 6060 C C . TYR B 1 126 ? 74.352 42.883 70.415 1.00 8.60 ? 146 TYR B C 1 +ATOM 6061 O O . TYR B 1 126 ? 75.540 43.245 70.505 1.00 8.17 ? 146 TYR B O 1 +ATOM 6062 C CB . TYR B 1 126 ? 74.119 42.439 72.914 1.00 8.46 ? 146 TYR B CB 1 +ATOM 6063 C CG . TYR B 1 126 ? 73.235 42.579 74.133 1.00 8.98 ? 146 TYR B CG 1 +ATOM 6064 C CD1 . TYR B 1 126 ? 72.930 43.847 74.650 1.00 8.52 ? 146 TYR B CD1 1 +ATOM 6065 C CD2 . TYR B 1 126 ? 72.649 41.471 74.736 1.00 10.06 ? 146 TYR B CD2 1 +ATOM 6066 C CE1 . TYR B 1 126 ? 72.090 43.980 75.756 1.00 8.81 ? 146 TYR B CE1 1 +ATOM 6067 C CE2 . TYR B 1 126 ? 71.806 41.604 75.827 1.00 9.78 ? 146 TYR B CE2 1 +ATOM 6068 C CZ . TYR B 1 126 ? 71.529 42.861 76.333 1.00 8.97 ? 146 TYR B CZ 1 +ATOM 6069 O OH . TYR B 1 126 ? 70.686 42.986 77.410 1.00 7.90 ? 146 TYR B OH 1 +ATOM 6070 N N . LEU B 1 127 ? 73.813 42.419 69.281 1.00 8.10 ? 147 LEU B N 1 +ATOM 6071 C CA . LEU B 1 127 ? 74.625 42.163 68.069 1.00 8.60 ? 147 LEU B CA 1 +ATOM 6072 C C . LEU B 1 127 ? 73.890 42.606 66.795 1.00 9.15 ? 147 LEU B C 1 +ATOM 6073 O O . LEU B 1 127 ? 72.686 42.416 66.677 1.00 8.29 ? 147 LEU B O 1 +ATOM 6074 C CB . LEU B 1 127 ? 74.986 40.679 67.988 1.00 8.94 ? 147 LEU B CB 1 +ATOM 6075 C CG . LEU B 1 127 ? 75.988 40.223 69.036 1.00 8.62 ? 147 LEU B CG 1 +ATOM 6076 C CD1 . LEU B 1 127 ? 76.090 38.688 69.090 1.00 9.21 ? 147 LEU B CD1 1 +ATOM 6077 C CD2 . LEU B 1 127 ? 77.351 40.836 68.741 1.00 8.51 ? 147 LEU B CD2 1 +ATOM 6078 N N . PRO B 1 128 ? 74.619 43.196 65.833 1.00 8.95 ? 148 PRO B N 1 +ATOM 6079 C CA . PRO B 1 128 ? 73.958 43.764 64.665 1.00 9.64 ? 148 PRO B CA 1 +ATOM 6080 C C . PRO B 1 128 ? 73.537 42.729 63.610 1.00 9.32 ? 148 PRO B C 1 +ATOM 6081 O O . PRO B 1 128 ? 74.062 41.608 63.549 1.00 9.86 ? 148 PRO B O 1 +ATOM 6082 C CB . PRO B 1 128 ? 75.013 44.708 64.098 1.00 9.24 ? 148 PRO B CB 1 +ATOM 6083 C CG . PRO B 1 128 ? 76.302 44.083 64.476 1.00 10.10 ? 148 PRO B CG 1 +ATOM 6084 C CD . PRO B 1 128 ? 76.082 43.381 65.784 1.00 8.94 ? 148 PRO B CD 1 +ATOM 6085 N N . PHE B 1 129 ? 72.574 43.120 62.794 1.00 9.90 ? 149 PHE B N 1 +ATOM 6086 C CA . PHE B 1 129 ? 72.157 42.307 61.668 1.00 9.79 ? 149 PHE B CA 1 +ATOM 6087 C C . PHE B 1 129 ? 71.654 43.229 60.541 1.00 10.24 ? 149 PHE B C 1 +ATOM 6088 O O . PHE B 1 129 ? 71.247 44.359 60.810 1.00 9.99 ? 149 PHE B O 1 +ATOM 6089 C CB . PHE B 1 129 ? 71.134 41.255 62.132 1.00 11.14 ? 149 PHE B CB 1 +ATOM 6090 C CG . PHE B 1 129 ? 69.945 41.820 62.863 1.00 10.29 ? 149 PHE B CG 1 +ATOM 6091 C CD1 . PHE B 1 129 ? 70.021 42.180 64.205 1.00 11.56 ? 149 PHE B CD1 1 +ATOM 6092 C CD2 . PHE B 1 129 ? 68.727 41.960 62.214 1.00 10.72 ? 149 PHE B CD2 1 +ATOM 6093 C CE1 . PHE B 1 129 ? 68.902 42.681 64.873 1.00 11.96 ? 149 PHE B CE1 1 +ATOM 6094 C CE2 . PHE B 1 129 ? 67.615 42.460 62.871 1.00 11.31 ? 149 PHE B CE2 1 +ATOM 6095 C CZ . PHE B 1 129 ? 67.700 42.824 64.204 1.00 11.45 ? 149 PHE B CZ 1 +ATOM 6096 N N . GLU B 1 130 ? 71.733 42.766 59.291 1.00 10.76 ? 150 GLU B N 1 +ATOM 6097 C CA . GLU B 1 130 ? 71.405 43.603 58.121 1.00 11.01 ? 150 GLU B CA 1 +ATOM 6098 C C . GLU B 1 130 ? 70.873 42.807 56.936 1.00 11.46 ? 150 GLU B C 1 +ATOM 6099 O O . GLU B 1 130 ? 71.063 41.595 56.854 1.00 11.27 ? 150 GLU B O 1 +ATOM 6100 C CB . GLU B 1 130 ? 72.637 44.387 57.667 1.00 10.69 ? 150 GLU B CB 1 +ATOM 6101 C CG . GLU B 1 130 ? 73.755 43.538 57.085 1.00 11.74 ? 150 GLU B CG 1 +ATOM 6102 C CD . GLU B 1 130 ? 74.912 44.358 56.541 1.00 11.88 ? 150 GLU B CD 1 +ATOM 6103 O OE1 . GLU B 1 130 ? 75.139 45.492 57.011 1.00 10.71 ? 150 GLU B OE1 1 +ATOM 6104 O OE2 . GLU B 1 130 ? 75.592 43.852 55.628 1.00 13.93 ? 150 GLU B OE2 1 +ATOM 6105 N N . ALA B 1 131 ? 70.208 43.510 56.024 1.00 12.07 ? 151 ALA B N 1 +ATOM 6106 C CA . ALA B 1 131 ? 69.733 42.922 54.780 1.00 12.44 ? 151 ALA B CA 1 +ATOM 6107 C C . ALA B 1 131 ? 69.928 43.907 53.645 1.00 12.67 ? 151 ALA B C 1 +ATOM 6108 O O . ALA B 1 131 ? 69.770 45.109 53.839 1.00 12.04 ? 151 ALA B O 1 +ATOM 6109 C CB . ALA B 1 131 ? 68.264 42.555 54.890 1.00 12.55 ? 151 ALA B CB 1 +ATOM 6110 N N . ASP B 1 132 ? 70.283 43.361 52.482 1.00 13.22 ? 152 ASP B N 1 +ATOM 6111 C CA . ASP B 1 132 ? 70.307 44.080 51.213 1.00 13.89 ? 152 ASP B CA 1 +ATOM 6112 C C . ASP B 1 132 ? 68.865 44.191 50.731 1.00 14.40 ? 152 ASP B C 1 +ATOM 6113 O O . ASP B 1 132 ? 68.261 43.191 50.314 1.00 14.78 ? 152 ASP B O 1 +ATOM 6114 C CB . ASP B 1 132 ? 71.179 43.292 50.229 1.00 14.09 ? 152 ASP B CB 1 +ATOM 6115 C CG . ASP B 1 132 ? 71.281 43.931 48.862 1.00 14.74 ? 152 ASP B CG 1 +ATOM 6116 O OD1 . ASP B 1 132 ? 70.363 44.684 48.464 1.00 16.31 ? 152 ASP B OD1 1 +ATOM 6117 O OD2 . ASP B 1 132 ? 72.296 43.640 48.184 1.00 15.24 ? 152 ASP B OD2 1 +ATOM 6118 N N . ILE B 1 133 ? 68.309 45.401 50.823 1.00 14.62 ? 153 ILE B N 1 +ATOM 6119 C CA . ILE B 1 133 ? 66.912 45.659 50.454 1.00 15.29 ? 153 ILE B CA 1 +ATOM 6120 C C . ILE B 1 133 ? 66.786 46.346 49.084 1.00 16.15 ? 153 ILE B C 1 +ATOM 6121 O O . ILE B 1 133 ? 65.744 46.936 48.765 1.00 15.95 ? 153 ILE B O 1 +ATOM 6122 C CB . ILE B 1 133 ? 66.192 46.515 51.538 1.00 15.25 ? 153 ILE B CB 1 +ATOM 6123 C CG1 . ILE B 1 133 ? 66.815 47.923 51.652 1.00 14.78 ? 153 ILE B CG1 1 +ATOM 6124 C CG2 . ILE B 1 133 ? 66.228 45.790 52.883 1.00 15.40 ? 153 ILE B CG2 1 +ATOM 6125 C CD1 . ILE B 1 133 ? 65.991 48.907 52.449 1.00 14.49 ? 153 ILE B CD1 1 +ATOM 6126 N N . SER B 1 134 ? 67.840 46.272 48.266 1.00 16.97 ? 154 SER B N 1 +ATOM 6127 C CA . SER B 1 134 ? 67.861 46.992 46.986 1.00 18.16 ? 154 SER B CA 1 +ATOM 6128 C C . SER B 1 134 ? 66.647 46.656 46.123 1.00 19.38 ? 154 SER B C 1 +ATOM 6129 O O . SER B 1 134 ? 66.015 47.546 45.559 1.00 19.70 ? 154 SER B O 1 +ATOM 6130 C CB . SER B 1 134 ? 69.132 46.671 46.198 1.00 18.11 ? 154 SER B CB 1 +ATOM 6131 O OG . SER B 1 134 ? 70.290 46.918 46.978 1.00 16.96 ? 154 SER B OG 1 +ATOM 6132 N N . ASN B 1 135 ? 66.340 45.363 46.031 1.00 20.96 ? 155 ASN B N 1 +ATOM 6133 C CA . ASN B 1 135 ? 65.233 44.866 45.208 1.00 22.44 ? 155 ASN B CA 1 +ATOM 6134 C C . ASN B 1 135 ? 63.853 45.368 45.627 1.00 23.00 ? 155 ASN B C 1 +ATOM 6135 O O . ASN B 1 135 ? 62.946 45.450 44.802 1.00 23.63 ? 155 ASN B O 1 +ATOM 6136 C CB . ASN B 1 135 ? 65.234 43.329 45.190 1.00 22.61 ? 155 ASN B CB 1 +ATOM 6137 C CG . ASN B 1 135 ? 65.061 42.718 46.578 1.00 25.09 ? 155 ASN B CG 1 +ATOM 6138 O OD1 . ASN B 1 135 ? 65.339 43.355 47.603 1.00 27.84 ? 155 ASN B OD1 1 +ATOM 6139 N ND2 . ASN B 1 135 ? 64.616 41.463 46.614 1.00 27.24 ? 155 ASN B ND2 1 +ATOM 6140 N N . LEU B 1 136 ? 63.696 45.695 46.905 1.00 23.79 ? 156 LEU B N 1 +ATOM 6141 C CA . LEU B 1 136 ? 62.423 46.168 47.439 1.00 24.63 ? 156 LEU B CA 1 +ATOM 6142 C C . LEU B 1 136 ? 62.251 47.683 47.321 1.00 25.55 ? 156 LEU B C 1 +ATOM 6143 O O . LEU B 1 136 ? 61.123 48.171 47.276 1.00 25.57 ? 156 LEU B O 1 +ATOM 6144 C CB . LEU B 1 136 ? 62.272 45.731 48.896 1.00 24.69 ? 156 LEU B CB 1 +ATOM 6145 C CG . LEU B 1 136 ? 62.214 44.217 49.127 1.00 24.91 ? 156 LEU B CG 1 +ATOM 6146 C CD1 . LEU B 1 136 ? 62.353 43.897 50.602 1.00 25.25 ? 156 LEU B CD1 1 +ATOM 6147 C CD2 . LEU B 1 136 ? 60.919 43.613 48.591 1.00 25.31 ? 156 LEU B CD2 1 +ATOM 6148 N N . VAL B 1 137 ? 63.357 48.424 47.263 1.00 26.39 ? 157 VAL B N 1 +ATOM 6149 C CA . VAL B 1 137 ? 63.288 49.885 47.128 1.00 27.44 ? 157 VAL B CA 1 +ATOM 6150 C C . VAL B 1 137 ? 63.422 50.352 45.672 1.00 27.93 ? 157 VAL B C 1 +ATOM 6151 O O . VAL B 1 137 ? 63.030 51.465 45.339 1.00 28.22 ? 157 VAL B O 1 +ATOM 6152 C CB . VAL B 1 137 ? 64.335 50.602 48.015 1.00 27.58 ? 157 VAL B CB 1 +ATOM 6153 C CG1 . VAL B 1 137 ? 64.111 50.246 49.486 1.00 28.15 ? 157 VAL B CG1 1 +ATOM 6154 C CG2 . VAL B 1 137 ? 65.741 50.252 47.584 1.00 27.66 ? 157 VAL B CG2 1 +ATOM 6155 N N . GLN B 1 138 ? 63.967 49.498 44.813 1.00 28.90 ? 158 GLN B N 1 +ATOM 6156 C CA . GLN B 1 138 ? 64.087 49.794 43.390 1.00 29.52 ? 158 GLN B CA 1 +ATOM 6157 C C . GLN B 1 138 ? 62.999 49.027 42.635 1.00 30.79 ? 158 GLN B C 1 +ATOM 6158 O O . GLN B 1 138 ? 63.263 48.420 41.598 1.00 31.12 ? 158 GLN B O 1 +ATOM 6159 C CB . GLN B 1 138 ? 65.486 49.406 42.892 1.00 29.76 ? 158 GLN B CB 1 +ATOM 6160 C CG . GLN B 1 138 ? 66.608 50.153 43.609 1.00 28.81 ? 158 GLN B CG 1 +ATOM 6161 C CD . GLN B 1 138 ? 67.993 49.578 43.361 1.00 28.85 ? 158 GLN B CD 1 +ATOM 6162 O OE1 . GLN B 1 138 ? 68.154 48.416 42.955 1.00 25.62 ? 158 GLN B OE1 1 +ATOM 6163 N NE2 . GLN B 1 138 ? 69.013 50.396 43.625 1.00 27.60 ? 158 GLN B NE2 1 +ATOM 6164 N N . VAL B 1 139 ? 61.779 49.057 43.179 1.00 31.98 ? 159 VAL B N 1 +ATOM 6165 C CA . VAL B 1 139 ? 60.627 48.357 42.606 1.00 32.64 ? 159 VAL B CA 1 +ATOM 6166 C C . VAL B 1 139 ? 59.326 49.088 42.939 1.00 33.13 ? 159 VAL B C 1 +ATOM 6167 O O . VAL B 1 139 ? 59.238 49.790 43.952 1.00 33.09 ? 159 VAL B O 1 +ATOM 6168 C CB . VAL B 1 139 ? 60.525 46.903 43.135 1.00 32.86 ? 159 VAL B CB 1 +ATOM 6169 C CG1 . VAL B 1 139 ? 60.189 46.895 44.623 1.00 32.72 ? 159 VAL B CG1 1 +ATOM 6170 C CG2 . VAL B 1 139 ? 59.483 46.110 42.353 1.00 32.99 ? 159 VAL B CG2 1 +ATOM 6171 N N . GLY B 1 140 ? 58.328 48.925 42.070 1.00 33.83 ? 160 GLY B N 1 +ATOM 6172 C CA . GLY B 1 140 ? 56.970 49.412 42.322 1.00 34.14 ? 160 GLY B CA 1 +ATOM 6173 C C . GLY B 1 140 ? 56.070 48.271 42.760 1.00 34.50 ? 160 GLY B C 1 +ATOM 6174 O O . GLY B 1 140 ? 56.554 47.234 43.235 1.00 34.88 ? 160 GLY B O 1 +ATOM 6175 N N . SER B 1 144 ? 57.393 54.626 46.563 1.00 30.98 ? 164 SER B N 1 +ATOM 6176 C CA . SER B 1 144 ? 57.062 55.853 47.287 1.00 30.65 ? 164 SER B CA 1 +ATOM 6177 C C . SER B 1 144 ? 57.946 55.978 48.536 1.00 30.14 ? 164 SER B C 1 +ATOM 6178 O O . SER B 1 144 ? 59.156 56.190 48.413 1.00 30.51 ? 164 SER B O 1 +ATOM 6179 C CB . SER B 1 144 ? 55.564 55.880 47.623 1.00 30.97 ? 164 SER B CB 1 +ATOM 6180 O OG . SER B 1 144 ? 55.215 57.024 48.391 1.00 31.63 ? 164 SER B OG 1 +ATOM 6181 N N . ARG B 1 145 ? 57.369 55.842 49.729 1.00 29.04 ? 165 ARG B N 1 +ATOM 6182 C CA . ARG B 1 145 ? 58.170 55.807 50.944 1.00 28.05 ? 165 ARG B CA 1 +ATOM 6183 C C . ARG B 1 145 ? 58.702 54.400 51.180 1.00 26.16 ? 165 ARG B C 1 +ATOM 6184 O O . ARG B 1 145 ? 58.372 53.461 50.443 1.00 26.30 ? 165 ARG B O 1 +ATOM 6185 C CB . ARG B 1 145 ? 57.356 56.265 52.158 1.00 28.63 ? 165 ARG B CB 1 +ATOM 6186 C CG . ARG B 1 145 ? 56.993 57.745 52.135 1.00 30.13 ? 165 ARG B CG 1 +ATOM 6187 C CD . ARG B 1 145 ? 56.814 58.303 53.542 1.00 32.17 ? 165 ARG B CD 1 +ATOM 6188 N NE . ARG B 1 145 ? 56.680 59.759 53.518 1.00 33.34 ? 165 ARG B NE 1 +ATOM 6189 C CZ . ARG B 1 145 ? 55.526 60.423 53.470 1.00 34.06 ? 165 ARG B CZ 1 +ATOM 6190 N NH1 . ARG B 1 145 ? 54.357 59.784 53.468 1.00 34.69 ? 165 ARG B NH1 1 +ATOM 6191 N NH2 . ARG B 1 145 ? 55.543 61.753 53.441 1.00 34.12 ? 165 ARG B NH2 1 +ATOM 6192 N N . LEU B 1 146 ? 59.550 54.278 52.198 1.00 23.40 ? 166 LEU B N 1 +ATOM 6193 C CA . LEU B 1 146 ? 60.011 52.997 52.702 1.00 21.58 ? 166 LEU B CA 1 +ATOM 6194 C C . LEU B 1 146 ? 59.379 52.822 54.073 1.00 19.39 ? 166 LEU B C 1 +ATOM 6195 O O . LEU B 1 146 ? 59.559 53.670 54.939 1.00 19.10 ? 166 LEU B O 1 +ATOM 6196 C CB . LEU B 1 146 ? 61.537 52.997 52.814 1.00 21.36 ? 166 LEU B CB 1 +ATOM 6197 C CG . LEU B 1 146 ? 62.218 51.788 53.450 1.00 21.89 ? 166 LEU B CG 1 +ATOM 6198 C CD1 . LEU B 1 146 ? 61.995 50.523 52.620 1.00 23.46 ? 166 LEU B CD1 1 +ATOM 6199 C CD2 . LEU B 1 146 ? 63.703 52.040 53.623 1.00 21.72 ? 166 LEU B CD2 1 +ATOM 6200 N N . ARG B 1 147 ? 58.603 51.755 54.257 1.00 17.22 ? 167 ARG B N 1 +ATOM 6201 C CA . ARG B 1 147 ? 57.980 51.469 55.554 1.00 15.23 ? 167 ARG B CA 1 +ATOM 6202 C C . ARG B 1 147 ? 58.707 50.301 56.194 1.00 14.48 ? 167 ARG B C 1 +ATOM 6203 O O . ARG B 1 147 ? 58.655 49.184 55.684 1.00 14.32 ? 167 ARG B O 1 +ATOM 6204 C CB . ARG B 1 147 ? 56.493 51.141 55.402 1.00 15.05 ? 167 ARG B CB 1 +ATOM 6205 C CG . ARG B 1 147 ? 55.745 51.021 56.724 1.00 14.34 ? 167 ARG B CG 1 +ATOM 6206 C CD . ARG B 1 147 ? 54.225 50.940 56.537 1.00 14.51 ? 167 ARG B CD 1 +ATOM 6207 N NE . ARG B 1 147 ? 53.826 49.843 55.642 1.00 13.02 ? 167 ARG B NE 1 +ATOM 6208 C CZ . ARG B 1 147 ? 53.643 48.577 56.001 1.00 12.87 ? 167 ARG B CZ 1 +ATOM 6209 N NH1 . ARG B 1 147 ? 53.825 48.187 57.257 1.00 10.38 ? 167 ARG B NH1 1 +ATOM 6210 N NH2 . ARG B 1 147 ? 53.286 47.682 55.082 1.00 13.93 ? 167 ARG B NH2 1 +ATOM 6211 N N . ILE B 1 148 ? 59.398 50.580 57.294 1.00 12.94 ? 168 ILE B N 1 +ATOM 6212 C CA . ILE B 1 148 ? 60.178 49.584 58.020 1.00 12.41 ? 168 ILE B CA 1 +ATOM 6213 C C . ILE B 1 148 ? 59.417 49.201 59.281 1.00 11.68 ? 168 ILE B C 1 +ATOM 6214 O O . ILE B 1 148 ? 59.142 50.067 60.111 1.00 12.16 ? 168 ILE B O 1 +ATOM 6215 C CB . ILE B 1 148 ? 61.562 50.164 58.441 1.00 12.08 ? 168 ILE B CB 1 +ATOM 6216 C CG1 . ILE B 1 148 ? 62.415 50.505 57.221 1.00 12.70 ? 168 ILE B CG1 1 +ATOM 6217 C CG2 . ILE B 1 148 ? 62.315 49.194 59.300 1.00 11.45 ? 168 ILE B CG2 1 +ATOM 6218 C CD1 . ILE B 1 148 ? 63.669 51.305 57.576 1.00 13.29 ? 168 ILE B CD1 1 +ATOM 6219 N N . THR B 1 149 ? 59.088 47.915 59.413 1.00 11.61 ? 169 THR B N 1 +ATOM 6220 C CA . THR B 1 149 ? 58.384 47.380 60.580 1.00 10.76 ? 169 THR B CA 1 +ATOM 6221 C C . THR B 1 149 ? 59.273 46.351 61.233 1.00 10.82 ? 169 THR B C 1 +ATOM 6222 O O . THR B 1 149 ? 59.819 45.473 60.546 1.00 10.54 ? 169 THR B O 1 +ATOM 6223 C CB . THR B 1 149 ? 57.071 46.676 60.194 1.00 11.27 ? 169 THR B CB 1 +ATOM 6224 O OG1 . THR B 1 149 ? 56.366 47.471 59.224 1.00 9.25 ? 169 THR B OG1 1 +ATOM 6225 C CG2 . THR B 1 149 ? 56.211 46.450 61.426 1.00 10.33 ? 169 THR B CG2 1 +ATOM 6226 N N . ILE B 1 150 ? 59.424 46.458 62.552 1.00 10.41 ? 170 ILE B N 1 +ATOM 6227 C CA . ILE B 1 150 ? 60.269 45.538 63.323 1.00 9.80 ? 170 ILE B CA 1 +ATOM 6228 C C . ILE B 1 150 ? 59.507 45.014 64.543 1.00 9.79 ? 170 ILE B C 1 +ATOM 6229 O O . ILE B 1 150 ? 58.981 45.788 65.333 1.00 9.44 ? 170 ILE B O 1 +ATOM 6230 C CB . ILE B 1 150 ? 61.587 46.220 63.809 1.00 9.81 ? 170 ILE B CB 1 +ATOM 6231 C CG1 . ILE B 1 150 ? 62.327 46.913 62.656 1.00 10.54 ? 170 ILE B CG1 1 +ATOM 6232 C CG2 . ILE B 1 150 ? 62.481 45.199 64.483 1.00 8.66 ? 170 ILE B CG2 1 +ATOM 6233 C CD1 . ILE B 1 150 ? 63.507 47.748 63.108 1.00 10.30 ? 170 ILE B CD1 1 +ATOM 6234 N N . ALA B 1 151 ? 59.422 43.691 64.669 1.00 8.85 ? 171 ALA B N 1 +ATOM 6235 C CA . ALA B 1 151 ? 58.825 43.051 65.833 1.00 9.02 ? 171 ALA B CA 1 +ATOM 6236 C C . ALA B 1 151 ? 59.942 42.384 66.617 1.00 9.45 ? 171 ALA B C 1 +ATOM 6237 O O . ALA B 1 151 ? 60.732 41.625 66.042 1.00 9.55 ? 171 ALA B O 1 +ATOM 6238 C CB . ALA B 1 151 ? 57.783 42.022 65.409 1.00 9.27 ? 171 ALA B CB 1 +ATOM 6239 N N . ILE B 1 152 ? 60.008 42.688 67.912 1.00 9.80 ? 172 ILE B N 1 +ATOM 6240 C CA . ILE B 1 152 ? 61.070 42.238 68.793 1.00 9.64 ? 172 ILE B CA 1 +ATOM 6241 C C . ILE B 1 152 ? 60.455 41.461 69.955 1.00 9.41 ? 172 ILE B C 1 +ATOM 6242 O O . ILE B 1 152 ? 59.560 41.974 70.632 1.00 8.62 ? 172 ILE B O 1 +ATOM 6243 C CB . ILE B 1 152 ? 61.886 43.417 69.376 1.00 9.82 ? 172 ILE B CB 1 +ATOM 6244 C CG1 . ILE B 1 152 ? 62.500 44.253 68.232 1.00 10.07 ? 172 ILE B CG1 1 +ATOM 6245 C CG2 . ILE B 1 152 ? 62.973 42.898 70.322 1.00 8.54 ? 172 ILE B CG2 1 +ATOM 6246 C CD1 . ILE B 1 152 ? 63.282 45.479 68.682 1.00 11.05 ? 172 ILE B CD1 1 +ATOM 6247 N N . ASN B 1 153 ? 60.937 40.235 70.169 1.00 9.03 ? 173 ASN B N 1 +ATOM 6248 C CA . ASN B 1 153 ? 60.503 39.389 71.278 1.00 9.13 ? 173 ASN B CA 1 +ATOM 6249 C C . ASN B 1 153 ? 61.556 39.427 72.380 1.00 9.47 ? 173 ASN B C 1 +ATOM 6250 O O . ASN B 1 153 ? 62.732 39.160 72.119 1.00 10.64 ? 173 ASN B O 1 +ATOM 6251 C CB . ASN B 1 153 ? 60.330 37.949 70.773 1.00 9.23 ? 173 ASN B CB 1 +ATOM 6252 C CG . ASN B 1 153 ? 59.498 37.074 71.710 1.00 10.02 ? 173 ASN B CG 1 +ATOM 6253 O OD1 . ASN B 1 153 ? 59.901 36.801 72.844 1.00 11.10 ? 173 ASN B OD1 1 +ATOM 6254 N ND2 . ASN B 1 153 ? 58.335 36.623 71.214 1.00 11.06 ? 173 ASN B ND2 1 +ATOM 6255 N N . ASN B 1 154 ? 61.147 39.729 73.605 1.00 8.88 ? 174 ASN B N 1 +ATOM 6256 C CA . ASN B 1 154 ? 62.101 39.844 74.709 1.00 8.17 ? 174 ASN B CA 1 +ATOM 6257 C C . ASN B 1 154 ? 62.038 38.690 75.694 1.00 8.48 ? 174 ASN B C 1 +ATOM 6258 O O . ASN B 1 154 ? 62.593 38.774 76.792 1.00 9.04 ? 174 ASN B O 1 +ATOM 6259 C CB . ASN B 1 154 ? 61.890 41.161 75.456 1.00 7.92 ? 174 ASN B CB 1 +ATOM 6260 C CG . ASN B 1 154 ? 60.567 41.213 76.166 1.00 7.64 ? 174 ASN B CG 1 +ATOM 6261 O OD1 . ASN B 1 154 ? 59.692 40.385 75.920 1.00 9.72 ? 174 ASN B OD1 1 +ATOM 6262 N ND2 . ASN B 1 154 ? 60.394 42.209 77.021 1.00 9.83 ? 174 ASN B ND2 1 +ATOM 6263 N N . THR B 1 155 ? 61.369 37.608 75.314 1.00 8.74 ? 175 THR B N 1 +ATOM 6264 C CA . THR B 1 155 ? 61.236 36.468 76.215 1.00 9.06 ? 175 THR B CA 1 +ATOM 6265 C C . THR B 1 155 ? 62.565 35.741 76.299 1.00 9.87 ? 175 THR B C 1 +ATOM 6266 O O . THR B 1 155 ? 63.187 35.454 75.263 1.00 10.07 ? 175 THR B O 1 +ATOM 6267 C CB . THR B 1 155 ? 60.141 35.507 75.744 1.00 9.87 ? 175 THR B CB 1 +ATOM 6268 O OG1 . THR B 1 155 ? 58.955 36.255 75.491 1.00 7.90 ? 175 THR B OG1 1 +ATOM 6269 C CG2 . THR B 1 155 ? 59.847 34.446 76.815 1.00 9.64 ? 175 THR B CG2 1 +ATOM 6270 N N . LEU B 1 156 ? 62.992 35.442 77.525 1.00 9.97 ? 176 LEU B N 1 +ATOM 6271 C CA . LEU B 1 156 ? 64.179 34.617 77.753 1.00 10.18 ? 176 LEU B CA 1 +ATOM 6272 C C . LEU B 1 156 ? 63.723 33.210 78.115 1.00 11.00 ? 176 LEU B C 1 +ATOM 6273 O O . LEU B 1 156 ? 62.764 33.036 78.862 1.00 10.77 ? 176 LEU B O 1 +ATOM 6274 C CB . LEU B 1 156 ? 65.050 35.218 78.858 1.00 10.19 ? 176 LEU B CB 1 +ATOM 6275 C CG . LEU B 1 156 ? 65.483 36.656 78.550 1.00 9.89 ? 176 LEU B CG 1 +ATOM 6276 C CD1 . LEU B 1 156 ? 66.306 37.265 79.673 1.00 11.70 ? 176 LEU B CD1 1 +ATOM 6277 C CD2 . LEU B 1 156 ? 66.261 36.704 77.275 1.00 11.08 ? 176 LEU B CD2 1 +ATOM 6278 N N . THR B 1 157 ? 64.424 32.219 77.581 1.00 11.09 ? 177 THR B N 1 +ATOM 6279 C CA . THR B 1 157 ? 64.007 30.822 77.667 1.00 12.20 ? 177 THR B CA 1 +ATOM 6280 C C . THR B 1 157 ? 65.235 29.970 77.945 1.00 12.05 ? 177 THR B C 1 +ATOM 6281 O O . THR B 1 157 ? 66.358 30.494 77.968 1.00 11.43 ? 177 THR B O 1 +ATOM 6282 C CB . THR B 1 157 ? 63.333 30.365 76.341 1.00 12.56 ? 177 THR B CB 1 +ATOM 6283 O OG1 . THR B 1 157 ? 64.329 30.195 75.330 1.00 13.14 ? 177 THR B OG1 1 +ATOM 6284 C CG2 . THR B 1 157 ? 62.326 31.377 75.877 1.00 14.36 ? 177 THR B CG2 1 +ATOM 6285 N N . PRO B 1 158 ? 65.050 28.658 78.174 1.00 11.78 ? 178 PRO B N 1 +ATOM 6286 C CA . PRO B 1 158 ? 66.237 27.815 78.341 1.00 12.20 ? 178 PRO B CA 1 +ATOM 6287 C C . PRO B 1 158 ? 67.199 27.771 77.159 1.00 12.94 ? 178 PRO B C 1 +ATOM 6288 O O . PRO B 1 158 ? 68.302 27.230 77.305 1.00 13.98 ? 178 PRO B O 1 +ATOM 6289 C CB . PRO B 1 158 ? 65.645 26.427 78.604 1.00 12.44 ? 178 PRO B CB 1 +ATOM 6290 C CG . PRO B 1 158 ? 64.292 26.727 79.182 1.00 11.89 ? 178 PRO B CG 1 +ATOM 6291 C CD . PRO B 1 158 ? 63.811 27.898 78.402 1.00 12.40 ? 178 PRO B CD 1 +ATOM 6292 N N . THR B 1 159 ? 66.800 28.341 76.019 1.00 13.36 ? 179 THR B N 1 +ATOM 6293 C CA . THR B 1 159 ? 67.620 28.321 74.826 1.00 13.58 ? 179 THR B CA 1 +ATOM 6294 C C . THR B 1 159 ? 68.044 29.713 74.337 1.00 13.61 ? 179 THR B C 1 +ATOM 6295 O O . THR B 1 159 ? 68.711 29.807 73.307 1.00 14.43 ? 179 THR B O 1 +ATOM 6296 C CB . THR B 1 159 ? 66.913 27.539 73.692 1.00 13.46 ? 179 THR B CB 1 +ATOM 6297 O OG1 . THR B 1 159 ? 65.674 28.164 73.354 1.00 14.18 ? 179 THR B OG1 1 +ATOM 6298 C CG2 . THR B 1 159 ? 66.658 26.095 74.147 1.00 15.23 ? 179 THR B CG2 1 +ATOM 6299 N N . THR B 1 160 ? 67.697 30.767 75.084 1.00 13.25 ? 180 THR B N 1 +ATOM 6300 C CA . THR B 1 160 ? 68.211 32.119 74.808 1.00 12.57 ? 180 THR B CA 1 +ATOM 6301 C C . THR B 1 160 ? 69.526 32.350 75.567 1.00 12.48 ? 180 THR B C 1 +ATOM 6302 O O . THR B 1 160 ? 69.850 31.624 76.514 1.00 11.93 ? 180 THR B O 1 +ATOM 6303 C CB . THR B 1 160 ? 67.198 33.272 75.152 1.00 12.77 ? 180 THR B CB 1 +ATOM 6304 O OG1 . THR B 1 160 ? 66.805 33.199 76.527 1.00 10.71 ? 180 THR B OG1 1 +ATOM 6305 C CG2 . THR B 1 160 ? 65.943 33.222 74.263 1.00 12.76 ? 180 THR B CG2 1 +ATOM 6306 N N . LEU B 1 161 ? 70.288 33.350 75.120 1.00 12.11 ? 181 LEU B N 1 +ATOM 6307 C CA . LEU B 1 161 ? 71.515 33.788 75.787 1.00 12.60 ? 181 LEU B CA 1 +ATOM 6308 C C . LEU B 1 161 ? 71.423 35.307 76.001 1.00 12.52 ? 181 LEU B C 1 +ATOM 6309 O O . LEU B 1 161 ? 71.596 36.076 75.055 1.00 13.13 ? 181 LEU B O 1 +ATOM 6310 C CB . LEU B 1 161 ? 72.756 33.489 74.943 1.00 13.10 ? 181 LEU B CB 1 +ATOM 6311 C CG . LEU B 1 161 ? 73.671 32.292 75.161 1.00 13.94 ? 181 LEU B CG 1 +ATOM 6312 C CD1 . LEU B 1 161 ? 75.091 32.682 74.712 1.00 13.99 ? 181 LEU B CD1 1 +ATOM 6313 C CD2 . LEU B 1 161 ? 73.708 31.739 76.595 1.00 12.46 ? 181 LEU B CD2 1 +ATOM 6314 N N . PRO B 1 162 ? 71.158 35.753 77.234 1.00 12.22 ? 182 PRO B N 1 +ATOM 6315 C CA . PRO B 1 162 ? 71.073 34.968 78.458 1.00 11.90 ? 182 PRO B CA 1 +ATOM 6316 C C . PRO B 1 162 ? 69.792 34.139 78.502 1.00 11.65 ? 182 PRO B C 1 +ATOM 6317 O O . PRO B 1 162 ? 68.788 34.521 77.891 1.00 11.71 ? 182 PRO B O 1 +ATOM 6318 C CB . PRO B 1 162 ? 71.044 36.043 79.545 1.00 11.98 ? 182 PRO B CB 1 +ATOM 6319 C CG . PRO B 1 162 ? 70.393 37.186 78.896 1.00 12.65 ? 182 PRO B CG 1 +ATOM 6320 C CD . PRO B 1 162 ? 70.880 37.179 77.492 1.00 12.67 ? 182 PRO B CD 1 +ATOM 6321 N N . PRO B 1 163 ? 69.835 32.997 79.206 1.00 11.10 ? 183 PRO B N 1 +ATOM 6322 C CA . PRO B 1 163 ? 68.662 32.148 79.394 1.00 10.72 ? 183 PRO B CA 1 +ATOM 6323 C C . PRO B 1 163 ? 67.725 32.728 80.440 1.00 10.63 ? 183 PRO B C 1 +ATOM 6324 O O . PRO B 1 163 ? 68.113 33.599 81.214 1.00 10.11 ? 183 PRO B O 1 +ATOM 6325 C CB . PRO B 1 163 ? 69.259 30.856 79.923 1.00 10.73 ? 183 PRO B CB 1 +ATOM 6326 C CG . PRO B 1 163 ? 70.459 31.290 80.653 1.00 10.37 ? 183 PRO B CG 1 +ATOM 6327 C CD . PRO B 1 163 ? 71.021 32.432 79.876 1.00 11.34 ? 183 PRO B CD 1 +ATOM 6328 N N . GLY B 1 164 ? 66.499 32.229 80.430 1.00 10.39 ? 184 GLY B N 1 +ATOM 6329 C CA . GLY B 1 164 ? 65.536 32.448 81.506 1.00 10.44 ? 184 GLY B CA 1 +ATOM 6330 C C . GLY B 1 164 ? 64.487 31.340 81.457 1.00 10.96 ? 184 GLY B C 1 +ATOM 6331 O O . GLY B 1 164 ? 64.601 30.397 80.676 1.00 10.66 ? 184 GLY B O 1 +ATOM 6332 N N . THR B 1 165 ? 63.485 31.438 82.316 1.00 11.52 ? 185 THR B N 1 +ATOM 6333 C CA . THR B 1 165 ? 62.366 30.511 82.285 1.00 11.48 ? 185 THR B CA 1 +ATOM 6334 C C . THR B 1 165 ? 61.078 31.302 82.463 1.00 11.21 ? 185 THR B C 1 +ATOM 6335 O O . THR B 1 165 ? 61.067 32.364 83.097 1.00 10.45 ? 185 THR B O 1 +ATOM 6336 C CB . THR B 1 165 ? 62.511 29.396 83.373 1.00 11.58 ? 185 THR B CB 1 +ATOM 6337 O OG1 . THR B 1 165 ? 62.360 29.964 84.679 1.00 12.77 ? 185 THR B OG1 1 +ATOM 6338 C CG2 . THR B 1 165 ? 63.876 28.723 83.266 1.00 11.45 ? 185 THR B CG2 1 +ATOM 6339 N N . ILE B 1 166 ? 60.002 30.795 81.868 1.00 11.84 ? 186 ILE B N 1 +ATOM 6340 C CA . ILE B 1 166 ? 58.687 31.383 82.018 1.00 12.26 ? 186 ILE B CA 1 +ATOM 6341 C C . ILE B 1 166 ? 57.828 30.446 82.872 1.00 13.06 ? 186 ILE B C 1 +ATOM 6342 O O . ILE B 1 166 ? 57.829 29.222 82.676 1.00 12.24 ? 186 ILE B O 1 +ATOM 6343 C CB . ILE B 1 166 ? 58.047 31.656 80.617 1.00 12.59 ? 186 ILE B CB 1 +ATOM 6344 C CG1 . ILE B 1 166 ? 58.776 32.824 79.915 1.00 12.35 ? 186 ILE B CG1 1 +ATOM 6345 C CG2 . ILE B 1 166 ? 56.541 31.896 80.732 1.00 12.45 ? 186 ILE B CG2 1 +ATOM 6346 C CD1 . ILE B 1 166 ? 58.248 34.167 80.219 1.00 13.52 ? 186 ILE B CD1 1 +ATOM 6347 N N . GLN B 1 167 ? 57.124 31.022 83.842 1.00 13.76 ? 187 GLN B N 1 +ATOM 6348 C CA . GLN B 1 167 ? 56.294 30.239 84.747 1.00 15.25 ? 187 GLN B CA 1 +ATOM 6349 C C . GLN B 1 167 ? 54.896 30.803 84.792 1.00 15.39 ? 187 GLN B C 1 +ATOM 6350 O O . GLN B 1 167 ? 54.705 31.919 85.241 1.00 15.01 ? 187 GLN B O 1 +ATOM 6351 C CB . GLN B 1 167 ? 56.856 30.232 86.175 1.00 15.73 ? 187 GLN B CB 1 +ATOM 6352 C CG . GLN B 1 167 ? 58.357 30.424 86.303 1.00 19.32 ? 187 GLN B CG 1 +ATOM 6353 C CD . GLN B 1 167 ? 59.198 29.216 85.915 1.00 22.18 ? 187 GLN B CD 1 +ATOM 6354 O OE1 . GLN B 1 167 ? 60.416 29.217 86.122 1.00 24.88 ? 187 GLN B OE1 1 +ATOM 6355 N NE2 . GLN B 1 167 ? 58.563 28.179 85.364 1.00 25.63 ? 187 GLN B NE2 1 +ATOM 6356 N N . TYR B 1 168 ? 53.929 30.016 84.316 1.00 16.21 ? 188 TYR B N 1 +ATOM 6357 C CA . TYR B 1 168 ? 52.516 30.313 84.526 1.00 16.97 ? 188 TYR B CA 1 +ATOM 6358 C C . TYR B 1 168 ? 52.129 29.772 85.900 1.00 17.33 ? 188 TYR B C 1 +ATOM 6359 O O . TYR B 1 168 ? 52.404 28.613 86.206 1.00 17.32 ? 188 TYR B O 1 +ATOM 6360 C CB . TYR B 1 168 ? 51.660 29.671 83.425 1.00 17.62 ? 188 TYR B CB 1 +ATOM 6361 C CG . TYR B 1 168 ? 51.668 30.466 82.135 1.00 18.00 ? 188 TYR B CG 1 +ATOM 6362 C CD1 . TYR B 1 168 ? 52.617 30.215 81.146 1.00 18.95 ? 188 TYR B CD1 1 +ATOM 6363 C CD2 . TYR B 1 168 ? 50.743 31.480 81.914 1.00 18.61 ? 188 TYR B CD2 1 +ATOM 6364 C CE1 . TYR B 1 168 ? 52.636 30.956 79.963 1.00 19.30 ? 188 TYR B CE1 1 +ATOM 6365 C CE2 . TYR B 1 168 ? 50.757 32.227 80.733 1.00 18.08 ? 188 TYR B CE2 1 +ATOM 6366 C CZ . TYR B 1 168 ? 51.709 31.958 79.766 1.00 18.80 ? 188 TYR B CZ 1 +ATOM 6367 O OH . TYR B 1 168 ? 51.736 32.685 78.593 1.00 18.84 ? 188 TYR B OH 1 +ATOM 6368 N N . LEU B 1 169 ? 51.518 30.622 86.723 1.00 17.41 ? 189 LEU B N 1 +ATOM 6369 C CA . LEU B 1 169 ? 51.107 30.262 88.078 1.00 17.73 ? 189 LEU B CA 1 +ATOM 6370 C C . LEU B 1 169 ? 49.581 30.202 88.094 1.00 17.76 ? 189 LEU B C 1 +ATOM 6371 O O . LEU B 1 169 ? 48.917 31.231 87.964 1.00 17.74 ? 189 LEU B O 1 +ATOM 6372 C CB . LEU B 1 169 ? 51.623 31.310 89.075 1.00 17.90 ? 189 LEU B CB 1 +ATOM 6373 C CG . LEU B 1 169 ? 53.143 31.510 89.066 1.00 18.74 ? 189 LEU B CG 1 +ATOM 6374 C CD1 . LEU B 1 169 ? 53.572 32.590 90.054 1.00 18.96 ? 189 LEU B CD1 1 +ATOM 6375 C CD2 . LEU B 1 169 ? 53.862 30.199 89.388 1.00 19.88 ? 189 LEU B CD2 1 +ATOM 6376 N N . THR B 1 170 ? 49.035 28.997 88.238 1.00 18.07 ? 190 THR B N 1 +ATOM 6377 C CA . THR B 1 170 ? 47.613 28.759 87.993 1.00 18.52 ? 190 THR B CA 1 +ATOM 6378 C C . THR B 1 170 ? 46.724 28.773 89.245 1.00 18.77 ? 190 THR B C 1 +ATOM 6379 O O . THR B 1 170 ? 45.504 28.580 89.138 1.00 19.04 ? 190 THR B O 1 +ATOM 6380 C CB . THR B 1 170 ? 47.441 27.428 87.256 1.00 18.73 ? 190 THR B CB 1 +ATOM 6381 O OG1 . THR B 1 170 ? 48.069 26.383 88.004 1.00 19.42 ? 190 THR B OG1 1 +ATOM 6382 C CG2 . THR B 1 170 ? 48.084 27.507 85.878 1.00 19.46 ? 190 THR B CG2 1 +ATOM 6383 N N . ASP B 1 171 ? 47.323 28.999 90.415 1.00 18.89 ? 191 ASP B N 1 +ATOM 6384 C CA . ASP B 1 171 ? 46.584 29.036 91.681 1.00 19.21 ? 191 ASP B CA 1 +ATOM 6385 C C . ASP B 1 171 ? 45.822 30.347 91.770 1.00 18.96 ? 191 ASP B C 1 +ATOM 6386 O O . ASP B 1 171 ? 46.393 31.383 92.110 1.00 18.22 ? 191 ASP B O 1 +ATOM 6387 C CB . ASP B 1 171 ? 47.536 28.891 92.874 1.00 19.69 ? 191 ASP B CB 1 +ATOM 6388 C CG . ASP B 1 171 ? 46.815 28.952 94.219 1.00 20.81 ? 191 ASP B CG 1 +ATOM 6389 O OD1 . ASP B 1 171 ? 45.570 29.109 94.242 1.00 22.20 ? 191 ASP B OD1 1 +ATOM 6390 O OD2 . ASP B 1 171 ? 47.508 28.858 95.251 1.00 23.42 ? 191 ASP B OD2 1 +ATOM 6391 N N . THR B 1 172 ? 44.523 30.296 91.484 1.00 18.45 ? 192 THR B N 1 +ATOM 6392 C CA . THR B 1 172 ? 43.708 31.512 91.386 1.00 18.64 ? 192 THR B CA 1 +ATOM 6393 C C . THR B 1 172 ? 43.324 32.118 92.744 1.00 18.31 ? 192 THR B C 1 +ATOM 6394 O O . THR B 1 172 ? 42.727 33.202 92.796 1.00 18.38 ? 192 THR B O 1 +ATOM 6395 C CB . THR B 1 172 ? 42.448 31.272 90.529 1.00 19.32 ? 192 THR B CB 1 +ATOM 6396 O OG1 . THR B 1 172 ? 41.837 30.037 90.918 1.00 19.71 ? 192 THR B OG1 1 +ATOM 6397 C CG2 . THR B 1 172 ? 42.821 31.201 89.045 1.00 19.31 ? 192 THR B CG2 1 +ATOM 6398 N N . SER B 1 173 ? 43.668 31.433 93.834 1.00 18.11 ? 193 SER B N 1 +ATOM 6399 C CA . SER B 1 173 ? 43.545 32.008 95.185 1.00 17.74 ? 193 SER B CA 1 +ATOM 6400 C C . SER B 1 173 ? 44.721 32.941 95.509 1.00 17.33 ? 193 SER B C 1 +ATOM 6401 O O . SER B 1 173 ? 44.688 33.665 96.496 1.00 17.08 ? 193 SER B O 1 +ATOM 6402 C CB . SER B 1 173 ? 43.452 30.900 96.245 1.00 17.90 ? 193 SER B CB 1 +ATOM 6403 O OG . SER B 1 173 ? 44.713 30.299 96.506 1.00 17.83 ? 193 SER B OG 1 +ATOM 6404 N N . LYS B 1 174 ? 45.761 32.907 94.680 1.00 16.96 ? 194 LYS B N 1 +ATOM 6405 C CA . LYS B 1 174 ? 46.953 33.744 94.886 1.00 16.96 ? 194 LYS B CA 1 +ATOM 6406 C C . LYS B 1 174 ? 47.313 34.624 93.682 1.00 16.06 ? 194 LYS B C 1 +ATOM 6407 O O . LYS B 1 174 ? 47.962 35.651 93.842 1.00 15.28 ? 194 LYS B O 1 +ATOM 6408 C CB . LYS B 1 174 ? 48.147 32.855 95.218 1.00 17.72 ? 194 LYS B CB 1 +ATOM 6409 C CG . LYS B 1 174 ? 47.961 32.054 96.491 1.00 20.14 ? 194 LYS B CG 1 +ATOM 6410 C CD . LYS B 1 174 ? 49.276 31.522 97.014 1.00 23.33 ? 194 LYS B CD 1 +ATOM 6411 C CE . LYS B 1 174 ? 49.337 31.647 98.533 1.00 25.38 ? 194 LYS B CE 1 +ATOM 6412 N NZ . LYS B 1 174 ? 49.316 33.078 98.974 1.00 27.22 ? 194 LYS B NZ 1 +ATOM 6413 N N . TYR B 1 175 ? 46.917 34.205 92.484 1.00 15.06 ? 195 TYR B N 1 +ATOM 6414 C CA . TYR B 1 175 ? 47.265 34.905 91.263 1.00 14.88 ? 195 TYR B CA 1 +ATOM 6415 C C . TYR B 1 175 ? 46.085 34.957 90.322 1.00 15.24 ? 195 TYR B C 1 +ATOM 6416 O O . TYR B 1 175 ? 45.337 33.981 90.214 1.00 15.02 ? 195 TYR B O 1 +ATOM 6417 C CB . TYR B 1 175 ? 48.395 34.199 90.534 1.00 14.79 ? 195 TYR B CB 1 +ATOM 6418 C CG . TYR B 1 175 ? 49.633 34.006 91.365 1.00 14.35 ? 195 TYR B CG 1 +ATOM 6419 C CD1 . TYR B 1 175 ? 49.907 32.783 91.963 1.00 14.24 ? 195 TYR B CD1 1 +ATOM 6420 C CD2 . TYR B 1 175 ? 50.530 35.052 91.556 1.00 14.45 ? 195 TYR B CD2 1 +ATOM 6421 C CE1 . TYR B 1 175 ? 51.057 32.601 92.723 1.00 14.48 ? 195 TYR B CE1 1 +ATOM 6422 C CE2 . TYR B 1 175 ? 51.673 34.873 92.305 1.00 13.51 ? 195 TYR B CE2 1 +ATOM 6423 C CZ . TYR B 1 175 ? 51.922 33.653 92.900 1.00 14.13 ? 195 TYR B CZ 1 +ATOM 6424 O OH . TYR B 1 175 ? 53.052 33.450 93.663 1.00 14.51 ? 195 TYR B OH 1 +ATOM 6425 N N . PRO B 1 176 ? 45.954 36.068 89.587 1.00 15.19 ? 196 PRO B N 1 +ATOM 6426 C CA . PRO B 1 176 ? 44.839 36.166 88.660 1.00 15.44 ? 196 PRO B CA 1 +ATOM 6427 C C . PRO B 1 176 ? 45.034 35.237 87.473 1.00 15.07 ? 196 PRO B C 1 +ATOM 6428 O O . PRO B 1 176 ? 46.161 34.890 87.131 1.00 13.86 ? 196 PRO B O 1 +ATOM 6429 C CB . PRO B 1 176 ? 44.884 37.627 88.214 1.00 15.20 ? 196 PRO B CB 1 +ATOM 6430 C CG . PRO B 1 176 ? 46.312 38.038 88.374 1.00 15.88 ? 196 PRO B CG 1 +ATOM 6431 C CD . PRO B 1 176 ? 46.824 37.259 89.547 1.00 15.63 ? 196 PRO B CD 1 +ATOM 6432 N N . LYS B 1 177 ? 43.933 34.839 86.845 1.00 15.66 ? 197 LYS B N 1 +ATOM 6433 C CA . LYS B 1 177 ? 43.991 33.987 85.672 1.00 16.29 ? 197 LYS B CA 1 +ATOM 6434 C C . LYS B 1 177 ? 44.935 34.591 84.634 1.00 15.90 ? 197 LYS B C 1 +ATOM 6435 O O . LYS B 1 177 ? 44.856 35.784 84.324 1.00 16.44 ? 197 LYS B O 1 +ATOM 6436 C CB . LYS B 1 177 ? 42.586 33.816 85.068 1.00 16.35 ? 197 LYS B CB 1 +ATOM 6437 C CG . LYS B 1 177 ? 42.552 33.101 83.722 1.00 17.03 ? 197 LYS B CG 1 +ATOM 6438 C CD . LYS B 1 177 ? 41.139 33.058 83.156 1.00 18.06 ? 197 LYS B CD 1 +ATOM 6439 C CE . LYS B 1 177 ? 40.718 34.377 82.534 1.00 20.05 ? 197 LYS B CE 1 +ATOM 6440 N NZ . LYS B 1 177 ? 39.340 34.267 81.959 1.00 23.06 ? 197 LYS B NZ 1 +ATOM 6441 N N . GLY B 1 178 ? 45.818 33.754 84.106 1.00 16.11 ? 198 GLY B N 1 +ATOM 6442 C CA . GLY B 1 178 ? 46.739 34.151 83.046 1.00 15.72 ? 198 GLY B CA 1 +ATOM 6443 C C . GLY B 1 178 ? 48.071 34.681 83.547 1.00 15.63 ? 198 GLY B C 1 +ATOM 6444 O O . GLY B 1 178 ? 48.961 34.981 82.735 1.00 16.02 ? 198 GLY B O 1 +ATOM 6445 N N . TYR B 1 179 ? 48.224 34.785 84.869 1.00 14.52 ? 199 TYR B N 1 +ATOM 6446 C CA . TYR B 1 179 ? 49.464 35.275 85.473 1.00 13.91 ? 199 TYR B CA 1 +ATOM 6447 C C . TYR B 1 179 ? 50.673 34.445 85.083 1.00 13.65 ? 199 TYR B C 1 +ATOM 6448 O O . TYR B 1 179 ? 50.659 33.215 85.155 1.00 13.21 ? 199 TYR B O 1 +ATOM 6449 C CB . TYR B 1 179 ? 49.344 35.275 86.994 1.00 13.66 ? 199 TYR B CB 1 +ATOM 6450 C CG . TYR B 1 179 ? 50.488 35.942 87.752 1.00 13.30 ? 199 TYR B CG 1 +ATOM 6451 C CD1 . TYR B 1 179 ? 51.568 35.204 88.236 1.00 12.69 ? 199 TYR B CD1 1 +ATOM 6452 C CD2 . TYR B 1 179 ? 50.461 37.310 88.013 1.00 13.40 ? 199 TYR B CD2 1 +ATOM 6453 C CE1 . TYR B 1 179 ? 52.615 35.834 88.956 1.00 12.12 ? 199 TYR B CE1 1 +ATOM 6454 C CE2 . TYR B 1 179 ? 51.491 37.946 88.732 1.00 13.73 ? 199 TYR B CE2 1 +ATOM 6455 C CZ . TYR B 1 179 ? 52.563 37.200 89.192 1.00 13.75 ? 199 TYR B CZ 1 +ATOM 6456 O OH . TYR B 1 179 ? 53.570 37.832 89.905 1.00 13.35 ? 199 TYR B OH 1 +ATOM 6457 N N . PHE B 1 180 ? 51.728 35.129 84.663 1.00 13.68 ? 200 PHE B N 1 +ATOM 6458 C CA . PHE B 1 180 ? 53.009 34.470 84.464 1.00 13.40 ? 200 PHE B CA 1 +ATOM 6459 C C . PHE B 1 180 ? 54.114 35.457 84.718 1.00 12.80 ? 200 PHE B C 1 +ATOM 6460 O O . PHE B 1 180 ? 53.910 36.674 84.642 1.00 12.88 ? 200 PHE B O 1 +ATOM 6461 C CB . PHE B 1 180 ? 53.138 33.879 83.057 1.00 13.68 ? 200 PHE B CB 1 +ATOM 6462 C CG . PHE B 1 180 ? 53.347 34.901 81.964 1.00 13.69 ? 200 PHE B CG 1 +ATOM 6463 C CD1 . PHE B 1 180 ? 52.267 35.517 81.343 1.00 15.31 ? 200 PHE B CD1 1 +ATOM 6464 C CD2 . PHE B 1 180 ? 54.635 35.229 81.538 1.00 14.41 ? 200 PHE B CD2 1 +ATOM 6465 C CE1 . PHE B 1 180 ? 52.454 36.460 80.322 1.00 14.66 ? 200 PHE B CE1 1 +ATOM 6466 C CE2 . PHE B 1 180 ? 54.830 36.165 80.523 1.00 13.95 ? 200 PHE B CE2 1 +ATOM 6467 C CZ . PHE B 1 180 ? 53.731 36.784 79.918 1.00 14.27 ? 200 PHE B CZ 1 +ATOM 6468 N N . VAL B 1 181 ? 55.293 34.919 84.997 1.00 12.81 ? 201 VAL B N 1 +ATOM 6469 C CA . VAL B 1 181 ? 56.464 35.754 85.198 1.00 12.60 ? 201 VAL B CA 1 +ATOM 6470 C C . VAL B 1 181 ? 57.666 35.188 84.473 1.00 11.86 ? 201 VAL B C 1 +ATOM 6471 O O . VAL B 1 181 ? 57.754 33.975 84.199 1.00 10.13 ? 201 VAL B O 1 +ATOM 6472 C CB . VAL B 1 181 ? 56.802 35.908 86.683 1.00 12.80 ? 201 VAL B CB 1 +ATOM 6473 C CG1 . VAL B 1 181 ? 55.720 36.720 87.381 1.00 14.06 ? 201 VAL B CG1 1 +ATOM 6474 C CG2 . VAL B 1 181 ? 56.970 34.533 87.333 1.00 13.19 ? 201 VAL B CG2 1 +ATOM 6475 N N . GLN B 1 182 ? 58.583 36.101 84.186 1.00 10.68 ? 202 GLN B N 1 +ATOM 6476 C CA . GLN B 1 182 ? 59.891 35.810 83.635 1.00 11.06 ? 202 GLN B CA 1 +ATOM 6477 C C . GLN B 1 182 ? 60.846 35.687 84.806 1.00 11.13 ? 202 GLN B C 1 +ATOM 6478 O O . GLN B 1 182 ? 60.983 36.633 85.576 1.00 11.03 ? 202 GLN B O 1 +ATOM 6479 C CB . GLN B 1 182 ? 60.345 36.976 82.754 1.00 10.81 ? 202 GLN B CB 1 +ATOM 6480 C CG . GLN B 1 182 ? 61.759 36.879 82.216 1.00 11.24 ? 202 GLN B CG 1 +ATOM 6481 C CD . GLN B 1 182 ? 61.850 35.913 81.051 1.00 11.57 ? 202 GLN B CD 1 +ATOM 6482 O OE1 . GLN B 1 182 ? 61.599 36.295 79.910 1.00 12.63 ? 202 GLN B OE1 1 +ATOM 6483 N NE2 . GLN B 1 182 ? 62.213 34.668 81.329 1.00 12.41 ? 202 GLN B NE2 1 +ATOM 6484 N N . ASN B 1 183 ? 61.474 34.526 84.958 1.00 11.09 ? 203 ASN B N 1 +ATOM 6485 C CA . ASN B 1 183 ? 62.530 34.357 85.937 1.00 11.70 ? 203 ASN B CA 1 +ATOM 6486 C C . ASN B 1 183 ? 63.869 34.446 85.240 1.00 11.04 ? 203 ASN B C 1 +ATOM 6487 O O . ASN B 1 183 ? 64.032 33.953 84.132 1.00 10.20 ? 203 ASN B O 1 +ATOM 6488 C CB . ASN B 1 183 ? 62.432 33.010 86.623 1.00 12.09 ? 203 ASN B CB 1 +ATOM 6489 C CG . ASN B 1 183 ? 61.184 32.870 87.474 1.00 13.92 ? 203 ASN B CG 1 +ATOM 6490 O OD1 . ASN B 1 183 ? 60.598 31.796 87.537 1.00 18.88 ? 203 ASN B OD1 1 +ATOM 6491 N ND2 . ASN B 1 183 ? 60.780 33.951 88.139 1.00 15.47 ? 203 ASN B ND2 1 +ATOM 6492 N N . THR B 1 184 ? 64.830 35.068 85.902 1.00 10.34 ? 204 THR B N 1 +ATOM 6493 C CA . THR B 1 184 ? 66.184 35.206 85.360 1.00 10.28 ? 204 THR B CA 1 +ATOM 6494 C C . THR B 1 184 ? 67.179 34.938 86.468 1.00 10.11 ? 204 THR B C 1 +ATOM 6495 O O . THR B 1 184 ? 66.821 34.985 87.647 1.00 9.28 ? 204 THR B O 1 +ATOM 6496 C CB . THR B 1 184 ? 66.429 36.624 84.801 1.00 10.81 ? 204 THR B CB 1 +ATOM 6497 O OG1 . THR B 1 184 ? 66.215 37.575 85.841 1.00 10.70 ? 204 THR B OG1 1 +ATOM 6498 C CG2 . THR B 1 184 ? 65.463 36.901 83.669 1.00 12.18 ? 204 THR B CG2 1 +ATOM 6499 N N . TYR B 1 185 ? 68.414 34.612 86.085 1.00 10.25 ? 205 TYR B N 1 +ATOM 6500 C CA . TYR B 1 185 ? 69.477 34.308 87.043 1.00 10.55 ? 205 TYR B CA 1 +ATOM 6501 C C . TYR B 1 185 ? 70.700 35.177 86.816 1.00 10.05 ? 205 TYR B C 1 +ATOM 6502 O O . TYR B 1 185 ? 71.823 34.795 87.154 1.00 11.22 ? 205 TYR B O 1 +ATOM 6503 C CB . TYR B 1 185 ? 69.824 32.825 86.974 1.00 11.18 ? 205 TYR B CB 1 +ATOM 6504 C CG . TYR B 1 185 ? 68.597 32.021 87.254 1.00 11.90 ? 205 TYR B CG 1 +ATOM 6505 C CD1 . TYR B 1 185 ? 68.269 31.663 88.555 1.00 14.02 ? 205 TYR B CD1 1 +ATOM 6506 C CD2 . TYR B 1 185 ? 67.725 31.681 86.229 1.00 11.57 ? 205 TYR B CD2 1 +ATOM 6507 C CE1 . TYR B 1 185 ? 67.120 30.949 88.822 1.00 15.63 ? 205 TYR B CE1 1 +ATOM 6508 C CE2 . TYR B 1 185 ? 66.569 30.970 86.489 1.00 13.57 ? 205 TYR B CE2 1 +ATOM 6509 C CZ . TYR B 1 185 ? 66.274 30.610 87.787 1.00 14.03 ? 205 TYR B CZ 1 +ATOM 6510 O OH . TYR B 1 185 ? 65.116 29.905 88.043 1.00 15.56 ? 205 TYR B OH 1 +ATOM 6511 N N . PHE B 1 186 ? 70.461 36.367 86.280 1.00 9.47 ? 206 PHE B N 1 +ATOM 6512 C CA . PHE B 1 186 ? 71.506 37.366 86.088 1.00 7.99 ? 206 PHE B CA 1 +ATOM 6513 C C . PHE B 1 186 ? 71.089 38.684 86.722 1.00 7.75 ? 206 PHE B C 1 +ATOM 6514 O O . PHE B 1 186 ? 69.900 38.979 86.844 1.00 7.12 ? 206 PHE B O 1 +ATOM 6515 C CB . PHE B 1 186 ? 71.850 37.546 84.605 1.00 7.72 ? 206 PHE B CB 1 +ATOM 6516 C CG . PHE B 1 186 ? 70.673 37.866 83.726 1.00 8.38 ? 206 PHE B CG 1 +ATOM 6517 C CD1 . PHE B 1 186 ? 70.282 39.182 83.521 1.00 7.45 ? 206 PHE B CD1 1 +ATOM 6518 C CD2 . PHE B 1 186 ? 69.988 36.857 83.058 1.00 7.38 ? 206 PHE B CD2 1 +ATOM 6519 C CE1 . PHE B 1 186 ? 69.212 39.485 82.705 1.00 7.35 ? 206 PHE B CE1 1 +ATOM 6520 C CE2 . PHE B 1 186 ? 68.902 37.162 82.241 1.00 8.23 ? 206 PHE B CE2 1 +ATOM 6521 C CZ . PHE B 1 186 ? 68.528 38.472 82.054 1.00 8.09 ? 206 PHE B CZ 1 +ATOM 6522 N N . ASP B 1 187 ? 72.088 39.441 87.148 1.00 6.51 ? 207 ASP B N 1 +ATOM 6523 C CA . ASP B 1 187 ? 71.884 40.621 87.987 1.00 6.96 ? 207 ASP B CA 1 +ATOM 6524 C C . ASP B 1 187 ? 71.883 41.927 87.176 1.00 7.14 ? 207 ASP B C 1 +ATOM 6525 O O . ASP B 1 187 ? 72.618 42.868 87.480 1.00 7.96 ? 207 ASP B O 1 +ATOM 6526 C CB . ASP B 1 187 ? 72.949 40.639 89.094 1.00 6.58 ? 207 ASP B CB 1 +ATOM 6527 C CG . ASP B 1 187 ? 72.698 41.700 90.149 1.00 8.15 ? 207 ASP B CG 1 +ATOM 6528 O OD1 . ASP B 1 187 ? 71.519 41.954 90.488 1.00 6.29 ? 207 ASP B OD1 1 +ATOM 6529 O OD2 . ASP B 1 187 ? 73.700 42.266 90.645 1.00 9.32 ? 207 ASP B OD2 1 +ATOM 6530 N N . PHE B 1 188 ? 71.038 41.984 86.149 1.00 7.09 ? 208 PHE B N 1 +ATOM 6531 C CA . PHE B 1 188 ? 70.699 43.254 85.496 1.00 6.86 ? 208 PHE B CA 1 +ATOM 6532 C C . PHE B 1 188 ? 69.314 43.186 84.848 1.00 7.17 ? 208 PHE B C 1 +ATOM 6533 O O . PHE B 1 188 ? 68.864 42.108 84.451 1.00 7.59 ? 208 PHE B O 1 +ATOM 6534 C CB . PHE B 1 188 ? 71.759 43.680 84.483 1.00 7.09 ? 208 PHE B CB 1 +ATOM 6535 C CG . PHE B 1 188 ? 72.049 42.649 83.417 1.00 7.10 ? 208 PHE B CG 1 +ATOM 6536 C CD1 . PHE B 1 188 ? 71.377 42.672 82.190 1.00 7.03 ? 208 PHE B CD1 1 +ATOM 6537 C CD2 . PHE B 1 188 ? 73.000 41.669 83.632 1.00 8.52 ? 208 PHE B CD2 1 +ATOM 6538 C CE1 . PHE B 1 188 ? 71.642 41.733 81.218 1.00 7.00 ? 208 PHE B CE1 1 +ATOM 6539 C CE2 . PHE B 1 188 ? 73.270 40.714 82.658 1.00 7.12 ? 208 PHE B CE2 1 +ATOM 6540 C CZ . PHE B 1 188 ? 72.605 40.756 81.449 1.00 7.81 ? 208 PHE B CZ 1 +ATOM 6541 N N . PHE B 1 189 ? 68.668 44.346 84.726 1.00 7.14 ? 209 PHE B N 1 +ATOM 6542 C CA . PHE B 1 189 ? 67.284 44.405 84.256 1.00 7.29 ? 209 PHE B CA 1 +ATOM 6543 C C . PHE B 1 189 ? 67.223 44.096 82.765 1.00 7.22 ? 209 PHE B C 1 +ATOM 6544 O O . PHE B 1 189 ? 68.002 44.624 81.974 1.00 6.53 ? 209 PHE B O 1 +ATOM 6545 C CB . PHE B 1 189 ? 66.636 45.754 84.598 1.00 7.68 ? 209 PHE B CB 1 +ATOM 6546 C CG . PHE B 1 189 ? 65.165 45.796 84.304 1.00 8.18 ? 209 PHE B CG 1 +ATOM 6547 C CD1 . PHE B 1 189 ? 64.281 45.041 85.048 1.00 11.10 ? 209 PHE B CD1 1 +ATOM 6548 C CD2 . PHE B 1 189 ? 64.677 46.548 83.252 1.00 9.11 ? 209 PHE B CD2 1 +ATOM 6549 C CE1 . PHE B 1 189 ? 62.911 45.069 84.760 1.00 9.92 ? 209 PHE B CE1 1 +ATOM 6550 C CE2 . PHE B 1 189 ? 63.327 46.568 82.952 1.00 9.44 ? 209 PHE B CE2 1 +ATOM 6551 C CZ . PHE B 1 189 ? 62.448 45.838 83.702 1.00 10.04 ? 209 PHE B CZ 1 +ATOM 6552 N N . ASN B 1 190 ? 66.289 43.230 82.379 1.00 6.82 ? 210 ASN B N 1 +ATOM 6553 C CA . ASN B 1 190 ? 66.179 42.802 80.987 1.00 7.17 ? 210 ASN B CA 1 +ATOM 6554 C C . ASN B 1 190 ? 65.441 43.825 80.134 1.00 7.67 ? 210 ASN B C 1 +ATOM 6555 O O . ASN B 1 190 ? 64.356 43.540 79.570 1.00 7.51 ? 210 ASN B O 1 +ATOM 6556 C CB . ASN B 1 190 ? 65.495 41.435 80.897 1.00 7.32 ? 210 ASN B CB 1 +ATOM 6557 C CG . ASN B 1 190 ? 65.381 40.939 79.486 1.00 7.49 ? 210 ASN B CG 1 +ATOM 6558 O OD1 . ASN B 1 190 ? 66.347 40.947 78.727 1.00 9.70 ? 210 ASN B OD1 1 +ATOM 6559 N ND2 . ASN B 1 190 ? 64.192 40.465 79.127 1.00 9.94 ? 210 ASN B ND2 1 +ATOM 6560 N N . TYR B 1 191 ? 66.018 45.025 80.060 1.00 7.83 ? 211 TYR B N 1 +ATOM 6561 C CA . TYR B 1 191 ? 65.536 46.094 79.188 1.00 8.08 ? 211 TYR B CA 1 +ATOM 6562 C C . TYR B 1 191 ? 65.408 45.601 77.744 1.00 8.44 ? 211 TYR B C 1 +ATOM 6563 O O . TYR B 1 191 ? 66.160 44.730 77.320 1.00 8.77 ? 211 TYR B O 1 +ATOM 6564 C CB . TYR B 1 191 ? 66.535 47.267 79.201 1.00 7.76 ? 211 TYR B CB 1 +ATOM 6565 C CG . TYR B 1 191 ? 66.460 48.226 80.391 1.00 7.93 ? 211 TYR B CG 1 +ATOM 6566 C CD1 . TYR B 1 191 ? 65.351 49.060 80.563 1.00 7.98 ? 211 TYR B CD1 1 +ATOM 6567 C CD2 . TYR B 1 191 ? 67.506 48.329 81.321 1.00 7.58 ? 211 TYR B CD2 1 +ATOM 6568 C CE1 . TYR B 1 191 ? 65.272 49.970 81.634 1.00 8.39 ? 211 TYR B CE1 1 +ATOM 6569 C CE2 . TYR B 1 191 ? 67.427 49.216 82.401 1.00 7.63 ? 211 TYR B CE2 1 +ATOM 6570 C CZ . TYR B 1 191 ? 66.309 50.032 82.548 1.00 8.31 ? 211 TYR B CZ 1 +ATOM 6571 O OH . TYR B 1 191 ? 66.213 50.909 83.587 1.00 7.97 ? 211 TYR B OH 1 +ATOM 6572 N N . ALA B 1 192 ? 64.480 46.180 76.983 1.00 8.52 ? 212 ALA B N 1 +ATOM 6573 C CA . ALA B 1 192 ? 64.348 45.861 75.560 1.00 8.70 ? 212 ALA B CA 1 +ATOM 6574 C C . ALA B 1 192 ? 63.950 47.052 74.715 1.00 8.47 ? 212 ALA B C 1 +ATOM 6575 O O . ALA B 1 192 ? 63.603 48.127 75.236 1.00 7.78 ? 212 ALA B O 1 +ATOM 6576 C CB . ALA B 1 192 ? 63.356 44.707 75.352 1.00 8.82 ? 212 ALA B CB 1 +ATOM 6577 N N . GLY B 1 193 ? 64.006 46.844 73.398 1.00 8.18 ? 213 GLY B N 1 +ATOM 6578 C CA . GLY B 1 193 ? 63.741 47.895 72.419 1.00 9.15 ? 213 GLY B CA 1 +ATOM 6579 C C . GLY B 1 193 ? 64.798 47.930 71.331 1.00 9.02 ? 213 GLY B C 1 +ATOM 6580 O O . GLY B 1 193 ? 65.609 47.003 71.193 1.00 10.13 ? 213 GLY B O 1 +ATOM 6581 N N . LEU B 1 194 ? 64.750 48.985 70.528 1.00 9.14 ? 214 LEU B N 1 +ATOM 6582 C CA . LEU B 1 194 ? 65.813 49.281 69.575 1.00 9.25 ? 214 LEU B CA 1 +ATOM 6583 C C . LEU B 1 194 ? 66.788 50.181 70.320 1.00 8.67 ? 214 LEU B C 1 +ATOM 6584 O O . LEU B 1 194 ? 66.692 51.415 70.290 1.00 7.77 ? 214 LEU B O 1 +ATOM 6585 C CB . LEU B 1 194 ? 65.271 49.930 68.307 1.00 9.35 ? 214 LEU B CB 1 +ATOM 6586 C CG . LEU B 1 194 ? 64.405 49.034 67.406 1.00 9.23 ? 214 LEU B CG 1 +ATOM 6587 C CD1 . LEU B 1 194 ? 63.764 49.842 66.282 1.00 8.59 ? 214 LEU B CD1 1 +ATOM 6588 C CD2 . LEU B 1 194 ? 65.186 47.881 66.818 1.00 9.14 ? 214 LEU B CD2 1 +ATOM 6589 N N . GLN B 1 195 ? 67.714 49.532 71.027 1.00 8.36 ? 215 GLN B N 1 +ATOM 6590 C CA . GLN B 1 195 ? 68.625 50.224 71.946 1.00 8.04 ? 215 GLN B CA 1 +ATOM 6591 C C . GLN B 1 195 ? 69.874 50.799 71.256 1.00 8.10 ? 215 GLN B C 1 +ATOM 6592 O O . GLN B 1 195 ? 70.623 51.567 71.863 1.00 7.58 ? 215 GLN B O 1 +ATOM 6593 C CB . GLN B 1 195 ? 69.003 49.263 73.082 1.00 7.46 ? 215 GLN B CB 1 +ATOM 6594 C CG . GLN B 1 195 ? 67.755 48.810 73.867 1.00 7.64 ? 215 GLN B CG 1 +ATOM 6595 C CD . GLN B 1 195 ? 67.972 47.590 74.731 1.00 5.13 ? 215 GLN B CD 1 +ATOM 6596 O OE1 . GLN B 1 195 ? 68.561 46.584 74.316 1.00 9.66 ? 215 GLN B OE1 1 +ATOM 6597 N NE2 . GLN B 1 195 ? 67.463 47.650 75.937 1.00 4.45 ? 215 GLN B NE2 1 +ATOM 6598 N N . ARG B 1 196 ? 70.090 50.406 70.001 1.00 8.48 ? 216 ARG B N 1 +ATOM 6599 C CA . ARG B 1 196 ? 71.187 50.905 69.191 1.00 8.96 ? 216 ARG B CA 1 +ATOM 6600 C C . ARG B 1 196 ? 70.672 51.446 67.876 1.00 10.05 ? 216 ARG B C 1 +ATOM 6601 O O . ARG B 1 196 ? 69.547 51.159 67.463 1.00 9.62 ? 216 ARG B O 1 +ATOM 6602 C CB . ARG B 1 196 ? 72.226 49.820 68.977 1.00 9.30 ? 216 ARG B CB 1 +ATOM 6603 C CG . ARG B 1 196 ? 72.820 49.381 70.282 1.00 8.67 ? 216 ARG B CG 1 +ATOM 6604 C CD . ARG B 1 196 ? 73.979 48.424 70.125 1.00 9.84 ? 216 ARG B CD 1 +ATOM 6605 N NE . ARG B 1 196 ? 74.351 47.977 71.452 1.00 10.64 ? 216 ARG B NE 1 +ATOM 6606 C CZ . ARG B 1 196 ? 74.981 46.843 71.727 1.00 9.53 ? 216 ARG B CZ 1 +ATOM 6607 N NH1 . ARG B 1 196 ? 75.370 46.043 70.757 1.00 7.98 ? 216 ARG B NH1 1 +ATOM 6608 N NH2 . ARG B 1 196 ? 75.214 46.520 72.987 1.00 10.04 ? 216 ARG B NH2 1 +ATOM 6609 N N . SER B 1 197 ? 71.504 52.231 67.210 1.00 11.01 ? 217 SER B N 1 +ATOM 6610 C CA . SER B 1 197 ? 71.061 52.897 66.008 1.00 12.89 ? 217 SER B CA 1 +ATOM 6611 C C . SER B 1 197 ? 70.672 51.924 64.892 1.00 13.10 ? 217 SER B C 1 +ATOM 6612 O O . SER B 1 197 ? 71.287 50.853 64.722 1.00 13.47 ? 217 SER B O 1 +ATOM 6613 C CB . SER B 1 197 ? 72.118 53.884 65.539 1.00 13.24 ? 217 SER B CB 1 +ATOM 6614 O OG . SER B 1 197 ? 71.977 55.089 66.279 1.00 14.45 ? 217 SER B OG 1 +ATOM 6615 N N . VAL B 1 198 ? 69.612 52.297 64.179 1.00 13.41 ? 218 VAL B N 1 +ATOM 6616 C CA . VAL B 1 198 ? 69.179 51.639 62.951 1.00 13.49 ? 218 VAL B CA 1 +ATOM 6617 C C . VAL B 1 198 ? 69.557 52.604 61.835 1.00 13.87 ? 218 VAL B C 1 +ATOM 6618 O O . VAL B 1 198 ? 69.382 53.817 61.981 1.00 15.01 ? 218 VAL B O 1 +ATOM 6619 C CB . VAL B 1 198 ? 67.643 51.448 62.928 1.00 13.58 ? 218 VAL B CB 1 +ATOM 6620 C CG1 . VAL B 1 198 ? 67.203 50.721 61.656 1.00 12.82 ? 218 VAL B CG1 1 +ATOM 6621 C CG2 . VAL B 1 198 ? 67.182 50.720 64.181 1.00 13.42 ? 218 VAL B CG2 1 +ATOM 6622 N N . LEU B 1 199 ? 70.115 52.083 60.752 1.00 13.91 ? 219 LEU B N 1 +ATOM 6623 C CA . LEU B 1 199 ? 70.435 52.935 59.620 1.00 13.90 ? 219 LEU B CA 1 +ATOM 6624 C C . LEU B 1 199 ? 70.333 52.244 58.279 1.00 13.30 ? 219 LEU B C 1 +ATOM 6625 O O . LEU B 1 199 ? 70.338 51.018 58.183 1.00 12.62 ? 219 LEU B O 1 +ATOM 6626 C CB . LEU B 1 199 ? 71.823 53.548 59.782 1.00 14.06 ? 219 LEU B CB 1 +ATOM 6627 C CG . LEU B 1 199 ? 73.067 52.666 59.871 1.00 14.86 ? 219 LEU B CG 1 +ATOM 6628 C CD1 . LEU B 1 199 ? 74.281 53.459 59.403 1.00 16.18 ? 219 LEU B CD1 1 +ATOM 6629 C CD2 . LEU B 1 199 ? 73.291 52.155 61.266 1.00 17.01 ? 219 LEU B CD2 1 +ATOM 6630 N N . LEU B 1 200 ? 70.235 53.066 57.242 1.00 12.81 ? 220 LEU B N 1 +ATOM 6631 C CA . LEU B 1 200 ? 70.323 52.596 55.884 1.00 12.05 ? 220 LEU B CA 1 +ATOM 6632 C C . LEU B 1 200 ? 71.677 53.078 55.394 1.00 11.83 ? 220 LEU B C 1 +ATOM 6633 O O . LEU B 1 200 ? 72.121 54.184 55.753 1.00 11.50 ? 220 LEU B O 1 +ATOM 6634 C CB . LEU B 1 200 ? 69.201 53.187 55.038 1.00 12.25 ? 220 LEU B CB 1 +ATOM 6635 C CG . LEU B 1 200 ? 67.792 52.717 55.406 1.00 12.60 ? 220 LEU B CG 1 +ATOM 6636 C CD1 . LEU B 1 200 ? 66.757 53.683 54.880 1.00 13.81 ? 220 LEU B CD1 1 +ATOM 6637 C CD2 . LEU B 1 200 ? 67.481 51.303 54.900 1.00 13.33 ? 220 LEU B CD2 1 +ATOM 6638 N N . TYR B 1 201 ? 72.351 52.226 54.632 1.00 11.61 ? 221 TYR B N 1 +ATOM 6639 C CA . TYR B 1 201 ? 73.585 52.620 53.979 1.00 11.46 ? 221 TYR B CA 1 +ATOM 6640 C C . TYR B 1 201 ? 73.675 52.020 52.572 1.00 11.46 ? 221 TYR B C 1 +ATOM 6641 O O . TYR B 1 201 ? 72.930 51.085 52.227 1.00 11.13 ? 221 TYR B O 1 +ATOM 6642 C CB . TYR B 1 201 ? 74.785 52.286 54.871 1.00 11.78 ? 221 TYR B CB 1 +ATOM 6643 C CG . TYR B 1 201 ? 75.222 50.836 54.971 1.00 12.20 ? 221 TYR B CG 1 +ATOM 6644 C CD1 . TYR B 1 201 ? 76.134 50.297 54.075 1.00 12.74 ? 221 TYR B CD1 1 +ATOM 6645 C CD2 . TYR B 1 201 ? 74.780 50.025 56.011 1.00 12.23 ? 221 TYR B CD2 1 +ATOM 6646 C CE1 . TYR B 1 201 ? 76.556 48.980 54.189 1.00 11.56 ? 221 TYR B CE1 1 +ATOM 6647 C CE2 . TYR B 1 201 ? 75.207 48.707 56.134 1.00 11.13 ? 221 TYR B CE2 1 +ATOM 6648 C CZ . TYR B 1 201 ? 76.092 48.194 55.220 1.00 12.83 ? 221 TYR B CZ 1 +ATOM 6649 O OH . TYR B 1 201 ? 76.526 46.890 55.338 1.00 12.63 ? 221 TYR B OH 1 +ATOM 6650 N N . THR B 1 202 ? 74.563 52.580 51.755 1.00 11.54 ? 222 THR B N 1 +ATOM 6651 C CA . THR B 1 202 ? 74.738 52.120 50.383 1.00 11.58 ? 222 THR B CA 1 +ATOM 6652 C C . THR B 1 202 ? 76.168 51.699 50.087 1.00 11.46 ? 222 THR B C 1 +ATOM 6653 O O . THR B 1 202 ? 77.115 52.148 50.742 1.00 10.92 ? 222 THR B O 1 +ATOM 6654 C CB . THR B 1 202 ? 74.349 53.205 49.358 1.00 11.96 ? 222 THR B CB 1 +ATOM 6655 O OG1 . THR B 1 202 ? 75.250 54.314 49.462 1.00 12.77 ? 222 THR B OG1 1 +ATOM 6656 C CG2 . THR B 1 202 ? 72.909 53.678 49.574 1.00 11.78 ? 222 THR B CG2 1 +ATOM 6657 N N . THR B 1 203 ? 76.297 50.810 49.107 1.00 11.54 ? 223 THR B N 1 +ATOM 6658 C CA . THR B 1 203 ? 77.578 50.455 48.525 1.00 11.69 ? 223 THR B CA 1 +ATOM 6659 C C . THR B 1 203 ? 77.349 50.231 47.046 1.00 12.04 ? 223 THR B C 1 +ATOM 6660 O O . THR B 1 203 ? 76.211 50.233 46.596 1.00 11.51 ? 223 THR B O 1 +ATOM 6661 C CB . THR B 1 203 ? 78.137 49.157 49.131 1.00 12.25 ? 223 THR B CB 1 +ATOM 6662 O OG1 . THR B 1 203 ? 77.359 48.038 48.681 1.00 11.57 ? 223 THR B OG1 1 +ATOM 6663 C CG2 . THR B 1 203 ? 78.105 49.218 50.651 1.00 11.52 ? 223 THR B CG2 1 +ATOM 6664 N N . PRO B 1 204 ? 78.432 50.047 46.266 1.00 12.28 ? 224 PRO B N 1 +ATOM 6665 C CA . PRO B 1 204 ? 78.222 49.537 44.921 1.00 12.43 ? 224 PRO B CA 1 +ATOM 6666 C C . PRO B 1 204 ? 77.762 48.080 44.989 1.00 13.10 ? 224 PRO B C 1 +ATOM 6667 O O . PRO B 1 204 ? 77.792 47.472 46.065 1.00 12.63 ? 224 PRO B O 1 +ATOM 6668 C CB . PRO B 1 204 ? 79.613 49.653 44.272 1.00 11.99 ? 224 PRO B CB 1 +ATOM 6669 C CG . PRO B 1 204 ? 80.378 50.562 45.147 1.00 12.33 ? 224 PRO B CG 1 +ATOM 6670 C CD . PRO B 1 204 ? 79.844 50.360 46.516 1.00 12.65 ? 224 PRO B CD 1 +ATOM 6671 N N . THR B 1 205 ? 77.328 47.533 43.857 1.00 13.70 ? 225 THR B N 1 +ATOM 6672 C CA . THR B 1 205 ? 76.844 46.161 43.817 1.00 14.28 ? 225 THR B CA 1 +ATOM 6673 C C . THR B 1 205 ? 77.956 45.127 43.981 1.00 14.56 ? 225 THR B C 1 +ATOM 6674 O O . THR B 1 205 ? 77.695 44.000 44.407 1.00 15.46 ? 225 THR B O 1 +ATOM 6675 C CB . THR B 1 205 ? 76.039 45.887 42.531 1.00 14.36 ? 225 THR B CB 1 +ATOM 6676 O OG1 . THR B 1 205 ? 76.797 46.291 41.380 1.00 14.54 ? 225 THR B OG1 1 +ATOM 6677 C CG2 . THR B 1 205 ? 74.744 46.660 42.580 1.00 15.17 ? 225 THR B CG2 1 +ATOM 6678 N N . THR B 1 206 ? 79.181 45.500 43.619 1.00 14.30 ? 226 THR B N 1 +ATOM 6679 C CA . THR B 1 206 ? 80.368 44.734 43.975 1.00 14.33 ? 226 THR B CA 1 +ATOM 6680 C C . THR B 1 206 ? 81.105 45.569 45.015 1.00 14.17 ? 226 THR B C 1 +ATOM 6681 O O . THR B 1 206 ? 81.370 46.751 44.788 1.00 13.75 ? 226 THR B O 1 +ATOM 6682 C CB . THR B 1 206 ? 81.260 44.456 42.769 1.00 14.03 ? 226 THR B CB 1 +ATOM 6683 O OG1 . THR B 1 206 ? 80.539 43.649 41.832 1.00 15.15 ? 226 THR B OG1 1 +ATOM 6684 C CG2 . THR B 1 206 ? 82.528 43.715 43.194 1.00 14.36 ? 226 THR B CG2 1 +ATOM 6685 N N . TYR B 1 207 ? 81.417 44.954 46.154 1.00 14.15 ? 227 TYR B N 1 +ATOM 6686 C CA . TYR B 1 207 ? 81.796 45.713 47.351 1.00 14.28 ? 227 TYR B CA 1 +ATOM 6687 C C . TYR B 1 207 ? 82.679 44.916 48.304 1.00 13.86 ? 227 TYR B C 1 +ATOM 6688 O O . TYR B 1 207 ? 82.747 43.682 48.247 1.00 13.31 ? 227 TYR B O 1 +ATOM 6689 C CB . TYR B 1 207 ? 80.535 46.173 48.098 1.00 15.17 ? 227 TYR B CB 1 +ATOM 6690 C CG . TYR B 1 207 ? 79.664 45.025 48.553 1.00 16.21 ? 227 TYR B CG 1 +ATOM 6691 C CD1 . TYR B 1 207 ? 78.720 44.452 47.706 1.00 17.52 ? 227 TYR B CD1 1 +ATOM 6692 C CD2 . TYR B 1 207 ? 79.803 44.496 49.831 1.00 18.16 ? 227 TYR B CD2 1 +ATOM 6693 C CE1 . TYR B 1 207 ? 77.933 43.376 48.133 1.00 18.77 ? 227 TYR B CE1 1 +ATOM 6694 C CE2 . TYR B 1 207 ? 79.029 43.435 50.261 1.00 18.13 ? 227 TYR B CE2 1 +ATOM 6695 C CZ . TYR B 1 207 ? 78.101 42.881 49.418 1.00 17.60 ? 227 TYR B CZ 1 +ATOM 6696 O OH . TYR B 1 207 ? 77.334 41.835 49.864 1.00 18.98 ? 227 TYR B OH 1 +ATOM 6697 N N . ILE B 1 208 ? 83.349 45.654 49.182 1.00 12.88 ? 228 ILE B N 1 +ATOM 6698 C CA . ILE B 1 208 ? 84.205 45.078 50.213 1.00 12.75 ? 228 ILE B CA 1 +ATOM 6699 C C . ILE B 1 208 ? 83.277 44.545 51.300 1.00 12.30 ? 228 ILE B C 1 +ATOM 6700 O O . ILE B 1 208 ? 82.551 45.316 51.920 1.00 12.57 ? 228 ILE B O 1 +ATOM 6701 C CB . ILE B 1 208 ? 85.167 46.154 50.787 1.00 12.77 ? 228 ILE B CB 1 +ATOM 6702 C CG1 . ILE B 1 208 ? 86.014 46.763 49.662 1.00 13.01 ? 228 ILE B CG1 1 +ATOM 6703 C CG2 . ILE B 1 208 ? 86.064 45.557 51.873 1.00 12.61 ? 228 ILE B CG2 1 +ATOM 6704 C CD1 . ILE B 1 208 ? 86.703 48.048 50.025 1.00 12.48 ? 228 ILE B CD1 1 +ATOM 6705 N N . ASP B 1 209 ? 83.260 43.231 51.495 1.00 11.63 ? 229 ASP B N 1 +ATOM 6706 C CA . ASP B 1 209 ? 82.326 42.599 52.440 1.00 11.57 ? 229 ASP B CA 1 +ATOM 6707 C C . ASP B 1 209 ? 82.951 42.335 53.802 1.00 11.47 ? 229 ASP B C 1 +ATOM 6708 O O . ASP B 1 209 ? 82.267 42.393 54.823 1.00 11.83 ? 229 ASP B O 1 +ATOM 6709 C CB . ASP B 1 209 ? 81.783 41.279 51.874 1.00 11.62 ? 229 ASP B CB 1 +ATOM 6710 C CG . ASP B 1 209 ? 80.678 40.709 52.722 1.00 12.46 ? 229 ASP B CG 1 +ATOM 6711 O OD1 . ASP B 1 209 ? 79.582 41.313 52.762 1.00 13.13 ? 229 ASP B OD1 1 +ATOM 6712 O OD2 . ASP B 1 209 ? 80.908 39.659 53.358 1.00 13.99 ? 229 ASP B OD2 1 +ATOM 6713 N N . ASP B 1 210 ? 84.244 42.012 53.825 1.00 11.54 ? 230 ASP B N 1 +ATOM 6714 C CA . ASP B 1 210 ? 84.905 41.690 55.077 1.00 11.62 ? 230 ASP B CA 1 +ATOM 6715 C C . ASP B 1 210 ? 86.382 42.058 55.010 1.00 11.46 ? 230 ASP B C 1 +ATOM 6716 O O . ASP B 1 210 ? 86.983 42.089 53.930 1.00 11.33 ? 230 ASP B O 1 +ATOM 6717 C CB . ASP B 1 210 ? 84.730 40.195 55.390 1.00 11.94 ? 230 ASP B CB 1 +ATOM 6718 C CG . ASP B 1 210 ? 84.866 39.855 56.889 1.00 13.02 ? 230 ASP B CG 1 +ATOM 6719 O OD1 . ASP B 1 210 ? 85.143 40.734 57.732 1.00 12.21 ? 230 ASP B OD1 1 +ATOM 6720 O OD2 . ASP B 1 210 ? 84.691 38.661 57.220 1.00 14.85 ? 230 ASP B OD2 1 +ATOM 6721 N N . ILE B 1 211 ? 86.938 42.374 56.169 1.00 11.07 ? 231 ILE B N 1 +ATOM 6722 C CA . ILE B 1 211 ? 88.360 42.658 56.307 1.00 11.21 ? 231 ILE B CA 1 +ATOM 6723 C C . ILE B 1 211 ? 88.788 42.018 57.608 1.00 11.09 ? 231 ILE B C 1 +ATOM 6724 O O . ILE B 1 211 ? 88.070 42.135 58.597 1.00 11.07 ? 231 ILE B O 1 +ATOM 6725 C CB . ILE B 1 211 ? 88.661 44.174 56.391 1.00 10.49 ? 231 ILE B CB 1 +ATOM 6726 C CG1 . ILE B 1 211 ? 88.236 44.912 55.126 1.00 11.49 ? 231 ILE B CG1 1 +ATOM 6727 C CG2 . ILE B 1 211 ? 90.171 44.432 56.621 1.00 10.65 ? 231 ILE B CG2 1 +ATOM 6728 C CD1 . ILE B 1 211 ? 88.267 46.433 55.298 1.00 11.06 ? 231 ILE B CD1 1 +ATOM 6729 N N . THR B 1 212 ? 89.917 41.304 57.602 1.00 10.79 ? 232 THR B N 1 +ATOM 6730 C CA . THR B 1 212 ? 90.472 40.721 58.818 1.00 11.00 ? 232 THR B CA 1 +ATOM 6731 C C . THR B 1 212 ? 91.934 41.108 58.887 1.00 11.42 ? 232 THR B C 1 +ATOM 6732 O O . THR B 1 212 ? 92.729 40.732 58.017 1.00 11.08 ? 232 THR B O 1 +ATOM 6733 C CB . THR B 1 212 ? 90.324 39.184 58.867 1.00 11.31 ? 232 THR B CB 1 +ATOM 6734 O OG1 . THR B 1 212 ? 88.943 38.841 58.743 1.00 11.16 ? 232 THR B OG1 1 +ATOM 6735 C CG2 . THR B 1 212 ? 90.836 38.637 60.183 1.00 11.71 ? 232 THR B CG2 1 +ATOM 6736 N N . VAL B 1 213 ? 92.267 41.898 59.904 1.00 10.73 ? 233 VAL B N 1 +ATOM 6737 C CA . VAL B 1 213 ? 93.616 42.386 60.094 1.00 10.64 ? 233 VAL B CA 1 +ATOM 6738 C C . VAL B 1 213 ? 94.193 41.785 61.360 1.00 10.92 ? 233 VAL B C 1 +ATOM 6739 O O . VAL B 1 213 ? 93.530 41.740 62.390 1.00 9.79 ? 233 VAL B O 1 +ATOM 6740 C CB . VAL B 1 213 ? 93.635 43.922 60.209 1.00 10.65 ? 233 VAL B CB 1 +ATOM 6741 C CG1 . VAL B 1 213 ? 95.023 44.408 60.684 1.00 11.07 ? 233 VAL B CG1 1 +ATOM 6742 C CG2 . VAL B 1 213 ? 93.278 44.541 58.878 1.00 10.19 ? 233 VAL B CG2 1 +ATOM 6743 N N . THR B 1 214 ? 95.434 41.321 61.269 1.00 11.01 ? 234 THR B N 1 +ATOM 6744 C CA . THR B 1 214 ? 96.206 40.945 62.443 1.00 11.58 ? 234 THR B CA 1 +ATOM 6745 C C . THR B 1 214 ? 97.569 41.615 62.349 1.00 11.86 ? 234 THR B C 1 +ATOM 6746 O O . THR B 1 214 ? 98.060 41.887 61.253 1.00 12.12 ? 234 THR B O 1 +ATOM 6747 C CB . THR B 1 214 ? 96.365 39.422 62.559 1.00 12.04 ? 234 THR B CB 1 +ATOM 6748 O OG1 . THR B 1 214 ? 97.069 38.916 61.421 1.00 13.10 ? 234 THR B OG1 1 +ATOM 6749 C CG2 . THR B 1 214 ? 94.990 38.750 62.646 1.00 10.77 ? 234 THR B CG2 1 +ATOM 6750 N N . THR B 1 215 ? 98.171 41.899 63.489 1.00 11.92 ? 235 THR B N 1 +ATOM 6751 C CA . THR B 1 215 ? 99.415 42.654 63.502 1.00 12.20 ? 235 THR B CA 1 +ATOM 6752 C C . THR B 1 215 ? 100.453 41.934 64.343 1.00 12.83 ? 235 THR B C 1 +ATOM 6753 O O . THR B 1 215 ? 100.118 41.299 65.339 1.00 13.25 ? 235 THR B O 1 +ATOM 6754 C CB . THR B 1 215 ? 99.185 44.092 64.049 1.00 11.93 ? 235 THR B CB 1 +ATOM 6755 O OG1 . THR B 1 215 ? 98.804 44.048 65.432 1.00 11.47 ? 235 THR B OG1 1 +ATOM 6756 C CG2 . THR B 1 215 ? 98.087 44.777 63.268 1.00 12.25 ? 235 THR B CG2 1 +ATOM 6757 N N . SER B 1 216 ? 101.717 42.041 63.943 1.00 13.79 ? 236 SER B N 1 +ATOM 6758 C CA . SER B 1 216 ? 102.824 41.543 64.760 1.00 14.79 ? 236 SER B CA 1 +ATOM 6759 C C . SER B 1 216 ? 103.988 42.527 64.702 1.00 15.23 ? 236 SER B C 1 +ATOM 6760 O O . SER B 1 216 ? 103.917 43.545 64.006 1.00 13.93 ? 236 SER B O 1 +ATOM 6761 C CB . SER B 1 216 ? 103.250 40.145 64.306 1.00 15.11 ? 236 SER B CB 1 +ATOM 6762 O OG . SER B 1 216 ? 103.808 40.180 63.013 1.00 16.85 ? 236 SER B OG 1 +ATOM 6763 N N . VAL B 1 217 ? 105.045 42.249 65.458 1.00 16.03 ? 237 VAL B N 1 +ATOM 6764 C CA . VAL B 1 217 ? 106.198 43.149 65.494 1.00 17.37 ? 237 VAL B CA 1 +ATOM 6765 C C . VAL B 1 217 ? 107.445 42.371 65.104 1.00 18.23 ? 237 VAL B C 1 +ATOM 6766 O O . VAL B 1 217 ? 107.603 41.206 65.481 1.00 18.06 ? 237 VAL B O 1 +ATOM 6767 C CB . VAL B 1 217 ? 106.380 43.792 66.887 1.00 17.73 ? 237 VAL B CB 1 +ATOM 6768 C CG1 . VAL B 1 217 ? 107.617 44.714 66.913 1.00 18.51 ? 237 VAL B CG1 1 +ATOM 6769 C CG2 . VAL B 1 217 ? 105.119 44.562 67.279 1.00 18.02 ? 237 VAL B CG2 1 +ATOM 6770 N N . GLU B 1 218 ? 108.311 43.024 64.331 1.00 19.12 ? 238 GLU B N 1 +ATOM 6771 C CA . GLU B 1 218 ? 109.609 42.470 63.949 1.00 19.78 ? 238 GLU B CA 1 +ATOM 6772 C C . GLU B 1 218 ? 110.668 43.540 64.178 1.00 20.00 ? 238 GLU B C 1 +ATOM 6773 O O . GLU B 1 218 ? 110.773 44.494 63.405 1.00 19.05 ? 238 GLU B O 1 +ATOM 6774 C CB . GLU B 1 218 ? 109.590 42.039 62.482 1.00 20.42 ? 238 GLU B CB 1 +ATOM 6775 C CG . GLU B 1 218 ? 110.832 41.272 62.053 1.00 21.85 ? 238 GLU B CG 1 +ATOM 6776 C CD . GLU B 1 218 ? 110.979 41.196 60.549 1.00 23.98 ? 238 GLU B CD 1 +ATOM 6777 O OE1 . GLU B 1 218 ? 109.978 40.929 59.858 1.00 26.73 ? 238 GLU B OE1 1 +ATOM 6778 O OE2 . GLU B 1 218 ? 112.102 41.400 60.059 1.00 25.81 ? 238 GLU B OE2 1 +ATOM 6779 N N . GLN B 1 219 ? 111.439 43.375 65.255 1.00 20.36 ? 239 GLN B N 1 +ATOM 6780 C CA . GLN B 1 219 ? 112.408 44.374 65.698 1.00 20.53 ? 239 GLN B CA 1 +ATOM 6781 C C . GLN B 1 219 ? 111.698 45.714 65.938 1.00 20.48 ? 239 GLN B C 1 +ATOM 6782 O O . GLN B 1 219 ? 110.832 45.793 66.816 1.00 21.42 ? 239 GLN B O 1 +ATOM 6783 C CB . GLN B 1 219 ? 113.584 44.484 64.712 1.00 20.69 ? 239 GLN B CB 1 +ATOM 6784 C CG . GLN B 1 219 ? 114.249 43.128 64.325 0.00 24.38 ? 239 GLN B CG 1 +ATOM 6785 C CD . GLN B 1 219 ? 115.436 43.269 63.370 0.00 24.42 ? 239 GLN B CD 1 +ATOM 6786 O OE1 . GLN B 1 219 ? 115.514 43.107 62.350 0.50 16.12 ? 239 GLN B OE1 1 +ATOM 6787 N NE2 . GLN B 1 219 ? 116.545 43.788 63.888 0.00 50.61 ? 239 GLN B NE2 1 +ATOM 6788 N N . ASP B 1 220 ? 112.035 46.746 65.160 1.00 20.02 ? 240 ASP B N 1 +ATOM 6789 C CA A ASP B 1 220 ? 111.394 48.056 65.249 0.50 19.92 ? 240 ASP B CA 1 +ATOM 6790 C CA B ASP B 1 220 ? 111.346 48.039 65.281 0.50 19.87 ? 240 ASP B CA 1 +ATOM 6791 C C . ASP B 1 220 ? 110.409 48.273 64.092 1.00 19.48 ? 240 ASP B C 1 +ATOM 6792 O O . ASP B 1 220 ? 110.033 49.415 63.783 1.00 19.19 ? 240 ASP B O 1 +ATOM 6793 C CB A ASP B 1 220 ? 112.480 49.130 65.251 0.50 20.15 ? 240 ASP B CB 1 +ATOM 6794 C CB B ASP B 1 220 ? 112.341 49.196 65.472 0.50 20.10 ? 240 ASP B CB 1 +ATOM 6795 C CG A ASP B 1 220 ? 113.574 48.832 66.262 0.50 20.64 ? 240 ASP B CG 1 +ATOM 6796 C CG B ASP B 1 220 ? 113.295 49.365 64.307 0.50 20.26 ? 240 ASP B CG 1 +ATOM 6797 O OD1 A ASP B 1 220 ? 113.237 48.670 67.453 0.50 21.78 ? 240 ASP B OD1 1 +ATOM 6798 O OD1 B ASP B 1 220 ? 113.453 48.428 63.497 0.50 21.43 ? 240 ASP B OD1 1 +ATOM 6799 O OD2 A ASP B 1 220 ? 114.757 48.732 65.869 0.50 22.26 ? 240 ASP B OD2 1 +ATOM 6800 O OD2 B ASP B 1 220 ? 113.901 50.453 64.216 0.50 21.60 ? 240 ASP B OD2 1 +ATOM 6801 N N . SER B 1 221 ? 110.010 47.178 63.443 1.00 18.79 ? 241 SER B N 1 +ATOM 6802 C CA . SER B 1 221 ? 109.052 47.219 62.344 1.00 18.27 ? 241 SER B CA 1 +ATOM 6803 C C . SER B 1 221 ? 107.733 46.577 62.757 1.00 17.42 ? 241 SER B C 1 +ATOM 6804 O O . SER B 1 221 ? 107.704 45.655 63.569 1.00 17.49 ? 241 SER B O 1 +ATOM 6805 C CB . SER B 1 221 ? 109.599 46.500 61.107 1.00 19.05 ? 241 SER B CB 1 +ATOM 6806 O OG . SER B 1 221 ? 110.577 47.294 60.449 1.00 19.88 ? 241 SER B OG 1 +ATOM 6807 N N . GLY B 1 222 ? 106.643 47.063 62.182 1.00 16.25 ? 242 GLY B N 1 +ATOM 6808 C CA . GLY B 1 222 ? 105.331 46.469 62.415 1.00 15.25 ? 242 GLY B CA 1 +ATOM 6809 C C . GLY B 1 222 ? 104.901 45.753 61.162 1.00 14.47 ? 242 GLY B C 1 +ATOM 6810 O O . GLY B 1 222 ? 105.265 46.155 60.051 1.00 14.73 ? 242 GLY B O 1 +ATOM 6811 N N . LEU B 1 223 ? 104.153 44.671 61.335 1.00 13.44 ? 243 LEU B N 1 +ATOM 6812 C CA . LEU B 1 223 ? 103.653 43.891 60.221 1.00 12.96 ? 243 LEU B CA 1 +ATOM 6813 C C . LEU B 1 223 ? 102.144 43.869 60.303 1.00 12.20 ? 243 LEU B C 1 +ATOM 6814 O O . LEU B 1 223 ? 101.604 43.555 61.350 1.00 13.03 ? 243 LEU B O 1 +ATOM 6815 C CB . LEU B 1 223 ? 104.196 42.470 60.297 1.00 13.22 ? 243 LEU B CB 1 +ATOM 6816 C CG . LEU B 1 223 ? 105.725 42.346 60.214 1.00 12.95 ? 243 LEU B CG 1 +ATOM 6817 C CD1 . LEU B 1 223 ? 106.141 40.889 60.478 1.00 15.63 ? 243 LEU B CD1 1 +ATOM 6818 C CD2 . LEU B 1 223 ? 106.205 42.808 58.858 1.00 15.75 ? 243 LEU B CD2 1 +ATOM 6819 N N . VAL B 1 224 ? 101.473 44.208 59.209 1.00 11.74 ? 244 VAL B N 1 +ATOM 6820 C CA . VAL B 1 224 ? 100.010 44.281 59.179 1.00 11.27 ? 244 VAL B CA 1 +ATOM 6821 C C . VAL B 1 224 ? 99.532 43.295 58.127 1.00 11.37 ? 244 VAL B C 1 +ATOM 6822 O O . VAL B 1 224 ? 99.680 43.523 56.912 1.00 11.15 ? 244 VAL B O 1 +ATOM 6823 C CB . VAL B 1 224 ? 99.491 45.684 58.861 1.00 11.40 ? 244 VAL B CB 1 +ATOM 6824 C CG1 . VAL B 1 224 ? 97.978 45.720 58.998 1.00 11.45 ? 244 VAL B CG1 1 +ATOM 6825 C CG2 . VAL B 1 224 ? 100.125 46.721 59.791 1.00 10.82 ? 244 VAL B CG2 1 +ATOM 6826 N N . ASN B 1 225 ? 99.007 42.175 58.607 1.00 11.00 ? 245 ASN B N 1 +ATOM 6827 C CA . ASN B 1 225 ? 98.441 41.155 57.750 1.00 11.31 ? 245 ASN B CA 1 +ATOM 6828 C C . ASN B 1 225 ? 97.009 41.530 57.412 1.00 11.91 ? 245 ASN B C 1 +ATOM 6829 O O . ASN B 1 225 ? 96.254 41.903 58.307 1.00 11.75 ? 245 ASN B O 1 +ATOM 6830 C CB . ASN B 1 225 ? 98.432 39.802 58.463 1.00 11.72 ? 245 ASN B CB 1 +ATOM 6831 C CG . ASN B 1 225 ? 99.809 39.354 58.891 1.00 12.23 ? 245 ASN B CG 1 +ATOM 6832 O OD1 . ASN B 1 225 ? 100.678 39.105 58.055 1.00 12.09 ? 245 ASN B OD1 1 +ATOM 6833 N ND2 . ASN B 1 225 ? 100.015 39.229 60.207 1.00 11.35 ? 245 ASN B ND2 1 +ATOM 6834 N N . TYR B 1 226 ? 96.643 41.434 56.137 1.00 12.20 ? 246 TYR B N 1 +ATOM 6835 C CA . TYR B 1 226 ? 95.255 41.644 55.702 1.00 11.92 ? 246 TYR B CA 1 +ATOM 6836 C C . TYR B 1 226 ? 94.686 40.446 54.932 1.00 12.46 ? 246 TYR B C 1 +ATOM 6837 O O . TYR B 1 226 ? 95.398 39.747 54.191 1.00 11.64 ? 246 TYR B O 1 +ATOM 6838 C CB . TYR B 1 226 ? 95.098 42.944 54.893 1.00 11.96 ? 246 TYR B CB 1 +ATOM 6839 C CG . TYR B 1 226 ? 95.975 43.051 53.667 1.00 10.61 ? 246 TYR B CG 1 +ATOM 6840 C CD1 . TYR B 1 226 ? 95.493 42.712 52.406 1.00 11.35 ? 246 TYR B CD1 1 +ATOM 6841 C CD2 . TYR B 1 226 ? 97.277 43.508 53.769 1.00 11.34 ? 246 TYR B CD2 1 +ATOM 6842 C CE1 . TYR B 1 226 ? 96.302 42.810 51.277 1.00 12.11 ? 246 TYR B CE1 1 +ATOM 6843 C CE2 . TYR B 1 226 ? 98.096 43.607 52.650 1.00 11.51 ? 246 TYR B CE2 1 +ATOM 6844 C CZ . TYR B 1 226 ? 97.605 43.261 51.406 1.00 12.08 ? 246 TYR B CZ 1 +ATOM 6845 O OH . TYR B 1 226 ? 98.425 43.373 50.298 1.00 11.61 ? 246 TYR B OH 1 +ATOM 6846 N N . GLN B 1 227 ? 93.392 40.210 55.158 1.00 12.55 ? 247 GLN B N 1 +ATOM 6847 C CA . GLN B 1 227 ? 92.562 39.294 54.384 1.00 13.65 ? 247 GLN B CA 1 +ATOM 6848 C C . GLN B 1 227 ? 91.280 40.049 54.049 1.00 13.48 ? 247 GLN B C 1 +ATOM 6849 O O . GLN B 1 227 ? 90.596 40.521 54.948 1.00 13.81 ? 247 GLN B O 1 +ATOM 6850 C CB . GLN B 1 227 ? 92.204 38.054 55.211 1.00 13.98 ? 247 GLN B CB 1 +ATOM 6851 C CG . GLN B 1 227 ? 93.122 36.879 55.030 1.00 15.73 ? 247 GLN B CG 1 +ATOM 6852 C CD . GLN B 1 227 ? 92.951 36.185 53.691 1.00 15.80 ? 247 GLN B CD 1 +ATOM 6853 O OE1 . GLN B 1 227 ? 92.051 36.510 52.907 1.00 16.13 ? 247 GLN B OE1 1 +ATOM 6854 N NE2 . GLN B 1 227 ? 93.797 35.198 53.436 1.00 15.86 ? 247 GLN B NE2 1 +ATOM 6855 N N . ILE B 1 228 ? 90.948 40.149 52.767 1.00 13.54 ? 248 ILE B N 1 +ATOM 6856 C CA . ILE B 1 228 ? 89.829 40.982 52.332 1.00 13.73 ? 248 ILE B CA 1 +ATOM 6857 C C . ILE B 1 228 ? 88.876 40.159 51.486 1.00 13.98 ? 248 ILE B C 1 +ATOM 6858 O O . ILE B 1 228 ? 89.302 39.417 50.597 1.00 13.17 ? 248 ILE B O 1 +ATOM 6859 C CB . ILE B 1 228 ? 90.307 42.206 51.528 1.00 13.57 ? 248 ILE B CB 1 +ATOM 6860 C CG1 . ILE B 1 228 ? 91.319 43.026 52.340 1.00 13.44 ? 248 ILE B CG1 1 +ATOM 6861 C CG2 . ILE B 1 228 ? 89.114 43.066 51.134 1.00 13.29 ? 248 ILE B CG2 1 +ATOM 6862 C CD1 . ILE B 1 228 ? 92.010 44.131 51.531 1.00 14.26 ? 248 ILE B CD1 1 +ATOM 6863 N N . SER B 1 229 ? 87.587 40.288 51.780 1.00 14.03 ? 249 SER B N 1 +ATOM 6864 C CA . SER B 1 229 ? 86.555 39.517 51.099 1.00 14.99 ? 249 SER B CA 1 +ATOM 6865 C C . SER B 1 229 ? 85.727 40.482 50.283 1.00 15.19 ? 249 SER B C 1 +ATOM 6866 O O . SER B 1 229 ? 85.216 41.465 50.820 1.00 15.15 ? 249 SER B O 1 +ATOM 6867 C CB . SER B 1 229 ? 85.645 38.806 52.098 1.00 14.98 ? 249 SER B CB 1 +ATOM 6868 O OG . SER B 1 229 ? 84.491 38.311 51.456 1.00 16.74 ? 249 SER B OG 1 +ATOM 6869 N N . VAL B 1 230 ? 85.596 40.179 48.993 1.00 15.94 ? 250 VAL B N 1 +ATOM 6870 C CA . VAL B 1 230 ? 84.790 40.956 48.061 1.00 16.30 ? 250 VAL B CA 1 +ATOM 6871 C C . VAL B 1 230 ? 83.597 40.133 47.571 1.00 17.18 ? 250 VAL B C 1 +ATOM 6872 O O . VAL B 1 230 ? 83.751 38.940 47.236 1.00 16.71 ? 250 VAL B O 1 +ATOM 6873 C CB . VAL B 1 230 ? 85.633 41.380 46.850 1.00 16.21 ? 250 VAL B CB 1 +ATOM 6874 C CG1 . VAL B 1 230 ? 84.741 41.978 45.746 1.00 16.00 ? 250 VAL B CG1 1 +ATOM 6875 C CG2 . VAL B 1 230 ? 86.729 42.364 47.287 1.00 16.59 ? 250 VAL B CG2 1 +ATOM 6876 N N . LYS B 1 231 ? 82.422 40.770 47.540 1.00 18.06 ? 251 LYS B N 1 +ATOM 6877 C CA . LYS B 1 231 ? 81.179 40.150 47.069 1.00 19.09 ? 251 LYS B CA 1 +ATOM 6878 C C . LYS B 1 231 ? 80.669 40.837 45.813 1.00 19.86 ? 251 LYS B C 1 +ATOM 6879 O O . LYS B 1 231 ? 80.863 42.035 45.631 1.00 19.27 ? 251 LYS B O 1 +ATOM 6880 C CB . LYS B 1 231 ? 80.085 40.241 48.133 1.00 19.35 ? 251 LYS B CB 1 +ATOM 6881 C CG . LYS B 1 231 ? 80.298 39.372 49.347 1.00 20.56 ? 251 LYS B CG 1 +ATOM 6882 C CD . LYS B 1 231 ? 79.738 37.972 49.167 1.00 23.30 ? 251 LYS B CD 1 +ATOM 6883 C CE . LYS B 1 231 ? 79.953 37.142 50.416 1.00 24.16 ? 251 LYS B CE 1 +ATOM 6884 N NZ . LYS B 1 231 ? 79.273 37.720 51.619 1.00 25.03 ? 251 LYS B NZ 1 +ATOM 6885 N N . GLY B 1 232 ? 79.979 40.064 44.978 1.00 21.02 ? 252 GLY B N 1 +ATOM 6886 C CA . GLY B 1 232 ? 79.459 40.527 43.697 1.00 22.07 ? 252 GLY B CA 1 +ATOM 6887 C C . GLY B 1 232 ? 80.290 39.967 42.561 1.00 23.00 ? 252 GLY B C 1 +ATOM 6888 O O . GLY B 1 232 ? 80.447 38.748 42.429 1.00 23.47 ? 252 GLY B O 1 +ATOM 6889 N N . SER B 1 233 ? 80.844 40.859 41.753 1.00 24.01 ? 253 SER B N 1 +ATOM 6890 C CA . SER B 1 233 ? 81.686 40.485 40.623 1.00 24.91 ? 253 SER B CA 1 +ATOM 6891 C C . SER B 1 233 ? 82.941 39.732 41.070 1.00 25.24 ? 253 SER B C 1 +ATOM 6892 O O . SER B 1 233 ? 83.543 40.067 42.098 1.00 25.68 ? 253 SER B O 1 +ATOM 6893 C CB . SER B 1 233 ? 82.098 41.747 39.850 1.00 24.64 ? 253 SER B CB 1 +ATOM 6894 O OG . SER B 1 233 ? 83.097 41.463 38.881 1.00 25.87 ? 253 SER B OG 1 +ATOM 6895 N N . ASN B 1 234 ? 83.331 38.725 40.291 1.00 25.43 ? 254 ASN B N 1 +ATOM 6896 C CA . ASN B 1 234 ? 84.588 38.010 40.517 1.00 25.77 ? 254 ASN B CA 1 +ATOM 6897 C C . ASN B 1 234 ? 85.783 38.645 39.810 1.00 25.23 ? 254 ASN B C 1 +ATOM 6898 O O . ASN B 1 234 ? 86.915 38.206 40.004 1.00 25.92 ? 254 ASN B O 1 +ATOM 6899 C CB . ASN B 1 234 ? 84.462 36.544 40.082 1.00 26.20 ? 254 ASN B CB 1 +ATOM 6900 C CG . ASN B 1 234 ? 84.253 36.386 38.582 1.00 28.01 ? 254 ASN B CG 1 +ATOM 6901 O OD1 . ASN B 1 234 ? 83.874 37.333 37.888 1.00 32.16 ? 254 ASN B OD1 1 +ATOM 6902 N ND2 . ASN B 1 234 ? 84.492 35.179 38.076 1.00 30.66 ? 254 ASN B ND2 1 +ATOM 6903 N N . LEU B 1 235 ? 85.526 39.651 38.975 1.00 24.68 ? 255 LEU B N 1 +ATOM 6904 C CA . LEU B 1 235 ? 86.570 40.350 38.237 1.00 24.17 ? 255 LEU B CA 1 +ATOM 6905 C C . LEU B 1 235 ? 86.867 41.683 38.916 1.00 23.09 ? 255 LEU B C 1 +ATOM 6906 O O . LEU B 1 235 ? 86.118 42.643 38.763 1.00 23.14 ? 255 LEU B O 1 +ATOM 6907 C CB . LEU B 1 235 ? 86.135 40.584 36.782 1.00 24.46 ? 255 LEU B CB 1 +ATOM 6908 C CG . LEU B 1 235 ? 87.149 41.263 35.849 1.00 24.74 ? 255 LEU B CG 1 +ATOM 6909 C CD1 . LEU B 1 235 ? 88.457 40.476 35.799 1.00 26.29 ? 255 LEU B CD1 1 +ATOM 6910 C CD2 . LEU B 1 235 ? 86.577 41.443 34.445 1.00 24.82 ? 255 LEU B CD2 1 +ATOM 6911 N N . PHE B 1 236 ? 87.958 41.733 39.673 1.00 21.93 ? 256 PHE B N 1 +ATOM 6912 C CA . PHE B 1 236 ? 88.315 42.945 40.398 1.00 20.76 ? 256 PHE B CA 1 +ATOM 6913 C C . PHE B 1 236 ? 89.795 43.048 40.739 1.00 20.35 ? 256 PHE B C 1 +ATOM 6914 O O . PHE B 1 236 ? 90.573 42.095 40.569 1.00 20.32 ? 256 PHE B O 1 +ATOM 6915 C CB . PHE B 1 236 ? 87.475 43.060 41.679 1.00 20.62 ? 256 PHE B CB 1 +ATOM 6916 C CG . PHE B 1 236 ? 87.711 41.948 42.672 1.00 19.97 ? 256 PHE B CG 1 +ATOM 6917 C CD1 . PHE B 1 236 ? 86.811 40.904 42.786 1.00 19.55 ? 256 PHE B CD1 1 +ATOM 6918 C CD2 . PHE B 1 236 ? 88.824 41.957 43.506 1.00 20.68 ? 256 PHE B CD2 1 +ATOM 6919 C CE1 . PHE B 1 236 ? 87.011 39.884 43.705 1.00 19.76 ? 256 PHE B CE1 1 +ATOM 6920 C CE2 . PHE B 1 236 ? 89.040 40.927 44.420 1.00 20.40 ? 256 PHE B CE2 1 +ATOM 6921 C CZ . PHE B 1 236 ? 88.128 39.893 44.515 1.00 20.07 ? 256 PHE B CZ 1 +ATOM 6922 N N . LYS B 1 237 ? 90.159 44.228 41.225 1.00 19.46 ? 257 LYS B N 1 +ATOM 6923 C CA . LYS B 1 237 ? 91.497 44.522 41.726 1.00 19.78 ? 257 LYS B CA 1 +ATOM 6924 C C . LYS B 1 237 ? 91.393 45.257 43.071 1.00 18.60 ? 257 LYS B C 1 +ATOM 6925 O O . LYS B 1 237 ? 90.495 46.097 43.268 1.00 18.05 ? 257 LYS B O 1 +ATOM 6926 C CB . LYS B 1 237 ? 92.270 45.366 40.710 1.00 19.73 ? 257 LYS B CB 1 +ATOM 6927 C CG . LYS B 1 237 ? 92.554 44.626 39.399 1.00 21.19 ? 257 LYS B CG 1 +ATOM 6928 C CD . LYS B 1 237 ? 93.238 45.506 38.372 1.00 22.27 ? 257 LYS B CD 1 +ATOM 6929 C CE . LYS B 1 237 ? 93.437 44.764 37.052 1.00 24.73 ? 257 LYS B CE 1 +ATOM 6930 N NZ . LYS B 1 237 ? 94.388 43.624 37.206 1.00 26.18 ? 257 LYS B NZ 1 +ATOM 6931 N N . LEU B 1 238 ? 92.292 44.912 43.997 1.00 17.37 ? 258 LEU B N 1 +ATOM 6932 C CA . LEU B 1 238 ? 92.348 45.539 45.316 1.00 16.57 ? 258 LEU B CA 1 +ATOM 6933 C C . LEU B 1 238 ? 93.683 46.242 45.495 1.00 16.50 ? 258 LEU B C 1 +ATOM 6934 O O . LEU B 1 238 ? 94.735 45.719 45.128 1.00 16.44 ? 258 LEU B O 1 +ATOM 6935 C CB . LEU B 1 238 ? 92.161 44.503 46.444 1.00 16.41 ? 258 LEU B CB 1 +ATOM 6936 C CG . LEU B 1 238 ? 90.741 44.074 46.838 1.00 16.06 ? 258 LEU B CG 1 +ATOM 6937 C CD1 . LEU B 1 238 ? 90.795 42.827 47.698 1.00 15.72 ? 258 LEU B CD1 1 +ATOM 6938 C CD2 . LEU B 1 238 ? 89.998 45.198 47.575 1.00 14.13 ? 258 LEU B CD2 1 +ATOM 6939 N N . GLU B 1 239 ? 93.614 47.453 46.030 1.00 15.89 ? 259 GLU B N 1 +ATOM 6940 C CA . GLU B 1 239 ? 94.773 48.196 46.459 1.00 16.13 ? 259 GLU B CA 1 +ATOM 6941 C C . GLU B 1 239 ? 94.544 48.509 47.921 1.00 15.76 ? 259 GLU B C 1 +ATOM 6942 O O . GLU B 1 239 ? 93.420 48.796 48.325 1.00 15.58 ? 259 GLU B O 1 +ATOM 6943 C CB . GLU B 1 239 ? 94.909 49.452 45.613 1.00 16.49 ? 259 GLU B CB 1 +ATOM 6944 C CG . GLU B 1 239 ? 95.311 49.136 44.168 1.00 18.10 ? 259 GLU B CG 1 +ATOM 6945 C CD . GLU B 1 239 ? 94.986 50.251 43.183 1.00 20.78 ? 259 GLU B CD 1 +ATOM 6946 O OE1 . GLU B 1 239 ? 93.798 50.421 42.846 1.00 23.14 ? 259 GLU B OE1 1 +ATOM 6947 O OE2 . GLU B 1 239 ? 95.923 50.933 42.715 1.00 22.54 ? 259 GLU B OE2 1 +ATOM 6948 N N . VAL B 1 240 ? 95.592 48.384 48.727 1.00 15.20 ? 260 VAL B N 1 +ATOM 6949 C CA . VAL B 1 240 ? 95.509 48.699 50.144 1.00 15.22 ? 260 VAL B CA 1 +ATOM 6950 C C . VAL B 1 240 ? 96.644 49.649 50.501 1.00 15.31 ? 260 VAL B C 1 +ATOM 6951 O O . VAL B 1 240 ? 97.775 49.481 50.025 1.00 15.25 ? 260 VAL B O 1 +ATOM 6952 C CB . VAL B 1 240 ? 95.578 47.426 51.044 1.00 15.20 ? 260 VAL B CB 1 +ATOM 6953 C CG1 . VAL B 1 240 ? 94.407 46.492 50.767 1.00 15.50 ? 260 VAL B CG1 1 +ATOM 6954 C CG2 . VAL B 1 240 ? 96.886 46.707 50.863 1.00 15.16 ? 260 VAL B CG2 1 +ATOM 6955 N N . ARG B 1 241 ? 96.333 50.662 51.308 1.00 15.40 ? 261 ARG B N 1 +ATOM 6956 C CA . ARG B 1 241 ? 97.328 51.625 51.775 1.00 15.90 ? 261 ARG B CA 1 +ATOM 6957 C C . ARG B 1 241 ? 97.231 51.775 53.277 1.00 15.60 ? 261 ARG B C 1 +ATOM 6958 O O . ARG B 1 241 ? 96.132 51.874 53.828 1.00 14.92 ? 261 ARG B O 1 +ATOM 6959 C CB . ARG B 1 241 ? 97.090 53.005 51.165 1.00 16.32 ? 261 ARG B CB 1 +ATOM 6960 C CG . ARG B 1 241 ? 97.255 53.103 49.677 1.00 18.20 ? 261 ARG B CG 1 +ATOM 6961 C CD . ARG B 1 241 ? 97.414 54.579 49.257 1.00 21.78 ? 261 ARG B CD 1 +ATOM 6962 N NE . ARG B 1 241 ? 96.351 55.446 49.769 1.00 24.09 ? 261 ARG B NE 1 +ATOM 6963 C CZ . ARG B 1 241 ? 96.367 56.783 49.723 1.00 25.55 ? 261 ARG B CZ 1 +ATOM 6964 N NH1 . ARG B 1 241 ? 97.397 57.440 49.198 1.00 25.38 ? 261 ARG B NH1 1 +ATOM 6965 N NH2 . ARG B 1 241 ? 95.355 57.478 50.216 1.00 24.96 ? 261 ARG B NH2 1 +ATOM 6966 N N . LEU B 1 242 ? 98.376 51.843 53.943 1.00 15.42 ? 262 LEU B N 1 +ATOM 6967 C CA . LEU B 1 242 ? 98.379 52.093 55.374 1.00 15.18 ? 262 LEU B CA 1 +ATOM 6968 C C . LEU B 1 242 ? 98.821 53.531 55.588 1.00 15.51 ? 262 LEU B C 1 +ATOM 6969 O O . LEU B 1 242 ? 99.920 53.921 55.181 1.00 14.77 ? 262 LEU B O 1 +ATOM 6970 C CB . LEU B 1 242 ? 99.291 51.109 56.109 1.00 14.63 ? 262 LEU B CB 1 +ATOM 6971 C CG . LEU B 1 242 ? 99.048 51.053 57.621 1.00 14.68 ? 262 LEU B CG 1 +ATOM 6972 C CD1 . LEU B 1 242 ? 97.753 50.303 57.968 1.00 14.28 ? 262 LEU B CD1 1 +ATOM 6973 C CD2 . LEU B 1 242 ? 100.236 50.448 58.330 1.00 14.00 ? 262 LEU B CD2 1 +ATOM 6974 N N . LEU B 1 243 ? 97.946 54.319 56.208 1.00 15.84 ? 263 LEU B N 1 +ATOM 6975 C CA . LEU B 1 243 ? 98.226 55.712 56.502 1.00 16.44 ? 263 LEU B CA 1 +ATOM 6976 C C . LEU B 1 243 ? 98.542 55.846 57.985 1.00 16.83 ? 263 LEU B C 1 +ATOM 6977 O O . LEU B 1 243 ? 97.913 55.192 58.825 1.00 16.31 ? 263 LEU B O 1 +ATOM 6978 C CB . LEU B 1 243 ? 97.033 56.596 56.120 1.00 16.82 ? 263 LEU B CB 1 +ATOM 6979 C CG . LEU B 1 243 ? 96.774 56.896 54.634 1.00 16.99 ? 263 LEU B CG 1 +ATOM 6980 C CD1 . LEU B 1 243 ? 97.082 55.717 53.726 1.00 18.97 ? 263 LEU B CD1 1 +ATOM 6981 C CD2 . LEU B 1 243 ? 95.329 57.342 54.429 1.00 17.45 ? 263 LEU B CD2 1 +ATOM 6982 N N . ASP B 1 244 ? 99.534 56.676 58.295 1.00 16.47 ? 264 ASP B N 1 +ATOM 6983 C CA . ASP B 1 244 ? 99.867 56.990 59.679 1.00 17.29 ? 264 ASP B CA 1 +ATOM 6984 C C . ASP B 1 244 ? 98.893 58.029 60.253 1.00 17.73 ? 264 ASP B C 1 +ATOM 6985 O O . ASP B 1 244 ? 97.902 58.396 59.603 1.00 18.29 ? 264 ASP B O 1 +ATOM 6986 C CB . ASP B 1 244 ? 101.338 57.423 59.810 1.00 16.97 ? 264 ASP B CB 1 +ATOM 6987 C CG . ASP B 1 244 ? 101.616 58.809 59.255 1.00 17.64 ? 264 ASP B CG 1 +ATOM 6988 O OD1 . ASP B 1 244 ? 100.670 59.602 59.021 1.00 17.87 ? 264 ASP B OD1 1 +ATOM 6989 O OD2 . ASP B 1 244 ? 102.817 59.099 59.072 1.00 17.28 ? 264 ASP B OD2 1 +ATOM 6990 N N . ALA B 1 245 ? 99.176 58.493 61.467 1.00 18.71 ? 265 ALA B N 1 +ATOM 6991 C CA . ALA B 1 245 ? 98.254 59.364 62.199 1.00 19.67 ? 265 ALA B CA 1 +ATOM 6992 C C . ALA B 1 245 ? 98.156 60.786 61.620 1.00 20.55 ? 265 ALA B C 1 +ATOM 6993 O O . ALA B 1 245 ? 97.219 61.513 61.943 1.00 20.92 ? 265 ALA B O 1 +ATOM 6994 C CB . ALA B 1 245 ? 98.637 59.407 63.674 1.00 19.53 ? 265 ALA B CB 1 +ATOM 6995 N N . GLU B 1 246 ? 99.114 61.176 60.777 1.00 21.41 ? 266 GLU B N 1 +ATOM 6996 C CA . GLU B 1 246 ? 99.033 62.445 60.030 1.00 22.40 ? 266 GLU B CA 1 +ATOM 6997 C C . GLU B 1 246 ? 98.622 62.236 58.560 1.00 22.69 ? 266 GLU B C 1 +ATOM 6998 O O . GLU B 1 246 ? 98.868 63.105 57.712 1.00 22.44 ? 266 GLU B O 1 +ATOM 6999 C CB . GLU B 1 246 ? 100.363 63.212 60.102 1.00 22.68 ? 266 GLU B CB 1 +ATOM 7000 C CG . GLU B 1 246 ? 100.665 63.844 61.462 1.00 24.89 ? 266 GLU B CG 1 +ATOM 7001 C CD . GLU B 1 246 ? 101.177 62.854 62.490 1.00 27.14 ? 266 GLU B CD 1 +ATOM 7002 O OE1 . GLU B 1 246 ? 102.069 62.048 62.151 1.00 28.31 ? 266 GLU B OE1 1 +ATOM 7003 O OE2 . GLU B 1 246 ? 100.697 62.891 63.647 1.00 29.70 ? 266 GLU B OE2 1 +ATOM 7004 N N . ASN B 1 247 ? 97.999 61.091 58.266 1.00 22.81 ? 267 ASN B N 1 +ATOM 7005 C CA . ASN B 1 247 ? 97.434 60.793 56.936 1.00 23.29 ? 267 ASN B CA 1 +ATOM 7006 C C . ASN B 1 247 ? 98.461 60.499 55.839 1.00 22.96 ? 267 ASN B C 1 +ATOM 7007 O O . ASN B 1 247 ? 98.123 60.516 54.654 1.00 23.25 ? 267 ASN B O 1 +ATOM 7008 C CB . ASN B 1 247 ? 96.496 61.919 56.461 1.00 23.68 ? 267 ASN B CB 1 +ATOM 7009 C CG . ASN B 1 247 ? 95.332 62.133 57.387 1.00 24.89 ? 267 ASN B CG 1 +ATOM 7010 O OD1 . ASN B 1 247 ? 94.503 61.243 57.572 1.00 28.02 ? 267 ASN B OD1 1 +ATOM 7011 N ND2 . ASN B 1 247 ? 95.247 63.327 57.969 1.00 27.36 ? 267 ASN B ND2 1 +ATOM 7012 N N . LYS B 1 248 ? 99.699 60.221 56.233 1.00 22.39 ? 268 LYS B N 1 +ATOM 7013 C CA . LYS B 1 248 ? 100.758 59.932 55.285 1.00 22.25 ? 268 LYS B CA 1 +ATOM 7014 C C . LYS B 1 248 ? 100.832 58.431 55.060 1.00 21.16 ? 268 LYS B C 1 +ATOM 7015 O O . LYS B 1 248 ? 100.885 57.659 56.018 1.00 20.73 ? 268 LYS B O 1 +ATOM 7016 C CB . LYS B 1 248 ? 102.097 60.453 55.807 1.00 22.34 ? 268 LYS B CB 1 +ATOM 7017 C CG . LYS B 1 248 ? 103.255 60.316 54.816 1.00 23.50 ? 268 LYS B CG 1 +ATOM 7018 C CD . LYS B 1 248 ? 104.526 60.990 55.327 1.00 24.07 ? 268 LYS B CD 1 +ATOM 7019 C CE . LYS B 1 248 ? 105.077 60.311 56.575 1.00 25.89 ? 268 LYS B CE 1 +ATOM 7020 N NZ . LYS B 1 248 ? 106.318 60.973 57.056 1.00 27.38 ? 268 LYS B NZ 1 +ATOM 7021 N N . VAL B 1 249 ? 100.843 58.034 53.790 1.00 20.23 ? 269 VAL B N 1 +ATOM 7022 C CA . VAL B 1 249 ? 100.982 56.626 53.402 1.00 19.29 ? 269 VAL B CA 1 +ATOM 7023 C C . VAL B 1 249 ? 102.360 56.090 53.796 1.00 18.43 ? 269 VAL B C 1 +ATOM 7024 O O . VAL B 1 249 ? 103.383 56.637 53.367 1.00 19.18 ? 269 VAL B O 1 +ATOM 7025 C CB . VAL B 1 249 ? 100.809 56.445 51.883 1.00 19.50 ? 269 VAL B CB 1 +ATOM 7026 C CG1 . VAL B 1 249 ? 101.165 55.020 51.479 1.00 18.86 ? 269 VAL B CG1 1 +ATOM 7027 C CG2 . VAL B 1 249 ? 99.378 56.802 51.459 1.00 18.88 ? 269 VAL B CG2 1 +ATOM 7028 N N . VAL B 1 250 ? 102.388 55.049 54.631 1.00 16.76 ? 270 VAL B N 1 +ATOM 7029 C CA . VAL B 1 250 ? 103.656 54.454 55.095 1.00 15.94 ? 270 VAL B CA 1 +ATOM 7030 C C . VAL B 1 250 ? 103.918 53.063 54.515 1.00 15.47 ? 270 VAL B C 1 +ATOM 7031 O O . VAL B 1 250 ? 105.017 52.513 54.665 1.00 15.55 ? 270 VAL B O 1 +ATOM 7032 C CB . VAL B 1 250 ? 103.735 54.393 56.649 1.00 15.76 ? 270 VAL B CB 1 +ATOM 7033 C CG1 . VAL B 1 250 ? 103.699 55.800 57.228 1.00 15.38 ? 270 VAL B CG1 1 +ATOM 7034 C CG2 . VAL B 1 250 ? 102.606 53.533 57.239 1.00 15.67 ? 270 VAL B CG2 1 +ATOM 7035 N N . ALA B 1 251 ? 102.907 52.490 53.867 1.00 14.49 ? 271 ALA B N 1 +ATOM 7036 C CA . ALA B 1 251 ? 103.035 51.171 53.238 1.00 14.50 ? 271 ALA B CA 1 +ATOM 7037 C C . ALA B 1 251 ? 101.846 50.917 52.319 1.00 14.40 ? 271 ALA B C 1 +ATOM 7038 O O . ALA B 1 251 ? 100.761 51.461 52.537 1.00 14.28 ? 271 ALA B O 1 +ATOM 7039 C CB . ALA B 1 251 ? 103.111 50.067 54.304 1.00 14.86 ? 271 ALA B CB 1 +ATOM 7040 N N . ASN B 1 252 ? 102.041 50.103 51.288 1.00 14.09 ? 272 ASN B N 1 +ATOM 7041 C CA . ASN B 1 252 ? 100.928 49.735 50.420 1.00 14.11 ? 272 ASN B CA 1 +ATOM 7042 C C . ASN B 1 252 ? 101.140 48.388 49.750 1.00 13.63 ? 272 ASN B C 1 +ATOM 7043 O O . ASN B 1 252 ? 102.264 47.882 49.666 1.00 13.93 ? 272 ASN B O 1 +ATOM 7044 C CB . ASN B 1 252 ? 100.632 50.829 49.376 1.00 14.48 ? 272 ASN B CB 1 +ATOM 7045 C CG . ASN B 1 252 ? 101.667 50.894 48.275 1.00 16.37 ? 272 ASN B CG 1 +ATOM 7046 O OD1 . ASN B 1 252 ? 102.742 51.478 48.449 1.00 19.01 ? 272 ASN B OD1 1 +ATOM 7047 N ND2 . ASN B 1 252 ? 101.336 50.284 47.109 1.00 19.54 ? 272 ASN B ND2 1 +ATOM 7048 N N . GLY B 1 253 ? 100.040 47.818 49.281 1.00 12.64 ? 273 GLY B N 1 +ATOM 7049 C CA . GLY B 1 253 ? 100.049 46.527 48.626 1.00 12.93 ? 273 GLY B CA 1 +ATOM 7050 C C . GLY B 1 253 ? 98.783 46.338 47.824 1.00 12.70 ? 273 GLY B C 1 +ATOM 7051 O O . GLY B 1 253 ? 98.034 47.292 47.598 1.00 12.99 ? 273 GLY B O 1 +ATOM 7052 N N . THR B 1 254 ? 98.550 45.099 47.401 1.00 13.26 ? 274 THR B N 1 +ATOM 7053 C CA . THR B 1 254 ? 97.407 44.744 46.558 1.00 13.45 ? 274 THR B CA 1 +ATOM 7054 C C . THR B 1 254 ? 96.861 43.378 46.953 1.00 13.62 ? 274 THR B C 1 +ATOM 7055 O O . THR B 1 254 ? 97.418 42.697 47.821 1.00 13.15 ? 274 THR B O 1 +ATOM 7056 C CB . THR B 1 254 ? 97.795 44.672 45.056 1.00 13.98 ? 274 THR B CB 1 +ATOM 7057 O OG1 . THR B 1 254 ? 98.784 43.652 44.853 1.00 15.31 ? 274 THR B OG1 1 +ATOM 7058 C CG2 . THR B 1 254 ? 98.323 46.013 44.573 1.00 14.21 ? 274 THR B CG2 1 +ATOM 7059 N N . GLY B 1 255 ? 95.768 42.983 46.311 1.00 13.83 ? 275 GLY B N 1 +ATOM 7060 C CA . GLY B 1 255 ? 95.242 41.630 46.451 1.00 14.18 ? 275 GLY B CA 1 +ATOM 7061 C C . GLY B 1 255 ? 94.330 41.459 47.646 1.00 14.02 ? 275 GLY B C 1 +ATOM 7062 O O . GLY B 1 255 ? 94.156 42.375 48.468 1.00 15.10 ? 275 GLY B O 1 +ATOM 7063 N N . THR B 1 256 ? 93.732 40.285 47.720 1.00 13.54 ? 276 THR B N 1 +ATOM 7064 C CA . THR B 1 256 ? 92.853 39.916 48.822 1.00 13.40 ? 276 THR B CA 1 +ATOM 7065 C C . THR B 1 256 ? 93.639 39.542 50.069 1.00 13.22 ? 276 THR B C 1 +ATOM 7066 O O . THR B 1 256 ? 93.087 39.562 51.168 1.00 12.92 ? 276 THR B O 1 +ATOM 7067 C CB . THR B 1 256 ? 91.970 38.707 48.459 1.00 13.36 ? 276 THR B CB 1 +ATOM 7068 O OG1 . THR B 1 256 ? 92.811 37.589 48.135 1.00 12.74 ? 276 THR B OG1 1 +ATOM 7069 C CG2 . THR B 1 256 ? 91.054 39.038 47.293 1.00 13.29 ? 276 THR B CG2 1 +ATOM 7070 N N . GLN B 1 257 ? 94.921 39.194 49.910 1.00 13.37 ? 277 GLN B N 1 +ATOM 7071 C CA . GLN B 1 257 ? 95.728 38.809 51.059 1.00 13.28 ? 277 GLN B CA 1 +ATOM 7072 C C . GLN B 1 257 ? 97.192 39.214 50.931 1.00 12.80 ? 277 GLN B C 1 +ATOM 7073 O O . GLN B 1 257 ? 97.769 39.180 49.850 1.00 12.79 ? 277 GLN B O 1 +ATOM 7074 C CB . GLN B 1 257 ? 95.614 37.298 51.303 1.00 13.12 ? 277 GLN B CB 1 +ATOM 7075 C CG . GLN B 1 257 ? 96.087 36.432 50.132 1.00 14.23 ? 277 GLN B CG 1 +ATOM 7076 C CD . GLN B 1 257 ? 95.639 34.982 50.220 1.00 14.16 ? 277 GLN B CD 1 +ATOM 7077 O OE1 . GLN B 1 257 ? 94.580 34.669 50.773 1.00 17.24 ? 277 GLN B OE1 1 +ATOM 7078 N NE2 . GLN B 1 257 ? 96.435 34.086 49.647 1.00 16.47 ? 277 GLN B NE2 1 +ATOM 7079 N N . GLY B 1 258 ? 97.782 39.606 52.048 1.00 12.55 ? 278 GLY B N 1 +ATOM 7080 C CA . GLY B 1 258 ? 99.168 40.024 52.056 1.00 12.25 ? 278 GLY B CA 1 +ATOM 7081 C C . GLY B 1 258 ? 99.594 40.570 53.395 1.00 12.17 ? 278 GLY B C 1 +ATOM 7082 O O . GLY B 1 258 ? 98.919 40.366 54.407 1.00 11.53 ? 278 GLY B O 1 +ATOM 7083 N N . GLN B 1 259 ? 100.718 41.279 53.383 1.00 12.02 ? 279 GLN B N 1 +ATOM 7084 C CA . GLN B 1 259 ? 101.318 41.819 54.582 1.00 12.46 ? 279 GLN B CA 1 +ATOM 7085 C C . GLN B 1 259 ? 102.001 43.143 54.262 1.00 13.04 ? 279 GLN B C 1 +ATOM 7086 O O . GLN B 1 259 ? 102.775 43.228 53.303 1.00 12.83 ? 279 GLN B O 1 +ATOM 7087 C CB . GLN B 1 259 ? 102.353 40.853 55.122 1.00 12.66 ? 279 GLN B CB 1 +ATOM 7088 C CG . GLN B 1 259 ? 102.948 41.248 56.460 1.00 12.93 ? 279 GLN B CG 1 +ATOM 7089 C CD . GLN B 1 259 ? 103.981 40.250 56.916 1.00 14.92 ? 279 GLN B CD 1 +ATOM 7090 O OE1 . GLN B 1 259 ? 105.142 40.310 56.496 1.00 14.88 ? 279 GLN B OE1 1 +ATOM 7091 N NE2 . GLN B 1 259 ? 103.563 39.300 57.749 1.00 17.26 ? 279 GLN B NE2 1 +ATOM 7092 N N . LEU B 1 260 ? 101.690 44.169 55.041 1.00 13.26 ? 280 LEU B N 1 +ATOM 7093 C CA . LEU B 1 260 ? 102.364 45.456 54.909 1.00 13.38 ? 280 LEU B CA 1 +ATOM 7094 C C . LEU B 1 260 ? 103.416 45.581 56.011 1.00 13.77 ? 280 LEU B C 1 +ATOM 7095 O O . LEU B 1 260 ? 103.184 45.150 57.144 1.00 12.75 ? 280 LEU B O 1 +ATOM 7096 C CB . LEU B 1 260 ? 101.345 46.593 54.980 1.00 13.56 ? 280 LEU B CB 1 +ATOM 7097 C CG . LEU B 1 260 ? 100.197 46.514 53.973 1.00 13.24 ? 280 LEU B CG 1 +ATOM 7098 C CD1 . LEU B 1 260 ? 99.238 47.696 54.180 1.00 13.53 ? 280 LEU B CD1 1 +ATOM 7099 C CD2 . LEU B 1 260 ? 100.716 46.464 52.530 1.00 14.54 ? 280 LEU B CD2 1 +ATOM 7100 N N . LYS B 1 261 ? 104.584 46.134 55.667 1.00 13.58 ? 281 LYS B N 1 +ATOM 7101 C CA . LYS B 1 261 ? 105.654 46.348 56.641 1.00 13.78 ? 281 LYS B CA 1 +ATOM 7102 C C . LYS B 1 261 ? 105.779 47.836 56.942 1.00 14.32 ? 281 LYS B C 1 +ATOM 7103 O O . LYS B 1 261 ? 105.823 48.651 56.023 1.00 13.96 ? 281 LYS B O 1 +ATOM 7104 C CB . LYS B 1 261 ? 106.989 45.822 56.124 1.00 14.27 ? 281 LYS B CB 1 +ATOM 7105 C CG . LYS B 1 261 ? 108.017 45.640 57.232 1.00 15.37 ? 281 LYS B CG 1 +ATOM 7106 C CD . LYS B 1 261 ? 109.319 45.024 56.725 1.00 16.98 ? 281 LYS B CD 1 +ATOM 7107 C CE . LYS B 1 261 ? 110.475 45.688 56.607 0.00 21.40 ? 281 LYS B CE 1 +ATOM 7108 N NZ . LYS B 1 261 ? 111.744 44.885 56.599 0.00 22.42 ? 281 LYS B NZ 1 +ATOM 7109 N N . VAL B 1 262 ? 105.855 48.159 58.230 1.00 14.75 ? 282 VAL B N 1 +ATOM 7110 C CA . VAL B 1 262 ? 105.851 49.528 58.706 1.00 14.60 ? 282 VAL B CA 1 +ATOM 7111 C C . VAL B 1 262 ? 107.170 49.811 59.424 1.00 15.13 ? 282 VAL B C 1 +ATOM 7112 O O . VAL B 1 262 ? 107.327 49.475 60.597 1.00 13.91 ? 282 VAL B O 1 +ATOM 7113 C CB . VAL B 1 262 ? 104.679 49.767 59.684 1.00 14.97 ? 282 VAL B CB 1 +ATOM 7114 C CG1 . VAL B 1 262 ? 104.593 51.237 60.063 1.00 14.73 ? 282 VAL B CG1 1 +ATOM 7115 C CG2 . VAL B 1 262 ? 103.357 49.298 59.067 1.00 14.77 ? 282 VAL B CG2 1 +ATOM 7116 N N . PRO B 1 263 ? 108.133 50.426 58.715 1.00 15.36 ? 283 PRO B N 1 +ATOM 7117 C CA . PRO B 1 263 ? 109.402 50.690 59.377 1.00 15.79 ? 283 PRO B CA 1 +ATOM 7118 C C . PRO B 1 263 ? 109.265 51.719 60.494 1.00 15.40 ? 283 PRO B C 1 +ATOM 7119 O O . PRO B 1 263 ? 108.530 52.702 60.347 1.00 16.54 ? 283 PRO B O 1 +ATOM 7120 C CB . PRO B 1 263 ? 110.302 51.234 58.254 1.00 15.76 ? 283 PRO B CB 1 +ATOM 7121 C CG . PRO B 1 263 ? 109.557 51.090 56.996 1.00 16.40 ? 283 PRO B CG 1 +ATOM 7122 C CD . PRO B 1 263 ? 108.107 50.902 57.323 1.00 16.13 ? 283 PRO B CD 1 +ATOM 7123 N N . GLY B 1 264 ? 109.991 51.504 61.587 1.00 15.51 ? 284 GLY B N 1 +ATOM 7124 C CA . GLY B 1 264 ? 110.003 52.440 62.702 1.00 15.17 ? 284 GLY B CA 1 +ATOM 7125 C C . GLY B 1 264 ? 108.596 52.681 63.197 1.00 14.47 ? 284 GLY B C 1 +ATOM 7126 O O . GLY B 1 264 ? 108.161 53.816 63.342 1.00 15.17 ? 284 GLY B O 1 +ATOM 7127 N N . VAL B 1 265 ? 107.892 51.587 63.448 1.00 13.57 ? 285 VAL B N 1 +ATOM 7128 C CA . VAL B 1 265 ? 106.470 51.638 63.736 1.00 12.89 ? 285 VAL B CA 1 +ATOM 7129 C C . VAL B 1 265 ? 106.201 52.318 65.078 1.00 12.55 ? 285 VAL B C 1 +ATOM 7130 O O . VAL B 1 265 ? 107.042 52.312 65.979 1.00 12.26 ? 285 VAL B O 1 +ATOM 7131 C CB . VAL B 1 265 ? 105.863 50.213 63.726 1.00 13.06 ? 285 VAL B CB 1 +ATOM 7132 C CG1 . VAL B 1 265 ? 106.477 49.357 64.841 1.00 12.05 ? 285 VAL B CG1 1 +ATOM 7133 C CG2 . VAL B 1 265 ? 104.323 50.249 63.796 1.00 12.14 ? 285 VAL B CG2 1 +ATOM 7134 N N . SER B 1 266 ? 105.014 52.898 65.189 1.00 11.92 ? 286 SER B N 1 +ATOM 7135 C CA . SER B 1 266 ? 104.479 53.355 66.452 1.00 12.01 ? 286 SER B CA 1 +ATOM 7136 C C . SER B 1 266 ? 103.461 52.299 66.916 1.00 12.04 ? 286 SER B C 1 +ATOM 7137 O O . SER B 1 266 ? 102.365 52.207 66.362 1.00 11.99 ? 286 SER B O 1 +ATOM 7138 C CB . SER B 1 266 ? 103.813 54.724 66.277 1.00 12.31 ? 286 SER B CB 1 +ATOM 7139 O OG . SER B 1 266 ? 104.780 55.737 66.010 1.00 13.05 ? 286 SER B OG 1 +ATOM 7140 N N . LEU B 1 267 ? 103.840 51.502 67.916 1.00 11.55 ? 287 LEU B N 1 +ATOM 7141 C CA . LEU B 1 267 ? 102.937 50.485 68.469 1.00 11.43 ? 287 LEU B CA 1 +ATOM 7142 C C . LEU B 1 267 ? 101.737 51.130 69.171 1.00 10.79 ? 287 LEU B C 1 +ATOM 7143 O O . LEU B 1 267 ? 101.823 52.258 69.655 1.00 10.24 ? 287 LEU B O 1 +ATOM 7144 C CB . LEU B 1 267 ? 103.674 49.572 69.453 1.00 11.59 ? 287 LEU B CB 1 +ATOM 7145 C CG . LEU B 1 267 ? 104.859 48.762 68.911 1.00 12.40 ? 287 LEU B CG 1 +ATOM 7146 C CD1 . LEU B 1 267 ? 105.308 47.710 69.938 1.00 11.82 ? 287 LEU B CD1 1 +ATOM 7147 C CD2 . LEU B 1 267 ? 104.514 48.081 67.615 1.00 12.74 ? 287 LEU B CD2 1 +ATOM 7148 N N . TRP B 1 268 ? 100.622 50.405 69.184 1.00 10.36 ? 288 TRP B N 1 +ATOM 7149 C CA . TRP B 1 268 ? 99.443 50.787 69.958 1.00 10.31 ? 288 TRP B CA 1 +ATOM 7150 C C . TRP B 1 268 ? 99.694 50.368 71.406 1.00 10.81 ? 288 TRP B C 1 +ATOM 7151 O O . TRP B 1 268 ? 99.880 49.168 71.686 1.00 11.03 ? 288 TRP B O 1 +ATOM 7152 C CB . TRP B 1 268 ? 98.207 50.074 69.365 1.00 10.13 ? 288 TRP B CB 1 +ATOM 7153 C CG . TRP B 1 268 ? 96.859 50.475 69.930 1.00 9.82 ? 288 TRP B CG 1 +ATOM 7154 C CD1 . TRP B 1 268 ? 95.964 51.330 69.358 1.00 10.79 ? 288 TRP B CD1 1 +ATOM 7155 C CD2 . TRP B 1 268 ? 96.243 50.003 71.142 1.00 9.19 ? 288 TRP B CD2 1 +ATOM 7156 N NE1 . TRP B 1 268 ? 94.843 51.444 70.144 1.00 10.69 ? 288 TRP B NE1 1 +ATOM 7157 C CE2 . TRP B 1 268 ? 94.990 50.644 71.248 1.00 9.93 ? 288 TRP B CE2 1 +ATOM 7158 C CE3 . TRP B 1 268 ? 96.634 49.123 72.160 1.00 11.33 ? 288 TRP B CE3 1 +ATOM 7159 C CZ2 . TRP B 1 268 ? 94.135 50.435 72.327 1.00 10.66 ? 288 TRP B CZ2 1 +ATOM 7160 C CZ3 . TRP B 1 268 ? 95.767 48.905 73.220 1.00 10.22 ? 288 TRP B CZ3 1 +ATOM 7161 C CH2 . TRP B 1 268 ? 94.534 49.559 73.295 1.00 9.78 ? 288 TRP B CH2 1 +ATOM 7162 N N . TRP B 1 269 ? 99.723 51.332 72.328 1.00 11.53 ? 289 TRP B N 1 +ATOM 7163 C CA . TRP B 1 269 ? 99.854 51.022 73.759 1.00 11.70 ? 289 TRP B CA 1 +ATOM 7164 C C . TRP B 1 269 ? 98.605 51.422 74.527 1.00 11.75 ? 289 TRP B C 1 +ATOM 7165 O O . TRP B 1 269 ? 98.003 52.470 74.239 1.00 10.99 ? 289 TRP B O 1 +ATOM 7166 C CB . TRP B 1 269 ? 101.031 51.750 74.391 1.00 13.07 ? 289 TRP B CB 1 +ATOM 7167 C CG . TRP B 1 269 ? 102.367 51.360 73.850 1.00 13.46 ? 289 TRP B CG 1 +ATOM 7168 C CD1 . TRP B 1 269 ? 103.086 52.020 72.905 1.00 15.77 ? 289 TRP B CD1 1 +ATOM 7169 C CD2 . TRP B 1 269 ? 103.156 50.230 74.244 1.00 14.92 ? 289 TRP B CD2 1 +ATOM 7170 N NE1 . TRP B 1 269 ? 104.274 51.365 72.666 1.00 14.73 ? 289 TRP B NE1 1 +ATOM 7171 C CE2 . TRP B 1 269 ? 104.343 50.262 73.473 1.00 16.05 ? 289 TRP B CE2 1 +ATOM 7172 C CE3 . TRP B 1 269 ? 102.970 49.182 75.157 1.00 15.23 ? 289 TRP B CE3 1 +ATOM 7173 C CZ2 . TRP B 1 269 ? 105.345 49.296 73.598 1.00 15.40 ? 289 TRP B CZ2 1 +ATOM 7174 C CZ3 . TRP B 1 269 ? 103.971 48.212 75.281 1.00 14.89 ? 289 TRP B CZ3 1 +ATOM 7175 C CH2 . TRP B 1 269 ? 105.143 48.280 74.500 1.00 15.52 ? 289 TRP B CH2 1 +ATOM 7176 N N . PRO B 1 270 ? 98.225 50.609 75.519 1.00 10.91 ? 290 PRO B N 1 +ATOM 7177 C CA . PRO B 1 270 ? 97.164 51.010 76.443 1.00 10.64 ? 290 PRO B CA 1 +ATOM 7178 C C . PRO B 1 270 ? 97.412 52.348 77.125 1.00 10.48 ? 290 PRO B C 1 +ATOM 7179 O O . PRO B 1 270 ? 98.558 52.744 77.336 1.00 11.01 ? 290 PRO B O 1 +ATOM 7180 C CB . PRO B 1 270 ? 97.168 49.897 77.490 1.00 10.32 ? 290 PRO B CB 1 +ATOM 7181 C CG . PRO B 1 270 ? 97.684 48.705 76.781 1.00 10.76 ? 290 PRO B CG 1 +ATOM 7182 C CD . PRO B 1 270 ? 98.705 49.239 75.802 1.00 10.80 ? 290 PRO B CD 1 +ATOM 7183 N N . TYR B 1 271 ? 96.323 53.037 77.455 1.00 10.55 ? 291 TYR B N 1 +ATOM 7184 C CA . TYR B 1 271 ? 96.364 54.232 78.287 1.00 10.20 ? 291 TYR B CA 1 +ATOM 7185 C C . TYR B 1 271 ? 97.240 53.992 79.528 1.00 10.82 ? 291 TYR B C 1 +ATOM 7186 O O . TYR B 1 271 ? 97.105 52.964 80.204 1.00 10.36 ? 291 TYR B O 1 +ATOM 7187 C CB . TYR B 1 271 ? 94.930 54.592 78.693 1.00 10.16 ? 291 TYR B CB 1 +ATOM 7188 C CG . TYR B 1 271 ? 94.776 55.755 79.633 1.00 9.46 ? 291 TYR B CG 1 +ATOM 7189 C CD1 . TYR B 1 271 ? 95.338 57.000 79.346 1.00 9.38 ? 291 TYR B CD1 1 +ATOM 7190 C CD2 . TYR B 1 271 ? 94.031 55.624 80.805 1.00 7.95 ? 291 TYR B CD2 1 +ATOM 7191 C CE1 . TYR B 1 271 ? 95.191 58.073 80.222 1.00 10.04 ? 291 TYR B CE1 1 +ATOM 7192 C CE2 . TYR B 1 271 ? 93.873 56.678 81.675 1.00 8.75 ? 291 TYR B CE2 1 +ATOM 7193 C CZ . TYR B 1 271 ? 94.459 57.899 81.391 1.00 9.35 ? 291 TYR B CZ 1 +ATOM 7194 O OH . TYR B 1 271 ? 94.289 58.948 82.265 1.00 8.81 ? 291 TYR B OH 1 +ATOM 7195 N N . LEU B 1 272 ? 98.143 54.941 79.778 1.00 11.84 ? 292 LEU B N 1 +ATOM 7196 C CA . LEU B 1 272 ? 99.079 54.938 80.919 1.00 12.62 ? 292 LEU B CA 1 +ATOM 7197 C C . LEU B 1 272 ? 100.233 53.937 80.840 1.00 13.66 ? 292 LEU B C 1 +ATOM 7198 O O . LEU B 1 272 ? 101.086 53.921 81.737 1.00 13.63 ? 292 LEU B O 1 +ATOM 7199 C CB . LEU B 1 272 ? 98.338 54.811 82.264 1.00 12.91 ? 292 LEU B CB 1 +ATOM 7200 C CG . LEU B 1 272 ? 97.358 55.945 82.545 1.00 11.80 ? 292 LEU B CG 1 +ATOM 7201 C CD1 . LEU B 1 272 ? 96.742 55.793 83.937 1.00 11.89 ? 292 LEU B CD1 1 +ATOM 7202 C CD2 . LEU B 1 272 ? 98.038 57.306 82.377 1.00 11.75 ? 292 LEU B CD2 1 +ATOM 7203 N N . MET B 1 273 ? 100.282 53.133 79.773 1.00 14.46 ? 293 MET B N 1 +ATOM 7204 C CA . MET B 1 273 ? 101.422 52.257 79.518 1.00 15.41 ? 293 MET B CA 1 +ATOM 7205 C C . MET B 1 273 ? 102.498 52.956 78.663 1.00 15.86 ? 293 MET B C 1 +ATOM 7206 O O . MET B 1 273 ? 103.644 52.491 78.586 1.00 16.24 ? 293 MET B O 1 +ATOM 7207 C CB . MET B 1 273 ? 100.949 50.957 78.856 1.00 15.47 ? 293 MET B CB 1 +ATOM 7208 C CG . MET B 1 273 ? 101.936 49.817 78.977 1.00 16.18 ? 293 MET B CG 1 +ATOM 7209 S SD . MET B 1 273 ? 101.309 48.226 78.421 1.00 16.79 ? 293 MET B SD 1 +ATOM 7210 C CE . MET B 1 273 ? 102.687 47.187 78.895 1.00 15.99 ? 293 MET B CE 1 +ATOM 7211 N N . HIS B 1 274 ? 102.121 54.054 78.011 1.00 16.91 ? 294 HIS B N 1 +ATOM 7212 C CA . HIS B 1 274 ? 103.028 54.827 77.150 1.00 17.68 ? 294 HIS B CA 1 +ATOM 7213 C C . HIS B 1 274 ? 102.524 56.272 77.081 1.00 18.23 ? 294 HIS B C 1 +ATOM 7214 O O . HIS B 1 274 ? 101.319 56.510 77.106 1.00 17.46 ? 294 HIS B O 1 +ATOM 7215 C CB . HIS B 1 274 ? 103.095 54.195 75.754 1.00 18.04 ? 294 HIS B CB 1 +ATOM 7216 C CG . HIS B 1 274 ? 104.175 54.755 74.877 1.00 19.38 ? 294 HIS B CG 1 +ATOM 7217 N ND1 . HIS B 1 274 ? 104.124 56.027 74.348 1.00 20.64 ? 294 HIS B ND1 1 +ATOM 7218 C CD2 . HIS B 1 274 ? 105.324 54.206 74.420 1.00 20.97 ? 294 HIS B CD2 1 +ATOM 7219 C CE1 . HIS B 1 274 ? 105.206 56.245 73.618 1.00 21.19 ? 294 HIS B CE1 1 +ATOM 7220 N NE2 . HIS B 1 274 ? 105.944 55.151 73.638 1.00 21.54 ? 294 HIS B NE2 1 +ATOM 7221 N N . GLU B 1 275 ? 103.445 57.234 77.009 1.00 18.82 ? 295 GLU B N 1 +ATOM 7222 C CA . GLU B 1 275 ? 103.093 58.661 77.062 1.00 19.66 ? 295 GLU B CA 1 +ATOM 7223 C C . GLU B 1 275 ? 102.223 59.109 75.875 1.00 19.27 ? 295 GLU B C 1 +ATOM 7224 O O . GLU B 1 275 ? 101.483 60.091 75.973 1.00 20.36 ? 295 GLU B O 1 +ATOM 7225 C CB . GLU B 1 275 ? 104.362 59.518 77.142 1.00 20.16 ? 295 GLU B CB 1 +ATOM 7226 C CG . GLU B 1 275 ? 104.185 60.861 77.882 1.00 22.61 ? 295 GLU B CG 1 +ATOM 7227 C CD . GLU B 1 275 ? 105.465 61.324 78.562 1.00 25.68 ? 295 GLU B CD 1 +ATOM 7228 O OE1 . GLU B 1 275 ? 106.524 61.322 77.894 1.00 27.68 ? 295 GLU B OE1 1 +ATOM 7229 O OE2 . GLU B 1 275 ? 105.416 61.687 79.766 1.00 28.64 ? 295 GLU B OE2 1 +ATOM 7230 N N . ARG B 1 276 ? 102.333 58.387 74.758 1.00 18.85 ? 296 ARG B N 1 +ATOM 7231 C CA . ARG B 1 276 ? 101.484 58.575 73.582 1.00 18.38 ? 296 ARG B CA 1 +ATOM 7232 C C . ARG B 1 276 ? 100.764 57.243 73.309 1.00 16.37 ? 296 ARG B C 1 +ATOM 7233 O O . ARG B 1 276 ? 101.204 56.441 72.474 1.00 16.08 ? 296 ARG B O 1 +ATOM 7234 C CB . ARG B 1 276 ? 102.334 58.970 72.368 1.00 18.33 ? 296 ARG B CB 1 +ATOM 7235 C CG . ARG B 1 276 ? 103.077 60.311 72.471 1.00 20.57 ? 296 ARG B CG 1 +ATOM 7236 C CD . ARG B 1 276 ? 104.090 60.456 71.321 1.00 21.50 ? 296 ARG B CD 1 +ATOM 7237 N NE . ARG B 1 276 ? 104.659 61.807 71.198 1.00 24.64 ? 296 ARG B NE 1 +ATOM 7238 C CZ . ARG B 1 276 ? 105.963 62.112 71.178 1.00 25.53 ? 296 ARG B CZ 1 +ATOM 7239 N NH1 . ARG B 1 276 ? 106.900 61.170 71.260 1.00 28.27 ? 296 ARG B NH1 1 +ATOM 7240 N NH2 . ARG B 1 276 ? 106.340 63.385 71.057 1.00 26.58 ? 296 ARG B NH2 1 +ATOM 7241 N N . PRO B 1 277 ? 99.669 56.979 74.040 1.00 14.05 ? 297 PRO B N 1 +ATOM 7242 C CA . PRO B 1 277 ? 98.974 55.699 73.888 1.00 12.56 ? 297 PRO B CA 1 +ATOM 7243 C C . PRO B 1 277 ? 98.052 55.646 72.674 1.00 11.59 ? 297 PRO B C 1 +ATOM 7244 O O . PRO B 1 277 ? 97.784 56.671 72.033 1.00 11.32 ? 297 PRO B O 1 +ATOM 7245 C CB . PRO B 1 277 ? 98.141 55.612 75.171 1.00 12.32 ? 297 PRO B CB 1 +ATOM 7246 C CG . PRO B 1 277 ? 97.795 57.061 75.464 1.00 13.45 ? 297 PRO B CG 1 +ATOM 7247 C CD . PRO B 1 277 ? 99.024 57.846 75.044 1.00 13.89 ? 297 PRO B CD 1 +ATOM 7248 N N . ALA B 1 278 ? 97.572 54.446 72.364 1.00 10.71 ? 298 ALA B N 1 +ATOM 7249 C CA . ALA B 1 278 ? 96.496 54.254 71.399 1.00 10.03 ? 298 ALA B CA 1 +ATOM 7250 C C . ALA B 1 278 ? 96.816 54.754 69.967 1.00 9.60 ? 298 ALA B C 1 +ATOM 7251 O O . ALA B 1 278 ? 95.935 55.195 69.258 1.00 9.31 ? 298 ALA B O 1 +ATOM 7252 C CB . ALA B 1 278 ? 95.215 54.932 71.919 1.00 10.56 ? 298 ALA B CB 1 +ATOM 7253 N N . TYR B 1 279 ? 98.076 54.696 69.552 1.00 9.59 ? 299 TYR B N 1 +ATOM 7254 C CA . TYR B 1 279 ? 98.431 55.137 68.205 1.00 9.39 ? 299 TYR B CA 1 +ATOM 7255 C C . TYR B 1 279 ? 97.705 54.281 67.187 1.00 9.44 ? 299 TYR B C 1 +ATOM 7256 O O . TYR B 1 279 ? 97.832 53.057 67.220 1.00 9.43 ? 299 TYR B O 1 +ATOM 7257 C CB . TYR B 1 279 ? 99.939 55.043 67.983 1.00 9.78 ? 299 TYR B CB 1 +ATOM 7258 C CG . TYR B 1 279 ? 100.374 55.727 66.717 1.00 9.43 ? 299 TYR B CG 1 +ATOM 7259 C CD1 . TYR B 1 279 ? 100.174 55.130 65.479 1.00 10.78 ? 299 TYR B CD1 1 +ATOM 7260 C CD2 . TYR B 1 279 ? 100.965 56.981 66.753 1.00 10.96 ? 299 TYR B CD2 1 +ATOM 7261 C CE1 . TYR B 1 279 ? 100.554 55.758 64.308 1.00 10.95 ? 299 TYR B CE1 1 +ATOM 7262 C CE2 . TYR B 1 279 ? 101.346 57.613 65.592 1.00 10.80 ? 299 TYR B CE2 1 +ATOM 7263 C CZ . TYR B 1 279 ? 101.138 56.990 64.369 1.00 11.09 ? 299 TYR B CZ 1 +ATOM 7264 O OH . TYR B 1 279 ? 101.505 57.607 63.200 1.00 11.82 ? 299 TYR B OH 1 +ATOM 7265 N N . LEU B 1 280 ? 96.916 54.921 66.320 1.00 9.33 ? 300 LEU B N 1 +ATOM 7266 C CA . LEU B 1 280 ? 96.207 54.224 65.249 1.00 9.36 ? 300 LEU B CA 1 +ATOM 7267 C C . LEU B 1 280 ? 96.684 54.672 63.873 1.00 9.60 ? 300 LEU B C 1 +ATOM 7268 O O . LEU B 1 280 ? 96.744 55.882 63.579 1.00 9.79 ? 300 LEU B O 1 +ATOM 7269 C CB . LEU B 1 280 ? 94.694 54.461 65.353 1.00 8.90 ? 300 LEU B CB 1 +ATOM 7270 C CG . LEU B 1 280 ? 93.984 53.806 66.548 1.00 7.98 ? 300 LEU B CG 1 +ATOM 7271 C CD1 . LEU B 1 280 ? 92.578 54.382 66.750 1.00 8.04 ? 300 LEU B CD1 1 +ATOM 7272 C CD2 . LEU B 1 280 ? 93.918 52.302 66.379 1.00 8.35 ? 300 LEU B CD2 1 +ATOM 7273 N N . TYR B 1 281 ? 97.056 53.688 63.061 1.00 9.84 ? 301 TYR B N 1 +ATOM 7274 C CA . TYR B 1 281 ? 97.169 53.834 61.609 1.00 10.02 ? 301 TYR B CA 1 +ATOM 7275 C C . TYR B 1 281 ? 95.775 53.644 61.032 1.00 10.81 ? 301 TYR B C 1 +ATOM 7276 O O . TYR B 1 281 ? 94.822 53.332 61.764 1.00 10.60 ? 301 TYR B O 1 +ATOM 7277 C CB . TYR B 1 281 ? 98.107 52.762 61.023 1.00 9.70 ? 301 TYR B CB 1 +ATOM 7278 C CG . TYR B 1 281 ? 99.540 52.914 61.462 1.00 9.70 ? 301 TYR B CG 1 +ATOM 7279 C CD1 . TYR B 1 281 ? 100.465 53.566 60.651 1.00 9.03 ? 301 TYR B CD1 1 +ATOM 7280 C CD2 . TYR B 1 281 ? 99.971 52.424 62.694 1.00 9.04 ? 301 TYR B CD2 1 +ATOM 7281 C CE1 . TYR B 1 281 ? 101.782 53.717 61.050 1.00 9.76 ? 301 TYR B CE1 1 +ATOM 7282 C CE2 . TYR B 1 281 ? 101.303 52.591 63.112 1.00 9.51 ? 301 TYR B CE2 1 +ATOM 7283 C CZ . TYR B 1 281 ? 102.194 53.234 62.278 1.00 9.21 ? 301 TYR B CZ 1 +ATOM 7284 O OH . TYR B 1 281 ? 103.505 53.407 62.658 1.00 9.95 ? 301 TYR B OH 1 +ATOM 7285 N N . SER B 1 282 ? 95.636 53.829 59.727 1.00 11.74 ? 302 SER B N 1 +ATOM 7286 C CA . SER B 1 282 ? 94.400 53.463 59.060 1.00 12.83 ? 302 SER B CA 1 +ATOM 7287 C C . SER B 1 282 ? 94.693 52.684 57.793 1.00 13.28 ? 302 SER B C 1 +ATOM 7288 O O . SER B 1 282 ? 95.590 53.060 57.019 1.00 13.57 ? 302 SER B O 1 +ATOM 7289 C CB . SER B 1 282 ? 93.518 54.682 58.792 1.00 13.47 ? 302 SER B CB 1 +ATOM 7290 O OG . SER B 1 282 ? 94.194 55.685 58.073 1.00 15.15 ? 302 SER B OG 1 +ATOM 7291 N N . LEU B 1 283 ? 93.969 51.570 57.620 1.00 12.68 ? 303 LEU B N 1 +ATOM 7292 C CA . LEU B 1 283 ? 94.050 50.760 56.416 1.00 12.57 ? 303 LEU B CA 1 +ATOM 7293 C C . LEU B 1 283 ? 92.980 51.195 55.403 1.00 12.65 ? 303 LEU B C 1 +ATOM 7294 O O . LEU B 1 283 ? 91.796 50.935 55.603 1.00 12.47 ? 303 LEU B O 1 +ATOM 7295 C CB . LEU B 1 283 ? 93.886 49.278 56.769 1.00 12.62 ? 303 LEU B CB 1 +ATOM 7296 C CG . LEU B 1 283 ? 94.034 48.254 55.644 1.00 13.24 ? 303 LEU B CG 1 +ATOM 7297 C CD1 . LEU B 1 283 ? 95.469 48.234 55.148 1.00 12.83 ? 303 LEU B CD1 1 +ATOM 7298 C CD2 . LEU B 1 283 ? 93.626 46.884 56.145 1.00 13.42 ? 303 LEU B CD2 1 +ATOM 7299 N N . GLU B 1 284 ? 93.405 51.875 54.338 1.00 12.37 ? 304 GLU B N 1 +ATOM 7300 C CA . GLU B 1 284 ? 92.504 52.276 53.263 1.00 13.05 ? 304 GLU B CA 1 +ATOM 7301 C C . GLU B 1 284 ? 92.464 51.223 52.165 1.00 12.85 ? 304 GLU B C 1 +ATOM 7302 O O . GLU B 1 284 ? 93.485 50.966 51.510 1.00 13.02 ? 304 GLU B O 1 +ATOM 7303 C CB . GLU B 1 284 ? 92.948 53.611 52.685 1.00 13.36 ? 304 GLU B CB 1 +ATOM 7304 C CG . GLU B 1 284 ? 92.067 54.163 51.599 1.00 16.68 ? 304 GLU B CG 1 +ATOM 7305 C CD . GLU B 1 284 ? 92.609 55.485 51.078 1.00 21.37 ? 304 GLU B CD 1 +ATOM 7306 O OE1 . GLU B 1 284 ? 92.831 56.405 51.907 1.00 23.49 ? 304 GLU B OE1 1 +ATOM 7307 O OE2 . GLU B 1 284 ? 92.837 55.592 49.851 1.00 25.40 ? 304 GLU B OE2 1 +ATOM 7308 N N . VAL B 1 285 ? 91.287 50.645 51.957 1.00 12.62 ? 305 VAL B N 1 +ATOM 7309 C CA . VAL B 1 285 ? 91.087 49.562 50.993 1.00 12.40 ? 305 VAL B CA 1 +ATOM 7310 C C . VAL B 1 285 ? 90.320 50.106 49.803 1.00 12.96 ? 305 VAL B C 1 +ATOM 7311 O O . VAL B 1 285 ? 89.204 50.612 49.967 1.00 13.18 ? 305 VAL B O 1 +ATOM 7312 C CB . VAL B 1 285 ? 90.273 48.411 51.602 1.00 12.12 ? 305 VAL B CB 1 +ATOM 7313 C CG1 . VAL B 1 285 ? 90.097 47.280 50.579 1.00 12.04 ? 305 VAL B CG1 1 +ATOM 7314 C CG2 . VAL B 1 285 ? 90.941 47.909 52.864 1.00 12.91 ? 305 VAL B CG2 1 +ATOM 7315 N N . GLN B 1 286 ? 90.906 50.001 48.614 1.00 12.86 ? 306 GLN B N 1 +ATOM 7316 C CA . GLN B 1 286 ? 90.269 50.512 47.405 1.00 14.05 ? 306 GLN B CA 1 +ATOM 7317 C C . GLN B 1 286 ? 90.001 49.378 46.436 1.00 14.17 ? 306 GLN B C 1 +ATOM 7318 O O . GLN B 1 286 ? 90.931 48.751 45.935 1.00 14.24 ? 306 GLN B O 1 +ATOM 7319 C CB . GLN B 1 286 ? 91.126 51.590 46.739 1.00 14.27 ? 306 GLN B CB 1 +ATOM 7320 C CG . GLN B 1 286 ? 90.616 51.997 45.368 1.00 14.84 ? 306 GLN B CG 1 +ATOM 7321 C CD . GLN B 1 286 ? 91.312 53.229 44.798 1.00 15.10 ? 306 GLN B CD 1 +ATOM 7322 O OE1 . GLN B 1 286 ? 92.239 53.772 45.392 1.00 19.17 ? 306 GLN B OE1 1 +ATOM 7323 N NE2 . GLN B 1 286 ? 90.857 53.667 43.625 1.00 19.40 ? 306 GLN B NE2 1 +ATOM 7324 N N . LEU B 1 287 ? 88.726 49.126 46.170 1.00 14.49 ? 307 LEU B N 1 +ATOM 7325 C CA . LEU B 1 287 ? 88.305 48.065 45.256 1.00 15.15 ? 307 LEU B CA 1 +ATOM 7326 C C . LEU B 1 287 ? 87.993 48.697 43.905 1.00 16.33 ? 307 LEU B C 1 +ATOM 7327 O O . LEU B 1 287 ? 87.316 49.730 43.849 1.00 15.87 ? 307 LEU B O 1 +ATOM 7328 C CB . LEU B 1 287 ? 87.051 47.362 45.801 1.00 15.43 ? 307 LEU B CB 1 +ATOM 7329 C CG . LEU B 1 287 ? 86.395 46.296 44.913 1.00 14.81 ? 307 LEU B CG 1 +ATOM 7330 C CD1 . LEU B 1 287 ? 87.305 45.096 44.784 1.00 14.57 ? 307 LEU B CD1 1 +ATOM 7331 C CD2 . LEU B 1 287 ? 85.022 45.890 45.435 1.00 15.88 ? 307 LEU B CD2 1 +ATOM 7332 N N . THR B 1 288 ? 88.500 48.097 42.823 1.00 17.45 ? 308 THR B N 1 +ATOM 7333 C CA . THR B 1 288 ? 88.059 48.446 41.474 1.00 18.62 ? 308 THR B CA 1 +ATOM 7334 C C . THR B 1 288 ? 87.548 47.151 40.833 1.00 19.26 ? 308 THR B C 1 +ATOM 7335 O O . THR B 1 288 ? 88.305 46.195 40.686 1.00 18.93 ? 308 THR B O 1 +ATOM 7336 C CB . THR B 1 288 ? 89.194 49.058 40.621 1.00 18.72 ? 308 THR B CB 1 +ATOM 7337 O OG1 . THR B 1 288 ? 89.845 50.114 41.340 1.00 18.82 ? 308 THR B OG1 1 +ATOM 7338 C CG2 . THR B 1 288 ? 88.638 49.616 39.305 1.00 19.46 ? 308 THR B CG2 1 +ATOM 7339 N N . ALA B 1 289 ? 86.268 47.121 40.471 1.00 20.43 ? 309 ALA B N 1 +ATOM 7340 C CA . ALA B 1 289 ? 85.639 45.897 39.980 1.00 21.88 ? 309 ALA B CA 1 +ATOM 7341 C C . ALA B 1 289 ? 84.967 46.114 38.637 1.00 23.44 ? 309 ALA B C 1 +ATOM 7342 O O . ALA B 1 289 ? 84.530 47.232 38.317 1.00 23.08 ? 309 ALA B O 1 +ATOM 7343 C CB . ALA B 1 289 ? 84.630 45.394 40.990 1.00 21.51 ? 309 ALA B CB 1 +ATOM 7344 N N . GLN B 1 290 ? 84.898 45.047 37.843 1.00 25.15 ? 310 GLN B N 1 +ATOM 7345 C CA . GLN B 1 290 ? 84.157 45.090 36.588 1.00 26.65 ? 310 GLN B CA 1 +ATOM 7346 C C . GLN B 1 290 ? 82.773 44.484 36.834 1.00 27.28 ? 310 GLN B C 1 +ATOM 7347 O O . GLN B 1 290 ? 82.657 43.334 37.283 1.00 26.99 ? 310 GLN B O 1 +ATOM 7348 C CB . GLN B 1 290 ? 84.903 44.348 35.468 1.00 26.99 ? 310 GLN B CB 1 +ATOM 7349 C CG . GLN B 1 290 ? 86.402 44.664 35.360 1.00 28.06 ? 310 GLN B CG 1 +ATOM 7350 C CD . GLN B 1 290 ? 86.725 46.150 35.171 1.00 29.01 ? 310 GLN B CD 1 +ATOM 7351 O OE1 . GLN B 1 290 ? 87.803 46.616 35.554 1.00 30.11 ? 310 GLN B OE1 1 +ATOM 7352 N NE2 . GLN B 1 290 ? 85.801 46.890 34.572 1.00 30.29 ? 310 GLN B NE2 1 +ATOM 7353 N N . THR B 1 291 ? 81.730 45.278 36.579 1.00 28.17 ? 311 THR B N 1 +ATOM 7354 C CA . THR B 1 291 ? 80.347 44.840 36.777 1.00 28.83 ? 311 THR B CA 1 +ATOM 7355 C C . THR B 1 291 ? 79.584 44.888 35.452 1.00 29.47 ? 311 THR B C 1 +ATOM 7356 O O . THR B 1 291 ? 80.093 45.407 34.450 1.00 29.67 ? 311 THR B O 1 +ATOM 7357 C CB . THR B 1 291 ? 79.611 45.683 37.853 1.00 29.11 ? 311 THR B CB 1 +ATOM 7358 O OG1 . THR B 1 291 ? 79.040 46.856 37.266 1.00 29.35 ? 311 THR B OG1 1 +ATOM 7359 C CG2 . THR B 1 291 ? 80.557 46.080 38.979 1.00 28.95 ? 311 THR B CG2 1 +ATOM 7360 N N . SER B 1 292 ? 78.370 44.342 35.456 1.00 29.96 ? 312 SER B N 1 +ATOM 7361 C CA . SER B 1 292 ? 77.530 44.281 34.252 1.00 30.36 ? 312 SER B CA 1 +ATOM 7362 C C . SER B 1 292 ? 76.977 45.654 33.866 1.00 30.58 ? 312 SER B C 1 +ATOM 7363 O O . SER B 1 292 ? 76.442 45.827 32.767 1.00 30.91 ? 312 SER B O 1 +ATOM 7364 C CB . SER B 1 292 ? 76.370 43.303 34.459 1.00 30.32 ? 312 SER B CB 1 +ATOM 7365 O OG . SER B 1 292 ? 75.401 43.838 35.345 1.00 30.41 ? 312 SER B OG 1 +ATOM 7366 N N . LEU B 1 293 ? 77.079 46.607 34.792 1.00 30.68 ? 313 LEU B N 1 +ATOM 7367 C CA . LEU B 1 293 ? 76.720 48.003 34.561 1.00 30.56 ? 313 LEU B CA 1 +ATOM 7368 C C . LEU B 1 293 ? 77.983 48.877 34.543 1.00 30.26 ? 313 LEU B C 1 +ATOM 7369 O O . LEU B 1 293 ? 77.909 50.090 34.761 1.00 30.82 ? 313 LEU B O 1 +ATOM 7370 C CB . LEU B 1 293 ? 75.746 48.473 35.650 1.00 30.65 ? 313 LEU B CB 1 +ATOM 7371 C CG . LEU B 1 293 ? 74.250 48.180 35.463 1.00 30.90 ? 313 LEU B CG 1 +ATOM 7372 C CD1 . LEU B 1 293 ? 73.986 46.823 34.824 1.00 31.78 ? 313 LEU B CD1 1 +ATOM 7373 C CD2 . LEU B 1 293 ? 73.517 48.287 36.793 1.00 30.81 ? 313 LEU B CD2 1 +ATOM 7374 N N . GLY B 1 294 ? 79.136 48.253 34.286 1.00 29.64 ? 314 GLY B N 1 +ATOM 7375 C CA . GLY B 1 294 ? 80.411 48.961 34.114 1.00 29.22 ? 314 GLY B CA 1 +ATOM 7376 C C . GLY B 1 294 ? 81.327 48.955 35.333 1.00 28.49 ? 314 GLY B C 1 +ATOM 7377 O O . GLY B 1 294 ? 80.972 48.408 36.378 1.00 28.89 ? 314 GLY B O 1 +ATOM 7378 N N . PRO B 1 295 ? 82.528 49.554 35.203 1.00 27.72 ? 315 PRO B N 1 +ATOM 7379 C CA . PRO B 1 295 ? 83.467 49.660 36.328 1.00 26.80 ? 315 PRO B CA 1 +ATOM 7380 C C . PRO B 1 295 ? 82.896 50.381 37.550 1.00 25.73 ? 315 PRO B C 1 +ATOM 7381 O O . PRO B 1 295 ? 82.134 51.334 37.406 1.00 25.28 ? 315 PRO B O 1 +ATOM 7382 C CB . PRO B 1 295 ? 84.631 50.468 35.745 1.00 26.83 ? 315 PRO B CB 1 +ATOM 7383 C CG . PRO B 1 295 ? 84.542 50.255 34.277 1.00 27.73 ? 315 PRO B CG 1 +ATOM 7384 C CD . PRO B 1 295 ? 83.087 50.139 33.971 1.00 27.74 ? 315 PRO B CD 1 +ATOM 7385 N N . VAL B 1 296 ? 83.261 49.907 38.739 1.00 24.40 ? 316 VAL B N 1 +ATOM 7386 C CA . VAL B 1 296 ? 82.864 50.548 39.991 1.00 23.42 ? 316 VAL B CA 1 +ATOM 7387 C C . VAL B 1 296 ? 84.013 50.546 40.994 1.00 22.30 ? 316 VAL B C 1 +ATOM 7388 O O . VAL B 1 296 ? 84.837 49.623 41.011 1.00 22.58 ? 316 VAL B O 1 +ATOM 7389 C CB . VAL B 1 296 ? 81.650 49.857 40.630 1.00 23.77 ? 316 VAL B CB 1 +ATOM 7390 C CG1 . VAL B 1 296 ? 80.446 49.910 39.691 1.00 24.61 ? 316 VAL B CG1 1 +ATOM 7391 C CG2 . VAL B 1 296 ? 81.982 48.418 40.995 1.00 23.38 ? 316 VAL B CG2 1 +ATOM 7392 N N . SER B 1 297 ? 84.066 51.598 41.805 1.00 20.60 ? 317 SER B N 1 +ATOM 7393 C CA . SER B 1 297 ? 85.043 51.729 42.880 1.00 19.73 ? 317 SER B CA 1 +ATOM 7394 C C . SER B 1 297 ? 84.345 51.541 44.218 1.00 18.23 ? 317 SER B C 1 +ATOM 7395 O O . SER B 1 297 ? 83.200 51.964 44.397 1.00 18.11 ? 317 SER B O 1 +ATOM 7396 C CB . SER B 1 297 ? 85.708 53.106 42.854 1.00 19.79 ? 317 SER B CB 1 +ATOM 7397 O OG . SER B 1 297 ? 86.499 53.275 41.690 1.00 21.83 ? 317 SER B OG 1 +ATOM 7398 N N . ASP B 1 298 ? 85.033 50.901 45.156 1.00 16.61 ? 318 ASP B N 1 +ATOM 7399 C CA . ASP B 1 298 ? 84.561 50.837 46.526 1.00 15.32 ? 318 ASP B CA 1 +ATOM 7400 C C . ASP B 1 298 ? 85.713 51.176 47.447 1.00 14.59 ? 318 ASP B C 1 +ATOM 7401 O O . ASP B 1 298 ? 86.841 50.724 47.232 1.00 14.16 ? 318 ASP B O 1 +ATOM 7402 C CB . ASP B 1 298 ? 84.005 49.448 46.850 1.00 14.79 ? 318 ASP B CB 1 +ATOM 7403 C CG . ASP B 1 298 ? 83.205 49.410 48.141 1.00 13.96 ? 318 ASP B CG 1 +ATOM 7404 O OD1 . ASP B 1 298 ? 82.581 50.433 48.513 1.00 12.58 ? 318 ASP B OD1 1 +ATOM 7405 O OD2 . ASP B 1 298 ? 83.167 48.321 48.757 1.00 12.58 ? 318 ASP B OD2 1 +ATOM 7406 N N . PHE B 1 299 ? 85.413 51.980 48.460 1.00 13.88 ? 319 PHE B N 1 +ATOM 7407 C CA . PHE B 1 299 ? 86.384 52.406 49.454 1.00 13.83 ? 319 PHE B CA 1 +ATOM 7408 C C . PHE B 1 299 ? 85.878 52.071 50.850 1.00 13.14 ? 319 PHE B C 1 +ATOM 7409 O O . PHE B 1 299 ? 84.707 52.272 51.168 1.00 13.52 ? 319 PHE B O 1 +ATOM 7410 C CB . PHE B 1 299 ? 86.611 53.918 49.368 1.00 14.67 ? 319 PHE B CB 1 +ATOM 7411 C CG . PHE B 1 299 ? 87.116 54.386 48.036 1.00 15.38 ? 319 PHE B CG 1 +ATOM 7412 C CD1 . PHE B 1 299 ? 86.233 54.720 47.032 1.00 17.31 ? 319 PHE B CD1 1 +ATOM 7413 C CD2 . PHE B 1 299 ? 88.476 54.509 47.799 1.00 18.16 ? 319 PHE B CD2 1 +ATOM 7414 C CE1 . PHE B 1 299 ? 86.685 55.162 45.809 1.00 18.49 ? 319 PHE B CE1 1 +ATOM 7415 C CE2 . PHE B 1 299 ? 88.939 54.946 46.574 1.00 18.13 ? 319 PHE B CE2 1 +ATOM 7416 C CZ . PHE B 1 299 ? 88.047 55.267 45.578 1.00 17.22 ? 319 PHE B CZ 1 +ATOM 7417 N N . TYR B 1 300 ? 86.778 51.579 51.684 1.00 11.81 ? 320 TYR B N 1 +ATOM 7418 C CA . TYR B 1 300 ? 86.504 51.404 53.094 1.00 11.08 ? 320 TYR B CA 1 +ATOM 7419 C C . TYR B 1 300 ? 87.818 51.594 53.826 1.00 11.19 ? 320 TYR B C 1 +ATOM 7420 O O . TYR B 1 300 ? 88.851 51.126 53.361 1.00 11.12 ? 320 TYR B O 1 +ATOM 7421 C CB . TYR B 1 300 ? 85.933 50.016 53.380 1.00 10.73 ? 320 TYR B CB 1 +ATOM 7422 C CG . TYR B 1 300 ? 85.433 49.878 54.796 1.00 10.92 ? 320 TYR B CG 1 +ATOM 7423 C CD1 . TYR B 1 300 ? 86.299 49.530 55.832 1.00 9.92 ? 320 TYR B CD1 1 +ATOM 7424 C CD2 . TYR B 1 300 ? 84.103 50.131 55.111 1.00 10.06 ? 320 TYR B CD2 1 +ATOM 7425 C CE1 . TYR B 1 300 ? 85.849 49.418 57.139 1.00 10.22 ? 320 TYR B CE1 1 +ATOM 7426 C CE2 . TYR B 1 300 ? 83.646 50.016 56.403 1.00 10.58 ? 320 TYR B CE2 1 +ATOM 7427 C CZ . TYR B 1 300 ? 84.512 49.660 57.415 1.00 10.38 ? 320 TYR B CZ 1 +ATOM 7428 O OH . TYR B 1 300 ? 84.031 49.550 58.702 1.00 11.55 ? 320 TYR B OH 1 +ATOM 7429 N N . THR B 1 301 ? 87.776 52.309 54.944 1.00 11.43 ? 321 THR B N 1 +ATOM 7430 C CA . THR B 1 301 ? 88.962 52.564 55.756 1.00 11.16 ? 321 THR B CA 1 +ATOM 7431 C C . THR B 1 301 ? 88.760 52.026 57.167 1.00 10.93 ? 321 THR B C 1 +ATOM 7432 O O . THR B 1 301 ? 87.788 52.394 57.849 1.00 10.85 ? 321 THR B O 1 +ATOM 7433 C CB . THR B 1 301 ? 89.270 54.074 55.864 1.00 11.65 ? 321 THR B CB 1 +ATOM 7434 O OG1 . THR B 1 301 ? 89.400 54.628 54.553 1.00 11.28 ? 321 THR B OG1 1 +ATOM 7435 C CG2 . THR B 1 301 ? 90.564 54.321 56.630 1.00 11.92 ? 321 THR B CG2 1 +ATOM 7436 N N . LEU B 1 302 ? 89.721 51.221 57.619 1.00 10.58 ? 322 LEU B N 1 +ATOM 7437 C CA . LEU B 1 302 ? 89.643 50.506 58.890 1.00 10.49 ? 322 LEU B CA 1 +ATOM 7438 C C . LEU B 1 302 ? 90.777 50.941 59.797 1.00 11.01 ? 322 LEU B C 1 +ATOM 7439 O O . LEU B 1 302 ? 91.940 50.828 59.391 1.00 11.01 ? 322 LEU B O 1 +ATOM 7440 C CB . LEU B 1 302 ? 89.781 49.004 58.628 1.00 10.69 ? 322 LEU B CB 1 +ATOM 7441 C CG . LEU B 1 302 ? 89.705 48.092 59.846 1.00 10.66 ? 322 LEU B CG 1 +ATOM 7442 C CD1 . LEU B 1 302 ? 88.285 48.090 60.387 1.00 9.77 ? 322 LEU B CD1 1 +ATOM 7443 C CD2 . LEU B 1 302 ? 90.147 46.674 59.465 1.00 10.04 ? 322 LEU B CD2 1 +ATOM 7444 N N . PRO B 1 303 ? 90.471 51.423 61.022 1.00 10.29 ? 323 PRO B N 1 +ATOM 7445 C CA . PRO B 1 303 ? 91.557 51.771 61.933 1.00 10.27 ? 323 PRO B CA 1 +ATOM 7446 C C . PRO B 1 303 ? 92.379 50.548 62.340 1.00 9.39 ? 323 PRO B C 1 +ATOM 7447 O O . PRO B 1 303 ? 91.815 49.471 62.493 1.00 9.12 ? 323 PRO B O 1 +ATOM 7448 C CB . PRO B 1 303 ? 90.832 52.396 63.139 1.00 10.59 ? 323 PRO B CB 1 +ATOM 7449 C CG . PRO B 1 303 ? 89.464 52.782 62.624 1.00 9.94 ? 323 PRO B CG 1 +ATOM 7450 C CD . PRO B 1 303 ? 89.152 51.721 61.613 1.00 10.85 ? 323 PRO B CD 1 +ATOM 7451 N N . VAL B 1 304 ? 93.692 50.730 62.509 1.00 9.44 ? 324 VAL B N 1 +ATOM 7452 C CA . VAL B 1 304 ? 94.612 49.649 62.840 1.00 9.40 ? 324 VAL B CA 1 +ATOM 7453 C C . VAL B 1 304 ? 95.563 50.086 63.938 1.00 9.25 ? 324 VAL B C 1 +ATOM 7454 O O . VAL B 1 304 ? 96.231 51.110 63.808 1.00 9.06 ? 324 VAL B O 1 +ATOM 7455 C CB . VAL B 1 304 ? 95.505 49.229 61.619 1.00 9.19 ? 324 VAL B CB 1 +ATOM 7456 C CG1 . VAL B 1 304 ? 96.586 48.230 62.049 1.00 9.00 ? 324 VAL B CG1 1 +ATOM 7457 C CG2 . VAL B 1 304 ? 94.657 48.672 60.493 1.00 11.07 ? 324 VAL B CG2 1 +ATOM 7458 N N . GLY B 1 305 ? 95.612 49.314 65.017 1.00 9.26 ? 325 GLY B N 1 +ATOM 7459 C CA . GLY B 1 305 ? 96.614 49.486 66.065 1.00 9.32 ? 325 GLY B CA 1 +ATOM 7460 C C . GLY B 1 305 ? 97.542 48.286 66.051 1.00 9.85 ? 325 GLY B C 1 +ATOM 7461 O O . GLY B 1 305 ? 97.105 47.142 66.204 1.00 10.48 ? 325 GLY B O 1 +ATOM 7462 N N . ILE B 1 306 ? 98.829 48.549 65.840 1.00 9.91 ? 326 ILE B N 1 +ATOM 7463 C CA . ILE B 1 306 ? 99.820 47.512 65.772 1.00 10.69 ? 326 ILE B CA 1 +ATOM 7464 C C . ILE B 1 306 ? 100.255 47.146 67.191 1.00 10.26 ? 326 ILE B C 1 +ATOM 7465 O O . ILE B 1 306 ? 100.943 47.920 67.878 1.00 10.32 ? 326 ILE B O 1 +ATOM 7466 C CB . ILE B 1 306 ? 101.000 47.958 64.872 1.00 10.71 ? 326 ILE B CB 1 +ATOM 7467 C CG1 . ILE B 1 306 ? 100.461 48.280 63.473 1.00 11.58 ? 326 ILE B CG1 1 +ATOM 7468 C CG2 . ILE B 1 306 ? 102.041 46.864 64.788 1.00 11.20 ? 326 ILE B CG2 1 +ATOM 7469 C CD1 . ILE B 1 306 ? 101.493 48.850 62.512 1.00 12.30 ? 326 ILE B CD1 1 +ATOM 7470 N N . ARG B 1 307 ? 99.810 45.975 67.628 1.00 10.62 ? 327 ARG B N 1 +ATOM 7471 C CA . ARG B 1 307 ? 100.086 45.475 68.959 1.00 11.08 ? 327 ARG B CA 1 +ATOM 7472 C C . ARG B 1 307 ? 99.871 43.963 69.040 1.00 11.35 ? 327 ARG B C 1 +ATOM 7473 O O . ARG B 1 307 ? 99.098 43.387 68.264 1.00 10.90 ? 327 ARG B O 1 +ATOM 7474 C CB . ARG B 1 307 ? 99.164 46.174 69.963 1.00 11.28 ? 327 ARG B CB 1 +ATOM 7475 C CG . ARG B 1 307 ? 97.699 45.835 69.784 1.00 10.63 ? 327 ARG B CG 1 +ATOM 7476 C CD . ARG B 1 307 ? 97.309 44.765 70.756 1.00 10.80 ? 327 ARG B CD 1 +ATOM 7477 N NE . ARG B 1 307 ? 95.934 44.309 70.593 1.00 11.05 ? 327 ARG B NE 1 +ATOM 7478 C CZ . ARG B 1 307 ? 95.570 43.212 69.931 1.00 10.54 ? 327 ARG B CZ 1 +ATOM 7479 N NH1 . ARG B 1 307 ? 96.476 42.444 69.329 1.00 11.76 ? 327 ARG B NH1 1 +ATOM 7480 N NH2 . ARG B 1 307 ? 94.283 42.881 69.872 1.00 9.47 ? 327 ARG B NH2 1 +ATOM 7481 N N . THR B 1 308 ? 100.549 43.338 69.994 1.00 12.14 ? 328 THR B N 1 +ATOM 7482 C CA . THR B 1 308 ? 100.418 41.911 70.229 1.00 12.45 ? 328 THR B CA 1 +ATOM 7483 C C . THR B 1 308 ? 99.991 41.643 71.664 1.00 12.92 ? 328 THR B C 1 +ATOM 7484 O O . THR B 1 308 ? 100.221 42.461 72.556 1.00 12.60 ? 328 THR B O 1 +ATOM 7485 C CB . THR B 1 308 ? 101.743 41.183 69.980 1.00 12.53 ? 328 THR B CB 1 +ATOM 7486 O OG1 . THR B 1 308 ? 102.688 41.544 70.992 1.00 12.29 ? 328 THR B OG1 1 +ATOM 7487 C CG2 . THR B 1 308 ? 102.311 41.529 68.596 1.00 12.59 ? 328 THR B CG2 1 +ATOM 7488 N N . VAL B 1 309 ? 99.359 40.487 71.857 1.00 13.06 ? 329 VAL B N 1 +ATOM 7489 C CA . VAL B 1 309 ? 98.931 40.001 73.163 1.00 13.20 ? 329 VAL B CA 1 +ATOM 7490 C C . VAL B 1 309 ? 99.402 38.560 73.319 1.00 13.64 ? 329 VAL B C 1 +ATOM 7491 O O . VAL B 1 309 ? 99.283 37.757 72.384 1.00 14.06 ? 329 VAL B O 1 +ATOM 7492 C CB . VAL B 1 309 ? 97.396 40.011 73.287 1.00 13.32 ? 329 VAL B CB 1 +ATOM 7493 C CG1 . VAL B 1 309 ? 96.952 39.470 74.666 1.00 13.62 ? 329 VAL B CG1 1 +ATOM 7494 C CG2 . VAL B 1 309 ? 96.853 41.418 73.031 1.00 13.31 ? 329 VAL B CG2 1 +ATOM 7495 N N . ALA B 1 310 ? 99.935 38.248 74.495 1.00 13.79 ? 330 ALA B N 1 +ATOM 7496 C CA . ALA B 1 310 ? 100.341 36.885 74.826 1.00 13.78 ? 330 ALA B CA 1 +ATOM 7497 C C . ALA B 1 310 ? 100.221 36.670 76.322 1.00 13.89 ? 330 ALA B C 1 +ATOM 7498 O O . ALA B 1 310 ? 100.234 37.620 77.118 1.00 13.74 ? 330 ALA B O 1 +ATOM 7499 C CB . ALA B 1 310 ? 101.759 36.614 74.355 1.00 13.88 ? 330 ALA B CB 1 +ATOM 7500 N N . VAL B 1 311 ? 100.113 35.404 76.699 1.00 13.68 ? 331 VAL B N 1 +ATOM 7501 C CA . VAL B 1 311 ? 99.887 35.013 78.074 1.00 14.54 ? 331 VAL B CA 1 +ATOM 7502 C C . VAL B 1 311 ? 100.902 33.917 78.404 1.00 14.95 ? 331 VAL B C 1 +ATOM 7503 O O . VAL B 1 311 ? 101.091 32.998 77.616 1.00 14.93 ? 331 VAL B O 1 +ATOM 7504 C CB . VAL B 1 311 ? 98.441 34.501 78.248 1.00 14.70 ? 331 VAL B CB 1 +ATOM 7505 C CG1 . VAL B 1 311 ? 98.205 33.974 79.652 1.00 16.11 ? 331 VAL B CG1 1 +ATOM 7506 C CG2 . VAL B 1 311 ? 97.468 35.632 77.935 1.00 15.21 ? 331 VAL B CG2 1 +ATOM 7507 N N . THR B 1 312 ? 101.593 34.069 79.529 1.00 15.24 ? 332 THR B N 1 +ATOM 7508 C CA . THR B 1 312 ? 102.505 33.042 80.037 1.00 15.68 ? 332 THR B CA 1 +ATOM 7509 C C . THR B 1 312 ? 101.827 32.360 81.228 1.00 16.05 ? 332 THR B C 1 +ATOM 7510 O O . THR B 1 312 ? 100.615 32.499 81.410 1.00 15.54 ? 332 THR B O 1 +ATOM 7511 C CB . THR B 1 312 ? 103.873 33.651 80.415 1.00 15.76 ? 332 THR B CB 1 +ATOM 7512 O OG1 . THR B 1 312 ? 103.759 34.470 81.588 1.00 15.91 ? 332 THR B OG1 1 +ATOM 7513 C CG2 . THR B 1 312 ? 104.407 34.502 79.264 1.00 16.16 ? 332 THR B CG2 1 +ATOM 7514 N N . LYS B 1 313 ? 102.573 31.609 82.033 1.00 16.25 ? 333 LYS B N 1 +ATOM 7515 C CA . LYS B 1 313 ? 101.960 30.982 83.212 1.00 16.92 ? 333 LYS B CA 1 +ATOM 7516 C C . LYS B 1 313 ? 101.748 31.974 84.358 1.00 16.34 ? 333 LYS B C 1 +ATOM 7517 O O . LYS B 1 313 ? 100.982 31.689 85.291 1.00 16.12 ? 333 LYS B O 1 +ATOM 7518 C CB . LYS B 1 313 ? 102.794 29.802 83.710 1.00 17.21 ? 333 LYS B CB 1 +ATOM 7519 C CG . LYS B 1 313 ? 102.966 28.684 82.693 1.00 19.16 ? 333 LYS B CG 1 +ATOM 7520 C CD . LYS B 1 313 ? 103.303 27.367 83.408 1.00 21.61 ? 333 LYS B CD 1 +ATOM 7521 C CE . LYS B 1 313 ? 104.446 26.615 82.753 1.00 23.44 ? 333 LYS B CE 1 +ATOM 7522 N NZ . LYS B 1 313 ? 104.811 25.423 83.583 1.00 24.69 ? 333 LYS B NZ 1 +ATOM 7523 N N . SER B 1 314 ? 102.409 33.133 84.290 1.00 15.75 ? 334 SER B N 1 +ATOM 7524 C CA . SER B 1 314 ? 102.290 34.161 85.335 1.00 15.63 ? 334 SER B CA 1 +ATOM 7525 C C . SER B 1 314 ? 102.108 35.602 84.844 1.00 15.13 ? 334 SER B C 1 +ATOM 7526 O O . SER B 1 314 ? 101.946 36.504 85.670 1.00 15.64 ? 334 SER B O 1 +ATOM 7527 C CB . SER B 1 314 ? 103.537 34.115 86.206 1.00 15.66 ? 334 SER B CB 1 +ATOM 7528 O OG . SER B 1 314 ? 104.679 34.393 85.418 1.00 16.00 ? 334 SER B OG 1 +ATOM 7529 N N . GLN B 1 315 ? 102.150 35.818 83.525 1.00 14.48 ? 335 GLN B N 1 +ATOM 7530 C CA . GLN B 1 315 ? 102.120 37.160 82.954 1.00 14.23 ? 335 GLN B CA 1 +ATOM 7531 C C . GLN B 1 315 ? 101.125 37.343 81.804 1.00 12.89 ? 335 GLN B C 1 +ATOM 7532 O O . GLN B 1 315 ? 100.814 36.407 81.070 1.00 13.60 ? 335 GLN B O 1 +ATOM 7533 C CB . GLN B 1 315 ? 103.526 37.565 82.498 1.00 14.14 ? 335 GLN B CB 1 +ATOM 7534 C CG . GLN B 1 315 ? 104.507 37.743 83.659 1.00 15.19 ? 335 GLN B CG 1 +ATOM 7535 C CD . GLN B 1 315 ? 105.767 38.523 83.286 1.00 15.22 ? 335 GLN B CD 1 +ATOM 7536 O OE1 . GLN B 1 315 ? 106.435 38.212 82.303 1.00 18.94 ? 335 GLN B OE1 1 +ATOM 7537 N NE2 . GLN B 1 315 ? 106.105 39.523 84.093 1.00 18.03 ? 335 GLN B NE2 1 +ATOM 7538 N N . PHE B 1 316 ? 100.630 38.572 81.668 1.00 12.63 ? 336 PHE B N 1 +ATOM 7539 C CA . PHE B 1 316 ? 99.803 38.982 80.524 1.00 11.78 ? 336 PHE B CA 1 +ATOM 7540 C C . PHE B 1 316 ? 100.614 40.022 79.783 1.00 11.72 ? 336 PHE B C 1 +ATOM 7541 O O . PHE B 1 316 ? 100.898 41.096 80.323 1.00 11.74 ? 336 PHE B O 1 +ATOM 7542 C CB . PHE B 1 316 ? 98.467 39.587 80.976 1.00 11.40 ? 336 PHE B CB 1 +ATOM 7543 C CG . PHE B 1 316 ? 97.430 39.672 79.883 1.00 10.00 ? 336 PHE B CG 1 +ATOM 7544 C CD1 . PHE B 1 316 ? 97.505 40.654 78.895 1.00 10.15 ? 336 PHE B CD1 1 +ATOM 7545 C CD2 . PHE B 1 316 ? 96.353 38.799 79.869 1.00 9.70 ? 336 PHE B CD2 1 +ATOM 7546 C CE1 . PHE B 1 316 ? 96.546 40.734 77.906 1.00 10.16 ? 336 PHE B CE1 1 +ATOM 7547 C CE2 . PHE B 1 316 ? 95.399 38.875 78.876 1.00 10.34 ? 336 PHE B CE2 1 +ATOM 7548 C CZ . PHE B 1 316 ? 95.490 39.842 77.900 1.00 10.15 ? 336 PHE B CZ 1 +ATOM 7549 N N . LEU B 1 317 ? 100.992 39.701 78.550 1.00 11.92 ? 337 LEU B N 1 +ATOM 7550 C CA . LEU B 1 317 ? 101.956 40.500 77.821 1.00 12.23 ? 337 LEU B CA 1 +ATOM 7551 C C . LEU B 1 317 ? 101.301 41.271 76.691 1.00 11.93 ? 337 LEU B C 1 +ATOM 7552 O O . LEU B 1 317 ? 100.654 40.680 75.838 1.00 12.62 ? 337 LEU B O 1 +ATOM 7553 C CB . LEU B 1 317 ? 103.052 39.585 77.255 1.00 12.55 ? 337 LEU B CB 1 +ATOM 7554 C CG . LEU B 1 317 ? 103.866 38.752 78.258 1.00 13.18 ? 337 LEU B CG 1 +ATOM 7555 C CD1 . LEU B 1 317 ? 104.937 37.984 77.500 1.00 14.67 ? 337 LEU B CD1 1 +ATOM 7556 C CD2 . LEU B 1 317 ? 104.499 39.605 79.340 1.00 14.09 ? 337 LEU B CD2 1 +ATOM 7557 N N . ILE B 1 318 ? 101.470 42.594 76.700 1.00 11.77 ? 338 ILE B N 1 +ATOM 7558 C CA . ILE B 1 318 ? 101.088 43.443 75.559 1.00 11.49 ? 338 ILE B CA 1 +ATOM 7559 C C . ILE B 1 318 ? 102.376 44.004 74.954 1.00 11.09 ? 338 ILE B C 1 +ATOM 7560 O O . ILE B 1 318 ? 103.203 44.607 75.649 1.00 10.72 ? 338 ILE B O 1 +ATOM 7561 C CB . ILE B 1 318 ? 100.094 44.559 75.951 1.00 11.61 ? 338 ILE B CB 1 +ATOM 7562 C CG1 . ILE B 1 318 ? 98.776 43.937 76.409 1.00 11.81 ? 338 ILE B CG1 1 +ATOM 7563 C CG2 . ILE B 1 318 ? 99.801 45.452 74.759 1.00 10.89 ? 338 ILE B CG2 1 +ATOM 7564 C CD1 . ILE B 1 318 ? 97.723 44.951 76.800 1.00 12.65 ? 338 ILE B CD1 1 +ATOM 7565 N N . ASN B 1 319 ? 102.565 43.733 73.667 1.00 11.69 ? 339 ASN B N 1 +ATOM 7566 C CA . ASN B 1 319 ? 103.782 44.104 72.961 1.00 12.33 ? 339 ASN B CA 1 +ATOM 7567 C C . ASN B 1 319 ? 105.014 43.550 73.655 1.00 13.12 ? 339 ASN B C 1 +ATOM 7568 O O . ASN B 1 319 ? 106.056 44.194 73.672 1.00 13.06 ? 339 ASN B O 1 +ATOM 7569 C CB . ASN B 1 319 ? 103.860 45.631 72.829 1.00 11.77 ? 339 ASN B CB 1 +ATOM 7570 C CG . ASN B 1 319 ? 102.669 46.199 72.080 1.00 12.04 ? 339 ASN B CG 1 +ATOM 7571 O OD1 . ASN B 1 319 ? 102.087 45.514 71.251 1.00 13.54 ? 339 ASN B OD1 1 +ATOM 7572 N ND2 . ASN B 1 319 ? 102.301 47.448 72.372 1.00 13.07 ? 339 ASN B ND2 1 +ATOM 7573 N N . GLY B 1 320 ? 104.884 42.353 74.233 1.00 13.95 ? 340 GLY B N 1 +ATOM 7574 C CA . GLY B 1 320 ? 105.996 41.697 74.920 1.00 14.79 ? 340 GLY B CA 1 +ATOM 7575 C C . GLY B 1 320 ? 106.315 42.193 76.322 1.00 15.26 ? 340 GLY B C 1 +ATOM 7576 O O . GLY B 1 320 ? 107.265 41.697 76.950 1.00 15.70 ? 340 GLY B O 1 +ATOM 7577 N N . LYS B 1 321 ? 105.537 43.152 76.826 1.00 15.21 ? 341 LYS B N 1 +ATOM 7578 C CA . LYS B 1 321 ? 105.806 43.782 78.110 1.00 15.38 ? 341 LYS B CA 1 +ATOM 7579 C C . LYS B 1 321 ? 104.704 43.397 79.084 1.00 14.88 ? 341 LYS B C 1 +ATOM 7580 O O . LYS B 1 321 ? 103.533 43.382 78.701 1.00 13.62 ? 341 LYS B O 1 +ATOM 7581 C CB . LYS B 1 321 ? 105.832 45.303 77.961 1.00 15.86 ? 341 LYS B CB 1 +ATOM 7582 C CG . LYS B 1 321 ? 106.953 45.826 77.070 1.00 19.02 ? 341 LYS B CG 1 +ATOM 7583 C CD . LYS B 1 321 ? 107.180 47.316 77.276 1.00 22.05 ? 341 LYS B CD 1 +ATOM 7584 C CE . LYS B 1 321 ? 108.017 47.600 78.520 1.00 24.86 ? 341 LYS B CE 1 +ATOM 7585 N NZ . LYS B 1 321 ? 109.485 47.462 78.288 1.00 26.44 ? 341 LYS B NZ 1 +ATOM 7586 N N . PRO B 1 322 ? 105.064 43.072 80.337 1.00 14.23 ? 342 PRO B N 1 +ATOM 7587 C CA . PRO B 1 322 ? 104.029 42.788 81.330 1.00 13.98 ? 342 PRO B CA 1 +ATOM 7588 C C . PRO B 1 322 ? 102.994 43.910 81.449 1.00 13.32 ? 342 PRO B C 1 +ATOM 7589 O O . PRO B 1 322 ? 103.351 45.093 81.575 1.00 14.17 ? 342 PRO B O 1 +ATOM 7590 C CB . PRO B 1 322 ? 104.813 42.643 82.636 1.00 13.82 ? 342 PRO B CB 1 +ATOM 7591 C CG . PRO B 1 322 ? 106.171 42.227 82.213 1.00 14.46 ? 342 PRO B CG 1 +ATOM 7592 C CD . PRO B 1 322 ? 106.417 42.912 80.900 1.00 14.62 ? 342 PRO B CD 1 +ATOM 7593 N N . PHE B 1 323 ? 101.728 43.509 81.415 1.00 12.62 ? 343 PHE B N 1 +ATOM 7594 C CA . PHE B 1 323 ? 100.591 44.402 81.553 1.00 11.74 ? 343 PHE B CA 1 +ATOM 7595 C C . PHE B 1 323 ? 99.802 44.043 82.813 1.00 11.31 ? 343 PHE B C 1 +ATOM 7596 O O . PHE B 1 323 ? 99.743 42.879 83.213 1.00 11.28 ? 343 PHE B O 1 +ATOM 7597 C CB . PHE B 1 323 ? 99.715 44.266 80.307 1.00 11.71 ? 343 PHE B CB 1 +ATOM 7598 C CG . PHE B 1 323 ? 98.480 45.091 80.343 1.00 11.10 ? 343 PHE B CG 1 +ATOM 7599 C CD1 . PHE B 1 323 ? 98.563 46.476 80.289 1.00 10.39 ? 343 PHE B CD1 1 +ATOM 7600 C CD2 . PHE B 1 323 ? 97.230 44.490 80.433 1.00 10.64 ? 343 PHE B CD2 1 +ATOM 7601 C CE1 . PHE B 1 323 ? 97.424 47.257 80.322 1.00 11.53 ? 343 PHE B CE1 1 +ATOM 7602 C CE2 . PHE B 1 323 ? 96.081 45.265 80.465 1.00 11.73 ? 343 PHE B CE2 1 +ATOM 7603 C CZ . PHE B 1 323 ? 96.179 46.644 80.403 1.00 10.98 ? 343 PHE B CZ 1 +ATOM 7604 N N . TYR B 1 324 ? 99.205 45.045 83.446 1.00 10.62 ? 344 TYR B N 1 +ATOM 7605 C CA . TYR B 1 324 ? 98.348 44.804 84.603 1.00 10.44 ? 344 TYR B CA 1 +ATOM 7606 C C . TYR B 1 324 ? 97.041 45.530 84.394 1.00 10.26 ? 344 TYR B C 1 +ATOM 7607 O O . TYR B 1 324 ? 97.050 46.752 84.238 1.00 10.16 ? 344 TYR B O 1 +ATOM 7608 C CB . TYR B 1 324 ? 99.016 45.294 85.884 1.00 10.03 ? 344 TYR B CB 1 +ATOM 7609 C CG . TYR B 1 324 ? 98.245 44.906 87.118 1.00 9.57 ? 344 TYR B CG 1 +ATOM 7610 C CD1 . TYR B 1 324 ? 97.457 45.831 87.794 1.00 8.69 ? 344 TYR B CD1 1 +ATOM 7611 C CD2 . TYR B 1 324 ? 98.281 43.599 87.594 1.00 9.03 ? 344 TYR B CD2 1 +ATOM 7612 C CE1 . TYR B 1 324 ? 96.735 45.460 88.926 1.00 10.01 ? 344 TYR B CE1 1 +ATOM 7613 C CE2 . TYR B 1 324 ? 97.566 43.223 88.714 1.00 9.70 ? 344 TYR B CE2 1 +ATOM 7614 C CZ . TYR B 1 324 ? 96.806 44.147 89.383 1.00 9.67 ? 344 TYR B CZ 1 +ATOM 7615 O OH . TYR B 1 324 ? 96.117 43.741 90.495 1.00 9.78 ? 344 TYR B OH 1 +ATOM 7616 N N . PHE B 1 325 ? 95.932 44.785 84.377 1.00 10.46 ? 345 PHE B N 1 +ATOM 7617 C CA . PHE B 1 325 ? 94.614 45.402 84.235 1.00 10.15 ? 345 PHE B CA 1 +ATOM 7618 C C . PHE B 1 325 ? 94.302 46.129 85.521 1.00 9.44 ? 345 PHE B C 1 +ATOM 7619 O O . PHE B 1 325 ? 94.277 45.526 86.585 1.00 9.98 ? 345 PHE B O 1 +ATOM 7620 C CB . PHE B 1 325 ? 93.498 44.371 84.029 1.00 10.34 ? 345 PHE B CB 1 +ATOM 7621 C CG . PHE B 1 325 ? 93.558 43.629 82.724 1.00 10.93 ? 345 PHE B CG 1 +ATOM 7622 C CD1 . PHE B 1 325 ? 92.690 43.957 81.691 1.00 11.12 ? 345 PHE B CD1 1 +ATOM 7623 C CD2 . PHE B 1 325 ? 94.447 42.576 82.538 1.00 10.19 ? 345 PHE B CD2 1 +ATOM 7624 C CE1 . PHE B 1 325 ? 92.717 43.256 80.486 1.00 11.33 ? 345 PHE B CE1 1 +ATOM 7625 C CE2 . PHE B 1 325 ? 94.494 41.896 81.352 1.00 8.88 ? 345 PHE B CE2 1 +ATOM 7626 C CZ . PHE B 1 325 ? 93.626 42.221 80.320 1.00 11.38 ? 345 PHE B CZ 1 +ATOM 7627 N N . HIS B 1 326 ? 94.064 47.427 85.431 1.00 9.26 ? 346 HIS B N 1 +ATOM 7628 C CA . HIS B 1 326 ? 93.529 48.153 86.568 1.00 8.61 ? 346 HIS B CA 1 +ATOM 7629 C C . HIS B 1 326 ? 92.347 48.957 86.080 1.00 8.55 ? 346 HIS B C 1 +ATOM 7630 O O . HIS B 1 326 ? 92.497 50.074 85.587 1.00 8.17 ? 346 HIS B O 1 +ATOM 7631 C CB . HIS B 1 326 ? 94.591 48.995 87.312 1.00 8.74 ? 346 HIS B CB 1 +ATOM 7632 C CG . HIS B 1 326 ? 95.496 49.820 86.436 1.00 8.83 ? 346 HIS B CG 1 +ATOM 7633 N ND1 . HIS B 1 326 ? 95.138 51.055 85.941 1.00 10.86 ? 346 HIS B ND1 1 +ATOM 7634 C CD2 . HIS B 1 326 ? 96.787 49.631 86.063 1.00 9.09 ? 346 HIS B CD2 1 +ATOM 7635 C CE1 . HIS B 1 326 ? 96.151 51.569 85.260 1.00 10.67 ? 346 HIS B CE1 1 +ATOM 7636 N NE2 . HIS B 1 326 ? 97.164 50.723 85.320 1.00 9.85 ? 346 HIS B NE2 1 +ATOM 7637 N N . GLY B 1 327 ? 91.158 48.378 86.253 1.00 7.81 ? 347 GLY B N 1 +ATOM 7638 C CA . GLY B 1 327 ? 90.008 48.805 85.497 1.00 7.82 ? 347 GLY B CA 1 +ATOM 7639 C C . GLY B 1 327 ? 88.686 48.610 86.179 1.00 7.78 ? 347 GLY B C 1 +ATOM 7640 O O . GLY B 1 327 ? 88.599 48.560 87.410 1.00 7.22 ? 347 GLY B O 1 +ATOM 7641 N N . VAL B 1 328 ? 87.645 48.531 85.365 1.00 7.82 ? 348 VAL B N 1 +ATOM 7642 C CA . VAL B 1 328 ? 86.293 48.413 85.883 1.00 7.21 ? 348 VAL B CA 1 +ATOM 7643 C C . VAL B 1 328 ? 85.447 47.439 85.079 1.00 7.23 ? 348 VAL B C 1 +ATOM 7644 O O . VAL B 1 328 ? 85.824 47.031 83.985 1.00 7.28 ? 348 VAL B O 1 +ATOM 7645 C CB . VAL B 1 328 ? 85.584 49.787 85.866 1.00 7.24 ? 348 VAL B CB 1 +ATOM 7646 C CG1 . VAL B 1 328 ? 86.379 50.797 86.678 1.00 6.40 ? 348 VAL B CG1 1 +ATOM 7647 C CG2 . VAL B 1 328 ? 85.348 50.263 84.430 1.00 6.07 ? 348 VAL B CG2 1 +ATOM 7648 N N . ASN B 1 329 ? 84.305 47.069 85.650 1.00 7.48 ? 349 ASN B N 1 +ATOM 7649 C CA . ASN B 1 329 ? 83.212 46.450 84.921 1.00 7.53 ? 349 ASN B CA 1 +ATOM 7650 C C . ASN B 1 329 ? 82.212 47.569 84.683 1.00 7.47 ? 349 ASN B C 1 +ATOM 7651 O O . ASN B 1 329 ? 82.166 48.519 85.475 1.00 6.70 ? 349 ASN B O 1 +ATOM 7652 C CB . ASN B 1 329 ? 82.572 45.339 85.754 1.00 7.74 ? 349 ASN B CB 1 +ATOM 7653 C CG . ASN B 1 329 ? 83.517 44.179 86.004 1.00 7.62 ? 349 ASN B CG 1 +ATOM 7654 O OD1 . ASN B 1 329 ? 83.662 43.294 85.160 1.00 9.81 ? 349 ASN B OD1 1 +ATOM 7655 N ND2 . ASN B 1 329 ? 84.146 44.168 87.170 1.00 6.62 ? 349 ASN B ND2 1 +ATOM 7656 N N . LYS B 1 330 ? 81.447 47.497 83.588 1.00 7.74 ? 350 LYS B N 1 +ATOM 7657 C CA . LYS B 1 330 ? 80.463 48.551 83.264 1.00 6.96 ? 350 LYS B CA 1 +ATOM 7658 C C . LYS B 1 330 ? 79.108 47.926 82.968 1.00 7.39 ? 350 LYS B C 1 +ATOM 7659 O O . LYS B 1 330 ? 78.909 46.747 83.223 1.00 7.51 ? 350 LYS B O 1 +ATOM 7660 C CB . LYS B 1 330 ? 80.938 49.369 82.049 1.00 6.96 ? 350 LYS B CB 1 +ATOM 7661 C CG . LYS B 1 330 ? 82.198 50.155 82.308 1.00 7.30 ? 350 LYS B CG 1 +ATOM 7662 C CD . LYS B 1 330 ? 82.530 51.010 81.116 1.00 7.93 ? 350 LYS B CD 1 +ATOM 7663 C CE . LYS B 1 330 ? 81.943 52.414 81.195 1.00 7.78 ? 350 LYS B CE 1 +ATOM 7664 N NZ . LYS B 1 330 ? 80.452 52.496 81.209 1.00 8.19 ? 350 LYS B NZ 1 +ATOM 7665 N N . HIS B 1 331 ? 78.175 48.728 82.472 1.00 6.55 ? 351 HIS B N 1 +ATOM 7666 C CA . HIS B 1 331 ? 76.922 48.228 81.904 1.00 6.39 ? 351 HIS B CA 1 +ATOM 7667 C C . HIS B 1 331 ? 76.449 49.277 80.949 1.00 6.70 ? 351 HIS B C 1 +ATOM 7668 O O . HIS B 1 331 ? 76.802 50.439 81.091 1.00 6.82 ? 351 HIS B O 1 +ATOM 7669 C CB . HIS B 1 331 ? 75.828 48.002 82.963 1.00 6.41 ? 351 HIS B CB 1 +ATOM 7670 C CG . HIS B 1 331 ? 75.708 46.580 83.431 1.00 6.01 ? 351 HIS B CG 1 +ATOM 7671 N ND1 . HIS B 1 331 ? 75.325 45.545 82.603 1.00 6.92 ? 351 HIS B ND1 1 +ATOM 7672 C CD2 . HIS B 1 331 ? 75.894 46.030 84.652 1.00 6.96 ? 351 HIS B CD2 1 +ATOM 7673 C CE1 . HIS B 1 331 ? 75.300 44.419 83.290 1.00 5.91 ? 351 HIS B CE1 1 +ATOM 7674 N NE2 . HIS B 1 331 ? 75.653 44.683 84.534 1.00 5.44 ? 351 HIS B NE2 1 +ATOM 7675 N N . GLU B 1 332 ? 75.649 48.881 79.971 1.00 6.86 ? 352 GLU B N 1 +ATOM 7676 C CA . GLU B 1 332 ? 74.967 49.867 79.181 1.00 6.75 ? 352 GLU B CA 1 +ATOM 7677 C C . GLU B 1 332 ? 73.675 50.152 79.928 1.00 6.45 ? 352 GLU B C 1 +ATOM 7678 O O . GLU B 1 332 ? 72.737 49.364 79.893 1.00 6.23 ? 352 GLU B O 1 +ATOM 7679 C CB . GLU B 1 332 ? 74.738 49.400 77.750 1.00 6.90 ? 352 GLU B CB 1 +ATOM 7680 C CG . GLU B 1 332 ? 76.050 49.303 76.967 1.00 8.48 ? 352 GLU B CG 1 +ATOM 7681 C CD . GLU B 1 332 ? 75.861 48.944 75.524 1.00 11.46 ? 352 GLU B CD 1 +ATOM 7682 O OE1 . GLU B 1 332 ? 75.053 48.026 75.259 1.00 12.35 ? 352 GLU B OE1 1 +ATOM 7683 O OE2 . GLU B 1 332 ? 76.528 49.574 74.665 1.00 13.05 ? 352 GLU B OE2 1 +ATOM 7684 N N . ASP B 1 333 ? 73.663 51.279 80.634 1.00 6.65 ? 353 ASP B N 1 +ATOM 7685 C CA . ASP B 1 333 ? 72.573 51.613 81.541 1.00 6.53 ? 353 ASP B CA 1 +ATOM 7686 C C . ASP B 1 333 ? 72.660 53.114 81.920 1.00 6.47 ? 353 ASP B C 1 +ATOM 7687 O O . ASP B 1 333 ? 73.734 53.644 82.248 1.00 6.44 ? 353 ASP B O 1 +ATOM 7688 C CB . ASP B 1 333 ? 72.642 50.697 82.771 1.00 7.00 ? 353 ASP B CB 1 +ATOM 7689 C CG . ASP B 1 333 ? 71.771 51.162 83.904 1.00 7.84 ? 353 ASP B CG 1 +ATOM 7690 O OD1 . ASP B 1 333 ? 72.189 52.077 84.633 1.00 7.81 ? 353 ASP B OD1 1 +ATOM 7691 O OD2 . ASP B 1 333 ? 70.668 50.611 84.084 1.00 7.43 ? 353 ASP B OD2 1 +ATOM 7692 N N . ALA B 1 334 ? 71.528 53.791 81.831 1.00 6.25 ? 354 ALA B N 1 +ATOM 7693 C CA . ALA B 1 334 ? 71.412 55.161 82.296 1.00 5.85 ? 354 ALA B CA 1 +ATOM 7694 C C . ALA B 1 334 ? 69.943 55.448 82.542 1.00 6.22 ? 354 ALA B C 1 +ATOM 7695 O O . ALA B 1 334 ? 69.081 54.690 82.081 1.00 6.07 ? 354 ALA B O 1 +ATOM 7696 C CB . ALA B 1 334 ? 71.977 56.128 81.278 1.00 5.96 ? 354 ALA B CB 1 +ATOM 7697 N N . ASP B 1 335 ? 69.680 56.548 83.247 1.00 6.64 ? 355 ASP B N 1 +ATOM 7698 C CA . ASP B 1 335 ? 68.306 57.000 83.536 1.00 7.02 ? 355 ASP B CA 1 +ATOM 7699 C C . ASP B 1 335 ? 67.493 57.171 82.256 1.00 7.45 ? 355 ASP B C 1 +ATOM 7700 O O . ASP B 1 335 ? 68.017 57.608 81.240 1.00 7.81 ? 355 ASP B O 1 +ATOM 7701 C CB . ASP B 1 335 ? 68.293 58.323 84.297 1.00 7.43 ? 355 ASP B CB 1 +ATOM 7702 C CG . ASP B 1 335 ? 68.839 58.211 85.692 1.00 8.56 ? 355 ASP B CG 1 +ATOM 7703 O OD1 . ASP B 1 335 ? 68.697 57.132 86.339 1.00 7.90 ? 355 ASP B OD1 1 +ATOM 7704 O OD2 . ASP B 1 335 ? 69.400 59.217 86.148 1.00 9.12 ? 355 ASP B OD2 1 +ATOM 7705 N N . ILE B 1 336 ? 66.215 56.809 82.321 1.00 7.86 ? 356 ILE B N 1 +ATOM 7706 C CA . ILE B 1 336 ? 65.239 57.014 81.234 1.00 8.45 ? 356 ILE B CA 1 +ATOM 7707 C C . ILE B 1 336 ? 65.424 56.161 79.964 1.00 8.78 ? 356 ILE B C 1 +ATOM 7708 O O . ILE B 1 336 ? 64.476 55.507 79.510 1.00 8.26 ? 356 ILE B O 1 +ATOM 7709 C CB . ILE B 1 336 ? 65.129 58.507 80.855 1.00 9.49 ? 356 ILE B CB 1 +ATOM 7710 C CG1 . ILE B 1 336 ? 64.899 59.353 82.113 1.00 11.51 ? 356 ILE B CG1 1 +ATOM 7711 C CG2 . ILE B 1 336 ? 63.992 58.734 79.844 1.00 7.90 ? 356 ILE B CG2 1 +ATOM 7712 C CD1 . ILE B 1 336 ? 63.814 58.818 83.043 1.00 14.43 ? 356 ILE B CD1 1 +ATOM 7713 N N . ARG B 1 337 ? 66.611 56.204 79.370 1.00 7.61 ? 357 ARG B N 1 +ATOM 7714 C CA . ARG B 1 337 ? 66.888 55.447 78.144 1.00 7.69 ? 357 ARG B CA 1 +ATOM 7715 C C . ARG B 1 337 ? 67.230 53.952 78.329 1.00 7.52 ? 357 ARG B C 1 +ATOM 7716 O O . ARG B 1 337 ? 67.386 53.211 77.342 1.00 6.45 ? 357 ARG B O 1 +ATOM 7717 C CB . ARG B 1 337 ? 68.027 56.140 77.396 1.00 7.54 ? 357 ARG B CB 1 +ATOM 7718 C CG . ARG B 1 337 ? 69.380 55.946 78.053 1.00 7.45 ? 357 ARG B CG 1 +ATOM 7719 C CD . ARG B 1 337 ? 70.380 56.960 77.586 1.00 7.89 ? 357 ARG B CD 1 +ATOM 7720 N NE . ARG B 1 337 ? 69.992 58.280 78.053 1.00 7.93 ? 357 ARG B NE 1 +ATOM 7721 C CZ . ARG B 1 337 ? 69.513 59.263 77.288 1.00 8.57 ? 357 ARG B CZ 1 +ATOM 7722 N NH1 . ARG B 1 337 ? 69.372 59.114 75.973 1.00 7.98 ? 357 ARG B NH1 1 +ATOM 7723 N NH2 . ARG B 1 337 ? 69.157 60.404 77.848 1.00 8.50 ? 357 ARG B NH2 1 +ATOM 7724 N N . GLY B 1 338 ? 67.378 53.496 79.573 1.00 7.68 ? 358 GLY B N 1 +ATOM 7725 C CA . GLY B 1 338 ? 67.791 52.120 79.821 1.00 7.51 ? 358 GLY B CA 1 +ATOM 7726 C C . GLY B 1 338 ? 69.146 51.825 79.214 1.00 7.28 ? 358 GLY B C 1 +ATOM 7727 O O . GLY B 1 338 ? 70.142 52.456 79.571 1.00 6.99 ? 358 GLY B O 1 +ATOM 7728 N N . LYS B 1 339 ? 69.183 50.879 78.279 1.00 6.27 ? 359 LYS B N 1 +ATOM 7729 C CA . LYS B 1 339 ? 70.449 50.458 77.649 1.00 6.90 ? 359 LYS B CA 1 +ATOM 7730 C C . LYS B 1 339 ? 70.689 51.198 76.340 1.00 7.40 ? 359 LYS B C 1 +ATOM 7731 O O . LYS B 1 339 ? 71.604 50.844 75.575 1.00 8.64 ? 359 LYS B O 1 +ATOM 7732 C CB . LYS B 1 339 ? 70.440 48.944 77.395 1.00 6.76 ? 359 LYS B CB 1 +ATOM 7733 C CG . LYS B 1 339 ? 70.044 48.119 78.633 1.00 6.86 ? 359 LYS B CG 1 +ATOM 7734 C CD . LYS B 1 339 ? 70.175 46.606 78.477 1.00 7.48 ? 359 LYS B CD 1 +ATOM 7735 C CE . LYS B 1 339 ? 71.597 46.127 78.697 1.00 7.19 ? 359 LYS B CE 1 +ATOM 7736 N NZ . LYS B 1 339 ? 72.175 46.715 79.938 1.00 8.39 ? 359 LYS B NZ 1 +ATOM 7737 N N . GLY B 1 340 ? 69.882 52.227 76.097 1.00 7.62 ? 360 GLY B N 1 +ATOM 7738 C CA . GLY B 1 340 ? 69.953 53.047 74.882 1.00 7.91 ? 360 GLY B CA 1 +ATOM 7739 C C . GLY B 1 340 ? 71.273 53.777 74.690 1.00 8.46 ? 360 GLY B C 1 +ATOM 7740 O O . GLY B 1 340 ? 71.842 54.317 75.633 1.00 8.85 ? 360 GLY B O 1 +ATOM 7741 N N . PHE B 1 341 ? 71.760 53.789 73.456 1.00 8.57 ? 361 PHE B N 1 +ATOM 7742 C CA . PHE B 1 341 ? 72.997 54.486 73.148 1.00 8.65 ? 361 PHE B CA 1 +ATOM 7743 C C . PHE B 1 341 ? 72.826 56.001 73.254 1.00 8.78 ? 361 PHE B C 1 +ATOM 7744 O O . PHE B 1 341 ? 71.777 56.538 72.908 1.00 7.95 ? 361 PHE B O 1 +ATOM 7745 C CB . PHE B 1 341 ? 73.484 54.119 71.753 1.00 9.62 ? 361 PHE B CB 1 +ATOM 7746 C CG . PHE B 1 341 ? 74.770 54.774 71.395 1.00 8.97 ? 361 PHE B CG 1 +ATOM 7747 C CD1 . PHE B 1 341 ? 75.977 54.264 71.847 1.00 10.99 ? 361 PHE B CD1 1 +ATOM 7748 C CD2 . PHE B 1 341 ? 74.773 55.941 70.644 1.00 10.38 ? 361 PHE B CD2 1 +ATOM 7749 C CE1 . PHE B 1 341 ? 77.172 54.895 71.532 1.00 11.19 ? 361 PHE B CE1 1 +ATOM 7750 C CE2 . PHE B 1 341 ? 75.954 56.565 70.320 1.00 10.98 ? 361 PHE B CE2 1 +ATOM 7751 C CZ . PHE B 1 341 ? 77.160 56.042 70.767 1.00 9.71 ? 361 PHE B CZ 1 +ATOM 7752 N N . ASP B 1 342 ? 73.875 56.675 73.727 1.00 8.34 ? 362 ASP B N 1 +ATOM 7753 C CA . ASP B 1 342 ? 73.830 58.123 73.944 1.00 8.43 ? 362 ASP B CA 1 +ATOM 7754 C C . ASP B 1 342 ? 75.233 58.686 73.882 1.00 7.80 ? 362 ASP B C 1 +ATOM 7755 O O . ASP B 1 342 ? 76.105 58.250 74.632 1.00 8.65 ? 362 ASP B O 1 +ATOM 7756 C CB . ASP B 1 342 ? 73.209 58.441 75.308 1.00 8.37 ? 362 ASP B CB 1 +ATOM 7757 C CG . ASP B 1 342 ? 73.164 59.917 75.597 1.00 10.05 ? 362 ASP B CG 1 +ATOM 7758 O OD1 . ASP B 1 342 ? 72.429 60.663 74.896 1.00 9.35 ? 362 ASP B OD1 1 +ATOM 7759 O OD2 . ASP B 1 342 ? 73.875 60.339 76.527 1.00 9.19 ? 362 ASP B OD2 1 +ATOM 7760 N N . TRP B 1 343 ? 75.438 59.649 72.992 1.00 7.42 ? 363 TRP B N 1 +ATOM 7761 C CA . TRP B 1 343 ? 76.768 60.236 72.798 1.00 8.01 ? 363 TRP B CA 1 +ATOM 7762 C C . TRP B 1 343 ? 77.289 60.970 74.037 1.00 6.76 ? 363 TRP B C 1 +ATOM 7763 O O . TRP B 1 343 ? 78.441 60.769 74.424 1.00 6.47 ? 363 TRP B O 1 +ATOM 7764 C CB . TRP B 1 343 ? 76.786 61.148 71.570 1.00 8.98 ? 363 TRP B CB 1 +ATOM 7765 C CG . TRP B 1 343 ? 76.810 60.409 70.282 1.00 9.32 ? 363 TRP B CG 1 +ATOM 7766 C CD1 . TRP B 1 343 ? 75.824 60.347 69.359 1.00 10.76 ? 363 TRP B CD1 1 +ATOM 7767 C CD2 . TRP B 1 343 ? 77.891 59.628 69.776 1.00 9.34 ? 363 TRP B CD2 1 +ATOM 7768 N NE1 . TRP B 1 343 ? 76.211 59.550 68.302 1.00 12.31 ? 363 TRP B NE1 1 +ATOM 7769 C CE2 . TRP B 1 343 ? 77.490 59.115 68.528 1.00 10.08 ? 363 TRP B CE2 1 +ATOM 7770 C CE3 . TRP B 1 343 ? 79.165 59.327 70.252 1.00 10.67 ? 363 TRP B CE3 1 +ATOM 7771 C CZ2 . TRP B 1 343 ? 78.321 58.302 67.752 1.00 11.92 ? 363 TRP B CZ2 1 +ATOM 7772 C CZ3 . TRP B 1 343 ? 79.995 58.520 69.475 1.00 11.25 ? 363 TRP B CZ3 1 +ATOM 7773 C CH2 . TRP B 1 343 ? 79.569 58.023 68.243 1.00 10.73 ? 363 TRP B CH2 1 +ATOM 7774 N N . PRO B 1 344 ? 76.481 61.851 74.651 1.00 6.70 ? 364 PRO B N 1 +ATOM 7775 C CA . PRO B 1 344 ? 76.999 62.528 75.839 1.00 7.16 ? 364 PRO B CA 1 +ATOM 7776 C C . PRO B 1 344 ? 77.462 61.596 76.956 1.00 7.08 ? 364 PRO B C 1 +ATOM 7777 O O . PRO B 1 344 ? 78.560 61.756 77.465 1.00 6.30 ? 364 PRO B O 1 +ATOM 7778 C CB . PRO B 1 344 ? 75.823 63.397 76.275 1.00 7.34 ? 364 PRO B CB 1 +ATOM 7779 C CG . PRO B 1 344 ? 75.131 63.710 74.986 1.00 8.07 ? 364 PRO B CG 1 +ATOM 7780 C CD . PRO B 1 344 ? 75.157 62.381 74.284 1.00 6.78 ? 364 PRO B CD 1 +ATOM 7781 N N . LEU B 1 345 ? 76.645 60.608 77.294 1.00 7.69 ? 365 LEU B N 1 +ATOM 7782 C CA . LEU B 1 345 ? 77.021 59.621 78.316 1.00 8.33 ? 365 LEU B CA 1 +ATOM 7783 C C . LEU B 1 345 ? 78.269 58.805 77.913 1.00 8.80 ? 365 LEU B C 1 +ATOM 7784 O O . LEU B 1 345 ? 79.092 58.465 78.773 1.00 9.32 ? 365 LEU B O 1 +ATOM 7785 C CB . LEU B 1 345 ? 75.835 58.710 78.647 1.00 9.45 ? 365 LEU B CB 1 +ATOM 7786 C CG . LEU B 1 345 ? 74.833 59.346 79.601 1.00 10.49 ? 365 LEU B CG 1 +ATOM 7787 C CD1 . LEU B 1 345 ? 73.521 58.558 79.658 1.00 12.57 ? 365 LEU B CD1 1 +ATOM 7788 C CD2 . LEU B 1 345 ? 75.439 59.487 80.978 1.00 13.49 ? 365 LEU B CD2 1 +ATOM 7789 N N . LEU B 1 346 ? 78.398 58.484 76.626 1.00 8.56 ? 366 LEU B N 1 +ATOM 7790 C CA . LEU B 1 346 ? 79.565 57.751 76.125 1.00 9.03 ? 366 LEU B CA 1 +ATOM 7791 C C . LEU B 1 346 ? 80.842 58.537 76.413 1.00 8.27 ? 366 LEU B C 1 +ATOM 7792 O O . LEU B 1 346 ? 81.796 58.018 76.995 1.00 8.44 ? 366 LEU B O 1 +ATOM 7793 C CB . LEU B 1 346 ? 79.453 57.521 74.620 1.00 9.01 ? 366 LEU B CB 1 +ATOM 7794 C CG . LEU B 1 346 ? 80.678 56.896 73.928 1.00 10.71 ? 366 LEU B CG 1 +ATOM 7795 C CD1 . LEU B 1 346 ? 80.849 55.478 74.398 1.00 12.39 ? 366 LEU B CD1 1 +ATOM 7796 C CD2 . LEU B 1 346 ? 80.526 56.995 72.399 1.00 10.55 ? 366 LEU B CD2 1 +ATOM 7797 N N . VAL B 1 347 ? 80.867 59.793 75.981 1.00 7.60 ? 367 VAL B N 1 +ATOM 7798 C CA . VAL B 1 347 ? 82.062 60.631 76.167 1.00 6.18 ? 367 VAL B CA 1 +ATOM 7799 C C . VAL B 1 347 ? 82.324 60.880 77.647 1.00 5.99 ? 367 VAL B C 1 +ATOM 7800 O O . VAL B 1 347 ? 83.448 60.754 78.108 1.00 5.49 ? 367 VAL B O 1 +ATOM 7801 C CB . VAL B 1 347 ? 81.988 61.971 75.372 1.00 6.36 ? 367 VAL B CB 1 +ATOM 7802 C CG1 . VAL B 1 347 ? 83.262 62.819 75.603 1.00 5.17 ? 367 VAL B CG1 1 +ATOM 7803 C CG2 . VAL B 1 347 ? 81.846 61.678 73.879 1.00 6.24 ? 367 VAL B CG2 1 +ATOM 7804 N N . LYS B 1 348 ? 81.271 61.175 78.406 1.00 5.90 ? 368 LYS B N 1 +ATOM 7805 C CA . LYS B 1 348 ? 81.424 61.368 79.836 1.00 5.43 ? 368 LYS B CA 1 +ATOM 7806 C C . LYS B 1 348 ? 82.082 60.149 80.502 1.00 5.51 ? 368 LYS B C 1 +ATOM 7807 O O . LYS B 1 348 ? 83.029 60.281 81.305 1.00 5.38 ? 368 LYS B O 1 +ATOM 7808 C CB . LYS B 1 348 ? 80.064 61.627 80.480 1.00 5.18 ? 368 LYS B CB 1 +ATOM 7809 C CG . LYS B 1 348 ? 80.149 61.948 81.950 1.00 4.80 ? 368 LYS B CG 1 +ATOM 7810 C CD . LYS B 1 348 ? 80.968 63.223 82.245 1.00 6.22 ? 368 LYS B CD 1 +ATOM 7811 C CE . LYS B 1 348 ? 80.906 63.538 83.712 1.00 6.97 ? 368 LYS B CE 1 +ATOM 7812 N NZ . LYS B 1 348 ? 81.599 64.774 84.121 1.00 6.19 ? 368 LYS B NZ 1 +ATOM 7813 N N . ASP B 1 349 ? 81.603 58.963 80.152 1.00 5.01 ? 369 ASP B N 1 +ATOM 7814 C CA . ASP B 1 349 ? 82.129 57.737 80.737 1.00 5.98 ? 369 ASP B CA 1 +ATOM 7815 C C . ASP B 1 349 ? 83.615 57.595 80.434 1.00 5.96 ? 369 ASP B C 1 +ATOM 7816 O O . ASP B 1 349 ? 84.394 57.223 81.315 1.00 6.96 ? 369 ASP B O 1 +ATOM 7817 C CB . ASP B 1 349 ? 81.364 56.503 80.251 1.00 6.05 ? 369 ASP B CB 1 +ATOM 7818 C CG . ASP B 1 349 ? 80.053 56.296 80.987 1.00 7.83 ? 369 ASP B CG 1 +ATOM 7819 O OD1 . ASP B 1 349 ? 79.692 57.125 81.830 1.00 8.50 ? 369 ASP B OD1 1 +ATOM 7820 O OD2 . ASP B 1 349 ? 79.378 55.275 80.755 1.00 11.75 ? 369 ASP B OD2 1 +ATOM 7821 N N . PHE B 1 350 ? 84.033 57.910 79.210 1.00 6.40 ? 370 PHE B N 1 +ATOM 7822 C CA . PHE B 1 350 ? 85.467 57.802 78.895 1.00 6.70 ? 370 PHE B CA 1 +ATOM 7823 C C . PHE B 1 350 ? 86.305 58.850 79.596 1.00 7.00 ? 370 PHE B C 1 +ATOM 7824 O O . PHE B 1 350 ? 87.437 58.574 80.015 1.00 6.63 ? 370 PHE B O 1 +ATOM 7825 C CB . PHE B 1 350 ? 85.729 57.765 77.387 1.00 7.04 ? 370 PHE B CB 1 +ATOM 7826 C CG . PHE B 1 350 ? 85.544 56.373 76.806 1.00 6.73 ? 370 PHE B CG 1 +ATOM 7827 C CD1 . PHE B 1 350 ? 86.625 55.496 76.666 1.00 7.40 ? 370 PHE B CD1 1 +ATOM 7828 C CD2 . PHE B 1 350 ? 84.274 55.911 76.508 1.00 7.83 ? 370 PHE B CD2 1 +ATOM 7829 C CE1 . PHE B 1 350 ? 86.437 54.193 76.186 1.00 8.60 ? 370 PHE B CE1 1 +ATOM 7830 C CE2 . PHE B 1 350 ? 84.087 54.616 76.016 1.00 8.73 ? 370 PHE B CE2 1 +ATOM 7831 C CZ . PHE B 1 350 ? 85.174 53.756 75.876 1.00 8.05 ? 370 PHE B CZ 1 +ATOM 7832 N N . ASN B 1 351 ? 85.763 60.057 79.731 1.00 7.58 ? 371 ASN B N 1 +ATOM 7833 C CA . ASN B 1 351 ? 86.433 61.065 80.527 1.00 8.13 ? 371 ASN B CA 1 +ATOM 7834 C C . ASN B 1 351 ? 86.601 60.597 81.960 1.00 8.26 ? 371 ASN B C 1 +ATOM 7835 O O . ASN B 1 351 ? 87.664 60.780 82.545 1.00 9.33 ? 371 ASN B O 1 +ATOM 7836 C CB . ASN B 1 351 ? 85.720 62.414 80.398 1.00 8.16 ? 371 ASN B CB 1 +ATOM 7837 C CG . ASN B 1 351 ? 85.951 63.044 79.028 1.00 9.68 ? 371 ASN B CG 1 +ATOM 7838 O OD1 . ASN B 1 351 ? 86.960 62.758 78.365 1.00 11.53 ? 371 ASN B OD1 1 +ATOM 7839 N ND2 . ASN B 1 351 ? 85.038 63.901 78.602 1.00 9.10 ? 371 ASN B ND2 1 +ATOM 7840 N N . LEU B 1 352 ? 85.591 59.922 82.508 1.00 8.40 ? 372 LEU B N 1 +ATOM 7841 C CA . LEU B 1 352 ? 85.698 59.368 83.862 1.00 8.34 ? 372 LEU B CA 1 +ATOM 7842 C C . LEU B 1 352 ? 86.697 58.221 83.971 1.00 8.37 ? 372 LEU B C 1 +ATOM 7843 O O . LEU B 1 352 ? 87.429 58.115 84.965 1.00 8.83 ? 372 LEU B O 1 +ATOM 7844 C CB . LEU B 1 352 ? 84.331 58.923 84.361 1.00 8.46 ? 372 LEU B CB 1 +ATOM 7845 C CG . LEU B 1 352 ? 83.413 60.102 84.690 1.00 6.74 ? 372 LEU B CG 1 +ATOM 7846 C CD1 . LEU B 1 352 ? 81.973 59.637 84.952 1.00 7.85 ? 372 LEU B CD1 1 +ATOM 7847 C CD2 . LEU B 1 352 ? 83.943 60.863 85.871 1.00 9.13 ? 372 LEU B CD2 1 +ATOM 7848 N N . LEU B 1 353 ? 86.718 57.348 82.970 1.00 8.52 ? 373 LEU B N 1 +ATOM 7849 C CA . LEU B 1 353 ? 87.704 56.256 82.936 1.00 8.45 ? 373 LEU B CA 1 +ATOM 7850 C C . LEU B 1 353 ? 89.125 56.797 82.971 1.00 8.64 ? 373 LEU B C 1 +ATOM 7851 O O . LEU B 1 353 ? 89.948 56.358 83.775 1.00 8.79 ? 373 LEU B O 1 +ATOM 7852 C CB . LEU B 1 353 ? 87.501 55.378 81.710 1.00 8.62 ? 373 LEU B CB 1 +ATOM 7853 C CG . LEU B 1 353 ? 86.253 54.476 81.767 1.00 8.51 ? 373 LEU B CG 1 +ATOM 7854 C CD1 . LEU B 1 353 ? 85.969 53.910 80.395 1.00 9.15 ? 373 LEU B CD1 1 +ATOM 7855 C CD2 . LEU B 1 353 ? 86.384 53.346 82.809 1.00 7.59 ? 373 LEU B CD2 1 +ATOM 7856 N N . ARG B 1 354 ? 89.404 57.775 82.126 1.00 8.54 ? 374 ARG B N 1 +ATOM 7857 C CA . ARG B 1 354 ? 90.738 58.373 82.080 1.00 9.82 ? 374 ARG B CA 1 +ATOM 7858 C C . ARG B 1 354 ? 91.074 59.110 83.381 1.00 9.40 ? 374 ARG B C 1 +ATOM 7859 O O . ARG B 1 354 ? 92.184 58.994 83.894 1.00 9.17 ? 374 ARG B O 1 +ATOM 7860 C CB . ARG B 1 354 ? 90.885 59.283 80.852 1.00 9.97 ? 374 ARG B CB 1 +ATOM 7861 C CG . ARG B 1 354 ? 90.991 58.470 79.553 1.00 11.53 ? 374 ARG B CG 1 +ATOM 7862 C CD . ARG B 1 354 ? 91.474 59.254 78.332 1.00 14.30 ? 374 ARG B CD 1 +ATOM 7863 N NE . ARG B 1 354 ? 92.902 59.557 78.315 1.00 18.37 ? 374 ARG B NE 1 +ATOM 7864 C CZ . ARG B 1 354 ? 93.501 60.268 77.356 1.00 20.28 ? 374 ARG B CZ 1 +ATOM 7865 N NH1 . ARG B 1 354 ? 92.810 60.742 76.319 1.00 22.23 ? 374 ARG B NH1 1 +ATOM 7866 N NH2 . ARG B 1 354 ? 94.806 60.496 77.421 1.00 21.55 ? 374 ARG B NH2 1 +ATOM 7867 N N . TRP B 1 355 ? 90.105 59.850 83.914 1.00 8.62 ? 375 TRP B N 1 +ATOM 7868 C CA . TRP B 1 355 ? 90.241 60.525 85.220 1.00 8.48 ? 375 TRP B CA 1 +ATOM 7869 C C . TRP B 1 355 ? 90.553 59.527 86.345 1.00 8.40 ? 375 TRP B C 1 +ATOM 7870 O O . TRP B 1 355 ? 91.435 59.763 87.179 1.00 9.27 ? 375 TRP B O 1 +ATOM 7871 C CB . TRP B 1 355 ? 88.935 61.268 85.524 1.00 9.03 ? 375 TRP B CB 1 +ATOM 7872 C CG . TRP B 1 355 ? 88.848 61.856 86.891 1.00 8.53 ? 375 TRP B CG 1 +ATOM 7873 C CD1 . TRP B 1 355 ? 89.289 63.084 87.292 1.00 9.97 ? 375 TRP B CD1 1 +ATOM 7874 C CD2 . TRP B 1 355 ? 88.219 61.262 88.039 1.00 8.86 ? 375 TRP B CD2 1 +ATOM 7875 N NE1 . TRP B 1 355 ? 88.992 63.287 88.627 1.00 9.58 ? 375 TRP B NE1 1 +ATOM 7876 C CE2 . TRP B 1 355 ? 88.345 62.176 89.107 1.00 8.02 ? 375 TRP B CE2 1 +ATOM 7877 C CE3 . TRP B 1 355 ? 87.586 60.036 88.272 1.00 9.68 ? 375 TRP B CE3 1 +ATOM 7878 C CZ2 . TRP B 1 355 ? 87.855 61.905 90.389 1.00 9.15 ? 375 TRP B CZ2 1 +ATOM 7879 C CZ3 . TRP B 1 355 ? 87.092 59.772 89.552 1.00 9.56 ? 375 TRP B CZ3 1 +ATOM 7880 C CH2 . TRP B 1 355 ? 87.232 60.708 90.588 1.00 9.34 ? 375 TRP B CH2 1 +ATOM 7881 N N . LEU B 1 356 ? 89.826 58.422 86.358 1.00 7.72 ? 376 LEU B N 1 +ATOM 7882 C CA . LEU B 1 356 ? 90.006 57.337 87.350 1.00 7.64 ? 376 LEU B CA 1 +ATOM 7883 C C . LEU B 1 356 ? 91.376 56.658 87.279 1.00 7.38 ? 376 LEU B C 1 +ATOM 7884 O O . LEU B 1 356 ? 91.780 55.988 88.217 1.00 7.76 ? 376 LEU B O 1 +ATOM 7885 C CB . LEU B 1 356 ? 88.934 56.272 87.133 1.00 8.05 ? 376 LEU B CB 1 +ATOM 7886 C CG . LEU B 1 356 ? 88.802 55.097 88.104 1.00 7.65 ? 376 LEU B CG 1 +ATOM 7887 C CD1 . LEU B 1 356 ? 88.558 55.590 89.523 1.00 12.61 ? 376 LEU B CD1 1 +ATOM 7888 C CD2 . LEU B 1 356 ? 87.653 54.154 87.654 1.00 8.15 ? 376 LEU B CD2 1 +ATOM 7889 N N . GLY B 1 357 ? 92.058 56.782 86.146 1.00 7.34 ? 377 GLY B N 1 +ATOM 7890 C CA . GLY B 1 357 ? 93.292 56.043 85.916 1.00 7.76 ? 377 GLY B CA 1 +ATOM 7891 C C . GLY B 1 357 ? 93.013 54.617 85.472 1.00 7.91 ? 377 GLY B C 1 +ATOM 7892 O O . GLY B 1 357 ? 93.906 53.764 85.511 1.00 9.67 ? 377 GLY B O 1 +ATOM 7893 N N . ALA B 1 358 ? 91.774 54.345 85.047 1.00 7.94 ? 378 ALA B N 1 +ATOM 7894 C CA . ALA B 1 358 ? 91.395 53.023 84.553 1.00 7.99 ? 378 ALA B CA 1 +ATOM 7895 C C . ALA B 1 358 ? 91.988 52.748 83.175 1.00 8.10 ? 378 ALA B C 1 +ATOM 7896 O O . ALA B 1 358 ? 91.879 53.575 82.270 1.00 8.54 ? 378 ALA B O 1 +ATOM 7897 C CB . ALA B 1 358 ? 89.852 52.893 84.504 1.00 7.71 ? 378 ALA B CB 1 +ATOM 7898 N N . ASN B 1 359 ? 92.602 51.582 83.009 1.00 8.51 ? 379 ASN B N 1 +ATOM 7899 C CA . ASN B 1 359 ? 93.174 51.214 81.713 1.00 8.48 ? 379 ASN B CA 1 +ATOM 7900 C C . ASN B 1 359 ? 92.439 50.121 80.968 1.00 8.83 ? 379 ASN B C 1 +ATOM 7901 O O . ASN B 1 359 ? 92.886 49.719 79.909 1.00 9.35 ? 379 ASN B O 1 +ATOM 7902 C CB . ASN B 1 359 ? 94.654 50.844 81.866 1.00 9.07 ? 379 ASN B CB 1 +ATOM 7903 C CG . ASN B 1 359 ? 94.883 49.521 82.585 1.00 9.11 ? 379 ASN B CG 1 +ATOM 7904 O OD1 . ASN B 1 359 ? 93.948 48.853 83.054 1.00 8.10 ? 379 ASN B OD1 1 +ATOM 7905 N ND2 . ASN B 1 359 ? 96.164 49.131 82.676 1.00 9.07 ? 379 ASN B ND2 1 +ATOM 7906 N N . ALA B 1 360 ? 91.289 49.693 81.492 1.00 8.24 ? 380 ALA B N 1 +ATOM 7907 C CA . ALA B 1 360 ? 90.611 48.514 80.999 1.00 8.14 ? 380 ALA B CA 1 +ATOM 7908 C C . ALA B 1 360 ? 89.183 48.457 81.496 1.00 8.09 ? 380 ALA B C 1 +ATOM 7909 O O . ALA B 1 360 ? 88.842 49.023 82.558 1.00 7.97 ? 380 ALA B O 1 +ATOM 7910 C CB . ALA B 1 360 ? 91.334 47.268 81.457 1.00 8.27 ? 380 ALA B CB 1 +ATOM 7911 N N . PHE B 1 361 ? 88.346 47.794 80.707 1.00 7.41 ? 381 PHE B N 1 +ATOM 7912 C CA . PHE B 1 361 ? 87.095 47.277 81.237 1.00 7.29 ? 381 PHE B CA 1 +ATOM 7913 C C . PHE B 1 361 ? 86.662 46.013 80.551 1.00 7.34 ? 381 PHE B C 1 +ATOM 7914 O O . PHE B 1 361 ? 87.107 45.704 79.439 1.00 7.43 ? 381 PHE B O 1 +ATOM 7915 C CB . PHE B 1 361 ? 85.953 48.315 81.288 1.00 7.73 ? 381 PHE B CB 1 +ATOM 7916 C CG . PHE B 1 361 ? 85.531 48.862 79.959 1.00 7.79 ? 381 PHE B CG 1 +ATOM 7917 C CD1 . PHE B 1 361 ? 84.611 48.183 79.169 1.00 8.79 ? 381 PHE B CD1 1 +ATOM 7918 C CD2 . PHE B 1 361 ? 85.996 50.094 79.527 1.00 6.82 ? 381 PHE B CD2 1 +ATOM 7919 C CE1 . PHE B 1 361 ? 84.189 48.706 77.950 1.00 9.72 ? 381 PHE B CE1 1 +ATOM 7920 C CE2 . PHE B 1 361 ? 85.588 50.619 78.309 1.00 9.17 ? 381 PHE B CE2 1 +ATOM 7921 C CZ . PHE B 1 361 ? 84.671 49.940 77.531 1.00 8.62 ? 381 PHE B CZ 1 +ATOM 7922 N N . ARG B 1 362 ? 85.819 45.268 81.258 1.00 7.15 ? 382 ARG B N 1 +ATOM 7923 C CA . ARG B 1 362 ? 85.163 44.092 80.720 1.00 6.94 ? 382 ARG B CA 1 +ATOM 7924 C C . ARG B 1 362 ? 83.763 44.533 80.304 1.00 6.83 ? 382 ARG B C 1 +ATOM 7925 O O . ARG B 1 362 ? 83.134 45.306 81.032 1.00 6.80 ? 382 ARG B O 1 +ATOM 7926 C CB . ARG B 1 362 ? 85.020 43.009 81.786 1.00 7.15 ? 382 ARG B CB 1 +ATOM 7927 C CG . ARG B 1 362 ? 84.256 41.791 81.293 1.00 7.67 ? 382 ARG B CG 1 +ATOM 7928 C CD . ARG B 1 362 ? 84.386 40.624 82.248 1.00 8.19 ? 382 ARG B CD 1 +ATOM 7929 N NE . ARG B 1 362 ? 83.924 40.907 83.613 1.00 9.35 ? 382 ARG B NE 1 +ATOM 7930 C CZ . ARG B 1 362 ? 82.993 40.206 84.262 1.00 9.23 ? 382 ARG B CZ 1 +ATOM 7931 N NH1 . ARG B 1 362 ? 82.386 39.183 83.686 1.00 8.76 ? 382 ARG B NH1 1 +ATOM 7932 N NH2 . ARG B 1 362 ? 82.673 40.516 85.508 1.00 9.65 ? 382 ARG B NH2 1 +ATOM 7933 N N . THR B 1 363 ? 83.272 44.034 79.169 1.00 6.60 ? 383 THR B N 1 +ATOM 7934 C CA . THR B 1 363 ? 81.897 44.334 78.719 1.00 6.80 ? 383 THR B CA 1 +ATOM 7935 C C . THR B 1 363 ? 80.895 43.422 79.441 1.00 6.97 ? 383 THR B C 1 +ATOM 7936 O O . THR B 1 363 ? 80.207 42.589 78.828 1.00 7.42 ? 383 THR B O 1 +ATOM 7937 C CB . THR B 1 363 ? 81.729 44.265 77.176 1.00 7.45 ? 383 THR B CB 1 +ATOM 7938 O OG1 . THR B 1 363 ? 81.761 42.904 76.714 1.00 7.65 ? 383 THR B OG1 1 +ATOM 7939 C CG2 . THR B 1 363 ? 82.804 45.072 76.466 1.00 5.32 ? 383 THR B CG2 1 +ATOM 7940 N N . SER B 1 364 ? 80.852 43.554 80.761 1.00 6.54 ? 384 SER B N 1 +ATOM 7941 C CA . SER B 1 364 ? 79.860 42.851 81.552 1.00 6.87 ? 384 SER B CA 1 +ATOM 7942 C C . SER B 1 364 ? 78.472 43.316 81.109 1.00 6.51 ? 384 SER B C 1 +ATOM 7943 O O . SER B 1 364 ? 78.230 44.533 81.085 1.00 7.22 ? 384 SER B O 1 +ATOM 7944 C CB . SER B 1 364 ? 80.057 43.144 83.041 1.00 6.18 ? 384 SER B CB 1 +ATOM 7945 O OG . SER B 1 364 ? 80.449 44.485 83.265 1.00 7.84 ? 384 SER B OG 1 +ATOM 7946 N N . HIS B 1 365 ? 77.559 42.414 80.727 1.00 7.56 ? 385 HIS B N 1 +ATOM 7947 C CA . HIS B 1 365 ? 77.808 40.996 80.429 1.00 7.08 ? 385 HIS B CA 1 +ATOM 7948 C C . HIS B 1 365 ? 77.224 40.691 79.042 1.00 7.39 ? 385 HIS B C 1 +ATOM 7949 O O . HIS B 1 365 ? 76.330 39.851 78.906 1.00 8.52 ? 385 HIS B O 1 +ATOM 7950 C CB . HIS B 1 365 ? 77.122 40.100 81.460 1.00 7.33 ? 385 HIS B CB 1 +ATOM 7951 C CG . HIS B 1 365 ? 77.616 40.294 82.854 1.00 6.79 ? 385 HIS B CG 1 +ATOM 7952 N ND1 . HIS B 1 365 ? 78.908 39.994 83.228 1.00 7.86 ? 385 HIS B ND1 1 +ATOM 7953 C CD2 . HIS B 1 365 ? 76.998 40.751 83.965 1.00 8.97 ? 385 HIS B CD2 1 +ATOM 7954 C CE1 . HIS B 1 365 ? 79.067 40.276 84.509 1.00 8.49 ? 385 HIS B CE1 1 +ATOM 7955 N NE2 . HIS B 1 365 ? 77.919 40.726 84.982 1.00 8.77 ? 385 HIS B NE2 1 +ATOM 7956 N N . TYR B 1 366 ? 77.716 41.402 78.035 1.00 6.58 ? 386 TYR B N 1 +ATOM 7957 C CA . TYR B 1 366 ? 77.199 41.363 76.665 1.00 6.76 ? 386 TYR B CA 1 +ATOM 7958 C C . TYR B 1 366 ? 78.068 42.313 75.836 1.00 7.40 ? 386 TYR B C 1 +ATOM 7959 O O . TYR B 1 366 ? 78.692 43.207 76.386 1.00 7.23 ? 386 TYR B O 1 +ATOM 7960 C CB . TYR B 1 366 ? 75.707 41.772 76.606 1.00 6.56 ? 386 TYR B CB 1 +ATOM 7961 C CG . TYR B 1 366 ? 75.405 42.930 77.519 1.00 6.32 ? 386 TYR B CG 1 +ATOM 7962 C CD1 . TYR B 1 366 ? 75.736 44.232 77.140 1.00 6.60 ? 386 TYR B CD1 1 +ATOM 7963 C CD2 . TYR B 1 366 ? 74.830 42.734 78.765 1.00 5.69 ? 386 TYR B CD2 1 +ATOM 7964 C CE1 . TYR B 1 366 ? 75.490 45.303 77.982 1.00 6.73 ? 386 TYR B CE1 1 +ATOM 7965 C CE2 . TYR B 1 366 ? 74.597 43.818 79.627 1.00 4.43 ? 386 TYR B CE2 1 +ATOM 7966 C CZ . TYR B 1 366 ? 74.934 45.079 79.227 1.00 6.13 ? 386 TYR B CZ 1 +ATOM 7967 O OH . TYR B 1 366 ? 74.720 46.142 80.081 1.00 7.81 ? 386 TYR B OH 1 +ATOM 7968 N N . PRO B 1 367 ? 78.143 42.100 74.517 1.00 8.19 ? 387 PRO B N 1 +ATOM 7969 C CA . PRO B 1 367 ? 78.895 43.065 73.714 1.00 8.19 ? 387 PRO B CA 1 +ATOM 7970 C C . PRO B 1 367 ? 78.217 44.412 73.783 1.00 8.06 ? 387 PRO B C 1 +ATOM 7971 O O . PRO B 1 367 ? 76.983 44.471 73.778 1.00 7.95 ? 387 PRO B O 1 +ATOM 7972 C CB . PRO B 1 367 ? 78.811 42.502 72.299 1.00 8.76 ? 387 PRO B CB 1 +ATOM 7973 C CG . PRO B 1 367 ? 78.325 41.136 72.443 1.00 8.89 ? 387 PRO B CG 1 +ATOM 7974 C CD . PRO B 1 367 ? 77.591 41.012 73.703 1.00 8.13 ? 387 PRO B CD 1 +ATOM 7975 N N . TYR B 1 368 ? 79.016 45.465 73.883 1.00 8.15 ? 388 TYR B N 1 +ATOM 7976 C CA . TYR B 1 368 ? 78.501 46.843 73.931 1.00 8.15 ? 388 TYR B CA 1 +ATOM 7977 C C . TYR B 1 368 ? 78.388 47.407 72.517 1.00 8.26 ? 388 TYR B C 1 +ATOM 7978 O O . TYR B 1 368 ? 78.830 46.779 71.561 1.00 8.23 ? 388 TYR B O 1 +ATOM 7979 C CB . TYR B 1 368 ? 79.405 47.741 74.786 1.00 8.54 ? 388 TYR B CB 1 +ATOM 7980 C CG . TYR B 1 368 ? 79.468 47.424 76.274 1.00 8.30 ? 388 TYR B CG 1 +ATOM 7981 C CD1 . TYR B 1 368 ? 78.661 46.435 76.862 1.00 7.37 ? 388 TYR B CD1 1 +ATOM 7982 C CD2 . TYR B 1 368 ? 80.329 48.135 77.103 1.00 9.66 ? 388 TYR B CD2 1 +ATOM 7983 C CE1 . TYR B 1 368 ? 78.724 46.185 78.194 1.00 7.96 ? 388 TYR B CE1 1 +ATOM 7984 C CE2 . TYR B 1 368 ? 80.400 47.875 78.452 1.00 8.84 ? 388 TYR B CE2 1 +ATOM 7985 C CZ . TYR B 1 368 ? 79.600 46.901 79.000 1.00 6.82 ? 388 TYR B CZ 1 +ATOM 7986 O OH . TYR B 1 368 ? 79.687 46.648 80.350 1.00 7.87 ? 388 TYR B OH 1 +ATOM 7987 N N . ALA B 1 369 ? 77.767 48.575 72.370 1.00 7.75 ? 389 ALA B N 1 +ATOM 7988 C CA . ALA B 1 369 ? 77.660 49.246 71.066 1.00 7.92 ? 389 ALA B CA 1 +ATOM 7989 C C . ALA B 1 369 ? 79.034 49.338 70.398 1.00 8.35 ? 389 ALA B C 1 +ATOM 7990 O O . ALA B 1 369 ? 80.043 49.541 71.063 1.00 7.59 ? 389 ALA B O 1 +ATOM 7991 C CB . ALA B 1 369 ? 77.072 50.646 71.245 1.00 8.21 ? 389 ALA B CB 1 +ATOM 7992 N N . GLU B 1 370 ? 79.065 49.202 69.081 1.00 8.20 ? 390 GLU B N 1 +ATOM 7993 C CA . GLU B 1 370 ? 80.328 49.308 68.332 1.00 9.16 ? 390 GLU B CA 1 +ATOM 7994 C C . GLU B 1 370 ? 81.060 50.618 68.617 1.00 9.41 ? 390 GLU B C 1 +ATOM 7995 O O . GLU B 1 370 ? 82.288 50.646 68.744 1.00 9.43 ? 390 GLU B O 1 +ATOM 7996 C CB . GLU B 1 370 ? 80.067 49.150 66.833 1.00 10.01 ? 390 GLU B CB 1 +ATOM 7997 C CG A GLU B 1 370 ? 79.505 47.800 66.424 0.50 9.01 ? 390 GLU B CG 1 +ATOM 7998 C CG B GLU B 1 370 ? 79.599 47.740 66.466 0.50 9.94 ? 390 GLU B CG 1 +ATOM 7999 C CD A GLU B 1 370 ? 78.000 47.830 66.167 0.50 8.81 ? 390 GLU B CD 1 +ATOM 8000 C CD B GLU B 1 370 ? 78.905 47.655 65.125 0.50 11.72 ? 390 GLU B CD 1 +ATOM 8001 O OE1 A GLU B 1 370 ? 77.229 48.316 67.029 0.50 8.47 ? 390 GLU B OE1 1 +ATOM 8002 O OE1 B GLU B 1 370 ? 77.822 48.278 64.982 0.50 11.12 ? 390 GLU B OE1 1 +ATOM 8003 O OE2 A GLU B 1 370 ? 77.595 47.351 65.084 0.50 9.74 ? 390 GLU B OE2 1 +ATOM 8004 O OE2 B GLU B 1 370 ? 79.436 46.957 64.226 0.50 12.09 ? 390 GLU B OE2 1 +ATOM 8005 N N . GLU B 1 371 ? 80.299 51.694 68.737 1.00 9.49 ? 391 GLU B N 1 +ATOM 8006 C CA . GLU B 1 371 ? 80.873 53.010 69.032 1.00 9.71 ? 391 GLU B CA 1 +ATOM 8007 C C . GLU B 1 371 ? 81.729 53.006 70.311 1.00 9.24 ? 391 GLU B C 1 +ATOM 8008 O O . GLU B 1 371 ? 82.703 53.748 70.404 1.00 9.48 ? 391 GLU B O 1 +ATOM 8009 C CB . GLU B 1 371 ? 79.776 54.063 69.122 1.00 9.87 ? 391 GLU B CB 1 +ATOM 8010 C CG . GLU B 1 371 ? 79.015 54.309 67.829 1.00 11.75 ? 391 GLU B CG 1 +ATOM 8011 C CD . GLU B 1 371 ? 77.708 53.514 67.737 1.00 15.67 ? 391 GLU B CD 1 +ATOM 8012 O OE1 . GLU B 1 371 ? 77.668 52.355 68.187 1.00 14.15 ? 391 GLU B OE1 1 +ATOM 8013 O OE2 . GLU B 1 371 ? 76.709 54.068 67.222 1.00 21.48 ? 391 GLU B OE2 1 +ATOM 8014 N N . VAL B 1 372 ? 81.363 52.173 71.286 1.00 8.41 ? 392 VAL B N 1 +ATOM 8015 C CA . VAL B 1 372 ? 82.132 52.031 72.534 1.00 8.31 ? 392 VAL B CA 1 +ATOM 8016 C C . VAL B 1 372 ? 83.494 51.366 72.261 1.00 8.88 ? 392 VAL B C 1 +ATOM 8017 O O . VAL B 1 372 ? 84.525 51.783 72.784 1.00 8.89 ? 392 VAL B O 1 +ATOM 8018 C CB . VAL B 1 372 ? 81.345 51.205 73.588 1.00 7.94 ? 392 VAL B CB 1 +ATOM 8019 C CG1 . VAL B 1 372 ? 82.140 51.052 74.862 1.00 9.07 ? 392 VAL B CG1 1 +ATOM 8020 C CG2 . VAL B 1 372 ? 79.965 51.843 73.878 1.00 7.12 ? 392 VAL B CG2 1 +ATOM 8021 N N . MET B 1 373 ? 83.494 50.321 71.440 1.00 8.72 ? 393 MET B N 1 +ATOM 8022 C CA . MET B 1 373 ? 84.754 49.691 71.036 1.00 8.95 ? 393 MET B CA 1 +ATOM 8023 C C . MET B 1 373 ? 85.634 50.677 70.264 1.00 9.09 ? 393 MET B C 1 +ATOM 8024 O O . MET B 1 373 ? 86.856 50.727 70.455 1.00 9.30 ? 393 MET B O 1 +ATOM 8025 C CB . MET B 1 373 ? 84.478 48.435 70.199 1.00 8.97 ? 393 MET B CB 1 +ATOM 8026 C CG . MET B 1 373 ? 83.636 47.380 70.922 1.00 9.30 ? 393 MET B CG 1 +ATOM 8027 S SD . MET B 1 373 ? 84.414 46.711 72.402 1.00 10.89 ? 393 MET B SD 1 +ATOM 8028 C CE . MET B 1 373 ? 83.719 47.787 73.662 1.00 11.91 ? 393 MET B CE 1 +ATOM 8029 N N . GLN B 1 374 ? 85.031 51.468 69.385 1.00 9.33 ? 394 GLN B N 1 +ATOM 8030 C CA . GLN B 1 374 ? 85.809 52.449 68.631 1.00 9.80 ? 394 GLN B CA 1 +ATOM 8031 C C . GLN B 1 374 ? 86.467 53.480 69.570 1.00 9.46 ? 394 GLN B C 1 +ATOM 8032 O O . GLN B 1 374 ? 87.621 53.861 69.363 1.00 10.80 ? 394 GLN B O 1 +ATOM 8033 C CB . GLN B 1 374 ? 84.932 53.144 67.602 1.00 10.04 ? 394 GLN B CB 1 +ATOM 8034 C CG A GLN B 1 374 ? 84.460 52.208 66.513 0.50 10.64 ? 394 GLN B CG 1 +ATOM 8035 C CG B GLN B 1 374 ? 84.426 52.253 66.494 0.50 11.69 ? 394 GLN B CG 1 +ATOM 8036 C CD A GLN B 1 374 ? 83.419 52.821 65.636 0.50 10.63 ? 394 GLN B CD 1 +ATOM 8037 C CD B GLN B 1 374 ? 83.648 53.024 65.463 0.50 13.60 ? 394 GLN B CD 1 +ATOM 8038 O OE1 A GLN B 1 374 ? 83.425 54.038 65.399 0.50 13.15 ? 394 GLN B OE1 1 +ATOM 8039 O OE1 B GLN B 1 374 ? 82.524 53.477 65.720 0.50 14.56 ? 394 GLN B OE1 1 +ATOM 8040 N NE2 A GLN B 1 374 ? 82.522 51.983 65.111 0.50 7.03 ? 394 GLN B NE2 1 +ATOM 8041 N NE2 B GLN B 1 374 ? 84.239 53.187 64.277 0.50 14.06 ? 394 GLN B NE2 1 +ATOM 8042 N N . MET B 1 375 ? 85.760 53.890 70.622 1.00 9.25 ? 395 MET B N 1 +ATOM 8043 C CA . MET B 1 375 ? 86.317 54.830 71.605 1.00 9.48 ? 395 MET B CA 1 +ATOM 8044 C C . MET B 1 375 ? 87.480 54.178 72.342 1.00 8.96 ? 395 MET B C 1 +ATOM 8045 O O . MET B 1 375 ? 88.508 54.803 72.565 1.00 9.52 ? 395 MET B O 1 +ATOM 8046 C CB . MET B 1 375 ? 85.248 55.260 72.616 1.00 9.49 ? 395 MET B CB 1 +ATOM 8047 C CG . MET B 1 375 ? 84.164 56.132 72.031 1.00 11.50 ? 395 MET B CG 1 +ATOM 8048 S SD . MET B 1 375 ? 84.651 57.878 71.940 1.00 16.27 ? 395 MET B SD 1 +ATOM 8049 C CE . MET B 1 375 ? 84.692 58.290 73.676 1.00 9.35 ? 395 MET B CE 1 +ATOM 8050 N N . CYS B 1 376 ? 87.329 52.903 72.704 1.00 8.48 ? 396 CYS B N 1 +ATOM 8051 C CA . CYS B 1 376 ? 88.398 52.155 73.364 1.00 8.26 ? 396 CYS B CA 1 +ATOM 8052 C C . CYS B 1 376 ? 89.667 52.159 72.518 1.00 8.62 ? 396 CYS B C 1 +ATOM 8053 O O . CYS B 1 376 ? 90.758 52.384 73.049 1.00 8.35 ? 396 CYS B O 1 +ATOM 8054 C CB . CYS B 1 376 ? 87.977 50.705 73.632 1.00 8.70 ? 396 CYS B CB 1 +ATOM 8055 S SG . CYS B 1 376 ? 86.679 50.524 74.852 1.00 8.59 ? 396 CYS B SG 1 +ATOM 8056 N N . ASP B 1 377 ? 89.528 51.911 71.213 1.00 8.62 ? 397 ASP B N 1 +ATOM 8057 C CA . ASP B 1 377 ? 90.700 51.925 70.307 1.00 9.11 ? 397 ASP B CA 1 +ATOM 8058 C C . ASP B 1 377 ? 91.433 53.266 70.346 1.00 9.46 ? 397 ASP B C 1 +ATOM 8059 O O . ASP B 1 377 ? 92.668 53.320 70.311 1.00 9.19 ? 397 ASP B O 1 +ATOM 8060 C CB . ASP B 1 377 ? 90.285 51.645 68.862 1.00 9.23 ? 397 ASP B CB 1 +ATOM 8061 C CG . ASP B 1 377 ? 89.905 50.188 68.614 1.00 9.66 ? 397 ASP B CG 1 +ATOM 8062 O OD1 . ASP B 1 377 ? 90.207 49.317 69.459 1.00 10.38 ? 397 ASP B OD1 1 +ATOM 8063 O OD2 . ASP B 1 377 ? 89.306 49.927 67.546 1.00 12.78 ? 397 ASP B OD2 1 +ATOM 8064 N N . ARG B 1 378 ? 90.664 54.343 70.424 1.00 9.45 ? 398 ARG B N 1 +ATOM 8065 C CA . ARG B 1 378 ? 91.201 55.694 70.317 1.00 9.96 ? 398 ARG B CA 1 +ATOM 8066 C C . ARG B 1 378 ? 91.721 56.227 71.651 1.00 9.40 ? 398 ARG B C 1 +ATOM 8067 O O . ARG B 1 378 ? 92.655 57.020 71.668 1.00 9.75 ? 398 ARG B O 1 +ATOM 8068 C CB . ARG B 1 378 ? 90.143 56.628 69.739 1.00 10.14 ? 398 ARG B CB 1 +ATOM 8069 C CG . ARG B 1 378 ? 89.742 56.238 68.322 1.00 11.52 ? 398 ARG B CG 1 +ATOM 8070 C CD . ARG B 1 378 ? 88.615 57.108 67.787 1.00 14.15 ? 398 ARG B CD 1 +ATOM 8071 N NE . ARG B 1 378 ? 88.944 58.526 67.919 1.00 13.72 ? 398 ARG B NE 1 +ATOM 8072 C CZ . ARG B 1 378 ? 88.298 59.413 68.676 1.00 14.24 ? 398 ARG B CZ 1 +ATOM 8073 N NH1 . ARG B 1 378 ? 87.210 59.088 69.364 1.00 14.35 ? 398 ARG B NH1 1 +ATOM 8074 N NH2 . ARG B 1 378 ? 88.736 60.665 68.694 1.00 15.86 ? 398 ARG B NH2 1 +ATOM 8075 N N . TYR B 1 379 ? 91.142 55.763 72.755 1.00 8.97 ? 399 TYR B N 1 +ATOM 8076 C CA . TYR B 1 379 ? 91.531 56.181 74.110 1.00 9.44 ? 399 TYR B CA 1 +ATOM 8077 C C . TYR B 1 379 ? 92.509 55.218 74.831 1.00 9.41 ? 399 TYR B C 1 +ATOM 8078 O O . TYR B 1 379 ? 92.995 55.544 75.914 1.00 10.29 ? 399 TYR B O 1 +ATOM 8079 C CB . TYR B 1 379 ? 90.281 56.347 74.980 1.00 9.01 ? 399 TYR B CB 1 +ATOM 8080 C CG . TYR B 1 379 ? 89.436 57.566 74.654 1.00 10.53 ? 399 TYR B CG 1 +ATOM 8081 C CD1 . TYR B 1 379 ? 88.865 57.744 73.398 1.00 9.57 ? 399 TYR B CD1 1 +ATOM 8082 C CD2 . TYR B 1 379 ? 89.205 58.540 75.615 1.00 10.55 ? 399 TYR B CD2 1 +ATOM 8083 C CE1 . TYR B 1 379 ? 88.106 58.881 73.105 1.00 10.53 ? 399 TYR B CE1 1 +ATOM 8084 C CE2 . TYR B 1 379 ? 88.442 59.660 75.335 1.00 10.67 ? 399 TYR B CE2 1 +ATOM 8085 C CZ . TYR B 1 379 ? 87.895 59.828 74.082 1.00 9.93 ? 399 TYR B CZ 1 +ATOM 8086 O OH . TYR B 1 379 ? 87.146 60.952 73.816 1.00 10.93 ? 399 TYR B OH 1 +ATOM 8087 N N . GLY B 1 380 ? 92.777 54.045 74.253 1.00 9.10 ? 400 GLY B N 1 +ATOM 8088 C CA . GLY B 1 380 ? 93.718 53.086 74.827 1.00 8.58 ? 400 GLY B CA 1 +ATOM 8089 C C . GLY B 1 380 ? 93.177 52.299 76.008 1.00 8.58 ? 400 GLY B C 1 +ATOM 8090 O O . GLY B 1 380 ? 93.936 51.835 76.855 1.00 8.23 ? 400 GLY B O 1 +ATOM 8091 N N . ILE B 1 381 ? 91.856 52.148 76.081 1.00 7.58 ? 401 ILE B N 1 +ATOM 8092 C CA . ILE B 1 381 ? 91.247 51.397 77.172 1.00 8.09 ? 401 ILE B CA 1 +ATOM 8093 C C . ILE B 1 381 ? 91.033 49.972 76.669 1.00 7.54 ? 401 ILE B C 1 +ATOM 8094 O O . ILE B 1 381 ? 90.223 49.752 75.774 1.00 7.39 ? 401 ILE B O 1 +ATOM 8095 C CB . ILE B 1 381 ? 89.873 51.997 77.582 1.00 7.65 ? 401 ILE B CB 1 +ATOM 8096 C CG1 . ILE B 1 381 ? 89.985 53.487 77.913 1.00 8.55 ? 401 ILE B CG1 1 +ATOM 8097 C CG2 . ILE B 1 381 ? 89.324 51.271 78.787 1.00 8.18 ? 401 ILE B CG2 1 +ATOM 8098 C CD1 . ILE B 1 381 ? 90.862 53.823 79.126 1.00 9.36 ? 401 ILE B CD1 1 +ATOM 8099 N N . VAL B 1 382 ? 91.770 49.013 77.216 1.00 8.23 ? 402 VAL B N 1 +ATOM 8100 C CA . VAL B 1 382 ? 91.695 47.638 76.696 1.00 7.91 ? 402 VAL B CA 1 +ATOM 8101 C C . VAL B 1 382 ? 90.408 46.992 77.175 1.00 8.29 ? 402 VAL B C 1 +ATOM 8102 O O . VAL B 1 382 ? 89.822 47.397 78.192 1.00 8.19 ? 402 VAL B O 1 +ATOM 8103 C CB . VAL B 1 382 ? 92.916 46.789 77.054 1.00 8.30 ? 402 VAL B CB 1 +ATOM 8104 C CG1 . VAL B 1 382 ? 94.194 47.531 76.655 1.00 8.83 ? 402 VAL B CG1 1 +ATOM 8105 C CG2 . VAL B 1 382 ? 92.922 46.412 78.541 1.00 8.29 ? 402 VAL B CG2 1 +ATOM 8106 N N . VAL B 1 383 ? 89.970 46.004 76.417 1.00 8.24 ? 403 VAL B N 1 +ATOM 8107 C CA . VAL B 1 383 ? 88.662 45.413 76.605 1.00 8.24 ? 403 VAL B CA 1 +ATOM 8108 C C . VAL B 1 383 ? 88.733 43.878 76.741 1.00 8.20 ? 403 VAL B C 1 +ATOM 8109 O O . VAL B 1 383 ? 89.408 43.173 75.960 1.00 8.04 ? 403 VAL B O 1 +ATOM 8110 C CB . VAL B 1 383 ? 87.722 45.807 75.448 1.00 8.17 ? 403 VAL B CB 1 +ATOM 8111 C CG1 . VAL B 1 383 ? 86.395 45.023 75.543 1.00 9.63 ? 403 VAL B CG1 1 +ATOM 8112 C CG2 . VAL B 1 383 ? 87.511 47.316 75.417 1.00 9.49 ? 403 VAL B CG2 1 +ATOM 8113 N N . ILE B 1 384 ? 88.061 43.371 77.771 1.00 7.25 ? 404 ILE B N 1 +ATOM 8114 C CA . ILE B 1 384 ? 87.717 41.958 77.846 1.00 7.07 ? 404 ILE B CA 1 +ATOM 8115 C C . ILE B 1 384 ? 86.310 41.901 77.265 1.00 6.56 ? 404 ILE B C 1 +ATOM 8116 O O . ILE B 1 384 ? 85.361 42.345 77.895 1.00 6.69 ? 404 ILE B O 1 +ATOM 8117 C CB . ILE B 1 384 ? 87.772 41.400 79.283 1.00 7.20 ? 404 ILE B CB 1 +ATOM 8118 C CG1 . ILE B 1 384 ? 89.194 41.476 79.836 1.00 8.47 ? 404 ILE B CG1 1 +ATOM 8119 C CG2 . ILE B 1 384 ? 87.291 39.934 79.302 1.00 6.30 ? 404 ILE B CG2 1 +ATOM 8120 C CD1 . ILE B 1 384 ? 89.286 41.236 81.327 1.00 10.27 ? 404 ILE B CD1 1 +ATOM 8121 N N . ASP B 1 385 ? 86.201 41.406 76.034 1.00 6.60 ? 405 ASP B N 1 +ATOM 8122 C CA . ASP B 1 385 ? 84.958 41.448 75.262 1.00 6.69 ? 405 ASP B CA 1 +ATOM 8123 C C . ASP B 1 385 ? 84.143 40.184 75.541 1.00 7.01 ? 405 ASP B C 1 +ATOM 8124 O O . ASP B 1 385 ? 84.580 39.060 75.221 1.00 6.71 ? 405 ASP B O 1 +ATOM 8125 C CB . ASP B 1 385 ? 85.314 41.597 73.772 1.00 6.56 ? 405 ASP B CB 1 +ATOM 8126 C CG . ASP B 1 385 ? 84.204 42.178 72.923 1.00 7.28 ? 405 ASP B CG 1 +ATOM 8127 O OD1 . ASP B 1 385 ? 83.052 42.338 73.387 1.00 8.55 ? 405 ASP B OD1 1 +ATOM 8128 O OD2 . ASP B 1 385 ? 84.515 42.495 71.747 1.00 7.35 ? 405 ASP B OD2 1 +ATOM 8129 N N . GLU B 1 386 ? 82.967 40.369 76.148 1.00 7.59 ? 406 GLU B N 1 +ATOM 8130 C CA . GLU B 1 386 ? 82.201 39.282 76.738 1.00 8.16 ? 406 GLU B CA 1 +ATOM 8131 C C . GLU B 1 386 ? 80.859 39.121 76.059 1.00 8.59 ? 406 GLU B C 1 +ATOM 8132 O O . GLU B 1 386 ? 80.130 40.084 75.881 1.00 9.01 ? 406 GLU B O 1 +ATOM 8133 C CB . GLU B 1 386 ? 81.981 39.534 78.241 1.00 8.16 ? 406 GLU B CB 1 +ATOM 8134 C CG . GLU B 1 386 ? 81.265 38.374 78.963 1.00 8.08 ? 406 GLU B CG 1 +ATOM 8135 C CD . GLU B 1 386 ? 81.351 38.494 80.453 1.00 7.71 ? 406 GLU B CD 1 +ATOM 8136 O OE1 . GLU B 1 386 ? 82.428 38.193 81.007 1.00 8.49 ? 406 GLU B OE1 1 +ATOM 8137 O OE2 . GLU B 1 386 ? 80.327 38.876 81.070 1.00 6.00 ? 406 GLU B OE2 1 +ATOM 8138 N N . CYS B 1 387 ? 80.526 37.889 75.697 1.00 8.78 ? 407 CYS B N 1 +ATOM 8139 C CA . CYS B 1 387 ? 79.248 37.619 75.080 1.00 9.52 ? 407 CYS B CA 1 +ATOM 8140 C C . CYS B 1 387 ? 78.162 37.569 76.159 1.00 9.35 ? 407 CYS B C 1 +ATOM 8141 O O . CYS B 1 387 ? 78.472 37.554 77.349 1.00 9.39 ? 407 CYS B O 1 +ATOM 8142 C CB . CYS B 1 387 ? 79.307 36.304 74.330 1.00 9.73 ? 407 CYS B CB 1 +ATOM 8143 S SG . CYS B 1 387 ? 79.381 34.932 75.421 1.00 12.35 ? 407 CYS B SG 1 +ATOM 8144 N N . PRO B 1 388 ? 76.883 37.529 75.752 1.00 9.25 ? 408 PRO B N 1 +ATOM 8145 C CA . PRO B 1 388 ? 75.801 37.438 76.725 1.00 8.68 ? 408 PRO B CA 1 +ATOM 8146 C C . PRO B 1 388 ? 75.595 36.089 77.448 1.00 9.05 ? 408 PRO B C 1 +ATOM 8147 O O . PRO B 1 388 ? 74.470 35.817 77.875 1.00 8.99 ? 408 PRO B O 1 +ATOM 8148 C CB . PRO B 1 388 ? 74.554 37.782 75.894 1.00 9.02 ? 408 PRO B CB 1 +ATOM 8149 C CG . PRO B 1 388 ? 75.026 38.240 74.586 1.00 9.24 ? 408 PRO B CG 1 +ATOM 8150 C CD . PRO B 1 388 ? 76.368 37.635 74.383 1.00 9.60 ? 408 PRO B CD 1 +ATOM 8151 N N . GLY B 1 389 ? 76.659 35.302 77.641 1.00 8.31 ? 409 GLY B N 1 +ATOM 8152 C CA . GLY B 1 389 ? 76.607 34.009 78.318 1.00 8.67 ? 409 GLY B CA 1 +ATOM 8153 C C . GLY B 1 389 ? 76.566 34.138 79.824 1.00 8.45 ? 409 GLY B C 1 +ATOM 8154 O O . GLY B 1 389 ? 77.387 33.547 80.544 1.00 8.70 ? 409 GLY B O 1 +ATOM 8155 N N . VAL B 1 390 ? 75.569 34.882 80.293 1.00 8.40 ? 410 VAL B N 1 +ATOM 8156 C CA . VAL B 1 390 ? 75.380 35.177 81.697 1.00 8.30 ? 410 VAL B CA 1 +ATOM 8157 C C . VAL B 1 390 ? 74.045 34.622 82.158 1.00 8.58 ? 410 VAL B C 1 +ATOM 8158 O O . VAL B 1 390 ? 73.089 34.587 81.399 1.00 9.18 ? 410 VAL B O 1 +ATOM 8159 C CB . VAL B 1 390 ? 75.390 36.705 81.957 1.00 8.37 ? 410 VAL B CB 1 +ATOM 8160 C CG1 . VAL B 1 390 ? 74.236 37.346 81.264 1.00 7.53 ? 410 VAL B CG1 1 +ATOM 8161 C CG2 . VAL B 1 390 ? 75.354 36.965 83.445 1.00 8.42 ? 410 VAL B CG2 1 +ATOM 8162 N N . GLY B 1 391 ? 74.000 34.166 83.400 1.00 9.01 ? 411 GLY B N 1 +ATOM 8163 C CA . GLY B 1 391 ? 72.796 33.559 83.941 1.00 9.66 ? 411 GLY B CA 1 +ATOM 8164 C C . GLY B 1 391 ? 72.653 32.065 83.684 1.00 10.02 ? 411 GLY B C 1 +ATOM 8165 O O . GLY B 1 391 ? 71.550 31.530 83.823 1.00 9.98 ? 411 GLY B O 1 +ATOM 8166 N N . LEU B 1 392 ? 73.751 31.379 83.343 1.00 9.99 ? 412 LEU B N 1 +ATOM 8167 C CA . LEU B 1 392 ? 73.716 29.900 83.087 1.00 11.10 ? 412 LEU B CA 1 +ATOM 8168 C C . LEU B 1 392 ? 73.750 29.137 84.404 1.00 11.52 ? 412 LEU B C 1 +ATOM 8169 O O . LEU B 1 392 ? 74.722 28.446 84.736 1.00 11.33 ? 412 LEU B O 1 +ATOM 8170 C CB . LEU B 1 392 ? 74.882 29.451 82.188 1.00 11.07 ? 412 LEU B CB 1 +ATOM 8171 C CG . LEU B 1 392 ? 74.742 29.686 80.679 1.00 11.92 ? 412 LEU B CG 1 +ATOM 8172 C CD1 . LEU B 1 392 ? 74.352 31.102 80.369 1.00 12.05 ? 412 LEU B CD1 1 +ATOM 8173 C CD2 . LEU B 1 392 ? 76.050 29.311 79.976 1.00 12.04 ? 412 LEU B CD2 1 +ATOM 8174 N N . ALA B 1 393 ? 72.671 29.257 85.160 1.00 12.07 ? 413 ALA B N 1 +ATOM 8175 C CA . ALA B 1 393 ? 72.653 28.821 86.550 1.00 13.66 ? 413 ALA B CA 1 +ATOM 8176 C C . ALA B 1 393 ? 72.029 27.437 86.768 1.00 14.12 ? 413 ALA B C 1 +ATOM 8177 O O . ALA B 1 393 ? 72.289 26.776 87.799 1.00 14.92 ? 413 ALA B O 1 +ATOM 8178 C CB . ALA B 1 393 ? 71.940 29.884 87.394 1.00 13.03 ? 413 ALA B CB 1 +ATOM 8179 N N . LEU B 1 394 ? 71.232 26.988 85.796 1.00 14.82 ? 414 LEU B N 1 +ATOM 8180 C CA . LEU B 1 394 ? 70.488 25.738 85.910 1.00 15.08 ? 414 LEU B CA 1 +ATOM 8181 C C . LEU B 1 394 ? 70.979 24.698 84.930 1.00 15.72 ? 414 LEU B C 1 +ATOM 8182 O O . LEU B 1 394 ? 71.351 25.029 83.806 1.00 14.90 ? 414 LEU B O 1 +ATOM 8183 C CB . LEU B 1 394 ? 69.015 25.974 85.630 1.00 14.79 ? 414 LEU B CB 1 +ATOM 8184 C CG . LEU B 1 394 ? 68.337 27.007 86.521 1.00 14.44 ? 414 LEU B CG 1 +ATOM 8185 C CD1 . LEU B 1 394 ? 66.858 27.136 86.171 1.00 15.14 ? 414 LEU B CD1 1 +ATOM 8186 C CD2 . LEU B 1 394 ? 68.513 26.634 87.973 1.00 15.18 ? 414 LEU B CD2 1 +ATOM 8187 N N . PRO B 1 395 ? 70.933 23.418 85.338 1.00 16.66 ? 415 PRO B N 1 +ATOM 8188 C CA . PRO B 1 395 ? 71.368 22.328 84.453 1.00 16.99 ? 415 PRO B CA 1 +ATOM 8189 C C . PRO B 1 395 ? 70.692 22.325 83.069 1.00 17.29 ? 415 PRO B C 1 +ATOM 8190 O O . PRO B 1 395 ? 71.345 21.986 82.074 1.00 17.29 ? 415 PRO B O 1 +ATOM 8191 C CB . PRO B 1 395 ? 70.987 21.063 85.230 1.00 17.35 ? 415 PRO B CB 1 +ATOM 8192 C CG . PRO B 1 395 ? 70.786 21.472 86.617 1.00 17.02 ? 415 PRO B CG 1 +ATOM 8193 C CD . PRO B 1 395 ? 70.463 22.926 86.649 1.00 17.05 ? 415 PRO B CD 1 +ATOM 8194 N N . GLN B 1 396 ? 69.412 22.708 83.017 1.00 17.58 ? 416 GLN B N 1 +ATOM 8195 C CA . GLN B 1 396 ? 68.630 22.726 81.777 1.00 18.20 ? 416 GLN B CA 1 +ATOM 8196 C C . GLN B 1 396 ? 69.119 23.730 80.731 1.00 18.07 ? 416 GLN B C 1 +ATOM 8197 O O . GLN B 1 396 ? 68.708 23.663 79.576 1.00 18.52 ? 416 GLN B O 1 +ATOM 8198 C CB . GLN B 1 396 ? 67.141 22.995 82.068 1.00 18.21 ? 416 GLN B CB 1 +ATOM 8199 C CG . GLN B 1 396 ? 66.822 24.429 82.547 1.00 19.79 ? 416 GLN B CG 1 +ATOM 8200 C CD . GLN B 1 396 ? 65.364 24.615 82.951 1.00 19.83 ? 416 GLN B CD 1 +ATOM 8201 O OE1 . GLN B 1 396 ? 64.479 24.716 82.099 1.00 23.88 ? 416 GLN B OE1 1 +ATOM 8202 N NE2 . GLN B 1 396 ? 65.108 24.664 84.258 1.00 21.97 ? 416 GLN B NE2 1 +ATOM 8203 N N . PHE B 1 397 ? 69.977 24.661 81.138 1.00 17.66 ? 417 PHE B N 1 +ATOM 8204 C CA . PHE B 1 397 ? 70.510 25.663 80.227 1.00 17.45 ? 417 PHE B CA 1 +ATOM 8205 C C . PHE B 1 397 ? 71.714 25.149 79.454 1.00 17.99 ? 417 PHE B C 1 +ATOM 8206 O O . PHE B 1 397 ? 72.141 25.775 78.489 1.00 18.13 ? 417 PHE B O 1 +ATOM 8207 C CB . PHE B 1 397 ? 70.900 26.930 80.994 1.00 16.93 ? 417 PHE B CB 1 +ATOM 8208 C CG . PHE B 1 397 ? 69.738 27.621 81.682 1.00 16.53 ? 417 PHE B CG 1 +ATOM 8209 C CD1 . PHE B 1 397 ? 68.426 27.449 81.252 1.00 15.93 ? 417 PHE B CD1 1 +ATOM 8210 C CD2 . PHE B 1 397 ? 69.976 28.463 82.758 1.00 15.03 ? 417 PHE B CD2 1 +ATOM 8211 C CE1 . PHE B 1 397 ? 67.385 28.105 81.887 1.00 15.51 ? 417 PHE B CE1 1 +ATOM 8212 C CE2 . PHE B 1 397 ? 68.937 29.119 83.394 1.00 15.29 ? 417 PHE B CE2 1 +ATOM 8213 C CZ . PHE B 1 397 ? 67.644 28.936 82.964 1.00 15.01 ? 417 PHE B CZ 1 +ATOM 8214 N N . PHE B 1 398 ? 72.268 24.021 79.892 1.00 18.78 ? 418 PHE B N 1 +ATOM 8215 C CA . PHE B 1 398 ? 73.386 23.390 79.207 1.00 19.29 ? 418 PHE B CA 1 +ATOM 8216 C C . PHE B 1 398 ? 72.834 22.236 78.372 1.00 20.43 ? 418 PHE B C 1 +ATOM 8217 O O . PHE B 1 398 ? 72.913 21.061 78.755 1.00 21.99 ? 418 PHE B O 1 +ATOM 8218 C CB . PHE B 1 398 ? 74.425 22.923 80.220 1.00 18.77 ? 418 PHE B CB 1 +ATOM 8219 C CG . PHE B 1 398 ? 75.006 24.038 81.033 1.00 18.12 ? 418 PHE B CG 1 +ATOM 8220 C CD1 . PHE B 1 398 ? 76.032 24.813 80.524 1.00 18.44 ? 418 PHE B CD1 1 +ATOM 8221 C CD2 . PHE B 1 398 ? 74.503 24.342 82.292 1.00 17.37 ? 418 PHE B CD2 1 +ATOM 8222 C CE1 . PHE B 1 398 ? 76.572 25.873 81.263 1.00 17.79 ? 418 PHE B CE1 1 +ATOM 8223 C CE2 . PHE B 1 398 ? 75.047 25.383 83.049 1.00 17.07 ? 418 PHE B CE2 1 +ATOM 8224 C CZ . PHE B 1 398 ? 76.078 26.152 82.530 1.00 17.57 ? 418 PHE B CZ 1 +ATOM 8225 N N . ASN B 1 399 ? 72.229 22.609 77.248 1.00 20.90 ? 419 ASN B N 1 +ATOM 8226 C CA . ASN B 1 399 ? 71.677 21.667 76.286 1.00 20.97 ? 419 ASN B CA 1 +ATOM 8227 C C . ASN B 1 399 ? 72.304 21.926 74.924 1.00 21.37 ? 419 ASN B C 1 +ATOM 8228 O O . ASN B 1 399 ? 73.043 22.900 74.745 1.00 21.06 ? 419 ASN B O 1 +ATOM 8229 C CB . ASN B 1 399 ? 70.161 21.813 76.215 1.00 20.60 ? 419 ASN B CB 1 +ATOM 8230 C CG . ASN B 1 399 ? 69.730 23.208 75.823 1.00 21.73 ? 419 ASN B CG 1 +ATOM 8231 O OD1 . ASN B 1 399 ? 69.693 23.550 74.642 1.00 22.06 ? 419 ASN B OD1 1 +ATOM 8232 N ND2 . ASN B 1 399 ? 69.405 24.024 76.818 1.00 20.94 ? 419 ASN B ND2 1 +ATOM 8233 N N . ASN B 1 400 ? 72.008 21.064 73.956 1.00 21.70 ? 420 ASN B N 1 +ATOM 8234 C CA . ASN B 1 400 ? 72.658 21.172 72.647 1.00 21.79 ? 420 ASN B CA 1 +ATOM 8235 C C . ASN B 1 400 ? 72.183 22.308 71.757 1.00 21.13 ? 420 ASN B C 1 +ATOM 8236 O O . ASN B 1 400 ? 72.961 22.824 70.956 1.00 20.93 ? 420 ASN B O 1 +ATOM 8237 C CB . ASN B 1 400 ? 72.609 19.850 71.880 1.00 22.62 ? 420 ASN B CB 1 +ATOM 8238 C CG . ASN B 1 400 ? 73.969 19.236 71.755 1.00 24.22 ? 420 ASN B CG 1 +ATOM 8239 O OD1 . ASN B 1 400 ? 74.656 19.439 70.751 1.00 28.19 ? 420 ASN B OD1 1 +ATOM 8240 N ND2 . ASN B 1 400 ? 74.407 18.540 72.802 1.00 27.56 ? 420 ASN B ND2 1 +ATOM 8241 N N . VAL B 1 401 ? 70.921 22.689 71.885 1.00 20.12 ? 421 VAL B N 1 +ATOM 8242 C CA . VAL B 1 401 ? 70.419 23.837 71.156 1.00 19.66 ? 421 VAL B CA 1 +ATOM 8243 C C . VAL B 1 401 ? 71.137 25.091 71.677 1.00 19.32 ? 421 VAL B C 1 +ATOM 8244 O O . VAL B 1 401 ? 71.666 25.868 70.892 1.00 19.01 ? 421 VAL B O 1 +ATOM 8245 C CB . VAL B 1 401 ? 68.903 23.958 71.274 1.00 19.63 ? 421 VAL B CB 1 +ATOM 8246 C CG1 . VAL B 1 401 ? 68.414 25.225 70.596 1.00 19.45 ? 421 VAL B CG1 1 +ATOM 8247 C CG2 . VAL B 1 401 ? 68.252 22.711 70.652 1.00 19.74 ? 421 VAL B CG2 1 +ATOM 8248 N N . SER B 1 402 ? 71.192 25.235 73.002 1.00 18.96 ? 422 SER B N 1 +ATOM 8249 C CA . SER B 1 402 ? 71.906 26.338 73.658 1.00 18.55 ? 422 SER B CA 1 +ATOM 8250 C C . SER B 1 402 ? 73.392 26.381 73.304 1.00 18.08 ? 422 SER B C 1 +ATOM 8251 O O . SER B 1 402 ? 73.931 27.455 73.007 1.00 17.52 ? 422 SER B O 1 +ATOM 8252 C CB . SER B 1 402 ? 71.756 26.247 75.181 1.00 18.80 ? 422 SER B CB 1 +ATOM 8253 O OG . SER B 1 402 ? 70.421 26.522 75.567 1.00 20.11 ? 422 SER B OG 1 +ATOM 8254 N N . LEU B 1 403 ? 74.049 25.222 73.337 1.00 17.23 ? 423 LEU B N 1 +ATOM 8255 C CA . LEU B 1 403 ? 75.470 25.139 72.993 1.00 17.24 ? 423 LEU B CA 1 +ATOM 8256 C C . LEU B 1 403 ? 75.709 25.652 71.586 1.00 17.41 ? 423 LEU B C 1 +ATOM 8257 O O . LEU B 1 403 ? 76.572 26.509 71.369 1.00 16.65 ? 423 LEU B O 1 +ATOM 8258 C CB . LEU B 1 403 ? 75.999 23.707 73.093 1.00 17.10 ? 423 LEU B CB 1 +ATOM 8259 C CG . LEU B 1 403 ? 77.461 23.526 72.648 1.00 16.93 ? 423 LEU B CG 1 +ATOM 8260 C CD1 . LEU B 1 403 ? 78.384 24.539 73.319 1.00 16.07 ? 423 LEU B CD1 1 +ATOM 8261 C CD2 . LEU B 1 403 ? 77.963 22.111 72.900 1.00 17.40 ? 423 LEU B CD2 1 +ATOM 8262 N N . HIS B 1 404 ? 74.955 25.105 70.632 1.00 17.17 ? 424 HIS B N 1 +ATOM 8263 C CA . HIS B 1 404 ? 75.064 25.502 69.230 1.00 17.73 ? 424 HIS B CA 1 +ATOM 8264 C C . HIS B 1 404 ? 74.855 27.006 69.042 1.00 16.51 ? 424 HIS B C 1 +ATOM 8265 O O . HIS B 1 404 ? 75.596 27.653 68.294 1.00 16.33 ? 424 HIS B O 1 +ATOM 8266 C CB . HIS B 1 404 ? 74.059 24.721 68.374 1.00 18.61 ? 424 HIS B CB 1 +ATOM 8267 C CG . HIS B 1 404 ? 74.141 25.029 66.911 1.00 21.58 ? 424 HIS B CG 1 +ATOM 8268 N ND1 . HIS B 1 404 ? 73.276 25.902 66.285 1.00 25.42 ? 424 HIS B ND1 1 +ATOM 8269 C CD2 . HIS B 1 404 ? 74.993 24.593 65.955 1.00 24.45 ? 424 HIS B CD2 1 +ATOM 8270 C CE1 . HIS B 1 404 ? 73.585 25.980 65.002 1.00 25.22 ? 424 HIS B CE1 1 +ATOM 8271 N NE2 . HIS B 1 404 ? 74.623 25.196 64.777 1.00 25.50 ? 424 HIS B NE2 1 +ATOM 8272 N N . HIS B 1 405 ? 73.839 27.555 69.703 1.00 15.02 ? 425 HIS B N 1 +ATOM 8273 C CA . HIS B 1 405 ? 73.550 28.981 69.619 1.00 14.89 ? 425 HIS B CA 1 +ATOM 8274 C C . HIS B 1 405 ? 74.679 29.826 70.219 1.00 14.32 ? 425 HIS B C 1 +ATOM 8275 O O . HIS B 1 405 ? 75.086 30.839 69.653 1.00 14.08 ? 425 HIS B O 1 +ATOM 8276 C CB . HIS B 1 405 ? 72.224 29.301 70.317 1.00 15.03 ? 425 HIS B CB 1 +ATOM 8277 C CG . HIS B 1 405 ? 71.934 30.761 70.389 1.00 15.02 ? 425 HIS B CG 1 +ATOM 8278 N ND1 . HIS B 1 405 ? 71.871 31.446 71.583 1.00 15.30 ? 425 HIS B ND1 1 +ATOM 8279 C CD2 . HIS B 1 405 ? 71.736 31.679 69.413 1.00 15.17 ? 425 HIS B CD2 1 +ATOM 8280 C CE1 . HIS B 1 405 ? 71.628 32.720 71.340 1.00 15.05 ? 425 HIS B CE1 1 +ATOM 8281 N NE2 . HIS B 1 405 ? 71.547 32.891 70.032 1.00 15.44 ? 425 HIS B NE2 1 +ATOM 8282 N N . HIS B 1 406 ? 75.195 29.390 71.360 1.00 14.15 ? 426 HIS B N 1 +ATOM 8283 C CA . HIS B 1 406 ? 76.294 30.074 72.032 1.00 13.95 ? 426 HIS B CA 1 +ATOM 8284 C C . HIS B 1 406 ? 77.500 30.169 71.091 1.00 14.58 ? 426 HIS B C 1 +ATOM 8285 O O . HIS B 1 406 ? 78.180 31.201 71.017 1.00 13.73 ? 426 HIS B O 1 +ATOM 8286 C CB . HIS B 1 406 ? 76.681 29.311 73.298 1.00 14.44 ? 426 HIS B CB 1 +ATOM 8287 C CG . HIS B 1 406 ? 77.407 30.130 74.320 1.00 13.41 ? 426 HIS B CG 1 +ATOM 8288 N ND1 . HIS B 1 406 ? 77.252 29.918 75.672 1.00 12.88 ? 426 HIS B ND1 1 +ATOM 8289 C CD2 . HIS B 1 406 ? 78.272 31.166 74.197 1.00 13.20 ? 426 HIS B CD2 1 +ATOM 8290 C CE1 . HIS B 1 406 ? 78.001 30.779 76.339 1.00 13.34 ? 426 HIS B CE1 1 +ATOM 8291 N NE2 . HIS B 1 406 ? 78.633 31.547 75.467 1.00 11.59 ? 426 HIS B NE2 1 +ATOM 8292 N N . MET B 1 407 ? 77.769 29.078 70.374 1.00 14.49 ? 427 MET B N 1 +ATOM 8293 C CA . MET B 1 407 ? 78.885 29.051 69.433 1.00 15.46 ? 427 MET B CA 1 +ATOM 8294 C C . MET B 1 407 ? 78.659 30.044 68.302 1.00 14.49 ? 427 MET B C 1 +ATOM 8295 O O . MET B 1 407 ? 79.580 30.757 67.907 1.00 13.66 ? 427 MET B O 1 +ATOM 8296 C CB . MET B 1 407 ? 79.095 27.634 68.891 1.00 15.19 ? 427 MET B CB 1 +ATOM 8297 C CG . MET B 1 407 ? 79.646 26.691 69.955 1.00 16.51 ? 427 MET B CG 1 +ATOM 8298 S SD . MET B 1 407 ? 79.861 24.978 69.409 1.00 20.50 ? 427 MET B SD 1 +ATOM 8299 C CE . MET B 1 407 ? 78.397 24.757 68.431 1.00 20.36 ? 427 MET B CE 1 +ATOM 8300 N N . GLN B 1 408 ? 77.431 30.115 67.791 1.00 13.79 ? 428 GLN B N 1 +ATOM 8301 C CA . GLN B 1 408 ? 77.098 31.098 66.755 1.00 14.54 ? 428 GLN B CA 1 +ATOM 8302 C C . GLN B 1 408 ? 77.238 32.527 67.272 1.00 13.43 ? 428 GLN B C 1 +ATOM 8303 O O . GLN B 1 408 ? 77.674 33.425 66.547 1.00 14.02 ? 428 GLN B O 1 +ATOM 8304 C CB . GLN B 1 408 ? 75.666 30.921 66.258 1.00 14.33 ? 428 GLN B CB 1 +ATOM 8305 C CG . GLN B 1 408 ? 75.407 29.660 65.437 1.00 16.79 ? 428 GLN B CG 1 +ATOM 8306 C CD . GLN B 1 408 ? 73.935 29.500 65.081 1.00 17.79 ? 428 GLN B CD 1 +ATOM 8307 O OE1 . GLN B 1 408 ? 73.064 29.526 65.957 1.00 22.54 ? 428 GLN B OE1 1 +ATOM 8308 N NE2 . GLN B 1 408 ? 73.647 29.334 63.793 1.00 21.86 ? 428 GLN B NE2 1 +ATOM 8309 N N . VAL B 1 409 ? 76.836 32.739 68.522 1.00 12.73 ? 429 VAL B N 1 +ATOM 8310 C CA . VAL B 1 409 ? 76.945 34.060 69.124 1.00 12.29 ? 429 VAL B CA 1 +ATOM 8311 C C . VAL B 1 409 ? 78.416 34.460 69.216 1.00 12.47 ? 429 VAL B C 1 +ATOM 8312 O O . VAL B 1 409 ? 78.756 35.607 68.914 1.00 12.34 ? 429 VAL B O 1 +ATOM 8313 C CB . VAL B 1 409 ? 76.272 34.127 70.496 1.00 12.16 ? 429 VAL B CB 1 +ATOM 8314 C CG1 . VAL B 1 409 ? 76.617 35.458 71.194 1.00 11.00 ? 429 VAL B CG1 1 +ATOM 8315 C CG2 . VAL B 1 409 ? 74.767 33.976 70.320 1.00 12.21 ? 429 VAL B CG2 1 +ATOM 8316 N N . MET B 1 410 ? 79.279 33.519 69.607 1.00 12.40 ? 430 MET B N 1 +ATOM 8317 C CA . MET B 1 410 ? 80.720 33.784 69.630 1.00 12.82 ? 430 MET B CA 1 +ATOM 8318 C C . MET B 1 410 ? 81.264 34.135 68.246 1.00 13.17 ? 430 MET B C 1 +ATOM 8319 O O . MET B 1 410 ? 82.055 35.085 68.114 1.00 12.93 ? 430 MET B O 1 +ATOM 8320 C CB . MET B 1 410 ? 81.507 32.640 70.269 1.00 12.87 ? 430 MET B CB 1 +ATOM 8321 C CG . MET B 1 410 ? 81.367 32.591 71.783 1.00 14.36 ? 430 MET B CG 1 +ATOM 8322 S SD . MET B 1 410 ? 81.673 34.150 72.632 1.00 18.74 ? 430 MET B SD 1 +ATOM 8323 C CE . MET B 1 410 ? 83.303 34.579 72.035 1.00 17.52 ? 430 MET B CE 1 +ATOM 8324 N N . GLU B 1 411 ? 80.809 33.424 67.213 1.00 12.87 ? 431 GLU B N 1 +ATOM 8325 C CA . GLU B 1 411 ? 81.224 33.746 65.842 1.00 13.13 ? 431 GLU B CA 1 +ATOM 8326 C C . GLU B 1 411 ? 80.816 35.165 65.489 1.00 12.35 ? 431 GLU B C 1 +ATOM 8327 O O . GLU B 1 411 ? 81.580 35.910 64.851 1.00 10.76 ? 431 GLU B O 1 +ATOM 8328 C CB . GLU B 1 411 ? 80.619 32.760 64.832 1.00 13.55 ? 431 GLU B CB 1 +ATOM 8329 C CG . GLU B 1 411 ? 81.104 31.340 65.010 1.00 15.52 ? 431 GLU B CG 1 +ATOM 8330 C CD . GLU B 1 411 ? 80.502 30.371 64.010 1.00 16.17 ? 431 GLU B CD 1 +ATOM 8331 O OE1 . GLU B 1 411 ? 79.570 30.747 63.269 1.00 22.12 ? 431 GLU B OE1 1 +ATOM 8332 O OE2 . GLU B 1 411 ? 80.957 29.212 63.971 1.00 23.16 ? 431 GLU B OE2 1 +ATOM 8333 N N . GLU B 1 412 ? 79.608 35.536 65.910 1.00 11.16 ? 432 GLU B N 1 +ATOM 8334 C CA . GLU B 1 412 ? 79.112 36.888 65.720 1.00 11.08 ? 432 GLU B CA 1 +ATOM 8335 C C . GLU B 1 412 ? 79.958 37.922 66.451 1.00 10.72 ? 432 GLU B C 1 +ATOM 8336 O O . GLU B 1 412 ? 80.276 38.971 65.892 1.00 9.93 ? 432 GLU B O 1 +ATOM 8337 C CB . GLU B 1 412 ? 77.661 37.005 66.205 1.00 11.30 ? 432 GLU B CB 1 +ATOM 8338 C CG . GLU B 1 412 ? 76.647 36.418 65.268 1.00 11.47 ? 432 GLU B CG 1 +ATOM 8339 C CD . GLU B 1 412 ? 75.233 36.741 65.694 1.00 12.04 ? 432 GLU B CD 1 +ATOM 8340 O OE1 . GLU B 1 412 ? 74.723 37.798 65.277 1.00 10.37 ? 432 GLU B OE1 1 +ATOM 8341 O OE2 . GLU B 1 412 ? 74.645 35.955 66.469 1.00 15.57 ? 432 GLU B OE2 1 +ATOM 8342 N N . VAL B 1 413 ? 80.291 37.638 67.708 1.00 9.95 ? 433 VAL B N 1 +ATOM 8343 C CA . VAL B 1 413 ? 81.058 38.590 68.530 1.00 9.75 ? 433 VAL B CA 1 +ATOM 8344 C C . VAL B 1 413 ? 82.452 38.801 67.932 1.00 9.42 ? 433 VAL B C 1 +ATOM 8345 O O . VAL B 1 413 ? 82.923 39.938 67.817 1.00 9.53 ? 433 VAL B O 1 +ATOM 8346 C CB . VAL B 1 413 ? 81.125 38.150 70.029 1.00 9.82 ? 433 VAL B CB 1 +ATOM 8347 C CG1 . VAL B 1 413 ? 82.045 39.096 70.853 1.00 10.84 ? 433 VAL B CG1 1 +ATOM 8348 C CG2 . VAL B 1 413 ? 79.718 38.154 70.643 1.00 9.63 ? 433 VAL B CG2 1 +ATOM 8349 N N . VAL B 1 414 ? 83.088 37.707 67.513 1.00 9.19 ? 434 VAL B N 1 +ATOM 8350 C CA . VAL B 1 414 ? 84.418 37.770 66.906 1.00 8.83 ? 434 VAL B CA 1 +ATOM 8351 C C . VAL B 1 414 ? 84.351 38.474 65.544 1.00 8.68 ? 434 VAL B C 1 +ATOM 8352 O O . VAL B 1 414 ? 85.203 39.307 65.213 1.00 9.10 ? 434 VAL B O 1 +ATOM 8353 C CB . VAL B 1 414 ? 85.026 36.361 66.768 1.00 9.18 ? 434 VAL B CB 1 +ATOM 8354 C CG1 . VAL B 1 414 ? 86.359 36.394 66.022 1.00 9.36 ? 434 VAL B CG1 1 +ATOM 8355 C CG2 . VAL B 1 414 ? 85.224 35.752 68.151 1.00 8.70 ? 434 VAL B CG2 1 +ATOM 8356 N N . ARG B 1 415 ? 83.338 38.157 64.754 1.00 9.04 ? 435 ARG B N 1 +ATOM 8357 C CA . ARG B 1 415 ? 83.183 38.833 63.467 1.00 9.05 ? 435 ARG B CA 1 +ATOM 8358 C C . ARG B 1 415 ? 83.129 40.327 63.650 1.00 9.20 ? 435 ARG B C 1 +ATOM 8359 O O . ARG B 1 415 ? 83.743 41.067 62.892 1.00 9.15 ? 435 ARG B O 1 +ATOM 8360 C CB . ARG B 1 415 ? 81.917 38.399 62.733 1.00 9.41 ? 435 ARG B CB 1 +ATOM 8361 C CG . ARG B 1 415 ? 81.575 39.287 61.533 1.00 9.30 ? 435 ARG B CG 1 +ATOM 8362 C CD . ARG B 1 415 ? 80.462 38.729 60.705 1.00 11.40 ? 435 ARG B CD 1 +ATOM 8363 N NE . ARG B 1 415 ? 79.176 38.839 61.386 1.00 10.45 ? 435 ARG B NE 1 +ATOM 8364 C CZ . ARG B 1 415 ? 78.029 38.415 60.871 1.00 12.08 ? 435 ARG B CZ 1 +ATOM 8365 N NH1 . ARG B 1 415 ? 78.008 37.820 59.686 1.00 12.10 ? 435 ARG B NH1 1 +ATOM 8366 N NH2 . ARG B 1 415 ? 76.899 38.556 61.560 1.00 11.89 ? 435 ARG B NH2 1 +ATOM 8367 N N . ARG B 1 416 ? 82.336 40.772 64.621 1.00 8.84 ? 436 ARG B N 1 +ATOM 8368 C CA . ARG B 1 416 ? 82.121 42.195 64.797 1.00 9.14 ? 436 ARG B CA 1 +ATOM 8369 C C . ARG B 1 416 ? 83.371 42.915 65.324 1.00 8.73 ? 436 ARG B C 1 +ATOM 8370 O O . ARG B 1 416 ? 83.665 44.040 64.898 1.00 9.30 ? 436 ARG B O 1 +ATOM 8371 C CB . ARG B 1 416 ? 80.926 42.430 65.730 1.00 8.78 ? 436 ARG B CB 1 +ATOM 8372 C CG . ARG B 1 416 ? 80.346 43.828 65.624 1.00 9.00 ? 436 ARG B CG 1 +ATOM 8373 C CD . ARG B 1 416 ? 79.413 44.124 66.788 1.00 10.37 ? 436 ARG B CD 1 +ATOM 8374 N NE . ARG B 1 416 ? 80.145 44.321 68.046 1.00 9.91 ? 436 ARG B NE 1 +ATOM 8375 C CZ . ARG B 1 416 ? 79.608 44.856 69.144 1.00 10.09 ? 436 ARG B CZ 1 +ATOM 8376 N NH1 . ARG B 1 416 ? 78.340 45.247 69.155 1.00 8.95 ? 436 ARG B NH1 1 +ATOM 8377 N NH2 . ARG B 1 416 ? 80.349 45.000 70.236 1.00 9.05 ? 436 ARG B NH2 1 +ATOM 8378 N N . ASP B 1 417 ? 84.108 42.260 66.228 1.00 8.61 ? 437 ASP B N 1 +ATOM 8379 C CA . ASP B 1 417 ? 85.077 42.967 67.062 1.00 8.35 ? 437 ASP B CA 1 +ATOM 8380 C C . ASP B 1 417 ? 86.537 42.567 66.842 1.00 8.90 ? 437 ASP B C 1 +ATOM 8381 O O . ASP B 1 417 ? 87.430 43.158 67.459 1.00 8.94 ? 437 ASP B O 1 +ATOM 8382 C CB . ASP B 1 417 ? 84.675 42.837 68.539 1.00 8.00 ? 437 ASP B CB 1 +ATOM 8383 C CG . ASP B 1 417 ? 83.395 43.602 68.858 1.00 8.55 ? 437 ASP B CG 1 +ATOM 8384 O OD1 . ASP B 1 417 ? 82.881 44.284 67.954 1.00 7.92 ? 437 ASP B OD1 1 +ATOM 8385 O OD2 . ASP B 1 417 ? 82.919 43.554 70.011 1.00 6.40 ? 437 ASP B OD2 1 +ATOM 8386 N N . LYS B 1 418 ? 86.751 41.593 65.949 1.00 9.11 ? 438 LYS B N 1 +ATOM 8387 C CA . LYS B 1 418 ? 88.086 41.039 65.639 1.00 9.87 ? 438 LYS B CA 1 +ATOM 8388 C C . LYS B 1 418 ? 89.177 42.049 65.283 1.00 9.79 ? 438 LYS B C 1 +ATOM 8389 O O . LYS B 1 418 ? 90.374 41.765 65.485 1.00 10.26 ? 438 LYS B O 1 +ATOM 8390 C CB . LYS B 1 418 ? 87.993 40.038 64.486 1.00 9.69 ? 438 LYS B CB 1 +ATOM 8391 C CG . LYS B 1 418 ? 87.441 40.631 63.201 1.00 9.95 ? 438 LYS B CG 1 +ATOM 8392 C CD . LYS B 1 418 ? 87.171 39.608 62.127 1.00 11.21 ? 438 LYS B CD 1 +ATOM 8393 C CE . LYS B 1 418 ? 86.519 40.278 60.935 1.00 12.95 ? 438 LYS B CE 1 +ATOM 8394 N NZ . LYS B 1 418 ? 86.225 39.347 59.802 1.00 13.62 ? 438 LYS B NZ 1 +ATOM 8395 N N . ASN B 1 419 ? 88.796 43.201 64.727 1.00 9.69 ? 439 ASN B N 1 +ATOM 8396 C CA . ASN B 1 419 ? 89.790 44.171 64.252 1.00 9.70 ? 439 ASN B CA 1 +ATOM 8397 C C . ASN B 1 419 ? 90.110 45.291 65.242 1.00 10.33 ? 439 ASN B C 1 +ATOM 8398 O O . ASN B 1 419 ? 90.918 46.166 64.932 1.00 9.69 ? 439 ASN B O 1 +ATOM 8399 C CB . ASN B 1 419 ? 89.357 44.743 62.892 1.00 9.63 ? 439 ASN B CB 1 +ATOM 8400 C CG . ASN B 1 419 ? 89.291 43.681 61.815 1.00 10.09 ? 439 ASN B CG 1 +ATOM 8401 O OD1 . ASN B 1 419 ? 90.201 42.860 61.687 1.00 9.73 ? 439 ASN B OD1 1 +ATOM 8402 N ND2 . ASN B 1 419 ? 88.192 43.664 61.059 1.00 9.45 ? 439 ASN B ND2 1 +ATOM 8403 N N . HIS B 1 420 ? 89.509 45.246 66.432 1.00 9.55 ? 440 HIS B N 1 +ATOM 8404 C CA . HIS B 1 420 ? 89.723 46.274 67.448 1.00 9.62 ? 440 HIS B CA 1 +ATOM 8405 C C . HIS B 1 420 ? 90.998 45.988 68.239 1.00 9.29 ? 440 HIS B C 1 +ATOM 8406 O O . HIS B 1 420 ? 91.033 45.046 69.021 1.00 10.29 ? 440 HIS B O 1 +ATOM 8407 C CB . HIS B 1 420 ? 88.535 46.328 68.416 1.00 9.37 ? 440 HIS B CB 1 +ATOM 8408 C CG . HIS B 1 420 ? 87.302 46.938 67.828 1.00 9.57 ? 440 HIS B CG 1 +ATOM 8409 N ND1 . HIS B 1 420 ? 87.258 48.247 67.401 1.00 8.30 ? 440 HIS B ND1 1 +ATOM 8410 C CD2 . HIS B 1 420 ? 86.065 46.429 67.609 1.00 9.81 ? 440 HIS B CD2 1 +ATOM 8411 C CE1 . HIS B 1 420 ? 86.052 48.517 66.932 1.00 9.29 ? 440 HIS B CE1 1 +ATOM 8412 N NE2 . HIS B 1 420 ? 85.308 47.431 67.046 1.00 9.73 ? 440 HIS B NE2 1 +ATOM 8413 N N . PRO B 1 421 ? 92.044 46.824 68.080 1.00 10.28 ? 441 PRO B N 1 +ATOM 8414 C CA . PRO B 1 421 ? 93.246 46.593 68.893 1.00 9.71 ? 441 PRO B CA 1 +ATOM 8415 C C . PRO B 1 421 ? 92.976 46.579 70.401 1.00 9.15 ? 441 PRO B C 1 +ATOM 8416 O O . PRO B 1 421 ? 93.640 45.846 71.135 1.00 8.59 ? 441 PRO B O 1 +ATOM 8417 C CB . PRO B 1 421 ? 94.160 47.763 68.518 1.00 9.87 ? 441 PRO B CB 1 +ATOM 8418 C CG . PRO B 1 421 ? 93.275 48.767 67.834 1.00 10.36 ? 441 PRO B CG 1 +ATOM 8419 C CD . PRO B 1 421 ? 92.202 47.983 67.184 1.00 10.02 ? 441 PRO B CD 1 +ATOM 8420 N N . ALA B 1 422 ? 92.017 47.385 70.858 1.00 8.60 ? 442 ALA B N 1 +ATOM 8421 C CA . ALA B 1 422 ? 91.692 47.479 72.283 1.00 7.90 ? 442 ALA B CA 1 +ATOM 8422 C C . ALA B 1 422 ? 91.232 46.159 72.882 1.00 7.22 ? 442 ALA B C 1 +ATOM 8423 O O . ALA B 1 422 ? 91.480 45.912 74.045 1.00 6.89 ? 442 ALA B O 1 +ATOM 8424 C CB . ALA B 1 422 ? 90.625 48.536 72.527 1.00 7.86 ? 442 ALA B CB 1 +ATOM 8425 N N . VAL B 1 423 ? 90.535 45.354 72.098 1.00 7.57 ? 443 VAL B N 1 +ATOM 8426 C CA . VAL B 1 423 ? 90.063 44.050 72.550 1.00 7.75 ? 443 VAL B CA 1 +ATOM 8427 C C . VAL B 1 423 ? 91.289 43.168 72.696 1.00 8.16 ? 443 VAL B C 1 +ATOM 8428 O O . VAL B 1 423 ? 92.002 42.916 71.711 1.00 8.28 ? 443 VAL B O 1 +ATOM 8429 C CB . VAL B 1 423 ? 89.067 43.415 71.571 1.00 7.97 ? 443 VAL B CB 1 +ATOM 8430 C CG1 . VAL B 1 423 ? 88.719 42.034 72.043 1.00 6.51 ? 443 VAL B CG1 1 +ATOM 8431 C CG2 . VAL B 1 423 ? 87.785 44.260 71.448 1.00 7.20 ? 443 VAL B CG2 1 +ATOM 8432 N N . VAL B 1 424 ? 91.557 42.750 73.926 1.00 8.73 ? 444 VAL B N 1 +ATOM 8433 C CA . VAL B 1 424 ? 92.708 41.901 74.221 1.00 9.26 ? 444 VAL B CA 1 +ATOM 8434 C C . VAL B 1 424 ? 92.353 40.499 74.712 1.00 9.48 ? 444 VAL B C 1 +ATOM 8435 O O . VAL B 1 424 ? 93.224 39.649 74.797 1.00 9.68 ? 444 VAL B O 1 +ATOM 8436 C CB . VAL B 1 424 ? 93.668 42.585 75.226 1.00 8.93 ? 444 VAL B CB 1 +ATOM 8437 C CG1 . VAL B 1 424 ? 94.209 43.880 74.647 1.00 9.71 ? 444 VAL B CG1 1 +ATOM 8438 C CG2 . VAL B 1 424 ? 92.989 42.796 76.593 1.00 9.15 ? 444 VAL B CG2 1 +ATOM 8439 N N . MET B 1 425 ? 91.080 40.237 75.011 1.00 9.69 ? 445 MET B N 1 +ATOM 8440 C CA . MET B 1 425 ? 90.673 38.921 75.474 1.00 9.90 ? 445 MET B CA 1 +ATOM 8441 C C . MET B 1 425 ? 89.177 38.751 75.247 1.00 9.65 ? 445 MET B C 1 +ATOM 8442 O O . MET B 1 425 ? 88.430 39.739 75.303 1.00 9.58 ? 445 MET B O 1 +ATOM 8443 C CB . MET B 1 425 ? 91.010 38.747 76.958 1.00 10.32 ? 445 MET B CB 1 +ATOM 8444 C CG . MET B 1 425 ? 90.660 37.372 77.495 1.00 9.37 ? 445 MET B CG 1 +ATOM 8445 S SD . MET B 1 425 ? 91.688 36.832 78.899 1.00 10.50 ? 445 MET B SD 1 +ATOM 8446 C CE . MET B 1 425 ? 91.303 38.061 80.136 1.00 10.48 ? 445 MET B CE 1 +ATOM 8447 N N . TRP B 1 426 ? 88.774 37.517 74.934 1.00 8.83 ? 446 TRP B N 1 +ATOM 8448 C CA . TRP B 1 426 ? 87.361 37.148 74.761 1.00 8.40 ? 446 TRP B CA 1 +ATOM 8449 C C . TRP B 1 426 ? 86.882 36.426 76.017 1.00 9.07 ? 446 TRP B C 1 +ATOM 8450 O O . TRP B 1 426 ? 87.611 35.595 76.583 1.00 8.84 ? 446 TRP B O 1 +ATOM 8451 C CB . TRP B 1 426 ? 87.157 36.209 73.567 1.00 9.29 ? 446 TRP B CB 1 +ATOM 8452 C CG . TRP B 1 426 ? 87.728 36.675 72.299 1.00 9.18 ? 446 TRP B CG 1 +ATOM 8453 C CD1 . TRP B 1 426 ? 88.852 36.209 71.700 1.00 10.22 ? 446 TRP B CD1 1 +ATOM 8454 C CD2 . TRP B 1 426 ? 87.213 37.704 71.447 1.00 10.62 ? 446 TRP B CD2 1 +ATOM 8455 N NE1 . TRP B 1 426 ? 89.080 36.887 70.524 1.00 9.60 ? 446 TRP B NE1 1 +ATOM 8456 C CE2 . TRP B 1 426 ? 88.087 37.809 70.348 1.00 9.77 ? 446 TRP B CE2 1 +ATOM 8457 C CE3 . TRP B 1 426 ? 86.100 38.557 71.508 1.00 8.86 ? 446 TRP B CE3 1 +ATOM 8458 C CZ2 . TRP B 1 426 ? 87.886 38.725 69.319 1.00 9.95 ? 446 TRP B CZ2 1 +ATOM 8459 C CZ3 . TRP B 1 426 ? 85.907 39.470 70.485 1.00 9.63 ? 446 TRP B CZ3 1 +ATOM 8460 C CH2 . TRP B 1 426 ? 86.789 39.545 69.404 1.00 9.80 ? 446 TRP B CH2 1 +ATOM 8461 N N . SER B 1 427 ? 85.661 36.727 76.463 1.00 8.83 ? 447 SER B N 1 +ATOM 8462 C CA . SER B 1 427 ? 85.062 36.013 77.593 1.00 8.57 ? 447 SER B CA 1 +ATOM 8463 C C . SER B 1 427 ? 83.763 35.397 77.127 1.00 8.78 ? 447 SER B C 1 +ATOM 8464 O O . SER B 1 427 ? 82.888 36.115 76.633 1.00 7.89 ? 447 SER B O 1 +ATOM 8465 C CB . SER B 1 427 ? 84.794 36.965 78.762 1.00 8.89 ? 447 SER B CB 1 +ATOM 8466 O OG . SER B 1 427 ? 84.101 36.311 79.806 1.00 8.26 ? 447 SER B OG 1 +ATOM 8467 N N . VAL B 1 428 ? 83.648 34.076 77.271 1.00 8.32 ? 448 VAL B N 1 +ATOM 8468 C CA . VAL B 1 428 ? 82.508 33.345 76.733 1.00 8.06 ? 448 VAL B CA 1 +ATOM 8469 C C . VAL B 1 428 ? 81.362 33.181 77.715 1.00 7.36 ? 448 VAL B C 1 +ATOM 8470 O O . VAL B 1 428 ? 80.280 32.750 77.321 1.00 6.82 ? 448 VAL B O 1 +ATOM 8471 C CB . VAL B 1 428 ? 82.934 31.959 76.191 1.00 8.82 ? 448 VAL B CB 1 +ATOM 8472 C CG1 . VAL B 1 428 ? 84.062 32.148 75.169 1.00 9.24 ? 448 VAL B CG1 1 +ATOM 8473 C CG2 . VAL B 1 428 ? 83.355 31.045 77.333 1.00 8.68 ? 448 VAL B CG2 1 +ATOM 8474 N N . ALA B 1 429 ? 81.585 33.534 78.980 1.00 6.84 ? 449 ALA B N 1 +ATOM 8475 C CA . ALA B 1 429 ? 80.526 33.445 79.987 1.00 7.06 ? 449 ALA B CA 1 +ATOM 8476 C C . ALA B 1 429 ? 80.826 34.210 81.267 1.00 6.85 ? 449 ALA B C 1 +ATOM 8477 O O . ALA B 1 429 ? 81.983 34.540 81.544 1.00 7.66 ? 449 ALA B O 1 +ATOM 8478 C CB . ALA B 1 429 ? 80.255 31.980 80.332 1.00 6.21 ? 449 ALA B CB 1 +ATOM 8479 N N . ASN B 1 430 ? 79.775 34.454 82.051 1.00 7.21 ? 450 ASN B N 1 +ATOM 8480 C CA . ASN B 1 430 ? 79.895 34.990 83.413 1.00 7.52 ? 450 ASN B CA 1 +ATOM 8481 C C . ASN B 1 430 ? 79.133 34.149 84.438 1.00 7.66 ? 450 ASN B C 1 +ATOM 8482 O O . ASN B 1 430 ? 77.914 34.012 84.364 1.00 6.35 ? 450 ASN B O 1 +ATOM 8483 C CB . ASN B 1 430 ? 79.416 36.454 83.501 1.00 8.33 ? 450 ASN B CB 1 +ATOM 8484 C CG . ASN B 1 430 ? 79.613 37.043 84.887 1.00 6.87 ? 450 ASN B CG 1 +ATOM 8485 O OD1 . ASN B 1 430 ? 80.741 37.325 85.309 1.00 7.59 ? 450 ASN B OD1 1 +ATOM 8486 N ND2 . ASN B 1 430 ? 78.521 37.184 85.627 1.00 7.80 ? 450 ASN B ND2 1 +ATOM 8487 N N . GLU B 1 431 ? 79.875 33.600 85.397 1.00 8.05 ? 451 GLU B N 1 +ATOM 8488 C CA . GLU B 1 431 ? 79.305 32.807 86.497 1.00 9.02 ? 451 GLU B CA 1 +ATOM 8489 C C . GLU B 1 431 ? 78.371 31.706 86.009 1.00 9.12 ? 451 GLU B C 1 +ATOM 8490 O O . GLU B 1 431 ? 77.229 31.565 86.493 1.00 9.29 ? 451 GLU B O 1 +ATOM 8491 C CB . GLU B 1 431 ? 78.627 33.733 87.528 1.00 8.91 ? 451 GLU B CB 1 +ATOM 8492 C CG . GLU B 1 431 ? 79.608 34.733 88.147 1.00 9.76 ? 451 GLU B CG 1 +ATOM 8493 C CD . GLU B 1 431 ? 79.005 35.588 89.252 1.00 9.52 ? 451 GLU B CD 1 +ATOM 8494 O OE1 . GLU B 1 431 ? 77.769 35.789 89.261 1.00 10.23 ? 451 GLU B OE1 1 +ATOM 8495 O OE2 . GLU B 1 431 ? 79.779 36.077 90.097 1.00 9.27 ? 451 GLU B OE2 1 +ATOM 8496 N N . PRO B 1 432 ? 78.850 30.898 85.039 1.00 9.59 ? 452 PRO B N 1 +ATOM 8497 C CA . PRO B 1 432 ? 78.041 29.734 84.683 1.00 10.02 ? 452 PRO B CA 1 +ATOM 8498 C C . PRO B 1 432 ? 78.112 28.721 85.813 1.00 10.77 ? 452 PRO B C 1 +ATOM 8499 O O . PRO B 1 432 ? 79.003 28.803 86.659 1.00 10.91 ? 452 PRO B O 1 +ATOM 8500 C CB . PRO B 1 432 ? 78.727 29.184 83.433 1.00 9.43 ? 452 PRO B CB 1 +ATOM 8501 C CG . PRO B 1 432 ? 80.147 29.597 83.579 1.00 9.07 ? 452 PRO B CG 1 +ATOM 8502 C CD . PRO B 1 432 ? 80.127 30.931 84.304 1.00 9.52 ? 452 PRO B CD 1 +ATOM 8503 N N . ALA B 1 433 ? 77.206 27.746 85.809 1.00 11.88 ? 453 ALA B N 1 +ATOM 8504 C CA . ALA B 1 433 ? 77.232 26.690 86.809 1.00 12.70 ? 453 ALA B CA 1 +ATOM 8505 C C . ALA B 1 433 ? 78.304 25.659 86.433 1.00 13.29 ? 453 ALA B C 1 +ATOM 8506 O O . ALA B 1 433 ? 78.005 24.500 86.173 1.00 14.04 ? 453 ALA B O 1 +ATOM 8507 C CB . ALA B 1 433 ? 75.853 26.043 86.905 1.00 12.94 ? 453 ALA B CB 1 +ATOM 8508 N N . SER B 1 434 ? 79.562 26.082 86.426 1.00 14.52 ? 454 SER B N 1 +ATOM 8509 C CA . SER B 1 434 ? 80.622 25.278 85.820 1.00 15.32 ? 454 SER B CA 1 +ATOM 8510 C C . SER B 1 434 ? 81.096 24.125 86.712 1.00 15.73 ? 454 SER B C 1 +ATOM 8511 O O . SER B 1 434 ? 81.988 23.381 86.324 1.00 16.35 ? 454 SER B O 1 +ATOM 8512 C CB . SER B 1 434 ? 81.793 26.172 85.432 1.00 15.34 ? 454 SER B CB 1 +ATOM 8513 O OG . SER B 1 434 ? 82.325 26.814 86.571 1.00 17.74 ? 454 SER B OG 1 +ATOM 8514 N N . HIS B 1 435 ? 80.514 23.997 87.904 1.00 16.33 ? 455 HIS B N 1 +ATOM 8515 C CA . HIS B 1 435 ? 80.666 22.788 88.744 1.00 16.75 ? 455 HIS B CA 1 +ATOM 8516 C C . HIS B 1 435 ? 79.976 21.558 88.152 1.00 17.41 ? 455 HIS B C 1 +ATOM 8517 O O . HIS B 1 435 ? 80.278 20.418 88.533 1.00 17.21 ? 455 HIS B O 1 +ATOM 8518 C CB . HIS B 1 435 ? 80.143 23.041 90.164 1.00 17.02 ? 455 HIS B CB 1 +ATOM 8519 C CG . HIS B 1 435 ? 78.712 23.474 90.217 1.00 17.05 ? 455 HIS B CG 1 +ATOM 8520 N ND1 . HIS B 1 435 ? 78.322 24.778 89.989 1.00 14.97 ? 455 HIS B ND1 1 +ATOM 8521 C CD2 . HIS B 1 435 ? 77.576 22.782 90.477 1.00 18.05 ? 455 HIS B CD2 1 +ATOM 8522 C CE1 . HIS B 1 435 ? 77.007 24.864 90.091 1.00 17.38 ? 455 HIS B CE1 1 +ATOM 8523 N NE2 . HIS B 1 435 ? 76.532 23.668 90.388 1.00 17.46 ? 455 HIS B NE2 1 +ATOM 8524 N N . LEU B 1 436 ? 79.041 21.792 87.235 1.00 17.91 ? 456 LEU B N 1 +ATOM 8525 C CA . LEU B 1 436 ? 78.329 20.716 86.543 1.00 18.57 ? 456 LEU B CA 1 +ATOM 8526 C C . LEU B 1 436 ? 79.178 20.126 85.417 1.00 19.00 ? 456 LEU B C 1 +ATOM 8527 O O . LEU B 1 436 ? 79.782 20.855 84.630 1.00 19.06 ? 456 LEU B O 1 +ATOM 8528 C CB . LEU B 1 436 ? 77.024 21.251 85.957 1.00 18.15 ? 456 LEU B CB 1 +ATOM 8529 C CG . LEU B 1 436 ? 76.057 21.909 86.936 1.00 18.12 ? 456 LEU B CG 1 +ATOM 8530 C CD1 . LEU B 1 436 ? 74.883 22.524 86.181 1.00 18.69 ? 456 LEU B CD1 1 +ATOM 8531 C CD2 . LEU B 1 436 ? 75.557 20.927 87.985 1.00 19.42 ? 456 LEU B CD2 1 +ATOM 8532 N N . GLU B 1 437 ? 79.210 18.802 85.330 1.00 19.65 ? 457 GLU B N 1 +ATOM 8533 C CA . GLU B 1 437 ? 79.984 18.130 84.293 1.00 19.75 ? 457 GLU B CA 1 +ATOM 8534 C C . GLU B 1 437 ? 79.555 18.615 82.909 1.00 19.15 ? 457 GLU B C 1 +ATOM 8535 O O . GLU B 1 437 ? 80.406 18.869 82.052 1.00 18.95 ? 457 GLU B O 1 +ATOM 8536 C CB . GLU B 1 437 ? 79.828 16.604 84.386 1.00 20.56 ? 457 GLU B CB 1 +ATOM 8537 C CG . GLU B 1 437 ? 80.999 15.832 83.780 1.00 22.26 ? 457 GLU B CG 1 +ATOM 8538 C CD . GLU B 1 437 ? 82.293 15.982 84.577 1.00 25.78 ? 457 GLU B CD 1 +ATOM 8539 O OE1 . GLU B 1 437 ? 83.373 16.096 83.957 1.00 28.65 ? 457 GLU B OE1 1 +ATOM 8540 O OE2 . GLU B 1 437 ? 82.242 15.992 85.826 1.00 28.62 ? 457 GLU B OE2 1 +ATOM 8541 N N . SER B 1 438 ? 78.241 18.747 82.709 1.00 18.76 ? 458 SER B N 1 +ATOM 8542 C CA . SER B 1 438 ? 77.676 19.184 81.428 1.00 18.26 ? 458 SER B CA 1 +ATOM 8543 C C . SER B 1 438 ? 78.124 20.589 81.070 1.00 17.92 ? 458 SER B C 1 +ATOM 8544 O O . SER B 1 438 ? 78.362 20.877 79.904 1.00 17.71 ? 458 SER B O 1 +ATOM 8545 C CB . SER B 1 438 ? 76.149 19.138 81.450 1.00 18.47 ? 458 SER B CB 1 +ATOM 8546 O OG . SER B 1 438 ? 75.609 20.135 82.300 1.00 18.72 ? 458 SER B OG 1 +ATOM 8547 N N . ALA B 1 439 ? 78.224 21.458 82.073 1.00 17.41 ? 459 ALA B N 1 +ATOM 8548 C CA . ALA B 1 439 ? 78.753 22.800 81.867 1.00 17.21 ? 459 ALA B CA 1 +ATOM 8549 C C . ALA B 1 439 ? 80.235 22.721 81.505 1.00 17.26 ? 459 ALA B C 1 +ATOM 8550 O O . ALA B 1 439 ? 80.717 23.497 80.684 1.00 16.97 ? 459 ALA B O 1 +ATOM 8551 C CB . ALA B 1 439 ? 78.531 23.668 83.111 1.00 16.81 ? 459 ALA B CB 1 +ATOM 8552 N N . GLY B 1 440 ? 80.941 21.761 82.100 1.00 17.56 ? 460 GLY B N 1 +ATOM 8553 C CA . GLY B 1 440 ? 82.349 21.519 81.774 1.00 17.71 ? 460 GLY B CA 1 +ATOM 8554 C C . GLY B 1 440 ? 82.564 21.342 80.277 1.00 17.95 ? 460 GLY B C 1 +ATOM 8555 O O . GLY B 1 440 ? 83.371 22.064 79.663 1.00 17.39 ? 460 GLY B O 1 +ATOM 8556 N N . TYR B 1 441 ? 81.818 20.402 79.695 1.00 18.10 ? 461 TYR B N 1 +ATOM 8557 C CA . TYR B 1 441 ? 81.905 20.097 78.263 1.00 18.16 ? 461 TYR B CA 1 +ATOM 8558 C C . TYR B 1 441 ? 81.433 21.265 77.406 1.00 16.77 ? 461 TYR B C 1 +ATOM 8559 O O . TYR B 1 441 ? 82.061 21.621 76.426 1.00 16.60 ? 461 TYR B O 1 +ATOM 8560 C CB . TYR B 1 441 ? 81.075 18.855 77.906 1.00 19.56 ? 461 TYR B CB 1 +ATOM 8561 C CG . TYR B 1 441 ? 80.939 18.643 76.411 1.00 20.88 ? 461 TYR B CG 1 +ATOM 8562 C CD1 . TYR B 1 441 ? 81.985 18.095 75.669 1.00 23.22 ? 461 TYR B CD1 1 +ATOM 8563 C CD2 . TYR B 1 441 ? 79.776 19.003 75.739 1.00 21.63 ? 461 TYR B CD2 1 +ATOM 8564 C CE1 . TYR B 1 441 ? 81.872 17.915 74.297 1.00 23.51 ? 461 TYR B CE1 1 +ATOM 8565 C CE2 . TYR B 1 441 ? 79.652 18.825 74.370 1.00 22.87 ? 461 TYR B CE2 1 +ATOM 8566 C CZ . TYR B 1 441 ? 80.704 18.278 73.654 1.00 23.10 ? 461 TYR B CZ 1 +ATOM 8567 O OH . TYR B 1 441 ? 80.593 18.095 72.288 1.00 24.17 ? 461 TYR B OH 1 +ATOM 8568 N N . TYR B 1 442 ? 80.298 21.831 77.779 1.00 15.77 ? 462 TYR B N 1 +ATOM 8569 C CA . TYR B 1 442 ? 79.728 22.982 77.092 1.00 14.72 ? 462 TYR B CA 1 +ATOM 8570 C C . TYR B 1 442 ? 80.752 24.113 76.995 1.00 14.64 ? 462 TYR B C 1 +ATOM 8571 O O . TYR B 1 442 ? 80.962 24.696 75.923 1.00 14.59 ? 462 TYR B O 1 +ATOM 8572 C CB . TYR B 1 442 ? 78.497 23.410 77.891 1.00 14.17 ? 462 TYR B CB 1 +ATOM 8573 C CG . TYR B 1 442 ? 77.724 24.625 77.436 1.00 13.60 ? 462 TYR B CG 1 +ATOM 8574 C CD1 . TYR B 1 442 ? 78.179 25.914 77.707 1.00 13.36 ? 462 TYR B CD1 1 +ATOM 8575 C CD2 . TYR B 1 442 ? 76.476 24.490 76.831 1.00 12.36 ? 462 TYR B CD2 1 +ATOM 8576 C CE1 . TYR B 1 442 ? 77.438 27.023 77.326 1.00 12.74 ? 462 TYR B CE1 1 +ATOM 8577 C CE2 . TYR B 1 442 ? 75.728 25.585 76.474 1.00 13.14 ? 462 TYR B CE2 1 +ATOM 8578 C CZ . TYR B 1 442 ? 76.224 26.856 76.711 1.00 12.97 ? 462 TYR B CZ 1 +ATOM 8579 O OH . TYR B 1 442 ? 75.472 27.954 76.354 1.00 13.26 ? 462 TYR B OH 1 +ATOM 8580 N N . LEU B 1 443 ? 81.397 24.414 78.118 1.00 14.54 ? 463 LEU B N 1 +ATOM 8581 C CA . LEU B 1 443 ? 82.362 25.506 78.180 1.00 14.42 ? 463 LEU B CA 1 +ATOM 8582 C C . LEU B 1 443 ? 83.610 25.178 77.395 1.00 14.72 ? 463 LEU B C 1 +ATOM 8583 O O . LEU B 1 443 ? 84.182 26.046 76.738 1.00 14.64 ? 463 LEU B O 1 +ATOM 8584 C CB . LEU B 1 443 ? 82.746 25.809 79.627 1.00 14.27 ? 463 LEU B CB 1 +ATOM 8585 C CG . LEU B 1 443 ? 81.656 26.500 80.442 1.00 14.41 ? 463 LEU B CG 1 +ATOM 8586 C CD1 . LEU B 1 443 ? 82.032 26.491 81.912 1.00 13.48 ? 463 LEU B CD1 1 +ATOM 8587 C CD2 . LEU B 1 443 ? 81.443 27.928 79.920 1.00 13.07 ? 463 LEU B CD2 1 +ATOM 8588 N N . LYS B 1 444 ? 84.052 23.929 77.503 1.00 14.90 ? 464 LYS B N 1 +ATOM 8589 C CA . LYS B 1 444 ? 85.189 23.444 76.733 1.00 15.44 ? 464 LYS B CA 1 +ATOM 8590 C C . LYS B 1 444 ? 84.989 23.724 75.246 1.00 14.99 ? 464 LYS B C 1 +ATOM 8591 O O . LYS B 1 444 ? 85.902 24.209 74.578 1.00 14.64 ? 464 LYS B O 1 +ATOM 8592 C CB . LYS B 1 444 ? 85.353 21.937 76.956 1.00 15.49 ? 464 LYS B CB 1 +ATOM 8593 C CG . LYS B 1 444 ? 86.545 21.285 76.268 1.00 16.98 ? 464 LYS B CG 1 +ATOM 8594 C CD . LYS B 1 444 ? 86.477 19.766 76.465 1.00 17.71 ? 464 LYS B CD 1 +ATOM 8595 C CE . LYS B 1 444 ? 87.301 18.985 75.457 1.00 20.37 ? 464 LYS B CE 1 +ATOM 8596 N NZ . LYS B 1 444 ? 88.684 18.748 75.928 1.00 22.82 ? 464 LYS B NZ 1 +ATOM 8597 N N . MET B 1 445 ? 83.800 23.416 74.735 1.00 14.81 ? 465 MET B N 1 +ATOM 8598 C CA . MET B 1 445 ? 83.533 23.517 73.300 1.00 15.39 ? 465 MET B CA 1 +ATOM 8599 C C . MET B 1 445 ? 83.434 24.963 72.855 1.00 14.71 ? 465 MET B C 1 +ATOM 8600 O O . MET B 1 445 ? 83.930 25.322 71.794 1.00 14.90 ? 465 MET B O 1 +ATOM 8601 C CB . MET B 1 445 ? 82.252 22.759 72.914 1.00 15.90 ? 465 MET B CB 1 +ATOM 8602 C CG . MET B 1 445 ? 82.294 21.265 73.152 1.00 18.71 ? 465 MET B CG 1 +ATOM 8603 S SD . MET B 1 445 ? 83.529 20.398 72.159 1.00 24.80 ? 465 MET B SD 1 +ATOM 8604 C CE . MET B 1 445 ? 84.968 20.501 73.203 1.00 23.03 ? 465 MET B CE 1 +ATOM 8605 N N . VAL B 1 446 ? 82.791 25.796 73.661 1.00 14.02 ? 466 VAL B N 1 +ATOM 8606 C CA . VAL B 1 446 ? 82.649 27.205 73.314 1.00 13.37 ? 466 VAL B CA 1 +ATOM 8607 C C . VAL B 1 446 ? 84.015 27.907 73.346 1.00 13.36 ? 466 VAL B C 1 +ATOM 8608 O O . VAL B 1 446 ? 84.312 28.727 72.472 1.00 13.29 ? 466 VAL B O 1 +ATOM 8609 C CB . VAL B 1 446 ? 81.643 27.921 74.230 1.00 13.47 ? 466 VAL B CB 1 +ATOM 8610 C CG1 . VAL B 1 446 ? 81.568 29.394 73.857 1.00 13.31 ? 466 VAL B CG1 1 +ATOM 8611 C CG2 . VAL B 1 446 ? 80.281 27.256 74.127 1.00 14.24 ? 466 VAL B CG2 1 +ATOM 8612 N N . ILE B 1 447 ? 84.837 27.575 74.339 1.00 13.34 ? 467 ILE B N 1 +ATOM 8613 C CA . ILE B 1 447 ? 86.185 28.156 74.449 1.00 13.23 ? 467 ILE B CA 1 +ATOM 8614 C C . ILE B 1 447 ? 87.031 27.730 73.247 1.00 13.90 ? 467 ILE B C 1 +ATOM 8615 O O . ILE B 1 447 ? 87.690 28.565 72.615 1.00 13.67 ? 467 ILE B O 1 +ATOM 8616 C CB . ILE B 1 447 ? 86.887 27.754 75.763 1.00 13.56 ? 467 ILE B CB 1 +ATOM 8617 C CG1 . ILE B 1 447 ? 86.239 28.462 76.960 1.00 13.11 ? 467 ILE B CG1 1 +ATOM 8618 C CG2 . ILE B 1 447 ? 88.375 28.099 75.711 1.00 10.66 ? 467 ILE B CG2 1 +ATOM 8619 C CD1 . ILE B 1 447 ? 86.594 27.842 78.276 1.00 13.62 ? 467 ILE B CD1 1 +ATOM 8620 N N . ALA B 1 448 ? 86.991 26.438 72.920 1.00 14.14 ? 468 ALA B N 1 +ATOM 8621 C CA . ALA B 1 448 ? 87.736 25.915 71.767 1.00 14.21 ? 468 ALA B CA 1 +ATOM 8622 C C . ALA B 1 448 ? 87.256 26.544 70.448 1.00 13.92 ? 468 ALA B C 1 +ATOM 8623 O O . ALA B 1 448 ? 88.072 26.911 69.613 1.00 14.53 ? 468 ALA B O 1 +ATOM 8624 C CB . ALA B 1 448 ? 87.632 24.394 71.702 1.00 14.53 ? 468 ALA B CB 1 +ATOM 8625 N N . HIS B 1 449 ? 85.942 26.674 70.263 1.00 13.46 ? 469 HIS B N 1 +ATOM 8626 C CA . HIS B 1 449 ? 85.399 27.324 69.069 1.00 13.22 ? 469 HIS B CA 1 +ATOM 8627 C C . HIS B 1 449 ? 85.950 28.743 68.942 1.00 12.86 ? 469 HIS B C 1 +ATOM 8628 O O . HIS B 1 449 ? 86.405 29.181 67.882 1.00 13.18 ? 469 HIS B O 1 +ATOM 8629 C CB . HIS B 1 449 ? 83.872 27.398 69.146 1.00 13.51 ? 469 HIS B CB 1 +ATOM 8630 C CG . HIS B 1 449 ? 83.221 27.624 67.823 1.00 14.55 ? 469 HIS B CG 1 +ATOM 8631 N ND1 . HIS B 1 449 ? 83.425 26.782 66.752 1.00 16.88 ? 469 HIS B ND1 1 +ATOM 8632 C CD2 . HIS B 1 449 ? 82.375 28.589 67.392 1.00 15.38 ? 469 HIS B CD2 1 +ATOM 8633 C CE1 . HIS B 1 449 ? 82.726 27.217 65.718 1.00 16.73 ? 469 HIS B CE1 1 +ATOM 8634 N NE2 . HIS B 1 449 ? 82.085 28.315 66.079 1.00 16.47 ? 469 HIS B NE2 1 +ATOM 8635 N N . THR B 1 450 ? 85.897 29.459 70.050 1.00 12.70 ? 470 THR B N 1 +ATOM 8636 C CA . THR B 1 450 ? 86.348 30.827 70.079 1.00 11.55 ? 470 THR B CA 1 +ATOM 8637 C C . THR B 1 450 ? 87.827 30.901 69.700 1.00 12.27 ? 470 THR B C 1 +ATOM 8638 O O . THR B 1 450 ? 88.218 31.706 68.863 1.00 12.66 ? 470 THR B O 1 +ATOM 8639 C CB . THR B 1 450 ? 86.129 31.432 71.454 1.00 11.60 ? 470 THR B CB 1 +ATOM 8640 O OG1 . THR B 1 450 ? 84.745 31.278 71.823 1.00 10.72 ? 470 THR B OG1 1 +ATOM 8641 C CG2 . THR B 1 450 ? 86.507 32.909 71.432 1.00 9.76 ? 470 THR B CG2 1 +ATOM 8642 N N . LYS B 1 451 ? 88.642 30.050 70.307 1.00 12.72 ? 471 LYS B N 1 +ATOM 8643 C CA . LYS B 1 451 ? 90.069 30.060 70.011 1.00 13.61 ? 471 LYS B CA 1 +ATOM 8644 C C . LYS B 1 451 ? 90.337 29.804 68.530 1.00 13.48 ? 471 LYS B C 1 +ATOM 8645 O O . LYS B 1 451 ? 91.241 30.407 67.944 1.00 13.76 ? 471 LYS B O 1 +ATOM 8646 C CB . LYS B 1 451 ? 90.802 29.035 70.858 1.00 13.88 ? 471 LYS B CB 1 +ATOM 8647 C CG . LYS B 1 451 ? 90.952 29.449 72.286 1.00 14.81 ? 471 LYS B CG 1 +ATOM 8648 C CD . LYS B 1 451 ? 91.410 28.284 73.132 1.00 17.47 ? 471 LYS B CD 1 +ATOM 8649 C CE . LYS B 1 451 ? 92.003 28.748 74.437 1.00 19.13 ? 471 LYS B CE 1 +ATOM 8650 N NZ . LYS B 1 451 ? 92.569 27.609 75.232 1.00 21.72 ? 471 LYS B NZ 1 +ATOM 8651 N N . SER B 1 452 ? 89.544 28.920 67.935 1.00 13.80 ? 472 SER B N 1 +ATOM 8652 C CA A SER B 1 452 ? 89.700 28.566 66.525 0.50 13.78 ? 472 SER B CA 1 +ATOM 8653 C CA B SER B 1 452 ? 89.699 28.566 66.531 0.50 14.13 ? 472 SER B CA 1 +ATOM 8654 C C . SER B 1 452 ? 89.356 29.756 65.629 1.00 14.17 ? 472 SER B C 1 +ATOM 8655 O O . SER B 1 452 ? 89.972 29.945 64.582 1.00 14.50 ? 472 SER B O 1 +ATOM 8656 C CB A SER B 1 452 ? 88.850 27.336 66.162 0.50 13.70 ? 472 SER B CB 1 +ATOM 8657 C CB B SER B 1 452 ? 88.824 27.357 66.196 0.50 14.09 ? 472 SER B CB 1 +ATOM 8658 O OG A SER B 1 452 ? 87.477 27.646 65.977 0.50 12.54 ? 472 SER B OG 1 +ATOM 8659 O OG B SER B 1 452 ? 89.195 26.235 66.987 0.50 15.09 ? 472 SER B OG 1 +ATOM 8660 N N . LEU B 1 453 ? 88.380 30.557 66.055 1.00 14.13 ? 473 LEU B N 1 +ATOM 8661 C CA . LEU B 1 453 ? 87.964 31.749 65.317 1.00 14.09 ? 473 LEU B CA 1 +ATOM 8662 C C . LEU B 1 453 ? 89.020 32.857 65.329 1.00 14.33 ? 473 LEU B C 1 +ATOM 8663 O O . LEU B 1 453 ? 89.160 33.600 64.358 1.00 14.75 ? 473 LEU B O 1 +ATOM 8664 C CB . LEU B 1 453 ? 86.671 32.298 65.910 1.00 14.32 ? 473 LEU B CB 1 +ATOM 8665 C CG . LEU B 1 453 ? 85.450 31.423 65.689 1.00 13.85 ? 473 LEU B CG 1 +ATOM 8666 C CD1 . LEU B 1 453 ? 84.390 31.769 66.725 1.00 14.73 ? 473 LEU B CD1 1 +ATOM 8667 C CD2 . LEU B 1 453 ? 84.966 31.633 64.269 1.00 13.55 ? 473 LEU B CD2 1 +ATOM 8668 N N . ASP B 1 454 ? 89.754 32.969 66.431 1.00 14.23 ? 474 ASP B N 1 +ATOM 8669 C CA . ASP B 1 454 ? 90.741 34.027 66.586 1.00 14.22 ? 474 ASP B CA 1 +ATOM 8670 C C . ASP B 1 454 ? 91.903 33.535 67.437 1.00 14.66 ? 474 ASP B C 1 +ATOM 8671 O O . ASP B 1 454 ? 91.917 33.716 68.650 1.00 14.95 ? 474 ASP B O 1 +ATOM 8672 C CB . ASP B 1 454 ? 90.098 35.268 67.206 1.00 13.87 ? 474 ASP B CB 1 +ATOM 8673 C CG . ASP B 1 454 ? 91.100 36.381 67.443 1.00 13.43 ? 474 ASP B CG 1 +ATOM 8674 O OD1 . ASP B 1 454 ? 92.120 36.449 66.716 1.00 12.51 ? 474 ASP B OD1 1 +ATOM 8675 O OD2 . ASP B 1 454 ? 90.875 37.196 68.353 1.00 11.73 ? 474 ASP B OD2 1 +ATOM 8676 N N . PRO B 1 455 ? 92.893 32.899 66.794 1.00 14.89 ? 475 PRO B N 1 +ATOM 8677 C CA . PRO B 1 455 ? 94.115 32.519 67.478 1.00 15.32 ? 475 PRO B CA 1 +ATOM 8678 C C . PRO B 1 455 ? 94.946 33.676 68.046 1.00 15.00 ? 475 PRO B C 1 +ATOM 8679 O O . PRO B 1 455 ? 95.864 33.414 68.838 1.00 16.33 ? 475 PRO B O 1 +ATOM 8680 C CB . PRO B 1 455 ? 94.910 31.777 66.386 1.00 15.52 ? 475 PRO B CB 1 +ATOM 8681 C CG . PRO B 1 455 ? 93.909 31.390 65.373 1.00 15.89 ? 475 PRO B CG 1 +ATOM 8682 C CD . PRO B 1 455 ? 92.893 32.465 65.387 1.00 15.42 ? 475 PRO B CD 1 +ATOM 8683 N N . SER B 1 456 ? 94.650 34.926 67.671 1.00 13.93 ? 476 SER B N 1 +ATOM 8684 C CA . SER B 1 456 ? 95.469 36.071 68.092 1.00 13.70 ? 476 SER B CA 1 +ATOM 8685 C C . SER B 1 456 ? 95.218 36.562 69.527 1.00 13.28 ? 476 SER B C 1 +ATOM 8686 O O . SER B 1 456 ? 96.017 37.340 70.047 1.00 14.31 ? 476 SER B O 1 +ATOM 8687 C CB . SER B 1 456 ? 95.297 37.247 67.115 1.00 14.15 ? 476 SER B CB 1 +ATOM 8688 O OG . SER B 1 456 ? 94.074 37.942 67.317 1.00 13.91 ? 476 SER B OG 1 +ATOM 8689 N N . ARG B 1 457 ? 94.131 36.125 70.163 1.00 11.87 ? 477 ARG B N 1 +ATOM 8690 C CA . ARG B 1 457 ? 93.778 36.614 71.513 1.00 11.37 ? 477 ARG B CA 1 +ATOM 8691 C C . ARG B 1 457 ? 93.452 35.463 72.470 1.00 10.59 ? 477 ARG B C 1 +ATOM 8692 O O . ARG B 1 457 ? 92.873 34.463 72.041 1.00 10.51 ? 477 ARG B O 1 +ATOM 8693 C CB . ARG B 1 457 ? 92.535 37.492 71.441 1.00 11.50 ? 477 ARG B CB 1 +ATOM 8694 C CG . ARG B 1 457 ? 92.676 38.759 70.610 1.00 11.69 ? 477 ARG B CG 1 +ATOM 8695 C CD . ARG B 1 457 ? 91.377 39.538 70.639 1.00 11.01 ? 477 ARG B CD 1 +ATOM 8696 N NE . ARG B 1 457 ? 91.495 40.825 69.979 1.00 11.42 ? 477 ARG B NE 1 +ATOM 8697 C CZ . ARG B 1 457 ? 91.330 41.034 68.675 1.00 11.95 ? 477 ARG B CZ 1 +ATOM 8698 N NH1 . ARG B 1 457 ? 91.057 40.029 67.841 1.00 10.29 ? 477 ARG B NH1 1 +ATOM 8699 N NH2 . ARG B 1 457 ? 91.464 42.257 68.201 1.00 10.63 ? 477 ARG B NH2 1 +ATOM 8700 N N . PRO B 1 458 ? 93.769 35.630 73.772 1.00 9.79 ? 478 PRO B N 1 +ATOM 8701 C CA . PRO B 1 458 ? 93.392 34.629 74.768 1.00 9.50 ? 478 PRO B CA 1 +ATOM 8702 C C . PRO B 1 458 ? 91.888 34.586 75.005 1.00 9.41 ? 478 PRO B C 1 +ATOM 8703 O O . PRO B 1 458 ? 91.185 35.555 74.714 1.00 9.74 ? 478 PRO B O 1 +ATOM 8704 C CB . PRO B 1 458 ? 94.133 35.084 76.025 1.00 9.58 ? 478 PRO B CB 1 +ATOM 8705 C CG . PRO B 1 458 ? 94.329 36.565 75.834 1.00 9.43 ? 478 PRO B CG 1 +ATOM 8706 C CD . PRO B 1 458 ? 94.484 36.772 74.372 1.00 9.76 ? 478 PRO B CD 1 +ATOM 8707 N N . VAL B 1 459 ? 91.415 33.469 75.537 1.00 9.70 ? 479 VAL B N 1 +ATOM 8708 C CA . VAL B 1 459 ? 90.009 33.280 75.820 1.00 9.40 ? 479 VAL B CA 1 +ATOM 8709 C C . VAL B 1 459 ? 89.867 32.873 77.281 1.00 9.88 ? 479 VAL B C 1 +ATOM 8710 O O . VAL B 1 459 ? 90.701 32.136 77.846 1.00 9.94 ? 479 VAL B O 1 +ATOM 8711 C CB . VAL B 1 459 ? 89.405 32.191 74.902 1.00 9.42 ? 479 VAL B CB 1 +ATOM 8712 C CG1 . VAL B 1 459 ? 87.906 32.005 75.176 1.00 10.43 ? 479 VAL B CG1 1 +ATOM 8713 C CG2 . VAL B 1 459 ? 89.646 32.537 73.435 1.00 9.46 ? 479 VAL B CG2 1 +ATOM 8714 N N . THR B 1 460 ? 88.787 33.347 77.886 1.00 9.75 ? 480 THR B N 1 +ATOM 8715 C CA . THR B 1 460 ? 88.500 33.058 79.266 1.00 9.64 ? 480 THR B CA 1 +ATOM 8716 C C . THR B 1 460 ? 86.989 32.943 79.439 1.00 9.34 ? 480 THR B C 1 +ATOM 8717 O O . THR B 1 460 ? 86.223 33.110 78.496 1.00 9.47 ? 480 THR B O 1 +ATOM 8718 C CB . THR B 1 460 ? 89.043 34.174 80.167 1.00 9.82 ? 480 THR B CB 1 +ATOM 8719 O OG1 . THR B 1 460 ? 89.005 33.770 81.545 1.00 10.61 ? 480 THR B OG1 1 +ATOM 8720 C CG2 . THR B 1 460 ? 88.234 35.467 79.971 1.00 9.10 ? 480 THR B CG2 1 +ATOM 8721 N N . PHE B 1 461 ? 86.588 32.616 80.654 1.00 10.13 ? 481 PHE B N 1 +ATOM 8722 C CA . PHE B 1 461 ? 85.247 32.927 81.131 1.00 9.93 ? 481 PHE B CA 1 +ATOM 8723 C C . PHE B 1 461 ? 85.410 33.317 82.593 1.00 9.12 ? 481 PHE B C 1 +ATOM 8724 O O . PHE B 1 461 ? 86.414 32.955 83.227 1.00 8.57 ? 481 PHE B O 1 +ATOM 8725 C CB . PHE B 1 461 ? 84.283 31.749 80.925 1.00 10.47 ? 481 PHE B CB 1 +ATOM 8726 C CG . PHE B 1 461 ? 84.413 30.649 81.936 1.00 10.53 ? 481 PHE B CG 1 +ATOM 8727 C CD1 . PHE B 1 461 ? 85.217 29.541 81.671 1.00 11.51 ? 481 PHE B CD1 1 +ATOM 8728 C CD2 . PHE B 1 461 ? 83.707 30.694 83.145 1.00 10.58 ? 481 PHE B CD2 1 +ATOM 8729 C CE1 . PHE B 1 461 ? 85.317 28.507 82.586 1.00 11.57 ? 481 PHE B CE1 1 +ATOM 8730 C CE2 . PHE B 1 461 ? 83.817 29.661 84.078 1.00 11.39 ? 481 PHE B CE2 1 +ATOM 8731 C CZ . PHE B 1 461 ? 84.612 28.564 83.795 1.00 12.13 ? 481 PHE B CZ 1 +ATOM 8732 N N . VAL B 1 462 ? 84.445 34.065 83.115 1.00 8.73 ? 482 VAL B N 1 +ATOM 8733 C CA . VAL B 1 462 ? 84.538 34.631 84.443 1.00 8.92 ? 482 VAL B CA 1 +ATOM 8734 C C . VAL B 1 462 ? 83.783 33.725 85.421 1.00 8.98 ? 482 VAL B C 1 +ATOM 8735 O O . VAL B 1 462 ? 82.613 33.433 85.202 1.00 9.44 ? 482 VAL B O 1 +ATOM 8736 C CB . VAL B 1 462 ? 83.950 36.045 84.480 1.00 8.82 ? 482 VAL B CB 1 +ATOM 8737 C CG1 . VAL B 1 462 ? 83.950 36.571 85.898 1.00 8.99 ? 482 VAL B CG1 1 +ATOM 8738 C CG2 . VAL B 1 462 ? 84.746 36.985 83.553 1.00 9.96 ? 482 VAL B CG2 1 +ATOM 8739 N N . SER B 1 463 ? 84.451 33.321 86.499 1.00 9.52 ? 483 SER B N 1 +ATOM 8740 C CA . SER B 1 463 ? 83.947 32.252 87.373 1.00 9.67 ? 483 SER B CA 1 +ATOM 8741 C C . SER B 1 463 ? 83.708 32.699 88.819 1.00 9.58 ? 483 SER B C 1 +ATOM 8742 O O . SER B 1 463 ? 84.512 33.455 89.393 1.00 9.32 ? 483 SER B O 1 +ATOM 8743 C CB . SER B 1 463 ? 84.939 31.078 87.369 1.00 10.24 ? 483 SER B CB 1 +ATOM 8744 O OG . SER B 1 463 ? 84.445 29.986 88.121 1.00 10.04 ? 483 SER B OG 1 +ATOM 8745 N N . ASN B 1 464 ? 82.617 32.210 89.413 1.00 10.35 ? 484 ASN B N 1 +ATOM 8746 C CA . ASN B 1 464 ? 82.441 32.275 90.868 1.00 10.75 ? 484 ASN B CA 1 +ATOM 8747 C C . ASN B 1 464 ? 82.428 30.894 91.526 1.00 11.54 ? 484 ASN B C 1 +ATOM 8748 O O . ASN B 1 464 ? 81.976 30.742 92.662 1.00 11.21 ? 484 ASN B O 1 +ATOM 8749 C CB . ASN B 1 464 ? 81.197 33.092 91.248 1.00 10.77 ? 484 ASN B CB 1 +ATOM 8750 C CG . ASN B 1 464 ? 79.895 32.433 90.835 1.00 10.66 ? 484 ASN B CG 1 +ATOM 8751 O OD1 . ASN B 1 464 ? 79.882 31.446 90.091 1.00 12.22 ? 484 ASN B OD1 1 +ATOM 8752 N ND2 . ASN B 1 464 ? 78.780 32.977 91.325 1.00 11.28 ? 484 ASN B ND2 1 +ATOM 8753 N N . SER B 1 465 ? 82.929 29.890 90.806 1.00 11.99 ? 485 SER B N 1 +ATOM 8754 C CA . SER B 1 465 ? 82.955 28.514 91.311 1.00 13.02 ? 485 SER B CA 1 +ATOM 8755 C C . SER B 1 465 ? 84.035 28.272 92.363 1.00 13.93 ? 485 SER B C 1 +ATOM 8756 O O . SER B 1 465 ? 84.959 29.071 92.531 1.00 14.90 ? 485 SER B O 1 +ATOM 8757 C CB . SER B 1 465 ? 83.179 27.540 90.154 1.00 12.95 ? 485 SER B CB 1 +ATOM 8758 O OG . SER B 1 465 ? 82.179 27.667 89.159 1.00 12.23 ? 485 SER B OG 1 +ATOM 8759 N N . ASN B 1 466 ? 83.910 27.143 93.057 1.00 15.25 ? 486 ASN B N 1 +ATOM 8760 C CA . ASN B 1 466 ? 84.973 26.664 93.933 1.00 16.17 ? 486 ASN B CA 1 +ATOM 8761 C C . ASN B 1 466 ? 86.110 26.123 93.081 1.00 16.04 ? 486 ASN B C 1 +ATOM 8762 O O . ASN B 1 466 ? 85.871 25.398 92.119 1.00 16.41 ? 486 ASN B O 1 +ATOM 8763 C CB . ASN B 1 466 ? 84.464 25.575 94.879 1.00 16.66 ? 486 ASN B CB 1 +ATOM 8764 C CG . ASN B 1 466 ? 85.548 25.072 95.811 1.00 18.79 ? 486 ASN B CG 1 +ATOM 8765 O OD1 . ASN B 1 466 ? 86.311 24.168 95.471 1.00 21.68 ? 486 ASN B OD1 1 +ATOM 8766 N ND2 . ASN B 1 466 ? 85.626 25.667 96.994 1.00 22.41 ? 486 ASN B ND2 1 +ATOM 8767 N N . TYR B 1 467 ? 87.344 26.463 93.441 1.00 16.39 ? 487 TYR B N 1 +ATOM 8768 C CA . TYR B 1 467 ? 88.512 26.109 92.619 1.00 16.70 ? 487 TYR B CA 1 +ATOM 8769 C C . TYR B 1 467 ? 88.607 24.612 92.315 1.00 16.83 ? 487 TYR B C 1 +ATOM 8770 O O . TYR B 1 467 ? 89.021 24.219 91.226 1.00 17.24 ? 487 TYR B O 1 +ATOM 8771 C CB . TYR B 1 467 ? 89.801 26.567 93.289 1.00 16.96 ? 487 TYR B CB 1 +ATOM 8772 C CG . TYR B 1 467 ? 90.272 25.652 94.399 1.00 17.67 ? 487 TYR B CG 1 +ATOM 8773 C CD1 . TYR B 1 467 ? 89.730 25.732 95.675 1.00 18.49 ? 487 TYR B CD1 1 +ATOM 8774 C CD2 . TYR B 1 467 ? 91.271 24.718 94.169 1.00 17.56 ? 487 TYR B CD2 1 +ATOM 8775 C CE1 . TYR B 1 467 ? 90.157 24.885 96.692 1.00 18.26 ? 487 TYR B CE1 1 +ATOM 8776 C CE2 . TYR B 1 467 ? 91.712 23.875 95.171 1.00 18.22 ? 487 TYR B CE2 1 +ATOM 8777 C CZ . TYR B 1 467 ? 91.150 23.962 96.431 1.00 17.86 ? 487 TYR B CZ 1 +ATOM 8778 O OH . TYR B 1 467 ? 91.589 23.132 97.427 1.00 18.68 ? 487 TYR B OH 1 +ATOM 8779 N N . ALA B 1 468 ? 88.223 23.788 93.287 1.00 17.12 ? 488 ALA B N 1 +ATOM 8780 C CA . ALA B 1 468 ? 88.312 22.333 93.167 1.00 17.41 ? 488 ALA B CA 1 +ATOM 8781 C C . ALA B 1 468 ? 87.210 21.723 92.307 1.00 17.44 ? 488 ALA B C 1 +ATOM 8782 O O . ALA B 1 468 ? 87.357 20.595 91.821 1.00 17.75 ? 488 ALA B O 1 +ATOM 8783 C CB . ALA B 1 468 ? 88.280 21.713 94.553 1.00 17.82 ? 488 ALA B CB 1 +ATOM 8784 N N . ALA B 1 469 ? 86.119 22.463 92.120 1.00 17.05 ? 489 ALA B N 1 +ATOM 8785 C CA . ALA B 1 469 ? 84.924 21.972 91.432 1.00 16.91 ? 489 ALA B CA 1 +ATOM 8786 C C . ALA B 1 469 ? 84.731 22.548 90.033 1.00 16.46 ? 489 ALA B C 1 +ATOM 8787 O O . ALA B 1 469 ? 83.928 22.031 89.272 1.00 16.32 ? 489 ALA B O 1 +ATOM 8788 C CB . ALA B 1 469 ? 83.671 22.269 92.277 1.00 17.02 ? 489 ALA B CB 1 +ATOM 8789 N N . ASP B 1 470 ? 85.445 23.623 89.701 1.00 16.33 ? 490 ASP B N 1 +ATOM 8790 C CA . ASP B 1 470 ? 85.269 24.302 88.411 1.00 15.99 ? 490 ASP B CA 1 +ATOM 8791 C C . ASP B 1 470 ? 85.755 23.431 87.250 1.00 16.33 ? 490 ASP B C 1 +ATOM 8792 O O . ASP B 1 470 ? 86.958 23.268 87.056 1.00 16.42 ? 490 ASP B O 1 +ATOM 8793 C CB . ASP B 1 470 ? 86.015 25.644 88.409 1.00 15.71 ? 490 ASP B CB 1 +ATOM 8794 C CG . ASP B 1 470 ? 85.665 26.504 87.212 1.00 15.21 ? 490 ASP B CG 1 +ATOM 8795 O OD1 . ASP B 1 470 ? 85.264 25.948 86.182 1.00 14.73 ? 490 ASP B OD1 1 +ATOM 8796 O OD2 . ASP B 1 470 ? 85.787 27.741 87.300 1.00 16.39 ? 490 ASP B OD2 1 +ATOM 8797 N N . LYS B 1 471 ? 84.816 22.908 86.465 1.00 16.63 ? 491 LYS B N 1 +ATOM 8798 C CA . LYS B 1 471 ? 85.143 22.010 85.349 1.00 17.02 ? 491 LYS B CA 1 +ATOM 8799 C C . LYS B 1 471 ? 85.485 22.737 84.041 1.00 16.70 ? 491 LYS B C 1 +ATOM 8800 O O . LYS B 1 471 ? 85.888 22.090 83.068 1.00 17.04 ? 491 LYS B O 1 +ATOM 8801 C CB . LYS B 1 471 ? 83.984 21.049 85.083 1.00 17.57 ? 491 LYS B CB 1 +ATOM 8802 C CG . LYS B 1 471 ? 83.483 20.280 86.303 1.00 19.28 ? 491 LYS B CG 1 +ATOM 8803 C CD . LYS B 1 471 ? 84.539 19.414 86.935 1.00 21.78 ? 491 LYS B CD 1 +ATOM 8804 C CE . LYS B 1 471 ? 83.941 18.554 88.053 1.00 22.89 ? 491 LYS B CE 1 +ATOM 8805 N NZ . LYS B 1 471 ? 84.985 18.050 88.985 1.00 24.44 ? 491 LYS B NZ 1 +ATOM 8806 N N . GLY B 1 472 ? 85.302 24.060 84.012 1.00 16.11 ? 492 GLY B N 1 +ATOM 8807 C CA . GLY B 1 472 ? 85.654 24.886 82.850 1.00 15.43 ? 492 GLY B CA 1 +ATOM 8808 C C . GLY B 1 472 ? 87.059 25.454 82.917 1.00 14.84 ? 492 GLY B C 1 +ATOM 8809 O O . GLY B 1 472 ? 87.666 25.754 81.891 1.00 14.34 ? 492 GLY B O 1 +ATOM 8810 N N . ALA B 1 473 ? 87.566 25.610 84.138 1.00 14.37 ? 493 ALA B N 1 +ATOM 8811 C CA . ALA B 1 473 ? 88.862 26.234 84.400 1.00 14.02 ? 493 ALA B CA 1 +ATOM 8812 C C . ALA B 1 473 ? 90.067 25.615 83.675 1.00 13.94 ? 493 ALA B C 1 +ATOM 8813 O O . ALA B 1 473 ? 90.979 26.337 83.279 1.00 13.36 ? 493 ALA B O 1 +ATOM 8814 C CB . ALA B 1 473 ? 89.119 26.259 85.889 1.00 14.32 ? 493 ALA B CB 1 +ATOM 8815 N N . PRO B 1 474 ? 90.096 24.276 83.507 1.00 13.60 ? 494 PRO B N 1 +ATOM 8816 C CA . PRO B 1 474 ? 91.234 23.723 82.742 1.00 13.90 ? 494 PRO B CA 1 +ATOM 8817 C C . PRO B 1 474 ? 91.463 24.313 81.324 1.00 14.23 ? 494 PRO B C 1 +ATOM 8818 O O . PRO B 1 474 ? 92.591 24.281 80.824 1.00 14.61 ? 494 PRO B O 1 +ATOM 8819 C CB . PRO B 1 474 ? 90.892 22.229 82.631 1.00 13.88 ? 494 PRO B CB 1 +ATOM 8820 C CG . PRO B 1 474 ? 89.966 21.954 83.777 1.00 13.52 ? 494 PRO B CG 1 +ATOM 8821 C CD . PRO B 1 474 ? 89.178 23.225 83.976 1.00 13.99 ? 494 PRO B CD 1 +ATOM 8822 N N . TYR B 1 475 ? 90.418 24.844 80.690 1.00 14.25 ? 495 TYR B N 1 +ATOM 8823 C CA . TYR B 1 475 ? 90.476 25.231 79.275 1.00 14.73 ? 495 TYR B CA 1 +ATOM 8824 C C . TYR B 1 475 ? 90.693 26.726 79.037 1.00 13.92 ? 495 TYR B C 1 +ATOM 8825 O O . TYR B 1 475 ? 90.835 27.163 77.892 1.00 13.86 ? 495 TYR B O 1 +ATOM 8826 C CB . TYR B 1 475 ? 89.198 24.785 78.573 1.00 15.71 ? 495 TYR B CB 1 +ATOM 8827 C CG . TYR B 1 475 ? 88.793 23.379 78.955 1.00 17.42 ? 495 TYR B CG 1 +ATOM 8828 C CD1 . TYR B 1 475 ? 89.507 22.278 78.505 1.00 18.54 ? 495 TYR B CD1 1 +ATOM 8829 C CD2 . TYR B 1 475 ? 87.718 23.162 79.799 1.00 18.13 ? 495 TYR B CD2 1 +ATOM 8830 C CE1 . TYR B 1 475 ? 89.137 20.988 78.887 1.00 19.14 ? 495 TYR B CE1 1 +ATOM 8831 C CE2 . TYR B 1 475 ? 87.344 21.891 80.176 1.00 19.50 ? 495 TYR B CE2 1 +ATOM 8832 C CZ . TYR B 1 475 ? 88.045 20.815 79.719 1.00 18.50 ? 495 TYR B CZ 1 +ATOM 8833 O OH . TYR B 1 475 ? 87.632 19.555 80.113 1.00 21.03 ? 495 TYR B OH 1 +ATOM 8834 N N . VAL B 1 476 ? 90.706 27.526 80.096 1.00 13.37 ? 496 VAL B N 1 +ATOM 8835 C CA . VAL B 1 476 ? 90.862 28.975 79.913 1.00 12.55 ? 496 VAL B CA 1 +ATOM 8836 C C . VAL B 1 476 ? 92.338 29.343 79.841 1.00 12.82 ? 496 VAL B C 1 +ATOM 8837 O O . VAL B 1 476 ? 93.177 28.635 80.387 1.00 12.65 ? 496 VAL B O 1 +ATOM 8838 C CB . VAL B 1 476 ? 90.194 29.774 81.041 1.00 12.73 ? 496 VAL B CB 1 +ATOM 8839 C CG1 . VAL B 1 476 ? 88.687 29.533 81.043 1.00 10.33 ? 496 VAL B CG1 1 +ATOM 8840 C CG2 . VAL B 1 476 ? 90.800 29.432 82.395 1.00 12.56 ? 496 VAL B CG2 1 +ATOM 8841 N N . ASP B 1 477 ? 92.641 30.464 79.183 1.00 12.51 ? 497 ASP B N 1 +ATOM 8842 C CA . ASP B 1 477 ? 94.015 30.974 79.064 1.00 11.99 ? 497 ASP B CA 1 +ATOM 8843 C C . ASP B 1 477 ? 94.402 31.836 80.262 1.00 11.05 ? 497 ASP B C 1 +ATOM 8844 O O . ASP B 1 477 ? 95.569 31.885 80.668 1.00 10.96 ? 497 ASP B O 1 +ATOM 8845 C CB . ASP B 1 477 ? 94.164 31.784 77.765 1.00 12.40 ? 497 ASP B CB 1 +ATOM 8846 C CG . ASP B 1 477 ? 93.996 30.922 76.516 1.00 14.11 ? 497 ASP B CG 1 +ATOM 8847 O OD1 . ASP B 1 477 ? 94.377 29.718 76.552 1.00 13.70 ? 497 ASP B OD1 1 +ATOM 8848 O OD2 . ASP B 1 477 ? 93.490 31.443 75.497 1.00 13.12 ? 497 ASP B OD2 1 +ATOM 8849 N N . VAL B 1 478 ? 93.409 32.518 80.816 1.00 10.14 ? 498 VAL B N 1 +ATOM 8850 C CA . VAL B 1 478 ? 93.552 33.332 82.008 1.00 9.76 ? 498 VAL B CA 1 +ATOM 8851 C C . VAL B 1 478 ? 92.356 33.010 82.877 1.00 9.69 ? 498 VAL B C 1 +ATOM 8852 O O . VAL B 1 478 ? 91.247 32.890 82.362 1.00 9.68 ? 498 VAL B O 1 +ATOM 8853 C CB . VAL B 1 478 ? 93.536 34.840 81.687 1.00 10.03 ? 498 VAL B CB 1 +ATOM 8854 C CG1 . VAL B 1 478 ? 93.436 35.674 82.979 1.00 9.02 ? 498 VAL B CG1 1 +ATOM 8855 C CG2 . VAL B 1 478 ? 94.772 35.241 80.853 1.00 10.86 ? 498 VAL B CG2 1 +ATOM 8856 N N . ILE B 1 479 ? 92.594 32.889 84.178 1.00 9.36 ? 499 ILE B N 1 +ATOM 8857 C CA . ILE B 1 479 ? 91.556 32.601 85.162 1.00 9.98 ? 499 ILE B CA 1 +ATOM 8858 C C . ILE B 1 479 ? 90.991 33.914 85.703 1.00 9.88 ? 499 ILE B C 1 +ATOM 8859 O O . ILE B 1 479 ? 91.737 34.758 86.190 1.00 9.91 ? 499 ILE B O 1 +ATOM 8860 C CB . ILE B 1 479 ? 92.132 31.732 86.304 1.00 10.22 ? 499 ILE B CB 1 +ATOM 8861 C CG1 . ILE B 1 479 ? 92.392 30.310 85.781 1.00 10.64 ? 499 ILE B CG1 1 +ATOM 8862 C CG2 . ILE B 1 479 ? 91.178 31.674 87.486 1.00 8.78 ? 499 ILE B CG2 1 +ATOM 8863 C CD1 . ILE B 1 479 ? 93.129 29.395 86.747 1.00 11.97 ? 499 ILE B CD1 1 +ATOM 8864 N N . CYS B 1 480 ? 89.677 34.095 85.565 1.00 9.81 ? 500 CYS B N 1 +ATOM 8865 C CA . CYS B 1 480 ? 89.001 35.301 86.062 1.00 9.73 ? 500 CYS B CA 1 +ATOM 8866 C C . CYS B 1 480 ? 88.054 34.918 87.189 1.00 9.58 ? 500 CYS B C 1 +ATOM 8867 O O . CYS B 1 480 ? 87.118 34.143 86.980 1.00 9.23 ? 500 CYS B O 1 +ATOM 8868 C CB . CYS B 1 480 ? 88.228 35.991 84.946 1.00 9.66 ? 500 CYS B CB 1 +ATOM 8869 S SG . CYS B 1 480 ? 89.278 36.642 83.632 1.00 10.58 ? 500 CYS B SG 1 +ATOM 8870 N N . LEU B 1 481 ? 88.307 35.476 88.368 1.00 9.54 ? 501 LEU B N 1 +ATOM 8871 C CA . LEU B 1 481 ? 87.584 35.137 89.598 1.00 9.56 ? 501 LEU B CA 1 +ATOM 8872 C C . LEU B 1 481 ? 86.755 36.299 90.142 1.00 9.08 ? 501 LEU B C 1 +ATOM 8873 O O . LEU B 1 481 ? 87.258 37.413 90.260 1.00 9.10 ? 501 LEU B O 1 +ATOM 8874 C CB . LEU B 1 481 ? 88.592 34.731 90.668 1.00 9.96 ? 501 LEU B CB 1 +ATOM 8875 C CG . LEU B 1 481 ? 89.535 33.595 90.242 1.00 9.90 ? 501 LEU B CG 1 +ATOM 8876 C CD1 . LEU B 1 481 ? 90.548 33.333 91.343 1.00 10.09 ? 501 LEU B CD1 1 +ATOM 8877 C CD2 . LEU B 1 481 ? 88.748 32.332 89.892 1.00 11.62 ? 501 LEU B CD2 1 +ATOM 8878 N N . ASN B 1 482 ? 85.507 36.000 90.497 1.00 9.13 ? 502 ASN B N 1 +ATOM 8879 C CA . ASN B 1 482 ? 84.620 36.935 91.200 1.00 8.99 ? 502 ASN B CA 1 +ATOM 8880 C C . ASN B 1 482 ? 84.508 36.554 92.662 1.00 9.58 ? 502 ASN B C 1 +ATOM 8881 O O . ASN B 1 482 ? 84.172 35.404 92.968 1.00 9.61 ? 502 ASN B O 1 +ATOM 8882 C CB . ASN B 1 482 ? 83.208 36.890 90.611 1.00 8.74 ? 502 ASN B CB 1 +ATOM 8883 C CG . ASN B 1 482 ? 83.139 37.393 89.184 1.00 8.51 ? 502 ASN B CG 1 +ATOM 8884 O OD1 . ASN B 1 482 ? 84.099 37.957 88.655 1.00 9.65 ? 502 ASN B OD1 1 +ATOM 8885 N ND2 . ASN B 1 482 ? 81.977 37.188 88.550 1.00 6.96 ? 502 ASN B ND2 1 +ATOM 8886 N N . SER B 1 483 ? 84.765 37.497 93.563 1.00 9.32 ? 503 SER B N 1 +ATOM 8887 C CA . SER B 1 483 ? 84.521 37.256 94.978 1.00 9.48 ? 503 SER B CA 1 +ATOM 8888 C C . SER B 1 483 ? 84.184 38.538 95.734 1.00 9.14 ? 503 SER B C 1 +ATOM 8889 O O . SER B 1 483 ? 84.643 39.617 95.394 1.00 9.64 ? 503 SER B O 1 +ATOM 8890 C CB . SER B 1 483 ? 85.689 36.518 95.632 1.00 9.17 ? 503 SER B CB 1 +ATOM 8891 O OG . SER B 1 483 ? 86.854 37.314 95.703 1.00 9.14 ? 503 SER B OG 1 +ATOM 8892 N N . TYR B 1 484 ? 83.361 38.393 96.766 1.00 9.37 ? 504 TYR B N 1 +ATOM 8893 C CA . TYR B 1 484 ? 82.861 39.527 97.542 1.00 8.99 ? 504 TYR B CA 1 +ATOM 8894 C C . TYR B 1 484 ? 82.916 39.164 99.035 1.00 9.12 ? 504 TYR B C 1 +ATOM 8895 O O . TYR B 1 484 ? 81.892 39.096 99.709 1.00 8.51 ? 504 TYR B O 1 +ATOM 8896 C CB . TYR B 1 484 ? 81.414 39.807 97.152 1.00 8.72 ? 504 TYR B CB 1 +ATOM 8897 C CG . TYR B 1 484 ? 81.191 40.320 95.733 1.00 8.25 ? 504 TYR B CG 1 +ATOM 8898 C CD1 . TYR B 1 484 ? 81.158 39.445 94.645 1.00 8.49 ? 504 TYR B CD1 1 +ATOM 8899 C CD2 . TYR B 1 484 ? 80.975 41.669 95.499 1.00 8.59 ? 504 TYR B CD2 1 +ATOM 8900 C CE1 . TYR B 1 484 ? 80.932 39.908 93.356 1.00 8.63 ? 504 TYR B CE1 1 +ATOM 8901 C CE2 . TYR B 1 484 ? 80.756 42.154 94.222 1.00 9.36 ? 504 TYR B CE2 1 +ATOM 8902 C CZ . TYR B 1 484 ? 80.726 41.273 93.150 1.00 7.95 ? 504 TYR B CZ 1 +ATOM 8903 O OH . TYR B 1 484 ? 80.476 41.772 91.889 1.00 8.64 ? 504 TYR B OH 1 +ATOM 8904 N N . TYR B 1 485 ? 84.115 38.924 99.550 1.00 9.20 ? 505 TYR B N 1 +ATOM 8905 C CA . TYR B 1 485 ? 84.255 38.508 100.944 1.00 8.90 ? 505 TYR B CA 1 +ATOM 8906 C C . TYR B 1 485 ? 83.771 39.645 101.849 1.00 8.82 ? 505 TYR B C 1 +ATOM 8907 O O . TYR B 1 485 ? 83.991 40.825 101.550 1.00 8.95 ? 505 TYR B O 1 +ATOM 8908 C CB . TYR B 1 485 ? 85.704 38.128 101.242 1.00 8.95 ? 505 TYR B CB 1 +ATOM 8909 C CG . TYR B 1 485 ? 86.195 37.042 100.320 1.00 8.92 ? 505 TYR B CG 1 +ATOM 8910 C CD1 . TYR B 1 485 ? 85.518 35.823 100.236 1.00 8.50 ? 505 TYR B CD1 1 +ATOM 8911 C CD2 . TYR B 1 485 ? 87.314 37.226 99.525 1.00 9.14 ? 505 TYR B CD2 1 +ATOM 8912 C CE1 . TYR B 1 485 ? 85.944 34.810 99.384 1.00 9.29 ? 505 TYR B CE1 1 +ATOM 8913 C CE2 . TYR B 1 485 ? 87.758 36.207 98.659 1.00 9.54 ? 505 TYR B CE2 1 +ATOM 8914 C CZ . TYR B 1 485 ? 87.070 35.004 98.612 1.00 9.54 ? 505 TYR B CZ 1 +ATOM 8915 O OH . TYR B 1 485 ? 87.472 33.995 97.770 1.00 10.59 ? 505 TYR B OH 1 +ATOM 8916 N N . SER B 1 486 ? 83.080 39.267 102.923 1.00 8.57 ? 506 SER B N 1 +ATOM 8917 C CA . SER B 1 486 ? 82.404 40.209 103.840 1.00 8.47 ? 506 SER B CA 1 +ATOM 8918 C C . SER B 1 486 ? 81.098 40.780 103.293 1.00 9.01 ? 506 SER B C 1 +ATOM 8919 O O . SER B 1 486 ? 80.341 41.362 104.058 1.00 8.86 ? 506 SER B O 1 +ATOM 8920 C CB . SER B 1 486 ? 83.317 41.346 104.316 1.00 8.87 ? 506 SER B CB 1 +ATOM 8921 O OG . SER B 1 486 ? 83.289 42.477 103.457 1.00 6.90 ? 506 SER B OG 1 +ATOM 8922 N N . TRP B 1 487 ? 80.849 40.636 101.990 1.00 9.39 ? 507 TRP B N 1 +ATOM 8923 C CA . TRP B 1 487 ? 79.622 41.154 101.388 1.00 9.87 ? 507 TRP B CA 1 +ATOM 8924 C C . TRP B 1 487 ? 78.573 40.053 101.178 1.00 10.21 ? 507 TRP B C 1 +ATOM 8925 O O . TRP B 1 487 ? 77.485 40.099 101.782 1.00 10.10 ? 507 TRP B O 1 +ATOM 8926 C CB . TRP B 1 487 ? 79.852 41.935 100.070 1.00 9.69 ? 507 TRP B CB 1 +ATOM 8927 C CG . TRP B 1 487 ? 78.553 42.542 99.713 1.00 9.77 ? 507 TRP B CG 1 +ATOM 8928 C CD1 . TRP B 1 487 ? 77.596 42.023 98.899 1.00 10.11 ? 507 TRP B CD1 1 +ATOM 8929 C CD2 . TRP B 1 487 ? 77.997 43.712 100.294 1.00 9.03 ? 507 TRP B CD2 1 +ATOM 8930 N NE1 . TRP B 1 487 ? 76.479 42.813 98.918 1.00 9.98 ? 507 TRP B NE1 1 +ATOM 8931 C CE2 . TRP B 1 487 ? 76.700 43.863 99.770 1.00 8.98 ? 507 TRP B CE2 1 +ATOM 8932 C CE3 . TRP B 1 487 ? 78.472 44.653 101.213 1.00 9.55 ? 507 TRP B CE3 1 +ATOM 8933 C CZ2 . TRP B 1 487 ? 75.875 44.919 100.127 1.00 9.55 ? 507 TRP B CZ2 1 +ATOM 8934 C CZ3 . TRP B 1 487 ? 77.668 45.707 101.550 1.00 9.81 ? 507 TRP B CZ3 1 +ATOM 8935 C CH2 . TRP B 1 487 ? 76.371 45.831 101.016 1.00 9.20 ? 507 TRP B CH2 1 +ATOM 8936 N N . TYR B 1 488 ? 78.861 39.093 100.299 1.00 10.71 ? 508 TYR B N 1 +ATOM 8937 C CA . TYR B 1 488 ? 77.921 37.994 100.035 1.00 11.41 ? 508 TYR B CA 1 +ATOM 8938 C C . TYR B 1 488 ? 77.992 36.891 101.078 1.00 11.55 ? 508 TYR B C 1 +ATOM 8939 O O . TYR B 1 488 ? 77.152 35.989 101.079 1.00 12.10 ? 508 TYR B O 1 +ATOM 8940 C CB . TYR B 1 488 ? 78.109 37.402 98.635 1.00 12.10 ? 508 TYR B CB 1 +ATOM 8941 C CG . TYR B 1 488 ? 77.554 38.268 97.516 1.00 13.03 ? 508 TYR B CG 1 +ATOM 8942 C CD1 . TYR B 1 488 ? 76.280 38.840 97.599 1.00 13.49 ? 508 TYR B CD1 1 +ATOM 8943 C CD2 . TYR B 1 488 ? 78.292 38.499 96.363 1.00 14.27 ? 508 TYR B CD2 1 +ATOM 8944 C CE1 . TYR B 1 488 ? 75.779 39.634 96.565 1.00 13.60 ? 508 TYR B CE1 1 +ATOM 8945 C CE2 . TYR B 1 488 ? 77.795 39.283 95.330 1.00 14.57 ? 508 TYR B CE2 1 +ATOM 8946 C CZ . TYR B 1 488 ? 76.541 39.857 95.444 1.00 13.56 ? 508 TYR B CZ 1 +ATOM 8947 O OH . TYR B 1 488 ? 76.054 40.617 94.402 1.00 13.82 ? 508 TYR B OH 1 +ATOM 8948 N N . HIS B 1 489 ? 78.984 36.961 101.957 1.00 11.53 ? 509 HIS B N 1 +ATOM 8949 C CA . HIS B 1 489 ? 79.106 36.041 103.096 1.00 11.90 ? 509 HIS B CA 1 +ATOM 8950 C C . HIS B 1 489 ? 79.883 36.708 104.227 1.00 10.84 ? 509 HIS B C 1 +ATOM 8951 O O . HIS B 1 489 ? 80.608 37.668 103.984 1.00 11.04 ? 509 HIS B O 1 +ATOM 8952 C CB . HIS B 1 489 ? 79.788 34.740 102.665 1.00 12.73 ? 509 HIS B CB 1 +ATOM 8953 C CG . HIS B 1 489 ? 80.442 34.823 101.324 1.00 14.75 ? 509 HIS B CG 1 +ATOM 8954 N ND1 . HIS B 1 489 ? 81.683 35.389 101.134 1.00 17.08 ? 509 HIS B ND1 1 +ATOM 8955 C CD2 . HIS B 1 489 ? 80.014 34.437 100.098 1.00 16.29 ? 509 HIS B CD2 1 +ATOM 8956 C CE1 . HIS B 1 489 ? 81.994 35.344 99.851 1.00 16.69 ? 509 HIS B CE1 1 +ATOM 8957 N NE2 . HIS B 1 489 ? 80.999 34.771 99.200 1.00 15.84 ? 509 HIS B NE2 1 +ATOM 8958 N N . ASP B 1 490 ? 79.730 36.185 105.449 1.00 10.10 ? 510 ASP B N 1 +ATOM 8959 C CA . ASP B 1 490 ? 80.357 36.746 106.647 1.00 9.94 ? 510 ASP B CA 1 +ATOM 8960 C C . ASP B 1 490 ? 80.083 38.252 106.710 1.00 9.24 ? 510 ASP B C 1 +ATOM 8961 O O . ASP B 1 490 ? 80.991 39.066 106.773 1.00 8.82 ? 510 ASP B O 1 +ATOM 8962 C CB . ASP B 1 490 ? 81.865 36.451 106.678 1.00 10.17 ? 510 ASP B CB 1 +ATOM 8963 C CG . ASP B 1 490 ? 82.180 34.969 106.458 1.00 11.16 ? 510 ASP B CG 1 +ATOM 8964 O OD1 . ASP B 1 490 ? 81.652 34.124 107.205 1.00 12.47 ? 510 ASP B OD1 1 +ATOM 8965 O OD2 . ASP B 1 490 ? 82.960 34.655 105.536 1.00 10.09 ? 510 ASP B OD2 1 +ATOM 8966 N N . TYR B 1 491 ? 78.803 38.590 106.707 1.00 8.52 ? 511 TYR B N 1 +ATOM 8967 C CA . TYR B 1 491 ? 78.352 39.966 106.499 1.00 9.12 ? 511 TYR B CA 1 +ATOM 8968 C C . TYR B 1 491 ? 79.015 40.938 107.474 1.00 8.72 ? 511 TYR B C 1 +ATOM 8969 O O . TYR B 1 491 ? 78.917 40.773 108.691 1.00 8.47 ? 511 TYR B O 1 +ATOM 8970 C CB . TYR B 1 491 ? 76.828 40.051 106.624 1.00 9.85 ? 511 TYR B CB 1 +ATOM 8971 C CG . TYR B 1 491 ? 76.053 39.050 105.788 1.00 9.97 ? 511 TYR B CG 1 +ATOM 8972 C CD1 . TYR B 1 491 ? 76.393 38.794 104.463 1.00 10.10 ? 511 TYR B CD1 1 +ATOM 8973 C CD2 . TYR B 1 491 ? 74.975 38.348 106.331 1.00 10.07 ? 511 TYR B CD2 1 +ATOM 8974 C CE1 . TYR B 1 491 ? 75.680 37.862 103.702 1.00 11.17 ? 511 TYR B CE1 1 +ATOM 8975 C CE2 . TYR B 1 491 ? 74.258 37.443 105.584 1.00 11.15 ? 511 TYR B CE2 1 +ATOM 8976 C CZ . TYR B 1 491 ? 74.608 37.198 104.264 1.00 11.40 ? 511 TYR B CZ 1 +ATOM 8977 O OH . TYR B 1 491 ? 73.887 36.266 103.531 1.00 11.79 ? 511 TYR B OH 1 +ATOM 8978 N N . GLY B 1 492 ? 79.712 41.927 106.927 1.00 8.38 ? 512 GLY B N 1 +ATOM 8979 C CA . GLY B 1 492 ? 80.312 43.003 107.715 1.00 8.52 ? 512 GLY B CA 1 +ATOM 8980 C C . GLY B 1 492 ? 81.723 42.711 108.201 1.00 8.83 ? 512 GLY B C 1 +ATOM 8981 O O . GLY B 1 492 ? 82.386 43.597 108.747 1.00 9.57 ? 512 GLY B O 1 +ATOM 8982 N N . HIS B 1 493 ? 82.187 41.471 108.006 1.00 9.65 ? 513 HIS B N 1 +ATOM 8983 C CA . HIS B 1 493 ? 83.475 41.027 108.547 1.00 9.66 ? 513 HIS B CA 1 +ATOM 8984 C C . HIS B 1 493 ? 84.663 41.421 107.646 1.00 9.58 ? 513 HIS B C 1 +ATOM 8985 O O . HIS B 1 493 ? 85.305 40.576 107.032 1.00 10.39 ? 513 HIS B O 1 +ATOM 8986 C CB . HIS B 1 493 ? 83.462 39.520 108.847 1.00 9.87 ? 513 HIS B CB 1 +ATOM 8987 C CG . HIS B 1 493 ? 82.647 39.159 110.050 1.00 10.95 ? 513 HIS B CG 1 +ATOM 8988 N ND1 . HIS B 1 493 ? 83.159 39.197 111.329 1.00 12.61 ? 513 HIS B ND1 1 +ATOM 8989 C CD2 . HIS B 1 493 ? 81.347 38.802 110.174 1.00 11.19 ? 513 HIS B CD2 1 +ATOM 8990 C CE1 . HIS B 1 493 ? 82.209 38.862 112.187 1.00 13.89 ? 513 HIS B CE1 1 +ATOM 8991 N NE2 . HIS B 1 493 ? 81.101 38.620 111.512 1.00 12.35 ? 513 HIS B NE2 1 +ATOM 8992 N N . LEU B 1 494 ? 84.939 42.725 107.603 1.00 9.95 ? 514 LEU B N 1 +ATOM 8993 C CA . LEU B 1 494 ? 86.036 43.291 106.816 1.00 9.91 ? 514 LEU B CA 1 +ATOM 8994 C C . LEU B 1 494 ? 87.376 42.636 107.157 1.00 10.14 ? 514 LEU B C 1 +ATOM 8995 O O . LEU B 1 494 ? 88.296 42.612 106.335 1.00 9.42 ? 514 LEU B O 1 +ATOM 8996 C CB . LEU B 1 494 ? 86.134 44.796 107.071 1.00 10.16 ? 514 LEU B CB 1 +ATOM 8997 C CG . LEU B 1 494 ? 85.027 45.682 106.480 1.00 9.80 ? 514 LEU B CG 1 +ATOM 8998 C CD1 . LEU B 1 494 ? 84.981 47.045 107.165 1.00 9.49 ? 514 LEU B CD1 1 +ATOM 8999 C CD2 . LEU B 1 494 ? 85.195 45.834 104.974 1.00 8.93 ? 514 LEU B CD2 1 +ATOM 9000 N N . GLU B 1 495 ? 87.484 42.140 108.386 1.00 10.45 ? 515 GLU B N 1 +ATOM 9001 C CA . GLU B 1 495 ? 88.739 41.622 108.905 1.00 11.62 ? 515 GLU B CA 1 +ATOM 9002 C C . GLU B 1 495 ? 89.126 40.270 108.304 1.00 11.73 ? 515 GLU B C 1 +ATOM 9003 O O . GLU B 1 495 ? 90.271 39.831 108.463 1.00 13.24 ? 515 GLU B O 1 +ATOM 9004 C CB . GLU B 1 495 ? 88.691 41.537 110.444 1.00 11.82 ? 515 GLU B CB 1 +ATOM 9005 C CG . GLU B 1 495 ? 87.987 40.297 111.029 1.00 12.85 ? 515 GLU B CG 1 +ATOM 9006 C CD . GLU B 1 495 ? 86.481 40.428 111.143 1.00 13.71 ? 515 GLU B CD 1 +ATOM 9007 O OE1 . GLU B 1 495 ? 85.905 41.368 110.552 1.00 14.58 ? 515 GLU B OE1 1 +ATOM 9008 O OE2 . GLU B 1 495 ? 85.865 39.585 111.831 1.00 13.41 ? 515 GLU B OE2 1 +ATOM 9009 N N . LEU B 1 496 ? 88.182 39.611 107.632 1.00 11.19 ? 516 LEU B N 1 +ATOM 9010 C CA . LEU B 1 496 ? 88.421 38.302 107.011 1.00 11.61 ? 516 LEU B CA 1 +ATOM 9011 C C . LEU B 1 496 ? 88.922 38.402 105.561 1.00 11.36 ? 516 LEU B C 1 +ATOM 9012 O O . LEU B 1 496 ? 89.396 37.423 105.011 1.00 12.04 ? 516 LEU B O 1 +ATOM 9013 C CB . LEU B 1 496 ? 87.143 37.464 107.037 1.00 11.67 ? 516 LEU B CB 1 +ATOM 9014 C CG . LEU B 1 496 ? 86.532 37.182 108.408 1.00 11.95 ? 516 LEU B CG 1 +ATOM 9015 C CD1 . LEU B 1 496 ? 85.243 36.398 108.243 1.00 13.84 ? 516 LEU B CD1 1 +ATOM 9016 C CD2 . LEU B 1 496 ? 87.521 36.431 109.302 1.00 12.56 ? 516 LEU B CD2 1 +ATOM 9017 N N . ILE B 1 497 ? 88.826 39.583 104.954 1.00 11.53 ? 517 ILE B N 1 +ATOM 9018 C CA . ILE B 1 497 ? 89.046 39.727 103.524 1.00 11.04 ? 517 ILE B CA 1 +ATOM 9019 C C . ILE B 1 497 ? 90.450 39.282 103.119 1.00 11.20 ? 517 ILE B C 1 +ATOM 9020 O O . ILE B 1 497 ? 90.604 38.501 102.191 1.00 11.81 ? 517 ILE B O 1 +ATOM 9021 C CB . ILE B 1 497 ? 88.766 41.161 103.039 1.00 11.14 ? 517 ILE B CB 1 +ATOM 9022 C CG1 . ILE B 1 497 ? 87.279 41.497 103.208 1.00 11.09 ? 517 ILE B CG1 1 +ATOM 9023 C CG2 . ILE B 1 497 ? 89.193 41.329 101.571 1.00 9.37 ? 517 ILE B CG2 1 +ATOM 9024 C CD1 . ILE B 1 497 ? 86.911 42.925 102.843 1.00 11.09 ? 517 ILE B CD1 1 +ATOM 9025 N N . GLN B 1 498 ? 91.469 39.759 103.824 1.00 11.92 ? 518 GLN B N 1 +ATOM 9026 C CA . GLN B 1 498 ? 92.850 39.442 103.431 1.00 12.00 ? 518 GLN B CA 1 +ATOM 9027 C C . GLN B 1 498 ? 93.148 37.946 103.503 1.00 12.14 ? 518 GLN B C 1 +ATOM 9028 O O . GLN B 1 498 ? 93.768 37.392 102.595 1.00 11.56 ? 518 GLN B O 1 +ATOM 9029 C CB . GLN B 1 498 ? 93.870 40.235 104.258 1.00 12.29 ? 518 GLN B CB 1 +ATOM 9030 C CG . GLN B 1 498 ? 93.942 41.678 103.905 1.00 12.90 ? 518 GLN B CG 1 +ATOM 9031 C CD . GLN B 1 498 ? 95.132 42.373 104.534 1.00 14.24 ? 518 GLN B CD 1 +ATOM 9032 O OE1 . GLN B 1 498 ? 96.289 42.004 104.297 1.00 14.53 ? 518 GLN B OE1 1 +ATOM 9033 N NE2 . GLN B 1 498 ? 94.860 43.402 105.317 1.00 13.97 ? 518 GLN B NE2 1 +ATOM 9034 N N . LEU B 1 499 ? 92.701 37.299 104.574 1.00 12.00 ? 519 LEU B N 1 +ATOM 9035 C CA . LEU B 1 499 ? 92.903 35.867 104.751 1.00 12.08 ? 519 LEU B CA 1 +ATOM 9036 C C . LEU B 1 499 ? 92.225 35.110 103.620 1.00 11.66 ? 519 LEU B C 1 +ATOM 9037 O O . LEU B 1 499 ? 92.826 34.271 102.968 1.00 11.84 ? 519 LEU B O 1 +ATOM 9038 C CB . LEU B 1 499 ? 92.338 35.402 106.097 1.00 12.06 ? 519 LEU B CB 1 +ATOM 9039 C CG . LEU B 1 499 ? 92.371 33.891 106.336 1.00 13.32 ? 519 LEU B CG 1 +ATOM 9040 C CD1 . LEU B 1 499 ? 93.781 33.369 106.071 1.00 14.88 ? 519 LEU B CD1 1 +ATOM 9041 C CD2 . LEU B 1 499 ? 91.916 33.553 107.767 1.00 12.96 ? 519 LEU B CD2 1 +ATOM 9042 N N . GLN B 1 500 ? 90.944 35.407 103.401 1.00 10.80 ? 520 GLN B N 1 +ATOM 9043 C CA . GLN B 1 500 ? 90.166 34.691 102.407 1.00 10.91 ? 520 GLN B CA 1 +ATOM 9044 C C . GLN B 1 500 ? 90.662 34.899 100.976 1.00 11.33 ? 520 GLN B C 1 +ATOM 9045 O O . GLN B 1 500 ? 90.634 33.979 100.168 1.00 11.28 ? 520 GLN B O 1 +ATOM 9046 C CB . GLN B 1 500 ? 88.682 35.020 102.559 1.00 10.30 ? 520 GLN B CB 1 +ATOM 9047 C CG . GLN B 1 500 ? 88.156 34.531 103.900 1.00 10.74 ? 520 GLN B CG 1 +ATOM 9048 C CD . GLN B 1 500 ? 86.664 34.739 104.110 1.00 12.98 ? 520 GLN B CD 1 +ATOM 9049 O OE1 . GLN B 1 500 ? 85.968 35.299 103.269 1.00 14.39 ? 520 GLN B OE1 1 +ATOM 9050 N NE2 . GLN B 1 500 ? 86.170 34.266 105.250 1.00 12.61 ? 520 GLN B NE2 1 +ATOM 9051 N N . LEU B 1 501 ? 91.133 36.104 100.677 1.00 12.38 ? 521 LEU B N 1 +ATOM 9052 C CA . LEU B 1 501 ? 91.670 36.411 99.358 1.00 13.50 ? 521 LEU B CA 1 +ATOM 9053 C C . LEU B 1 501 ? 92.975 35.637 99.149 1.00 13.83 ? 521 LEU B C 1 +ATOM 9054 O O . LEU B 1 501 ? 93.210 35.081 98.077 1.00 14.44 ? 521 LEU B O 1 +ATOM 9055 C CB . LEU B 1 501 ? 91.866 37.933 99.222 1.00 13.64 ? 521 LEU B CB 1 +ATOM 9056 C CG . LEU B 1 501 ? 91.932 38.558 97.822 1.00 15.36 ? 521 LEU B CG 1 +ATOM 9057 C CD1 . LEU B 1 501 ? 90.725 38.208 96.990 1.00 15.41 ? 521 LEU B CD1 1 +ATOM 9058 C CD2 . LEU B 1 501 ? 92.047 40.066 97.965 1.00 15.04 ? 521 LEU B CD2 1 +ATOM 9059 N N . ALA B 1 502 ? 93.800 35.574 100.193 1.00 13.81 ? 522 ALA B N 1 +ATOM 9060 C CA . ALA B 1 502 ? 95.098 34.889 100.124 1.00 13.57 ? 522 ALA B CA 1 +ATOM 9061 C C . ALA B 1 502 ? 94.909 33.416 99.810 1.00 13.65 ? 522 ALA B C 1 +ATOM 9062 O O . ALA B 1 502 ? 95.608 32.843 98.967 1.00 13.82 ? 522 ALA B O 1 +ATOM 9063 C CB . ALA B 1 502 ? 95.857 35.053 101.441 1.00 13.83 ? 522 ALA B CB 1 +ATOM 9064 N N . THR B 1 503 ? 93.961 32.809 100.513 1.00 12.92 ? 523 THR B N 1 +ATOM 9065 C CA . THR B 1 503 ? 93.596 31.428 100.314 1.00 13.03 ? 523 THR B CA 1 +ATOM 9066 C C . THR B 1 503 ? 93.037 31.198 98.905 1.00 12.18 ? 523 THR B C 1 +ATOM 9067 O O . THR B 1 503 ? 93.369 30.204 98.257 1.00 11.94 ? 523 THR B O 1 +ATOM 9068 C CB . THR B 1 503 ? 92.574 31.000 101.380 1.00 12.81 ? 523 THR B CB 1 +ATOM 9069 O OG1 . THR B 1 503 ? 93.205 31.029 102.671 1.00 13.78 ? 523 THR B OG1 1 +ATOM 9070 C CG2 . THR B 1 503 ? 92.050 29.620 101.098 1.00 14.37 ? 523 THR B CG2 1 +ATOM 9071 N N . GLN B 1 504 ? 92.199 32.125 98.439 1.00 11.90 ? 524 GLN B N 1 +ATOM 9072 C CA . GLN B 1 504 ? 91.673 32.090 97.069 1.00 11.47 ? 524 GLN B CA 1 +ATOM 9073 C C . GLN B 1 504 ? 92.788 31.999 96.036 1.00 12.01 ? 524 GLN B C 1 +ATOM 9074 O O . GLN B 1 504 ? 92.796 31.094 95.205 1.00 12.85 ? 524 GLN B O 1 +ATOM 9075 C CB . GLN B 1 504 ? 90.849 33.340 96.785 1.00 11.65 ? 524 GLN B CB 1 +ATOM 9076 C CG . GLN B 1 504 ? 90.389 33.510 95.345 1.00 10.54 ? 524 GLN B CG 1 +ATOM 9077 C CD . GLN B 1 504 ? 89.719 34.848 95.146 1.00 10.76 ? 524 GLN B CD 1 +ATOM 9078 O OE1 . GLN B 1 504 ? 88.712 35.136 95.791 1.00 10.59 ? 524 GLN B OE1 1 +ATOM 9079 N NE2 . GLN B 1 504 ? 90.268 35.679 94.255 1.00 9.36 ? 524 GLN B NE2 1 +ATOM 9080 N N . PHE B 1 505 ? 93.707 32.954 96.079 1.00 12.79 ? 525 PHE B N 1 +ATOM 9081 C CA . PHE B 1 505 ? 94.779 33.022 95.081 1.00 13.07 ? 525 PHE B CA 1 +ATOM 9082 C C . PHE B 1 505 ? 95.703 31.808 95.158 1.00 13.96 ? 525 PHE B C 1 +ATOM 9083 O O . PHE B 1 505 ? 96.087 31.249 94.128 1.00 14.18 ? 525 PHE B O 1 +ATOM 9084 C CB . PHE B 1 505 ? 95.590 34.309 95.223 1.00 13.15 ? 525 PHE B CB 1 +ATOM 9085 C CG . PHE B 1 505 ? 94.848 35.556 94.791 1.00 12.49 ? 525 PHE B CG 1 +ATOM 9086 C CD1 . PHE B 1 505 ? 94.094 35.579 93.613 1.00 13.46 ? 525 PHE B CD1 1 +ATOM 9087 C CD2 . PHE B 1 505 ? 94.937 36.715 95.537 1.00 11.62 ? 525 PHE B CD2 1 +ATOM 9088 C CE1 . PHE B 1 505 ? 93.423 36.739 93.218 1.00 14.07 ? 525 PHE B CE1 1 +ATOM 9089 C CE2 . PHE B 1 505 ? 94.265 37.887 95.133 1.00 12.99 ? 525 PHE B CE2 1 +ATOM 9090 C CZ . PHE B 1 505 ? 93.519 37.889 93.977 1.00 13.22 ? 525 PHE B CZ 1 +ATOM 9091 N N . GLU B 1 506 ? 96.045 31.402 96.379 1.00 14.20 ? 526 GLU B N 1 +ATOM 9092 C CA . GLU B 1 506 ? 96.936 30.261 96.582 1.00 15.41 ? 526 GLU B CA 1 +ATOM 9093 C C . GLU B 1 506 ? 96.293 28.980 96.041 1.00 14.62 ? 526 GLU B C 1 +ATOM 9094 O O . GLU B 1 506 ? 96.931 28.208 95.333 1.00 14.56 ? 526 GLU B O 1 +ATOM 9095 C CB . GLU B 1 506 ? 97.275 30.118 98.073 1.00 14.95 ? 526 GLU B CB 1 +ATOM 9096 C CG . GLU B 1 506 ? 98.115 31.253 98.647 1.00 18.02 ? 526 GLU B CG 1 +ATOM 9097 C CD . GLU B 1 506 ? 98.160 31.264 100.177 1.00 19.04 ? 526 GLU B CD 1 +ATOM 9098 O OE1 . GLU B 1 506 ? 97.206 30.775 100.825 1.00 24.22 ? 526 GLU B OE1 1 +ATOM 9099 O OE2 . GLU B 1 506 ? 99.165 31.763 100.730 1.00 24.57 ? 526 GLU B OE2 1 +ATOM 9100 N N . ASN B 1 507 ? 95.017 28.775 96.344 1.00 14.57 ? 527 ASN B N 1 +ATOM 9101 C CA . ASN B 1 507 ? 94.300 27.574 95.918 1.00 15.02 ? 527 ASN B CA 1 +ATOM 9102 C C . ASN B 1 507 ? 94.177 27.462 94.407 1.00 14.45 ? 527 ASN B C 1 +ATOM 9103 O O . ASN B 1 507 ? 94.488 26.423 93.826 1.00 15.10 ? 527 ASN B O 1 +ATOM 9104 C CB . ASN B 1 507 ? 92.903 27.529 96.551 1.00 15.40 ? 527 ASN B CB 1 +ATOM 9105 C CG . ASN B 1 507 ? 92.935 27.129 98.017 1.00 17.26 ? 527 ASN B CG 1 +ATOM 9106 O OD1 . ASN B 1 507 ? 93.984 26.774 98.550 1.00 19.49 ? 527 ASN B OD1 1 +ATOM 9107 N ND2 . ASN B 1 507 ? 91.779 27.182 98.672 1.00 17.96 ? 527 ASN B ND2 1 +ATOM 9108 N N . TRP B 1 508 ? 93.704 28.534 93.782 1.00 14.28 ? 528 TRP B N 1 +ATOM 9109 C CA . TRP B 1 508 ? 93.537 28.573 92.340 1.00 13.88 ? 528 TRP B CA 1 +ATOM 9110 C C . TRP B 1 508 ? 94.873 28.453 91.619 1.00 14.08 ? 528 TRP B C 1 +ATOM 9111 O O . TRP B 1 508 ? 94.972 27.709 90.659 1.00 14.35 ? 528 TRP B O 1 +ATOM 9112 C CB . TRP B 1 508 ? 92.827 29.862 91.900 1.00 13.80 ? 528 TRP B CB 1 +ATOM 9113 C CG . TRP B 1 508 ? 91.336 29.814 92.079 1.00 12.51 ? 528 TRP B CG 1 +ATOM 9114 C CD1 . TRP B 1 508 ? 90.635 30.191 93.173 1.00 13.00 ? 528 TRP B CD1 1 +ATOM 9115 C CD2 . TRP B 1 508 ? 90.366 29.360 91.118 1.00 12.84 ? 528 TRP B CD2 1 +ATOM 9116 N NE1 . TRP B 1 508 ? 89.288 30.008 92.963 1.00 12.03 ? 528 TRP B NE1 1 +ATOM 9117 C CE2 . TRP B 1 508 ? 89.099 29.504 91.705 1.00 12.43 ? 528 TRP B CE2 1 +ATOM 9118 C CE3 . TRP B 1 508 ? 90.451 28.852 89.817 1.00 13.79 ? 528 TRP B CE3 1 +ATOM 9119 C CZ2 . TRP B 1 508 ? 87.918 29.164 91.036 1.00 13.66 ? 528 TRP B CZ2 1 +ATOM 9120 C CZ3 . TRP B 1 508 ? 89.284 28.524 89.152 1.00 13.33 ? 528 TRP B CZ3 1 +ATOM 9121 C CH2 . TRP B 1 508 ? 88.034 28.669 89.771 1.00 12.91 ? 528 TRP B CH2 1 +ATOM 9122 N N . TYR B 1 509 ? 95.899 29.180 92.066 1.00 14.27 ? 529 TYR B N 1 +ATOM 9123 C CA . TYR B 1 509 ? 97.149 29.152 91.315 1.00 14.99 ? 529 TYR B CA 1 +ATOM 9124 C C . TYR B 1 509 ? 97.856 27.814 91.447 1.00 15.82 ? 529 TYR B C 1 +ATOM 9125 O O . TYR B 1 509 ? 98.476 27.360 90.496 1.00 15.85 ? 529 TYR B O 1 +ATOM 9126 C CB . TYR B 1 509 ? 98.112 30.271 91.683 1.00 15.29 ? 529 TYR B CB 1 +ATOM 9127 C CG . TYR B 1 509 ? 99.175 30.432 90.612 1.00 15.68 ? 529 TYR B CG 1 +ATOM 9128 C CD1 . TYR B 1 509 ? 98.858 30.971 89.366 1.00 15.45 ? 529 TYR B CD1 1 +ATOM 9129 C CD2 . TYR B 1 509 ? 100.479 30.001 90.824 1.00 16.31 ? 529 TYR B CD2 1 +ATOM 9130 C CE1 . TYR B 1 509 ? 99.822 31.103 88.370 1.00 16.21 ? 529 TYR B CE1 1 +ATOM 9131 C CE2 . TYR B 1 509 ? 101.445 30.120 89.831 1.00 15.65 ? 529 TYR B CE2 1 +ATOM 9132 C CZ . TYR B 1 509 ? 101.113 30.671 88.608 1.00 16.25 ? 529 TYR B CZ 1 +ATOM 9133 O OH . TYR B 1 509 ? 102.077 30.804 87.622 1.00 15.21 ? 529 TYR B OH 1 +ATOM 9134 N N . LYS B 1 510 ? 97.789 27.193 92.615 1.00 16.85 ? 530 LYS B N 1 +ATOM 9135 C CA . LYS B 1 510 ? 98.405 25.872 92.769 1.00 17.87 ? 530 LYS B CA 1 +ATOM 9136 C C . LYS B 1 510 ? 97.767 24.866 91.826 1.00 18.18 ? 530 LYS B C 1 +ATOM 9137 O O . LYS B 1 510 ? 98.461 24.058 91.217 1.00 18.73 ? 530 LYS B O 1 +ATOM 9138 C CB . LYS B 1 510 ? 98.317 25.379 94.209 1.00 18.26 ? 530 LYS B CB 1 +ATOM 9139 C CG . LYS B 1 510 ? 98.925 23.992 94.415 1.00 19.92 ? 530 LYS B CG 1 +ATOM 9140 C CD . LYS B 1 510 ? 99.066 23.656 95.883 1.00 22.12 ? 530 LYS B CD 1 +ATOM 9141 C CE . LYS B 1 510 ? 99.966 22.451 96.091 1.00 23.78 ? 530 LYS B CE 1 +ATOM 9142 N NZ . LYS B 1 510 ? 99.360 21.198 95.570 1.00 25.45 ? 530 LYS B NZ 1 +ATOM 9143 N N . LYS B 1 511 ? 96.450 24.921 91.689 1.00 18.52 ? 531 LYS B N 1 +ATOM 9144 C CA . LYS B 1 511 ? 95.741 23.938 90.889 1.00 19.20 ? 531 LYS B CA 1 +ATOM 9145 C C . LYS B 1 511 ? 95.921 24.143 89.391 1.00 19.69 ? 531 LYS B C 1 +ATOM 9146 O O . LYS B 1 511 ? 96.141 23.179 88.658 1.00 19.24 ? 531 LYS B O 1 +ATOM 9147 C CB . LYS B 1 511 ? 94.253 23.943 91.221 1.00 19.02 ? 531 LYS B CB 1 +ATOM 9148 C CG . LYS B 1 511 ? 93.533 22.690 90.724 1.00 20.30 ? 531 LYS B CG 1 +ATOM 9149 C CD . LYS B 1 511 ? 92.085 22.633 91.169 1.00 21.50 ? 531 LYS B CD 1 +ATOM 9150 C CE . LYS B 1 511 ? 91.507 21.220 91.107 1.00 23.56 ? 531 LYS B CE 1 +ATOM 9151 N NZ . LYS B 1 511 ? 91.970 20.408 89.941 1.00 24.92 ? 531 LYS B NZ 1 +ATOM 9152 N N . TYR B 1 512 ? 95.823 25.394 88.934 1.00 20.19 ? 532 TYR B N 1 +ATOM 9153 C CA . TYR B 1 512 ? 95.788 25.663 87.491 1.00 21.07 ? 532 TYR B CA 1 +ATOM 9154 C C . TYR B 1 512 ? 97.037 26.283 86.879 1.00 20.74 ? 532 TYR B C 1 +ATOM 9155 O O . TYR B 1 512 ? 97.295 26.073 85.700 1.00 21.49 ? 532 TYR B O 1 +ATOM 9156 C CB . TYR B 1 512 ? 94.515 26.448 87.136 1.00 21.62 ? 532 TYR B CB 1 +ATOM 9157 C CG . TYR B 1 512 ? 93.320 25.535 87.226 1.00 22.83 ? 532 TYR B CG 1 +ATOM 9158 C CD1 . TYR B 1 512 ? 93.203 24.468 86.348 1.00 23.85 ? 532 TYR B CD1 1 +ATOM 9159 C CD2 . TYR B 1 512 ? 92.356 25.676 88.220 1.00 23.76 ? 532 TYR B CD2 1 +ATOM 9160 C CE1 . TYR B 1 512 ? 92.156 23.597 86.415 1.00 25.11 ? 532 TYR B CE1 1 +ATOM 9161 C CE2 . TYR B 1 512 ? 91.275 24.787 88.294 1.00 24.28 ? 532 TYR B CE2 1 +ATOM 9162 C CZ . TYR B 1 512 ? 91.199 23.744 87.380 1.00 23.85 ? 532 TYR B CZ 1 +ATOM 9163 O OH . TYR B 1 512 ? 90.176 22.819 87.387 1.00 25.27 ? 532 TYR B OH 1 +ATOM 9164 N N . GLN B 1 513 ? 97.800 27.042 87.658 1.00 20.38 ? 533 GLN B N 1 +ATOM 9165 C CA . GLN B 1 513 ? 99.062 27.632 87.178 1.00 20.07 ? 533 GLN B CA 1 +ATOM 9166 C C . GLN B 1 513 ? 98.887 28.511 85.922 1.00 18.78 ? 533 GLN B C 1 +ATOM 9167 O O . GLN B 1 513 ? 99.711 28.489 85.005 1.00 18.33 ? 533 GLN B O 1 +ATOM 9168 C CB . GLN B 1 513 ? 100.111 26.533 86.932 1.00 20.53 ? 533 GLN B CB 1 +ATOM 9169 C CG . GLN B 1 513 ? 100.122 25.464 88.015 1.00 21.55 ? 533 GLN B CG 1 +ATOM 9170 C CD . GLN B 1 513 ? 101.296 24.518 87.916 1.00 22.37 ? 533 GLN B CD 1 +ATOM 9171 O OE1 . GLN B 1 513 ? 102.371 24.878 87.428 1.00 26.95 ? 533 GLN B OE1 1 +ATOM 9172 N NE2 . GLN B 1 513 ? 101.100 23.298 88.392 1.00 26.98 ? 533 GLN B NE2 1 +ATOM 9173 N N . LYS B 1 514 ? 97.808 29.287 85.898 1.00 17.12 ? 534 LYS B N 1 +ATOM 9174 C CA . LYS B 1 514 ? 97.581 30.297 84.852 1.00 15.85 ? 534 LYS B CA 1 +ATOM 9175 C C . LYS B 1 514 ? 97.468 31.666 85.524 1.00 13.97 ? 534 LYS B C 1 +ATOM 9176 O O . LYS B 1 514 ? 97.152 31.736 86.710 1.00 11.95 ? 534 LYS B O 1 +ATOM 9177 C CB . LYS B 1 514 ? 96.292 30.006 84.077 1.00 16.32 ? 534 LYS B CB 1 +ATOM 9178 C CG . LYS B 1 514 ? 96.363 28.837 83.088 1.00 19.16 ? 534 LYS B CG 1 +ATOM 9179 C CD . LYS B 1 514 ? 95.615 27.604 83.589 1.00 20.66 ? 534 LYS B CD 1 +ATOM 9180 C CE . LYS B 1 514 ? 94.112 27.684 83.356 1.00 21.35 ? 534 LYS B CE 1 +ATOM 9181 N NZ . LYS B 1 514 ? 93.631 26.804 82.242 1.00 21.07 ? 534 LYS B NZ 1 +ATOM 9182 N N . PRO B 1 515 ? 97.733 32.757 84.779 1.00 12.33 ? 535 PRO B N 1 +ATOM 9183 C CA . PRO B 1 515 ? 97.543 34.081 85.398 1.00 11.63 ? 535 PRO B CA 1 +ATOM 9184 C C . PRO B 1 515 ? 96.091 34.276 85.837 1.00 10.38 ? 535 PRO B C 1 +ATOM 9185 O O . PRO B 1 515 ? 95.184 33.683 85.236 1.00 10.01 ? 535 PRO B O 1 +ATOM 9186 C CB . PRO B 1 515 ? 97.900 35.060 84.273 1.00 11.41 ? 535 PRO B CB 1 +ATOM 9187 C CG . PRO B 1 515 ? 98.757 34.270 83.330 1.00 12.64 ? 535 PRO B CG 1 +ATOM 9188 C CD . PRO B 1 515 ? 98.230 32.863 83.396 1.00 12.20 ? 535 PRO B CD 1 +ATOM 9189 N N . ILE B 1 516 ? 95.905 35.098 86.871 1.00 9.63 ? 536 ILE B N 1 +ATOM 9190 C CA . ILE B 1 516 ? 94.592 35.348 87.474 1.00 9.47 ? 536 ILE B CA 1 +ATOM 9191 C C . ILE B 1 516 ? 94.231 36.827 87.423 1.00 9.08 ? 536 ILE B C 1 +ATOM 9192 O O . ILE B 1 516 ? 95.070 37.703 87.671 1.00 8.65 ? 536 ILE B O 1 +ATOM 9193 C CB . ILE B 1 516 ? 94.578 34.899 88.946 1.00 9.58 ? 536 ILE B CB 1 +ATOM 9194 C CG1 . ILE B 1 516 ? 94.695 33.375 89.021 1.00 9.93 ? 536 ILE B CG1 1 +ATOM 9195 C CG2 . ILE B 1 516 ? 93.307 35.408 89.672 1.00 9.73 ? 536 ILE B CG2 1 +ATOM 9196 C CD1 . ILE B 1 516 ? 95.019 32.817 90.420 1.00 10.24 ? 536 ILE B CD1 1 +ATOM 9197 N N . ILE B 1 517 ? 92.966 37.096 87.085 1.00 8.67 ? 537 ILE B N 1 +ATOM 9198 C CA . ILE B 1 517 ? 92.385 38.429 87.226 1.00 8.14 ? 537 ILE B CA 1 +ATOM 9199 C C . ILE B 1 517 ? 91.281 38.350 88.282 1.00 7.99 ? 537 ILE B C 1 +ATOM 9200 O O . ILE B 1 517 ? 90.457 37.439 88.236 1.00 8.14 ? 537 ILE B O 1 +ATOM 9201 C CB . ILE B 1 517 ? 91.795 38.932 85.882 1.00 8.16 ? 537 ILE B CB 1 +ATOM 9202 C CG1 . ILE B 1 517 ? 92.920 39.190 84.872 1.00 7.25 ? 537 ILE B CG1 1 +ATOM 9203 C CG2 . ILE B 1 517 ? 90.996 40.224 86.080 1.00 8.91 ? 537 ILE B CG2 1 +ATOM 9204 C CD1 . ILE B 1 517 ? 92.436 39.333 83.464 1.00 7.59 ? 537 ILE B CD1 1 +ATOM 9205 N N . GLN B 1 518 ? 91.305 39.266 89.251 1.00 8.33 ? 538 GLN B N 1 +ATOM 9206 C CA . GLN B 1 518 ? 90.165 39.470 90.142 1.00 8.11 ? 538 GLN B CA 1 +ATOM 9207 C C . GLN B 1 518 ? 89.185 40.327 89.354 1.00 8.05 ? 538 GLN B C 1 +ATOM 9208 O O . GLN B 1 518 ? 89.325 41.558 89.297 1.00 7.80 ? 538 GLN B O 1 +ATOM 9209 C CB . GLN B 1 518 ? 90.600 40.161 91.430 1.00 8.56 ? 538 GLN B CB 1 +ATOM 9210 C CG . GLN B 1 518 ? 89.484 40.367 92.444 1.00 9.08 ? 538 GLN B CG 1 +ATOM 9211 C CD . GLN B 1 518 ? 89.118 39.112 93.185 1.00 11.40 ? 538 GLN B CD 1 +ATOM 9212 O OE1 . GLN B 1 518 ? 89.982 38.287 93.498 1.00 9.84 ? 538 GLN B OE1 1 +ATOM 9213 N NE2 . GLN B 1 518 ? 87.835 38.970 93.508 1.00 11.01 ? 538 GLN B NE2 1 +ATOM 9214 N N . SER B 1 519 ? 88.225 39.660 88.727 1.00 7.06 ? 539 SER B N 1 +ATOM 9215 C CA . SER B 1 519 ? 87.330 40.276 87.742 1.00 7.94 ? 539 SER B CA 1 +ATOM 9216 C C . SER B 1 519 ? 86.107 40.985 88.349 1.00 7.32 ? 539 SER B C 1 +ATOM 9217 O O . SER B 1 519 ? 85.470 41.796 87.674 1.00 7.60 ? 539 SER B O 1 +ATOM 9218 C CB . SER B 1 519 ? 86.858 39.225 86.742 1.00 7.78 ? 539 SER B CB 1 +ATOM 9219 O OG . SER B 1 519 ? 86.552 38.014 87.384 1.00 8.90 ? 539 SER B OG 1 +ATOM 9220 N N . GLU B 1 520 ? 85.768 40.657 89.595 1.00 7.72 ? 540 GLU B N 1 +ATOM 9221 C CA . GLU B 1 520 ? 84.757 41.394 90.362 1.00 7.69 ? 540 GLU B CA 1 +ATOM 9222 C C . GLU B 1 520 ? 85.066 41.368 91.846 1.00 7.46 ? 540 GLU B C 1 +ATOM 9223 O O . GLU B 1 520 ? 85.533 40.362 92.383 1.00 7.91 ? 540 GLU B O 1 +ATOM 9224 C CB . GLU B 1 520 ? 83.356 40.809 90.218 1.00 8.06 ? 540 GLU B CB 1 +ATOM 9225 C CG . GLU B 1 520 ? 82.723 40.944 88.835 1.00 7.92 ? 540 GLU B CG 1 +ATOM 9226 C CD . GLU B 1 520 ? 81.319 40.381 88.777 1.00 7.97 ? 540 GLU B CD 1 +ATOM 9227 O OE1 . GLU B 1 520 ? 80.638 40.265 89.822 1.00 9.06 ? 540 GLU B OE1 1 +ATOM 9228 O OE2 . GLU B 1 520 ? 80.897 40.040 87.675 1.00 7.01 ? 540 GLU B OE2 1 +ATOM 9229 N N . TYR B 1 521 ? 84.765 42.487 92.490 1.00 6.80 ? 541 TYR B N 1 +ATOM 9230 C CA . TYR B 1 521 ? 84.714 42.619 93.947 1.00 6.72 ? 541 TYR B CA 1 +ATOM 9231 C C . TYR B 1 521 ? 84.038 43.975 94.173 1.00 7.22 ? 541 TYR B C 1 +ATOM 9232 O O . TYR B 1 521 ? 84.020 44.802 93.257 1.00 7.11 ? 541 TYR B O 1 +ATOM 9233 C CB . TYR B 1 521 ? 86.110 42.604 94.578 1.00 7.68 ? 541 TYR B CB 1 +ATOM 9234 C CG . TYR B 1 521 ? 86.915 43.850 94.297 1.00 7.98 ? 541 TYR B CG 1 +ATOM 9235 C CD1 . TYR B 1 521 ? 87.596 44.003 93.092 1.00 8.53 ? 541 TYR B CD1 1 +ATOM 9236 C CD2 . TYR B 1 521 ? 87.000 44.881 95.231 1.00 9.01 ? 541 TYR B CD2 1 +ATOM 9237 C CE1 . TYR B 1 521 ? 88.332 45.140 92.832 1.00 7.95 ? 541 TYR B CE1 1 +ATOM 9238 C CE2 . TYR B 1 521 ? 87.738 46.016 94.991 1.00 8.99 ? 541 TYR B CE2 1 +ATOM 9239 C CZ . TYR B 1 521 ? 88.400 46.150 93.789 1.00 8.12 ? 541 TYR B CZ 1 +ATOM 9240 O OH . TYR B 1 521 ? 89.110 47.304 93.546 1.00 8.56 ? 541 TYR B OH 1 +ATOM 9241 N N . GLY B 1 522 ? 83.477 44.190 95.359 1.00 7.26 ? 542 GLY B N 1 +ATOM 9242 C CA . GLY B 1 522 ? 82.716 45.420 95.628 1.00 7.41 ? 542 GLY B CA 1 +ATOM 9243 C C . GLY B 1 522 ? 81.733 45.347 96.784 1.00 7.54 ? 542 GLY B C 1 +ATOM 9244 O O . GLY B 1 522 ? 81.644 44.338 97.483 1.00 6.22 ? 542 GLY B O 1 +ATOM 9245 N N . ALA B 1 523 ? 81.001 46.452 96.968 1.00 7.91 ? 543 ALA B N 1 +ATOM 9246 C CA . ALA B 1 523 ? 80.019 46.589 98.042 1.00 7.61 ? 543 ALA B CA 1 +ATOM 9247 C C . ALA B 1 523 ? 78.844 47.476 97.608 1.00 7.14 ? 543 ALA B C 1 +ATOM 9248 O O . ALA B 1 523 ? 79.053 48.519 97.003 1.00 7.85 ? 543 ALA B O 1 +ATOM 9249 C CB . ALA B 1 523 ? 80.697 47.175 99.266 1.00 8.21 ? 543 ALA B CB 1 +ATOM 9250 N N . GLU B 1 524 ? 77.610 47.079 97.927 1.00 7.22 ? 544 GLU B N 1 +ATOM 9251 C CA . GLU B 1 524 ? 76.474 47.953 97.655 1.00 6.56 ? 544 GLU B CA 1 +ATOM 9252 C C . GLU B 1 524 ? 76.638 49.161 98.536 1.00 6.39 ? 544 GLU B C 1 +ATOM 9253 O O . GLU B 1 524 ? 76.966 49.033 99.712 1.00 5.07 ? 544 GLU B O 1 +ATOM 9254 C CB . GLU B 1 524 ? 75.140 47.300 97.954 1.00 6.79 ? 544 GLU B CB 1 +ATOM 9255 C CG . GLU B 1 524 ? 74.908 45.974 97.249 1.00 6.49 ? 544 GLU B CG 1 +ATOM 9256 C CD . GLU B 1 524 ? 74.331 46.103 95.852 1.00 9.61 ? 544 GLU B CD 1 +ATOM 9257 O OE1 . GLU B 1 524 ? 73.629 47.097 95.561 1.00 8.54 ? 544 GLU B OE1 1 +ATOM 9258 O OE2 . GLU B 1 524 ? 74.588 45.193 95.037 1.00 8.93 ? 544 GLU B OE2 1 +ATOM 9259 N N . THR B 1 525 ? 76.407 50.326 97.961 1.00 6.47 ? 545 THR B N 1 +ATOM 9260 C CA . THR B 1 525 ? 76.718 51.594 98.622 1.00 6.68 ? 545 THR B CA 1 +ATOM 9261 C C . THR B 1 525 ? 75.696 52.662 98.246 1.00 7.39 ? 545 THR B C 1 +ATOM 9262 O O . THR B 1 525 ? 75.614 53.056 97.085 1.00 7.56 ? 545 THR B O 1 +ATOM 9263 C CB . THR B 1 525 ? 78.108 52.085 98.186 1.00 6.97 ? 545 THR B CB 1 +ATOM 9264 O OG1 . THR B 1 525 ? 79.081 51.070 98.438 1.00 6.75 ? 545 THR B OG1 1 +ATOM 9265 C CG2 . THR B 1 525 ? 78.529 53.363 98.945 1.00 6.93 ? 545 THR B CG2 1 +ATOM 9266 N N . ILE B 1 526 ? 74.920 53.113 99.227 1.00 7.70 ? 546 ILE B N 1 +ATOM 9267 C CA . ILE B 1 526 ? 73.926 54.165 99.009 1.00 8.47 ? 546 ILE B CA 1 +ATOM 9268 C C . ILE B 1 526 ? 74.621 55.501 99.239 1.00 8.39 ? 546 ILE B C 1 +ATOM 9269 O O . ILE B 1 526 ? 75.042 55.803 100.367 1.00 7.76 ? 546 ILE B O 1 +ATOM 9270 C CB . ILE B 1 526 ? 72.722 54.047 99.984 1.00 8.85 ? 546 ILE B CB 1 +ATOM 9271 C CG1 . ILE B 1 526 ? 72.178 52.619 100.033 1.00 9.99 ? 546 ILE B CG1 1 +ATOM 9272 C CG2 . ILE B 1 526 ? 71.601 55.022 99.581 1.00 9.20 ? 546 ILE B CG2 1 +ATOM 9273 C CD1 . ILE B 1 526 ? 71.660 52.102 98.711 1.00 11.74 ? 546 ILE B CD1 1 +ATOM 9274 N N . ALA B 1 527 ? 74.779 56.288 98.176 1.00 8.18 ? 547 ALA B N 1 +ATOM 9275 C CA . ALA B 1 527 ? 75.409 57.598 98.305 1.00 8.27 ? 547 ALA B CA 1 +ATOM 9276 C C . ALA B 1 527 ? 74.793 58.375 99.467 1.00 8.03 ? 547 ALA B C 1 +ATOM 9277 O O . ALA B 1 527 ? 73.561 58.464 99.576 1.00 8.91 ? 547 ALA B O 1 +ATOM 9278 C CB . ALA B 1 527 ? 75.302 58.389 97.004 1.00 8.62 ? 547 ALA B CB 1 +ATOM 9279 N N . GLY B 1 528 ? 75.650 58.891 100.344 1.00 7.42 ? 548 GLY B N 1 +ATOM 9280 C CA . GLY B 1 528 ? 75.226 59.692 101.498 1.00 7.36 ? 548 GLY B CA 1 +ATOM 9281 C C . GLY B 1 528 ? 75.023 58.929 102.806 1.00 7.41 ? 548 GLY B C 1 +ATOM 9282 O O . GLY B 1 528 ? 74.819 59.539 103.847 1.00 7.79 ? 548 GLY B O 1 +ATOM 9283 N N . PHE B 1 529 ? 75.036 57.599 102.755 1.00 6.80 ? 549 PHE B N 1 +ATOM 9284 C CA . PHE B 1 529 ? 74.980 56.785 103.968 1.00 7.38 ? 549 PHE B CA 1 +ATOM 9285 C C . PHE B 1 529 ? 76.367 56.727 104.549 1.00 7.40 ? 549 PHE B C 1 +ATOM 9286 O O . PHE B 1 529 ? 77.278 56.253 103.877 1.00 8.48 ? 549 PHE B O 1 +ATOM 9287 C CB . PHE B 1 529 ? 74.491 55.361 103.685 1.00 6.85 ? 549 PHE B CB 1 +ATOM 9288 C CG . PHE B 1 529 ? 72.979 55.215 103.723 1.00 7.96 ? 549 PHE B CG 1 +ATOM 9289 C CD1 . PHE B 1 529 ? 72.164 56.178 103.175 1.00 10.54 ? 549 PHE B CD1 1 +ATOM 9290 C CD2 . PHE B 1 529 ? 72.391 54.111 104.317 1.00 9.82 ? 549 PHE B CD2 1 +ATOM 9291 C CE1 . PHE B 1 529 ? 70.760 56.040 103.206 1.00 10.51 ? 549 PHE B CE1 1 +ATOM 9292 C CE2 . PHE B 1 529 ? 71.007 53.968 104.350 1.00 11.59 ? 549 PHE B CE2 1 +ATOM 9293 C CZ . PHE B 1 529 ? 70.199 54.950 103.802 1.00 9.34 ? 549 PHE B CZ 1 +ATOM 9294 N N . HIS B 1 530 ? 76.507 57.197 105.790 1.00 7.64 ? 550 HIS B N 1 +ATOM 9295 C CA . HIS B 1 530 ? 77.790 57.278 106.471 1.00 7.68 ? 550 HIS B CA 1 +ATOM 9296 C C . HIS B 1 530 ? 77.746 56.618 107.854 1.00 7.82 ? 550 HIS B C 1 +ATOM 9297 O O . HIS B 1 530 ? 76.764 56.751 108.588 1.00 8.02 ? 550 HIS B O 1 +ATOM 9298 C CB . HIS B 1 530 ? 78.171 58.743 106.674 1.00 8.07 ? 550 HIS B CB 1 +ATOM 9299 C CG . HIS B 1 530 ? 78.517 59.471 105.414 1.00 8.48 ? 550 HIS B CG 1 +ATOM 9300 N ND1 . HIS B 1 530 ? 79.720 59.292 104.766 1.00 9.29 ? 550 HIS B ND1 1 +ATOM 9301 C CD2 . HIS B 1 530 ? 77.857 60.431 104.724 1.00 10.55 ? 550 HIS B CD2 1 +ATOM 9302 C CE1 . HIS B 1 530 ? 79.775 60.095 103.716 1.00 10.03 ? 550 HIS B CE1 1 +ATOM 9303 N NE2 . HIS B 1 530 ? 78.656 60.795 103.666 1.00 9.59 ? 550 HIS B NE2 1 +ATOM 9304 N N . GLN B 1 531 ? 78.816 55.920 108.225 1.00 7.95 ? 551 GLN B N 1 +ATOM 9305 C CA . GLN B 1 531 ? 78.960 55.452 109.598 1.00 7.97 ? 551 GLN B CA 1 +ATOM 9306 C C . GLN B 1 531 ? 80.399 55.153 109.918 1.00 8.03 ? 551 GLN B C 1 +ATOM 9307 O O . GLN B 1 531 ? 81.156 54.754 109.045 1.00 8.43 ? 551 GLN B O 1 +ATOM 9308 C CB . GLN B 1 531 ? 78.115 54.211 109.887 1.00 8.39 ? 551 GLN B CB 1 +ATOM 9309 C CG . GLN B 1 531 ? 78.086 53.841 111.377 1.00 9.94 ? 551 GLN B CG 1 +ATOM 9310 C CD . GLN B 1 531 ? 76.715 53.524 111.935 1.00 12.00 ? 551 GLN B CD 1 +ATOM 9311 O OE1 . GLN B 1 531 ? 75.691 53.925 111.389 1.00 12.41 ? 551 GLN B OE1 1 +ATOM 9312 N NE2 . GLN B 1 531 ? 76.694 52.805 113.057 1.00 13.67 ? 551 GLN B NE2 1 +ATOM 9313 N N . ASP B 1 532 ? 80.748 55.403 111.173 1.00 8.34 ? 552 ASP B N 1 +ATOM 9314 C CA . ASP B 1 532 ? 81.977 54.924 111.777 1.00 9.17 ? 552 ASP B CA 1 +ATOM 9315 C C . ASP B 1 532 ? 81.653 54.362 113.151 1.00 9.27 ? 552 ASP B C 1 +ATOM 9316 O O . ASP B 1 532 ? 80.951 55.007 113.941 1.00 9.62 ? 552 ASP B O 1 +ATOM 9317 C CB . ASP B 1 532 ? 83.001 56.030 111.949 1.00 9.28 ? 552 ASP B CB 1 +ATOM 9318 C CG . ASP B 1 532 ? 84.337 55.485 112.394 1.00 9.94 ? 552 ASP B CG 1 +ATOM 9319 O OD1 . ASP B 1 532 ? 85.019 54.852 111.556 1.00 11.68 ? 552 ASP B OD1 1 +ATOM 9320 O OD2 . ASP B 1 532 ? 84.687 55.639 113.589 1.00 11.01 ? 552 ASP B OD2 1 +ATOM 9321 N N . PRO B 1 533 ? 82.135 53.143 113.441 1.00 9.66 ? 553 PRO B N 1 +ATOM 9322 C CA . PRO B 1 533 ? 82.829 52.238 112.526 1.00 9.32 ? 553 PRO B CA 1 +ATOM 9323 C C . PRO B 1 533 ? 81.933 51.858 111.349 1.00 9.09 ? 553 PRO B C 1 +ATOM 9324 O O . PRO B 1 533 ? 80.713 51.977 111.448 1.00 8.33 ? 553 PRO B O 1 +ATOM 9325 C CB . PRO B 1 533 ? 83.148 51.035 113.419 1.00 9.43 ? 553 PRO B CB 1 +ATOM 9326 C CG . PRO B 1 533 ? 83.177 51.622 114.804 1.00 9.48 ? 553 PRO B CG 1 +ATOM 9327 C CD . PRO B 1 533 ? 82.028 52.553 114.784 1.00 9.87 ? 553 PRO B CD 1 +ATOM 9328 N N . PRO B 1 534 ? 82.525 51.463 110.220 1.00 8.76 ? 554 PRO B N 1 +ATOM 9329 C CA . PRO B 1 534 ? 81.696 51.264 109.029 1.00 8.95 ? 554 PRO B CA 1 +ATOM 9330 C C . PRO B 1 534 ? 80.724 50.080 109.099 1.00 8.69 ? 554 PRO B C 1 +ATOM 9331 O O . PRO B 1 534 ? 81.031 49.025 109.689 1.00 8.13 ? 554 PRO B O 1 +ATOM 9332 C CB . PRO B 1 534 ? 82.725 51.046 107.918 1.00 9.05 ? 554 PRO B CB 1 +ATOM 9333 C CG . PRO B 1 534 ? 83.931 50.598 108.594 1.00 10.24 ? 554 PRO B CG 1 +ATOM 9334 C CD . PRO B 1 534 ? 83.943 51.192 109.958 1.00 9.18 ? 554 PRO B CD 1 +ATOM 9335 N N . LEU B 1 535 ? 79.564 50.265 108.472 1.00 8.38 ? 555 LEU B N 1 +ATOM 9336 C CA . LEU B 1 535 ? 78.591 49.204 108.299 1.00 9.06 ? 555 LEU B CA 1 +ATOM 9337 C C . LEU B 1 535 ? 78.218 49.070 106.816 1.00 8.57 ? 555 LEU B C 1 +ATOM 9338 O O . LEU B 1 535 ? 78.271 50.034 106.064 1.00 8.23 ? 555 LEU B O 1 +ATOM 9339 C CB . LEU B 1 535 ? 77.338 49.513 109.112 1.00 9.58 ? 555 LEU B CB 1 +ATOM 9340 C CG . LEU B 1 535 ? 77.497 49.568 110.630 1.00 10.59 ? 555 LEU B CG 1 +ATOM 9341 C CD1 . LEU B 1 535 ? 76.159 49.937 111.260 1.00 12.26 ? 555 LEU B CD1 1 +ATOM 9342 C CD2 . LEU B 1 535 ? 77.977 48.235 111.181 1.00 13.07 ? 555 LEU B CD2 1 +ATOM 9343 N N . MET B 1 536 ? 77.806 47.868 106.416 1.00 8.39 ? 556 MET B N 1 +ATOM 9344 C CA . MET B 1 536 ? 77.339 47.613 105.052 1.00 8.29 ? 556 MET B CA 1 +ATOM 9345 C C . MET B 1 536 ? 76.384 48.705 104.567 1.00 7.73 ? 556 MET B C 1 +ATOM 9346 O O . MET B 1 536 ? 75.550 49.159 105.333 1.00 8.17 ? 556 MET B O 1 +ATOM 9347 C CB . MET B 1 536 ? 76.640 46.251 104.993 1.00 8.70 ? 556 MET B CB 1 +ATOM 9348 C CG . MET B 1 536 ? 77.591 45.080 105.091 1.00 9.31 ? 556 MET B CG 1 +ATOM 9349 S SD . MET B 1 536 ? 76.793 43.462 105.159 1.00 10.83 ? 556 MET B SD 1 +ATOM 9350 C CE . MET B 1 536 ? 76.076 43.392 103.525 1.00 11.47 ? 556 MET B CE 1 +ATOM 9351 N N . PHE B 1 537 ? 76.523 49.076 103.295 1.00 6.74 ? 557 PHE B N 1 +ATOM 9352 C CA . PHE B 1 537 ? 75.722 50.094 102.583 1.00 6.71 ? 557 PHE B CA 1 +ATOM 9353 C C . PHE B 1 537 ? 76.226 51.519 102.756 1.00 6.51 ? 557 PHE B C 1 +ATOM 9354 O O . PHE B 1 537 ? 75.811 52.413 101.997 1.00 7.54 ? 557 PHE B O 1 +ATOM 9355 C CB . PHE B 1 537 ? 74.233 49.987 102.891 1.00 6.39 ? 557 PHE B CB 1 +ATOM 9356 C CG . PHE B 1 537 ? 73.612 48.738 102.356 1.00 7.71 ? 557 PHE B CG 1 +ATOM 9357 C CD1 . PHE B 1 537 ? 73.177 48.680 101.037 1.00 8.29 ? 557 PHE B CD1 1 +ATOM 9358 C CD2 . PHE B 1 537 ? 73.472 47.616 103.162 1.00 7.04 ? 557 PHE B CD2 1 +ATOM 9359 C CE1 . PHE B 1 537 ? 72.586 47.504 100.535 1.00 8.02 ? 557 PHE B CE1 1 +ATOM 9360 C CE2 . PHE B 1 537 ? 72.885 46.449 102.677 1.00 8.48 ? 557 PHE B CE2 1 +ATOM 9361 C CZ . PHE B 1 537 ? 72.454 46.392 101.351 1.00 7.59 ? 557 PHE B CZ 1 +ATOM 9362 N N . THR B 1 538 ? 77.141 51.746 103.707 1.00 6.06 ? 558 THR B N 1 +ATOM 9363 C CA . THR B 1 538 ? 77.752 53.078 103.861 1.00 6.65 ? 558 THR B CA 1 +ATOM 9364 C C . THR B 1 538 ? 78.931 53.306 102.909 1.00 6.56 ? 558 THR B C 1 +ATOM 9365 O O . THR B 1 538 ? 79.568 52.368 102.429 1.00 6.68 ? 558 THR B O 1 +ATOM 9366 C CB . THR B 1 538 ? 78.236 53.369 105.302 1.00 6.33 ? 558 THR B CB 1 +ATOM 9367 O OG1 . THR B 1 538 ? 79.381 52.554 105.612 1.00 7.20 ? 558 THR B OG1 1 +ATOM 9368 C CG2 . THR B 1 538 ? 77.118 53.143 106.318 1.00 7.37 ? 558 THR B CG2 1 +ATOM 9369 N N . GLU B 1 539 ? 79.243 54.576 102.659 1.00 6.68 ? 559 GLU B N 1 +ATOM 9370 C CA . GLU B 1 539 ? 80.373 54.903 101.795 1.00 7.41 ? 559 GLU B CA 1 +ATOM 9371 C C . GLU B 1 539 ? 81.670 54.425 102.439 1.00 7.30 ? 559 GLU B C 1 +ATOM 9372 O O . GLU B 1 539 ? 82.612 54.045 101.753 1.00 7.07 ? 559 GLU B O 1 +ATOM 9373 C CB . GLU B 1 539 ? 80.420 56.403 101.475 1.00 7.13 ? 559 GLU B CB 1 +ATOM 9374 C CG . GLU B 1 539 ? 79.221 56.845 100.612 1.00 8.70 ? 559 GLU B CG 1 +ATOM 9375 C CD . GLU B 1 539 ? 79.346 58.213 99.986 1.00 9.68 ? 559 GLU B CD 1 +ATOM 9376 O OE1 . GLU B 1 539 ? 80.477 58.635 99.652 1.00 13.01 ? 559 GLU B OE1 1 +ATOM 9377 O OE2 . GLU B 1 539 ? 78.296 58.879 99.776 1.00 6.09 ? 559 GLU B OE2 1 +ATOM 9378 N N . GLU B 1 540 ? 81.697 54.414 103.764 1.00 7.09 ? 560 GLU B N 1 +ATOM 9379 C CA . GLU B 1 540 ? 82.910 54.072 104.483 1.00 7.27 ? 560 GLU B CA 1 +ATOM 9380 C C . GLU B 1 540 ? 83.172 52.574 104.347 1.00 7.54 ? 560 GLU B C 1 +ATOM 9381 O O . GLU B 1 540 ? 84.322 52.179 104.233 1.00 8.35 ? 560 GLU B O 1 +ATOM 9382 C CB . GLU B 1 540 ? 82.834 54.460 105.955 1.00 7.54 ? 560 GLU B CB 1 +ATOM 9383 C CG . GLU B 1 540 ? 82.915 55.955 106.206 1.00 8.96 ? 560 GLU B CG 1 +ATOM 9384 C CD . GLU B 1 540 ? 81.705 56.675 105.712 1.00 10.79 ? 560 GLU B CD 1 +ATOM 9385 O OE1 . GLU B 1 540 ? 80.616 56.052 105.717 1.00 11.33 ? 560 GLU B OE1 1 +ATOM 9386 O OE2 . GLU B 1 540 ? 81.835 57.861 105.332 1.00 10.13 ? 560 GLU B OE2 1 +ATOM 9387 N N . TYR B 1 541 ? 82.108 51.766 104.328 1.00 7.26 ? 561 TYR B N 1 +ATOM 9388 C CA . TYR B 1 541 ? 82.244 50.320 104.137 1.00 7.62 ? 561 TYR B CA 1 +ATOM 9389 C C . TYR B 1 541 ? 82.796 49.973 102.742 1.00 7.79 ? 561 TYR B C 1 +ATOM 9390 O O . TYR B 1 541 ? 83.599 49.035 102.595 1.00 7.41 ? 561 TYR B O 1 +ATOM 9391 C CB . TYR B 1 541 ? 80.917 49.586 104.371 1.00 8.08 ? 561 TYR B CB 1 +ATOM 9392 C CG . TYR B 1 541 ? 81.118 48.097 104.603 1.00 7.35 ? 561 TYR B CG 1 +ATOM 9393 C CD1 . TYR B 1 541 ? 81.179 47.202 103.539 1.00 7.22 ? 561 TYR B CD1 1 +ATOM 9394 C CD2 . TYR B 1 541 ? 81.311 47.596 105.886 1.00 7.87 ? 561 TYR B CD2 1 +ATOM 9395 C CE1 . TYR B 1 541 ? 81.363 45.833 103.754 1.00 7.75 ? 561 TYR B CE1 1 +ATOM 9396 C CE2 . TYR B 1 541 ? 81.499 46.218 106.117 1.00 7.66 ? 561 TYR B CE2 1 +ATOM 9397 C CZ . TYR B 1 541 ? 81.556 45.349 105.043 1.00 8.30 ? 561 TYR B CZ 1 +ATOM 9398 O OH . TYR B 1 541 ? 81.767 44.003 105.260 1.00 8.92 ? 561 TYR B OH 1 +ATOM 9399 N N . GLN B 1 542 ? 82.351 50.713 101.721 1.00 7.42 ? 562 GLN B N 1 +ATOM 9400 C CA . GLN B 1 542 ? 82.854 50.501 100.367 1.00 8.14 ? 562 GLN B CA 1 +ATOM 9401 C C . GLN B 1 542 ? 84.352 50.787 100.320 1.00 8.26 ? 562 GLN B C 1 +ATOM 9402 O O . GLN B 1 542 ? 85.147 49.993 99.816 1.00 8.93 ? 562 GLN B O 1 +ATOM 9403 C CB . GLN B 1 542 ? 82.119 51.393 99.375 1.00 8.33 ? 562 GLN B CB 1 +ATOM 9404 C CG . GLN B 1 542 ? 82.509 51.126 97.925 1.00 8.62 ? 562 GLN B CG 1 +ATOM 9405 C CD . GLN B 1 542 ? 81.717 51.949 96.961 1.00 7.88 ? 562 GLN B CD 1 +ATOM 9406 O OE1 . GLN B 1 542 ? 81.461 53.130 97.199 1.00 9.22 ? 562 GLN B OE1 1 +ATOM 9407 N NE2 . GLN B 1 542 ? 81.322 51.333 95.843 1.00 10.33 ? 562 GLN B NE2 1 +ATOM 9408 N N . LYS B 1 543 ? 84.738 51.913 100.890 1.00 9.28 ? 563 LYS B N 1 +ATOM 9409 C CA . LYS B 1 543 ? 86.159 52.253 101.006 1.00 9.87 ? 563 LYS B CA 1 +ATOM 9410 C C . LYS B 1 543 ? 86.967 51.168 101.731 1.00 9.98 ? 563 LYS B C 1 +ATOM 9411 O O . LYS B 1 543 ? 88.039 50.763 101.256 1.00 9.11 ? 563 LYS B O 1 +ATOM 9412 C CB . LYS B 1 543 ? 86.299 53.593 101.735 1.00 10.86 ? 563 LYS B CB 1 +ATOM 9413 C CG . LYS B 1 543 ? 85.900 54.778 100.878 1.00 13.92 ? 563 LYS B CG 1 +ATOM 9414 C CD . LYS B 1 543 ? 85.487 55.991 101.706 1.00 18.47 ? 563 LYS B CD 1 +ATOM 9415 C CE . LYS B 1 543 ? 86.651 56.763 102.250 1.00 20.97 ? 563 LYS B CE 1 +ATOM 9416 N NZ . LYS B 1 543 ? 86.160 57.832 103.189 1.00 22.08 ? 563 LYS B NZ 1 +ATOM 9417 N N . SER B 1 544 ? 86.456 50.710 102.875 1.00 9.82 ? 564 SER B N 1 +ATOM 9418 C CA A SER B 1 544 ? 87.161 49.740 103.717 0.50 10.22 ? 564 SER B CA 1 +ATOM 9419 C CA B SER B 1 544 ? 87.163 49.743 103.715 0.50 10.34 ? 564 SER B CA 1 +ATOM 9420 C C . SER B 1 544 ? 87.306 48.397 103.014 1.00 10.10 ? 564 SER B C 1 +ATOM 9421 O O . SER B 1 544 ? 88.383 47.803 103.015 1.00 10.71 ? 564 SER B O 1 +ATOM 9422 C CB A SER B 1 544 ? 86.442 49.555 105.062 0.50 10.22 ? 564 SER B CB 1 +ATOM 9423 C CB B SER B 1 544 ? 86.442 49.557 105.055 0.50 10.37 ? 564 SER B CB 1 +ATOM 9424 O OG A SER B 1 544 ? 86.688 50.656 105.922 0.50 10.76 ? 564 SER B OG 1 +ATOM 9425 O OG B SER B 1 544 ? 87.285 48.898 105.982 0.50 11.67 ? 564 SER B OG 1 +ATOM 9426 N N . LEU B 1 545 ? 86.220 47.930 102.400 1.00 9.54 ? 565 LEU B N 1 +ATOM 9427 C CA . LEU B 1 545 ? 86.240 46.676 101.661 1.00 9.33 ? 565 LEU B CA 1 +ATOM 9428 C C . LEU B 1 545 ? 87.243 46.741 100.524 1.00 8.71 ? 565 LEU B C 1 +ATOM 9429 O O . LEU B 1 545 ? 88.009 45.793 100.305 1.00 9.44 ? 565 LEU B O 1 +ATOM 9430 C CB . LEU B 1 545 ? 84.849 46.334 101.112 1.00 9.16 ? 565 LEU B CB 1 +ATOM 9431 C CG . LEU B 1 545 ? 84.761 45.063 100.245 1.00 8.54 ? 565 LEU B CG 1 +ATOM 9432 C CD1 . LEU B 1 545 ? 83.475 44.256 100.554 1.00 5.47 ? 565 LEU B CD1 1 +ATOM 9433 C CD2 . LEU B 1 545 ? 84.861 45.396 98.747 1.00 8.15 ? 565 LEU B CD2 1 +ATOM 9434 N N . LEU B 1 546 ? 87.205 47.844 99.783 1.00 9.02 ? 566 LEU B N 1 +ATOM 9435 C CA . LEU B 1 546 ? 88.180 48.101 98.724 1.00 8.68 ? 566 LEU B CA 1 +ATOM 9436 C C . LEU B 1 546 ? 89.605 48.069 99.245 1.00 9.36 ? 566 LEU B C 1 +ATOM 9437 O O . LEU B 1 546 ? 90.455 47.385 98.660 1.00 8.63 ? 566 LEU B O 1 +ATOM 9438 C CB . LEU B 1 546 ? 87.914 49.436 98.025 1.00 8.60 ? 566 LEU B CB 1 +ATOM 9439 C CG . LEU B 1 546 ? 87.107 49.375 96.733 1.00 7.18 ? 566 LEU B CG 1 +ATOM 9440 C CD1 . LEU B 1 546 ? 85.831 48.540 96.879 1.00 8.28 ? 566 LEU B CD1 1 +ATOM 9441 C CD2 . LEU B 1 546 ? 86.808 50.794 96.247 1.00 8.61 ? 566 LEU B CD2 1 +ATOM 9442 N N . GLU B 1 547 ? 89.865 48.790 100.335 1.00 9.16 ? 567 GLU B N 1 +ATOM 9443 C CA . GLU B 1 547 ? 91.215 48.812 100.929 1.00 10.37 ? 567 GLU B CA 1 +ATOM 9444 C C . GLU B 1 547 ? 91.734 47.398 101.213 1.00 9.94 ? 567 GLU B C 1 +ATOM 9445 O O . GLU B 1 547 ? 92.874 47.051 100.874 1.00 9.67 ? 567 GLU B O 1 +ATOM 9446 C CB . GLU B 1 547 ? 91.218 49.636 102.211 1.00 10.41 ? 567 GLU B CB 1 +ATOM 9447 C CG . GLU B 1 547 ? 91.205 51.153 101.976 1.00 12.45 ? 567 GLU B CG 1 +ATOM 9448 C CD . GLU B 1 547 ? 90.960 51.958 103.248 1.00 13.74 ? 567 GLU B CD 1 +ATOM 9449 O OE1 . GLU B 1 547 ? 90.559 51.374 104.276 1.00 18.98 ? 567 GLU B OE1 1 +ATOM 9450 O OE2 . GLU B 1 547 ? 91.174 53.193 103.226 1.00 20.31 ? 567 GLU B OE2 1 +ATOM 9451 N N . GLN B 1 548 ? 90.894 46.587 101.837 1.00 9.29 ? 568 GLN B N 1 +ATOM 9452 C CA . GLN B 1 548 ? 91.287 45.240 102.216 1.00 9.62 ? 568 GLN B CA 1 +ATOM 9453 C C . GLN B 1 548 ? 91.528 44.368 100.986 1.00 9.54 ? 568 GLN B C 1 +ATOM 9454 O O . GLN B 1 548 ? 92.531 43.626 100.940 1.00 10.14 ? 568 GLN B O 1 +ATOM 9455 C CB . GLN B 1 548 ? 90.263 44.650 103.197 1.00 9.69 ? 568 GLN B CB 1 +ATOM 9456 C CG . GLN B 1 548 ? 90.210 45.445 104.531 1.00 9.02 ? 568 GLN B CG 1 +ATOM 9457 C CD . GLN B 1 548 ? 91.545 45.454 105.269 1.00 10.66 ? 568 GLN B CD 1 +ATOM 9458 O OE1 . GLN B 1 548 ? 92.188 44.411 105.407 1.00 12.18 ? 568 GLN B OE1 1 +ATOM 9459 N NE2 . GLN B 1 548 ? 91.974 46.639 105.725 1.00 14.64 ? 568 GLN B NE2 1 +ATOM 9460 N N . TYR B 1 549 ? 90.658 44.488 99.974 1.00 8.62 ? 569 TYR B N 1 +ATOM 9461 C CA . TYR B 1 549 ? 90.893 43.824 98.679 1.00 9.42 ? 569 TYR B CA 1 +ATOM 9462 C C . TYR B 1 549 ? 92.232 44.230 98.071 1.00 9.35 ? 569 TYR B C 1 +ATOM 9463 O O . TYR B 1 549 ? 93.016 43.377 97.623 1.00 9.69 ? 569 TYR B O 1 +ATOM 9464 C CB . TYR B 1 549 ? 89.732 44.042 97.691 1.00 9.44 ? 569 TYR B CB 1 +ATOM 9465 C CG . TYR B 1 549 ? 88.791 42.867 97.685 1.00 8.61 ? 569 TYR B CG 1 +ATOM 9466 C CD1 . TYR B 1 549 ? 87.753 42.768 98.606 1.00 9.57 ? 569 TYR B CD1 1 +ATOM 9467 C CD2 . TYR B 1 549 ? 88.973 41.811 96.788 1.00 10.29 ? 569 TYR B CD2 1 +ATOM 9468 C CE1 . TYR B 1 549 ? 86.924 41.656 98.620 1.00 9.28 ? 569 TYR B CE1 1 +ATOM 9469 C CE2 . TYR B 1 549 ? 88.135 40.713 96.778 1.00 9.92 ? 569 TYR B CE2 1 +ATOM 9470 C CZ . TYR B 1 549 ? 87.120 40.630 97.707 1.00 9.67 ? 569 TYR B CZ 1 +ATOM 9471 O OH . TYR B 1 549 ? 86.293 39.520 97.717 1.00 9.90 ? 569 TYR B OH 1 +ATOM 9472 N N . HIS B 1 550 ? 92.498 45.537 98.078 1.00 9.48 ? 570 HIS B N 1 +ATOM 9473 C CA . HIS B 1 550 ? 93.726 46.092 97.517 1.00 9.70 ? 570 HIS B CA 1 +ATOM 9474 C C . HIS B 1 550 ? 94.971 45.568 98.233 1.00 10.01 ? 570 HIS B C 1 +ATOM 9475 O O . HIS B 1 550 ? 95.988 45.281 97.602 1.00 9.75 ? 570 HIS B O 1 +ATOM 9476 C CB . HIS B 1 550 ? 93.683 47.636 97.574 1.00 9.59 ? 570 HIS B CB 1 +ATOM 9477 C CG . HIS B 1 550 ? 92.558 48.232 96.784 1.00 8.85 ? 570 HIS B CG 1 +ATOM 9478 N ND1 . HIS B 1 550 ? 92.147 49.545 96.920 1.00 9.37 ? 570 HIS B ND1 1 +ATOM 9479 C CD2 . HIS B 1 550 ? 91.747 47.676 95.856 1.00 7.22 ? 570 HIS B CD2 1 +ATOM 9480 C CE1 . HIS B 1 550 ? 91.137 49.770 96.093 1.00 7.12 ? 570 HIS B CE1 1 +ATOM 9481 N NE2 . HIS B 1 550 ? 90.867 48.646 95.450 1.00 7.24 ? 570 HIS B NE2 1 +ATOM 9482 N N . LEU B 1 551 ? 94.899 45.451 99.551 1.00 10.59 ? 571 LEU B N 1 +ATOM 9483 C CA . LEU B 1 551 ? 96.028 44.907 100.326 1.00 10.63 ? 571 LEU B CA 1 +ATOM 9484 C C . LEU B 1 551 ? 96.326 43.457 99.935 1.00 11.01 ? 571 LEU B C 1 +ATOM 9485 O O . LEU B 1 551 ? 97.490 43.049 99.888 1.00 11.06 ? 571 LEU B O 1 +ATOM 9486 C CB . LEU B 1 551 ? 95.767 45.020 101.831 1.00 11.17 ? 571 LEU B CB 1 +ATOM 9487 C CG . LEU B 1 551 ? 95.896 46.450 102.354 1.00 10.46 ? 571 LEU B CG 1 +ATOM 9488 C CD1 . LEU B 1 551 ? 95.086 46.694 103.634 1.00 12.55 ? 571 LEU B CD1 1 +ATOM 9489 C CD2 . LEU B 1 551 ? 97.387 46.829 102.529 1.00 13.04 ? 571 LEU B CD2 1 +ATOM 9490 N N . GLY B 1 552 ? 95.275 42.691 99.668 1.00 11.07 ? 572 GLY B N 1 +ATOM 9491 C CA . GLY B 1 552 ? 95.399 41.311 99.220 1.00 11.71 ? 572 GLY B CA 1 +ATOM 9492 C C . GLY B 1 552 ? 95.947 41.243 97.809 1.00 12.02 ? 572 GLY B C 1 +ATOM 9493 O O . GLY B 1 552 ? 96.853 40.467 97.518 1.00 12.61 ? 572 GLY B O 1 +ATOM 9494 N N . LEU B 1 553 ? 95.383 42.043 96.911 1.00 11.80 ? 573 LEU B N 1 +ATOM 9495 C CA . LEU B 1 553 ? 95.869 42.063 95.536 1.00 11.38 ? 573 LEU B CA 1 +ATOM 9496 C C . LEU B 1 553 ? 97.353 42.431 95.514 1.00 11.79 ? 573 LEU B C 1 +ATOM 9497 O O . LEU B 1 553 ? 98.120 41.868 94.718 1.00 12.31 ? 573 LEU B O 1 +ATOM 9498 C CB . LEU B 1 553 ? 95.059 43.043 94.701 1.00 11.50 ? 573 LEU B CB 1 +ATOM 9499 C CG . LEU B 1 553 ? 93.643 42.567 94.389 1.00 9.72 ? 573 LEU B CG 1 +ATOM 9500 C CD1 . LEU B 1 553 ? 92.730 43.757 93.979 1.00 10.82 ? 573 LEU B CD1 1 +ATOM 9501 C CD2 . LEU B 1 553 ? 93.677 41.494 93.307 1.00 9.29 ? 573 LEU B CD2 1 +ATOM 9502 N N . ASP B 1 554 ? 97.753 43.377 96.375 1.00 11.87 ? 574 ASP B N 1 +ATOM 9503 C CA . ASP B 1 554 ? 99.160 43.799 96.460 1.00 12.54 ? 574 ASP B CA 1 +ATOM 9504 C C . ASP B 1 554 ? 100.125 42.628 96.677 1.00 13.28 ? 574 ASP B C 1 +ATOM 9505 O O . ASP B 1 554 ? 101.271 42.672 96.212 1.00 13.23 ? 574 ASP B O 1 +ATOM 9506 C CB . ASP B 1 554 ? 99.366 44.828 97.578 1.00 12.49 ? 574 ASP B CB 1 +ATOM 9507 C CG . ASP B 1 554 ? 98.899 46.214 97.193 1.00 12.31 ? 574 ASP B CG 1 +ATOM 9508 O OD1 . ASP B 1 554 ? 98.532 46.409 96.014 1.00 11.32 ? 574 ASP B OD1 1 +ATOM 9509 O OD2 . ASP B 1 554 ? 98.899 47.113 98.068 1.00 12.77 ? 574 ASP B OD2 1 +ATOM 9510 N N . GLN B 1 555 ? 99.669 41.590 97.374 1.00 14.36 ? 575 GLN B N 1 +ATOM 9511 C CA . GLN B 1 555 ? 100.549 40.474 97.726 1.00 15.20 ? 575 GLN B CA 1 +ATOM 9512 C C . GLN B 1 555 ? 100.847 39.536 96.551 1.00 16.03 ? 575 GLN B C 1 +ATOM 9513 O O . GLN B 1 555 ? 101.855 38.812 96.577 1.00 16.24 ? 575 GLN B O 1 +ATOM 9514 C CB . GLN B 1 555 ? 99.964 39.694 98.914 1.00 15.34 ? 575 GLN B CB 1 +ATOM 9515 C CG . GLN B 1 555 ? 99.927 40.506 100.221 1.00 17.06 ? 575 GLN B CG 1 +ATOM 9516 C CD . GLN B 1 555 ? 101.316 40.882 100.745 1.00 18.95 ? 575 GLN B CD 1 +ATOM 9517 O OE1 . GLN B 1 555 ? 101.546 42.012 101.192 1.00 22.29 ? 575 GLN B OE1 1 +ATOM 9518 N NE2 . GLN B 1 555 ? 102.249 39.938 100.686 1.00 20.55 ? 575 GLN B NE2 1 +ATOM 9519 N N . LYS B 1 556 ? 100.006 39.568 95.515 1.00 16.36 ? 576 LYS B N 1 +ATOM 9520 C CA . LYS B 1 556 ? 100.163 38.669 94.363 1.00 16.85 ? 576 LYS B CA 1 +ATOM 9521 C C . LYS B 1 556 ? 100.299 39.374 93.001 1.00 16.62 ? 576 LYS B C 1 +ATOM 9522 O O . LYS B 1 556 ? 100.579 38.718 92.000 1.00 16.25 ? 576 LYS B O 1 +ATOM 9523 C CB . LYS B 1 556 ? 98.999 37.684 94.316 1.00 17.23 ? 576 LYS B CB 1 +ATOM 9524 C CG . LYS B 1 556 ? 98.514 37.195 95.688 1.00 18.68 ? 576 LYS B CG 1 +ATOM 9525 C CD . LYS B 1 556 ? 99.479 36.268 96.399 1.00 20.23 ? 576 LYS B CD 1 +ATOM 9526 C CE . LYS B 1 556 ? 98.779 35.477 97.544 1.00 20.18 ? 576 LYS B CE 1 +ATOM 9527 N NZ . LYS B 1 556 ? 98.762 36.193 98.877 1.00 19.20 ? 576 LYS B NZ 1 +ATOM 9528 N N . ARG B 1 557 ? 100.132 40.693 92.952 1.00 16.68 ? 577 ARG B N 1 +ATOM 9529 C CA . ARG B 1 557 ? 100.124 41.398 91.666 1.00 17.20 ? 577 ARG B CA 1 +ATOM 9530 C C . ARG B 1 557 ? 101.513 41.607 91.035 1.00 17.91 ? 577 ARG B C 1 +ATOM 9531 O O . ARG B 1 557 ? 101.606 42.085 89.907 1.00 18.92 ? 577 ARG B O 1 +ATOM 9532 C CB . ARG B 1 557 ? 99.345 42.721 91.751 1.00 16.81 ? 577 ARG B CB 1 +ATOM 9533 C CG . ARG B 1 557 ? 99.961 43.791 92.592 1.00 15.74 ? 577 ARG B CG 1 +ATOM 9534 C CD . ARG B 1 557 ? 99.055 45.016 92.572 1.00 16.29 ? 577 ARG B CD 1 +ATOM 9535 N NE . ARG B 1 557 ? 99.596 46.153 93.308 1.00 15.75 ? 577 ARG B NE 1 +ATOM 9536 C CZ . ARG B 1 557 ? 100.569 46.940 92.865 1.00 15.69 ? 577 ARG B CZ 1 +ATOM 9537 N NH1 . ARG B 1 557 ? 101.140 46.726 91.686 1.00 16.14 ? 577 ARG B NH1 1 +ATOM 9538 N NH2 . ARG B 1 557 ? 100.967 47.958 93.612 1.00 17.00 ? 577 ARG B NH2 1 +ATOM 9539 N N . ARG B 1 558 ? 102.584 41.277 91.747 1.00 18.72 ? 578 ARG B N 1 +ATOM 9540 C CA . ARG B 1 558 ? 103.922 41.206 91.106 1.00 19.46 ? 578 ARG B CA 1 +ATOM 9541 C C . ARG B 1 558 ? 104.347 39.745 90.935 1.00 18.94 ? 578 ARG B C 1 +ATOM 9542 O O . ARG B 1 558 ? 105.512 39.448 90.632 1.00 18.83 ? 578 ARG B O 1 +ATOM 9543 C CB . ARG B 1 558 ? 104.978 41.988 91.902 1.00 20.03 ? 578 ARG B CB 1 +ATOM 9544 C CG . ARG B 1 558 ? 104.560 43.397 92.342 1.00 22.92 ? 578 ARG B CG 1 +ATOM 9545 C CD . ARG B 1 558 ? 103.927 44.235 91.219 1.00 26.94 ? 578 ARG B CD 1 +ATOM 9546 N NE . ARG B 1 558 ? 104.885 44.734 90.228 1.00 29.16 ? 578 ARG B NE 1 +ATOM 9547 C CZ . ARG B 1 558 ? 105.435 45.953 90.223 1.00 30.35 ? 578 ARG B CZ 1 +ATOM 9548 N NH1 . ARG B 1 558 ? 105.163 46.847 91.177 1.00 31.64 ? 578 ARG B NH1 1 +ATOM 9549 N NH2 . ARG B 1 558 ? 106.286 46.282 89.256 1.00 30.35 ? 578 ARG B NH2 1 +ATOM 9550 N N . LYS B 1 559 ? 103.401 38.834 91.128 1.00 17.93 ? 579 LYS B N 1 +ATOM 9551 C CA . LYS B 1 559 ? 103.652 37.415 90.945 1.00 17.71 ? 579 LYS B CA 1 +ATOM 9552 C C . LYS B 1 559 ? 102.826 36.929 89.766 1.00 16.27 ? 579 LYS B C 1 +ATOM 9553 O O . LYS B 1 559 ? 103.302 36.993 88.631 1.00 17.04 ? 579 LYS B O 1 +ATOM 9554 C CB . LYS B 1 559 ? 103.361 36.625 92.228 1.00 17.91 ? 579 LYS B CB 1 +ATOM 9555 C CG . LYS B 1 559 ? 104.512 36.667 93.236 1.00 19.89 ? 579 LYS B CG 1 +ATOM 9556 C CD . LYS B 1 559 ? 104.251 35.769 94.431 1.00 20.26 ? 579 LYS B CD 1 +ATOM 9557 C CE . LYS B 1 559 ? 105.495 35.586 95.296 1.00 22.41 ? 579 LYS B CE 1 +ATOM 9558 N NZ . LYS B 1 559 ? 106.498 34.651 94.695 1.00 24.21 ? 579 LYS B NZ 1 +ATOM 9559 N N . TYR B 1 560 ? 101.586 36.495 90.020 1.00 13.92 ? 580 TYR B N 1 +ATOM 9560 C CA . TYR B 1 560 ? 100.731 35.882 88.991 1.00 12.75 ? 580 TYR B CA 1 +ATOM 9561 C C . TYR B 1 560 ? 99.316 36.461 88.896 1.00 12.01 ? 580 TYR B C 1 +ATOM 9562 O O . TYR B 1 560 ? 98.520 35.983 88.090 1.00 11.76 ? 580 TYR B O 1 +ATOM 9563 C CB . TYR B 1 560 ? 100.626 34.362 89.209 1.00 12.55 ? 580 TYR B CB 1 +ATOM 9564 C CG . TYR B 1 560 ? 100.163 33.982 90.596 1.00 12.99 ? 580 TYR B CG 1 +ATOM 9565 C CD1 . TYR B 1 560 ? 98.818 34.085 90.961 1.00 11.14 ? 580 TYR B CD1 1 +ATOM 9566 C CD2 . TYR B 1 560 ? 101.068 33.531 91.557 1.00 11.89 ? 580 TYR B CD2 1 +ATOM 9567 C CE1 . TYR B 1 560 ? 98.398 33.739 92.231 1.00 12.36 ? 580 TYR B CE1 1 +ATOM 9568 C CE2 . TYR B 1 560 ? 100.656 33.186 92.828 1.00 12.43 ? 580 TYR B CE2 1 +ATOM 9569 C CZ . TYR B 1 560 ? 99.313 33.287 93.163 1.00 12.12 ? 580 TYR B CZ 1 +ATOM 9570 O OH . TYR B 1 560 ? 98.896 32.967 94.437 1.00 13.48 ? 580 TYR B OH 1 +ATOM 9571 N N . VAL B 1 561 ? 98.982 37.454 89.717 1.00 11.01 ? 581 VAL B N 1 +ATOM 9572 C CA . VAL B 1 561 ? 97.706 38.152 89.542 1.00 10.60 ? 581 VAL B CA 1 +ATOM 9573 C C . VAL B 1 561 ? 98.011 39.294 88.564 1.00 10.33 ? 581 VAL B C 1 +ATOM 9574 O O . VAL B 1 561 ? 98.887 40.138 88.834 1.00 10.59 ? 581 VAL B O 1 +ATOM 9575 C CB . VAL B 1 561 ? 97.112 38.672 90.869 1.00 10.22 ? 581 VAL B CB 1 +ATOM 9576 C CG1 . VAL B 1 561 ? 95.936 39.629 90.592 1.00 10.73 ? 581 VAL B CG1 1 +ATOM 9577 C CG2 . VAL B 1 561 ? 96.650 37.501 91.756 1.00 10.62 ? 581 VAL B CG2 1 +ATOM 9578 N N . VAL B 1 562 ? 97.331 39.275 87.422 1.00 9.64 ? 582 VAL B N 1 +ATOM 9579 C CA . VAL B 1 562 ? 97.607 40.189 86.313 1.00 9.81 ? 582 VAL B CA 1 +ATOM 9580 C C . VAL B 1 562 ? 96.517 41.246 86.115 1.00 9.53 ? 582 VAL B C 1 +ATOM 9581 O O . VAL B 1 562 ? 96.586 42.053 85.190 1.00 9.82 ? 582 VAL B O 1 +ATOM 9582 C CB . VAL B 1 562 ? 97.813 39.412 85.002 1.00 9.87 ? 582 VAL B CB 1 +ATOM 9583 C CG1 . VAL B 1 562 ? 99.100 38.613 85.070 1.00 11.57 ? 582 VAL B CG1 1 +ATOM 9584 C CG2 . VAL B 1 562 ? 96.603 38.506 84.690 1.00 10.56 ? 582 VAL B CG2 1 +ATOM 9585 N N . GLY B 1 563 ? 95.522 41.279 86.990 1.00 9.39 ? 583 GLY B N 1 +ATOM 9586 C CA . GLY B 1 563 ? 94.529 42.332 86.867 1.00 8.66 ? 583 GLY B CA 1 +ATOM 9587 C C . GLY B 1 563 ? 93.499 42.396 87.974 1.00 8.43 ? 583 GLY B C 1 +ATOM 9588 O O . GLY B 1 563 ? 93.297 41.430 88.718 1.00 8.86 ? 583 GLY B O 1 +ATOM 9589 N N . GLU B 1 564 ? 92.859 43.556 88.058 1.00 8.25 ? 584 GLU B N 1 +ATOM 9590 C CA . GLU B 1 564 ? 91.772 43.785 88.984 1.00 8.47 ? 584 GLU B CA 1 +ATOM 9591 C C . GLU B 1 564 ? 90.715 44.666 88.318 1.00 8.38 ? 584 GLU B C 1 +ATOM 9592 O O . GLU B 1 564 ? 91.042 45.675 87.705 1.00 8.29 ? 584 GLU B O 1 +ATOM 9593 C CB . GLU B 1 564 ? 92.296 44.435 90.275 1.00 8.12 ? 584 GLU B CB 1 +ATOM 9594 C CG . GLU B 1 564 ? 93.067 45.732 90.089 1.00 8.69 ? 584 GLU B CG 1 +ATOM 9595 C CD . GLU B 1 564 ? 93.688 46.249 91.377 1.00 8.93 ? 584 GLU B CD 1 +ATOM 9596 O OE1 . GLU B 1 564 ? 93.107 47.158 92.014 1.00 6.85 ? 584 GLU B OE1 1 +ATOM 9597 O OE2 . GLU B 1 564 ? 94.769 45.736 91.769 1.00 8.33 ? 584 GLU B OE2 1 +ATOM 9598 N N . LEU B 1 565 ? 89.450 44.274 88.443 1.00 8.61 ? 585 LEU B N 1 +ATOM 9599 C CA . LEU B 1 565 ? 88.337 45.055 87.900 1.00 8.24 ? 585 LEU B CA 1 +ATOM 9600 C C . LEU B 1 565 ? 87.295 45.225 88.987 1.00 8.37 ? 585 LEU B C 1 +ATOM 9601 O O . LEU B 1 565 ? 86.717 44.248 89.469 1.00 8.88 ? 585 LEU B O 1 +ATOM 9602 C CB . LEU B 1 565 ? 87.699 44.350 86.696 1.00 8.84 ? 585 LEU B CB 1 +ATOM 9603 C CG . LEU B 1 565 ? 88.611 43.893 85.558 1.00 7.71 ? 585 LEU B CG 1 +ATOM 9604 C CD1 . LEU B 1 565 ? 87.829 42.980 84.603 1.00 5.54 ? 585 LEU B CD1 1 +ATOM 9605 C CD2 . LEU B 1 565 ? 89.211 45.060 84.808 1.00 7.34 ? 585 LEU B CD2 1 +ATOM 9606 N N . ILE B 1 566 ? 87.043 46.467 89.380 1.00 7.76 ? 586 ILE B N 1 +ATOM 9607 C CA . ILE B 1 566 ? 86.037 46.700 90.396 1.00 7.63 ? 586 ILE B CA 1 +ATOM 9608 C C . ILE B 1 566 ? 84.643 46.479 89.806 1.00 7.61 ? 586 ILE B C 1 +ATOM 9609 O O . ILE B 1 566 ? 84.404 46.813 88.656 1.00 8.05 ? 586 ILE B O 1 +ATOM 9610 C CB . ILE B 1 566 ? 86.157 48.116 91.029 1.00 8.06 ? 586 ILE B CB 1 +ATOM 9611 C CG1 . ILE B 1 566 ? 85.230 48.222 92.248 1.00 9.16 ? 586 ILE B CG1 1 +ATOM 9612 C CG2 . ILE B 1 566 ? 85.905 49.191 89.985 1.00 7.14 ? 586 ILE B CG2 1 +ATOM 9613 C CD1 . ILE B 1 566 ? 85.585 49.279 93.233 1.00 12.39 ? 586 ILE B CD1 1 +ATOM 9614 N N . TRP B 1 567 ? 83.759 45.881 90.597 1.00 8.03 ? 587 TRP B N 1 +ATOM 9615 C CA . TRP B 1 567 ? 82.324 45.906 90.328 1.00 7.21 ? 587 TRP B CA 1 +ATOM 9616 C C . TRP B 1 567 ? 81.711 47.019 91.175 1.00 7.28 ? 587 TRP B C 1 +ATOM 9617 O O . TRP B 1 567 ? 81.668 46.882 92.406 1.00 6.12 ? 587 TRP B O 1 +ATOM 9618 C CB . TRP B 1 567 ? 81.642 44.586 90.690 1.00 7.97 ? 587 TRP B CB 1 +ATOM 9619 C CG . TRP B 1 567 ? 80.262 44.578 90.144 1.00 7.02 ? 587 TRP B CG 1 +ATOM 9620 C CD1 . TRP B 1 567 ? 79.135 45.034 90.750 1.00 8.45 ? 587 TRP B CD1 1 +ATOM 9621 C CD2 . TRP B 1 567 ? 79.884 44.194 88.821 1.00 8.10 ? 587 TRP B CD2 1 +ATOM 9622 N NE1 . TRP B 1 567 ? 78.062 44.922 89.897 1.00 8.10 ? 587 TRP B NE1 1 +ATOM 9623 C CE2 . TRP B 1 567 ? 78.495 44.403 88.704 1.00 8.53 ? 587 TRP B CE2 1 +ATOM 9624 C CE3 . TRP B 1 567 ? 80.574 43.658 87.735 1.00 9.11 ? 587 TRP B CE3 1 +ATOM 9625 C CZ2 . TRP B 1 567 ? 77.781 44.092 87.533 1.00 7.78 ? 587 TRP B CZ2 1 +ATOM 9626 C CZ3 . TRP B 1 567 ? 79.861 43.354 86.559 1.00 7.23 ? 587 TRP B CZ3 1 +ATOM 9627 C CH2 . TRP B 1 567 ? 78.479 43.573 86.478 1.00 8.31 ? 587 TRP B CH2 1 +ATOM 9628 N N . ASN B 1 568 ? 81.193 48.095 90.578 1.00 7.65 ? 588 ASN B N 1 +ATOM 9629 C CA . ASN B 1 568 ? 81.026 48.335 89.133 1.00 7.87 ? 588 ASN B CA 1 +ATOM 9630 C C . ASN B 1 568 ? 81.363 49.828 88.931 1.00 7.55 ? 588 ASN B C 1 +ATOM 9631 O O . ASN B 1 568 ? 81.451 50.586 89.892 1.00 7.58 ? 588 ASN B O 1 +ATOM 9632 C CB . ASN B 1 568 ? 79.564 48.067 88.711 1.00 8.13 ? 588 ASN B CB 1 +ATOM 9633 C CG . ASN B 1 568 ? 79.326 48.163 87.192 1.00 9.28 ? 588 ASN B CG 1 +ATOM 9634 O OD1 . ASN B 1 568 ? 79.186 49.256 86.635 1.00 10.85 ? 588 ASN B OD1 1 +ATOM 9635 N ND2 . ASN B 1 568 ? 79.232 47.003 86.528 1.00 9.42 ? 588 ASN B ND2 1 +ATOM 9636 N N . PHE B 1 569 ? 81.564 50.227 87.687 1.00 7.71 ? 589 PHE B N 1 +ATOM 9637 C CA . PHE B 1 569 ? 81.788 51.625 87.335 1.00 7.73 ? 589 PHE B CA 1 +ATOM 9638 C C . PHE B 1 569 ? 80.651 52.515 87.880 1.00 7.25 ? 589 PHE B C 1 +ATOM 9639 O O . PHE B 1 569 ? 80.908 53.546 88.495 1.00 8.94 ? 589 PHE B O 1 +ATOM 9640 C CB . PHE B 1 569 ? 81.922 51.708 85.809 1.00 8.44 ? 589 PHE B CB 1 +ATOM 9641 C CG . PHE B 1 569 ? 81.987 53.104 85.254 1.00 7.68 ? 589 PHE B CG 1 +ATOM 9642 C CD1 . PHE B 1 569 ? 80.847 53.711 84.747 1.00 7.99 ? 589 PHE B CD1 1 +ATOM 9643 C CD2 . PHE B 1 569 ? 83.193 53.779 85.164 1.00 10.32 ? 589 PHE B CD2 1 +ATOM 9644 C CE1 . PHE B 1 569 ? 80.898 54.997 84.205 1.00 7.98 ? 589 PHE B CE1 1 +ATOM 9645 C CE2 . PHE B 1 569 ? 83.251 55.066 84.623 1.00 9.65 ? 589 PHE B CE2 1 +ATOM 9646 C CZ . PHE B 1 569 ? 82.102 55.675 84.146 1.00 9.44 ? 589 PHE B CZ 1 +ATOM 9647 N N . ALA B 1 570 ? 79.400 52.104 87.669 1.00 7.60 ? 590 ALA B N 1 +ATOM 9648 C CA . ALA B 1 570 ? 78.252 52.908 88.096 1.00 6.83 ? 590 ALA B CA 1 +ATOM 9649 C C . ALA B 1 570 ? 77.043 52.074 88.504 1.00 7.17 ? 590 ALA B C 1 +ATOM 9650 O O . ALA B 1 570 ? 76.849 50.938 88.027 1.00 6.39 ? 590 ALA B O 1 +ATOM 9651 C CB . ALA B 1 570 ? 77.844 53.877 87.000 1.00 7.25 ? 590 ALA B CB 1 +ATOM 9652 N N . ASP B 1 571 ? 76.264 52.646 89.415 1.00 5.93 ? 591 ASP B N 1 +ATOM 9653 C CA . ASP B 1 571 ? 74.953 52.125 89.786 1.00 5.84 ? 591 ASP B CA 1 +ATOM 9654 C C . ASP B 1 571 ? 74.104 51.897 88.541 1.00 5.53 ? 591 ASP B C 1 +ATOM 9655 O O . ASP B 1 571 ? 74.099 52.730 87.639 1.00 5.07 ? 591 ASP B O 1 +ATOM 9656 C CB . ASP B 1 571 ? 74.213 53.102 90.702 1.00 6.28 ? 591 ASP B CB 1 +ATOM 9657 C CG . ASP B 1 571 ? 74.921 53.357 92.016 1.00 7.29 ? 591 ASP B CG 1 +ATOM 9658 O OD1 . ASP B 1 571 ? 75.856 52.610 92.393 1.00 6.72 ? 591 ASP B OD1 1 +ATOM 9659 O OD2 . ASP B 1 571 ? 74.504 54.310 92.698 1.00 6.56 ? 591 ASP B OD2 1 +ATOM 9660 N N . PHE B 1 572 ? 73.405 50.759 88.503 1.00 5.05 ? 592 PHE B N 1 +ATOM 9661 C CA . PHE B 1 572 ? 72.584 50.373 87.357 1.00 5.97 ? 592 PHE B CA 1 +ATOM 9662 C C . PHE B 1 572 ? 71.315 49.626 87.796 1.00 6.49 ? 592 PHE B C 1 +ATOM 9663 O O . PHE B 1 572 ? 71.225 49.139 88.916 1.00 6.70 ? 592 PHE B O 1 +ATOM 9664 C CB . PHE B 1 572 ? 73.402 49.529 86.389 1.00 5.89 ? 592 PHE B CB 1 +ATOM 9665 C CG . PHE B 1 572 ? 73.867 48.244 86.967 1.00 5.19 ? 592 PHE B CG 1 +ATOM 9666 C CD1 . PHE B 1 572 ? 73.091 47.113 86.880 1.00 5.72 ? 592 PHE B CD1 1 +ATOM 9667 C CD2 . PHE B 1 572 ? 75.101 48.155 87.593 1.00 4.80 ? 592 PHE B CD2 1 +ATOM 9668 C CE1 . PHE B 1 572 ? 73.519 45.916 87.408 1.00 4.73 ? 592 PHE B CE1 1 +ATOM 9669 C CE2 . PHE B 1 572 ? 75.530 46.944 88.130 1.00 4.39 ? 592 PHE B CE2 1 +ATOM 9670 C CZ . PHE B 1 572 ? 74.734 45.833 88.028 1.00 4.22 ? 592 PHE B CZ 1 +ATOM 9671 N N . MET B 1 573 ? 70.347 49.532 86.894 1.00 7.24 ? 593 MET B N 1 +ATOM 9672 C CA . MET B 1 573 ? 69.040 48.966 87.214 1.00 8.35 ? 593 MET B CA 1 +ATOM 9673 C C . MET B 1 573 ? 69.002 47.432 87.153 1.00 8.10 ? 593 MET B C 1 +ATOM 9674 O O . MET B 1 573 ? 69.653 46.793 86.317 1.00 7.79 ? 593 MET B O 1 +ATOM 9675 C CB . MET B 1 573 ? 67.993 49.586 86.274 1.00 7.95 ? 593 MET B CB 1 +ATOM 9676 C CG . MET B 1 573 ? 66.551 49.243 86.607 1.00 10.86 ? 593 MET B CG 1 +ATOM 9677 S SD . MET B 1 573 ? 66.079 49.450 88.345 1.00 12.92 ? 593 MET B SD 1 +ATOM 9678 C CE . MET B 1 573 ? 66.263 51.200 88.548 1.00 14.85 ? 593 MET B CE 1 +ATOM 9679 N N . THR B 1 574 ? 68.235 46.844 88.066 1.00 8.13 ? 594 THR B N 1 +ATOM 9680 C CA . THR B 1 574 ? 68.030 45.412 88.110 1.00 7.81 ? 594 THR B CA 1 +ATOM 9681 C C . THR B 1 574 ? 66.536 45.169 88.331 1.00 7.74 ? 594 THR B C 1 +ATOM 9682 O O . THR B 1 574 ? 65.773 46.120 88.544 1.00 7.04 ? 594 THR B O 1 +ATOM 9683 C CB . THR B 1 574 ? 68.763 44.754 89.275 1.00 8.15 ? 594 THR B CB 1 +ATOM 9684 O OG1 . THR B 1 574 ? 68.193 45.184 90.519 1.00 8.65 ? 594 THR B OG1 1 +ATOM 9685 C CG2 . THR B 1 574 ? 70.282 45.067 89.245 1.00 6.88 ? 594 THR B CG2 1 +ATOM 9686 N N . GLU B 1 575 ? 66.139 43.907 88.281 1.00 8.54 ? 595 GLU B N 1 +ATOM 9687 C CA . GLU B 1 575 ? 64.829 43.502 88.764 1.00 9.02 ? 595 GLU B CA 1 +ATOM 9688 C C . GLU B 1 575 ? 64.672 43.833 90.246 1.00 8.94 ? 595 GLU B C 1 +ATOM 9689 O O . GLU B 1 575 ? 65.640 43.956 90.991 1.00 8.14 ? 595 GLU B O 1 +ATOM 9690 C CB . GLU B 1 575 ? 64.632 41.984 88.587 1.00 10.08 ? 595 GLU B CB 1 +ATOM 9691 C CG . GLU B 1 575 ? 64.089 41.613 87.260 1.00 13.61 ? 595 GLU B CG 1 +ATOM 9692 C CD . GLU B 1 575 ? 62.657 42.106 87.059 1.00 17.98 ? 595 GLU B CD 1 +ATOM 9693 O OE1 . GLU B 1 575 ? 61.973 42.453 88.052 1.00 21.81 ? 595 GLU B OE1 1 +ATOM 9694 O OE2 . GLU B 1 575 ? 62.223 42.153 85.896 1.00 23.15 ? 595 GLU B OE2 1 +ATOM 9695 N N . GLN B 1 576 ? 63.424 43.942 90.663 1.00 8.75 ? 596 GLN B N 1 +ATOM 9696 C CA . GLN B 1 576 ? 63.099 44.183 92.042 1.00 9.19 ? 596 GLN B CA 1 +ATOM 9697 C C . GLN B 1 576 ? 63.351 42.937 92.863 1.00 9.55 ? 596 GLN B C 1 +ATOM 9698 O O . GLN B 1 576 ? 63.016 41.817 92.453 1.00 10.56 ? 596 GLN B O 1 +ATOM 9699 C CB . GLN B 1 576 ? 61.637 44.622 92.179 1.00 9.04 ? 596 GLN B CB 1 +ATOM 9700 C CG . GLN B 1 576 ? 61.369 45.997 91.613 1.00 10.48 ? 596 GLN B CG 1 +ATOM 9701 C CD . GLN B 1 576 ? 59.905 46.334 91.656 1.00 10.67 ? 596 GLN B CD 1 +ATOM 9702 O OE1 . GLN B 1 576 ? 59.438 46.926 92.611 1.00 11.12 ? 596 GLN B OE1 1 +ATOM 9703 N NE2 . GLN B 1 576 ? 59.166 45.932 90.627 1.00 14.15 ? 596 GLN B NE2 1 +ATOM 9704 N N . SER B 1 577 ? 63.968 43.133 94.020 1.00 9.36 ? 597 SER B N 1 +ATOM 9705 C CA . SER B 1 577 ? 64.159 42.050 94.996 1.00 9.80 ? 597 SER B CA 1 +ATOM 9706 C C . SER B 1 577 ? 64.582 42.716 96.295 1.00 9.72 ? 597 SER B C 1 +ATOM 9707 O O . SER B 1 577 ? 65.082 43.835 96.261 1.00 8.78 ? 597 SER B O 1 +ATOM 9708 C CB . SER B 1 577 ? 65.238 41.075 94.545 1.00 10.65 ? 597 SER B CB 1 +ATOM 9709 O OG . SER B 1 577 ? 66.508 41.641 94.741 1.00 11.94 ? 597 SER B OG 1 +ATOM 9710 N N . PRO B 1 578 ? 64.402 42.038 97.446 1.00 9.55 ? 598 PRO B N 1 +ATOM 9711 C CA . PRO B 1 578 ? 64.812 42.647 98.729 1.00 9.62 ? 598 PRO B CA 1 +ATOM 9712 C C . PRO B 1 578 ? 66.312 42.961 98.912 1.00 9.71 ? 598 PRO B C 1 +ATOM 9713 O O . PRO B 1 578 ? 66.661 43.668 99.872 1.00 11.56 ? 598 PRO B O 1 +ATOM 9714 C CB . PRO B 1 578 ? 64.354 41.607 99.766 1.00 9.58 ? 598 PRO B CB 1 +ATOM 9715 C CG . PRO B 1 578 ? 63.246 40.858 99.069 1.00 9.42 ? 598 PRO B CG 1 +ATOM 9716 C CD . PRO B 1 578 ? 63.748 40.740 97.658 1.00 10.33 ? 598 PRO B CD 1 +ATOM 9717 N N . THR B 1 579 ? 67.177 42.498 98.015 1.00 8.80 ? 599 THR B N 1 +ATOM 9718 C CA . THR B 1 579 ? 68.629 42.789 98.106 1.00 9.04 ? 599 THR B CA 1 +ATOM 9719 C C . THR B 1 579 ? 69.075 43.878 97.121 1.00 8.95 ? 599 THR B C 1 +ATOM 9720 O O . THR B 1 579 ? 70.265 44.221 97.045 1.00 8.61 ? 599 THR B O 1 +ATOM 9721 C CB . THR B 1 579 ? 69.510 41.526 97.879 1.00 9.85 ? 599 THR B CB 1 +ATOM 9722 O OG1 . THR B 1 579 ? 69.351 41.047 96.540 1.00 12.15 ? 599 THR B OG1 1 +ATOM 9723 C CG2 . THR B 1 579 ? 69.152 40.420 98.855 1.00 10.29 ? 599 THR B CG2 1 +ATOM 9724 N N . ARG B 1 580 ? 68.120 44.421 96.372 1.00 8.19 ? 600 ARG B N 1 +ATOM 9725 C CA . ARG B 1 580 ? 68.425 45.424 95.370 1.00 8.65 ? 600 ARG B CA 1 +ATOM 9726 C C . ARG B 1 580 ? 67.604 46.681 95.615 1.00 9.00 ? 600 ARG B C 1 +ATOM 9727 O O . ARG B 1 580 ? 66.387 46.705 95.426 1.00 7.90 ? 600 ARG B O 1 +ATOM 9728 C CB . ARG B 1 580 ? 68.221 44.844 93.962 1.00 8.49 ? 600 ARG B CB 1 +ATOM 9729 C CG . ARG B 1 580 ? 69.245 43.773 93.575 1.00 8.69 ? 600 ARG B CG 1 +ATOM 9730 C CD . ARG B 1 580 ? 70.614 44.382 93.314 1.00 7.21 ? 600 ARG B CD 1 +ATOM 9731 N NE . ARG B 1 580 ? 71.696 43.409 93.040 1.00 7.75 ? 600 ARG B NE 1 +ATOM 9732 C CZ . ARG B 1 580 ? 72.484 42.877 93.975 1.00 10.08 ? 600 ARG B CZ 1 +ATOM 9733 N NH1 . ARG B 1 580 ? 72.318 43.178 95.256 1.00 10.30 ? 600 ARG B NH1 1 +ATOM 9734 N NH2 . ARG B 1 580 ? 73.451 42.034 93.640 1.00 10.73 ? 600 ARG B NH2 1 +ATOM 9735 N N . VAL B 1 581 ? 68.289 47.720 96.071 1.00 9.24 ? 601 VAL B N 1 +ATOM 9736 C CA . VAL B 1 581 ? 67.645 48.979 96.408 1.00 10.39 ? 601 VAL B CA 1 +ATOM 9737 C C . VAL B 1 581 ? 67.584 49.831 95.149 1.00 10.48 ? 601 VAL B C 1 +ATOM 9738 O O . VAL B 1 581 ? 68.532 50.533 94.838 1.00 10.80 ? 601 VAL B O 1 +ATOM 9739 C CB . VAL B 1 581 ? 68.412 49.704 97.521 1.00 10.56 ? 601 VAL B CB 1 +ATOM 9740 C CG1 . VAL B 1 581 ? 67.680 51.019 97.911 1.00 11.36 ? 601 VAL B CG1 1 +ATOM 9741 C CG2 . VAL B 1 581 ? 68.573 48.800 98.707 1.00 11.54 ? 601 VAL B CG2 1 +ATOM 9742 N N . LEU B 1 582 ? 66.480 49.753 94.417 1.00 10.25 ? 602 LEU B N 1 +ATOM 9743 C CA . LEU B 1 582 ? 66.366 50.402 93.107 1.00 11.06 ? 602 LEU B CA 1 +ATOM 9744 C C . LEU B 1 582 ? 67.554 50.044 92.205 1.00 11.15 ? 602 LEU B C 1 +ATOM 9745 O O . LEU B 1 582 ? 68.232 50.907 91.659 1.00 11.95 ? 602 LEU B O 1 +ATOM 9746 C CB . LEU B 1 582 ? 66.200 51.943 93.253 1.00 11.73 ? 602 LEU B CB 1 +ATOM 9747 C CG . LEU B 1 582 ? 64.760 52.474 93.274 1.00 12.88 ? 602 LEU B CG 1 +ATOM 9748 C CD1 . LEU B 1 582 ? 64.697 53.964 93.053 1.00 13.67 ? 602 LEU B CD1 1 +ATOM 9749 C CD2 . LEU B 1 582 ? 63.899 51.793 92.227 1.00 14.73 ? 602 LEU B CD2 1 +ATOM 9750 N N . GLY B 1 583 ? 67.835 48.752 92.085 1.00 9.62 ? 603 GLY B N 1 +ATOM 9751 C CA . GLY B 1 583 ? 68.955 48.303 91.266 1.00 9.44 ? 603 GLY B CA 1 +ATOM 9752 C C . GLY B 1 583 ? 70.183 47.964 92.080 1.00 8.93 ? 603 GLY B C 1 +ATOM 9753 O O . GLY B 1 583 ? 70.100 47.784 93.291 1.00 10.76 ? 603 GLY B O 1 +ATOM 9754 N N . ASN B 1 584 ? 71.314 47.853 91.393 1.00 8.37 ? 604 ASN B N 1 +ATOM 9755 C CA . ASN B 1 584 ? 72.572 47.433 91.984 1.00 8.38 ? 604 ASN B CA 1 +ATOM 9756 C C . ASN B 1 584 ? 73.313 48.721 92.284 1.00 8.15 ? 604 ASN B C 1 +ATOM 9757 O O . ASN B 1 584 ? 73.535 49.541 91.376 1.00 8.60 ? 604 ASN B O 1 +ATOM 9758 C CB . ASN B 1 584 ? 73.340 46.537 91.002 1.00 8.17 ? 604 ASN B CB 1 +ATOM 9759 C CG . ASN B 1 584 ? 74.682 46.104 91.520 1.00 7.81 ? 604 ASN B CG 1 +ATOM 9760 O OD1 . ASN B 1 584 ? 75.529 46.942 91.837 1.00 6.58 ? 604 ASN B OD1 1 +ATOM 9761 N ND2 . ASN B 1 584 ? 74.909 44.775 91.581 1.00 5.92 ? 604 ASN B ND2 1 +ATOM 9762 N N . LYS B 1 585 ? 73.699 48.884 93.547 1.00 7.73 ? 605 LYS B N 1 +ATOM 9763 C CA . LYS B 1 585 ? 74.336 50.104 94.023 1.00 7.29 ? 605 LYS B CA 1 +ATOM 9764 C C . LYS B 1 585 ? 75.814 49.900 94.330 1.00 7.04 ? 605 LYS B C 1 +ATOM 9765 O O . LYS B 1 585 ? 76.385 50.658 95.120 1.00 7.72 ? 605 LYS B O 1 +ATOM 9766 C CB . LYS B 1 585 ? 73.605 50.640 95.262 1.00 7.12 ? 605 LYS B CB 1 +ATOM 9767 C CG . LYS B 1 585 ? 72.168 51.140 95.009 1.00 7.52 ? 605 LYS B CG 1 +ATOM 9768 C CD . LYS B 1 585 ? 72.114 52.603 94.556 1.00 8.56 ? 605 LYS B CD 1 +ATOM 9769 C CE . LYS B 1 585 ? 70.696 53.154 94.461 1.00 8.29 ? 605 LYS B CE 1 +ATOM 9770 N NZ . LYS B 1 585 ? 69.834 52.460 93.470 1.00 7.72 ? 605 LYS B NZ 1 +ATOM 9771 N N . LYS B 1 586 ? 76.451 48.914 93.695 1.00 6.10 ? 606 LYS B N 1 +ATOM 9772 C CA . LYS B 1 586 ? 77.909 48.736 93.879 1.00 5.35 ? 606 LYS B CA 1 +ATOM 9773 C C . LYS B 1 586 ? 78.768 49.734 93.071 1.00 5.18 ? 606 LYS B C 1 +ATOM 9774 O O . LYS B 1 586 ? 80.008 49.642 93.062 1.00 5.36 ? 606 LYS B O 1 +ATOM 9775 C CB . LYS B 1 586 ? 78.320 47.296 93.564 1.00 5.02 ? 606 LYS B CB 1 +ATOM 9776 C CG . LYS B 1 586 ? 77.603 46.259 94.423 1.00 4.85 ? 606 LYS B CG 1 +ATOM 9777 C CD . LYS B 1 586 ? 78.395 44.953 94.500 1.00 6.51 ? 606 LYS B CD 1 +ATOM 9778 C CE . LYS B 1 586 ? 77.755 43.955 95.429 1.00 7.82 ? 606 LYS B CE 1 +ATOM 9779 N NZ . LYS B 1 586 ? 76.456 43.443 94.896 1.00 8.63 ? 606 LYS B NZ 1 +ATOM 9780 N N . GLY B 1 587 ? 78.147 50.679 92.371 1.00 5.27 ? 607 GLY B N 1 +ATOM 9781 C CA . GLY B 1 587 ? 78.928 51.626 91.581 1.00 6.17 ? 607 GLY B CA 1 +ATOM 9782 C C . GLY B 1 587 ? 79.911 52.450 92.401 1.00 6.31 ? 607 GLY B C 1 +ATOM 9783 O O . GLY B 1 587 ? 79.635 52.833 93.550 1.00 5.21 ? 607 GLY B O 1 +ATOM 9784 N N . ILE B 1 588 ? 81.083 52.717 91.838 1.00 5.85 ? 608 ILE B N 1 +ATOM 9785 C CA . ILE B 1 588 ? 81.932 53.756 92.411 1.00 6.41 ? 608 ILE B CA 1 +ATOM 9786 C C . ILE B 1 588 ? 81.451 55.142 91.966 1.00 5.90 ? 608 ILE B C 1 +ATOM 9787 O O . ILE B 1 588 ? 81.757 56.135 92.625 1.00 6.03 ? 608 ILE B O 1 +ATOM 9788 C CB . ILE B 1 588 ? 83.429 53.568 92.068 1.00 6.83 ? 608 ILE B CB 1 +ATOM 9789 C CG1 . ILE B 1 588 ? 83.634 53.420 90.561 1.00 7.46 ? 608 ILE B CG1 1 +ATOM 9790 C CG2 . ILE B 1 588 ? 83.977 52.380 92.833 1.00 6.90 ? 608 ILE B CG2 1 +ATOM 9791 C CD1 . ILE B 1 588 ? 85.107 53.490 90.120 1.00 7.74 ? 608 ILE B CD1 1 +ATOM 9792 N N . PHE B 1 589 ? 80.721 55.196 90.846 1.00 5.92 ? 609 PHE B N 1 +ATOM 9793 C CA . PHE B 1 589 ? 79.968 56.378 90.425 1.00 5.40 ? 609 PHE B CA 1 +ATOM 9794 C C . PHE B 1 589 ? 78.464 56.157 90.570 1.00 5.97 ? 609 PHE B C 1 +ATOM 9795 O O . PHE B 1 589 ? 77.967 55.032 90.470 1.00 5.05 ? 609 PHE B O 1 +ATOM 9796 C CB . PHE B 1 589 ? 80.276 56.737 88.972 1.00 5.84 ? 609 PHE B CB 1 +ATOM 9797 C CG . PHE B 1 589 ? 81.732 57.047 88.714 1.00 4.26 ? 609 PHE B CG 1 +ATOM 9798 C CD1 . PHE B 1 589 ? 82.590 56.102 88.205 1.00 5.63 ? 609 PHE B CD1 1 +ATOM 9799 C CD2 . PHE B 1 589 ? 82.219 58.319 88.938 1.00 6.22 ? 609 PHE B CD2 1 +ATOM 9800 C CE1 . PHE B 1 589 ? 83.939 56.415 87.974 1.00 5.44 ? 609 PHE B CE1 1 +ATOM 9801 C CE2 . PHE B 1 589 ? 83.543 58.632 88.718 1.00 5.93 ? 609 PHE B CE2 1 +ATOM 9802 C CZ . PHE B 1 589 ? 84.395 57.691 88.235 1.00 5.65 ? 609 PHE B CZ 1 +ATOM 9803 N N . THR B 1 590 ? 77.726 57.231 90.808 1.00 4.89 ? 610 THR B N 1 +ATOM 9804 C CA . THR B 1 590 ? 76.256 57.133 90.764 1.00 5.51 ? 610 THR B CA 1 +ATOM 9805 C C . THR B 1 590 ? 75.804 56.874 89.318 1.00 5.77 ? 610 THR B C 1 +ATOM 9806 O O . THR B 1 590 ? 76.576 57.038 88.381 1.00 6.42 ? 610 THR B O 1 +ATOM 9807 C CB . THR B 1 590 ? 75.603 58.418 91.262 1.00 5.70 ? 610 THR B CB 1 +ATOM 9808 O OG1 . THR B 1 590 ? 75.933 59.472 90.358 1.00 5.82 ? 610 THR B OG1 1 +ATOM 9809 C CG2 . THR B 1 590 ? 76.093 58.771 92.641 1.00 6.22 ? 610 THR B CG2 1 +ATOM 9810 N N . ARG B 1 591 ? 74.542 56.490 89.132 1.00 5.96 ? 611 ARG B N 1 +ATOM 9811 C CA . ARG B 1 591 ? 73.984 56.313 87.784 1.00 5.73 ? 611 ARG B CA 1 +ATOM 9812 C C . ARG B 1 591 ? 74.050 57.616 86.953 1.00 6.23 ? 611 ARG B C 1 +ATOM 9813 O O . ARG B 1 591 ? 74.022 57.569 85.732 1.00 5.34 ? 611 ARG B O 1 +ATOM 9814 C CB . ARG B 1 591 ? 72.542 55.829 87.879 1.00 6.35 ? 611 ARG B CB 1 +ATOM 9815 C CG . ARG B 1 591 ? 72.014 55.152 86.641 1.00 6.33 ? 611 ARG B CG 1 +ATOM 9816 C CD . ARG B 1 591 ? 70.612 54.629 86.884 1.00 7.04 ? 611 ARG B CD 1 +ATOM 9817 N NE . ARG B 1 591 ? 70.164 53.718 85.839 1.00 8.16 ? 611 ARG B NE 1 +ATOM 9818 C CZ . ARG B 1 591 ? 68.901 53.560 85.453 1.00 9.92 ? 611 ARG B CZ 1 +ATOM 9819 N NH1 . ARG B 1 591 ? 67.924 54.283 85.981 1.00 9.11 ? 611 ARG B NH1 1 +ATOM 9820 N NH2 . ARG B 1 591 ? 68.609 52.659 84.522 1.00 11.47 ? 611 ARG B NH2 1 +ATOM 9821 N N . GLN B 1 592 ? 74.129 58.758 87.639 1.00 6.18 ? 612 GLN B N 1 +ATOM 9822 C CA . GLN B 1 592 ? 74.212 60.079 87.011 1.00 6.49 ? 612 GLN B CA 1 +ATOM 9823 C C . GLN B 1 592 ? 75.673 60.530 86.826 1.00 6.62 ? 612 GLN B C 1 +ATOM 9824 O O . GLN B 1 592 ? 75.931 61.698 86.525 1.00 6.61 ? 612 GLN B O 1 +ATOM 9825 C CB . GLN B 1 592 ? 73.432 61.092 87.845 1.00 6.59 ? 612 GLN B CB 1 +ATOM 9826 C CG . GLN B 1 592 ? 71.946 60.736 88.005 1.00 6.10 ? 612 GLN B CG 1 +ATOM 9827 C CD . GLN B 1 592 ? 71.680 59.709 89.092 1.00 7.16 ? 612 GLN B CD 1 +ATOM 9828 O OE1 . GLN B 1 592 ? 72.321 59.722 90.142 1.00 7.68 ? 612 GLN B OE1 1 +ATOM 9829 N NE2 . GLN B 1 592 ? 70.698 58.836 88.866 1.00 6.66 ? 612 GLN B NE2 1 +ATOM 9830 N N . ARG B 1 593 ? 76.597 59.590 87.018 1.00 7.41 ? 613 ARG B N 1 +ATOM 9831 C CA . ARG B 1 593 ? 78.016 59.750 86.661 1.00 7.70 ? 613 ARG B CA 1 +ATOM 9832 C C . ARG B 1 593 ? 78.774 60.756 87.537 1.00 7.73 ? 613 ARG B C 1 +ATOM 9833 O O . ARG B 1 593 ? 79.619 61.536 87.053 1.00 8.16 ? 613 ARG B O 1 +ATOM 9834 C CB . ARG B 1 593 ? 78.174 60.116 85.184 1.00 7.53 ? 613 ARG B CB 1 +ATOM 9835 C CG . ARG B 1 593 ? 78.348 58.939 84.275 1.00 8.20 ? 613 ARG B CG 1 +ATOM 9836 C CD . ARG B 1 593 ? 77.145 58.031 84.280 1.00 9.78 ? 613 ARG B CD 1 +ATOM 9837 N NE . ARG B 1 593 ? 77.361 56.919 83.368 1.00 10.33 ? 613 ARG B NE 1 +ATOM 9838 C CZ . ARG B 1 593 ? 76.541 55.894 83.219 1.00 12.64 ? 613 ARG B CZ 1 +ATOM 9839 N NH1 . ARG B 1 593 ? 75.420 55.809 83.930 1.00 10.31 ? 613 ARG B NH1 1 +ATOM 9840 N NH2 . ARG B 1 593 ? 76.861 54.942 82.343 1.00 14.14 ? 613 ARG B NH2 1 +ATOM 9841 N N . GLN B 1 594 ? 78.487 60.718 88.831 1.00 6.82 ? 614 GLN B N 1 +ATOM 9842 C CA . GLN B 1 594 ? 79.265 61.484 89.805 1.00 8.02 ? 614 GLN B CA 1 +ATOM 9843 C C . GLN B 1 594 ? 79.870 60.537 90.840 1.00 7.93 ? 614 GLN B C 1 +ATOM 9844 O O . GLN B 1 594 ? 79.278 59.533 91.191 1.00 8.16 ? 614 GLN B O 1 +ATOM 9845 C CB . GLN B 1 594 ? 78.392 62.529 90.479 1.00 7.82 ? 614 GLN B CB 1 +ATOM 9846 C CG . GLN B 1 594 ? 77.830 63.568 89.498 1.00 8.62 ? 614 GLN B CG 1 +ATOM 9847 C CD . GLN B 1 594 ? 78.908 64.381 88.798 1.00 8.77 ? 614 GLN B CD 1 +ATOM 9848 O OE1 . GLN B 1 594 ? 80.078 64.369 89.191 1.00 8.04 ? 614 GLN B OE1 1 +ATOM 9849 N NE2 . GLN B 1 594 ? 78.522 65.071 87.728 1.00 9.90 ? 614 GLN B NE2 1 +ATOM 9850 N N . PRO B 1 595 ? 81.072 60.863 91.320 1.00 8.88 ? 615 PRO B N 1 +ATOM 9851 C CA . PRO B 1 595 ? 81.794 59.904 92.140 1.00 9.56 ? 615 PRO B CA 1 +ATOM 9852 C C . PRO B 1 595 ? 81.304 59.815 93.578 1.00 9.25 ? 615 PRO B C 1 +ATOM 9853 O O . PRO B 1 595 ? 81.089 60.849 94.227 1.00 9.80 ? 615 PRO B O 1 +ATOM 9854 C CB . PRO B 1 595 ? 83.228 60.434 92.094 1.00 9.31 ? 615 PRO B CB 1 +ATOM 9855 C CG . PRO B 1 595 ? 83.074 61.907 91.957 1.00 9.66 ? 615 PRO B CG 1 +ATOM 9856 C CD . PRO B 1 595 ? 81.828 62.114 91.126 1.00 10.35 ? 615 PRO B CD 1 +ATOM 9857 N N . LYS B 1 596 ? 81.154 58.589 94.069 1.00 8.90 ? 616 LYS B N 1 +ATOM 9858 C CA . LYS B 1 596 ? 81.048 58.330 95.494 1.00 8.78 ? 616 LYS B CA 1 +ATOM 9859 C C . LYS B 1 596 ? 82.439 58.489 96.068 1.00 9.67 ? 616 LYS B C 1 +ATOM 9860 O O . LYS B 1 596 ? 83.412 58.580 95.322 1.00 8.64 ? 616 LYS B O 1 +ATOM 9861 C CB . LYS B 1 596 ? 80.510 56.920 95.776 1.00 8.46 ? 616 LYS B CB 1 +ATOM 9862 C CG . LYS B 1 596 ? 79.120 56.720 95.242 1.00 7.56 ? 616 LYS B CG 1 +ATOM 9863 C CD . LYS B 1 596 ? 78.610 55.300 95.463 1.00 7.03 ? 616 LYS B CD 1 +ATOM 9864 C CE . LYS B 1 596 ? 77.448 54.991 94.552 1.00 6.67 ? 616 LYS B CE 1 +ATOM 9865 N NZ . LYS B 1 596 ? 77.115 53.545 94.602 1.00 5.51 ? 616 LYS B NZ 1 +ATOM 9866 N N . SER B 1 597 ? 82.542 58.516 97.391 1.00 9.92 ? 617 SER B N 1 +ATOM 9867 C CA . SER B 1 597 ? 83.850 58.743 98.011 1.00 10.88 ? 617 SER B CA 1 +ATOM 9868 C C . SER B 1 597 ? 84.885 57.690 97.644 1.00 10.12 ? 617 SER B C 1 +ATOM 9869 O O . SER B 1 597 ? 86.062 58.024 97.463 1.00 10.70 ? 617 SER B O 1 +ATOM 9870 C CB . SER B 1 597 ? 83.718 58.853 99.526 1.00 11.61 ? 617 SER B CB 1 +ATOM 9871 O OG . SER B 1 597 ? 83.226 60.140 99.858 1.00 15.34 ? 617 SER B OG 1 +ATOM 9872 N N . ALA B 1 598 ? 84.457 56.435 97.508 1.00 9.58 ? 618 ALA B N 1 +ATOM 9873 C CA . ALA B 1 598 ? 85.360 55.340 97.142 1.00 9.48 ? 618 ALA B CA 1 +ATOM 9874 C C . ALA B 1 598 ? 86.009 55.518 95.769 1.00 9.15 ? 618 ALA B C 1 +ATOM 9875 O O . ALA B 1 598 ? 87.094 54.995 95.537 1.00 9.60 ? 618 ALA B O 1 +ATOM 9876 C CB . ALA B 1 598 ? 84.628 53.996 97.181 1.00 9.84 ? 618 ALA B CB 1 +ATOM 9877 N N . ALA B 1 599 ? 85.361 56.245 94.861 1.00 8.65 ? 619 ALA B N 1 +ATOM 9878 C CA . ALA B 1 599 ? 85.940 56.493 93.540 1.00 8.61 ? 619 ALA B CA 1 +ATOM 9879 C C . ALA B 1 599 ? 87.315 57.144 93.663 1.00 8.96 ? 619 ALA B C 1 +ATOM 9880 O O . ALA B 1 599 ? 88.230 56.819 92.908 1.00 8.95 ? 619 ALA B O 1 +ATOM 9881 C CB . ALA B 1 599 ? 85.022 57.368 92.683 1.00 9.38 ? 619 ALA B CB 1 +ATOM 9882 N N . PHE B 1 600 ? 87.450 58.066 94.619 1.00 9.70 ? 620 PHE B N 1 +ATOM 9883 C CA . PHE B 1 600 ? 88.702 58.798 94.799 1.00 9.92 ? 620 PHE B CA 1 +ATOM 9884 C C . PHE B 1 600 ? 89.780 57.872 95.332 1.00 10.44 ? 620 PHE B C 1 +ATOM 9885 O O . PHE B 1 600 ? 90.957 58.010 94.977 1.00 10.36 ? 620 PHE B O 1 +ATOM 9886 C CB . PHE B 1 600 ? 88.487 59.994 95.726 1.00 10.27 ? 620 PHE B CB 1 +ATOM 9887 C CG . PHE B 1 600 ? 87.609 61.053 95.128 1.00 9.86 ? 620 PHE B CG 1 +ATOM 9888 C CD1 . PHE B 1 600 ? 88.156 62.063 94.330 1.00 10.89 ? 620 PHE B CD1 1 +ATOM 9889 C CD2 . PHE B 1 600 ? 86.243 61.038 95.347 1.00 11.01 ? 620 PHE B CD2 1 +ATOM 9890 C CE1 . PHE B 1 600 ? 87.363 63.042 93.782 1.00 11.66 ? 620 PHE B CE1 1 +ATOM 9891 C CE2 . PHE B 1 600 ? 85.427 62.018 94.790 1.00 9.90 ? 620 PHE B CE2 1 +ATOM 9892 C CZ . PHE B 1 600 ? 85.988 63.022 94.000 1.00 10.58 ? 620 PHE B CZ 1 +ATOM 9893 N N . LEU B 1 601 ? 89.376 56.946 96.194 1.00 10.42 ? 621 LEU B N 1 +ATOM 9894 C CA A LEU B 1 601 ? 90.300 55.972 96.758 0.33 10.33 ? 621 LEU B CA 1 +ATOM 9895 C CA B LEU B 1 601 ? 90.304 55.972 96.760 0.33 10.20 ? 621 LEU B CA 1 +ATOM 9896 C CA C LEU B 1 601 ? 90.286 55.949 96.762 0.33 10.37 ? 621 LEU B CA 1 +ATOM 9897 C C . LEU B 1 601 ? 90.877 55.086 95.657 1.00 10.44 ? 621 LEU B C 1 +ATOM 9898 O O . LEU B 1 601 ? 92.095 54.906 95.576 1.00 10.81 ? 621 LEU B O 1 +ATOM 9899 C CB A LEU B 1 601 ? 89.596 55.129 97.829 0.33 10.31 ? 621 LEU B CB 1 +ATOM 9900 C CB B LEU B 1 601 ? 89.615 55.131 97.845 0.33 10.15 ? 621 LEU B CB 1 +ATOM 9901 C CB C LEU B 1 601 ? 89.546 55.075 97.789 0.33 10.38 ? 621 LEU B CB 1 +ATOM 9902 C CG A LEU B 1 601 ? 90.428 54.161 98.676 0.33 10.55 ? 621 LEU B CG 1 +ATOM 9903 C CG B LEU B 1 601 ? 90.470 54.124 98.624 0.33 10.19 ? 621 LEU B CG 1 +ATOM 9904 C CG C LEU B 1 601 ? 90.175 53.776 98.314 0.33 10.91 ? 621 LEU B CG 1 +ATOM 9905 C CD1 A LEU B 1 601 ? 90.753 52.891 97.898 0.33 10.32 ? 621 LEU B CD1 1 +ATOM 9906 C CD1 B LEU B 1 601 ? 89.846 53.796 99.984 0.33 9.74 ? 621 LEU B CD1 1 +ATOM 9907 C CD1 C LEU B 1 601 ? 89.229 53.117 99.299 0.33 10.26 ? 621 LEU B CD1 1 +ATOM 9908 C CD2 A LEU B 1 601 ? 91.698 54.827 99.189 0.33 10.69 ? 621 LEU B CD2 1 +ATOM 9909 C CD2 B LEU B 1 601 ? 90.657 52.846 97.822 0.33 9.83 ? 621 LEU B CD2 1 +ATOM 9910 C CD2 C LEU B 1 601 ? 90.506 52.801 97.209 0.33 10.85 ? 621 LEU B CD2 1 +ATOM 9911 N N . LEU B 1 602 ? 89.998 54.543 94.807 1.00 10.14 ? 622 LEU B N 1 +ATOM 9912 C CA . LEU B 1 602 ? 90.408 53.702 93.692 1.00 10.10 ? 622 LEU B CA 1 +ATOM 9913 C C . LEU B 1 602 ? 91.270 54.487 92.697 1.00 10.05 ? 622 LEU B C 1 +ATOM 9914 O O . LEU B 1 602 ? 92.265 53.970 92.168 1.00 10.04 ? 622 LEU B O 1 +ATOM 9915 C CB . LEU B 1 602 ? 89.183 53.101 92.970 1.00 9.57 ? 622 LEU B CB 1 +ATOM 9916 C CG . LEU B 1 602 ? 89.491 51.969 91.980 1.00 10.21 ? 622 LEU B CG 1 +ATOM 9917 C CD1 . LEU B 1 602 ? 90.023 50.749 92.704 1.00 11.33 ? 622 LEU B CD1 1 +ATOM 9918 C CD2 . LEU B 1 602 ? 88.255 51.583 91.149 1.00 10.08 ? 622 LEU B CD2 1 +ATOM 9919 N N . ARG B 1 603 ? 90.892 55.733 92.445 1.00 10.37 ? 623 ARG B N 1 +ATOM 9920 C CA . ARG B 1 603 ? 91.652 56.603 91.551 1.00 10.67 ? 623 ARG B CA 1 +ATOM 9921 C C . ARG B 1 603 ? 93.091 56.766 92.050 1.00 11.55 ? 623 ARG B C 1 +ATOM 9922 O O . ARG B 1 603 ? 94.036 56.643 91.277 1.00 11.73 ? 623 ARG B O 1 +ATOM 9923 C CB . ARG B 1 603 ? 90.971 57.971 91.427 1.00 11.29 ? 623 ARG B CB 1 +ATOM 9924 C CG . ARG B 1 603 ? 91.736 59.021 90.631 1.00 10.45 ? 623 ARG B CG 1 +ATOM 9925 C CD . ARG B 1 603 ? 90.834 60.211 90.351 1.00 12.38 ? 623 ARG B CD 1 +ATOM 9926 N NE . ARG B 1 603 ? 91.513 61.342 89.735 1.00 13.39 ? 623 ARG B NE 1 +ATOM 9927 C CZ . ARG B 1 603 ? 91.957 62.410 90.388 1.00 13.30 ? 623 ARG B CZ 1 +ATOM 9928 N NH1 . ARG B 1 603 ? 91.820 62.512 91.706 1.00 16.13 ? 623 ARG B NH1 1 +ATOM 9929 N NH2 . ARG B 1 603 ? 92.536 63.395 89.713 1.00 15.19 ? 623 ARG B NH2 1 +ATOM 9930 N N . GLU B 1 604 ? 93.260 57.023 93.345 1.00 11.75 ? 624 GLU B N 1 +ATOM 9931 C CA . GLU B 1 604 ? 94.615 57.101 93.926 1.00 12.34 ? 624 GLU B CA 1 +ATOM 9932 C C . GLU B 1 604 ? 95.418 55.823 93.650 1.00 11.31 ? 624 GLU B C 1 +ATOM 9933 O O . GLU B 1 604 ? 96.573 55.878 93.207 1.00 11.17 ? 624 GLU B O 1 +ATOM 9934 C CB . GLU B 1 604 ? 94.545 57.349 95.434 1.00 13.08 ? 624 GLU B CB 1 +ATOM 9935 C CG . GLU B 1 604 ? 94.081 58.751 95.834 1.00 16.83 ? 624 GLU B CG 1 +ATOM 9936 C CD . GLU B 1 604 ? 94.852 59.848 95.134 1.00 20.64 ? 624 GLU B CD 1 +ATOM 9937 O OE1 . GLU B 1 604 ? 96.082 59.956 95.348 1.00 23.00 ? 624 GLU B OE1 1 +ATOM 9938 O OE2 . GLU B 1 604 ? 94.226 60.603 94.355 1.00 25.80 ? 624 GLU B OE2 1 +ATOM 9939 N N . ARG B 1 605 ? 94.798 54.676 93.905 1.00 10.09 ? 625 ARG B N 1 +ATOM 9940 C CA . ARG B 1 605 ? 95.443 53.377 93.691 1.00 9.13 ? 625 ARG B CA 1 +ATOM 9941 C C . ARG B 1 605 ? 95.879 53.193 92.243 1.00 8.77 ? 625 ARG B C 1 +ATOM 9942 O O . ARG B 1 605 ? 97.014 52.819 91.974 1.00 7.82 ? 625 ARG B O 1 +ATOM 9943 C CB . ARG B 1 605 ? 94.513 52.224 94.098 1.00 9.09 ? 625 ARG B CB 1 +ATOM 9944 C CG . ARG B 1 605 ? 95.074 50.843 93.754 1.00 8.95 ? 625 ARG B CG 1 +ATOM 9945 C CD . ARG B 1 605 ? 94.225 49.768 94.346 1.00 9.14 ? 625 ARG B CD 1 +ATOM 9946 N NE . ARG B 1 605 ? 94.647 48.412 94.001 1.00 8.27 ? 625 ARG B NE 1 +ATOM 9947 C CZ . ARG B 1 605 ? 95.720 47.798 94.508 1.00 8.45 ? 625 ARG B CZ 1 +ATOM 9948 N NH1 . ARG B 1 605 ? 96.485 48.418 95.372 1.00 7.81 ? 625 ARG B NH1 1 +ATOM 9949 N NH2 . ARG B 1 605 ? 96.004 46.544 94.175 1.00 9.32 ? 625 ARG B NH2 1 +ATOM 9950 N N . TYR B 1 606 ? 94.969 53.469 91.311 1.00 8.07 ? 626 TYR B N 1 +ATOM 9951 C CA . TYR B 1 606 ? 95.233 53.217 89.897 1.00 8.66 ? 626 TYR B CA 1 +ATOM 9952 C C . TYR B 1 606 ? 96.374 54.068 89.345 1.00 9.46 ? 626 TYR B C 1 +ATOM 9953 O O . TYR B 1 606 ? 97.199 53.578 88.571 1.00 9.34 ? 626 TYR B O 1 +ATOM 9954 C CB . TYR B 1 606 ? 93.938 53.410 89.086 1.00 9.04 ? 626 TYR B CB 1 +ATOM 9955 C CG . TYR B 1 606 ? 92.963 52.234 89.157 1.00 9.13 ? 626 TYR B CG 1 +ATOM 9956 C CD1 . TYR B 1 606 ? 93.152 51.168 90.046 1.00 8.40 ? 626 TYR B CD1 1 +ATOM 9957 C CD2 . TYR B 1 606 ? 91.824 52.200 88.343 1.00 8.64 ? 626 TYR B CD2 1 +ATOM 9958 C CE1 . TYR B 1 606 ? 92.254 50.091 90.098 1.00 7.79 ? 626 TYR B CE1 1 +ATOM 9959 C CE2 . TYR B 1 606 ? 90.909 51.123 88.396 1.00 9.16 ? 626 TYR B CE2 1 +ATOM 9960 C CZ . TYR B 1 606 ? 91.130 50.079 89.282 1.00 9.20 ? 626 TYR B CZ 1 +ATOM 9961 O OH . TYR B 1 606 ? 90.254 49.003 89.354 1.00 9.17 ? 626 TYR B OH 1 +ATOM 9962 N N . TRP B 1 607 ? 96.429 55.333 89.743 1.00 9.64 ? 627 TRP B N 1 +ATOM 9963 C CA . TRP B 1 607 ? 97.527 56.189 89.286 1.00 10.66 ? 627 TRP B CA 1 +ATOM 9964 C C . TRP B 1 607 ? 98.853 55.737 89.911 1.00 11.69 ? 627 TRP B C 1 +ATOM 9965 O O . TRP B 1 607 ? 99.893 55.714 89.227 1.00 12.15 ? 627 TRP B O 1 +ATOM 9966 C CB . TRP B 1 607 ? 97.203 57.657 89.549 1.00 11.04 ? 627 TRP B CB 1 +ATOM 9967 C CG . TRP B 1 607 ? 96.216 58.186 88.534 1.00 11.28 ? 627 TRP B CG 1 +ATOM 9968 C CD1 . TRP B 1 607 ? 94.854 58.251 88.661 1.00 12.48 ? 627 TRP B CD1 1 +ATOM 9969 C CD2 . TRP B 1 607 ? 96.522 58.704 87.235 1.00 10.52 ? 627 TRP B CD2 1 +ATOM 9970 N NE1 . TRP B 1 607 ? 94.299 58.784 87.521 1.00 11.78 ? 627 TRP B NE1 1 +ATOM 9971 C CE2 . TRP B 1 607 ? 95.303 59.072 86.632 1.00 12.47 ? 627 TRP B CE2 1 +ATOM 9972 C CE3 . TRP B 1 607 ? 97.713 58.898 86.525 1.00 12.47 ? 627 TRP B CE3 1 +ATOM 9973 C CZ2 . TRP B 1 607 ? 95.241 59.615 85.349 1.00 11.63 ? 627 TRP B CZ2 1 +ATOM 9974 C CZ3 . TRP B 1 607 ? 97.654 59.437 85.251 1.00 11.92 ? 627 TRP B CZ3 1 +ATOM 9975 C CH2 . TRP B 1 607 ? 96.428 59.798 84.676 1.00 11.39 ? 627 TRP B CH2 1 +ATOM 9976 N N . LYS B 1 608 ? 98.809 55.342 91.184 1.00 12.25 ? 628 LYS B N 1 +ATOM 9977 C CA . LYS B 1 608 ? 100.004 54.807 91.862 1.00 13.28 ? 628 LYS B CA 1 +ATOM 9978 C C . LYS B 1 608 ? 100.557 53.572 91.119 1.00 13.25 ? 628 LYS B C 1 +ATOM 9979 O O . LYS B 1 608 ? 101.757 53.493 90.835 1.00 13.67 ? 628 LYS B O 1 +ATOM 9980 C CB . LYS B 1 608 ? 99.688 54.462 93.330 1.00 12.86 ? 628 LYS B CB 1 +ATOM 9981 C CG . LYS B 1 608 ? 100.715 53.541 94.007 1.00 15.04 ? 628 LYS B CG 1 +ATOM 9982 C CD . LYS B 1 608 ? 100.354 53.186 95.444 1.00 15.91 ? 628 LYS B CD 1 +ATOM 9983 C CE . LYS B 1 608 ? 99.056 52.364 95.565 1.00 19.40 ? 628 LYS B CE 1 +ATOM 9984 N NZ . LYS B 1 608 ? 99.006 51.141 94.707 1.00 22.66 ? 628 LYS B NZ 1 +ATOM 9985 N N . ILE B 1 609 ? 99.684 52.622 90.796 1.00 13.12 ? 629 ILE B N 1 +ATOM 9986 C CA . ILE B 1 609 ? 100.096 51.414 90.065 1.00 13.45 ? 629 ILE B CA 1 +ATOM 9987 C C . ILE B 1 609 ? 100.645 51.782 88.693 1.00 14.65 ? 629 ILE B C 1 +ATOM 9988 O O . ILE B 1 609 ? 101.681 51.274 88.283 1.00 14.14 ? 629 ILE B O 1 +ATOM 9989 C CB . ILE B 1 609 ? 98.940 50.416 89.859 1.00 13.28 ? 629 ILE B CB 1 +ATOM 9990 C CG1 . ILE B 1 609 ? 98.447 49.873 91.194 1.00 12.15 ? 629 ILE B CG1 1 +ATOM 9991 C CG2 . ILE B 1 609 ? 99.387 49.259 88.965 1.00 12.51 ? 629 ILE B CG2 1 +ATOM 9992 C CD1 . ILE B 1 609 ? 97.194 49.020 91.090 1.00 12.61 ? 629 ILE B CD1 1 +ATOM 9993 N N . ALA B 1 610 ? 99.959 52.678 87.982 1.00 15.55 ? 630 ALA B N 1 +ATOM 9994 C CA . ALA B 1 610 ? 100.404 53.067 86.643 1.00 16.81 ? 630 ALA B CA 1 +ATOM 9995 C C . ALA B 1 610 ? 101.810 53.675 86.693 1.00 18.43 ? 630 ALA B C 1 +ATOM 9996 O O . ALA B 1 610 ? 102.597 53.492 85.768 1.00 18.47 ? 630 ALA B O 1 +ATOM 9997 C CB . ALA B 1 610 ? 99.415 54.058 86.013 1.00 16.62 ? 630 ALA B CB 1 +ATOM 9998 N N . ASN B 1 611 ? 102.117 54.367 87.789 1.00 19.63 ? 631 ASN B N 1 +ATOM 9999 C CA . ASN B 1 611 ? 103.392 55.082 87.938 1.00 21.59 ? 631 ASN B CA 1 +ATOM 10000 C C . ASN B 1 611 ? 104.552 54.191 88.363 1.00 22.60 ? 631 ASN B C 1 +ATOM 10001 O O . ASN B 1 611 ? 105.710 54.619 88.325 1.00 23.12 ? 631 ASN B O 1 +ATOM 10002 C CB . ASN B 1 611 ? 103.236 56.231 88.934 1.00 21.81 ? 631 ASN B CB 1 +ATOM 10003 C CG . ASN B 1 611 ? 104.254 57.346 88.716 1.00 23.90 ? 631 ASN B CG 1 +ATOM 10004 O OD1 . ASN B 1 611 ? 104.799 57.894 89.672 1.00 27.21 ? 631 ASN B OD1 1 +ATOM 10005 N ND2 . ASN B 1 611 ? 104.501 57.694 87.456 1.00 25.78 ? 631 ASN B ND2 1 +ATOM 10006 N N . GLU B 1 612 ? 104.249 52.963 88.776 1.00 23.84 ? 632 GLU B N 1 +ATOM 10007 C CA . GLU B 1 612 ? 105.290 51.978 89.087 1.00 25.20 ? 632 GLU B CA 1 +ATOM 10008 C C . GLU B 1 612 ? 106.047 51.546 87.836 1.00 26.64 ? 632 GLU B C 1 +ATOM 10009 O O . GLU B 1 612 ? 107.283 51.552 87.817 1.00 27.41 ? 632 GLU B O 1 +ATOM 10010 C CB . GLU B 1 612 ? 104.689 50.742 89.751 1.00 24.96 ? 632 GLU B CB 1 +ATOM 10011 C CG . GLU B 1 612 ? 104.204 50.998 91.161 1.00 23.75 ? 632 GLU B CG 1 +ATOM 10012 C CD . GLU B 1 612 ? 103.414 49.837 91.732 1.00 23.37 ? 632 GLU B CD 1 +ATOM 10013 O OE1 . GLU B 1 612 ? 103.137 48.871 90.997 1.00 23.58 ? 632 GLU B OE1 1 +ATOM 10014 O OE2 . GLU B 1 612 ? 103.064 49.897 92.920 1.00 23.50 ? 632 GLU B OE2 1 +ATOM 10015 N N . THR B 1 613 ? 105.289 51.144 86.815 1.00 28.22 ? 633 THR B N 1 +ATOM 10016 C CA . THR B 1 613 ? 105.835 50.622 85.563 1.00 29.02 ? 633 THR B CA 1 +ATOM 10017 C C . THR B 1 613 ? 106.746 49.411 85.789 1.00 29.45 ? 633 THR B C 1 +ATOM 10018 O O . THR B 1 613 ? 106.331 48.266 85.582 1.00 29.47 ? 633 THR B O 1 +ATOM 10019 C CB . THR B 1 613 ? 106.586 51.710 84.781 1.00 29.29 ? 633 THR B CB 1 +ATOM 10020 O OG1 . THR B 1 613 ? 105.693 52.800 84.520 1.00 30.82 ? 633 THR B OG1 1 +ATOM 10021 C CG2 . THR B 1 613 ? 107.119 51.160 83.463 1.00 29.49 ? 633 THR B CG2 1 +ATOM 10022 N N . LEU C 1 3 ? 58.471 32.501 140.934 1.00 32.72 ? 23 LEU D N 1 +ATOM 10023 C CA . LEU C 1 3 ? 59.595 32.972 141.799 1.00 32.45 ? 23 LEU D CA 1 +ATOM 10024 C C . LEU C 1 3 ? 59.062 33.941 142.875 1.00 31.92 ? 23 LEU D C 1 +ATOM 10025 O O . LEU C 1 3 ? 57.885 33.864 143.230 1.00 32.57 ? 23 LEU D O 1 +ATOM 10026 C CB . LEU C 1 3 ? 60.706 33.584 140.929 1.00 32.57 ? 23 LEU D CB 1 +ATOM 10027 C CG . LEU C 1 3 ? 62.169 33.404 141.358 1.00 32.79 ? 23 LEU D CG 1 +ATOM 10028 C CD1 . LEU C 1 3 ? 62.415 32.057 142.044 1.00 33.59 ? 23 LEU D CD1 1 +ATOM 10029 C CD2 . LEU C 1 3 ? 63.080 33.543 140.155 1.00 32.12 ? 23 LEU D CD2 1 +ATOM 10030 N N . GLN C 1 4 ? 59.898 34.850 143.382 1.00 31.07 ? 24 GLN D N 1 +ATOM 10031 C CA . GLN C 1 4 ? 59.637 35.490 144.685 1.00 30.03 ? 24 GLN D CA 1 +ATOM 10032 C C . GLN C 1 4 ? 59.246 36.973 144.653 1.00 28.34 ? 24 GLN D C 1 +ATOM 10033 O O . GLN C 1 4 ? 59.902 37.786 143.998 1.00 28.56 ? 24 GLN D O 1 +ATOM 10034 C CB . GLN C 1 4 ? 60.875 35.340 145.576 1.00 30.44 ? 24 GLN D CB 1 +ATOM 10035 C CG . GLN C 1 4 ? 61.580 33.993 145.431 1.00 31.64 ? 24 GLN D CG 1 +ATOM 10036 C CD . GLN C 1 4 ? 62.454 33.639 146.619 1.00 33.66 ? 24 GLN D CD 1 +ATOM 10037 O OE1 . GLN C 1 4 ? 62.373 34.265 147.682 1.00 34.92 ? 24 GLN D OE1 1 +ATOM 10038 N NE2 . GLN C 1 4 ? 63.294 32.620 146.447 1.00 34.27 ? 24 GLN D NE2 1 +ATOM 10039 N N . GLY C 1 5 ? 58.176 37.306 145.376 1.00 25.99 ? 25 GLY D N 1 +ATOM 10040 C CA . GLY C 1 5 ? 57.875 38.689 145.754 1.00 24.23 ? 25 GLY D CA 1 +ATOM 10041 C C . GLY C 1 5 ? 57.350 39.586 144.650 1.00 22.35 ? 25 GLY D C 1 +ATOM 10042 O O . GLY C 1 5 ? 57.232 39.168 143.506 1.00 21.66 ? 25 GLY D O 1 +ATOM 10043 N N . GLY C 1 6 ? 57.043 40.830 145.010 1.00 20.07 ? 26 GLY D N 1 +ATOM 10044 C CA . GLY C 1 6 ? 56.523 41.808 144.062 1.00 18.59 ? 26 GLY D CA 1 +ATOM 10045 C C . GLY C 1 6 ? 57.597 42.634 143.373 1.00 17.42 ? 26 GLY D C 1 +ATOM 10046 O O . GLY C 1 6 ? 58.797 42.491 143.640 1.00 15.99 ? 26 GLY D O 1 +ATOM 10047 N N . MET C 1 7 ? 57.148 43.510 142.483 1.00 16.50 ? 27 MET D N 1 +ATOM 10048 C CA . MET C 1 7 ? 58.045 44.344 141.682 1.00 16.55 ? 27 MET D CA 1 +ATOM 10049 C C . MET C 1 7 ? 57.287 45.605 141.280 1.00 15.74 ? 27 MET D C 1 +ATOM 10050 O O . MET C 1 7 ? 57.029 45.860 140.101 1.00 16.30 ? 27 MET D O 1 +ATOM 10051 C CB . MET C 1 7 ? 58.536 43.572 140.450 1.00 16.59 ? 27 MET D CB 1 +ATOM 10052 C CG . MET C 1 7 ? 59.714 44.236 139.730 1.00 17.61 ? 27 MET D CG 1 +ATOM 10053 S SD . MET C 1 7 ? 61.240 44.261 140.693 1.00 20.09 ? 27 MET D SD 1 +ATOM 10054 C CE . MET C 1 7 ? 61.547 42.509 140.932 1.00 20.03 ? 27 MET D CE 1 +ATOM 10055 N N . LEU C 1 8 ? 56.919 46.382 142.291 1.00 14.76 ? 28 LEU D N 1 +ATOM 10056 C CA . LEU C 1 8 ? 56.200 47.630 142.093 1.00 14.32 ? 28 LEU D CA 1 +ATOM 10057 C C . LEU C 1 8 ? 57.161 48.716 141.602 1.00 14.63 ? 28 LEU D C 1 +ATOM 10058 O O . LEU C 1 8 ? 58.297 48.814 142.076 1.00 13.84 ? 28 LEU D O 1 +ATOM 10059 C CB . LEU C 1 8 ? 55.550 48.066 143.406 1.00 14.15 ? 28 LEU D CB 1 +ATOM 10060 C CG . LEU C 1 8 ? 54.401 47.206 143.931 1.00 13.17 ? 28 LEU D CG 1 +ATOM 10061 C CD1 . LEU C 1 8 ? 53.989 47.694 145.300 1.00 13.10 ? 28 LEU D CD1 1 +ATOM 10062 C CD2 . LEU C 1 8 ? 53.211 47.206 142.986 1.00 11.09 ? 28 LEU D CD2 1 +ATOM 10063 N N . TYR C 1 9 ? 56.700 49.530 140.659 1.00 14.84 ? 29 TYR D N 1 +ATOM 10064 C CA . TYR C 1 9 ? 57.548 50.562 140.094 1.00 15.47 ? 29 TYR D CA 1 +ATOM 10065 C C . TYR C 1 9 ? 57.858 51.569 141.192 1.00 15.34 ? 29 TYR D C 1 +ATOM 10066 O O . TYR C 1 9 ? 56.942 52.066 141.843 1.00 15.00 ? 29 TYR D O 1 +ATOM 10067 C CB . TYR C 1 9 ? 56.864 51.272 138.927 1.00 16.25 ? 29 TYR D CB 1 +ATOM 10068 C CG . TYR C 1 9 ? 57.818 52.170 138.190 1.00 17.41 ? 29 TYR D CG 1 +ATOM 10069 C CD1 . TYR C 1 9 ? 58.919 51.637 137.546 1.00 17.61 ? 29 TYR D CD1 1 +ATOM 10070 C CD2 . TYR C 1 9 ? 57.645 53.548 138.169 1.00 19.26 ? 29 TYR D CD2 1 +ATOM 10071 C CE1 . TYR C 1 9 ? 59.829 52.443 136.876 1.00 18.12 ? 29 TYR D CE1 1 +ATOM 10072 C CE2 . TYR C 1 9 ? 58.553 54.372 137.495 1.00 19.71 ? 29 TYR D CE2 1 +ATOM 10073 C CZ . TYR C 1 9 ? 59.631 53.806 136.845 1.00 18.96 ? 29 TYR D CZ 1 +ATOM 10074 O OH . TYR C 1 9 ? 60.551 54.594 136.182 1.00 19.53 ? 29 TYR D OH 1 +ATOM 10075 N N . PRO C 1 10 ? 59.145 51.873 141.414 1.00 15.19 ? 30 PRO D N 1 +ATOM 10076 C CA . PRO C 1 10 ? 59.455 52.732 142.545 1.00 15.19 ? 30 PRO D CA 1 +ATOM 10077 C C . PRO C 1 10 ? 58.913 54.151 142.400 1.00 15.55 ? 30 PRO D C 1 +ATOM 10078 O O . PRO C 1 10 ? 58.865 54.703 141.295 1.00 15.59 ? 30 PRO D O 1 +ATOM 10079 C CB . PRO C 1 10 ? 60.992 52.744 142.582 1.00 14.80 ? 30 PRO D CB 1 +ATOM 10080 C CG . PRO C 1 10 ? 61.427 51.676 141.706 1.00 14.58 ? 30 PRO D CG 1 +ATOM 10081 C CD . PRO C 1 10 ? 60.362 51.457 140.697 1.00 15.29 ? 30 PRO D CD 1 +ATOM 10082 N N . GLN C 1 11 ? 58.493 54.719 143.525 1.00 15.91 ? 31 GLN D N 1 +ATOM 10083 C CA . GLN C 1 11 ? 57.977 56.081 143.575 1.00 16.44 ? 31 GLN D CA 1 +ATOM 10084 C C . GLN C 1 11 ? 58.359 56.691 144.909 1.00 16.57 ? 31 GLN D C 1 +ATOM 10085 O O . GLN C 1 11 ? 58.622 55.958 145.870 1.00 17.32 ? 31 GLN D O 1 +ATOM 10086 C CB . GLN C 1 11 ? 56.451 56.077 143.427 1.00 16.69 ? 31 GLN D CB 1 +ATOM 10087 C CG . GLN C 1 11 ? 55.730 55.304 144.536 1.00 17.16 ? 31 GLN D CG 1 +ATOM 10088 C CD . GLN C 1 11 ? 54.223 55.339 144.419 1.00 16.77 ? 31 GLN D CD 1 +ATOM 10089 O OE1 . GLN C 1 11 ? 53.521 55.713 145.372 1.00 16.33 ? 31 GLN D OE1 1 +ATOM 10090 N NE2 . GLN C 1 11 ? 53.710 54.936 143.260 1.00 16.53 ? 31 GLN D NE2 1 +ATOM 10091 N N . GLU C 1 12 ? 58.406 58.021 144.961 1.00 16.66 ? 32 GLU D N 1 +ATOM 10092 C CA . GLU C 1 12 ? 58.559 58.738 146.221 1.00 16.61 ? 32 GLU D CA 1 +ATOM 10093 C C . GLU C 1 12 ? 57.212 58.754 146.916 1.00 16.20 ? 32 GLU D C 1 +ATOM 10094 O O . GLU C 1 12 ? 56.171 58.801 146.260 1.00 16.12 ? 32 GLU D O 1 +ATOM 10095 C CB . GLU C 1 12 ? 59.031 60.187 146.004 1.00 17.36 ? 32 GLU D CB 1 +ATOM 10096 C CG . GLU C 1 12 ? 60.435 60.344 145.415 1.00 18.53 ? 32 GLU D CG 1 +ATOM 10097 C CD . GLU C 1 12 ? 60.458 60.341 143.901 1.00 21.68 ? 32 GLU D CD 1 +ATOM 10098 O OE1 . GLU C 1 12 ? 59.408 60.046 143.283 1.00 23.30 ? 32 GLU D OE1 1 +ATOM 10099 O OE2 . GLU C 1 12 ? 61.531 60.639 143.327 1.00 24.05 ? 32 GLU D OE2 1 +ATOM 10100 N N . SER C 1 13 ? 57.237 58.712 148.240 1.00 15.91 ? 33 SER D N 1 +ATOM 10101 C CA . SER C 1 13 ? 56.025 58.855 149.051 1.00 15.57 ? 33 SER D CA 1 +ATOM 10102 C C . SER C 1 13 ? 56.474 59.324 150.426 1.00 15.67 ? 33 SER D C 1 +ATOM 10103 O O . SER C 1 13 ? 57.682 59.424 150.683 1.00 14.71 ? 33 SER D O 1 +ATOM 10104 C CB . SER C 1 13 ? 55.257 57.523 149.119 1.00 15.64 ? 33 SER D CB 1 +ATOM 10105 O OG . SER C 1 13 ? 55.834 56.639 150.064 1.00 15.39 ? 33 SER D OG 1 +ATOM 10106 N N . PRO C 1 14 ? 55.522 59.655 151.314 1.00 15.47 ? 34 PRO D N 1 +ATOM 10107 C CA . PRO C 1 14 ? 55.913 59.995 152.678 1.00 15.88 ? 34 PRO D CA 1 +ATOM 10108 C C . PRO C 1 14 ? 56.862 58.990 153.347 1.00 15.78 ? 34 PRO D C 1 +ATOM 10109 O O . PRO C 1 14 ? 57.638 59.378 154.226 1.00 15.92 ? 34 PRO D O 1 +ATOM 10110 C CB . PRO C 1 14 ? 54.563 60.072 153.406 1.00 16.19 ? 34 PRO D CB 1 +ATOM 10111 C CG . PRO C 1 14 ? 53.617 60.469 152.371 1.00 16.29 ? 34 PRO D CG 1 +ATOM 10112 C CD . PRO C 1 14 ? 54.065 59.762 151.125 1.00 16.63 ? 34 PRO D CD 1 +ATOM 10113 N N . SER C 1 15 ? 56.836 57.721 152.912 1.00 15.10 ? 35 SER D N 1 +ATOM 10114 C CA . SER C 1 15 ? 57.660 56.661 153.504 1.00 14.71 ? 35 SER D CA 1 +ATOM 10115 C C . SER C 1 15 ? 58.801 56.145 152.612 1.00 14.26 ? 35 SER D C 1 +ATOM 10116 O O . SER C 1 15 ? 59.538 55.232 153.001 1.00 13.90 ? 35 SER D O 1 +ATOM 10117 C CB . SER C 1 15 ? 56.762 55.476 153.864 1.00 14.75 ? 35 SER D CB 1 +ATOM 10118 O OG . SER C 1 15 ? 56.144 54.945 152.705 1.00 14.81 ? 35 SER D OG 1 +ATOM 10119 N N . ARG C 1 16 ? 58.932 56.704 151.411 1.00 13.98 ? 36 ARG D N 1 +ATOM 10120 C CA . ARG C 1 16 ? 59.893 56.188 150.448 1.00 14.01 ? 36 ARG D CA 1 +ATOM 10121 C C . ARG C 1 16 ? 60.599 57.302 149.712 1.00 14.34 ? 36 ARG D C 1 +ATOM 10122 O O . ARG C 1 16 ? 59.950 58.244 149.259 1.00 13.36 ? 36 ARG D O 1 +ATOM 10123 C CB . ARG C 1 16 ? 59.179 55.319 149.432 1.00 13.93 ? 36 ARG D CB 1 +ATOM 10124 C CG . ARG C 1 16 ? 58.344 54.208 150.033 1.00 14.16 ? 36 ARG D CG 1 +ATOM 10125 C CD . ARG C 1 16 ? 57.891 53.249 148.958 1.00 15.13 ? 36 ARG D CD 1 +ATOM 10126 N NE . ARG C 1 16 ? 57.210 52.117 149.558 1.00 14.91 ? 36 ARG D NE 1 +ATOM 10127 C CZ . ARG C 1 16 ? 57.047 50.930 148.983 1.00 15.55 ? 36 ARG D CZ 1 +ATOM 10128 N NH1 . ARG C 1 16 ? 57.511 50.683 147.766 1.00 14.75 ? 36 ARG D NH1 1 +ATOM 10129 N NH2 . ARG C 1 16 ? 56.404 49.980 149.634 1.00 14.59 ? 36 ARG D NH2 1 +ATOM 10130 N N . GLU C 1 17 ? 61.923 57.162 149.586 1.00 14.60 ? 37 GLU D N 1 +ATOM 10131 C CA . GLU C 1 17 ? 62.761 58.052 148.786 1.00 15.56 ? 37 GLU D CA 1 +ATOM 10132 C C . GLU C 1 17 ? 63.311 57.293 147.579 1.00 16.12 ? 37 GLU D C 1 +ATOM 10133 O O . GLU C 1 17 ? 63.341 56.064 147.582 1.00 14.97 ? 37 GLU D O 1 +ATOM 10134 C CB . GLU C 1 17 ? 63.939 58.565 149.621 1.00 15.68 ? 37 GLU D CB 1 +ATOM 10135 C CG . GLU C 1 17 ? 63.542 59.210 150.941 1.00 16.34 ? 37 GLU D CG 1 +ATOM 10136 C CD . GLU C 1 17 ? 64.740 59.610 151.783 1.00 16.80 ? 37 GLU D CD 1 +ATOM 10137 O OE1 . GLU C 1 17 ? 65.803 59.919 151.206 1.00 19.71 ? 37 GLU D OE1 1 +ATOM 10138 O OE2 . GLU C 1 17 ? 64.618 59.634 153.027 1.00 18.75 ? 37 GLU D OE2 1 +ATOM 10139 N N . CYS C 1 18 ? 63.730 58.030 146.552 1.00 16.59 ? 38 CYS D N 1 +ATOM 10140 C CA . CYS C 1 18 ? 64.391 57.437 145.382 1.00 17.78 ? 38 CYS D CA 1 +ATOM 10141 C C . CYS C 1 18 ? 65.627 58.236 145.030 1.00 17.61 ? 38 CYS D C 1 +ATOM 10142 O O . CYS C 1 18 ? 65.570 59.466 145.002 1.00 18.34 ? 38 CYS D O 1 +ATOM 10143 C CB . CYS C 1 18 ? 63.472 57.441 144.168 1.00 18.11 ? 38 CYS D CB 1 +ATOM 10144 S SG . CYS C 1 18 ? 61.964 56.509 144.350 1.00 21.82 ? 38 CYS D SG 1 +ATOM 10145 N N . LYS C 1 19 ? 66.728 57.539 144.756 1.00 17.67 ? 39 LYS D N 1 +ATOM 10146 C CA . LYS C 1 19 ? 67.958 58.164 144.272 1.00 17.12 ? 39 LYS D CA 1 +ATOM 10147 C C . LYS C 1 19 ? 68.362 57.542 142.944 1.00 16.83 ? 39 LYS D C 1 +ATOM 10148 O O . LYS C 1 19 ? 68.813 56.405 142.906 1.00 16.38 ? 39 LYS D O 1 +ATOM 10149 C CB . LYS C 1 19 ? 69.097 58.010 145.276 1.00 17.11 ? 39 LYS D CB 1 +ATOM 10150 C CG . LYS C 1 19 ? 70.404 58.624 144.786 1.00 16.94 ? 39 LYS D CG 1 +ATOM 10151 C CD . LYS C 1 19 ? 71.435 58.773 145.884 1.00 18.28 ? 39 LYS D CD 1 +ATOM 10152 C CE . LYS C 1 19 ? 72.662 59.579 145.428 1.00 18.08 ? 39 LYS D CE 1 +ATOM 10153 N NZ . LYS C 1 19 ? 72.352 60.997 145.049 1.00 19.62 ? 39 LYS D NZ 1 +ATOM 10154 N N . GLU C 1 20 ? 68.198 58.303 141.862 1.00 16.77 ? 40 GLU D N 1 +ATOM 10155 C CA . GLU C 1 20 ? 68.579 57.879 140.513 1.00 16.69 ? 40 GLU D CA 1 +ATOM 10156 C C . GLU C 1 20 ? 70.098 57.800 140.373 1.00 16.03 ? 40 GLU D C 1 +ATOM 10157 O O . GLU C 1 20 ? 70.818 58.671 140.850 1.00 15.87 ? 40 GLU D O 1 +ATOM 10158 C CB . GLU C 1 20 ? 68.050 58.880 139.465 1.00 17.43 ? 40 GLU D CB 1 +ATOM 10159 C CG . GLU C 1 20 ? 66.527 58.969 139.358 1.00 18.84 ? 40 GLU D CG 1 +ATOM 10160 C CD . GLU C 1 20 ? 65.902 59.860 140.417 1.00 21.62 ? 40 GLU D CD 1 +ATOM 10161 O OE1 . GLU C 1 20 ? 66.649 60.436 141.235 1.00 22.92 ? 40 GLU D OE1 1 +ATOM 10162 O OE2 . GLU C 1 20 ? 64.658 59.988 140.428 1.00 25.37 ? 40 GLU D OE2 1 +ATOM 10163 N N . LEU C 1 21 ? 70.582 56.746 139.717 1.00 15.46 ? 41 LEU D N 1 +ATOM 10164 C CA . LEU C 1 21 ? 72.008 56.612 139.430 1.00 15.04 ? 41 LEU D CA 1 +ATOM 10165 C C . LEU C 1 21 ? 72.286 56.767 137.931 1.00 15.07 ? 41 LEU D C 1 +ATOM 10166 O O . LEU C 1 21 ? 73.161 56.092 137.381 1.00 15.54 ? 41 LEU D O 1 +ATOM 10167 C CB . LEU C 1 21 ? 72.543 55.283 139.965 1.00 14.78 ? 41 LEU D CB 1 +ATOM 10168 C CG . LEU C 1 21 ? 72.361 55.045 141.465 1.00 14.97 ? 41 LEU D CG 1 +ATOM 10169 C CD1 . LEU C 1 21 ? 72.984 53.720 141.871 1.00 15.34 ? 41 LEU D CD1 1 +ATOM 10170 C CD2 . LEU C 1 21 ? 72.941 56.214 142.285 1.00 16.49 ? 41 LEU D CD2 1 +ATOM 10171 N N . ASP C 1 22 ? 71.560 57.680 137.286 1.00 15.15 ? 42 ASP D N 1 +ATOM 10172 C CA . ASP C 1 22 ? 71.783 58.006 135.875 1.00 15.18 ? 42 ASP D CA 1 +ATOM 10173 C C . ASP C 1 22 ? 73.091 58.749 135.703 1.00 14.35 ? 42 ASP D C 1 +ATOM 10174 O O . ASP C 1 22 ? 73.592 59.359 136.640 1.00 15.14 ? 42 ASP D O 1 +ATOM 10175 C CB . ASP C 1 22 ? 70.655 58.879 135.315 1.00 16.03 ? 42 ASP D CB 1 +ATOM 10176 C CG . ASP C 1 22 ? 69.361 58.116 135.076 1.00 17.91 ? 42 ASP D CG 1 +ATOM 10177 O OD1 . ASP C 1 22 ? 69.236 56.954 135.505 1.00 20.74 ? 42 ASP D OD1 1 +ATOM 10178 O OD2 . ASP C 1 22 ? 68.455 58.699 134.436 1.00 22.11 ? 42 ASP D OD2 1 +ATOM 10179 N N . GLY C 1 23 ? 73.632 58.711 134.491 1.00 13.13 ? 43 GLY D N 1 +ATOM 10180 C CA . GLY C 1 23 ? 74.858 59.431 134.170 1.00 12.31 ? 43 GLY D CA 1 +ATOM 10181 C C . GLY C 1 23 ? 76.014 58.518 133.847 1.00 11.54 ? 43 GLY D C 1 +ATOM 10182 O O . GLY C 1 23 ? 75.818 57.434 133.270 1.00 11.51 ? 43 GLY D O 1 +ATOM 10183 N N . LEU C 1 24 ? 77.218 58.958 134.205 1.00 10.81 ? 44 LEU D N 1 +ATOM 10184 C CA . LEU C 1 24 ? 78.436 58.255 133.824 1.00 10.69 ? 44 LEU D CA 1 +ATOM 10185 C C . LEU C 1 24 ? 78.761 57.086 134.758 1.00 10.33 ? 44 LEU D C 1 +ATOM 10186 O O . LEU C 1 24 ? 78.789 57.241 135.979 1.00 10.03 ? 44 LEU D O 1 +ATOM 10187 C CB . LEU C 1 24 ? 79.634 59.211 133.805 1.00 11.00 ? 44 LEU D CB 1 +ATOM 10188 C CG . LEU C 1 24 ? 79.533 60.423 132.870 1.00 11.07 ? 44 LEU D CG 1 +ATOM 10189 C CD1 . LEU C 1 24 ? 80.739 61.319 133.051 1.00 12.96 ? 44 LEU D CD1 1 +ATOM 10190 C CD2 . LEU C 1 24 ? 79.359 60.025 131.394 1.00 10.02 ? 44 LEU D CD2 1 +ATOM 10191 N N . TRP C 1 25 ? 79.021 55.928 134.178 1.00 10.25 ? 45 TRP D N 1 +ATOM 10192 C CA . TRP C 1 25 ? 79.560 54.803 134.915 1.00 9.83 ? 45 TRP D CA 1 +ATOM 10193 C C . TRP C 1 25 ? 80.903 54.436 134.289 1.00 10.37 ? 45 TRP D C 1 +ATOM 10194 O O . TRP C 1 25 ? 81.147 54.729 133.125 1.00 10.76 ? 45 TRP D O 1 +ATOM 10195 C CB . TRP C 1 25 ? 78.629 53.593 134.802 1.00 9.59 ? 45 TRP D CB 1 +ATOM 10196 C CG . TRP C 1 25 ? 77.338 53.703 135.567 1.00 9.94 ? 45 TRP D CG 1 +ATOM 10197 C CD1 . TRP C 1 25 ? 76.403 54.693 135.480 1.00 9.60 ? 45 TRP D CD1 1 +ATOM 10198 C CD2 . TRP C 1 25 ? 76.830 52.746 136.497 1.00 9.15 ? 45 TRP D CD2 1 +ATOM 10199 N NE1 . TRP C 1 25 ? 75.348 54.421 136.327 1.00 8.72 ? 45 TRP D NE1 1 +ATOM 10200 C CE2 . TRP C 1 25 ? 75.589 53.226 136.959 1.00 9.71 ? 45 TRP D CE2 1 +ATOM 10201 C CE3 . TRP C 1 25 ? 77.314 51.525 136.998 1.00 9.21 ? 45 TRP D CE3 1 +ATOM 10202 C CZ2 . TRP C 1 25 ? 74.822 52.527 137.900 1.00 9.74 ? 45 TRP D CZ2 1 +ATOM 10203 C CZ3 . TRP C 1 25 ? 76.573 50.852 137.930 1.00 9.20 ? 45 TRP D CZ3 1 +ATOM 10204 C CH2 . TRP C 1 25 ? 75.325 51.342 138.367 1.00 9.30 ? 45 TRP D CH2 1 +ATOM 10205 N N . SER C 1 26 ? 81.764 53.772 135.050 1.00 10.53 ? 46 SER D N 1 +ATOM 10206 C CA . SER C 1 26 ? 83.012 53.243 134.505 1.00 10.43 ? 46 SER D CA 1 +ATOM 10207 C C . SER C 1 26 ? 82.712 51.920 133.808 1.00 10.12 ? 46 SER D C 1 +ATOM 10208 O O . SER C 1 26 ? 81.854 51.169 134.265 1.00 10.08 ? 46 SER D O 1 +ATOM 10209 C CB . SER C 1 26 ? 84.042 53.006 135.610 1.00 11.12 ? 46 SER D CB 1 +ATOM 10210 O OG . SER C 1 26 ? 84.523 54.233 136.124 1.00 14.61 ? 46 SER D OG 1 +ATOM 10211 N N . PHE C 1 27 ? 83.445 51.633 132.733 1.00 9.44 ? 47 PHE D N 1 +ATOM 10212 C CA . PHE C 1 27 ? 83.100 50.536 131.835 1.00 9.49 ? 47 PHE D CA 1 +ATOM 10213 C C . PHE C 1 27 ? 84.331 49.872 131.229 1.00 9.77 ? 47 PHE D C 1 +ATOM 10214 O O . PHE C 1 27 ? 85.279 50.549 130.806 1.00 9.70 ? 47 PHE D O 1 +ATOM 10215 C CB . PHE C 1 27 ? 82.168 51.071 130.731 1.00 8.98 ? 47 PHE D CB 1 +ATOM 10216 C CG . PHE C 1 27 ? 81.770 50.059 129.675 1.00 8.79 ? 47 PHE D CG 1 +ATOM 10217 C CD1 . PHE C 1 27 ? 82.608 49.797 128.603 1.00 9.01 ? 47 PHE D CD1 1 +ATOM 10218 C CD2 . PHE C 1 27 ? 80.524 49.436 129.710 1.00 7.90 ? 47 PHE D CD2 1 +ATOM 10219 C CE1 . PHE C 1 27 ? 82.228 48.910 127.613 1.00 8.86 ? 47 PHE D CE1 1 +ATOM 10220 C CE2 . PHE C 1 27 ? 80.146 48.546 128.715 1.00 7.77 ? 47 PHE D CE2 1 +ATOM 10221 C CZ . PHE C 1 27 ? 80.999 48.274 127.684 1.00 8.83 ? 47 PHE D CZ 1 +ATOM 10222 N N . ARG C 1 28 ? 84.276 48.548 131.152 1.00 10.31 ? 48 ARG D N 1 +ATOM 10223 C CA . ARG C 1 28 ? 85.257 47.772 130.426 1.00 10.73 ? 48 ARG D CA 1 +ATOM 10224 C C . ARG C 1 28 ? 84.639 46.501 129.853 1.00 10.47 ? 48 ARG D C 1 +ATOM 10225 O O . ARG C 1 28 ? 83.979 45.763 130.574 1.00 9.90 ? 48 ARG D O 1 +ATOM 10226 C CB . ARG C 1 28 ? 86.400 47.406 131.356 1.00 11.27 ? 48 ARG D CB 1 +ATOM 10227 C CG . ARG C 1 28 ? 87.588 46.811 130.649 1.00 14.68 ? 48 ARG D CG 1 +ATOM 10228 C CD A ARG C 1 28 ? 88.602 46.340 131.684 0.50 16.70 ? 48 ARG D CD 1 +ATOM 10229 C CD B ARG C 1 28 ? 88.557 46.191 131.625 0.50 15.96 ? 48 ARG D CD 1 +ATOM 10230 N NE A ARG C 1 28 ? 89.607 45.456 131.118 0.50 18.32 ? 48 ARG D NE 1 +ATOM 10231 N NE B ARG C 1 28 ? 88.998 47.154 132.623 0.50 16.84 ? 48 ARG D NE 1 +ATOM 10232 C CZ A ARG C 1 28 ? 90.554 44.842 131.820 0.50 18.52 ? 48 ARG D CZ 1 +ATOM 10233 C CZ B ARG C 1 28 ? 89.423 46.849 133.842 0.50 17.41 ? 48 ARG D CZ 1 +ATOM 10234 N NH1 A ARG C 1 28 ? 90.638 45.010 133.135 0.50 19.03 ? 48 ARG D NH1 1 +ATOM 10235 N NH1 B ARG C 1 28 ? 89.462 45.589 134.260 0.50 18.11 ? 48 ARG D NH1 1 +ATOM 10236 N NH2 A ARG C 1 28 ? 91.415 44.045 131.200 0.50 19.86 ? 48 ARG D NH2 1 +ATOM 10237 N NH2 B ARG C 1 28 ? 89.807 47.821 134.646 0.50 16.31 ? 48 ARG D NH2 1 +ATOM 10238 N N . ALA C 1 29 ? 84.844 46.272 128.559 1.00 9.82 ? 49 ALA D N 1 +ATOM 10239 C CA . ALA C 1 29 ? 84.518 44.977 127.958 1.00 9.83 ? 49 ALA D CA 1 +ATOM 10240 C C . ALA C 1 29 ? 85.681 44.034 128.220 1.00 9.55 ? 49 ALA D C 1 +ATOM 10241 O O . ALA C 1 29 ? 86.843 44.428 128.099 1.00 10.65 ? 49 ALA D O 1 +ATOM 10242 C CB . ALA C 1 29 ? 84.283 45.120 126.481 1.00 9.41 ? 49 ALA D CB 1 +ATOM 10243 N N . ASP C 1 30 ? 85.380 42.790 128.568 1.00 10.46 ? 50 ASP D N 1 +ATOM 10244 C CA . ASP C 1 30 ? 86.429 41.796 128.764 1.00 10.25 ? 50 ASP D CA 1 +ATOM 10245 C C . ASP C 1 30 ? 86.693 41.045 127.455 1.00 10.88 ? 50 ASP D C 1 +ATOM 10246 O O . ASP C 1 30 ? 85.968 40.099 127.104 1.00 10.22 ? 50 ASP D O 1 +ATOM 10247 C CB . ASP C 1 30 ? 86.049 40.849 129.902 1.00 10.83 ? 50 ASP D CB 1 +ATOM 10248 C CG . ASP C 1 30 ? 87.099 39.778 130.156 1.00 10.33 ? 50 ASP D CG 1 +ATOM 10249 O OD1 . ASP C 1 30 ? 88.135 39.738 129.443 1.00 9.38 ? 50 ASP D OD1 1 +ATOM 10250 O OD2 . ASP C 1 30 ? 86.875 38.976 131.087 1.00 12.67 ? 50 ASP D OD2 1 +ATOM 10251 N N . PHE C 1 31 ? 87.736 41.477 126.743 1.00 10.86 ? 51 PHE D N 1 +ATOM 10252 C CA . PHE C 1 31 ? 88.108 40.893 125.452 1.00 11.78 ? 51 PHE D CA 1 +ATOM 10253 C C . PHE C 1 31 ? 89.035 39.665 125.569 1.00 11.98 ? 51 PHE D C 1 +ATOM 10254 O O . PHE C 1 31 ? 89.567 39.215 124.562 1.00 12.27 ? 51 PHE D O 1 +ATOM 10255 C CB . PHE C 1 31 ? 88.778 41.938 124.551 1.00 12.60 ? 51 PHE D CB 1 +ATOM 10256 C CG . PHE C 1 31 ? 87.888 43.092 124.178 1.00 13.21 ? 51 PHE D CG 1 +ATOM 10257 C CD1 . PHE C 1 31 ? 86.790 42.893 123.355 1.00 14.34 ? 51 PHE D CD1 1 +ATOM 10258 C CD2 . PHE C 1 31 ? 88.158 44.386 124.638 1.00 15.00 ? 51 PHE D CD2 1 +ATOM 10259 C CE1 . PHE C 1 31 ? 85.968 43.960 123.000 1.00 14.36 ? 51 PHE D CE1 1 +ATOM 10260 C CE2 . PHE C 1 31 ? 87.347 45.450 124.282 1.00 15.76 ? 51 PHE D CE2 1 +ATOM 10261 C CZ . PHE C 1 31 ? 86.248 45.233 123.464 1.00 14.44 ? 51 PHE D CZ 1 +ATOM 10262 N N . SER C 1 32 ? 89.202 39.104 126.766 1.00 11.92 ? 52 SER D N 1 +ATOM 10263 C CA . SER C 1 32 ? 89.996 37.873 126.928 1.00 11.66 ? 52 SER D CA 1 +ATOM 10264 C C . SER C 1 32 ? 89.438 36.734 126.094 1.00 11.98 ? 52 SER D C 1 +ATOM 10265 O O . SER C 1 32 ? 88.223 36.603 125.935 1.00 11.38 ? 52 SER D O 1 +ATOM 10266 C CB . SER C 1 32 ? 90.067 37.447 128.390 1.00 11.56 ? 52 SER D CB 1 +ATOM 10267 O OG . SER C 1 32 ? 88.783 37.162 128.925 1.00 11.68 ? 52 SER D OG 1 +ATOM 10268 N N . ASP C 1 33 ? 90.327 35.903 125.564 1.00 12.06 ? 53 ASP D N 1 +ATOM 10269 C CA . ASP C 1 33 ? 89.917 34.828 124.666 1.00 12.70 ? 53 ASP D CA 1 +ATOM 10270 C C . ASP C 1 33 ? 88.820 33.970 125.270 1.00 12.51 ? 53 ASP D C 1 +ATOM 10271 O O . ASP C 1 33 ? 87.819 33.705 124.611 1.00 12.80 ? 53 ASP D O 1 +ATOM 10272 C CB . ASP C 1 33 ? 91.132 33.992 124.238 1.00 12.83 ? 53 ASP D CB 1 +ATOM 10273 C CG . ASP C 1 33 ? 92.090 34.772 123.333 1.00 14.88 ? 53 ASP D CG 1 +ATOM 10274 O OD1 . ASP C 1 33 ? 91.711 35.858 122.847 1.00 17.27 ? 53 ASP D OD1 1 +ATOM 10275 O OD2 . ASP C 1 33 ? 93.227 34.302 123.113 1.00 17.76 ? 53 ASP D OD2 1 +ATOM 10276 N N . ASN C 1 34 ? 88.964 33.573 126.530 1.00 12.32 ? 54 ASN D N 1 +ATOM 10277 C CA . ASN C 1 34 ? 87.930 32.761 127.169 1.00 12.20 ? 54 ASN D CA 1 +ATOM 10278 C C . ASN C 1 34 ? 86.821 33.587 127.813 1.00 11.89 ? 54 ASN D C 1 +ATOM 10279 O O . ASN C 1 34 ? 85.930 33.033 128.443 1.00 12.00 ? 54 ASN D O 1 +ATOM 10280 C CB . ASN C 1 34 ? 88.519 31.749 128.158 1.00 12.31 ? 54 ASN D CB 1 +ATOM 10281 C CG . ASN C 1 34 ? 89.018 32.381 129.448 1.00 12.90 ? 54 ASN D CG 1 +ATOM 10282 O OD1 . ASN C 1 34 ? 88.834 33.571 129.698 1.00 12.01 ? 54 ASN D OD1 1 +ATOM 10283 N ND2 . ASN C 1 34 ? 89.651 31.554 130.293 1.00 14.33 ? 54 ASN D ND2 1 +ATOM 10284 N N . ARG C 1 35 ? 86.882 34.906 127.634 1.00 11.73 ? 55 ARG D N 1 +ATOM 10285 C CA . ARG C 1 35 ? 85.841 35.821 128.101 1.00 11.30 ? 55 ARG D CA 1 +ATOM 10286 C C . ARG C 1 35 ? 85.646 35.848 129.637 1.00 11.50 ? 55 ARG D C 1 +ATOM 10287 O O . ARG C 1 35 ? 84.678 36.429 130.132 1.00 10.28 ? 55 ARG D O 1 +ATOM 10288 C CB . ARG C 1 35 ? 84.517 35.521 127.357 1.00 11.12 ? 55 ARG D CB 1 +ATOM 10289 C CG . ARG C 1 35 ? 84.598 35.729 125.828 1.00 10.63 ? 55 ARG D CG 1 +ATOM 10290 C CD . ARG C 1 35 ? 84.881 37.202 125.473 1.00 12.44 ? 55 ARG D CD 1 +ATOM 10291 N NE . ARG C 1 35 ? 84.685 37.557 124.064 1.00 12.26 ? 55 ARG D NE 1 +ATOM 10292 C CZ . ARG C 1 35 ? 85.585 37.395 123.090 1.00 14.87 ? 55 ARG D CZ 1 +ATOM 10293 N NH1 . ARG C 1 35 ? 86.781 36.866 123.327 1.00 14.65 ? 55 ARG D NH1 1 +ATOM 10294 N NH2 . ARG C 1 35 ? 85.286 37.762 121.849 1.00 15.59 ? 55 ARG D NH2 1 +ATOM 10295 N N . ARG C 1 36 ? 86.590 35.264 130.382 1.00 11.74 ? 56 ARG D N 1 +ATOM 10296 C CA . ARG C 1 36 ? 86.451 35.107 131.827 1.00 12.33 ? 56 ARG D CA 1 +ATOM 10297 C C . ARG C 1 36 ? 87.563 35.747 132.663 1.00 11.89 ? 56 ARG D C 1 +ATOM 10298 O O . ARG C 1 36 ? 87.588 35.560 133.881 1.00 10.88 ? 56 ARG D O 1 +ATOM 10299 C CB . ARG C 1 36 ? 86.404 33.619 132.184 1.00 12.79 ? 56 ARG D CB 1 +ATOM 10300 C CG . ARG C 1 36 ? 85.178 32.888 131.710 1.00 14.93 ? 56 ARG D CG 1 +ATOM 10301 C CD . ARG C 1 36 ? 85.125 31.487 132.300 1.00 15.11 ? 56 ARG D CD 1 +ATOM 10302 N NE . ARG C 1 36 ? 86.192 30.620 131.806 1.00 16.56 ? 56 ARG D NE 1 +ATOM 10303 C CZ . ARG C 1 36 ? 86.206 30.018 130.616 1.00 16.02 ? 56 ARG D CZ 1 +ATOM 10304 N NH1 . ARG C 1 36 ? 85.212 30.169 129.758 1.00 15.49 ? 56 ARG D NH1 1 +ATOM 10305 N NH2 . ARG C 1 36 ? 87.231 29.257 130.287 1.00 16.48 ? 56 ARG D NH2 1 +ATOM 10306 N N . ARG C 1 37 ? 88.477 36.490 132.037 1.00 11.93 ? 57 ARG D N 1 +ATOM 10307 C CA . ARG C 1 37 ? 89.600 37.096 132.783 1.00 12.46 ? 57 ARG D CA 1 +ATOM 10308 C C . ARG C 1 37 ? 89.136 37.951 133.970 1.00 12.17 ? 57 ARG D C 1 +ATOM 10309 O O . ARG C 1 37 ? 89.767 37.934 135.028 1.00 12.02 ? 57 ARG D O 1 +ATOM 10310 C CB . ARG C 1 37 ? 90.499 37.916 131.862 1.00 12.56 ? 57 ARG D CB 1 +ATOM 10311 C CG . ARG C 1 37 ? 91.751 38.481 132.527 1.00 15.72 ? 57 ARG D CG 1 +ATOM 10312 C CD . ARG C 1 37 ? 92.781 38.864 131.466 1.00 19.44 ? 57 ARG D CD 1 +ATOM 10313 N NE . ARG C 1 37 ? 93.311 37.668 130.814 1.00 21.84 ? 57 ARG D NE 1 +ATOM 10314 C CZ . ARG C 1 37 ? 93.718 37.589 129.546 1.00 23.56 ? 57 ARG D CZ 1 +ATOM 10315 N NH1 . ARG C 1 37 ? 93.669 38.634 128.726 1.00 23.89 ? 57 ARG D NH1 1 +ATOM 10316 N NH2 . ARG C 1 37 ? 94.176 36.431 129.088 1.00 24.37 ? 57 ARG D NH2 1 +ATOM 10317 N N . GLY C 1 38 ? 88.023 38.668 133.815 1.00 11.65 ? 58 GLY D N 1 +ATOM 10318 C CA . GLY C 1 38 ? 87.463 39.465 134.907 1.00 11.37 ? 58 GLY D CA 1 +ATOM 10319 C C . GLY C 1 38 ? 87.097 38.668 136.149 1.00 11.81 ? 58 GLY D C 1 +ATOM 10320 O O . GLY C 1 38 ? 87.194 39.176 137.264 1.00 11.97 ? 58 GLY D O 1 +ATOM 10321 N N . PHE C 1 39 ? 86.664 37.423 135.945 1.00 11.91 ? 59 PHE D N 1 +ATOM 10322 C CA . PHE C 1 39 ? 86.350 36.517 137.046 1.00 12.47 ? 59 PHE D CA 1 +ATOM 10323 C C . PHE C 1 39 ? 87.612 35.837 137.561 1.00 12.80 ? 59 PHE D C 1 +ATOM 10324 O O . PHE C 1 39 ? 87.724 35.560 138.756 1.00 13.50 ? 59 PHE D O 1 +ATOM 10325 C CB . PHE C 1 39 ? 85.317 35.495 136.598 1.00 12.60 ? 59 PHE D CB 1 +ATOM 10326 C CG . PHE C 1 39 ? 84.000 36.115 136.262 1.00 12.78 ? 59 PHE D CG 1 +ATOM 10327 C CD1 . PHE C 1 39 ? 83.105 36.432 137.266 1.00 12.78 ? 59 PHE D CD1 1 +ATOM 10328 C CD2 . PHE C 1 39 ? 83.670 36.429 134.953 1.00 13.60 ? 59 PHE D CD2 1 +ATOM 10329 C CE1 . PHE C 1 39 ? 81.880 37.043 136.969 1.00 12.87 ? 59 PHE D CE1 1 +ATOM 10330 C CE2 . PHE C 1 39 ? 82.449 37.029 134.658 1.00 13.74 ? 59 PHE D CE2 1 +ATOM 10331 C CZ . PHE C 1 39 ? 81.558 37.336 135.681 1.00 12.77 ? 59 PHE D CZ 1 +ATOM 10332 N N . GLU C 1 40 ? 88.567 35.590 136.674 1.00 13.14 ? 60 GLU D N 1 +ATOM 10333 C CA . GLU C 1 40 ? 89.843 34.990 137.087 1.00 13.55 ? 60 GLU D CA 1 +ATOM 10334 C C . GLU C 1 40 ? 90.661 35.936 137.957 1.00 13.90 ? 60 GLU D C 1 +ATOM 10335 O O . GLU C 1 40 ? 91.197 35.525 138.999 1.00 14.35 ? 60 GLU D O 1 +ATOM 10336 C CB . GLU C 1 40 ? 90.654 34.560 135.865 1.00 13.63 ? 60 GLU D CB 1 +ATOM 10337 C CG . GLU C 1 40 ? 90.020 33.448 135.067 1.00 14.41 ? 60 GLU D CG 1 +ATOM 10338 C CD . GLU C 1 40 ? 90.680 33.236 133.709 1.00 14.57 ? 60 GLU D CD 1 +ATOM 10339 O OE1 . GLU C 1 40 ? 91.463 34.110 133.267 1.00 15.84 ? 60 GLU D OE1 1 +ATOM 10340 O OE2 . GLU C 1 40 ? 90.401 32.199 133.078 1.00 15.37 ? 60 GLU D OE2 1 +ATOM 10341 N N . GLU C 1 41 ? 90.732 37.202 137.546 1.00 13.45 ? 61 GLU D N 1 +ATOM 10342 C CA . GLU C 1 41 ? 91.411 38.239 138.313 1.00 13.88 ? 61 GLU D CA 1 +ATOM 10343 C C . GLU C 1 41 ? 90.504 38.881 139.377 1.00 13.74 ? 61 GLU D C 1 +ATOM 10344 O O . GLU C 1 41 ? 90.953 39.735 140.148 1.00 14.51 ? 61 GLU D O 1 +ATOM 10345 C CB . GLU C 1 41 ? 91.944 39.318 137.358 1.00 14.04 ? 61 GLU D CB 1 +ATOM 10346 C CG . GLU C 1 41 ? 92.979 38.795 136.366 1.00 13.48 ? 61 GLU D CG 1 +ATOM 10347 C CD . GLU C 1 41 ? 93.498 39.856 135.412 1.00 14.36 ? 61 GLU D CD 1 +ATOM 10348 O OE1 . GLU C 1 41 ? 92.904 40.951 135.345 1.00 14.10 ? 61 GLU D OE1 1 +ATOM 10349 O OE2 . GLU C 1 41 ? 94.503 39.596 134.708 1.00 14.31 ? 61 GLU D OE2 1 +ATOM 10350 N N . GLN C 1 42 ? 89.224 38.506 139.403 1.00 13.09 ? 62 GLN D N 1 +ATOM 10351 C CA . GLN C 1 42 ? 88.278 39.056 140.369 1.00 13.26 ? 62 GLN D CA 1 +ATOM 10352 C C . GLN C 1 42 ? 88.285 40.590 140.380 1.00 12.95 ? 62 GLN D C 1 +ATOM 10353 O O . GLN C 1 42 ? 88.534 41.222 141.414 1.00 12.94 ? 62 GLN D O 1 +ATOM 10354 C CB . GLN C 1 42 ? 88.546 38.490 141.770 1.00 13.24 ? 62 GLN D CB 1 +ATOM 10355 C CG . GLN C 1 42 ? 88.611 36.965 141.795 1.00 13.96 ? 62 GLN D CG 1 +ATOM 10356 C CD . GLN C 1 42 ? 88.606 36.376 143.200 1.00 13.98 ? 62 GLN D CD 1 +ATOM 10357 O OE1 . GLN C 1 42 ? 88.552 37.099 144.196 1.00 17.20 ? 62 GLN D OE1 1 +ATOM 10358 N NE2 . GLN C 1 42 ? 88.648 35.057 143.282 1.00 14.54 ? 62 GLN D NE2 1 +ATOM 10359 N N . TRP C 1 43 ? 87.994 41.185 139.223 1.00 12.98 ? 63 TRP D N 1 +ATOM 10360 C CA . TRP C 1 43 ? 87.992 42.648 139.088 1.00 12.84 ? 63 TRP D CA 1 +ATOM 10361 C C . TRP C 1 43 ? 87.109 43.332 140.136 1.00 13.56 ? 63 TRP D C 1 +ATOM 10362 O O . TRP C 1 43 ? 87.415 44.439 140.604 1.00 13.60 ? 63 TRP D O 1 +ATOM 10363 C CB . TRP C 1 43 ? 87.544 43.074 137.679 1.00 12.86 ? 63 TRP D CB 1 +ATOM 10364 C CG . TRP C 1 43 ? 88.476 42.664 136.568 1.00 11.84 ? 63 TRP D CG 1 +ATOM 10365 C CD1 . TRP C 1 43 ? 89.767 42.213 136.694 1.00 11.49 ? 63 TRP D CD1 1 +ATOM 10366 C CD2 . TRP C 1 43 ? 88.214 42.726 135.157 1.00 11.46 ? 63 TRP D CD2 1 +ATOM 10367 N NE1 . TRP C 1 43 ? 90.298 41.955 135.457 1.00 10.90 ? 63 TRP D NE1 1 +ATOM 10368 C CE2 . TRP C 1 43 ? 89.372 42.260 134.496 1.00 10.78 ? 63 TRP D CE2 1 +ATOM 10369 C CE3 . TRP C 1 43 ? 87.108 43.108 134.387 1.00 11.31 ? 63 TRP D CE3 1 +ATOM 10370 C CZ2 . TRP C 1 43 ? 89.456 42.176 133.105 1.00 12.27 ? 63 TRP D CZ2 1 +ATOM 10371 C CZ3 . TRP C 1 43 ? 87.195 43.022 133.006 1.00 11.38 ? 63 TRP D CZ3 1 +ATOM 10372 C CH2 . TRP C 1 43 ? 88.358 42.564 132.380 1.00 11.53 ? 63 TRP D CH2 1 +ATOM 10373 N N . TYR C 1 44 ? 86.012 42.668 140.494 1.00 13.95 ? 64 TYR D N 1 +ATOM 10374 C CA . TYR C 1 44 ? 85.045 43.206 141.452 1.00 14.33 ? 64 TYR D CA 1 +ATOM 10375 C C . TYR C 1 44 ? 85.582 43.459 142.867 1.00 15.19 ? 64 TYR D C 1 +ATOM 10376 O O . TYR C 1 44 ? 84.930 44.152 143.636 1.00 15.38 ? 64 TYR D O 1 +ATOM 10377 C CB . TYR C 1 44 ? 83.834 42.279 141.546 1.00 14.77 ? 64 TYR D CB 1 +ATOM 10378 C CG . TYR C 1 44 ? 84.193 40.832 141.818 1.00 14.47 ? 64 TYR D CG 1 +ATOM 10379 C CD1 . TYR C 1 44 ? 84.242 39.902 140.784 1.00 13.89 ? 64 TYR D CD1 1 +ATOM 10380 C CD2 . TYR C 1 44 ? 84.496 40.398 143.107 1.00 15.33 ? 64 TYR D CD2 1 +ATOM 10381 C CE1 . TYR C 1 44 ? 84.576 38.572 141.016 1.00 15.02 ? 64 TYR D CE1 1 +ATOM 10382 C CE2 . TYR C 1 44 ? 84.827 39.069 143.356 1.00 15.33 ? 64 TYR D CE2 1 +ATOM 10383 C CZ . TYR C 1 44 ? 84.869 38.163 142.303 1.00 15.82 ? 64 TYR D CZ 1 +ATOM 10384 O OH . TYR C 1 44 ? 85.189 36.846 142.517 1.00 16.57 ? 64 TYR D OH 1 +ATOM 10385 N N . ARG C 1 45 ? 86.740 42.901 143.226 1.00 16.22 ? 65 ARG D N 1 +ATOM 10386 C CA . ARG C 1 45 ? 87.274 43.084 144.587 1.00 17.07 ? 65 ARG D CA 1 +ATOM 10387 C C . ARG C 1 45 ? 87.750 44.510 144.847 1.00 17.15 ? 65 ARG D C 1 +ATOM 10388 O O . ARG C 1 45 ? 87.895 44.921 146.008 1.00 17.36 ? 65 ARG D O 1 +ATOM 10389 C CB . ARG C 1 45 ? 88.466 42.171 144.876 1.00 17.39 ? 65 ARG D CB 1 +ATOM 10390 C CG . ARG C 1 45 ? 88.287 40.682 144.585 1.00 19.41 ? 65 ARG D CG 1 +ATOM 10391 C CD A ARG C 1 45 ? 88.647 39.810 145.787 0.50 21.07 ? 65 ARG D CD 1 +ATOM 10392 C CD B ARG C 1 45 ? 88.648 39.844 145.816 0.50 20.67 ? 65 ARG D CD 1 +ATOM 10393 N NE A ARG C 1 45 ? 87.450 39.378 146.509 0.50 21.34 ? 65 ARG D NE 1 +ATOM 10394 N NE B ARG C 1 45 ? 89.837 40.350 146.506 0.50 20.54 ? 65 ARG D NE 1 +ATOM 10395 C CZ A ARG C 1 45 ? 87.442 38.876 147.743 0.50 21.95 ? 65 ARG D CZ 1 +ATOM 10396 C CZ B ARG C 1 45 ? 90.095 40.194 147.807 0.50 20.92 ? 65 ARG D CZ 1 +ATOM 10397 N NH1 A ARG C 1 45 ? 86.289 38.521 148.299 0.50 21.70 ? 65 ARG D NH1 1 +ATOM 10398 N NH1 B ARG C 1 45 ? 91.204 40.708 148.319 0.50 21.29 ? 65 ARG D NH1 1 +ATOM 10399 N NH2 A ARG C 1 45 ? 88.572 38.722 148.427 0.50 22.80 ? 65 ARG D NH2 1 +ATOM 10400 N NH2 B ARG C 1 45 ? 89.259 39.538 148.604 0.50 21.32 ? 65 ARG D NH2 1 +ATOM 10401 N N . ARG C 1 46 ? 88.043 45.228 143.765 1.00 17.08 ? 66 ARG D N 1 +ATOM 10402 C CA . ARG C 1 46 ? 88.610 46.566 143.820 1.00 17.31 ? 66 ARG D CA 1 +ATOM 10403 C C . ARG C 1 46 ? 87.948 47.470 142.785 1.00 17.08 ? 66 ARG D C 1 +ATOM 10404 O O . ARG C 1 46 ? 87.305 46.982 141.845 1.00 16.79 ? 66 ARG D O 1 +ATOM 10405 C CB . ARG C 1 46 ? 90.103 46.493 143.515 1.00 17.73 ? 66 ARG D CB 1 +ATOM 10406 C CG . ARG C 1 46 ? 90.899 45.603 144.469 1.00 19.65 ? 66 ARG D CG 1 +ATOM 10407 C CD . ARG C 1 46 ? 91.018 46.264 145.836 1.00 22.67 ? 66 ARG D CD 1 +ATOM 10408 N NE . ARG C 1 46 ? 91.819 47.483 145.772 1.00 24.42 ? 66 ARG D NE 1 +ATOM 10409 C CZ . ARG C 1 46 ? 91.875 48.413 146.727 1.00 26.27 ? 66 ARG D CZ 1 +ATOM 10410 N NH1 . ARG C 1 46 ? 91.176 48.288 147.856 1.00 27.53 ? 66 ARG D NH1 1 +ATOM 10411 N NH2 . ARG C 1 46 ? 92.646 49.484 146.550 1.00 25.87 ? 66 ARG D NH2 1 +ATOM 10412 N N . PRO C 1 47 ? 88.114 48.795 142.939 1.00 17.10 ? 67 PRO D N 1 +ATOM 10413 C CA . PRO C 1 47 ? 87.632 49.703 141.900 1.00 17.01 ? 67 PRO D CA 1 +ATOM 10414 C C . PRO C 1 47 ? 88.093 49.257 140.510 1.00 16.66 ? 67 PRO D C 1 +ATOM 10415 O O . PRO C 1 47 ? 89.227 48.813 140.350 1.00 15.86 ? 67 PRO D O 1 +ATOM 10416 C CB . PRO C 1 47 ? 88.237 51.042 142.306 1.00 17.26 ? 67 PRO D CB 1 +ATOM 10417 C CG . PRO C 1 47 ? 88.275 50.961 143.799 1.00 17.35 ? 67 PRO D CG 1 +ATOM 10418 C CD . PRO C 1 47 ? 88.728 49.538 144.053 1.00 16.96 ? 67 PRO D CD 1 +ATOM 10419 N N . LEU C 1 48 ? 87.209 49.376 139.524 1.00 16.45 ? 68 LEU D N 1 +ATOM 10420 C CA . LEU C 1 48 ? 87.431 48.763 138.204 1.00 16.57 ? 68 LEU D CA 1 +ATOM 10421 C C . LEU C 1 48 ? 88.705 49.267 137.533 1.00 17.43 ? 68 LEU D C 1 +ATOM 10422 O O . LEU C 1 48 ? 89.413 48.500 136.903 1.00 17.01 ? 68 LEU D O 1 +ATOM 10423 C CB . LEU C 1 48 ? 86.224 49.003 137.289 1.00 16.45 ? 68 LEU D CB 1 +ATOM 10424 C CG . LEU C 1 48 ? 86.121 48.193 135.993 1.00 16.04 ? 68 LEU D CG 1 +ATOM 10425 C CD1 . LEU C 1 48 ? 86.126 46.672 136.260 1.00 15.63 ? 68 LEU D CD1 1 +ATOM 10426 C CD2 . LEU C 1 48 ? 84.856 48.598 135.251 1.00 15.55 ? 68 LEU D CD2 1 +ATOM 10427 N N . TRP C 1 49 ? 89.018 50.546 137.710 1.00 18.68 ? 69 TRP D N 1 +ATOM 10428 C CA . TRP C 1 49 ? 90.191 51.141 137.054 1.00 20.04 ? 69 TRP D CA 1 +ATOM 10429 C C . TRP C 1 49 ? 91.509 50.496 137.479 1.00 20.53 ? 69 TRP D C 1 +ATOM 10430 O O . TRP C 1 49 ? 92.494 50.550 136.744 1.00 20.58 ? 69 TRP D O 1 +ATOM 10431 C CB . TRP C 1 49 ? 90.255 52.646 137.333 1.00 20.94 ? 69 TRP D CB 1 +ATOM 10432 C CG . TRP C 1 49 ? 90.594 52.979 138.748 1.00 21.47 ? 69 TRP D CG 1 +ATOM 10433 C CD1 . TRP C 1 49 ? 89.721 53.228 139.761 1.00 22.40 ? 69 TRP D CD1 1 +ATOM 10434 C CD2 . TRP C 1 49 ? 91.907 53.087 139.310 1.00 22.98 ? 69 TRP D CD2 1 +ATOM 10435 N NE1 . TRP C 1 49 ? 90.408 53.492 140.923 1.00 22.99 ? 69 TRP D NE1 1 +ATOM 10436 C CE2 . TRP C 1 49 ? 91.752 53.408 140.673 1.00 23.37 ? 69 TRP D CE2 1 +ATOM 10437 C CE3 . TRP C 1 49 ? 93.199 52.938 138.791 1.00 22.42 ? 69 TRP D CE3 1 +ATOM 10438 C CZ2 . TRP C 1 49 ? 92.844 53.589 141.529 1.00 22.94 ? 69 TRP D CZ2 1 +ATOM 10439 C CZ3 . TRP C 1 49 ? 94.281 53.112 139.639 1.00 22.65 ? 69 TRP D CZ3 1 +ATOM 10440 C CH2 . TRP C 1 49 ? 94.096 53.434 140.995 1.00 22.68 ? 69 TRP D CH2 1 +ATOM 10441 N N . GLU C 1 50 ? 91.539 49.900 138.667 1.00 21.22 ? 70 GLU D N 1 +ATOM 10442 C CA . GLU C 1 50 ? 92.767 49.273 139.164 1.00 21.61 ? 70 GLU D CA 1 +ATOM 10443 C C . GLU C 1 50 ? 93.206 48.060 138.362 1.00 21.63 ? 70 GLU D C 1 +ATOM 10444 O O . GLU C 1 50 ? 94.388 47.709 138.391 1.00 22.52 ? 70 GLU D O 1 +ATOM 10445 C CB . GLU C 1 50 ? 92.626 48.875 140.632 1.00 21.78 ? 70 GLU D CB 1 +ATOM 10446 C CG . GLU C 1 50 ? 92.436 50.060 141.540 1.00 23.22 ? 70 GLU D CG 1 +ATOM 10447 C CD . GLU C 1 50 ? 92.583 49.721 143.006 1.00 24.01 ? 70 GLU D CD 1 +ATOM 10448 O OE1 . GLU C 1 50 ? 92.961 48.579 143.342 1.00 25.82 ? 70 GLU D OE1 1 +ATOM 10449 O OE2 . GLU C 1 50 ? 92.314 50.618 143.820 1.00 26.66 ? 70 GLU D OE2 1 +ATOM 10450 N N . SER C 1 51 ? 92.278 47.435 137.644 1.00 21.33 ? 71 SER D N 1 +ATOM 10451 C CA . SER C 1 51 ? 92.585 46.234 136.878 1.00 21.34 ? 71 SER D CA 1 +ATOM 10452 C C . SER C 1 51 ? 92.808 46.472 135.377 1.00 20.65 ? 71 SER D C 1 +ATOM 10453 O O . SER C 1 51 ? 93.108 45.535 134.655 1.00 20.59 ? 71 SER D O 1 +ATOM 10454 C CB . SER C 1 51 ? 91.501 45.180 137.112 1.00 21.54 ? 71 SER D CB 1 +ATOM 10455 O OG . SER C 1 51 ? 90.218 45.773 137.175 1.00 22.46 ? 71 SER D OG 1 +ATOM 10456 N N . GLY C 1 52 ? 92.686 47.713 134.907 1.00 20.06 ? 72 GLY D N 1 +ATOM 10457 C CA . GLY C 1 52 ? 93.026 48.025 133.516 1.00 19.34 ? 72 GLY D CA 1 +ATOM 10458 C C . GLY C 1 52 ? 92.317 49.260 133.015 1.00 18.59 ? 72 GLY D C 1 +ATOM 10459 O O . GLY C 1 52 ? 91.577 49.874 133.768 1.00 18.02 ? 72 GLY D O 1 +ATOM 10460 N N . PRO C 1 53 ? 92.554 49.636 131.743 1.00 18.17 ? 73 PRO D N 1 +ATOM 10461 C CA . PRO C 1 53 ? 91.870 50.783 131.136 1.00 17.09 ? 73 PRO D CA 1 +ATOM 10462 C C . PRO C 1 53 ? 90.354 50.668 131.256 1.00 16.33 ? 73 PRO D C 1 +ATOM 10463 O O . PRO C 1 53 ? 89.798 49.598 131.011 1.00 16.52 ? 73 PRO D O 1 +ATOM 10464 C CB . PRO C 1 53 ? 92.284 50.713 129.659 1.00 17.44 ? 73 PRO D CB 1 +ATOM 10465 C CG . PRO C 1 53 ? 93.545 49.922 129.635 1.00 17.90 ? 73 PRO D CG 1 +ATOM 10466 C CD . PRO C 1 53 ? 93.501 48.990 130.812 1.00 18.18 ? 73 PRO D CD 1 +ATOM 10467 N N . THR C 1 54 ? 89.708 51.762 131.639 1.00 14.99 ? 74 THR D N 1 +ATOM 10468 C CA . THR C 1 54 ? 88.253 51.847 131.658 1.00 14.04 ? 74 THR D CA 1 +ATOM 10469 C C . THR C 1 54 ? 87.852 53.063 130.854 1.00 13.15 ? 74 THR D C 1 +ATOM 10470 O O . THR C 1 54 ? 88.669 53.967 130.625 1.00 13.17 ? 74 THR D O 1 +ATOM 10471 C CB . THR C 1 54 ? 87.714 52.020 133.087 1.00 14.36 ? 74 THR D CB 1 +ATOM 10472 O OG1 . THR C 1 54 ? 88.311 53.176 133.695 1.00 14.21 ? 74 THR D OG1 1 +ATOM 10473 C CG2 . THR C 1 54 ? 88.015 50.789 133.920 1.00 14.78 ? 74 THR D CG2 1 +ATOM 10474 N N . VAL C 1 55 ? 86.593 53.103 130.442 1.00 11.93 ? 75 VAL D N 1 +ATOM 10475 C CA . VAL C 1 55 ? 86.051 54.284 129.763 1.00 11.82 ? 75 VAL D CA 1 +ATOM 10476 C C . VAL C 1 55 ? 84.742 54.667 130.415 1.00 11.27 ? 75 VAL D C 1 +ATOM 10477 O O . VAL C 1 55 ? 84.190 53.885 131.198 1.00 11.72 ? 75 VAL D O 1 +ATOM 10478 C CB . VAL C 1 55 ? 85.822 54.014 128.270 1.00 12.08 ? 75 VAL D CB 1 +ATOM 10479 C CG1 . VAL C 1 55 ? 87.156 53.749 127.589 1.00 12.64 ? 75 VAL D CG1 1 +ATOM 10480 C CG2 . VAL C 1 55 ? 84.857 52.839 128.061 1.00 11.98 ? 75 VAL D CG2 1 +ATOM 10481 N N . ASP C 1 56 ? 84.265 55.864 130.095 1.00 10.75 ? 76 ASP D N 1 +ATOM 10482 C CA . ASP C 1 56 ? 82.959 56.318 130.544 1.00 10.78 ? 76 ASP D CA 1 +ATOM 10483 C C . ASP C 1 56 ? 81.924 55.615 129.688 1.00 10.12 ? 76 ASP D C 1 +ATOM 10484 O O . ASP C 1 56 ? 82.121 55.451 128.478 1.00 10.12 ? 76 ASP D O 1 +ATOM 10485 C CB . ASP C 1 56 ? 82.776 57.820 130.338 1.00 10.25 ? 76 ASP D CB 1 +ATOM 10486 C CG . ASP C 1 56 ? 83.624 58.670 131.262 1.00 11.47 ? 76 ASP D CG 1 +ATOM 10487 O OD1 . ASP C 1 56 ? 83.913 58.261 132.403 1.00 12.44 ? 76 ASP D OD1 1 +ATOM 10488 O OD2 . ASP C 1 56 ? 83.963 59.790 130.836 1.00 13.02 ? 76 ASP D OD2 1 +ATOM 10489 N N . MET C 1 57 ? 80.822 55.215 130.317 1.00 9.75 ? 77 MET D N 1 +ATOM 10490 C CA . MET C 1 57 ? 79.657 54.720 129.595 1.00 9.24 ? 77 MET D CA 1 +ATOM 10491 C C . MET C 1 57 ? 78.430 55.371 130.233 1.00 9.23 ? 77 MET D C 1 +ATOM 10492 O O . MET C 1 57 ? 78.281 55.342 131.447 1.00 7.62 ? 77 MET D O 1 +ATOM 10493 C CB . MET C 1 57 ? 79.608 53.182 129.660 1.00 9.76 ? 77 MET D CB 1 +ATOM 10494 C CG . MET C 1 57 ? 78.612 52.504 128.706 1.00 11.19 ? 77 MET D CG 1 +ATOM 10495 S SD . MET C 1 57 ? 78.890 52.883 126.959 1.00 11.25 ? 77 MET D SD 1 +ATOM 10496 C CE . MET C 1 57 ? 80.564 52.326 126.759 1.00 10.84 ? 77 MET D CE 1 +ATOM 10497 N N . PRO C 1 58 ? 77.552 55.982 129.412 1.00 8.93 ? 78 PRO D N 1 +ATOM 10498 C CA . PRO C 1 58 ? 76.347 56.603 129.938 1.00 9.31 ? 78 PRO D CA 1 +ATOM 10499 C C . PRO C 1 58 ? 75.330 55.526 130.320 1.00 9.27 ? 78 PRO D C 1 +ATOM 10500 O O . PRO C 1 58 ? 75.290 54.455 129.687 1.00 8.62 ? 78 PRO D O 1 +ATOM 10501 C CB . PRO C 1 58 ? 75.850 57.439 128.757 1.00 9.26 ? 78 PRO D CB 1 +ATOM 10502 C CG . PRO C 1 58 ? 76.270 56.655 127.567 1.00 8.26 ? 78 PRO D CG 1 +ATOM 10503 C CD . PRO C 1 58 ? 77.612 56.074 127.944 1.00 8.91 ? 78 PRO D CD 1 +ATOM 10504 N N . VAL C 1 59 ? 74.537 55.819 131.354 1.00 9.16 ? 79 VAL D N 1 +ATOM 10505 C CA . VAL C 1 59 ? 73.443 54.979 131.795 1.00 9.55 ? 79 VAL D CA 1 +ATOM 10506 C C . VAL C 1 59 ? 72.236 55.867 132.059 1.00 9.01 ? 79 VAL D C 1 +ATOM 10507 O O . VAL C 1 59 ? 72.358 56.861 132.765 1.00 9.25 ? 79 VAL D O 1 +ATOM 10508 C CB . VAL C 1 59 ? 73.813 54.251 133.109 1.00 9.03 ? 79 VAL D CB 1 +ATOM 10509 C CG1 . VAL C 1 59 ? 72.621 53.482 133.673 1.00 10.42 ? 79 VAL D CG1 1 +ATOM 10510 C CG2 . VAL C 1 59 ? 75.016 53.344 132.903 1.00 11.33 ? 79 VAL D CG2 1 +ATOM 10511 N N . PRO C 1 60 ? 71.057 55.520 131.505 1.00 9.85 ? 80 PRO D N 1 +ATOM 10512 C CA . PRO C 1 60 ? 70.762 54.395 130.624 1.00 9.42 ? 80 PRO D CA 1 +ATOM 10513 C C . PRO C 1 60 ? 71.226 54.608 129.174 1.00 9.55 ? 80 PRO D C 1 +ATOM 10514 O O . PRO C 1 60 ? 71.145 55.725 128.643 1.00 10.28 ? 80 PRO D O 1 +ATOM 10515 C CB . PRO C 1 60 ? 69.230 54.296 130.700 1.00 9.82 ? 80 PRO D CB 1 +ATOM 10516 C CG . PRO C 1 60 ? 68.781 55.685 130.992 1.00 9.31 ? 80 PRO D CG 1 +ATOM 10517 C CD . PRO C 1 60 ? 69.852 56.303 131.830 1.00 9.91 ? 80 PRO D CD 1 +ATOM 10518 N N . SER C 1 61 ? 71.735 53.537 128.569 1.00 9.01 ? 81 SER D N 1 +ATOM 10519 C CA . SER C 1 61 ? 72.150 53.521 127.168 1.00 8.31 ? 81 SER D CA 1 +ATOM 10520 C C . SER C 1 61 ? 72.549 52.101 126.797 1.00 7.86 ? 81 SER D C 1 +ATOM 10521 O O . SER C 1 61 ? 72.952 51.322 127.675 1.00 8.63 ? 81 SER D O 1 +ATOM 10522 C CB . SER C 1 61 ? 73.366 54.424 126.955 1.00 8.48 ? 81 SER D CB 1 +ATOM 10523 O OG . SER C 1 61 ? 73.658 54.596 125.574 1.00 6.90 ? 81 SER D OG 1 +ATOM 10524 N N . SER C 1 62 ? 72.474 51.767 125.510 1.00 7.46 ? 82 SER D N 1 +ATOM 10525 C CA . SER C 1 62 ? 73.219 50.617 124.993 1.00 7.57 ? 82 SER D CA 1 +ATOM 10526 C C . SER C 1 62 ? 74.675 51.075 124.863 1.00 7.08 ? 82 SER D C 1 +ATOM 10527 O O . SER C 1 62 ? 74.936 52.265 124.719 1.00 6.82 ? 82 SER D O 1 +ATOM 10528 C CB . SER C 1 62 ? 72.666 50.148 123.648 1.00 7.61 ? 82 SER D CB 1 +ATOM 10529 O OG . SER C 1 62 ? 71.288 49.821 123.761 1.00 7.66 ? 82 SER D OG 1 +ATOM 10530 N N . PHE C 1 63 ? 75.625 50.152 124.953 1.00 7.02 ? 83 PHE D N 1 +ATOM 10531 C CA . PHE C 1 63 ? 77.037 50.503 124.794 1.00 7.17 ? 83 PHE D CA 1 +ATOM 10532 C C . PHE C 1 63 ? 77.523 50.475 123.345 1.00 7.43 ? 83 PHE D C 1 +ATOM 10533 O O . PHE C 1 63 ? 78.626 50.957 123.049 1.00 8.26 ? 83 PHE D O 1 +ATOM 10534 C CB . PHE C 1 63 ? 77.964 49.635 125.678 1.00 7.47 ? 83 PHE D CB 1 +ATOM 10535 C CG . PHE C 1 63 ? 77.935 48.139 125.376 1.00 6.81 ? 83 PHE D CG 1 +ATOM 10536 C CD1 . PHE C 1 63 ? 78.592 47.619 124.276 1.00 7.74 ? 83 PHE D CD1 1 +ATOM 10537 C CD2 . PHE C 1 63 ? 77.275 47.262 126.224 1.00 8.34 ? 83 PHE D CD2 1 +ATOM 10538 C CE1 . PHE C 1 63 ? 78.579 46.243 123.992 1.00 7.97 ? 83 PHE D CE1 1 +ATOM 10539 C CE2 . PHE C 1 63 ? 77.254 45.892 125.974 1.00 8.02 ? 83 PHE D CE2 1 +ATOM 10540 C CZ . PHE C 1 63 ? 77.915 45.369 124.851 1.00 7.96 ? 83 PHE D CZ 1 +ATOM 10541 N N . ASN C 1 64 ? 76.710 49.924 122.444 1.00 6.96 ? 84 ASN D N 1 +ATOM 10542 C CA . ASN C 1 64 ? 77.215 49.425 121.170 1.00 7.05 ? 84 ASN D CA 1 +ATOM 10543 C C . ASN C 1 64 ? 77.594 50.497 120.183 1.00 8.16 ? 84 ASN D C 1 +ATOM 10544 O O . ASN C 1 64 ? 78.515 50.294 119.392 1.00 8.13 ? 84 ASN D O 1 +ATOM 10545 C CB . ASN C 1 64 ? 76.217 48.478 120.508 1.00 7.02 ? 84 ASN D CB 1 +ATOM 10546 C CG . ASN C 1 64 ? 75.795 47.359 121.422 1.00 5.81 ? 84 ASN D CG 1 +ATOM 10547 O OD1 . ASN C 1 64 ? 75.025 47.596 122.335 1.00 5.93 ? 84 ASN D OD1 1 +ATOM 10548 N ND2 . ASN C 1 64 ? 76.289 46.133 121.182 1.00 7.59 ? 84 ASN D ND2 1 +ATOM 10549 N N . ASP C 1 65 ? 76.891 51.628 120.235 1.00 8.54 ? 85 ASP D N 1 +ATOM 10550 C CA . ASP C 1 65 ? 77.141 52.742 119.307 1.00 9.23 ? 85 ASP D CA 1 +ATOM 10551 C C . ASP C 1 65 ? 77.786 53.958 119.965 1.00 9.32 ? 85 ASP D C 1 +ATOM 10552 O O . ASP C 1 65 ? 77.890 55.005 119.340 1.00 9.19 ? 85 ASP D O 1 +ATOM 10553 C CB . ASP C 1 65 ? 75.836 53.161 118.617 1.00 9.99 ? 85 ASP D CB 1 +ATOM 10554 C CG . ASP C 1 65 ? 75.302 52.087 117.658 1.00 9.46 ? 85 ASP D CG 1 +ATOM 10555 O OD1 . ASP C 1 65 ? 76.108 51.303 117.118 1.00 11.16 ? 85 ASP D OD1 1 +ATOM 10556 O OD2 . ASP C 1 65 ? 74.075 52.056 117.416 1.00 10.31 ? 85 ASP D OD2 1 +ATOM 10557 N N . ILE C 1 66 ? 78.253 53.825 121.203 1.00 9.64 ? 86 ILE D N 1 +ATOM 10558 C CA . ILE C 1 66 ? 78.724 54.990 121.952 1.00 10.55 ? 86 ILE D CA 1 +ATOM 10559 C C . ILE C 1 66 ? 80.178 55.302 121.609 1.00 10.78 ? 86 ILE D C 1 +ATOM 10560 O O . ILE C 1 66 ? 80.589 56.460 121.668 1.00 10.05 ? 86 ILE D O 1 +ATOM 10561 C CB . ILE C 1 66 ? 78.567 54.796 123.487 1.00 11.00 ? 86 ILE D CB 1 +ATOM 10562 C CG1 . ILE C 1 66 ? 77.084 54.868 123.878 1.00 11.48 ? 86 ILE D CG1 1 +ATOM 10563 C CG2 . ILE C 1 66 ? 79.389 55.831 124.272 1.00 12.05 ? 86 ILE D CG2 1 +ATOM 10564 C CD1 . ILE C 1 66 ? 76.418 56.254 123.674 1.00 12.29 ? 86 ILE D CD1 1 +ATOM 10565 N N . SER C 1 67 ? 80.945 54.281 121.231 1.00 11.28 ? 87 SER D N 1 +ATOM 10566 C CA . SER C 1 67 ? 82.375 54.481 120.967 1.00 11.72 ? 87 SER D CA 1 +ATOM 10567 C C . SER C 1 67 ? 82.727 54.310 119.492 1.00 12.24 ? 87 SER D C 1 +ATOM 10568 O O . SER C 1 67 ? 81.875 53.984 118.672 1.00 12.85 ? 87 SER D O 1 +ATOM 10569 C CB . SER C 1 67 ? 83.207 53.519 121.821 1.00 11.89 ? 87 SER D CB 1 +ATOM 10570 O OG . SER C 1 67 ? 83.252 52.232 121.248 1.00 12.42 ? 87 SER D OG 1 +ATOM 10571 N N . GLN C 1 68 ? 83.990 54.558 119.155 1.00 12.24 ? 88 GLN D N 1 +ATOM 10572 C CA . GLN C 1 68 ? 84.501 54.280 117.821 1.00 12.68 ? 88 GLN D CA 1 +ATOM 10573 C C . GLN C 1 68 ? 85.416 53.058 117.836 1.00 13.79 ? 88 GLN D C 1 +ATOM 10574 O O . GLN C 1 68 ? 86.174 52.841 116.884 1.00 14.22 ? 88 GLN D O 1 +ATOM 10575 C CB . GLN C 1 68 ? 85.273 55.483 117.260 1.00 12.48 ? 88 GLN D CB 1 +ATOM 10576 C CG . GLN C 1 68 ? 84.640 56.843 117.559 1.00 10.52 ? 88 GLN D CG 1 +ATOM 10577 C CD . GLN C 1 68 ? 83.210 56.933 117.087 1.00 9.61 ? 88 GLN D CD 1 +ATOM 10578 O OE1 . GLN C 1 68 ? 82.311 57.283 117.857 1.00 8.70 ? 88 GLN D OE1 1 +ATOM 10579 N NE2 . GLN C 1 68 ? 82.979 56.604 115.803 1.00 11.01 ? 88 GLN D NE2 1 +ATOM 10580 N N . ASP C 1 69 ? 85.376 52.271 118.911 1.00 14.54 ? 89 ASP D N 1 +ATOM 10581 C CA . ASP C 1 69 ? 86.155 51.022 118.971 1.00 15.37 ? 89 ASP D CA 1 +ATOM 10582 C C . ASP C 1 69 ? 85.473 49.991 118.088 1.00 15.63 ? 89 ASP D C 1 +ATOM 10583 O O . ASP C 1 69 ? 84.338 49.588 118.352 1.00 16.02 ? 89 ASP D O 1 +ATOM 10584 C CB . ASP C 1 69 ? 86.259 50.503 120.413 1.00 15.44 ? 89 ASP D CB 1 +ATOM 10585 C CG . ASP C 1 69 ? 87.162 49.265 120.546 1.00 17.01 ? 89 ASP D CG 1 +ATOM 10586 O OD1 . ASP C 1 69 ? 87.355 48.512 119.570 1.00 18.39 ? 89 ASP D OD1 1 +ATOM 10587 O OD2 . ASP C 1 69 ? 87.673 49.048 121.654 1.00 17.67 ? 89 ASP D OD2 1 +ATOM 10588 N N . TRP C 1 70 ? 86.174 49.536 117.054 1.00 16.57 ? 90 TRP D N 1 +ATOM 10589 C CA . TRP C 1 70 ? 85.585 48.606 116.076 1.00 17.30 ? 90 TRP D CA 1 +ATOM 10590 C C . TRP C 1 70 ? 85.134 47.260 116.700 1.00 17.10 ? 90 TRP D C 1 +ATOM 10591 O O . TRP C 1 70 ? 84.226 46.620 116.188 1.00 18.61 ? 90 TRP D O 1 +ATOM 10592 C CB . TRP C 1 70 ? 86.563 48.356 114.915 1.00 17.80 ? 90 TRP D CB 1 +ATOM 10593 C CG . TRP C 1 70 ? 86.714 49.507 113.924 1.00 18.63 ? 90 TRP D CG 1 +ATOM 10594 C CD1 . TRP C 1 70 ? 86.801 50.841 114.213 1.00 18.98 ? 90 TRP D CD1 1 +ATOM 10595 C CD2 . TRP C 1 70 ? 86.846 49.404 112.495 1.00 18.78 ? 90 TRP D CD2 1 +ATOM 10596 N NE1 . TRP C 1 70 ? 86.944 51.573 113.051 1.00 18.72 ? 90 TRP D NE1 1 +ATOM 10597 C CE2 . TRP C 1 70 ? 86.982 50.715 111.987 1.00 19.11 ? 90 TRP D CE2 1 +ATOM 10598 C CE3 . TRP C 1 70 ? 86.844 48.329 111.594 1.00 19.48 ? 90 TRP D CE3 1 +ATOM 10599 C CZ2 . TRP C 1 70 ? 87.128 50.981 110.616 1.00 18.85 ? 90 TRP D CZ2 1 +ATOM 10600 C CZ3 . TRP C 1 70 ? 86.983 48.593 110.234 1.00 19.02 ? 90 TRP D CZ3 1 +ATOM 10601 C CH2 . TRP C 1 70 ? 87.122 49.908 109.759 1.00 19.31 ? 90 TRP D CH2 1 +ATOM 10602 N N . ARG C 1 71 ? 85.737 46.865 117.816 1.00 16.39 ? 91 ARG D N 1 +ATOM 10603 C CA . ARG C 1 71 ? 85.466 45.552 118.432 1.00 15.87 ? 91 ARG D CA 1 +ATOM 10604 C C . ARG C 1 71 ? 84.256 45.518 119.358 1.00 14.50 ? 91 ARG D C 1 +ATOM 10605 O O . ARG C 1 71 ? 83.769 44.432 119.676 1.00 13.81 ? 91 ARG D O 1 +ATOM 10606 C CB . ARG C 1 71 ? 86.678 45.096 119.244 1.00 16.56 ? 91 ARG D CB 1 +ATOM 10607 C CG . ARG C 1 71 ? 87.881 44.768 118.389 1.00 18.92 ? 91 ARG D CG 1 +ATOM 10608 C CD . ARG C 1 71 ? 89.145 45.398 118.900 1.00 23.08 ? 91 ARG D CD 1 +ATOM 10609 N NE . ARG C 1 71 ? 89.493 44.960 120.250 1.00 24.88 ? 91 ARG D NE 1 +ATOM 10610 C CZ . ARG C 1 71 ? 89.749 45.773 121.277 1.00 26.67 ? 91 ARG D CZ 1 +ATOM 10611 N NH1 . ARG C 1 71 ? 89.677 47.096 121.151 1.00 27.89 ? 91 ARG D NH1 1 +ATOM 10612 N NH2 . ARG C 1 71 ? 90.084 45.258 122.454 1.00 27.47 ? 91 ARG D NH2 1 +ATOM 10613 N N . LEU C 1 72 ? 83.803 46.690 119.811 1.00 12.38 ? 92 LEU D N 1 +ATOM 10614 C CA . LEU C 1 72 ? 82.784 46.764 120.864 1.00 11.31 ? 92 LEU D CA 1 +ATOM 10615 C C . LEU C 1 72 ? 81.355 46.547 120.360 1.00 10.71 ? 92 LEU D C 1 +ATOM 10616 O O . LEU C 1 72 ? 80.558 45.898 121.034 1.00 9.41 ? 92 LEU D O 1 +ATOM 10617 C CB . LEU C 1 72 ? 82.869 48.104 121.620 1.00 11.54 ? 92 LEU D CB 1 +ATOM 10618 C CG . LEU C 1 72 ? 81.996 48.200 122.886 1.00 10.30 ? 92 LEU D CG 1 +ATOM 10619 C CD1 . LEU C 1 72 ? 82.319 47.048 123.836 1.00 9.54 ? 92 LEU D CD1 1 +ATOM 10620 C CD2 . LEU C 1 72 ? 82.122 49.525 123.624 1.00 11.01 ? 92 LEU D CD2 1 +ATOM 10621 N N . ARG C 1 73 ? 81.027 47.062 119.177 1.00 10.84 ? 93 ARG D N 1 +ATOM 10622 C CA . ARG C 1 73 ? 79.632 47.025 118.717 1.00 10.61 ? 93 ARG D CA 1 +ATOM 10623 C C . ARG C 1 73 ? 79.135 45.594 118.612 1.00 10.43 ? 93 ARG D C 1 +ATOM 10624 O O . ARG C 1 73 ? 78.017 45.283 119.008 1.00 9.33 ? 93 ARG D O 1 +ATOM 10625 C CB . ARG C 1 73 ? 79.479 47.748 117.374 1.00 10.77 ? 93 ARG D CB 1 +ATOM 10626 C CG . ARG C 1 73 ? 78.077 47.771 116.831 1.00 12.23 ? 93 ARG D CG 1 +ATOM 10627 C CD . ARG C 1 73 ? 77.972 48.737 115.652 1.00 12.25 ? 93 ARG D CD 1 +ATOM 10628 N NE . ARG C 1 73 ? 76.585 49.066 115.306 1.00 12.82 ? 93 ARG D NE 1 +ATOM 10629 C CZ . ARG C 1 73 ? 75.753 48.288 114.614 1.00 13.40 ? 93 ARG D CZ 1 +ATOM 10630 N NH1 . ARG C 1 73 ? 76.141 47.102 114.170 1.00 14.37 ? 93 ARG D NH1 1 +ATOM 10631 N NH2 . ARG C 1 73 ? 74.523 48.724 114.346 1.00 13.51 ? 93 ARG D NH2 1 +ATOM 10632 N N . HIS C 1 74 ? 79.991 44.719 118.098 1.00 10.29 ? 94 HIS D N 1 +ATOM 10633 C CA . HIS C 1 74 ? 79.638 43.328 117.883 1.00 10.72 ? 94 HIS D CA 1 +ATOM 10634 C C . HIS C 1 74 ? 80.246 42.384 118.921 1.00 9.89 ? 94 HIS D C 1 +ATOM 10635 O O . HIS C 1 74 ? 80.254 41.173 118.713 1.00 10.36 ? 94 HIS D O 1 +ATOM 10636 C CB . HIS C 1 74 ? 80.047 42.924 116.465 1.00 11.11 ? 94 HIS D CB 1 +ATOM 10637 C CG . HIS C 1 74 ? 79.504 43.840 115.415 1.00 11.78 ? 94 HIS D CG 1 +ATOM 10638 N ND1 . HIS C 1 74 ? 80.263 44.809 114.797 1.00 14.78 ? 94 HIS D ND1 1 +ATOM 10639 C CD2 . HIS C 1 74 ? 78.252 43.963 114.910 1.00 13.08 ? 94 HIS D CD2 1 +ATOM 10640 C CE1 . HIS C 1 74 ? 79.508 45.474 113.939 1.00 12.97 ? 94 HIS D CE1 1 +ATOM 10641 N NE2 . HIS C 1 74 ? 78.285 44.977 113.984 1.00 13.70 ? 94 HIS D NE2 1 +ATOM 10642 N N . PHE C 1 75 ? 80.734 42.947 120.031 1.00 9.46 ? 95 PHE D N 1 +ATOM 10643 C CA . PHE C 1 75 ? 81.274 42.161 121.153 1.00 8.74 ? 95 PHE D CA 1 +ATOM 10644 C C . PHE C 1 75 ? 80.273 41.149 121.697 1.00 8.28 ? 95 PHE D C 1 +ATOM 10645 O O . PHE C 1 75 ? 79.089 41.452 121.837 1.00 8.34 ? 95 PHE D O 1 +ATOM 10646 C CB . PHE C 1 75 ? 81.668 43.108 122.275 1.00 8.98 ? 95 PHE D CB 1 +ATOM 10647 C CG . PHE C 1 75 ? 82.160 42.419 123.502 1.00 8.38 ? 95 PHE D CG 1 +ATOM 10648 C CD1 . PHE C 1 75 ? 83.399 41.801 123.516 1.00 10.03 ? 95 PHE D CD1 1 +ATOM 10649 C CD2 . PHE C 1 75 ? 81.399 42.417 124.657 1.00 9.57 ? 95 PHE D CD2 1 +ATOM 10650 C CE1 . PHE C 1 75 ? 83.868 41.148 124.666 1.00 10.48 ? 95 PHE D CE1 1 +ATOM 10651 C CE2 . PHE C 1 75 ? 81.854 41.782 125.804 1.00 9.35 ? 95 PHE D CE2 1 +ATOM 10652 C CZ . PHE C 1 75 ? 83.100 41.160 125.812 1.00 9.86 ? 95 PHE D CZ 1 +ATOM 10653 N N . VAL C 1 76 ? 80.745 39.940 121.983 1.00 8.15 ? 96 VAL D N 1 +ATOM 10654 C CA . VAL C 1 76 ? 79.920 38.914 122.631 1.00 7.50 ? 96 VAL D CA 1 +ATOM 10655 C C . VAL C 1 76 ? 80.710 38.466 123.835 1.00 7.87 ? 96 VAL D C 1 +ATOM 10656 O O . VAL C 1 76 ? 81.843 38.017 123.679 1.00 7.52 ? 96 VAL D O 1 +ATOM 10657 C CB . VAL C 1 76 ? 79.650 37.715 121.722 1.00 7.34 ? 96 VAL D CB 1 +ATOM 10658 C CG1 . VAL C 1 76 ? 78.904 36.591 122.493 1.00 6.86 ? 96 VAL D CG1 1 +ATOM 10659 C CG2 . VAL C 1 76 ? 78.871 38.141 120.473 1.00 6.07 ? 96 VAL D CG2 1 +ATOM 10660 N N . GLY C 1 77 ? 80.133 38.616 125.025 1.00 7.91 ? 97 GLY D N 1 +ATOM 10661 C CA . GLY C 1 77 ? 80.839 38.297 126.255 1.00 7.94 ? 97 GLY D CA 1 +ATOM 10662 C C . GLY C 1 77 ? 80.312 39.023 127.470 1.00 7.93 ? 97 GLY D C 1 +ATOM 10663 O O . GLY C 1 77 ? 79.126 39.330 127.534 1.00 8.13 ? 97 GLY D O 1 +ATOM 10664 N N . TRP C 1 78 ? 81.194 39.274 128.438 1.00 7.69 ? 98 TRP D N 1 +ATOM 10665 C CA . TRP C 1 78 ? 80.866 40.070 129.611 1.00 8.28 ? 98 TRP D CA 1 +ATOM 10666 C C . TRP C 1 78 ? 81.378 41.500 129.475 1.00 8.49 ? 98 TRP D C 1 +ATOM 10667 O O . TRP C 1 78 ? 82.570 41.696 129.168 1.00 8.16 ? 98 TRP D O 1 +ATOM 10668 C CB . TRP C 1 78 ? 81.526 39.514 130.869 1.00 8.49 ? 98 TRP D CB 1 +ATOM 10669 C CG . TRP C 1 78 ? 81.064 38.185 131.298 1.00 8.40 ? 98 TRP D CG 1 +ATOM 10670 C CD1 . TRP C 1 78 ? 81.632 37.010 131.005 1.00 9.30 ? 98 TRP D CD1 1 +ATOM 10671 C CD2 . TRP C 1 78 ? 79.963 37.903 132.169 1.00 9.08 ? 98 TRP D CD2 1 +ATOM 10672 N NE1 . TRP C 1 78 ? 80.953 35.983 131.609 1.00 8.68 ? 98 TRP D NE1 1 +ATOM 10673 C CE2 . TRP C 1 78 ? 79.909 36.502 132.326 1.00 8.03 ? 98 TRP D CE2 1 +ATOM 10674 C CE3 . TRP C 1 78 ? 79.004 38.696 132.816 1.00 9.89 ? 98 TRP D CE3 1 +ATOM 10675 C CZ2 . TRP C 1 78 ? 78.947 35.874 133.112 1.00 8.95 ? 98 TRP D CZ2 1 +ATOM 10676 C CZ3 . TRP C 1 78 ? 78.035 38.066 133.592 1.00 9.67 ? 98 TRP D CZ3 1 +ATOM 10677 C CH2 . TRP C 1 78 ? 78.018 36.672 133.733 1.00 8.78 ? 98 TRP D CH2 1 +ATOM 10678 N N . VAL C 1 79 ? 80.504 42.475 129.742 1.00 8.75 ? 99 VAL D N 1 +ATOM 10679 C CA . VAL C 1 79 ? 80.925 43.854 129.949 1.00 8.35 ? 99 VAL D CA 1 +ATOM 10680 C C . VAL C 1 79 ? 80.767 44.197 131.421 1.00 8.35 ? 99 VAL D C 1 +ATOM 10681 O O . VAL C 1 79 ? 79.880 43.671 132.098 1.00 9.21 ? 99 VAL D O 1 +ATOM 10682 C CB . VAL C 1 79 ? 80.160 44.863 129.042 1.00 8.38 ? 99 VAL D CB 1 +ATOM 10683 C CG1 . VAL C 1 79 ? 80.383 44.522 127.574 1.00 7.65 ? 99 VAL D CG1 1 +ATOM 10684 C CG2 . VAL C 1 79 ? 78.662 44.893 129.384 1.00 7.56 ? 99 VAL D CG2 1 +ATOM 10685 N N . TRP C 1 80 ? 81.642 45.073 131.910 1.00 8.97 ? 100 TRP D N 1 +ATOM 10686 C CA . TRP C 1 80 ? 81.724 45.391 133.331 1.00 8.77 ? 100 TRP D CA 1 +ATOM 10687 C C . TRP C 1 80 ? 81.442 46.875 133.521 1.00 8.59 ? 100 TRP D C 1 +ATOM 10688 O O . TRP C 1 80 ? 82.090 47.710 132.886 1.00 9.14 ? 100 TRP D O 1 +ATOM 10689 C CB . TRP C 1 80 ? 83.121 45.055 133.858 1.00 8.75 ? 100 TRP D CB 1 +ATOM 10690 C CG . TRP C 1 80 ? 83.375 43.603 133.890 1.00 9.52 ? 100 TRP D CG 1 +ATOM 10691 C CD1 . TRP C 1 80 ? 83.536 42.785 132.824 1.00 9.61 ? 100 TRP D CD1 1 +ATOM 10692 C CD2 . TRP C 1 80 ? 83.472 42.777 135.052 1.00 10.34 ? 100 TRP D CD2 1 +ATOM 10693 N NE1 . TRP C 1 80 ? 83.719 41.485 133.237 1.00 10.29 ? 100 TRP D NE1 1 +ATOM 10694 C CE2 . TRP C 1 80 ? 83.680 41.452 134.606 1.00 9.46 ? 100 TRP D CE2 1 +ATOM 10695 C CE3 . TRP C 1 80 ? 83.393 43.024 136.426 1.00 10.48 ? 100 TRP D CE3 1 +ATOM 10696 C CZ2 . TRP C 1 80 ? 83.827 40.381 135.487 1.00 10.59 ? 100 TRP D CZ2 1 +ATOM 10697 C CZ3 . TRP C 1 80 ? 83.531 41.947 137.304 1.00 9.94 ? 100 TRP D CZ3 1 +ATOM 10698 C CH2 . TRP C 1 80 ? 83.755 40.647 136.824 1.00 9.79 ? 100 TRP D CH2 1 +ATOM 10699 N N . TYR C 1 81 ? 80.460 47.182 134.359 1.00 8.71 ? 101 TYR D N 1 +ATOM 10700 C CA . TYR C 1 81 ? 80.087 48.557 134.682 1.00 8.65 ? 101 TYR D CA 1 +ATOM 10701 C C . TYR C 1 81 ? 80.378 48.828 136.161 1.00 9.49 ? 101 TYR D C 1 +ATOM 10702 O O . TYR C 1 81 ? 80.252 47.933 136.995 1.00 8.99 ? 101 TYR D O 1 +ATOM 10703 C CB . TYR C 1 81 ? 78.588 48.762 134.472 1.00 8.70 ? 101 TYR D CB 1 +ATOM 10704 C CG . TYR C 1 81 ? 78.076 48.959 133.069 1.00 8.57 ? 101 TYR D CG 1 +ATOM 10705 C CD1 . TYR C 1 81 ? 77.768 50.231 132.603 1.00 9.17 ? 101 TYR D CD1 1 +ATOM 10706 C CD2 . TYR C 1 81 ? 77.813 47.878 132.230 1.00 7.98 ? 101 TYR D CD2 1 +ATOM 10707 C CE1 . TYR C 1 81 ? 77.245 50.431 131.341 1.00 8.13 ? 101 TYR D CE1 1 +ATOM 10708 C CE2 . TYR C 1 81 ? 77.296 48.070 130.954 1.00 8.40 ? 101 TYR D CE2 1 +ATOM 10709 C CZ . TYR C 1 81 ? 77.001 49.357 130.521 1.00 9.03 ? 101 TYR D CZ 1 +ATOM 10710 O OH . TYR C 1 81 ? 76.477 49.567 129.268 1.00 8.33 ? 101 TYR D OH 1 +ATOM 10711 N N . GLU C 1 82 ? 80.714 50.071 136.508 1.00 10.24 ? 102 GLU D N 1 +ATOM 10712 C CA . GLU C 1 82 ? 80.867 50.422 137.915 1.00 11.10 ? 102 GLU D CA 1 +ATOM 10713 C C . GLU C 1 82 ? 80.555 51.877 138.230 1.00 11.94 ? 102 GLU D C 1 +ATOM 10714 O O . GLU C 1 82 ? 80.846 52.771 137.440 1.00 11.78 ? 102 GLU D O 1 +ATOM 10715 C CB . GLU C 1 82 ? 82.269 50.083 138.392 1.00 10.80 ? 102 GLU D CB 1 +ATOM 10716 C CG . GLU C 1 82 ? 82.487 50.290 139.882 1.00 11.06 ? 102 GLU D CG 1 +ATOM 10717 C CD . GLU C 1 82 ? 83.805 49.728 140.321 1.00 10.77 ? 102 GLU D CD 1 +ATOM 10718 O OE1 . GLU C 1 82 ? 83.843 48.542 140.673 1.00 12.31 ? 102 GLU D OE1 1 +ATOM 10719 O OE2 . GLU C 1 82 ? 84.802 50.481 140.305 1.00 12.33 ? 102 GLU D OE2 1 +ATOM 10720 N N . ARG C 1 83 ? 79.958 52.091 139.398 1.00 13.76 ? 103 ARG D N 1 +ATOM 10721 C CA . ARG C 1 83 ? 79.560 53.414 139.873 1.00 15.33 ? 103 ARG D CA 1 +ATOM 10722 C C . ARG C 1 83 ? 79.849 53.467 141.360 1.00 16.15 ? 103 ARG D C 1 +ATOM 10723 O O . ARG C 1 83 ? 79.607 52.488 142.074 1.00 15.83 ? 103 ARG D O 1 +ATOM 10724 C CB . ARG C 1 83 ? 78.053 53.612 139.646 1.00 16.08 ? 103 ARG D CB 1 +ATOM 10725 C CG . ARG C 1 83 ? 77.406 54.840 140.284 1.00 18.68 ? 103 ARG D CG 1 +ATOM 10726 C CD . ARG C 1 83 ? 77.428 56.051 139.361 1.00 21.28 ? 103 ARG D CD 1 +ATOM 10727 N NE . ARG C 1 83 ? 76.422 57.042 139.747 1.00 22.32 ? 103 ARG D NE 1 +ATOM 10728 C CZ . ARG C 1 83 ? 75.887 57.945 138.924 1.00 23.65 ? 103 ARG D CZ 1 +ATOM 10729 N NH1 . ARG C 1 83 ? 76.233 58.008 137.635 1.00 23.37 ? 103 ARG D NH1 1 +ATOM 10730 N NH2 . ARG C 1 83 ? 74.986 58.794 139.396 1.00 24.68 ? 103 ARG D NH2 1 +ATOM 10731 N N . GLU C 1 84 ? 80.326 54.615 141.832 1.00 17.16 ? 104 GLU D N 1 +ATOM 10732 C CA . GLU C 1 84 ? 80.449 54.847 143.264 1.00 17.92 ? 104 GLU D CA 1 +ATOM 10733 C C . GLU C 1 84 ? 79.415 55.879 143.683 1.00 18.05 ? 104 GLU D C 1 +ATOM 10734 O O . GLU C 1 84 ? 79.173 56.853 142.966 1.00 17.69 ? 104 GLU D O 1 +ATOM 10735 C CB . GLU C 1 84 ? 81.880 55.254 143.616 1.00 18.72 ? 104 GLU D CB 1 +ATOM 10736 C CG . GLU C 1 84 ? 82.883 54.182 143.189 1.00 21.27 ? 104 GLU D CG 1 +ATOM 10737 C CD . GLU C 1 84 ? 84.230 54.322 143.861 1.00 24.54 ? 104 GLU D CD 1 +ATOM 10738 O OE1 . GLU C 1 84 ? 85.098 55.058 143.339 1.00 28.58 ? 104 GLU D OE1 1 +ATOM 10739 O OE2 . GLU C 1 84 ? 84.426 53.686 144.912 1.00 26.33 ? 104 GLU D OE2 1 +ATOM 10740 N N . VAL C 1 85 ? 78.777 55.638 144.821 1.00 17.99 ? 105 VAL D N 1 +ATOM 10741 C CA . VAL C 1 85 ? 77.710 56.499 145.312 1.00 18.71 ? 105 VAL D CA 1 +ATOM 10742 C C . VAL C 1 85 ? 77.999 56.913 146.740 1.00 18.46 ? 105 VAL D C 1 +ATOM 10743 O O . VAL C 1 85 ? 78.446 56.094 147.542 1.00 18.79 ? 105 VAL D O 1 +ATOM 10744 C CB . VAL C 1 85 ? 76.348 55.761 145.327 1.00 18.60 ? 105 VAL D CB 1 +ATOM 10745 C CG1 . VAL C 1 85 ? 75.214 56.765 145.183 1.00 19.85 ? 105 VAL D CG1 1 +ATOM 10746 C CG2 . VAL C 1 85 ? 76.288 54.714 144.233 1.00 19.41 ? 105 VAL D CG2 1 +ATOM 10747 N N . ILE C 1 86 ? 77.730 58.175 147.057 1.00 18.79 ? 106 ILE D N 1 +ATOM 10748 C CA . ILE C 1 86 ? 77.693 58.628 148.436 1.00 19.16 ? 106 ILE D CA 1 +ATOM 10749 C C . ILE C 1 86 ? 76.243 58.667 148.897 1.00 19.76 ? 106 ILE D C 1 +ATOM 10750 O O . ILE C 1 86 ? 75.442 59.441 148.376 1.00 20.14 ? 106 ILE D O 1 +ATOM 10751 C CB . ILE C 1 86 ? 78.332 60.014 148.587 1.00 19.55 ? 106 ILE D CB 1 +ATOM 10752 C CG1 . ILE C 1 86 ? 79.854 59.898 148.401 1.00 19.60 ? 106 ILE D CG1 1 +ATOM 10753 C CG2 . ILE C 1 86 ? 77.979 60.624 149.939 1.00 19.60 ? 106 ILE D CG2 1 +ATOM 10754 C CD1 . ILE C 1 86 ? 80.589 61.234 148.305 1.00 19.59 ? 106 ILE D CD1 1 +ATOM 10755 N N . LEU C 1 87 ? 75.919 57.833 149.879 1.00 20.38 ? 107 LEU D N 1 +ATOM 10756 C CA . LEU C 1 87 ? 74.543 57.705 150.379 1.00 21.01 ? 107 LEU D CA 1 +ATOM 10757 C C . LEU C 1 87 ? 74.244 58.755 151.443 1.00 21.03 ? 107 LEU D C 1 +ATOM 10758 O O . LEU C 1 87 ? 75.145 59.185 152.167 1.00 21.14 ? 107 LEU D O 1 +ATOM 10759 C CB . LEU C 1 87 ? 74.316 56.313 150.984 1.00 20.86 ? 107 LEU D CB 1 +ATOM 10760 C CG . LEU C 1 87 ? 73.874 55.165 150.069 1.00 21.85 ? 107 LEU D CG 1 +ATOM 10761 C CD1 . LEU C 1 87 ? 74.585 55.200 148.740 1.00 22.75 ? 107 LEU D CD1 1 +ATOM 10762 C CD2 . LEU C 1 87 ? 74.086 53.817 150.773 1.00 21.59 ? 107 LEU D CD2 1 +ATOM 10763 N N . PRO C 1 88 ? 72.975 59.182 151.540 1.00 21.47 ? 108 PRO D N 1 +ATOM 10764 C CA . PRO C 1 88 ? 72.579 59.987 152.694 1.00 21.89 ? 108 PRO D CA 1 +ATOM 10765 C C . PRO C 1 88 ? 72.897 59.267 154.008 1.00 22.63 ? 108 PRO D C 1 +ATOM 10766 O O . PRO C 1 88 ? 72.655 58.063 154.127 1.00 21.77 ? 108 PRO D O 1 +ATOM 10767 C CB . PRO C 1 88 ? 71.063 60.146 152.509 1.00 21.83 ? 108 PRO D CB 1 +ATOM 10768 C CG . PRO C 1 88 ? 70.815 59.944 151.080 1.00 21.78 ? 108 PRO D CG 1 +ATOM 10769 C CD . PRO C 1 88 ? 71.866 58.990 150.590 1.00 21.12 ? 108 PRO D CD 1 +ATOM 10770 N N . GLU C 1 89 ? 73.449 59.988 154.984 1.00 23.97 ? 109 GLU D N 1 +ATOM 10771 C CA . GLU C 1 89 ? 73.862 59.354 156.244 1.00 24.86 ? 109 GLU D CA 1 +ATOM 10772 C C . GLU C 1 89 ? 72.689 58.710 156.982 1.00 24.97 ? 109 GLU D C 1 +ATOM 10773 O O . GLU C 1 89 ? 72.855 57.693 157.649 1.00 25.18 ? 109 GLU D O 1 +ATOM 10774 C CB . GLU C 1 89 ? 74.617 60.331 157.157 1.00 25.37 ? 109 GLU D CB 1 +ATOM 10775 C CG . GLU C 1 89 ? 73.782 61.077 158.201 1.00 27.13 ? 109 GLU D CG 1 +ATOM 10776 C CD . GLU C 1 89 ? 74.578 61.406 159.459 1.00 29.07 ? 109 GLU D CD 1 +ATOM 10777 O OE1 . GLU C 1 89 ? 73.970 61.438 160.549 1.00 31.53 ? 109 GLU D OE1 1 +ATOM 10778 O OE2 . GLU C 1 89 ? 75.808 61.616 159.363 1.00 30.76 ? 109 GLU D OE2 1 +ATOM 10779 N N . ARG C 1 90 ? 71.511 59.310 156.845 1.00 24.91 ? 110 ARG D N 1 +ATOM 10780 C CA . ARG C 1 90 ? 70.273 58.786 157.409 1.00 25.28 ? 110 ARG D CA 1 +ATOM 10781 C C . ARG C 1 90 ? 70.003 57.348 156.948 1.00 24.67 ? 110 ARG D C 1 +ATOM 10782 O O . ARG C 1 90 ? 69.519 56.530 157.721 1.00 25.15 ? 110 ARG D O 1 +ATOM 10783 C CB . ARG C 1 90 ? 69.116 59.720 157.027 1.00 25.59 ? 110 ARG D CB 1 +ATOM 10784 C CG . ARG C 1 90 ? 67.697 59.224 157.274 1.00 27.80 ? 110 ARG D CG 1 +ATOM 10785 C CD . ARG C 1 90 ? 67.473 58.662 158.676 1.00 30.79 ? 110 ARG D CD 1 +ATOM 10786 N NE . ARG C 1 90 ? 66.236 59.145 159.297 1.00 31.63 ? 110 ARG D NE 1 +ATOM 10787 C CZ . ARG C 1 90 ? 65.000 58.856 158.880 1.00 33.24 ? 110 ARG D CZ 1 +ATOM 10788 N NH1 . ARG C 1 90 ? 64.791 58.077 157.826 1.00 33.43 ? 110 ARG D NH1 1 +ATOM 10789 N NH2 . ARG C 1 90 ? 63.953 59.358 159.528 1.00 33.63 ? 110 ARG D NH2 1 +ATOM 10790 N N . TRP C 1 91 ? 70.330 57.047 155.696 1.00 24.21 ? 111 TRP D N 1 +ATOM 10791 C CA . TRP C 1 91 ? 70.150 55.702 155.148 1.00 23.86 ? 111 TRP D CA 1 +ATOM 10792 C C . TRP C 1 91 ? 71.042 54.679 155.858 1.00 24.31 ? 111 TRP D C 1 +ATOM 10793 O O . TRP C 1 91 ? 70.614 53.561 156.145 1.00 24.30 ? 111 TRP D O 1 +ATOM 10794 C CB . TRP C 1 91 ? 70.465 55.692 153.646 1.00 23.08 ? 111 TRP D CB 1 +ATOM 10795 C CG . TRP C 1 91 ? 69.465 56.413 152.779 1.00 22.34 ? 111 TRP D CG 1 +ATOM 10796 C CD1 . TRP C 1 91 ? 68.521 57.309 153.178 1.00 21.87 ? 111 TRP D CD1 1 +ATOM 10797 C CD2 . TRP C 1 91 ? 69.342 56.308 151.356 1.00 21.25 ? 111 TRP D CD2 1 +ATOM 10798 N NE1 . TRP C 1 91 ? 67.805 57.761 152.097 1.00 21.79 ? 111 TRP D NE1 1 +ATOM 10799 C CE2 . TRP C 1 91 ? 68.290 57.160 150.963 1.00 21.38 ? 111 TRP D CE2 1 +ATOM 10800 C CE3 . TRP C 1 91 ? 70.016 55.571 150.377 1.00 21.45 ? 111 TRP D CE3 1 +ATOM 10801 C CZ2 . TRP C 1 91 ? 67.896 57.297 149.636 1.00 21.70 ? 111 TRP D CZ2 1 +ATOM 10802 C CZ3 . TRP C 1 91 ? 69.623 55.710 149.053 1.00 22.02 ? 111 TRP D CZ3 1 +ATOM 10803 C CH2 . TRP C 1 91 ? 68.571 56.564 148.697 1.00 22.07 ? 111 TRP D CH2 1 +ATOM 10804 N N . THR C 1 92 ? 72.278 55.079 156.144 1.00 25.11 ? 112 THR D N 1 +ATOM 10805 C CA . THR C 1 92 ? 73.313 54.172 156.643 1.00 25.83 ? 112 THR D CA 1 +ATOM 10806 C C . THR C 1 92 ? 73.366 54.060 158.162 1.00 26.46 ? 112 THR D C 1 +ATOM 10807 O O . THR C 1 92 ? 73.886 53.078 158.683 1.00 26.69 ? 112 THR D O 1 +ATOM 10808 C CB . THR C 1 92 ? 74.715 54.607 156.163 1.00 25.83 ? 112 THR D CB 1 +ATOM 10809 O OG1 . THR C 1 92 ? 75.078 55.840 156.796 1.00 25.88 ? 112 THR D OG1 1 +ATOM 10810 C CG2 . THR C 1 92 ? 74.739 54.788 154.647 1.00 26.22 ? 112 THR D CG2 1 +ATOM 10811 N N . GLN C 1 93 ? 72.845 55.063 158.868 1.00 27.38 ? 113 GLN D N 1 +ATOM 10812 C CA . GLN C 1 93 ? 72.885 55.092 160.339 1.00 27.95 ? 113 GLN D CA 1 +ATOM 10813 C C . GLN C 1 93 ? 71.548 54.706 160.987 1.00 27.92 ? 113 GLN D C 1 +ATOM 10814 O O . GLN C 1 93 ? 71.536 54.043 162.024 1.00 28.32 ? 113 GLN D O 1 +ATOM 10815 C CB . GLN C 1 93 ? 73.328 56.480 160.830 1.00 28.23 ? 113 GLN D CB 1 +ATOM 10816 C CG . GLN C 1 93 ? 74.706 56.927 160.312 1.00 29.35 ? 113 GLN D CG 1 +ATOM 10817 C CD . GLN C 1 93 ? 75.840 55.997 160.719 1.00 31.53 ? 113 GLN D CD 1 +ATOM 10818 O OE1 . GLN C 1 93 ? 76.007 55.673 161.896 1.00 33.20 ? 113 GLN D OE1 1 +ATOM 10819 N NE2 . GLN C 1 93 ? 76.628 55.567 159.741 1.00 32.59 ? 113 GLN D NE2 1 +ATOM 10820 N N . ASP C 1 94 ? 70.434 55.118 160.382 1.00 27.89 ? 114 ASP D N 1 +ATOM 10821 C CA . ASP C 1 94 ? 69.091 54.817 160.902 1.00 27.66 ? 114 ASP D CA 1 +ATOM 10822 C C . ASP C 1 94 ? 68.594 53.451 160.406 1.00 27.18 ? 114 ASP D C 1 +ATOM 10823 O O . ASP C 1 94 ? 68.161 53.325 159.259 1.00 27.19 ? 114 ASP D O 1 +ATOM 10824 C CB . ASP C 1 94 ? 68.120 55.914 160.469 1.00 27.80 ? 114 ASP D CB 1 +ATOM 10825 C CG . ASP C 1 94 ? 66.756 55.808 161.136 1.00 28.64 ? 114 ASP D CG 1 +ATOM 10826 O OD1 . ASP C 1 94 ? 66.381 54.713 161.603 1.00 29.12 ? 114 ASP D OD1 1 +ATOM 10827 O OD2 . ASP C 1 94 ? 66.045 56.836 161.169 1.00 28.93 ? 114 ASP D OD2 1 +ATOM 10828 N N . LEU C 1 95 ? 68.605 52.452 161.289 1.00 26.32 ? 115 LEU D N 1 +ATOM 10829 C CA . LEU C 1 95 ? 68.313 51.061 160.915 1.00 25.79 ? 115 LEU D CA 1 +ATOM 10830 C C . LEU C 1 95 ? 66.827 50.744 160.651 1.00 25.18 ? 115 LEU D C 1 +ATOM 10831 O O . LEU C 1 95 ? 66.479 49.609 160.351 1.00 24.95 ? 115 LEU D O 1 +ATOM 10832 C CB . LEU C 1 95 ? 68.880 50.110 161.975 1.00 25.96 ? 115 LEU D CB 1 +ATOM 10833 C CG . LEU C 1 95 ? 70.379 50.261 162.281 1.00 26.11 ? 115 LEU D CG 1 +ATOM 10834 C CD1 . LEU C 1 95 ? 70.803 49.288 163.369 1.00 25.63 ? 115 LEU D CD1 1 +ATOM 10835 C CD2 . LEU C 1 95 ? 71.244 50.071 161.040 1.00 25.50 ? 115 LEU D CD2 1 +ATOM 10836 N N . ARG C 1 96 ? 65.957 51.743 160.742 1.00 24.42 ? 116 ARG D N 1 +ATOM 10837 C CA . ARG C 1 96 ? 64.575 51.597 160.285 1.00 24.20 ? 116 ARG D CA 1 +ATOM 10838 C C . ARG C 1 96 ? 64.477 51.769 158.756 1.00 23.07 ? 116 ARG D C 1 +ATOM 10839 O O . ARG C 1 96 ? 63.417 51.561 158.171 1.00 23.42 ? 116 ARG D O 1 +ATOM 10840 C CB . ARG C 1 96 ? 63.682 52.627 160.975 1.00 24.76 ? 116 ARG D CB 1 +ATOM 10841 C CG . ARG C 1 96 ? 63.638 52.517 162.499 1.00 26.47 ? 116 ARG D CG 1 +ATOM 10842 C CD . ARG C 1 96 ? 62.988 53.754 163.098 1.00 29.13 ? 116 ARG D CD 1 +ATOM 10843 N NE . ARG C 1 96 ? 63.956 54.838 163.300 1.00 30.33 ? 116 ARG D NE 1 +ATOM 10844 C CZ . ARG C 1 96 ? 63.664 56.140 163.275 1.00 31.67 ? 116 ARG D CZ 1 +ATOM 10845 N NH1 . ARG C 1 96 ? 62.424 56.568 163.037 1.00 32.63 ? 116 ARG D NH1 1 +ATOM 10846 N NH2 . ARG C 1 96 ? 64.629 57.033 163.479 1.00 31.74 ? 116 ARG D NH2 1 +ATOM 10847 N N . THR C 1 97 ? 65.579 52.174 158.124 1.00 22.01 ? 117 THR D N 1 +ATOM 10848 C CA . THR C 1 97 ? 65.629 52.349 156.676 1.00 20.94 ? 117 THR D CA 1 +ATOM 10849 C C . THR C 1 97 ? 65.968 51.037 155.997 1.00 19.86 ? 117 THR D C 1 +ATOM 10850 O O . THR C 1 97 ? 66.969 50.410 156.330 1.00 20.27 ? 117 THR D O 1 +ATOM 10851 C CB . THR C 1 97 ? 66.711 53.365 156.255 1.00 21.06 ? 117 THR D CB 1 +ATOM 10852 O OG1 . THR C 1 97 ? 66.662 54.528 157.101 1.00 21.46 ? 117 THR D OG1 1 +ATOM 10853 C CG2 . THR C 1 97 ? 66.515 53.766 154.788 1.00 20.97 ? 117 THR D CG2 1 +ATOM 10854 N N . ARG C 1 98 ? 65.125 50.623 155.055 1.00 18.43 ? 118 ARG D N 1 +ATOM 10855 C CA . ARG C 1 98 ? 65.440 49.516 154.149 1.00 17.54 ? 118 ARG D CA 1 +ATOM 10856 C C . ARG C 1 98 ? 65.918 50.139 152.839 1.00 16.62 ? 118 ARG D C 1 +ATOM 10857 O O . ARG C 1 98 ? 65.225 50.994 152.284 1.00 16.53 ? 118 ARG D O 1 +ATOM 10858 C CB . ARG C 1 98 ? 64.207 48.635 153.917 1.00 17.17 ? 118 ARG D CB 1 +ATOM 10859 C CG . ARG C 1 98 ? 64.325 47.642 152.775 1.00 17.21 ? 118 ARG D CG 1 +ATOM 10860 C CD . ARG C 1 98 ? 63.203 46.614 152.809 1.00 17.29 ? 118 ARG D CD 1 +ATOM 10861 N NE . ARG C 1 98 ? 63.171 45.758 151.614 1.00 17.35 ? 118 ARG D NE 1 +ATOM 10862 C CZ . ARG C 1 98 ? 62.552 46.050 150.467 1.00 17.51 ? 118 ARG D CZ 1 +ATOM 10863 N NH1 . ARG C 1 98 ? 61.908 47.189 150.319 1.00 16.20 ? 118 ARG D NH1 1 +ATOM 10864 N NH2 . ARG C 1 98 ? 62.577 45.190 149.449 1.00 17.55 ? 118 ARG D NH2 1 +ATOM 10865 N N . VAL C 1 99 ? 67.105 49.737 152.372 1.00 15.31 ? 119 VAL D N 1 +ATOM 10866 C CA . VAL C 1 99 ? 67.711 50.306 151.163 1.00 14.70 ? 119 VAL D CA 1 +ATOM 10867 C C . VAL C 1 99 ? 67.723 49.254 150.050 1.00 14.48 ? 119 VAL D C 1 +ATOM 10868 O O . VAL C 1 99 ? 68.202 48.125 150.255 1.00 14.19 ? 119 VAL D O 1 +ATOM 10869 C CB . VAL C 1 99 ? 69.166 50.801 151.422 1.00 14.26 ? 119 VAL D CB 1 +ATOM 10870 C CG1 . VAL C 1 99 ? 69.756 51.377 150.147 1.00 13.87 ? 119 VAL D CG1 1 +ATOM 10871 C CG2 . VAL C 1 99 ? 69.200 51.841 152.551 1.00 14.13 ? 119 VAL D CG2 1 +ATOM 10872 N N . VAL C 1 100 ? 67.175 49.617 148.885 1.00 13.72 ? 120 VAL D N 1 +ATOM 10873 C CA . VAL C 1 100 ? 67.024 48.691 147.759 1.00 13.07 ? 120 VAL D CA 1 +ATOM 10874 C C . VAL C 1 100 ? 67.743 49.213 146.530 1.00 12.93 ? 120 VAL D C 1 +ATOM 10875 O O . VAL C 1 100 ? 67.629 50.400 146.209 1.00 12.28 ? 120 VAL D O 1 +ATOM 10876 C CB . VAL C 1 100 ? 65.538 48.518 147.373 1.00 12.93 ? 120 VAL D CB 1 +ATOM 10877 C CG1 . VAL C 1 100 ? 65.394 47.451 146.293 1.00 12.89 ? 120 VAL D CG1 1 +ATOM 10878 C CG2 . VAL C 1 100 ? 64.723 48.154 148.595 1.00 14.26 ? 120 VAL D CG2 1 +ATOM 10879 N N . LEU C 1 101 ? 68.463 48.326 145.842 1.00 12.20 ? 121 LEU D N 1 +ATOM 10880 C CA . LEU C 1 101 ? 69.101 48.656 144.564 1.00 11.89 ? 121 LEU D CA 1 +ATOM 10881 C C . LEU C 1 101 ? 68.265 48.006 143.469 1.00 11.71 ? 121 LEU D C 1 +ATOM 10882 O O . LEU C 1 101 ? 68.089 46.796 143.462 1.00 11.52 ? 121 LEU D O 1 +ATOM 10883 C CB . LEU C 1 101 ? 70.543 48.148 144.504 1.00 11.79 ? 121 LEU D CB 1 +ATOM 10884 C CG . LEU C 1 101 ? 71.273 48.280 143.161 1.00 11.93 ? 121 LEU D CG 1 +ATOM 10885 C CD1 . LEU C 1 101 ? 71.354 49.738 142.698 1.00 12.39 ? 121 LEU D CD1 1 +ATOM 10886 C CD2 . LEU C 1 101 ? 72.662 47.662 143.234 1.00 12.55 ? 121 LEU D CD2 1 +ATOM 10887 N N . ARG C 1 102 ? 67.734 48.834 142.581 1.00 11.29 ? 122 ARG D N 1 +ATOM 10888 C CA . ARG C 1 102 ? 66.870 48.398 141.504 1.00 10.99 ? 122 ARG D CA 1 +ATOM 10889 C C . ARG C 1 102 ? 67.593 48.639 140.188 1.00 10.84 ? 122 ARG D C 1 +ATOM 10890 O O . ARG C 1 102 ? 68.047 49.755 139.913 1.00 10.27 ? 122 ARG D O 1 +ATOM 10891 C CB . ARG C 1 102 ? 65.566 49.193 141.523 1.00 11.76 ? 122 ARG D CB 1 +ATOM 10892 C CG . ARG C 1 102 ? 64.708 49.060 140.277 1.00 11.85 ? 122 ARG D CG 1 +ATOM 10893 C CD . ARG C 1 102 ? 64.080 47.683 140.186 1.00 12.88 ? 122 ARG D CD 1 +ATOM 10894 N NE . ARG C 1 102 ? 62.991 47.502 141.143 1.00 12.75 ? 122 ARG D NE 1 +ATOM 10895 C CZ . ARG C 1 102 ? 61.694 47.717 140.904 1.00 14.31 ? 122 ARG D CZ 1 +ATOM 10896 N NH1 . ARG C 1 102 ? 61.261 48.187 139.736 1.00 13.35 ? 122 ARG D NH1 1 +ATOM 10897 N NH2 . ARG C 1 102 ? 60.811 47.482 141.862 1.00 14.73 ? 122 ARG D NH2 1 +ATOM 10898 N N . ILE C 1 103 ? 67.700 47.579 139.393 1.00 10.17 ? 123 ILE D N 1 +ATOM 10899 C CA . ILE C 1 103 ? 68.238 47.642 138.034 1.00 10.71 ? 123 ILE D CA 1 +ATOM 10900 C C . ILE C 1 103 ? 67.083 47.417 137.056 1.00 10.13 ? 123 ILE D C 1 +ATOM 10901 O O . ILE C 1 103 ? 66.434 46.360 137.071 1.00 10.02 ? 123 ILE D O 1 +ATOM 10902 C CB . ILE C 1 103 ? 69.308 46.558 137.799 1.00 11.18 ? 123 ILE D CB 1 +ATOM 10903 C CG1 . ILE C 1 103 ? 70.419 46.612 138.864 1.00 13.42 ? 123 ILE D CG1 1 +ATOM 10904 C CG2 . ILE C 1 103 ? 69.904 46.689 136.417 1.00 10.97 ? 123 ILE D CG2 1 +ATOM 10905 C CD1 . ILE C 1 103 ? 71.189 47.909 138.950 1.00 16.50 ? 123 ILE D CD1 1 +ATOM 10906 N N . GLY C 1 104 ? 66.835 48.416 136.209 1.00 9.79 ? 124 GLY D N 1 +ATOM 10907 C CA . GLY C 1 104 ? 65.678 48.407 135.320 1.00 9.55 ? 124 GLY D CA 1 +ATOM 10908 C C . GLY C 1 104 ? 65.684 47.237 134.349 1.00 8.66 ? 124 GLY D C 1 +ATOM 10909 O O . GLY C 1 104 ? 64.632 46.691 134.028 1.00 9.24 ? 124 GLY D O 1 +ATOM 10910 N N . SER C 1 105 ? 66.875 46.892 133.857 1.00 8.66 ? 125 SER D N 1 +ATOM 10911 C CA . SER C 1 105 ? 67.075 45.748 132.958 1.00 8.42 ? 125 SER D CA 1 +ATOM 10912 C C . SER C 1 105 ? 68.559 45.520 132.747 1.00 8.84 ? 125 SER D C 1 +ATOM 10913 O O . SER C 1 105 ? 69.366 46.406 133.021 1.00 7.37 ? 125 SER D O 1 +ATOM 10914 C CB . SER C 1 105 ? 66.426 45.988 131.583 1.00 8.77 ? 125 SER D CB 1 +ATOM 10915 O OG . SER C 1 105 ? 67.026 47.068 130.877 1.00 9.04 ? 125 SER D OG 1 +ATOM 10916 N N . ALA C 1 106 ? 68.896 44.345 132.225 1.00 8.80 ? 126 ALA D N 1 +ATOM 10917 C CA . ALA C 1 106 ? 70.272 44.043 131.871 1.00 9.47 ? 126 ALA D CA 1 +ATOM 10918 C C . ALA C 1 106 ? 70.301 43.279 130.543 1.00 9.61 ? 126 ALA D C 1 +ATOM 10919 O O . ALA C 1 106 ? 69.967 43.846 129.494 1.00 10.20 ? 126 ALA D O 1 +ATOM 10920 C CB . ALA C 1 106 ? 70.959 43.282 133.027 1.00 9.65 ? 126 ALA D CB 1 +ATOM 10921 N N . HIS C 1 107 ? 70.674 42.003 130.562 1.00 9.44 ? 127 HIS D N 1 +ATOM 10922 C CA . HIS C 1 107 ? 70.704 41.206 129.346 1.00 9.45 ? 127 HIS D CA 1 +ATOM 10923 C C . HIS C 1 107 ? 70.633 39.708 129.721 1.00 9.85 ? 127 HIS D C 1 +ATOM 10924 O O . HIS C 1 107 ? 69.993 39.350 130.713 1.00 10.75 ? 127 HIS D O 1 +ATOM 10925 C CB . HIS C 1 107 ? 71.939 41.577 128.503 1.00 9.09 ? 127 HIS D CB 1 +ATOM 10926 C CG . HIS C 1 107 ? 71.746 41.401 127.028 1.00 9.64 ? 127 HIS D CG 1 +ATOM 10927 N ND1 . HIS C 1 107 ? 71.686 40.162 126.427 1.00 8.49 ? 127 HIS D ND1 1 +ATOM 10928 C CD2 . HIS C 1 107 ? 71.579 42.310 126.035 1.00 8.85 ? 127 HIS D CD2 1 +ATOM 10929 C CE1 . HIS C 1 107 ? 71.504 40.313 125.126 1.00 10.36 ? 127 HIS D CE1 1 +ATOM 10930 N NE2 . HIS C 1 107 ? 71.438 41.607 124.863 1.00 10.41 ? 127 HIS D NE2 1 +ATOM 10931 N N . SER C 1 108 ? 71.254 38.832 128.941 1.00 9.99 ? 128 SER D N 1 +ATOM 10932 C CA . SER C 1 108 ? 71.102 37.387 129.144 1.00 10.35 ? 128 SER D CA 1 +ATOM 10933 C C . SER C 1 108 ? 71.451 36.987 130.568 1.00 10.09 ? 128 SER D C 1 +ATOM 10934 O O . SER C 1 108 ? 70.709 36.247 131.181 1.00 10.26 ? 128 SER D O 1 +ATOM 10935 C CB . SER C 1 108 ? 71.954 36.590 128.162 1.00 10.30 ? 128 SER D CB 1 +ATOM 10936 O OG . SER C 1 108 ? 71.419 36.658 126.865 1.00 13.09 ? 128 SER D OG 1 +ATOM 10937 N N . TYR C 1 109 ? 72.580 37.475 131.070 1.00 10.20 ? 129 TYR D N 1 +ATOM 10938 C CA . TYR C 1 109 ? 72.922 37.320 132.491 1.00 10.69 ? 129 TYR D CA 1 +ATOM 10939 C C . TYR C 1 109 ? 73.500 38.614 133.065 1.00 10.25 ? 129 TYR D C 1 +ATOM 10940 O O . TYR C 1 109 ? 74.178 39.360 132.363 1.00 10.16 ? 129 TYR D O 1 +ATOM 10941 C CB . TYR C 1 109 ? 73.903 36.160 132.730 1.00 11.32 ? 129 TYR D CB 1 +ATOM 10942 C CG . TYR C 1 109 ? 73.650 35.466 134.054 1.00 11.96 ? 129 TYR D CG 1 +ATOM 10943 C CD1 . TYR C 1 109 ? 72.654 34.498 134.172 1.00 13.60 ? 129 TYR D CD1 1 +ATOM 10944 C CD2 . TYR C 1 109 ? 74.346 35.826 135.201 1.00 12.57 ? 129 TYR D CD2 1 +ATOM 10945 C CE1 . TYR C 1 109 ? 72.388 33.885 135.395 1.00 13.61 ? 129 TYR D CE1 1 +ATOM 10946 C CE2 . TYR C 1 109 ? 74.080 35.219 136.436 1.00 13.03 ? 129 TYR D CE2 1 +ATOM 10947 C CZ . TYR C 1 109 ? 73.098 34.250 136.521 1.00 13.20 ? 129 TYR D CZ 1 +ATOM 10948 O OH . TYR C 1 109 ? 72.819 33.643 137.732 1.00 15.05 ? 129 TYR D OH 1 +ATOM 10949 N N . ALA C 1 110 ? 73.230 38.860 134.343 1.00 9.93 ? 130 ALA D N 1 +ATOM 10950 C CA . ALA C 1 110 ? 73.868 39.944 135.079 1.00 10.01 ? 130 ALA D CA 1 +ATOM 10951 C C . ALA C 1 110 ? 74.186 39.518 136.507 1.00 10.14 ? 130 ALA D C 1 +ATOM 10952 O O . ALA C 1 110 ? 73.385 38.852 137.151 1.00 10.41 ? 130 ALA D O 1 +ATOM 10953 C CB . ALA C 1 110 ? 72.969 41.195 135.094 1.00 9.88 ? 130 ALA D CB 1 +ATOM 10954 N N . ILE C 1 111 ? 75.370 39.896 136.982 1.00 10.57 ? 131 ILE D N 1 +ATOM 10955 C CA . ILE C 1 111 ? 75.758 39.718 138.378 1.00 11.07 ? 131 ILE D CA 1 +ATOM 10956 C C . ILE C 1 111 ? 76.101 41.090 138.923 1.00 10.86 ? 131 ILE D C 1 +ATOM 10957 O O . ILE C 1 111 ? 76.761 41.865 138.248 1.00 10.87 ? 131 ILE D O 1 +ATOM 10958 C CB . ILE C 1 111 ? 76.997 38.819 138.519 1.00 11.22 ? 131 ILE D CB 1 +ATOM 10959 C CG1 . ILE C 1 111 ? 76.742 37.435 137.926 1.00 11.60 ? 131 ILE D CG1 1 +ATOM 10960 C CG2 . ILE C 1 111 ? 77.392 38.681 139.987 1.00 12.53 ? 131 ILE D CG2 1 +ATOM 10961 C CD1 . ILE C 1 111 ? 78.038 36.697 137.580 1.00 12.03 ? 131 ILE D CD1 1 +ATOM 10962 N N . VAL C 1 112 ? 75.646 41.373 140.139 1.00 11.05 ? 132 VAL D N 1 +ATOM 10963 C CA . VAL C 1 112 ? 75.896 42.638 140.811 1.00 10.85 ? 132 VAL D CA 1 +ATOM 10964 C C . VAL C 1 112 ? 76.697 42.394 142.085 1.00 11.28 ? 132 VAL D C 1 +ATOM 10965 O O . VAL C 1 112 ? 76.333 41.541 142.901 1.00 11.03 ? 132 VAL D O 1 +ATOM 10966 C CB . VAL C 1 112 ? 74.580 43.304 141.182 1.00 10.88 ? 132 VAL D CB 1 +ATOM 10967 C CG1 . VAL C 1 112 ? 74.808 44.653 141.867 1.00 11.61 ? 132 VAL D CG1 1 +ATOM 10968 C CG2 . VAL C 1 112 ? 73.709 43.462 139.929 1.00 10.34 ? 132 VAL D CG2 1 +ATOM 10969 N N . TRP C 1 113 ? 77.787 43.138 142.249 1.00 12.09 ? 133 TRP D N 1 +ATOM 10970 C CA . TRP C 1 113 ? 78.541 43.152 143.499 1.00 12.64 ? 133 TRP D CA 1 +ATOM 10971 C C . TRP C 1 113 ? 78.365 44.517 144.167 1.00 13.15 ? 133 TRP D C 1 +ATOM 10972 O O . TRP C 1 113 ? 78.361 45.560 143.496 1.00 12.54 ? 133 TRP D O 1 +ATOM 10973 C CB . TRP C 1 113 ? 80.043 42.922 143.256 1.00 13.11 ? 133 TRP D CB 1 +ATOM 10974 C CG . TRP C 1 113 ? 80.415 41.605 142.655 1.00 13.38 ? 133 TRP D CG 1 +ATOM 10975 C CD1 . TRP C 1 113 ? 80.870 40.500 143.323 1.00 13.67 ? 133 TRP D CD1 1 +ATOM 10976 C CD2 . TRP C 1 113 ? 80.431 41.264 141.265 1.00 13.84 ? 133 TRP D CD2 1 +ATOM 10977 N NE1 . TRP C 1 113 ? 81.140 39.484 142.438 1.00 13.71 ? 133 TRP D NE1 1 +ATOM 10978 C CE2 . TRP C 1 113 ? 80.879 39.924 141.167 1.00 14.40 ? 133 TRP D CE2 1 +ATOM 10979 C CE3 . TRP C 1 113 ? 80.104 41.951 140.095 1.00 13.21 ? 133 TRP D CE3 1 +ATOM 10980 C CZ2 . TRP C 1 113 ? 81.005 39.264 139.943 1.00 13.98 ? 133 TRP D CZ2 1 +ATOM 10981 C CZ3 . TRP C 1 113 ? 80.226 41.295 138.884 1.00 13.56 ? 133 TRP D CZ3 1 +ATOM 10982 C CH2 . TRP C 1 113 ? 80.682 39.968 138.813 1.00 14.24 ? 133 TRP D CH2 1 +ATOM 10983 N N . VAL C 1 114 ? 78.225 44.507 145.490 1.00 13.91 ? 134 VAL D N 1 +ATOM 10984 C CA . VAL C 1 114 ? 78.121 45.737 146.276 1.00 14.35 ? 134 VAL D CA 1 +ATOM 10985 C C . VAL C 1 114 ? 79.310 45.761 147.214 1.00 14.48 ? 134 VAL D C 1 +ATOM 10986 O O . VAL C 1 114 ? 79.466 44.854 148.024 1.00 14.99 ? 134 VAL D O 1 +ATOM 10987 C CB . VAL C 1 114 ? 76.800 45.790 147.039 1.00 14.62 ? 134 VAL D CB 1 +ATOM 10988 C CG1 . VAL C 1 114 ? 76.818 46.890 148.086 1.00 15.26 ? 134 VAL D CG1 1 +ATOM 10989 C CG2 . VAL C 1 114 ? 75.648 45.984 146.050 1.00 14.71 ? 134 VAL D CG2 1 +ATOM 10990 N N . ASN C 1 115 ? 80.162 46.780 147.078 1.00 15.33 ? 135 ASN D N 1 +ATOM 10991 C CA . ASN C 1 115 ? 81.447 46.817 147.777 1.00 15.80 ? 135 ASN D CA 1 +ATOM 10992 C C . ASN C 1 115 ? 82.205 45.474 147.681 1.00 15.90 ? 135 ASN D C 1 +ATOM 10993 O O . ASN C 1 115 ? 82.729 44.964 148.675 1.00 15.98 ? 135 ASN D O 1 +ATOM 10994 C CB . ASN C 1 115 ? 81.235 47.221 149.239 1.00 16.00 ? 135 ASN D CB 1 +ATOM 10995 C CG . ASN C 1 115 ? 80.772 48.663 149.390 1.00 17.20 ? 135 ASN D CG 1 +ATOM 10996 O OD1 . ASN C 1 115 ? 81.033 49.501 148.528 1.00 18.43 ? 135 ASN D OD1 1 +ATOM 10997 N ND2 . ASN C 1 115 ? 80.099 48.960 150.497 1.00 19.89 ? 135 ASN D ND2 1 +ATOM 10998 N N . GLY C 1 116 ? 82.247 44.903 146.479 1.00 15.93 ? 136 GLY D N 1 +ATOM 10999 C CA . GLY C 1 116 ? 82.977 43.658 146.220 1.00 15.83 ? 136 GLY D CA 1 +ATOM 11000 C C . GLY C 1 116 ? 82.285 42.370 146.624 1.00 16.12 ? 136 GLY D C 1 +ATOM 11001 O O . GLY C 1 116 ? 82.808 41.292 146.360 1.00 16.36 ? 136 GLY D O 1 +ATOM 11002 N N . VAL C 1 117 ? 81.106 42.477 147.236 1.00 16.20 ? 137 VAL D N 1 +ATOM 11003 C CA . VAL C 1 117 ? 80.341 41.324 147.703 1.00 16.07 ? 137 VAL D CA 1 +ATOM 11004 C C . VAL C 1 117 ? 79.228 41.018 146.715 1.00 16.12 ? 137 VAL D C 1 +ATOM 11005 O O . VAL C 1 117 ? 78.402 41.883 146.432 1.00 15.64 ? 137 VAL D O 1 +ATOM 11006 C CB . VAL C 1 117 ? 79.679 41.600 149.061 1.00 16.42 ? 137 VAL D CB 1 +ATOM 11007 C CG1 . VAL C 1 117 ? 78.812 40.403 149.497 1.00 16.51 ? 137 VAL D CG1 1 +ATOM 11008 C CG2 . VAL C 1 117 ? 80.728 41.929 150.113 1.00 16.59 ? 137 VAL D CG2 1 +ATOM 11009 N N A ASP C 1 118 ? 79.190 39.782 146.234 0.50 16.09 ? 138 ASP D N 1 +ATOM 11010 N N B ASP C 1 118 ? 79.227 39.805 146.155 0.50 15.99 ? 138 ASP D N 1 +ATOM 11011 C CA A ASP C 1 118 ? 78.199 39.330 145.258 0.50 16.12 ? 138 ASP D CA 1 +ATOM 11012 C CA B ASP C 1 118 ? 78.171 39.434 145.214 0.50 15.92 ? 138 ASP D CA 1 +ATOM 11013 C C A ASP C 1 118 ? 76.791 39.274 145.890 0.50 16.19 ? 138 ASP D C 1 +ATOM 11014 C C B ASP C 1 118 ? 76.854 39.443 145.979 0.50 16.03 ? 138 ASP D C 1 +ATOM 11015 O O A ASP C 1 118 ? 76.551 38.449 146.773 0.50 16.50 ? 138 ASP D O 1 +ATOM 11016 O O B ASP C 1 118 ? 76.765 38.922 147.091 0.50 16.18 ? 138 ASP D O 1 +ATOM 11017 C CB A ASP C 1 118 ? 78.682 37.963 144.726 0.50 16.49 ? 138 ASP D CB 1 +ATOM 11018 C CB B ASP C 1 118 ? 78.446 38.106 144.474 0.50 16.25 ? 138 ASP D CB 1 +ATOM 11019 C CG A ASP C 1 118 ? 77.586 37.120 144.127 0.50 16.92 ? 138 ASP D CG 1 +ATOM 11020 C CG B ASP C 1 118 ? 78.531 36.896 145.397 0.50 16.33 ? 138 ASP D CG 1 +ATOM 11021 O OD1 A ASP C 1 118 ? 76.670 37.678 143.502 0.50 17.99 ? 138 ASP D OD1 1 +ATOM 11022 O OD1 B ASP C 1 118 ? 77.475 36.348 145.774 0.50 17.93 ? 138 ASP D OD1 1 +ATOM 11023 O OD2 A ASP C 1 118 ? 77.668 35.876 144.273 0.50 18.30 ? 138 ASP D OD2 1 +ATOM 11024 O OD2 B ASP C 1 118 ? 79.659 36.461 145.702 0.50 17.93 ? 138 ASP D OD2 1 +ATOM 11025 N N . THR C 1 119 ? 75.864 40.120 145.412 1.00 15.95 ? 139 THR D N 1 +ATOM 11026 C CA . THR C 1 119 ? 74.576 40.382 146.101 1.00 16.06 ? 139 THR D CA 1 +ATOM 11027 C C . THR C 1 119 ? 73.293 40.147 145.299 1.00 15.20 ? 139 THR D C 1 +ATOM 11028 O O . THR C 1 119 ? 72.203 40.074 145.885 1.00 15.07 ? 139 THR D O 1 +ATOM 11029 C CB . THR C 1 119 ? 74.502 41.865 146.521 1.00 16.44 ? 139 THR D CB 1 +ATOM 11030 O OG1 . THR C 1 119 ? 75.759 42.273 147.059 1.00 19.47 ? 139 THR D OG1 1 +ATOM 11031 C CG2 . THR C 1 119 ? 73.387 42.088 147.549 1.00 17.07 ? 139 THR D CG2 1 +ATOM 11032 N N . LEU C 1 120 ? 73.402 40.066 143.977 1.00 14.39 ? 140 LEU D N 1 +ATOM 11033 C CA . LEU C 1 120 ? 72.229 40.018 143.107 1.00 13.74 ? 140 LEU D CA 1 +ATOM 11034 C C . LEU C 1 120 ? 72.599 39.456 141.726 1.00 14.10 ? 140 LEU D C 1 +ATOM 11035 O O . LEU C 1 120 ? 73.626 39.826 141.145 1.00 14.34 ? 140 LEU D O 1 +ATOM 11036 C CB . LEU C 1 120 ? 71.647 41.426 142.973 1.00 13.55 ? 140 LEU D CB 1 +ATOM 11037 C CG . LEU C 1 120 ? 70.406 41.622 142.099 1.00 13.36 ? 140 LEU D CG 1 +ATOM 11038 C CD1 . LEU C 1 120 ? 69.267 40.711 142.540 1.00 13.82 ? 140 LEU D CD1 1 +ATOM 11039 C CD2 . LEU C 1 120 ? 69.993 43.086 142.150 1.00 13.65 ? 140 LEU D CD2 1 +ATOM 11040 N N . GLU C 1 121 ? 71.784 38.529 141.227 1.00 14.16 ? 141 GLU D N 1 +ATOM 11041 C CA . GLU C 1 121 ? 71.938 38.001 139.878 1.00 15.16 ? 141 GLU D CA 1 +ATOM 11042 C C . GLU C 1 121 ? 70.576 37.971 139.199 1.00 13.94 ? 141 GLU D C 1 +ATOM 11043 O O . GLU C 1 121 ? 69.547 37.957 139.877 1.00 14.13 ? 141 GLU D O 1 +ATOM 11044 C CB . GLU C 1 121 ? 72.545 36.595 139.910 1.00 15.33 ? 141 GLU D CB 1 +ATOM 11045 C CG . GLU C 1 121 ? 73.956 36.562 140.467 1.00 17.18 ? 141 GLU D CG 1 +ATOM 11046 C CD . GLU C 1 121 ? 74.563 35.162 140.542 1.00 18.59 ? 141 GLU D CD 1 +ATOM 11047 O OE1 . GLU C 1 121 ? 74.060 34.222 139.887 1.00 21.92 ? 141 GLU D OE1 1 +ATOM 11048 O OE2 . GLU C 1 121 ? 75.568 35.005 141.267 1.00 22.97 ? 141 GLU D OE2 1 +ATOM 11049 N N . HIS C 1 122 ? 70.575 38.000 137.868 1.00 12.86 ? 142 HIS D N 1 +ATOM 11050 C CA . HIS C 1 122 ? 69.342 37.896 137.084 1.00 11.85 ? 142 HIS D CA 1 +ATOM 11051 C C . HIS C 1 122 ? 69.617 37.342 135.697 1.00 11.99 ? 142 HIS D C 1 +ATOM 11052 O O . HIS C 1 122 ? 70.602 37.723 135.045 1.00 10.78 ? 142 HIS D O 1 +ATOM 11053 C CB . HIS C 1 122 ? 68.667 39.256 136.942 1.00 11.93 ? 142 HIS D CB 1 +ATOM 11054 C CG . HIS C 1 122 ? 67.340 39.210 136.255 1.00 10.15 ? 142 HIS D CG 1 +ATOM 11055 N ND1 . HIS C 1 122 ? 67.185 39.481 134.915 1.00 10.81 ? 142 HIS D ND1 1 +ATOM 11056 C CD2 . HIS C 1 122 ? 66.099 38.950 136.730 1.00 12.02 ? 142 HIS D CD2 1 +ATOM 11057 C CE1 . HIS C 1 122 ? 65.905 39.398 134.594 1.00 10.82 ? 142 HIS D CE1 1 +ATOM 11058 N NE2 . HIS C 1 122 ? 65.224 39.079 135.677 1.00 11.23 ? 142 HIS D NE2 1 +ATOM 11059 N N . GLU C 1 123 ? 68.733 36.441 135.262 1.00 11.55 ? 143 GLU D N 1 +ATOM 11060 C CA . GLU C 1 123 ? 68.760 35.896 133.918 1.00 11.74 ? 143 GLU D CA 1 +ATOM 11061 C C . GLU C 1 123 ? 67.669 36.557 133.078 1.00 11.30 ? 143 GLU D C 1 +ATOM 11062 O O . GLU C 1 123 ? 66.511 36.658 133.508 1.00 11.72 ? 143 GLU D O 1 +ATOM 11063 C CB . GLU C 1 123 ? 68.564 34.369 133.965 1.00 12.39 ? 143 GLU D CB 1 +ATOM 11064 C CG . GLU C 1 123 ? 69.033 33.624 132.718 1.00 14.50 ? 143 GLU D CG 1 +ATOM 11065 C CD . GLU C 1 123 ? 68.048 33.662 131.560 1.00 17.24 ? 143 GLU D CD 1 +ATOM 11066 O OE1 . GLU C 1 123 ? 66.842 33.884 131.780 1.00 17.76 ? 143 GLU D OE1 1 +ATOM 11067 O OE2 . GLU C 1 123 ? 68.488 33.461 130.409 1.00 20.76 ? 143 GLU D OE2 1 +ATOM 11068 N N . GLY C 1 124 ? 68.045 37.032 131.890 1.00 10.01 ? 144 GLY D N 1 +ATOM 11069 C CA . GLY C 1 124 ? 67.082 37.532 130.913 1.00 9.75 ? 144 GLY D CA 1 +ATOM 11070 C C . GLY C 1 124 ? 67.050 39.043 130.860 1.00 9.11 ? 144 GLY D C 1 +ATOM 11071 O O . GLY C 1 124 ? 67.165 39.717 131.890 1.00 9.04 ? 144 GLY D O 1 +ATOM 11072 N N . GLY C 1 125 ? 66.885 39.574 129.655 1.00 8.38 ? 145 GLY D N 1 +ATOM 11073 C CA . GLY C 1 125 ? 66.872 41.018 129.443 1.00 8.42 ? 145 GLY D CA 1 +ATOM 11074 C C . GLY C 1 125 ? 65.470 41.590 129.543 1.00 8.33 ? 145 GLY D C 1 +ATOM 11075 O O . GLY C 1 125 ? 64.496 40.846 129.723 1.00 8.20 ? 145 GLY D O 1 +ATOM 11076 N N . TYR C 1 126 ? 65.389 42.923 129.429 1.00 8.51 ? 146 TYR D N 1 +ATOM 11077 C CA . TYR C 1 126 ? 64.127 43.659 129.318 1.00 8.70 ? 146 TYR D CA 1 +ATOM 11078 C C . TYR C 1 126 ? 63.235 43.647 130.552 1.00 8.73 ? 146 TYR D C 1 +ATOM 11079 O O . TYR C 1 126 ? 62.086 44.128 130.478 1.00 9.29 ? 146 TYR D O 1 +ATOM 11080 C CB . TYR C 1 126 ? 63.351 43.178 128.072 1.00 8.63 ? 146 TYR D CB 1 +ATOM 11081 C CG . TYR C 1 126 ? 64.223 43.202 126.821 1.00 9.36 ? 146 TYR D CG 1 +ATOM 11082 C CD1 . TYR C 1 126 ? 64.662 44.407 126.282 1.00 10.06 ? 146 TYR D CD1 1 +ATOM 11083 C CD2 . TYR C 1 126 ? 64.633 42.024 126.203 1.00 8.07 ? 146 TYR D CD2 1 +ATOM 11084 C CE1 . TYR C 1 126 ? 65.489 44.446 125.144 1.00 9.29 ? 146 TYR D CE1 1 +ATOM 11085 C CE2 . TYR C 1 126 ? 65.456 42.048 125.064 1.00 9.03 ? 146 TYR D CE2 1 +ATOM 11086 C CZ . TYR C 1 126 ? 65.877 43.271 124.534 1.00 9.05 ? 146 TYR D CZ 1 +ATOM 11087 O OH . TYR C 1 126 ? 66.702 43.304 123.412 1.00 9.45 ? 146 TYR D OH 1 +ATOM 11088 N N . LEU C 1 127 ? 63.752 43.122 131.667 1.00 8.42 ? 147 LEU D N 1 +ATOM 11089 C CA . LEU C 1 127 ? 62.986 42.981 132.906 1.00 8.52 ? 147 LEU D CA 1 +ATOM 11090 C C . LEU C 1 127 ? 63.777 43.394 134.159 1.00 8.48 ? 147 LEU D C 1 +ATOM 11091 O O . LEU C 1 127 ? 64.984 43.183 134.239 1.00 8.13 ? 147 LEU D O 1 +ATOM 11092 C CB . LEU C 1 127 ? 62.467 41.553 133.037 1.00 8.25 ? 147 LEU D CB 1 +ATOM 11093 C CG . LEU C 1 127 ? 61.308 41.222 132.085 1.00 9.26 ? 147 LEU D CG 1 +ATOM 11094 C CD1 . LEU C 1 127 ? 61.041 39.713 131.986 1.00 9.52 ? 147 LEU D CD1 1 +ATOM 11095 C CD2 . LEU C 1 127 ? 60.062 41.921 132.549 1.00 9.05 ? 147 LEU D CD2 1 +ATOM 11096 N N . PRO C 1 128 ? 63.101 44.046 135.112 1.00 8.73 ? 148 PRO D N 1 +ATOM 11097 C CA . PRO C 1 128 ? 63.763 44.595 136.290 1.00 9.85 ? 148 PRO D CA 1 +ATOM 11098 C C . PRO C 1 128 ? 64.137 43.556 137.336 1.00 10.22 ? 148 PRO D C 1 +ATOM 11099 O O . PRO C 1 128 ? 63.517 42.492 137.418 1.00 10.38 ? 148 PRO D O 1 +ATOM 11100 C CB . PRO C 1 128 ? 62.719 45.544 136.848 1.00 10.15 ? 148 PRO D CB 1 +ATOM 11101 C CG . PRO C 1 128 ? 61.418 44.929 136.446 1.00 9.80 ? 148 PRO D CG 1 +ATOM 11102 C CD . PRO C 1 128 ? 61.661 44.378 135.092 1.00 9.30 ? 148 PRO D CD 1 +ATOM 11103 N N . PHE C 1 129 ? 65.159 43.881 138.117 1.00 10.46 ? 149 PHE D N 1 +ATOM 11104 C CA . PHE C 1 129 ? 65.533 43.073 139.266 1.00 10.92 ? 149 PHE D CA 1 +ATOM 11105 C C . PHE C 1 129 ? 66.136 43.935 140.360 1.00 11.25 ? 149 PHE D C 1 +ATOM 11106 O O . PHE C 1 129 ? 66.666 45.024 140.099 1.00 12.58 ? 149 PHE D O 1 +ATOM 11107 C CB . PHE C 1 129 ? 66.454 41.906 138.862 1.00 11.21 ? 149 PHE D CB 1 +ATOM 11108 C CG . PHE C 1 129 ? 67.696 42.316 138.115 1.00 9.97 ? 149 PHE D CG 1 +ATOM 11109 C CD1 . PHE C 1 129 ? 67.650 42.628 136.762 1.00 10.87 ? 149 PHE D CD1 1 +ATOM 11110 C CD2 . PHE C 1 129 ? 68.922 42.358 138.758 1.00 10.45 ? 149 PHE D CD2 1 +ATOM 11111 C CE1 . PHE C 1 129 ? 68.810 42.979 136.081 1.00 10.66 ? 149 PHE D CE1 1 +ATOM 11112 C CE2 . PHE C 1 129 ? 70.075 42.715 138.092 1.00 12.25 ? 149 PHE D CE2 1 +ATOM 11113 C CZ . PHE C 1 129 ? 70.029 43.029 136.756 1.00 10.92 ? 149 PHE D CZ 1 +ATOM 11114 N N . GLU C 1 130 ? 66.023 43.471 141.598 1.00 11.95 ? 150 GLU D N 1 +ATOM 11115 C CA . GLU C 1 130 ? 66.452 44.261 142.743 1.00 12.72 ? 150 GLU D CA 1 +ATOM 11116 C C . GLU C 1 130 ? 66.947 43.411 143.904 1.00 12.25 ? 150 GLU D C 1 +ATOM 11117 O O . GLU C 1 130 ? 66.747 42.193 143.932 1.00 12.85 ? 150 GLU D O 1 +ATOM 11118 C CB . GLU C 1 130 ? 65.311 45.163 143.223 1.00 12.34 ? 150 GLU D CB 1 +ATOM 11119 C CG . GLU C 1 130 ? 64.204 44.442 143.984 1.00 13.46 ? 150 GLU D CG 1 +ATOM 11120 C CD . GLU C 1 130 ? 63.121 45.374 144.499 1.00 13.86 ? 150 GLU D CD 1 +ATOM 11121 O OE1 . GLU C 1 130 ? 62.989 46.497 143.972 1.00 15.67 ? 150 GLU D OE1 1 +ATOM 11122 O OE2 . GLU C 1 130 ? 62.391 44.987 145.443 1.00 14.29 ? 150 GLU D OE2 1 +ATOM 11123 N N . ALA C 1 131 ? 67.570 44.087 144.860 1.00 13.02 ? 151 ALA D N 1 +ATOM 11124 C CA . ALA C 1 131 ? 68.124 43.460 146.051 1.00 13.03 ? 151 ALA D CA 1 +ATOM 11125 C C . ALA C 1 131 ? 68.059 44.456 147.203 1.00 13.82 ? 151 ALA D C 1 +ATOM 11126 O O . ALA C 1 131 ? 68.397 45.631 147.035 1.00 13.09 ? 151 ALA D O 1 +ATOM 11127 C CB . ALA C 1 131 ? 69.555 43.057 145.813 1.00 13.56 ? 151 ALA D CB 1 +ATOM 11128 N N . ASP C 1 132 ? 67.624 43.970 148.363 1.00 14.05 ? 152 ASP D N 1 +ATOM 11129 C CA . ASP C 1 132 ? 67.737 44.713 149.610 1.00 14.83 ? 152 ASP D CA 1 +ATOM 11130 C C . ASP C 1 132 ? 69.205 44.700 150.038 1.00 15.26 ? 152 ASP D C 1 +ATOM 11131 O O . ASP C 1 132 ? 69.739 43.640 150.376 1.00 15.01 ? 152 ASP D O 1 +ATOM 11132 C CB . ASP C 1 132 ? 66.849 44.048 150.677 1.00 15.36 ? 152 ASP D CB 1 +ATOM 11133 C CG . ASP C 1 132 ? 66.865 44.771 152.010 1.00 16.37 ? 152 ASP D CG 1 +ATOM 11134 O OD1 . ASP C 1 132 ? 67.840 45.479 152.316 1.00 18.20 ? 152 ASP D OD1 1 +ATOM 11135 O OD2 . ASP C 1 132 ? 65.885 44.604 152.766 1.00 17.34 ? 152 ASP D OD2 1 +ATOM 11136 N N . ILE C 1 133 ? 69.849 45.870 150.011 1.00 15.23 ? 153 ILE D N 1 +ATOM 11137 C CA . ILE C 1 133 ? 71.271 46.003 150.398 1.00 15.70 ? 153 ILE D CA 1 +ATOM 11138 C C . ILE C 1 133 ? 71.477 46.709 151.755 1.00 16.14 ? 153 ILE D C 1 +ATOM 11139 O O . ILE C 1 133 ? 72.553 47.244 152.021 1.00 16.31 ? 153 ILE D O 1 +ATOM 11140 C CB . ILE C 1 133 ? 72.109 46.729 149.292 1.00 15.35 ? 153 ILE D CB 1 +ATOM 11141 C CG1 . ILE C 1 133 ? 71.622 48.169 149.068 1.00 15.77 ? 153 ILE D CG1 1 +ATOM 11142 C CG2 . ILE C 1 133 ? 72.066 45.926 147.977 1.00 15.93 ? 153 ILE D CG2 1 +ATOM 11143 C CD1 . ILE C 1 133 ? 72.502 48.986 148.082 1.00 15.79 ? 153 ILE D CD1 1 +ATOM 11144 N N . SER C 1 134 ? 70.450 46.704 152.605 1.00 17.30 ? 154 SER D N 1 +ATOM 11145 C CA . SER C 1 134 ? 70.518 47.350 153.914 1.00 17.88 ? 154 SER D CA 1 +ATOM 11146 C C . SER C 1 134 ? 71.704 46.842 154.740 1.00 18.94 ? 154 SER D C 1 +ATOM 11147 O O . SER C 1 134 ? 72.436 47.626 155.336 1.00 18.55 ? 154 SER D O 1 +ATOM 11148 C CB . SER C 1 134 ? 69.218 47.113 154.677 1.00 18.12 ? 154 SER D CB 1 +ATOM 11149 O OG . SER C 1 134 ? 68.104 47.486 153.890 1.00 16.92 ? 154 SER D OG 1 +ATOM 11150 N N . ASN C 1 135 ? 71.891 45.525 154.749 1.00 20.63 ? 155 ASN D N 1 +ATOM 11151 C CA . ASN C 1 135 ? 72.995 44.897 155.483 1.00 21.98 ? 155 ASN D CA 1 +ATOM 11152 C C . ASN C 1 135 ? 74.386 45.395 155.065 1.00 22.78 ? 155 ASN D C 1 +ATOM 11153 O O . ASN C 1 135 ? 75.249 45.636 155.917 1.00 23.61 ? 155 ASN D O 1 +ATOM 11154 C CB . ASN C 1 135 ? 72.896 43.359 155.355 1.00 22.17 ? 155 ASN D CB 1 +ATOM 11155 C CG A ASN C 1 135 ? 72.062 42.779 156.484 0.50 22.74 ? 155 ASN D CG 1 +ATOM 11156 C CG B ASN C 1 135 ? 73.487 42.886 154.034 0.50 22.13 ? 155 ASN D CG 1 +ATOM 11157 O OD1 A ASN C 1 135 ? 71.737 43.464 157.454 0.50 22.93 ? 155 ASN D OD1 1 +ATOM 11158 O OD1 B ASN C 1 135 ? 73.125 43.395 152.973 0.50 22.11 ? 155 ASN D OD1 1 +ATOM 11159 N ND2 A ASN C 1 135 ? 71.695 41.504 156.351 0.50 24.18 ? 155 ASN D ND2 1 +ATOM 11160 N ND2 B ASN C 1 135 ? 74.383 41.900 154.089 0.50 21.64 ? 155 ASN D ND2 1 +ATOM 11161 N N . LEU C 1 136 ? 74.595 45.570 153.762 1.00 23.47 ? 156 LEU D N 1 +ATOM 11162 C CA . LEU C 1 136 ? 75.891 45.992 153.228 1.00 23.62 ? 156 LEU D CA 1 +ATOM 11163 C C . LEU C 1 136 ? 76.111 47.504 153.357 1.00 23.90 ? 156 LEU D C 1 +ATOM 11164 O O . LEU C 1 136 ? 77.243 47.977 153.352 1.00 23.43 ? 156 LEU D O 1 +ATOM 11165 C CB . LEU C 1 136 ? 76.015 45.554 151.770 1.00 23.74 ? 156 LEU D CB 1 +ATOM 11166 C CG . LEU C 1 136 ? 76.112 44.030 151.617 1.00 24.24 ? 156 LEU D CG 1 +ATOM 11167 C CD1 . LEU C 1 136 ? 75.573 43.564 150.267 1.00 24.89 ? 156 LEU D CD1 1 +ATOM 11168 C CD2 . LEU C 1 136 ? 77.551 43.572 151.835 1.00 24.86 ? 156 LEU D CD2 1 +ATOM 11169 N N . VAL C 1 137 ? 75.016 48.247 153.482 1.00 24.63 ? 157 VAL D N 1 +ATOM 11170 C CA . VAL C 1 137 ? 75.050 49.704 153.582 1.00 25.24 ? 157 VAL D CA 1 +ATOM 11171 C C . VAL C 1 137 ? 75.160 50.165 155.040 1.00 25.76 ? 157 VAL D C 1 +ATOM 11172 O O . VAL C 1 137 ? 75.726 51.224 155.317 1.00 25.82 ? 157 VAL D O 1 +ATOM 11173 C CB . VAL C 1 137 ? 73.780 50.317 152.927 1.00 25.40 ? 157 VAL D CB 1 +ATOM 11174 C CG1 . VAL C 1 137 ? 73.569 51.761 153.364 1.00 25.59 ? 157 VAL D CG1 1 +ATOM 11175 C CG2 . VAL C 1 137 ? 73.872 50.220 151.409 1.00 25.55 ? 157 VAL D CG2 1 +ATOM 11176 N N . GLN C 1 138 ? 74.616 49.372 155.964 1.00 26.49 ? 158 GLN D N 1 +ATOM 11177 C CA . GLN C 1 138 ? 74.512 49.768 157.367 1.00 27.26 ? 158 GLN D CA 1 +ATOM 11178 C C . GLN C 1 138 ? 75.470 49.005 158.286 1.00 28.47 ? 158 GLN D C 1 +ATOM 11179 O O . GLN C 1 138 ? 75.225 48.899 159.486 1.00 29.14 ? 158 GLN D O 1 +ATOM 11180 C CB . GLN C 1 138 ? 73.065 49.592 157.840 1.00 26.83 ? 158 GLN D CB 1 +ATOM 11181 C CG . GLN C 1 138 ? 72.092 50.500 157.103 1.00 26.38 ? 158 GLN D CG 1 +ATOM 11182 C CD . GLN C 1 138 ? 70.635 50.132 157.309 1.00 25.18 ? 158 GLN D CD 1 +ATOM 11183 O OE1 . GLN C 1 138 ? 70.314 49.043 157.790 1.00 23.27 ? 158 GLN D OE1 1 +ATOM 11184 N NE2 . GLN C 1 138 ? 69.741 51.040 156.927 1.00 22.63 ? 158 GLN D NE2 1 +ATOM 11185 N N . VAL C 1 139 ? 76.556 48.475 157.729 1.00 29.83 ? 159 VAL D N 1 +ATOM 11186 C CA . VAL C 1 139 ? 77.613 47.849 158.531 1.00 30.59 ? 159 VAL D CA 1 +ATOM 11187 C C . VAL C 1 139 ? 78.836 47.537 157.672 1.00 30.83 ? 159 VAL D C 1 +ATOM 11188 O O . VAL C 1 139 ? 78.723 47.354 156.457 1.00 31.38 ? 159 VAL D O 1 +ATOM 11189 C CB . VAL C 1 139 ? 77.128 46.547 159.232 1.00 30.96 ? 159 VAL D CB 1 +ATOM 11190 C CG1 . VAL C 1 139 ? 77.006 45.400 158.232 1.00 31.58 ? 159 VAL D CG1 1 +ATOM 11191 C CG2 . VAL C 1 139 ? 78.064 46.174 160.379 1.00 31.57 ? 159 VAL D CG2 1 +ATOM 11192 N N . SER C 1 144 ? 83.936 56.179 152.589 1.00 31.03 ? 164 SER D N 1 +ATOM 11193 C CA . SER C 1 144 ? 82.539 55.890 152.920 1.00 30.92 ? 164 SER D CA 1 +ATOM 11194 C C . SER C 1 144 ? 81.665 55.922 151.672 1.00 30.25 ? 164 SER D C 1 +ATOM 11195 O O . SER C 1 144 ? 80.697 56.687 151.595 1.00 30.36 ? 164 SER D O 1 +ATOM 11196 C CB . SER C 1 144 ? 82.019 56.891 153.963 1.00 31.02 ? 164 SER D CB 1 +ATOM 11197 O OG . SER C 1 144 ? 82.890 56.962 155.083 1.00 32.01 ? 164 SER D OG 1 +ATOM 11198 N N . ARG C 1 145 ? 82.010 55.082 150.696 1.00 29.20 ? 165 ARG D N 1 +ATOM 11199 C CA . ARG C 1 145 ? 81.274 55.026 149.434 1.00 28.30 ? 165 ARG D CA 1 +ATOM 11200 C C . ARG C 1 145 ? 80.646 53.654 149.212 1.00 26.27 ? 165 ARG D C 1 +ATOM 11201 O O . ARG C 1 145 ? 81.223 52.631 149.575 1.00 26.70 ? 165 ARG D O 1 +ATOM 11202 C CB . ARG C 1 145 ? 82.196 55.357 148.256 1.00 28.36 ? 165 ARG D CB 1 +ATOM 11203 C CG . ARG C 1 145 ? 82.665 56.813 148.184 1.00 29.49 ? 165 ARG D CG 1 +ATOM 11204 C CD . ARG C 1 145 ? 83.215 57.161 146.796 1.00 29.95 ? 165 ARG D CD 1 +ATOM 11205 N NE . ARG C 1 145 ? 84.456 56.442 146.474 1.00 31.62 ? 165 ARG D NE 1 +ATOM 11206 C CZ . ARG C 1 145 ? 85.690 56.906 146.684 1.00 32.48 ? 165 ARG D CZ 1 +ATOM 11207 N NH1 . ARG C 1 145 ? 85.892 58.100 147.240 1.00 33.50 ? 165 ARG D NH1 1 +ATOM 11208 N NH2 . ARG C 1 145 ? 86.740 56.167 146.341 1.00 32.02 ? 165 ARG D NH2 1 +ATOM 11209 N N . LEU C 1 146 ? 79.459 53.641 148.618 1.00 23.58 ? 166 LEU D N 1 +ATOM 11210 C CA . LEU C 1 146 ? 78.890 52.415 148.069 1.00 21.61 ? 166 LEU D CA 1 +ATOM 11211 C C . LEU C 1 146 ? 79.452 52.247 146.663 1.00 19.77 ? 166 LEU D C 1 +ATOM 11212 O O . LEU C 1 146 ? 79.294 53.135 145.827 1.00 19.25 ? 166 LEU D O 1 +ATOM 11213 C CB . LEU C 1 146 ? 77.362 52.505 148.021 1.00 21.72 ? 166 LEU D CB 1 +ATOM 11214 C CG . LEU C 1 146 ? 76.602 51.387 147.300 1.00 21.79 ? 166 LEU D CG 1 +ATOM 11215 C CD1 . LEU C 1 146 ? 76.808 50.072 148.009 1.00 22.48 ? 166 LEU D CD1 1 +ATOM 11216 C CD2 . LEU C 1 146 ? 75.116 51.695 147.208 1.00 22.12 ? 166 LEU D CD2 1 +ATOM 11217 N N . ARG C 1 147 ? 80.112 51.118 146.413 1.00 17.33 ? 167 ARG D N 1 +ATOM 11218 C CA . ARG C 1 147 ? 80.633 50.799 145.083 1.00 15.84 ? 167 ARG D CA 1 +ATOM 11219 C C . ARG C 1 147 ? 79.774 49.704 144.463 1.00 14.92 ? 167 ARG D C 1 +ATOM 11220 O O . ARG C 1 147 ? 79.707 48.611 145.004 1.00 14.24 ? 167 ARG D O 1 +ATOM 11221 C CB . ARG C 1 147 ? 82.085 50.337 145.181 1.00 15.41 ? 167 ARG D CB 1 +ATOM 11222 C CG . ARG C 1 147 ? 82.709 49.983 143.845 1.00 15.10 ? 167 ARG D CG 1 +ATOM 11223 C CD . ARG C 1 147 ? 84.211 49.850 143.935 1.00 14.78 ? 167 ARG D CD 1 +ATOM 11224 N NE . ARG C 1 147 ? 84.609 48.735 144.791 1.00 12.77 ? 167 ARG D NE 1 +ATOM 11225 C CZ . ARG C 1 147 ? 84.710 47.456 144.412 1.00 14.94 ? 167 ARG D CZ 1 +ATOM 11226 N NH1 . ARG C 1 147 ? 84.446 47.075 143.163 1.00 14.37 ? 167 ARG D NH1 1 +ATOM 11227 N NH2 . ARG C 1 147 ? 85.077 46.543 145.304 1.00 15.55 ? 167 ARG D NH2 1 +ATOM 11228 N N . ILE C 1 148 ? 79.106 50.020 143.349 1.00 14.05 ? 168 ILE D N 1 +ATOM 11229 C CA . ILE C 1 148 ? 78.240 49.070 142.653 1.00 13.48 ? 168 ILE D CA 1 +ATOM 11230 C C . ILE C 1 148 ? 78.916 48.589 141.379 1.00 12.66 ? 168 ILE D C 1 +ATOM 11231 O O . ILE C 1 148 ? 79.234 49.393 140.507 1.00 12.16 ? 168 ILE D O 1 +ATOM 11232 C CB . ILE C 1 148 ? 76.881 49.692 142.267 1.00 13.47 ? 168 ILE D CB 1 +ATOM 11233 C CG1 . ILE C 1 148 ? 76.137 50.194 143.499 1.00 13.88 ? 168 ILE D CG1 1 +ATOM 11234 C CG2 . ILE C 1 148 ? 76.004 48.662 141.514 1.00 13.66 ? 168 ILE D CG2 1 +ATOM 11235 C CD1 . ILE C 1 148 ? 74.896 50.990 143.150 1.00 14.89 ? 168 ILE D CD1 1 +ATOM 11236 N N . THR C 1 149 ? 79.135 47.278 141.278 1.00 11.62 ? 169 THR D N 1 +ATOM 11237 C CA . THR C 1 149 ? 79.770 46.676 140.106 1.00 11.39 ? 169 THR D CA 1 +ATOM 11238 C C . THR C 1 149 ? 78.781 45.722 139.482 1.00 10.63 ? 169 THR D C 1 +ATOM 11239 O O . THR C 1 149 ? 78.201 44.902 140.185 1.00 9.87 ? 169 THR D O 1 +ATOM 11240 C CB . THR C 1 149 ? 81.025 45.894 140.471 1.00 11.61 ? 169 THR D CB 1 +ATOM 11241 O OG1 . THR C 1 149 ? 81.810 46.660 141.396 1.00 11.42 ? 169 THR D OG1 1 +ATOM 11242 C CG2 . THR C 1 149 ? 81.851 45.556 139.211 1.00 12.44 ? 169 THR D CG2 1 +ATOM 11243 N N . ILE C 1 150 ? 78.585 45.850 138.170 1.00 10.21 ? 170 ILE D N 1 +ATOM 11244 C CA . ILE C 1 150 ? 77.632 45.023 137.429 1.00 9.82 ? 170 ILE D CA 1 +ATOM 11245 C C . ILE C 1 150 ? 78.309 44.408 136.198 1.00 9.78 ? 170 ILE D C 1 +ATOM 11246 O O . ILE C 1 150 ? 78.799 45.123 135.335 1.00 9.73 ? 170 ILE D O 1 +ATOM 11247 C CB . ILE C 1 150 ? 76.389 45.839 136.990 1.00 9.94 ? 170 ILE D CB 1 +ATOM 11248 C CG1 . ILE C 1 150 ? 75.775 46.578 138.185 1.00 10.18 ? 170 ILE D CG1 1 +ATOM 11249 C CG2 . ILE C 1 150 ? 75.361 44.929 136.338 1.00 11.10 ? 170 ILE D CG2 1 +ATOM 11250 C CD1 . ILE C 1 150 ? 74.563 47.445 137.820 1.00 10.36 ? 170 ILE D CD1 1 +ATOM 11251 N N . ALA C 1 151 ? 78.376 43.079 136.140 1.00 9.36 ? 171 ALA D N 1 +ATOM 11252 C CA . ALA C 1 151 ? 78.875 42.385 134.956 1.00 8.97 ? 171 ALA D CA 1 +ATOM 11253 C C . ALA C 1 151 ? 77.659 41.868 134.190 1.00 9.15 ? 171 ALA D C 1 +ATOM 11254 O O . ALA C 1 151 ? 76.769 41.271 134.791 1.00 9.10 ? 171 ALA D O 1 +ATOM 11255 C CB . ALA C 1 151 ? 79.805 41.213 135.345 1.00 10.15 ? 171 ALA D CB 1 +ATOM 11256 N N . ILE C 1 152 ? 77.623 42.112 132.883 1.00 7.97 ? 172 ILE D N 1 +ATOM 11257 C CA . ILE C 1 152 ? 76.470 41.782 132.049 1.00 7.82 ? 172 ILE D CA 1 +ATOM 11258 C C . ILE C 1 152 ? 76.950 40.919 130.893 1.00 7.58 ? 172 ILE D C 1 +ATOM 11259 O O . ILE C 1 152 ? 77.908 41.291 130.199 1.00 7.18 ? 172 ILE D O 1 +ATOM 11260 C CB . ILE C 1 152 ? 75.757 43.046 131.497 1.00 7.79 ? 172 ILE D CB 1 +ATOM 11261 C CG1 . ILE C 1 152 ? 75.217 43.903 132.645 1.00 7.71 ? 172 ILE D CG1 1 +ATOM 11262 C CG2 . ILE C 1 152 ? 74.612 42.635 130.576 1.00 8.49 ? 172 ILE D CG2 1 +ATOM 11263 C CD1 . ILE C 1 152 ? 74.745 45.298 132.233 1.00 7.99 ? 172 ILE D CD1 1 +ATOM 11264 N N . ASN C 1 153 ? 76.324 39.750 130.725 1.00 7.31 ? 173 ASN D N 1 +ATOM 11265 C CA . ASN C 1 153 ? 76.621 38.856 129.613 1.00 7.26 ? 173 ASN D CA 1 +ATOM 11266 C C . ASN C 1 153 ? 75.524 39.003 128.555 1.00 6.74 ? 173 ASN D C 1 +ATOM 11267 O O . ASN C 1 153 ? 74.335 38.961 128.890 1.00 6.90 ? 173 ASN D O 1 +ATOM 11268 C CB . ASN C 1 153 ? 76.692 37.408 130.113 1.00 7.64 ? 173 ASN D CB 1 +ATOM 11269 C CG . ASN C 1 153 ? 77.374 36.484 129.142 1.00 8.70 ? 173 ASN D CG 1 +ATOM 11270 O OD1 . ASN C 1 153 ? 76.870 36.240 128.044 1.00 8.96 ? 173 ASN D OD1 1 +ATOM 11271 N ND2 . ASN C 1 153 ? 78.553 35.963 129.545 1.00 10.94 ? 173 ASN D ND2 1 +ATOM 11272 N N . ASN C 1 154 ? 75.928 39.167 127.293 1.00 6.15 ? 174 ASN D N 1 +ATOM 11273 C CA . ASN C 1 154 ? 74.991 39.379 126.192 1.00 6.39 ? 174 ASN D CA 1 +ATOM 11274 C C . ASN C 1 154 ? 74.858 38.191 125.237 1.00 6.31 ? 174 ASN D C 1 +ATOM 11275 O O . ASN C 1 154 ? 74.345 38.336 124.139 1.00 6.06 ? 174 ASN D O 1 +ATOM 11276 C CB . ASN C 1 154 ? 75.347 40.638 125.403 1.00 6.77 ? 174 ASN D CB 1 +ATOM 11277 C CG . ASN C 1 154 ? 76.678 40.547 124.692 1.00 6.32 ? 174 ASN D CG 1 +ATOM 11278 O OD1 . ASN C 1 154 ? 77.464 39.629 124.917 1.00 6.98 ? 174 ASN D OD1 1 +ATOM 11279 N ND2 . ASN C 1 154 ? 76.960 41.547 123.858 1.00 7.93 ? 174 ASN D ND2 1 +ATOM 11280 N N . THR C 1 155 ? 75.349 37.023 125.649 1.00 7.11 ? 175 THR D N 1 +ATOM 11281 C CA . THR C 1 155 ? 75.355 35.859 124.768 1.00 8.24 ? 175 THR D CA 1 +ATOM 11282 C C . THR C 1 155 ? 73.959 35.245 124.744 1.00 9.25 ? 175 THR D C 1 +ATOM 11283 O O . THR C 1 155 ? 73.375 34.963 125.796 1.00 10.83 ? 175 THR D O 1 +ATOM 11284 C CB . THR C 1 155 ? 76.361 34.792 125.227 1.00 7.99 ? 175 THR D CB 1 +ATOM 11285 O OG1 . THR C 1 155 ? 77.651 35.383 125.392 1.00 7.06 ? 175 THR D OG1 1 +ATOM 11286 C CG2 . THR C 1 155 ? 76.477 33.664 124.191 1.00 9.10 ? 175 THR D CG2 1 +ATOM 11287 N N . LEU C 1 156 ? 73.445 35.025 123.547 1.00 10.34 ? 176 LEU D N 1 +ATOM 11288 C CA . LEU C 1 156 ? 72.170 34.365 123.369 1.00 10.73 ? 176 LEU D CA 1 +ATOM 11289 C C . LEU C 1 156 ? 72.470 32.905 123.027 1.00 11.75 ? 176 LEU D C 1 +ATOM 11290 O O . LEU C 1 156 ? 73.445 32.604 122.316 1.00 11.79 ? 176 LEU D O 1 +ATOM 11291 C CB . LEU C 1 156 ? 71.350 35.067 122.287 1.00 11.12 ? 176 LEU D CB 1 +ATOM 11292 C CG . LEU C 1 156 ? 71.061 36.550 122.595 1.00 10.98 ? 176 LEU D CG 1 +ATOM 11293 C CD1 . LEU C 1 156 ? 70.339 37.251 121.441 1.00 13.26 ? 176 LEU D CD1 1 +ATOM 11294 C CD2 . LEU C 1 156 ? 70.246 36.678 123.877 1.00 12.90 ? 176 LEU D CD2 1 +ATOM 11295 N N . THR C 1 157 ? 71.636 32.015 123.560 1.00 12.59 ? 177 THR D N 1 +ATOM 11296 C CA . THR C 1 157 ? 71.840 30.567 123.476 1.00 13.47 ? 177 THR D CA 1 +ATOM 11297 C C . THR C 1 157 ? 70.510 29.859 123.209 1.00 13.59 ? 177 THR D C 1 +ATOM 11298 O O . THR C 1 157 ? 69.472 30.491 123.206 1.00 12.43 ? 177 THR D O 1 +ATOM 11299 C CB . THR C 1 157 ? 72.442 30.013 124.782 1.00 13.58 ? 177 THR D CB 1 +ATOM 11300 O OG1 . THR C 1 157 ? 71.438 29.966 125.798 1.00 15.71 ? 177 THR D OG1 1 +ATOM 11301 C CG2 . THR C 1 157 ? 73.622 30.839 125.232 1.00 14.55 ? 177 THR D CG2 1 +ATOM 11302 N N . PRO C 1 158 ? 70.539 28.535 122.938 1.00 14.03 ? 178 PRO D N 1 +ATOM 11303 C CA . PRO C 1 158 ? 69.286 27.779 122.781 1.00 14.47 ? 178 PRO D CA 1 +ATOM 11304 C C . PRO C 1 158 ? 68.260 27.816 123.934 1.00 14.76 ? 178 PRO D C 1 +ATOM 11305 O O . PRO C 1 158 ? 67.129 27.363 123.742 1.00 15.36 ? 178 PRO D O 1 +ATOM 11306 C CB . PRO C 1 158 ? 69.775 26.343 122.523 1.00 13.94 ? 178 PRO D CB 1 +ATOM 11307 C CG . PRO C 1 158 ? 71.125 26.514 121.951 1.00 14.26 ? 178 PRO D CG 1 +ATOM 11308 C CD . PRO C 1 158 ? 71.717 27.712 122.622 1.00 14.27 ? 178 PRO D CD 1 +ATOM 11309 N N . THR C 1 159 ? 68.620 28.353 125.099 1.00 15.09 ? 179 THR D N 1 +ATOM 11310 C CA . THR C 1 159 ? 67.647 28.502 126.187 1.00 15.19 ? 179 THR D CA 1 +ATOM 11311 C C . THR C 1 159 ? 67.489 29.928 126.707 1.00 14.74 ? 179 THR D C 1 +ATOM 11312 O O . THR C 1 159 ? 66.864 30.124 127.737 1.00 14.48 ? 179 THR D O 1 +ATOM 11313 C CB . THR C 1 159 ? 68.006 27.608 127.372 1.00 15.63 ? 179 THR D CB 1 +ATOM 11314 O OG1 . THR C 1 159 ? 69.383 27.824 127.710 1.00 17.58 ? 179 THR D OG1 1 +ATOM 11315 C CG2 . THR C 1 159 ? 67.752 26.160 127.017 1.00 16.24 ? 179 THR D CG2 1 +ATOM 11316 N N . THR C 1 160 ? 68.015 30.919 125.996 1.00 13.54 ? 180 THR D N 1 +ATOM 11317 C CA . THR C 1 160 ? 67.704 32.311 126.331 1.00 12.79 ? 180 THR D CA 1 +ATOM 11318 C C . THR C 1 160 ? 66.489 32.724 125.522 1.00 12.32 ? 180 THR D C 1 +ATOM 11319 O O . THR C 1 160 ? 66.120 32.048 124.554 1.00 10.67 ? 180 THR D O 1 +ATOM 11320 C CB . THR C 1 160 ? 68.877 33.275 126.076 1.00 12.44 ? 180 THR D CB 1 +ATOM 11321 O OG1 . THR C 1 160 ? 69.296 33.232 124.706 1.00 11.60 ? 180 THR D OG1 1 +ATOM 11322 C CG2 . THR C 1 160 ? 70.070 32.943 126.982 1.00 13.34 ? 180 THR D CG2 1 +ATOM 11323 N N . LEU C 1 161 ? 65.868 33.822 125.946 1.00 11.65 ? 181 LEU D N 1 +ATOM 11324 C CA . LEU C 1 161 ? 64.765 34.446 125.237 1.00 11.47 ? 181 LEU D CA 1 +ATOM 11325 C C . LEU C 1 161 ? 65.114 35.931 125.027 1.00 10.76 ? 181 LEU D C 1 +ATOM 11326 O O . LEU C 1 161 ? 65.126 36.710 125.986 1.00 10.55 ? 181 LEU D O 1 +ATOM 11327 C CB . LEU C 1 161 ? 63.460 34.322 126.029 1.00 11.87 ? 181 LEU D CB 1 +ATOM 11328 C CG . LEU C 1 161 ? 62.567 33.094 125.904 1.00 12.86 ? 181 LEU D CG 1 +ATOM 11329 C CD1 . LEU C 1 161 ? 61.253 33.414 126.590 1.00 12.53 ? 181 LEU D CD1 1 +ATOM 11330 C CD2 . LEU C 1 161 ? 62.310 32.651 124.462 1.00 11.30 ? 181 LEU D CD2 1 +ATOM 11331 N N . PRO C 1 162 ? 65.421 36.332 123.782 1.00 10.21 ? 182 PRO D N 1 +ATOM 11332 C CA . PRO C 1 162 ? 65.379 35.501 122.587 1.00 9.62 ? 182 PRO D CA 1 +ATOM 11333 C C . PRO C 1 162 ? 66.516 34.494 122.569 1.00 9.79 ? 182 PRO D C 1 +ATOM 11334 O O . PRO C 1 162 ? 67.571 34.749 123.158 1.00 8.51 ? 182 PRO D O 1 +ATOM 11335 C CB . PRO C 1 162 ? 65.526 36.503 121.427 1.00 9.98 ? 182 PRO D CB 1 +ATOM 11336 C CG . PRO C 1 162 ? 65.877 37.773 122.006 1.00 10.91 ? 182 PRO D CG 1 +ATOM 11337 C CD . PRO C 1 162 ? 65.885 37.697 123.495 1.00 10.70 ? 182 PRO D CD 1 +ATOM 11338 N N . PRO C 1 163 ? 66.308 33.353 121.890 1.00 9.40 ? 183 PRO D N 1 +ATOM 11339 C CA . PRO C 1 163 ? 67.393 32.395 121.698 1.00 9.64 ? 183 PRO D CA 1 +ATOM 11340 C C . PRO C 1 163 ? 68.399 32.837 120.651 1.00 10.01 ? 183 PRO D C 1 +ATOM 11341 O O . PRO C 1 163 ? 68.134 33.765 119.866 1.00 9.13 ? 183 PRO D O 1 +ATOM 11342 C CB . PRO C 1 163 ? 66.670 31.125 121.229 1.00 10.16 ? 183 PRO D CB 1 +ATOM 11343 C CG . PRO C 1 163 ? 65.403 31.615 120.600 1.00 9.27 ? 183 PRO D CG 1 +ATOM 11344 C CD . PRO C 1 163 ? 65.044 32.914 121.274 1.00 9.97 ? 183 PRO D CD 1 +ATOM 11345 N N . GLY C 1 164 ? 69.547 32.161 120.655 1.00 10.01 ? 184 GLY D N 1 +ATOM 11346 C CA . GLY C 1 164 ? 70.521 32.259 119.582 1.00 10.57 ? 184 GLY D CA 1 +ATOM 11347 C C . GLY C 1 164 ? 71.456 31.070 119.639 1.00 10.94 ? 184 GLY D C 1 +ATOM 11348 O O . GLY C 1 164 ? 71.321 30.206 120.495 1.00 10.79 ? 184 GLY D O 1 +ATOM 11349 N N . THR C 1 165 ? 72.407 31.015 118.721 1.00 11.17 ? 185 THR D N 1 +ATOM 11350 C CA . THR C 1 165 ? 73.450 30.023 118.809 1.00 11.83 ? 185 THR D CA 1 +ATOM 11351 C C . THR C 1 165 ? 74.815 30.688 118.626 1.00 11.86 ? 185 THR D C 1 +ATOM 11352 O O . THR C 1 165 ? 74.922 31.767 118.045 1.00 11.21 ? 185 THR D O 1 +ATOM 11353 C CB . THR C 1 165 ? 73.242 28.900 117.781 1.00 11.97 ? 185 THR D CB 1 +ATOM 11354 O OG1 . THR C 1 165 ? 73.444 29.410 116.467 1.00 12.68 ? 185 THR D OG1 1 +ATOM 11355 C CG2 . THR C 1 165 ? 71.828 28.331 117.873 1.00 12.15 ? 185 THR D CG2 1 +ATOM 11356 N N . ILE C 1 166 ? 75.838 30.032 119.161 1.00 12.39 ? 186 ILE D N 1 +ATOM 11357 C CA . ILE C 1 166 ? 77.216 30.452 119.017 1.00 12.97 ? 186 ILE D CA 1 +ATOM 11358 C C . ILE C 1 166 ? 77.923 29.419 118.151 1.00 14.37 ? 186 ILE D C 1 +ATOM 11359 O O . ILE C 1 166 ? 77.879 28.236 118.461 1.00 13.97 ? 186 ILE D O 1 +ATOM 11360 C CB . ILE C 1 166 ? 77.897 30.569 120.400 1.00 12.89 ? 186 ILE D CB 1 +ATOM 11361 C CG1 . ILE C 1 166 ? 77.382 31.812 121.139 1.00 12.61 ? 186 ILE D CG1 1 +ATOM 11362 C CG2 . ILE C 1 166 ? 79.423 30.626 120.264 1.00 12.95 ? 186 ILE D CG2 1 +ATOM 11363 C CD1 . ILE C 1 166 ? 77.863 33.141 120.563 1.00 12.28 ? 186 ILE D CD1 1 +ATOM 11364 N N . GLN C 1 167 ? 78.559 29.854 117.065 1.00 15.96 ? 187 GLN D N 1 +ATOM 11365 C CA . GLN C 1 167 ? 79.276 28.935 116.176 1.00 17.36 ? 187 GLN D CA 1 +ATOM 11366 C C . GLN C 1 167 ? 80.751 29.316 116.122 1.00 17.58 ? 187 GLN D C 1 +ATOM 11367 O O . GLN C 1 167 ? 81.093 30.429 115.720 1.00 16.54 ? 187 GLN D O 1 +ATOM 11368 C CB . GLN C 1 167 ? 78.674 28.969 114.765 1.00 18.13 ? 187 GLN D CB 1 +ATOM 11369 C CG . GLN C 1 167 ? 78.737 27.617 114.054 1.00 21.41 ? 187 GLN D CG 1 +ATOM 11370 C CD . GLN C 1 167 ? 78.702 27.721 112.541 1.00 25.09 ? 187 GLN D CD 1 +ATOM 11371 O OE1 . GLN C 1 167 ? 79.394 26.973 111.842 1.00 28.73 ? 187 GLN D OE1 1 +ATOM 11372 N NE2 . GLN C 1 167 ? 77.898 28.644 112.025 1.00 27.90 ? 187 GLN D NE2 1 +ATOM 11373 N N . TYR C 1 168 ? 81.620 28.418 116.581 1.00 18.54 ? 188 TYR D N 1 +ATOM 11374 C CA . TYR C 1 168 ? 83.052 28.567 116.344 1.00 19.66 ? 188 TYR D CA 1 +ATOM 11375 C C . TYR C 1 168 ? 83.358 28.047 114.948 1.00 20.23 ? 188 TYR D C 1 +ATOM 11376 O O . TYR C 1 168 ? 82.877 26.985 114.565 1.00 20.68 ? 188 TYR D O 1 +ATOM 11377 C CB . TYR C 1 168 ? 83.876 27.820 117.404 1.00 20.06 ? 188 TYR D CB 1 +ATOM 11378 C CG . TYR C 1 168 ? 83.993 28.583 118.700 1.00 20.65 ? 188 TYR D CG 1 +ATOM 11379 C CD1 . TYR C 1 168 ? 82.998 28.499 119.671 1.00 21.43 ? 188 TYR D CD1 1 +ATOM 11380 C CD2 . TYR C 1 168 ? 85.093 29.399 118.957 1.00 20.51 ? 188 TYR D CD2 1 +ATOM 11381 C CE1 . TYR C 1 168 ? 83.104 29.204 120.865 1.00 21.97 ? 188 TYR D CE1 1 +ATOM 11382 C CE2 . TYR C 1 168 ? 85.202 30.114 120.142 1.00 21.51 ? 188 TYR D CE2 1 +ATOM 11383 C CZ . TYR C 1 168 ? 84.205 30.010 121.092 1.00 22.00 ? 188 TYR D CZ 1 +ATOM 11384 O OH . TYR C 1 168 ? 84.310 30.734 122.266 1.00 22.21 ? 188 TYR D OH 1 +ATOM 11385 N N . LEU C 1 169 ? 84.147 28.798 114.183 1.00 21.02 ? 189 LEU D N 1 +ATOM 11386 C CA . LEU C 1 169 ? 84.527 28.393 112.829 1.00 21.57 ? 189 LEU D CA 1 +ATOM 11387 C C . LEU C 1 169 ? 86.034 28.152 112.814 1.00 21.86 ? 189 LEU D C 1 +ATOM 11388 O O . LEU C 1 169 ? 86.816 29.081 112.991 1.00 21.42 ? 189 LEU D O 1 +ATOM 11389 C CB . LEU C 1 169 ? 84.120 29.450 111.802 1.00 21.87 ? 189 LEU D CB 1 +ATOM 11390 C CG . LEU C 1 169 ? 82.609 29.662 111.635 1.00 22.66 ? 189 LEU D CG 1 +ATOM 11391 C CD1 . LEU C 1 169 ? 82.315 30.976 110.950 1.00 24.01 ? 189 LEU D CD1 1 +ATOM 11392 C CD2 . LEU C 1 169 ? 81.984 28.518 110.860 1.00 23.02 ? 189 LEU D CD2 1 +ATOM 11393 N N . THR C 1 170 ? 86.422 26.891 112.618 1.00 22.23 ? 190 THR D N 1 +ATOM 11394 C CA . THR C 1 170 ? 87.807 26.455 112.811 1.00 22.77 ? 190 THR D CA 1 +ATOM 11395 C C . THR C 1 170 ? 88.549 26.099 111.517 1.00 22.96 ? 190 THR D C 1 +ATOM 11396 O O . THR C 1 170 ? 89.583 25.422 111.554 1.00 23.13 ? 190 THR D O 1 +ATOM 11397 C CB . THR C 1 170 ? 87.847 25.226 113.730 1.00 22.64 ? 190 THR D CB 1 +ATOM 11398 O OG1 . THR C 1 170 ? 87.157 24.149 113.097 1.00 23.96 ? 190 THR D OG1 1 +ATOM 11399 C CG2 . THR C 1 170 ? 87.171 25.545 115.059 1.00 22.79 ? 190 THR D CG2 1 +ATOM 11400 N N . ASP C 1 171 ? 88.021 26.538 110.380 1.00 22.84 ? 191 ASP D N 1 +ATOM 11401 C CA . ASP C 1 171 ? 88.778 26.504 109.135 1.00 22.65 ? 191 ASP D CA 1 +ATOM 11402 C C . ASP C 1 171 ? 89.715 27.692 109.173 1.00 22.15 ? 191 ASP D C 1 +ATOM 11403 O O . ASP C 1 171 ? 89.300 28.840 108.978 1.00 21.86 ? 191 ASP D O 1 +ATOM 11404 C CB . ASP C 1 171 ? 87.851 26.583 107.925 1.00 22.92 ? 191 ASP D CB 1 +ATOM 11405 C CG . ASP C 1 171 ? 88.584 26.396 106.605 1.00 23.42 ? 191 ASP D CG 1 +ATOM 11406 O OD1 . ASP C 1 171 ? 89.815 26.623 106.547 1.00 24.22 ? 191 ASP D OD1 1 +ATOM 11407 O OD2 . ASP C 1 171 ? 87.914 26.028 105.622 1.00 24.78 ? 191 ASP D OD2 1 +ATOM 11408 N N . THR C 1 172 ? 90.987 27.417 109.433 1.00 21.47 ? 192 THR D N 1 +ATOM 11409 C CA . THR C 1 172 ? 91.974 28.474 109.600 1.00 21.27 ? 192 THR D CA 1 +ATOM 11410 C C . THR C 1 172 ? 92.420 29.113 108.274 1.00 20.14 ? 192 THR D C 1 +ATOM 11411 O O . THR C 1 172 ? 93.173 30.083 108.288 1.00 20.39 ? 192 THR D O 1 +ATOM 11412 C CB . THR C 1 172 ? 93.204 27.958 110.359 1.00 21.57 ? 192 THR D CB 1 +ATOM 11413 O OG1 . THR C 1 172 ? 93.723 26.815 109.679 1.00 22.35 ? 192 THR D OG1 1 +ATOM 11414 C CG2 . THR C 1 172 ? 92.817 27.558 111.780 1.00 22.20 ? 192 THR D CG2 1 +ATOM 11415 N N . SER C 1 173 ? 91.958 28.576 107.145 1.00 19.33 ? 193 SER D N 1 +ATOM 11416 C CA . SER C 1 173 ? 92.216 29.184 105.834 1.00 19.01 ? 193 SER D CA 1 +ATOM 11417 C C . SER C 1 173 ? 91.190 30.263 105.501 1.00 18.45 ? 193 SER D C 1 +ATOM 11418 O O . SER C 1 173 ? 91.397 31.050 104.592 1.00 17.42 ? 193 SER D O 1 +ATOM 11419 C CB . SER C 1 173 ? 92.204 28.128 104.726 1.00 19.05 ? 193 SER D CB 1 +ATOM 11420 O OG . SER C 1 173 ? 90.894 27.653 104.467 1.00 20.27 ? 193 SER D OG 1 +ATOM 11421 N N . LYS C 1 174 ? 90.067 30.276 106.216 1.00 18.01 ? 194 LYS D N 1 +ATOM 11422 C CA . LYS C 1 174 ? 89.038 31.294 105.981 1.00 17.73 ? 194 LYS D CA 1 +ATOM 11423 C C . LYS C 1 174 ? 88.752 32.168 107.202 1.00 17.12 ? 194 LYS D C 1 +ATOM 11424 O O . LYS C 1 174 ? 88.212 33.261 107.051 1.00 15.53 ? 194 LYS D O 1 +ATOM 11425 C CB . LYS C 1 174 ? 87.750 30.638 105.472 1.00 18.21 ? 194 LYS D CB 1 +ATOM 11426 C CG . LYS C 1 174 ? 87.852 30.167 104.013 1.00 20.40 ? 194 LYS D CG 1 +ATOM 11427 C CD . LYS C 1 174 ? 86.487 29.966 103.374 1.00 22.67 ? 194 LYS D CD 1 +ATOM 11428 C CE . LYS C 1 174 ? 86.603 29.624 101.887 1.00 24.09 ? 194 LYS D CE 1 +ATOM 11429 N NZ . LYS C 1 174 ? 86.526 30.820 100.994 1.00 25.69 ? 194 LYS D NZ 1 +ATOM 11430 N N . TYR C 1 175 ? 89.130 31.704 108.398 1.00 16.63 ? 195 TYR D N 1 +ATOM 11431 C CA . TYR C 1 175 ? 88.856 32.436 109.642 1.00 16.53 ? 195 TYR D CA 1 +ATOM 11432 C C . TYR C 1 175 ? 90.051 32.390 110.599 1.00 17.48 ? 195 TYR D C 1 +ATOM 11433 O O . TYR C 1 175 ? 90.696 31.353 110.697 1.00 17.20 ? 195 TYR D O 1 +ATOM 11434 C CB . TYR C 1 175 ? 87.652 31.819 110.352 1.00 15.79 ? 195 TYR D CB 1 +ATOM 11435 C CG . TYR C 1 175 ? 86.387 31.807 109.530 1.00 15.08 ? 195 TYR D CG 1 +ATOM 11436 C CD1 . TYR C 1 175 ? 85.959 30.643 108.897 1.00 12.94 ? 195 TYR D CD1 1 +ATOM 11437 C CD2 . TYR C 1 175 ? 85.617 32.962 109.382 1.00 14.51 ? 195 TYR D CD2 1 +ATOM 11438 C CE1 . TYR C 1 175 ? 84.792 30.617 108.144 1.00 13.89 ? 195 TYR D CE1 1 +ATOM 11439 C CE2 . TYR C 1 175 ? 84.446 32.947 108.624 1.00 14.33 ? 195 TYR D CE2 1 +ATOM 11440 C CZ . TYR C 1 175 ? 84.043 31.770 108.003 1.00 14.23 ? 195 TYR D CZ 1 +ATOM 11441 O OH . TYR C 1 175 ? 82.883 31.738 107.250 1.00 15.23 ? 195 TYR D OH 1 +ATOM 11442 N N . PRO C 1 176 ? 90.307 33.492 111.340 1.00 18.05 ? 196 PRO D N 1 +ATOM 11443 C CA . PRO C 1 176 ? 91.430 33.547 112.286 1.00 18.51 ? 196 PRO D CA 1 +ATOM 11444 C C . PRO C 1 176 ? 91.209 32.653 113.506 1.00 18.87 ? 196 PRO D C 1 +ATOM 11445 O O . PRO C 1 176 ? 90.069 32.283 113.823 1.00 18.53 ? 196 PRO D O 1 +ATOM 11446 C CB . PRO C 1 176 ? 91.458 35.010 112.709 1.00 18.86 ? 196 PRO D CB 1 +ATOM 11447 C CG . PRO C 1 176 ? 90.046 35.450 112.588 1.00 18.76 ? 196 PRO D CG 1 +ATOM 11448 C CD . PRO C 1 176 ? 89.533 34.747 111.361 1.00 18.55 ? 196 PRO D CD 1 +ATOM 11449 N N . LYS C 1 177 ? 92.302 32.305 114.182 1.00 18.73 ? 197 LYS D N 1 +ATOM 11450 C CA . LYS C 1 177 ? 92.226 31.448 115.351 1.00 19.34 ? 197 LYS D CA 1 +ATOM 11451 C C . LYS C 1 177 ? 91.264 32.049 116.362 1.00 18.41 ? 197 LYS D C 1 +ATOM 11452 O O . LYS C 1 177 ? 91.407 33.215 116.750 1.00 18.88 ? 197 LYS D O 1 +ATOM 11453 C CB . LYS C 1 177 ? 93.604 31.245 116.000 1.00 19.24 ? 197 LYS D CB 1 +ATOM 11454 C CG . LYS C 1 177 ? 93.626 30.109 117.043 1.00 20.35 ? 197 LYS D CG 1 +ATOM 11455 C CD . LYS C 1 177 ? 95.037 29.808 117.571 1.00 21.22 ? 197 LYS D CD 1 +ATOM 11456 C CE . LYS C 1 177 ? 95.615 30.971 118.372 1.00 22.94 ? 197 LYS D CE 1 +ATOM 11457 N NZ . LYS C 1 177 ? 96.855 30.592 119.139 1.00 25.28 ? 197 LYS D NZ 1 +ATOM 11458 N N . GLY C 1 178 ? 90.272 31.259 116.753 1.00 17.62 ? 198 GLY D N 1 +ATOM 11459 C CA . GLY C 1 178 ? 89.325 31.652 117.797 1.00 17.04 ? 198 GLY D CA 1 +ATOM 11460 C C . GLY C 1 178 ? 88.054 32.321 117.302 1.00 16.43 ? 198 GLY D C 1 +ATOM 11461 O O . GLY C 1 178 ? 87.204 32.715 118.098 1.00 16.32 ? 198 GLY D O 1 +ATOM 11462 N N . TYR C 1 179 ? 87.909 32.432 115.990 1.00 15.53 ? 199 TYR D N 1 +ATOM 11463 C CA . TYR C 1 179 ? 86.723 33.066 115.416 1.00 14.68 ? 199 TYR D CA 1 +ATOM 11464 C C . TYR C 1 179 ? 85.449 32.344 115.858 1.00 14.42 ? 199 TYR D C 1 +ATOM 11465 O O . TYR C 1 179 ? 85.356 31.116 115.800 1.00 13.91 ? 199 TYR D O 1 +ATOM 11466 C CB . TYR C 1 179 ? 86.807 33.045 113.891 1.00 13.97 ? 199 TYR D CB 1 +ATOM 11467 C CG . TYR C 1 179 ? 85.747 33.865 113.183 1.00 13.02 ? 199 TYR D CG 1 +ATOM 11468 C CD1 . TYR C 1 179 ? 84.578 33.287 112.703 1.00 13.50 ? 199 TYR D CD1 1 +ATOM 11469 C CD2 . TYR C 1 179 ? 85.933 35.218 112.984 1.00 11.98 ? 199 TYR D CD2 1 +ATOM 11470 C CE1 . TYR C 1 179 ? 83.621 34.062 112.030 1.00 10.03 ? 199 TYR D CE1 1 +ATOM 11471 C CE2 . TYR C 1 179 ? 85.000 35.982 112.310 1.00 10.12 ? 199 TYR D CE2 1 +ATOM 11472 C CZ . TYR C 1 179 ? 83.846 35.401 111.849 1.00 11.98 ? 199 TYR D CZ 1 +ATOM 11473 O OH . TYR C 1 179 ? 82.923 36.176 111.192 1.00 12.08 ? 199 TYR D OH 1 +ATOM 11474 N N . PHE C 1 180 ? 84.464 33.123 116.296 1.00 14.04 ? 200 PHE D N 1 +ATOM 11475 C CA . PHE C 1 180 ? 83.102 32.628 116.466 1.00 13.35 ? 200 PHE D CA 1 +ATOM 11476 C C . PHE C 1 180 ? 82.107 33.731 116.149 1.00 13.15 ? 200 PHE D C 1 +ATOM 11477 O O . PHE C 1 180 ? 82.451 34.902 116.170 1.00 12.60 ? 200 PHE D O 1 +ATOM 11478 C CB . PHE C 1 180 ? 82.856 32.088 117.887 1.00 13.82 ? 200 PHE D CB 1 +ATOM 11479 C CG . PHE C 1 180 ? 82.812 33.145 118.971 1.00 12.86 ? 200 PHE D CG 1 +ATOM 11480 C CD1 . PHE C 1 180 ? 83.973 33.552 119.615 1.00 13.83 ? 200 PHE D CD1 1 +ATOM 11481 C CD2 . PHE C 1 180 ? 81.608 33.702 119.382 1.00 13.04 ? 200 PHE D CD2 1 +ATOM 11482 C CE1 . PHE C 1 180 ? 83.942 34.521 120.612 1.00 13.63 ? 200 PHE D CE1 1 +ATOM 11483 C CE2 . PHE C 1 180 ? 81.579 34.662 120.391 1.00 11.14 ? 200 PHE D CE2 1 +ATOM 11484 C CZ . PHE C 1 180 ? 82.746 35.068 120.998 1.00 14.16 ? 200 PHE D CZ 1 +ATOM 11485 N N . VAL C 1 181 ? 80.868 33.351 115.867 1.00 13.25 ? 201 VAL D N 1 +ATOM 11486 C CA . VAL C 1 181 ? 79.814 34.335 115.702 1.00 13.71 ? 201 VAL D CA 1 +ATOM 11487 C C . VAL C 1 181 ? 78.560 33.941 116.450 1.00 13.16 ? 201 VAL D C 1 +ATOM 11488 O O . VAL C 1 181 ? 78.342 32.760 116.782 1.00 13.32 ? 201 VAL D O 1 +ATOM 11489 C CB . VAL C 1 181 ? 79.448 34.593 114.210 1.00 14.23 ? 201 VAL D CB 1 +ATOM 11490 C CG1 . VAL C 1 181 ? 80.639 35.138 113.455 1.00 14.00 ? 201 VAL D CG1 1 +ATOM 11491 C CG2 . VAL C 1 181 ? 78.899 33.325 113.548 1.00 14.98 ? 201 VAL D CG2 1 +ATOM 11492 N N . GLN C 1 182 ? 77.757 34.968 116.703 1.00 12.60 ? 202 GLN D N 1 +ATOM 11493 C CA . GLN C 1 182 ? 76.454 34.834 117.315 1.00 12.19 ? 202 GLN D CA 1 +ATOM 11494 C C . GLN C 1 182 ? 75.466 34.780 116.171 1.00 12.20 ? 202 GLN D C 1 +ATOM 11495 O O . GLN C 1 182 ? 75.382 35.735 115.396 1.00 12.43 ? 202 GLN D O 1 +ATOM 11496 C CB . GLN C 1 182 ? 76.183 36.070 118.180 1.00 11.48 ? 202 GLN D CB 1 +ATOM 11497 C CG . GLN C 1 182 ? 74.788 36.180 118.755 1.00 12.21 ? 202 GLN D CG 1 +ATOM 11498 C CD . GLN C 1 182 ? 74.590 35.311 119.960 1.00 13.01 ? 202 GLN D CD 1 +ATOM 11499 O OE1 . GLN C 1 182 ? 74.875 35.715 121.086 1.00 14.70 ? 202 GLN D OE1 1 +ATOM 11500 N NE2 . GLN C 1 182 ? 74.083 34.121 119.742 1.00 13.31 ? 202 GLN D NE2 1 +ATOM 11501 N N . ASN C 1 183 ? 74.762 33.660 116.037 1.00 12.65 ? 203 ASN D N 1 +ATOM 11502 C CA . ASN C 1 183 ? 73.623 33.549 115.119 1.00 12.65 ? 203 ASN D CA 1 +ATOM 11503 C C . ASN C 1 183 ? 72.317 33.862 115.833 1.00 12.03 ? 203 ASN D C 1 +ATOM 11504 O O . ASN C 1 183 ? 72.090 33.408 116.950 1.00 12.17 ? 203 ASN D O 1 +ATOM 11505 C CB . ASN C 1 183 ? 73.533 32.146 114.539 1.00 13.43 ? 203 ASN D CB 1 +ATOM 11506 C CG . ASN C 1 183 ? 74.775 31.745 113.771 1.00 14.50 ? 203 ASN D CG 1 +ATOM 11507 O OD1 . ASN C 1 183 ? 75.381 32.555 113.072 1.00 18.28 ? 203 ASN D OD1 1 +ATOM 11508 N ND2 . ASN C 1 183 ? 75.151 30.480 113.889 1.00 19.30 ? 203 ASN D ND2 1 +ATOM 11509 N N . THR C 1 184 ? 71.459 34.644 115.185 1.00 10.83 ? 204 THR D N 1 +ATOM 11510 C CA . THR C 1 184 ? 70.142 34.945 115.720 1.00 10.81 ? 204 THR D CA 1 +ATOM 11511 C C . THR C 1 184 ? 69.124 34.827 114.612 1.00 10.61 ? 204 THR D C 1 +ATOM 11512 O O . THR C 1 184 ? 69.473 34.882 113.424 1.00 9.74 ? 204 THR D O 1 +ATOM 11513 C CB . THR C 1 184 ? 70.054 36.380 116.252 1.00 11.24 ? 204 THR D CB 1 +ATOM 11514 O OG1 . THR C 1 184 ? 70.328 37.283 115.179 1.00 12.58 ? 204 THR D OG1 1 +ATOM 11515 C CG2 . THR C 1 184 ? 71.041 36.613 117.381 1.00 12.20 ? 204 THR D CG2 1 +ATOM 11516 N N . TYR C 1 185 ? 67.861 34.696 115.010 1.00 10.27 ? 205 TYR D N 1 +ATOM 11517 C CA . TYR C 1 185 ? 66.753 34.512 114.065 1.00 10.71 ? 205 TYR D CA 1 +ATOM 11518 C C . TYR C 1 185 ? 65.645 35.540 114.308 1.00 10.00 ? 205 TYR D C 1 +ATOM 11519 O O . TYR C 1 185 ? 64.460 35.284 114.035 1.00 10.41 ? 205 TYR D O 1 +ATOM 11520 C CB . TYR C 1 185 ? 66.242 33.073 114.138 1.00 11.67 ? 205 TYR D CB 1 +ATOM 11521 C CG . TYR C 1 185 ? 67.351 32.111 113.834 1.00 12.32 ? 205 TYR D CG 1 +ATOM 11522 C CD1 . TYR C 1 185 ? 67.632 31.748 112.529 1.00 14.53 ? 205 TYR D CD1 1 +ATOM 11523 C CD2 . TYR C 1 185 ? 68.155 31.597 114.852 1.00 13.36 ? 205 TYR D CD2 1 +ATOM 11524 C CE1 . TYR C 1 185 ? 68.672 30.874 112.237 1.00 15.37 ? 205 TYR D CE1 1 +ATOM 11525 C CE2 . TYR C 1 185 ? 69.200 30.726 114.568 1.00 14.77 ? 205 TYR D CE2 1 +ATOM 11526 C CZ . TYR C 1 185 ? 69.454 30.380 113.262 1.00 14.17 ? 205 TYR D CZ 1 +ATOM 11527 O OH . TYR C 1 185 ? 70.483 29.509 112.982 1.00 16.33 ? 205 TYR D OH 1 +ATOM 11528 N N . PHE C 1 186 ? 66.037 36.719 114.785 1.00 9.36 ? 206 PHE D N 1 +ATOM 11529 C CA . PHE C 1 186 ? 65.107 37.826 114.992 1.00 8.43 ? 206 PHE D CA 1 +ATOM 11530 C C . PHE C 1 186 ? 65.658 39.095 114.333 1.00 8.00 ? 206 PHE D C 1 +ATOM 11531 O O . PHE C 1 186 ? 66.862 39.266 114.198 1.00 8.19 ? 206 PHE D O 1 +ATOM 11532 C CB . PHE C 1 186 ? 64.807 38.054 116.474 1.00 8.64 ? 206 PHE D CB 1 +ATOM 11533 C CG . PHE C 1 186 ? 66.017 38.247 117.321 1.00 7.68 ? 206 PHE D CG 1 +ATOM 11534 C CD1 . PHE C 1 186 ? 66.565 39.510 117.512 1.00 7.69 ? 206 PHE D CD1 1 +ATOM 11535 C CD2 . PHE C 1 186 ? 66.605 37.168 117.960 1.00 9.43 ? 206 PHE D CD2 1 +ATOM 11536 C CE1 . PHE C 1 186 ? 67.689 39.678 118.294 1.00 7.24 ? 206 PHE D CE1 1 +ATOM 11537 C CE2 . PHE C 1 186 ? 67.726 37.340 118.751 1.00 8.43 ? 206 PHE D CE2 1 +ATOM 11538 C CZ . PHE C 1 186 ? 68.266 38.598 118.916 1.00 9.65 ? 206 PHE D CZ 1 +ATOM 11539 N N . ASP C 1 187 ? 64.749 39.948 113.883 1.00 7.77 ? 207 ASP D N 1 +ATOM 11540 C CA . ASP C 1 187 ? 65.110 41.044 112.992 1.00 7.97 ? 207 ASP D CA 1 +ATOM 11541 C C . ASP C 1 187 ? 65.236 42.344 113.758 1.00 8.03 ? 207 ASP D C 1 +ATOM 11542 O O . ASP C 1 187 ? 64.595 43.347 113.430 1.00 7.94 ? 207 ASP D O 1 +ATOM 11543 C CB . ASP C 1 187 ? 64.070 41.155 111.874 1.00 7.85 ? 207 ASP D CB 1 +ATOM 11544 C CG . ASP C 1 187 ? 64.410 42.210 110.855 1.00 9.36 ? 207 ASP D CG 1 +ATOM 11545 O OD1 . ASP C 1 187 ? 65.603 42.382 110.522 1.00 7.90 ? 207 ASP D OD1 1 +ATOM 11546 O OD2 . ASP C 1 187 ? 63.454 42.863 110.388 1.00 10.69 ? 207 ASP D OD2 1 +ATOM 11547 N N . PHE C 1 188 ? 66.101 42.332 114.767 1.00 7.26 ? 208 PHE D N 1 +ATOM 11548 C CA . PHE C 1 188 ? 66.524 43.548 115.433 1.00 6.81 ? 208 PHE D CA 1 +ATOM 11549 C C . PHE C 1 188 ? 67.876 43.333 116.092 1.00 6.56 ? 208 PHE D C 1 +ATOM 11550 O O . PHE C 1 188 ? 68.225 42.203 116.443 1.00 6.12 ? 208 PHE D O 1 +ATOM 11551 C CB . PHE C 1 188 ? 65.483 44.057 116.429 1.00 6.81 ? 208 PHE D CB 1 +ATOM 11552 C CG . PHE C 1 188 ? 65.129 43.093 117.521 1.00 7.30 ? 208 PHE D CG 1 +ATOM 11553 C CD1 . PHE C 1 188 ? 65.805 43.113 118.724 1.00 7.82 ? 208 PHE D CD1 1 +ATOM 11554 C CD2 . PHE C 1 188 ? 64.084 42.194 117.361 1.00 5.73 ? 208 PHE D CD2 1 +ATOM 11555 C CE1 . PHE C 1 188 ? 65.477 42.234 119.724 1.00 8.63 ? 208 PHE D CE1 1 +ATOM 11556 C CE2 . PHE C 1 188 ? 63.751 41.316 118.369 1.00 6.85 ? 208 PHE D CE2 1 +ATOM 11557 C CZ . PHE C 1 188 ? 64.440 41.347 119.557 1.00 7.03 ? 208 PHE D CZ 1 +ATOM 11558 N N . PHE C 1 189 ? 68.629 44.413 116.239 1.00 6.40 ? 209 PHE D N 1 +ATOM 11559 C CA . PHE C 1 189 ? 70.013 44.308 116.687 1.00 6.45 ? 209 PHE D CA 1 +ATOM 11560 C C . PHE C 1 189 ? 70.061 44.026 118.166 1.00 6.59 ? 209 PHE D C 1 +ATOM 11561 O O . PHE C 1 189 ? 69.350 44.656 118.945 1.00 6.56 ? 209 PHE D O 1 +ATOM 11562 C CB . PHE C 1 189 ? 70.793 45.563 116.358 1.00 7.32 ? 209 PHE D CB 1 +ATOM 11563 C CG . PHE C 1 189 ? 72.243 45.427 116.632 1.00 7.47 ? 209 PHE D CG 1 +ATOM 11564 C CD1 . PHE C 1 189 ? 73.011 44.547 115.889 1.00 9.24 ? 209 PHE D CD1 1 +ATOM 11565 C CD2 . PHE C 1 189 ? 72.837 46.122 117.664 1.00 8.71 ? 209 PHE D CD2 1 +ATOM 11566 C CE1 . PHE C 1 189 ? 74.363 44.414 116.145 1.00 9.81 ? 209 PHE D CE1 1 +ATOM 11567 C CE2 . PHE C 1 189 ? 74.194 45.978 117.933 1.00 8.75 ? 209 PHE D CE2 1 +ATOM 11568 C CZ . PHE C 1 189 ? 74.952 45.154 117.171 1.00 9.82 ? 209 PHE D CZ 1 +ATOM 11569 N N . ASN C 1 190 ? 70.890 43.046 118.539 1.00 7.20 ? 210 ASN D N 1 +ATOM 11570 C CA . ASN C 1 190 ? 71.049 42.620 119.923 1.00 7.58 ? 210 ASN D CA 1 +ATOM 11571 C C . ASN C 1 190 ? 71.917 43.581 120.751 1.00 7.47 ? 210 ASN D C 1 +ATOM 11572 O O . ASN C 1 190 ? 72.983 43.198 121.285 1.00 7.29 ? 210 ASN D O 1 +ATOM 11573 C CB . ASN C 1 190 ? 71.623 41.200 119.967 1.00 7.77 ? 210 ASN D CB 1 +ATOM 11574 C CG . ASN C 1 190 ? 71.725 40.669 121.364 1.00 8.29 ? 210 ASN D CG 1 +ATOM 11575 O OD1 . ASN C 1 190 ? 70.834 40.899 122.183 1.00 10.09 ? 210 ASN D OD1 1 +ATOM 11576 N ND2 . ASN C 1 190 ? 72.818 39.951 121.659 1.00 9.68 ? 210 ASN D ND2 1 +ATOM 11577 N N . TYR C 1 191 ? 71.463 44.832 120.831 1.00 7.12 ? 211 TYR D N 1 +ATOM 11578 C CA . TYR C 1 191 ? 72.073 45.852 121.669 1.00 6.94 ? 211 TYR D CA 1 +ATOM 11579 C C . TYR C 1 191 ? 72.179 45.342 123.106 1.00 6.70 ? 211 TYR D C 1 +ATOM 11580 O O . TYR C 1 191 ? 71.333 44.567 123.572 1.00 6.19 ? 211 TYR D O 1 +ATOM 11581 C CB . TYR C 1 191 ? 71.226 47.155 121.674 1.00 6.87 ? 211 TYR D CB 1 +ATOM 11582 C CG . TYR C 1 191 ? 71.377 48.089 120.486 1.00 6.09 ? 211 TYR D CG 1 +ATOM 11583 C CD1 . TYR C 1 191 ? 72.524 48.850 120.319 1.00 7.83 ? 211 TYR D CD1 1 +ATOM 11584 C CD2 . TYR C 1 191 ? 70.358 48.249 119.560 1.00 7.13 ? 211 TYR D CD2 1 +ATOM 11585 C CE1 . TYR C 1 191 ? 72.678 49.711 119.241 1.00 8.46 ? 211 TYR D CE1 1 +ATOM 11586 C CE2 . TYR C 1 191 ? 70.493 49.116 118.485 1.00 6.82 ? 211 TYR D CE2 1 +ATOM 11587 C CZ . TYR C 1 191 ? 71.658 49.853 118.329 1.00 8.00 ? 211 TYR D CZ 1 +ATOM 11588 O OH . TYR C 1 191 ? 71.807 50.718 117.262 1.00 7.95 ? 211 TYR D OH 1 +ATOM 11589 N N . ALA C 1 192 ? 73.172 45.850 123.829 1.00 7.38 ? 212 ALA D N 1 +ATOM 11590 C CA . ALA C 1 192 ? 73.340 45.549 125.247 1.00 7.51 ? 212 ALA D CA 1 +ATOM 11591 C C . ALA C 1 192 ? 73.847 46.736 126.069 1.00 8.16 ? 212 ALA D C 1 +ATOM 11592 O O . ALA C 1 192 ? 74.274 47.774 125.528 1.00 7.67 ? 212 ALA D O 1 +ATOM 11593 C CB . ALA C 1 192 ? 74.253 44.305 125.437 1.00 8.24 ? 212 ALA D CB 1 +ATOM 11594 N N . GLY C 1 193 ? 73.735 46.577 127.388 1.00 7.69 ? 213 GLY D N 1 +ATOM 11595 C CA . GLY C 1 193 ? 74.211 47.561 128.353 1.00 8.29 ? 213 GLY D CA 1 +ATOM 11596 C C . GLY C 1 193 ? 73.197 47.683 129.466 1.00 7.88 ? 213 GLY D C 1 +ATOM 11597 O O . GLY C 1 193 ? 72.310 46.845 129.601 1.00 8.52 ? 213 GLY D O 1 +ATOM 11598 N N . LEU C 1 194 ? 73.336 48.746 130.253 1.00 7.88 ? 214 LEU D N 1 +ATOM 11599 C CA . LEU C 1 194 ? 72.335 49.116 131.225 1.00 7.40 ? 214 LEU D CA 1 +ATOM 11600 C C . LEU C 1 194 ? 71.456 50.144 130.515 1.00 7.89 ? 214 LEU D C 1 +ATOM 11601 O O . LEU C 1 194 ? 71.699 51.350 130.575 1.00 7.48 ? 214 LEU D O 1 +ATOM 11602 C CB . LEU C 1 194 ? 72.989 49.710 132.477 1.00 7.86 ? 214 LEU D CB 1 +ATOM 11603 C CG . LEU C 1 194 ? 73.773 48.746 133.371 1.00 7.95 ? 214 LEU D CG 1 +ATOM 11604 C CD1 . LEU C 1 194 ? 74.614 49.560 134.346 1.00 7.64 ? 214 LEU D CD1 1 +ATOM 11605 C CD2 . LEU C 1 194 ? 72.832 47.845 134.126 1.00 7.30 ? 214 LEU D CD2 1 +ATOM 11606 N N . GLN C 1 195 ? 70.438 49.627 129.840 1.00 7.71 ? 215 GLN D N 1 +ATOM 11607 C CA . GLN C 1 195 ? 69.600 50.382 128.905 1.00 7.88 ? 215 GLN D CA 1 +ATOM 11608 C C . GLN C 1 195 ? 68.403 51.064 129.567 1.00 8.22 ? 215 GLN D C 1 +ATOM 11609 O O . GLN C 1 195 ? 67.688 51.810 128.923 1.00 7.97 ? 215 GLN D O 1 +ATOM 11610 C CB . GLN C 1 195 ? 69.142 49.444 127.782 1.00 7.68 ? 215 GLN D CB 1 +ATOM 11611 C CG . GLN C 1 195 ? 70.314 48.788 127.049 1.00 8.01 ? 215 GLN D CG 1 +ATOM 11612 C CD . GLN C 1 195 ? 69.959 47.612 126.155 1.00 8.44 ? 215 GLN D CD 1 +ATOM 11613 O OE1 . GLN C 1 195 ? 69.219 46.704 126.535 1.00 12.88 ? 215 GLN D OE1 1 +ATOM 11614 N NE2 . GLN C 1 195 ? 70.556 47.584 124.988 1.00 6.33 ? 215 GLN D NE2 1 +ATOM 11615 N N . ARG C 1 196 ? 68.207 50.793 130.857 1.00 8.37 ? 216 ARG D N 1 +ATOM 11616 C CA . ARG C 1 196 ? 67.143 51.366 131.640 1.00 8.48 ? 216 ARG D CA 1 +ATOM 11617 C C . ARG C 1 196 ? 67.671 51.876 132.963 1.00 9.23 ? 216 ARG D C 1 +ATOM 11618 O O . ARG C 1 196 ? 68.753 51.496 133.426 1.00 8.67 ? 216 ARG D O 1 +ATOM 11619 C CB . ARG C 1 196 ? 66.025 50.354 131.848 1.00 8.41 ? 216 ARG D CB 1 +ATOM 11620 C CG . ARG C 1 196 ? 65.343 50.008 130.546 1.00 7.94 ? 216 ARG D CG 1 +ATOM 11621 C CD . ARG C 1 196 ? 64.130 49.127 130.718 1.00 7.58 ? 216 ARG D CD 1 +ATOM 11622 N NE . ARG C 1 196 ? 63.664 48.720 129.400 1.00 7.55 ? 216 ARG D NE 1 +ATOM 11623 C CZ . ARG C 1 196 ? 62.945 47.633 129.139 1.00 8.49 ? 216 ARG D CZ 1 +ATOM 11624 N NH1 . ARG C 1 196 ? 62.519 46.829 130.107 1.00 8.10 ? 216 ARG D NH1 1 +ATOM 11625 N NH2 . ARG C 1 196 ? 62.633 47.363 127.890 1.00 8.50 ? 216 ARG D NH2 1 +ATOM 11626 N N . SER C 1 197 ? 66.876 52.742 133.566 1.00 10.39 ? 217 SER D N 1 +ATOM 11627 C CA . SER C 1 197 ? 67.280 53.451 134.761 1.00 11.97 ? 217 SER D CA 1 +ATOM 11628 C C . SER C 1 197 ? 67.684 52.494 135.882 1.00 11.85 ? 217 SER D C 1 +ATOM 11629 O O . SER C 1 197 ? 67.047 51.440 136.090 1.00 11.63 ? 217 SER D O 1 +ATOM 11630 C CB . SER C 1 197 ? 66.136 54.348 135.206 1.00 12.55 ? 217 SER D CB 1 +ATOM 11631 O OG . SER C 1 197 ? 65.781 55.258 134.156 1.00 16.20 ? 217 SER D OG 1 +ATOM 11632 N N . VAL C 1 198 ? 68.769 52.856 136.564 1.00 11.68 ? 218 VAL D N 1 +ATOM 11633 C CA . VAL C 1 198 ? 69.238 52.187 137.760 1.00 12.03 ? 218 VAL D CA 1 +ATOM 11634 C C . VAL C 1 198 ? 69.046 53.173 138.917 1.00 12.30 ? 218 VAL D C 1 +ATOM 11635 O O . VAL C 1 198 ? 69.389 54.355 138.802 1.00 12.18 ? 218 VAL D O 1 +ATOM 11636 C CB . VAL C 1 198 ? 70.721 51.809 137.625 1.00 12.09 ? 218 VAL D CB 1 +ATOM 11637 C CG1 . VAL C 1 198 ? 71.225 51.254 138.911 1.00 11.82 ? 218 VAL D CG1 1 +ATOM 11638 C CG2 . VAL C 1 198 ? 70.900 50.825 136.470 1.00 12.92 ? 218 VAL D CG2 1 +ATOM 11639 N N . LEU C 1 199 ? 68.450 52.707 140.006 1.00 12.37 ? 219 LEU D N 1 +ATOM 11640 C CA . LEU C 1 199 ? 68.262 53.565 141.170 1.00 12.93 ? 219 LEU D CA 1 +ATOM 11641 C C . LEU C 1 199 ? 68.341 52.815 142.486 1.00 12.54 ? 219 LEU D C 1 +ATOM 11642 O O . LEU C 1 199 ? 68.278 51.581 142.535 1.00 12.26 ? 219 LEU D O 1 +ATOM 11643 C CB . LEU C 1 199 ? 66.933 54.333 141.100 1.00 13.28 ? 219 LEU D CB 1 +ATOM 11644 C CG . LEU C 1 199 ? 65.653 53.508 141.243 1.00 14.36 ? 219 LEU D CG 1 +ATOM 11645 C CD1 . LEU C 1 199 ? 64.513 54.382 141.735 1.00 15.83 ? 219 LEU D CD1 1 +ATOM 11646 C CD2 . LEU C 1 199 ? 65.293 52.824 139.923 1.00 14.10 ? 219 LEU D CD2 1 +ATOM 11647 N N . LEU C 1 200 ? 68.506 53.605 143.541 1.00 12.57 ? 220 LEU D N 1 +ATOM 11648 C CA . LEU C 1 200 ? 68.401 53.155 144.916 1.00 12.45 ? 220 LEU D CA 1 +ATOM 11649 C C . LEU C 1 200 ? 67.082 53.710 145.409 1.00 12.58 ? 220 LEU D C 1 +ATOM 11650 O O . LEU C 1 200 ? 66.688 54.805 145.025 1.00 11.67 ? 220 LEU D O 1 +ATOM 11651 C CB . LEU C 1 200 ? 69.550 53.711 145.765 1.00 12.87 ? 220 LEU D CB 1 +ATOM 11652 C CG . LEU C 1 200 ? 70.958 53.241 145.388 1.00 14.15 ? 220 LEU D CG 1 +ATOM 11653 C CD1 . LEU C 1 200 ? 72.045 54.133 145.967 1.00 13.27 ? 220 LEU D CD1 1 +ATOM 11654 C CD2 . LEU C 1 200 ? 71.185 51.810 145.814 1.00 14.57 ? 220 LEU D CD2 1 +ATOM 11655 N N . TYR C 1 201 ? 66.369 52.936 146.210 1.00 12.15 ? 221 TYR D N 1 +ATOM 11656 C CA . TYR C 1 201 ? 65.197 53.469 146.865 1.00 12.65 ? 221 TYR D CA 1 +ATOM 11657 C C . TYR C 1 201 ? 65.072 52.907 148.259 1.00 12.77 ? 221 TYR D C 1 +ATOM 11658 O O . TYR C 1 201 ? 65.748 51.938 148.612 1.00 12.80 ? 221 TYR D O 1 +ATOM 11659 C CB . TYR C 1 201 ? 63.941 53.238 146.017 1.00 12.53 ? 221 TYR D CB 1 +ATOM 11660 C CG . TYR C 1 201 ? 63.401 51.825 145.927 1.00 12.38 ? 221 TYR D CG 1 +ATOM 11661 C CD1 . TYR C 1 201 ? 62.410 51.395 146.798 1.00 12.34 ? 221 TYR D CD1 1 +ATOM 11662 C CD2 . TYR C 1 201 ? 63.813 50.948 144.921 1.00 11.54 ? 221 TYR D CD2 1 +ATOM 11663 C CE1 . TYR C 1 201 ? 61.873 50.147 146.702 1.00 12.97 ? 221 TYR D CE1 1 +ATOM 11664 C CE2 . TYR C 1 201 ? 63.272 49.669 144.824 1.00 12.65 ? 221 TYR D CE2 1 +ATOM 11665 C CZ . TYR C 1 201 ? 62.291 49.285 145.722 1.00 13.14 ? 221 TYR D CZ 1 +ATOM 11666 O OH . TYR C 1 201 ? 61.700 48.037 145.695 1.00 12.65 ? 221 TYR D OH 1 +ATOM 11667 N N . THR C 1 202 ? 64.238 53.551 149.068 1.00 13.48 ? 222 THR D N 1 +ATOM 11668 C CA . THR C 1 202 ? 64.060 53.126 150.439 1.00 13.52 ? 222 THR D CA 1 +ATOM 11669 C C . THR C 1 202 ? 62.606 52.858 150.732 1.00 13.37 ? 222 THR D C 1 +ATOM 11670 O O . THR C 1 202 ? 61.712 53.437 150.108 1.00 13.44 ? 222 THR D O 1 +ATOM 11671 C CB . THR C 1 202 ? 64.564 54.176 151.432 1.00 13.97 ? 222 THR D CB 1 +ATOM 11672 O OG1 . THR C 1 202 ? 63.821 55.398 151.267 1.00 14.10 ? 222 THR D OG1 1 +ATOM 11673 C CG2 . THR C 1 202 ? 66.049 54.434 151.211 1.00 13.91 ? 222 THR D CG2 1 +ATOM 11674 N N . THR C 1 203 ? 62.398 51.950 151.673 1.00 13.71 ? 223 THR D N 1 +ATOM 11675 C CA . THR C 1 203 ? 61.101 51.733 152.306 1.00 14.08 ? 223 THR D CA 1 +ATOM 11676 C C . THR C 1 203 ? 61.348 51.517 153.797 1.00 14.45 ? 223 THR D C 1 +ATOM 11677 O O . THR C 1 203 ? 62.492 51.433 154.227 1.00 14.24 ? 223 THR D O 1 +ATOM 11678 C CB . THR C 1 203 ? 60.403 50.495 151.750 1.00 13.76 ? 223 THR D CB 1 +ATOM 11679 O OG1 . THR C 1 203 ? 61.073 49.319 152.216 1.00 14.11 ? 223 THR D OG1 1 +ATOM 11680 C CG2 . THR C 1 203 ? 60.373 50.521 150.227 1.00 13.90 ? 223 THR D CG2 1 +ATOM 11681 N N . PRO C 1 204 ? 60.275 51.449 154.600 1.00 15.26 ? 224 PRO D N 1 +ATOM 11682 C CA . PRO C 1 204 ? 60.452 50.931 155.956 1.00 15.53 ? 224 PRO D CA 1 +ATOM 11683 C C . PRO C 1 204 ? 60.794 49.432 155.913 1.00 15.96 ? 224 PRO D C 1 +ATOM 11684 O O . PRO C 1 204 ? 60.651 48.804 154.859 1.00 15.42 ? 224 PRO D O 1 +ATOM 11685 C CB . PRO C 1 204 ? 59.085 51.183 156.613 1.00 15.67 ? 224 PRO D CB 1 +ATOM 11686 C CG . PRO C 1 204 ? 58.376 52.156 155.730 1.00 15.15 ? 224 PRO D CG 1 +ATOM 11687 C CD . PRO C 1 204 ? 58.891 51.886 154.352 1.00 15.59 ? 224 PRO D CD 1 +ATOM 11688 N N . THR C 1 205 ? 61.260 48.866 157.028 1.00 16.37 ? 225 THR D N 1 +ATOM 11689 C CA . THR C 1 205 ? 61.636 47.445 157.054 1.00 16.39 ? 225 THR D CA 1 +ATOM 11690 C C . THR C 1 205 ? 60.432 46.496 156.986 1.00 16.60 ? 225 THR D C 1 +ATOM 11691 O O . THR C 1 205 ? 60.599 45.310 156.702 1.00 17.10 ? 225 THR D O 1 +ATOM 11692 C CB . THR C 1 205 ? 62.496 47.090 158.288 1.00 16.52 ? 225 THR D CB 1 +ATOM 11693 O OG1 . THR C 1 205 ? 61.791 47.434 159.485 1.00 16.70 ? 225 THR D OG1 1 +ATOM 11694 C CG2 . THR C 1 205 ? 63.804 47.830 158.242 1.00 16.54 ? 225 THR D CG2 1 +ATOM 11695 N N . THR C 1 206 ? 59.238 47.012 157.275 1.00 16.57 ? 226 THR D N 1 +ATOM 11696 C CA . THR C 1 206 ? 57.983 46.339 156.943 1.00 16.51 ? 226 THR D CA 1 +ATOM 11697 C C . THR C 1 206 ? 57.282 47.224 155.919 1.00 16.17 ? 226 THR D C 1 +ATOM 11698 O O . THR C 1 206 ? 57.054 48.403 156.176 1.00 16.26 ? 226 THR D O 1 +ATOM 11699 C CB . THR C 1 206 ? 57.102 46.105 158.187 1.00 16.52 ? 226 THR D CB 1 +ATOM 11700 O OG1 . THR C 1 206 ? 57.821 45.312 159.139 1.00 17.35 ? 226 THR D OG1 1 +ATOM 11701 C CG2 . THR C 1 206 ? 55.801 45.395 157.818 1.00 16.45 ? 226 THR D CG2 1 +ATOM 11702 N N . TYR C 1 207 ? 56.944 46.659 154.760 1.00 16.25 ? 227 TYR D N 1 +ATOM 11703 C CA . TYR C 1 207 ? 56.594 47.474 153.595 1.00 16.08 ? 227 TYR D CA 1 +ATOM 11704 C C . TYR C 1 207 ? 55.575 46.814 152.663 1.00 15.67 ? 227 TYR D C 1 +ATOM 11705 O O . TYR C 1 207 ? 55.382 45.594 152.690 1.00 15.54 ? 227 TYR D O 1 +ATOM 11706 C CB . TYR C 1 207 ? 57.874 47.780 152.813 1.00 16.27 ? 227 TYR D CB 1 +ATOM 11707 C CG . TYR C 1 207 ? 58.633 46.530 152.431 1.00 17.24 ? 227 TYR D CG 1 +ATOM 11708 C CD1 . TYR C 1 207 ? 59.511 45.933 153.328 1.00 17.34 ? 227 TYR D CD1 1 +ATOM 11709 C CD2 . TYR C 1 207 ? 58.445 45.920 151.197 1.00 18.41 ? 227 TYR D CD2 1 +ATOM 11710 C CE1 . TYR C 1 207 ? 60.197 44.787 153.010 1.00 16.70 ? 227 TYR D CE1 1 +ATOM 11711 C CE2 . TYR C 1 207 ? 59.139 44.754 150.864 1.00 17.22 ? 227 TYR D CE2 1 +ATOM 11712 C CZ . TYR C 1 207 ? 60.011 44.196 151.778 1.00 17.69 ? 227 TYR D CZ 1 +ATOM 11713 O OH . TYR C 1 207 ? 60.705 43.034 151.479 1.00 18.71 ? 227 TYR D OH 1 +ATOM 11714 N N . ILE C 1 208 ? 54.929 47.634 151.832 1.00 15.00 ? 228 ILE D N 1 +ATOM 11715 C CA . ILE C 1 208 ? 54.028 47.132 150.796 1.00 15.12 ? 228 ILE D CA 1 +ATOM 11716 C C . ILE C 1 208 ? 54.892 46.503 149.697 1.00 15.23 ? 228 ILE D C 1 +ATOM 11717 O O . ILE C 1 208 ? 55.636 47.212 149.028 1.00 15.07 ? 228 ILE D O 1 +ATOM 11718 C CB . ILE C 1 208 ? 53.139 48.273 150.230 1.00 14.92 ? 228 ILE D CB 1 +ATOM 11719 C CG1 . ILE C 1 208 ? 52.292 48.904 151.355 1.00 14.55 ? 228 ILE D CG1 1 +ATOM 11720 C CG2 . ILE C 1 208 ? 52.235 47.757 149.112 1.00 14.50 ? 228 ILE D CG2 1 +ATOM 11721 C CD1 . ILE C 1 208 ? 51.668 50.239 150.992 1.00 15.49 ? 228 ILE D CD1 1 +ATOM 11722 N N . ASP C 1 209 ? 54.837 45.180 149.555 1.00 15.17 ? 229 ASP D N 1 +ATOM 11723 C CA . ASP C 1 209 ? 55.692 44.449 148.591 1.00 15.11 ? 229 ASP D CA 1 +ATOM 11724 C C . ASP C 1 209 ? 55.037 44.214 147.228 1.00 15.02 ? 229 ASP D C 1 +ATOM 11725 O O . ASP C 1 209 ? 55.724 44.156 146.210 1.00 14.28 ? 229 ASP D O 1 +ATOM 11726 C CB . ASP C 1 209 ? 56.144 43.111 149.184 1.00 15.63 ? 229 ASP D CB 1 +ATOM 11727 C CG . ASP C 1 209 ? 57.178 42.387 148.315 1.00 15.85 ? 229 ASP D CG 1 +ATOM 11728 O OD1 . ASP C 1 209 ? 58.336 42.844 148.206 1.00 17.83 ? 229 ASP D OD1 1 +ATOM 11729 O OD2 . ASP C 1 209 ? 56.830 41.345 147.747 1.00 17.02 ? 229 ASP D OD2 1 +ATOM 11730 N N . ASP C 1 210 ? 53.720 44.062 147.201 1.00 15.28 ? 230 ASP D N 1 +ATOM 11731 C CA . ASP C 1 210 ? 53.022 43.727 145.966 1.00 15.70 ? 230 ASP D CA 1 +ATOM 11732 C C . ASP C 1 210 ? 51.578 44.204 146.056 1.00 15.73 ? 230 ASP D C 1 +ATOM 11733 O O . ASP C 1 210 ? 50.976 44.204 147.137 1.00 16.12 ? 230 ASP D O 1 +ATOM 11734 C CB . ASP C 1 210 ? 53.073 42.204 145.726 1.00 16.27 ? 230 ASP D CB 1 +ATOM 11735 C CG . ASP C 1 210 ? 52.829 41.799 144.264 1.00 17.17 ? 230 ASP D CG 1 +ATOM 11736 O OD1 . ASP C 1 210 ? 52.505 42.656 143.411 1.00 17.32 ? 230 ASP D OD1 1 +ATOM 11737 O OD2 . ASP C 1 210 ? 52.966 40.585 143.976 1.00 19.76 ? 230 ASP D OD2 1 +ATOM 11738 N N . ILE C 1 211 ? 51.037 44.629 144.918 1.00 15.51 ? 231 ILE D N 1 +ATOM 11739 C CA . ILE C 1 211 ? 49.626 44.991 144.802 1.00 15.03 ? 231 ILE D CA 1 +ATOM 11740 C C . ILE C 1 211 ? 49.097 44.379 143.520 1.00 15.53 ? 231 ILE D C 1 +ATOM 11741 O O . ILE C 1 211 ? 49.777 44.391 142.496 1.00 14.98 ? 231 ILE D O 1 +ATOM 11742 C CB . ILE C 1 211 ? 49.417 46.526 144.747 1.00 15.16 ? 231 ILE D CB 1 +ATOM 11743 C CG1 . ILE C 1 211 ? 49.992 47.205 145.990 1.00 14.34 ? 231 ILE D CG1 1 +ATOM 11744 C CG2 . ILE C 1 211 ? 47.938 46.871 144.584 1.00 14.62 ? 231 ILE D CG2 1 +ATOM 11745 C CD1 . ILE C 1 211 ? 50.072 48.718 145.858 1.00 15.10 ? 231 ILE D CD1 1 +ATOM 11746 N N . THR C 1 212 ? 47.894 43.815 143.581 1.00 15.37 ? 232 THR D N 1 +ATOM 11747 C CA . THR C 1 212 ? 47.239 43.296 142.391 1.00 15.95 ? 232 THR D CA 1 +ATOM 11748 C C . THR C 1 212 ? 45.818 43.840 142.355 1.00 16.16 ? 232 THR D C 1 +ATOM 11749 O O . THR C 1 212 ? 45.062 43.691 143.326 1.00 16.36 ? 232 THR D O 1 +ATOM 11750 C CB . THR C 1 212 ? 47.248 41.757 142.358 1.00 16.04 ? 232 THR D CB 1 +ATOM 11751 O OG1 . THR C 1 212 ? 48.595 41.283 142.297 1.00 16.92 ? 232 THR D OG1 1 +ATOM 11752 C CG2 . THR C 1 212 ? 46.490 41.239 141.144 1.00 17.13 ? 232 THR D CG2 1 +ATOM 11753 N N . VAL C 1 213 ? 45.477 44.489 141.241 1.00 15.96 ? 233 VAL D N 1 +ATOM 11754 C CA . VAL C 1 213 ? 44.161 45.069 141.039 1.00 16.51 ? 233 VAL D CA 1 +ATOM 11755 C C . VAL C 1 213 ? 43.548 44.489 139.773 1.00 16.64 ? 233 VAL D C 1 +ATOM 11756 O O . VAL C 1 213 ? 44.225 44.358 138.766 1.00 15.82 ? 233 VAL D O 1 +ATOM 11757 C CB . VAL C 1 213 ? 44.256 46.599 140.894 1.00 16.45 ? 233 VAL D CB 1 +ATOM 11758 C CG1 . VAL C 1 213 ? 42.947 47.194 140.361 1.00 16.85 ? 233 VAL D CG1 1 +ATOM 11759 C CG2 . VAL C 1 213 ? 44.636 47.239 142.223 1.00 17.69 ? 233 VAL D CG2 1 +ATOM 11760 N N . THR C 1 214 ? 42.271 44.125 139.833 1.00 17.24 ? 234 THR D N 1 +ATOM 11761 C CA . THR C 1 214 ? 41.483 43.874 138.618 1.00 18.28 ? 234 THR D CA 1 +ATOM 11762 C C . THR C 1 214 ? 40.185 44.679 138.707 1.00 18.73 ? 234 THR D C 1 +ATOM 11763 O O . THR C 1 214 ? 39.691 44.929 139.806 1.00 19.21 ? 234 THR D O 1 +ATOM 11764 C CB . THR C 1 214 ? 41.184 42.378 138.414 1.00 18.35 ? 234 THR D CB 1 +ATOM 11765 O OG1 . THR C 1 214 ? 40.407 41.876 139.509 1.00 19.27 ? 234 THR D OG1 1 +ATOM 11766 C CG2 . THR C 1 214 ? 42.480 41.585 138.316 1.00 18.47 ? 234 THR D CG2 1 +ATOM 11767 N N . THR C 1 215 ? 39.644 45.090 137.562 1.00 19.31 ? 235 THR D N 1 +ATOM 11768 C CA . THR C 1 215 ? 38.469 45.962 137.534 1.00 20.01 ? 235 THR D CA 1 +ATOM 11769 C C . THR C 1 215 ? 37.339 45.379 136.693 1.00 20.85 ? 235 THR D C 1 +ATOM 11770 O O . THR C 1 215 ? 37.579 44.776 135.651 1.00 20.99 ? 235 THR D O 1 +ATOM 11771 C CB . THR C 1 215 ? 38.817 47.364 136.990 1.00 20.13 ? 235 THR D CB 1 +ATOM 11772 O OG1 . THR C 1 215 ? 39.268 47.263 135.632 1.00 18.61 ? 235 THR D OG1 1 +ATOM 11773 C CG2 . THR C 1 215 ? 39.906 48.021 137.850 1.00 19.32 ? 235 THR D CG2 1 +ATOM 11774 N N . SER C 1 216 ? 36.108 45.547 137.172 1.00 22.47 ? 236 SER D N 1 +ATOM 11775 C CA . SER C 1 216 ? 34.918 45.137 136.429 1.00 23.08 ? 236 SER D CA 1 +ATOM 11776 C C . SER C 1 216 ? 33.820 46.181 136.606 1.00 23.90 ? 236 SER D C 1 +ATOM 11777 O O . SER C 1 216 ? 33.988 47.163 137.333 1.00 22.96 ? 236 SER D O 1 +ATOM 11778 C CB . SER C 1 216 ? 34.442 43.740 136.867 1.00 23.53 ? 236 SER D CB 1 +ATOM 11779 O OG . SER C 1 216 ? 33.809 43.755 138.142 1.00 24.14 ? 236 SER D OG 1 +ATOM 11780 N N . VAL C 1 217 ? 32.703 45.969 135.919 1.00 25.33 ? 237 VAL D N 1 +ATOM 11781 C CA . VAL C 1 217 ? 31.590 46.908 135.956 1.00 26.46 ? 237 VAL D CA 1 +ATOM 11782 C C . VAL C 1 217 ? 30.294 46.175 136.301 1.00 27.65 ? 237 VAL D C 1 +ATOM 11783 O O . VAL C 1 217 ? 30.062 45.060 135.830 1.00 27.66 ? 237 VAL D O 1 +ATOM 11784 C CB . VAL C 1 217 ? 31.434 47.622 134.604 1.00 26.68 ? 237 VAL D CB 1 +ATOM 11785 C CG1 . VAL C 1 217 ? 31.043 46.622 133.509 1.00 26.82 ? 237 VAL D CG1 1 +ATOM 11786 C CG2 . VAL C 1 217 ? 30.423 48.764 134.707 1.00 26.70 ? 237 VAL D CG2 1 +ATOM 11787 N N . GLU C 1 218 ? 29.488 46.797 137.159 1.00 28.93 ? 238 GLU D N 1 +ATOM 11788 C CA . GLU C 1 218 ? 28.146 46.312 137.502 1.00 29.80 ? 238 GLU D CA 1 +ATOM 11789 C C . GLU C 1 218 ? 27.194 47.435 137.162 1.00 30.29 ? 238 GLU D C 1 +ATOM 11790 O O . GLU C 1 218 ? 27.242 48.499 137.787 1.00 30.29 ? 238 GLU D O 1 +ATOM 11791 C CB . GLU C 1 218 ? 28.033 46.000 138.993 1.00 30.25 ? 238 GLU D CB 1 +ATOM 11792 C CG . GLU C 1 218 ? 28.857 44.812 139.453 1.00 31.35 ? 238 GLU D CG 1 +ATOM 11793 C CD . GLU C 1 218 ? 28.270 43.469 139.054 1.00 32.67 ? 238 GLU D CD 1 +ATOM 11794 O OE1 . GLU C 1 218 ? 27.029 43.340 138.979 1.00 33.84 ? 238 GLU D OE1 1 +ATOM 11795 O OE2 . GLU C 1 218 ? 29.063 42.533 138.827 1.00 33.88 ? 238 GLU D OE2 1 +ATOM 11796 N N . GLN C 1 219 ? 26.332 47.210 136.173 1.00 30.92 ? 239 GLN D N 1 +ATOM 11797 C CA . GLN C 1 219 ? 25.498 48.278 135.646 1.00 31.16 ? 239 GLN D CA 1 +ATOM 11798 C C . GLN C 1 219 ? 26.406 49.496 135.433 1.00 31.17 ? 239 GLN D C 1 +ATOM 11799 O O . GLN C 1 219 ? 27.338 49.430 134.624 1.00 31.46 ? 239 GLN D O 1 +ATOM 11800 C CB . GLN C 1 219 ? 24.311 48.562 136.581 1.00 31.48 ? 239 GLN D CB 1 +ATOM 11801 C CG . GLN C 1 219 ? 23.212 47.500 136.540 1.00 32.50 ? 239 GLN D CG 1 +ATOM 11802 C CD . GLN C 1 219 ? 23.650 46.163 137.118 1.00 33.90 ? 239 GLN D CD 1 +ATOM 11803 O OE1 . GLN C 1 219 ? 23.850 46.025 138.328 1.00 35.50 ? 239 GLN D OE1 1 +ATOM 11804 N NE2 . GLN C 1 219 ? 23.790 45.167 136.252 1.00 35.89 ? 239 GLN D NE2 1 +ATOM 11805 N N . ASP C 1 220 ? 26.181 50.578 136.178 1.00 30.93 ? 240 ASP D N 1 +ATOM 11806 C CA . ASP C 1 220 ? 26.980 51.794 136.036 1.00 30.74 ? 240 ASP D CA 1 +ATOM 11807 C C . ASP C 1 220 ? 27.941 51.982 137.221 1.00 30.17 ? 240 ASP D C 1 +ATOM 11808 O O . ASP C 1 220 ? 28.455 53.082 137.448 1.00 29.78 ? 240 ASP D O 1 +ATOM 11809 C CB . ASP C 1 220 ? 26.071 53.012 135.875 1.00 31.04 ? 240 ASP D CB 1 +ATOM 11810 C CG . ASP C 1 220 ? 25.163 53.229 137.068 1.00 31.96 ? 240 ASP D CG 1 +ATOM 11811 O OD1 . ASP C 1 220 ? 24.840 52.236 137.761 1.00 33.61 ? 240 ASP D OD1 1 +ATOM 11812 O OD2 . ASP C 1 220 ? 24.771 54.394 137.307 1.00 33.37 ? 240 ASP D OD2 1 +ATOM 11813 N N . SER C 1 221 ? 28.181 50.898 137.958 1.00 29.67 ? 241 SER D N 1 +ATOM 11814 C CA . SER C 1 221 ? 29.110 50.902 139.082 1.00 29.36 ? 241 SER D CA 1 +ATOM 11815 C C . SER C 1 221 ? 30.454 50.339 138.655 1.00 28.65 ? 241 SER D C 1 +ATOM 11816 O O . SER C 1 221 ? 30.516 49.418 137.838 1.00 28.40 ? 241 SER D O 1 +ATOM 11817 C CB . SER C 1 221 ? 28.573 50.049 140.229 1.00 29.47 ? 241 SER D CB 1 +ATOM 11818 O OG . SER C 1 221 ? 29.452 50.100 141.338 1.00 31.25 ? 241 SER D OG 1 +ATOM 11819 N N . GLY C 1 222 ? 31.521 50.900 139.215 1.00 27.80 ? 242 GLY D N 1 +ATOM 11820 C CA . GLY C 1 222 ? 32.864 50.372 139.024 1.00 27.21 ? 242 GLY D CA 1 +ATOM 11821 C C . GLY C 1 222 ? 33.237 49.502 140.208 1.00 26.70 ? 242 GLY D C 1 +ATOM 11822 O O . GLY C 1 222 ? 32.959 49.867 141.355 1.00 26.99 ? 242 GLY D O 1 +ATOM 11823 N N . LEU C 1 223 ? 33.859 48.359 139.930 1.00 25.89 ? 243 LEU D N 1 +ATOM 11824 C CA . LEU C 1 223 ? 34.327 47.431 140.961 1.00 25.31 ? 243 LEU D CA 1 +ATOM 11825 C C . LEU C 1 223 ? 35.843 47.268 140.855 1.00 24.87 ? 243 LEU D C 1 +ATOM 11826 O O . LEU C 1 223 ? 36.345 46.814 139.823 1.00 24.54 ? 243 LEU D O 1 +ATOM 11827 C CB . LEU C 1 223 ? 33.670 46.062 140.803 1.00 25.45 ? 243 LEU D CB 1 +ATOM 11828 C CG . LEU C 1 223 ? 32.147 45.971 140.930 1.00 25.41 ? 243 LEU D CG 1 +ATOM 11829 C CD1 . LEU C 1 223 ? 31.733 44.513 140.809 1.00 25.71 ? 243 LEU D CD1 1 +ATOM 11830 C CD2 . LEU C 1 223 ? 31.648 46.556 142.242 1.00 25.15 ? 243 LEU D CD2 1 +ATOM 11831 N N . VAL C 1 224 ? 36.549 47.634 141.924 1.00 24.11 ? 244 VAL D N 1 +ATOM 11832 C CA . VAL C 1 224 ? 38.008 47.553 141.987 1.00 23.53 ? 244 VAL D CA 1 +ATOM 11833 C C . VAL C 1 224 ? 38.412 46.504 143.032 1.00 23.36 ? 244 VAL D C 1 +ATOM 11834 O O . VAL C 1 224 ? 38.363 46.758 144.240 1.00 23.64 ? 244 VAL D O 1 +ATOM 11835 C CB . VAL C 1 224 ? 38.617 48.943 142.330 1.00 23.52 ? 244 VAL D CB 1 +ATOM 11836 C CG1 . VAL C 1 224 ? 40.146 48.919 142.244 1.00 23.45 ? 244 VAL D CG1 1 +ATOM 11837 C CG2 . VAL C 1 224 ? 38.053 50.002 141.406 1.00 23.15 ? 244 VAL D CG2 1 +ATOM 11838 N N . ASN C 1 225 ? 38.790 45.317 142.564 1.00 22.90 ? 245 ASN D N 1 +ATOM 11839 C CA . ASN C 1 225 ? 39.305 44.259 143.438 1.00 22.86 ? 245 ASN D CA 1 +ATOM 11840 C C . ASN C 1 225 ? 40.785 44.481 143.727 1.00 22.48 ? 245 ASN D C 1 +ATOM 11841 O O . ASN C 1 225 ? 41.566 44.645 142.799 1.00 21.70 ? 245 ASN D O 1 +ATOM 11842 C CB . ASN C 1 225 ? 39.123 42.882 142.797 1.00 23.22 ? 245 ASN D CB 1 +ATOM 11843 C CG . ASN C 1 225 ? 37.680 42.397 142.834 1.00 24.36 ? 245 ASN D CG 1 +ATOM 11844 O OD1 . ASN C 1 225 ? 36.746 43.172 142.657 1.00 27.55 ? 245 ASN D OD1 1 +ATOM 11845 N ND2 . ASN C 1 225 ? 37.498 41.105 143.054 1.00 26.33 ? 245 ASN D ND2 1 +ATOM 11846 N N . TYR C 1 226 ? 41.174 44.478 145.001 1.00 22.36 ? 246 TYR D N 1 +ATOM 11847 C CA . TYR C 1 226 ? 42.592 44.631 145.355 1.00 22.28 ? 246 TYR D CA 1 +ATOM 11848 C C . TYR C 1 226 ? 43.090 43.487 146.224 1.00 21.94 ? 246 TYR D C 1 +ATOM 11849 O O . TYR C 1 226 ? 42.323 42.865 146.979 1.00 22.05 ? 246 TYR D O 1 +ATOM 11850 C CB . TYR C 1 226 ? 42.862 45.976 146.044 1.00 22.36 ? 246 TYR D CB 1 +ATOM 11851 C CG . TYR C 1 226 ? 42.124 46.162 147.353 1.00 22.70 ? 246 TYR D CG 1 +ATOM 11852 C CD1 . TYR C 1 226 ? 40.880 46.770 147.382 1.00 23.01 ? 246 TYR D CD1 1 +ATOM 11853 C CD2 . TYR C 1 226 ? 42.668 45.722 148.557 1.00 23.41 ? 246 TYR D CD2 1 +ATOM 11854 C CE1 . TYR C 1 226 ? 40.190 46.941 148.575 1.00 23.62 ? 246 TYR D CE1 1 +ATOM 11855 C CE2 . TYR C 1 226 ? 41.982 45.885 149.761 1.00 23.34 ? 246 TYR D CE2 1 +ATOM 11856 C CZ . TYR C 1 226 ? 40.746 46.499 149.758 1.00 23.32 ? 246 TYR D CZ 1 +ATOM 11857 O OH . TYR C 1 226 ? 40.044 46.677 150.929 1.00 23.36 ? 246 TYR D OH 1 +ATOM 11858 N N . GLN C 1 227 ? 44.378 43.199 146.075 1.00 21.60 ? 247 GLN D N 1 +ATOM 11859 C CA A GLN C 1 227 ? 45.072 42.212 146.893 0.50 21.42 ? 247 GLN D CA 1 +ATOM 11860 C CA B GLN C 1 227 ? 45.069 42.243 146.931 0.50 21.52 ? 247 GLN D CA 1 +ATOM 11861 C C . GLN C 1 227 ? 46.456 42.791 147.206 1.00 21.31 ? 247 GLN D C 1 +ATOM 11862 O O . GLN C 1 227 ? 47.188 43.165 146.280 1.00 21.04 ? 247 GLN D O 1 +ATOM 11863 C CB A GLN C 1 227 ? 45.166 40.872 146.144 0.50 21.64 ? 247 GLN D CB 1 +ATOM 11864 C CB B GLN C 1 227 ? 45.172 40.856 146.299 0.50 21.81 ? 247 GLN D CB 1 +ATOM 11865 C CG A GLN C 1 227 ? 43.805 40.156 145.987 0.50 22.09 ? 247 GLN D CG 1 +ATOM 11866 C CG B GLN C 1 227 ? 45.933 39.864 147.175 0.50 22.74 ? 247 GLN D CG 1 +ATOM 11867 C CD A GLN C 1 227 ? 43.669 39.298 144.728 0.50 22.83 ? 247 GLN D CD 1 +ATOM 11868 C CD B GLN C 1 227 ? 45.989 38.474 146.593 0.50 24.58 ? 247 GLN D CD 1 +ATOM 11869 O OE1 A GLN C 1 227 ? 44.458 39.397 143.787 0.50 22.76 ? 247 GLN D OE1 1 +ATOM 11870 O OE1 B GLN C 1 227 ? 45.544 38.240 145.472 0.50 26.24 ? 247 GLN D OE1 1 +ATOM 11871 N NE2 A GLN C 1 227 ? 42.632 38.464 144.705 0.50 23.74 ? 247 GLN D NE2 1 +ATOM 11872 N NE2 B GLN C 1 227 ? 46.551 37.537 147.352 0.50 25.67 ? 247 GLN D NE2 1 +ATOM 11873 N N . ILE C 1 228 ? 46.800 42.861 148.492 1.00 20.45 ? 248 ILE D N 1 +ATOM 11874 C CA . ILE C 1 228 ? 48.023 43.507 148.934 1.00 19.80 ? 248 ILE D CA 1 +ATOM 11875 C C . ILE C 1 228 ? 48.893 42.538 149.725 1.00 19.41 ? 248 ILE D C 1 +ATOM 11876 O O . ILE C 1 228 ? 48.401 41.752 150.533 1.00 19.10 ? 248 ILE D O 1 +ATOM 11877 C CB . ILE C 1 228 ? 47.703 44.757 149.782 1.00 19.72 ? 248 ILE D CB 1 +ATOM 11878 C CG1 . ILE C 1 228 ? 46.845 45.746 148.977 1.00 19.33 ? 248 ILE D CG1 1 +ATOM 11879 C CG2 . ILE C 1 228 ? 48.994 45.446 150.221 1.00 19.86 ? 248 ILE D CG2 1 +ATOM 11880 C CD1 . ILE C 1 228 ? 46.164 46.802 149.813 1.00 19.88 ? 248 ILE D CD1 1 +ATOM 11881 N N . SER C 1 229 ? 50.193 42.593 149.476 1.00 18.83 ? 249 SER D N 1 +ATOM 11882 C CA . SER C 1 229 ? 51.145 41.724 150.129 1.00 19.08 ? 249 SER D CA 1 +ATOM 11883 C C . SER C 1 229 ? 52.140 42.573 150.903 1.00 18.94 ? 249 SER D C 1 +ATOM 11884 O O . SER C 1 229 ? 52.704 43.523 150.363 1.00 18.37 ? 249 SER D O 1 +ATOM 11885 C CB . SER C 1 229 ? 51.889 40.891 149.096 1.00 18.94 ? 249 SER D CB 1 +ATOM 11886 O OG . SER C 1 229 ? 53.052 40.326 149.656 1.00 20.24 ? 249 SER D OG 1 +ATOM 11887 N N . VAL C 1 230 ? 52.357 42.199 152.161 1.00 19.05 ? 250 VAL D N 1 +ATOM 11888 C CA . VAL C 1 230 ? 53.249 42.905 153.061 1.00 18.99 ? 250 VAL D CA 1 +ATOM 11889 C C . VAL C 1 230 ? 54.381 41.987 153.490 1.00 19.64 ? 250 VAL D C 1 +ATOM 11890 O O . VAL C 1 230 ? 54.154 40.806 153.767 1.00 19.43 ? 250 VAL D O 1 +ATOM 11891 C CB . VAL C 1 230 ? 52.485 43.390 154.299 1.00 18.97 ? 250 VAL D CB 1 +ATOM 11892 C CG1 . VAL C 1 230 ? 53.448 44.031 155.320 1.00 18.59 ? 250 VAL D CG1 1 +ATOM 11893 C CG2 . VAL C 1 230 ? 51.389 44.360 153.880 1.00 18.95 ? 250 VAL D CG2 1 +ATOM 11894 N N . LYS C 1 231 ? 55.598 42.527 153.500 1.00 19.56 ? 251 LYS D N 1 +ATOM 11895 C CA . LYS C 1 231 ? 56.781 41.808 153.946 1.00 20.53 ? 251 LYS D CA 1 +ATOM 11896 C C . LYS C 1 231 ? 57.344 42.493 155.183 1.00 20.82 ? 251 LYS D C 1 +ATOM 11897 O O . LYS C 1 231 ? 57.151 43.682 155.369 1.00 19.87 ? 251 LYS D O 1 +ATOM 11898 C CB . LYS C 1 231 ? 57.834 41.769 152.843 1.00 20.61 ? 251 LYS D CB 1 +ATOM 11899 C CG . LYS C 1 231 ? 57.645 40.642 151.821 1.00 22.01 ? 251 LYS D CG 1 +ATOM 11900 C CD . LYS C 1 231 ? 58.896 40.442 150.974 1.00 24.22 ? 251 LYS D CD 1 +ATOM 11901 C CE . LYS C 1 231 ? 60.059 39.871 151.795 1.00 26.09 ? 251 LYS D CE 1 +ATOM 11902 N NZ . LYS C 1 231 ? 61.232 39.476 150.954 1.00 28.08 ? 251 LYS D NZ 1 +ATOM 11903 N N . GLY C 1 232 ? 58.038 41.722 156.020 1.00 21.74 ? 252 GLY D N 1 +ATOM 11904 C CA . GLY C 1 232 ? 58.535 42.195 157.312 1.00 22.81 ? 252 GLY D CA 1 +ATOM 11905 C C . GLY C 1 232 ? 57.667 41.668 158.444 1.00 23.78 ? 252 GLY D C 1 +ATOM 11906 O O . GLY C 1 232 ? 57.448 40.468 158.551 1.00 24.50 ? 252 GLY D O 1 +ATOM 11907 N N . SER C 1 233 ? 57.150 42.568 159.277 1.00 25.21 ? 253 SER D N 1 +ATOM 11908 C CA . SER C 1 233 ? 56.295 42.191 160.410 1.00 25.63 ? 253 SER D CA 1 +ATOM 11909 C C . SER C 1 233 ? 54.927 41.688 159.942 1.00 26.25 ? 253 SER D C 1 +ATOM 11910 O O . SER C 1 233 ? 54.354 42.248 159.007 1.00 26.39 ? 253 SER D O 1 +ATOM 11911 C CB . SER C 1 233 ? 56.130 43.395 161.352 1.00 25.94 ? 253 SER D CB 1 +ATOM 11912 O OG . SER C 1 233 ? 55.143 43.173 162.351 1.00 26.03 ? 253 SER D OG 1 +ATOM 11913 N N . ASN C 1 234 ? 54.412 40.633 160.588 1.00 26.70 ? 254 ASN D N 1 +ATOM 11914 C CA . ASN C 1 234 ? 53.030 40.190 160.352 1.00 26.86 ? 254 ASN D CA 1 +ATOM 11915 C C . ASN C 1 234 ? 52.010 40.782 161.339 1.00 26.75 ? 254 ASN D C 1 +ATOM 11916 O O . ASN C 1 234 ? 50.889 40.279 161.448 1.00 26.95 ? 254 ASN D O 1 +ATOM 11917 C CB . ASN C 1 234 ? 52.914 38.652 160.270 1.00 27.36 ? 254 ASN D CB 1 +ATOM 11918 C CG . ASN C 1 234 ? 53.375 37.937 161.536 1.00 28.02 ? 254 ASN D CG 1 +ATOM 11919 O OD1 . ASN C 1 234 ? 53.540 38.541 162.597 1.00 29.34 ? 254 ASN D OD1 1 +ATOM 11920 N ND2 . ASN C 1 234 ? 53.587 36.628 161.418 1.00 29.66 ? 254 ASN D ND2 1 +ATOM 11921 N N . LEU C 1 235 ? 52.395 41.856 162.031 1.00 26.41 ? 255 LEU D N 1 +ATOM 11922 C CA . LEU C 1 235 ? 51.471 42.641 162.854 1.00 26.03 ? 255 LEU D CA 1 +ATOM 11923 C C . LEU C 1 235 ? 51.291 44.023 162.238 1.00 25.24 ? 255 LEU D C 1 +ATOM 11924 O O . LEU C 1 235 ? 52.130 44.907 162.432 1.00 25.23 ? 255 LEU D O 1 +ATOM 11925 C CB . LEU C 1 235 ? 52.000 42.768 164.290 1.00 26.38 ? 255 LEU D CB 1 +ATOM 11926 C CG . LEU C 1 235 ? 51.186 43.619 165.280 1.00 26.48 ? 255 LEU D CG 1 +ATOM 11927 C CD1 . LEU C 1 235 ? 49.683 43.338 165.201 1.00 27.38 ? 255 LEU D CD1 1 +ATOM 11928 C CD2 . LEU C 1 235 ? 51.691 43.407 166.706 1.00 26.42 ? 255 LEU D CD2 1 +ATOM 11929 N N . PHE C 1 236 ? 50.194 44.205 161.500 1.00 24.13 ? 256 PHE D N 1 +ATOM 11930 C CA . PHE C 1 236 ? 49.938 45.460 160.785 1.00 23.30 ? 256 PHE D CA 1 +ATOM 11931 C C . PHE C 1 236 ? 48.465 45.650 160.436 1.00 23.06 ? 256 PHE D C 1 +ATOM 11932 O O . PHE C 1 236 ? 47.665 44.728 160.559 1.00 23.12 ? 256 PHE D O 1 +ATOM 11933 C CB . PHE C 1 236 ? 50.760 45.501 159.489 1.00 22.96 ? 256 PHE D CB 1 +ATOM 11934 C CG . PHE C 1 236 ? 50.441 44.382 158.537 1.00 22.39 ? 256 PHE D CG 1 +ATOM 11935 C CD1 . PHE C 1 236 ? 51.198 43.226 158.527 1.00 22.10 ? 256 PHE D CD1 1 +ATOM 11936 C CD2 . PHE C 1 236 ? 49.369 44.482 157.660 1.00 21.88 ? 256 PHE D CD2 1 +ATOM 11937 C CE1 . PHE C 1 236 ? 50.899 42.185 157.654 1.00 22.16 ? 256 PHE D CE1 1 +ATOM 11938 C CE2 . PHE C 1 236 ? 49.065 43.445 156.790 1.00 22.05 ? 256 PHE D CE2 1 +ATOM 11939 C CZ . PHE C 1 236 ? 49.834 42.299 156.788 1.00 22.04 ? 256 PHE D CZ 1 +ATOM 11940 N N . LYS C 1 237 ? 48.125 46.855 159.990 1.00 22.86 ? 257 LYS D N 1 +ATOM 11941 C CA . LYS C 1 237 ? 46.816 47.130 159.396 1.00 22.98 ? 257 LYS D CA 1 +ATOM 11942 C C . LYS C 1 237 ? 46.991 47.858 158.062 1.00 22.49 ? 257 LYS D C 1 +ATOM 11943 O O . LYS C 1 237 ? 47.967 48.592 157.868 1.00 22.49 ? 257 LYS D O 1 +ATOM 11944 C CB . LYS C 1 237 ? 45.928 47.948 160.343 1.00 22.91 ? 257 LYS D CB 1 +ATOM 11945 C CG . LYS C 1 237 ? 46.433 49.352 160.663 1.00 23.77 ? 257 LYS D CG 1 +ATOM 11946 C CD . LYS C 1 237 ? 45.332 50.274 161.184 1.00 24.42 ? 257 LYS D CD 1 +ATOM 11947 C CE . LYS C 1 237 ? 45.924 51.604 161.664 1.00 25.41 ? 257 LYS D CE 1 +ATOM 11948 N NZ . LYS C 1 237 ? 44.906 52.690 161.887 1.00 26.49 ? 257 LYS D NZ 1 +ATOM 11949 N N . LEU C 1 238 ? 46.044 47.644 157.151 1.00 21.90 ? 258 LEU D N 1 +ATOM 11950 C CA . LEU C 1 238 ? 46.033 48.311 155.854 1.00 21.71 ? 258 LEU D CA 1 +ATOM 11951 C C . LEU C 1 238 ? 44.763 49.128 155.707 1.00 22.20 ? 258 LEU D C 1 +ATOM 11952 O O . LEU C 1 238 ? 43.664 48.637 155.993 1.00 22.26 ? 258 LEU D O 1 +ATOM 11953 C CB . LEU C 1 238 ? 46.110 47.291 154.713 1.00 21.41 ? 258 LEU D CB 1 +ATOM 11954 C CG . LEU C 1 238 ? 47.478 46.662 154.465 1.00 20.56 ? 258 LEU D CG 1 +ATOM 11955 C CD1 . LEU C 1 238 ? 47.346 45.354 153.704 1.00 18.73 ? 258 LEU D CD1 1 +ATOM 11956 C CD2 . LEU C 1 238 ? 48.372 47.647 153.706 1.00 19.15 ? 258 LEU D CD2 1 +ATOM 11957 N N . GLU C 1 239 ? 44.929 50.372 155.272 1.00 22.32 ? 259 GLU D N 1 +ATOM 11958 C CA . GLU C 1 239 ? 43.823 51.220 154.847 1.00 22.93 ? 259 GLU D CA 1 +ATOM 11959 C C . GLU C 1 239 ? 44.026 51.496 153.368 1.00 22.97 ? 259 GLU D C 1 +ATOM 11960 O O . GLU C 1 239 ? 45.141 51.822 152.940 1.00 21.90 ? 259 GLU D O 1 +ATOM 11961 C CB . GLU C 1 239 ? 43.816 52.544 155.608 1.00 23.27 ? 259 GLU D CB 1 +ATOM 11962 C CG . GLU C 1 239 ? 43.733 52.416 157.121 1.00 24.87 ? 259 GLU D CG 1 +ATOM 11963 C CD . GLU C 1 239 ? 44.182 53.677 157.830 1.00 27.61 ? 259 GLU D CD 1 +ATOM 11964 O OE1 . GLU C 1 239 ? 43.968 54.781 157.275 1.00 28.74 ? 259 GLU D OE1 1 +ATOM 11965 O OE2 . GLU C 1 239 ? 44.758 53.566 158.935 1.00 28.50 ? 259 GLU D OE2 1 +ATOM 11966 N N . VAL C 1 240 ? 42.960 51.355 152.585 1.00 22.95 ? 260 VAL D N 1 +ATOM 11967 C CA . VAL C 1 240 ? 43.026 51.623 151.153 1.00 23.15 ? 260 VAL D CA 1 +ATOM 11968 C C . VAL C 1 240 ? 41.951 52.623 150.732 1.00 23.48 ? 260 VAL D C 1 +ATOM 11969 O O . VAL C 1 240 ? 40.777 52.462 151.088 1.00 22.90 ? 260 VAL D O 1 +ATOM 11970 C CB . VAL C 1 240 ? 42.883 50.330 150.331 1.00 23.39 ? 260 VAL D CB 1 +ATOM 11971 C CG1 . VAL C 1 240 ? 43.014 50.635 148.861 1.00 23.50 ? 260 VAL D CG1 1 +ATOM 11972 C CG2 . VAL C 1 240 ? 43.934 49.321 150.753 1.00 23.38 ? 260 VAL D CG2 1 +ATOM 11973 N N . ARG C 1 241 ? 42.367 53.657 149.994 1.00 23.66 ? 261 ARG D N 1 +ATOM 11974 C CA . ARG C 1 241 ? 41.454 54.644 149.409 1.00 24.29 ? 261 ARG D CA 1 +ATOM 11975 C C . ARG C 1 241 ? 41.566 54.695 147.893 1.00 24.28 ? 261 ARG D C 1 +ATOM 11976 O O . ARG C 1 241 ? 42.654 54.551 147.341 1.00 23.58 ? 261 ARG D O 1 +ATOM 11977 C CB . ARG C 1 241 ? 41.770 56.048 149.906 1.00 24.60 ? 261 ARG D CB 1 +ATOM 11978 C CG . ARG C 1 241 ? 41.718 56.232 151.385 1.00 26.81 ? 261 ARG D CG 1 +ATOM 11979 C CD . ARG C 1 241 ? 41.443 57.693 151.738 1.00 29.52 ? 261 ARG D CD 1 +ATOM 11980 N NE . ARG C 1 241 ? 42.419 58.193 152.703 1.00 31.43 ? 261 ARG D NE 1 +ATOM 11981 C CZ . ARG C 1 241 ? 43.350 59.120 152.463 1.00 32.42 ? 261 ARG D CZ 1 +ATOM 11982 N NH1 . ARG C 1 241 ? 43.466 59.707 151.273 1.00 32.43 ? 261 ARG D NH1 1 +ATOM 11983 N NH2 . ARG C 1 241 ? 44.182 59.468 153.441 1.00 33.43 ? 261 ARG D NH2 1 +ATOM 11984 N N . LEU C 1 242 ? 40.440 54.936 147.228 1.00 24.17 ? 262 LEU D N 1 +ATOM 11985 C CA . LEU C 1 242 ? 40.435 55.170 145.790 1.00 24.06 ? 262 LEU D CA 1 +ATOM 11986 C C . LEU C 1 242 ? 40.069 56.629 145.568 1.00 24.56 ? 262 LEU D C 1 +ATOM 11987 O O . LEU C 1 242 ? 38.993 57.078 145.981 1.00 23.67 ? 262 LEU D O 1 +ATOM 11988 C CB . LEU C 1 242 ? 39.453 54.232 145.087 1.00 23.95 ? 262 LEU D CB 1 +ATOM 11989 C CG . LEU C 1 242 ? 39.547 54.163 143.559 1.00 24.28 ? 262 LEU D CG 1 +ATOM 11990 C CD1 . LEU C 1 242 ? 40.811 53.434 143.115 1.00 23.12 ? 262 LEU D CD1 1 +ATOM 11991 C CD2 . LEU C 1 242 ? 38.306 53.469 142.979 1.00 23.76 ? 262 LEU D CD2 1 +ATOM 11992 N N . LEU C 1 243 ? 40.983 57.365 144.939 1.00 24.83 ? 263 LEU D N 1 +ATOM 11993 C CA . LEU C 1 243 ? 40.819 58.788 144.679 1.00 25.68 ? 263 LEU D CA 1 +ATOM 11994 C C . LEU C 1 243 ? 40.452 58.993 143.214 1.00 26.15 ? 263 LEU D C 1 +ATOM 11995 O O . LEU C 1 243 ? 40.988 58.304 142.340 1.00 25.78 ? 263 LEU D O 1 +ATOM 11996 C CB . LEU C 1 243 ? 42.122 59.531 144.976 1.00 25.83 ? 263 LEU D CB 1 +ATOM 11997 C CG . LEU C 1 243 ? 42.796 59.244 146.323 1.00 26.72 ? 263 LEU D CG 1 +ATOM 11998 C CD1 . LEU C 1 243 ? 44.285 59.541 146.267 1.00 27.09 ? 263 LEU D CD1 1 +ATOM 11999 C CD2 . LEU C 1 243 ? 42.126 60.043 147.434 1.00 27.86 ? 263 LEU D CD2 1 +ATOM 12000 N N . ASP C 1 244 ? 39.552 59.939 142.948 1.00 26.74 ? 264 ASP D N 1 +ATOM 12001 C CA . ASP C 1 244 ? 39.185 60.300 141.572 1.00 27.54 ? 264 ASP D CA 1 +ATOM 12002 C C . ASP C 1 244 ? 40.269 61.177 140.941 1.00 28.00 ? 264 ASP D C 1 +ATOM 12003 O O . ASP C 1 244 ? 41.300 61.427 141.566 1.00 28.22 ? 264 ASP D O 1 +ATOM 12004 C CB . ASP C 1 244 ? 37.792 60.966 141.523 1.00 27.48 ? 264 ASP D CB 1 +ATOM 12005 C CG . ASP C 1 244 ? 37.773 62.390 142.081 1.00 27.87 ? 264 ASP D CG 1 +ATOM 12006 O OD1 . ASP C 1 244 ? 38.812 62.901 142.544 1.00 27.85 ? 264 ASP D OD1 1 +ATOM 12007 O OD2 . ASP C 1 244 ? 36.683 63.009 142.063 1.00 29.25 ? 264 ASP D OD2 1 +ATOM 12008 N N . ALA C 1 245 ? 40.038 61.640 139.714 1.00 28.87 ? 265 ALA D N 1 +ATOM 12009 C CA . ALA C 1 245 ? 41.037 62.417 138.971 1.00 29.56 ? 265 ALA D CA 1 +ATOM 12010 C C . ALA C 1 245 ? 41.504 63.679 139.702 1.00 30.37 ? 265 ALA D C 1 +ATOM 12011 O O . ALA C 1 245 ? 42.670 64.064 139.588 1.00 30.60 ? 265 ALA D O 1 +ATOM 12012 C CB . ALA C 1 245 ? 40.510 62.769 137.589 1.00 29.68 ? 265 ALA D CB 1 +ATOM 12013 N N . GLU C 1 246 ? 40.602 64.319 140.446 1.00 31.13 ? 266 GLU D N 1 +ATOM 12014 C CA . GLU C 1 246 ? 40.953 65.476 141.273 1.00 31.86 ? 266 GLU D CA 1 +ATOM 12015 C C . GLU C 1 246 ? 41.273 65.082 142.725 1.00 31.93 ? 266 GLU D C 1 +ATOM 12016 O O . GLU C 1 246 ? 41.241 65.925 143.622 1.00 31.98 ? 266 GLU D O 1 +ATOM 12017 C CB . GLU C 1 246 ? 39.834 66.520 141.237 1.00 31.85 ? 266 GLU D CB 1 +ATOM 12018 C CG . GLU C 1 246 ? 39.648 67.187 139.874 1.00 32.96 ? 266 GLU D CG 1 +ATOM 12019 C CD . GLU C 1 246 ? 38.678 68.364 139.911 1.00 33.26 ? 266 GLU D CD 1 +ATOM 12020 O OE1 . GLU C 1 246 ? 38.763 69.194 140.846 1.00 35.37 ? 266 GLU D OE1 1 +ATOM 12021 O OE2 . GLU C 1 246 ? 37.835 68.462 138.994 1.00 35.60 ? 266 GLU D OE2 1 +ATOM 12022 N N . ASN C 1 247 ? 41.597 63.804 142.935 1.00 31.94 ? 267 ASN D N 1 +ATOM 12023 C CA . ASN C 1 247 ? 42.046 63.265 144.228 1.00 32.09 ? 267 ASN D CA 1 +ATOM 12024 C C . ASN C 1 247 ? 41.029 63.364 145.370 1.00 31.89 ? 267 ASN D C 1 +ATOM 12025 O O . ASN C 1 247 ? 41.395 63.542 146.532 1.00 31.89 ? 267 ASN D O 1 +ATOM 12026 C CB . ASN C 1 247 ? 43.405 63.859 144.633 1.00 32.16 ? 267 ASN D CB 1 +ATOM 12027 C CG . ASN C 1 247 ? 44.545 63.371 143.752 1.00 33.14 ? 267 ASN D CG 1 +ATOM 12028 O OD1 . ASN C 1 247 ? 44.464 62.303 143.130 1.00 33.98 ? 267 ASN D OD1 1 +ATOM 12029 N ND2 . ASN C 1 247 ? 45.624 64.147 143.706 1.00 34.15 ? 267 ASN D ND2 1 +ATOM 12030 N N . LYS C 1 248 ? 39.753 63.232 145.020 1.00 31.59 ? 268 LYS D N 1 +ATOM 12031 C CA . LYS C 1 248 ? 38.677 63.102 145.997 1.00 31.46 ? 268 LYS D CA 1 +ATOM 12032 C C . LYS C 1 248 ? 38.469 61.620 146.271 1.00 30.64 ? 268 LYS D C 1 +ATOM 12033 O O . LYS C 1 248 ? 38.454 60.810 145.343 1.00 30.38 ? 268 LYS D O 1 +ATOM 12034 C CB . LYS C 1 248 ? 37.384 63.719 145.455 1.00 31.55 ? 268 LYS D CB 1 +ATOM 12035 C CG . LYS C 1 248 ? 36.122 63.461 146.288 1.00 32.20 ? 268 LYS D CG 1 +ATOM 12036 C CD . LYS C 1 248 ? 34.840 63.674 145.465 1.00 32.58 ? 268 LYS D CD 1 +ATOM 12037 C CE . LYS C 1 248 ? 34.406 65.139 145.417 1.00 33.85 ? 268 LYS D CE 1 +ATOM 12038 N NZ . LYS C 1 248 ? 35.469 66.062 144.927 1.00 34.98 ? 268 LYS D NZ 1 +ATOM 12039 N N . VAL C 1 249 ? 38.294 61.276 147.544 1.00 29.74 ? 269 VAL D N 1 +ATOM 12040 C CA . VAL C 1 249 ? 38.034 59.898 147.938 1.00 29.18 ? 269 VAL D CA 1 +ATOM 12041 C C . VAL C 1 249 ? 36.622 59.504 147.505 1.00 28.80 ? 269 VAL D C 1 +ATOM 12042 O O . VAL C 1 249 ? 35.642 60.123 147.931 1.00 28.71 ? 269 VAL D O 1 +ATOM 12043 C CB . VAL C 1 249 ? 38.175 59.713 149.459 1.00 29.31 ? 269 VAL D CB 1 +ATOM 12044 C CG1 . VAL C 1 249 ? 37.839 58.280 149.854 1.00 28.67 ? 269 VAL D CG1 1 +ATOM 12045 C CG2 . VAL C 1 249 ? 39.584 60.108 149.920 1.00 28.83 ? 269 VAL D CG2 1 +ATOM 12046 N N . VAL C 1 250 ? 36.527 58.488 146.650 1.00 28.06 ? 270 VAL D N 1 +ATOM 12047 C CA . VAL C 1 250 ? 35.237 57.986 146.167 1.00 27.61 ? 270 VAL D CA 1 +ATOM 12048 C C . VAL C 1 250 ? 34.891 56.613 146.745 1.00 27.23 ? 270 VAL D C 1 +ATOM 12049 O O . VAL C 1 250 ? 33.789 56.107 146.531 1.00 26.75 ? 270 VAL D O 1 +ATOM 12050 C CB . VAL C 1 250 ? 35.214 57.876 144.627 1.00 27.72 ? 270 VAL D CB 1 +ATOM 12051 C CG1 . VAL C 1 250 ? 35.409 59.238 143.992 1.00 28.06 ? 270 VAL D CG1 1 +ATOM 12052 C CG2 . VAL C 1 250 ? 36.273 56.868 144.134 1.00 27.70 ? 270 VAL D CG2 1 +ATOM 12053 N N . ALA C 1 251 ? 35.836 56.008 147.462 1.00 26.66 ? 271 ALA D N 1 +ATOM 12054 C CA . ALA C 1 251 ? 35.664 54.662 147.990 1.00 26.34 ? 271 ALA D CA 1 +ATOM 12055 C C . ALA C 1 251 ? 36.847 54.323 148.882 1.00 26.22 ? 271 ALA D C 1 +ATOM 12056 O O . ALA C 1 251 ? 37.939 54.874 148.708 1.00 26.26 ? 271 ALA D O 1 +ATOM 12057 C CB . ALA C 1 251 ? 35.552 53.653 146.856 1.00 26.35 ? 271 ALA D CB 1 +ATOM 12058 N N . ASN C 1 252 ? 36.627 53.432 149.846 1.00 25.85 ? 272 ASN D N 1 +ATOM 12059 C CA . ASN C 1 252 ? 37.707 52.993 150.727 1.00 25.78 ? 272 ASN D CA 1 +ATOM 12060 C C . ASN C 1 252 ? 37.449 51.636 151.378 1.00 25.17 ? 272 ASN D C 1 +ATOM 12061 O O . ASN C 1 252 ? 36.310 51.173 151.454 1.00 25.30 ? 272 ASN D O 1 +ATOM 12062 C CB . ASN C 1 252 ? 38.009 54.057 151.784 1.00 25.89 ? 272 ASN D CB 1 +ATOM 12063 C CG . ASN C 1 252 ? 36.912 54.181 152.814 1.00 27.13 ? 272 ASN D CG 1 +ATOM 12064 O OD1 . ASN C 1 252 ? 35.828 54.690 152.526 1.00 27.56 ? 272 ASN D OD1 1 +ATOM 12065 N ND2 . ASN C 1 252 ? 37.185 53.682 154.029 1.00 29.76 ? 272 ASN D ND2 1 +ATOM 12066 N N . GLY C 1 253 ? 38.527 51.003 151.828 1.00 24.64 ? 273 GLY D N 1 +ATOM 12067 C CA . GLY C 1 253 ? 38.470 49.690 152.461 1.00 24.33 ? 273 GLY D CA 1 +ATOM 12068 C C . GLY C 1 253 ? 39.677 49.430 153.346 1.00 24.01 ? 273 GLY D C 1 +ATOM 12069 O O . GLY C 1 253 ? 40.422 50.358 153.675 1.00 23.86 ? 273 GLY D O 1 +ATOM 12070 N N . THR C 1 254 ? 39.856 48.168 153.738 1.00 23.79 ? 274 THR D N 1 +ATOM 12071 C CA . THR C 1 254 ? 40.937 47.757 154.643 1.00 23.60 ? 274 THR D CA 1 +ATOM 12072 C C . THR C 1 254 ? 41.383 46.326 154.356 1.00 23.39 ? 274 THR D C 1 +ATOM 12073 O O . THR C 1 254 ? 40.781 45.628 153.532 1.00 23.39 ? 274 THR D O 1 +ATOM 12074 C CB . THR C 1 254 ? 40.499 47.806 156.135 1.00 23.70 ? 274 THR D CB 1 +ATOM 12075 O OG1 . THR C 1 254 ? 39.478 46.827 156.376 1.00 23.99 ? 274 THR D OG1 1 +ATOM 12076 C CG2 . THR C 1 254 ? 39.977 49.186 156.520 1.00 23.91 ? 274 THR D CG2 1 +ATOM 12077 N N . GLY C 1 255 ? 42.424 45.885 155.057 1.00 23.19 ? 275 GLY D N 1 +ATOM 12078 C CA . GLY C 1 255 ? 42.877 44.498 154.974 1.00 23.44 ? 275 GLY D CA 1 +ATOM 12079 C C . GLY C 1 255 ? 43.731 44.223 153.754 1.00 23.58 ? 275 GLY D C 1 +ATOM 12080 O O . GLY C 1 255 ? 43.905 45.088 152.895 1.00 23.64 ? 275 GLY D O 1 +ATOM 12081 N N . THR C 1 256 ? 44.263 43.006 153.684 1.00 23.97 ? 276 THR D N 1 +ATOM 12082 C CA . THR C 1 256 ? 45.127 42.593 152.581 1.00 24.28 ? 276 THR D CA 1 +ATOM 12083 C C . THR C 1 256 ? 44.356 42.373 151.283 1.00 24.50 ? 276 THR D C 1 +ATOM 12084 O O . THR C 1 256 ? 44.955 42.257 150.223 1.00 24.32 ? 276 THR D O 1 +ATOM 12085 C CB . THR C 1 256 ? 45.893 41.299 152.921 1.00 24.41 ? 276 THR D CB 1 +ATOM 12086 O OG1 . THR C 1 256 ? 44.970 40.306 153.382 1.00 24.95 ? 276 THR D OG1 1 +ATOM 12087 C CG2 . THR C 1 256 ? 46.940 41.560 153.990 1.00 24.86 ? 276 THR D CG2 1 +ATOM 12088 N N . GLN C 1 257 ? 43.030 42.295 151.354 1.00 25.33 ? 277 GLN D N 1 +ATOM 12089 C CA . GLN C 1 257 ? 42.245 42.160 150.135 1.00 26.11 ? 277 GLN D CA 1 +ATOM 12090 C C . GLN C 1 257 ? 40.815 42.649 150.305 1.00 26.42 ? 277 GLN D C 1 +ATOM 12091 O O . GLN C 1 257 ? 40.276 42.685 151.419 1.00 26.12 ? 277 GLN D O 1 +ATOM 12092 C CB . GLN C 1 257 ? 42.291 40.715 149.611 1.00 26.47 ? 277 GLN D CB 1 +ATOM 12093 C CG . GLN C 1 257 ? 41.184 39.787 150.073 1.00 27.85 ? 277 GLN D CG 1 +ATOM 12094 C CD . GLN C 1 257 ? 41.032 38.596 149.146 1.00 30.64 ? 277 GLN D CD 1 +ATOM 12095 O OE1 . GLN C 1 257 ? 42.022 37.988 148.728 1.00 31.74 ? 277 GLN D OE1 1 +ATOM 12096 N NE2 . GLN C 1 257 ? 39.786 38.257 148.815 1.00 31.42 ? 277 GLN D NE2 1 +ATOM 12097 N N . GLY C 1 258 ? 40.207 43.029 149.186 1.00 26.82 ? 278 GLY D N 1 +ATOM 12098 C CA . GLY C 1 258 ? 38.850 43.532 149.208 1.00 27.15 ? 278 GLY D CA 1 +ATOM 12099 C C . GLY C 1 258 ? 38.340 43.868 147.828 1.00 27.45 ? 278 GLY D C 1 +ATOM 12100 O O . GLY C 1 258 ? 38.994 43.582 146.820 1.00 27.41 ? 278 GLY D O 1 +ATOM 12101 N N . GLN C 1 259 ? 37.151 44.463 147.803 1.00 27.75 ? 279 GLN D N 1 +ATOM 12102 C CA . GLN C 1 259 ? 36.541 44.962 146.585 1.00 27.84 ? 279 GLN D CA 1 +ATOM 12103 C C . GLN C 1 259 ? 35.933 46.322 146.886 1.00 27.86 ? 279 GLN D C 1 +ATOM 12104 O O . GLN C 1 259 ? 35.068 46.439 147.753 1.00 28.21 ? 279 GLN D O 1 +ATOM 12105 C CB . GLN C 1 259 ? 35.469 43.997 146.080 1.00 27.91 ? 279 GLN D CB 1 +ATOM 12106 C CG . GLN C 1 259 ? 34.789 44.463 144.798 1.00 28.22 ? 279 GLN D CG 1 +ATOM 12107 C CD . GLN C 1 259 ? 33.910 43.399 144.172 1.00 29.60 ? 279 GLN D CD 1 +ATOM 12108 O OE1 . GLN C 1 259 ? 32.715 43.614 143.968 1.00 29.21 ? 279 GLN D OE1 1 +ATOM 12109 N NE2 . GLN C 1 259 ? 34.494 42.237 143.870 1.00 29.24 ? 279 GLN D NE2 1 +ATOM 12110 N N . LEU C 1 260 ? 36.400 47.346 146.181 1.00 27.66 ? 280 LEU D N 1 +ATOM 12111 C CA . LEU C 1 260 ? 35.850 48.688 146.303 1.00 27.57 ? 280 LEU D CA 1 +ATOM 12112 C C . LEU C 1 260 ? 34.760 48.893 145.258 1.00 27.65 ? 280 LEU D C 1 +ATOM 12113 O O . LEU C 1 260 ? 34.876 48.399 144.135 1.00 27.35 ? 280 LEU D O 1 +ATOM 12114 C CB . LEU C 1 260 ? 36.947 49.729 146.103 1.00 27.57 ? 280 LEU D CB 1 +ATOM 12115 C CG . LEU C 1 260 ? 38.148 49.625 147.042 1.00 27.55 ? 280 LEU D CG 1 +ATOM 12116 C CD1 . LEU C 1 260 ? 39.123 50.757 146.746 1.00 27.31 ? 280 LEU D CD1 1 +ATOM 12117 C CD2 . LEU C 1 260 ? 37.709 49.650 148.500 1.00 27.69 ? 280 LEU D CD2 1 +ATOM 12118 N N . LYS C 1 261 ? 33.706 49.616 145.641 1.00 27.72 ? 281 LYS D N 1 +ATOM 12119 C CA . LYS C 1 261 ? 32.613 49.975 144.738 1.00 27.74 ? 281 LYS D CA 1 +ATOM 12120 C C . LYS C 1 261 ? 32.667 51.465 144.432 1.00 27.45 ? 281 LYS D C 1 +ATOM 12121 O O . LYS C 1 261 ? 32.734 52.294 145.348 1.00 27.69 ? 281 LYS D O 1 +ATOM 12122 C CB . LYS C 1 261 ? 31.255 49.615 145.358 1.00 27.84 ? 281 LYS D CB 1 +ATOM 12123 C CG . LYS C 1 261 ? 30.100 49.670 144.365 1.00 28.26 ? 281 LYS D CG 1 +ATOM 12124 C CD . LYS C 1 261 ? 28.766 49.329 145.011 1.00 28.49 ? 281 LYS D CD 1 +ATOM 12125 C CE . LYS C 1 261 ? 27.649 49.280 143.977 1.00 29.14 ? 281 LYS D CE 1 +ATOM 12126 N NZ . LYS C 1 261 ? 26.391 48.706 144.546 1.00 29.78 ? 281 LYS D NZ 1 +ATOM 12127 N N . VAL C 1 262 ? 32.645 51.802 143.142 1.00 27.03 ? 282 VAL D N 1 +ATOM 12128 C CA . VAL C 1 262 ? 32.718 53.191 142.683 1.00 26.61 ? 282 VAL D CA 1 +ATOM 12129 C C . VAL C 1 262 ? 31.409 53.566 141.997 1.00 26.47 ? 282 VAL D C 1 +ATOM 12130 O O . VAL C 1 262 ? 31.173 53.154 140.862 1.00 26.41 ? 282 VAL D O 1 +ATOM 12131 C CB . VAL C 1 262 ? 33.877 53.403 141.684 1.00 26.40 ? 282 VAL D CB 1 +ATOM 12132 C CG1 . VAL C 1 262 ? 34.011 54.884 141.341 1.00 26.34 ? 282 VAL D CG1 1 +ATOM 12133 C CG2 . VAL C 1 262 ? 35.180 52.856 142.259 1.00 26.76 ? 282 VAL D CG2 1 +ATOM 12134 N N . PRO C 1 263 ? 30.535 54.324 142.694 1.00 26.25 ? 283 PRO D N 1 +ATOM 12135 C CA . PRO C 1 263 ? 29.265 54.735 142.086 1.00 25.76 ? 283 PRO D CA 1 +ATOM 12136 C C . PRO C 1 263 ? 29.450 55.685 140.909 1.00 24.85 ? 283 PRO D C 1 +ATOM 12137 O O . PRO C 1 263 ? 30.286 56.585 140.976 1.00 24.76 ? 283 PRO D O 1 +ATOM 12138 C CB . PRO C 1 263 ? 28.537 55.469 143.230 1.00 25.87 ? 283 PRO D CB 1 +ATOM 12139 C CG . PRO C 1 263 ? 29.259 55.111 144.469 1.00 26.33 ? 283 PRO D CG 1 +ATOM 12140 C CD . PRO C 1 263 ? 30.664 54.814 144.078 1.00 26.34 ? 283 PRO D CD 1 +ATOM 12141 N N . GLY C 1 264 ? 28.654 55.501 139.858 1.00 23.78 ? 284 GLY D N 1 +ATOM 12142 C CA . GLY C 1 264 ? 28.720 56.365 138.685 1.00 23.04 ? 284 GLY D CA 1 +ATOM 12143 C C . GLY C 1 264 ? 30.144 56.479 138.179 1.00 22.21 ? 284 GLY D C 1 +ATOM 12144 O O . GLY C 1 264 ? 30.648 57.582 137.970 1.00 21.77 ? 284 GLY D O 1 +ATOM 12145 N N . VAL C 1 265 ? 30.783 55.326 138.002 1.00 21.35 ? 285 VAL D N 1 +ATOM 12146 C CA . VAL C 1 265 ? 32.210 55.270 137.683 1.00 20.73 ? 285 VAL D CA 1 +ATOM 12147 C C . VAL C 1 265 ? 32.526 55.914 136.333 1.00 20.62 ? 285 VAL D C 1 +ATOM 12148 O O . VAL C 1 265 ? 31.706 55.871 135.407 1.00 20.56 ? 285 VAL D O 1 +ATOM 12149 C CB . VAL C 1 265 ? 32.728 53.808 137.702 1.00 20.77 ? 285 VAL D CB 1 +ATOM 12150 C CG1 . VAL C 1 265 ? 32.076 52.986 136.601 1.00 20.59 ? 285 VAL D CG1 1 +ATOM 12151 C CG2 . VAL C 1 265 ? 34.248 53.770 137.592 1.00 20.52 ? 285 VAL D CG2 1 +ATOM 12152 N N . SER C 1 266 ? 33.709 56.533 136.246 1.00 20.07 ? 286 SER D N 1 +ATOM 12153 C CA . SER C 1 266 ? 34.278 56.991 134.976 1.00 19.40 ? 286 SER D CA 1 +ATOM 12154 C C . SER C 1 266 ? 35.200 55.893 134.444 1.00 18.47 ? 286 SER D C 1 +ATOM 12155 O O . SER C 1 266 ? 36.273 55.650 135.012 1.00 18.27 ? 286 SER D O 1 +ATOM 12156 C CB . SER C 1 266 ? 35.073 58.280 135.166 1.00 19.91 ? 286 SER D CB 1 +ATOM 12157 O OG . SER C 1 266 ? 34.226 59.393 135.425 1.00 20.76 ? 286 SER D OG 1 +ATOM 12158 N N . LEU C 1 267 ? 34.767 55.211 133.385 1.00 17.49 ? 287 LEU D N 1 +ATOM 12159 C CA . LEU C 1 267 ? 35.535 54.101 132.819 1.00 16.80 ? 287 LEU D CA 1 +ATOM 12160 C C . LEU C 1 267 ? 36.769 54.629 132.100 1.00 15.68 ? 287 LEU D C 1 +ATOM 12161 O O . LEU C 1 267 ? 36.795 55.772 131.622 1.00 14.86 ? 287 LEU D O 1 +ATOM 12162 C CB . LEU C 1 267 ? 34.690 53.271 131.840 1.00 16.92 ? 287 LEU D CB 1 +ATOM 12163 C CG . LEU C 1 267 ? 33.936 52.029 132.358 1.00 18.15 ? 287 LEU D CG 1 +ATOM 12164 C CD1 . LEU C 1 267 ? 33.568 52.152 133.818 1.00 19.26 ? 287 LEU D CD1 1 +ATOM 12165 C CD2 . LEU C 1 267 ? 32.715 51.750 131.501 1.00 16.94 ? 287 LEU D CD2 1 +ATOM 12166 N N . TRP C 1 268 ? 37.775 53.763 132.024 1.00 14.69 ? 288 TRP D N 1 +ATOM 12167 C CA . TRP C 1 268 ? 38.995 54.006 131.255 1.00 14.13 ? 288 TRP D CA 1 +ATOM 12168 C C . TRP C 1 268 ? 38.724 53.623 129.810 1.00 13.64 ? 288 TRP D C 1 +ATOM 12169 O O . TRP C 1 268 ? 38.417 52.471 129.520 1.00 12.91 ? 288 TRP D O 1 +ATOM 12170 C CB . TRP C 1 268 ? 40.126 53.138 131.806 1.00 13.76 ? 288 TRP D CB 1 +ATOM 12171 C CG . TRP C 1 268 ? 41.494 53.481 131.303 1.00 13.83 ? 288 TRP D CG 1 +ATOM 12172 C CD1 . TRP C 1 268 ? 42.404 54.293 131.908 1.00 13.34 ? 288 TRP D CD1 1 +ATOM 12173 C CD2 . TRP C 1 268 ? 42.109 53.013 130.094 1.00 12.70 ? 288 TRP D CD2 1 +ATOM 12174 N NE1 . TRP C 1 268 ? 43.549 54.359 131.156 1.00 13.13 ? 288 TRP D NE1 1 +ATOM 12175 C CE2 . TRP C 1 268 ? 43.394 53.585 130.035 1.00 13.54 ? 288 TRP D CE2 1 +ATOM 12176 C CE3 . TRP C 1 268 ? 41.694 52.169 129.052 1.00 14.12 ? 288 TRP D CE3 1 +ATOM 12177 C CZ2 . TRP C 1 268 ? 44.272 53.336 128.979 1.00 14.01 ? 288 TRP D CZ2 1 +ATOM 12178 C CZ3 . TRP C 1 268 ? 42.565 51.931 128.004 1.00 13.95 ? 288 TRP D CZ3 1 +ATOM 12179 C CH2 . TRP C 1 268 ? 43.835 52.516 127.974 1.00 13.09 ? 288 TRP D CH2 1 +ATOM 12180 N N . TRP C 1 269 ? 38.842 54.601 128.917 1.00 13.79 ? 289 TRP D N 1 +ATOM 12181 C CA . TRP C 1 269 ? 38.567 54.418 127.501 1.00 14.05 ? 289 TRP D CA 1 +ATOM 12182 C C . TRP C 1 269 ? 39.840 54.670 126.696 1.00 13.52 ? 289 TRP D C 1 +ATOM 12183 O O . TRP C 1 269 ? 40.570 55.615 126.990 1.00 13.67 ? 289 TRP D O 1 +ATOM 12184 C CB . TRP C 1 269 ? 37.517 55.426 127.042 1.00 14.79 ? 289 TRP D CB 1 +ATOM 12185 C CG . TRP C 1 269 ? 36.136 55.146 127.537 1.00 15.86 ? 289 TRP D CG 1 +ATOM 12186 C CD1 . TRP C 1 269 ? 35.435 55.869 128.464 1.00 16.34 ? 289 TRP D CD1 1 +ATOM 12187 C CD2 . TRP C 1 269 ? 35.270 54.089 127.108 1.00 14.86 ? 289 TRP D CD2 1 +ATOM 12188 N NE1 . TRP C 1 269 ? 34.187 55.311 128.650 1.00 16.91 ? 289 TRP D NE1 1 +ATOM 12189 C CE2 . TRP C 1 269 ? 34.063 54.218 127.833 1.00 15.41 ? 289 TRP D CE2 1 +ATOM 12190 C CE3 . TRP C 1 269 ? 35.400 53.036 126.195 1.00 15.44 ? 289 TRP D CE3 1 +ATOM 12191 C CZ2 . TRP C 1 269 ? 32.995 53.333 127.671 1.00 16.21 ? 289 TRP D CZ2 1 +ATOM 12192 C CZ3 . TRP C 1 269 ? 34.323 52.153 126.028 1.00 16.17 ? 289 TRP D CZ3 1 +ATOM 12193 C CH2 . TRP C 1 269 ? 33.137 52.313 126.764 1.00 16.35 ? 289 TRP D CH2 1 +ATOM 12194 N N . PRO C 1 270 ? 40.088 53.848 125.667 1.00 12.99 ? 290 PRO D N 1 +ATOM 12195 C CA . PRO C 1 270 ? 41.187 54.168 124.754 1.00 12.85 ? 290 PRO D CA 1 +ATOM 12196 C C . PRO C 1 270 ? 41.061 55.541 124.067 1.00 12.61 ? 290 PRO D C 1 +ATOM 12197 O O . PRO C 1 270 ? 39.955 56.071 123.881 1.00 11.86 ? 290 PRO D O 1 +ATOM 12198 C CB . PRO C 1 270 ? 41.118 53.050 123.712 1.00 13.01 ? 290 PRO D CB 1 +ATOM 12199 C CG . PRO C 1 270 ? 40.420 51.909 124.388 1.00 12.59 ? 290 PRO D CG 1 +ATOM 12200 C CD . PRO C 1 270 ? 39.433 52.575 125.310 1.00 12.93 ? 290 PRO D CD 1 +ATOM 12201 N N . TYR C 1 271 ? 42.210 56.103 123.710 1.00 11.86 ? 291 TYR D N 1 +ATOM 12202 C CA . TYR C 1 271 ? 42.306 57.311 122.906 1.00 12.07 ? 291 TYR D CA 1 +ATOM 12203 C C . TYR C 1 271 ? 41.444 57.134 121.661 1.00 12.64 ? 291 TYR D C 1 +ATOM 12204 O O . TYR C 1 271 ? 41.517 56.101 121.000 1.00 12.96 ? 291 TYR D O 1 +ATOM 12205 C CB . TYR C 1 271 ? 43.784 57.534 122.547 1.00 11.57 ? 291 TYR D CB 1 +ATOM 12206 C CG . TYR C 1 271 ? 44.058 58.624 121.554 1.00 10.72 ? 291 TYR D CG 1 +ATOM 12207 C CD1 . TYR C 1 271 ? 43.701 59.935 121.820 1.00 10.70 ? 291 TYR D CD1 1 +ATOM 12208 C CD2 . TYR C 1 271 ? 44.741 58.352 120.364 1.00 9.11 ? 291 TYR D CD2 1 +ATOM 12209 C CE1 . TYR C 1 271 ? 43.969 60.943 120.916 1.00 8.71 ? 291 TYR D CE1 1 +ATOM 12210 C CE2 . TYR C 1 271 ? 45.011 59.346 119.460 1.00 9.13 ? 291 TYR D CE2 1 +ATOM 12211 C CZ . TYR C 1 271 ? 44.628 60.645 119.743 1.00 10.37 ? 291 TYR D CZ 1 +ATOM 12212 O OH . TYR C 1 271 ? 44.880 61.662 118.852 1.00 11.34 ? 291 TYR D OH 1 +ATOM 12213 N N . LEU C 1 272 ? 40.607 58.136 121.390 1.00 13.46 ? 292 LEU D N 1 +ATOM 12214 C CA . LEU C 1 272 ? 39.664 58.162 120.255 1.00 14.31 ? 292 LEU D CA 1 +ATOM 12215 C C . LEU C 1 272 ? 38.425 57.252 120.372 1.00 15.17 ? 292 LEU D C 1 +ATOM 12216 O O . LEU C 1 272 ? 37.615 57.208 119.444 1.00 15.10 ? 292 LEU D O 1 +ATOM 12217 C CB . LEU C 1 272 ? 40.379 57.950 118.907 1.00 14.48 ? 292 LEU D CB 1 +ATOM 12218 C CG . LEU C 1 272 ? 41.459 58.979 118.554 1.00 13.88 ? 292 LEU D CG 1 +ATOM 12219 C CD1 . LEU C 1 272 ? 42.094 58.670 117.183 1.00 14.59 ? 292 LEU D CD1 1 +ATOM 12220 C CD2 . LEU C 1 272 ? 40.933 60.412 118.584 1.00 13.32 ? 292 LEU D CD2 1 +ATOM 12221 N N . MET C 1 273 ? 38.268 56.561 121.501 1.00 15.98 ? 293 MET D N 1 +ATOM 12222 C CA . MET C 1 273 ? 37.061 55.768 121.776 1.00 17.05 ? 293 MET D CA 1 +ATOM 12223 C C . MET C 1 273 ? 36.102 56.522 122.708 1.00 18.13 ? 293 MET D C 1 +ATOM 12224 O O . MET C 1 273 ? 34.976 56.073 122.942 1.00 19.66 ? 293 MET D O 1 +ATOM 12225 C CB . MET C 1 273 ? 37.441 54.411 122.387 1.00 16.85 ? 293 MET D CB 1 +ATOM 12226 C CG . MET C 1 273 ? 36.311 53.402 122.422 1.00 16.79 ? 293 MET D CG 1 +ATOM 12227 S SD . MET C 1 273 ? 36.803 51.727 122.898 1.00 16.95 ? 293 MET D SD 1 +ATOM 12228 C CE . MET C 1 273 ? 35.279 50.833 122.545 1.00 16.73 ? 293 MET D CE 1 +ATOM 12229 N N . HIS C 1 274 ? 36.557 57.658 123.229 1.00 19.22 ? 294 HIS D N 1 +ATOM 12230 C CA . HIS C 1 274 ? 35.784 58.516 124.121 1.00 19.97 ? 294 HIS D CA 1 +ATOM 12231 C C . HIS C 1 274 ? 36.447 59.898 124.117 1.00 20.43 ? 294 HIS D C 1 +ATOM 12232 O O . HIS C 1 274 ? 37.675 59.995 124.028 1.00 20.45 ? 294 HIS D O 1 +ATOM 12233 C CB . HIS C 1 274 ? 35.768 57.927 125.537 1.00 20.43 ? 294 HIS D CB 1 +ATOM 12234 C CG . HIS C 1 274 ? 34.706 58.496 126.432 1.00 21.16 ? 294 HIS D CG 1 +ATOM 12235 N ND1 . HIS C 1 274 ? 34.832 59.715 127.063 1.00 22.24 ? 294 HIS D ND1 1 +ATOM 12236 C CD2 . HIS C 1 274 ? 33.515 57.990 126.831 1.00 22.74 ? 294 HIS D CD2 1 +ATOM 12237 C CE1 . HIS C 1 274 ? 33.752 59.948 127.791 1.00 23.57 ? 294 HIS D CE1 1 +ATOM 12238 N NE2 . HIS C 1 274 ? 32.942 58.910 127.674 1.00 23.02 ? 294 HIS D NE2 1 +ATOM 12239 N N . GLU C 1 275 ? 35.643 60.959 124.210 1.00 20.49 ? 295 GLU D N 1 +ATOM 12240 C CA . GLU C 1 275 ? 36.155 62.337 124.205 1.00 20.56 ? 295 GLU D CA 1 +ATOM 12241 C C . GLU C 1 275 ? 37.082 62.641 125.378 1.00 20.39 ? 295 GLU D C 1 +ATOM 12242 O O . GLU C 1 275 ? 37.927 63.534 125.295 1.00 20.15 ? 295 GLU D O 1 +ATOM 12243 C CB . GLU C 1 275 ? 35.000 63.345 124.196 1.00 20.86 ? 295 GLU D CB 1 +ATOM 12244 C CG . GLU C 1 275 ? 34.326 63.864 123.001 0.00 25.08 ? 295 GLU D CG 1 +ATOM 12245 C CD . GLU C 1 275 ? 33.441 65.108 123.209 0.00 25.75 ? 295 GLU D CD 1 +ATOM 12246 O OE1 . GLU C 1 275 ? 33.546 65.771 124.274 0.00 29.44 ? 295 GLU D OE1 1 +ATOM 12247 O OE2 . GLU C 1 275 ? 32.643 65.429 122.300 0.00 30.00 ? 295 GLU D OE2 1 +ATOM 12248 N N . ARG C 1 276 ? 36.912 61.889 126.466 1.00 20.31 ? 296 ARG D N 1 +ATOM 12249 C CA . ARG C 1 276 ? 37.765 61.993 127.641 1.00 20.50 ? 296 ARG D CA 1 +ATOM 12250 C C . ARG C 1 276 ? 38.341 60.609 127.949 1.00 19.35 ? 296 ARG D C 1 +ATOM 12251 O O . ARG C 1 276 ? 37.861 59.903 128.832 1.00 19.29 ? 296 ARG D O 1 +ATOM 12252 C CB . ARG C 1 276 ? 36.964 62.562 128.813 1.00 20.88 ? 296 ARG D CB 1 +ATOM 12253 C CG . ARG C 1 276 ? 36.650 64.039 128.620 1.00 22.16 ? 296 ARG D CG 1 +ATOM 12254 C CD . ARG C 1 276 ? 35.950 64.687 129.812 1.00 22.75 ? 296 ARG D CD 1 +ATOM 12255 N NE . ARG C 1 276 ? 34.491 64.695 129.680 1.00 24.53 ? 296 ARG D NE 1 +ATOM 12256 C CZ . ARG C 1 276 ? 33.674 65.612 130.206 1.00 25.95 ? 296 ARG D CZ 1 +ATOM 12257 N NH1 . ARG C 1 276 ? 32.364 65.505 130.018 1.00 26.48 ? 296 ARG D NH1 1 +ATOM 12258 N NH2 . ARG C 1 276 ? 34.143 66.643 130.913 1.00 26.88 ? 296 ARG D NH2 1 +ATOM 12259 N N . PRO C 1 277 ? 39.378 60.211 127.193 1.00 17.56 ? 297 PRO D N 1 +ATOM 12260 C CA . PRO C 1 277 ? 39.943 58.873 127.322 1.00 16.65 ? 297 PRO D CA 1 +ATOM 12261 C C . PRO C 1 277 ? 40.836 58.750 128.546 1.00 15.71 ? 297 PRO D C 1 +ATOM 12262 O O . PRO C 1 277 ? 41.175 59.753 129.171 1.00 14.77 ? 297 PRO D O 1 +ATOM 12263 C CB . PRO C 1 277 ? 40.790 58.748 126.056 1.00 16.65 ? 297 PRO D CB 1 +ATOM 12264 C CG . PRO C 1 277 ? 41.251 60.126 125.810 1.00 16.21 ? 297 PRO D CG 1 +ATOM 12265 C CD . PRO C 1 277 ? 40.101 61.009 126.186 1.00 17.85 ? 297 PRO D CD 1 +ATOM 12266 N N . ALA C 1 278 ? 41.195 57.512 128.870 1.00 15.04 ? 298 ALA D N 1 +ATOM 12267 C CA . ALA C 1 278 ? 42.257 57.217 129.825 1.00 14.82 ? 298 ALA D CA 1 +ATOM 12268 C C . ALA C 1 278 ? 41.993 57.747 131.237 1.00 15.19 ? 298 ALA D C 1 +ATOM 12269 O O . ALA C 1 278 ? 42.930 58.118 131.944 1.00 14.45 ? 298 ALA D O 1 +ATOM 12270 C CB . ALA C 1 278 ? 43.597 57.759 129.297 1.00 14.04 ? 298 ALA D CB 1 +ATOM 12271 N N . TYR C 1 279 ? 40.730 57.754 131.672 1.00 15.53 ? 299 TYR D N 1 +ATOM 12272 C CA . TYR C 1 279 ? 40.423 58.259 133.010 1.00 16.34 ? 299 TYR D CA 1 +ATOM 12273 C C . TYR C 1 279 ? 41.092 57.378 134.062 1.00 16.22 ? 299 TYR D C 1 +ATOM 12274 O O . TYR C 1 279 ? 40.838 56.181 134.131 1.00 15.59 ? 299 TYR D O 1 +ATOM 12275 C CB . TYR C 1 279 ? 38.908 58.320 133.272 1.00 17.09 ? 299 TYR D CB 1 +ATOM 12276 C CG . TYR C 1 279 ? 38.579 59.027 134.573 1.00 17.70 ? 299 TYR D CG 1 +ATOM 12277 C CD1 . TYR C 1 279 ? 38.707 58.369 135.796 1.00 19.35 ? 299 TYR D CD1 1 +ATOM 12278 C CD2 . TYR C 1 279 ? 38.166 60.353 134.587 1.00 19.34 ? 299 TYR D CD2 1 +ATOM 12279 C CE1 . TYR C 1 279 ? 38.427 59.012 136.995 1.00 19.52 ? 299 TYR D CE1 1 +ATOM 12280 C CE2 . TYR C 1 279 ? 37.882 61.004 135.785 1.00 19.45 ? 299 TYR D CE2 1 +ATOM 12281 C CZ . TYR C 1 279 ? 38.012 60.323 136.983 1.00 19.87 ? 299 TYR D CZ 1 +ATOM 12282 O OH . TYR C 1 279 ? 37.744 60.947 138.183 1.00 19.77 ? 299 TYR D OH 1 +ATOM 12283 N N . LEU C 1 280 ? 41.945 57.987 134.878 1.00 16.31 ? 300 LEU D N 1 +ATOM 12284 C CA . LEU C 1 280 ? 42.649 57.268 135.928 1.00 16.65 ? 300 LEU D CA 1 +ATOM 12285 C C . LEU C 1 280 ? 42.214 57.707 137.333 1.00 17.04 ? 300 LEU D C 1 +ATOM 12286 O O . LEU C 1 280 ? 42.273 58.890 137.671 1.00 17.41 ? 300 LEU D O 1 +ATOM 12287 C CB . LEU C 1 280 ? 44.158 57.448 135.774 1.00 16.37 ? 300 LEU D CB 1 +ATOM 12288 C CG . LEU C 1 280 ? 44.836 56.649 134.658 1.00 16.46 ? 300 LEU D CG 1 +ATOM 12289 C CD1 . LEU C 1 280 ? 46.260 57.135 134.493 1.00 14.89 ? 300 LEU D CD1 1 +ATOM 12290 C CD2 . LEU C 1 280 ? 44.813 55.128 134.887 1.00 15.00 ? 300 LEU D CD2 1 +ATOM 12291 N N . TYR C 1 281 ? 41.767 56.735 138.124 1.00 17.37 ? 301 TYR D N 1 +ATOM 12292 C CA . TYR C 1 281 ? 41.691 56.864 139.575 1.00 17.75 ? 301 TYR D CA 1 +ATOM 12293 C C . TYR C 1 281 ? 43.057 56.496 140.143 1.00 18.11 ? 301 TYR D C 1 +ATOM 12294 O O . TYR C 1 281 ? 43.941 56.025 139.404 1.00 17.31 ? 301 TYR D O 1 +ATOM 12295 C CB . TYR C 1 281 ? 40.645 55.910 140.147 1.00 18.11 ? 301 TYR D CB 1 +ATOM 12296 C CG . TYR C 1 281 ? 39.230 56.237 139.739 1.00 18.05 ? 301 TYR D CG 1 +ATOM 12297 C CD1 . TYR C 1 281 ? 38.405 56.993 140.566 1.00 18.36 ? 301 TYR D CD1 1 +ATOM 12298 C CD2 . TYR C 1 281 ? 38.708 55.773 138.534 1.00 18.66 ? 301 TYR D CD2 1 +ATOM 12299 C CE1 . TYR C 1 281 ? 37.095 57.295 140.195 1.00 18.99 ? 301 TYR D CE1 1 +ATOM 12300 C CE2 . TYR C 1 281 ? 37.402 56.074 138.155 1.00 18.27 ? 301 TYR D CE2 1 +ATOM 12301 C CZ . TYR C 1 281 ? 36.605 56.829 138.993 1.00 18.80 ? 301 TYR D CZ 1 +ATOM 12302 O OH . TYR C 1 281 ? 35.318 57.119 138.610 1.00 19.38 ? 301 TYR D OH 1 +ATOM 12303 N N . SER C 1 282 ? 43.233 56.705 141.444 1.00 17.75 ? 302 SER D N 1 +ATOM 12304 C CA . SER C 1 282 ? 44.444 56.238 142.125 1.00 18.63 ? 302 SER D CA 1 +ATOM 12305 C C . SER C 1 282 ? 44.132 55.482 143.410 1.00 18.45 ? 302 SER D C 1 +ATOM 12306 O O . SER C 1 282 ? 43.315 55.924 144.233 1.00 18.48 ? 302 SER D O 1 +ATOM 12307 C CB . SER C 1 282 ? 45.401 57.392 142.383 1.00 18.75 ? 302 SER D CB 1 +ATOM 12308 O OG . SER C 1 282 ? 44.884 58.289 143.321 1.00 20.75 ? 302 SER D OG 1 +ATOM 12309 N N . LEU C 1 283 ? 44.774 54.326 143.562 1.00 18.32 ? 303 LEU D N 1 +ATOM 12310 C CA . LEU C 1 283 ? 44.636 53.521 144.761 1.00 18.31 ? 303 LEU D CA 1 +ATOM 12311 C C . LEU C 1 283 ? 45.743 53.873 145.741 1.00 18.60 ? 303 LEU D C 1 +ATOM 12312 O O . LEU C 1 283 ? 46.908 53.504 145.549 1.00 17.84 ? 303 LEU D O 1 +ATOM 12313 C CB . LEU C 1 283 ? 44.695 52.041 144.424 1.00 18.28 ? 303 LEU D CB 1 +ATOM 12314 C CG . LEU C 1 283 ? 44.347 51.101 145.573 1.00 18.51 ? 303 LEU D CG 1 +ATOM 12315 C CD1 . LEU C 1 283 ? 42.857 51.210 145.910 1.00 17.96 ? 303 LEU D CD1 1 +ATOM 12316 C CD2 . LEU C 1 283 ? 44.727 49.683 145.198 1.00 19.00 ? 303 LEU D CD2 1 +ATOM 12317 N N . GLU C 1 284 ? 45.369 54.598 146.785 1.00 18.80 ? 304 GLU D N 1 +ATOM 12318 C CA . GLU C 1 284 ? 46.293 54.959 147.848 1.00 19.33 ? 304 GLU D CA 1 +ATOM 12319 C C . GLU C 1 284 ? 46.291 53.862 148.904 1.00 19.16 ? 304 GLU D C 1 +ATOM 12320 O O . GLU C 1 284 ? 45.259 53.597 149.536 1.00 19.19 ? 304 GLU D O 1 +ATOM 12321 C CB . GLU C 1 284 ? 45.875 56.283 148.464 1.00 19.74 ? 304 GLU D CB 1 +ATOM 12322 C CG . GLU C 1 284 ? 46.778 56.764 149.565 1.00 22.22 ? 304 GLU D CG 1 +ATOM 12323 C CD . GLU C 1 284 ? 46.300 58.070 150.145 1.00 25.21 ? 304 GLU D CD 1 +ATOM 12324 O OE1 . GLU C 1 284 ? 46.429 59.114 149.462 1.00 28.22 ? 304 GLU D OE1 1 +ATOM 12325 O OE2 . GLU C 1 284 ? 45.787 58.041 151.282 1.00 27.83 ? 304 GLU D OE2 1 +ATOM 12326 N N . VAL C 1 285 ? 47.440 53.214 149.087 1.00 18.72 ? 305 VAL D N 1 +ATOM 12327 C CA . VAL C 1 285 ? 47.572 52.147 150.075 1.00 18.67 ? 305 VAL D CA 1 +ATOM 12328 C C . VAL C 1 285 ? 48.401 52.654 151.242 1.00 19.17 ? 305 VAL D C 1 +ATOM 12329 O O . VAL C 1 285 ? 49.502 53.176 151.043 1.00 18.76 ? 305 VAL D O 1 +ATOM 12330 C CB . VAL C 1 285 ? 48.250 50.899 149.491 1.00 18.62 ? 305 VAL D CB 1 +ATOM 12331 C CG1 . VAL C 1 285 ? 48.287 49.778 150.529 1.00 18.42 ? 305 VAL D CG1 1 +ATOM 12332 C CG2 . VAL C 1 285 ? 47.558 50.452 148.192 1.00 18.48 ? 305 VAL D CG2 1 +ATOM 12333 N N . GLN C 1 286 ? 47.874 52.502 152.458 1.00 19.47 ? 306 GLN D N 1 +ATOM 12334 C CA . GLN C 1 286 ? 48.588 52.928 153.659 1.00 19.65 ? 306 GLN D CA 1 +ATOM 12335 C C . GLN C 1 286 ? 48.708 51.788 154.662 1.00 19.89 ? 306 GLN D C 1 +ATOM 12336 O O . GLN C 1 286 ? 47.696 51.288 155.171 1.00 20.05 ? 306 GLN D O 1 +ATOM 12337 C CB . GLN C 1 286 ? 47.880 54.113 154.308 1.00 19.93 ? 306 GLN D CB 1 +ATOM 12338 C CG . GLN C 1 286 ? 48.609 54.664 155.529 1.00 20.92 ? 306 GLN D CG 1 +ATOM 12339 C CD . GLN C 1 286 ? 47.817 55.734 156.251 1.00 23.01 ? 306 GLN D CD 1 +ATOM 12340 O OE1 . GLN C 1 286 ? 46.858 56.285 155.714 1.00 24.96 ? 306 GLN D OE1 1 +ATOM 12341 N NE2 . GLN C 1 286 ? 48.219 56.032 157.478 1.00 22.93 ? 306 GLN D NE2 1 +ATOM 12342 N N . LEU C 1 287 ? 49.951 51.408 154.945 1.00 19.85 ? 307 LEU D N 1 +ATOM 12343 C CA . LEU C 1 287 ? 50.278 50.346 155.885 1.00 19.93 ? 307 LEU D CA 1 +ATOM 12344 C C . LEU C 1 287 ? 50.712 50.955 157.214 1.00 20.56 ? 307 LEU D C 1 +ATOM 12345 O O . LEU C 1 287 ? 51.591 51.807 157.242 1.00 20.13 ? 307 LEU D O 1 +ATOM 12346 C CB . LEU C 1 287 ? 51.429 49.512 155.330 1.00 19.81 ? 307 LEU D CB 1 +ATOM 12347 C CG . LEU C 1 287 ? 52.046 48.433 156.219 1.00 19.84 ? 307 LEU D CG 1 +ATOM 12348 C CD1 . LEU C 1 287 ? 51.032 47.335 156.511 1.00 20.32 ? 307 LEU D CD1 1 +ATOM 12349 C CD2 . LEU C 1 287 ? 53.285 47.863 155.537 1.00 20.04 ? 307 LEU D CD2 1 +ATOM 12350 N N . THR C 1 288 ? 50.085 50.520 158.304 1.00 21.15 ? 308 THR D N 1 +ATOM 12351 C CA . THR C 1 288 ? 50.569 50.804 159.653 1.00 21.83 ? 308 THR D CA 1 +ATOM 12352 C C . THR C 1 288 ? 51.014 49.474 160.253 1.00 22.58 ? 308 THR D C 1 +ATOM 12353 O O . THR C 1 288 ? 50.212 48.547 160.356 1.00 22.43 ? 308 THR D O 1 +ATOM 12354 C CB . THR C 1 288 ? 49.465 51.407 160.528 1.00 21.97 ? 308 THR D CB 1 +ATOM 12355 O OG1 . THR C 1 288 ? 48.907 52.554 159.879 1.00 22.35 ? 308 THR D OG1 1 +ATOM 12356 C CG2 . THR C 1 288 ? 50.016 51.795 161.911 1.00 21.74 ? 308 THR D CG2 1 +ATOM 12357 N N . ALA C 1 289 ? 52.291 49.370 160.620 1.00 23.57 ? 309 ALA D N 1 +ATOM 12358 C CA . ALA C 1 289 ? 52.843 48.118 161.150 1.00 24.58 ? 309 ALA D CA 1 +ATOM 12359 C C . ALA C 1 289 ? 53.582 48.337 162.470 1.00 25.64 ? 309 ALA D C 1 +ATOM 12360 O O . ALA C 1 289 ? 54.060 49.442 162.753 1.00 25.58 ? 309 ALA D O 1 +ATOM 12361 C CB . ALA C 1 289 ? 53.771 47.474 160.128 1.00 24.61 ? 309 ALA D CB 1 +ATOM 12362 N N . GLN C 1 290 ? 53.655 47.274 163.269 1.00 26.93 ? 310 GLN D N 1 +ATOM 12363 C CA . GLN C 1 290 ? 54.445 47.258 164.501 1.00 27.92 ? 310 GLN D CA 1 +ATOM 12364 C C . GLN C 1 290 ? 55.743 46.497 164.262 1.00 28.42 ? 310 GLN D C 1 +ATOM 12365 O O . GLN C 1 290 ? 55.719 45.333 163.829 1.00 28.50 ? 310 GLN D O 1 +ATOM 12366 C CB . GLN C 1 290 ? 53.655 46.617 165.646 1.00 28.28 ? 310 GLN D CB 1 +ATOM 12367 C CG . GLN C 1 290 ? 52.676 47.566 166.323 1.00 29.47 ? 310 GLN D CG 1 +ATOM 12368 C CD . GLN C 1 290 ? 53.366 48.693 167.090 1.00 30.95 ? 310 GLN D CD 1 +ATOM 12369 O OE1 . GLN C 1 290 ? 54.519 48.564 167.520 1.00 32.26 ? 310 GLN D OE1 1 +ATOM 12370 N NE2 . GLN C 1 290 ? 52.659 49.810 167.257 1.00 32.48 ? 310 GLN D NE2 1 +ATOM 12371 N N . THR C 1 291 ? 56.867 47.161 164.543 1.00 28.99 ? 311 THR D N 1 +ATOM 12372 C CA . THR C 1 291 ? 58.198 46.635 164.225 1.00 29.44 ? 311 THR D CA 1 +ATOM 12373 C C . THR C 1 291 ? 59.099 46.572 165.455 1.00 29.90 ? 311 THR D C 1 +ATOM 12374 O O . THR C 1 291 ? 58.738 47.042 166.529 1.00 29.87 ? 311 THR D O 1 +ATOM 12375 C CB . THR C 1 291 ? 58.915 47.477 163.128 1.00 29.46 ? 311 THR D CB 1 +ATOM 12376 O OG1 . THR C 1 291 ? 59.453 48.674 163.699 1.00 29.18 ? 311 THR D OG1 1 +ATOM 12377 C CG2 . THR C 1 291 ? 57.964 47.839 161.995 1.00 29.27 ? 311 THR D CG2 1 +ATOM 12378 N N . SER C 1 292 ? 60.276 45.980 165.258 1.00 30.66 ? 312 SER D N 1 +ATOM 12379 C CA . SER C 1 292 ? 61.314 45.821 166.283 1.00 30.96 ? 312 SER D CA 1 +ATOM 12380 C C . SER C 1 292 ? 61.814 47.153 166.862 1.00 30.94 ? 312 SER D C 1 +ATOM 12381 O O . SER C 1 292 ? 62.369 47.184 167.967 1.00 31.28 ? 312 SER D O 1 +ATOM 12382 C CB . SER C 1 292 ? 62.507 45.081 165.666 1.00 31.02 ? 312 SER D CB 1 +ATOM 12383 O OG . SER C 1 292 ? 62.199 44.636 164.347 1.00 32.09 ? 312 SER D OG 1 +ATOM 12384 N N . LEU C 1 293 ? 61.647 48.235 166.100 1.00 30.46 ? 313 LEU D N 1 +ATOM 12385 C CA . LEU C 1 293 ? 62.067 49.574 166.510 1.00 30.11 ? 313 LEU D CA 1 +ATOM 12386 C C . LEU C 1 293 ? 60.882 50.533 166.613 1.00 29.68 ? 313 LEU D C 1 +ATOM 12387 O O . LEU C 1 293 ? 61.061 51.743 166.535 1.00 30.29 ? 313 LEU D O 1 +ATOM 12388 C CB . LEU C 1 293 ? 63.070 50.129 165.502 1.00 30.13 ? 313 LEU D CB 1 +ATOM 12389 C CG . LEU C 1 293 ? 64.292 49.265 165.193 1.00 30.27 ? 313 LEU D CG 1 +ATOM 12390 C CD1 . LEU C 1 293 ? 64.990 49.755 163.943 1.00 31.15 ? 313 LEU D CD1 1 +ATOM 12391 C CD2 . LEU C 1 293 ? 65.250 49.262 166.370 1.00 31.03 ? 313 LEU D CD2 1 +ATOM 12392 N N . GLY C 1 294 ? 59.675 49.997 166.777 1.00 29.26 ? 314 GLY D N 1 +ATOM 12393 C CA . GLY C 1 294 ? 58.480 50.822 166.935 1.00 28.60 ? 314 GLY D CA 1 +ATOM 12394 C C . GLY C 1 294 ? 57.550 50.792 165.732 1.00 28.00 ? 314 GLY D C 1 +ATOM 12395 O O . GLY C 1 294 ? 57.763 50.024 164.794 1.00 28.31 ? 314 GLY D O 1 +ATOM 12396 N N . PRO C 1 295 ? 56.499 51.627 165.759 1.00 27.33 ? 315 PRO D N 1 +ATOM 12397 C CA . PRO C 1 295 ? 55.494 51.638 164.702 1.00 26.56 ? 315 PRO D CA 1 +ATOM 12398 C C . PRO C 1 295 ? 56.007 52.307 163.431 1.00 25.72 ? 315 PRO D C 1 +ATOM 12399 O O . PRO C 1 295 ? 56.700 53.322 163.514 1.00 25.66 ? 315 PRO D O 1 +ATOM 12400 C CB . PRO C 1 295 ? 54.347 52.463 165.307 1.00 26.67 ? 315 PRO D CB 1 +ATOM 12401 C CG . PRO C 1 295 ? 54.707 52.681 166.747 1.00 27.09 ? 315 PRO D CG 1 +ATOM 12402 C CD . PRO C 1 295 ? 56.190 52.620 166.799 1.00 27.28 ? 315 PRO D CD 1 +ATOM 12403 N N . VAL C 1 296 ? 55.662 51.750 162.270 1.00 24.45 ? 316 VAL D N 1 +ATOM 12404 C CA . VAL C 1 296 ? 56.041 52.355 160.991 1.00 23.57 ? 316 VAL D CA 1 +ATOM 12405 C C . VAL C 1 296 ? 54.832 52.555 160.090 1.00 22.49 ? 316 VAL D C 1 +ATOM 12406 O O . VAL C 1 296 ? 53.825 51.852 160.211 1.00 23.02 ? 316 VAL D O 1 +ATOM 12407 C CB . VAL C 1 296 ? 57.105 51.520 160.242 1.00 23.55 ? 316 VAL D CB 1 +ATOM 12408 C CG1 . VAL C 1 296 ? 58.257 51.168 161.177 1.00 24.40 ? 316 VAL D CG1 1 +ATOM 12409 C CG2 . VAL C 1 296 ? 56.494 50.281 159.645 1.00 23.71 ? 316 VAL D CG2 1 +ATOM 12410 N N . SER C 1 297 ? 54.935 53.538 159.203 1.00 21.02 ? 317 SER D N 1 +ATOM 12411 C CA . SER C 1 297 ? 53.919 53.789 158.188 1.00 19.92 ? 317 SER D CA 1 +ATOM 12412 C C . SER C 1 297 ? 54.551 53.618 156.811 1.00 18.74 ? 317 SER D C 1 +ATOM 12413 O O . SER C 1 297 ? 55.696 53.994 156.607 1.00 18.22 ? 317 SER D O 1 +ATOM 12414 C CB . SER C 1 297 ? 53.361 55.203 158.331 1.00 20.24 ? 317 SER D CB 1 +ATOM 12415 O OG . SER C 1 297 ? 52.735 55.367 159.589 1.00 21.55 ? 317 SER D OG 1 +ATOM 12416 N N . ASP C 1 298 ? 53.802 53.043 155.877 1.00 17.39 ? 318 ASP D N 1 +ATOM 12417 C CA . ASP C 1 298 ? 54.249 52.927 154.494 1.00 16.23 ? 318 ASP D CA 1 +ATOM 12418 C C . ASP C 1 298 ? 53.107 53.311 153.568 1.00 16.01 ? 318 ASP D C 1 +ATOM 12419 O O . ASP C 1 298 ? 51.965 52.912 153.797 1.00 15.20 ? 318 ASP D O 1 +ATOM 12420 C CB . ASP C 1 298 ? 54.728 51.507 154.196 1.00 16.27 ? 318 ASP D CB 1 +ATOM 12421 C CG . ASP C 1 298 ? 55.449 51.394 152.858 1.00 15.76 ? 318 ASP D CG 1 +ATOM 12422 O OD1 . ASP C 1 298 ? 56.041 52.392 152.389 1.00 15.98 ? 318 ASP D OD1 1 +ATOM 12423 O OD2 . ASP C 1 298 ? 55.419 50.291 152.274 1.00 12.25 ? 318 ASP D OD2 1 +ATOM 12424 N N . PHE C 1 299 ? 53.427 54.113 152.552 1.00 15.56 ? 319 PHE D N 1 +ATOM 12425 C CA . PHE C 1 299 ? 52.467 54.557 151.536 1.00 15.61 ? 319 PHE D CA 1 +ATOM 12426 C C . PHE C 1 299 ? 52.935 54.154 150.145 1.00 15.27 ? 319 PHE D C 1 +ATOM 12427 O O . PHE C 1 299 ? 54.109 54.296 149.820 1.00 15.45 ? 319 PHE D O 1 +ATOM 12428 C CB . PHE C 1 299 ? 52.313 56.086 151.569 1.00 16.10 ? 319 PHE D CB 1 +ATOM 12429 C CG . PHE C 1 299 ? 51.820 56.617 152.890 1.00 16.74 ? 319 PHE D CG 1 +ATOM 12430 C CD1 . PHE C 1 299 ? 52.698 56.795 153.949 1.00 18.52 ? 319 PHE D CD1 1 +ATOM 12431 C CD2 . PHE C 1 299 ? 50.482 56.918 153.074 1.00 18.64 ? 319 PHE D CD2 1 +ATOM 12432 C CE1 . PHE C 1 299 ? 52.248 57.266 155.168 1.00 18.33 ? 319 PHE D CE1 1 +ATOM 12433 C CE2 . PHE C 1 299 ? 50.030 57.404 154.292 1.00 18.41 ? 319 PHE D CE2 1 +ATOM 12434 C CZ . PHE C 1 299 ? 50.920 57.567 155.335 1.00 17.76 ? 319 PHE D CZ 1 +ATOM 12435 N N . TYR C 1 300 ? 52.013 53.632 149.342 1.00 14.86 ? 320 TYR D N 1 +ATOM 12436 C CA . TYR C 1 300 ? 52.231 53.450 147.908 1.00 14.43 ? 320 TYR D CA 1 +ATOM 12437 C C . TYR C 1 300 ? 50.925 53.805 147.200 1.00 14.54 ? 320 TYR D C 1 +ATOM 12438 O O . TYR C 1 300 ? 49.848 53.473 147.694 1.00 14.26 ? 320 TYR D O 1 +ATOM 12439 C CB . TYR C 1 300 ? 52.640 52.008 147.585 1.00 14.49 ? 320 TYR D CB 1 +ATOM 12440 C CG . TYR C 1 300 ? 53.108 51.818 146.157 1.00 13.39 ? 320 TYR D CG 1 +ATOM 12441 C CD1 . TYR C 1 300 ? 52.200 51.615 145.127 1.00 13.65 ? 320 TYR D CD1 1 +ATOM 12442 C CD2 . TYR C 1 300 ? 54.458 51.880 145.836 1.00 12.74 ? 320 TYR D CD2 1 +ATOM 12443 C CE1 . TYR C 1 300 ? 52.626 51.460 143.802 1.00 13.90 ? 320 TYR D CE1 1 +ATOM 12444 C CE2 . TYR C 1 300 ? 54.898 51.732 144.519 1.00 14.27 ? 320 TYR D CE2 1 +ATOM 12445 C CZ . TYR C 1 300 ? 53.978 51.516 143.511 1.00 14.28 ? 320 TYR D CZ 1 +ATOM 12446 O OH . TYR C 1 300 ? 54.412 51.381 142.211 1.00 13.01 ? 320 TYR D OH 1 +ATOM 12447 N N . THR C 1 301 ? 51.022 54.505 146.073 1.00 14.48 ? 321 THR D N 1 +ATOM 12448 C CA . THR C 1 301 ? 49.844 54.875 145.290 1.00 14.65 ? 321 THR D CA 1 +ATOM 12449 C C . THR C 1 301 ? 49.940 54.299 143.881 1.00 14.85 ? 321 THR D C 1 +ATOM 12450 O O . THR C 1 301 ? 50.880 54.611 143.136 1.00 15.04 ? 321 THR D O 1 +ATOM 12451 C CB . THR C 1 301 ? 49.659 56.397 145.178 1.00 15.05 ? 321 THR D CB 1 +ATOM 12452 O OG1 . THR C 1 301 ? 49.600 56.981 146.486 1.00 14.23 ? 321 THR D OG1 1 +ATOM 12453 C CG2 . THR C 1 301 ? 48.362 56.716 144.437 1.00 14.04 ? 321 THR D CG2 1 +ATOM 12454 N N . LEU C 1 302 ? 48.937 53.499 143.519 1.00 14.90 ? 322 LEU D N 1 +ATOM 12455 C CA . LEU C 1 302 ? 48.880 52.810 142.227 1.00 14.76 ? 322 LEU D CA 1 +ATOM 12456 C C . LEU C 1 302 ? 47.771 53.409 141.357 1.00 14.54 ? 322 LEU D C 1 +ATOM 12457 O O . LEU C 1 302 ? 46.613 53.433 141.783 1.00 13.81 ? 322 LEU D O 1 +ATOM 12458 C CB . LEU C 1 302 ? 48.600 51.320 142.451 1.00 15.03 ? 322 LEU D CB 1 +ATOM 12459 C CG . LEU C 1 302 ? 48.593 50.389 141.231 1.00 15.08 ? 322 LEU D CG 1 +ATOM 12460 C CD1 . LEU C 1 302 ? 49.999 50.229 140.644 1.00 15.46 ? 322 LEU D CD1 1 +ATOM 12461 C CD2 . LEU C 1 302 ? 48.008 49.013 141.550 1.00 15.25 ? 322 LEU D CD2 1 +ATOM 12462 N N . PRO C 1 303 ? 48.110 53.912 140.150 1.00 14.18 ? 323 PRO D N 1 +ATOM 12463 C CA . PRO C 1 303 ? 47.071 54.332 139.197 1.00 14.21 ? 323 PRO D CA 1 +ATOM 12464 C C . PRO C 1 303 ? 46.154 53.186 138.812 1.00 14.37 ? 323 PRO D C 1 +ATOM 12465 O O . PRO C 1 303 ? 46.625 52.054 138.637 1.00 14.67 ? 323 PRO D O 1 +ATOM 12466 C CB . PRO C 1 303 ? 47.872 54.776 137.963 1.00 14.38 ? 323 PRO D CB 1 +ATOM 12467 C CG . PRO C 1 303 ? 49.252 55.034 138.474 1.00 13.63 ? 323 PRO D CG 1 +ATOM 12468 C CD . PRO C 1 303 ? 49.469 54.136 139.621 1.00 14.36 ? 323 PRO D CD 1 +ATOM 12469 N N . VAL C 1 304 ? 44.864 53.477 138.663 1.00 14.40 ? 324 VAL D N 1 +ATOM 12470 C CA . VAL C 1 304 ? 43.867 52.458 138.342 1.00 14.29 ? 324 VAL D CA 1 +ATOM 12471 C C . VAL C 1 304 ? 42.945 52.963 137.232 1.00 14.48 ? 324 VAL D C 1 +ATOM 12472 O O . VAL C 1 304 ? 42.408 54.084 137.307 1.00 14.04 ? 324 VAL D O 1 +ATOM 12473 C CB . VAL C 1 304 ? 42.999 52.112 139.576 1.00 14.05 ? 324 VAL D CB 1 +ATOM 12474 C CG1 . VAL C 1 304 ? 41.723 51.306 139.164 1.00 12.80 ? 324 VAL D CG1 1 +ATOM 12475 C CG2 . VAL C 1 304 ? 43.825 51.378 140.599 1.00 14.76 ? 324 VAL D CG2 1 +ATOM 12476 N N . GLY C 1 305 ? 42.794 52.142 136.198 1.00 14.53 ? 325 GLY D N 1 +ATOM 12477 C CA . GLY C 1 305 ? 41.843 52.409 135.133 1.00 14.56 ? 325 GLY D CA 1 +ATOM 12478 C C . GLY C 1 305 ? 40.783 51.342 135.170 1.00 14.29 ? 325 GLY D C 1 +ATOM 12479 O O . GLY C 1 305 ? 41.077 50.158 135.001 1.00 14.52 ? 325 GLY D O 1 +ATOM 12480 N N . ILE C 1 306 ? 39.540 51.744 135.417 1.00 14.12 ? 326 ILE D N 1 +ATOM 12481 C CA . ILE C 1 306 ? 38.461 50.775 135.504 1.00 14.04 ? 326 ILE D CA 1 +ATOM 12482 C C . ILE C 1 306 ? 37.932 50.466 134.111 1.00 13.90 ? 326 ILE D C 1 +ATOM 12483 O O . ILE C 1 306 ? 37.294 51.315 133.463 1.00 13.89 ? 326 ILE D O 1 +ATOM 12484 C CB . ILE C 1 306 ? 37.339 51.270 136.437 1.00 14.25 ? 326 ILE D CB 1 +ATOM 12485 C CG1 . ILE C 1 306 ? 37.906 51.503 137.840 1.00 15.44 ? 326 ILE D CG1 1 +ATOM 12486 C CG2 . ILE C 1 306 ? 36.222 50.254 136.488 1.00 13.11 ? 326 ILE D CG2 1 +ATOM 12487 C CD1 . ILE C 1 306 ? 36.978 52.277 138.774 1.00 15.57 ? 326 ILE D CD1 1 +ATOM 12488 N N . ARG C 1 307 ? 38.208 49.242 133.662 1.00 13.73 ? 327 ARG D N 1 +ATOM 12489 C CA . ARG C 1 307 ? 37.872 48.815 132.314 1.00 13.59 ? 327 ARG D CA 1 +ATOM 12490 C C . ARG C 1 307 ? 37.946 47.301 132.187 1.00 13.61 ? 327 ARG D C 1 +ATOM 12491 O O . ARG C 1 307 ? 38.640 46.626 132.955 1.00 13.81 ? 327 ARG D O 1 +ATOM 12492 C CB . ARG C 1 307 ? 38.814 49.471 131.293 1.00 13.57 ? 327 ARG D CB 1 +ATOM 12493 C CG . ARG C 1 307 ? 40.275 48.960 131.369 1.00 12.77 ? 327 ARG D CG 1 +ATOM 12494 C CD . ARG C 1 307 ? 40.567 47.863 130.349 1.00 12.82 ? 327 ARG D CD 1 +ATOM 12495 N NE . ARG C 1 307 ? 41.911 47.313 130.522 1.00 13.49 ? 327 ARG D NE 1 +ATOM 12496 C CZ . ARG C 1 307 ? 42.228 46.288 131.311 1.00 13.02 ? 327 ARG D CZ 1 +ATOM 12497 N NH1 . ARG C 1 307 ? 43.489 45.875 131.364 1.00 15.10 ? 327 ARG D NH1 1 +ATOM 12498 N NH2 . ARG C 1 307 ? 41.302 45.630 132.004 1.00 13.85 ? 327 ARG D NH2 1 +ATOM 12499 N N . THR C 1 308 ? 37.225 46.765 131.212 1.00 13.56 ? 328 THR D N 1 +ATOM 12500 C CA . THR C 1 308 ? 37.194 45.331 130.983 1.00 13.92 ? 328 THR D CA 1 +ATOM 12501 C C . THR C 1 308 ? 37.589 45.014 129.548 1.00 13.77 ? 328 THR D C 1 +ATOM 12502 O O . THR C 1 308 ? 37.418 45.842 128.653 1.00 13.78 ? 328 THR D O 1 +ATOM 12503 C CB . THR C 1 308 ? 35.784 44.756 131.256 1.00 14.24 ? 328 THR D CB 1 +ATOM 12504 O OG1 . THR C 1 308 ? 34.878 45.221 130.249 1.00 15.96 ? 328 THR D OG1 1 +ATOM 12505 C CG2 . THR C 1 308 ? 35.290 45.197 132.627 1.00 15.36 ? 328 THR D CG2 1 +ATOM 12506 N N . VAL C 1 309 ? 38.135 43.818 129.358 1.00 13.85 ? 329 VAL D N 1 +ATOM 12507 C CA . VAL C 1 309 ? 38.485 43.292 128.041 1.00 13.95 ? 329 VAL D CA 1 +ATOM 12508 C C . VAL C 1 309 ? 37.837 41.923 127.847 1.00 14.29 ? 329 VAL D C 1 +ATOM 12509 O O . VAL C 1 309 ? 37.982 41.038 128.694 1.00 14.31 ? 329 VAL D O 1 +ATOM 12510 C CB . VAL C 1 309 ? 40.016 43.139 127.884 1.00 13.54 ? 329 VAL D CB 1 +ATOM 12511 C CG1 . VAL C 1 309 ? 40.364 42.836 126.423 1.00 15.03 ? 329 VAL D CG1 1 +ATOM 12512 C CG2 . VAL C 1 309 ? 40.726 44.396 128.372 1.00 13.37 ? 329 VAL D CG2 1 +ATOM 12513 N N . ALA C 1 310 ? 37.134 41.742 126.729 1.00 14.91 ? 330 ALA D N 1 +ATOM 12514 C CA . ALA C 1 310 ? 36.587 40.434 126.379 1.00 15.06 ? 330 ALA D CA 1 +ATOM 12515 C C . ALA C 1 310 ? 36.696 40.183 124.888 1.00 15.55 ? 330 ALA D C 1 +ATOM 12516 O O . ALA C 1 310 ? 36.853 41.114 124.112 1.00 16.50 ? 330 ALA D O 1 +ATOM 12517 C CB . ALA C 1 310 ? 35.134 40.322 126.827 1.00 15.33 ? 330 ALA D CB 1 +ATOM 12518 N N . VAL C 1 311 ? 36.628 38.916 124.502 1.00 16.28 ? 331 VAL D N 1 +ATOM 12519 C CA . VAL C 1 311 ? 36.748 38.514 123.112 1.00 16.63 ? 331 VAL D CA 1 +ATOM 12520 C C . VAL C 1 311 ? 35.610 37.555 122.762 1.00 17.13 ? 331 VAL D C 1 +ATOM 12521 O O . VAL C 1 311 ? 35.323 36.630 123.516 1.00 17.32 ? 331 VAL D O 1 +ATOM 12522 C CB . VAL C 1 311 ? 38.119 37.852 122.873 1.00 16.99 ? 331 VAL D CB 1 +ATOM 12523 C CG1 . VAL C 1 311 ? 38.227 37.280 121.462 1.00 18.09 ? 331 VAL D CG1 1 +ATOM 12524 C CG2 . VAL C 1 311 ? 39.232 38.864 123.141 1.00 16.50 ? 331 VAL D CG2 1 +ATOM 12525 N N . THR C 1 312 ? 34.954 37.799 121.629 1.00 17.27 ? 332 THR D N 1 +ATOM 12526 C CA . THR C 1 312 ? 33.908 36.904 121.122 1.00 17.48 ? 332 THR D CA 1 +ATOM 12527 C C . THR C 1 312 ? 34.462 36.194 119.895 1.00 17.49 ? 332 THR D C 1 +ATOM 12528 O O . THR C 1 312 ? 35.679 36.210 119.672 1.00 17.77 ? 332 THR D O 1 +ATOM 12529 C CB . THR C 1 312 ? 32.613 37.694 120.792 1.00 17.38 ? 332 THR D CB 1 +ATOM 12530 O OG1 . THR C 1 312 ? 32.825 38.523 119.646 1.00 17.68 ? 332 THR D OG1 1 +ATOM 12531 C CG2 . THR C 1 312 ? 32.215 38.579 121.952 1.00 18.03 ? 332 THR D CG2 1 +ATOM 12532 N N . LYS C 1 313 ? 33.596 35.557 119.105 1.00 17.27 ? 333 LYS D N 1 +ATOM 12533 C CA . LYS C 1 313 ? 34.035 34.878 117.883 1.00 17.48 ? 333 LYS D CA 1 +ATOM 12534 C C . LYS C 1 313 ? 34.434 35.852 116.768 1.00 16.67 ? 333 LYS D C 1 +ATOM 12535 O O . LYS C 1 313 ? 35.168 35.470 115.854 1.00 15.78 ? 333 LYS D O 1 +ATOM 12536 C CB . LYS C 1 313 ? 32.944 33.932 117.378 1.00 17.87 ? 333 LYS D CB 1 +ATOM 12537 C CG . LYS C 1 313 ? 32.744 32.702 118.267 1.00 18.72 ? 333 LYS D CG 1 +ATOM 12538 C CD . LYS C 1 313 ? 31.548 31.867 117.811 1.00 19.49 ? 333 LYS D CD 1 +ATOM 12539 C CE . LYS C 1 313 ? 31.407 30.602 118.648 1.00 21.65 ? 333 LYS D CE 1 +ATOM 12540 N NZ . LYS C 1 313 ? 30.582 29.567 117.965 1.00 23.75 ? 333 LYS D NZ 1 +ATOM 12541 N N . SER C 1 314 ? 33.958 37.096 116.852 1.00 16.18 ? 334 SER D N 1 +ATOM 12542 C CA . SER C 1 314 ? 34.239 38.120 115.837 1.00 16.17 ? 334 SER D CA 1 +ATOM 12543 C C . SER C 1 314 ? 34.590 39.517 116.357 1.00 15.74 ? 334 SER D C 1 +ATOM 12544 O O . SER C 1 314 ? 34.886 40.399 115.549 1.00 15.57 ? 334 SER D O 1 +ATOM 12545 C CB . SER C 1 314 ? 33.025 38.264 114.935 1.00 16.32 ? 334 SER D CB 1 +ATOM 12546 O OG . SER C 1 314 ? 31.978 38.909 115.637 1.00 17.06 ? 334 SER D OG 1 +ATOM 12547 N N . GLN C 1 315 ? 34.531 39.738 117.672 1.00 15.32 ? 335 GLN D N 1 +ATOM 12548 C CA . GLN C 1 315 ? 34.748 41.082 118.231 1.00 15.28 ? 335 GLN D CA 1 +ATOM 12549 C C . GLN C 1 315 ? 35.751 41.057 119.371 1.00 14.35 ? 335 GLN D C 1 +ATOM 12550 O O . GLN C 1 315 ? 35.935 40.028 120.034 1.00 14.19 ? 335 GLN D O 1 +ATOM 12551 C CB . GLN C 1 315 ? 33.424 41.730 118.705 1.00 15.31 ? 335 GLN D CB 1 +ATOM 12552 C CG . GLN C 1 315 ? 32.505 42.161 117.554 1.00 16.26 ? 335 GLN D CG 1 +ATOM 12553 C CD . GLN C 1 315 ? 31.204 42.848 118.005 1.00 16.78 ? 335 GLN D CD 1 +ATOM 12554 O OE1 . GLN C 1 315 ? 30.639 42.538 119.055 1.00 19.84 ? 335 GLN D OE1 1 +ATOM 12555 N NE2 . GLN C 1 315 ? 30.724 43.764 117.188 1.00 18.16 ? 335 GLN D NE2 1 +ATOM 12556 N N . PHE C 1 316 ? 36.406 42.199 119.562 1.00 13.54 ? 336 PHE D N 1 +ATOM 12557 C CA . PHE C 1 316 ? 37.289 42.456 120.689 1.00 13.06 ? 336 PHE D CA 1 +ATOM 12558 C C . PHE C 1 316 ? 36.599 43.582 121.460 1.00 13.25 ? 336 PHE D C 1 +ATOM 12559 O O . PHE C 1 316 ? 36.491 44.708 120.965 1.00 12.49 ? 336 PHE D O 1 +ATOM 12560 C CB . PHE C 1 316 ? 38.665 42.913 120.183 1.00 12.89 ? 336 PHE D CB 1 +ATOM 12561 C CG . PHE C 1 316 ? 39.731 42.949 121.249 1.00 12.22 ? 336 PHE D CG 1 +ATOM 12562 C CD1 . PHE C 1 316 ? 39.825 44.019 122.134 1.00 11.77 ? 336 PHE D CD1 1 +ATOM 12563 C CD2 . PHE C 1 316 ? 40.644 41.910 121.361 1.00 12.19 ? 336 PHE D CD2 1 +ATOM 12564 C CE1 . PHE C 1 316 ? 40.806 44.031 123.125 1.00 10.77 ? 336 PHE D CE1 1 +ATOM 12565 C CE2 . PHE C 1 316 ? 41.640 41.931 122.342 1.00 10.30 ? 336 PHE D CE2 1 +ATOM 12566 C CZ . PHE C 1 316 ? 41.716 42.978 123.211 1.00 11.04 ? 336 PHE D CZ 1 +ATOM 12567 N N . LEU C 1 317 ? 36.112 43.271 122.659 1.00 13.44 ? 337 LEU D N 1 +ATOM 12568 C CA . LEU C 1 317 ? 35.295 44.204 123.428 1.00 13.39 ? 337 LEU D CA 1 +ATOM 12569 C C . LEU C 1 317 ? 36.080 44.889 124.545 1.00 13.26 ? 337 LEU D C 1 +ATOM 12570 O O . LEU C 1 317 ? 36.697 44.228 125.393 1.00 13.77 ? 337 LEU D O 1 +ATOM 12571 C CB . LEU C 1 317 ? 34.080 43.465 124.020 1.00 13.55 ? 337 LEU D CB 1 +ATOM 12572 C CG . LEU C 1 317 ? 33.260 42.621 123.038 1.00 13.80 ? 337 LEU D CG 1 +ATOM 12573 C CD1 . LEU C 1 317 ? 32.157 41.820 123.778 1.00 14.87 ? 337 LEU D CD1 1 +ATOM 12574 C CD2 . LEU C 1 317 ? 32.657 43.485 121.933 1.00 13.07 ? 337 LEU D CD2 1 +ATOM 12575 N N . ILE C 1 318 ? 36.071 46.216 124.532 1.00 12.84 ? 338 ILE D N 1 +ATOM 12576 C CA . ILE C 1 318 ? 36.596 47.008 125.644 1.00 12.75 ? 338 ILE D CA 1 +ATOM 12577 C C . ILE C 1 318 ? 35.391 47.686 126.284 1.00 12.98 ? 338 ILE D C 1 +ATOM 12578 O O . ILE C 1 318 ? 34.626 48.372 125.606 1.00 12.24 ? 338 ILE D O 1 +ATOM 12579 C CB . ILE C 1 318 ? 37.659 48.025 125.192 1.00 12.88 ? 338 ILE D CB 1 +ATOM 12580 C CG1 . ILE C 1 318 ? 38.906 47.292 124.700 1.00 12.50 ? 338 ILE D CG1 1 +ATOM 12581 C CG2 . ILE C 1 318 ? 38.051 48.938 126.344 1.00 12.31 ? 338 ILE D CG2 1 +ATOM 12582 C CD1 . ILE C 1 318 ? 40.076 48.213 124.400 1.00 13.62 ? 338 ILE D CD1 1 +ATOM 12583 N N . ASN C 1 319 ? 35.193 47.435 127.577 1.00 13.64 ? 339 ASN D N 1 +ATOM 12584 C CA . ASN C 1 319 ? 34.016 47.960 128.303 1.00 14.38 ? 339 ASN D CA 1 +ATOM 12585 C C . ASN C 1 319 ? 32.705 47.565 127.621 1.00 14.71 ? 339 ASN D C 1 +ATOM 12586 O O . ASN C 1 319 ? 31.725 48.325 127.623 1.00 14.35 ? 339 ASN D O 1 +ATOM 12587 C CB . ASN C 1 319 ? 34.120 49.480 128.479 1.00 14.59 ? 339 ASN D CB 1 +ATOM 12588 C CG . ASN C 1 319 ? 35.346 49.879 129.285 1.00 15.14 ? 339 ASN D CG 1 +ATOM 12589 O OD1 . ASN C 1 319 ? 35.884 49.060 130.025 1.00 17.38 ? 339 ASN D OD1 1 +ATOM 12590 N ND2 . ASN C 1 319 ? 35.789 51.132 129.147 1.00 15.89 ? 339 ASN D ND2 1 +ATOM 12591 N N . GLY C 1 320 ? 32.704 46.363 127.050 1.00 14.97 ? 340 GLY D N 1 +ATOM 12592 C CA . GLY C 1 320 ? 31.527 45.814 126.374 1.00 15.36 ? 340 GLY D CA 1 +ATOM 12593 C C . GLY C 1 320 ? 31.187 46.444 125.035 1.00 15.96 ? 340 GLY D C 1 +ATOM 12594 O O . GLY C 1 320 ? 30.101 46.212 124.500 1.00 15.72 ? 340 GLY D O 1 +ATOM 12595 N N . LYS C 1 321 ? 32.104 47.234 124.481 1.00 16.11 ? 341 LYS D N 1 +ATOM 12596 C CA . LYS C 1 321 ? 31.876 47.913 123.200 1.00 16.66 ? 341 LYS D CA 1 +ATOM 12597 C C . LYS C 1 321 ? 32.918 47.438 122.202 1.00 15.96 ? 341 LYS D C 1 +ATOM 12598 O O . LYS C 1 321 ? 34.088 47.282 122.580 1.00 15.23 ? 341 LYS D O 1 +ATOM 12599 C CB . LYS C 1 321 ? 31.984 49.430 123.364 1.00 16.75 ? 341 LYS D CB 1 +ATOM 12600 C CG . LYS C 1 321 ? 30.848 50.035 124.182 1.00 18.47 ? 341 LYS D CG 1 +ATOM 12601 C CD . LYS C 1 321 ? 30.944 51.557 124.275 1.00 19.24 ? 341 LYS D CD 1 +ATOM 12602 C CE . LYS C 1 321 ? 30.316 52.269 123.072 1.00 21.13 ? 341 LYS D CE 1 +ATOM 12603 N NZ . LYS C 1 321 ? 28.818 52.285 123.058 1.00 22.67 ? 341 LYS D NZ 1 +ATOM 12604 N N . PRO C 1 322 ? 32.505 47.191 120.940 1.00 15.59 ? 342 PRO D N 1 +ATOM 12605 C CA . PRO C 1 322 ? 33.488 46.721 119.967 1.00 14.88 ? 342 PRO D CA 1 +ATOM 12606 C C . PRO C 1 322 ? 34.637 47.718 119.788 1.00 14.47 ? 342 PRO D C 1 +ATOM 12607 O O . PRO C 1 322 ? 34.412 48.936 119.680 1.00 13.40 ? 342 PRO D O 1 +ATOM 12608 C CB . PRO C 1 322 ? 32.679 46.582 118.673 1.00 15.52 ? 342 PRO D CB 1 +ATOM 12609 C CG . PRO C 1 322 ? 31.251 46.432 119.123 1.00 15.72 ? 342 PRO D CG 1 +ATOM 12610 C CD . PRO C 1 322 ? 31.161 47.310 120.337 1.00 16.01 ? 342 PRO D CD 1 +ATOM 12611 N N . PHE C 1 323 ? 35.844 47.161 119.725 1.00 13.61 ? 343 PHE D N 1 +ATOM 12612 C CA . PHE C 1 323 ? 37.073 47.919 119.590 1.00 12.97 ? 343 PHE D CA 1 +ATOM 12613 C C . PHE C 1 323 ? 37.800 47.444 118.340 1.00 12.35 ? 343 PHE D C 1 +ATOM 12614 O O . PHE C 1 323 ? 37.758 46.266 118.002 1.00 13.00 ? 343 PHE D O 1 +ATOM 12615 C CB . PHE C 1 323 ? 37.957 47.702 120.818 1.00 12.82 ? 343 PHE D CB 1 +ATOM 12616 C CG . PHE C 1 323 ? 39.271 48.463 120.774 1.00 11.93 ? 343 PHE D CG 1 +ATOM 12617 C CD1 . PHE C 1 323 ? 39.289 49.835 120.922 1.00 11.76 ? 343 PHE D CD1 1 +ATOM 12618 C CD2 . PHE C 1 323 ? 40.472 47.802 120.611 1.00 12.83 ? 343 PHE D CD2 1 +ATOM 12619 C CE1 . PHE C 1 323 ? 40.474 50.541 120.892 1.00 11.17 ? 343 PHE D CE1 1 +ATOM 12620 C CE2 . PHE C 1 323 ? 41.666 48.499 120.582 1.00 11.70 ? 343 PHE D CE2 1 +ATOM 12621 C CZ . PHE C 1 323 ? 41.667 49.868 120.724 1.00 12.46 ? 343 PHE D CZ 1 +ATOM 12622 N N . TYR C 1 324 ? 38.443 48.384 117.658 1.00 11.18 ? 344 TYR D N 1 +ATOM 12623 C CA . TYR C 1 324 ? 39.285 48.093 116.507 1.00 11.04 ? 344 TYR D CA 1 +ATOM 12624 C C . TYR C 1 324 ? 40.659 48.702 116.747 1.00 10.46 ? 344 TYR D C 1 +ATOM 12625 O O . TYR C 1 324 ? 40.783 49.906 116.949 1.00 11.14 ? 344 TYR D O 1 +ATOM 12626 C CB . TYR C 1 324 ? 38.678 48.685 115.230 1.00 11.10 ? 344 TYR D CB 1 +ATOM 12627 C CG . TYR C 1 324 ? 39.378 48.236 113.967 1.00 11.08 ? 344 TYR D CG 1 +ATOM 12628 C CD1 . TYR C 1 324 ? 40.235 49.095 113.279 1.00 10.68 ? 344 TYR D CD1 1 +ATOM 12629 C CD2 . TYR C 1 324 ? 39.213 46.939 113.475 1.00 11.04 ? 344 TYR D CD2 1 +ATOM 12630 C CE1 . TYR C 1 324 ? 40.894 48.669 112.108 1.00 11.48 ? 344 TYR D CE1 1 +ATOM 12631 C CE2 . TYR C 1 324 ? 39.864 46.510 112.319 1.00 11.36 ? 344 TYR D CE2 1 +ATOM 12632 C CZ . TYR C 1 324 ? 40.704 47.382 111.643 1.00 11.67 ? 344 TYR D CZ 1 +ATOM 12633 O OH . TYR C 1 324 ? 41.357 46.952 110.501 1.00 10.60 ? 344 TYR D OH 1 +ATOM 12634 N N . PHE C 1 325 ? 41.686 47.860 116.716 1.00 10.32 ? 345 PHE D N 1 +ATOM 12635 C CA . PHE C 1 325 ? 43.059 48.336 116.820 1.00 10.09 ? 345 PHE D CA 1 +ATOM 12636 C C . PHE C 1 325 ? 43.417 49.024 115.522 1.00 9.71 ? 345 PHE D C 1 +ATOM 12637 O O . PHE C 1 325 ? 43.367 48.402 114.457 1.00 9.85 ? 345 PHE D O 1 +ATOM 12638 C CB . PHE C 1 325 ? 44.030 47.166 116.979 1.00 10.51 ? 345 PHE D CB 1 +ATOM 12639 C CG . PHE C 1 325 ? 43.923 46.439 118.289 1.00 11.26 ? 345 PHE D CG 1 +ATOM 12640 C CD1 . PHE C 1 325 ? 44.801 46.725 119.320 1.00 11.20 ? 345 PHE D CD1 1 +ATOM 12641 C CD2 . PHE C 1 325 ? 42.949 45.461 118.492 1.00 11.86 ? 345 PHE D CD2 1 +ATOM 12642 C CE1 . PHE C 1 325 ? 44.725 46.044 120.542 1.00 12.23 ? 345 PHE D CE1 1 +ATOM 12643 C CE2 . PHE C 1 325 ? 42.864 44.779 119.702 1.00 12.73 ? 345 PHE D CE2 1 +ATOM 12644 C CZ . PHE C 1 325 ? 43.747 45.081 120.734 1.00 11.87 ? 345 PHE D CZ 1 +ATOM 12645 N N . HIS C 1 326 ? 43.800 50.289 115.611 1.00 9.47 ? 346 HIS D N 1 +ATOM 12646 C CA . HIS C 1 326 ? 44.401 50.965 114.469 1.00 9.45 ? 346 HIS D CA 1 +ATOM 12647 C C . HIS C 1 326 ? 45.691 51.614 114.949 1.00 8.72 ? 346 HIS D C 1 +ATOM 12648 O O . HIS C 1 326 ? 45.687 52.722 115.466 1.00 8.45 ? 346 HIS D O 1 +ATOM 12649 C CB . HIS C 1 326 ? 43.428 51.921 113.735 1.00 9.63 ? 346 HIS D CB 1 +ATOM 12650 C CG . HIS C 1 326 ? 42.646 52.859 114.609 1.00 9.21 ? 346 HIS D CG 1 +ATOM 12651 N ND1 . HIS C 1 326 ? 43.183 54.016 115.129 1.00 10.74 ? 346 HIS D ND1 1 +ATOM 12652 C CD2 . HIS C 1 326 ? 41.341 52.855 114.975 1.00 9.44 ? 346 HIS D CD2 1 +ATOM 12653 C CE1 . HIS C 1 326 ? 42.247 54.679 115.790 1.00 11.06 ? 346 HIS D CE1 1 +ATOM 12654 N NE2 . HIS C 1 326 ? 41.120 53.992 115.715 1.00 10.76 ? 346 HIS D NE2 1 +ATOM 12655 N N . GLY C 1 327 ? 46.795 50.879 114.797 1.00 8.54 ? 347 GLY D N 1 +ATOM 12656 C CA . GLY C 1 327 ? 48.002 51.206 115.533 1.00 8.25 ? 347 GLY D CA 1 +ATOM 12657 C C . GLY C 1 327 ? 49.281 50.853 114.822 1.00 7.95 ? 347 GLY D C 1 +ATOM 12658 O O . GLY C 1 327 ? 49.330 50.781 113.592 1.00 7.77 ? 347 GLY D O 1 +ATOM 12659 N N . VAL C 1 328 ? 50.326 50.667 115.615 1.00 8.13 ? 348 VAL D N 1 +ATOM 12660 C CA . VAL C 1 328 ? 51.653 50.410 115.091 1.00 8.43 ? 348 VAL D CA 1 +ATOM 12661 C C . VAL C 1 328 ? 52.371 49.350 115.922 1.00 8.41 ? 348 VAL D C 1 +ATOM 12662 O O . VAL C 1 328 ? 51.913 48.963 117.005 1.00 8.13 ? 348 VAL D O 1 +ATOM 12663 C CB . VAL C 1 328 ? 52.483 51.709 115.106 1.00 8.27 ? 348 VAL D CB 1 +ATOM 12664 C CG1 . VAL C 1 328 ? 51.755 52.841 114.359 1.00 9.42 ? 348 VAL D CG1 1 +ATOM 12665 C CG2 . VAL C 1 328 ? 52.753 52.134 116.533 1.00 9.08 ? 348 VAL D CG2 1 +ATOM 12666 N N . ASN C 1 329 ? 53.462 48.856 115.363 1.00 7.76 ? 349 ASN D N 1 +ATOM 12667 C CA . ASN C 1 329 ? 54.497 48.123 116.081 1.00 8.11 ? 349 ASN D CA 1 +ATOM 12668 C C . ASN C 1 329 ? 55.615 49.126 116.304 1.00 8.27 ? 349 ASN D C 1 +ATOM 12669 O O . ASN C 1 329 ? 55.798 50.032 115.489 1.00 7.70 ? 349 ASN D O 1 +ATOM 12670 C CB . ASN C 1 329 ? 54.998 46.979 115.217 1.00 8.07 ? 349 ASN D CB 1 +ATOM 12671 C CG . ASN C 1 329 ? 53.945 45.937 114.983 1.00 7.51 ? 349 ASN D CG 1 +ATOM 12672 O OD1 . ASN C 1 329 ? 53.723 45.068 115.842 1.00 8.51 ? 349 ASN D OD1 1 +ATOM 12673 N ND2 . ASN C 1 329 ? 53.278 46.005 113.829 1.00 7.35 ? 349 ASN D ND2 1 +ATOM 12674 N N . LYS C 1 330 ? 56.341 48.991 117.411 1.00 8.41 ? 350 LYS D N 1 +ATOM 12675 C CA . LYS C 1 330 ? 57.460 49.911 117.711 1.00 8.34 ? 350 LYS D CA 1 +ATOM 12676 C C . LYS C 1 330 ? 58.733 49.124 117.993 1.00 8.16 ? 350 LYS D C 1 +ATOM 12677 O O . LYS C 1 330 ? 58.804 47.925 117.746 1.00 8.27 ? 350 LYS D O 1 +ATOM 12678 C CB . LYS C 1 330 ? 57.108 50.811 118.908 1.00 8.72 ? 350 LYS D CB 1 +ATOM 12679 C CG . LYS C 1 330 ? 55.997 51.825 118.638 1.00 8.23 ? 350 LYS D CG 1 +ATOM 12680 C CD . LYS C 1 330 ? 55.739 52.731 119.828 1.00 8.73 ? 350 LYS D CD 1 +ATOM 12681 C CE . LYS C 1 330 ? 56.461 54.079 119.719 1.00 11.23 ? 350 LYS D CE 1 +ATOM 12682 N NZ . LYS C 1 330 ? 57.939 54.006 119.754 1.00 11.02 ? 350 LYS D NZ 1 +ATOM 12683 N N . HIS C 1 331 ? 59.755 49.823 118.461 1.00 7.20 ? 351 HIS D N 1 +ATOM 12684 C CA . HIS C 1 331 ? 60.941 49.180 119.011 1.00 7.53 ? 351 HIS D CA 1 +ATOM 12685 C C . HIS C 1 331 ? 61.556 50.201 119.955 1.00 7.77 ? 351 HIS D C 1 +ATOM 12686 O O . HIS C 1 331 ? 61.321 51.426 119.818 1.00 7.93 ? 351 HIS D O 1 +ATOM 12687 C CB . HIS C 1 331 ? 61.952 48.800 117.913 1.00 7.45 ? 351 HIS D CB 1 +ATOM 12688 C CG . HIS C 1 331 ? 61.940 47.346 117.497 1.00 7.33 ? 351 HIS D CG 1 +ATOM 12689 N ND1 . HIS C 1 331 ? 62.235 46.308 118.358 1.00 7.51 ? 351 HIS D ND1 1 +ATOM 12690 C CD2 . HIS C 1 331 ? 61.737 46.774 116.287 1.00 6.94 ? 351 HIS D CD2 1 +ATOM 12691 C CE1 . HIS C 1 331 ? 62.195 45.160 117.700 1.00 7.17 ? 351 HIS D CE1 1 +ATOM 12692 N NE2 . HIS C 1 331 ? 61.878 45.411 116.443 1.00 8.30 ? 351 HIS D NE2 1 +ATOM 12693 N N . GLU C 1 332 ? 62.334 49.711 120.917 1.00 8.20 ? 352 GLU D N 1 +ATOM 12694 C CA . GLU C 1 332 ? 63.144 50.589 121.735 1.00 8.03 ? 352 GLU D CA 1 +ATOM 12695 C C . GLU C 1 332 ? 64.461 50.786 121.005 1.00 7.91 ? 352 GLU D C 1 +ATOM 12696 O O . GLU C 1 332 ? 65.342 49.931 121.035 1.00 7.48 ? 352 GLU D O 1 +ATOM 12697 C CB . GLU C 1 332 ? 63.345 50.027 123.146 1.00 8.52 ? 352 GLU D CB 1 +ATOM 12698 C CG . GLU C 1 332 ? 62.094 50.142 124.005 1.00 8.56 ? 352 GLU D CG 1 +ATOM 12699 C CD . GLU C 1 332 ? 62.338 49.732 125.439 1.00 11.20 ? 352 GLU D CD 1 +ATOM 12700 O OE1 . GLU C 1 332 ? 63.003 48.703 125.635 1.00 11.52 ? 352 GLU D OE1 1 +ATOM 12701 O OE2 . GLU C 1 332 ? 61.860 50.425 126.358 1.00 13.69 ? 352 GLU D OE2 1 +ATOM 12702 N N . ASP C 1 333 ? 64.568 51.923 120.323 1.00 7.50 ? 353 ASP D N 1 +ATOM 12703 C CA . ASP C 1 333 ? 65.639 52.130 119.357 1.00 7.27 ? 353 ASP D CA 1 +ATOM 12704 C C . ASP C 1 333 ? 65.718 53.595 118.940 1.00 7.46 ? 353 ASP D C 1 +ATOM 12705 O O . ASP C 1 333 ? 64.717 54.205 118.553 1.00 7.67 ? 353 ASP D O 1 +ATOM 12706 C CB . ASP C 1 333 ? 65.391 51.248 118.130 1.00 7.52 ? 353 ASP D CB 1 +ATOM 12707 C CG . ASP C 1 333 ? 66.319 51.550 116.994 1.00 8.03 ? 353 ASP D CG 1 +ATOM 12708 O OD1 . ASP C 1 333 ? 66.088 52.571 116.299 1.00 8.87 ? 353 ASP D OD1 1 +ATOM 12709 O OD2 . ASP C 1 333 ? 67.273 50.776 116.811 1.00 4.21 ? 353 ASP D OD2 1 +ATOM 12710 N N . ALA C 1 334 ? 66.922 54.131 118.969 1.00 6.77 ? 354 ALA D N 1 +ATOM 12711 C CA . ALA C 1 334 ? 67.171 55.477 118.509 1.00 6.85 ? 354 ALA D CA 1 +ATOM 12712 C C . ALA C 1 334 ? 68.656 55.643 118.246 1.00 6.93 ? 354 ALA D C 1 +ATOM 12713 O O . ALA C 1 334 ? 69.470 54.804 118.655 1.00 6.58 ? 354 ALA D O 1 +ATOM 12714 C CB . ALA C 1 334 ? 66.687 56.489 119.542 1.00 6.84 ? 354 ALA D CB 1 +ATOM 12715 N N . ASP C 1 335 ? 69.001 56.722 117.542 1.00 7.91 ? 355 ASP D N 1 +ATOM 12716 C CA . ASP C 1 335 ? 70.408 57.003 117.220 1.00 7.61 ? 355 ASP D CA 1 +ATOM 12717 C C . ASP C 1 335 ? 71.257 57.064 118.485 1.00 7.65 ? 355 ASP D C 1 +ATOM 12718 O O . ASP C 1 335 ? 70.839 57.609 119.505 1.00 7.12 ? 355 ASP D O 1 +ATOM 12719 C CB . ASP C 1 335 ? 70.540 58.311 116.432 1.00 8.39 ? 355 ASP D CB 1 +ATOM 12720 C CG . ASP C 1 335 ? 69.976 58.220 115.019 1.00 9.01 ? 355 ASP D CG 1 +ATOM 12721 O OD1 . ASP C 1 335 ? 69.988 57.122 114.384 1.00 6.55 ? 355 ASP D OD1 1 +ATOM 12722 O OD2 . ASP C 1 335 ? 69.519 59.279 114.534 1.00 8.50 ? 355 ASP D OD2 1 +ATOM 12723 N N . ILE C 1 336 ? 72.436 56.453 118.404 1.00 7.87 ? 356 ILE D N 1 +ATOM 12724 C CA . ILE C 1 336 ? 73.490 56.557 119.419 1.00 8.14 ? 356 ILE D CA 1 +ATOM 12725 C C . ILE C 1 336 ? 73.254 55.827 120.754 1.00 7.36 ? 356 ILE D C 1 +ATOM 12726 O O . ILE C 1 336 ? 74.147 55.132 121.234 1.00 8.06 ? 356 ILE D O 1 +ATOM 12727 C CB . ILE C 1 336 ? 73.873 58.018 119.673 1.00 8.93 ? 356 ILE D CB 1 +ATOM 12728 C CG1 . ILE C 1 336 ? 74.381 58.653 118.362 1.00 9.51 ? 356 ILE D CG1 1 +ATOM 12729 C CG2 . ILE C 1 336 ? 74.955 58.114 120.724 1.00 10.21 ? 356 ILE D CG2 1 +ATOM 12730 C CD1 . ILE C 1 336 ? 75.370 57.761 117.590 1.00 12.89 ? 356 ILE D CD1 1 +ATOM 12731 N N . ARG C 1 337 ? 72.077 55.990 121.350 1.00 6.77 ? 357 ARG D N 1 +ATOM 12732 C CA . ARG C 1 337 ? 71.766 55.363 122.626 1.00 7.11 ? 357 ARG D CA 1 +ATOM 12733 C C . ARG C 1 337 ? 71.247 53.920 122.466 1.00 7.25 ? 357 ARG D C 1 +ATOM 12734 O O . ARG C 1 337 ? 71.055 53.206 123.459 1.00 7.49 ? 357 ARG D O 1 +ATOM 12735 C CB . ARG C 1 337 ? 70.746 56.233 123.385 1.00 6.54 ? 357 ARG D CB 1 +ATOM 12736 C CG . ARG C 1 337 ? 69.325 56.077 122.900 1.00 7.95 ? 357 ARG D CG 1 +ATOM 12737 C CD . ARG C 1 337 ? 68.414 57.190 123.347 1.00 6.38 ? 357 ARG D CD 1 +ATOM 12738 N NE . ARG C 1 337 ? 68.920 58.476 122.872 1.00 8.01 ? 357 ARG D NE 1 +ATOM 12739 C CZ . ARG C 1 337 ? 69.499 59.413 123.628 1.00 8.59 ? 357 ARG D CZ 1 +ATOM 12740 N NH1 . ARG C 1 337 ? 69.644 59.274 124.947 1.00 8.92 ? 357 ARG D NH1 1 +ATOM 12741 N NH2 . ARG C 1 337 ? 69.933 60.515 123.044 1.00 7.98 ? 357 ARG D NH2 1 +ATOM 12742 N N . GLY C 1 338 ? 70.985 53.488 121.231 1.00 7.16 ? 358 GLY D N 1 +ATOM 12743 C CA . GLY C 1 338 ? 70.442 52.156 121.005 1.00 6.88 ? 358 GLY D CA 1 +ATOM 12744 C C . GLY C 1 338 ? 69.056 51.966 121.614 1.00 6.70 ? 358 GLY D C 1 +ATOM 12745 O O . GLY C 1 338 ? 68.106 52.653 121.238 1.00 6.69 ? 358 GLY D O 1 +ATOM 12746 N N . LYS C 1 339 ? 68.950 51.044 122.576 1.00 5.72 ? 359 LYS D N 1 +ATOM 12747 C CA . LYS C 1 339 ? 67.680 50.748 123.233 1.00 7.10 ? 359 LYS D CA 1 +ATOM 12748 C C . LYS C 1 339 ? 67.556 51.543 124.535 1.00 7.70 ? 359 LYS D C 1 +ATOM 12749 O O . LYS C 1 339 ? 66.606 51.352 125.303 1.00 9.14 ? 359 LYS D O 1 +ATOM 12750 C CB . LYS C 1 339 ? 67.550 49.239 123.512 1.00 6.67 ? 359 LYS D CB 1 +ATOM 12751 C CG . LYS C 1 339 ? 67.907 48.351 122.323 1.00 7.13 ? 359 LYS D CG 1 +ATOM 12752 C CD . LYS C 1 339 ? 67.565 46.869 122.524 1.00 7.79 ? 359 LYS D CD 1 +ATOM 12753 C CE . LYS C 1 339 ? 66.090 46.590 122.287 1.00 8.93 ? 359 LYS D CE 1 +ATOM 12754 N NZ . LYS C 1 339 ? 65.589 47.130 120.983 1.00 9.41 ? 359 LYS D NZ 1 +ATOM 12755 N N . GLY C 1 340 ? 68.494 52.455 124.763 1.00 7.52 ? 360 GLY D N 1 +ATOM 12756 C CA . GLY C 1 340 ? 68.525 53.249 125.988 1.00 7.24 ? 360 GLY D CA 1 +ATOM 12757 C C . GLY C 1 340 ? 67.300 54.128 126.155 1.00 7.49 ? 360 GLY D C 1 +ATOM 12758 O O . GLY C 1 340 ? 66.811 54.719 125.191 1.00 7.46 ? 360 GLY D O 1 +ATOM 12759 N N . PHE C 1 341 ? 66.796 54.200 127.380 1.00 8.32 ? 361 PHE D N 1 +ATOM 12760 C CA . PHE C 1 341 ? 65.654 55.035 127.704 1.00 8.85 ? 361 PHE D CA 1 +ATOM 12761 C C . PHE C 1 341 ? 65.985 56.531 127.595 1.00 9.12 ? 361 PHE D C 1 +ATOM 12762 O O . PHE C 1 341 ? 67.076 56.954 127.963 1.00 9.09 ? 361 PHE D O 1 +ATOM 12763 C CB . PHE C 1 341 ? 65.168 54.720 129.114 1.00 9.31 ? 361 PHE D CB 1 +ATOM 12764 C CG . PHE C 1 341 ? 64.009 55.545 129.535 1.00 9.42 ? 361 PHE D CG 1 +ATOM 12765 C CD1 . PHE C 1 341 ? 62.740 55.250 129.077 1.00 9.73 ? 361 PHE D CD1 1 +ATOM 12766 C CD2 . PHE C 1 341 ? 64.194 56.642 130.363 1.00 10.38 ? 361 PHE D CD2 1 +ATOM 12767 C CE1 . PHE C 1 341 ? 61.665 56.021 129.452 1.00 9.90 ? 361 PHE D CE1 1 +ATOM 12768 C CE2 . PHE C 1 341 ? 63.132 57.405 130.751 1.00 10.19 ? 361 PHE D CE2 1 +ATOM 12769 C CZ . PHE C 1 341 ? 61.861 57.101 130.284 1.00 10.70 ? 361 PHE D CZ 1 +ATOM 12770 N N . ASP C 1 342 ? 65.030 57.314 127.106 1.00 8.48 ? 362 ASP D N 1 +ATOM 12771 C CA . ASP C 1 342 ? 65.217 58.768 126.908 1.00 8.19 ? 362 ASP D CA 1 +ATOM 12772 C C . ASP C 1 342 ? 63.888 59.485 127.019 1.00 7.51 ? 362 ASP D C 1 +ATOM 12773 O O . ASP C 1 342 ? 62.945 59.143 126.316 1.00 8.44 ? 362 ASP D O 1 +ATOM 12774 C CB . ASP C 1 342 ? 65.830 59.049 125.524 1.00 7.70 ? 362 ASP D CB 1 +ATOM 12775 C CG . ASP C 1 342 ? 66.019 60.546 125.242 1.00 9.60 ? 362 ASP D CG 1 +ATOM 12776 O OD1 . ASP C 1 342 ? 66.876 61.185 125.895 1.00 8.19 ? 362 ASP D OD1 1 +ATOM 12777 O OD2 . ASP C 1 342 ? 65.334 61.077 124.340 1.00 8.52 ? 362 ASP D OD2 1 +ATOM 12778 N N . TRP C 1 343 ? 63.817 60.498 127.882 1.00 8.27 ? 363 TRP D N 1 +ATOM 12779 C CA . TRP C 1 343 ? 62.555 61.209 128.076 1.00 8.62 ? 363 TRP D CA 1 +ATOM 12780 C C . TRP C 1 343 ? 62.062 61.986 126.845 1.00 8.42 ? 363 TRP D C 1 +ATOM 12781 O O . TRP C 1 343 ? 60.867 61.890 126.485 1.00 7.51 ? 363 TRP D O 1 +ATOM 12782 C CB . TRP C 1 343 ? 62.641 62.134 129.299 1.00 9.58 ? 363 TRP D CB 1 +ATOM 12783 C CG . TRP C 1 343 ? 62.602 61.406 130.584 1.00 10.14 ? 363 TRP D CG 1 +ATOM 12784 C CD1 . TRP C 1 343 ? 63.616 61.274 131.464 1.00 10.90 ? 363 TRP D CD1 1 +ATOM 12785 C CD2 . TRP C 1 343 ? 61.480 60.720 131.147 1.00 9.12 ? 363 TRP D CD2 1 +ATOM 12786 N NE1 . TRP C 1 343 ? 63.206 60.550 132.560 1.00 12.49 ? 363 TRP D NE1 1 +ATOM 12787 C CE2 . TRP C 1 343 ? 61.894 60.203 132.391 1.00 11.53 ? 363 TRP D CE2 1 +ATOM 12788 C CE3 . TRP C 1 343 ? 60.167 60.504 130.729 1.00 11.60 ? 363 TRP D CE3 1 +ATOM 12789 C CZ2 . TRP C 1 343 ? 61.043 59.476 133.217 1.00 10.93 ? 363 TRP D CZ2 1 +ATOM 12790 C CZ3 . TRP C 1 343 ? 59.309 59.781 131.561 1.00 11.52 ? 363 TRP D CZ3 1 +ATOM 12791 C CH2 . TRP C 1 343 ? 59.758 59.283 132.788 1.00 10.79 ? 363 TRP D CH2 1 +ATOM 12792 N N . PRO C 1 344 ? 62.936 62.792 126.214 1.00 8.77 ? 364 PRO D N 1 +ATOM 12793 C CA . PRO C 1 344 ? 62.456 63.503 125.025 1.00 8.79 ? 364 PRO D CA 1 +ATOM 12794 C C . PRO C 1 344 ? 61.933 62.587 123.915 1.00 8.77 ? 364 PRO D C 1 +ATOM 12795 O O . PRO C 1 344 ? 60.861 62.856 123.373 1.00 8.36 ? 364 PRO D O 1 +ATOM 12796 C CB . PRO C 1 344 ? 63.682 64.297 124.571 1.00 9.00 ? 364 PRO D CB 1 +ATOM 12797 C CG . PRO C 1 344 ? 64.426 64.521 125.820 1.00 8.81 ? 364 PRO D CG 1 +ATOM 12798 C CD . PRO C 1 344 ? 64.311 63.201 126.543 1.00 8.75 ? 364 PRO D CD 1 +ATOM 12799 N N . LEU C 1 345 ? 62.659 61.518 123.586 1.00 8.59 ? 365 LEU D N 1 +ATOM 12800 C CA . LEU C 1 345 ? 62.167 60.557 122.592 1.00 9.62 ? 365 LEU D CA 1 +ATOM 12801 C C . LEU C 1 345 ? 60.837 59.925 122.997 1.00 9.54 ? 365 LEU D C 1 +ATOM 12802 O O . LEU C 1 345 ? 59.968 59.684 122.140 1.00 9.76 ? 365 LEU D O 1 +ATOM 12803 C CB . LEU C 1 345 ? 63.196 59.471 122.318 1.00 10.05 ? 365 LEU D CB 1 +ATOM 12804 C CG . LEU C 1 345 ? 64.339 59.939 121.423 1.00 11.95 ? 365 LEU D CG 1 +ATOM 12805 C CD1 . LEU C 1 345 ? 65.633 59.224 121.788 1.00 12.74 ? 365 LEU D CD1 1 +ATOM 12806 C CD2 . LEU C 1 345 ? 63.988 59.737 119.952 1.00 16.03 ? 365 LEU D CD2 1 +ATOM 12807 N N . LEU C 1 346 ? 60.685 59.643 124.289 1.00 8.87 ? 366 LEU D N 1 +ATOM 12808 C CA . LEU C 1 346 ? 59.440 59.059 124.789 1.00 9.51 ? 366 LEU D CA 1 +ATOM 12809 C C . LEU C 1 346 ? 58.262 59.981 124.537 1.00 8.78 ? 366 LEU D C 1 +ATOM 12810 O O . LEU C 1 346 ? 57.269 59.575 123.936 1.00 8.72 ? 366 LEU D O 1 +ATOM 12811 C CB . LEU C 1 346 ? 59.531 58.737 126.278 1.00 9.68 ? 366 LEU D CB 1 +ATOM 12812 C CG . LEU C 1 346 ? 58.258 58.121 126.873 1.00 11.55 ? 366 LEU D CG 1 +ATOM 12813 C CD1 . LEU C 1 346 ? 57.967 56.777 126.263 1.00 14.20 ? 366 LEU D CD1 1 +ATOM 12814 C CD2 . LEU C 1 346 ? 58.401 58.023 128.394 1.00 15.69 ? 366 LEU D CD2 1 +ATOM 12815 N N . VAL C 1 347 ? 58.372 61.232 124.974 1.00 9.74 ? 367 VAL D N 1 +ATOM 12816 C CA . VAL C 1 347 ? 57.261 62.178 124.799 1.00 8.82 ? 367 VAL D CA 1 +ATOM 12817 C C . VAL C 1 347 ? 57.011 62.427 123.314 1.00 8.38 ? 367 VAL D C 1 +ATOM 12818 O O . VAL C 1 347 ? 55.875 62.444 122.865 1.00 8.25 ? 367 VAL D O 1 +ATOM 12819 C CB . VAL C 1 347 ? 57.496 63.507 125.550 1.00 9.87 ? 367 VAL D CB 1 +ATOM 12820 C CG1 . VAL C 1 347 ? 56.337 64.470 125.316 1.00 8.59 ? 367 VAL D CG1 1 +ATOM 12821 C CG2 . VAL C 1 347 ? 57.657 63.250 127.051 1.00 9.45 ? 367 VAL D CG2 1 +ATOM 12822 N N . LYS C 1 348 ? 58.075 62.572 122.539 1.00 7.58 ? 368 LYS D N 1 +ATOM 12823 C CA . LYS C 1 348 ? 57.934 62.779 121.098 1.00 7.67 ? 368 LYS D CA 1 +ATOM 12824 C C . LYS C 1 348 ? 57.168 61.636 120.478 1.00 6.89 ? 368 LYS D C 1 +ATOM 12825 O O . LYS C 1 348 ? 56.227 61.843 119.683 1.00 6.56 ? 368 LYS D O 1 +ATOM 12826 C CB . LYS C 1 348 ? 59.317 62.888 120.437 1.00 6.86 ? 368 LYS D CB 1 +ATOM 12827 C CG . LYS C 1 348 ? 59.300 63.166 118.945 1.00 8.37 ? 368 LYS D CG 1 +ATOM 12828 C CD . LYS C 1 348 ? 58.487 64.398 118.561 1.00 9.18 ? 368 LYS D CD 1 +ATOM 12829 C CE . LYS C 1 348 ? 58.714 64.810 117.118 1.00 9.97 ? 368 LYS D CE 1 +ATOM 12830 N NZ . LYS C 1 348 ? 58.136 66.166 116.798 1.00 7.98 ? 368 LYS D NZ 1 +ATOM 12831 N N . ASP C 1 349 ? 57.515 60.408 120.852 1.00 7.76 ? 369 ASP D N 1 +ATOM 12832 C CA . ASP C 1 349 ? 56.839 59.284 120.245 1.00 7.03 ? 369 ASP D CA 1 +ATOM 12833 C C . ASP C 1 349 ? 55.356 59.318 120.550 1.00 6.95 ? 369 ASP D C 1 +ATOM 12834 O O . ASP C 1 349 ? 54.547 59.103 119.658 1.00 7.47 ? 369 ASP D O 1 +ATOM 12835 C CB . ASP C 1 349 ? 57.449 57.937 120.642 1.00 7.71 ? 369 ASP D CB 1 +ATOM 12836 C CG . ASP C 1 349 ? 58.726 57.650 119.898 1.00 8.78 ? 369 ASP D CG 1 +ATOM 12837 O OD1 . ASP C 1 349 ? 59.213 58.541 119.153 1.00 7.27 ? 369 ASP D OD1 1 +ATOM 12838 O OD2 . ASP C 1 349 ? 59.251 56.516 120.052 1.00 10.90 ? 369 ASP D OD2 1 +ATOM 12839 N N . PHE C 1 350 ? 54.993 59.601 121.794 1.00 6.58 ? 370 PHE D N 1 +ATOM 12840 C CA . PHE C 1 350 ? 53.564 59.691 122.133 1.00 7.56 ? 370 PHE D CA 1 +ATOM 12841 C C . PHE C 1 350 ? 52.834 60.829 121.424 1.00 7.62 ? 370 PHE D C 1 +ATOM 12842 O O . PHE C 1 350 ? 51.677 60.657 120.993 1.00 8.67 ? 370 PHE D O 1 +ATOM 12843 C CB . PHE C 1 350 ? 53.368 59.690 123.644 1.00 7.09 ? 370 PHE D CB 1 +ATOM 12844 C CG . PHE C 1 350 ? 53.362 58.305 124.203 1.00 7.34 ? 370 PHE D CG 1 +ATOM 12845 C CD1 . PHE C 1 350 ? 52.191 57.595 124.290 1.00 7.81 ? 370 PHE D CD1 1 +ATOM 12846 C CD2 . PHE C 1 350 ? 54.552 57.666 124.525 1.00 7.34 ? 370 PHE D CD2 1 +ATOM 12847 C CE1 . PHE C 1 350 ? 52.190 56.279 124.753 1.00 6.12 ? 370 PHE D CE1 1 +ATOM 12848 C CE2 . PHE C 1 350 ? 54.549 56.349 124.987 1.00 7.56 ? 370 PHE D CE2 1 +ATOM 12849 C CZ . PHE C 1 350 ? 53.370 55.674 125.103 1.00 6.21 ? 370 PHE D CZ 1 +ATOM 12850 N N . ASN C 1 351 ? 53.494 61.961 121.263 1.00 8.65 ? 371 ASN D N 1 +ATOM 12851 C CA . ASN C 1 351 ? 52.929 63.025 120.437 1.00 8.03 ? 371 ASN D CA 1 +ATOM 12852 C C . ASN C 1 351 ? 52.681 62.587 118.989 1.00 7.91 ? 371 ASN D C 1 +ATOM 12853 O O . ASN C 1 351 ? 51.628 62.889 118.407 1.00 7.96 ? 371 ASN D O 1 +ATOM 12854 C CB . ASN C 1 351 ? 53.757 64.313 120.549 1.00 8.73 ? 371 ASN D CB 1 +ATOM 12855 C CG . ASN C 1 351 ? 53.600 64.967 121.900 1.00 9.07 ? 371 ASN D CG 1 +ATOM 12856 O OD1 . ASN C 1 351 ? 52.565 64.801 122.560 1.00 10.20 ? 371 ASN D OD1 1 +ATOM 12857 N ND2 . ASN C 1 351 ? 54.615 65.706 122.330 1.00 7.23 ? 371 ASN D ND2 1 +ATOM 12858 N N . LEU C 1 352 ? 53.615 61.833 118.426 1.00 7.86 ? 372 LEU D N 1 +ATOM 12859 C CA . LEU C 1 352 ? 53.428 61.267 117.100 1.00 7.10 ? 372 LEU D CA 1 +ATOM 12860 C C . LEU C 1 352 ? 52.289 60.234 117.051 1.00 7.71 ? 372 LEU D C 1 +ATOM 12861 O O . LEU C 1 352 ? 51.521 60.209 116.089 1.00 8.15 ? 372 LEU D O 1 +ATOM 12862 C CB . LEU C 1 352 ? 54.741 60.674 116.595 1.00 7.45 ? 372 LEU D CB 1 +ATOM 12863 C CG . LEU C 1 352 ? 55.809 61.708 116.248 1.00 7.22 ? 372 LEU D CG 1 +ATOM 12864 C CD1 . LEU C 1 352 ? 57.160 61.079 115.983 1.00 6.57 ? 372 LEU D CD1 1 +ATOM 12865 C CD2 . LEU C 1 352 ? 55.378 62.552 115.030 1.00 7.24 ? 372 LEU D CD2 1 +ATOM 12866 N N . LEU C 1 353 ? 52.185 59.371 118.064 1.00 7.74 ? 373 LEU D N 1 +ATOM 12867 C CA . LEU C 1 353 ? 51.102 58.375 118.096 1.00 8.24 ? 373 LEU D CA 1 +ATOM 12868 C C . LEU C 1 353 ? 49.751 59.074 118.059 1.00 9.49 ? 373 LEU D C 1 +ATOM 12869 O O . LEU C 1 353 ? 48.859 58.686 117.289 1.00 9.07 ? 373 LEU D O 1 +ATOM 12870 C CB . LEU C 1 353 ? 51.217 57.463 119.326 1.00 8.52 ? 373 LEU D CB 1 +ATOM 12871 C CG . LEU C 1 353 ? 52.351 56.431 119.309 1.00 9.11 ? 373 LEU D CG 1 +ATOM 12872 C CD1 . LEU C 1 353 ? 52.467 55.778 120.686 1.00 10.38 ? 373 LEU D CD1 1 +ATOM 12873 C CD2 . LEU C 1 353 ? 52.201 55.350 118.246 1.00 8.72 ? 373 LEU D CD2 1 +ATOM 12874 N N . ARG C 1 354 ? 49.606 60.137 118.847 1.00 9.49 ? 374 ARG D N 1 +ATOM 12875 C CA . ARG C 1 354 ? 48.320 60.855 118.897 1.00 10.40 ? 374 ARG D CA 1 +ATOM 12876 C C . ARG C 1 354 ? 48.041 61.623 117.594 1.00 10.54 ? 374 ARG D C 1 +ATOM 12877 O O . ARG C 1 354 ? 46.915 61.655 117.111 1.00 10.15 ? 374 ARG D O 1 +ATOM 12878 C CB . ARG C 1 354 ? 48.233 61.758 120.130 1.00 11.01 ? 374 ARG D CB 1 +ATOM 12879 C CG . ARG C 1 354 ? 48.175 60.959 121.430 1.00 12.90 ? 374 ARG D CG 1 +ATOM 12880 C CD . ARG C 1 354 ? 47.469 61.688 122.556 1.00 17.32 ? 374 ARG D CD 1 +ATOM 12881 N NE . ARG C 1 354 ? 48.214 62.872 122.983 1.00 19.73 ? 374 ARG D NE 1 +ATOM 12882 C CZ . ARG C 1 354 ? 47.887 63.630 124.030 1.00 20.88 ? 374 ARG D CZ 1 +ATOM 12883 N NH1 . ARG C 1 354 ? 48.623 64.688 124.332 1.00 21.01 ? 374 ARG D NH1 1 +ATOM 12884 N NH2 . ARG C 1 354 ? 46.831 63.336 124.783 1.00 22.85 ? 374 ARG D NH2 1 +ATOM 12885 N N . TRP C 1 355 ? 49.091 62.179 117.011 1.00 9.91 ? 375 TRP D N 1 +ATOM 12886 C CA . TRP C 1 355 ? 49.023 62.869 115.716 1.00 10.08 ? 375 TRP D CA 1 +ATOM 12887 C C . TRP C 1 355 ? 48.563 61.899 114.637 1.00 9.67 ? 375 TRP D C 1 +ATOM 12888 O O . TRP C 1 355 ? 47.674 62.202 113.858 1.00 8.28 ? 375 TRP D O 1 +ATOM 12889 C CB . TRP C 1 355 ? 50.406 63.464 115.393 1.00 10.78 ? 375 TRP D CB 1 +ATOM 12890 C CG . TRP C 1 355 ? 50.553 64.095 114.022 1.00 10.04 ? 375 TRP D CG 1 +ATOM 12891 C CD1 . TRP C 1 355 ? 50.195 65.351 113.655 1.00 11.81 ? 375 TRP D CD1 1 +ATOM 12892 C CD2 . TRP C 1 355 ? 51.128 63.487 112.865 1.00 10.71 ? 375 TRP D CD2 1 +ATOM 12893 N NE1 . TRP C 1 355 ? 50.491 65.566 112.330 1.00 11.30 ? 375 TRP D NE1 1 +ATOM 12894 C CE2 . TRP C 1 355 ? 51.060 64.427 111.820 1.00 11.92 ? 375 TRP D CE2 1 +ATOM 12895 C CE3 . TRP C 1 355 ? 51.676 62.225 112.605 1.00 11.66 ? 375 TRP D CE3 1 +ATOM 12896 C CZ2 . TRP C 1 355 ? 51.539 64.150 110.529 1.00 12.15 ? 375 TRP D CZ2 1 +ATOM 12897 C CZ3 . TRP C 1 355 ? 52.128 61.942 111.322 1.00 11.94 ? 375 TRP D CZ3 1 +ATOM 12898 C CH2 . TRP C 1 355 ? 52.069 62.909 110.304 1.00 11.21 ? 375 TRP D CH2 1 +ATOM 12899 N N . LEU C 1 356 ? 49.135 60.696 114.656 1.00 9.05 ? 376 LEU D N 1 +ATOM 12900 C CA . LEU C 1 356 ? 48.854 59.650 113.667 1.00 9.10 ? 376 LEU D CA 1 +ATOM 12901 C C . LEU C 1 356 ? 47.402 59.134 113.746 1.00 8.87 ? 376 LEU D C 1 +ATOM 12902 O O . LEU C 1 356 ? 46.877 58.562 112.789 1.00 9.94 ? 376 LEU D O 1 +ATOM 12903 C CB . LEU C 1 356 ? 49.842 58.503 113.892 1.00 9.33 ? 376 LEU D CB 1 +ATOM 12904 C CG . LEU C 1 356 ? 49.894 57.324 112.917 1.00 9.13 ? 376 LEU D CG 1 +ATOM 12905 C CD1 . LEU C 1 356 ? 50.356 57.819 111.536 1.00 11.10 ? 376 LEU D CD1 1 +ATOM 12906 C CD2 . LEU C 1 356 ? 50.834 56.185 113.452 1.00 10.68 ? 376 LEU D CD2 1 +ATOM 12907 N N . GLY C 1 357 ? 46.760 59.308 114.891 1.00 8.53 ? 377 GLY D N 1 +ATOM 12908 C CA . GLY C 1 357 ? 45.467 58.670 115.120 1.00 8.64 ? 377 GLY D CA 1 +ATOM 12909 C C . GLY C 1 357 ? 45.618 57.215 115.565 1.00 8.86 ? 377 GLY D C 1 +ATOM 12910 O O . GLY C 1 357 ? 44.660 56.426 115.528 1.00 9.51 ? 377 GLY D O 1 +ATOM 12911 N N . ALA C 1 358 ? 46.824 56.840 115.991 1.00 8.40 ? 378 ALA D N 1 +ATOM 12912 C CA . ALA C 1 358 ? 47.054 55.496 116.489 1.00 8.63 ? 378 ALA D CA 1 +ATOM 12913 C C . ALA C 1 358 ? 46.459 55.362 117.890 1.00 9.06 ? 378 ALA D C 1 +ATOM 12914 O O . ALA C 1 358 ? 46.669 56.231 118.757 1.00 9.77 ? 378 ALA D O 1 +ATOM 12915 C CB . ALA C 1 358 ? 48.557 55.179 116.509 1.00 9.03 ? 378 ALA D CB 1 +ATOM 12916 N N . ASN C 1 359 ? 45.701 54.290 118.104 1.00 8.86 ? 379 ASN D N 1 +ATOM 12917 C CA . ASN C 1 359 ? 45.158 53.999 119.438 1.00 8.94 ? 379 ASN D CA 1 +ATOM 12918 C C . ASN C 1 359 ? 45.790 52.804 120.145 1.00 8.95 ? 379 ASN D C 1 +ATOM 12919 O O . ASN C 1 359 ? 45.315 52.395 121.211 1.00 8.63 ? 379 ASN D O 1 +ATOM 12920 C CB . ASN C 1 359 ? 43.648 53.780 119.347 1.00 9.09 ? 379 ASN D CB 1 +ATOM 12921 C CG . ASN C 1 359 ? 43.271 52.585 118.497 1.00 9.75 ? 379 ASN D CG 1 +ATOM 12922 O OD1 . ASN C 1 359 ? 44.130 51.853 117.988 1.00 9.85 ? 379 ASN D OD1 1 +ATOM 12923 N ND2 . ASN C 1 359 ? 41.957 52.380 118.330 1.00 9.25 ? 379 ASN D ND2 1 +ATOM 12924 N N . ALA C 1 360 ? 46.863 52.261 119.571 1.00 8.13 ? 380 ALA D N 1 +ATOM 12925 C CA . ALA C 1 360 ? 47.427 51.005 120.051 1.00 8.50 ? 380 ALA D CA 1 +ATOM 12926 C C . ALA C 1 360 ? 48.833 50.780 119.551 1.00 8.38 ? 380 ALA D C 1 +ATOM 12927 O O . ALA C 1 360 ? 49.182 51.190 118.440 1.00 8.46 ? 380 ALA D O 1 +ATOM 12928 C CB . ALA C 1 360 ? 46.557 49.846 119.603 1.00 8.38 ? 380 ALA D CB 1 +ATOM 12929 N N . PHE C 1 361 ? 49.638 50.091 120.355 1.00 8.44 ? 381 PHE D N 1 +ATOM 12930 C CA . PHE C 1 361 ? 50.804 49.425 119.796 1.00 8.42 ? 381 PHE D CA 1 +ATOM 12931 C C . PHE C 1 361 ? 51.127 48.120 120.491 1.00 8.59 ? 381 PHE D C 1 +ATOM 12932 O O . PHE C 1 361 ? 50.719 47.892 121.626 1.00 8.23 ? 381 PHE D O 1 +ATOM 12933 C CB . PHE C 1 361 ? 52.032 50.341 119.730 1.00 8.67 ? 381 PHE D CB 1 +ATOM 12934 C CG . PHE C 1 361 ? 52.523 50.845 121.065 1.00 8.98 ? 381 PHE D CG 1 +ATOM 12935 C CD1 . PHE C 1 361 ? 53.405 50.092 121.828 1.00 10.76 ? 381 PHE D CD1 1 +ATOM 12936 C CD2 . PHE C 1 361 ? 52.164 52.094 121.517 1.00 10.08 ? 381 PHE D CD2 1 +ATOM 12937 C CE1 . PHE C 1 361 ? 53.878 50.557 123.042 1.00 9.26 ? 381 PHE D CE1 1 +ATOM 12938 C CE2 . PHE C 1 361 ? 52.631 52.569 122.730 1.00 9.48 ? 381 PHE D CE2 1 +ATOM 12939 C CZ . PHE C 1 361 ? 53.512 51.810 123.480 1.00 9.00 ? 381 PHE D CZ 1 +ATOM 12940 N N . ARG C 1 362 ? 51.837 47.254 119.766 1.00 8.67 ? 382 ARG D N 1 +ATOM 12941 C CA . ARG C 1 362 ? 52.425 46.062 120.342 1.00 8.11 ? 382 ARG D CA 1 +ATOM 12942 C C . ARG C 1 362 ? 53.858 46.389 120.714 1.00 8.28 ? 382 ARG D C 1 +ATOM 12943 O O . ARG C 1 362 ? 54.548 47.099 119.971 1.00 7.72 ? 382 ARG D O 1 +ATOM 12944 C CB . ARG C 1 362 ? 52.443 44.914 119.331 1.00 8.62 ? 382 ARG D CB 1 +ATOM 12945 C CG . ARG C 1 362 ? 53.025 43.621 119.880 1.00 7.99 ? 382 ARG D CG 1 +ATOM 12946 C CD . ARG C 1 362 ? 52.969 42.442 118.918 1.00 8.71 ? 382 ARG D CD 1 +ATOM 12947 N NE . ARG C 1 362 ? 53.362 42.735 117.536 1.00 9.03 ? 382 ARG D NE 1 +ATOM 12948 C CZ . ARG C 1 362 ? 54.088 41.932 116.749 1.00 10.19 ? 382 ARG D CZ 1 +ATOM 12949 N NH1 . ARG C 1 362 ? 54.571 40.775 117.181 1.00 9.81 ? 382 ARG D NH1 1 +ATOM 12950 N NH2 . ARG C 1 362 ? 54.353 42.295 115.497 1.00 10.68 ? 382 ARG D NH2 1 +ATOM 12951 N N . THR C 1 363 ? 54.325 45.844 121.828 1.00 8.25 ? 383 THR D N 1 +ATOM 12952 C CA . THR C 1 363 ? 55.713 45.999 122.230 1.00 8.23 ? 383 THR D CA 1 +ATOM 12953 C C . THR C 1 363 ? 56.561 44.925 121.532 1.00 8.08 ? 383 THR D C 1 +ATOM 12954 O O . THR C 1 363 ? 57.092 43.996 122.155 1.00 8.24 ? 383 THR D O 1 +ATOM 12955 C CB . THR C 1 363 ? 55.881 45.947 123.758 1.00 9.24 ? 383 THR D CB 1 +ATOM 12956 O OG1 . THR C 1 363 ? 55.576 44.625 124.240 1.00 10.11 ? 383 THR D OG1 1 +ATOM 12957 C CG2 . THR C 1 363 ? 54.990 46.988 124.457 1.00 8.47 ? 383 THR D CG2 1 +ATOM 12958 N N . SER C 1 364 ? 56.625 45.030 120.212 1.00 7.92 ? 384 SER D N 1 +ATOM 12959 C CA . SER C 1 364 ? 57.483 44.182 119.409 1.00 7.68 ? 384 SER D CA 1 +ATOM 12960 C C . SER C 1 364 ? 58.915 44.464 119.855 1.00 7.64 ? 384 SER D C 1 +ATOM 12961 O O . SER C 1 364 ? 59.310 45.627 119.860 1.00 7.74 ? 384 SER D O 1 +ATOM 12962 C CB . SER C 1 364 ? 57.292 44.517 117.918 1.00 7.51 ? 384 SER D CB 1 +ATOM 12963 O OG . SER C 1 364 ? 57.013 45.885 117.710 1.00 7.84 ? 384 SER D OG 1 +ATOM 12964 N N . HIS C 1 365 ? 59.700 43.471 120.282 1.00 8.09 ? 385 HIS D N 1 +ATOM 12965 C CA . HIS C 1 365 ? 59.308 42.095 120.608 1.00 7.99 ? 385 HIS D CA 1 +ATOM 12966 C C . HIS C 1 365 ? 59.860 41.715 121.993 1.00 8.19 ? 385 HIS D C 1 +ATOM 12967 O O . HIS C 1 365 ? 60.592 40.718 122.154 1.00 9.28 ? 385 HIS D O 1 +ATOM 12968 C CB . HIS C 1 365 ? 59.891 41.138 119.576 1.00 7.92 ? 385 HIS D CB 1 +ATOM 12969 C CG . HIS C 1 365 ? 59.422 41.379 118.180 1.00 6.34 ? 385 HIS D CG 1 +ATOM 12970 N ND1 . HIS C 1 365 ? 58.113 41.172 117.794 1.00 6.01 ? 385 HIS D ND1 1 +ATOM 12971 C CD2 . HIS C 1 365 ? 60.086 41.771 117.067 1.00 6.07 ? 385 HIS D CD2 1 +ATOM 12972 C CE1 . HIS C 1 365 ? 57.988 41.444 116.508 1.00 6.80 ? 385 HIS D CE1 1 +ATOM 12973 N NE2 . HIS C 1 365 ? 59.172 41.793 116.037 1.00 7.05 ? 385 HIS D NE2 1 +ATOM 12974 N N . TYR C 1 366 ? 59.500 42.510 122.986 1.00 7.53 ? 386 TYR D N 1 +ATOM 12975 C CA . TYR C 1 366 ? 60.041 42.422 124.346 1.00 7.01 ? 386 TYR D CA 1 +ATOM 12976 C C . TYR C 1 366 ? 59.292 43.482 125.144 1.00 7.72 ? 386 TYR D C 1 +ATOM 12977 O O . TYR C 1 366 ? 58.771 44.441 124.562 1.00 7.36 ? 386 TYR D O 1 +ATOM 12978 C CB . TYR C 1 366 ? 61.571 42.665 124.382 1.00 7.17 ? 386 TYR D CB 1 +ATOM 12979 C CG . TYR C 1 366 ? 61.994 43.763 123.453 1.00 7.16 ? 386 TYR D CG 1 +ATOM 12980 C CD1 . TYR C 1 366 ? 61.821 45.101 123.813 1.00 8.78 ? 386 TYR D CD1 1 +ATOM 12981 C CD2 . TYR C 1 366 ? 62.523 43.481 122.201 1.00 8.11 ? 386 TYR D CD2 1 +ATOM 12982 C CE1 . TYR C 1 366 ? 62.182 46.124 122.949 1.00 7.19 ? 386 TYR D CE1 1 +ATOM 12983 C CE2 . TYR C 1 366 ? 62.877 44.508 121.330 1.00 8.15 ? 386 TYR D CE2 1 +ATOM 12984 C CZ . TYR C 1 366 ? 62.678 45.819 121.707 1.00 6.24 ? 386 TYR D CZ 1 +ATOM 12985 O OH . TYR C 1 366 ? 63.015 46.832 120.828 1.00 7.81 ? 386 TYR D OH 1 +ATOM 12986 N N . PRO C 1 367 ? 59.216 43.316 126.472 1.00 7.60 ? 387 PRO D N 1 +ATOM 12987 C CA . PRO C 1 367 ? 58.621 44.389 127.271 1.00 7.67 ? 387 PRO D CA 1 +ATOM 12988 C C . PRO C 1 367 ? 59.435 45.668 127.200 1.00 7.65 ? 387 PRO D C 1 +ATOM 12989 O O . PRO C 1 367 ? 60.662 45.616 127.224 1.00 7.25 ? 387 PRO D O 1 +ATOM 12990 C CB . PRO C 1 367 ? 58.623 43.844 128.693 1.00 7.98 ? 387 PRO D CB 1 +ATOM 12991 C CG . PRO C 1 367 ? 58.986 42.402 128.604 1.00 8.48 ? 387 PRO D CG 1 +ATOM 12992 C CD . PRO C 1 367 ? 59.624 42.153 127.275 1.00 7.94 ? 387 PRO D CD 1 +ATOM 12993 N N . TYR C 1 368 ? 58.756 46.798 127.069 1.00 7.82 ? 388 TYR D N 1 +ATOM 12994 C CA . TYR C 1 368 ? 59.418 48.106 127.052 1.00 7.82 ? 388 TYR D CA 1 +ATOM 12995 C C . TYR C 1 368 ? 59.620 48.627 128.470 1.00 7.75 ? 388 TYR D C 1 +ATOM 12996 O O . TYR C 1 368 ? 59.143 48.026 129.426 1.00 7.60 ? 388 TYR D O 1 +ATOM 12997 C CB . TYR C 1 368 ? 58.604 49.098 126.214 1.00 8.27 ? 388 TYR D CB 1 +ATOM 12998 C CG . TYR C 1 368 ? 58.504 48.785 124.724 1.00 8.35 ? 388 TYR D CG 1 +ATOM 12999 C CD1 . TYR C 1 368 ? 59.175 47.701 124.139 1.00 8.24 ? 388 TYR D CD1 1 +ATOM 13000 C CD2 . TYR C 1 368 ? 57.748 49.606 123.889 1.00 11.80 ? 388 TYR D CD2 1 +ATOM 13001 C CE1 . TYR C 1 368 ? 59.063 47.439 122.793 1.00 9.38 ? 388 TYR D CE1 1 +ATOM 13002 C CE2 . TYR C 1 368 ? 57.644 49.354 122.530 1.00 9.87 ? 388 TYR D CE2 1 +ATOM 13003 C CZ . TYR C 1 368 ? 58.300 48.273 121.987 1.00 8.53 ? 388 TYR D CZ 1 +ATOM 13004 O OH . TYR C 1 368 ? 58.181 48.026 120.641 1.00 9.20 ? 388 TYR D OH 1 +ATOM 13005 N N . ALA C 1 369 ? 60.352 49.732 128.616 1.00 8.17 ? 389 ALA D N 1 +ATOM 13006 C CA . ALA C 1 369 ? 60.504 50.391 129.909 1.00 7.93 ? 389 ALA D CA 1 +ATOM 13007 C C . ALA C 1 369 ? 59.138 50.618 130.542 1.00 8.13 ? 389 ALA D C 1 +ATOM 13008 O O . ALA C 1 369 ? 58.152 50.924 129.859 1.00 8.38 ? 389 ALA D O 1 +ATOM 13009 C CB . ALA C 1 369 ? 61.261 51.732 129.778 1.00 8.17 ? 389 ALA D CB 1 +ATOM 13010 N N . GLU C 1 370 ? 59.098 50.495 131.862 1.00 8.09 ? 390 GLU D N 1 +ATOM 13011 C CA . GLU C 1 370 ? 57.868 50.719 132.619 1.00 8.45 ? 390 GLU D CA 1 +ATOM 13012 C C . GLU C 1 370 ? 57.287 52.121 132.338 1.00 8.85 ? 390 GLU D C 1 +ATOM 13013 O O . GLU C 1 370 ? 56.074 52.301 132.194 1.00 8.38 ? 390 GLU D O 1 +ATOM 13014 C CB . GLU C 1 370 ? 58.147 50.496 134.108 1.00 8.85 ? 390 GLU D CB 1 +ATOM 13015 C CG A GLU C 1 370 ? 58.544 49.077 134.493 0.50 8.95 ? 390 GLU D CG 1 +ATOM 13016 C CG B GLU C 1 370 ? 58.548 49.045 134.394 0.50 10.48 ? 390 GLU D CG 1 +ATOM 13017 C CD A GLU C 1 370 ? 60.034 48.921 134.752 0.50 7.90 ? 390 GLU D CD 1 +ATOM 13018 C CD B GLU C 1 370 ? 59.172 48.843 135.748 0.50 12.04 ? 390 GLU D CD 1 +ATOM 13019 O OE1 A GLU C 1 370 ? 60.842 49.373 133.901 0.50 6.56 ? 390 GLU D OE1 1 +ATOM 13020 O OE1 B GLU C 1 370 ? 58.435 48.425 136.661 0.50 14.14 ? 390 GLU D OE1 1 +ATOM 13021 O OE2 A GLU C 1 370 ? 60.385 48.337 135.810 0.50 8.53 ? 390 GLU D OE2 1 +ATOM 13022 O OE2 B GLU C 1 370 ? 60.384 49.107 135.909 0.50 11.50 ? 390 GLU D OE2 1 +ATOM 13023 N N . GLU C 1 371 ? 58.163 53.098 132.199 1.00 8.96 ? 391 GLU D N 1 +ATOM 13024 C CA . GLU C 1 371 ? 57.734 54.483 131.936 1.00 9.66 ? 391 GLU D CA 1 +ATOM 13025 C C . GLU C 1 371 ? 56.879 54.584 130.659 1.00 9.37 ? 391 GLU D C 1 +ATOM 13026 O O . GLU C 1 371 ? 55.984 55.437 130.561 1.00 9.76 ? 391 GLU D O 1 +ATOM 13027 C CB . GLU C 1 371 ? 58.953 55.402 131.860 1.00 9.86 ? 391 GLU D CB 1 +ATOM 13028 C CG . GLU C 1 371 ? 59.823 55.423 133.142 1.00 12.48 ? 391 GLU D CG 1 +ATOM 13029 C CD . GLU C 1 371 ? 61.013 54.438 133.126 1.00 16.53 ? 391 GLU D CD 1 +ATOM 13030 O OE1 . GLU C 1 371 ? 60.809 53.220 132.893 1.00 16.53 ? 391 GLU D OE1 1 +ATOM 13031 O OE2 . GLU C 1 371 ? 62.165 54.890 133.382 1.00 21.18 ? 391 GLU D OE2 1 +ATOM 13032 N N . VAL C 1 372 ? 57.167 53.719 129.684 1.00 9.11 ? 392 VAL D N 1 +ATOM 13033 C CA . VAL C 1 372 ? 56.371 53.624 128.454 1.00 9.24 ? 392 VAL D CA 1 +ATOM 13034 C C . VAL C 1 372 ? 54.959 53.137 128.776 1.00 9.87 ? 392 VAL D C 1 +ATOM 13035 O O . VAL C 1 372 ? 53.974 53.659 128.253 1.00 10.55 ? 392 VAL D O 1 +ATOM 13036 C CB . VAL C 1 372 ? 57.013 52.668 127.407 1.00 9.58 ? 392 VAL D CB 1 +ATOM 13037 C CG1 . VAL C 1 372 ? 56.156 52.580 126.128 1.00 9.10 ? 392 VAL D CG1 1 +ATOM 13038 C CG2 . VAL C 1 372 ? 58.443 53.107 127.076 1.00 8.37 ? 392 VAL D CG2 1 +ATOM 13039 N N . MET C 1 373 ? 54.858 52.151 129.661 1.00 10.10 ? 393 MET D N 1 +ATOM 13040 C CA . MET C 1 373 ? 53.546 51.633 130.037 1.00 9.91 ? 393 MET D CA 1 +ATOM 13041 C C . MET C 1 373 ? 52.743 52.660 130.848 1.00 9.96 ? 393 MET D C 1 +ATOM 13042 O O . MET C 1 373 ? 51.523 52.777 130.685 1.00 10.07 ? 393 MET D O 1 +ATOM 13043 C CB . MET C 1 373 ? 53.683 50.321 130.810 1.00 10.09 ? 393 MET D CB 1 +ATOM 13044 C CG . MET C 1 373 ? 54.369 49.192 130.052 1.00 10.58 ? 393 MET D CG 1 +ATOM 13045 S SD . MET C 1 373 ? 53.474 48.631 128.607 1.00 10.76 ? 393 MET D SD 1 +ATOM 13046 C CE . MET C 1 373 ? 54.085 49.755 127.343 1.00 13.26 ? 393 MET D CE 1 +ATOM 13047 N N . GLN C 1 374 ? 53.421 53.409 131.708 1.00 10.23 ? 394 GLN D N 1 +ATOM 13048 C CA . GLN C 1 374 ? 52.781 54.480 132.467 1.00 10.80 ? 394 GLN D CA 1 +ATOM 13049 C C . GLN C 1 374 ? 52.184 55.528 131.539 1.00 10.94 ? 394 GLN D C 1 +ATOM 13050 O O . GLN C 1 374 ? 51.077 56.027 131.761 1.00 11.01 ? 394 GLN D O 1 +ATOM 13051 C CB . GLN C 1 374 ? 53.799 55.140 133.384 1.00 10.95 ? 394 GLN D CB 1 +ATOM 13052 C CG A GLN C 1 374 ? 54.364 54.206 134.428 0.50 12.26 ? 394 GLN D CG 1 +ATOM 13053 C CG B GLN C 1 374 ? 54.414 54.187 134.406 0.50 11.55 ? 394 GLN D CG 1 +ATOM 13054 C CD A GLN C 1 374 ? 55.231 54.927 135.418 0.50 14.52 ? 394 GLN D CD 1 +ATOM 13055 C CD B GLN C 1 374 ? 55.029 54.926 135.562 0.50 13.11 ? 394 GLN D CD 1 +ATOM 13056 O OE1 A GLN C 1 374 ? 55.126 56.147 135.601 0.50 16.11 ? 394 GLN D OE1 1 +ATOM 13057 O OE1 B GLN C 1 374 ? 56.225 55.240 135.549 0.50 14.03 ? 394 GLN D OE1 1 +ATOM 13058 N NE2 A GLN C 1 374 ? 56.093 54.178 136.077 0.50 16.55 ? 394 GLN D NE2 1 +ATOM 13059 N NE2 B GLN C 1 374 ? 54.206 55.243 136.563 0.50 12.98 ? 394 GLN D NE2 1 +ATOM 13060 N N . MET C 1 375 ? 52.929 55.859 130.491 1.00 10.80 ? 395 MET D N 1 +ATOM 13061 C CA . MET C 1 375 ? 52.467 56.803 129.479 1.00 10.54 ? 395 MET D CA 1 +ATOM 13062 C C . MET C 1 375 ? 51.231 56.267 128.748 1.00 10.02 ? 395 MET D C 1 +ATOM 13063 O O . MET C 1 375 ? 50.229 56.978 128.552 1.00 9.51 ? 395 MET D O 1 +ATOM 13064 C CB . MET C 1 375 ? 53.607 57.112 128.503 1.00 10.92 ? 395 MET D CB 1 +ATOM 13065 C CG . MET C 1 375 ? 54.727 57.940 129.124 1.00 12.88 ? 395 MET D CG 1 +ATOM 13066 S SD . MET C 1 375 ? 54.416 59.740 129.154 1.00 17.13 ? 395 MET D SD 1 +ATOM 13067 C CE . MET C 1 375 ? 54.413 60.083 127.398 1.00 14.14 ? 395 MET D CE 1 +ATOM 13068 N N . CYS C 1 376 ? 51.272 54.998 128.374 1.00 9.82 ? 396 CYS D N 1 +ATOM 13069 C CA . CYS C 1 376 ? 50.103 54.356 127.751 1.00 10.11 ? 396 CYS D CA 1 +ATOM 13070 C C . CYS C 1 376 ? 48.836 54.496 128.611 1.00 10.63 ? 396 CYS D C 1 +ATOM 13071 O O . CYS C 1 376 ? 47.754 54.822 128.086 1.00 11.12 ? 396 CYS D O 1 +ATOM 13072 C CB . CYS C 1 376 ? 50.402 52.889 127.475 1.00 10.46 ? 396 CYS D CB 1 +ATOM 13073 S SG . CYS C 1 376 ? 51.613 52.668 126.130 1.00 10.84 ? 396 CYS D SG 1 +ATOM 13074 N N . ASP C 1 377 ? 48.975 54.268 129.917 1.00 10.83 ? 397 ASP D N 1 +ATOM 13075 C CA . ASP C 1 377 ? 47.822 54.354 130.827 1.00 11.08 ? 397 ASP D CA 1 +ATOM 13076 C C . ASP C 1 377 ? 47.251 55.765 130.806 1.00 11.72 ? 397 ASP D C 1 +ATOM 13077 O O . ASP C 1 377 ? 46.039 55.950 130.851 1.00 12.89 ? 397 ASP D O 1 +ATOM 13078 C CB . ASP C 1 377 ? 48.217 54.002 132.262 1.00 11.18 ? 397 ASP D CB 1 +ATOM 13079 C CG . ASP C 1 377 ? 48.524 52.526 132.465 1.00 10.58 ? 397 ASP D CG 1 +ATOM 13080 O OD1 . ASP C 1 377 ? 48.104 51.673 131.652 1.00 12.61 ? 397 ASP D OD1 1 +ATOM 13081 O OD2 . ASP C 1 377 ? 49.152 52.207 133.491 1.00 10.21 ? 397 ASP D OD2 1 +ATOM 13082 N N . ARG C 1 378 ? 48.131 56.761 130.754 1.00 11.41 ? 398 ARG D N 1 +ATOM 13083 C CA . ARG C 1 378 ? 47.732 58.159 130.798 1.00 11.21 ? 398 ARG D CA 1 +ATOM 13084 C C . ARG C 1 378 ? 47.189 58.701 129.458 1.00 11.42 ? 398 ARG D C 1 +ATOM 13085 O O . ARG C 1 378 ? 46.278 59.532 129.463 1.00 11.94 ? 398 ARG D O 1 +ATOM 13086 C CB . ARG C 1 378 ? 48.907 59.005 131.301 1.00 11.07 ? 398 ARG D CB 1 +ATOM 13087 C CG . ARG C 1 378 ? 49.253 58.697 132.743 1.00 10.85 ? 398 ARG D CG 1 +ATOM 13088 C CD . ARG C 1 378 ? 50.491 59.427 133.238 1.00 12.98 ? 398 ARG D CD 1 +ATOM 13089 N NE . ARG C 1 378 ? 50.316 60.868 133.117 1.00 13.41 ? 398 ARG D NE 1 +ATOM 13090 C CZ . ARG C 1 378 ? 51.076 61.677 132.381 1.00 14.87 ? 398 ARG D CZ 1 +ATOM 13091 N NH1 . ARG C 1 378 ? 52.124 61.211 131.703 1.00 14.28 ? 398 ARG D NH1 1 +ATOM 13092 N NH2 . ARG C 1 378 ? 50.787 62.977 132.343 1.00 14.34 ? 398 ARG D NH2 1 +ATOM 13093 N N . TYR C 1 379 ? 47.740 58.230 128.328 1.00 11.27 ? 399 TYR D N 1 +ATOM 13094 C CA . TYR C 1 379 ? 47.358 58.729 126.988 1.00 10.85 ? 399 TYR D CA 1 +ATOM 13095 C C . TYR C 1 379 ? 46.263 57.873 126.313 1.00 11.20 ? 399 TYR D C 1 +ATOM 13096 O O . TYR C 1 379 ? 45.732 58.260 125.271 1.00 11.56 ? 399 TYR D O 1 +ATOM 13097 C CB . TYR C 1 379 ? 48.597 58.804 126.069 1.00 11.30 ? 399 TYR D CB 1 +ATOM 13098 C CG . TYR C 1 379 ? 49.568 59.944 126.363 1.00 11.71 ? 399 TYR D CG 1 +ATOM 13099 C CD1 . TYR C 1 379 ? 50.205 60.042 127.592 1.00 12.80 ? 399 TYR D CD1 1 +ATOM 13100 C CD2 . TYR C 1 379 ? 49.861 60.909 125.396 1.00 12.82 ? 399 TYR D CD2 1 +ATOM 13101 C CE1 . TYR C 1 379 ? 51.098 61.081 127.870 1.00 12.49 ? 399 TYR D CE1 1 +ATOM 13102 C CE2 . TYR C 1 379 ? 50.765 61.956 125.661 1.00 12.48 ? 399 TYR D CE2 1 +ATOM 13103 C CZ . TYR C 1 379 ? 51.371 62.034 126.899 1.00 12.90 ? 399 TYR D CZ 1 +ATOM 13104 O OH . TYR C 1 379 ? 52.256 63.053 127.185 1.00 11.89 ? 399 TYR D OH 1 +ATOM 13105 N N . GLY C 1 380 ? 45.952 56.700 126.878 1.00 10.17 ? 400 GLY D N 1 +ATOM 13106 C CA . GLY C 1 380 ? 44.899 55.841 126.341 1.00 10.18 ? 400 GLY D CA 1 +ATOM 13107 C C . GLY C 1 380 ? 45.337 55.023 125.138 1.00 9.87 ? 400 GLY D C 1 +ATOM 13108 O O . GLY C 1 380 ? 44.524 54.666 124.290 1.00 9.40 ? 400 GLY D O 1 +ATOM 13109 N N . ILE C 1 381 ? 46.626 54.719 125.067 1.00 9.28 ? 401 ILE D N 1 +ATOM 13110 C CA . ILE C 1 381 ? 47.160 53.950 123.974 1.00 9.29 ? 401 ILE D CA 1 +ATOM 13111 C C . ILE C 1 381 ? 47.230 52.492 124.443 1.00 9.22 ? 401 ILE D C 1 +ATOM 13112 O O . ILE C 1 381 ? 48.029 52.148 125.306 1.00 8.39 ? 401 ILE D O 1 +ATOM 13113 C CB . ILE C 1 381 ? 48.575 54.460 123.535 1.00 9.13 ? 401 ILE D CB 1 +ATOM 13114 C CG1 . ILE C 1 381 ? 48.556 55.969 123.253 1.00 11.04 ? 401 ILE D CG1 1 +ATOM 13115 C CG2 . ILE C 1 381 ? 49.050 53.672 122.322 1.00 10.25 ? 401 ILE D CG2 1 +ATOM 13116 C CD1 . ILE C 1 381 ? 47.664 56.370 122.092 1.00 12.45 ? 401 ILE D CD1 1 +ATOM 13117 N N . VAL C 1 382 ? 46.368 51.642 123.898 1.00 9.51 ? 402 VAL D N 1 +ATOM 13118 C CA . VAL C 1 382 ? 46.305 50.263 124.364 1.00 9.87 ? 402 VAL D CA 1 +ATOM 13119 C C . VAL C 1 382 ? 47.532 49.504 123.886 1.00 9.77 ? 402 VAL D C 1 +ATOM 13120 O O . VAL C 1 382 ? 48.182 49.884 122.908 1.00 10.02 ? 402 VAL D O 1 +ATOM 13121 C CB . VAL C 1 382 ? 45.003 49.525 123.949 1.00 10.15 ? 402 VAL D CB 1 +ATOM 13122 C CG1 . VAL C 1 382 ? 43.794 50.292 124.478 1.00 10.99 ? 402 VAL D CG1 1 +ATOM 13123 C CG2 . VAL C 1 382 ? 44.901 49.339 122.433 1.00 11.19 ? 402 VAL D CG2 1 +ATOM 13124 N N . VAL C 1 383 ? 47.834 48.430 124.598 1.00 9.14 ? 403 VAL D N 1 +ATOM 13125 C CA . VAL C 1 383 ? 49.080 47.715 124.421 1.00 8.45 ? 403 VAL D CA 1 +ATOM 13126 C C . VAL C 1 383 ? 48.852 46.219 124.315 1.00 8.19 ? 403 VAL D C 1 +ATOM 13127 O O . VAL C 1 383 ? 48.141 45.637 125.134 1.00 8.27 ? 403 VAL D O 1 +ATOM 13128 C CB . VAL C 1 383 ? 50.023 47.986 125.616 1.00 8.49 ? 403 VAL D CB 1 +ATOM 13129 C CG1 . VAL C 1 383 ? 51.247 47.049 125.565 1.00 9.32 ? 403 VAL D CG1 1 +ATOM 13130 C CG2 . VAL C 1 383 ? 50.414 49.480 125.684 1.00 7.31 ? 403 VAL D CG2 1 +ATOM 13131 N N . ILE C 1 384 ? 49.469 45.601 123.308 1.00 7.50 ? 404 ILE D N 1 +ATOM 13132 C CA . ILE C 1 384 ? 49.645 44.165 123.272 1.00 7.50 ? 404 ILE D CA 1 +ATOM 13133 C C . ILE C 1 384 ? 51.055 43.965 123.796 1.00 7.90 ? 404 ILE D C 1 +ATOM 13134 O O . ILE C 1 384 ? 52.019 44.238 123.098 1.00 8.12 ? 404 ILE D O 1 +ATOM 13135 C CB . ILE C 1 384 ? 49.492 43.604 121.858 1.00 7.99 ? 404 ILE D CB 1 +ATOM 13136 C CG1 . ILE C 1 384 ? 48.107 43.944 121.310 1.00 7.90 ? 404 ILE D CG1 1 +ATOM 13137 C CG2 . ILE C 1 384 ? 49.691 42.103 121.855 1.00 7.63 ? 404 ILE D CG2 1 +ATOM 13138 C CD1 . ILE C 1 384 ? 47.927 43.651 119.835 1.00 9.88 ? 404 ILE D CD1 1 +ATOM 13139 N N . ASP C 1 385 ? 51.151 43.551 125.050 1.00 7.72 ? 405 ASP D N 1 +ATOM 13140 C CA . ASP C 1 385 ? 52.412 43.478 125.771 1.00 8.09 ? 405 ASP D CA 1 +ATOM 13141 C C . ASP C 1 385 ? 53.056 42.107 125.511 1.00 8.13 ? 405 ASP D C 1 +ATOM 13142 O O . ASP C 1 385 ? 52.500 41.057 125.849 1.00 7.46 ? 405 ASP D O 1 +ATOM 13143 C CB . ASP C 1 385 ? 52.103 43.696 127.247 1.00 8.04 ? 405 ASP D CB 1 +ATOM 13144 C CG . ASP C 1 385 ? 53.297 44.005 128.078 1.00 8.76 ? 405 ASP D CG 1 +ATOM 13145 O OD1 . ASP C 1 385 ? 54.432 43.998 127.568 1.00 8.47 ? 405 ASP D OD1 1 +ATOM 13146 O OD2 . ASP C 1 385 ? 53.074 44.252 129.294 1.00 8.17 ? 405 ASP D OD2 1 +ATOM 13147 N N . GLU C 1 386 ? 54.236 42.125 124.902 1.00 8.40 ? 406 GLU D N 1 +ATOM 13148 C CA . GLU C 1 386 ? 54.827 40.927 124.329 1.00 8.86 ? 406 GLU D CA 1 +ATOM 13149 C C . GLU C 1 386 ? 56.136 40.532 124.994 1.00 9.11 ? 406 GLU D C 1 +ATOM 13150 O O . GLU C 1 386 ? 57.016 41.355 125.152 1.00 8.95 ? 406 GLU D O 1 +ATOM 13151 C CB . GLU C 1 386 ? 55.090 41.135 122.836 1.00 9.22 ? 406 GLU D CB 1 +ATOM 13152 C CG . GLU C 1 386 ? 55.617 39.907 122.144 1.00 8.62 ? 406 GLU D CG 1 +ATOM 13153 C CD . GLU C 1 386 ? 55.579 40.017 120.650 1.00 8.69 ? 406 GLU D CD 1 +ATOM 13154 O OE1 . GLU C 1 386 ? 54.487 39.833 120.079 1.00 11.85 ? 406 GLU D OE1 1 +ATOM 13155 O OE2 . GLU C 1 386 ? 56.630 40.279 120.046 1.00 10.92 ? 406 GLU D OE2 1 +ATOM 13156 N N A CYS C 1 387 ? 56.268 39.280 125.424 0.50 8.70 ? 407 CYS D N 1 +ATOM 13157 N N B CYS C 1 387 ? 56.223 39.235 125.306 0.50 9.97 ? 407 CYS D N 1 +ATOM 13158 C CA A CYS C 1 387 ? 57.523 38.845 126.041 0.50 8.46 ? 407 CYS D CA 1 +ATOM 13159 C CA B CYS C 1 387 ? 57.421 38.545 125.803 0.50 9.98 ? 407 CYS D CA 1 +ATOM 13160 C C A CYS C 1 387 ? 58.554 38.603 124.951 0.50 8.61 ? 407 CYS D C 1 +ATOM 13161 C C B CYS C 1 387 ? 58.599 38.724 124.842 0.50 9.42 ? 407 CYS D C 1 +ATOM 13162 O O A CYS C 1 387 ? 58.189 38.404 123.792 0.50 9.37 ? 407 CYS D O 1 +ATOM 13163 O O B CYS C 1 387 ? 58.396 39.041 123.671 0.50 9.69 ? 407 CYS D O 1 +ATOM 13164 C CB A CYS C 1 387 ? 57.327 37.555 126.816 0.50 7.95 ? 407 CYS D CB 1 +ATOM 13165 C CB B CYS C 1 387 ? 57.085 37.043 125.916 0.50 10.12 ? 407 CYS D CB 1 +ATOM 13166 S SG A CYS C 1 387 ? 57.143 36.163 125.712 0.50 6.62 ? 407 CYS D SG 1 +ATOM 13167 S SG B CYS C 1 387 ? 57.935 36.094 127.178 0.50 12.45 ? 407 CYS D SG 1 +ATOM 13168 N N . PRO C 1 388 ? 59.845 38.551 125.322 1.00 9.02 ? 408 PRO D N 1 +ATOM 13169 C CA . PRO C 1 388 ? 60.921 38.363 124.329 1.00 8.58 ? 408 PRO D CA 1 +ATOM 13170 C C . PRO C 1 388 ? 60.976 36.975 123.620 1.00 8.04 ? 408 PRO D C 1 +ATOM 13171 O O . PRO C 1 388 ? 62.060 36.551 123.233 1.00 9.08 ? 408 PRO D O 1 +ATOM 13172 C CB . PRO C 1 388 ? 62.202 38.600 125.137 1.00 8.24 ? 408 PRO D CB 1 +ATOM 13173 C CG . PRO C 1 388 ? 61.780 39.083 126.473 1.00 8.13 ? 408 PRO D CG 1 +ATOM 13174 C CD . PRO C 1 388 ? 60.374 38.648 126.690 1.00 8.84 ? 408 PRO D CD 1 +ATOM 13175 N N . GLY C 1 389 ? 59.831 36.339 123.363 1.00 8.28 ? 409 GLY D N 1 +ATOM 13176 C CA . GLY C 1 389 ? 59.775 35.023 122.717 1.00 8.31 ? 409 GLY D CA 1 +ATOM 13177 C C . GLY C 1 389 ? 59.793 35.135 121.206 1.00 8.64 ? 409 GLY D C 1 +ATOM 13178 O O . GLY C 1 389 ? 58.858 34.697 120.520 1.00 8.41 ? 409 GLY D O 1 +ATOM 13179 N N . VAL C 1 390 ? 60.872 35.721 120.697 1.00 8.47 ? 410 VAL D N 1 +ATOM 13180 C CA . VAL C 1 390 ? 61.037 36.028 119.285 1.00 8.66 ? 410 VAL D CA 1 +ATOM 13181 C C . VAL C 1 390 ? 62.301 35.305 118.812 1.00 8.59 ? 410 VAL D C 1 +ATOM 13182 O O . VAL C 1 390 ? 63.255 35.139 119.575 1.00 9.38 ? 410 VAL D O 1 +ATOM 13183 C CB . VAL C 1 390 ? 61.166 37.576 119.034 1.00 8.44 ? 410 VAL D CB 1 +ATOM 13184 C CG1 . VAL C 1 390 ? 62.329 38.191 119.832 1.00 9.18 ? 410 VAL D CG1 1 +ATOM 13185 C CG2 . VAL C 1 390 ? 61.310 37.907 117.532 1.00 7.81 ? 410 VAL D CG2 1 +ATOM 13186 N N . GLY C 1 391 ? 62.297 34.872 117.563 1.00 8.88 ? 411 GLY D N 1 +ATOM 13187 C CA . GLY C 1 391 ? 63.412 34.127 116.979 1.00 9.19 ? 411 GLY D CA 1 +ATOM 13188 C C . GLY C 1 391 ? 63.469 32.655 117.361 1.00 9.72 ? 411 GLY D C 1 +ATOM 13189 O O . GLY C 1 391 ? 64.529 32.034 117.293 1.00 9.81 ? 411 GLY D O 1 +ATOM 13190 N N . LEU C 1 392 ? 62.323 32.096 117.741 1.00 10.42 ? 412 LEU D N 1 +ATOM 13191 C CA . LEU C 1 392 ? 62.222 30.675 118.088 1.00 11.31 ? 412 LEU D CA 1 +ATOM 13192 C C . LEU C 1 392 ? 62.022 29.883 116.787 1.00 11.31 ? 412 LEU D C 1 +ATOM 13193 O O . LEU C 1 392 ? 60.949 29.330 116.525 1.00 11.33 ? 412 LEU D O 1 +ATOM 13194 C CB . LEU C 1 392 ? 61.069 30.443 119.072 1.00 11.31 ? 412 LEU D CB 1 +ATOM 13195 C CG . LEU C 1 392 ? 61.231 30.907 120.524 1.00 12.14 ? 412 LEU D CG 1 +ATOM 13196 C CD1 . LEU C 1 392 ? 61.512 32.402 120.630 1.00 15.89 ? 412 LEU D CD1 1 +ATOM 13197 C CD2 . LEU C 1 392 ? 59.968 30.547 121.317 1.00 12.46 ? 412 LEU D CD2 1 +ATOM 13198 N N . ALA C 1 393 ? 63.081 29.829 115.984 1.00 11.84 ? 413 ALA D N 1 +ATOM 13199 C CA . ALA C 1 393 ? 63.012 29.404 114.593 1.00 12.30 ? 413 ALA D CA 1 +ATOM 13200 C C . ALA C 1 393 ? 63.437 27.949 114.364 1.00 13.39 ? 413 ALA D C 1 +ATOM 13201 O O . ALA C 1 393 ? 63.018 27.338 113.375 1.00 13.26 ? 413 ALA D O 1 +ATOM 13202 C CB . ALA C 1 393 ? 63.855 30.355 113.722 1.00 12.72 ? 413 ALA D CB 1 +ATOM 13203 N N . LEU C 1 394 ? 64.263 27.403 115.261 1.00 14.00 ? 414 LEU D N 1 +ATOM 13204 C CA . LEU C 1 394 ? 64.827 26.075 115.078 1.00 14.88 ? 414 LEU D CA 1 +ATOM 13205 C C . LEU C 1 394 ? 64.202 25.085 116.041 1.00 15.81 ? 414 LEU D C 1 +ATOM 13206 O O . LEU C 1 394 ? 63.875 25.439 117.177 1.00 15.72 ? 414 LEU D O 1 +ATOM 13207 C CB . LEU C 1 394 ? 66.338 26.090 115.319 1.00 15.26 ? 414 LEU D CB 1 +ATOM 13208 C CG . LEU C 1 394 ? 67.162 27.144 114.583 1.00 15.36 ? 414 LEU D CG 1 +ATOM 13209 C CD1 . LEU C 1 394 ? 68.644 26.986 114.920 1.00 16.00 ? 414 LEU D CD1 1 +ATOM 13210 C CD2 . LEU C 1 394 ? 66.938 27.060 113.081 1.00 17.39 ? 414 LEU D CD2 1 +ATOM 13211 N N . PRO C 1 395 ? 64.085 23.820 115.614 1.00 16.41 ? 415 PRO D N 1 +ATOM 13212 C CA . PRO C 1 395 ? 63.474 22.805 116.474 1.00 17.05 ? 415 PRO D CA 1 +ATOM 13213 C C . PRO C 1 395 ? 64.147 22.639 117.830 1.00 17.29 ? 415 PRO D C 1 +ATOM 13214 O O . PRO C 1 395 ? 63.459 22.320 118.795 1.00 17.46 ? 415 PRO D O 1 +ATOM 13215 C CB . PRO C 1 395 ? 63.614 21.519 115.662 1.00 17.10 ? 415 PRO D CB 1 +ATOM 13216 C CG . PRO C 1 395 ? 63.847 21.946 114.267 1.00 17.31 ? 415 PRO D CG 1 +ATOM 13217 C CD . PRO C 1 395 ? 64.528 23.261 114.323 1.00 16.47 ? 415 PRO D CD 1 +ATOM 13218 N N . GLN C 1 396 ? 65.464 22.862 117.902 1.00 17.76 ? 416 GLN D N 1 +ATOM 13219 C CA . GLN C 1 396 ? 66.218 22.727 119.154 1.00 19.01 ? 416 GLN D CA 1 +ATOM 13220 C C . GLN C 1 396 ? 65.813 23.727 120.243 1.00 18.84 ? 416 GLN D C 1 +ATOM 13221 O O . GLN C 1 396 ? 66.152 23.527 121.407 1.00 20.25 ? 416 GLN D O 1 +ATOM 13222 C CB . GLN C 1 396 ? 67.740 22.821 118.907 1.00 18.73 ? 416 GLN D CB 1 +ATOM 13223 C CG . GLN C 1 396 ? 68.245 24.207 118.477 1.00 20.30 ? 416 GLN D CG 1 +ATOM 13224 C CD . GLN C 1 396 ? 69.726 24.247 118.121 1.00 20.88 ? 416 GLN D CD 1 +ATOM 13225 O OE1 . GLN C 1 396 ? 70.588 24.396 118.994 1.00 23.62 ? 416 GLN D OE1 1 +ATOM 13226 N NE2 . GLN C 1 396 ? 70.027 24.158 116.827 1.00 22.44 ? 416 GLN D NE2 1 +ATOM 13227 N N . PHE C 1 397 ? 65.104 24.792 119.875 1.00 18.10 ? 417 PHE D N 1 +ATOM 13228 C CA . PHE C 1 397 ? 64.678 25.811 120.847 1.00 17.79 ? 417 PHE D CA 1 +ATOM 13229 C C . PHE C 1 397 ? 63.398 25.423 121.585 1.00 18.11 ? 417 PHE D C 1 +ATOM 13230 O O . PHE C 1 397 ? 62.999 26.105 122.531 1.00 17.69 ? 417 PHE D O 1 +ATOM 13231 C CB . PHE C 1 397 ? 64.453 27.175 120.173 1.00 16.93 ? 417 PHE D CB 1 +ATOM 13232 C CG . PHE C 1 397 ? 65.677 27.767 119.501 1.00 16.11 ? 417 PHE D CG 1 +ATOM 13233 C CD1 . PHE C 1 397 ? 66.970 27.461 119.910 1.00 16.36 ? 417 PHE D CD1 1 +ATOM 13234 C CD2 . PHE C 1 397 ? 65.515 28.691 118.472 1.00 15.71 ? 417 PHE D CD2 1 +ATOM 13235 C CE1 . PHE C 1 397 ? 68.071 28.036 119.279 1.00 15.14 ? 417 PHE D CE1 1 +ATOM 13236 C CE2 . PHE C 1 397 ? 66.612 29.267 117.844 1.00 14.07 ? 417 PHE D CE2 1 +ATOM 13237 C CZ . PHE C 1 397 ? 67.890 28.940 118.255 1.00 15.62 ? 417 PHE D CZ 1 +ATOM 13238 N N . PHE C 1 398 ? 62.763 24.337 121.150 1.00 18.80 ? 418 PHE D N 1 +ATOM 13239 C CA . PHE C 1 398 ? 61.537 23.850 121.755 1.00 19.43 ? 418 PHE D CA 1 +ATOM 13240 C C . PHE C 1 398 ? 61.829 22.553 122.515 1.00 20.73 ? 418 PHE D C 1 +ATOM 13241 O O . PHE C 1 398 ? 61.999 21.477 121.924 1.00 21.24 ? 418 PHE D O 1 +ATOM 13242 C CB . PHE C 1 398 ? 60.476 23.626 120.674 1.00 19.33 ? 418 PHE D CB 1 +ATOM 13243 C CG . PHE C 1 398 ? 60.110 24.879 119.914 1.00 19.11 ? 418 PHE D CG 1 +ATOM 13244 C CD1 . PHE C 1 398 ? 59.077 25.696 120.356 1.00 19.06 ? 418 PHE D CD1 1 +ATOM 13245 C CD2 . PHE C 1 398 ? 60.799 25.243 118.763 1.00 18.62 ? 418 PHE D CD2 1 +ATOM 13246 C CE1 . PHE C 1 398 ? 58.736 26.855 119.671 1.00 18.09 ? 418 PHE D CE1 1 +ATOM 13247 C CE2 . PHE C 1 398 ? 60.463 26.408 118.066 1.00 17.95 ? 418 PHE D CE2 1 +ATOM 13248 C CZ . PHE C 1 398 ? 59.432 27.209 118.519 1.00 18.57 ? 418 PHE D CZ 1 +ATOM 13249 N N . ASN C 1 399 ? 61.913 22.679 123.830 1.00 21.39 ? 419 ASN D N 1 +ATOM 13250 C CA . ASN C 1 399 ? 62.148 21.547 124.711 1.00 21.94 ? 419 ASN D CA 1 +ATOM 13251 C C . ASN C 1 399 ? 61.660 21.912 126.108 1.00 22.46 ? 419 ASN D C 1 +ATOM 13252 O O . ASN C 1 399 ? 61.160 23.024 126.324 1.00 23.13 ? 419 ASN D O 1 +ATOM 13253 C CB . ASN C 1 399 ? 63.631 21.174 124.699 1.00 21.96 ? 419 ASN D CB 1 +ATOM 13254 C CG . ASN C 1 399 ? 64.530 22.344 125.031 1.00 21.31 ? 419 ASN D CG 1 +ATOM 13255 O OD1 . ASN C 1 399 ? 64.586 22.800 126.174 1.00 22.59 ? 419 ASN D OD1 1 +ATOM 13256 N ND2 . ASN C 1 399 ? 65.259 22.820 124.040 1.00 20.88 ? 419 ASN D ND2 1 +ATOM 13257 N N . ASN C 1 400 ? 61.790 20.985 127.050 1.00 22.76 ? 420 ASN D N 1 +ATOM 13258 C CA . ASN C 1 400 ? 61.235 21.181 128.388 1.00 22.71 ? 420 ASN D CA 1 +ATOM 13259 C C . ASN C 1 400 ? 61.917 22.306 129.175 1.00 22.02 ? 420 ASN D C 1 +ATOM 13260 O O . ASN C 1 400 ? 61.256 23.026 129.927 1.00 22.23 ? 420 ASN D O 1 +ATOM 13261 C CB . ASN C 1 400 ? 61.284 19.864 129.179 1.00 22.98 ? 420 ASN D CB 1 +ATOM 13262 C CG . ASN C 1 400 ? 60.438 19.907 130.435 1.00 24.10 ? 420 ASN D CG 1 +ATOM 13263 O OD1 . ASN C 1 400 ? 59.239 20.192 130.383 1.00 25.32 ? 420 ASN D OD1 1 +ATOM 13264 N ND2 . ASN C 1 400 ? 61.058 19.615 131.579 1.00 27.75 ? 420 ASN D ND2 1 +ATOM 13265 N N . VAL C 1 401 ? 63.226 22.473 128.997 1.00 21.46 ? 421 VAL D N 1 +ATOM 13266 C CA . VAL C 1 401 ? 63.973 23.494 129.725 1.00 20.70 ? 421 VAL D CA 1 +ATOM 13267 C C . VAL C 1 401 ? 63.635 24.893 129.193 1.00 20.22 ? 421 VAL D C 1 +ATOM 13268 O O . VAL C 1 401 ? 63.372 25.817 129.962 1.00 19.42 ? 421 VAL D O 1 +ATOM 13269 C CB . VAL C 1 401 ? 65.493 23.263 129.638 1.00 20.95 ? 421 VAL D CB 1 +ATOM 13270 C CG1 . VAL C 1 401 ? 66.257 24.491 130.143 1.00 21.29 ? 421 VAL D CG1 1 +ATOM 13271 C CG2 . VAL C 1 401 ? 65.877 22.022 130.430 1.00 21.43 ? 421 VAL D CG2 1 +ATOM 13272 N N . SER C 1 402 ? 63.631 25.038 127.873 1.00 19.47 ? 422 SER D N 1 +ATOM 13273 C CA . SER C 1 402 ? 63.232 26.309 127.279 1.00 18.76 ? 422 SER D CA 1 +ATOM 13274 C C . SER C 1 402 ? 61.763 26.596 127.614 1.00 17.95 ? 422 SER D C 1 +ATOM 13275 O O . SER C 1 402 ? 61.408 27.741 127.873 1.00 17.97 ? 422 SER D O 1 +ATOM 13276 C CB . SER C 1 402 ? 63.454 26.308 125.769 1.00 18.85 ? 422 SER D CB 1 +ATOM 13277 O OG . SER C 1 402 ? 62.666 25.319 125.128 1.00 19.37 ? 422 SER D OG 1 +ATOM 13278 N N . LEU C 1 403 ? 60.920 25.561 127.621 1.00 17.63 ? 423 LEU D N 1 +ATOM 13279 C CA . LEU C 1 403 ? 59.500 25.750 127.951 1.00 17.23 ? 423 LEU D CA 1 +ATOM 13280 C C . LEU C 1 403 ? 59.345 26.353 129.339 1.00 17.01 ? 423 LEU D C 1 +ATOM 13281 O O . LEU C 1 403 ? 58.671 27.362 129.510 1.00 16.57 ? 423 LEU D O 1 +ATOM 13282 C CB . LEU C 1 403 ? 58.710 24.439 127.878 1.00 17.23 ? 423 LEU D CB 1 +ATOM 13283 C CG . LEU C 1 403 ? 57.269 24.532 128.400 1.00 17.07 ? 423 LEU D CG 1 +ATOM 13284 C CD1 . LEU C 1 403 ? 56.500 25.638 127.649 1.00 15.55 ? 423 LEU D CD1 1 +ATOM 13285 C CD2 . LEU C 1 403 ? 56.552 23.208 128.296 1.00 17.50 ? 423 LEU D CD2 1 +ATOM 13286 N N . HIS C 1 404 ? 59.978 25.737 130.335 1.00 17.39 ? 424 HIS D N 1 +ATOM 13287 C CA . HIS C 1 404 ? 59.843 26.228 131.709 1.00 17.47 ? 424 HIS D CA 1 +ATOM 13288 C C . HIS C 1 404 ? 60.495 27.598 131.885 1.00 16.68 ? 424 HIS D C 1 +ATOM 13289 O O . HIS C 1 404 ? 59.984 28.436 132.621 1.00 16.11 ? 424 HIS D O 1 +ATOM 13290 C CB . HIS C 1 404 ? 60.339 25.178 132.709 1.00 18.33 ? 424 HIS D CB 1 +ATOM 13291 C CG . HIS C 1 404 ? 59.443 23.977 132.773 1.00 20.01 ? 424 HIS D CG 1 +ATOM 13292 N ND1 . HIS C 1 404 ? 58.099 24.077 133.067 1.00 22.37 ? 424 HIS D ND1 1 +ATOM 13293 C CD2 . HIS C 1 404 ? 59.681 22.663 132.549 1.00 21.93 ? 424 HIS D CD2 1 +ATOM 13294 C CE1 . HIS C 1 404 ? 57.552 22.874 133.036 1.00 23.44 ? 424 HIS D CE1 1 +ATOM 13295 N NE2 . HIS C 1 404 ? 58.490 21.998 132.721 1.00 23.12 ? 424 HIS D NE2 1 +ATOM 13296 N N . HIS C 1 405 ? 61.586 27.852 131.171 1.00 15.77 ? 425 HIS D N 1 +ATOM 13297 C CA . HIS C 1 405 ? 62.189 29.170 131.204 1.00 15.48 ? 425 HIS D CA 1 +ATOM 13298 C C . HIS C 1 405 ? 61.231 30.232 130.635 1.00 14.65 ? 425 HIS D C 1 +ATOM 13299 O O . HIS C 1 405 ? 61.091 31.317 131.194 1.00 14.29 ? 425 HIS D O 1 +ATOM 13300 C CB . HIS C 1 405 ? 63.517 29.179 130.444 1.00 15.52 ? 425 HIS D CB 1 +ATOM 13301 C CG . HIS C 1 405 ? 64.113 30.542 130.314 1.00 16.53 ? 425 HIS D CG 1 +ATOM 13302 N ND1 . HIS C 1 405 ? 64.096 31.248 129.132 1.00 17.08 ? 425 HIS D ND1 1 +ATOM 13303 C CD2 . HIS C 1 405 ? 64.707 31.349 131.225 1.00 17.00 ? 425 HIS D CD2 1 +ATOM 13304 C CE1 . HIS C 1 405 ? 64.669 32.425 129.316 1.00 17.38 ? 425 HIS D CE1 1 +ATOM 13305 N NE2 . HIS C 1 405 ? 65.056 32.509 130.575 1.00 16.53 ? 425 HIS D NE2 1 +ATOM 13306 N N . HIS C 1 406 ? 60.563 29.903 129.533 1.00 14.27 ? 426 HIS D N 1 +ATOM 13307 C CA . HIS C 1 406 ? 59.616 30.816 128.871 1.00 14.16 ? 426 HIS D CA 1 +ATOM 13308 C C . HIS C 1 406 ? 58.434 31.134 129.820 1.00 14.61 ? 426 HIS D C 1 +ATOM 13309 O O . HIS C 1 406 ? 57.956 32.272 129.896 1.00 13.58 ? 426 HIS D O 1 +ATOM 13310 C CB . HIS C 1 406 ? 59.118 30.176 127.563 1.00 14.39 ? 426 HIS D CB 1 +ATOM 13311 C CG . HIS C 1 406 ? 58.496 31.139 126.593 1.00 13.47 ? 426 HIS D CG 1 +ATOM 13312 N ND1 . HIS C 1 406 ? 58.704 31.050 125.232 1.00 14.99 ? 426 HIS D ND1 1 +ATOM 13313 C CD2 . HIS C 1 406 ? 57.685 32.209 126.778 1.00 13.68 ? 426 HIS D CD2 1 +ATOM 13314 C CE1 . HIS C 1 406 ? 58.031 32.010 124.621 1.00 14.15 ? 426 HIS D CE1 1 +ATOM 13315 N NE2 . HIS C 1 406 ? 57.408 32.731 125.537 1.00 13.12 ? 426 HIS D NE2 1 +ATOM 13316 N N . MET C 1 407 ? 57.983 30.115 130.555 1.00 15.01 ? 427 MET D N 1 +ATOM 13317 C CA . MET C 1 407 ? 56.919 30.284 131.546 1.00 15.67 ? 427 MET D CA 1 +ATOM 13318 C C . MET C 1 407 ? 57.342 31.215 132.674 1.00 14.79 ? 427 MET D C 1 +ATOM 13319 O O . MET C 1 407 ? 56.537 31.995 133.161 1.00 14.74 ? 427 MET D O 1 +ATOM 13320 C CB . MET C 1 407 ? 56.510 28.921 132.129 1.00 15.51 ? 427 MET D CB 1 +ATOM 13321 C CG . MET C 1 407 ? 55.771 28.004 131.147 1.00 15.99 ? 427 MET D CG 1 +ATOM 13322 S SD . MET C 1 407 ? 55.543 26.323 131.792 1.00 20.00 ? 427 MET D SD 1 +ATOM 13323 C CE . MET C 1 407 ? 54.503 26.662 133.205 1.00 19.96 ? 427 MET D CE 1 +ATOM 13324 N N . GLN C 1 408 ? 58.603 31.124 133.095 1.00 14.56 ? 428 GLN D N 1 +ATOM 13325 C CA . GLN C 1 408 ? 59.119 31.996 134.145 1.00 14.84 ? 428 GLN D CA 1 +ATOM 13326 C C . GLN C 1 408 ? 59.204 33.441 133.679 1.00 14.24 ? 428 GLN D C 1 +ATOM 13327 O O . GLN C 1 408 ? 58.851 34.359 134.420 1.00 14.05 ? 428 GLN D O 1 +ATOM 13328 C CB . GLN C 1 408 ? 60.486 31.526 134.626 1.00 15.32 ? 428 GLN D CB 1 +ATOM 13329 C CG . GLN C 1 408 ? 60.415 30.279 135.476 1.00 19.01 ? 428 GLN D CG 1 +ATOM 13330 C CD . GLN C 1 408 ? 60.069 30.576 136.924 1.00 22.57 ? 428 GLN D CD 1 +ATOM 13331 O OE1 . GLN C 1 408 ? 58.975 31.051 137.229 1.00 26.20 ? 428 GLN D OE1 1 +ATOM 13332 N NE2 . GLN C 1 408 ? 61.005 30.287 137.831 1.00 25.92 ? 428 GLN D NE2 1 +ATOM 13333 N N . VAL C 1 409 ? 59.658 33.636 132.447 1.00 13.74 ? 429 VAL D N 1 +ATOM 13334 C CA . VAL C 1 409 ? 59.714 34.971 131.873 1.00 13.62 ? 429 VAL D CA 1 +ATOM 13335 C C . VAL C 1 409 ? 58.314 35.566 131.760 1.00 13.67 ? 429 VAL D C 1 +ATOM 13336 O O . VAL C 1 409 ? 58.103 36.726 132.140 1.00 13.45 ? 429 VAL D O 1 +ATOM 13337 C CB . VAL C 1 409 ? 60.415 34.986 130.505 1.00 13.36 ? 429 VAL D CB 1 +ATOM 13338 C CG1 . VAL C 1 409 ? 60.207 36.325 129.818 1.00 14.38 ? 429 VAL D CG1 1 +ATOM 13339 C CG2 . VAL C 1 409 ? 61.903 34.700 130.677 1.00 14.24 ? 429 VAL D CG2 1 +ATOM 13340 N N . MET C 1 410 ? 57.348 34.792 131.268 1.00 13.77 ? 430 MET D N 1 +ATOM 13341 C CA . MET C 1 410 ? 55.972 35.308 131.191 1.00 14.21 ? 430 MET D CA 1 +ATOM 13342 C C . MET C 1 410 ? 55.464 35.718 132.563 1.00 14.52 ? 430 MET D C 1 +ATOM 13343 O O . MET C 1 410 ? 54.808 36.757 132.701 1.00 14.02 ? 430 MET D O 1 +ATOM 13344 C CB . MET C 1 410 ? 54.999 34.309 130.559 1.00 14.33 ? 430 MET D CB 1 +ATOM 13345 C CG . MET C 1 410 ? 54.932 34.384 129.045 1.00 16.40 ? 430 MET D CG 1 +ATOM 13346 S SD . MET C 1 410 ? 54.567 36.040 128.436 1.00 16.73 ? 430 MET D SD 1 +ATOM 13347 C CE . MET C 1 410 ? 52.932 36.335 129.099 1.00 16.92 ? 430 MET D CE 1 +ATOM 13348 N N . GLU C 1 411 ? 55.775 34.913 133.575 1.00 14.58 ? 431 GLU D N 1 +ATOM 13349 C CA . GLU C 1 411 ? 55.462 35.270 134.968 1.00 15.11 ? 431 GLU D CA 1 +ATOM 13350 C C . GLU C 1 411 ? 56.055 36.610 135.379 1.00 13.92 ? 431 GLU D C 1 +ATOM 13351 O O . GLU C 1 411 ? 55.404 37.403 136.042 1.00 14.08 ? 431 GLU D O 1 +ATOM 13352 C CB . GLU C 1 411 ? 55.961 34.192 135.935 1.00 16.00 ? 431 GLU D CB 1 +ATOM 13353 C CG . GLU C 1 411 ? 55.058 33.020 136.026 1.00 19.20 ? 431 GLU D CG 1 +ATOM 13354 C CD . GLU C 1 411 ? 55.336 32.169 137.232 1.00 23.12 ? 431 GLU D CD 1 +ATOM 13355 O OE1 . GLU C 1 411 ? 55.247 32.704 138.371 1.00 25.70 ? 431 GLU D OE1 1 +ATOM 13356 O OE2 . GLU C 1 411 ? 55.632 30.972 137.033 1.00 26.18 ? 431 GLU D OE2 1 +ATOM 13357 N N . GLU C 1 412 ? 57.308 36.852 135.005 1.00 12.81 ? 432 GLU D N 1 +ATOM 13358 C CA . GLU C 1 412 ? 57.944 38.141 135.259 1.00 11.86 ? 432 GLU D CA 1 +ATOM 13359 C C . GLU C 1 412 ? 57.254 39.303 134.546 1.00 10.96 ? 432 GLU D C 1 +ATOM 13360 O O . GLU C 1 412 ? 57.048 40.349 135.130 1.00 10.02 ? 432 GLU D O 1 +ATOM 13361 C CB . GLU C 1 412 ? 59.418 38.099 134.846 1.00 12.35 ? 432 GLU D CB 1 +ATOM 13362 C CG . GLU C 1 412 ? 60.366 37.717 135.950 1.00 12.86 ? 432 GLU D CG 1 +ATOM 13363 C CD . GLU C 1 412 ? 61.825 37.859 135.512 1.00 12.76 ? 432 GLU D CD 1 +ATOM 13364 O OE1 . GLU C 1 412 ? 62.532 38.807 135.928 1.00 13.34 ? 432 GLU D OE1 1 +ATOM 13365 O OE2 . GLU C 1 412 ? 62.249 37.025 134.719 1.00 13.65 ? 432 GLU D OE2 1 +ATOM 13366 N N . VAL C 1 413 ? 56.879 39.090 133.293 1.00 11.02 ? 433 VAL D N 1 +ATOM 13367 C CA . VAL C 1 413 ? 56.206 40.102 132.492 1.00 10.82 ? 433 VAL D CA 1 +ATOM 13368 C C . VAL C 1 413 ? 54.866 40.462 133.134 1.00 10.77 ? 433 VAL D C 1 +ATOM 13369 O O . VAL C 1 413 ? 54.543 41.637 133.295 1.00 10.58 ? 433 VAL D O 1 +ATOM 13370 C CB . VAL C 1 413 ? 56.007 39.612 131.042 1.00 10.98 ? 433 VAL D CB 1 +ATOM 13371 C CG1 . VAL C 1 413 ? 55.148 40.593 130.242 1.00 11.02 ? 433 VAL D CG1 1 +ATOM 13372 C CG2 . VAL C 1 413 ? 57.360 39.391 130.358 1.00 11.64 ? 433 VAL D CG2 1 +ATOM 13373 N N . VAL C 1 414 ? 54.101 39.440 133.515 1.00 10.74 ? 434 VAL D N 1 +ATOM 13374 C CA . VAL C 1 414 ? 52.813 39.649 134.172 1.00 10.26 ? 434 VAL D CA 1 +ATOM 13375 C C . VAL C 1 414 ? 52.981 40.321 135.541 1.00 10.11 ? 434 VAL D C 1 +ATOM 13376 O O . VAL C 1 414 ? 52.270 41.271 135.868 1.00 9.40 ? 434 VAL D O 1 +ATOM 13377 C CB . VAL C 1 414 ? 52.039 38.328 134.306 1.00 10.32 ? 434 VAL D CB 1 +ATOM 13378 C CG1 . VAL C 1 414 ? 50.760 38.551 135.104 1.00 9.39 ? 434 VAL D CG1 1 +ATOM 13379 C CG2 . VAL C 1 414 ? 51.741 37.751 132.922 1.00 10.57 ? 434 VAL D CG2 1 +ATOM 13380 N N . ARG C 1 415 ? 53.950 39.874 136.334 1.00 10.22 ? 435 ARG D N 1 +ATOM 13381 C CA . ARG C 1 415 ? 54.195 40.544 137.604 1.00 10.02 ? 435 ARG D CA 1 +ATOM 13382 C C . ARG C 1 415 ? 54.398 42.045 137.395 1.00 10.00 ? 435 ARG D C 1 +ATOM 13383 O O . ARG C 1 415 ? 53.860 42.857 138.126 1.00 9.79 ? 435 ARG D O 1 +ATOM 13384 C CB . ARG C 1 415 ? 55.427 39.988 138.320 1.00 10.34 ? 435 ARG D CB 1 +ATOM 13385 C CG . ARG C 1 415 ? 55.766 40.760 139.587 1.00 10.95 ? 435 ARG D CG 1 +ATOM 13386 C CD . ARG C 1 415 ? 56.921 40.145 140.335 1.00 13.23 ? 435 ARG D CD 1 +ATOM 13387 N NE . ARG C 1 415 ? 58.180 40.237 139.599 1.00 12.67 ? 435 ARG D NE 1 +ATOM 13388 C CZ . ARG C 1 415 ? 59.340 39.758 140.042 1.00 14.16 ? 435 ARG D CZ 1 +ATOM 13389 N NH1 . ARG C 1 415 ? 59.409 39.149 141.226 1.00 13.86 ? 435 ARG D NH1 1 +ATOM 13390 N NH2 . ARG C 1 415 ? 60.431 39.864 139.302 1.00 14.36 ? 435 ARG D NH2 1 +ATOM 13391 N N . ARG C 1 416 ? 55.216 42.404 136.414 1.00 10.33 ? 436 ARG D N 1 +ATOM 13392 C CA . ARG C 1 416 ? 55.578 43.791 136.248 1.00 10.23 ? 436 ARG D CA 1 +ATOM 13393 C C . ARG C 1 416 ? 54.391 44.608 135.750 1.00 10.08 ? 436 ARG D C 1 +ATOM 13394 O O . ARG C 1 416 ? 54.179 45.726 136.209 1.00 9.81 ? 436 ARG D O 1 +ATOM 13395 C CB . ARG C 1 416 ? 56.764 43.932 135.301 1.00 10.28 ? 436 ARG D CB 1 +ATOM 13396 C CG . ARG C 1 416 ? 57.449 45.269 135.401 1.00 10.23 ? 436 ARG D CG 1 +ATOM 13397 C CD . ARG C 1 416 ? 58.397 45.522 134.232 1.00 9.92 ? 436 ARG D CD 1 +ATOM 13398 N NE . ARG C 1 416 ? 57.671 45.767 132.992 1.00 9.43 ? 436 ARG D NE 1 +ATOM 13399 C CZ . ARG C 1 416 ? 58.227 46.227 131.873 1.00 8.33 ? 436 ARG D CZ 1 +ATOM 13400 N NH1 . ARG C 1 416 ? 59.527 46.469 131.812 1.00 7.62 ? 436 ARG D NH1 1 +ATOM 13401 N NH2 . ARG C 1 416 ? 57.455 46.447 130.814 1.00 10.00 ? 436 ARG D NH2 1 +ATOM 13402 N N . ASP C 1 417 ? 53.594 44.046 134.841 1.00 10.34 ? 437 ASP D N 1 +ATOM 13403 C CA . ASP C 1 417 ? 52.659 44.863 134.063 1.00 10.65 ? 437 ASP D CA 1 +ATOM 13404 C C . ASP C 1 417 ? 51.184 44.613 134.301 1.00 10.92 ? 437 ASP D C 1 +ATOM 13405 O O . ASP C 1 417 ? 50.359 45.289 133.694 1.00 10.79 ? 437 ASP D O 1 +ATOM 13406 C CB . ASP C 1 417 ? 52.966 44.706 132.572 1.00 10.18 ? 437 ASP D CB 1 +ATOM 13407 C CG . ASP C 1 417 ? 54.268 45.378 132.181 1.00 11.48 ? 437 ASP D CG 1 +ATOM 13408 O OD1 . ASP C 1 417 ? 54.846 46.085 133.029 1.00 11.76 ? 437 ASP D OD1 1 +ATOM 13409 O OD2 . ASP C 1 417 ? 54.688 45.222 131.018 1.00 11.42 ? 437 ASP D OD2 1 +ATOM 13410 N N . LYS C 1 418 ? 50.870 43.651 135.176 1.00 11.28 ? 438 LYS D N 1 +ATOM 13411 C CA . LYS C 1 418 ? 49.485 43.248 135.478 1.00 11.63 ? 438 LYS D CA 1 +ATOM 13412 C C . LYS C 1 418 ? 48.508 44.359 135.855 1.00 11.75 ? 438 LYS D C 1 +ATOM 13413 O O . LYS C 1 418 ? 47.296 44.155 135.750 1.00 12.52 ? 438 LYS D O 1 +ATOM 13414 C CB . LYS C 1 418 ? 49.472 42.242 136.628 1.00 11.47 ? 438 LYS D CB 1 +ATOM 13415 C CG . LYS C 1 418 ? 50.154 42.744 137.891 1.00 13.09 ? 438 LYS D CG 1 +ATOM 13416 C CD . LYS C 1 418 ? 50.415 41.639 138.903 1.00 13.97 ? 438 LYS D CD 1 +ATOM 13417 C CE . LYS C 1 418 ? 51.005 42.231 140.187 1.00 16.23 ? 438 LYS D CE 1 +ATOM 13418 N NZ . LYS C 1 418 ? 50.936 41.292 141.346 1.00 17.42 ? 438 LYS D NZ 1 +ATOM 13419 N N . ASN C 1 419 ? 49.006 45.473 136.373 1.00 11.73 ? 439 ASN D N 1 +ATOM 13420 C CA . ASN C 1 419 ? 48.136 46.559 136.839 1.00 11.87 ? 439 ASN D CA 1 +ATOM 13421 C C . ASN C 1 419 ? 47.919 47.704 135.848 1.00 12.01 ? 439 ASN D C 1 +ATOM 13422 O O . ASN C 1 419 ? 47.241 48.675 136.183 1.00 11.59 ? 439 ASN D O 1 +ATOM 13423 C CB . ASN C 1 419 ? 48.648 47.099 138.173 1.00 11.85 ? 439 ASN D CB 1 +ATOM 13424 C CG . ASN C 1 419 ? 48.597 46.055 139.285 1.00 11.77 ? 439 ASN D CG 1 +ATOM 13425 O OD1 . ASN C 1 419 ? 47.583 45.378 139.478 1.00 15.10 ? 439 ASN D OD1 1 +ATOM 13426 N ND2 . ASN C 1 419 ? 49.693 45.919 140.013 1.00 12.35 ? 439 ASN D ND2 1 +ATOM 13427 N N . HIS C 1 420 ? 48.468 47.613 134.630 1.00 12.05 ? 440 HIS D N 1 +ATOM 13428 C CA . HIS C 1 420 ? 48.293 48.706 133.659 1.00 11.63 ? 440 HIS D CA 1 +ATOM 13429 C C . HIS C 1 420 ? 46.989 48.545 132.870 1.00 11.18 ? 440 HIS D C 1 +ATOM 13430 O O . HIS C 1 420 ? 46.859 47.607 132.093 1.00 11.29 ? 440 HIS D O 1 +ATOM 13431 C CB . HIS C 1 420 ? 49.453 48.761 132.653 1.00 12.11 ? 440 HIS D CB 1 +ATOM 13432 C CG . HIS C 1 420 ? 50.773 49.137 133.253 1.00 11.93 ? 440 HIS D CG 1 +ATOM 13433 N ND1 . HIS C 1 420 ? 51.055 50.411 133.688 1.00 12.51 ? 440 HIS D ND1 1 +ATOM 13434 C CD2 . HIS C 1 420 ? 51.892 48.407 133.475 1.00 14.10 ? 440 HIS D CD2 1 +ATOM 13435 C CE1 . HIS C 1 420 ? 52.289 50.454 134.155 1.00 12.10 ? 440 HIS D CE1 1 +ATOM 13436 N NE2 . HIS C 1 420 ? 52.822 49.251 134.036 1.00 12.09 ? 440 HIS D NE2 1 +ATOM 13437 N N . PRO C 1 421 ? 46.034 49.476 133.034 1.00 11.14 ? 441 PRO D N 1 +ATOM 13438 C CA . PRO C 1 421 ? 44.796 49.376 132.243 1.00 11.10 ? 441 PRO D CA 1 +ATOM 13439 C C . PRO C 1 421 ? 45.064 49.395 130.732 1.00 10.72 ? 441 PRO D C 1 +ATOM 13440 O O . PRO C 1 421 ? 44.342 48.766 129.958 1.00 10.31 ? 441 PRO D O 1 +ATOM 13441 C CB . PRO C 1 421 ? 44.008 50.614 132.665 1.00 11.46 ? 441 PRO D CB 1 +ATOM 13442 C CG . PRO C 1 421 ? 45.007 51.528 133.284 1.00 11.21 ? 441 PRO D CG 1 +ATOM 13443 C CD . PRO C 1 421 ? 46.020 50.649 133.920 1.00 11.23 ? 441 PRO D CD 1 +ATOM 13444 N N . ALA C 1 422 ? 46.121 50.081 130.312 1.00 9.84 ? 442 ALA D N 1 +ATOM 13445 C CA . ALA C 1 422 ? 46.437 50.126 128.884 1.00 9.58 ? 442 ALA D CA 1 +ATOM 13446 C C . ALA C 1 422 ? 46.769 48.758 128.284 1.00 9.49 ? 442 ALA D C 1 +ATOM 13447 O O . ALA C 1 422 ? 46.504 48.545 127.102 1.00 9.40 ? 442 ALA D O 1 +ATOM 13448 C CB . ALA C 1 422 ? 47.549 51.134 128.599 1.00 9.12 ? 442 ALA D CB 1 +ATOM 13449 N N . VAL C 1 423 ? 47.319 47.830 129.075 1.00 10.04 ? 443 VAL D N 1 +ATOM 13450 C CA . VAL C 1 423 ? 47.616 46.491 128.567 1.00 10.17 ? 443 VAL D CA 1 +ATOM 13451 C C . VAL C 1 423 ? 46.292 45.749 128.445 1.00 10.30 ? 443 VAL D C 1 +ATOM 13452 O O . VAL C 1 423 ? 45.617 45.501 129.449 1.00 10.72 ? 443 VAL D O 1 +ATOM 13453 C CB . VAL C 1 423 ? 48.596 45.711 129.457 1.00 10.36 ? 443 VAL D CB 1 +ATOM 13454 C CG1 . VAL C 1 423 ? 48.765 44.290 128.950 1.00 8.76 ? 443 VAL D CG1 1 +ATOM 13455 C CG2 . VAL C 1 423 ? 49.961 46.429 129.489 1.00 11.22 ? 443 VAL D CG2 1 +ATOM 13456 N N . VAL C 1 424 ? 45.905 45.451 127.215 1.00 10.13 ? 444 VAL D N 1 +ATOM 13457 C CA . VAL C 1 424 ? 44.665 44.729 126.953 1.00 10.31 ? 444 VAL D CA 1 +ATOM 13458 C C . VAL C 1 424 ? 44.879 43.282 126.467 1.00 9.84 ? 444 VAL D C 1 +ATOM 13459 O O . VAL C 1 424 ? 43.922 42.526 126.380 1.00 9.68 ? 444 VAL D O 1 +ATOM 13460 C CB . VAL C 1 424 ? 43.808 45.494 125.937 1.00 10.35 ? 444 VAL D CB 1 +ATOM 13461 C CG1 . VAL C 1 424 ? 43.485 46.895 126.477 1.00 10.37 ? 444 VAL D CG1 1 +ATOM 13462 C CG2 . VAL C 1 424 ? 44.527 45.596 124.591 1.00 11.24 ? 444 VAL D CG2 1 +ATOM 13463 N N . MET C 1 425 ? 46.106 42.886 126.139 1.00 9.40 ? 445 MET D N 1 +ATOM 13464 C CA . MET C 1 425 ? 46.359 41.503 125.706 1.00 9.50 ? 445 MET D CA 1 +ATOM 13465 C C . MET C 1 425 ? 47.828 41.151 125.882 1.00 9.97 ? 445 MET D C 1 +ATOM 13466 O O . MET C 1 425 ? 48.684 42.020 125.722 1.00 9.57 ? 445 MET D O 1 +ATOM 13467 C CB . MET C 1 425 ? 45.918 41.321 124.241 1.00 9.42 ? 445 MET D CB 1 +ATOM 13468 C CG . MET C 1 425 ? 46.138 39.936 123.647 1.00 10.79 ? 445 MET D CG 1 +ATOM 13469 S SD . MET C 1 425 ? 45.042 39.503 122.265 1.00 11.49 ? 445 MET D SD 1 +ATOM 13470 C CE . MET C 1 425 ? 45.520 40.718 121.024 1.00 12.73 ? 445 MET D CE 1 +ATOM 13471 N N . TRP C 1 426 ? 48.097 39.886 126.219 1.00 9.74 ? 446 TRP D N 1 +ATOM 13472 C CA . TRP C 1 426 ? 49.461 39.373 126.307 1.00 10.28 ? 446 TRP D CA 1 +ATOM 13473 C C . TRP C 1 426 ? 49.798 38.653 125.025 1.00 10.46 ? 446 TRP D C 1 +ATOM 13474 O O . TRP C 1 426 ? 48.986 37.857 124.534 1.00 9.97 ? 446 TRP D O 1 +ATOM 13475 C CB . TRP C 1 426 ? 49.609 38.372 127.453 1.00 10.36 ? 446 TRP D CB 1 +ATOM 13476 C CG . TRP C 1 426 ? 49.196 38.881 128.787 1.00 10.88 ? 446 TRP D CG 1 +ATOM 13477 C CD1 . TRP C 1 426 ? 48.101 38.494 129.507 1.00 10.34 ? 446 TRP D CD1 1 +ATOM 13478 C CD2 . TRP C 1 426 ? 49.867 39.870 129.576 1.00 10.90 ? 446 TRP D CD2 1 +ATOM 13479 N NE1 . TRP C 1 426 ? 48.048 39.182 130.690 1.00 10.27 ? 446 TRP D NE1 1 +ATOM 13480 C CE2 . TRP C 1 426 ? 49.116 40.039 130.757 1.00 10.95 ? 446 TRP D CE2 1 +ATOM 13481 C CE3 . TRP C 1 426 ? 51.021 40.650 129.394 1.00 10.71 ? 446 TRP D CE3 1 +ATOM 13482 C CZ2 . TRP C 1 426 ? 49.482 40.945 131.752 1.00 10.78 ? 446 TRP D CZ2 1 +ATOM 13483 C CZ3 . TRP C 1 426 ? 51.386 41.552 130.405 1.00 10.55 ? 446 TRP D CZ3 1 +ATOM 13484 C CH2 . TRP C 1 426 ? 50.613 41.689 131.560 1.00 10.60 ? 446 TRP D CH2 1 +ATOM 13485 N N . SER C 1 427 ? 51.006 38.880 124.511 1.00 9.60 ? 447 SER D N 1 +ATOM 13486 C CA . SER C 1 427 ? 51.558 38.044 123.436 1.00 9.96 ? 447 SER D CA 1 +ATOM 13487 C C . SER C 1 427 ? 52.780 37.282 123.928 1.00 9.30 ? 447 SER D C 1 +ATOM 13488 O O . SER C 1 427 ? 53.719 37.887 124.449 1.00 8.85 ? 447 SER D O 1 +ATOM 13489 C CB . SER C 1 427 ? 51.937 38.896 122.237 1.00 10.02 ? 447 SER D CB 1 +ATOM 13490 O OG . SER C 1 427 ? 52.658 38.128 121.302 1.00 10.72 ? 447 SER D OG 1 +ATOM 13491 N N . VAL C 1 428 ? 52.773 35.958 123.753 1.00 8.86 ? 448 VAL D N 1 +ATOM 13492 C CA . VAL C 1 428 ? 53.800 35.106 124.336 1.00 8.96 ? 448 VAL D CA 1 +ATOM 13493 C C . VAL C 1 428 ? 54.949 34.848 123.362 1.00 8.75 ? 448 VAL D C 1 +ATOM 13494 O O . VAL C 1 428 ? 55.973 34.325 123.763 1.00 9.60 ? 448 VAL D O 1 +ATOM 13495 C CB . VAL C 1 428 ? 53.220 33.753 124.816 1.00 9.75 ? 448 VAL D CB 1 +ATOM 13496 C CG1 . VAL C 1 428 ? 52.060 33.986 125.788 1.00 8.56 ? 448 VAL D CG1 1 +ATOM 13497 C CG2 . VAL C 1 428 ? 52.755 32.908 123.646 1.00 9.53 ? 448 VAL D CG2 1 +ATOM 13498 N N . ALA C 1 429 ? 54.770 35.190 122.087 1.00 8.55 ? 449 ALA D N 1 +ATOM 13499 C CA . ALA C 1 429 ? 55.818 34.971 121.085 1.00 8.36 ? 449 ALA D CA 1 +ATOM 13500 C C . ALA C 1 429 ? 55.537 35.712 119.790 1.00 8.35 ? 449 ALA D C 1 +ATOM 13501 O O . ALA C 1 429 ? 54.402 36.075 119.503 1.00 7.51 ? 449 ALA D O 1 +ATOM 13502 C CB . ALA C 1 429 ? 55.962 33.484 120.786 1.00 8.65 ? 449 ALA D CB 1 +ATOM 13503 N N . ASN C 1 430 ? 56.594 35.883 118.999 1.00 7.87 ? 450 ASN D N 1 +ATOM 13504 C CA . ASN C 1 430 ? 56.485 36.400 117.634 1.00 7.90 ? 450 ASN D CA 1 +ATOM 13505 C C . ASN C 1 430 ? 57.140 35.487 116.611 1.00 7.58 ? 450 ASN D C 1 +ATOM 13506 O O . ASN C 1 430 ? 58.338 35.222 116.687 1.00 6.30 ? 450 ASN D O 1 +ATOM 13507 C CB . ASN C 1 430 ? 57.135 37.776 117.526 1.00 8.12 ? 450 ASN D CB 1 +ATOM 13508 C CG . ASN C 1 430 ? 57.006 38.367 116.144 1.00 7.42 ? 450 ASN D CG 1 +ATOM 13509 O OD1 . ASN C 1 430 ? 55.940 38.822 115.746 1.00 7.37 ? 450 ASN D OD1 1 +ATOM 13510 N ND2 . ASN C 1 430 ? 58.093 38.360 115.402 1.00 7.53 ? 450 ASN D ND2 1 +ATOM 13511 N N . GLU C 1 431 ? 56.346 35.023 115.648 1.00 8.36 ? 451 GLU D N 1 +ATOM 13512 C CA . GLU C 1 431 ? 56.819 34.154 114.578 1.00 9.10 ? 451 GLU D CA 1 +ATOM 13513 C C . GLU C 1 431 ? 57.669 32.968 115.075 1.00 9.50 ? 451 GLU D C 1 +ATOM 13514 O O . GLU C 1 431 ? 58.751 32.686 114.542 1.00 9.44 ? 451 GLU D O 1 +ATOM 13515 C CB . GLU C 1 431 ? 57.568 34.974 113.525 1.00 9.28 ? 451 GLU D CB 1 +ATOM 13516 C CG . GLU C 1 431 ? 56.726 36.098 112.935 1.00 9.14 ? 451 GLU D CG 1 +ATOM 13517 C CD . GLU C 1 431 ? 57.437 36.888 111.860 1.00 9.42 ? 451 GLU D CD 1 +ATOM 13518 O OE1 . GLU C 1 431 ? 58.680 37.005 111.945 1.00 11.06 ? 451 GLU D OE1 1 +ATOM 13519 O OE2 . GLU C 1 431 ? 56.759 37.387 110.921 1.00 9.05 ? 451 GLU D OE2 1 +ATOM 13520 N N . PRO C 1 432 ? 57.162 32.238 116.078 1.00 9.97 ? 452 PRO D N 1 +ATOM 13521 C CA . PRO C 1 432 ? 57.815 30.970 116.412 1.00 10.29 ? 452 PRO D CA 1 +ATOM 13522 C C . PRO C 1 432 ? 57.617 29.959 115.293 1.00 10.30 ? 452 PRO D C 1 +ATOM 13523 O O . PRO C 1 432 ? 56.746 30.153 114.443 1.00 10.37 ? 452 PRO D O 1 +ATOM 13524 C CB . PRO C 1 432 ? 57.082 30.523 117.676 1.00 10.33 ? 452 PRO D CB 1 +ATOM 13525 C CG . PRO C 1 432 ? 55.714 31.145 117.555 1.00 9.46 ? 452 PRO D CG 1 +ATOM 13526 C CD . PRO C 1 432 ? 55.954 32.471 116.891 1.00 10.33 ? 452 PRO D CD 1 +ATOM 13527 N N . ALA C 1 433 ? 58.384 28.866 115.310 1.00 10.98 ? 453 ALA D N 1 +ATOM 13528 C CA . ALA C 1 433 ? 58.234 27.794 114.329 1.00 11.10 ? 453 ALA D CA 1 +ATOM 13529 C C . ALA C 1 433 ? 57.025 26.934 114.676 1.00 11.76 ? 453 ALA D C 1 +ATOM 13530 O O . ALA C 1 433 ? 57.158 25.747 114.965 1.00 11.99 ? 453 ALA D O 1 +ATOM 13531 C CB . ALA C 1 433 ? 59.475 26.946 114.297 1.00 11.13 ? 453 ALA D CB 1 +ATOM 13532 N N . SER C 1 434 ? 55.842 27.543 114.618 1.00 12.67 ? 454 SER D N 1 +ATOM 13533 C CA . SER C 1 434 ? 54.631 26.946 115.171 1.00 13.69 ? 454 SER D CA 1 +ATOM 13534 C C . SER C 1 434 ? 53.962 25.906 114.276 1.00 14.39 ? 454 SER D C 1 +ATOM 13535 O O . SER C 1 434 ? 52.952 25.334 114.666 1.00 14.49 ? 454 SER D O 1 +ATOM 13536 C CB . SER C 1 434 ? 53.626 28.040 115.559 1.00 13.99 ? 454 SER D CB 1 +ATOM 13537 O OG . SER C 1 434 ? 53.347 28.908 114.479 1.00 15.53 ? 454 SER D OG 1 +ATOM 13538 N N . HIS C 1 435 ? 54.524 25.670 113.092 1.00 15.17 ? 455 HIS D N 1 +ATOM 13539 C CA . HIS C 1 435 ? 54.189 24.501 112.278 1.00 16.00 ? 455 HIS D CA 1 +ATOM 13540 C C . HIS C 1 435 ? 54.679 23.191 112.906 1.00 16.55 ? 455 HIS D C 1 +ATOM 13541 O O . HIS C 1 435 ? 54.234 22.105 112.509 1.00 16.67 ? 455 HIS D O 1 +ATOM 13542 C CB . HIS C 1 435 ? 54.793 24.638 110.874 1.00 15.92 ? 455 HIS D CB 1 +ATOM 13543 C CG . HIS C 1 435 ? 56.289 24.696 110.869 1.00 16.52 ? 455 HIS D CG 1 +ATOM 13544 N ND1 . HIS C 1 435 ? 56.987 25.871 111.047 1.00 16.29 ? 455 HIS D ND1 1 +ATOM 13545 C CD2 . HIS C 1 435 ? 57.220 23.722 110.737 1.00 17.89 ? 455 HIS D CD2 1 +ATOM 13546 C CE1 . HIS C 1 435 ? 58.283 25.621 111.001 1.00 17.64 ? 455 HIS D CE1 1 +ATOM 13547 N NE2 . HIS C 1 435 ? 58.452 24.324 110.819 1.00 18.35 ? 455 HIS D NE2 1 +ATOM 13548 N N . LEU C 1 436 ? 55.622 23.286 113.846 1.00 17.37 ? 456 LEU D N 1 +ATOM 13549 C CA . LEU C 1 436 ? 56.168 22.120 114.535 1.00 17.90 ? 456 LEU D CA 1 +ATOM 13550 C C . LEU C 1 436 ? 55.215 21.665 115.637 1.00 18.14 ? 456 LEU D C 1 +ATOM 13551 O O . LEU C 1 436 ? 54.660 22.496 116.351 1.00 18.05 ? 456 LEU D O 1 +ATOM 13552 C CB . LEU C 1 436 ? 57.524 22.461 115.158 1.00 17.95 ? 456 LEU D CB 1 +ATOM 13553 C CG . LEU C 1 436 ? 58.641 22.909 114.222 1.00 18.03 ? 456 LEU D CG 1 +ATOM 13554 C CD1 . LEU C 1 436 ? 59.868 23.305 115.022 1.00 17.93 ? 456 LEU D CD1 1 +ATOM 13555 C CD2 . LEU C 1 436 ? 58.978 21.814 113.241 1.00 18.38 ? 456 LEU D CD2 1 +ATOM 13556 N N . GLU C 1 437 ? 55.031 20.352 115.783 1.00 18.77 ? 457 GLU D N 1 +ATOM 13557 C CA . GLU C 1 437 ? 54.145 19.840 116.839 1.00 18.74 ? 457 GLU D CA 1 +ATOM 13558 C C . GLU C 1 437 ? 54.749 20.130 118.214 1.00 17.84 ? 457 GLU D C 1 +ATOM 13559 O O . GLU C 1 437 ? 54.030 20.431 119.167 1.00 17.04 ? 457 GLU D O 1 +ATOM 13560 C CB . GLU C 1 437 ? 53.885 18.337 116.669 1.00 19.64 ? 457 GLU D CB 1 +ATOM 13561 C CG . GLU C 1 437 ? 53.181 17.971 115.365 1.00 22.08 ? 457 GLU D CG 1 +ATOM 13562 C CD . GLU C 1 437 ? 51.698 18.293 115.348 1.00 25.14 ? 457 GLU D CD 1 +ATOM 13563 O OE1 . GLU C 1 437 ? 51.128 18.648 116.408 1.00 28.07 ? 457 GLU D OE1 1 +ATOM 13564 O OE2 . GLU C 1 437 ? 51.086 18.170 114.261 1.00 28.16 ? 457 GLU D OE2 1 +ATOM 13565 N N . SER C 1 438 ? 56.071 20.055 118.323 1.00 17.17 ? 458 SER D N 1 +ATOM 13566 C CA . SER C 1 438 ? 56.723 20.393 119.587 1.00 16.87 ? 458 SER D CA 1 +ATOM 13567 C C . SER C 1 438 ? 56.376 21.835 119.977 1.00 16.50 ? 458 SER D C 1 +ATOM 13568 O O . SER C 1 438 ? 56.055 22.110 121.132 1.00 15.86 ? 458 SER D O 1 +ATOM 13569 C CB . SER C 1 438 ? 58.238 20.193 119.498 1.00 17.24 ? 458 SER D CB 1 +ATOM 13570 O OG . SER C 1 438 ? 58.812 21.022 118.506 1.00 18.22 ? 458 SER D OG 1 +ATOM 13571 N N . ALA C 1 439 ? 56.410 22.735 118.992 1.00 16.49 ? 459 ALA D N 1 +ATOM 13572 C CA . ALA C 1 439 ? 56.081 24.156 119.190 1.00 16.55 ? 459 ALA D CA 1 +ATOM 13573 C C . ALA C 1 439 ? 54.615 24.384 119.588 1.00 16.35 ? 459 ALA D C 1 +ATOM 13574 O O . ALA C 1 439 ? 54.310 25.290 120.348 1.00 16.99 ? 459 ALA D O 1 +ATOM 13575 C CB . ALA C 1 439 ? 56.406 24.945 117.930 1.00 16.73 ? 459 ALA D CB 1 +ATOM 13576 N N . GLY C 1 440 ? 53.709 23.578 119.047 1.00 16.67 ? 460 GLY D N 1 +ATOM 13577 C CA . GLY C 1 440 ? 52.295 23.669 119.401 1.00 16.26 ? 460 GLY D CA 1 +ATOM 13578 C C . GLY C 1 440 ? 52.054 23.398 120.878 1.00 15.87 ? 460 GLY D C 1 +ATOM 13579 O O . GLY C 1 440 ? 51.333 24.151 121.554 1.00 16.07 ? 460 GLY D O 1 +ATOM 13580 N N . TYR C 1 441 ? 52.663 22.324 121.376 1.00 15.76 ? 461 TYR D N 1 +ATOM 13581 C CA . TYR C 1 441 ? 52.560 21.961 122.792 1.00 14.85 ? 461 TYR D CA 1 +ATOM 13582 C C . TYR C 1 441 ? 53.170 23.075 123.641 1.00 13.69 ? 461 TYR D C 1 +ATOM 13583 O O . TYR C 1 441 ? 52.559 23.572 124.577 1.00 12.80 ? 461 TYR D O 1 +ATOM 13584 C CB . TYR C 1 441 ? 53.273 20.635 123.067 1.00 16.02 ? 461 TYR D CB 1 +ATOM 13585 C CG . TYR C 1 441 ? 53.308 20.281 124.541 1.00 16.67 ? 461 TYR D CG 1 +ATOM 13586 C CD1 . TYR C 1 441 ? 52.224 19.656 125.152 1.00 17.49 ? 461 TYR D CD1 1 +ATOM 13587 C CD2 . TYR C 1 441 ? 54.407 20.606 125.328 1.00 17.41 ? 461 TYR D CD2 1 +ATOM 13588 C CE1 . TYR C 1 441 ? 52.246 19.340 126.502 1.00 18.11 ? 461 TYR D CE1 1 +ATOM 13589 C CE2 . TYR C 1 441 ? 54.439 20.294 126.677 1.00 18.10 ? 461 TYR D CE2 1 +ATOM 13590 C CZ . TYR C 1 441 ? 53.352 19.668 127.259 1.00 17.65 ? 461 TYR D CZ 1 +ATOM 13591 O OH . TYR C 1 441 ? 53.385 19.368 128.602 1.00 18.31 ? 461 TYR D OH 1 +ATOM 13592 N N . TYR C 1 442 ? 54.388 23.452 123.285 1.00 12.46 ? 462 TYR D N 1 +ATOM 13593 C CA . TYR C 1 442 ? 55.107 24.532 123.929 1.00 11.73 ? 462 TYR D CA 1 +ATOM 13594 C C . TYR C 1 442 ? 54.205 25.761 124.069 1.00 11.57 ? 462 TYR D C 1 +ATOM 13595 O O . TYR C 1 442 ? 54.013 26.294 125.175 1.00 11.04 ? 462 TYR D O 1 +ATOM 13596 C CB . TYR C 1 442 ? 56.337 24.842 123.064 1.00 11.39 ? 462 TYR D CB 1 +ATOM 13597 C CG . TYR C 1 442 ? 57.303 25.893 123.547 1.00 10.24 ? 462 TYR D CG 1 +ATOM 13598 C CD1 . TYR C 1 442 ? 57.035 27.245 123.343 1.00 10.18 ? 462 TYR D CD1 1 +ATOM 13599 C CD2 . TYR C 1 442 ? 58.532 25.547 124.113 1.00 8.99 ? 462 TYR D CD2 1 +ATOM 13600 C CE1 . TYR C 1 442 ? 57.899 28.199 123.732 1.00 10.50 ? 462 TYR D CE1 1 +ATOM 13601 C CE2 . TYR C 1 442 ? 59.429 26.522 124.495 1.00 9.15 ? 462 TYR D CE2 1 +ATOM 13602 C CZ . TYR C 1 442 ? 59.097 27.861 124.298 1.00 10.24 ? 462 TYR D CZ 1 +ATOM 13603 O OH . TYR C 1 442 ? 59.961 28.871 124.669 1.00 9.02 ? 462 TYR D OH 1 +ATOM 13604 N N . LEU C 1 443 ? 53.629 26.201 122.952 1.00 11.45 ? 463 LEU D N 1 +ATOM 13605 C CA . LEU C 1 443 ? 52.823 27.427 122.962 1.00 11.48 ? 463 LEU D CA 1 +ATOM 13606 C C . LEU C 1 443 ? 51.525 27.208 123.729 1.00 11.83 ? 463 LEU D C 1 +ATOM 13607 O O . LEU C 1 443 ? 51.086 28.087 124.451 1.00 12.05 ? 463 LEU D O 1 +ATOM 13608 C CB . LEU C 1 443 ? 52.542 27.932 121.543 1.00 11.60 ? 463 LEU D CB 1 +ATOM 13609 C CG . LEU C 1 443 ? 53.766 28.436 120.773 1.00 11.20 ? 463 LEU D CG 1 +ATOM 13610 C CD1 . LEU C 1 443 ? 53.466 28.329 119.293 1.00 12.28 ? 463 LEU D CD1 1 +ATOM 13611 C CD2 . LEU C 1 443 ? 54.112 29.864 121.198 1.00 13.20 ? 463 LEU D CD2 1 +ATOM 13612 N N . LYS C 1 444 ? 50.926 26.026 123.589 1.00 12.36 ? 464 LYS D N 1 +ATOM 13613 C CA . LYS C 1 444 ? 49.754 25.668 124.392 1.00 12.47 ? 464 LYS D CA 1 +ATOM 13614 C C . LYS C 1 444 ? 50.030 25.911 125.870 1.00 12.03 ? 464 LYS D C 1 +ATOM 13615 O O . LYS C 1 444 ? 49.214 26.484 126.589 1.00 11.97 ? 464 LYS D O 1 +ATOM 13616 C CB . LYS C 1 444 ? 49.398 24.198 124.204 1.00 12.75 ? 464 LYS D CB 1 +ATOM 13617 C CG . LYS C 1 444 ? 48.142 23.800 124.940 1.00 13.71 ? 464 LYS D CG 1 +ATOM 13618 C CD . LYS C 1 444 ? 47.747 22.385 124.633 1.00 15.64 ? 464 LYS D CD 1 +ATOM 13619 C CE A LYS C 1 444 ? 48.477 21.408 125.527 0.50 15.54 ? 464 LYS D CE 1 +ATOM 13620 C CE B LYS C 1 444 ? 48.455 21.386 125.513 0.50 15.26 ? 464 LYS D CE 1 +ATOM 13621 N NZ A LYS C 1 444 ? 47.901 21.376 126.900 0.50 16.63 ? 464 LYS D NZ 1 +ATOM 13622 N NZ B LYS C 1 444 ? 47.799 20.050 125.405 0.50 15.73 ? 464 LYS D NZ 1 +ATOM 13623 N N . MET C 1 445 ? 51.193 25.472 126.323 1.00 12.18 ? 465 MET D N 1 +ATOM 13624 C CA . MET C 1 445 ? 51.498 25.512 127.750 1.00 12.44 ? 465 MET D CA 1 +ATOM 13625 C C . MET C 1 445 ? 51.906 26.877 128.259 1.00 11.63 ? 465 MET D C 1 +ATOM 13626 O O . MET C 1 445 ? 51.512 27.249 129.363 1.00 11.45 ? 465 MET D O 1 +ATOM 13627 C CB . MET C 1 445 ? 52.529 24.444 128.102 1.00 12.96 ? 465 MET D CB 1 +ATOM 13628 C CG . MET C 1 445 ? 52.023 23.032 127.835 1.00 14.54 ? 465 MET D CG 1 +ATOM 13629 S SD . MET C 1 445 ? 50.544 22.586 128.792 1.00 17.86 ? 465 MET D SD 1 +ATOM 13630 C CE . MET C 1 445 ? 49.247 23.681 128.237 1.00 22.25 ? 465 MET D CE 1 +ATOM 13631 N N . VAL C 1 446 ? 52.667 27.638 127.466 1.00 11.09 ? 466 VAL D N 1 +ATOM 13632 C CA . VAL C 1 446 ? 52.997 29.020 127.834 1.00 10.83 ? 466 VAL D CA 1 +ATOM 13633 C C . VAL C 1 446 ? 51.715 29.865 127.890 1.00 10.19 ? 466 VAL D C 1 +ATOM 13634 O O . VAL C 1 446 ? 51.510 30.630 128.820 1.00 10.41 ? 466 VAL D O 1 +ATOM 13635 C CB . VAL C 1 446 ? 54.012 29.637 126.853 1.00 10.97 ? 466 VAL D CB 1 +ATOM 13636 C CG1 . VAL C 1 446 ? 54.261 31.109 127.174 1.00 12.37 ? 466 VAL D CG1 1 +ATOM 13637 C CG2 . VAL C 1 446 ? 55.301 28.853 126.876 1.00 11.64 ? 466 VAL D CG2 1 +ATOM 13638 N N . ILE C 1 447 ? 50.829 29.686 126.917 1.00 10.15 ? 467 ILE D N 1 +ATOM 13639 C CA . ILE C 1 447 ? 49.563 30.414 126.900 1.00 9.96 ? 467 ILE D CA 1 +ATOM 13640 C C . ILE C 1 447 ? 48.709 30.029 128.115 1.00 10.21 ? 467 ILE D C 1 +ATOM 13641 O O . ILE C 1 447 ? 48.154 30.892 128.787 1.00 9.59 ? 467 ILE D O 1 +ATOM 13642 C CB . ILE C 1 447 ? 48.781 30.178 125.575 1.00 9.83 ? 467 ILE D CB 1 +ATOM 13643 C CG1 . ILE C 1 447 ? 49.506 30.866 124.407 1.00 10.58 ? 467 ILE D CG1 1 +ATOM 13644 C CG2 . ILE C 1 447 ? 47.355 30.700 125.689 1.00 10.87 ? 467 ILE D CG2 1 +ATOM 13645 C CD1 . ILE C 1 447 ? 48.946 30.542 123.042 1.00 9.87 ? 467 ILE D CD1 1 +ATOM 13646 N N . ALA C 1 448 ? 48.605 28.731 128.403 1.00 10.27 ? 468 ALA D N 1 +ATOM 13647 C CA . ALA C 1 448 ? 47.814 28.291 129.567 1.00 10.65 ? 468 ALA D CA 1 +ATOM 13648 C C . ALA C 1 448 ? 48.408 28.843 130.864 1.00 11.09 ? 468 ALA D C 1 +ATOM 13649 O O . ALA C 1 448 ? 47.685 29.288 131.748 1.00 11.52 ? 468 ALA D O 1 +ATOM 13650 C CB . ALA C 1 448 ? 47.726 26.756 129.618 1.00 10.53 ? 468 ALA D CB 1 +ATOM 13651 N N . HIS C 1 449 ? 49.731 28.827 130.971 1.00 11.48 ? 469 HIS D N 1 +ATOM 13652 C CA . HIS C 1 449 ? 50.390 29.390 132.139 1.00 11.62 ? 469 HIS D CA 1 +ATOM 13653 C C . HIS C 1 449 ? 50.013 30.860 132.315 1.00 11.59 ? 469 HIS D C 1 +ATOM 13654 O O . HIS C 1 449 ? 49.646 31.302 133.413 1.00 12.17 ? 469 HIS D O 1 +ATOM 13655 C CB . HIS C 1 449 ? 51.903 29.254 132.009 1.00 11.91 ? 469 HIS D CB 1 +ATOM 13656 C CG . HIS C 1 449 ? 52.644 29.572 133.268 1.00 11.48 ? 469 HIS D CG 1 +ATOM 13657 N ND1 . HIS C 1 449 ? 52.529 28.807 134.408 1.00 14.96 ? 469 HIS D ND1 1 +ATOM 13658 C CD2 . HIS C 1 449 ? 53.523 30.560 133.563 1.00 14.74 ? 469 HIS D CD2 1 +ATOM 13659 C CE1 . HIS C 1 449 ? 53.308 29.306 135.351 1.00 14.61 ? 469 HIS D CE1 1 +ATOM 13660 N NE2 . HIS C 1 449 ? 53.918 30.371 134.866 1.00 14.60 ? 469 HIS D NE2 1 +ATOM 13661 N N . THR C 1 450 ? 50.097 31.621 131.224 1.00 11.51 ? 470 THR D N 1 +ATOM 13662 C CA . THR C 1 450 ? 49.797 33.044 131.260 1.00 11.77 ? 470 THR D CA 1 +ATOM 13663 C C . THR C 1 450 ? 48.356 33.239 131.719 1.00 11.78 ? 470 THR D C 1 +ATOM 13664 O O . THR C 1 450 ? 48.100 34.001 132.637 1.00 11.59 ? 470 THR D O 1 +ATOM 13665 C CB . THR C 1 450 ? 50.017 33.719 129.883 1.00 11.58 ? 470 THR D CB 1 +ATOM 13666 O OG1 . THR C 1 450 ? 51.358 33.461 129.443 1.00 11.45 ? 470 THR D OG1 1 +ATOM 13667 C CG2 . THR C 1 450 ? 49.788 35.229 129.951 1.00 12.30 ? 470 THR D CG2 1 +ATOM 13668 N N . LYS C 1 451 ? 47.431 32.519 131.098 1.00 12.24 ? 471 LYS D N 1 +ATOM 13669 C CA . LYS C 1 451 ? 46.022 32.625 131.475 1.00 13.07 ? 471 LYS D CA 1 +ATOM 13670 C C . LYS C 1 451 ? 45.781 32.351 132.966 1.00 13.11 ? 471 LYS D C 1 +ATOM 13671 O O . LYS C 1 451 ? 44.937 33.014 133.603 1.00 13.82 ? 471 LYS D O 1 +ATOM 13672 C CB . LYS C 1 451 ? 45.163 31.697 130.620 1.00 13.20 ? 471 LYS D CB 1 +ATOM 13673 C CG . LYS C 1 451 ? 45.077 32.135 129.166 1.00 13.82 ? 471 LYS D CG 1 +ATOM 13674 C CD . LYS C 1 451 ? 44.191 31.204 128.346 1.00 14.39 ? 471 LYS D CD 1 +ATOM 13675 C CE . LYS C 1 451 ? 43.718 31.895 127.069 1.00 15.04 ? 471 LYS D CE 1 +ATOM 13676 N NZ . LYS C 1 451 ? 42.673 31.069 126.388 1.00 14.78 ? 471 LYS D NZ 1 +ATOM 13677 N N . SER C 1 452 ? 46.528 31.399 133.516 1.00 13.25 ? 472 SER D N 1 +ATOM 13678 C CA . SER C 1 452 ? 46.401 31.027 134.928 1.00 13.33 ? 472 SER D CA 1 +ATOM 13679 C C . SER C 1 452 ? 46.952 32.103 135.858 1.00 13.45 ? 472 SER D C 1 +ATOM 13680 O O . SER C 1 452 ? 46.597 32.152 137.026 1.00 14.35 ? 472 SER D O 1 +ATOM 13681 C CB . SER C 1 452 ? 47.103 29.693 135.211 1.00 13.48 ? 472 SER D CB 1 +ATOM 13682 O OG . SER C 1 452 ? 48.502 29.866 135.352 1.00 13.78 ? 472 SER D OG 1 +ATOM 13683 N N . LEU C 1 453 ? 47.843 32.953 135.346 1.00 12.73 ? 473 LEU D N 1 +ATOM 13684 C CA . LEU C 1 453 ? 48.433 34.028 136.142 1.00 13.04 ? 473 LEU D CA 1 +ATOM 13685 C C . LEU C 1 453 ? 47.586 35.294 136.178 1.00 12.94 ? 473 LEU D C 1 +ATOM 13686 O O . LEU C 1 453 ? 47.644 36.034 137.147 1.00 13.17 ? 473 LEU D O 1 +ATOM 13687 C CB . LEU C 1 453 ? 49.800 34.413 135.589 1.00 13.34 ? 473 LEU D CB 1 +ATOM 13688 C CG . LEU C 1 453 ? 50.857 33.321 135.671 1.00 13.36 ? 473 LEU D CG 1 +ATOM 13689 C CD1 . LEU C 1 453 ? 52.065 33.749 134.860 1.00 14.14 ? 473 LEU D CD1 1 +ATOM 13690 C CD2 . LEU C 1 453 ? 51.232 33.052 137.123 1.00 15.66 ? 473 LEU D CD2 1 +ATOM 13691 N N . ASP C 1 454 ? 46.815 35.536 135.121 1.00 12.66 ? 474 ASP D N 1 +ATOM 13692 C CA . ASP C 1 454 ? 46.013 36.760 135.017 1.00 12.77 ? 474 ASP D CA 1 +ATOM 13693 C C . ASP C 1 454 ? 44.666 36.432 134.381 1.00 12.55 ? 474 ASP D C 1 +ATOM 13694 O O . ASP C 1 454 ? 44.594 36.153 133.187 1.00 12.98 ? 474 ASP D O 1 +ATOM 13695 C CB . ASP C 1 454 ? 46.763 37.804 134.185 1.00 13.17 ? 474 ASP D CB 1 +ATOM 13696 C CG . ASP C 1 454 ? 45.951 39.057 133.947 1.00 12.51 ? 474 ASP D CG 1 +ATOM 13697 O OD1 . ASP C 1 454 ? 45.008 39.316 134.715 1.00 11.68 ? 474 ASP D OD1 1 +ATOM 13698 O OD2 . ASP C 1 454 ? 46.234 39.778 132.962 1.00 12.50 ? 474 ASP D OD2 1 +ATOM 13699 N N . PRO C 1 455 ? 43.592 36.452 135.182 1.00 12.41 ? 475 PRO D N 1 +ATOM 13700 C CA . PRO C 1 455 ? 42.281 36.099 134.647 1.00 12.24 ? 475 PRO D CA 1 +ATOM 13701 C C . PRO C 1 455 ? 41.632 37.184 133.773 1.00 12.37 ? 475 PRO D C 1 +ATOM 13702 O O . PRO C 1 455 ? 40.590 36.930 133.164 1.00 12.48 ? 475 PRO D O 1 +ATOM 13703 C CB . PRO C 1 455 ? 41.453 35.884 135.915 1.00 12.11 ? 475 PRO D CB 1 +ATOM 13704 C CG . PRO C 1 455 ? 42.043 36.771 136.910 1.00 13.01 ? 475 PRO D CG 1 +ATOM 13705 C CD . PRO C 1 455 ? 43.529 36.748 136.619 1.00 12.23 ? 475 PRO D CD 1 +ATOM 13706 N N . SER C 1 456 ? 42.251 38.359 133.696 1.00 12.36 ? 476 SER D N 1 +ATOM 13707 C CA . SER C 1 456 ? 41.593 39.567 133.199 1.00 12.30 ? 476 SER D CA 1 +ATOM 13708 C C . SER C 1 456 ? 41.870 39.922 131.737 1.00 12.03 ? 476 SER D C 1 +ATOM 13709 O O . SER C 1 456 ? 41.221 40.812 131.204 1.00 11.67 ? 476 SER D O 1 +ATOM 13710 C CB . SER C 1 456 ? 41.988 40.771 134.065 1.00 12.56 ? 476 SER D CB 1 +ATOM 13711 O OG . SER C 1 456 ? 43.369 41.078 133.941 1.00 13.14 ? 476 SER D OG 1 +ATOM 13712 N N . ARG C 1 457 ? 42.847 39.277 131.111 1.00 11.47 ? 477 ARG D N 1 +ATOM 13713 C CA . ARG C 1 457 ? 43.227 39.600 129.740 1.00 11.31 ? 477 ARG D CA 1 +ATOM 13714 C C . ARG C 1 457 ? 43.298 38.405 128.807 1.00 11.09 ? 477 ARG D C 1 +ATOM 13715 O O . ARG C 1 457 ? 43.662 37.307 129.224 1.00 11.54 ? 477 ARG D O 1 +ATOM 13716 C CB . ARG C 1 457 ? 44.602 40.273 129.727 1.00 10.97 ? 477 ARG D CB 1 +ATOM 13717 C CG . ARG C 1 457 ? 44.637 41.595 130.458 1.00 10.34 ? 477 ARG D CG 1 +ATOM 13718 C CD . ARG C 1 457 ? 46.061 42.153 130.481 1.00 8.86 ? 477 ARG D CD 1 +ATOM 13719 N NE . ARG C 1 457 ? 46.162 43.440 131.172 1.00 10.72 ? 477 ARG D NE 1 +ATOM 13720 C CZ . ARG C 1 457 ? 46.335 43.598 132.482 1.00 11.91 ? 477 ARG D CZ 1 +ATOM 13721 N NH1 . ARG C 1 457 ? 46.427 42.552 133.291 1.00 10.71 ? 477 ARG D NH1 1 +ATOM 13722 N NH2 . ARG C 1 457 ? 46.414 44.819 132.986 1.00 10.39 ? 477 ARG D NH2 1 +ATOM 13723 N N . PRO C 1 458 ? 42.991 38.627 127.516 1.00 10.74 ? 478 PRO D N 1 +ATOM 13724 C CA . PRO C 1 458 ? 43.215 37.589 126.520 1.00 10.38 ? 478 PRO D CA 1 +ATOM 13725 C C . PRO C 1 458 ? 44.705 37.352 126.271 1.00 10.00 ? 478 PRO D C 1 +ATOM 13726 O O . PRO C 1 458 ? 45.529 38.172 126.673 1.00 10.07 ? 478 PRO D O 1 +ATOM 13727 C CB . PRO C 1 458 ? 42.512 38.136 125.273 1.00 10.50 ? 478 PRO D CB 1 +ATOM 13728 C CG . PRO C 1 458 ? 42.484 39.608 125.466 1.00 10.61 ? 478 PRO D CG 1 +ATOM 13729 C CD . PRO C 1 458 ? 42.383 39.840 126.931 1.00 10.85 ? 478 PRO D CD 1 +ATOM 13730 N N . VAL C 1 459 ? 45.033 36.225 125.652 1.00 9.26 ? 479 VAL D N 1 +ATOM 13731 C CA . VAL C 1 459 ? 46.423 35.870 125.335 1.00 9.55 ? 479 VAL D CA 1 +ATOM 13732 C C . VAL C 1 459 ? 46.539 35.390 123.892 1.00 9.82 ? 479 VAL D C 1 +ATOM 13733 O O . VAL C 1 459 ? 45.642 34.716 123.373 1.00 10.27 ? 479 VAL D O 1 +ATOM 13734 C CB . VAL C 1 459 ? 46.950 34.767 126.277 1.00 9.14 ? 479 VAL D CB 1 +ATOM 13735 C CG1 . VAL C 1 459 ? 48.453 34.519 126.056 1.00 9.73 ? 479 VAL D CG1 1 +ATOM 13736 C CG2 . VAL C 1 459 ? 46.699 35.140 127.714 1.00 7.43 ? 479 VAL D CG2 1 +ATOM 13737 N N . THR C 1 460 ? 47.656 35.734 123.261 1.00 10.05 ? 480 THR D N 1 +ATOM 13738 C CA . THR C 1 460 ? 47.911 35.381 121.868 1.00 10.36 ? 480 THR D CA 1 +ATOM 13739 C C . THR C 1 460 ? 49.401 35.152 121.668 1.00 10.36 ? 480 THR D C 1 +ATOM 13740 O O . THR C 1 460 ? 50.210 35.299 122.594 1.00 10.22 ? 480 THR D O 1 +ATOM 13741 C CB . THR C 1 460 ? 47.423 36.494 120.899 1.00 10.72 ? 480 THR D CB 1 +ATOM 13742 O OG1 . THR C 1 460 ? 47.491 36.048 119.528 1.00 11.33 ? 480 THR D OG1 1 +ATOM 13743 C CG2 . THR C 1 460 ? 48.269 37.794 121.062 1.00 9.63 ? 480 THR D CG2 1 +ATOM 13744 N N . PHE C 1 461 ? 49.740 34.755 120.451 1.00 10.85 ? 481 PHE D N 1 +ATOM 13745 C CA . PHE C 1 461 ? 51.095 34.899 119.930 1.00 10.63 ? 481 PHE D CA 1 +ATOM 13746 C C . PHE C 1 461 ? 50.932 35.311 118.469 1.00 10.64 ? 481 PHE D C 1 +ATOM 13747 O O . PHE C 1 461 ? 49.909 34.992 117.834 1.00 10.76 ? 481 PHE D O 1 +ATOM 13748 C CB . PHE C 1 461 ? 51.898 33.598 120.084 1.00 11.46 ? 481 PHE D CB 1 +ATOM 13749 C CG . PHE C 1 461 ? 51.577 32.552 119.063 1.00 10.83 ? 481 PHE D CG 1 +ATOM 13750 C CD1 . PHE C 1 461 ? 50.545 31.656 119.268 1.00 11.52 ? 481 PHE D CD1 1 +ATOM 13751 C CD2 . PHE C 1 461 ? 52.305 32.475 117.888 1.00 11.80 ? 481 PHE D CD2 1 +ATOM 13752 C CE1 . PHE C 1 461 ? 50.259 30.683 118.313 1.00 12.43 ? 481 PHE D CE1 1 +ATOM 13753 C CE2 . PHE C 1 461 ? 52.024 31.524 116.941 1.00 12.01 ? 481 PHE D CE2 1 +ATOM 13754 C CZ . PHE C 1 461 ? 50.998 30.630 117.144 1.00 11.98 ? 481 PHE D CZ 1 +ATOM 13755 N N . VAL C 1 462 ? 51.932 36.020 117.949 1.00 9.69 ? 482 VAL D N 1 +ATOM 13756 C CA . VAL C 1 462 ? 51.893 36.529 116.584 1.00 9.67 ? 482 VAL D CA 1 +ATOM 13757 C C . VAL C 1 462 ? 52.569 35.552 115.620 1.00 10.02 ? 482 VAL D C 1 +ATOM 13758 O O . VAL C 1 462 ? 53.700 35.096 115.849 1.00 10.18 ? 482 VAL D O 1 +ATOM 13759 C CB . VAL C 1 462 ? 52.539 37.933 116.499 1.00 9.46 ? 482 VAL D CB 1 +ATOM 13760 C CG1 . VAL C 1 462 ? 52.506 38.425 115.065 1.00 9.30 ? 482 VAL D CG1 1 +ATOM 13761 C CG2 . VAL C 1 462 ? 51.830 38.896 117.468 1.00 9.80 ? 482 VAL D CG2 1 +ATOM 13762 N N . SER C 1 463 ? 51.869 35.221 114.540 1.00 10.46 ? 483 SER D N 1 +ATOM 13763 C CA . SER C 1 463 ? 52.262 34.099 113.676 1.00 10.93 ? 483 SER D CA 1 +ATOM 13764 C C . SER C 1 463 ? 52.503 34.518 112.227 1.00 11.11 ? 483 SER D C 1 +ATOM 13765 O O . SER C 1 463 ? 51.790 35.355 111.695 1.00 11.13 ? 483 SER D O 1 +ATOM 13766 C CB . SER C 1 463 ? 51.160 33.037 113.695 1.00 11.21 ? 483 SER D CB 1 +ATOM 13767 O OG . SER C 1 463 ? 51.549 31.859 113.019 1.00 12.66 ? 483 SER D OG 1 +ATOM 13768 N N . ASN C 1 464 ? 53.519 33.922 111.608 1.00 11.51 ? 484 ASN D N 1 +ATOM 13769 C CA . ASN C 1 464 ? 53.690 33.969 110.165 1.00 11.78 ? 484 ASN D CA 1 +ATOM 13770 C C . ASN C 1 464 ? 53.531 32.566 109.539 1.00 12.25 ? 484 ASN D C 1 +ATOM 13771 O O . ASN C 1 464 ? 53.995 32.329 108.429 1.00 12.57 ? 484 ASN D O 1 +ATOM 13772 C CB . ASN C 1 464 ? 55.046 34.584 109.781 1.00 11.48 ? 484 ASN D CB 1 +ATOM 13773 C CG . ASN C 1 464 ? 56.227 33.739 110.225 1.00 11.13 ? 484 ASN D CG 1 +ATOM 13774 O OD1 . ASN C 1 464 ? 56.066 32.738 110.913 1.00 9.20 ? 484 ASN D OD1 1 +ATOM 13775 N ND2 . ASN C 1 464 ? 57.440 34.148 109.828 1.00 10.68 ? 484 ASN D ND2 1 +ATOM 13776 N N . SER C 1 465 ? 52.870 31.649 110.250 1.00 12.83 ? 485 SER D N 1 +ATOM 13777 C CA . SER C 1 465 ? 52.686 30.277 109.765 1.00 13.14 ? 485 SER D CA 1 +ATOM 13778 C C . SER C 1 465 ? 51.574 30.207 108.741 1.00 13.93 ? 485 SER D C 1 +ATOM 13779 O O . SER C 1 465 ? 50.732 31.112 108.661 1.00 13.93 ? 485 SER D O 1 +ATOM 13780 C CB . SER C 1 465 ? 52.338 29.331 110.916 1.00 12.68 ? 485 SER D CB 1 +ATOM 13781 O OG . SER C 1 465 ? 53.348 29.329 111.896 1.00 13.42 ? 485 SER D OG 1 +ATOM 13782 N N . ASN C 1 466 ? 51.577 29.132 107.960 1.00 14.48 ? 486 ASN D N 1 +ATOM 13783 C CA . ASN C 1 466 ? 50.461 28.828 107.067 1.00 15.40 ? 486 ASN D CA 1 +ATOM 13784 C C . ASN C 1 466 ? 49.273 28.377 107.915 1.00 15.59 ? 486 ASN D C 1 +ATOM 13785 O O . ASN C 1 466 ? 49.440 27.598 108.859 1.00 16.04 ? 486 ASN D O 1 +ATOM 13786 C CB . ASN C 1 466 ? 50.870 27.740 106.058 1.00 15.60 ? 486 ASN D CB 1 +ATOM 13787 C CG . ASN C 1 466 ? 49.711 27.262 105.217 1.00 17.00 ? 486 ASN D CG 1 +ATOM 13788 O OD1 . ASN C 1 466 ? 48.908 26.450 105.664 1.00 19.88 ? 486 ASN D OD1 1 +ATOM 13789 N ND2 . ASN C 1 466 ? 49.624 27.751 103.989 1.00 20.31 ? 486 ASN D ND2 1 +ATOM 13790 N N . TYR C 1 467 ? 48.078 28.854 107.569 1.00 16.22 ? 487 TYR D N 1 +ATOM 13791 C CA . TYR C 1 467 ? 46.873 28.605 108.366 1.00 16.48 ? 487 TYR D CA 1 +ATOM 13792 C C . TYR C 1 467 ? 46.646 27.111 108.658 1.00 16.89 ? 487 TYR D C 1 +ATOM 13793 O O . TYR C 1 467 ? 46.186 26.738 109.748 1.00 16.71 ? 487 TYR D O 1 +ATOM 13794 C CB . TYR C 1 467 ? 45.644 29.208 107.667 1.00 16.65 ? 487 TYR D CB 1 +ATOM 13795 C CG . TYR C 1 467 ? 45.086 28.357 106.538 1.00 16.38 ? 487 TYR D CG 1 +ATOM 13796 C CD1 . TYR C 1 467 ? 45.669 28.358 105.276 1.00 16.72 ? 487 TYR D CD1 1 +ATOM 13797 C CD2 . TYR C 1 467 ? 43.976 27.543 106.743 1.00 17.55 ? 487 TYR D CD2 1 +ATOM 13798 C CE1 . TYR C 1 467 ? 45.150 27.574 104.243 1.00 17.87 ? 487 TYR D CE1 1 +ATOM 13799 C CE2 . TYR C 1 467 ? 43.463 26.760 105.728 1.00 16.59 ? 487 TYR D CE2 1 +ATOM 13800 C CZ . TYR C 1 467 ? 44.048 26.774 104.487 1.00 17.12 ? 487 TYR D CZ 1 +ATOM 13801 O OH . TYR C 1 467 ? 43.519 25.973 103.494 1.00 18.07 ? 487 TYR D OH 1 +ATOM 13802 N N . ALA C 1 468 ? 46.969 26.262 107.688 1.00 16.91 ? 488 ALA D N 1 +ATOM 13803 C CA . ALA C 1 468 ? 46.726 24.827 107.817 1.00 17.04 ? 488 ALA D CA 1 +ATOM 13804 C C . ALA C 1 468 ? 47.751 24.127 108.701 1.00 17.27 ? 488 ALA D C 1 +ATOM 13805 O O . ALA C 1 468 ? 47.485 23.032 109.203 1.00 16.50 ? 488 ALA D O 1 +ATOM 13806 C CB . ALA C 1 468 ? 46.699 24.179 106.429 1.00 17.32 ? 488 ALA D CB 1 +ATOM 13807 N N . ALA C 1 469 ? 48.917 24.751 108.876 1.00 16.72 ? 489 ALA D N 1 +ATOM 13808 C CA . ALA C 1 469 ? 50.060 24.119 109.514 1.00 16.61 ? 489 ALA D CA 1 +ATOM 13809 C C . ALA C 1 469 ? 50.259 24.592 110.949 1.00 16.28 ? 489 ALA D C 1 +ATOM 13810 O O . ALA C 1 469 ? 50.924 23.926 111.732 1.00 16.01 ? 489 ALA D O 1 +ATOM 13811 C CB . ALA C 1 469 ? 51.323 24.389 108.689 1.00 16.94 ? 489 ALA D CB 1 +ATOM 13812 N N . ASP C 1 470 ? 49.673 25.734 111.293 1.00 15.78 ? 490 ASP D N 1 +ATOM 13813 C CA . ASP C 1 470 ? 49.909 26.358 112.593 1.00 15.62 ? 490 ASP D CA 1 +ATOM 13814 C C . ASP C 1 470 ? 49.358 25.538 113.775 1.00 15.66 ? 490 ASP D C 1 +ATOM 13815 O O . ASP C 1 470 ? 48.150 25.537 114.032 1.00 16.36 ? 490 ASP D O 1 +ATOM 13816 C CB . ASP C 1 470 ? 49.315 27.765 112.614 1.00 15.34 ? 490 ASP D CB 1 +ATOM 13817 C CG . ASP C 1 470 ? 49.837 28.598 113.759 1.00 15.37 ? 490 ASP D CG 1 +ATOM 13818 O OD1 . ASP C 1 470 ? 50.230 28.008 114.796 1.00 14.53 ? 490 ASP D OD1 1 +ATOM 13819 O OD2 . ASP C 1 470 ? 49.874 29.838 113.605 1.00 11.93 ? 490 ASP D OD2 1 +ATOM 13820 N N . LYS C 1 471 ? 50.262 24.898 114.514 1.00 15.79 ? 491 LYS D N 1 +ATOM 13821 C CA . LYS C 1 471 ? 49.885 24.033 115.643 1.00 16.29 ? 491 LYS D CA 1 +ATOM 13822 C C . LYS C 1 471 ? 49.607 24.806 116.933 1.00 15.99 ? 491 LYS D C 1 +ATOM 13823 O O . LYS C 1 471 ? 49.110 24.221 117.902 1.00 16.37 ? 491 LYS D O 1 +ATOM 13824 C CB . LYS C 1 471 ? 50.952 22.961 115.891 1.00 16.29 ? 491 LYS D CB 1 +ATOM 13825 C CG . LYS C 1 471 ? 51.264 22.075 114.681 1.00 17.89 ? 491 LYS D CG 1 +ATOM 13826 C CD . LYS C 1 471 ? 50.058 21.286 114.182 1.00 20.74 ? 491 LYS D CD 1 +ATOM 13827 C CE . LYS C 1 471 ? 50.301 20.717 112.779 1.00 23.04 ? 491 LYS D CE 1 +ATOM 13828 N NZ . LYS C 1 471 ? 49.086 20.045 112.228 1.00 24.33 ? 491 LYS D NZ 1 +ATOM 13829 N N . GLY C 1 472 ? 49.939 26.100 116.951 1.00 15.26 ? 492 GLY D N 1 +ATOM 13830 C CA . GLY C 1 472 ? 49.662 26.977 118.093 1.00 15.00 ? 492 GLY D CA 1 +ATOM 13831 C C . GLY C 1 472 ? 48.354 27.739 117.981 1.00 14.64 ? 492 GLY D C 1 +ATOM 13832 O O . GLY C 1 472 ? 47.809 28.214 118.984 1.00 15.04 ? 492 GLY D O 1 +ATOM 13833 N N . ALA C 1 473 ? 47.841 27.858 116.757 1.00 13.89 ? 493 ALA D N 1 +ATOM 13834 C CA . ALA C 1 473 ? 46.643 28.651 116.469 1.00 13.78 ? 493 ALA D CA 1 +ATOM 13835 C C . ALA C 1 473 ? 45.414 28.284 117.304 1.00 13.48 ? 493 ALA D C 1 +ATOM 13836 O O . ALA C 1 473 ? 44.660 29.164 117.708 1.00 13.40 ? 493 ALA D O 1 +ATOM 13837 C CB . ALA C 1 473 ? 46.302 28.562 114.978 1.00 13.78 ? 493 ALA D CB 1 +ATOM 13838 N N . PRO C 1 474 ? 45.195 26.981 117.559 1.00 13.26 ? 494 PRO D N 1 +ATOM 13839 C CA . PRO C 1 474 ? 44.006 26.672 118.358 1.00 13.00 ? 494 PRO D CA 1 +ATOM 13840 C C . PRO C 1 474 ? 43.934 27.325 119.736 1.00 12.89 ? 494 PRO D C 1 +ATOM 13841 O O . PRO C 1 474 ? 42.837 27.513 120.239 1.00 12.69 ? 494 PRO D O 1 +ATOM 13842 C CB . PRO C 1 474 ? 44.079 25.155 118.508 1.00 13.31 ? 494 PRO D CB 1 +ATOM 13843 C CG . PRO C 1 474 ? 44.836 24.701 117.333 1.00 12.87 ? 494 PRO D CG 1 +ATOM 13844 C CD . PRO C 1 474 ? 45.891 25.755 117.134 1.00 13.40 ? 494 PRO D CD 1 +ATOM 13845 N N . TYR C 1 475 ? 45.084 27.667 120.326 1.00 12.59 ? 495 TYR D N 1 +ATOM 13846 C CA . TYR C 1 475 ? 45.145 28.106 121.723 1.00 12.89 ? 495 TYR D CA 1 +ATOM 13847 C C . TYR C 1 475 ? 45.090 29.620 121.937 1.00 12.35 ? 495 TYR D C 1 +ATOM 13848 O O . TYR C 1 475 ? 44.979 30.073 123.073 1.00 12.22 ? 495 TYR D O 1 +ATOM 13849 C CB . TYR C 1 475 ? 46.398 27.508 122.377 1.00 13.50 ? 495 TYR D CB 1 +ATOM 13850 C CG . TYR C 1 475 ? 46.444 26.011 122.156 1.00 14.37 ? 495 TYR D CG 1 +ATOM 13851 C CD1 . TYR C 1 475 ? 45.582 25.169 122.848 1.00 15.27 ? 495 TYR D CD1 1 +ATOM 13852 C CD2 . TYR C 1 475 ? 47.274 25.451 121.199 1.00 14.42 ? 495 TYR D CD2 1 +ATOM 13853 C CE1 . TYR C 1 475 ? 45.576 23.809 122.629 1.00 15.41 ? 495 TYR D CE1 1 +ATOM 13854 C CE2 . TYR C 1 475 ? 47.273 24.070 120.969 1.00 16.23 ? 495 TYR D CE2 1 +ATOM 13855 C CZ . TYR C 1 475 ? 46.412 23.260 121.689 1.00 14.83 ? 495 TYR D CZ 1 +ATOM 13856 O OH . TYR C 1 475 ? 46.397 21.887 121.492 1.00 17.83 ? 495 TYR D OH 1 +ATOM 13857 N N . VAL C 1 476 ? 45.169 30.410 120.867 1.00 12.62 ? 496 VAL D N 1 +ATOM 13858 C CA . VAL C 1 476 ? 45.136 31.873 121.010 1.00 12.49 ? 496 VAL D CA 1 +ATOM 13859 C C . VAL C 1 476 ? 43.693 32.360 121.097 1.00 12.88 ? 496 VAL D C 1 +ATOM 13860 O O . VAL C 1 476 ? 42.787 31.739 120.519 1.00 13.19 ? 496 VAL D O 1 +ATOM 13861 C CB . VAL C 1 476 ? 45.880 32.608 119.855 1.00 12.47 ? 496 VAL D CB 1 +ATOM 13862 C CG1 . VAL C 1 476 ? 47.320 32.119 119.764 1.00 12.62 ? 496 VAL D CG1 1 +ATOM 13863 C CG2 . VAL C 1 476 ? 45.158 32.424 118.515 1.00 12.60 ? 496 VAL D CG2 1 +ATOM 13864 N N . ASP C 1 477 ? 43.483 33.443 121.839 1.00 12.89 ? 497 ASP D N 1 +ATOM 13865 C CA . ASP C 1 477 ? 42.158 34.059 121.974 1.00 12.97 ? 497 ASP D CA 1 +ATOM 13866 C C . ASP C 1 477 ? 41.862 34.984 120.798 1.00 12.67 ? 497 ASP D C 1 +ATOM 13867 O O . ASP C 1 477 ? 40.700 35.175 120.416 1.00 12.90 ? 497 ASP D O 1 +ATOM 13868 C CB . ASP C 1 477 ? 42.078 34.850 123.276 1.00 12.99 ? 497 ASP D CB 1 +ATOM 13869 C CG . ASP C 1 477 ? 42.213 33.969 124.490 1.00 14.94 ? 497 ASP D CG 1 +ATOM 13870 O OD1 . ASP C 1 477 ? 41.873 32.762 124.378 1.00 15.05 ? 497 ASP D OD1 1 +ATOM 13871 O OD2 . ASP C 1 477 ? 42.657 34.486 125.537 1.00 12.22 ? 497 ASP D OD2 1 +ATOM 13872 N N . VAL C 1 478 ? 42.927 35.534 120.224 1.00 11.90 ? 498 VAL D N 1 +ATOM 13873 C CA . VAL C 1 478 ? 42.848 36.379 119.029 1.00 11.71 ? 498 VAL D CA 1 +ATOM 13874 C C . VAL C 1 478 ? 43.973 35.955 118.081 1.00 11.50 ? 498 VAL D C 1 +ATOM 13875 O O . VAL C 1 478 ? 45.120 35.798 118.505 1.00 10.85 ? 498 VAL D O 1 +ATOM 13876 C CB . VAL C 1 478 ? 43.002 37.878 119.375 1.00 11.78 ? 498 VAL D CB 1 +ATOM 13877 C CG1 . VAL C 1 478 ? 43.074 38.716 118.097 1.00 11.98 ? 498 VAL D CG1 1 +ATOM 13878 C CG2 . VAL C 1 478 ? 41.853 38.354 120.266 1.00 11.30 ? 498 VAL D CG2 1 +ATOM 13879 N N . ILE C 1 479 ? 43.641 35.766 116.806 1.00 11.04 ? 499 ILE D N 1 +ATOM 13880 C CA . ILE C 1 479 ? 44.627 35.386 115.797 1.00 10.83 ? 499 ILE D CA 1 +ATOM 13881 C C . ILE C 1 479 ? 45.353 36.643 115.289 1.00 10.85 ? 499 ILE D C 1 +ATOM 13882 O O . ILE C 1 479 ? 44.729 37.570 114.777 1.00 10.78 ? 499 ILE D O 1 +ATOM 13883 C CB . ILE C 1 479 ? 43.972 34.629 114.621 1.00 11.01 ? 499 ILE D CB 1 +ATOM 13884 C CG1 . ILE C 1 479 ? 43.477 33.251 115.081 1.00 11.41 ? 499 ILE D CG1 1 +ATOM 13885 C CG2 . ILE C 1 479 ? 44.950 34.431 113.472 1.00 9.67 ? 499 ILE D CG2 1 +ATOM 13886 C CD1 . ILE C 1 479 ? 42.536 32.608 114.082 1.00 15.37 ? 499 ILE D CD1 1 +ATOM 13887 N N . CYS C 1 480 ? 46.677 36.647 115.448 1.00 10.79 ? 500 CYS D N 1 +ATOM 13888 C CA . CYS C 1 480 ? 47.539 37.721 114.983 1.00 10.61 ? 500 CYS D CA 1 +ATOM 13889 C C . CYS C 1 480 ? 48.436 37.246 113.838 1.00 10.30 ? 500 CYS D C 1 +ATOM 13890 O O . CYS C 1 480 ? 49.244 36.323 114.010 1.00 9.79 ? 500 CYS D O 1 +ATOM 13891 C CB . CYS C 1 480 ? 48.382 38.226 116.143 1.00 10.45 ? 500 CYS D CB 1 +ATOM 13892 S SG . CYS C 1 480 ? 47.411 39.064 117.430 1.00 11.58 ? 500 CYS D SG 1 +ATOM 13893 N N . LEU C 1 481 ? 48.273 37.880 112.678 1.00 9.42 ? 501 LEU D N 1 +ATOM 13894 C CA . LEU C 1 481 ? 48.885 37.428 111.430 1.00 9.24 ? 501 LEU D CA 1 +ATOM 13895 C C . LEU C 1 481 ? 49.843 38.467 110.858 1.00 9.13 ? 501 LEU D C 1 +ATOM 13896 O O . LEU C 1 481 ? 49.471 39.627 110.665 1.00 8.91 ? 501 LEU D O 1 +ATOM 13897 C CB . LEU C 1 481 ? 47.806 37.162 110.387 1.00 9.51 ? 501 LEU D CB 1 +ATOM 13898 C CG . LEU C 1 481 ? 46.717 36.147 110.753 1.00 9.39 ? 501 LEU D CG 1 +ATOM 13899 C CD1 . LEU C 1 481 ? 45.724 35.961 109.603 1.00 11.40 ? 501 LEU D CD1 1 +ATOM 13900 C CD2 . LEU C 1 481 ? 47.365 34.838 111.123 1.00 10.35 ? 501 LEU D CD2 1 +ATOM 13901 N N . ASN C 1 482 ? 51.062 38.032 110.565 1.00 8.95 ? 502 ASN D N 1 +ATOM 13902 C CA . ASN C 1 482 ? 52.041 38.820 109.819 1.00 9.11 ? 502 ASN D CA 1 +ATOM 13903 C C . ASN C 1 482 ? 52.101 38.416 108.346 1.00 8.72 ? 502 ASN D C 1 +ATOM 13904 O O . ASN C 1 482 ? 52.331 37.257 108.038 1.00 9.62 ? 502 ASN D O 1 +ATOM 13905 C CB . ASN C 1 482 ? 53.442 38.614 110.400 1.00 8.63 ? 502 ASN D CB 1 +ATOM 13906 C CG . ASN C 1 482 ? 53.561 39.046 111.845 1.00 9.35 ? 502 ASN D CG 1 +ATOM 13907 O OD1 . ASN C 1 482 ? 52.684 39.721 112.391 1.00 11.01 ? 502 ASN D OD1 1 +ATOM 13908 N ND2 . ASN C 1 482 ? 54.680 38.672 112.472 1.00 7.85 ? 502 ASN D ND2 1 +ATOM 13909 N N . SER C 1 483 ? 51.937 39.380 107.434 1.00 8.91 ? 503 SER D N 1 +ATOM 13910 C CA . SER C 1 483 ? 52.118 39.100 106.001 1.00 9.09 ? 503 SER D CA 1 +ATOM 13911 C C . SER C 1 483 ? 52.613 40.344 105.267 1.00 9.12 ? 503 SER D C 1 +ATOM 13912 O O . SER C 1 483 ? 52.286 41.466 105.642 1.00 9.59 ? 503 SER D O 1 +ATOM 13913 C CB . SER C 1 483 ? 50.820 38.576 105.367 1.00 9.09 ? 503 SER D CB 1 +ATOM 13914 O OG . SER C 1 483 ? 49.800 39.563 105.339 1.00 9.25 ? 503 SER D OG 1 +ATOM 13915 N N . TYR C 1 484 ? 53.394 40.120 104.211 1.00 8.99 ? 504 TYR D N 1 +ATOM 13916 C CA . TYR C 1 484 ? 54.020 41.210 103.463 1.00 8.75 ? 504 TYR D CA 1 +ATOM 13917 C C . TYR C 1 484 ? 53.936 40.911 101.975 1.00 8.51 ? 504 TYR D C 1 +ATOM 13918 O O . TYR C 1 484 ? 54.960 40.836 101.290 1.00 9.40 ? 504 TYR D O 1 +ATOM 13919 C CB . TYR C 1 484 ? 55.485 41.314 103.846 1.00 8.20 ? 504 TYR D CB 1 +ATOM 13920 C CG . TYR C 1 484 ? 55.773 41.774 105.251 1.00 8.82 ? 504 TYR D CG 1 +ATOM 13921 C CD1 . TYR C 1 484 ? 55.777 40.889 106.322 1.00 8.25 ? 504 TYR D CD1 1 +ATOM 13922 C CD2 . TYR C 1 484 ? 56.077 43.098 105.498 1.00 6.96 ? 504 TYR D CD2 1 +ATOM 13923 C CE1 . TYR C 1 484 ? 56.073 41.324 107.622 1.00 8.89 ? 504 TYR D CE1 1 +ATOM 13924 C CE2 . TYR C 1 484 ? 56.355 43.551 106.771 1.00 8.02 ? 504 TYR D CE2 1 +ATOM 13925 C CZ . TYR C 1 484 ? 56.361 42.670 107.835 1.00 7.19 ? 504 TYR D CZ 1 +ATOM 13926 O OH . TYR C 1 484 ? 56.684 43.171 109.080 1.00 8.22 ? 504 TYR D OH 1 +ATOM 13927 N N . TYR C 1 485 ? 52.716 40.726 101.475 1.00 8.07 ? 505 TYR D N 1 +ATOM 13928 C CA . TYR C 1 485 ? 52.503 40.373 100.074 1.00 8.36 ? 505 TYR D CA 1 +ATOM 13929 C C . TYR C 1 485 ? 53.104 41.429 99.143 1.00 8.52 ? 505 TYR D C 1 +ATOM 13930 O O . TYR C 1 485 ? 53.007 42.626 99.419 1.00 8.62 ? 505 TYR D O 1 +ATOM 13931 C CB . TYR C 1 485 ? 51.006 40.174 99.790 1.00 8.10 ? 505 TYR D CB 1 +ATOM 13932 C CG . TYR C 1 485 ? 50.398 39.124 100.688 1.00 8.05 ? 505 TYR D CG 1 +ATOM 13933 C CD1 . TYR C 1 485 ? 50.943 37.845 100.747 1.00 7.93 ? 505 TYR D CD1 1 +ATOM 13934 C CD2 . TYR C 1 485 ? 49.312 39.410 101.508 1.00 8.69 ? 505 TYR D CD2 1 +ATOM 13935 C CE1 . TYR C 1 485 ? 50.421 36.866 101.592 1.00 7.88 ? 505 TYR D CE1 1 +ATOM 13936 C CE2 . TYR C 1 485 ? 48.772 38.419 102.358 1.00 9.31 ? 505 TYR D CE2 1 +ATOM 13937 C CZ . TYR C 1 485 ? 49.330 37.156 102.379 1.00 9.15 ? 505 TYR D CZ 1 +ATOM 13938 O OH . TYR C 1 485 ? 48.845 36.156 103.195 1.00 10.27 ? 505 TYR D OH 1 +ATOM 13939 N N . SER C 1 486 ? 53.720 40.951 98.058 1.00 8.96 ? 506 SER D N 1 +ATOM 13940 C CA . SER C 1 486 ? 54.522 41.761 97.110 1.00 9.12 ? 506 SER D CA 1 +ATOM 13941 C C . SER C 1 486 ? 55.880 42.209 97.649 1.00 9.60 ? 506 SER D C 1 +ATOM 13942 O O . SER C 1 486 ? 56.706 42.691 96.872 1.00 9.48 ? 506 SER D O 1 +ATOM 13943 C CB . SER C 1 486 ? 53.753 42.971 96.565 1.00 9.10 ? 506 SER D CB 1 +ATOM 13944 O OG . SER C 1 486 ? 53.860 44.086 97.413 1.00 8.47 ? 506 SER D OG 1 +ATOM 13945 N N . TRP C 1 487 ? 56.112 42.057 98.954 1.00 10.22 ? 507 TRP D N 1 +ATOM 13946 C CA . TRP C 1 487 ? 57.402 42.459 99.550 1.00 10.00 ? 507 TRP D CA 1 +ATOM 13947 C C . TRP C 1 487 ? 58.347 41.268 99.792 1.00 11.32 ? 507 TRP D C 1 +ATOM 13948 O O . TRP C 1 487 ? 59.495 41.283 99.319 1.00 11.34 ? 507 TRP D O 1 +ATOM 13949 C CB . TRP C 1 487 ? 57.234 43.273 100.854 1.00 10.23 ? 507 TRP D CB 1 +ATOM 13950 C CG . TRP C 1 487 ? 58.598 43.717 101.232 1.00 8.69 ? 507 TRP D CG 1 +ATOM 13951 C CD1 . TRP C 1 487 ? 59.496 43.044 102.002 1.00 9.78 ? 507 TRP D CD1 1 +ATOM 13952 C CD2 . TRP C 1 487 ? 59.296 44.829 100.680 1.00 9.55 ? 507 TRP D CD2 1 +ATOM 13953 N NE1 . TRP C 1 487 ? 60.706 43.699 102.009 1.00 8.13 ? 507 TRP D NE1 1 +ATOM 13954 C CE2 . TRP C 1 487 ? 60.607 44.802 101.198 1.00 8.56 ? 507 TRP D CE2 1 +ATOM 13955 C CE3 . TRP C 1 487 ? 58.936 45.860 99.807 1.00 9.44 ? 507 TRP D CE3 1 +ATOM 13956 C CZ2 . TRP C 1 487 ? 61.542 45.759 100.868 1.00 8.86 ? 507 TRP D CZ2 1 +ATOM 13957 C CZ3 . TRP C 1 487 ? 59.856 46.818 99.500 1.00 8.99 ? 507 TRP D CZ3 1 +ATOM 13958 C CH2 . TRP C 1 487 ? 61.142 46.770 100.029 1.00 8.94 ? 507 TRP D CH2 1 +ATOM 13959 N N . TYR C 1 488 ? 57.907 40.279 100.579 1.00 10.84 ? 508 TYR D N 1 +ATOM 13960 C CA . TYR C 1 488 ? 58.735 39.091 100.864 1.00 11.65 ? 508 TYR D CA 1 +ATOM 13961 C C . TYR C 1 488 ? 58.538 37.966 99.849 1.00 11.79 ? 508 TYR D C 1 +ATOM 13962 O O . TYR C 1 488 ? 59.232 36.941 99.894 1.00 11.98 ? 508 TYR D O 1 +ATOM 13963 C CB . TYR C 1 488 ? 58.479 38.579 102.285 1.00 12.00 ? 508 TYR D CB 1 +ATOM 13964 C CG . TYR C 1 488 ? 59.156 39.373 103.388 1.00 12.28 ? 508 TYR D CG 1 +ATOM 13965 C CD1 . TYR C 1 488 ? 60.492 39.782 103.277 1.00 13.42 ? 508 TYR D CD1 1 +ATOM 13966 C CD2 . TYR C 1 488 ? 58.494 39.654 104.569 1.00 13.38 ? 508 TYR D CD2 1 +ATOM 13967 C CE1 . TYR C 1 488 ? 61.110 40.468 104.285 1.00 12.74 ? 508 TYR D CE1 1 +ATOM 13968 C CE2 . TYR C 1 488 ? 59.120 40.355 105.594 1.00 13.16 ? 508 TYR D CE2 1 +ATOM 13969 C CZ . TYR C 1 488 ? 60.430 40.758 105.442 1.00 12.88 ? 508 TYR D CZ 1 +ATOM 13970 O OH . TYR C 1 488 ? 61.059 41.458 106.461 1.00 13.24 ? 508 TYR D OH 1 +ATOM 13971 N N . HIS C 1 489 ? 57.579 38.158 98.948 1.00 11.97 ? 509 HIS D N 1 +ATOM 13972 C CA . HIS C 1 489 ? 57.347 37.264 97.822 1.00 12.40 ? 509 HIS D CA 1 +ATOM 13973 C C . HIS C 1 489 ? 56.670 38.044 96.710 1.00 11.30 ? 509 HIS D C 1 +ATOM 13974 O O . HIS C 1 489 ? 56.052 39.080 96.970 1.00 11.13 ? 509 HIS D O 1 +ATOM 13975 C CB . HIS C 1 489 ? 56.491 36.054 98.237 1.00 13.58 ? 509 HIS D CB 1 +ATOM 13976 C CG . HIS C 1 489 ? 55.853 36.203 99.580 1.00 15.27 ? 509 HIS D CG 1 +ATOM 13977 N ND1 . HIS C 1 489 ? 54.729 36.974 99.791 1.00 17.44 ? 509 HIS D ND1 1 +ATOM 13978 C CD2 . HIS C 1 489 ? 56.207 35.713 100.793 1.00 17.93 ? 509 HIS D CD2 1 +ATOM 13979 C CE1 . HIS C 1 489 ? 54.412 36.941 101.074 1.00 18.56 ? 509 HIS D CE1 1 +ATOM 13980 N NE2 . HIS C 1 489 ? 55.301 36.196 101.706 1.00 18.17 ? 509 HIS D NE2 1 +ATOM 13981 N N . ASP C 1 490 ? 56.772 37.526 95.489 1.00 11.15 ? 510 ASP D N 1 +ATOM 13982 C CA . ASP C 1 490 ? 56.203 38.150 94.305 1.00 10.41 ? 510 ASP D CA 1 +ATOM 13983 C C . ASP C 1 490 ? 56.658 39.586 94.261 1.00 9.96 ? 510 ASP D C 1 +ATOM 13984 O O . ASP C 1 490 ? 55.850 40.496 94.190 1.00 9.19 ? 510 ASP D O 1 +ATOM 13985 C CB . ASP C 1 490 ? 54.679 38.089 94.317 1.00 10.62 ? 510 ASP D CB 1 +ATOM 13986 C CG . ASP C 1 490 ? 54.152 36.680 94.539 1.00 10.65 ? 510 ASP D CG 1 +ATOM 13987 O OD1 . ASP C 1 490 ? 54.538 35.747 93.805 1.00 10.82 ? 510 ASP D OD1 1 +ATOM 13988 O OD2 . ASP C 1 490 ? 53.353 36.529 95.474 1.00 13.04 ? 510 ASP D OD2 1 +ATOM 13989 N N . TYR C 1 491 ? 57.974 39.772 94.297 1.00 9.77 ? 511 TYR D N 1 +ATOM 13990 C CA . TYR C 1 491 ? 58.555 41.081 94.493 1.00 9.96 ? 511 TYR D CA 1 +ATOM 13991 C C . TYR C 1 491 ? 58.011 42.134 93.532 1.00 9.81 ? 511 TYR D C 1 +ATOM 13992 O O . TYR C 1 491 ? 58.085 41.964 92.316 1.00 9.32 ? 511 TYR D O 1 +ATOM 13993 C CB . TYR C 1 491 ? 60.086 41.000 94.363 1.00 10.48 ? 511 TYR D CB 1 +ATOM 13994 C CG . TYR C 1 491 ? 60.712 39.931 95.217 1.00 10.56 ? 511 TYR D CG 1 +ATOM 13995 C CD1 . TYR C 1 491 ? 60.387 39.807 96.561 1.00 8.98 ? 511 TYR D CD1 1 +ATOM 13996 C CD2 . TYR C 1 491 ? 61.667 39.051 94.686 1.00 11.21 ? 511 TYR D CD2 1 +ATOM 13997 C CE1 . TYR C 1 491 ? 60.979 38.843 97.350 1.00 11.26 ? 511 TYR D CE1 1 +ATOM 13998 C CE2 . TYR C 1 491 ? 62.253 38.076 95.473 1.00 11.76 ? 511 TYR D CE2 1 +ATOM 13999 C CZ . TYR C 1 491 ? 61.902 37.970 96.799 1.00 12.21 ? 511 TYR D CZ 1 +ATOM 14000 O OH . TYR C 1 491 ? 62.489 36.995 97.571 1.00 12.12 ? 511 TYR D OH 1 +ATOM 14001 N N . GLY C 1 492 ? 57.464 43.203 94.101 1.00 9.45 ? 512 GLY D N 1 +ATOM 14002 C CA . GLY C 1 492 ? 56.996 44.370 93.344 1.00 9.43 ? 512 GLY D CA 1 +ATOM 14003 C C . GLY C 1 492 ? 55.567 44.258 92.830 1.00 9.53 ? 512 GLY D C 1 +ATOM 14004 O O . GLY C 1 492 ? 55.022 45.227 92.287 1.00 9.35 ? 512 GLY D O 1 +ATOM 14005 N N . HIS C 1 493 ? 54.951 43.086 92.987 1.00 9.62 ? 513 HIS D N 1 +ATOM 14006 C CA . HIS C 1 493 ? 53.617 42.835 92.422 1.00 9.56 ? 513 HIS D CA 1 +ATOM 14007 C C . HIS C 1 493 ? 52.479 43.318 93.319 1.00 9.29 ? 513 HIS D C 1 +ATOM 14008 O O . HIS C 1 493 ? 51.783 42.528 93.956 1.00 9.54 ? 513 HIS D O 1 +ATOM 14009 C CB . HIS C 1 493 ? 53.467 41.355 92.077 1.00 9.74 ? 513 HIS D CB 1 +ATOM 14010 C CG . HIS C 1 493 ? 54.235 40.964 90.863 1.00 10.55 ? 513 HIS D CG 1 +ATOM 14011 N ND1 . HIS C 1 493 ? 53.669 40.960 89.609 1.00 9.77 ? 513 HIS D ND1 1 +ATOM 14012 C CD2 . HIS C 1 493 ? 55.534 40.622 90.698 1.00 10.04 ? 513 HIS D CD2 1 +ATOM 14013 C CE1 . HIS C 1 493 ? 54.582 40.598 88.724 1.00 11.82 ? 513 HIS D CE1 1 +ATOM 14014 N NE2 . HIS C 1 493 ? 55.722 40.386 89.359 1.00 11.93 ? 513 HIS D NE2 1 +ATOM 14015 N N . LEU C 1 494 ? 52.295 44.633 93.340 1.00 9.00 ? 514 LEU D N 1 +ATOM 14016 C CA . LEU C 1 494 ? 51.278 45.301 94.151 1.00 8.02 ? 514 LEU D CA 1 +ATOM 14017 C C . LEU C 1 494 ? 49.900 44.805 93.777 1.00 8.66 ? 514 LEU D C 1 +ATOM 14018 O O . LEU C 1 494 ? 48.981 44.793 94.604 1.00 8.82 ? 514 LEU D O 1 +ATOM 14019 C CB . LEU C 1 494 ? 51.346 46.819 93.932 1.00 8.43 ? 514 LEU D CB 1 +ATOM 14020 C CG . LEU C 1 494 ? 52.622 47.510 94.431 1.00 7.33 ? 514 LEU D CG 1 +ATOM 14021 C CD1 . LEU C 1 494 ? 52.803 48.943 93.839 1.00 8.20 ? 514 LEU D CD1 1 +ATOM 14022 C CD2 . LEU C 1 494 ? 52.602 47.571 95.943 1.00 4.96 ? 514 LEU D CD2 1 +ATOM 14023 N N . GLU C 1 495 ? 49.768 44.390 92.527 1.00 8.46 ? 515 GLU D N 1 +ATOM 14024 C CA . GLU C 1 495 ? 48.470 43.973 91.988 1.00 9.13 ? 515 GLU D CA 1 +ATOM 14025 C C . GLU C 1 495 ? 47.944 42.663 92.592 1.00 9.34 ? 515 GLU D C 1 +ATOM 14026 O O . GLU C 1 495 ? 46.788 42.311 92.380 1.00 10.36 ? 515 GLU D O 1 +ATOM 14027 C CB . GLU C 1 495 ? 48.540 43.882 90.457 1.00 9.23 ? 515 GLU D CB 1 +ATOM 14028 C CG . GLU C 1 495 ? 49.047 42.575 89.857 1.00 9.54 ? 515 GLU D CG 1 +ATOM 14029 C CD . GLU C 1 495 ? 50.552 42.431 89.836 1.00 9.58 ? 515 GLU D CD 1 +ATOM 14030 O OE1 . GLU C 1 495 ? 51.266 43.289 90.409 1.00 10.87 ? 515 GLU D OE1 1 +ATOM 14031 O OE2 . GLU C 1 495 ? 51.027 41.429 89.249 1.00 11.84 ? 515 GLU D OE2 1 +ATOM 14032 N N . LEU C 1 496 ? 48.781 41.957 93.348 1.00 9.29 ? 516 LEU D N 1 +ATOM 14033 C CA . LEU C 1 496 ? 48.408 40.671 93.938 1.00 9.58 ? 516 LEU D CA 1 +ATOM 14034 C C . LEU C 1 496 ? 47.924 40.812 95.395 1.00 9.61 ? 516 LEU D C 1 +ATOM 14035 O O . LEU C 1 496 ? 47.426 39.855 95.977 1.00 10.43 ? 516 LEU D O 1 +ATOM 14036 C CB . LEU C 1 496 ? 49.589 39.705 93.884 1.00 9.78 ? 516 LEU D CB 1 +ATOM 14037 C CG . LEU C 1 496 ? 50.161 39.375 92.505 1.00 9.65 ? 516 LEU D CG 1 +ATOM 14038 C CD1 . LEU C 1 496 ? 51.371 38.452 92.615 1.00 11.92 ? 516 LEU D CD1 1 +ATOM 14039 C CD2 . LEU C 1 496 ? 49.091 38.762 91.576 1.00 11.80 ? 516 LEU D CD2 1 +ATOM 14040 N N . ILE C 1 497 ? 48.051 41.999 95.980 1.00 10.05 ? 517 ILE D N 1 +ATOM 14041 C CA . ILE C 1 497 ? 47.898 42.147 97.420 1.00 10.47 ? 517 ILE D CA 1 +ATOM 14042 C C . ILE C 1 497 ? 46.463 41.871 97.866 1.00 10.74 ? 517 ILE D C 1 +ATOM 14043 O O . ILE C 1 497 ? 46.231 41.123 98.812 1.00 11.14 ? 517 ILE D O 1 +ATOM 14044 C CB . ILE C 1 497 ? 48.341 43.552 97.903 1.00 10.37 ? 517 ILE D CB 1 +ATOM 14045 C CG1 . ILE C 1 497 ? 49.858 43.685 97.785 1.00 10.19 ? 517 ILE D CG1 1 +ATOM 14046 C CG2 . ILE C 1 497 ? 47.935 43.774 99.346 1.00 10.70 ? 517 ILE D CG2 1 +ATOM 14047 C CD1 . ILE C 1 497 ? 50.362 45.052 98.080 1.00 9.70 ? 517 ILE D CD1 1 +ATOM 14048 N N . GLN C 1 498 ? 45.498 42.454 97.179 1.00 11.26 ? 518 GLN D N 1 +ATOM 14049 C CA . GLN C 1 498 ? 44.102 42.312 97.619 1.00 12.22 ? 518 GLN D CA 1 +ATOM 14050 C C . GLN C 1 498 ? 43.644 40.851 97.526 1.00 12.40 ? 518 GLN D C 1 +ATOM 14051 O O . GLN C 1 498 ? 42.963 40.338 98.418 1.00 13.17 ? 518 GLN D O 1 +ATOM 14052 C CB . GLN C 1 498 ? 43.182 43.231 96.820 1.00 11.94 ? 518 GLN D CB 1 +ATOM 14053 C CG . GLN C 1 498 ? 43.214 44.686 97.266 1.00 12.41 ? 518 GLN D CG 1 +ATOM 14054 C CD . GLN C 1 498 ? 42.087 45.511 96.656 1.00 13.80 ? 518 GLN D CD 1 +ATOM 14055 O OE1 . GLN C 1 498 ? 40.912 45.307 96.979 1.00 16.81 ? 518 GLN D OE1 1 +ATOM 14056 N NE2 . GLN C 1 498 ? 42.437 46.452 95.783 1.00 16.56 ? 518 GLN D NE2 1 +ATOM 14057 N N . LEU C 1 499 ? 44.010 40.180 96.448 1.00 12.53 ? 519 LEU D N 1 +ATOM 14058 C CA . LEU C 1 499 ? 43.644 38.771 96.274 1.00 12.35 ? 519 LEU D CA 1 +ATOM 14059 C C . LEU C 1 499 ? 44.243 37.905 97.385 1.00 12.03 ? 519 LEU D C 1 +ATOM 14060 O O . LEU C 1 499 ? 43.545 37.075 98.009 1.00 11.54 ? 519 LEU D O 1 +ATOM 14061 C CB . LEU C 1 499 ? 44.121 38.270 94.906 1.00 12.82 ? 519 LEU D CB 1 +ATOM 14062 C CG . LEU C 1 499 ? 43.744 36.867 94.433 1.00 11.97 ? 519 LEU D CG 1 +ATOM 14063 C CD1 . LEU C 1 499 ? 42.228 36.757 94.262 1.00 12.82 ? 519 LEU D CD1 1 +ATOM 14064 C CD2 . LEU C 1 499 ? 44.449 36.570 93.130 1.00 12.55 ? 519 LEU D CD2 1 +ATOM 14065 N N . GLN C 1 500 ? 45.539 38.082 97.638 1.00 11.23 ? 520 GLN D N 1 +ATOM 14066 C CA . GLN C 1 500 ? 46.234 37.213 98.593 1.00 11.62 ? 520 GLN D CA 1 +ATOM 14067 C C . GLN C 1 500 ? 45.762 37.450 100.036 1.00 11.92 ? 520 GLN D C 1 +ATOM 14068 O O . GLN C 1 500 ? 45.662 36.509 100.843 1.00 12.30 ? 520 GLN D O 1 +ATOM 14069 C CB . GLN C 1 500 ? 47.748 37.351 98.433 1.00 11.50 ? 520 GLN D CB 1 +ATOM 14070 C CG . GLN C 1 500 ? 48.216 36.838 97.089 1.00 11.52 ? 520 GLN D CG 1 +ATOM 14071 C CD . GLN C 1 500 ? 49.706 36.970 96.874 1.00 12.41 ? 520 GLN D CD 1 +ATOM 14072 O OE1 . GLN C 1 500 ? 50.423 37.554 97.697 1.00 13.07 ? 520 GLN D OE1 1 +ATOM 14073 N NE2 . GLN C 1 500 ? 50.184 36.420 95.758 1.00 11.52 ? 520 GLN D NE2 1 +ATOM 14074 N N . LEU C 1 501 ? 45.436 38.699 100.328 1.00 12.50 ? 521 LEU D N 1 +ATOM 14075 C CA . LEU C 1 501 ? 44.941 39.107 101.631 1.00 13.03 ? 521 LEU D CA 1 +ATOM 14076 C C . LEU C 1 501 ? 43.538 38.586 101.882 1.00 13.14 ? 521 LEU D C 1 +ATOM 14077 O O . LEU C 1 501 ? 43.219 38.186 102.997 1.00 13.38 ? 521 LEU D O 1 +ATOM 14078 C CB . LEU C 1 501 ? 44.955 40.630 101.717 1.00 13.49 ? 521 LEU D CB 1 +ATOM 14079 C CG . LEU C 1 501 ? 45.040 41.332 103.066 1.00 14.85 ? 521 LEU D CG 1 +ATOM 14080 C CD1 . LEU C 1 501 ? 46.130 40.750 103.965 1.00 15.29 ? 521 LEU D CD1 1 +ATOM 14081 C CD2 . LEU C 1 501 ? 45.287 42.817 102.809 1.00 13.13 ? 521 LEU D CD2 1 +ATOM 14082 N N . ALA C 1 502 ? 42.690 38.630 100.852 1.00 13.02 ? 522 ALA D N 1 +ATOM 14083 C CA . ALA C 1 502 ? 41.345 38.052 100.935 1.00 13.39 ? 522 ALA D CA 1 +ATOM 14084 C C . ALA C 1 502 ? 41.427 36.562 101.230 1.00 13.65 ? 522 ALA D C 1 +ATOM 14085 O O . ALA C 1 502 ? 40.755 36.063 102.128 1.00 14.56 ? 522 ALA D O 1 +ATOM 14086 C CB . ALA C 1 502 ? 40.583 38.285 99.642 1.00 13.48 ? 522 ALA D CB 1 +ATOM 14087 N N . THR C 1 503 ? 42.272 35.861 100.481 1.00 13.62 ? 523 THR D N 1 +ATOM 14088 C CA . THR C 1 503 ? 42.475 34.435 100.677 1.00 13.51 ? 523 THR D CA 1 +ATOM 14089 C C . THR C 1 503 ? 42.978 34.158 102.097 1.00 13.34 ? 523 THR D C 1 +ATOM 14090 O O . THR C 1 503 ? 42.453 33.291 102.783 1.00 13.06 ? 523 THR D O 1 +ATOM 14091 C CB . THR C 1 503 ? 43.449 33.878 99.624 1.00 13.95 ? 523 THR D CB 1 +ATOM 14092 O OG1 . THR C 1 503 ? 42.843 33.972 98.326 1.00 14.26 ? 523 THR D OG1 1 +ATOM 14093 C CG2 . THR C 1 503 ? 43.799 32.427 99.920 1.00 13.42 ? 523 THR D CG2 1 +ATOM 14094 N N . GLN C 1 504 ? 43.967 34.932 102.546 1.00 12.62 ? 524 GLN D N 1 +ATOM 14095 C CA . GLN C 1 504 ? 44.463 34.849 103.925 1.00 12.78 ? 524 GLN D CA 1 +ATOM 14096 C C . GLN C 1 504 ? 43.333 34.844 104.969 1.00 12.91 ? 524 GLN D C 1 +ATOM 14097 O O . GLN C 1 504 ? 43.187 33.893 105.756 1.00 12.38 ? 524 GLN D O 1 +ATOM 14098 C CB . GLN C 1 504 ? 45.390 36.042 104.200 1.00 12.32 ? 524 GLN D CB 1 +ATOM 14099 C CG . GLN C 1 504 ? 45.943 36.107 105.611 1.00 12.92 ? 524 GLN D CG 1 +ATOM 14100 C CD . GLN C 1 504 ? 46.744 37.372 105.817 1.00 13.37 ? 524 GLN D CD 1 +ATOM 14101 O OE1 . GLN C 1 504 ? 47.802 37.550 105.211 1.00 13.54 ? 524 GLN D OE1 1 +ATOM 14102 N NE2 . GLN C 1 504 ? 46.247 38.261 106.666 1.00 13.77 ? 524 GLN D NE2 1 +ATOM 14103 N N . PHE C 1 505 ? 42.545 35.912 104.969 1.00 12.70 ? 525 PHE D N 1 +ATOM 14104 C CA . PHE C 1 505 ? 41.472 36.077 105.946 1.00 13.01 ? 525 PHE D CA 1 +ATOM 14105 C C . PHE C 1 505 ? 40.429 34.986 105.837 1.00 13.66 ? 525 PHE D C 1 +ATOM 14106 O O . PHE C 1 505 ? 40.068 34.396 106.863 1.00 13.35 ? 525 PHE D O 1 +ATOM 14107 C CB . PHE C 1 505 ? 40.791 37.427 105.811 1.00 12.82 ? 525 PHE D CB 1 +ATOM 14108 C CG . PHE C 1 505 ? 41.658 38.587 106.196 1.00 12.70 ? 525 PHE D CG 1 +ATOM 14109 C CD1 . PHE C 1 505 ? 42.402 38.573 107.374 1.00 12.53 ? 525 PHE D CD1 1 +ATOM 14110 C CD2 . PHE C 1 505 ? 41.705 39.713 105.393 1.00 12.65 ? 525 PHE D CD2 1 +ATOM 14111 C CE1 . PHE C 1 505 ? 43.193 39.674 107.740 1.00 12.29 ? 525 PHE D CE1 1 +ATOM 14112 C CE2 . PHE C 1 505 ? 42.500 40.809 105.748 1.00 13.49 ? 525 PHE D CE2 1 +ATOM 14113 C CZ . PHE C 1 505 ? 43.240 40.783 106.920 1.00 12.91 ? 525 PHE D CZ 1 +ATOM 14114 N N . GLU C 1 506 ? 39.962 34.690 104.621 1.00 14.55 ? 526 GLU D N 1 +ATOM 14115 C CA . GLU C 1 506 ? 38.971 33.613 104.456 1.00 15.94 ? 526 GLU D CA 1 +ATOM 14116 C C . GLU C 1 506 ? 39.528 32.280 104.982 1.00 15.60 ? 526 GLU D C 1 +ATOM 14117 O O . GLU C 1 506 ? 38.840 31.570 105.719 1.00 15.74 ? 526 GLU D O 1 +ATOM 14118 C CB . GLU C 1 506 ? 38.468 33.409 103.005 1.00 16.41 ? 526 GLU D CB 1 +ATOM 14119 C CG . GLU C 1 506 ? 38.357 34.595 102.030 1.00 19.40 ? 526 GLU D CG 1 +ATOM 14120 C CD . GLU C 1 506 ? 37.543 35.776 102.512 1.00 22.53 ? 526 GLU D CD 1 +ATOM 14121 O OE1 . GLU C 1 506 ? 38.114 36.891 102.567 1.00 24.40 ? 526 GLU D OE1 1 +ATOM 14122 O OE2 . GLU C 1 506 ? 36.324 35.614 102.794 1.00 24.33 ? 526 GLU D OE2 1 +ATOM 14123 N N . ASN C 1 507 ? 40.771 31.932 104.620 1.00 15.65 ? 527 ASN D N 1 +ATOM 14124 C CA . ASN C 1 507 ? 41.343 30.646 105.041 1.00 15.89 ? 527 ASN D CA 1 +ATOM 14125 C C . ASN C 1 507 ? 41.458 30.552 106.557 1.00 15.57 ? 527 ASN D C 1 +ATOM 14126 O O . ASN C 1 507 ? 41.065 29.544 107.154 1.00 14.64 ? 527 ASN D O 1 +ATOM 14127 C CB . ASN C 1 507 ? 42.722 30.393 104.420 1.00 16.45 ? 527 ASN D CB 1 +ATOM 14128 C CG . ASN C 1 507 ? 42.669 30.116 102.934 1.00 17.88 ? 527 ASN D CG 1 +ATOM 14129 O OD1 . ASN C 1 507 ? 41.612 29.810 102.369 1.00 20.88 ? 527 ASN D OD1 1 +ATOM 14130 N ND2 . ASN C 1 507 ? 43.825 30.216 102.286 1.00 19.84 ? 527 ASN D ND2 1 +ATOM 14131 N N . TRP C 1 508 ? 41.979 31.608 107.183 1.00 15.13 ? 528 TRP D N 1 +ATOM 14132 C CA . TRP C 1 508 ? 42.160 31.609 108.634 1.00 15.11 ? 528 TRP D CA 1 +ATOM 14133 C C . TRP C 1 508 ? 40.831 31.586 109.400 1.00 15.40 ? 528 TRP D C 1 +ATOM 14134 O O . TRP C 1 508 ? 40.680 30.806 110.339 1.00 15.43 ? 528 TRP D O 1 +ATOM 14135 C CB . TRP C 1 508 ? 43.007 32.805 109.092 1.00 15.19 ? 528 TRP D CB 1 +ATOM 14136 C CG . TRP C 1 508 ? 44.494 32.589 108.984 1.00 15.16 ? 528 TRP D CG 1 +ATOM 14137 C CD1 . TRP C 1 508 ? 45.318 32.985 107.950 1.00 14.96 ? 528 TRP D CD1 1 +ATOM 14138 C CD2 . TRP C 1 508 ? 45.345 31.955 109.948 1.00 15.47 ? 528 TRP D CD2 1 +ATOM 14139 N NE1 . TRP C 1 508 ? 46.617 32.623 108.216 1.00 15.06 ? 528 TRP D NE1 1 +ATOM 14140 C CE2 . TRP C 1 508 ? 46.665 31.989 109.431 1.00 15.25 ? 528 TRP D CE2 1 +ATOM 14141 C CE3 . TRP C 1 508 ? 45.124 31.364 111.198 1.00 14.39 ? 528 TRP D CE3 1 +ATOM 14142 C CZ2 . TRP C 1 508 ? 47.759 31.455 110.128 1.00 15.11 ? 528 TRP D CZ2 1 +ATOM 14143 C CZ3 . TRP C 1 508 ? 46.204 30.834 111.884 1.00 14.98 ? 528 TRP D CZ3 1 +ATOM 14144 C CH2 . TRP C 1 508 ? 47.506 30.871 111.341 1.00 15.51 ? 528 TRP D CH2 1 +ATOM 14145 N N . TYR C 1 509 ? 39.874 32.421 109.003 1.00 15.39 ? 529 TYR D N 1 +ATOM 14146 C CA . TYR C 1 509 ? 38.611 32.492 109.746 1.00 15.77 ? 529 TYR D CA 1 +ATOM 14147 C C . TYR C 1 509 ? 37.742 31.258 109.550 1.00 16.25 ? 529 TYR D C 1 +ATOM 14148 O O . TYR C 1 509 ? 37.034 30.857 110.465 1.00 16.03 ? 529 TYR D O 1 +ATOM 14149 C CB . TYR C 1 509 ? 37.795 33.724 109.374 1.00 15.94 ? 529 TYR D CB 1 +ATOM 14150 C CG . TYR C 1 509 ? 36.759 34.042 110.422 1.00 15.57 ? 529 TYR D CG 1 +ATOM 14151 C CD1 . TYR C 1 509 ? 37.132 34.594 111.639 1.00 15.75 ? 529 TYR D CD1 1 +ATOM 14152 C CD2 . TYR C 1 509 ? 35.409 33.782 110.206 1.00 15.40 ? 529 TYR D CD2 1 +ATOM 14153 C CE1 . TYR C 1 509 ? 36.194 34.879 112.623 1.00 15.86 ? 529 TYR D CE1 1 +ATOM 14154 C CE2 . TYR C 1 509 ? 34.466 34.064 111.181 1.00 15.57 ? 529 TYR D CE2 1 +ATOM 14155 C CZ . TYR C 1 509 ? 34.862 34.611 112.388 1.00 17.24 ? 529 TYR D CZ 1 +ATOM 14156 O OH . TYR C 1 509 ? 33.934 34.899 113.368 1.00 17.15 ? 529 TYR D OH 1 +ATOM 14157 N N . LYS C 1 510 ? 37.770 30.684 108.354 1.00 17.06 ? 530 LYS D N 1 +ATOM 14158 C CA . LYS C 1 510 ? 37.054 29.435 108.099 1.00 18.39 ? 530 LYS D CA 1 +ATOM 14159 C C . LYS C 1 510 ? 37.533 28.341 109.055 1.00 18.62 ? 530 LYS D C 1 +ATOM 14160 O O . LYS C 1 510 ? 36.717 27.598 109.602 1.00 18.89 ? 530 LYS D O 1 +ATOM 14161 C CB . LYS C 1 510 ? 37.228 28.994 106.647 1.00 18.87 ? 530 LYS D CB 1 +ATOM 14162 C CG . LYS C 1 510 ? 36.409 27.762 106.262 1.00 20.54 ? 530 LYS D CG 1 +ATOM 14163 C CD . LYS C 1 510 ? 36.712 27.345 104.827 1.00 23.49 ? 530 LYS D CD 1 +ATOM 14164 C CE . LYS C 1 510 ? 35.658 26.401 104.255 1.00 25.30 ? 530 LYS D CE 1 +ATOM 14165 N NZ . LYS C 1 510 ? 35.849 24.985 104.668 1.00 26.88 ? 530 LYS D NZ 1 +ATOM 14166 N N . LYS C 1 511 ? 38.847 28.261 109.282 1.00 18.66 ? 531 LYS D N 1 +ATOM 14167 C CA . LYS C 1 511 ? 39.405 27.233 110.169 1.00 19.17 ? 531 LYS D CA 1 +ATOM 14168 C C . LYS C 1 511 ? 39.149 27.490 111.660 1.00 19.49 ? 531 LYS D C 1 +ATOM 14169 O O . LYS C 1 511 ? 38.833 26.552 112.393 1.00 19.24 ? 531 LYS D O 1 +ATOM 14170 C CB . LYS C 1 511 ? 40.907 27.045 109.929 1.00 19.47 ? 531 LYS D CB 1 +ATOM 14171 C CG . LYS C 1 511 ? 41.466 25.780 110.591 1.00 20.04 ? 531 LYS D CG 1 +ATOM 14172 C CD . LYS C 1 511 ? 42.786 25.314 109.974 1.00 21.83 ? 531 LYS D CD 1 +ATOM 14173 C CE . LYS C 1 511 ? 42.895 23.782 109.931 1.00 23.45 ? 531 LYS D CE 1 +ATOM 14174 N NZ . LYS C 1 511 ? 42.835 23.166 111.279 1.00 23.53 ? 531 LYS D NZ 1 +ATOM 14175 N N . TYR C 1 512 ? 39.273 28.745 112.106 1.00 19.74 ? 532 TYR D N 1 +ATOM 14176 C CA . TYR C 1 512 ? 39.288 29.050 113.546 1.00 20.42 ? 532 TYR D CA 1 +ATOM 14177 C C . TYR C 1 512 ? 38.103 29.806 114.143 1.00 20.69 ? 532 TYR D C 1 +ATOM 14178 O O . TYR C 1 512 ? 37.847 29.681 115.347 1.00 21.56 ? 532 TYR D O 1 +ATOM 14179 C CB . TYR C 1 512 ? 40.609 29.741 113.915 1.00 20.95 ? 532 TYR D CB 1 +ATOM 14180 C CG . TYR C 1 512 ? 41.725 28.745 113.881 1.00 21.69 ? 532 TYR D CG 1 +ATOM 14181 C CD1 . TYR C 1 512 ? 41.747 27.697 114.801 1.00 22.41 ? 532 TYR D CD1 1 +ATOM 14182 C CD2 . TYR C 1 512 ? 42.708 28.778 112.898 1.00 21.67 ? 532 TYR D CD2 1 +ATOM 14183 C CE1 . TYR C 1 512 ? 42.719 26.754 114.777 1.00 22.85 ? 532 TYR D CE1 1 +ATOM 14184 C CE2 . TYR C 1 512 ? 43.714 27.809 112.872 1.00 22.46 ? 532 TYR D CE2 1 +ATOM 14185 C CZ . TYR C 1 512 ? 43.698 26.798 113.821 1.00 22.28 ? 532 TYR D CZ 1 +ATOM 14186 O OH . TYR C 1 512 ? 44.656 25.811 113.848 1.00 23.82 ? 532 TYR D OH 1 +ATOM 14187 N N . GLN C 1 513 ? 37.390 30.584 113.334 1.00 20.10 ? 533 GLN D N 1 +ATOM 14188 C CA . GLN C 1 513 ? 36.240 31.361 113.819 1.00 19.94 ? 533 GLN D CA 1 +ATOM 14189 C C . GLN C 1 513 ? 36.594 32.129 115.094 1.00 18.30 ? 533 GLN D C 1 +ATOM 14190 O O . GLN C 1 513 ? 35.908 32.025 116.116 1.00 17.33 ? 533 GLN D O 1 +ATOM 14191 C CB . GLN C 1 513 ? 35.034 30.442 114.060 1.00 19.88 ? 533 GLN D CB 1 +ATOM 14192 C CG . GLN C 1 513 ? 34.736 29.499 112.887 1.00 22.14 ? 533 GLN D CG 1 +ATOM 14193 C CD . GLN C 1 513 ? 33.452 28.691 113.065 1.00 22.63 ? 533 GLN D CD 1 +ATOM 14194 O OE1 . GLN C 1 513 ? 32.572 29.050 113.857 1.00 28.17 ? 533 GLN D OE1 1 +ATOM 14195 N NE2 . GLN C 1 513 ? 33.342 27.591 112.321 1.00 27.58 ? 533 GLN D NE2 1 +ATOM 14196 N N . LYS C 1 514 ? 37.702 32.868 115.013 1.00 16.62 ? 534 LYS D N 1 +ATOM 14197 C CA . LYS C 1 514 ? 38.217 33.722 116.082 1.00 15.60 ? 534 LYS D CA 1 +ATOM 14198 C C . LYS C 1 514 ? 38.617 35.068 115.460 1.00 14.26 ? 534 LYS D C 1 +ATOM 14199 O O . LYS C 1 514 ? 39.007 35.088 114.293 1.00 13.49 ? 534 LYS D O 1 +ATOM 14200 C CB . LYS C 1 514 ? 39.452 33.065 116.706 1.00 16.06 ? 534 LYS D CB 1 +ATOM 14201 C CG . LYS C 1 514 ? 39.191 32.392 118.031 1.00 17.99 ? 534 LYS D CG 1 +ATOM 14202 C CD . LYS C 1 514 ? 39.877 31.044 118.165 1.00 17.42 ? 534 LYS D CD 1 +ATOM 14203 C CE . LYS C 1 514 ? 41.354 31.073 117.885 1.00 17.64 ? 534 LYS D CE 1 +ATOM 14204 N NZ . LYS C 1 514 ? 42.007 29.920 118.555 1.00 16.23 ? 534 LYS D NZ 1 +ATOM 14205 N N . PRO C 1 515 ? 38.531 36.183 116.224 1.00 12.92 ? 535 PRO D N 1 +ATOM 14206 C CA . PRO C 1 515 ? 38.875 37.506 115.668 1.00 11.94 ? 535 PRO D CA 1 +ATOM 14207 C C . PRO C 1 515 ? 40.324 37.531 115.190 1.00 11.28 ? 535 PRO D C 1 +ATOM 14208 O O . PRO C 1 515 ? 41.166 36.844 115.771 1.00 11.32 ? 535 PRO D O 1 +ATOM 14209 C CB . PRO C 1 515 ? 38.659 38.464 116.845 1.00 11.71 ? 535 PRO D CB 1 +ATOM 14210 C CG . PRO C 1 515 ? 37.744 37.694 117.799 1.00 12.81 ? 535 PRO D CG 1 +ATOM 14211 C CD . PRO C 1 515 ? 38.105 36.271 117.635 1.00 12.99 ? 535 PRO D CD 1 +ATOM 14212 N N . ILE C 1 516 ? 40.570 38.275 114.115 1.00 10.45 ? 536 ILE D N 1 +ATOM 14213 C CA . ILE C 1 516 ? 41.898 38.361 113.498 1.00 10.50 ? 536 ILE D CA 1 +ATOM 14214 C C . ILE C 1 516 ? 42.453 39.789 113.563 1.00 9.91 ? 536 ILE D C 1 +ATOM 14215 O O . ILE C 1 516 ? 41.751 40.769 113.310 1.00 8.92 ? 536 ILE D O 1 +ATOM 14216 C CB . ILE C 1 516 ? 41.864 37.887 112.028 1.00 10.46 ? 536 ILE D CB 1 +ATOM 14217 C CG1 . ILE C 1 516 ? 41.486 36.412 111.938 1.00 10.84 ? 536 ILE D CG1 1 +ATOM 14218 C CG2 . ILE C 1 516 ? 43.229 38.096 111.349 1.00 10.71 ? 536 ILE D CG2 1 +ATOM 14219 C CD1 . ILE C 1 516 ? 41.233 35.929 110.518 1.00 11.03 ? 536 ILE D CD1 1 +ATOM 14220 N N . ILE C 1 517 ? 43.737 39.909 113.901 1.00 9.49 ? 537 ILE D N 1 +ATOM 14221 C CA . ILE C 1 517 ? 44.450 41.168 113.768 1.00 9.98 ? 537 ILE D CA 1 +ATOM 14222 C C . ILE C 1 517 ? 45.535 40.979 112.709 1.00 9.41 ? 537 ILE D C 1 +ATOM 14223 O O . ILE C 1 517 ? 46.247 39.971 112.723 1.00 9.20 ? 537 ILE D O 1 +ATOM 14224 C CB . ILE C 1 517 ? 45.105 41.584 115.112 1.00 9.92 ? 537 ILE D CB 1 +ATOM 14225 C CG1 . ILE C 1 517 ? 44.033 42.026 116.113 1.00 10.83 ? 537 ILE D CG1 1 +ATOM 14226 C CG2 . ILE C 1 517 ? 46.119 42.706 114.901 1.00 10.94 ? 537 ILE D CG2 1 +ATOM 14227 C CD1 . ILE C 1 517 ? 44.524 42.227 117.487 1.00 11.04 ? 537 ILE D CD1 1 +ATOM 14228 N N . GLN C 1 518 ? 45.647 41.933 111.783 1.00 8.60 ? 538 GLN D N 1 +ATOM 14229 C CA . GLN C 1 518 ? 46.772 41.976 110.859 1.00 8.95 ? 538 GLN D CA 1 +ATOM 14230 C C . GLN C 1 518 ? 47.864 42.698 111.642 1.00 8.46 ? 538 GLN D C 1 +ATOM 14231 O O . GLN C 1 518 ? 47.893 43.929 111.677 1.00 8.66 ? 538 GLN D O 1 +ATOM 14232 C CB . GLN C 1 518 ? 46.393 42.748 109.584 1.00 9.04 ? 538 GLN D CB 1 +ATOM 14233 C CG . GLN C 1 518 ? 47.485 42.849 108.538 1.00 9.45 ? 538 GLN D CG 1 +ATOM 14234 C CD . GLN C 1 518 ? 47.751 41.535 107.831 1.00 10.13 ? 538 GLN D CD 1 +ATOM 14235 O OE1 . GLN C 1 518 ? 46.821 40.804 107.491 1.00 12.32 ? 538 GLN D OE1 1 +ATOM 14236 N NE2 . GLN C 1 518 ? 49.031 41.235 107.579 1.00 10.20 ? 538 GLN D NE2 1 +ATOM 14237 N N . SER C 1 519 ? 48.755 41.917 112.257 1.00 8.28 ? 539 SER D N 1 +ATOM 14238 C CA . SER C 1 519 ? 49.696 42.428 113.264 1.00 8.53 ? 539 SER D CA 1 +ATOM 14239 C C . SER C 1 519 ? 51.004 42.965 112.671 1.00 8.50 ? 539 SER D C 1 +ATOM 14240 O O . SER C 1 519 ? 51.717 43.711 113.342 1.00 8.30 ? 539 SER D O 1 +ATOM 14241 C CB . SER C 1 519 ? 49.983 41.359 114.337 1.00 8.92 ? 539 SER D CB 1 +ATOM 14242 O OG . SER C 1 519 ? 50.191 40.084 113.763 1.00 9.14 ? 539 SER D OG 1 +ATOM 14243 N N . GLU C 1 520 ? 51.300 42.588 111.427 1.00 8.49 ? 540 GLU D N 1 +ATOM 14244 C CA . GLU C 1 520 ? 52.360 43.242 110.631 1.00 8.19 ? 540 GLU D CA 1 +ATOM 14245 C C . GLU C 1 520 ? 52.038 43.283 109.156 1.00 8.12 ? 540 GLU D C 1 +ATOM 14246 O O . GLU C 1 520 ? 51.507 42.311 108.596 1.00 8.22 ? 540 GLU D O 1 +ATOM 14247 C CB . GLU C 1 520 ? 53.692 42.512 110.761 1.00 7.96 ? 540 GLU D CB 1 +ATOM 14248 C CG . GLU C 1 520 ? 54.261 42.467 112.144 1.00 8.88 ? 540 GLU D CG 1 +ATOM 14249 C CD . GLU C 1 520 ? 55.640 41.830 112.205 1.00 9.55 ? 540 GLU D CD 1 +ATOM 14250 O OE1 . GLU C 1 520 ? 56.313 41.671 111.144 1.00 9.72 ? 540 GLU D OE1 1 +ATOM 14251 O OE2 . GLU C 1 520 ? 56.065 41.515 113.338 1.00 7.28 ? 540 GLU D OE2 1 +ATOM 14252 N N . TYR C 1 521 ? 52.410 44.406 108.536 1.00 8.04 ? 541 TYR D N 1 +ATOM 14253 C CA . TYR C 1 521 ? 52.506 44.554 107.088 1.00 7.95 ? 541 TYR D CA 1 +ATOM 14254 C C . TYR C 1 521 ? 53.365 45.828 106.836 1.00 8.46 ? 541 TYR D C 1 +ATOM 14255 O O . TYR C 1 521 ? 53.490 46.702 107.706 1.00 7.84 ? 541 TYR D O 1 +ATOM 14256 C CB . TYR C 1 521 ? 51.110 44.655 106.429 1.00 8.56 ? 541 TYR D CB 1 +ATOM 14257 C CG . TYR C 1 521 ? 50.423 45.962 106.720 1.00 9.34 ? 541 TYR D CG 1 +ATOM 14258 C CD1 . TYR C 1 521 ? 49.753 46.179 107.922 1.00 9.54 ? 541 TYR D CD1 1 +ATOM 14259 C CD2 . TYR C 1 521 ? 50.469 47.008 105.795 1.00 9.19 ? 541 TYR D CD2 1 +ATOM 14260 C CE1 . TYR C 1 521 ? 49.150 47.411 108.194 1.00 9.03 ? 541 TYR D CE1 1 +ATOM 14261 C CE2 . TYR C 1 521 ? 49.887 48.212 106.048 1.00 10.63 ? 541 TYR D CE2 1 +ATOM 14262 C CZ . TYR C 1 521 ? 49.219 48.424 107.247 1.00 10.09 ? 541 TYR D CZ 1 +ATOM 14263 O OH . TYR C 1 521 ? 48.642 49.658 107.471 1.00 9.87 ? 541 TYR D OH 1 +ATOM 14264 N N . GLY C 1 522 ? 53.985 45.903 105.667 1.00 8.32 ? 542 GLY D N 1 +ATOM 14265 C CA . GLY C 1 522 ? 54.802 47.080 105.331 1.00 7.62 ? 542 GLY D CA 1 +ATOM 14266 C C . GLY C 1 522 ? 55.748 46.906 104.166 1.00 7.58 ? 542 GLY D C 1 +ATOM 14267 O O . GLY C 1 522 ? 55.707 45.895 103.460 1.00 8.12 ? 542 GLY D O 1 +ATOM 14268 N N . ALA C 1 523 ? 56.606 47.913 103.975 1.00 7.17 ? 543 ALA D N 1 +ATOM 14269 C CA . ALA C 1 523 ? 57.604 47.894 102.920 1.00 7.24 ? 543 ALA D CA 1 +ATOM 14270 C C . ALA C 1 523 ? 58.849 48.646 103.361 1.00 6.51 ? 543 ALA D C 1 +ATOM 14271 O O . ALA C 1 523 ? 58.755 49.730 103.930 1.00 7.88 ? 543 ALA D O 1 +ATOM 14272 C CB . ALA C 1 523 ? 57.035 48.550 101.650 1.00 7.67 ? 543 ALA D CB 1 +ATOM 14273 N N . GLU C 1 524 ? 60.022 48.092 103.078 1.00 7.11 ? 544 GLU D N 1 +ATOM 14274 C CA . GLU C 1 524 ? 61.254 48.824 103.323 1.00 6.14 ? 544 GLU D CA 1 +ATOM 14275 C C . GLU C 1 524 ? 61.252 50.036 102.418 1.00 6.07 ? 544 GLU D C 1 +ATOM 14276 O O . GLU C 1 524 ? 60.959 49.925 101.229 1.00 6.01 ? 544 GLU D O 1 +ATOM 14277 C CB . GLU C 1 524 ? 62.497 48.007 103.043 1.00 6.06 ? 544 GLU D CB 1 +ATOM 14278 C CG . GLU C 1 524 ? 62.568 46.675 103.802 1.00 7.12 ? 544 GLU D CG 1 +ATOM 14279 C CD . GLU C 1 524 ? 63.219 46.781 105.167 1.00 8.92 ? 544 GLU D CD 1 +ATOM 14280 O OE1 . GLU C 1 524 ? 64.075 47.676 105.369 1.00 9.53 ? 544 GLU D OE1 1 +ATOM 14281 O OE2 . GLU C 1 524 ? 62.883 45.947 106.042 1.00 9.12 ? 544 GLU D OE2 1 +ATOM 14282 N N . THR C 1 525 ? 61.589 51.180 102.985 1.00 6.14 ? 545 THR D N 1 +ATOM 14283 C CA . THR C 1 525 ? 61.391 52.472 102.333 1.00 6.76 ? 545 THR D CA 1 +ATOM 14284 C C . THR C 1 525 ? 62.511 53.435 102.717 1.00 6.97 ? 545 THR D C 1 +ATOM 14285 O O . THR C 1 525 ? 62.623 53.854 103.870 1.00 6.02 ? 545 THR D O 1 +ATOM 14286 C CB . THR C 1 525 ? 60.017 53.048 102.712 1.00 7.00 ? 545 THR D CB 1 +ATOM 14287 O OG1 . THR C 1 525 ? 59.009 52.051 102.467 1.00 7.01 ? 545 THR D OG1 1 +ATOM 14288 C CG2 . THR C 1 525 ? 59.715 54.345 101.930 1.00 8.47 ? 545 THR D CG2 1 +ATOM 14289 N N . ILE C 1 526 ? 63.360 53.753 101.739 1.00 7.52 ? 546 ILE D N 1 +ATOM 14290 C CA . ILE C 1 526 ? 64.438 54.719 101.921 1.00 7.81 ? 546 ILE D CA 1 +ATOM 14291 C C . ILE C 1 526 ? 63.892 56.120 101.649 1.00 7.07 ? 546 ILE D C 1 +ATOM 14292 O O . ILE C 1 526 ? 63.546 56.462 100.510 1.00 6.16 ? 546 ILE D O 1 +ATOM 14293 C CB . ILE C 1 526 ? 65.615 54.464 100.960 1.00 8.54 ? 546 ILE D CB 1 +ATOM 14294 C CG1 . ILE C 1 526 ? 66.063 52.999 101.013 1.00 9.49 ? 546 ILE D CG1 1 +ATOM 14295 C CG2 . ILE C 1 526 ? 66.796 55.371 101.287 1.00 8.29 ? 546 ILE D CG2 1 +ATOM 14296 C CD1 . ILE C 1 526 ? 66.318 52.496 102.361 1.00 12.82 ? 546 ILE D CD1 1 +ATOM 14297 N N . ALA C 1 527 ? 63.804 56.929 102.691 1.00 7.16 ? 547 ALA D N 1 +ATOM 14298 C CA . ALA C 1 527 ? 63.331 58.301 102.531 1.00 7.89 ? 547 ALA D CA 1 +ATOM 14299 C C . ALA C 1 527 ? 64.047 59.022 101.377 1.00 8.13 ? 547 ALA D C 1 +ATOM 14300 O O . ALA C 1 527 ? 65.276 59.055 101.311 1.00 8.30 ? 547 ALA D O 1 +ATOM 14301 C CB . ALA C 1 527 ? 63.496 59.080 103.823 1.00 8.43 ? 547 ALA D CB 1 +ATOM 14302 N N . GLY C 1 528 ? 63.263 59.592 100.468 1.00 8.60 ? 548 GLY D N 1 +ATOM 14303 C CA . GLY C 1 528 ? 63.793 60.316 99.320 1.00 8.49 ? 548 GLY D CA 1 +ATOM 14304 C C . GLY C 1 528 ? 63.904 59.537 98.027 1.00 8.60 ? 548 GLY D C 1 +ATOM 14305 O O . GLY C 1 528 ? 64.081 60.134 96.974 1.00 9.00 ? 548 GLY D O 1 +ATOM 14306 N N . PHE C 1 529 ? 63.792 58.214 98.099 1.00 7.74 ? 549 PHE D N 1 +ATOM 14307 C CA . PHE C 1 529 ? 63.747 57.388 96.902 1.00 8.43 ? 549 PHE D CA 1 +ATOM 14308 C C . PHE C 1 529 ? 62.362 57.496 96.271 1.00 8.81 ? 549 PHE D C 1 +ATOM 14309 O O . PHE C 1 529 ? 61.370 57.180 96.927 1.00 9.20 ? 549 PHE D O 1 +ATOM 14310 C CB . PHE C 1 529 ? 64.073 55.935 97.239 1.00 8.03 ? 549 PHE D CB 1 +ATOM 14311 C CG . PHE C 1 529 ? 65.549 55.636 97.274 1.00 8.81 ? 549 PHE D CG 1 +ATOM 14312 C CD1 . PHE C 1 529 ? 66.426 56.474 97.924 1.00 9.04 ? 549 PHE D CD1 1 +ATOM 14313 C CD2 . PHE C 1 529 ? 66.050 54.498 96.655 1.00 10.78 ? 549 PHE D CD2 1 +ATOM 14314 C CE1 . PHE C 1 529 ? 67.794 56.206 97.935 1.00 9.28 ? 549 PHE D CE1 1 +ATOM 14315 C CE2 . PHE C 1 529 ? 67.403 54.214 96.678 1.00 11.20 ? 549 PHE D CE2 1 +ATOM 14316 C CZ . PHE C 1 529 ? 68.269 55.064 97.315 1.00 10.03 ? 549 PHE D CZ 1 +ATOM 14317 N N . HIS C 1 530 ? 62.306 57.948 95.009 1.00 9.66 ? 550 HIS D N 1 +ATOM 14318 C CA . HIS C 1 530 ? 61.033 58.163 94.292 1.00 9.29 ? 550 HIS D CA 1 +ATOM 14319 C C . HIS C 1 530 ? 61.000 57.475 92.933 1.00 9.25 ? 550 HIS D C 1 +ATOM 14320 O O . HIS C 1 530 ? 61.989 57.498 92.188 1.00 8.90 ? 550 HIS D O 1 +ATOM 14321 C CB . HIS C 1 530 ? 60.786 59.661 94.071 1.00 9.03 ? 550 HIS D CB 1 +ATOM 14322 C CG . HIS C 1 530 ? 60.461 60.414 95.322 1.00 8.72 ? 550 HIS D CG 1 +ATOM 14323 N ND1 . HIS C 1 530 ? 59.214 60.382 95.906 1.00 7.96 ? 550 HIS D ND1 1 +ATOM 14324 C CD2 . HIS C 1 530 ? 61.228 61.196 96.110 1.00 9.07 ? 550 HIS D CD2 1 +ATOM 14325 C CE1 . HIS C 1 530 ? 59.223 61.134 96.996 1.00 8.86 ? 550 HIS D CE1 1 +ATOM 14326 N NE2 . HIS C 1 530 ? 60.433 61.642 97.139 1.00 8.78 ? 550 HIS D NE2 1 +ATOM 14327 N N . GLN C 1 531 ? 59.867 56.876 92.582 1.00 9.00 ? 551 GLN D N 1 +ATOM 14328 C CA . GLN C 1 531 ? 59.685 56.412 91.221 1.00 9.54 ? 551 GLN D CA 1 +ATOM 14329 C C . GLN C 1 531 ? 58.222 56.320 90.869 1.00 10.47 ? 551 GLN D C 1 +ATOM 14330 O O . GLN C 1 531 ? 57.390 55.966 91.722 1.00 11.09 ? 551 GLN D O 1 +ATOM 14331 C CB . GLN C 1 531 ? 60.338 55.051 91.005 1.00 10.33 ? 551 GLN D CB 1 +ATOM 14332 C CG . GLN C 1 531 ? 60.611 54.712 89.544 1.00 10.99 ? 551 GLN D CG 1 +ATOM 14333 C CD . GLN C 1 531 ? 62.090 54.725 89.216 1.00 13.66 ? 551 GLN D CD 1 +ATOM 14334 O OE1 . GLN C 1 531 ? 62.901 55.277 89.955 1.00 16.11 ? 551 GLN D OE1 1 +ATOM 14335 N NE2 . GLN C 1 531 ? 62.440 54.128 88.099 1.00 17.80 ? 551 GLN D NE2 1 +ATOM 14336 N N . ASP C 1 532 ? 57.925 56.663 89.617 1.00 10.17 ? 552 ASP D N 1 +ATOM 14337 C CA . ASP C 1 532 ? 56.666 56.275 88.979 1.00 10.88 ? 552 ASP D CA 1 +ATOM 14338 C C . ASP C 1 532 ? 56.983 55.631 87.624 1.00 11.21 ? 552 ASP D C 1 +ATOM 14339 O O . ASP C 1 532 ? 57.777 56.187 86.845 1.00 10.96 ? 552 ASP D O 1 +ATOM 14340 C CB . ASP C 1 532 ? 55.757 57.471 88.753 1.00 10.96 ? 552 ASP D CB 1 +ATOM 14341 C CG . ASP C 1 532 ? 54.379 57.053 88.323 1.00 11.44 ? 552 ASP D CG 1 +ATOM 14342 O OD1 . ASP C 1 532 ? 53.615 56.661 89.225 1.00 12.01 ? 552 ASP D OD1 1 +ATOM 14343 O OD2 . ASP C 1 532 ? 54.083 57.084 87.095 1.00 11.23 ? 552 ASP D OD2 1 +ATOM 14344 N N . PRO C 1 533 ? 56.409 54.444 87.346 1.00 11.51 ? 553 PRO D N 1 +ATOM 14345 C CA . PRO C 1 533 ? 55.601 53.624 88.249 1.00 11.38 ? 553 PRO D CA 1 +ATOM 14346 C C . PRO C 1 533 ? 56.407 53.240 89.487 1.00 11.36 ? 553 PRO D C 1 +ATOM 14347 O O . PRO C 1 533 ? 57.634 53.329 89.470 1.00 10.22 ? 553 PRO D O 1 +ATOM 14348 C CB . PRO C 1 533 ? 55.259 52.390 87.389 1.00 11.75 ? 553 PRO D CB 1 +ATOM 14349 C CG . PRO C 1 533 ? 55.407 52.862 85.967 1.00 11.95 ? 553 PRO D CG 1 +ATOM 14350 C CD . PRO C 1 533 ? 56.580 53.790 86.031 1.00 11.91 ? 553 PRO D CD 1 +ATOM 14351 N N . PRO C 1 534 ? 55.732 52.826 90.569 1.00 11.46 ? 554 PRO D N 1 +ATOM 14352 C CA . PRO C 1 534 ? 56.453 52.575 91.818 1.00 11.30 ? 554 PRO D CA 1 +ATOM 14353 C C . PRO C 1 534 ? 57.310 51.300 91.794 1.00 11.17 ? 554 PRO D C 1 +ATOM 14354 O O . PRO C 1 534 ? 56.913 50.293 91.202 1.00 11.17 ? 554 PRO D O 1 +ATOM 14355 C CB . PRO C 1 534 ? 55.321 52.458 92.848 1.00 11.65 ? 554 PRO D CB 1 +ATOM 14356 C CG . PRO C 1 534 ? 54.160 51.968 92.065 1.00 12.37 ? 554 PRO D CG 1 +ATOM 14357 C CD . PRO C 1 534 ? 54.282 52.593 90.709 1.00 11.75 ? 554 PRO D CD 1 +ATOM 14358 N N . LEU C 1 535 ? 58.481 51.365 92.434 1.00 10.06 ? 555 LEU D N 1 +ATOM 14359 C CA . LEU C 1 535 ? 59.361 50.227 92.636 1.00 10.19 ? 555 LEU D CA 1 +ATOM 14360 C C . LEU C 1 535 ? 59.674 50.055 94.117 1.00 8.98 ? 555 LEU D C 1 +ATOM 14361 O O . LEU C 1 535 ? 59.704 51.033 94.857 1.00 9.34 ? 555 LEU D O 1 +ATOM 14362 C CB . LEU C 1 535 ? 60.686 50.449 91.902 1.00 10.07 ? 555 LEU D CB 1 +ATOM 14363 C CG . LEU C 1 535 ? 60.594 50.560 90.383 1.00 11.32 ? 555 LEU D CG 1 +ATOM 14364 C CD1 . LEU C 1 535 ? 61.927 50.963 89.780 1.00 12.86 ? 555 LEU D CD1 1 +ATOM 14365 C CD2 . LEU C 1 535 ? 60.104 49.260 89.799 1.00 13.31 ? 555 LEU D CD2 1 +ATOM 14366 N N . MET C 1 536 ? 59.981 48.828 94.526 1.00 8.62 ? 556 MET D N 1 +ATOM 14367 C CA . MET C 1 536 ? 60.359 48.559 95.920 1.00 8.97 ? 556 MET D CA 1 +ATOM 14368 C C . MET C 1 536 ? 61.418 49.543 96.419 1.00 8.25 ? 556 MET D C 1 +ATOM 14369 O O . MET C 1 536 ? 62.347 49.882 95.697 1.00 8.25 ? 556 MET D O 1 +ATOM 14370 C CB . MET C 1 536 ? 60.869 47.132 96.098 1.00 8.78 ? 556 MET D CB 1 +ATOM 14371 C CG . MET C 1 536 ? 59.810 46.059 95.939 1.00 8.80 ? 556 MET D CG 1 +ATOM 14372 S SD . MET C 1 536 ? 60.465 44.376 95.842 1.00 10.48 ? 556 MET D SD 1 +ATOM 14373 C CE . MET C 1 536 ? 61.186 44.227 97.474 1.00 9.14 ? 556 MET D CE 1 +ATOM 14374 N N . PHE C 1 537 ? 61.277 49.953 97.677 1.00 7.76 ? 557 PHE D N 1 +ATOM 14375 C CA . PHE C 1 537 ? 62.182 50.891 98.372 1.00 7.04 ? 557 PHE D CA 1 +ATOM 14376 C C . PHE C 1 537 ? 61.834 52.359 98.165 1.00 7.19 ? 557 PHE D C 1 +ATOM 14377 O O . PHE C 1 537 ? 62.391 53.210 98.850 1.00 7.33 ? 557 PHE D O 1 +ATOM 14378 C CB . PHE C 1 537 ? 63.677 50.639 98.107 1.00 6.98 ? 557 PHE D CB 1 +ATOM 14379 C CG . PHE C 1 537 ? 64.173 49.297 98.607 1.00 6.67 ? 557 PHE D CG 1 +ATOM 14380 C CD1 . PHE C 1 537 ? 64.528 49.117 99.947 1.00 8.55 ? 557 PHE D CD1 1 +ATOM 14381 C CD2 . PHE C 1 537 ? 64.290 48.212 97.741 1.00 6.93 ? 557 PHE D CD2 1 +ATOM 14382 C CE1 . PHE C 1 537 ? 64.968 47.872 100.408 1.00 7.98 ? 557 PHE D CE1 1 +ATOM 14383 C CE2 . PHE C 1 537 ? 64.760 46.971 98.191 1.00 5.59 ? 557 PHE D CE2 1 +ATOM 14384 C CZ . PHE C 1 537 ? 65.099 46.804 99.531 1.00 7.39 ? 557 PHE D CZ 1 +ATOM 14385 N N . THR C 1 538 ? 60.937 52.666 97.222 1.00 6.88 ? 558 THR D N 1 +ATOM 14386 C CA . THR C 1 538 ? 60.507 54.063 97.041 1.00 6.91 ? 558 THR D CA 1 +ATOM 14387 C C . THR C 1 538 ? 59.352 54.389 97.993 1.00 7.54 ? 558 THR D C 1 +ATOM 14388 O O . THR C 1 538 ? 58.626 53.496 98.464 1.00 8.60 ? 558 THR D O 1 +ATOM 14389 C CB . THR C 1 538 ? 60.055 54.366 95.611 1.00 6.55 ? 558 THR D CB 1 +ATOM 14390 O OG1 . THR C 1 538 ? 58.940 53.530 95.271 1.00 6.21 ? 558 THR D OG1 1 +ATOM 14391 C CG2 . THR C 1 538 ? 61.197 54.129 94.621 1.00 5.87 ? 558 THR D CG2 1 +ATOM 14392 N N . GLU C 1 539 ? 59.189 55.680 98.257 1.00 8.26 ? 559 GLU D N 1 +ATOM 14393 C CA . GLU C 1 539 ? 58.098 56.165 99.091 1.00 8.78 ? 559 GLU D CA 1 +ATOM 14394 C C . GLU C 1 539 ? 56.771 55.832 98.422 1.00 8.92 ? 559 GLU D C 1 +ATOM 14395 O O . GLU C 1 539 ? 55.775 55.616 99.103 1.00 9.35 ? 559 GLU D O 1 +ATOM 14396 C CB . GLU C 1 539 ? 58.235 57.673 99.358 1.00 9.82 ? 559 GLU D CB 1 +ATOM 14397 C CG . GLU C 1 539 ? 59.563 58.024 100.057 1.00 9.50 ? 559 GLU D CG 1 +ATOM 14398 C CD . GLU C 1 539 ? 59.511 59.223 100.995 1.00 10.52 ? 559 GLU D CD 1 +ATOM 14399 O OE1 . GLU C 1 539 ? 58.424 59.543 101.539 1.00 12.42 ? 559 GLU D OE1 1 +ATOM 14400 O OE2 . GLU C 1 539 ? 60.582 59.848 101.192 1.00 8.01 ? 559 GLU D OE2 1 +ATOM 14401 N N . GLU C 1 540 ? 56.761 55.788 97.090 1.00 8.84 ? 560 GLU D N 1 +ATOM 14402 C CA . GLU C 1 540 ? 55.531 55.526 96.335 1.00 9.29 ? 560 GLU D CA 1 +ATOM 14403 C C . GLU C 1 540 ? 55.108 54.080 96.480 1.00 9.43 ? 560 GLU D C 1 +ATOM 14404 O O . GLU C 1 540 ? 53.906 53.777 96.557 1.00 10.17 ? 560 GLU D O 1 +ATOM 14405 C CB . GLU C 1 540 ? 55.691 55.863 94.859 1.00 9.56 ? 560 GLU D CB 1 +ATOM 14406 C CG . GLU C 1 540 ? 55.727 57.374 94.572 1.00 9.58 ? 560 GLU D CG 1 +ATOM 14407 C CD . GLU C 1 540 ? 57.023 58.024 95.010 1.00 9.11 ? 560 GLU D CD 1 +ATOM 14408 O OE1 . GLU C 1 540 ? 58.057 57.342 95.021 1.00 9.05 ? 560 GLU D OE1 1 +ATOM 14409 O OE2 . GLU C 1 540 ? 57.019 59.225 95.326 1.00 8.40 ? 560 GLU D OE2 1 +ATOM 14410 N N . TYR C 1 541 ? 56.090 53.189 96.515 1.00 9.74 ? 561 TYR D N 1 +ATOM 14411 C CA . TYR C 1 541 ? 55.806 51.774 96.727 1.00 9.45 ? 561 TYR D CA 1 +ATOM 14412 C C . TYR C 1 541 ? 55.219 51.566 98.121 1.00 9.24 ? 561 TYR D C 1 +ATOM 14413 O O . TYR C 1 541 ? 54.258 50.802 98.296 1.00 9.99 ? 561 TYR D O 1 +ATOM 14414 C CB . TYR C 1 541 ? 57.046 50.904 96.526 1.00 9.18 ? 561 TYR D CB 1 +ATOM 14415 C CG . TYR C 1 541 ? 56.682 49.456 96.331 1.00 8.39 ? 561 TYR D CG 1 +ATOM 14416 C CD1 . TYR C 1 541 ? 56.539 48.610 97.407 1.00 9.05 ? 561 TYR D CD1 1 +ATOM 14417 C CD2 . TYR C 1 541 ? 56.434 48.946 95.056 1.00 8.78 ? 561 TYR D CD2 1 +ATOM 14418 C CE1 . TYR C 1 541 ? 56.185 47.276 97.231 1.00 8.62 ? 561 TYR D CE1 1 +ATOM 14419 C CE2 . TYR C 1 541 ? 56.075 47.619 94.869 1.00 8.22 ? 561 TYR D CE2 1 +ATOM 14420 C CZ . TYR C 1 541 ? 55.952 46.791 95.961 1.00 8.86 ? 561 TYR D CZ 1 +ATOM 14421 O OH . TYR C 1 541 ? 55.585 45.470 95.789 1.00 9.03 ? 561 TYR D OH 1 +ATOM 14422 N N . GLN C 1 542 ? 55.764 52.262 99.114 1.00 9.14 ? 562 GLN D N 1 +ATOM 14423 C CA . GLN C 1 542 ? 55.229 52.164 100.467 1.00 9.44 ? 562 GLN D CA 1 +ATOM 14424 C C . GLN C 1 542 ? 53.774 52.590 100.492 1.00 9.81 ? 562 GLN D C 1 +ATOM 14425 O O . GLN C 1 542 ? 52.910 51.871 101.005 1.00 9.74 ? 562 GLN D O 1 +ATOM 14426 C CB . GLN C 1 542 ? 56.024 53.009 101.457 1.00 9.61 ? 562 GLN D CB 1 +ATOM 14427 C CG . GLN C 1 542 ? 55.698 52.682 102.908 1.00 8.76 ? 562 GLN D CG 1 +ATOM 14428 C CD . GLN C 1 542 ? 56.564 53.429 103.905 1.00 8.68 ? 562 GLN D CD 1 +ATOM 14429 O OE1 . GLN C 1 542 ? 56.995 54.576 103.664 1.00 9.37 ? 562 GLN D OE1 1 +ATOM 14430 N NE2 . GLN C 1 542 ? 56.789 52.804 105.055 1.00 8.44 ? 562 GLN D NE2 1 +ATOM 14431 N N . LYS C 1 543 ? 53.496 53.757 99.925 1.00 9.61 ? 563 LYS D N 1 +ATOM 14432 C CA . LYS C 1 543 ? 52.122 54.215 99.829 1.00 10.45 ? 563 LYS D CA 1 +ATOM 14433 C C . LYS C 1 543 ? 51.211 53.199 99.136 1.00 9.59 ? 563 LYS D C 1 +ATOM 14434 O O . LYS C 1 543 ? 50.113 52.898 99.631 1.00 9.70 ? 563 LYS D O 1 +ATOM 14435 C CB . LYS C 1 543 ? 52.066 55.560 99.116 1.00 10.69 ? 563 LYS D CB 1 +ATOM 14436 C CG . LYS C 1 543 ? 52.645 56.707 99.934 1.00 12.31 ? 563 LYS D CG 1 +ATOM 14437 C CD . LYS C 1 543 ? 52.600 58.058 99.185 1.00 14.07 ? 563 LYS D CD 1 +ATOM 14438 C CE . LYS C 1 543 ? 51.191 58.634 99.152 1.00 17.34 ? 563 LYS D CE 1 +ATOM 14439 N NZ . LYS C 1 543 ? 51.054 59.819 98.235 1.00 21.55 ? 563 LYS D NZ 1 +ATOM 14440 N N . SER C 1 544 ? 51.640 52.661 98.000 1.00 8.36 ? 564 SER D N 1 +ATOM 14441 C CA A SER C 1 544 ? 50.791 51.772 97.210 0.50 8.84 ? 564 SER D CA 1 +ATOM 14442 C CA B SER C 1 544 ? 50.763 51.791 97.235 0.50 8.37 ? 564 SER D CA 1 +ATOM 14443 C C . SER C 1 544 ? 50.509 50.484 97.980 1.00 8.44 ? 564 SER D C 1 +ATOM 14444 O O . SER C 1 544 ? 49.376 49.994 98.024 1.00 9.51 ? 564 SER D O 1 +ATOM 14445 C CB A SER C 1 544 ? 51.449 51.441 95.865 0.50 8.80 ? 564 SER D CB 1 +ATOM 14446 C CB B SER C 1 544 ? 51.330 51.516 95.848 0.50 8.19 ? 564 SER D CB 1 +ATOM 14447 O OG A SER C 1 544 ? 51.796 52.613 95.142 0.50 9.35 ? 564 SER D OG 1 +ATOM 14448 O OG B SER C 1 544 ? 50.323 50.970 95.026 0.50 5.95 ? 564 SER D OG 1 +ATOM 14449 N N . LEU C 1 545 ? 51.548 49.933 98.586 1.00 8.35 ? 565 LEU D N 1 +ATOM 14450 C CA . LEU C 1 545 ? 51.409 48.705 99.357 1.00 8.04 ? 565 LEU D CA 1 +ATOM 14451 C C . LEU C 1 545 ? 50.441 48.924 100.516 1.00 8.30 ? 565 LEU D C 1 +ATOM 14452 O O . LEU C 1 545 ? 49.544 48.100 100.748 1.00 8.10 ? 565 LEU D O 1 +ATOM 14453 C CB . LEU C 1 545 ? 52.775 48.236 99.865 1.00 8.03 ? 565 LEU D CB 1 +ATOM 14454 C CG . LEU C 1 545 ? 52.735 46.899 100.609 1.00 7.47 ? 565 LEU D CG 1 +ATOM 14455 C CD1 . LEU C 1 545 ? 53.942 46.032 100.283 1.00 8.52 ? 565 LEU D CD1 1 +ATOM 14456 C CD2 . LEU C 1 545 ? 52.637 47.097 102.120 1.00 7.40 ? 565 LEU D CD2 1 +ATOM 14457 N N . LEU C 1 546 ? 50.580 50.054 101.211 1.00 8.62 ? 566 LEU D N 1 +ATOM 14458 C CA . LEU C 1 546 ? 49.632 50.387 102.286 1.00 9.07 ? 566 LEU D CA 1 +ATOM 14459 C C . LEU C 1 546 ? 48.176 50.518 101.775 1.00 9.59 ? 566 LEU D C 1 +ATOM 14460 O O . LEU C 1 546 ? 47.232 49.985 102.394 1.00 9.04 ? 566 LEU D O 1 +ATOM 14461 C CB . LEU C 1 546 ? 50.068 51.636 103.034 1.00 8.82 ? 566 LEU D CB 1 +ATOM 14462 C CG . LEU C 1 546 ? 51.009 51.443 104.228 1.00 9.23 ? 566 LEU D CG 1 +ATOM 14463 C CD1 . LEU C 1 546 ? 52.250 50.615 103.919 1.00 8.60 ? 566 LEU D CD1 1 +ATOM 14464 C CD2 . LEU C 1 546 ? 51.401 52.814 104.770 1.00 11.98 ? 566 LEU D CD2 1 +ATOM 14465 N N . GLU C 1 547 ? 48.000 51.164 100.628 1.00 10.06 ? 567 GLU D N 1 +ATOM 14466 C CA . GLU C 1 547 ? 46.663 51.363 100.053 1.00 10.73 ? 567 GLU D CA 1 +ATOM 14467 C C . GLU C 1 547 ? 45.983 50.038 99.730 1.00 10.83 ? 567 GLU D C 1 +ATOM 14468 O O . GLU C 1 547 ? 44.781 49.873 99.977 1.00 10.58 ? 567 GLU D O 1 +ATOM 14469 C CB . GLU C 1 547 ? 46.746 52.240 98.799 1.00 10.78 ? 567 GLU D CB 1 +ATOM 14470 C CG . GLU C 1 547 ? 46.927 53.742 99.074 1.00 12.66 ? 567 GLU D CG 1 +ATOM 14471 C CD . GLU C 1 547 ? 47.258 54.539 97.824 1.00 13.10 ? 567 GLU D CD 1 +ATOM 14472 O OE1 . GLU C 1 547 ? 47.506 53.935 96.761 1.00 17.47 ? 567 GLU D OE1 1 +ATOM 14473 O OE2 . GLU C 1 547 ? 47.286 55.784 97.901 1.00 18.66 ? 567 GLU D OE2 1 +ATOM 14474 N N . GLN C 1 548 ? 46.746 49.089 99.194 1.00 10.51 ? 568 GLN D N 1 +ATOM 14475 C CA . GLN C 1 548 ? 46.201 47.780 98.825 1.00 10.37 ? 568 GLN D CA 1 +ATOM 14476 C C . GLN C 1 548 ? 45.862 46.941 100.057 1.00 10.43 ? 568 GLN D C 1 +ATOM 14477 O O . GLN C 1 548 ? 44.810 46.296 100.089 1.00 10.41 ? 568 GLN D O 1 +ATOM 14478 C CB . GLN C 1 548 ? 47.170 47.031 97.906 1.00 10.65 ? 568 GLN D CB 1 +ATOM 14479 C CG . GLN C 1 548 ? 47.382 47.726 96.580 1.00 10.43 ? 568 GLN D CG 1 +ATOM 14480 C CD . GLN C 1 548 ? 46.062 47.959 95.866 1.00 11.85 ? 568 GLN D CD 1 +ATOM 14481 O OE1 . GLN C 1 548 ? 45.272 47.037 95.686 1.00 12.04 ? 568 GLN D OE1 1 +ATOM 14482 N NE2 . GLN C 1 548 ? 45.798 49.211 95.507 1.00 13.02 ? 568 GLN D NE2 1 +ATOM 14483 N N . TYR C 1 549 ? 46.756 46.938 101.053 1.00 9.50 ? 569 TYR D N 1 +ATOM 14484 C CA . TYR C 1 549 ? 46.442 46.356 102.358 1.00 9.64 ? 569 TYR D CA 1 +ATOM 14485 C C . TYR C 1 549 ? 45.180 46.952 102.979 1.00 9.27 ? 569 TYR D C 1 +ATOM 14486 O O . TYR C 1 549 ? 44.310 46.203 103.460 1.00 9.98 ? 569 TYR D O 1 +ATOM 14487 C CB . TYR C 1 549 ? 47.625 46.473 103.331 1.00 10.00 ? 569 TYR D CB 1 +ATOM 14488 C CG . TYR C 1 549 ? 48.445 45.209 103.336 1.00 9.67 ? 569 TYR D CG 1 +ATOM 14489 C CD1 . TYR C 1 549 ? 49.465 45.025 102.411 1.00 10.63 ? 569 TYR D CD1 1 +ATOM 14490 C CD2 . TYR C 1 549 ? 48.171 44.174 104.227 1.00 8.65 ? 569 TYR D CD2 1 +ATOM 14491 C CE1 . TYR C 1 549 ? 50.188 43.866 102.379 1.00 10.60 ? 569 TYR D CE1 1 +ATOM 14492 C CE2 . TYR C 1 549 ? 48.896 42.988 104.206 1.00 9.93 ? 569 TYR D CE2 1 +ATOM 14493 C CZ . TYR C 1 549 ? 49.907 42.842 103.278 1.00 11.38 ? 569 TYR D CZ 1 +ATOM 14494 O OH . TYR C 1 549 ? 50.638 41.688 103.239 1.00 11.42 ? 569 TYR D OH 1 +ATOM 14495 N N . HIS C 1 550 ? 45.075 48.281 102.930 1.00 9.19 ? 570 HIS D N 1 +ATOM 14496 C CA . HIS C 1 550 ? 43.954 49.003 103.519 1.00 9.02 ? 570 HIS D CA 1 +ATOM 14497 C C . HIS C 1 550 ? 42.658 48.617 102.804 1.00 9.19 ? 570 HIS D C 1 +ATOM 14498 O O . HIS C 1 550 ? 41.626 48.483 103.451 1.00 9.20 ? 570 HIS D O 1 +ATOM 14499 C CB . HIS C 1 550 ? 44.192 50.521 103.480 1.00 8.87 ? 570 HIS D CB 1 +ATOM 14500 C CG . HIS C 1 550 ? 45.375 50.970 104.288 1.00 6.75 ? 570 HIS D CG 1 +ATOM 14501 N ND1 . HIS C 1 550 ? 45.974 52.202 104.120 1.00 8.15 ? 570 HIS D ND1 1 +ATOM 14502 C CD2 . HIS C 1 550 ? 46.091 50.330 105.243 1.00 9.00 ? 570 HIS D CD2 1 +ATOM 14503 C CE1 . HIS C 1 550 ? 46.986 52.311 104.965 1.00 7.66 ? 570 HIS D CE1 1 +ATOM 14504 N NE2 . HIS C 1 550 ? 47.086 51.183 105.650 1.00 6.45 ? 570 HIS D NE2 1 +ATOM 14505 N N . LEU C 1 551 ? 42.709 48.434 101.483 1.00 9.50 ? 571 LEU D N 1 +ATOM 14506 C CA . LEU C 1 551 ? 41.514 48.010 100.742 1.00 10.37 ? 571 LEU D CA 1 +ATOM 14507 C C . LEU C 1 551 ? 41.088 46.585 101.133 1.00 10.88 ? 571 LEU D C 1 +ATOM 14508 O O . LEU C 1 551 ? 39.894 46.289 101.256 1.00 11.64 ? 571 LEU D O 1 +ATOM 14509 C CB . LEU C 1 551 ? 41.746 48.092 99.238 1.00 10.32 ? 571 LEU D CB 1 +ATOM 14510 C CG . LEU C 1 551 ? 41.759 49.512 98.674 1.00 12.23 ? 571 LEU D CG 1 +ATOM 14511 C CD1 . LEU C 1 551 ? 42.323 49.521 97.265 1.00 14.00 ? 571 LEU D CD1 1 +ATOM 14512 C CD2 . LEU C 1 551 ? 40.353 50.078 98.715 1.00 12.05 ? 571 LEU D CD2 1 +ATOM 14513 N N . GLY C 1 552 ? 42.060 45.709 101.330 1.00 11.16 ? 572 GLY D N 1 +ATOM 14514 C CA . GLY C 1 552 ? 41.783 44.361 101.830 1.00 11.06 ? 572 GLY D CA 1 +ATOM 14515 C C . GLY C 1 552 ? 41.217 44.400 103.235 1.00 11.47 ? 572 GLY D C 1 +ATOM 14516 O O . GLY C 1 552 ? 40.198 43.767 103.523 1.00 12.01 ? 572 GLY D O 1 +ATOM 14517 N N . LEU C 1 553 ? 41.867 45.149 104.118 1.00 11.09 ? 573 LEU D N 1 +ATOM 14518 C CA . LEU C 1 553 ? 41.410 45.257 105.500 1.00 11.48 ? 573 LEU D CA 1 +ATOM 14519 C C . LEU C 1 553 ? 39.980 45.789 105.584 1.00 11.87 ? 573 LEU D C 1 +ATOM 14520 O O . LEU C 1 553 ? 39.201 45.358 106.444 1.00 12.14 ? 573 LEU D O 1 +ATOM 14521 C CB . LEU C 1 553 ? 42.362 46.129 106.320 1.00 11.23 ? 573 LEU D CB 1 +ATOM 14522 C CG . LEU C 1 553 ? 43.693 45.425 106.621 1.00 10.89 ? 573 LEU D CG 1 +ATOM 14523 C CD1 . LEU C 1 553 ? 44.749 46.434 106.988 1.00 9.68 ? 573 LEU D CD1 1 +ATOM 14524 C CD2 . LEU C 1 553 ? 43.524 44.409 107.747 1.00 10.79 ? 573 LEU D CD2 1 +ATOM 14525 N N . ASP C 1 554 ? 39.635 46.721 104.694 1.00 12.14 ? 574 ASP D N 1 +ATOM 14526 C CA . ASP C 1 554 ? 38.281 47.272 104.627 1.00 12.48 ? 574 ASP D CA 1 +ATOM 14527 C C . ASP C 1 554 ? 37.227 46.191 104.376 1.00 12.71 ? 574 ASP D C 1 +ATOM 14528 O O . ASP C 1 554 ? 36.095 46.304 104.855 1.00 12.20 ? 574 ASP D O 1 +ATOM 14529 C CB . ASP C 1 554 ? 38.179 48.339 103.522 1.00 12.26 ? 574 ASP D CB 1 +ATOM 14530 C CG . ASP C 1 554 ? 38.858 49.648 103.895 1.00 13.32 ? 574 ASP D CG 1 +ATOM 14531 O OD1 . ASP C 1 554 ? 39.285 49.816 105.059 1.00 12.62 ? 574 ASP D OD1 1 +ATOM 14532 O OD2 . ASP C 1 554 ? 38.969 50.524 103.008 1.00 13.74 ? 574 ASP D OD2 1 +ATOM 14533 N N . GLN C 1 555 ? 37.577 45.144 103.634 1.00 13.23 ? 575 GLN D N 1 +ATOM 14534 C CA . GLN C 1 555 ? 36.577 44.124 103.294 1.00 14.07 ? 575 GLN D CA 1 +ATOM 14535 C C . GLN C 1 555 ? 36.203 43.216 104.465 1.00 14.51 ? 575 GLN D C 1 +ATOM 14536 O O . GLN C 1 555 ? 35.182 42.521 104.400 1.00 14.32 ? 575 GLN D O 1 +ATOM 14537 C CB . GLN C 1 555 ? 37.038 43.289 102.100 1.00 14.43 ? 575 GLN D CB 1 +ATOM 14538 C CG . GLN C 1 555 ? 37.076 44.066 100.799 1.00 16.24 ? 575 GLN D CG 1 +ATOM 14539 C CD . GLN C 1 555 ? 35.702 44.529 100.343 1.00 18.73 ? 575 GLN D CD 1 +ATOM 14540 O OE1 . GLN C 1 555 ? 35.509 45.699 100.030 1.00 21.97 ? 575 GLN D OE1 1 +ATOM 14541 N NE2 . GLN C 1 555 ? 34.737 43.613 100.323 1.00 19.67 ? 575 GLN D NE2 1 +ATOM 14542 N N . LYS C 1 556 ? 37.002 43.222 105.533 1.00 14.65 ? 576 LYS D N 1 +ATOM 14543 C CA . LYS C 1 556 ? 36.728 42.368 106.676 1.00 15.60 ? 576 LYS D CA 1 +ATOM 14544 C C . LYS C 1 556 ? 36.704 43.046 108.045 1.00 15.75 ? 576 LYS D C 1 +ATOM 14545 O O . LYS C 1 556 ? 36.314 42.420 109.021 1.00 15.44 ? 576 LYS D O 1 +ATOM 14546 C CB . LYS C 1 556 ? 37.696 41.169 106.668 1.00 16.34 ? 576 LYS D CB 1 +ATOM 14547 C CG . LYS C 1 556 ? 37.435 40.191 105.497 1.00 16.64 ? 576 LYS D CG 1 +ATOM 14548 C CD . LYS C 1 556 ? 36.009 39.610 105.523 1.00 19.13 ? 576 LYS D CD 1 +ATOM 14549 C CE . LYS C 1 556 ? 35.686 38.782 104.286 1.00 20.15 ? 576 LYS D CE 1 +ATOM 14550 N NZ . LYS C 1 556 ? 35.409 39.611 103.079 1.00 21.39 ? 576 LYS D NZ 1 +ATOM 14551 N N . ARG C 1 557 ? 37.073 44.321 108.127 1.00 16.33 ? 577 ARG D N 1 +ATOM 14552 C CA . ARG C 1 557 ? 37.195 44.979 109.435 1.00 17.32 ? 577 ARG D CA 1 +ATOM 14553 C C . ARG C 1 557 ? 35.875 45.314 110.143 1.00 18.56 ? 577 ARG D C 1 +ATOM 14554 O O . ARG C 1 557 ? 35.892 45.711 111.309 1.00 19.98 ? 577 ARG D O 1 +ATOM 14555 C CB . ARG C 1 557 ? 38.078 46.228 109.347 1.00 17.53 ? 577 ARG D CB 1 +ATOM 14556 C CG . ARG C 1 557 ? 37.521 47.374 108.530 1.00 16.38 ? 577 ARG D CG 1 +ATOM 14557 C CD . ARG C 1 557 ? 38.510 48.533 108.561 1.00 16.55 ? 577 ARG D CD 1 +ATOM 14558 N NE . ARG C 1 557 ? 38.086 49.667 107.743 1.00 16.41 ? 577 ARG D NE 1 +ATOM 14559 C CZ . ARG C 1 557 ? 37.247 50.623 108.136 1.00 15.33 ? 577 ARG D CZ 1 +ATOM 14560 N NH1 . ARG C 1 557 ? 36.701 50.614 109.341 1.00 14.41 ? 577 ARG D NH1 1 +ATOM 14561 N NH2 . ARG C 1 557 ? 36.947 51.604 107.298 1.00 16.95 ? 577 ARG D NH2 1 +ATOM 14562 N N . ARG C 1 558 ? 34.746 45.163 109.458 1.00 19.37 ? 578 ARG D N 1 +ATOM 14563 C CA . ARG C 1 558 ? 33.428 45.296 110.108 1.00 20.12 ? 578 ARG D CA 1 +ATOM 14564 C C . ARG C 1 558 ? 32.774 43.934 110.299 1.00 19.71 ? 578 ARG D C 1 +ATOM 14565 O O . ARG C 1 558 ? 31.568 43.841 110.577 1.00 19.78 ? 578 ARG D O 1 +ATOM 14566 C CB . ARG C 1 558 ? 32.515 46.206 109.288 1.00 20.88 ? 578 ARG D CB 1 +ATOM 14567 C CG . ARG C 1 558 ? 33.134 47.548 108.937 1.00 24.13 ? 578 ARG D CG 1 +ATOM 14568 C CD . ARG C 1 558 ? 33.755 48.252 110.153 1.00 28.45 ? 578 ARG D CD 1 +ATOM 14569 N NE . ARG C 1 558 ? 32.773 48.521 111.201 1.00 31.42 ? 578 ARG D NE 1 +ATOM 14570 C CZ . ARG C 1 558 ? 31.970 49.586 111.246 1.00 32.24 ? 578 ARG D CZ 1 +ATOM 14571 N NH1 . ARG C 1 558 ? 32.011 50.521 110.297 1.00 34.49 ? 578 ARG D NH1 1 +ATOM 14572 N NH2 . ARG C 1 558 ? 31.113 49.721 112.254 1.00 32.47 ? 578 ARG D NH2 1 +ATOM 14573 N N . LYS C 1 559 ? 33.574 42.881 110.159 1.00 19.00 ? 579 LYS D N 1 +ATOM 14574 C CA . LYS C 1 559 ? 33.097 41.524 110.281 1.00 18.44 ? 579 LYS D CA 1 +ATOM 14575 C C . LYS C 1 559 ? 33.876 40.840 111.388 1.00 17.38 ? 579 LYS D C 1 +ATOM 14576 O O . LYS C 1 559 ? 33.388 40.782 112.507 1.00 17.66 ? 579 LYS D O 1 +ATOM 14577 C CB . LYS C 1 559 ? 33.200 40.799 108.948 1.00 18.87 ? 579 LYS D CB 1 +ATOM 14578 C CG . LYS C 1 559 ? 32.406 41.500 107.839 1.00 20.67 ? 579 LYS D CG 1 +ATOM 14579 C CD . LYS C 1 559 ? 31.844 40.517 106.829 1.00 23.93 ? 579 LYS D CD 1 +ATOM 14580 C CE . LYS C 1 559 ? 30.536 39.882 107.303 1.00 25.01 ? 579 LYS D CE 1 +ATOM 14581 N NZ . LYS C 1 559 ? 29.379 40.838 107.324 1.00 27.28 ? 579 LYS D NZ 1 +ATOM 14582 N N . TYR C 1 560 ? 35.098 40.389 111.102 1.00 15.48 ? 580 TYR D N 1 +ATOM 14583 C CA . TYR C 1 560 ? 35.879 39.651 112.085 1.00 14.49 ? 580 TYR D CA 1 +ATOM 14584 C C . TYR C 1 560 ? 37.352 40.078 112.217 1.00 13.67 ? 580 TYR D C 1 +ATOM 14585 O O . TYR C 1 560 ? 38.049 39.568 113.092 1.00 13.29 ? 580 TYR D O 1 +ATOM 14586 C CB . TYR C 1 560 ? 35.793 38.141 111.809 1.00 14.61 ? 580 TYR D CB 1 +ATOM 14587 C CG . TYR C 1 560 ? 36.233 37.711 110.422 1.00 14.56 ? 580 TYR D CG 1 +ATOM 14588 C CD1 . TYR C 1 560 ? 37.582 37.617 110.090 1.00 13.36 ? 580 TYR D CD1 1 +ATOM 14589 C CD2 . TYR C 1 560 ? 35.294 37.370 109.448 1.00 15.50 ? 580 TYR D CD2 1 +ATOM 14590 C CE1 . TYR C 1 560 ? 37.985 37.218 108.825 1.00 13.72 ? 580 TYR D CE1 1 +ATOM 14591 C CE2 . TYR C 1 560 ? 35.685 36.973 108.185 1.00 14.83 ? 580 TYR D CE2 1 +ATOM 14592 C CZ . TYR C 1 560 ? 37.032 36.898 107.872 1.00 14.50 ? 580 TYR D CZ 1 +ATOM 14593 O OH . TYR C 1 560 ? 37.402 36.490 106.608 1.00 15.03 ? 580 TYR D OH 1 +ATOM 14594 N N . VAL C 1 561 ? 37.825 40.994 111.369 1.00 12.92 ? 581 VAL D N 1 +ATOM 14595 C CA . VAL C 1 561 ? 39.178 41.540 111.536 1.00 12.08 ? 581 VAL D CA 1 +ATOM 14596 C C . VAL C 1 561 ? 39.026 42.664 112.538 1.00 11.32 ? 581 VAL D C 1 +ATOM 14597 O O . VAL C 1 561 ? 38.260 43.604 112.298 1.00 11.05 ? 581 VAL D O 1 +ATOM 14598 C CB . VAL C 1 561 ? 39.812 42.014 110.207 1.00 11.73 ? 581 VAL D CB 1 +ATOM 14599 C CG1 . VAL C 1 561 ? 41.069 42.816 110.460 1.00 11.65 ? 581 VAL D CG1 1 +ATOM 14600 C CG2 . VAL C 1 561 ? 40.145 40.811 109.336 1.00 12.26 ? 581 VAL D CG2 1 +ATOM 14601 N N . VAL C 1 562 ? 39.683 42.534 113.694 1.00 10.42 ? 582 VAL D N 1 +ATOM 14602 C CA . VAL C 1 562 ? 39.529 43.511 114.777 1.00 9.63 ? 582 VAL D CA 1 +ATOM 14603 C C . VAL C 1 562 ? 40.759 44.384 114.991 1.00 9.29 ? 582 VAL D C 1 +ATOM 14604 O O . VAL C 1 562 ? 40.810 45.157 115.940 1.00 9.28 ? 582 VAL D O 1 +ATOM 14605 C CB . VAL C 1 562 ? 39.173 42.853 116.136 1.00 9.64 ? 582 VAL D CB 1 +ATOM 14606 C CG1 . VAL C 1 562 ? 37.844 42.151 116.022 1.00 10.34 ? 582 VAL D CG1 1 +ATOM 14607 C CG2 . VAL C 1 562 ? 40.285 41.902 116.597 1.00 9.78 ? 582 VAL D CG2 1 +ATOM 14608 N N . GLY C 1 563 ? 41.728 44.303 114.097 1.00 9.35 ? 583 GLY D N 1 +ATOM 14609 C CA . GLY C 1 563 ? 42.859 45.209 114.197 1.00 8.82 ? 583 GLY D CA 1 +ATOM 14610 C C . GLY C 1 563 ? 43.841 45.176 113.060 1.00 8.93 ? 583 GLY D C 1 +ATOM 14611 O O . GLY C 1 563 ? 43.897 44.212 112.279 1.00 9.11 ? 583 GLY D O 1 +ATOM 14612 N N . GLU C 1 564 ? 44.612 46.255 112.986 1.00 9.33 ? 584 GLU D N 1 +ATOM 14613 C CA . GLU C 1 564 ? 45.696 46.402 112.037 1.00 9.44 ? 584 GLU D CA 1 +ATOM 14614 C C . GLU C 1 564 ? 46.809 47.203 112.710 1.00 8.88 ? 584 GLU D C 1 +ATOM 14615 O O . GLU C 1 564 ? 46.558 48.281 113.283 1.00 9.12 ? 584 GLU D O 1 +ATOM 14616 C CB . GLU C 1 564 ? 45.215 47.111 110.759 1.00 9.65 ? 584 GLU D CB 1 +ATOM 14617 C CG . GLU C 1 564 ? 44.675 48.511 110.960 1.00 9.75 ? 584 GLU D CG 1 +ATOM 14618 C CD . GLU C 1 564 ? 44.039 49.101 109.708 1.00 11.03 ? 584 GLU D CD 1 +ATOM 14619 O OE1 . GLU C 1 564 ? 44.666 49.992 109.071 1.00 10.19 ? 584 GLU D OE1 1 +ATOM 14620 O OE2 . GLU C 1 564 ? 42.909 48.677 109.375 1.00 11.58 ? 584 GLU D OE2 1 +ATOM 14621 N N . LEU C 1 565 ? 48.031 46.682 112.608 1.00 8.77 ? 585 LEU D N 1 +ATOM 14622 C CA . LEU C 1 565 ? 49.229 47.307 113.137 1.00 8.90 ? 585 LEU D CA 1 +ATOM 14623 C C . LEU C 1 565 ? 50.303 47.357 112.043 1.00 8.92 ? 585 LEU D C 1 +ATOM 14624 O O . LEU C 1 565 ? 50.766 46.305 111.583 1.00 9.79 ? 585 LEU D O 1 +ATOM 14625 C CB . LEU C 1 565 ? 49.756 46.493 114.320 1.00 9.38 ? 585 LEU D CB 1 +ATOM 14626 C CG . LEU C 1 565 ? 48.791 46.196 115.476 1.00 8.65 ? 585 LEU D CG 1 +ATOM 14627 C CD1 . LEU C 1 565 ? 49.459 45.178 116.471 1.00 9.18 ? 585 LEU D CD1 1 +ATOM 14628 C CD2 . LEU C 1 565 ? 48.311 47.474 116.188 1.00 8.87 ? 585 LEU D CD2 1 +ATOM 14629 N N . ILE C 1 566 ? 50.692 48.553 111.622 1.00 8.51 ? 586 ILE D N 1 +ATOM 14630 C CA . ILE C 1 566 ? 51.716 48.707 110.585 1.00 8.61 ? 586 ILE D CA 1 +ATOM 14631 C C . ILE C 1 566 ? 53.083 48.336 111.149 1.00 7.99 ? 586 ILE D C 1 +ATOM 14632 O O . ILE C 1 566 ? 53.371 48.630 112.295 1.00 8.24 ? 586 ILE D O 1 +ATOM 14633 C CB . ILE C 1 566 ? 51.740 50.173 110.003 1.00 9.11 ? 586 ILE D CB 1 +ATOM 14634 C CG1 . ILE C 1 566 ? 52.670 50.247 108.785 1.00 10.48 ? 586 ILE D CG1 1 +ATOM 14635 C CG2 . ILE C 1 566 ? 52.130 51.180 111.071 1.00 9.93 ? 586 ILE D CG2 1 +ATOM 14636 C CD1 . ILE C 1 566 ? 52.296 51.310 107.789 1.00 14.45 ? 586 ILE D CD1 1 +ATOM 14637 N N . TRP C 1 567 ? 53.903 47.652 110.348 1.00 7.99 ? 587 TRP D N 1 +ATOM 14638 C CA . TRP C 1 567 ? 55.312 47.487 110.640 1.00 7.46 ? 587 TRP D CA 1 +ATOM 14639 C C . TRP C 1 567 ? 56.030 48.533 109.786 1.00 7.04 ? 587 TRP D C 1 +ATOM 14640 O O . TRP C 1 567 ? 55.962 48.422 108.566 1.00 6.26 ? 587 TRP D O 1 +ATOM 14641 C CB . TRP C 1 567 ? 55.832 46.098 110.277 1.00 7.69 ? 587 TRP D CB 1 +ATOM 14642 C CG . TRP C 1 567 ? 57.202 45.938 110.842 1.00 6.83 ? 587 TRP D CG 1 +ATOM 14643 C CD1 . TRP C 1 567 ? 58.370 46.255 110.241 1.00 8.79 ? 587 TRP D CD1 1 +ATOM 14644 C CD2 . TRP C 1 567 ? 57.536 45.510 112.172 1.00 7.18 ? 587 TRP D CD2 1 +ATOM 14645 N NE1 . TRP C 1 567 ? 59.427 46.028 111.101 1.00 7.91 ? 587 TRP D NE1 1 +ATOM 14646 C CE2 . TRP C 1 567 ? 58.937 45.592 112.300 1.00 7.01 ? 587 TRP D CE2 1 +ATOM 14647 C CE3 . TRP C 1 567 ? 56.786 45.066 113.261 1.00 7.63 ? 587 TRP D CE3 1 +ATOM 14648 C CZ2 . TRP C 1 567 ? 59.609 45.217 113.470 1.00 8.08 ? 587 TRP D CZ2 1 +ATOM 14649 C CZ3 . TRP C 1 567 ? 57.448 44.703 114.423 1.00 7.11 ? 587 TRP D CZ3 1 +ATOM 14650 C CH2 . TRP C 1 567 ? 58.847 44.778 114.519 1.00 7.91 ? 587 TRP D CH2 1 +ATOM 14651 N N . ASN C 1 568 ? 56.699 49.536 110.363 1.00 7.27 ? 588 ASN D N 1 +ATOM 14652 C CA . ASN C 1 568 ? 56.867 49.794 111.808 1.00 7.50 ? 588 ASN D CA 1 +ATOM 14653 C C . ASN C 1 568 ? 56.685 51.305 112.047 1.00 6.93 ? 588 ASN D C 1 +ATOM 14654 O O . ASN C 1 568 ? 56.710 52.104 111.102 1.00 7.29 ? 588 ASN D O 1 +ATOM 14655 C CB . ASN C 1 568 ? 58.283 49.338 112.245 1.00 8.12 ? 588 ASN D CB 1 +ATOM 14656 C CG . ASN C 1 568 ? 58.515 49.374 113.760 1.00 9.15 ? 588 ASN D CG 1 +ATOM 14657 O OD1 . ASN C 1 568 ? 58.830 50.425 114.326 1.00 10.38 ? 588 ASN D OD1 1 +ATOM 14658 N ND2 . ASN C 1 568 ? 58.417 48.198 114.417 1.00 10.15 ? 588 ASN D ND2 1 +ATOM 14659 N N . PHE C 1 569 ? 56.482 51.689 113.296 1.00 6.09 ? 589 PHE D N 1 +ATOM 14660 C CA . PHE C 1 569 ? 56.455 53.093 113.682 1.00 6.30 ? 589 PHE D CA 1 +ATOM 14661 C C . PHE C 1 569 ? 57.670 53.838 113.109 1.00 6.31 ? 589 PHE D C 1 +ATOM 14662 O O . PHE C 1 569 ? 57.520 54.845 112.411 1.00 6.35 ? 589 PHE D O 1 +ATOM 14663 C CB . PHE C 1 569 ? 56.422 53.188 115.206 1.00 6.93 ? 589 PHE D CB 1 +ATOM 14664 C CG . PHE C 1 569 ? 56.463 54.587 115.732 1.00 5.69 ? 589 PHE D CG 1 +ATOM 14665 C CD1 . PHE C 1 569 ? 57.651 55.128 116.218 1.00 6.08 ? 589 PHE D CD1 1 +ATOM 14666 C CD2 . PHE C 1 569 ? 55.307 55.366 115.775 1.00 8.75 ? 589 PHE D CD2 1 +ATOM 14667 C CE1 . PHE C 1 569 ? 57.686 56.438 116.723 1.00 7.67 ? 589 PHE D CE1 1 +ATOM 14668 C CE2 . PHE C 1 569 ? 55.340 56.663 116.271 1.00 7.74 ? 589 PHE D CE2 1 +ATOM 14669 C CZ . PHE C 1 569 ? 56.535 57.204 116.749 1.00 8.00 ? 589 PHE D CZ 1 +ATOM 14670 N N . ALA C 1 570 ? 58.868 53.315 113.336 1.00 6.94 ? 590 ALA D N 1 +ATOM 14671 C CA . ALA C 1 570 ? 60.064 53.988 112.829 1.00 6.86 ? 590 ALA D CA 1 +ATOM 14672 C C . ALA C 1 570 ? 61.180 53.030 112.388 1.00 7.01 ? 590 ALA D C 1 +ATOM 14673 O O . ALA C 1 570 ? 61.296 51.914 112.890 1.00 7.50 ? 590 ALA D O 1 +ATOM 14674 C CB . ALA C 1 570 ? 60.594 54.973 113.864 1.00 7.39 ? 590 ALA D CB 1 +ATOM 14675 N N . ASP C 1 571 ? 61.984 53.493 111.433 1.00 6.36 ? 591 ASP D N 1 +ATOM 14676 C CA . ASP C 1 571 ? 63.250 52.839 111.054 1.00 5.83 ? 591 ASP D CA 1 +ATOM 14677 C C . ASP C 1 571 ? 64.078 52.512 112.303 1.00 5.65 ? 591 ASP D C 1 +ATOM 14678 O O . ASP C 1 571 ? 64.236 53.358 113.200 1.00 5.58 ? 591 ASP D O 1 +ATOM 14679 C CB . ASP C 1 571 ? 64.084 53.735 110.130 1.00 6.19 ? 591 ASP D CB 1 +ATOM 14680 C CG . ASP C 1 571 ? 63.389 54.066 108.829 1.00 6.54 ? 591 ASP D CG 1 +ATOM 14681 O OD1 . ASP C 1 571 ? 62.401 53.373 108.488 1.00 7.06 ? 591 ASP D OD1 1 +ATOM 14682 O OD2 . ASP C 1 571 ? 63.826 55.041 108.154 1.00 7.77 ? 591 ASP D OD2 1 +ATOM 14683 N N . PHE C 1 572 ? 64.633 51.303 112.338 1.00 5.38 ? 592 PHE D N 1 +ATOM 14684 C CA . PHE C 1 572 ? 65.420 50.848 113.484 1.00 5.49 ? 592 PHE D CA 1 +ATOM 14685 C C . PHE C 1 572 ? 66.583 49.931 113.064 1.00 5.92 ? 592 PHE D C 1 +ATOM 14686 O O . PHE C 1 572 ? 66.631 49.450 111.937 1.00 5.62 ? 592 PHE D O 1 +ATOM 14687 C CB . PHE C 1 572 ? 64.500 50.142 114.472 1.00 5.68 ? 592 PHE D CB 1 +ATOM 14688 C CG . PHE C 1 572 ? 63.909 48.865 113.932 1.00 5.21 ? 592 PHE D CG 1 +ATOM 14689 C CD1 . PHE C 1 572 ? 64.577 47.662 114.067 1.00 6.35 ? 592 PHE D CD1 1 +ATOM 14690 C CD2 . PHE C 1 572 ? 62.685 48.877 113.278 1.00 5.77 ? 592 PHE D CD2 1 +ATOM 14691 C CE1 . PHE C 1 572 ? 64.037 46.489 113.565 1.00 4.73 ? 592 PHE D CE1 1 +ATOM 14692 C CE2 . PHE C 1 572 ? 62.153 47.715 112.751 1.00 6.00 ? 592 PHE D CE2 1 +ATOM 14693 C CZ . PHE C 1 572 ? 62.810 46.519 112.902 1.00 4.80 ? 592 PHE D CZ 1 +ATOM 14694 N N . MET C 1 573 ? 67.522 49.702 113.977 1.00 6.62 ? 593 MET D N 1 +ATOM 14695 C CA . MET C 1 573 ? 68.748 48.978 113.666 1.00 7.79 ? 593 MET D CA 1 +ATOM 14696 C C . MET C 1 573 ? 68.591 47.452 113.767 1.00 7.74 ? 593 MET D C 1 +ATOM 14697 O O . MET C 1 573 ? 67.861 46.932 114.608 1.00 7.08 ? 593 MET D O 1 +ATOM 14698 C CB . MET C 1 573 ? 69.877 49.470 114.586 1.00 7.70 ? 593 MET D CB 1 +ATOM 14699 C CG . MET C 1 573 ? 71.274 49.027 114.218 1.00 9.44 ? 593 MET D CG 1 +ATOM 14700 S SD . MET C 1 573 ? 71.693 49.172 112.482 1.00 10.45 ? 593 MET D SD 1 +ATOM 14701 C CE . MET C 1 573 ? 71.905 50.935 112.318 1.00 12.84 ? 593 MET D CE 1 +ATOM 14702 N N . THR C 1 574 ? 69.286 46.767 112.867 1.00 8.39 ? 594 THR D N 1 +ATOM 14703 C CA . THR C 1 574 ? 69.339 45.309 112.807 1.00 8.28 ? 594 THR D CA 1 +ATOM 14704 C C . THR C 1 574 ? 70.790 44.914 112.552 1.00 8.54 ? 594 THR D C 1 +ATOM 14705 O O . THR C 1 574 ? 71.646 45.762 112.291 1.00 8.78 ? 594 THR D O 1 +ATOM 14706 C CB . THR C 1 574 ? 68.520 44.742 111.637 1.00 8.30 ? 594 THR D CB 1 +ATOM 14707 O OG1 . THR C 1 574 ? 69.120 45.147 110.395 1.00 9.68 ? 594 THR D OG1 1 +ATOM 14708 C CG2 . THR C 1 574 ? 67.047 45.178 111.703 1.00 6.33 ? 594 THR D CG2 1 +ATOM 14709 N N . GLU C 1 575 ? 71.057 43.609 112.573 1.00 9.25 ? 595 GLU D N 1 +ATOM 14710 C CA . GLU C 1 575 ? 72.348 43.122 112.123 1.00 9.66 ? 595 GLU D CA 1 +ATOM 14711 C C . GLU C 1 575 ? 72.560 43.437 110.652 1.00 9.11 ? 595 GLU D C 1 +ATOM 14712 O O . GLU C 1 575 ? 71.618 43.582 109.879 1.00 8.65 ? 595 GLU D O 1 +ATOM 14713 C CB . GLU C 1 575 ? 72.482 41.613 112.348 1.00 10.31 ? 595 GLU D CB 1 +ATOM 14714 C CG . GLU C 1 575 ? 72.616 41.264 113.780 1.00 14.28 ? 595 GLU D CG 1 +ATOM 14715 C CD . GLU C 1 575 ? 74.022 41.443 114.323 1.00 19.04 ? 595 GLU D CD 1 +ATOM 14716 O OE1 . GLU C 1 575 ? 74.988 41.526 113.537 1.00 22.43 ? 595 GLU D OE1 1 +ATOM 14717 O OE2 . GLU C 1 575 ? 74.162 41.481 115.565 1.00 24.05 ? 595 GLU D OE2 1 +ATOM 14718 N N . GLN C 1 576 ? 73.826 43.553 110.285 1.00 8.78 ? 596 GLN D N 1 +ATOM 14719 C CA . GLN C 1 576 ? 74.231 43.694 108.913 1.00 8.92 ? 596 GLN D CA 1 +ATOM 14720 C C . GLN C 1 576 ? 73.829 42.455 108.111 1.00 9.81 ? 596 GLN D C 1 +ATOM 14721 O O . GLN C 1 576 ? 74.016 41.328 108.560 1.00 10.21 ? 596 GLN D O 1 +ATOM 14722 C CB . GLN C 1 576 ? 75.758 43.873 108.849 1.00 8.55 ? 596 GLN D CB 1 +ATOM 14723 C CG . GLN C 1 576 ? 76.234 45.228 109.340 1.00 9.30 ? 596 GLN D CG 1 +ATOM 14724 C CD . GLN C 1 576 ? 77.731 45.350 109.271 1.00 9.39 ? 596 GLN D CD 1 +ATOM 14725 O OE1 . GLN C 1 576 ? 78.261 45.901 108.315 1.00 11.39 ? 596 GLN D OE1 1 +ATOM 14726 N NE2 . GLN C 1 576 ? 78.430 44.829 110.283 1.00 10.54 ? 596 GLN D NE2 1 +ATOM 14727 N N . SER C 1 577 ? 73.228 42.692 106.948 1.00 10.06 ? 597 SER D N 1 +ATOM 14728 C CA . SER C 1 577 ? 72.975 41.646 105.967 1.00 10.90 ? 597 SER D CA 1 +ATOM 14729 C C . SER C 1 577 ? 72.580 42.315 104.646 1.00 10.49 ? 597 SER D C 1 +ATOM 14730 O O . SER C 1 577 ? 72.223 43.495 104.646 1.00 10.22 ? 597 SER D O 1 +ATOM 14731 C CB . SER C 1 577 ? 71.896 40.689 106.444 1.00 11.12 ? 597 SER D CB 1 +ATOM 14732 O OG . SER C 1 577 ? 70.605 41.202 106.246 1.00 12.29 ? 597 SER D OG 1 +ATOM 14733 N N . PRO C 1 578 ? 72.661 41.583 103.521 1.00 10.09 ? 598 PRO D N 1 +ATOM 14734 C CA . PRO C 1 578 ? 72.331 42.190 102.212 1.00 9.88 ? 598 PRO D CA 1 +ATOM 14735 C C . PRO C 1 578 ? 70.873 42.695 102.008 1.00 9.36 ? 598 PRO D C 1 +ATOM 14736 O O . PRO C 1 578 ? 70.590 43.367 101.019 1.00 9.64 ? 598 PRO D O 1 +ATOM 14737 C CB . PRO C 1 578 ? 72.670 41.055 101.215 1.00 9.83 ? 598 PRO D CB 1 +ATOM 14738 C CG . PRO C 1 578 ? 73.657 40.188 101.946 1.00 10.19 ? 598 PRO D CG 1 +ATOM 14739 C CD . PRO C 1 578 ? 73.159 40.203 103.362 1.00 9.99 ? 598 PRO D CD 1 +ATOM 14740 N N . THR C 1 579 ? 69.966 42.371 102.921 1.00 8.84 ? 599 THR D N 1 +ATOM 14741 C CA . THR C 1 579 ? 68.574 42.806 102.819 1.00 8.88 ? 599 THR D CA 1 +ATOM 14742 C C . THR C 1 579 ? 68.262 43.896 103.833 1.00 9.07 ? 599 THR D C 1 +ATOM 14743 O O . THR C 1 579 ? 67.111 44.304 103.962 1.00 7.82 ? 599 THR D O 1 +ATOM 14744 C CB . THR C 1 579 ? 67.591 41.640 103.065 1.00 9.25 ? 599 THR D CB 1 +ATOM 14745 O OG1 . THR C 1 579 ? 67.671 41.241 104.437 1.00 12.17 ? 599 THR D OG1 1 +ATOM 14746 C CG2 . THR C 1 579 ? 67.911 40.456 102.166 1.00 9.70 ? 599 THR D CG2 1 +ATOM 14747 N N . ARG C 1 580 ? 69.274 44.340 104.573 1.00 8.28 ? 600 ARG D N 1 +ATOM 14748 C CA . ARG C 1 580 ? 69.062 45.372 105.569 1.00 9.44 ? 600 ARG D CA 1 +ATOM 14749 C C . ARG C 1 580 ? 69.990 46.553 105.314 1.00 9.71 ? 600 ARG D C 1 +ATOM 14750 O O . ARG C 1 580 ? 71.212 46.482 105.524 1.00 8.81 ? 600 ARG D O 1 +ATOM 14751 C CB . ARG C 1 580 ? 69.209 44.795 106.980 1.00 9.21 ? 600 ARG D CB 1 +ATOM 14752 C CG . ARG C 1 580 ? 68.089 43.815 107.343 1.00 10.00 ? 600 ARG D CG 1 +ATOM 14753 C CD . ARG C 1 580 ? 66.785 44.547 107.556 1.00 8.90 ? 600 ARG D CD 1 +ATOM 14754 N NE . ARG C 1 580 ? 65.614 43.715 107.870 1.00 8.76 ? 600 ARG D NE 1 +ATOM 14755 C CZ . ARG C 1 580 ? 64.731 43.266 106.978 1.00 10.10 ? 600 ARG D CZ 1 +ATOM 14756 N NH1 . ARG C 1 580 ? 64.894 43.476 105.683 1.00 10.18 ? 600 ARG D NH1 1 +ATOM 14757 N NH2 . ARG C 1 580 ? 63.670 42.572 107.383 1.00 10.61 ? 600 ARG D NH2 1 +ATOM 14758 N N . VAL C 1 581 ? 69.391 47.642 104.847 1.00 10.66 ? 601 VAL D N 1 +ATOM 14759 C CA . VAL C 1 581 ? 70.141 48.805 104.426 1.00 11.01 ? 601 VAL D CA 1 +ATOM 14760 C C . VAL C 1 581 ? 70.325 49.709 105.643 1.00 10.93 ? 601 VAL D C 1 +ATOM 14761 O O . VAL C 1 581 ? 69.489 50.552 105.915 1.00 9.95 ? 601 VAL D O 1 +ATOM 14762 C CB . VAL C 1 581 ? 69.388 49.541 103.295 1.00 11.68 ? 601 VAL D CB 1 +ATOM 14763 C CG1 . VAL C 1 581 ? 70.239 50.666 102.739 1.00 12.51 ? 601 VAL D CG1 1 +ATOM 14764 C CG2 . VAL C 1 581 ? 68.995 48.573 102.204 1.00 13.06 ? 601 VAL D CG2 1 +ATOM 14765 N N . LEU C 1 582 ? 71.408 49.494 106.396 1.00 10.76 ? 602 LEU D N 1 +ATOM 14766 C CA . LEU C 1 582 ? 71.594 50.100 107.724 1.00 11.25 ? 602 LEU D CA 1 +ATOM 14767 C C . LEU C 1 582 ? 70.364 49.908 108.637 1.00 10.95 ? 602 LEU D C 1 +ATOM 14768 O O . LEU C 1 582 ? 69.835 50.868 109.184 1.00 11.47 ? 602 LEU D O 1 +ATOM 14769 C CB . LEU C 1 582 ? 71.951 51.592 107.603 1.00 12.14 ? 602 LEU D CB 1 +ATOM 14770 C CG . LEU C 1 582 ? 73.425 51.975 107.536 1.00 13.22 ? 602 LEU D CG 1 +ATOM 14771 C CD1 . LEU C 1 582 ? 73.565 53.482 107.517 1.00 12.79 ? 602 LEU D CD1 1 +ATOM 14772 C CD2 . LEU C 1 582 ? 74.219 51.376 108.674 1.00 12.65 ? 602 LEU D CD2 1 +ATOM 14773 N N . GLY C 1 583 ? 69.919 48.660 108.796 1.00 9.42 ? 603 GLY D N 1 +ATOM 14774 C CA . GLY C 1 583 ? 68.760 48.342 109.630 1.00 8.73 ? 603 GLY D CA 1 +ATOM 14775 C C . GLY C 1 583 ? 67.497 48.153 108.817 1.00 8.64 ? 603 GLY D C 1 +ATOM 14776 O O . GLY C 1 583 ? 67.537 47.966 107.595 1.00 8.05 ? 603 GLY D O 1 +ATOM 14777 N N . ASN C 1 584 ? 66.375 48.171 109.522 1.00 7.65 ? 604 ASN D N 1 +ATOM 14778 C CA . ASN C 1 584 ? 65.070 47.912 108.955 1.00 8.39 ? 604 ASN D CA 1 +ATOM 14779 C C . ASN C 1 584 ? 64.474 49.271 108.643 1.00 8.05 ? 604 ASN D C 1 +ATOM 14780 O O . ASN C 1 584 ? 64.352 50.098 109.537 1.00 7.96 ? 604 ASN D O 1 +ATOM 14781 C CB . ASN C 1 584 ? 64.237 47.144 109.987 1.00 8.26 ? 604 ASN D CB 1 +ATOM 14782 C CG . ASN C 1 584 ? 62.844 46.802 109.505 1.00 8.72 ? 604 ASN D CG 1 +ATOM 14783 O OD1 . ASN C 1 584 ? 62.067 47.690 109.138 1.00 10.17 ? 604 ASN D OD1 1 +ATOM 14784 N ND2 . ASN C 1 584 ? 62.508 45.509 109.521 1.00 9.29 ? 604 ASN D ND2 1 +ATOM 14785 N N . LYS C 1 585 ? 64.099 49.472 107.378 1.00 7.94 ? 605 LYS D N 1 +ATOM 14786 C CA . LYS C 1 585 ? 63.613 50.764 106.877 1.00 7.47 ? 605 LYS D CA 1 +ATOM 14787 C C . LYS C 1 585 ? 62.108 50.762 106.579 1.00 7.92 ? 605 LYS D C 1 +ATOM 14788 O O . LYS C 1 585 ? 61.637 51.587 105.788 1.00 7.50 ? 605 LYS D O 1 +ATOM 14789 C CB . LYS C 1 585 ? 64.418 51.169 105.625 1.00 7.82 ? 605 LYS D CB 1 +ATOM 14790 C CG . LYS C 1 585 ? 65.913 51.558 105.908 1.00 7.19 ? 605 LYS D CG 1 +ATOM 14791 C CD . LYS C 1 585 ? 66.049 53.012 106.376 1.00 8.73 ? 605 LYS D CD 1 +ATOM 14792 C CE . LYS C 1 585 ? 67.501 53.443 106.540 1.00 8.72 ? 605 LYS D CE 1 +ATOM 14793 N NZ . LYS C 1 585 ? 68.272 52.570 107.472 1.00 7.91 ? 605 LYS D NZ 1 +ATOM 14794 N N . LYS C 1 586 ? 61.354 49.882 107.241 1.00 7.41 ? 606 LYS D N 1 +ATOM 14795 C CA . LYS C 1 586 ? 59.905 49.803 107.018 1.00 7.31 ? 606 LYS D CA 1 +ATOM 14796 C C . LYS C 1 586 ? 59.151 50.832 107.844 1.00 7.71 ? 606 LYS D C 1 +ATOM 14797 O O . LYS C 1 586 ? 57.922 50.842 107.849 1.00 8.07 ? 606 LYS D O 1 +ATOM 14798 C CB . LYS C 1 586 ? 59.362 48.416 107.350 1.00 8.21 ? 606 LYS D CB 1 +ATOM 14799 C CG . LYS C 1 586 ? 59.925 47.311 106.499 1.00 8.04 ? 606 LYS D CG 1 +ATOM 14800 C CD . LYS C 1 586 ? 58.956 46.124 106.375 1.00 9.38 ? 606 LYS D CD 1 +ATOM 14801 C CE . LYS C 1 586 ? 59.551 44.978 105.570 1.00 10.09 ? 606 LYS D CE 1 +ATOM 14802 N NZ . LYS C 1 586 ? 60.728 44.354 106.226 1.00 10.59 ? 606 LYS D NZ 1 +ATOM 14803 N N . GLY C 1 587 ? 59.879 51.666 108.578 1.00 7.37 ? 607 GLY D N 1 +ATOM 14804 C CA . GLY C 1 587 ? 59.265 52.760 109.336 1.00 7.99 ? 607 GLY D CA 1 +ATOM 14805 C C . GLY C 1 587 ? 58.385 53.685 108.501 1.00 8.09 ? 607 GLY D C 1 +ATOM 14806 O O . GLY C 1 587 ? 58.675 53.953 107.326 1.00 7.82 ? 607 GLY D O 1 +ATOM 14807 N N . ILE C 1 588 ? 57.283 54.147 109.096 1.00 7.84 ? 608 ILE D N 1 +ATOM 14808 C CA . ILE C 1 588 ? 56.521 55.256 108.529 1.00 7.78 ? 608 ILE D CA 1 +ATOM 14809 C C . ILE C 1 588 ? 57.140 56.582 108.972 1.00 7.67 ? 608 ILE D C 1 +ATOM 14810 O O . ILE C 1 588 ? 56.901 57.616 108.353 1.00 8.29 ? 608 ILE D O 1 +ATOM 14811 C CB . ILE C 1 588 ? 55.001 55.237 108.882 1.00 8.15 ? 608 ILE D CB 1 +ATOM 14812 C CG1 . ILE C 1 588 ? 54.772 55.196 110.391 1.00 7.67 ? 608 ILE D CG1 1 +ATOM 14813 C CG2 . ILE C 1 588 ? 54.313 54.095 108.160 1.00 9.16 ? 608 ILE D CG2 1 +ATOM 14814 C CD1 . ILE C 1 588 ? 53.291 55.424 110.785 1.00 9.03 ? 608 ILE D CD1 1 +ATOM 14815 N N . PHE C 1 589 ? 57.902 56.552 110.070 1.00 7.13 ? 609 PHE D N 1 +ATOM 14816 C CA . PHE C 1 589 ? 58.759 57.651 110.475 1.00 6.29 ? 609 PHE D CA 1 +ATOM 14817 C C . PHE C 1 589 ? 60.209 57.220 110.297 1.00 6.27 ? 609 PHE D C 1 +ATOM 14818 O O . PHE C 1 589 ? 60.541 56.025 110.382 1.00 6.91 ? 609 PHE D O 1 +ATOM 14819 C CB . PHE C 1 589 ? 58.529 58.039 111.952 1.00 6.78 ? 609 PHE D CB 1 +ATOM 14820 C CG . PHE C 1 589 ? 57.115 58.513 112.264 1.00 6.01 ? 609 PHE D CG 1 +ATOM 14821 C CD1 . PHE C 1 589 ? 56.188 57.661 112.825 1.00 6.83 ? 609 PHE D CD1 1 +ATOM 14822 C CD2 . PHE C 1 589 ? 56.731 59.832 112.017 1.00 7.27 ? 609 PHE D CD2 1 +ATOM 14823 C CE1 . PHE C 1 589 ? 54.885 58.093 113.121 1.00 6.35 ? 609 PHE D CE1 1 +ATOM 14824 C CE2 . PHE C 1 589 ? 55.446 60.277 112.313 1.00 7.89 ? 609 PHE D CE2 1 +ATOM 14825 C CZ . PHE C 1 589 ? 54.521 59.423 112.847 1.00 7.40 ? 609 PHE D CZ 1 +ATOM 14826 N N . THR C 1 590 ? 61.064 58.179 110.011 1.00 5.11 ? 610 THR D N 1 +ATOM 14827 C CA . THR C 1 590 ? 62.515 57.951 110.064 1.00 5.17 ? 610 THR D CA 1 +ATOM 14828 C C . THR C 1 590 ? 62.955 57.690 111.489 1.00 4.67 ? 610 THR D C 1 +ATOM 14829 O O . THR C 1 590 ? 62.194 57.927 112.439 1.00 4.76 ? 610 THR D O 1 +ATOM 14830 C CB . THR C 1 590 ? 63.273 59.191 109.606 1.00 5.31 ? 610 THR D CB 1 +ATOM 14831 O OG1 . THR C 1 590 ? 63.049 60.255 110.542 1.00 7.16 ? 610 THR D OG1 1 +ATOM 14832 C CG2 . THR C 1 590 ? 62.812 59.606 108.193 1.00 6.29 ? 610 THR D CG2 1 +ATOM 14833 N N . ARG C 1 591 ? 64.186 57.204 111.655 1.00 4.90 ? 611 ARG D N 1 +ATOM 14834 C CA . ARG C 1 591 ? 64.714 56.929 112.989 1.00 5.50 ? 611 ARG D CA 1 +ATOM 14835 C C . ARG C 1 591 ? 64.780 58.222 113.838 1.00 5.83 ? 611 ARG D C 1 +ATOM 14836 O O . ARG C 1 591 ? 64.798 58.167 115.056 1.00 5.25 ? 611 ARG D O 1 +ATOM 14837 C CB . ARG C 1 591 ? 66.096 56.279 112.887 1.00 5.29 ? 611 ARG D CB 1 +ATOM 14838 C CG . ARG C 1 591 ? 66.548 55.553 114.145 1.00 6.05 ? 611 ARG D CG 1 +ATOM 14839 C CD . ARG C 1 591 ? 67.870 54.838 113.916 1.00 6.72 ? 611 ARG D CD 1 +ATOM 14840 N NE . ARG C 1 591 ? 68.209 53.887 114.983 1.00 8.22 ? 611 ARG D NE 1 +ATOM 14841 C CZ . ARG C 1 591 ? 69.452 53.570 115.361 1.00 8.06 ? 611 ARG D CZ 1 +ATOM 14842 N NH1 . ARG C 1 591 ? 70.513 54.144 114.820 1.00 6.13 ? 611 ARG D NH1 1 +ATOM 14843 N NH2 . ARG C 1 591 ? 69.636 52.661 116.309 1.00 6.75 ? 611 ARG D NH2 1 +ATOM 14844 N N . GLN C 1 592 ? 64.803 59.375 113.173 1.00 6.30 ? 612 GLN D N 1 +ATOM 14845 C CA . GLN C 1 592 ? 64.843 60.683 113.825 1.00 6.85 ? 612 GLN D CA 1 +ATOM 14846 C C . GLN C 1 592 ? 63.451 61.289 114.011 1.00 7.40 ? 612 GLN D C 1 +ATOM 14847 O O . GLN C 1 592 ? 63.311 62.509 114.239 1.00 8.35 ? 612 GLN D O 1 +ATOM 14848 C CB . GLN C 1 592 ? 65.707 61.638 113.005 1.00 7.23 ? 612 GLN D CB 1 +ATOM 14849 C CG . GLN C 1 592 ? 67.161 61.184 112.787 1.00 7.60 ? 612 GLN D CG 1 +ATOM 14850 C CD . GLN C 1 592 ? 67.323 60.135 111.726 1.00 7.84 ? 612 GLN D CD 1 +ATOM 14851 O OE1 . GLN C 1 592 ? 66.685 60.177 110.672 1.00 10.91 ? 612 GLN D OE1 1 +ATOM 14852 N NE2 . GLN C 1 592 ? 68.198 59.168 111.994 1.00 7.86 ? 612 GLN D NE2 1 +ATOM 14853 N N . ARG C 1 593 ? 62.430 60.448 113.900 1.00 7.75 ? 613 ARG D N 1 +ATOM 14854 C CA . ARG C 1 593 ? 61.034 60.824 114.220 1.00 8.27 ? 613 ARG D CA 1 +ATOM 14855 C C . ARG C 1 593 ? 60.426 61.908 113.312 1.00 8.44 ? 613 ARG D C 1 +ATOM 14856 O O . ARG C 1 593 ? 59.628 62.732 113.771 1.00 9.32 ? 613 ARG D O 1 +ATOM 14857 C CB . ARG C 1 593 ? 60.907 61.195 115.701 1.00 8.17 ? 613 ARG D CB 1 +ATOM 14858 C CG . ARG C 1 593 ? 60.608 60.004 116.620 1.00 8.53 ? 613 ARG D CG 1 +ATOM 14859 C CD . ARG C 1 593 ? 61.671 58.903 116.526 1.00 10.39 ? 613 ARG D CD 1 +ATOM 14860 N NE . ARG C 1 593 ? 61.445 57.879 117.541 1.00 11.03 ? 613 ARG D NE 1 +ATOM 14861 C CZ . ARG C 1 593 ? 62.082 56.714 117.612 1.00 14.93 ? 613 ARG D CZ 1 +ATOM 14862 N NH1 . ARG C 1 593 ? 63.030 56.386 116.739 1.00 14.46 ? 613 ARG D NH1 1 +ATOM 14863 N NH2 . ARG C 1 593 ? 61.772 55.865 118.583 1.00 15.67 ? 613 ARG D NH2 1 +ATOM 14864 N N . GLN C 1 594 ? 60.754 61.851 112.023 1.00 8.59 ? 614 GLN D N 1 +ATOM 14865 C CA . GLN C 1 594 ? 60.029 62.613 110.996 1.00 8.68 ? 614 GLN D CA 1 +ATOM 14866 C C . GLN C 1 594 ? 59.274 61.733 109.998 1.00 8.56 ? 614 GLN D C 1 +ATOM 14867 O O . GLN C 1 594 ? 59.697 60.592 109.687 1.00 8.97 ? 614 GLN D O 1 +ATOM 14868 C CB . GLN C 1 594 ? 60.991 63.565 110.273 1.00 8.70 ? 614 GLN D CB 1 +ATOM 14869 C CG . GLN C 1 594 ? 61.687 64.539 111.210 1.00 9.11 ? 614 GLN D CG 1 +ATOM 14870 C CD . GLN C 1 594 ? 60.741 65.464 111.966 1.00 9.82 ? 614 GLN D CD 1 +ATOM 14871 O OE1 . GLN C 1 594 ? 59.597 65.674 111.563 1.00 9.53 ? 614 GLN D OE1 1 +ATOM 14872 N NE2 . GLN C 1 594 ? 61.227 66.044 113.059 1.00 10.56 ? 614 GLN D NE2 1 +ATOM 14873 N N . PRO C 1 595 ? 58.111 62.226 109.519 1.00 8.58 ? 615 PRO D N 1 +ATOM 14874 C CA . PRO C 1 595 ? 57.268 61.366 108.722 1.00 8.81 ? 615 PRO D CA 1 +ATOM 14875 C C . PRO C 1 595 ? 57.730 61.236 107.290 1.00 8.48 ? 615 PRO D C 1 +ATOM 14876 O O . PRO C 1 595 ? 58.059 62.239 106.629 1.00 9.22 ? 615 PRO D O 1 +ATOM 14877 C CB . PRO C 1 595 ? 55.903 62.066 108.774 1.00 8.63 ? 615 PRO D CB 1 +ATOM 14878 C CG . PRO C 1 595 ? 56.226 63.470 108.868 1.00 8.16 ? 615 PRO D CG 1 +ATOM 14879 C CD . PRO C 1 595 ? 57.502 63.557 109.684 1.00 8.75 ? 615 PRO D CD 1 +ATOM 14880 N N . LYS C 1 596 ? 57.757 60.007 106.809 1.00 8.22 ? 616 LYS D N 1 +ATOM 14881 C CA . LYS C 1 596 ? 57.871 59.780 105.390 1.00 8.06 ? 616 LYS D CA 1 +ATOM 14882 C C . LYS C 1 596 ? 56.485 60.092 104.837 1.00 8.77 ? 616 LYS D C 1 +ATOM 14883 O O . LYS C 1 596 ? 55.526 60.271 105.589 1.00 8.73 ? 616 LYS D O 1 +ATOM 14884 C CB . LYS C 1 596 ? 58.278 58.332 105.085 1.00 7.61 ? 616 LYS D CB 1 +ATOM 14885 C CG . LYS C 1 596 ? 59.545 57.852 105.808 1.00 7.56 ? 616 LYS D CG 1 +ATOM 14886 C CD . LYS C 1 596 ? 59.892 56.394 105.484 1.00 7.00 ? 616 LYS D CD 1 +ATOM 14887 C CE . LYS C 1 596 ? 60.994 55.919 106.414 1.00 7.26 ? 616 LYS D CE 1 +ATOM 14888 N NZ . LYS C 1 596 ? 61.245 54.440 106.349 1.00 5.45 ? 616 LYS D NZ 1 +ATOM 14889 N N . SER C 1 597 ? 56.356 60.109 103.527 1.00 8.90 ? 617 SER D N 1 +ATOM 14890 C CA . SER C 1 597 ? 55.065 60.432 102.919 1.00 10.20 ? 617 SER D CA 1 +ATOM 14891 C C . SER C 1 597 ? 53.924 59.478 103.315 1.00 9.49 ? 617 SER D C 1 +ATOM 14892 O O . SER C 1 597 ? 52.784 59.923 103.509 1.00 9.75 ? 617 SER D O 1 +ATOM 14893 C CB . SER C 1 597 ? 55.227 60.497 101.406 1.00 10.28 ? 617 SER D CB 1 +ATOM 14894 O OG . SER C 1 597 ? 55.969 61.660 101.057 1.00 13.65 ? 617 SER D OG 1 +ATOM 14895 N N . ALA C 1 598 ? 54.227 58.179 103.444 1.00 8.62 ? 618 ALA D N 1 +ATOM 14896 C CA . ALA C 1 598 ? 53.246 57.160 103.895 1.00 8.59 ? 618 ALA D CA 1 +ATOM 14897 C C . ALA C 1 598 ? 52.633 57.446 105.265 1.00 8.24 ? 618 ALA D C 1 +ATOM 14898 O O . ALA C 1 598 ? 51.491 57.055 105.539 1.00 7.72 ? 618 ALA D O 1 +ATOM 14899 C CB . ALA C 1 598 ? 53.898 55.756 103.913 1.00 8.32 ? 618 ALA D CB 1 +ATOM 14900 N N . ALA C 1 599 ? 53.379 58.115 106.138 1.00 7.90 ? 619 ALA D N 1 +ATOM 14901 C CA . ALA C 1 599 ? 52.869 58.458 107.462 1.00 8.68 ? 619 ALA D CA 1 +ATOM 14902 C C . ALA C 1 599 ? 51.546 59.239 107.355 1.00 9.15 ? 619 ALA D C 1 +ATOM 14903 O O . ALA C 1 599 ? 50.604 59.003 108.110 1.00 9.34 ? 619 ALA D O 1 +ATOM 14904 C CB . ALA C 1 599 ? 53.900 59.282 108.235 1.00 8.59 ? 619 ALA D CB 1 +ATOM 14905 N N . PHE C 1 600 ? 51.489 60.175 106.408 1.00 9.74 ? 620 PHE D N 1 +ATOM 14906 C CA . PHE C 1 600 ? 50.305 61.021 106.212 1.00 9.70 ? 620 PHE D CA 1 +ATOM 14907 C C . PHE C 1 600 ? 49.123 60.216 105.671 1.00 9.99 ? 620 PHE D C 1 +ATOM 14908 O O . PHE C 1 600 ? 47.972 60.465 106.044 1.00 10.22 ? 620 PHE D O 1 +ATOM 14909 C CB . PHE C 1 600 ? 50.645 62.180 105.280 1.00 10.24 ? 620 PHE D CB 1 +ATOM 14910 C CG . PHE C 1 600 ? 51.672 63.126 105.849 1.00 9.51 ? 620 PHE D CG 1 +ATOM 14911 C CD1 . PHE C 1 600 ? 53.022 62.935 105.611 1.00 9.56 ? 620 PHE D CD1 1 +ATOM 14912 C CD2 . PHE C 1 600 ? 51.283 64.191 106.648 1.00 11.94 ? 620 PHE D CD2 1 +ATOM 14913 C CE1 . PHE C 1 600 ? 53.971 63.806 106.136 1.00 9.65 ? 620 PHE D CE1 1 +ATOM 14914 C CE2 . PHE C 1 600 ? 52.225 65.073 107.175 1.00 10.14 ? 620 PHE D CE2 1 +ATOM 14915 C CZ . PHE C 1 600 ? 53.569 64.877 106.927 1.00 10.56 ? 620 PHE D CZ 1 +ATOM 14916 N N . LEU C 1 601 ? 49.411 59.257 104.797 1.00 9.81 ? 621 LEU D N 1 +ATOM 14917 C CA . LEU C 1 601 ? 48.401 58.337 104.256 1.00 10.09 ? 621 LEU D CA 1 +ATOM 14918 C C . LEU C 1 601 ? 47.731 57.539 105.382 1.00 9.58 ? 621 LEU D C 1 +ATOM 14919 O O . LEU C 1 601 ? 46.498 57.500 105.491 1.00 9.84 ? 621 LEU D O 1 +ATOM 14920 C CB . LEU C 1 601 ? 49.046 57.397 103.233 1.00 10.08 ? 621 LEU D CB 1 +ATOM 14921 C CG . LEU C 1 601 ? 48.161 56.439 102.454 1.00 11.95 ? 621 LEU D CG 1 +ATOM 14922 C CD1 . LEU C 1 601 ? 48.885 55.999 101.175 1.00 14.22 ? 621 LEU D CD1 1 +ATOM 14923 C CD2 . LEU C 1 601 ? 47.797 55.265 103.292 1.00 12.25 ? 621 LEU D CD2 1 +ATOM 14924 N N . LEU C 1 602 ? 48.556 56.923 106.232 1.00 9.52 ? 622 LEU D N 1 +ATOM 14925 C CA . LEU C 1 602 ? 48.052 56.124 107.348 1.00 9.51 ? 622 LEU D CA 1 +ATOM 14926 C C . LEU C 1 602 ? 47.296 56.990 108.340 1.00 9.32 ? 622 LEU D C 1 +ATOM 14927 O O . LEU C 1 602 ? 46.252 56.599 108.848 1.00 8.93 ? 622 LEU D O 1 +ATOM 14928 C CB . LEU C 1 602 ? 49.196 55.415 108.079 1.00 9.35 ? 622 LEU D CB 1 +ATOM 14929 C CG . LEU C 1 602 ? 48.747 54.240 108.949 1.00 10.21 ? 622 LEU D CG 1 +ATOM 14930 C CD1 . LEU C 1 602 ? 48.238 53.084 108.100 1.00 10.62 ? 622 LEU D CD1 1 +ATOM 14931 C CD2 . LEU C 1 602 ? 49.926 53.801 109.817 1.00 10.13 ? 622 LEU D CD2 1 +ATOM 14932 N N . ARG C 1 603 ? 47.827 58.177 108.608 1.00 9.69 ? 623 ARG D N 1 +ATOM 14933 C CA . ARG C 1 603 ? 47.172 59.127 109.514 1.00 9.85 ? 623 ARG D CA 1 +ATOM 14934 C C . ARG C 1 603 ? 45.729 59.412 109.070 1.00 10.16 ? 623 ARG D C 1 +ATOM 14935 O O . ARG C 1 603 ? 44.802 59.384 109.874 1.00 9.84 ? 623 ARG D O 1 +ATOM 14936 C CB . ARG C 1 603 ? 47.987 60.426 109.582 1.00 10.05 ? 623 ARG D CB 1 +ATOM 14937 C CG . ARG C 1 603 ? 47.376 61.526 110.410 1.00 11.27 ? 623 ARG D CG 1 +ATOM 14938 C CD . ARG C 1 603 ? 48.385 62.628 110.649 1.00 13.01 ? 623 ARG D CD 1 +ATOM 14939 N NE . ARG C 1 603 ? 47.826 63.805 111.312 1.00 12.35 ? 623 ARG D NE 1 +ATOM 14940 C CZ . ARG C 1 603 ? 47.475 64.927 110.698 1.00 15.51 ? 623 ARG D CZ 1 +ATOM 14941 N NH1 . ARG C 1 603 ? 47.596 65.055 109.381 1.00 17.70 ? 623 ARG D NH1 1 +ATOM 14942 N NH2 . ARG C 1 603 ? 46.993 65.938 111.413 1.00 16.37 ? 623 ARG D NH2 1 +ATOM 14943 N N . GLU C 1 604 ? 45.557 59.693 107.784 1.00 10.57 ? 624 GLU D N 1 +ATOM 14944 C CA . GLU C 1 604 ? 44.228 59.938 107.204 1.00 11.47 ? 624 GLU D CA 1 +ATOM 14945 C C . GLU C 1 604 ? 43.296 58.764 107.467 1.00 11.08 ? 624 GLU D C 1 +ATOM 14946 O O . GLU C 1 604 ? 42.142 58.952 107.848 1.00 11.84 ? 624 GLU D O 1 +ATOM 14947 C CB . GLU C 1 604 ? 44.341 60.167 105.695 1.00 12.01 ? 624 GLU D CB 1 +ATOM 14948 C CG . GLU C 1 604 ? 44.792 61.582 105.301 1.00 16.07 ? 624 GLU D CG 1 +ATOM 14949 C CD . GLU C 1 604 ? 43.730 62.638 105.555 1.00 20.82 ? 624 GLU D CD 1 +ATOM 14950 O OE1 . GLU C 1 604 ? 42.517 62.335 105.446 1.00 25.57 ? 624 GLU D OE1 1 +ATOM 14951 O OE2 . GLU C 1 604 ? 44.116 63.784 105.875 1.00 25.93 ? 624 GLU D OE2 1 +ATOM 14952 N N . ARG C 1 605 ? 43.816 57.559 107.263 1.00 10.19 ? 625 ARG D N 1 +ATOM 14953 C CA . ARG C 1 605 ? 43.044 56.338 107.465 1.00 10.11 ? 625 ARG D CA 1 +ATOM 14954 C C . ARG C 1 605 ? 42.608 56.205 108.916 1.00 10.07 ? 625 ARG D C 1 +ATOM 14955 O O . ARG C 1 605 ? 41.444 55.898 109.200 1.00 9.03 ? 625 ARG D O 1 +ATOM 14956 C CB . ARG C 1 605 ? 43.858 55.110 107.056 1.00 10.71 ? 625 ARG D CB 1 +ATOM 14957 C CG . ARG C 1 605 ? 43.147 53.798 107.313 1.00 9.35 ? 625 ARG D CG 1 +ATOM 14958 C CD . ARG C 1 605 ? 43.841 52.654 106.609 1.00 9.72 ? 625 ARG D CD 1 +ATOM 14959 N NE . ARG C 1 605 ? 43.301 51.336 106.955 1.00 9.29 ? 625 ARG D NE 1 +ATOM 14960 C CZ . ARG C 1 605 ? 42.140 50.854 106.507 1.00 9.85 ? 625 ARG D CZ 1 +ATOM 14961 N NH1 . ARG C 1 605 ? 41.393 51.577 105.689 1.00 11.74 ? 625 ARG D NH1 1 +ATOM 14962 N NH2 . ARG C 1 605 ? 41.744 49.633 106.854 1.00 9.83 ? 625 ARG D NH2 1 +ATOM 14963 N N . TYR C 1 606 ? 43.547 56.422 109.835 1.00 9.26 ? 626 TYR D N 1 +ATOM 14964 C CA . TYR C 1 606 ? 43.268 56.232 111.243 1.00 9.30 ? 626 TYR D CA 1 +ATOM 14965 C C . TYR C 1 606 ? 42.235 57.233 111.774 1.00 9.99 ? 626 TYR D C 1 +ATOM 14966 O O . TYR C 1 606 ? 41.313 56.858 112.506 1.00 10.22 ? 626 TYR D O 1 +ATOM 14967 C CB . TYR C 1 606 ? 44.573 56.232 112.053 1.00 9.64 ? 626 TYR D CB 1 +ATOM 14968 C CG . TYR C 1 606 ? 45.413 54.944 111.897 1.00 9.47 ? 626 TYR D CG 1 +ATOM 14969 C CD1 . TYR C 1 606 ? 44.989 53.867 111.114 1.00 9.50 ? 626 TYR D CD1 1 +ATOM 14970 C CD2 . TYR C 1 606 ? 46.615 54.801 112.596 1.00 11.10 ? 626 TYR D CD2 1 +ATOM 14971 C CE1 . TYR C 1 606 ? 45.778 52.683 111.005 1.00 9.73 ? 626 TYR D CE1 1 +ATOM 14972 C CE2 . TYR C 1 606 ? 47.387 53.668 112.487 1.00 10.12 ? 626 TYR D CE2 1 +ATOM 14973 C CZ . TYR C 1 606 ? 46.971 52.609 111.712 1.00 11.17 ? 626 TYR D CZ 1 +ATOM 14974 O OH . TYR C 1 606 ? 47.768 51.490 111.659 1.00 9.82 ? 626 TYR D OH 1 +ATOM 14975 N N . TRP C 1 607 ? 42.353 58.499 111.392 1.00 10.35 ? 627 TRP D N 1 +ATOM 14976 C CA . TRP C 1 607 ? 41.321 59.471 111.763 1.00 11.08 ? 627 TRP D CA 1 +ATOM 14977 C C . TRP C 1 607 ? 39.970 59.182 111.096 1.00 12.13 ? 627 TRP D C 1 +ATOM 14978 O O . TRP C 1 607 ? 38.923 59.381 111.716 1.00 11.94 ? 627 TRP D O 1 +ATOM 14979 C CB . TRP C 1 607 ? 41.798 60.895 111.498 1.00 11.71 ? 627 TRP D CB 1 +ATOM 14980 C CG . TRP C 1 607 ? 42.825 61.300 112.489 1.00 11.68 ? 627 TRP D CG 1 +ATOM 14981 C CD1 . TRP C 1 607 ? 44.184 61.186 112.357 1.00 11.44 ? 627 TRP D CD1 1 +ATOM 14982 C CD2 . TRP C 1 607 ? 42.592 61.832 113.799 1.00 11.93 ? 627 TRP D CD2 1 +ATOM 14983 N NE1 . TRP C 1 607 ? 44.805 61.620 113.497 1.00 12.43 ? 627 TRP D NE1 1 +ATOM 14984 C CE2 . TRP C 1 607 ? 43.853 62.033 114.397 1.00 11.91 ? 627 TRP D CE2 1 +ATOM 14985 C CE3 . TRP C 1 607 ? 41.440 62.164 114.524 1.00 12.10 ? 627 TRP D CE3 1 +ATOM 14986 C CZ2 . TRP C 1 607 ? 43.998 62.564 115.676 1.00 12.32 ? 627 TRP D CZ2 1 +ATOM 14987 C CZ3 . TRP C 1 607 ? 41.583 62.688 115.802 1.00 11.62 ? 627 TRP D CZ3 1 +ATOM 14988 C CH2 . TRP C 1 607 ? 42.853 62.882 116.366 1.00 11.91 ? 627 TRP D CH2 1 +ATOM 14989 N N . LYS C 1 608 ? 39.975 58.688 109.866 1.00 12.53 ? 628 LYS D N 1 +ATOM 14990 C CA . LYS C 1 608 ? 38.723 58.306 109.198 1.00 14.06 ? 628 LYS D CA 1 +ATOM 14991 C C . LYS C 1 608 ? 38.038 57.141 109.923 1.00 13.66 ? 628 LYS D C 1 +ATOM 14992 O O . LYS C 1 608 ? 36.830 57.180 110.156 1.00 13.52 ? 628 LYS D O 1 +ATOM 14993 C CB . LYS C 1 608 ? 38.984 57.941 107.736 1.00 14.45 ? 628 LYS D CB 1 +ATOM 14994 C CG . LYS C 1 608 ? 37.782 57.356 106.992 1.00 16.37 ? 628 LYS D CG 1 +ATOM 14995 C CD . LYS C 1 608 ? 38.160 56.841 105.613 1.00 17.34 ? 628 LYS D CD 1 +ATOM 14996 C CE . LYS C 1 608 ? 39.060 55.605 105.665 1.00 20.34 ? 628 LYS D CE 1 +ATOM 14997 N NZ . LYS C 1 608 ? 39.849 55.462 104.407 1.00 22.09 ? 628 LYS D NZ 1 +ATOM 14998 N N . ILE C 1 609 ? 38.806 56.108 110.275 1.00 13.76 ? 629 ILE D N 1 +ATOM 14999 C CA . ILE C 1 609 ? 38.256 54.946 110.995 1.00 13.97 ? 629 ILE D CA 1 +ATOM 15000 C C . ILE C 1 609 ? 37.744 55.354 112.374 1.00 14.92 ? 629 ILE D C 1 +ATOM 15001 O O . ILE C 1 609 ? 36.638 54.976 112.788 1.00 15.42 ? 629 ILE D O 1 +ATOM 15002 C CB . ILE C 1 609 ? 39.314 53.833 111.152 1.00 14.14 ? 629 ILE D CB 1 +ATOM 15003 C CG1 . ILE C 1 609 ? 39.567 53.167 109.799 1.00 13.07 ? 629 ILE D CG1 1 +ATOM 15004 C CG2 . ILE C 1 609 ? 38.863 52.803 112.193 1.00 13.21 ? 629 ILE D CG2 1 +ATOM 15005 C CD1 . ILE C 1 609 ? 40.639 52.092 109.828 1.00 14.70 ? 629 ILE D CD1 1 +ATOM 15006 N N . ALA C 1 610 ? 38.542 56.148 113.075 1.00 15.47 ? 630 ALA D N 1 +ATOM 15007 C CA . ALA C 1 610 ? 38.169 56.633 114.392 1.00 16.87 ? 630 ALA D CA 1 +ATOM 15008 C C . ALA C 1 610 ? 36.874 57.437 114.363 1.00 18.10 ? 630 ALA D C 1 +ATOM 15009 O O . ALA C 1 610 ? 36.089 57.359 115.313 1.00 18.45 ? 630 ALA D O 1 +ATOM 15010 C CB . ALA C 1 610 ? 39.278 57.468 114.980 1.00 16.72 ? 630 ALA D CB 1 +ATOM 15011 N N . ASN C 1 611 ? 36.669 58.208 113.290 1.00 20.04 ? 631 ASN D N 1 +ATOM 15012 C CA . ASN C 1 611 ? 35.480 59.063 113.137 1.00 22.00 ? 631 ASN D CA 1 +ATOM 15013 C C . ASN C 1 611 ? 34.225 58.297 112.715 1.00 23.23 ? 631 ASN D C 1 +ATOM 15014 O O . ASN C 1 611 ? 33.123 58.843 112.799 1.00 23.31 ? 631 ASN D O 1 +ATOM 15015 C CB . ASN C 1 611 ? 35.726 60.185 112.116 1.00 22.29 ? 631 ASN D CB 1 +ATOM 15016 C CG . ASN C 1 611 ? 36.811 61.177 112.550 1.00 24.54 ? 631 ASN D CG 1 +ATOM 15017 O OD1 . ASN C 1 611 ? 37.351 61.102 113.657 1.00 28.37 ? 631 ASN D OD1 1 +ATOM 15018 N ND2 . ASN C 1 611 ? 37.143 62.111 111.656 1.00 27.11 ? 631 ASN D ND2 1 +ATOM 15019 N N . GLU C 1 612 ? 34.372 57.048 112.262 1.00 24.70 ? 632 GLU D N 1 +ATOM 15020 C CA . GLU C 1 612 ? 33.202 56.196 111.976 1.00 26.19 ? 632 GLU D CA 1 +ATOM 15021 C C . GLU C 1 612 ? 32.373 56.002 113.248 1.00 27.75 ? 632 GLU D C 1 +ATOM 15022 O O . GLU C 1 612 ? 31.205 55.602 113.181 1.00 28.32 ? 632 GLU D O 1 +ATOM 15023 C CB . GLU C 1 612 ? 33.626 54.849 111.387 1.00 26.18 ? 632 GLU D CB 1 +ATOM 15024 C CG . GLU C 1 612 ? 34.294 54.990 110.025 1.00 25.80 ? 632 GLU D CG 1 +ATOM 15025 C CD . GLU C 1 612 ? 34.745 53.676 109.427 1.00 26.13 ? 632 GLU D CD 1 +ATOM 15026 O OE1 . GLU C 1 612 ? 34.726 52.645 110.133 1.00 26.86 ? 632 GLU D OE1 1 +ATOM 15027 O OE2 . GLU C 1 612 ? 35.127 53.683 108.238 1.00 25.18 ? 632 GLU D OE2 1 +ATOM 15028 N N . THR C 1 613 ? 33.026 56.263 114.388 1.00 29.35 ? 633 THR D N 1 +ATOM 15029 C CA . THR C 1 613 ? 32.424 56.521 115.705 1.00 30.49 ? 633 THR D CA 1 +ATOM 15030 C C . THR C 1 613 ? 32.686 55.354 116.651 1.00 30.72 ? 633 THR D C 1 +ATOM 15031 O O . THR C 1 613 ? 33.838 54.942 116.832 1.00 31.75 ? 633 THR D O 1 +ATOM 15032 C CB . THR C 1 613 ? 30.909 56.859 115.662 1.00 30.65 ? 633 THR D CB 1 +ATOM 15033 O OG1 . THR C 1 613 ? 30.654 57.846 114.652 1.00 32.32 ? 633 THR D OG1 1 +ATOM 15034 C CG2 . THR C 1 613 ? 30.451 57.405 117.009 1.00 31.23 ? 633 THR D CG2 1 +ATOM 15035 N N . LEU D 1 3 ? 70.252 85.525 53.236 1.00 30.29 ? 23 LEU E N 1 +ATOM 15036 C CA . LEU D 1 3 ? 69.841 86.907 53.618 1.00 30.06 ? 23 LEU E CA 1 +ATOM 15037 C C . LEU D 1 3 ? 68.359 86.961 53.990 1.00 29.62 ? 23 LEU E C 1 +ATOM 15038 O O . LEU D 1 3 ? 67.493 86.722 53.144 1.00 30.08 ? 23 LEU E O 1 +ATOM 15039 C CB . LEU D 1 3 ? 70.123 87.877 52.471 1.00 30.10 ? 23 LEU E CB 1 +ATOM 15040 N N . GLN D 1 4 ? 68.085 87.287 55.254 1.00 28.86 ? 24 GLN E N 1 +ATOM 15041 C CA . GLN D 1 4 ? 66.722 87.361 55.798 1.00 28.07 ? 24 GLN E CA 1 +ATOM 15042 C C . GLN D 1 4 ? 65.976 86.041 55.571 1.00 26.83 ? 24 GLN E C 1 +ATOM 15043 O O . GLN D 1 4 ? 66.433 84.997 56.046 1.00 27.65 ? 24 GLN E O 1 +ATOM 15044 C CB . GLN D 1 4 ? 65.977 88.572 55.213 1.00 28.36 ? 24 GLN E CB 1 +ATOM 15045 C CG . GLN D 1 4 ? 64.894 89.127 56.140 1.00 29.11 ? 24 GLN E CG 1 +ATOM 15046 C CD . GLN D 1 4 ? 65.473 89.880 57.331 1.00 30.37 ? 24 GLN E CD 1 +ATOM 15047 O OE1 . GLN D 1 4 ? 66.666 90.187 57.367 1.00 31.78 ? 24 GLN E OE1 1 +ATOM 15048 N NE2 . GLN D 1 4 ? 64.626 90.188 58.307 1.00 31.20 ? 24 GLN E NE2 1 +ATOM 15049 N N . GLY D 1 5 ? 64.839 86.074 54.871 1.00 24.99 ? 25 GLY E N 1 +ATOM 15050 C CA . GLY D 1 5 ? 64.232 84.860 54.331 1.00 22.97 ? 25 GLY E CA 1 +ATOM 15051 C C . GLY D 1 5 ? 63.487 84.021 55.349 1.00 21.20 ? 25 GLY E C 1 +ATOM 15052 O O . GLY D 1 5 ? 63.226 84.461 56.464 1.00 20.58 ? 25 GLY E O 1 +ATOM 15053 N N . GLY D 1 6 ? 63.126 82.809 54.939 1.00 19.15 ? 26 GLY E N 1 +ATOM 15054 C CA . GLY D 1 6 ? 62.405 81.883 55.800 1.00 17.39 ? 26 GLY E CA 1 +ATOM 15055 C C . GLY D 1 6 ? 63.350 81.063 56.648 1.00 16.22 ? 26 GLY E C 1 +ATOM 15056 O O . GLY D 1 6 ? 64.574 81.229 56.573 1.00 14.77 ? 26 GLY E O 1 +ATOM 15057 N N . MET D 1 7 ? 62.761 80.191 57.462 1.00 15.11 ? 27 MET E N 1 +ATOM 15058 C CA . MET D 1 7 ? 63.502 79.290 58.354 1.00 15.09 ? 27 MET E CA 1 +ATOM 15059 C C . MET D 1 7 ? 62.600 78.091 58.685 1.00 14.31 ? 27 MET E C 1 +ATOM 15060 O O . MET D 1 7 ? 62.264 77.805 59.846 1.00 13.73 ? 27 MET E O 1 +ATOM 15061 C CB . MET D 1 7 ? 63.956 80.024 59.619 1.00 15.14 ? 27 MET E CB 1 +ATOM 15062 C CG . MET D 1 7 ? 65.008 79.290 60.442 1.00 16.87 ? 27 MET E CG 1 +ATOM 15063 S SD . MET D 1 7 ? 66.577 79.018 59.607 1.00 20.25 ? 27 MET E SD 1 +ATOM 15064 C CE . MET D 1 7 ? 67.167 80.706 59.426 1.00 19.07 ? 27 MET E CE 1 +ATOM 15065 N N . LEU D 1 8 ? 62.185 77.407 57.631 1.00 13.63 ? 28 LEU E N 1 +ATOM 15066 C CA . LEU D 1 8 ? 61.329 76.229 57.764 1.00 13.84 ? 28 LEU E CA 1 +ATOM 15067 C C . LEU D 1 8 ? 62.127 75.071 58.339 1.00 14.15 ? 28 LEU E C 1 +ATOM 15068 O O . LEU D 1 8 ? 63.274 74.865 57.940 1.00 13.38 ? 28 LEU E O 1 +ATOM 15069 C CB . LEU D 1 8 ? 60.764 75.836 56.405 1.00 13.61 ? 28 LEU E CB 1 +ATOM 15070 C CG . LEU D 1 8 ? 59.866 76.901 55.751 1.00 12.14 ? 28 LEU E CG 1 +ATOM 15071 C CD1 . LEU D 1 8 ? 59.657 76.585 54.269 1.00 10.98 ? 28 LEU E CD1 1 +ATOM 15072 C CD2 . LEU D 1 8 ? 58.526 76.999 56.486 1.00 12.93 ? 28 LEU E CD2 1 +ATOM 15073 N N . TYR D 1 9 ? 61.524 74.315 59.260 1.00 14.61 ? 29 TYR E N 1 +ATOM 15074 C CA . TYR D 1 9 ? 62.201 73.152 59.837 1.00 15.09 ? 29 TYR E CA 1 +ATOM 15075 C C . TYR D 1 9 ? 62.502 72.145 58.730 1.00 14.29 ? 29 TYR E C 1 +ATOM 15076 O O . TYR D 1 9 ? 61.587 71.715 58.024 1.00 13.92 ? 29 TYR E O 1 +ATOM 15077 C CB . TYR D 1 9 ? 61.352 72.479 60.926 1.00 16.21 ? 29 TYR E CB 1 +ATOM 15078 C CG . TYR D 1 9 ? 62.129 71.440 61.719 1.00 17.41 ? 29 TYR E CG 1 +ATOM 15079 C CD1 . TYR D 1 9 ? 63.184 71.823 62.546 1.00 19.37 ? 29 TYR E CD1 1 +ATOM 15080 C CD2 . TYR D 1 9 ? 61.823 70.075 61.626 1.00 19.58 ? 29 TYR E CD2 1 +ATOM 15081 C CE1 . TYR D 1 9 ? 63.910 70.884 63.271 1.00 19.14 ? 29 TYR E CE1 1 +ATOM 15082 C CE2 . TYR D 1 9 ? 62.547 69.120 62.355 1.00 19.41 ? 29 TYR E CE2 1 +ATOM 15083 C CZ . TYR D 1 9 ? 63.582 69.539 63.179 1.00 19.79 ? 29 TYR E CZ 1 +ATOM 15084 O OH . TYR D 1 9 ? 64.309 68.610 63.901 1.00 19.71 ? 29 TYR E OH 1 +ATOM 15085 N N . PRO D 1 10 ? 63.778 71.768 58.558 1.00 14.14 ? 30 PRO E N 1 +ATOM 15086 C CA . PRO D 1 10 ? 64.095 70.846 57.471 1.00 14.48 ? 30 PRO E CA 1 +ATOM 15087 C C . PRO D 1 10 ? 63.411 69.485 57.569 1.00 14.86 ? 30 PRO E C 1 +ATOM 15088 O O . PRO D 1 10 ? 63.232 68.957 58.661 1.00 16.09 ? 30 PRO E O 1 +ATOM 15089 C CB . PRO D 1 10 ? 65.630 70.698 57.561 1.00 14.60 ? 30 PRO E CB 1 +ATOM 15090 C CG . PRO D 1 10 ? 66.081 71.899 58.298 1.00 13.93 ? 30 PRO E CG 1 +ATOM 15091 C CD . PRO D 1 10 ? 64.992 72.176 59.287 1.00 14.52 ? 30 PRO E CD 1 +ATOM 15092 N N . GLN D 1 11 ? 63.045 68.936 56.417 1.00 15.18 ? 31 GLN E N 1 +ATOM 15093 C CA . GLN D 1 11 ? 62.391 67.634 56.329 1.00 15.55 ? 31 GLN E CA 1 +ATOM 15094 C C . GLN D 1 11 ? 62.768 66.963 55.019 1.00 15.83 ? 31 GLN E C 1 +ATOM 15095 O O . GLN D 1 11 ? 63.117 67.639 54.048 1.00 16.15 ? 31 GLN E O 1 +ATOM 15096 C CB . GLN D 1 11 ? 60.873 67.818 56.391 1.00 16.05 ? 31 GLN E CB 1 +ATOM 15097 C CG . GLN D 1 11 ? 60.330 68.801 55.357 1.00 16.05 ? 31 GLN E CG 1 +ATOM 15098 C CD . GLN D 1 11 ? 58.822 68.735 55.202 1.00 15.69 ? 31 GLN E CD 1 +ATOM 15099 O OE1 . GLN D 1 11 ? 58.306 68.448 54.114 1.00 14.01 ? 31 GLN E OE1 1 +ATOM 15100 N NE2 . GLN D 1 11 ? 58.105 68.986 56.295 1.00 17.71 ? 31 GLN E NE2 1 +ATOM 15101 N N . GLU D 1 12 ? 62.694 65.635 54.978 1.00 15.99 ? 32 GLU E N 1 +ATOM 15102 C CA . GLU D 1 12 ? 62.870 64.922 53.725 1.00 15.88 ? 32 GLU E CA 1 +ATOM 15103 C C . GLU D 1 12 ? 61.570 65.049 52.953 1.00 15.80 ? 32 GLU E C 1 +ATOM 15104 O O . GLU D 1 12 ? 60.497 65.149 53.549 1.00 16.10 ? 32 GLU E O 1 +ATOM 15105 C CB . GLU D 1 12 ? 63.185 63.434 53.941 1.00 16.31 ? 32 GLU E CB 1 +ATOM 15106 C CG . GLU D 1 12 ? 64.504 63.140 54.675 1.00 17.66 ? 32 GLU E CG 1 +ATOM 15107 C CD . GLU D 1 12 ? 64.351 63.088 56.185 1.00 20.81 ? 32 GLU E CD 1 +ATOM 15108 O OE1 . GLU D 1 12 ? 63.299 63.534 56.694 1.00 23.61 ? 32 GLU E OE1 1 +ATOM 15109 O OE2 . GLU D 1 12 ? 65.283 62.608 56.874 1.00 22.19 ? 32 GLU E OE2 1 +ATOM 15110 N N . SER D 1 13 ? 61.686 65.059 51.634 1.00 15.74 ? 33 SER E N 1 +ATOM 15111 C CA . SER D 1 13 ? 60.551 65.041 50.726 1.00 16.00 ? 33 SER E CA 1 +ATOM 15112 C C . SER D 1 13 ? 61.065 64.527 49.384 1.00 16.21 ? 33 SER E C 1 +ATOM 15113 O O . SER D 1 13 ? 62.263 64.243 49.249 1.00 15.97 ? 33 SER E O 1 +ATOM 15114 C CB . SER D 1 13 ? 59.976 66.448 50.577 1.00 15.80 ? 33 SER E CB 1 +ATOM 15115 O OG . SER D 1 13 ? 60.754 67.204 49.673 1.00 15.75 ? 33 SER E OG 1 +ATOM 15116 N N . PRO D 1 14 ? 60.173 64.372 48.389 1.00 16.32 ? 34 PRO E N 1 +ATOM 15117 C CA . PRO D 1 14 ? 60.659 63.976 47.072 1.00 16.40 ? 34 PRO E CA 1 +ATOM 15118 C C . PRO D 1 14 ? 61.771 64.855 46.498 1.00 16.42 ? 34 PRO E C 1 +ATOM 15119 O O . PRO D 1 14 ? 62.586 64.363 45.723 1.00 17.38 ? 34 PRO E O 1 +ATOM 15120 C CB . PRO D 1 14 ? 59.393 64.024 46.210 1.00 16.45 ? 34 PRO E CB 1 +ATOM 15121 C CG . PRO D 1 14 ? 58.303 63.721 47.160 1.00 17.13 ? 34 PRO E CG 1 +ATOM 15122 C CD . PRO D 1 14 ? 58.701 64.439 48.419 1.00 16.79 ? 34 PRO E CD 1 +ATOM 15123 N N . SER D 1 15 ? 61.833 66.121 46.906 1.00 15.35 ? 35 SER E N 1 +ATOM 15124 C CA . SER D 1 15 ? 62.825 67.065 46.386 1.00 14.69 ? 35 SER E CA 1 +ATOM 15125 C C . SER D 1 15 ? 63.927 67.417 47.388 1.00 14.45 ? 35 SER E C 1 +ATOM 15126 O O . SER D 1 15 ? 64.822 68.188 47.050 1.00 14.58 ? 35 SER E O 1 +ATOM 15127 C CB . SER D 1 15 ? 62.126 68.364 46.000 1.00 14.79 ? 35 SER E CB 1 +ATOM 15128 O OG . SER D 1 15 ? 61.473 68.887 47.132 1.00 13.78 ? 35 SER E OG 1 +ATOM 15129 N N . ARG D 1 16 ? 63.867 66.882 48.608 1.00 14.25 ? 36 ARG E N 1 +ATOM 15130 C CA . ARG D 1 16 ? 64.803 67.295 49.672 1.00 14.13 ? 36 ARG E CA 1 +ATOM 15131 C C . ARG D 1 16 ? 65.380 66.131 50.460 1.00 14.15 ? 36 ARG E C 1 +ATOM 15132 O O . ARG D 1 16 ? 64.655 65.226 50.828 1.00 14.54 ? 36 ARG E O 1 +ATOM 15133 C CB . ARG D 1 16 ? 64.102 68.220 50.658 1.00 13.68 ? 36 ARG E CB 1 +ATOM 15134 C CG . ARG D 1 16 ? 63.388 69.367 50.016 1.00 13.97 ? 36 ARG E CG 1 +ATOM 15135 C CD . ARG D 1 16 ? 63.025 70.441 51.019 1.00 12.73 ? 36 ARG E CD 1 +ATOM 15136 N NE . ARG D 1 16 ? 62.522 71.628 50.335 1.00 11.60 ? 36 ARG E NE 1 +ATOM 15137 C CZ . ARG D 1 16 ? 62.408 72.830 50.896 1.00 11.13 ? 36 ARG E CZ 1 +ATOM 15138 N NH1 . ARG D 1 16 ? 62.728 73.033 52.162 1.00 10.76 ? 36 ARG E NH1 1 +ATOM 15139 N NH2 . ARG D 1 16 ? 61.964 73.832 50.183 1.00 12.13 ? 36 ARG E NH2 1 +ATOM 15140 N N . GLU D 1 17 ? 66.690 66.182 50.717 1.00 13.97 ? 37 GLU E N 1 +ATOM 15141 C CA . GLU D 1 17 ? 67.369 65.217 51.561 1.00 14.01 ? 37 GLU E CA 1 +ATOM 15142 C C . GLU D 1 17 ? 67.847 65.906 52.830 1.00 14.39 ? 37 GLU E C 1 +ATOM 15143 O O . GLU D 1 17 ? 68.005 67.134 52.844 1.00 13.64 ? 37 GLU E O 1 +ATOM 15144 C CB . GLU D 1 17 ? 68.577 64.630 50.836 1.00 14.31 ? 37 GLU E CB 1 +ATOM 15145 C CG . GLU D 1 17 ? 68.258 63.932 49.541 1.00 14.61 ? 37 GLU E CG 1 +ATOM 15146 C CD . GLU D 1 17 ? 69.504 63.394 48.878 1.00 16.00 ? 37 GLU E CD 1 +ATOM 15147 O OE1 . GLU D 1 17 ? 70.348 62.808 49.588 1.00 18.72 ? 37 GLU E OE1 1 +ATOM 15148 O OE2 . GLU D 1 17 ? 69.644 63.532 47.649 1.00 17.28 ? 37 GLU E OE2 1 +ATOM 15149 N N . CYS D 1 18 ? 68.071 65.110 53.878 1.00 14.83 ? 38 CYS E N 1 +ATOM 15150 C CA . CYS D 1 18 ? 68.646 65.583 55.147 1.00 16.01 ? 38 CYS E CA 1 +ATOM 15151 C C . CYS D 1 18 ? 69.717 64.610 55.617 1.00 15.84 ? 38 CYS E C 1 +ATOM 15152 O O . CYS D 1 18 ? 69.478 63.393 55.651 1.00 15.55 ? 38 CYS E O 1 +ATOM 15153 C CB . CYS D 1 18 ? 67.591 65.647 56.242 1.00 16.23 ? 38 CYS E CB 1 +ATOM 15154 S SG . CYS D 1 18 ? 66.234 66.709 55.918 1.00 20.31 ? 38 CYS E SG 1 +ATOM 15155 N N . LYS D 1 19 ? 70.878 65.145 55.986 1.00 15.59 ? 39 LYS E N 1 +ATOM 15156 C CA . LYS D 1 19 ? 71.966 64.363 56.569 1.00 15.63 ? 39 LYS E CA 1 +ATOM 15157 C C . LYS D 1 19 ? 72.363 64.957 57.912 1.00 15.57 ? 39 LYS E C 1 +ATOM 15158 O O . LYS D 1 19 ? 72.944 66.037 57.967 1.00 15.77 ? 39 LYS E O 1 +ATOM 15159 C CB . LYS D 1 19 ? 73.190 64.336 55.650 1.00 15.84 ? 39 LYS E CB 1 +ATOM 15160 C CG . LYS D 1 19 ? 74.380 63.570 56.236 1.00 16.24 ? 39 LYS E CG 1 +ATOM 15161 C CD . LYS D 1 19 ? 75.360 63.121 55.170 1.00 17.43 ? 39 LYS E CD 1 +ATOM 15162 C CE . LYS D 1 19 ? 76.493 62.273 55.768 1.00 18.32 ? 39 LYS E CE 1 +ATOM 15163 N NZ . LYS D 1 19 ? 76.044 60.890 56.138 1.00 19.56 ? 39 LYS E NZ 1 +ATOM 15164 N N . GLU D 1 20 ? 72.063 64.238 58.989 1.00 15.30 ? 40 GLU E N 1 +ATOM 15165 C CA . GLU D 1 20 ? 72.365 64.698 60.344 1.00 14.96 ? 40 GLU E CA 1 +ATOM 15166 C C . GLU D 1 20 ? 73.870 64.616 60.582 1.00 14.46 ? 40 GLU E C 1 +ATOM 15167 O O . GLU D 1 20 ? 74.528 63.683 60.115 1.00 14.92 ? 40 GLU E O 1 +ATOM 15168 C CB . GLU D 1 20 ? 71.628 63.829 61.374 1.00 15.51 ? 40 GLU E CB 1 +ATOM 15169 C CG . GLU D 1 20 ? 70.091 63.894 61.282 1.00 15.53 ? 40 GLU E CG 1 +ATOM 15170 C CD . GLU D 1 20 ? 69.469 62.883 60.308 0.50 15.61 ? 40 GLU E CD 1 +ATOM 15171 O OE1 . GLU D 1 20 ? 70.206 62.189 59.565 0.50 12.82 ? 40 GLU E OE1 1 +ATOM 15172 O OE2 . GLU D 1 20 ? 68.220 62.796 60.280 0.50 15.64 ? 40 GLU E OE2 1 +ATOM 15173 N N . LEU D 1 21 ? 74.411 65.595 61.298 1.00 13.89 ? 41 LEU E N 1 +ATOM 15174 C CA . LEU D 1 21 ? 75.836 65.626 61.632 1.00 14.03 ? 41 LEU E CA 1 +ATOM 15175 C C . LEU D 1 21 ? 76.052 65.462 63.130 1.00 14.16 ? 41 LEU E C 1 +ATOM 15176 O O . LEU D 1 21 ? 77.049 65.922 63.670 1.00 15.07 ? 41 LEU E O 1 +ATOM 15177 C CB . LEU D 1 21 ? 76.458 66.937 61.152 1.00 13.70 ? 41 LEU E CB 1 +ATOM 15178 C CG . LEU D 1 21 ? 76.510 67.139 59.642 1.00 14.36 ? 41 LEU E CG 1 +ATOM 15179 C CD1 . LEU D 1 21 ? 77.230 68.457 59.357 1.00 13.83 ? 41 LEU E CD1 1 +ATOM 15180 C CD2 . LEU D 1 21 ? 77.206 65.988 58.949 1.00 14.66 ? 41 LEU E CD2 1 +ATOM 15181 N N . ASP D 1 22 ? 75.160 64.746 63.796 1.00 13.75 ? 42 ASP E N 1 +ATOM 15182 C CA . ASP D 1 22 ? 75.294 64.532 65.237 1.00 13.90 ? 42 ASP E CA 1 +ATOM 15183 C C . ASP D 1 22 ? 76.315 63.433 65.554 1.00 13.01 ? 42 ASP E C 1 +ATOM 15184 O O . ASP D 1 22 ? 76.682 62.644 64.677 1.00 13.61 ? 42 ASP E O 1 +ATOM 15185 C CB . ASP D 1 22 ? 73.918 64.278 65.846 1.00 14.72 ? 42 ASP E CB 1 +ATOM 15186 C CG . ASP D 1 22 ? 72.962 65.468 65.637 1.00 16.03 ? 42 ASP E CG 1 +ATOM 15187 O OD1 . ASP D 1 22 ? 73.427 66.627 65.429 1.00 18.97 ? 42 ASP E OD1 1 +ATOM 15188 O OD2 . ASP D 1 22 ? 71.737 65.254 65.678 1.00 20.27 ? 42 ASP E OD2 1 +ATOM 15189 N N . GLY D 1 23 ? 76.805 63.414 66.793 1.00 11.98 ? 43 GLY E N 1 +ATOM 15190 C CA . GLY D 1 23 ? 77.864 62.492 67.219 1.00 11.55 ? 43 GLY E CA 1 +ATOM 15191 C C . GLY D 1 23 ? 79.117 63.246 67.655 1.00 11.15 ? 43 GLY E C 1 +ATOM 15192 O O . GLY D 1 23 ? 79.023 64.325 68.254 1.00 11.08 ? 43 GLY E O 1 +ATOM 15193 N N . LEU D 1 24 ? 80.290 62.671 67.387 1.00 10.96 ? 44 LEU E N 1 +ATOM 15194 C CA . LEU D 1 24 ? 81.557 63.258 67.846 1.00 10.81 ? 44 LEU E CA 1 +ATOM 15195 C C . LEU D 1 24 ? 82.090 64.376 66.931 1.00 10.75 ? 44 LEU E C 1 +ATOM 15196 O O . LEU D 1 24 ? 82.216 64.200 65.708 1.00 10.41 ? 44 LEU E O 1 +ATOM 15197 C CB . LEU D 1 24 ? 82.644 62.187 67.975 1.00 10.80 ? 44 LEU E CB 1 +ATOM 15198 C CG . LEU D 1 24 ? 82.434 61.009 68.926 1.00 11.91 ? 44 LEU E CG 1 +ATOM 15199 C CD1 . LEU D 1 24 ? 83.696 60.114 68.897 1.00 12.51 ? 44 LEU E CD1 1 +ATOM 15200 C CD2 . LEU D 1 24 ? 82.090 61.455 70.339 1.00 13.20 ? 44 LEU E CD2 1 +ATOM 15201 N N . TRP D 1 25 ? 82.375 65.527 67.530 1.00 10.12 ? 45 TRP E N 1 +ATOM 15202 C CA . TRP D 1 25 ? 83.121 66.588 66.875 1.00 10.29 ? 45 TRP E CA 1 +ATOM 15203 C C . TRP D 1 25 ? 84.417 66.778 67.661 1.00 10.64 ? 45 TRP E C 1 +ATOM 15204 O O . TRP D 1 25 ? 84.477 66.443 68.853 1.00 11.14 ? 45 TRP E O 1 +ATOM 15205 C CB . TRP D 1 25 ? 82.327 67.901 66.897 1.00 9.79 ? 45 TRP E CB 1 +ATOM 15206 C CG . TRP D 1 25 ? 81.100 67.925 66.041 1.00 8.94 ? 45 TRP E CG 1 +ATOM 15207 C CD1 . TRP D 1 25 ? 80.087 67.024 66.042 1.00 9.92 ? 45 TRP E CD1 1 +ATOM 15208 C CD2 . TRP D 1 25 ? 80.759 68.914 65.072 1.00 8.94 ? 45 TRP E CD2 1 +ATOM 15209 N NE1 . TRP D 1 25 ? 79.130 67.376 65.114 1.00 9.66 ? 45 TRP E NE1 1 +ATOM 15210 C CE2 . TRP D 1 25 ? 79.519 68.545 64.511 1.00 9.02 ? 45 TRP E CE2 1 +ATOM 15211 C CE3 . TRP D 1 25 ? 81.379 70.086 64.624 1.00 9.92 ? 45 TRP E CE3 1 +ATOM 15212 C CZ2 . TRP D 1 25 ? 78.899 69.291 63.516 1.00 10.11 ? 45 TRP E CZ2 1 +ATOM 15213 C CZ3 . TRP D 1 25 ? 80.750 70.840 63.632 1.00 9.85 ? 45 TRP E CZ3 1 +ATOM 15214 C CH2 . TRP D 1 25 ? 79.524 70.434 63.094 1.00 10.11 ? 45 TRP E CH2 1 +ATOM 15215 N N . SER D 1 26 ? 85.450 67.296 67.002 1.00 10.74 ? 46 SER E N 1 +ATOM 15216 C CA . SER D 1 26 ? 86.696 67.649 67.680 1.00 11.08 ? 46 SER E CA 1 +ATOM 15217 C C . SER D 1 26 ? 86.492 68.998 68.332 1.00 10.47 ? 46 SER E C 1 +ATOM 15218 O O . SER D 1 26 ? 85.720 69.814 67.830 1.00 10.29 ? 46 SER E O 1 +ATOM 15219 C CB . SER D 1 26 ? 87.859 67.712 66.691 1.00 11.42 ? 46 SER E CB 1 +ATOM 15220 O OG . SER D 1 26 ? 88.108 66.424 66.171 1.00 13.42 ? 46 SER E OG 1 +ATOM 15221 N N . PHE D 1 27 ? 87.192 69.231 69.437 1.00 9.11 ? 47 PHE E N 1 +ATOM 15222 C CA . PHE D 1 27 ? 86.894 70.371 70.296 1.00 9.10 ? 47 PHE E CA 1 +ATOM 15223 C C . PHE D 1 27 ? 88.138 70.892 71.000 1.00 8.81 ? 47 PHE E C 1 +ATOM 15224 O O . PHE D 1 27 ? 88.972 70.122 71.442 1.00 9.10 ? 47 PHE E O 1 +ATOM 15225 C CB . PHE D 1 27 ? 85.841 69.930 71.309 1.00 8.88 ? 47 PHE E CB 1 +ATOM 15226 C CG . PHE D 1 27 ? 85.441 70.978 72.314 1.00 9.02 ? 47 PHE E CG 1 +ATOM 15227 C CD1 . PHE D 1 27 ? 86.156 71.143 73.481 1.00 8.84 ? 47 PHE E CD1 1 +ATOM 15228 C CD2 . PHE D 1 27 ? 84.297 71.741 72.131 1.00 7.44 ? 47 PHE E CD2 1 +ATOM 15229 C CE1 . PHE D 1 27 ? 85.766 72.066 74.425 1.00 8.60 ? 47 PHE E CE1 1 +ATOM 15230 C CE2 . PHE D 1 27 ? 83.902 72.664 73.078 1.00 7.75 ? 47 PHE E CE2 1 +ATOM 15231 C CZ . PHE D 1 27 ? 84.643 72.832 74.225 1.00 8.18 ? 47 PHE E CZ 1 +ATOM 15232 N N . ARG D 1 28 ? 88.252 72.211 71.065 1.00 9.35 ? 48 ARG E N 1 +ATOM 15233 C CA . ARG D 1 28 ? 89.259 72.883 71.869 1.00 9.89 ? 48 ARG E CA 1 +ATOM 15234 C C . ARG D 1 28 ? 88.645 74.174 72.419 1.00 9.52 ? 48 ARG E C 1 +ATOM 15235 O O . ARG D 1 28 ? 88.049 74.946 71.673 1.00 9.06 ? 48 ARG E O 1 +ATOM 15236 C CB . ARG D 1 28 ? 90.490 73.211 71.019 1.00 9.94 ? 48 ARG E CB 1 +ATOM 15237 C CG . ARG D 1 28 ? 91.656 73.729 71.843 1.00 12.72 ? 48 ARG E CG 1 +ATOM 15238 C CD . ARG D 1 28 ? 93.008 73.470 71.191 1.00 15.20 ? 48 ARG E CD 1 +ATOM 15239 N NE . ARG D 1 28 ? 93.122 74.143 69.916 1.00 18.31 ? 48 ARG E NE 1 +ATOM 15240 C CZ . ARG D 1 28 ? 93.463 73.596 68.753 1.00 18.79 ? 48 ARG E CZ 1 +ATOM 15241 N NH1 . ARG D 1 28 ? 93.772 72.312 68.622 1.00 19.62 ? 48 ARG E NH1 1 +ATOM 15242 N NH2 . ARG D 1 28 ? 93.501 74.368 67.691 1.00 18.80 ? 48 ARG E NH2 1 +ATOM 15243 N N . ALA D 1 29 ? 88.767 74.382 73.724 1.00 9.42 ? 49 ALA E N 1 +ATOM 15244 C CA . ALA D 1 29 ? 88.436 75.663 74.327 1.00 9.94 ? 49 ALA E CA 1 +ATOM 15245 C C . ALA D 1 29 ? 89.689 76.524 74.183 1.00 10.15 ? 49 ALA E C 1 +ATOM 15246 O O . ALA D 1 29 ? 90.794 75.996 74.348 1.00 10.41 ? 49 ALA E O 1 +ATOM 15247 C CB . ALA D 1 29 ? 88.066 75.469 75.794 1.00 10.35 ? 49 ALA E CB 1 +ATOM 15248 N N . ASP D 1 30 ? 89.537 77.819 73.861 1.00 10.37 ? 50 ASP E N 1 +ATOM 15249 C CA . ASP D 1 30 ? 90.693 78.729 73.729 1.00 10.11 ? 50 ASP E CA 1 +ATOM 15250 C C . ASP D 1 30 ? 90.954 79.472 75.050 1.00 10.09 ? 50 ASP E C 1 +ATOM 15251 O O . ASP D 1 30 ? 90.391 80.547 75.286 1.00 9.62 ? 50 ASP E O 1 +ATOM 15252 C CB . ASP D 1 30 ? 90.492 79.744 72.576 1.00 9.88 ? 50 ASP E CB 1 +ATOM 15253 C CG . ASP D 1 30 ? 91.671 80.695 72.405 1.00 11.21 ? 50 ASP E CG 1 +ATOM 15254 O OD1 . ASP D 1 30 ? 92.659 80.565 73.162 1.00 11.03 ? 50 ASP E OD1 1 +ATOM 15255 O OD2 . ASP D 1 30 ? 91.596 81.594 71.527 1.00 10.47 ? 50 ASP E OD2 1 +ATOM 15256 N N . PHE D 1 31 ? 91.834 78.894 75.876 1.00 10.70 ? 51 PHE E N 1 +ATOM 15257 C CA . PHE D 1 31 ? 92.160 79.398 77.215 1.00 11.53 ? 51 PHE E CA 1 +ATOM 15258 C C . PHE D 1 31 ? 93.221 80.523 77.206 1.00 12.36 ? 51 PHE E C 1 +ATOM 15259 O O . PHE D 1 31 ? 93.721 80.924 78.264 1.00 12.64 ? 51 PHE E O 1 +ATOM 15260 C CB . PHE D 1 31 ? 92.640 78.250 78.125 1.00 12.39 ? 51 PHE E CB 1 +ATOM 15261 C CG . PHE D 1 31 ? 91.566 77.233 78.479 1.00 12.60 ? 51 PHE E CG 1 +ATOM 15262 C CD1 . PHE D 1 31 ? 90.459 77.599 79.230 1.00 14.80 ? 51 PHE E CD1 1 +ATOM 15263 C CD2 . PHE D 1 31 ? 91.688 75.909 78.088 1.00 14.74 ? 51 PHE E CD2 1 +ATOM 15264 C CE1 . PHE D 1 31 ? 89.477 76.657 79.555 1.00 13.69 ? 51 PHE E CE1 1 +ATOM 15265 C CE2 . PHE D 1 31 ? 90.715 74.971 78.413 1.00 14.80 ? 51 PHE E CE2 1 +ATOM 15266 C CZ . PHE D 1 31 ? 89.615 75.353 79.153 1.00 13.53 ? 51 PHE E CZ 1 +ATOM 15267 N N . SER D 1 32 ? 93.558 81.048 76.029 1.00 12.17 ? 52 SER E N 1 +ATOM 15268 C CA . SER D 1 32 ? 94.530 82.142 75.950 1.00 12.24 ? 52 SER E CA 1 +ATOM 15269 C C . SER D 1 32 ? 94.052 83.346 76.767 1.00 12.11 ? 52 SER E C 1 +ATOM 15270 O O . SER D 1 32 ? 92.857 83.607 76.842 1.00 11.45 ? 52 SER E O 1 +ATOM 15271 C CB . SER D 1 32 ? 94.779 82.550 74.490 1.00 12.42 ? 52 SER E CB 1 +ATOM 15272 O OG . SER D 1 32 ? 93.618 83.048 73.847 1.00 10.63 ? 52 SER E OG 1 +ATOM 15273 N N . ASP D 1 33 ? 94.981 84.066 77.388 1.00 12.68 ? 53 ASP E N 1 +ATOM 15274 C CA . ASP D 1 33 ? 94.622 85.214 78.243 1.00 13.25 ? 53 ASP E CA 1 +ATOM 15275 C C . ASP D 1 33 ? 93.741 86.238 77.537 1.00 13.19 ? 53 ASP E C 1 +ATOM 15276 O O . ASP D 1 33 ? 92.758 86.713 78.121 1.00 13.96 ? 53 ASP E O 1 +ATOM 15277 C CB . ASP D 1 33 ? 95.882 85.878 78.807 1.00 13.52 ? 53 ASP E CB 1 +ATOM 15278 C CG . ASP D 1 33 ? 96.607 84.988 79.809 1.00 15.37 ? 53 ASP E CG 1 +ATOM 15279 O OD1 . ASP D 1 33 ? 95.937 84.169 80.470 1.00 17.90 ? 53 ASP E OD1 1 +ATOM 15280 O OD2 . ASP D 1 33 ? 97.844 85.117 79.948 1.00 18.65 ? 53 ASP E OD2 1 +ATOM 15281 N N . ASN D 1 34 ? 94.064 86.572 76.285 1.00 12.50 ? 54 ASN E N 1 +ATOM 15282 C CA . ASN D 1 34 ? 93.235 87.499 75.518 1.00 12.10 ? 54 ASN E CA 1 +ATOM 15283 C C . ASN D 1 34 ? 92.100 86.800 74.783 1.00 11.36 ? 54 ASN E C 1 +ATOM 15284 O O . ASN D 1 34 ? 91.378 87.443 74.030 1.00 10.65 ? 54 ASN E O 1 +ATOM 15285 C CB . ASN D 1 34 ? 94.073 88.342 74.543 1.00 12.42 ? 54 ASN E CB 1 +ATOM 15286 C CG . ASN D 1 34 ? 94.585 87.554 73.342 1.00 12.83 ? 54 ASN E CG 1 +ATOM 15287 O OD1 . ASN D 1 34 ? 94.197 86.405 73.102 1.00 15.39 ? 54 ASN E OD1 1 +ATOM 15288 N ND2 . ASN D 1 34 ? 95.471 88.191 72.567 1.00 14.98 ? 54 ASN E ND2 1 +ATOM 15289 N N . ARG D 1 35 ? 91.969 85.487 74.998 1.00 11.14 ? 55 ARG E N 1 +ATOM 15290 C CA . ARG D 1 35 ? 90.857 84.676 74.480 1.00 10.91 ? 55 ARG E CA 1 +ATOM 15291 C C . ARG D 1 35 ? 90.708 84.649 72.945 1.00 11.34 ? 55 ARG E C 1 +ATOM 15292 O O . ARG D 1 35 ? 89.680 84.207 72.431 1.00 10.56 ? 55 ARG E O 1 +ATOM 15293 C CB . ARG D 1 35 ? 89.536 85.103 75.152 1.00 11.77 ? 55 ARG E CB 1 +ATOM 15294 C CG . ARG D 1 35 ? 89.489 84.892 76.669 1.00 10.82 ? 55 ARG E CG 1 +ATOM 15295 C CD . ARG D 1 35 ? 89.391 83.410 77.025 1.00 11.81 ? 55 ARG E CD 1 +ATOM 15296 N NE . ARG D 1 35 ? 89.051 83.164 78.425 1.00 12.58 ? 55 ARG E NE 1 +ATOM 15297 C CZ . ARG D 1 35 ? 89.917 83.149 79.434 1.00 13.47 ? 55 ARG E CZ 1 +ATOM 15298 N NH1 . ARG D 1 35 ? 91.211 83.391 79.238 1.00 15.50 ? 55 ARG E NH1 1 +ATOM 15299 N NH2 . ARG D 1 35 ? 89.483 82.890 80.660 1.00 13.84 ? 55 ARG E NH2 1 +ATOM 15300 N N . ARG D 1 36 ? 91.725 85.096 72.204 1.00 10.92 ? 56 ARG E N 1 +ATOM 15301 C CA . ARG D 1 36 ? 91.613 85.135 70.736 1.00 11.28 ? 56 ARG E CA 1 +ATOM 15302 C C . ARG D 1 36 ? 92.834 84.560 69.986 1.00 11.04 ? 56 ARG E C 1 +ATOM 15303 O O . ARG D 1 36 ? 92.993 84.801 68.790 1.00 10.78 ? 56 ARG E O 1 +ATOM 15304 C CB . ARG D 1 36 ? 91.255 86.537 70.241 1.00 11.91 ? 56 ARG E CB 1 +ATOM 15305 C CG . ARG D 1 36 ? 92.230 87.609 70.663 1.00 12.83 ? 56 ARG E CG 1 +ATOM 15306 C CD . ARG D 1 36 ? 91.827 88.987 70.176 1.00 15.55 ? 56 ARG E CD 1 +ATOM 15307 N NE . ARG D 1 36 ? 92.757 89.967 70.728 1.00 16.79 ? 56 ARG E NE 1 +ATOM 15308 C CZ . ARG D 1 36 ? 92.623 90.555 71.913 1.00 16.74 ? 56 ARG E CZ 1 +ATOM 15309 N NH1 . ARG D 1 36 ? 91.556 90.332 72.674 1.00 15.84 ? 56 ARG E NH1 1 +ATOM 15310 N NH2 . ARG D 1 36 ? 93.554 91.408 72.325 1.00 17.35 ? 56 ARG E NH2 1 +ATOM 15311 N N . ARG D 1 37 ? 93.653 83.782 70.678 1.00 11.30 ? 57 ARG E N 1 +ATOM 15312 C CA . ARG D 1 37 ? 94.734 83.004 70.029 1.00 11.74 ? 57 ARG E CA 1 +ATOM 15313 C C . ARG D 1 37 ? 94.240 82.244 68.794 1.00 11.09 ? 57 ARG E C 1 +ATOM 15314 O O . ARG D 1 37 ? 94.932 82.167 67.787 1.00 11.29 ? 57 ARG E O 1 +ATOM 15315 C CB . ARG D 1 37 ? 95.343 81.999 71.008 1.00 12.25 ? 57 ARG E CB 1 +ATOM 15316 C CG . ARG D 1 37 ? 96.449 81.149 70.388 1.00 13.13 ? 57 ARG E CG 1 +ATOM 15317 C CD . ARG D 1 37 ? 97.136 80.287 71.404 1.00 16.51 ? 57 ARG E CD 1 +ATOM 15318 N NE . ARG D 1 37 ? 98.297 79.621 70.825 1.00 18.74 ? 57 ARG E NE 1 +ATOM 15319 C CZ . ARG D 1 37 ? 99.281 79.070 71.532 1.00 20.39 ? 57 ARG E CZ 1 +ATOM 15320 N NH1 . ARG D 1 37 ? 99.235 79.045 72.861 1.00 20.88 ? 57 ARG E NH1 1 +ATOM 15321 N NH2 . ARG D 1 37 ? 100.308 78.507 70.900 1.00 21.46 ? 57 ARG E NH2 1 +ATOM 15322 N N . GLY D 1 38 ? 93.039 81.683 68.871 1.00 11.38 ? 58 GLY E N 1 +ATOM 15323 C CA . GLY D 1 38 ? 92.484 80.943 67.745 1.00 11.00 ? 58 GLY E CA 1 +ATOM 15324 C C . GLY D 1 38 ? 92.332 81.800 66.504 1.00 11.13 ? 58 GLY E C 1 +ATOM 15325 O O . GLY D 1 38 ? 92.483 81.319 65.394 1.00 11.20 ? 58 GLY E O 1 +ATOM 15326 N N . PHE D 1 39 ? 92.034 83.082 66.684 1.00 10.78 ? 59 PHE E N 1 +ATOM 15327 C CA . PHE D 1 39 ? 91.965 83.977 65.547 1.00 11.06 ? 59 PHE E CA 1 +ATOM 15328 C C . PHE D 1 39 ? 93.344 84.501 65.182 1.00 11.45 ? 59 PHE E C 1 +ATOM 15329 O O . PHE D 1 39 ? 93.637 84.726 64.011 1.00 12.62 ? 59 PHE E O 1 +ATOM 15330 C CB . PHE D 1 39 ? 90.995 85.107 65.834 1.00 10.48 ? 59 PHE E CB 1 +ATOM 15331 C CG . PHE D 1 39 ? 89.590 84.632 66.028 1.00 10.14 ? 59 PHE E CG 1 +ATOM 15332 C CD1 . PHE D 1 39 ? 88.736 84.541 64.949 1.00 9.61 ? 59 PHE E CD1 1 +ATOM 15333 C CD2 . PHE D 1 39 ? 89.137 84.232 67.280 1.00 10.38 ? 59 PHE E CD2 1 +ATOM 15334 C CE1 . PHE D 1 39 ? 87.431 84.092 65.108 1.00 9.30 ? 59 PHE E CE1 1 +ATOM 15335 C CE2 . PHE D 1 39 ? 87.826 83.782 67.445 1.00 9.39 ? 59 PHE E CE2 1 +ATOM 15336 C CZ . PHE D 1 39 ? 86.987 83.705 66.358 1.00 10.06 ? 59 PHE E CZ 1 +ATOM 15337 N N . GLU D 1 40 ? 94.201 84.663 66.181 1.00 11.95 ? 60 GLU E N 1 +ATOM 15338 C CA . GLU D 1 40 ? 95.581 85.102 65.940 1.00 11.77 ? 60 GLU E CA 1 +ATOM 15339 C C . GLU D 1 40 ? 96.341 84.108 65.074 1.00 12.34 ? 60 GLU E C 1 +ATOM 15340 O O . GLU D 1 40 ? 97.025 84.488 64.118 1.00 12.44 ? 60 GLU E O 1 +ATOM 15341 C CB . GLU D 1 40 ? 96.299 85.308 67.271 1.00 11.42 ? 60 GLU E CB 1 +ATOM 15342 C CG . GLU D 1 40 ? 95.779 86.509 68.062 1.00 11.63 ? 60 GLU E CG 1 +ATOM 15343 C CD . GLU D 1 40 ? 96.469 86.690 69.404 1.00 11.00 ? 60 GLU E CD 1 +ATOM 15344 O OE1 . GLU D 1 40 ? 97.149 85.755 69.870 1.00 13.55 ? 60 GLU E OE1 1 +ATOM 15345 O OE2 . GLU D 1 40 ? 96.311 87.769 69.997 1.00 11.41 ? 60 GLU E OE2 1 +ATOM 15346 N N . GLU D 1 41 ? 96.202 82.828 65.409 1.00 12.48 ? 61 GLU E N 1 +ATOM 15347 C CA . GLU D 1 41 ? 96.852 81.747 64.688 1.00 13.24 ? 61 GLU E CA 1 +ATOM 15348 C C . GLU D 1 41 ? 95.974 81.189 63.568 1.00 13.41 ? 61 GLU E C 1 +ATOM 15349 O O . GLU D 1 41 ? 96.368 80.241 62.888 1.00 14.19 ? 61 GLU E O 1 +ATOM 15350 C CB . GLU D 1 41 ? 97.206 80.633 65.669 1.00 12.96 ? 61 GLU E CB 1 +ATOM 15351 C CG . GLU D 1 41 ? 98.196 81.051 66.748 1.00 13.01 ? 61 GLU E CG 1 +ATOM 15352 C CD . GLU D 1 41 ? 98.591 79.937 67.709 1.00 14.11 ? 61 GLU E CD 1 +ATOM 15353 O OE1 . GLU D 1 41 ? 97.832 78.959 67.881 1.00 12.32 ? 61 GLU E OE1 1 +ATOM 15354 O OE2 . GLU D 1 41 ? 99.673 80.054 68.319 1.00 14.87 ? 61 GLU E OE2 1 +ATOM 15355 N N . GLN D 1 42 ? 94.781 81.754 63.385 1.00 13.18 ? 62 GLN E N 1 +ATOM 15356 C CA . GLN D 1 42 ? 93.873 81.339 62.321 1.00 13.25 ? 62 GLN E CA 1 +ATOM 15357 C C . GLN D 1 42 ? 93.703 79.810 62.275 1.00 12.23 ? 62 GLN E C 1 +ATOM 15358 O O . GLN D 1 42 ? 93.935 79.174 61.262 1.00 12.16 ? 62 GLN E O 1 +ATOM 15359 C CB . GLN D 1 42 ? 94.365 81.858 60.973 1.00 13.78 ? 62 GLN E CB 1 +ATOM 15360 C CG . GLN D 1 42 ? 94.486 83.366 60.893 1.00 15.84 ? 62 GLN E CG 1 +ATOM 15361 C CD . GLN D 1 42 ? 94.605 83.840 59.459 1.00 19.21 ? 62 GLN E CD 1 +ATOM 15362 O OE1 . GLN D 1 42 ? 95.637 83.667 58.838 1.00 20.84 ? 62 GLN E OE1 1 +ATOM 15363 N NE2 . GLN D 1 42 ? 93.538 84.438 58.929 1.00 22.98 ? 62 GLN E NE2 1 +ATOM 15364 N N . TRP D 1 43 ? 93.267 79.237 63.387 1.00 11.75 ? 63 TRP E N 1 +ATOM 15365 C CA . TRP D 1 43 ? 93.081 77.797 63.476 1.00 11.11 ? 63 TRP E CA 1 +ATOM 15366 C C . TRP D 1 43 ? 92.224 77.238 62.344 1.00 11.55 ? 63 TRP E C 1 +ATOM 15367 O O . TRP D 1 43 ? 92.477 76.129 61.857 1.00 12.64 ? 63 TRP E O 1 +ATOM 15368 C CB . TRP D 1 43 ? 92.456 77.444 64.819 1.00 10.11 ? 63 TRP E CB 1 +ATOM 15369 C CG . TRP D 1 43 ? 93.342 77.680 66.006 1.00 9.17 ? 63 TRP E CG 1 +ATOM 15370 C CD1 . TRP D 1 43 ? 94.692 77.912 66.007 1.00 8.82 ? 63 TRP E CD1 1 +ATOM 15371 C CD2 . TRP D 1 43 ? 92.946 77.654 67.383 1.00 9.43 ? 63 TRP E CD2 1 +ATOM 15372 N NE1 . TRP D 1 43 ? 95.146 78.067 67.287 1.00 9.34 ? 63 TRP E NE1 1 +ATOM 15373 C CE2 . TRP D 1 43 ? 94.097 77.907 68.154 1.00 9.72 ? 63 TRP E CE2 1 +ATOM 15374 C CE3 . TRP D 1 43 ? 91.722 77.471 68.036 1.00 9.30 ? 63 TRP E CE3 1 +ATOM 15375 C CZ2 . TRP D 1 43 ? 94.067 77.971 69.539 1.00 9.07 ? 63 TRP E CZ2 1 +ATOM 15376 C CZ3 . TRP D 1 43 ? 91.696 77.519 69.413 1.00 8.55 ? 63 TRP E CZ3 1 +ATOM 15377 C CH2 . TRP D 1 43 ? 92.858 77.770 70.152 1.00 10.06 ? 63 TRP E CH2 1 +ATOM 15378 N N . TYR D 1 44 ? 91.207 78.000 61.947 1.00 12.40 ? 64 TYR E N 1 +ATOM 15379 C CA . TYR D 1 44 ? 90.252 77.592 60.911 1.00 12.89 ? 64 TYR E CA 1 +ATOM 15380 C C . TYR D 1 44 ? 90.869 77.257 59.552 1.00 12.86 ? 64 TYR E C 1 +ATOM 15381 O O . TYR D 1 44 ? 90.241 76.570 58.762 1.00 12.21 ? 64 TYR E O 1 +ATOM 15382 C CB . TYR D 1 44 ? 89.152 78.658 60.709 1.00 13.26 ? 64 TYR E CB 1 +ATOM 15383 C CG . TYR D 1 44 ? 89.678 80.053 60.512 1.00 14.14 ? 64 TYR E CG 1 +ATOM 15384 C CD1 . TYR D 1 44 ? 89.791 80.934 61.588 1.00 14.47 ? 64 TYR E CD1 1 +ATOM 15385 C CD2 . TYR D 1 44 ? 90.076 80.501 59.251 1.00 13.94 ? 64 TYR E CD2 1 +ATOM 15386 C CE1 . TYR D 1 44 ? 90.288 82.219 61.415 1.00 15.74 ? 64 TYR E CE1 1 +ATOM 15387 C CE2 . TYR D 1 44 ? 90.567 81.782 59.071 1.00 14.83 ? 64 TYR E CE2 1 +ATOM 15388 C CZ . TYR D 1 44 ? 90.671 82.632 60.149 1.00 14.87 ? 64 TYR E CZ 1 +ATOM 15389 O OH . TYR D 1 44 ? 91.165 83.898 59.976 1.00 16.26 ? 64 TYR E OH 1 +ATOM 15390 N N . ARG D 1 45 ? 92.083 77.725 59.273 1.00 13.16 ? 65 ARG E N 1 +ATOM 15391 C CA . ARG D 1 45 ? 92.695 77.533 57.949 1.00 14.32 ? 65 ARG E CA 1 +ATOM 15392 C C . ARG D 1 45 ? 93.097 76.082 57.692 1.00 14.30 ? 65 ARG E C 1 +ATOM 15393 O O . ARG D 1 45 ? 93.231 75.667 56.540 1.00 14.27 ? 65 ARG E O 1 +ATOM 15394 C CB . ARG D 1 45 ? 93.933 78.422 57.794 1.00 14.57 ? 65 ARG E CB 1 +ATOM 15395 C CG . ARG D 1 45 ? 93.656 79.911 57.873 1.00 18.08 ? 65 ARG E CG 1 +ATOM 15396 C CD . ARG D 1 45 ? 94.881 80.695 57.448 1.00 22.46 ? 65 ARG E CD 1 +ATOM 15397 N NE . ARG D 1 45 ? 94.967 80.753 55.994 1.00 25.02 ? 65 ARG E NE 1 +ATOM 15398 C CZ . ARG D 1 45 ? 94.468 81.726 55.230 1.00 26.96 ? 65 ARG E CZ 1 +ATOM 15399 N NH1 . ARG D 1 45 ? 93.854 82.779 55.764 1.00 28.43 ? 65 ARG E NH1 1 +ATOM 15400 N NH2 . ARG D 1 45 ? 94.597 81.650 53.908 1.00 27.89 ? 65 ARG E NH2 1 +ATOM 15401 N N . ARG D 1 46 ? 93.275 75.320 58.768 1.00 14.59 ? 66 ARG E N 1 +ATOM 15402 C CA . ARG D 1 46 ? 93.728 73.938 58.687 1.00 14.73 ? 66 ARG E CA 1 +ATOM 15403 C C . ARG D 1 46 ? 92.931 73.093 59.670 1.00 14.39 ? 66 ARG E C 1 +ATOM 15404 O O . ARG D 1 46 ? 92.317 73.620 60.605 1.00 13.43 ? 66 ARG E O 1 +ATOM 15405 C CB . ARG D 1 46 ? 95.213 73.841 59.025 1.00 15.67 ? 66 ARG E CB 1 +ATOM 15406 C CG . ARG D 1 46 ? 96.141 74.584 58.082 1.00 17.20 ? 66 ARG E CG 1 +ATOM 15407 C CD . ARG D 1 46 ? 96.110 73.964 56.699 1.00 21.78 ? 66 ARG E CD 1 +ATOM 15408 N NE . ARG D 1 46 ? 96.656 72.610 56.677 1.00 22.84 ? 66 ARG E NE 1 +ATOM 15409 C CZ . ARG D 1 46 ? 96.627 71.810 55.611 1.00 25.39 ? 66 ARG E CZ 1 +ATOM 15410 N NH1 . ARG D 1 46 ? 96.084 72.219 54.465 1.00 27.20 ? 66 ARG E NH1 1 +ATOM 15411 N NH2 . ARG D 1 46 ? 97.149 70.593 55.682 1.00 25.34 ? 66 ARG E NH2 1 +ATOM 15412 N N . PRO D 1 47 ? 92.935 71.774 59.467 1.00 14.11 ? 67 PRO E N 1 +ATOM 15413 C CA . PRO D 1 47 ? 92.294 70.912 60.449 1.00 13.73 ? 67 PRO E CA 1 +ATOM 15414 C C . PRO D 1 47 ? 92.721 71.277 61.863 1.00 13.14 ? 67 PRO E C 1 +ATOM 15415 O O . PRO D 1 47 ? 93.890 71.591 62.103 1.00 12.84 ? 67 PRO E O 1 +ATOM 15416 C CB . PRO D 1 47 ? 92.787 69.517 60.059 1.00 13.61 ? 67 PRO E CB 1 +ATOM 15417 C CG . PRO D 1 47 ? 93.018 69.624 58.578 1.00 14.57 ? 67 PRO E CG 1 +ATOM 15418 C CD . PRO D 1 47 ? 93.510 71.010 58.342 1.00 14.26 ? 67 PRO E CD 1 +ATOM 15419 N N . LEU D 1 48 ? 91.763 71.240 62.781 1.00 12.96 ? 68 LEU E N 1 +ATOM 15420 C CA . LEU D 1 48 ? 91.958 71.730 64.139 1.00 13.22 ? 68 LEU E CA 1 +ATOM 15421 C C . LEU D 1 48 ? 93.117 71.014 64.853 1.00 13.60 ? 68 LEU E C 1 +ATOM 15422 O O . LEU D 1 48 ? 93.888 71.649 65.566 1.00 13.56 ? 68 LEU E O 1 +ATOM 15423 C CB . LEU D 1 48 ? 90.649 71.607 64.935 1.00 13.07 ? 68 LEU E CB 1 +ATOM 15424 C CG . LEU D 1 48 ? 90.419 72.479 66.173 1.00 13.81 ? 68 LEU E CG 1 +ATOM 15425 C CD1 . LEU D 1 48 ? 90.569 73.948 65.842 1.00 12.12 ? 68 LEU E CD1 1 +ATOM 15426 C CD2 . LEU D 1 48 ? 89.015 72.194 66.744 1.00 12.50 ? 68 LEU E CD2 1 +ATOM 15427 N N . TRP D 1 49 ? 93.263 69.702 64.648 1.00 14.71 ? 69 TRP E N 1 +ATOM 15428 C CA . TRP D 1 49 ? 94.329 68.948 65.320 1.00 15.37 ? 69 TRP E CA 1 +ATOM 15429 C C . TRP D 1 49 ? 95.733 69.454 64.987 1.00 16.15 ? 69 TRP E C 1 +ATOM 15430 O O . TRP D 1 49 ? 96.679 69.224 65.747 1.00 16.93 ? 69 TRP E O 1 +ATOM 15431 C CB . TRP D 1 49 ? 94.217 67.446 65.018 1.00 15.78 ? 69 TRP E CB 1 +ATOM 15432 C CG . TRP D 1 49 ? 94.449 67.075 63.587 1.00 15.85 ? 69 TRP E CG 1 +ATOM 15433 C CD1 . TRP D 1 49 ? 93.505 66.937 62.617 1.00 15.82 ? 69 TRP E CD1 1 +ATOM 15434 C CD2 . TRP D 1 49 ? 95.707 66.797 62.965 1.00 16.16 ? 69 TRP E CD2 1 +ATOM 15435 N NE1 . TRP D 1 49 ? 94.097 66.593 61.429 1.00 16.15 ? 69 TRP E NE1 1 +ATOM 15436 C CE2 . TRP D 1 49 ? 95.449 66.508 61.614 1.00 15.62 ? 69 TRP E CE2 1 +ATOM 15437 C CE3 . TRP D 1 49 ? 97.029 66.774 63.418 1.00 16.27 ? 69 TRP E CE3 1 +ATOM 15438 C CZ2 . TRP D 1 49 ? 96.462 66.175 60.713 1.00 17.13 ? 69 TRP E CZ2 1 +ATOM 15439 C CZ3 . TRP D 1 49 ? 98.039 66.458 62.518 1.00 16.32 ? 69 TRP E CZ3 1 +ATOM 15440 C CH2 . TRP D 1 49 ? 97.746 66.166 61.184 1.00 16.37 ? 69 TRP E CH2 1 +ATOM 15441 N N . GLU D 1 50 ? 95.879 70.149 63.865 1.00 16.52 ? 70 GLU E N 1 +ATOM 15442 C CA . GLU D 1 50 ? 97.189 70.651 63.477 1.00 17.08 ? 70 GLU E CA 1 +ATOM 15443 C C . GLU D 1 50 ? 97.687 71.790 64.359 1.00 17.21 ? 70 GLU E C 1 +ATOM 15444 O O . GLU D 1 50 ? 98.887 71.991 64.461 1.00 18.45 ? 70 GLU E O 1 +ATOM 15445 C CB . GLU D 1 50 ? 97.183 71.085 62.019 1.00 17.36 ? 70 GLU E CB 1 +ATOM 15446 C CG . GLU D 1 50 ? 96.955 69.942 61.049 1.00 18.49 ? 70 GLU E CG 1 +ATOM 15447 C CD . GLU D 1 50 ? 97.201 70.347 59.616 1.00 20.76 ? 70 GLU E CD 1 +ATOM 15448 O OE1 . GLU D 1 50 ? 97.721 71.461 59.395 1.00 23.75 ? 70 GLU E OE1 1 +ATOM 15449 O OE2 . GLU D 1 50 ? 96.859 69.566 58.710 1.00 23.33 ? 70 GLU E OE2 1 +ATOM 15450 N N . SER D 1 51 ? 96.789 72.536 64.995 1.00 17.07 ? 71 SER E N 1 +ATOM 15451 C CA . SER D 1 51 ? 97.211 73.670 65.817 1.00 16.94 ? 71 SER E CA 1 +ATOM 15452 C C . SER D 1 51 ? 97.279 73.370 67.318 1.00 16.58 ? 71 SER E C 1 +ATOM 15453 O O . SER D 1 51 ? 97.523 74.272 68.119 1.00 17.43 ? 71 SER E O 1 +ATOM 15454 C CB . SER D 1 51 ? 96.316 74.881 65.536 1.00 17.06 ? 71 SER E CB 1 +ATOM 15455 O OG . SER D 1 51 ? 94.955 74.503 65.538 1.00 17.45 ? 71 SER E OG 1 +ATOM 15456 N N . GLY D 1 52 ? 97.083 72.109 67.701 1.00 16.03 ? 72 GLY E N 1 +ATOM 15457 C CA . GLY D 1 52 ? 97.230 71.708 69.102 1.00 15.31 ? 72 GLY E CA 1 +ATOM 15458 C C . GLY D 1 52 ? 96.314 70.552 69.472 1.00 14.73 ? 72 GLY E C 1 +ATOM 15459 O O . GLY D 1 52 ? 95.531 70.105 68.640 1.00 13.75 ? 72 GLY E O 1 +ATOM 15460 N N . PRO D 1 53 ? 96.418 70.067 70.721 1.00 13.72 ? 73 PRO E N 1 +ATOM 15461 C CA . PRO D 1 53 ? 95.549 69.026 71.258 1.00 13.28 ? 73 PRO E CA 1 +ATOM 15462 C C . PRO D 1 53 ? 94.072 69.331 71.072 1.00 12.82 ? 73 PRO E C 1 +ATOM 15463 O O . PRO D 1 53 ? 93.657 70.490 71.137 1.00 12.43 ? 73 PRO E O 1 +ATOM 15464 C CB . PRO D 1 53 ? 95.900 69.000 72.752 1.00 13.13 ? 73 PRO E CB 1 +ATOM 15465 C CG . PRO D 1 53 ? 97.313 69.479 72.814 1.00 14.04 ? 73 PRO E CG 1 +ATOM 15466 C CD . PRO D 1 53 ? 97.446 70.480 71.698 1.00 13.94 ? 73 PRO E CD 1 +ATOM 15467 N N . THR D 1 54 ? 93.294 68.286 70.830 1.00 12.23 ? 74 THR E N 1 +ATOM 15468 C CA . THR D 1 54 ? 91.841 68.392 70.785 1.00 11.85 ? 74 THR E CA 1 +ATOM 15469 C C . THR D 1 54 ? 91.239 67.274 71.614 1.00 10.94 ? 74 THR E C 1 +ATOM 15470 O O . THR D 1 54 ? 91.936 66.325 71.974 1.00 10.50 ? 74 THR E O 1 +ATOM 15471 C CB . THR D 1 54 ? 91.309 68.267 69.351 1.00 12.15 ? 74 THR E CB 1 +ATOM 15472 O OG1 . THR D 1 54 ? 91.718 67.008 68.801 1.00 13.28 ? 74 THR E OG1 1 +ATOM 15473 C CG2 . THR D 1 54 ? 91.827 69.411 68.495 1.00 12.39 ? 74 THR E CG2 1 +ATOM 15474 N N . VAL D 1 55 ? 89.951 67.407 71.918 1.00 9.89 ? 75 VAL E N 1 +ATOM 15475 C CA . VAL D 1 55 ? 89.172 66.360 72.595 1.00 9.57 ? 75 VAL E CA 1 +ATOM 15476 C C . VAL D 1 55 ? 87.866 66.118 71.839 1.00 8.81 ? 75 VAL E C 1 +ATOM 15477 O O . VAL D 1 55 ? 87.453 66.954 71.026 1.00 8.78 ? 75 VAL E O 1 +ATOM 15478 C CB . VAL D 1 55 ? 88.852 66.729 74.080 1.00 9.02 ? 75 VAL E CB 1 +ATOM 15479 C CG1 . VAL D 1 55 ? 90.141 66.949 74.880 1.00 10.26 ? 75 VAL E CG1 1 +ATOM 15480 C CG2 . VAL D 1 55 ? 87.932 67.947 74.174 1.00 10.17 ? 75 VAL E CG2 1 +ATOM 15481 N N . ASP D 1 56 ? 87.235 64.966 72.084 1.00 8.88 ? 76 ASP E N 1 +ATOM 15482 C CA . ASP D 1 56 ? 85.921 64.677 71.536 1.00 8.24 ? 76 ASP E CA 1 +ATOM 15483 C C . ASP D 1 56 ? 84.900 65.474 72.288 1.00 8.25 ? 76 ASP E C 1 +ATOM 15484 O O . ASP D 1 56 ? 85.003 65.618 73.496 1.00 8.76 ? 76 ASP E O 1 +ATOM 15485 C CB . ASP D 1 56 ? 85.552 63.197 71.686 1.00 8.83 ? 76 ASP E CB 1 +ATOM 15486 C CG . ASP D 1 56 ? 86.384 62.294 70.809 1.00 9.90 ? 76 ASP E CG 1 +ATOM 15487 O OD1 . ASP D 1 56 ? 86.768 62.718 69.693 1.00 11.16 ? 76 ASP E OD1 1 +ATOM 15488 O OD2 . ASP D 1 56 ? 86.638 61.141 71.238 1.00 15.07 ? 76 ASP E OD2 1 +ATOM 15489 N N . MET D 1 57 ? 83.918 66.011 71.570 1.00 7.84 ? 77 MET E N 1 +ATOM 15490 C CA . MET D 1 57 ? 82.772 66.649 72.209 1.00 7.91 ? 77 MET E CA 1 +ATOM 15491 C C . MET D 1 57 ? 81.548 66.215 71.446 1.00 7.93 ? 77 MET E C 1 +ATOM 15492 O O . MET D 1 57 ? 81.475 66.423 70.233 1.00 9.52 ? 77 MET E O 1 +ATOM 15493 C CB . MET D 1 57 ? 82.879 68.177 72.167 1.00 7.72 ? 77 MET E CB 1 +ATOM 15494 C CG . MET D 1 57 ? 81.834 68.909 72.999 1.00 7.43 ? 77 MET E CG 1 +ATOM 15495 S SD . MET D 1 57 ? 81.986 68.576 74.766 1.00 8.90 ? 77 MET E SD 1 +ATOM 15496 C CE . MET D 1 57 ? 83.687 69.028 75.056 1.00 9.44 ? 77 MET E CE 1 +ATOM 15497 N N . PRO D 1 58 ? 80.569 65.642 72.153 1.00 8.15 ? 78 PRO E N 1 +ATOM 15498 C CA . PRO D 1 58 ? 79.345 65.155 71.534 1.00 8.31 ? 78 PRO E CA 1 +ATOM 15499 C C . PRO D 1 58 ? 78.478 66.314 71.101 1.00 8.26 ? 78 PRO E C 1 +ATOM 15500 O O . PRO D 1 58 ? 78.492 67.349 71.755 1.00 6.93 ? 78 PRO E O 1 +ATOM 15501 C CB . PRO D 1 58 ? 78.675 64.383 72.666 1.00 8.56 ? 78 PRO E CB 1 +ATOM 15502 C CG . PRO D 1 58 ? 79.119 65.062 73.890 1.00 7.52 ? 78 PRO E CG 1 +ATOM 15503 C CD . PRO D 1 58 ? 80.539 65.480 73.615 1.00 8.22 ? 78 PRO E CD 1 +ATOM 15504 N N . VAL D 1 59 ? 77.763 66.131 69.991 1.00 8.53 ? 79 VAL E N 1 +ATOM 15505 C CA . VAL D 1 59 ? 76.790 67.091 69.486 1.00 8.80 ? 79 VAL E CA 1 +ATOM 15506 C C . VAL D 1 59 ? 75.518 66.309 69.109 1.00 9.52 ? 79 VAL E C 1 +ATOM 15507 O O . VAL D 1 59 ? 75.591 65.319 68.371 1.00 8.99 ? 79 VAL E O 1 +ATOM 15508 C CB . VAL D 1 59 ? 77.316 67.857 68.251 1.00 9.37 ? 79 VAL E CB 1 +ATOM 15509 C CG1 . VAL D 1 59 ? 76.239 68.792 67.685 1.00 10.36 ? 79 VAL E CG1 1 +ATOM 15510 C CG2 . VAL D 1 59 ? 78.584 68.670 68.583 1.00 9.44 ? 79 VAL E CG2 1 +ATOM 15511 N N . PRO D 1 60 ? 74.351 66.747 69.593 1.00 9.26 ? 80 PRO E N 1 +ATOM 15512 C CA . PRO D 1 60 ? 74.102 67.891 70.466 1.00 8.97 ? 80 PRO E CA 1 +ATOM 15513 C C . PRO D 1 60 ? 74.409 67.644 71.944 1.00 8.31 ? 80 PRO E C 1 +ATOM 15514 O O . PRO D 1 60 ? 74.188 66.546 72.455 1.00 8.14 ? 80 PRO E O 1 +ATOM 15515 C CB . PRO D 1 60 ? 72.612 68.170 70.252 1.00 9.54 ? 80 PRO E CB 1 +ATOM 15516 C CG . PRO D 1 60 ? 72.034 66.836 69.886 1.00 9.37 ? 80 PRO E CG 1 +ATOM 15517 C CD . PRO D 1 60 ? 73.101 66.076 69.182 1.00 9.43 ? 80 PRO E CD 1 +ATOM 15518 N N . SER D 1 61 ? 74.917 68.685 72.607 1.00 7.74 ? 81 SER E N 1 +ATOM 15519 C CA . SER D 1 61 ? 75.220 68.671 74.028 1.00 7.10 ? 81 SER E CA 1 +ATOM 15520 C C . SER D 1 61 ? 75.740 70.045 74.415 1.00 6.25 ? 81 SER E C 1 +ATOM 15521 O O . SER D 1 61 ? 76.307 70.749 73.582 1.00 7.51 ? 81 SER E O 1 +ATOM 15522 C CB . SER D 1 61 ? 76.342 67.700 74.351 1.00 7.23 ? 81 SER E CB 1 +ATOM 15523 O OG . SER D 1 61 ? 76.505 67.552 75.752 1.00 6.60 ? 81 SER E OG 1 +ATOM 15524 N N . SER D 1 62 ? 75.616 70.379 75.681 1.00 6.36 ? 82 SER E N 1 +ATOM 15525 C CA . SER D 1 62 ? 76.423 71.465 76.241 1.00 6.11 ? 82 SER E CA 1 +ATOM 15526 C C . SER D 1 62 ? 77.799 70.854 76.530 1.00 6.22 ? 82 SER E C 1 +ATOM 15527 O O . SER D 1 62 ? 77.903 69.662 76.848 1.00 7.64 ? 82 SER E O 1 +ATOM 15528 C CB . SER D 1 62 ? 75.814 72.036 77.523 1.00 5.69 ? 82 SER E CB 1 +ATOM 15529 O OG . SER D 1 62 ? 74.463 72.456 77.334 1.00 5.27 ? 82 SER E OG 1 +ATOM 15530 N N . PHE D 1 63 ? 78.855 71.644 76.442 1.00 6.67 ? 83 PHE E N 1 +ATOM 15531 C CA . PHE D 1 63 ? 80.196 71.116 76.756 1.00 6.17 ? 83 PHE E CA 1 +ATOM 15532 C C . PHE D 1 63 ? 80.524 71.129 78.244 1.00 6.11 ? 83 PHE E C 1 +ATOM 15533 O O . PHE D 1 63 ? 81.519 70.526 78.678 1.00 6.88 ? 83 PHE E O 1 +ATOM 15534 C CB . PHE D 1 63 ? 81.283 71.879 75.972 1.00 5.94 ? 83 PHE E CB 1 +ATOM 15535 C CG . PHE D 1 63 ? 81.398 73.344 76.309 1.00 6.13 ? 83 PHE E CG 1 +ATOM 15536 C CD1 . PHE D 1 63 ? 81.973 73.777 77.505 1.00 7.00 ? 83 PHE E CD1 1 +ATOM 15537 C CD2 . PHE D 1 63 ? 80.979 74.301 75.408 1.00 6.73 ? 83 PHE E CD2 1 +ATOM 15538 C CE1 . PHE D 1 63 ? 82.098 75.138 77.794 1.00 6.18 ? 83 PHE E CE1 1 +ATOM 15539 C CE2 . PHE D 1 63 ? 81.087 75.655 75.706 1.00 4.57 ? 83 PHE E CE2 1 +ATOM 15540 C CZ . PHE D 1 63 ? 81.653 76.061 76.903 1.00 4.92 ? 83 PHE E CZ 1 +ATOM 15541 N N . ASN D 1 64 ? 79.710 71.815 79.042 1.00 6.24 ? 84 ASN E N 1 +ATOM 15542 C CA . ASN D 1 64 ? 80.176 72.229 80.361 1.00 6.42 ? 84 ASN E CA 1 +ATOM 15543 C C . ASN D 1 64 ? 80.360 71.127 81.365 1.00 6.80 ? 84 ASN E C 1 +ATOM 15544 O O . ASN D 1 64 ? 81.220 71.263 82.233 1.00 7.86 ? 84 ASN E O 1 +ATOM 15545 C CB . ASN D 1 64 ? 79.299 73.325 80.993 1.00 6.21 ? 84 ASN E CB 1 +ATOM 15546 C CG . ASN D 1 64 ? 79.033 74.476 80.058 1.00 6.09 ? 84 ASN E CG 1 +ATOM 15547 O OD1 . ASN D 1 64 ? 78.332 74.313 79.054 1.00 4.10 ? 84 ASN E OD1 1 +ATOM 15548 N ND2 . ASN D 1 64 ? 79.538 75.670 80.404 1.00 5.69 ? 84 ASN E ND2 1 +ATOM 15549 N N . ASP D 1 65 ? 79.561 70.060 81.260 1.00 6.86 ? 85 ASP E N 1 +ATOM 15550 C CA . ASP D 1 65 ? 79.606 68.958 82.223 1.00 7.47 ? 85 ASP E CA 1 +ATOM 15551 C C . ASP D 1 65 ? 80.173 67.659 81.644 1.00 7.74 ? 85 ASP E C 1 +ATOM 15552 O O . ASP D 1 65 ? 80.129 66.611 82.317 1.00 7.22 ? 85 ASP E O 1 +ATOM 15553 C CB . ASP D 1 65 ? 78.202 68.705 82.792 1.00 7.72 ? 85 ASP E CB 1 +ATOM 15554 C CG . ASP D 1 65 ? 77.732 69.802 83.749 1.00 8.17 ? 85 ASP E CG 1 +ATOM 15555 O OD1 . ASP D 1 65 ? 78.575 70.516 84.309 1.00 7.34 ? 85 ASP E OD1 1 +ATOM 15556 O OD2 . ASP D 1 65 ? 76.496 69.906 83.965 1.00 8.21 ? 85 ASP E OD2 1 +ATOM 15557 N N . ILE D 1 66 ? 80.723 67.719 80.425 1.00 8.23 ? 86 ILE E N 1 +ATOM 15558 C CA . ILE D 1 66 ? 81.214 66.513 79.738 1.00 8.51 ? 86 ILE E CA 1 +ATOM 15559 C C . ILE D 1 66 ? 82.595 66.079 80.248 1.00 8.91 ? 86 ILE E C 1 +ATOM 15560 O O . ILE D 1 66 ? 82.916 64.884 80.289 1.00 8.49 ? 86 ILE E O 1 +ATOM 15561 C CB . ILE D 1 66 ? 81.316 66.757 78.214 1.00 8.26 ? 86 ILE E CB 1 +ATOM 15562 C CG1 . ILE D 1 66 ? 79.923 66.990 77.628 1.00 8.55 ? 86 ILE E CG1 1 +ATOM 15563 C CG2 . ILE D 1 66 ? 81.988 65.555 77.511 1.00 9.51 ? 86 ILE E CG2 1 +ATOM 15564 C CD1 . ILE D 1 66 ? 79.015 65.751 77.662 1.00 11.33 ? 86 ILE E CD1 1 +ATOM 15565 N N . SER D 1 67 ? 83.415 67.054 80.621 1.00 8.79 ? 87 SER E N 1 +ATOM 15566 C CA . SER D 1 67 ? 84.798 66.767 81.016 1.00 9.61 ? 87 SER E CA 1 +ATOM 15567 C C . SER D 1 67 ? 85.007 66.795 82.525 1.00 9.47 ? 87 SER E C 1 +ATOM 15568 O O . SER D 1 67 ? 84.106 67.161 83.296 1.00 9.02 ? 87 SER E O 1 +ATOM 15569 C CB . SER D 1 67 ? 85.748 67.759 80.356 1.00 9.40 ? 87 SER E CB 1 +ATOM 15570 O OG . SER D 1 67 ? 85.933 68.892 81.168 1.00 11.46 ? 87 SER E OG 1 +ATOM 15571 N N . GLN D 1 68 ? 86.203 66.376 82.934 1.00 10.23 ? 88 GLN E N 1 +ATOM 15572 C CA . GLN D 1 68 ? 86.655 66.537 84.314 1.00 11.24 ? 88 GLN E CA 1 +ATOM 15573 C C . GLN D 1 68 ? 87.650 67.695 84.452 1.00 12.63 ? 88 GLN E C 1 +ATOM 15574 O O . GLN D 1 68 ? 88.289 67.851 85.496 1.00 12.74 ? 88 GLN E O 1 +ATOM 15575 C CB . GLN D 1 68 ? 87.299 65.253 84.826 1.00 11.29 ? 88 GLN E CB 1 +ATOM 15576 C CG . GLN D 1 68 ? 86.472 64.005 84.626 1.00 9.93 ? 88 GLN E CG 1 +ATOM 15577 C CD . GLN D 1 68 ? 84.995 64.203 84.923 1.00 8.72 ? 88 GLN E CD 1 +ATOM 15578 O OE1 . GLN D 1 68 ? 84.159 64.051 84.039 1.00 8.27 ? 88 GLN E OE1 1 +ATOM 15579 N NE2 . GLN D 1 68 ? 84.667 64.537 86.168 1.00 8.81 ? 88 GLN E NE2 1 +ATOM 15580 N N . ASP D 1 69 ? 87.795 68.486 83.392 1.00 13.69 ? 89 ASP E N 1 +ATOM 15581 C CA . ASP D 1 69 ? 88.677 69.645 83.435 1.00 15.03 ? 89 ASP E CA 1 +ATOM 15582 C C . ASP D 1 69 ? 88.024 70.733 84.276 1.00 15.26 ? 89 ASP E C 1 +ATOM 15583 O O . ASP D 1 69 ? 86.958 71.230 83.935 1.00 15.07 ? 89 ASP E O 1 +ATOM 15584 C CB . ASP D 1 69 ? 88.939 70.175 82.030 1.00 15.08 ? 89 ASP E CB 1 +ATOM 15585 C CG . ASP D 1 69 ? 90.081 71.168 81.994 1.00 17.55 ? 89 ASP E CG 1 +ATOM 15586 O OD1 . ASP D 1 69 ? 90.214 71.968 82.941 1.00 20.35 ? 89 ASP E OD1 1 +ATOM 15587 O OD2 . ASP D 1 69 ? 90.844 71.152 81.015 1.00 20.72 ? 89 ASP E OD2 1 +ATOM 15588 N N . TRP D 1 70 ? 88.673 71.115 85.370 1.00 16.38 ? 90 TRP E N 1 +ATOM 15589 C CA . TRP D 1 70 ? 88.100 72.122 86.279 1.00 16.77 ? 90 TRP E CA 1 +ATOM 15590 C C . TRP D 1 70 ? 87.887 73.496 85.607 1.00 16.61 ? 90 TRP E C 1 +ATOM 15591 O O . TRP D 1 70 ? 87.103 74.293 86.096 1.00 17.37 ? 90 TRP E O 1 +ATOM 15592 C CB . TRP D 1 70 ? 88.978 72.288 87.526 1.00 17.47 ? 90 TRP E CB 1 +ATOM 15593 C CG . TRP D 1 70 ? 88.914 71.142 88.515 1.00 17.92 ? 90 TRP E CG 1 +ATOM 15594 C CD1 . TRP D 1 70 ? 88.805 69.805 88.230 1.00 18.21 ? 90 TRP E CD1 1 +ATOM 15595 C CD2 . TRP D 1 70 ? 88.983 71.240 89.947 1.00 18.17 ? 90 TRP E CD2 1 +ATOM 15596 N NE1 . TRP D 1 70 ? 88.779 69.072 89.402 1.00 18.11 ? 90 TRP E NE1 1 +ATOM 15597 C CE2 . TRP D 1 70 ? 88.896 69.927 90.465 1.00 18.86 ? 90 TRP E CE2 1 +ATOM 15598 C CE3 . TRP D 1 70 ? 89.096 72.311 90.842 1.00 18.72 ? 90 TRP E CE3 1 +ATOM 15599 C CZ2 . TRP D 1 70 ? 88.930 69.661 91.840 1.00 18.94 ? 90 TRP E CZ2 1 +ATOM 15600 C CZ3 . TRP D 1 70 ? 89.123 72.050 92.200 1.00 18.90 ? 90 TRP E CZ3 1 +ATOM 15601 C CH2 . TRP D 1 70 ? 89.046 70.738 92.688 1.00 18.90 ? 90 TRP E CH2 1 +ATOM 15602 N N . ARG D 1 71 ? 88.583 73.757 84.498 1.00 16.01 ? 91 ARG E N 1 +ATOM 15603 C CA . ARG D 1 71 ? 88.556 75.062 83.813 1.00 15.38 ? 91 ARG E CA 1 +ATOM 15604 C C . ARG D 1 71 ? 87.387 75.245 82.853 1.00 13.62 ? 91 ARG E C 1 +ATOM 15605 O O . ARG D 1 71 ? 87.034 76.369 82.497 1.00 13.10 ? 91 ARG E O 1 +ATOM 15606 C CB . ARG D 1 71 ? 89.820 75.230 82.964 1.00 15.13 ? 91 ARG E CB 1 +ATOM 15607 C CG . ARG D 1 71 ? 91.149 75.166 83.702 1.00 16.93 ? 91 ARG E CG 1 +ATOM 15608 C CD . ARG D 1 71 ? 92.306 75.217 82.686 1.00 17.99 ? 91 ARG E CD 1 +ATOM 15609 N NE . ARG D 1 71 ? 92.382 73.986 81.882 1.00 19.66 ? 91 ARG E NE 1 +ATOM 15610 C CZ . ARG D 1 71 ? 93.197 73.797 80.839 1.00 20.78 ? 91 ARG E CZ 1 +ATOM 15611 N NH1 . ARG D 1 71 ? 94.036 74.743 80.445 1.00 21.33 ? 91 ARG E NH1 1 +ATOM 15612 N NH2 . ARG D 1 71 ? 93.179 72.643 80.186 1.00 21.22 ? 91 ARG E NH2 1 +ATOM 15613 N N . LEU D 1 72 ? 86.830 74.140 82.387 1.00 12.05 ? 92 LEU E N 1 +ATOM 15614 C CA . LEU D 1 72 ? 85.926 74.184 81.253 1.00 10.79 ? 92 LEU E CA 1 +ATOM 15615 C C . LEU D 1 72 ? 84.515 74.581 81.645 1.00 10.57 ? 92 LEU E C 1 +ATOM 15616 O O . LEU D 1 72 ? 83.895 75.377 80.940 1.00 9.63 ? 92 LEU E O 1 +ATOM 15617 C CB . LEU D 1 72 ? 85.912 72.848 80.516 1.00 10.98 ? 92 LEU E CB 1 +ATOM 15618 C CG . LEU D 1 72 ? 85.209 72.827 79.164 1.00 10.09 ? 92 LEU E CG 1 +ATOM 15619 C CD1 . LEU D 1 72 ? 85.677 73.971 78.230 1.00 9.48 ? 92 LEU E CD1 1 +ATOM 15620 C CD2 . LEU D 1 72 ? 85.424 71.474 78.515 1.00 10.19 ? 92 LEU E CD2 1 +ATOM 15621 N N . ARG D 1 73 ? 83.996 74.028 82.749 1.00 9.66 ? 93 ARG E N 1 +ATOM 15622 C CA . ARG D 1 73 ? 82.581 74.253 83.086 1.00 9.03 ? 93 ARG E CA 1 +ATOM 15623 C C . ARG D 1 73 ? 82.249 75.744 83.126 1.00 9.08 ? 93 ARG E C 1 +ATOM 15624 O O . ARG D 1 73 ? 81.233 76.181 82.582 1.00 9.33 ? 93 ARG E O 1 +ATOM 15625 C CB . ARG D 1 73 ? 82.223 73.617 84.423 1.00 9.00 ? 93 ARG E CB 1 +ATOM 15626 C CG . ARG D 1 73 ? 80.745 73.677 84.792 1.00 10.82 ? 93 ARG E CG 1 +ATOM 15627 C CD . ARG D 1 73 ? 80.490 72.805 86.025 1.00 12.00 ? 93 ARG E CD 1 +ATOM 15628 N NE . ARG D 1 73 ? 79.061 72.612 86.262 1.00 13.94 ? 93 ARG E NE 1 +ATOM 15629 C CZ . ARG D 1 73 ? 78.262 73.510 86.837 1.00 12.91 ? 93 ARG E CZ 1 +ATOM 15630 N NH1 . ARG D 1 73 ? 78.732 74.676 87.266 1.00 11.96 ? 93 ARG E NH1 1 +ATOM 15631 N NH2 . ARG D 1 73 ? 76.980 73.225 87.009 1.00 14.97 ? 93 ARG E NH2 1 +ATOM 15632 N N . HIS D 1 74 ? 83.122 76.520 83.753 1.00 8.58 ? 94 HIS E N 1 +ATOM 15633 C CA . HIS D 1 74 ? 82.892 77.939 83.947 1.00 9.02 ? 94 HIS E CA 1 +ATOM 15634 C C . HIS D 1 74 ? 83.649 78.824 82.951 1.00 9.09 ? 94 HIS E C 1 +ATOM 15635 O O . HIS D 1 74 ? 83.736 80.034 83.145 1.00 8.58 ? 94 HIS E O 1 +ATOM 15636 C CB . HIS D 1 74 ? 83.264 78.292 85.376 1.00 9.78 ? 94 HIS E CB 1 +ATOM 15637 C CG . HIS D 1 74 ? 82.495 77.516 86.395 1.00 9.73 ? 94 HIS E CG 1 +ATOM 15638 N ND1 . HIS D 1 74 ? 83.041 76.478 87.113 1.00 11.94 ? 94 HIS E ND1 1 +ATOM 15639 C CD2 . HIS D 1 74 ? 81.207 77.620 86.802 1.00 12.27 ? 94 HIS E CD2 1 +ATOM 15640 C CE1 . HIS D 1 74 ? 82.122 75.976 87.921 1.00 13.19 ? 94 HIS E CE1 1 +ATOM 15641 N NE2 . HIS D 1 74 ? 81.005 76.661 87.760 1.00 12.58 ? 94 HIS E NE2 1 +ATOM 15642 N N . PHE D 1 75 ? 84.146 78.215 81.875 1.00 8.72 ? 95 PHE E N 1 +ATOM 15643 C CA . PHE D 1 75 ? 84.893 78.939 80.837 1.00 9.32 ? 95 PHE E CA 1 +ATOM 15644 C C . PHE D 1 75 ? 84.060 80.044 80.137 1.00 8.83 ? 95 PHE E C 1 +ATOM 15645 O O . PHE D 1 75 ? 82.892 79.843 79.759 1.00 9.28 ? 95 PHE E O 1 +ATOM 15646 C CB . PHE D 1 75 ? 85.423 77.942 79.802 1.00 9.37 ? 95 PHE E CB 1 +ATOM 15647 C CG . PHE D 1 75 ? 86.030 78.594 78.586 1.00 9.43 ? 95 PHE E CG 1 +ATOM 15648 C CD1 . PHE D 1 75 ? 87.327 79.073 78.625 1.00 10.72 ? 95 PHE E CD1 1 +ATOM 15649 C CD2 . PHE D 1 75 ? 85.310 78.708 77.403 1.00 10.11 ? 95 PHE E CD2 1 +ATOM 15650 C CE1 . PHE D 1 75 ? 87.890 79.667 77.517 1.00 9.98 ? 95 PHE E CE1 1 +ATOM 15651 C CE2 . PHE D 1 75 ? 85.873 79.308 76.291 1.00 9.79 ? 95 PHE E CE2 1 +ATOM 15652 C CZ . PHE D 1 75 ? 87.167 79.792 76.358 1.00 9.49 ? 95 PHE E CZ 1 +ATOM 15653 N N . VAL D 1 76 ? 84.686 81.210 79.961 1.00 8.90 ? 96 VAL E N 1 +ATOM 15654 C CA . VAL D 1 76 ? 84.098 82.312 79.229 1.00 8.35 ? 96 VAL E CA 1 +ATOM 15655 C C . VAL D 1 76 ? 85.054 82.662 78.100 1.00 8.80 ? 96 VAL E C 1 +ATOM 15656 O O . VAL D 1 76 ? 86.224 82.964 78.359 1.00 8.75 ? 96 VAL E O 1 +ATOM 15657 C CB . VAL D 1 76 ? 83.907 83.546 80.110 1.00 8.69 ? 96 VAL E CB 1 +ATOM 15658 C CG1 . VAL D 1 76 ? 83.325 84.681 79.292 1.00 8.72 ? 96 VAL E CG1 1 +ATOM 15659 C CG2 . VAL D 1 76 ? 83.004 83.221 81.301 1.00 7.44 ? 96 VAL E CG2 1 +ATOM 15660 N N . GLY D 1 77 ? 84.564 82.613 76.865 1.00 8.68 ? 97 GLY E N 1 +ATOM 15661 C CA . GLY D 1 77 ? 85.406 82.855 75.692 1.00 8.84 ? 97 GLY E CA 1 +ATOM 15662 C C . GLY D 1 77 ? 84.914 82.088 74.490 1.00 8.24 ? 97 GLY E C 1 +ATOM 15663 O O . GLY D 1 77 ? 83.711 81.852 74.352 1.00 8.45 ? 97 GLY E O 1 +ATOM 15664 N N . TRP D 1 78 ? 85.844 81.736 73.609 1.00 8.62 ? 98 TRP E N 1 +ATOM 15665 C CA . TRP D 1 78 ? 85.552 80.995 72.384 1.00 7.98 ? 98 TRP E CA 1 +ATOM 15666 C C . TRP D 1 78 ? 85.898 79.511 72.548 1.00 8.32 ? 98 TRP E C 1 +ATOM 15667 O O . TRP D 1 78 ? 86.999 79.175 73.005 1.00 7.15 ? 98 TRP E O 1 +ATOM 15668 C CB . TRP D 1 78 ? 86.404 81.515 71.224 1.00 8.22 ? 98 TRP E CB 1 +ATOM 15669 C CG . TRP D 1 78 ? 86.108 82.885 70.735 1.00 8.34 ? 98 TRP E CG 1 +ATOM 15670 C CD1 . TRP D 1 78 ? 86.751 84.031 71.091 1.00 8.83 ? 98 TRP E CD1 1 +ATOM 15671 C CD2 . TRP D 1 78 ? 85.139 83.256 69.761 1.00 8.59 ? 98 TRP E CD2 1 +ATOM 15672 N NE1 . TRP D 1 78 ? 86.243 85.102 70.411 1.00 9.13 ? 98 TRP E NE1 1 +ATOM 15673 C CE2 . TRP D 1 78 ? 85.238 84.662 69.591 1.00 9.33 ? 98 TRP E CE2 1 +ATOM 15674 C CE3 . TRP D 1 78 ? 84.186 82.554 69.024 1.00 8.26 ? 98 TRP E CE3 1 +ATOM 15675 C CZ2 . TRP D 1 78 ? 84.430 85.364 68.701 1.00 9.70 ? 98 TRP E CZ2 1 +ATOM 15676 C CZ3 . TRP D 1 78 ? 83.378 83.257 68.148 1.00 9.20 ? 98 TRP E CZ3 1 +ATOM 15677 C CH2 . TRP D 1 78 ? 83.499 84.645 67.999 1.00 8.25 ? 98 TRP E CH2 1 +ATOM 15678 N N . VAL D 1 79 ? 84.957 78.642 72.196 1.00 8.10 ? 99 VAL E N 1 +ATOM 15679 C CA . VAL D 1 79 ? 85.254 77.213 71.996 1.00 8.15 ? 99 VAL E CA 1 +ATOM 15680 C C . VAL D 1 79 ? 85.187 76.925 70.509 1.00 8.36 ? 99 VAL E C 1 +ATOM 15681 O O . VAL D 1 79 ? 84.382 77.522 69.781 1.00 9.43 ? 99 VAL E O 1 +ATOM 15682 C CB . VAL D 1 79 ? 84.296 76.261 72.766 1.00 8.21 ? 99 VAL E CB 1 +ATOM 15683 C CG1 . VAL D 1 79 ? 84.402 76.500 74.239 1.00 8.25 ? 99 VAL E CG1 1 +ATOM 15684 C CG2 . VAL D 1 79 ? 82.870 76.431 72.306 1.00 9.11 ? 99 VAL E CG2 1 +ATOM 15685 N N . TRP D 1 80 ? 86.032 76.009 70.061 1.00 8.30 ? 100 TRP E N 1 +ATOM 15686 C CA . TRP D 1 80 ? 86.142 75.658 68.658 1.00 8.04 ? 100 TRP E CA 1 +ATOM 15687 C C . TRP D 1 80 ? 85.719 74.205 68.458 1.00 8.42 ? 100 TRP E C 1 +ATOM 15688 O O . TRP D 1 80 ? 86.211 73.323 69.159 1.00 8.38 ? 100 TRP E O 1 +ATOM 15689 C CB . TRP D 1 80 ? 87.586 75.847 68.188 1.00 7.83 ? 100 TRP E CB 1 +ATOM 15690 C CG . TRP D 1 80 ? 88.004 77.268 68.224 1.00 7.55 ? 100 TRP E CG 1 +ATOM 15691 C CD1 . TRP D 1 80 ? 88.219 78.029 69.333 1.00 8.78 ? 100 TRP E CD1 1 +ATOM 15692 C CD2 . TRP D 1 80 ? 88.242 78.120 67.101 1.00 8.63 ? 100 TRP E CD2 1 +ATOM 15693 N NE1 . TRP D 1 80 ? 88.586 79.300 68.972 1.00 8.26 ? 100 TRP E NE1 1 +ATOM 15694 C CE2 . TRP D 1 80 ? 88.616 79.381 67.605 1.00 8.03 ? 100 TRP E CE2 1 +ATOM 15695 C CE3 . TRP D 1 80 ? 88.195 77.935 65.717 1.00 8.86 ? 100 TRP E CE3 1 +ATOM 15696 C CZ2 . TRP D 1 80 ? 88.910 80.453 66.774 1.00 8.36 ? 100 TRP E CZ2 1 +ATOM 15697 C CZ3 . TRP D 1 80 ? 88.505 78.995 64.894 1.00 8.65 ? 100 TRP E CZ3 1 +ATOM 15698 C CH2 . TRP D 1 80 ? 88.863 80.232 65.423 1.00 8.30 ? 100 TRP E CH2 1 +ATOM 15699 N N . TYR D 1 81 ? 84.802 73.989 67.515 1.00 8.30 ? 101 TYR E N 1 +ATOM 15700 C CA . TYR D 1 81 ? 84.313 72.671 67.127 1.00 8.26 ? 101 TYR E CA 1 +ATOM 15701 C C . TYR D 1 81 ? 84.686 72.402 65.675 1.00 8.69 ? 101 TYR E C 1 +ATOM 15702 O O . TYR D 1 81 ? 84.706 73.325 64.849 1.00 8.83 ? 101 TYR E O 1 +ATOM 15703 C CB . TYR D 1 81 ? 82.792 72.629 67.177 1.00 7.70 ? 101 TYR E CB 1 +ATOM 15704 C CG . TYR D 1 81 ? 82.152 72.469 68.524 1.00 8.30 ? 101 TYR E CG 1 +ATOM 15705 C CD1 . TYR D 1 81 ? 81.695 71.219 68.961 1.00 8.17 ? 101 TYR E CD1 1 +ATOM 15706 C CD2 . TYR D 1 81 ? 81.911 73.577 69.327 1.00 8.36 ? 101 TYR E CD2 1 +ATOM 15707 C CE1 . TYR D 1 81 ? 81.068 71.087 70.195 1.00 6.49 ? 101 TYR E CE1 1 +ATOM 15708 C CE2 . TYR D 1 81 ? 81.282 73.463 70.539 1.00 7.80 ? 101 TYR E CE2 1 +ATOM 15709 C CZ . TYR D 1 81 ? 80.842 72.223 70.970 1.00 6.72 ? 101 TYR E CZ 1 +ATOM 15710 O OH . TYR D 1 81 ? 80.211 72.160 72.196 1.00 8.46 ? 101 TYR E OH 1 +ATOM 15711 N N . GLU D 1 82 ? 84.921 71.139 65.340 1.00 9.07 ? 102 GLU E N 1 +ATOM 15712 C CA . GLU D 1 82 ? 85.146 70.772 63.957 1.00 10.13 ? 102 GLU E CA 1 +ATOM 15713 C C . GLU D 1 82 ? 84.701 69.338 63.639 1.00 10.85 ? 102 GLU E C 1 +ATOM 15714 O O . GLU D 1 82 ? 84.885 68.420 64.444 1.00 11.07 ? 102 GLU E O 1 +ATOM 15715 C CB . GLU D 1 82 ? 86.610 70.940 63.594 1.00 9.81 ? 102 GLU E CB 1 +ATOM 15716 C CG . GLU D 1 82 ? 86.903 70.821 62.103 1.00 9.83 ? 102 GLU E CG 1 +ATOM 15717 C CD . GLU D 1 82 ? 88.308 71.260 61.796 1.00 11.73 ? 102 GLU E CD 1 +ATOM 15718 O OE1 . GLU D 1 82 ? 88.505 72.485 61.586 1.00 12.52 ? 102 GLU E OE1 1 +ATOM 15719 O OE2 . GLU D 1 82 ? 89.222 70.406 61.848 1.00 12.42 ? 102 GLU E OE2 1 +ATOM 15720 N N . ARG D 1 83 ? 84.104 69.193 62.463 1.00 12.44 ? 103 ARG E N 1 +ATOM 15721 C CA . ARG D 1 83 ? 83.661 67.910 61.919 1.00 14.49 ? 103 ARG E CA 1 +ATOM 15722 C C . ARG D 1 83 ? 84.097 67.818 60.455 1.00 14.99 ? 103 ARG E C 1 +ATOM 15723 O O . ARG D 1 83 ? 84.013 68.798 59.721 1.00 14.99 ? 103 ARG E O 1 +ATOM 15724 C CB . ARG D 1 83 ? 82.128 67.854 62.003 1.00 14.76 ? 103 ARG E CB 1 +ATOM 15725 C CG . ARG D 1 83 ? 81.455 66.670 61.345 1.00 17.95 ? 103 ARG E CG 1 +ATOM 15726 C CD . ARG D 1 83 ? 81.537 65.405 62.174 1.00 21.10 ? 103 ARG E CD 1 +ATOM 15727 N NE . ARG D 1 83 ? 80.431 64.532 61.800 1.00 22.85 ? 103 ARG E NE 1 +ATOM 15728 C CZ . ARG D 1 83 ? 79.502 64.061 62.626 1.00 23.38 ? 103 ARG E CZ 1 +ATOM 15729 N NH1 . ARG D 1 83 ? 79.515 64.321 63.934 1.00 24.32 ? 103 ARG E NH1 1 +ATOM 15730 N NH2 . ARG D 1 83 ? 78.551 63.300 62.126 1.00 23.37 ? 103 ARG E NH2 1 +ATOM 15731 N N . GLU D 1 84 ? 84.554 66.641 60.024 1.00 16.22 ? 104 GLU E N 1 +ATOM 15732 C CA . GLU D 1 84 ? 84.781 66.405 58.604 1.00 17.61 ? 104 GLU E CA 1 +ATOM 15733 C C . GLU D 1 84 ? 83.660 65.487 58.076 1.00 17.54 ? 104 GLU E C 1 +ATOM 15734 O O . GLU D 1 84 ? 83.223 64.580 58.778 1.00 18.04 ? 104 GLU E O 1 +ATOM 15735 C CB . GLU D 1 84 ? 86.203 65.865 58.374 1.00 18.11 ? 104 GLU E CB 1 +ATOM 15736 C CG . GLU D 1 84 ? 87.274 66.965 58.540 1.00 19.87 ? 104 GLU E CG 1 +ATOM 15737 C CD . GLU D 1 84 ? 88.713 66.508 58.291 1.00 20.75 ? 104 GLU E CD 1 +ATOM 15738 O OE1 . GLU D 1 84 ? 88.957 65.717 57.349 1.00 26.23 ? 104 GLU E OE1 1 +ATOM 15739 O OE2 . GLU D 1 84 ? 89.613 66.948 59.047 1.00 24.56 ? 104 GLU E OE2 1 +ATOM 15740 N N . VAL D 1 85 ? 83.160 65.773 56.875 1.00 17.72 ? 105 VAL E N 1 +ATOM 15741 C CA . VAL D 1 85 ? 82.014 65.063 56.297 1.00 18.26 ? 105 VAL E CA 1 +ATOM 15742 C C . VAL D 1 85 ? 82.339 64.642 54.875 1.00 18.41 ? 105 VAL E C 1 +ATOM 15743 O O . VAL D 1 85 ? 82.909 65.415 54.118 1.00 18.35 ? 105 VAL E O 1 +ATOM 15744 C CB . VAL D 1 85 ? 80.758 65.973 56.218 1.00 18.38 ? 105 VAL E CB 1 +ATOM 15745 C CG1 . VAL D 1 85 ? 79.514 65.132 55.933 1.00 19.13 ? 105 VAL E CG1 1 +ATOM 15746 C CG2 . VAL D 1 85 ? 80.598 66.791 57.494 1.00 18.51 ? 105 VAL E CG2 1 +ATOM 15747 N N . ILE D 1 86 ? 81.985 63.411 54.516 1.00 18.71 ? 106 ILE E N 1 +ATOM 15748 C CA . ILE D 1 86 ? 82.041 62.970 53.131 1.00 19.33 ? 106 ILE E CA 1 +ATOM 15749 C C . ILE D 1 86 ? 80.636 63.102 52.546 1.00 19.72 ? 106 ILE E C 1 +ATOM 15750 O O . ILE D 1 86 ? 79.721 62.405 52.985 1.00 19.83 ? 106 ILE E O 1 +ATOM 15751 C CB . ILE D 1 86 ? 82.507 61.508 53.032 1.00 19.43 ? 106 ILE E CB 1 +ATOM 15752 C CG1 . ILE D 1 86 ? 83.962 61.387 53.494 1.00 19.02 ? 106 ILE E CG1 1 +ATOM 15753 C CG2 . ILE D 1 86 ? 82.353 60.990 51.615 1.00 19.60 ? 106 ILE E CG2 1 +ATOM 15754 C CD1 . ILE D 1 86 ? 84.484 59.934 53.507 1.00 20.19 ? 106 ILE E CD1 1 +ATOM 15755 N N . LEU D 1 87 ? 80.468 64.005 51.580 1.00 20.06 ? 107 LEU E N 1 +ATOM 15756 C CA . LEU D 1 87 ? 79.148 64.276 51.002 1.00 20.36 ? 107 LEU E CA 1 +ATOM 15757 C C . LEU D 1 87 ? 78.849 63.295 49.878 1.00 20.75 ? 107 LEU E C 1 +ATOM 15758 O O . LEU D 1 87 ? 79.768 62.835 49.199 1.00 20.81 ? 107 LEU E O 1 +ATOM 15759 C CB . LEU D 1 87 ? 79.078 65.690 50.424 1.00 20.40 ? 107 LEU E CB 1 +ATOM 15760 C CG . LEU D 1 87 ? 79.388 66.867 51.341 1.00 21.70 ? 107 LEU E CG 1 +ATOM 15761 C CD1 . LEU D 1 87 ? 79.393 68.166 50.525 1.00 23.04 ? 107 LEU E CD1 1 +ATOM 15762 C CD2 . LEU D 1 87 ? 78.408 66.947 52.489 1.00 22.36 ? 107 LEU E CD2 1 +ATOM 15763 N N . PRO D 1 88 ? 77.559 63.003 49.644 1.00 20.66 ? 108 PRO E N 1 +ATOM 15764 C CA . PRO D 1 88 ? 77.200 62.223 48.466 1.00 21.06 ? 108 PRO E CA 1 +ATOM 15765 C C . PRO D 1 88 ? 77.685 62.885 47.169 1.00 21.64 ? 108 PRO E C 1 +ATOM 15766 O O . PRO D 1 88 ? 77.597 64.107 47.020 1.00 21.39 ? 108 PRO E O 1 +ATOM 15767 C CB . PRO D 1 88 ? 75.669 62.203 48.507 1.00 21.04 ? 108 PRO E CB 1 +ATOM 15768 C CG . PRO D 1 88 ? 75.307 62.490 49.909 1.00 20.53 ? 108 PRO E CG 1 +ATOM 15769 C CD . PRO D 1 88 ? 76.378 63.384 50.440 1.00 20.67 ? 108 PRO E CD 1 +ATOM 15770 N N . GLU D 1 89 ? 78.193 62.065 46.253 1.00 22.54 ? 109 GLU E N 1 +ATOM 15771 C CA . GLU D 1 89 ? 78.701 62.514 44.956 1.00 23.19 ? 109 GLU E CA 1 +ATOM 15772 C C . GLU D 1 89 ? 77.732 63.426 44.190 1.00 22.77 ? 109 GLU E C 1 +ATOM 15773 O O . GLU D 1 89 ? 78.144 64.456 43.649 1.00 21.97 ? 109 GLU E O 1 +ATOM 15774 C CB . GLU D 1 89 ? 79.035 61.280 44.114 1.00 23.52 ? 109 GLU E CB 1 +ATOM 15775 C CG . GLU D 1 89 ? 79.498 61.530 42.694 1.00 24.68 ? 109 GLU E CG 1 +ATOM 15776 C CD . GLU D 1 89 ? 79.832 60.220 42.004 1.00 25.06 ? 109 GLU E CD 1 +ATOM 15777 O OE1 . GLU D 1 89 ? 81.032 59.962 41.761 1.00 28.88 ? 109 GLU E OE1 1 +ATOM 15778 O OE2 . GLU D 1 89 ? 78.895 59.425 41.755 1.00 29.15 ? 109 GLU E OE2 1 +ATOM 15779 N N . ARG D 1 90 ? 76.457 63.039 44.145 1.00 22.39 ? 110 ARG E N 1 +ATOM 15780 C CA . ARG D 1 90 ? 75.436 63.799 43.417 1.00 22.63 ? 110 ARG E CA 1 +ATOM 15781 C C . ARG D 1 90 ? 75.263 65.218 43.954 1.00 22.81 ? 110 ARG E C 1 +ATOM 15782 O O . ARG D 1 90 ? 74.919 66.124 43.191 1.00 23.60 ? 110 ARG E O 1 +ATOM 15783 C CB . ARG D 1 90 ? 74.083 63.072 43.421 1.00 22.50 ? 110 ARG E CB 1 +ATOM 15784 C CG . ARG D 1 90 ? 73.458 62.972 44.794 1.00 22.84 ? 110 ARG E CG 1 +ATOM 15785 C CD . ARG D 1 90 ? 72.101 62.289 44.826 1.00 22.17 ? 110 ARG E CD 1 +ATOM 15786 N NE . ARG D 1 90 ? 71.756 62.036 46.223 1.00 20.82 ? 110 ARG E NE 1 +ATOM 15787 C CZ . ARG D 1 90 ? 72.193 60.987 46.916 1.00 21.01 ? 110 ARG E CZ 1 +ATOM 15788 N NH1 . ARG D 1 90 ? 72.962 60.077 46.341 1.00 19.98 ? 110 ARG E NH1 1 +ATOM 15789 N NH2 . ARG D 1 90 ? 71.868 60.852 48.192 1.00 19.48 ? 110 ARG E NH2 1 +ATOM 15790 N N . TRP D 1 91 ? 75.495 65.424 45.251 1.00 22.85 ? 111 TRP E N 1 +ATOM 15791 C CA . TRP D 1 91 ? 75.436 66.778 45.813 1.00 23.02 ? 111 TRP E CA 1 +ATOM 15792 C C . TRP D 1 91 ? 76.525 67.668 45.223 1.00 23.70 ? 111 TRP E C 1 +ATOM 15793 O O . TRP D 1 91 ? 76.270 68.815 44.852 1.00 23.58 ? 111 TRP E O 1 +ATOM 15794 C CB . TRP D 1 91 ? 75.602 66.766 47.335 1.00 22.74 ? 111 TRP E CB 1 +ATOM 15795 C CG . TRP D 1 91 ? 74.471 66.171 48.100 1.00 21.88 ? 111 TRP E CG 1 +ATOM 15796 C CD1 . TRP D 1 91 ? 73.497 65.341 47.628 1.00 21.85 ? 111 TRP E CD1 1 +ATOM 15797 C CD2 . TRP D 1 91 ? 74.223 66.329 49.498 1.00 21.05 ? 111 TRP E CD2 1 +ATOM 15798 N NE1 . TRP D 1 91 ? 72.647 64.983 48.646 1.00 21.57 ? 111 TRP E NE1 1 +ATOM 15799 C CE2 . TRP D 1 91 ? 73.071 65.577 49.806 1.00 21.26 ? 111 TRP E CE2 1 +ATOM 15800 C CE3 . TRP D 1 91 ? 74.859 67.043 50.520 1.00 21.65 ? 111 TRP E CE3 1 +ATOM 15801 C CZ2 . TRP D 1 91 ? 72.541 65.515 51.093 1.00 21.73 ? 111 TRP E CZ2 1 +ATOM 15802 C CZ3 . TRP D 1 91 ? 74.323 66.988 51.806 1.00 21.96 ? 111 TRP E CZ3 1 +ATOM 15803 C CH2 . TRP D 1 91 ? 73.178 66.226 52.078 1.00 21.75 ? 111 TRP E CH2 1 +ATOM 15804 N N . THR D 1 92 ? 77.734 67.122 45.135 1.00 24.45 ? 112 THR E N 1 +ATOM 15805 C CA . THR D 1 92 ? 78.911 67.890 44.739 1.00 25.13 ? 112 THR E CA 1 +ATOM 15806 C C . THR D 1 92 ? 79.081 68.005 43.220 1.00 25.70 ? 112 THR E C 1 +ATOM 15807 O O . THR D 1 92 ? 79.744 68.930 42.744 1.00 25.84 ? 112 THR E O 1 +ATOM 15808 C CB . THR D 1 92 ? 80.199 67.277 45.343 1.00 25.23 ? 112 THR E CB 1 +ATOM 15809 O OG1 . THR D 1 92 ? 80.433 65.980 44.781 1.00 25.83 ? 112 THR E OG1 1 +ATOM 15810 C CG2 . THR D 1 92 ? 80.079 67.148 46.861 1.00 25.39 ? 112 THR E CG2 1 +ATOM 15811 N N . GLN D 1 93 ? 78.496 67.070 42.470 1.00 26.11 ? 113 GLN E N 1 +ATOM 15812 C CA . GLN D 1 93 ? 78.661 67.021 41.014 1.00 26.60 ? 113 GLN E CA 1 +ATOM 15813 C C . GLN D 1 93 ? 77.437 67.515 40.233 1.00 26.61 ? 113 GLN E C 1 +ATOM 15814 O O . GLN D 1 93 ? 77.595 68.053 39.138 1.00 27.24 ? 113 GLN E O 1 +ATOM 15815 C CB . GLN D 1 93 ? 79.048 65.608 40.557 1.00 26.75 ? 113 GLN E CB 1 +ATOM 15816 C CG . GLN D 1 93 ? 80.296 65.036 41.247 1.00 27.52 ? 113 GLN E CG 1 +ATOM 15817 C CD . GLN D 1 93 ? 81.500 65.972 41.209 1.00 28.97 ? 113 GLN E CD 1 +ATOM 15818 O OE1 . GLN D 1 93 ? 81.781 66.612 40.189 1.00 30.23 ? 113 GLN E OE1 1 +ATOM 15819 N NE2 . GLN D 1 93 ? 82.221 66.050 42.322 1.00 29.49 ? 113 GLN E NE2 1 +ATOM 15820 N N . ASP D 1 94 ? 76.232 67.346 40.778 1.00 26.54 ? 114 ASP E N 1 +ATOM 15821 C CA . ASP D 1 94 ? 75.023 67.850 40.118 1.00 26.18 ? 114 ASP E CA 1 +ATOM 15822 C C . ASP D 1 94 ? 74.657 69.260 40.592 1.00 25.78 ? 114 ASP E C 1 +ATOM 15823 O O . ASP D 1 94 ? 74.152 69.439 41.701 1.00 25.99 ? 114 ASP E O 1 +ATOM 15824 C CB . ASP D 1 94 ? 73.847 66.909 40.339 1.00 26.31 ? 114 ASP E CB 1 +ATOM 15825 C CG . ASP D 1 94 ? 72.592 67.369 39.624 1.00 27.22 ? 114 ASP E CG 1 +ATOM 15826 O OD1 . ASP D 1 94 ? 72.577 68.491 39.067 1.00 27.07 ? 114 ASP E OD1 1 +ATOM 15827 O OD2 . ASP D 1 94 ? 71.618 66.599 39.618 1.00 30.32 ? 114 ASP E OD2 1 +ATOM 15828 N N . LEU D 1 95 ? 74.864 70.241 39.713 1.00 24.99 ? 115 LEU E N 1 +ATOM 15829 C CA . LEU D 1 95 ? 74.686 71.661 40.038 1.00 24.66 ? 115 LEU E CA 1 +ATOM 15830 C C . LEU D 1 95 ? 73.230 72.091 40.243 1.00 24.02 ? 115 LEU E C 1 +ATOM 15831 O O . LEU D 1 95 ? 72.967 73.211 40.674 1.00 23.78 ? 115 LEU E O 1 +ATOM 15832 C CB . LEU D 1 95 ? 75.310 72.530 38.943 1.00 24.86 ? 115 LEU E CB 1 +ATOM 15833 C CG . LEU D 1 95 ? 76.810 72.338 38.720 1.00 25.02 ? 115 LEU E CG 1 +ATOM 15834 C CD1 . LEU D 1 95 ? 77.244 73.041 37.450 1.00 25.82 ? 115 LEU E CD1 1 +ATOM 15835 C CD2 . LEU D 1 95 ? 77.601 72.836 39.924 1.00 26.01 ? 115 LEU E CD2 1 +ATOM 15836 N N . ARG D 1 96 ? 72.290 71.211 39.922 1.00 23.43 ? 116 ARG E N 1 +ATOM 15837 C CA . ARG D 1 96 ? 70.881 71.431 40.246 1.00 23.10 ? 116 ARG E CA 1 +ATOM 15838 C C . ARG D 1 96 ? 70.611 71.326 41.757 1.00 22.01 ? 116 ARG E C 1 +ATOM 15839 O O . ARG D 1 96 ? 69.534 71.720 42.227 1.00 21.57 ? 116 ARG E O 1 +ATOM 15840 C CB . ARG D 1 96 ? 70.010 70.439 39.470 1.00 23.23 ? 116 ARG E CB 1 +ATOM 15841 C CG . ARG D 1 96 ? 70.084 70.627 37.952 1.00 23.99 ? 116 ARG E CG 1 +ATOM 15842 C CD . ARG D 1 96 ? 69.382 69.502 37.197 1.00 24.97 ? 116 ARG E CD 1 +ATOM 15843 N NE . ARG D 1 96 ? 70.213 68.298 37.066 1.00 26.39 ? 116 ARG E NE 1 +ATOM 15844 C CZ . ARG D 1 96 ? 69.760 67.096 36.701 1.00 27.85 ? 116 ARG E CZ 1 +ATOM 15845 N NH1 . ARG D 1 96 ? 68.472 66.901 36.433 1.00 29.50 ? 116 ARG E NH1 1 +ATOM 15846 N NH2 . ARG D 1 96 ? 70.605 66.074 36.605 1.00 27.99 ? 116 ARG E NH2 1 +ATOM 15847 N N . THR D 1 97 ? 71.589 70.808 42.508 1.00 20.80 ? 117 THR E N 1 +ATOM 15848 C CA . THR D 1 97 ? 71.471 70.629 43.956 1.00 19.78 ? 117 THR E CA 1 +ATOM 15849 C C . THR D 1 97 ? 71.862 71.901 44.712 1.00 18.69 ? 117 THR E C 1 +ATOM 15850 O O . THR D 1 97 ? 72.954 72.426 44.526 1.00 18.48 ? 117 THR E O 1 +ATOM 15851 C CB . THR D 1 97 ? 72.373 69.477 44.481 1.00 19.87 ? 117 THR E CB 1 +ATOM 15852 O OG1 . THR D 1 97 ? 72.153 68.275 43.724 1.00 21.02 ? 117 THR E OG1 1 +ATOM 15853 C CG2 . THR D 1 97 ? 72.078 69.209 45.953 1.00 19.74 ? 117 THR E CG2 1 +ATOM 15854 N N . ARG D 1 98 ? 70.958 72.380 45.561 1.00 16.93 ? 118 ARG E N 1 +ATOM 15855 C CA . ARG D 1 98 ? 71.274 73.415 46.538 1.00 15.60 ? 118 ARG E CA 1 +ATOM 15856 C C . ARG D 1 98 ? 71.585 72.724 47.864 1.00 14.72 ? 118 ARG E C 1 +ATOM 15857 O O . ARG D 1 98 ? 70.747 71.978 48.378 1.00 14.84 ? 118 ARG E O 1 +ATOM 15858 C CB . ARG D 1 98 ? 70.081 74.358 46.696 1.00 15.55 ? 118 ARG E CB 1 +ATOM 15859 C CG . ARG D 1 98 ? 70.237 75.387 47.782 1.00 16.26 ? 118 ARG E CG 1 +ATOM 15860 C CD . ARG D 1 98 ? 69.217 76.497 47.614 1.00 16.76 ? 118 ARG E CD 1 +ATOM 15861 N NE . ARG D 1 98 ? 69.167 77.327 48.816 1.00 16.93 ? 118 ARG E NE 1 +ATOM 15862 C CZ . ARG D 1 98 ? 68.415 77.073 49.883 1.00 16.89 ? 118 ARG E CZ 1 +ATOM 15863 N NH1 . ARG D 1 98 ? 67.617 76.009 49.916 1.00 16.73 ? 118 ARG E NH1 1 +ATOM 15864 N NH2 . ARG D 1 98 ? 68.468 77.884 50.925 1.00 16.78 ? 118 ARG E NH2 1 +ATOM 15865 N N . VAL D 1 99 ? 72.785 72.959 48.404 1.00 13.40 ? 119 VAL E N 1 +ATOM 15866 C CA . VAL D 1 99 ? 73.220 72.361 49.673 1.00 12.76 ? 119 VAL E CA 1 +ATOM 15867 C C . VAL D 1 99 ? 73.230 73.417 50.786 1.00 12.49 ? 119 VAL E C 1 +ATOM 15868 O O . VAL D 1 99 ? 73.849 74.474 50.648 1.00 11.91 ? 119 VAL E O 1 +ATOM 15869 C CB . VAL D 1 99 ? 74.640 71.758 49.554 1.00 12.78 ? 119 VAL E CB 1 +ATOM 15870 C CG1 . VAL D 1 99 ? 75.086 71.171 50.876 1.00 12.79 ? 119 VAL E CG1 1 +ATOM 15871 C CG2 . VAL D 1 99 ? 74.700 70.678 48.449 1.00 12.78 ? 119 VAL E CG2 1 +ATOM 15872 N N . VAL D 1 100 ? 72.543 73.121 51.888 1.00 11.79 ? 120 VAL E N 1 +ATOM 15873 C CA . VAL D 1 100 ? 72.426 74.056 53.007 1.00 11.49 ? 120 VAL E CA 1 +ATOM 15874 C C . VAL D 1 100 ? 73.005 73.478 54.300 1.00 11.10 ? 120 VAL E C 1 +ATOM 15875 O O . VAL D 1 100 ? 72.720 72.324 54.674 1.00 11.09 ? 120 VAL E O 1 +ATOM 15876 C CB . VAL D 1 100 ? 70.961 74.410 53.259 1.00 11.21 ? 120 VAL E CB 1 +ATOM 15877 C CG1 . VAL D 1 100 ? 70.825 75.393 54.419 1.00 11.76 ? 120 VAL E CG1 1 +ATOM 15878 C CG2 . VAL D 1 100 ? 70.343 74.980 51.983 1.00 11.41 ? 120 VAL E CG2 1 +ATOM 15879 N N . LEU D 1 101 ? 73.823 74.281 54.968 1.00 10.90 ? 121 LEU E N 1 +ATOM 15880 C CA . LEU D 1 101 ? 74.289 73.964 56.319 1.00 10.87 ? 121 LEU E CA 1 +ATOM 15881 C C . LEU D 1 101 ? 73.415 74.686 57.345 1.00 10.75 ? 121 LEU E C 1 +ATOM 15882 O O . LEU D 1 101 ? 73.349 75.919 57.348 1.00 9.57 ? 121 LEU E O 1 +ATOM 15883 C CB . LEU D 1 101 ? 75.749 74.382 56.505 1.00 10.75 ? 121 LEU E CB 1 +ATOM 15884 C CG . LEU D 1 101 ? 76.309 74.133 57.905 1.00 9.95 ? 121 LEU E CG 1 +ATOM 15885 C CD1 . LEU D 1 101 ? 76.083 72.694 58.354 1.00 11.97 ? 121 LEU E CD1 1 +ATOM 15886 C CD2 . LEU D 1 101 ? 77.785 74.480 57.949 1.00 11.23 ? 121 LEU E CD2 1 +ATOM 15887 N N . ARG D 1 102 ? 72.769 73.906 58.212 1.00 10.80 ? 122 ARG E N 1 +ATOM 15888 C CA . ARG D 1 102 ? 71.852 74.408 59.245 1.00 11.31 ? 122 ARG E CA 1 +ATOM 15889 C C . ARG D 1 102 ? 72.374 74.090 60.649 1.00 11.42 ? 122 ARG E C 1 +ATOM 15890 O O . ARG D 1 102 ? 72.617 72.915 60.983 1.00 11.77 ? 122 ARG E O 1 +ATOM 15891 C CB . ARG D 1 102 ? 70.468 73.754 59.074 1.00 11.51 ? 122 ARG E CB 1 +ATOM 15892 C CG . ARG D 1 102 ? 69.450 73.981 60.215 1.00 11.60 ? 122 ARG E CG 1 +ATOM 15893 C CD . ARG D 1 102 ? 69.023 75.422 60.358 1.00 12.56 ? 122 ARG E CD 1 +ATOM 15894 N NE . ARG D 1 102 ? 68.027 75.824 59.367 1.00 12.36 ? 122 ARG E NE 1 +ATOM 15895 C CZ . ARG D 1 102 ? 66.708 75.678 59.495 1.00 14.10 ? 122 ARG E CZ 1 +ATOM 15896 N NH1 . ARG D 1 102 ? 66.173 75.110 60.568 1.00 15.20 ? 122 ARG E NH1 1 +ATOM 15897 N NH2 . ARG D 1 102 ? 65.910 76.117 58.529 1.00 12.13 ? 122 ARG E NH2 1 +ATOM 15898 N N . ILE D 1 103 ? 72.505 75.139 61.464 1.00 11.95 ? 123 ILE E N 1 +ATOM 15899 C CA . ILE D 1 103 ? 72.891 75.040 62.870 1.00 12.00 ? 123 ILE E CA 1 +ATOM 15900 C C . ILE D 1 103 ? 71.668 75.332 63.744 1.00 11.34 ? 123 ILE E C 1 +ATOM 15901 O O . ILE D 1 103 ? 71.103 76.407 63.649 1.00 10.74 ? 123 ILE E O 1 +ATOM 15902 C CB . ILE D 1 103 ? 73.984 76.087 63.202 1.00 12.48 ? 123 ILE E CB 1 +ATOM 15903 C CG1 . ILE D 1 103 ? 75.132 76.016 62.193 1.00 14.45 ? 123 ILE E CG1 1 +ATOM 15904 C CG2 . ILE D 1 103 ? 74.500 75.891 64.619 1.00 11.66 ? 123 ILE E CG2 1 +ATOM 15905 C CD1 . ILE D 1 103 ? 75.677 74.656 61.983 1.00 15.31 ? 123 ILE E CD1 1 +ATOM 15906 N N . GLY D 1 104 ? 71.275 74.372 64.583 1.00 10.93 ? 124 GLY E N 1 +ATOM 15907 C CA . GLY D 1 104 ? 70.038 74.483 65.375 1.00 10.08 ? 124 GLY E CA 1 +ATOM 15908 C C . GLY D 1 104 ? 70.072 75.642 66.357 1.00 9.87 ? 124 GLY E C 1 +ATOM 15909 O O . GLY D 1 104 ? 69.078 76.354 66.523 1.00 10.26 ? 124 GLY E O 1 +ATOM 15910 N N . SER D 1 105 ? 71.227 75.816 67.002 1.00 9.30 ? 125 SER E N 1 +ATOM 15911 C CA . SER D 1 105 ? 71.513 76.966 67.856 1.00 8.86 ? 125 SER E CA 1 +ATOM 15912 C C . SER D 1 105 ? 73.014 77.012 68.178 1.00 8.91 ? 125 SER E C 1 +ATOM 15913 O O . SER D 1 105 ? 73.741 76.065 67.889 1.00 10.11 ? 125 SER E O 1 +ATOM 15914 C CB . SER D 1 105 ? 70.718 76.914 69.160 1.00 8.95 ? 125 SER E CB 1 +ATOM 15915 O OG . SER D 1 105 ? 71.050 75.765 69.919 1.00 9.74 ? 125 SER E OG 1 +ATOM 15916 N N . ALA D 1 106 ? 73.436 78.112 68.784 1.00 8.54 ? 126 ALA E N 1 +ATOM 15917 C CA . ALA D 1 106 ? 74.815 78.312 69.243 1.00 8.66 ? 126 ALA E CA 1 +ATOM 15918 C C . ALA D 1 106 ? 74.767 79.091 70.561 1.00 10.13 ? 126 ALA E C 1 +ATOM 15919 O O . ALA D 1 106 ? 74.230 78.586 71.562 1.00 11.53 ? 126 ALA E O 1 +ATOM 15920 C CB . ALA D 1 106 ? 75.612 79.044 68.188 1.00 8.80 ? 126 ALA E CB 1 +ATOM 15921 N N . HIS D 1 107 ? 75.285 80.316 70.570 1.00 9.89 ? 127 HIS E N 1 +ATOM 15922 C CA . HIS D 1 107 ? 75.285 81.139 71.777 1.00 9.95 ? 127 HIS E CA 1 +ATOM 15923 C C . HIS D 1 107 ? 75.439 82.625 71.378 1.00 10.12 ? 127 HIS E C 1 +ATOM 15924 O O . HIS D 1 107 ? 74.961 83.047 70.317 1.00 9.54 ? 127 HIS E O 1 +ATOM 15925 C CB . HIS D 1 107 ? 76.390 80.639 72.732 1.00 10.31 ? 127 HIS E CB 1 +ATOM 15926 C CG . HIS D 1 107 ? 76.081 80.816 74.191 1.00 10.44 ? 127 HIS E CG 1 +ATOM 15927 N ND1 . HIS D 1 107 ? 76.162 82.032 74.828 1.00 12.28 ? 127 HIS E ND1 1 +ATOM 15928 C CD2 . HIS D 1 107 ? 75.737 79.919 75.147 1.00 11.71 ? 127 HIS E CD2 1 +ATOM 15929 C CE1 . HIS D 1 107 ? 75.863 81.885 76.104 1.00 11.39 ? 127 HIS E CE1 1 +ATOM 15930 N NE2 . HIS D 1 107 ? 75.601 80.611 76.325 1.00 10.27 ? 127 HIS E NE2 1 +ATOM 15931 N N . SER D 1 108 ? 76.070 83.427 72.230 1.00 9.60 ? 128 SER E N 1 +ATOM 15932 C CA . SER D 1 108 ? 76.173 84.867 71.995 1.00 10.47 ? 128 SER E CA 1 +ATOM 15933 C C . SER D 1 108 ? 76.700 85.201 70.606 1.00 10.36 ? 128 SER E C 1 +ATOM 15934 O O . SER D 1 108 ? 76.163 86.089 69.937 1.00 11.21 ? 128 SER E O 1 +ATOM 15935 C CB . SER D 1 108 ? 77.043 85.539 73.062 1.00 10.92 ? 128 SER E CB 1 +ATOM 15936 O OG . SER D 1 108 ? 76.388 85.616 74.312 1.00 11.61 ? 128 SER E OG 1 +ATOM 15937 N N . TYR D 1 109 ? 77.754 84.499 70.185 1.00 10.97 ? 129 TYR E N 1 +ATOM 15938 C CA . TYR D 1 109 ? 78.246 84.601 68.818 1.00 10.52 ? 129 TYR E CA 1 +ATOM 15939 C C . TYR D 1 109 ? 78.733 83.261 68.281 1.00 9.66 ? 129 TYR E C 1 +ATOM 15940 O O . TYR D 1 109 ? 79.263 82.425 69.027 1.00 8.98 ? 129 TYR E O 1 +ATOM 15941 C CB . TYR D 1 109 ? 79.366 85.645 68.694 1.00 11.71 ? 129 TYR E CB 1 +ATOM 15942 C CG . TYR D 1 109 ? 79.296 86.369 67.373 1.00 12.86 ? 129 TYR E CG 1 +ATOM 15943 C CD1 . TYR D 1 109 ? 78.443 87.444 67.210 1.00 15.42 ? 129 TYR E CD1 1 +ATOM 15944 C CD2 . TYR D 1 109 ? 80.051 85.955 66.279 1.00 14.05 ? 129 TYR E CD2 1 +ATOM 15945 C CE1 . TYR D 1 109 ? 78.342 88.109 66.003 1.00 16.26 ? 129 TYR E CE1 1 +ATOM 15946 C CE2 . TYR D 1 109 ? 79.960 86.611 65.053 1.00 14.94 ? 129 TYR E CE2 1 +ATOM 15947 C CZ . TYR D 1 109 ? 79.107 87.690 64.926 1.00 16.11 ? 129 TYR E CZ 1 +ATOM 15948 O OH . TYR D 1 109 ? 78.995 88.360 63.730 1.00 16.20 ? 129 TYR E OH 1 +ATOM 15949 N N . ALA D 1 110 ? 78.535 83.062 66.986 1.00 8.53 ? 130 ALA E N 1 +ATOM 15950 C CA . ALA D 1 110 ? 79.050 81.893 66.285 1.00 8.59 ? 130 ALA E CA 1 +ATOM 15951 C C . ALA D 1 110 ? 79.572 82.304 64.919 1.00 9.23 ? 130 ALA E C 1 +ATOM 15952 O O . ALA D 1 110 ? 78.934 83.102 64.220 1.00 9.87 ? 130 ALA E O 1 +ATOM 15953 C CB . ALA D 1 110 ? 77.961 80.843 66.140 1.00 9.32 ? 130 ALA E CB 1 +ATOM 15954 N N . ILE D 1 111 ? 80.735 81.762 64.557 1.00 9.31 ? 131 ILE E N 1 +ATOM 15955 C CA . ILE D 1 111 ? 81.296 81.893 63.206 1.00 9.80 ? 131 ILE E CA 1 +ATOM 15956 C C . ILE D 1 111 ? 81.531 80.501 62.645 1.00 9.91 ? 131 ILE E C 1 +ATOM 15957 O O . ILE D 1 111 ? 82.018 79.631 63.349 1.00 10.34 ? 131 ILE E O 1 +ATOM 15958 C CB . ILE D 1 111 ? 82.647 82.682 63.196 1.00 10.21 ? 131 ILE E CB 1 +ATOM 15959 C CG1 . ILE D 1 111 ? 82.481 84.075 63.807 1.00 11.10 ? 131 ILE E CG1 1 +ATOM 15960 C CG2 . ILE D 1 111 ? 83.209 82.779 61.767 1.00 10.36 ? 131 ILE E CG2 1 +ATOM 15961 C CD1 . ILE D 1 111 ? 83.788 84.784 64.142 1.00 10.12 ? 131 ILE E CD1 1 +ATOM 15962 N N . VAL D 1 112 ? 81.150 80.299 61.390 1.00 10.08 ? 132 VAL E N 1 +ATOM 15963 C CA . VAL D 1 112 ? 81.275 79.015 60.731 1.00 10.05 ? 132 VAL E CA 1 +ATOM 15964 C C . VAL D 1 112 ? 82.156 79.160 59.494 1.00 10.24 ? 132 VAL E C 1 +ATOM 15965 O O . VAL D 1 112 ? 81.899 80.014 58.631 1.00 9.58 ? 132 VAL E O 1 +ATOM 15966 C CB . VAL D 1 112 ? 79.914 78.486 60.279 1.00 10.35 ? 132 VAL E CB 1 +ATOM 15967 C CG1 . VAL D 1 112 ? 80.056 77.094 59.738 1.00 10.14 ? 132 VAL E CG1 1 +ATOM 15968 C CG2 . VAL D 1 112 ? 78.905 78.569 61.429 1.00 9.32 ? 132 VAL E CG2 1 +ATOM 15969 N N . TRP D 1 113 ? 83.196 78.332 59.437 1.00 10.53 ? 133 TRP E N 1 +ATOM 15970 C CA . TRP D 1 113 ? 84.040 78.179 58.265 1.00 10.56 ? 133 TRP E CA 1 +ATOM 15971 C C . TRP D 1 113 ? 83.768 76.845 57.580 1.00 11.36 ? 133 TRP E C 1 +ATOM 15972 O O . TRP D 1 113 ? 83.563 75.827 58.247 1.00 10.64 ? 133 TRP E O 1 +ATOM 15973 C CB . TRP D 1 113 ? 85.513 78.215 58.658 1.00 10.98 ? 133 TRP E CB 1 +ATOM 15974 C CG . TRP D 1 113 ? 85.957 79.517 59.236 1.00 10.68 ? 133 TRP E CG 1 +ATOM 15975 C CD1 . TRP D 1 113 ? 86.520 80.567 58.568 1.00 12.39 ? 133 TRP E CD1 1 +ATOM 15976 C CD2 . TRP D 1 113 ? 85.913 79.895 60.615 1.00 10.59 ? 133 TRP E CD2 1 +ATOM 15977 N NE1 . TRP D 1 113 ? 86.808 81.584 59.445 1.00 11.82 ? 133 TRP E NE1 1 +ATOM 15978 C CE2 . TRP D 1 113 ? 86.454 81.197 60.712 1.00 12.05 ? 133 TRP E CE2 1 +ATOM 15979 C CE3 . TRP D 1 113 ? 85.463 79.263 61.780 1.00 10.29 ? 133 TRP E CE3 1 +ATOM 15980 C CZ2 . TRP D 1 113 ? 86.562 81.877 61.933 1.00 11.69 ? 133 TRP E CZ2 1 +ATOM 15981 C CZ3 . TRP D 1 113 ? 85.577 79.934 62.992 1.00 11.01 ? 133 TRP E CZ3 1 +ATOM 15982 C CH2 . TRP D 1 113 ? 86.123 81.223 63.064 1.00 11.41 ? 133 TRP E CH2 1 +ATOM 15983 N N . VAL D 1 114 ? 83.783 76.864 56.250 1.00 12.02 ? 134 VAL E N 1 +ATOM 15984 C CA . VAL D 1 114 ? 83.634 75.675 55.436 1.00 12.67 ? 134 VAL E CA 1 +ATOM 15985 C C . VAL D 1 114 ? 84.895 75.567 54.592 1.00 13.24 ? 134 VAL E C 1 +ATOM 15986 O O . VAL D 1 114 ? 85.196 76.468 53.798 1.00 12.49 ? 134 VAL E O 1 +ATOM 15987 C CB . VAL D 1 114 ? 82.412 75.776 54.542 1.00 13.47 ? 134 VAL E CB 1 +ATOM 15988 C CG1 . VAL D 1 114 ? 82.319 74.547 53.643 1.00 14.48 ? 134 VAL E CG1 1 +ATOM 15989 C CG2 . VAL D 1 114 ? 81.154 75.960 55.407 1.00 13.45 ? 134 VAL E CG2 1 +ATOM 15990 N N . ASN D 1 115 ? 85.649 74.494 54.810 1.00 13.76 ? 135 ASN E N 1 +ATOM 15991 C CA . ASN D 1 115 ? 86.973 74.344 54.208 1.00 14.34 ? 135 ASN E CA 1 +ATOM 15992 C C . ASN D 1 115 ? 87.835 75.583 54.393 1.00 14.21 ? 135 ASN E C 1 +ATOM 15993 O O . ASN D 1 115 ? 88.533 76.019 53.466 1.00 14.73 ? 135 ASN E O 1 +ATOM 15994 C CB . ASN D 1 115 ? 86.842 73.975 52.729 1.00 14.49 ? 135 ASN E CB 1 +ATOM 15995 C CG . ASN D 1 115 ? 86.181 72.637 52.532 1.00 15.53 ? 135 ASN E CG 1 +ATOM 15996 O OD1 . ASN D 1 115 ? 86.261 71.766 53.399 1.00 18.33 ? 135 ASN E OD1 1 +ATOM 15997 N ND2 . ASN D 1 115 ? 85.515 72.466 51.402 1.00 18.05 ? 135 ASN E ND2 1 +ATOM 15998 N N . GLY D 1 116 ? 87.782 76.144 55.601 1.00 14.12 ? 136 GLY E N 1 +ATOM 15999 C CA . GLY D 1 116 ? 88.609 77.288 55.975 1.00 14.14 ? 136 GLY E CA 1 +ATOM 16000 C C . GLY D 1 116 ? 88.111 78.638 55.512 1.00 14.25 ? 136 GLY E C 1 +ATOM 16001 O O . GLY D 1 116 ? 88.754 79.657 55.786 1.00 13.64 ? 136 GLY E O 1 +ATOM 16002 N N . VAL D 1 117 ? 86.963 78.664 54.836 1.00 14.52 ? 137 VAL E N 1 +ATOM 16003 C CA . VAL D 1 117 ? 86.383 79.912 54.319 1.00 14.96 ? 137 VAL E CA 1 +ATOM 16004 C C . VAL D 1 117 ? 85.217 80.345 55.208 1.00 15.48 ? 137 VAL E C 1 +ATOM 16005 O O . VAL D 1 117 ? 84.329 79.550 55.469 1.00 15.08 ? 137 VAL E O 1 +ATOM 16006 C CB . VAL D 1 117 ? 85.864 79.727 52.890 1.00 14.77 ? 137 VAL E CB 1 +ATOM 16007 C CG1 . VAL D 1 117 ? 85.246 81.018 52.382 1.00 16.00 ? 137 VAL E CG1 1 +ATOM 16008 C CG2 . VAL D 1 117 ? 87.005 79.287 51.945 1.00 15.73 ? 137 VAL E CG2 1 +ATOM 16009 N N . ASP D 1 118 ? 85.224 81.587 55.689 1.00 15.78 ? 138 ASP E N 1 +ATOM 16010 C CA . ASP D 1 118 ? 84.118 82.055 56.539 1.00 16.64 ? 138 ASP E CA 1 +ATOM 16011 C C . ASP D 1 118 ? 82.846 82.150 55.699 1.00 16.52 ? 138 ASP E C 1 +ATOM 16012 O O . ASP D 1 118 ? 82.850 82.727 54.611 1.00 16.64 ? 138 ASP E O 1 +ATOM 16013 C CB . ASP D 1 118 ? 84.439 83.386 57.223 1.00 17.29 ? 138 ASP E CB 1 +ATOM 16014 C CG . ASP D 1 118 ? 84.709 84.481 56.243 1.00 19.67 ? 138 ASP E CG 1 +ATOM 16015 O OD1 . ASP D 1 118 ? 83.766 85.238 55.912 1.00 23.69 ? 138 ASP E OD1 1 +ATOM 16016 O OD2 . ASP D 1 118 ? 85.856 84.552 55.771 1.00 23.45 ? 138 ASP E OD2 1 +ATOM 16017 N N . THR D 1 119 ? 81.764 81.542 56.174 1.00 16.08 ? 139 THR E N 1 +ATOM 16018 C CA . THR D 1 119 ? 80.558 81.443 55.360 1.00 16.31 ? 139 THR E CA 1 +ATOM 16019 C C . THR D 1 119 ? 79.268 81.808 56.092 1.00 15.84 ? 139 THR E C 1 +ATOM 16020 O O . THR D 1 119 ? 78.227 82.000 55.457 1.00 16.19 ? 139 THR E O 1 +ATOM 16021 C CB . THR D 1 119 ? 80.394 80.026 54.775 1.00 16.82 ? 139 THR E CB 1 +ATOM 16022 O OG1 . THR D 1 119 ? 79.883 79.151 55.779 1.00 19.57 ? 139 THR E OG1 1 +ATOM 16023 C CG2 . THR D 1 119 ? 81.718 79.481 54.265 1.00 16.69 ? 139 THR E CG2 1 +ATOM 16024 N N . LEU D 1 120 ? 79.329 81.899 57.417 1.00 14.66 ? 140 LEU E N 1 +ATOM 16025 C CA . LEU D 1 120 ? 78.123 82.060 58.210 1.00 13.96 ? 140 LEU E CA 1 +ATOM 16026 C C . LEU D 1 120 ? 78.447 82.529 59.618 1.00 13.61 ? 140 LEU E C 1 +ATOM 16027 O O . LEU D 1 120 ? 79.359 82.007 60.265 1.00 12.34 ? 140 LEU E O 1 +ATOM 16028 C CB . LEU D 1 120 ? 77.356 80.732 58.253 1.00 14.06 ? 140 LEU E CB 1 +ATOM 16029 C CG . LEU D 1 120 ? 76.097 80.653 59.123 1.00 14.56 ? 140 LEU E CG 1 +ATOM 16030 C CD1 . LEU D 1 120 ? 75.060 81.699 58.701 1.00 12.74 ? 140 LEU E CD1 1 +ATOM 16031 C CD2 . LEU D 1 120 ? 75.516 79.249 59.051 1.00 13.92 ? 140 LEU E CD2 1 +ATOM 16032 N N . GLU D 1 121 ? 77.700 83.536 60.060 1.00 12.68 ? 141 GLU E N 1 +ATOM 16033 C CA . GLU D 1 121 ? 77.787 84.059 61.417 1.00 13.03 ? 141 GLU E CA 1 +ATOM 16034 C C . GLU D 1 121 ? 76.378 84.228 61.968 1.00 12.07 ? 141 GLU E C 1 +ATOM 16035 O O . GLU D 1 121 ? 75.414 84.339 61.194 1.00 12.40 ? 141 GLU E O 1 +ATOM 16036 C CB . GLU D 1 121 ? 78.524 85.408 61.435 1.00 13.38 ? 141 GLU E CB 1 +ATOM 16037 C CG . GLU D 1 121 ? 79.995 85.318 61.013 1.00 15.29 ? 141 GLU E CG 1 +ATOM 16038 C CD . GLU D 1 121 ? 80.692 86.683 60.899 1.00 16.18 ? 141 GLU E CD 1 +ATOM 16039 O OE1 . GLU D 1 121 ? 80.437 87.592 61.724 1.00 19.65 ? 141 GLU E OE1 1 +ATOM 16040 O OE2 . GLU D 1 121 ? 81.524 86.837 59.978 1.00 21.29 ? 141 GLU E OE2 1 +ATOM 16041 N N . HIS D 1 122 ? 76.259 84.207 63.293 1.00 11.12 ? 142 HIS E N 1 +ATOM 16042 C CA . HIS D 1 122 ? 74.987 84.464 63.970 1.00 10.97 ? 142 HIS E CA 1 +ATOM 16043 C C . HIS D 1 122 ? 75.212 84.957 65.389 1.00 11.01 ? 142 HIS E C 1 +ATOM 16044 O O . HIS D 1 122 ? 76.142 84.525 66.079 1.00 11.19 ? 142 HIS E O 1 +ATOM 16045 C CB . HIS D 1 122 ? 74.118 83.204 63.973 1.00 10.70 ? 142 HIS E CB 1 +ATOM 16046 C CG . HIS D 1 122 ? 72.756 83.401 64.575 1.00 10.38 ? 142 HIS E CG 1 +ATOM 16047 N ND1 . HIS D 1 122 ? 72.493 83.182 65.911 1.00 10.35 ? 142 HIS E ND1 1 +ATOM 16048 C CD2 . HIS D 1 122 ? 71.578 83.768 64.014 1.00 11.19 ? 142 HIS E CD2 1 +ATOM 16049 C CE1 . HIS D 1 122 ? 71.210 83.414 66.148 1.00 11.08 ? 142 HIS E CE1 1 +ATOM 16050 N NE2 . HIS D 1 122 ? 70.630 83.763 65.013 1.00 9.59 ? 142 HIS E NE2 1 +ATOM 16051 N N . GLU D 1 123 ? 74.337 85.871 65.813 1.00 10.72 ? 143 GLU E N 1 +ATOM 16052 C CA . GLU D 1 123 ? 74.380 86.479 67.132 1.00 11.11 ? 143 GLU E CA 1 +ATOM 16053 C C . GLU D 1 123 ? 73.170 86.006 67.894 1.00 10.48 ? 143 GLU E C 1 +ATOM 16054 O O . GLU D 1 123 ? 72.045 86.147 67.410 1.00 10.83 ? 143 GLU E O 1 +ATOM 16055 C CB . GLU D 1 123 ? 74.349 88.000 67.005 1.00 11.57 ? 143 GLU E CB 1 +ATOM 16056 C CG . GLU D 1 123 ? 74.711 88.778 68.273 1.00 13.87 ? 143 GLU E CG 1 +ATOM 16057 C CD . GLU D 1 123 ? 73.607 88.847 69.311 1.00 16.61 ? 143 GLU E CD 1 +ATOM 16058 O OE1 . GLU D 1 123 ? 73.931 89.077 70.496 1.00 16.76 ? 143 GLU E OE1 1 +ATOM 16059 O OE2 . GLU D 1 123 ? 72.419 88.676 68.954 1.00 17.11 ? 143 GLU E OE2 1 +ATOM 16060 N N . GLY D 1 124 ? 73.404 85.437 69.074 1.00 9.67 ? 144 GLY E N 1 +ATOM 16061 C CA . GLY D 1 124 ? 72.336 85.093 70.004 1.00 9.62 ? 144 GLY E CA 1 +ATOM 16062 C C . GLY D 1 124 ? 72.067 83.603 70.036 1.00 9.08 ? 144 GLY E C 1 +ATOM 16063 O O . GLY D 1 124 ? 72.165 82.914 69.010 1.00 9.67 ? 144 GLY E O 1 +ATOM 16064 N N . GLY D 1 125 ? 71.721 83.096 71.214 1.00 9.08 ? 145 GLY E N 1 +ATOM 16065 C CA . GLY D 1 125 ? 71.505 81.668 71.392 1.00 9.07 ? 145 GLY E CA 1 +ATOM 16066 C C . GLY D 1 125 ? 70.063 81.246 71.176 1.00 9.18 ? 145 GLY E C 1 +ATOM 16067 O O . GLY D 1 125 ? 69.181 82.079 70.970 1.00 9.13 ? 145 GLY E O 1 +ATOM 16068 N N . TYR D 1 126 ? 69.845 79.933 71.205 1.00 8.75 ? 146 TYR E N 1 +ATOM 16069 C CA . TYR D 1 126 ? 68.510 79.337 71.226 1.00 9.31 ? 146 TYR E CA 1 +ATOM 16070 C C . TYR D 1 126 ? 67.736 79.437 69.909 1.00 8.72 ? 146 TYR E C 1 +ATOM 16071 O O . TYR D 1 126 ? 66.558 79.083 69.869 1.00 9.72 ? 146 TYR E O 1 +ATOM 16072 C CB . TYR D 1 126 ? 67.704 79.915 72.389 1.00 9.01 ? 146 TYR E CB 1 +ATOM 16073 C CG . TYR D 1 126 ? 68.464 79.819 73.712 1.00 9.83 ? 146 TYR E CG 1 +ATOM 16074 C CD1 . TYR D 1 126 ? 68.724 78.573 74.299 1.00 8.24 ? 146 TYR E CD1 1 +ATOM 16075 C CD2 . TYR D 1 126 ? 68.919 80.955 74.362 1.00 9.03 ? 146 TYR E CD2 1 +ATOM 16076 C CE1 . TYR D 1 126 ? 69.421 78.477 75.509 1.00 7.59 ? 146 TYR E CE1 1 +ATOM 16077 C CE2 . TYR D 1 126 ? 69.634 80.865 75.567 1.00 8.32 ? 146 TYR E CE2 1 +ATOM 16078 C CZ . TYR D 1 126 ? 69.864 79.627 76.134 1.00 9.11 ? 146 TYR E CZ 1 +ATOM 16079 O OH . TYR D 1 126 ? 70.560 79.522 77.316 1.00 9.27 ? 146 TYR E OH 1 +ATOM 16080 N N . LEU D 1 127 ? 68.404 79.852 68.828 1.00 9.21 ? 147 LEU E N 1 +ATOM 16081 C CA . LEU D 1 127 ? 67.741 80.067 67.531 1.00 8.91 ? 147 LEU E CA 1 +ATOM 16082 C C . LEU D 1 127 ? 68.585 79.592 66.353 1.00 9.16 ? 147 LEU E C 1 +ATOM 16083 O O . LEU D 1 127 ? 69.812 79.727 66.381 1.00 7.87 ? 147 LEU E O 1 +ATOM 16084 C CB . LEU D 1 127 ? 67.391 81.535 67.375 1.00 9.22 ? 147 LEU E CB 1 +ATOM 16085 C CG . LEU D 1 127 ? 66.228 81.988 68.248 1.00 9.19 ? 147 LEU E CG 1 +ATOM 16086 C CD1 . LEU D 1 127 ? 66.048 83.518 68.206 1.00 9.08 ? 147 LEU E CD1 1 +ATOM 16087 C CD2 . LEU D 1 127 ? 64.946 81.241 67.865 1.00 8.79 ? 147 LEU E CD2 1 +ATOM 16088 N N . PRO D 1 128 ? 67.933 79.011 65.329 1.00 8.91 ? 148 PRO E N 1 +ATOM 16089 C CA . PRO D 1 128 ? 68.657 78.413 64.206 1.00 9.63 ? 148 PRO E CA 1 +ATOM 16090 C C . PRO D 1 128 ? 69.223 79.441 63.224 1.00 9.74 ? 148 PRO E C 1 +ATOM 16091 O O . PRO D 1 128 ? 68.727 80.565 63.122 1.00 9.61 ? 148 PRO E O 1 +ATOM 16092 C CB . PRO D 1 128 ? 67.597 77.571 63.529 1.00 9.65 ? 148 PRO E CB 1 +ATOM 16093 C CG . PRO D 1 128 ? 66.327 78.347 63.779 1.00 9.79 ? 148 PRO E CG 1 +ATOM 16094 C CD . PRO D 1 128 ? 66.466 78.870 65.163 1.00 9.05 ? 148 PRO E CD 1 +ATOM 16095 N N . PHE D 1 129 ? 70.266 79.035 62.516 1.00 9.94 ? 149 PHE E N 1 +ATOM 16096 C CA . PHE D 1 129 ? 70.827 79.834 61.427 1.00 10.42 ? 149 PHE E CA 1 +ATOM 16097 C C . PHE D 1 129 ? 71.395 78.882 60.383 1.00 10.74 ? 149 PHE E C 1 +ATOM 16098 O O . PHE D 1 129 ? 71.717 77.722 60.701 1.00 10.78 ? 149 PHE E O 1 +ATOM 16099 C CB . PHE D 1 129 ? 71.843 80.884 61.928 1.00 10.39 ? 149 PHE E CB 1 +ATOM 16100 C CG . PHE D 1 129 ? 72.963 80.346 62.792 1.00 9.45 ? 149 PHE E CG 1 +ATOM 16101 C CD1 . PHE D 1 129 ? 72.768 80.064 64.131 1.00 9.26 ? 149 PHE E CD1 1 +ATOM 16102 C CD2 . PHE D 1 129 ? 74.234 80.193 62.272 1.00 10.50 ? 149 PHE E CD2 1 +ATOM 16103 C CE1 . PHE D 1 129 ? 73.816 79.602 64.916 1.00 10.74 ? 149 PHE E CE1 1 +ATOM 16104 C CE2 . PHE D 1 129 ? 75.278 79.734 63.045 1.00 10.47 ? 149 PHE E CE2 1 +ATOM 16105 C CZ . PHE D 1 129 ? 75.072 79.440 64.372 1.00 9.71 ? 149 PHE E CZ 1 +ATOM 16106 N N . GLU D 1 130 ? 71.422 79.331 59.130 1.00 11.31 ? 150 GLU E N 1 +ATOM 16107 C CA . GLU D 1 130 ? 71.877 78.489 58.022 1.00 11.91 ? 150 GLU E CA 1 +ATOM 16108 C C . GLU D 1 130 ? 72.560 79.282 56.919 1.00 12.20 ? 150 GLU E C 1 +ATOM 16109 O O . GLU D 1 130 ? 72.442 80.492 56.845 1.00 12.20 ? 150 GLU E O 1 +ATOM 16110 C CB . GLU D 1 130 ? 70.706 77.715 57.421 1.00 12.24 ? 150 GLU E CB 1 +ATOM 16111 C CG . GLU D 1 130 ? 69.677 78.569 56.677 1.00 12.55 ? 150 GLU E CG 1 +ATOM 16112 C CD . GLU D 1 130 ? 68.566 77.735 56.076 1.00 13.03 ? 150 GLU E CD 1 +ATOM 16113 O OE1 . GLU D 1 130 ? 68.312 76.626 56.594 1.00 12.43 ? 150 GLU E OE1 1 +ATOM 16114 O OE2 . GLU D 1 130 ? 67.960 78.168 55.070 1.00 14.81 ? 150 GLU E OE2 1 +ATOM 16115 N N . ALA D 1 131 ? 73.268 78.571 56.050 1.00 12.61 ? 151 ALA E N 1 +ATOM 16116 C CA . ALA D 1 131 ? 73.885 79.187 54.879 1.00 12.84 ? 151 ALA E CA 1 +ATOM 16117 C C . ALA D 1 131 ? 73.847 78.174 53.738 1.00 13.07 ? 151 ALA E C 1 +ATOM 16118 O O . ALA D 1 131 ? 74.077 76.988 53.949 1.00 13.34 ? 151 ALA E O 1 +ATOM 16119 C CB . ALA D 1 131 ? 75.316 79.586 55.172 1.00 12.71 ? 151 ALA E CB 1 +ATOM 16120 N N . ASP D 1 132 ? 73.568 78.669 52.538 1.00 13.50 ? 152 ASP E N 1 +ATOM 16121 C CA . ASP D 1 132 ? 73.689 77.892 51.301 1.00 13.92 ? 152 ASP E CA 1 +ATOM 16122 C C . ASP D 1 132 ? 75.172 77.729 50.973 1.00 14.26 ? 152 ASP E C 1 +ATOM 16123 O O . ASP D 1 132 ? 75.858 78.720 50.709 1.00 14.88 ? 152 ASP E O 1 +ATOM 16124 C CB . ASP D 1 132 ? 72.981 78.658 50.178 1.00 14.25 ? 152 ASP E CB 1 +ATOM 16125 C CG . ASP D 1 132 ? 73.036 77.951 48.838 1.00 14.82 ? 152 ASP E CG 1 +ATOM 16126 O OD1 . ASP D 1 132 ? 73.950 77.134 48.599 1.00 18.51 ? 152 ASP E OD1 1 +ATOM 16127 O OD2 . ASP D 1 132 ? 72.149 78.239 48.013 1.00 17.08 ? 152 ASP E OD2 1 +ATOM 16128 N N . ILE D 1 133 ? 75.666 76.492 50.982 1.00 14.43 ? 153 ILE E N 1 +ATOM 16129 C CA . ILE D 1 133 ? 77.100 76.244 50.765 1.00 14.55 ? 153 ILE E CA 1 +ATOM 16130 C C . ILE D 1 133 ? 77.393 75.574 49.420 1.00 15.14 ? 153 ILE E C 1 +ATOM 16131 O O . ILE D 1 133 ? 78.496 75.090 49.189 1.00 14.98 ? 153 ILE E O 1 +ATOM 16132 C CB . ILE D 1 133 ? 77.729 75.433 51.932 1.00 14.51 ? 153 ILE E CB 1 +ATOM 16133 C CG1 . ILE D 1 133 ? 77.057 74.067 52.096 1.00 14.07 ? 153 ILE E CG1 1 +ATOM 16134 C CG2 . ILE D 1 133 ? 77.632 76.226 53.232 1.00 14.28 ? 153 ILE E CG2 1 +ATOM 16135 C CD1 . ILE D 1 133 ? 77.715 73.209 53.142 1.00 14.10 ? 153 ILE E CD1 1 +ATOM 16136 N N . SER D 1 134 ? 76.420 75.603 48.517 1.00 16.21 ? 154 SER E N 1 +ATOM 16137 C CA . SER D 1 134 ? 76.534 74.909 47.246 1.00 16.85 ? 154 SER E CA 1 +ATOM 16138 C C . SER D 1 134 ? 77.841 75.218 46.533 1.00 18.06 ? 154 SER E C 1 +ATOM 16139 O O . SER D 1 134 ? 78.530 74.313 46.086 1.00 17.08 ? 154 SER E O 1 +ATOM 16140 C CB . SER D 1 134 ? 75.369 75.283 46.346 1.00 16.68 ? 154 SER E CB 1 +ATOM 16141 O OG . SER D 1 134 ? 74.142 75.101 47.026 1.00 16.72 ? 154 SER E OG 1 +ATOM 16142 N N . ASN D 1 135 ? 78.159 76.503 46.425 1.00 19.71 ? 155 ASN E N 1 +ATOM 16143 C CA . ASN D 1 135 ? 79.365 76.929 45.717 1.00 21.46 ? 155 ASN E CA 1 +ATOM 16144 C C . ASN D 1 135 ? 80.653 76.381 46.344 1.00 22.47 ? 155 ASN E C 1 +ATOM 16145 O O . ASN D 1 135 ? 81.629 76.126 45.633 1.00 23.05 ? 155 ASN E O 1 +ATOM 16146 C CB . ASN D 1 135 ? 79.426 78.455 45.651 1.00 21.65 ? 155 ASN E CB 1 +ATOM 16147 C CG . ASN D 1 135 ? 79.795 79.077 46.979 1.00 23.44 ? 155 ASN E CG 1 +ATOM 16148 O OD1 . ASN D 1 135 ? 79.149 78.818 47.995 1.00 26.16 ? 155 ASN E OD1 1 +ATOM 16149 N ND2 . ASN D 1 135 ? 80.851 79.892 46.984 1.00 26.90 ? 155 ASN E ND2 1 +ATOM 16150 N N . LEU D 1 136 ? 80.652 76.200 47.665 1.00 23.45 ? 156 LEU E N 1 +ATOM 16151 C CA . LEU D 1 136 ? 81.835 75.715 48.395 1.00 24.34 ? 156 LEU E CA 1 +ATOM 16152 C C . LEU D 1 136 ? 82.060 74.214 48.240 1.00 24.96 ? 156 LEU E C 1 +ATOM 16153 O O . LEU D 1 136 ? 83.197 73.747 48.312 1.00 25.53 ? 156 LEU E O 1 +ATOM 16154 C CB . LEU D 1 136 ? 81.724 76.058 49.888 1.00 24.42 ? 156 LEU E CB 1 +ATOM 16155 C CG . LEU D 1 136 ? 82.192 77.443 50.358 1.00 25.03 ? 156 LEU E CG 1 +ATOM 16156 C CD1 . LEU D 1 136 ? 82.257 78.458 49.236 1.00 25.38 ? 156 LEU E CD1 1 +ATOM 16157 C CD2 . LEU D 1 136 ? 81.300 77.950 51.481 1.00 25.75 ? 156 LEU E CD2 1 +ATOM 16158 N N . VAL D 1 137 ? 80.983 73.459 48.046 1.00 25.54 ? 157 VAL E N 1 +ATOM 16159 C CA . VAL D 1 137 ? 81.085 72.006 47.897 1.00 26.11 ? 157 VAL E CA 1 +ATOM 16160 C C . VAL D 1 137 ? 81.041 71.561 46.436 1.00 26.41 ? 157 VAL E C 1 +ATOM 16161 O O . VAL D 1 137 ? 81.446 70.445 46.119 1.00 26.63 ? 157 VAL E O 1 +ATOM 16162 C CB . VAL D 1 137 ? 79.997 71.273 48.705 1.00 26.21 ? 157 VAL E CB 1 +ATOM 16163 C CG1 . VAL D 1 137 ? 80.181 71.547 50.183 1.00 26.78 ? 157 VAL E CG1 1 +ATOM 16164 C CG2 . VAL D 1 137 ? 78.612 71.685 48.248 1.00 26.29 ? 157 VAL E CG2 1 +ATOM 16165 N N . GLN D 1 138 ? 80.562 72.432 45.550 1.00 26.79 ? 158 GLN E N 1 +ATOM 16166 C CA . GLN D 1 138 ? 80.498 72.121 44.126 1.00 27.18 ? 158 GLN E CA 1 +ATOM 16167 C C . GLN D 1 138 ? 81.731 72.699 43.442 1.00 28.26 ? 158 GLN E C 1 +ATOM 16168 O O . GLN D 1 138 ? 81.682 73.757 42.808 1.00 28.30 ? 158 GLN E O 1 +ATOM 16169 C CB . GLN D 1 138 ? 79.184 72.613 43.526 1.00 26.86 ? 158 GLN E CB 1 +ATOM 16170 C CG . GLN D 1 138 ? 78.007 71.845 44.120 1.00 25.53 ? 158 GLN E CG 1 +ATOM 16171 C CD . GLN D 1 138 ? 76.651 72.398 43.754 1.00 24.45 ? 158 GLN E CD 1 +ATOM 16172 O OE1 . GLN D 1 138 ? 76.527 73.498 43.221 1.00 21.75 ? 158 GLN E OE1 1 +ATOM 16173 N NE2 . GLN D 1 138 ? 75.613 71.615 44.040 1.00 23.51 ? 158 GLN E NE2 1 +ATOM 16174 N N . VAL D 1 139 ? 82.827 71.955 43.606 1.00 29.14 ? 159 VAL E N 1 +ATOM 16175 C CA . VAL D 1 139 ? 84.184 72.358 43.249 1.00 29.97 ? 159 VAL E CA 1 +ATOM 16176 C C . VAL D 1 139 ? 84.364 73.874 43.144 1.00 30.27 ? 159 VAL E C 1 +ATOM 16177 O O . VAL D 1 139 ? 84.341 74.581 44.157 1.00 30.96 ? 159 VAL E O 1 +ATOM 16178 C CB . VAL D 1 139 ? 84.649 71.650 41.956 1.00 30.05 ? 159 VAL E CB 1 +ATOM 16179 C CG1 . VAL D 1 139 ? 84.288 72.468 40.718 1.00 31.12 ? 159 VAL E CG1 1 +ATOM 16180 C CG2 . VAL D 1 139 ? 86.144 71.379 42.009 1.00 30.61 ? 159 VAL E CG2 1 +ATOM 16181 N N . SER D 1 144 ? 86.459 64.616 47.677 1.00 27.79 ? 164 SER E N 1 +ATOM 16182 C CA . SER D 1 144 ? 86.940 65.512 48.727 1.00 27.83 ? 164 SER E CA 1 +ATOM 16183 C C . SER D 1 144 ? 86.136 65.319 50.011 1.00 27.32 ? 164 SER E C 1 +ATOM 16184 O O . SER D 1 144 ? 85.217 64.492 50.055 1.00 28.04 ? 164 SER E O 1 +ATOM 16185 C CB . SER D 1 144 ? 86.842 66.961 48.256 1.00 28.04 ? 164 SER E CB 1 +ATOM 16186 O OG . SER D 1 144 ? 87.381 67.850 49.218 1.00 29.02 ? 164 SER E OG 1 +ATOM 16187 N N . ARG D 1 145 ? 86.485 66.073 51.054 1.00 26.40 ? 165 ARG E N 1 +ATOM 16188 C CA . ARG D 1 145 ? 85.732 66.047 52.310 1.00 25.28 ? 165 ARG E CA 1 +ATOM 16189 C C . ARG D 1 145 ? 85.501 67.443 52.871 1.00 23.93 ? 165 ARG E C 1 +ATOM 16190 O O . ARG D 1 145 ? 86.449 68.217 53.062 1.00 24.14 ? 165 ARG E O 1 +ATOM 16191 C CB . ARG D 1 145 ? 86.442 65.186 53.342 1.00 25.76 ? 165 ARG E CB 1 +ATOM 16192 N N . LEU D 1 146 ? 84.235 67.733 53.159 1.00 21.65 ? 166 LEU E N 1 +ATOM 16193 C CA . LEU D 1 146 ? 83.818 68.987 53.769 1.00 20.06 ? 166 LEU E CA 1 +ATOM 16194 C C . LEU D 1 146 ? 84.308 69.067 55.218 1.00 18.58 ? 166 LEU E C 1 +ATOM 16195 O O . LEU D 1 146 ? 84.036 68.175 56.029 1.00 18.53 ? 166 LEU E O 1 +ATOM 16196 C CB . LEU D 1 146 ? 82.288 69.093 53.720 1.00 20.06 ? 166 LEU E CB 1 +ATOM 16197 C CG . LEU D 1 146 ? 81.581 70.326 54.288 1.00 19.93 ? 166 LEU E CG 1 +ATOM 16198 C CD1 . LEU D 1 146 ? 81.947 71.541 53.480 1.00 22.10 ? 166 LEU E CD1 1 +ATOM 16199 C CD2 . LEU D 1 146 ? 80.060 70.123 54.316 1.00 19.67 ? 166 LEU E CD2 1 +ATOM 16200 N N . ARG D 1 147 ? 85.063 70.117 55.523 1.00 16.36 ? 167 ARG E N 1 +ATOM 16201 C CA . ARG D 1 147 ? 85.473 70.413 56.884 1.00 14.95 ? 167 ARG E CA 1 +ATOM 16202 C C . ARG D 1 147 ? 84.648 71.588 57.386 1.00 14.02 ? 167 ARG E C 1 +ATOM 16203 O O . ARG D 1 147 ? 84.682 72.656 56.788 1.00 13.85 ? 167 ARG E O 1 +ATOM 16204 C CB . ARG D 1 147 ? 86.958 70.769 56.930 1.00 14.64 ? 167 ARG E CB 1 +ATOM 16205 C CG . ARG D 1 147 ? 87.525 70.883 58.322 1.00 14.06 ? 167 ARG E CG 1 +ATOM 16206 C CD . ARG D 1 147 ? 89.049 70.869 58.316 1.00 13.49 ? 167 ARG E CD 1 +ATOM 16207 N NE . ARG D 1 147 ? 89.614 71.913 57.454 1.00 13.57 ? 167 ARG E NE 1 +ATOM 16208 C CZ . ARG D 1 147 ? 89.745 73.190 57.800 1.00 13.88 ? 167 ARG E CZ 1 +ATOM 16209 N NH1 . ARG D 1 147 ? 89.352 73.610 58.996 1.00 13.96 ? 167 ARG E NH1 1 +ATOM 16210 N NH2 . ARG D 1 147 ? 90.276 74.058 56.942 1.00 15.51 ? 167 ARG E NH2 1 +ATOM 16211 N N . ILE D 1 148 ? 83.907 71.374 58.475 1.00 12.79 ? 168 ILE E N 1 +ATOM 16212 C CA . ILE D 1 148 ? 83.066 72.397 59.081 1.00 12.06 ? 168 ILE E CA 1 +ATOM 16213 C C . ILE D 1 148 ? 83.681 72.801 60.420 1.00 11.05 ? 168 ILE E C 1 +ATOM 16214 O O . ILE D 1 148 ? 83.857 71.967 61.315 1.00 9.65 ? 168 ILE E O 1 +ATOM 16215 C CB . ILE D 1 148 ? 81.628 71.887 59.296 1.00 12.29 ? 168 ILE E CB 1 +ATOM 16216 C CG1 . ILE D 1 148 ? 80.982 71.516 57.961 1.00 11.74 ? 168 ILE E CG1 1 +ATOM 16217 C CG2 . ILE D 1 148 ? 80.781 72.938 59.998 1.00 11.71 ? 168 ILE E CG2 1 +ATOM 16218 C CD1 . ILE D 1 148 ? 79.696 70.662 58.100 1.00 13.01 ? 168 ILE E CD1 1 +ATOM 16219 N N . THR D 1 149 ? 84.047 74.080 60.529 1.00 9.70 ? 169 THR E N 1 +ATOM 16220 C CA . THR D 1 149 ? 84.613 74.623 61.751 1.00 9.53 ? 169 THR E CA 1 +ATOM 16221 C C . THR D 1 149 ? 83.672 75.675 62.310 1.00 9.21 ? 169 THR E C 1 +ATOM 16222 O O . THR D 1 149 ? 83.187 76.530 61.572 1.00 9.04 ? 169 THR E O 1 +ATOM 16223 C CB . THR D 1 149 ? 85.980 75.264 61.489 1.00 8.97 ? 169 THR E CB 1 +ATOM 16224 O OG1 . THR D 1 149 ? 86.728 74.408 60.613 1.00 11.72 ? 169 THR E OG1 1 +ATOM 16225 C CG2 . THR D 1 149 ? 86.738 75.471 62.777 1.00 9.71 ? 169 THR E CG2 1 +ATOM 16226 N N . ILE D 1 150 ? 83.394 75.582 63.607 1.00 9.61 ? 170 ILE E N 1 +ATOM 16227 C CA . ILE D 1 150 ? 82.477 76.499 64.256 1.00 9.68 ? 170 ILE E CA 1 +ATOM 16228 C C . ILE D 1 150 ? 83.121 77.022 65.534 1.00 9.63 ? 170 ILE E C 1 +ATOM 16229 O O . ILE D 1 150 ? 83.494 76.249 66.421 1.00 10.05 ? 170 ILE E O 1 +ATOM 16230 C CB . ILE D 1 150 ? 81.113 75.857 64.572 1.00 9.49 ? 170 ILE E CB 1 +ATOM 16231 C CG1 . ILE D 1 150 ? 80.516 75.182 63.325 1.00 10.21 ? 170 ILE E CG1 1 +ATOM 16232 C CG2 . ILE D 1 150 ? 80.153 76.905 65.125 1.00 10.33 ? 170 ILE E CG2 1 +ATOM 16233 C CD1 . ILE D 1 150 ? 79.213 74.478 63.581 1.00 11.32 ? 170 ILE E CD1 1 +ATOM 16234 N N . ALA D 1 151 ? 83.283 78.339 65.612 1.00 9.39 ? 171 ALA E N 1 +ATOM 16235 C CA . ALA D 1 151 ? 83.747 78.985 66.846 1.00 8.67 ? 171 ALA E CA 1 +ATOM 16236 C C . ALA D 1 151 ? 82.546 79.632 67.516 1.00 8.72 ? 171 ALA E C 1 +ATOM 16237 O O . ALA D 1 151 ? 81.794 80.363 66.864 1.00 7.55 ? 171 ALA E O 1 +ATOM 16238 C CB . ALA D 1 151 ? 84.822 80.021 66.561 1.00 9.12 ? 171 ALA E CB 1 +ATOM 16239 N N . ILE D 1 152 ? 82.373 79.354 68.809 1.00 8.69 ? 172 ILE E N 1 +ATOM 16240 C CA . ILE D 1 152 ? 81.229 79.856 69.576 1.00 8.28 ? 172 ILE E CA 1 +ATOM 16241 C C . ILE D 1 152 ? 81.711 80.631 70.796 1.00 8.17 ? 172 ILE E C 1 +ATOM 16242 O O . ILE D 1 152 ? 82.532 80.131 71.568 1.00 8.16 ? 172 ILE E O 1 +ATOM 16243 C CB . ILE D 1 152 ? 80.340 78.717 70.060 1.00 8.47 ? 172 ILE E CB 1 +ATOM 16244 C CG1 . ILE D 1 152 ? 79.804 77.922 68.865 1.00 8.49 ? 172 ILE E CG1 1 +ATOM 16245 C CG2 . ILE D 1 152 ? 79.160 79.263 70.860 1.00 6.88 ? 172 ILE E CG2 1 +ATOM 16246 C CD1 . ILE D 1 152 ? 79.064 76.635 69.255 1.00 10.40 ? 172 ILE E CD1 1 +ATOM 16247 N N . ASN D 1 153 ? 81.200 81.846 70.951 1.00 8.69 ? 173 ASN E N 1 +ATOM 16248 C CA . ASN D 1 153 ? 81.520 82.720 72.089 1.00 8.04 ? 173 ASN E CA 1 +ATOM 16249 C C . ASN D 1 153 ? 80.320 82.753 73.034 1.00 8.43 ? 173 ASN E C 1 +ATOM 16250 O O . ASN D 1 153 ? 79.180 82.944 72.571 1.00 7.97 ? 173 ASN E O 1 +ATOM 16251 C CB . ASN D 1 153 ? 81.840 84.138 71.594 1.00 8.81 ? 173 ASN E CB 1 +ATOM 16252 C CG . ASN D 1 153 ? 82.537 84.985 72.651 1.00 7.69 ? 173 ASN E CG 1 +ATOM 16253 O OD1 . ASN D 1 153 ? 81.957 85.303 73.696 1.00 8.59 ? 173 ASN E OD1 1 +ATOM 16254 N ND2 . ASN D 1 153 ? 83.805 85.332 72.376 1.00 7.53 ? 173 ASN E ND2 1 +ATOM 16255 N N . ASN D 1 154 ? 80.571 82.556 74.332 1.00 7.91 ? 174 ASN E N 1 +ATOM 16256 C CA . ASN D 1 154 ? 79.496 82.437 75.329 1.00 7.27 ? 174 ASN E CA 1 +ATOM 16257 C C . ASN D 1 154 ? 79.422 83.650 76.256 1.00 7.28 ? 174 ASN E C 1 +ATOM 16258 O O . ASN D 1 154 ? 78.762 83.601 77.283 1.00 7.92 ? 174 ASN E O 1 +ATOM 16259 C CB . ASN D 1 154 ? 79.599 81.144 76.147 1.00 7.66 ? 174 ASN E CB 1 +ATOM 16260 C CG . ASN D 1 154 ? 80.855 81.062 76.988 1.00 6.57 ? 174 ASN E CG 1 +ATOM 16261 O OD1 . ASN D 1 154 ? 81.738 81.893 76.878 1.00 7.51 ? 174 ASN E OD1 1 +ATOM 16262 N ND2 . ASN D 1 154 ? 80.951 80.011 77.813 1.00 6.93 ? 174 ASN E ND2 1 +ATOM 16263 N N . THR D 1 155 ? 80.090 84.734 75.880 1.00 7.30 ? 175 THR E N 1 +ATOM 16264 C CA . THR D 1 155 ? 80.130 85.932 76.714 1.00 7.71 ? 175 THR E CA 1 +ATOM 16265 C C . THR D 1 155 ? 78.831 86.716 76.577 1.00 7.85 ? 175 THR E C 1 +ATOM 16266 O O . THR D 1 155 ? 78.437 87.073 75.482 1.00 8.18 ? 175 THR E O 1 +ATOM 16267 C CB . THR D 1 155 ? 81.299 86.849 76.352 1.00 8.12 ? 175 THR E CB 1 +ATOM 16268 O OG1 . THR D 1 155 ? 82.503 86.086 76.312 1.00 6.84 ? 175 THR E OG1 1 +ATOM 16269 C CG2 . THR D 1 155 ? 81.457 87.953 77.401 1.00 7.56 ? 175 THR E CG2 1 +ATOM 16270 N N . LEU D 1 156 ? 78.199 87.011 77.704 1.00 8.65 ? 176 LEU E N 1 +ATOM 16271 C CA . LEU D 1 156 ? 76.983 87.810 77.717 1.00 8.44 ? 176 LEU E CA 1 +ATOM 16272 C C . LEU D 1 156 ? 77.379 89.250 78.039 1.00 9.62 ? 176 LEU E C 1 +ATOM 16273 O O . LEU D 1 156 ? 78.363 89.496 78.753 1.00 9.23 ? 176 LEU E O 1 +ATOM 16274 C CB . LEU D 1 156 ? 75.990 87.252 78.742 1.00 9.14 ? 176 LEU E CB 1 +ATOM 16275 C CG . LEU D 1 156 ? 75.595 85.792 78.479 1.00 9.42 ? 176 LEU E CG 1 +ATOM 16276 C CD1 . LEU D 1 156 ? 74.682 85.244 79.559 1.00 10.04 ? 176 LEU E CD1 1 +ATOM 16277 C CD2 . LEU D 1 156 ? 74.948 85.627 77.114 1.00 9.92 ? 176 LEU E CD2 1 +ATOM 16278 N N . THR D 1 157 ? 76.616 90.191 77.494 1.00 9.75 ? 177 THR E N 1 +ATOM 16279 C CA . THR D 1 157 ? 76.968 91.611 77.532 1.00 10.33 ? 177 THR E CA 1 +ATOM 16280 C C . THR D 1 157 ? 75.725 92.452 77.833 1.00 9.92 ? 177 THR E C 1 +ATOM 16281 O O . THR D 1 157 ? 74.616 91.933 77.811 1.00 10.34 ? 177 THR E O 1 +ATOM 16282 C CB . THR D 1 157 ? 77.530 92.095 76.168 1.00 10.07 ? 177 THR E CB 1 +ATOM 16283 O OG1 . THR D 1 157 ? 76.451 92.300 75.251 1.00 11.24 ? 177 THR E OG1 1 +ATOM 16284 C CG2 . THR D 1 157 ? 78.544 91.090 75.585 1.00 11.29 ? 177 THR E CG2 1 +ATOM 16285 N N . PRO D 1 158 ? 75.898 93.762 78.100 1.00 10.28 ? 178 PRO E N 1 +ATOM 16286 C CA . PRO D 1 158 ? 74.713 94.623 78.234 1.00 10.72 ? 178 PRO E CA 1 +ATOM 16287 C C . PRO D 1 158 ? 73.782 94.662 77.018 1.00 10.99 ? 178 PRO E C 1 +ATOM 16288 O O . PRO D 1 158 ? 72.686 95.198 77.126 1.00 11.20 ? 178 PRO E O 1 +ATOM 16289 C CB . PRO D 1 158 ? 75.310 96.007 78.522 1.00 10.64 ? 178 PRO E CB 1 +ATOM 16290 C CG . PRO D 1 158 ? 76.653 95.710 79.106 1.00 11.12 ? 178 PRO E CG 1 +ATOM 16291 C CD . PRO D 1 158 ? 77.139 94.502 78.378 1.00 10.37 ? 178 PRO E CD 1 +ATOM 16292 N N . THR D 1 159 ? 74.192 94.096 75.888 1.00 10.94 ? 179 THR E N 1 +ATOM 16293 C CA . THR D 1 159 ? 73.361 94.105 74.678 1.00 11.90 ? 179 THR E CA 1 +ATOM 16294 C C . THR D 1 159 ? 73.055 92.709 74.121 1.00 11.41 ? 179 THR E C 1 +ATOM 16295 O O . THR D 1 159 ? 72.570 92.586 72.998 1.00 12.28 ? 179 THR E O 1 +ATOM 16296 C CB . THR D 1 159 ? 74.014 94.983 73.586 1.00 11.81 ? 179 THR E CB 1 +ATOM 16297 O OG1 . THR D 1 159 ? 75.309 94.480 73.275 1.00 14.08 ? 179 THR E OG1 1 +ATOM 16298 C CG2 . THR D 1 159 ? 74.150 96.446 74.075 1.00 14.23 ? 179 THR E CG2 1 +ATOM 16299 N N . THR D 1 160 ? 73.317 91.665 74.908 1.00 10.57 ? 180 THR E N 1 +ATOM 16300 C CA . THR D 1 160 ? 72.864 90.310 74.573 1.00 10.01 ? 180 THR E CA 1 +ATOM 16301 C C . THR D 1 160 ? 71.557 90.003 75.290 1.00 9.80 ? 180 THR E C 1 +ATOM 16302 O O . THR D 1 160 ? 71.164 90.719 76.226 1.00 8.94 ? 180 THR E O 1 +ATOM 16303 C CB . THR D 1 160 ? 73.902 89.239 74.930 1.00 9.68 ? 180 THR E CB 1 +ATOM 16304 O OG1 . THR D 1 160 ? 74.226 89.299 76.321 1.00 8.94 ? 180 THR E OG1 1 +ATOM 16305 C CG2 . THR D 1 160 ? 75.188 89.424 74.114 1.00 9.98 ? 180 THR E CG2 1 +ATOM 16306 N N . LEU D 1 161 ? 70.890 88.953 74.813 1.00 9.98 ? 181 LEU E N 1 +ATOM 16307 C CA . LEU D 1 161 ? 69.719 88.370 75.463 1.00 9.87 ? 181 LEU E CA 1 +ATOM 16308 C C . LEU D 1 161 ? 69.958 86.868 75.646 1.00 9.06 ? 181 LEU E C 1 +ATOM 16309 O O . LEU D 1 161 ? 70.061 86.128 74.666 1.00 8.74 ? 181 LEU E O 1 +ATOM 16310 C CB . LEU D 1 161 ? 68.452 88.581 74.629 1.00 10.55 ? 181 LEU E CB 1 +ATOM 16311 C CG . LEU D 1 161 ? 67.879 89.999 74.554 1.00 11.48 ? 181 LEU E CG 1 +ATOM 16312 C CD1 . LEU D 1 161 ? 66.690 90.019 73.628 1.00 14.07 ? 181 LEU E CD1 1 +ATOM 16313 C CD2 . LEU D 1 161 ? 67.474 90.510 75.932 1.00 11.45 ? 181 LEU E CD2 1 +ATOM 16314 N N . PRO D 1 162 ? 70.073 86.412 76.902 1.00 8.84 ? 182 PRO E N 1 +ATOM 16315 C CA . PRO D 1 162 ? 70.032 87.258 78.093 1.00 8.82 ? 182 PRO E CA 1 +ATOM 16316 C C . PRO D 1 162 ? 71.262 88.172 78.197 1.00 8.11 ? 182 PRO E C 1 +ATOM 16317 O O . PRO D 1 162 ? 72.336 87.841 77.657 1.00 7.97 ? 182 PRO E O 1 +ATOM 16318 C CB . PRO D 1 162 ? 69.989 86.251 79.246 1.00 8.42 ? 182 PRO E CB 1 +ATOM 16319 C CG . PRO D 1 162 ? 70.518 85.023 78.718 1.00 10.40 ? 182 PRO E CG 1 +ATOM 16320 C CD . PRO D 1 162 ? 70.236 84.989 77.243 1.00 9.67 ? 182 PRO E CD 1 +ATOM 16321 N N . PRO D 1 163 ? 71.115 89.316 78.879 1.00 8.35 ? 183 PRO E N 1 +ATOM 16322 C CA . PRO D 1 163 ? 72.273 90.175 79.086 1.00 8.08 ? 183 PRO E CA 1 +ATOM 16323 C C . PRO D 1 163 ? 73.160 89.707 80.229 1.00 7.77 ? 183 PRO E C 1 +ATOM 16324 O O . PRO D 1 163 ? 72.788 88.839 81.011 1.00 6.86 ? 183 PRO E O 1 +ATOM 16325 C CB . PRO D 1 163 ? 71.656 91.532 79.409 1.00 8.49 ? 183 PRO E CB 1 +ATOM 16326 C CG . PRO D 1 163 ? 70.324 91.235 80.007 1.00 9.01 ? 183 PRO E CG 1 +ATOM 16327 C CD . PRO D 1 163 ? 69.885 89.887 79.467 1.00 8.19 ? 183 PRO E CD 1 +ATOM 16328 N N . GLY D 1 164 ? 74.336 90.307 80.320 1.00 7.52 ? 184 GLY E N 1 +ATOM 16329 C CA . GLY D 1 164 ? 75.268 90.017 81.404 1.00 7.81 ? 184 GLY E CA 1 +ATOM 16330 C C . GLY D 1 164 ? 76.343 91.082 81.425 1.00 8.14 ? 184 GLY E C 1 +ATOM 16331 O O . GLY D 1 164 ? 76.364 91.956 80.560 1.00 8.01 ? 184 GLY E O 1 +ATOM 16332 N N . THR D 1 165 ? 77.242 91.012 82.404 1.00 8.33 ? 185 THR E N 1 +ATOM 16333 C CA . THR D 1 165 ? 78.406 91.918 82.436 1.00 8.39 ? 185 THR E CA 1 +ATOM 16334 C C . THR D 1 165 ? 79.656 91.101 82.749 1.00 8.73 ? 185 THR E C 1 +ATOM 16335 O O . THR D 1 165 ? 79.557 89.983 83.265 1.00 8.32 ? 185 THR E O 1 +ATOM 16336 C CB . THR D 1 165 ? 78.255 93.030 83.488 1.00 8.77 ? 185 THR E CB 1 +ATOM 16337 O OG1 . THR D 1 165 ? 78.252 92.469 84.814 1.00 9.62 ? 185 THR E OG1 1 +ATOM 16338 C CG2 . THR D 1 165 ? 76.953 93.827 83.262 1.00 7.29 ? 185 THR E CG2 1 +ATOM 16339 N N . ILE D 1 166 ? 80.822 91.655 82.421 1.00 8.37 ? 186 ILE E N 1 +ATOM 16340 C CA . ILE D 1 166 ? 82.120 91.050 82.774 1.00 8.53 ? 186 ILE E CA 1 +ATOM 16341 C C . ILE D 1 166 ? 82.805 91.966 83.764 1.00 9.03 ? 186 ILE E C 1 +ATOM 16342 O O . ILE D 1 166 ? 82.857 93.172 83.559 1.00 8.63 ? 186 ILE E O 1 +ATOM 16343 C CB . ILE D 1 166 ? 83.031 90.799 81.528 1.00 9.12 ? 186 ILE E CB 1 +ATOM 16344 C CG1 . ILE D 1 166 ? 82.409 89.711 80.627 1.00 8.86 ? 186 ILE E CG1 1 +ATOM 16345 C CG2 . ILE D 1 166 ? 84.442 90.377 81.941 1.00 8.82 ? 186 ILE E CG2 1 +ATOM 16346 C CD1 . ILE D 1 166 ? 82.575 88.243 81.148 1.00 11.57 ? 186 ILE E CD1 1 +ATOM 16347 N N . GLN D 1 167 ? 83.302 91.392 84.857 1.00 10.16 ? 187 GLN E N 1 +ATOM 16348 C CA . GLN D 1 167 ? 83.997 92.164 85.889 1.00 10.91 ? 187 GLN E CA 1 +ATOM 16349 C C . GLN D 1 167 ? 85.438 91.690 85.987 1.00 11.73 ? 187 GLN E C 1 +ATOM 16350 O O . GLN D 1 167 ? 85.698 90.557 86.377 1.00 10.30 ? 187 GLN E O 1 +ATOM 16351 C CB . GLN D 1 167 ? 83.325 91.991 87.258 1.00 11.48 ? 187 GLN E CB 1 +ATOM 16352 C CG . GLN D 1 167 ? 81.818 92.201 87.279 1.00 12.28 ? 187 GLN E CG 1 +ATOM 16353 C CD . GLN D 1 167 ? 81.404 93.549 86.748 1.00 13.42 ? 187 GLN E CD 1 +ATOM 16354 O OE1 . GLN D 1 167 ? 80.494 93.650 85.921 1.00 14.06 ? 187 GLN E OE1 1 +ATOM 16355 N NE2 . GLN D 1 167 ? 82.059 94.594 87.222 1.00 14.25 ? 187 GLN E NE2 1 +ATOM 16356 N N . TYR D 1 168 ? 86.367 92.564 85.616 1.00 12.84 ? 188 TYR E N 1 +ATOM 16357 C CA . TYR D 1 168 ? 87.778 92.334 85.893 1.00 13.88 ? 188 TYR E CA 1 +ATOM 16358 C C . TYR D 1 168 ? 88.064 92.820 87.305 1.00 14.69 ? 188 TYR E C 1 +ATOM 16359 O O . TYR D 1 168 ? 87.758 93.972 87.631 1.00 15.41 ? 188 TYR E O 1 +ATOM 16360 C CB . TYR D 1 168 ? 88.657 93.063 84.873 1.00 13.90 ? 188 TYR E CB 1 +ATOM 16361 C CG . TYR D 1 168 ? 88.825 92.277 83.601 1.00 13.19 ? 188 TYR E CG 1 +ATOM 16362 C CD1 . TYR D 1 168 ? 87.877 92.355 82.589 1.00 13.20 ? 188 TYR E CD1 1 +ATOM 16363 C CD2 . TYR D 1 168 ? 89.923 91.467 83.396 1.00 13.05 ? 188 TYR E CD2 1 +ATOM 16364 C CE1 . TYR D 1 168 ? 88.016 91.633 81.430 1.00 13.56 ? 188 TYR E CE1 1 +ATOM 16365 C CE2 . TYR D 1 168 ? 90.058 90.728 82.229 1.00 12.98 ? 188 TYR E CE2 1 +ATOM 16366 C CZ . TYR D 1 168 ? 89.103 90.825 81.250 1.00 12.39 ? 188 TYR E CZ 1 +ATOM 16367 O OH . TYR D 1 168 ? 89.223 90.097 80.084 1.00 14.72 ? 188 TYR E OH 1 +ATOM 16368 N N . LEU D 1 169 ? 88.594 91.933 88.145 1.00 15.41 ? 189 LEU E N 1 +ATOM 16369 C CA . LEU D 1 169 ? 88.934 92.266 89.535 1.00 15.82 ? 189 LEU E CA 1 +ATOM 16370 C C . LEU D 1 169 ? 90.454 92.322 89.669 1.00 16.08 ? 189 LEU E C 1 +ATOM 16371 O O . LEU D 1 169 ? 91.128 91.295 89.691 1.00 16.09 ? 189 LEU E O 1 +ATOM 16372 C CB . LEU D 1 169 ? 88.339 91.252 90.520 1.00 15.70 ? 189 LEU E CB 1 +ATOM 16373 C CG . LEU D 1 169 ? 86.804 91.156 90.502 1.00 16.50 ? 189 LEU E CG 1 +ATOM 16374 C CD1 . LEU D 1 169 ? 86.280 90.070 91.435 1.00 18.53 ? 189 LEU E CD1 1 +ATOM 16375 C CD2 . LEU D 1 169 ? 86.205 92.511 90.860 1.00 17.42 ? 189 LEU E CD2 1 +ATOM 16376 N N . THR D 1 170 ? 90.976 93.541 89.757 1.00 17.12 ? 190 THR E N 1 +ATOM 16377 C CA . THR D 1 170 ? 92.414 93.777 89.645 1.00 17.64 ? 190 THR E CA 1 +ATOM 16378 C C . THR D 1 170 ? 93.161 93.918 90.974 1.00 18.15 ? 190 THR E C 1 +ATOM 16379 O O . THR D 1 170 ? 94.365 94.189 90.965 1.00 18.31 ? 190 THR E O 1 +ATOM 16380 C CB . THR D 1 170 ? 92.647 95.056 88.833 1.00 17.85 ? 190 THR E CB 1 +ATOM 16381 O OG1 . THR D 1 170 ? 91.906 96.122 89.438 1.00 17.50 ? 190 THR E OG1 1 +ATOM 16382 C CG2 . THR D 1 170 ? 92.177 94.868 87.399 1.00 18.92 ? 190 THR E CG2 1 +ATOM 16383 N N . ASP D 1 171 ? 92.467 93.763 92.106 1.00 18.81 ? 191 ASP E N 1 +ATOM 16384 C CA . ASP D 1 171 ? 93.130 93.711 93.412 1.00 18.63 ? 191 ASP E CA 1 +ATOM 16385 C C . ASP D 1 171 ? 93.877 92.383 93.546 1.00 18.19 ? 191 ASP E C 1 +ATOM 16386 O O . ASP D 1 171 ? 93.300 91.358 93.941 1.00 18.36 ? 191 ASP E O 1 +ATOM 16387 C CB . ASP D 1 171 ? 92.115 93.864 94.548 1.00 19.14 ? 191 ASP E CB 1 +ATOM 16388 C CG . ASP D 1 171 ? 92.772 93.969 95.928 1.00 19.81 ? 191 ASP E CG 1 +ATOM 16389 O OD1 . ASP D 1 171 ? 94.003 93.776 96.055 1.00 21.68 ? 191 ASP E OD1 1 +ATOM 16390 O OD2 . ASP D 1 171 ? 92.045 94.240 96.904 1.00 23.11 ? 191 ASP E OD2 1 +ATOM 16391 N N . THR D 1 172 ? 95.172 92.394 93.240 1.00 17.62 ? 192 THR E N 1 +ATOM 16392 C CA . THR D 1 172 ? 95.932 91.145 93.229 1.00 17.63 ? 192 THR E CA 1 +ATOM 16393 C C . THR D 1 172 ? 96.238 90.576 94.633 1.00 17.12 ? 192 THR E C 1 +ATOM 16394 O O . THR D 1 172 ? 96.851 89.526 94.745 1.00 17.15 ? 192 THR E O 1 +ATOM 16395 C CB . THR D 1 172 ? 97.232 91.280 92.410 1.00 17.83 ? 192 THR E CB 1 +ATOM 16396 O OG1 . THR D 1 172 ? 98.021 92.339 92.952 1.00 19.13 ? 192 THR E OG1 1 +ATOM 16397 C CG2 . THR D 1 172 ? 96.908 91.583 90.962 1.00 18.02 ? 192 THR E CG2 1 +ATOM 16398 N N . SER D 1 173 ? 95.824 91.265 95.696 1.00 17.15 ? 193 SER E N 1 +ATOM 16399 C CA . SER D 1 173 ? 95.904 90.689 97.045 1.00 17.08 ? 193 SER E CA 1 +ATOM 16400 C C . SER D 1 173 ? 94.728 89.742 97.319 1.00 16.90 ? 193 SER E C 1 +ATOM 16401 O O . SER D 1 173 ? 94.764 88.963 98.276 1.00 17.11 ? 193 SER E O 1 +ATOM 16402 C CB . SER D 1 173 ? 95.973 91.780 98.116 1.00 17.08 ? 193 SER E CB 1 +ATOM 16403 O OG . SER D 1 173 ? 94.732 92.447 98.278 1.00 16.94 ? 193 SER E OG 1 +ATOM 16404 N N . LYS D 1 174 ? 93.687 89.829 96.491 1.00 16.50 ? 194 LYS E N 1 +ATOM 16405 C CA . LYS D 1 174 ? 92.503 88.971 96.628 1.00 15.72 ? 194 LYS E CA 1 +ATOM 16406 C C . LYS D 1 174 ? 92.246 88.095 95.402 1.00 15.03 ? 194 LYS E C 1 +ATOM 16407 O O . LYS D 1 174 ? 91.569 87.079 95.517 1.00 14.07 ? 194 LYS E O 1 +ATOM 16408 C CB . LYS D 1 174 ? 91.242 89.800 96.847 1.00 16.26 ? 194 LYS E CB 1 +ATOM 16409 C CG . LYS D 1 174 ? 91.275 90.810 97.985 1.00 16.97 ? 194 LYS E CG 1 +ATOM 16410 C CD . LYS D 1 174 ? 90.097 91.751 97.841 1.00 18.97 ? 194 LYS E CD 1 +ATOM 16411 C CE . LYS D 1 174 ? 89.617 92.658 98.464 0.00 17.03 ? 194 LYS E CE 1 +ATOM 16412 N NZ . LYS D 1 174 ? 88.154 92.649 98.161 0.00 17.03 ? 194 LYS E NZ 1 +ATOM 16413 N N . TYR D 1 175 ? 92.726 88.508 94.225 1.00 13.73 ? 195 TYR E N 1 +ATOM 16414 C CA . TYR D 1 175 ? 92.479 87.769 92.994 1.00 13.73 ? 195 TYR E CA 1 +ATOM 16415 C C . TYR D 1 175 ? 93.730 87.656 92.130 1.00 13.67 ? 195 TYR E C 1 +ATOM 16416 O O . TYR D 1 175 ? 94.474 88.622 92.003 1.00 13.08 ? 195 TYR E O 1 +ATOM 16417 C CB . TYR D 1 175 ? 91.389 88.458 92.178 1.00 13.28 ? 195 TYR E CB 1 +ATOM 16418 C CG . TYR D 1 175 ? 90.077 88.629 92.900 1.00 13.66 ? 195 TYR E CG 1 +ATOM 16419 C CD1 . TYR D 1 175 ? 89.773 89.813 93.560 1.00 12.94 ? 195 TYR E CD1 1 +ATOM 16420 C CD2 . TYR D 1 175 ? 89.136 87.611 92.914 1.00 13.94 ? 195 TYR E CD2 1 +ATOM 16421 C CE1 . TYR D 1 175 ? 88.562 89.978 94.226 1.00 13.87 ? 195 TYR E CE1 1 +ATOM 16422 C CE2 . TYR D 1 175 ? 87.923 87.765 93.570 1.00 13.92 ? 195 TYR E CE2 1 +ATOM 16423 C CZ . TYR D 1 175 ? 87.637 88.952 94.214 1.00 13.18 ? 195 TYR E CZ 1 +ATOM 16424 O OH . TYR D 1 175 ? 86.442 89.094 94.875 1.00 13.66 ? 195 TYR E OH 1 +ATOM 16425 N N . PRO D 1 176 ? 93.945 86.490 91.497 1.00 14.11 ? 196 PRO E N 1 +ATOM 16426 C CA . PRO D 1 176 ? 95.137 86.381 90.648 1.00 14.35 ? 196 PRO E CA 1 +ATOM 16427 C C . PRO D 1 176 ? 95.093 87.319 89.439 1.00 14.43 ? 196 PRO E C 1 +ATOM 16428 O O . PRO D 1 176 ? 94.021 87.724 88.986 1.00 13.25 ? 196 PRO E O 1 +ATOM 16429 C CB . PRO D 1 176 ? 95.118 84.919 90.193 1.00 14.47 ? 196 PRO E CB 1 +ATOM 16430 C CG . PRO D 1 176 ? 93.658 84.533 90.259 1.00 14.76 ? 196 PRO E CG 1 +ATOM 16431 C CD . PRO D 1 176 ? 93.153 85.243 91.486 1.00 14.55 ? 196 PRO E CD 1 +ATOM 16432 N N . LYS D 1 177 ? 96.273 87.664 88.929 1.00 14.88 ? 197 LYS E N 1 +ATOM 16433 C CA . LYS D 1 177 ? 96.386 88.527 87.765 1.00 15.27 ? 197 LYS E CA 1 +ATOM 16434 C C . LYS D 1 177 ? 95.495 88.029 86.634 1.00 14.70 ? 197 LYS E C 1 +ATOM 16435 O O . LYS D 1 177 ? 95.532 86.854 86.281 1.00 15.14 ? 197 LYS E O 1 +ATOM 16436 C CB . LYS D 1 177 ? 97.838 88.583 87.282 1.00 15.73 ? 197 LYS E CB 1 +ATOM 16437 C CG . LYS D 1 177 ? 98.115 89.727 86.315 1.00 18.49 ? 197 LYS E CG 1 +ATOM 16438 C CD . LYS D 1 177 ? 99.592 89.756 85.915 1.00 20.78 ? 197 LYS E CD 1 +ATOM 16439 C CE . LYS D 1 177 ? 99.981 88.558 85.035 1.00 21.65 ? 197 LYS E CE 1 +ATOM 16440 N NZ . LYS D 1 177 ? 101.385 88.651 84.523 1.00 23.82 ? 197 LYS E NZ 1 +ATOM 16441 N N . GLY D 1 178 ? 94.661 88.926 86.111 1.00 14.43 ? 198 GLY E N 1 +ATOM 16442 C CA . GLY D 1 178 ? 93.788 88.624 84.977 1.00 13.47 ? 198 GLY E CA 1 +ATOM 16443 C C . GLY D 1 178 ? 92.399 88.116 85.316 1.00 13.08 ? 198 GLY E C 1 +ATOM 16444 O O . GLY D 1 178 ? 91.591 87.891 84.423 1.00 12.99 ? 198 GLY E O 1 +ATOM 16445 N N . TYR D 1 179 ? 92.121 87.946 86.601 1.00 12.33 ? 199 TYR E N 1 +ATOM 16446 C CA . TYR D 1 179 ? 90.834 87.404 87.055 1.00 11.59 ? 199 TYR E CA 1 +ATOM 16447 C C . TYR D 1 179 ? 89.645 88.224 86.568 1.00 11.14 ? 199 TYR E C 1 +ATOM 16448 O O . TYR D 1 179 ? 89.600 89.457 86.723 1.00 10.13 ? 199 TYR E O 1 +ATOM 16449 C CB . TYR D 1 179 ? 90.823 87.349 88.584 1.00 11.85 ? 199 TYR E CB 1 +ATOM 16450 C CG . TYR D 1 179 ? 89.603 86.703 89.221 1.00 10.94 ? 199 TYR E CG 1 +ATOM 16451 C CD1 . TYR D 1 179 ? 88.461 87.443 89.484 1.00 11.70 ? 199 TYR E CD1 1 +ATOM 16452 C CD2 . TYR D 1 179 ? 89.607 85.348 89.565 1.00 11.77 ? 199 TYR E CD2 1 +ATOM 16453 C CE1 . TYR D 1 179 ? 87.350 86.862 90.084 1.00 11.42 ? 199 TYR E CE1 1 +ATOM 16454 C CE2 . TYR D 1 179 ? 88.507 84.755 90.164 1.00 11.17 ? 199 TYR E CE2 1 +ATOM 16455 C CZ . TYR D 1 179 ? 87.379 85.516 90.420 1.00 11.76 ? 199 TYR E CZ 1 +ATOM 16456 O OH . TYR D 1 179 ? 86.276 84.919 91.000 1.00 12.34 ? 199 TYR E OH 1 +ATOM 16457 N N . PHE D 1 180 ? 88.673 87.523 85.991 1.00 10.93 ? 200 PHE E N 1 +ATOM 16458 C CA . PHE D 1 180 ? 87.383 88.127 85.705 1.00 10.21 ? 200 PHE E CA 1 +ATOM 16459 C C . PHE D 1 180 ? 86.271 87.115 85.863 1.00 9.89 ? 200 PHE E C 1 +ATOM 16460 O O . PHE D 1 180 ? 86.496 85.922 85.811 1.00 9.21 ? 200 PHE E O 1 +ATOM 16461 C CB . PHE D 1 180 ? 87.334 88.729 84.304 1.00 10.45 ? 200 PHE E CB 1 +ATOM 16462 C CG . PHE D 1 180 ? 87.345 87.714 83.184 1.00 10.28 ? 200 PHE E CG 1 +ATOM 16463 C CD1 . PHE D 1 180 ? 88.530 87.218 82.686 1.00 11.92 ? 200 PHE E CD1 1 +ATOM 16464 C CD2 . PHE D 1 180 ? 86.164 87.300 82.596 1.00 10.04 ? 200 PHE E CD2 1 +ATOM 16465 C CE1 . PHE D 1 180 ? 88.532 86.298 81.628 1.00 11.31 ? 200 PHE E CE1 1 +ATOM 16466 C CE2 . PHE D 1 180 ? 86.167 86.372 81.548 1.00 9.25 ? 200 PHE E CE2 1 +ATOM 16467 C CZ . PHE D 1 180 ? 87.349 85.886 81.070 1.00 10.54 ? 200 PHE E CZ 1 +ATOM 16468 N N . VAL D 1 181 ? 85.062 87.633 86.022 1.00 10.01 ? 201 VAL E N 1 +ATOM 16469 C CA . VAL D 1 181 ? 83.885 86.802 86.136 1.00 9.69 ? 201 VAL E CA 1 +ATOM 16470 C C . VAL D 1 181 ? 82.770 87.384 85.290 1.00 9.61 ? 201 VAL E C 1 +ATOM 16471 O O . VAL D 1 181 ? 82.719 88.599 85.027 1.00 9.91 ? 201 VAL E O 1 +ATOM 16472 C CB . VAL D 1 181 ? 83.406 86.696 87.598 1.00 10.09 ? 201 VAL E CB 1 +ATOM 16473 C CG1 . VAL D 1 181 ? 84.419 85.879 88.424 1.00 10.45 ? 201 VAL E CG1 1 +ATOM 16474 C CG2 . VAL D 1 181 ? 83.219 88.076 88.202 1.00 10.18 ? 201 VAL E CG2 1 +ATOM 16475 N N . GLN D 1 182 ? 81.895 86.486 84.868 1.00 9.13 ? 202 GLN E N 1 +ATOM 16476 C CA . GLN D 1 182 ? 80.646 86.823 84.216 1.00 8.59 ? 202 GLN E CA 1 +ATOM 16477 C C . GLN D 1 182 ? 79.561 86.973 85.285 1.00 8.52 ? 202 GLN E C 1 +ATOM 16478 O O . GLN D 1 182 ? 79.297 86.021 86.040 1.00 9.21 ? 202 GLN E O 1 +ATOM 16479 C CB . GLN D 1 182 ? 80.273 85.700 83.243 1.00 8.49 ? 202 GLN E CB 1 +ATOM 16480 C CG . GLN D 1 182 ? 78.902 85.849 82.587 1.00 8.35 ? 202 GLN E CG 1 +ATOM 16481 C CD . GLN D 1 182 ? 78.948 86.638 81.306 1.00 7.50 ? 202 GLN E CD 1 +ATOM 16482 O OE1 . GLN D 1 182 ? 79.194 86.078 80.238 1.00 9.70 ? 202 GLN E OE1 1 +ATOM 16483 N NE2 . GLN D 1 182 ? 78.691 87.950 81.393 1.00 7.32 ? 202 GLN E NE2 1 +ATOM 16484 N N . ASN D 1 183 ? 78.954 88.161 85.349 1.00 8.31 ? 203 ASN E N 1 +ATOM 16485 C CA . ASN D 1 183 ? 77.780 88.433 86.177 1.00 8.56 ? 203 ASN E CA 1 +ATOM 16486 C C . ASN D 1 183 ? 76.521 88.238 85.360 1.00 8.34 ? 203 ASN E C 1 +ATOM 16487 O O . ASN D 1 183 ? 76.457 88.644 84.196 1.00 9.02 ? 203 ASN E O 1 +ATOM 16488 C CB . ASN D 1 183 ? 77.798 89.870 86.714 1.00 9.19 ? 203 ASN E CB 1 +ATOM 16489 C CG . ASN D 1 183 ? 78.738 90.048 87.894 1.00 11.09 ? 203 ASN E CG 1 +ATOM 16490 O OD1 . ASN D 1 183 ? 79.341 89.088 88.372 1.00 12.58 ? 203 ASN E OD1 1 +ATOM 16491 N ND2 . ASN D 1 183 ? 78.844 91.290 88.387 1.00 12.18 ? 203 ASN E ND2 1 +ATOM 16492 N N . THR D 1 184 ? 75.515 87.630 85.976 1.00 8.27 ? 204 THR E N 1 +ATOM 16493 C CA . THR D 1 184 ? 74.216 87.436 85.337 1.00 8.38 ? 204 THR E CA 1 +ATOM 16494 C C . THR D 1 184 ? 73.128 87.644 86.372 1.00 8.31 ? 204 THR E C 1 +ATOM 16495 O O . THR D 1 184 ? 73.386 87.609 87.572 1.00 8.28 ? 204 THR E O 1 +ATOM 16496 C CB . THR D 1 184 ? 74.069 86.025 84.707 1.00 7.91 ? 204 THR E CB 1 +ATOM 16497 O OG1 . THR D 1 184 ? 74.287 85.033 85.703 1.00 8.68 ? 204 THR E OG1 1 +ATOM 16498 C CG2 . THR D 1 184 ? 75.067 85.797 83.571 1.00 9.08 ? 204 THR E CG2 1 +ATOM 16499 N N . TYR D 1 185 ? 71.906 87.851 85.901 1.00 8.71 ? 205 TYR E N 1 +ATOM 16500 C CA . TYR D 1 185 ? 70.776 88.151 86.784 1.00 8.98 ? 205 TYR E CA 1 +ATOM 16501 C C . TYR D 1 185 ? 69.570 87.289 86.441 1.00 9.25 ? 205 TYR E C 1 +ATOM 16502 O O . TYR D 1 185 ? 68.422 87.681 86.690 1.00 9.63 ? 205 TYR E O 1 +ATOM 16503 C CB . TYR D 1 185 ? 70.442 89.642 86.728 1.00 9.98 ? 205 TYR E CB 1 +ATOM 16504 C CG . TYR D 1 185 ? 71.611 90.496 87.098 1.00 10.64 ? 205 TYR E CG 1 +ATOM 16505 C CD1 . TYR D 1 185 ? 71.797 90.939 88.402 1.00 10.92 ? 205 TYR E CD1 1 +ATOM 16506 C CD2 . TYR D 1 185 ? 72.554 90.853 86.140 1.00 10.80 ? 205 TYR E CD2 1 +ATOM 16507 C CE1 . TYR D 1 185 ? 72.903 91.698 88.744 1.00 13.28 ? 205 TYR E CE1 1 +ATOM 16508 C CE2 . TYR D 1 185 ? 73.658 91.608 86.475 1.00 10.42 ? 205 TYR E CE2 1 +ATOM 16509 C CZ . TYR D 1 185 ? 73.823 92.030 87.771 1.00 12.20 ? 205 TYR E CZ 1 +ATOM 16510 O OH . TYR D 1 185 ? 74.925 92.784 88.097 1.00 14.05 ? 205 TYR E OH 1 +ATOM 16511 N N . PHE D 1 186 ? 69.857 86.102 85.901 1.00 8.54 ? 206 PHE E N 1 +ATOM 16512 C CA . PHE D 1 186 ? 68.872 85.092 85.611 1.00 8.27 ? 206 PHE E CA 1 +ATOM 16513 C C . PHE D 1 186 ? 69.219 83.799 86.342 1.00 7.06 ? 206 PHE E C 1 +ATOM 16514 O O . PHE D 1 186 ? 70.396 83.524 86.633 1.00 6.66 ? 206 PHE E O 1 +ATOM 16515 C CB . PHE D 1 186 ? 68.712 84.861 84.105 1.00 8.59 ? 206 PHE E CB 1 +ATOM 16516 C CG . PHE D 1 186 ? 69.994 84.563 83.355 1.00 8.95 ? 206 PHE E CG 1 +ATOM 16517 C CD1 . PHE D 1 186 ? 70.426 83.262 83.182 1.00 8.76 ? 206 PHE E CD1 1 +ATOM 16518 C CD2 . PHE D 1 186 ? 70.721 85.590 82.763 1.00 8.50 ? 206 PHE E CD2 1 +ATOM 16519 C CE1 . PHE D 1 186 ? 71.601 82.984 82.449 1.00 9.11 ? 206 PHE E CE1 1 +ATOM 16520 C CE2 . PHE D 1 186 ? 71.886 85.330 82.035 1.00 9.77 ? 206 PHE E CE2 1 +ATOM 16521 C CZ . PHE D 1 186 ? 72.325 84.024 81.885 1.00 9.54 ? 206 PHE E CZ 1 +ATOM 16522 N N . ASP D 1 187 ? 68.179 83.048 86.684 1.00 6.43 ? 207 ASP E N 1 +ATOM 16523 C CA . ASP D 1 187 ? 68.320 81.844 87.534 1.00 6.88 ? 207 ASP E CA 1 +ATOM 16524 C C . ASP D 1 187 ? 68.412 80.513 86.750 1.00 7.31 ? 207 ASP E C 1 +ATOM 16525 O O . ASP D 1 187 ? 67.609 79.596 86.925 1.00 7.22 ? 207 ASP E O 1 +ATOM 16526 C CB . ASP D 1 187 ? 67.161 81.843 88.531 1.00 6.76 ? 207 ASP E CB 1 +ATOM 16527 C CG . ASP D 1 187 ? 67.328 80.855 89.657 1.00 7.89 ? 207 ASP E CG 1 +ATOM 16528 O OD1 . ASP D 1 187 ? 68.463 80.604 90.120 1.00 7.42 ? 207 ASP E OD1 1 +ATOM 16529 O OD2 . ASP D 1 187 ? 66.271 80.355 90.111 1.00 7.05 ? 207 ASP E OD2 1 +ATOM 16530 N N . PHE D 1 188 ? 69.409 80.416 85.877 1.00 7.24 ? 208 PHE E N 1 +ATOM 16531 C CA . PHE D 1 188 ? 69.734 79.160 85.218 1.00 6.74 ? 208 PHE E CA 1 +ATOM 16532 C C . PHE D 1 188 ? 71.159 79.224 84.689 1.00 6.99 ? 208 PHE E C 1 +ATOM 16533 O O . PHE D 1 188 ? 71.648 80.301 84.332 1.00 7.21 ? 208 PHE E O 1 +ATOM 16534 C CB . PHE D 1 188 ? 68.712 78.768 84.125 1.00 7.64 ? 208 PHE E CB 1 +ATOM 16535 C CG . PHE D 1 188 ? 68.543 79.776 83.029 1.00 7.44 ? 208 PHE E CG 1 +ATOM 16536 C CD1 . PHE D 1 188 ? 69.360 79.760 81.909 1.00 8.83 ? 208 PHE E CD1 1 +ATOM 16537 C CD2 . PHE D 1 188 ? 67.539 80.719 83.094 1.00 7.64 ? 208 PHE E CD2 1 +ATOM 16538 C CE1 . PHE D 1 188 ? 69.203 80.697 80.892 1.00 8.20 ? 208 PHE E CE1 1 +ATOM 16539 C CE2 . PHE D 1 188 ? 67.371 81.661 82.070 1.00 7.78 ? 208 PHE E CE2 1 +ATOM 16540 C CZ . PHE D 1 188 ? 68.195 81.636 80.972 1.00 8.02 ? 208 PHE E CZ 1 +ATOM 16541 N N . PHE D 1 189 ? 71.829 78.080 84.645 1.00 7.14 ? 209 PHE E N 1 +ATOM 16542 C CA . PHE D 1 189 ? 73.243 78.072 84.289 1.00 6.77 ? 209 PHE E CA 1 +ATOM 16543 C C . PHE D 1 189 ? 73.438 78.377 82.808 1.00 7.02 ? 209 PHE E C 1 +ATOM 16544 O O . PHE D 1 189 ? 72.717 77.858 81.945 1.00 7.19 ? 209 PHE E O 1 +ATOM 16545 C CB . PHE D 1 189 ? 73.879 76.744 84.654 1.00 7.05 ? 209 PHE E CB 1 +ATOM 16546 C CG . PHE D 1 189 ? 75.361 76.738 84.518 1.00 6.59 ? 209 PHE E CG 1 +ATOM 16547 C CD1 . PHE D 1 189 ? 76.145 77.367 85.452 1.00 9.04 ? 209 PHE E CD1 1 +ATOM 16548 C CD2 . PHE D 1 189 ? 75.973 76.099 83.456 1.00 7.90 ? 209 PHE E CD2 1 +ATOM 16549 C CE1 . PHE D 1 189 ? 77.532 77.361 85.331 1.00 9.03 ? 209 PHE E CE1 1 +ATOM 16550 C CE2 . PHE D 1 189 ? 77.344 76.075 83.337 1.00 7.57 ? 209 PHE E CE2 1 +ATOM 16551 C CZ . PHE D 1 189 ? 78.124 76.708 84.265 1.00 8.62 ? 209 PHE E CZ 1 +ATOM 16552 N N . ASN D 1 190 ? 74.433 79.213 82.516 1.00 7.00 ? 210 ASN E N 1 +ATOM 16553 C CA . ASN D 1 190 ? 74.692 79.652 81.156 1.00 6.85 ? 210 ASN E CA 1 +ATOM 16554 C C . ASN D 1 190 ? 75.536 78.607 80.413 1.00 7.35 ? 210 ASN E C 1 +ATOM 16555 O O . ASN D 1 190 ? 76.658 78.902 79.966 1.00 7.45 ? 210 ASN E O 1 +ATOM 16556 C CB . ASN D 1 190 ? 75.386 81.015 81.156 1.00 7.39 ? 210 ASN E CB 1 +ATOM 16557 C CG . ASN D 1 190 ? 75.589 81.564 79.767 1.00 5.91 ? 210 ASN E CG 1 +ATOM 16558 O OD1 . ASN D 1 190 ? 74.695 81.523 78.936 1.00 9.56 ? 210 ASN E OD1 1 +ATOM 16559 N ND2 . ASN D 1 190 ? 76.785 82.057 79.503 1.00 5.40 ? 210 ASN E ND2 1 +ATOM 16560 N N . TYR D 1 191 ? 74.996 77.388 80.316 1.00 7.13 ? 211 TYR E N 1 +ATOM 16561 C CA . TYR D 1 191 ? 75.541 76.330 79.472 1.00 6.96 ? 211 TYR E CA 1 +ATOM 16562 C C . TYR D 1 191 ? 75.795 76.829 78.061 1.00 7.15 ? 211 TYR E C 1 +ATOM 16563 O O . TYR D 1 191 ? 75.111 77.723 77.569 1.00 7.55 ? 211 TYR E O 1 +ATOM 16564 C CB . TYR D 1 191 ? 74.565 75.145 79.375 1.00 7.24 ? 211 TYR E CB 1 +ATOM 16565 C CG . TYR D 1 191 ? 74.518 74.211 80.572 1.00 7.08 ? 211 TYR E CG 1 +ATOM 16566 C CD1 . TYR D 1 191 ? 75.581 73.338 80.851 1.00 8.05 ? 211 TYR E CD1 1 +ATOM 16567 C CD2 . TYR D 1 191 ? 73.398 74.169 81.408 1.00 7.81 ? 211 TYR E CD2 1 +ATOM 16568 C CE1 . TYR D 1 191 ? 75.547 72.475 81.952 1.00 7.55 ? 211 TYR E CE1 1 +ATOM 16569 C CE2 . TYR D 1 191 ? 73.353 73.293 82.507 1.00 7.63 ? 211 TYR E CE2 1 +ATOM 16570 C CZ . TYR D 1 191 ? 74.435 72.447 82.760 1.00 7.97 ? 211 TYR E CZ 1 +ATOM 16571 O OH . TYR D 1 191 ? 74.398 71.584 83.837 1.00 7.86 ? 211 TYR E OH 1 +ATOM 16572 N N . ALA D 1 192 ? 76.783 76.219 77.408 1.00 6.53 ? 212 ALA E N 1 +ATOM 16573 C CA . ALA D 1 192 ? 77.095 76.531 76.028 1.00 6.93 ? 212 ALA E CA 1 +ATOM 16574 C C . ALA D 1 192 ? 77.520 75.283 75.267 1.00 6.93 ? 212 ALA E C 1 +ATOM 16575 O O . ALA D 1 192 ? 77.861 74.250 75.863 1.00 6.11 ? 212 ALA E O 1 +ATOM 16576 C CB . ALA D 1 192 ? 78.194 77.645 75.944 1.00 6.18 ? 212 ALA E CB 1 +ATOM 16577 N N . GLY D 1 193 ? 77.477 75.404 73.942 1.00 7.91 ? 213 GLY E N 1 +ATOM 16578 C CA . GLY D 1 193 ? 77.933 74.366 73.026 1.00 8.24 ? 213 GLY E CA 1 +ATOM 16579 C C . GLY D 1 193 ? 77.063 74.301 71.788 1.00 8.49 ? 213 GLY E C 1 +ATOM 16580 O O . GLY D 1 193 ? 76.275 75.223 71.528 1.00 10.02 ? 213 GLY E O 1 +ATOM 16581 N N . LEU D 1 194 ? 77.208 73.205 71.038 1.00 8.45 ? 214 LEU E N 1 +ATOM 16582 C CA . LEU D 1 194 ? 76.280 72.882 69.961 1.00 7.94 ? 214 LEU E CA 1 +ATOM 16583 C C . LEU D 1 194 ? 75.220 72.009 70.609 1.00 7.61 ? 214 LEU E C 1 +ATOM 16584 O O . LEU D 1 194 ? 75.289 70.773 70.584 1.00 6.80 ? 214 LEU E O 1 +ATOM 16585 C CB . LEU D 1 194 ? 76.973 72.181 68.793 1.00 7.68 ? 214 LEU E CB 1 +ATOM 16586 C CG . LEU D 1 194 ? 77.963 73.050 68.030 1.00 9.04 ? 214 LEU E CG 1 +ATOM 16587 C CD1 . LEU D 1 194 ? 78.728 72.189 67.023 1.00 8.45 ? 214 LEU E CD1 1 +ATOM 16588 C CD2 . LEU D 1 194 ? 77.245 74.231 67.370 1.00 9.13 ? 214 LEU E CD2 1 +ATOM 16589 N N . GLN D 1 195 ? 74.247 72.682 71.218 1.00 6.86 ? 215 GLN E N 1 +ATOM 16590 C CA . GLN D 1 195 ? 73.215 72.047 72.058 1.00 6.94 ? 215 GLN E CA 1 +ATOM 16591 C C . GLN D 1 195 ? 72.003 71.536 71.297 1.00 7.42 ? 215 GLN E C 1 +ATOM 16592 O O . GLN D 1 195 ? 71.139 70.882 71.893 1.00 7.38 ? 215 GLN E O 1 +ATOM 16593 C CB . GLN D 1 195 ? 72.750 73.044 73.118 1.00 6.50 ? 215 GLN E CB 1 +ATOM 16594 C CG . GLN D 1 195 ? 73.910 73.523 73.929 1.00 6.43 ? 215 GLN E CG 1 +ATOM 16595 C CD . GLN D 1 195 ? 73.631 74.662 74.874 1.00 7.53 ? 215 GLN E CD 1 +ATOM 16596 O OE1 . GLN D 1 195 ? 74.029 74.594 76.027 1.00 8.74 ? 215 GLN E OE1 1 +ATOM 16597 N NE2 . GLN D 1 195 ? 73.002 75.737 74.389 1.00 7.41 ? 215 GLN E NE2 1 +ATOM 16598 N N . ARG D 1 196 ? 71.932 71.839 70.001 1.00 8.30 ? 216 ARG E N 1 +ATOM 16599 C CA . ARG D 1 196 ? 70.883 71.324 69.115 1.00 9.51 ? 216 ARG E CA 1 +ATOM 16600 C C . ARG D 1 196 ? 71.493 70.777 67.849 1.00 10.39 ? 216 ARG E C 1 +ATOM 16601 O O . ARG D 1 196 ? 72.650 71.070 67.542 1.00 9.89 ? 216 ARG E O 1 +ATOM 16602 C CB . ARG D 1 196 ? 69.871 72.431 68.807 1.00 9.77 ? 216 ARG E CB 1 +ATOM 16603 C CG . ARG D 1 196 ? 69.157 72.872 70.050 1.00 10.09 ? 216 ARG E CG 1 +ATOM 16604 C CD . ARG D 1 196 ? 68.032 73.850 69.804 1.00 9.74 ? 216 ARG E CD 1 +ATOM 16605 N NE . ARG D 1 196 ? 67.569 74.388 71.079 1.00 9.78 ? 216 ARG E NE 1 +ATOM 16606 C CZ . ARG D 1 196 ? 66.931 75.546 71.242 1.00 9.99 ? 216 ARG E CZ 1 +ATOM 16607 N NH1 . ARG D 1 196 ? 66.607 76.283 70.205 1.00 9.39 ? 216 ARG E NH1 1 +ATOM 16608 N NH2 . ARG D 1 196 ? 66.588 75.961 72.450 1.00 9.79 ? 216 ARG E NH2 1 +ATOM 16609 N N . SER D 1 197 ? 70.714 69.960 67.133 1.00 11.70 ? 217 SER E N 1 +ATOM 16610 C CA . SER D 1 197 ? 71.200 69.206 65.985 1.00 13.07 ? 217 SER E CA 1 +ATOM 16611 C C . SER D 1 197 ? 71.766 70.116 64.897 1.00 13.20 ? 217 SER E C 1 +ATOM 16612 O O . SER D 1 197 ? 71.200 71.180 64.600 1.00 13.30 ? 217 SER E O 1 +ATOM 16613 C CB . SER D 1 197 ? 70.074 68.328 65.407 1.00 13.67 ? 217 SER E CB 1 +ATOM 16614 O OG . SER D 1 197 ? 69.102 68.038 66.402 1.00 16.99 ? 217 SER E OG 1 +ATOM 16615 N N . VAL D 1 198 ? 72.909 69.704 64.350 1.00 13.04 ? 218 VAL E N 1 +ATOM 16616 C CA . VAL D 1 198 ? 73.476 70.303 63.160 1.00 13.56 ? 218 VAL E CA 1 +ATOM 16617 C C . VAL D 1 198 ? 73.234 69.291 62.053 1.00 13.75 ? 218 VAL E C 1 +ATOM 16618 O O . VAL D 1 198 ? 73.328 68.069 62.271 1.00 13.53 ? 218 VAL E O 1 +ATOM 16619 C CB . VAL D 1 198 ? 74.992 70.604 63.310 1.00 13.37 ? 218 VAL E CB 1 +ATOM 16620 C CG1 . VAL D 1 198 ? 75.569 71.090 62.013 1.00 14.12 ? 218 VAL E CG1 1 +ATOM 16621 C CG2 . VAL D 1 198 ? 75.245 71.626 64.427 1.00 14.12 ? 218 VAL E CG2 1 +ATOM 16622 N N . LEU D 1 199 ? 72.872 69.801 60.885 1.00 13.60 ? 219 LEU E N 1 +ATOM 16623 C CA . LEU D 1 199 ? 72.582 68.961 59.736 1.00 14.08 ? 219 LEU E CA 1 +ATOM 16624 C C . LEU D 1 199 ? 72.875 69.678 58.418 1.00 13.54 ? 219 LEU E C 1 +ATOM 16625 O O . LEU D 1 199 ? 72.918 70.906 58.343 1.00 13.38 ? 219 LEU E O 1 +ATOM 16626 C CB . LEU D 1 199 ? 71.125 68.503 59.754 1.00 14.33 ? 219 LEU E CB 1 +ATOM 16627 C CG . LEU D 1 199 ? 70.023 69.530 59.468 1.00 14.50 ? 219 LEU E CG 1 +ATOM 16628 C CD1 . LEU D 1 199 ? 68.867 68.832 58.741 1.00 16.79 ? 219 LEU E CD1 1 +ATOM 16629 C CD2 . LEU D 1 199 ? 69.535 70.208 60.748 1.00 15.61 ? 219 LEU E CD2 1 +ATOM 16630 N N . LEU D 1 200 ? 73.095 68.885 57.381 1.00 13.45 ? 220 LEU E N 1 +ATOM 16631 C CA . LEU D 1 200 ? 73.110 69.394 56.012 1.00 12.89 ? 220 LEU E CA 1 +ATOM 16632 C C . LEU D 1 200 ? 71.789 68.989 55.366 1.00 12.56 ? 220 LEU E C 1 +ATOM 16633 O O . LEU D 1 200 ? 71.232 67.932 55.680 1.00 12.23 ? 220 LEU E O 1 +ATOM 16634 C CB . LEU D 1 200 ? 74.281 68.776 55.240 1.00 13.49 ? 220 LEU E CB 1 +ATOM 16635 C CG . LEU D 1 200 ? 75.662 69.253 55.699 1.00 13.24 ? 220 LEU E CG 1 +ATOM 16636 C CD1 . LEU D 1 200 ? 76.703 68.157 55.464 1.00 13.74 ? 220 LEU E CD1 1 +ATOM 16637 C CD2 . LEU D 1 200 ? 76.047 70.549 55.002 1.00 14.72 ? 220 LEU E CD2 1 +ATOM 16638 N N . TYR D 1 201 ? 71.260 69.821 54.479 1.00 12.43 ? 221 TYR E N 1 +ATOM 16639 C CA . TYR D 1 201 ? 70.076 69.406 53.712 1.00 12.49 ? 221 TYR E CA 1 +ATOM 16640 C C . TYR D 1 201 ? 70.103 69.958 52.298 1.00 12.91 ? 221 TYR E C 1 +ATOM 16641 O O . TYR D 1 201 ? 70.890 70.863 51.998 1.00 12.84 ? 221 TYR E O 1 +ATOM 16642 C CB . TYR D 1 201 ? 68.763 69.727 54.459 1.00 12.75 ? 221 TYR E CB 1 +ATOM 16643 C CG . TYR D 1 201 ? 68.326 71.181 54.544 1.00 11.87 ? 221 TYR E CG 1 +ATOM 16644 C CD1 . TYR D 1 201 ? 67.537 71.745 53.546 1.00 12.82 ? 221 TYR E CD1 1 +ATOM 16645 C CD2 . TYR D 1 201 ? 68.655 71.975 55.642 1.00 12.57 ? 221 TYR E CD2 1 +ATOM 16646 C CE1 . TYR D 1 201 ? 67.104 73.050 53.620 1.00 12.86 ? 221 TYR E CE1 1 +ATOM 16647 C CE2 . TYR D 1 201 ? 68.225 73.301 55.730 1.00 13.26 ? 221 TYR E CE2 1 +ATOM 16648 C CZ . TYR D 1 201 ? 67.451 73.834 54.708 1.00 12.58 ? 221 TYR E CZ 1 +ATOM 16649 O OH . TYR D 1 201 ? 66.998 75.134 54.760 1.00 12.07 ? 221 TYR E OH 1 +ATOM 16650 N N . THR D 1 202 ? 69.288 69.368 51.423 1.00 13.34 ? 222 THR E N 1 +ATOM 16651 C CA . THR D 1 202 ? 69.229 69.791 50.024 1.00 13.31 ? 222 THR E CA 1 +ATOM 16652 C C . THR D 1 202 ? 67.836 70.242 49.608 1.00 13.33 ? 222 THR E C 1 +ATOM 16653 O O . THR D 1 202 ? 66.832 69.778 50.139 1.00 13.45 ? 222 THR E O 1 +ATOM 16654 C CB . THR D 1 202 ? 69.695 68.689 49.056 1.00 13.53 ? 222 THR E CB 1 +ATOM 16655 O OG1 . THR D 1 202 ? 68.794 67.574 49.101 1.00 12.32 ? 222 THR E OG1 1 +ATOM 16656 C CG2 . THR D 1 202 ? 71.108 68.228 49.419 1.00 13.60 ? 222 THR E CG2 1 +ATOM 16657 N N . THR D 1 203 ? 67.816 71.186 48.674 1.00 13.30 ? 223 THR E N 1 +ATOM 16658 C CA . THR D 1 203 ? 66.613 71.560 47.922 1.00 13.25 ? 223 THR E CA 1 +ATOM 16659 C C . THR D 1 203 ? 67.016 71.788 46.451 1.00 13.41 ? 223 THR E C 1 +ATOM 16660 O O . THR D 1 203 ? 68.210 71.844 46.125 1.00 13.42 ? 223 THR E O 1 +ATOM 16661 C CB . THR D 1 203 ? 66.021 72.882 48.447 1.00 13.14 ? 223 THR E CB 1 +ATOM 16662 O OG1 . THR D 1 203 ? 66.866 73.962 48.037 1.00 13.94 ? 223 THR E OG1 1 +ATOM 16663 C CG2 . THR D 1 203 ? 65.909 72.882 49.984 1.00 13.03 ? 223 THR E CG2 1 +ATOM 16664 N N . PRO D 1 204 ? 66.033 71.919 45.542 1.00 13.50 ? 224 PRO E N 1 +ATOM 16665 C CA . PRO D 1 204 ? 66.402 72.428 44.212 1.00 13.87 ? 224 PRO E CA 1 +ATOM 16666 C C . PRO D 1 204 ? 66.874 73.890 44.306 1.00 14.16 ? 224 PRO E C 1 +ATOM 16667 O O . PRO D 1 204 ? 66.708 74.513 45.349 1.00 14.01 ? 224 PRO E O 1 +ATOM 16668 C CB . PRO D 1 204 ? 65.103 72.294 43.393 1.00 13.97 ? 224 PRO E CB 1 +ATOM 16669 C CG . PRO D 1 204 ? 64.175 71.439 44.211 1.00 13.98 ? 224 PRO E CG 1 +ATOM 16670 C CD . PRO D 1 204 ? 64.606 71.575 45.647 1.00 13.74 ? 224 PRO E CD 1 +ATOM 16671 N N . THR D 1 205 ? 67.470 74.425 43.240 1.00 14.74 ? 225 THR E N 1 +ATOM 16672 C CA . THR D 1 205 ? 67.996 75.800 43.265 1.00 15.61 ? 225 THR E CA 1 +ATOM 16673 C C . THR D 1 205 ? 66.899 76.891 43.277 1.00 15.44 ? 225 THR E C 1 +ATOM 16674 O O . THR D 1 205 ? 67.148 78.033 43.692 1.00 15.99 ? 225 THR E O 1 +ATOM 16675 C CB . THR D 1 205 ? 68.963 76.046 42.085 1.00 15.73 ? 225 THR E CB 1 +ATOM 16676 O OG1 . THR D 1 205 ? 68.296 75.763 40.847 1.00 16.75 ? 225 THR E OG1 1 +ATOM 16677 C CG2 . THR D 1 205 ? 70.195 75.178 42.217 1.00 16.17 ? 225 THR E CG2 1 +ATOM 16678 N N . THR D 1 206 ? 65.704 76.550 42.797 1.00 15.49 ? 226 THR E N 1 +ATOM 16679 C CA . THR D 1 206 ? 64.503 77.344 43.075 1.00 15.71 ? 226 THR E CA 1 +ATOM 16680 C C . THR D 1 206 ? 63.655 76.510 44.032 1.00 15.38 ? 226 THR E C 1 +ATOM 16681 O O . THR D 1 206 ? 63.425 75.310 43.799 1.00 15.54 ? 226 THR E O 1 +ATOM 16682 C CB . THR D 1 206 ? 63.739 77.748 41.790 1.00 15.94 ? 226 THR E CB 1 +ATOM 16683 O OG1 . THR D 1 206 ? 64.586 78.585 40.975 1.00 16.98 ? 226 THR E OG1 1 +ATOM 16684 C CG2 . THR D 1 206 ? 62.458 78.530 42.132 1.00 16.69 ? 226 THR E CG2 1 +ATOM 16685 N N . TYR D 1 207 ? 63.205 77.137 45.116 1.00 14.78 ? 227 TYR E N 1 +ATOM 16686 C CA . TYR D 1 207 ? 62.662 76.390 46.246 1.00 14.90 ? 227 TYR E CA 1 +ATOM 16687 C C . TYR D 1 207 ? 61.667 77.186 47.081 1.00 13.99 ? 227 TYR E C 1 +ATOM 16688 O O . TYR D 1 207 ? 61.637 78.415 47.047 1.00 12.97 ? 227 TYR E O 1 +ATOM 16689 C CB . TYR D 1 207 ? 63.801 75.918 47.159 1.00 15.53 ? 227 TYR E CB 1 +ATOM 16690 C CG . TYR D 1 207 ? 64.651 77.045 47.697 1.00 16.78 ? 227 TYR E CG 1 +ATOM 16691 C CD1 . TYR D 1 207 ? 65.714 77.540 46.960 1.00 16.80 ? 227 TYR E CD1 1 +ATOM 16692 C CD2 . TYR D 1 207 ? 64.385 77.631 48.933 1.00 17.25 ? 227 TYR E CD2 1 +ATOM 16693 C CE1 . TYR D 1 207 ? 66.493 78.562 47.430 1.00 17.74 ? 227 TYR E CE1 1 +ATOM 16694 C CE2 . TYR D 1 207 ? 65.163 78.665 49.408 1.00 16.48 ? 227 TYR E CE2 1 +ATOM 16695 C CZ . TYR D 1 207 ? 66.210 79.127 48.651 1.00 17.44 ? 227 TYR E CZ 1 +ATOM 16696 O OH . TYR D 1 207 ? 67.020 80.129 49.102 1.00 19.38 ? 227 TYR E OH 1 +ATOM 16697 N N . ILE D 1 208 ? 60.889 76.438 47.856 1.00 13.36 ? 228 ILE E N 1 +ATOM 16698 C CA . ILE D 1 208 ? 59.960 76.986 48.828 1.00 13.16 ? 228 ILE E CA 1 +ATOM 16699 C C . ILE D 1 208 ? 60.761 77.508 50.013 1.00 12.92 ? 228 ILE E C 1 +ATOM 16700 O O . ILE D 1 208 ? 61.366 76.723 50.754 1.00 12.99 ? 228 ILE E O 1 +ATOM 16701 C CB . ILE D 1 208 ? 58.982 75.889 49.310 1.00 13.26 ? 228 ILE E CB 1 +ATOM 16702 C CG1 . ILE D 1 208 ? 58.120 75.387 48.145 1.00 13.25 ? 228 ILE E CG1 1 +ATOM 16703 C CG2 . ILE D 1 208 ? 58.114 76.419 50.464 1.00 14.28 ? 228 ILE E CG2 1 +ATOM 16704 C CD1 . ILE D 1 208 ? 57.558 74.003 48.353 1.00 12.82 ? 228 ILE E CD1 1 +ATOM 16705 N N . ASP D 1 209 ? 60.792 78.827 50.184 1.00 12.98 ? 229 ASP E N 1 +ATOM 16706 C CA . ASP D 1 209 ? 61.644 79.443 51.198 1.00 12.98 ? 229 ASP E CA 1 +ATOM 16707 C C . ASP D 1 209 ? 60.910 79.736 52.501 1.00 13.13 ? 229 ASP E C 1 +ATOM 16708 O O . ASP D 1 209 ? 61.513 79.677 53.572 1.00 13.27 ? 229 ASP E O 1 +ATOM 16709 C CB . ASP D 1 209 ? 62.233 80.758 50.694 1.00 13.12 ? 229 ASP E CB 1 +ATOM 16710 C CG . ASP D 1 209 ? 63.224 81.348 51.671 1.00 14.29 ? 229 ASP E CG 1 +ATOM 16711 O OD1 . ASP D 1 209 ? 64.237 80.680 51.962 1.00 17.04 ? 229 ASP E OD1 1 +ATOM 16712 O OD2 . ASP D 1 209 ? 62.984 82.466 52.162 1.00 15.92 ? 229 ASP E OD2 1 +ATOM 16713 N N . ASP D 1 210 ? 59.629 80.084 52.416 1.00 13.04 ? 230 ASP E N 1 +ATOM 16714 C CA . ASP D 1 210 ? 58.872 80.459 53.613 1.00 13.09 ? 230 ASP E CA 1 +ATOM 16715 C C . ASP D 1 210 ? 57.393 80.173 53.431 1.00 12.69 ? 230 ASP E C 1 +ATOM 16716 O O . ASP D 1 210 ? 56.886 80.249 52.322 1.00 12.96 ? 230 ASP E O 1 +ATOM 16717 C CB . ASP D 1 210 ? 59.072 81.932 53.898 1.00 13.51 ? 230 ASP E CB 1 +ATOM 16718 C CG . ASP D 1 210 ? 58.806 82.307 55.347 1.00 14.45 ? 230 ASP E CG 1 +ATOM 16719 O OD1 . ASP D 1 210 ? 58.351 81.467 56.151 1.00 14.11 ? 230 ASP E OD1 1 +ATOM 16720 O OD2 . ASP D 1 210 ? 59.062 83.483 55.668 1.00 16.33 ? 230 ASP E OD2 1 +ATOM 16721 N N . ILE D 1 211 ? 56.724 79.798 54.515 1.00 12.31 ? 231 ILE E N 1 +ATOM 16722 C CA . ILE D 1 211 ? 55.281 79.585 54.498 1.00 11.99 ? 231 ILE E CA 1 +ATOM 16723 C C . ILE D 1 211 ? 54.733 80.248 55.741 1.00 11.95 ? 231 ILE E C 1 +ATOM 16724 O O . ILE D 1 211 ? 55.339 80.151 56.801 1.00 11.61 ? 231 ILE E O 1 +ATOM 16725 C CB . ILE D 1 211 ? 54.864 78.097 54.547 1.00 11.78 ? 231 ILE E CB 1 +ATOM 16726 C CG1 . ILE D 1 211 ? 55.515 77.274 53.421 1.00 10.71 ? 231 ILE E CG1 1 +ATOM 16727 C CG2 . ILE D 1 211 ? 53.333 77.991 54.502 1.00 11.32 ? 231 ILE E CG2 1 +ATOM 16728 C CD1 . ILE D 1 211 ? 55.350 75.756 53.566 1.00 12.28 ? 231 ILE E CD1 1 +ATOM 16729 N N . THR D 1 212 ? 53.597 80.921 55.611 1.00 12.13 ? 232 THR E N 1 +ATOM 16730 C CA . THR D 1 212 ? 52.868 81.452 56.762 1.00 12.41 ? 232 THR E CA 1 +ATOM 16731 C C . THR D 1 212 ? 51.446 80.983 56.652 1.00 11.99 ? 232 THR E C 1 +ATOM 16732 O O . THR D 1 212 ? 50.780 81.212 55.618 1.00 12.15 ? 232 THR E O 1 +ATOM 16733 C CB . THR D 1 212 ? 52.887 82.989 56.816 1.00 12.74 ? 232 THR E CB 1 +ATOM 16734 O OG1 . THR D 1 212 ? 54.232 83.429 56.974 1.00 14.14 ? 232 THR E OG1 1 +ATOM 16735 C CG2 . THR D 1 212 ? 52.058 83.526 57.991 1.00 13.21 ? 232 THR E CG2 1 +ATOM 16736 N N . VAL D 1 213 ? 50.976 80.326 57.706 1.00 11.77 ? 233 VAL E N 1 +ATOM 16737 C CA . VAL D 1 213 ? 49.578 79.920 57.779 1.00 11.32 ? 233 VAL E CA 1 +ATOM 16738 C C . VAL D 1 213 ? 48.872 80.510 58.993 1.00 11.77 ? 233 VAL E C 1 +ATOM 16739 O O . VAL D 1 213 ? 49.407 80.524 60.100 1.00 11.22 ? 233 VAL E O 1 +ATOM 16740 C CB . VAL D 1 213 ? 49.422 78.402 57.824 1.00 11.36 ? 233 VAL E CB 1 +ATOM 16741 C CG1 . VAL D 1 213 ? 47.963 78.028 58.168 1.00 11.25 ? 233 VAL E CG1 1 +ATOM 16742 C CG2 . VAL D 1 213 ? 49.850 77.796 56.499 1.00 11.97 ? 233 VAL E CG2 1 +ATOM 16743 N N . THR D 1 214 ? 47.655 81.004 58.776 1.00 11.74 ? 234 THR E N 1 +ATOM 16744 C CA . THR D 1 214 ? 46.762 81.345 59.884 1.00 11.99 ? 234 THR E CA 1 +ATOM 16745 C C . THR D 1 214 ? 45.415 80.730 59.621 1.00 12.68 ? 234 THR E C 1 +ATOM 16746 O O . THR D 1 214 ? 45.034 80.556 58.458 1.00 13.04 ? 234 THR E O 1 +ATOM 16747 C CB . THR D 1 214 ? 46.566 82.861 60.067 1.00 12.12 ? 234 THR E CB 1 +ATOM 16748 O OG1 . THR D 1 214 ? 45.882 83.404 58.928 1.00 12.46 ? 234 THR E OG1 1 +ATOM 16749 C CG2 . THR D 1 214 ? 47.899 83.555 60.281 1.00 12.33 ? 234 THR E CG2 1 +ATOM 16750 N N . THR D 1 215 ? 44.709 80.405 60.707 1.00 13.04 ? 235 THR E N 1 +ATOM 16751 C CA . THR D 1 215 ? 43.487 79.601 60.650 1.00 13.23 ? 235 THR E CA 1 +ATOM 16752 C C . THR D 1 215 ? 42.369 80.244 61.468 1.00 13.91 ? 235 THR E C 1 +ATOM 16753 O O . THR D 1 215 ? 42.609 80.857 62.506 1.00 13.62 ? 235 THR E O 1 +ATOM 16754 C CB . THR D 1 215 ? 43.729 78.150 61.153 1.00 13.48 ? 235 THR E CB 1 +ATOM 16755 O OG1 . THR D 1 215 ? 44.095 78.162 62.541 1.00 12.92 ? 235 THR E OG1 1 +ATOM 16756 C CG2 . THR D 1 215 ? 44.835 77.476 60.348 1.00 13.47 ? 235 THR E CG2 1 +ATOM 16757 N N . SER D 1 216 ? 41.139 80.107 60.984 1.00 14.56 ? 236 SER E N 1 +ATOM 16758 C CA . SER D 1 216 ? 39.973 80.631 61.691 1.00 15.19 ? 236 SER E CA 1 +ATOM 16759 C C . SER D 1 216 ? 38.803 79.712 61.391 1.00 16.08 ? 236 SER E C 1 +ATOM 16760 O O . SER D 1 216 ? 38.949 78.748 60.643 1.00 14.91 ? 236 SER E O 1 +ATOM 16761 C CB . SER D 1 216 ? 39.672 82.083 61.270 1.00 15.60 ? 236 SER E CB 1 +ATOM 16762 O OG . SER D 1 216 ? 39.304 82.153 59.902 1.00 16.11 ? 236 SER E OG 1 +ATOM 16763 N N . VAL D 1 217 ? 37.656 80.003 61.997 1.00 17.09 ? 237 VAL E N 1 +ATOM 16764 C CA . VAL D 1 217 ? 36.477 79.159 61.866 1.00 18.53 ? 237 VAL E CA 1 +ATOM 16765 C C . VAL D 1 217 ? 35.292 80.003 61.420 1.00 19.33 ? 237 VAL E C 1 +ATOM 16766 O O . VAL D 1 217 ? 35.174 81.158 61.798 1.00 19.70 ? 237 VAL E O 1 +ATOM 16767 C CB . VAL D 1 217 ? 36.108 78.502 63.214 1.00 18.86 ? 237 VAL E CB 1 +ATOM 16768 C CG1 . VAL D 1 217 ? 35.071 77.410 63.006 1.00 20.14 ? 237 VAL E CG1 1 +ATOM 16769 C CG2 . VAL D 1 217 ? 37.355 77.946 63.902 1.00 19.32 ? 237 VAL E CG2 1 +ATOM 16770 N N . GLU D 1 218 ? 34.434 79.412 60.599 1.00 20.57 ? 238 GLU E N 1 +ATOM 16771 C CA . GLU D 1 218 ? 33.125 79.989 60.326 1.00 21.56 ? 238 GLU E CA 1 +ATOM 16772 C C . GLU D 1 218 ? 32.141 78.829 60.277 1.00 21.54 ? 238 GLU E C 1 +ATOM 16773 O O . GLU D 1 218 ? 32.381 77.837 59.592 1.00 21.70 ? 238 GLU E O 1 +ATOM 16774 C CB . GLU D 1 218 ? 33.121 80.805 59.028 1.00 21.54 ? 238 GLU E CB 1 +ATOM 16775 C CG . GLU D 1 218 ? 33.364 80.027 57.731 1.00 23.01 ? 238 GLU E CG 1 +ATOM 16776 C CD . GLU D 1 218 ? 33.037 80.847 56.489 1.00 23.08 ? 238 GLU E CD 1 +ATOM 16777 O OE1 . GLU D 1 218 ? 33.025 82.100 56.583 1.00 24.76 ? 238 GLU E OE1 1 +ATOM 16778 O OE2 . GLU D 1 218 ? 32.784 80.235 55.428 1.00 24.85 ? 238 GLU E OE2 1 +ATOM 16779 N N . GLN D 1 219 ? 31.056 78.951 61.038 1.00 22.13 ? 239 GLN E N 1 +ATOM 16780 C CA . GLN D 1 219 ? 30.121 77.855 61.248 1.00 22.74 ? 239 GLN E CA 1 +ATOM 16781 C C . GLN D 1 219 ? 30.909 76.605 61.651 1.00 22.14 ? 239 GLN E C 1 +ATOM 16782 O O . GLN D 1 219 ? 31.716 76.666 62.577 1.00 22.48 ? 239 GLN E O 1 +ATOM 16783 C CB . GLN D 1 219 ? 29.249 77.641 59.999 1.00 23.06 ? 239 GLN E CB 1 +ATOM 16784 C CG . GLN D 1 219 ? 28.405 78.864 59.619 1.00 25.28 ? 239 GLN E CG 1 +ATOM 16785 C CD . GLN D 1 219 ? 29.220 80.002 59.036 1.00 26.46 ? 239 GLN E CD 1 +ATOM 16786 O OE1 . GLN D 1 219 ? 29.162 81.139 59.518 1.00 30.05 ? 239 GLN E OE1 1 +ATOM 16787 N NE2 . GLN D 1 219 ? 29.996 79.701 58.000 1.00 28.50 ? 239 GLN E NE2 1 +ATOM 16788 N N . ASP D 1 220 ? 30.713 75.490 60.957 1.00 21.73 ? 240 ASP E N 1 +ATOM 16789 C CA . ASP D 1 220 ? 31.449 74.267 61.270 1.00 21.90 ? 240 ASP E CA 1 +ATOM 16790 C C . ASP D 1 220 ? 32.526 74.013 60.206 1.00 21.16 ? 240 ASP E C 1 +ATOM 16791 O O . ASP D 1 220 ? 32.909 72.876 59.960 1.00 20.64 ? 240 ASP E O 1 +ATOM 16792 C CB . ASP D 1 220 ? 30.486 73.082 61.403 1.00 22.22 ? 240 ASP E CB 1 +ATOM 16793 C CG . ASP D 1 220 ? 29.844 72.689 60.086 1.00 23.92 ? 240 ASP E CG 1 +ATOM 16794 O OD1 . ASP D 1 220 ? 29.793 73.526 59.162 1.00 26.68 ? 240 ASP E OD1 1 +ATOM 16795 O OD2 . ASP D 1 220 ? 29.372 71.533 59.983 1.00 26.96 ? 240 ASP E OD2 1 +ATOM 16796 N N . SER D 1 221 ? 32.997 75.090 59.579 1.00 20.51 ? 241 SER E N 1 +ATOM 16797 C CA . SER D 1 221 ? 34.046 75.009 58.571 1.00 20.13 ? 241 SER E CA 1 +ATOM 16798 C C . SER D 1 221 ? 35.327 75.630 59.107 1.00 19.12 ? 241 SER E C 1 +ATOM 16799 O O . SER D 1 221 ? 35.295 76.492 59.980 1.00 18.98 ? 241 SER E O 1 +ATOM 16800 C CB . SER D 1 221 ? 33.635 75.753 57.296 1.00 20.39 ? 241 SER E CB 1 +ATOM 16801 O OG . SER D 1 221 ? 32.604 75.062 56.607 1.00 21.95 ? 241 SER E OG 1 +ATOM 16802 N N . GLY D 1 222 ? 36.451 75.179 58.564 1.00 18.12 ? 242 GLY E N 1 +ATOM 16803 C CA . GLY D 1 222 ? 37.756 75.765 58.866 1.00 17.26 ? 242 GLY E CA 1 +ATOM 16804 C C . GLY D 1 222 ? 38.244 76.590 57.690 1.00 16.64 ? 242 GLY E C 1 +ATOM 16805 O O . GLY D 1 222 ? 38.021 76.229 56.535 1.00 16.26 ? 242 GLY E O 1 +ATOM 16806 N N . LEU D 1 223 ? 38.919 77.696 57.989 1.00 16.18 ? 243 LEU E N 1 +ATOM 16807 C CA . LEU D 1 223 ? 39.539 78.538 56.984 1.00 15.56 ? 243 LEU E CA 1 +ATOM 16808 C C . LEU D 1 223 ? 41.044 78.514 57.197 1.00 15.53 ? 243 LEU E C 1 +ATOM 16809 O O . LEU D 1 223 ? 41.504 78.809 58.295 1.00 15.70 ? 243 LEU E O 1 +ATOM 16810 C CB . LEU D 1 223 ? 39.042 79.981 57.113 1.00 15.93 ? 243 LEU E CB 1 +ATOM 16811 C CG . LEU D 1 223 ? 37.527 80.189 57.044 1.00 16.27 ? 243 LEU E CG 1 +ATOM 16812 C CD1 . LEU D 1 223 ? 37.194 81.659 57.165 1.00 17.55 ? 243 LEU E CD1 1 +ATOM 16813 C CD2 . LEU D 1 223 ? 36.965 79.600 55.757 1.00 18.19 ? 243 LEU E CD2 1 +ATOM 16814 N N . VAL D 1 224 ? 41.793 78.160 56.158 1.00 14.75 ? 244 VAL E N 1 +ATOM 16815 C CA . VAL D 1 224 ? 43.259 78.115 56.220 1.00 14.45 ? 244 VAL E CA 1 +ATOM 16816 C C . VAL D 1 224 ? 43.837 79.117 55.222 1.00 14.38 ? 244 VAL E C 1 +ATOM 16817 O O . VAL D 1 224 ? 43.773 78.905 54.008 1.00 13.81 ? 244 VAL E O 1 +ATOM 16818 C CB . VAL D 1 224 ? 43.801 76.705 55.901 1.00 14.35 ? 244 VAL E CB 1 +ATOM 16819 C CG1 . VAL D 1 224 ? 45.337 76.692 55.937 1.00 15.95 ? 244 VAL E CG1 1 +ATOM 16820 C CG2 . VAL D 1 224 ? 43.223 75.668 56.874 1.00 14.63 ? 244 VAL E CG2 1 +ATOM 16821 N N . ASN D 1 225 ? 44.388 80.205 55.746 1.00 14.26 ? 245 ASN E N 1 +ATOM 16822 C CA . ASN D 1 225 ? 45.039 81.229 54.938 1.00 14.90 ? 245 ASN E CA 1 +ATOM 16823 C C . ASN D 1 225 ? 46.504 80.875 54.751 1.00 15.05 ? 245 ASN E C 1 +ATOM 16824 O O . ASN D 1 225 ? 47.192 80.630 55.734 1.00 15.59 ? 245 ASN E O 1 +ATOM 16825 C CB . ASN D 1 225 ? 44.953 82.580 55.640 1.00 15.13 ? 245 ASN E CB 1 +ATOM 16826 C CG . ASN D 1 225 ? 43.534 82.948 56.015 1.00 16.68 ? 245 ASN E CG 1 +ATOM 16827 O OD1 . ASN D 1 225 ? 43.116 82.789 57.164 1.00 20.58 ? 245 ASN E OD1 1 +ATOM 16828 N ND2 . ASN D 1 225 ? 42.779 83.409 55.043 1.00 13.78 ? 245 ASN E ND2 1 +ATOM 16829 N N . TYR D 1 226 ? 46.983 80.852 53.511 1.00 15.14 ? 246 TYR E N 1 +ATOM 16830 C CA . TYR D 1 226 ? 48.394 80.547 53.254 1.00 15.27 ? 246 TYR E CA 1 +ATOM 16831 C C . TYR D 1 226 ? 49.093 81.675 52.495 1.00 15.33 ? 246 TYR E C 1 +ATOM 16832 O O . TYR D 1 226 ? 48.482 82.400 51.708 1.00 14.65 ? 246 TYR E O 1 +ATOM 16833 C CB . TYR D 1 226 ? 48.563 79.187 52.536 1.00 15.74 ? 246 TYR E CB 1 +ATOM 16834 C CG . TYR D 1 226 ? 47.879 79.078 51.193 1.00 16.87 ? 246 TYR E CG 1 +ATOM 16835 C CD1 . TYR D 1 226 ? 48.554 79.385 50.014 1.00 17.59 ? 246 TYR E CD1 1 +ATOM 16836 C CD2 . TYR D 1 226 ? 46.551 78.673 51.102 1.00 17.31 ? 246 TYR E CD2 1 +ATOM 16837 C CE1 . TYR D 1 226 ? 47.921 79.298 48.773 1.00 17.83 ? 246 TYR E CE1 1 +ATOM 16838 C CE2 . TYR D 1 226 ? 45.910 78.576 49.865 1.00 17.79 ? 246 TYR E CE2 1 +ATOM 16839 C CZ . TYR D 1 226 ? 46.601 78.890 48.706 1.00 17.55 ? 246 TYR E CZ 1 +ATOM 16840 O OH . TYR D 1 226 ? 45.964 78.791 47.481 1.00 18.12 ? 246 TYR E OH 1 +ATOM 16841 N N . GLN D 1 227 ? 50.377 81.837 52.796 1.00 15.09 ? 247 GLN E N 1 +ATOM 16842 C CA . GLN D 1 227 ? 51.268 82.744 52.086 1.00 15.86 ? 247 GLN E CA 1 +ATOM 16843 C C . GLN D 1 227 ? 52.566 81.984 51.906 1.00 15.75 ? 247 GLN E C 1 +ATOM 16844 O O . GLN D 1 227 ? 53.061 81.376 52.858 1.00 14.84 ? 247 GLN E O 1 +ATOM 16845 C CB . GLN D 1 227 ? 51.538 84.005 52.904 1.00 15.86 ? 247 GLN E CB 1 +ATOM 16846 C CG . GLN D 1 227 ? 50.309 84.817 53.260 1.00 18.08 ? 247 GLN E CG 1 +ATOM 16847 C CD . GLN D 1 227 ? 50.641 86.052 54.096 1.00 18.27 ? 247 GLN E CD 1 +ATOM 16848 O OE1 . GLN D 1 227 ? 51.745 86.599 54.009 1.00 24.45 ? 247 GLN E OE1 1 +ATOM 16849 N NE2 . GLN D 1 227 ? 49.679 86.504 54.902 1.00 22.78 ? 247 GLN E NE2 1 +ATOM 16850 N N . ILE D 1 228 ? 53.103 81.995 50.693 1.00 15.58 ? 248 ILE E N 1 +ATOM 16851 C CA . ILE D 1 228 ? 54.279 81.195 50.375 1.00 15.69 ? 248 ILE E CA 1 +ATOM 16852 C C . ILE D 1 228 ? 55.277 82.059 49.631 1.00 16.08 ? 248 ILE E C 1 +ATOM 16853 O O . ILE D 1 228 ? 54.898 82.787 48.712 1.00 15.12 ? 248 ILE E O 1 +ATOM 16854 C CB . ILE D 1 228 ? 53.917 79.976 49.507 1.00 15.76 ? 248 ILE E CB 1 +ATOM 16855 C CG1 . ILE D 1 228 ? 52.888 79.087 50.218 1.00 16.34 ? 248 ILE E CG1 1 +ATOM 16856 C CG2 . ILE D 1 228 ? 55.189 79.177 49.158 1.00 15.60 ? 248 ILE E CG2 1 +ATOM 16857 C CD1 . ILE D 1 228 ? 52.294 78.022 49.338 1.00 18.15 ? 248 ILE E CD1 1 +ATOM 16858 N N . SER D 1 229 ? 56.544 81.996 50.037 1.00 16.58 ? 249 SER E N 1 +ATOM 16859 C CA . SER D 1 229 ? 57.602 82.714 49.334 1.00 16.93 ? 249 SER E CA 1 +ATOM 16860 C C . SER D 1 229 ? 58.554 81.710 48.678 1.00 17.60 ? 249 SER E C 1 +ATOM 16861 O O . SER D 1 229 ? 58.923 80.689 49.278 1.00 17.06 ? 249 SER E O 1 +ATOM 16862 C CB . SER D 1 229 ? 58.323 83.697 50.274 1.00 17.36 ? 249 SER E CB 1 +ATOM 16863 O OG A SER D 1 229 ? 59.638 83.751 49.750 0.50 16.21 ? 249 SER E OG 1 +ATOM 16864 O OG B SER D 1 229 ? 57.264 84.125 51.107 0.50 17.92 ? 249 SER E OG 1 +ATOM 16865 N N . VAL D 1 230 ? 58.921 82.005 47.431 1.00 17.88 ? 250 VAL E N 1 +ATOM 16866 C CA . VAL D 1 230 ? 59.770 81.129 46.622 1.00 18.61 ? 250 VAL E CA 1 +ATOM 16867 C C . VAL D 1 230 ? 61.012 81.909 46.222 1.00 19.05 ? 250 VAL E C 1 +ATOM 16868 O O . VAL D 1 230 ? 60.903 83.059 45.795 1.00 19.07 ? 250 VAL E O 1 +ATOM 16869 C CB . VAL D 1 230 ? 59.020 80.663 45.359 1.00 18.51 ? 250 VAL E CB 1 +ATOM 16870 C CG1 . VAL D 1 230 ? 59.955 79.936 44.393 1.00 18.43 ? 250 VAL E CG1 1 +ATOM 16871 C CG2 . VAL D 1 230 ? 57.842 79.772 45.748 1.00 18.68 ? 250 VAL E CG2 1 +ATOM 16872 N N . LYS D 1 231 ? 62.189 81.303 46.383 1.00 19.71 ? 251 LYS E N 1 +ATOM 16873 C CA . LYS D 1 231 ? 63.433 81.941 45.965 1.00 20.32 ? 251 LYS E CA 1 +ATOM 16874 C C . LYS D 1 231 ? 64.091 81.170 44.824 1.00 21.14 ? 251 LYS E C 1 +ATOM 16875 O O . LYS D 1 231 ? 63.865 79.968 44.668 1.00 20.77 ? 251 LYS E O 1 +ATOM 16876 C CB . LYS D 1 231 ? 64.384 82.104 47.158 1.00 20.49 ? 251 LYS E CB 1 +ATOM 16877 C CG . LYS D 1 231 ? 63.909 83.139 48.179 1.00 21.12 ? 251 LYS E CG 1 +ATOM 16878 C CD . LYS D 1 231 ? 63.617 84.504 47.510 1.00 22.59 ? 251 LYS E CD 1 +ATOM 16879 C CE . LYS D 1 231 ? 63.050 85.530 48.472 1.00 23.07 ? 251 LYS E CE 1 +ATOM 16880 N NZ . LYS D 1 231 ? 63.012 86.903 47.856 1.00 25.03 ? 251 LYS E NZ 1 +ATOM 16881 N N . GLY D 1 232 ? 64.860 81.893 44.008 1.00 22.40 ? 252 GLY E N 1 +ATOM 16882 C CA . GLY D 1 232 ? 65.696 81.302 42.963 1.00 23.52 ? 252 GLY E CA 1 +ATOM 16883 C C . GLY D 1 232 ? 65.319 81.741 41.557 1.00 24.62 ? 252 GLY E C 1 +ATOM 16884 O O . GLY D 1 232 ? 66.159 82.234 40.799 1.00 25.83 ? 252 GLY E O 1 +ATOM 16885 N N . SER D 1 233 ? 64.057 81.531 41.212 1.00 25.25 ? 253 SER E N 1 +ATOM 16886 C CA . SER D 1 233 ? 63.519 81.831 39.888 1.00 25.70 ? 253 SER E CA 1 +ATOM 16887 C C . SER D 1 233 ? 62.159 82.479 40.085 1.00 26.21 ? 253 SER E C 1 +ATOM 16888 O O . SER D 1 233 ? 61.458 82.168 41.045 1.00 26.27 ? 253 SER E O 1 +ATOM 16889 C CB . SER D 1 233 ? 63.372 80.542 39.073 1.00 25.74 ? 253 SER E CB 1 +ATOM 16890 O OG . SER D 1 233 ? 62.716 80.761 37.830 1.00 25.37 ? 253 SER E OG 1 +ATOM 16891 N N . ASN D 1 234 ? 61.793 83.388 39.187 1.00 26.78 ? 254 ASN E N 1 +ATOM 16892 C CA . ASN D 1 234 ? 60.498 84.071 39.268 1.00 27.00 ? 254 ASN E CA 1 +ATOM 16893 C C . ASN D 1 234 ? 59.448 83.477 38.335 1.00 26.76 ? 254 ASN E C 1 +ATOM 16894 O O . ASN D 1 234 ? 58.310 83.942 38.313 1.00 27.30 ? 254 ASN E O 1 +ATOM 16895 C CB . ASN D 1 234 ? 60.651 85.580 39.024 1.00 27.46 ? 254 ASN E CB 1 +ATOM 16896 C CG . ASN D 1 234 ? 61.593 85.902 37.883 1.00 28.46 ? 254 ASN E CG 1 +ATOM 16897 O OD1 . ASN D 1 234 ? 61.564 85.259 36.833 1.00 30.55 ? 254 ASN E OD1 1 +ATOM 16898 N ND2 . ASN D 1 234 ? 62.441 86.907 38.085 1.00 30.39 ? 254 ASN E ND2 1 +ATOM 16899 N N . LEU D 1 235 ? 59.829 82.453 37.574 1.00 26.26 ? 255 LEU E N 1 +ATOM 16900 C CA . LEU D 1 235 ? 58.899 81.732 36.712 1.00 25.63 ? 255 LEU E CA 1 +ATOM 16901 C C . LEU D 1 235 ? 58.518 80.402 37.347 1.00 24.54 ? 255 LEU E C 1 +ATOM 16902 O O . LEU D 1 235 ? 59.268 79.432 37.269 1.00 23.81 ? 255 LEU E O 1 +ATOM 16903 C CB . LEU D 1 235 ? 59.517 81.494 35.334 1.00 25.92 ? 255 LEU E CB 1 +ATOM 16904 C CG . LEU D 1 235 ? 59.831 82.778 34.558 1.00 27.02 ? 255 LEU E CG 1 +ATOM 16905 C CD1 . LEU D 1 235 ? 60.473 82.451 33.208 1.00 27.57 ? 255 LEU E CD1 1 +ATOM 16906 C CD2 . LEU D 1 235 ? 58.571 83.619 34.376 1.00 27.67 ? 255 LEU E CD2 1 +ATOM 16907 N N . PHE D 1 236 ? 57.347 80.360 37.970 1.00 23.45 ? 256 PHE E N 1 +ATOM 16908 C CA . PHE D 1 236 ? 56.917 79.163 38.674 1.00 22.74 ? 256 PHE E CA 1 +ATOM 16909 C C . PHE D 1 236 ? 55.414 79.138 38.929 1.00 22.39 ? 256 PHE E C 1 +ATOM 16910 O O . PHE D 1 236 ? 54.738 80.169 38.841 1.00 22.62 ? 256 PHE E O 1 +ATOM 16911 C CB . PHE D 1 236 ? 57.658 79.053 40.013 1.00 22.46 ? 256 PHE E CB 1 +ATOM 16912 C CG . PHE D 1 236 ? 57.394 80.204 40.948 1.00 21.97 ? 256 PHE E CG 1 +ATOM 16913 C CD1 . PHE D 1 236 ? 58.248 81.297 40.986 1.00 21.63 ? 256 PHE E CD1 1 +ATOM 16914 C CD2 . PHE D 1 236 ? 56.288 80.193 41.787 1.00 22.33 ? 256 PHE E CD2 1 +ATOM 16915 C CE1 . PHE D 1 236 ? 58.008 82.360 41.847 1.00 21.15 ? 256 PHE E CE1 1 +ATOM 16916 C CE2 . PHE D 1 236 ? 56.034 81.256 42.645 1.00 22.01 ? 256 PHE E CE2 1 +ATOM 16917 C CZ . PHE D 1 236 ? 56.895 82.340 42.673 1.00 21.96 ? 256 PHE E CZ 1 +ATOM 16918 N N . LYS D 1 237 ? 54.914 77.950 39.258 1.00 21.50 ? 257 LYS E N 1 +ATOM 16919 C CA . LYS D 1 237 ? 53.544 77.786 39.737 1.00 21.17 ? 257 LYS E CA 1 +ATOM 16920 C C . LYS D 1 237 ? 53.527 76.978 41.037 1.00 20.22 ? 257 LYS E C 1 +ATOM 16921 O O . LYS D 1 237 ? 54.371 76.093 41.252 1.00 19.62 ? 257 LYS E O 1 +ATOM 16922 C CB . LYS D 1 237 ? 52.665 77.123 38.671 1.00 21.16 ? 257 LYS E CB 1 +ATOM 16923 C CG . LYS D 1 237 ? 53.048 75.699 38.309 1.00 22.23 ? 257 LYS E CG 1 +ATOM 16924 C CD . LYS D 1 237 ? 52.025 75.078 37.377 1.00 22.50 ? 257 LYS E CD 1 +ATOM 16925 C CE . LYS D 1 237 ? 52.349 73.628 37.088 1.00 23.42 ? 257 LYS E CE 1 +ATOM 16926 N NZ . LYS D 1 237 ? 51.293 72.986 36.252 1.00 25.01 ? 257 LYS E NZ 1 +ATOM 16927 N N . LEU D 1 238 ? 52.563 77.305 41.898 1.00 19.38 ? 258 LEU E N 1 +ATOM 16928 C CA . LEU D 1 238 ? 52.384 76.631 43.183 1.00 18.97 ? 258 LEU E CA 1 +ATOM 16929 C C . LEU D 1 238 ? 51.034 75.932 43.247 1.00 19.19 ? 258 LEU E C 1 +ATOM 16930 O O . LEU D 1 238 ? 50.011 76.500 42.860 1.00 18.96 ? 258 LEU E O 1 +ATOM 16931 C CB . LEU D 1 238 ? 52.474 77.644 44.318 1.00 18.46 ? 258 LEU E CB 1 +ATOM 16932 C CG . LEU D 1 238 ? 53.886 78.047 44.723 1.00 17.63 ? 258 LEU E CG 1 +ATOM 16933 C CD1 . LEU D 1 238 ? 53.855 79.408 45.425 1.00 15.97 ? 258 LEU E CD1 1 +ATOM 16934 C CD2 . LEU D 1 238 ? 54.540 76.950 45.603 1.00 15.37 ? 258 LEU E CD2 1 +ATOM 16935 N N . GLU D 1 239 ? 51.042 74.689 43.711 1.00 19.56 ? 259 GLU E N 1 +ATOM 16936 C CA . GLU D 1 239 ? 49.821 73.985 44.064 1.00 20.06 ? 259 GLU E CA 1 +ATOM 16937 C C . GLU D 1 239 ? 49.860 73.684 45.549 1.00 20.09 ? 259 GLU E C 1 +ATOM 16938 O O . GLU D 1 239 ? 50.908 73.340 46.100 1.00 19.45 ? 259 GLU E O 1 +ATOM 16939 C CB . GLU D 1 239 ? 49.694 72.698 43.264 1.00 20.55 ? 259 GLU E CB 1 +ATOM 16940 C CG . GLU D 1 239 ? 49.596 72.926 41.769 1.00 22.88 ? 259 GLU E CG 1 +ATOM 16941 C CD . GLU D 1 239 ? 49.801 71.653 40.986 1.00 26.28 ? 259 GLU E CD 1 +ATOM 16942 O OE1 . GLU D 1 239 ? 49.325 70.587 41.446 1.00 29.06 ? 259 GLU E OE1 1 +ATOM 16943 O OE2 . GLU D 1 239 ? 50.441 71.715 39.913 1.00 29.31 ? 259 GLU E OE2 1 +ATOM 16944 N N . VAL D 1 240 ? 48.722 73.849 46.208 1.00 20.11 ? 260 VAL E N 1 +ATOM 16945 C CA . VAL D 1 240 ? 48.641 73.604 47.631 1.00 20.46 ? 260 VAL E CA 1 +ATOM 16946 C C . VAL D 1 240 ? 47.425 72.748 47.935 1.00 20.64 ? 260 VAL E C 1 +ATOM 16947 O O . VAL D 1 240 ? 46.321 73.028 47.456 1.00 21.26 ? 260 VAL E O 1 +ATOM 16948 C CB . VAL D 1 240 ? 48.532 74.917 48.404 1.00 20.56 ? 260 VAL E CB 1 +ATOM 16949 C CG1 . VAL D 1 240 ? 48.614 74.653 49.892 1.00 21.99 ? 260 VAL E CG1 1 +ATOM 16950 C CG2 . VAL D 1 240 ? 49.618 75.886 47.964 1.00 20.50 ? 260 VAL E CG2 1 +ATOM 16951 N N . ARG D 1 241 ? 47.633 71.701 48.724 1.00 20.27 ? 261 ARG E N 1 +ATOM 16952 C CA . ARG D 1 241 ? 46.562 70.823 49.144 1.00 20.61 ? 261 ARG E CA 1 +ATOM 16953 C C . ARG D 1 241 ? 46.570 70.713 50.660 1.00 20.52 ? 261 ARG E C 1 +ATOM 16954 O O . ARG D 1 241 ? 47.642 70.712 51.276 1.00 20.23 ? 261 ARG E O 1 +ATOM 16955 C CB . ARG D 1 241 ? 46.752 69.442 48.525 1.00 20.88 ? 261 ARG E CB 1 +ATOM 16956 C CG . ARG D 1 241 ? 46.519 69.407 47.023 1.00 22.56 ? 261 ARG E CG 1 +ATOM 16957 C CD . ARG D 1 241 ? 47.077 68.145 46.412 1.00 24.83 ? 261 ARG E CD 1 +ATOM 16958 N NE . ARG D 1 241 ? 48.537 68.161 46.464 1.00 26.23 ? 261 ARG E NE 1 +ATOM 16959 C CZ . ARG D 1 241 ? 49.350 68.542 45.476 1.00 27.18 ? 261 ARG E CZ 1 +ATOM 16960 N NH1 . ARG D 1 241 ? 48.879 68.937 44.295 1.00 28.10 ? 261 ARG E NH1 1 +ATOM 16961 N NH2 . ARG D 1 241 ? 50.662 68.513 45.670 1.00 26.85 ? 261 ARG E NH2 1 +ATOM 16962 N N . LEU D 1 242 ? 45.381 70.627 51.257 1.00 20.06 ? 262 LEU E N 1 +ATOM 16963 C CA . LEU D 1 242 ? 45.262 70.305 52.679 1.00 20.11 ? 262 LEU E CA 1 +ATOM 16964 C C . LEU D 1 242 ? 44.839 68.846 52.816 1.00 20.18 ? 262 LEU E C 1 +ATOM 16965 O O . LEU D 1 242 ? 43.818 68.426 52.256 1.00 19.72 ? 262 LEU E O 1 +ATOM 16966 C CB . LEU D 1 242 ? 44.259 71.223 53.381 1.00 19.80 ? 262 LEU E CB 1 +ATOM 16967 C CG . LEU D 1 242 ? 44.343 71.254 54.910 1.00 20.14 ? 262 LEU E CG 1 +ATOM 16968 C CD1 . LEU D 1 242 ? 45.693 71.806 55.352 1.00 19.46 ? 262 LEU E CD1 1 +ATOM 16969 C CD2 . LEU D 1 242 ? 43.207 72.084 55.509 1.00 20.00 ? 262 LEU E CD2 1 +ATOM 16970 N N . LEU D 1 243 ? 45.630 68.070 53.549 1.00 20.07 ? 263 LEU E N 1 +ATOM 16971 C CA . LEU D 1 243 ? 45.353 66.660 53.734 1.00 20.11 ? 263 LEU E CA 1 +ATOM 16972 C C . LEU D 1 243 ? 44.865 66.466 55.156 1.00 20.20 ? 263 LEU E C 1 +ATOM 16973 O O . LEU D 1 243 ? 45.396 67.076 56.091 1.00 19.75 ? 263 LEU E O 1 +ATOM 16974 C CB . LEU D 1 243 ? 46.604 65.826 53.484 1.00 20.14 ? 263 LEU E CB 1 +ATOM 16975 C CG . LEU D 1 243 ? 47.505 66.298 52.337 1.00 20.51 ? 263 LEU E CG 1 +ATOM 16976 C CD1 . LEU D 1 243 ? 48.744 65.407 52.238 1.00 21.72 ? 263 LEU E CD1 1 +ATOM 16977 C CD2 . LEU D 1 243 ? 46.730 66.316 51.034 1.00 21.17 ? 263 LEU E CD2 1 +ATOM 16978 N N . ASP D 1 244 ? 43.848 65.630 55.318 1.00 20.23 ? 264 ASP E N 1 +ATOM 16979 C CA . ASP D 1 244 ? 43.360 65.294 56.649 1.00 20.76 ? 264 ASP E CA 1 +ATOM 16980 C C . ASP D 1 244 ? 44.290 64.269 57.326 1.00 21.05 ? 264 ASP E C 1 +ATOM 16981 O O . ASP D 1 244 ? 45.367 63.943 56.790 1.00 20.54 ? 264 ASP E O 1 +ATOM 16982 C CB . ASP D 1 244 ? 41.877 64.868 56.605 1.00 20.81 ? 264 ASP E CB 1 +ATOM 16983 C CG . ASP D 1 244 ? 41.649 63.461 56.049 1.00 20.80 ? 264 ASP E CG 1 +ATOM 16984 O OD1 . ASP D 1 244 ? 42.612 62.706 55.802 1.00 21.14 ? 264 ASP E OD1 1 +ATOM 16985 O OD2 . ASP D 1 244 ? 40.458 63.115 55.860 1.00 20.94 ? 264 ASP E OD2 1 +ATOM 16986 N N . ALA D 1 245 ? 43.887 63.778 58.496 1.00 22.07 ? 265 ALA E N 1 +ATOM 16987 C CA . ALA D 1 245 ? 44.750 62.927 59.319 1.00 23.39 ? 265 ALA E CA 1 +ATOM 16988 C C . ALA D 1 245 ? 45.101 61.604 58.632 1.00 24.66 ? 265 ALA E C 1 +ATOM 16989 O O . ALA D 1 245 ? 46.141 61.007 58.928 1.00 25.03 ? 265 ALA E O 1 +ATOM 16990 C CB . ALA D 1 245 ? 44.108 62.672 60.673 1.00 23.29 ? 265 ALA E CB 1 +ATOM 16991 N N . GLU D 1 246 ? 44.229 61.165 57.722 1.00 25.90 ? 266 GLU E N 1 +ATOM 16992 C CA . GLU D 1 246 ? 44.461 59.985 56.887 1.00 26.85 ? 266 GLU E CA 1 +ATOM 16993 C C . GLU D 1 246 ? 44.912 60.379 55.470 1.00 26.94 ? 266 GLU E C 1 +ATOM 16994 O O . GLU D 1 246 ? 44.574 59.705 54.490 1.00 27.59 ? 266 GLU E O 1 +ATOM 16995 C CB . GLU D 1 246 ? 43.178 59.142 56.827 1.00 26.94 ? 266 GLU E CB 1 +ATOM 16996 C CG . GLU D 1 246 ? 43.374 57.697 56.363 1.00 27.90 ? 266 GLU E CG 1 +ATOM 16997 C CD . GLU D 1 246 ? 42.195 56.805 56.710 1.00 27.50 ? 266 GLU E CD 1 +ATOM 16998 O OE1 . GLU D 1 246 ? 41.061 57.699 57.273 0.00 32.74 ? 266 GLU E OE1 1 +ATOM 16999 O OE2 . GLU D 1 246 ? 42.022 55.836 56.588 0.00 32.66 ? 266 GLU E OE2 1 +ATOM 17000 N N . ASN D 1 247 ? 45.689 61.456 55.365 1.00 26.77 ? 267 ASN E N 1 +ATOM 17001 C CA . ASN D 1 247 ? 46.212 61.964 54.081 1.00 26.83 ? 267 ASN E CA 1 +ATOM 17002 C C . ASN D 1 247 ? 45.226 62.016 52.890 1.00 26.40 ? 267 ASN E C 1 +ATOM 17003 O O . ASN D 1 247 ? 45.631 61.897 51.732 1.00 26.62 ? 267 ASN E O 1 +ATOM 17004 C CB . ASN D 1 247 ? 47.539 61.273 53.672 1.00 27.27 ? 267 ASN E CB 1 +ATOM 17005 C CG . ASN D 1 247 ? 47.956 60.151 54.614 1.00 28.81 ? 267 ASN E CG 1 +ATOM 17006 O OD1 . ASN D 1 247 ? 47.454 59.029 54.528 1.00 32.40 ? 267 ASN E OD1 1 +ATOM 17007 N ND2 . ASN D 1 247 ? 48.909 60.441 55.492 1.00 29.81 ? 267 ASN E ND2 1 +ATOM 17008 N N . LYS D 1 248 ? 43.942 62.200 53.185 1.00 25.57 ? 268 LYS E N 1 +ATOM 17009 C CA . LYS D 1 248 ? 42.938 62.436 52.162 1.00 25.18 ? 268 LYS E CA 1 +ATOM 17010 C C . LYS D 1 248 ? 42.848 63.941 51.956 1.00 24.27 ? 268 LYS E C 1 +ATOM 17011 O O . LYS D 1 248 ? 42.750 64.693 52.931 1.00 23.97 ? 268 LYS E O 1 +ATOM 17012 C CB . LYS D 1 248 ? 41.582 61.882 52.601 1.00 25.41 ? 268 LYS E CB 1 +ATOM 17013 C CG . LYS D 1 248 ? 40.487 62.015 51.557 1.00 26.96 ? 268 LYS E CG 1 +ATOM 17014 C CD . LYS D 1 248 ? 39.176 61.422 52.034 1.00 28.99 ? 268 LYS E CD 1 +ATOM 17015 C CE . LYS D 1 248 ? 38.147 61.384 50.907 1.00 29.80 ? 268 LYS E CE 1 +ATOM 17016 N NZ . LYS D 1 248 ? 36.910 60.635 51.277 1.00 30.26 ? 268 LYS E NZ 1 +ATOM 17017 N N . VAL D 1 249 ? 42.879 64.367 50.694 1.00 23.12 ? 269 VAL E N 1 +ATOM 17018 C CA . VAL D 1 249 ? 42.789 65.782 50.342 1.00 22.52 ? 269 VAL E CA 1 +ATOM 17019 C C . VAL D 1 249 ? 41.380 66.294 50.623 1.00 21.96 ? 269 VAL E C 1 +ATOM 17020 O O . VAL D 1 249 ? 40.406 65.749 50.102 1.00 22.60 ? 269 VAL E O 1 +ATOM 17021 C CB . VAL D 1 249 ? 43.135 66.029 48.857 1.00 22.07 ? 269 VAL E CB 1 +ATOM 17022 C CG1 . VAL D 1 249 ? 42.902 67.498 48.485 1.00 22.82 ? 269 VAL E CG1 1 +ATOM 17023 C CG2 . VAL D 1 249 ? 44.581 65.648 48.581 1.00 22.66 ? 269 VAL E CG2 1 +ATOM 17024 N N . VAL D 1 250 ? 41.282 67.325 51.459 1.00 21.13 ? 270 VAL E N 1 +ATOM 17025 C CA . VAL D 1 250 ? 39.993 67.934 51.821 1.00 20.84 ? 270 VAL E CA 1 +ATOM 17026 C C . VAL D 1 250 ? 39.840 69.359 51.270 1.00 20.98 ? 270 VAL E C 1 +ATOM 17027 O O . VAL D 1 250 ? 38.745 69.934 51.321 1.00 21.04 ? 270 VAL E O 1 +ATOM 17028 C CB . VAL D 1 250 ? 39.797 67.969 53.351 1.00 20.84 ? 270 VAL E CB 1 +ATOM 17029 C CG1 . VAL D 1 250 ? 39.872 66.549 53.926 1.00 20.09 ? 270 VAL E CG1 1 +ATOM 17030 C CG2 . VAL D 1 250 ? 40.823 68.896 54.032 1.00 20.22 ? 270 VAL E CG2 1 +ATOM 17031 N N . ALA D 1 251 ? 40.930 69.928 50.755 1.00 20.69 ? 271 ALA E N 1 +ATOM 17032 C CA . ALA D 1 251 ? 40.893 71.268 50.161 1.00 20.61 ? 271 ALA E CA 1 +ATOM 17033 C C . ALA D 1 251 ? 42.141 71.537 49.335 1.00 20.70 ? 271 ALA E C 1 +ATOM 17034 O O . ALA D 1 251 ? 43.204 70.959 49.593 1.00 20.96 ? 271 ALA E O 1 +ATOM 17035 C CB . ALA D 1 251 ? 40.725 72.331 51.245 1.00 20.70 ? 271 ALA E CB 1 +ATOM 17036 N N . ASN D 1 252 ? 42.028 72.410 48.337 1.00 20.42 ? 272 ASN E N 1 +ATOM 17037 C CA . ASN D 1 252 ? 43.199 72.732 47.527 1.00 20.32 ? 272 ASN E CA 1 +ATOM 17038 C C . ASN D 1 252 ? 43.132 74.092 46.855 1.00 20.14 ? 272 ASN E C 1 +ATOM 17039 O O . ASN D 1 252 ? 42.056 74.684 46.693 1.00 20.39 ? 272 ASN E O 1 +ATOM 17040 C CB . ASN D 1 252 ? 43.473 71.623 46.499 1.00 20.43 ? 272 ASN E CB 1 +ATOM 17041 C CG . ASN D 1 252 ? 42.456 71.606 45.375 1.00 22.13 ? 272 ASN E CG 1 +ATOM 17042 O OD1 . ASN D 1 252 ? 41.320 71.175 45.562 1.00 22.82 ? 272 ASN E OD1 1 +ATOM 17043 N ND2 . ASN D 1 252 ? 42.868 72.112 44.199 1.00 25.09 ? 272 ASN E ND2 1 +ATOM 17044 N N . GLY D 1 253 ? 44.300 74.598 46.485 1.00 19.40 ? 273 GLY E N 1 +ATOM 17045 C CA . GLY D 1 253 ? 44.405 75.920 45.895 1.00 18.90 ? 273 GLY E CA 1 +ATOM 17046 C C . GLY D 1 253 ? 45.686 76.067 45.111 1.00 18.54 ? 273 GLY E C 1 +ATOM 17047 O O . GLY D 1 253 ? 46.390 75.083 44.884 1.00 18.26 ? 273 GLY E O 1 +ATOM 17048 N N . THR D 1 254 ? 45.966 77.292 44.681 1.00 17.97 ? 274 THR E N 1 +ATOM 17049 C CA . THR D 1 254 ? 47.166 77.603 43.913 1.00 18.22 ? 274 THR E CA 1 +ATOM 17050 C C . THR D 1 254 ? 47.733 78.955 44.336 1.00 18.26 ? 274 THR E C 1 +ATOM 17051 O O . THR D 1 254 ? 47.147 79.658 45.157 1.00 17.66 ? 274 THR E O 1 +ATOM 17052 C CB . THR D 1 254 ? 46.870 77.645 42.390 1.00 18.41 ? 274 THR E CB 1 +ATOM 17053 O OG1 . THR D 1 254 ? 45.892 78.655 42.116 1.00 19.24 ? 274 THR E OG1 1 +ATOM 17054 C CG2 . THR D 1 254 ? 46.365 76.295 41.870 1.00 18.44 ? 274 THR E CG2 1 +ATOM 17055 N N . GLY D 1 255 ? 48.878 79.314 43.769 1.00 18.31 ? 275 GLY E N 1 +ATOM 17056 C CA . GLY D 1 255 ? 49.418 80.645 43.915 1.00 18.70 ? 275 GLY E CA 1 +ATOM 17057 C C . GLY D 1 255 ? 50.229 80.814 45.180 1.00 18.53 ? 275 GLY E C 1 +ATOM 17058 O O . GLY D 1 255 ? 50.326 79.903 46.001 1.00 18.64 ? 275 GLY E O 1 +ATOM 17059 N N . THR D 1 256 ? 50.818 81.992 45.318 1.00 18.38 ? 276 THR E N 1 +ATOM 17060 C CA . THR D 1 256 ? 51.641 82.322 46.470 1.00 18.26 ? 276 THR E CA 1 +ATOM 17061 C C . THR D 1 256 ? 50.807 82.759 47.675 1.00 18.29 ? 276 THR E C 1 +ATOM 17062 O O . THR D 1 256 ? 51.347 82.953 48.769 1.00 18.34 ? 276 THR E O 1 +ATOM 17063 C CB . THR D 1 256 ? 52.600 83.467 46.130 1.00 17.99 ? 276 THR E CB 1 +ATOM 17064 O OG1 . THR D 1 256 ? 51.843 84.573 45.622 1.00 18.68 ? 276 THR E OG1 1 +ATOM 17065 C CG2 . THR D 1 256 ? 53.626 83.024 45.090 1.00 17.17 ? 276 THR E CG2 1 +ATOM 17066 N N . GLN D 1 257 ? 49.507 82.959 47.473 1.00 18.29 ? 277 GLN E N 1 +ATOM 17067 C CA . GLN D 1 257 ? 48.604 83.189 48.598 1.00 18.64 ? 277 GLN E CA 1 +ATOM 17068 C C . GLN D 1 257 ? 47.178 82.754 48.263 1.00 18.04 ? 277 GLN E C 1 +ATOM 17069 O O . GLN D 1 257 ? 46.809 82.615 47.098 1.00 17.76 ? 277 GLN E O 1 +ATOM 17070 C CB . GLN D 1 257 ? 48.681 84.646 49.094 1.00 18.62 ? 277 GLN E CB 1 +ATOM 17071 C CG . GLN D 1 257 ? 47.881 85.680 48.328 1.00 20.07 ? 277 GLN E CG 1 +ATOM 17072 C CD . GLN D 1 257 ? 47.945 87.073 48.982 1.00 20.50 ? 277 GLN E CD 1 +ATOM 17073 O OE1 . GLN D 1 257 ? 48.866 87.848 48.726 1.00 23.02 ? 277 GLN E OE1 1 +ATOM 17074 N NE2 . GLN D 1 257 ? 46.963 87.384 49.830 1.00 23.26 ? 277 GLN E NE2 1 +ATOM 17075 N N . GLY D 1 258 ? 46.397 82.492 49.297 1.00 17.72 ? 278 GLY E N 1 +ATOM 17076 C CA . GLY D 1 258 ? 45.044 81.993 49.112 1.00 17.66 ? 278 GLY E CA 1 +ATOM 17077 C C . GLY D 1 258 ? 44.419 81.574 50.425 1.00 17.40 ? 278 GLY E C 1 +ATOM 17078 O O . GLY D 1 258 ? 45.049 81.642 51.483 1.00 17.51 ? 278 GLY E O 1 +ATOM 17079 N N . GLN D 1 259 ? 43.165 81.157 50.357 1.00 17.25 ? 279 GLN E N 1 +ATOM 17080 C CA . GLN D 1 259 ? 42.465 80.655 51.529 1.00 16.78 ? 279 GLN E CA 1 +ATOM 17081 C C . GLN D 1 259 ? 41.790 79.347 51.163 1.00 16.97 ? 279 GLN E C 1 +ATOM 17082 O O . GLN D 1 259 ? 41.122 79.261 50.127 1.00 16.61 ? 279 GLN E O 1 +ATOM 17083 C CB . GLN D 1 259 ? 41.435 81.668 52.011 1.00 16.95 ? 279 GLN E CB 1 +ATOM 17084 C CG . GLN D 1 259 ? 40.780 81.331 53.333 1.00 16.35 ? 279 GLN E CG 1 +ATOM 17085 C CD . GLN D 1 259 ? 39.762 82.363 53.736 1.00 16.66 ? 279 GLN E CD 1 +ATOM 17086 O OE1 . GLN D 1 259 ? 40.036 83.232 54.565 1.00 18.38 ? 279 GLN E OE1 1 +ATOM 17087 N NE2 . GLN D 1 259 ? 38.590 82.305 53.121 1.00 16.17 ? 279 GLN E NE2 1 +ATOM 17088 N N . LEU D 1 260 ? 41.972 78.335 52.007 1.00 16.42 ? 280 LEU E N 1 +ATOM 17089 C CA . LEU D 1 260 ? 41.336 77.042 51.812 1.00 16.46 ? 280 LEU E CA 1 +ATOM 17090 C C . LEU D 1 260 ? 40.178 76.899 52.792 1.00 17.03 ? 280 LEU E C 1 +ATOM 17091 O O . LEU D 1 260 ? 40.295 77.293 53.952 1.00 16.69 ? 280 LEU E O 1 +ATOM 17092 C CB . LEU D 1 260 ? 42.346 75.915 52.044 1.00 16.43 ? 280 LEU E CB 1 +ATOM 17093 C CG . LEU D 1 260 ? 43.617 75.968 51.194 1.00 15.99 ? 280 LEU E CG 1 +ATOM 17094 C CD1 . LEU D 1 260 ? 44.612 74.875 51.627 1.00 16.98 ? 280 LEU E CD1 1 +ATOM 17095 C CD2 . LEU D 1 260 ? 43.274 75.835 49.720 1.00 16.10 ? 280 LEU E CD2 1 +ATOM 17096 N N . LYS D 1 261 ? 39.057 76.351 52.321 1.00 17.45 ? 281 LYS E N 1 +ATOM 17097 C CA . LYS D 1 261 ? 37.897 76.093 53.175 1.00 17.77 ? 281 LYS E CA 1 +ATOM 17098 C C . LYS D 1 261 ? 37.740 74.589 53.411 1.00 17.72 ? 281 LYS E C 1 +ATOM 17099 O O . LYS D 1 261 ? 37.746 73.799 52.462 1.00 17.81 ? 281 LYS E O 1 +ATOM 17100 C CB . LYS D 1 261 ? 36.627 76.671 52.542 1.00 18.20 ? 281 LYS E CB 1 +ATOM 17101 C CG . LYS D 1 261 ? 35.357 76.498 53.380 1.00 19.53 ? 281 LYS E CG 1 +ATOM 17102 C CD . LYS D 1 261 ? 34.308 77.592 53.073 1.00 21.54 ? 281 LYS E CD 1 +ATOM 17103 C CE . LYS D 1 261 ? 34.027 77.707 51.570 1.00 22.96 ? 281 LYS E CE 1 +ATOM 17104 N NZ . LYS D 1 261 ? 32.712 78.347 51.225 1.00 24.49 ? 281 LYS E NZ 1 +ATOM 17105 N N . VAL D 1 262 ? 37.584 74.221 54.680 1.00 17.77 ? 282 VAL E N 1 +ATOM 17106 C CA . VAL D 1 262 ? 37.497 72.825 55.120 1.00 17.75 ? 282 VAL E CA 1 +ATOM 17107 C C . VAL D 1 262 ? 36.126 72.545 55.737 1.00 17.84 ? 282 VAL E C 1 +ATOM 17108 O O . VAL D 1 262 ? 35.875 72.898 56.891 1.00 16.93 ? 282 VAL E O 1 +ATOM 17109 C CB . VAL D 1 262 ? 38.595 72.501 56.149 1.00 17.91 ? 282 VAL E CB 1 +ATOM 17110 C CG1 . VAL D 1 262 ? 38.618 71.001 56.449 1.00 18.65 ? 282 VAL E CG1 1 +ATOM 17111 C CG2 . VAL D 1 262 ? 39.944 72.986 55.627 1.00 18.60 ? 282 VAL E CG2 1 +ATOM 17112 N N . PRO D 1 263 ? 35.229 71.908 54.961 1.00 18.32 ? 283 PRO E N 1 +ATOM 17113 C CA . PRO D 1 263 ? 33.890 71.539 55.430 1.00 18.45 ? 283 PRO E CA 1 +ATOM 17114 C C . PRO D 1 263 ? 33.914 70.524 56.569 1.00 17.96 ? 283 PRO E C 1 +ATOM 17115 O O . PRO D 1 263 ? 34.705 69.584 56.533 1.00 18.52 ? 283 PRO E O 1 +ATOM 17116 C CB . PRO D 1 263 ? 33.249 70.877 54.201 1.00 18.63 ? 283 PRO E CB 1 +ATOM 17117 C CG . PRO D 1 263 ? 34.081 71.251 53.053 1.00 18.88 ? 283 PRO E CG 1 +ATOM 17118 C CD . PRO D 1 263 ? 35.456 71.492 53.565 1.00 18.57 ? 283 PRO E CD 1 +ATOM 17119 N N . GLY D 1 264 ? 33.021 70.694 57.543 1.00 17.66 ? 284 GLY E N 1 +ATOM 17120 C CA . GLY D 1 264 ? 32.928 69.785 58.693 1.00 16.87 ? 284 GLY E CA 1 +ATOM 17121 C C . GLY D 1 264 ? 34.278 69.562 59.353 1.00 16.00 ? 284 GLY E C 1 +ATOM 17122 O O . GLY D 1 264 ? 34.697 68.419 59.563 1.00 16.62 ? 284 GLY E O 1 +ATOM 17123 N N . VAL D 1 265 ? 34.951 70.667 59.660 1.00 15.43 ? 285 VAL E N 1 +ATOM 17124 C CA . VAL D 1 265 ? 36.345 70.637 60.121 1.00 14.27 ? 285 VAL E CA 1 +ATOM 17125 C C . VAL D 1 265 ? 36.511 69.993 61.484 1.00 13.86 ? 285 VAL E C 1 +ATOM 17126 O O . VAL D 1 265 ? 35.592 70.014 62.323 1.00 13.16 ? 285 VAL E O 1 +ATOM 17127 C CB . VAL D 1 265 ? 36.947 72.048 60.163 1.00 13.90 ? 285 VAL E CB 1 +ATOM 17128 C CG1 . VAL D 1 265 ? 36.342 72.873 61.316 1.00 12.95 ? 285 VAL E CG1 1 +ATOM 17129 C CG2 . VAL D 1 265 ? 38.475 71.981 60.276 1.00 13.51 ? 285 VAL E CG2 1 +ATOM 17130 N N . SER D 1 266 ? 37.689 69.392 61.672 1.00 13.53 ? 286 SER E N 1 +ATOM 17131 C CA . SER D 1 266 ? 38.132 68.890 62.962 1.00 13.80 ? 286 SER E CA 1 +ATOM 17132 C C . SER D 1 266 ? 39.123 69.926 63.496 1.00 13.32 ? 286 SER E C 1 +ATOM 17133 O O . SER D 1 266 ? 40.265 70.007 63.032 1.00 13.15 ? 286 SER E O 1 +ATOM 17134 C CB . SER D 1 266 ? 38.820 67.524 62.830 1.00 13.89 ? 286 SER E CB 1 +ATOM 17135 O OG . SER D 1 266 ? 37.905 66.478 62.500 1.00 15.43 ? 286 SER E OG 1 +ATOM 17136 N N . LEU D 1 267 ? 38.657 70.746 64.435 1.00 12.37 ? 287 LEU E N 1 +ATOM 17137 C CA . LEU D 1 267 ? 39.494 71.757 65.082 1.00 12.28 ? 287 LEU E CA 1 +ATOM 17138 C C . LEU D 1 267 ? 40.588 71.104 65.906 1.00 11.56 ? 287 LEU E C 1 +ATOM 17139 O O . LEU D 1 267 ? 40.432 69.989 66.413 1.00 10.09 ? 287 LEU E O 1 +ATOM 17140 C CB . LEU D 1 267 ? 38.659 72.635 66.020 1.00 12.53 ? 287 LEU E CB 1 +ATOM 17141 C CG . LEU D 1 267 ? 38.006 73.950 65.540 1.00 14.42 ? 287 LEU E CG 1 +ATOM 17142 C CD1 . LEU D 1 267 ? 37.924 74.114 64.025 1.00 14.59 ? 287 LEU E CD1 1 +ATOM 17143 C CD2 . LEU D 1 267 ? 36.658 74.120 66.195 1.00 13.53 ? 287 LEU E CD2 1 +ATOM 17144 N N . TRP D 1 268 ? 41.683 71.839 66.050 1.00 11.00 ? 288 TRP E N 1 +ATOM 17145 C CA . TRP D 1 268 ? 42.770 71.463 66.931 1.00 10.91 ? 288 TRP E CA 1 +ATOM 17146 C C . TRP D 1 268 ? 42.390 71.903 68.337 1.00 10.50 ? 288 TRP E C 1 +ATOM 17147 O O . TRP D 1 268 ? 42.172 73.103 68.585 1.00 9.83 ? 288 TRP E O 1 +ATOM 17148 C CB . TRP D 1 268 ? 44.061 72.145 66.476 1.00 10.45 ? 288 TRP E CB 1 +ATOM 17149 C CG . TRP D 1 268 ? 45.322 71.731 67.203 1.00 11.49 ? 288 TRP E CG 1 +ATOM 17150 C CD1 . TRP D 1 268 ? 46.255 70.846 66.759 1.00 11.63 ? 288 TRP E CD1 1 +ATOM 17151 C CD2 . TRP D 1 268 ? 45.803 72.217 68.482 1.00 10.80 ? 288 TRP E CD2 1 +ATOM 17152 N NE1 . TRP D 1 268 ? 47.284 70.734 67.676 1.00 10.69 ? 288 TRP E NE1 1 +ATOM 17153 C CE2 . TRP D 1 268 ? 47.027 71.554 68.745 1.00 9.97 ? 288 TRP E CE2 1 +ATOM 17154 C CE3 . TRP D 1 268 ? 45.311 73.125 69.432 1.00 11.21 ? 288 TRP E CE3 1 +ATOM 17155 C CZ2 . TRP D 1 268 ? 47.768 71.786 69.906 1.00 11.02 ? 288 TRP E CZ2 1 +ATOM 17156 C CZ3 . TRP D 1 268 ? 46.057 73.359 70.589 1.00 11.15 ? 288 TRP E CZ3 1 +ATOM 17157 C CH2 . TRP D 1 268 ? 47.270 72.690 70.813 1.00 11.18 ? 288 TRP E CH2 1 +ATOM 17158 N N . TRP D 1 269 ? 42.307 70.932 69.245 1.00 10.28 ? 289 TRP E N 1 +ATOM 17159 C CA . TRP D 1 269 ? 41.987 71.171 70.668 1.00 10.75 ? 289 TRP E CA 1 +ATOM 17160 C C . TRP D 1 269 ? 43.148 70.792 71.586 1.00 10.54 ? 289 TRP E C 1 +ATOM 17161 O O . TRP D 1 269 ? 43.789 69.763 71.366 1.00 9.36 ? 289 TRP E O 1 +ATOM 17162 C CB . TRP D 1 269 ? 40.779 70.325 71.101 1.00 11.49 ? 289 TRP E CB 1 +ATOM 17163 C CG . TRP D 1 269 ? 39.488 70.750 70.474 1.00 12.20 ? 289 TRP E CG 1 +ATOM 17164 C CD1 . TRP D 1 269 ? 38.844 70.147 69.443 1.00 12.40 ? 289 TRP E CD1 1 +ATOM 17165 C CD2 . TRP D 1 269 ? 38.698 71.899 70.826 1.00 10.99 ? 289 TRP E CD2 1 +ATOM 17166 N NE1 . TRP D 1 269 ? 37.693 70.831 69.133 1.00 12.31 ? 289 TRP E NE1 1 +ATOM 17167 C CE2 . TRP D 1 269 ? 37.573 71.903 69.977 1.00 12.25 ? 289 TRP E CE2 1 +ATOM 17168 C CE3 . TRP D 1 269 ? 38.818 72.905 71.791 1.00 13.19 ? 289 TRP E CE3 1 +ATOM 17169 C CZ2 . TRP D 1 269 ? 36.590 72.891 70.050 1.00 11.77 ? 289 TRP E CZ2 1 +ATOM 17170 C CZ3 . TRP D 1 269 ? 37.837 73.888 71.864 1.00 12.38 ? 289 TRP E CZ3 1 +ATOM 17171 C CH2 . TRP D 1 269 ? 36.737 73.867 70.993 1.00 12.48 ? 289 TRP E CH2 1 +ATOM 17172 N N . PRO D 1 270 ? 43.387 71.595 72.641 1.00 10.34 ? 290 PRO E N 1 +ATOM 17173 C CA . PRO D 1 270 ? 44.345 71.220 73.672 1.00 10.03 ? 290 PRO E CA 1 +ATOM 17174 C C . PRO D 1 270 ? 43.992 69.919 74.388 1.00 10.72 ? 290 PRO E C 1 +ATOM 17175 O O . PRO D 1 270 ? 42.818 69.575 74.558 1.00 10.29 ? 290 PRO E O 1 +ATOM 17176 C CB . PRO D 1 270 ? 44.288 72.392 74.660 1.00 10.19 ? 290 PRO E CB 1 +ATOM 17177 C CG . PRO D 1 270 ? 43.812 73.539 73.868 1.00 9.85 ? 290 PRO E CG 1 +ATOM 17178 C CD . PRO D 1 270 ? 42.805 72.918 72.923 1.00 10.55 ? 290 PRO E CD 1 +ATOM 17179 N N . TYR D 1 271 ? 45.030 69.204 74.786 1.00 10.74 ? 291 TYR E N 1 +ATOM 17180 C CA . TYR D 1 271 ? 44.937 68.040 75.642 1.00 10.78 ? 291 TYR E CA 1 +ATOM 17181 C C . TYR D 1 271 ? 43.972 68.300 76.803 1.00 11.24 ? 291 TYR E C 1 +ATOM 17182 O O . TYR D 1 271 ? 44.067 69.323 77.483 1.00 11.21 ? 291 TYR E O 1 +ATOM 17183 C CB . TYR D 1 271 ? 46.343 67.719 76.174 1.00 11.10 ? 291 TYR E CB 1 +ATOM 17184 C CG . TYR D 1 271 ? 46.423 66.592 77.170 1.00 10.58 ? 291 TYR E CG 1 +ATOM 17185 C CD1 . TYR D 1 271 ? 45.874 65.341 76.894 1.00 10.07 ? 291 TYR E CD1 1 +ATOM 17186 C CD2 . TYR D 1 271 ? 47.073 66.763 78.392 1.00 10.40 ? 291 TYR E CD2 1 +ATOM 17187 C CE1 . TYR D 1 271 ? 45.962 64.300 77.814 1.00 12.18 ? 291 TYR E CE1 1 +ATOM 17188 C CE2 . TYR D 1 271 ? 47.152 65.723 79.318 1.00 10.20 ? 291 TYR E CE2 1 +ATOM 17189 C CZ . TYR D 1 271 ? 46.595 64.489 79.017 1.00 11.96 ? 291 TYR E CZ 1 +ATOM 17190 O OH . TYR D 1 271 ? 46.652 63.412 79.898 1.00 11.30 ? 291 TYR E OH 1 +ATOM 17191 N N . LEU D 1 272 ? 43.022 67.382 76.970 1.00 12.24 ? 292 LEU E N 1 +ATOM 17192 C CA . LEU D 1 272 ? 41.989 67.423 78.013 1.00 13.09 ? 292 LEU E CA 1 +ATOM 17193 C C . LEU D 1 272 ? 40.862 68.444 77.782 1.00 14.48 ? 292 LEU E C 1 +ATOM 17194 O O . LEU D 1 272 ? 39.959 68.552 78.617 1.00 14.66 ? 292 LEU E O 1 +ATOM 17195 C CB . LEU D 1 272 ? 42.594 67.596 79.417 1.00 13.57 ? 292 LEU E CB 1 +ATOM 17196 C CG . LEU D 1 272 ? 43.580 66.500 79.815 1.00 13.17 ? 292 LEU E CG 1 +ATOM 17197 C CD1 . LEU D 1 272 ? 44.126 66.728 81.229 1.00 14.27 ? 292 LEU E CD1 1 +ATOM 17198 C CD2 . LEU D 1 272 ? 42.950 65.111 79.674 1.00 14.03 ? 292 LEU E CD2 1 +ATOM 17199 N N . MET D 1 273 ? 40.912 69.175 76.669 1.00 15.37 ? 293 MET E N 1 +ATOM 17200 C CA . MET D 1 273 ? 39.800 70.042 76.265 1.00 16.41 ? 293 MET E CA 1 +ATOM 17201 C C . MET D 1 273 ? 38.819 69.304 75.343 1.00 17.15 ? 293 MET E C 1 +ATOM 17202 O O . MET D 1 273 ? 37.682 69.764 75.152 1.00 17.82 ? 293 MET E O 1 +ATOM 17203 C CB . MET D 1 273 ? 40.326 71.310 75.587 1.00 16.66 ? 293 MET E CB 1 +ATOM 17204 C CG . MET D 1 273 ? 39.305 72.428 75.509 1.00 16.82 ? 293 MET E CG 1 +ATOM 17205 S SD . MET D 1 273 ? 40.038 74.030 75.127 1.00 17.10 ? 293 MET E SD 1 +ATOM 17206 C CE . MET D 1 273 ? 38.578 75.061 75.269 1.00 16.86 ? 293 MET E CE 1 +ATOM 17207 N N . HIS D 1 274 ? 39.249 68.165 74.801 1.00 17.77 ? 294 HIS E N 1 +ATOM 17208 C CA . HIS D 1 274 ? 38.451 67.341 73.882 1.00 18.24 ? 294 HIS E CA 1 +ATOM 17209 C C . HIS D 1 274 ? 38.964 65.900 73.955 1.00 18.16 ? 294 HIS E C 1 +ATOM 17210 O O . HIS D 1 274 ? 40.154 65.675 74.187 1.00 17.99 ? 294 HIS E O 1 +ATOM 17211 C CB . HIS D 1 274 ? 38.575 67.890 72.456 1.00 18.47 ? 294 HIS E CB 1 +ATOM 17212 C CG . HIS D 1 274 ? 37.591 67.318 71.477 1.00 19.77 ? 294 HIS E CG 1 +ATOM 17213 N ND1 . HIS D 1 274 ? 37.734 66.067 70.914 1.00 19.15 ? 294 HIS E ND1 1 +ATOM 17214 C CD2 . HIS D 1 274 ? 36.470 67.848 70.931 1.00 20.62 ? 294 HIS E CD2 1 +ATOM 17215 C CE1 . HIS D 1 274 ? 36.732 65.841 70.082 1.00 20.99 ? 294 HIS E CE1 1 +ATOM 17216 N NE2 . HIS D 1 274 ? 35.955 66.910 70.068 1.00 20.78 ? 294 HIS E NE2 1 +ATOM 17217 N N . GLU D 1 275 ? 38.080 64.926 73.754 1.00 18.24 ? 295 GLU E N 1 +ATOM 17218 C CA . GLU D 1 275 ? 38.468 63.512 73.804 1.00 18.89 ? 295 GLU E CA 1 +ATOM 17219 C C . GLU D 1 275 ? 39.469 63.113 72.703 1.00 18.24 ? 295 GLU E C 1 +ATOM 17220 O O . GLU D 1 275 ? 40.202 62.132 72.849 1.00 18.70 ? 295 GLU E O 1 +ATOM 17221 C CB . GLU D 1 275 ? 37.232 62.595 73.748 1.00 19.33 ? 295 GLU E CB 1 +ATOM 17222 C CG . GLU D 1 275 ? 36.537 62.392 75.098 1.00 20.19 ? 295 GLU E CG 1 +ATOM 17223 C CD . GLU D 1 275 ? 35.608 61.189 75.102 1.00 20.29 ? 295 GLU E CD 1 +ATOM 17224 O OE1 . GLU D 1 275 ? 36.092 60.046 74.635 0.00 30.00 ? 295 GLU E OE1 1 +ATOM 17225 O OE2 . GLU D 1 275 ? 34.280 61.277 74.898 0.00 28.90 ? 295 GLU E OE2 1 +ATOM 17226 N N . ARG D 1 276 ? 39.493 63.869 71.606 1.00 17.56 ? 296 ARG E N 1 +ATOM 17227 C CA . ARG D 1 276 ? 40.436 63.638 70.518 1.00 17.37 ? 296 ARG E CA 1 +ATOM 17228 C C . ARG D 1 276 ? 41.179 64.943 70.235 1.00 15.91 ? 296 ARG E C 1 +ATOM 17229 O O . ARG D 1 276 ? 40.858 65.663 69.284 1.00 15.70 ? 296 ARG E O 1 +ATOM 17230 C CB . ARG D 1 276 ? 39.712 63.134 69.269 1.00 18.23 ? 296 ARG E CB 1 +ATOM 17231 C CG . ARG D 1 276 ? 39.241 61.672 69.371 1.00 21.11 ? 296 ARG E CG 1 +ATOM 17232 C CD . ARG D 1 276 ? 39.027 61.071 67.977 1.00 26.63 ? 296 ARG E CD 1 +ATOM 17233 N NE . ARG D 1 276 ? 38.946 59.605 67.960 1.00 29.35 ? 296 ARG E NE 1 +ATOM 17234 C CZ . ARG D 1 276 ? 37.847 58.882 67.729 1.00 30.71 ? 296 ARG E CZ 1 +ATOM 17235 N NH1 . ARG D 1 276 ? 36.664 59.457 67.500 1.00 32.66 ? 296 ARG E NH1 1 +ATOM 17236 N NH2 . ARG D 1 276 ? 37.931 57.550 67.736 1.00 31.50 ? 296 ARG E NH2 1 +ATOM 17237 N N . PRO D 1 277 ? 42.171 65.259 71.080 1.00 14.09 ? 297 PRO E N 1 +ATOM 17238 C CA . PRO D 1 277 ? 42.862 66.546 70.990 1.00 12.68 ? 297 PRO E CA 1 +ATOM 17239 C C . PRO D 1 277 ? 43.884 66.613 69.860 1.00 11.73 ? 297 PRO E C 1 +ATOM 17240 O O . PRO D 1 277 ? 44.234 65.593 69.281 1.00 10.64 ? 297 PRO E O 1 +ATOM 17241 C CB . PRO D 1 277 ? 43.583 66.629 72.334 1.00 12.92 ? 297 PRO E CB 1 +ATOM 17242 C CG . PRO D 1 277 ? 43.919 65.185 72.636 1.00 12.53 ? 297 PRO E CG 1 +ATOM 17243 C CD . PRO D 1 277 ? 42.686 64.436 72.190 1.00 14.16 ? 297 PRO E CD 1 +ATOM 17244 N N . ALA D 1 278 ? 44.335 67.828 69.552 1.00 10.45 ? 298 ALA E N 1 +ATOM 17245 C CA . ALA D 1 278 ? 45.490 68.044 68.691 1.00 10.65 ? 298 ALA E CA 1 +ATOM 17246 C C . ALA D 1 278 ? 45.345 67.540 67.249 1.00 10.68 ? 298 ALA E C 1 +ATOM 17247 O O . ALA D 1 278 ? 46.327 67.128 66.628 1.00 11.17 ? 298 ALA E O 1 +ATOM 17248 C CB . ALA D 1 278 ? 46.729 67.429 69.334 1.00 10.42 ? 298 ALA E CB 1 +ATOM 17249 N N . TYR D 1 279 ? 44.133 67.589 66.697 1.00 11.05 ? 299 TYR E N 1 +ATOM 17250 C CA . TYR D 1 279 ? 43.937 67.139 65.327 1.00 11.43 ? 299 TYR E CA 1 +ATOM 17251 C C . TYR D 1 279 ? 44.764 67.985 64.369 1.00 11.38 ? 299 TYR E C 1 +ATOM 17252 O O . TYR D 1 279 ? 44.649 69.207 64.362 1.00 11.09 ? 299 TYR E O 1 +ATOM 17253 C CB . TYR D 1 279 ? 42.459 67.195 64.924 1.00 11.79 ? 299 TYR E CB 1 +ATOM 17254 C CG . TYR D 1 279 ? 42.203 66.489 63.615 1.00 11.82 ? 299 TYR E CG 1 +ATOM 17255 C CD1 . TYR D 1 279 ? 42.486 67.114 62.404 1.00 14.22 ? 299 TYR E CD1 1 +ATOM 17256 C CD2 . TYR D 1 279 ? 41.708 65.186 63.588 1.00 13.39 ? 299 TYR E CD2 1 +ATOM 17257 C CE1 . TYR D 1 279 ? 42.260 66.477 61.188 1.00 12.54 ? 299 TYR E CE1 1 +ATOM 17258 C CE2 . TYR D 1 279 ? 41.491 64.529 62.367 1.00 13.67 ? 299 TYR E CE2 1 +ATOM 17259 C CZ . TYR D 1 279 ? 41.771 65.191 61.178 1.00 13.96 ? 299 TYR E CZ 1 +ATOM 17260 O OH . TYR D 1 279 ? 41.569 64.583 59.964 1.00 14.08 ? 299 TYR E OH 1 +ATOM 17261 N N . LEU D 1 280 ? 45.581 67.327 63.546 1.00 11.73 ? 300 LEU E N 1 +ATOM 17262 C CA . LEU D 1 280 ? 46.447 68.030 62.602 1.00 11.68 ? 300 LEU E CA 1 +ATOM 17263 C C . LEU D 1 280 ? 46.123 67.636 61.171 1.00 12.30 ? 300 LEU E C 1 +ATOM 17264 O O . LEU D 1 280 ? 46.086 66.444 60.834 1.00 11.87 ? 300 LEU E O 1 +ATOM 17265 C CB . LEU D 1 280 ? 47.926 67.737 62.888 1.00 11.55 ? 300 LEU E CB 1 +ATOM 17266 C CG . LEU D 1 280 ? 48.528 68.395 64.134 1.00 11.15 ? 300 LEU E CG 1 +ATOM 17267 C CD1 . LEU D 1 280 ? 49.806 67.620 64.573 1.00 11.49 ? 300 LEU E CD1 1 +ATOM 17268 C CD2 . LEU D 1 280 ? 48.825 69.865 63.884 1.00 11.83 ? 300 LEU E CD2 1 +ATOM 17269 N N . TYR D 1 281 ? 45.882 68.651 60.347 1.00 12.85 ? 301 TYR E N 1 +ATOM 17270 C CA . TYR D 1 281 ? 45.909 68.503 58.899 1.00 13.57 ? 301 TYR E CA 1 +ATOM 17271 C C . TYR D 1 281 ? 47.357 68.705 58.418 1.00 13.98 ? 301 TYR E C 1 +ATOM 17272 O O . TYR D 1 281 ? 48.228 69.092 59.201 1.00 14.09 ? 301 TYR E O 1 +ATOM 17273 C CB . TYR D 1 281 ? 45.014 69.564 58.259 1.00 13.06 ? 301 TYR E CB 1 +ATOM 17274 C CG . TYR D 1 281 ? 43.532 69.384 58.538 1.00 13.76 ? 301 TYR E CG 1 +ATOM 17275 C CD1 . TYR D 1 281 ? 42.708 68.726 57.625 1.00 12.49 ? 301 TYR E CD1 1 +ATOM 17276 C CD2 . TYR D 1 281 ? 42.956 69.878 59.713 1.00 13.35 ? 301 TYR E CD2 1 +ATOM 17277 C CE1 . TYR D 1 281 ? 41.345 68.569 57.871 1.00 12.86 ? 301 TYR E CE1 1 +ATOM 17278 C CE2 . TYR D 1 281 ? 41.598 69.723 59.969 1.00 13.49 ? 301 TYR E CE2 1 +ATOM 17279 C CZ . TYR D 1 281 ? 40.797 69.073 59.039 1.00 12.64 ? 301 TYR E CZ 1 +ATOM 17280 O OH . TYR D 1 281 ? 39.449 68.918 59.292 1.00 13.65 ? 301 TYR E OH 1 +ATOM 17281 N N . SER D 1 282 ? 47.617 68.448 57.140 1.00 14.24 ? 302 SER E N 1 +ATOM 17282 C CA . SER D 1 282 ? 48.913 68.784 56.557 1.00 15.11 ? 302 SER E CA 1 +ATOM 17283 C C . SER D 1 282 ? 48.744 69.600 55.273 1.00 15.40 ? 302 SER E C 1 +ATOM 17284 O O . SER D 1 282 ? 47.894 69.272 54.434 1.00 15.04 ? 302 SER E O 1 +ATOM 17285 C CB . SER D 1 282 ? 49.774 67.528 56.348 1.00 15.44 ? 302 SER E CB 1 +ATOM 17286 O OG . SER D 1 282 ? 49.230 66.618 55.410 1.00 18.57 ? 302 SER E OG 1 +ATOM 17287 N N . LEU D 1 283 ? 49.532 70.676 55.160 1.00 15.22 ? 303 LEU E N 1 +ATOM 17288 C CA . LEU D 1 283 ? 49.541 71.552 53.983 1.00 15.22 ? 303 LEU E CA 1 +ATOM 17289 C C . LEU D 1 283 ? 50.683 71.142 53.075 1.00 15.40 ? 303 LEU E C 1 +ATOM 17290 O O . LEU D 1 283 ? 51.839 71.475 53.343 1.00 14.40 ? 303 LEU E O 1 +ATOM 17291 C CB . LEU D 1 283 ? 49.710 73.024 54.374 1.00 15.42 ? 303 LEU E CB 1 +ATOM 17292 C CG . LEU D 1 283 ? 49.519 74.033 53.230 1.00 15.36 ? 303 LEU E CG 1 +ATOM 17293 C CD1 . LEU D 1 283 ? 48.024 74.172 52.868 1.00 17.06 ? 303 LEU E CD1 1 +ATOM 17294 C CD2 . LEU D 1 283 ? 50.107 75.387 53.581 1.00 16.50 ? 303 LEU E CD2 1 +ATOM 17295 N N . GLU D 1 284 ? 50.345 70.400 52.022 1.00 15.62 ? 304 GLU E N 1 +ATOM 17296 C CA . GLU D 1 284 ? 51.315 69.938 51.044 1.00 16.29 ? 304 GLU E CA 1 +ATOM 17297 C C . GLU D 1 284 ? 51.490 71.002 49.973 1.00 16.29 ? 304 GLU E C 1 +ATOM 17298 O O . GLU D 1 284 ? 50.542 71.323 49.252 1.00 16.01 ? 304 GLU E O 1 +ATOM 17299 C CB . GLU D 1 284 ? 50.844 68.620 50.426 1.00 16.76 ? 304 GLU E CB 1 +ATOM 17300 C CG . GLU D 1 284 ? 51.860 67.954 49.528 1.00 18.95 ? 304 GLU E CG 1 +ATOM 17301 C CD . GLU D 1 284 ? 51.341 66.660 48.932 1.00 22.71 ? 304 GLU E CD 1 +ATOM 17302 O OE1 . GLU D 1 284 ? 51.278 65.632 49.653 1.00 24.80 ? 304 GLU E OE1 1 +ATOM 17303 O OE2 . GLU D 1 284 ? 50.998 66.666 47.732 1.00 24.93 ? 304 GLU E OE2 1 +ATOM 17304 N N . VAL D 1 285 ? 52.704 71.539 49.866 1.00 16.30 ? 305 VAL E N 1 +ATOM 17305 C CA . VAL D 1 285 ? 53.007 72.608 48.915 1.00 16.66 ? 305 VAL E CA 1 +ATOM 17306 C C . VAL D 1 285 ? 53.889 72.039 47.809 1.00 16.82 ? 305 VAL E C 1 +ATOM 17307 O O . VAL D 1 285 ? 54.935 71.451 48.084 1.00 16.05 ? 305 VAL E O 1 +ATOM 17308 C CB . VAL D 1 285 ? 53.718 73.787 49.599 1.00 16.53 ? 305 VAL E CB 1 +ATOM 17309 C CG1 . VAL D 1 285 ? 54.031 74.897 48.586 1.00 17.03 ? 305 VAL E CG1 1 +ATOM 17310 C CG2 . VAL D 1 285 ? 52.880 74.316 50.753 1.00 16.69 ? 305 VAL E CG2 1 +ATOM 17311 N N . GLN D 1 286 ? 53.455 72.215 46.564 1.00 16.95 ? 306 GLN E N 1 +ATOM 17312 C CA . GLN D 1 286 ? 54.178 71.695 45.420 1.00 17.85 ? 306 GLN E CA 1 +ATOM 17313 C C . GLN D 1 286 ? 54.520 72.821 44.471 1.00 17.93 ? 306 GLN E C 1 +ATOM 17314 O O . GLN D 1 286 ? 53.638 73.397 43.838 1.00 17.60 ? 306 GLN E O 1 +ATOM 17315 C CB . GLN D 1 286 ? 53.351 70.644 44.689 1.00 18.15 ? 306 GLN E CB 1 +ATOM 17316 C CG . GLN D 1 286 ? 54.058 70.040 43.482 1.00 19.84 ? 306 GLN E CG 1 +ATOM 17317 C CD . GLN D 1 286 ? 53.225 68.965 42.833 1.00 22.06 ? 306 GLN E CD 1 +ATOM 17318 O OE1 . GLN D 1 286 ? 52.061 68.789 43.174 1.00 23.03 ? 306 GLN E OE1 1 +ATOM 17319 N NE2 . GLN D 1 286 ? 53.814 68.239 41.894 1.00 24.58 ? 306 GLN E NE2 1 +ATOM 17320 N N . LEU D 1 287 ? 55.809 73.105 44.370 1.00 17.89 ? 307 LEU E N 1 +ATOM 17321 C CA . LEU D 1 287 ? 56.334 74.114 43.470 1.00 18.30 ? 307 LEU E CA 1 +ATOM 17322 C C . LEU D 1 287 ? 56.791 73.447 42.177 1.00 19.40 ? 307 LEU E C 1 +ATOM 17323 O O . LEU D 1 287 ? 57.479 72.425 42.210 1.00 19.42 ? 307 LEU E O 1 +ATOM 17324 C CB . LEU D 1 287 ? 57.532 74.812 44.118 1.00 18.14 ? 307 LEU E CB 1 +ATOM 17325 C CG . LEU D 1 287 ? 58.292 75.842 43.289 1.00 18.07 ? 307 LEU E CG 1 +ATOM 17326 C CD1 . LEU D 1 287 ? 57.491 77.134 43.149 1.00 16.83 ? 307 LEU E CD1 1 +ATOM 17327 C CD2 . LEU D 1 287 ? 59.661 76.111 43.919 1.00 16.85 ? 307 LEU E CD2 1 +ATOM 17328 N N . THR D 1 288 ? 56.400 74.035 41.052 1.00 20.64 ? 308 THR E N 1 +ATOM 17329 C CA . THR D 1 288 ? 56.961 73.713 39.747 1.00 21.58 ? 308 THR E CA 1 +ATOM 17330 C C . THR D 1 288 ? 57.614 74.994 39.236 1.00 22.39 ? 308 THR E C 1 +ATOM 17331 O O . THR D 1 288 ? 56.941 76.008 39.059 1.00 22.05 ? 308 THR E O 1 +ATOM 17332 C CB . THR D 1 288 ? 55.867 73.228 38.776 1.00 21.62 ? 308 THR E CB 1 +ATOM 17333 O OG1 . THR D 1 288 ? 55.191 72.100 39.354 1.00 21.95 ? 308 THR E OG1 1 +ATOM 17334 C CG2 . THR D 1 288 ? 56.469 72.830 37.425 1.00 22.23 ? 308 THR E CG2 1 +ATOM 17335 N N . ALA D 1 289 ? 58.927 74.955 39.026 1.00 23.40 ? 309 ALA E N 1 +ATOM 17336 C CA . ALA D 1 289 ? 59.677 76.159 38.678 1.00 24.23 ? 309 ALA E CA 1 +ATOM 17337 C C . ALA D 1 289 ? 60.479 75.953 37.412 1.00 25.06 ? 309 ALA E C 1 +ATOM 17338 O O . ALA D 1 289 ? 60.863 74.829 37.086 1.00 25.57 ? 309 ALA E O 1 +ATOM 17339 C CB . ALA D 1 289 ? 60.600 76.551 39.817 1.00 24.21 ? 309 ALA E CB 1 +ATOM 17340 N N . GLN D 1 290 ? 60.732 77.043 36.699 1.00 26.03 ? 310 GLN E N 1 +ATOM 17341 C CA . GLN D 1 290 ? 61.560 77.002 35.500 1.00 27.04 ? 310 GLN E CA 1 +ATOM 17342 C C . GLN D 1 290 ? 62.908 77.639 35.829 1.00 27.29 ? 310 GLN E C 1 +ATOM 17343 O O . GLN D 1 290 ? 62.973 78.829 36.143 1.00 27.47 ? 310 GLN E O 1 +ATOM 17344 C CB . GLN D 1 290 ? 60.856 77.732 34.350 1.00 27.40 ? 310 GLN E CB 1 +ATOM 17345 C CG . GLN D 1 290 ? 59.849 76.876 33.527 1.00 28.84 ? 310 GLN E CG 1 +ATOM 17346 C CD . GLN D 1 290 ? 58.905 75.997 34.365 1.00 30.64 ? 310 GLN E CD 1 +ATOM 17347 O OE1 . GLN D 1 290 ? 59.276 74.902 34.795 1.00 32.59 ? 310 GLN E OE1 1 +ATOM 17348 N NE2 . GLN D 1 290 ? 57.671 76.458 34.560 1.00 30.51 ? 310 GLN E NE2 1 +ATOM 17349 N N . THR D 1 291 ? 63.979 76.842 35.777 1.00 27.84 ? 311 THR E N 1 +ATOM 17350 C CA . THR D 1 291 ? 65.332 77.316 36.128 1.00 27.99 ? 311 THR E CA 1 +ATOM 17351 C C . THR D 1 291 ? 66.271 77.332 34.922 1.00 28.35 ? 311 THR E C 1 +ATOM 17352 O O . THR D 1 291 ? 65.924 76.853 33.844 1.00 28.38 ? 311 THR E O 1 +ATOM 17353 C CB . THR D 1 291 ? 65.982 76.451 37.245 1.00 27.90 ? 311 THR E CB 1 +ATOM 17354 O OG1 . THR D 1 291 ? 66.531 75.247 36.691 1.00 28.02 ? 311 THR E OG1 1 +ATOM 17355 C CG2 . THR D 1 291 ? 64.969 76.099 38.327 1.00 28.09 ? 311 THR E CG2 1 +ATOM 17356 N N . SER D 1 292 ? 67.472 77.868 35.118 1.00 28.54 ? 312 SER E N 1 +ATOM 17357 C CA . SER D 1 292 ? 68.476 77.905 34.050 1.00 28.83 ? 312 SER E CA 1 +ATOM 17358 C C . SER D 1 292 ? 69.002 76.519 33.688 1.00 28.58 ? 312 SER E C 1 +ATOM 17359 O O . SER D 1 292 ? 69.572 76.339 32.610 1.00 28.68 ? 312 SER E O 1 +ATOM 17360 C CB . SER D 1 292 ? 69.645 78.817 34.426 1.00 28.89 ? 312 SER E CB 1 +ATOM 17361 O OG . SER D 1 292 ? 69.313 80.174 34.194 1.00 30.76 ? 312 SER E OG 1 +ATOM 17362 N N . LEU D 1 293 ? 68.823 75.552 34.588 1.00 28.22 ? 313 LEU E N 1 +ATOM 17363 C CA . LEU D 1 293 ? 69.183 74.162 34.329 1.00 28.09 ? 313 LEU E CA 1 +ATOM 17364 C C . LEU D 1 293 ? 67.946 73.295 34.089 1.00 27.68 ? 313 LEU E C 1 +ATOM 17365 O O . LEU D 1 293 ? 68.018 72.064 34.167 1.00 27.76 ? 313 LEU E O 1 +ATOM 17366 C CB . LEU D 1 293 ? 70.004 73.603 35.495 1.00 28.07 ? 313 LEU E CB 1 +ATOM 17367 C CG . LEU D 1 293 ? 71.315 74.337 35.796 1.00 28.46 ? 313 LEU E CG 1 +ATOM 17368 C CD1 . LEU D 1 293 ? 72.029 73.686 36.973 1.00 28.44 ? 313 LEU E CD1 1 +ATOM 17369 C CD2 . LEU D 1 293 ? 72.213 74.363 34.565 1.00 29.17 ? 313 LEU E CD2 1 +ATOM 17370 N N . GLY D 1 294 ? 66.818 73.940 33.792 1.00 27.21 ? 314 GLY E N 1 +ATOM 17371 C CA . GLY D 1 294 ? 65.581 73.242 33.462 1.00 26.84 ? 314 GLY E CA 1 +ATOM 17372 C C . GLY D 1 294 ? 64.512 73.367 34.533 1.00 26.42 ? 314 GLY E C 1 +ATOM 17373 O O . GLY D 1 294 ? 64.686 74.098 35.518 1.00 26.29 ? 314 GLY E O 1 +ATOM 17374 N N . PRO D 1 295 ? 63.390 72.652 34.345 1.00 25.86 ? 315 PRO E N 1 +ATOM 17375 C CA . PRO D 1 295 ? 62.314 72.693 35.319 1.00 25.36 ? 315 PRO E CA 1 +ATOM 17376 C C . PRO D 1 295 ? 62.678 71.866 36.540 1.00 24.60 ? 315 PRO E C 1 +ATOM 17377 O O . PRO D 1 295 ? 63.460 70.910 36.438 1.00 24.71 ? 315 PRO E O 1 +ATOM 17378 C CB . PRO D 1 295 ? 61.143 72.056 34.571 1.00 25.41 ? 315 PRO E CB 1 +ATOM 17379 C CG . PRO D 1 295 ? 61.782 71.088 33.658 1.00 25.88 ? 315 PRO E CG 1 +ATOM 17380 C CD . PRO D 1 295 ? 63.074 71.740 33.227 1.00 25.98 ? 315 PRO E CD 1 +ATOM 17381 N N . VAL D 1 296 ? 62.129 72.243 37.686 1.00 23.47 ? 316 VAL E N 1 +ATOM 17382 C CA . VAL D 1 296 ? 62.348 71.502 38.917 1.00 22.80 ? 316 VAL E CA 1 +ATOM 17383 C C . VAL D 1 296 ? 61.055 71.467 39.710 1.00 21.88 ? 316 VAL E C 1 +ATOM 17384 O O . VAL D 1 296 ? 60.181 72.304 39.511 1.00 22.06 ? 316 VAL E O 1 +ATOM 17385 C CB . VAL D 1 296 ? 63.463 72.142 39.765 1.00 22.81 ? 316 VAL E CB 1 +ATOM 17386 C CG1 . VAL D 1 296 ? 64.783 72.032 39.038 1.00 22.98 ? 316 VAL E CG1 1 +ATOM 17387 C CG2 . VAL D 1 296 ? 63.127 73.605 40.081 1.00 22.63 ? 316 VAL E CG2 1 +ATOM 17388 N N . SER D 1 297 ? 60.937 70.458 40.567 1.00 21.25 ? 317 SER E N 1 +ATOM 17389 C CA . SER D 1 297 ? 59.825 70.329 41.505 1.00 20.38 ? 317 SER E CA 1 +ATOM 17390 C C . SER D 1 297 ? 60.368 70.451 42.915 1.00 19.18 ? 317 SER E C 1 +ATOM 17391 O O . SER D 1 297 ? 61.460 69.939 43.212 1.00 18.91 ? 317 SER E O 1 +ATOM 17392 C CB . SER D 1 297 ? 59.137 68.968 41.360 1.00 20.58 ? 317 SER E CB 1 +ATOM 17393 O OG . SER D 1 297 ? 58.401 68.905 40.158 1.00 22.83 ? 317 SER E OG 1 +ATOM 17394 N N . ASP D 1 298 ? 59.610 71.126 43.777 1.00 17.18 ? 318 ASP E N 1 +ATOM 17395 C CA . ASP D 1 298 ? 59.925 71.191 45.193 1.00 16.66 ? 318 ASP E CA 1 +ATOM 17396 C C . ASP D 1 298 ? 58.675 70.873 46.017 1.00 16.40 ? 318 ASP E C 1 +ATOM 17397 O O . ASP D 1 298 ? 57.591 71.386 45.723 1.00 15.35 ? 318 ASP E O 1 +ATOM 17398 C CB . ASP D 1 298 ? 60.461 72.573 45.548 1.00 16.33 ? 318 ASP E CB 1 +ATOM 17399 C CG . ASP D 1 298 ? 61.136 72.615 46.903 1.00 15.68 ? 318 ASP E CG 1 +ATOM 17400 O OD1 . ASP D 1 298 ? 61.672 71.586 47.374 1.00 14.80 ? 318 ASP E OD1 1 +ATOM 17401 O OD2 . ASP D 1 298 ? 61.131 73.696 47.498 1.00 14.81 ? 318 ASP E OD2 1 +ATOM 17402 N N . PHE D 1 299 ? 58.836 70.014 47.026 1.00 15.81 ? 319 PHE E N 1 +ATOM 17403 C CA . PHE D 1 299 ? 57.747 69.648 47.932 1.00 16.16 ? 319 PHE E CA 1 +ATOM 17404 C C . PHE D 1 299 ? 58.112 69.994 49.372 1.00 15.66 ? 319 PHE E C 1 +ATOM 17405 O O . PHE D 1 299 ? 59.163 69.577 49.859 1.00 15.64 ? 319 PHE E O 1 +ATOM 17406 C CB . PHE D 1 299 ? 57.479 68.142 47.874 1.00 16.92 ? 319 PHE E CB 1 +ATOM 17407 C CG . PHE D 1 299 ? 56.775 67.689 46.628 1.00 18.45 ? 319 PHE E CG 1 +ATOM 17408 C CD1 . PHE D 1 299 ? 57.478 67.463 45.459 1.00 19.72 ? 319 PHE E CD1 1 +ATOM 17409 C CD2 . PHE D 1 299 ? 55.406 67.472 46.638 1.00 19.29 ? 319 PHE E CD2 1 +ATOM 17410 C CE1 . PHE D 1 299 ? 56.823 67.043 44.312 1.00 19.55 ? 319 PHE E CE1 1 +ATOM 17411 C CE2 . PHE D 1 299 ? 54.747 67.057 45.498 1.00 19.71 ? 319 PHE E CE2 1 +ATOM 17412 C CZ . PHE D 1 299 ? 55.457 66.832 44.337 1.00 19.24 ? 319 PHE E CZ 1 +ATOM 17413 N N . TYR D 1 300 ? 57.239 70.737 50.053 1.00 15.05 ? 320 TYR E N 1 +ATOM 17414 C CA . TYR D 1 300 ? 57.337 70.910 51.501 1.00 14.01 ? 320 TYR E CA 1 +ATOM 17415 C C . TYR D 1 300 ? 55.946 70.716 52.093 1.00 13.99 ? 320 TYR E C 1 +ATOM 17416 O O . TYR D 1 300 ? 54.959 71.222 51.543 1.00 13.53 ? 320 TYR E O 1 +ATOM 17417 C CB . TYR D 1 300 ? 57.890 72.295 51.875 1.00 13.88 ? 320 TYR E CB 1 +ATOM 17418 C CG . TYR D 1 300 ? 58.230 72.399 53.344 1.00 12.97 ? 320 TYR E CG 1 +ATOM 17419 C CD1 . TYR D 1 300 ? 57.259 72.740 54.278 1.00 11.96 ? 320 TYR E CD1 1 +ATOM 17420 C CD2 . TYR D 1 300 ? 59.517 72.123 53.809 1.00 11.65 ? 320 TYR E CD2 1 +ATOM 17421 C CE1 . TYR D 1 300 ? 57.554 72.813 55.624 1.00 12.92 ? 320 TYR E CE1 1 +ATOM 17422 C CE2 . TYR D 1 300 ? 59.819 72.196 55.164 1.00 12.42 ? 320 TYR E CE2 1 +ATOM 17423 C CZ . TYR D 1 300 ? 58.834 72.533 56.064 1.00 12.74 ? 320 TYR E CZ 1 +ATOM 17424 O OH . TYR D 1 300 ? 59.129 72.610 57.405 1.00 13.04 ? 320 TYR E OH 1 +ATOM 17425 N N . THR D 1 301 ? 55.871 69.968 53.194 1.00 13.38 ? 321 THR E N 1 +ATOM 17426 C CA . THR D 1 301 ? 54.600 69.714 53.870 1.00 12.96 ? 321 THR E CA 1 +ATOM 17427 C C . THR D 1 301 ? 54.646 70.243 55.294 1.00 13.35 ? 321 THR E C 1 +ATOM 17428 O O . THR D 1 301 ? 55.533 69.872 56.078 1.00 13.01 ? 321 THR E O 1 +ATOM 17429 C CB . THR D 1 301 ? 54.248 68.219 53.894 1.00 13.04 ? 321 THR E CB 1 +ATOM 17430 O OG1 . THR D 1 301 ? 54.135 67.736 52.551 1.00 12.72 ? 321 THR E OG1 1 +ATOM 17431 C CG2 . THR D 1 301 ? 52.936 67.988 54.626 1.00 12.20 ? 321 THR E CG2 1 +ATOM 17432 N N . LEU D 1 302 ? 53.684 71.105 55.615 1.00 13.31 ? 322 LEU E N 1 +ATOM 17433 C CA . LEU D 1 302 ? 53.605 71.757 56.919 1.00 12.93 ? 322 LEU E CA 1 +ATOM 17434 C C . LEU D 1 302 ? 52.378 71.289 57.702 1.00 12.60 ? 322 LEU E C 1 +ATOM 17435 O O . LEU D 1 302 ? 51.253 71.412 57.211 1.00 12.43 ? 322 LEU E O 1 +ATOM 17436 C CB . LEU D 1 302 ? 53.536 73.268 56.719 1.00 12.96 ? 322 LEU E CB 1 +ATOM 17437 C CG . LEU D 1 302 ? 53.506 74.137 57.967 1.00 13.40 ? 322 LEU E CG 1 +ATOM 17438 C CD1 . LEU D 1 302 ? 54.833 74.049 58.719 1.00 11.65 ? 322 LEU E CD1 1 +ATOM 17439 C CD2 . LEU D 1 302 ? 53.216 75.590 57.574 1.00 13.00 ? 322 LEU E CD2 1 +ATOM 17440 N N . PRO D 1 303 ? 52.576 70.749 58.925 1.00 12.08 ? 323 PRO E N 1 +ATOM 17441 C CA . PRO D 1 303 ? 51.410 70.430 59.740 1.00 12.02 ? 323 PRO E CA 1 +ATOM 17442 C C . PRO D 1 303 ? 50.592 71.670 60.066 1.00 11.34 ? 323 PRO E C 1 +ATOM 17443 O O . PRO D 1 303 ? 51.158 72.729 60.291 1.00 12.17 ? 323 PRO E O 1 +ATOM 17444 C CB . PRO D 1 303 ? 52.022 69.836 61.021 1.00 11.62 ? 323 PRO E CB 1 +ATOM 17445 C CG . PRO D 1 303 ? 53.349 69.360 60.612 1.00 12.33 ? 323 PRO E CG 1 +ATOM 17446 C CD . PRO D 1 303 ? 53.817 70.373 59.622 1.00 12.76 ? 323 PRO E CD 1 +ATOM 17447 N N . VAL D 1 304 ? 49.270 71.518 60.062 1.00 11.05 ? 324 VAL E N 1 +ATOM 17448 C CA . VAL D 1 304 ? 48.346 72.623 60.333 1.00 10.30 ? 324 VAL E CA 1 +ATOM 17449 C C . VAL D 1 304 ? 47.282 72.167 61.319 1.00 10.43 ? 324 VAL E C 1 +ATOM 17450 O O . VAL D 1 304 ? 46.634 71.142 61.107 1.00 10.91 ? 324 VAL E O 1 +ATOM 17451 C CB . VAL D 1 304 ? 47.620 73.095 59.042 1.00 10.06 ? 324 VAL E CB 1 +ATOM 17452 C CG1 . VAL D 1 304 ? 46.532 74.137 59.382 1.00 9.41 ? 324 VAL E CG1 1 +ATOM 17453 C CG2 . VAL D 1 304 ? 48.614 73.666 58.030 1.00 8.52 ? 324 VAL E CG2 1 +ATOM 17454 N N . GLY D 1 305 ? 47.120 72.932 62.387 1.00 10.57 ? 325 GLY E N 1 +ATOM 17455 C CA . GLY D 1 305 ? 46.047 72.731 63.350 1.00 10.73 ? 325 GLY E CA 1 +ATOM 17456 C C . GLY D 1 305 ? 45.123 73.926 63.276 1.00 11.07 ? 325 GLY E C 1 +ATOM 17457 O O . GLY D 1 305 ? 45.553 75.074 63.428 1.00 11.32 ? 325 GLY E O 1 +ATOM 17458 N N . ILE D 1 306 ? 43.850 73.664 62.990 1.00 11.34 ? 326 ILE E N 1 +ATOM 17459 C CA . ILE D 1 306 ? 42.889 74.738 62.773 1.00 11.73 ? 326 ILE E CA 1 +ATOM 17460 C C . ILE D 1 306 ? 42.302 75.136 64.125 1.00 11.63 ? 326 ILE E C 1 +ATOM 17461 O O . ILE D 1 306 ? 41.539 74.377 64.744 1.00 11.61 ? 326 ILE E O 1 +ATOM 17462 C CB . ILE D 1 306 ? 41.782 74.326 61.753 1.00 11.49 ? 326 ILE E CB 1 +ATOM 17463 C CG1 . ILE D 1 306 ? 42.417 74.078 60.379 1.00 11.84 ? 326 ILE E CG1 1 +ATOM 17464 C CG2 . ILE D 1 306 ? 40.737 75.428 61.640 1.00 12.71 ? 326 ILE E CG2 1 +ATOM 17465 C CD1 . ILE D 1 306 ? 41.506 73.418 59.339 1.00 12.34 ? 326 ILE E CD1 1 +ATOM 17466 N N . ARG D 1 307 ? 42.679 76.327 64.582 1.00 11.66 ? 327 ARG E N 1 +ATOM 17467 C CA . ARG D 1 307 ? 42.283 76.795 65.897 1.00 11.90 ? 327 ARG E CA 1 +ATOM 17468 C C . ARG D 1 307 ? 42.497 78.294 66.029 1.00 12.24 ? 327 ARG E C 1 +ATOM 17469 O O . ARG D 1 307 ? 43.334 78.886 65.345 1.00 12.00 ? 327 ARG E O 1 +ATOM 17470 C CB . ARG D 1 307 ? 43.050 76.038 66.993 1.00 12.13 ? 327 ARG E CB 1 +ATOM 17471 C CG . ARG D 1 307 ? 44.561 76.354 67.054 1.00 11.86 ? 327 ARG E CG 1 +ATOM 17472 C CD . ARG D 1 307 ? 44.847 77.499 68.034 1.00 11.49 ? 327 ARG E CD 1 +ATOM 17473 N NE . ARG D 1 307 ? 46.226 77.998 67.987 1.00 11.29 ? 327 ARG E NE 1 +ATOM 17474 C CZ . ARG D 1 307 ? 46.646 79.052 67.279 1.00 11.87 ? 327 ARG E CZ 1 +ATOM 17475 N NH1 . ARG D 1 307 ? 45.821 79.759 66.512 1.00 10.13 ? 327 ARG E NH1 1 +ATOM 17476 N NH2 . ARG D 1 307 ? 47.920 79.414 67.343 1.00 10.61 ? 327 ARG E NH2 1 +ATOM 17477 N N . THR D 1 308 ? 41.738 78.911 66.921 1.00 11.93 ? 328 THR E N 1 +ATOM 17478 C CA . THR D 1 308 ? 41.834 80.344 67.140 1.00 12.65 ? 328 THR E CA 1 +ATOM 17479 C C . THR D 1 308 ? 42.139 80.637 68.596 1.00 12.47 ? 328 THR E C 1 +ATOM 17480 O O . THR D 1 308 ? 41.843 79.832 69.474 1.00 12.50 ? 328 THR E O 1 +ATOM 17481 C CB . THR D 1 308 ? 40.521 81.028 66.780 1.00 13.29 ? 328 THR E CB 1 +ATOM 17482 O OG1 . THR D 1 308 ? 39.475 80.503 67.602 1.00 14.23 ? 328 THR E OG1 1 +ATOM 17483 C CG2 . THR D 1 308 ? 40.183 80.771 65.321 1.00 14.17 ? 328 THR E CG2 1 +ATOM 17484 N N . VAL D 1 309 ? 42.706 81.813 68.832 1.00 12.50 ? 329 VAL E N 1 +ATOM 17485 C CA . VAL D 1 309 ? 43.026 82.292 70.165 1.00 11.99 ? 329 VAL E CA 1 +ATOM 17486 C C . VAL D 1 309 ? 42.518 83.729 70.296 1.00 12.51 ? 329 VAL E C 1 +ATOM 17487 O O . VAL D 1 309 ? 42.765 84.559 69.418 1.00 12.23 ? 329 VAL E O 1 +ATOM 17488 C CB . VAL D 1 309 ? 44.538 82.313 70.405 1.00 12.25 ? 329 VAL E CB 1 +ATOM 17489 C CG1 . VAL D 1 309 ? 44.837 82.931 71.761 1.00 11.81 ? 329 VAL E CG1 1 +ATOM 17490 C CG2 . VAL D 1 309 ? 45.126 80.906 70.292 1.00 12.64 ? 329 VAL E CG2 1 +ATOM 17491 N N . ALA D 1 310 ? 41.816 84.024 71.379 1.00 12.86 ? 330 ALA E N 1 +ATOM 17492 C CA . ALA D 1 310 ? 41.407 85.399 71.651 1.00 13.33 ? 330 ALA E CA 1 +ATOM 17493 C C . ALA D 1 310 ? 41.367 85.629 73.153 1.00 13.78 ? 330 ALA E C 1 +ATOM 17494 O O . ALA D 1 310 ? 41.299 84.666 73.932 1.00 13.80 ? 330 ALA E O 1 +ATOM 17495 C CB . ALA D 1 310 ? 40.052 85.694 71.023 1.00 13.94 ? 330 ALA E CB 1 +ATOM 17496 N N . VAL D 1 311 ? 41.457 86.899 73.542 1.00 13.93 ? 331 VAL E N 1 +ATOM 17497 C CA A VAL D 1 311 ? 41.455 87.299 74.943 0.50 14.06 ? 331 VAL E CA 1 +ATOM 17498 C CA B VAL D 1 311 ? 41.436 87.289 74.946 0.50 14.18 ? 331 VAL E CA 1 +ATOM 17499 C C . VAL D 1 311 ? 40.395 88.380 75.191 1.00 14.53 ? 331 VAL E C 1 +ATOM 17500 O O . VAL D 1 311 ? 40.250 89.317 74.389 1.00 14.02 ? 331 VAL E O 1 +ATOM 17501 C CB A VAL D 1 311 ? 42.859 87.816 75.345 0.50 14.24 ? 331 VAL E CB 1 +ATOM 17502 C CB B VAL D 1 311 ? 42.815 87.809 75.405 0.50 14.36 ? 331 VAL E CB 1 +ATOM 17503 C CG1 A VAL D 1 311 ? 42.838 88.526 76.695 0.50 14.50 ? 331 VAL E CG1 1 +ATOM 17504 C CG1 B VAL D 1 311 ? 43.109 89.165 74.790 0.50 13.96 ? 331 VAL E CG1 1 +ATOM 17505 C CG2 A VAL D 1 311 ? 43.857 86.656 75.352 0.50 13.24 ? 331 VAL E CG2 1 +ATOM 17506 C CG2 B VAL D 1 311 ? 42.878 87.887 76.914 0.50 14.94 ? 331 VAL E CG2 1 +ATOM 17507 N N . THR D 1 312 ? 39.660 88.252 76.296 1.00 14.49 ? 332 THR E N 1 +ATOM 17508 C CA . THR D 1 312 ? 38.698 89.288 76.709 1.00 14.88 ? 332 THR E CA 1 +ATOM 17509 C C . THR D 1 312 ? 39.214 89.967 77.976 1.00 15.02 ? 332 THR E C 1 +ATOM 17510 O O . THR D 1 312 ? 40.377 89.807 78.320 1.00 15.06 ? 332 THR E O 1 +ATOM 17511 C CB . THR D 1 312 ? 37.291 88.692 76.938 1.00 14.36 ? 332 THR E CB 1 +ATOM 17512 O OG1 . THR D 1 312 ? 37.289 87.876 78.112 1.00 15.72 ? 332 THR E OG1 1 +ATOM 17513 C CG2 . THR D 1 312 ? 36.854 87.873 75.736 1.00 15.17 ? 332 THR E CG2 1 +ATOM 17514 N N . LYS D 1 313 ? 38.366 90.716 78.680 1.00 15.44 ? 333 LYS E N 1 +ATOM 17515 C CA . LYS D 1 313 ? 38.794 91.334 79.942 1.00 15.94 ? 333 LYS E CA 1 +ATOM 17516 C C . LYS D 1 313 ? 38.915 90.309 81.082 1.00 14.97 ? 333 LYS E C 1 +ATOM 17517 O O . LYS D 1 313 ? 39.542 90.604 82.116 1.00 14.18 ? 333 LYS E O 1 +ATOM 17518 C CB . LYS D 1 313 ? 37.843 92.467 80.353 1.00 16.14 ? 333 LYS E CB 1 +ATOM 17519 C CG . LYS D 1 313 ? 37.883 93.714 79.459 1.00 17.27 ? 333 LYS E CG 1 +ATOM 17520 C CD . LYS D 1 313 ? 37.217 94.909 80.163 1.00 18.16 ? 333 LYS E CD 1 +ATOM 17521 C CE . LYS D 1 313 ? 36.872 96.045 79.205 1.00 19.50 ? 333 LYS E CE 1 +ATOM 17522 N NZ . LYS D 1 313 ? 36.654 97.322 79.952 1.00 20.83 ? 333 LYS E NZ 1 +ATOM 17523 N N . SER D 1 314 ? 38.311 89.128 80.893 1.00 14.32 ? 334 SER E N 1 +ATOM 17524 C CA . SER D 1 314 ? 38.287 88.081 81.925 1.00 14.03 ? 334 SER E CA 1 +ATOM 17525 C C . SER D 1 314 ? 38.581 86.649 81.458 1.00 13.58 ? 334 SER E C 1 +ATOM 17526 O O . SER D 1 314 ? 38.687 85.764 82.299 1.00 13.47 ? 334 SER E O 1 +ATOM 17527 C CB . SER D 1 314 ? 36.927 88.088 82.628 1.00 14.10 ? 334 SER E CB 1 +ATOM 17528 O OG . SER D 1 314 ? 35.912 87.571 81.777 1.00 13.89 ? 334 SER E OG 1 +ATOM 17529 N N . GLN D 1 315 ? 38.717 86.423 80.149 1.00 13.16 ? 335 GLN E N 1 +ATOM 17530 C CA . GLN D 1 315 ? 38.811 85.070 79.605 1.00 13.07 ? 335 GLN E CA 1 +ATOM 17531 C C . GLN D 1 315 ? 39.916 84.917 78.558 1.00 11.72 ? 335 GLN E C 1 +ATOM 17532 O O . GLN D 1 315 ? 40.204 85.837 77.806 1.00 10.72 ? 335 GLN E O 1 +ATOM 17533 C CB . GLN D 1 315 ? 37.475 84.639 78.972 1.00 13.26 ? 335 GLN E CB 1 +ATOM 17534 C CG . GLN D 1 315 ? 36.287 84.618 79.938 1.00 14.12 ? 335 GLN E CG 1 +ATOM 17535 C CD . GLN D 1 315 ? 35.032 83.986 79.337 1.00 15.87 ? 335 GLN E CD 1 +ATOM 17536 O OE1 . GLN D 1 315 ? 34.572 84.384 78.259 1.00 19.98 ? 335 GLN E OE1 1 +ATOM 17537 N NE2 . GLN D 1 315 ? 34.469 82.999 80.043 1.00 17.00 ? 335 GLN E NE2 1 +ATOM 17538 N N . PHE D 1 316 ? 40.500 83.721 78.510 1.00 11.24 ? 336 PHE E N 1 +ATOM 17539 C CA . PHE D 1 316 ? 41.379 83.305 77.426 1.00 11.20 ? 336 PHE E CA 1 +ATOM 17540 C C . PHE D 1 316 ? 40.601 82.272 76.618 1.00 11.75 ? 336 PHE E C 1 +ATOM 17541 O O . PHE D 1 316 ? 40.261 81.197 77.142 1.00 12.29 ? 336 PHE E O 1 +ATOM 17542 C CB . PHE D 1 316 ? 42.640 82.657 78.005 1.00 10.80 ? 336 PHE E CB 1 +ATOM 17543 C CG . PHE D 1 316 ? 43.774 82.544 77.032 1.00 9.89 ? 336 PHE E CG 1 +ATOM 17544 C CD1 . PHE D 1 316 ? 43.824 81.491 76.115 1.00 10.80 ? 336 PHE E CD1 1 +ATOM 17545 C CD2 . PHE D 1 316 ? 44.805 83.482 77.040 1.00 11.52 ? 336 PHE E CD2 1 +ATOM 17546 C CE1 . PHE D 1 316 ? 44.881 81.378 75.223 1.00 11.17 ? 336 PHE E CE1 1 +ATOM 17547 C CE2 . PHE D 1 316 ? 45.875 83.374 76.154 1.00 10.33 ? 336 PHE E CE2 1 +ATOM 17548 C CZ . PHE D 1 316 ? 45.911 82.333 75.243 1.00 10.69 ? 336 PHE E CZ 1 +ATOM 17549 N N . LEU D 1 317 ? 40.322 82.590 75.354 1.00 11.52 ? 337 LEU E N 1 +ATOM 17550 C CA . LEU D 1 317 ? 39.431 81.769 74.532 1.00 11.86 ? 337 LEU E CA 1 +ATOM 17551 C C . LEU D 1 317 ? 40.215 81.012 73.475 1.00 11.70 ? 337 LEU E C 1 +ATOM 17552 O O . LEU D 1 317 ? 40.934 81.634 72.694 1.00 12.43 ? 337 LEU E O 1 +ATOM 17553 C CB . LEU D 1 317 ? 38.403 82.656 73.827 1.00 12.13 ? 337 LEU E CB 1 +ATOM 17554 C CG . LEU D 1 317 ? 37.523 83.537 74.720 1.00 12.35 ? 337 LEU E CG 1 +ATOM 17555 C CD1 . LEU D 1 317 ? 36.574 84.361 73.848 1.00 13.21 ? 337 LEU E CD1 1 +ATOM 17556 C CD2 . LEU D 1 317 ? 36.762 82.656 75.697 1.00 11.96 ? 337 LEU E CD2 1 +ATOM 17557 N N . ILE D 1 318 ? 40.096 79.689 73.465 1.00 10.89 ? 338 ILE E N 1 +ATOM 17558 C CA . ILE D 1 318 ? 40.593 78.874 72.344 1.00 10.92 ? 338 ILE E CA 1 +ATOM 17559 C C . ILE D 1 318 ? 39.381 78.277 71.627 1.00 11.24 ? 338 ILE E C 1 +ATOM 17560 O O . ILE D 1 318 ? 38.497 77.691 72.257 1.00 10.90 ? 338 ILE E O 1 +ATOM 17561 C CB . ILE D 1 318 ? 41.545 77.741 72.781 1.00 10.67 ? 338 ILE E CB 1 +ATOM 17562 C CG1 . ILE D 1 318 ? 42.762 78.321 73.500 1.00 10.25 ? 338 ILE E CG1 1 +ATOM 17563 C CG2 . ILE D 1 318 ? 42.037 76.955 71.564 1.00 10.90 ? 338 ILE E CG2 1 +ATOM 17564 C CD1 . ILE D 1 318 ? 43.812 77.275 73.895 1.00 10.82 ? 338 ILE E CD1 1 +ATOM 17565 N N . ASN D 1 319 ? 39.344 78.455 70.313 1.00 11.82 ? 339 ASN E N 1 +ATOM 17566 C CA . ASN D 1 319 ? 38.201 78.042 69.497 1.00 12.07 ? 339 ASN E CA 1 +ATOM 17567 C C . ASN D 1 319 ? 36.884 78.624 70.035 1.00 12.27 ? 339 ASN E C 1 +ATOM 17568 O O . ASN D 1 319 ? 35.826 77.994 69.949 1.00 11.89 ? 339 ASN E O 1 +ATOM 17569 C CB . ASN D 1 319 ? 38.169 76.521 69.381 1.00 12.27 ? 339 ASN E CB 1 +ATOM 17570 C CG . ASN D 1 319 ? 39.428 75.962 68.728 1.00 12.55 ? 339 ASN E CG 1 +ATOM 17571 O OD1 . ASN D 1 319 ? 40.052 76.628 67.901 1.00 12.94 ? 339 ASN E OD1 1 +ATOM 17572 N ND2 . ASN D 1 319 ? 39.809 74.737 69.100 1.00 13.61 ? 339 ASN E ND2 1 +ATOM 17573 N N . GLY D 1 320 ? 36.968 79.840 70.572 1.00 12.61 ? 340 GLY E N 1 +ATOM 17574 C CA . GLY D 1 320 ? 35.804 80.551 71.100 1.00 13.39 ? 340 GLY E CA 1 +ATOM 17575 C C . GLY D 1 320 ? 35.312 80.090 72.459 1.00 13.94 ? 340 GLY E C 1 +ATOM 17576 O O . GLY D 1 320 ? 34.310 80.612 72.961 1.00 14.09 ? 340 GLY E O 1 +ATOM 17577 N N . LYS D 1 321 ? 36.022 79.133 73.065 1.00 14.21 ? 341 LYS E N 1 +ATOM 17578 C CA . LYS D 1 321 ? 35.650 78.543 74.341 1.00 14.99 ? 341 LYS E CA 1 +ATOM 17579 C C . LYS D 1 321 ? 36.640 78.934 75.434 1.00 14.24 ? 341 LYS E C 1 +ATOM 17580 O O . LYS D 1 321 ? 37.854 78.942 75.189 1.00 13.61 ? 341 LYS E O 1 +ATOM 17581 C CB . LYS D 1 321 ? 35.627 77.022 74.228 1.00 15.34 ? 341 LYS E CB 1 +ATOM 17582 C CG . LYS D 1 321 ? 34.524 76.462 73.335 1.00 17.11 ? 341 LYS E CG 1 +ATOM 17583 C CD . LYS D 1 321 ? 34.477 74.927 73.371 1.00 18.31 ? 341 LYS E CD 1 +ATOM 17584 C CE . LYS D 1 321 ? 33.953 74.343 74.689 1.00 21.00 ? 341 LYS E CE 1 +ATOM 17585 N NZ . LYS D 1 321 ? 32.468 74.460 74.867 1.00 23.30 ? 341 LYS E NZ 1 +ATOM 17586 N N . PRO D 1 322 ? 36.139 79.251 76.645 1.00 13.28 ? 342 PRO E N 1 +ATOM 17587 C CA . PRO D 1 322 ? 37.039 79.571 77.755 1.00 12.91 ? 342 PRO E CA 1 +ATOM 17588 C C . PRO D 1 322 ? 38.043 78.451 78.032 1.00 12.37 ? 342 PRO E C 1 +ATOM 17589 O O . PRO D 1 322 ? 37.659 77.279 78.122 1.00 11.77 ? 342 PRO E O 1 +ATOM 17590 C CB . PRO D 1 322 ? 36.101 79.739 78.954 1.00 13.16 ? 342 PRO E CB 1 +ATOM 17591 C CG . PRO D 1 322 ? 34.758 79.896 78.398 1.00 13.56 ? 342 PRO E CG 1 +ATOM 17592 C CD . PRO D 1 322 ? 34.722 79.353 77.030 1.00 13.98 ? 342 PRO E CD 1 +ATOM 17593 N N . PHE D 1 323 ? 39.315 78.840 78.141 1.00 11.10 ? 343 PHE E N 1 +ATOM 17594 C CA . PHE D 1 323 ? 40.437 77.942 78.377 1.00 11.11 ? 343 PHE E CA 1 +ATOM 17595 C C . PHE D 1 323 ? 41.087 78.276 79.727 1.00 10.23 ? 343 PHE E C 1 +ATOM 17596 O O . PHE D 1 323 ? 41.093 79.421 80.141 1.00 10.55 ? 343 PHE E O 1 +ATOM 17597 C CB . PHE D 1 323 ? 41.467 78.118 77.262 1.00 10.81 ? 343 PHE E CB 1 +ATOM 17598 C CG . PHE D 1 323 ? 42.657 77.223 77.396 1.00 10.44 ? 343 PHE E CG 1 +ATOM 17599 C CD1 . PHE D 1 323 ? 42.528 75.847 77.229 1.00 9.24 ? 343 PHE E CD1 1 +ATOM 17600 C CD2 . PHE D 1 323 ? 43.906 77.746 77.682 1.00 10.98 ? 343 PHE E CD2 1 +ATOM 17601 C CE1 . PHE D 1 323 ? 43.614 75.014 77.343 1.00 10.20 ? 343 PHE E CE1 1 +ATOM 17602 C CE2 . PHE D 1 323 ? 45.002 76.919 77.799 1.00 9.45 ? 343 PHE E CE2 1 +ATOM 17603 C CZ . PHE D 1 323 ? 44.860 75.548 77.631 1.00 9.42 ? 343 PHE E CZ 1 +ATOM 17604 N N . TYR D 1 324 ? 41.610 77.266 80.411 1.00 9.97 ? 344 TYR E N 1 +ATOM 17605 C CA . TYR D 1 324 ? 42.364 77.498 81.637 1.00 9.68 ? 344 TYR E CA 1 +ATOM 17606 C C . TYR D 1 324 ? 43.698 76.766 81.512 1.00 9.61 ? 344 TYR E C 1 +ATOM 17607 O O . TYR D 1 324 ? 43.716 75.561 81.260 1.00 10.08 ? 344 TYR E O 1 +ATOM 17608 C CB . TYR D 1 324 ? 41.595 76.996 82.857 1.00 9.62 ? 344 TYR E CB 1 +ATOM 17609 C CG . TYR D 1 324 ? 42.224 77.361 84.168 1.00 9.52 ? 344 TYR E CG 1 +ATOM 17610 C CD1 . TYR D 1 324 ? 42.969 76.422 84.894 1.00 9.65 ? 344 TYR E CD1 1 +ATOM 17611 C CD2 . TYR D 1 324 ? 42.106 78.645 84.677 1.00 9.73 ? 344 TYR E CD2 1 +ATOM 17612 C CE1 . TYR D 1 324 ? 43.560 76.768 86.090 1.00 8.92 ? 344 TYR E CE1 1 +ATOM 17613 C CE2 . TYR D 1 324 ? 42.682 78.987 85.878 1.00 9.64 ? 344 TYR E CE2 1 +ATOM 17614 C CZ . TYR D 1 324 ? 43.414 78.050 86.576 1.00 9.73 ? 344 TYR E CZ 1 +ATOM 17615 O OH . TYR D 1 324 ? 43.981 78.411 87.769 1.00 10.93 ? 344 TYR E OH 1 +ATOM 17616 N N . PHE D 1 325 ? 44.796 77.508 81.633 1.00 9.52 ? 345 PHE E N 1 +ATOM 17617 C CA . PHE D 1 325 ? 46.120 76.910 81.638 1.00 9.18 ? 345 PHE E CA 1 +ATOM 17618 C C . PHE D 1 325 ? 46.273 76.193 82.963 1.00 8.98 ? 345 PHE E C 1 +ATOM 17619 O O . PHE D 1 325 ? 46.186 76.833 83.995 1.00 9.32 ? 345 PHE E O 1 +ATOM 17620 C CB . PHE D 1 325 ? 47.223 77.979 81.571 1.00 8.68 ? 345 PHE E CB 1 +ATOM 17621 C CG . PHE D 1 325 ? 47.302 78.726 80.265 1.00 8.31 ? 345 PHE E CG 1 +ATOM 17622 C CD1 . PHE D 1 325 ? 48.293 78.422 79.340 1.00 8.65 ? 345 PHE E CD1 1 +ATOM 17623 C CD2 . PHE D 1 325 ? 46.432 79.770 79.982 1.00 9.22 ? 345 PHE E CD2 1 +ATOM 17624 C CE1 . PHE D 1 325 ? 48.383 79.108 78.146 1.00 9.18 ? 345 PHE E CE1 1 +ATOM 17625 C CE2 . PHE D 1 325 ? 46.519 80.466 78.794 1.00 7.40 ? 345 PHE E CE2 1 +ATOM 17626 C CZ . PHE D 1 325 ? 47.503 80.144 77.877 1.00 8.39 ? 345 PHE E CZ 1 +ATOM 17627 N N . HIS D 1 326 ? 46.490 74.872 82.945 1.00 8.95 ? 346 HIS E N 1 +ATOM 17628 C CA . HIS D 1 326 ? 46.926 74.156 84.151 1.00 8.61 ? 346 HIS E CA 1 +ATOM 17629 C C . HIS D 1 326 ? 48.180 73.386 83.804 1.00 8.34 ? 346 HIS E C 1 +ATOM 17630 O O . HIS D 1 326 ? 48.133 72.258 83.294 1.00 7.70 ? 346 HIS E O 1 +ATOM 17631 C CB . HIS D 1 326 ? 45.833 73.278 84.803 1.00 9.12 ? 346 HIS E CB 1 +ATOM 17632 C CG . HIS D 1 326 ? 45.036 72.421 83.864 1.00 8.36 ? 346 HIS E CG 1 +ATOM 17633 N ND1 . HIS D 1 326 ? 45.468 71.184 83.435 1.00 9.69 ? 346 HIS E ND1 1 +ATOM 17634 C CD2 . HIS D 1 326 ? 43.780 72.569 83.375 1.00 9.09 ? 346 HIS E CD2 1 +ATOM 17635 C CE1 . HIS D 1 326 ? 44.533 70.630 82.679 1.00 10.63 ? 346 HIS E CE1 1 +ATOM 17636 N NE2 . HIS D 1 326 ? 43.496 71.448 82.627 1.00 10.34 ? 346 HIS E NE2 1 +ATOM 17637 N N . GLY D 1 327 ? 49.309 74.043 84.050 1.00 7.98 ? 347 GLY E N 1 +ATOM 17638 C CA . GLY D 1 327 ? 50.537 73.655 83.413 1.00 7.98 ? 347 GLY E CA 1 +ATOM 17639 C C . GLY D 1 327 ? 51.770 73.848 84.250 1.00 7.72 ? 347 GLY E C 1 +ATOM 17640 O O . GLY D 1 327 ? 51.718 73.932 85.479 1.00 8.46 ? 347 GLY E O 1 +ATOM 17641 N N . VAL D 1 328 ? 52.890 73.911 83.559 1.00 7.56 ? 348 VAL E N 1 +ATOM 17642 C CA . VAL D 1 328 ? 54.176 74.000 84.232 1.00 6.94 ? 348 VAL E CA 1 +ATOM 17643 C C . VAL D 1 328 ? 55.087 74.965 83.495 1.00 7.32 ? 348 VAL E C 1 +ATOM 17644 O O . VAL D 1 328 ? 54.837 75.310 82.325 1.00 6.88 ? 348 VAL E O 1 +ATOM 17645 C CB . VAL D 1 328 ? 54.882 72.618 84.289 1.00 6.61 ? 348 VAL E CB 1 +ATOM 17646 C CG1 . VAL D 1 328 ? 54.008 71.566 84.973 1.00 6.90 ? 348 VAL E CG1 1 +ATOM 17647 C CG2 . VAL D 1 328 ? 55.267 72.154 82.894 1.00 7.40 ? 348 VAL E CG2 1 +ATOM 17648 N N . ASN D 1 329 ? 56.147 75.373 84.190 1.00 7.38 ? 349 ASN E N 1 +ATOM 17649 C CA . ASN D 1 329 ? 57.352 75.912 83.554 1.00 7.23 ? 349 ASN E CA 1 +ATOM 17650 C C . ASN D 1 329 ? 58.375 74.791 83.386 1.00 7.19 ? 349 ASN E C 1 +ATOM 17651 O O . ASN D 1 329 ? 58.385 73.851 84.166 1.00 7.08 ? 349 ASN E O 1 +ATOM 17652 C CB . ASN D 1 329 ? 57.942 77.024 84.401 1.00 7.74 ? 349 ASN E CB 1 +ATOM 17653 C CG . ASN D 1 329 ? 57.000 78.189 84.540 1.00 8.27 ? 349 ASN E CG 1 +ATOM 17654 O OD1 . ASN D 1 329 ? 56.977 79.088 83.700 1.00 8.47 ? 349 ASN E OD1 1 +ATOM 17655 N ND2 . ASN D 1 329 ? 56.217 78.185 85.606 1.00 8.70 ? 349 ASN E ND2 1 +ATOM 17656 N N . LYS D 1 330 ? 59.238 74.897 82.376 1.00 7.13 ? 350 LYS E N 1 +ATOM 17657 C CA . LYS D 1 330 ? 60.265 73.872 82.147 1.00 7.82 ? 350 LYS E CA 1 +ATOM 17658 C C . LYS D 1 330 ? 61.628 74.565 81.961 1.00 7.64 ? 350 LYS E C 1 +ATOM 17659 O O . LYS D 1 330 ? 61.764 75.763 82.213 1.00 8.48 ? 350 LYS E O 1 +ATOM 17660 C CB . LYS D 1 330 ? 59.901 73.011 80.930 1.00 7.85 ? 350 LYS E CB 1 +ATOM 17661 C CG . LYS D 1 330 ? 58.621 72.183 81.057 1.00 8.74 ? 350 LYS E CG 1 +ATOM 17662 C CD . LYS D 1 330 ? 58.444 71.179 79.900 1.00 9.19 ? 350 LYS E CD 1 +ATOM 17663 C CE . LYS D 1 330 ? 58.991 69.774 80.203 1.00 11.77 ? 350 LYS E CE 1 +ATOM 17664 N NZ . LYS D 1 330 ? 60.483 69.637 80.089 1.00 11.70 ? 350 LYS E NZ 1 +ATOM 17665 N N . HIS D 1 331 ? 62.624 73.782 81.572 1.00 8.09 ? 351 HIS E N 1 +ATOM 17666 C CA . HIS D 1 331 ? 63.915 74.261 81.113 1.00 7.64 ? 351 HIS E CA 1 +ATOM 17667 C C . HIS D 1 331 ? 64.478 73.172 80.227 1.00 7.79 ? 351 HIS E C 1 +ATOM 17668 O O . HIS D 1 331 ? 64.110 72.006 80.360 1.00 9.22 ? 351 HIS E O 1 +ATOM 17669 C CB . HIS D 1 331 ? 64.896 74.519 82.280 1.00 7.12 ? 351 HIS E CB 1 +ATOM 17670 C CG . HIS D 1 331 ? 64.977 75.952 82.712 1.00 8.18 ? 351 HIS E CG 1 +ATOM 17671 N ND1 . HIS D 1 331 ? 65.442 76.958 81.885 1.00 7.37 ? 351 HIS E ND1 1 +ATOM 17672 C CD2 . HIS D 1 331 ? 64.692 76.542 83.893 1.00 6.92 ? 351 HIS E CD2 1 +ATOM 17673 C CE1 . HIS D 1 331 ? 65.404 78.108 82.533 1.00 8.38 ? 351 HIS E CE1 1 +ATOM 17674 N NE2 . HIS D 1 331 ? 64.961 77.885 83.757 1.00 7.36 ? 351 HIS E NE2 1 +ATOM 17675 N N . GLU D 1 332 ? 65.367 73.544 79.324 1.00 7.71 ? 352 GLU E N 1 +ATOM 17676 C CA . GLU D 1 332 ? 66.134 72.549 78.597 1.00 7.42 ? 352 GLU E CA 1 +ATOM 17677 C C . GLU D 1 332 ? 67.340 72.211 79.438 1.00 7.20 ? 352 GLU E C 1 +ATOM 17678 O O . GLU D 1 332 ? 68.332 72.911 79.426 1.00 6.11 ? 352 GLU E O 1 +ATOM 17679 C CB . GLU D 1 332 ? 66.531 73.049 77.219 1.00 7.51 ? 352 GLU E CB 1 +ATOM 17680 C CG . GLU D 1 332 ? 65.345 73.076 76.297 1.00 8.68 ? 352 GLU E CG 1 +ATOM 17681 C CD . GLU D 1 332 ? 65.709 73.493 74.920 1.00 9.99 ? 352 GLU E CD 1 +ATOM 17682 O OE1 . GLU D 1 332 ? 66.463 74.481 74.798 1.00 10.38 ? 352 GLU E OE1 1 +ATOM 17683 O OE2 . GLU D 1 332 ? 65.226 72.848 73.962 1.00 12.62 ? 352 GLU E OE2 1 +ATOM 17684 N N . ASP D 1 333 ? 67.219 71.143 80.218 1.00 6.94 ? 353 ASP E N 1 +ATOM 17685 C CA . ASP D 1 333 ? 68.191 70.869 81.264 1.00 7.29 ? 353 ASP E CA 1 +ATOM 17686 C C . ASP D 1 333 ? 68.130 69.401 81.674 1.00 6.84 ? 353 ASP E C 1 +ATOM 17687 O O . ASP D 1 333 ? 67.048 68.891 81.931 1.00 7.68 ? 353 ASP E O 1 +ATOM 17688 C CB . ASP D 1 333 ? 67.929 71.735 82.488 1.00 7.25 ? 353 ASP E CB 1 +ATOM 17689 C CG . ASP D 1 333 ? 68.751 71.298 83.689 1.00 8.79 ? 353 ASP E CG 1 +ATOM 17690 O OD1 . ASP D 1 333 ? 68.313 70.332 84.370 1.00 7.11 ? 353 ASP E OD1 1 +ATOM 17691 O OD2 . ASP D 1 333 ? 69.827 71.910 83.935 1.00 6.45 ? 353 ASP E OD2 1 +ATOM 17692 N N . ALA D 1 334 ? 69.283 68.739 81.704 1.00 7.10 ? 354 ALA E N 1 +ATOM 17693 C CA . ALA D 1 334 ? 69.369 67.323 82.087 1.00 7.01 ? 354 ALA E CA 1 +ATOM 17694 C C . ALA D 1 334 ? 70.790 67.030 82.514 1.00 6.91 ? 354 ALA E C 1 +ATOM 17695 O O . ALA D 1 334 ? 71.713 67.812 82.219 1.00 6.63 ? 354 ALA E O 1 +ATOM 17696 C CB . ALA D 1 334 ? 68.951 66.418 80.935 1.00 6.97 ? 354 ALA E CB 1 +ATOM 17697 N N . ASP D 1 335 ? 70.959 65.924 83.240 1.00 6.87 ? 355 ASP E N 1 +ATOM 17698 C CA . ASP D 1 335 ? 72.281 65.491 83.702 1.00 6.70 ? 355 ASP E CA 1 +ATOM 17699 C C . ASP D 1 335 ? 73.224 65.281 82.523 1.00 6.63 ? 355 ASP E C 1 +ATOM 17700 O O . ASP D 1 335 ? 72.843 64.739 81.496 1.00 7.76 ? 355 ASP E O 1 +ATOM 17701 C CB . ASP D 1 335 ? 72.204 64.169 84.497 1.00 6.38 ? 355 ASP E CB 1 +ATOM 17702 C CG . ASP D 1 335 ? 71.571 64.318 85.864 1.00 7.09 ? 355 ASP E CG 1 +ATOM 17703 O OD1 . ASP D 1 335 ? 71.714 65.392 86.489 1.00 8.26 ? 355 ASP E OD1 1 +ATOM 17704 O OD2 . ASP D 1 335 ? 70.930 63.348 86.338 1.00 6.53 ? 355 ASP E OD2 1 +ATOM 17705 N N . ILE D 1 336 ? 74.456 65.738 82.703 1.00 6.35 ? 356 ILE E N 1 +ATOM 17706 C CA . ILE D 1 336 ? 75.565 65.512 81.802 1.00 6.66 ? 356 ILE E CA 1 +ATOM 17707 C C . ILE D 1 336 ? 75.525 66.315 80.502 1.00 5.98 ? 356 ILE E C 1 +ATOM 17708 O O . ILE D 1 336 ? 76.518 66.898 80.137 1.00 5.22 ? 356 ILE E O 1 +ATOM 17709 C CB . ILE D 1 336 ? 75.769 64.008 81.465 1.00 6.79 ? 356 ILE E CB 1 +ATOM 17710 C CG1 . ILE D 1 336 ? 75.894 63.174 82.744 1.00 7.84 ? 356 ILE E CG1 1 +ATOM 17711 C CG2 . ILE D 1 336 ? 76.998 63.820 80.618 1.00 8.05 ? 356 ILE E CG2 1 +ATOM 17712 C CD1 . ILE D 1 336 ? 76.995 63.599 83.685 1.00 10.06 ? 356 ILE E CD1 1 +ATOM 17713 N N . ARG D 1 337 ? 74.414 66.266 79.772 1.00 5.91 ? 357 ARG E N 1 +ATOM 17714 C CA . ARG D 1 337 ? 74.302 66.937 78.467 1.00 5.71 ? 357 ARG E CA 1 +ATOM 17715 C C . ARG D 1 337 ? 73.915 68.404 78.575 1.00 6.41 ? 357 ARG E C 1 +ATOM 17716 O O . ARG D 1 337 ? 73.864 69.123 77.563 1.00 6.55 ? 357 ARG E O 1 +ATOM 17717 C CB . ARG D 1 337 ? 73.261 66.235 77.613 1.00 5.55 ? 357 ARG E CB 1 +ATOM 17718 C CG . ARG D 1 337 ? 71.839 66.497 78.086 1.00 5.43 ? 357 ARG E CG 1 +ATOM 17719 C CD . ARG D 1 337 ? 70.856 65.503 77.511 1.00 5.77 ? 357 ARG E CD 1 +ATOM 17720 N NE . ARG D 1 337 ? 71.139 64.167 78.016 1.00 8.09 ? 357 ARG E NE 1 +ATOM 17721 C CZ . ARG D 1 337 ? 71.703 63.184 77.318 1.00 7.71 ? 357 ARG E CZ 1 +ATOM 17722 N NH1 . ARG D 1 337 ? 71.999 63.334 76.034 1.00 8.71 ? 357 ARG E NH1 1 +ATOM 17723 N NH2 . ARG D 1 337 ? 71.962 62.027 77.914 1.00 7.49 ? 357 ARG E NH2 1 +ATOM 17724 N N . GLY D 1 338 ? 73.609 68.841 79.794 1.00 6.25 ? 358 GLY E N 1 +ATOM 17725 C CA . GLY D 1 338 ? 73.168 70.212 80.036 1.00 6.50 ? 358 GLY E CA 1 +ATOM 17726 C C . GLY D 1 338 ? 71.906 70.558 79.273 1.00 6.45 ? 358 GLY E C 1 +ATOM 17727 O O . GLY D 1 338 ? 70.866 69.959 79.520 1.00 7.28 ? 358 GLY E O 1 +ATOM 17728 N N . LYS D 1 339 ? 71.986 71.506 78.335 1.00 6.10 ? 359 LYS E N 1 +ATOM 17729 C CA . LYS D 1 339 ? 70.806 71.903 77.539 1.00 6.22 ? 359 LYS E CA 1 +ATOM 17730 C C . LYS D 1 339 ? 70.687 71.106 76.238 1.00 6.49 ? 359 LYS E C 1 +ATOM 17731 O O . LYS D 1 339 ? 69.840 71.411 75.383 1.00 7.88 ? 359 LYS E O 1 +ATOM 17732 C CB . LYS D 1 339 ? 70.829 73.400 77.227 1.00 5.95 ? 359 LYS E CB 1 +ATOM 17733 C CG . LYS D 1 339 ? 71.148 74.279 78.453 1.00 4.82 ? 359 LYS E CG 1 +ATOM 17734 C CD . LYS D 1 339 ? 70.910 75.768 78.211 1.00 5.93 ? 359 LYS E CD 1 +ATOM 17735 C CE . LYS D 1 339 ? 69.461 76.143 78.360 1.00 6.99 ? 359 LYS E CE 1 +ATOM 17736 N NZ . LYS D 1 339 ? 68.821 75.656 79.613 1.00 6.84 ? 359 LYS E NZ 1 +ATOM 17737 N N . GLY D 1 340 ? 71.512 70.079 76.082 1.00 7.46 ? 360 GLY E N 1 +ATOM 17738 C CA . GLY D 1 340 ? 71.545 69.316 74.841 1.00 7.21 ? 360 GLY E CA 1 +ATOM 17739 C C . GLY D 1 340 ? 70.253 68.597 74.526 1.00 7.96 ? 360 GLY E C 1 +ATOM 17740 O O . GLY D 1 340 ? 69.648 67.975 75.405 1.00 7.64 ? 360 GLY E O 1 +ATOM 17741 N N . PHE D 1 341 ? 69.870 68.622 73.254 1.00 8.13 ? 361 PHE E N 1 +ATOM 17742 C CA . PHE D 1 341 ? 68.675 67.926 72.824 1.00 8.41 ? 361 PHE E CA 1 +ATOM 17743 C C . PHE D 1 341 ? 68.842 66.397 72.928 1.00 8.40 ? 361 PHE E C 1 +ATOM 17744 O O . PHE D 1 341 ? 69.901 65.846 72.609 1.00 7.92 ? 361 PHE E O 1 +ATOM 17745 C CB . PHE D 1 341 ? 68.268 68.335 71.406 1.00 8.76 ? 361 PHE E CB 1 +ATOM 17746 C CG . PHE D 1 341 ? 67.081 67.580 70.904 1.00 8.51 ? 361 PHE E CG 1 +ATOM 17747 C CD1 . PHE D 1 341 ? 65.794 68.001 71.209 1.00 10.38 ? 361 PHE E CD1 1 +ATOM 17748 C CD2 . PHE D 1 341 ? 67.253 66.388 70.201 1.00 10.18 ? 361 PHE E CD2 1 +ATOM 17749 C CE1 . PHE D 1 341 ? 64.705 67.269 70.772 1.00 9.73 ? 361 PHE E CE1 1 +ATOM 17750 C CE2 . PHE D 1 341 ? 66.180 65.660 69.773 1.00 10.62 ? 361 PHE E CE2 1 +ATOM 17751 C CZ . PHE D 1 341 ? 64.890 66.111 70.060 1.00 10.20 ? 361 PHE E CZ 1 +ATOM 17752 N N . ASP D 1 342 ? 67.787 65.726 73.372 1.00 8.45 ? 362 ASP E N 1 +ATOM 17753 C CA . ASP D 1 342 ? 67.801 64.285 73.568 1.00 8.35 ? 362 ASP E CA 1 +ATOM 17754 C C . ASP D 1 342 ? 66.407 63.693 73.383 1.00 8.44 ? 362 ASP E C 1 +ATOM 17755 O O . ASP D 1 342 ? 65.472 64.142 74.036 1.00 8.62 ? 362 ASP E O 1 +ATOM 17756 C CB . ASP D 1 342 ? 68.275 63.967 74.971 1.00 8.52 ? 362 ASP E CB 1 +ATOM 17757 C CG . ASP D 1 342 ? 68.327 62.488 75.237 1.00 9.40 ? 362 ASP E CG 1 +ATOM 17758 O OD1 . ASP D 1 342 ? 69.093 61.780 74.539 1.00 8.64 ? 362 ASP E OD1 1 +ATOM 17759 O OD2 . ASP D 1 342 ? 67.589 62.036 76.142 1.00 10.32 ? 362 ASP E OD2 1 +ATOM 17760 N N . TRP D 1 343 ? 66.288 62.683 72.529 1.00 9.21 ? 363 TRP E N 1 +ATOM 17761 C CA . TRP D 1 343 ? 64.984 62.063 72.207 1.00 9.73 ? 363 TRP E CA 1 +ATOM 17762 C C . TRP D 1 343 ? 64.325 61.344 73.397 1.00 9.69 ? 363 TRP E C 1 +ATOM 17763 O O . TRP D 1 343 ? 63.158 61.610 73.709 1.00 9.58 ? 363 TRP E O 1 +ATOM 17764 C CB . TRP D 1 343 ? 65.094 61.108 71.005 1.00 11.15 ? 363 TRP E CB 1 +ATOM 17765 C CG . TRP D 1 343 ? 65.266 61.810 69.710 1.00 11.60 ? 363 TRP E CG 1 +ATOM 17766 C CD1 . TRP D 1 343 ? 66.382 61.851 68.948 1.00 13.10 ? 363 TRP E CD1 1 +ATOM 17767 C CD2 . TRP D 1 343 ? 64.283 62.585 69.039 1.00 11.98 ? 363 TRP E CD2 1 +ATOM 17768 N NE1 . TRP D 1 343 ? 66.159 62.607 67.822 1.00 13.88 ? 363 TRP E NE1 1 +ATOM 17769 C CE2 . TRP D 1 343 ? 64.870 63.067 67.853 1.00 12.15 ? 363 TRP E CE2 1 +ATOM 17770 C CE3 . TRP D 1 343 ? 62.948 62.906 69.314 1.00 12.35 ? 363 TRP E CE3 1 +ATOM 17771 C CZ2 . TRP D 1 343 ? 64.173 63.854 66.943 1.00 13.44 ? 363 TRP E CZ2 1 +ATOM 17772 C CZ3 . TRP D 1 343 ? 62.257 63.699 68.408 1.00 13.25 ? 363 TRP E CZ3 1 +ATOM 17773 C CH2 . TRP D 1 343 ? 62.869 64.159 67.238 1.00 13.38 ? 363 TRP E CH2 1 +ATOM 17774 N N . PRO D 1 344 ? 65.046 60.431 74.060 1.00 9.31 ? 364 PRO E N 1 +ATOM 17775 C CA . PRO D 1 344 ? 64.418 59.785 75.218 1.00 9.32 ? 364 PRO E CA 1 +ATOM 17776 C C . PRO D 1 344 ? 63.874 60.773 76.274 1.00 9.37 ? 364 PRO E C 1 +ATOM 17777 O O . PRO D 1 344 ? 62.736 60.633 76.729 1.00 8.47 ? 364 PRO E O 1 +ATOM 17778 C CB . PRO D 1 344 ? 65.545 58.908 75.767 1.00 9.61 ? 364 PRO E CB 1 +ATOM 17779 C CG . PRO D 1 344 ? 66.325 58.545 74.533 1.00 9.72 ? 364 PRO E CG 1 +ATOM 17780 C CD . PRO D 1 344 ? 66.372 59.855 73.777 1.00 9.66 ? 364 PRO E CD 1 +ATOM 17781 N N . LEU D 1 345 ? 64.663 61.780 76.644 1.00 9.14 ? 365 LEU E N 1 +ATOM 17782 C CA . LEU D 1 345 ? 64.208 62.754 77.631 1.00 10.06 ? 365 LEU E CA 1 +ATOM 17783 C C . LEU D 1 345 ? 63.008 63.571 77.130 1.00 10.23 ? 365 LEU E C 1 +ATOM 17784 O O . LEU D 1 345 ? 62.132 63.918 77.917 1.00 10.60 ? 365 LEU E O 1 +ATOM 17785 C CB . LEU D 1 345 ? 65.344 63.689 78.072 1.00 9.90 ? 365 LEU E CB 1 +ATOM 17786 C CG . LEU D 1 345 ? 66.307 63.011 79.052 1.00 11.64 ? 365 LEU E CG 1 +ATOM 17787 C CD1 . LEU D 1 345 ? 67.696 63.665 79.081 1.00 13.19 ? 365 LEU E CD1 1 +ATOM 17788 C CD2 . LEU D 1 345 ? 65.694 62.935 80.443 1.00 13.26 ? 365 LEU E CD2 1 +ATOM 17789 N N . LEU D 1 346 ? 62.971 63.853 75.828 1.00 10.73 ? 366 LEU E N 1 +ATOM 17790 C CA . LEU D 1 346 ? 61.843 64.563 75.210 1.00 10.39 ? 366 LEU E CA 1 +ATOM 17791 C C . LEU D 1 346 ? 60.574 63.743 75.364 1.00 9.60 ? 366 LEU E C 1 +ATOM 17792 O O . LEU D 1 346 ? 59.566 64.245 75.862 1.00 9.80 ? 366 LEU E O 1 +ATOM 17793 C CB . LEU D 1 346 ? 62.110 64.812 73.717 1.00 10.72 ? 366 LEU E CB 1 +ATOM 17794 C CG . LEU D 1 346 ? 61.011 65.550 72.911 1.00 11.19 ? 366 LEU E CG 1 +ATOM 17795 C CD1 . LEU D 1 346 ? 60.820 66.967 73.367 1.00 13.50 ? 366 LEU E CD1 1 +ATOM 17796 C CD2 . LEU D 1 346 ? 61.314 65.504 71.413 1.00 11.51 ? 366 LEU E CD2 1 +ATOM 17797 N N . VAL D 1 347 ? 60.612 62.479 74.939 1.00 8.80 ? 367 VAL E N 1 +ATOM 17798 C CA . VAL D 1 347 ? 59.399 61.631 75.016 1.00 7.93 ? 367 VAL E CA 1 +ATOM 17799 C C . VAL D 1 347 ? 58.991 61.387 76.477 1.00 8.19 ? 367 VAL E C 1 +ATOM 17800 O O . VAL D 1 347 ? 57.807 61.435 76.808 1.00 8.04 ? 367 VAL E O 1 +ATOM 17801 C CB . VAL D 1 347 ? 59.566 60.304 74.230 1.00 7.71 ? 367 VAL E CB 1 +ATOM 17802 C CG1 . VAL D 1 347 ? 58.277 59.412 74.342 1.00 7.11 ? 367 VAL E CG1 1 +ATOM 17803 C CG2 . VAL D 1 347 ? 59.888 60.620 72.766 1.00 7.32 ? 367 VAL E CG2 1 +ATOM 17804 N N . LYS D 1 348 ? 59.970 61.189 77.358 1.00 7.78 ? 368 LYS E N 1 +ATOM 17805 C CA . LYS D 1 348 ? 59.688 60.998 78.780 1.00 8.66 ? 368 LYS E CA 1 +ATOM 17806 C C . LYS D 1 348 ? 58.937 62.208 79.343 1.00 8.00 ? 368 LYS E C 1 +ATOM 17807 O O . LYS D 1 348 ? 57.889 62.060 79.998 1.00 8.91 ? 368 LYS E O 1 +ATOM 17808 C CB . LYS D 1 348 ? 60.996 60.800 79.567 1.00 8.33 ? 368 LYS E CB 1 +ATOM 17809 C CG . LYS D 1 348 ? 60.789 60.576 81.081 1.00 8.78 ? 368 LYS E CG 1 +ATOM 17810 C CD . LYS D 1 348 ? 59.892 59.385 81.386 1.00 9.45 ? 368 LYS E CD 1 +ATOM 17811 C CE . LYS D 1 348 ? 59.890 59.026 82.861 1.00 9.55 ? 368 LYS E CE 1 +ATOM 17812 N NZ . LYS D 1 348 ? 59.256 57.687 83.121 1.00 7.86 ? 368 LYS E NZ 1 +ATOM 17813 N N . ASP D 1 349 ? 59.460 63.407 79.076 1.00 8.46 ? 369 ASP E N 1 +ATOM 17814 C CA . ASP D 1 349 ? 58.831 64.640 79.567 1.00 8.48 ? 369 ASP E CA 1 +ATOM 17815 C C . ASP D 1 349 ? 57.385 64.777 79.098 1.00 7.91 ? 369 ASP E C 1 +ATOM 17816 O O . ASP D 1 349 ? 56.521 65.117 79.894 1.00 7.54 ? 369 ASP E O 1 +ATOM 17817 C CB . ASP D 1 349 ? 59.628 65.882 79.162 1.00 8.98 ? 369 ASP E CB 1 +ATOM 17818 C CG . ASP D 1 349 ? 60.834 66.105 80.040 1.00 9.95 ? 369 ASP E CG 1 +ATOM 17819 O OD1 . ASP D 1 349 ? 61.134 65.213 80.865 1.00 11.57 ? 369 ASP E OD1 1 +ATOM 17820 O OD2 . ASP D 1 349 ? 61.485 67.158 79.909 1.00 11.23 ? 369 ASP E OD2 1 +ATOM 17821 N N . PHE D 1 350 ? 57.114 64.492 77.823 1.00 8.09 ? 370 PHE E N 1 +ATOM 17822 C CA . PHE D 1 350 ? 55.726 64.555 77.360 1.00 8.28 ? 370 PHE E CA 1 +ATOM 17823 C C . PHE D 1 350 ? 54.844 63.485 77.979 1.00 8.51 ? 370 PHE E C 1 +ATOM 17824 O O . PHE D 1 350 ? 53.676 63.744 78.303 1.00 9.02 ? 370 PHE E O 1 +ATOM 17825 C CB . PHE D 1 350 ? 55.641 64.576 75.838 1.00 8.07 ? 370 PHE E CB 1 +ATOM 17826 C CG . PHE D 1 350 ? 55.889 65.949 75.276 1.00 8.79 ? 370 PHE E CG 1 +ATOM 17827 C CD1 . PHE D 1 350 ? 54.829 66.794 74.994 1.00 8.27 ? 370 PHE E CD1 1 +ATOM 17828 C CD2 . PHE D 1 350 ? 57.194 66.423 75.112 1.00 9.60 ? 370 PHE E CD2 1 +ATOM 17829 C CE1 . PHE D 1 350 ? 55.060 68.080 74.512 1.00 8.83 ? 370 PHE E CE1 1 +ATOM 17830 C CE2 . PHE D 1 350 ? 57.426 67.704 74.623 1.00 7.46 ? 370 PHE E CE2 1 +ATOM 17831 C CZ . PHE D 1 350 ? 56.358 68.532 74.331 1.00 9.72 ? 370 PHE E CZ 1 +ATOM 17832 N N . ASN D 1 351 ? 55.374 62.281 78.142 1.00 8.35 ? 371 ASN E N 1 +ATOM 17833 C CA . ASN D 1 351 ? 54.636 61.261 78.888 1.00 8.64 ? 371 ASN E CA 1 +ATOM 17834 C C . ASN D 1 351 ? 54.310 61.698 80.324 1.00 8.71 ? 371 ASN E C 1 +ATOM 17835 O O . ASN D 1 351 ? 53.217 61.425 80.831 1.00 8.99 ? 371 ASN E O 1 +ATOM 17836 C CB . ASN D 1 351 ? 55.374 59.925 78.827 1.00 8.91 ? 371 ASN E CB 1 +ATOM 17837 C CG . ASN D 1 351 ? 55.248 59.267 77.471 1.00 9.40 ? 371 ASN E CG 1 +ATOM 17838 O OD1 . ASN D 1 351 ? 54.257 59.484 76.756 1.00 11.09 ? 371 ASN E OD1 1 +ATOM 17839 N ND2 . ASN D 1 351 ? 56.219 58.421 77.120 1.00 9.76 ? 371 ASN E ND2 1 +ATOM 17840 N N . LEU D 1 352 ? 55.225 62.417 80.967 1.00 8.46 ? 372 LEU E N 1 +ATOM 17841 C CA . LEU D 1 352 ? 54.978 62.914 82.324 1.00 8.15 ? 372 LEU E CA 1 +ATOM 17842 C C . LEU D 1 352 ? 53.999 64.102 82.328 1.00 8.56 ? 372 LEU E C 1 +ATOM 17843 O O . LEU D 1 352 ? 53.173 64.228 83.227 1.00 8.71 ? 372 LEU E O 1 +ATOM 17844 C CB . LEU D 1 352 ? 56.287 63.327 82.991 1.00 8.43 ? 372 LEU E CB 1 +ATOM 17845 C CG . LEU D 1 352 ? 57.232 62.218 83.445 1.00 8.32 ? 372 LEU E CG 1 +ATOM 17846 C CD1 . LEU D 1 352 ? 58.573 62.808 83.878 1.00 7.16 ? 372 LEU E CD1 1 +ATOM 17847 C CD2 . LEU D 1 352 ? 56.615 61.431 84.584 1.00 9.59 ? 372 LEU E CD2 1 +ATOM 17848 N N . LEU D 1 353 ? 54.098 64.973 81.332 1.00 8.79 ? 373 LEU E N 1 +ATOM 17849 C CA . LEU D 1 353 ? 53.116 66.071 81.172 1.00 9.00 ? 373 LEU E CA 1 +ATOM 17850 C C . LEU D 1 353 ? 51.695 65.525 81.068 1.00 9.23 ? 373 LEU E C 1 +ATOM 17851 O O . LEU D 1 353 ? 50.786 65.993 81.756 1.00 8.95 ? 373 LEU E O 1 +ATOM 17852 C CB . LEU D 1 353 ? 53.426 66.901 79.928 1.00 9.09 ? 373 LEU E CB 1 +ATOM 17853 C CG . LEU D 1 353 ? 54.631 67.848 80.031 1.00 9.38 ? 373 LEU E CG 1 +ATOM 17854 C CD1 . LEU D 1 353 ? 54.877 68.548 78.701 1.00 10.78 ? 373 LEU E CD1 1 +ATOM 17855 C CD2 . LEU D 1 353 ? 54.427 68.862 81.155 1.00 7.15 ? 373 LEU E CD2 1 +ATOM 17856 N N . ARG D 1 354 ? 51.499 64.521 80.219 1.00 9.87 ? 374 ARG E N 1 +ATOM 17857 C CA A ARG D 1 354 ? 50.174 63.911 80.062 0.50 10.23 ? 374 ARG E CA 1 +ATOM 17858 C CA B ARG D 1 354 ? 50.183 63.901 80.061 0.50 10.43 ? 374 ARG E CA 1 +ATOM 17859 C C . ARG D 1 354 ? 49.715 63.195 81.334 1.00 10.32 ? 374 ARG E C 1 +ATOM 17860 O O . ARG D 1 354 ? 48.547 63.304 81.730 1.00 9.98 ? 374 ARG E O 1 +ATOM 17861 C CB A ARG D 1 354 ? 50.140 62.943 78.874 0.50 10.61 ? 374 ARG E CB 1 +ATOM 17862 C CB B ARG D 1 354 ? 50.199 62.902 78.909 0.50 10.95 ? 374 ARG E CB 1 +ATOM 17863 C CG A ARG D 1 354 ? 50.148 63.640 77.520 0.50 12.31 ? 374 ARG E CG 1 +ATOM 17864 C CG B ARG D 1 354 ? 50.091 63.539 77.537 0.50 13.56 ? 374 ARG E CG 1 +ATOM 17865 C CD A ARG D 1 354 ? 49.717 62.698 76.398 0.50 14.86 ? 374 ARG E CD 1 +ATOM 17866 C CD B ARG D 1 354 ? 50.249 62.466 76.480 0.50 17.33 ? 374 ARG E CD 1 +ATOM 17867 N NE A ARG D 1 354 ? 48.333 62.889 75.951 0.50 15.88 ? 374 ARG E NE 1 +ATOM 17868 N NE B ARG D 1 354 ? 49.198 62.474 75.474 0.50 19.44 ? 374 ARG E NE 1 +ATOM 17869 C CZ A ARG D 1 354 ? 47.361 61.973 76.000 0.50 17.16 ? 374 ARG E CZ 1 +ATOM 17870 C CZ B ARG D 1 354 ? 49.080 61.554 74.520 0.50 20.01 ? 374 ARG E CZ 1 +ATOM 17871 N NH1 A ARG D 1 354 ? 46.156 62.275 75.526 0.50 18.22 ? 374 ARG E NH1 1 +ATOM 17872 N NH1 B ARG D 1 354 ? 48.086 61.634 73.646 0.50 20.42 ? 374 ARG E NH1 1 +ATOM 17873 N NH2 A ARG D 1 354 ? 47.556 60.768 76.531 0.50 18.54 ? 374 ARG E NH2 1 +ATOM 17874 N NH2 B ARG D 1 354 ? 49.950 60.547 74.434 0.50 20.99 ? 374 ARG E NH2 1 +ATOM 17875 N N . TRP D 1 355 ? 50.626 62.466 81.970 1.00 9.33 ? 375 TRP E N 1 +ATOM 17876 C CA . TRP D 1 355 ? 50.346 61.776 83.240 1.00 9.41 ? 375 TRP E CA 1 +ATOM 17877 C C . TRP D 1 355 ? 49.914 62.771 84.307 1.00 9.24 ? 375 TRP E C 1 +ATOM 17878 O O . TRP D 1 355 ? 48.963 62.545 85.050 1.00 9.58 ? 375 TRP E O 1 +ATOM 17879 C CB . TRP D 1 355 ? 51.628 61.090 83.696 1.00 9.25 ? 375 TRP E CB 1 +ATOM 17880 C CG . TRP D 1 355 ? 51.594 60.464 85.023 1.00 9.45 ? 375 TRP E CG 1 +ATOM 17881 C CD1 . TRP D 1 355 ? 51.142 59.211 85.323 1.00 9.98 ? 375 TRP E CD1 1 +ATOM 17882 C CD2 . TRP D 1 355 ? 52.085 61.022 86.247 1.00 9.57 ? 375 TRP E CD2 1 +ATOM 17883 N NE1 . TRP D 1 355 ? 51.308 58.956 86.662 1.00 10.27 ? 375 TRP E NE1 1 +ATOM 17884 C CE2 . TRP D 1 355 ? 51.876 60.055 87.256 1.00 9.08 ? 375 TRP E CE2 1 +ATOM 17885 C CE3 . TRP D 1 355 ? 52.667 62.250 86.591 1.00 7.97 ? 375 TRP E CE3 1 +ATOM 17886 C CZ2 . TRP D 1 355 ? 52.230 60.272 88.590 1.00 10.17 ? 375 TRP E CZ2 1 +ATOM 17887 C CZ3 . TRP D 1 355 ? 53.013 62.476 87.920 1.00 9.89 ? 375 TRP E CZ3 1 +ATOM 17888 C CH2 . TRP D 1 355 ? 52.797 61.477 88.907 1.00 9.47 ? 375 TRP E CH2 1 +ATOM 17889 N N . LEU D 1 356 ? 50.628 63.887 84.362 1.00 9.20 ? 376 LEU E N 1 +ATOM 17890 C CA . LEU D 1 356 ? 50.367 64.970 85.306 1.00 9.01 ? 376 LEU E CA 1 +ATOM 17891 C C . LEU D 1 356 ? 49.016 65.685 85.055 1.00 9.10 ? 376 LEU E C 1 +ATOM 17892 O O . LEU D 1 356 ? 48.483 66.341 85.945 1.00 9.69 ? 376 LEU E O 1 +ATOM 17893 C CB . LEU D 1 356 ? 51.507 65.988 85.184 1.00 9.04 ? 376 LEU E CB 1 +ATOM 17894 C CG . LEU D 1 356 ? 51.528 67.225 86.080 1.00 6.73 ? 376 LEU E CG 1 +ATOM 17895 C CD1 . LEU D 1 356 ? 51.567 66.822 87.533 1.00 8.93 ? 376 LEU E CD1 1 +ATOM 17896 C CD2 . LEU D 1 356 ? 52.758 68.057 85.736 1.00 9.53 ? 376 LEU E CD2 1 +ATOM 17897 N N . GLY D 1 357 ? 48.475 65.577 83.845 1.00 8.92 ? 377 GLY E N 1 +ATOM 17898 C CA . GLY D 1 357 ? 47.292 66.372 83.485 1.00 8.83 ? 377 GLY E CA 1 +ATOM 17899 C C . GLY D 1 357 ? 47.629 67.819 83.157 1.00 8.70 ? 377 GLY E C 1 +ATOM 17900 O O . GLY D 1 357 ? 46.760 68.706 83.201 1.00 8.90 ? 377 GLY E O 1 +ATOM 17901 N N . ALA D 1 358 ? 48.892 68.074 82.823 1.00 8.12 ? 378 ALA E N 1 +ATOM 17902 C CA . ALA D 1 358 ? 49.298 69.394 82.343 1.00 8.46 ? 378 ALA E CA 1 +ATOM 17903 C C . ALA D 1 358 ? 48.843 69.627 80.906 1.00 8.26 ? 378 ALA E C 1 +ATOM 17904 O O . ALA D 1 358 ? 49.041 68.780 80.034 1.00 8.64 ? 378 ALA E O 1 +ATOM 17905 C CB . ALA D 1 358 ? 50.812 69.539 82.442 1.00 8.56 ? 378 ALA E CB 1 +ATOM 17906 N N . ASN D 1 359 ? 48.246 70.790 80.638 1.00 8.25 ? 379 ASN E N 1 +ATOM 17907 C CA . ASN D 1 359 ? 47.804 71.096 79.277 1.00 8.25 ? 379 ASN E CA 1 +ATOM 17908 C C . ASN D 1 359 ? 48.601 72.204 78.635 1.00 8.31 ? 379 ASN E C 1 +ATOM 17909 O O . ASN D 1 359 ? 48.241 72.694 77.556 1.00 8.95 ? 379 ASN E O 1 +ATOM 17910 C CB . ASN D 1 359 ? 46.317 71.442 79.268 1.00 8.05 ? 379 ASN E CB 1 +ATOM 17911 C CG . ASN D 1 359 ? 46.008 72.659 80.077 1.00 8.57 ? 379 ASN E CG 1 +ATOM 17912 O OD1 . ASN D 1 359 ? 46.904 73.299 80.632 1.00 6.78 ? 379 ASN E OD1 1 +ATOM 17913 N ND2 . ASN D 1 359 ? 44.736 73.019 80.125 1.00 9.87 ? 379 ASN E ND2 1 +ATOM 17914 N N . ALA D 1 360 ? 49.692 72.607 79.289 1.00 8.06 ? 380 ALA E N 1 +ATOM 17915 C CA . ALA D 1 360 ? 50.414 73.786 78.865 1.00 7.69 ? 380 ALA E CA 1 +ATOM 17916 C C . ALA D 1 360 ? 51.765 73.895 79.517 1.00 7.49 ? 380 ALA E C 1 +ATOM 17917 O O . ALA D 1 360 ? 51.969 73.439 80.647 1.00 6.61 ? 380 ALA E O 1 +ATOM 17918 C CB . ALA D 1 360 ? 49.618 75.026 79.190 1.00 8.54 ? 380 ALA E CB 1 +ATOM 17919 N N . PHE D 1 361 ? 52.690 74.509 78.793 1.00 8.06 ? 381 PHE E N 1 +ATOM 17920 C CA . PHE D 1 361 ? 53.874 75.058 79.433 1.00 7.83 ? 381 PHE E CA 1 +ATOM 17921 C C . PHE D 1 361 ? 54.367 76.319 78.768 1.00 8.37 ? 381 PHE E C 1 +ATOM 17922 O O . PHE D 1 361 ? 54.028 76.618 77.609 1.00 8.37 ? 381 PHE E O 1 +ATOM 17923 C CB . PHE D 1 361 ? 54.998 74.014 79.610 1.00 8.71 ? 381 PHE E CB 1 +ATOM 17924 C CG . PHE D 1 361 ? 55.556 73.443 78.326 1.00 8.45 ? 381 PHE E CG 1 +ATOM 17925 C CD1 . PHE D 1 361 ? 56.589 74.097 77.652 1.00 8.49 ? 381 PHE E CD1 1 +ATOM 17926 C CD2 . PHE D 1 361 ? 55.117 72.231 77.847 1.00 9.85 ? 381 PHE E CD2 1 +ATOM 17927 C CE1 . PHE D 1 361 ? 57.135 73.564 76.495 1.00 9.61 ? 381 PHE E CE1 1 +ATOM 17928 C CE2 . PHE D 1 361 ? 55.642 71.695 76.698 1.00 10.48 ? 381 PHE E CE2 1 +ATOM 17929 C CZ . PHE D 1 361 ? 56.661 72.353 76.013 1.00 8.66 ? 381 PHE E CZ 1 +ATOM 17930 N N . ARG D 1 362 ? 55.129 77.082 79.551 1.00 7.59 ? 382 ARG E N 1 +ATOM 17931 C CA . ARG D 1 362 ? 55.859 78.231 79.061 1.00 7.60 ? 382 ARG E CA 1 +ATOM 17932 C C . ARG D 1 362 ? 57.281 77.790 78.836 1.00 7.60 ? 382 ARG E C 1 +ATOM 17933 O O . ARG D 1 362 ? 57.825 77.060 79.675 1.00 7.62 ? 382 ARG E O 1 +ATOM 17934 C CB . ARG D 1 362 ? 55.864 79.345 80.102 1.00 6.94 ? 382 ARG E CB 1 +ATOM 17935 C CG . ARG D 1 362 ? 56.759 80.529 79.719 1.00 8.50 ? 382 ARG E CG 1 +ATOM 17936 C CD . ARG D 1 362 ? 56.543 81.727 80.613 1.00 8.18 ? 382 ARG E CD 1 +ATOM 17937 N NE . ARG D 1 362 ? 56.779 81.469 82.034 1.00 8.60 ? 382 ARG E NE 1 +ATOM 17938 C CZ . ARG D 1 362 ? 57.612 82.159 82.818 1.00 8.43 ? 382 ARG E CZ 1 +ATOM 17939 N NH1 . ARG D 1 362 ? 58.326 83.160 82.342 1.00 8.45 ? 382 ARG E NH1 1 +ATOM 17940 N NH2 . ARG D 1 362 ? 57.713 81.865 84.103 1.00 9.04 ? 382 ARG E NH2 1 +ATOM 17941 N N . THR D 1 363 ? 57.883 78.255 77.735 1.00 7.12 ? 383 THR E N 1 +ATOM 17942 C CA . THR D 1 363 ? 59.284 77.958 77.440 1.00 7.82 ? 383 THR E CA 1 +ATOM 17943 C C . THR D 1 363 ? 60.196 78.889 78.241 1.00 7.30 ? 383 THR E C 1 +ATOM 17944 O O . THR D 1 363 ? 60.935 79.680 77.667 1.00 7.99 ? 383 THR E O 1 +ATOM 17945 C CB . THR D 1 363 ? 59.626 78.090 75.920 1.00 7.31 ? 383 THR E CB 1 +ATOM 17946 O OG1 . THR D 1 363 ? 59.617 79.473 75.518 1.00 7.40 ? 383 THR E OG1 1 +ATOM 17947 C CG2 . THR D 1 363 ? 58.665 77.274 75.055 1.00 10.39 ? 383 THR E CG2 1 +ATOM 17948 N N . SER D 1 364 ? 60.136 78.817 79.567 1.00 7.67 ? 384 SER E N 1 +ATOM 17949 C CA . SER D 1 364 ? 61.031 79.620 80.382 1.00 7.79 ? 384 SER E CA 1 +ATOM 17950 C C . SER D 1 364 ? 62.449 79.132 80.111 1.00 7.85 ? 384 SER E C 1 +ATOM 17951 O O . SER D 1 364 ? 62.684 77.924 80.147 1.00 8.17 ? 384 SER E O 1 +ATOM 17952 C CB . SER D 1 364 ? 60.719 79.470 81.864 1.00 8.18 ? 384 SER E CB 1 +ATOM 17953 O OG . SER D 1 364 ? 60.376 78.128 82.161 1.00 9.72 ? 384 SER E OG 1 +ATOM 17954 N N . HIS D 1 365 ? 63.399 80.022 79.832 1.00 8.33 ? 385 HIS E N 1 +ATOM 17955 C CA . HIS D 1 365 ? 63.206 81.432 79.479 1.00 8.69 ? 385 HIS E CA 1 +ATOM 17956 C C . HIS D 1 365 ? 63.902 81.714 78.130 1.00 8.70 ? 385 HIS E C 1 +ATOM 17957 O O . HIS D 1 365 ? 64.748 82.596 78.040 1.00 9.80 ? 385 HIS E O 1 +ATOM 17958 C CB . HIS D 1 365 ? 63.813 82.338 80.543 1.00 8.66 ? 385 HIS E CB 1 +ATOM 17959 C CG . HIS D 1 365 ? 63.181 82.222 81.897 1.00 8.71 ? 385 HIS E CG 1 +ATOM 17960 N ND1 . HIS D 1 365 ? 61.858 82.530 82.137 1.00 7.79 ? 385 HIS E ND1 1 +ATOM 17961 C CD2 . HIS D 1 365 ? 63.697 81.832 83.088 1.00 8.46 ? 385 HIS E CD2 1 +ATOM 17962 C CE1 . HIS D 1 365 ? 61.588 82.336 83.418 1.00 9.14 ? 385 HIS E CE1 1 +ATOM 17963 N NE2 . HIS D 1 365 ? 62.692 81.923 84.019 1.00 8.68 ? 385 HIS E NE2 1 +ATOM 17964 N N . TYR D 1 366 ? 63.516 80.965 77.102 1.00 8.71 ? 386 TYR E N 1 +ATOM 17965 C CA . TYR D 1 366 ? 64.151 80.995 75.782 1.00 8.39 ? 386 TYR E CA 1 +ATOM 17966 C C . TYR D 1 366 ? 63.385 80.010 74.889 1.00 8.92 ? 386 TYR E C 1 +ATOM 17967 O O . TYR D 1 366 ? 62.748 79.077 75.387 1.00 9.52 ? 386 TYR E O 1 +ATOM 17968 C CB . TYR D 1 366 ? 65.653 80.622 75.875 1.00 8.01 ? 386 TYR E CB 1 +ATOM 17969 C CG . TYR D 1 366 ? 65.882 79.479 76.834 1.00 7.38 ? 386 TYR E CG 1 +ATOM 17970 C CD1 . TYR D 1 366 ? 65.610 78.165 76.451 1.00 7.91 ? 386 TYR E CD1 1 +ATOM 17971 C CD2 . TYR D 1 366 ? 66.291 79.711 78.138 1.00 7.43 ? 386 TYR E CD2 1 +ATOM 17972 C CE1 . TYR D 1 366 ? 65.773 77.121 77.327 1.00 7.89 ? 386 TYR E CE1 1 +ATOM 17973 C CE2 . TYR D 1 366 ? 66.440 78.647 79.038 1.00 5.69 ? 386 TYR E CE2 1 +ATOM 17974 C CZ . TYR D 1 366 ? 66.180 77.368 78.615 1.00 7.91 ? 386 TYR E CZ 1 +ATOM 17975 O OH . TYR D 1 366 ? 66.297 76.325 79.489 1.00 8.97 ? 386 TYR E OH 1 +ATOM 17976 N N . PRO D 1 367 ? 63.425 80.203 73.565 1.00 9.22 ? 387 PRO E N 1 +ATOM 17977 C CA . PRO D 1 367 ? 62.730 79.208 72.739 1.00 9.36 ? 387 PRO E CA 1 +ATOM 17978 C C . PRO D 1 367 ? 63.393 77.878 72.926 1.00 9.43 ? 387 PRO E C 1 +ATOM 17979 O O . PRO D 1 367 ? 64.605 77.856 73.085 1.00 9.48 ? 387 PRO E O 1 +ATOM 17980 C CB . PRO D 1 367 ? 62.965 79.682 71.302 1.00 9.97 ? 387 PRO E CB 1 +ATOM 17981 C CG . PRO D 1 367 ? 63.550 81.064 71.418 1.00 10.28 ? 387 PRO E CG 1 +ATOM 17982 C CD . PRO D 1 367 ? 64.048 81.282 72.787 1.00 9.51 ? 387 PRO E CD 1 +ATOM 17983 N N . TYR D 1 368 ? 62.621 76.790 72.904 1.00 9.20 ? 388 TYR E N 1 +ATOM 17984 C CA . TYR D 1 368 ? 63.160 75.421 72.972 1.00 9.19 ? 388 TYR E CA 1 +ATOM 17985 C C . TYR D 1 368 ? 63.415 74.830 71.580 1.00 9.39 ? 388 TYR E C 1 +ATOM 17986 O O . TYR D 1 368 ? 63.026 75.402 70.560 1.00 8.89 ? 388 TYR E O 1 +ATOM 17987 C CB . TYR D 1 368 ? 62.199 74.516 73.749 1.00 9.42 ? 388 TYR E CB 1 +ATOM 17988 C CG . TYR D 1 368 ? 61.985 74.879 75.213 1.00 8.83 ? 388 TYR E CG 1 +ATOM 17989 C CD1 . TYR D 1 368 ? 62.712 75.899 75.847 1.00 8.47 ? 388 TYR E CD1 1 +ATOM 17990 C CD2 . TYR D 1 368 ? 61.062 74.181 75.981 1.00 10.69 ? 388 TYR E CD2 1 +ATOM 17991 C CE1 . TYR D 1 368 ? 62.521 76.195 77.198 1.00 9.32 ? 388 TYR E CE1 1 +ATOM 17992 C CE2 . TYR D 1 368 ? 60.866 74.471 77.330 1.00 10.88 ? 388 TYR E CE2 1 +ATOM 17993 C CZ . TYR D 1 368 ? 61.594 75.479 77.932 1.00 9.70 ? 388 TYR E CZ 1 +ATOM 17994 O OH . TYR D 1 368 ? 61.390 75.755 79.260 1.00 9.15 ? 388 TYR E OH 1 +ATOM 17995 N N . ALA D 1 369 ? 64.087 73.687 71.520 1.00 9.84 ? 389 ALA E N 1 +ATOM 17996 C CA . ALA D 1 369 ? 64.310 73.025 70.240 1.00 9.90 ? 389 ALA E CA 1 +ATOM 17997 C C . ALA D 1 369 ? 62.995 72.939 69.446 1.00 10.61 ? 389 ALA E C 1 +ATOM 17998 O O . ALA D 1 369 ? 61.917 72.744 70.023 1.00 10.47 ? 389 ALA E O 1 +ATOM 17999 C CB . ALA D 1 369 ? 64.882 71.629 70.459 1.00 9.74 ? 389 ALA E CB 1 +ATOM 18000 N N . GLU D 1 370 ? 63.089 73.086 68.128 1.00 10.89 ? 390 GLU E N 1 +ATOM 18001 C CA . GLU D 1 370 ? 61.917 72.957 67.258 1.00 11.49 ? 390 GLU E CA 1 +ATOM 18002 C C . GLU D 1 370 ? 61.190 71.648 67.507 1.00 11.62 ? 390 GLU E C 1 +ATOM 18003 O O . GLU D 1 370 ? 59.953 71.605 67.500 1.00 12.00 ? 390 GLU E O 1 +ATOM 18004 C CB . GLU D 1 370 ? 62.328 73.043 65.800 1.00 12.10 ? 390 GLU E CB 1 +ATOM 18005 C CG . GLU D 1 370 ? 62.887 74.403 65.413 1.00 13.96 ? 390 GLU E CG 1 +ATOM 18006 C CD . GLU D 1 370 ? 64.404 74.408 65.334 1.00 18.28 ? 390 GLU E CD 1 +ATOM 18007 O OE1 . GLU D 1 370 ? 65.065 73.873 66.268 1.00 19.14 ? 390 GLU E OE1 1 +ATOM 18008 O OE2 . GLU D 1 370 ? 64.940 74.932 64.330 1.00 19.80 ? 390 GLU E OE2 1 +ATOM 18009 N N . GLU D 1 371 ? 61.955 70.590 67.756 1.00 11.01 ? 391 GLU E N 1 +ATOM 18010 C CA . GLU D 1 371 ? 61.369 69.279 68.012 1.00 11.42 ? 391 GLU E CA 1 +ATOM 18011 C C . GLU D 1 371 ? 60.382 69.340 69.174 1.00 11.06 ? 391 GLU E C 1 +ATOM 18012 O O . GLU D 1 371 ? 59.367 68.649 69.163 1.00 12.07 ? 391 GLU E O 1 +ATOM 18013 C CB . GLU D 1 371 ? 62.464 68.252 68.298 1.00 11.96 ? 391 GLU E CB 1 +ATOM 18014 C CG . GLU D 1 371 ? 63.434 68.013 67.139 1.00 14.01 ? 391 GLU E CG 1 +ATOM 18015 C CD . GLU D 1 371 ? 64.697 68.859 67.203 1.00 16.23 ? 391 GLU E CD 1 +ATOM 18016 O OE1 . GLU D 1 371 ? 64.588 70.108 67.289 1.00 12.51 ? 391 GLU E OE1 1 +ATOM 18017 O OE2 . GLU D 1 371 ? 65.811 68.261 67.161 1.00 19.73 ? 391 GLU E OE2 1 +ATOM 18018 N N . VAL D 1 372 ? 60.676 70.151 70.184 1.00 10.27 ? 392 VAL E N 1 +ATOM 18019 C CA . VAL D 1 372 ? 59.772 70.269 71.333 1.00 9.67 ? 392 VAL E CA 1 +ATOM 18020 C C . VAL D 1 372 ? 58.433 70.865 70.861 1.00 9.77 ? 392 VAL E C 1 +ATOM 18021 O O . VAL D 1 372 ? 57.341 70.422 71.283 1.00 10.41 ? 392 VAL E O 1 +ATOM 18022 C CB . VAL D 1 372 ? 60.389 71.094 72.486 1.00 9.53 ? 392 VAL E CB 1 +ATOM 18023 C CG1 . VAL D 1 372 ? 59.400 71.229 73.644 1.00 9.31 ? 392 VAL E CG1 1 +ATOM 18024 C CG2 . VAL D 1 372 ? 61.687 70.450 72.965 1.00 7.79 ? 392 VAL E CG2 1 +ATOM 18025 N N . MET D 1 373 ? 58.510 71.840 69.962 1.00 9.71 ? 393 MET E N 1 +ATOM 18026 C CA . MET D 1 373 ? 57.301 72.496 69.459 1.00 10.02 ? 393 MET E CA 1 +ATOM 18027 C C . MET D 1 373 ? 56.484 71.521 68.598 1.00 10.09 ? 393 MET E C 1 +ATOM 18028 O O . MET D 1 373 ? 55.251 71.506 68.664 1.00 10.30 ? 393 MET E O 1 +ATOM 18029 C CB . MET D 1 373 ? 57.655 73.786 68.718 1.00 10.32 ? 393 MET E CB 1 +ATOM 18030 C CG . MET D 1 373 ? 58.409 74.813 69.574 1.00 10.23 ? 393 MET E CG 1 +ATOM 18031 S SD . MET D 1 373 ? 57.454 75.499 70.931 1.00 10.20 ? 393 MET E SD 1 +ATOM 18032 C CE . MET D 1 373 ? 57.783 74.339 72.273 1.00 11.43 ? 393 MET E CE 1 +ATOM 18033 N N . GLN D 1 374 ? 57.160 70.675 67.826 1.00 10.12 ? 394 GLN E N 1 +ATOM 18034 C CA . GLN D 1 374 ? 56.457 69.708 66.984 1.00 10.44 ? 394 GLN E CA 1 +ATOM 18035 C C . GLN D 1 374 ? 55.664 68.746 67.870 1.00 10.41 ? 394 GLN E C 1 +ATOM 18036 O O . GLN D 1 374 ? 54.507 68.409 67.549 1.00 10.31 ? 394 GLN E O 1 +ATOM 18037 C CB . GLN D 1 374 ? 57.432 68.973 66.051 1.00 10.54 ? 394 GLN E CB 1 +ATOM 18038 C CG A GLN D 1 374 ? 58.261 69.996 65.290 0.50 11.46 ? 394 GLN E CG 1 +ATOM 18039 C CG B GLN D 1 374 ? 58.246 69.851 65.110 0.50 10.85 ? 394 GLN E CG 1 +ATOM 18040 C CD A GLN D 1 374 ? 58.800 69.550 63.968 0.50 12.29 ? 394 GLN E CD 1 +ATOM 18041 C CD B GLN D 1 374 ? 57.517 70.164 63.811 0.50 10.94 ? 394 GLN E CD 1 +ATOM 18042 O OE1 A GLN D 1 374 ? 59.928 69.883 63.632 0.50 12.17 ? 394 GLN E OE1 1 +ATOM 18043 O OE1 B GLN D 1 374 ? 57.015 71.268 63.623 0.50 10.67 ? 394 GLN E OE1 1 +ATOM 18044 N NE2 A GLN D 1 374 ? 58.001 68.830 63.191 0.50 14.77 ? 394 GLN E NE2 1 +ATOM 18045 N NE2 B GLN D 1 374 ? 57.457 69.192 62.911 0.50 13.21 ? 394 GLN E NE2 1 +ATOM 18046 N N . MET D 1 375 ? 56.253 68.369 69.011 1.00 10.01 ? 395 MET E N 1 +ATOM 18047 C CA . MET D 1 375 ? 55.606 67.484 69.984 1.00 10.03 ? 395 MET E CA 1 +ATOM 18048 C C . MET D 1 375 ? 54.379 68.139 70.591 1.00 9.59 ? 395 MET E C 1 +ATOM 18049 O O . MET D 1 375 ? 53.328 67.520 70.715 1.00 8.47 ? 395 MET E O 1 +ATOM 18050 C CB . MET D 1 375 ? 56.572 67.085 71.105 1.00 10.50 ? 395 MET E CB 1 +ATOM 18051 C CG . MET D 1 375 ? 57.669 66.174 70.635 1.00 11.39 ? 395 MET E CG 1 +ATOM 18052 S SD . MET D 1 375 ? 57.186 64.431 70.606 1.00 16.13 ? 395 MET E SD 1 +ATOM 18053 C CE . MET D 1 375 ? 57.133 64.133 72.362 1.00 8.03 ? 395 MET E CE 1 +ATOM 18054 N N . CYS D 1 376 ? 54.506 69.410 70.952 1.00 9.06 ? 396 CYS E N 1 +ATOM 18055 C CA . CYS D 1 376 ? 53.371 70.158 71.463 1.00 9.49 ? 396 CYS E CA 1 +ATOM 18056 C C . CYS D 1 376 ? 52.219 70.137 70.475 1.00 9.67 ? 396 CYS E C 1 +ATOM 18057 O O . CYS D 1 376 ? 51.065 69.957 70.871 1.00 9.89 ? 396 CYS E O 1 +ATOM 18058 C CB . CYS D 1 376 ? 53.779 71.599 71.755 1.00 9.40 ? 396 CYS E CB 1 +ATOM 18059 S SG . CYS D 1 376 ? 54.943 71.712 73.125 1.00 10.11 ? 396 CYS E SG 1 +ATOM 18060 N N . ASP D 1 377 ? 52.529 70.324 69.198 1.00 9.80 ? 397 ASP E N 1 +ATOM 18061 C CA . ASP D 1 377 ? 51.488 70.325 68.165 1.00 10.03 ? 397 ASP E CA 1 +ATOM 18062 C C . ASP D 1 377 ? 50.751 68.989 68.097 1.00 10.31 ? 397 ASP E C 1 +ATOM 18063 O O . ASP D 1 377 ? 49.541 68.957 67.869 1.00 9.46 ? 397 ASP E O 1 +ATOM 18064 C CB . ASP D 1 377 ? 52.080 70.642 66.790 1.00 10.17 ? 397 ASP E CB 1 +ATOM 18065 C CG . ASP D 1 377 ? 52.472 72.097 66.628 1.00 11.67 ? 397 ASP E CG 1 +ATOM 18066 O OD1 . ASP D 1 377 ? 52.043 72.941 67.442 1.00 10.84 ? 397 ASP E OD1 1 +ATOM 18067 O OD2 . ASP D 1 377 ? 53.224 72.393 65.669 1.00 12.54 ? 397 ASP E OD2 1 +ATOM 18068 N N . ARG D 1 378 ? 51.479 67.890 68.272 1.00 10.35 ? 398 ARG E N 1 +ATOM 18069 C CA . ARG D 1 378 ? 50.908 66.558 68.136 1.00 10.50 ? 398 ARG E CA 1 +ATOM 18070 C C . ARG D 1 378 ? 50.255 66.060 69.428 1.00 10.56 ? 398 ARG E C 1 +ATOM 18071 O O . ARG D 1 378 ? 49.344 65.243 69.374 1.00 10.98 ? 398 ARG E O 1 +ATOM 18072 C CB . ARG D 1 378 ? 51.980 65.570 67.659 1.00 11.21 ? 398 ARG E CB 1 +ATOM 18073 C CG . ARG D 1 378 ? 52.523 65.905 66.286 1.00 11.43 ? 398 ARG E CG 1 +ATOM 18074 C CD . ARG D 1 378 ? 53.788 65.133 65.990 1.00 14.03 ? 398 ARG E CD 1 +ATOM 18075 N NE . ARG D 1 378 ? 53.499 63.708 66.031 1.00 14.77 ? 398 ARG E NE 1 +ATOM 18076 C CZ . ARG D 1 378 ? 53.983 62.840 66.918 1.00 16.13 ? 398 ARG E CZ 1 +ATOM 18077 N NH1 . ARG D 1 378 ? 54.874 63.213 67.843 1.00 14.89 ? 398 ARG E NH1 1 +ATOM 18078 N NH2 . ARG D 1 378 ? 53.589 61.568 66.846 1.00 15.08 ? 398 ARG E NH2 1 +ATOM 18079 N N . TYR D 1 379 ? 50.723 66.553 70.577 1.00 10.10 ? 399 TYR E N 1 +ATOM 18080 C CA . TYR D 1 379 ? 50.234 66.097 71.884 1.00 9.83 ? 399 TYR E CA 1 +ATOM 18081 C C . TYR D 1 379 ? 49.168 67.035 72.478 1.00 9.47 ? 399 TYR E C 1 +ATOM 18082 O O . TYR D 1 379 ? 48.500 66.680 73.460 1.00 9.78 ? 399 TYR E O 1 +ATOM 18083 C CB . TYR D 1 379 ? 51.404 65.954 72.866 1.00 10.13 ? 399 TYR E CB 1 +ATOM 18084 C CG . TYR D 1 379 ? 52.219 64.678 72.692 1.00 10.77 ? 399 TYR E CG 1 +ATOM 18085 C CD1 . TYR D 1 379 ? 52.900 64.420 71.509 1.00 11.16 ? 399 TYR E CD1 1 +ATOM 18086 C CD2 . TYR D 1 379 ? 52.313 63.744 73.713 1.00 11.45 ? 399 TYR E CD2 1 +ATOM 18087 C CE1 . TYR D 1 379 ? 53.657 63.274 71.352 1.00 11.43 ? 399 TYR E CE1 1 +ATOM 18088 C CE2 . TYR D 1 379 ? 53.058 62.583 73.560 1.00 11.89 ? 399 TYR E CE2 1 +ATOM 18089 C CZ . TYR D 1 379 ? 53.731 62.359 72.375 1.00 11.04 ? 399 TYR E CZ 1 +ATOM 18090 O OH . TYR D 1 379 ? 54.462 61.194 72.201 1.00 12.96 ? 399 TYR E OH 1 +ATOM 18091 N N . GLY D 1 380 ? 49.013 68.221 71.896 1.00 9.38 ? 400 GLY E N 1 +ATOM 18092 C CA . GLY D 1 380 ? 48.015 69.204 72.378 1.00 9.05 ? 400 GLY E CA 1 +ATOM 18093 C C . GLY D 1 380 ? 48.396 69.986 73.619 1.00 9.26 ? 400 GLY E C 1 +ATOM 18094 O O . GLY D 1 380 ? 47.534 70.432 74.369 1.00 9.33 ? 400 GLY E O 1 +ATOM 18095 N N . ILE D 1 381 ? 49.695 70.147 73.849 1.00 8.68 ? 401 ILE E N 1 +ATOM 18096 C CA . ILE D 1 381 ? 50.193 70.890 75.003 1.00 8.56 ? 401 ILE E CA 1 +ATOM 18097 C C . ILE D 1 381 ? 50.445 72.311 74.515 1.00 8.53 ? 401 ILE E C 1 +ATOM 18098 O O . ILE D 1 381 ? 51.334 72.529 73.688 1.00 8.90 ? 401 ILE E O 1 +ATOM 18099 C CB . ILE D 1 381 ? 51.512 70.290 75.545 1.00 8.29 ? 401 ILE E CB 1 +ATOM 18100 C CG1 . ILE D 1 381 ? 51.353 68.791 75.808 1.00 8.99 ? 401 ILE E CG1 1 +ATOM 18101 C CG2 . ILE D 1 381 ? 51.943 71.008 76.831 1.00 8.32 ? 401 ILE E CG2 1 +ATOM 18102 C CD1 . ILE D 1 381 ? 50.277 68.432 76.868 1.00 9.20 ? 401 ILE E CD1 1 +ATOM 18103 N N . VAL D 1 382 ? 49.635 73.261 74.974 1.00 8.15 ? 402 VAL E N 1 +ATOM 18104 C CA . VAL D 1 382 ? 49.767 74.640 74.470 1.00 8.34 ? 402 VAL E CA 1 +ATOM 18105 C C . VAL D 1 382 ? 50.997 75.300 75.070 1.00 8.22 ? 402 VAL E C 1 +ATOM 18106 O O . VAL D 1 382 ? 51.486 74.902 76.138 1.00 7.88 ? 402 VAL E O 1 +ATOM 18107 C CB . VAL D 1 382 ? 48.507 75.511 74.686 1.00 8.42 ? 402 VAL E CB 1 +ATOM 18108 C CG1 . VAL D 1 382 ? 47.282 74.810 74.070 1.00 8.29 ? 402 VAL E CG1 1 +ATOM 18109 C CG2 . VAL D 1 382 ? 48.295 75.862 76.145 1.00 10.08 ? 402 VAL E CG2 1 +ATOM 18110 N N . VAL D 1 383 ? 51.495 76.301 74.358 1.00 7.99 ? 403 VAL E N 1 +ATOM 18111 C CA . VAL D 1 383 ? 52.774 76.907 74.684 1.00 7.44 ? 403 VAL E CA 1 +ATOM 18112 C C . VAL D 1 383 ? 52.680 78.428 74.776 1.00 7.16 ? 403 VAL E C 1 +ATOM 18113 O O . VAL D 1 383 ? 52.069 79.088 73.915 1.00 6.86 ? 403 VAL E O 1 +ATOM 18114 C CB . VAL D 1 383 ? 53.828 76.516 73.642 1.00 7.50 ? 403 VAL E CB 1 +ATOM 18115 C CG1 . VAL D 1 383 ? 55.155 77.189 73.949 1.00 7.02 ? 403 VAL E CG1 1 +ATOM 18116 C CG2 . VAL D 1 383 ? 54.012 74.988 73.600 1.00 6.64 ? 403 VAL E CG2 1 +ATOM 18117 N N . ILE D 1 384 ? 53.282 78.988 75.822 1.00 7.20 ? 404 ILE E N 1 +ATOM 18118 C CA . ILE D 1 384 ? 53.581 80.419 75.870 1.00 7.48 ? 404 ILE E CA 1 +ATOM 18119 C C . ILE D 1 384 ? 55.046 80.464 75.458 1.00 7.94 ? 404 ILE E C 1 +ATOM 18120 O O . ILE D 1 384 ? 55.918 80.056 76.220 1.00 8.08 ? 404 ILE E O 1 +ATOM 18121 C CB . ILE D 1 384 ? 53.375 81.022 77.260 1.00 7.06 ? 404 ILE E CB 1 +ATOM 18122 C CG1 . ILE D 1 384 ? 51.896 80.937 77.656 1.00 8.14 ? 404 ILE E CG1 1 +ATOM 18123 C CG2 . ILE D 1 384 ? 53.836 82.466 77.292 1.00 8.01 ? 404 ILE E CG2 1 +ATOM 18124 C CD1 . ILE D 1 384 ? 51.625 81.171 79.140 1.00 8.11 ? 404 ILE E CD1 1 +ATOM 18125 N N . ASP D 1 385 ? 55.288 80.908 74.230 1.00 8.10 ? 405 ASP E N 1 +ATOM 18126 C CA . ASP D 1 385 ? 56.612 80.826 73.606 1.00 8.33 ? 405 ASP E CA 1 +ATOM 18127 C C . ASP D 1 385 ? 57.388 82.078 73.996 1.00 8.67 ? 405 ASP E C 1 +ATOM 18128 O O . ASP D 1 385 ? 57.014 83.188 73.621 1.00 9.39 ? 405 ASP E O 1 +ATOM 18129 C CB . ASP D 1 385 ? 56.456 80.738 72.091 1.00 8.49 ? 405 ASP E CB 1 +ATOM 18130 C CG . ASP D 1 385 ? 57.650 80.138 71.401 1.00 9.33 ? 405 ASP E CG 1 +ATOM 18131 O OD1 . ASP D 1 385 ? 58.732 80.011 72.020 1.00 7.93 ? 405 ASP E OD1 1 +ATOM 18132 O OD2 . ASP D 1 385 ? 57.484 79.769 70.218 1.00 9.55 ? 405 ASP E OD2 1 +ATOM 18133 N N . GLU D 1 386 ? 58.475 81.909 74.743 1.00 8.71 ? 406 GLU E N 1 +ATOM 18134 C CA . GLU D 1 386 ? 59.135 83.036 75.377 1.00 8.96 ? 406 GLU E CA 1 +ATOM 18135 C C . GLU D 1 386 ? 60.550 83.223 74.849 1.00 9.51 ? 406 GLU E C 1 +ATOM 18136 O O . GLU D 1 386 ? 61.305 82.241 74.715 1.00 10.15 ? 406 GLU E O 1 +ATOM 18137 C CB . GLU D 1 386 ? 59.182 82.826 76.878 1.00 9.17 ? 406 GLU E CB 1 +ATOM 18138 C CG . GLU D 1 386 ? 59.855 83.973 77.636 1.00 8.33 ? 406 GLU E CG 1 +ATOM 18139 C CD . GLU D 1 386 ? 59.612 83.906 79.125 1.00 9.19 ? 406 GLU E CD 1 +ATOM 18140 O OE1 . GLU D 1 386 ? 58.481 84.225 79.558 1.00 7.57 ? 406 GLU E OE1 1 +ATOM 18141 O OE2 . GLU D 1 386 ? 60.560 83.562 79.877 1.00 8.86 ? 406 GLU E OE2 1 +ATOM 18142 N N . CYS D 1 387 ? 60.898 84.471 74.548 1.00 10.02 ? 407 CYS E N 1 +ATOM 18143 C CA . CYS D 1 387 ? 62.217 84.774 74.007 1.00 10.81 ? 407 CYS E CA 1 +ATOM 18144 C C . CYS D 1 387 ? 63.180 84.983 75.171 1.00 10.01 ? 407 CYS E C 1 +ATOM 18145 O O . CYS D 1 387 ? 62.734 85.124 76.298 1.00 10.78 ? 407 CYS E O 1 +ATOM 18146 C CB . CYS D 1 387 ? 62.163 86.013 73.160 1.00 11.45 ? 407 CYS E CB 1 +ATOM 18147 S SG . CYS D 1 387 ? 62.083 87.443 74.182 1.00 13.60 ? 407 CYS E SG 1 +ATOM 18148 N N . PRO D 1 388 ? 64.506 84.981 74.901 1.00 9.70 ? 408 PRO E N 1 +ATOM 18149 C CA . PRO D 1 388 ? 65.525 85.095 75.959 1.00 9.82 ? 408 PRO E CA 1 +ATOM 18150 C C . PRO D 1 388 ? 65.623 86.438 76.694 1.00 10.31 ? 408 PRO E C 1 +ATOM 18151 O O . PRO D 1 388 ? 66.697 86.783 77.228 1.00 9.95 ? 408 PRO E O 1 +ATOM 18152 C CB . PRO D 1 388 ? 66.835 84.796 75.214 1.00 9.56 ? 408 PRO E CB 1 +ATOM 18153 C CG . PRO D 1 388 ? 66.460 84.237 73.913 1.00 10.37 ? 408 PRO E CG 1 +ATOM 18154 C CD . PRO D 1 388 ? 65.133 84.801 73.581 1.00 9.69 ? 408 PRO E CD 1 +ATOM 18155 N N . GLY D 1 389 ? 64.517 87.180 76.785 1.00 9.52 ? 409 GLY E N 1 +ATOM 18156 C CA . GLY D 1 389 ? 64.520 88.481 77.444 1.00 9.46 ? 409 GLY E CA 1 +ATOM 18157 C C . GLY D 1 389 ? 64.434 88.344 78.952 1.00 9.26 ? 409 GLY E C 1 +ATOM 18158 O O . GLY D 1 389 ? 63.488 88.811 79.557 1.00 9.16 ? 409 GLY E O 1 +ATOM 18159 N N . VAL D 1 390 ? 65.412 87.660 79.544 1.00 8.99 ? 410 VAL E N 1 +ATOM 18160 C CA . VAL D 1 390 ? 65.411 87.346 80.968 1.00 8.53 ? 410 VAL E CA 1 +ATOM 18161 C C . VAL D 1 390 ? 66.703 87.898 81.557 1.00 8.21 ? 410 VAL E C 1 +ATOM 18162 O O . VAL D 1 390 ? 67.717 87.953 80.866 1.00 8.90 ? 410 VAL E O 1 +ATOM 18163 C CB . VAL D 1 390 ? 65.306 85.803 81.205 1.00 7.80 ? 410 VAL E CB 1 +ATOM 18164 C CG1 . VAL D 1 390 ? 66.491 85.042 80.526 1.00 8.36 ? 410 VAL E CG1 1 +ATOM 18165 C CG2 . VAL D 1 390 ? 65.244 85.469 82.688 1.00 9.13 ? 410 VAL E CG2 1 +ATOM 18166 N N . GLY D 1 391 ? 66.661 88.324 82.817 1.00 8.56 ? 411 GLY E N 1 +ATOM 18167 C CA . GLY D 1 391 ? 67.812 88.926 83.480 1.00 8.93 ? 411 GLY E CA 1 +ATOM 18168 C C . GLY D 1 391 ? 68.034 90.407 83.193 1.00 9.37 ? 411 GLY E C 1 +ATOM 18169 O O . GLY D 1 391 ? 69.117 90.937 83.432 1.00 8.31 ? 411 GLY E O 1 +ATOM 18170 N N . LEU D 1 392 ? 67.003 91.072 82.676 1.00 9.95 ? 412 LEU E N 1 +ATOM 18171 C CA . LEU D 1 392 ? 67.077 92.475 82.348 1.00 10.50 ? 412 LEU E CA 1 +ATOM 18172 C C . LEU D 1 392 ? 66.852 93.264 83.642 1.00 10.94 ? 412 LEU E C 1 +ATOM 18173 O O . LEU D 1 392 ? 65.828 93.919 83.809 1.00 10.06 ? 412 LEU E O 1 +ATOM 18174 C CB . LEU D 1 392 ? 66.039 92.837 81.273 1.00 11.01 ? 412 LEU E CB 1 +ATOM 18175 C CG . LEU D 1 392 ? 66.112 92.209 79.872 1.00 11.71 ? 412 LEU E CG 1 +ATOM 18176 C CD1 . LEU D 1 392 ? 64.989 92.760 78.977 1.00 13.96 ? 412 LEU E CD1 1 +ATOM 18177 C CD2 . LEU D 1 392 ? 67.405 92.461 79.203 1.00 15.49 ? 412 LEU E CD2 1 +ATOM 18178 N N . ALA D 1 393 ? 67.817 93.156 84.563 1.00 11.57 ? 413 ALA E N 1 +ATOM 18179 C CA . ALA D 1 393 ? 67.679 93.646 85.941 1.00 12.51 ? 413 ALA E CA 1 +ATOM 18180 C C . ALA D 1 393 ? 68.253 95.037 86.188 1.00 12.93 ? 413 ALA E C 1 +ATOM 18181 O O . ALA D 1 393 ? 67.897 95.677 87.186 1.00 13.34 ? 413 ALA E O 1 +ATOM 18182 C CB . ALA D 1 393 ? 68.338 92.666 86.911 1.00 12.73 ? 413 ALA E CB 1 +ATOM 18183 N N . LEU D 1 394 ? 69.150 95.488 85.307 1.00 13.54 ? 414 LEU E N 1 +ATOM 18184 C CA . LEU D 1 394 ? 69.865 96.764 85.472 1.00 13.87 ? 414 LEU E CA 1 +ATOM 18185 C C . LEU D 1 394 ? 69.396 97.849 84.498 1.00 13.99 ? 414 LEU E C 1 +ATOM 18186 O O . LEU D 1 394 ? 69.076 97.554 83.350 1.00 13.59 ? 414 LEU E O 1 +ATOM 18187 C CB . LEU D 1 394 ? 71.371 96.557 85.272 1.00 13.83 ? 414 LEU E CB 1 +ATOM 18188 C CG . LEU D 1 394 ? 72.069 95.542 86.167 1.00 14.01 ? 414 LEU E CG 1 +ATOM 18189 C CD1 . LEU D 1 394 ? 73.552 95.488 85.847 1.00 13.53 ? 414 LEU E CD1 1 +ATOM 18190 C CD2 . LEU D 1 394 ? 71.823 95.871 87.646 1.00 14.93 ? 414 LEU E CD2 1 +ATOM 18191 N N . PRO D 1 395 ? 69.366 99.120 84.953 1.00 14.72 ? 415 PRO E N 1 +ATOM 18192 C CA . PRO D 1 395 ? 69.021 100.242 84.070 1.00 14.88 ? 415 PRO E CA 1 +ATOM 18193 C C . PRO D 1 395 ? 69.811 100.281 82.747 1.00 14.58 ? 415 PRO E C 1 +ATOM 18194 O O . PRO D 1 395 ? 69.241 100.614 81.712 1.00 14.96 ? 415 PRO E O 1 +ATOM 18195 C CB . PRO D 1 395 ? 69.354 101.480 84.915 1.00 14.97 ? 415 PRO E CB 1 +ATOM 18196 C CG . PRO D 1 395 ? 69.319 101.021 86.317 1.00 15.32 ? 415 PRO E CG 1 +ATOM 18197 C CD . PRO D 1 395 ? 69.644 99.562 86.331 1.00 14.87 ? 415 PRO E CD 1 +ATOM 18198 N N . GLN D 1 396 ? 71.096 99.917 82.774 1.00 14.77 ? 416 GLN E N 1 +ATOM 18199 C CA . GLN D 1 396 ? 71.935 99.973 81.567 1.00 14.67 ? 416 GLN E CA 1 +ATOM 18200 C C . GLN D 1 396 ? 71.515 99.007 80.450 1.00 14.76 ? 416 GLN E C 1 +ATOM 18201 O O . GLN D 1 396 ? 71.907 99.179 79.300 1.00 15.24 ? 416 GLN E O 1 +ATOM 18202 C CB . GLN D 1 396 ? 73.423 99.791 81.911 1.00 14.75 ? 416 GLN E CB 1 +ATOM 18203 C CG . GLN D 1 396 ? 73.908 98.361 82.025 1.00 14.89 ? 416 GLN E CG 1 +ATOM 18204 C CD . GLN D 1 396 ? 75.314 98.265 82.584 1.00 14.95 ? 416 GLN E CD 1 +ATOM 18205 O OE1 . GLN D 1 396 ? 76.296 98.221 81.832 1.00 18.58 ? 416 GLN E OE1 1 +ATOM 18206 N NE2 . GLN D 1 396 ? 75.423 98.253 83.905 1.00 13.58 ? 416 GLN E NE2 1 +ATOM 18207 N N . PHE D 1 397 ? 70.716 98.000 80.794 1.00 14.01 ? 417 PHE E N 1 +ATOM 18208 C CA . PHE D 1 397 ? 70.201 97.042 79.815 1.00 14.09 ? 417 PHE E CA 1 +ATOM 18209 C C . PHE D 1 397 ? 69.034 97.579 78.991 1.00 14.38 ? 417 PHE E C 1 +ATOM 18210 O O . PHE D 1 397 ? 68.619 96.927 78.016 1.00 14.79 ? 417 PHE E O 1 +ATOM 18211 C CB . PHE D 1 397 ? 69.745 95.753 80.516 1.00 13.11 ? 417 PHE E CB 1 +ATOM 18212 C CG . PHE D 1 397 ? 70.833 95.026 81.266 1.00 13.13 ? 417 PHE E CG 1 +ATOM 18213 C CD1 . PHE D 1 397 ? 72.182 95.202 80.970 1.00 12.05 ? 417 PHE E CD1 1 +ATOM 18214 C CD2 . PHE D 1 397 ? 70.493 94.120 82.265 1.00 11.91 ? 417 PHE E CD2 1 +ATOM 18215 C CE1 . PHE D 1 397 ? 73.153 94.512 81.672 1.00 11.95 ? 417 PHE E CE1 1 +ATOM 18216 C CE2 . PHE D 1 397 ? 71.461 93.422 82.961 1.00 12.28 ? 417 PHE E CE2 1 +ATOM 18217 C CZ . PHE D 1 397 ? 72.793 93.616 82.669 1.00 13.29 ? 417 PHE E CZ 1 +ATOM 18218 N N . PHE D 1 398 ? 68.503 98.744 79.367 1.00 15.50 ? 418 PHE E N 1 +ATOM 18219 C CA . PHE D 1 398 ? 67.395 99.372 78.640 1.00 16.71 ? 418 PHE E CA 1 +ATOM 18220 C C . PHE D 1 398 ? 67.885 100.591 77.873 1.00 18.25 ? 418 PHE E C 1 +ATOM 18221 O O . PHE D 1 398 ? 67.754 101.735 78.316 1.00 19.41 ? 418 PHE E O 1 +ATOM 18222 C CB . PHE D 1 398 ? 66.261 99.726 79.599 1.00 16.13 ? 418 PHE E CB 1 +ATOM 18223 C CG . PHE D 1 398 ? 65.731 98.538 80.339 1.00 15.61 ? 418 PHE E CG 1 +ATOM 18224 C CD1 . PHE D 1 398 ? 64.775 97.712 79.759 1.00 14.95 ? 418 PHE E CD1 1 +ATOM 18225 C CD2 . PHE D 1 398 ? 66.212 98.221 81.595 1.00 15.33 ? 418 PHE E CD2 1 +ATOM 18226 C CE1 . PHE D 1 398 ? 64.293 96.592 80.440 1.00 14.87 ? 418 PHE E CE1 1 +ATOM 18227 C CE2 . PHE D 1 398 ? 65.744 97.104 82.276 1.00 15.57 ? 418 PHE E CE2 1 +ATOM 18228 C CZ . PHE D 1 398 ? 64.783 96.296 81.702 1.00 14.85 ? 418 PHE E CZ 1 +ATOM 18229 N N . ASN D 1 399 ? 68.462 100.307 76.714 1.00 20.03 ? 419 ASN E N 1 +ATOM 18230 C CA . ASN D 1 399 ? 68.962 101.325 75.798 1.00 20.86 ? 419 ASN E CA 1 +ATOM 18231 C C . ASN D 1 399 ? 68.430 101.030 74.407 1.00 21.21 ? 419 ASN E C 1 +ATOM 18232 O O . ASN D 1 399 ? 67.877 99.952 74.157 1.00 20.84 ? 419 ASN E O 1 +ATOM 18233 C CB . ASN D 1 399 ? 70.491 101.333 75.804 1.00 21.45 ? 419 ASN E CB 1 +ATOM 18234 C CG . ASN D 1 399 ? 71.088 99.951 75.609 1.00 23.18 ? 419 ASN E CG 1 +ATOM 18235 O OD1 . ASN D 1 399 ? 71.322 99.514 74.484 1.00 25.83 ? 419 ASN E OD1 1 +ATOM 18236 N ND2 . ASN D 1 399 ? 71.348 99.253 76.713 1.00 27.24 ? 419 ASN E ND2 1 +ATOM 18237 N N . ASN D 1 400 ? 68.609 101.985 73.497 1.00 21.39 ? 420 ASN E N 1 +ATOM 18238 C CA . ASN D 1 400 ? 68.130 101.846 72.118 1.00 21.62 ? 420 ASN E CA 1 +ATOM 18239 C C . ASN D 1 400 ? 68.804 100.684 71.388 1.00 20.87 ? 420 ASN E C 1 +ATOM 18240 O O . ASN D 1 400 ? 68.191 100.034 70.526 1.00 20.56 ? 420 ASN E O 1 +ATOM 18241 C CB . ASN D 1 400 ? 68.361 103.151 71.341 1.00 22.15 ? 420 ASN E CB 1 +ATOM 18242 C CG . ASN D 1 400 ? 67.459 103.283 70.119 1.00 23.92 ? 420 ASN E CG 1 +ATOM 18243 O OD1 . ASN D 1 400 ? 66.267 102.978 70.170 1.00 27.67 ? 420 ASN E OD1 1 +ATOM 18244 N ND2 . ASN D 1 400 ? 68.025 103.772 69.016 1.00 27.36 ? 420 ASN E ND2 1 +ATOM 18245 N N . VAL D 1 401 ? 70.064 100.427 71.730 1.00 19.87 ? 421 VAL E N 1 +ATOM 18246 C CA . VAL D 1 401 ? 70.822 99.352 71.115 1.00 19.20 ? 421 VAL E CA 1 +ATOM 18247 C C . VAL D 1 401 ? 70.262 97.999 71.551 1.00 18.31 ? 421 VAL E C 1 +ATOM 18248 O O . VAL D 1 401 ? 70.020 97.128 70.723 1.00 17.44 ? 421 VAL E O 1 +ATOM 18249 C CB . VAL D 1 401 ? 72.330 99.465 71.439 1.00 19.27 ? 421 VAL E CB 1 +ATOM 18250 C CG1 . VAL D 1 401 ? 73.099 98.322 70.816 1.00 20.34 ? 421 VAL E CG1 1 +ATOM 18251 C CG2 . VAL D 1 401 ? 72.871 100.815 70.946 1.00 19.86 ? 421 VAL E CG2 1 +ATOM 18252 N N . SER D 1 402 ? 70.017 97.843 72.847 1.00 17.51 ? 422 SER E N 1 +ATOM 18253 C CA . SER D 1 402 ? 69.434 96.596 73.347 1.00 17.31 ? 422 SER E CA 1 +ATOM 18254 C C . SER D 1 402 ? 68.023 96.408 72.799 1.00 16.76 ? 422 SER E C 1 +ATOM 18255 O O . SER D 1 402 ? 67.605 95.285 72.530 1.00 16.73 ? 422 SER E O 1 +ATOM 18256 C CB . SER D 1 402 ? 69.423 96.568 74.870 1.00 17.01 ? 422 SER E CB 1 +ATOM 18257 O OG . SER D 1 402 ? 70.733 96.320 75.343 1.00 17.77 ? 422 SER E OG 1 +ATOM 18258 N N . LEU D 1 403 ? 67.303 97.513 72.637 1.00 16.74 ? 423 LEU E N 1 +ATOM 18259 C CA . LEU D 1 403 ? 65.918 97.467 72.169 1.00 16.44 ? 423 LEU E CA 1 +ATOM 18260 C C . LEU D 1 403 ? 65.874 96.948 70.735 1.00 16.51 ? 423 LEU E C 1 +ATOM 18261 O O . LEU D 1 403 ? 65.105 96.043 70.420 1.00 15.95 ? 423 LEU E O 1 +ATOM 18262 C CB . LEU D 1 403 ? 65.261 98.848 72.283 1.00 16.90 ? 423 LEU E CB 1 +ATOM 18263 C CG . LEU D 1 403 ? 63.805 99.030 71.846 1.00 16.85 ? 423 LEU E CG 1 +ATOM 18264 C CD1 . LEU D 1 403 ? 62.861 98.007 72.491 1.00 16.64 ? 423 LEU E CD1 1 +ATOM 18265 C CD2 . LEU D 1 403 ? 63.341 100.438 72.159 1.00 17.43 ? 423 LEU E CD2 1 +ATOM 18266 N N . HIS D 1 404 ? 66.707 97.515 69.864 1.00 16.48 ? 424 HIS E N 1 +ATOM 18267 C CA . HIS D 1 404 ? 66.791 97.047 68.482 1.00 16.86 ? 424 HIS E CA 1 +ATOM 18268 C C . HIS D 1 404 ? 67.141 95.560 68.411 1.00 15.80 ? 424 HIS E C 1 +ATOM 18269 O O . HIS D 1 404 ? 66.564 94.817 67.621 1.00 15.13 ? 424 HIS E O 1 +ATOM 18270 C CB . HIS D 1 404 ? 67.802 97.886 67.698 1.00 17.79 ? 424 HIS E CB 1 +ATOM 18271 C CG . HIS D 1 404 ? 67.887 97.535 66.246 1.00 20.21 ? 424 HIS E CG 1 +ATOM 18272 N ND1 . HIS D 1 404 ? 68.903 96.757 65.729 1.00 24.01 ? 424 HIS E ND1 1 +ATOM 18273 C CD2 . HIS D 1 404 ? 67.097 97.869 65.200 1.00 22.92 ? 424 HIS E CD2 1 +ATOM 18274 C CE1 . HIS D 1 404 ? 68.726 96.622 64.425 1.00 23.75 ? 424 HIS E CE1 1 +ATOM 18275 N NE2 . HIS D 1 404 ? 67.638 97.287 64.080 1.00 23.71 ? 424 HIS E NE2 1 +ATOM 18276 N N . HIS D 1 405 ? 68.090 95.134 69.235 1.00 14.72 ? 425 HIS E N 1 +ATOM 18277 C CA . HIS D 1 405 ? 68.494 93.746 69.260 1.00 14.51 ? 425 HIS E CA 1 +ATOM 18278 C C . HIS D 1 405 ? 67.340 92.824 69.685 1.00 13.57 ? 425 HIS E C 1 +ATOM 18279 O O . HIS D 1 405 ? 67.118 91.776 69.083 1.00 13.41 ? 425 HIS E O 1 +ATOM 18280 C CB . HIS D 1 405 ? 69.680 93.562 70.189 1.00 14.87 ? 425 HIS E CB 1 +ATOM 18281 C CG . HIS D 1 405 ? 70.077 92.137 70.344 1.00 16.24 ? 425 HIS E CG 1 +ATOM 18282 N ND1 . HIS D 1 405 ? 69.768 91.399 71.464 1.00 17.24 ? 425 HIS E ND1 1 +ATOM 18283 C CD2 . HIS D 1 405 ? 70.693 91.289 69.489 1.00 17.85 ? 425 HIS E CD2 1 +ATOM 18284 C CE1 . HIS D 1 405 ? 70.215 90.166 71.308 1.00 17.79 ? 425 HIS E CE1 1 +ATOM 18285 N NE2 . HIS D 1 405 ? 70.765 90.069 70.113 1.00 16.97 ? 425 HIS E NE2 1 +ATOM 18286 N N . HIS D 1 406 ? 66.612 93.239 70.711 1.00 12.94 ? 426 HIS E N 1 +ATOM 18287 C CA . HIS D 1 406 ? 65.465 92.480 71.227 1.00 12.55 ? 426 HIS E CA 1 +ATOM 18288 C C . HIS D 1 406 ? 64.384 92.346 70.154 1.00 13.15 ? 426 HIS E C 1 +ATOM 18289 O O . HIS D 1 406 ? 63.756 91.295 70.009 1.00 12.63 ? 426 HIS E O 1 +ATOM 18290 C CB . HIS D 1 406 ? 64.916 93.177 72.476 1.00 12.30 ? 426 HIS E CB 1 +ATOM 18291 C CG . HIS D 1 406 ? 64.118 92.296 73.394 1.00 11.51 ? 426 HIS E CG 1 +ATOM 18292 N ND1 . HIS D 1 406 ? 64.171 92.424 74.765 1.00 11.51 ? 426 HIS E ND1 1 +ATOM 18293 C CD2 . HIS D 1 406 ? 63.227 91.307 73.146 1.00 11.49 ? 426 HIS E CD2 1 +ATOM 18294 C CE1 . HIS D 1 406 ? 63.346 91.554 75.324 1.00 12.26 ? 426 HIS E CE1 1 +ATOM 18295 N NE2 . HIS D 1 406 ? 62.770 90.854 74.364 1.00 11.30 ? 426 HIS E NE2 1 +ATOM 18296 N N . MET D 1 407 ? 64.171 93.416 69.393 1.00 14.08 ? 427 MET E N 1 +ATOM 18297 C CA . MET D 1 407 ? 63.186 93.385 68.316 1.00 15.23 ? 427 MET E CA 1 +ATOM 18298 C C . MET D 1 407 ? 63.574 92.363 67.258 1.00 13.98 ? 427 MET E C 1 +ATOM 18299 O O . MET D 1 407 ? 62.731 91.630 66.768 1.00 13.92 ? 427 MET E O 1 +ATOM 18300 C CB . MET D 1 407 ? 63.022 94.782 67.705 1.00 15.15 ? 427 MET E CB 1 +ATOM 18301 C CG . MET D 1 407 ? 62.352 95.753 68.660 1.00 16.67 ? 427 MET E CG 1 +ATOM 18302 S SD . MET D 1 407 ? 62.182 97.467 68.069 1.00 20.84 ? 427 MET E SD 1 +ATOM 18303 C CE . MET D 1 407 ? 63.791 98.176 68.293 1.00 22.39 ? 427 MET E CE 1 +ATOM 18304 N N . GLN D 1 408 ? 64.858 92.298 66.923 1.00 13.93 ? 428 GLN E N 1 +ATOM 18305 C CA . GLN D 1 408 ? 65.338 91.331 65.930 1.00 14.14 ? 428 GLN E CA 1 +ATOM 18306 C C . GLN D 1 408 ? 65.209 89.892 66.423 1.00 13.36 ? 428 GLN E C 1 +ATOM 18307 O O . GLN D 1 408 ? 64.852 88.997 65.661 1.00 12.83 ? 428 GLN E O 1 +ATOM 18308 C CB . GLN D 1 408 ? 66.793 91.620 65.573 1.00 14.64 ? 428 GLN E CB 1 +ATOM 18309 C CG . GLN D 1 408 ? 66.993 92.975 64.883 1.00 17.41 ? 428 GLN E CG 1 +ATOM 18310 C CD . GLN D 1 408 ? 68.454 93.343 64.752 1.00 20.99 ? 428 GLN E CD 1 +ATOM 18311 O OE1 . GLN D 1 408 ? 69.170 93.435 65.749 1.00 25.38 ? 428 GLN E OE1 1 +ATOM 18312 N NE2 . GLN D 1 408 ? 68.908 93.562 63.518 1.00 24.14 ? 428 GLN E NE2 1 +ATOM 18313 N N . VAL D 1 409 ? 65.528 89.674 67.694 1.00 13.20 ? 429 VAL E N 1 +ATOM 18314 C CA . VAL D 1 409 ? 65.352 88.352 68.299 1.00 12.73 ? 429 VAL E CA 1 +ATOM 18315 C C . VAL D 1 409 ? 63.883 87.916 68.267 1.00 12.96 ? 429 VAL E C 1 +ATOM 18316 O O . VAL D 1 409 ? 63.576 86.763 67.927 1.00 11.63 ? 429 VAL E O 1 +ATOM 18317 C CB . VAL D 1 409 ? 65.923 88.304 69.724 1.00 12.80 ? 429 VAL E CB 1 +ATOM 18318 C CG1 . VAL D 1 409 ? 65.522 87.007 70.424 1.00 13.63 ? 429 VAL E CG1 1 +ATOM 18319 C CG2 . VAL D 1 409 ? 67.417 88.446 69.671 1.00 13.13 ? 429 VAL E CG2 1 +ATOM 18320 N N . MET D 1 410 ? 62.972 88.828 68.595 1.00 13.08 ? 430 MET E N 1 +ATOM 18321 C CA . MET D 1 410 ? 61.539 88.519 68.487 1.00 13.64 ? 430 MET E CA 1 +ATOM 18322 C C . MET D 1 410 ? 61.156 88.196 67.042 1.00 13.83 ? 430 MET E C 1 +ATOM 18323 O O . MET D 1 410 ? 60.336 87.316 66.812 1.00 14.43 ? 430 MET E O 1 +ATOM 18324 C CB . MET D 1 410 ? 60.669 89.664 69.035 1.00 14.10 ? 430 MET E CB 1 +ATOM 18325 C CG . MET D 1 410 ? 60.448 89.630 70.545 1.00 14.67 ? 430 MET E CG 1 +ATOM 18326 S SD . MET D 1 410 ? 59.958 88.018 71.236 1.00 14.67 ? 430 MET E SD 1 +ATOM 18327 C CE . MET D 1 410 ? 58.447 87.651 70.366 1.00 17.34 ? 430 MET E CE 1 +ATOM 18328 N N . GLU D 1 411 ? 61.759 88.881 66.068 1.00 13.59 ? 431 GLU E N 1 +ATOM 18329 C CA . GLU D 1 411 ? 61.536 88.527 64.660 1.00 13.52 ? 431 GLU E CA 1 +ATOM 18330 C C . GLU D 1 411 ? 61.926 87.073 64.378 1.00 12.88 ? 431 GLU E C 1 +ATOM 18331 O O . GLU D 1 411 ? 61.175 86.329 63.736 1.00 12.42 ? 431 GLU E O 1 +ATOM 18332 C CB . GLU D 1 411 ? 62.299 89.453 63.715 1.00 14.14 ? 431 GLU E CB 1 +ATOM 18333 C CG . GLU D 1 411 ? 61.815 90.870 63.717 1.00 15.77 ? 431 GLU E CG 1 +ATOM 18334 C CD . GLU D 1 411 ? 62.688 91.803 62.907 1.00 18.54 ? 431 GLU E CD 1 +ATOM 18335 O OE1 . GLU D 1 411 ? 63.776 91.381 62.421 1.00 19.86 ? 431 GLU E OE1 1 +ATOM 18336 O OE2 . GLU D 1 411 ? 62.280 92.968 62.762 1.00 19.03 ? 431 GLU E OE2 1 +ATOM 18337 N N . GLU D 1 412 ? 63.104 86.672 64.855 1.00 11.69 ? 432 GLU E N 1 +ATOM 18338 C CA . GLU D 1 412 ? 63.577 85.291 64.684 1.00 11.45 ? 432 GLU E CA 1 +ATOM 18339 C C . GLU D 1 412 ? 62.664 84.269 65.352 1.00 10.95 ? 432 GLU E C 1 +ATOM 18340 O O . GLU D 1 412 ? 62.372 83.208 64.777 1.00 10.20 ? 432 GLU E O 1 +ATOM 18341 C CB . GLU D 1 412 ? 64.980 85.155 65.277 1.00 11.44 ? 432 GLU E CB 1 +ATOM 18342 C CG . GLU D 1 412 ? 66.063 85.722 64.427 1.00 13.17 ? 432 GLU E CG 1 +ATOM 18343 C CD . GLU D 1 412 ? 67.442 85.437 65.018 1.00 13.89 ? 432 GLU E CD 1 +ATOM 18344 O OE1 . GLU D 1 412 ? 68.032 84.373 64.724 1.00 12.25 ? 432 GLU E OE1 1 +ATOM 18345 O OE2 . GLU D 1 412 ? 67.922 86.301 65.773 1.00 15.18 ? 432 GLU E OE2 1 +ATOM 18346 N N . VAL D 1 413 ? 62.233 84.591 66.571 1.00 10.66 ? 433 VAL E N 1 +ATOM 18347 C CA . VAL D 1 413 ? 61.350 83.717 67.346 1.00 10.39 ? 433 VAL E CA 1 +ATOM 18348 C C . VAL D 1 413 ? 60.052 83.481 66.574 1.00 10.07 ? 433 VAL E C 1 +ATOM 18349 O O . VAL D 1 413 ? 59.637 82.339 66.354 1.00 9.67 ? 433 VAL E O 1 +ATOM 18350 C CB . VAL D 1 413 ? 61.028 84.321 68.722 1.00 10.27 ? 433 VAL E CB 1 +ATOM 18351 C CG1 . VAL D 1 413 ? 59.989 83.482 69.470 1.00 9.91 ? 433 VAL E CG1 1 +ATOM 18352 C CG2 . VAL D 1 413 ? 62.304 84.422 69.570 1.00 11.49 ? 433 VAL E CG2 1 +ATOM 18353 N N . VAL D 1 414 ? 59.431 84.576 66.144 1.00 9.93 ? 434 VAL E N 1 +ATOM 18354 C CA . VAL D 1 414 ? 58.172 84.486 65.407 1.00 9.48 ? 434 VAL E CA 1 +ATOM 18355 C C . VAL D 1 414 ? 58.356 83.762 64.068 1.00 8.96 ? 434 VAL E C 1 +ATOM 18356 O O . VAL D 1 414 ? 57.557 82.881 63.708 1.00 8.55 ? 434 VAL E O 1 +ATOM 18357 C CB . VAL D 1 414 ? 57.539 85.864 65.205 1.00 9.68 ? 434 VAL E CB 1 +ATOM 18358 C CG1 . VAL D 1 414 ? 56.312 85.757 64.282 1.00 10.30 ? 434 VAL E CG1 1 +ATOM 18359 C CG2 . VAL D 1 414 ? 57.162 86.478 66.561 1.00 10.63 ? 434 VAL E CG2 1 +ATOM 18360 N N . ARG D 1 415 ? 59.426 84.095 63.347 1.00 9.05 ? 435 ARG E N 1 +ATOM 18361 C CA . ARG D 1 415 ? 59.707 83.434 62.083 1.00 8.96 ? 435 ARG E CA 1 +ATOM 18362 C C . ARG D 1 415 ? 59.773 81.908 62.256 1.00 8.69 ? 435 ARG E C 1 +ATOM 18363 O O . ARG D 1 415 ? 59.229 81.155 61.456 1.00 8.26 ? 435 ARG E O 1 +ATOM 18364 C CB . ARG D 1 415 ? 61.015 83.946 61.484 1.00 8.84 ? 435 ARG E CB 1 +ATOM 18365 C CG . ARG D 1 415 ? 61.438 83.177 60.260 1.00 9.52 ? 435 ARG E CG 1 +ATOM 18366 C CD . ARG D 1 415 ? 62.670 83.744 59.613 1.00 11.00 ? 435 ARG E CD 1 +ATOM 18367 N NE . ARG D 1 415 ? 63.880 83.646 60.438 1.00 11.49 ? 435 ARG E NE 1 +ATOM 18368 C CZ . ARG D 1 415 ? 65.093 83.951 59.985 1.00 12.26 ? 435 ARG E CZ 1 +ATOM 18369 N NH1 . ARG D 1 415 ? 65.256 84.377 58.731 1.00 10.87 ? 435 ARG E NH1 1 +ATOM 18370 N NH2 . ARG D 1 415 ? 66.149 83.842 60.781 1.00 13.78 ? 435 ARG E NH2 1 +ATOM 18371 N N . ARG D 1 416 ? 60.464 81.456 63.302 1.00 8.63 ? 436 ARG E N 1 +ATOM 18372 C CA . ARG D 1 416 ? 60.618 80.030 63.530 1.00 8.96 ? 436 ARG E CA 1 +ATOM 18373 C C . ARG D 1 416 ? 59.302 79.351 63.895 1.00 9.01 ? 436 ARG E C 1 +ATOM 18374 O O . ARG D 1 416 ? 58.992 78.308 63.358 1.00 9.83 ? 436 ARG E O 1 +ATOM 18375 C CB . ARG D 1 416 ? 61.652 79.770 64.629 1.00 9.11 ? 436 ARG E CB 1 +ATOM 18376 C CG . ARG D 1 416 ? 62.236 78.386 64.557 1.00 8.55 ? 436 ARG E CG 1 +ATOM 18377 C CD . ARG D 1 416 ? 63.067 78.026 65.773 1.00 9.43 ? 436 ARG E CD 1 +ATOM 18378 N NE . ARG D 1 416 ? 62.211 77.913 66.953 1.00 9.38 ? 436 ARG E NE 1 +ATOM 18379 C CZ . ARG D 1 416 ? 62.586 77.358 68.098 1.00 8.52 ? 436 ARG E CZ 1 +ATOM 18380 N NH1 . ARG D 1 416 ? 63.816 76.872 68.254 1.00 7.76 ? 436 ARG E NH1 1 +ATOM 18381 N NH2 . ARG D 1 416 ? 61.720 77.325 69.101 1.00 8.20 ? 436 ARG E NH2 1 +ATOM 18382 N N . ASP D 1 417 ? 58.528 79.961 64.785 1.00 9.14 ? 437 ASP E N 1 +ATOM 18383 C CA . ASP D 1 417 ? 57.439 79.258 65.485 1.00 9.07 ? 437 ASP E CA 1 +ATOM 18384 C C . ASP D 1 417 ? 56.030 79.693 65.107 1.00 9.30 ? 437 ASP E C 1 +ATOM 18385 O O . ASP D 1 417 ? 55.073 79.154 65.648 1.00 9.09 ? 437 ASP E O 1 +ATOM 18386 C CB . ASP D 1 417 ? 57.626 79.442 67.001 1.00 9.22 ? 437 ASP E CB 1 +ATOM 18387 C CG . ASP D 1 417 ? 58.844 78.718 67.511 1.00 9.20 ? 437 ASP E CG 1 +ATOM 18388 O OD1 . ASP D 1 417 ? 59.429 77.983 66.702 1.00 9.80 ? 437 ASP E OD1 1 +ATOM 18389 O OD2 . ASP D 1 417 ? 59.221 78.872 68.695 1.00 11.40 ? 437 ASP E OD2 1 +ATOM 18390 N N . LYS D 1 418 ? 55.924 80.660 64.191 1.00 9.40 ? 438 LYS E N 1 +ATOM 18391 C CA . LYS D 1 418 ? 54.632 81.230 63.768 1.00 10.17 ? 438 LYS E CA 1 +ATOM 18392 C C . LYS D 1 418 ? 53.578 80.219 63.312 1.00 9.96 ? 438 LYS E C 1 +ATOM 18393 O O . LYS D 1 418 ? 52.381 80.512 63.332 1.00 10.23 ? 438 LYS E O 1 +ATOM 18394 C CB . LYS D 1 418 ? 54.838 82.218 62.616 1.00 10.44 ? 438 LYS E CB 1 +ATOM 18395 C CG . LYS D 1 418 ? 55.398 81.572 61.340 1.00 11.41 ? 438 LYS E CG 1 +ATOM 18396 C CD . LYS D 1 418 ? 55.713 82.577 60.244 1.00 11.57 ? 438 LYS E CD 1 +ATOM 18397 C CE . LYS D 1 418 ? 56.594 81.939 59.186 1.00 12.27 ? 438 LYS E CE 1 +ATOM 18398 N NZ . LYS D 1 418 ? 56.766 82.798 57.972 1.00 16.32 ? 438 LYS E NZ 1 +ATOM 18399 N N . ASN D 1 419 ? 54.000 79.057 62.841 1.00 10.30 ? 439 ASN E N 1 +ATOM 18400 C CA . ASN D 1 419 ? 53.058 78.103 62.282 1.00 10.34 ? 439 ASN E CA 1 +ATOM 18401 C C . ASN D 1 419 ? 52.626 76.988 63.255 1.00 10.86 ? 439 ASN E C 1 +ATOM 18402 O O . ASN D 1 419 ? 51.905 76.076 62.855 1.00 10.63 ? 439 ASN E O 1 +ATOM 18403 C CB . ASN D 1 419 ? 53.640 77.522 60.981 1.00 10.75 ? 439 ASN E CB 1 +ATOM 18404 C CG . ASN D 1 419 ? 53.719 78.554 59.867 1.00 11.04 ? 439 ASN E CG 1 +ATOM 18405 O OD1 . ASN D 1 419 ? 52.814 79.383 59.714 1.00 10.10 ? 439 ASN E OD1 1 +ATOM 18406 N ND2 . ASN D 1 419 ? 54.798 78.511 59.085 1.00 12.33 ? 439 ASN E ND2 1 +ATOM 18407 N N . HIS D 1 420 ? 53.072 77.043 64.516 1.00 10.18 ? 440 HIS E N 1 +ATOM 18408 C CA . HIS D 1 420 ? 52.735 75.992 65.486 1.00 9.71 ? 440 HIS E CA 1 +ATOM 18409 C C . HIS D 1 420 ? 51.388 76.265 66.138 1.00 9.47 ? 440 HIS E C 1 +ATOM 18410 O O . HIS D 1 420 ? 51.283 77.225 66.886 1.00 8.50 ? 440 HIS E O 1 +ATOM 18411 C CB . HIS D 1 420 ? 53.778 75.919 66.609 1.00 9.87 ? 440 HIS E CB 1 +ATOM 18412 C CG . HIS D 1 420 ? 55.084 75.364 66.174 1.00 9.37 ? 440 HIS E CG 1 +ATOM 18413 N ND1 . HIS D 1 420 ? 55.218 74.089 65.674 1.00 10.43 ? 440 HIS E ND1 1 +ATOM 18414 C CD2 . HIS D 1 420 ? 56.324 75.897 66.192 1.00 10.92 ? 440 HIS E CD2 1 +ATOM 18415 C CE1 . HIS D 1 420 ? 56.486 73.872 65.372 1.00 11.07 ? 440 HIS E CE1 1 +ATOM 18416 N NE2 . HIS D 1 420 ? 57.178 74.952 65.681 1.00 11.38 ? 440 HIS E NE2 1 +ATOM 18417 N N . PRO D 1 421 ? 50.377 75.402 65.888 1.00 9.17 ? 441 PRO E N 1 +ATOM 18418 C CA . PRO D 1 421 ? 49.091 75.605 66.546 1.00 9.07 ? 441 PRO E CA 1 +ATOM 18419 C C . PRO D 1 421 ? 49.198 75.598 68.053 1.00 8.74 ? 441 PRO E C 1 +ATOM 18420 O O . PRO D 1 421 ? 48.448 76.316 68.721 1.00 9.05 ? 441 PRO E O 1 +ATOM 18421 C CB . PRO D 1 421 ? 48.247 74.406 66.071 1.00 9.27 ? 441 PRO E CB 1 +ATOM 18422 C CG . PRO D 1 421 ? 49.221 73.413 65.580 1.00 9.07 ? 441 PRO E CG 1 +ATOM 18423 C CD . PRO D 1 421 ? 50.345 74.213 65.016 1.00 9.39 ? 441 PRO E CD 1 +ATOM 18424 N N . ALA D 1 422 ? 50.135 74.821 68.605 1.00 8.00 ? 442 ALA E N 1 +ATOM 18425 C CA . ALA D 1 422 ? 50.269 74.766 70.066 1.00 7.56 ? 442 ALA E CA 1 +ATOM 18426 C C . ALA D 1 422 ? 50.701 76.090 70.697 1.00 7.73 ? 442 ALA E C 1 +ATOM 18427 O O . ALA D 1 422 ? 50.370 76.357 71.848 1.00 7.96 ? 442 ALA E O 1 +ATOM 18428 C CB . ALA D 1 422 ? 51.198 73.611 70.495 1.00 7.17 ? 442 ALA E CB 1 +ATOM 18429 N N . VAL D 1 423 ? 51.433 76.925 69.961 1.00 8.14 ? 443 VAL E N 1 +ATOM 18430 C CA . VAL D 1 423 ? 51.857 78.219 70.490 1.00 8.66 ? 443 VAL E CA 1 +ATOM 18431 C C . VAL D 1 423 ? 50.640 79.108 70.488 1.00 8.73 ? 443 VAL E C 1 +ATOM 18432 O O . VAL D 1 423 ? 50.072 79.352 69.423 1.00 8.94 ? 443 VAL E O 1 +ATOM 18433 C CB . VAL D 1 423 ? 52.978 78.857 69.661 1.00 8.60 ? 443 VAL E CB 1 +ATOM 18434 C CG1 . VAL D 1 423 ? 53.239 80.301 70.099 1.00 8.78 ? 443 VAL E CG1 1 +ATOM 18435 C CG2 . VAL D 1 423 ? 54.258 78.044 69.777 1.00 7.26 ? 443 VAL E CG2 1 +ATOM 18436 N N . VAL D 1 424 ? 50.225 79.554 71.677 1.00 9.08 ? 444 VAL E N 1 +ATOM 18437 C CA . VAL D 1 424 ? 49.011 80.376 71.835 1.00 8.76 ? 444 VAL E CA 1 +ATOM 18438 C C . VAL D 1 424 ? 49.271 81.803 72.341 1.00 9.17 ? 444 VAL E C 1 +ATOM 18439 O O . VAL D 1 424 ? 48.343 82.610 72.411 1.00 9.73 ? 444 VAL E O 1 +ATOM 18440 C CB . VAL D 1 424 ? 47.976 79.694 72.769 1.00 8.56 ? 444 VAL E CB 1 +ATOM 18441 C CG1 . VAL D 1 424 ? 47.594 78.297 72.231 1.00 9.02 ? 444 VAL E CG1 1 +ATOM 18442 C CG2 . VAL D 1 424 ? 48.486 79.610 74.200 1.00 8.03 ? 444 VAL E CG2 1 +ATOM 18443 N N . MET D 1 425 ? 50.522 82.134 72.663 1.00 9.00 ? 445 MET E N 1 +ATOM 18444 C CA . MET D 1 425 ? 50.865 83.442 73.197 1.00 8.81 ? 445 MET E CA 1 +ATOM 18445 C C . MET D 1 425 ? 52.372 83.623 73.159 1.00 8.74 ? 445 MET E C 1 +ATOM 18446 O O . MET D 1 425 ? 53.103 82.670 73.399 1.00 9.45 ? 445 MET E O 1 +ATOM 18447 C CB . MET D 1 425 ? 50.409 83.586 74.642 1.00 8.66 ? 445 MET E CB 1 +ATOM 18448 C CG . MET D 1 425 ? 50.688 84.981 75.211 1.00 8.62 ? 445 MET E CG 1 +ATOM 18449 S SD . MET D 1 425 ? 49.512 85.512 76.467 1.00 10.30 ? 445 MET E SD 1 +ATOM 18450 C CE . MET D 1 425 ? 49.775 84.239 77.707 1.00 11.26 ? 445 MET E CE 1 +ATOM 18451 N N . TRP D 1 426 ? 52.819 84.824 72.807 1.00 8.21 ? 446 TRP E N 1 +ATOM 18452 C CA . TRP D 1 426 ? 54.245 85.157 72.853 1.00 8.32 ? 446 TRP E CA 1 +ATOM 18453 C C . TRP D 1 426 ? 54.535 85.853 74.171 1.00 8.42 ? 446 TRP E C 1 +ATOM 18454 O O . TRP D 1 426 ? 53.751 86.687 74.613 1.00 8.28 ? 446 TRP E O 1 +ATOM 18455 C CB . TRP D 1 426 ? 54.654 86.111 71.725 1.00 8.73 ? 446 TRP E CB 1 +ATOM 18456 C CG . TRP D 1 426 ? 54.274 85.675 70.361 1.00 8.79 ? 446 TRP E CG 1 +ATOM 18457 C CD1 . TRP D 1 426 ? 53.297 86.214 69.590 1.00 9.26 ? 446 TRP E CD1 1 +ATOM 18458 C CD2 . TRP D 1 426 ? 54.852 84.605 69.593 1.00 9.04 ? 446 TRP E CD2 1 +ATOM 18459 N NE1 . TRP D 1 426 ? 53.213 85.551 68.394 1.00 7.98 ? 446 TRP E NE1 1 +ATOM 18460 C CE2 . TRP D 1 426 ? 54.163 84.561 68.366 1.00 9.69 ? 446 TRP E CE2 1 +ATOM 18461 C CE3 . TRP D 1 426 ? 55.886 83.688 69.822 1.00 9.49 ? 446 TRP E CE3 1 +ATOM 18462 C CZ2 . TRP D 1 426 ? 54.470 83.633 67.367 1.00 9.01 ? 446 TRP E CZ2 1 +ATOM 18463 C CZ3 . TRP D 1 426 ? 56.185 82.764 68.838 1.00 9.07 ? 446 TRP E CZ3 1 +ATOM 18464 C CH2 . TRP D 1 426 ? 55.480 82.745 67.624 1.00 8.98 ? 446 TRP E CH2 1 +ATOM 18465 N N . SER D 1 427 ? 55.674 85.538 74.788 1.00 8.08 ? 447 SER E N 1 +ATOM 18466 C CA . SER D 1 427 ? 56.153 86.310 75.927 1.00 8.14 ? 447 SER E CA 1 +ATOM 18467 C C . SER D 1 427 ? 57.496 86.941 75.596 1.00 7.97 ? 447 SER E C 1 +ATOM 18468 O O . SER D 1 427 ? 58.432 86.237 75.196 1.00 9.54 ? 447 SER E O 1 +ATOM 18469 C CB . SER D 1 427 ? 56.282 85.408 77.147 1.00 8.35 ? 447 SER E CB 1 +ATOM 18470 O OG . SER D 1 427 ? 57.039 86.048 78.149 1.00 7.35 ? 447 SER E OG 1 +ATOM 18471 N N . VAL D 1 428 ? 57.586 88.255 75.742 1.00 8.29 ? 448 VAL E N 1 +ATOM 18472 C CA . VAL D 1 428 ? 58.762 88.995 75.273 1.00 8.28 ? 448 VAL E CA 1 +ATOM 18473 C C . VAL D 1 428 ? 59.828 89.152 76.352 1.00 7.72 ? 448 VAL E C 1 +ATOM 18474 O O . VAL D 1 428 ? 60.936 89.582 76.055 1.00 8.07 ? 448 VAL E O 1 +ATOM 18475 C CB . VAL D 1 428 ? 58.379 90.382 74.669 1.00 8.51 ? 448 VAL E CB 1 +ATOM 18476 C CG1 . VAL D 1 428 ? 57.382 90.176 73.542 1.00 8.39 ? 448 VAL E CG1 1 +ATOM 18477 C CG2 . VAL D 1 428 ? 57.836 91.329 75.727 1.00 8.57 ? 448 VAL E CG2 1 +ATOM 18478 N N . ALA D 1 429 ? 59.510 88.813 77.596 1.00 8.14 ? 449 ALA E N 1 +ATOM 18479 C CA . ALA D 1 429 ? 60.493 88.925 78.680 1.00 8.21 ? 449 ALA E CA 1 +ATOM 18480 C C . ALA D 1 429 ? 60.018 88.253 79.948 1.00 8.68 ? 449 ALA E C 1 +ATOM 18481 O O . ALA D 1 429 ? 58.825 87.956 80.099 1.00 9.27 ? 449 ALA E O 1 +ATOM 18482 C CB . ALA D 1 429 ? 60.787 90.368 78.987 1.00 8.40 ? 449 ALA E CB 1 +ATOM 18483 N N . ASN D 1 430 ? 60.962 88.055 80.863 1.00 8.19 ? 450 ASN E N 1 +ATOM 18484 C CA . ASN D 1 430 ? 60.674 87.509 82.192 1.00 7.88 ? 450 ASN E CA 1 +ATOM 18485 C C . ASN D 1 430 ? 61.370 88.332 83.274 1.00 7.69 ? 450 ASN E C 1 +ATOM 18486 O O . ASN D 1 430 ? 62.600 88.487 83.268 1.00 6.02 ? 450 ASN E O 1 +ATOM 18487 C CB . ASN D 1 430 ? 61.097 86.045 82.311 1.00 7.97 ? 450 ASN E CB 1 +ATOM 18488 C CG . ASN D 1 430 ? 60.826 85.473 83.687 1.00 9.10 ? 450 ASN E CG 1 +ATOM 18489 O OD1 . ASN D 1 430 ? 59.709 85.074 83.980 1.00 8.26 ? 450 ASN E OD1 1 +ATOM 18490 N ND2 . ASN D 1 430 ? 61.844 85.422 84.533 1.00 9.81 ? 450 ASN E ND2 1 +ATOM 18491 N N . GLU D 1 431 ? 60.568 88.803 84.225 1.00 7.64 ? 451 GLU E N 1 +ATOM 18492 C CA . GLU D 1 431 ? 61.031 89.632 85.340 1.00 8.61 ? 451 GLU E CA 1 +ATOM 18493 C C . GLU D 1 431 ? 62.035 90.732 84.941 1.00 9.44 ? 451 GLU E C 1 +ATOM 18494 O O . GLU D 1 431 ? 63.096 90.913 85.580 1.00 9.28 ? 451 GLU E O 1 +ATOM 18495 C CB . GLU D 1 431 ? 61.578 88.750 86.472 1.00 8.88 ? 451 GLU E CB 1 +ATOM 18496 C CG . GLU D 1 431 ? 60.600 87.702 86.940 1.00 8.00 ? 451 GLU E CG 1 +ATOM 18497 C CD . GLU D 1 431 ? 61.111 86.836 88.089 1.00 9.22 ? 451 GLU E CD 1 +ATOM 18498 O OE1 . GLU D 1 431 ? 62.347 86.687 88.238 1.00 8.84 ? 451 GLU E OE1 1 +ATOM 18499 O OE2 . GLU D 1 431 ? 60.264 86.281 88.825 1.00 9.52 ? 451 GLU E OE2 1 +ATOM 18500 N N . PRO D 1 432 ? 61.682 91.520 83.908 1.00 9.75 ? 452 PRO E N 1 +ATOM 18501 C CA . PRO D 1 432 ? 62.508 92.684 83.644 1.00 9.87 ? 452 PRO E CA 1 +ATOM 18502 C C . PRO D 1 432 ? 62.298 93.689 84.784 1.00 10.49 ? 452 PRO E C 1 +ATOM 18503 O O . PRO D 1 432 ? 61.326 93.558 85.548 1.00 10.54 ? 452 PRO E O 1 +ATOM 18504 C CB . PRO D 1 432 ? 61.932 93.229 82.329 1.00 9.97 ? 452 PRO E CB 1 +ATOM 18505 C CG . PRO D 1 432 ? 60.486 92.857 82.399 1.00 9.44 ? 452 PRO E CG 1 +ATOM 18506 C CD . PRO D 1 432 ? 60.502 91.471 83.026 1.00 9.47 ? 452 PRO E CD 1 +ATOM 18507 N N . ALA D 1 433 ? 63.197 94.658 84.909 1.00 11.01 ? 453 ALA E N 1 +ATOM 18508 C CA . ALA D 1 433 ? 63.038 95.757 85.879 1.00 11.52 ? 453 ALA E CA 1 +ATOM 18509 C C . ALA D 1 433 ? 61.968 96.729 85.380 1.00 12.02 ? 453 ALA E C 1 +ATOM 18510 O O . ALA D 1 433 ? 62.236 97.902 85.111 1.00 12.26 ? 453 ALA E O 1 +ATOM 18511 C CB . ALA D 1 433 ? 64.381 96.481 86.104 1.00 11.59 ? 453 ALA E CB 1 +ATOM 18512 N N . SER D 1 434 ? 60.743 96.225 85.271 1.00 13.05 ? 454 SER E N 1 +ATOM 18513 C CA . SER D 1 434 ? 59.661 96.938 84.609 1.00 13.75 ? 454 SER E CA 1 +ATOM 18514 C C . SER D 1 434 ? 59.112 98.104 85.437 1.00 14.52 ? 454 SER E C 1 +ATOM 18515 O O . SER D 1 434 ? 58.231 98.813 84.969 1.00 14.18 ? 454 SER E O 1 +ATOM 18516 C CB . SER D 1 434 ? 58.536 95.952 84.224 1.00 13.52 ? 454 SER E CB 1 +ATOM 18517 O OG . SER D 1 434 ? 58.368 94.960 85.229 1.00 14.87 ? 454 SER E OG 1 +ATOM 18518 N N . HIS D 1 435 ? 59.640 98.309 86.647 1.00 14.75 ? 455 HIS E N 1 +ATOM 18519 C CA . HIS D 1 435 ? 59.346 99.513 87.431 1.00 15.21 ? 455 HIS E CA 1 +ATOM 18520 C C . HIS D 1 435 ? 60.015 100.772 86.873 1.00 15.54 ? 455 HIS E C 1 +ATOM 18521 O O . HIS D 1 435 ? 59.641 101.892 87.241 1.00 15.41 ? 455 HIS E O 1 +ATOM 18522 C CB . HIS D 1 435 ? 59.735 99.326 88.905 1.00 15.26 ? 455 HIS E CB 1 +ATOM 18523 C CG . HIS D 1 435 ? 61.193 99.069 89.128 1.00 15.32 ? 455 HIS E CG 1 +ATOM 18524 N ND1 . HIS D 1 435 ? 61.759 97.822 88.963 1.00 14.27 ? 455 HIS E ND1 1 +ATOM 18525 C CD2 . HIS D 1 435 ? 62.195 99.886 89.538 1.00 14.84 ? 455 HIS E CD2 1 +ATOM 18526 C CE1 . HIS D 1 435 ? 63.051 97.888 89.245 1.00 15.25 ? 455 HIS E CE1 1 +ATOM 18527 N NE2 . HIS D 1 435 ? 63.342 99.129 89.592 1.00 15.04 ? 455 HIS E NE2 1 +ATOM 18528 N N . LEU D 1 436 ? 61.009 100.597 86.002 1.00 16.07 ? 456 LEU E N 1 +ATOM 18529 C CA . LEU D 1 436 ? 61.685 101.732 85.367 1.00 16.48 ? 456 LEU E CA 1 +ATOM 18530 C C . LEU D 1 436 ? 60.903 102.255 84.172 1.00 17.11 ? 456 LEU E C 1 +ATOM 18531 O O . LEU D 1 436 ? 60.432 101.477 83.343 1.00 16.86 ? 456 LEU E O 1 +ATOM 18532 C CB . LEU D 1 436 ? 63.073 101.324 84.899 1.00 16.74 ? 456 LEU E CB 1 +ATOM 18533 C CG . LEU D 1 436 ? 64.025 100.751 85.940 1.00 17.07 ? 456 LEU E CG 1 +ATOM 18534 C CD1 . LEU D 1 436 ? 65.285 100.250 85.231 1.00 17.40 ? 456 LEU E CD1 1 +ATOM 18535 C CD2 . LEU D 1 436 ? 64.372 101.782 86.993 1.00 16.11 ? 456 LEU E CD2 1 +ATOM 18536 N N . GLU D 1 437 ? 60.785 103.578 84.071 1.00 17.15 ? 457 GLU E N 1 +ATOM 18537 C CA . GLU D 1 437 ? 60.096 104.203 82.938 1.00 17.94 ? 457 GLU E CA 1 +ATOM 18538 C C . GLU D 1 437 ? 60.753 103.827 81.617 1.00 16.85 ? 457 GLU E C 1 +ATOM 18539 O O . GLU D 1 437 ? 60.058 103.639 80.622 1.00 17.03 ? 457 GLU E O 1 +ATOM 18540 C CB . GLU D 1 437 ? 60.047 105.728 83.089 1.00 18.57 ? 457 GLU E CB 1 +ATOM 18541 C CG . GLU D 1 437 ? 59.123 106.242 84.215 1.00 21.84 ? 457 GLU E CG 1 +ATOM 18542 C CD . GLU D 1 437 ? 57.703 106.616 83.771 1.00 25.08 ? 457 GLU E CD 1 +ATOM 18543 O OE1 . GLU D 1 437 ? 57.411 106.650 82.552 1.00 29.09 ? 457 GLU E OE1 1 +ATOM 18544 O OE2 . GLU D 1 437 ? 56.864 106.898 84.660 1.00 27.31 ? 457 GLU E OE2 1 +ATOM 18545 N N . SER D 1 438 ? 62.081 103.693 81.601 1.00 16.29 ? 458 SER E N 1 +ATOM 18546 C CA . SER D 1 438 ? 62.772 103.222 80.394 1.00 15.84 ? 458 SER E CA 1 +ATOM 18547 C C . SER D 1 438 ? 62.311 101.831 79.982 1.00 15.33 ? 458 SER E C 1 +ATOM 18548 O O . SER D 1 438 ? 62.100 101.561 78.791 1.00 14.19 ? 458 SER E O 1 +ATOM 18549 C CB . SER D 1 438 ? 64.284 103.219 80.595 1.00 16.55 ? 458 SER E CB 1 +ATOM 18550 O OG . SER D 1 438 ? 64.667 102.353 81.643 1.00 16.14 ? 458 SER E OG 1 +ATOM 18551 N N . ALA D 1 439 ? 62.164 100.942 80.966 1.00 15.05 ? 459 ALA E N 1 +ATOM 18552 C CA . ALA D 1 439 ? 61.708 99.569 80.710 1.00 14.59 ? 459 ALA E CA 1 +ATOM 18553 C C . ALA D 1 439 ? 60.287 99.547 80.143 1.00 14.73 ? 459 ALA E C 1 +ATOM 18554 O O . ALA D 1 439 ? 59.973 98.772 79.239 1.00 14.13 ? 459 ALA E O 1 +ATOM 18555 C CB . ALA D 1 439 ? 61.770 98.752 81.984 1.00 14.87 ? 459 ALA E CB 1 +ATOM 18556 N N . GLY D 1 440 ? 59.416 100.375 80.704 1.00 14.76 ? 460 GLY E N 1 +ATOM 18557 C CA . GLY D 1 440 ? 58.055 100.520 80.185 1.00 14.76 ? 460 GLY E CA 1 +ATOM 18558 C C . GLY D 1 440 ? 58.025 100.831 78.700 1.00 14.67 ? 460 GLY E C 1 +ATOM 18559 O O . GLY D 1 440 ? 57.310 100.172 77.939 1.00 15.12 ? 460 GLY E O 1 +ATOM 18560 N N . TYR D 1 441 ? 58.806 101.827 78.282 1.00 15.01 ? 461 TYR E N 1 +ATOM 18561 C CA . TYR D 1 441 ? 58.887 102.184 76.859 1.00 15.19 ? 461 TYR E CA 1 +ATOM 18562 C C . TYR D 1 441 ? 59.484 101.031 76.020 1.00 14.00 ? 461 TYR E C 1 +ATOM 18563 O O . TYR D 1 441 ? 58.978 100.696 74.948 1.00 13.74 ? 461 TYR E O 1 +ATOM 18564 C CB . TYR D 1 441 ? 59.675 103.496 76.646 1.00 16.38 ? 461 TYR E CB 1 +ATOM 18565 C CG . TYR D 1 441 ? 59.988 103.764 75.180 1.00 17.53 ? 461 TYR E CG 1 +ATOM 18566 C CD1 . TYR D 1 441 ? 59.050 104.368 74.341 1.00 19.48 ? 461 TYR E CD1 1 +ATOM 18567 C CD2 . TYR D 1 441 ? 61.212 103.388 74.629 1.00 18.61 ? 461 TYR E CD2 1 +ATOM 18568 C CE1 . TYR D 1 441 ? 59.335 104.595 72.987 1.00 19.99 ? 461 TYR E CE1 1 +ATOM 18569 C CE2 . TYR D 1 441 ? 61.503 103.613 73.283 1.00 19.37 ? 461 TYR E CE2 1 +ATOM 18570 C CZ . TYR D 1 441 ? 60.560 104.209 72.473 1.00 19.61 ? 461 TYR E CZ 1 +ATOM 18571 O OH . TYR D 1 441 ? 60.858 104.416 71.143 1.00 20.69 ? 461 TYR E OH 1 +ATOM 18572 N N . TYR D 1 442 ? 60.557 100.432 76.528 1.00 12.99 ? 462 TYR E N 1 +ATOM 18573 C CA . TYR D 1 442 ? 61.241 99.307 75.886 1.00 11.86 ? 462 TYR E CA 1 +ATOM 18574 C C . TYR D 1 442 ? 60.260 98.164 75.610 1.00 11.38 ? 462 TYR E C 1 +ATOM 18575 O O . TYR D 1 442 ? 60.156 97.677 74.482 1.00 10.59 ? 462 TYR E O 1 +ATOM 18576 C CB . TYR D 1 442 ? 62.397 98.888 76.810 1.00 11.46 ? 462 TYR E CB 1 +ATOM 18577 C CG . TYR D 1 442 ? 63.261 97.712 76.429 1.00 10.72 ? 462 TYR E CG 1 +ATOM 18578 C CD1 . TYR D 1 442 ? 62.809 96.400 76.600 1.00 10.88 ? 462 TYR E CD1 1 +ATOM 18579 C CD2 . TYR D 1 442 ? 64.564 97.902 75.967 1.00 9.49 ? 462 TYR E CD2 1 +ATOM 18580 C CE1 . TYR D 1 442 ? 63.607 95.320 76.274 1.00 10.80 ? 462 TYR E CE1 1 +ATOM 18581 C CE2 . TYR D 1 442 ? 65.385 96.826 75.659 1.00 10.45 ? 462 TYR E CE2 1 +ATOM 18582 C CZ . TYR D 1 442 ? 64.902 95.537 75.814 1.00 10.69 ? 462 TYR E CZ 1 +ATOM 18583 O OH . TYR D 1 442 ? 65.684 94.450 75.504 1.00 10.45 ? 462 TYR E OH 1 +ATOM 18584 N N . LEU D 1 443 ? 59.506 97.770 76.630 1.00 10.98 ? 463 LEU E N 1 +ATOM 18585 C CA . LEU D 1 443 ? 58.543 96.676 76.488 1.00 10.99 ? 463 LEU E CA 1 +ATOM 18586 C C . LEU D 1 443 ? 57.374 97.036 75.570 1.00 11.19 ? 463 LEU E C 1 +ATOM 18587 O O . LEU D 1 443 ? 56.924 96.196 74.780 1.00 11.35 ? 463 LEU E O 1 +ATOM 18588 C CB . LEU D 1 443 ? 58.038 96.216 77.857 1.00 11.23 ? 463 LEU E CB 1 +ATOM 18589 C CG . LEU D 1 443 ? 59.100 95.612 78.791 1.00 11.87 ? 463 LEU E CG 1 +ATOM 18590 C CD1 . LEU D 1 443 ? 58.615 95.589 80.240 1.00 12.63 ? 463 LEU E CD1 1 +ATOM 18591 C CD2 . LEU D 1 443 ? 59.522 94.216 78.346 1.00 13.40 ? 463 LEU E CD2 1 +ATOM 18592 N N . LYS D 1 444 ? 56.906 98.290 75.641 1.00 11.62 ? 464 LYS E N 1 +ATOM 18593 C CA . LYS D 1 444 ? 55.861 98.764 74.720 1.00 11.51 ? 464 LYS E CA 1 +ATOM 18594 C C . LYS D 1 444 ? 56.279 98.510 73.284 1.00 11.19 ? 464 LYS E C 1 +ATOM 18595 O O . LYS D 1 444 ? 55.525 97.955 72.485 1.00 10.66 ? 464 LYS E O 1 +ATOM 18596 C CB . LYS D 1 444 ? 55.597 100.258 74.929 1.00 12.14 ? 464 LYS E CB 1 +ATOM 18597 C CG . LYS D 1 444 ? 54.596 100.869 73.967 1.00 13.36 ? 464 LYS E CG 1 +ATOM 18598 C CD . LYS D 1 444 ? 54.547 102.379 74.124 1.00 15.15 ? 464 LYS E CD 1 +ATOM 18599 C CE . LYS D 1 444 ? 53.757 103.020 73.021 1.00 16.98 ? 464 LYS E CE 1 +ATOM 18600 N NZ . LYS D 1 444 ? 52.316 102.713 73.191 1.00 19.70 ? 464 LYS E NZ 1 +ATOM 18601 N N . MET D 1 445 ? 57.518 98.873 72.971 1.00 10.51 ? 465 MET E N 1 +ATOM 18602 C CA . MET D 1 445 ? 58.023 98.755 71.611 1.00 11.43 ? 465 MET E CA 1 +ATOM 18603 C C . MET D 1 445 ? 58.209 97.281 71.177 1.00 10.80 ? 465 MET E C 1 +ATOM 18604 O O . MET D 1 445 ? 57.828 96.916 70.062 1.00 11.20 ? 465 MET E O 1 +ATOM 18605 C CB . MET D 1 445 ? 59.317 99.563 71.473 1.00 11.98 ? 465 MET E CB 1 +ATOM 18606 C CG . MET D 1 445 ? 59.181 101.051 71.782 1.00 14.77 ? 465 MET E CG 1 +ATOM 18607 S SD . MET D 1 445 ? 58.047 101.911 70.664 1.00 22.58 ? 465 MET E SD 1 +ATOM 18608 C CE . MET D 1 445 ? 56.791 102.445 71.805 1.00 21.88 ? 465 MET E CE 1 +ATOM 18609 N N . VAL D 1 446 ? 58.772 96.433 72.041 1.00 10.33 ? 466 VAL E N 1 +ATOM 18610 C CA . VAL D 1 446 ? 58.950 95.016 71.689 1.00 10.26 ? 466 VAL E CA 1 +ATOM 18611 C C . VAL D 1 446 ? 57.594 94.334 71.483 1.00 10.38 ? 466 VAL E C 1 +ATOM 18612 O O . VAL D 1 446 ? 57.441 93.512 70.574 1.00 10.66 ? 466 VAL E O 1 +ATOM 18613 C CB . VAL D 1 446 ? 59.794 94.236 72.732 1.00 10.05 ? 466 VAL E CB 1 +ATOM 18614 C CG1 . VAL D 1 446 ? 59.868 92.741 72.355 1.00 10.19 ? 466 VAL E CG1 1 +ATOM 18615 C CG2 . VAL D 1 446 ? 61.193 94.847 72.857 1.00 10.52 ? 466 VAL E CG2 1 +ATOM 18616 N N . ILE D 1 447 ? 56.617 94.685 72.318 1.00 10.30 ? 467 ILE E N 1 +ATOM 18617 C CA . ILE D 1 447 ? 55.259 94.149 72.190 1.00 10.37 ? 467 ILE E CA 1 +ATOM 18618 C C . ILE D 1 447 ? 54.609 94.604 70.872 1.00 9.88 ? 467 ILE E C 1 +ATOM 18619 O O . ILE D 1 447 ? 54.062 93.795 70.133 1.00 10.03 ? 467 ILE E O 1 +ATOM 18620 C CB . ILE D 1 447 ? 54.382 94.517 73.416 1.00 10.19 ? 467 ILE E CB 1 +ATOM 18621 C CG1 . ILE D 1 447 ? 54.892 93.775 74.656 1.00 11.21 ? 467 ILE E CG1 1 +ATOM 18622 C CG2 . ILE D 1 447 ? 52.888 94.200 73.148 1.00 10.40 ? 467 ILE E CG2 1 +ATOM 18623 C CD1 . ILE D 1 447 ? 54.271 94.169 75.969 1.00 10.86 ? 467 ILE E CD1 1 +ATOM 18624 N N . ALA D 1 448 ? 54.685 95.897 70.571 1.00 10.04 ? 468 ALA E N 1 +ATOM 18625 C CA . ALA D 1 448 ? 54.171 96.431 69.306 1.00 9.92 ? 468 ALA E CA 1 +ATOM 18626 C C . ALA D 1 448 ? 54.829 95.744 68.105 1.00 10.31 ? 468 ALA E C 1 +ATOM 18627 O O . ALA D 1 448 ? 54.159 95.370 67.129 1.00 10.54 ? 468 ALA E O 1 +ATOM 18628 C CB . ALA D 1 448 ? 54.400 97.954 69.248 1.00 10.04 ? 468 ALA E CB 1 +ATOM 18629 N N . HIS D 1 449 ? 56.142 95.548 68.188 1.00 10.42 ? 469 HIS E N 1 +ATOM 18630 C CA . HIS D 1 449 ? 56.863 94.897 67.117 1.00 10.54 ? 469 HIS E CA 1 +ATOM 18631 C C . HIS D 1 449 ? 56.363 93.474 66.925 1.00 10.35 ? 469 HIS E C 1 +ATOM 18632 O O . HIS D 1 449 ? 56.149 93.046 65.790 1.00 10.16 ? 469 HIS E O 1 +ATOM 18633 C CB . HIS D 1 449 ? 58.372 94.895 67.377 1.00 11.00 ? 469 HIS E CB 1 +ATOM 18634 C CG . HIS D 1 449 ? 59.183 94.526 66.176 1.00 11.49 ? 469 HIS E CG 1 +ATOM 18635 N ND1 . HIS D 1 449 ? 59.165 95.271 65.016 1.00 13.17 ? 469 HIS E ND1 1 +ATOM 18636 C CD2 . HIS D 1 449 ? 60.046 93.505 65.954 1.00 14.02 ? 469 HIS E CD2 1 +ATOM 18637 C CE1 . HIS D 1 449 ? 59.979 94.722 64.130 1.00 14.91 ? 469 HIS E CE1 1 +ATOM 18638 N NE2 . HIS D 1 449 ? 60.518 93.643 64.670 1.00 15.01 ? 469 HIS E NE2 1 +ATOM 18639 N N . THR D 1 450 ? 56.167 92.749 68.032 1.00 10.08 ? 470 THR E N 1 +ATOM 18640 C CA . THR D 1 450 ? 55.689 91.379 67.972 1.00 10.12 ? 470 THR E CA 1 +ATOM 18641 C C . THR D 1 450 ? 54.325 91.328 67.274 1.00 10.44 ? 470 THR E C 1 +ATOM 18642 O O . THR D 1 450 ? 54.124 90.529 66.360 1.00 10.50 ? 470 THR E O 1 +ATOM 18643 C CB . THR D 1 450 ? 55.630 90.747 69.380 1.00 10.28 ? 470 THR E CB 1 +ATOM 18644 O OG1 . THR D 1 450 ? 56.934 90.786 69.979 1.00 9.16 ? 470 THR E OG1 1 +ATOM 18645 C CG2 . THR D 1 450 ? 55.153 89.303 69.300 1.00 10.31 ? 470 THR E CG2 1 +ATOM 18646 N N . LYS D 1 451 ? 53.404 92.206 67.669 1.00 11.77 ? 471 LYS E N 1 +ATOM 18647 C CA . LYS D 1 451 ? 52.078 92.237 67.035 1.00 12.99 ? 471 LYS E CA 1 +ATOM 18648 C C . LYS D 1 451 ? 52.133 92.562 65.550 1.00 13.71 ? 471 LYS E C 1 +ATOM 18649 O O . LYS D 1 451 ? 51.286 92.091 64.782 1.00 14.47 ? 471 LYS E O 1 +ATOM 18650 C CB . LYS D 1 451 ? 51.136 93.201 67.751 1.00 12.98 ? 471 LYS E CB 1 +ATOM 18651 C CG . LYS D 1 451 ? 50.766 92.729 69.119 1.00 14.27 ? 471 LYS E CG 1 +ATOM 18652 C CD . LYS D 1 451 ? 49.714 93.610 69.751 1.00 15.75 ? 471 LYS E CD 1 +ATOM 18653 C CE . LYS D 1 451 ? 49.338 93.094 71.149 1.00 17.11 ? 471 LYS E CE 1 +ATOM 18654 N NZ . LYS D 1 451 ? 48.125 93.770 71.689 1.00 18.16 ? 471 LYS E NZ 1 +ATOM 18655 N N . SER D 1 452 ? 53.118 93.358 65.140 1.00 13.59 ? 472 SER E N 1 +ATOM 18656 C CA . SER D 1 452 ? 53.291 93.678 63.713 1.00 14.15 ? 472 SER E CA 1 +ATOM 18657 C C . SER D 1 452 ? 53.717 92.445 62.904 1.00 14.50 ? 472 SER E C 1 +ATOM 18658 O O . SER D 1 452 ? 53.459 92.368 61.693 1.00 15.13 ? 472 SER E O 1 +ATOM 18659 C CB . SER D 1 452 ? 54.304 94.804 63.522 1.00 14.62 ? 472 SER E CB 1 +ATOM 18660 O OG . SER D 1 452 ? 55.634 94.339 63.651 1.00 14.24 ? 472 SER E OG 1 +ATOM 18661 N N . LEU D 1 453 ? 54.392 91.512 63.577 1.00 13.58 ? 473 LEU E N 1 +ATOM 18662 C CA . LEU D 1 453 ? 54.902 90.291 62.953 1.00 13.57 ? 473 LEU E CA 1 +ATOM 18663 C C . LEU D 1 453 ? 53.893 89.168 62.914 1.00 13.34 ? 473 LEU E C 1 +ATOM 18664 O O . LEU D 1 453 ? 53.943 88.320 62.025 1.00 13.69 ? 473 LEU E O 1 +ATOM 18665 C CB . LEU D 1 453 ? 56.118 89.785 63.716 1.00 13.97 ? 473 LEU E CB 1 +ATOM 18666 C CG . LEU D 1 453 ? 57.268 90.775 63.809 1.00 13.50 ? 473 LEU E CG 1 +ATOM 18667 C CD1 . LEU D 1 453 ? 58.335 90.175 64.728 1.00 13.08 ? 473 LEU E CD1 1 +ATOM 18668 C CD2 . LEU D 1 453 ? 57.825 91.101 62.424 1.00 13.92 ? 473 LEU E CD2 1 +ATOM 18669 N N . ASP D 1 454 ? 52.998 89.145 63.895 1.00 12.94 ? 474 ASP E N 1 +ATOM 18670 C CA . ASP D 1 454 ? 52.004 88.084 64.001 1.00 12.33 ? 474 ASP E CA 1 +ATOM 18671 C C . ASP D 1 454 ? 50.674 88.612 64.536 1.00 12.51 ? 474 ASP E C 1 +ATOM 18672 O O . ASP D 1 454 ? 50.531 88.852 65.741 1.00 12.40 ? 474 ASP E O 1 +ATOM 18673 C CB . ASP D 1 454 ? 52.511 86.960 64.904 1.00 11.94 ? 474 ASP E CB 1 +ATOM 18674 C CG . ASP D 1 454 ? 51.512 85.832 65.040 1.00 11.35 ? 474 ASP E CG 1 +ATOM 18675 O OD1 . ASP D 1 454 ? 50.640 85.671 64.151 1.00 10.51 ? 474 ASP E OD1 1 +ATOM 18676 O OD2 . ASP D 1 454 ? 51.593 85.115 66.051 1.00 9.12 ? 474 ASP E OD2 1 +ATOM 18677 N N . PRO D 1 455 ? 49.679 88.759 63.646 1.00 13.18 ? 475 PRO E N 1 +ATOM 18678 C CA . PRO D 1 455 ? 48.358 89.238 64.057 1.00 12.73 ? 475 PRO E CA 1 +ATOM 18679 C C . PRO D 1 455 ? 47.511 88.218 64.831 1.00 12.80 ? 475 PRO E C 1 +ATOM 18680 O O . PRO D 1 455 ? 46.443 88.567 65.345 1.00 12.97 ? 475 PRO E O 1 +ATOM 18681 C CB . PRO D 1 455 ? 47.682 89.580 62.725 1.00 13.07 ? 475 PRO E CB 1 +ATOM 18682 C CG . PRO D 1 455 ? 48.317 88.699 61.735 1.00 13.58 ? 475 PRO E CG 1 +ATOM 18683 C CD . PRO D 1 455 ? 49.741 88.484 62.198 1.00 13.51 ? 475 PRO E CD 1 +ATOM 18684 N N . SER D 1 456 ? 47.971 86.974 64.927 1.00 11.81 ? 476 SER E N 1 +ATOM 18685 C CA . SER D 1 456 ? 47.090 85.863 65.324 1.00 11.28 ? 476 SER E CA 1 +ATOM 18686 C C . SER D 1 456 ? 47.151 85.456 66.793 1.00 11.26 ? 476 SER E C 1 +ATOM 18687 O O . SER D 1 456 ? 46.370 84.600 67.227 1.00 10.70 ? 476 SER E O 1 +ATOM 18688 C CB . SER D 1 456 ? 47.391 84.638 64.461 1.00 11.70 ? 476 SER E CB 1 +ATOM 18689 O OG . SER D 1 456 ? 48.639 84.029 64.818 1.00 11.34 ? 476 SER E OG 1 +ATOM 18690 N N . ARG D 1 457 ? 48.074 86.036 67.558 1.00 10.41 ? 477 ARG E N 1 +ATOM 18691 C CA . ARG D 1 457 ? 48.299 85.592 68.940 1.00 10.15 ? 477 ARG E CA 1 +ATOM 18692 C C . ARG D 1 457 ? 48.470 86.771 69.864 1.00 10.05 ? 477 ARG E C 1 +ATOM 18693 O O . ARG D 1 457 ? 48.978 87.804 69.441 1.00 10.39 ? 477 ARG E O 1 +ATOM 18694 C CB . ARG D 1 457 ? 49.570 84.737 69.058 1.00 10.01 ? 477 ARG E CB 1 +ATOM 18695 C CG . ARG D 1 457 ? 49.556 83.441 68.281 1.00 10.01 ? 477 ARG E CG 1 +ATOM 18696 C CD . ARG D 1 457 ? 50.915 82.737 68.333 1.00 9.36 ? 477 ARG E CD 1 +ATOM 18697 N NE . ARG D 1 457 ? 50.850 81.428 67.694 1.00 8.10 ? 477 ARG E NE 1 +ATOM 18698 C CZ . ARG D 1 457 ? 51.139 81.177 66.419 1.00 8.93 ? 477 ARG E CZ 1 +ATOM 18699 N NH1 . ARG D 1 457 ? 51.483 82.155 65.594 1.00 10.65 ? 477 ARG E NH1 1 +ATOM 18700 N NH2 . ARG D 1 457 ? 51.052 79.928 65.967 1.00 8.36 ? 477 ARG E NH2 1 +ATOM 18701 N N . PRO D 1 458 ? 48.061 86.612 71.139 1.00 9.84 ? 478 PRO E N 1 +ATOM 18702 C CA . PRO D 1 458 ? 48.269 87.642 72.141 1.00 9.28 ? 478 PRO E CA 1 +ATOM 18703 C C . PRO D 1 458 ? 49.734 87.682 72.565 1.00 8.90 ? 478 PRO E C 1 +ATOM 18704 O O . PRO D 1 458 ? 50.478 86.713 72.329 1.00 8.70 ? 478 PRO E O 1 +ATOM 18705 C CB . PRO D 1 458 ? 47.370 87.203 73.295 1.00 9.63 ? 478 PRO E CB 1 +ATOM 18706 C CG . PRO D 1 458 ? 47.260 85.715 73.153 1.00 9.58 ? 478 PRO E CG 1 +ATOM 18707 C CD . PRO D 1 458 ? 47.352 85.441 71.683 1.00 10.47 ? 478 PRO E CD 1 +ATOM 18708 N N . VAL D 1 459 ? 50.113 88.787 73.184 1.00 8.52 ? 479 VAL E N 1 +ATOM 18709 C CA . VAL D 1 459 ? 51.478 89.045 73.607 1.00 8.27 ? 479 VAL E CA 1 +ATOM 18710 C C . VAL D 1 459 ? 51.478 89.474 75.069 1.00 8.59 ? 479 VAL E C 1 +ATOM 18711 O O . VAL D 1 459 ? 50.565 90.167 75.542 1.00 7.61 ? 479 VAL E O 1 +ATOM 18712 C CB . VAL D 1 459 ? 52.111 90.178 72.755 1.00 8.06 ? 479 VAL E CB 1 +ATOM 18713 C CG1 . VAL D 1 459 ? 53.585 90.404 73.135 1.00 9.08 ? 479 VAL E CG1 1 +ATOM 18714 C CG2 . VAL D 1 459 ? 51.970 89.865 71.268 1.00 8.69 ? 479 VAL E CG2 1 +ATOM 18715 N N . THR D 1 460 ? 52.514 89.057 75.780 1.00 8.06 ? 480 THR E N 1 +ATOM 18716 C CA . THR D 1 460 ? 52.628 89.318 77.195 1.00 8.31 ? 480 THR E CA 1 +ATOM 18717 C C . THR D 1 460 ? 54.113 89.440 77.541 1.00 8.55 ? 480 THR E C 1 +ATOM 18718 O O . THR D 1 460 ? 54.975 89.214 76.696 1.00 8.88 ? 480 THR E O 1 +ATOM 18719 C CB . THR D 1 460 ? 51.986 88.150 77.992 1.00 8.88 ? 480 THR E CB 1 +ATOM 18720 O OG1 . THR D 1 460 ? 51.899 88.483 79.382 1.00 8.77 ? 480 THR E OG1 1 +ATOM 18721 C CG2 . THR D 1 460 ? 52.814 86.885 77.821 1.00 8.89 ? 480 THR E CG2 1 +ATOM 18722 N N . PHE D 1 461 ? 54.395 89.808 78.774 1.00 8.65 ? 481 PHE E N 1 +ATOM 18723 C CA . PHE D 1 461 ? 55.675 89.481 79.399 1.00 8.67 ? 481 PHE E CA 1 +ATOM 18724 C C . PHE D 1 461 ? 55.385 89.076 80.828 1.00 8.89 ? 481 PHE E C 1 +ATOM 18725 O O . PHE D 1 461 ? 54.320 89.387 81.365 1.00 8.63 ? 481 PHE E O 1 +ATOM 18726 C CB . PHE D 1 461 ? 56.664 90.638 79.334 1.00 9.51 ? 481 PHE E CB 1 +ATOM 18727 C CG . PHE D 1 461 ? 56.391 91.719 80.324 1.00 8.72 ? 481 PHE E CG 1 +ATOM 18728 C CD1 . PHE D 1 461 ? 55.467 92.718 80.042 1.00 11.40 ? 481 PHE E CD1 1 +ATOM 18729 C CD2 . PHE D 1 461 ? 57.039 91.737 81.547 1.00 10.73 ? 481 PHE E CD2 1 +ATOM 18730 C CE1 . PHE D 1 461 ? 55.204 93.724 80.961 1.00 11.62 ? 481 PHE E CE1 1 +ATOM 18731 C CE2 . PHE D 1 461 ? 56.777 92.721 82.469 1.00 12.29 ? 481 PHE E CE2 1 +ATOM 18732 C CZ . PHE D 1 461 ? 55.856 93.721 82.181 1.00 11.12 ? 481 PHE E CZ 1 +ATOM 18733 N N . VAL D 1 462 ? 56.313 88.335 81.427 1.00 8.21 ? 482 VAL E N 1 +ATOM 18734 C CA . VAL D 1 462 ? 56.096 87.786 82.756 1.00 8.65 ? 482 VAL E CA 1 +ATOM 18735 C C . VAL D 1 462 ? 56.742 88.678 83.796 1.00 8.90 ? 482 VAL E C 1 +ATOM 18736 O O . VAL D 1 462 ? 57.922 88.977 83.701 1.00 8.63 ? 482 VAL E O 1 +ATOM 18737 C CB . VAL D 1 462 ? 56.622 86.337 82.842 1.00 7.63 ? 482 VAL E CB 1 +ATOM 18738 C CG1 . VAL D 1 462 ? 56.472 85.789 84.255 1.00 8.24 ? 482 VAL E CG1 1 +ATOM 18739 C CG2 . VAL D 1 462 ? 55.863 85.453 81.835 1.00 9.52 ? 482 VAL E CG2 1 +ATOM 18740 N N . SER D 1 463 ? 55.959 89.097 84.793 1.00 9.03 ? 483 SER E N 1 +ATOM 18741 C CA . SER D 1 463 ? 56.372 90.139 85.728 1.00 9.47 ? 483 SER E CA 1 +ATOM 18742 C C . SER D 1 463 ? 56.473 89.690 87.180 1.00 10.09 ? 483 SER E C 1 +ATOM 18743 O O . SER D 1 463 ? 55.691 88.847 87.637 1.00 9.10 ? 483 SER E O 1 +ATOM 18744 C CB . SER D 1 463 ? 55.375 91.306 85.652 1.00 9.99 ? 483 SER E CB 1 +ATOM 18745 O OG . SER D 1 463 ? 55.841 92.426 86.391 1.00 9.42 ? 483 SER E OG 1 +ATOM 18746 N N . ASN D 1 464 ? 57.447 90.249 87.899 1.00 10.44 ? 484 ASN E N 1 +ATOM 18747 C CA . ASN D 1 464 ? 57.472 90.168 89.346 1.00 11.46 ? 484 ASN E CA 1 +ATOM 18748 C C . ASN D 1 464 ? 57.429 91.559 89.986 1.00 12.37 ? 484 ASN E C 1 +ATOM 18749 O O . ASN D 1 464 ? 57.817 91.730 91.153 1.00 12.72 ? 484 ASN E O 1 +ATOM 18750 C CB . ASN D 1 464 ? 58.697 89.380 89.837 1.00 11.15 ? 484 ASN E CB 1 +ATOM 18751 C CG . ASN D 1 464 ? 60.001 90.111 89.595 1.00 11.48 ? 484 ASN E CG 1 +ATOM 18752 O OD1 . ASN D 1 464 ? 60.055 91.055 88.810 1.00 10.58 ? 484 ASN E OD1 1 +ATOM 18753 N ND2 . ASN D 1 464 ? 61.074 89.666 90.270 1.00 11.00 ? 484 ASN E ND2 1 +ATOM 18754 N N . SER D 1 465 ? 56.956 92.557 89.225 1.00 13.01 ? 485 SER E N 1 +ATOM 18755 C CA . SER D 1 465 ? 56.891 93.929 89.715 1.00 14.12 ? 485 SER E CA 1 +ATOM 18756 C C . SER D 1 465 ? 55.723 94.132 90.668 1.00 14.66 ? 485 SER E C 1 +ATOM 18757 O O . SER D 1 465 ? 54.789 93.347 90.686 1.00 14.06 ? 485 SER E O 1 +ATOM 18758 C CB . SER D 1 465 ? 56.750 94.920 88.555 1.00 14.30 ? 485 SER E CB 1 +ATOM 18759 O OG . SER D 1 465 ? 57.875 94.887 87.684 1.00 14.21 ? 485 SER E OG 1 +ATOM 18760 N N . ASN D 1 466 ? 55.813 95.195 91.457 1.00 15.05 ? 486 ASN E N 1 +ATOM 18761 C CA . ASN D 1 466 ? 54.700 95.728 92.246 1.00 16.07 ? 486 ASN E CA 1 +ATOM 18762 C C . ASN D 1 466 ? 53.596 96.211 91.293 1.00 15.83 ? 486 ASN E C 1 +ATOM 18763 O O . ASN D 1 466 ? 53.890 96.853 90.283 1.00 15.43 ? 486 ASN E O 1 +ATOM 18764 C CB . ASN D 1 466 ? 55.249 96.886 93.080 1.00 16.30 ? 486 ASN E CB 1 +ATOM 18765 C CG . ASN D 1 466 ? 54.223 97.522 93.992 1.00 19.34 ? 486 ASN E CG 1 +ATOM 18766 O OD1 . ASN D 1 466 ? 53.036 97.241 93.917 1.00 23.69 ? 486 ASN E OD1 1 +ATOM 18767 N ND2 . ASN D 1 466 ? 54.698 98.405 94.872 1.00 23.63 ? 486 ASN E ND2 1 +ATOM 18768 N N . TYR D 1 467 ? 52.334 95.899 91.598 1.00 15.89 ? 487 TYR E N 1 +ATOM 18769 C CA . TYR D 1 467 ? 51.231 96.214 90.683 1.00 16.01 ? 487 TYR E CA 1 +ATOM 18770 C C . TYR D 1 467 ? 51.204 97.725 90.358 1.00 16.08 ? 487 TYR E C 1 +ATOM 18771 O O . TYR D 1 467 ? 50.936 98.112 89.224 1.00 16.10 ? 487 TYR E O 1 +ATOM 18772 C CB . TYR D 1 467 ? 49.874 95.738 91.248 1.00 16.30 ? 487 TYR E CB 1 +ATOM 18773 C CG . TYR D 1 467 ? 49.316 96.682 92.290 1.00 16.38 ? 487 TYR E CG 1 +ATOM 18774 C CD1 . TYR D 1 467 ? 49.772 96.647 93.603 1.00 16.42 ? 487 TYR E CD1 1 +ATOM 18775 C CD2 . TYR D 1 467 ? 48.355 97.635 91.951 1.00 17.30 ? 487 TYR E CD2 1 +ATOM 18776 C CE1 . TYR D 1 467 ? 49.291 97.534 94.556 1.00 16.95 ? 487 TYR E CE1 1 +ATOM 18777 C CE2 . TYR D 1 467 ? 47.858 98.524 92.905 1.00 17.22 ? 487 TYR E CE2 1 +ATOM 18778 C CZ . TYR D 1 467 ? 48.328 98.465 94.204 1.00 17.44 ? 487 TYR E CZ 1 +ATOM 18779 O OH . TYR D 1 467 ? 47.860 99.357 95.159 1.00 17.06 ? 487 TYR E OH 1 +ATOM 18780 N N . ALA D 1 468 ? 51.513 98.558 91.351 1.00 16.53 ? 488 ALA E N 1 +ATOM 18781 C CA . ALA D 1 468 ? 51.435 100.008 91.215 1.00 16.75 ? 488 ALA E CA 1 +ATOM 18782 C C . ALA D 1 468 ? 52.603 100.587 90.420 1.00 16.69 ? 488 ALA E C 1 +ATOM 18783 O O . ALA D 1 468 ? 52.501 101.698 89.883 1.00 16.81 ? 488 ALA E O 1 +ATOM 18784 C CB . ALA D 1 468 ? 51.380 100.659 92.593 1.00 17.47 ? 488 ALA E CB 1 +ATOM 18785 N N . ALA D 1 469 ? 53.709 99.846 90.350 1.00 16.47 ? 489 ALA E N 1 +ATOM 18786 C CA . ALA D 1 469 ? 54.948 100.347 89.751 1.00 15.99 ? 489 ALA E CA 1 +ATOM 18787 C C . ALA D 1 469 ? 55.219 99.804 88.341 1.00 15.60 ? 489 ALA E C 1 +ATOM 18788 O O . ALA D 1 469 ? 56.003 100.398 87.588 1.00 15.29 ? 489 ALA E O 1 +ATOM 18789 C CB . ALA D 1 469 ? 56.137 100.039 90.676 1.00 16.26 ? 489 ALA E CB 1 +ATOM 18790 N N . ASP D 1 470 ? 54.560 98.706 87.980 1.00 14.84 ? 490 ASP E N 1 +ATOM 18791 C CA . ASP D 1 470 ? 54.819 98.025 86.701 1.00 14.15 ? 490 ASP E CA 1 +ATOM 18792 C C . ASP D 1 470 ? 54.446 98.890 85.485 1.00 13.96 ? 490 ASP E C 1 +ATOM 18793 O O . ASP D 1 470 ? 53.268 99.023 85.130 1.00 13.98 ? 490 ASP E O 1 +ATOM 18794 C CB . ASP D 1 470 ? 54.096 96.679 86.633 1.00 13.85 ? 490 ASP E CB 1 +ATOM 18795 C CG . ASP D 1 470 ? 54.598 95.798 85.490 1.00 11.78 ? 490 ASP E CG 1 +ATOM 18796 O OD1 . ASP D 1 470 ? 55.086 96.332 84.466 1.00 12.59 ? 490 ASP E OD1 1 +ATOM 18797 O OD2 . ASP D 1 470 ? 54.498 94.563 85.601 1.00 12.43 ? 490 ASP E OD2 1 +ATOM 18798 N N . LYS D 1 471 ? 55.471 99.449 84.845 1.00 13.61 ? 491 LYS E N 1 +ATOM 18799 C CA . LYS D 1 471 ? 55.305 100.320 83.682 1.00 13.05 ? 491 LYS E CA 1 +ATOM 18800 C C . LYS D 1 471 ? 55.048 99.570 82.373 1.00 12.33 ? 491 LYS E C 1 +ATOM 18801 O O . LYS D 1 471 ? 54.690 100.197 81.373 1.00 12.75 ? 491 LYS E O 1 +ATOM 18802 C CB . LYS D 1 471 ? 56.556 101.194 83.502 1.00 13.15 ? 491 LYS E CB 1 +ATOM 18803 C CG . LYS D 1 471 ? 56.945 102.008 84.735 1.00 13.88 ? 491 LYS E CG 1 +ATOM 18804 C CD . LYS D 1 471 ? 55.820 102.883 85.240 1.00 16.53 ? 491 LYS E CD 1 +ATOM 18805 C CE . LYS D 1 471 ? 56.302 103.758 86.394 1.00 17.77 ? 491 LYS E CE 1 +ATOM 18806 N NZ . LYS D 1 471 ? 55.206 104.587 86.954 1.00 20.97 ? 491 LYS E NZ 1 +ATOM 18807 N N . GLY D 1 472 ? 55.242 98.251 82.364 1.00 11.12 ? 492 GLY E N 1 +ATOM 18808 C CA . GLY D 1 472 ? 54.978 97.442 81.178 1.00 10.95 ? 492 GLY E CA 1 +ATOM 18809 C C . GLY D 1 472 ? 53.547 96.932 81.107 1.00 10.74 ? 492 GLY E C 1 +ATOM 18810 O O . GLY D 1 472 ? 53.049 96.585 80.029 1.00 11.46 ? 492 GLY E O 1 +ATOM 18811 N N . ALA D 1 473 ? 52.888 96.886 82.258 1.00 10.33 ? 493 ALA E N 1 +ATOM 18812 C CA . ALA D 1 473 ? 51.602 96.209 82.404 1.00 10.56 ? 493 ALA E CA 1 +ATOM 18813 C C . ALA D 1 473 ? 50.507 96.803 81.525 1.00 10.68 ? 493 ALA E C 1 +ATOM 18814 O O . ALA D 1 473 ? 49.615 96.078 81.092 1.00 10.04 ? 493 ALA E O 1 +ATOM 18815 C CB . ALA D 1 473 ? 51.162 96.226 83.853 1.00 10.86 ? 493 ALA E CB 1 +ATOM 18816 N N . PRO D 1 474 ? 50.551 98.124 81.268 1.00 11.18 ? 494 PRO E N 1 +ATOM 18817 C CA . PRO D 1 474 ? 49.510 98.629 80.371 1.00 11.37 ? 494 PRO E CA 1 +ATOM 18818 C C . PRO D 1 474 ? 49.500 97.996 78.972 1.00 11.19 ? 494 PRO E C 1 +ATOM 18819 O O . PRO D 1 474 ? 48.454 97.984 78.308 1.00 11.40 ? 494 PRO E O 1 +ATOM 18820 C CB . PRO D 1 474 ? 49.818 100.128 80.284 1.00 11.72 ? 494 PRO E CB 1 +ATOM 18821 C CG . PRO D 1 474 ? 50.562 100.444 81.506 1.00 11.38 ? 494 PRO E CG 1 +ATOM 18822 C CD . PRO D 1 474 ? 51.411 99.214 81.760 1.00 11.60 ? 494 PRO E CD 1 +ATOM 18823 N N . TYR D 1 475 ? 50.637 97.469 78.536 1.00 10.93 ? 495 TYR E N 1 +ATOM 18824 C CA . TYR D 1 475 ? 50.835 97.058 77.153 1.00 10.90 ? 495 TYR E CA 1 +ATOM 18825 C C . TYR D 1 475 ? 50.596 95.595 76.859 1.00 10.32 ? 495 TYR E C 1 +ATOM 18826 O O . TYR D 1 475 ? 50.575 95.217 75.691 1.00 11.02 ? 495 TYR E O 1 +ATOM 18827 C CB . TYR D 1 475 ? 52.256 97.441 76.743 1.00 11.55 ? 495 TYR E CB 1 +ATOM 18828 C CG . TYR D 1 475 ? 52.485 98.908 76.971 1.00 12.29 ? 495 TYR E CG 1 +ATOM 18829 C CD1 . TYR D 1 475 ? 51.865 99.841 76.158 1.00 13.41 ? 495 TYR E CD1 1 +ATOM 18830 C CD2 . TYR D 1 475 ? 53.275 99.363 78.012 1.00 12.95 ? 495 TYR E CD2 1 +ATOM 18831 C CE1 . TYR D 1 475 ? 52.048 101.192 76.348 1.00 13.08 ? 495 TYR E CE1 1 +ATOM 18832 C CE2 . TYR D 1 475 ? 53.457 100.728 78.226 1.00 12.69 ? 495 TYR E CE2 1 +ATOM 18833 C CZ . TYR D 1 475 ? 52.837 101.637 77.383 1.00 13.26 ? 495 TYR E CZ 1 +ATOM 18834 O OH . TYR D 1 475 ? 53.009 102.999 77.551 1.00 14.55 ? 495 TYR E OH 1 +ATOM 18835 N N . VAL D 1 476 ? 50.435 94.767 77.895 1.00 10.32 ? 496 VAL E N 1 +ATOM 18836 C CA . VAL D 1 476 ? 50.230 93.336 77.695 1.00 10.13 ? 496 VAL E CA 1 +ATOM 18837 C C . VAL D 1 476 ? 48.764 92.998 77.456 1.00 10.31 ? 496 VAL E C 1 +ATOM 18838 O O . VAL D 1 476 ? 47.870 93.722 77.891 1.00 10.79 ? 496 VAL E O 1 +ATOM 18839 C CB . VAL D 1 476 ? 50.726 92.490 78.893 1.00 9.83 ? 496 VAL E CB 1 +ATOM 18840 C CG1 . VAL D 1 476 ? 52.223 92.683 79.096 1.00 10.23 ? 496 VAL E CG1 1 +ATOM 18841 C CG2 . VAL D 1 476 ? 49.929 92.798 80.164 1.00 10.41 ? 496 VAL E CG2 1 +ATOM 18842 N N . ASP D 1 477 ? 48.528 91.890 76.761 1.00 10.19 ? 497 ASP E N 1 +ATOM 18843 C CA . ASP D 1 477 ? 47.160 91.437 76.499 1.00 10.00 ? 497 ASP E CA 1 +ATOM 18844 C C . ASP D 1 477 ? 46.666 90.614 77.673 1.00 10.26 ? 497 ASP E C 1 +ATOM 18845 O O . ASP D 1 477 ? 45.461 90.621 77.986 1.00 10.24 ? 497 ASP E O 1 +ATOM 18846 C CB . ASP D 1 477 ? 47.109 90.601 75.221 1.00 10.22 ? 497 ASP E CB 1 +ATOM 18847 C CG . ASP D 1 477 ? 47.498 91.392 73.985 1.00 10.46 ? 497 ASP E CG 1 +ATOM 18848 O OD1 . ASP D 1 477 ? 47.251 92.615 73.933 1.00 13.79 ? 497 ASP E OD1 1 +ATOM 18849 O OD2 . ASP D 1 477 ? 48.050 90.785 73.053 1.00 11.54 ? 497 ASP E OD2 1 +ATOM 18850 N N . VAL D 1 478 ? 47.611 89.903 78.304 1.00 9.87 ? 498 VAL E N 1 +ATOM 18851 C CA . VAL D 1 478 ? 47.371 89.040 79.460 1.00 9.90 ? 498 VAL E CA 1 +ATOM 18852 C C . VAL D 1 478 ? 48.473 89.359 80.465 1.00 10.18 ? 498 VAL E C 1 +ATOM 18853 O O . VAL D 1 478 ? 49.639 89.473 80.085 1.00 9.46 ? 498 VAL E O 1 +ATOM 18854 C CB . VAL D 1 478 ? 47.429 87.550 79.050 1.00 9.52 ? 498 VAL E CB 1 +ATOM 18855 C CG1 . VAL D 1 478 ? 47.287 86.624 80.253 1.00 10.26 ? 498 VAL E CG1 1 +ATOM 18856 C CG2 . VAL D 1 478 ? 46.345 87.262 78.014 1.00 10.51 ? 498 VAL E CG2 1 +ATOM 18857 N N . ILE D 1 479 ? 48.089 89.534 81.724 1.00 10.48 ? 499 ILE E N 1 +ATOM 18858 C CA . ILE D 1 479 ? 49.033 89.813 82.806 1.00 10.44 ? 499 ILE E CA 1 +ATOM 18859 C C . ILE D 1 479 ? 49.538 88.471 83.361 1.00 10.39 ? 499 ILE E C 1 +ATOM 18860 O O . ILE D 1 479 ? 48.741 87.626 83.744 1.00 9.93 ? 499 ILE E O 1 +ATOM 18861 C CB . ILE D 1 479 ? 48.358 90.629 83.919 1.00 10.10 ? 499 ILE E CB 1 +ATOM 18862 C CG1 . ILE D 1 479 ? 48.009 92.033 83.412 1.00 11.74 ? 499 ILE E CG1 1 +ATOM 18863 C CG2 . ILE D 1 479 ? 49.258 90.751 85.135 1.00 10.14 ? 499 ILE E CG2 1 +ATOM 18864 C CD1 . ILE D 1 479 ? 47.012 92.770 84.288 1.00 13.40 ? 499 ILE E CD1 1 +ATOM 18865 N N . CYS D 1 480 ? 50.857 88.272 83.358 1.00 10.19 ? 500 CYS E N 1 +ATOM 18866 C CA . CYS D 1 480 ? 51.469 87.076 83.940 1.00 10.14 ? 500 CYS E CA 1 +ATOM 18867 C C . CYS D 1 480 ? 52.315 87.475 85.158 1.00 10.18 ? 500 CYS E C 1 +ATOM 18868 O O . CYS D 1 480 ? 53.252 88.270 85.037 1.00 9.80 ? 500 CYS E O 1 +ATOM 18869 C CB . CYS D 1 480 ? 52.326 86.363 82.898 1.00 10.15 ? 500 CYS E CB 1 +ATOM 18870 S SG . CYS D 1 480 ? 51.407 85.738 81.488 1.00 10.88 ? 500 CYS E SG 1 +ATOM 18871 N N . LEU D 1 481 ? 51.973 86.917 86.316 1.00 10.37 ? 501 LEU E N 1 +ATOM 18872 C CA . LEU D 1 481 ? 52.562 87.288 87.603 1.00 10.33 ? 501 LEU E CA 1 +ATOM 18873 C C . LEU D 1 481 ? 53.316 86.111 88.252 1.00 10.11 ? 501 LEU E C 1 +ATOM 18874 O O . LEU D 1 481 ? 52.823 84.977 88.293 1.00 9.61 ? 501 LEU E O 1 +ATOM 18875 C CB . LEU D 1 481 ? 51.450 87.736 88.564 1.00 10.65 ? 501 LEU E CB 1 +ATOM 18876 C CG . LEU D 1 481 ? 50.536 88.882 88.119 1.00 12.40 ? 501 LEU E CG 1 +ATOM 18877 C CD1 . LEU D 1 481 ? 49.442 89.144 89.162 1.00 12.95 ? 501 LEU E CD1 1 +ATOM 18878 C CD2 . LEU D 1 481 ? 51.322 90.152 87.831 1.00 11.82 ? 501 LEU E CD2 1 +ATOM 18879 N N . ASN D 1 482 ? 54.504 86.414 88.778 1.00 9.62 ? 502 ASN E N 1 +ATOM 18880 C CA . ASN D 1 482 ? 55.310 85.476 89.552 1.00 9.34 ? 502 ASN E CA 1 +ATOM 18881 C C . ASN D 1 482 ? 55.288 85.881 91.022 1.00 9.48 ? 502 ASN E C 1 +ATOM 18882 O O . ASN D 1 482 ? 55.538 87.037 91.349 1.00 10.65 ? 502 ASN E O 1 +ATOM 18883 C CB . ASN D 1 482 ? 56.771 85.499 89.094 1.00 8.69 ? 502 ASN E CB 1 +ATOM 18884 C CG . ASN D 1 482 ? 56.957 85.025 87.682 1.00 8.37 ? 502 ASN E CG 1 +ATOM 18885 O OD1 . ASN D 1 482 ? 56.048 84.454 87.068 1.00 7.96 ? 502 ASN E OD1 1 +ATOM 18886 N ND2 . ASN D 1 482 ? 58.163 85.232 87.155 1.00 9.37 ? 502 ASN E ND2 1 +ATOM 18887 N N . SER D 1 483 ? 54.977 84.939 91.911 1.00 9.51 ? 503 SER E N 1 +ATOM 18888 C CA . SER D 1 483 ? 55.078 85.214 93.327 1.00 9.11 ? 503 SER E CA 1 +ATOM 18889 C C . SER D 1 483 ? 55.388 83.936 94.114 1.00 9.36 ? 503 SER E C 1 +ATOM 18890 O O . SER D 1 483 ? 55.010 82.849 93.707 1.00 10.22 ? 503 SER E O 1 +ATOM 18891 C CB A SER D 1 483 ? 53.779 85.859 93.843 0.50 9.04 ? 503 SER E CB 1 +ATOM 18892 C CB B SER D 1 483 ? 53.804 85.861 93.836 0.50 9.46 ? 503 SER E CB 1 +ATOM 18893 O OG A SER D 1 483 ? 52.669 84.964 93.804 0.50 5.90 ? 503 SER E OG 1 +ATOM 18894 O OG B SER D 1 483 ? 54.035 86.355 95.130 0.50 10.50 ? 503 SER E OG 1 +ATOM 18895 N N . TYR D 1 484 ? 56.071 84.102 95.242 1.00 9.11 ? 504 TYR E N 1 +ATOM 18896 C CA . TYR D 1 484 ? 56.535 82.990 96.050 1.00 8.72 ? 504 TYR E CA 1 +ATOM 18897 C C . TYR D 1 484 ? 56.356 83.350 97.521 1.00 8.59 ? 504 TYR E C 1 +ATOM 18898 O O . TYR D 1 484 ? 57.323 83.420 98.291 1.00 7.64 ? 504 TYR E O 1 +ATOM 18899 C CB . TYR D 1 484 ? 58.013 82.730 95.774 1.00 8.57 ? 504 TYR E CB 1 +ATOM 18900 C CG . TYR D 1 484 ? 58.346 82.195 94.390 1.00 9.27 ? 504 TYR E CG 1 +ATOM 18901 C CD1 . TYR D 1 484 ? 58.502 83.054 93.295 1.00 10.55 ? 504 TYR E CD1 1 +ATOM 18902 C CD2 . TYR D 1 484 ? 58.553 80.836 94.189 1.00 8.85 ? 504 TYR E CD2 1 +ATOM 18903 C CE1 . TYR D 1 484 ? 58.843 82.549 92.025 1.00 10.17 ? 504 TYR E CE1 1 +ATOM 18904 C CE2 . TYR D 1 484 ? 58.891 80.332 92.942 1.00 10.02 ? 504 TYR E CE2 1 +ATOM 18905 C CZ . TYR D 1 484 ? 59.041 81.186 91.870 1.00 7.96 ? 504 TYR E CZ 1 +ATOM 18906 O OH . TYR D 1 484 ? 59.406 80.647 90.654 1.00 10.09 ? 504 TYR E OH 1 +ATOM 18907 N N . TYR D 1 485 ? 55.111 83.577 97.908 1.00 8.63 ? 505 TYR E N 1 +ATOM 18908 C CA . TYR D 1 485 ? 54.796 83.917 99.304 1.00 8.61 ? 505 TYR E CA 1 +ATOM 18909 C C . TYR D 1 485 ? 55.230 82.798 100.258 1.00 8.77 ? 505 TYR E C 1 +ATOM 18910 O O . TYR D 1 485 ? 55.101 81.598 99.949 1.00 9.41 ? 505 TYR E O 1 +ATOM 18911 C CB . TYR D 1 485 ? 53.298 84.248 99.465 1.00 8.83 ? 505 TYR E CB 1 +ATOM 18912 C CG . TYR D 1 485 ? 52.865 85.349 98.513 1.00 9.70 ? 505 TYR E CG 1 +ATOM 18913 C CD1 . TYR D 1 485 ? 53.550 86.550 98.483 1.00 9.33 ? 505 TYR E CD1 1 +ATOM 18914 C CD2 . TYR D 1 485 ? 51.810 85.172 97.609 1.00 10.34 ? 505 TYR E CD2 1 +ATOM 18915 C CE1 . TYR D 1 485 ? 53.198 87.568 97.609 1.00 10.42 ? 505 TYR E CE1 1 +ATOM 18916 C CE2 . TYR D 1 485 ? 51.446 86.199 96.719 1.00 9.40 ? 505 TYR E CE2 1 +ATOM 18917 C CZ . TYR D 1 485 ? 52.144 87.393 96.734 1.00 10.04 ? 505 TYR E CZ 1 +ATOM 18918 O OH . TYR D 1 485 ? 51.867 88.435 95.868 1.00 10.83 ? 505 TYR E OH 1 +ATOM 18919 N N . SER D 1 486 ? 55.792 83.224 101.390 1.00 8.97 ? 506 SER E N 1 +ATOM 18920 C CA . SER D 1 486 ? 56.393 82.349 102.409 1.00 8.70 ? 506 SER E CA 1 +ATOM 18921 C C . SER D 1 486 ? 57.746 81.766 101.994 1.00 9.68 ? 506 SER E C 1 +ATOM 18922 O O . SER D 1 486 ? 58.404 81.139 102.825 1.00 9.62 ? 506 SER E O 1 +ATOM 18923 C CB . SER D 1 486 ? 55.455 81.227 102.855 1.00 8.95 ? 506 SER E CB 1 +ATOM 18924 O OG . SER D 1 486 ? 55.522 80.115 101.983 1.00 7.28 ? 506 SER E OG 1 +ATOM 18925 N N . TRP D 1 487 ? 58.144 81.953 100.735 1.00 9.69 ? 507 TRP E N 1 +ATOM 18926 C CA . TRP D 1 487 ? 59.419 81.409 100.266 1.00 10.35 ? 507 TRP E CA 1 +ATOM 18927 C C . TRP D 1 487 ? 60.478 82.504 100.112 1.00 10.99 ? 507 TRP E C 1 +ATOM 18928 O O . TRP D 1 487 ? 61.531 82.450 100.764 1.00 11.08 ? 507 TRP E O 1 +ATOM 18929 C CB . TRP D 1 487 ? 59.296 80.598 98.961 1.00 9.98 ? 507 TRP E CB 1 +ATOM 18930 C CG . TRP D 1 487 ? 60.614 80.019 98.726 1.00 9.33 ? 507 TRP E CG 1 +ATOM 18931 C CD1 . TRP D 1 487 ? 61.628 80.566 98.013 1.00 9.78 ? 507 TRP E CD1 1 +ATOM 18932 C CD2 . TRP D 1 487 ? 61.142 78.857 99.361 1.00 9.66 ? 507 TRP E CD2 1 +ATOM 18933 N NE1 . TRP D 1 487 ? 62.751 79.791 98.121 1.00 8.47 ? 507 TRP E NE1 1 +ATOM 18934 C CE2 . TRP D 1 487 ? 62.483 78.738 98.956 1.00 10.05 ? 507 TRP E CE2 1 +ATOM 18935 C CE3 . TRP D 1 487 ? 60.603 77.887 100.218 1.00 9.25 ? 507 TRP E CE3 1 +ATOM 18936 C CZ2 . TRP D 1 487 ? 63.294 77.682 99.365 1.00 9.22 ? 507 TRP E CZ2 1 +ATOM 18937 C CZ3 . TRP D 1 487 ? 61.419 76.849 100.641 1.00 9.45 ? 507 TRP E CZ3 1 +ATOM 18938 C CH2 . TRP D 1 487 ? 62.746 76.756 100.213 1.00 9.40 ? 507 TRP E CH2 1 +ATOM 18939 N N . TYR D 1 488 ? 60.217 83.491 99.252 1.00 11.07 ? 508 TYR E N 1 +ATOM 18940 C CA . TYR D 1 488 ? 61.185 84.579 99.040 1.00 11.91 ? 508 TYR E CA 1 +ATOM 18941 C C . TYR D 1 488 ? 61.030 85.708 100.063 1.00 11.70 ? 508 TYR E C 1 +ATOM 18942 O O . TYR D 1 488 ? 61.829 86.650 100.091 1.00 12.10 ? 508 TYR E O 1 +ATOM 18943 C CB . TYR D 1 488 ? 61.096 85.131 97.605 1.00 12.05 ? 508 TYR E CB 1 +ATOM 18944 C CG . TYR D 1 488 ? 61.775 84.280 96.539 1.00 13.10 ? 508 TYR E CG 1 +ATOM 18945 C CD1 . TYR D 1 488 ? 63.057 83.757 96.732 1.00 13.04 ? 508 TYR E CD1 1 +ATOM 18946 C CD2 . TYR D 1 488 ? 61.154 84.023 95.324 1.00 12.51 ? 508 TYR E CD2 1 +ATOM 18947 C CE1 . TYR D 1 488 ? 63.677 82.993 95.760 1.00 13.11 ? 508 TYR E CE1 1 +ATOM 18948 C CE2 . TYR D 1 488 ? 61.781 83.261 94.340 1.00 13.53 ? 508 TYR E CE2 1 +ATOM 18949 C CZ . TYR D 1 488 ? 63.042 82.747 94.571 1.00 13.24 ? 508 TYR E CZ 1 +ATOM 18950 O OH . TYR D 1 488 ? 63.675 81.988 93.605 1.00 14.14 ? 508 TYR E OH 1 +ATOM 18951 N N . HIS D 1 489 ? 59.991 85.610 100.890 1.00 11.27 ? 509 HIS E N 1 +ATOM 18952 C CA . HIS D 1 489 ? 59.747 86.545 101.982 1.00 10.98 ? 509 HIS E CA 1 +ATOM 18953 C C . HIS D 1 489 ? 58.896 85.860 103.032 1.00 10.15 ? 509 HIS E C 1 +ATOM 18954 O O . HIS D 1 489 ? 58.239 84.849 102.748 1.00 9.93 ? 509 HIS E O 1 +ATOM 18955 C CB . HIS D 1 489 ? 59.055 87.835 101.489 1.00 11.78 ? 509 HIS E CB 1 +ATOM 18956 C CG . HIS D 1 489 ? 58.565 87.755 100.076 1.00 12.55 ? 509 HIS E CG 1 +ATOM 18957 N ND1 . HIS D 1 489 ? 57.383 87.137 99.727 1.00 16.26 ? 509 HIS E ND1 1 +ATOM 18958 C CD2 . HIS D 1 489 ? 59.128 88.170 98.916 1.00 15.38 ? 509 HIS E CD2 1 +ATOM 18959 C CE1 . HIS D 1 489 ? 57.231 87.192 98.416 1.00 16.32 ? 509 HIS E CE1 1 +ATOM 18960 N NE2 . HIS D 1 489 ? 58.277 87.807 97.898 1.00 16.08 ? 509 HIS E NE2 1 +ATOM 18961 N N . ASP D 1 490 ? 58.921 86.419 104.238 1.00 9.74 ? 510 ASP E N 1 +ATOM 18962 C CA . ASP D 1 490 ? 58.205 85.883 105.388 1.00 9.33 ? 510 ASP E CA 1 +ATOM 18963 C C . ASP D 1 490 ? 58.495 84.387 105.538 1.00 9.17 ? 510 ASP E C 1 +ATOM 18964 O O . ASP D 1 490 ? 57.588 83.563 105.573 1.00 8.86 ? 510 ASP E O 1 +ATOM 18965 C CB . ASP D 1 490 ? 56.719 86.127 105.248 1.00 9.63 ? 510 ASP E CB 1 +ATOM 18966 C CG . ASP D 1 490 ? 56.395 87.575 104.998 1.00 9.56 ? 510 ASP E CG 1 +ATOM 18967 O OD1 . ASP D 1 490 ? 56.797 88.424 105.807 1.00 7.80 ? 510 ASP E OD1 1 +ATOM 18968 O OD2 . ASP D 1 490 ? 55.752 87.856 103.977 1.00 10.99 ? 510 ASP E OD2 1 +ATOM 18969 N N . TYR D 1 491 ? 59.775 84.065 105.639 1.00 8.77 ? 511 TYR E N 1 +ATOM 18970 C CA . TYR D 1 491 ? 60.249 82.683 105.470 1.00 9.31 ? 511 TYR E CA 1 +ATOM 18971 C C . TYR D 1 491 ? 59.527 81.715 106.394 1.00 9.30 ? 511 TYR E C 1 +ATOM 18972 O O . TYR D 1 491 ? 59.546 81.882 107.606 1.00 9.42 ? 511 TYR E O 1 +ATOM 18973 C CB . TYR D 1 491 ? 61.764 82.598 105.705 1.00 9.45 ? 511 TYR E CB 1 +ATOM 18974 C CG . TYR D 1 491 ? 62.591 83.601 104.932 1.00 10.41 ? 511 TYR E CG 1 +ATOM 18975 C CD1 . TYR D 1 491 ? 62.364 83.835 103.576 1.00 10.20 ? 511 TYR E CD1 1 +ATOM 18976 C CD2 . TYR D 1 491 ? 63.626 84.299 105.548 1.00 10.47 ? 511 TYR E CD2 1 +ATOM 18977 C CE1 . TYR D 1 491 ? 63.125 84.775 102.869 1.00 10.95 ? 511 TYR E CE1 1 +ATOM 18978 C CE2 . TYR D 1 491 ? 64.384 85.225 104.856 1.00 10.74 ? 511 TYR E CE2 1 +ATOM 18979 C CZ . TYR D 1 491 ? 64.137 85.452 103.519 1.00 11.31 ? 511 TYR E CZ 1 +ATOM 18980 O OH . TYR D 1 491 ? 64.885 86.365 102.840 1.00 13.07 ? 511 TYR E OH 1 +ATOM 18981 N N . GLY D 1 492 ? 58.875 80.723 105.791 1.00 8.91 ? 512 GLY E N 1 +ATOM 18982 C CA . GLY D 1 492 ? 58.227 79.631 106.511 1.00 9.12 ? 512 GLY E CA 1 +ATOM 18983 C C . GLY D 1 492 ? 56.759 79.880 106.804 1.00 8.92 ? 512 GLY E C 1 +ATOM 18984 O O . GLY D 1 492 ? 56.073 78.991 107.297 1.00 9.05 ? 512 GLY E O 1 +ATOM 18985 N N . HIS D 1 493 ? 56.273 81.094 106.520 1.00 8.76 ? 513 HIS E N 1 +ATOM 18986 C CA . HIS D 1 493 ? 54.926 81.483 106.938 1.00 9.12 ? 513 HIS E CA 1 +ATOM 18987 C C . HIS D 1 493 ? 53.835 81.083 105.937 1.00 9.13 ? 513 HIS E C 1 +ATOM 18988 O O . HIS D 1 493 ? 53.248 81.930 105.232 1.00 8.82 ? 513 HIS E O 1 +ATOM 18989 C CB . HIS D 1 493 ? 54.890 82.967 107.256 1.00 9.39 ? 513 HIS E CB 1 +ATOM 18990 C CG . HIS D 1 493 ? 55.604 83.318 108.528 1.00 10.25 ? 513 HIS E CG 1 +ATOM 18991 N ND1 . HIS D 1 493 ? 54.957 83.401 109.743 1.00 11.28 ? 513 HIS E ND1 1 +ATOM 18992 C CD2 . HIS D 1 493 ? 56.902 83.621 108.771 1.00 12.26 ? 513 HIS E CD2 1 +ATOM 18993 C CE1 . HIS D 1 493 ? 55.831 83.724 110.682 1.00 13.93 ? 513 HIS E CE1 1 +ATOM 18994 N NE2 . HIS D 1 493 ? 57.017 83.860 110.119 1.00 12.55 ? 513 HIS E NE2 1 +ATOM 18995 N N . LEU D 1 494 ? 53.557 79.787 105.908 1.00 9.26 ? 514 LEU E N 1 +ATOM 18996 C CA . LEU D 1 494 ? 52.541 79.210 105.025 1.00 8.89 ? 514 LEU E CA 1 +ATOM 18997 C C . LEU D 1 494 ? 51.174 79.839 105.267 1.00 8.96 ? 514 LEU E C 1 +ATOM 18998 O O . LEU D 1 494 ? 50.340 79.867 104.359 1.00 9.12 ? 514 LEU E O 1 +ATOM 18999 C CB . LEU D 1 494 ? 52.435 77.697 105.244 1.00 8.66 ? 514 LEU E CB 1 +ATOM 19000 C CG . LEU D 1 494 ? 53.652 76.853 104.858 1.00 9.42 ? 514 LEU E CG 1 +ATOM 19001 C CD1 . LEU D 1 494 ? 53.549 75.467 105.468 1.00 9.13 ? 514 LEU E CD1 1 +ATOM 19002 C CD2 . LEU D 1 494 ? 53.765 76.770 103.354 1.00 8.88 ? 514 LEU E CD2 1 +ATOM 19003 N N . GLU D 1 495 ? 50.964 80.329 106.483 1.00 9.34 ? 515 GLU E N 1 +ATOM 19004 C CA . GLU D 1 495 ? 49.665 80.899 106.899 1.00 10.28 ? 515 GLU E CA 1 +ATOM 19005 C C . GLU D 1 495 ? 49.330 82.230 106.235 1.00 10.57 ? 515 GLU E C 1 +ATOM 19006 O O . GLU D 1 495 ? 48.187 82.710 106.337 1.00 10.68 ? 515 GLU E O 1 +ATOM 19007 C CB . GLU D 1 495 ? 49.621 81.062 108.427 1.00 10.16 ? 515 GLU E CB 1 +ATOM 19008 C CG . GLU D 1 495 ? 50.296 82.308 108.989 1.00 11.92 ? 515 GLU E CG 1 +ATOM 19009 C CD . GLU D 1 495 ? 51.779 82.135 109.236 1.00 13.55 ? 515 GLU E CD 1 +ATOM 19010 O OE1 . GLU D 1 495 ? 52.381 81.196 108.663 1.00 12.88 ? 515 GLU E OE1 1 +ATOM 19011 O OE2 . GLU D 1 495 ? 52.340 82.947 110.008 1.00 14.80 ? 515 GLU E OE2 1 +ATOM 19012 N N . LEU D 1 496 ? 50.324 82.847 105.596 1.00 10.46 ? 516 LEU E N 1 +ATOM 19013 C CA . LEU D 1 496 ? 50.157 84.144 104.938 1.00 10.39 ? 516 LEU E CA 1 +ATOM 19014 C C . LEU D 1 496 ? 49.784 84.038 103.460 1.00 10.15 ? 516 LEU E C 1 +ATOM 19015 O O . LEU D 1 496 ? 49.361 85.030 102.874 1.00 10.47 ? 516 LEU E O 1 +ATOM 19016 C CB . LEU D 1 496 ? 51.447 84.973 105.068 1.00 10.19 ? 516 LEU E CB 1 +ATOM 19017 C CG . LEU D 1 496 ? 51.923 85.235 106.495 1.00 10.67 ? 516 LEU E CG 1 +ATOM 19018 C CD1 . LEU D 1 496 ? 53.288 85.927 106.542 1.00 9.43 ? 516 LEU E CD1 1 +ATOM 19019 C CD2 . LEU D 1 496 ? 50.885 86.089 107.217 1.00 9.32 ? 516 LEU E CD2 1 +ATOM 19020 N N . ILE D 1 497 ? 49.926 82.855 102.864 1.00 10.40 ? 517 ILE E N 1 +ATOM 19021 C CA . ILE D 1 497 ? 49.818 82.716 101.411 1.00 10.20 ? 517 ILE E CA 1 +ATOM 19022 C C . ILE D 1 497 ? 48.438 83.122 100.879 1.00 11.12 ? 517 ILE E C 1 +ATOM 19023 O O . ILE D 1 497 ? 48.334 83.949 99.969 1.00 11.15 ? 517 ILE E O 1 +ATOM 19024 C CB . ILE D 1 497 ? 50.156 81.291 100.955 1.00 10.25 ? 517 ILE E CB 1 +ATOM 19025 C CG1 . ILE D 1 497 ? 51.644 81.014 101.186 1.00 9.07 ? 517 ILE E CG1 1 +ATOM 19026 C CG2 . ILE D 1 497 ? 49.817 81.113 99.494 1.00 7.19 ? 517 ILE E CG2 1 +ATOM 19027 C CD1 . ILE D 1 497 ? 52.006 79.512 101.205 1.00 7.96 ? 517 ILE E CD1 1 +ATOM 19028 N N . GLN D 1 498 ? 47.386 82.530 101.421 1.00 11.53 ? 518 GLN E N 1 +ATOM 19029 C CA . GLN D 1 498 ? 46.044 82.846 100.927 1.00 11.55 ? 518 GLN E CA 1 +ATOM 19030 C C . GLN D 1 498 ? 45.749 84.370 100.960 1.00 11.64 ? 518 GLN E C 1 +ATOM 19031 O O . GLN D 1 498 ? 45.255 84.942 99.976 1.00 11.44 ? 518 GLN E O 1 +ATOM 19032 C CB . GLN D 1 498 ? 44.989 82.049 101.700 1.00 11.56 ? 518 GLN E CB 1 +ATOM 19033 C CG . GLN D 1 498 ? 44.861 80.630 101.223 1.00 12.73 ? 518 GLN E CG 1 +ATOM 19034 C CD . GLN D 1 498 ? 43.632 79.954 101.763 1.00 14.17 ? 518 GLN E CD 1 +ATOM 19035 O OE1 . GLN D 1 498 ? 42.505 80.323 101.426 1.00 14.41 ? 518 GLN E OE1 1 +ATOM 19036 N NE2 . GLN D 1 498 ? 43.837 78.952 102.604 1.00 14.09 ? 518 GLN E NE2 1 +ATOM 19037 N N . LEU D 1 499 ? 46.085 85.013 102.071 1.00 11.39 ? 519 LEU E N 1 +ATOM 19038 C CA . LEU D 1 499 ? 45.864 86.450 102.260 1.00 11.94 ? 519 LEU E CA 1 +ATOM 19039 C C . LEU D 1 499 ? 46.653 87.258 101.230 1.00 11.96 ? 519 LEU E C 1 +ATOM 19040 O O . LEU D 1 499 ? 46.122 88.145 100.561 1.00 12.66 ? 519 LEU E O 1 +ATOM 19041 C CB . LEU D 1 499 ? 46.294 86.873 103.674 1.00 12.54 ? 519 LEU E CB 1 +ATOM 19042 C CG . LEU D 1 499 ? 46.162 88.351 104.062 1.00 12.60 ? 519 LEU E CG 1 +ATOM 19043 C CD1 . LEU D 1 499 ? 44.718 88.822 103.891 1.00 14.44 ? 519 LEU E CD1 1 +ATOM 19044 C CD2 . LEU D 1 499 ? 46.639 88.617 105.487 1.00 12.92 ? 519 LEU E CD2 1 +ATOM 19045 N N . GLN D 1 500 ? 47.944 86.975 101.109 1.00 11.47 ? 520 GLN E N 1 +ATOM 19046 C CA . GLN D 1 500 ? 48.758 87.809 100.227 1.00 11.17 ? 520 GLN E CA 1 +ATOM 19047 C C . GLN D 1 500 ? 48.401 87.579 98.766 1.00 11.24 ? 520 GLN E C 1 +ATOM 19048 O O . GLN D 1 500 ? 48.473 88.501 97.948 1.00 10.86 ? 520 GLN E O 1 +ATOM 19049 C CB . GLN D 1 500 ? 50.247 87.588 100.494 1.00 11.51 ? 520 GLN E CB 1 +ATOM 19050 C CG . GLN D 1 500 ? 50.682 88.117 101.852 1.00 10.15 ? 520 GLN E CG 1 +ATOM 19051 C CD . GLN D 1 500 ? 52.116 87.789 102.185 1.00 11.38 ? 520 GLN E CD 1 +ATOM 19052 O OE1 . GLN D 1 500 ? 52.807 87.138 101.405 1.00 12.01 ? 520 GLN E OE1 1 +ATOM 19053 N NE2 . GLN D 1 500 ? 52.574 88.231 103.353 1.00 8.19 ? 520 GLN E NE2 1 +ATOM 19054 N N . LEU D 1 501 ? 47.986 86.362 98.436 1.00 11.91 ? 521 LEU E N 1 +ATOM 19055 C CA . LEU D 1 501 ? 47.535 86.047 97.074 1.00 12.59 ? 521 LEU E CA 1 +ATOM 19056 C C . LEU D 1 501 ? 46.194 86.708 96.734 1.00 12.76 ? 521 LEU E C 1 +ATOM 19057 O O . LEU D 1 501 ? 45.993 87.165 95.604 1.00 13.35 ? 521 LEU E O 1 +ATOM 19058 C CB . LEU D 1 501 ? 47.445 84.527 96.880 1.00 13.01 ? 521 LEU E CB 1 +ATOM 19059 C CG . LEU D 1 501 ? 47.528 84.001 95.450 1.00 13.42 ? 521 LEU E CG 1 +ATOM 19060 C CD1 . LEU D 1 501 ? 48.843 84.370 94.786 1.00 15.09 ? 521 LEU E CD1 1 +ATOM 19061 C CD2 . LEU D 1 501 ? 47.361 82.473 95.477 1.00 13.33 ? 521 LEU E CD2 1 +ATOM 19062 N N . ALA D 1 502 ? 45.272 86.744 97.694 1.00 12.69 ? 522 ALA E N 1 +ATOM 19063 C CA . ALA D 1 502 ? 44.003 87.475 97.512 1.00 12.63 ? 522 ALA E CA 1 +ATOM 19064 C C . ALA D 1 502 ? 44.276 88.947 97.213 1.00 12.65 ? 522 ALA E C 1 +ATOM 19065 O O . ALA D 1 502 ? 43.706 89.517 96.278 1.00 12.12 ? 522 ALA E O 1 +ATOM 19066 C CB . ALA D 1 502 ? 43.118 87.340 98.752 1.00 12.75 ? 522 ALA E CB 1 +ATOM 19067 N N . THR D 1 503 ? 45.155 89.548 98.012 1.00 12.49 ? 523 THR E N 1 +ATOM 19068 C CA . THR D 1 503 ? 45.551 90.929 97.839 1.00 12.39 ? 523 THR E CA 1 +ATOM 19069 C C . THR D 1 503 ? 46.184 91.171 96.465 1.00 12.42 ? 523 THR E C 1 +ATOM 19070 O O . THR D 1 503 ? 45.850 92.141 95.775 1.00 11.93 ? 523 THR E O 1 +ATOM 19071 C CB . THR D 1 503 ? 46.493 91.351 98.972 1.00 12.77 ? 523 THR E CB 1 +ATOM 19072 O OG1 . THR D 1 503 ? 45.758 91.326 100.205 1.00 12.75 ? 523 THR E OG1 1 +ATOM 19073 C CG2 . THR D 1 503 ? 47.072 92.753 98.725 1.00 13.66 ? 523 THR E CG2 1 +ATOM 19074 N N . GLN D 1 504 ? 47.071 90.269 96.062 1.00 11.92 ? 524 GLN E N 1 +ATOM 19075 C CA . GLN D 1 504 ? 47.719 90.342 94.757 1.00 11.67 ? 524 GLN E CA 1 +ATOM 19076 C C . GLN D 1 504 ? 46.716 90.412 93.608 1.00 11.79 ? 524 GLN E C 1 +ATOM 19077 O O . GLN D 1 504 ? 46.789 91.304 92.765 1.00 12.10 ? 524 GLN E O 1 +ATOM 19078 C CB . GLN D 1 504 ? 48.582 89.091 94.571 1.00 11.59 ? 524 GLN E CB 1 +ATOM 19079 C CG . GLN D 1 504 ? 49.307 88.979 93.252 1.00 11.29 ? 524 GLN E CG 1 +ATOM 19080 C CD . GLN D 1 504 ? 49.892 87.583 93.077 1.00 10.89 ? 524 GLN E CD 1 +ATOM 19081 O OE1 . GLN D 1 504 ? 50.876 87.229 93.729 1.00 11.50 ? 524 GLN E OE1 1 +ATOM 19082 N NE2 . GLN D 1 504 ? 49.294 86.795 92.208 1.00 11.04 ? 524 GLN E NE2 1 +ATOM 19083 N N . PHE D 1 505 ? 45.796 89.453 93.567 1.00 11.98 ? 525 PHE E N 1 +ATOM 19084 C CA . PHE D 1 505 ? 44.808 89.383 92.488 1.00 12.14 ? 525 PHE E CA 1 +ATOM 19085 C C . PHE D 1 505 ? 43.868 90.582 92.493 1.00 12.45 ? 525 PHE E C 1 +ATOM 19086 O O . PHE D 1 505 ? 43.584 91.150 91.445 1.00 12.31 ? 525 PHE E O 1 +ATOM 19087 C CB . PHE D 1 505 ? 43.991 88.081 92.552 1.00 11.81 ? 525 PHE E CB 1 +ATOM 19088 C CG . PHE D 1 505 ? 44.788 86.831 92.221 1.00 12.31 ? 525 PHE E CG 1 +ATOM 19089 C CD1 . PHE D 1 505 ? 45.659 86.802 91.130 1.00 11.52 ? 525 PHE E CD1 1 +ATOM 19090 C CD2 . PHE D 1 505 ? 44.641 85.686 92.978 1.00 11.17 ? 525 PHE E CD2 1 +ATOM 19091 C CE1 . PHE D 1 505 ? 46.371 85.672 90.813 1.00 11.88 ? 525 PHE E CE1 1 +ATOM 19092 C CE2 . PHE D 1 505 ? 45.362 84.538 92.674 1.00 11.94 ? 525 PHE E CE2 1 +ATOM 19093 C CZ . PHE D 1 505 ? 46.238 84.530 91.591 1.00 11.59 ? 525 PHE E CZ 1 +ATOM 19094 N N . GLU D 1 506 ? 43.402 90.961 93.676 1.00 12.98 ? 526 GLU E N 1 +ATOM 19095 C CA . GLU D 1 506 ? 42.499 92.103 93.820 1.00 13.77 ? 526 GLU E CA 1 +ATOM 19096 C C . GLU D 1 506 ? 43.166 93.391 93.326 1.00 13.24 ? 526 GLU E C 1 +ATOM 19097 O O . GLU D 1 506 ? 42.567 94.153 92.573 1.00 12.90 ? 526 GLU E O 1 +ATOM 19098 C CB . GLU D 1 506 ? 42.078 92.259 95.289 1.00 14.49 ? 526 GLU E CB 1 +ATOM 19099 C CG . GLU D 1 506 ? 40.632 92.628 95.503 1.00 19.06 ? 526 GLU E CG 1 +ATOM 19100 C CD . GLU D 1 506 ? 40.328 92.846 96.970 1.00 22.40 ? 526 GLU E CD 1 +ATOM 19101 O OE1 . GLU D 1 506 ? 40.601 93.964 97.473 1.00 25.08 ? 526 GLU E OE1 1 +ATOM 19102 O OE2 . GLU D 1 506 ? 39.830 91.895 97.614 1.00 26.58 ? 526 GLU E OE2 1 +ATOM 19103 N N . ASN D 1 507 ? 44.410 93.628 93.738 1.00 12.39 ? 527 ASN E N 1 +ATOM 19104 C CA . ASN D 1 507 ? 45.139 94.837 93.325 1.00 12.87 ? 527 ASN E CA 1 +ATOM 19105 C C . ASN D 1 507 ? 45.421 94.884 91.822 1.00 12.70 ? 527 ASN E C 1 +ATOM 19106 O O . ASN D 1 507 ? 45.195 95.901 91.168 1.00 12.23 ? 527 ASN E O 1 +ATOM 19107 C CB . ASN D 1 507 ? 46.474 94.947 94.069 1.00 12.84 ? 527 ASN E CB 1 +ATOM 19108 C CG . ASN D 1 507 ? 46.307 95.279 95.533 1.00 14.82 ? 527 ASN E CG 1 +ATOM 19109 O OD1 . ASN D 1 507 ? 45.265 95.779 95.968 1.00 17.85 ? 527 ASN E OD1 1 +ATOM 19110 N ND2 . ASN D 1 507 ? 47.334 95.001 96.304 1.00 15.27 ? 527 ASN E ND2 1 +ATOM 19111 N N . TRP D 1 508 ? 45.922 93.776 91.286 1.00 12.80 ? 528 TRP E N 1 +ATOM 19112 C CA . TRP D 1 508 ? 46.265 93.711 89.876 1.00 13.16 ? 528 TRP E CA 1 +ATOM 19113 C C . TRP D 1 508 ? 45.031 93.895 89.007 1.00 13.63 ? 528 TRP E C 1 +ATOM 19114 O O . TRP D 1 508 ? 45.057 94.690 88.070 1.00 13.64 ? 528 TRP E O 1 +ATOM 19115 C CB . TRP D 1 508 ? 46.996 92.398 89.525 1.00 13.16 ? 528 TRP E CB 1 +ATOM 19116 C CG . TRP D 1 508 ? 48.486 92.469 89.780 1.00 13.14 ? 528 TRP E CG 1 +ATOM 19117 C CD1 . TRP D 1 508 ? 49.152 92.051 90.900 1.00 13.68 ? 528 TRP E CD1 1 +ATOM 19118 C CD2 . TRP D 1 508 ? 49.482 93.014 88.903 1.00 13.65 ? 528 TRP E CD2 1 +ATOM 19119 N NE1 . TRP D 1 508 ? 50.504 92.281 90.764 1.00 13.05 ? 528 TRP E NE1 1 +ATOM 19120 C CE2 . TRP D 1 508 ? 50.731 92.883 89.553 1.00 13.74 ? 528 TRP E CE2 1 +ATOM 19121 C CE3 . TRP D 1 508 ? 49.442 93.596 87.631 1.00 13.64 ? 528 TRP E CE3 1 +ATOM 19122 C CZ2 . TRP D 1 508 ? 51.929 93.303 88.962 1.00 14.01 ? 528 TRP E CZ2 1 +ATOM 19123 C CZ3 . TRP D 1 508 ? 50.632 94.020 87.051 1.00 14.07 ? 528 TRP E CZ3 1 +ATOM 19124 C CH2 . TRP D 1 508 ? 51.855 93.877 87.720 1.00 13.59 ? 528 TRP E CH2 1 +ATOM 19125 N N . TYR D 1 509 ? 43.950 93.189 89.322 1.00 14.20 ? 529 TYR E N 1 +ATOM 19126 C CA . TYR D 1 509 ? 42.769 93.239 88.458 1.00 14.80 ? 529 TYR E CA 1 +ATOM 19127 C C . TYR D 1 509 ? 42.027 94.568 88.558 1.00 15.63 ? 529 TYR E C 1 +ATOM 19128 O O . TYR D 1 509 ? 41.457 95.039 87.561 1.00 15.63 ? 529 TYR E O 1 +ATOM 19129 C CB . TYR D 1 509 ? 41.797 92.090 88.724 1.00 14.98 ? 529 TYR E CB 1 +ATOM 19130 C CG . TYR D 1 509 ? 40.857 91.891 87.547 1.00 14.23 ? 529 TYR E CG 1 +ATOM 19131 C CD1 . TYR D 1 509 ? 41.323 91.373 86.346 1.00 13.81 ? 529 TYR E CD1 1 +ATOM 19132 C CD2 . TYR D 1 509 ? 39.517 92.252 87.625 1.00 14.20 ? 529 TYR E CD2 1 +ATOM 19133 C CE1 . TYR D 1 509 ? 40.481 91.200 85.255 1.00 14.64 ? 529 TYR E CE1 1 +ATOM 19134 C CE2 . TYR D 1 509 ? 38.668 92.088 86.537 1.00 13.67 ? 529 TYR E CE2 1 +ATOM 19135 C CZ . TYR D 1 509 ? 39.157 91.562 85.352 1.00 14.29 ? 529 TYR E CZ 1 +ATOM 19136 O OH . TYR D 1 509 ? 38.323 91.390 84.260 1.00 15.60 ? 529 TYR E OH 1 +ATOM 19137 N N . LYS D 1 510 ? 42.013 95.164 89.749 1.00 16.23 ? 530 LYS E N 1 +ATOM 19138 C CA . LYS D 1 510 ? 41.390 96.473 89.914 1.00 17.88 ? 530 LYS E CA 1 +ATOM 19139 C C . LYS D 1 510 ? 42.075 97.476 88.995 1.00 17.86 ? 530 LYS E C 1 +ATOM 19140 O O . LYS D 1 510 ? 41.404 98.257 88.306 1.00 17.73 ? 530 LYS E O 1 +ATOM 19141 C CB . LYS D 1 510 ? 41.453 96.931 91.377 1.00 17.78 ? 530 LYS E CB 1 +ATOM 19142 C CG . LYS D 1 510 ? 40.643 98.184 91.692 1.00 19.91 ? 530 LYS E CG 1 +ATOM 19143 C CD . LYS D 1 510 ? 40.634 98.481 93.188 1.00 20.28 ? 530 LYS E CD 1 +ATOM 19144 C CE . LYS D 1 510 ? 39.525 99.469 93.553 1.00 23.54 ? 530 LYS E CE 1 +ATOM 19145 N NZ . LYS D 1 510 ? 39.567 100.704 92.725 1.00 24.93 ? 530 LYS E NZ 1 +ATOM 19146 N N . LYS D 1 511 ? 43.407 97.425 88.948 1.00 17.90 ? 531 LYS E N 1 +ATOM 19147 C CA . LYS D 1 511 ? 44.177 98.421 88.199 1.00 18.38 ? 531 LYS E CA 1 +ATOM 19148 C C . LYS D 1 511 ? 44.106 98.204 86.692 1.00 18.83 ? 531 LYS E C 1 +ATOM 19149 O O . LYS D 1 511 ? 43.988 99.177 85.936 1.00 18.40 ? 531 LYS E O 1 +ATOM 19150 C CB . LYS D 1 511 ? 45.638 98.449 88.663 1.00 18.34 ? 531 LYS E CB 1 +ATOM 19151 C CG . LYS D 1 511 ? 46.383 99.733 88.295 1.00 18.82 ? 531 LYS E CG 1 +ATOM 19152 C CD . LYS D 1 511 ? 47.734 99.808 88.997 1.00 19.23 ? 531 LYS E CD 1 +ATOM 19153 C CE . LYS D 1 511 ? 48.506 101.037 88.587 1.00 21.60 ? 531 LYS E CE 1 +ATOM 19154 N NZ . LYS D 1 511 ? 48.998 100.907 87.202 1.00 23.14 ? 531 LYS E NZ 1 +ATOM 19155 N N . TYR D 1 512 ? 44.162 96.939 86.255 1.00 19.39 ? 532 TYR E N 1 +ATOM 19156 C CA . TYR D 1 512 ? 44.345 96.628 84.832 1.00 20.14 ? 532 TYR E CA 1 +ATOM 19157 C C . TYR D 1 512 ? 43.171 95.998 84.086 1.00 19.93 ? 532 TYR E C 1 +ATOM 19158 O O . TYR D 1 512 ? 43.043 96.210 82.882 1.00 20.62 ? 532 TYR E O 1 +ATOM 19159 C CB . TYR D 1 512 ? 45.640 95.826 84.637 1.00 20.73 ? 532 TYR E CB 1 +ATOM 19160 C CG . TYR D 1 512 ? 46.835 96.721 84.851 1.00 21.84 ? 532 TYR E CG 1 +ATOM 19161 C CD1 . TYR D 1 512 ? 47.115 97.731 83.936 1.00 22.72 ? 532 TYR E CD1 1 +ATOM 19162 C CD2 . TYR D 1 512 ? 47.640 96.615 85.983 1.00 22.23 ? 532 TYR E CD2 1 +ATOM 19163 C CE1 . TYR D 1 512 ? 48.170 98.585 84.112 1.00 23.43 ? 532 TYR E CE1 1 +ATOM 19164 C CE2 . TYR D 1 512 ? 48.722 97.486 86.167 1.00 22.34 ? 532 TYR E CE2 1 +ATOM 19165 C CZ . TYR D 1 512 ? 48.966 98.467 85.216 1.00 21.71 ? 532 TYR E CZ 1 +ATOM 19166 O OH . TYR D 1 512 ? 50.008 99.353 85.334 1.00 24.57 ? 532 TYR E OH 1 +ATOM 19167 N N . GLN D 1 513 ? 42.325 95.237 84.777 1.00 19.36 ? 533 GLN E N 1 +ATOM 19168 C CA . GLN D 1 513 ? 41.124 94.634 84.177 1.00 18.53 ? 533 GLN E CA 1 +ATOM 19169 C C . GLN D 1 513 ? 41.461 93.771 82.952 1.00 17.28 ? 533 GLN E C 1 +ATOM 19170 O O . GLN D 1 513 ? 40.819 93.864 81.900 1.00 16.44 ? 533 GLN E O 1 +ATOM 19171 C CB . GLN D 1 513 ? 40.094 95.720 83.802 1.00 19.49 ? 533 GLN E CB 1 +ATOM 19172 C CG . GLN D 1 513 ? 39.853 96.786 84.883 1.00 22.02 ? 533 GLN E CG 1 +ATOM 19173 C CD . GLN D 1 513 ? 39.687 98.194 84.304 1.00 25.56 ? 533 GLN E CD 1 +ATOM 19174 O OE1 . GLN D 1 513 ? 38.639 98.822 84.461 1.00 29.43 ? 533 GLN E OE1 1 +ATOM 19175 N NE2 . GLN D 1 513 ? 40.722 98.690 83.632 1.00 28.24 ? 533 GLN E NE2 1 +ATOM 19176 N N . LYS D 1 514 ? 42.485 92.934 83.105 1.00 15.42 ? 534 LYS E N 1 +ATOM 19177 C CA . LYS D 1 514 ? 42.924 92.021 82.052 1.00 14.82 ? 534 LYS E CA 1 +ATOM 19178 C C . LYS D 1 514 ? 43.116 90.627 82.664 1.00 13.16 ? 534 LYS E C 1 +ATOM 19179 O O . LYS D 1 514 ? 43.424 90.527 83.853 1.00 12.92 ? 534 LYS E O 1 +ATOM 19180 C CB . LYS D 1 514 ? 44.227 92.550 81.428 1.00 14.71 ? 534 LYS E CB 1 +ATOM 19181 C CG . LYS D 1 514 ? 44.064 93.178 80.038 1.00 16.31 ? 534 LYS E CG 1 +ATOM 19182 C CD . LYS D 1 514 ? 44.869 94.480 79.773 1.00 16.51 ? 534 LYS E CD 1 +ATOM 19183 C CE . LYS D 1 514 ? 46.277 94.515 80.343 1.00 15.94 ? 534 LYS E CE 1 +ATOM 19184 N NZ . LYS D 1 514 ? 47.074 95.677 79.797 1.00 14.91 ? 534 LYS E NZ 1 +ATOM 19185 N N . PRO D 1 515 ? 42.939 89.550 81.869 1.00 12.24 ? 535 PRO E N 1 +ATOM 19186 C CA . PRO D 1 515 ? 43.066 88.201 82.440 1.00 11.57 ? 535 PRO E CA 1 +ATOM 19187 C C . PRO D 1 515 ? 44.455 88.003 83.033 1.00 10.59 ? 535 PRO E C 1 +ATOM 19188 O O . PRO D 1 515 ? 45.409 88.588 82.525 1.00 9.95 ? 535 PRO E O 1 +ATOM 19189 C CB . PRO D 1 515 ? 42.873 87.287 81.234 1.00 12.07 ? 535 PRO E CB 1 +ATOM 19190 C CG . PRO D 1 515 ? 42.092 88.136 80.254 1.00 12.66 ? 535 PRO E CG 1 +ATOM 19191 C CD . PRO D 1 515 ? 42.631 89.498 80.428 1.00 12.29 ? 535 PRO E CD 1 +ATOM 19192 N N . ILE D 1 516 ? 44.538 87.216 84.102 1.00 9.61 ? 536 ILE E N 1 +ATOM 19193 C CA . ILE D 1 516 ? 45.789 87.009 84.843 1.00 9.16 ? 536 ILE E CA 1 +ATOM 19194 C C . ILE D 1 516 ? 46.162 85.537 84.861 1.00 8.78 ? 536 ILE E C 1 +ATOM 19195 O O . ILE D 1 516 ? 45.303 84.652 85.071 1.00 8.24 ? 536 ILE E O 1 +ATOM 19196 C CB . ILE D 1 516 ? 45.692 87.534 86.302 1.00 9.11 ? 536 ILE E CB 1 +ATOM 19197 C CG1 . ILE D 1 516 ? 45.418 89.039 86.304 1.00 9.81 ? 536 ILE E CG1 1 +ATOM 19198 C CG2 . ILE D 1 516 ? 46.990 87.281 87.087 1.00 11.40 ? 536 ILE E CG2 1 +ATOM 19199 C CD1 . ILE D 1 516 ? 45.123 89.620 87.671 1.00 8.34 ? 536 ILE E CD1 1 +ATOM 19200 N N . ILE D 1 517 ? 47.456 85.281 84.652 1.00 8.07 ? 537 ILE E N 1 +ATOM 19201 C CA . ILE D 1 517 ? 48.010 83.954 84.810 1.00 8.19 ? 537 ILE E CA 1 +ATOM 19202 C C . ILE D 1 517 ? 49.000 84.027 85.964 1.00 7.42 ? 537 ILE E C 1 +ATOM 19203 O O . ILE D 1 517 ? 49.820 84.933 86.018 1.00 7.44 ? 537 ILE E O 1 +ATOM 19204 C CB . ILE D 1 517 ? 48.731 83.476 83.547 1.00 7.63 ? 537 ILE E CB 1 +ATOM 19205 C CG1 . ILE D 1 517 ? 47.727 83.280 82.404 1.00 7.90 ? 537 ILE E CG1 1 +ATOM 19206 C CG2 . ILE D 1 517 ? 49.463 82.174 83.811 1.00 9.01 ? 537 ILE E CG2 1 +ATOM 19207 C CD1 . ILE D 1 517 ? 48.325 82.633 81.144 1.00 8.93 ? 537 ILE E CD1 1 +ATOM 19208 N N . GLN D 1 518 ? 48.879 83.096 86.899 1.00 7.29 ? 538 GLN E N 1 +ATOM 19209 C CA . GLN D 1 518 ? 49.916 82.885 87.899 1.00 7.27 ? 538 GLN E CA 1 +ATOM 19210 C C . GLN D 1 518 ? 50.985 82.032 87.228 1.00 7.18 ? 538 GLN E C 1 +ATOM 19211 O O . GLN D 1 518 ? 50.863 80.797 87.151 1.00 6.39 ? 538 GLN E O 1 +ATOM 19212 C CB . GLN D 1 518 ? 49.334 82.181 89.128 1.00 7.70 ? 538 GLN E CB 1 +ATOM 19213 C CG . GLN D 1 518 ? 50.326 81.991 90.265 1.00 8.12 ? 538 GLN E CG 1 +ATOM 19214 C CD . GLN D 1 518 ? 50.655 83.260 91.011 1.00 9.58 ? 538 GLN E CD 1 +ATOM 19215 O OE1 . GLN D 1 518 ? 49.795 84.125 91.209 1.00 10.16 ? 538 GLN E OE1 1 +ATOM 19216 N NE2 . GLN D 1 518 ? 51.913 83.374 91.468 1.00 7.70 ? 538 GLN E NE2 1 +ATOM 19217 N N . SER D 1 519 ? 52.016 82.702 86.720 1.00 7.30 ? 539 SER E N 1 +ATOM 19218 C CA . SER D 1 519 ? 52.995 82.078 85.830 1.00 7.73 ? 539 SER E CA 1 +ATOM 19219 C C . SER D 1 519 ? 54.141 81.354 86.568 1.00 8.30 ? 539 SER E C 1 +ATOM 19220 O O . SER D 1 519 ? 54.826 80.523 85.972 1.00 8.15 ? 539 SER E O 1 +ATOM 19221 C CB . SER D 1 519 ? 53.566 83.118 84.869 1.00 8.00 ? 539 SER E CB 1 +ATOM 19222 O OG . SER D 1 519 ? 53.783 84.364 85.504 1.00 8.06 ? 539 SER E OG 1 +ATOM 19223 N N . GLU D 1 520 ? 54.333 81.678 87.847 1.00 8.68 ? 540 GLU E N 1 +ATOM 19224 C CA . GLU D 1 520 ? 55.274 80.976 88.718 1.00 8.51 ? 540 GLU E CA 1 +ATOM 19225 C C . GLU D 1 520 ? 54.835 81.008 90.184 1.00 8.47 ? 540 GLU E C 1 +ATOM 19226 O O . GLU D 1 520 ? 54.369 82.042 90.701 1.00 7.13 ? 540 GLU E O 1 +ATOM 19227 C CB . GLU D 1 520 ? 56.664 81.623 88.688 1.00 8.42 ? 540 GLU E CB 1 +ATOM 19228 C CG . GLU D 1 520 ? 57.397 81.630 87.371 1.00 8.88 ? 540 GLU E CG 1 +ATOM 19229 C CD . GLU D 1 520 ? 58.805 82.202 87.485 1.00 9.91 ? 540 GLU E CD 1 +ATOM 19230 O OE1 . GLU D 1 520 ? 59.361 82.292 88.611 1.00 9.35 ? 540 GLU E OE1 1 +ATOM 19231 O OE2 . GLU D 1 520 ? 59.370 82.557 86.436 1.00 9.67 ? 540 GLU E OE2 1 +ATOM 19232 N N . TYR D 1 521 ? 55.059 79.879 90.850 1.00 8.16 ? 541 TYR E N 1 +ATOM 19233 C CA . TYR D 1 521 ? 54.988 79.757 92.302 1.00 8.29 ? 541 TYR E CA 1 +ATOM 19234 C C . TYR D 1 521 ? 55.682 78.431 92.630 1.00 8.17 ? 541 TYR E C 1 +ATOM 19235 O O . TYR D 1 521 ? 55.782 77.542 91.765 1.00 9.22 ? 541 TYR E O 1 +ATOM 19236 C CB . TYR D 1 521 ? 53.538 79.770 92.823 1.00 9.21 ? 541 TYR E CB 1 +ATOM 19237 C CG . TYR D 1 521 ? 52.758 78.529 92.482 1.00 9.22 ? 541 TYR E CG 1 +ATOM 19238 C CD1 . TYR D 1 521 ? 52.220 78.346 91.214 1.00 9.69 ? 541 TYR E CD1 1 +ATOM 19239 C CD2 . TYR D 1 521 ? 52.589 77.502 93.416 1.00 9.40 ? 541 TYR E CD2 1 +ATOM 19240 C CE1 . TYR D 1 521 ? 51.526 77.190 90.887 1.00 10.53 ? 541 TYR E CE1 1 +ATOM 19241 C CE2 . TYR D 1 521 ? 51.905 76.335 93.095 1.00 8.53 ? 541 TYR E CE2 1 +ATOM 19242 C CZ . TYR D 1 521 ? 51.358 76.186 91.835 1.00 9.55 ? 541 TYR E CZ 1 +ATOM 19243 O OH . TYR D 1 521 ? 50.684 75.032 91.513 1.00 9.30 ? 541 TYR E OH 1 +ATOM 19244 N N . GLY D 1 522 ? 56.167 78.293 93.857 1.00 7.61 ? 542 GLY E N 1 +ATOM 19245 C CA . GLY D 1 522 ? 56.860 77.047 94.239 1.00 7.42 ? 542 GLY E CA 1 +ATOM 19246 C C . GLY D 1 522 ? 57.730 77.140 95.466 1.00 7.25 ? 542 GLY E C 1 +ATOM 19247 O O . GLY D 1 522 ? 57.781 78.168 96.125 1.00 6.72 ? 542 GLY E O 1 +ATOM 19248 N N . ALA D 1 523 ? 58.437 76.040 95.752 1.00 7.75 ? 543 ALA E N 1 +ATOM 19249 C CA . ALA D 1 523 ? 59.312 75.954 96.919 1.00 7.79 ? 543 ALA E CA 1 +ATOM 19250 C C . ALA D 1 523 ? 60.508 75.077 96.606 1.00 7.67 ? 543 ALA E C 1 +ATOM 19251 O O . ALA D 1 523 ? 60.334 74.000 96.057 1.00 7.86 ? 543 ALA E O 1 +ATOM 19252 C CB . ALA D 1 523 ? 58.535 75.349 98.096 1.00 8.19 ? 543 ALA E CB 1 +ATOM 19253 N N . GLU D 1 524 ? 61.717 75.513 96.965 1.00 6.98 ? 544 GLU E N 1 +ATOM 19254 C CA . GLU D 1 524 ? 62.879 74.632 96.817 1.00 6.56 ? 544 GLU E CA 1 +ATOM 19255 C C . GLU D 1 524 ? 62.670 73.435 97.729 1.00 6.55 ? 544 GLU E C 1 +ATOM 19256 O O . GLU D 1 524 ? 62.306 73.618 98.883 1.00 5.96 ? 544 GLU E O 1 +ATOM 19257 C CB . GLU D 1 524 ? 64.179 75.316 97.218 1.00 5.71 ? 544 GLU E CB 1 +ATOM 19258 C CG . GLU D 1 524 ? 64.524 76.624 96.504 1.00 5.96 ? 544 GLU E CG 1 +ATOM 19259 C CD . GLU D 1 524 ? 65.208 76.472 95.153 1.00 5.97 ? 544 GLU E CD 1 +ATOM 19260 O OE1 . GLU D 1 524 ? 65.879 75.450 94.894 1.00 7.82 ? 544 GLU E OE1 1 +ATOM 19261 O OE2 . GLU D 1 524 ? 65.095 77.420 94.347 1.00 7.98 ? 544 GLU E OE2 1 +ATOM 19262 N N . THR D 1 525 ? 62.911 72.237 97.202 1.00 6.89 ? 545 THR E N 1 +ATOM 19263 C CA . THR D 1 525 ? 62.544 70.973 97.856 1.00 7.03 ? 545 THR E CA 1 +ATOM 19264 C C . THR D 1 525 ? 63.582 69.906 97.535 1.00 7.55 ? 545 THR E C 1 +ATOM 19265 O O . THR D 1 525 ? 63.729 69.487 96.383 1.00 7.25 ? 545 THR E O 1 +ATOM 19266 C CB . THR D 1 525 ? 61.179 70.502 97.375 1.00 8.01 ? 545 THR E CB 1 +ATOM 19267 O OG1 . THR D 1 525 ? 60.243 71.573 97.515 1.00 7.19 ? 545 THR E OG1 1 +ATOM 19268 C CG2 . THR D 1 525 ? 60.700 69.284 98.182 1.00 7.21 ? 545 THR E CG2 1 +ATOM 19269 N N . ILE D 1 526 ? 64.314 69.494 98.561 1.00 8.42 ? 546 ILE E N 1 +ATOM 19270 C CA . ILE D 1 526 ? 65.313 68.449 98.428 1.00 8.92 ? 546 ILE E CA 1 +ATOM 19271 C C . ILE D 1 526 ? 64.599 67.134 98.691 1.00 8.84 ? 546 ILE E C 1 +ATOM 19272 O O . ILE D 1 526 ? 64.066 66.902 99.777 1.00 8.03 ? 546 ILE E O 1 +ATOM 19273 C CB . ILE D 1 526 ? 66.447 68.622 99.449 1.00 9.35 ? 546 ILE E CB 1 +ATOM 19274 C CG1 . ILE D 1 526 ? 66.996 70.051 99.409 1.00 10.32 ? 546 ILE E CG1 1 +ATOM 19275 C CG2 . ILE D 1 526 ? 67.546 67.577 99.210 1.00 10.59 ? 546 ILE E CG2 1 +ATOM 19276 C CD1 . ILE D 1 526 ? 67.729 70.372 98.165 1.00 11.39 ? 546 ILE E CD1 1 +ATOM 19277 N N . ALA D 1 527 ? 64.591 66.264 97.689 1.00 9.03 ? 547 ALA E N 1 +ATOM 19278 C CA . ALA D 1 527 ? 63.879 65.005 97.821 1.00 8.89 ? 547 ALA E CA 1 +ATOM 19279 C C . ALA D 1 527 ? 64.398 64.286 99.061 1.00 8.51 ? 547 ALA E C 1 +ATOM 19280 O O . ALA D 1 527 ? 65.607 64.221 99.316 1.00 6.52 ? 547 ALA E O 1 +ATOM 19281 C CB . ALA D 1 527 ? 64.060 64.143 96.566 1.00 9.74 ? 547 ALA E CB 1 +ATOM 19282 N N . GLY D 1 528 ? 63.465 63.788 99.858 1.00 8.77 ? 548 GLY E N 1 +ATOM 19283 C CA . GLY D 1 528 ? 63.810 63.002 101.027 1.00 9.28 ? 548 GLY E CA 1 +ATOM 19284 C C . GLY D 1 528 ? 63.928 63.780 102.319 1.00 9.21 ? 548 GLY E C 1 +ATOM 19285 O O . GLY D 1 528 ? 64.044 63.166 103.377 1.00 10.72 ? 548 GLY E O 1 +ATOM 19286 N N . PHE D 1 529 ? 63.930 65.113 102.257 1.00 8.38 ? 549 PHE E N 1 +ATOM 19287 C CA . PHE D 1 529 ? 63.902 65.925 103.472 1.00 7.98 ? 549 PHE E CA 1 +ATOM 19288 C C . PHE D 1 529 ? 62.456 65.974 103.933 1.00 8.33 ? 549 PHE E C 1 +ATOM 19289 O O . PHE D 1 529 ? 61.576 66.349 103.165 1.00 9.00 ? 549 PHE E O 1 +ATOM 19290 C CB . PHE D 1 529 ? 64.433 67.344 103.233 1.00 8.18 ? 549 PHE E CB 1 +ATOM 19291 C CG . PHE D 1 529 ? 65.937 67.439 103.312 1.00 8.01 ? 549 PHE E CG 1 +ATOM 19292 C CD1 . PHE D 1 529 ? 66.553 68.140 104.327 1.00 11.88 ? 549 PHE E CD1 1 +ATOM 19293 C CD2 . PHE D 1 529 ? 66.722 66.792 102.384 1.00 11.26 ? 549 PHE E CD2 1 +ATOM 19294 C CE1 . PHE D 1 529 ? 67.950 68.210 104.402 1.00 10.73 ? 549 PHE E CE1 1 +ATOM 19295 C CE2 . PHE D 1 529 ? 68.117 66.856 102.459 1.00 12.10 ? 549 PHE E CE2 1 +ATOM 19296 C CZ . PHE D 1 529 ? 68.713 67.548 103.470 1.00 10.17 ? 549 PHE E CZ 1 +ATOM 19297 N N . HIS D 1 530 ? 62.227 65.600 105.187 1.00 8.67 ? 550 HIS E N 1 +ATOM 19298 C CA . HIS D 1 530 ? 60.875 65.493 105.730 1.00 8.16 ? 550 HIS E CA 1 +ATOM 19299 C C . HIS D 1 530 ? 60.833 66.154 107.090 1.00 8.82 ? 550 HIS E C 1 +ATOM 19300 O O . HIS D 1 530 ? 61.785 66.082 107.861 1.00 8.80 ? 550 HIS E O 1 +ATOM 19301 C CB . HIS D 1 530 ? 60.473 64.024 105.911 1.00 8.83 ? 550 HIS E CB 1 +ATOM 19302 C CG . HIS D 1 530 ? 60.234 63.278 104.628 1.00 8.22 ? 550 HIS E CG 1 +ATOM 19303 N ND1 . HIS D 1 530 ? 59.099 63.457 103.870 1.00 10.69 ? 550 HIS E ND1 1 +ATOM 19304 C CD2 . HIS D 1 530 ? 60.961 62.325 103.997 1.00 9.93 ? 550 HIS E CD2 1 +ATOM 19305 C CE1 . HIS D 1 530 ? 59.144 62.663 102.816 1.00 8.64 ? 550 HIS E CE1 1 +ATOM 19306 N NE2 . HIS D 1 530 ? 60.266 61.966 102.868 1.00 10.75 ? 550 HIS E NE2 1 +ATOM 19307 N N . GLN D 1 531 ? 59.717 66.788 107.409 1.00 9.36 ? 551 GLN E N 1 +ATOM 19308 C CA . GLN D 1 531 ? 59.493 67.244 108.763 1.00 9.67 ? 551 GLN E CA 1 +ATOM 19309 C C . GLN D 1 531 ? 58.027 67.546 108.947 1.00 10.42 ? 551 GLN E C 1 +ATOM 19310 O O . GLN D 1 531 ? 57.348 67.973 108.001 1.00 11.30 ? 551 GLN E O 1 +ATOM 19311 C CB . GLN D 1 531 ? 60.353 68.462 109.137 1.00 9.97 ? 551 GLN E CB 1 +ATOM 19312 C CG . GLN D 1 531 ? 60.185 68.909 110.619 1.00 11.23 ? 551 GLN E CG 1 +ATOM 19313 C CD . GLN D 1 531 ? 61.467 69.365 111.304 1.00 13.46 ? 551 GLN E CD 1 +ATOM 19314 O OE1 . GLN D 1 531 ? 62.562 68.953 110.943 1.00 15.25 ? 551 GLN E OE1 1 +ATOM 19315 N NE2 . GLN D 1 531 ? 61.321 70.207 112.331 1.00 15.26 ? 551 GLN E NE2 1 +ATOM 19316 N N . ASP D 1 532 ? 57.550 67.254 110.157 1.00 10.13 ? 552 ASP E N 1 +ATOM 19317 C CA . ASP D 1 532 ? 56.287 67.773 110.663 1.00 10.36 ? 552 ASP E CA 1 +ATOM 19318 C C . ASP D 1 532 ? 56.541 68.388 112.029 1.00 10.13 ? 552 ASP E C 1 +ATOM 19319 O O . ASP D 1 532 ? 57.134 67.732 112.888 1.00 10.52 ? 552 ASP E O 1 +ATOM 19320 C CB . ASP D 1 532 ? 55.242 66.678 110.835 1.00 9.96 ? 552 ASP E CB 1 +ATOM 19321 C CG . ASP D 1 532 ? 53.865 67.259 111.146 1.00 11.73 ? 552 ASP E CG 1 +ATOM 19322 O OD1 . ASP D 1 532 ? 53.257 67.835 110.217 1.00 11.19 ? 552 ASP E OD1 1 +ATOM 19323 O OD2 . ASP D 1 532 ? 53.406 67.165 112.309 1.00 10.56 ? 552 ASP E OD2 1 +ATOM 19324 N N . PRO D 1 533 ? 56.086 69.637 112.249 1.00 10.45 ? 553 PRO E N 1 +ATOM 19325 C CA . PRO D 1 533 ? 55.478 70.547 111.273 1.00 10.51 ? 553 PRO E CA 1 +ATOM 19326 C C . PRO D 1 533 ? 56.438 70.882 110.133 1.00 10.88 ? 553 PRO E C 1 +ATOM 19327 O O . PRO D 1 533 ? 57.649 70.755 110.317 1.00 10.82 ? 553 PRO E O 1 +ATOM 19328 C CB . PRO D 1 533 ? 55.167 71.795 112.106 1.00 10.68 ? 553 PRO E CB 1 +ATOM 19329 C CG . PRO D 1 533 ? 55.143 71.325 113.502 1.00 10.66 ? 553 PRO E CG 1 +ATOM 19330 C CD . PRO D 1 533 ? 56.156 70.251 113.581 1.00 11.12 ? 553 PRO E CD 1 +ATOM 19331 N N . PRO D 1 534 ? 55.903 71.298 108.971 1.00 10.64 ? 554 PRO E N 1 +ATOM 19332 C CA . PRO D 1 534 ? 56.744 71.461 107.792 1.00 10.64 ? 554 PRO E CA 1 +ATOM 19333 C C . PRO D 1 534 ? 57.722 72.630 107.889 1.00 10.25 ? 554 PRO E C 1 +ATOM 19334 O O . PRO D 1 534 ? 57.396 73.696 108.443 1.00 10.20 ? 554 PRO E O 1 +ATOM 19335 C CB . PRO D 1 534 ? 55.732 71.650 106.648 1.00 10.65 ? 554 PRO E CB 1 +ATOM 19336 C CG . PRO D 1 534 ? 54.515 72.159 107.291 1.00 10.99 ? 554 PRO E CG 1 +ATOM 19337 C CD . PRO D 1 534 ? 54.489 71.610 108.689 1.00 10.91 ? 554 PRO E CD 1 +ATOM 19338 N N . LEU D 1 535 ? 58.922 72.404 107.357 1.00 10.44 ? 555 LEU E N 1 +ATOM 19339 C CA . LEU D 1 535 ? 59.949 73.423 107.245 1.00 10.56 ? 555 LEU E CA 1 +ATOM 19340 C C . LEU D 1 535 ? 60.394 73.597 105.793 1.00 10.02 ? 555 LEU E C 1 +ATOM 19341 O O . LEU D 1 535 ? 60.357 72.658 105.003 1.00 10.53 ? 555 LEU E O 1 +ATOM 19342 C CB . LEU D 1 535 ? 61.153 73.045 108.109 1.00 10.98 ? 555 LEU E CB 1 +ATOM 19343 C CG . LEU D 1 535 ? 60.898 73.044 109.610 1.00 9.71 ? 555 LEU E CG 1 +ATOM 19344 C CD1 . LEU D 1 535 ? 62.186 72.714 110.372 1.00 12.19 ? 555 LEU E CD1 1 +ATOM 19345 C CD2 . LEU D 1 535 ? 60.339 74.369 110.079 1.00 12.91 ? 555 LEU E CD2 1 +ATOM 19346 N N . MET D 1 536 ? 60.840 74.800 105.449 1.00 9.17 ? 556 MET E N 1 +ATOM 19347 C CA . MET D 1 536 ? 61.385 75.046 104.119 1.00 8.79 ? 556 MET E CA 1 +ATOM 19348 C C . MET D 1 536 ? 62.368 73.955 103.687 1.00 8.33 ? 556 MET E C 1 +ATOM 19349 O O . MET D 1 536 ? 63.162 73.504 104.497 1.00 8.43 ? 556 MET E O 1 +ATOM 19350 C CB . MET D 1 536 ? 62.067 76.409 104.077 1.00 9.09 ? 556 MET E CB 1 +ATOM 19351 C CG . MET D 1 536 ? 61.122 77.561 104.133 1.00 8.76 ? 556 MET E CG 1 +ATOM 19352 S SD . MET D 1 536 ? 61.934 79.175 104.230 1.00 10.03 ? 556 MET E SD 1 +ATOM 19353 C CE . MET D 1 536 ? 62.758 79.297 102.649 1.00 8.99 ? 556 MET E CE 1 +ATOM 19354 N N . PHE D 1 537 ? 62.276 73.541 102.421 1.00 7.55 ? 557 PHE E N 1 +ATOM 19355 C CA . PHE D 1 537 ? 63.124 72.514 101.784 1.00 7.46 ? 557 PHE E CA 1 +ATOM 19356 C C . PHE D 1 537 ? 62.620 71.091 101.943 1.00 7.03 ? 557 PHE E C 1 +ATOM 19357 O O . PHE D 1 537 ? 63.142 70.190 101.291 1.00 7.46 ? 557 PHE E O 1 +ATOM 19358 C CB . PHE D 1 537 ? 64.593 72.594 102.212 1.00 6.88 ? 557 PHE E CB 1 +ATOM 19359 C CG . PHE D 1 537 ? 65.290 73.824 101.734 1.00 6.17 ? 557 PHE E CG 1 +ATOM 19360 C CD1 . PHE D 1 537 ? 65.785 73.898 100.442 1.00 5.39 ? 557 PHE E CD1 1 +ATOM 19361 C CD2 . PHE D 1 537 ? 65.433 74.918 102.571 1.00 6.50 ? 557 PHE E CD2 1 +ATOM 19362 C CE1 . PHE D 1 537 ? 66.446 75.037 100.000 1.00 6.25 ? 557 PHE E CE1 1 +ATOM 19363 C CE2 . PHE D 1 537 ? 66.108 76.057 102.146 1.00 8.07 ? 557 PHE E CE2 1 +ATOM 19364 C CZ . PHE D 1 537 ? 66.617 76.116 100.854 1.00 6.82 ? 557 PHE E CZ 1 +ATOM 19365 N N . THR D 1 538 ? 61.598 70.888 102.776 1.00 7.31 ? 558 THR E N 1 +ATOM 19366 C CA . THR D 1 538 ? 61.007 69.562 102.934 1.00 7.13 ? 558 THR E CA 1 +ATOM 19367 C C . THR D 1 538 ? 59.926 69.299 101.894 1.00 7.30 ? 558 THR E C 1 +ATOM 19368 O O . THR D 1 538 ? 59.353 70.215 101.315 1.00 7.40 ? 558 THR E O 1 +ATOM 19369 C CB . THR D 1 538 ? 60.414 69.359 104.353 1.00 7.32 ? 558 THR E CB 1 +ATOM 19370 O OG1 . THR D 1 538 ? 59.320 70.260 104.586 1.00 6.51 ? 558 THR E OG1 1 +ATOM 19371 C CG2 . THR D 1 538 ? 61.487 69.580 105.405 1.00 5.81 ? 558 THR E CG2 1 +ATOM 19372 N N . GLU D 1 539 ? 59.634 68.032 101.658 1.00 7.42 ? 559 GLU E N 1 +ATOM 19373 C CA . GLU D 1 539 ? 58.572 67.708 100.726 1.00 7.60 ? 559 GLU E CA 1 +ATOM 19374 C C . GLU D 1 539 ? 57.228 68.171 101.290 1.00 7.65 ? 559 GLU E C 1 +ATOM 19375 O O . GLU D 1 539 ? 56.341 68.559 100.534 1.00 7.95 ? 559 GLU E O 1 +ATOM 19376 C CB . GLU D 1 539 ? 58.595 66.210 100.406 1.00 7.44 ? 559 GLU E CB 1 +ATOM 19377 C CG . GLU D 1 539 ? 59.902 65.771 99.735 1.00 8.45 ? 559 GLU E CG 1 +ATOM 19378 C CD . GLU D 1 539 ? 59.822 64.426 99.021 1.00 8.60 ? 559 GLU E CD 1 +ATOM 19379 O OE1 . GLU D 1 539 ? 58.745 64.078 98.485 1.00 14.14 ? 559 GLU E OE1 1 +ATOM 19380 O OE2 . GLU D 1 539 ? 60.854 63.743 98.937 1.00 7.18 ? 559 GLU E OE2 1 +ATOM 19381 N N . GLU D 1 540 ? 57.110 68.187 102.617 1.00 7.65 ? 560 GLU E N 1 +ATOM 19382 C CA . GLU D 1 540 ? 55.845 68.560 103.277 1.00 7.39 ? 560 GLU E CA 1 +ATOM 19383 C C . GLU D 1 540 ? 55.574 70.028 103.068 1.00 7.29 ? 560 GLU E C 1 +ATOM 19384 O O . GLU D 1 540 ? 54.422 70.427 102.897 1.00 7.37 ? 560 GLU E O 1 +ATOM 19385 C CB . GLU D 1 540 ? 55.845 68.247 104.773 1.00 7.04 ? 560 GLU E CB 1 +ATOM 19386 C CG . GLU D 1 540 ? 55.788 66.746 105.124 1.00 8.36 ? 560 GLU E CG 1 +ATOM 19387 C CD . GLU D 1 540 ? 57.051 66.023 104.741 1.00 10.23 ? 560 GLU E CD 1 +ATOM 19388 O OE1 . GLU D 1 540 ? 58.123 66.645 104.841 1.00 8.71 ? 560 GLU E OE1 1 +ATOM 19389 O OE2 . GLU D 1 540 ? 56.981 64.834 104.354 1.00 7.98 ? 560 GLU E OE2 1 +ATOM 19390 N N . TYR D 1 541 ? 56.638 70.823 103.083 1.00 6.84 ? 561 TYR E N 1 +ATOM 19391 C CA . TYR D 1 541 ? 56.537 72.262 102.877 1.00 6.81 ? 561 TYR E CA 1 +ATOM 19392 C C . TYR D 1 541 ? 56.147 72.568 101.432 1.00 7.28 ? 561 TYR E C 1 +ATOM 19393 O O . TYR D 1 541 ? 55.315 73.452 101.169 1.00 8.10 ? 561 TYR E O 1 +ATOM 19394 C CB . TYR D 1 541 ? 57.862 72.948 103.231 1.00 6.45 ? 561 TYR E CB 1 +ATOM 19395 C CG . TYR D 1 541 ? 57.674 74.440 103.379 1.00 6.10 ? 561 TYR E CG 1 +ATOM 19396 C CD1 . TYR D 1 541 ? 57.681 75.271 102.273 1.00 6.96 ? 561 TYR E CD1 1 +ATOM 19397 C CD2 . TYR D 1 541 ? 57.399 75.002 104.618 1.00 6.56 ? 561 TYR E CD2 1 +ATOM 19398 C CE1 . TYR D 1 541 ? 57.483 76.646 102.406 1.00 7.44 ? 561 TYR E CE1 1 +ATOM 19399 C CE2 . TYR D 1 541 ? 57.196 76.360 104.762 1.00 8.40 ? 561 TYR E CE2 1 +ATOM 19400 C CZ . TYR D 1 541 ? 57.228 77.181 103.659 1.00 7.78 ? 561 TYR E CZ 1 +ATOM 19401 O OH . TYR D 1 541 ? 57.002 78.537 103.817 1.00 7.60 ? 561 TYR E OH 1 +ATOM 19402 N N . GLN D 1 542 ? 56.720 71.829 100.479 1.00 7.72 ? 562 GLN E N 1 +ATOM 19403 C CA . GLN D 1 542 ? 56.303 71.994 99.085 1.00 8.26 ? 562 GLN E CA 1 +ATOM 19404 C C . GLN D 1 542 ? 54.820 71.695 98.913 1.00 8.79 ? 562 GLN E C 1 +ATOM 19405 O O . GLN D 1 542 ? 54.092 72.486 98.317 1.00 9.87 ? 562 GLN E O 1 +ATOM 19406 C CB . GLN D 1 542 ? 57.091 71.118 98.131 1.00 8.46 ? 562 GLN E CB 1 +ATOM 19407 C CG . GLN D 1 542 ? 56.956 71.534 96.660 1.00 8.21 ? 562 GLN E CG 1 +ATOM 19408 C CD . GLN D 1 542 ? 57.745 70.615 95.750 1.00 8.97 ? 562 GLN E CD 1 +ATOM 19409 O OE1 . GLN D 1 542 ? 57.979 69.447 96.077 1.00 8.76 ? 562 GLN E OE1 1 +ATOM 19410 N NE2 . GLN D 1 542 ? 58.183 71.140 94.615 1.00 8.44 ? 562 GLN E NE2 1 +ATOM 19411 N N . LYS D 1 543 ? 54.369 70.580 99.472 1.00 9.18 ? 563 LYS E N 1 +ATOM 19412 C CA . LYS D 1 543 ? 52.948 70.225 99.421 1.00 10.28 ? 563 LYS E CA 1 +ATOM 19413 C C . LYS D 1 543 ? 52.057 71.335 99.993 1.00 10.59 ? 563 LYS E C 1 +ATOM 19414 O O . LYS D 1 543 ? 51.043 71.722 99.378 1.00 11.38 ? 563 LYS E O 1 +ATOM 19415 C CB . LYS D 1 543 ? 52.725 68.901 100.157 1.00 10.63 ? 563 LYS E CB 1 +ATOM 19416 C CG . LYS D 1 543 ? 53.249 67.712 99.361 1.00 13.07 ? 563 LYS E CG 1 +ATOM 19417 C CD . LYS D 1 543 ? 52.970 66.379 100.029 1.00 15.76 ? 563 LYS E CD 1 +ATOM 19418 C CE . LYS D 1 543 ? 51.489 66.129 100.178 1.00 17.19 ? 563 LYS E CE 1 +ATOM 19419 N NZ . LYS D 1 543 ? 50.945 64.742 100.117 0.00 19.07 ? 563 LYS E NZ 1 +ATOM 19420 N N . SER D 1 544 ? 52.438 71.850 101.155 1.00 10.25 ? 564 SER E N 1 +ATOM 19421 C CA . SER D 1 544 ? 51.608 72.812 101.876 1.00 10.05 ? 564 SER E CA 1 +ATOM 19422 C C . SER D 1 544 ? 51.567 74.155 101.152 1.00 10.08 ? 564 SER E C 1 +ATOM 19423 O O . SER D 1 544 ? 50.498 74.748 100.993 1.00 10.25 ? 564 SER E O 1 +ATOM 19424 C CB A SER D 1 544 ? 52.127 73.009 103.301 0.50 10.02 ? 564 SER E CB 1 +ATOM 19425 C CB B SER D 1 544 ? 52.113 72.969 103.308 0.50 10.17 ? 564 SER E CB 1 +ATOM 19426 O OG A SER D 1 544 ? 51.185 73.714 104.095 0.50 9.00 ? 564 SER E OG 1 +ATOM 19427 O OG B SER D 1 544 ? 52.017 71.728 103.995 0.50 10.56 ? 564 SER E OG 1 +ATOM 19428 N N . LEU D 1 545 ? 52.721 74.618 100.683 1.00 9.36 ? 565 LEU E N 1 +ATOM 19429 C CA . LEU D 1 545 ? 52.771 75.824 99.871 1.00 9.35 ? 565 LEU E CA 1 +ATOM 19430 C C . LEU D 1 545 ? 51.876 75.669 98.628 1.00 9.26 ? 565 LEU E C 1 +ATOM 19431 O O . LEU D 1 545 ? 51.107 76.569 98.306 1.00 10.06 ? 565 LEU E O 1 +ATOM 19432 C CB . LEU D 1 545 ? 54.221 76.171 99.493 1.00 9.20 ? 565 LEU E CB 1 +ATOM 19433 C CG . LEU D 1 545 ? 54.406 77.447 98.665 1.00 8.25 ? 565 LEU E CG 1 +ATOM 19434 C CD1 . LEU D 1 545 ? 55.692 78.210 99.068 1.00 8.40 ? 565 LEU E CD1 1 +ATOM 19435 C CD2 . LEU D 1 545 ? 54.374 77.126 97.158 1.00 7.44 ? 565 LEU E CD2 1 +ATOM 19436 N N . LEU D 1 546 ? 51.962 74.524 97.952 1.00 9.81 ? 566 LEU E N 1 +ATOM 19437 C CA . LEU D 1 546 ? 51.108 74.245 96.791 1.00 9.71 ? 566 LEU E CA 1 +ATOM 19438 C C . LEU D 1 546 ? 49.631 74.283 97.186 1.00 9.74 ? 566 LEU E C 1 +ATOM 19439 O O . LEU D 1 546 ? 48.824 74.979 96.549 1.00 8.44 ? 566 LEU E O 1 +ATOM 19440 C CB . LEU D 1 546 ? 51.449 72.892 96.144 1.00 9.33 ? 566 LEU E CB 1 +ATOM 19441 C CG . LEU D 1 546 ? 52.437 73.022 94.978 1.00 10.11 ? 566 LEU E CG 1 +ATOM 19442 C CD1 . LEU D 1 546 ? 53.680 73.889 95.331 1.00 11.06 ? 566 LEU E CD1 1 +ATOM 19443 C CD2 . LEU D 1 546 ? 52.841 71.675 94.469 1.00 11.33 ? 566 LEU E CD2 1 +ATOM 19444 N N . GLU D 1 547 ? 49.282 73.563 98.251 1.00 9.92 ? 567 GLU E N 1 +ATOM 19445 C CA . GLU D 1 547 ? 47.888 73.547 98.735 1.00 10.43 ? 567 GLU E CA 1 +ATOM 19446 C C . GLU D 1 547 ? 47.341 74.952 98.975 1.00 10.85 ? 567 GLU E C 1 +ATOM 19447 O O . GLU D 1 547 ? 46.211 75.254 98.598 1.00 10.83 ? 567 GLU E O 1 +ATOM 19448 C CB . GLU D 1 547 ? 47.800 72.770 100.038 1.00 10.91 ? 567 GLU E CB 1 +ATOM 19449 C CG . GLU D 1 547 ? 47.859 71.274 99.854 1.00 13.21 ? 567 GLU E CG 1 +ATOM 19450 C CD . GLU D 1 547 ? 48.010 70.521 101.165 1.00 15.55 ? 567 GLU E CD 1 +ATOM 19451 O OE1 . GLU D 1 547 ? 48.318 71.158 102.197 1.00 17.85 ? 567 GLU E OE1 1 +ATOM 19452 O OE2 . GLU D 1 547 ? 47.839 69.281 101.149 1.00 18.94 ? 567 GLU E OE2 1 +ATOM 19453 N N . GLN D 1 548 ? 48.127 75.801 99.627 1.00 10.48 ? 568 GLN E N 1 +ATOM 19454 C CA . GLN D 1 548 ? 47.676 77.151 99.932 1.00 10.97 ? 568 GLN E CA 1 +ATOM 19455 C C . GLN D 1 548 ? 47.544 77.981 98.659 1.00 10.59 ? 568 GLN E C 1 +ATOM 19456 O O . GLN D 1 548 ? 46.585 78.761 98.522 1.00 10.64 ? 568 GLN E O 1 +ATOM 19457 C CB . GLN D 1 548 ? 48.600 77.821 100.959 1.00 10.94 ? 568 GLN E CB 1 +ATOM 19458 C CG . GLN D 1 548 ? 48.590 77.105 102.302 1.00 11.75 ? 568 GLN E CG 1 +ATOM 19459 C CD . GLN D 1 548 ? 47.193 77.078 102.898 1.00 11.44 ? 568 GLN E CD 1 +ATOM 19460 O OE1 . GLN D 1 548 ? 46.557 78.123 103.020 1.00 11.82 ? 568 GLN E OE1 1 +ATOM 19461 N NE2 . GLN D 1 548 ? 46.716 75.900 103.254 1.00 12.39 ? 568 GLN E NE2 1 +ATOM 19462 N N . TYR D 1 549 ? 48.488 77.821 97.723 1.00 9.94 ? 569 TYR E N 1 +ATOM 19463 C CA . TYR D 1 549 ? 48.385 78.530 96.451 1.00 9.85 ? 569 TYR E CA 1 +ATOM 19464 C C . TYR D 1 549 ? 47.134 78.101 95.695 1.00 9.40 ? 569 TYR E C 1 +ATOM 19465 O O . TYR D 1 549 ? 46.424 78.929 95.097 1.00 8.90 ? 569 TYR E O 1 +ATOM 19466 C CB . TYR D 1 549 ? 49.642 78.336 95.583 1.00 10.30 ? 569 TYR E CB 1 +ATOM 19467 C CG . TYR D 1 549 ? 50.578 79.514 95.676 1.00 10.46 ? 569 TYR E CG 1 +ATOM 19468 C CD1 . TYR D 1 549 ? 51.481 79.640 96.736 1.00 11.91 ? 569 TYR E CD1 1 +ATOM 19469 C CD2 . TYR D 1 549 ? 50.525 80.544 94.734 1.00 9.69 ? 569 TYR E CD2 1 +ATOM 19470 C CE1 . TYR D 1 549 ? 52.332 80.740 96.823 1.00 10.70 ? 569 TYR E CE1 1 +ATOM 19471 C CE2 . TYR D 1 549 ? 51.360 81.635 94.814 1.00 10.66 ? 569 TYR E CE2 1 +ATOM 19472 C CZ . TYR D 1 549 ? 52.262 81.735 95.860 1.00 10.70 ? 569 TYR E CZ 1 +ATOM 19473 O OH . TYR D 1 549 ? 53.077 82.838 95.931 1.00 10.95 ? 569 TYR E OH 1 +ATOM 19474 N N . HIS D 1 550 ? 46.872 76.805 95.706 1.00 8.53 ? 570 HIS E N 1 +ATOM 19475 C CA . HIS D 1 550 ? 45.715 76.263 95.000 1.00 8.43 ? 570 HIS E CA 1 +ATOM 19476 C C . HIS D 1 550 ? 44.401 76.826 95.539 1.00 9.45 ? 570 HIS E C 1 +ATOM 19477 O O . HIS D 1 550 ? 43.512 77.189 94.759 1.00 9.73 ? 570 HIS E O 1 +ATOM 19478 C CB . HIS D 1 550 ? 45.765 74.736 95.040 1.00 8.37 ? 570 HIS E CB 1 +ATOM 19479 C CG . HIS D 1 550 ? 46.974 74.174 94.360 1.00 7.63 ? 570 HIS E CG 1 +ATOM 19480 N ND1 . HIS D 1 550 ? 47.420 72.885 94.562 1.00 8.24 ? 570 HIS E ND1 1 +ATOM 19481 C CD2 . HIS D 1 550 ? 47.835 74.737 93.481 1.00 8.30 ? 570 HIS E CD2 1 +ATOM 19482 C CE1 . HIS D 1 550 ? 48.506 72.681 93.833 1.00 8.00 ? 570 HIS E CE1 1 +ATOM 19483 N NE2 . HIS D 1 550 ? 48.778 73.788 93.169 1.00 8.18 ? 570 HIS E NE2 1 +ATOM 19484 N N . LEU D 1 551 ? 44.304 76.931 96.861 1.00 10.05 ? 571 LEU E N 1 +ATOM 19485 C CA . LEU D 1 551 ? 43.118 77.498 97.513 1.00 10.00 ? 571 LEU E CA 1 +ATOM 19486 C C . LEU D 1 551 ? 42.880 78.951 97.111 1.00 10.35 ? 571 LEU E C 1 +ATOM 19487 O O . LEU D 1 551 ? 41.738 79.352 96.881 1.00 10.50 ? 571 LEU E O 1 +ATOM 19488 C CB . LEU D 1 551 ? 43.237 77.403 99.027 1.00 10.05 ? 571 LEU E CB 1 +ATOM 19489 C CG . LEU D 1 551 ? 43.034 75.996 99.596 1.00 10.27 ? 571 LEU E CG 1 +ATOM 19490 C CD1 . LEU D 1 551 ? 43.459 75.959 101.039 1.00 12.33 ? 571 LEU E CD1 1 +ATOM 19491 C CD2 . LEU D 1 551 ? 41.562 75.557 99.426 1.00 11.54 ? 571 LEU E CD2 1 +ATOM 19492 N N . GLY D 1 552 ? 43.951 79.733 97.034 1.00 10.69 ? 572 GLY E N 1 +ATOM 19493 C CA . GLY D 1 552 ? 43.869 81.117 96.561 1.00 10.51 ? 572 GLY E CA 1 +ATOM 19494 C C . GLY D 1 552 ? 43.477 81.190 95.097 1.00 10.81 ? 572 GLY E C 1 +ATOM 19495 O O . GLY D 1 552 ? 42.620 82.000 94.710 1.00 11.00 ? 572 GLY E O 1 +ATOM 19496 N N . LEU D 1 553 ? 44.091 80.348 94.271 1.00 10.26 ? 573 LEU E N 1 +ATOM 19497 C CA . LEU D 1 553 ? 43.738 80.279 92.854 1.00 9.99 ? 573 LEU E CA 1 +ATOM 19498 C C . LEU D 1 553 ? 42.266 79.920 92.663 1.00 10.47 ? 573 LEU E C 1 +ATOM 19499 O O . LEU D 1 553 ? 41.600 80.458 91.777 1.00 10.63 ? 573 LEU E O 1 +ATOM 19500 C CB . LEU D 1 553 ? 44.607 79.251 92.118 1.00 9.85 ? 573 LEU E CB 1 +ATOM 19501 C CG . LEU D 1 553 ? 46.055 79.707 91.927 1.00 9.56 ? 573 LEU E CG 1 +ATOM 19502 C CD1 . LEU D 1 553 ? 46.985 78.539 91.533 1.00 9.10 ? 573 LEU E CD1 1 +ATOM 19503 C CD2 . LEU D 1 553 ? 46.114 80.833 90.883 1.00 9.08 ? 573 LEU E CD2 1 +ATOM 19504 N N . ASP D 1 554 ? 41.775 79.004 93.496 1.00 10.32 ? 574 ASP E N 1 +ATOM 19505 C CA . ASP D 1 554 ? 40.381 78.560 93.445 1.00 10.75 ? 574 ASP E CA 1 +ATOM 19506 C C . ASP D 1 554 ? 39.395 79.710 93.569 1.00 11.14 ? 574 ASP E C 1 +ATOM 19507 O O . ASP D 1 554 ? 38.307 79.643 92.997 1.00 11.76 ? 574 ASP E O 1 +ATOM 19508 C CB . ASP D 1 554 ? 40.102 77.533 94.541 1.00 10.27 ? 574 ASP E CB 1 +ATOM 19509 C CG . ASP D 1 554 ? 40.635 76.155 94.197 1.00 11.06 ? 574 ASP E CG 1 +ATOM 19510 O OD1 . ASP D 1 554 ? 41.156 75.982 93.079 1.00 10.43 ? 574 ASP E OD1 1 +ATOM 19511 O OD2 . ASP D 1 554 ? 40.514 75.238 95.031 1.00 11.83 ? 574 ASP E OD2 1 +ATOM 19512 N N . GLN D 1 555 ? 39.772 80.748 94.316 1.00 11.79 ? 575 GLN E N 1 +ATOM 19513 C CA . GLN D 1 555 ? 38.891 81.899 94.543 1.00 13.11 ? 575 GLN E CA 1 +ATOM 19514 C C . GLN D 1 555 ? 38.735 82.797 93.327 1.00 13.36 ? 575 GLN E C 1 +ATOM 19515 O O . GLN D 1 555 ? 37.817 83.613 93.285 1.00 13.27 ? 575 GLN E O 1 +ATOM 19516 C CB . GLN D 1 555 ? 39.396 82.736 95.716 1.00 13.51 ? 575 GLN E CB 1 +ATOM 19517 C CG . GLN D 1 555 ? 39.267 82.049 97.075 1.00 15.87 ? 575 GLN E CG 1 +ATOM 19518 C CD . GLN D 1 555 ? 37.827 81.773 97.437 1.00 19.19 ? 575 GLN E CD 1 +ATOM 19519 O OE1 . GLN D 1 555 ? 36.983 82.676 97.407 1.00 19.98 ? 575 GLN E OE1 1 +ATOM 19520 N NE2 . GLN D 1 555 ? 37.525 80.514 97.729 1.00 19.88 ? 575 GLN E NE2 1 +ATOM 19521 N N . LYS D 1 556 ? 39.632 82.677 92.351 1.00 13.18 ? 576 LYS E N 1 +ATOM 19522 C CA . LYS D 1 556 ? 39.581 83.544 91.175 1.00 13.73 ? 576 LYS E CA 1 +ATOM 19523 C C . LYS D 1 556 ? 39.615 82.829 89.822 1.00 13.84 ? 576 LYS E C 1 +ATOM 19524 O O . LYS D 1 556 ? 39.429 83.477 88.786 1.00 13.27 ? 576 LYS E O 1 +ATOM 19525 C CB . LYS D 1 556 ? 40.693 84.601 91.265 1.00 13.98 ? 576 LYS E CB 1 +ATOM 19526 C CG . LYS D 1 556 ? 40.479 85.628 92.386 1.00 15.47 ? 576 LYS E CG 1 +ATOM 19527 C CD . LYS D 1 556 ? 39.205 86.444 92.167 1.00 17.35 ? 576 LYS E CD 1 +ATOM 19528 C CE . LYS D 1 556 ? 38.970 87.504 93.238 1.00 17.55 ? 576 LYS E CE 1 +ATOM 19529 N NZ . LYS D 1 556 ? 38.248 86.928 94.412 1.00 19.10 ? 576 LYS E NZ 1 +ATOM 19530 N N . ARG D 1 557 ? 39.816 81.507 89.815 1.00 14.03 ? 577 ARG E N 1 +ATOM 19531 C CA . ARG D 1 557 ? 40.002 80.778 88.559 1.00 15.13 ? 577 ARG E CA 1 +ATOM 19532 C C . ARG D 1 557 ? 38.736 80.619 87.714 1.00 16.21 ? 577 ARG E C 1 +ATOM 19533 O O . ARG D 1 557 ? 38.810 80.155 86.584 1.00 16.83 ? 577 ARG E O 1 +ATOM 19534 C CB . ARG D 1 557 ? 40.683 79.424 88.783 1.00 15.37 ? 577 ARG E CB 1 +ATOM 19535 C CG . ARG D 1 557 ? 39.925 78.403 89.576 1.00 14.89 ? 577 ARG E CG 1 +ATOM 19536 C CD . ARG D 1 557 ? 40.806 77.163 89.712 1.00 16.33 ? 577 ARG E CD 1 +ATOM 19537 N NE . ARG D 1 557 ? 40.192 76.050 90.417 1.00 15.50 ? 577 ARG E NE 1 +ATOM 19538 C CZ . ARG D 1 557 ? 39.298 75.215 89.896 1.00 16.68 ? 577 ARG E CZ 1 +ATOM 19539 N NH1 . ARG D 1 557 ? 38.860 75.372 88.653 1.00 15.59 ? 577 ARG E NH1 1 +ATOM 19540 N NH2 . ARG D 1 557 ? 38.830 74.220 90.636 1.00 16.21 ? 577 ARG E NH2 1 +ATOM 19541 N N . ARG D 1 558 ? 37.588 80.999 88.264 1.00 17.46 ? 578 ARG E N 1 +ATOM 19542 C CA . ARG D 1 558 ? 36.353 81.100 87.484 1.00 18.86 ? 578 ARG E CA 1 +ATOM 19543 C C . ARG D 1 558 ? 35.877 82.558 87.323 1.00 18.76 ? 578 ARG E C 1 +ATOM 19544 O O . ARG D 1 558 ? 34.710 82.789 86.970 1.00 19.72 ? 578 ARG E O 1 +ATOM 19545 C CB . ARG D 1 558 ? 35.280 80.228 88.154 1.00 19.32 ? 578 ARG E CB 1 +ATOM 19546 C CG . ARG D 1 558 ? 35.620 78.734 88.151 1.00 22.23 ? 578 ARG E CG 1 +ATOM 19547 C CD . ARG D 1 558 ? 35.337 78.065 89.503 1.00 26.91 ? 578 ARG E CD 1 +ATOM 19548 N NE . ARG D 1 558 ? 34.821 76.703 89.343 1.00 28.98 ? 578 ARG E NE 1 +ATOM 19549 C CZ . ARG D 1 558 ? 33.577 76.407 88.970 1.00 30.25 ? 578 ARG E CZ 1 +ATOM 19550 N NH1 . ARG D 1 558 ? 32.698 77.374 88.703 1.00 31.68 ? 578 ARG E NH1 1 +ATOM 19551 N NH2 . ARG D 1 558 ? 33.203 75.136 88.852 1.00 30.99 ? 578 ARG E NH2 1 +ATOM 19552 N N . LYS D 1 559 ? 36.768 83.534 87.556 1.00 17.99 ? 579 LYS E N 1 +ATOM 19553 C CA . LYS D 1 559 ? 36.427 84.967 87.463 1.00 17.71 ? 579 LYS E CA 1 +ATOM 19554 C C . LYS D 1 559 ? 37.317 85.736 86.469 1.00 16.77 ? 579 LYS E C 1 +ATOM 19555 O O . LYS D 1 559 ? 36.826 86.263 85.474 1.00 17.83 ? 579 LYS E O 1 +ATOM 19556 C CB . LYS D 1 559 ? 36.491 85.624 88.845 1.00 17.78 ? 579 LYS E CB 1 +ATOM 19557 C CG . LYS D 1 559 ? 35.577 84.946 89.861 1.00 19.98 ? 579 LYS E CG 1 +ATOM 19558 C CD . LYS D 1 559 ? 35.536 85.708 91.168 1.00 22.09 ? 579 LYS E CD 1 +ATOM 19559 C CE . LYS D 1 559 ? 34.569 85.067 92.148 1.00 24.39 ? 579 LYS E CE 1 +ATOM 19560 N NZ . LYS D 1 559 ? 35.076 83.741 92.658 1.00 25.11 ? 579 LYS E NZ 1 +ATOM 19561 N N . TYR D 1 560 ? 38.614 85.829 86.754 1.00 14.51 ? 580 TYR E N 1 +ATOM 19562 C CA . TYR D 1 560 ? 39.548 86.460 85.816 1.00 13.41 ? 580 TYR E CA 1 +ATOM 19563 C C . TYR D 1 560 ? 40.961 85.834 85.792 1.00 12.44 ? 580 TYR E C 1 +ATOM 19564 O O . TYR D 1 560 ? 41.797 86.244 84.996 1.00 12.09 ? 580 TYR E O 1 +ATOM 19565 C CB . TYR D 1 560 ? 39.630 87.970 86.077 1.00 13.29 ? 580 TYR E CB 1 +ATOM 19566 C CG . TYR D 1 560 ? 39.953 88.349 87.502 1.00 13.27 ? 580 TYR E CG 1 +ATOM 19567 C CD1 . TYR D 1 560 ? 38.947 88.745 88.386 1.00 14.44 ? 580 TYR E CD1 1 +ATOM 19568 C CD2 . TYR D 1 560 ? 41.260 88.339 87.968 1.00 13.44 ? 580 TYR E CD2 1 +ATOM 19569 C CE1 . TYR D 1 560 ? 39.242 89.106 89.691 1.00 13.16 ? 580 TYR E CE1 1 +ATOM 19570 C CE2 . TYR D 1 560 ? 41.560 88.682 89.265 1.00 12.45 ? 580 TYR E CE2 1 +ATOM 19571 C CZ . TYR D 1 560 ? 40.555 89.072 90.129 1.00 13.21 ? 580 TYR E CZ 1 +ATOM 19572 O OH . TYR D 1 560 ? 40.861 89.429 91.422 1.00 12.90 ? 580 TYR E OH 1 +ATOM 19573 N N . VAL D 1 561 ? 41.222 84.844 86.643 1.00 11.64 ? 581 VAL E N 1 +ATOM 19574 C CA . VAL D 1 561 ? 42.497 84.126 86.587 1.00 10.81 ? 581 VAL E CA 1 +ATOM 19575 C C . VAL D 1 561 ? 42.311 82.974 85.597 1.00 10.26 ? 581 VAL E C 1 +ATOM 19576 O O . VAL D 1 561 ? 41.430 82.109 85.769 1.00 10.78 ? 581 VAL E O 1 +ATOM 19577 C CB . VAL D 1 561 ? 42.948 83.642 87.984 1.00 10.84 ? 581 VAL E CB 1 +ATOM 19578 C CG1 . VAL D 1 561 ? 44.143 82.673 87.873 1.00 9.86 ? 581 VAL E CG1 1 +ATOM 19579 C CG2 . VAL D 1 561 ? 43.307 84.844 88.860 1.00 9.75 ? 581 VAL E CG2 1 +ATOM 19580 N N . VAL D 1 562 ? 43.115 82.983 84.533 1.00 9.29 ? 582 VAL E N 1 +ATOM 19581 C CA . VAL D 1 562 ? 42.929 82.058 83.427 1.00 9.24 ? 582 VAL E CA 1 +ATOM 19582 C C . VAL D 1 562 ? 44.057 81.041 83.312 1.00 8.24 ? 582 VAL E C 1 +ATOM 19583 O O . VAL D 1 562 ? 44.103 80.305 82.360 1.00 7.87 ? 582 VAL E O 1 +ATOM 19584 C CB . VAL D 1 562 ? 42.790 82.813 82.067 1.00 9.54 ? 582 VAL E CB 1 +ATOM 19585 C CG1 . VAL D 1 562 ? 41.622 83.780 82.111 1.00 9.65 ? 582 VAL E CG1 1 +ATOM 19586 C CG2 . VAL D 1 562 ? 44.049 83.559 81.749 1.00 8.57 ? 582 VAL E CG2 1 +ATOM 19587 N N . GLY D 1 563 ? 44.952 80.985 84.291 1.00 8.43 ? 583 GLY E N 1 +ATOM 19588 C CA . GLY D 1 563 ? 45.985 79.989 84.245 1.00 8.67 ? 583 GLY E CA 1 +ATOM 19589 C C . GLY D 1 563 ? 46.837 79.966 85.484 1.00 8.55 ? 583 GLY E C 1 +ATOM 19590 O O . GLY D 1 563 ? 46.943 80.968 86.197 1.00 7.76 ? 583 GLY E O 1 +ATOM 19591 N N . GLU D 1 564 ? 47.442 78.800 85.699 1.00 8.49 ? 584 GLU E N 1 +ATOM 19592 C CA . GLU D 1 564 ? 48.472 78.597 86.718 1.00 8.94 ? 584 GLU E CA 1 +ATOM 19593 C C . GLU D 1 564 ? 49.577 77.709 86.136 1.00 8.64 ? 584 GLU E C 1 +ATOM 19594 O O . GLU D 1 564 ? 49.288 76.692 85.482 1.00 8.44 ? 584 GLU E O 1 +ATOM 19595 C CB . GLU D 1 564 ? 47.864 77.956 87.971 1.00 9.15 ? 584 GLU E CB 1 +ATOM 19596 C CG . GLU D 1 564 ? 47.086 76.687 87.716 1.00 9.21 ? 584 GLU E CG 1 +ATOM 19597 C CD . GLU D 1 564 ? 46.359 76.187 88.938 1.00 10.54 ? 584 GLU E CD 1 +ATOM 19598 O OE1 . GLU D 1 564 ? 46.908 75.313 89.634 1.00 9.31 ? 584 GLU E OE1 1 +ATOM 19599 O OE2 . GLU D 1 564 ? 45.239 76.678 89.214 1.00 11.19 ? 584 GLU E OE2 1 +ATOM 19600 N N . LEU D 1 565 ? 50.832 78.105 86.356 1.00 8.47 ? 585 LEU E N 1 +ATOM 19601 C CA . LEU D 1 565 ? 51.997 77.342 85.911 1.00 8.26 ? 585 LEU E CA 1 +ATOM 19602 C C . LEU D 1 565 ? 52.946 77.187 87.098 1.00 8.24 ? 585 LEU E C 1 +ATOM 19603 O O . LEU D 1 565 ? 53.458 78.175 87.633 1.00 8.53 ? 585 LEU E O 1 +ATOM 19604 C CB . LEU D 1 565 ? 52.724 78.069 84.765 1.00 8.45 ? 585 LEU E CB 1 +ATOM 19605 C CG . LEU D 1 565 ? 51.924 78.427 83.500 1.00 7.50 ? 585 LEU E CG 1 +ATOM 19606 C CD1 . LEU D 1 565 ? 52.770 79.279 82.535 1.00 6.92 ? 585 LEU E CD1 1 +ATOM 19607 C CD2 . LEU D 1 565 ? 51.403 77.186 82.799 1.00 8.52 ? 585 LEU E CD2 1 +ATOM 19608 N N . ILE D 1 566 ? 53.157 75.955 87.525 1.00 7.85 ? 586 ILE E N 1 +ATOM 19609 C CA . ILE D 1 566 ? 54.027 75.713 88.659 1.00 8.07 ? 586 ILE E CA 1 +ATOM 19610 C C . ILE D 1 566 ? 55.470 75.938 88.217 1.00 7.42 ? 586 ILE E C 1 +ATOM 19611 O O . ILE D 1 566 ? 55.832 75.622 87.085 1.00 8.12 ? 586 ILE E O 1 +ATOM 19612 C CB . ILE D 1 566 ? 53.844 74.289 89.243 1.00 8.34 ? 586 ILE E CB 1 +ATOM 19613 C CG1 . ILE D 1 566 ? 54.620 74.155 90.565 1.00 10.27 ? 586 ILE E CG1 1 +ATOM 19614 C CG2 . ILE D 1 566 ? 54.204 73.215 88.231 1.00 8.11 ? 586 ILE E CG2 1 +ATOM 19615 C CD1 . ILE D 1 566 ? 54.115 73.018 91.438 1.00 12.75 ? 586 ILE E CD1 1 +ATOM 19616 N N . TRP D 1 567 ? 56.272 76.501 89.110 1.00 7.29 ? 587 TRP E N 1 +ATOM 19617 C CA . TRP D 1 567 ? 57.725 76.495 88.944 1.00 7.33 ? 587 TRP E CA 1 +ATOM 19618 C C . TRP D 1 567 ? 58.262 75.387 89.839 1.00 7.54 ? 587 TRP E C 1 +ATOM 19619 O O . TRP D 1 567 ? 58.114 75.488 91.059 1.00 6.97 ? 587 TRP E O 1 +ATOM 19620 C CB . TRP D 1 567 ? 58.348 77.820 89.359 1.00 7.98 ? 587 TRP E CB 1 +ATOM 19621 C CG . TRP D 1 567 ? 59.797 77.877 88.945 1.00 9.21 ? 587 TRP E CG 1 +ATOM 19622 C CD1 . TRP D 1 567 ? 60.874 77.479 89.681 1.00 8.99 ? 587 TRP E CD1 1 +ATOM 19623 C CD2 . TRP D 1 567 ? 60.312 78.290 87.665 1.00 9.07 ? 587 TRP E CD2 1 +ATOM 19624 N NE1 . TRP D 1 567 ? 62.042 77.650 88.946 1.00 9.75 ? 587 TRP E NE1 1 +ATOM 19625 C CE2 . TRP D 1 567 ? 61.715 78.148 87.710 1.00 8.24 ? 587 TRP E CE2 1 +ATOM 19626 C CE3 . TRP D 1 567 ? 59.725 78.793 86.497 1.00 9.57 ? 587 TRP E CE3 1 +ATOM 19627 C CZ2 . TRP D 1 567 ? 62.526 78.478 86.630 1.00 8.49 ? 587 TRP E CZ2 1 +ATOM 19628 C CZ3 . TRP D 1 567 ? 60.531 79.116 85.429 1.00 9.24 ? 587 TRP E CZ3 1 +ATOM 19629 C CH2 . TRP D 1 567 ? 61.923 78.948 85.499 1.00 8.56 ? 587 TRP E CH2 1 +ATOM 19630 N N . ASN D 1 568 ? 58.867 74.324 89.302 1.00 7.50 ? 588 ASN E N 1 +ATOM 19631 C CA . ASN D 1 568 ? 59.161 74.072 87.888 1.00 8.01 ? 588 ASN E CA 1 +ATOM 19632 C C . ASN D 1 568 ? 58.830 72.596 87.660 1.00 8.02 ? 588 ASN E C 1 +ATOM 19633 O O . ASN D 1 568 ? 58.650 71.854 88.616 1.00 8.19 ? 588 ASN E O 1 +ATOM 19634 C CB . ASN D 1 568 ? 60.667 74.318 87.639 1.00 8.09 ? 588 ASN E CB 1 +ATOM 19635 C CG . ASN D 1 568 ? 61.058 74.266 86.175 1.00 8.39 ? 588 ASN E CG 1 +ATOM 19636 O OD1 . ASN D 1 568 ? 61.284 73.184 85.610 1.00 10.96 ? 588 ASN E OD1 1 +ATOM 19637 N ND2 . ASN D 1 568 ? 61.177 75.461 85.548 1.00 9.22 ? 588 ASN E ND2 1 +ATOM 19638 N N . PHE D 1 569 ? 58.757 72.176 86.402 1.00 7.78 ? 589 PHE E N 1 +ATOM 19639 C CA . PHE D 1 569 ? 58.584 70.781 86.042 1.00 8.14 ? 589 PHE E CA 1 +ATOM 19640 C C . PHE D 1 569 ? 59.637 69.918 86.739 1.00 8.15 ? 589 PHE E C 1 +ATOM 19641 O O . PHE D 1 569 ? 59.306 68.942 87.396 1.00 7.74 ? 589 PHE E O 1 +ATOM 19642 C CB . PHE D 1 569 ? 58.692 70.644 84.525 1.00 8.04 ? 589 PHE E CB 1 +ATOM 19643 C CG . PHE D 1 569 ? 58.600 69.251 84.020 1.00 7.36 ? 589 PHE E CG 1 +ATOM 19644 C CD1 . PHE D 1 569 ? 59.750 68.562 83.673 1.00 7.47 ? 589 PHE E CD1 1 +ATOM 19645 C CD2 . PHE D 1 569 ? 57.371 68.625 83.847 1.00 7.92 ? 589 PHE E CD2 1 +ATOM 19646 C CE1 . PHE D 1 569 ? 59.680 67.264 83.191 1.00 7.82 ? 589 PHE E CE1 1 +ATOM 19647 C CE2 . PHE D 1 569 ? 57.304 67.322 83.350 1.00 7.84 ? 589 PHE E CE2 1 +ATOM 19648 C CZ . PHE D 1 569 ? 58.448 66.654 83.025 1.00 8.60 ? 589 PHE E CZ 1 +ATOM 19649 N N . ALA D 1 570 ? 60.902 70.313 86.627 1.00 7.97 ? 590 ALA E N 1 +ATOM 19650 C CA . ALA D 1 570 ? 61.990 69.525 87.199 1.00 8.02 ? 590 ALA E CA 1 +ATOM 19651 C C . ALA D 1 570 ? 63.157 70.381 87.709 1.00 7.75 ? 590 ALA E C 1 +ATOM 19652 O O . ALA D 1 570 ? 63.402 71.491 87.223 1.00 9.17 ? 590 ALA E O 1 +ATOM 19653 C CB . ALA D 1 570 ? 62.489 68.514 86.189 1.00 7.75 ? 590 ALA E CB 1 +ATOM 19654 N N . ASP D 1 571 ? 63.831 69.867 88.731 1.00 8.20 ? 591 ASP E N 1 +ATOM 19655 C CA . ASP D 1 571 ? 65.068 70.457 89.253 1.00 7.03 ? 591 ASP E CA 1 +ATOM 19656 C C . ASP D 1 571 ? 66.027 70.681 88.102 1.00 7.38 ? 591 ASP E C 1 +ATOM 19657 O O . ASP D 1 571 ? 66.177 69.820 87.245 1.00 7.58 ? 591 ASP E O 1 +ATOM 19658 C CB . ASP D 1 571 ? 65.761 69.513 90.257 1.00 7.49 ? 591 ASP E CB 1 +ATOM 19659 C CG . ASP D 1 571 ? 64.930 69.220 91.486 1.00 7.42 ? 591 ASP E CG 1 +ATOM 19660 O OD1 . ASP D 1 571 ? 64.036 70.019 91.830 1.00 5.28 ? 591 ASP E OD1 1 +ATOM 19661 O OD2 . ASP D 1 571 ? 65.169 68.160 92.108 1.00 7.84 ? 591 ASP E OD2 1 +ATOM 19662 N N . PHE D 1 572 ? 66.685 71.829 88.090 1.00 7.35 ? 592 PHE E N 1 +ATOM 19663 C CA . PHE D 1 572 ? 67.598 72.175 86.990 1.00 7.34 ? 592 PHE E CA 1 +ATOM 19664 C C . PHE D 1 572 ? 68.811 72.945 87.516 1.00 7.46 ? 592 PHE E C 1 +ATOM 19665 O O . PHE D 1 572 ? 68.801 73.434 88.640 1.00 7.26 ? 592 PHE E O 1 +ATOM 19666 C CB . PHE D 1 572 ? 66.857 72.969 85.932 1.00 7.26 ? 592 PHE E CB 1 +ATOM 19667 C CG . PHE D 1 572 ? 66.384 74.285 86.427 1.00 6.11 ? 592 PHE E CG 1 +ATOM 19668 C CD1 . PHE D 1 572 ? 67.189 75.396 86.341 1.00 6.71 ? 592 PHE E CD1 1 +ATOM 19669 C CD2 . PHE D 1 572 ? 65.133 74.406 87.027 1.00 5.41 ? 592 PHE E CD2 1 +ATOM 19670 C CE1 . PHE D 1 572 ? 66.769 76.615 86.829 1.00 5.53 ? 592 PHE E CE1 1 +ATOM 19671 C CE2 . PHE D 1 572 ? 64.711 75.630 87.530 1.00 6.37 ? 592 PHE E CE2 1 +ATOM 19672 C CZ . PHE D 1 572 ? 65.514 76.732 87.417 1.00 5.58 ? 592 PHE E CZ 1 +ATOM 19673 N N . MET D 1 573 ? 69.861 73.038 86.700 1.00 7.51 ? 593 MET E N 1 +ATOM 19674 C CA . MET D 1 573 ? 71.130 73.624 87.152 1.00 7.67 ? 593 MET E CA 1 +ATOM 19675 C C . MET D 1 573 ? 71.156 75.159 87.085 1.00 7.34 ? 593 MET E C 1 +ATOM 19676 O O . MET D 1 573 ? 70.575 75.770 86.198 1.00 7.36 ? 593 MET E O 1 +ATOM 19677 C CB . MET D 1 573 ? 72.294 73.058 86.346 1.00 7.60 ? 593 MET E CB 1 +ATOM 19678 C CG . MET D 1 573 ? 73.688 73.382 86.889 1.00 9.50 ? 593 MET E CG 1 +ATOM 19679 S SD . MET D 1 573 ? 73.940 73.093 88.655 1.00 10.99 ? 593 MET E SD 1 +ATOM 19680 C CE . MET D 1 573 ? 73.790 71.328 88.849 1.00 12.81 ? 593 MET E CE 1 +ATOM 19681 N N . THR D 1 574 ? 71.864 75.752 88.039 1.00 6.87 ? 594 THR E N 1 +ATOM 19682 C CA . THR D 1 574 ? 72.073 77.203 88.083 1.00 6.83 ? 594 THR E CA 1 +ATOM 19683 C C . THR D 1 574 ? 73.529 77.456 88.442 1.00 6.96 ? 594 THR E C 1 +ATOM 19684 O O . THR D 1 574 ? 74.260 76.515 88.725 1.00 7.45 ? 594 THR E O 1 +ATOM 19685 C CB . THR D 1 574 ? 71.234 77.891 89.165 1.00 6.76 ? 594 THR E CB 1 +ATOM 19686 O OG1 . THR D 1 574 ? 71.680 77.466 90.462 1.00 7.12 ? 594 THR E OG1 1 +ATOM 19687 C CG2 . THR D 1 574 ? 69.728 77.637 88.982 1.00 7.35 ? 594 THR E CG2 1 +ATOM 19688 N N . GLU D 1 575 ? 73.928 78.733 88.418 1.00 7.75 ? 595 GLU E N 1 +ATOM 19689 C CA . GLU D 1 575 ? 75.212 79.182 88.982 1.00 8.74 ? 595 GLU E CA 1 +ATOM 19690 C C . GLU D 1 575 ? 75.305 78.853 90.453 1.00 8.47 ? 595 GLU E C 1 +ATOM 19691 O O . GLU D 1 575 ? 74.296 78.655 91.137 1.00 8.47 ? 595 GLU E O 1 +ATOM 19692 C CB . GLU D 1 575 ? 75.396 80.704 88.833 1.00 10.32 ? 595 GLU E CB 1 +ATOM 19693 C CG . GLU D 1 575 ? 75.968 81.140 87.535 1.00 14.14 ? 595 GLU E CG 1 +ATOM 19694 C CD . GLU D 1 575 ? 77.340 80.554 87.256 1.00 18.30 ? 595 GLU E CD 1 +ATOM 19695 O OE1 . GLU D 1 575 ? 78.128 80.372 88.209 1.00 21.33 ? 595 GLU E OE1 1 +ATOM 19696 O OE2 . GLU D 1 575 ? 77.635 80.289 86.070 1.00 21.19 ? 595 GLU E OE2 1 +ATOM 19697 N N . GLN D 1 576 ? 76.539 78.780 90.936 1.00 7.89 ? 596 GLN E N 1 +ATOM 19698 C CA . GLN D 1 576 ? 76.787 78.466 92.321 1.00 8.45 ? 596 GLN E CA 1 +ATOM 19699 C C . GLN D 1 576 ? 76.428 79.688 93.142 1.00 8.63 ? 596 GLN E C 1 +ATOM 19700 O O . GLN D 1 576 ? 76.710 80.808 92.733 1.00 9.15 ? 596 GLN E O 1 +ATOM 19701 C CB . GLN D 1 576 ? 78.264 78.095 92.539 1.00 7.81 ? 596 GLN E CB 1 +ATOM 19702 C CG . GLN D 1 576 ? 78.560 76.658 92.174 1.00 9.33 ? 596 GLN E CG 1 +ATOM 19703 C CD . GLN D 1 576 ? 80.007 76.290 92.351 1.00 8.36 ? 596 GLN E CD 1 +ATOM 19704 O OE1 . GLN D 1 576 ? 80.372 75.598 93.302 1.00 10.94 ? 596 GLN E OE1 1 +ATOM 19705 N NE2 . GLN D 1 576 ? 80.840 76.737 91.436 1.00 12.04 ? 596 GLN E NE2 1 +ATOM 19706 N N . SER D 1 577 ? 75.729 79.461 94.254 1.00 9.25 ? 597 SER E N 1 +ATOM 19707 C CA . SER D 1 577 ? 75.479 80.505 95.248 1.00 9.82 ? 597 SER E CA 1 +ATOM 19708 C C . SER D 1 577 ? 74.876 79.884 96.507 1.00 9.67 ? 597 SER E C 1 +ATOM 19709 O O . SER D 1 577 ? 74.381 78.763 96.452 1.00 9.50 ? 597 SER E O 1 +ATOM 19710 C CB . SER D 1 577 ? 74.563 81.591 94.710 1.00 9.93 ? 597 SER E CB 1 +ATOM 19711 O OG . SER D 1 577 ? 73.212 81.181 94.711 1.00 10.09 ? 597 SER E OG 1 +ATOM 19712 N N . PRO D 1 578 ? 74.926 80.613 97.648 1.00 9.44 ? 598 PRO E N 1 +ATOM 19713 C CA . PRO D 1 578 ? 74.431 80.071 98.912 1.00 9.19 ? 598 PRO E CA 1 +ATOM 19714 C C . PRO D 1 578 ? 72.928 79.741 98.969 1.00 9.35 ? 598 PRO E C 1 +ATOM 19715 O O . PRO D 1 578 ? 72.511 79.018 99.874 1.00 9.04 ? 598 PRO E O 1 +ATOM 19716 C CB . PRO D 1 578 ? 74.797 81.152 99.935 1.00 9.38 ? 598 PRO E CB 1 +ATOM 19717 C CG . PRO D 1 578 ? 75.871 81.985 99.277 1.00 9.98 ? 598 PRO E CG 1 +ATOM 19718 C CD . PRO D 1 578 ? 75.499 81.966 97.825 1.00 9.38 ? 598 PRO E CD 1 +ATOM 19719 N N . THR D 1 579 ? 72.143 80.195 97.998 1.00 8.98 ? 599 THR E N 1 +ATOM 19720 C CA . THR D 1 579 ? 70.704 79.867 97.963 1.00 9.63 ? 599 THR E CA 1 +ATOM 19721 C C . THR D 1 579 ? 70.335 78.796 96.939 1.00 9.26 ? 599 THR E C 1 +ATOM 19722 O O . THR D 1 579 ? 69.142 78.546 96.699 1.00 9.43 ? 599 THR E O 1 +ATOM 19723 C CB . THR D 1 579 ? 69.868 81.105 97.625 1.00 10.04 ? 599 THR E CB 1 +ATOM 19724 O OG1 . THR D 1 579 ? 70.203 81.565 96.313 1.00 11.13 ? 599 THR E OG1 1 +ATOM 19725 C CG2 . THR D 1 579 ? 70.100 82.214 98.639 1.00 11.06 ? 599 THR E CG2 1 +ATOM 19726 N N . ARG D 1 580 ? 71.339 78.195 96.316 1.00 9.30 ? 600 ARG E N 1 +ATOM 19727 C CA . ARG D 1 580 ? 71.112 77.196 95.281 1.00 9.41 ? 600 ARG E CA 1 +ATOM 19728 C C . ARG D 1 580 ? 71.904 75.940 95.576 1.00 9.79 ? 600 ARG E C 1 +ATOM 19729 O O . ARG D 1 580 ? 73.115 75.888 95.354 1.00 7.94 ? 600 ARG E O 1 +ATOM 19730 C CB . ARG D 1 580 ? 71.449 77.761 93.899 1.00 10.05 ? 600 ARG E CB 1 +ATOM 19731 C CG . ARG D 1 580 ? 70.490 78.867 93.435 1.00 9.86 ? 600 ARG E CG 1 +ATOM 19732 C CD . ARG D 1 580 ? 69.151 78.248 93.029 1.00 9.53 ? 600 ARG E CD 1 +ATOM 19733 N NE . ARG D 1 580 ? 68.106 79.204 92.623 1.00 9.78 ? 600 ARG E NE 1 +ATOM 19734 C CZ . ARG D 1 580 ? 67.216 79.762 93.446 1.00 8.66 ? 600 ARG E CZ 1 +ATOM 19735 N NH1 . ARG D 1 580 ? 67.236 79.519 94.743 1.00 8.65 ? 600 ARG E NH1 1 +ATOM 19736 N NH2 . ARG D 1 580 ? 66.270 80.552 92.965 1.00 9.28 ? 600 ARG E NH2 1 +ATOM 19737 N N . VAL D 1 581 ? 71.185 74.931 96.050 1.00 9.69 ? 601 VAL E N 1 +ATOM 19738 C CA . VAL D 1 581 ? 71.771 73.650 96.435 1.00 11.13 ? 601 VAL E CA 1 +ATOM 19739 C C . VAL D 1 581 ? 71.953 72.770 95.211 1.00 11.11 ? 601 VAL E C 1 +ATOM 19740 O O . VAL D 1 581 ? 71.056 71.996 94.850 1.00 11.13 ? 601 VAL E O 1 +ATOM 19741 C CB . VAL D 1 581 ? 70.880 72.925 97.460 1.00 11.29 ? 601 VAL E CB 1 +ATOM 19742 C CG1 . VAL D 1 581 ? 71.509 71.585 97.865 1.00 13.54 ? 601 VAL E CG1 1 +ATOM 19743 C CG2 . VAL D 1 581 ? 70.603 73.829 98.655 1.00 12.67 ? 601 VAL E CG2 1 +ATOM 19744 N N . LEU D 1 582 ? 73.110 72.884 94.567 1.00 10.64 ? 602 LEU E N 1 +ATOM 19745 C CA . LEU D 1 582 ? 73.346 72.234 93.280 1.00 11.37 ? 602 LEU E CA 1 +ATOM 19746 C C . LEU D 1 582 ? 72.214 72.576 92.318 1.00 11.28 ? 602 LEU E C 1 +ATOM 19747 O O . LEU D 1 582 ? 71.611 71.691 91.707 1.00 12.20 ? 602 LEU E O 1 +ATOM 19748 C CB . LEU D 1 582 ? 73.523 70.708 93.405 1.00 12.27 ? 602 LEU E CB 1 +ATOM 19749 C CG . LEU D 1 582 ? 74.896 70.152 93.764 1.00 14.46 ? 602 LEU E CG 1 +ATOM 19750 C CD1 . LEU D 1 582 ? 74.852 68.614 93.772 1.00 16.82 ? 602 LEU E CD1 1 +ATOM 19751 C CD2 . LEU D 1 582 ? 75.940 70.643 92.792 1.00 14.80 ? 602 LEU E CD2 1 +ATOM 19752 N N . GLY D 1 583 ? 71.950 73.877 92.181 1.00 10.35 ? 603 GLY E N 1 +ATOM 19753 C CA . GLY D 1 583 ? 70.969 74.373 91.228 1.00 9.88 ? 603 GLY E CA 1 +ATOM 19754 C C . GLY D 1 583 ? 69.642 74.688 91.890 1.00 9.82 ? 603 GLY E C 1 +ATOM 19755 O O . GLY D 1 583 ? 69.573 74.824 93.093 1.00 9.99 ? 603 GLY E O 1 +ATOM 19756 N N . ASN D 1 584 ? 68.595 74.794 91.075 1.00 9.16 ? 604 ASN E N 1 +ATOM 19757 C CA . ASN D 1 584 ? 67.254 75.164 91.535 1.00 8.88 ? 604 ASN E CA 1 +ATOM 19758 C C . ASN D 1 584 ? 66.484 73.872 91.805 1.00 8.29 ? 604 ASN E C 1 +ATOM 19759 O O . ASN D 1 584 ? 66.393 72.995 90.938 1.00 9.42 ? 604 ASN E O 1 +ATOM 19760 C CB . ASN D 1 584 ? 66.572 76.024 90.465 1.00 8.68 ? 604 ASN E CB 1 +ATOM 19761 C CG . ASN D 1 584 ? 65.159 76.485 90.848 1.00 8.02 ? 604 ASN E CG 1 +ATOM 19762 O OD1 . ASN D 1 584 ? 64.269 75.668 91.077 1.00 9.25 ? 604 ASN E OD1 1 +ATOM 19763 N ND2 . ASN D 1 584 ? 64.930 77.812 90.831 1.00 6.59 ? 604 ASN E ND2 1 +ATOM 19764 N N . LYS D 1 585 ? 65.944 73.759 93.013 1.00 7.90 ? 605 LYS E N 1 +ATOM 19765 C CA . LYS D 1 585 ? 65.343 72.523 93.500 1.00 6.48 ? 605 LYS E CA 1 +ATOM 19766 C C . LYS D 1 585 ? 63.818 72.610 93.611 1.00 6.86 ? 605 LYS E C 1 +ATOM 19767 O O . LYS D 1 585 ? 63.185 71.804 94.296 1.00 5.51 ? 605 LYS E O 1 +ATOM 19768 C CB . LYS D 1 585 ? 65.985 72.157 94.839 1.00 7.11 ? 605 LYS E CB 1 +ATOM 19769 C CG . LYS D 1 585 ? 67.428 71.645 94.670 1.00 8.09 ? 605 LYS E CG 1 +ATOM 19770 C CD . LYS D 1 585 ? 67.456 70.134 94.340 1.00 8.96 ? 605 LYS E CD 1 +ATOM 19771 C CE . LYS D 1 585 ? 68.870 69.548 94.329 1.00 9.09 ? 605 LYS E CE 1 +ATOM 19772 N NZ . LYS D 1 585 ? 69.801 70.194 93.363 1.00 8.84 ? 605 LYS E NZ 1 +ATOM 19773 N N . LYS D 1 586 ? 63.230 73.578 92.913 1.00 6.64 ? 606 LYS E N 1 +ATOM 19774 C CA . LYS D 1 586 ? 61.778 73.777 92.989 1.00 6.91 ? 606 LYS E CA 1 +ATOM 19775 C C . LYS D 1 586 ? 60.995 72.801 92.111 1.00 6.63 ? 606 LYS E C 1 +ATOM 19776 O O . LYS D 1 586 ? 59.767 72.904 92.016 1.00 6.49 ? 606 LYS E O 1 +ATOM 19777 C CB . LYS D 1 586 ? 61.413 75.228 92.643 1.00 7.31 ? 606 LYS E CB 1 +ATOM 19778 C CG . LYS D 1 586 ? 62.020 76.257 93.575 1.00 6.63 ? 606 LYS E CG 1 +ATOM 19779 C CD . LYS D 1 586 ? 61.146 77.527 93.656 1.00 7.31 ? 606 LYS E CD 1 +ATOM 19780 C CE . LYS D 1 586 ? 61.710 78.557 94.593 1.00 7.94 ? 606 LYS E CE 1 +ATOM 19781 N NZ . LYS D 1 586 ? 63.053 79.038 94.142 1.00 9.82 ? 606 LYS E NZ 1 +ATOM 19782 N N . GLY D 1 587 ? 61.671 71.860 91.452 1.00 6.12 ? 607 GLY E N 1 +ATOM 19783 C CA . GLY D 1 587 ? 60.980 70.869 90.635 1.00 6.55 ? 607 GLY E CA 1 +ATOM 19784 C C . GLY D 1 587 ? 59.940 70.088 91.413 1.00 6.50 ? 607 GLY E C 1 +ATOM 19785 O O . GLY D 1 587 ? 60.128 69.786 92.597 1.00 5.98 ? 607 GLY E O 1 +ATOM 19786 N N . ILE D 1 588 ? 58.822 69.787 90.757 1.00 6.72 ? 608 ILE E N 1 +ATOM 19787 C CA . ILE D 1 588 ? 57.922 68.720 91.218 1.00 7.48 ? 608 ILE E CA 1 +ATOM 19788 C C . ILE D 1 588 ? 58.441 67.342 90.807 1.00 7.35 ? 608 ILE E C 1 +ATOM 19789 O O . ILE D 1 588 ? 58.059 66.319 91.390 1.00 8.09 ? 608 ILE E O 1 +ATOM 19790 C CB . ILE D 1 588 ? 56.463 68.938 90.727 1.00 7.65 ? 608 ILE E CB 1 +ATOM 19791 C CG1 . ILE D 1 588 ? 56.371 69.040 89.197 1.00 8.24 ? 608 ILE E CG1 1 +ATOM 19792 C CG2 . ILE D 1 588 ? 55.915 70.185 91.363 1.00 8.25 ? 608 ILE E CG2 1 +ATOM 19793 C CD1 . ILE D 1 588 ? 54.913 68.976 88.665 1.00 8.10 ? 608 ILE E CD1 1 +ATOM 19794 N N . PHE D 1 589 ? 59.290 67.294 89.774 1.00 7.15 ? 609 PHE E N 1 +ATOM 19795 C CA . PHE D 1 589 ? 60.056 66.096 89.460 1.00 6.90 ? 609 PHE E CA 1 +ATOM 19796 C C . PHE D 1 589 ? 61.518 66.367 89.760 1.00 6.42 ? 609 PHE E C 1 +ATOM 19797 O O . PHE D 1 589 ? 61.982 67.506 89.700 1.00 4.70 ? 609 PHE E O 1 +ATOM 19798 C CB . PHE D 1 589 ? 59.932 65.706 87.987 1.00 7.20 ? 609 PHE E CB 1 +ATOM 19799 C CG . PHE D 1 589 ? 58.530 65.366 87.568 1.00 8.08 ? 609 PHE E CG 1 +ATOM 19800 C CD1 . PHE D 1 589 ? 57.750 66.287 86.905 1.00 9.56 ? 609 PHE E CD1 1 +ATOM 19801 C CD2 . PHE D 1 589 ? 58.008 64.108 87.822 1.00 9.08 ? 609 PHE E CD2 1 +ATOM 19802 C CE1 . PHE D 1 589 ? 56.444 65.966 86.511 1.00 10.23 ? 609 PHE E CE1 1 +ATOM 19803 C CE2 . PHE D 1 589 ? 56.711 63.789 87.452 1.00 10.02 ? 609 PHE E CE2 1 +ATOM 19804 C CZ . PHE D 1 589 ? 55.938 64.719 86.787 1.00 8.56 ? 609 PHE E CZ 1 +ATOM 19805 N N . THR D 1 590 ? 62.247 65.314 90.075 1.00 6.25 ? 610 THR E N 1 +ATOM 19806 C CA . THR D 1 590 ? 63.708 65.409 90.166 1.00 6.67 ? 610 THR E CA 1 +ATOM 19807 C C . THR D 1 590 ? 64.299 65.695 88.787 1.00 6.82 ? 610 THR E C 1 +ATOM 19808 O O . THR D 1 590 ? 63.623 65.573 87.760 1.00 7.32 ? 610 THR E O 1 +ATOM 19809 C CB . THR D 1 590 ? 64.328 64.087 90.713 1.00 5.64 ? 610 THR E CB 1 +ATOM 19810 O OG1 . THR D 1 590 ? 64.129 63.023 89.771 1.00 6.51 ? 610 THR E OG1 1 +ATOM 19811 C CG2 . THR D 1 590 ? 63.702 63.723 92.080 1.00 7.31 ? 610 THR E CG2 1 +ATOM 19812 N N . ARG D 1 591 ? 65.578 66.053 88.746 1.00 7.07 ? 611 ARG E N 1 +ATOM 19813 C CA . ARG D 1 591 ? 66.254 66.227 87.457 1.00 7.25 ? 611 ARG E CA 1 +ATOM 19814 C C . ARG D 1 591 ? 66.271 64.921 86.627 1.00 6.65 ? 611 ARG E C 1 +ATOM 19815 O O . ARG D 1 591 ? 66.430 64.970 85.402 1.00 7.00 ? 611 ARG E O 1 +ATOM 19816 C CB . ARG D 1 591 ? 67.685 66.734 87.687 1.00 6.38 ? 611 ARG E CB 1 +ATOM 19817 C CG . ARG D 1 591 ? 68.337 67.337 86.464 1.00 8.00 ? 611 ARG E CG 1 +ATOM 19818 C CD . ARG D 1 591 ? 69.720 67.857 86.808 1.00 6.54 ? 611 ARG E CD 1 +ATOM 19819 N NE . ARG D 1 591 ? 70.244 68.796 85.813 1.00 6.78 ? 611 ARG E NE 1 +ATOM 19820 C CZ . ARG D 1 591 ? 71.545 68.992 85.587 1.00 7.90 ? 611 ARG E CZ 1 +ATOM 19821 N NH1 . ARG D 1 591 ? 72.459 68.272 86.228 1.00 7.94 ? 611 ARG E NH1 1 +ATOM 19822 N NH2 . ARG D 1 591 ? 71.939 69.885 84.684 1.00 8.46 ? 611 ARG E NH2 1 +ATOM 19823 N N . GLN D 1 592 ? 66.100 63.772 87.294 1.00 7.08 ? 612 GLN E N 1 +ATOM 19824 C CA . GLN D 1 592 ? 66.063 62.460 86.647 1.00 7.24 ? 612 GLN E CA 1 +ATOM 19825 C C . GLN D 1 592 ? 64.647 61.988 86.329 1.00 7.52 ? 612 GLN E C 1 +ATOM 19826 O O . GLN D 1 592 ? 64.445 60.807 86.014 1.00 8.00 ? 612 GLN E O 1 +ATOM 19827 C CB . GLN D 1 592 ? 66.776 61.437 87.524 1.00 7.54 ? 612 GLN E CB 1 +ATOM 19828 C CG . GLN D 1 592 ? 68.254 61.767 87.742 1.00 6.62 ? 612 GLN E CG 1 +ATOM 19829 C CD . GLN D 1 592 ? 68.501 62.744 88.870 1.00 7.62 ? 612 GLN E CD 1 +ATOM 19830 O OE1 . GLN D 1 592 ? 67.755 62.792 89.859 1.00 9.09 ? 612 GLN E OE1 1 +ATOM 19831 N NE2 . GLN D 1 592 ? 69.547 63.528 88.735 1.00 8.91 ? 612 GLN E NE2 1 +ATOM 19832 N N . ARG D 1 593 ? 63.698 62.924 86.368 1.00 7.41 ? 613 ARG E N 1 +ATOM 19833 C CA . ARG D 1 593 ? 62.332 62.699 85.878 1.00 7.78 ? 613 ARG E CA 1 +ATOM 19834 C C . ARG D 1 593 ? 61.521 61.680 86.716 1.00 7.80 ? 613 ARG E C 1 +ATOM 19835 O O . ARG D 1 593 ? 60.697 60.917 86.176 1.00 7.76 ? 613 ARG E O 1 +ATOM 19836 C CB . ARG D 1 593 ? 62.348 62.334 84.386 1.00 7.77 ? 613 ARG E CB 1 +ATOM 19837 C CG . ARG D 1 593 ? 62.257 63.552 83.433 1.00 8.79 ? 613 ARG E CG 1 +ATOM 19838 C CD . ARG D 1 593 ? 63.388 64.550 83.628 1.00 9.79 ? 613 ARG E CD 1 +ATOM 19839 N NE . ARG D 1 593 ? 63.308 65.619 82.630 1.00 11.25 ? 613 ARG E NE 1 +ATOM 19840 C CZ . ARG D 1 593 ? 64.142 66.648 82.548 1.00 12.85 ? 613 ARG E CZ 1 +ATOM 19841 N NH1 . ARG D 1 593 ? 65.165 66.766 83.383 1.00 11.96 ? 613 ARG E NH1 1 +ATOM 19842 N NH2 . ARG D 1 593 ? 63.968 67.556 81.592 1.00 14.09 ? 613 ARG E NH2 1 +ATOM 19843 N N . GLN D 1 594 ? 61.745 61.695 88.029 1.00 7.43 ? 614 GLN E N 1 +ATOM 19844 C CA . GLN D 1 594 ? 60.868 60.984 88.989 1.00 8.16 ? 614 GLN E CA 1 +ATOM 19845 C C . GLN D 1 594 ? 60.115 61.942 89.904 1.00 8.15 ? 614 GLN E C 1 +ATOM 19846 O O . GLN D 1 594 ? 60.640 62.998 90.295 1.00 7.20 ? 614 GLN E O 1 +ATOM 19847 C CB . GLN D 1 594 ? 61.676 59.983 89.822 1.00 8.29 ? 614 GLN E CB 1 +ATOM 19848 C CG . GLN D 1 594 ? 62.316 58.861 88.995 1.00 8.51 ? 614 GLN E CG 1 +ATOM 19849 C CD . GLN D 1 594 ? 61.357 58.149 88.075 1.00 8.61 ? 614 GLN E CD 1 +ATOM 19850 O OE1 . GLN D 1 594 ? 60.154 58.098 88.321 1.00 8.99 ? 614 GLN E OE1 1 +ATOM 19851 N NE2 . GLN D 1 594 ? 61.888 57.562 87.015 1.00 9.66 ? 614 GLN E NE2 1 +ATOM 19852 N N . PRO D 1 595 ? 58.861 61.584 90.267 1.00 8.31 ? 615 PRO E N 1 +ATOM 19853 C CA . PRO D 1 595 ? 58.060 62.529 91.028 1.00 8.63 ? 615 PRO E CA 1 +ATOM 19854 C C . PRO D 1 595 ? 58.454 62.658 92.489 1.00 8.55 ? 615 PRO E C 1 +ATOM 19855 O O . PRO D 1 595 ? 58.658 61.652 93.165 1.00 9.40 ? 615 PRO E O 1 +ATOM 19856 C CB . PRO D 1 595 ? 56.641 61.940 90.933 1.00 8.15 ? 615 PRO E CB 1 +ATOM 19857 C CG . PRO D 1 595 ? 56.838 60.474 90.785 1.00 7.79 ? 615 PRO E CG 1 +ATOM 19858 C CD . PRO D 1 595 ? 58.144 60.322 89.999 1.00 8.62 ? 615 PRO E CD 1 +ATOM 19859 N N . LYS D 1 596 ? 58.545 63.886 92.975 1.00 8.63 ? 616 LYS E N 1 +ATOM 19860 C CA . LYS D 1 596 ? 58.514 64.150 94.405 1.00 8.50 ? 616 LYS E CA 1 +ATOM 19861 C C . LYS D 1 596 ? 57.057 64.008 94.835 1.00 9.33 ? 616 LYS E C 1 +ATOM 19862 O O . LYS D 1 596 ? 56.164 63.913 93.992 1.00 10.30 ? 616 LYS E O 1 +ATOM 19863 C CB . LYS D 1 596 ? 59.005 65.548 94.732 1.00 8.40 ? 616 LYS E CB 1 +ATOM 19864 C CG . LYS D 1 596 ? 60.463 65.829 94.310 1.00 7.68 ? 616 LYS E CG 1 +ATOM 19865 C CD . LYS D 1 596 ? 60.869 67.266 94.548 1.00 8.00 ? 616 LYS E CD 1 +ATOM 19866 C CE . LYS D 1 596 ? 62.096 67.629 93.728 1.00 6.39 ? 616 LYS E CE 1 +ATOM 19867 N NZ . LYS D 1 596 ? 62.532 69.037 93.875 1.00 7.69 ? 616 LYS E NZ 1 +ATOM 19868 N N . SER D 1 597 ? 56.816 63.978 96.136 1.00 9.74 ? 617 SER E N 1 +ATOM 19869 C CA . SER D 1 597 ? 55.448 63.755 96.629 1.00 10.98 ? 617 SER E CA 1 +ATOM 19870 C C . SER D 1 597 ? 54.483 64.852 96.180 1.00 9.96 ? 617 SER E C 1 +ATOM 19871 O O . SER D 1 597 ? 53.291 64.596 95.963 1.00 10.41 ? 617 SER E O 1 +ATOM 19872 C CB . SER D 1 597 ? 55.452 63.640 98.142 1.00 11.49 ? 617 SER E CB 1 +ATOM 19873 O OG . SER D 1 597 ? 56.220 62.512 98.519 1.00 14.17 ? 617 SER E OG 1 +ATOM 19874 N N . ALA D 1 598 ? 54.976 66.074 96.042 1.00 9.67 ? 618 ALA E N 1 +ATOM 19875 C CA . ALA D 1 598 ? 54.120 67.175 95.574 1.00 9.31 ? 618 ALA E CA 1 +ATOM 19876 C C . ALA D 1 598 ? 53.621 66.987 94.129 1.00 9.33 ? 618 ALA E C 1 +ATOM 19877 O O . ALA D 1 598 ? 52.596 67.552 93.750 1.00 10.17 ? 618 ALA E O 1 +ATOM 19878 C CB . ALA D 1 598 ? 54.854 68.498 95.717 1.00 9.10 ? 618 ALA E CB 1 +ATOM 19879 N N . ALA D 1 599 ? 54.319 66.200 93.314 1.00 8.90 ? 619 ALA E N 1 +ATOM 19880 C CA . ALA D 1 599 ? 53.875 65.982 91.939 1.00 8.80 ? 619 ALA E CA 1 +ATOM 19881 C C . ALA D 1 599 ? 52.500 65.293 91.896 1.00 9.49 ? 619 ALA E C 1 +ATOM 19882 O O . ALA D 1 599 ? 51.664 65.599 91.047 1.00 9.59 ? 619 ALA E O 1 +ATOM 19883 C CB . ALA D 1 599 ? 54.889 65.166 91.183 1.00 9.26 ? 619 ALA E CB 1 +ATOM 19884 N N . PHE D 1 600 ? 52.302 64.347 92.807 1.00 9.98 ? 620 PHE E N 1 +ATOM 19885 C CA . PHE D 1 600 ? 51.034 63.637 92.938 1.00 10.36 ? 620 PHE E CA 1 +ATOM 19886 C C . PHE D 1 600 ? 49.900 64.588 93.371 1.00 11.00 ? 620 PHE E C 1 +ATOM 19887 O O . PHE D 1 600 ? 48.756 64.475 92.898 1.00 11.42 ? 620 PHE E O 1 +ATOM 19888 C CB . PHE D 1 600 ? 51.200 62.477 93.934 1.00 10.98 ? 620 PHE E CB 1 +ATOM 19889 C CG . PHE D 1 600 ? 52.108 61.386 93.442 1.00 9.78 ? 620 PHE E CG 1 +ATOM 19890 C CD1 . PHE D 1 600 ? 53.449 61.366 93.805 1.00 12.18 ? 620 PHE E CD1 1 +ATOM 19891 C CD2 . PHE D 1 600 ? 51.635 60.393 92.592 1.00 11.50 ? 620 PHE E CD2 1 +ATOM 19892 C CE1 . PHE D 1 600 ? 54.292 60.365 93.342 1.00 10.34 ? 620 PHE E CE1 1 +ATOM 19893 C CE2 . PHE D 1 600 ? 52.484 59.382 92.128 1.00 11.96 ? 620 PHE E CE2 1 +ATOM 19894 C CZ . PHE D 1 600 ? 53.807 59.385 92.492 1.00 11.11 ? 620 PHE E CZ 1 +ATOM 19895 N N . LEU D 1 601 ? 50.205 65.527 94.255 1.00 10.88 ? 621 LEU E N 1 +ATOM 19896 C CA A LEU D 1 601 ? 49.214 66.507 94.685 0.50 10.99 ? 621 LEU E CA 1 +ATOM 19897 C CA B LEU D 1 601 ? 49.214 66.527 94.686 0.50 11.08 ? 621 LEU E CA 1 +ATOM 19898 C C . LEU D 1 601 ? 48.751 67.353 93.486 1.00 10.97 ? 621 LEU E C 1 +ATOM 19899 O O . LEU D 1 601 ? 47.550 67.512 93.246 1.00 11.02 ? 621 LEU E O 1 +ATOM 19900 C CB A LEU D 1 601 ? 49.811 67.365 95.801 0.50 10.96 ? 621 LEU E CB 1 +ATOM 19901 C CB B LEU D 1 601 ? 49.798 67.452 95.762 0.50 11.14 ? 621 LEU E CB 1 +ATOM 19902 C CG A LEU D 1 601 ? 48.903 68.330 96.550 0.50 11.04 ? 621 LEU E CG 1 +ATOM 19903 C CG B LEU D 1 601 ? 48.873 68.525 96.349 0.50 11.50 ? 621 LEU E CG 1 +ATOM 19904 C CD1 A LEU D 1 601 ? 49.356 68.470 97.995 0.50 10.15 ? 621 LEU E CD1 1 +ATOM 19905 C CD1 B LEU D 1 601 ? 47.971 67.920 97.419 0.50 11.57 ? 621 LEU E CD1 1 +ATOM 19906 C CD2 A LEU D 1 601 ? 48.887 69.671 95.850 0.50 9.69 ? 621 LEU E CD2 1 +ATOM 19907 C CD2 B LEU D 1 601 ? 49.662 69.689 96.924 0.50 10.74 ? 621 LEU E CD2 1 +ATOM 19908 N N . LEU D 1 602 ? 49.710 67.877 92.721 1.00 10.63 ? 622 LEU E N 1 +ATOM 19909 C CA . LEU D 1 602 ? 49.399 68.705 91.539 1.00 9.60 ? 622 LEU E CA 1 +ATOM 19910 C C . LEU D 1 602 ? 48.629 67.927 90.466 1.00 9.83 ? 622 LEU E C 1 +ATOM 19911 O O . LEU D 1 602 ? 47.696 68.450 89.845 1.00 9.45 ? 622 LEU E O 1 +ATOM 19912 C CB . LEU D 1 602 ? 50.688 69.269 90.927 1.00 9.53 ? 622 LEU E CB 1 +ATOM 19913 C CG . LEU D 1 602 ? 50.453 70.427 89.952 1.00 8.41 ? 622 LEU E CG 1 +ATOM 19914 C CD1 . LEU D 1 602 ? 49.925 71.631 90.690 1.00 9.01 ? 622 LEU E CD1 1 +ATOM 19915 C CD2 . LEU D 1 602 ? 51.735 70.796 89.191 1.00 9.45 ? 622 LEU E CD2 1 +ATOM 19916 N N . ARG D 1 603 ? 49.025 66.676 90.261 1.00 9.44 ? 623 ARG E N 1 +ATOM 19917 C CA . ARG D 1 603 ? 48.355 65.759 89.330 1.00 9.68 ? 623 ARG E CA 1 +ATOM 19918 C C . ARG D 1 603 ? 46.860 65.670 89.633 1.00 9.55 ? 623 ARG E C 1 +ATOM 19919 O O . ARG D 1 603 ? 46.029 65.856 88.755 1.00 10.12 ? 623 ARG E O 1 +ATOM 19920 C CB . ARG D 1 603 ? 48.972 64.376 89.448 1.00 9.58 ? 623 ARG E CB 1 +ATOM 19921 C CG . ARG D 1 603 ? 48.368 63.325 88.535 1.00 9.43 ? 623 ARG E CG 1 +ATOM 19922 C CD . ARG D 1 603 ? 49.278 62.122 88.454 1.00 10.32 ? 623 ARG E CD 1 +ATOM 19923 N NE . ARG D 1 603 ? 48.737 61.050 87.620 1.00 10.81 ? 623 ARG E NE 1 +ATOM 19924 C CZ . ARG D 1 603 ? 48.192 59.928 88.086 1.00 12.79 ? 623 ARG E CZ 1 +ATOM 19925 N NH1 . ARG D 1 603 ? 48.082 59.713 89.388 1.00 14.29 ? 623 ARG E NH1 1 +ATOM 19926 N NH2 . ARG D 1 603 ? 47.746 59.009 87.244 1.00 15.26 ? 623 ARG E NH2 1 +ATOM 19927 N N . GLU D 1 604 ? 46.537 65.391 90.891 1.00 9.58 ? 624 GLU E N 1 +ATOM 19928 C CA . GLU D 1 604 ? 45.138 65.284 91.321 1.00 9.50 ? 624 GLU E CA 1 +ATOM 19929 C C . GLU D 1 604 ? 44.363 66.571 91.007 1.00 9.50 ? 624 GLU E C 1 +ATOM 19930 O O . GLU D 1 604 ? 43.224 66.524 90.517 1.00 10.71 ? 624 GLU E O 1 +ATOM 19931 C CB . GLU D 1 604 ? 45.056 64.954 92.817 1.00 9.36 ? 624 GLU E CB 1 +ATOM 19932 C CG . GLU D 1 604 ? 45.473 63.540 93.159 1.00 11.45 ? 624 GLU E CG 1 +ATOM 19933 C CD . GLU D 1 604 ? 44.735 62.455 92.417 0.00 20.05 ? 624 GLU E CD 1 +ATOM 19934 O OE1 . GLU D 1 604 ? 43.533 62.667 92.117 0.00 24.33 ? 624 GLU E OE1 1 +ATOM 19935 O OE2 . GLU D 1 604 ? 45.309 61.366 92.208 0.00 24.93 ? 624 GLU E OE2 1 +ATOM 19936 N N . ARG D 1 605 ? 44.984 67.715 91.291 1.00 8.41 ? 625 ARG E N 1 +ATOM 19937 C CA . ARG D 1 605 ? 44.366 69.010 91.014 1.00 8.30 ? 625 ARG E CA 1 +ATOM 19938 C C . ARG D 1 605 ? 44.093 69.178 89.537 1.00 7.88 ? 625 ARG E C 1 +ATOM 19939 O O . ARG D 1 605 ? 42.986 69.537 89.133 1.00 7.61 ? 625 ARG E O 1 +ATOM 19940 C CB . ARG D 1 605 ? 45.255 70.138 91.488 1.00 8.34 ? 625 ARG E CB 1 +ATOM 19941 C CG . ARG D 1 605 ? 44.743 71.504 91.060 1.00 7.77 ? 625 ARG E CG 1 +ATOM 19942 C CD . ARG D 1 605 ? 45.458 72.588 91.803 1.00 8.79 ? 625 ARG E CD 1 +ATOM 19943 N NE . ARG D 1 605 ? 45.051 73.938 91.412 1.00 7.92 ? 625 ARG E NE 1 +ATOM 19944 C CZ . ARG D 1 605 ? 44.001 74.588 91.910 1.00 9.26 ? 625 ARG E CZ 1 +ATOM 19945 N NH1 . ARG D 1 605 ? 43.181 73.996 92.769 1.00 8.47 ? 625 ARG E NH1 1 +ATOM 19946 N NH2 . ARG D 1 605 ? 43.750 75.833 91.520 1.00 10.26 ? 625 ARG E NH2 1 +ATOM 19947 N N . TYR D 1 606 ? 45.113 68.941 88.718 1.00 7.46 ? 626 TYR E N 1 +ATOM 19948 C CA . TYR D 1 606 ? 44.980 69.162 87.289 1.00 7.93 ? 626 TYR E CA 1 +ATOM 19949 C C . TYR D 1 606 ? 43.897 68.309 86.624 1.00 8.19 ? 626 TYR E C 1 +ATOM 19950 O O . TYR D 1 606 ? 43.140 68.794 85.760 1.00 9.52 ? 626 TYR E O 1 +ATOM 19951 C CB . TYR D 1 606 ? 46.343 68.984 86.621 1.00 7.83 ? 626 TYR E CB 1 +ATOM 19952 C CG . TYR D 1 606 ? 47.293 70.160 86.828 1.00 7.63 ? 626 TYR E CG 1 +ATOM 19953 C CD1 . TYR D 1 606 ? 46.992 71.214 87.683 1.00 7.29 ? 626 TYR E CD1 1 +ATOM 19954 C CD2 . TYR D 1 606 ? 48.517 70.198 86.154 1.00 7.62 ? 626 TYR E CD2 1 +ATOM 19955 C CE1 . TYR D 1 606 ? 47.880 72.276 87.845 1.00 6.42 ? 626 TYR E CE1 1 +ATOM 19956 C CE2 . TYR D 1 606 ? 49.402 71.245 86.322 1.00 7.45 ? 626 TYR E CE2 1 +ATOM 19957 C CZ . TYR D 1 606 ? 49.085 72.273 87.160 1.00 7.34 ? 626 TYR E CZ 1 +ATOM 19958 O OH . TYR D 1 606 ? 49.961 73.319 87.310 1.00 8.59 ? 626 TYR E OH 1 +ATOM 19959 N N . TRP D 1 607 ? 43.779 67.056 87.041 1.00 8.61 ? 627 TRP E N 1 +ATOM 19960 C CA . TRP D 1 607 ? 42.752 66.181 86.474 1.00 9.23 ? 627 TRP E CA 1 +ATOM 19961 C C . TRP D 1 607 ? 41.375 66.594 86.984 1.00 10.22 ? 627 TRP E C 1 +ATOM 19962 O O . TRP D 1 607 ? 40.377 66.469 86.257 1.00 10.16 ? 627 TRP E O 1 +ATOM 19963 C CB . TRP D 1 607 ? 43.043 64.726 86.806 1.00 9.08 ? 627 TRP E CB 1 +ATOM 19964 C CG . TRP D 1 607 ? 44.102 64.167 85.930 1.00 9.33 ? 627 TRP E CG 1 +ATOM 19965 C CD1 . TRP D 1 607 ? 45.443 64.130 86.179 1.00 8.96 ? 627 TRP E CD1 1 +ATOM 19966 C CD2 . TRP D 1 607 ? 43.915 63.591 84.637 1.00 8.54 ? 627 TRP E CD2 1 +ATOM 19967 N NE1 . TRP D 1 607 ? 46.109 63.539 85.119 1.00 8.39 ? 627 TRP E NE1 1 +ATOM 19968 C CE2 . TRP D 1 607 ? 45.185 63.205 84.160 1.00 7.41 ? 627 TRP E CE2 1 +ATOM 19969 C CE3 . TRP D 1 607 ? 42.793 63.347 83.838 1.00 8.88 ? 627 TRP E CE3 1 +ATOM 19970 C CZ2 . TRP D 1 607 ? 45.363 62.586 82.919 1.00 9.46 ? 627 TRP E CZ2 1 +ATOM 19971 C CZ3 . TRP D 1 607 ? 42.979 62.734 82.600 1.00 9.43 ? 627 TRP E CZ3 1 +ATOM 19972 C CH2 . TRP D 1 607 ? 44.250 62.359 82.160 1.00 9.64 ? 627 TRP E CH2 1 +ATOM 19973 N N . LYS D 1 608 ? 41.333 67.068 88.227 1.00 10.99 ? 628 LYS E N 1 +ATOM 19974 C CA . LYS D 1 608 ? 40.090 67.547 88.826 1.00 12.58 ? 628 LYS E CA 1 +ATOM 19975 C C . LYS D 1 608 ? 39.586 68.743 88.042 1.00 12.62 ? 628 LYS E C 1 +ATOM 19976 O O . LYS D 1 608 ? 38.419 68.775 87.623 1.00 13.30 ? 628 LYS E O 1 +ATOM 19977 C CB . LYS D 1 608 ? 40.309 67.910 90.292 1.00 12.62 ? 628 LYS E CB 1 +ATOM 19978 C CG . LYS D 1 608 ? 39.129 68.568 91.000 1.00 14.75 ? 628 LYS E CG 1 +ATOM 19979 C CD . LYS D 1 608 ? 39.453 68.855 92.474 1.00 15.27 ? 628 LYS E CD 1 +ATOM 19980 C CE . LYS D 1 608 ? 40.317 70.116 92.657 1.00 17.90 ? 628 LYS E CE 1 +ATOM 19981 N NZ . LYS D 1 608 ? 41.092 70.044 93.938 1.00 19.43 ? 628 LYS E NZ 1 +ATOM 19982 N N . ILE D 1 609 ? 40.464 69.722 87.835 1.00 12.18 ? 629 ILE E N 1 +ATOM 19983 C CA . ILE D 1 609 ? 40.140 70.899 87.041 1.00 12.71 ? 629 ILE E CA 1 +ATOM 19984 C C . ILE D 1 609 ? 39.723 70.493 85.636 1.00 13.06 ? 629 ILE E C 1 +ATOM 19985 O O . ILE D 1 609 ? 38.697 70.958 85.141 1.00 12.92 ? 629 ILE E O 1 +ATOM 19986 C CB . ILE D 1 609 ? 41.309 71.893 86.977 1.00 12.68 ? 629 ILE E CB 1 +ATOM 19987 C CG1 . ILE D 1 609 ? 41.558 72.491 88.368 1.00 12.43 ? 629 ILE E CG1 1 +ATOM 19988 C CG2 . ILE D 1 609 ? 41.019 73.010 85.953 1.00 11.73 ? 629 ILE E CG2 1 +ATOM 19989 C CD1 . ILE D 1 609 ? 42.708 73.498 88.434 1.00 13.33 ? 629 ILE E CD1 1 +ATOM 19990 N N . ALA D 1 610 ? 40.470 69.588 85.010 1.00 13.46 ? 630 ALA E N 1 +ATOM 19991 C CA . ALA D 1 610 ? 40.146 69.171 83.649 1.00 14.84 ? 630 ALA E CA 1 +ATOM 19992 C C . ALA D 1 610 ? 38.725 68.611 83.569 1.00 16.12 ? 630 ALA E C 1 +ATOM 19993 O O . ALA D 1 610 ? 37.988 68.901 82.616 1.00 16.41 ? 630 ALA E O 1 +ATOM 19994 C CB . ALA D 1 610 ? 41.150 68.150 83.144 1.00 15.09 ? 630 ALA E CB 1 +ATOM 19995 N N . ASN D 1 611 ? 38.351 67.819 84.575 1.00 17.82 ? 631 ASN E N 1 +ATOM 19996 C CA . ASN D 1 611 ? 37.056 67.134 84.578 1.00 19.18 ? 631 ASN E CA 1 +ATOM 19997 C C . ASN D 1 611 ? 35.877 68.057 84.887 1.00 19.93 ? 631 ASN E C 1 +ATOM 19998 O O . ASN D 1 611 ? 34.727 67.691 84.646 1.00 20.17 ? 631 ASN E O 1 +ATOM 19999 C CB . ASN D 1 611 ? 37.073 65.969 85.566 1.00 19.56 ? 631 ASN E CB 1 +ATOM 20000 C CG . ASN D 1 611 ? 35.926 65.002 85.342 1.00 22.28 ? 631 ASN E CG 1 +ATOM 20001 O OD1 . ASN D 1 611 ? 35.531 64.745 84.201 1.00 24.85 ? 631 ASN E OD1 1 +ATOM 20002 N ND2 . ASN D 1 611 ? 35.375 64.474 86.427 1.00 25.39 ? 631 ASN E ND2 1 +ATOM 20003 N N . GLU D 1 612 ? 36.142 69.251 85.413 1.00 20.57 ? 632 GLU E N 1 +ATOM 20004 C CA . GLU D 1 612 ? 35.049 70.188 85.695 1.00 21.29 ? 632 GLU E CA 1 +ATOM 20005 C C . GLU D 1 612 ? 34.252 70.490 84.422 1.00 21.82 ? 632 GLU E C 1 +ATOM 20006 O O . GLU D 1 612 ? 34.181 71.632 83.968 1.00 22.75 ? 632 GLU E O 1 +ATOM 20007 C CB . GLU D 1 612 ? 35.586 71.480 86.308 1.00 21.29 ? 632 GLU E CB 1 +ATOM 20008 C CG . GLU D 1 612 ? 36.110 71.280 87.705 1.00 21.50 ? 632 GLU E CG 1 +ATOM 20009 C CD . GLU D 1 612 ? 36.647 72.541 88.313 1.00 22.13 ? 632 GLU E CD 1 +ATOM 20010 O OE1 . GLU D 1 612 ? 36.993 73.463 87.556 1.00 22.14 ? 632 GLU E OE1 1 +ATOM 20011 O OE2 . GLU D 1 612 ? 36.729 72.601 89.553 1.00 23.70 ? 632 GLU E OE2 1 +HETATM 20012 C C1 . NAG E 2 . ? 57.910 88.261 127.788 1.00 11.68 ? 1 NAG C C1 1 +HETATM 20013 C C2 . NAG E 2 . ? 58.748 89.529 127.912 1.00 13.09 ? 1 NAG C C2 1 +HETATM 20014 C C3 . NAG E 2 . ? 57.988 90.724 127.354 1.00 13.31 ? 1 NAG C C3 1 +HETATM 20015 C C4 . NAG E 2 . ? 57.483 90.436 125.939 1.00 12.85 ? 1 NAG C C4 1 +HETATM 20016 C C5 . NAG E 2 . ? 56.685 89.131 125.930 1.00 12.80 ? 1 NAG C C5 1 +HETATM 20017 C C6 . NAG E 2 . ? 56.170 88.738 124.544 1.00 12.17 ? 1 NAG C C6 1 +HETATM 20018 C C7 . NAG E 2 . ? 60.249 89.391 129.856 1.00 15.04 ? 1 NAG C C7 1 +HETATM 20019 C C8 . NAG E 2 . ? 60.440 89.752 131.300 1.00 14.11 ? 1 NAG C C8 1 +HETATM 20020 N N2 . NAG E 2 . ? 59.105 89.801 129.305 1.00 13.35 ? 1 NAG C N2 1 +HETATM 20021 O O3 . NAG E 2 . ? 58.825 91.867 127.389 1.00 15.36 ? 1 NAG C O3 1 +HETATM 20022 O O4 . NAG E 2 . ? 56.652 91.515 125.549 1.00 12.63 ? 1 NAG C O4 1 +HETATM 20023 O O5 . NAG E 2 . ? 57.459 88.067 126.454 1.00 10.18 ? 1 NAG C O5 1 +HETATM 20024 O O6 . NAG E 2 . ? 57.192 88.767 123.563 1.00 11.99 ? 1 NAG C O6 1 +HETATM 20025 O O7 . NAG E 2 . ? 61.127 88.748 129.266 1.00 12.45 ? 1 NAG C O7 1 +HETATM 20026 C C1 . NAG E 2 . ? 57.023 92.118 124.304 1.00 13.62 ? 2 NAG C C1 1 +HETATM 20027 C C2 . NAG E 2 . ? 55.858 93.014 123.879 1.00 13.45 ? 2 NAG C C2 1 +HETATM 20028 C C3 . NAG E 2 . ? 56.202 93.781 122.608 1.00 14.30 ? 2 NAG C C3 1 +HETATM 20029 C C4 . NAG E 2 . ? 57.577 94.424 122.659 1.00 14.60 ? 2 NAG C C4 1 +HETATM 20030 C C5 . NAG E 2 . ? 58.623 93.476 123.203 1.00 15.34 ? 2 NAG C C5 1 +HETATM 20031 C C6 . NAG E 2 . ? 59.935 94.231 123.421 1.00 15.87 ? 2 NAG C C6 1 +HETATM 20032 C C7 . NAG E 2 . ? 53.679 92.072 124.530 1.00 15.89 ? 2 NAG C C7 1 +HETATM 20033 C C8 . NAG E 2 . ? 52.514 91.249 124.077 1.00 16.44 ? 2 NAG C C8 1 +HETATM 20034 N N2 . NAG E 2 . ? 54.641 92.260 123.628 1.00 14.58 ? 2 NAG C N2 1 +HETATM 20035 O O3 . NAG E 2 . ? 55.244 94.795 122.432 1.00 13.30 ? 2 NAG C O3 1 +HETATM 20036 O O4 . NAG E 2 . ? 57.928 94.742 121.335 1.00 15.28 ? 2 NAG C O4 1 +HETATM 20037 O O5 . NAG E 2 . ? 58.209 92.882 124.421 1.00 12.90 ? 2 NAG C O5 1 +HETATM 20038 O O6 . NAG E 2 . ? 60.879 93.314 123.918 1.00 19.06 ? 2 NAG C O6 1 +HETATM 20039 O O7 . NAG E 2 . ? 53.712 92.544 125.667 1.00 18.06 ? 2 NAG C O7 1 +HETATM 20040 C C1 . BMA E 2 . ? 57.918 96.154 121.122 1.00 14.05 ? 3 BMA C C1 1 +HETATM 20041 C C2 . BMA E 2 . ? 58.641 96.442 119.816 1.00 14.26 ? 3 BMA C C2 1 +HETATM 20042 C C3 . BMA E 2 . ? 58.647 97.929 119.512 1.00 16.09 ? 3 BMA C C3 1 +HETATM 20043 C C4 . BMA E 2 . ? 57.226 98.457 119.544 1.00 15.01 ? 3 BMA C C4 1 +HETATM 20044 C C5 . BMA E 2 . ? 56.555 98.071 120.852 1.00 14.87 ? 3 BMA C C5 1 +HETATM 20045 C C6 . BMA E 2 . ? 55.095 98.481 120.870 1.00 15.20 ? 3 BMA C C6 1 +HETATM 20046 O O2 . BMA E 2 . ? 57.971 95.750 118.754 1.00 12.46 ? 3 BMA C O2 1 +HETATM 20047 O O3 . BMA E 2 . ? 59.142 98.077 118.191 1.00 19.09 ? 3 BMA C O3 1 +HETATM 20048 O O4 . BMA E 2 . ? 57.246 99.879 119.426 1.00 15.41 ? 3 BMA C O4 1 +HETATM 20049 O O5 . BMA E 2 . ? 56.586 96.666 121.055 1.00 13.86 ? 3 BMA C O5 1 +HETATM 20050 O O6 . BMA E 2 . ? 54.654 98.162 122.186 1.00 16.26 ? 3 BMA C O6 1 +HETATM 20051 C C1 . MAN E 2 . ? 53.306 98.610 122.378 1.00 18.49 ? 4 MAN C C1 1 +HETATM 20052 C C2 . MAN E 2 . ? 52.997 98.419 123.847 1.00 19.85 ? 4 MAN C C2 1 +HETATM 20053 C C3 . MAN E 2 . ? 53.107 96.931 124.150 1.00 19.26 ? 4 MAN C C3 1 +HETATM 20054 C C4 . MAN E 2 . ? 52.203 96.144 123.215 1.00 18.82 ? 4 MAN C C4 1 +HETATM 20055 C C5 . MAN E 2 . ? 52.411 96.502 121.749 1.00 18.08 ? 4 MAN C C5 1 +HETATM 20056 C C6 . MAN E 2 . ? 51.296 95.903 120.902 1.00 20.00 ? 4 MAN C C6 1 +HETATM 20057 O O2 . MAN E 2 . ? 51.697 98.899 124.113 1.00 21.56 ? 4 MAN C O2 1 +HETATM 20058 O O3 . MAN E 2 . ? 52.705 96.653 125.475 1.00 19.87 ? 4 MAN C O3 1 +HETATM 20059 O O4 . MAN E 2 . ? 52.422 94.764 123.394 1.00 18.73 ? 4 MAN C O4 1 +HETATM 20060 O O5 . MAN E 2 . ? 52.391 97.901 121.576 1.00 19.74 ? 4 MAN C O5 1 +HETATM 20061 O O6 . MAN E 2 . ? 50.094 96.560 121.245 1.00 20.17 ? 4 MAN C O6 1 +HETATM 20062 C C1 . MAN E 2 . ? 53.818 96.576 126.392 1.00 20.98 ? 5 MAN C C1 1 +HETATM 20063 C C2 . MAN E 2 . ? 53.466 95.642 127.551 1.00 22.08 ? 5 MAN C C2 1 +HETATM 20064 C C3 . MAN E 2 . ? 52.307 96.240 128.330 1.00 21.20 ? 5 MAN C C3 1 +HETATM 20065 C C4 . MAN E 2 . ? 52.700 97.619 128.833 1.00 21.61 ? 5 MAN C C4 1 +HETATM 20066 C C5 . MAN E 2 . ? 53.227 98.507 127.708 1.00 23.24 ? 5 MAN C C5 1 +HETATM 20067 C C6 . MAN E 2 . ? 53.898 99.749 128.290 1.00 23.95 ? 5 MAN C C6 1 +HETATM 20068 O O2 . MAN E 2 . ? 54.533 95.519 128.482 1.00 23.88 ? 5 MAN C O2 1 +HETATM 20069 O O3 . MAN E 2 . ? 52.034 95.429 129.453 1.00 21.10 ? 5 MAN C O3 1 +HETATM 20070 O O4 . MAN E 2 . ? 51.586 98.211 129.458 1.00 21.06 ? 5 MAN C O4 1 +HETATM 20071 O O5 . MAN E 2 . ? 54.181 97.848 126.894 1.00 22.02 ? 5 MAN C O5 1 +HETATM 20072 O O6 . MAN E 2 . ? 54.070 100.681 127.255 1.00 26.32 ? 5 MAN C O6 1 +HETATM 20073 C C1 . MAN E 2 . ? 55.484 94.483 128.174 1.00 28.28 ? 6 MAN C C1 1 +HETATM 20074 C C2 . MAN E 2 . ? 56.325 94.227 129.418 1.00 29.26 ? 6 MAN C C2 1 +HETATM 20075 C C3 . MAN E 2 . ? 57.116 95.472 129.793 1.00 30.53 ? 6 MAN C C3 1 +HETATM 20076 C C4 . MAN E 2 . ? 57.927 95.975 128.605 1.00 31.18 ? 6 MAN C C4 1 +HETATM 20077 C C5 . MAN E 2 . ? 57.056 96.063 127.351 1.00 31.52 ? 6 MAN C C5 1 +HETATM 20078 C C6 . MAN E 2 . ? 57.892 96.380 126.116 1.00 32.10 ? 6 MAN C C6 1 +HETATM 20079 O O2 . MAN E 2 . ? 57.228 93.180 129.162 1.00 29.13 ? 6 MAN C O2 1 +HETATM 20080 O O3 . MAN E 2 . ? 57.974 95.162 130.866 1.00 30.72 ? 6 MAN C O3 1 +HETATM 20081 O O4 . MAN E 2 . ? 58.433 97.259 128.895 1.00 32.34 ? 6 MAN C O4 1 +HETATM 20082 O O5 . MAN E 2 . ? 56.363 94.842 127.132 1.00 29.63 ? 6 MAN C O5 1 +HETATM 20083 O O6 . MAN E 2 . ? 57.142 97.158 125.208 1.00 33.74 ? 6 MAN C O6 1 +HETATM 20084 C C1 . MAN E 2 . ? 48.961 95.953 120.610 1.00 22.27 ? 7 MAN C C1 1 +HETATM 20085 C C2 . MAN E 2 . ? 47.779 96.902 120.817 1.00 23.10 ? 7 MAN C C2 1 +HETATM 20086 C C3 . MAN E 2 . ? 47.484 96.995 122.308 1.00 23.41 ? 7 MAN C C3 1 +HETATM 20087 C C4 . MAN E 2 . ? 47.273 95.596 122.872 1.00 23.10 ? 7 MAN C C4 1 +HETATM 20088 C C5 . MAN E 2 . ? 48.469 94.700 122.547 1.00 23.66 ? 7 MAN C C5 1 +HETATM 20089 C C6 . MAN E 2 . ? 48.280 93.267 123.034 1.00 24.37 ? 7 MAN C C6 1 +HETATM 20090 O O2 . MAN E 2 . ? 46.579 96.468 120.198 1.00 25.20 ? 7 MAN C O2 1 +HETATM 20091 O O3 . MAN E 2 . ? 46.330 97.796 122.525 1.00 23.79 ? 7 MAN C O3 1 +HETATM 20092 O O4 . MAN E 2 . ? 47.159 95.733 124.265 1.00 25.85 ? 7 MAN C O4 1 +HETATM 20093 O O5 . MAN E 2 . ? 48.675 94.678 121.150 1.00 22.24 ? 7 MAN C O5 1 +HETATM 20094 O O6 . MAN E 2 . ? 47.137 92.720 122.427 1.00 26.16 ? 7 MAN C O6 1 +HETATM 20095 C C1 . MAN E 2 . ? 46.517 96.708 118.779 1.00 27.58 ? 8 MAN C C1 1 +HETATM 20096 C C2 . MAN E 2 . ? 45.059 96.845 118.353 1.00 29.22 ? 8 MAN C C2 1 +HETATM 20097 C C3 . MAN E 2 . ? 44.302 95.549 118.629 1.00 29.61 ? 8 MAN C C3 1 +HETATM 20098 C C4 . MAN E 2 . ? 45.041 94.352 118.036 1.00 29.61 ? 8 MAN C C4 1 +HETATM 20099 C C5 . MAN E 2 . ? 46.527 94.388 118.399 1.00 28.68 ? 8 MAN C C5 1 +HETATM 20100 C C6 . MAN E 2 . ? 47.317 93.337 117.639 1.00 28.98 ? 8 MAN C C6 1 +HETATM 20101 O O2 . MAN E 2 . ? 45.011 97.143 116.971 1.00 29.42 ? 8 MAN C O2 1 +HETATM 20102 O O3 . MAN E 2 . ? 42.991 95.611 118.092 1.00 31.41 ? 8 MAN C O3 1 +HETATM 20103 O O4 . MAN E 2 . ? 44.429 93.160 118.492 1.00 29.22 ? 8 MAN C O4 1 +HETATM 20104 O O5 . MAN E 2 . ? 47.081 95.638 118.049 1.00 26.76 ? 8 MAN C O5 1 +HETATM 20105 O O6 . MAN E 2 . ? 48.695 93.529 117.894 1.00 28.38 ? 8 MAN C O6 1 +HETATM 20106 C C1 . MAN E 2 . ? 59.981 99.225 118.050 1.00 23.47 ? 9 MAN C C1 1 +HETATM 20107 C C2 . MAN E 2 . ? 60.119 99.491 116.560 1.00 24.98 ? 9 MAN C C2 1 +HETATM 20108 C C3 . MAN E 2 . ? 60.894 98.341 115.919 1.00 24.49 ? 9 MAN C C3 1 +HETATM 20109 C C4 . MAN E 2 . ? 62.256 98.235 116.587 1.00 23.99 ? 9 MAN C C4 1 +HETATM 20110 C C5 . MAN E 2 . ? 62.055 98.033 118.092 1.00 24.92 ? 9 MAN C C5 1 +HETATM 20111 C C6 . MAN E 2 . ? 63.386 98.025 118.837 1.00 25.67 ? 9 MAN C C6 1 +HETATM 20112 O O2 . MAN E 2 . ? 60.795 100.726 116.554 1.00 29.76 ? 9 MAN C O2 1 +HETATM 20113 O O3 . MAN E 2 . ? 61.018 98.505 114.520 1.00 22.46 ? 9 MAN C O3 1 +HETATM 20114 O O4 . MAN E 2 . ? 62.945 97.147 116.008 1.00 22.18 ? 9 MAN C O4 1 +HETATM 20115 O O5 . MAN E 2 . ? 61.262 99.074 118.641 1.00 23.00 ? 9 MAN C O5 1 +HETATM 20116 O O6 . MAN E 2 . ? 63.962 99.308 118.754 1.00 26.84 ? 9 MAN C O6 1 +HETATM 20117 O O5 . GUP E 2 . ? 62.122 102.301 115.498 1.00 36.43 ? 10 GUP C O5 1 +HETATM 20118 C C1 . GUP E 2 . ? 61.126 101.321 115.289 1.00 34.32 ? 10 GUP C C1 1 +HETATM 20119 C C2 . GUP E 2 . ? 59.901 101.956 114.644 1.00 35.42 ? 10 GUP C C2 1 +HETATM 20120 O O2 . GUP E 2 . ? 58.770 101.864 115.494 1.00 34.73 ? 10 GUP C O2 1 +HETATM 20121 C C3 . GUP E 2 . ? 60.203 103.414 114.314 1.00 36.79 ? 10 GUP C C3 1 +HETATM 20122 O O3 . GUP E 2 . ? 59.087 104.015 113.708 1.00 37.66 ? 10 GUP C O3 1 +HETATM 20123 C C4 . GUP E 2 . ? 60.607 104.162 115.586 1.00 37.69 ? 10 GUP C C4 1 +HETATM 20124 O O4 . GUP E 2 . ? 61.040 105.469 115.258 1.00 39.30 ? 10 GUP C O4 1 +HETATM 20125 C C5 . GUP E 2 . ? 61.688 103.367 116.327 1.00 37.29 ? 10 GUP C C5 1 +HETATM 20126 C C6 . GUP E 2 . ? 62.910 104.194 116.726 1.00 37.74 ? 10 GUP C C6 1 +HETATM 20127 O O6 . GUP E 2 . ? 63.632 103.525 117.741 1.00 38.38 ? 10 GUP C O6 1 +HETATM 20128 C C1 . NAG F 3 . ? 57.788 35.447 71.866 1.00 13.15 ? 1 NAG F C1 1 +HETATM 20129 C C2 . NAG F 3 . ? 58.507 34.113 71.901 1.00 15.27 ? 1 NAG F C2 1 +HETATM 20130 C C3 . NAG F 3 . ? 57.593 33.027 72.454 1.00 13.73 ? 1 NAG F C3 1 +HETATM 20131 C C4 . NAG F 3 . ? 56.937 33.445 73.764 1.00 12.02 ? 1 NAG F C4 1 +HETATM 20132 C C5 . NAG F 3 . ? 56.253 34.796 73.566 1.00 12.12 ? 1 NAG F C5 1 +HETATM 20133 C C6 . NAG F 3 . ? 55.585 35.352 74.826 1.00 11.67 ? 1 NAG F C6 1 +HETATM 20134 C C7 . NAG F 3 . ? 60.101 34.050 70.069 1.00 19.94 ? 1 NAG F C7 1 +HETATM 20135 C C8 . NAG F 3 . ? 60.401 33.555 68.681 1.00 19.87 ? 1 NAG F C8 1 +HETATM 20136 N N2 . NAG F 3 . ? 58.882 33.777 70.532 1.00 17.27 ? 1 NAG F N2 1 +HETATM 20137 O O3 . NAG F 3 . ? 58.312 31.816 72.590 1.00 14.04 ? 1 NAG F O3 1 +HETATM 20138 O O4 . NAG F 3 . ? 55.951 32.498 74.114 1.00 12.18 ? 1 NAG F O4 1 +HETATM 20139 O O5 . NAG F 3 . ? 57.190 35.752 73.112 1.00 11.49 ? 1 NAG F O5 1 +HETATM 20140 O O6 . NAG F 3 . ? 56.505 35.394 75.908 1.00 12.27 ? 1 NAG F O6 1 +HETATM 20141 O O7 . NAG F 3 . ? 60.949 34.680 70.700 1.00 18.83 ? 1 NAG F O7 1 +HETATM 20142 C C1 . NAG F 3 . ? 56.147 31.900 75.401 1.00 11.17 ? 2 NAG F C1 1 +HETATM 20143 C C2 . NAG F 3 . ? 54.854 31.141 75.719 1.00 12.71 ? 2 NAG F C2 1 +HETATM 20144 C C3 . NAG F 3 . ? 54.962 30.301 76.982 1.00 13.59 ? 2 NAG F C3 1 +HETATM 20145 C C4 . NAG F 3 . ? 56.254 29.521 77.054 1.00 14.29 ? 2 NAG F C4 1 +HETATM 20146 C C5 . NAG F 3 . ? 57.462 30.350 76.645 1.00 13.22 ? 2 NAG F C5 1 +HETATM 20147 C C6 . NAG F 3 . ? 58.669 29.425 76.509 1.00 15.34 ? 2 NAG F C6 1 +HETATM 20148 C C7 . NAG F 3 . ? 52.842 32.266 74.923 1.00 15.05 ? 2 NAG F C7 1 +HETATM 20149 C C8 . NAG F 3 . ? 51.764 33.255 75.261 1.00 15.24 ? 2 NAG F C8 1 +HETATM 20150 N N2 . NAG F 3 . ? 53.718 32.016 75.887 1.00 12.52 ? 2 NAG F N2 1 +HETATM 20151 O O3 . NAG F 3 . ? 53.860 29.418 76.999 1.00 13.73 ? 2 NAG F O3 1 +HETATM 20152 O O4 . NAG F 3 . ? 56.431 29.177 78.402 1.00 13.68 ? 2 NAG F O4 1 +HETATM 20153 O O5 . NAG F 3 . ? 57.224 30.981 75.404 1.00 11.50 ? 2 NAG F O5 1 +HETATM 20154 O O6 . NAG F 3 . ? 59.814 30.245 76.475 1.00 19.76 ? 2 NAG F O6 1 +HETATM 20155 O O7 . NAG F 3 . ? 52.886 31.727 73.809 1.00 18.71 ? 2 NAG F O7 1 +HETATM 20156 C C1 . BMA F 3 . ? 56.205 27.798 78.628 1.00 14.46 ? 3 BMA F C1 1 +HETATM 20157 C C2 . BMA F 3 . ? 56.792 27.427 79.969 1.00 13.92 ? 3 BMA F C2 1 +HETATM 20158 C C3 . BMA F 3 . ? 56.622 25.928 80.150 1.00 15.08 ? 3 BMA F C3 1 +HETATM 20159 C C4 . BMA F 3 . ? 55.169 25.512 79.975 1.00 14.78 ? 3 BMA F C4 1 +HETATM 20160 C C5 . BMA F 3 . ? 54.596 26.088 78.692 1.00 13.53 ? 3 BMA F C5 1 +HETATM 20161 C C6 . BMA F 3 . ? 53.104 25.830 78.545 1.00 13.91 ? 3 BMA F C6 1 +HETATM 20162 O O2 . BMA F 3 . ? 56.088 28.146 80.972 1.00 12.53 ? 3 BMA F O2 1 +HETATM 20163 O O3 . BMA F 3 . ? 56.991 25.557 81.472 1.00 19.18 ? 3 BMA F O3 1 +HETATM 20164 O O4 . BMA F 3 . ? 55.121 24.075 79.952 1.00 13.75 ? 3 BMA F O4 1 +HETATM 20165 O O5 . BMA F 3 . ? 54.815 27.494 78.661 1.00 13.40 ? 3 BMA F O5 1 +HETATM 20166 O O6 . BMA F 3 . ? 52.830 26.053 77.169 1.00 15.54 ? 3 BMA F O6 1 +HETATM 20167 C C1 . MAN F 3 . ? 51.457 25.772 76.831 1.00 17.00 ? 4 MAN F C1 1 +HETATM 20168 C C2 . MAN F 3 . ? 51.314 25.937 75.315 1.00 18.91 ? 4 MAN F C2 1 +HETATM 20169 C C3 . MAN F 3 . ? 51.543 27.400 74.949 1.00 19.85 ? 4 MAN F C3 1 +HETATM 20170 C C4 . MAN F 3 . ? 50.685 28.334 75.802 1.00 18.20 ? 4 MAN F C4 1 +HETATM 20171 C C5 . MAN F 3 . ? 50.737 27.993 77.290 1.00 17.50 ? 4 MAN F C5 1 +HETATM 20172 C C6 . MAN F 3 . ? 49.638 28.748 78.030 1.00 17.58 ? 4 MAN F C6 1 +HETATM 20173 O O2 . MAN F 3 . ? 50.040 25.489 74.864 1.00 16.99 ? 4 MAN F O2 1 +HETATM 20174 O O3 . MAN F 3 . ? 51.285 27.640 73.579 1.00 23.01 ? 4 MAN F O3 1 +HETATM 20175 O O4 . MAN F 3 . ? 51.162 29.647 75.647 1.00 20.60 ? 4 MAN F O4 1 +HETATM 20176 O O5 . MAN F 3 . ? 50.538 26.606 77.508 1.00 15.90 ? 4 MAN F O5 1 +HETATM 20177 O O6 . MAN F 3 . ? 48.409 28.206 77.577 1.00 18.75 ? 4 MAN F O6 1 +HETATM 20178 C C1 . MAN F 3 . ? 52.497 27.671 72.807 1.00 28.71 ? 5 MAN F C1 1 +HETATM 20179 C C2 . MAN F 3 . ? 52.314 28.643 71.655 1.00 31.48 ? 5 MAN F C2 1 +HETATM 20180 C C3 . MAN F 3 . ? 51.291 28.124 70.663 1.00 31.83 ? 5 MAN F C3 1 +HETATM 20181 C C4 . MAN F 3 . ? 51.644 26.711 70.215 1.00 32.16 ? 5 MAN F C4 1 +HETATM 20182 C C5 . MAN F 3 . ? 51.949 25.800 71.402 1.00 31.53 ? 5 MAN F C5 1 +HETATM 20183 C C6 . MAN F 3 . ? 52.536 24.484 70.885 1.00 32.50 ? 5 MAN F C6 1 +HETATM 20184 O O2 . MAN F 3 . ? 53.530 28.728 70.955 1.00 34.37 ? 5 MAN F O2 1 +HETATM 20185 O O3 . MAN F 3 . ? 51.280 28.984 69.544 1.00 33.35 ? 5 MAN F O3 1 +HETATM 20186 O O4 . MAN F 3 . ? 50.572 26.167 69.466 1.00 31.70 ? 5 MAN F O4 1 +HETATM 20187 O O5 . MAN F 3 . ? 52.867 26.406 72.299 1.00 28.95 ? 5 MAN F O5 1 +HETATM 20188 O O6 . MAN F 3 . ? 52.212 23.418 71.753 1.00 33.85 ? 5 MAN F O6 1 +HETATM 20189 C C1 . MAN F 3 . ? 54.353 29.834 71.349 1.00 37.93 ? 6 MAN F C1 1 +HETATM 20190 C C2 . MAN F 3 . ? 55.045 30.310 70.082 1.00 39.38 ? 6 MAN F C2 1 +HETATM 20191 C C3 . MAN F 3 . ? 56.012 29.233 69.597 1.00 40.33 ? 6 MAN F C3 1 +HETATM 20192 C C4 . MAN F 3 . ? 56.904 28.734 70.730 1.00 40.40 ? 6 MAN F C4 1 +HETATM 20193 C C5 . MAN F 3 . ? 56.082 28.355 71.960 1.00 40.09 ? 6 MAN F C5 1 +HETATM 20194 C C6 . MAN F 3 . ? 56.954 27.974 73.152 1.00 40.71 ? 6 MAN F C6 1 +HETATM 20195 O O2 . MAN F 3 . ? 55.717 31.518 70.343 1.00 39.94 ? 6 MAN F O2 1 +HETATM 20196 O O3 . MAN F 3 . ? 56.806 29.718 68.533 1.00 41.30 ? 6 MAN F O3 1 +HETATM 20197 O O4 . MAN F 3 . ? 57.605 27.611 70.252 1.00 40.64 ? 6 MAN F O4 1 +HETATM 20198 O O5 . MAN F 3 . ? 55.300 29.467 72.331 1.00 38.63 ? 6 MAN F O5 1 +HETATM 20199 O O6 . MAN F 3 . ? 56.296 27.003 73.945 1.00 41.40 ? 6 MAN F O6 1 +HETATM 20200 C C1 . MAN F 3 . ? 47.274 28.935 78.088 1.00 20.17 ? 7 MAN F C1 1 +HETATM 20201 C C2 . MAN F 3 . ? 46.017 28.214 77.604 1.00 21.73 ? 7 MAN F C2 1 +HETATM 20202 C C3 . MAN F 3 . ? 45.942 28.316 76.083 1.00 21.24 ? 7 MAN F C3 1 +HETATM 20203 C C4 . MAN F 3 . ? 45.970 29.784 75.659 1.00 20.90 ? 7 MAN F C4 1 +HETATM 20204 C C5 . MAN F 3 . ? 47.169 30.504 76.282 1.00 20.25 ? 7 MAN F C5 1 +HETATM 20205 C C6 . MAN F 3 . ? 47.110 32.000 75.995 1.00 20.16 ? 7 MAN F C6 1 +HETATM 20206 O O2 . MAN F 3 . ? 44.839 28.820 78.112 1.00 23.29 ? 7 MAN F O2 1 +HETATM 20207 O O3 . MAN F 3 . ? 44.761 27.692 75.604 1.00 21.18 ? 7 MAN F O3 1 +HETATM 20208 O O4 . MAN F 3 . ? 46.041 29.881 74.252 1.00 21.00 ? 7 MAN F O4 1 +HETATM 20209 O O5 . MAN F 3 . ? 47.227 30.298 77.684 1.00 18.83 ? 7 MAN F O5 1 +HETATM 20210 O O6 . MAN F 3 . ? 46.068 32.575 76.760 1.00 20.50 ? 7 MAN F O6 1 +HETATM 20211 C C1 . MAN F 3 . ? 44.574 28.557 79.510 1.00 26.22 ? 8 MAN F C1 1 +HETATM 20212 C C2 . MAN F 3 . ? 43.061 28.543 79.735 1.00 27.37 ? 8 MAN F C2 1 +HETATM 20213 C C3 . MAN F 3 . ? 42.472 29.910 79.436 1.00 27.93 ? 8 MAN F C3 1 +HETATM 20214 C C4 . MAN F 3 . ? 43.190 30.959 80.270 1.00 27.19 ? 8 MAN F C4 1 +HETATM 20215 C C5 . MAN F 3 . ? 44.702 30.852 80.079 1.00 26.61 ? 8 MAN F C5 1 +HETATM 20216 C C6 . MAN F 3 . ? 45.436 31.808 81.008 1.00 26.43 ? 8 MAN F C6 1 +HETATM 20217 O O2 . MAN F 3 . ? 42.766 28.236 81.083 1.00 29.13 ? 8 MAN F O2 1 +HETATM 20218 O O3 . MAN F 3 . ? 41.093 29.919 79.746 1.00 28.18 ? 8 MAN F O3 1 +HETATM 20219 O O4 . MAN F 3 . ? 42.748 32.226 79.857 1.00 27.71 ? 8 MAN F O4 1 +HETATM 20220 O O5 . MAN F 3 . ? 45.138 29.534 80.362 1.00 26.29 ? 8 MAN F O5 1 +HETATM 20221 O O6 . MAN F 3 . ? 46.829 31.679 80.779 1.00 26.83 ? 8 MAN F O6 1 +HETATM 20222 C C1 . MAN F 3 . ? 57.980 24.538 81.464 1.00 23.82 ? 9 MAN F C1 1 +HETATM 20223 C C2 . MAN F 3 . ? 58.024 24.054 82.889 1.00 27.25 ? 9 MAN F C2 1 +HETATM 20224 C C3 . MAN F 3 . ? 58.572 25.089 83.849 1.00 27.73 ? 9 MAN F C3 1 +HETATM 20225 C C4 . MAN F 3 . ? 59.925 25.552 83.336 1.00 27.92 ? 9 MAN F C4 1 +HETATM 20226 C C5 . MAN F 3 . ? 59.795 25.999 81.880 1.00 27.59 ? 9 MAN F C5 1 +HETATM 20227 C C6 . MAN F 3 . ? 61.145 26.386 81.289 1.00 28.21 ? 9 MAN F C6 1 +HETATM 20228 O O2 . MAN F 3 . ? 58.840 22.915 82.890 1.00 30.63 ? 9 MAN F O2 1 +HETATM 20229 O O3 . MAN F 3 . ? 58.686 24.470 85.106 1.00 29.18 ? 9 MAN F O3 1 +HETATM 20230 O O4 . MAN F 3 . ? 60.401 26.605 84.150 1.00 29.25 ? 9 MAN F O4 1 +HETATM 20231 O O5 . MAN F 3 . ? 59.275 24.955 81.079 1.00 25.03 ? 9 MAN F O5 1 +HETATM 20232 O O6 . MAN F 3 . ? 62.053 25.320 81.442 1.00 30.87 ? 9 MAN F O6 1 +HETATM 20233 C C1 . BMA F 3 . ? 57.982 21.794 83.097 1.00 34.47 ? 10 BMA F C1 1 +HETATM 20234 C C2 . BMA F 3 . ? 58.362 20.747 82.064 1.00 34.68 ? 10 BMA F C2 1 +HETATM 20235 C C3 . BMA F 3 . ? 59.490 19.812 82.491 1.00 35.95 ? 10 BMA F C3 1 +HETATM 20236 C C4 . BMA F 3 . ? 59.545 19.568 83.998 1.00 36.73 ? 10 BMA F C4 1 +HETATM 20237 C C5 . BMA F 3 . ? 58.361 20.111 84.783 1.00 36.74 ? 10 BMA F C5 1 +HETATM 20238 C C6 . BMA F 3 . ? 58.713 20.108 86.269 1.00 37.22 ? 10 BMA F C6 1 +HETATM 20239 O O2 . BMA F 3 . ? 58.742 21.419 80.884 1.00 34.57 ? 10 BMA F O2 1 +HETATM 20240 O O3 . BMA F 3 . ? 60.737 20.318 82.041 1.00 37.28 ? 10 BMA F O3 1 +HETATM 20241 O O4 . BMA F 3 . ? 59.594 18.182 84.246 1.00 37.20 ? 10 BMA F O4 1 +HETATM 20242 O O5 . BMA F 3 . ? 58.087 21.444 84.456 1.00 36.10 ? 10 BMA F O5 1 +HETATM 20243 O O6 . BMA F 3 . ? 57.728 20.782 87.021 1.00 37.55 ? 10 BMA F O6 1 +HETATM 20244 C C1 . NAG G 4 . ? 78.911 34.702 128.939 1.00 11.94 ? 1 NAG G C1 1 +HETATM 20245 C C2 . NAG G 4 . ? 78.041 33.443 128.982 1.00 12.30 ? 1 NAG G C2 1 +HETATM 20246 C C3 . NAG G 4 . ? 78.855 32.233 128.538 1.00 12.69 ? 1 NAG G C3 1 +HETATM 20247 C C4 . NAG G 4 . ? 79.461 32.467 127.169 1.00 12.26 ? 1 NAG G C4 1 +HETATM 20248 C C5 . NAG G 4 . ? 80.288 33.761 127.218 1.00 11.90 ? 1 NAG G C5 1 +HETATM 20249 C C6 . NAG G 4 . ? 80.892 34.111 125.866 1.00 11.63 ? 1 NAG G C6 1 +HETATM 20250 C C7 . NAG G 4 . ? 76.391 33.589 130.787 1.00 12.51 ? 1 NAG G C7 1 +HETATM 20251 C C8 . NAG G 4 . ? 76.068 33.188 132.201 1.00 15.14 ? 1 NAG G C8 1 +HETATM 20252 N N2 . NAG G 4 . ? 77.592 33.244 130.344 1.00 12.63 ? 1 NAG G N2 1 +HETATM 20253 O O3 . NAG G 4 . ? 78.067 31.069 128.540 1.00 14.40 ? 1 NAG G O3 1 +HETATM 20254 O O4 . NAG G 4 . ? 80.273 31.346 126.869 1.00 11.70 ? 1 NAG G O4 1 +HETATM 20255 O O5 . NAG G 4 . ? 79.507 34.871 127.667 1.00 9.72 ? 1 NAG G O5 1 +HETATM 20256 O O6 . NAG G 4 . ? 79.923 34.041 124.845 1.00 13.23 ? 1 NAG G O6 1 +HETATM 20257 O O7 . NAG G 4 . ? 75.555 34.210 130.139 1.00 11.85 ? 1 NAG G O7 1 +HETATM 20258 C C1 . NAG G 4 . ? 79.982 30.713 125.613 1.00 12.80 ? 2 NAG G C1 1 +HETATM 20259 C C2 . NAG G 4 . ? 81.133 29.748 125.321 1.00 13.00 ? 2 NAG G C2 1 +HETATM 20260 C C3 . NAG G 4 . ? 80.914 28.926 124.060 1.00 14.02 ? 2 NAG G C3 1 +HETATM 20261 C C4 . NAG G 4 . ? 79.504 28.374 123.991 1.00 13.67 ? 2 NAG G C4 1 +HETATM 20262 C C5 . NAG G 4 . ? 78.475 29.439 124.338 1.00 14.69 ? 2 NAG G C5 1 +HETATM 20263 C C6 . NAG G 4 . ? 77.080 28.850 124.332 1.00 16.28 ? 2 NAG G C6 1 +HETATM 20264 C C7 . NAG G 4 . ? 83.273 30.581 126.164 1.00 15.90 ? 2 NAG G C7 1 +HETATM 20265 C C8 . NAG G 4 . ? 84.560 31.238 125.780 1.00 15.76 ? 2 NAG G C8 1 +HETATM 20266 N N2 . NAG G 4 . ? 82.400 30.455 125.176 1.00 13.90 ? 2 NAG G N2 1 +HETATM 20267 O O3 . NAG G 4 . ? 81.840 27.862 124.030 1.00 14.81 ? 2 NAG G O3 1 +HETATM 20268 O O4 . NAG G 4 . ? 79.257 27.982 122.673 1.00 14.23 ? 2 NAG G O4 1 +HETATM 20269 O O5 . NAG G 4 . ? 78.751 29.998 125.604 1.00 12.89 ? 2 NAG G O5 1 +HETATM 20270 O O6 . NAG G 4 . ? 76.188 29.915 124.531 1.00 21.79 ? 2 NAG G O6 1 +HETATM 20271 O O7 . NAG G 4 . ? 83.091 30.204 127.331 1.00 17.29 ? 2 NAG G O7 1 +HETATM 20272 C C1 . BMA G 4 . ? 79.243 26.548 122.531 1.00 15.35 ? 3 BMA G C1 1 +HETATM 20273 C C2 . BMA G 4 . ? 78.571 26.198 121.217 1.00 16.12 ? 3 BMA G C2 1 +HETATM 20274 C C3 . BMA G 4 . ? 78.533 24.694 120.983 1.00 18.63 ? 3 BMA G C3 1 +HETATM 20275 C C4 . BMA G 4 . ? 79.915 24.088 121.185 1.00 18.01 ? 3 BMA G C4 1 +HETATM 20276 C C5 . BMA G 4 . ? 80.568 24.584 122.466 1.00 16.55 ? 3 BMA G C5 1 +HETATM 20277 C C6 . BMA G 4 . ? 82.008 24.113 122.543 1.00 17.54 ? 3 BMA G C6 1 +HETATM 20278 O O2 . BMA G 4 . ? 79.308 26.764 120.142 1.00 13.08 ? 3 BMA G O2 1 +HETATM 20279 O O3 . BMA G 4 . ? 78.162 24.528 119.617 1.00 23.04 ? 3 BMA G O3 1 +HETATM 20280 O O4 . BMA G 4 . ? 79.804 22.658 121.234 1.00 18.19 ? 3 BMA G O4 1 +HETATM 20281 O O5 . BMA G 4 . ? 80.565 26.014 122.559 1.00 14.70 ? 3 BMA G O5 1 +HETATM 20282 O O6 . BMA G 4 . ? 82.407 24.372 123.881 1.00 16.90 ? 3 BMA G O6 1 +HETATM 20283 C C1 . MAN G 4 . ? 83.763 23.952 124.131 1.00 19.14 ? 4 MAN G C1 1 +HETATM 20284 C C2 . MAN G 4 . ? 84.034 24.226 125.600 1.00 19.77 ? 4 MAN G C2 1 +HETATM 20285 C C3 . MAN G 4 . ? 83.850 25.721 125.850 1.00 21.55 ? 4 MAN G C3 1 +HETATM 20286 C C4 . MAN G 4 . ? 84.805 26.501 124.950 1.00 21.30 ? 4 MAN G C4 1 +HETATM 20287 C C5 . MAN G 4 . ? 84.731 26.048 123.485 1.00 21.09 ? 4 MAN G C5 1 +HETATM 20288 C C6 . MAN G 4 . ? 85.903 26.628 122.688 1.00 21.92 ? 4 MAN G C6 1 +HETATM 20289 O O2 . MAN G 4 . ? 85.370 23.860 125.866 1.00 19.27 ? 4 MAN G O2 1 +HETATM 20290 O O3 . MAN G 4 . ? 84.094 26.065 127.204 1.00 23.21 ? 4 MAN G O3 1 +HETATM 20291 O O4 . MAN G 4 . ? 84.513 27.884 125.040 1.00 22.50 ? 4 MAN G O4 1 +HETATM 20292 O O5 . MAN G 4 . ? 84.747 24.627 123.365 1.00 19.04 ? 4 MAN G O5 1 +HETATM 20293 O O6 . MAN G 4 . ? 87.085 26.097 123.255 1.00 24.47 ? 4 MAN G O6 1 +HETATM 20294 C C1 . MAN G 4 . ? 82.869 26.176 127.979 1.00 25.33 ? 5 MAN G C1 1 +HETATM 20295 C C2 . MAN G 4 . ? 83.103 27.097 129.168 1.00 26.83 ? 5 MAN G C2 1 +HETATM 20296 C C3 . MAN G 4 . ? 84.135 26.483 130.099 1.00 26.34 ? 5 MAN G C3 1 +HETATM 20297 C C4 . MAN G 4 . ? 83.678 25.090 130.519 1.00 26.02 ? 5 MAN G C4 1 +HETATM 20298 C C5 . MAN G 4 . ? 83.299 24.238 129.303 1.00 26.66 ? 5 MAN G C5 1 +HETATM 20299 C C6 . MAN G 4 . ? 82.635 22.930 129.729 1.00 27.18 ? 5 MAN G C6 1 +HETATM 20300 O O2 . MAN G 4 . ? 81.925 27.243 129.939 1.00 29.36 ? 5 MAN G O2 1 +HETATM 20301 O O3 . MAN G 4 . ? 84.283 27.312 131.235 1.00 27.06 ? 5 MAN G O3 1 +HETATM 20302 O O4 . MAN G 4 . ? 84.707 24.468 131.262 1.00 24.75 ? 5 MAN G O4 1 +HETATM 20303 O O5 . MAN G 4 . ? 82.406 24.925 128.445 1.00 24.98 ? 5 MAN G O5 1 +HETATM 20304 O O6 . MAN G 4 . ? 82.832 21.962 128.724 1.00 29.83 ? 5 MAN G O6 1 +HETATM 20305 C C1 . MAN G 4 . ? 81.075 28.332 129.531 1.00 32.39 ? 6 MAN G C1 1 +HETATM 20306 C C2 . MAN G 4 . ? 80.186 28.716 130.712 1.00 33.93 ? 6 MAN G C2 1 +HETATM 20307 C C3 . MAN G 4 . ? 79.190 27.615 131.056 1.00 35.08 ? 6 MAN G C3 1 +HETATM 20308 C C4 . MAN G 4 . ? 78.505 27.039 129.816 1.00 35.20 ? 6 MAN G C4 1 +HETATM 20309 C C5 . MAN G 4 . ? 79.464 26.853 128.637 1.00 34.77 ? 6 MAN G C5 1 +HETATM 20310 C C6 . MAN G 4 . ? 78.723 26.572 127.334 1.00 35.10 ? 6 MAN G C6 1 +HETATM 20311 O O2 . MAN G 4 . ? 79.468 29.884 130.405 1.00 33.98 ? 6 MAN G O2 1 +HETATM 20312 O O3 . MAN G 4 . ? 78.207 28.146 131.926 1.00 36.58 ? 6 MAN G O3 1 +HETATM 20313 O O4 . MAN G 4 . ? 77.941 25.792 130.167 1.00 35.74 ? 6 MAN G O4 1 +HETATM 20314 O O5 . MAN G 4 . ? 80.247 28.013 128.439 1.00 33.32 ? 6 MAN G O5 1 +HETATM 20315 O O6 . MAN G 4 . ? 79.534 25.749 126.516 1.00 36.18 ? 6 MAN G O6 1 +HETATM 20316 C C1 . MAN G 4 . ? 88.296 26.758 122.829 1.00 27.02 ? 7 MAN G C1 1 +HETATM 20317 C C2 . MAN G 4 . ? 89.462 26.108 123.573 1.00 28.04 ? 7 MAN G C2 1 +HETATM 20318 C C3 . MAN G 4 . ? 89.339 26.371 125.069 1.00 28.60 ? 7 MAN G C3 1 +HETATM 20319 C C4 . MAN G 4 . ? 89.177 27.859 125.343 1.00 28.72 ? 7 MAN G C4 1 +HETATM 20320 C C5 . MAN G 4 . ? 88.108 28.492 124.448 1.00 28.92 ? 7 MAN G C5 1 +HETATM 20321 C C6 . MAN G 4 . ? 88.006 30.013 124.607 1.00 28.54 ? 7 MAN G C6 1 +HETATM 20322 O O2 . MAN G 4 . ? 90.703 26.659 123.190 1.00 29.99 ? 7 MAN G O2 1 +HETATM 20323 O O3 . MAN G 4 . ? 90.509 25.944 125.735 1.00 29.27 ? 7 MAN G O3 1 +HETATM 20324 O O4 . MAN G 4 . ? 88.816 27.998 126.693 1.00 29.30 ? 7 MAN G O4 1 +HETATM 20325 O O5 . MAN G 4 . ? 88.326 28.153 123.083 1.00 27.75 ? 7 MAN G O5 1 +HETATM 20326 O O6 . MAN G 4 . ? 89.265 30.658 124.593 1.00 29.64 ? 7 MAN G O6 1 +HETATM 20327 C C1 . MAN G 4 . ? 91.227 26.212 121.929 1.00 31.44 ? 8 MAN G C1 1 +HETATM 20328 C C2 . MAN G 4 . ? 92.748 26.239 122.050 1.00 32.82 ? 8 MAN G C2 1 +HETATM 20329 C C3 . MAN G 4 . ? 93.258 27.668 122.217 1.00 33.30 ? 8 MAN G C3 1 +HETATM 20330 C C4 . MAN G 4 . ? 92.691 28.568 121.125 1.00 32.75 ? 8 MAN G C4 1 +HETATM 20331 C C5 . MAN G 4 . ? 91.176 28.407 121.067 1.00 32.47 ? 8 MAN G C5 1 +HETATM 20332 C C6 . MAN G 4 . ? 90.554 29.241 119.955 1.00 32.59 ? 8 MAN G C6 1 +HETATM 20333 O O2 . MAN G 4 . ? 93.325 25.682 120.895 1.00 33.35 ? 8 MAN G O2 1 +HETATM 20334 O O3 . MAN G 4 . ? 94.671 27.686 122.187 1.00 34.31 ? 8 MAN G O3 1 +HETATM 20335 O O4 . MAN G 4 . ? 93.026 29.905 121.421 1.00 34.32 ? 8 MAN G O4 1 +HETATM 20336 O O5 . MAN G 4 . ? 90.841 27.045 120.854 1.00 32.87 ? 8 MAN G O5 1 +HETATM 20337 O O6 . MAN G 4 . ? 89.200 29.471 120.279 1.00 31.88 ? 8 MAN G O6 1 +HETATM 20338 C C1 . MAN G 4 . ? 77.291 23.425 119.398 1.00 29.17 ? 9 MAN G C1 1 +HETATM 20339 C C2 . MAN G 4 . ? 77.312 23.149 117.903 1.00 32.46 ? 9 MAN G C2 1 +HETATM 20340 C C3 . MAN G 4 . ? 76.625 24.265 117.127 1.00 32.63 ? 9 MAN G C3 1 +HETATM 20341 C C4 . MAN G 4 . ? 75.232 24.471 117.700 1.00 32.05 ? 9 MAN G C4 1 +HETATM 20342 C C5 . MAN G 4 . ? 75.353 24.773 119.191 1.00 31.74 ? 9 MAN G C5 1 +HETATM 20343 C C6 . MAN G 4 . ? 73.989 24.963 119.839 1.00 32.66 ? 9 MAN G C6 1 +HETATM 20344 O O2 . MAN G 4 . ? 76.652 21.924 117.681 1.00 36.90 ? 9 MAN G O2 1 +HETATM 20345 O O3 . MAN G 4 . ? 76.547 23.951 115.751 1.00 33.65 ? 9 MAN G O3 1 +HETATM 20346 O O4 . MAN G 4 . ? 74.595 25.528 117.021 1.00 31.17 ? 9 MAN G O4 1 +HETATM 20347 O O5 . MAN G 4 . ? 75.989 23.693 119.841 1.00 30.12 ? 9 MAN G O5 1 +HETATM 20348 O O6 . MAN G 4 . ? 73.255 23.766 119.714 1.00 34.34 ? 9 MAN G O6 1 +HETATM 20349 C C1 . MAN G 4 . ? 77.355 21.090 116.746 1.00 40.52 ? 10 MAN G C1 1 +HETATM 20350 C C2 . MAN G 4 . ? 76.868 19.662 116.927 1.00 41.73 ? 10 MAN G C2 1 +HETATM 20351 C C3 . MAN G 4 . ? 77.742 18.659 116.158 1.00 42.88 ? 10 MAN G C3 1 +HETATM 20352 C C4 . MAN G 4 . ? 78.828 19.284 115.267 1.00 43.14 ? 10 MAN G C4 1 +HETATM 20353 C C5 . MAN G 4 . ? 79.455 20.577 115.808 1.00 43.17 ? 10 MAN G C5 1 +HETATM 20354 C C6 . MAN G 4 . ? 79.568 21.669 114.743 1.00 43.03 ? 10 MAN G C6 1 +HETATM 20355 O O2 . MAN G 4 . ? 75.514 19.603 116.518 1.00 43.06 ? 10 MAN G O2 1 +HETATM 20356 O O3 . MAN G 4 . ? 76.925 17.835 115.351 1.00 42.96 ? 10 MAN G O3 1 +HETATM 20357 O O4 . MAN G 4 . ? 79.867 18.342 115.103 1.00 44.40 ? 10 MAN G O4 1 +HETATM 20358 O O5 . MAN G 4 . ? 78.750 21.083 116.925 1.00 42.04 ? 10 MAN G O5 1 +HETATM 20359 O O6 . MAN G 4 . ? 80.795 21.550 114.062 1.00 42.98 ? 10 MAN G O6 1 +HETATM 20360 C C1 . NAG H 5 . ? 84.311 86.543 72.955 1.00 9.83 ? 1 NAG H C1 1 +HETATM 20361 C C2 . NAG H 5 . ? 83.594 87.870 72.754 1.00 8.02 ? 1 NAG H C2 1 +HETATM 20362 C C3 . NAG H 5 . ? 84.501 88.989 73.232 1.00 10.37 ? 1 NAG H C3 1 +HETATM 20363 C C4 . NAG H 5 . ? 84.890 88.743 74.681 1.00 9.31 ? 1 NAG H C4 1 +HETATM 20364 C C5 . NAG H 5 . ? 85.546 87.368 74.777 1.00 9.21 ? 1 NAG H C5 1 +HETATM 20365 C C6 . NAG H 5 . ? 85.966 86.954 76.180 1.00 9.91 ? 1 NAG H C6 1 +HETATM 20366 C C7 . NAG H 5 . ? 82.069 87.828 70.837 1.00 10.32 ? 1 NAG H C7 1 +HETATM 20367 C C8 . NAG H 5 . ? 81.898 88.322 69.423 1.00 10.84 ? 1 NAG H C8 1 +HETATM 20368 N N2 . NAG H 5 . ? 83.271 88.037 71.356 1.00 8.12 ? 1 NAG H N2 1 +HETATM 20369 O O3 . NAG H 5 . ? 83.836 90.222 73.125 1.00 9.52 ? 1 NAG H O3 1 +HETATM 20370 O O4 . NAG H 5 . ? 85.832 89.729 75.026 1.00 10.33 ? 1 NAG H O4 1 +HETATM 20371 O O5 . NAG H 5 . ? 84.662 86.371 74.294 1.00 7.90 ? 1 NAG H O5 1 +HETATM 20372 O O6 . NAG H 5 . ? 84.939 87.161 77.116 1.00 9.75 ? 1 NAG H O6 1 +HETATM 20373 O O7 . NAG H 5 . ? 81.142 87.249 71.420 1.00 10.70 ? 1 NAG H O7 1 +HETATM 20374 C C1 . NAG H 5 . ? 85.492 90.431 76.236 1.00 10.11 ? 2 NAG H C1 1 +HETATM 20375 C C2 . NAG H 5 . ? 86.720 91.210 76.684 1.00 9.43 ? 2 NAG H C2 1 +HETATM 20376 C C3 . NAG H 5 . ? 86.436 92.011 77.946 1.00 9.97 ? 2 NAG H C3 1 +HETATM 20377 C C4 . NAG H 5 . ? 85.139 92.797 77.882 1.00 9.80 ? 2 NAG H C4 1 +HETATM 20378 C C5 . NAG H 5 . ? 84.013 91.979 77.271 1.00 9.14 ? 2 NAG H C5 1 +HETATM 20379 C C6 . NAG H 5 . ? 82.830 92.890 76.990 1.00 10.70 ? 2 NAG H C6 1 +HETATM 20380 C C7 . NAG H 5 . ? 88.854 90.045 76.254 1.00 11.56 ? 2 NAG H C7 1 +HETATM 20381 C C8 . NAG H 5 . ? 89.942 89.233 76.899 1.00 11.26 ? 2 NAG H C8 1 +HETATM 20382 N N2 . NAG H 5 . ? 87.807 90.315 77.034 1.00 9.86 ? 2 NAG H N2 1 +HETATM 20383 O O3 . NAG H 5 . ? 87.554 92.865 78.186 1.00 10.44 ? 2 NAG H O3 1 +HETATM 20384 O O4 . NAG H 5 . ? 84.756 93.141 79.196 1.00 7.77 ? 2 NAG H O4 1 +HETATM 20385 O O5 . NAG H 5 . ? 84.414 91.327 76.075 1.00 9.89 ? 2 NAG H O5 1 +HETATM 20386 O O6 . NAG H 5 . ? 81.748 92.064 76.624 1.00 13.77 ? 2 NAG H O6 1 +HETATM 20387 O O7 . NAG H 5 . ? 88.949 90.411 75.085 1.00 13.22 ? 2 NAG H O7 1 +HETATM 20388 C C1 . BMA H 5 . ? 84.938 94.529 79.522 1.00 8.57 ? 3 BMA H C1 1 +HETATM 20389 C C2 . BMA H 5 . ? 84.218 94.857 80.820 1.00 7.64 ? 3 BMA H C2 1 +HETATM 20390 C C3 . BMA H 5 . ? 84.427 96.311 81.218 1.00 9.53 ? 3 BMA H C3 1 +HETATM 20391 C C4 . BMA H 5 . ? 85.920 96.603 81.273 1.00 9.68 ? 3 BMA H C4 1 +HETATM 20392 C C5 . BMA H 5 . ? 86.583 96.180 79.978 1.00 9.44 ? 3 BMA H C5 1 +HETATM 20393 C C6 . BMA H 5 . ? 88.093 96.358 80.071 1.00 9.12 ? 3 BMA H C6 1 +HETATM 20394 O O2 . BMA H 5 . ? 84.734 94.031 81.883 1.00 9.15 ? 3 BMA H O2 1 +HETATM 20395 O O3 . BMA H 5 . ? 83.870 96.462 82.521 1.00 9.75 ? 3 BMA H O3 1 +HETATM 20396 O O4 . BMA H 5 . ? 86.158 97.993 81.509 1.00 10.30 ? 3 BMA H O4 1 +HETATM 20397 O O5 . BMA H 5 . ? 86.315 94.798 79.704 1.00 8.03 ? 3 BMA H O5 1 +HETATM 20398 O O6 . BMA H 5 . ? 88.591 96.147 78.755 1.00 11.82 ? 3 BMA H O6 1 +HETATM 20399 C C1 . MAN H 5 . ? 83.126 97.676 82.689 1.00 9.81 ? 4 MAN H C1 1 +HETATM 20400 C C2 . MAN H 5 . ? 82.899 97.829 84.184 1.00 11.22 ? 4 MAN H C2 1 +HETATM 20401 C C3 . MAN H 5 . ? 81.963 96.744 84.700 1.00 11.84 ? 4 MAN H C3 1 +HETATM 20402 C C4 . MAN H 5 . ? 80.668 96.862 83.905 1.00 11.76 ? 4 MAN H C4 1 +HETATM 20403 C C5 . MAN H 5 . ? 80.947 96.723 82.412 1.00 12.49 ? 4 MAN H C5 1 +HETATM 20404 C C6 . MAN H 5 . ? 79.668 96.887 81.600 1.00 13.74 ? 4 MAN H C6 1 +HETATM 20405 O O2 . MAN H 5 . ? 82.245 99.036 84.480 1.00 11.10 ? 4 MAN H O2 1 +HETATM 20406 O O3 . MAN H 5 . ? 81.701 97.005 86.071 1.00 14.14 ? 4 MAN H O3 1 +HETATM 20407 O O4 . MAN H 5 . ? 79.714 95.908 84.319 1.00 12.62 ? 4 MAN H O4 1 +HETATM 20408 O O5 . MAN H 5 . ? 81.909 97.689 81.976 1.00 10.81 ? 4 MAN H O5 1 +HETATM 20409 O O6 . MAN H 5 . ? 79.068 98.143 81.892 1.00 15.91 ? 4 MAN H O6 1 +HETATM 20410 C C1 . MAN H 5 . ? 83.097 100.123 84.855 1.00 14.22 ? 5 MAN H C1 1 +HETATM 20411 C C2 . MAN H 5 . ? 82.224 101.231 85.444 1.00 13.37 ? 5 MAN H C2 1 +HETATM 20412 C C3 . MAN H 5 . ? 81.247 101.722 84.387 1.00 13.37 ? 5 MAN H C3 1 +HETATM 20413 C C4 . MAN H 5 . ? 82.032 102.220 83.178 1.00 13.90 ? 5 MAN H C4 1 +HETATM 20414 C C5 . MAN H 5 . ? 83.021 101.151 82.697 1.00 13.31 ? 5 MAN H C5 1 +HETATM 20415 C C6 . MAN H 5 . ? 84.022 101.708 81.685 1.00 14.52 ? 5 MAN H C6 1 +HETATM 20416 O O2 . MAN H 5 . ? 82.955 102.367 85.894 1.00 15.64 ? 5 MAN H O2 1 +HETATM 20417 O O3 . MAN H 5 . ? 80.415 102.755 84.888 1.00 14.64 ? 5 MAN H O3 1 +HETATM 20418 O O4 . MAN H 5 . ? 81.103 102.474 82.165 1.00 14.43 ? 5 MAN H O4 1 +HETATM 20419 O O5 . MAN H 5 . ? 83.814 100.638 83.749 1.00 12.46 ? 5 MAN H O5 1 +HETATM 20420 O O6 . MAN H 5 . ? 84.973 102.545 82.337 1.00 12.21 ? 5 MAN H O6 1 +HETATM 20421 C C1 . MAN H 5 . ? 83.869 102.074 86.969 1.00 16.20 ? 6 MAN H C1 1 +HETATM 20422 C C2 . MAN H 5 . ? 83.951 103.273 87.903 1.00 17.54 ? 6 MAN H C2 1 +HETATM 20423 C C3 . MAN H 5 . ? 84.454 104.487 87.127 1.00 17.35 ? 6 MAN H C3 1 +HETATM 20424 C C4 . MAN H 5 . ? 85.752 104.127 86.413 1.00 15.93 ? 6 MAN H C4 1 +HETATM 20425 C C5 . MAN H 5 . ? 85.624 102.826 85.618 1.00 16.08 ? 6 MAN H C5 1 +HETATM 20426 C C6 . MAN H 5 . ? 86.997 102.442 85.081 1.00 15.50 ? 6 MAN H C6 1 +HETATM 20427 O O2 . MAN H 5 . ? 84.853 102.995 88.953 1.00 18.19 ? 6 MAN H O2 1 +HETATM 20428 O O3 . MAN H 5 . ? 84.653 105.572 88.008 1.00 19.12 ? 6 MAN H O3 1 +HETATM 20429 O O4 . MAN H 5 . ? 86.166 105.198 85.586 1.00 15.00 ? 6 MAN H O4 1 +HETATM 20430 O O5 . MAN H 5 . ? 85.159 101.786 86.474 1.00 16.31 ? 6 MAN H O5 1 +HETATM 20431 O O6 . MAN H 5 . ? 86.904 101.441 84.088 1.00 16.00 ? 6 MAN H O6 1 +HETATM 20432 C C1 . MAN H 5 . ? 90.004 96.377 78.619 1.00 10.13 ? 7 MAN H C1 1 +HETATM 20433 C C2 . MAN H 5 . ? 90.353 96.176 77.150 1.00 9.62 ? 7 MAN H C2 1 +HETATM 20434 C C3 . MAN H 5 . ? 90.084 94.721 76.781 1.00 11.11 ? 7 MAN H C3 1 +HETATM 20435 C C4 . MAN H 5 . ? 90.876 93.798 77.696 1.00 12.20 ? 7 MAN H C4 1 +HETATM 20436 C C5 . MAN H 5 . ? 90.694 94.141 79.175 1.00 12.70 ? 7 MAN H C5 1 +HETATM 20437 C C6 . MAN H 5 . ? 91.789 93.466 79.992 1.00 12.42 ? 7 MAN H C6 1 +HETATM 20438 O O2 . MAN H 5 . ? 91.714 96.496 76.945 1.00 8.69 ? 7 MAN H O2 1 +HETATM 20439 O O3 . MAN H 5 . ? 90.541 94.470 75.477 1.00 11.54 ? 7 MAN H O3 1 +HETATM 20440 O O4 . MAN H 5 . ? 90.458 92.456 77.494 1.00 14.83 ? 7 MAN H O4 1 +HETATM 20441 O O5 . MAN H 5 . ? 90.777 95.520 79.434 1.00 11.42 ? 7 MAN H O5 1 +HETATM 20442 O O6 . MAN H 5 . ? 93.019 93.962 79.500 1.00 13.24 ? 7 MAN H O6 1 +HETATM 20443 C C1 . MAN H 5 . ? 94.161 93.288 80.061 1.00 15.21 ? 8 MAN H C1 1 +HETATM 20444 C C2 . MAN H 5 . ? 95.408 94.058 79.641 1.00 15.42 ? 8 MAN H C2 1 +HETATM 20445 C C3 . MAN H 5 . ? 95.588 93.976 78.135 1.00 17.89 ? 8 MAN H C3 1 +HETATM 20446 C C4 . MAN H 5 . ? 95.646 92.528 77.705 1.00 18.87 ? 8 MAN H C4 1 +HETATM 20447 C C5 . MAN H 5 . ? 94.425 91.780 78.251 1.00 18.60 ? 8 MAN H C5 1 +HETATM 20448 C C6 . MAN H 5 . ? 94.457 90.288 77.929 1.00 19.31 ? 8 MAN H C6 1 +HETATM 20449 O O2 . MAN H 5 . ? 96.584 93.526 80.210 1.00 15.09 ? 8 MAN H O2 1 +HETATM 20450 O O3 . MAN H 5 . ? 96.784 94.635 77.788 1.00 19.16 ? 8 MAN H O3 1 +HETATM 20451 O O4 . MAN H 5 . ? 95.691 92.478 76.294 1.00 21.34 ? 8 MAN H O4 1 +HETATM 20452 O O5 . MAN H 5 . ? 94.331 91.939 79.656 1.00 16.02 ? 8 MAN H O5 1 +HETATM 20453 O O6 . MAN H 5 . ? 95.543 89.664 78.588 1.00 21.24 ? 8 MAN H O6 1 +HETATM 20454 C C1 . MAN H 5 . ? 96.835 93.981 81.548 1.00 16.21 ? 9 MAN H C1 1 +HETATM 20455 C C2 . MAN H 5 . ? 98.326 93.832 81.807 1.00 17.12 ? 9 MAN H C2 1 +HETATM 20456 C C3 . MAN H 5 . ? 98.731 92.370 81.811 1.00 18.93 ? 9 MAN H C3 1 +HETATM 20457 C C4 . MAN H 5 . ? 97.835 91.587 82.766 1.00 18.73 ? 9 MAN H C4 1 +HETATM 20458 C C5 . MAN H 5 . ? 96.363 91.842 82.410 1.00 18.03 ? 9 MAN H C5 1 +HETATM 20459 C C6 . MAN H 5 . ? 95.436 91.123 83.368 1.00 18.63 ? 9 MAN H C6 1 +HETATM 20460 O O2 . MAN H 5 . ? 98.667 94.356 83.070 1.00 15.84 ? 9 MAN H O2 1 +HETATM 20461 O O3 . MAN H 5 . ? 100.083 92.288 82.213 1.00 20.95 ? 9 MAN H O3 1 +HETATM 20462 O O4 . MAN H 5 . ? 98.144 90.208 82.698 1.00 19.11 ? 9 MAN H O4 1 +HETATM 20463 O O5 . MAN H 5 . ? 96.092 93.231 82.481 1.00 17.48 ? 9 MAN H O5 1 +HETATM 20464 O O6 . MAN H 5 . ? 94.094 91.407 83.030 1.00 20.51 ? 9 MAN H O6 1 +HETATM 20465 C C1 . MAN H 5 . ? 89.482 94.311 74.522 1.00 12.27 ? 10 MAN H C1 1 +HETATM 20466 C C2 . MAN H 5 . ? 90.119 93.806 73.227 1.00 14.21 ? 10 MAN H C2 1 +HETATM 20467 C C3 . MAN H 5 . ? 90.974 94.867 72.573 1.00 15.21 ? 10 MAN H C3 1 +HETATM 20468 C C4 . MAN H 5 . ? 90.129 96.122 72.360 1.00 14.76 ? 10 MAN H C4 1 +HETATM 20469 C C5 . MAN H 5 . ? 89.475 96.552 73.679 1.00 14.25 ? 10 MAN H C5 1 +HETATM 20470 C C6 . MAN H 5 . ? 88.540 97.749 73.513 1.00 15.57 ? 10 MAN H C6 1 +HETATM 20471 O O2 . MAN H 5 . ? 89.109 93.475 72.299 1.00 15.55 ? 10 MAN H O2 1 +HETATM 20472 O O3 . MAN H 5 . ? 91.490 94.341 71.361 1.00 16.85 ? 10 MAN H O3 1 +HETATM 20473 O O4 . MAN H 5 . ? 90.931 97.173 71.843 1.00 15.51 ? 10 MAN H O4 1 +HETATM 20474 O O5 . MAN H 5 . ? 88.737 95.483 74.278 1.00 11.77 ? 10 MAN H O5 1 +HETATM 20475 O O6 . MAN H 5 . ? 87.319 97.338 72.920 1.00 17.22 ? 10 MAN H O6 1 +HETATM 20476 C C1 . NAG I 6 . ? 98.049 69.049 157.252 1.00 37.36 ? 650 NAG A C1 1 +HETATM 20477 C C2 . NAG I 6 . ? 98.544 70.086 158.270 1.00 38.86 ? 650 NAG A C2 1 +HETATM 20478 C C3 . NAG I 6 . ? 99.292 69.449 159.442 1.00 40.01 ? 650 NAG A C3 1 +HETATM 20479 C C4 . NAG I 6 . ? 98.686 68.122 159.880 1.00 40.43 ? 650 NAG A C4 1 +HETATM 20480 C C5 . NAG I 6 . ? 98.499 67.171 158.692 1.00 40.51 ? 650 NAG A C5 1 +HETATM 20481 C C6 . NAG I 6 . ? 97.158 66.431 158.712 1.00 40.67 ? 650 NAG A C6 1 +HETATM 20482 C C7 . NAG I 6 . ? 99.111 72.362 157.445 1.00 38.69 ? 650 NAG A C7 1 +HETATM 20483 C C8 . NAG I 6 . ? 97.927 72.981 158.131 1.00 38.64 ? 650 NAG A C8 1 +HETATM 20484 N N2 . NAG I 6 . ? 99.429 71.081 157.672 1.00 38.72 ? 650 NAG A N2 1 +HETATM 20485 O O3 . NAG I 6 . ? 99.293 70.356 160.524 1.00 40.54 ? 650 NAG A O3 1 +HETATM 20486 O O4 . NAG I 6 . ? 99.574 67.513 160.794 1.00 41.25 ? 650 NAG A O4 1 +HETATM 20487 O O5 . NAG I 6 . ? 98.716 67.813 157.437 1.00 39.07 ? 650 NAG A O5 1 +HETATM 20488 O O6 . NAG I 6 . ? 96.114 67.197 159.276 1.00 41.12 ? 650 NAG A O6 1 +HETATM 20489 O O7 . NAG I 6 . ? 99.779 73.054 156.682 1.00 40.10 ? 650 NAG A O7 1 +HETATM 20490 C C1 . MRD J 7 . ? 89.764 87.702 108.690 1.00 26.73 ? 1 MRD A C1 1 +HETATM 20491 C C2 . MRD J 7 . ? 88.608 88.582 108.232 1.00 26.46 ? 1 MRD A C2 1 +HETATM 20492 O O2 . MRD J 7 . ? 89.051 89.957 108.102 1.00 23.20 ? 1 MRD A O2 1 +HETATM 20493 C CM . MRD J 7 . ? 87.518 88.538 109.293 1.00 26.40 ? 1 MRD A CM 1 +HETATM 20494 C C3 . MRD J 7 . ? 88.142 88.112 106.861 1.00 27.15 ? 1 MRD A C3 1 +HETATM 20495 C C4 . MRD J 7 . ? 86.750 88.594 106.460 1.00 27.88 ? 1 MRD A C4 1 +HETATM 20496 O O4 . MRD J 7 . ? 86.336 87.893 105.302 1.00 28.72 ? 1 MRD A O4 1 +HETATM 20497 C C5 . MRD J 7 . ? 86.730 90.093 106.170 1.00 27.89 ? 1 MRD A C5 1 +HETATM 20498 C C1 . NAG K 6 . ? 102.133 50.692 45.956 1.00 21.86 ? 650 NAG B C1 1 +HETATM 20499 C C2 . NAG K 6 . ? 102.644 49.414 45.294 1.00 21.88 ? 650 NAG B C2 1 +HETATM 20500 C C3 . NAG K 6 . ? 103.409 49.679 43.992 1.00 23.26 ? 650 NAG B C3 1 +HETATM 20501 C C4 . NAG K 6 . ? 102.571 50.589 43.096 1.00 23.83 ? 650 NAG B C4 1 +HETATM 20502 C C5 . NAG K 6 . ? 102.217 51.852 43.884 1.00 23.79 ? 650 NAG B C5 1 +HETATM 20503 C C6 . NAG K 6 . ? 101.377 52.834 43.083 1.00 24.37 ? 650 NAG B C6 1 +HETATM 20504 C C7 . NAG K 6 . ? 103.288 47.319 46.426 1.00 22.61 ? 650 NAG B C7 1 +HETATM 20505 C C8 . NAG K 6 . ? 102.142 46.672 45.719 1.00 20.04 ? 650 NAG B C8 1 +HETATM 20506 N N2 . NAG K 6 . ? 103.432 48.642 46.255 1.00 21.05 ? 650 NAG B N2 1 +HETATM 20507 O O3 . NAG K 6 . ? 103.683 48.465 43.323 1.00 22.89 ? 650 NAG B O3 1 +HETATM 20508 O O4 . NAG K 6 . ? 103.268 50.909 41.907 1.00 25.57 ? 650 NAG B O4 1 +HETATM 20509 O O5 . NAG K 6 . ? 101.443 51.489 45.005 1.00 22.88 ? 650 NAG B O5 1 +HETATM 20510 O O6 . NAG K 6 . ? 100.106 52.253 42.884 1.00 24.20 ? 650 NAG B O6 1 +HETATM 20511 O O7 . NAG K 6 . ? 104.054 46.622 47.123 1.00 24.05 ? 650 NAG B O7 1 +HETATM 20512 C C1 . MPD L 8 . ? 87.036 32.960 94.442 1.00 23.57 ? 2 MPD B C1 1 +HETATM 20513 C C2 . MPD L 8 . ? 85.988 32.018 93.888 1.00 23.62 ? 2 MPD B C2 1 +HETATM 20514 O O2 . MPD L 8 . ? 86.325 30.659 94.306 1.00 20.97 ? 2 MPD B O2 1 +HETATM 20515 C CM . MPD L 8 . ? 86.072 32.076 92.368 1.00 22.81 ? 2 MPD B CM 1 +HETATM 20516 C C3 . MPD L 8 . ? 84.594 32.491 94.311 1.00 24.53 ? 2 MPD B C3 1 +HETATM 20517 C C4 . MPD L 8 . ? 84.010 31.954 95.614 1.00 25.83 ? 2 MPD B C4 1 +HETATM 20518 O O4 . MPD L 8 . ? 84.351 32.761 96.722 1.00 27.49 ? 2 MPD B O4 1 +HETATM 20519 C C5 . MPD L 8 . ? 82.491 31.944 95.506 1.00 25.78 ? 2 MPD B C5 1 +HETATM 20520 C C1 . NAG M 6 . ? 36.373 54.275 155.083 1.00 32.53 ? 650 NAG D C1 1 +HETATM 20521 C C2 . NAG M 6 . ? 35.834 53.118 155.922 1.00 33.43 ? 650 NAG D C2 1 +HETATM 20522 C C3 . NAG M 6 . ? 35.129 53.548 157.205 1.00 34.21 ? 650 NAG D C3 1 +HETATM 20523 C C4 . NAG M 6 . ? 35.886 54.664 157.913 1.00 34.84 ? 650 NAG D C4 1 +HETATM 20524 C C5 . NAG M 6 . ? 36.208 55.774 156.918 1.00 34.96 ? 650 NAG D C5 1 +HETATM 20525 C C6 . NAG M 6 . ? 36.949 56.935 157.574 1.00 35.51 ? 650 NAG D C6 1 +HETATM 20526 C C7 . NAG M 6 . ? 35.141 51.043 154.787 1.00 32.73 ? 650 NAG D C7 1 +HETATM 20527 C C8 . NAG M 6 . ? 36.276 50.335 155.460 1.00 31.78 ? 650 NAG D C8 1 +HETATM 20528 N N2 . NAG M 6 . ? 34.926 52.315 155.114 1.00 32.71 ? 650 NAG D N2 1 +HETATM 20529 O O3 . NAG M 6 . ? 35.037 52.434 158.066 1.00 34.22 ? 650 NAG D O3 1 +HETATM 20530 O O4 . NAG M 6 . ? 35.080 55.165 158.959 1.00 34.88 ? 650 NAG D O4 1 +HETATM 20531 O O5 . NAG M 6 . ? 37.014 55.245 155.885 1.00 33.87 ? 650 NAG D O5 1 +HETATM 20532 O O6 . NAG M 6 . ? 38.180 56.471 158.086 1.00 36.36 ? 650 NAG D O6 1 +HETATM 20533 O O7 . NAG M 6 . ? 34.438 50.442 153.967 1.00 33.89 ? 650 NAG D O7 1 +HETATM 20534 C C1 . MRD N 7 . ? 49.127 35.247 106.993 1.00 28.09 ? 3 MRD D C1 1 +HETATM 20535 C C2 . MRD N 7 . ? 50.166 34.166 107.252 1.00 27.29 ? 3 MRD D C2 1 +HETATM 20536 O O2 . MRD N 7 . ? 49.631 32.913 106.739 1.00 25.17 ? 3 MRD D O2 1 +HETATM 20537 C CM . MRD N 7 . ? 50.361 34.055 108.761 1.00 27.29 ? 3 MRD D CM 1 +HETATM 20538 C C3 . MRD N 7 . ? 51.508 34.558 106.620 1.00 27.89 ? 3 MRD D C3 1 +HETATM 20539 C C4 . MRD N 7 . ? 52.168 33.636 105.587 1.00 29.29 ? 3 MRD D C4 1 +HETATM 20540 O O4 . MRD N 7 . ? 52.440 34.400 104.427 1.00 30.82 ? 3 MRD D O4 1 +HETATM 20541 C C5 . MRD N 7 . ? 51.386 32.392 105.179 1.00 29.26 ? 3 MRD D C5 1 +HETATM 20542 C C1 . NAG O 6 . ? 42.090 71.705 43.029 1.00 28.57 ? 650 NAG E C1 1 +HETATM 20543 C C2 . NAG O 6 . ? 41.907 72.932 42.132 1.00 28.93 ? 650 NAG E C2 1 +HETATM 20544 C C3 . NAG O 6 . ? 41.235 72.594 40.802 1.00 31.29 ? 650 NAG E C3 1 +HETATM 20545 C C4 . NAG O 6 . ? 41.874 71.372 40.148 1.00 32.62 ? 650 NAG E C4 1 +HETATM 20546 C C5 . NAG O 6 . ? 41.946 70.236 41.156 1.00 32.76 ? 650 NAG E C5 1 +HETATM 20547 C C6 . NAG O 6 . ? 42.621 69.003 40.568 1.00 33.16 ? 650 NAG E C6 1 +HETATM 20548 C C7 . NAG O 6 . ? 41.651 75.199 43.055 1.00 25.75 ? 650 NAG E C7 1 +HETATM 20549 C C8 . NAG O 6 . ? 40.724 76.176 43.713 1.00 25.09 ? 650 NAG E C8 1 +HETATM 20550 N N2 . NAG O 6 . ? 41.158 73.978 42.821 1.00 26.82 ? 650 NAG E N2 1 +HETATM 20551 O O3 . NAG O 6 . ? 41.331 73.701 39.931 1.00 31.56 ? 650 NAG E O3 1 +HETATM 20552 O O4 . NAG O 6 . ? 41.116 70.987 39.014 1.00 34.99 ? 650 NAG E O4 1 +HETATM 20553 O O5 . NAG O 6 . ? 42.687 70.664 42.280 1.00 30.24 ? 650 NAG E O5 1 +HETATM 20554 O O6 . NAG O 6 . ? 42.524 67.945 41.496 1.00 34.77 ? 650 NAG E O6 1 +HETATM 20555 O O7 . NAG O 6 . ? 42.788 75.558 42.772 1.00 24.37 ? 650 NAG E O7 1 +HETATM 20556 C C1 . BMA P 9 . ? 87.350 91.751 71.874 1.00 36.01 ? 661 BMA E C1 1 +HETATM 20557 C C2 . BMA P 9 . ? 87.263 92.289 70.432 1.00 36.15 ? 661 BMA E C2 1 +HETATM 20558 C C3 . BMA P 9 . ? 86.632 93.660 70.310 1.00 36.79 ? 661 BMA E C3 1 +HETATM 20559 C C4 . BMA P 9 . ? 85.483 93.716 71.291 1.00 36.18 ? 661 BMA E C4 1 +HETATM 20560 C C5 . BMA P 9 . ? 86.132 93.790 72.666 1.00 35.82 ? 661 BMA E C5 1 +HETATM 20561 C C6 . BMA P 9 . ? 85.103 94.036 73.769 1.00 35.83 ? 661 BMA E C6 1 +HETATM 20562 O O1 . BMA P 9 . ? 86.641 90.545 71.903 1.00 33.75 ? 661 BMA E O1 1 +HETATM 20563 O O2 . BMA P 9 . ? 86.508 91.429 69.614 1.00 36.48 ? 661 BMA E O2 1 +HETATM 20564 O O3 . BMA P 9 . ? 86.162 93.873 68.995 1.00 38.24 ? 661 BMA E O3 1 +HETATM 20565 O O4 . BMA P 9 . ? 84.686 94.841 71.021 1.00 36.05 ? 661 BMA E O4 1 +HETATM 20566 O O5 . BMA P 9 . ? 86.877 92.604 72.941 1.00 36.43 ? 661 BMA E O5 1 +HETATM 20567 O O6 . BMA P 9 . ? 84.170 92.977 73.788 1.00 34.82 ? 661 BMA E O6 1 +HETATM 20568 C C1 . MPD Q 8 . ? 52.595 89.255 92.059 1.00 26.04 ? 4 MPD E C1 1 +HETATM 20569 C C2 . MPD Q 8 . ? 53.687 90.295 91.865 1.00 26.17 ? 4 MPD E C2 1 +HETATM 20570 O O2 . MPD Q 8 . ? 53.201 91.571 92.352 1.00 24.21 ? 4 MPD E O2 1 +HETATM 20571 C CM . MPD Q 8 . ? 53.955 90.415 90.373 1.00 26.67 ? 4 MPD E CM 1 +HETATM 20572 C C3 . MPD Q 8 . ? 54.958 89.866 92.599 1.00 27.46 ? 4 MPD E C3 1 +HETATM 20573 C C4 . MPD Q 8 . ? 55.527 90.862 93.609 1.00 28.09 ? 4 MPD E C4 1 +HETATM 20574 O O4 . MPD Q 8 . ? 54.716 91.011 94.754 1.00 29.98 ? 4 MPD E O4 1 +HETATM 20575 C C5 . MPD Q 8 . ? 56.896 90.379 94.070 1.00 27.77 ? 4 MPD E C5 1 +HETATM 20576 C C1 . MRD R 7 . ? 49.021 103.554 75.992 1.00 36.64 ? 5 MRD E C1 1 +HETATM 20577 C C2 . MRD R 7 . ? 48.475 103.774 77.395 1.00 36.61 ? 5 MRD E C2 1 +HETATM 20578 O O2 . MRD R 7 . ? 47.723 105.011 77.380 1.00 36.56 ? 5 MRD E O2 1 +HETATM 20579 C CM . MRD R 7 . ? 47.538 102.634 77.775 1.00 37.22 ? 5 MRD E CM 1 +HETATM 20580 C C3 . MRD R 7 . ? 49.634 103.880 78.388 1.00 36.80 ? 5 MRD E C3 1 +HETATM 20581 C C4 . MRD R 7 . ? 49.236 104.469 79.745 1.00 37.63 ? 5 MRD E C4 1 +HETATM 20582 O O4 . MRD R 7 . ? 48.746 105.787 79.604 1.00 38.11 ? 5 MRD E O4 1 +HETATM 20583 C C5 . MRD R 7 . ? 50.428 104.501 80.699 1.00 37.22 ? 5 MRD E C5 1 +HETATM 20584 O O . HOH S 10 . ? 82.411 72.763 107.046 1.00 4.31 ? 3 HOH A O 1 +HETATM 20585 O O . HOH S 10 . ? 80.124 71.938 100.060 1.00 9.04 ? 5 HOH A O 1 +HETATM 20586 O O . HOH S 10 . ? 72.546 66.389 109.608 1.00 5.72 ? 14 HOH A O 1 +HETATM 20587 O O . HOH S 10 . ? 78.017 89.847 118.521 1.00 8.57 ? 16 HOH A O 1 +HETATM 20588 O O . HOH S 10 . ? 79.150 84.832 121.365 1.00 10.97 ? 17 HOH A O 1 +HETATM 20589 O O . HOH S 10 . ? 69.199 81.931 122.818 1.00 11.58 ? 634 HOH A O 1 +HETATM 20590 O O . HOH S 10 . ? 77.646 81.706 137.493 1.00 10.72 ? 635 HOH A O 1 +HETATM 20591 O O . HOH S 10 . ? 60.353 92.096 110.064 1.00 36.55 ? 636 HOH A O 1 +HETATM 20592 O O . HOH S 10 . ? 68.139 82.879 115.121 1.00 9.20 ? 637 HOH A O 1 +HETATM 20593 O O . HOH S 10 . ? 96.501 85.907 140.448 1.00 19.77 ? 638 HOH A O 1 +HETATM 20594 O O . HOH S 10 . ? 77.597 81.256 113.858 1.00 11.87 ? 639 HOH A O 1 +HETATM 20595 O O . HOH S 10 . ? 78.417 69.986 122.366 1.00 26.94 ? 640 HOH A O 1 +HETATM 20596 O O . HOH S 10 . ? 67.347 75.966 129.347 1.00 10.14 ? 641 HOH A O 1 +HETATM 20597 O O . HOH S 10 . ? 59.316 80.872 126.334 1.00 13.36 ? 642 HOH A O 1 +HETATM 20598 O O . HOH S 10 . ? 78.127 77.537 145.868 1.00 13.97 ? 643 HOH A O 1 +HETATM 20599 O O . HOH S 10 . ? 60.267 80.065 119.548 1.00 9.94 ? 644 HOH A O 1 +HETATM 20600 O O . HOH S 10 . ? 71.704 64.043 103.460 1.00 16.12 ? 645 HOH A O 1 +HETATM 20601 O O . HOH S 10 . ? 87.405 57.822 120.576 1.00 10.17 ? 646 HOH A O 1 +HETATM 20602 O O . HOH S 10 . ? 65.786 81.533 116.164 1.00 9.71 ? 647 HOH A O 1 +HETATM 20603 O O . HOH S 10 . ? 95.182 70.508 156.847 1.00 17.05 ? 648 HOH A O 1 +HETATM 20604 O O . HOH S 10 . ? 75.849 83.485 114.230 1.00 10.68 ? 649 HOH A O 1 +HETATM 20605 O O . HOH S 10 . ? 73.536 71.516 133.925 1.00 19.84 ? 661 HOH A O 1 +HETATM 20606 O O . HOH S 10 . ? 70.796 76.172 128.304 1.00 10.69 ? 662 HOH A O 1 +HETATM 20607 O O . HOH S 10 . ? 75.991 74.181 94.020 1.00 10.52 ? 663 HOH A O 1 +HETATM 20608 O O . HOH S 10 . ? 61.938 84.640 120.681 1.00 15.16 ? 664 HOH A O 1 +HETATM 20609 O O . HOH S 10 . ? 54.141 67.433 124.784 1.00 11.09 ? 665 HOH A O 1 +HETATM 20610 O O . HOH S 10 . ? 77.413 85.560 114.226 1.00 12.39 ? 666 HOH A O 1 +HETATM 20611 O O . HOH S 10 . ? 70.564 74.732 117.035 1.00 8.20 ? 667 HOH A O 1 +HETATM 20612 O O . HOH S 10 . ? 68.229 78.587 124.480 1.00 8.73 ? 668 HOH A O 1 +HETATM 20613 O O . HOH S 10 . ? 86.253 84.487 98.698 1.00 7.45 ? 669 HOH A O 1 +HETATM 20614 O O . HOH S 10 . ? 75.617 79.681 103.573 1.00 9.33 ? 670 HOH A O 1 +HETATM 20615 O O . HOH S 10 . ? 75.740 74.284 91.429 1.00 14.46 ? 671 HOH A O 1 +HETATM 20616 O O . HOH S 10 . ? 70.407 76.567 118.951 1.00 9.70 ? 672 HOH A O 1 +HETATM 20617 O O . HOH S 10 . ? 80.071 57.727 114.814 1.00 7.98 ? 673 HOH A O 1 +HETATM 20618 O O . HOH S 10 . ? 69.305 78.611 128.202 1.00 12.99 ? 674 HOH A O 1 +HETATM 20619 O O . HOH S 10 . ? 89.258 54.343 115.711 1.00 37.73 ? 675 HOH A O 1 +HETATM 20620 O O . HOH S 10 . ? 61.862 71.139 128.792 1.00 10.70 ? 676 HOH A O 1 +HETATM 20621 O O . HOH S 10 . ? 98.349 65.575 132.210 1.00 15.31 ? 677 HOH A O 1 +HETATM 20622 O O . HOH S 10 . ? 76.574 71.034 116.387 1.00 16.43 ? 678 HOH A O 1 +HETATM 20623 O O . HOH S 10 . ? 74.553 68.751 121.517 1.00 26.56 ? 679 HOH A O 1 +HETATM 20624 O O . HOH S 10 . ? 45.184 89.217 125.969 1.00 17.83 ? 680 HOH A O 1 +HETATM 20625 O O . HOH S 10 . ? 63.804 76.190 111.524 1.00 12.43 ? 681 HOH A O 1 +HETATM 20626 O O . HOH S 10 . ? 52.136 84.304 130.987 1.00 11.40 ? 682 HOH A O 1 +HETATM 20627 O O . HOH S 10 . ? 97.503 68.530 137.360 1.00 13.24 ? 683 HOH A O 1 +HETATM 20628 O O . HOH S 10 . ? 80.593 66.635 86.198 1.00 9.21 ? 684 HOH A O 1 +HETATM 20629 O O . HOH S 10 . ? 81.931 78.056 140.571 1.00 21.01 ? 685 HOH A O 1 +HETATM 20630 O O . HOH S 10 . ? 94.409 68.677 104.463 1.00 12.26 ? 686 HOH A O 1 +HETATM 20631 O O . HOH S 10 . ? 97.989 70.440 104.066 1.00 14.70 ? 687 HOH A O 1 +HETATM 20632 O O . HOH S 10 . ? 81.317 85.723 108.991 1.00 19.75 ? 688 HOH A O 1 +HETATM 20633 O O . HOH S 10 . ? 97.220 62.351 124.744 1.00 15.61 ? 689 HOH A O 1 +HETATM 20634 O O . HOH S 10 . ? 93.854 89.478 133.752 1.00 16.65 ? 690 HOH A O 1 +HETATM 20635 O O . HOH S 10 . ? 54.583 66.528 138.985 1.00 16.19 ? 691 HOH A O 1 +HETATM 20636 O O . HOH S 10 . ? 90.704 86.970 131.988 1.00 20.92 ? 692 HOH A O 1 +HETATM 20637 O O . HOH S 10 . ? 56.801 71.437 120.168 1.00 15.75 ? 693 HOH A O 1 +HETATM 20638 O O . HOH S 10 . ? 75.038 82.187 136.891 1.00 12.76 ? 694 HOH A O 1 +HETATM 20639 O O . HOH S 10 . ? 81.909 83.895 89.739 1.00 17.44 ? 695 HOH A O 1 +HETATM 20640 O O . HOH S 10 . ? 82.393 65.905 103.137 1.00 8.58 ? 696 HOH A O 1 +HETATM 20641 O O . HOH S 10 . ? 70.271 100.245 115.298 1.00 19.91 ? 697 HOH A O 1 +HETATM 20642 O O . HOH S 10 . ? 80.199 83.126 110.749 1.00 15.26 ? 698 HOH A O 1 +HETATM 20643 O O . HOH S 10 . ? 81.181 74.708 135.135 1.00 16.13 ? 699 HOH A O 1 +HETATM 20644 O O . HOH S 10 . ? 77.127 79.873 111.585 1.00 9.25 ? 700 HOH A O 1 +HETATM 20645 O O . HOH S 10 . ? 70.922 64.180 117.057 1.00 9.89 ? 701 HOH A O 1 +HETATM 20646 O O . HOH S 10 . ? 61.820 79.302 121.621 1.00 7.47 ? 702 HOH A O 1 +HETATM 20647 O O . HOH S 10 . ? 93.107 90.454 137.238 1.00 15.23 ? 703 HOH A O 1 +HETATM 20648 O O . HOH S 10 . ? 97.268 69.186 122.015 1.00 16.56 ? 704 HOH A O 1 +HETATM 20649 O O . HOH S 10 . ? 68.913 81.076 113.150 1.00 13.03 ? 705 HOH A O 1 +HETATM 20650 O O . HOH S 10 . ? 66.933 83.189 133.029 1.00 9.80 ? 706 HOH A O 1 +HETATM 20651 O O . HOH S 10 . ? 57.317 71.034 116.717 1.00 17.67 ? 707 HOH A O 1 +HETATM 20652 O O . HOH S 10 . ? 84.937 96.739 135.115 1.00 23.31 ? 708 HOH A O 1 +HETATM 20653 O O . HOH S 10 . ? 70.309 81.718 110.624 1.00 11.21 ? 709 HOH A O 1 +HETATM 20654 O O . HOH S 10 . ? 68.913 83.047 125.489 1.00 12.28 ? 710 HOH A O 1 +HETATM 20655 O O . HOH S 10 . ? 67.055 78.600 98.499 1.00 7.81 ? 711 HOH A O 1 +HETATM 20656 O O . HOH S 10 . ? 104.401 92.160 109.687 1.00 28.33 ? 712 HOH A O 1 +HETATM 20657 O O . HOH S 10 . ? 75.791 79.500 114.958 1.00 8.40 ? 713 HOH A O 1 +HETATM 20658 O O . HOH S 10 . ? 95.012 81.128 95.836 1.00 11.06 ? 714 HOH A O 1 +HETATM 20659 O O . HOH S 10 . ? 49.590 70.690 136.727 1.00 19.82 ? 715 HOH A O 1 +HETATM 20660 O O . HOH S 10 . ? 90.538 80.593 138.710 1.00 18.72 ? 716 HOH A O 1 +HETATM 20661 O O . HOH S 10 . ? 94.394 65.550 105.677 1.00 16.15 ? 717 HOH A O 1 +HETATM 20662 O O . HOH S 10 . ? 80.238 85.471 94.102 1.00 17.60 ? 718 HOH A O 1 +HETATM 20663 O O . HOH S 10 . ? 65.531 87.148 111.879 1.00 14.53 ? 719 HOH A O 1 +HETATM 20664 O O . HOH S 10 . ? 98.639 81.688 104.467 1.00 13.88 ? 720 HOH A O 1 +HETATM 20665 O O . HOH S 10 . ? 83.376 90.996 114.457 1.00 10.57 ? 721 HOH A O 1 +HETATM 20666 O O . HOH S 10 . ? 90.983 73.073 111.143 1.00 6.56 ? 722 HOH A O 1 +HETATM 20667 O O . HOH S 10 . ? 45.308 88.119 128.663 1.00 14.47 ? 723 HOH A O 1 +HETATM 20668 O O . HOH S 10 . ? 59.611 82.833 116.640 1.00 13.68 ? 724 HOH A O 1 +HETATM 20669 O O . HOH S 10 . ? 68.306 68.017 108.205 1.00 12.87 ? 725 HOH A O 1 +HETATM 20670 O O . HOH S 10 . ? 82.076 64.786 147.388 1.00 26.26 ? 726 HOH A O 1 +HETATM 20671 O O . HOH S 10 . ? 80.836 87.423 95.794 1.00 17.25 ? 727 HOH A O 1 +HETATM 20672 O O . HOH S 10 . ? 87.459 71.862 138.348 1.00 15.81 ? 728 HOH A O 1 +HETATM 20673 O O . HOH S 10 . ? 48.342 91.740 120.274 1.00 37.99 ? 729 HOH A O 1 +HETATM 20674 O O . HOH S 10 . ? 86.121 67.091 136.211 1.00 20.52 ? 730 HOH A O 1 +HETATM 20675 O O . HOH S 10 . ? 101.681 78.128 116.053 1.00 21.76 ? 731 HOH A O 1 +HETATM 20676 O O . HOH S 10 . ? 81.421 70.493 88.107 1.00 9.70 ? 732 HOH A O 1 +HETATM 20677 O O . HOH S 10 . ? 73.082 84.902 129.991 1.00 13.21 ? 733 HOH A O 1 +HETATM 20678 O O . HOH S 10 . ? 91.879 62.148 126.898 1.00 17.36 ? 734 HOH A O 1 +HETATM 20679 O O . HOH S 10 . ? 68.055 85.731 126.206 1.00 21.40 ? 735 HOH A O 1 +HETATM 20680 O O . HOH S 10 . ? 54.941 89.884 129.816 1.00 12.38 ? 736 HOH A O 1 +HETATM 20681 O O . HOH S 10 . ? 71.510 70.918 109.745 1.00 11.99 ? 737 HOH A O 1 +HETATM 20682 O O . HOH S 10 . ? 68.089 81.362 108.928 1.00 10.83 ? 738 HOH A O 1 +HETATM 20683 O O . HOH S 10 . ? 69.860 80.786 132.293 1.00 10.83 ? 739 HOH A O 1 +HETATM 20684 O O . HOH S 10 . ? 101.621 65.113 133.883 1.00 22.41 ? 740 HOH A O 1 +HETATM 20685 O O . HOH S 10 . ? 81.510 79.700 142.780 1.00 19.68 ? 741 HOH A O 1 +HETATM 20686 O O . HOH S 10 . ? 72.129 86.900 128.588 1.00 14.13 ? 742 HOH A O 1 +HETATM 20687 O O . HOH S 10 . ? 71.058 84.196 126.747 1.00 24.62 ? 743 HOH A O 1 +HETATM 20688 O O . HOH S 10 . ? 69.548 87.843 127.948 1.00 18.23 ? 744 HOH A O 1 +HETATM 20689 O O . HOH S 10 . ? 92.484 73.517 138.296 1.00 15.02 ? 745 HOH A O 1 +HETATM 20690 O O . HOH S 10 . ? 89.519 76.199 89.432 1.00 36.30 ? 746 HOH A O 1 +HETATM 20691 O O . HOH S 10 . ? 64.565 74.993 109.311 1.00 11.16 ? 747 HOH A O 1 +HETATM 20692 O O . HOH S 10 . ? 62.280 95.113 119.789 1.00 16.55 ? 748 HOH A O 1 +HETATM 20693 O O . HOH S 10 . ? 73.175 57.944 111.380 1.00 16.19 ? 749 HOH A O 1 +HETATM 20694 O O . HOH S 10 . ? 74.285 66.835 105.770 1.00 17.17 ? 750 HOH A O 1 +HETATM 20695 O O . HOH S 10 . ? 69.549 64.446 130.319 1.00 21.58 ? 751 HOH A O 1 +HETATM 20696 O O . HOH S 10 . ? 87.416 58.110 122.974 1.00 22.28 ? 752 HOH A O 1 +HETATM 20697 O O . HOH S 10 . ? 90.231 73.898 139.929 1.00 14.71 ? 753 HOH A O 1 +HETATM 20698 O O . HOH S 10 . ? 75.174 68.286 88.476 1.00 13.63 ? 754 HOH A O 1 +HETATM 20699 O O . HOH S 10 . ? 71.716 66.292 105.015 1.00 11.55 ? 755 HOH A O 1 +HETATM 20700 O O . HOH S 10 . ? 78.701 79.077 109.285 1.00 11.11 ? 756 HOH A O 1 +HETATM 20701 O O . HOH S 10 . ? 50.411 93.208 114.364 1.00 14.95 ? 757 HOH A O 1 +HETATM 20702 O O . HOH S 10 . ? 83.793 76.126 140.477 1.00 13.48 ? 758 HOH A O 1 +HETATM 20703 O O . HOH S 10 . ? 69.505 70.327 111.491 1.00 16.46 ? 759 HOH A O 1 +HETATM 20704 O O . HOH S 10 . ? 69.237 84.904 139.953 1.00 19.31 ? 760 HOH A O 1 +HETATM 20705 O O . HOH S 10 . ? 66.773 76.533 108.474 1.00 10.40 ? 761 HOH A O 1 +HETATM 20706 O O . HOH S 10 . ? 72.608 85.520 132.748 1.00 15.36 ? 762 HOH A O 1 +HETATM 20707 O O . HOH S 10 . ? 52.940 84.345 126.976 1.00 11.70 ? 763 HOH A O 1 +HETATM 20708 O O . HOH S 10 . ? 46.458 81.524 127.873 1.00 16.04 ? 764 HOH A O 1 +HETATM 20709 O O . HOH S 10 . ? 68.326 61.326 136.985 1.00 33.21 ? 765 HOH A O 1 +HETATM 20710 O O . HOH S 10 . ? 65.354 79.435 153.610 1.00 28.30 ? 766 HOH A O 1 +HETATM 20711 O O . HOH S 10 . ? 96.706 68.790 105.948 1.00 14.44 ? 767 HOH A O 1 +HETATM 20712 O O . HOH S 10 . ? 74.370 69.215 116.114 1.00 10.77 ? 768 HOH A O 1 +HETATM 20713 O O . HOH S 10 . ? 78.008 70.167 118.537 1.00 16.18 ? 769 HOH A O 1 +HETATM 20714 O O . HOH S 10 . ? 53.356 90.690 127.637 1.00 14.34 ? 770 HOH A O 1 +HETATM 20715 O O . HOH S 10 . ? 95.871 70.331 102.314 1.00 15.10 ? 771 HOH A O 1 +HETATM 20716 O O . HOH S 10 . ? 75.154 76.293 148.167 1.00 15.58 ? 772 HOH A O 1 +HETATM 20717 O O . HOH S 10 . ? 97.169 95.177 120.503 1.00 22.40 ? 773 HOH A O 1 +HETATM 20718 O O . HOH S 10 . ? 71.450 64.094 108.313 1.00 12.78 ? 774 HOH A O 1 +HETATM 20719 O O . HOH S 10 . ? 54.133 83.244 119.181 1.00 13.71 ? 775 HOH A O 1 +HETATM 20720 O O . HOH S 10 . ? 89.186 65.508 90.888 1.00 14.05 ? 776 HOH A O 1 +HETATM 20721 O O . HOH S 10 . ? 67.390 68.781 111.319 1.00 33.56 ? 777 HOH A O 1 +HETATM 20722 O O . HOH S 10 . ? 68.554 80.431 126.275 1.00 15.76 ? 778 HOH A O 1 +HETATM 20723 O O . HOH S 10 . ? 65.048 77.298 105.775 1.00 18.96 ? 779 HOH A O 1 +HETATM 20724 O O . HOH S 10 . ? 93.275 78.276 96.865 1.00 10.57 ? 780 HOH A O 1 +HETATM 20725 O O . HOH S 10 . ? 62.669 70.306 121.239 1.00 10.28 ? 781 HOH A O 1 +HETATM 20726 O O . HOH S 10 . ? 48.565 66.633 130.692 1.00 29.42 ? 782 HOH A O 1 +HETATM 20727 O O . HOH S 10 . ? 62.503 89.805 127.239 1.00 16.88 ? 783 HOH A O 1 +HETATM 20728 O O . HOH S 10 . ? 103.021 69.194 150.268 1.00 26.43 ? 784 HOH A O 1 +HETATM 20729 O O . HOH S 10 . ? 71.906 62.520 147.523 1.00 18.72 ? 785 HOH A O 1 +HETATM 20730 O O . HOH S 10 . ? 99.227 95.457 118.745 1.00 26.03 ? 786 HOH A O 1 +HETATM 20731 O O . HOH S 10 . ? 88.009 84.611 138.982 1.00 15.05 ? 787 HOH A O 1 +HETATM 20732 O O . HOH S 10 . ? 78.178 82.305 109.279 1.00 15.91 ? 788 HOH A O 1 +HETATM 20733 O O . HOH S 10 . ? 51.165 87.802 138.670 1.00 15.83 ? 789 HOH A O 1 +HETATM 20734 O O . HOH S 10 . ? 103.105 87.684 107.686 1.00 22.23 ? 790 HOH A O 1 +HETATM 20735 O O . HOH S 10 . ? 53.619 63.483 133.608 1.00 25.80 ? 791 HOH A O 1 +HETATM 20736 O O . HOH S 10 . ? 73.878 60.355 110.046 1.00 10.68 ? 792 HOH A O 1 +HETATM 20737 O O . HOH S 10 . ? 101.602 72.790 103.442 1.00 15.67 ? 793 HOH A O 1 +HETATM 20738 O O . HOH S 10 . ? 46.778 83.334 147.332 1.00 34.49 ? 794 HOH A O 1 +HETATM 20739 O O . HOH S 10 . ? 98.448 95.550 107.901 1.00 21.42 ? 795 HOH A O 1 +HETATM 20740 O O . HOH S 10 . ? 54.582 76.716 143.128 1.00 14.86 ? 796 HOH A O 1 +HETATM 20741 O O . HOH S 10 . ? 85.455 66.467 93.061 1.00 11.01 ? 797 HOH A O 1 +HETATM 20742 O O . HOH S 10 . ? 83.398 92.337 107.385 1.00 27.74 ? 798 HOH A O 1 +HETATM 20743 O O . HOH S 10 . ? 70.449 63.264 164.346 1.00 45.77 ? 799 HOH A O 1 +HETATM 20744 O O . HOH S 10 . ? 63.576 71.225 114.232 1.00 22.19 ? 800 HOH A O 1 +HETATM 20745 O O . HOH S 10 . ? 82.617 94.516 111.296 1.00 16.59 ? 801 HOH A O 1 +HETATM 20746 O O . HOH S 10 . ? 95.165 78.202 137.118 1.00 17.50 ? 802 HOH A O 1 +HETATM 20747 O O . HOH S 10 . ? 87.398 67.017 97.142 1.00 38.81 ? 803 HOH A O 1 +HETATM 20748 O O . HOH S 10 . ? 49.681 92.165 133.887 1.00 21.70 ? 804 HOH A O 1 +HETATM 20749 O O . HOH S 10 . ? 79.867 82.968 113.397 1.00 13.79 ? 805 HOH A O 1 +HETATM 20750 O O . HOH S 10 . ? 63.492 60.755 147.080 1.00 18.41 ? 806 HOH A O 1 +HETATM 20751 O O . HOH S 10 . ? 91.822 63.015 133.451 1.00 15.35 ? 807 HOH A O 1 +HETATM 20752 O O . HOH S 10 . ? 90.487 91.729 106.731 1.00 15.71 ? 808 HOH A O 1 +HETATM 20753 O O . HOH S 10 . ? 86.155 69.518 136.745 1.00 16.47 ? 809 HOH A O 1 +HETATM 20754 O O . HOH S 10 . ? 51.470 68.879 112.956 1.00 13.99 ? 810 HOH A O 1 +HETATM 20755 O O . HOH S 10 . ? 61.772 82.702 118.658 1.00 12.61 ? 811 HOH A O 1 +HETATM 20756 O O . HOH S 10 . ? 84.973 63.647 150.934 1.00 25.93 ? 812 HOH A O 1 +HETATM 20757 O O . HOH S 10 . ? 63.508 83.596 109.445 1.00 26.30 ? 813 HOH A O 1 +HETATM 20758 O O . HOH S 10 . ? 92.364 94.452 126.813 1.00 15.84 ? 814 HOH A O 1 +HETATM 20759 O O . HOH S 10 . ? 87.405 76.584 90.946 1.00 32.35 ? 815 HOH A O 1 +HETATM 20760 O O . HOH S 10 . ? 43.503 88.576 138.879 1.00 15.77 ? 816 HOH A O 1 +HETATM 20761 O O . HOH S 10 . ? 72.031 74.570 104.944 1.00 10.40 ? 817 HOH A O 1 +HETATM 20762 O O . HOH S 10 . ? 68.730 62.783 148.741 1.00 42.09 ? 818 HOH A O 1 +HETATM 20763 O O . HOH S 10 . ? 70.426 61.915 129.419 1.00 14.20 ? 819 HOH A O 1 +HETATM 20764 O O . HOH S 10 . ? 76.689 70.955 146.451 1.00 17.19 ? 820 HOH A O 1 +HETATM 20765 O O . HOH S 10 . ? 51.454 94.412 133.077 1.00 19.48 ? 821 HOH A O 1 +HETATM 20766 O O . HOH S 10 . ? 97.577 80.564 133.659 1.00 19.57 ? 822 HOH A O 1 +HETATM 20767 O O . HOH S 10 . ? 85.748 88.567 98.243 1.00 20.59 ? 823 HOH A O 1 +HETATM 20768 O O . HOH S 10 . ? 77.086 69.314 124.330 1.00 44.07 ? 824 HOH A O 1 +HETATM 20769 O O . HOH S 10 . ? 83.371 71.868 139.029 1.00 17.61 ? 825 HOH A O 1 +HETATM 20770 O O . HOH S 10 . ? 83.798 84.975 105.038 1.00 18.27 ? 826 HOH A O 1 +HETATM 20771 O O . HOH S 10 . ? 46.887 77.263 137.917 1.00 16.38 ? 827 HOH A O 1 +HETATM 20772 O O . HOH S 10 . ? 101.641 70.799 151.997 1.00 27.16 ? 828 HOH A O 1 +HETATM 20773 O O . HOH S 10 . ? 75.091 62.656 151.468 1.00 16.29 ? 829 HOH A O 1 +HETATM 20774 O O . HOH S 10 . ? 54.427 61.295 135.106 1.00 35.46 ? 830 HOH A O 1 +HETATM 20775 O O . HOH S 10 . ? 104.591 67.377 135.113 1.00 27.51 ? 831 HOH A O 1 +HETATM 20776 O O . HOH S 10 . ? 42.665 87.881 131.558 1.00 25.40 ? 832 HOH A O 1 +HETATM 20777 O O . HOH S 10 . ? 80.809 92.303 111.612 1.00 20.89 ? 840 HOH A O 1 +HETATM 20778 O O . HOH S 10 . ? 83.984 62.314 98.483 1.00 16.89 ? 842 HOH A O 1 +HETATM 20779 O O . HOH S 10 . ? 99.579 85.870 128.484 1.00 34.24 ? 847 HOH A O 1 +HETATM 20780 O O . HOH S 10 . ? 54.765 86.693 141.709 1.00 25.03 ? 850 HOH A O 1 +HETATM 20781 O O . HOH S 10 . ? 52.466 86.472 115.965 1.00 37.54 ? 852 HOH A O 1 +HETATM 20782 O O . HOH S 10 . ? 74.577 94.135 123.609 1.00 25.90 ? 856 HOH A O 1 +HETATM 20783 O O . HOH S 10 . ? 71.891 87.088 135.074 1.00 44.36 ? 876 HOH A O 1 +HETATM 20784 O O . HOH S 10 . ? 87.751 71.612 159.318 1.00 25.27 ? 879 HOH A O 1 +HETATM 20785 O O . HOH S 10 . ? 88.471 66.445 87.842 1.00 14.23 ? 881 HOH A O 1 +HETATM 20786 O O . HOH S 10 . ? 89.979 57.717 119.522 1.00 31.10 ? 883 HOH A O 1 +HETATM 20787 O O . HOH S 10 . ? 58.947 61.966 135.631 1.00 12.10 ? 893 HOH A O 1 +HETATM 20788 O O . HOH S 10 . ? 72.760 68.250 89.808 1.00 26.68 ? 895 HOH A O 1 +HETATM 20789 O O . HOH S 10 . ? 69.777 87.723 136.477 1.00 20.79 ? 909 HOH A O 1 +HETATM 20790 O O . HOH S 10 . ? 73.550 72.840 159.632 1.00 18.66 ? 911 HOH A O 1 +HETATM 20791 O O . HOH S 10 . ? 96.725 84.381 137.870 1.00 16.59 ? 913 HOH A O 1 +HETATM 20792 O O . HOH S 10 . ? 89.778 88.747 117.606 1.00 10.36 ? 914 HOH A O 1 +HETATM 20793 O O . HOH S 10 . ? 98.582 89.057 123.397 1.00 24.42 ? 915 HOH A O 1 +HETATM 20794 O O . HOH S 10 . ? 53.270 80.993 117.907 1.00 19.21 ? 916 HOH A O 1 +HETATM 20795 O O . HOH S 10 . ? 74.466 82.319 103.358 1.00 18.92 ? 917 HOH A O 1 +HETATM 20796 O O . HOH S 10 . ? 87.827 91.086 140.945 1.00 33.68 ? 919 HOH A O 1 +HETATM 20797 O O . HOH S 10 . ? 89.589 81.785 88.039 1.00 24.30 ? 924 HOH A O 1 +HETATM 20798 O O . HOH S 10 . ? 71.137 82.634 141.553 1.00 22.64 ? 925 HOH A O 1 +HETATM 20799 O O . HOH S 10 . ? 90.779 56.245 117.480 1.00 44.76 ? 931 HOH A O 1 +HETATM 20800 O O . HOH S 10 . ? 97.841 80.901 102.046 1.00 18.70 ? 934 HOH A O 1 +HETATM 20801 O O . HOH S 10 . ? 74.435 64.312 89.863 1.00 16.30 ? 937 HOH A O 1 +HETATM 20802 O O . HOH S 10 . ? 75.025 61.041 95.182 1.00 19.34 ? 939 HOH A O 1 +HETATM 20803 O O . HOH S 10 . ? 77.136 103.399 116.091 1.00 26.71 ? 940 HOH A O 1 +HETATM 20804 O O . HOH S 10 . ? 85.468 84.426 156.759 1.00 39.89 ? 943 HOH A O 1 +HETATM 20805 O O . HOH S 10 . ? 61.977 78.951 111.507 1.00 17.76 ? 947 HOH A O 1 +HETATM 20806 O O . HOH S 10 . ? 107.260 67.625 137.916 1.00 26.97 ? 950 HOH A O 1 +HETATM 20807 O O . HOH S 10 . ? 85.086 66.323 142.936 1.00 27.60 ? 956 HOH A O 1 +HETATM 20808 O O . HOH S 10 . ? 64.640 61.809 142.606 1.00 26.93 ? 960 HOH A O 1 +HETATM 20809 O O . HOH S 10 . ? 85.722 84.105 147.206 1.00 34.19 ? 968 HOH A O 1 +HETATM 20810 O O . HOH S 10 . ? 48.892 73.137 126.916 1.00 33.06 ? 974 HOH A O 1 +HETATM 20811 O O . HOH S 10 . ? 96.025 88.737 140.104 1.00 17.61 ? 979 HOH A O 1 +HETATM 20812 O O . HOH S 10 . ? 102.687 69.211 121.295 1.00 21.52 ? 980 HOH A O 1 +HETATM 20813 O O . HOH S 10 . ? 50.927 76.918 138.387 1.00 10.14 ? 985 HOH A O 1 +HETATM 20814 O O . HOH S 10 . ? 63.992 60.950 136.961 1.00 33.31 ? 990 HOH A O 1 +HETATM 20815 O O . HOH S 10 . ? 69.616 65.433 107.067 1.00 24.33 ? 992 HOH A O 1 +HETATM 20816 O O . HOH S 10 . ? 47.924 89.234 138.974 1.00 21.84 ? 993 HOH A O 1 +HETATM 20817 O O . HOH S 10 . ? 94.171 75.471 136.650 1.00 14.96 ? 1007 HOH A O 1 +HETATM 20818 O O . HOH S 10 . ? 100.976 67.338 119.905 1.00 23.36 ? 1011 HOH A O 1 +HETATM 20819 O O . HOH S 10 . ? 82.912 64.126 133.643 1.00 14.45 ? 1017 HOH A O 1 +HETATM 20820 O O . HOH S 10 . ? 78.242 92.581 111.868 1.00 28.80 ? 1025 HOH A O 1 +HETATM 20821 O O . HOH S 10 . ? 72.812 59.906 94.743 1.00 24.31 ? 1027 HOH A O 1 +HETATM 20822 O O . HOH S 10 . ? 43.281 90.794 110.067 1.00 22.78 ? 1030 HOH A O 1 +HETATM 20823 O O . HOH S 10 . ? 92.459 91.067 104.731 1.00 23.56 ? 1032 HOH A O 1 +HETATM 20824 O O . HOH S 10 . ? 76.879 66.065 136.335 1.00 49.09 ? 1036 HOH A O 1 +HETATM 20825 O O . HOH S 10 . ? 103.471 64.340 111.626 1.00 20.90 ? 1044 HOH A O 1 +HETATM 20826 O O . HOH S 10 . ? 91.003 59.585 108.786 1.00 15.15 ? 1048 HOH A O 1 +HETATM 20827 O O . HOH S 10 . ? 67.927 66.203 111.559 1.00 13.63 ? 1055 HOH A O 1 +HETATM 20828 O O . HOH S 10 . ? 76.566 73.675 145.155 1.00 15.67 ? 1059 HOH A O 1 +HETATM 20829 O O . HOH S 10 . ? 77.897 75.663 147.828 1.00 15.21 ? 1064 HOH A O 1 +HETATM 20830 O O . HOH S 10 . ? 53.543 87.002 143.931 1.00 32.56 ? 1066 HOH A O 1 +HETATM 20831 O O . HOH S 10 . ? 100.991 89.464 122.285 1.00 18.27 ? 1067 HOH A O 1 +HETATM 20832 O O . HOH S 10 . ? 81.569 104.565 114.169 1.00 22.25 ? 1068 HOH A O 1 +HETATM 20833 O O . HOH S 10 . ? 74.987 69.124 146.781 1.00 25.92 ? 1074 HOH A O 1 +HETATM 20834 O O . HOH S 10 . ? 89.309 91.337 116.558 1.00 17.51 ? 1090 HOH A O 1 +HETATM 20835 O O . HOH S 10 . ? 43.392 70.590 133.375 1.00 31.10 ? 1091 HOH A O 1 +HETATM 20836 O O . HOH S 10 . ? 72.897 82.769 143.957 1.00 33.63 ? 1092 HOH A O 1 +HETATM 20837 O O . HOH S 10 . ? 67.953 64.294 105.164 1.00 23.77 ? 1095 HOH A O 1 +HETATM 20838 O O . HOH S 10 . ? 91.379 99.398 115.012 1.00 33.93 ? 1096 HOH A O 1 +HETATM 20839 O O . HOH S 10 . ? 78.172 90.357 110.311 1.00 16.37 ? 1097 HOH A O 1 +HETATM 20840 O O . HOH S 10 . ? 80.468 74.717 137.470 1.00 31.49 ? 1098 HOH A O 1 +HETATM 20841 O O . HOH S 10 . ? 88.304 57.803 129.412 1.00 23.82 ? 1100 HOH A O 1 +HETATM 20842 O O . HOH S 10 . ? 103.892 81.457 141.108 1.00 22.30 ? 1101 HOH A O 1 +HETATM 20843 O O . HOH S 10 . ? 104.488 74.363 151.580 1.00 25.91 ? 1108 HOH A O 1 +HETATM 20844 O O . HOH S 10 . ? 90.427 62.102 136.016 1.00 25.25 ? 1109 HOH A O 1 +HETATM 20845 O O . HOH S 10 . ? 80.517 63.030 144.685 1.00 34.90 ? 1113 HOH A O 1 +HETATM 20846 O O . HOH S 10 . ? 96.118 60.030 124.676 1.00 31.71 ? 1119 HOH A O 1 +HETATM 20847 O O . HOH S 10 . ? 101.877 64.488 142.926 1.00 23.90 ? 1121 HOH A O 1 +HETATM 20848 O O . HOH S 10 . ? 102.206 78.614 129.859 1.00 17.78 ? 1126 HOH A O 1 +HETATM 20849 O O . HOH S 10 . ? 98.941 89.336 126.117 1.00 32.57 ? 1130 HOH A O 1 +HETATM 20850 O O . HOH S 10 . ? 103.364 63.980 140.477 1.00 28.65 ? 1141 HOH A O 1 +HETATM 20851 O O . HOH S 10 . ? 44.655 78.678 138.879 1.00 19.62 ? 1148 HOH A O 1 +HETATM 20852 O O . HOH S 10 . ? 47.279 79.524 125.975 1.00 18.44 ? 1150 HOH A O 1 +HETATM 20853 O O . HOH S 10 . ? 59.017 85.026 115.146 1.00 17.37 ? 1159 HOH A O 1 +HETATM 20854 O O . HOH S 10 . ? 57.014 63.604 137.063 1.00 54.61 ? 1162 HOH A O 1 +HETATM 20855 O O . HOH S 10 . ? 86.522 93.918 139.003 1.00 32.19 ? 1163 HOH A O 1 +HETATM 20856 O O . HOH S 10 . ? 64.142 61.632 156.363 1.00 24.06 ? 1172 HOH A O 1 +HETATM 20857 O O . HOH S 10 . ? 72.971 85.712 138.821 1.00 21.06 ? 1174 HOH A O 1 +HETATM 20858 O O . HOH S 10 . ? 56.445 85.227 115.094 1.00 35.01 ? 1180 HOH A O 1 +HETATM 20859 O O . HOH S 10 . ? 104.401 80.289 130.229 1.00 24.83 ? 1182 HOH A O 1 +HETATM 20860 O O . HOH S 10 . ? 83.764 70.835 141.357 1.00 23.47 ? 1184 HOH A O 1 +HETATM 20861 O O . HOH S 10 . ? 68.867 66.298 155.978 1.00 34.37 ? 1186 HOH A O 1 +HETATM 20862 O O . HOH S 10 . ? 75.810 78.463 145.008 1.00 22.88 ? 1189 HOH A O 1 +HETATM 20863 O O . HOH S 10 . ? 80.798 68.826 141.808 1.00 28.08 ? 1199 HOH A O 1 +HETATM 20864 O O . HOH S 10 . ? 70.578 60.737 106.512 1.00 25.10 ? 1200 HOH A O 1 +HETATM 20865 O O . HOH S 10 . ? 97.274 100.826 112.713 1.00 36.25 ? 1201 HOH A O 1 +HETATM 20866 O O . HOH S 10 . ? 97.213 94.237 127.313 1.00 37.72 ? 1202 HOH A O 1 +HETATM 20867 O O . HOH S 10 . ? 45.296 80.799 140.540 1.00 22.32 ? 1204 HOH A O 1 +HETATM 20868 O O . HOH S 10 . ? 80.178 65.207 132.901 1.00 25.89 ? 1209 HOH A O 1 +HETATM 20869 O O . HOH S 10 . ? 44.586 82.614 126.437 1.00 30.18 ? 1214 HOH A O 1 +HETATM 20870 O O . HOH S 10 . ? 68.135 64.599 109.535 1.00 43.02 ? 1219 HOH A O 1 +HETATM 20871 O O . HOH S 10 . ? 91.393 76.366 139.031 1.00 28.52 ? 1220 HOH A O 1 +HETATM 20872 O O . HOH S 10 . ? 82.315 88.341 140.417 1.00 27.72 ? 1228 HOH A O 1 +HETATM 20873 O O . HOH S 10 . ? 48.234 87.360 114.664 1.00 38.96 ? 1231 HOH A O 1 +HETATM 20874 O O . HOH S 10 . ? 59.234 90.227 108.507 1.00 34.09 ? 1241 HOH A O 1 +HETATM 20875 O O . HOH S 10 . ? 83.618 86.103 107.636 1.00 18.71 ? 1250 HOH A O 1 +HETATM 20876 O O . HOH S 10 . ? 83.690 66.195 140.652 1.00 37.15 ? 1256 HOH A O 1 +HETATM 20877 O O . HOH S 10 . ? 53.328 100.006 108.990 1.00 32.59 ? 1260 HOH A O 1 +HETATM 20878 O O . HOH S 10 . ? 104.452 85.749 104.066 1.00 38.18 ? 1262 HOH A O 1 +HETATM 20879 O O . HOH S 10 . ? 61.307 61.059 136.684 1.00 38.99 ? 1264 HOH A O 1 +HETATM 20880 O O . HOH S 10 . ? 72.958 82.878 105.545 1.00 28.00 ? 1266 HOH A O 1 +HETATM 20881 O O . HOH S 10 . ? 63.265 95.035 111.029 1.00 45.85 ? 1270 HOH A O 1 +HETATM 20882 O O . HOH S 10 . ? 52.698 68.290 137.749 1.00 22.09 ? 1275 HOH A O 1 +HETATM 20883 O O . HOH S 10 . ? 97.637 76.732 155.194 1.00 17.42 ? 1276 HOH A O 1 +HETATM 20884 O O . HOH S 10 . ? 74.451 75.904 133.474 1.00 11.53 ? 1281 HOH A O 1 +HETATM 20885 O O . HOH S 10 . ? 85.880 57.510 128.198 1.00 16.48 ? 1288 HOH A O 1 +HETATM 20886 O O . HOH S 10 . ? 104.230 78.278 109.049 1.00 18.01 ? 1290 HOH A O 1 +HETATM 20887 O O . HOH S 10 . ? 65.748 68.433 135.781 1.00 16.33 ? 1293 HOH A O 1 +HETATM 20888 O O . HOH S 10 . ? 67.567 66.448 126.354 1.00 14.55 ? 1295 HOH A O 1 +HETATM 20889 O O . HOH S 10 . ? 97.233 79.739 136.296 1.00 17.38 ? 1296 HOH A O 1 +HETATM 20890 O O . HOH S 10 . ? 48.623 93.182 110.307 1.00 18.85 ? 1305 HOH A O 1 +HETATM 20891 O O . HOH S 10 . ? 100.980 74.148 114.084 1.00 28.14 ? 1307 HOH A O 1 +HETATM 20892 O O . HOH S 10 . ? 59.214 70.635 115.172 1.00 19.83 ? 1311 HOH A O 1 +HETATM 20893 O O . HOH S 10 . ? 99.371 78.932 100.998 1.00 18.40 ? 1313 HOH A O 1 +HETATM 20894 O O . HOH S 10 . ? 84.624 76.359 137.745 1.00 9.27 ? 1314 HOH A O 1 +HETATM 20895 O O . HOH S 10 . ? 98.741 68.775 119.677 1.00 18.88 ? 1345 HOH A O 1 +HETATM 20896 O O . HOH S 10 . ? 105.182 88.906 124.745 1.00 25.98 ? 1348 HOH A O 1 +HETATM 20897 O O . HOH S 10 . ? 85.336 73.632 138.080 1.00 15.99 ? 1351 HOH A O 1 +HETATM 20898 O O . HOH S 10 . ? 72.746 83.015 139.234 1.00 16.84 ? 1354 HOH A O 1 +HETATM 20899 O O . HOH S 10 . ? 107.103 83.600 121.943 1.00 29.11 ? 1358 HOH A O 1 +HETATM 20900 O O . HOH S 10 . ? 63.863 83.262 117.149 1.00 23.54 ? 1364 HOH A O 1 +HETATM 20901 O O . HOH S 10 . ? 101.228 74.969 102.312 1.00 16.51 ? 1372 HOH A O 1 +HETATM 20902 O O . HOH S 10 . ? 68.688 67.207 137.927 1.00 37.10 ? 1374 HOH A O 1 +HETATM 20903 O O . HOH S 10 . ? 84.414 83.334 154.268 1.00 25.88 ? 1375 HOH A O 1 +HETATM 20904 O O . HOH S 10 . ? 90.853 77.535 159.627 1.00 24.27 ? 1376 HOH A O 1 +HETATM 20905 O O . HOH S 10 . ? 91.773 57.803 115.811 1.00 21.83 ? 1377 HOH A O 1 +HETATM 20906 O O . HOH S 10 . ? 69.345 84.612 112.048 1.00 26.15 ? 1386 HOH A O 1 +HETATM 20907 O O . HOH S 10 . ? 101.045 58.460 115.165 1.00 42.58 ? 1389 HOH A O 1 +HETATM 20908 O O . HOH S 10 . ? 51.194 70.259 138.972 1.00 18.03 ? 1396 HOH A O 1 +HETATM 20909 O O . HOH S 10 . ? 69.035 83.492 103.621 1.00 26.19 ? 1400 HOH A O 1 +HETATM 20910 O O . HOH S 10 . ? 90.513 83.196 138.687 1.00 15.34 ? 1405 HOH A O 1 +HETATM 20911 O O . HOH S 10 . ? 67.235 66.043 106.845 1.00 36.22 ? 1416 HOH A O 1 +HETATM 20912 O O . HOH S 10 . ? 66.483 89.489 137.731 1.00 37.42 ? 1420 HOH A O 1 +HETATM 20913 O O . HOH S 10 . ? 96.301 73.024 95.829 1.00 21.96 ? 1427 HOH A O 1 +HETATM 20914 O O . HOH S 10 . ? 77.026 85.526 100.770 1.00 21.96 ? 1432 HOH A O 1 +HETATM 20915 O O . HOH S 10 . ? 46.475 68.939 126.803 1.00 23.60 ? 1434 HOH A O 1 +HETATM 20916 O O . HOH S 10 . ? 51.023 87.173 143.277 1.00 36.44 ? 1438 HOH A O 1 +HETATM 20917 O O . HOH S 10 . ? 102.473 90.344 108.322 1.00 24.81 ? 1439 HOH A O 1 +HETATM 20918 O O . HOH S 10 . ? 82.081 73.779 140.630 1.00 23.57 ? 1442 HOH A O 1 +HETATM 20919 O O . HOH S 10 . ? 91.826 71.049 97.061 1.00 27.99 ? 1445 HOH A O 1 +HETATM 20920 O O . HOH S 10 . ? 50.377 74.856 125.813 1.00 23.01 ? 1446 HOH A O 1 +HETATM 20921 O O . HOH S 10 . ? 43.868 86.676 124.313 1.00 23.91 ? 1451 HOH A O 1 +HETATM 20922 O O . HOH S 10 . ? 53.458 93.767 131.488 1.00 20.96 ? 1453 HOH A O 1 +HETATM 20923 O O . HOH S 10 . ? 104.122 82.967 104.974 1.00 40.95 ? 1458 HOH A O 1 +HETATM 20924 O O . HOH S 10 . ? 61.593 61.895 148.850 1.00 21.81 ? 1460 HOH A O 1 +HETATM 20925 O O . HOH S 10 . ? 72.270 71.723 127.833 1.00 25.56 ? 1463 HOH A O 1 +HETATM 20926 O O . HOH S 10 . ? 65.405 64.749 129.277 1.00 17.81 ? 1466 HOH A O 1 +HETATM 20927 O O . HOH S 10 . ? 100.693 76.016 99.197 1.00 23.91 ? 1470 HOH A O 1 +HETATM 20928 O O . HOH S 10 . ? 86.585 81.931 146.164 1.00 48.84 ? 1477 HOH A O 1 +HETATM 20929 O O . HOH S 10 . ? 40.099 92.012 112.412 1.00 37.51 ? 1481 HOH A O 1 +HETATM 20930 O O . HOH S 10 . ? 76.675 64.367 137.992 1.00 44.35 ? 1483 HOH A O 1 +HETATM 20931 O O . HOH S 10 . ? 91.540 82.039 157.446 1.00 32.05 ? 1486 HOH A O 1 +HETATM 20932 O O . HOH S 10 . ? 48.576 77.013 108.200 1.00 36.37 ? 1490 HOH A O 1 +HETATM 20933 O O . HOH S 10 . ? 105.349 69.865 150.898 1.00 42.43 ? 1500 HOH A O 1 +HETATM 20934 O O . HOH S 10 . ? 103.130 79.738 117.543 1.00 24.29 ? 1501 HOH A O 1 +HETATM 20935 O O . HOH S 10 . ? 100.829 70.074 106.920 1.00 21.94 ? 1502 HOH A O 1 +HETATM 20936 O O . HOH S 10 . ? 68.350 61.928 106.245 1.00 24.95 ? 1514 HOH A O 1 +HETATM 20937 O O . HOH S 10 . ? 74.101 85.399 141.771 1.00 27.26 ? 1519 HOH A O 1 +HETATM 20938 O O . HOH S 10 . ? 44.215 90.646 107.599 1.00 25.88 ? 1520 HOH A O 1 +HETATM 20939 O O . HOH S 10 . ? 45.887 69.178 132.502 1.00 39.23 ? 1533 HOH A O 1 +HETATM 20940 O O . HOH S 10 . ? 104.323 81.364 102.689 1.00 22.55 ? 1534 HOH A O 1 +HETATM 20941 O O . HOH S 10 . ? 108.575 78.806 110.660 1.00 36.01 ? 1535 HOH A O 1 +HETATM 20942 O O . HOH S 10 . ? 61.220 85.031 112.984 1.00 20.53 ? 1543 HOH A O 1 +HETATM 20943 O O . HOH S 10 . ? 104.375 78.788 136.166 1.00 31.96 ? 1553 HOH A O 1 +HETATM 20944 O O . HOH S 10 . ? 43.236 84.571 125.905 1.00 31.82 ? 1554 HOH A O 1 +HETATM 20945 O O . HOH S 10 . ? 84.542 95.501 109.201 1.00 16.54 ? 1555 HOH A O 1 +HETATM 20946 O O . HOH S 10 . ? 96.811 65.846 106.468 1.00 29.89 ? 1557 HOH A O 1 +HETATM 20947 O O . HOH S 10 . ? 74.349 55.330 114.607 1.00 35.22 ? 1560 HOH A O 1 +HETATM 20948 O O . HOH S 10 . ? 83.828 66.357 149.399 1.00 20.49 ? 1562 HOH A O 1 +HETATM 20949 O O . HOH S 10 . ? 65.509 94.525 113.444 1.00 22.78 ? 1565 HOH A O 1 +HETATM 20950 O O . HOH S 10 . ? 55.526 83.290 116.916 1.00 28.46 ? 1568 HOH A O 1 +HETATM 20951 O O . HOH S 10 . ? 43.623 80.492 131.743 1.00 33.22 ? 1582 HOH A O 1 +HETATM 20952 O O . HOH S 10 . ? 53.582 64.556 135.909 1.00 42.63 ? 1583 HOH A O 1 +HETATM 20953 O O . HOH S 10 . ? 51.167 72.539 123.853 1.00 33.52 ? 1597 HOH A O 1 +HETATM 20954 O O . HOH S 10 . ? 79.194 65.984 135.005 1.00 33.74 ? 1599 HOH A O 1 +HETATM 20955 O O . HOH S 10 . ? 78.206 100.127 109.227 1.00 49.80 ? 1606 HOH A O 1 +HETATM 20956 O O . HOH S 10 . ? 88.651 58.605 131.698 1.00 36.04 ? 1611 HOH A O 1 +HETATM 20957 O O . HOH S 10 . ? 48.024 93.702 113.193 1.00 26.79 ? 1614 HOH A O 1 +HETATM 20958 O O . HOH S 10 . ? 91.441 63.348 140.567 1.00 29.06 ? 1619 HOH A O 1 +HETATM 20959 O O . HOH S 10 . ? 89.452 101.015 119.006 1.00 25.91 ? 1620 HOH A O 1 +HETATM 20960 O O . HOH S 10 . ? 97.344 84.167 130.479 1.00 22.11 ? 1627 HOH A O 1 +HETATM 20961 O O . HOH S 10 . ? 73.185 69.185 136.570 1.00 24.53 ? 1640 HOH A O 1 +HETATM 20962 O O . HOH S 10 . ? 101.404 61.690 143.456 1.00 24.35 ? 1649 HOH A O 1 +HETATM 20963 O O . HOH S 10 . ? 73.236 85.627 110.976 1.00 35.88 ? 1650 HOH A O 1 +HETATM 20964 O O . HOH S 10 . ? 68.475 83.081 145.311 1.00 18.75 ? 1654 HOH A O 1 +HETATM 20965 O O . HOH S 10 . ? 65.575 62.756 138.214 1.00 25.54 ? 1658 HOH A O 1 +HETATM 20966 O O . HOH S 10 . ? 98.007 95.859 105.051 1.00 30.31 ? 1660 HOH A O 1 +HETATM 20967 O O . HOH S 10 . ? 79.583 104.007 116.854 1.00 19.51 ? 1663 HOH A O 1 +HETATM 20968 O O . HOH S 10 . ? 98.531 81.020 140.494 1.00 19.46 ? 1665 HOH A O 1 +HETATM 20969 O O . HOH S 10 . ? 95.218 77.878 94.819 1.00 30.45 ? 1667 HOH A O 1 +HETATM 20970 O O . HOH S 10 . ? 73.434 69.700 123.845 1.00 26.17 ? 1670 HOH A O 1 +HETATM 20971 O O . HOH S 10 . ? 75.962 101.388 111.304 1.00 31.99 ? 1677 HOH A O 1 +HETATM 20972 O O . HOH S 10 . ? 63.213 86.805 144.150 1.00 32.30 ? 1678 HOH A O 1 +HETATM 20973 O O . HOH S 10 . ? 82.245 84.518 146.557 1.00 28.55 ? 1685 HOH A O 1 +HETATM 20974 O O . HOH S 10 . ? 105.329 72.335 122.138 1.00 31.05 ? 1686 HOH A O 1 +HETATM 20975 O O . HOH S 10 . ? 58.014 62.749 140.419 1.00 37.13 ? 1687 HOH A O 1 +HETATM 20976 O O . HOH S 10 . ? 87.026 88.256 100.476 1.00 36.53 ? 1689 HOH A O 1 +HETATM 20977 O O . HOH S 10 . ? 82.595 72.867 88.680 1.00 26.71 ? 1693 HOH A O 1 +HETATM 20978 O O . HOH S 10 . ? 93.991 62.335 136.835 1.00 22.61 ? 1694 HOH A O 1 +HETATM 20979 O O . HOH S 10 . ? 105.760 60.336 118.103 1.00 45.09 ? 1695 HOH A O 1 +HETATM 20980 O O . HOH S 10 . ? 65.838 86.115 142.508 1.00 19.31 ? 1701 HOH A O 1 +HETATM 20981 O O . HOH S 10 . ? 74.217 78.399 160.279 1.00 21.41 ? 1703 HOH A O 1 +HETATM 20982 O O . HOH S 10 . ? 72.336 83.353 108.046 1.00 50.21 ? 1713 HOH A O 1 +HETATM 20983 O O . HOH S 10 . ? 71.910 66.848 137.285 1.00 29.30 ? 1718 HOH A O 1 +HETATM 20984 O O . HOH S 10 . ? 97.323 61.220 110.007 1.00 27.41 ? 1719 HOH A O 1 +HETATM 20985 O O . HOH S 10 . ? 49.929 88.684 118.565 1.00 23.67 ? 1727 HOH A O 1 +HETATM 20986 O O . HOH S 10 . ? 61.377 89.586 109.812 1.00 35.64 ? 1731 HOH A O 1 +HETATM 20987 O O . HOH S 10 . ? 55.699 65.886 136.736 1.00 32.61 ? 1734 HOH A O 1 +HETATM 20988 O O . HOH S 10 . ? 65.438 70.805 164.279 1.00 34.46 ? 1736 HOH A O 1 +HETATM 20989 O O . HOH S 10 . ? 92.670 101.422 110.149 1.00 33.47 ? 1741 HOH A O 1 +HETATM 20990 O O . HOH S 10 . ? 91.663 84.539 140.607 1.00 30.34 ? 1742 HOH A O 1 +HETATM 20991 O O . HOH S 10 . ? 73.562 73.982 137.477 1.00 22.19 ? 1744 HOH A O 1 +HETATM 20992 O O . HOH S 10 . ? 86.255 102.444 119.487 1.00 28.30 ? 1748 HOH A O 1 +HETATM 20993 O O . HOH S 10 . ? 94.383 60.791 130.698 1.00 25.01 ? 1753 HOH A O 1 +HETATM 20994 O O . HOH S 10 . ? 70.939 58.550 105.462 1.00 25.77 ? 1771 HOH A O 1 +HETATM 20995 O O . HOH S 10 . ? 77.567 88.000 111.359 1.00 37.81 ? 1778 HOH A O 1 +HETATM 20996 O O . HOH S 10 . ? 68.150 94.892 110.236 1.00 28.83 ? 1780 HOH A O 1 +HETATM 20997 O O . HOH S 10 . ? 56.806 97.177 111.959 1.00 29.16 ? 1781 HOH A O 1 +HETATM 20998 O O . HOH S 10 . ? 90.676 84.899 152.885 1.00 39.03 ? 1785 HOH A O 1 +HETATM 20999 O O . HOH S 10 . ? 105.749 80.159 139.930 1.00 44.34 ? 1787 HOH A O 1 +HETATM 21000 O O . HOH S 10 . ? 91.750 60.656 137.893 1.00 50.53 ? 1790 HOH A O 1 +HETATM 21001 O O . HOH S 10 . ? 98.649 74.559 96.460 1.00 29.81 ? 1795 HOH A O 1 +HETATM 21002 O O . HOH S 10 . ? 106.634 72.750 151.381 1.00 51.44 ? 1796 HOH A O 1 +HETATM 21003 O O . HOH S 10 . ? 96.912 79.363 154.950 1.00 25.26 ? 1797 HOH A O 1 +HETATM 21004 O O . HOH S 10 . ? 50.634 68.386 121.916 1.00 31.48 ? 1798 HOH A O 1 +HETATM 21005 O O . HOH S 10 . ? 83.348 90.075 97.307 1.00 28.82 ? 1801 HOH A O 1 +HETATM 21006 O O . HOH S 10 . ? 39.939 81.524 133.086 1.00 41.60 ? 1804 HOH A O 1 +HETATM 21007 O O . HOH S 10 . ? 70.452 67.922 110.270 1.00 27.53 ? 1815 HOH A O 1 +HETATM 21008 O O . HOH S 10 . ? 71.952 76.770 162.221 1.00 44.74 ? 1817 HOH A O 1 +HETATM 21009 O O . HOH S 10 . ? 88.651 99.958 129.333 1.00 38.44 ? 1818 HOH A O 1 +HETATM 21010 O O . HOH S 10 . ? 94.146 84.962 141.505 1.00 35.07 ? 1820 HOH A O 1 +HETATM 21011 O O . HOH S 10 . ? 99.706 92.842 125.921 1.00 22.01 ? 1822 HOH A O 1 +HETATM 21012 O O . HOH S 10 . ? 55.766 76.634 151.546 1.00 30.07 ? 1827 HOH A O 1 +HETATM 21013 O O . HOH S 10 . ? 89.355 79.551 163.039 1.00 46.54 ? 1832 HOH A O 1 +HETATM 21014 O O . HOH S 10 . ? 104.357 62.154 126.709 1.00 26.92 ? 1836 HOH A O 1 +HETATM 21015 O O . HOH S 10 . ? 109.434 69.298 143.336 1.00 28.50 ? 1839 HOH A O 1 +HETATM 21016 O O . HOH S 10 . ? 91.681 76.281 136.387 1.00 19.19 ? 1841 HOH A O 1 +HETATM 21017 O O . HOH S 10 . ? 55.899 90.471 121.510 1.00 16.15 ? 1844 HOH A O 1 +HETATM 21018 O O . HOH S 10 . ? 72.002 71.836 136.276 1.00 18.84 ? 1845 HOH A O 1 +HETATM 21019 O O . HOH S 10 . ? 99.729 60.930 114.233 1.00 37.71 ? 1850 HOH A O 1 +HETATM 21020 O O . HOH S 10 . ? 102.812 89.895 124.501 1.00 41.76 ? 1853 HOH A O 1 +HETATM 21021 O O . HOH S 10 . ? 68.469 92.498 129.334 1.00 34.30 ? 1857 HOH A O 1 +HETATM 21022 O O . HOH S 10 . ? 57.298 66.689 150.791 1.00 24.33 ? 1866 HOH A O 1 +HETATM 21023 O O . HOH S 10 . ? 100.203 63.113 133.569 1.00 24.90 ? 1867 HOH A O 1 +HETATM 21024 O O . HOH S 10 . ? 49.561 95.141 116.144 1.00 24.66 ? 1869 HOH A O 1 +HETATM 21025 O O . HOH S 10 . ? 89.160 64.815 140.311 1.00 27.69 ? 1872 HOH A O 1 +HETATM 21026 O O . HOH S 10 . ? 87.587 65.126 142.520 1.00 36.71 ? 1875 HOH A O 1 +HETATM 21027 O O . HOH S 10 . ? 75.148 64.058 140.809 1.00 50.62 ? 1876 HOH A O 1 +HETATM 21028 O O . HOH S 10 . ? 101.984 78.498 120.274 1.00 18.77 ? 1882 HOH A O 1 +HETATM 21029 O O . HOH S 10 . ? 49.940 95.926 131.272 1.00 21.26 ? 1884 HOH A O 1 +HETATM 21030 O O . HOH S 10 . ? 85.370 97.454 132.463 1.00 21.83 ? 1885 HOH A O 1 +HETATM 21031 O O . HOH S 10 . ? 90.627 96.938 103.971 1.00 35.04 ? 1889 HOH A O 1 +HETATM 21032 O O . HOH S 10 . ? 99.404 71.559 120.203 1.00 18.48 ? 1890 HOH A O 1 +HETATM 21033 O O . HOH S 10 . ? 78.548 75.004 167.867 1.00 47.61 ? 1893 HOH A O 1 +HETATM 21034 O O . HOH S 10 . ? 69.755 60.949 147.561 1.00 51.70 ? 1898 HOH A O 1 +HETATM 21035 O O . HOH S 10 . ? 97.234 86.355 132.475 1.00 20.60 ? 1899 HOH A O 1 +HETATM 21036 O O . HOH S 10 . ? 92.133 61.739 129.526 1.00 18.01 ? 1901 HOH A O 1 +HETATM 21037 O O . HOH S 10 . ? 58.374 66.304 163.582 1.00 34.79 ? 1903 HOH A O 1 +HETATM 21038 O O . HOH S 10 . ? 100.937 73.598 97.866 1.00 29.19 ? 1907 HOH A O 1 +HETATM 21039 O O . HOH S 10 . ? 77.658 66.182 140.871 1.00 54.82 ? 1912 HOH A O 1 +HETATM 21040 O O . HOH S 10 . ? 94.443 82.474 92.876 1.00 36.33 ? 1918 HOH A O 1 +HETATM 21041 O O . HOH S 10 . ? 71.518 103.077 117.291 1.00 51.99 ? 1919 HOH A O 1 +HETATM 21042 O O . HOH S 10 . ? 74.850 68.294 140.050 1.00 31.43 ? 1924 HOH A O 1 +HETATM 21043 O O . HOH S 10 . ? 96.755 68.889 100.356 1.00 34.61 ? 1927 HOH A O 1 +HETATM 21044 O O . HOH S 10 . ? 89.631 52.860 111.146 1.00 37.55 ? 1929 HOH A O 1 +HETATM 21045 O O . HOH S 10 . ? 68.216 76.167 156.523 1.00 29.46 ? 1932 HOH A O 1 +HETATM 21046 O O . HOH S 10 . ? 100.578 74.349 152.941 1.00 26.60 ? 1934 HOH A O 1 +HETATM 21047 O O . HOH S 10 . ? 46.818 78.979 107.624 1.00 31.73 ? 1938 HOH A O 1 +HETATM 21048 O O . HOH S 10 . ? 87.831 96.227 139.809 1.00 28.77 ? 1941 HOH A O 1 +HETATM 21049 O O . HOH S 10 . ? 70.807 66.622 154.057 1.00 23.51 ? 1943 HOH A O 1 +HETATM 21050 O O . HOH S 10 . ? 82.965 86.565 138.443 1.00 22.20 ? 1944 HOH A O 1 +HETATM 21051 O O . HOH S 10 . ? 106.753 88.289 122.607 1.00 28.17 ? 1951 HOH A O 1 +HETATM 21052 O O . HOH S 10 . ? 81.431 83.415 157.171 1.00 34.84 ? 1952 HOH A O 1 +HETATM 21053 O O . HOH S 10 . ? 77.253 67.689 157.797 1.00 31.20 ? 1962 HOH A O 1 +HETATM 21054 O O . HOH S 10 . ? 50.448 74.386 122.063 1.00 41.90 ? 1966 HOH A O 1 +HETATM 21055 O O . HOH S 10 . ? 93.762 93.431 101.701 1.00 31.56 ? 1972 HOH A O 1 +HETATM 21056 O O . HOH S 10 . ? 98.941 97.979 109.002 1.00 29.62 ? 1978 HOH A O 1 +HETATM 21057 O O . HOH S 10 . ? 93.261 60.603 133.834 1.00 25.07 ? 1990 HOH A O 1 +HETATM 21058 O O . HOH S 10 . ? 102.215 59.843 141.880 1.00 38.88 ? 1993 HOH A O 1 +HETATM 21059 O O . HOH S 10 . ? 90.157 52.040 108.785 1.00 22.73 ? 1997 HOH A O 1 +HETATM 21060 O O . HOH S 10 . ? 50.297 85.757 117.851 1.00 29.44 ? 2000 HOH A O 1 +HETATM 21061 O O . HOH S 10 . ? 43.388 95.290 112.773 1.00 34.66 ? 2002 HOH A O 1 +HETATM 21062 O O . HOH S 10 . ? 106.705 86.157 120.933 1.00 42.13 ? 2009 HOH A O 1 +HETATM 21063 O O . HOH S 10 . ? 60.799 66.985 116.243 1.00 34.54 ? 2011 HOH A O 1 +HETATM 21064 O O . HOH S 10 . ? 89.548 63.280 97.633 1.00 28.78 ? 2012 HOH A O 1 +HETATM 21065 O O . HOH S 10 . ? 96.236 92.692 129.495 1.00 26.18 ? 2014 HOH A O 1 +HETATM 21066 O O . HOH S 10 . ? 89.245 80.338 159.109 1.00 43.25 ? 2015 HOH A O 1 +HETATM 21067 O O . HOH S 10 . ? 42.441 77.997 127.111 1.00 48.82 ? 2018 HOH A O 1 +HETATM 21068 O O . HOH S 10 . ? 41.626 92.607 110.566 1.00 42.09 ? 2023 HOH A O 1 +HETATM 21069 O O . HOH S 10 . ? 98.010 98.318 116.149 1.00 32.15 ? 2024 HOH A O 1 +HETATM 21070 O O . HOH S 10 . ? 95.323 60.374 135.733 1.00 39.71 ? 2030 HOH A O 1 +HETATM 21071 O O . HOH S 10 . ? 59.327 77.947 158.179 1.00 35.39 ? 2032 HOH A O 1 +HETATM 21072 O O . HOH S 10 . ? 99.533 60.735 111.393 1.00 31.89 ? 2033 HOH A O 1 +HETATM 21073 O O . HOH S 10 . ? 42.115 80.154 133.764 1.00 36.11 ? 2036 HOH A O 1 +HETATM 21074 O O . HOH S 10 . ? 47.814 92.708 131.976 1.00 18.53 ? 2043 HOH A O 1 +HETATM 21075 O O . HOH S 10 . ? 59.246 64.799 141.361 1.00 36.53 ? 2044 HOH A O 1 +HETATM 21076 O O . HOH S 10 . ? 68.314 63.082 120.081 1.00 8.24 ? 2047 HOH A O 1 +HETATM 21077 O O . HOH S 10 . ? 60.880 91.849 126.158 1.00 22.10 ? 2049 HOH A O 1 +HETATM 21078 O O . HOH S 10 . ? 67.893 63.701 127.962 1.00 15.66 ? 2052 HOH A O 1 +HETATM 21079 O O . HOH S 10 . ? 50.806 93.803 125.129 1.00 18.14 ? 2055 HOH A O 1 +HETATM 21080 O O . HOH S 10 . ? 92.649 55.030 145.874 1.00 40.24 ? 2071 HOH A O 1 +HETATM 21081 O O . HOH S 10 . ? 84.338 68.811 159.841 1.00 39.04 ? 2075 HOH A O 1 +HETATM 21082 O O . HOH S 10 . ? 62.377 101.560 119.061 1.00 44.79 ? 2079 HOH A O 1 +HETATM 21083 O O . HOH S 10 . ? 74.648 65.041 94.002 1.00 21.22 ? 2081 HOH A O 1 +HETATM 21084 O O . HOH S 10 . ? 56.859 96.633 116.201 1.00 21.33 ? 2083 HOH A O 1 +HETATM 21085 O O . HOH S 10 . ? 72.167 83.429 131.636 1.00 41.69 ? 2086 HOH A O 1 +HETATM 21086 O O . HOH S 10 . ? 44.941 90.717 118.253 1.00 43.19 ? 2098 HOH A O 1 +HETATM 21087 O O . HOH S 10 . ? 91.904 74.329 160.399 1.00 23.84 ? 2100 HOH A O 1 +HETATM 21088 O O . HOH S 10 . ? 50.738 97.467 100.959 1.00 34.51 ? 2103 HOH A O 1 +HETATM 21089 O O . HOH S 10 . ? 44.591 80.513 129.152 1.00 28.30 ? 2112 HOH A O 1 +HETATM 21090 O O . HOH S 10 . ? 92.888 58.613 121.299 1.00 27.45 ? 2120 HOH A O 1 +HETATM 21091 O O . HOH S 10 . ? 72.186 69.814 132.352 1.00 23.97 ? 2123 HOH A O 1 +HETATM 21092 O O . HOH S 10 . ? 77.553 84.533 156.200 1.00 39.25 ? 2125 HOH A O 1 +HETATM 21093 O O . HOH S 10 . ? 75.693 82.407 147.670 1.00 33.08 ? 2127 HOH A O 1 +HETATM 21094 O O . HOH S 10 . ? 93.063 72.121 161.385 1.00 36.53 ? 2133 HOH A O 1 +HETATM 21095 O O . HOH S 10 . ? 75.185 82.496 145.088 1.00 34.37 ? 2144 HOH A O 1 +HETATM 21096 O O . HOH S 10 . ? 43.534 80.780 136.527 1.00 41.66 ? 2150 HOH A O 1 +HETATM 21097 O O . HOH S 10 . ? 74.184 66.455 125.237 1.00 21.44 ? 2152 HOH A O 1 +HETATM 21098 O O . HOH S 10 . ? 50.736 90.105 120.803 1.00 20.58 ? 2156 HOH A O 1 +HETATM 21099 O O . HOH S 10 . ? 86.432 84.005 152.410 1.00 36.50 ? 2159 HOH A O 1 +HETATM 21100 O O . HOH S 10 . ? 65.435 96.335 125.746 1.00 22.87 ? 2161 HOH A O 1 +HETATM 21101 O O . HOH S 10 . ? 56.941 102.284 121.009 1.00 22.04 ? 2162 HOH A O 1 +HETATM 21102 O O . HOH S 10 . ? 92.779 81.319 144.288 1.00 42.70 ? 2168 HOH A O 1 +HETATM 21103 O O . HOH S 10 . ? 71.873 96.711 132.483 1.00 27.44 ? 2170 HOH A O 1 +HETATM 21104 O O . HOH S 10 . ? 84.665 88.391 161.225 1.00 45.82 ? 2172 HOH A O 1 +HETATM 21105 O O . HOH S 10 . ? 80.707 83.923 148.943 1.00 26.78 ? 2178 HOH A O 1 +HETATM 21106 O O . HOH S 10 . ? 54.800 85.472 116.959 1.00 25.21 ? 2180 HOH A O 1 +HETATM 21107 O O . HOH S 10 . ? 65.519 69.133 118.390 1.00 22.68 ? 2182 HOH A O 1 +HETATM 21108 O O . HOH S 10 . ? 42.791 89.073 117.140 1.00 45.73 ? 2185 HOH A O 1 +HETATM 21109 O O . HOH S 10 . ? 57.131 91.238 131.252 1.00 23.21 ? 2190 HOH A O 1 +HETATM 21110 O O . HOH S 10 . ? 91.818 88.684 102.227 1.00 20.55 ? 2191 HOH A O 1 +HETATM 21111 O O . HOH S 10 . ? 52.344 99.306 131.908 1.00 25.13 ? 2194 HOH A O 1 +HETATM 21112 O O . HOH S 10 . ? 72.771 65.415 140.685 1.00 50.81 ? 2203 HOH A O 1 +HETATM 21113 O O . HOH S 10 . ? 54.330 85.328 113.417 1.00 29.39 ? 2204 HOH A O 1 +HETATM 21114 O O . HOH S 10 . ? 47.026 89.510 118.931 1.00 27.78 ? 2207 HOH A O 1 +HETATM 21115 O O . HOH S 10 . ? 83.777 84.249 141.207 1.00 31.29 ? 2208 HOH A O 1 +HETATM 21116 O O . HOH S 10 . ? 90.905 103.220 123.670 1.00 24.14 ? 2210 HOH A O 1 +HETATM 21117 O O . HOH S 10 . ? 56.015 99.480 125.408 1.00 35.97 ? 2219 HOH A O 1 +HETATM 21118 O O . HOH S 10 . ? 86.821 78.751 85.387 1.00 28.84 ? 2221 HOH A O 1 +HETATM 21119 O O . HOH S 10 . ? 47.273 96.552 115.530 1.00 27.81 ? 2226 HOH A O 1 +HETATM 21120 O O . HOH S 10 . ? 73.116 66.211 135.323 1.00 27.96 ? 2231 HOH A O 1 +HETATM 21121 O O . HOH S 10 . ? 50.861 66.482 131.876 1.00 36.45 ? 2232 HOH A O 1 +HETATM 21122 O O . HOH S 10 . ? 78.655 61.492 143.770 1.00 29.99 ? 2238 HOH A O 1 +HETATM 21123 O O . HOH S 10 . ? 48.264 76.011 118.576 1.00 32.90 ? 2239 HOH A O 1 +HETATM 21124 O O . HOH S 10 . ? 68.890 100.619 126.797 1.00 45.45 ? 2240 HOH A O 1 +HETATM 21125 O O . HOH S 10 . ? 87.439 101.748 122.081 1.00 36.64 ? 2242 HOH A O 1 +HETATM 21126 O O . HOH S 10 . ? 61.245 92.008 128.622 1.00 43.73 ? 2253 HOH A O 1 +HETATM 21127 O O . HOH S 10 . ? 72.569 81.358 153.792 1.00 26.34 ? 2256 HOH A O 1 +HETATM 21128 O O . HOH S 10 . ? 86.234 82.553 162.205 1.00 37.77 ? 2263 HOH A O 1 +HETATM 21129 O O . HOH S 10 . ? 60.685 82.337 148.597 1.00 33.66 ? 2269 HOH A O 1 +HETATM 21130 O O . HOH S 10 . ? 58.789 62.299 152.597 1.00 28.94 ? 2271 HOH A O 1 +HETATM 21131 O O . HOH S 10 . ? 51.920 70.476 122.417 1.00 36.15 ? 2272 HOH A O 1 +HETATM 21132 O O . HOH S 10 . ? 48.414 78.011 120.055 1.00 62.36 ? 2277 HOH A O 1 +HETATM 21133 O O . HOH S 10 . ? 53.924 98.108 113.874 1.00 25.86 ? 2281 HOH A O 1 +HETATM 21134 O O . HOH S 10 . ? 86.992 64.068 148.367 1.00 34.04 ? 2283 HOH A O 1 +HETATM 21135 O O . HOH S 10 . ? 69.210 88.593 110.490 1.00 28.86 ? 2289 HOH A O 1 +HETATM 21136 O O . HOH S 10 . ? 88.047 63.044 153.992 1.00 41.00 ? 2290 HOH A O 1 +HETATM 21137 O O . HOH S 10 . ? 70.404 62.115 104.562 1.00 48.05 ? 2296 HOH A O 1 +HETATM 21138 O O . HOH S 10 . ? 85.392 62.803 153.242 1.00 48.37 ? 2298 HOH A O 1 +HETATM 21139 O O . HOH S 10 . ? 73.281 80.199 147.273 1.00 35.04 ? 2307 HOH A O 1 +HETATM 21140 O O . HOH S 10 . ? 68.816 82.602 148.472 1.00 36.86 ? 2317 HOH A O 1 +HETATM 21141 O O . HOH S 10 . ? 62.503 92.824 121.329 1.00 20.38 ? 2318 HOH A O 1 +HETATM 21142 O O . HOH S 10 . ? 81.460 89.839 99.975 1.00 27.59 ? 2319 HOH A O 1 +HETATM 21143 O O . HOH S 10 . ? 58.333 104.951 111.568 1.00 38.81 ? 2323 HOH A O 1 +HETATM 21144 O O . HOH S 10 . ? 75.685 69.662 118.132 1.00 35.72 ? 2326 HOH A O 1 +HETATM 21145 O O . HOH S 10 . ? 103.017 60.139 133.079 1.00 39.44 ? 2329 HOH A O 1 +HETATM 21146 O O . HOH S 10 . ? 76.988 89.539 137.583 1.00 31.81 ? 2334 HOH A O 1 +HETATM 21147 O O . HOH S 10 . ? 70.123 63.372 97.762 1.00 39.62 ? 2337 HOH A O 1 +HETATM 21148 O O . HOH S 10 . ? 46.434 79.742 119.968 1.00 35.38 ? 2341 HOH A O 1 +HETATM 21149 O O . HOH S 10 . ? 54.517 91.433 131.856 1.00 35.49 ? 2343 HOH A O 1 +HETATM 21150 O O . HOH S 10 . ? 71.753 62.603 99.348 1.00 36.10 ? 2346 HOH A O 1 +HETATM 21151 O O . HOH S 10 . ? 56.252 101.271 117.339 1.00 29.91 ? 2352 HOH A O 1 +HETATM 21152 O O . HOH S 10 . ? 56.249 71.840 150.221 1.00 36.08 ? 2357 HOH A O 1 +HETATM 21153 O O . HOH S 10 . ? 77.142 94.886 110.252 1.00 47.10 ? 2362 HOH A O 1 +HETATM 21154 O O . HOH S 10 . ? 46.882 98.381 104.682 1.00 41.32 ? 2363 HOH A O 1 +HETATM 21155 O O . HOH S 10 . ? 99.692 59.738 139.995 1.00 39.90 ? 2365 HOH A O 1 +HETATM 21156 O O . HOH S 10 . ? 92.494 56.409 140.441 1.00 36.61 ? 2366 HOH A O 1 +HETATM 21157 O O . HOH S 10 . ? 48.792 72.380 115.197 1.00 30.64 ? 2370 HOH A O 1 +HETATM 21158 O O . HOH S 10 . ? 53.363 97.437 109.735 1.00 51.72 ? 2377 HOH A O 1 +HETATM 21159 O O . HOH S 10 . ? 89.637 104.374 115.819 1.00 43.05 ? 2378 HOH A O 1 +HETATM 21160 O O . HOH S 10 . ? 56.333 99.593 115.041 1.00 32.67 ? 2384 HOH A O 1 +HETATM 21161 O O . HOH S 10 . ? 79.294 64.695 157.690 1.00 56.27 ? 2389 HOH A O 1 +HETATM 21162 O O . HOH S 10 . ? 102.027 61.117 137.393 1.00 38.87 ? 2402 HOH A O 1 +HETATM 21163 O O . HOH S 10 . ? 83.927 82.324 87.228 1.00 28.20 ? 2407 HOH A O 1 +HETATM 21164 O O . HOH S 10 . ? 88.095 62.755 137.265 1.00 44.39 ? 2409 HOH A O 1 +HETATM 21165 O O . HOH S 10 . ? 57.420 71.013 153.556 1.00 41.36 ? 2427 HOH A O 1 +HETATM 21166 O O . HOH S 10 . ? 80.671 60.228 144.040 1.00 37.81 ? 2440 HOH A O 1 +HETATM 21167 O O . HOH S 10 . ? 70.670 89.100 117.269 1.00 9.07 ? 2443 HOH A O 1 +HETATM 21168 O O . HOH S 10 . ? 80.864 76.532 128.790 1.00 9.52 ? 2448 HOH A O 1 +HETATM 21169 O O . HOH S 10 . ? 73.744 57.908 114.285 1.00 11.88 ? 2449 HOH A O 1 +HETATM 21170 O O . HOH S 10 . ? 71.199 68.652 122.844 1.00 12.17 ? 2450 HOH A O 1 +HETATM 21171 O O . HOH S 10 . ? 76.850 88.255 115.221 1.00 15.63 ? 2451 HOH A O 1 +HETATM 21172 O O . HOH S 10 . ? 93.295 79.212 135.330 1.00 20.47 ? 2458 HOH A O 1 +HETATM 21173 O O . HOH S 10 . ? 75.381 89.192 113.179 1.00 14.69 ? 2462 HOH A O 1 +HETATM 21174 O O . HOH S 10 . ? 75.951 66.047 91.330 1.00 15.00 ? 2464 HOH A O 1 +HETATM 21175 O O . HOH S 10 . ? 51.688 67.448 119.587 1.00 19.92 ? 2484 HOH A O 1 +HETATM 21176 O O . HOH S 10 . ? 64.022 67.004 115.246 1.00 30.06 ? 2492 HOH A O 1 +HETATM 21177 O O . HOH S 10 . ? 71.515 74.224 126.544 1.00 17.32 ? 2493 HOH A O 1 +HETATM 21178 O O . HOH S 10 . ? 92.014 96.970 113.361 1.00 24.36 ? 2494 HOH A O 1 +HETATM 21179 O O . HOH S 10 . ? 73.867 93.108 126.929 1.00 20.75 ? 2495 HOH A O 1 +HETATM 21180 O O . HOH S 10 . ? 94.473 88.043 131.361 1.00 28.57 ? 2500 HOH A O 1 +HETATM 21181 O O . HOH S 10 . ? 66.948 74.077 132.684 1.00 23.36 ? 2507 HOH A O 1 +HETATM 21182 O O . HOH S 10 . ? 95.827 88.881 129.316 1.00 24.91 ? 2510 HOH A O 1 +HETATM 21183 O O . HOH S 10 . ? 87.443 66.991 94.568 1.00 24.42 ? 2513 HOH A O 1 +HETATM 21184 O O . HOH S 10 . ? 53.148 95.548 107.812 1.00 31.24 ? 2516 HOH A O 1 +HETATM 21185 O O . HOH S 10 . ? 72.460 93.426 124.662 1.00 16.46 ? 2521 HOH A O 1 +HETATM 21186 O O . HOH S 10 . ? 77.386 75.283 139.264 1.00 23.51 ? 2523 HOH A O 1 +HETATM 21187 O O . HOH S 10 . ? 52.558 76.666 155.304 1.00 32.19 ? 2525 HOH A O 1 +HETATM 21188 O O . HOH S 10 . ? 64.705 69.306 114.781 1.00 26.01 ? 2526 HOH A O 1 +HETATM 21189 O O . HOH S 10 . ? 100.630 98.918 110.520 1.00 32.63 ? 2528 HOH A O 1 +HETATM 21190 O O . HOH S 10 . ? 99.004 87.485 99.871 1.00 28.46 ? 2530 HOH A O 1 +HETATM 21191 O O . HOH S 10 . ? 65.264 92.926 127.889 1.00 30.44 ? 2532 HOH A O 1 +HETATM 21192 O O . HOH S 10 . ? 64.511 85.049 114.639 1.00 24.14 ? 2536 HOH A O 1 +HETATM 21193 O O . HOH S 10 . ? 61.101 86.991 142.941 1.00 33.80 ? 2541 HOH A O 1 +HETATM 21194 O O . HOH S 10 . ? 79.001 88.583 146.606 1.00 42.36 ? 2544 HOH A O 1 +HETATM 21195 O O . HOH S 10 . ? 43.627 91.115 122.013 1.00 37.09 ? 2545 HOH A O 1 +HETATM 21196 O O . HOH S 10 . ? 44.660 91.935 125.661 1.00 31.17 ? 2546 HOH A O 1 +HETATM 21197 O O . HOH S 10 . ? 40.910 86.089 132.817 1.00 28.47 ? 2547 HOH A O 1 +HETATM 21198 O O . HOH S 10 . ? 54.421 88.347 139.589 1.00 40.81 ? 2548 HOH A O 1 +HETATM 21199 O O . HOH S 10 . ? 50.944 81.197 148.248 1.00 42.51 ? 2549 HOH A O 1 +HETATM 21200 O O . HOH S 10 . ? 40.518 74.805 128.015 1.00 41.91 ? 2550 HOH A O 1 +HETATM 21201 O O . HOH S 10 . ? 48.466 64.553 129.113 1.00 47.52 ? 2551 HOH A O 1 +HETATM 21202 O O . HOH S 10 . ? 61.667 96.897 122.007 1.00 31.84 ? 2552 HOH A O 1 +HETATM 21203 O O . HOH S 10 . ? 46.509 95.797 112.784 1.00 26.49 ? 2553 HOH A O 1 +HETATM 21204 O O . HOH S 10 . ? 106.097 64.678 132.022 1.00 26.44 ? 2554 HOH A O 1 +HETATM 21205 O O . HOH S 10 . ? 78.054 103.384 127.876 1.00 44.13 ? 2555 HOH A O 1 +HETATM 21206 O O . HOH S 10 . ? 81.680 96.636 136.926 1.00 40.21 ? 2556 HOH A O 1 +HETATM 21207 O O . HOH S 10 . ? 84.044 94.590 139.471 1.00 29.49 ? 2557 HOH A O 1 +HETATM 21208 O O . HOH S 10 . ? 93.027 56.313 108.979 1.00 36.24 ? 2558 HOH A O 1 +HETATM 21209 O O . HOH S 10 . ? 102.174 69.320 117.337 1.00 30.39 ? 2559 HOH A O 1 +HETATM 21210 O O . HOH S 10 . ? 45.613 66.319 136.993 1.00 44.57 ? 2568 HOH A O 1 +HETATM 21211 O O . HOH S 10 . ? 46.009 66.198 139.669 1.00 32.42 ? 2569 HOH A O 1 +HETATM 21212 O O . HOH S 10 . ? 45.495 66.991 134.454 1.00 42.05 ? 2570 HOH A O 1 +HETATM 21213 O O . HOH S 10 . ? 44.253 64.977 132.245 1.00 28.05 ? 2571 HOH A O 1 +HETATM 21214 O O . HOH S 10 . ? 71.147 84.522 110.106 1.00 34.12 ? 2580 HOH A O 1 +HETATM 21215 O O . HOH S 10 . ? 66.934 89.646 111.048 1.00 39.31 ? 2581 HOH A O 1 +HETATM 21216 O O . HOH S 10 . ? 101.946 82.620 102.016 1.00 32.89 ? 2583 HOH A O 1 +HETATM 21217 O O . HOH S 10 . ? 102.380 84.882 100.810 1.00 28.07 ? 2584 HOH A O 1 +HETATM 21218 O O . HOH S 10 . ? 101.115 80.939 99.961 1.00 34.10 ? 2585 HOH A O 1 +HETATM 21219 O O . HOH S 10 . ? 102.553 79.810 98.137 1.00 36.70 ? 2586 HOH A O 1 +HETATM 21220 O O . HOH S 10 . ? 105.757 78.638 117.708 1.00 27.49 ? 2597 HOH A O 1 +HETATM 21221 O O . HOH S 10 . ? 109.522 80.294 118.780 1.00 30.41 ? 2598 HOH A O 1 +HETATM 21222 O O . HOH S 10 . ? 89.580 53.861 113.325 1.00 33.20 ? 2609 HOH A O 1 +HETATM 21223 O O . HOH S 10 . ? 88.493 79.338 87.710 1.00 31.24 ? 2611 HOH A O 1 +HETATM 21224 O O . HOH S 10 . ? 85.580 56.334 125.501 1.00 21.69 ? 2615 HOH A O 1 +HETATM 21225 O O . HOH S 10 . ? 71.427 84.821 145.475 1.00 38.42 ? 2623 HOH A O 1 +HETATM 21226 O O . HOH S 10 . ? 101.800 91.782 120.827 1.00 27.60 ? 2637 HOH A O 1 +HETATM 21227 O O . HOH S 10 . ? 45.675 81.222 108.443 1.00 25.48 ? 2641 HOH A O 1 +HETATM 21228 O O . HOH S 10 . ? 61.115 93.773 130.445 1.00 36.63 ? 2650 HOH A O 1 +HETATM 21229 O O . HOH S 10 . ? 103.882 65.572 148.905 1.00 28.49 ? 2653 HOH A O 1 +HETATM 21230 O O . HOH S 10 . ? 103.396 65.807 145.061 1.00 28.94 ? 2654 HOH A O 1 +HETATM 21231 O O . HOH S 10 . ? 100.389 99.767 117.472 1.00 38.58 ? 2655 HOH A O 1 +HETATM 21232 O O . HOH S 10 . ? 101.451 71.326 98.993 1.00 32.57 ? 2657 HOH A O 1 +HETATM 21233 O O . HOH S 10 . ? 101.742 70.433 101.508 1.00 29.48 ? 2658 HOH A O 1 +HETATM 21234 O O . HOH S 10 . ? 104.731 74.619 100.078 1.00 41.53 ? 2659 HOH A O 1 +HETATM 21235 O O . HOH S 10 . ? 98.003 81.902 137.924 1.00 30.65 ? 2660 HOH A O 1 +HETATM 21236 O O . HOH S 10 . ? 75.603 62.737 93.486 1.00 25.58 ? 2665 HOH A O 1 +HETATM 21237 O O . HOH S 10 . ? 102.226 75.812 154.290 1.00 33.25 ? 2669 HOH A O 1 +HETATM 21238 O O . HOH S 10 . ? 94.793 82.946 143.148 1.00 25.98 ? 2671 HOH A O 1 +HETATM 21239 O O . HOH S 10 . ? 96.882 84.152 144.376 1.00 38.10 ? 2672 HOH A O 1 +HETATM 21240 O O . HOH S 10 . ? 95.465 64.112 155.489 1.00 38.83 ? 2675 HOH A O 1 +HETATM 21241 O O . HOH S 10 . ? 108.674 65.380 137.973 1.00 42.71 ? 2676 HOH A O 1 +HETATM 21242 O O . HOH S 10 . ? 69.644 99.624 112.672 1.00 31.15 ? 2678 HOH A O 1 +HETATM 21243 O O . HOH S 10 . ? 96.648 99.229 108.806 1.00 37.48 ? 2685 HOH A O 1 +HETATM 21244 O O . HOH S 10 . ? 104.020 85.882 127.877 1.00 31.75 ? 2689 HOH A O 1 +HETATM 21245 O O . HOH S 10 . ? 99.378 92.815 123.392 1.00 38.87 ? 2699 HOH A O 1 +HETATM 21246 O O . HOH S 10 . ? 47.186 72.120 125.144 1.00 40.67 ? 2703 HOH A O 1 +HETATM 21247 O O . HOH S 10 . ? 103.998 67.614 123.500 1.00 26.48 ? 2707 HOH A O 1 +HETATM 21248 O O . HOH S 10 . ? 52.286 84.332 113.959 1.00 34.96 ? 2710 HOH A O 1 +HETATM 21249 O O . HOH S 10 . ? 93.870 100.495 115.067 1.00 36.14 ? 2712 HOH A O 1 +HETATM 21250 O O . HOH S 10 . ? 107.684 71.833 148.718 1.00 38.95 ? 2713 HOH A O 1 +HETATM 21251 O O . HOH S 10 . ? 104.332 77.615 133.573 1.00 34.60 ? 2716 HOH A O 1 +HETATM 21252 O O . HOH S 10 . ? 99.097 81.170 154.038 1.00 33.16 ? 2726 HOH A O 1 +HETATM 21253 O O . HOH S 10 . ? 46.887 67.832 124.364 1.00 29.70 ? 2737 HOH A O 1 +HETATM 21254 O O . HOH S 10 . ? 93.985 80.944 158.831 1.00 27.62 ? 2738 HOH A O 1 +HETATM 21255 O O . HOH S 10 . ? 65.591 97.320 113.787 1.00 39.20 ? 2743 HOH A O 1 +HETATM 21256 O O . HOH S 10 . ? 90.659 60.409 142.450 1.00 30.39 ? 2745 HOH A O 1 +HETATM 21257 O O . HOH S 10 . ? 105.846 62.942 118.329 1.00 43.71 ? 2752 HOH A O 1 +HETATM 21258 O O . HOH S 10 . ? 72.676 80.299 159.091 1.00 34.73 ? 2754 HOH A O 1 +HETATM 21259 O O . HOH S 10 . ? 74.385 79.755 162.945 1.00 40.53 ? 2760 HOH A O 1 +HETATM 21260 O O . HOH S 10 . ? 111.125 68.129 144.990 1.00 38.69 ? 2761 HOH A O 1 +HETATM 21261 O O . HOH S 10 . ? 107.061 86.655 127.039 1.00 37.43 ? 2762 HOH A O 1 +HETATM 21262 O O . HOH S 10 . ? 107.836 83.412 127.842 1.00 36.41 ? 2763 HOH A O 1 +HETATM 21263 O O . HOH S 10 . ? 69.717 78.459 155.231 1.00 38.88 ? 2766 HOH A O 1 +HETATM 21264 O O . HOH S 10 . ? 41.845 95.463 108.457 1.00 37.66 ? 2770 HOH A O 1 +HETATM 21265 O O . HOH S 10 . ? 40.748 87.177 115.576 1.00 41.74 ? 2777 HOH A O 1 +HETATM 21266 O O . HOH S 10 . ? 90.547 57.615 142.055 1.00 37.76 ? 2785 HOH A O 1 +HETATM 21267 O O . HOH S 10 . ? 77.613 61.861 141.231 1.00 37.79 ? 2791 HOH A O 1 +HETATM 21268 O O . HOH S 10 . ? 46.945 78.639 110.258 1.00 41.61 ? 2799 HOH A O 1 +HETATM 21269 O O . HOH S 10 . ? 54.553 79.595 111.150 1.00 39.19 ? 2800 HOH A O 1 +HETATM 21270 O O . HOH S 10 . ? 53.248 78.289 113.144 1.00 32.64 ? 2801 HOH A O 1 +HETATM 21271 O O . HOH S 10 . ? 76.965 68.897 160.160 1.00 37.26 ? 2804 HOH A O 1 +HETATM 21272 O O . HOH S 10 . ? 103.739 66.414 109.713 1.00 45.06 ? 2806 HOH A O 1 +HETATM 21273 O O . HOH S 10 . ? 40.285 79.610 127.470 1.00 40.29 ? 2808 HOH A O 1 +HETATM 21274 O O . HOH S 10 . ? 37.889 79.796 128.575 1.00 40.45 ? 2809 HOH A O 1 +HETATM 21275 O O . HOH T 10 . ? 89.334 62.984 82.043 1.00 8.44 ? 6 HOH B O 1 +HETATM 21276 O O . HOH T 10 . ? 99.674 51.285 66.087 1.00 9.76 ? 12 HOH B O 1 +HETATM 21277 O O . HOH T 10 . ? 84.151 54.536 109.149 1.00 12.52 ? 634 HOH B O 1 +HETATM 21278 O O . HOH T 10 . ? 94.781 49.393 100.744 1.00 18.71 ? 635 HOH B O 1 +HETATM 21279 O O . HOH T 10 . ? 78.951 49.586 101.581 1.00 6.51 ? 636 HOH B O 1 +HETATM 21280 O O . HOH T 10 . ? 72.185 44.033 98.841 1.00 7.61 ? 637 HOH B O 1 +HETATM 21281 O O . HOH T 10 . ? 72.547 48.307 74.424 1.00 14.00 ? 638 HOH B O 1 +HETATM 21282 O O . HOH T 10 . ? 63.392 52.233 71.305 1.00 11.16 ? 639 HOH B O 1 +HETATM 21283 O O . HOH T 10 . ? 75.274 33.708 86.143 1.00 11.08 ? 640 HOH B O 1 +HETATM 21284 O O . HOH T 10 . ? 57.366 57.229 60.559 1.00 19.31 ? 641 HOH B O 1 +HETATM 21285 O O . HOH T 10 . ? 87.235 47.409 64.163 1.00 11.79 ? 642 HOH B O 1 +HETATM 21286 O O . HOH T 10 . ? 76.129 40.051 64.360 1.00 11.51 ? 643 HOH B O 1 +HETATM 21287 O O . HOH T 10 . ? 72.832 56.072 91.370 1.00 7.49 ? 644 HOH B O 1 +HETATM 21288 O O . HOH T 10 . ? 67.138 40.039 85.506 1.00 7.40 ? 645 HOH B O 1 +HETATM 21289 O O . HOH T 10 . ? 75.242 36.592 59.181 1.00 26.63 ? 646 HOH B O 1 +HETATM 21290 O O . HOH T 10 . ? 93.777 37.953 112.189 1.00 37.95 ? 647 HOH B O 1 +HETATM 21291 O O . HOH T 10 . ? 89.558 48.808 64.200 1.00 16.55 ? 648 HOH B O 1 +HETATM 21292 O O . HOH T 10 . ? 75.081 42.671 86.368 1.00 7.00 ? 649 HOH B O 1 +HETATM 21293 O O . HOH T 10 . ? 92.242 46.694 62.780 1.00 11.45 ? 661 HOH B O 1 +HETATM 21294 O O . HOH T 10 . ? 75.758 46.271 67.933 1.00 8.22 ? 662 HOH B O 1 +HETATM 21295 O O . HOH T 10 . ? 88.368 31.578 84.671 1.00 7.29 ? 663 HOH B O 1 +HETATM 21296 O O . HOH T 10 . ? 53.709 40.932 80.013 1.00 8.88 ? 664 HOH B O 1 +HETATM 21297 O O . HOH T 10 . ? 106.227 55.597 63.554 1.00 21.06 ? 665 HOH B O 1 +HETATM 21298 O O . HOH T 10 . ? 73.232 53.899 112.630 1.00 19.59 ? 666 HOH B O 1 +HETATM 21299 O O . HOH T 10 . ? 70.790 41.771 68.551 1.00 7.20 ? 667 HOH B O 1 +HETATM 21300 O O . HOH T 10 . ? 103.765 55.694 84.123 1.00 52.74 ? 668 HOH B O 1 +HETATM 21301 O O . HOH T 10 . ? 101.559 40.586 83.649 1.00 14.25 ? 669 HOH B O 1 +HETATM 21302 O O . HOH T 10 . ? 70.599 47.984 83.938 1.00 10.62 ? 670 HOH B O 1 +HETATM 21303 O O . HOH T 10 . ? 73.852 42.461 97.655 1.00 7.36 ? 671 HOH B O 1 +HETATM 21304 O O . HOH T 10 . ? 106.334 50.285 53.961 1.00 24.84 ? 672 HOH B O 1 +HETATM 21305 O O . HOH T 10 . ? 81.707 48.380 94.834 1.00 5.01 ? 673 HOH B O 1 +HETATM 21306 O O . HOH T 10 . ? 78.464 52.826 77.348 1.00 26.87 ? 674 HOH B O 1 +HETATM 21307 O O . HOH T 10 . ? 102.744 40.597 73.603 1.00 12.02 ? 675 HOH B O 1 +HETATM 21308 O O . HOH T 10 . ? 80.904 34.526 109.810 1.00 14.46 ? 676 HOH B O 1 +HETATM 21309 O O . HOH T 10 . ? 73.242 37.541 71.136 1.00 9.78 ? 677 HOH B O 1 +HETATM 21310 O O . HOH T 10 . ? 78.531 35.412 110.039 1.00 19.55 ? 678 HOH B O 1 +HETATM 21311 O O . HOH T 10 . ? 80.468 44.320 55.761 1.00 10.43 ? 679 HOH B O 1 +HETATM 21312 O O . HOH T 10 . ? 61.988 44.149 78.508 1.00 8.92 ? 680 HOH B O 1 +HETATM 21313 O O . HOH T 10 . ? 72.339 53.702 78.113 1.00 10.37 ? 681 HOH B O 1 +HETATM 21314 O O . HOH T 10 . ? 74.080 55.310 95.345 1.00 16.20 ? 682 HOH B O 1 +HETATM 21315 O O . HOH T 10 . ? 71.835 35.589 72.374 1.00 9.21 ? 683 HOH B O 1 +HETATM 21316 O O . HOH T 10 . ? 93.598 34.391 58.029 1.00 9.79 ? 684 HOH B O 1 +HETATM 21317 O O . HOH T 10 . ? 81.799 44.965 72.922 1.00 10.65 ? 685 HOH B O 1 +HETATM 21318 O O . HOH T 10 . ? 79.644 50.910 55.036 1.00 11.82 ? 686 HOH B O 1 +HETATM 21319 O O . HOH T 10 . ? 74.771 38.697 86.947 1.00 13.20 ? 687 HOH B O 1 +HETATM 21320 O O . HOH T 10 . ? 94.294 57.372 69.339 1.00 14.85 ? 688 HOH B O 1 +HETATM 21321 O O . HOH T 10 . ? 85.768 45.263 61.502 1.00 12.63 ? 689 HOH B O 1 +HETATM 21322 O O . HOH T 10 . ? 63.659 52.957 78.935 1.00 9.08 ? 690 HOH B O 1 +HETATM 21323 O O . HOH T 10 . ? 76.001 31.656 91.149 1.00 17.36 ? 691 HOH B O 1 +HETATM 21324 O O . HOH T 10 . ? 52.061 33.014 65.042 1.00 34.00 ? 692 HOH B O 1 +HETATM 21325 O O . HOH T 10 . ? 76.621 32.124 82.864 1.00 9.11 ? 693 HOH B O 1 +HETATM 21326 O O . HOH T 10 . ? 97.653 52.062 46.369 1.00 29.07 ? 694 HOH B O 1 +HETATM 21327 O O . HOH T 10 . ? 69.436 56.352 74.261 1.00 14.52 ? 695 HOH B O 1 +HETATM 21328 O O . HOH T 10 . ? 71.608 60.720 82.533 1.00 25.82 ? 696 HOH B O 1 +HETATM 21329 O O . HOH T 10 . ? 56.811 47.060 56.576 1.00 11.19 ? 697 HOH B O 1 +HETATM 21330 O O . HOH T 10 . ? 69.021 39.558 75.262 1.00 13.83 ? 698 HOH B O 1 +HETATM 21331 O O . HOH T 10 . ? 98.640 49.642 46.424 1.00 18.97 ? 699 HOH B O 1 +HETATM 21332 O O . HOH T 10 . ? 68.424 46.632 71.052 1.00 9.54 ? 700 HOH B O 1 +HETATM 21333 O O . HOH T 10 . ? 67.825 37.439 74.387 1.00 13.50 ? 701 HOH B O 1 +HETATM 21334 O O . HOH T 10 . ? 93.906 58.179 76.114 1.00 17.47 ? 702 HOH B O 1 +HETATM 21335 O O . HOH T 10 . ? 44.689 37.544 59.322 1.00 12.26 ? 703 HOH B O 1 +HETATM 21336 O O . HOH T 10 . ? 70.938 47.953 95.865 1.00 12.64 ? 704 HOH B O 1 +HETATM 21337 O O . HOH T 10 . ? 87.919 55.229 111.512 1.00 14.01 ? 705 HOH B O 1 +HETATM 21338 O O . HOH T 10 . ? 68.532 44.258 76.158 1.00 9.06 ? 706 HOH B O 1 +HETATM 21339 O O . HOH T 10 . ? 70.044 44.209 72.576 1.00 10.67 ? 707 HOH B O 1 +HETATM 21340 O O . HOH T 10 . ? 78.422 36.849 80.106 1.00 9.58 ? 708 HOH B O 1 +HETATM 21341 O O . HOH T 10 . ? 78.608 38.662 88.116 1.00 13.88 ? 709 HOH B O 1 +HETATM 21342 O O . HOH T 10 . ? 75.269 64.194 86.890 1.00 11.35 ? 710 HOH B O 1 +HETATM 21343 O O . HOH T 10 . ? 93.001 62.313 86.853 1.00 26.06 ? 711 HOH B O 1 +HETATM 21344 O O . HOH T 10 . ? 68.923 42.307 74.222 1.00 11.15 ? 712 HOH B O 1 +HETATM 21345 O O . HOH T 10 . ? 82.027 55.216 98.777 1.00 8.68 ? 713 HOH B O 1 +HETATM 21346 O O . HOH T 10 . ? 78.752 40.096 63.884 1.00 9.42 ? 714 HOH B O 1 +HETATM 21347 O O . HOH T 10 . ? 78.839 54.866 115.417 1.00 10.90 ? 715 HOH B O 1 +HETATM 21348 O O . HOH T 10 . ? 74.821 52.959 85.057 1.00 9.70 ? 716 HOH B O 1 +HETATM 21349 O O . HOH T 10 . ? 70.331 61.228 84.699 1.00 13.76 ? 717 HOH B O 1 +HETATM 21350 O O . HOH T 10 . ? 65.035 41.452 84.127 1.00 13.04 ? 718 HOH B O 1 +HETATM 21351 O O . HOH T 10 . ? 81.602 63.712 86.958 1.00 8.91 ? 719 HOH B O 1 +HETATM 21352 O O . HOH T 10 . ? 79.539 35.811 92.723 1.00 23.12 ? 720 HOH B O 1 +HETATM 21353 O O . HOH T 10 . ? 93.961 36.306 59.922 1.00 16.62 ? 721 HOH B O 1 +HETATM 21354 O O . HOH T 10 . ? 71.053 39.255 95.431 1.00 25.90 ? 722 HOH B O 1 +HETATM 21355 O O . HOH T 10 . ? 59.987 63.595 64.926 1.00 25.01 ? 723 HOH B O 1 +HETATM 21356 O O . HOH T 10 . ? 106.295 42.189 55.075 1.00 21.71 ? 724 HOH B O 1 +HETATM 21357 O O . HOH T 10 . ? 52.865 47.414 60.638 1.00 12.77 ? 725 HOH B O 1 +HETATM 21358 O O . HOH T 10 . ? 92.380 57.356 56.513 1.00 20.74 ? 726 HOH B O 1 +HETATM 21359 O O . HOH T 10 . ? 90.574 47.236 91.472 1.00 8.75 ? 727 HOH B O 1 +HETATM 21360 O O . HOH T 10 . ? 76.607 39.447 92.005 1.00 16.85 ? 728 HOH B O 1 +HETATM 21361 O O . HOH T 10 . ? 71.857 58.461 83.949 1.00 12.89 ? 729 HOH B O 1 +HETATM 21362 O O . HOH T 10 . ? 57.840 52.949 83.007 1.00 15.40 ? 730 HOH B O 1 +HETATM 21363 O O . HOH T 10 . ? 74.496 60.973 105.986 1.00 16.11 ? 731 HOH B O 1 +HETATM 21364 O O . HOH T 10 . ? 94.043 54.140 97.166 1.00 18.78 ? 732 HOH B O 1 +HETATM 21365 O O . HOH T 10 . ? 48.205 55.932 71.755 1.00 26.70 ? 733 HOH B O 1 +HETATM 21366 O O . HOH T 10 . ? 94.340 46.698 64.598 1.00 9.21 ? 734 HOH B O 1 +HETATM 21367 O O . HOH T 10 . ? 102.598 39.099 86.262 1.00 16.87 ? 735 HOH B O 1 +HETATM 21368 O O . HOH T 10 . ? 93.747 51.277 98.282 1.00 11.42 ? 736 HOH B O 1 +HETATM 21369 O O . HOH T 10 . ? 78.569 51.631 83.069 1.00 21.32 ? 737 HOH B O 1 +HETATM 21370 O O . HOH T 10 . ? 81.374 30.234 87.403 1.00 8.40 ? 738 HOH B O 1 +HETATM 21371 O O . HOH T 10 . ? 81.654 55.859 66.323 1.00 35.71 ? 739 HOH B O 1 +HETATM 21372 O O . HOH T 10 . ? 95.883 44.641 66.208 1.00 17.60 ? 740 HOH B O 1 +HETATM 21373 O O . HOH T 10 . ? 77.468 42.601 92.179 1.00 9.36 ? 741 HOH B O 1 +HETATM 21374 O O . HOH T 10 . ? 92.170 35.719 50.073 1.00 16.00 ? 742 HOH B O 1 +HETATM 21375 O O . HOH T 10 . ? 67.598 39.749 67.328 1.00 11.34 ? 743 HOH B O 1 +HETATM 21376 O O . HOH T 10 . ? 95.178 23.895 95.020 1.00 20.51 ? 744 HOH B O 1 +HETATM 21377 O O . HOH T 10 . ? 94.244 58.408 73.639 1.00 14.10 ? 745 HOH B O 1 +HETATM 21378 O O . HOH T 10 . ? 94.534 40.675 67.894 1.00 14.35 ? 746 HOH B O 1 +HETATM 21379 O O . HOH T 10 . ? 99.385 50.492 83.808 1.00 17.68 ? 747 HOH B O 1 +HETATM 21380 O O . HOH T 10 . ? 72.964 60.588 71.566 1.00 12.63 ? 748 HOH B O 1 +HETATM 21381 O O . HOH T 10 . ? 60.120 43.540 80.403 1.00 13.34 ? 749 HOH B O 1 +HETATM 21382 O O . HOH T 10 . ? 93.267 58.539 67.083 1.00 26.67 ? 750 HOH B O 1 +HETATM 21383 O O . HOH T 10 . ? 81.567 35.940 96.743 1.00 19.21 ? 751 HOH B O 1 +HETATM 21384 O O . HOH T 10 . ? 74.505 51.763 114.492 1.00 11.69 ? 752 HOH B O 1 +HETATM 21385 O O . HOH T 10 . ? 72.523 39.943 97.664 1.00 15.33 ? 753 HOH B O 1 +HETATM 21386 O O . HOH T 10 . ? 92.303 38.759 106.890 1.00 15.08 ? 754 HOH B O 1 +HETATM 21387 O O . HOH T 10 . ? 53.679 54.308 60.167 1.00 16.83 ? 755 HOH B O 1 +HETATM 21388 O O . HOH T 10 . ? 75.850 36.173 87.044 1.00 10.65 ? 756 HOH B O 1 +HETATM 21389 O O . HOH T 10 . ? 101.129 40.842 87.616 1.00 17.88 ? 757 HOH B O 1 +HETATM 21390 O O . HOH T 10 . ? 59.719 42.742 73.287 1.00 18.93 ? 758 HOH B O 1 +HETATM 21391 O O . HOH T 10 . ? 76.625 40.434 87.394 1.00 10.82 ? 759 HOH B O 1 +HETATM 21392 O O . HOH T 10 . ? 71.645 46.604 72.633 1.00 8.99 ? 760 HOH B O 1 +HETATM 21393 O O . HOH T 10 . ? 86.612 53.917 114.424 1.00 12.83 ? 761 HOH B O 1 +HETATM 21394 O O . HOH T 10 . ? 87.614 29.246 86.030 1.00 16.21 ? 762 HOH B O 1 +HETATM 21395 O O . HOH T 10 . ? 98.072 37.899 55.113 1.00 13.12 ? 763 HOH B O 1 +HETATM 21396 O O . HOH T 10 . ? 67.937 41.908 87.541 1.00 8.87 ? 764 HOH B O 1 +HETATM 21397 O O . HOH T 10 . ? 45.067 35.802 72.655 1.00 12.81 ? 765 HOH B O 1 +HETATM 21398 O O . HOH T 10 . ? 67.181 36.743 57.771 1.00 17.72 ? 766 HOH B O 1 +HETATM 21399 O O . HOH T 10 . ? 72.624 62.429 52.385 1.00 33.78 ? 767 HOH B O 1 +HETATM 21400 O O . HOH T 10 . ? 81.593 35.248 94.330 1.00 18.74 ? 768 HOH B O 1 +HETATM 21401 O O . HOH T 10 . ? 96.740 57.727 65.993 1.00 18.93 ? 769 HOH B O 1 +HETATM 21402 O O . HOH T 10 . ? 63.389 46.988 88.857 1.00 13.89 ? 770 HOH B O 1 +HETATM 21403 O O . HOH T 10 . ? 104.859 57.648 60.302 1.00 22.84 ? 771 HOH B O 1 +HETATM 21404 O O . HOH T 10 . ? 103.904 53.965 69.769 1.00 20.75 ? 772 HOH B O 1 +HETATM 21405 O O . HOH T 10 . ? 88.604 23.914 75.240 1.00 13.07 ? 773 HOH B O 1 +HETATM 21406 O O . HOH T 10 . ? 104.937 46.672 52.885 1.00 16.86 ? 774 HOH B O 1 +HETATM 21407 O O . HOH T 10 . ? 73.786 52.809 68.524 1.00 20.93 ? 775 HOH B O 1 +HETATM 21408 O O . HOH T 10 . ? 53.250 39.841 72.187 1.00 9.73 ? 776 HOH B O 1 +HETATM 21409 O O . HOH T 10 . ? 96.879 59.098 72.415 1.00 18.87 ? 777 HOH B O 1 +HETATM 21410 O O . HOH T 10 . ? 69.022 41.042 90.206 1.00 12.65 ? 778 HOH B O 1 +HETATM 21411 O O . HOH T 10 . ? 100.389 54.016 71.310 1.00 13.60 ? 779 HOH B O 1 +HETATM 21412 O O . HOH T 10 . ? 74.338 56.025 67.604 1.00 28.78 ? 780 HOH B O 1 +HETATM 21413 O O . HOH T 10 . ? 77.205 36.213 107.645 1.00 14.81 ? 781 HOH B O 1 +HETATM 21414 O O . HOH T 10 . ? 55.385 39.479 54.193 1.00 23.39 ? 782 HOH B O 1 +HETATM 21415 O O . HOH T 10 . ? 55.798 37.990 56.509 1.00 22.44 ? 783 HOH B O 1 +HETATM 21416 O O . HOH T 10 . ? 71.917 58.271 70.277 1.00 19.34 ? 784 HOH B O 1 +HETATM 21417 O O . HOH T 10 . ? 99.062 57.199 78.644 1.00 16.02 ? 785 HOH B O 1 +HETATM 21418 O O . HOH T 10 . ? 43.125 36.682 65.753 1.00 15.05 ? 786 HOH B O 1 +HETATM 21419 O O . HOH T 10 . ? 85.218 49.182 62.988 1.00 18.44 ? 787 HOH B O 1 +HETATM 21420 O O . HOH T 10 . ? 79.263 59.337 49.961 1.00 15.90 ? 788 HOH B O 1 +HETATM 21421 O O . HOH T 10 . ? 79.214 50.915 113.558 1.00 12.18 ? 789 HOH B O 1 +HETATM 21422 O O . HOH T 10 . ? 88.583 55.089 108.854 1.00 21.49 ? 790 HOH B O 1 +HETATM 21423 O O . HOH T 10 . ? 84.830 37.184 60.985 1.00 24.28 ? 791 HOH B O 1 +HETATM 21424 O O . HOH T 10 . ? 103.508 33.080 75.880 1.00 31.57 ? 792 HOH B O 1 +HETATM 21425 O O . HOH T 10 . ? 96.109 50.666 97.222 1.00 11.66 ? 793 HOH B O 1 +HETATM 21426 O O . HOH T 10 . ? 65.837 61.469 51.519 1.00 19.93 ? 794 HOH B O 1 +HETATM 21427 O O . HOH T 10 . ? 69.191 40.842 78.030 1.00 10.18 ? 795 HOH B O 1 +HETATM 21428 O O . HOH T 10 . ? 83.481 36.391 103.469 1.00 12.80 ? 796 HOH B O 1 +HETATM 21429 O O . HOH T 10 . ? 69.396 51.878 89.472 1.00 16.07 ? 797 HOH B O 1 +HETATM 21430 O O . HOH T 10 . ? 48.612 47.465 60.649 1.00 11.51 ? 798 HOH B O 1 +HETATM 21431 O O . HOH T 10 . ? 103.251 31.309 94.890 1.00 36.69 ? 799 HOH B O 1 +HETATM 21432 O O . HOH T 10 . ? 70.469 39.369 55.628 1.00 23.99 ? 800 HOH B O 1 +HETATM 21433 O O . HOH T 10 . ? 94.856 39.206 107.886 1.00 30.64 ? 801 HOH B O 1 +HETATM 21434 O O . HOH T 10 . ? 103.800 45.860 50.479 1.00 19.82 ? 802 HOH B O 1 +HETATM 21435 O O . HOH T 10 . ? 65.113 39.204 91.396 1.00 24.89 ? 803 HOH B O 1 +HETATM 21436 O O . HOH T 10 . ? 59.799 53.003 84.555 1.00 18.84 ? 804 HOH B O 1 +HETATM 21437 O O . HOH T 10 . ? 51.734 36.751 60.380 1.00 16.87 ? 805 HOH B O 1 +HETATM 21438 O O . HOH T 10 . ? 88.229 51.337 65.546 1.00 11.98 ? 806 HOH B O 1 +HETATM 21439 O O . HOH T 10 . ? 93.883 42.781 43.490 1.00 20.49 ? 807 HOH B O 1 +HETATM 21440 O O . HOH T 10 . ? 69.120 61.700 82.507 1.00 17.44 ? 808 HOH B O 1 +HETATM 21441 O O . HOH T 10 . ? 51.861 53.795 62.320 1.00 16.59 ? 809 HOH B O 1 +HETATM 21442 O O . HOH T 10 . ? 58.917 40.865 83.251 1.00 14.76 ? 810 HOH B O 1 +HETATM 21443 O O . HOH T 10 . ? 62.341 33.830 72.986 1.00 13.48 ? 811 HOH B O 1 +HETATM 21444 O O . HOH T 10 . ? 93.154 44.162 66.183 1.00 13.91 ? 812 HOH B O 1 +HETATM 21445 O O . HOH T 10 . ? 71.637 55.877 95.947 1.00 14.01 ? 813 HOH B O 1 +HETATM 21446 O O . HOH T 10 . ? 82.782 46.951 66.811 1.00 16.32 ? 814 HOH B O 1 +HETATM 21447 O O . HOH T 10 . ? 76.889 50.827 84.976 1.00 11.99 ? 815 HOH B O 1 +HETATM 21448 O O . HOH T 10 . ? 94.611 56.726 62.085 1.00 21.01 ? 816 HOH B O 1 +HETATM 21449 O O . HOH T 10 . ? 86.380 53.936 105.238 1.00 30.91 ? 817 HOH B O 1 +HETATM 21450 O O . HOH T 10 . ? 86.747 19.614 83.150 1.00 23.86 ? 818 HOH B O 1 +HETATM 21451 O O . HOH T 10 . ? 78.535 29.257 89.952 1.00 13.48 ? 819 HOH B O 1 +HETATM 21452 O O . HOH T 10 . ? 104.995 55.042 61.074 1.00 20.71 ? 820 HOH B O 1 +HETATM 21453 O O . HOH T 10 . ? 69.162 35.136 73.053 1.00 12.51 ? 821 HOH B O 1 +HETATM 21454 O O . HOH T 10 . ? 79.249 48.369 56.270 1.00 14.75 ? 822 HOH B O 1 +HETATM 21455 O O . HOH T 10 . ? 61.380 39.001 79.304 1.00 10.84 ? 823 HOH B O 1 +HETATM 21456 O O . HOH T 10 . ? 74.952 52.670 77.366 1.00 20.56 ? 824 HOH B O 1 +HETATM 21457 O O . HOH T 10 . ? 80.618 46.141 53.789 1.00 14.64 ? 825 HOH B O 1 +HETATM 21458 O O . HOH T 10 . ? 74.089 47.810 107.190 1.00 13.49 ? 826 HOH B O 1 +HETATM 21459 O O . HOH T 10 . ? 77.633 34.083 105.742 1.00 18.14 ? 827 HOH B O 1 +HETATM 21460 O O . HOH T 10 . ? 81.182 45.961 109.802 1.00 24.20 ? 828 HOH B O 1 +HETATM 21461 O O . HOH T 10 . ? 60.543 29.028 79.790 1.00 29.19 ? 829 HOH B O 1 +HETATM 21462 O O . HOH T 10 . ? 104.946 49.115 51.589 1.00 16.51 ? 830 HOH B O 1 +HETATM 21463 O O . HOH T 10 . ? 76.104 66.612 86.659 1.00 21.31 ? 831 HOH B O 1 +HETATM 21464 O O . HOH T 10 . ? 95.423 38.461 101.043 1.00 17.00 ? 832 HOH B O 1 +HETATM 21465 O O . HOH T 10 . ? 65.978 46.669 92.260 1.00 9.04 ? 833 HOH B O 1 +HETATM 21466 O O . HOH T 10 . ? 75.444 48.113 63.503 1.00 18.86 ? 834 HOH B O 1 +HETATM 21467 O O . HOH T 10 . ? 46.898 38.613 84.175 1.00 32.10 ? 835 HOH B O 1 +HETATM 21468 O O . HOH T 10 . ? 92.219 55.302 62.330 1.00 20.27 ? 836 HOH B O 1 +HETATM 21469 O O . HOH T 10 . ? 75.472 42.562 45.153 1.00 22.20 ? 837 HOH B O 1 +HETATM 21470 O O . HOH T 10 . ? 99.804 47.899 83.167 1.00 18.96 ? 838 HOH B O 1 +HETATM 21471 O O . HOH T 10 . ? 71.105 29.160 76.169 1.00 12.08 ? 839 HOH B O 1 +HETATM 21472 O O . HOH T 10 . ? 73.028 36.967 68.268 1.00 10.80 ? 840 HOH B O 1 +HETATM 21473 O O . HOH T 10 . ? 66.853 41.690 91.611 1.00 14.10 ? 841 HOH B O 1 +HETATM 21474 O O . HOH T 10 . ? 98.220 50.828 81.423 1.00 12.69 ? 842 HOH B O 1 +HETATM 21475 O O . HOH T 10 . ? 77.841 45.853 53.219 1.00 13.61 ? 843 HOH B O 1 +HETATM 21476 O O . HOH T 10 . ? 71.950 58.540 92.672 1.00 11.34 ? 844 HOH B O 1 +HETATM 21477 O O . HOH T 10 . ? 86.276 44.757 64.508 1.00 8.97 ? 845 HOH B O 1 +HETATM 21478 O O . HOH T 10 . ? 61.968 61.816 64.683 1.00 18.61 ? 846 HOH B O 1 +HETATM 21479 O O . HOH T 10 . ? 91.622 60.615 94.016 1.00 14.21 ? 847 HOH B O 1 +HETATM 21480 O O . HOH T 10 . ? 74.944 55.767 47.174 1.00 22.42 ? 848 HOH B O 1 +HETATM 21481 O O . HOH T 10 . ? 47.165 43.468 70.995 1.00 13.81 ? 849 HOH B O 1 +HETATM 21482 O O . HOH T 10 . ? 72.469 37.815 99.434 1.00 20.21 ? 850 HOH B O 1 +HETATM 21483 O O . HOH T 10 . ? 72.603 62.558 69.678 1.00 21.40 ? 851 HOH B O 1 +HETATM 21484 O O . HOH T 10 . ? 88.643 63.363 73.989 1.00 11.72 ? 852 HOH B O 1 +HETATM 21485 O O . HOH T 10 . ? 79.902 26.960 90.296 1.00 18.72 ? 853 HOH B O 1 +HETATM 21486 O O . HOH T 10 . ? 99.562 33.384 74.356 1.00 24.05 ? 854 HOH B O 1 +HETATM 21487 O O . HOH T 10 . ? 75.920 55.735 76.396 1.00 27.81 ? 855 HOH B O 1 +HETATM 21488 O O . HOH T 10 . ? 57.643 52.479 79.502 1.00 20.89 ? 856 HOH B O 1 +HETATM 21489 O O . HOH T 10 . ? 68.482 54.740 92.629 1.00 12.63 ? 857 HOH B O 1 +HETATM 21490 O O . HOH T 10 . ? 68.681 56.698 89.171 1.00 22.43 ? 858 HOH B O 1 +HETATM 21491 O O . HOH T 10 . ? 84.238 27.759 62.319 1.00 47.16 ? 859 HOH B O 1 +HETATM 21492 O O . HOH T 10 . ? 47.539 29.767 82.426 1.00 20.85 ? 860 HOH B O 1 +HETATM 21493 O O . HOH T 10 . ? 76.278 42.073 89.935 1.00 15.85 ? 861 HOH B O 1 +HETATM 21494 O O . HOH T 10 . ? 96.070 37.611 56.811 1.00 17.52 ? 862 HOH B O 1 +HETATM 21495 O O . HOH T 10 . ? 92.835 41.987 108.168 1.00 22.50 ? 866 HOH B O 1 +HETATM 21496 O O . HOH T 10 . ? 42.374 34.650 75.937 1.00 28.81 ? 867 HOH B O 1 +HETATM 21497 O O . HOH T 10 . ? 73.751 59.174 66.170 1.00 34.75 ? 868 HOH B O 1 +HETATM 21498 O O . HOH T 10 . ? 75.465 50.519 67.080 1.00 15.90 ? 869 HOH B O 1 +HETATM 21499 O O . HOH T 10 . ? 91.439 30.978 62.751 1.00 22.21 ? 872 HOH B O 1 +HETATM 21500 O O . HOH T 10 . ? 97.485 65.427 57.430 1.00 33.25 ? 888 HOH B O 1 +HETATM 21501 O O . HOH T 10 . ? 48.810 48.523 73.224 1.00 39.41 ? 889 HOH B O 1 +HETATM 21502 O O . HOH T 10 . ? 70.386 35.007 64.362 1.00 15.40 ? 890 HOH B O 1 +HETATM 21503 O O . HOH T 10 . ? 72.934 28.334 77.854 1.00 21.19 ? 891 HOH B O 1 +HETATM 21504 O O . HOH T 10 . ? 86.558 58.063 56.252 1.00 44.72 ? 897 HOH B O 1 +HETATM 21505 O O . HOH T 10 . ? 91.655 49.392 43.098 1.00 16.53 ? 898 HOH B O 1 +HETATM 21506 O O . HOH T 10 . ? 101.760 52.080 83.625 1.00 17.71 ? 900 HOH B O 1 +HETATM 21507 O O . HOH T 10 . ? 51.277 38.667 84.062 1.00 39.06 ? 902 HOH B O 1 +HETATM 21508 O O . HOH T 10 . ? 77.991 52.916 54.290 1.00 13.21 ? 903 HOH B O 1 +HETATM 21509 O O . HOH T 10 . ? 100.552 46.595 100.234 1.00 23.61 ? 905 HOH B O 1 +HETATM 21510 O O . HOH T 10 . ? 87.797 59.279 99.325 1.00 20.75 ? 907 HOH B O 1 +HETATM 21511 O O . HOH T 10 . ? 100.540 31.245 95.775 1.00 17.51 ? 918 HOH B O 1 +HETATM 21512 O O . HOH T 10 . ? 70.364 37.901 60.773 1.00 17.70 ? 922 HOH B O 1 +HETATM 21513 O O . HOH T 10 . ? 46.490 45.929 59.613 1.00 19.30 ? 927 HOH B O 1 +HETATM 21514 O O . HOH T 10 . ? 77.204 39.811 110.426 1.00 28.94 ? 930 HOH B O 1 +HETATM 21515 O O . HOH T 10 . ? 73.038 56.045 44.769 1.00 28.71 ? 932 HOH B O 1 +HETATM 21516 O O . HOH T 10 . ? 67.806 38.552 54.990 1.00 28.63 ? 941 HOH B O 1 +HETATM 21517 O O . HOH T 10 . ? 86.383 56.615 105.294 1.00 24.06 ? 942 HOH B O 1 +HETATM 21518 O O . HOH T 10 . ? 75.650 40.722 47.220 1.00 22.85 ? 955 HOH B O 1 +HETATM 21519 O O . HOH T 10 . ? 98.923 50.483 100.405 1.00 39.69 ? 957 HOH B O 1 +HETATM 21520 O O . HOH T 10 . ? 47.029 39.195 50.840 1.00 33.98 ? 959 HOH B O 1 +HETATM 21521 O O . HOH T 10 . ? 73.622 32.994 88.101 1.00 16.57 ? 964 HOH B O 1 +HETATM 21522 O O . HOH T 10 . ? 82.527 32.529 103.837 1.00 23.00 ? 965 HOH B O 1 +HETATM 21523 O O . HOH T 10 . ? 65.176 53.742 85.354 1.00 22.96 ? 966 HOH B O 1 +HETATM 21524 O O . HOH T 10 . ? 102.771 40.823 94.470 1.00 24.59 ? 969 HOH B O 1 +HETATM 21525 O O . HOH T 10 . ? 74.016 39.122 61.866 1.00 17.86 ? 971 HOH B O 1 +HETATM 21526 O O . HOH T 10 . ? 58.662 47.581 48.060 1.00 36.64 ? 977 HOH B O 1 +HETATM 21527 O O . HOH T 10 . ? 83.753 58.712 103.410 1.00 20.02 ? 981 HOH B O 1 +HETATM 21528 O O . HOH T 10 . ? 54.584 43.339 48.555 1.00 37.00 ? 982 HOH B O 1 +HETATM 21529 O O . HOH T 10 . ? 70.242 52.724 36.466 1.00 26.01 ? 987 HOH B O 1 +HETATM 21530 O O . HOH T 10 . ? 85.891 55.889 54.635 1.00 24.82 ? 994 HOH B O 1 +HETATM 21531 O O . HOH T 10 . ? 54.034 38.890 82.351 1.00 21.59 ? 996 HOH B O 1 +HETATM 21532 O O . HOH T 10 . ? 105.358 40.332 67.610 1.00 15.60 ? 1003 HOH B O 1 +HETATM 21533 O O . HOH T 10 . ? 54.855 34.057 69.649 1.00 14.53 ? 1010 HOH B O 1 +HETATM 21534 O O . HOH T 10 . ? 72.633 18.631 87.219 1.00 36.55 ? 1012 HOH B O 1 +HETATM 21535 O O . HOH T 10 . ? 90.300 49.031 105.514 1.00 19.03 ? 1015 HOH B O 1 +HETATM 21536 O O . HOH T 10 . ? 92.220 35.794 61.823 1.00 22.02 ? 1018 HOH B O 1 +HETATM 21537 O O . HOH T 10 . ? 44.431 33.440 74.886 1.00 37.49 ? 1023 HOH B O 1 +HETATM 21538 O O . HOH T 10 . ? 68.110 60.624 58.418 1.00 50.44 ? 1033 HOH B O 1 +HETATM 21539 O O . HOH T 10 . ? 97.127 29.360 103.886 1.00 41.39 ? 1037 HOH B O 1 +HETATM 21540 O O . HOH T 10 . ? 105.972 50.702 77.632 1.00 34.62 ? 1039 HOH B O 1 +HETATM 21541 O O . HOH T 10 . ? 85.835 56.913 65.952 1.00 32.62 ? 1040 HOH B O 1 +HETATM 21542 O O . HOH T 10 . ? 89.097 54.463 104.379 1.00 37.43 ? 1043 HOH B O 1 +HETATM 21543 O O . HOH T 10 . ? 57.955 38.817 84.794 1.00 21.09 ? 1050 HOH B O 1 +HETATM 21544 O O . HOH T 10 . ? 68.687 61.740 44.245 1.00 26.74 ? 1051 HOH B O 1 +HETATM 21545 O O . HOH T 10 . ? 91.771 60.096 97.573 1.00 50.91 ? 1057 HOH B O 1 +HETATM 21546 O O . HOH T 10 . ? 51.051 52.148 76.910 1.00 32.03 ? 1061 HOH B O 1 +HETATM 21547 O O . HOH T 10 . ? 44.910 44.336 74.081 1.00 45.86 ? 1062 HOH B O 1 +HETATM 21548 O O . HOH T 10 . ? 87.329 55.035 52.608 1.00 26.36 ? 1075 HOH B O 1 +HETATM 21549 O O . HOH T 10 . ? 46.273 31.735 88.407 1.00 19.35 ? 1077 HOH B O 1 +HETATM 21550 O O . HOH T 10 . ? 74.276 50.740 64.677 1.00 21.19 ? 1083 HOH B O 1 +HETATM 21551 O O . HOH T 10 . ? 61.238 41.135 81.305 1.00 20.86 ? 1086 HOH B O 1 +HETATM 21552 O O . HOH T 10 . ? 81.440 25.747 92.605 1.00 22.11 ? 1089 HOH B O 1 +HETATM 21553 O O . HOH T 10 . ? 78.882 38.657 90.816 1.00 17.54 ? 1099 HOH B O 1 +HETATM 21554 O O . HOH T 10 . ? 102.556 47.657 82.399 1.00 40.53 ? 1111 HOH B O 1 +HETATM 21555 O O . HOH T 10 . ? 45.894 31.198 85.446 1.00 23.42 ? 1115 HOH B O 1 +HETATM 21556 O O . HOH T 10 . ? 89.799 62.490 79.326 1.00 25.20 ? 1116 HOH B O 1 +HETATM 21557 O O . HOH T 10 . ? 94.036 38.873 44.951 1.00 23.70 ? 1128 HOH B O 1 +HETATM 21558 O O . HOH T 10 . ? 54.448 27.361 83.003 1.00 16.29 ? 1134 HOH B O 1 +HETATM 21559 O O . HOH T 10 . ? 88.765 52.329 42.287 1.00 30.03 ? 1135 HOH B O 1 +HETATM 21560 O O . HOH T 10 . ? 45.007 42.274 72.263 1.00 36.50 ? 1143 HOH B O 1 +HETATM 21561 O O . HOH T 10 . ? 68.795 64.134 42.753 1.00 41.05 ? 1145 HOH B O 1 +HETATM 21562 O O . HOH T 10 . ? 63.042 61.448 47.647 1.00 31.20 ? 1147 HOH B O 1 +HETATM 21563 O O . HOH T 10 . ? 77.722 56.363 60.825 1.00 40.50 ? 1149 HOH B O 1 +HETATM 21564 O O . HOH T 10 . ? 96.851 44.876 106.856 1.00 27.40 ? 1154 HOH B O 1 +HETATM 21565 O O . HOH T 10 . ? 58.737 58.395 62.575 1.00 24.14 ? 1160 HOH B O 1 +HETATM 21566 O O . HOH T 10 . ? 97.068 48.758 99.084 1.00 15.48 ? 1164 HOH B O 1 +HETATM 21567 O O . HOH T 10 . ? 80.286 57.019 60.796 1.00 57.14 ? 1167 HOH B O 1 +HETATM 21568 O O . HOH T 10 . ? 76.004 52.365 74.919 1.00 22.19 ? 1169 HOH B O 1 +HETATM 21569 O O . HOH T 10 . ? 84.225 54.547 60.501 1.00 41.81 ? 1175 HOH B O 1 +HETATM 21570 O O . HOH T 10 . ? 110.040 56.412 63.417 1.00 38.95 ? 1176 HOH B O 1 +HETATM 21571 O O . HOH T 10 . ? 45.469 36.858 69.697 1.00 16.77 ? 1181 HOH B O 1 +HETATM 21572 O O . HOH T 10 . ? 64.876 56.080 84.813 1.00 23.63 ? 1185 HOH B O 1 +HETATM 21573 O O . HOH T 10 . ? 92.656 32.135 70.817 1.00 13.51 ? 1187 HOH B O 1 +HETATM 21574 O O . HOH T 10 . ? 81.442 53.854 43.932 1.00 24.81 ? 1190 HOH B O 1 +HETATM 21575 O O . HOH T 10 . ? 98.084 40.330 66.962 1.00 18.86 ? 1191 HOH B O 1 +HETATM 21576 O O . HOH T 10 . ? 103.509 50.334 82.831 1.00 38.02 ? 1194 HOH B O 1 +HETATM 21577 O O . HOH T 10 . ? 51.120 37.609 55.281 1.00 32.13 ? 1196 HOH B O 1 +HETATM 21578 O O . HOH T 10 . ? 102.418 38.762 61.415 1.00 25.20 ? 1208 HOH B O 1 +HETATM 21579 O O . HOH T 10 . ? 53.734 37.201 55.672 1.00 39.25 ? 1210 HOH B O 1 +HETATM 21580 O O . HOH T 10 . ? 102.291 42.522 85.944 1.00 46.01 ? 1216 HOH B O 1 +HETATM 21581 O O . HOH T 10 . ? 98.410 37.896 65.230 1.00 34.36 ? 1225 HOH B O 1 +HETATM 21582 O O . HOH T 10 . ? 77.353 53.466 61.342 1.00 30.15 ? 1227 HOH B O 1 +HETATM 21583 O O . HOH T 10 . ? 106.333 55.492 84.674 1.00 38.91 ? 1229 HOH B O 1 +HETATM 21584 O O . HOH T 10 . ? 75.855 53.209 79.816 1.00 32.91 ? 1232 HOH B O 1 +HETATM 21585 O O . HOH T 10 . ? 90.925 63.928 83.963 1.00 22.78 ? 1242 HOH B O 1 +HETATM 21586 O O . HOH T 10 . ? 96.707 32.461 74.878 1.00 49.17 ? 1248 HOH B O 1 +HETATM 21587 O O . HOH T 10 . ? 103.027 46.440 98.905 1.00 42.31 ? 1249 HOH B O 1 +HETATM 21588 O O . HOH T 10 . ? 92.643 56.427 45.395 1.00 41.50 ? 1253 HOH B O 1 +HETATM 21589 O O . HOH T 10 . ? 71.206 35.435 61.804 1.00 30.89 ? 1255 HOH B O 1 +HETATM 21590 O O . HOH T 10 . ? 106.462 53.936 59.077 1.00 25.54 ? 1258 HOH B O 1 +HETATM 21591 O O . HOH T 10 . ? 83.526 55.991 44.712 1.00 47.76 ? 1259 HOH B O 1 +HETATM 21592 O O . HOH T 10 . ? 53.405 51.560 53.334 1.00 26.78 ? 1261 HOH B O 1 +HETATM 21593 O O . HOH T 10 . ? 90.812 25.481 75.223 1.00 22.71 ? 1267 HOH B O 1 +HETATM 21594 O O . HOH T 10 . ? 77.001 39.194 56.243 1.00 32.72 ? 1269 HOH B O 1 +HETATM 21595 O O . HOH T 10 . ? 54.428 31.305 66.496 1.00 44.95 ? 1277 HOH B O 1 +HETATM 21596 O O . HOH T 10 . ? 77.645 49.595 41.595 1.00 20.98 ? 1278 HOH B O 1 +HETATM 21597 O O . HOH T 10 . ? 70.384 46.047 82.024 1.00 6.73 ? 1285 HOH B O 1 +HETATM 21598 O O . HOH T 10 . ? 90.926 41.885 105.921 1.00 10.17 ? 1286 HOH B O 1 +HETATM 21599 O O . HOH T 10 . ? 55.407 36.173 91.147 1.00 15.01 ? 1287 HOH B O 1 +HETATM 21600 O O . HOH T 10 . ? 98.261 39.023 69.428 1.00 16.47 ? 1291 HOH B O 1 +HETATM 21601 O O . HOH T 10 . ? 94.817 38.826 58.906 1.00 11.70 ? 1297 HOH B O 1 +HETATM 21602 O O . HOH T 10 . ? 81.642 57.376 58.401 1.00 31.55 ? 1300 HOH B O 1 +HETATM 21603 O O . HOH T 10 . ? 69.311 33.481 83.674 1.00 11.87 ? 1302 HOH B O 1 +HETATM 21604 O O . HOH T 10 . ? 71.258 51.419 91.107 1.00 11.21 ? 1304 HOH B O 1 +HETATM 21605 O O . HOH T 10 . ? 74.677 55.899 109.931 1.00 14.33 ? 1306 HOH B O 1 +HETATM 21606 O O . HOH T 10 . ? 91.429 37.501 63.890 1.00 16.09 ? 1312 HOH B O 1 +HETATM 21607 O O . HOH T 10 . ? 85.320 56.927 68.249 1.00 15.39 ? 1315 HOH B O 1 +HETATM 21608 O O . HOH T 10 . ? 52.692 57.055 79.817 1.00 18.44 ? 1319 HOH B O 1 +HETATM 21609 O O . HOH T 10 . ? 48.383 31.283 84.763 1.00 20.91 ? 1322 HOH B O 1 +HETATM 21610 O O . HOH T 10 . ? 71.097 38.384 73.996 1.00 14.59 ? 1323 HOH B O 1 +HETATM 21611 O O . HOH T 10 . ? 67.627 58.228 71.269 1.00 16.59 ? 1324 HOH B O 1 +HETATM 21612 O O . HOH T 10 . ? 72.676 44.389 45.551 1.00 23.95 ? 1326 HOH B O 1 +HETATM 21613 O O . HOH T 10 . ? 96.330 42.156 65.763 1.00 17.37 ? 1329 HOH B O 1 +HETATM 21614 O O . HOH T 10 . ? 88.349 54.066 66.207 1.00 19.79 ? 1331 HOH B O 1 +HETATM 21615 O O . HOH T 10 . ? 106.335 56.646 77.269 1.00 24.25 ? 1338 HOH B O 1 +HETATM 21616 O O . HOH T 10 . ? 87.350 28.343 95.734 1.00 16.95 ? 1340 HOH B O 1 +HETATM 21617 O O . HOH T 10 . ? 83.208 41.844 59.123 1.00 23.22 ? 1342 HOH B O 1 +HETATM 21618 O O . HOH T 10 . ? 78.531 37.619 111.660 1.00 25.62 ? 1343 HOH B O 1 +HETATM 21619 O O . HOH T 10 . ? 67.328 22.842 85.152 1.00 20.84 ? 1344 HOH B O 1 +HETATM 21620 O O . HOH T 10 . ? 105.393 36.770 86.921 1.00 29.72 ? 1352 HOH B O 1 +HETATM 21621 O O . HOH T 10 . ? 95.866 59.439 69.572 1.00 21.33 ? 1361 HOH B O 1 +HETATM 21622 O O . HOH T 10 . ? 77.049 54.331 47.051 1.00 42.01 ? 1365 HOH B O 1 +HETATM 21623 O O . HOH T 10 . ? 71.552 58.331 97.718 1.00 19.16 ? 1366 HOH B O 1 +HETATM 21624 O O . HOH T 10 . ? 103.705 54.599 92.289 1.00 24.20 ? 1368 HOH B O 1 +HETATM 21625 O O . HOH T 10 . ? 55.109 45.164 88.284 1.00 28.15 ? 1378 HOH B O 1 +HETATM 21626 O O . HOH T 10 . ? 93.725 41.749 65.452 1.00 21.65 ? 1380 HOH B O 1 +HETATM 21627 O O . HOH T 10 . ? 53.292 43.410 51.675 1.00 34.02 ? 1387 HOH B O 1 +HETATM 21628 O O . HOH T 10 . ? 68.077 43.193 47.082 1.00 26.77 ? 1388 HOH B O 1 +HETATM 21629 O O . HOH T 10 . ? 52.601 44.343 86.111 1.00 41.76 ? 1390 HOH B O 1 +HETATM 21630 O O . HOH T 10 . ? 94.394 46.762 107.109 1.00 26.37 ? 1395 HOH B O 1 +HETATM 21631 O O . HOH T 10 . ? 100.690 48.773 102.108 1.00 23.97 ? 1397 HOH B O 1 +HETATM 21632 O O . HOH T 10 . ? 88.188 64.318 76.573 1.00 20.48 ? 1398 HOH B O 1 +HETATM 21633 O O . HOH T 10 . ? 82.814 56.215 68.711 1.00 23.10 ? 1406 HOH B O 1 +HETATM 21634 O O . HOH T 10 . ? 106.258 35.408 82.057 1.00 25.67 ? 1410 HOH B O 1 +HETATM 21635 O O . HOH T 10 . ? 48.192 45.412 72.703 1.00 15.27 ? 1414 HOH B O 1 +HETATM 21636 O O . HOH T 10 . ? 52.542 34.292 60.864 1.00 36.54 ? 1417 HOH B O 1 +HETATM 21637 O O . HOH T 10 . ? 43.881 38.314 74.120 1.00 25.59 ? 1426 HOH B O 1 +HETATM 21638 O O . HOH T 10 . ? 93.101 33.411 62.171 1.00 24.20 ? 1429 HOH B O 1 +HETATM 21639 O O . HOH T 10 . ? 101.500 46.812 42.652 1.00 28.23 ? 1433 HOH B O 1 +HETATM 21640 O O . HOH T 10 . ? 107.133 45.171 52.071 1.00 25.04 ? 1440 HOH B O 1 +HETATM 21641 O O . HOH T 10 . ? 73.226 20.217 82.514 1.00 25.58 ? 1443 HOH B O 1 +HETATM 21642 O O . HOH T 10 . ? 90.459 58.173 99.521 1.00 29.60 ? 1448 HOH B O 1 +HETATM 21643 O O . HOH T 10 . ? 59.263 34.285 90.098 1.00 35.46 ? 1456 HOH B O 1 +HETATM 21644 O O . HOH T 10 . ? 91.196 38.037 110.282 1.00 29.00 ? 1457 HOH B O 1 +HETATM 21645 O O . HOH T 10 . ? 75.379 53.016 64.551 1.00 20.92 ? 1461 HOH B O 1 +HETATM 21646 O O . HOH T 10 . ? 104.740 38.796 73.613 1.00 20.05 ? 1462 HOH B O 1 +HETATM 21647 O O . HOH T 10 . ? 71.383 36.211 103.610 1.00 37.98 ? 1467 HOH B O 1 +HETATM 21648 O O . HOH T 10 . ? 54.481 36.426 52.475 1.00 40.69 ? 1469 HOH B O 1 +HETATM 21649 O O . HOH T 10 . ? 78.020 44.033 40.855 1.00 26.26 ? 1472 HOH B O 1 +HETATM 21650 O O . HOH T 10 . ? 85.966 50.652 60.498 1.00 22.92 ? 1474 HOH B O 1 +HETATM 21651 O O . HOH T 10 . ? 63.466 38.429 85.792 1.00 25.29 ? 1485 HOH B O 1 +HETATM 21652 O O . HOH T 10 . ? 106.207 45.449 49.677 1.00 25.51 ? 1492 HOH B O 1 +HETATM 21653 O O . HOH T 10 . ? 93.044 65.358 76.854 1.00 33.52 ? 1493 HOH B O 1 +HETATM 21654 O O . HOH T 10 . ? 102.351 36.334 60.189 1.00 29.46 ? 1495 HOH B O 1 +HETATM 21655 O O . HOH T 10 . ? 83.477 49.324 64.988 1.00 22.19 ? 1506 HOH B O 1 +HETATM 21656 O O . HOH T 10 . ? 89.781 45.772 108.777 1.00 29.92 ? 1510 HOH B O 1 +HETATM 21657 O O . HOH T 10 . ? 88.881 36.249 63.701 1.00 23.24 ? 1511 HOH B O 1 +HETATM 21658 O O . HOH T 10 . ? 67.398 54.088 89.362 1.00 26.32 ? 1513 HOH B O 1 +HETATM 21659 O O . HOH T 10 . ? 83.626 52.321 60.100 1.00 30.30 ? 1517 HOH B O 1 +HETATM 21660 O O . HOH T 10 . ? 99.602 43.780 101.121 1.00 24.68 ? 1525 HOH B O 1 +HETATM 21661 O O . HOH T 10 . ? 86.500 60.112 101.399 1.00 32.48 ? 1528 HOH B O 1 +HETATM 21662 O O . HOH T 10 . ? 83.936 37.002 55.149 1.00 30.57 ? 1530 HOH B O 1 +HETATM 21663 O O . HOH T 10 . ? 96.962 60.830 75.134 1.00 26.55 ? 1536 HOH B O 1 +HETATM 21664 O O . HOH T 10 . ? 94.437 52.082 100.616 1.00 42.97 ? 1538 HOH B O 1 +HETATM 21665 O O . HOH T 10 . ? 88.108 39.223 55.664 1.00 21.20 ? 1539 HOH B O 1 +HETATM 21666 O O . HOH T 10 . ? 89.312 46.335 37.836 1.00 25.40 ? 1546 HOH B O 1 +HETATM 21667 O O . HOH T 10 . ? 104.938 32.240 88.952 1.00 34.79 ? 1548 HOH B O 1 +HETATM 21668 O O . HOH T 10 . ? 102.807 49.931 86.422 1.00 26.35 ? 1549 HOH B O 1 +HETATM 21669 O O . HOH T 10 . ? 77.987 55.070 78.617 1.00 43.32 ? 1550 HOH B O 1 +HETATM 21670 O O . HOH T 10 . ? 76.343 22.345 68.422 1.00 46.91 ? 1551 HOH B O 1 +HETATM 21671 O O . HOH T 10 . ? 107.124 53.841 55.720 1.00 26.63 ? 1559 HOH B O 1 +HETATM 21672 O O . HOH T 10 . ? 97.253 40.151 102.363 1.00 21.93 ? 1564 HOH B O 1 +HETATM 21673 O O . HOH T 10 . ? 65.573 38.686 89.122 1.00 39.32 ? 1569 HOH B O 1 +HETATM 21674 O O . HOH T 10 . ? 102.810 56.476 70.211 1.00 23.09 ? 1570 HOH B O 1 +HETATM 21675 O O . HOH T 10 . ? 78.941 58.808 47.252 1.00 35.07 ? 1571 HOH B O 1 +HETATM 21676 O O . HOH T 10 . ? 61.091 44.851 88.684 1.00 21.92 ? 1572 HOH B O 1 +HETATM 21677 O O . HOH T 10 . ? 74.412 55.769 78.606 1.00 21.84 ? 1573 HOH B O 1 +HETATM 21678 O O . HOH T 10 . ? 48.253 48.417 49.393 1.00 40.99 ? 1585 HOH B O 1 +HETATM 21679 O O . HOH T 10 . ? 44.580 47.449 58.098 1.00 19.36 ? 1586 HOH B O 1 +HETATM 21680 O O . HOH T 10 . ? 63.369 31.350 73.072 1.00 29.44 ? 1587 HOH B O 1 +HETATM 21681 O O . HOH T 10 . ? 43.780 35.457 81.305 1.00 31.31 ? 1588 HOH B O 1 +HETATM 21682 O O . HOH T 10 . ? 71.140 40.636 52.483 1.00 24.07 ? 1595 HOH B O 1 +HETATM 21683 O O . HOH T 10 . ? 86.691 28.012 63.303 1.00 31.70 ? 1596 HOH B O 1 +HETATM 21684 O O . HOH T 10 . ? 47.426 39.018 78.597 1.00 33.43 ? 1598 HOH B O 1 +HETATM 21685 O O . HOH T 10 . ? 98.001 58.245 93.239 1.00 23.61 ? 1600 HOH B O 1 +HETATM 21686 O O . HOH T 10 . ? 68.922 32.456 64.118 1.00 29.39 ? 1601 HOH B O 1 +HETATM 21687 O O . HOH T 10 . ? 88.615 57.059 51.417 1.00 34.95 ? 1602 HOH B O 1 +HETATM 21688 O O . HOH T 10 . ? 74.315 55.457 63.450 1.00 24.26 ? 1604 HOH B O 1 +HETATM 21689 O O . HOH T 10 . ? 101.140 58.780 89.579 1.00 33.52 ? 1605 HOH B O 1 +HETATM 21690 O O . HOH T 10 . ? 47.438 49.412 71.054 1.00 26.66 ? 1607 HOH B O 1 +HETATM 21691 O O . HOH T 10 . ? 113.122 52.533 63.352 1.00 38.76 ? 1608 HOH B O 1 +HETATM 21692 O O . HOH T 10 . ? 104.970 40.035 86.439 1.00 28.12 ? 1609 HOH B O 1 +HETATM 21693 O O . HOH T 10 . ? 93.396 36.388 46.069 1.00 29.70 ? 1613 HOH B O 1 +HETATM 21694 O O . HOH T 10 . ? 105.217 41.040 70.313 1.00 24.98 ? 1616 HOH B O 1 +HETATM 21695 O O . HOH T 10 . ? 96.625 35.790 64.113 1.00 26.21 ? 1618 HOH B O 1 +HETATM 21696 O O . HOH T 10 . ? 74.537 36.372 100.630 1.00 23.21 ? 1624 HOH B O 1 +HETATM 21697 O O . HOH T 10 . ? 73.737 18.611 84.902 1.00 32.99 ? 1625 HOH B O 1 +HETATM 21698 O O . HOH T 10 . ? 45.383 43.744 60.705 1.00 24.49 ? 1626 HOH B O 1 +HETATM 21699 O O . HOH T 10 . ? 80.437 48.671 113.011 1.00 20.32 ? 1629 HOH B O 1 +HETATM 21700 O O . HOH T 10 . ? 110.773 44.035 68.858 1.00 32.44 ? 1630 HOH B O 1 +HETATM 21701 O O . HOH T 10 . ? 111.978 49.628 61.123 1.00 23.49 ? 1631 HOH B O 1 +HETATM 21702 O O . HOH T 10 . ? 94.764 63.764 78.034 1.00 37.16 ? 1636 HOH B O 1 +HETATM 21703 O O . HOH T 10 . ? 73.723 50.627 73.230 1.00 18.13 ? 1644 HOH B O 1 +HETATM 21704 O O . HOH T 10 . ? 92.431 57.799 48.325 1.00 33.73 ? 1648 HOH B O 1 +HETATM 21705 O O . HOH T 10 . ? 63.168 27.460 74.752 1.00 31.89 ? 1653 HOH B O 1 +HETATM 21706 O O . HOH T 10 . ? 101.001 36.503 70.948 1.00 33.23 ? 1664 HOH B O 1 +HETATM 21707 O O . HOH T 10 . ? 90.134 55.847 64.250 1.00 34.26 ? 1673 HOH B O 1 +HETATM 21708 O O . HOH T 10 . ? 69.314 55.843 36.507 1.00 31.13 ? 1676 HOH B O 1 +HETATM 21709 O O . HOH T 10 . ? 89.438 39.218 39.884 1.00 34.47 ? 1682 HOH B O 1 +HETATM 21710 O O . HOH T 10 . ? 94.197 26.369 101.793 1.00 32.06 ? 1690 HOH B O 1 +HETATM 21711 O O . HOH T 10 . ? 94.867 28.863 102.622 1.00 43.65 ? 1697 HOH B O 1 +HETATM 21712 O O . HOH T 10 . ? 108.513 38.749 80.638 1.00 36.44 ? 1706 HOH B O 1 +HETATM 21713 O O . HOH T 10 . ? 105.085 40.465 96.108 1.00 23.20 ? 1711 HOH B O 1 +HETATM 21714 O O . HOH T 10 . ? 95.165 59.936 65.758 1.00 33.45 ? 1714 HOH B O 1 +HETATM 21715 O O . HOH T 10 . ? 52.923 43.306 81.303 1.00 24.61 ? 1715 HOH B O 1 +HETATM 21716 O O . HOH T 10 . ? 98.987 57.927 70.029 1.00 38.99 ? 1716 HOH B O 1 +HETATM 21717 O O . HOH T 10 . ? 99.780 56.882 47.143 1.00 53.25 ? 1717 HOH B O 1 +HETATM 21718 O O . HOH T 10 . ? 42.917 36.327 63.177 1.00 22.18 ? 1732 HOH B O 1 +HETATM 21719 O O . HOH T 10 . ? 49.812 34.509 78.272 1.00 20.32 ? 1733 HOH B O 1 +HETATM 21720 O O . HOH T 10 . ? 49.672 33.334 64.627 1.00 39.65 ? 1735 HOH B O 1 +HETATM 21721 O O . HOH T 10 . ? 51.688 25.766 85.373 1.00 34.20 ? 1745 HOH B O 1 +HETATM 21722 O O . HOH T 10 . ? 104.986 30.586 77.516 1.00 43.03 ? 1747 HOH B O 1 +HETATM 21723 O O . HOH T 10 . ? 55.489 35.002 65.080 1.00 36.95 ? 1749 HOH B O 1 +HETATM 21724 O O . HOH T 10 . ? 95.529 45.988 42.572 1.00 26.42 ? 1750 HOH B O 1 +HETATM 21725 O O . HOH T 10 . ? 43.096 34.626 71.311 1.00 23.41 ? 1751 HOH B O 1 +HETATM 21726 O O . HOH T 10 . ? 78.576 61.539 59.233 1.00 40.19 ? 1752 HOH B O 1 +HETATM 21727 O O . HOH T 10 . ? 69.880 57.028 94.222 1.00 25.54 ? 1755 HOH B O 1 +HETATM 21728 O O . HOH T 10 . ? 53.749 31.091 94.406 1.00 30.34 ? 1766 HOH B O 1 +HETATM 21729 O O . HOH T 10 . ? 99.167 45.364 105.680 1.00 39.81 ? 1767 HOH B O 1 +HETATM 21730 O O . HOH T 10 . ? 105.264 43.094 52.430 1.00 18.48 ? 1772 HOH B O 1 +HETATM 21731 O O . HOH T 10 . ? 53.233 33.560 71.641 1.00 17.47 ? 1774 HOH B O 1 +HETATM 21732 O O . HOH T 10 . ? 96.632 62.162 65.969 1.00 37.35 ? 1777 HOH B O 1 +HETATM 21733 O O . HOH T 10 . ? 93.352 19.944 86.998 1.00 46.70 ? 1779 HOH B O 1 +HETATM 21734 O O . HOH T 10 . ? 70.479 38.087 101.503 1.00 25.13 ? 1784 HOH B O 1 +HETATM 21735 O O . HOH T 10 . ? 50.193 29.181 91.266 1.00 25.33 ? 1786 HOH B O 1 +HETATM 21736 O O . HOH T 10 . ? 89.385 36.605 52.621 1.00 32.84 ? 1788 HOH B O 1 +HETATM 21737 O O . HOH T 10 . ? 68.342 37.175 100.654 1.00 23.95 ? 1792 HOH B O 1 +HETATM 21738 O O . HOH T 10 . ? 43.411 40.311 72.061 1.00 25.33 ? 1793 HOH B O 1 +HETATM 21739 O O . HOH T 10 . ? 77.362 48.415 38.977 1.00 26.21 ? 1799 HOH B O 1 +HETATM 21740 O O . HOH T 10 . ? 102.110 37.301 101.062 1.00 38.08 ? 1802 HOH B O 1 +HETATM 21741 O O . HOH T 10 . ? 73.848 36.431 62.030 1.00 20.17 ? 1805 HOH B O 1 +HETATM 21742 O O . HOH T 10 . ? 91.113 58.379 65.437 1.00 30.70 ? 1807 HOH B O 1 +HETATM 21743 O O . HOH T 10 . ? 42.189 38.888 66.687 1.00 46.53 ? 1808 HOH B O 1 +HETATM 21744 O O . HOH T 10 . ? 83.437 34.899 63.277 1.00 25.64 ? 1810 HOH B O 1 +HETATM 21745 O O . HOH T 10 . ? 55.639 46.115 48.777 1.00 34.73 ? 1812 HOH B O 1 +HETATM 21746 O O . HOH T 10 . ? 88.850 52.376 106.150 1.00 31.55 ? 1813 HOH B O 1 +HETATM 21747 O O . HOH T 10 . ? 65.431 30.030 71.437 1.00 30.90 ? 1816 HOH B O 1 +HETATM 21748 O O . HOH T 10 . ? 52.011 34.761 99.002 1.00 37.52 ? 1821 HOH B O 1 +HETATM 21749 O O . HOH T 10 . ? 93.464 58.989 62.949 1.00 39.50 ? 1823 HOH B O 1 +HETATM 21750 O O . HOH T 10 . ? 91.834 44.350 108.912 1.00 42.88 ? 1830 HOH B O 1 +HETATM 21751 O O . HOH T 10 . ? 50.418 56.004 56.738 1.00 31.98 ? 1833 HOH B O 1 +HETATM 21752 O O . HOH T 10 . ? 63.792 52.192 86.129 1.00 19.82 ? 1834 HOH B O 1 +HETATM 21753 O O . HOH T 10 . ? 76.218 17.572 84.428 1.00 29.81 ? 1835 HOH B O 1 +HETATM 21754 O O . HOH T 10 . ? 67.985 38.152 88.817 1.00 27.09 ? 1837 HOH B O 1 +HETATM 21755 O O . HOH T 10 . ? 54.805 33.961 77.969 1.00 14.05 ? 1843 HOH B O 1 +HETATM 21756 O O . HOH T 10 . ? 88.340 20.665 87.443 1.00 27.03 ? 1849 HOH B O 1 +HETATM 21757 O O . HOH T 10 . ? 77.967 43.837 56.406 1.00 33.63 ? 1852 HOH B O 1 +HETATM 21758 O O . HOH T 10 . ? 45.413 45.118 68.682 1.00 33.66 ? 1855 HOH B O 1 +HETATM 21759 O O . HOH T 10 . ? 91.551 40.072 63.579 1.00 16.50 ? 1856 HOH B O 1 +HETATM 21760 O O . HOH T 10 . ? 98.725 43.335 103.989 1.00 20.52 ? 1859 HOH B O 1 +HETATM 21761 O O . HOH T 10 . ? 54.623 47.620 87.970 1.00 48.52 ? 1863 HOH B O 1 +HETATM 21762 O O . HOH T 10 . ? 102.212 57.581 83.515 1.00 35.13 ? 1864 HOH B O 1 +HETATM 21763 O O . HOH T 10 . ? 103.550 60.452 89.064 1.00 49.13 ? 1878 HOH B O 1 +HETATM 21764 O O . HOH T 10 . ? 85.303 44.376 110.982 1.00 30.96 ? 1879 HOH B O 1 +HETATM 21765 O O . HOH T 10 . ? 109.036 48.760 68.608 1.00 41.58 ? 1883 HOH B O 1 +HETATM 21766 O O . HOH T 10 . ? 93.225 50.613 104.921 1.00 46.13 ? 1886 HOH B O 1 +HETATM 21767 O O . HOH T 10 . ? 58.490 45.184 49.442 1.00 36.50 ? 1892 HOH B O 1 +HETATM 21768 O O . HOH T 10 . ? 83.924 58.203 57.119 1.00 32.33 ? 1895 HOH B O 1 +HETATM 21769 O O . HOH T 10 . ? 67.148 33.670 62.504 1.00 34.65 ? 1900 HOH B O 1 +HETATM 21770 O O . HOH T 10 . ? 100.577 38.043 68.850 1.00 34.05 ? 1904 HOH B O 1 +HETATM 21771 O O . HOH T 10 . ? 79.089 51.333 79.121 1.00 21.75 ? 1909 HOH B O 1 +HETATM 21772 O O . HOH T 10 . ? 71.310 45.623 43.589 1.00 46.28 ? 1914 HOH B O 1 +HETATM 21773 O O . HOH T 10 . ? 99.646 36.266 101.462 1.00 36.72 ? 1915 HOH B O 1 +HETATM 21774 O O . HOH T 10 . ? 60.808 30.258 72.273 1.00 27.13 ? 1917 HOH B O 1 +HETATM 21775 O O . HOH T 10 . ? 45.648 54.210 65.390 1.00 21.77 ? 1933 HOH B O 1 +HETATM 21776 O O . HOH T 10 . ? 62.105 40.097 90.758 1.00 31.17 ? 1937 HOH B O 1 +HETATM 21777 O O . HOH T 10 . ? 86.289 54.279 107.739 1.00 28.97 ? 1946 HOH B O 1 +HETATM 21778 O O . HOH T 10 . ? 94.370 60.933 98.173 1.00 45.23 ? 1948 HOH B O 1 +HETATM 21779 O O . HOH T 10 . ? 90.008 58.125 49.529 1.00 40.95 ? 1949 HOH B O 1 +HETATM 21780 O O . HOH T 10 . ? 100.249 54.296 47.823 1.00 35.73 ? 1950 HOH B O 1 +HETATM 21781 O O . HOH T 10 . ? 82.017 47.223 64.349 1.00 27.84 ? 1956 HOH B O 1 +HETATM 21782 O O . HOH T 10 . ? 42.102 35.074 91.100 1.00 24.93 ? 1963 HOH B O 1 +HETATM 21783 O O . HOH T 10 . ? 57.268 33.176 65.721 1.00 44.66 ? 1965 HOH B O 1 +HETATM 21784 O O . HOH T 10 . ? 107.746 55.964 86.793 1.00 51.63 ? 1967 HOH B O 1 +HETATM 21785 O O . HOH T 10 . ? 41.670 37.111 74.556 1.00 30.29 ? 1969 HOH B O 1 +HETATM 21786 O O . HOH T 10 . ? 106.237 38.558 63.980 1.00 34.29 ? 1970 HOH B O 1 +HETATM 21787 O O . HOH T 10 . ? 105.556 30.755 81.781 1.00 28.76 ? 1971 HOH B O 1 +HETATM 21788 O O . HOH T 10 . ? 109.109 55.850 60.936 1.00 38.58 ? 1974 HOH B O 1 +HETATM 21789 O O . HOH T 10 . ? 107.408 58.203 63.772 1.00 35.83 ? 1976 HOH B O 1 +HETATM 21790 O O . HOH T 10 . ? 108.042 50.745 70.356 1.00 31.39 ? 1977 HOH B O 1 +HETATM 21791 O O . HOH T 10 . ? 55.473 55.449 61.645 1.00 32.10 ? 1980 HOH B O 1 +HETATM 21792 O O . HOH T 10 . ? 87.270 38.236 113.551 1.00 27.06 ? 1984 HOH B O 1 +HETATM 21793 O O . HOH T 10 . ? 70.787 26.207 68.354 1.00 22.80 ? 1987 HOH B O 1 +HETATM 21794 O O . HOH T 10 . ? 108.457 48.697 88.433 1.00 38.28 ? 1994 HOH B O 1 +HETATM 21795 O O . HOH T 10 . ? 98.036 59.038 67.932 1.00 27.31 ? 2003 HOH B O 1 +HETATM 21796 O O . HOH T 10 . ? 98.572 50.266 102.985 1.00 49.54 ? 2004 HOH B O 1 +HETATM 21797 O O . HOH T 10 . ? 51.833 29.131 93.294 1.00 31.60 ? 2006 HOH B O 1 +HETATM 21798 O O . HOH T 10 . ? 76.133 36.196 91.261 1.00 22.83 ? 2010 HOH B O 1 +HETATM 21799 O O . HOH T 10 . ? 72.769 40.477 54.620 1.00 38.87 ? 2016 HOH B O 1 +HETATM 21800 O O . HOH T 10 . ? 103.620 61.564 59.623 1.00 28.56 ? 2019 HOH B O 1 +HETATM 21801 O O . HOH T 10 . ? 95.219 41.394 109.104 1.00 47.38 ? 2028 HOH B O 1 +HETATM 21802 O O . HOH T 10 . ? 90.693 55.517 59.961 1.00 32.35 ? 2035 HOH B O 1 +HETATM 21803 O O . HOH T 10 . ? 41.361 38.311 78.581 1.00 47.28 ? 2038 HOH B O 1 +HETATM 21804 O O . HOH T 10 . ? 51.232 49.402 73.304 1.00 24.74 ? 2046 HOH B O 1 +HETATM 21805 O O . HOH T 10 . ? 92.159 28.324 64.077 1.00 16.05 ? 2050 HOH B O 1 +HETATM 21806 O O . HOH T 10 . ? 69.729 59.698 80.664 1.00 9.70 ? 2051 HOH B O 1 +HETATM 21807 O O . HOH T 10 . ? 83.423 46.964 33.903 1.00 33.90 ? 2061 HOH B O 1 +HETATM 21808 O O . HOH T 10 . ? 48.146 29.024 72.755 1.00 18.35 ? 2070 HOH B O 1 +HETATM 21809 O O . HOH T 10 . ? 89.649 16.357 75.081 1.00 29.02 ? 2072 HOH B O 1 +HETATM 21810 O O . HOH T 10 . ? 98.627 49.753 43.374 1.00 26.44 ? 2080 HOH B O 1 +HETATM 21811 O O . HOH T 10 . ? 83.734 43.177 61.382 1.00 18.94 ? 2082 HOH B O 1 +HETATM 21812 O O . HOH T 10 . ? 65.839 42.249 50.490 1.00 37.61 ? 2087 HOH B O 1 +HETATM 21813 O O . HOH T 10 . ? 62.341 60.299 55.725 1.00 26.64 ? 2088 HOH B O 1 +HETATM 21814 O O . HOH T 10 . ? 91.094 62.442 77.016 1.00 26.49 ? 2089 HOH B O 1 +HETATM 21815 O O . HOH T 10 . ? 90.551 33.642 70.638 1.00 29.96 ? 2097 HOH B O 1 +HETATM 21816 O O . HOH T 10 . ? 43.637 44.738 62.478 1.00 30.29 ? 2099 HOH B O 1 +HETATM 21817 O O . HOH T 10 . ? 101.432 26.792 90.602 1.00 29.11 ? 2102 HOH B O 1 +HETATM 21818 O O . HOH T 10 . ? 48.309 24.576 77.668 1.00 20.70 ? 2104 HOH B O 1 +HETATM 21819 O O . HOH T 10 . ? 100.663 45.023 89.389 1.00 24.13 ? 2110 HOH B O 1 +HETATM 21820 O O . HOH T 10 . ? 57.386 32.287 68.746 1.00 25.70 ? 2111 HOH B O 1 +HETATM 21821 O O . HOH T 10 . ? 42.976 27.950 91.896 1.00 39.50 ? 2114 HOH B O 1 +HETATM 21822 O O . HOH T 10 . ? 83.900 42.469 112.248 1.00 35.96 ? 2116 HOH B O 1 +HETATM 21823 O O . HOH T 10 . ? 72.551 29.546 73.939 1.00 19.66 ? 2119 HOH B O 1 +HETATM 21824 O O . HOH T 10 . ? 49.856 30.780 73.849 1.00 29.55 ? 2121 HOH B O 1 +HETATM 21825 O O . HOH T 10 . ? 68.731 59.861 62.597 1.00 31.23 ? 2129 HOH B O 1 +HETATM 21826 O O . HOH T 10 . ? 89.249 21.441 74.043 1.00 27.87 ? 2130 HOH B O 1 +HETATM 21827 O O . HOH T 10 . ? 88.065 49.343 35.940 1.00 33.31 ? 2131 HOH B O 1 +HETATM 21828 O O . HOH T 10 . ? 72.027 61.581 91.834 1.00 28.04 ? 2135 HOH B O 1 +HETATM 21829 O O . HOH T 10 . ? 61.381 56.795 49.490 1.00 26.79 ? 2139 HOH B O 1 +HETATM 21830 O O . HOH T 10 . ? 81.573 35.206 58.220 1.00 33.48 ? 2140 HOH B O 1 +HETATM 21831 O O . HOH T 10 . ? 101.479 35.818 98.868 1.00 39.65 ? 2142 HOH B O 1 +HETATM 21832 O O . HOH T 10 . ? 74.019 61.737 63.035 1.00 34.77 ? 2145 HOH B O 1 +HETATM 21833 O O . HOH T 10 . ? 61.225 20.460 79.413 1.00 32.72 ? 2147 HOH B O 1 +HETATM 21834 O O . HOH T 10 . ? 66.363 53.850 81.959 1.00 21.82 ? 2148 HOH B O 1 +HETATM 21835 O O . HOH T 10 . ? 60.787 28.293 74.082 1.00 27.71 ? 2151 HOH B O 1 +HETATM 21836 O O . HOH T 10 . ? 105.597 46.417 81.734 1.00 31.05 ? 2160 HOH B O 1 +HETATM 21837 O O . HOH T 10 . ? 54.739 54.392 53.334 1.00 36.76 ? 2167 HOH B O 1 +HETATM 21838 O O . HOH T 10 . ? 75.274 43.382 38.206 1.00 42.35 ? 2171 HOH B O 1 +HETATM 21839 O O . HOH T 10 . ? 95.243 57.517 59.560 1.00 18.91 ? 2179 HOH B O 1 +HETATM 21840 O O . HOH T 10 . ? 104.402 26.583 87.213 1.00 44.90 ? 2181 HOH B O 1 +HETATM 21841 O O . HOH T 10 . ? 106.257 52.046 69.180 1.00 27.15 ? 2192 HOH B O 1 +HETATM 21842 O O . HOH T 10 . ? 97.650 30.376 79.928 1.00 22.14 ? 2193 HOH B O 1 +HETATM 21843 O O . HOH T 10 . ? 55.368 24.665 72.584 1.00 35.02 ? 2202 HOH B O 1 +HETATM 21844 O O . HOH T 10 . ? 100.843 44.048 43.002 1.00 24.00 ? 2214 HOH B O 1 +HETATM 21845 O O . HOH T 10 . ? 55.597 51.945 51.478 1.00 39.73 ? 2225 HOH B O 1 +HETATM 21846 O O . HOH T 10 . ? 64.317 62.350 63.151 1.00 26.37 ? 2229 HOH B O 1 +HETATM 21847 O O . HOH T 10 . ? 76.153 52.048 83.107 1.00 29.88 ? 2233 HOH B O 1 +HETATM 21848 O O . HOH T 10 . ? 104.316 38.111 96.630 1.00 32.25 ? 2235 HOH B O 1 +HETATM 21849 O O . HOH T 10 . ? 86.521 54.168 61.682 1.00 39.84 ? 2237 HOH B O 1 +HETATM 21850 O O . HOH T 10 . ? 101.565 61.343 65.368 1.00 36.94 ? 2241 HOH B O 1 +HETATM 21851 O O . HOH T 10 . ? 94.556 58.975 56.947 1.00 43.31 ? 2244 HOH B O 1 +HETATM 21852 O O . HOH T 10 . ? 77.738 42.933 53.385 1.00 36.86 ? 2247 HOH B O 1 +HETATM 21853 O O . HOH T 10 . ? 97.953 59.449 78.073 1.00 31.02 ? 2248 HOH B O 1 +HETATM 21854 O O . HOH T 10 . ? 95.908 31.698 103.330 1.00 28.95 ? 2251 HOH B O 1 +HETATM 21855 O O . HOH T 10 . ? 93.164 54.298 102.088 1.00 27.46 ? 2260 HOH B O 1 +HETATM 21856 O O . HOH T 10 . ? 91.685 20.749 96.606 1.00 35.45 ? 2262 HOH B O 1 +HETATM 21857 O O . HOH T 10 . ? 84.049 47.254 61.506 1.00 31.68 ? 2266 HOH B O 1 +HETATM 21858 O O . HOH T 10 . ? 87.500 55.569 64.269 1.00 39.74 ? 2267 HOH B O 1 +HETATM 21859 O O . HOH T 10 . ? 99.484 28.785 95.018 1.00 29.38 ? 2268 HOH B O 1 +HETATM 21860 O O . HOH T 10 . ? 60.961 31.340 78.461 1.00 32.79 ? 2270 HOH B O 1 +HETATM 21861 O O . HOH T 10 . ? 47.868 55.681 66.240 1.00 28.19 ? 2274 HOH B O 1 +HETATM 21862 O O . HOH T 10 . ? 39.885 44.573 70.732 1.00 54.64 ? 2276 HOH B O 1 +HETATM 21863 O O . HOH T 10 . ? 43.224 47.091 67.792 1.00 35.89 ? 2279 HOH B O 1 +HETATM 21864 O O . HOH T 10 . ? 48.823 36.186 80.342 1.00 27.45 ? 2284 HOH B O 1 +HETATM 21865 O O . HOH T 10 . ? 93.395 65.526 92.187 1.00 37.05 ? 2285 HOH B O 1 +HETATM 21866 O O . HOH T 10 . ? 47.188 33.296 78.886 1.00 28.98 ? 2292 HOH B O 1 +HETATM 21867 O O . HOH T 10 . ? 107.527 39.234 56.908 1.00 34.58 ? 2293 HOH B O 1 +HETATM 21868 O O . HOH T 10 . ? 61.958 23.224 84.952 1.00 41.78 ? 2299 HOH B O 1 +HETATM 21869 O O . HOH T 10 . ? 77.395 16.910 87.346 1.00 38.32 ? 2303 HOH B O 1 +HETATM 21870 O O . HOH T 10 . ? 52.760 29.613 67.476 1.00 37.88 ? 2308 HOH B O 1 +HETATM 21871 O O . HOH T 10 . ? 81.803 36.893 43.660 1.00 32.85 ? 2316 HOH B O 1 +HETATM 21872 O O . HOH T 10 . ? 75.221 33.900 90.117 1.00 28.62 ? 2327 HOH B O 1 +HETATM 21873 O O . HOH T 10 . ? 104.797 53.082 50.342 1.00 40.37 ? 2331 HOH B O 1 +HETATM 21874 O O . HOH T 10 . ? 44.603 56.680 63.536 1.00 41.48 ? 2350 HOH B O 1 +HETATM 21875 O O . HOH T 10 . ? 50.661 51.223 72.020 1.00 38.24 ? 2354 HOH B O 1 +HETATM 21876 O O . HOH T 10 . ? 88.041 54.750 59.569 1.00 25.17 ? 2356 HOH B O 1 +HETATM 21877 O O . HOH T 10 . ? 68.197 58.176 91.000 1.00 29.16 ? 2374 HOH B O 1 +HETATM 21878 O O . HOH T 10 . ? 90.280 18.000 80.820 1.00 31.12 ? 2379 HOH B O 1 +HETATM 21879 O O . HOH T 10 . ? 93.380 62.263 79.704 1.00 32.62 ? 2380 HOH B O 1 +HETATM 21880 O O . HOH T 10 . ? 72.501 57.620 68.070 1.00 32.95 ? 2387 HOH B O 1 +HETATM 21881 O O . HOH T 10 . ? 76.334 41.589 56.865 1.00 37.27 ? 2391 HOH B O 1 +HETATM 21882 O O . HOH T 10 . ? 97.878 40.841 44.761 1.00 37.13 ? 2392 HOH B O 1 +HETATM 21883 O O . HOH T 10 . ? 58.033 31.355 89.419 1.00 43.49 ? 2410 HOH B O 1 +HETATM 21884 O O . HOH T 10 . ? 79.429 32.485 106.663 1.00 44.86 ? 2414 HOH B O 1 +HETATM 21885 O O . HOH T 10 . ? 96.591 20.653 89.184 1.00 38.36 ? 2416 HOH B O 1 +HETATM 21886 O O . HOH T 10 . ? 48.459 29.389 68.071 1.00 34.20 ? 2422 HOH B O 1 +HETATM 21887 O O . HOH T 10 . ? 73.694 60.296 51.959 1.00 36.02 ? 2425 HOH B O 1 +HETATM 21888 O O . HOH T 10 . ? 100.892 22.936 91.544 1.00 38.11 ? 2432 HOH B O 1 +HETATM 21889 O O . HOH T 10 . ? 47.857 28.413 97.906 1.00 41.12 ? 2433 HOH B O 1 +HETATM 21890 O O . HOH T 10 . ? 93.090 59.373 52.205 1.00 36.55 ? 2435 HOH B O 1 +HETATM 21891 O O . HOH T 10 . ? 112.598 45.413 61.311 1.00 48.68 ? 2436 HOH B O 1 +HETATM 21892 O O . HOH T 10 . ? 67.267 56.553 93.458 1.00 34.94 ? 2437 HOH B O 1 +HETATM 21893 O O . HOH T 10 . ? 70.950 61.066 73.141 1.00 7.30 ? 2447 HOH B O 1 +HETATM 21894 O O . HOH T 10 . ? 74.776 61.786 91.330 1.00 14.74 ? 2452 HOH B O 1 +HETATM 21895 O O . HOH T 10 . ? 52.810 39.961 68.216 1.00 12.81 ? 2453 HOH B O 1 +HETATM 21896 O O . HOH T 10 . ? 63.911 45.897 94.667 1.00 13.78 ? 2455 HOH B O 1 +HETATM 21897 O O . HOH T 10 . ? 96.608 37.844 98.622 1.00 13.62 ? 2466 HOH B O 1 +HETATM 21898 O O . HOH T 10 . ? 68.367 54.689 64.950 1.00 19.57 ? 2467 HOH B O 1 +HETATM 21899 O O . HOH T 10 . ? 96.946 38.572 47.424 1.00 17.48 ? 2468 HOH B O 1 +HETATM 21900 O O . HOH T 10 . ? 72.724 40.030 59.280 1.00 18.46 ? 2472 HOH B O 1 +HETATM 21901 O O . HOH T 10 . ? 70.086 59.052 72.768 1.00 18.94 ? 2474 HOH B O 1 +HETATM 21902 O O . HOH T 10 . ? 47.498 44.341 57.734 1.00 16.07 ? 2478 HOH B O 1 +HETATM 21903 O O . HOH T 10 . ? 73.623 57.083 107.356 1.00 24.61 ? 2483 HOH B O 1 +HETATM 21904 O O . HOH T 10 . ? 70.666 54.529 90.649 1.00 15.76 ? 2486 HOH B O 1 +HETATM 21905 O O . HOH T 10 . ? 65.834 44.692 72.812 1.00 23.30 ? 2488 HOH B O 1 +HETATM 21906 O O . HOH T 10 . ? 82.689 37.515 52.838 1.00 17.76 ? 2504 HOH B O 1 +HETATM 21907 O O . HOH T 10 . ? 68.560 48.759 67.853 1.00 24.57 ? 2505 HOH B O 1 +HETATM 21908 O O . HOH T 10 . ? 72.484 62.597 106.230 1.00 21.09 ? 2506 HOH B O 1 +HETATM 21909 O O . HOH T 10 . ? 67.801 31.140 71.051 1.00 25.26 ? 2509 HOH B O 1 +HETATM 21910 O O . HOH T 10 . ? 102.839 59.832 63.444 1.00 26.18 ? 2511 HOH B O 1 +HETATM 21911 O O . HOH T 10 . ? 87.823 61.630 103.145 1.00 28.71 ? 2512 HOH B O 1 +HETATM 21912 O O . HOH T 10 . ? 74.893 58.997 107.800 1.00 21.04 ? 2514 HOH B O 1 +HETATM 21913 O O . HOH T 10 . ? 87.454 36.715 55.032 1.00 28.34 ? 2517 HOH B O 1 +HETATM 21914 O O . HOH T 10 . ? 74.613 38.988 57.691 1.00 27.93 ? 2524 HOH B O 1 +HETATM 21915 O O . HOH T 10 . ? 74.983 30.634 87.698 1.00 29.06 ? 2531 HOH B O 1 +HETATM 21916 O O . HOH T 10 . ? 95.558 60.485 91.407 1.00 32.45 ? 2540 HOH B O 1 +HETATM 21917 O O . HOH T 10 . ? 47.377 53.404 54.713 1.00 36.01 ? 2542 HOH B O 1 +HETATM 21918 O O . HOH T 10 . ? 69.260 60.026 98.265 1.00 39.87 ? 2543 HOH B O 1 +HETATM 21919 O O . HOH T 10 . ? 90.491 23.034 99.741 1.00 37.35 ? 2560 HOH B O 1 +HETATM 21920 O O . HOH T 10 . ? 63.185 39.734 83.141 1.00 26.05 ? 2576 HOH B O 1 +HETATM 21921 O O . HOH T 10 . ? 76.377 34.922 94.264 1.00 36.27 ? 2577 HOH B O 1 +HETATM 21922 O O . HOH T 10 . ? 44.789 55.792 68.592 1.00 35.08 ? 2587 HOH B O 1 +HETATM 21923 O O . HOH T 10 . ? 47.381 56.244 68.566 1.00 31.23 ? 2588 HOH B O 1 +HETATM 21924 O O . HOH T 10 . ? 87.660 35.167 50.985 1.00 32.38 ? 2595 HOH B O 1 +HETATM 21925 O O . HOH T 10 . ? 95.672 21.493 94.140 1.00 27.68 ? 2599 HOH B O 1 +HETATM 21926 O O . HOH T 10 . ? 68.041 58.710 95.057 1.00 26.82 ? 2603 HOH B O 1 +HETATM 21927 O O . HOH T 10 . ? 70.845 61.512 94.101 1.00 27.37 ? 2604 HOH B O 1 +HETATM 21928 O O . HOH T 10 . ? 71.303 56.992 107.572 1.00 33.05 ? 2612 HOH B O 1 +HETATM 21929 O O . HOH T 10 . ? 41.237 37.230 70.614 1.00 39.76 ? 2613 HOH B O 1 +HETATM 21930 O O . HOH T 10 . ? 91.409 24.602 72.589 1.00 35.81 ? 2619 HOH B O 1 +HETATM 21931 O O . HOH T 10 . ? 75.816 56.124 65.496 1.00 36.61 ? 2626 HOH B O 1 +HETATM 21932 O O . HOH T 10 . ? 56.427 38.315 52.086 1.00 27.45 ? 2631 HOH B O 1 +HETATM 21933 O O . HOH T 10 . ? 54.484 39.486 49.799 1.00 38.75 ? 2632 HOH B O 1 +HETATM 21934 O O . HOH T 10 . ? 82.291 45.485 63.006 1.00 28.03 ? 2633 HOH B O 1 +HETATM 21935 O O . HOH T 10 . ? 66.862 62.059 63.052 1.00 34.87 ? 2634 HOH B O 1 +HETATM 21936 O O . HOH T 10 . ? 83.155 37.170 58.842 1.00 36.10 ? 2639 HOH B O 1 +HETATM 21937 O O . HOH T 10 . ? 75.125 41.327 54.688 1.00 32.86 ? 2648 HOH B O 1 +HETATM 21938 O O . HOH T 10 . ? 60.382 28.655 69.954 1.00 31.74 ? 2656 HOH B O 1 +HETATM 21939 O O . HOH T 10 . ? 72.800 34.149 65.599 1.00 26.99 ? 2663 HOH B O 1 +HETATM 21940 O O . HOH T 10 . ? 74.869 31.137 53.133 1.00 41.15 ? 2673 HOH B O 1 +HETATM 21941 O O . HOH T 10 . ? 90.126 39.025 113.686 1.00 34.10 ? 2674 HOH B O 1 +HETATM 21942 O O . HOH T 10 . ? 108.206 54.467 67.264 1.00 41.22 ? 2677 HOH B O 1 +HETATM 21943 O O . HOH T 10 . ? 90.884 56.814 54.031 1.00 35.11 ? 2682 HOH B O 1 +HETATM 21944 O O . HOH T 10 . ? 81.309 42.758 112.150 1.00 35.06 ? 2687 HOH B O 1 +HETATM 21945 O O . HOH T 10 . ? 82.198 29.095 61.495 1.00 35.31 ? 2691 HOH B O 1 +HETATM 21946 O O . HOH T 10 . ? 81.200 25.105 63.824 1.00 40.89 ? 2692 HOH B O 1 +HETATM 21947 O O . HOH T 10 . ? 52.209 56.002 77.017 1.00 27.79 ? 2708 HOH B O 1 +HETATM 21948 O O . HOH T 10 . ? 92.402 55.169 40.930 1.00 33.62 ? 2717 HOH B O 1 +HETATM 21949 O O . HOH T 10 . ? 44.925 41.425 76.483 1.00 40.56 ? 2718 HOH B O 1 +HETATM 21950 O O . HOH T 10 . ? 97.119 47.460 106.554 1.00 41.67 ? 2719 HOH B O 1 +HETATM 21951 O O . HOH T 10 . ? 81.459 52.912 41.601 1.00 30.03 ? 2722 HOH B O 1 +HETATM 21952 O O . HOH T 10 . ? 109.726 55.495 58.331 1.00 42.57 ? 2725 HOH B O 1 +HETATM 21953 O O . HOH T 10 . ? 87.651 26.312 99.092 1.00 30.20 ? 2733 HOH B O 1 +HETATM 21954 O O . HOH T 10 . ? 89.648 29.406 97.942 1.00 27.65 ? 2734 HOH B O 1 +HETATM 21955 O O . HOH T 10 . ? 68.107 40.633 47.960 1.00 32.58 ? 2735 HOH B O 1 +HETATM 21956 O O . HOH T 10 . ? 105.950 43.631 47.335 1.00 30.55 ? 2739 HOH B O 1 +HETATM 21957 O O . HOH T 10 . ? 90.371 60.798 103.764 1.00 41.40 ? 2741 HOH B O 1 +HETATM 21958 O O . HOH T 10 . ? 63.736 24.791 75.798 1.00 27.26 ? 2748 HOH B O 1 +HETATM 21959 O O . HOH T 10 . ? 103.120 37.856 70.675 1.00 35.05 ? 2750 HOH B O 1 +HETATM 21960 O O . HOH T 10 . ? 96.559 43.884 41.581 1.00 41.26 ? 2756 HOH B O 1 +HETATM 21961 O O . HOH T 10 . ? 104.653 59.646 91.785 1.00 31.57 ? 2764 HOH B O 1 +HETATM 21962 O O . HOH T 10 . ? 99.555 33.687 102.663 1.00 30.42 ? 2765 HOH B O 1 +HETATM 21963 O O . HOH T 10 . ? 43.524 54.286 66.707 1.00 26.29 ? 2767 HOH B O 1 +HETATM 21964 O O . HOH T 10 . ? 109.822 50.088 86.576 1.00 41.95 ? 2769 HOH B O 1 +HETATM 21965 O O . HOH T 10 . ? 99.240 47.607 41.536 1.00 34.66 ? 2771 HOH B O 1 +HETATM 21966 O O . HOH T 10 . ? 43.548 27.322 94.746 1.00 37.84 ? 2773 HOH B O 1 +HETATM 21967 O O . HOH T 10 . ? 100.307 39.766 43.817 1.00 29.82 ? 2780 HOH B O 1 +HETATM 21968 O O . HOH T 10 . ? 57.200 52.095 48.227 1.00 42.62 ? 2781 HOH B O 1 +HETATM 21969 O O . HOH T 10 . ? 79.988 37.202 45.637 1.00 45.06 ? 2783 HOH B O 1 +HETATM 21970 O O . HOH T 10 . ? 77.928 35.925 46.901 1.00 26.68 ? 2784 HOH B O 1 +HETATM 21971 O O . HOH T 10 . ? 81.542 35.178 52.238 1.00 32.69 ? 2787 HOH B O 1 +HETATM 21972 O O . HOH T 10 . ? 100.397 49.372 96.457 1.00 26.52 ? 2789 HOH B O 1 +HETATM 21973 O O . HOH T 10 . ? 98.748 56.672 97.071 1.00 38.77 ? 2790 HOH B O 1 +HETATM 21974 O O . HOH T 10 . ? 103.346 52.519 39.989 1.00 39.33 ? 2792 HOH B O 1 +HETATM 21975 O O . HOH T 10 . ? 100.453 60.033 68.530 1.00 33.53 ? 2798 HOH B O 1 +HETATM 21976 O O . HOH T 10 . ? 103.305 58.141 80.786 1.00 44.95 ? 2802 HOH B O 1 +HETATM 21977 O O . HOH T 10 . ? 61.952 63.905 41.468 1.00 40.14 ? 2807 HOH B O 1 +HETATM 21978 O O . HOH T 10 . ? 109.462 50.853 66.106 1.00 36.27 ? 2810 HOH B O 1 +HETATM 21979 O O . HOH T 10 . ? 93.704 53.959 47.540 1.00 27.36 ? 2811 HOH B O 1 +HETATM 21980 O O . HOH T 10 . ? 57.035 21.747 89.406 1.00 35.28 ? 2812 HOH B O 1 +HETATM 21981 O O . HOH U 10 . ? 74.666 52.381 121.699 1.00 7.72 ? 13 HOH D O 1 +HETATM 21982 O O . HOH U 10 . ? 80.655 51.716 117.738 1.00 15.60 ? 15 HOH D O 1 +HETATM 21983 O O . HOH U 10 . ? 63.845 38.075 130.217 1.00 8.81 ? 18 HOH D O 1 +HETATM 21984 O O . HOH U 10 . ? 75.045 51.892 129.358 1.00 7.90 ? 19 HOH D O 1 +HETATM 21985 O O . HOH U 10 . ? 68.916 44.386 124.778 1.00 9.79 ? 634 HOH D O 1 +HETATM 21986 O O . HOH U 10 . ? 77.202 42.670 120.300 1.00 10.61 ? 635 HOH D O 1 +HETATM 21987 O O . HOH U 10 . ? 75.458 38.392 121.467 1.00 12.57 ? 636 HOH D O 1 +HETATM 21988 O O . HOH U 10 . ? 59.580 52.727 117.967 1.00 12.77 ? 637 HOH D O 1 +HETATM 21989 O O . HOH U 10 . ? 65.813 56.477 109.398 1.00 5.99 ? 638 HOH D O 1 +HETATM 21990 O O . HOH U 10 . ? 70.218 61.860 118.207 1.00 16.92 ? 639 HOH D O 1 +HETATM 21991 O O . HOH U 10 . ? 75.431 43.677 122.252 1.00 8.51 ? 640 HOH D O 1 +HETATM 21992 O O . HOH U 10 . ? 44.359 29.090 125.492 1.00 12.57 ? 641 HOH D O 1 +HETATM 21993 O O . HOH U 10 . ? 45.870 49.158 138.446 1.00 15.80 ? 642 HOH D O 1 +HETATM 21994 O O . HOH U 10 . ? 64.292 64.740 113.802 1.00 11.38 ? 643 HOH D O 1 +HETATM 21995 O O . HOH U 10 . ? 90.821 53.728 128.200 1.00 27.12 ? 644 HOH D O 1 +HETATM 21996 O O . HOH U 10 . ? 55.925 46.453 128.018 1.00 11.43 ? 645 HOH D O 1 +HETATM 21997 O O . HOH U 10 . ? 78.024 40.035 117.575 1.00 9.67 ? 646 HOH D O 1 +HETATM 21998 O O . HOH U 10 . ? 62.102 43.370 114.615 1.00 8.19 ? 647 HOH D O 1 +HETATM 21999 O O . HOH U 10 . ? 66.820 33.649 117.497 1.00 8.18 ? 648 HOH D O 1 +HETATM 22000 O O . HOH U 10 . ? 47.613 54.535 161.246 1.00 35.99 ? 649 HOH D O 1 +HETATM 22001 O O . HOH U 10 . ? 45.125 60.795 124.848 1.00 21.46 ? 661 HOH D O 1 +HETATM 22002 O O . HOH U 10 . ? 81.661 33.002 131.131 1.00 11.69 ? 662 HOH D O 1 +HETATM 22003 O O . HOH U 10 . ? 67.010 34.778 128.631 1.00 17.03 ? 663 HOH D O 1 +HETATM 22004 O O . HOH U 10 . ? 79.645 63.013 135.712 1.00 25.03 ? 664 HOH D O 1 +HETATM 22005 O O . HOH U 10 . ? 83.840 38.680 128.399 1.00 14.07 ? 665 HOH D O 1 +HETATM 22006 O O . HOH U 10 . ? 73.536 47.723 109.860 1.00 10.65 ? 666 HOH D O 1 +HETATM 22007 O O . HOH U 10 . ? 89.056 50.301 116.622 1.00 21.84 ? 667 HOH D O 1 +HETATM 22008 O O . HOH U 10 . ? 59.048 50.545 99.299 1.00 6.58 ? 668 HOH D O 1 +HETATM 22009 O O . HOH U 10 . ? 78.612 52.161 116.111 1.00 11.36 ? 669 HOH D O 1 +HETATM 22010 O O . HOH U 10 . ? 40.831 48.047 94.020 1.00 25.25 ? 670 HOH D O 1 +HETATM 22011 O O . HOH U 10 . ? 66.481 61.113 129.269 1.00 10.41 ? 671 HOH D O 1 +HETATM 22012 O O . HOH U 10 . ? 69.782 39.895 115.378 1.00 8.36 ? 672 HOH D O 1 +HETATM 22013 O O . HOH U 10 . ? 67.622 44.421 128.289 1.00 9.87 ? 673 HOH D O 1 +HETATM 22014 O O . HOH U 10 . ? 59.863 55.960 85.331 1.00 12.64 ? 674 HOH D O 1 +HETATM 22015 O O . HOH U 10 . ? 63.504 53.607 115.878 1.00 10.40 ? 675 HOH D O 1 +HETATM 22016 O O . HOH U 10 . ? 73.530 37.749 115.636 1.00 15.52 ? 676 HOH D O 1 +HETATM 22017 O O . HOH U 10 . ? 57.308 30.368 111.128 1.00 15.80 ? 677 HOH D O 1 +HETATM 22018 O O . HOH U 10 . ? 56.191 49.967 106.145 1.00 7.15 ? 678 HOH D O 1 +HETATM 22019 O O . HOH U 10 . ? 77.735 42.095 127.272 1.00 11.53 ? 679 HOH D O 1 +HETATM 22020 O O . HOH U 10 . ? 40.102 53.992 119.839 1.00 12.99 ? 680 HOH D O 1 +HETATM 22021 O O . HOH U 10 . ? 85.324 46.276 139.897 1.00 15.41 ? 681 HOH D O 1 +HETATM 22022 O O . HOH U 10 . ? 95.603 37.227 134.143 1.00 17.71 ? 682 HOH D O 1 +HETATM 22023 O O . HOH U 10 . ? 74.191 46.301 112.074 1.00 10.43 ? 683 HOH D O 1 +HETATM 22024 O O . HOH U 10 . ? 68.035 40.835 122.953 1.00 13.40 ? 684 HOH D O 1 +HETATM 22025 O O . HOH U 10 . ? 68.144 39.978 125.672 1.00 17.60 ? 685 HOH D O 1 +HETATM 22026 O O . HOH U 10 . ? 66.900 42.310 132.412 1.00 9.94 ? 686 HOH D O 1 +HETATM 22027 O O . HOH U 10 . ? 44.845 60.072 131.730 1.00 11.21 ? 687 HOH D O 1 +HETATM 22028 O O . HOH U 10 . ? 39.477 39.220 135.645 1.00 21.49 ? 688 HOH D O 1 +HETATM 22029 O O . HOH U 10 . ? 67.143 48.152 117.013 1.00 9.98 ? 689 HOH D O 1 +HETATM 22030 O O . HOH U 10 . ? 65.146 44.355 102.055 1.00 7.64 ? 690 HOH D O 1 +HETATM 22031 O O . HOH U 10 . ? 62.018 39.272 113.979 1.00 14.61 ? 691 HOH D O 1 +HETATM 22032 O O . HOH U 10 . ? 60.999 34.551 115.039 1.00 16.18 ? 692 HOH D O 1 +HETATM 22033 O O . HOH U 10 . ? 58.011 65.100 113.876 1.00 8.03 ? 693 HOH D O 1 +HETATM 22034 O O . HOH U 10 . ? 59.029 49.711 144.472 1.00 14.97 ? 694 HOH D O 1 +HETATM 22035 O O . HOH U 10 . ? 38.921 54.443 135.261 1.00 14.66 ? 695 HOH D O 1 +HETATM 22036 O O . HOH U 10 . ? 52.330 47.192 139.446 1.00 14.48 ? 696 HOH D O 1 +HETATM 22037 O O . HOH U 10 . ? 65.555 48.570 126.394 1.00 18.36 ? 697 HOH D O 1 +HETATM 22038 O O . HOH U 10 . ? 61.357 51.724 116.021 1.00 14.61 ? 698 HOH D O 1 +HETATM 22039 O O . HOH U 10 . ? 64.053 37.520 132.706 1.00 14.33 ? 699 HOH D O 1 +HETATM 22040 O O . HOH U 10 . ? 59.543 33.147 118.092 1.00 6.89 ? 700 HOH D O 1 +HETATM 22041 O O . HOH U 10 . ? 51.172 25.544 131.470 1.00 17.65 ? 701 HOH D O 1 +HETATM 22042 O O . HOH U 10 . ? 50.502 56.299 134.749 1.00 18.23 ? 702 HOH D O 1 +HETATM 22043 O O . HOH U 10 . ? 64.720 36.020 128.666 1.00 10.89 ? 703 HOH D O 1 +HETATM 22044 O O . HOH U 10 . ? 66.141 46.796 128.307 1.00 11.13 ? 704 HOH D O 1 +HETATM 22045 O O . HOH U 10 . ? 56.562 56.953 102.240 1.00 10.51 ? 705 HOH D O 1 +HETATM 22046 O O . HOH U 10 . ? 58.634 41.584 137.044 1.00 11.67 ? 706 HOH D O 1 +HETATM 22047 O O . HOH U 10 . ? 42.011 53.821 103.892 1.00 18.40 ? 707 HOH D O 1 +HETATM 22048 O O . HOH U 10 . ? 45.700 39.941 137.337 1.00 18.79 ? 708 HOH D O 1 +HETATM 22049 O O . HOH U 10 . ? 64.106 51.494 136.485 1.00 11.91 ? 709 HOH D O 1 +HETATM 22050 O O . HOH U 10 . ? 74.633 38.850 110.082 1.00 22.38 ? 710 HOH D O 1 +HETATM 22051 O O . HOH U 10 . ? 55.493 63.811 102.143 1.00 17.73 ? 711 HOH D O 1 +HETATM 22052 O O . HOH U 10 . ? 66.860 51.873 109.708 1.00 8.01 ? 712 HOH D O 1 +HETATM 22053 O O . HOH U 10 . ? 68.851 52.164 111.363 1.00 17.75 ? 713 HOH D O 1 +HETATM 22054 O O . HOH U 10 . ? 72.080 41.253 116.689 1.00 10.64 ? 714 HOH D O 1 +HETATM 22055 O O . HOH U 10 . ? 54.408 43.797 141.857 1.00 19.47 ? 715 HOH D O 1 +HETATM 22056 O O . HOH U 10 . ? 59.673 43.613 108.662 1.00 11.64 ? 716 HOH D O 1 +HETATM 22057 O O . HOH U 10 . ? 64.795 40.761 141.746 1.00 16.45 ? 717 HOH D O 1 +HETATM 22058 O O . HOH U 10 . ? 66.672 48.012 105.064 1.00 13.36 ? 718 HOH D O 1 +HETATM 22059 O O . HOH U 10 . ? 54.771 36.792 106.928 1.00 21.44 ? 719 HOH D O 1 +HETATM 22060 O O . HOH U 10 . ? 47.256 34.220 100.554 1.00 20.27 ? 720 HOH D O 1 +HETATM 22061 O O . HOH U 10 . ? 69.383 46.870 129.692 1.00 7.50 ? 721 HOH D O 1 +HETATM 22062 O O . HOH U 10 . ? 83.202 39.437 120.765 1.00 13.21 ? 722 HOH D O 1 +HETATM 22063 O O . HOH U 10 . ? 75.117 62.073 137.186 1.00 26.17 ? 723 HOH D O 1 +HETATM 22064 O O . HOH U 10 . ? 61.323 41.164 136.701 1.00 11.25 ? 724 HOH D O 1 +HETATM 22065 O O . HOH U 10 . ? 40.819 52.088 102.111 1.00 15.75 ? 725 HOH D O 1 +HETATM 22066 O O . HOH U 10 . ? 90.456 41.395 129.549 1.00 15.74 ? 726 HOH D O 1 +HETATM 22067 O O . HOH U 10 . ? 91.263 34.647 130.590 1.00 11.44 ? 727 HOH D O 1 +HETATM 22068 O O . HOH U 10 . ? 67.691 22.841 115.836 1.00 18.32 ? 728 HOH D O 1 +HETATM 22069 O O . HOH U 10 . ? 74.249 33.353 128.059 1.00 16.66 ? 729 HOH D O 1 +HETATM 22070 O O . HOH U 10 . ? 63.242 42.868 103.295 1.00 10.02 ? 730 HOH D O 1 +HETATM 22071 O O . HOH U 10 . ? 53.055 38.020 97.630 1.00 10.97 ? 731 HOH D O 1 +HETATM 22072 O O . HOH U 10 . ? 67.278 58.688 130.364 1.00 15.58 ? 732 HOH D O 1 +HETATM 22073 O O . HOH U 10 . ? 43.438 32.957 135.826 1.00 13.27 ? 733 HOH D O 1 +HETATM 22074 O O . HOH U 10 . ? 44.627 61.137 127.940 1.00 21.51 ? 734 HOH D O 1 +HETATM 22075 O O . HOH U 10 . ? 44.457 54.016 102.739 1.00 15.86 ? 735 HOH D O 1 +HETATM 22076 O O . HOH U 10 . ? 38.364 57.469 129.884 1.00 18.92 ? 736 HOH D O 1 +HETATM 22077 O O . HOH U 10 . ? 40.364 41.106 102.319 1.00 13.45 ? 737 HOH D O 1 +HETATM 22078 O O . HOH U 10 . ? 81.729 56.559 140.117 1.00 17.55 ? 738 HOH D O 1 +HETATM 22079 O O . HOH U 10 . ? 48.786 51.281 137.070 1.00 16.17 ? 739 HOH D O 1 +HETATM 22080 O O . HOH U 10 . ? 66.173 54.227 122.681 1.00 11.92 ? 740 HOH D O 1 +HETATM 22081 O O . HOH U 10 . ? 47.860 34.221 116.291 1.00 12.09 ? 741 HOH D O 1 +HETATM 22082 O O . HOH U 10 . ? 44.421 57.179 103.875 1.00 17.84 ? 742 HOH D O 1 +HETATM 22083 O O . HOH U 10 . ? 57.755 47.704 147.015 1.00 17.22 ? 743 HOH D O 1 +HETATM 22084 O O . HOH U 10 . ? 67.028 63.181 131.321 1.00 18.44 ? 744 HOH D O 1 +HETATM 22085 O O . HOH U 10 . ? 34.667 44.272 127.490 1.00 16.97 ? 745 HOH D O 1 +HETATM 22086 O O . HOH U 10 . ? 56.432 47.277 91.031 1.00 16.01 ? 746 HOH D O 1 +HETATM 22087 O O . HOH U 10 . ? 40.812 55.709 154.716 1.00 27.75 ? 747 HOH D O 1 +HETATM 22088 O O . HOH U 10 . ? 75.348 26.089 123.156 1.00 24.11 ? 748 HOH D O 1 +HETATM 22089 O O . HOH U 10 . ? 51.022 65.437 126.890 1.00 14.28 ? 749 HOH D O 1 +HETATM 22090 O O . HOH U 10 . ? 51.732 46.867 136.508 1.00 12.53 ? 750 HOH D O 1 +HETATM 22091 O O . HOH U 10 . ? 60.173 60.623 150.938 1.00 23.92 ? 751 HOH D O 1 +HETATM 22092 O O . HOH U 10 . ? 73.859 39.471 117.661 1.00 22.90 ? 752 HOH D O 1 +HETATM 22093 O O . HOH U 10 . ? 71.670 46.264 108.839 1.00 11.96 ? 753 HOH D O 1 +HETATM 22094 O O . HOH U 10 . ? 51.034 56.938 89.094 1.00 16.46 ? 754 HOH D O 1 +HETATM 22095 O O . HOH U 10 . ? 72.511 35.798 112.387 1.00 17.41 ? 755 HOH D O 1 +HETATM 22096 O O . HOH U 10 . ? 75.034 27.676 120.794 1.00 16.27 ? 756 HOH D O 1 +HETATM 22097 O O . HOH U 10 . ? 58.889 52.243 145.876 1.00 15.08 ? 757 HOH D O 1 +HETATM 22098 O O . HOH U 10 . ? 59.280 37.090 93.317 1.00 18.38 ? 758 HOH D O 1 +HETATM 22099 O O . HOH U 10 . ? 95.966 41.384 133.348 1.00 34.89 ? 759 HOH D O 1 +HETATM 22100 O O . HOH U 10 . ? 70.000 54.738 108.148 1.00 9.31 ? 760 HOH D O 1 +HETATM 22101 O O . HOH U 10 . ? 38.399 51.259 117.811 1.00 20.06 ? 761 HOH D O 1 +HETATM 22102 O O . HOH U 10 . ? 47.585 63.191 107.046 1.00 11.33 ? 762 HOH D O 1 +HETATM 22103 O O . HOH U 10 . ? 63.604 48.389 93.732 1.00 13.44 ? 763 HOH D O 1 +HETATM 22104 O O . HOH U 10 . ? 52.452 55.827 138.988 1.00 32.96 ? 764 HOH D O 1 +HETATM 22105 O O . HOH U 10 . ? 69.340 56.488 126.640 1.00 13.05 ? 765 HOH D O 1 +HETATM 22106 O O . HOH U 10 . ? 48.184 30.970 105.390 1.00 17.53 ? 766 HOH D O 1 +HETATM 22107 O O . HOH U 10 . ? 72.835 54.351 116.402 1.00 16.28 ? 767 HOH D O 1 +HETATM 22108 O O . HOH U 10 . ? 52.145 55.613 92.808 1.00 24.14 ? 768 HOH D O 1 +HETATM 22109 O O . HOH U 10 . ? 80.666 51.413 120.992 1.00 10.18 ? 769 HOH D O 1 +HETATM 22110 O O . HOH U 10 . ? 68.423 42.460 126.606 1.00 12.15 ? 770 HOH D O 1 +HETATM 22111 O O . HOH U 10 . ? 34.275 44.851 106.436 1.00 17.99 ? 771 HOH D O 1 +HETATM 22112 O O . HOH U 10 . ? 58.120 39.927 112.880 1.00 13.63 ? 772 HOH D O 1 +HETATM 22113 O O . HOH U 10 . ? 57.937 39.680 109.983 1.00 17.62 ? 773 HOH D O 1 +HETATM 22114 O O . HOH U 10 . ? 69.064 41.812 113.539 1.00 9.35 ? 774 HOH D O 1 +HETATM 22115 O O . HOH U 10 . ? 41.984 47.565 134.945 1.00 17.63 ? 775 HOH D O 1 +HETATM 22116 O O . HOH U 10 . ? 40.007 60.538 122.610 1.00 13.19 ? 776 HOH D O 1 +HETATM 22117 O O . HOH U 10 . ? 52.843 51.254 137.961 1.00 15.91 ? 777 HOH D O 1 +HETATM 22118 O O . HOH U 10 . ? 54.517 31.849 113.644 1.00 10.12 ? 778 HOH D O 1 +HETATM 22119 O O . HOH U 10 . ? 41.522 41.626 100.034 1.00 18.55 ? 779 HOH D O 1 +HETATM 22120 O O . HOH U 10 . ? 44.624 41.348 93.884 1.00 13.30 ? 780 HOH D O 1 +HETATM 22121 O O . HOH U 10 . ? 54.872 37.700 104.289 1.00 17.03 ? 781 HOH D O 1 +HETATM 22122 O O . HOH U 10 . ? 86.701 31.139 135.640 1.00 22.29 ? 782 HOH D O 1 +HETATM 22123 O O . HOH U 10 . ? 58.233 38.066 120.893 1.00 10.35 ? 783 HOH D O 1 +HETATM 22124 O O . HOH U 10 . ? 69.398 53.161 164.009 1.00 34.27 ? 784 HOH D O 1 +HETATM 22125 O O . HOH U 10 . ? 53.212 36.758 137.815 1.00 16.95 ? 785 HOH D O 1 +HETATM 22126 O O . HOH U 10 . ? 48.132 31.634 115.009 1.00 17.84 ? 786 HOH D O 1 +HETATM 22127 O O . HOH U 10 . ? 89.492 29.402 112.531 1.00 25.71 ? 787 HOH D O 1 +HETATM 22128 O O . HOH U 10 . ? 59.942 32.468 109.957 1.00 17.85 ? 788 HOH D O 1 +HETATM 22129 O O . HOH U 10 . ? 66.645 35.491 136.932 1.00 16.28 ? 789 HOH D O 1 +HETATM 22130 O O . HOH U 10 . ? 61.425 20.541 118.606 1.00 20.67 ? 790 HOH D O 1 +HETATM 22131 O O . HOH U 10 . ? 85.227 53.005 140.440 1.00 18.61 ? 791 HOH D O 1 +HETATM 22132 O O . HOH U 10 . ? 77.605 61.235 136.042 1.00 19.17 ? 792 HOH D O 1 +HETATM 22133 O O . HOH U 10 . ? 84.564 38.748 132.227 1.00 13.34 ? 793 HOH D O 1 +HETATM 22134 O O . HOH U 10 . ? 42.342 60.570 135.444 1.00 30.95 ? 794 HOH D O 1 +HETATM 22135 O O . HOH U 10 . ? 43.721 49.455 136.575 1.00 11.21 ? 795 HOH D O 1 +HETATM 22136 O O . HOH U 10 . ? 62.827 51.076 133.944 1.00 20.71 ? 796 HOH D O 1 +HETATM 22137 O O . HOH U 10 . ? 51.538 57.124 148.173 1.00 22.53 ? 797 HOH D O 1 +HETATM 22138 O O . HOH U 10 . ? 64.325 40.461 103.314 1.00 15.62 ? 798 HOH D O 1 +HETATM 22139 O O . HOH U 10 . ? 36.100 44.652 113.695 1.00 18.88 ? 799 HOH D O 1 +HETATM 22140 O O . HOH U 10 . ? 38.893 54.063 117.329 1.00 14.28 ? 800 HOH D O 1 +HETATM 22141 O O . HOH U 10 . ? 33.942 58.420 140.466 1.00 25.03 ? 801 HOH D O 1 +HETATM 22142 O O . HOH U 10 . ? 81.299 46.290 144.236 1.00 13.57 ? 802 HOH D O 1 +HETATM 22143 O O . HOH U 10 . ? 60.621 37.176 113.963 1.00 17.14 ? 803 HOH D O 1 +HETATM 22144 O O . HOH U 10 . ? 51.283 61.075 101.531 1.00 25.35 ? 804 HOH D O 1 +HETATM 22145 O O . HOH U 10 . ? 34.979 58.715 108.948 1.00 20.57 ? 805 HOH D O 1 +HETATM 22146 O O . HOH U 10 . ? 70.951 53.964 111.413 1.00 19.06 ? 806 HOH D O 1 +HETATM 22147 O O . HOH U 10 . ? 87.352 29.363 116.249 1.00 15.30 ? 807 HOH D O 1 +HETATM 22148 O O . HOH U 10 . ? 51.342 26.352 134.440 1.00 18.52 ? 808 HOH D O 1 +HETATM 22149 O O . HOH U 10 . ? 63.030 29.930 127.086 1.00 18.96 ? 809 HOH D O 1 +HETATM 22150 O O . HOH U 10 . ? 63.596 39.908 139.360 1.00 18.27 ? 810 HOH D O 1 +HETATM 22151 O O . HOH U 10 . ? 37.846 47.538 99.908 1.00 22.99 ? 811 HOH D O 1 +HETATM 22152 O O . HOH U 10 . ? 89.486 46.090 139.876 1.00 13.44 ? 812 HOH D O 1 +HETATM 22153 O O . HOH U 10 . ? 33.431 50.544 148.596 1.00 33.78 ? 813 HOH D O 1 +HETATM 22154 O O . HOH U 10 . ? 37.045 48.667 111.660 1.00 21.38 ? 814 HOH D O 1 +HETATM 22155 O O . HOH U 10 . ? 37.088 37.133 126.631 1.00 25.11 ? 815 HOH D O 1 +HETATM 22156 O O . HOH U 10 . ? 42.453 62.072 128.932 1.00 25.72 ? 816 HOH D O 1 +HETATM 22157 O O . HOH U 10 . ? 64.007 48.275 91.108 1.00 7.82 ? 817 HOH D O 1 +HETATM 22158 O O . HOH U 10 . ? 50.298 53.639 135.545 1.00 19.79 ? 818 HOH D O 1 +HETATM 22159 O O . HOH U 10 . ? 66.891 38.360 140.458 1.00 23.17 ? 819 HOH D O 1 +HETATM 22160 O O . HOH U 10 . ? 69.089 59.160 128.033 1.00 16.43 ? 820 HOH D O 1 +HETATM 22161 O O . HOH U 10 . ? 43.958 22.593 114.127 1.00 30.44 ? 821 HOH D O 1 +HETATM 22162 O O . HOH U 10 . ? 46.785 57.951 138.622 1.00 25.41 ? 822 HOH D O 1 +HETATM 22163 O O . HOH U 10 . ? 36.368 59.951 131.243 1.00 25.38 ? 823 HOH D O 1 +HETATM 22164 O O . HOH U 10 . ? 73.936 61.717 149.190 1.00 21.91 ? 824 HOH D O 1 +HETATM 22165 O O . HOH U 10 . ? 57.705 54.472 159.465 1.00 26.45 ? 825 HOH D O 1 +HETATM 22166 O O . HOH U 10 . ? 49.752 64.794 121.480 1.00 18.36 ? 826 HOH D O 1 +HETATM 22167 O O . HOH U 10 . ? 57.938 36.965 91.072 1.00 20.69 ? 827 HOH D O 1 +HETATM 22168 O O . HOH U 10 . ? 35.413 34.366 124.547 1.00 27.08 ? 828 HOH D O 1 +HETATM 22169 O O . HOH U 10 . ? 86.858 48.238 126.979 1.00 22.55 ? 829 HOH D O 1 +HETATM 22170 O O . HOH U 10 . ? 45.857 36.327 130.807 1.00 20.90 ? 830 HOH D O 1 +HETATM 22171 O O . HOH U 10 . ? 66.689 47.679 156.852 1.00 35.39 ? 831 HOH D O 1 +HETATM 22172 O O . HOH U 10 . ? 83.019 55.446 125.709 1.00 17.14 ? 832 HOH D O 1 +HETATM 22173 O O . HOH U 10 . ? 89.619 43.473 127.723 1.00 17.87 ? 833 HOH D O 1 +HETATM 22174 O O . HOH U 10 . ? 39.802 31.406 123.362 1.00 33.20 ? 834 HOH D O 1 +HETATM 22175 O O . HOH U 10 . ? 85.919 55.617 121.093 1.00 13.67 ? 835 HOH D O 1 +HETATM 22176 O O . HOH U 10 . ? 79.261 31.657 132.273 1.00 20.88 ? 836 HOH D O 1 +HETATM 22177 O O . HOH U 10 . ? 45.344 30.504 138.712 1.00 18.10 ? 837 HOH D O 1 +HETATM 22178 O O . HOH U 10 . ? 54.469 56.027 91.684 1.00 15.30 ? 838 HOH D O 1 +HETATM 22179 O O . HOH U 10 . ? 52.039 55.595 86.297 1.00 17.39 ? 839 HOH D O 1 +HETATM 22180 O O . HOH U 10 . ? 60.141 40.483 109.073 1.00 17.88 ? 840 HOH D O 1 +HETATM 22181 O O . HOH U 10 . ? 75.775 40.168 119.420 1.00 11.95 ? 841 HOH D O 1 +HETATM 22182 O O . HOH U 10 . ? 52.538 52.597 140.325 1.00 21.74 ? 842 HOH D O 1 +HETATM 22183 O O . HOH U 10 . ? 55.238 48.425 134.381 1.00 14.24 ? 843 HOH D O 1 +HETATM 22184 O O . HOH U 10 . ? 76.029 43.842 112.330 1.00 20.84 ? 844 HOH D O 1 +HETATM 22185 O O . HOH U 10 . ? 68.284 47.776 158.935 1.00 34.91 ? 845 HOH D O 1 +HETATM 22186 O O . HOH U 10 . ? 67.377 60.712 118.462 1.00 24.28 ? 846 HOH D O 1 +HETATM 22187 O O . HOH U 10 . ? 67.008 58.666 108.180 1.00 11.56 ? 847 HOH D O 1 +HETATM 22188 O O . HOH U 10 . ? 46.226 44.463 95.022 1.00 12.14 ? 848 HOH D O 1 +HETATM 22189 O O . HOH U 10 . ? 69.496 41.019 149.901 1.00 43.10 ? 849 HOH D O 1 +HETATM 22190 O O . HOH U 10 . ? 88.742 33.760 140.507 1.00 14.16 ? 850 HOH D O 1 +HETATM 22191 O O . HOH U 10 . ? 69.667 39.987 133.529 1.00 10.15 ? 851 HOH D O 1 +HETATM 22192 O O . HOH U 10 . ? 91.624 33.701 127.899 1.00 13.55 ? 852 HOH D O 1 +HETATM 22193 O O . HOH U 10 . ? 57.550 55.598 157.081 1.00 22.46 ? 853 HOH D O 1 +HETATM 22194 O O . HOH U 10 . ? 64.374 56.167 105.638 1.00 14.19 ? 854 HOH D O 1 +HETATM 22195 O O . HOH U 10 . ? 55.945 47.341 137.587 1.00 25.14 ? 855 HOH D O 1 +HETATM 22196 O O . HOH U 10 . ? 91.569 44.518 140.585 1.00 19.09 ? 857 HOH D O 1 +HETATM 22197 O O . HOH U 10 . ? 64.570 62.373 109.569 1.00 12.11 ? 860 HOH D O 1 +HETATM 22198 O O . HOH U 10 . ? 76.663 58.353 142.050 1.00 26.18 ? 862 HOH D O 1 +HETATM 22199 O O . HOH U 10 . ? 43.101 41.789 143.062 1.00 23.99 ? 863 HOH D O 1 +HETATM 22200 O O . HOH U 10 . ? 35.470 35.087 105.326 1.00 20.77 ? 864 HOH D O 1 +HETATM 22201 O O . HOH U 10 . ? 87.506 50.540 123.927 1.00 28.75 ? 865 HOH D O 1 +HETATM 22202 O O . HOH U 10 . ? 61.568 37.070 91.851 1.00 22.38 ? 877 HOH D O 1 +HETATM 22203 O O . HOH U 10 . ? 46.809 41.967 158.956 1.00 36.61 ? 884 HOH D O 1 +HETATM 22204 O O . HOH U 10 . ? 59.084 51.925 87.348 1.00 16.83 ? 886 HOH D O 1 +HETATM 22205 O O . HOH U 10 . ? 85.167 35.363 140.234 1.00 22.13 ? 894 HOH D O 1 +HETATM 22206 O O . HOH U 10 . ? 33.794 51.766 112.417 1.00 32.00 ? 896 HOH D O 1 +HETATM 22207 O O . HOH U 10 . ? 74.582 36.170 109.084 1.00 15.16 ? 901 HOH D O 1 +HETATM 22208 O O . HOH U 10 . ? 94.498 31.930 112.532 1.00 26.62 ? 908 HOH D O 1 +HETATM 22209 O O . HOH U 10 . ? 62.628 43.837 155.849 1.00 21.48 ? 920 HOH D O 1 +HETATM 22210 O O . HOH U 10 . ? 73.467 45.341 106.391 1.00 15.19 ? 921 HOH D O 1 +HETATM 22211 O O . HOH U 10 . ? 35.646 44.338 117.637 1.00 15.72 ? 923 HOH D O 1 +HETATM 22212 O O . HOH U 10 . ? 63.355 40.025 143.777 1.00 38.16 ? 926 HOH D O 1 +HETATM 22213 O O . HOH U 10 . ? 43.294 43.787 133.699 1.00 14.90 ? 935 HOH D O 1 +HETATM 22214 O O . HOH U 10 . ? 32.180 57.315 142.207 1.00 29.74 ? 938 HOH D O 1 +HETATM 22215 O O . HOH U 10 . ? 49.586 40.674 87.237 1.00 28.09 ? 944 HOH D O 1 +HETATM 22216 O O . HOH U 10 . ? 64.506 29.599 124.830 1.00 13.15 ? 946 HOH D O 1 +HETATM 22217 O O . HOH U 10 . ? 67.038 39.849 145.258 1.00 21.00 ? 949 HOH D O 1 +HETATM 22218 O O . HOH U 10 . ? 53.559 58.186 146.407 1.00 24.49 ? 954 HOH D O 1 +HETATM 22219 O O . HOH U 10 . ? 44.227 33.631 138.085 1.00 23.72 ? 961 HOH D O 1 +HETATM 22220 O O . HOH U 10 . ? 34.686 49.179 105.361 1.00 36.99 ? 962 HOH D O 1 +HETATM 22221 O O . HOH U 10 . ? 45.934 42.458 137.578 1.00 16.01 ? 970 HOH D O 1 +HETATM 22222 O O . HOH U 10 . ? 60.334 54.141 120.103 1.00 32.64 ? 973 HOH D O 1 +HETATM 22223 O O . HOH U 10 . ? 64.093 38.148 101.251 1.00 19.37 ? 983 HOH D O 1 +HETATM 22224 O O . HOH U 10 . ? 56.844 62.169 143.601 1.00 32.31 ? 984 HOH D O 1 +HETATM 22225 O O . HOH U 10 . ? 78.797 37.533 116.275 1.00 17.82 ? 986 HOH D O 1 +HETATM 22226 O O . HOH U 10 . ? 63.359 53.339 123.711 1.00 25.82 ? 999 HOH D O 1 +HETATM 22227 O O . HOH U 10 . ? 53.756 58.866 132.610 1.00 18.21 ? 1001 HOH D O 1 +HETATM 22228 O O . HOH U 10 . ? 37.228 49.985 100.693 1.00 20.24 ? 1002 HOH D O 1 +HETATM 22229 O O . HOH U 10 . ? 55.451 38.500 156.671 1.00 37.75 ? 1005 HOH D O 1 +HETATM 22230 O O . HOH U 10 . ? 66.288 60.713 148.521 1.00 26.96 ? 1006 HOH D O 1 +HETATM 22231 O O . HOH U 10 . ? 51.014 49.414 136.849 1.00 16.54 ? 1009 HOH D O 1 +HETATM 22232 O O . HOH U 10 . ? 46.133 25.930 112.083 1.00 30.88 ? 1013 HOH D O 1 +HETATM 22233 O O . HOH U 10 . ? 40.840 34.488 127.448 1.00 23.29 ? 1014 HOH D O 1 +HETATM 22234 O O . HOH U 10 . ? 81.378 32.505 122.917 1.00 14.59 ? 1022 HOH D O 1 +HETATM 22235 O O . HOH U 10 . ? 37.752 52.524 104.574 1.00 15.75 ? 1031 HOH D O 1 +HETATM 22236 O O . HOH U 10 . ? 43.218 52.343 100.280 1.00 13.16 ? 1038 HOH D O 1 +HETATM 22237 O O . HOH U 10 . ? 57.429 57.179 134.222 1.00 30.64 ? 1041 HOH D O 1 +HETATM 22238 O O . HOH U 10 . ? 66.070 38.414 99.430 1.00 24.48 ? 1042 HOH D O 1 +HETATM 22239 O O . HOH U 10 . ? 60.317 47.122 147.781 1.00 14.82 ? 1052 HOH D O 1 +HETATM 22240 O O . HOH U 10 . ? 68.607 38.193 112.188 1.00 31.53 ? 1060 HOH D O 1 +HETATM 22241 O O . HOH U 10 . ? 67.094 58.736 103.152 1.00 15.95 ? 1065 HOH D O 1 +HETATM 22242 O O . HOH U 10 . ? 51.641 46.468 90.098 1.00 28.93 ? 1069 HOH D O 1 +HETATM 22243 O O . HOH U 10 . ? 90.030 28.941 115.074 1.00 36.48 ? 1071 HOH D O 1 +HETATM 22244 O O . HOH U 10 . ? 86.406 27.119 132.977 1.00 20.59 ? 1072 HOH D O 1 +HETATM 22245 O O . HOH U 10 . ? 66.868 41.041 148.593 1.00 39.23 ? 1078 HOH D O 1 +HETATM 22246 O O . HOH U 10 . ? 38.245 41.341 136.048 1.00 38.68 ? 1084 HOH D O 1 +HETATM 22247 O O . HOH U 10 . ? 65.119 64.905 111.063 1.00 13.01 ? 1104 HOH D O 1 +HETATM 22248 O O . HOH U 10 . ? 32.825 59.138 138.214 1.00 28.79 ? 1107 HOH D O 1 +HETATM 22249 O O . HOH U 10 . ? 60.685 31.352 113.335 1.00 32.06 ? 1112 HOH D O 1 +HETATM 22250 O O . HOH U 10 . ? 85.241 36.301 117.890 1.00 40.10 ? 1118 HOH D O 1 +HETATM 22251 O O . HOH U 10 . ? 48.603 61.229 101.954 1.00 37.47 ? 1127 HOH D O 1 +HETATM 22252 O O . HOH U 10 . ? 64.543 51.407 127.665 1.00 22.23 ? 1132 HOH D O 1 +HETATM 22253 O O . HOH U 10 . ? 46.348 31.829 103.492 1.00 20.59 ? 1138 HOH D O 1 +HETATM 22254 O O . HOH U 10 . ? 32.678 42.548 127.798 1.00 27.95 ? 1140 HOH D O 1 +HETATM 22255 O O . HOH U 10 . ? 75.042 35.529 112.080 1.00 29.05 ? 1151 HOH D O 1 +HETATM 22256 O O . HOH U 10 . ? 40.898 61.649 108.060 1.00 26.66 ? 1155 HOH D O 1 +HETATM 22257 O O . HOH U 10 . ? 66.934 56.457 105.000 1.00 18.87 ? 1157 HOH D O 1 +HETATM 22258 O O . HOH U 10 . ? 82.112 37.029 144.083 1.00 21.48 ? 1161 HOH D O 1 +HETATM 22259 O O . HOH U 10 . ? 32.385 54.168 147.623 1.00 36.89 ? 1166 HOH D O 1 +HETATM 22260 O O . HOH U 10 . ? 55.538 28.274 110.715 1.00 15.15 ? 1168 HOH D O 1 +HETATM 22261 O O . HOH U 10 . ? 62.711 48.946 137.276 1.00 13.76 ? 1177 HOH D O 1 +HETATM 22262 O O . HOH U 10 . ? 84.887 26.571 109.355 1.00 27.35 ? 1178 HOH D O 1 +HETATM 22263 O O . HOH U 10 . ? 64.352 60.056 93.067 1.00 30.71 ? 1188 HOH D O 1 +HETATM 22264 O O . HOH U 10 . ? 42.134 46.684 159.554 1.00 28.39 ? 1192 HOH D O 1 +HETATM 22265 O O . HOH U 10 . ? 71.290 38.821 109.664 1.00 26.29 ? 1205 HOH D O 1 +HETATM 22266 O O . HOH U 10 . ? 92.205 42.261 139.440 1.00 22.04 ? 1206 HOH D O 1 +HETATM 22267 O O . HOH U 10 . ? 49.017 68.403 113.296 1.00 33.38 ? 1212 HOH D O 1 +HETATM 22268 O O . HOH U 10 . ? 56.185 58.065 132.181 1.00 23.00 ? 1217 HOH D O 1 +HETATM 22269 O O . HOH U 10 . ? 57.066 36.773 108.260 1.00 22.20 ? 1226 HOH D O 1 +HETATM 22270 O O . HOH U 10 . ? 38.315 44.311 153.066 1.00 37.75 ? 1233 HOH D O 1 +HETATM 22271 O O . HOH U 10 . ? 59.411 54.929 123.527 1.00 37.82 ? 1234 HOH D O 1 +HETATM 22272 O O . HOH U 10 . ? 77.795 56.040 150.897 1.00 27.57 ? 1236 HOH D O 1 +HETATM 22273 O O . HOH U 10 . ? 46.359 23.269 113.852 1.00 37.70 ? 1237 HOH D O 1 +HETATM 22274 O O . HOH U 10 . ? 85.208 47.305 148.494 1.00 32.27 ? 1238 HOH D O 1 +HETATM 22275 O O . HOH U 10 . ? 41.173 62.918 122.736 1.00 26.77 ? 1239 HOH D O 1 +HETATM 22276 O O . HOH U 10 . ? 50.733 56.948 141.447 1.00 21.80 ? 1243 HOH D O 1 +HETATM 22277 O O . HOH U 10 . ? 37.944 64.015 113.490 1.00 37.29 ? 1245 HOH D O 1 +HETATM 22278 O O . HOH U 10 . ? 48.091 24.538 102.886 1.00 44.33 ? 1247 HOH D O 1 +HETATM 22279 O O . HOH U 10 . ? 49.247 47.569 90.811 1.00 39.98 ? 1251 HOH D O 1 +HETATM 22280 O O . HOH U 10 . ? 80.901 36.931 117.622 1.00 37.12 ? 1254 HOH D O 1 +HETATM 22281 O O . HOH U 10 . ? 91.423 24.302 106.703 1.00 36.62 ? 1257 HOH D O 1 +HETATM 22282 O O . HOH U 10 . ? 83.623 54.634 138.935 1.00 25.39 ? 1271 HOH D O 1 +HETATM 22283 O O . HOH U 10 . ? 41.924 64.964 120.445 1.00 32.63 ? 1272 HOH D O 1 +HETATM 22284 O O . HOH U 10 . ? 42.332 41.858 92.904 1.00 23.60 ? 1273 HOH D O 1 +HETATM 22285 O O . HOH U 10 . ? 71.423 26.561 126.396 1.00 33.53 ? 1280 HOH D O 1 +HETATM 22286 O O . HOH U 10 . ? 67.289 46.294 118.927 1.00 8.93 ? 1282 HOH D O 1 +HETATM 22287 O O . HOH U 10 . ? 62.140 47.186 133.108 1.00 9.82 ? 1283 HOH D O 1 +HETATM 22288 O O . HOH U 10 . ? 70.075 41.414 109.392 1.00 11.10 ? 1292 HOH D O 1 +HETATM 22289 O O . HOH U 10 . ? 64.342 53.013 132.237 1.00 17.11 ? 1298 HOH D O 1 +HETATM 22290 O O . HOH U 10 . ? 62.726 33.629 112.912 1.00 20.27 ? 1301 HOH D O 1 +HETATM 22291 O O . HOH U 10 . ? 57.526 45.837 145.148 1.00 12.54 ? 1303 HOH D O 1 +HETATM 22292 O O . HOH U 10 . ? 71.316 58.264 129.574 1.00 13.24 ? 1309 HOH D O 1 +HETATM 22293 O O . HOH U 10 . ? 47.716 22.040 117.973 1.00 21.94 ? 1317 HOH D O 1 +HETATM 22294 O O . HOH U 10 . ? 47.499 51.589 95.350 1.00 19.25 ? 1318 HOH D O 1 +HETATM 22295 O O . HOH U 10 . ? 84.816 28.566 134.710 1.00 20.84 ? 1325 HOH D O 1 +HETATM 22296 O O . HOH U 10 . ? 71.890 53.778 118.745 1.00 28.24 ? 1332 HOH D O 1 +HETATM 22297 O O . HOH U 10 . ? 54.079 49.258 139.293 1.00 16.95 ? 1334 HOH D O 1 +HETATM 22298 O O . HOH U 10 . ? 55.246 54.147 140.710 1.00 22.52 ? 1335 HOH D O 1 +HETATM 22299 O O . HOH U 10 . ? 44.307 59.585 138.963 1.00 28.76 ? 1339 HOH D O 1 +HETATM 22300 O O . HOH U 10 . ? 69.717 59.902 131.394 1.00 23.67 ? 1353 HOH D O 1 +HETATM 22301 O O . HOH U 10 . ? 86.730 52.477 138.109 1.00 18.36 ? 1355 HOH D O 1 +HETATM 22302 O O . HOH U 10 . ? 58.551 35.267 95.336 1.00 21.41 ? 1356 HOH D O 1 +HETATM 22303 O O . HOH U 10 . ? 54.137 45.147 139.694 1.00 16.89 ? 1357 HOH D O 1 +HETATM 22304 O O . HOH U 10 . ? 43.310 49.963 93.805 1.00 21.75 ? 1359 HOH D O 1 +HETATM 22305 O O . HOH U 10 . ? 44.163 45.444 157.816 1.00 24.34 ? 1362 HOH D O 1 +HETATM 22306 O O . HOH U 10 . ? 56.472 18.481 113.901 1.00 30.35 ? 1363 HOH D O 1 +HETATM 22307 O O . HOH U 10 . ? 64.487 61.404 94.953 1.00 17.93 ? 1367 HOH D O 1 +HETATM 22308 O O . HOH U 10 . ? 57.503 49.610 87.922 1.00 22.19 ? 1369 HOH D O 1 +HETATM 22309 O O . HOH U 10 . ? 64.350 26.118 132.519 1.00 22.12 ? 1385 HOH D O 1 +HETATM 22310 O O . HOH U 10 . ? 89.390 37.503 121.934 1.00 27.34 ? 1394 HOH D O 1 +HETATM 22311 O O . HOH U 10 . ? 85.273 41.182 147.172 1.00 38.40 ? 1399 HOH D O 1 +HETATM 22312 O O . HOH U 10 . ? 32.349 45.221 131.027 1.00 21.88 ? 1401 HOH D O 1 +HETATM 22313 O O . HOH U 10 . ? 69.631 49.042 133.017 1.00 15.86 ? 1407 HOH D O 1 +HETATM 22314 O O . HOH U 10 . ? 53.850 27.400 108.599 1.00 22.43 ? 1408 HOH D O 1 +HETATM 22315 O O . HOH U 10 . ? 58.507 39.101 155.137 1.00 37.73 ? 1411 HOH D O 1 +HETATM 22316 O O . HOH U 10 . ? 38.848 42.417 131.667 1.00 19.59 ? 1413 HOH D O 1 +HETATM 22317 O O . HOH U 10 . ? 53.649 34.211 97.064 1.00 26.90 ? 1415 HOH D O 1 +HETATM 22318 O O . HOH U 10 . ? 82.546 44.855 116.573 1.00 24.43 ? 1422 HOH D O 1 +HETATM 22319 O O . HOH U 10 . ? 93.768 35.502 132.993 1.00 20.41 ? 1425 HOH D O 1 +HETATM 22320 O O . HOH U 10 . ? 65.159 57.799 93.796 1.00 15.76 ? 1431 HOH D O 1 +HETATM 22321 O O . HOH U 10 . ? 62.562 28.878 123.172 1.00 27.22 ? 1437 HOH D O 1 +HETATM 22322 O O . HOH U 10 . ? 47.147 51.711 158.070 1.00 21.54 ? 1447 HOH D O 1 +HETATM 22323 O O . HOH U 10 . ? 65.298 45.032 155.424 1.00 27.75 ? 1450 HOH D O 1 +HETATM 22324 O O . HOH U 10 . ? 52.174 39.007 140.324 1.00 22.77 ? 1455 HOH D O 1 +HETATM 22325 O O . HOH U 10 . ? 68.193 61.427 142.699 1.00 28.83 ? 1468 HOH D O 1 +HETATM 22326 O O . HOH U 10 . ? 64.387 56.519 137.413 1.00 26.75 ? 1471 HOH D O 1 +HETATM 22327 O O . HOH U 10 . ? 83.464 32.425 137.065 1.00 50.42 ? 1476 HOH D O 1 +HETATM 22328 O O . HOH U 10 . ? 72.363 28.087 114.163 1.00 23.04 ? 1480 HOH D O 1 +HETATM 22329 O O . HOH U 10 . ? 43.799 60.099 141.569 1.00 26.62 ? 1484 HOH D O 1 +HETATM 22330 O O . HOH U 10 . ? 60.836 42.624 111.063 1.00 15.39 ? 1487 HOH D O 1 +HETATM 22331 O O . HOH U 10 . ? 64.451 19.974 121.324 1.00 46.44 ? 1496 HOH D O 1 +HETATM 22332 O O . HOH U 10 . ? 60.806 54.371 146.493 1.00 17.10 ? 1497 HOH D O 1 +HETATM 22333 O O . HOH U 10 . ? 62.538 34.305 134.676 1.00 35.20 ? 1498 HOH D O 1 +HETATM 22334 O O . HOH U 10 . ? 45.053 31.557 140.915 1.00 23.20 ? 1499 HOH D O 1 +HETATM 22335 O O . HOH U 10 . ? 51.987 55.595 95.392 1.00 19.00 ? 1504 HOH D O 1 +HETATM 22336 O O . HOH U 10 . ? 65.235 60.215 134.817 1.00 43.46 ? 1507 HOH D O 1 +HETATM 22337 O O . HOH U 10 . ? 84.340 41.865 119.456 1.00 26.65 ? 1508 HOH D O 1 +HETATM 22338 O O . HOH U 10 . ? 37.536 46.757 153.211 1.00 26.27 ? 1516 HOH D O 1 +HETATM 22339 O O . HOH U 10 . ? 40.541 46.794 91.778 1.00 36.05 ? 1518 HOH D O 1 +HETATM 22340 O O . HOH U 10 . ? 96.923 41.932 128.603 1.00 34.51 ? 1521 HOH D O 1 +HETATM 22341 O O . HOH U 10 . ? 39.731 52.394 154.872 1.00 22.77 ? 1523 HOH D O 1 +HETATM 22342 O O . HOH U 10 . ? 60.359 19.356 116.429 1.00 31.85 ? 1524 HOH D O 1 +HETATM 22343 O O . HOH U 10 . ? 69.973 39.363 104.322 1.00 34.20 ? 1527 HOH D O 1 +HETATM 22344 O O . HOH U 10 . ? 83.669 33.335 139.530 1.00 41.83 ? 1529 HOH D O 1 +HETATM 22345 O O . HOH U 10 . ? 39.869 43.389 98.656 1.00 20.06 ? 1531 HOH D O 1 +HETATM 22346 O O . HOH U 10 . ? 65.707 36.477 139.251 1.00 33.10 ? 1540 HOH D O 1 +HETATM 22347 O O . HOH U 10 . ? 48.529 55.464 88.653 1.00 26.42 ? 1542 HOH D O 1 +HETATM 22348 O O . HOH U 10 . ? 91.237 45.304 148.996 1.00 31.44 ? 1545 HOH D O 1 +HETATM 22349 O O . HOH U 10 . ? 59.901 44.950 144.419 1.00 28.65 ? 1547 HOH D O 1 +HETATM 22350 O O . HOH U 10 . ? 46.262 64.628 114.175 1.00 32.61 ? 1552 HOH D O 1 +HETATM 22351 O O . HOH U 10 . ? 46.979 49.476 91.307 1.00 29.88 ? 1558 HOH D O 1 +HETATM 22352 O O . HOH U 10 . ? 32.365 43.764 133.926 1.00 26.08 ? 1574 HOH D O 1 +HETATM 22353 O O . HOH U 10 . ? 40.524 60.033 104.401 1.00 35.19 ? 1575 HOH D O 1 +HETATM 22354 O O . HOH U 10 . ? 63.681 35.339 92.887 1.00 30.94 ? 1579 HOH D O 1 +HETATM 22355 O O . HOH U 10 . ? 58.719 17.732 132.460 1.00 33.10 ? 1581 HOH D O 1 +HETATM 22356 O O . HOH U 10 . ? 70.041 43.876 153.751 1.00 22.83 ? 1591 HOH D O 1 +HETATM 22357 O O . HOH U 10 . ? 89.048 46.309 127.637 1.00 20.14 ? 1593 HOH D O 1 +HETATM 22358 O O . HOH U 10 . ? 68.002 20.000 116.152 1.00 36.41 ? 1594 HOH D O 1 +HETATM 22359 O O . HOH U 10 . ? 48.769 35.559 139.547 1.00 37.18 ? 1610 HOH D O 1 +HETATM 22360 O O . HOH U 10 . ? 61.293 50.752 159.408 1.00 26.39 ? 1615 HOH D O 1 +HETATM 22361 O O . HOH U 10 . ? 34.996 57.859 131.537 1.00 25.26 ? 1623 HOH D O 1 +HETATM 22362 O O . HOH U 10 . ? 90.906 42.545 121.482 1.00 32.02 ? 1632 HOH D O 1 +HETATM 22363 O O . HOH U 10 . ? 85.977 32.096 139.987 1.00 63.93 ? 1635 HOH D O 1 +HETATM 22364 O O . HOH U 10 . ? 44.827 44.393 89.877 1.00 33.46 ? 1639 HOH D O 1 +HETATM 22365 O O . HOH U 10 . ? 44.963 64.643 118.835 1.00 31.88 ? 1641 HOH D O 1 +HETATM 22366 O O . HOH U 10 . ? 34.573 40.853 100.082 1.00 27.55 ? 1643 HOH D O 1 +HETATM 22367 O O . HOH U 10 . ? 82.697 59.313 137.275 1.00 32.19 ? 1646 HOH D O 1 +HETATM 22368 O O . HOH U 10 . ? 51.601 66.489 124.410 1.00 16.29 ? 1651 HOH D O 1 +HETATM 22369 O O . HOH U 10 . ? 40.500 42.011 156.532 1.00 43.93 ? 1652 HOH D O 1 +HETATM 22370 O O . HOH U 10 . ? 70.341 55.612 164.264 1.00 39.79 ? 1655 HOH D O 1 +HETATM 22371 O O . HOH U 10 . ? 31.171 41.249 113.946 1.00 31.15 ? 1656 HOH D O 1 +HETATM 22372 O O . HOH U 10 . ? 43.017 49.300 158.712 1.00 32.04 ? 1666 HOH D O 1 +HETATM 22373 O O . HOH U 10 . ? 64.336 19.783 127.882 1.00 35.28 ? 1668 HOH D O 1 +HETATM 22374 O O . HOH U 10 . ? 73.809 45.874 159.477 1.00 35.51 ? 1671 HOH D O 1 +HETATM 22375 O O . HOH U 10 . ? 34.792 49.007 150.704 1.00 26.90 ? 1674 HOH D O 1 +HETATM 22376 O O . HOH U 10 . ? 71.300 60.890 142.501 1.00 34.06 ? 1679 HOH D O 1 +HETATM 22377 O O . HOH U 10 . ? 48.197 59.283 146.966 1.00 23.54 ? 1684 HOH D O 1 +HETATM 22378 O O . HOH U 10 . ? 32.264 50.464 119.377 1.00 30.94 ? 1698 HOH D O 1 +HETATM 22379 O O . HOH U 10 . ? 38.255 23.801 111.072 1.00 46.35 ? 1704 HOH D O 1 +HETATM 22380 O O . HOH U 10 . ? 91.853 25.139 113.642 1.00 25.18 ? 1709 HOH D O 1 +HETATM 22381 O O . HOH U 10 . ? 39.466 24.961 106.910 1.00 28.54 ? 1710 HOH D O 1 +HETATM 22382 O O . HOH U 10 . ? 70.993 61.861 156.301 1.00 25.68 ? 1720 HOH D O 1 +HETATM 22383 O O . HOH U 10 . ? 71.136 22.971 120.984 1.00 33.43 ? 1724 HOH D O 1 +HETATM 22384 O O . HOH U 10 . ? 75.334 18.210 119.989 1.00 47.65 ? 1725 HOH D O 1 +HETATM 22385 O O . HOH U 10 . ? 62.789 18.306 126.249 1.00 31.85 ? 1726 HOH D O 1 +HETATM 22386 O O . HOH U 10 . ? 76.570 37.493 113.760 1.00 22.22 ? 1730 HOH D O 1 +HETATM 22387 O O . HOH U 10 . ? 61.128 54.629 139.511 1.00 28.08 ? 1739 HOH D O 1 +HETATM 22388 O O . HOH U 10 . ? 39.704 38.638 129.124 1.00 26.49 ? 1743 HOH D O 1 +HETATM 22389 O O . HOH U 10 . ? 60.333 45.112 160.225 1.00 18.71 ? 1746 HOH D O 1 +HETATM 22390 O O . HOH U 10 . ? 71.355 38.423 112.339 1.00 28.18 ? 1757 HOH D O 1 +HETATM 22391 O O . HOH U 10 . ? 40.477 35.310 97.595 1.00 28.09 ? 1759 HOH D O 1 +HETATM 22392 O O . HOH U 10 . ? 67.716 61.651 146.044 1.00 31.21 ? 1760 HOH D O 1 +HETATM 22393 O O . HOH U 10 . ? 94.197 24.455 112.762 1.00 31.72 ? 1764 HOH D O 1 +HETATM 22394 O O . HOH U 10 . ? 59.083 52.713 121.662 1.00 21.64 ? 1769 HOH D O 1 +HETATM 22395 O O . HOH U 10 . ? 69.627 34.157 139.030 1.00 35.91 ? 1770 HOH D O 1 +HETATM 22396 O O . HOH U 10 . ? 42.240 34.810 129.700 1.00 24.48 ? 1776 HOH D O 1 +HETATM 22397 O O . HOH U 10 . ? 44.517 44.837 92.618 1.00 26.37 ? 1782 HOH D O 1 +HETATM 22398 O O . HOH U 10 . ? 60.704 40.688 159.573 1.00 37.12 ? 1791 HOH D O 1 +HETATM 22399 O O . HOH U 10 . ? 32.967 55.314 124.719 1.00 41.05 ? 1794 HOH D O 1 +HETATM 22400 O O . HOH U 10 . ? 60.885 60.252 153.510 1.00 35.06 ? 1800 HOH D O 1 +HETATM 22401 O O . HOH U 10 . ? 37.181 40.593 145.516 1.00 34.14 ? 1806 HOH D O 1 +HETATM 22402 O O . HOH U 10 . ? 32.901 60.985 123.684 1.00 31.66 ? 1809 HOH D O 1 +HETATM 22403 O O . HOH U 10 . ? 88.835 31.928 100.586 1.00 25.54 ? 1811 HOH D O 1 +HETATM 22404 O O . HOH U 10 . ? 63.275 37.355 138.864 1.00 21.80 ? 1819 HOH D O 1 +HETATM 22405 O O . HOH U 10 . ? 61.928 42.929 158.871 1.00 31.79 ? 1825 HOH D O 1 +HETATM 22406 O O . HOH U 10 . ? 43.440 62.804 123.825 1.00 40.72 ? 1826 HOH D O 1 +HETATM 22407 O O . HOH U 10 . ? 55.608 59.881 143.861 1.00 38.19 ? 1828 HOH D O 1 +HETATM 22408 O O . HOH U 10 . ? 44.832 63.452 108.340 1.00 38.18 ? 1838 HOH D O 1 +HETATM 22409 O O . HOH U 10 . ? 46.576 27.083 125.934 1.00 10.53 ? 1842 HOH D O 1 +HETATM 22410 O O . HOH U 10 . ? 33.457 50.171 107.330 1.00 49.09 ? 1847 HOH D O 1 +HETATM 22411 O O . HOH U 10 . ? 63.026 54.003 137.207 1.00 24.70 ? 1848 HOH D O 1 +HETATM 22412 O O . HOH U 10 . ? 82.913 57.267 135.590 1.00 33.44 ? 1854 HOH D O 1 +HETATM 22413 O O . HOH U 10 . ? 87.081 36.130 146.442 1.00 23.86 ? 1860 HOH D O 1 +HETATM 22414 O O . HOH U 10 . ? 50.134 54.708 158.915 1.00 39.65 ? 1868 HOH D O 1 +HETATM 22415 O O . HOH U 10 . ? 62.805 52.801 126.422 1.00 29.97 ? 1871 HOH D O 1 +HETATM 22416 O O . HOH U 10 . ? 40.091 27.394 106.281 1.00 20.10 ? 1881 HOH D O 1 +HETATM 22417 O O . HOH U 10 . ? 49.276 56.050 95.698 1.00 39.08 ? 1894 HOH D O 1 +HETATM 22418 O O . HOH U 10 . ? 38.692 62.304 109.390 1.00 32.02 ? 1896 HOH D O 1 +HETATM 22419 O O . HOH U 10 . ? 66.328 38.421 142.760 1.00 26.08 ? 1897 HOH D O 1 +HETATM 22420 O O . HOH U 10 . ? 90.358 56.075 130.235 1.00 33.81 ? 1905 HOH D O 1 +HETATM 22421 O O . HOH U 10 . ? 30.362 39.445 119.374 1.00 25.87 ? 1908 HOH D O 1 +HETATM 22422 O O . HOH U 10 . ? 43.559 41.712 156.347 1.00 25.93 ? 1911 HOH D O 1 +HETATM 22423 O O . HOH U 10 . ? 59.912 57.095 135.863 1.00 51.59 ? 1920 HOH D O 1 +HETATM 22424 O O . HOH U 10 . ? 98.580 41.522 130.498 1.00 53.73 ? 1922 HOH D O 1 +HETATM 22425 O O . HOH U 10 . ? 71.735 33.803 110.799 1.00 43.14 ? 1925 HOH D O 1 +HETATM 22426 O O . HOH U 10 . ? 55.022 39.493 148.157 1.00 23.82 ? 1928 HOH D O 1 +HETATM 22427 O O . HOH U 10 . ? 68.824 57.540 106.698 1.00 30.07 ? 1935 HOH D O 1 +HETATM 22428 O O . HOH U 10 . ? 66.441 61.908 160.038 1.00 42.77 ? 1939 HOH D O 1 +HETATM 22429 O O . HOH U 10 . ? 69.931 27.687 110.661 1.00 34.88 ? 1940 HOH D O 1 +HETATM 22430 O O . HOH U 10 . ? 62.973 56.835 135.130 1.00 38.47 ? 1942 HOH D O 1 +HETATM 22431 O O . HOH U 10 . ? 84.326 53.086 147.410 1.00 33.06 ? 1945 HOH D O 1 +HETATM 22432 O O . HOH U 10 . ? 72.971 19.995 120.264 1.00 34.30 ? 1954 HOH D O 1 +HETATM 22433 O O . HOH U 10 . ? 49.657 59.209 95.580 1.00 34.94 ? 1957 HOH D O 1 +HETATM 22434 O O . HOH U 10 . ? 40.928 41.410 153.982 1.00 38.71 ? 1961 HOH D O 1 +HETATM 22435 O O . HOH U 10 . ? 68.937 34.409 110.562 1.00 23.67 ? 1964 HOH D O 1 +HETATM 22436 O O . HOH U 10 . ? 60.007 53.684 160.051 1.00 33.55 ? 1973 HOH D O 1 +HETATM 22437 O O . HOH U 10 . ? 81.806 29.349 106.954 1.00 32.45 ? 1981 HOH D O 1 +HETATM 22438 O O . HOH U 10 . ? 46.223 59.011 155.903 1.00 41.13 ? 1983 HOH D O 1 +HETATM 22439 O O . HOH U 10 . ? 89.983 52.732 146.373 1.00 42.24 ? 1989 HOH D O 1 +HETATM 22440 O O . HOH U 10 . ? 56.146 32.519 96.792 1.00 29.08 ? 1995 HOH D O 1 +HETATM 22441 O O . HOH U 10 . ? 48.406 41.333 161.640 1.00 36.37 ? 1996 HOH D O 1 +HETATM 22442 O O . HOH U 10 . ? 62.078 55.853 153.533 1.00 38.05 ? 1999 HOH D O 1 +HETATM 22443 O O . HOH U 10 . ? 32.553 58.569 131.650 1.00 33.16 ? 2001 HOH D O 1 +HETATM 22444 O O . HOH U 10 . ? 56.122 57.777 156.818 1.00 35.52 ? 2005 HOH D O 1 +HETATM 22445 O O . HOH U 10 . ? 93.205 43.573 120.384 1.00 57.22 ? 2007 HOH D O 1 +HETATM 22446 O O . HOH U 10 . ? 46.252 67.733 108.908 1.00 31.19 ? 2013 HOH D O 1 +HETATM 22447 O O . HOH U 10 . ? 84.283 53.014 124.907 1.00 36.58 ? 2017 HOH D O 1 +HETATM 22448 O O . HOH U 10 . ? 48.990 26.882 134.833 1.00 20.37 ? 2021 HOH D O 1 +HETATM 22449 O O . HOH U 10 . ? 34.174 30.572 109.966 1.00 29.81 ? 2027 HOH D O 1 +HETATM 22450 O O . HOH U 10 . ? 67.297 34.737 139.898 1.00 48.42 ? 2031 HOH D O 1 +HETATM 22451 O O . HOH U 10 . ? 31.825 31.233 109.115 1.00 34.28 ? 2034 HOH D O 1 +HETATM 22452 O O . HOH U 10 . ? 76.590 33.683 110.850 1.00 36.52 ? 2037 HOH D O 1 +HETATM 22453 O O . HOH U 10 . ? 58.037 38.935 89.058 1.00 26.89 ? 2042 HOH D O 1 +HETATM 22454 O O . HOH U 10 . ? 88.636 30.322 133.898 1.00 21.21 ? 2053 HOH D O 1 +HETATM 22455 O O . HOH U 10 . ? 83.180 32.359 129.019 1.00 13.80 ? 2054 HOH D O 1 +HETATM 22456 O O . HOH U 10 . ? 69.300 59.798 120.006 1.00 10.31 ? 2057 HOH D O 1 +HETATM 22457 O O . HOH U 10 . ? 68.484 61.504 127.733 1.00 7.49 ? 2058 HOH D O 1 +HETATM 22458 O O . HOH U 10 . ? 37.995 39.742 102.116 1.00 22.77 ? 2059 HOH D O 1 +HETATM 22459 O O . HOH U 10 . ? 28.633 54.220 113.038 1.00 36.65 ? 2062 HOH D O 1 +HETATM 22460 O O . HOH U 10 . ? 69.932 37.113 143.198 1.00 20.44 ? 2065 HOH D O 1 +HETATM 22461 O O . HOH U 10 . ? 81.714 38.452 146.526 1.00 37.79 ? 2068 HOH D O 1 +HETATM 22462 O O . HOH U 10 . ? 64.344 56.972 153.466 1.00 28.75 ? 2073 HOH D O 1 +HETATM 22463 O O . HOH U 10 . ? 33.756 56.347 150.881 1.00 39.84 ? 2076 HOH D O 1 +HETATM 22464 O O . HOH U 10 . ? 65.139 54.159 88.362 1.00 32.42 ? 2077 HOH D O 1 +HETATM 22465 O O . HOH U 10 . ? 54.354 38.824 145.846 1.00 30.88 ? 2078 HOH D O 1 +HETATM 22466 O O . HOH U 10 . ? 92.937 36.142 126.233 1.00 20.29 ? 2085 HOH D O 1 +HETATM 22467 O O . HOH U 10 . ? 86.014 28.174 127.591 1.00 26.81 ? 2090 HOH D O 1 +HETATM 22468 O O . HOH U 10 . ? 83.070 51.238 148.811 1.00 26.32 ? 2091 HOH D O 1 +HETATM 22469 O O . HOH U 10 . ? 63.608 57.700 140.199 1.00 31.16 ? 2092 HOH D O 1 +HETATM 22470 O O . HOH U 10 . ? 83.796 37.791 115.187 1.00 31.53 ? 2093 HOH D O 1 +HETATM 22471 O O . HOH U 10 . ? 90.710 47.892 129.454 1.00 24.72 ? 2101 HOH D O 1 +HETATM 22472 O O . HOH U 10 . ? 33.334 36.607 125.721 1.00 31.32 ? 2106 HOH D O 1 +HETATM 22473 O O . HOH U 10 . ? 74.219 64.375 158.510 1.00 36.94 ? 2107 HOH D O 1 +HETATM 22474 O O . HOH U 10 . ? 74.111 22.167 121.798 1.00 32.30 ? 2108 HOH D O 1 +HETATM 22475 O O . HOH U 10 . ? 70.538 56.685 111.765 1.00 25.34 ? 2113 HOH D O 1 +HETATM 22476 O O . HOH U 10 . ? 48.283 38.591 137.704 1.00 21.07 ? 2122 HOH D O 1 +HETATM 22477 O O . HOH U 10 . ? 66.967 62.312 109.026 1.00 31.88 ? 2124 HOH D O 1 +HETATM 22478 O O . HOH U 10 . ? 84.766 55.148 150.251 1.00 39.80 ? 2126 HOH D O 1 +HETATM 22479 O O . HOH U 10 . ? 68.272 30.704 129.974 1.00 31.47 ? 2128 HOH D O 1 +HETATM 22480 O O . HOH U 10 . ? 82.021 49.177 117.375 1.00 17.45 ? 2132 HOH D O 1 +HETATM 22481 O O . HOH U 10 . ? 91.114 52.682 133.795 1.00 43.64 ? 2134 HOH D O 1 +HETATM 22482 O O . HOH U 10 . ? 74.704 21.534 119.463 1.00 33.77 ? 2143 HOH D O 1 +HETATM 22483 O O . HOH U 10 . ? 36.860 47.676 155.816 1.00 39.20 ? 2146 HOH D O 1 +HETATM 22484 O O . HOH U 10 . ? 42.695 33.691 132.059 1.00 25.12 ? 2153 HOH D O 1 +HETATM 22485 O O . HOH U 10 . ? 61.964 37.210 100.577 1.00 25.60 ? 2155 HOH D O 1 +HETATM 22486 O O . HOH U 10 . ? 87.079 23.054 123.826 1.00 32.91 ? 2158 HOH D O 1 +HETATM 22487 O O . HOH U 10 . ? 34.183 37.211 101.893 1.00 30.46 ? 2164 HOH D O 1 +HETATM 22488 O O . HOH U 10 . ? 35.065 53.799 114.734 1.00 39.46 ? 2165 HOH D O 1 +HETATM 22489 O O . HOH U 10 . ? 36.907 59.728 117.739 1.00 40.69 ? 2166 HOH D O 1 +HETATM 22490 O O . HOH U 10 . ? 91.707 32.462 120.307 1.00 40.06 ? 2169 HOH D O 1 +HETATM 22491 O O . HOH U 10 . ? 94.527 33.149 109.862 1.00 42.96 ? 2174 HOH D O 1 +HETATM 22492 O O . HOH U 10 . ? 41.215 45.034 135.490 1.00 24.73 ? 2176 HOH D O 1 +HETATM 22493 O O . HOH U 10 . ? 66.860 24.632 124.066 1.00 31.10 ? 2177 HOH D O 1 +HETATM 22494 O O . HOH U 10 . ? 41.768 57.288 104.296 1.00 31.21 ? 2184 HOH D O 1 +HETATM 22495 O O . HOH U 10 . ? 43.746 23.326 104.147 1.00 35.28 ? 2187 HOH D O 1 +HETATM 22496 O O . HOH U 10 . ? 47.749 22.171 111.523 1.00 32.20 ? 2198 HOH D O 1 +HETATM 22497 O O . HOH U 10 . ? 49.549 29.730 138.266 1.00 32.11 ? 2200 HOH D O 1 +HETATM 22498 O O . HOH U 10 . ? 74.366 36.630 144.008 1.00 36.51 ? 2205 HOH D O 1 +HETATM 22499 O O . HOH U 10 . ? 87.120 54.415 135.785 1.00 30.08 ? 2206 HOH D O 1 +HETATM 22500 O O . HOH U 10 . ? 79.316 51.668 151.158 1.00 30.82 ? 2209 HOH D O 1 +HETATM 22501 O O . HOH U 10 . ? 61.170 28.356 111.617 1.00 34.94 ? 2212 HOH D O 1 +HETATM 22502 O O . HOH U 10 . ? 83.640 60.520 147.580 1.00 39.51 ? 2216 HOH D O 1 +HETATM 22503 O O . HOH U 10 . ? 51.865 46.454 116.860 1.00 40.64 ? 2217 HOH D O 1 +HETATM 22504 O O . HOH U 10 . ? 28.560 31.784 119.332 1.00 46.57 ? 2218 HOH D O 1 +HETATM 22505 O O . HOH U 10 . ? 41.789 23.733 106.873 1.00 39.31 ? 2220 HOH D O 1 +HETATM 22506 O O . HOH U 10 . ? 91.018 52.936 144.058 1.00 43.26 ? 2222 HOH D O 1 +HETATM 22507 O O . HOH U 10 . ? 38.714 33.754 121.341 1.00 25.47 ? 2224 HOH D O 1 +HETATM 22508 O O . HOH U 10 . ? 49.330 41.869 145.735 1.00 31.65 ? 2228 HOH D O 1 +HETATM 22509 O O . HOH U 10 . ? 88.311 54.405 143.454 1.00 46.81 ? 2234 HOH D O 1 +HETATM 22510 O O . HOH U 10 . ? 44.872 38.375 151.244 1.00 32.89 ? 2245 HOH D O 1 +HETATM 22511 O O . HOH U 10 . ? 54.296 38.829 142.456 1.00 29.73 ? 2258 HOH D O 1 +HETATM 22512 O O . HOH U 10 . ? 39.115 43.263 134.175 1.00 30.06 ? 2259 HOH D O 1 +HETATM 22513 O O . HOH U 10 . ? 60.825 41.310 144.509 1.00 36.09 ? 2264 HOH D O 1 +HETATM 22514 O O . HOH U 10 . ? 34.108 27.171 109.263 1.00 28.77 ? 2278 HOH D O 1 +HETATM 22515 O O . HOH U 10 . ? 33.363 55.203 120.742 1.00 29.92 ? 2280 HOH D O 1 +HETATM 22516 O O . HOH U 10 . ? 80.303 23.280 126.761 1.00 37.08 ? 2286 HOH D O 1 +HETATM 22517 O O . HOH U 10 . ? 67.723 56.411 137.434 1.00 29.33 ? 2288 HOH D O 1 +HETATM 22518 O O . HOH U 10 . ? 85.217 23.246 114.710 1.00 26.23 ? 2294 HOH D O 1 +HETATM 22519 O O . HOH U 10 . ? 59.255 63.045 144.340 1.00 45.79 ? 2295 HOH D O 1 +HETATM 22520 O O . HOH U 10 . ? 38.054 61.566 116.229 1.00 41.10 ? 2300 HOH D O 1 +HETATM 22521 O O . HOH U 10 . ? 85.631 21.813 127.624 1.00 23.33 ? 2305 HOH D O 1 +HETATM 22522 O O . HOH U 10 . ? 60.998 23.712 110.655 1.00 35.26 ? 2306 HOH D O 1 +HETATM 22523 O O . HOH U 10 . ? 84.097 25.275 111.665 1.00 47.24 ? 2309 HOH D O 1 +HETATM 22524 O O . HOH U 10 . ? 69.668 61.402 133.556 1.00 32.64 ? 2310 HOH D O 1 +HETATM 22525 O O . HOH U 10 . ? 40.859 31.799 98.788 1.00 37.40 ? 2311 HOH D O 1 +HETATM 22526 O O . HOH U 10 . ? 37.809 28.047 117.446 1.00 23.63 ? 2312 HOH D O 1 +HETATM 22527 O O . HOH U 10 . ? 78.163 35.194 141.597 1.00 40.05 ? 2315 HOH D O 1 +HETATM 22528 O O . HOH U 10 . ? 34.312 34.089 101.815 1.00 41.54 ? 2320 HOH D O 1 +HETATM 22529 O O . HOH U 10 . ? 41.321 64.240 128.131 1.00 26.41 ? 2321 HOH D O 1 +HETATM 22530 O O . HOH U 10 . ? 71.336 46.212 158.314 1.00 32.69 ? 2322 HOH D O 1 +HETATM 22531 O O . HOH U 10 . ? 72.012 31.113 111.314 1.00 37.05 ? 2325 HOH D O 1 +HETATM 22532 O O . HOH U 10 . ? 76.737 60.609 153.612 1.00 37.38 ? 2332 HOH D O 1 +HETATM 22533 O O . HOH U 10 . ? 61.532 49.847 161.796 1.00 25.07 ? 2333 HOH D O 1 +HETATM 22534 O O . HOH U 10 . ? 50.098 39.286 146.505 1.00 38.12 ? 2340 HOH D O 1 +HETATM 22535 O O . HOH U 10 . ? 80.787 34.613 140.441 1.00 40.63 ? 2342 HOH D O 1 +HETATM 22536 O O . HOH U 10 . ? 63.378 47.920 161.468 1.00 39.89 ? 2348 HOH D O 1 +HETATM 22537 O O . HOH U 10 . ? 59.292 36.959 148.611 1.00 37.78 ? 2351 HOH D O 1 +HETATM 22538 O O . HOH U 10 . ? 47.999 57.215 140.686 1.00 38.14 ? 2353 HOH D O 1 +HETATM 22539 O O . HOH U 10 . ? 36.603 55.521 117.423 1.00 18.67 ? 2355 HOH D O 1 +HETATM 22540 O O . HOH U 10 . ? 85.949 48.759 124.393 1.00 36.63 ? 2364 HOH D O 1 +HETATM 22541 O O . HOH U 10 . ? 34.638 42.964 114.671 1.00 35.61 ? 2367 HOH D O 1 +HETATM 22542 O O . HOH U 10 . ? 61.998 37.979 141.631 1.00 23.51 ? 2371 HOH D O 1 +HETATM 22543 O O . HOH U 10 . ? 86.201 32.678 122.574 1.00 24.53 ? 2373 HOH D O 1 +HETATM 22544 O O . HOH U 10 . ? 93.248 42.657 133.360 1.00 29.08 ? 2376 HOH D O 1 +HETATM 22545 O O . HOH U 10 . ? 54.039 40.414 157.159 1.00 47.29 ? 2382 HOH D O 1 +HETATM 22546 O O . HOH U 10 . ? 65.751 56.761 155.609 1.00 36.77 ? 2386 HOH D O 1 +HETATM 22547 O O . HOH U 10 . ? 78.947 58.487 151.571 1.00 35.36 ? 2390 HOH D O 1 +HETATM 22548 O O . HOH U 10 . ? 39.769 61.677 131.219 1.00 37.46 ? 2394 HOH D O 1 +HETATM 22549 O O . HOH U 10 . ? 32.355 52.739 120.672 1.00 42.21 ? 2395 HOH D O 1 +HETATM 22550 O O . HOH U 10 . ? 77.575 53.072 154.033 1.00 31.06 ? 2398 HOH D O 1 +HETATM 22551 O O . HOH U 10 . ? 34.388 61.596 140.930 1.00 24.11 ? 2399 HOH D O 1 +HETATM 22552 O O . HOH U 10 . ? 39.882 31.049 100.835 1.00 31.44 ? 2401 HOH D O 1 +HETATM 22553 O O . HOH U 10 . ? 46.947 59.937 144.748 1.00 42.32 ? 2415 HOH D O 1 +HETATM 22554 O O . HOH U 10 . ? 50.847 39.633 153.275 1.00 30.52 ? 2420 HOH D O 1 +HETATM 22555 O O . HOH U 10 . ? 75.504 15.199 115.886 1.00 34.96 ? 2421 HOH D O 1 +HETATM 22556 O O . HOH U 10 . ? 81.616 25.825 112.572 1.00 40.89 ? 2428 HOH D O 1 +HETATM 22557 O O . HOH U 10 . ? 30.711 53.051 112.032 1.00 52.74 ? 2430 HOH D O 1 +HETATM 22558 O O . HOH U 10 . ? 73.866 62.995 153.935 1.00 34.44 ? 2431 HOH D O 1 +HETATM 22559 O O . HOH U 10 . ? 68.926 61.350 116.014 1.00 12.17 ? 2442 HOH D O 1 +HETATM 22560 O O . HOH U 10 . ? 60.274 41.522 113.517 1.00 7.34 ? 2444 HOH D O 1 +HETATM 22561 O O . HOH U 10 . ? 47.299 49.661 109.636 1.00 10.70 ? 2445 HOH D O 1 +HETATM 22562 O O . HOH U 10 . ? 50.209 65.218 118.914 1.00 8.97 ? 2446 HOH D O 1 +HETATM 22563 O O . HOH U 10 . ? 67.017 58.751 116.793 1.00 8.85 ? 2456 HOH D O 1 +HETATM 22564 O O . HOH U 10 . ? 80.550 25.979 117.763 1.00 18.41 ? 2459 HOH D O 1 +HETATM 22565 O O . HOH U 10 . ? 67.955 40.994 110.754 1.00 13.42 ? 2469 HOH D O 1 +HETATM 22566 O O . HOH U 10 . ? 69.590 59.658 102.832 1.00 23.92 ? 2476 HOH D O 1 +HETATM 22567 O O . HOH U 10 . ? 67.047 38.147 127.124 1.00 21.73 ? 2479 HOH D O 1 +HETATM 22568 O O . HOH U 10 . ? 58.579 47.771 138.452 1.00 19.56 ? 2481 HOH D O 1 +HETATM 22569 O O . HOH U 10 . ? 76.241 30.952 127.222 1.00 24.92 ? 2496 HOH D O 1 +HETATM 22570 O O . HOH U 10 . ? 75.131 28.062 127.558 1.00 22.25 ? 2497 HOH D O 1 +HETATM 22571 O O . HOH U 10 . ? 70.203 55.097 135.636 1.00 20.51 ? 2498 HOH D O 1 +HETATM 22572 O O . HOH U 10 . ? 56.905 59.877 134.854 1.00 26.68 ? 2499 HOH D O 1 +HETATM 22573 O O . HOH U 10 . ? 48.315 65.962 117.117 1.00 30.36 ? 2502 HOH D O 1 +HETATM 22574 O O . HOH U 10 . ? 69.009 37.347 126.620 1.00 22.07 ? 2503 HOH D O 1 +HETATM 22575 O O . HOH U 10 . ? 67.720 54.760 110.181 1.00 17.26 ? 2520 HOH D O 1 +HETATM 22576 O O . HOH U 10 . ? 53.332 58.350 135.264 1.00 23.19 ? 2522 HOH D O 1 +HETATM 22577 O O . HOH U 10 . ? 88.057 27.922 118.786 1.00 28.40 ? 2538 HOH D O 1 +HETATM 22578 O O . HOH U 10 . ? 44.742 46.755 134.911 1.00 19.01 ? 2561 HOH D O 1 +HETATM 22579 O O . HOH U 10 . ? 56.142 30.815 107.097 1.00 38.31 ? 2563 HOH D O 1 +HETATM 22580 O O . HOH U 10 . ? 49.935 57.376 91.867 1.00 28.40 ? 2565 HOH D O 1 +HETATM 22581 O O . HOH U 10 . ? 45.945 60.860 134.104 1.00 23.96 ? 2566 HOH D O 1 +HETATM 22582 O O . HOH U 10 . ? 44.513 62.933 135.295 1.00 40.53 ? 2567 HOH D O 1 +HETATM 22583 O O . HOH U 10 . ? 60.890 34.960 111.064 1.00 24.98 ? 2572 HOH D O 1 +HETATM 22584 O O . HOH U 10 . ? 64.328 32.341 110.522 1.00 37.76 ? 2573 HOH D O 1 +HETATM 22585 O O . HOH U 10 . ? 60.130 37.475 109.762 1.00 23.38 ? 2574 HOH D O 1 +HETATM 22586 O O . HOH U 10 . ? 43.709 54.931 100.558 1.00 29.81 ? 2578 HOH D O 1 +HETATM 22587 O O . HOH U 10 . ? 42.036 40.153 141.110 1.00 30.42 ? 2579 HOH D O 1 +HETATM 22588 O O . HOH U 10 . ? 37.016 40.198 99.547 1.00 24.21 ? 2593 HOH D O 1 +HETATM 22589 O O . HOH U 10 . ? 37.126 37.502 98.370 1.00 34.96 ? 2594 HOH D O 1 +HETATM 22590 O O . HOH U 10 . ? 31.018 40.943 127.238 1.00 28.88 ? 2605 HOH D O 1 +HETATM 22591 O O . HOH U 10 . ? 29.913 43.534 128.637 1.00 29.91 ? 2606 HOH D O 1 +HETATM 22592 O O . HOH U 10 . ? 86.540 54.167 123.335 1.00 23.82 ? 2616 HOH D O 1 +HETATM 22593 O O . HOH U 10 . ? 31.550 44.749 105.343 1.00 34.87 ? 2622 HOH D O 1 +HETATM 22594 O O . HOH U 10 . ? 45.632 40.728 90.389 1.00 22.48 ? 2627 HOH D O 1 +HETATM 22595 O O . HOH U 10 . ? 82.157 32.612 134.763 1.00 32.14 ? 2628 HOH D O 1 +HETATM 22596 O O . HOH U 10 . ? 41.136 61.971 133.414 1.00 33.88 ? 2638 HOH D O 1 +HETATM 22597 O O . HOH U 10 . ? 86.638 25.430 119.069 1.00 39.18 ? 2642 HOH D O 1 +HETATM 22598 O O . HOH U 10 . ? 34.666 49.547 101.689 1.00 36.00 ? 2645 HOH D O 1 +HETATM 22599 O O . HOH U 10 . ? 32.764 47.211 102.855 1.00 46.44 ? 2646 HOH D O 1 +HETATM 22600 O O . HOH U 10 . ? 37.167 52.429 99.521 1.00 27.09 ? 2647 HOH D O 1 +HETATM 22601 O O . HOH U 10 . ? 94.017 35.813 109.847 1.00 40.69 ? 2649 HOH D O 1 +HETATM 22602 O O . HOH U 10 . ? 92.040 43.442 125.517 1.00 31.23 ? 2662 HOH D O 1 +HETATM 22603 O O . HOH U 10 . ? 79.461 59.782 153.776 1.00 46.66 ? 2670 HOH D O 1 +HETATM 22604 O O . HOH U 10 . ? 50.332 59.525 149.843 1.00 32.20 ? 2686 HOH D O 1 +HETATM 22605 O O . HOH U 10 . ? 68.672 41.332 153.604 1.00 43.20 ? 2690 HOH D O 1 +HETATM 22606 O O . HOH U 10 . ? 46.571 39.936 163.043 1.00 37.79 ? 2696 HOH D O 1 +HETATM 22607 O O . HOH U 10 . ? 95.183 34.050 113.720 1.00 37.60 ? 2698 HOH D O 1 +HETATM 22608 O O . HOH U 10 . ? 69.472 58.299 100.637 1.00 30.23 ? 2711 HOH D O 1 +HETATM 22609 O O . HOH U 10 . ? 89.009 35.733 116.523 1.00 40.89 ? 2714 HOH D O 1 +HETATM 22610 O O . HOH U 10 . ? 32.468 51.804 152.385 1.00 33.00 ? 2720 HOH D O 1 +HETATM 22611 O O . HOH U 10 . ? 35.458 43.859 150.042 1.00 39.58 ? 2724 HOH D O 1 +HETATM 22612 O O . HOH U 10 . ? 66.535 40.149 107.633 1.00 37.09 ? 2729 HOH D O 1 +HETATM 22613 O O . HOH U 10 . ? 82.063 47.665 114.943 1.00 25.27 ? 2736 HOH D O 1 +HETATM 22614 O O . HOH U 10 . ? 66.902 20.262 122.061 1.00 33.26 ? 2740 HOH D O 1 +HETATM 22615 O O . HOH U 10 . ? 30.101 37.310 116.726 1.00 28.90 ? 2749 HOH D O 1 +HETATM 22616 O O . HOH U 10 . ? 46.646 66.308 145.088 1.00 40.54 ? 2751 HOH D O 1 +HETATM 22617 O O . HOH U 10 . ? 31.694 62.649 128.251 1.00 51.59 ? 2759 HOH D O 1 +HETATM 22618 O O . HOH U 10 . ? 35.505 60.303 120.197 1.00 41.17 ? 2776 HOH D O 1 +HETATM 22619 O O . HOH U 10 . ? 63.273 25.440 111.269 1.00 35.14 ? 2778 HOH D O 1 +HETATM 22620 O O . HOH U 10 . ? 62.279 21.015 111.474 1.00 43.11 ? 2779 HOH D O 1 +HETATM 22621 O O . HOH U 10 . ? 33.066 28.558 116.470 1.00 51.02 ? 2782 HOH D O 1 +HETATM 22622 O O . HOH U 10 . ? 86.407 23.182 109.268 1.00 41.61 ? 2793 HOH D O 1 +HETATM 22623 O O . HOH U 10 . ? 53.092 54.667 162.263 1.00 30.33 ? 2794 HOH D O 1 +HETATM 22624 O O . HOH U 10 . ? 75.867 27.617 116.193 1.00 33.59 ? 2795 HOH D O 1 +HETATM 22625 O O . HOH U 10 . ? 82.945 24.147 118.559 1.00 27.59 ? 2796 HOH D O 1 +HETATM 22626 O O . HOH U 10 . ? 82.157 39.462 118.136 1.00 31.45 ? 2797 HOH D O 1 +HETATM 22627 O O . HOH V 10 . ? 60.099 73.080 100.650 1.00 6.50 ? 1 HOH E O 1 +HETATM 22628 O O . HOH V 10 . ? 66.510 76.009 67.241 1.00 9.07 ? 7 HOH E O 1 +HETATM 22629 O O . HOH V 10 . ? 94.362 74.389 62.952 1.00 10.81 ? 8 HOH E O 1 +HETATM 22630 O O . HOH V 10 . ? 57.995 73.983 93.549 1.00 6.82 ? 9 HOH E O 1 +HETATM 22631 O O . HOH V 10 . ? 70.015 74.607 83.704 1.00 9.54 ? 10 HOH E O 1 +HETATM 22632 O O . HOH V 10 . ? 65.169 60.805 90.762 1.00 14.19 ? 11 HOH E O 1 +HETATM 22633 O O . HOH V 10 . ? 65.249 79.906 85.649 1.00 8.68 ? 20 HOH E O 1 +HETATM 22634 O O . HOH V 10 . ? 69.281 85.425 67.869 1.00 11.88 ? 634 HOH E O 1 +HETATM 22635 O O . HOH V 10 . ? 67.020 66.632 91.199 1.00 5.83 ? 635 HOH E O 1 +HETATM 22636 O O . HOH V 10 . ? 72.757 78.048 76.226 1.00 8.53 ? 636 HOH E O 1 +HETATM 22637 O O . HOH V 10 . ? 93.878 93.247 74.597 1.00 13.34 ? 637 HOH E O 1 +HETATM 22638 O O . HOH V 10 . ? 69.879 86.774 71.874 1.00 10.44 ? 638 HOH E O 1 +HETATM 22639 O O . HOH V 10 . ? 78.471 70.195 71.998 1.00 8.58 ? 639 HOH E O 1 +HETATM 22640 O O . HOH V 10 . ? 57.215 67.084 97.447 1.00 12.02 ? 640 HOH E O 1 +HETATM 22641 O O . HOH V 10 . ? 73.543 75.638 71.205 1.00 8.64 ? 641 HOH E O 1 +HETATM 22642 O O . HOH V 10 . ? 79.100 78.234 79.179 1.00 9.10 ? 642 HOH E O 1 +HETATM 22643 O O . HOH V 10 . ? 66.480 82.593 55.212 1.00 23.11 ? 643 HOH E O 1 +HETATM 22644 O O . HOH V 10 . ? 65.210 91.734 86.433 1.00 21.15 ? 644 HOH E O 1 +HETATM 22645 O O . HOH V 10 . ? 72.147 81.682 77.761 1.00 11.17 ? 645 HOH E O 1 +HETATM 22646 O O . HOH V 10 . ? 50.522 97.172 73.802 1.00 9.27 ? 646 HOH E O 1 +HETATM 22647 O O . HOH V 10 . ? 74.734 82.407 67.571 1.00 8.73 ? 647 HOH E O 1 +HETATM 22648 O O . HOH V 10 . ? 73.350 82.489 85.458 1.00 7.77 ? 648 HOH E O 1 +HETATM 22649 O O . HOH V 10 . ? 53.068 58.757 72.270 1.00 12.75 ? 649 HOH E O 1 +HETATM 22650 O O . HOH V 10 . ? 41.199 88.874 95.724 1.00 29.18 ? 662 HOH E O 1 +HETATM 22651 O O . HOH V 10 . ? 46.793 77.555 63.847 1.00 14.90 ? 663 HOH E O 1 +HETATM 22652 O O . HOH V 10 . ? 42.741 84.493 95.833 1.00 15.43 ? 664 HOH E O 1 +HETATM 22653 O O . HOH V 10 . ? 83.020 69.661 83.993 1.00 11.98 ? 665 HOH E O 1 +HETATM 22654 O O . HOH V 10 . ? 57.914 74.149 112.069 1.00 22.53 ? 666 HOH E O 1 +HETATM 22655 O O . HOH V 10 . ? 64.892 69.132 112.212 1.00 19.68 ? 667 HOH E O 1 +HETATM 22656 O O . HOH V 10 . ? 73.694 73.482 68.154 1.00 19.96 ? 668 HOH E O 1 +HETATM 22657 O O . HOH V 10 . ? 51.518 59.486 80.129 1.00 11.19 ? 669 HOH E O 1 +HETATM 22658 O O . HOH V 10 . ? 77.396 69.494 79.513 1.00 7.85 ? 670 HOH E O 1 +HETATM 22659 O O . HOH V 10 . ? 64.024 82.124 62.961 1.00 11.25 ? 671 HOH E O 1 +HETATM 22660 O O . HOH V 10 . ? 70.180 76.076 72.351 1.00 10.88 ? 672 HOH E O 1 +HETATM 22661 O O . HOH V 10 . ? 72.574 79.936 74.186 1.00 14.57 ? 673 HOH E O 1 +HETATM 22662 O O . HOH V 10 . ? 68.877 84.729 70.480 1.00 7.09 ? 674 HOH E O 1 +HETATM 22663 O O . HOH V 10 . ? 80.461 93.866 80.410 1.00 10.67 ? 675 HOH E O 1 +HETATM 22664 O O . HOH V 10 . ? 60.018 77.462 71.747 1.00 10.67 ? 676 HOH E O 1 +HETATM 22665 O O . HOH V 10 . ? 44.568 88.925 51.078 1.00 35.75 ? 677 HOH E O 1 +HETATM 22666 O O . HOH V 10 . ? 48.123 61.874 91.869 1.00 13.28 ? 678 HOH E O 1 +HETATM 22667 O O . HOH V 10 . ? 65.161 58.283 86.533 1.00 12.33 ? 679 HOH E O 1 +HETATM 22668 O O . HOH V 10 . ? 62.342 79.891 91.240 1.00 6.63 ? 680 HOH E O 1 +HETATM 22669 O O . HOH V 10 . ? 39.394 81.242 84.211 1.00 17.09 ? 681 HOH E O 1 +HETATM 22670 O O . HOH V 10 . ? 89.516 81.899 70.067 1.00 11.49 ? 682 HOH E O 1 +HETATM 22671 O O . HOH V 10 . ? 69.326 79.134 44.638 1.00 19.35 ? 683 HOH E O 1 +HETATM 22672 O O . HOH V 10 . ? 49.487 75.102 89.405 1.00 10.08 ? 684 HOH E O 1 +HETATM 22673 O O . HOH V 10 . ? 47.642 80.511 103.777 1.00 12.40 ? 685 HOH E O 1 +HETATM 22674 O O . HOH V 10 . ? 73.776 78.205 102.180 1.00 5.99 ? 686 HOH E O 1 +HETATM 22675 O O . HOH V 10 . ? 71.599 80.248 68.270 1.00 12.52 ? 687 HOH E O 1 +HETATM 22676 O O . HOH V 10 . ? 83.343 69.831 80.823 1.00 8.36 ? 688 HOH E O 1 +HETATM 22677 O O . HOH V 10 . ? 89.174 88.458 72.996 1.00 12.73 ? 689 HOH E O 1 +HETATM 22678 O O . HOH V 10 . ? 79.571 81.485 82.004 1.00 10.54 ? 690 HOH E O 1 +HETATM 22679 O O . HOH V 10 . ? 71.005 81.524 89.881 1.00 9.99 ? 691 HOH E O 1 +HETATM 22680 O O . HOH V 10 . ? 57.919 65.952 53.086 1.00 17.20 ? 692 HOH E O 1 +HETATM 22681 O O . HOH V 10 . ? 62.569 85.649 79.074 1.00 12.89 ? 693 HOH E O 1 +HETATM 22682 O O . HOH V 10 . ? 63.931 71.270 54.260 1.00 12.32 ? 694 HOH E O 1 +HETATM 22683 O O . HOH V 10 . ? 61.251 86.498 106.533 1.00 16.15 ? 695 HOH E O 1 +HETATM 22684 O O . HOH V 10 . ? 94.616 78.556 73.347 1.00 18.78 ? 696 HOH E O 1 +HETATM 22685 O O . HOH V 10 . ? 42.925 71.062 62.958 1.00 15.47 ? 697 HOH E O 1 +HETATM 22686 O O . HOH V 10 . ? 76.082 59.634 53.681 1.00 17.35 ? 698 HOH E O 1 +HETATM 22687 O O . HOH V 10 . ? 75.494 80.958 84.475 1.00 9.50 ? 699 HOH E O 1 +HETATM 22688 O O . HOH V 10 . ? 91.311 70.005 86.050 1.00 23.31 ? 700 HOH E O 1 +HETATM 22689 O O . HOH V 10 . ? 96.794 67.382 67.578 1.00 20.65 ? 701 HOH E O 1 +HETATM 22690 O O . HOH V 10 . ? 64.317 86.257 86.088 1.00 10.53 ? 702 HOH E O 1 +HETATM 22691 O O . HOH V 10 . ? 79.885 88.577 73.401 1.00 12.59 ? 703 HOH E O 1 +HETATM 22692 O O . HOH V 10 . ? 45.719 71.198 95.800 1.00 10.97 ? 704 HOH E O 1 +HETATM 22693 O O . HOH V 10 . ? 81.740 81.620 84.057 1.00 12.91 ? 705 HOH E O 1 +HETATM 22694 O O . HOH V 10 . ? 75.843 60.216 44.860 1.00 22.05 ? 706 HOH E O 1 +HETATM 22695 O O . HOH V 10 . ? 55.755 75.776 110.709 1.00 40.52 ? 707 HOH E O 1 +HETATM 22696 O O . HOH V 10 . ? 62.183 70.775 81.915 1.00 11.91 ? 708 HOH E O 1 +HETATM 22697 O O . HOH V 10 . ? 59.173 68.001 114.524 1.00 13.21 ? 709 HOH E O 1 +HETATM 22698 O O . HOH V 10 . ? 68.643 64.109 83.782 1.00 11.11 ? 710 HOH E O 1 +HETATM 22699 O O . HOH V 10 . ? 86.585 74.870 57.877 1.00 12.00 ? 711 HOH E O 1 +HETATM 22700 O O . HOH V 10 . ? 67.526 72.632 41.005 1.00 15.19 ? 712 HOH E O 1 +HETATM 22701 O O . HOH V 10 . ? 68.852 68.744 78.013 1.00 12.73 ? 713 HOH E O 1 +HETATM 22702 O O . HOH V 10 . ? 58.985 92.177 85.895 1.00 12.95 ? 714 HOH E O 1 +HETATM 22703 O O . HOH V 10 . ? 80.516 60.393 65.455 1.00 15.05 ? 715 HOH E O 1 +HETATM 22704 O O . HOH V 10 . ? 65.072 88.670 85.177 1.00 17.35 ? 716 HOH E O 1 +HETATM 22705 O O . HOH V 10 . ? 59.646 75.390 65.612 1.00 12.13 ? 717 HOH E O 1 +HETATM 22706 O O . HOH V 10 . ? 91.061 62.552 72.528 1.00 30.78 ? 718 HOH E O 1 +HETATM 22707 O O . HOH V 10 . ? 66.015 76.302 52.349 1.00 10.91 ? 719 HOH E O 1 +HETATM 22708 O O . HOH V 10 . ? 88.587 82.148 73.988 1.00 10.99 ? 720 HOH E O 1 +HETATM 22709 O O . HOH V 10 . ? 81.967 79.465 74.508 1.00 11.95 ? 721 HOH E O 1 +HETATM 22710 O O . HOH V 10 . ? 65.688 69.610 84.568 1.00 6.96 ? 722 HOH E O 1 +HETATM 22711 O O . HOH V 10 . ? 43.313 71.572 94.543 1.00 13.94 ? 723 HOH E O 1 +HETATM 22712 O O . HOH V 10 . ? 51.208 82.181 61.382 1.00 11.50 ? 724 HOH E O 1 +HETATM 22713 O O . HOH V 10 . ? 94.366 91.440 87.662 1.00 15.33 ? 725 HOH E O 1 +HETATM 22714 O O . HOH V 10 . ? 64.483 74.824 106.513 1.00 11.29 ? 726 HOH E O 1 +HETATM 22715 O O . HOH V 10 . ? 49.487 78.204 63.832 1.00 19.97 ? 727 HOH E O 1 +HETATM 22716 O O . HOH V 10 . ? 87.457 87.739 70.785 1.00 11.85 ? 728 HOH E O 1 +HETATM 22717 O O . HOH V 10 . ? 70.121 93.351 75.671 1.00 12.60 ? 729 HOH E O 1 +HETATM 22718 O O . HOH V 10 . ? 52.228 96.781 65.931 1.00 16.98 ? 730 HOH E O 1 +HETATM 22719 O O . HOH V 10 . ? 83.584 75.814 91.183 1.00 29.93 ? 731 HOH E O 1 +HETATM 22720 O O . HOH V 10 . ? 57.182 76.864 60.064 1.00 13.04 ? 732 HOH E O 1 +HETATM 22721 O O . HOH V 10 . ? 52.716 98.083 72.741 1.00 13.27 ? 733 HOH E O 1 +HETATM 22722 O O . HOH V 10 . ? 58.963 75.044 60.324 1.00 23.19 ? 734 HOH E O 1 +HETATM 22723 O O . HOH V 10 . ? 50.540 67.730 110.235 1.00 14.52 ? 735 HOH E O 1 +HETATM 22724 O O . HOH V 10 . ? 63.828 91.017 90.219 1.00 18.48 ? 736 HOH E O 1 +HETATM 22725 O O . HOH V 10 . ? 92.130 91.480 75.436 1.00 13.68 ? 737 HOH E O 1 +HETATM 22726 O O . HOH V 10 . ? 40.650 76.914 47.227 1.00 16.44 ? 738 HOH E O 1 +HETATM 22727 O O . HOH V 10 . ? 40.563 86.153 95.910 1.00 14.19 ? 739 HOH E O 1 +HETATM 22728 O O . HOH V 10 . ? 80.022 91.693 78.906 1.00 11.10 ? 740 HOH E O 1 +HETATM 22729 O O . HOH V 10 . ? 85.550 64.772 61.814 1.00 22.50 ? 741 HOH E O 1 +HETATM 22730 O O . HOH V 10 . ? 64.139 90.341 82.046 1.00 8.73 ? 742 HOH E O 1 +HETATM 22731 O O . HOH V 10 . ? 44.310 75.842 104.667 1.00 19.38 ? 743 HOH E O 1 +HETATM 22732 O O . HOH V 10 . ? 72.283 65.988 74.289 1.00 12.61 ? 744 HOH E O 1 +HETATM 22733 O O . HOH V 10 . ? 68.431 71.629 64.221 1.00 19.22 ? 745 HOH E O 1 +HETATM 22734 O O . HOH V 10 . ? 70.399 76.455 81.813 1.00 9.10 ? 746 HOH E O 1 +HETATM 22735 O O . HOH V 10 . ? 72.753 82.521 75.217 1.00 16.02 ? 747 HOH E O 1 +HETATM 22736 O O . HOH V 10 . ? 69.023 61.784 71.313 1.00 13.89 ? 748 HOH E O 1 +HETATM 22737 O O . HOH V 10 . ? 63.889 104.993 83.549 1.00 16.33 ? 749 HOH E O 1 +HETATM 22738 O O . HOH V 10 . ? 63.673 81.889 86.589 1.00 11.45 ? 750 HOH E O 1 +HETATM 22739 O O . HOH V 10 . ? 45.344 68.181 94.805 1.00 15.12 ? 751 HOH E O 1 +HETATM 22740 O O . HOH V 10 . ? 44.856 82.013 45.517 1.00 23.37 ? 752 HOH E O 1 +HETATM 22741 O O . HOH V 10 . ? 71.679 63.358 72.943 1.00 16.62 ? 753 HOH E O 1 +HETATM 22742 O O . HOH V 10 . ? 63.667 71.563 84.114 1.00 12.83 ? 754 HOH E O 1 +HETATM 22743 O O . HOH V 10 . ? 39.313 81.601 80.183 1.00 11.83 ? 755 HOH E O 1 +HETATM 22744 O O . HOH V 10 . ? 48.590 90.565 49.965 1.00 24.98 ? 756 HOH E O 1 +HETATM 22745 O O . HOH V 10 . ? 90.242 74.458 62.382 1.00 15.11 ? 757 HOH E O 1 +HETATM 22746 O O . HOH V 10 . ? 42.346 65.053 75.555 1.00 13.30 ? 758 HOH E O 1 +HETATM 22747 O O . HOH V 10 . ? 54.353 68.058 107.748 1.00 11.93 ? 759 HOH E O 1 +HETATM 22748 O O . HOH V 10 . ? 71.834 78.220 72.475 1.00 9.33 ? 760 HOH E O 1 +HETATM 22749 O O . HOH V 10 . ? 66.885 71.781 66.535 1.00 16.01 ? 761 HOH E O 1 +HETATM 22750 O O . HOH V 10 . ? 59.600 84.707 110.803 1.00 18.99 ? 762 HOH E O 1 +HETATM 22751 O O . HOH V 10 . ? 44.500 98.311 92.117 1.00 16.37 ? 763 HOH E O 1 +HETATM 22752 O O . HOH V 10 . ? 48.900 60.117 80.557 1.00 33.11 ? 764 HOH E O 1 +HETATM 22753 O O . HOH V 10 . ? 81.929 85.881 91.548 1.00 17.41 ? 765 HOH E O 1 +HETATM 22754 O O . HOH V 10 . ? 67.937 66.482 95.593 1.00 24.20 ? 766 HOH E O 1 +HETATM 22755 O O . HOH V 10 . ? 67.694 64.372 97.278 1.00 18.97 ? 767 HOH E O 1 +HETATM 22756 O O . HOH V 10 . ? 71.307 89.046 83.278 1.00 7.79 ? 768 HOH E O 1 +HETATM 22757 O O . HOH V 10 . ? 42.870 71.570 78.426 1.00 13.24 ? 769 HOH E O 1 +HETATM 22758 O O . HOH V 10 . ? 91.359 85.380 62.205 1.00 14.10 ? 770 HOH E O 1 +HETATM 22759 O O . HOH V 10 . ? 71.272 67.923 92.636 1.00 12.60 ? 771 HOH E O 1 +HETATM 22760 O O . HOH V 10 . ? 51.295 84.791 61.735 1.00 14.27 ? 772 HOH E O 1 +HETATM 22761 O O . HOH V 10 . ? 54.200 68.076 64.331 1.00 12.65 ? 773 HOH E O 1 +HETATM 22762 O O . HOH V 10 . ? 85.745 65.729 76.313 1.00 16.20 ? 774 HOH E O 1 +HETATM 22763 O O . HOH V 10 . ? 47.603 64.357 73.701 1.00 17.17 ? 775 HOH E O 1 +HETATM 22764 O O . HOH V 10 . ? 69.156 74.248 74.107 1.00 14.04 ? 776 HOH E O 1 +HETATM 22765 O O . HOH V 10 . ? 43.488 83.714 98.418 1.00 22.60 ? 777 HOH E O 1 +HETATM 22766 O O . HOH V 10 . ? 39.201 73.389 48.316 1.00 19.02 ? 778 HOH E O 1 +HETATM 22767 O O . HOH V 10 . ? 75.922 83.016 55.594 1.00 28.93 ? 779 HOH E O 1 +HETATM 22768 O O . HOH V 10 . ? 53.258 73.047 41.084 1.00 16.37 ? 780 HOH E O 1 +HETATM 22769 O O . HOH V 10 . ? 86.652 98.847 76.956 1.00 11.79 ? 781 HOH E O 1 +HETATM 22770 O O . HOH V 10 . ? 37.308 81.947 64.035 1.00 27.61 ? 782 HOH E O 1 +HETATM 22771 O O . HOH V 10 . ? 80.118 100.495 80.641 1.00 22.87 ? 783 HOH E O 1 +HETATM 22772 O O . HOH V 10 . ? 85.434 89.371 69.660 1.00 14.14 ? 784 HOH E O 1 +HETATM 22773 O O . HOH V 10 . ? 59.943 95.595 89.030 1.00 13.93 ? 785 HOH E O 1 +HETATM 22774 O O . HOH V 10 . ? 54.068 85.824 61.239 1.00 15.05 ? 786 HOH E O 1 +HETATM 22775 O O . HOH V 10 . ? 61.519 83.860 87.068 1.00 14.42 ? 787 HOH E O 1 +HETATM 22776 O O . HOH V 10 . ? 46.213 83.908 52.630 1.00 18.99 ? 788 HOH E O 1 +HETATM 22777 O O . HOH V 10 . ? 60.943 88.389 104.452 1.00 18.57 ? 789 HOH E O 1 +HETATM 22778 O O . HOH V 10 . ? 39.122 81.803 70.364 1.00 12.54 ? 790 HOH E O 1 +HETATM 22779 O O . HOH V 10 . ? 77.956 60.588 52.122 1.00 15.14 ? 791 HOH E O 1 +HETATM 22780 O O . HOH V 10 . ? 55.715 56.577 74.878 1.00 9.09 ? 792 HOH E O 1 +HETATM 22781 O O . HOH V 10 . ? 47.355 60.299 84.699 1.00 15.65 ? 793 HOH E O 1 +HETATM 22782 O O . HOH V 10 . ? 56.586 84.825 40.005 1.00 50.31 ? 794 HOH E O 1 +HETATM 22783 O O . HOH V 10 . ? 40.682 83.971 58.407 1.00 19.88 ? 795 HOH E O 1 +HETATM 22784 O O . HOH V 10 . ? 64.324 73.841 55.417 1.00 18.70 ? 796 HOH E O 1 +HETATM 22785 O O . HOH V 10 . ? 52.680 93.135 83.993 1.00 19.21 ? 797 HOH E O 1 +HETATM 22786 O O . HOH V 10 . ? 65.387 80.326 97.119 1.00 8.60 ? 798 HOH E O 1 +HETATM 22787 O O . HOH V 10 . ? 38.821 76.054 49.321 1.00 19.42 ? 799 HOH E O 1 +HETATM 22788 O O . HOH V 10 . ? 73.866 75.950 92.420 1.00 12.72 ? 800 HOH E O 1 +HETATM 22789 O O . HOH V 10 . ? 75.535 76.718 95.001 1.00 13.59 ? 801 HOH E O 1 +HETATM 22790 O O . HOH V 10 . ? 78.769 78.097 89.211 1.00 18.05 ? 802 HOH E O 1 +HETATM 22791 O O . HOH V 10 . ? 39.423 65.596 66.910 1.00 21.24 ? 803 HOH E O 1 +HETATM 22792 O O . HOH V 10 . ? 43.802 79.210 45.114 1.00 18.61 ? 804 HOH E O 1 +HETATM 22793 O O . HOH V 10 . ? 45.458 87.800 60.145 1.00 17.24 ? 805 HOH E O 1 +HETATM 22794 O O . HOH V 10 . ? 68.023 94.244 77.158 1.00 17.16 ? 806 HOH E O 1 +HETATM 22795 O O . HOH V 10 . ? 59.398 78.933 60.157 1.00 15.13 ? 807 HOH E O 1 +HETATM 22796 O O . HOH V 10 . ? 44.131 82.937 66.540 1.00 11.62 ? 808 HOH E O 1 +HETATM 22797 O O . HOH V 10 . ? 89.210 67.769 62.097 1.00 24.36 ? 809 HOH E O 1 +HETATM 22798 O O . HOH V 10 . ? 73.330 82.618 55.528 1.00 21.91 ? 810 HOH E O 1 +HETATM 22799 O O . HOH V 10 . ? 64.705 62.721 49.199 1.00 15.78 ? 811 HOH E O 1 +HETATM 22800 O O . HOH V 10 . ? 38.487 68.149 66.477 1.00 22.28 ? 812 HOH E O 1 +HETATM 22801 O O . HOH V 10 . ? 96.635 75.346 61.988 1.00 18.44 ? 813 HOH E O 1 +HETATM 22802 O O . HOH V 10 . ? 71.427 61.330 63.614 1.00 25.08 ? 814 HOH E O 1 +HETATM 22803 O O . HOH V 10 . ? 65.441 67.133 94.825 1.00 11.84 ? 815 HOH E O 1 +HETATM 22804 O O . HOH V 10 . ? 42.134 73.395 96.239 1.00 14.94 ? 816 HOH E O 1 +HETATM 22805 O O . HOH V 10 . ? 42.143 88.730 71.389 1.00 19.58 ? 817 HOH E O 1 +HETATM 22806 O O . HOH V 10 . ? 67.912 64.273 92.428 1.00 11.48 ? 818 HOH E O 1 +HETATM 22807 O O . HOH V 10 . ? 84.385 86.506 92.079 1.00 16.23 ? 819 HOH E O 1 +HETATM 22808 O O . HOH V 10 . ? 96.786 86.028 75.233 1.00 11.21 ? 820 HOH E O 1 +HETATM 22809 O O . HOH V 10 . ? 46.254 83.585 104.552 1.00 13.66 ? 821 HOH E O 1 +HETATM 22810 O O . HOH V 10 . ? 57.767 83.423 113.153 1.00 32.75 ? 822 HOH E O 1 +HETATM 22811 O O . HOH V 10 . ? 93.505 76.583 74.927 1.00 16.01 ? 823 HOH E O 1 +HETATM 22812 O O . HOH V 10 . ? 49.136 63.839 64.574 1.00 19.43 ? 824 HOH E O 1 +HETATM 22813 O O . HOH V 10 . ? 90.876 68.077 64.173 1.00 14.95 ? 825 HOH E O 1 +HETATM 22814 O O . HOH V 10 . ? 45.493 72.805 43.589 1.00 18.27 ? 826 HOH E O 1 +HETATM 22815 O O . HOH V 10 . ? 72.322 87.850 72.388 1.00 10.80 ? 827 HOH E O 1 +HETATM 22816 O O . HOH V 10 . ? 43.119 62.204 75.342 1.00 23.95 ? 828 HOH E O 1 +HETATM 22817 O O . HOH V 10 . ? 66.600 82.325 63.655 1.00 11.13 ? 829 HOH E O 1 +HETATM 22818 O O . HOH V 10 . ? 91.857 91.437 86.399 1.00 13.60 ? 830 HOH E O 1 +HETATM 22819 O O . HOH V 10 . ? 70.574 82.306 59.204 1.00 16.47 ? 831 HOH E O 1 +HETATM 22820 O O . HOH V 10 . ? 70.700 70.356 89.408 1.00 25.33 ? 832 HOH E O 1 +HETATM 22821 O O . HOH V 10 . ? 49.874 93.059 95.673 1.00 28.20 ? 833 HOH E O 1 +HETATM 22822 O O . HOH V 10 . ? 65.661 58.193 89.207 1.00 22.84 ? 834 HOH E O 1 +HETATM 22823 O O . HOH V 10 . ? 63.901 80.516 88.965 1.00 15.48 ? 835 HOH E O 1 +HETATM 22824 O O . HOH V 10 . ? 99.403 84.590 69.103 1.00 28.36 ? 836 HOH E O 1 +HETATM 22825 O O . HOH V 10 . ? 80.742 78.884 81.369 1.00 8.62 ? 837 HOH E O 1 +HETATM 22826 O O . HOH V 10 . ? 87.091 81.647 81.676 1.00 13.19 ? 838 HOH E O 1 +HETATM 22827 O O . HOH V 10 . ? 79.596 83.390 79.944 1.00 11.15 ? 839 HOH E O 1 +HETATM 22828 O O . HOH V 10 . ? 48.021 64.873 66.977 1.00 17.50 ? 840 HOH E O 1 +HETATM 22829 O O . HOH V 10 . ? 90.142 72.451 75.282 1.00 21.51 ? 841 HOH E O 1 +HETATM 22830 O O . HOH V 10 . ? 30.849 81.292 62.392 1.00 36.26 ? 842 HOH E O 1 +HETATM 22831 O O . HOH V 10 . ? 57.233 76.795 108.711 1.00 16.13 ? 843 HOH E O 1 +HETATM 22832 O O . HOH V 10 . ? 76.680 75.602 89.327 1.00 13.37 ? 844 HOH E O 1 +HETATM 22833 O O . HOH V 10 . ? 65.581 87.789 107.447 1.00 33.60 ? 845 HOH E O 1 +HETATM 22834 O O . HOH V 10 . ? 77.761 75.648 42.605 1.00 32.09 ? 846 HOH E O 1 +HETATM 22835 O O . HOH V 10 . ? 96.713 77.600 77.567 1.00 35.23 ? 847 HOH E O 1 +HETATM 22836 O O . HOH V 10 . ? 57.334 87.956 108.398 1.00 14.58 ? 848 HOH E O 1 +HETATM 22837 O O . HOH V 10 . ? 72.211 80.726 87.546 1.00 8.75 ? 849 HOH E O 1 +HETATM 22838 O O . HOH V 10 . ? 76.957 93.417 86.959 1.00 18.02 ? 850 HOH E O 1 +HETATM 22839 O O . HOH V 10 . ? 49.461 63.069 55.652 1.00 37.77 ? 851 HOH E O 1 +HETATM 22840 O O . HOH V 10 . ? 56.589 77.537 62.777 1.00 11.89 ? 852 HOH E O 1 +HETATM 22841 O O . HOH V 10 . ? 88.171 65.272 81.281 1.00 13.62 ? 853 HOH E O 1 +HETATM 22842 O O . HOH V 10 . ? 70.793 85.588 100.369 1.00 24.74 ? 854 HOH E O 1 +HETATM 22843 O O . HOH V 10 . ? 54.332 70.881 63.583 1.00 21.57 ? 855 HOH E O 1 +HETATM 22844 O O . HOH V 10 . ? 37.287 83.838 69.886 1.00 26.03 ? 856 HOH E O 1 +HETATM 22845 O O . HOH V 10 . ? 80.970 69.458 85.590 1.00 14.46 ? 857 HOH E O 1 +HETATM 22846 O O . HOH V 10 . ? 74.303 74.818 42.357 1.00 26.25 ? 858 HOH E O 1 +HETATM 22847 O O . HOH V 10 . ? 38.299 67.203 57.700 1.00 17.42 ? 859 HOH E O 1 +HETATM 22848 O O . HOH V 10 . ? 55.520 74.827 62.527 1.00 14.61 ? 860 HOH E O 1 +HETATM 22849 O O . HOH V 10 . ? 50.896 79.222 41.033 1.00 18.56 ? 861 HOH E O 1 +HETATM 22850 O O . HOH V 10 . ? 58.771 58.960 85.949 1.00 8.01 ? 862 HOH E O 1 +HETATM 22851 O O . HOH V 10 . ? 58.302 96.675 91.156 1.00 22.90 ? 870 HOH E O 1 +HETATM 22852 O O . HOH V 10 . ? 57.959 97.729 64.583 1.00 35.37 ? 871 HOH E O 1 +HETATM 22853 O O . HOH V 10 . ? 50.804 66.767 60.336 1.00 23.63 ? 873 HOH E O 1 +HETATM 22854 O O . HOH V 10 . ? 93.321 62.229 72.149 1.00 30.55 ? 874 HOH E O 1 +HETATM 22855 O O . HOH V 10 . ? 63.105 77.821 54.831 1.00 13.81 ? 875 HOH E O 1 +HETATM 22856 O O . HOH V 10 . ? 60.715 66.658 65.994 1.00 40.79 ? 878 HOH E O 1 +HETATM 22857 O O . HOH V 10 . ? 60.573 85.124 57.427 1.00 27.49 ? 880 HOH E O 1 +HETATM 22858 O O . HOH V 10 . ? 44.110 84.456 62.272 1.00 26.75 ? 882 HOH E O 1 +HETATM 22859 O O . HOH V 10 . ? 38.114 83.175 82.795 1.00 21.30 ? 885 HOH E O 1 +HETATM 22860 O O . HOH V 10 . ? 67.244 74.054 63.051 1.00 13.12 ? 887 HOH E O 1 +HETATM 22861 O O . HOH V 10 . ? 86.296 88.586 79.049 1.00 11.81 ? 892 HOH E O 1 +HETATM 22862 O O . HOH V 10 . ? 67.334 102.528 82.029 1.00 16.50 ? 899 HOH E O 1 +HETATM 22863 O O . HOH V 10 . ? 38.781 75.711 96.984 1.00 19.50 ? 904 HOH E O 1 +HETATM 22864 O O . HOH V 10 . ? 41.865 63.906 90.469 1.00 27.11 ? 906 HOH E O 1 +HETATM 22865 O O . HOH V 10 . ? 67.591 62.265 53.219 1.00 20.65 ? 910 HOH E O 1 +HETATM 22866 O O . HOH V 10 . ? 36.044 71.292 76.840 1.00 39.53 ? 912 HOH E O 1 +HETATM 22867 O O . HOH V 10 . ? 93.724 66.360 74.357 1.00 16.95 ? 928 HOH E O 1 +HETATM 22868 O O . HOH V 10 . ? 51.904 100.197 71.376 1.00 13.36 ? 929 HOH E O 1 +HETATM 22869 O O . HOH V 10 . ? 49.802 69.013 103.011 1.00 39.31 ? 933 HOH E O 1 +HETATM 22870 O O . HOH V 10 . ? 47.511 63.872 70.943 1.00 22.15 ? 936 HOH E O 1 +HETATM 22871 O O . HOH V 10 . ? 45.194 93.981 74.814 1.00 23.13 ? 945 HOH E O 1 +HETATM 22872 O O . HOH V 10 . ? 78.266 85.174 91.916 1.00 22.38 ? 948 HOH E O 1 +HETATM 22873 O O . HOH V 10 . ? 50.453 83.491 42.915 1.00 26.37 ? 951 HOH E O 1 +HETATM 22874 O O . HOH V 10 . ? 90.751 80.564 52.139 1.00 42.36 ? 952 HOH E O 1 +HETATM 22875 O O . HOH V 10 . ? 66.157 60.068 105.924 1.00 18.12 ? 953 HOH E O 1 +HETATM 22876 O O . HOH V 10 . ? 68.177 66.814 62.998 1.00 18.52 ? 958 HOH E O 1 +HETATM 22877 O O . HOH V 10 . ? 73.128 84.302 99.639 1.00 18.25 ? 963 HOH E O 1 +HETATM 22878 O O . HOH V 10 . ? 82.523 99.441 79.056 1.00 31.31 ? 967 HOH E O 1 +HETATM 22879 O O . HOH V 10 . ? 67.979 73.398 38.706 1.00 23.53 ? 972 HOH E O 1 +HETATM 22880 O O . HOH V 10 . ? 39.012 91.089 92.585 1.00 18.94 ? 975 HOH E O 1 +HETATM 22881 O O . HOH V 10 . ? 37.033 81.054 66.594 1.00 21.26 ? 976 HOH E O 1 +HETATM 22882 O O . HOH V 10 . ? 72.910 80.963 91.574 1.00 14.04 ? 978 HOH E O 1 +HETATM 22883 O O . HOH V 10 . ? 77.452 82.639 83.447 1.00 18.15 ? 988 HOH E O 1 +HETATM 22884 O O . HOH V 10 . ? 89.500 83.958 84.977 1.00 38.86 ? 989 HOH E O 1 +HETATM 22885 O O . HOH V 10 . ? 74.045 91.591 70.854 1.00 22.37 ? 991 HOH E O 1 +HETATM 22886 O O . HOH V 10 . ? 35.937 77.218 49.045 1.00 31.35 ? 995 HOH E O 1 +HETATM 22887 O O . HOH V 10 . ? 73.880 69.573 36.318 1.00 33.75 ? 997 HOH E O 1 +HETATM 22888 O O . HOH V 10 . ? 56.918 65.731 64.285 1.00 25.01 ? 998 HOH E O 1 +HETATM 22889 O O . HOH V 10 . ? 34.870 85.280 83.423 1.00 35.81 ? 1000 HOH E O 1 +HETATM 22890 O O . HOH V 10 . ? 81.190 93.314 73.609 1.00 33.82 ? 1004 HOH E O 1 +HETATM 22891 O O . HOH V 10 . ? 72.437 83.201 96.576 1.00 34.06 ? 1016 HOH E O 1 +HETATM 22892 O O . HOH V 10 . ? 77.230 95.400 74.746 1.00 20.60 ? 1019 HOH E O 1 +HETATM 22893 O O . HOH V 10 . ? 97.238 77.779 63.539 1.00 18.34 ? 1020 HOH E O 1 +HETATM 22894 O O . HOH V 10 . ? 68.438 74.900 95.764 1.00 17.00 ? 1021 HOH E O 1 +HETATM 22895 O O . HOH V 10 . ? 55.266 65.118 49.529 1.00 30.92 ? 1024 HOH E O 1 +HETATM 22896 O O . HOH V 10 . ? 51.500 59.900 77.428 1.00 20.82 ? 1026 HOH E O 1 +HETATM 22897 O O . HOH V 10 . ? 37.410 72.551 50.172 1.00 25.06 ? 1028 HOH E O 1 +HETATM 22898 O O . HOH V 10 . ? 93.273 88.553 67.009 1.00 22.80 ? 1029 HOH E O 1 +HETATM 22899 O O . HOH V 10 . ? 57.581 65.802 57.456 1.00 36.97 ? 1034 HOH E O 1 +HETATM 22900 O O . HOH V 10 . ? 63.763 69.625 77.136 1.00 32.07 ? 1035 HOH E O 1 +HETATM 22901 O O . HOH V 10 . ? 55.376 66.447 62.142 1.00 37.95 ? 1045 HOH E O 1 +HETATM 22902 O O . HOH V 10 . ? 50.934 84.194 111.842 1.00 25.16 ? 1046 HOH E O 1 +HETATM 22903 O O . HOH V 10 . ? 46.522 60.651 79.431 1.00 27.75 ? 1047 HOH E O 1 +HETATM 22904 O O . HOH V 10 . ? 37.914 63.531 63.082 1.00 28.08 ? 1049 HOH E O 1 +HETATM 22905 O O . HOH V 10 . ? 81.533 70.226 41.048 1.00 32.07 ? 1053 HOH E O 1 +HETATM 22906 O O . HOH V 10 . ? 31.095 72.495 57.016 1.00 21.86 ? 1054 HOH E O 1 +HETATM 22907 O O . HOH V 10 . ? 73.970 89.823 63.890 1.00 39.37 ? 1056 HOH E O 1 +HETATM 22908 O O . HOH V 10 . ? 44.328 72.883 98.038 1.00 15.19 ? 1058 HOH E O 1 +HETATM 22909 O O . HOH V 10 . ? 70.281 87.689 65.165 1.00 20.38 ? 1063 HOH E O 1 +HETATM 22910 O O . HOH V 10 . ? 75.933 86.673 93.414 1.00 42.65 ? 1070 HOH E O 1 +HETATM 22911 O O . HOH V 10 . ? 66.827 67.165 77.847 1.00 23.59 ? 1073 HOH E O 1 +HETATM 22912 O O . HOH V 10 . ? 91.618 70.264 74.024 1.00 27.32 ? 1076 HOH E O 1 +HETATM 22913 O O . HOH V 10 . ? 86.818 96.365 76.441 1.00 24.97 ? 1079 HOH E O 1 +HETATM 22914 O O . HOH V 10 . ? 66.772 84.823 99.157 1.00 22.07 ? 1080 HOH E O 1 +HETATM 22915 O O . HOH V 10 . ? 77.141 97.971 75.652 1.00 18.06 ? 1081 HOH E O 1 +HETATM 22916 O O . HOH V 10 . ? 69.247 68.313 90.545 1.00 17.23 ? 1082 HOH E O 1 +HETATM 22917 O O . HOH V 10 . ? 50.843 63.038 49.600 1.00 41.26 ? 1085 HOH E O 1 +HETATM 22918 O O . HOH V 10 . ? 71.610 86.577 61.446 1.00 27.94 ? 1087 HOH E O 1 +HETATM 22919 O O . HOH V 10 . ? 59.741 86.768 108.791 1.00 21.52 ? 1088 HOH E O 1 +HETATM 22920 O O . HOH V 10 . ? 87.401 66.269 63.324 1.00 24.69 ? 1093 HOH E O 1 +HETATM 22921 O O . HOH V 10 . ? 56.291 85.469 53.389 1.00 38.18 ? 1094 HOH E O 1 +HETATM 22922 O O . HOH V 10 . ? 36.714 66.460 59.920 1.00 21.79 ? 1102 HOH E O 1 +HETATM 22923 O O . HOH V 10 . ? 52.038 101.515 85.455 1.00 27.39 ? 1103 HOH E O 1 +HETATM 22924 O O . HOH V 10 . ? 53.312 73.309 61.936 1.00 15.56 ? 1105 HOH E O 1 +HETATM 22925 O O . HOH V 10 . ? 60.869 82.626 109.322 1.00 26.34 ? 1106 HOH E O 1 +HETATM 22926 O O . HOH V 10 . ? 69.295 63.355 102.646 1.00 27.40 ? 1110 HOH E O 1 +HETATM 22927 O O . HOH V 10 . ? 73.460 103.550 80.206 1.00 47.72 ? 1114 HOH E O 1 +HETATM 22928 O O . HOH V 10 . ? 55.220 96.298 60.109 1.00 39.64 ? 1117 HOH E O 1 +HETATM 22929 O O . HOH V 10 . ? 91.283 87.960 80.092 1.00 20.88 ? 1120 HOH E O 1 +HETATM 22930 O O . HOH V 10 . ? 69.332 66.021 46.957 1.00 23.46 ? 1122 HOH E O 1 +HETATM 22931 O O . HOH V 10 . ? 63.015 67.451 42.962 1.00 34.36 ? 1123 HOH E O 1 +HETATM 22932 O O . HOH V 10 . ? 68.971 82.877 56.460 1.00 35.48 ? 1124 HOH E O 1 +HETATM 22933 O O . HOH V 10 . ? 32.833 82.736 71.204 1.00 30.18 ? 1125 HOH E O 1 +HETATM 22934 O O . HOH V 10 . ? 48.459 73.665 103.409 1.00 18.67 ? 1129 HOH E O 1 +HETATM 22935 O O . HOH V 10 . ? 54.064 100.623 66.151 1.00 18.44 ? 1131 HOH E O 1 +HETATM 22936 O O . HOH V 10 . ? 95.682 67.626 57.775 1.00 41.89 ? 1133 HOH E O 1 +HETATM 22937 O O . HOH V 10 . ? 69.754 65.484 93.879 1.00 24.07 ? 1136 HOH E O 1 +HETATM 22938 O O . HOH V 10 . ? 36.207 67.771 88.791 1.00 21.69 ? 1137 HOH E O 1 +HETATM 22939 O O . HOH V 10 . ? 32.601 70.501 66.220 1.00 59.79 ? 1139 HOH E O 1 +HETATM 22940 O O . HOH V 10 . ? 55.454 60.434 97.188 1.00 21.14 ? 1142 HOH E O 1 +HETATM 22941 O O . HOH V 10 . ? 35.272 89.063 86.173 1.00 38.64 ? 1144 HOH E O 1 +HETATM 22942 O O . HOH V 10 . ? 48.305 65.228 47.579 1.00 19.51 ? 1146 HOH E O 1 +HETATM 22943 O O . HOH V 10 . ? 34.791 87.059 78.142 1.00 23.02 ? 1152 HOH E O 1 +HETATM 22944 O O . HOH V 10 . ? 82.379 58.462 65.666 1.00 25.17 ? 1153 HOH E O 1 +HETATM 22945 O O . HOH V 10 . ? 35.138 65.751 73.820 1.00 32.06 ? 1156 HOH E O 1 +HETATM 22946 O O . HOH V 10 . ? 38.438 64.594 56.759 1.00 17.77 ? 1165 HOH E O 1 +HETATM 22947 O O . HOH V 10 . ? 61.184 83.879 43.186 1.00 22.45 ? 1170 HOH E O 1 +HETATM 22948 O O . HOH V 10 . ? 48.711 78.373 38.680 1.00 36.97 ? 1171 HOH E O 1 +HETATM 22949 O O . HOH V 10 . ? 86.691 68.101 77.323 1.00 29.64 ? 1173 HOH E O 1 +HETATM 22950 O O . HOH V 10 . ? 52.256 68.963 103.718 1.00 18.87 ? 1179 HOH E O 1 +HETATM 22951 O O . HOH V 10 . ? 57.521 63.240 64.280 1.00 33.36 ? 1183 HOH E O 1 +HETATM 22952 O O . HOH V 10 . ? 81.570 90.256 74.542 1.00 16.44 ? 1193 HOH E O 1 +HETATM 22953 O O . HOH V 10 . ? 80.022 92.808 90.548 1.00 24.18 ? 1195 HOH E O 1 +HETATM 22954 O O . HOH V 10 . ? 38.703 74.801 82.276 1.00 35.37 ? 1197 HOH E O 1 +HETATM 22955 O O . HOH V 10 . ? 98.582 83.013 72.905 1.00 31.37 ? 1198 HOH E O 1 +HETATM 22956 O O . HOH V 10 . ? 44.338 63.099 64.786 1.00 26.94 ? 1203 HOH E O 1 +HETATM 22957 O O . HOH V 10 . ? 84.589 78.196 89.250 1.00 26.72 ? 1207 HOH E O 1 +HETATM 22958 O O . HOH V 10 . ? 53.865 98.534 64.609 1.00 25.95 ? 1211 HOH E O 1 +HETATM 22959 O O . HOH V 10 . ? 48.870 83.202 55.776 1.00 21.56 ? 1213 HOH E O 1 +HETATM 22960 O O . HOH V 10 . ? 61.506 93.436 88.846 1.00 17.59 ? 1215 HOH E O 1 +HETATM 22961 O O . HOH V 10 . ? 41.004 74.531 79.934 1.00 22.91 ? 1218 HOH E O 1 +HETATM 22962 O O . HOH V 10 . ? 49.730 59.585 69.129 1.00 45.44 ? 1221 HOH E O 1 +HETATM 22963 O O . HOH V 10 . ? 78.363 76.779 39.991 1.00 32.82 ? 1222 HOH E O 1 +HETATM 22964 O O . HOH V 10 . ? 39.264 88.750 99.896 1.00 32.48 ? 1223 HOH E O 1 +HETATM 22965 O O . HOH V 10 . ? 66.385 69.684 76.709 1.00 26.64 ? 1224 HOH E O 1 +HETATM 22966 O O . HOH V 10 . ? 77.813 82.716 91.263 1.00 18.08 ? 1230 HOH E O 1 +HETATM 22967 O O . HOH V 10 . ? 33.863 74.139 51.178 1.00 35.47 ? 1235 HOH E O 1 +HETATM 22968 O O . HOH V 10 . ? 72.308 84.251 87.955 1.00 28.52 ? 1240 HOH E O 1 +HETATM 22969 O O . HOH V 10 . ? 65.070 69.343 79.329 1.00 29.31 ? 1244 HOH E O 1 +HETATM 22970 O O . HOH V 10 . ? 33.051 88.808 76.851 1.00 32.50 ? 1246 HOH E O 1 +HETATM 22971 O O . HOH V 10 . ? 46.032 70.160 43.824 1.00 31.77 ? 1252 HOH E O 1 +HETATM 22972 O O . HOH V 10 . ? 80.391 88.398 90.507 1.00 27.53 ? 1263 HOH E O 1 +HETATM 22973 O O . HOH V 10 . ? 59.405 95.391 60.496 1.00 44.78 ? 1265 HOH E O 1 +HETATM 22974 O O . HOH V 10 . ? 51.469 63.017 97.446 1.00 20.67 ? 1268 HOH E O 1 +HETATM 22975 O O . HOH V 10 . ? 56.472 67.269 51.003 1.00 20.95 ? 1274 HOH E O 1 +HETATM 22976 O O . HOH V 10 . ? 33.074 71.146 62.188 1.00 29.11 ? 1279 HOH E O 1 +HETATM 22977 O O . HOH V 10 . ? 72.896 99.817 85.124 1.00 19.07 ? 1284 HOH E O 1 +HETATM 22978 O O . HOH V 10 . ? 55.378 86.125 101.896 1.00 9.66 ? 1289 HOH E O 1 +HETATM 22979 O O . HOH V 10 . ? 66.780 82.748 97.288 1.00 16.22 ? 1294 HOH E O 1 +HETATM 22980 O O . HOH V 10 . ? 96.529 85.158 72.348 1.00 14.54 ? 1299 HOH E O 1 +HETATM 22981 O O . HOH V 10 . ? 39.665 77.130 86.403 1.00 17.21 ? 1308 HOH E O 1 +HETATM 22982 O O . HOH V 10 . ? 82.465 83.628 85.419 1.00 14.86 ? 1310 HOH E O 1 +HETATM 22983 O O . HOH V 10 . ? 84.747 71.954 84.625 1.00 14.77 ? 1316 HOH E O 1 +HETATM 22984 O O . HOH V 10 . ? 94.515 77.730 81.534 1.00 36.09 ? 1320 HOH E O 1 +HETATM 22985 O O . HOH V 10 . ? 75.402 67.131 36.138 1.00 43.32 ? 1321 HOH E O 1 +HETATM 22986 O O . HOH V 10 . ? 68.590 71.081 90.763 1.00 10.14 ? 1327 HOH E O 1 +HETATM 22987 O O . HOH V 10 . ? 88.083 78.794 82.750 1.00 16.12 ? 1328 HOH E O 1 +HETATM 22988 O O . HOH V 10 . ? 41.854 77.357 104.029 1.00 23.34 ? 1330 HOH E O 1 +HETATM 22989 O O . HOH V 10 . ? 58.868 71.809 112.410 1.00 22.59 ? 1333 HOH E O 1 +HETATM 22990 O O . HOH V 10 . ? 88.942 64.249 68.904 1.00 28.52 ? 1336 HOH E O 1 +HETATM 22991 O O . HOH V 10 . ? 47.933 87.046 58.662 1.00 18.75 ? 1337 HOH E O 1 +HETATM 22992 O O . HOH V 10 . ? 97.775 83.706 76.665 1.00 24.10 ? 1341 HOH E O 1 +HETATM 22993 O O . HOH V 10 . ? 69.116 82.935 61.306 1.00 15.85 ? 1346 HOH E O 1 +HETATM 22994 O O . HOH V 10 . ? 36.693 68.408 55.507 1.00 22.85 ? 1347 HOH E O 1 +HETATM 22995 O O . HOH V 10 . ? 94.138 88.119 63.929 1.00 32.85 ? 1349 HOH E O 1 +HETATM 22996 O O . HOH V 10 . ? 74.269 64.044 71.515 1.00 15.39 ? 1350 HOH E O 1 +HETATM 22997 O O . HOH V 10 . ? 57.280 72.851 61.452 1.00 15.34 ? 1360 HOH E O 1 +HETATM 22998 O O . HOH V 10 . ? 63.398 75.682 61.710 1.00 24.88 ? 1370 HOH E O 1 +HETATM 22999 O O . HOH V 10 . ? 66.419 66.478 65.009 1.00 27.09 ? 1371 HOH E O 1 +HETATM 23000 O O . HOH V 10 . ? 96.193 77.980 60.528 1.00 15.41 ? 1373 HOH E O 1 +HETATM 23001 O O . HOH V 10 . ? 94.764 65.710 70.892 1.00 24.96 ? 1379 HOH E O 1 +HETATM 23002 O O . HOH V 10 . ? 46.263 62.772 67.100 1.00 17.73 ? 1381 HOH E O 1 +HETATM 23003 O O . HOH V 10 . ? 47.213 84.906 57.249 1.00 19.63 ? 1382 HOH E O 1 +HETATM 23004 O O . HOH V 10 . ? 67.109 68.019 39.304 1.00 38.05 ? 1383 HOH E O 1 +HETATM 23005 O O . HOH V 10 . ? 36.875 81.483 91.061 1.00 21.27 ? 1384 HOH E O 1 +HETATM 23006 O O . HOH V 10 . ? 63.236 83.024 91.089 1.00 19.71 ? 1391 HOH E O 1 +HETATM 23007 O O . HOH V 10 . ? 66.934 62.783 94.562 1.00 18.73 ? 1392 HOH E O 1 +HETATM 23008 O O . HOH V 10 . ? 53.349 102.744 87.581 1.00 29.27 ? 1393 HOH E O 1 +HETATM 23009 O O . HOH V 10 . ? 60.014 80.314 57.846 1.00 19.15 ? 1402 HOH E O 1 +HETATM 23010 O O . HOH V 10 . ? 76.471 70.373 86.767 1.00 14.90 ? 1403 HOH E O 1 +HETATM 23011 O O . HOH V 10 . ? 77.419 97.233 85.275 1.00 24.09 ? 1404 HOH E O 1 +HETATM 23012 O O . HOH V 10 . ? 55.023 67.396 57.716 1.00 17.85 ? 1409 HOH E O 1 +HETATM 23013 O O . HOH V 10 . ? 55.884 100.978 68.267 1.00 28.05 ? 1412 HOH E O 1 +HETATM 23014 O O . HOH V 10 . ? 41.861 82.172 99.539 1.00 18.27 ? 1418 HOH E O 1 +HETATM 23015 O O . HOH V 10 . ? 44.358 96.774 75.062 1.00 25.77 ? 1419 HOH E O 1 +HETATM 23016 O O . HOH V 10 . ? 67.257 78.150 40.332 1.00 19.39 ? 1421 HOH E O 1 +HETATM 23017 O O . HOH V 10 . ? 76.048 78.591 47.297 1.00 24.24 ? 1423 HOH E O 1 +HETATM 23018 O O . HOH V 10 . ? 93.615 90.678 90.099 1.00 21.42 ? 1424 HOH E O 1 +HETATM 23019 O O . HOH V 10 . ? 38.521 90.011 72.649 1.00 39.63 ? 1428 HOH E O 1 +HETATM 23020 O O . HOH V 10 . ? 74.412 83.406 91.328 1.00 22.15 ? 1430 HOH E O 1 +HETATM 23021 O O . HOH V 10 . ? 60.582 76.157 62.450 1.00 27.92 ? 1435 HOH E O 1 +HETATM 23022 O O . HOH V 10 . ? 52.661 65.431 52.010 1.00 22.63 ? 1436 HOH E O 1 +HETATM 23023 O O . HOH V 10 . ? 99.732 85.785 65.525 1.00 32.62 ? 1441 HOH E O 1 +HETATM 23024 O O . HOH V 10 . ? 53.327 57.882 74.841 1.00 17.69 ? 1444 HOH E O 1 +HETATM 23025 O O . HOH V 10 . ? 87.037 83.553 87.097 1.00 28.30 ? 1449 HOH E O 1 +HETATM 23026 O O . HOH V 10 . ? 93.867 85.736 56.554 1.00 39.85 ? 1452 HOH E O 1 +HETATM 23027 O O . HOH V 10 . ? 45.264 63.144 69.632 1.00 19.27 ? 1454 HOH E O 1 +HETATM 23028 O O . HOH V 10 . ? 56.838 94.304 61.021 1.00 25.22 ? 1459 HOH E O 1 +HETATM 23029 O O . HOH V 10 . ? 50.316 101.561 73.003 1.00 16.75 ? 1464 HOH E O 1 +HETATM 23030 O O . HOH V 10 . ? 43.422 84.578 59.559 1.00 22.15 ? 1465 HOH E O 1 +HETATM 23031 O O . HOH V 10 . ? 48.402 65.316 59.835 1.00 21.03 ? 1473 HOH E O 1 +HETATM 23032 O O . HOH V 10 . ? 59.544 69.969 59.061 1.00 27.01 ? 1475 HOH E O 1 +HETATM 23033 O O . HOH V 10 . ? 63.464 86.363 108.260 1.00 18.68 ? 1478 HOH E O 1 +HETATM 23034 O O . HOH V 10 . ? 36.243 83.600 54.148 1.00 20.20 ? 1479 HOH E O 1 +HETATM 23035 O O . HOH V 10 . ? 80.309 80.947 86.217 1.00 31.97 ? 1482 HOH E O 1 +HETATM 23036 O O . HOH V 10 . ? 66.614 89.456 87.295 1.00 18.43 ? 1488 HOH E O 1 +HETATM 23037 O O . HOH V 10 . ? 68.234 84.800 58.185 1.00 36.92 ? 1489 HOH E O 1 +HETATM 23038 O O . HOH V 10 . ? 88.943 76.417 50.619 1.00 37.00 ? 1491 HOH E O 1 +HETATM 23039 O O . HOH V 10 . ? 96.809 79.278 74.799 1.00 21.62 ? 1494 HOH E O 1 +HETATM 23040 O O . HOH V 10 . ? 69.074 83.714 94.692 1.00 41.95 ? 1503 HOH E O 1 +HETATM 23041 O O . HOH V 10 . ? 60.292 86.737 91.539 1.00 22.25 ? 1505 HOH E O 1 +HETATM 23042 O O . HOH V 10 . ? 50.040 60.941 71.307 1.00 56.93 ? 1509 HOH E O 1 +HETATM 23043 O O . HOH V 10 . ? 49.333 76.201 40.154 1.00 23.89 ? 1512 HOH E O 1 +HETATM 23044 O O . HOH V 10 . ? 50.209 90.627 98.355 1.00 26.47 ? 1515 HOH E O 1 +HETATM 23045 O O . HOH V 10 . ? 65.520 78.801 55.548 1.00 21.28 ? 1522 HOH E O 1 +HETATM 23046 O O . HOH V 10 . ? 43.339 78.167 42.292 1.00 33.07 ? 1526 HOH E O 1 +HETATM 23047 O O . HOH V 10 . ? 74.632 84.547 101.791 1.00 18.32 ? 1532 HOH E O 1 +HETATM 23048 O O . HOH V 10 . ? 76.289 86.372 88.591 1.00 17.60 ? 1537 HOH E O 1 +HETATM 23049 O O . HOH V 10 . ? 71.467 94.454 66.682 1.00 32.64 ? 1541 HOH E O 1 +HETATM 23050 O O . HOH V 10 . ? 68.690 93.134 73.771 1.00 15.06 ? 1544 HOH E O 1 +HETATM 23051 O O . HOH V 10 . ? 68.103 69.702 68.237 1.00 15.83 ? 1556 HOH E O 1 +HETATM 23052 O O . HOH V 10 . ? 48.681 90.650 66.866 1.00 35.02 ? 1561 HOH E O 1 +HETATM 23053 O O . HOH V 10 . ? 45.191 86.716 62.572 1.00 23.82 ? 1563 HOH E O 1 +HETATM 23054 O O . HOH V 10 . ? 80.066 94.753 75.632 1.00 19.00 ? 1566 HOH E O 1 +HETATM 23055 O O . HOH V 10 . ? 67.342 86.809 103.257 1.00 32.85 ? 1567 HOH E O 1 +HETATM 23056 O O . HOH V 10 . ? 72.736 81.234 52.193 1.00 23.66 ? 1576 HOH E O 1 +HETATM 23057 O O . HOH V 10 . ? 97.336 65.766 71.251 1.00 24.51 ? 1577 HOH E O 1 +HETATM 23058 O O . HOH V 10 . ? 63.237 76.067 53.009 1.00 21.37 ? 1578 HOH E O 1 +HETATM 23059 O O . HOH V 10 . ? 57.931 84.416 46.247 1.00 26.87 ? 1580 HOH E O 1 +HETATM 23060 O O . HOH V 10 . ? 43.703 98.047 81.399 1.00 33.40 ? 1584 HOH E O 1 +HETATM 23061 O O . HOH V 10 . ? 95.049 72.509 73.353 1.00 23.77 ? 1589 HOH E O 1 +HETATM 23062 O O . HOH V 10 . ? 71.719 61.343 54.720 1.00 37.23 ? 1590 HOH E O 1 +HETATM 23063 O O . HOH V 10 . ? 55.510 83.189 53.954 1.00 29.40 ? 1592 HOH E O 1 +HETATM 23064 O O . HOH V 10 . ? 91.223 83.958 83.092 1.00 32.52 ? 1603 HOH E O 1 +HETATM 23065 O O . HOH V 10 . ? 98.778 88.049 90.661 1.00 30.67 ? 1612 HOH E O 1 +HETATM 23066 O O . HOH V 10 . ? 61.862 71.102 77.998 1.00 28.73 ? 1617 HOH E O 1 +HETATM 23067 O O . HOH V 10 . ? 76.392 85.255 58.029 1.00 17.65 ? 1621 HOH E O 1 +HETATM 23068 O O . HOH V 10 . ? 45.409 97.788 79.279 1.00 22.45 ? 1622 HOH E O 1 +HETATM 23069 O O . HOH V 10 . ? 51.478 88.474 68.163 1.00 25.40 ? 1628 HOH E O 1 +HETATM 23070 O O . HOH V 10 . ? 96.288 75.179 53.438 1.00 36.57 ? 1633 HOH E O 1 +HETATM 23071 O O . HOH V 10 . ? 67.505 63.700 65.072 1.00 23.24 ? 1634 HOH E O 1 +HETATM 23072 O O . HOH V 10 . ? 56.071 69.699 40.411 1.00 31.65 ? 1637 HOH E O 1 +HETATM 23073 O O . HOH V 10 . ? 98.857 74.511 61.307 1.00 22.28 ? 1638 HOH E O 1 +HETATM 23074 O O . HOH V 10 . ? 77.197 92.233 72.617 1.00 18.91 ? 1642 HOH E O 1 +HETATM 23075 O O . HOH V 10 . ? 100.998 83.750 66.659 1.00 49.11 ? 1645 HOH E O 1 +HETATM 23076 O O . HOH V 10 . ? 41.756 87.760 101.769 1.00 30.47 ? 1647 HOH E O 1 +HETATM 23077 O O . HOH V 10 . ? 67.794 60.806 91.542 1.00 28.00 ? 1657 HOH E O 1 +HETATM 23078 O O . HOH V 10 . ? 81.289 81.319 51.790 1.00 28.07 ? 1659 HOH E O 1 +HETATM 23079 O O . HOH V 10 . ? 57.060 86.638 61.080 1.00 24.41 ? 1661 HOH E O 1 +HETATM 23080 O O . HOH V 10 . ? 62.464 105.070 85.932 1.00 44.32 ? 1662 HOH E O 1 +HETATM 23081 O O . HOH V 10 . ? 37.389 79.988 51.733 1.00 37.66 ? 1669 HOH E O 1 +HETATM 23082 O O . HOH V 10 . ? 95.275 75.031 76.399 1.00 32.50 ? 1672 HOH E O 1 +HETATM 23083 O O . HOH V 10 . ? 65.743 89.189 62.830 1.00 26.69 ? 1675 HOH E O 1 +HETATM 23084 O O . HOH V 10 . ? 59.539 66.157 42.962 1.00 32.78 ? 1680 HOH E O 1 +HETATM 23085 O O . HOH V 10 . ? 98.602 88.816 71.370 1.00 22.41 ? 1681 HOH E O 1 +HETATM 23086 O O . HOH V 10 . ? 52.327 68.765 106.364 1.00 23.16 ? 1683 HOH E O 1 +HETATM 23087 O O . HOH V 10 . ? 94.390 66.293 68.545 1.00 28.24 ? 1688 HOH E O 1 +HETATM 23088 O O . HOH V 10 . ? 91.163 67.088 56.434 1.00 43.81 ? 1691 HOH E O 1 +HETATM 23089 O O . HOH V 10 . ? 71.528 103.187 82.619 1.00 47.10 ? 1692 HOH E O 1 +HETATM 23090 O O . HOH V 10 . ? 47.899 64.928 57.041 1.00 23.07 ? 1696 HOH E O 1 +HETATM 23091 O O . HOH V 10 . ? 68.384 102.419 66.658 1.00 44.65 ? 1699 HOH E O 1 +HETATM 23092 O O . HOH V 10 . ? 63.169 107.198 82.154 1.00 43.17 ? 1700 HOH E O 1 +HETATM 23093 O O . HOH V 10 . ? 88.497 88.578 68.239 1.00 25.72 ? 1702 HOH E O 1 +HETATM 23094 O O . HOH V 10 . ? 97.164 74.580 72.236 1.00 41.71 ? 1705 HOH E O 1 +HETATM 23095 O O . HOH V 10 . ? 71.711 65.646 89.171 1.00 29.26 ? 1707 HOH E O 1 +HETATM 23096 O O . HOH V 10 . ? 59.123 72.776 63.600 1.00 25.32 ? 1708 HOH E O 1 +HETATM 23097 O O . HOH V 10 . ? 69.939 61.619 52.276 1.00 50.21 ? 1712 HOH E O 1 +HETATM 23098 O O . HOH V 10 . ? 55.390 85.082 47.547 1.00 34.93 ? 1721 HOH E O 1 +HETATM 23099 O O . HOH V 10 . ? 38.864 82.443 48.914 1.00 44.92 ? 1722 HOH E O 1 +HETATM 23100 O O . HOH V 10 . ? 61.046 83.959 89.825 1.00 23.72 ? 1723 HOH E O 1 +HETATM 23101 O O . HOH V 10 . ? 65.944 70.331 73.955 1.00 24.23 ? 1728 HOH E O 1 +HETATM 23102 O O . HOH V 10 . ? 40.020 62.670 59.932 1.00 26.07 ? 1729 HOH E O 1 +HETATM 23103 O O . HOH V 10 . ? 38.863 98.781 88.032 1.00 38.25 ? 1737 HOH E O 1 +HETATM 23104 O O . HOH V 10 . ? 86.572 98.485 84.175 1.00 24.87 ? 1738 HOH E O 1 +HETATM 23105 O O . HOH V 10 . ? 44.820 86.478 69.547 1.00 27.69 ? 1740 HOH E O 1 +HETATM 23106 O O . HOH V 10 . ? 52.724 66.259 62.277 1.00 35.96 ? 1754 HOH E O 1 +HETATM 23107 O O . HOH V 10 . ? 84.384 96.655 76.123 1.00 32.06 ? 1756 HOH E O 1 +HETATM 23108 O O . HOH V 10 . ? 91.261 64.021 70.210 1.00 28.28 ? 1758 HOH E O 1 +HETATM 23109 O O . HOH V 10 . ? 96.301 95.193 89.463 1.00 22.57 ? 1761 HOH E O 1 +HETATM 23110 O O . HOH V 10 . ? 96.741 90.584 72.888 1.00 34.79 ? 1762 HOH E O 1 +HETATM 23111 O O . HOH V 10 . ? 51.415 64.141 63.287 1.00 44.81 ? 1763 HOH E O 1 +HETATM 23112 O O . HOH V 10 . ? 78.454 90.163 71.884 1.00 26.13 ? 1765 HOH E O 1 +HETATM 23113 O O . HOH V 10 . ? 79.116 86.200 89.150 1.00 35.02 ? 1768 HOH E O 1 +HETATM 23114 O O . HOH V 10 . ? 38.095 73.357 95.800 1.00 37.01 ? 1773 HOH E O 1 +HETATM 23115 O O . HOH V 10 . ? 36.703 83.177 60.411 1.00 24.16 ? 1775 HOH E O 1 +HETATM 23116 O O . HOH V 10 . ? 65.929 94.831 89.114 1.00 33.49 ? 1783 HOH E O 1 +HETATM 23117 O O . HOH V 10 . ? 69.544 59.719 69.481 1.00 21.95 ? 1789 HOH E O 1 +HETATM 23118 O O . HOH V 10 . ? 85.616 81.698 85.253 1.00 34.28 ? 1803 HOH E O 1 +HETATM 23119 O O . HOH V 10 . ? 44.793 61.708 88.906 1.00 39.88 ? 1814 HOH E O 1 +HETATM 23120 O O . HOH V 10 . ? 31.489 78.459 64.671 1.00 38.48 ? 1824 HOH E O 1 +HETATM 23121 O O . HOH V 10 . ? 72.331 66.110 93.986 1.00 40.20 ? 1829 HOH E O 1 +HETATM 23122 O O . HOH V 10 . ? 98.017 87.675 93.164 1.00 23.62 ? 1831 HOH E O 1 +HETATM 23123 O O . HOH V 10 . ? 48.934 96.164 71.529 1.00 17.66 ? 1840 HOH E O 1 +HETATM 23124 O O . HOH V 10 . ? 98.084 81.569 75.083 1.00 22.39 ? 1846 HOH E O 1 +HETATM 23125 O O . HOH V 10 . ? 72.571 87.157 63.780 1.00 19.92 ? 1851 HOH E O 1 +HETATM 23126 O O . HOH V 10 . ? 96.394 87.023 63.196 1.00 17.57 ? 1858 HOH E O 1 +HETATM 23127 O O . HOH V 10 . ? 47.939 58.504 70.698 1.00 41.74 ? 1861 HOH E O 1 +HETATM 23128 O O . HOH V 10 . ? 49.565 92.539 62.701 1.00 29.23 ? 1862 HOH E O 1 +HETATM 23129 O O . HOH V 10 . ? 39.702 63.142 88.696 1.00 36.77 ? 1865 HOH E O 1 +HETATM 23130 O O . HOH V 10 . ? 46.189 90.836 70.948 1.00 21.87 ? 1870 HOH E O 1 +HETATM 23131 O O . HOH V 10 . ? 84.463 105.117 83.182 1.00 19.46 ? 1873 HOH E O 1 +HETATM 23132 O O . HOH V 10 . ? 47.614 83.800 42.131 1.00 41.33 ? 1874 HOH E O 1 +HETATM 23133 O O . HOH V 10 . ? 66.415 87.294 60.999 1.00 34.73 ? 1877 HOH E O 1 +HETATM 23134 O O . HOH V 10 . ? 95.948 93.533 86.999 1.00 29.32 ? 1880 HOH E O 1 +HETATM 23135 O O . HOH V 10 . ? 43.807 83.267 105.744 1.00 31.61 ? 1887 HOH E O 1 +HETATM 23136 O O . HOH V 10 . ? 92.709 83.571 51.760 1.00 49.25 ? 1888 HOH E O 1 +HETATM 23137 O O . HOH V 10 . ? 36.232 68.218 51.731 1.00 25.16 ? 1891 HOH E O 1 +HETATM 23138 O O . HOH V 10 . ? 61.816 107.758 86.488 1.00 33.31 ? 1902 HOH E O 1 +HETATM 23139 O O . HOH V 10 . ? 95.162 87.252 82.243 1.00 24.95 ? 1906 HOH E O 1 +HETATM 23140 O O . HOH V 10 . ? 92.767 74.035 75.398 1.00 36.04 ? 1910 HOH E O 1 +HETATM 23141 O O . HOH V 10 . ? 46.310 81.350 42.311 1.00 38.60 ? 1913 HOH E O 1 +HETATM 23142 O O . HOH V 10 . ? 98.817 91.544 71.374 1.00 39.20 ? 1916 HOH E O 1 +HETATM 23143 O O . HOH V 10 . ? 57.193 71.433 59.095 1.00 20.80 ? 1921 HOH E O 1 +HETATM 23144 O O . HOH V 10 . ? 64.069 61.872 105.670 1.00 22.42 ? 1923 HOH E O 1 +HETATM 23145 O O . HOH V 10 . ? 83.284 68.774 47.511 1.00 35.60 ? 1926 HOH E O 1 +HETATM 23146 O O . HOH V 10 . ? 45.379 72.881 40.892 1.00 33.28 ? 1930 HOH E O 1 +HETATM 23147 O O . HOH V 10 . ? 44.295 100.707 91.023 1.00 39.66 ? 1931 HOH E O 1 +HETATM 23148 O O . HOH V 10 . ? 57.822 98.857 68.060 1.00 23.61 ? 1936 HOH E O 1 +HETATM 23149 O O . HOH V 10 . ? 35.576 82.892 68.099 1.00 36.36 ? 1947 HOH E O 1 +HETATM 23150 O O . HOH V 10 . ? 70.264 64.179 70.180 1.00 16.69 ? 1953 HOH E O 1 +HETATM 23151 O O . HOH V 10 . ? 78.176 90.628 68.987 1.00 37.75 ? 1955 HOH E O 1 +HETATM 23152 O O . HOH V 10 . ? 54.443 83.262 40.465 1.00 40.33 ? 1958 HOH E O 1 +HETATM 23153 O O . HOH V 10 . ? 36.759 96.170 83.097 1.00 40.40 ? 1959 HOH E O 1 +HETATM 23154 O O . HOH V 10 . ? 92.227 86.177 82.269 1.00 22.16 ? 1960 HOH E O 1 +HETATM 23155 O O . HOH V 10 . ? 85.600 91.649 94.775 1.00 32.56 ? 1968 HOH E O 1 +HETATM 23156 O O . HOH V 10 . ? 65.387 68.909 35.970 1.00 42.99 ? 1975 HOH E O 1 +HETATM 23157 O O . HOH V 10 . ? 67.183 61.950 102.489 1.00 29.61 ? 1979 HOH E O 1 +HETATM 23158 O O . HOH V 10 . ? 86.383 61.904 66.557 1.00 26.33 ? 1982 HOH E O 1 +HETATM 23159 O O . HOH V 10 . ? 85.664 74.599 48.995 1.00 28.15 ? 1985 HOH E O 1 +HETATM 23160 O O . HOH V 10 . ? 34.279 81.729 91.509 1.00 35.08 ? 1986 HOH E O 1 +HETATM 23161 O O . HOH V 10 . ? 52.131 105.021 75.901 1.00 28.10 ? 1988 HOH E O 1 +HETATM 23162 O O . HOH V 10 . ? 31.951 75.685 50.079 1.00 38.83 ? 1991 HOH E O 1 +HETATM 23163 O O . HOH V 10 . ? 36.250 93.533 83.364 1.00 43.13 ? 1992 HOH E O 1 +HETATM 23164 O O . HOH V 10 . ? 82.107 96.264 74.761 1.00 39.08 ? 1998 HOH E O 1 +HETATM 23165 O O . HOH V 10 . ? 52.819 65.906 58.260 1.00 37.95 ? 2008 HOH E O 1 +HETATM 23166 O O . HOH V 10 . ? 34.290 57.480 73.695 1.00 36.43 ? 2020 HOH E O 1 +HETATM 23167 O O . HOH V 10 . ? 34.742 83.774 58.327 1.00 28.37 ? 2022 HOH E O 1 +HETATM 23168 O O . HOH V 10 . ? 52.046 66.066 103.678 1.00 21.95 ? 2025 HOH E O 1 +HETATM 23169 O O . HOH V 10 . ? 91.242 79.662 55.111 1.00 38.53 ? 2026 HOH E O 1 +HETATM 23170 O O . HOH V 10 . ? 77.199 96.063 87.741 1.00 26.65 ? 2029 HOH E O 1 +HETATM 23171 O O . HOH V 10 . ? 67.397 104.190 86.666 1.00 30.66 ? 2039 HOH E O 1 +HETATM 23172 O O . HOH V 10 . ? 96.960 95.327 96.643 1.00 52.88 ? 2040 HOH E O 1 +HETATM 23173 O O . HOH V 10 . ? 77.837 60.216 64.216 1.00 36.55 ? 2041 HOH E O 1 +HETATM 23174 O O . HOH V 10 . ? 52.220 90.771 82.701 1.00 10.09 ? 2045 HOH E O 1 +HETATM 23175 O O . HOH V 10 . ? 50.671 75.397 60.538 1.00 17.24 ? 2048 HOH E O 1 +HETATM 23176 O O . HOH V 10 . ? 71.114 62.835 80.705 1.00 10.31 ? 2056 HOH E O 1 +HETATM 23177 O O . HOH V 10 . ? 75.024 67.671 84.556 1.00 15.14 ? 2060 HOH E O 1 +HETATM 23178 O O . HOH V 10 . ? 48.352 75.599 62.154 1.00 14.55 ? 2063 HOH E O 1 +HETATM 23179 O O . HOH V 10 . ? 39.007 70.385 80.459 1.00 14.54 ? 2064 HOH E O 1 +HETATM 23180 O O . HOH V 10 . ? 85.121 99.322 79.302 1.00 13.22 ? 2066 HOH E O 1 +HETATM 23181 O O . HOH V 10 . ? 38.410 79.091 53.796 1.00 33.63 ? 2067 HOH E O 1 +HETATM 23182 O O . HOH V 10 . ? 72.828 84.263 60.370 1.00 20.32 ? 2069 HOH E O 1 +HETATM 23183 O O . HOH V 10 . ? 93.921 89.637 81.118 1.00 23.93 ? 2074 HOH E O 1 +HETATM 23184 O O . HOH V 10 . ? 59.247 87.218 61.823 1.00 18.87 ? 2084 HOH E O 1 +HETATM 23185 O O . HOH V 10 . ? 81.166 61.767 56.526 1.00 32.70 ? 2094 HOH E O 1 +HETATM 23186 O O . HOH V 10 . ? 84.705 73.193 86.985 1.00 25.19 ? 2095 HOH E O 1 +HETATM 23187 O O . HOH V 10 . ? 37.407 76.970 92.024 1.00 40.36 ? 2096 HOH E O 1 +HETATM 23188 O O . HOH V 10 . ? 68.647 81.103 46.721 1.00 23.05 ? 2105 HOH E O 1 +HETATM 23189 O O . HOH V 10 . ? 85.523 75.993 85.515 1.00 24.40 ? 2109 HOH E O 1 +HETATM 23190 O O . HOH V 10 . ? 62.894 88.101 102.250 1.00 27.49 ? 2115 HOH E O 1 +HETATM 23191 O O . HOH V 10 . ? 71.717 84.364 73.956 1.00 27.02 ? 2117 HOH E O 1 +HETATM 23192 O O . HOH V 10 . ? 87.932 84.418 58.442 1.00 32.58 ? 2118 HOH E O 1 +HETATM 23193 O O . HOH V 10 . ? 34.770 61.956 86.223 1.00 44.76 ? 2136 HOH E O 1 +HETATM 23194 O O . HOH V 10 . ? 43.499 53.671 56.473 1.00 32.53 ? 2137 HOH E O 1 +HETATM 23195 O O . HOH V 10 . ? 84.159 87.701 60.061 1.00 33.84 ? 2138 HOH E O 1 +HETATM 23196 O O . HOH V 10 . ? 74.782 60.883 58.372 1.00 37.99 ? 2141 HOH E O 1 +HETATM 23197 O O . HOH V 10 . ? 82.779 65.155 50.484 1.00 39.20 ? 2149 HOH E O 1 +HETATM 23198 O O . HOH V 10 . ? 89.534 93.991 92.569 1.00 28.80 ? 2154 HOH E O 1 +HETATM 23199 O O . HOH V 10 . ? 69.453 104.397 74.201 1.00 37.40 ? 2157 HOH E O 1 +HETATM 23200 O O . HOH V 10 . ? 73.035 75.406 44.391 1.00 41.14 ? 2163 HOH E O 1 +HETATM 23201 O O . HOH V 10 . ? 37.186 64.750 89.082 1.00 39.86 ? 2173 HOH E O 1 +HETATM 23202 O O . HOH V 10 . ? 80.827 63.494 59.105 1.00 29.24 ? 2175 HOH E O 1 +HETATM 23203 O O . HOH V 10 . ? 81.170 60.746 48.608 1.00 35.31 ? 2183 HOH E O 1 +HETATM 23204 O O . HOH V 10 . ? 76.126 88.948 62.281 1.00 37.38 ? 2186 HOH E O 1 +HETATM 23205 O O . HOH V 10 . ? 43.065 63.812 67.084 1.00 30.12 ? 2188 HOH E O 1 +HETATM 23206 O O . HOH V 10 . ? 39.198 63.139 86.077 1.00 41.26 ? 2189 HOH E O 1 +HETATM 23207 O O . HOH V 10 . ? 56.201 89.985 102.406 1.00 23.73 ? 2195 HOH E O 1 +HETATM 23208 O O . HOH V 10 . ? 68.110 71.999 73.149 1.00 22.81 ? 2196 HOH E O 1 +HETATM 23209 O O . HOH V 10 . ? 52.436 99.258 95.834 1.00 33.49 ? 2197 HOH E O 1 +HETATM 23210 O O . HOH V 10 . ? 58.024 84.910 59.152 1.00 25.73 ? 2199 HOH E O 1 +HETATM 23211 O O . HOH V 10 . ? 72.314 75.625 39.314 1.00 30.77 ? 2201 HOH E O 1 +HETATM 23212 O O . HOH V 10 . ? 66.509 104.054 83.947 1.00 27.08 ? 2211 HOH E O 1 +HETATM 23213 O O . HOH V 10 . ? 67.465 69.434 34.357 1.00 27.56 ? 2213 HOH E O 1 +HETATM 23214 O O . HOH V 10 . ? 81.463 76.585 43.006 1.00 29.37 ? 2215 HOH E O 1 +HETATM 23215 O O . HOH V 10 . ? 82.689 96.891 78.112 1.00 22.02 ? 2227 HOH E O 1 +HETATM 23216 O O . HOH V 10 . ? 84.476 69.798 50.591 1.00 25.09 ? 2230 HOH E O 1 +HETATM 23217 O O . HOH V 10 . ? 76.084 69.524 36.992 1.00 37.40 ? 2236 HOH E O 1 +HETATM 23218 O O . HOH V 10 . ? 64.466 78.413 32.175 1.00 35.98 ? 2243 HOH E O 1 +HETATM 23219 O O . HOH V 10 . ? 66.953 69.348 63.840 1.00 27.46 ? 2246 HOH E O 1 +HETATM 23220 O O . HOH V 10 . ? 76.668 78.142 43.891 1.00 59.76 ? 2249 HOH E O 1 +HETATM 23221 O O . HOH V 10 . ? 51.921 64.188 55.693 1.00 46.66 ? 2250 HOH E O 1 +HETATM 23222 O O . HOH V 10 . ? 43.675 92.969 100.341 1.00 34.37 ? 2252 HOH E O 1 +HETATM 23223 O O . HOH V 10 . ? 99.204 93.490 78.101 1.00 37.73 ? 2254 HOH E O 1 +HETATM 23224 O O . HOH V 10 . ? 45.341 95.855 73.068 1.00 44.97 ? 2255 HOH E O 1 +HETATM 23225 O O . HOH V 10 . ? 46.086 93.228 69.613 1.00 29.61 ? 2257 HOH E O 1 +HETATM 23226 O O . HOH V 10 . ? 56.189 78.861 35.164 1.00 35.69 ? 2261 HOH E O 1 +HETATM 23227 O O . HOH V 10 . ? 38.590 79.474 49.505 1.00 27.95 ? 2265 HOH E O 1 +HETATM 23228 O O . HOH V 10 . ? 65.441 68.930 53.704 1.00 20.79 ? 2273 HOH E O 1 +HETATM 23229 O O . HOH V 10 . ? 86.034 95.503 88.873 1.00 39.06 ? 2275 HOH E O 1 +HETATM 23230 O O . HOH V 10 . ? 90.153 70.226 55.039 1.00 25.29 ? 2282 HOH E O 1 +HETATM 23231 O O . HOH V 10 . ? 82.228 68.745 38.912 1.00 35.05 ? 2287 HOH E O 1 +HETATM 23232 O O . HOH V 10 . ? 55.860 83.210 37.938 1.00 34.07 ? 2291 HOH E O 1 +HETATM 23233 O O . HOH V 10 . ? 83.420 98.413 88.181 1.00 37.47 ? 2297 HOH E O 1 +HETATM 23234 O O . HOH V 10 . ? 76.251 100.588 85.856 1.00 35.17 ? 2301 HOH E O 1 +HETATM 23235 O O . HOH V 10 . ? 49.860 103.836 87.021 1.00 26.69 ? 2302 HOH E O 1 +HETATM 23236 O O . HOH V 10 . ? 43.137 60.206 90.094 1.00 40.44 ? 2304 HOH E O 1 +HETATM 23237 O O . HOH V 10 . ? 53.618 102.763 81.469 1.00 24.86 ? 2313 HOH E O 1 +HETATM 23238 O O . HOH V 10 . ? 53.779 103.072 91.858 1.00 53.42 ? 2314 HOH E O 1 +HETATM 23239 O O . HOH V 10 . ? 71.485 64.002 95.154 1.00 30.70 ? 2324 HOH E O 1 +HETATM 23240 O O . HOH V 10 . ? 64.170 87.056 89.919 1.00 36.58 ? 2328 HOH E O 1 +HETATM 23241 O O . HOH V 10 . ? 35.602 79.495 95.219 1.00 39.60 ? 2330 HOH E O 1 +HETATM 23242 O O . HOH V 10 . ? 47.502 95.324 74.366 1.00 30.71 ? 2335 HOH E O 1 +HETATM 23243 O O . HOH V 10 . ? 56.680 68.555 60.265 1.00 33.52 ? 2336 HOH E O 1 +HETATM 23244 O O . HOH V 10 . ? 82.692 67.996 50.033 1.00 28.57 ? 2338 HOH E O 1 +HETATM 23245 O O . HOH V 10 . ? 42.900 94.006 102.948 1.00 32.61 ? 2339 HOH E O 1 +HETATM 23246 O O . HOH V 10 . ? 87.753 63.168 54.979 1.00 47.20 ? 2344 HOH E O 1 +HETATM 23247 O O . HOH V 10 . ? 54.342 101.103 94.181 1.00 38.27 ? 2345 HOH E O 1 +HETATM 23248 O O . HOH V 10 . ? 69.700 64.315 100.258 1.00 35.70 ? 2347 HOH E O 1 +HETATM 23249 O O . HOH V 10 . ? 92.695 93.223 84.100 1.00 18.42 ? 2349 HOH E O 1 +HETATM 23250 O O . HOH V 10 . ? 84.105 68.326 41.543 1.00 37.29 ? 2358 HOH E O 1 +HETATM 23251 O O . HOH V 10 . ? 61.263 103.277 89.205 1.00 46.19 ? 2359 HOH E O 1 +HETATM 23252 O O . HOH V 10 . ? 37.882 72.260 82.924 1.00 27.84 ? 2360 HOH E O 1 +HETATM 23253 O O . HOH V 10 . ? 45.763 64.585 63.231 1.00 26.21 ? 2361 HOH E O 1 +HETATM 23254 O O . HOH V 10 . ? 59.210 80.562 109.856 1.00 39.44 ? 2368 HOH E O 1 +HETATM 23255 O O . HOH V 10 . ? 93.543 84.478 85.953 1.00 25.40 ? 2369 HOH E O 1 +HETATM 23256 O O . HOH V 10 . ? 36.120 85.362 94.851 1.00 37.02 ? 2372 HOH E O 1 +HETATM 23257 O O . HOH V 10 . ? 55.770 103.854 78.160 1.00 31.68 ? 2375 HOH E O 1 +HETATM 23258 O O . HOH V 10 . ? 70.438 62.967 65.260 1.00 38.73 ? 2381 HOH E O 1 +HETATM 23259 O O . HOH V 10 . ? 36.631 58.307 73.307 1.00 39.98 ? 2383 HOH E O 1 +HETATM 23260 O O . HOH V 10 . ? 84.651 96.487 86.834 1.00 38.03 ? 2385 HOH E O 1 +HETATM 23261 O O . HOH V 10 . ? 66.212 84.548 42.907 1.00 48.46 ? 2388 HOH E O 1 +HETATM 23262 O O . HOH V 10 . ? 37.426 99.622 91.016 1.00 47.15 ? 2393 HOH E O 1 +HETATM 23263 O O . HOH V 10 . ? 86.192 83.645 83.293 1.00 32.00 ? 2396 HOH E O 1 +HETATM 23264 O O . HOH V 10 . ? 41.140 54.071 58.911 1.00 38.98 ? 2397 HOH E O 1 +HETATM 23265 O O . HOH V 10 . ? 51.393 93.639 60.993 1.00 37.79 ? 2400 HOH E O 1 +HETATM 23266 O O . HOH V 10 . ? 57.473 104.188 80.650 1.00 29.03 ? 2403 HOH E O 1 +HETATM 23267 O O . HOH V 10 . ? 35.234 79.098 98.577 1.00 38.79 ? 2404 HOH E O 1 +HETATM 23268 O O . HOH V 10 . ? 46.267 58.153 60.288 1.00 45.27 ? 2405 HOH E O 1 +HETATM 23269 O O . HOH V 10 . ? 40.048 79.103 100.676 1.00 29.91 ? 2406 HOH E O 1 +HETATM 23270 O O . HOH V 10 . ? 71.119 96.757 68.177 1.00 31.85 ? 2408 HOH E O 1 +HETATM 23271 O O . HOH V 10 . ? 36.140 70.298 65.697 1.00 30.45 ? 2411 HOH E O 1 +HETATM 23272 O O . HOH V 10 . ? 64.144 93.070 88.388 1.00 27.48 ? 2412 HOH E O 1 +HETATM 23273 O O . HOH V 10 . ? 41.724 82.054 47.710 1.00 24.74 ? 2413 HOH E O 1 +HETATM 23274 O O . HOH V 10 . ? 59.589 90.418 105.571 1.00 34.20 ? 2417 HOH E O 1 +HETATM 23275 O O . HOH V 10 . ? 40.266 92.452 74.583 1.00 36.57 ? 2418 HOH E O 1 +HETATM 23276 O O . HOH V 10 . ? 91.431 67.350 90.162 1.00 34.48 ? 2419 HOH E O 1 +HETATM 23277 O O . HOH V 10 . ? 33.313 77.268 48.348 1.00 40.78 ? 2423 HOH E O 1 +HETATM 23278 O O . HOH V 10 . ? 43.497 92.346 77.088 1.00 29.55 ? 2424 HOH E O 1 +HETATM 23279 O O . HOH V 10 . ? 53.363 101.641 69.012 1.00 46.36 ? 2426 HOH E O 1 +HETATM 23280 O O . HOH V 10 . ? 30.664 76.955 56.476 1.00 29.03 ? 2429 HOH E O 1 +HETATM 23281 O O . HOH V 10 . ? 67.634 69.319 44.121 1.00 37.70 ? 2434 HOH E O 1 +HETATM 23282 O O . HOH V 10 . ? 35.208 75.212 46.911 1.00 37.91 ? 2438 HOH E O 1 +HETATM 23283 O O . HOH V 10 . ? 33.559 75.507 44.508 1.00 29.59 ? 2439 HOH E O 1 +HETATM 23284 O O . HOH V 10 . ? 41.711 68.255 68.148 1.00 11.68 ? 2441 HOH E O 1 +HETATM 23285 O O . HOH V 10 . ? 85.571 95.180 84.659 1.00 11.02 ? 2454 HOH E O 1 +HETATM 23286 O O . HOH V 10 . ? 46.231 80.545 63.221 1.00 12.13 ? 2457 HOH E O 1 +HETATM 23287 O O . HOH V 10 . ? 56.982 65.149 66.883 1.00 14.35 ? 2460 HOH E O 1 +HETATM 23288 O O . HOH V 10 . ? 39.615 78.367 98.236 1.00 14.15 ? 2461 HOH E O 1 +HETATM 23289 O O . HOH V 10 . ? 52.112 93.813 93.614 1.00 18.29 ? 2463 HOH E O 1 +HETATM 23290 O O . HOH V 10 . ? 65.584 83.794 86.120 1.00 12.09 ? 2465 HOH E O 1 +HETATM 23291 O O . HOH V 10 . ? 57.985 87.471 92.904 1.00 18.78 ? 2470 HOH E O 1 +HETATM 23292 O O . HOH V 10 . ? 41.369 71.587 80.675 1.00 18.67 ? 2471 HOH E O 1 +HETATM 23293 O O . HOH V 10 . ? 73.777 85.944 73.684 1.00 23.18 ? 2473 HOH E O 1 +HETATM 23294 O O . HOH V 10 . ? 48.125 81.434 64.903 1.00 22.83 ? 2475 HOH E O 1 +HETATM 23295 O O . HOH V 10 . ? 57.827 86.526 95.266 1.00 18.82 ? 2477 HOH E O 1 +HETATM 23296 O O . HOH V 10 . ? 64.626 86.085 99.780 1.00 27.17 ? 2480 HOH E O 1 +HETATM 23297 O O . HOH V 10 . ? 44.346 82.425 63.577 1.00 29.06 ? 2482 HOH E O 1 +HETATM 23298 O O . HOH V 10 . ? 61.355 84.564 51.725 1.00 24.56 ? 2485 HOH E O 1 +HETATM 23299 O O . HOH V 10 . ? 89.120 70.585 77.309 1.00 27.89 ? 2487 HOH E O 1 +HETATM 23300 O O . HOH V 10 . ? 64.835 65.176 106.653 1.00 19.69 ? 2489 HOH E O 1 +HETATM 23301 O O . HOH V 10 . ? 68.533 84.617 100.913 1.00 20.31 ? 2490 HOH E O 1 +HETATM 23302 O O . HOH V 10 . ? 35.456 75.599 77.746 1.00 21.63 ? 2491 HOH E O 1 +HETATM 23303 O O . HOH V 10 . ? 70.943 66.214 44.752 1.00 33.20 ? 2501 HOH E O 1 +HETATM 23304 O O . HOH V 10 . ? 50.424 86.460 59.730 1.00 17.94 ? 2508 HOH E O 1 +HETATM 23305 O O . HOH V 10 . ? 87.132 96.623 69.790 1.00 25.09 ? 2518 HOH E O 1 +HETATM 23306 O O . HOH V 10 . ? 59.443 65.720 67.921 1.00 30.32 ? 2519 HOH E O 1 +HETATM 23307 O O . HOH V 10 . ? 97.293 87.877 82.710 1.00 46.28 ? 2527 HOH E O 1 +HETATM 23308 O O . HOH V 10 . ? 76.941 84.296 85.866 1.00 20.31 ? 2529 HOH E O 1 +HETATM 23309 O O . HOH V 10 . ? 77.337 66.489 34.551 1.00 31.85 ? 2533 HOH E O 1 +HETATM 23310 O O . HOH V 10 . ? 90.058 93.364 69.204 1.00 32.83 ? 2534 HOH E O 1 +HETATM 23311 O O . HOH V 10 . ? 39.538 84.130 64.409 1.00 29.04 ? 2535 HOH E O 1 +HETATM 23312 O O . HOH V 10 . ? 63.884 86.795 61.056 1.00 27.72 ? 2537 HOH E O 1 +HETATM 23313 O O . HOH V 10 . ? 38.371 72.556 43.802 1.00 48.20 ? 2539 HOH E O 1 +HETATM 23314 O O . HOH V 10 . ? 47.171 87.010 52.552 1.00 44.57 ? 2562 HOH E O 1 +HETATM 23315 O O . HOH V 10 . ? 47.969 60.863 94.362 1.00 29.23 ? 2564 HOH E O 1 +HETATM 23316 O O . HOH V 10 . ? 80.270 84.048 87.687 1.00 15.67 ? 2575 HOH E O 1 +HETATM 23317 O O . HOH V 10 . ? 86.801 87.287 66.135 1.00 32.51 ? 2582 HOH E O 1 +HETATM 23318 O O . HOH V 10 . ? 39.505 85.824 98.460 1.00 29.86 ? 2589 HOH E O 1 +HETATM 23319 O O . HOH V 10 . ? 36.838 85.161 97.458 1.00 30.31 ? 2590 HOH E O 1 +HETATM 23320 O O . HOH V 10 . ? 33.818 87.146 95.508 1.00 39.04 ? 2591 HOH E O 1 +HETATM 23321 O O . HOH V 10 . ? 65.885 66.678 108.973 1.00 27.82 ? 2592 HOH E O 1 +HETATM 23322 O O . HOH V 10 . ? 38.548 79.666 81.958 1.00 48.49 ? 2596 HOH E O 1 +HETATM 23323 O O . HOH V 10 . ? 82.575 89.137 91.800 1.00 38.50 ? 2600 HOH E O 1 +HETATM 23324 O O . HOH V 10 . ? 83.268 91.270 93.780 1.00 30.97 ? 2601 HOH E O 1 +HETATM 23325 O O . HOH V 10 . ? 84.561 94.405 94.227 1.00 32.99 ? 2602 HOH E O 1 +HETATM 23326 O O . HOH V 10 . ? 76.268 99.452 79.423 1.00 26.15 ? 2607 HOH E O 1 +HETATM 23327 O O . HOH V 10 . ? 74.150 100.402 77.973 1.00 32.93 ? 2608 HOH E O 1 +HETATM 23328 O O . HOH V 10 . ? 82.719 91.139 70.959 1.00 42.59 ? 2610 HOH E O 1 +HETATM 23329 O O . HOH V 10 . ? 36.311 85.037 56.432 1.00 24.43 ? 2614 HOH E O 1 +HETATM 23330 O O . HOH V 10 . ? 37.456 76.229 45.883 1.00 39.06 ? 2617 HOH E O 1 +HETATM 23331 O O . HOH V 10 . ? 33.851 73.343 42.565 1.00 42.34 ? 2618 HOH E O 1 +HETATM 23332 O O . HOH V 10 . ? 38.947 62.680 65.357 1.00 33.71 ? 2620 HOH E O 1 +HETATM 23333 O O . HOH V 10 . ? 43.061 83.724 46.145 1.00 34.56 ? 2621 HOH E O 1 +HETATM 23334 O O . HOH V 10 . ? 92.687 62.678 68.156 1.00 28.91 ? 2624 HOH E O 1 +HETATM 23335 O O . HOH V 10 . ? 93.600 63.900 65.922 1.00 40.60 ? 2625 HOH E O 1 +HETATM 23336 O O . HOH V 10 . ? 98.960 76.479 67.550 1.00 26.43 ? 2629 HOH E O 1 +HETATM 23337 O O . HOH V 10 . ? 99.098 77.538 65.215 1.00 30.72 ? 2630 HOH E O 1 +HETATM 23338 O O . HOH V 10 . ? 67.006 65.506 60.933 1.00 35.44 ? 2635 HOH E O 1 +HETATM 23339 O O . HOH V 10 . ? 65.144 66.274 59.299 1.00 37.28 ? 2636 HOH E O 1 +HETATM 23340 O O . HOH V 10 . ? 99.298 87.721 78.797 1.00 41.33 ? 2640 HOH E O 1 +HETATM 23341 O O . HOH V 10 . ? 46.720 60.118 66.616 1.00 27.60 ? 2643 HOH E O 1 +HETATM 23342 O O . HOH V 10 . ? 48.532 58.932 59.093 1.00 54.25 ? 2644 HOH E O 1 +HETATM 23343 O O . HOH V 10 . ? 69.091 85.580 61.539 1.00 24.24 ? 2651 HOH E O 1 +HETATM 23344 O O . HOH V 10 . ? 72.803 87.903 59.741 1.00 29.96 ? 2652 HOH E O 1 +HETATM 23345 O O . HOH V 10 . ? 27.792 81.701 62.480 1.00 37.81 ? 2661 HOH E O 1 +HETATM 23346 O O . HOH V 10 . ? 79.111 97.121 89.285 1.00 37.90 ? 2664 HOH E O 1 +HETATM 23347 O O . HOH V 10 . ? 67.665 88.931 101.123 1.00 32.06 ? 2666 HOH E O 1 +HETATM 23348 O O . HOH V 10 . ? 68.899 89.640 99.123 1.00 37.55 ? 2667 HOH E O 1 +HETATM 23349 O O . HOH V 10 . ? 89.270 66.533 79.214 1.00 25.24 ? 2668 HOH E O 1 +HETATM 23350 O O . HOH V 10 . ? 98.480 67.558 69.717 1.00 25.86 ? 2679 HOH E O 1 +HETATM 23351 O O . HOH V 10 . ? 98.177 65.922 73.541 1.00 31.52 ? 2680 HOH E O 1 +HETATM 23352 O O . HOH V 10 . ? 53.239 77.993 109.267 1.00 28.06 ? 2681 HOH E O 1 +HETATM 23353 O O . HOH V 10 . ? 41.745 79.214 46.928 1.00 32.43 ? 2683 HOH E O 1 +HETATM 23354 O O . HOH V 10 . ? 85.026 59.867 65.751 1.00 33.27 ? 2684 HOH E O 1 +HETATM 23355 O O . HOH V 10 . ? 100.527 82.254 69.571 1.00 32.62 ? 2688 HOH E O 1 +HETATM 23356 O O . HOH V 10 . ? 59.344 101.470 91.829 1.00 33.18 ? 2693 HOH E O 1 +HETATM 23357 O O . HOH V 10 . ? 48.760 62.761 60.101 1.00 40.72 ? 2694 HOH E O 1 +HETATM 23358 O O . HOH V 10 . ? 60.264 88.913 59.940 1.00 40.85 ? 2695 HOH E O 1 +HETATM 23359 O O . HOH V 10 . ? 83.486 61.099 57.330 1.00 44.50 ? 2697 HOH E O 1 +HETATM 23360 O O . HOH V 10 . ? 93.059 83.327 49.016 1.00 30.52 ? 2700 HOH E O 1 +HETATM 23361 O O . HOH V 10 . ? 89.872 78.715 49.353 1.00 36.77 ? 2701 HOH E O 1 +HETATM 23362 O O . HOH V 10 . ? 78.896 98.195 77.698 1.00 23.50 ? 2702 HOH E O 1 +HETATM 23363 O O . HOH V 10 . ? 35.298 90.838 89.399 1.00 42.55 ? 2704 HOH E O 1 +HETATM 23364 O O . HOH V 10 . ? 74.059 93.129 68.942 1.00 37.41 ? 2705 HOH E O 1 +HETATM 23365 O O . HOH V 10 . ? 70.923 91.521 66.115 1.00 31.78 ? 2706 HOH E O 1 +HETATM 23366 O O . HOH V 10 . ? 37.834 73.564 46.062 1.00 42.01 ? 2709 HOH E O 1 +HETATM 23367 O O . HOH V 10 . ? 67.343 67.374 46.470 1.00 34.18 ? 2715 HOH E O 1 +HETATM 23368 O O . HOH V 10 . ? 58.864 86.007 43.659 1.00 43.47 ? 2721 HOH E O 1 +HETATM 23369 O O . HOH V 10 . ? 46.819 60.022 62.812 1.00 38.46 ? 2723 HOH E O 1 +HETATM 23370 O O . HOH V 10 . ? 33.596 73.819 64.319 1.00 30.91 ? 2727 HOH E O 1 +HETATM 23371 O O . HOH V 10 . ? 73.203 99.410 87.964 1.00 30.49 ? 2728 HOH E O 1 +HETATM 23372 O O . HOH V 10 . ? 92.803 80.541 80.957 1.00 35.09 ? 2730 HOH E O 1 +HETATM 23373 O O . HOH V 10 . ? 39.742 76.456 102.911 1.00 35.90 ? 2731 HOH E O 1 +HETATM 23374 O O . HOH V 10 . ? 38.913 74.160 102.027 1.00 41.90 ? 2732 HOH E O 1 +HETATM 23375 O O . HOH V 10 . ? 48.486 93.035 64.940 1.00 34.13 ? 2742 HOH E O 1 +HETATM 23376 O O . HOH V 10 . ? 98.898 85.648 89.064 1.00 27.65 ? 2744 HOH E O 1 +HETATM 23377 O O . HOH V 10 . ? 95.010 77.052 54.753 1.00 34.47 ? 2746 HOH E O 1 +HETATM 23378 O O . HOH V 10 . ? 103.784 83.632 67.040 1.00 37.35 ? 2747 HOH E O 1 +HETATM 23379 O O . HOH V 10 . ? 69.930 100.668 65.231 1.00 39.81 ? 2753 HOH E O 1 +HETATM 23380 O O . HOH V 10 . ? 44.901 88.045 67.409 1.00 35.23 ? 2755 HOH E O 1 +HETATM 23381 O O . HOH V 10 . ? 76.419 61.920 61.028 1.00 37.53 ? 2757 HOH E O 1 +HETATM 23382 O O . HOH V 10 . ? 66.163 99.021 89.802 1.00 30.08 ? 2758 HOH E O 1 +HETATM 23383 O O . HOH V 10 . ? 33.820 95.936 81.442 1.00 36.74 ? 2768 HOH E O 1 +HETATM 23384 O O . HOH V 10 . ? 51.666 96.746 97.234 1.00 33.97 ? 2772 HOH E O 1 +HETATM 23385 O O . HOH V 10 . ? 80.960 86.538 57.298 1.00 44.22 ? 2774 HOH E O 1 +HETATM 23386 O O . HOH V 10 . ? 66.099 103.973 73.247 1.00 40.52 ? 2775 HOH E O 1 +HETATM 23387 O O . HOH V 10 . ? 58.486 90.952 103.219 1.00 37.95 ? 2786 HOH E O 1 +HETATM 23388 O O . HOH V 10 . ? 63.643 66.710 109.199 1.00 18.93 ? 2788 HOH E O 1 +HETATM 23389 O O . HOH V 10 . ? 79.124 80.669 49.907 1.00 57.67 ? 2803 HOH E O 1 +HETATM 23390 O O . HOH V 10 . ? 59.472 66.747 63.745 1.00 27.12 ? 2805 HOH E O 1 +# diff --git a/tests/resources/4kw4.cif b/tests/resources/4kw4.cif new file mode 100644 index 0000000..8d5299f --- /dev/null +++ b/tests/resources/4kw4.cif @@ -0,0 +1,8657 @@ +data_4KW4 +# +_entry.id 4KW4 +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.397 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 4KW4 pdb_00004kw4 10.2210/pdb4kw4/pdb +RCSB RCSB079868 ? ? +WWPDB D_1000079868 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2014-04-09 +2 'Structure model' 1 1 2022-12-21 +3 'Structure model' 1 2 2024-10-16 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Database references' +2 2 'Structure model' 'Derived calculations' +3 3 'Structure model' 'Data collection' +4 3 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 2 'Structure model' database_2 +2 2 'Structure model' struct_conn +3 2 'Structure model' struct_ref_seq_dif +4 3 'Structure model' chem_comp_atom +5 3 'Structure model' chem_comp_bond +6 3 'Structure model' pdbx_entry_details +7 3 'Structure model' pdbx_modification_feature +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 2 'Structure model' '_database_2.pdbx_DOI' +2 2 'Structure model' '_database_2.pdbx_database_accession' +3 2 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +4 2 'Structure model' '_struct_ref_seq_dif.details' +5 3 'Structure model' '_pdbx_entry_details.has_protein_modification' +# +_pdbx_database_status.entry_id 4KW4 +_pdbx_database_status.status_code REL +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.recvd_initial_deposition_date 2013-05-23 +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.SG_entry ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_pdbx_database_related.db_name +_pdbx_database_related.db_id +_pdbx_database_related.details +_pdbx_database_related.content_type +PDB 4KW8 . unspecified +PDB 4KW9 . unspecified +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Barnard, T.J.' 1 +'Yu, X.' 2 +'Noinaj, N.' 3 +'Taraska, J.W.' 4 +# +_citation.id primary +_citation.title 'Crystal Structure of Green Fluorescent Protein' +_citation.journal_abbrev 'To be Published' +_citation.journal_volume ? +_citation.page_first ? +_citation.page_last ? +_citation.year ? +_citation.journal_id_ASTM ? +_citation.country ? +_citation.journal_id_ISSN ? +_citation.journal_id_CSD 0353 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed ? +_citation.pdbx_database_id_DOI ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Barnard, T.J.' 1 ? +primary 'Yu, X.' 2 ? +primary 'Noinaj, N.' 3 ? +primary 'Taraska, J.W.' 4 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Green fluorescent protein' 27227.764 1 ? 'S147H, S202H, Q204H, A206K' ? +'The protein in this structure is a version of GFP called Emerald GFP' +2 water nat water 18.015 303 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer yes +_entity_poly.pdbx_seq_one_letter_code +;GSMVSKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTL(CRO)VQCFARYP +DHMKQHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNHHKVYITAD +KQKNGIKVNFKTRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLHTHSKLSKDPNEKRDHMVLLEFVTAAGITLGMDE +LYK +; +_entity_poly.pdbx_seq_one_letter_code_can +;GSMVSKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTLTYGVQCFARYPDH +MKQHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNHHKVYITADKQ +KNGIKVNFKTRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLHTHSKLSKDPNEKRDHMVLLEFVTAAGITLGMDELY +K +; +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier ? +# +_pdbx_entity_nonpoly.entity_id 2 +_pdbx_entity_nonpoly.name water +_pdbx_entity_nonpoly.comp_id HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 GLY n +1 2 SER n +1 3 MET n +1 4 VAL n +1 5 SER n +1 6 LYS n +1 7 GLY n +1 8 GLU n +1 9 GLU n +1 10 LEU n +1 11 PHE n +1 12 THR n +1 13 GLY n +1 14 VAL n +1 15 VAL n +1 16 PRO n +1 17 ILE n +1 18 LEU n +1 19 VAL n +1 20 GLU n +1 21 LEU n +1 22 ASP n +1 23 GLY n +1 24 ASP n +1 25 VAL n +1 26 ASN n +1 27 GLY n +1 28 HIS n +1 29 LYS n +1 30 PHE n +1 31 SER n +1 32 VAL n +1 33 SER n +1 34 GLY n +1 35 GLU n +1 36 GLY n +1 37 GLU n +1 38 GLY n +1 39 ASP n +1 40 ALA n +1 41 THR n +1 42 TYR n +1 43 GLY n +1 44 LYS n +1 45 LEU n +1 46 THR n +1 47 LEU n +1 48 LYS n +1 49 PHE n +1 50 ILE n +1 51 CYS n +1 52 THR n +1 53 THR n +1 54 GLY n +1 55 LYS n +1 56 LEU n +1 57 PRO n +1 58 VAL n +1 59 PRO n +1 60 TRP n +1 61 PRO n +1 62 THR n +1 63 LEU n +1 64 VAL n +1 65 THR n +1 66 THR n +1 67 LEU n +1 68 CRO n +1 69 VAL n +1 70 GLN n +1 71 CYS n +1 72 PHE n +1 73 ALA n +1 74 ARG n +1 75 TYR n +1 76 PRO n +1 77 ASP n +1 78 HIS n +1 79 MET n +1 80 LYS n +1 81 GLN n +1 82 HIS n +1 83 ASP n +1 84 PHE n +1 85 PHE n +1 86 LYS n +1 87 SER n +1 88 ALA n +1 89 MET n +1 90 PRO n +1 91 GLU n +1 92 GLY n +1 93 TYR n +1 94 VAL n +1 95 GLN n +1 96 GLU n +1 97 ARG n +1 98 THR n +1 99 ILE n +1 100 PHE n +1 101 PHE n +1 102 LYS n +1 103 ASP n +1 104 ASP n +1 105 GLY n +1 106 ASN n +1 107 TYR n +1 108 LYS n +1 109 THR n +1 110 ARG n +1 111 ALA n +1 112 GLU n +1 113 VAL n +1 114 LYS n +1 115 PHE n +1 116 GLU n +1 117 GLY n +1 118 ASP n +1 119 THR n +1 120 LEU n +1 121 VAL n +1 122 ASN n +1 123 ARG n +1 124 ILE n +1 125 GLU n +1 126 LEU n +1 127 LYS n +1 128 GLY n +1 129 ILE n +1 130 ASP n +1 131 PHE n +1 132 LYS n +1 133 GLU n +1 134 ASP n +1 135 GLY n +1 136 ASN n +1 137 ILE n +1 138 LEU n +1 139 GLY n +1 140 HIS n +1 141 LYS n +1 142 LEU n +1 143 GLU n +1 144 TYR n +1 145 ASN n +1 146 TYR n +1 147 ASN n +1 148 HIS n +1 149 HIS n +1 150 LYS n +1 151 VAL n +1 152 TYR n +1 153 ILE n +1 154 THR n +1 155 ALA n +1 156 ASP n +1 157 LYS n +1 158 GLN n +1 159 LYS n +1 160 ASN n +1 161 GLY n +1 162 ILE n +1 163 LYS n +1 164 VAL n +1 165 ASN n +1 166 PHE n +1 167 LYS n +1 168 THR n +1 169 ARG n +1 170 HIS n +1 171 ASN n +1 172 ILE n +1 173 GLU n +1 174 ASP n +1 175 GLY n +1 176 SER n +1 177 VAL n +1 178 GLN n +1 179 LEU n +1 180 ALA n +1 181 ASP n +1 182 HIS n +1 183 TYR n +1 184 GLN n +1 185 GLN n +1 186 ASN n +1 187 THR n +1 188 PRO n +1 189 ILE n +1 190 GLY n +1 191 ASP n +1 192 GLY n +1 193 PRO n +1 194 VAL n +1 195 LEU n +1 196 LEU n +1 197 PRO n +1 198 ASP n +1 199 ASN n +1 200 HIS n +1 201 TYR n +1 202 LEU n +1 203 HIS n +1 204 THR n +1 205 HIS n +1 206 SER n +1 207 LYS n +1 208 LEU n +1 209 SER n +1 210 LYS n +1 211 ASP n +1 212 PRO n +1 213 ASN n +1 214 GLU n +1 215 LYS n +1 216 ARG n +1 217 ASP n +1 218 HIS n +1 219 MET n +1 220 VAL n +1 221 LEU n +1 222 LEU n +1 223 GLU n +1 224 PHE n +1 225 VAL n +1 226 THR n +1 227 ALA n +1 228 ALA n +1 229 GLY n +1 230 ILE n +1 231 THR n +1 232 LEU n +1 233 GLY n +1 234 MET n +1 235 ASP n +1 236 GLU n +1 237 LEU n +1 238 TYR n +1 239 LYS n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name Jellyfish +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene GFP +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Aequorea victoria' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 6100 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 469008 +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain 'BL21(DE3)' +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type ? +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name ? +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CRO 'L-peptide linking' n +'{2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid' +'PEPTIDE DERIVED CHROMOPHORE' 'C15 H17 N3 O5' 319.313 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 GLY 1 -2 ? ? ? A . n +A 1 2 SER 2 -1 ? ? ? A . n +A 1 3 MET 3 0 ? ? ? A . n +A 1 4 VAL 4 1 ? ? ? A . n +A 1 5 SER 5 2 2 SER SER A . n +A 1 6 LYS 6 3 3 LYS LYS A . n +A 1 7 GLY 7 4 4 GLY GLY A . n +A 1 8 GLU 8 5 5 GLU GLU A . n +A 1 9 GLU 9 6 6 GLU GLU A . n +A 1 10 LEU 10 7 7 LEU LEU A . n +A 1 11 PHE 11 8 8 PHE PHE A . n +A 1 12 THR 12 9 9 THR THR A . n +A 1 13 GLY 13 10 10 GLY GLY A . n +A 1 14 VAL 14 11 11 VAL VAL A . n +A 1 15 VAL 15 12 12 VAL VAL A . n +A 1 16 PRO 16 13 13 PRO PRO A . n +A 1 17 ILE 17 14 14 ILE ILE A . n +A 1 18 LEU 18 15 15 LEU LEU A . n +A 1 19 VAL 19 16 16 VAL VAL A . n +A 1 20 GLU 20 17 17 GLU GLU A . n +A 1 21 LEU 21 18 18 LEU LEU A . n +A 1 22 ASP 22 19 19 ASP ASP A . n +A 1 23 GLY 23 20 20 GLY GLY A . n +A 1 24 ASP 24 21 21 ASP ASP A . n +A 1 25 VAL 25 22 22 VAL VAL A . n +A 1 26 ASN 26 23 23 ASN ASN A . n +A 1 27 GLY 27 24 24 GLY GLY A . n +A 1 28 HIS 28 25 25 HIS HIS A . n +A 1 29 LYS 29 26 26 LYS LYS A . n +A 1 30 PHE 30 27 27 PHE PHE A . n +A 1 31 SER 31 28 28 SER SER A . n +A 1 32 VAL 32 29 29 VAL VAL A . n +A 1 33 SER 33 30 30 SER SER A . n +A 1 34 GLY 34 31 31 GLY GLY A . n +A 1 35 GLU 35 32 32 GLU GLU A . n +A 1 36 GLY 36 33 33 GLY GLY A . n +A 1 37 GLU 37 34 34 GLU GLU A . n +A 1 38 GLY 38 35 35 GLY GLY A . n +A 1 39 ASP 39 36 36 ASP ASP A . n +A 1 40 ALA 40 37 37 ALA ALA A . n +A 1 41 THR 41 38 38 THR THR A . n +A 1 42 TYR 42 39 39 TYR TYR A . n +A 1 43 GLY 43 40 40 GLY GLY A . n +A 1 44 LYS 44 41 41 LYS LYS A . n +A 1 45 LEU 45 42 42 LEU LEU A . n +A 1 46 THR 46 43 43 THR THR A . n +A 1 47 LEU 47 44 44 LEU LEU A . n +A 1 48 LYS 48 45 45 LYS LYS A . n +A 1 49 PHE 49 46 46 PHE PHE A . n +A 1 50 ILE 50 47 47 ILE ILE A . n +A 1 51 CYS 51 48 48 CYS CYS A . n +A 1 52 THR 52 49 49 THR THR A . n +A 1 53 THR 53 50 50 THR THR A . n +A 1 54 GLY 54 51 51 GLY GLY A . n +A 1 55 LYS 55 52 52 LYS LYS A . n +A 1 56 LEU 56 53 53 LEU LEU A . n +A 1 57 PRO 57 54 54 PRO PRO A . n +A 1 58 VAL 58 55 55 VAL VAL A . n +A 1 59 PRO 59 56 56 PRO PRO A . n +A 1 60 TRP 60 57 57 TRP TRP A . n +A 1 61 PRO 61 58 58 PRO PRO A . n +A 1 62 THR 62 59 59 THR THR A . n +A 1 63 LEU 63 60 60 LEU LEU A . n +A 1 64 VAL 64 61 61 VAL VAL A . n +A 1 65 THR 65 62 62 THR THR A . n +A 1 66 THR 66 63 63 THR THR A . n +A 1 67 LEU 67 64 64 LEU LEU A . n +A 1 68 CRO 68 66 66 CRO CRO A . n +A 1 69 VAL 69 68 68 VAL VAL A . n +A 1 70 GLN 70 69 69 GLN GLN A . n +A 1 71 CYS 71 70 70 CYS CYS A . n +A 1 72 PHE 72 71 71 PHE PHE A . n +A 1 73 ALA 73 72 72 ALA ALA A . n +A 1 74 ARG 74 73 73 ARG ARG A . n +A 1 75 TYR 75 74 74 TYR TYR A . n +A 1 76 PRO 76 75 75 PRO PRO A . n +A 1 77 ASP 77 76 76 ASP ASP A . n +A 1 78 HIS 78 77 77 HIS HIS A . n +A 1 79 MET 79 78 78 MET MET A . n +A 1 80 LYS 80 79 79 LYS LYS A . n +A 1 81 GLN 81 80 80 GLN GLN A . n +A 1 82 HIS 82 81 81 HIS HIS A . n +A 1 83 ASP 83 82 82 ASP ASP A . n +A 1 84 PHE 84 83 83 PHE PHE A . n +A 1 85 PHE 85 84 84 PHE PHE A . n +A 1 86 LYS 86 85 85 LYS LYS A . n +A 1 87 SER 87 86 86 SER SER A . n +A 1 88 ALA 88 87 87 ALA ALA A . n +A 1 89 MET 89 88 88 MET MET A . n +A 1 90 PRO 90 89 89 PRO PRO A . n +A 1 91 GLU 91 90 90 GLU GLU A . n +A 1 92 GLY 92 91 91 GLY GLY A . n +A 1 93 TYR 93 92 92 TYR TYR A . n +A 1 94 VAL 94 93 93 VAL VAL A . n +A 1 95 GLN 95 94 94 GLN GLN A . n +A 1 96 GLU 96 95 95 GLU GLU A . n +A 1 97 ARG 97 96 96 ARG ARG A . n +A 1 98 THR 98 97 97 THR THR A . n +A 1 99 ILE 99 98 98 ILE ILE A . n +A 1 100 PHE 100 99 99 PHE PHE A . n +A 1 101 PHE 101 100 100 PHE PHE A . n +A 1 102 LYS 102 101 101 LYS LYS A . n +A 1 103 ASP 103 102 102 ASP ASP A . n +A 1 104 ASP 104 103 103 ASP ASP A . n +A 1 105 GLY 105 104 104 GLY GLY A . n +A 1 106 ASN 106 105 105 ASN ASN A . n +A 1 107 TYR 107 106 106 TYR TYR A . n +A 1 108 LYS 108 107 107 LYS LYS A . n +A 1 109 THR 109 108 108 THR THR A . n +A 1 110 ARG 110 109 109 ARG ARG A . n +A 1 111 ALA 111 110 110 ALA ALA A . n +A 1 112 GLU 112 111 111 GLU GLU A . n +A 1 113 VAL 113 112 112 VAL VAL A . n +A 1 114 LYS 114 113 113 LYS LYS A . n +A 1 115 PHE 115 114 114 PHE PHE A . n +A 1 116 GLU 116 115 115 GLU GLU A . n +A 1 117 GLY 117 116 116 GLY GLY A . n +A 1 118 ASP 118 117 117 ASP ASP A . n +A 1 119 THR 119 118 118 THR THR A . n +A 1 120 LEU 120 119 119 LEU LEU A . n +A 1 121 VAL 121 120 120 VAL VAL A . n +A 1 122 ASN 122 121 121 ASN ASN A . n +A 1 123 ARG 123 122 122 ARG ARG A . n +A 1 124 ILE 124 123 123 ILE ILE A . n +A 1 125 GLU 125 124 124 GLU GLU A . n +A 1 126 LEU 126 125 125 LEU LEU A . n +A 1 127 LYS 127 126 126 LYS LYS A . n +A 1 128 GLY 128 127 127 GLY GLY A . n +A 1 129 ILE 129 128 128 ILE ILE A . n +A 1 130 ASP 130 129 129 ASP ASP A . n +A 1 131 PHE 131 130 130 PHE PHE A . n +A 1 132 LYS 132 131 131 LYS LYS A . n +A 1 133 GLU 133 132 132 GLU GLU A . n +A 1 134 ASP 134 133 133 ASP ASP A . n +A 1 135 GLY 135 134 134 GLY GLY A . n +A 1 136 ASN 136 135 135 ASN ASN A . n +A 1 137 ILE 137 136 136 ILE ILE A . n +A 1 138 LEU 138 137 137 LEU LEU A . n +A 1 139 GLY 139 138 138 GLY GLY A . n +A 1 140 HIS 140 139 139 HIS HIS A . n +A 1 141 LYS 141 140 140 LYS LYS A . n +A 1 142 LEU 142 141 141 LEU LEU A . n +A 1 143 GLU 143 142 142 GLU GLU A . n +A 1 144 TYR 144 143 143 TYR TYR A . n +A 1 145 ASN 145 144 144 ASN ASN A . n +A 1 146 TYR 146 145 145 TYR TYR A . n +A 1 147 ASN 147 146 146 ASN ASN A . n +A 1 148 HIS 148 147 147 HIS HIS A . n +A 1 149 HIS 149 148 148 HIS HIS A . n +A 1 150 LYS 150 149 149 LYS LYS A . n +A 1 151 VAL 151 150 150 VAL VAL A . n +A 1 152 TYR 152 151 151 TYR TYR A . n +A 1 153 ILE 153 152 152 ILE ILE A . n +A 1 154 THR 154 153 153 THR THR A . n +A 1 155 ALA 155 154 154 ALA ALA A . n +A 1 156 ASP 156 155 155 ASP ASP A . n +A 1 157 LYS 157 156 156 LYS LYS A . n +A 1 158 GLN 158 157 157 GLN GLN A . n +A 1 159 LYS 159 158 158 LYS LYS A . n +A 1 160 ASN 160 159 159 ASN ASN A . n +A 1 161 GLY 161 160 160 GLY GLY A . n +A 1 162 ILE 162 161 161 ILE ILE A . n +A 1 163 LYS 163 162 162 LYS LYS A . n +A 1 164 VAL 164 163 163 VAL VAL A . n +A 1 165 ASN 165 164 164 ASN ASN A . n +A 1 166 PHE 166 165 165 PHE PHE A . n +A 1 167 LYS 167 166 166 LYS LYS A . n +A 1 168 THR 168 167 167 THR THR A . n +A 1 169 ARG 169 168 168 ARG ARG A . n +A 1 170 HIS 170 169 169 HIS HIS A . n +A 1 171 ASN 171 170 170 ASN ASN A . n +A 1 172 ILE 172 171 171 ILE ILE A . n +A 1 173 GLU 173 172 172 GLU GLU A . n +A 1 174 ASP 174 173 173 ASP ASP A . n +A 1 175 GLY 175 174 174 GLY GLY A . n +A 1 176 SER 176 175 175 SER SER A . n +A 1 177 VAL 177 176 176 VAL VAL A . n +A 1 178 GLN 178 177 177 GLN GLN A . n +A 1 179 LEU 179 178 178 LEU LEU A . n +A 1 180 ALA 180 179 179 ALA ALA A . n +A 1 181 ASP 181 180 180 ASP ASP A . n +A 1 182 HIS 182 181 181 HIS HIS A . n +A 1 183 TYR 183 182 182 TYR TYR A . n +A 1 184 GLN 184 183 183 GLN GLN A . n +A 1 185 GLN 185 184 184 GLN GLN A . n +A 1 186 ASN 186 185 185 ASN ASN A . n +A 1 187 THR 187 186 186 THR THR A . n +A 1 188 PRO 188 187 187 PRO PRO A . n +A 1 189 ILE 189 188 188 ILE ILE A . n +A 1 190 GLY 190 189 189 GLY GLY A . n +A 1 191 ASP 191 190 190 ASP ASP A . n +A 1 192 GLY 192 191 191 GLY GLY A . n +A 1 193 PRO 193 192 192 PRO PRO A . n +A 1 194 VAL 194 193 193 VAL VAL A . n +A 1 195 LEU 195 194 194 LEU LEU A . n +A 1 196 LEU 196 195 195 LEU LEU A . n +A 1 197 PRO 197 196 196 PRO PRO A . n +A 1 198 ASP 198 197 197 ASP ASP A . n +A 1 199 ASN 199 198 198 ASN ASN A . n +A 1 200 HIS 200 199 199 HIS HIS A . n +A 1 201 TYR 201 200 200 TYR TYR A . n +A 1 202 LEU 202 201 201 LEU LEU A . n +A 1 203 HIS 203 202 202 HIS HIS A . n +A 1 204 THR 204 203 203 THR THR A . n +A 1 205 HIS 205 204 204 HIS HIS A . n +A 1 206 SER 206 205 205 SER SER A . n +A 1 207 LYS 207 206 206 LYS LYS A . n +A 1 208 LEU 208 207 207 LEU LEU A . n +A 1 209 SER 209 208 208 SER SER A . n +A 1 210 LYS 210 209 209 LYS LYS A . n +A 1 211 ASP 211 210 210 ASP ASP A . n +A 1 212 PRO 212 211 211 PRO PRO A . n +A 1 213 ASN 213 212 212 ASN ASN A . n +A 1 214 GLU 214 213 213 GLU GLU A . n +A 1 215 LYS 215 214 214 LYS LYS A . n +A 1 216 ARG 216 215 215 ARG ARG A . n +A 1 217 ASP 217 216 216 ASP ASP A . n +A 1 218 HIS 218 217 217 HIS HIS A . n +A 1 219 MET 219 218 218 MET MET A . n +A 1 220 VAL 220 219 219 VAL VAL A . n +A 1 221 LEU 221 220 220 LEU LEU A . n +A 1 222 LEU 222 221 221 LEU LEU A . n +A 1 223 GLU 223 222 222 GLU GLU A . n +A 1 224 PHE 224 223 223 PHE PHE A . n +A 1 225 VAL 225 224 224 VAL VAL A . n +A 1 226 THR 226 225 225 THR THR A . n +A 1 227 ALA 227 226 226 ALA ALA A . n +A 1 228 ALA 228 227 227 ALA ALA A . n +A 1 229 GLY 229 228 228 GLY GLY A . n +A 1 230 ILE 230 229 229 ILE ILE A . n +A 1 231 THR 231 230 230 THR THR A . n +A 1 232 LEU 232 231 231 LEU LEU A . n +A 1 233 GLY 233 232 ? ? ? A . n +A 1 234 MET 234 233 ? ? ? A . n +A 1 235 ASP 235 234 ? ? ? A . n +A 1 236 GLU 236 235 ? ? ? A . n +A 1 237 LEU 237 236 ? ? ? A . n +A 1 238 TYR 238 237 ? ? ? A . n +A 1 239 LYS 239 238 ? ? ? A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +B 2 HOH 1 301 1 HOH HOH A . +B 2 HOH 2 302 2 HOH HOH A . +B 2 HOH 3 303 3 HOH HOH A . +B 2 HOH 4 304 4 HOH HOH A . +B 2 HOH 5 305 5 HOH HOH A . +B 2 HOH 6 306 6 HOH HOH A . +B 2 HOH 7 307 7 HOH HOH A . +B 2 HOH 8 308 8 HOH HOH A . +B 2 HOH 9 309 9 HOH HOH A . +B 2 HOH 10 310 10 HOH HOH A . +B 2 HOH 11 311 11 HOH HOH A . +B 2 HOH 12 312 12 HOH HOH A . +B 2 HOH 13 313 13 HOH HOH A . +B 2 HOH 14 314 14 HOH HOH A . +B 2 HOH 15 315 15 HOH HOH A . +B 2 HOH 16 316 16 HOH HOH A . +B 2 HOH 17 317 17 HOH HOH A . +B 2 HOH 18 318 18 HOH HOH A . +B 2 HOH 19 319 19 HOH HOH A . +B 2 HOH 20 320 20 HOH HOH A . +B 2 HOH 21 321 21 HOH HOH A . +B 2 HOH 22 322 22 HOH HOH A . +B 2 HOH 23 323 23 HOH HOH A . +B 2 HOH 24 324 24 HOH HOH A . +B 2 HOH 25 325 25 HOH HOH A . +B 2 HOH 26 326 26 HOH HOH A . +B 2 HOH 27 327 27 HOH HOH A . +B 2 HOH 28 328 28 HOH HOH A . +B 2 HOH 29 329 29 HOH HOH A . +B 2 HOH 30 330 30 HOH HOH A . +B 2 HOH 31 331 31 HOH HOH A . +B 2 HOH 32 332 32 HOH HOH A . +B 2 HOH 33 333 33 HOH HOH A . +B 2 HOH 34 334 34 HOH HOH A . +B 2 HOH 35 335 35 HOH HOH A . +B 2 HOH 36 336 36 HOH HOH A . +B 2 HOH 37 337 37 HOH HOH A . +B 2 HOH 38 338 38 HOH HOH A . +B 2 HOH 39 339 39 HOH HOH A . +B 2 HOH 40 340 40 HOH HOH A . +B 2 HOH 41 341 41 HOH HOH A . +B 2 HOH 42 342 42 HOH HOH A . +B 2 HOH 43 343 43 HOH HOH A . +B 2 HOH 44 344 44 HOH HOH A . +B 2 HOH 45 345 45 HOH HOH A . +B 2 HOH 46 346 46 HOH HOH A . +B 2 HOH 47 347 47 HOH HOH A . +B 2 HOH 48 348 48 HOH HOH A . +B 2 HOH 49 349 49 HOH HOH A . +B 2 HOH 50 350 50 HOH HOH A . +B 2 HOH 51 351 51 HOH HOH A . +B 2 HOH 52 352 52 HOH HOH A . +B 2 HOH 53 353 53 HOH HOH A . +B 2 HOH 54 354 54 HOH HOH A . +B 2 HOH 55 355 55 HOH HOH A . +B 2 HOH 56 356 56 HOH HOH A . +B 2 HOH 57 357 57 HOH HOH A . +B 2 HOH 58 358 58 HOH HOH A . +B 2 HOH 59 359 59 HOH HOH A . +B 2 HOH 60 360 60 HOH HOH A . +B 2 HOH 61 361 61 HOH HOH A . +B 2 HOH 62 362 62 HOH HOH A . +B 2 HOH 63 363 63 HOH HOH A . +B 2 HOH 64 364 64 HOH HOH A . +B 2 HOH 65 365 65 HOH HOH A . +B 2 HOH 66 366 66 HOH HOH A . +B 2 HOH 67 367 67 HOH HOH A . +B 2 HOH 68 368 68 HOH HOH A . +B 2 HOH 69 369 69 HOH HOH A . +B 2 HOH 70 370 70 HOH HOH A . +B 2 HOH 71 371 71 HOH HOH A . +B 2 HOH 72 372 72 HOH HOH A . +B 2 HOH 73 373 73 HOH HOH A . +B 2 HOH 74 374 74 HOH HOH A . +B 2 HOH 75 375 75 HOH HOH A . +B 2 HOH 76 376 76 HOH HOH A . +B 2 HOH 77 377 77 HOH HOH A . +B 2 HOH 78 378 78 HOH HOH A . +B 2 HOH 79 379 79 HOH HOH A . +B 2 HOH 80 380 80 HOH HOH A . +B 2 HOH 81 381 81 HOH HOH A . +B 2 HOH 82 382 82 HOH HOH A . +B 2 HOH 83 383 83 HOH HOH A . +B 2 HOH 84 384 84 HOH HOH A . +B 2 HOH 85 385 85 HOH HOH A . +B 2 HOH 86 386 86 HOH HOH A . +B 2 HOH 87 387 87 HOH HOH A . +B 2 HOH 88 388 88 HOH HOH A . +B 2 HOH 89 389 89 HOH HOH A . +B 2 HOH 90 390 90 HOH HOH A . +B 2 HOH 91 391 91 HOH HOH A . +B 2 HOH 92 392 92 HOH HOH A . +B 2 HOH 93 393 93 HOH HOH A . +B 2 HOH 94 394 94 HOH HOH A . +B 2 HOH 95 395 95 HOH HOH A . +B 2 HOH 96 396 96 HOH HOH A . +B 2 HOH 97 397 97 HOH HOH A . +B 2 HOH 98 398 98 HOH HOH A . +B 2 HOH 99 399 99 HOH HOH A . +B 2 HOH 100 400 100 HOH HOH A . +B 2 HOH 101 401 101 HOH HOH A . +B 2 HOH 102 402 102 HOH HOH A . +B 2 HOH 103 403 103 HOH HOH A . +B 2 HOH 104 404 104 HOH HOH A . +B 2 HOH 105 405 105 HOH HOH A . +B 2 HOH 106 406 106 HOH HOH A . +B 2 HOH 107 407 107 HOH HOH A . +B 2 HOH 108 408 108 HOH HOH A . +B 2 HOH 109 409 109 HOH HOH A . +B 2 HOH 110 410 110 HOH HOH A . +B 2 HOH 111 411 111 HOH HOH A . +B 2 HOH 112 412 112 HOH HOH A . +B 2 HOH 113 413 113 HOH HOH A . +B 2 HOH 114 414 114 HOH HOH A . +B 2 HOH 115 415 115 HOH HOH A . +B 2 HOH 116 416 116 HOH HOH A . +B 2 HOH 117 417 117 HOH HOH A . +B 2 HOH 118 418 118 HOH HOH A . +B 2 HOH 119 419 119 HOH HOH A . +B 2 HOH 120 420 120 HOH HOH A . +B 2 HOH 121 421 121 HOH HOH A . +B 2 HOH 122 422 122 HOH HOH A . +B 2 HOH 123 423 123 HOH HOH A . +B 2 HOH 124 424 124 HOH HOH A . +B 2 HOH 125 425 125 HOH HOH A . +B 2 HOH 126 426 126 HOH HOH A . +B 2 HOH 127 427 127 HOH HOH A . +B 2 HOH 128 428 128 HOH HOH A . +B 2 HOH 129 429 129 HOH HOH A . +B 2 HOH 130 430 130 HOH HOH A . +B 2 HOH 131 431 131 HOH HOH A . +B 2 HOH 132 432 132 HOH HOH A . +B 2 HOH 133 433 133 HOH HOH A . +B 2 HOH 134 434 134 HOH HOH A . +B 2 HOH 135 435 135 HOH HOH A . +B 2 HOH 136 436 136 HOH HOH A . +B 2 HOH 137 437 137 HOH HOH A . +B 2 HOH 138 438 138 HOH HOH A . +B 2 HOH 139 439 139 HOH HOH A . +B 2 HOH 140 440 140 HOH HOH A . +B 2 HOH 141 441 141 HOH HOH A . +B 2 HOH 142 442 142 HOH HOH A . +B 2 HOH 143 443 143 HOH HOH A . +B 2 HOH 144 444 144 HOH HOH A . +B 2 HOH 145 445 145 HOH HOH A . +B 2 HOH 146 446 146 HOH HOH A . +B 2 HOH 147 447 147 HOH HOH A . +B 2 HOH 148 448 148 HOH HOH A . +B 2 HOH 149 449 149 HOH HOH A . +B 2 HOH 150 450 150 HOH HOH A . +B 2 HOH 151 451 151 HOH HOH A . +B 2 HOH 152 452 152 HOH HOH A . +B 2 HOH 153 453 153 HOH HOH A . +B 2 HOH 154 454 154 HOH HOH A . +B 2 HOH 155 455 155 HOH HOH A . +B 2 HOH 156 456 156 HOH HOH A . +B 2 HOH 157 457 157 HOH HOH A . +B 2 HOH 158 458 158 HOH HOH A . +B 2 HOH 159 459 159 HOH HOH A . +B 2 HOH 160 460 160 HOH HOH A . +B 2 HOH 161 461 161 HOH HOH A . +B 2 HOH 162 462 162 HOH HOH A . +B 2 HOH 163 463 163 HOH HOH A . +B 2 HOH 164 464 164 HOH HOH A . +B 2 HOH 165 465 165 HOH HOH A . +B 2 HOH 166 466 166 HOH HOH A . +B 2 HOH 167 467 167 HOH HOH A . +B 2 HOH 168 468 168 HOH HOH A . +B 2 HOH 169 469 169 HOH HOH A . +B 2 HOH 170 470 170 HOH HOH A . +B 2 HOH 171 471 171 HOH HOH A . +B 2 HOH 172 472 172 HOH HOH A . +B 2 HOH 173 473 173 HOH HOH A . +B 2 HOH 174 474 174 HOH HOH A . +B 2 HOH 175 475 175 HOH HOH A . +B 2 HOH 176 476 176 HOH HOH A . +B 2 HOH 177 477 177 HOH HOH A . +B 2 HOH 178 478 178 HOH HOH A . +B 2 HOH 179 479 179 HOH HOH A . +B 2 HOH 180 480 180 HOH HOH A . +B 2 HOH 181 481 181 HOH HOH A . +B 2 HOH 182 482 182 HOH HOH A . +B 2 HOH 183 483 183 HOH HOH A . +B 2 HOH 184 484 184 HOH HOH A . +B 2 HOH 185 485 185 HOH HOH A . +B 2 HOH 186 486 186 HOH HOH A . +B 2 HOH 187 487 187 HOH HOH A . +B 2 HOH 188 488 188 HOH HOH A . +B 2 HOH 189 489 189 HOH HOH A . +B 2 HOH 190 490 190 HOH HOH A . +B 2 HOH 191 491 191 HOH HOH A . +B 2 HOH 192 492 192 HOH HOH A . +B 2 HOH 193 493 193 HOH HOH A . +B 2 HOH 194 494 194 HOH HOH A . +B 2 HOH 195 495 195 HOH HOH A . +B 2 HOH 196 496 196 HOH HOH A . +B 2 HOH 197 497 197 HOH HOH A . +B 2 HOH 198 498 198 HOH HOH A . +B 2 HOH 199 499 199 HOH HOH A . +B 2 HOH 200 500 200 HOH HOH A . +B 2 HOH 201 501 201 HOH HOH A . +B 2 HOH 202 502 202 HOH HOH A . +B 2 HOH 203 503 203 HOH HOH A . +B 2 HOH 204 504 204 HOH HOH A . +B 2 HOH 205 505 205 HOH HOH A . +B 2 HOH 206 506 206 HOH HOH A . +B 2 HOH 207 507 207 HOH HOH A . +B 2 HOH 208 508 208 HOH HOH A . +B 2 HOH 209 509 209 HOH HOH A . +B 2 HOH 210 510 210 HOH HOH A . +B 2 HOH 211 511 211 HOH HOH A . +B 2 HOH 212 512 212 HOH HOH A . +B 2 HOH 213 513 213 HOH HOH A . +B 2 HOH 214 514 214 HOH HOH A . +B 2 HOH 215 515 215 HOH HOH A . +B 2 HOH 216 516 216 HOH HOH A . +B 2 HOH 217 517 217 HOH HOH A . +B 2 HOH 218 518 218 HOH HOH A . +B 2 HOH 219 519 219 HOH HOH A . +B 2 HOH 220 520 220 HOH HOH A . +B 2 HOH 221 521 221 HOH HOH A . +B 2 HOH 222 522 222 HOH HOH A . +B 2 HOH 223 523 223 HOH HOH A . +B 2 HOH 224 524 224 HOH HOH A . +B 2 HOH 225 525 225 HOH HOH A . +B 2 HOH 226 526 226 HOH HOH A . +B 2 HOH 227 527 227 HOH HOH A . +B 2 HOH 228 528 228 HOH HOH A . +B 2 HOH 229 529 229 HOH HOH A . +B 2 HOH 230 530 230 HOH HOH A . +B 2 HOH 231 531 231 HOH HOH A . +B 2 HOH 232 532 232 HOH HOH A . +B 2 HOH 233 533 233 HOH HOH A . +B 2 HOH 234 534 234 HOH HOH A . +B 2 HOH 235 535 235 HOH HOH A . +B 2 HOH 236 536 236 HOH HOH A . +B 2 HOH 237 537 237 HOH HOH A . +B 2 HOH 238 538 238 HOH HOH A . +B 2 HOH 239 539 239 HOH HOH A . +B 2 HOH 240 540 240 HOH HOH A . +B 2 HOH 241 541 241 HOH HOH A . +B 2 HOH 242 542 242 HOH HOH A . +B 2 HOH 243 543 243 HOH HOH A . +B 2 HOH 244 544 244 HOH HOH A . +B 2 HOH 245 545 245 HOH HOH A . +B 2 HOH 246 546 246 HOH HOH A . +B 2 HOH 247 547 247 HOH HOH A . +B 2 HOH 248 548 248 HOH HOH A . +B 2 HOH 249 549 249 HOH HOH A . +B 2 HOH 250 550 250 HOH HOH A . +B 2 HOH 251 551 251 HOH HOH A . +B 2 HOH 252 552 252 HOH HOH A . +B 2 HOH 253 553 253 HOH HOH A . +B 2 HOH 254 554 254 HOH HOH A . +B 2 HOH 255 555 255 HOH HOH A . +B 2 HOH 256 556 256 HOH HOH A . +B 2 HOH 257 557 257 HOH HOH A . +B 2 HOH 258 558 258 HOH HOH A . +B 2 HOH 259 559 259 HOH HOH A . +B 2 HOH 260 560 260 HOH HOH A . +B 2 HOH 261 561 261 HOH HOH A . +B 2 HOH 262 562 262 HOH HOH A . +B 2 HOH 263 563 263 HOH HOH A . +B 2 HOH 264 564 264 HOH HOH A . +B 2 HOH 265 565 265 HOH HOH A . +B 2 HOH 266 566 266 HOH HOH A . +B 2 HOH 267 567 267 HOH HOH A . +B 2 HOH 268 568 268 HOH HOH A . +B 2 HOH 269 569 269 HOH HOH A . +B 2 HOH 270 570 270 HOH HOH A . +B 2 HOH 271 571 271 HOH HOH A . +B 2 HOH 272 572 272 HOH HOH A . +B 2 HOH 273 573 273 HOH HOH A . +B 2 HOH 274 574 274 HOH HOH A . +B 2 HOH 275 575 275 HOH HOH A . +B 2 HOH 276 576 276 HOH HOH A . +B 2 HOH 277 577 277 HOH HOH A . +B 2 HOH 278 578 278 HOH HOH A . +B 2 HOH 279 579 279 HOH HOH A . +B 2 HOH 280 580 280 HOH HOH A . +B 2 HOH 281 581 281 HOH HOH A . +B 2 HOH 282 582 282 HOH HOH A . +B 2 HOH 283 583 283 HOH HOH A . +B 2 HOH 284 584 284 HOH HOH A . +B 2 HOH 285 585 285 HOH HOH A . +B 2 HOH 286 586 286 HOH HOH A . +B 2 HOH 287 587 287 HOH HOH A . +B 2 HOH 288 588 288 HOH HOH A . +B 2 HOH 289 589 289 HOH HOH A . +B 2 HOH 290 590 290 HOH HOH A . +B 2 HOH 291 591 291 HOH HOH A . +B 2 HOH 292 592 292 HOH HOH A . +B 2 HOH 293 593 293 HOH HOH A . +B 2 HOH 294 594 294 HOH HOH A . +B 2 HOH 295 595 295 HOH HOH A . +B 2 HOH 296 596 296 HOH HOH A . +B 2 HOH 297 597 297 HOH HOH A . +B 2 HOH 298 598 298 HOH HOH A . +B 2 HOH 299 599 299 HOH HOH A . +B 2 HOH 300 600 300 HOH HOH A . +B 2 HOH 301 601 301 HOH HOH A . +B 2 HOH 302 602 302 HOH HOH A . +B 2 HOH 303 603 303 HOH HOH A . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A LYS 3 ? CD ? A LYS 6 CD +2 1 Y 1 A LYS 3 ? CE ? A LYS 6 CE +3 1 Y 1 A LYS 3 ? NZ ? A LYS 6 NZ +4 1 Y 1 A GLU 5 ? CD ? A GLU 8 CD +5 1 Y 1 A GLU 5 ? OE1 ? A GLU 8 OE1 +6 1 Y 1 A GLU 5 ? OE2 ? A GLU 8 OE2 +7 1 Y 1 A GLU 6 ? CD ? A GLU 9 CD +8 1 Y 1 A GLU 6 ? OE1 ? A GLU 9 OE1 +9 1 Y 1 A GLU 6 ? OE2 ? A GLU 9 OE2 +10 1 Y 1 A LYS 52 ? CE ? A LYS 55 CE +11 1 Y 1 A LYS 52 ? NZ ? A LYS 55 NZ +12 1 Y 1 A LYS 107 ? CE ? A LYS 108 CE +13 1 Y 1 A LYS 107 ? NZ ? A LYS 108 NZ +14 1 Y 1 A LYS 113 ? CE ? A LYS 114 CE +15 1 Y 1 A LYS 113 ? NZ ? A LYS 114 NZ +16 1 Y 1 A LYS 131 ? NZ ? A LYS 132 NZ +17 1 Y 1 A GLU 132 ? CG ? A GLU 133 CG +18 1 Y 1 A GLU 132 ? CD ? A GLU 133 CD +19 1 Y 1 A GLU 132 ? OE1 ? A GLU 133 OE1 +20 1 Y 1 A GLU 132 ? OE2 ? A GLU 133 OE2 +21 1 Y 1 A LYS 158 ? NZ ? A LYS 159 NZ +22 1 Y 1 A LYS 162 ? NZ ? A LYS 163 NZ +23 1 Y 1 A LYS 166 ? CD ? A LYS 167 CD +24 1 Y 1 A LYS 166 ? CE ? A LYS 167 CE +25 1 Y 1 A LYS 166 ? NZ ? A LYS 167 NZ +26 1 Y 1 A GLU 172 ? CG ? A GLU 173 CG +27 1 Y 1 A GLU 172 ? CD ? A GLU 173 CD +28 1 Y 1 A GLU 172 ? OE1 ? A GLU 173 OE1 +29 1 Y 1 A GLU 172 ? OE2 ? A GLU 173 OE2 +30 1 Y 1 A LEU 178 ? CG ? A LEU 179 CG +31 1 Y 1 A LEU 178 ? CD1 ? A LEU 179 CD1 +32 1 Y 1 A LEU 178 ? CD2 ? A LEU 179 CD2 +33 1 Y 1 A GLN 184 ? CD ? A GLN 185 CD +34 1 Y 1 A GLN 184 ? OE1 ? A GLN 185 OE1 +35 1 Y 1 A GLN 184 ? NE2 ? A GLN 185 NE2 +36 1 Y 1 A LYS 206 ? CE ? A LYS 207 CE +37 1 Y 1 A LYS 206 ? NZ ? A LYS 207 NZ +38 1 Y 1 A LYS 214 ? CD ? A LYS 215 CD +39 1 Y 1 A LYS 214 ? CE ? A LYS 215 CE +40 1 Y 1 A LYS 214 ? NZ ? A LYS 215 NZ +# +loop_ +_software.pdbx_ordinal +_software.name +_software.version +_software.date +_software.type +_software.contact_author +_software.contact_author_email +_software.classification +_software.location +_software.language +_software.citation_id +1 DENZO . ? program 'Zbyszek Otwinowski' hkl@hkl-xray.com +'data reduction' http://www.hkl-xray.com/ ? ? +2 SCALEPACK . ? program 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data scaling' +http://www.hkl-xray.com/ ? ? +3 PHASER 2.5.0 'Sat Jun 2 05:21:23 2012 (svn )' program 'Randy J. Read' cimr-phaser@lists.cam.ac.uk phasing +http://www-structmed.cimr.cam.ac.uk/phaser/ ? ? +4 PHENIX 1.8.2_1309 ? package 'Paul D. Adams' PDAdams@lbl.gov refinement +http://www.phenix-online.org/ C++ ? +5 PDB_EXTRACT 3.11 'April 22, 2011' package PDB deposit@deposit.rcsb.org +'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? +6 SERGUI . ? ? ? ? +'data collection' ? ? ? +# +_cell.entry_id 4KW4 +_cell.length_a 72.904 +_cell.length_b 72.904 +_cell.length_c 113.973 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 90.00 +_cell.Z_PDB 8 +_cell.pdbx_unique_axis ? +_cell.length_a_esd ? +_cell.length_b_esd ? +_cell.length_c_esd ? +_cell.angle_alpha_esd ? +_cell.angle_beta_esd ? +_cell.angle_gamma_esd ? +# +_symmetry.entry_id 4KW4 +_symmetry.space_group_name_H-M 'P 41 21 2' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 92 +_symmetry.space_group_name_Hall ? +# +_exptl.crystals_number 1 +_exptl.entry_id 4KW4 +_exptl.method 'X-RAY DIFFRACTION' +# +_exptl_crystal.id 1 +_exptl_crystal.density_Matthews 2.78 +_exptl_crystal.density_meas ? +_exptl_crystal.density_percent_sol 55.77 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.preparation ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method 'hanging drop' +_exptl_crystal_grow.pH 8.2 +_exptl_crystal_grow.temp 294 +_exptl_crystal_grow.pdbx_details '50 mM HEPES pH 8.2, 50 mM MgCl2, 22% PEG4000, hanging drop, temperature 294K' +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.id 1 +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'MARMOSAIC 225 mm CCD' +_diffrn_detector.pdbx_collection_date 2012-08-20 +_diffrn_detector.details mirrors +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.monochromator 'Si(111)' +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1.0000 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'APS BEAMLINE 22-BM' +_diffrn_source.pdbx_wavelength_list 1.0000 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_site APS +_diffrn_source.pdbx_synchrotron_beamline 22-BM +# +_reflns.entry_id 4KW4 +_reflns.d_resolution_high 1.746 +_reflns.d_resolution_low 50.000 +_reflns.number_obs 31923 +_reflns.pdbx_Rmerge_I_obs 0.088 +_reflns.pdbx_netI_over_sigmaI 8.700 +_reflns.pdbx_chi_squared 1.312 +_reflns.pdbx_redundancy 8.300 +_reflns.percent_possible_obs 99.800 +_reflns.observed_criterion_sigma_F 1 +_reflns.observed_criterion_sigma_I 1 +_reflns.number_all 31994 +_reflns.B_iso_Wilson_estimate 29.0 +_reflns.R_free_details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_ordinal 1 +_reflns.pdbx_diffrn_id 1 +# +loop_ +_reflns_shell.d_res_high +_reflns_shell.d_res_low +_reflns_shell.number_measured_obs +_reflns_shell.number_measured_all +_reflns_shell.number_unique_obs +_reflns_shell.Rmerge_I_obs +_reflns_shell.meanI_over_sigI_obs +_reflns_shell.pdbx_Rsym_value +_reflns_shell.pdbx_chi_squared +_reflns_shell.pdbx_redundancy +_reflns_shell.percent_possible_obs +_reflns_shell.number_unique_all +_reflns_shell.percent_possible_all +_reflns_shell.pdbx_ordinal +_reflns_shell.pdbx_diffrn_id +1.746 1.810 ? ? ? 0.822 ? ? 1.049 7.200 ? 3125 100.000 1 1 +1.810 1.890 ? ? ? 0.667 ? ? 1.056 7.400 ? 3114 99.700 2 1 +1.890 1.970 ? ? ? 0.499 ? ? 1.115 7.700 ? 3132 99.700 3 1 +1.970 2.070 ? ? ? 0.368 ? ? 1.145 8.100 ? 3142 99.800 4 1 +2.070 2.200 ? ? ? 0.268 ? ? 1.190 8.300 ? 3155 99.900 5 1 +2.200 2.380 ? ? ? 0.198 ? ? 1.215 8.400 ? 3176 99.900 6 1 +2.380 2.610 ? ? ? 0.142 ? ? 1.371 8.600 ? 3183 99.900 7 1 +2.610 2.990 ? ? ? 0.107 ? ? 1.730 8.800 ? 3200 99.900 8 1 +2.990 3.770 ? ? ? 0.055 ? ? 1.759 9.100 ? 3259 99.900 9 1 +3.770 50.000 ? ? ? 0.031 ? ? 1.287 8.800 ? 3437 99.200 10 1 +# +_refine.entry_id 4KW4 +_refine.ls_d_res_high 1.7460 +_refine.ls_d_res_low 23.0540 +_refine.pdbx_ls_sigma_F 1.380 +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.ls_percent_reflns_obs 99.8800 +_refine.ls_number_reflns_obs 31868 +_refine.ls_number_reflns_all 31878 +_refine.pdbx_ls_cross_valid_method ? +_refine.pdbx_R_Free_selection_details Random +_refine.details ? +_refine.ls_R_factor_all 0.217 +_refine.ls_R_factor_obs 0.1723 +_refine.ls_R_factor_R_work 0.1701 +_refine.ls_wR_factor_R_work ? +_refine.ls_R_factor_R_free 0.2045 +_refine.ls_wR_factor_R_free ? +_refine.ls_percent_reflns_R_free 6.2800 +_refine.ls_number_reflns_R_free 2000 +_refine.ls_R_factor_R_free_error ? +_refine.B_iso_mean 25.9969 +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.pdbx_isotropic_thermal_model ? +_refine.aniso_B[1][1] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[3][3] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][3] ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML 0.1900 +_refine.overall_SU_B ? +_refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' +_refine.pdbx_solvent_vdw_probe_radii 1.1100 +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii 0.9000 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.pdbx_starting_model ? +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_stereochemistry_target_values ML +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.overall_FOM_work_R_set 0.8700 +_refine.B_iso_max 70.010 +_refine.B_iso_min 9.110 +_refine.pdbx_overall_phase_error 19.6800 +_refine.occupancy_max 1.000 +_refine.occupancy_min 0.180 +_refine.pdbx_ls_sigma_I ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_R_factor_R_free_error_details ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.overall_FOM_free_R_set ? +_refine.pdbx_diffrn_id 1 +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 1795 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 0 +_refine_hist.number_atoms_solvent 303 +_refine_hist.number_atoms_total 2098 +_refine_hist.d_res_high 1.7460 +_refine_hist.d_res_low 23.0540 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.number +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.pdbx_restraint_function +_refine_ls_restr.pdbx_refine_id +f_bond_d 1928 0.011 ? ? ? 'X-RAY DIFFRACTION' +f_angle_d 2631 1.399 ? ? ? 'X-RAY DIFFRACTION' +f_chiral_restr 284 0.081 ? ? ? 'X-RAY DIFFRACTION' +f_plane_restr 348 0.006 ? ? ? 'X-RAY DIFFRACTION' +f_dihedral_angle_d 707 14.575 ? ? ? 'X-RAY DIFFRACTION' +# +loop_ +_refine_ls_shell.d_res_high +_refine_ls_shell.d_res_low +_refine_ls_shell.pdbx_total_number_of_bins_used +_refine_ls_shell.percent_reflns_obs +_refine_ls_shell.number_reflns_R_work +_refine_ls_shell.R_factor_all +_refine_ls_shell.R_factor_R_work +_refine_ls_shell.R_factor_R_free +_refine_ls_shell.percent_reflns_R_free +_refine_ls_shell.number_reflns_R_free +_refine_ls_shell.R_factor_R_free_error +_refine_ls_shell.number_reflns_all +_refine_ls_shell.number_reflns_obs +_refine_ls_shell.redundancy_reflns_obs +_refine_ls_shell.pdbx_refine_id +1.7460 1.7896 14 100.0000 2070 . 0.3050 0.3455 . 138 . 2208 . . 'X-RAY DIFFRACTION' +1.7896 1.8380 14 100.0000 2087 . 0.2680 0.3011 . 141 . 2228 . . 'X-RAY DIFFRACTION' +1.8380 1.8920 14 100.0000 2097 . 0.2489 0.2530 . 140 . 2237 . . 'X-RAY DIFFRACTION' +1.8920 1.9531 14 100.0000 2088 . 0.2226 0.2224 . 140 . 2228 . . 'X-RAY DIFFRACTION' +1.9531 2.0228 14 100.0000 2120 . 0.1938 0.2131 . 141 . 2261 . . 'X-RAY DIFFRACTION' +2.0228 2.1038 14 100.0000 2100 . 0.1793 0.2297 . 141 . 2241 . . 'X-RAY DIFFRACTION' +2.1038 2.1995 14 100.0000 2104 . 0.1639 0.2313 . 141 . 2245 . . 'X-RAY DIFFRACTION' +2.1995 2.3153 14 100.0000 2110 . 0.1675 0.2273 . 141 . 2251 . . 'X-RAY DIFFRACTION' +2.3153 2.4602 14 100.0000 2134 . 0.1630 0.2033 . 143 . 2277 . . 'X-RAY DIFFRACTION' +2.4602 2.6499 14 100.0000 2138 . 0.1570 0.2243 . 144 . 2282 . . 'X-RAY DIFFRACTION' +2.6499 2.9161 14 100.0000 2150 . 0.1701 0.1971 . 144 . 2294 . . 'X-RAY DIFFRACTION' +2.9161 3.3370 14 100.0000 2155 . 0.1502 0.1811 . 144 . 2299 . . 'X-RAY DIFFRACTION' +3.3370 4.2001 14 100.0000 2191 . 0.1431 0.1788 . 146 . 2337 . . 'X-RAY DIFFRACTION' +4.2001 23.0563 14 100.0000 2324 . 0.1575 0.1778 . 156 . 2480 . . 'X-RAY DIFFRACTION' +# +_struct.entry_id 4KW4 +_struct.title 'Crystal Structure of Green Fluorescent Protein' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 4KW4 +_struct_keywords.text 'beta barrel, fluorescent protein, chromophore' +_struct_keywords.pdbx_keywords 'FLUORESCENT PROTEIN' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code GFP_AEQVI +_struct_ref.pdbx_db_accession P42212 +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code +;SKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTFSYGVQCFSRYPDHMKQH +DFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYIMADKQKNGI +KVNFKIRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGITHGMDELYK +; +_struct_ref.pdbx_align_begin 2 +_struct_ref.pdbx_db_isoform ? +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 4KW4 +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 5 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 239 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession P42212 +_struct_ref_seq.db_align_beg 2 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 238 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 2 +_struct_ref_seq.pdbx_auth_seq_align_end 238 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +1 4KW4 GLY A 1 ? UNP P42212 ? ? 'expression tag' -2 1 +1 4KW4 SER A 2 ? UNP P42212 ? ? 'expression tag' -1 2 +1 4KW4 MET A 3 ? UNP P42212 ? ? 'expression tag' 0 3 +1 4KW4 VAL A 4 ? UNP P42212 ? ? 'expression tag' 1 4 +1 4KW4 LEU A 67 ? UNP P42212 PHE 64 'SEE REMARK 999' 64 5 +1 4KW4 CRO A 68 ? UNP P42212 SER 65 chromophore 66 6 +1 4KW4 CRO A 68 ? UNP P42212 TYR 66 chromophore 66 7 +1 4KW4 CRO A 68 ? UNP P42212 GLY 67 chromophore 66 8 +1 4KW4 ALA A 73 ? UNP P42212 SER 72 'SEE REMARK 999' 72 9 +1 4KW4 HIS A 148 ? UNP P42212 SER 147 'engineered mutation' 147 10 +1 4KW4 LYS A 150 ? UNP P42212 ASN 149 'SEE REMARK 999' 149 11 +1 4KW4 THR A 154 ? UNP P42212 MET 153 'SEE REMARK 999' 153 12 +1 4KW4 THR A 168 ? UNP P42212 ILE 167 'SEE REMARK 999' 167 13 +1 4KW4 HIS A 203 ? UNP P42212 SER 202 'engineered mutation' 202 14 +1 4KW4 HIS A 205 ? UNP P42212 GLN 204 'engineered mutation' 204 15 +1 4KW4 LYS A 207 ? UNP P42212 ALA 206 'engineered mutation' 206 16 +1 4KW4 LEU A 232 ? UNP P42212 HIS 231 'SEE REMARK 999' 231 17 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_and_software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_struct_biol.id 1 +_struct_biol.details ? +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 LYS A 6 ? THR A 12 ? LYS A 3 THR A 9 5 ? 7 +HELX_P HELX_P2 2 PRO A 59 ? VAL A 64 ? PRO A 56 VAL A 61 5 ? 6 +HELX_P HELX_P3 3 VAL A 69 ? ALA A 73 ? VAL A 68 ALA A 72 5 ? 5 +HELX_P HELX_P4 4 PRO A 76 ? HIS A 82 ? PRO A 75 HIS A 81 5 ? 7 +HELX_P HELX_P5 5 ASP A 83 ? ALA A 88 ? ASP A 82 ALA A 87 1 ? 6 +HELX_P HELX_P6 6 LYS A 157 ? ASN A 160 ? LYS A 156 ASN A 159 5 ? 4 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +covale1 covale both ? A LEU 67 C ? ? ? 1_555 A CRO 68 N1 ? ? A LEU 64 A CRO 66 1_555 ? ? ? ? ? ? ? 1.331 ? ? +covale2 covale both ? A CRO 68 C3 ? ? ? 1_555 A VAL 69 N ? ? A CRO 66 A VAL 68 1_555 ? ? ? ? ? ? ? 1.352 ? ? +# +_struct_conn_type.id covale +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +_pdbx_modification_feature.ordinal 1 +_pdbx_modification_feature.label_comp_id CRO +_pdbx_modification_feature.label_asym_id A +_pdbx_modification_feature.label_seq_id 68 +_pdbx_modification_feature.label_alt_id ? +_pdbx_modification_feature.modified_residue_label_comp_id . +_pdbx_modification_feature.modified_residue_label_asym_id . +_pdbx_modification_feature.modified_residue_label_seq_id . +_pdbx_modification_feature.modified_residue_label_alt_id . +_pdbx_modification_feature.auth_comp_id CRO +_pdbx_modification_feature.auth_asym_id A +_pdbx_modification_feature.auth_seq_id 66 +_pdbx_modification_feature.PDB_ins_code ? +_pdbx_modification_feature.symmetry 1_555 +_pdbx_modification_feature.modified_residue_auth_comp_id . +_pdbx_modification_feature.modified_residue_auth_asym_id . +_pdbx_modification_feature.modified_residue_auth_seq_id . +_pdbx_modification_feature.modified_residue_PDB_ins_code . +_pdbx_modification_feature.modified_residue_symmetry . +_pdbx_modification_feature.comp_id_linking_atom . +_pdbx_modification_feature.modified_residue_id_linking_atom . +_pdbx_modification_feature.modified_residue_id 'THR, TYR, GLY' +_pdbx_modification_feature.ref_pcm_id 1 +_pdbx_modification_feature.ref_comp_id CRO +_pdbx_modification_feature.type None +_pdbx_modification_feature.category Chromophore/chromophore-like +# +_struct_mon_prot_cis.pdbx_id 1 +_struct_mon_prot_cis.label_comp_id MET +_struct_mon_prot_cis.label_seq_id 89 +_struct_mon_prot_cis.label_asym_id A +_struct_mon_prot_cis.label_alt_id . +_struct_mon_prot_cis.pdbx_PDB_ins_code ? +_struct_mon_prot_cis.auth_comp_id MET +_struct_mon_prot_cis.auth_seq_id 88 +_struct_mon_prot_cis.auth_asym_id A +_struct_mon_prot_cis.pdbx_label_comp_id_2 PRO +_struct_mon_prot_cis.pdbx_label_seq_id_2 90 +_struct_mon_prot_cis.pdbx_label_asym_id_2 A +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 ? +_struct_mon_prot_cis.pdbx_auth_comp_id_2 PRO +_struct_mon_prot_cis.pdbx_auth_seq_id_2 89 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 A +_struct_mon_prot_cis.pdbx_PDB_model_num 1 +_struct_mon_prot_cis.pdbx_omega_angle 6.13 +# +_struct_sheet.id A +_struct_sheet.type ? +_struct_sheet.number_strands 12 +_struct_sheet.details ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +A 1 2 ? anti-parallel +A 2 3 ? anti-parallel +A 3 4 ? anti-parallel +A 4 5 ? anti-parallel +A 5 6 ? anti-parallel +A 6 7 ? anti-parallel +A 7 8 ? anti-parallel +A 8 9 ? anti-parallel +A 9 10 ? anti-parallel +A 10 11 ? anti-parallel +A 11 12 ? parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +A 1 VAL A 14 ? VAL A 25 ? VAL A 11 VAL A 22 +A 2 HIS A 28 ? ASP A 39 ? HIS A 25 ASP A 36 +A 3 LYS A 44 ? CYS A 51 ? LYS A 41 CYS A 48 +A 4 HIS A 218 ? ALA A 228 ? HIS A 217 ALA A 227 +A 5 HIS A 200 ? SER A 209 ? HIS A 199 SER A 208 +A 6 HIS A 148 ? ASP A 156 ? HIS A 147 ASP A 155 +A 7 GLY A 161 ? ASN A 171 ? GLY A 160 ASN A 170 +A 8 VAL A 177 ? PRO A 188 ? VAL A 176 PRO A 187 +A 9 TYR A 93 ? PHE A 101 ? TYR A 92 PHE A 100 +A 10 ASN A 106 ? GLU A 116 ? ASN A 105 GLU A 115 +A 11 THR A 119 ? ILE A 129 ? THR A 118 ILE A 128 +A 12 VAL A 14 ? VAL A 25 ? VAL A 11 VAL A 22 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +A 1 2 N VAL A 19 ? N VAL A 16 O GLY A 34 ? O GLY A 31 +A 2 3 N ASP A 39 ? N ASP A 36 O LYS A 44 ? O LYS A 41 +A 3 4 N LEU A 47 ? N LEU A 44 O LEU A 221 ? O LEU A 220 +A 4 5 O THR A 226 ? O THR A 225 N HIS A 203 ? N HIS A 202 +A 5 6 O HIS A 200 ? O HIS A 199 N ILE A 153 ? N ILE A 152 +A 6 7 N ASP A 156 ? N ASP A 155 O GLY A 161 ? O GLY A 160 +A 7 8 N PHE A 166 ? N PHE A 165 O HIS A 182 ? O HIS A 181 +A 8 9 O GLN A 185 ? O GLN A 184 N GLU A 96 ? N GLU A 95 +A 9 10 N ILE A 99 ? N ILE A 98 O TYR A 107 ? O TYR A 106 +A 10 11 N LYS A 114 ? N LYS A 113 O VAL A 121 ? O VAL A 120 +A 11 12 O GLY A 128 ? O GLY A 127 N ASP A 24 ? N ASP A 21 +# +_pdbx_entry_details.entry_id 4KW4 +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details +;EMERALD GFP HAS LEU AT POSITION 64, THR AT 65, ALA AT 72, LYS AT 149, THR AT 153, 167, LEU AT 231. RESIDUES THR 65, TYR 66, GLY 67 FORM A CHROMOPHORE CRO 66 +; +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 HD1 A HIS 204 ? ? O A HOH 373 ? ? 1.46 +2 1 O A HOH 459 ? ? O A HOH 539 ? ? 2.19 +3 1 O A HOH 386 ? ? O A HOH 416 ? ? 2.19 +# +_pdbx_validate_symm_contact.id 1 +_pdbx_validate_symm_contact.PDB_model_num 1 +_pdbx_validate_symm_contact.auth_atom_id_1 OE1 +_pdbx_validate_symm_contact.auth_asym_id_1 A +_pdbx_validate_symm_contact.auth_comp_id_1 GLU +_pdbx_validate_symm_contact.auth_seq_id_1 115 +_pdbx_validate_symm_contact.PDB_ins_code_1 ? +_pdbx_validate_symm_contact.label_alt_id_1 ? +_pdbx_validate_symm_contact.site_symmetry_1 1_555 +_pdbx_validate_symm_contact.auth_atom_id_2 HE2 +_pdbx_validate_symm_contact.auth_asym_id_2 A +_pdbx_validate_symm_contact.auth_comp_id_2 HIS +_pdbx_validate_symm_contact.auth_seq_id_2 204 +_pdbx_validate_symm_contact.PDB_ins_code_2 ? +_pdbx_validate_symm_contact.label_alt_id_2 ? +_pdbx_validate_symm_contact.site_symmetry_2 3_555 +_pdbx_validate_symm_contact.dist 1.54 +# +loop_ +_pdbx_struct_mod_residue.id +_pdbx_struct_mod_residue.label_asym_id +_pdbx_struct_mod_residue.label_comp_id +_pdbx_struct_mod_residue.label_seq_id +_pdbx_struct_mod_residue.auth_asym_id +_pdbx_struct_mod_residue.auth_comp_id +_pdbx_struct_mod_residue.auth_seq_id +_pdbx_struct_mod_residue.PDB_ins_code +_pdbx_struct_mod_residue.parent_comp_id +_pdbx_struct_mod_residue.details +1 A CRO 68 A CRO 66 ? GLY ? +2 A CRO 68 A CRO 66 ? TYR ? +3 A CRO 68 A CRO 66 ? GLY ? +# +loop_ +_pdbx_refine_tls.pdbx_refine_id +_pdbx_refine_tls.id +_pdbx_refine_tls.details +_pdbx_refine_tls.method +_pdbx_refine_tls.origin_x +_pdbx_refine_tls.origin_y +_pdbx_refine_tls.origin_z +_pdbx_refine_tls.T[1][1] +_pdbx_refine_tls.T[2][2] +_pdbx_refine_tls.T[3][3] +_pdbx_refine_tls.T[1][2] +_pdbx_refine_tls.T[1][3] +_pdbx_refine_tls.T[2][3] +_pdbx_refine_tls.L[1][1] +_pdbx_refine_tls.L[2][2] +_pdbx_refine_tls.L[3][3] +_pdbx_refine_tls.L[1][2] +_pdbx_refine_tls.L[1][3] +_pdbx_refine_tls.L[2][3] +_pdbx_refine_tls.S[1][1] +_pdbx_refine_tls.S[2][2] +_pdbx_refine_tls.S[3][3] +_pdbx_refine_tls.S[1][2] +_pdbx_refine_tls.S[1][3] +_pdbx_refine_tls.S[2][3] +_pdbx_refine_tls.S[2][1] +_pdbx_refine_tls.S[3][1] +_pdbx_refine_tls.S[3][2] +'X-RAY DIFFRACTION' 1 ? refined 5.8131 34.8751 10.6333 0.1659 0.2248 0.1561 -0.0588 0.0471 -0.0606 6.9422 0.9654 1.2153 1.4834 +-0.6529 -0.0309 0.1399 0.0313 -0.1594 -0.0676 -0.0329 -0.0186 0.0429 -0.1517 0.1419 +'X-RAY DIFFRACTION' 2 ? refined 9.8511 41.3592 5.1179 0.2276 0.1802 0.1739 -0.0837 0.0497 -0.0546 2.0235 2.5201 1.5618 1.3662 +0.0986 0.5919 0.0724 0.0666 -0.0565 0.0104 0.2630 0.0649 -0.0952 -0.5582 0.2005 +'X-RAY DIFFRACTION' 3 ? refined -1.3023 21.3211 1.2920 0.1193 0.1521 0.1664 -0.0459 -0.0254 0.0217 1.6696 5.6767 2.5332 1.5808 +0.5822 2.1659 0.0439 -0.0393 0.0129 -0.1210 -0.1196 0.4711 0.0898 0.2803 -0.5372 +'X-RAY DIFFRACTION' 4 ? refined 12.5488 30.8642 10.1624 0.1210 0.2715 0.1466 -0.0333 -0.0008 -0.0825 1.1908 1.0013 0.6352 0.6221 +0.4139 0.0700 0.1092 0.1229 -0.1501 -0.1426 0.0047 -0.1214 0.1590 0.1274 0.4535 +'X-RAY DIFFRACTION' 5 ? refined 21.6845 42.0788 -4.9024 0.3275 0.5590 0.2898 -0.3814 0.1150 -0.0850 0.4808 0.3889 0.3938 0.0409 +0.4292 0.0646 0.0938 0.1807 0.3214 0.2377 0.1269 -0.3286 -0.0993 -0.5701 0.7063 +'X-RAY DIFFRACTION' 6 ? refined 13.5753 23.0041 0.0983 0.1403 0.1898 0.1738 0.0328 -0.0524 -0.0755 1.8710 6.2596 3.0751 2.0227 +-1.3353 -2.7467 0.0025 0.0194 0.0149 0.0609 -0.2071 -0.4026 0.1030 0.1013 0.3749 +'X-RAY DIFFRACTION' 7 ? refined 18.4979 30.8766 -1.8321 0.1772 0.3548 0.1539 -0.0510 0.0049 -0.1128 1.8902 0.7366 1.0021 -0.2206 +-0.6204 0.8338 0.1094 0.0897 -0.0762 0.1781 -0.1195 -0.3348 -0.0944 -0.1789 0.7668 +'X-RAY DIFFRACTION' 8 ? refined 5.1885 32.1855 1.0626 0.1989 0.1305 0.1266 -0.0554 0.0165 -0.0149 1.2240 1.2152 1.8489 0.1500 +0.3857 0.6047 0.2021 -0.2053 -0.0317 -0.1131 0.0922 0.1237 0.2790 -0.1936 -0.0112 +# +loop_ +_pdbx_refine_tls_group.pdbx_refine_id +_pdbx_refine_tls_group.id +_pdbx_refine_tls_group.refine_tls_id +_pdbx_refine_tls_group.beg_auth_asym_id +_pdbx_refine_tls_group.beg_auth_seq_id +_pdbx_refine_tls_group.end_auth_asym_id +_pdbx_refine_tls_group.end_auth_seq_id +_pdbx_refine_tls_group.selection_details +_pdbx_refine_tls_group.beg_label_asym_id +_pdbx_refine_tls_group.beg_label_seq_id +_pdbx_refine_tls_group.end_label_asym_id +_pdbx_refine_tls_group.end_label_seq_id +_pdbx_refine_tls_group.selection +'X-RAY DIFFRACTION' 1 1 A 0 A 0 +;chain 'A' and (resid 2 through 24 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 2 2 A 0 A 0 +;chain 'A' and (resid 25 through 68 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 3 3 A 0 A 0 +;chain 'A' and (resid 69 through 81 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 4 4 A 0 A 0 +;chain 'A' and (resid 82 through 128 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 5 5 A 0 A 0 +;chain 'A' and (resid 129 through 147 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 6 6 A 0 A 0 +;chain 'A' and (resid 148 through 170 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 7 7 A 0 A 0 +;chain 'A' and (resid 171 through 187 ) +; +? ? ? ? ? +'X-RAY DIFFRACTION' 8 8 A 0 A 0 +;chain 'A' and (resid 188 through 231 ) +; +? ? ? ? ? +# +_pdbx_phasing_MR.entry_id 4KW4 +_pdbx_phasing_MR.method_rotation ? +_pdbx_phasing_MR.method_translation ? +_pdbx_phasing_MR.model_details ? +_pdbx_phasing_MR.R_factor ? +_pdbx_phasing_MR.R_rigid_body ? +_pdbx_phasing_MR.correlation_coeff_Fo_to_Fc ? +_pdbx_phasing_MR.correlation_coeff_Io_to_Ic ? +_pdbx_phasing_MR.d_res_high_rotation 6.230 +_pdbx_phasing_MR.d_res_low_rotation 46.970 +_pdbx_phasing_MR.d_res_high_translation 6.230 +_pdbx_phasing_MR.d_res_low_translation 46.970 +_pdbx_phasing_MR.packing ? +_pdbx_phasing_MR.reflns_percent_rotation ? +_pdbx_phasing_MR.reflns_percent_translation ? +_pdbx_phasing_MR.sigma_F_rotation ? +_pdbx_phasing_MR.sigma_F_translation ? +_pdbx_phasing_MR.sigma_I_rotation ? +_pdbx_phasing_MR.sigma_I_translation ? +# +_phasing.method MR +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A GLY -2 ? A GLY 1 +2 1 Y 1 A SER -1 ? A SER 2 +3 1 Y 1 A MET 0 ? A MET 3 +4 1 Y 1 A VAL 1 ? A VAL 4 +5 1 Y 1 A GLY 232 ? A GLY 233 +6 1 Y 1 A MET 233 ? A MET 234 +7 1 Y 1 A ASP 234 ? A ASP 235 +8 1 Y 1 A GLU 235 ? A GLU 236 +9 1 Y 1 A LEU 236 ? A LEU 237 +10 1 Y 1 A TYR 237 ? A TYR 238 +11 1 Y 1 A LYS 238 ? A LYS 239 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CRO N1 N N N 74 +CRO CA1 C N R 75 +CRO CB1 C N R 76 +CRO CG1 C N N 77 +CRO OG1 O N N 78 +CRO C1 C N N 79 +CRO N2 N N N 80 +CRO N3 N N N 81 +CRO C2 C N N 82 +CRO O2 O N N 83 +CRO CA2 C N N 84 +CRO CA3 C N N 85 +CRO C3 C N N 86 +CRO O3 O N N 87 +CRO CB2 C N N 88 +CRO CG2 C Y N 89 +CRO CD1 C Y N 90 +CRO CD2 C Y N 91 +CRO CE1 C Y N 92 +CRO CE2 C Y N 93 +CRO CZ C Y N 94 +CRO OH O N N 95 +CRO OXT O N N 96 +CRO H H N N 97 +CRO H2 H N N 98 +CRO HA1 H N N 99 +CRO HB1 H N N 100 +CRO HG11 H N N 101 +CRO HG12 H N N 102 +CRO HG13 H N N 103 +CRO HOG1 H N N 104 +CRO HA31 H N N 105 +CRO HA32 H N N 106 +CRO HXT H N N 107 +CRO HB2 H N N 108 +CRO HD1 H N N 109 +CRO HD2 H N N 110 +CRO HE1 H N N 111 +CRO HE2 H N N 112 +CRO HOH H N N 113 +CYS N N N N 114 +CYS CA C N R 115 +CYS C C N N 116 +CYS O O N N 117 +CYS CB C N N 118 +CYS SG S N N 119 +CYS OXT O N N 120 +CYS H H N N 121 +CYS H2 H N N 122 +CYS HA H N N 123 +CYS HB2 H N N 124 +CYS HB3 H N N 125 +CYS HG H N N 126 +CYS HXT H N N 127 +GLN N N N N 128 +GLN CA C N S 129 +GLN C C N N 130 +GLN O O N N 131 +GLN CB C N N 132 +GLN CG C N N 133 +GLN CD C N N 134 +GLN OE1 O N N 135 +GLN NE2 N N N 136 +GLN OXT O N N 137 +GLN H H N N 138 +GLN H2 H N N 139 +GLN HA H N N 140 +GLN HB2 H N N 141 +GLN HB3 H N N 142 +GLN HG2 H N N 143 +GLN HG3 H N N 144 +GLN HE21 H N N 145 +GLN HE22 H N N 146 +GLN HXT H N N 147 +GLU N N N N 148 +GLU CA C N S 149 +GLU C C N N 150 +GLU O O N N 151 +GLU CB C N N 152 +GLU CG C N N 153 +GLU CD C N N 154 +GLU OE1 O N N 155 +GLU OE2 O N N 156 +GLU OXT O N N 157 +GLU H H N N 158 +GLU H2 H N N 159 +GLU HA H N N 160 +GLU HB2 H N N 161 +GLU HB3 H N N 162 +GLU HG2 H N N 163 +GLU HG3 H N N 164 +GLU HE2 H N N 165 +GLU HXT H N N 166 +GLY N N N N 167 +GLY CA C N N 168 +GLY C C N N 169 +GLY O O N N 170 +GLY OXT O N N 171 +GLY H H N N 172 +GLY H2 H N N 173 +GLY HA2 H N N 174 +GLY HA3 H N N 175 +GLY HXT H N N 176 +HIS N N N N 177 +HIS CA C N S 178 +HIS C C N N 179 +HIS O O N N 180 +HIS CB C N N 181 +HIS CG C Y N 182 +HIS ND1 N Y N 183 +HIS CD2 C Y N 184 +HIS CE1 C Y N 185 +HIS NE2 N Y N 186 +HIS OXT O N N 187 +HIS H H N N 188 +HIS H2 H N N 189 +HIS HA H N N 190 +HIS HB2 H N N 191 +HIS HB3 H N N 192 +HIS HD1 H N N 193 +HIS HD2 H N N 194 +HIS HE1 H N N 195 +HIS HE2 H N N 196 +HIS HXT H N N 197 +HOH O O N N 198 +HOH H1 H N N 199 +HOH H2 H N N 200 +ILE N N N N 201 +ILE CA C N S 202 +ILE C C N N 203 +ILE O O N N 204 +ILE CB C N S 205 +ILE CG1 C N N 206 +ILE CG2 C N N 207 +ILE CD1 C N N 208 +ILE OXT O N N 209 +ILE H H N N 210 +ILE H2 H N N 211 +ILE HA H N N 212 +ILE HB H N N 213 +ILE HG12 H N N 214 +ILE HG13 H N N 215 +ILE HG21 H N N 216 +ILE HG22 H N N 217 +ILE HG23 H N N 218 +ILE HD11 H N N 219 +ILE HD12 H N N 220 +ILE HD13 H N N 221 +ILE HXT H N N 222 +LEU N N N N 223 +LEU CA C N S 224 +LEU C C N N 225 +LEU O O N N 226 +LEU CB C N N 227 +LEU CG C N N 228 +LEU CD1 C N N 229 +LEU CD2 C N N 230 +LEU OXT O N N 231 +LEU H H N N 232 +LEU H2 H N N 233 +LEU HA H N N 234 +LEU HB2 H N N 235 +LEU HB3 H N N 236 +LEU HG H N N 237 +LEU HD11 H N N 238 +LEU HD12 H N N 239 +LEU HD13 H N N 240 +LEU HD21 H N N 241 +LEU HD22 H N N 242 +LEU HD23 H N N 243 +LEU HXT H N N 244 +LYS N N N N 245 +LYS CA C N S 246 +LYS C C N N 247 +LYS O O N N 248 +LYS CB C N N 249 +LYS CG C N N 250 +LYS CD C N N 251 +LYS CE C N N 252 +LYS NZ N N N 253 +LYS OXT O N N 254 +LYS H H N N 255 +LYS H2 H N N 256 +LYS HA H N N 257 +LYS HB2 H N N 258 +LYS HB3 H N N 259 +LYS HG2 H N N 260 +LYS HG3 H N N 261 +LYS HD2 H N N 262 +LYS HD3 H N N 263 +LYS HE2 H N N 264 +LYS HE3 H N N 265 +LYS HZ1 H N N 266 +LYS HZ2 H N N 267 +LYS HZ3 H N N 268 +LYS HXT H N N 269 +MET N N N N 270 +MET CA C N S 271 +MET C C N N 272 +MET O O N N 273 +MET CB C N N 274 +MET CG C N N 275 +MET SD S N N 276 +MET CE C N N 277 +MET OXT O N N 278 +MET H H N N 279 +MET H2 H N N 280 +MET HA H N N 281 +MET HB2 H N N 282 +MET HB3 H N N 283 +MET HG2 H N N 284 +MET HG3 H N N 285 +MET HE1 H N N 286 +MET HE2 H N N 287 +MET HE3 H N N 288 +MET HXT H N N 289 +PHE N N N N 290 +PHE CA C N S 291 +PHE C C N N 292 +PHE O O N N 293 +PHE CB C N N 294 +PHE CG C Y N 295 +PHE CD1 C Y N 296 +PHE CD2 C Y N 297 +PHE CE1 C Y N 298 +PHE CE2 C Y N 299 +PHE CZ C Y N 300 +PHE OXT O N N 301 +PHE H H N N 302 +PHE H2 H N N 303 +PHE HA H N N 304 +PHE HB2 H N N 305 +PHE HB3 H N N 306 +PHE HD1 H N N 307 +PHE HD2 H N N 308 +PHE HE1 H N N 309 +PHE HE2 H N N 310 +PHE HZ H N N 311 +PHE HXT H N N 312 +PRO N N N N 313 +PRO CA C N S 314 +PRO C C N N 315 +PRO O O N N 316 +PRO CB C N N 317 +PRO CG C N N 318 +PRO CD C N N 319 +PRO OXT O N N 320 +PRO H H N N 321 +PRO HA H N N 322 +PRO HB2 H N N 323 +PRO HB3 H N N 324 +PRO HG2 H N N 325 +PRO HG3 H N N 326 +PRO HD2 H N N 327 +PRO HD3 H N N 328 +PRO HXT H N N 329 +SER N N N N 330 +SER CA C N S 331 +SER C C N N 332 +SER O O N N 333 +SER CB C N N 334 +SER OG O N N 335 +SER OXT O N N 336 +SER H H N N 337 +SER H2 H N N 338 +SER HA H N N 339 +SER HB2 H N N 340 +SER HB3 H N N 341 +SER HG H N N 342 +SER HXT H N N 343 +THR N N N N 344 +THR CA C N S 345 +THR C C N N 346 +THR O O N N 347 +THR CB C N R 348 +THR OG1 O N N 349 +THR CG2 C N N 350 +THR OXT O N N 351 +THR H H N N 352 +THR H2 H N N 353 +THR HA H N N 354 +THR HB H N N 355 +THR HG1 H N N 356 +THR HG21 H N N 357 +THR HG22 H N N 358 +THR HG23 H N N 359 +THR HXT H N N 360 +TRP N N N N 361 +TRP CA C N S 362 +TRP C C N N 363 +TRP O O N N 364 +TRP CB C N N 365 +TRP CG C Y N 366 +TRP CD1 C Y N 367 +TRP CD2 C Y N 368 +TRP NE1 N Y N 369 +TRP CE2 C Y N 370 +TRP CE3 C Y N 371 +TRP CZ2 C Y N 372 +TRP CZ3 C Y N 373 +TRP CH2 C Y N 374 +TRP OXT O N N 375 +TRP H H N N 376 +TRP H2 H N N 377 +TRP HA H N N 378 +TRP HB2 H N N 379 +TRP HB3 H N N 380 +TRP HD1 H N N 381 +TRP HE1 H N N 382 +TRP HE3 H N N 383 +TRP HZ2 H N N 384 +TRP HZ3 H N N 385 +TRP HH2 H N N 386 +TRP HXT H N N 387 +TYR N N N N 388 +TYR CA C N S 389 +TYR C C N N 390 +TYR O O N N 391 +TYR CB C N N 392 +TYR CG C Y N 393 +TYR CD1 C Y N 394 +TYR CD2 C Y N 395 +TYR CE1 C Y N 396 +TYR CE2 C Y N 397 +TYR CZ C Y N 398 +TYR OH O N N 399 +TYR OXT O N N 400 +TYR H H N N 401 +TYR H2 H N N 402 +TYR HA H N N 403 +TYR HB2 H N N 404 +TYR HB3 H N N 405 +TYR HD1 H N N 406 +TYR HD2 H N N 407 +TYR HE1 H N N 408 +TYR HE2 H N N 409 +TYR HH H N N 410 +TYR HXT H N N 411 +VAL N N N N 412 +VAL CA C N S 413 +VAL C C N N 414 +VAL O O N N 415 +VAL CB C N N 416 +VAL CG1 C N N 417 +VAL CG2 C N N 418 +VAL OXT O N N 419 +VAL H H N N 420 +VAL H2 H N N 421 +VAL HA H N N 422 +VAL HB H N N 423 +VAL HG11 H N N 424 +VAL HG12 H N N 425 +VAL HG13 H N N 426 +VAL HG21 H N N 427 +VAL HG22 H N N 428 +VAL HG23 H N N 429 +VAL HXT H N N 430 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CRO CG1 CB1 sing N N 70 +CRO OG1 CB1 sing N N 71 +CRO CB1 CA1 sing N N 72 +CRO N1 CA1 sing N N 73 +CRO OH CZ sing N N 74 +CRO CE1 CZ doub Y N 75 +CRO CE1 CD1 sing Y N 76 +CRO CA1 C1 sing N N 77 +CRO CZ CE2 sing Y N 78 +CRO CD1 CG2 doub Y N 79 +CRO N2 C1 doub N N 80 +CRO N2 CA2 sing N N 81 +CRO C1 N3 sing N N 82 +CRO CE2 CD2 doub Y N 83 +CRO CG2 CD2 sing Y N 84 +CRO CG2 CB2 sing N N 85 +CRO N3 CA3 sing N N 86 +CRO N3 C2 sing N N 87 +CRO CA2 CB2 doub N Z 88 +CRO CA2 C2 sing N N 89 +CRO CA3 C3 sing N N 90 +CRO OXT C3 sing N N 91 +CRO C3 O3 doub N N 92 +CRO C2 O2 doub N N 93 +CRO N1 H sing N N 94 +CRO N1 H2 sing N N 95 +CRO CA1 HA1 sing N N 96 +CRO CB1 HB1 sing N N 97 +CRO CG1 HG11 sing N N 98 +CRO CG1 HG12 sing N N 99 +CRO CG1 HG13 sing N N 100 +CRO OG1 HOG1 sing N N 101 +CRO CA3 HA31 sing N N 102 +CRO CA3 HA32 sing N N 103 +CRO OXT HXT sing N N 104 +CRO CB2 HB2 sing N N 105 +CRO CD1 HD1 sing N N 106 +CRO CD2 HD2 sing N N 107 +CRO CE1 HE1 sing N N 108 +CRO CE2 HE2 sing N N 109 +CRO OH HOH sing N N 110 +CYS N CA sing N N 111 +CYS N H sing N N 112 +CYS N H2 sing N N 113 +CYS CA C sing N N 114 +CYS CA CB sing N N 115 +CYS CA HA sing N N 116 +CYS C O doub N N 117 +CYS C OXT sing N N 118 +CYS CB SG sing N N 119 +CYS CB HB2 sing N N 120 +CYS CB HB3 sing N N 121 +CYS SG HG sing N N 122 +CYS OXT HXT sing N N 123 +GLN N CA sing N N 124 +GLN N H sing N N 125 +GLN N H2 sing N N 126 +GLN CA C sing N N 127 +GLN CA CB sing N N 128 +GLN CA HA sing N N 129 +GLN C O doub N N 130 +GLN C OXT sing N N 131 +GLN CB CG sing N N 132 +GLN CB HB2 sing N N 133 +GLN CB HB3 sing N N 134 +GLN CG CD sing N N 135 +GLN CG HG2 sing N N 136 +GLN CG HG3 sing N N 137 +GLN CD OE1 doub N N 138 +GLN CD NE2 sing N N 139 +GLN NE2 HE21 sing N N 140 +GLN NE2 HE22 sing N N 141 +GLN OXT HXT sing N N 142 +GLU N CA sing N N 143 +GLU N H sing N N 144 +GLU N H2 sing N N 145 +GLU CA C sing N N 146 +GLU CA CB sing N N 147 +GLU CA HA sing N N 148 +GLU C O doub N N 149 +GLU C OXT sing N N 150 +GLU CB CG sing N N 151 +GLU CB HB2 sing N N 152 +GLU CB HB3 sing N N 153 +GLU CG CD sing N N 154 +GLU CG HG2 sing N N 155 +GLU CG HG3 sing N N 156 +GLU CD OE1 doub N N 157 +GLU CD OE2 sing N N 158 +GLU OE2 HE2 sing N N 159 +GLU OXT HXT sing N N 160 +GLY N CA sing N N 161 +GLY N H sing N N 162 +GLY N H2 sing N N 163 +GLY CA C sing N N 164 +GLY CA HA2 sing N N 165 +GLY CA HA3 sing N N 166 +GLY C O doub N N 167 +GLY C OXT sing N N 168 +GLY OXT HXT sing N N 169 +HIS N CA sing N N 170 +HIS N H sing N N 171 +HIS N H2 sing N N 172 +HIS CA C sing N N 173 +HIS CA CB sing N N 174 +HIS CA HA sing N N 175 +HIS C O doub N N 176 +HIS C OXT sing N N 177 +HIS CB CG sing N N 178 +HIS CB HB2 sing N N 179 +HIS CB HB3 sing N N 180 +HIS CG ND1 sing Y N 181 +HIS CG CD2 doub Y N 182 +HIS ND1 CE1 doub Y N 183 +HIS ND1 HD1 sing N N 184 +HIS CD2 NE2 sing Y N 185 +HIS CD2 HD2 sing N N 186 +HIS CE1 NE2 sing Y N 187 +HIS CE1 HE1 sing N N 188 +HIS NE2 HE2 sing N N 189 +HIS OXT HXT sing N N 190 +HOH O H1 sing N N 191 +HOH O H2 sing N N 192 +ILE N CA sing N N 193 +ILE N H sing N N 194 +ILE N H2 sing N N 195 +ILE CA C sing N N 196 +ILE CA CB sing N N 197 +ILE CA HA sing N N 198 +ILE C O doub N N 199 +ILE C OXT sing N N 200 +ILE CB CG1 sing N N 201 +ILE CB CG2 sing N N 202 +ILE CB HB sing N N 203 +ILE CG1 CD1 sing N N 204 +ILE CG1 HG12 sing N N 205 +ILE CG1 HG13 sing N N 206 +ILE CG2 HG21 sing N N 207 +ILE CG2 HG22 sing N N 208 +ILE CG2 HG23 sing N N 209 +ILE CD1 HD11 sing N N 210 +ILE CD1 HD12 sing N N 211 +ILE CD1 HD13 sing N N 212 +ILE OXT HXT sing N N 213 +LEU N CA sing N N 214 +LEU N H sing N N 215 +LEU N H2 sing N N 216 +LEU CA C sing N N 217 +LEU CA CB sing N N 218 +LEU CA HA sing N N 219 +LEU C O doub N N 220 +LEU C OXT sing N N 221 +LEU CB CG sing N N 222 +LEU CB HB2 sing N N 223 +LEU CB HB3 sing N N 224 +LEU CG CD1 sing N N 225 +LEU CG CD2 sing N N 226 +LEU CG HG sing N N 227 +LEU CD1 HD11 sing N N 228 +LEU CD1 HD12 sing N N 229 +LEU CD1 HD13 sing N N 230 +LEU CD2 HD21 sing N N 231 +LEU CD2 HD22 sing N N 232 +LEU CD2 HD23 sing N N 233 +LEU OXT HXT sing N N 234 +LYS N CA sing N N 235 +LYS N H sing N N 236 +LYS N H2 sing N N 237 +LYS CA C sing N N 238 +LYS CA CB sing N N 239 +LYS CA HA sing N N 240 +LYS C O doub N N 241 +LYS C OXT sing N N 242 +LYS CB CG sing N N 243 +LYS CB HB2 sing N N 244 +LYS CB HB3 sing N N 245 +LYS CG CD sing N N 246 +LYS CG HG2 sing N N 247 +LYS CG HG3 sing N N 248 +LYS CD CE sing N N 249 +LYS CD HD2 sing N N 250 +LYS CD HD3 sing N N 251 +LYS CE NZ sing N N 252 +LYS CE HE2 sing N N 253 +LYS CE HE3 sing N N 254 +LYS NZ HZ1 sing N N 255 +LYS NZ HZ2 sing N N 256 +LYS NZ HZ3 sing N N 257 +LYS OXT HXT sing N N 258 +MET N CA sing N N 259 +MET N H sing N N 260 +MET N H2 sing N N 261 +MET CA C sing N N 262 +MET CA CB sing N N 263 +MET CA HA sing N N 264 +MET C O doub N N 265 +MET C OXT sing N N 266 +MET CB CG sing N N 267 +MET CB HB2 sing N N 268 +MET CB HB3 sing N N 269 +MET CG SD sing N N 270 +MET CG HG2 sing N N 271 +MET CG HG3 sing N N 272 +MET SD CE sing N N 273 +MET CE HE1 sing N N 274 +MET CE HE2 sing N N 275 +MET CE HE3 sing N N 276 +MET OXT HXT sing N N 277 +PHE N CA sing N N 278 +PHE N H sing N N 279 +PHE N H2 sing N N 280 +PHE CA C sing N N 281 +PHE CA CB sing N N 282 +PHE CA HA sing N N 283 +PHE C O doub N N 284 +PHE C OXT sing N N 285 +PHE CB CG sing N N 286 +PHE CB HB2 sing N N 287 +PHE CB HB3 sing N N 288 +PHE CG CD1 doub Y N 289 +PHE CG CD2 sing Y N 290 +PHE CD1 CE1 sing Y N 291 +PHE CD1 HD1 sing N N 292 +PHE CD2 CE2 doub Y N 293 +PHE CD2 HD2 sing N N 294 +PHE CE1 CZ doub Y N 295 +PHE CE1 HE1 sing N N 296 +PHE CE2 CZ sing Y N 297 +PHE CE2 HE2 sing N N 298 +PHE CZ HZ sing N N 299 +PHE OXT HXT sing N N 300 +PRO N CA sing N N 301 +PRO N CD sing N N 302 +PRO N H sing N N 303 +PRO CA C sing N N 304 +PRO CA CB sing N N 305 +PRO CA HA sing N N 306 +PRO C O doub N N 307 +PRO C OXT sing N N 308 +PRO CB CG sing N N 309 +PRO CB HB2 sing N N 310 +PRO CB HB3 sing N N 311 +PRO CG CD sing N N 312 +PRO CG HG2 sing N N 313 +PRO CG HG3 sing N N 314 +PRO CD HD2 sing N N 315 +PRO CD HD3 sing N N 316 +PRO OXT HXT sing N N 317 +SER N CA sing N N 318 +SER N H sing N N 319 +SER N H2 sing N N 320 +SER CA C sing N N 321 +SER CA CB sing N N 322 +SER CA HA sing N N 323 +SER C O doub N N 324 +SER C OXT sing N N 325 +SER CB OG sing N N 326 +SER CB HB2 sing N N 327 +SER CB HB3 sing N N 328 +SER OG HG sing N N 329 +SER OXT HXT sing N N 330 +THR N CA sing N N 331 +THR N H sing N N 332 +THR N H2 sing N N 333 +THR CA C sing N N 334 +THR CA CB sing N N 335 +THR CA HA sing N N 336 +THR C O doub N N 337 +THR C OXT sing N N 338 +THR CB OG1 sing N N 339 +THR CB CG2 sing N N 340 +THR CB HB sing N N 341 +THR OG1 HG1 sing N N 342 +THR CG2 HG21 sing N N 343 +THR CG2 HG22 sing N N 344 +THR CG2 HG23 sing N N 345 +THR OXT HXT sing N N 346 +TRP N CA sing N N 347 +TRP N H sing N N 348 +TRP N H2 sing N N 349 +TRP CA C sing N N 350 +TRP CA CB sing N N 351 +TRP CA HA sing N N 352 +TRP C O doub N N 353 +TRP C OXT sing N N 354 +TRP CB CG sing N N 355 +TRP CB HB2 sing N N 356 +TRP CB HB3 sing N N 357 +TRP CG CD1 doub Y N 358 +TRP CG CD2 sing Y N 359 +TRP CD1 NE1 sing Y N 360 +TRP CD1 HD1 sing N N 361 +TRP CD2 CE2 doub Y N 362 +TRP CD2 CE3 sing Y N 363 +TRP NE1 CE2 sing Y N 364 +TRP NE1 HE1 sing N N 365 +TRP CE2 CZ2 sing Y N 366 +TRP CE3 CZ3 doub Y N 367 +TRP CE3 HE3 sing N N 368 +TRP CZ2 CH2 doub Y N 369 +TRP CZ2 HZ2 sing N N 370 +TRP CZ3 CH2 sing Y N 371 +TRP CZ3 HZ3 sing N N 372 +TRP CH2 HH2 sing N N 373 +TRP OXT HXT sing N N 374 +TYR N CA sing N N 375 +TYR N H sing N N 376 +TYR N H2 sing N N 377 +TYR CA C sing N N 378 +TYR CA CB sing N N 379 +TYR CA HA sing N N 380 +TYR C O doub N N 381 +TYR C OXT sing N N 382 +TYR CB CG sing N N 383 +TYR CB HB2 sing N N 384 +TYR CB HB3 sing N N 385 +TYR CG CD1 doub Y N 386 +TYR CG CD2 sing Y N 387 +TYR CD1 CE1 sing Y N 388 +TYR CD1 HD1 sing N N 389 +TYR CD2 CE2 doub Y N 390 +TYR CD2 HD2 sing N N 391 +TYR CE1 CZ doub Y N 392 +TYR CE1 HE1 sing N N 393 +TYR CE2 CZ sing Y N 394 +TYR CE2 HE2 sing N N 395 +TYR CZ OH sing N N 396 +TYR OH HH sing N N 397 +TYR OXT HXT sing N N 398 +VAL N CA sing N N 399 +VAL N H sing N N 400 +VAL N H2 sing N N 401 +VAL CA C sing N N 402 +VAL CA CB sing N N 403 +VAL CA HA sing N N 404 +VAL C O doub N N 405 +VAL C OXT sing N N 406 +VAL CB CG1 sing N N 407 +VAL CB CG2 sing N N 408 +VAL CB HB sing N N 409 +VAL CG1 HG11 sing N N 410 +VAL CG1 HG12 sing N N 411 +VAL CG1 HG13 sing N N 412 +VAL CG2 HG21 sing N N 413 +VAL CG2 HG22 sing N N 414 +VAL CG2 HG23 sing N N 415 +VAL OXT HXT sing N N 416 +# +_atom_sites.entry_id 4KW4 +_atom_sites.fract_transf_matrix[1][1] 0.013717 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.013717 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.008774 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +H +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . SER A 1 5 ? -5.112 18.146 9.119 1.00 46.40 ? 2 SER A N 1 +ATOM 2 C CA . SER A 1 5 ? -4.513 18.180 10.455 1.00 46.93 ? 2 SER A CA 1 +ATOM 3 C C . SER A 1 5 ? -5.223 19.209 11.341 1.00 47.15 ? 2 SER A C 1 +ATOM 4 O O . SER A 1 5 ? -5.829 20.157 10.842 1.00 47.19 ? 2 SER A O 1 +ATOM 5 C CB . SER A 1 5 ? -3.006 18.498 10.372 1.00 36.38 ? 2 SER A CB 1 +ATOM 6 O OG . SER A 1 5 ? -2.785 19.868 10.093 1.00 25.89 ? 2 SER A OG 1 +ATOM 7 H HA . SER A 1 5 ? -4.613 17.308 10.868 1.00 56.32 ? 2 SER A HA 1 +ATOM 8 H HB2 . SER A 1 5 ? -2.591 18.279 11.222 1.00 43.65 ? 2 SER A HB2 1 +ATOM 9 H HB3 . SER A 1 5 ? -2.610 17.965 9.665 1.00 43.65 ? 2 SER A HB3 1 +ATOM 10 H HG . SER A 1 5 ? -1.961 20.024 10.051 1.00 31.07 ? 2 SER A HG 1 +ATOM 11 N N . LYS A 1 6 ? -5.149 19.014 12.655 1.00 44.41 ? 3 LYS A N 1 +ATOM 12 C CA . LYS A 1 6 ? -5.696 19.981 13.600 1.00 39.63 ? 3 LYS A CA 1 +ATOM 13 C C . LYS A 1 6 ? -5.092 21.382 13.346 1.00 22.64 ? 3 LYS A C 1 +ATOM 14 O O . LYS A 1 6 ? -5.801 22.379 13.343 1.00 24.47 ? 3 LYS A O 1 +ATOM 15 C CB . LYS A 1 6 ? -5.431 19.502 15.036 1.00 42.61 ? 3 LYS A CB 1 +ATOM 16 C CG . LYS A 1 6 ? -5.221 20.607 16.054 1.00 40.19 ? 3 LYS A CG 1 +ATOM 17 H H . LYS A 1 6 ? -4.785 18.328 13.026 1.00 53.29 ? 3 LYS A H 1 +ATOM 18 H HA . LYS A 1 6 ? -6.656 20.039 13.474 1.00 47.56 ? 3 LYS A HA 1 +ATOM 19 H HB2 . LYS A 1 6 ? -6.189 18.974 15.329 1.00 51.13 ? 3 LYS A HB2 1 +ATOM 20 H HB3 . LYS A 1 6 ? -4.632 18.951 15.034 1.00 51.13 ? 3 LYS A HB3 1 +ATOM 21 N N . GLY A 1 7 ? -3.784 21.447 13.110 1.00 22.73 ? 4 GLY A N 1 +ATOM 22 C CA . GLY A 1 7 ? -3.152 22.729 12.830 1.00 21.03 ? 4 GLY A CA 1 +ATOM 23 C C . GLY A 1 7 ? -3.779 23.455 11.639 1.00 22.73 ? 4 GLY A C 1 +ATOM 24 O O . GLY A 1 7 ? -3.896 24.685 11.625 1.00 18.50 ? 4 GLY A O 1 +ATOM 25 H H . GLY A 1 7 ? -3.248 20.774 13.106 1.00 27.28 ? 4 GLY A H 1 +ATOM 26 H HA2 . GLY A 1 7 ? -3.227 23.301 13.610 1.00 25.23 ? 4 GLY A HA2 1 +ATOM 27 H HA3 . GLY A 1 7 ? -2.211 22.590 12.642 1.00 25.23 ? 4 GLY A HA3 1 +ATOM 28 N N . GLU A 1 8 ? -4.204 22.678 10.648 1.00 26.98 ? 5 GLU A N 1 +ATOM 29 C CA . GLU A 1 8 ? -4.779 23.224 9.416 1.00 27.97 ? 5 GLU A CA 1 +ATOM 30 C C . GLU A 1 8 ? -6.006 24.083 9.704 1.00 26.00 ? 5 GLU A C 1 +ATOM 31 O O . GLU A 1 8 ? -6.292 25.051 8.993 1.00 22.42 ? 5 GLU A O 1 +ATOM 32 C CB . GLU A 1 8 ? -5.157 22.070 8.479 1.00 39.76 ? 5 GLU A CB 1 +ATOM 33 C CG . GLU A 1 8 ? -5.678 22.501 7.133 1.00 44.07 ? 5 GLU A CG 1 +ATOM 34 H H . GLU A 1 8 ? -4.172 21.818 10.663 1.00 32.37 ? 5 GLU A H 1 +ATOM 35 H HA . GLU A 1 8 ? -4.118 23.776 8.970 1.00 33.56 ? 5 GLU A HA 1 +ATOM 36 H HB2 . GLU A 1 8 ? -4.370 21.524 8.328 1.00 47.71 ? 5 GLU A HB2 1 +ATOM 37 H HB3 . GLU A 1 8 ? -5.847 21.538 8.905 1.00 47.71 ? 5 GLU A HB3 1 +ATOM 38 H HG2 . GLU A 1 8 ? -6.074 21.735 6.688 1.00 52.88 ? 5 GLU A HG2 1 +ATOM 39 H HG3 . GLU A 1 8 ? -6.346 23.192 7.260 1.00 52.88 ? 5 GLU A HG3 1 +ATOM 40 N N . GLU A 1 9 ? -6.744 23.732 10.751 1.00 19.28 ? 6 GLU A N 1 +ATOM 41 C CA . GLU A 1 9 ? -7.976 24.448 11.066 1.00 18.23 ? 6 GLU A CA 1 +ATOM 42 C C . GLU A 1 9 ? -7.686 25.906 11.418 1.00 20.81 ? 6 GLU A C 1 +ATOM 43 O O . GLU A 1 9 ? -8.556 26.781 11.285 1.00 24.77 ? 6 GLU A O 1 +ATOM 44 C CB . GLU A 1 9 ? -8.708 23.737 12.221 1.00 19.06 ? 6 GLU A CB 1 +ATOM 45 C CG . GLU A 1 9 ? -8.909 22.242 11.972 1.00 27.45 ? 6 GLU A CG 1 +ATOM 46 H H . GLU A 1 9 ? -6.557 23.089 11.290 1.00 23.13 ? 6 GLU A H 1 +ATOM 47 H HA . GLU A 1 9 ? -8.557 24.437 10.289 1.00 21.87 ? 6 GLU A HA 1 +ATOM 48 H HB2 . GLU A 1 9 ? -8.188 23.837 13.034 1.00 22.87 ? 6 GLU A HB2 1 +ATOM 49 H HB3 . GLU A 1 9 ? -9.583 24.140 12.336 1.00 22.87 ? 6 GLU A HB3 1 +ATOM 50 N N . LEU A 1 10 ? -6.459 26.181 11.851 1.00 18.92 ? 7 LEU A N 1 +ATOM 51 C CA . LEU A 1 10 ? -6.078 27.546 12.215 1.00 15.87 ? 7 LEU A CA 1 +ATOM 52 C C . LEU A 1 10 ? -5.914 28.481 10.998 1.00 15.26 ? 7 LEU A C 1 +ATOM 53 O O . LEU A 1 10 ? -5.780 29.692 11.166 1.00 18.66 ? 7 LEU A O 1 +ATOM 54 C CB . LEU A 1 10 ? -4.777 27.547 13.019 1.00 15.99 ? 7 LEU A CB 1 +ATOM 55 C CG . LEU A 1 10 ? -4.761 26.694 14.297 1.00 19.60 ? 7 LEU A CG 1 +ATOM 56 C CD1 . LEU A 1 10 ? -3.339 26.613 14.843 1.00 20.58 ? 7 LEU A CD1 1 +ATOM 57 C CD2 . LEU A 1 10 ? -5.704 27.238 15.360 1.00 25.52 ? 7 LEU A CD2 1 +ATOM 58 H H . LEU A 1 10 ? -5.831 25.600 11.943 1.00 22.70 ? 7 LEU A H 1 +ATOM 59 H HA . LEU A 1 10 ? -6.773 27.919 12.780 1.00 19.04 ? 7 LEU A HA 1 +ATOM 60 H HB2 . LEU A 1 10 ? -4.066 27.219 12.446 1.00 19.18 ? 7 LEU A HB2 1 +ATOM 61 H HB3 . LEU A 1 10 ? -4.582 28.460 13.280 1.00 19.18 ? 7 LEU A HB3 1 +ATOM 62 H HG . LEU A 1 10 ? -5.047 25.794 14.077 1.00 23.52 ? 7 LEU A HG 1 +ATOM 63 H HD11 . LEU A 1 10 ? -3.341 26.073 15.648 1.00 24.70 ? 7 LEU A HD11 1 +ATOM 64 H HD12 . LEU A 1 10 ? -2.767 26.207 14.173 1.00 24.70 ? 7 LEU A HD12 1 +ATOM 65 H HD13 . LEU A 1 10 ? -3.028 27.509 15.045 1.00 24.70 ? 7 LEU A HD13 1 +ATOM 66 H HD21 . LEU A 1 10 ? -5.658 26.668 16.143 1.00 30.63 ? 7 LEU A HD21 1 +ATOM 67 H HD22 . LEU A 1 10 ? -5.433 28.140 15.590 1.00 30.63 ? 7 LEU A HD22 1 +ATOM 68 H HD23 . LEU A 1 10 ? -6.607 27.244 15.007 1.00 30.63 ? 7 LEU A HD23 1 +ATOM 69 N N . PHE A 1 11 ? -5.933 27.930 9.787 1.00 15.59 ? 8 PHE A N 1 +ATOM 70 C CA . PHE A 1 11 ? -5.649 28.735 8.587 1.00 15.43 ? 8 PHE A CA 1 +ATOM 71 C C . PHE A 1 11 ? -6.845 28.861 7.651 1.00 17.31 ? 8 PHE A C 1 +ATOM 72 O O . PHE A 1 11 ? -6.705 29.257 6.498 1.00 21.14 ? 8 PHE A O 1 +ATOM 73 C CB . PHE A 1 11 ? -4.455 28.144 7.825 1.00 15.83 ? 8 PHE A CB 1 +ATOM 74 C CG . PHE A 1 11 ? -3.159 28.224 8.591 1.00 15.48 ? 8 PHE A CG 1 +ATOM 75 C CD1 . PHE A 1 11 ? -2.281 29.264 8.384 1.00 15.00 ? 8 PHE A CD1 1 +ATOM 76 C CD2 . PHE A 1 11 ? -2.843 27.253 9.557 1.00 15.89 ? 8 PHE A CD2 1 +ATOM 77 C CE1 . PHE A 1 11 ? -1.068 29.344 9.124 1.00 15.80 ? 8 PHE A CE1 1 +ATOM 78 C CE2 . PHE A 1 11 ? -1.654 27.324 10.284 1.00 15.83 ? 8 PHE A CE2 1 +ATOM 79 C CZ . PHE A 1 11 ? -0.772 28.360 10.073 1.00 15.23 ? 8 PHE A CZ 1 +ATOM 80 H H . PHE A 1 11 ? -6.106 27.103 9.627 1.00 18.71 ? 8 PHE A H 1 +ATOM 81 H HA . PHE A 1 11 ? -5.402 29.630 8.869 1.00 18.51 ? 8 PHE A HA 1 +ATOM 82 H HB2 . PHE A 1 11 ? -4.634 27.209 7.638 1.00 19.00 ? 8 PHE A HB2 1 +ATOM 83 H HB3 . PHE A 1 11 ? -4.341 28.632 6.995 1.00 19.00 ? 8 PHE A HB3 1 +ATOM 84 H HD1 . PHE A 1 11 ? -2.480 29.917 7.754 1.00 18.00 ? 8 PHE A HD1 1 +ATOM 85 H HD2 . PHE A 1 11 ? -3.432 26.549 9.709 1.00 19.07 ? 8 PHE A HD2 1 +ATOM 86 H HE1 . PHE A 1 11 ? -0.475 30.045 8.975 1.00 18.96 ? 8 PHE A HE1 1 +ATOM 87 H HE2 . PHE A 1 11 ? -1.457 26.670 10.915 1.00 18.99 ? 8 PHE A HE2 1 +ATOM 88 H HZ . PHE A 1 11 ? 0.020 28.404 10.557 1.00 18.27 ? 8 PHE A HZ 1 +ATOM 89 N N . THR A 1 12 ? -8.035 28.552 8.145 1.00 21.85 ? 9 THR A N 1 +ATOM 90 C CA . THR A 1 12 ? -9.191 28.522 7.246 1.00 27.23 ? 9 THR A CA 1 +ATOM 91 C C . THR A 1 12 ? -9.616 29.918 6.795 1.00 28.84 ? 9 THR A C 1 +ATOM 92 O O . THR A 1 12 ? -10.287 30.050 5.783 1.00 27.58 ? 9 THR A O 1 +ATOM 93 C CB . THR A 1 12 ? -10.382 27.805 7.883 1.00 26.11 ? 9 THR A CB 1 +ATOM 94 O OG1 . THR A 1 12 ? -10.595 28.317 9.195 1.00 23.82 ? 9 THR A OG1 1 +ATOM 95 C CG2 . THR A 1 12 ? -10.106 26.317 7.962 1.00 35.34 ? 9 THR A CG2 1 +ATOM 96 H H . THR A 1 12 ? -8.202 28.361 8.967 1.00 26.22 ? 9 THR A H 1 +ATOM 97 H HA . THR A 1 12 ? -8.945 28.023 6.451 1.00 32.68 ? 9 THR A HA 1 +ATOM 98 H HB . THR A 1 12 ? -11.175 27.947 7.344 1.00 31.34 ? 9 THR A HB 1 +ATOM 99 H HG1 . THR A 1 12 ? -10.754 29.141 9.159 1.00 28.59 ? 9 THR A HG1 1 +ATOM 100 H HG21 . THR A 1 12 ? -10.861 25.861 8.365 1.00 42.41 ? 9 THR A HG21 1 +ATOM 101 H HG22 . THR A 1 12 ? -9.961 25.959 7.072 1.00 42.41 ? 9 THR A HG22 1 +ATOM 102 H HG23 . THR A 1 12 ? -9.315 26.154 8.500 1.00 42.41 ? 9 THR A HG23 1 +ATOM 103 N N . GLY A 1 13 ? -9.230 30.943 7.545 1.00 23.64 ? 10 GLY A N 1 +ATOM 104 C CA . GLY A 1 13 ? -9.578 32.310 7.199 1.00 25.42 ? 10 GLY A CA 1 +ATOM 105 C C . GLY A 1 13 ? -8.340 33.182 7.076 1.00 26.09 ? 10 GLY A C 1 +ATOM 106 O O . GLY A 1 13 ? -7.225 32.685 6.866 1.00 19.90 ? 10 GLY A O 1 +ATOM 107 H H . GLY A 1 13 ? -8.763 30.871 8.264 1.00 28.37 ? 10 GLY A H 1 +ATOM 108 H HA2 . GLY A 1 13 ? -10.052 32.322 6.353 1.00 30.51 ? 10 GLY A HA2 1 +ATOM 109 H HA3 . GLY A 1 13 ? -10.154 32.684 7.884 1.00 30.51 ? 10 GLY A HA3 1 +ATOM 110 N N . VAL A 1 14 ? -8.536 34.487 7.218 1.00 17.94 ? 11 VAL A N 1 +ATOM 111 C CA . VAL A 1 14 ? -7.437 35.444 7.112 1.00 21.14 ? 11 VAL A CA 1 +ATOM 112 C C . VAL A 1 14 ? -6.775 35.535 8.492 1.00 22.02 ? 11 VAL A C 1 +ATOM 113 O O . VAL A 1 14 ? -7.463 35.711 9.478 1.00 16.51 ? 11 VAL A O 1 +ATOM 114 C CB . VAL A 1 14 ? -7.946 36.824 6.695 1.00 21.80 ? 11 VAL A CB 1 +ATOM 115 C CG1 . VAL A 1 14 ? -6.808 37.853 6.705 1.00 19.85 ? 11 VAL A CG1 1 +ATOM 116 C CG2 . VAL A 1 14 ? -8.580 36.774 5.296 1.00 24.91 ? 11 VAL A CG2 1 +ATOM 117 H H . VAL A 1 14 ? -9.300 34.848 7.377 1.00 21.52 ? 11 VAL A H 1 +ATOM 118 H HA . VAL A 1 14 ? -6.784 35.135 6.465 1.00 25.37 ? 11 VAL A HA 1 +ATOM 119 H HB . VAL A 1 14 ? -8.623 37.117 7.324 1.00 26.16 ? 11 VAL A HB 1 +ATOM 120 H HG11 . VAL A 1 14 ? -7.161 38.715 6.437 1.00 23.82 ? 11 VAL A HG11 1 +ATOM 121 H HG12 . VAL A 1 14 ? -6.441 37.909 7.601 1.00 23.82 ? 11 VAL A HG12 1 +ATOM 122 H HG13 . VAL A 1 14 ? -6.121 37.568 6.082 1.00 23.82 ? 11 VAL A HG13 1 +ATOM 123 H HG21 . VAL A 1 14 ? -8.893 37.662 5.060 1.00 29.90 ? 11 VAL A HG21 1 +ATOM 124 H HG22 . VAL A 1 14 ? -7.913 36.477 4.658 1.00 29.90 ? 11 VAL A HG22 1 +ATOM 125 H HG23 . VAL A 1 14 ? -9.326 36.154 5.310 1.00 29.90 ? 11 VAL A HG23 1 +ATOM 126 N N . VAL A 1 15 ? -5.458 35.399 8.539 1.00 15.48 ? 12 VAL A N 1 +ATOM 127 C CA . VAL A 1 15 ? -4.697 35.315 9.779 1.00 16.91 ? 12 VAL A CA 1 +ATOM 128 C C . VAL A 1 15 ? -3.711 36.468 9.818 1.00 15.31 ? 12 VAL A C 1 +ATOM 129 O O . VAL A 1 15 ? -2.975 36.692 8.855 1.00 15.45 ? 12 VAL A O 1 +ATOM 130 C CB . VAL A 1 15 ? -3.885 33.996 9.836 1.00 14.40 ? 12 VAL A CB 1 +ATOM 131 C CG1 . VAL A 1 15 ? -3.001 33.951 11.068 1.00 14.23 ? 12 VAL A CG1 1 +ATOM 132 C CG2 . VAL A 1 15 ? -4.839 32.773 9.809 1.00 14.82 ? 12 VAL A CG2 1 +ATOM 133 H H . VAL A 1 15 ? -4.963 35.352 7.838 1.00 18.57 ? 12 VAL A H 1 +ATOM 134 H HA . VAL A 1 15 ? -5.288 35.367 10.546 1.00 20.30 ? 12 VAL A HA 1 +ATOM 135 H HB . VAL A 1 15 ? -3.312 33.946 9.055 1.00 17.28 ? 12 VAL A HB 1 +ATOM 136 H HG11 . VAL A 1 15 ? -2.508 33.116 11.073 1.00 17.07 ? 12 VAL A HG11 1 +ATOM 137 H HG12 . VAL A 1 15 ? -2.384 34.699 11.041 1.00 17.07 ? 12 VAL A HG12 1 +ATOM 138 H HG13 . VAL A 1 15 ? -3.559 34.011 11.859 1.00 17.07 ? 12 VAL A HG13 1 +ATOM 139 H HG21 . VAL A 1 15 ? -4.310 31.961 9.845 1.00 17.78 ? 12 VAL A HG21 1 +ATOM 140 H HG22 . VAL A 1 15 ? -5.431 32.818 10.576 1.00 17.78 ? 12 VAL A HG22 1 +ATOM 141 H HG23 . VAL A 1 15 ? -5.357 32.795 8.989 1.00 17.78 ? 12 VAL A HG23 1 +ATOM 142 N N . PRO A 1 16 ? -3.681 37.219 10.923 1.00 15.72 ? 13 PRO A N 1 +ATOM 143 C CA . PRO A 1 16 ? -2.708 38.298 10.989 1.00 16.25 ? 13 PRO A CA 1 +ATOM 144 C C . PRO A 1 16 ? -1.299 37.756 11.229 1.00 15.61 ? 13 PRO A C 1 +ATOM 145 O O . PRO A 1 16 ? -1.111 36.719 11.876 1.00 15.58 ? 13 PRO A O 1 +ATOM 146 C CB . PRO A 1 16 ? -3.202 39.136 12.186 1.00 17.21 ? 13 PRO A CB 1 +ATOM 147 C CG . PRO A 1 16 ? -4.054 38.273 12.954 1.00 23.20 ? 13 PRO A CG 1 +ATOM 148 C CD . PRO A 1 16 ? -4.620 37.248 12.058 1.00 16.09 ? 13 PRO A CD 1 +ATOM 149 H HA . PRO A 1 16 ? -2.727 38.833 10.180 1.00 19.50 ? 13 PRO A HA 1 +ATOM 150 H HB2 . PRO A 1 16 ? -2.442 39.423 12.715 1.00 20.66 ? 13 PRO A HB2 1 +ATOM 151 H HB3 . PRO A 1 16 ? -3.700 39.902 11.860 1.00 20.66 ? 13 PRO A HB3 1 +ATOM 152 H HG2 . PRO A 1 16 ? -3.529 37.851 13.652 1.00 27.84 ? 13 PRO A HG2 1 +ATOM 153 H HG3 . PRO A 1 16 ? -4.766 38.801 13.347 1.00 27.84 ? 13 PRO A HG3 1 +ATOM 154 H HD2 . PRO A 1 16 ? -4.639 36.386 12.501 1.00 19.31 ? 13 PRO A HD2 1 +ATOM 155 H HD3 . PRO A 1 16 ? -5.503 37.513 11.758 1.00 19.31 ? 13 PRO A HD3 1 +ATOM 156 N N . ILE A 1 17 ? -0.317 38.474 10.707 1.00 15.91 ? 14 ILE A N 1 +ATOM 157 C CA . ILE A 1 17 ? 1.062 38.055 10.753 1.00 15.46 ? 14 ILE A CA 1 +ATOM 158 C C . ILE A 1 17 ? 1.929 39.182 11.312 1.00 16.23 ? 14 ILE A C 1 +ATOM 159 O O . ILE A 1 17 ? 1.740 40.343 10.960 1.00 17.19 ? 14 ILE A O 1 +ATOM 160 C CB . ILE A 1 17 ? 1.584 37.742 9.323 1.00 15.25 ? 14 ILE A CB 1 +ATOM 161 C CG1 . ILE A 1 17 ? 0.793 36.587 8.710 1.00 14.81 ? 14 ILE A CG1 1 +ATOM 162 C CG2 . ILE A 1 17 ? 3.084 37.397 9.343 1.00 14.98 ? 14 ILE A CG2 1 +ATOM 163 C CD1 . ILE A 1 17 ? 1.087 36.367 7.221 1.00 15.12 ? 14 ILE A CD1 1 +ATOM 164 H H . ILE A 1 17 ? -0.434 39.229 10.311 1.00 19.09 ? 14 ILE A H 1 +ATOM 165 H HA . ILE A 1 17 ? 1.158 37.267 11.311 1.00 18.55 ? 14 ILE A HA 1 +ATOM 166 H HB . ILE A 1 17 ? 1.457 38.529 8.770 1.00 18.30 ? 14 ILE A HB 1 +ATOM 167 H HG12 . ILE A 1 17 ? 1.015 35.769 9.182 1.00 17.77 ? 14 ILE A HG12 1 +ATOM 168 H HG13 . ILE A 1 17 ? -0.155 36.773 8.802 1.00 17.77 ? 14 ILE A HG13 1 +ATOM 169 H HG21 . ILE A 1 17 ? 3.377 37.207 8.438 1.00 17.98 ? 14 ILE A HG21 1 +ATOM 170 H HG22 . ILE A 1 17 ? 3.577 38.153 9.699 1.00 17.98 ? 14 ILE A HG22 1 +ATOM 171 H HG23 . ILE A 1 17 ? 3.221 36.618 9.905 1.00 17.98 ? 14 ILE A HG23 1 +ATOM 172 H HD11 . ILE A 1 17 ? 0.553 35.623 6.901 1.00 18.14 ? 14 ILE A HD11 1 +ATOM 173 H HD12 . ILE A 1 17 ? 0.859 37.173 6.732 1.00 18.14 ? 14 ILE A HD12 1 +ATOM 174 H HD13 . ILE A 1 17 ? 2.030 36.169 7.112 1.00 18.14 ? 14 ILE A HD13 1 +ATOM 175 N N . LEU A 1 18 ? 2.889 38.813 12.151 1.00 16.08 ? 15 LEU A N 1 +ATOM 176 C CA . LEU A 1 18 ? 3.971 39.699 12.575 1.00 16.84 ? 15 LEU A CA 1 +ATOM 177 C C . LEU A 1 18 ? 5.297 39.050 12.273 1.00 16.30 ? 15 LEU A C 1 +ATOM 178 O O . LEU A 1 18 ? 5.497 37.869 12.550 1.00 15.70 ? 15 LEU A O 1 +ATOM 179 C CB . LEU A 1 18 ? 3.901 39.970 14.092 1.00 17.71 ? 15 LEU A CB 1 +ATOM 180 C CG . LEU A 1 18 ? 2.725 40.790 14.579 1.00 18.74 ? 15 LEU A CG 1 +ATOM 181 C CD1 . LEU A 1 18 ? 2.729 40.816 16.144 1.00 22.96 ? 15 LEU A CD1 1 +ATOM 182 C CD2 . LEU A 1 18 ? 2.784 42.211 14.035 1.00 22.26 ? 15 LEU A CD2 1 +ATOM 183 H H . LEU A 1 18 ? 2.937 38.029 12.501 1.00 19.30 ? 15 LEU A H 1 +ATOM 184 H HA . LEU A 1 18 ? 3.915 40.543 12.100 1.00 20.21 ? 15 LEU A HA 1 +ATOM 185 H HB2 . LEU A 1 18 ? 3.865 39.116 14.551 1.00 21.25 ? 15 LEU A HB2 1 +ATOM 186 H HB3 . LEU A 1 18 ? 4.707 40.441 14.354 1.00 21.25 ? 15 LEU A HB3 1 +ATOM 187 H HG . LEU A 1 18 ? 1.899 40.380 14.280 1.00 22.49 ? 15 LEU A HG 1 +ATOM 188 H HD11 . LEU A 1 18 ? 1.974 41.342 16.453 1.00 27.55 ? 15 LEU A HD11 1 +ATOM 189 H HD12 . LEU A 1 18 ? 2.656 39.907 16.475 1.00 27.55 ? 15 LEU A HD12 1 +ATOM 190 H HD13 . LEU A 1 18 ? 3.558 41.214 16.451 1.00 27.55 ? 15 LEU A HD13 1 +ATOM 191 H HD21 . LEU A 1 18 ? 2.019 42.707 14.365 1.00 26.72 ? 15 LEU A HD21 1 +ATOM 192 H HD22 . LEU A 1 18 ? 3.606 42.630 14.335 1.00 26.72 ? 15 LEU A HD22 1 +ATOM 193 H HD23 . LEU A 1 18 ? 2.765 42.179 13.065 1.00 26.72 ? 15 LEU A HD23 1 +ATOM 194 N N . VAL A 1 19 ? 6.207 39.826 11.711 1.00 16.74 ? 16 VAL A N 1 +ATOM 195 C CA . VAL A 1 19 ? 7.551 39.367 11.418 1.00 16.46 ? 16 VAL A CA 1 +ATOM 196 C C . VAL A 1 19 ? 8.562 40.315 12.066 1.00 17.42 ? 16 VAL A C 1 +ATOM 197 O O . VAL A 1 19 ? 8.412 41.536 11.998 1.00 18.41 ? 16 VAL A O 1 +ATOM 198 C CB . VAL A 1 19 ? 7.799 39.343 9.911 1.00 16.28 ? 16 VAL A CB 1 +ATOM 199 C CG1 . VAL A 1 19 ? 9.166 38.779 9.593 1.00 16.12 ? 16 VAL A CG1 1 +ATOM 200 C CG2 . VAL A 1 19 ? 6.693 38.517 9.189 1.00 15.69 ? 16 VAL A CG2 1 +ATOM 201 H H . VAL A 1 19 ? 6.066 40.643 11.484 1.00 20.08 ? 16 VAL A H 1 +ATOM 202 H HA . VAL A 1 19 ? 7.682 38.474 11.774 1.00 19.75 ? 16 VAL A HA 1 +ATOM 203 H HB . VAL A 1 19 ? 7.764 40.251 9.571 1.00 19.53 ? 16 VAL A HB 1 +ATOM 204 H HG11 . VAL A 1 19 ? 9.291 38.777 8.631 1.00 19.34 ? 16 VAL A HG11 1 +ATOM 205 H HG12 . VAL A 1 19 ? 9.842 39.333 10.014 1.00 19.34 ? 16 VAL A HG12 1 +ATOM 206 H HG13 . VAL A 1 19 ? 9.220 37.873 9.935 1.00 19.34 ? 16 VAL A HG13 1 +ATOM 207 H HG21 . VAL A 1 19 ? 6.872 38.516 8.236 1.00 18.83 ? 16 VAL A HG21 1 +ATOM 208 H HG22 . VAL A 1 19 ? 6.706 37.608 9.529 1.00 18.83 ? 16 VAL A HG22 1 +ATOM 209 H HG23 . VAL A 1 19 ? 5.831 38.924 9.364 1.00 18.83 ? 16 VAL A HG23 1 +ATOM 210 N N . GLU A 1 20 ? 9.595 39.732 12.671 1.00 18.42 ? 17 GLU A N 1 +ATOM 211 C CA . GLU A 1 20 ? 10.673 40.491 13.276 1.00 18.40 ? 17 GLU A CA 1 +ATOM 212 C C . GLU A 1 20 ? 11.973 39.835 12.881 1.00 18.08 ? 17 GLU A C 1 +ATOM 213 O O . GLU A 1 20 ? 12.101 38.609 12.958 1.00 17.55 ? 17 GLU A O 1 +ATOM 214 C CB . GLU A 1 20 ? 10.509 40.475 14.785 1.00 19.23 ? 17 GLU A CB 1 +ATOM 215 C CG . GLU A 1 20 ? 9.211 41.107 15.230 1.00 22.51 ? 17 GLU A CG 1 +ATOM 216 C CD . GLU A 1 20 ? 9.212 42.599 15.067 1.00 27.80 ? 17 GLU A CD 1 +ATOM 217 O OE1 . GLU A 1 20 ? 10.301 43.186 14.850 1.00 23.48 ? 17 GLU A OE1 1 +ATOM 218 O OE2 . GLU A 1 20 ? 8.115 43.179 15.199 1.00 38.66 ? 17 GLU A OE2 1 +ATOM 219 H H . GLU A 1 20 ? 9.691 38.881 12.742 1.00 22.11 ? 17 GLU A H 1 +ATOM 220 H HA . GLU A 1 20 ? 10.663 41.408 12.959 1.00 22.08 ? 17 GLU A HA 1 +ATOM 221 H HB2 . GLU A 1 20 ? 10.519 39.556 15.095 1.00 23.08 ? 17 GLU A HB2 1 +ATOM 222 H HB3 . GLU A 1 20 ? 11.239 40.971 15.188 1.00 23.08 ? 17 GLU A HB3 1 +ATOM 223 H HG2 . GLU A 1 20 ? 8.485 40.747 14.698 1.00 27.02 ? 17 GLU A HG2 1 +ATOM 224 H HG3 . GLU A 1 20 ? 9.067 40.907 16.168 1.00 27.02 ? 17 GLU A HG3 1 +ATOM 225 N N A LEU A 1 21 ? 12.929 40.652 12.460 0.40 18.70 ? 18 LEU A N 1 +ATOM 226 N N B LEU A 1 21 ? 12.935 40.641 12.445 0.60 18.69 ? 18 LEU A N 1 +ATOM 227 C CA A LEU A 1 21 ? 14.222 40.167 12.025 0.40 18.61 ? 18 LEU A CA 1 +ATOM 228 C CA B LEU A 1 21 ? 14.225 40.145 11.992 0.60 18.58 ? 18 LEU A CA 1 +ATOM 229 C C A LEU A 1 21 ? 15.316 41.042 12.588 0.40 19.78 ? 18 LEU A C 1 +ATOM 230 C C B LEU A 1 21 ? 15.329 41.026 12.541 0.60 19.75 ? 18 LEU A C 1 +ATOM 231 O O A LEU A 1 21 ? 15.244 42.259 12.489 0.40 20.65 ? 18 LEU A O 1 +ATOM 232 O O B LEU A 1 21 ? 15.263 42.236 12.404 0.60 20.60 ? 18 LEU A O 1 +ATOM 233 C CB A LEU A 1 21 ? 14.305 40.200 10.500 0.40 18.24 ? 18 LEU A CB 1 +ATOM 234 C CB B LEU A 1 21 ? 14.287 40.165 10.455 0.60 18.20 ? 18 LEU A CB 1 +ATOM 235 C CG A LEU A 1 21 ? 15.643 39.742 9.921 0.40 18.36 ? 18 LEU A CG 1 +ATOM 236 C CG B LEU A 1 21 ? 15.672 39.985 9.820 0.60 18.48 ? 18 LEU A CG 1 +ATOM 237 C CD1 A LEU A 1 21 ? 15.381 39.130 8.572 0.40 17.93 ? 18 LEU A CD1 1 +ATOM 238 C CD1 B LEU A 1 21 ? 16.228 38.592 10.049 0.60 18.11 ? 18 LEU A CD1 1 +ATOM 239 C CD2 A LEU A 1 21 ? 16.666 40.884 9.791 0.40 19.38 ? 18 LEU A CD2 1 +ATOM 240 C CD2 B LEU A 1 21 ? 15.630 40.302 8.321 0.60 18.63 ? 18 LEU A CD2 1 +ATOM 241 H H A LEU A 1 21 ? 12.847 41.507 12.417 0.40 22.44 ? 18 LEU A H 1 +ATOM 242 H H B LEU A 1 21 ? 12.861 41.497 12.402 0.60 22.42 ? 18 LEU A H 1 +ATOM 243 H HA A LEU A 1 21 ? 14.355 39.256 12.331 0.40 22.33 ? 18 LEU A HA 1 +ATOM 244 H HA B LEU A 1 21 ? 14.360 39.236 12.303 0.60 22.30 ? 18 LEU A HA 1 +ATOM 245 H HB2 A LEU A 1 21 ? 13.617 39.619 10.140 0.40 21.89 ? 18 LEU A HB2 1 +ATOM 246 H HB2 B LEU A 1 21 ? 13.722 39.451 10.120 0.60 21.84 ? 18 LEU A HB2 1 +ATOM 247 H HB3 A LEU A 1 21 ? 14.153 41.110 10.201 0.40 21.89 ? 18 LEU A HB3 1 +ATOM 248 H HB3 B LEU A 1 21 ? 13.940 41.018 10.149 0.60 21.84 ? 18 LEU A HB3 1 +ATOM 249 H HG A LEU A 1 21 ? 16.023 39.059 10.495 0.40 22.03 ? 18 LEU A HG 1 +ATOM 250 H HG B LEU A 1 21 ? 16.283 40.614 10.233 0.60 22.18 ? 18 LEU A HG 1 +ATOM 251 H HD11 A LEU A 1 21 ? 16.222 38.834 8.191 0.40 21.52 ? 18 LEU A HD11 1 +ATOM 252 H HD11 B LEU A 1 21 ? 17.101 38.529 9.630 0.60 21.73 ? 18 LEU A HD11 1 +ATOM 253 H HD12 A LEU A 1 21 ? 14.782 38.375 8.680 0.40 21.52 ? 18 LEU A HD12 1 +ATOM 254 H HD12 B LEU A 1 21 ? 16.307 38.437 11.003 0.60 21.73 ? 18 LEU A HD12 1 +ATOM 255 H HD13 A LEU A 1 21 ? 14.973 39.797 7.998 0.40 21.52 ? 18 LEU A HD13 1 +ATOM 256 H HD13 B LEU A 1 21 ? 15.625 37.943 9.656 0.60 21.73 ? 18 LEU A HD13 1 +ATOM 257 H HD21 A LEU A 1 21 ? 17.489 40.529 9.420 0.40 23.25 ? 18 LEU A HD21 1 +ATOM 258 H HD21 B LEU A 1 21 ? 16.516 40.180 7.948 0.60 22.36 ? 18 LEU A HD21 1 +ATOM 259 H HD22 A LEU A 1 21 ? 16.305 41.566 9.204 0.40 23.25 ? 18 LEU A HD22 1 +ATOM 260 H HD22 B LEU A 1 21 ? 15.002 39.701 7.889 0.60 22.36 ? 18 LEU A HD22 1 +ATOM 261 H HD23 A LEU A 1 21 ? 16.834 41.258 10.670 0.40 23.25 ? 18 LEU A HD23 1 +ATOM 262 H HD23 B LEU A 1 21 ? 15.344 41.221 8.202 0.60 22.36 ? 18 LEU A HD23 1 +ATOM 263 N N . ASP A 1 22 ? 16.329 40.408 13.170 1.00 20.05 ? 19 ASP A N 1 +ATOM 264 C CA . ASP A 1 22 ? 17.578 41.091 13.554 1.00 21.22 ? 19 ASP A CA 1 +ATOM 265 C C . ASP A 1 22 ? 18.665 40.532 12.666 1.00 22.77 ? 19 ASP A C 1 +ATOM 266 O O . ASP A 1 22 ? 18.895 39.309 12.651 1.00 20.44 ? 19 ASP A O 1 +ATOM 267 C CB . ASP A 1 22 ? 17.976 40.790 15.003 1.00 22.21 ? 19 ASP A CB 1 +ATOM 268 C CG . ASP A 1 22 ? 17.168 41.573 16.016 1.00 35.56 ? 19 ASP A CG 1 +ATOM 269 O OD1 . ASP A 1 22 ? 16.575 42.613 15.638 1.00 23.46 ? 19 ASP A OD1 1 +ATOM 270 O OD2 . ASP A 1 22 ? 17.155 41.154 17.202 1.00 36.38 ? 19 ASP A OD2 1 +ATOM 271 H H A ASP A 1 22 ? 16.323 39.569 13.359 0.40 24.06 ? 19 ASP A H 1 +ATOM 272 H H B ASP A 1 22 ? 16.311 39.577 13.392 0.60 24.06 ? 19 ASP A H 1 +ATOM 273 H HA . ASP A 1 22 ? 17.504 42.049 13.423 1.00 25.46 ? 19 ASP A HA 1 +ATOM 274 H HB2 . ASP A 1 22 ? 17.839 39.845 15.177 1.00 26.66 ? 19 ASP A HB2 1 +ATOM 275 H HB3 . ASP A 1 22 ? 18.911 41.017 15.126 1.00 26.66 ? 19 ASP A HB3 1 +ATOM 276 N N . GLY A 1 23 ? 19.329 41.417 11.925 1.00 25.73 ? 20 GLY A N 1 +ATOM 277 C CA . GLY A 1 23 ? 20.388 41.017 11.017 1.00 23.03 ? 20 GLY A CA 1 +ATOM 278 C C . GLY A 1 23 ? 21.732 41.678 11.300 1.00 23.54 ? 20 GLY A C 1 +ATOM 279 O O . GLY A 1 23 ? 21.810 42.748 11.938 1.00 23.72 ? 20 GLY A O 1 +ATOM 280 H H . GLY A 1 23 ? 19.179 42.264 11.933 1.00 30.88 ? 20 GLY A H 1 +ATOM 281 H HA2 . GLY A 1 23 ? 20.507 40.056 11.073 1.00 27.64 ? 20 GLY A HA2 1 +ATOM 282 H HA3 . GLY A 1 23 ? 20.128 41.238 10.109 1.00 27.64 ? 20 GLY A HA3 1 +ATOM 283 N N . ASP A 1 24 ? 22.780 41.008 10.820 1.00 22.63 ? 21 ASP A N 1 +ATOM 284 C CA . ASP A 1 24 ? 24.172 41.428 10.912 1.00 23.74 ? 21 ASP A CA 1 +ATOM 285 C C . ASP A 1 24 ? 24.884 40.835 9.680 1.00 23.60 ? 21 ASP A C 1 +ATOM 286 O O . ASP A 1 24 ? 25.142 39.633 9.632 1.00 23.34 ? 21 ASP A O 1 +ATOM 287 C CB . ASP A 1 24 ? 24.816 40.878 12.192 1.00 24.43 ? 21 ASP A CB 1 +ATOM 288 C CG . ASP A 1 24 ? 26.275 41.282 12.348 1.00 39.60 ? 21 ASP A CG 1 +ATOM 289 O OD1 . ASP A 1 24 ? 26.914 41.624 11.335 1.00 35.23 ? 21 ASP A OD1 1 +ATOM 290 O OD2 . ASP A 1 24 ? 26.793 41.252 13.496 1.00 38.18 ? 21 ASP A OD2 1 +ATOM 291 H H . ASP A 1 24 ? 22.696 40.256 10.410 1.00 27.16 ? 21 ASP A H 1 +ATOM 292 H HA . ASP A 1 24 ? 24.242 42.395 10.898 1.00 28.49 ? 21 ASP A HA 1 +ATOM 293 H HB2 . ASP A 1 24 ? 24.329 41.215 12.960 1.00 29.32 ? 21 ASP A HB2 1 +ATOM 294 H HB3 . ASP A 1 24 ? 24.775 39.909 12.174 1.00 29.32 ? 21 ASP A HB3 1 +ATOM 295 N N . VAL A 1 25 ? 25.170 41.670 8.687 1.00 24.07 ? 22 VAL A N 1 +ATOM 296 C CA . VAL A 1 25 ? 25.845 41.220 7.455 1.00 24.30 ? 22 VAL A CA 1 +ATOM 297 C C . VAL A 1 25 ? 27.187 41.932 7.335 1.00 25.57 ? 22 VAL A C 1 +ATOM 298 O O . VAL A 1 25 ? 27.246 43.156 7.313 1.00 26.35 ? 22 VAL A O 1 +ATOM 299 C CB . VAL A 1 25 ? 24.972 41.484 6.207 1.00 24.09 ? 22 VAL A CB 1 +ATOM 300 C CG1 . VAL A 1 25 ? 25.709 41.086 4.917 1.00 24.79 ? 22 VAL A CG1 1 +ATOM 301 C CG2 . VAL A 1 25 ? 23.638 40.702 6.308 1.00 22.89 ? 22 VAL A CG2 1 +ATOM 302 H H . VAL A 1 25 ? 24.985 42.510 8.695 1.00 28.88 ? 22 VAL A H 1 +ATOM 303 H HA . VAL A 1 25 ? 26.011 40.267 7.512 1.00 29.16 ? 22 VAL A HA 1 +ATOM 304 H HB . VAL A 1 25 ? 24.765 42.430 6.157 1.00 28.91 ? 22 VAL A HB 1 +ATOM 305 H HG11 . VAL A 1 25 ? 25.133 41.264 4.157 1.00 29.75 ? 22 VAL A HG11 1 +ATOM 306 H HG12 . VAL A 1 25 ? 26.524 41.608 4.845 1.00 29.75 ? 22 VAL A HG12 1 +ATOM 307 H HG13 . VAL A 1 25 ? 25.924 40.141 4.955 1.00 29.75 ? 22 VAL A HG13 1 +ATOM 308 H HG21 . VAL A 1 25 ? 23.107 40.881 5.516 1.00 27.46 ? 22 VAL A HG21 1 +ATOM 309 H HG22 . VAL A 1 25 ? 23.832 39.754 6.369 1.00 27.46 ? 22 VAL A HG22 1 +ATOM 310 H HG23 . VAL A 1 25 ? 23.161 40.994 7.100 1.00 27.46 ? 22 VAL A HG23 1 +ATOM 311 N N . ASN A 1 26 ? 28.262 41.154 7.282 1.00 26.93 ? 23 ASN A N 1 +ATOM 312 C CA . ASN A 1 26 ? 29.615 41.710 7.332 1.00 27.26 ? 23 ASN A CA 1 +ATOM 313 C C . ASN A 1 26 ? 29.732 42.771 8.448 1.00 27.89 ? 23 ASN A C 1 +ATOM 314 O O . ASN A 1 26 ? 30.338 43.849 8.274 1.00 29.03 ? 23 ASN A O 1 +ATOM 315 C CB . ASN A 1 26 ? 30.008 42.268 5.970 1.00 28.02 ? 23 ASN A CB 1 +ATOM 316 C CG . ASN A 1 26 ? 30.533 41.189 5.033 1.00 28.25 ? 23 ASN A CG 1 +ATOM 317 O OD1 . ASN A 1 26 ? 30.050 40.054 5.031 1.00 27.55 ? 23 ASN A OD1 1 +ATOM 318 N ND2 . ASN A 1 26 ? 31.529 41.538 4.239 1.00 29.50 ? 23 ASN A ND2 1 +ATOM 319 H H . ASN A 1 26 ? 28.238 40.297 7.216 1.00 32.31 ? 23 ASN A H 1 +ATOM 320 H HA . ASN A 1 26 ? 30.235 40.994 7.544 1.00 32.71 ? 23 ASN A HA 1 +ATOM 321 H HB2 . ASN A 1 26 ? 29.229 42.674 5.557 1.00 33.63 ? 23 ASN A HB2 1 +ATOM 322 H HB3 . ASN A 1 26 ? 30.706 42.931 6.087 1.00 33.63 ? 23 ASN A HB3 1 +ATOM 323 H HD21 . ASN A 1 26 ? 31.844 42.338 4.270 1.00 35.40 ? 23 ASN A HD21 1 +ATOM 324 H HD22 . ASN A 1 26 ? 31.862 40.966 3.690 1.00 35.40 ? 23 ASN A HD22 1 +ATOM 325 N N . GLY A 1 27 ? 29.097 42.483 9.582 1.00 27.51 ? 24 GLY A N 1 +ATOM 326 C CA . GLY A 1 27 ? 29.210 43.362 10.738 1.00 32.99 ? 24 GLY A CA 1 +ATOM 327 C C . GLY A 1 27 ? 28.265 44.546 10.706 1.00 30.46 ? 24 GLY A C 1 +ATOM 328 O O . GLY A 1 27 ? 28.157 45.283 11.696 1.00 30.72 ? 24 GLY A O 1 +ATOM 329 H H . GLY A 1 27 ? 28.601 41.792 9.705 1.00 33.01 ? 24 GLY A H 1 +ATOM 330 H HA2 . GLY A 1 27 ? 29.028 42.852 11.543 1.00 39.59 ? 24 GLY A HA2 1 +ATOM 331 H HA3 . GLY A 1 27 ? 30.117 43.701 10.793 1.00 39.59 ? 24 GLY A HA3 1 +ATOM 332 N N . HIS A 1 28 ? 27.570 44.735 9.590 1.00 29.38 ? 25 HIS A N 1 +ATOM 333 C CA . HIS A 1 28 ? 26.552 45.773 9.495 1.00 28.77 ? 25 HIS A CA 1 +ATOM 334 C C . HIS A 1 28 ? 25.234 45.263 10.100 1.00 27.15 ? 25 HIS A C 1 +ATOM 335 O O . HIS A 1 28 ? 24.585 44.388 9.549 1.00 25.88 ? 25 HIS A O 1 +ATOM 336 C CB . HIS A 1 28 ? 26.302 46.188 8.047 1.00 28.61 ? 25 HIS A CB 1 +ATOM 337 C CG . HIS A 1 28 ? 27.519 46.678 7.336 1.00 30.28 ? 25 HIS A CG 1 +ATOM 338 N ND1 . HIS A 1 28 ? 28.076 47.913 7.587 1.00 35.79 ? 25 HIS A ND1 1 +ATOM 339 C CD2 . HIS A 1 28 ? 28.274 46.110 6.363 1.00 30.87 ? 25 HIS A CD2 1 +ATOM 340 C CE1 . HIS A 1 28 ? 29.132 48.082 6.810 1.00 42.62 ? 25 HIS A CE1 1 +ATOM 341 N NE2 . HIS A 1 28 ? 29.275 47.003 6.059 1.00 34.90 ? 25 HIS A NE2 1 +ATOM 342 H H . HIS A 1 28 ? 27.669 44.273 8.871 1.00 35.26 ? 25 HIS A H 1 +ATOM 343 H HA . HIS A 1 28 ? 26.839 46.554 9.994 1.00 34.52 ? 25 HIS A HA 1 +ATOM 344 H HB2 . HIS A 1 28 ? 25.962 45.422 7.558 1.00 34.33 ? 25 HIS A HB2 1 +ATOM 345 H HB3 . HIS A 1 28 ? 25.645 46.902 8.036 1.00 34.33 ? 25 HIS A HB3 1 +ATOM 346 H HD1 . HIS A 1 28 ? 27.786 48.482 8.164 1.00 42.95 ? 25 HIS A HD1 1 +ATOM 347 H HD2 . HIS A 1 28 ? 28.146 45.272 5.981 1.00 37.05 ? 25 HIS A HD2 1 +ATOM 348 H HE1 . HIS A 1 28 ? 29.681 48.833 6.794 1.00 51.15 ? 25 HIS A HE1 1 +ATOM 349 H HE2 . HIS A 1 28 ? 29.893 46.881 5.473 1.00 41.88 ? 25 HIS A HE2 1 +ATOM 350 N N . LYS A 1 29 ? 24.849 45.846 11.230 1.00 27.39 ? 26 LYS A N 1 +ATOM 351 C CA . LYS A 1 29 ? 23.652 45.441 11.956 1.00 26.21 ? 26 LYS A CA 1 +ATOM 352 C C . LYS A 1 29 ? 22.402 46.213 11.514 1.00 25.48 ? 26 LYS A C 1 +ATOM 353 O O . LYS A 1 29 ? 22.479 47.365 11.091 1.00 27.28 ? 26 LYS A O 1 +ATOM 354 C CB . LYS A 1 29 ? 23.922 45.629 13.453 1.00 27.17 ? 26 LYS A CB 1 +ATOM 355 C CG . LYS A 1 29 ? 24.968 44.640 13.962 1.00 28.27 ? 26 LYS A CG 1 +ATOM 356 C CD . LYS A 1 29 ? 25.160 44.707 15.475 1.00 36.46 ? 26 LYS A CD 1 +ATOM 357 C CE . LYS A 1 29 ? 26.159 43.651 15.960 1.00 42.25 ? 26 LYS A CE 1 +ATOM 358 N NZ . LYS A 1 29 ? 25.634 42.256 15.819 1.00 46.52 ? 26 LYS A NZ 1 +ATOM 359 H H . LYS A 1 29 ? 25.275 46.493 11.604 1.00 32.87 ? 26 LYS A H 1 +ATOM 360 H HA . LYS A 1 29 ? 23.492 44.498 11.797 1.00 31.46 ? 26 LYS A HA 1 +ATOM 361 H HB2 . LYS A 1 29 ? 24.252 46.528 13.609 1.00 32.61 ? 26 LYS A HB2 1 +ATOM 362 H HB3 . LYS A 1 29 ? 23.100 45.483 13.947 1.00 32.61 ? 26 LYS A HB3 1 +ATOM 363 H HG2 . LYS A 1 29 ? 24.688 43.740 13.735 1.00 33.93 ? 26 LYS A HG2 1 +ATOM 364 H HG3 . LYS A 1 29 ? 25.820 44.839 13.543 1.00 33.93 ? 26 LYS A HG3 1 +ATOM 365 H HD2 . LYS A 1 29 ? 25.502 45.582 15.716 1.00 43.75 ? 26 LYS A HD2 1 +ATOM 366 H HD3 . LYS A 1 29 ? 24.310 44.545 15.913 1.00 43.75 ? 26 LYS A HD3 1 +ATOM 367 H HE2 . LYS A 1 29 ? 26.973 43.721 15.437 1.00 50.70 ? 26 LYS A HE2 1 +ATOM 368 H HE3 . LYS A 1 29 ? 26.352 43.806 16.898 1.00 50.70 ? 26 LYS A HE3 1 +ATOM 369 H HZ1 . LYS A 1 29 ? 25.454 42.084 14.965 1.00 55.83 ? 26 LYS A HZ1 1 +ATOM 370 H HZ2 . LYS A 1 29 ? 26.240 41.673 16.110 1.00 55.83 ? 26 LYS A HZ2 1 +ATOM 371 H HZ3 . LYS A 1 29 ? 24.889 42.162 16.296 1.00 55.83 ? 26 LYS A HZ3 1 +ATOM 372 N N . PHE A 1 30 ? 21.248 45.574 11.604 1.00 24.15 ? 27 PHE A N 1 +ATOM 373 C CA . PHE A 1 30 ? 19.993 46.208 11.226 1.00 23.58 ? 27 PHE A CA 1 +ATOM 374 C C . PHE A 1 30 ? 18.834 45.410 11.779 1.00 22.42 ? 27 PHE A C 1 +ATOM 375 O O . PHE A 1 30 ? 19.016 44.282 12.215 1.00 21.91 ? 27 PHE A O 1 +ATOM 376 C CB . PHE A 1 30 ? 19.845 46.285 9.709 1.00 23.20 ? 27 PHE A CB 1 +ATOM 377 C CG . PHE A 1 30 ? 19.807 44.949 9.013 1.00 22.07 ? 27 PHE A CG 1 +ATOM 378 C CD1 . PHE A 1 30 ? 20.973 44.331 8.612 1.00 22.80 ? 27 PHE A CD1 1 +ATOM 379 C CD2 . PHE A 1 30 ? 18.598 44.343 8.710 1.00 21.48 ? 27 PHE A CD2 1 +ATOM 380 C CE1 . PHE A 1 30 ? 20.946 43.118 7.937 1.00 23.27 ? 27 PHE A CE1 1 +ATOM 381 C CE2 . PHE A 1 30 ? 18.560 43.124 8.028 1.00 24.37 ? 27 PHE A CE2 1 +ATOM 382 C CZ . PHE A 1 30 ? 19.743 42.520 7.641 1.00 20.65 ? 27 PHE A CZ 1 +ATOM 383 H H . PHE A 1 30 ? 21.161 44.765 11.884 1.00 28.98 ? 27 PHE A H 1 +ATOM 384 H HA . PHE A 1 30 ? 19.956 47.106 11.589 1.00 28.30 ? 27 PHE A HA 1 +ATOM 385 H HB2 . PHE A 1 30 ? 19.018 46.747 9.502 1.00 27.84 ? 27 PHE A HB2 1 +ATOM 386 H HB3 . PHE A 1 30 ? 20.596 46.782 9.349 1.00 27.84 ? 27 PHE A HB3 1 +ATOM 387 H HD1 . PHE A 1 30 ? 21.790 44.732 8.799 1.00 27.36 ? 27 PHE A HD1 1 +ATOM 388 H HD2 . PHE A 1 30 ? 17.803 44.754 8.961 1.00 25.78 ? 27 PHE A HD2 1 +ATOM 389 H HE1 . PHE A 1 30 ? 21.743 42.711 7.681 1.00 27.93 ? 27 PHE A HE1 1 +ATOM 390 H HE2 . PHE A 1 30 ? 17.744 42.721 7.837 1.00 29.25 ? 27 PHE A HE2 1 +ATOM 391 H HZ . PHE A 1 30 ? 19.725 41.702 7.199 1.00 24.79 ? 27 PHE A HZ 1 +ATOM 392 N N A SER A 1 31 ? 17.643 45.990 11.730 0.82 22.17 ? 28 SER A N 1 +ATOM 393 N N B SER A 1 31 ? 17.648 46.013 11.769 0.18 22.20 ? 28 SER A N 1 +ATOM 394 C CA A SER A 1 31 ? 16.441 45.310 12.186 0.82 21.21 ? 28 SER A CA 1 +ATOM 395 C CA B SER A 1 31 ? 16.428 45.347 12.211 0.18 21.24 ? 28 SER A CA 1 +ATOM 396 C C A SER A 1 31 ? 15.275 45.664 11.284 0.82 20.70 ? 28 SER A C 1 +ATOM 397 C C B SER A 1 31 ? 15.284 45.664 11.257 0.18 20.69 ? 28 SER A C 1 +ATOM 398 O O A SER A 1 31 ? 15.159 46.804 10.825 0.82 21.51 ? 28 SER A O 1 +ATOM 399 O O B SER A 1 31 ? 15.191 46.774 10.732 0.18 21.47 ? 28 SER A O 1 +ATOM 400 C CB A SER A 1 31 ? 16.121 45.683 13.649 0.82 21.97 ? 28 SER A CB 1 +ATOM 401 C CB B SER A 1 31 ? 16.045 45.782 13.633 0.18 22.01 ? 28 SER A CB 1 +ATOM 402 O OG A SER A 1 31 ? 15.198 44.766 14.202 0.82 21.17 ? 28 SER A OG 1 +ATOM 403 O OG B SER A 1 31 ? 17.085 45.514 14.557 0.18 22.75 ? 28 SER A OG 1 +ATOM 404 H H A SER A 1 31 ? 17.503 46.785 11.433 0.82 26.60 ? 28 SER A H 1 +ATOM 405 H H B SER A 1 31 ? 17.524 46.822 11.506 0.18 26.64 ? 28 SER A H 1 +ATOM 406 H HA A SER A 1 31 ? 16.580 44.351 12.140 0.82 25.45 ? 28 SER A HA 1 +ATOM 407 H HA B SER A 1 31 ? 16.567 44.387 12.213 0.18 25.49 ? 28 SER A HA 1 +ATOM 408 H HB2 A SER A 1 31 ? 16.940 45.661 14.168 0.82 26.37 ? 28 SER A HB2 1 +ATOM 409 H HB2 B SER A 1 31 ? 15.865 46.735 13.631 0.18 26.41 ? 28 SER A HB2 1 +ATOM 410 H HB3 A SER A 1 31 ? 15.736 46.573 13.672 0.82 26.37 ? 28 SER A HB3 1 +ATOM 411 H HB3 B SER A 1 31 ? 15.251 45.297 13.906 0.18 26.41 ? 28 SER A HB3 1 +ATOM 412 H HG A SER A 1 31 ? 15.028 44.974 14.998 0.82 25.41 ? 28 SER A HG 1 +ATOM 413 H HG B SER A 1 31 ? 17.251 44.691 14.572 0.18 27.30 ? 28 SER A HG 1 +ATOM 414 N N . VAL A 1 32 ? 14.426 44.674 11.042 1.00 19.52 ? 29 VAL A N 1 +ATOM 415 C CA . VAL A 1 32 ? 13.241 44.814 10.196 1.00 19.05 ? 29 VAL A CA 1 +ATOM 416 C C . VAL A 1 32 ? 11.997 44.299 10.926 1.00 23.06 ? 29 VAL A C 1 +ATOM 417 O O . VAL A 1 32 ? 12.042 43.252 11.567 1.00 18.14 ? 29 VAL A O 1 +ATOM 418 C CB . VAL A 1 32 ? 13.373 43.977 8.900 1.00 18.16 ? 29 VAL A CB 1 +ATOM 419 C CG1 . VAL A 1 32 ? 12.055 43.993 8.093 1.00 17.75 ? 29 VAL A CG1 1 +ATOM 420 C CG2 . VAL A 1 32 ? 14.504 44.488 8.082 1.00 18.84 ? 29 VAL A CG2 1 +ATOM 421 H H A VAL A 1 32 ? 14.516 43.883 11.367 0.82 23.43 ? 29 VAL A H 1 +ATOM 422 H H B VAL A 1 32 ? 14.509 43.889 11.384 0.18 23.43 ? 29 VAL A H 1 +ATOM 423 H HA . VAL A 1 32 ? 13.108 45.745 9.960 1.00 22.87 ? 29 VAL A HA 1 +ATOM 424 H HB . VAL A 1 32 ? 13.567 43.057 9.137 1.00 21.80 ? 29 VAL A HB 1 +ATOM 425 H HG11 . VAL A 1 32 ? 12.170 43.461 7.290 1.00 21.30 ? 29 VAL A HG11 1 +ATOM 426 H HG12 . VAL A 1 32 ? 11.346 43.618 8.640 1.00 21.30 ? 29 VAL A HG12 1 +ATOM 427 H HG13 . VAL A 1 32 ? 11.841 44.909 7.856 1.00 21.30 ? 29 VAL A HG13 1 +ATOM 428 H HG21 . VAL A 1 32 ? 14.575 43.955 7.274 1.00 22.61 ? 29 VAL A HG21 1 +ATOM 429 H HG22 . VAL A 1 32 ? 14.335 45.415 7.853 1.00 22.61 ? 29 VAL A HG22 1 +ATOM 430 H HG23 . VAL A 1 32 ? 15.323 44.417 8.598 1.00 22.61 ? 29 VAL A HG23 1 +ATOM 431 N N . SER A 1 33 ? 10.906 45.048 10.828 1.00 18.99 ? 30 SER A N 1 +ATOM 432 C CA A SER A 1 33 ? 9.620 44.614 11.366 0.69 18.82 ? 30 SER A CA 1 +ATOM 433 C CA C SER A 1 33 ? 9.611 44.640 11.370 0.31 20.13 ? 30 SER A CA 1 +ATOM 434 C C . SER A 1 33 ? 8.600 44.614 10.238 1.00 19.01 ? 30 SER A C 1 +ATOM 435 O O . SER A 1 33 ? 8.584 45.514 9.405 1.00 19.04 ? 30 SER A O 1 +ATOM 436 C CB A SER A 1 33 ? 9.166 45.537 12.505 0.69 24.53 ? 30 SER A CB 1 +ATOM 437 C CB C SER A 1 33 ? 9.152 45.623 12.453 0.31 23.90 ? 30 SER A CB 1 +ATOM 438 O OG A SER A 1 33 ? 10.018 45.441 13.642 0.69 20.36 ? 30 SER A OG 1 +ATOM 439 O OG C SER A 1 33 ? 7.795 45.410 12.817 0.31 24.57 ? 30 SER A OG 1 +ATOM 440 H H A SER A 1 33 ? 10.883 45.821 10.450 0.69 22.79 ? 30 SER A H 1 +ATOM 441 H H C SER A 1 33 ? 10.888 45.817 10.442 0.31 22.79 ? 30 SER A H 1 +ATOM 442 H HA A SER A 1 33 ? 9.700 43.711 11.711 0.69 22.59 ? 30 SER A HA 1 +ATOM 443 H HA C SER A 1 33 ? 9.677 43.753 11.755 0.31 24.16 ? 30 SER A HA 1 +ATOM 444 H HB2 A SER A 1 33 ? 9.173 46.453 12.186 0.69 29.43 ? 30 SER A HB2 1 +ATOM 445 H HB2 C SER A 1 33 ? 9.708 45.505 13.239 0.31 28.68 ? 30 SER A HB2 1 +ATOM 446 H HB3 A SER A 1 33 ? 8.266 45.289 12.768 0.69 29.43 ? 30 SER A HB3 1 +ATOM 447 H HB3 C SER A 1 33 ? 9.247 46.527 12.116 0.31 28.68 ? 30 SER A HB3 1 +ATOM 448 H HG A SER A 1 33 ? 10.802 45.657 13.432 0.69 24.44 ? 30 SER A HG 1 +ATOM 449 H HG C SER A 1 33 ? 7.298 45.511 12.147 0.31 29.49 ? 30 SER A HG 1 +ATOM 450 N N . GLY A 1 34 ? 7.774 43.575 10.194 1.00 19.43 ? 31 GLY A N 1 +ATOM 451 C CA . GLY A 1 34 ? 6.732 43.476 9.193 1.00 19.05 ? 31 GLY A CA 1 +ATOM 452 C C . GLY A 1 34 ? 5.403 43.080 9.806 1.00 23.36 ? 31 GLY A C 1 +ATOM 453 O O . GLY A 1 34 ? 5.351 42.440 10.864 1.00 18.06 ? 31 GLY A O 1 +ATOM 454 H H . GLY A 1 34 ? 7.800 42.911 10.740 1.00 23.31 ? 31 GLY A H 1 +ATOM 455 H HA2 . GLY A 1 34 ? 6.625 44.331 8.748 1.00 22.86 ? 31 GLY A HA2 1 +ATOM 456 H HA3 . GLY A 1 34 ? 6.978 42.810 8.532 1.00 22.86 ? 31 GLY A HA3 1 +ATOM 457 N N . GLU A 1 35 ? 4.323 43.467 9.143 1.00 17.75 ? 32 GLU A N 1 +ATOM 458 C CA . GLU A 1 35 ? 2.999 43.054 9.565 1.00 17.87 ? 32 GLU A CA 1 +ATOM 459 C C . GLU A 1 35 ? 2.113 42.970 8.350 1.00 17.92 ? 32 GLU A C 1 +ATOM 460 O O . GLU A 1 35 ? 2.390 43.583 7.317 1.00 18.33 ? 32 GLU A O 1 +ATOM 461 C CB . GLU A 1 35 ? 2.412 44.031 10.571 1.00 20.01 ? 32 GLU A CB 1 +ATOM 462 C CG . GLU A 1 35 ? 2.464 45.446 10.100 1.00 26.36 ? 32 GLU A CG 1 +ATOM 463 C CD . GLU A 1 35 ? 1.826 46.418 11.092 1.00 39.06 ? 32 GLU A CD 1 +ATOM 464 O OE1 . GLU A 1 35 ? 1.684 47.602 10.735 1.00 40.06 ? 32 GLU A OE1 1 +ATOM 465 O OE2 . GLU A 1 35 ? 1.457 46.005 12.210 1.00 35.93 ? 32 GLU A OE2 1 +ATOM 466 H H . GLU A 1 35 ? 4.331 43.968 8.444 1.00 21.30 ? 32 GLU A H 1 +ATOM 467 H HA . GLU A 1 35 ? 3.047 42.177 9.976 1.00 21.45 ? 32 GLU A HA 1 +ATOM 468 H HB2 . GLU A 1 35 ? 1.483 43.802 10.729 1.00 24.02 ? 32 GLU A HB2 1 +ATOM 469 H HB3 . GLU A 1 35 ? 2.914 43.972 11.399 1.00 24.02 ? 32 GLU A HB3 1 +ATOM 470 H HG2 . GLU A 1 35 ? 3.391 45.706 9.979 1.00 31.64 ? 32 GLU A HG2 1 +ATOM 471 H HG3 . GLU A 1 35 ? 1.986 45.518 9.259 1.00 31.64 ? 32 GLU A HG3 1 +ATOM 472 N N . GLY A 1 36 ? 1.087 42.151 8.472 1.00 17.60 ? 33 GLY A N 1 +ATOM 473 C CA . GLY A 1 36 ? 0.112 41.967 7.410 1.00 17.79 ? 33 GLY A CA 1 +ATOM 474 C C . GLY A 1 36 ? -0.762 40.764 7.681 1.00 19.09 ? 33 GLY A C 1 +ATOM 475 O O . GLY A 1 36 ? -1.070 40.461 8.840 1.00 17.22 ? 33 GLY A O 1 +ATOM 476 H H . GLY A 1 36 ? 0.927 41.681 9.174 1.00 21.13 ? 33 GLY A H 1 +ATOM 477 H HA2 . GLY A 1 36 ? -0.451 42.753 7.341 1.00 21.35 ? 33 GLY A HA2 1 +ATOM 478 H HA3 . GLY A 1 36 ? 0.570 41.836 6.564 1.00 21.35 ? 33 GLY A HA3 1 +ATOM 479 N N . GLU A 1 37 ? -1.151 40.059 6.614 1.00 16.63 ? 34 GLU A N 1 +ATOM 480 C CA . GLU A 1 37 ? -2.030 38.912 6.757 1.00 16.14 ? 34 GLU A CA 1 +ATOM 481 C C . GLU A 1 37 ? -1.791 37.859 5.697 1.00 15.10 ? 34 GLU A C 1 +ATOM 482 O O . GLU A 1 37 ? -1.292 38.156 4.586 1.00 15.12 ? 34 GLU A O 1 +ATOM 483 C CB . GLU A 1 37 ? -3.498 39.351 6.736 1.00 24.16 ? 34 GLU A CB 1 +ATOM 484 C CG . GLU A 1 37 ? -3.921 40.077 5.498 1.00 32.09 ? 34 GLU A CG 1 +ATOM 485 C CD . GLU A 1 37 ? -5.255 40.795 5.668 1.00 35.26 ? 34 GLU A CD 1 +ATOM 486 O OE1 . GLU A 1 37 ? -5.471 41.443 6.715 1.00 38.72 ? 34 GLU A OE1 1 +ATOM 487 O OE2 . GLU A 1 37 ? -6.091 40.708 4.745 1.00 36.42 ? 34 GLU A OE2 1 +ATOM 488 H H . GLU A 1 37 ? -0.918 40.229 5.804 1.00 19.96 ? 34 GLU A H 1 +ATOM 489 H HA . GLU A 1 37 ? -1.860 38.501 7.619 1.00 19.37 ? 34 GLU A HA 1 +ATOM 490 H HB2 . GLU A 1 37 ? -4.057 38.562 6.818 1.00 28.99 ? 34 GLU A HB2 1 +ATOM 491 H HB3 . GLU A 1 37 ? -3.655 39.941 7.490 1.00 28.99 ? 34 GLU A HB3 1 +ATOM 492 H HG2 . GLU A 1 37 ? -3.250 40.741 5.275 1.00 38.51 ? 34 GLU A HG2 1 +ATOM 493 H HG3 . GLU A 1 37 ? -4.013 39.440 4.772 1.00 38.51 ? 34 GLU A HG3 1 +ATOM 494 N N . GLY A 1 38 ? -2.142 36.627 6.055 1.00 14.87 ? 35 GLY A N 1 +ATOM 495 C CA . GLY A 1 38 ? -2.055 35.502 5.140 1.00 17.37 ? 35 GLY A CA 1 +ATOM 496 C C . GLY A 1 38 ? -3.408 34.838 5.007 1.00 18.21 ? 35 GLY A C 1 +ATOM 497 O O . GLY A 1 38 ? -4.192 34.813 5.956 1.00 17.93 ? 35 GLY A O 1 +ATOM 498 H H . GLY A 1 38 ? -2.438 36.418 6.835 1.00 17.84 ? 35 GLY A H 1 +ATOM 499 H HA2 . GLY A 1 38 ? -1.766 35.807 4.265 1.00 20.84 ? 35 GLY A HA2 1 +ATOM 500 H HA3 . GLY A 1 38 ? -1.417 34.852 5.474 1.00 20.84 ? 35 GLY A HA3 1 +ATOM 501 N N . ASP A 1 39 ? -3.701 34.337 3.811 1.00 13.74 ? 36 ASP A N 1 +ATOM 502 C CA . ASP A 1 39 ? -4.967 33.678 3.527 1.00 14.50 ? 36 ASP A CA 1 +ATOM 503 C C . ASP A 1 39 ? -4.619 32.396 2.819 1.00 13.23 ? 36 ASP A C 1 +ATOM 504 O O . ASP A 1 39 ? -4.451 32.373 1.591 1.00 14.25 ? 36 ASP A O 1 +ATOM 505 C CB . ASP A 1 39 ? -5.823 34.579 2.635 1.00 15.64 ? 36 ASP A CB 1 +ATOM 506 C CG . ASP A 1 39 ? -7.270 34.133 2.565 1.00 24.81 ? 36 ASP A CG 1 +ATOM 507 O OD1 . ASP A 1 39 ? -7.585 33.049 3.077 1.00 26.29 ? 36 ASP A OD1 1 +ATOM 508 O OD2 . ASP A 1 39 ? -8.097 34.885 2.016 1.00 29.69 ? 36 ASP A OD2 1 +ATOM 509 H H . ASP A 1 39 ? -3.169 34.368 3.136 1.00 16.49 ? 36 ASP A H 1 +ATOM 510 H HA . ASP A 1 39 ? -5.444 33.481 4.348 1.00 17.40 ? 36 ASP A HA 1 +ATOM 511 H HB2 . ASP A 1 39 ? -5.805 35.483 2.988 1.00 18.77 ? 36 ASP A HB2 1 +ATOM 512 H HB3 . ASP A 1 39 ? -5.462 34.567 1.735 1.00 18.77 ? 36 ASP A HB3 1 +ATOM 513 N N . ALA A 1 40 ? -4.423 31.331 3.590 1.00 14.38 ? 37 ALA A N 1 +ATOM 514 C CA . ALA A 1 40 ? -3.825 30.116 3.037 1.00 13.95 ? 37 ALA A CA 1 +ATOM 515 C C . ALA A 1 40 ? -4.763 29.443 2.006 1.00 17.11 ? 37 ALA A C 1 +ATOM 516 O O . ALA A 1 40 ? -4.342 28.632 1.174 1.00 14.97 ? 37 ALA A O 1 +ATOM 517 C CB . ALA A 1 40 ? -3.510 29.151 4.156 1.00 14.36 ? 37 ALA A CB 1 +ATOM 518 H H . ALA A 1 40 ? -4.623 31.284 4.425 1.00 17.26 ? 37 ALA A H 1 +ATOM 519 H HA . ALA A 1 40 ? -2.995 30.343 2.589 1.00 16.74 ? 37 ALA A HA 1 +ATOM 520 H HB1 . ALA A 1 40 ? -3.115 28.350 3.779 1.00 17.24 ? 37 ALA A HB1 1 +ATOM 521 H HB2 . ALA A 1 40 ? -2.887 29.572 4.768 1.00 17.24 ? 37 ALA A HB2 1 +ATOM 522 H HB3 . ALA A 1 40 ? -4.332 28.928 4.621 1.00 17.24 ? 37 ALA A HB3 1 +ATOM 523 N N . THR A 1 41 ? -6.041 29.753 2.112 1.00 15.07 ? 38 THR A N 1 +ATOM 524 C CA . THR A 1 41 ? -7.035 29.240 1.154 1.00 20.20 ? 38 THR A CA 1 +ATOM 525 C C . THR A 1 41 ? -6.670 29.653 -0.264 1.00 16.50 ? 38 THR A C 1 +ATOM 526 O O . THR A 1 41 ? -6.946 28.930 -1.238 1.00 21.01 ? 38 THR A O 1 +ATOM 527 C CB . THR A 1 41 ? -8.433 29.767 1.475 1.00 25.86 ? 38 THR A CB 1 +ATOM 528 O OG1 . THR A 1 41 ? -8.849 29.272 2.753 1.00 23.44 ? 38 THR A OG1 1 +ATOM 529 C CG2 . THR A 1 41 ? -9.459 29.306 0.415 1.00 26.42 ? 38 THR A CG2 1 +ATOM 530 H H . THR A 1 41 ? -6.370 30.257 2.725 1.00 18.08 ? 38 THR A H 1 +ATOM 531 H HA . THR A 1 41 ? -7.055 28.272 1.197 1.00 24.24 ? 38 THR A HA 1 +ATOM 532 H HB . THR A 1 41 ? -8.420 30.737 1.491 1.00 31.03 ? 38 THR A HB 1 +ATOM 533 H HG1 . THR A 1 41 ? -8.314 29.527 3.348 1.00 28.13 ? 38 THR A HG1 1 +ATOM 534 H HG21 . THR A 1 41 ? -10.339 29.649 0.634 1.00 31.70 ? 38 THR A HG21 1 +ATOM 535 H HG22 . THR A 1 41 ? -9.202 29.635 -0.461 1.00 31.70 ? 38 THR A HG22 1 +ATOM 536 H HG23 . THR A 1 41 ? -9.496 28.337 0.388 1.00 31.70 ? 38 THR A HG23 1 +ATOM 537 N N . TYR A 1 42 ? -6.064 30.829 -0.390 1.00 16.31 ? 39 TYR A N 1 +ATOM 538 C CA . TYR A 1 42 ? -5.652 31.335 -1.694 1.00 18.99 ? 39 TYR A CA 1 +ATOM 539 C C . TYR A 1 42 ? -4.148 31.329 -1.844 1.00 19.61 ? 39 TYR A C 1 +ATOM 540 O O . TYR A 1 42 ? -3.619 31.739 -2.876 1.00 17.60 ? 39 TYR A O 1 +ATOM 541 C CB . TYR A 1 42 ? -6.214 32.735 -1.898 1.00 24.43 ? 39 TYR A CB 1 +ATOM 542 C CG . TYR A 1 42 ? -7.712 32.694 -1.905 1.00 27.78 ? 39 TYR A CG 1 +ATOM 543 C CD1 . TYR A 1 42 ? -8.402 32.327 -3.050 1.00 27.35 ? 39 TYR A CD1 1 +ATOM 544 C CD2 . TYR A 1 42 ? -8.439 32.944 -0.753 1.00 27.94 ? 39 TYR A CD2 1 +ATOM 545 C CE1 . TYR A 1 42 ? -9.766 32.260 -3.063 1.00 34.08 ? 39 TYR A CE1 1 +ATOM 546 C CE2 . TYR A 1 42 ? -9.824 32.886 -0.762 1.00 26.40 ? 39 TYR A CE2 1 +ATOM 547 C CZ . TYR A 1 42 ? -10.476 32.530 -1.916 1.00 35.29 ? 39 TYR A CZ 1 +ATOM 548 O OH . TYR A 1 42 ? -11.853 32.467 -1.938 1.00 45.28 ? 39 TYR A OH 1 +ATOM 549 H H . TYR A 1 42 ? -5.880 31.354 0.265 1.00 19.57 ? 39 TYR A H 1 +ATOM 550 H HA . TYR A 1 42 ? -6.022 30.762 -2.384 1.00 22.78 ? 39 TYR A HA 1 +ATOM 551 H HB2 . TYR A 1 42 ? -5.924 33.310 -1.173 1.00 29.31 ? 39 TYR A HB2 1 +ATOM 552 H HB3 . TYR A 1 42 ? -5.911 33.084 -2.751 1.00 29.31 ? 39 TYR A HB3 1 +ATOM 553 H HD1 . TYR A 1 42 ? -7.928 32.142 -3.829 1.00 32.82 ? 39 TYR A HD1 1 +ATOM 554 H HD2 . TYR A 1 42 ? -7.994 33.183 0.028 1.00 33.53 ? 39 TYR A HD2 1 +ATOM 555 H HE1 . TYR A 1 42 ? -10.213 32.026 -3.844 1.00 40.89 ? 39 TYR A HE1 1 +ATOM 556 H HE2 . TYR A 1 42 ? -10.306 33.067 0.012 1.00 31.68 ? 39 TYR A HE2 1 +ATOM 557 H HH . TYR A 1 42 ? -12.161 32.652 -1.179 1.00 54.34 ? 39 TYR A HH 1 +ATOM 558 N N . GLY A 1 43 ? -3.457 30.830 -0.827 1.00 13.07 ? 40 GLY A N 1 +ATOM 559 C CA . GLY A 1 43 ? -2.010 30.824 -0.825 1.00 12.10 ? 40 GLY A CA 1 +ATOM 560 C C . GLY A 1 43 ? -1.397 32.212 -0.826 1.00 12.58 ? 40 GLY A C 1 +ATOM 561 O O . GLY A 1 43 ? -0.278 32.384 -1.305 1.00 13.99 ? 40 GLY A O 1 +ATOM 562 H H . GLY A 1 43 ? -3.810 30.487 -0.121 1.00 15.69 ? 40 GLY A H 1 +ATOM 563 H HA2 . GLY A 1 43 ? -1.694 30.354 -0.038 1.00 14.52 ? 40 GLY A HA2 1 +ATOM 564 H HA3 . GLY A 1 43 ? -1.692 30.352 -1.610 1.00 14.52 ? 40 GLY A HA3 1 +ATOM 565 N N . LYS A 1 44 ? -2.102 33.193 -0.248 1.00 13.16 ? 41 LYS A N 1 +ATOM 566 C CA . LYS A 1 44 ? -1.802 34.607 -0.465 1.00 14.01 ? 41 LYS A CA 1 +ATOM 567 C C . LYS A 1 44 ? -1.278 35.299 0.777 1.00 13.76 ? 41 LYS A C 1 +ATOM 568 O O . LYS A 1 44 ? -1.895 35.198 1.859 1.00 13.67 ? 41 LYS A O 1 +ATOM 569 C CB . LYS A 1 44 ? -3.080 35.320 -0.960 1.00 15.41 ? 41 LYS A CB 1 +ATOM 570 C CG . LYS A 1 44 ? -2.944 36.821 -1.214 1.00 16.64 ? 41 LYS A CG 1 +ATOM 571 C CD . LYS A 1 44 ? -4.273 37.391 -1.734 1.00 18.27 ? 41 LYS A CD 1 +ATOM 572 C CE . LYS A 1 44 ? -4.211 38.893 -1.920 1.00 33.90 ? 41 LYS A CE 1 +ATOM 573 N NZ . LYS A 1 44 ? -5.545 39.527 -2.248 1.00 35.10 ? 41 LYS A NZ 1 +ATOM 574 H H . LYS A 1 44 ? -2.767 33.059 0.281 1.00 15.80 ? 41 LYS A H 1 +ATOM 575 H HA . LYS A 1 44 ? -1.127 34.684 -1.158 1.00 16.81 ? 41 LYS A HA 1 +ATOM 576 H HB2 . LYS A 1 44 ? -3.358 34.909 -1.793 1.00 18.50 ? 41 LYS A HB2 1 +ATOM 577 H HB3 . LYS A 1 44 ? -3.775 35.201 -0.293 1.00 18.50 ? 41 LYS A HB3 1 +ATOM 578 H HG2 . LYS A 1 44 ? -2.718 37.271 -0.385 1.00 19.97 ? 41 LYS A HG2 1 +ATOM 579 H HG3 . LYS A 1 44 ? -2.259 36.976 -1.883 1.00 19.97 ? 41 LYS A HG3 1 +ATOM 580 H HD2 . LYS A 1 44 ? -4.479 36.988 -2.592 1.00 21.93 ? 41 LYS A HD2 1 +ATOM 581 H HD3 . LYS A 1 44 ? -4.976 37.195 -1.095 1.00 21.93 ? 41 LYS A HD3 1 +ATOM 582 H HE2 . LYS A 1 44 ? -3.886 39.296 -1.100 1.00 40.69 ? 41 LYS A HE2 1 +ATOM 583 H HE3 . LYS A 1 44 ? -3.602 39.092 -2.648 1.00 40.69 ? 41 LYS A HE3 1 +ATOM 584 H HZ1 . LYS A 1 44 ? -5.447 40.407 -2.346 1.00 42.11 ? 41 LYS A HZ1 1 +ATOM 585 H HZ2 . LYS A 1 44 ? -5.866 39.186 -3.004 1.00 42.11 ? 41 LYS A HZ2 1 +ATOM 586 H HZ3 . LYS A 1 44 ? -6.125 39.372 -1.591 1.00 42.11 ? 41 LYS A HZ3 1 +ATOM 587 N N . LEU A 1 45 ? -0.153 35.991 0.628 1.00 13.96 ? 42 LEU A N 1 +ATOM 588 C CA . LEU A 1 45 ? 0.406 36.835 1.702 1.00 13.85 ? 42 LEU A CA 1 +ATOM 589 C C . LEU A 1 45 ? 0.432 38.291 1.261 1.00 16.58 ? 42 LEU A C 1 +ATOM 590 O O . LEU A 1 45 ? 0.823 38.592 0.131 1.00 15.62 ? 42 LEU A O 1 +ATOM 591 C CB . LEU A 1 45 ? 1.847 36.420 1.995 1.00 17.93 ? 42 LEU A CB 1 +ATOM 592 C CG . LEU A 1 45 ? 2.072 35.034 2.565 1.00 25.09 ? 42 LEU A CG 1 +ATOM 593 C CD1 . LEU A 1 45 ? 3.519 34.655 2.383 1.00 28.01 ? 42 LEU A CD1 1 +ATOM 594 C CD2 . LEU A 1 45 ? 1.711 35.012 4.022 1.00 24.59 ? 42 LEU A CD2 1 +ATOM 595 H H . LEU A 1 45 ? 0.317 35.993 -0.092 1.00 16.75 ? 42 LEU A H 1 +ATOM 596 H HA . LEU A 1 45 ? -0.124 36.751 2.510 1.00 16.62 ? 42 LEU A HA 1 +ATOM 597 H HB2 . LEU A 1 45 ? 2.348 36.471 1.166 1.00 21.52 ? 42 LEU A HB2 1 +ATOM 598 H HB3 . LEU A 1 45 ? 2.218 37.052 2.630 1.00 21.52 ? 42 LEU A HB3 1 +ATOM 599 H HG . LEU A 1 45 ? 1.518 34.391 2.095 1.00 30.10 ? 42 LEU A HG 1 +ATOM 600 H HD11 . LEU A 1 45 ? 3.661 33.768 2.749 1.00 33.61 ? 42 LEU A HD11 1 +ATOM 601 H HD12 . LEU A 1 45 ? 3.731 34.662 1.437 1.00 33.61 ? 42 LEU A HD12 1 +ATOM 602 H HD13 . LEU A 1 45 ? 4.075 35.299 2.851 1.00 33.61 ? 42 LEU A HD13 1 +ATOM 603 H HD21 . LEU A 1 45 ? 1.860 34.119 4.371 1.00 29.51 ? 42 LEU A HD21 1 +ATOM 604 H HD22 . LEU A 1 45 ? 2.268 35.650 4.495 1.00 29.51 ? 42 LEU A HD22 1 +ATOM 605 H HD23 . LEU A 1 45 ? 0.776 35.253 4.119 1.00 29.51 ? 42 LEU A HD23 1 +ATOM 606 N N . THR A 1 46 ? 0.061 39.188 2.163 1.00 15.76 ? 43 THR A N 1 +ATOM 607 C CA . THR A 1 46 ? 0.221 40.626 1.949 1.00 17.05 ? 43 THR A CA 1 +ATOM 608 C C . THR A 1 46 ? 0.904 41.184 3.192 1.00 19.99 ? 43 THR A C 1 +ATOM 609 O O . THR A 1 46 ? 0.382 41.076 4.296 1.00 17.27 ? 43 THR A O 1 +ATOM 610 C CB . THR A 1 46 ? -1.134 41.321 1.739 1.00 21.36 ? 43 THR A CB 1 +ATOM 611 O OG1 . THR A 1 46 ? -1.940 41.141 2.898 1.00 34.36 ? 43 THR A OG1 1 +ATOM 612 C CG2 . THR A 1 46 ? -1.883 40.707 0.560 1.00 24.30 ? 43 THR A CG2 1 +ATOM 613 H H . THR A 1 46 ? -0.293 38.989 2.921 1.00 18.91 ? 43 THR A H 1 +ATOM 614 H HA . THR A 1 46 ? 0.785 40.787 1.177 1.00 20.46 ? 43 THR A HA 1 +ATOM 615 H HB . THR A 1 46 ? -1.000 42.267 1.570 1.00 25.63 ? 43 THR A HB 1 +ATOM 616 H HG1 . THR A 1 46 ? -1.558 41.474 3.568 1.00 41.23 ? 43 THR A HG1 1 +ATOM 617 H HG21 . THR A 1 46 ? -2.735 41.155 0.439 1.00 29.16 ? 43 THR A HG21 1 +ATOM 618 H HG22 . THR A 1 46 ? -1.359 40.801 -0.251 1.00 29.16 ? 43 THR A HG22 1 +ATOM 619 H HG23 . THR A 1 46 ? -2.043 39.764 0.724 1.00 29.16 ? 43 THR A HG23 1 +ATOM 620 N N . LEU A 1 47 ? 2.075 41.767 3.013 1.00 17.05 ? 44 LEU A N 1 +ATOM 621 C CA . LEU A 1 47 ? 2.901 42.186 4.145 1.00 19.32 ? 44 LEU A CA 1 +ATOM 622 C C . LEU A 1 47 ? 3.623 43.468 3.815 1.00 19.86 ? 44 LEU A C 1 +ATOM 623 O O . LEU A 1 47 ? 3.964 43.707 2.653 1.00 18.99 ? 44 LEU A O 1 +ATOM 624 C CB . LEU A 1 47 ? 3.941 41.101 4.433 1.00 20.19 ? 44 LEU A CB 1 +ATOM 625 C CG . LEU A 1 47 ? 3.397 39.809 5.042 1.00 21.08 ? 44 LEU A CG 1 +ATOM 626 C CD1 . LEU A 1 47 ? 4.281 38.624 4.711 1.00 21.30 ? 44 LEU A CD1 1 +ATOM 627 C CD2 . LEU A 1 47 ? 3.308 40.000 6.532 1.00 20.51 ? 44 LEU A CD2 1 +ATOM 628 H H . LEU A 1 47 ? 2.422 41.935 2.244 1.00 20.46 ? 44 LEU A H 1 +ATOM 629 H HA . LEU A 1 47 ? 2.351 42.320 4.932 1.00 23.19 ? 44 LEU A HA 1 +ATOM 630 H HB2 . LEU A 1 47 ? 4.379 40.867 3.600 1.00 24.22 ? 44 LEU A HB2 1 +ATOM 631 H HB3 . LEU A 1 47 ? 4.596 41.460 5.052 1.00 24.22 ? 44 LEU A HB3 1 +ATOM 632 H HG . LEU A 1 47 ? 2.506 39.637 4.698 1.00 25.30 ? 44 LEU A HG 1 +ATOM 633 H HD11 . LEU A 1 47 ? 3.903 37.826 5.114 1.00 25.56 ? 44 LEU A HD11 1 +ATOM 634 H HD12 . LEU A 1 47 ? 4.322 38.521 3.747 1.00 25.56 ? 44 LEU A HD12 1 +ATOM 635 H HD13 . LEU A 1 47 ? 5.170 38.785 5.065 1.00 25.56 ? 44 LEU A HD13 1 +ATOM 636 H HD21 . LEU A 1 47 ? 2.963 39.187 6.934 1.00 24.61 ? 44 LEU A HD21 1 +ATOM 637 H HD22 . LEU A 1 47 ? 4.193 40.191 6.879 1.00 24.61 ? 44 LEU A HD22 1 +ATOM 638 H HD23 . LEU A 1 47 ? 2.711 40.741 6.720 1.00 24.61 ? 44 LEU A HD23 1 +ATOM 639 N N . LYS A 1 48 ? 3.844 44.297 4.832 1.00 18.83 ? 45 LYS A N 1 +ATOM 640 C CA . LYS A 1 48 ? 4.690 45.462 4.693 1.00 19.64 ? 45 LYS A CA 1 +ATOM 641 C C . LYS A 1 48 ? 5.793 45.351 5.738 1.00 21.01 ? 45 LYS A C 1 +ATOM 642 O O . LYS A 1 48 ? 5.532 45.030 6.912 1.00 18.78 ? 45 LYS A O 1 +ATOM 643 C CB . LYS A 1 48 ? 3.887 46.758 4.851 1.00 21.39 ? 45 LYS A CB 1 +ATOM 644 C CG . LYS A 1 48 ? 4.729 48.030 4.738 1.00 22.65 ? 45 LYS A CG 1 +ATOM 645 C CD . LYS A 1 48 ? 3.941 49.286 5.077 1.00 25.34 ? 45 LYS A CD 1 +ATOM 646 C CE . LYS A 1 48 ? 4.852 50.501 5.169 1.00 25.80 ? 45 LYS A CE 1 +ATOM 647 N NZ . LYS A 1 48 ? 4.132 51.701 5.603 1.00 27.76 ? 45 LYS A NZ 1 +ATOM 648 H H . LYS A 1 48 ? 3.509 44.200 5.618 1.00 22.59 ? 45 LYS A H 1 +ATOM 649 H HA . LYS A 1 48 ? 5.099 45.460 3.813 1.00 23.57 ? 45 LYS A HA 1 +ATOM 650 H HB2 . LYS A 1 48 ? 3.208 46.791 4.158 1.00 25.66 ? 45 LYS A HB2 1 +ATOM 651 H HB3 . LYS A 1 48 ? 3.465 46.759 5.724 1.00 25.66 ? 45 LYS A HB3 1 +ATOM 652 H HG2 . LYS A 1 48 ? 5.477 47.970 5.353 1.00 27.18 ? 45 LYS A HG2 1 +ATOM 653 H HG3 . LYS A 1 48 ? 5.053 48.116 3.828 1.00 27.18 ? 45 LYS A HG3 1 +ATOM 654 H HD2 . LYS A 1 48 ? 3.284 49.449 4.383 1.00 30.41 ? 45 LYS A HD2 1 +ATOM 655 H HD3 . LYS A 1 48 ? 3.503 49.168 5.935 1.00 30.41 ? 45 LYS A HD3 1 +ATOM 656 H HE2 . LYS A 1 48 ? 5.557 50.323 5.812 1.00 30.95 ? 45 LYS A HE2 1 +ATOM 657 H HE3 . LYS A 1 48 ? 5.235 50.678 4.295 1.00 30.95 ? 45 LYS A HE3 1 +ATOM 658 H HZ1 . LYS A 1 48 ? 3.482 51.891 5.026 1.00 33.31 ? 45 LYS A HZ1 1 +ATOM 659 H HZ2 . LYS A 1 48 ? 3.775 51.567 6.407 1.00 33.31 ? 45 LYS A HZ2 1 +ATOM 660 H HZ3 . LYS A 1 48 ? 4.691 52.392 5.646 1.00 33.31 ? 45 LYS A HZ3 1 +ATOM 661 N N . PHE A 1 49 ? 7.015 45.631 5.294 1.00 19.21 ? 46 PHE A N 1 +ATOM 662 C CA . PHE A 1 49 ? 8.207 45.591 6.123 1.00 18.95 ? 46 PHE A CA 1 +ATOM 663 C C . PHE A 1 49 ? 8.863 46.963 6.189 1.00 21.17 ? 46 PHE A C 1 +ATOM 664 O O . PHE A 1 49 ? 8.919 47.683 5.189 1.00 21.26 ? 46 PHE A O 1 +ATOM 665 C CB . PHE A 1 49 ? 9.209 44.587 5.551 1.00 17.97 ? 46 PHE A CB 1 +ATOM 666 C CG . PHE A 1 49 ? 8.661 43.191 5.430 1.00 16.70 ? 46 PHE A CG 1 +ATOM 667 C CD1 . PHE A 1 49 ? 8.642 42.332 6.538 1.00 17.56 ? 46 PHE A CD1 1 +ATOM 668 C CD2 . PHE A 1 49 ? 8.125 42.744 4.221 1.00 16.47 ? 46 PHE A CD2 1 +ATOM 669 C CE1 . PHE A 1 49 ? 8.109 41.055 6.422 1.00 14.90 ? 46 PHE A CE1 1 +ATOM 670 C CE2 . PHE A 1 49 ? 7.615 41.462 4.113 1.00 15.41 ? 46 PHE A CE2 1 +ATOM 671 C CZ . PHE A 1 49 ? 7.603 40.626 5.191 1.00 17.30 ? 46 PHE A CZ 1 +ATOM 672 H H . PHE A 1 49 ? 7.180 45.856 4.481 1.00 23.05 ? 46 PHE A H 1 +ATOM 673 H HA . PHE A 1 49 ? 7.970 45.316 7.023 1.00 22.75 ? 46 PHE A HA 1 +ATOM 674 H HB2 . PHE A 1 49 ? 9.475 44.880 4.665 1.00 21.57 ? 46 PHE A HB2 1 +ATOM 675 H HB3 . PHE A 1 49 ? 9.985 44.553 6.132 1.00 21.57 ? 46 PHE A HB3 1 +ATOM 676 H HD1 . PHE A 1 49 ? 8.982 42.620 7.354 1.00 21.07 ? 46 PHE A HD1 1 +ATOM 677 H HD2 . PHE A 1 49 ? 8.132 43.303 3.478 1.00 19.76 ? 46 PHE A HD2 1 +ATOM 678 H HE1 . PHE A 1 49 ? 8.106 40.481 7.154 1.00 17.88 ? 46 PHE A HE1 1 +ATOM 679 H HE2 . PHE A 1 49 ? 7.267 41.172 3.300 1.00 18.49 ? 46 PHE A HE2 1 +ATOM 680 H HZ . PHE A 1 49 ? 7.249 39.769 5.108 1.00 20.76 ? 46 PHE A HZ 1 +ATOM 681 N N . ILE A 1 50 ? 9.379 47.304 7.373 1.00 20.66 ? 47 ILE A N 1 +ATOM 682 C CA . ILE A 1 50 ? 10.141 48.534 7.579 1.00 22.01 ? 47 ILE A CA 1 +ATOM 683 C C . ILE A 1 50 ? 11.501 48.178 8.161 1.00 23.73 ? 47 ILE A C 1 +ATOM 684 O O . ILE A 1 50 ? 11.596 47.323 9.042 1.00 21.25 ? 47 ILE A O 1 +ATOM 685 C CB . ILE A 1 50 ? 9.469 49.427 8.625 1.00 28.21 ? 47 ILE A CB 1 +ATOM 686 C CG1 . ILE A 1 50 ? 8.023 49.749 8.244 1.00 35.14 ? 47 ILE A CG1 1 +ATOM 687 C CG2 . ILE A 1 50 ? 10.286 50.692 8.845 1.00 38.54 ? 47 ILE A CG2 1 +ATOM 688 C CD1 . ILE A 1 50 ? 7.878 50.907 7.338 1.00 36.65 ? 47 ILE A CD1 1 +ATOM 689 H H . ILE A 1 50 ? 9.297 46.828 8.085 1.00 24.79 ? 47 ILE A H 1 +ATOM 690 H HA . ILE A 1 50 ? 10.252 49.021 6.747 1.00 26.41 ? 47 ILE A HA 1 +ATOM 691 H HB . ILE A 1 50 ? 9.451 48.938 9.463 1.00 33.85 ? 47 ILE A HB 1 +ATOM 692 H HG12 . ILE A 1 50 ? 7.640 48.976 7.800 1.00 42.16 ? 47 ILE A HG12 1 +ATOM 693 H HG13 . ILE A 1 50 ? 7.524 49.942 9.053 1.00 42.16 ? 47 ILE A HG13 1 +ATOM 694 H HG21 . ILE A 1 50 ? 9.843 51.242 9.510 1.00 46.25 ? 47 ILE A HG21 1 +ATOM 695 H HG22 . ILE A 1 50 ? 11.172 50.445 9.156 1.00 46.25 ? 47 ILE A HG22 1 +ATOM 696 H HG23 . ILE A 1 50 ? 10.352 51.175 8.006 1.00 46.25 ? 47 ILE A HG23 1 +ATOM 697 H HD11 . ILE A 1 50 ? 6.936 51.042 7.147 1.00 43.98 ? 47 ILE A HD11 1 +ATOM 698 H HD12 . ILE A 1 50 ? 8.244 51.694 7.771 1.00 43.98 ? 47 ILE A HD12 1 +ATOM 699 H HD13 . ILE A 1 50 ? 8.360 50.726 6.516 1.00 43.98 ? 47 ILE A HD13 1 +ATOM 700 N N . CYS A 1 51 ? 12.548 48.857 7.719 1.00 22.51 ? 48 CYS A N 1 +ATOM 701 C CA . CYS A 1 51 ? 13.806 48.841 8.448 1.00 22.74 ? 48 CYS A CA 1 +ATOM 702 C C . CYS A 1 51 ? 13.696 49.874 9.570 1.00 23.97 ? 48 CYS A C 1 +ATOM 703 O O . CYS A 1 51 ? 13.540 51.068 9.332 1.00 25.29 ? 48 CYS A O 1 +ATOM 704 C CB . CYS A 1 51 ? 14.992 49.175 7.547 1.00 23.37 ? 48 CYS A CB 1 +ATOM 705 S SG . CYS A 1 51 ? 16.579 49.059 8.445 1.00 25.80 ? 48 CYS A SG 1 +ATOM 706 H H . CYS A 1 51 ? 12.557 49.333 7.003 1.00 27.01 ? 48 CYS A H 1 +ATOM 707 H HA . CYS A 1 51 ? 13.947 47.965 8.841 1.00 27.29 ? 48 CYS A HA 1 +ATOM 708 H HB2 . CYS A 1 51 ? 15.016 48.549 6.807 1.00 28.04 ? 48 CYS A HB2 1 +ATOM 709 H HB3 . CYS A 1 51 ? 14.896 50.082 7.217 1.00 28.04 ? 48 CYS A HB3 1 +ATOM 710 H HG . CYS A 1 51 ? 17.474 49.331 7.692 1.00 30.97 ? 48 CYS A HG 1 +ATOM 711 N N . THR A 1 52 ? 13.743 49.406 10.800 1.00 23.69 ? 49 THR A N 1 +ATOM 712 C CA . THR A 1 52 ? 13.518 50.288 11.933 1.00 24.93 ? 49 THR A CA 1 +ATOM 713 C C . THR A 1 52 ? 14.819 50.902 12.422 1.00 26.03 ? 49 THR A C 1 +ATOM 714 O O . THR A 1 52 ? 14.805 51.762 13.298 1.00 28.32 ? 49 THR A O 1 +ATOM 715 C CB . THR A 1 52 ? 12.902 49.501 13.078 1.00 24.38 ? 49 THR A CB 1 +ATOM 716 O OG1 . THR A 1 52 ? 13.799 48.446 13.445 1.00 23.60 ? 49 THR A OG1 1 +ATOM 717 C CG2 . THR A 1 52 ? 11.576 48.895 12.647 1.00 23.43 ? 49 THR A CG2 1 +ATOM 718 H H . THR A 1 52 ? 13.903 48.587 11.009 1.00 28.43 ? 49 THR A H 1 +ATOM 719 H HA . THR A 1 52 ? 12.910 51.000 11.680 1.00 29.92 ? 49 THR A HA 1 +ATOM 720 H HB . THR A 1 52 ? 12.750 50.085 13.837 1.00 29.26 ? 49 THR A HB 1 +ATOM 721 H HG1 . THR A 1 52 ? 13.474 48.000 14.078 1.00 28.32 ? 49 THR A HG1 1 +ATOM 722 H HG21 . THR A 1 52 ? 11.187 48.394 13.381 1.00 28.12 ? 49 THR A HG21 1 +ATOM 723 H HG22 . THR A 1 52 ? 10.961 49.598 12.384 1.00 28.12 ? 49 THR A HG22 1 +ATOM 724 H HG23 . THR A 1 52 ? 11.713 48.298 11.896 1.00 28.12 ? 49 THR A HG23 1 +ATOM 725 N N . THR A 1 53 ? 15.944 50.443 11.898 1.00 25.66 ? 50 THR A N 1 +ATOM 726 C CA . THR A 1 53 ? 17.255 50.909 12.370 1.00 28.74 ? 50 THR A CA 1 +ATOM 727 C C . THR A 1 53 ? 17.881 51.955 11.449 1.00 34.05 ? 50 THR A C 1 +ATOM 728 O O . THR A 1 53 ? 18.966 52.448 11.739 1.00 33.22 ? 50 THR A O 1 +ATOM 729 C CB . THR A 1 53 ? 18.243 49.725 12.498 1.00 26.03 ? 50 THR A CB 1 +ATOM 730 O OG1 . THR A 1 53 ? 18.134 48.889 11.337 1.00 24.81 ? 50 THR A OG1 1 +ATOM 731 C CG2 . THR A 1 53 ? 17.919 48.882 13.724 1.00 25.56 ? 50 THR A CG2 1 +ATOM 732 H H . THR A 1 53 ? 15.985 49.860 11.267 1.00 30.80 ? 50 THR A H 1 +ATOM 733 H HA . THR A 1 53 ? 17.149 51.308 13.248 1.00 34.49 ? 50 THR A HA 1 +ATOM 734 H HB . THR A 1 53 ? 19.150 50.059 12.579 1.00 31.24 ? 50 THR A HB 1 +ATOM 735 H HG1 . THR A 1 53 ? 18.319 49.331 10.647 1.00 29.77 ? 50 THR A HG1 1 +ATOM 736 H HG21 . THR A 1 53 ? 18.544 48.143 13.793 1.00 30.67 ? 50 THR A HG21 1 +ATOM 737 H HG22 . THR A 1 53 ? 17.982 49.424 14.526 1.00 30.67 ? 50 THR A HG22 1 +ATOM 738 H HG23 . THR A 1 53 ? 17.019 48.527 13.654 1.00 30.67 ? 50 THR A HG23 1 +ATOM 739 N N . GLY A 1 54 ? 17.209 52.283 10.345 1.00 27.80 ? 51 GLY A N 1 +ATOM 740 C CA . GLY A 1 54 ? 17.719 53.249 9.387 1.00 29.02 ? 51 GLY A CA 1 +ATOM 741 C C . GLY A 1 54 ? 17.688 52.689 7.972 1.00 33.12 ? 51 GLY A C 1 +ATOM 742 O O . GLY A 1 54 ? 16.703 52.082 7.564 1.00 29.75 ? 51 GLY A O 1 +ATOM 743 H H . GLY A 1 54 ? 16.445 51.952 10.131 1.00 33.35 ? 51 GLY A H 1 +ATOM 744 H HA2 . GLY A 1 54 ? 17.179 54.054 9.416 1.00 34.82 ? 51 GLY A HA2 1 +ATOM 745 H HA3 . GLY A 1 54 ? 18.634 53.480 9.611 1.00 34.82 ? 51 GLY A HA3 1 +ATOM 746 N N . LYS A 1 55 ? 18.768 52.887 7.220 1.00 32.75 ? 52 LYS A N 1 +ATOM 747 C CA . LYS A 1 55 ? 18.867 52.328 5.863 1.00 33.84 ? 52 LYS A CA 1 +ATOM 748 C C . LYS A 1 55 ? 19.240 50.848 5.918 1.00 32.80 ? 52 LYS A C 1 +ATOM 749 O O . LYS A 1 55 ? 20.113 50.429 6.674 1.00 26.98 ? 52 LYS A O 1 +ATOM 750 C CB . LYS A 1 55 ? 19.908 53.111 5.048 1.00 33.94 ? 52 LYS A CB 1 +ATOM 751 C CG . LYS A 1 55 ? 20.109 52.641 3.615 1.00 39.22 ? 52 LYS A CG 1 +ATOM 752 C CD . LYS A 1 55 ? 21.218 53.429 2.928 1.00 42.14 ? 52 LYS A CD 1 +ATOM 753 H H . LYS A 1 55 ? 19.457 53.338 7.466 1.00 39.30 ? 52 LYS A H 1 +ATOM 754 H HA . LYS A 1 55 ? 18.008 52.409 5.419 1.00 40.61 ? 52 LYS A HA 1 +ATOM 755 H HB2 . LYS A 1 55 ? 19.633 54.041 5.013 1.00 40.73 ? 52 LYS A HB2 1 +ATOM 756 H HB3 . LYS A 1 55 ? 20.764 53.044 5.499 1.00 40.73 ? 52 LYS A HB3 1 +ATOM 757 H HG2 . LYS A 1 55 ? 20.358 51.704 3.616 1.00 47.07 ? 52 LYS A HG2 1 +ATOM 758 H HG3 . LYS A 1 55 ? 19.288 52.772 3.116 1.00 47.07 ? 52 LYS A HG3 1 +ATOM 759 N N . LEU A 1 56 ? 18.588 50.039 5.102 1.00 28.92 ? 53 LEU A N 1 +ATOM 760 C CA . LEU A 1 56 ? 18.953 48.637 5.033 1.00 24.73 ? 53 LEU A CA 1 +ATOM 761 C C . LEU A 1 56 ? 20.308 48.467 4.327 1.00 28.88 ? 53 LEU A C 1 +ATOM 762 O O . LEU A 1 56 ? 20.506 48.992 3.245 1.00 29.90 ? 53 LEU A O 1 +ATOM 763 C CB . LEU A 1 56 ? 17.866 47.886 4.278 1.00 25.82 ? 53 LEU A CB 1 +ATOM 764 C CG . LEU A 1 56 ? 17.835 46.388 4.469 1.00 22.15 ? 53 LEU A CG 1 +ATOM 765 C CD1 . LEU A 1 56 ? 17.465 46.060 5.933 1.00 21.45 ? 53 LEU A CD1 1 +ATOM 766 C CD2 . LEU A 1 56 ? 16.816 45.780 3.511 1.00 23.98 ? 53 LEU A CD2 1 +ATOM 767 H H . LEU A 1 56 ? 17.940 50.272 4.586 1.00 34.70 ? 53 LEU A H 1 +ATOM 768 H HA . LEU A 1 56 ? 19.020 48.271 5.929 1.00 29.68 ? 53 LEU A HA 1 +ATOM 769 H HB2 . LEU A 1 56 ? 17.005 48.230 4.562 1.00 30.99 ? 53 LEU A HB2 1 +ATOM 770 H HB3 . LEU A 1 56 ? 17.984 48.053 3.330 1.00 30.99 ? 53 LEU A HB3 1 +ATOM 771 H HG . LEU A 1 56 ? 18.709 46.014 4.275 1.00 26.58 ? 53 LEU A HG 1 +ATOM 772 H HD11 . LEU A 1 56 ? 17.448 45.096 6.045 1.00 25.74 ? 53 LEU A HD11 1 +ATOM 773 H HD12 . LEU A 1 56 ? 18.130 46.450 6.522 1.00 25.74 ? 53 LEU A HD12 1 +ATOM 774 H HD13 . LEU A 1 56 ? 16.591 46.432 6.128 1.00 25.74 ? 53 LEU A HD13 1 +ATOM 775 H HD21 . LEU A 1 56 ? 16.800 44.818 3.637 1.00 28.77 ? 53 LEU A HD21 1 +ATOM 776 H HD22 . LEU A 1 56 ? 15.942 46.154 3.701 1.00 28.77 ? 53 LEU A HD22 1 +ATOM 777 H HD23 . LEU A 1 56 ? 17.075 45.990 2.600 1.00 28.77 ? 53 LEU A HD23 1 +ATOM 778 N N . PRO A 1 57 ? 21.246 47.719 4.928 1.00 32.71 ? 54 PRO A N 1 +ATOM 779 C CA . PRO A 1 57 ? 22.592 47.588 4.337 1.00 32.55 ? 54 PRO A CA 1 +ATOM 780 C C . PRO A 1 57 ? 22.696 46.567 3.198 1.00 27.05 ? 54 PRO A C 1 +ATOM 781 O O . PRO A 1 57 ? 23.767 46.435 2.594 1.00 28.78 ? 54 PRO A O 1 +ATOM 782 C CB . PRO A 1 57 ? 23.434 47.106 5.513 1.00 35.55 ? 54 PRO A CB 1 +ATOM 783 C CG . PRO A 1 57 ? 22.443 46.323 6.352 1.00 30.64 ? 54 PRO A CG 1 +ATOM 784 C CD . PRO A 1 57 ? 21.158 47.072 6.245 1.00 25.37 ? 54 PRO A CD 1 +ATOM 785 H HA . PRO A 1 57 ? 22.919 48.450 4.035 1.00 39.05 ? 54 PRO A HA 1 +ATOM 786 H HB2 . PRO A 1 57 ? 24.151 46.535 5.197 1.00 42.67 ? 54 PRO A HB2 1 +ATOM 787 H HB3 . PRO A 1 57 ? 23.783 47.866 6.005 1.00 42.67 ? 54 PRO A HB3 1 +ATOM 788 H HG2 . PRO A 1 57 ? 22.348 45.427 5.992 1.00 36.77 ? 54 PRO A HG2 1 +ATOM 789 H HG3 . PRO A 1 57 ? 22.746 46.293 7.272 1.00 36.77 ? 54 PRO A HG3 1 +ATOM 790 H HD2 . PRO A 1 57 ? 20.406 46.460 6.271 1.00 30.44 ? 54 PRO A HD2 1 +ATOM 791 H HD3 . PRO A 1 57 ? 21.097 47.740 6.946 1.00 30.44 ? 54 PRO A HD3 1 +ATOM 792 N N . VAL A 1 58 ? 21.604 45.860 2.940 1.00 24.63 ? 55 VAL A N 1 +ATOM 793 C CA . VAL A 1 58 ? 21.517 44.883 1.865 1.00 26.80 ? 55 VAL A CA 1 +ATOM 794 C C . VAL A 1 58 ? 20.233 45.190 1.082 1.00 23.77 ? 55 VAL A C 1 +ATOM 795 O O . VAL A 1 58 ? 19.359 45.902 1.569 1.00 25.09 ? 55 VAL A O 1 +ATOM 796 C CB . VAL A 1 58 ? 21.499 43.432 2.418 1.00 22.99 ? 55 VAL A CB 1 +ATOM 797 C CG1 . VAL A 1 58 ? 22.762 43.143 3.227 1.00 25.78 ? 55 VAL A CG1 1 +ATOM 798 C CG2 . VAL A 1 58 ? 20.222 43.155 3.286 1.00 21.52 ? 55 VAL A CG2 1 +ATOM 799 H H . VAL A 1 58 ? 20.875 45.932 3.390 1.00 29.56 ? 55 VAL A H 1 +ATOM 800 H HA . VAL A 1 58 ? 22.277 44.981 1.269 1.00 32.15 ? 55 VAL A HA 1 +ATOM 801 H HB . VAL A 1 58 ? 21.483 42.816 1.669 1.00 27.59 ? 55 VAL A HB 1 +ATOM 802 H HG11 . VAL A 1 58 ? 22.722 42.233 3.559 1.00 30.94 ? 55 VAL A HG11 1 +ATOM 803 H HG12 . VAL A 1 58 ? 23.536 43.253 2.653 1.00 30.94 ? 55 VAL A HG12 1 +ATOM 804 H HG13 . VAL A 1 58 ? 22.809 43.765 3.970 1.00 30.94 ? 55 VAL A HG13 1 +ATOM 805 H HG21 . VAL A 1 58 ? 20.253 42.241 3.609 1.00 25.83 ? 55 VAL A HG21 1 +ATOM 806 H HG22 . VAL A 1 58 ? 20.211 43.771 4.035 1.00 25.83 ? 55 VAL A HG22 1 +ATOM 807 H HG23 . VAL A 1 58 ? 19.433 43.286 2.737 1.00 25.83 ? 55 VAL A HG23 1 +ATOM 808 N N . PRO A 1 59 ? 20.120 44.681 -0.142 1.00 23.89 ? 56 PRO A N 1 +ATOM 809 C CA . PRO A 1 59 ? 18.894 44.935 -0.901 1.00 23.66 ? 56 PRO A CA 1 +ATOM 810 C C . PRO A 1 59 ? 17.718 44.149 -0.343 1.00 21.99 ? 56 PRO A C 1 +ATOM 811 O O . PRO A 1 59 ? 17.889 43.015 0.117 1.00 21.00 ? 56 PRO A O 1 +ATOM 812 C CB . PRO A 1 59 ? 19.246 44.439 -2.309 1.00 24.39 ? 56 PRO A CB 1 +ATOM 813 C CG . PRO A 1 59 ? 20.757 44.457 -2.334 1.00 25.53 ? 56 PRO A CG 1 +ATOM 814 C CD . PRO A 1 59 ? 21.153 44.040 -0.965 1.00 24.66 ? 56 PRO A CD 1 +ATOM 815 H HA . PRO A 1 59 ? 18.684 45.882 -0.923 1.00 28.40 ? 56 PRO A HA 1 +ATOM 816 H HB2 . PRO A 1 59 ? 18.909 43.538 -2.436 1.00 29.27 ? 56 PRO A HB2 1 +ATOM 817 H HB3 . PRO A 1 59 ? 18.881 45.044 -2.974 1.00 29.27 ? 56 PRO A HB3 1 +ATOM 818 H HG2 . PRO A 1 59 ? 21.083 43.827 -2.995 1.00 30.63 ? 56 PRO A HG2 1 +ATOM 819 H HG3 . PRO A 1 59 ? 21.072 45.355 -2.526 1.00 30.63 ? 56 PRO A HG3 1 +ATOM 820 H HD2 . PRO A 1 59 ? 21.111 43.075 -0.876 1.00 29.60 ? 56 PRO A HD2 1 +ATOM 821 H HD3 . PRO A 1 59 ? 22.031 44.386 -0.743 1.00 29.60 ? 56 PRO A HD3 1 +ATOM 822 N N . TRP A 1 60 ? 16.543 44.756 -0.412 1.00 21.89 ? 57 TRP A N 1 +ATOM 823 C CA . TRP A 1 60 ? 15.330 44.151 0.099 1.00 20.55 ? 57 TRP A CA 1 +ATOM 824 C C . TRP A 1 60 ? 15.079 42.775 -0.503 1.00 19.64 ? 57 TRP A C 1 +ATOM 825 O O . TRP A 1 60 ? 14.708 41.849 0.219 1.00 18.42 ? 57 TRP A O 1 +ATOM 826 C CB . TRP A 1 60 ? 14.137 45.066 -0.144 1.00 21.03 ? 57 TRP A CB 1 +ATOM 827 C CG . TRP A 1 60 ? 14.008 46.145 0.890 1.00 21.51 ? 57 TRP A CG 1 +ATOM 828 C CD1 . TRP A 1 60 ? 14.297 47.480 0.744 1.00 25.14 ? 57 TRP A CD1 1 +ATOM 829 C CD2 . TRP A 1 60 ? 13.541 45.977 2.218 1.00 20.67 ? 57 TRP A CD2 1 +ATOM 830 N NE1 . TRP A 1 60 ? 14.032 48.153 1.925 1.00 23.90 ? 57 TRP A NE1 1 +ATOM 831 C CE2 . TRP A 1 60 ? 13.567 47.247 2.843 1.00 21.73 ? 57 TRP A CE2 1 +ATOM 832 C CE3 . TRP A 1 60 ? 13.096 44.874 2.945 1.00 19.28 ? 57 TRP A CE3 1 +ATOM 833 C CZ2 . TRP A 1 60 ? 13.161 47.435 4.166 1.00 24.82 ? 57 TRP A CZ2 1 +ATOM 834 C CZ3 . TRP A 1 60 ? 12.708 45.054 4.254 1.00 19.03 ? 57 TRP A CZ3 1 +ATOM 835 C CH2 . TRP A 1 60 ? 12.734 46.327 4.856 1.00 21.04 ? 57 TRP A CH2 1 +ATOM 836 H H . TRP A 1 60 ? 16.423 45.534 -0.758 1.00 26.27 ? 57 TRP A H 1 +ATOM 837 H HA . TRP A 1 60 ? 15.422 44.038 1.058 1.00 24.66 ? 57 TRP A HA 1 +ATOM 838 H HB2 . TRP A 1 60 ? 14.238 45.492 -1.009 1.00 25.23 ? 57 TRP A HB2 1 +ATOM 839 H HB3 . TRP A 1 60 ? 13.325 44.537 -0.127 1.00 25.23 ? 57 TRP A HB3 1 +ATOM 840 H HD1 . TRP A 1 60 ? 14.621 47.874 -0.033 1.00 30.17 ? 57 TRP A HD1 1 +ATOM 841 H HE1 . TRP A 1 60 ? 14.141 48.995 2.059 1.00 28.68 ? 57 TRP A HE1 1 +ATOM 842 H HE3 . TRP A 1 60 ? 13.070 44.030 2.556 1.00 23.14 ? 57 TRP A HE3 1 +ATOM 843 H HZ2 . TRP A 1 60 ? 13.188 48.275 4.567 1.00 29.78 ? 57 TRP A HZ2 1 +ATOM 844 H HZ3 . TRP A 1 60 ? 12.408 44.324 4.745 1.00 22.83 ? 57 TRP A HZ3 1 +ATOM 845 H HH2 . TRP A 1 60 ? 12.464 46.418 5.741 1.00 25.25 ? 57 TRP A HH2 1 +ATOM 846 N N . PRO A 1 61 ? 15.280 42.622 -1.821 1.00 20.37 ? 58 PRO A N 1 +ATOM 847 C CA . PRO A 1 61 ? 14.972 41.293 -2.375 1.00 19.59 ? 58 PRO A CA 1 +ATOM 848 C C . PRO A 1 61 ? 15.805 40.167 -1.779 1.00 18.90 ? 58 PRO A C 1 +ATOM 849 O O . PRO A 1 61 ? 15.356 39.033 -1.838 1.00 18.01 ? 58 PRO A O 1 +ATOM 850 C CB . PRO A 1 61 ? 15.262 41.437 -3.885 1.00 20.90 ? 58 PRO A CB 1 +ATOM 851 C CG . PRO A 1 61 ? 15.067 42.904 -4.167 1.00 22.78 ? 58 PRO A CG 1 +ATOM 852 C CD . PRO A 1 61 ? 15.522 43.634 -2.870 1.00 21.99 ? 58 PRO A CD 1 +ATOM 853 H HA . PRO A 1 61 ? 14.031 41.091 -2.251 1.00 23.51 ? 58 PRO A HA 1 +ATOM 854 H HB2 . PRO A 1 61 ? 16.175 41.168 -4.072 1.00 25.08 ? 58 PRO A HB2 1 +ATOM 855 H HB3 . PRO A 1 61 ? 14.633 40.901 -4.393 1.00 25.08 ? 58 PRO A HB3 1 +ATOM 856 H HG2 . PRO A 1 61 ? 15.618 43.168 -4.921 1.00 27.34 ? 58 PRO A HG2 1 +ATOM 857 H HG3 . PRO A 1 61 ? 14.130 43.080 -4.349 1.00 27.34 ? 58 PRO A HG3 1 +ATOM 858 H HD2 . PRO A 1 61 ? 16.466 43.855 -2.918 1.00 26.39 ? 58 PRO A HD2 1 +ATOM 859 H HD3 . PRO A 1 61 ? 14.978 44.421 -2.714 1.00 26.39 ? 58 PRO A HD3 1 +ATOM 860 N N . THR A 1 62 ? 16.955 40.462 -1.176 1.00 19.40 ? 59 THR A N 1 +ATOM 861 C CA . THR A 1 62 ? 17.729 39.394 -0.565 1.00 18.98 ? 59 THR A CA 1 +ATOM 862 C C . THR A 1 62 ? 17.133 38.899 0.734 1.00 17.74 ? 59 THR A C 1 +ATOM 863 O O . THR A 1 62 ? 17.569 37.870 1.250 1.00 17.39 ? 59 THR A O 1 +ATOM 864 C CB . THR A 1 62 ? 19.198 39.774 -0.291 1.00 21.16 ? 59 THR A CB 1 +ATOM 865 O OG1 . THR A 1 62 ? 19.270 40.753 0.756 1.00 21.37 ? 59 THR A OG1 1 +ATOM 866 C CG2 . THR A 1 62 ? 19.864 40.306 -1.570 1.00 24.80 ? 59 THR A CG2 1 +ATOM 867 H H . THR A 1 62 ? 17.298 41.247 -1.110 1.00 23.28 ? 59 THR A H 1 +ATOM 868 H HA . THR A 1 62 ? 17.739 38.643 -1.179 1.00 22.78 ? 59 THR A HA 1 +ATOM 869 H HB . THR A 1 62 ? 19.681 38.980 -0.012 1.00 25.39 ? 59 THR A HB 1 +ATOM 870 H HG1 . THR A 1 62 ? 18.848 41.444 0.532 1.00 25.64 ? 59 THR A HG1 1 +ATOM 871 H HG21 . THR A 1 62 ? 20.787 40.543 -1.389 1.00 29.76 ? 59 THR A HG21 1 +ATOM 872 H HG22 . THR A 1 62 ? 19.842 39.627 -2.262 1.00 29.76 ? 59 THR A HG22 1 +ATOM 873 H HG23 . THR A 1 62 ? 19.392 41.093 -1.886 1.00 29.76 ? 59 THR A HG23 1 +ATOM 874 N N . LEU A 1 63 ? 16.171 39.633 1.289 1.00 17.38 ? 60 LEU A N 1 +ATOM 875 C CA . LEU A 1 63 ? 15.544 39.235 2.549 1.00 16.33 ? 60 LEU A CA 1 +ATOM 876 C C . LEU A 1 63 ? 14.170 38.587 2.381 1.00 15.33 ? 60 LEU A C 1 +ATOM 877 O O . LEU A 1 63 ? 13.618 38.078 3.344 1.00 14.59 ? 60 LEU A O 1 +ATOM 878 C CB . LEU A 1 63 ? 15.385 40.454 3.459 1.00 16.71 ? 60 LEU A CB 1 +ATOM 879 C CG . LEU A 1 63 ? 16.662 41.199 3.816 1.00 17.78 ? 60 LEU A CG 1 +ATOM 880 C CD1 . LEU A 1 63 ? 16.324 42.342 4.760 1.00 18.16 ? 60 LEU A CD1 1 +ATOM 881 C CD2 . LEU A 1 63 ? 17.662 40.238 4.441 1.00 24.63 ? 60 LEU A CD2 1 +ATOM 882 H H . LEU A 1 63 ? 15.863 40.364 0.957 1.00 20.86 ? 60 LEU A H 1 +ATOM 883 H HA . LEU A 1 63 ? 16.121 38.598 3.000 1.00 19.60 ? 60 LEU A HA 1 +ATOM 884 H HB2 . LEU A 1 63 ? 14.795 41.087 3.020 1.00 20.06 ? 60 LEU A HB2 1 +ATOM 885 H HB3 . LEU A 1 63 ? 14.980 40.163 4.291 1.00 20.06 ? 60 LEU A HB3 1 +ATOM 886 H HG . LEU A 1 63 ? 17.055 41.571 3.011 1.00 21.34 ? 60 LEU A HG 1 +ATOM 887 H HD11 . LEU A 1 63 ? 17.139 42.816 4.987 1.00 21.80 ? 60 LEU A HD11 1 +ATOM 888 H HD12 . LEU A 1 63 ? 15.703 42.943 4.319 1.00 21.80 ? 60 LEU A HD12 1 +ATOM 889 H HD13 . LEU A 1 63 ? 15.918 41.979 5.563 1.00 21.80 ? 60 LEU A HD13 1 +ATOM 890 H HD21 . LEU A 1 63 ? 18.470 40.725 4.663 1.00 29.55 ? 60 LEU A HD21 1 +ATOM 891 H HD22 . LEU A 1 63 ? 17.273 39.857 5.244 1.00 29.55 ? 60 LEU A HD22 1 +ATOM 892 H HD23 . LEU A 1 63 ? 17.863 39.534 3.804 1.00 29.55 ? 60 LEU A HD23 1 +ATOM 893 N N . VAL A 1 64 ? 13.609 38.621 1.171 1.00 15.49 ? 61 VAL A N 1 +ATOM 894 C CA . VAL A 1 64 ? 12.270 38.077 0.971 1.00 14.72 ? 61 VAL A CA 1 +ATOM 895 C C . VAL A 1 64 ? 12.133 36.640 1.483 1.00 14.26 ? 61 VAL A C 1 +ATOM 896 O O . VAL A 1 64 ? 11.221 36.350 2.246 1.00 13.80 ? 61 VAL A O 1 +ATOM 897 C CB . VAL A 1 64 ? 11.864 38.180 -0.517 1.00 15.28 ? 61 VAL A CB 1 +ATOM 898 C CG1 . VAL A 1 64 ? 10.575 37.428 -0.812 1.00 15.19 ? 61 VAL A CG1 1 +ATOM 899 C CG2 . VAL A 1 64 ? 11.684 39.633 -0.857 1.00 19.01 ? 61 VAL A CG2 1 +ATOM 900 H H . VAL A 1 64 ? 13.976 38.946 0.464 1.00 18.58 ? 61 VAL A H 1 +ATOM 901 H HA . VAL A 1 64 ? 11.645 38.620 1.476 1.00 17.67 ? 61 VAL A HA 1 +ATOM 902 H HB . VAL A 1 64 ? 12.570 37.816 -1.074 1.00 18.33 ? 61 VAL A HB 1 +ATOM 903 H HG11 . VAL A 1 64 ? 10.363 37.522 -1.754 1.00 18.23 ? 61 VAL A HG11 1 +ATOM 904 H HG12 . VAL A 1 64 ? 10.699 36.492 -0.592 1.00 18.23 ? 61 VAL A HG12 1 +ATOM 905 H HG13 . VAL A 1 64 ? 9.861 37.803 -0.273 1.00 18.23 ? 61 VAL A HG13 1 +ATOM 906 H HG21 . VAL A 1 64 ? 11.429 39.709 -1.790 1.00 22.82 ? 61 VAL A HG21 1 +ATOM 907 H HG22 . VAL A 1 64 ? 10.988 40.005 -0.293 1.00 22.82 ? 61 VAL A HG22 1 +ATOM 908 H HG23 . VAL A 1 64 ? 12.520 40.099 -0.704 1.00 22.82 ? 61 VAL A HG23 1 +ATOM 909 N N . THR A 1 65 ? 13.036 35.729 1.104 1.00 13.88 ? 62 THR A N 1 +ATOM 910 C CA . THR A 1 65 ? 12.846 34.333 1.509 1.00 15.71 ? 62 THR A CA 1 +ATOM 911 C C . THR A 1 65 ? 12.939 34.148 3.042 1.00 13.50 ? 62 THR A C 1 +ATOM 912 O O . THR A 1 65 ? 12.274 33.262 3.616 1.00 12.13 ? 62 THR A O 1 +ATOM 913 C CB . THR A 1 65 ? 13.830 33.404 0.810 1.00 13.63 ? 62 THR A CB 1 +ATOM 914 O OG1 . THR A 1 65 ? 15.160 33.905 0.980 1.00 14.50 ? 62 THR A OG1 1 +ATOM 915 C CG2 . THR A 1 65 ? 13.522 33.345 -0.695 1.00 14.04 ? 62 THR A CG2 1 +ATOM 916 H H . THR A 1 65 ? 13.738 35.885 0.632 1.00 16.65 ? 62 THR A H 1 +ATOM 917 H HA . THR A 1 65 ? 11.955 34.060 1.241 1.00 18.85 ? 62 THR A HA 1 +ATOM 918 H HB . THR A 1 65 ? 13.763 32.510 1.181 1.00 16.36 ? 62 THR A HB 1 +ATOM 919 H HG1 . THR A 1 65 ? 15.349 33.945 1.798 1.00 17.40 ? 62 THR A HG1 1 +ATOM 920 H HG21 . THR A 1 65 ? 14.149 32.753 -1.139 1.00 16.85 ? 62 THR A HG21 1 +ATOM 921 H HG22 . THR A 1 65 ? 12.621 33.013 -0.836 1.00 16.85 ? 62 THR A HG22 1 +ATOM 922 H HG23 . THR A 1 65 ? 13.596 34.231 -1.083 1.00 16.85 ? 62 THR A HG23 1 +ATOM 923 N N . THR A 1 66 ? 13.735 34.995 3.694 1.00 13.33 ? 63 THR A N 1 +ATOM 924 C CA . THR A 1 66 ? 13.903 34.918 5.138 1.00 13.26 ? 63 THR A CA 1 +ATOM 925 C C . THR A 1 66 ? 12.645 35.434 5.845 1.00 15.56 ? 63 THR A C 1 +ATOM 926 O O . THR A 1 66 ? 12.187 34.858 6.839 1.00 12.46 ? 63 THR A O 1 +ATOM 927 C CB . THR A 1 66 ? 15.115 35.756 5.553 1.00 14.23 ? 63 THR A CB 1 +ATOM 928 O OG1 . THR A 1 66 ? 16.297 35.182 4.981 1.00 14.80 ? 63 THR A OG1 1 +ATOM 929 C CG2 . THR A 1 66 ? 15.298 35.813 7.079 1.00 14.36 ? 63 THR A CG2 1 +ATOM 930 H H . THR A 1 66 ? 14.189 35.622 3.320 1.00 15.99 ? 63 THR A H 1 +ATOM 931 H HA . THR A 1 66 ? 14.055 33.998 5.402 1.00 15.91 ? 63 THR A HA 1 +ATOM 932 H HB . THR A 1 66 ? 15.007 36.662 5.224 1.00 17.08 ? 63 THR A HB 1 +ATOM 933 H HG1 . THR A 1 66 ? 16.236 35.175 4.144 1.00 17.76 ? 63 THR A HG1 1 +ATOM 934 H HG21 . THR A 1 66 ? 16.075 36.351 7.300 1.00 17.23 ? 63 THR A HG21 1 +ATOM 935 H HG22 . THR A 1 66 ? 14.514 36.207 7.492 1.00 17.23 ? 63 THR A HG22 1 +ATOM 936 H HG23 . THR A 1 66 ? 15.425 34.918 7.431 1.00 17.23 ? 63 THR A HG23 1 +ATOM 937 N N . LEU A 1 67 ? 12.096 36.524 5.319 1.00 13.01 ? 64 LEU A N 1 +ATOM 938 C CA . LEU A 1 67 ? 10.982 37.215 5.955 1.00 12.94 ? 64 LEU A CA 1 +ATOM 939 C C . LEU A 1 67 ? 9.696 36.436 5.696 1.00 16.68 ? 64 LEU A C 1 +ATOM 940 O O . LEU A 1 67 ? 8.892 36.255 6.598 1.00 15.59 ? 64 LEU A O 1 +ATOM 941 C CB . LEU A 1 67 ? 10.852 38.637 5.394 1.00 13.67 ? 64 LEU A CB 1 +ATOM 942 C CG . LEU A 1 67 ? 11.999 39.605 5.747 1.00 14.96 ? 64 LEU A CG 1 +ATOM 943 C CD1 . LEU A 1 67 ? 11.983 40.870 4.885 1.00 20.00 ? 64 LEU A CD1 1 +ATOM 944 C CD2 . LEU A 1 67 ? 11.950 40.017 7.225 1.00 14.79 ? 64 LEU A CD2 1 +ATOM 945 H H . LEU A 1 67 ? 12.354 36.887 4.584 1.00 15.61 ? 64 LEU A H 1 +ATOM 946 H HA . LEU A 1 67 ? 11.130 37.268 6.912 1.00 15.53 ? 64 LEU A HA 1 +ATOM 947 H HB2 . LEU A 1 67 ? 10.807 38.581 4.427 1.00 16.40 ? 64 LEU A HB2 1 +ATOM 948 H HB3 . LEU A 1 67 ? 10.030 39.025 5.733 1.00 16.40 ? 64 LEU A HB3 1 +ATOM 949 H HG . LEU A 1 67 ? 12.844 39.154 5.594 1.00 17.95 ? 64 LEU A HG 1 +ATOM 950 H HD11 . LEU A 1 67 ? 12.722 41.441 5.149 1.00 24.00 ? 64 LEU A HD11 1 +ATOM 951 H HD12 . LEU A 1 67 ? 12.075 40.618 3.953 1.00 24.00 ? 64 LEU A HD12 1 +ATOM 952 H HD13 . LEU A 1 67 ? 11.142 41.334 5.021 1.00 24.00 ? 64 LEU A HD13 1 +ATOM 953 H HD21 . LEU A 1 67 ? 12.685 40.624 7.407 1.00 17.75 ? 64 LEU A HD21 1 +ATOM 954 H HD22 . LEU A 1 67 ? 11.105 40.459 7.401 1.00 17.75 ? 64 LEU A HD22 1 +ATOM 955 H HD23 . LEU A 1 67 ? 12.031 39.224 7.776 1.00 17.75 ? 64 LEU A HD23 1 +HETATM 956 N N1 . CRO A 1 68 ? 9.558 35.883 4.493 1.00 15.01 ? 66 CRO A N1 1 +HETATM 957 C CA1 . CRO A 1 68 ? 8.415 35.088 4.161 1.00 11.75 ? 66 CRO A CA1 1 +HETATM 958 C CB1 . CRO A 1 68 ? 7.463 35.719 3.145 1.00 20.94 ? 66 CRO A CB1 1 +HETATM 959 C CG1 . CRO A 1 68 ? 7.020 37.003 3.745 1.00 20.14 ? 66 CRO A CG1 1 +HETATM 960 O OG1 . CRO A 1 68 ? 8.090 36.070 1.959 1.00 23.20 ? 66 CRO A OG1 1 +HETATM 961 C C1 . CRO A 1 68 ? 8.935 33.796 3.598 1.00 13.40 ? 66 CRO A C1 1 +HETATM 962 N N2 . CRO A 1 68 ? 9.097 33.444 2.308 1.00 13.42 ? 66 CRO A N2 1 +HETATM 963 N N3 . CRO A 1 68 ? 9.410 32.737 4.460 1.00 12.57 ? 66 CRO A N3 1 +HETATM 964 C C2 . CRO A 1 68 ? 9.878 31.658 3.627 1.00 11.07 ? 66 CRO A C2 1 +HETATM 965 O O2 . CRO A 1 68 ? 10.323 30.600 4.024 1.00 14.57 ? 66 CRO A O2 1 +HETATM 966 C CA2 . CRO A 1 68 ? 9.656 32.127 2.274 1.00 16.54 ? 66 CRO A CA2 1 +HETATM 967 C CA3 . CRO A 1 68 ? 9.464 32.756 5.911 1.00 11.12 ? 66 CRO A CA3 1 +HETATM 968 C C3 . CRO A 1 68 ? 8.291 32.084 6.521 1.00 13.28 ? 66 CRO A C3 1 +HETATM 969 O O3 . CRO A 1 68 ? 8.450 31.672 7.724 1.00 15.33 ? 66 CRO A O3 1 +HETATM 970 C CB2 . CRO A 1 68 ? 10.007 31.340 1.172 1.00 16.67 ? 66 CRO A CB2 1 +HETATM 971 C CG2 . CRO A 1 68 ? 10.044 31.819 -0.262 1.00 17.45 ? 66 CRO A CG2 1 +HETATM 972 C CD1 . CRO A 1 68 ? 10.584 30.944 -1.222 1.00 14.23 ? 66 CRO A CD1 1 +HETATM 973 C CD2 . CRO A 1 68 ? 9.569 33.081 -0.639 1.00 13.27 ? 66 CRO A CD2 1 +HETATM 974 C CE1 . CRO A 1 68 ? 10.643 31.305 -2.555 1.00 15.13 ? 66 CRO A CE1 1 +HETATM 975 C CE2 . CRO A 1 68 ? 9.634 33.442 -2.011 1.00 19.49 ? 66 CRO A CE2 1 +HETATM 976 C CZ . CRO A 1 68 ? 10.149 32.562 -2.956 1.00 18.25 ? 66 CRO A CZ 1 +HETATM 977 O OH . CRO A 1 68 ? 10.206 32.877 -4.329 1.00 17.46 ? 66 CRO A OH 1 +ATOM 978 N N . VAL A 1 69 ? 7.075 32.229 5.948 1.00 10.19 ? 68 VAL A N 1 +ATOM 979 C CA . VAL A 1 69 ? 5.863 31.742 6.599 1.00 9.98 ? 68 VAL A CA 1 +ATOM 980 C C . VAL A 1 69 ? 5.145 30.766 5.656 1.00 13.64 ? 68 VAL A C 1 +ATOM 981 O O . VAL A 1 69 ? 4.012 30.963 5.226 1.00 12.40 ? 68 VAL A O 1 +ATOM 982 C CB . VAL A 1 69 ? 4.981 32.898 7.093 1.00 10.37 ? 68 VAL A CB 1 +ATOM 983 C CG1 . VAL A 1 69 ? 5.624 33.569 8.323 1.00 11.96 ? 68 VAL A CG1 1 +ATOM 984 C CG2 . VAL A 1 69 ? 4.744 33.921 5.994 1.00 10.68 ? 68 VAL A CG2 1 +ATOM 985 H HA . VAL A 1 69 ? 6.127 31.235 7.382 1.00 11.97 ? 68 VAL A HA 1 +ATOM 986 H HB . VAL A 1 69 ? 4.120 32.543 7.362 1.00 12.45 ? 68 VAL A HB 1 +ATOM 987 H HG11 . VAL A 1 69 ? 5.053 34.295 8.619 1.00 14.35 ? 68 VAL A HG11 1 +ATOM 988 H HG12 . VAL A 1 69 ? 5.716 32.911 9.029 1.00 14.35 ? 68 VAL A HG12 1 +ATOM 989 H HG13 . VAL A 1 69 ? 6.496 33.914 8.074 1.00 14.35 ? 68 VAL A HG13 1 +ATOM 990 H HG21 . VAL A 1 69 ? 4.185 34.633 6.342 1.00 12.82 ? 68 VAL A HG21 1 +ATOM 991 H HG22 . VAL A 1 69 ? 5.598 34.280 5.707 1.00 12.82 ? 68 VAL A HG22 1 +ATOM 992 H HG23 . VAL A 1 69 ? 4.300 33.486 5.249 1.00 12.82 ? 68 VAL A HG23 1 +ATOM 993 N N . GLN A 1 70 ? 5.816 29.658 5.389 1.00 12.29 ? 69 GLN A N 1 +ATOM 994 C CA . GLN A 1 70 ? 5.346 28.717 4.388 1.00 13.14 ? 69 GLN A CA 1 +ATOM 995 C C . GLN A 1 70 ? 4.116 27.931 4.822 1.00 13.26 ? 69 GLN A C 1 +ATOM 996 O O . GLN A 1 70 ? 3.524 27.214 4.013 1.00 12.64 ? 69 GLN A O 1 +ATOM 997 C CB . GLN A 1 70 ? 6.489 27.803 3.976 1.00 12.19 ? 69 GLN A CB 1 +ATOM 998 C CG . GLN A 1 70 ? 7.620 28.604 3.339 1.00 11.35 ? 69 GLN A CG 1 +ATOM 999 C CD . GLN A 1 70 ? 8.851 27.775 3.024 1.00 16.17 ? 69 GLN A CD 1 +ATOM 1000 O OE1 . GLN A 1 70 ? 9.346 27.034 3.859 1.00 20.76 ? 69 GLN A OE1 1 +ATOM 1001 N NE2 . GLN A 1 70 ? 9.365 27.923 1.811 1.00 24.02 ? 69 GLN A NE2 1 +ATOM 1002 H H . GLN A 1 70 ? 6.549 29.427 5.775 1.00 14.74 ? 69 GLN A H 1 +ATOM 1003 H HA . GLN A 1 70 ? 5.092 29.223 3.600 1.00 15.77 ? 69 GLN A HA 1 +ATOM 1004 H HB2 . GLN A 1 70 ? 6.838 27.350 4.760 1.00 14.63 ? 69 GLN A HB2 1 +ATOM 1005 H HB3 . GLN A 1 70 ? 6.168 27.157 3.328 1.00 14.63 ? 69 GLN A HB3 1 +ATOM 1006 H HG2 . GLN A 1 70 ? 7.301 28.990 2.509 1.00 13.62 ? 69 GLN A HG2 1 +ATOM 1007 H HG3 . GLN A 1 70 ? 7.886 29.310 3.950 1.00 13.62 ? 69 GLN A HG3 1 +ATOM 1008 H HE21 . GLN A 1 70 ? 9.000 28.467 1.253 1.00 28.82 ? 69 GLN A HE21 1 +ATOM 1009 H HE22 . GLN A 1 70 ? 10.062 27.475 1.581 1.00 28.82 ? 69 GLN A HE22 1 +ATOM 1010 N N . CYS A 1 71 ? 3.719 28.103 6.083 1.00 10.41 ? 70 CYS A N 1 +ATOM 1011 C CA . CYS A 1 71 ? 2.432 27.630 6.570 1.00 14.00 ? 70 CYS A CA 1 +ATOM 1012 C C . CYS A 1 71 ? 1.252 28.276 5.864 1.00 9.11 ? 70 CYS A C 1 +ATOM 1013 O O . CYS A 1 71 ? 0.135 27.801 6.019 1.00 11.91 ? 70 CYS A O 1 +ATOM 1014 C CB . CYS A 1 71 ? 2.313 27.849 8.094 1.00 15.60 ? 70 CYS A CB 1 +ATOM 1015 S SG . CYS A 1 71 ? 2.800 29.481 8.660 1.00 15.97 ? 70 CYS A SG 1 +ATOM 1016 H H . CYS A 1 71 ? 4.189 28.500 6.683 1.00 12.50 ? 70 CYS A H 1 +ATOM 1017 H HA . CYS A 1 71 ? 2.377 26.675 6.409 1.00 16.80 ? 70 CYS A HA 1 +ATOM 1018 H HB2 . CYS A 1 71 ? 1.389 27.712 8.355 1.00 18.72 ? 70 CYS A HB2 1 +ATOM 1019 H HB3 . CYS A 1 71 ? 2.878 27.202 8.544 1.00 18.72 ? 70 CYS A HB3 1 +ATOM 1020 H HG . CYS A 1 71 ? 2.103 30.302 8.132 1.00 19.16 ? 70 CYS A HG 1 +ATOM 1021 N N . PHE A 1 72 ? 1.481 29.337 5.071 1.00 10.37 ? 71 PHE A N 1 +ATOM 1022 C CA . PHE A 1 72 ? 0.401 29.957 4.318 1.00 12.93 ? 71 PHE A CA 1 +ATOM 1023 C C . PHE A 1 72 ? 0.272 29.449 2.880 1.00 12.62 ? 71 PHE A C 1 +ATOM 1024 O O . PHE A 1 72 ? -0.531 29.956 2.137 1.00 12.90 ? 71 PHE A O 1 +ATOM 1025 C CB . PHE A 1 72 ? 0.511 31.479 4.346 1.00 11.83 ? 71 PHE A CB 1 +ATOM 1026 C CG . PHE A 1 72 ? 0.137 32.054 5.677 1.00 13.19 ? 71 PHE A CG 1 +ATOM 1027 C CD1 . PHE A 1 72 ? -1.195 32.151 6.045 1.00 11.82 ? 71 PHE A CD1 1 +ATOM 1028 C CD2 . PHE A 1 72 ? 1.113 32.459 6.573 1.00 12.90 ? 71 PHE A CD2 1 +ATOM 1029 C CE1 . PHE A 1 72 ? -1.558 32.647 7.317 1.00 16.89 ? 71 PHE A CE1 1 +ATOM 1030 C CE2 . PHE A 1 72 ? 0.754 32.957 7.845 1.00 12.87 ? 71 PHE A CE2 1 +ATOM 1031 C CZ . PHE A 1 72 ? -0.574 33.053 8.195 1.00 12.91 ? 71 PHE A CZ 1 +ATOM 1032 H H . PHE A 1 72 ? 2.249 29.707 4.959 1.00 12.44 ? 71 PHE A H 1 +ATOM 1033 H HA . PHE A 1 72 ? -0.431 29.732 4.764 1.00 15.52 ? 71 PHE A HA 1 +ATOM 1034 H HB2 . PHE A 1 72 ? 1.427 31.734 4.154 1.00 14.20 ? 71 PHE A HB2 1 +ATOM 1035 H HB3 . PHE A 1 72 ? -0.085 31.852 3.678 1.00 14.20 ? 71 PHE A HB3 1 +ATOM 1036 H HD1 . PHE A 1 72 ? -1.857 31.870 5.455 1.00 14.19 ? 71 PHE A HD1 1 +ATOM 1037 H HD2 . PHE A 1 72 ? 2.011 32.388 6.342 1.00 15.48 ? 71 PHE A HD2 1 +ATOM 1038 H HE1 . PHE A 1 72 ? -2.455 32.717 7.553 1.00 20.27 ? 71 PHE A HE1 1 +ATOM 1039 H HE2 . PHE A 1 72 ? 1.413 33.235 8.440 1.00 15.45 ? 71 PHE A HE2 1 +ATOM 1040 H HZ . PHE A 1 72 ? -0.810 33.393 9.028 1.00 15.49 ? 71 PHE A HZ 1 +ATOM 1041 N N . ALA A 1 73 ? 1.037 28.433 2.529 1.00 12.02 ? 72 ALA A N 1 +ATOM 1042 C CA . ALA A 1 73 ? 0.934 27.821 1.217 1.00 13.08 ? 72 ALA A CA 1 +ATOM 1043 C C . ALA A 1 73 ? -0.451 27.211 1.042 1.00 10.21 ? 72 ALA A C 1 +ATOM 1044 O O . ALA A 1 73 ? -1.073 26.723 1.999 1.00 10.96 ? 72 ALA A O 1 +ATOM 1045 C CB . ALA A 1 73 ? 1.974 26.767 1.075 1.00 11.54 ? 72 ALA A CB 1 +ATOM 1046 H H . ALA A 1 73 ? 1.631 28.075 3.037 1.00 14.42 ? 72 ALA A H 1 +ATOM 1047 H HA . ALA A 1 73 ? 1.070 28.491 0.529 1.00 15.69 ? 72 ALA A HA 1 +ATOM 1048 H HB1 . ALA A 1 73 ? 1.897 26.365 0.196 1.00 13.84 ? 72 ALA A HB1 1 +ATOM 1049 H HB2 . ALA A 1 73 ? 2.850 27.172 1.178 1.00 13.84 ? 72 ALA A HB2 1 +ATOM 1050 H HB3 . ALA A 1 73 ? 1.838 26.095 1.760 1.00 13.84 ? 72 ALA A HB3 1 +ATOM 1051 N N . ARG A 1 74 ? -0.953 27.258 -0.180 1.00 10.91 ? 73 ARG A N 1 +ATOM 1052 C CA . ARG A 1 74 ? -2.189 26.554 -0.498 1.00 11.72 ? 73 ARG A CA 1 +ATOM 1053 C C . ARG A 1 74 ? -1.826 25.125 -0.848 1.00 16.71 ? 73 ARG A C 1 +ATOM 1054 O O . ARG A 1 74 ? -1.149 24.904 -1.844 1.00 13.70 ? 73 ARG A O 1 +ATOM 1055 C CB . ARG A 1 74 ? -2.933 27.177 -1.691 1.00 13.20 ? 73 ARG A CB 1 +ATOM 1056 C CG . ARG A 1 74 ? -4.275 26.505 -1.910 1.00 14.78 ? 73 ARG A CG 1 +ATOM 1057 C CD . ARG A 1 74 ? -5.063 27.138 -3.049 1.00 29.85 ? 73 ARG A CD 1 +ATOM 1058 N NE . ARG A 1 74 ? -4.515 26.749 -4.334 1.00 34.37 ? 73 ARG A NE 1 +ATOM 1059 C CZ . ARG A 1 74 ? -4.893 25.673 -5.029 1.00 37.81 ? 73 ARG A CZ 1 +ATOM 1060 N NH1 . ARG A 1 74 ? -5.829 24.852 -4.566 1.00 30.15 ? 73 ARG A NH1 1 +ATOM 1061 N NH2 . ARG A 1 74 ? -4.322 25.420 -6.201 1.00 43.91 ? 73 ARG A NH2 1 +ATOM 1062 H H . ARG A 1 74 ? -0.604 27.685 -0.840 1.00 13.09 ? 73 ARG A H 1 +ATOM 1063 H HA . ARG A 1 74 ? -2.777 26.551 0.273 1.00 14.06 ? 73 ARG A HA 1 +ATOM 1064 H HB2 . ARG A 1 74 ? -3.087 28.118 -1.517 1.00 15.84 ? 73 ARG A HB2 1 +ATOM 1065 H HB3 . ARG A 1 74 ? -2.401 27.065 -2.495 1.00 15.84 ? 73 ARG A HB3 1 +ATOM 1066 H HG2 . ARG A 1 74 ? -4.131 25.571 -2.127 1.00 17.73 ? 73 ARG A HG2 1 +ATOM 1067 H HG3 . ARG A 1 74 ? -4.804 26.582 -1.100 1.00 17.73 ? 73 ARG A HG3 1 +ATOM 1068 H HD2 . ARG A 1 74 ? -5.985 26.841 -3.007 1.00 35.82 ? 73 ARG A HD2 1 +ATOM 1069 H HD3 . ARG A 1 74 ? -5.015 28.104 -2.976 1.00 35.82 ? 73 ARG A HD3 1 +ATOM 1070 H HE . ARG A 1 74 ? -3.901 27.247 -4.673 1.00 41.24 ? 73 ARG A HE 1 +ATOM 1071 H HH11 . ARG A 1 74 ? -6.204 25.011 -3.808 1.00 36.19 ? 73 ARG A HH11 1 +ATOM 1072 H HH12 . ARG A 1 74 ? -6.061 24.162 -5.024 1.00 36.19 ? 73 ARG A HH12 1 +ATOM 1073 H HH21 . ARG A 1 74 ? -3.714 25.947 -6.506 1.00 52.69 ? 73 ARG A HH21 1 +ATOM 1074 H HH22 . ARG A 1 74 ? -4.558 24.728 -6.653 1.00 52.69 ? 73 ARG A HH22 1 +ATOM 1075 N N . TYR A 1 75 ? -2.256 24.179 -0.016 1.00 13.43 ? 74 TYR A N 1 +ATOM 1076 C CA . TYR A 1 75 ? -2.182 22.762 -0.337 1.00 12.00 ? 74 TYR A CA 1 +ATOM 1077 C C . TYR A 1 75 ? -3.540 22.325 -0.915 1.00 13.66 ? 74 TYR A C 1 +ATOM 1078 O O . TYR A 1 75 ? -4.567 22.464 -0.255 1.00 14.95 ? 74 TYR A O 1 +ATOM 1079 C CB . TYR A 1 75 ? -1.790 21.940 0.912 1.00 14.73 ? 74 TYR A CB 1 +ATOM 1080 C CG . TYR A 1 75 ? -0.289 21.869 1.113 1.00 12.58 ? 74 TYR A CG 1 +ATOM 1081 C CD1 . TYR A 1 75 ? 0.416 22.956 1.615 1.00 12.58 ? 74 TYR A CD1 1 +ATOM 1082 C CD2 . TYR A 1 75 ? 0.416 20.719 0.805 1.00 11.06 ? 74 TYR A CD2 1 +ATOM 1083 C CE1 . TYR A 1 75 ? 1.780 22.903 1.800 1.00 11.28 ? 74 TYR A CE1 1 +ATOM 1084 C CE2 . TYR A 1 75 ? 1.804 20.642 1.009 1.00 12.46 ? 74 TYR A CE2 1 +ATOM 1085 C CZ . TYR A 1 75 ? 2.482 21.744 1.471 1.00 10.67 ? 74 TYR A CZ 1 +ATOM 1086 O OH . TYR A 1 75 ? 3.843 21.716 1.639 1.00 11.45 ? 74 TYR A OH 1 +ATOM 1087 H H . TYR A 1 75 ? -2.601 24.340 0.755 1.00 16.12 ? 74 TYR A H 1 +ATOM 1088 H HA . TYR A 1 75 ? -1.504 22.623 -1.016 1.00 14.40 ? 74 TYR A HA 1 +ATOM 1089 H HB2 . TYR A 1 75 ? -2.179 22.354 1.698 1.00 17.68 ? 74 TYR A HB2 1 +ATOM 1090 H HB3 . TYR A 1 75 ? -2.124 21.035 0.813 1.00 17.68 ? 74 TYR A HB3 1 +ATOM 1091 H HD1 . TYR A 1 75 ? -0.041 23.739 1.822 1.00 15.09 ? 74 TYR A HD1 1 +ATOM 1092 H HD2 . TYR A 1 75 ? -0.040 19.978 0.477 1.00 13.28 ? 74 TYR A HD2 1 +ATOM 1093 H HE1 . TYR A 1 75 ? 2.235 23.648 2.121 1.00 13.54 ? 74 TYR A HE1 1 +ATOM 1094 H HE2 . TYR A 1 75 ? 2.269 19.870 0.777 1.00 14.95 ? 74 TYR A HE2 1 +ATOM 1095 H HH . TYR A 1 75 ? 4.111 22.453 1.942 1.00 13.74 ? 74 TYR A HH 1 +ATOM 1096 N N . PRO A 1 76 ? -3.561 21.845 -2.177 1.00 13.82 ? 75 PRO A N 1 +ATOM 1097 C CA . PRO A 1 76 ? -4.780 21.283 -2.745 1.00 15.59 ? 75 PRO A CA 1 +ATOM 1098 C C . PRO A 1 76 ? -5.287 20.132 -1.881 1.00 16.35 ? 75 PRO A C 1 +ATOM 1099 O O . PRO A 1 76 ? -4.480 19.499 -1.184 1.00 15.42 ? 75 PRO A O 1 +ATOM 1100 C CB . PRO A 1 76 ? -4.322 20.721 -4.087 1.00 17.02 ? 75 PRO A CB 1 +ATOM 1101 C CG . PRO A 1 76 ? -3.099 21.492 -4.430 1.00 21.21 ? 75 PRO A CG 1 +ATOM 1102 C CD . PRO A 1 76 ? -2.437 21.783 -3.133 1.00 17.27 ? 75 PRO A CD 1 +ATOM 1103 H HA . PRO A 1 76 ? -5.468 21.957 -2.868 1.00 18.71 ? 75 PRO A HA 1 +ATOM 1104 H HB2 . PRO A 1 76 ? -4.118 19.777 -3.993 1.00 20.42 ? 75 PRO A HB2 1 +ATOM 1105 H HB3 . PRO A 1 76 ? -5.014 20.859 -4.753 1.00 20.42 ? 75 PRO A HB3 1 +ATOM 1106 H HG2 . PRO A 1 76 ? -2.522 20.955 -4.996 1.00 25.45 ? 75 PRO A HG2 1 +ATOM 1107 H HG3 . PRO A 1 76 ? -3.347 22.315 -4.879 1.00 25.45 ? 75 PRO A HG3 1 +ATOM 1108 H HD2 . PRO A 1 76 ? -1.830 21.064 -2.895 1.00 20.72 ? 75 PRO A HD2 1 +ATOM 1109 H HD3 . PRO A 1 76 ? -1.979 22.637 -3.172 1.00 20.72 ? 75 PRO A HD3 1 +ATOM 1110 N N . ASP A 1 77 ? -6.581 19.848 -1.980 1.00 18.34 ? 76 ASP A N 1 +ATOM 1111 C CA . ASP A 1 77 ? -7.213 18.840 -1.134 1.00 23.18 ? 76 ASP A CA 1 +ATOM 1112 C C . ASP A 1 77 ? -6.496 17.502 -1.176 1.00 21.44 ? 76 ASP A C 1 +ATOM 1113 O O . ASP A 1 77 ? -6.326 16.871 -0.134 1.00 20.69 ? 76 ASP A O 1 +ATOM 1114 C CB . ASP A 1 77 ? -8.662 18.620 -1.547 1.00 29.75 ? 76 ASP A CB 1 +ATOM 1115 C CG . ASP A 1 77 ? -9.559 19.796 -1.208 1.00 35.46 ? 76 ASP A CG 1 +ATOM 1116 O OD1 . ASP A 1 77 ? -9.146 20.700 -0.452 1.00 34.35 ? 76 ASP A OD1 1 +ATOM 1117 O OD2 . ASP A 1 77 ? -10.699 19.795 -1.693 1.00 37.76 ? 76 ASP A OD2 1 +ATOM 1118 H H . ASP A 1 77 ? -7.119 20.227 -2.533 1.00 22.01 ? 76 ASP A H 1 +ATOM 1119 H HA . ASP A 1 77 ? -7.208 19.152 -0.216 1.00 27.81 ? 76 ASP A HA 1 +ATOM 1120 H HB2 . ASP A 1 77 ? -8.700 18.481 -2.506 1.00 35.70 ? 76 ASP A HB2 1 +ATOM 1121 H HB3 . ASP A 1 77 ? -9.006 17.839 -1.085 1.00 35.70 ? 76 ASP A HB3 1 +ATOM 1122 N N . HIS A 1 78 ? -6.068 17.060 -2.356 1.00 18.60 ? 77 HIS A N 1 +ATOM 1123 C CA . HIS A 1 78 ? -5.412 15.752 -2.459 1.00 22.42 ? 77 HIS A CA 1 +ATOM 1124 C C . HIS A 1 78 ? -3.995 15.726 -1.854 1.00 23.74 ? 77 HIS A C 1 +ATOM 1125 O O . HIS A 1 78 ? -3.372 14.666 -1.770 1.00 22.02 ? 77 HIS A O 1 +ATOM 1126 C CB . HIS A 1 78 ? -5.370 15.242 -3.912 1.00 19.50 ? 77 HIS A CB 1 +ATOM 1127 C CG . HIS A 1 78 ? -4.336 15.915 -4.756 1.00 17.38 ? 77 HIS A CG 1 +ATOM 1128 N ND1 . HIS A 1 78 ? -4.491 17.198 -5.245 1.00 20.69 ? 77 HIS A ND1 1 +ATOM 1129 C CD2 . HIS A 1 78 ? -3.145 15.476 -5.228 1.00 20.53 ? 77 HIS A CD2 1 +ATOM 1130 C CE1 . HIS A 1 78 ? -3.416 17.538 -5.934 1.00 19.97 ? 77 HIS A CE1 1 +ATOM 1131 N NE2 . HIS A 1 78 ? -2.595 16.505 -5.960 1.00 19.57 ? 77 HIS A NE2 1 +ATOM 1132 H H . HIS A 1 78 ? -6.142 17.485 -3.100 1.00 22.31 ? 77 HIS A H 1 +ATOM 1133 H HA . HIS A 1 78 ? -5.943 15.116 -1.954 1.00 26.90 ? 77 HIS A HA 1 +ATOM 1134 H HB2 . HIS A 1 78 ? -5.174 14.292 -3.905 1.00 23.40 ? 77 HIS A HB2 1 +ATOM 1135 H HB3 . HIS A 1 78 ? -6.235 15.396 -4.323 1.00 23.40 ? 77 HIS A HB3 1 +ATOM 1136 H HD1 . HIS A 1 78 ? -5.161 17.713 -5.084 1.00 24.83 ? 77 HIS A HD1 1 +ATOM 1137 H HD2 . HIS A 1 78 ? -2.763 14.643 -5.073 1.00 24.63 ? 77 HIS A HD2 1 +ATOM 1138 H HE1 . HIS A 1 78 ? -3.283 18.349 -6.368 1.00 23.96 ? 77 HIS A HE1 1 +ATOM 1139 H HE2 . HIS A 1 78 ? -1.834 16.482 -6.360 1.00 23.49 ? 77 HIS A HE2 1 +ATOM 1140 N N . MET A 1 79 ? -3.487 16.879 -1.431 1.00 16.94 ? 78 MET A N 1 +ATOM 1141 C CA . MET A 1 79 ? -2.146 16.955 -0.875 1.00 16.44 ? 78 MET A CA 1 +ATOM 1142 C C . MET A 1 79 ? -2.149 17.390 0.583 1.00 16.72 ? 78 MET A C 1 +ATOM 1143 O O . MET A 1 79 ? -1.101 17.614 1.153 1.00 18.09 ? 78 MET A O 1 +ATOM 1144 C CB . MET A 1 79 ? -1.311 17.947 -1.669 1.00 14.85 ? 78 MET A CB 1 +ATOM 1145 C CG . MET A 1 79 ? -0.963 17.507 -3.056 1.00 20.35 ? 78 MET A CG 1 +ATOM 1146 S SD . MET A 1 79 ? 0.108 18.703 -3.881 1.00 15.79 ? 78 MET A SD 1 +ATOM 1147 C CE . MET A 1 79 ? 1.585 18.658 -2.845 1.00 15.12 ? 78 MET A CE 1 +ATOM 1148 H H . MET A 1 79 ? -3.901 17.632 -1.456 1.00 20.32 ? 78 MET A H 1 +ATOM 1149 H HA . MET A 1 79 ? -1.724 16.084 -0.944 1.00 19.72 ? 78 MET A HA 1 +ATOM 1150 H HB2 . MET A 1 79 ? -1.806 18.779 -1.740 1.00 17.83 ? 78 MET A HB2 1 +ATOM 1151 H HB3 . MET A 1 79 ? -0.480 18.103 -1.193 1.00 17.83 ? 78 MET A HB3 1 +ATOM 1152 H HG2 . MET A 1 79 ? -0.495 16.659 -3.015 1.00 24.42 ? 78 MET A HG2 1 +ATOM 1153 H HG3 . MET A 1 79 ? -1.776 17.418 -3.577 1.00 24.42 ? 78 MET A HG3 1 +ATOM 1154 H HE1 . MET A 1 79 ? 2.241 19.277 -3.204 1.00 18.14 ? 78 MET A HE1 1 +ATOM 1155 H HE2 . MET A 1 79 ? 1.345 18.918 -1.942 1.00 18.14 ? 78 MET A HE2 1 +ATOM 1156 H HE3 . MET A 1 79 ? 1.944 17.757 -2.846 1.00 18.14 ? 78 MET A HE3 1 +ATOM 1157 N N . LYS A 1 80 ? -3.312 17.473 1.202 1.00 16.61 ? 79 LYS A N 1 +ATOM 1158 C CA . LYS A 1 80 ? -3.364 17.997 2.564 1.00 17.84 ? 79 LYS A CA 1 +ATOM 1159 C C . LYS A 1 80 ? -2.572 17.170 3.586 1.00 24.08 ? 79 LYS A C 1 +ATOM 1160 O O . LYS A 1 80 ? -2.105 17.718 4.584 1.00 19.78 ? 79 LYS A O 1 +ATOM 1161 C CB . LYS A 1 80 ? -4.811 18.281 2.993 1.00 20.20 ? 79 LYS A CB 1 +ATOM 1162 C CG . LYS A 1 80 ? -5.276 19.619 2.349 1.00 28.48 ? 79 LYS A CG 1 +ATOM 1163 C CD . LYS A 1 80 ? -6.645 20.077 2.745 1.00 37.12 ? 79 LYS A CD 1 +ATOM 1164 C CE . LYS A 1 80 ? -7.063 21.286 1.911 1.00 33.14 ? 79 LYS A CE 1 +ATOM 1165 N NZ . LYS A 1 80 ? -6.130 22.420 2.003 1.00 36.28 ? 79 LYS A NZ 1 +ATOM 1166 H H . LYS A 1 80 ? -4.071 17.240 0.871 1.00 19.94 ? 79 LYS A H 1 +ATOM 1167 H HA . LYS A 1 80 ? -2.927 18.862 2.541 1.00 21.41 ? 79 LYS A HA 1 +ATOM 1168 H HB2 . LYS A 1 80 ? -5.391 17.568 2.684 1.00 24.24 ? 79 LYS A HB2 1 +ATOM 1169 H HB3 . LYS A 1 80 ? -4.856 18.368 3.959 1.00 24.24 ? 79 LYS A HB3 1 +ATOM 1170 H HG2 . LYS A 1 80 ? -4.651 20.316 2.602 1.00 34.18 ? 79 LYS A HG2 1 +ATOM 1171 H HG3 . LYS A 1 80 ? -5.271 19.514 1.385 1.00 34.18 ? 79 LYS A HG3 1 +ATOM 1172 H HD2 . LYS A 1 80 ? -7.283 19.362 2.591 1.00 44.54 ? 79 LYS A HD2 1 +ATOM 1173 H HD3 . LYS A 1 80 ? -6.642 20.335 3.680 1.00 44.54 ? 79 LYS A HD3 1 +ATOM 1174 H HE2 . LYS A 1 80 ? -7.116 21.020 0.979 1.00 39.77 ? 79 LYS A HE2 1 +ATOM 1175 H HE3 . LYS A 1 80 ? -7.932 21.591 2.215 1.00 39.77 ? 79 LYS A HE3 1 +ATOM 1176 H HZ1 . LYS A 1 80 ? -5.324 22.174 1.720 1.00 43.54 ? 79 LYS A HZ1 1 +ATOM 1177 H HZ2 . LYS A 1 80 ? -6.421 23.095 1.500 1.00 43.54 ? 79 LYS A HZ2 1 +ATOM 1178 H HZ3 . LYS A 1 80 ? -6.069 22.695 2.848 1.00 43.54 ? 79 LYS A HZ3 1 +ATOM 1179 N N A GLN A 1 81 ? -2.390 15.877 3.324 0.62 16.50 ? 80 GLN A N 1 +ATOM 1180 N N B GLN A 1 81 ? -2.383 15.879 3.329 0.38 16.69 ? 80 GLN A N 1 +ATOM 1181 C CA A GLN A 1 81 ? -1.595 15.040 4.225 0.62 17.11 ? 80 GLN A CA 1 +ATOM 1182 C CA B GLN A 1 81 ? -1.592 15.051 4.241 0.38 17.11 ? 80 GLN A CA 1 +ATOM 1183 C C A GLN A 1 81 ? -0.083 15.347 4.194 0.62 16.76 ? 80 GLN A C 1 +ATOM 1184 C C B GLN A 1 81 ? -0.072 15.229 4.082 0.38 16.95 ? 80 GLN A C 1 +ATOM 1185 O O A GLN A 1 81 ? 0.680 14.828 5.015 0.62 16.38 ? 80 GLN A O 1 +ATOM 1186 O O B GLN A 1 81 ? 0.709 14.498 4.700 0.38 18.04 ? 80 GLN A O 1 +ATOM 1187 C CB A GLN A 1 81 ? -1.866 13.550 3.971 0.62 24.38 ? 80 GLN A CB 1 +ATOM 1188 C CB B GLN A 1 81 ? -1.980 13.576 4.105 0.38 23.30 ? 80 GLN A CB 1 +ATOM 1189 C CG A GLN A 1 81 ? -1.337 12.996 2.657 0.62 22.96 ? 80 GLN A CG 1 +ATOM 1190 C CG B GLN A 1 81 ? -3.416 13.267 4.514 0.38 24.73 ? 80 GLN A CG 1 +ATOM 1191 C CD A GLN A 1 81 ? -2.379 12.994 1.562 0.62 29.04 ? 80 GLN A CD 1 +ATOM 1192 C CD B GLN A 1 81 ? -3.749 13.712 5.931 0.38 22.49 ? 80 GLN A CD 1 +ATOM 1193 O OE1 A GLN A 1 81 ? -2.976 14.029 1.243 0.62 17.39 ? 80 GLN A OE1 1 +ATOM 1194 O OE1 B GLN A 1 81 ? -3.248 13.151 6.902 0.38 23.15 ? 80 GLN A OE1 1 +ATOM 1195 N NE2 A GLN A 1 81 ? -2.625 11.815 0.996 0.62 26.02 ? 80 GLN A NE2 1 +ATOM 1196 N NE2 B GLN A 1 81 ? -4.606 14.721 6.050 0.38 22.13 ? 80 GLN A NE2 1 +ATOM 1197 H H A GLN A 1 81 ? -2.711 15.464 2.641 0.62 19.80 ? 80 GLN A H 1 +ATOM 1198 H H B GLN A 1 81 ? -2.695 15.462 2.644 0.38 20.03 ? 80 GLN A H 1 +ATOM 1199 H HA A GLN A 1 81 ? -1.893 15.224 5.129 0.62 20.53 ? 80 GLN A HA 1 +ATOM 1200 H HA B GLN A 1 81 ? -1.811 15.317 5.147 0.38 20.53 ? 80 GLN A HA 1 +ATOM 1201 H HB2 A GLN A 1 81 ? -1.457 13.039 4.687 0.62 29.25 ? 80 GLN A HB2 1 +ATOM 1202 H HB2 B GLN A 1 81 ? -1.873 13.310 3.178 0.38 27.96 ? 80 GLN A HB2 1 +ATOM 1203 H HB3 A GLN A 1 81 ? -2.826 13.408 3.981 0.62 29.25 ? 80 GLN A HB3 1 +ATOM 1204 H HB3 B GLN A 1 81 ? -1.393 13.046 4.667 0.38 27.96 ? 80 GLN A HB3 1 +ATOM 1205 H HG2 A GLN A 1 81 ? -0.592 13.542 2.361 0.62 27.55 ? 80 GLN A HG2 1 +ATOM 1206 H HG2 B GLN A 1 81 ? -4.020 13.725 3.908 0.38 29.68 ? 80 GLN A HG2 1 +ATOM 1207 H HG3 A GLN A 1 81 ? -1.045 12.081 2.795 0.62 27.55 ? 80 GLN A HG3 1 +ATOM 1208 H HG3 B GLN A 1 81 ? -3.559 12.309 4.461 0.38 29.68 ? 80 GLN A HG3 1 +ATOM 1209 H HE21 A GLN A 1 81 ? -2.200 11.115 1.259 0.62 31.22 ? 80 GLN A HE21 1 +ATOM 1210 H HE21 B GLN A 1 81 ? -4.941 15.087 5.348 0.38 26.56 ? 80 GLN A HE21 1 +ATOM 1211 H HE22 A GLN A 1 81 ? -3.208 11.754 0.367 0.62 31.22 ? 80 GLN A HE22 1 +ATOM 1212 H HE22 B GLN A 1 81 ? -4.826 15.009 6.831 0.38 26.56 ? 80 GLN A HE22 1 +ATOM 1213 N N . HIS A 1 82 ? 0.344 16.205 3.277 1.00 14.23 ? 81 HIS A N 1 +ATOM 1214 C CA . HIS A 1 82 ? 1.766 16.519 3.098 1.00 17.52 ? 81 HIS A CA 1 +ATOM 1215 C C . HIS A 1 82 ? 2.151 17.916 3.567 1.00 13.09 ? 81 HIS A C 1 +ATOM 1216 O O . HIS A 1 82 ? 3.254 18.400 3.253 1.00 13.89 ? 81 HIS A O 1 +ATOM 1217 C CB . HIS A 1 82 ? 2.139 16.368 1.625 1.00 18.27 ? 81 HIS A CB 1 +ATOM 1218 C CG . HIS A 1 82 ? 1.805 15.017 1.094 1.00 17.56 ? 81 HIS A CG 1 +ATOM 1219 N ND1 . HIS A 1 82 ? 2.565 13.913 1.395 1.00 16.64 ? 81 HIS A ND1 1 +ATOM 1220 C CD2 . HIS A 1 82 ? 0.758 14.569 0.361 1.00 16.40 ? 81 HIS A CD2 1 +ATOM 1221 C CE1 . HIS A 1 82 ? 2.024 12.843 0.843 1.00 18.74 ? 81 HIS A CE1 1 +ATOM 1222 N NE2 . HIS A 1 82 ? 0.925 13.214 0.208 1.00 18.27 ? 81 HIS A NE2 1 +ATOM 1223 H H A HIS A 1 82 ? -0.174 16.628 2.736 0.62 17.08 ? 81 HIS A H 1 +ATOM 1224 H H B HIS A 1 82 ? -0.182 16.707 2.818 0.38 17.08 ? 81 HIS A H 1 +ATOM 1225 H HA . HIS A 1 82 ? 2.292 15.881 3.605 1.00 21.02 ? 81 HIS A HA 1 +ATOM 1226 H HB2 . HIS A 1 82 ? 1.651 17.025 1.105 1.00 21.92 ? 81 HIS A HB2 1 +ATOM 1227 H HB3 . HIS A 1 82 ? 3.094 16.504 1.524 1.00 21.92 ? 81 HIS A HB3 1 +ATOM 1228 H HD1 . HIS A 1 82 ? 3.287 13.920 1.863 1.00 19.97 ? 81 HIS A HD1 1 +ATOM 1229 H HD2 . HIS A 1 82 ? 0.065 15.084 0.015 1.00 19.68 ? 81 HIS A HD2 1 +ATOM 1230 H HE1 . HIS A 1 82 ? 2.362 11.977 0.888 1.00 22.49 ? 81 HIS A HE1 1 +ATOM 1231 H HE2 . HIS A 1 82 ? 0.403 12.693 -0.234 1.00 21.93 ? 81 HIS A HE2 1 +ATOM 1232 N N . ASP A 1 83 ? 1.246 18.575 4.291 1.00 14.39 ? 82 ASP A N 1 +ATOM 1233 C CA . ASP A 1 83 ? 1.485 19.938 4.749 1.00 10.38 ? 82 ASP A CA 1 +ATOM 1234 C C . ASP A 1 83 ? 2.092 19.909 6.152 1.00 16.82 ? 82 ASP A C 1 +ATOM 1235 O O . ASP A 1 83 ? 1.380 20.000 7.151 1.00 15.17 ? 82 ASP A O 1 +ATOM 1236 C CB . ASP A 1 83 ? 0.159 20.738 4.710 1.00 10.45 ? 82 ASP A CB 1 +ATOM 1237 C CG . ASP A 1 83 ? 0.329 22.222 5.021 1.00 11.30 ? 82 ASP A CG 1 +ATOM 1238 O OD1 . ASP A 1 83 ? 1.415 22.660 5.496 1.00 13.98 ? 82 ASP A OD1 1 +ATOM 1239 O OD2 . ASP A 1 83 ? -0.663 22.969 4.794 1.00 13.14 ? 82 ASP A OD2 1 +ATOM 1240 H H . ASP A 1 83 ? 0.486 18.253 4.530 1.00 17.26 ? 82 ASP A H 1 +ATOM 1241 H HA . ASP A 1 83 ? 2.118 20.369 4.153 1.00 12.46 ? 82 ASP A HA 1 +ATOM 1242 H HB2 . ASP A 1 83 ? -0.226 20.663 3.823 1.00 12.54 ? 82 ASP A HB2 1 +ATOM 1243 H HB3 . ASP A 1 83 ? -0.450 20.365 5.366 1.00 12.54 ? 82 ASP A HB3 1 +ATOM 1244 N N . PHE A 1 84 ? 3.412 19.755 6.218 1.00 13.48 ? 83 PHE A N 1 +ATOM 1245 C CA . PHE A 1 84 ? 4.117 19.760 7.496 1.00 12.00 ? 83 PHE A CA 1 +ATOM 1246 C C . PHE A 1 84 ? 3.884 21.049 8.262 1.00 13.61 ? 83 PHE A C 1 +ATOM 1247 O O . PHE A 1 84 ? 3.660 21.043 9.488 1.00 16.89 ? 83 PHE A O 1 +ATOM 1248 C CB . PHE A 1 84 ? 5.609 19.596 7.264 1.00 12.68 ? 83 PHE A CB 1 +ATOM 1249 C CG . PHE A 1 84 ? 6.435 19.981 8.445 1.00 13.23 ? 83 PHE A CG 1 +ATOM 1250 C CD1 . PHE A 1 84 ? 6.740 19.039 9.418 1.00 18.06 ? 83 PHE A CD1 1 +ATOM 1251 C CD2 . PHE A 1 84 ? 6.901 21.278 8.595 1.00 14.71 ? 83 PHE A CD2 1 +ATOM 1252 C CE1 . PHE A 1 84 ? 7.514 19.388 10.547 1.00 19.07 ? 83 PHE A CE1 1 +ATOM 1253 C CE2 . PHE A 1 84 ? 7.679 21.648 9.712 1.00 14.58 ? 83 PHE A CE2 1 +ATOM 1254 C CZ . PHE A 1 84 ? 7.978 20.700 10.694 1.00 17.21 ? 83 PHE A CZ 1 +ATOM 1255 H H . PHE A 1 84 ? 3.924 19.645 5.535 1.00 16.17 ? 83 PHE A H 1 +ATOM 1256 H HA . PHE A 1 84 ? 3.806 19.019 8.039 1.00 14.40 ? 83 PHE A HA 1 +ATOM 1257 H HB2 . PHE A 1 84 ? 5.795 18.666 7.060 1.00 15.22 ? 83 PHE A HB2 1 +ATOM 1258 H HB3 . PHE A 1 84 ? 5.875 20.157 6.519 1.00 15.22 ? 83 PHE A HB3 1 +ATOM 1259 H HD1 . PHE A 1 84 ? 6.428 18.168 9.327 1.00 21.68 ? 83 PHE A HD1 1 +ATOM 1260 H HD2 . PHE A 1 84 ? 6.700 21.914 7.947 1.00 17.66 ? 83 PHE A HD2 1 +ATOM 1261 H HE1 . PHE A 1 84 ? 7.711 18.749 11.192 1.00 22.89 ? 83 PHE A HE1 1 +ATOM 1262 H HE2 . PHE A 1 84 ? 7.984 22.523 9.800 1.00 17.49 ? 83 PHE A HE2 1 +ATOM 1263 H HZ . PHE A 1 84 ? 8.493 20.936 11.432 1.00 20.65 ? 83 PHE A HZ 1 +ATOM 1264 N N . PHE A 1 85 ? 3.964 22.161 7.536 1.00 11.19 ? 84 PHE A N 1 +ATOM 1265 C CA . PHE A 1 85 ? 3.982 23.495 8.126 1.00 12.32 ? 84 PHE A CA 1 +ATOM 1266 C C . PHE A 1 85 ? 2.733 23.776 8.983 1.00 11.67 ? 84 PHE A C 1 +ATOM 1267 O O . PHE A 1 85 ? 2.823 24.220 10.138 1.00 12.65 ? 84 PHE A O 1 +ATOM 1268 C CB . PHE A 1 85 ? 4.053 24.575 7.024 1.00 13.11 ? 84 PHE A CB 1 +ATOM 1269 C CG . PHE A 1 85 ? 5.184 24.393 6.033 1.00 14.62 ? 84 PHE A CG 1 +ATOM 1270 C CD1 . PHE A 1 85 ? 6.484 24.749 6.361 1.00 11.36 ? 84 PHE A CD1 1 +ATOM 1271 C CD2 . PHE A 1 85 ? 4.936 23.898 4.759 1.00 12.41 ? 84 PHE A CD2 1 +ATOM 1272 C CE1 . PHE A 1 85 ? 7.507 24.628 5.444 1.00 13.76 ? 84 PHE A CE1 1 +ATOM 1273 C CE2 . PHE A 1 85 ? 5.982 23.754 3.834 1.00 12.11 ? 84 PHE A CE2 1 +ATOM 1274 C CZ . PHE A 1 85 ? 7.254 24.116 4.190 1.00 13.76 ? 84 PHE A CZ 1 +ATOM 1275 H H . PHE A 1 85 ? 4.009 22.167 6.677 1.00 13.42 ? 84 PHE A H 1 +ATOM 1276 H HA . PHE A 1 85 ? 4.765 23.585 8.691 1.00 14.78 ? 84 PHE A HA 1 +ATOM 1277 H HB2 . PHE A 1 85 ? 3.222 24.564 6.525 1.00 15.73 ? 84 PHE A HB2 1 +ATOM 1278 H HB3 . PHE A 1 85 ? 4.169 25.441 7.445 1.00 15.73 ? 84 PHE A HB3 1 +ATOM 1279 H HD1 . PHE A 1 85 ? 6.664 25.099 7.204 1.00 13.63 ? 84 PHE A HD1 1 +ATOM 1280 H HD2 . PHE A 1 85 ? 4.071 23.655 4.519 1.00 14.89 ? 84 PHE A HD2 1 +ATOM 1281 H HE1 . PHE A 1 85 ? 8.374 24.862 5.684 1.00 16.51 ? 84 PHE A HE1 1 +ATOM 1282 H HE2 . PHE A 1 85 ? 5.812 23.417 2.985 1.00 14.53 ? 84 PHE A HE2 1 +ATOM 1283 H HZ . PHE A 1 85 ? 7.950 24.022 3.580 1.00 16.51 ? 84 PHE A HZ 1 +ATOM 1284 N N . LYS A 1 86 ? 1.554 23.516 8.442 1.00 14.36 ? 85 LYS A N 1 +ATOM 1285 C CA . LYS A 1 86 ? 0.367 23.736 9.252 1.00 15.80 ? 85 LYS A CA 1 +ATOM 1286 C C . LYS A 1 86 ? 0.248 22.704 10.358 1.00 18.20 ? 85 LYS A C 1 +ATOM 1287 O O . LYS A 1 86 ? -0.261 22.998 11.423 1.00 14.90 ? 85 LYS A O 1 +ATOM 1288 C CB . LYS A 1 86 ? -0.879 23.718 8.393 1.00 14.63 ? 85 LYS A CB 1 +ATOM 1289 C CG . LYS A 1 86 ? -0.969 24.896 7.431 1.00 12.10 ? 85 LYS A CG 1 +ATOM 1290 C CD . LYS A 1 86 ? -2.273 24.881 6.663 1.00 12.79 ? 85 LYS A CD 1 +ATOM 1291 C CE . LYS A 1 86 ? -2.269 25.863 5.470 1.00 10.72 ? 85 LYS A CE 1 +ATOM 1292 N NZ . LYS A 1 86 ? -1.118 25.656 4.536 1.00 11.63 ? 85 LYS A NZ 1 +ATOM 1293 H H . LYS A 1 86 ? 1.415 23.226 7.644 1.00 17.23 ? 85 LYS A H 1 +ATOM 1294 H HA . LYS A 1 86 ? 0.429 24.610 9.668 1.00 18.96 ? 85 LYS A HA 1 +ATOM 1295 H HB2 . LYS A 1 86 ? -0.886 22.903 7.866 1.00 17.56 ? 85 LYS A HB2 1 +ATOM 1296 H HB3 . LYS A 1 86 ? -1.659 23.744 8.969 1.00 17.56 ? 85 LYS A HB3 1 +ATOM 1297 H HG2 . LYS A 1 86 ? -0.921 25.725 7.934 1.00 14.52 ? 85 LYS A HG2 1 +ATOM 1298 H HG3 . LYS A 1 86 ? -0.239 24.847 6.794 1.00 14.52 ? 85 LYS A HG3 1 +ATOM 1299 H HD2 . LYS A 1 86 ? -2.427 23.988 6.317 1.00 15.35 ? 85 LYS A HD2 1 +ATOM 1300 H HD3 . LYS A 1 86 ? -2.995 25.136 7.259 1.00 15.35 ? 85 LYS A HD3 1 +ATOM 1301 H HE2 . LYS A 1 86 ? -3.088 25.745 4.964 1.00 12.86 ? 85 LYS A HE2 1 +ATOM 1302 H HE3 . LYS A 1 86 ? -2.218 26.770 5.810 1.00 12.86 ? 85 LYS A HE3 1 +ATOM 1303 H HZ1 . LYS A 1 86 ? -0.350 25.767 4.972 1.00 13.96 ? 85 LYS A HZ1 1 +ATOM 1304 H HZ2 . LYS A 1 86 ? -1.144 24.833 4.200 1.00 13.96 ? 85 LYS A HZ2 1 +ATOM 1305 H HZ3 . LYS A 1 86 ? -1.160 26.243 3.869 1.00 13.96 ? 85 LYS A HZ3 1 +ATOM 1306 N N . SER A 1 87 ? 0.706 21.491 10.101 1.00 13.71 ? 86 SER A N 1 +ATOM 1307 C CA . SER A 1 87 ? 0.522 20.417 11.064 1.00 15.14 ? 86 SER A CA 1 +ATOM 1308 C C . SER A 1 87 ? 1.294 20.700 12.362 1.00 15.80 ? 86 SER A C 1 +ATOM 1309 O O . SER A 1 87 ? 0.932 20.202 13.434 1.00 14.88 ? 86 SER A O 1 +ATOM 1310 C CB . SER A 1 87 ? 0.952 19.079 10.464 1.00 17.60 ? 86 SER A CB 1 +ATOM 1311 O OG . SER A 1 87 ? 2.343 18.884 10.542 1.00 16.88 ? 86 SER A OG 1 +ATOM 1312 H H . SER A 1 87 ? 1.124 21.263 9.384 1.00 16.45 ? 86 SER A H 1 +ATOM 1313 H HA . SER A 1 87 ? -0.420 20.354 11.286 1.00 18.17 ? 86 SER A HA 1 +ATOM 1314 H HB2 . SER A 1 87 ? 0.509 18.365 10.948 1.00 21.12 ? 86 SER A HB2 1 +ATOM 1315 H HB3 . SER A 1 87 ? 0.686 19.057 9.531 1.00 21.12 ? 86 SER A HB3 1 +ATOM 1316 H HG . SER A 1 87 ? 2.742 19.493 10.124 1.00 20.26 ? 86 SER A HG 1 +ATOM 1317 N N . ALA A 1 88 ? 2.334 21.525 12.273 1.00 15.21 ? 87 ALA A N 1 +ATOM 1318 C CA . ALA A 1 88 ? 3.142 21.866 13.445 1.00 17.26 ? 87 ALA A CA 1 +ATOM 1319 C C . ALA A 1 88 ? 2.511 22.947 14.323 1.00 16.43 ? 87 ALA A C 1 +ATOM 1320 O O . ALA A 1 88 ? 2.994 23.220 15.405 1.00 18.92 ? 87 ALA A O 1 +ATOM 1321 C CB . ALA A 1 88 ? 4.535 22.301 13.010 1.00 18.08 ? 87 ALA A CB 1 +ATOM 1322 H H . ALA A 1 88 ? 2.594 21.902 11.545 1.00 18.25 ? 87 ALA A H 1 +ATOM 1323 H HA . ALA A 1 88 ? 3.242 21.070 13.990 1.00 20.71 ? 87 ALA A HA 1 +ATOM 1324 H HB1 . ALA A 1 88 ? 5.056 22.523 13.798 1.00 21.70 ? 87 ALA A HB1 1 +ATOM 1325 H HB2 . ALA A 1 88 ? 4.956 21.573 12.528 1.00 21.70 ? 87 ALA A HB2 1 +ATOM 1326 H HB3 . ALA A 1 88 ? 4.457 23.078 12.435 1.00 21.70 ? 87 ALA A HB3 1 +ATOM 1327 N N . MET A 1 89 ? 1.450 23.588 13.839 1.00 15.02 ? 88 MET A N 1 +ATOM 1328 C CA . MET A 1 89 ? 0.822 24.675 14.572 1.00 17.74 ? 88 MET A CA 1 +ATOM 1329 C C . MET A 1 89 ? -0.171 24.096 15.571 1.00 19.26 ? 88 MET A C 1 +ATOM 1330 O O . MET A 1 89 ? -0.679 23.010 15.346 1.00 18.88 ? 88 MET A O 1 +ATOM 1331 C CB . MET A 1 89 ? 0.119 25.599 13.579 1.00 12.96 ? 88 MET A CB 1 +ATOM 1332 C CG . MET A 1 89 ? 1.090 26.249 12.621 1.00 12.21 ? 88 MET A CG 1 +ATOM 1333 S SD . MET A 1 89 ? 2.316 27.268 13.462 1.00 14.67 ? 88 MET A SD 1 +ATOM 1334 C CE . MET A 1 89 ? 3.583 27.383 12.185 1.00 15.27 ? 88 MET A CE 1 +ATOM 1335 H H . MET A 1 89 ? 1.075 23.409 13.086 1.00 18.03 ? 88 MET A H 1 +ATOM 1336 H HA . MET A 1 89 ? 1.500 25.185 15.043 1.00 21.29 ? 88 MET A HA 1 +ATOM 1337 H HB2 . MET A 1 89 ? -0.517 25.082 13.060 1.00 15.55 ? 88 MET A HB2 1 +ATOM 1338 H HB3 . MET A 1 89 ? -0.339 26.300 14.067 1.00 15.55 ? 88 MET A HB3 1 +ATOM 1339 H HG2 . MET A 1 89 ? 1.560 25.558 12.129 1.00 14.66 ? 88 MET A HG2 1 +ATOM 1340 H HG3 . MET A 1 89 ? 0.597 26.817 12.008 1.00 14.66 ? 88 MET A HG3 1 +ATOM 1341 H HE1 . MET A 1 89 ? 4.319 27.920 12.519 1.00 18.32 ? 88 MET A HE1 1 +ATOM 1342 H HE2 . MET A 1 89 ? 3.895 26.490 11.970 1.00 18.32 ? 88 MET A HE2 1 +ATOM 1343 H HE3 . MET A 1 89 ? 3.200 27.799 11.397 1.00 18.32 ? 88 MET A HE3 1 +ATOM 1344 N N . PRO A 1 90 ? -0.452 24.822 16.671 1.00 19.95 ? 89 PRO A N 1 +ATOM 1345 C CA . PRO A 1 90 ? 0.019 26.195 16.943 1.00 15.03 ? 89 PRO A CA 1 +ATOM 1346 C C . PRO A 1 90 ? 1.418 26.309 17.548 1.00 16.37 ? 89 PRO A C 1 +ATOM 1347 O O . PRO A 1 90 ? 1.982 27.391 17.533 1.00 18.93 ? 89 PRO A O 1 +ATOM 1348 C CB . PRO A 1 90 ? -1.035 26.726 17.915 1.00 14.73 ? 89 PRO A CB 1 +ATOM 1349 C CG . PRO A 1 90 ? -1.444 25.471 18.697 1.00 18.28 ? 89 PRO A CG 1 +ATOM 1350 C CD . PRO A 1 90 ? -1.371 24.336 17.721 1.00 17.91 ? 89 PRO A CD 1 +ATOM 1351 H HA . PRO A 1 90 ? -0.013 26.721 16.129 1.00 18.04 ? 89 PRO A HA 1 +ATOM 1352 H HB2 . PRO A 1 90 ? -0.643 27.392 18.501 1.00 17.67 ? 89 PRO A HB2 1 +ATOM 1353 H HB3 . PRO A 1 90 ? -1.788 27.092 17.423 1.00 17.67 ? 89 PRO A HB3 1 +ATOM 1354 H HG2 . PRO A 1 90 ? -0.824 25.329 19.430 1.00 21.93 ? 89 PRO A HG2 1 +ATOM 1355 H HG3 . PRO A 1 90 ? -2.348 25.576 19.031 1.00 21.93 ? 89 PRO A HG3 1 +ATOM 1356 H HD2 . PRO A 1 90 ? -1.004 23.546 18.149 1.00 21.50 ? 89 PRO A HD2 1 +ATOM 1357 H HD3 . PRO A 1 90 ? -2.247 24.159 17.345 1.00 21.50 ? 89 PRO A HD3 1 +ATOM 1358 N N A GLU A 1 91 ? 1.959 25.201 18.039 0.60 18.72 ? 90 GLU A N 1 +ATOM 1359 N N B GLU A 1 91 ? 1.972 25.219 18.075 0.40 18.42 ? 90 GLU A N 1 +ATOM 1360 C CA A GLU A 1 91 ? 3.241 25.199 18.733 0.60 19.60 ? 90 GLU A CA 1 +ATOM 1361 C CA B GLU A 1 91 ? 3.274 25.278 18.750 0.40 18.76 ? 90 GLU A CA 1 +ATOM 1362 C C A GLU A 1 91 ? 4.374 25.720 17.844 0.60 19.34 ? 90 GLU A C 1 +ATOM 1363 C C B GLU A 1 91 ? 4.375 25.780 17.827 0.40 19.49 ? 90 GLU A C 1 +ATOM 1364 O O A GLU A 1 91 ? 5.302 26.382 18.335 0.60 19.57 ? 90 GLU A O 1 +ATOM 1365 O O B GLU A 1 91 ? 5.296 26.475 18.277 0.40 20.43 ? 90 GLU A O 1 +ATOM 1366 C CB A GLU A 1 91 ? 3.536 23.782 19.259 0.60 26.94 ? 90 GLU A CB 1 +ATOM 1367 C CB B GLU A 1 91 ? 3.656 23.911 19.334 0.40 24.63 ? 90 GLU A CB 1 +ATOM 1368 C CG A GLU A 1 91 ? 2.477 23.243 20.256 0.60 29.43 ? 90 GLU A CG 1 +ATOM 1369 C CG B GLU A 1 91 ? 2.771 23.469 20.488 0.40 28.75 ? 90 GLU A CG 1 +ATOM 1370 C CD A GLU A 1 91 ? 1.248 22.567 19.604 0.60 27.31 ? 90 GLU A CD 1 +ATOM 1371 C CD B GLU A 1 91 ? 3.056 22.046 20.939 0.40 31.15 ? 90 GLU A CD 1 +ATOM 1372 O OE1 A GLU A 1 91 ? 1.137 22.521 18.361 0.60 17.67 ? 90 GLU A OE1 1 +ATOM 1373 O OE1 B GLU A 1 91 ? 2.857 21.105 20.140 0.40 30.34 ? 90 GLU A OE1 1 +ATOM 1374 O OE2 A GLU A 1 91 ? 0.382 22.070 20.361 0.60 29.81 ? 90 GLU A OE2 1 +ATOM 1375 O OE2 B GLU A 1 91 ? 3.482 21.872 22.096 0.40 33.36 ? 90 GLU A OE2 1 +ATOM 1376 H H A GLU A 1 91 ? 1.596 24.423 17.981 0.60 22.47 ? 90 GLU A H 1 +ATOM 1377 H H B GLU A 1 91 ? 1.619 24.435 18.056 0.40 22.10 ? 90 GLU A H 1 +ATOM 1378 H HA A GLU A 1 91 ? 3.177 25.788 19.501 0.60 23.51 ? 90 GLU A HA 1 +ATOM 1379 H HA B GLU A 1 91 ? 3.207 25.902 19.490 0.40 22.51 ? 90 GLU A HA 1 +ATOM 1380 H HB2 A GLU A 1 91 ? 3.571 23.171 18.507 0.60 32.32 ? 90 GLU A HB2 1 +ATOM 1381 H HB2 B GLU A 1 91 ? 3.588 23.242 18.634 0.40 29.55 ? 90 GLU A HB2 1 +ATOM 1382 H HB3 A GLU A 1 91 ? 4.392 23.790 19.714 0.60 32.32 ? 90 GLU A HB3 1 +ATOM 1383 H HB3 B GLU A 1 91 ? 4.568 23.954 19.659 0.40 29.55 ? 90 GLU A HB3 1 +ATOM 1384 H HG2 A GLU A 1 91 ? 2.901 22.587 20.831 0.60 35.32 ? 90 GLU A HG2 1 +ATOM 1385 H HG2 B GLU A 1 91 ? 2.919 24.058 21.243 0.40 34.50 ? 90 GLU A HG2 1 +ATOM 1386 H HG3 A GLU A 1 91 ? 2.153 23.984 20.792 0.60 35.32 ? 90 GLU A HG3 1 +ATOM 1387 H HG3 B GLU A 1 91 ? 1.843 23.514 20.209 0.40 34.50 ? 90 GLU A HG3 1 +ATOM 1388 N N . GLY A 1 92 ? 4.283 25.421 16.548 1.00 17.41 ? 91 GLY A N 1 +ATOM 1389 C CA . GLY A 1 92 ? 5.156 25.989 15.527 1.00 16.09 ? 91 GLY A CA 1 +ATOM 1390 C C . GLY A 1 92 ? 6.378 25.177 15.161 1.00 15.56 ? 91 GLY A C 1 +ATOM 1391 O O . GLY A 1 92 ? 6.489 23.993 15.484 1.00 17.96 ? 91 GLY A O 1 +ATOM 1392 H H A GLY A 1 92 ? 3.703 24.873 16.228 0.60 20.90 ? 91 GLY A H 1 +ATOM 1393 H H B GLY A 1 92 ? 3.719 24.847 16.246 0.40 20.90 ? 91 GLY A H 1 +ATOM 1394 H HA2 . GLY A 1 92 ? 4.639 26.123 14.718 1.00 19.31 ? 91 GLY A HA2 1 +ATOM 1395 H HA3 . GLY A 1 92 ? 5.462 26.859 15.830 1.00 19.31 ? 91 GLY A HA3 1 +ATOM 1396 N N . TYR A 1 93 ? 7.306 25.819 14.463 1.00 16.76 ? 92 TYR A N 1 +ATOM 1397 C CA . TYR A 1 93 ? 8.523 25.146 14.030 1.00 15.25 ? 92 TYR A CA 1 +ATOM 1398 C C . TYR A 1 93 ? 9.691 26.102 13.986 1.00 15.44 ? 92 TYR A C 1 +ATOM 1399 O O . TYR A 1 93 ? 9.493 27.301 13.906 1.00 15.64 ? 92 TYR A O 1 +ATOM 1400 C CB . TYR A 1 93 ? 8.356 24.511 12.656 1.00 17.13 ? 92 TYR A CB 1 +ATOM 1401 C CG . TYR A 1 93 ? 7.838 25.423 11.553 1.00 13.26 ? 92 TYR A CG 1 +ATOM 1402 C CD1 . TYR A 1 93 ? 8.670 26.318 10.906 1.00 13.95 ? 92 TYR A CD1 1 +ATOM 1403 C CD2 . TYR A 1 93 ? 6.519 25.331 11.131 1.00 17.44 ? 92 TYR A CD2 1 +ATOM 1404 C CE1 . TYR A 1 93 ? 8.182 27.151 9.880 1.00 12.51 ? 92 TYR A CE1 1 +ATOM 1405 C CE2 . TYR A 1 93 ? 6.033 26.121 10.129 1.00 15.93 ? 92 TYR A CE2 1 +ATOM 1406 C CZ . TYR A 1 93 ? 6.868 27.024 9.488 1.00 13.04 ? 92 TYR A CZ 1 +ATOM 1407 O OH . TYR A 1 93 ? 6.329 27.817 8.488 1.00 14.86 ? 92 TYR A OH 1 +ATOM 1408 H H . TYR A 1 93 ? 7.255 26.645 14.227 1.00 20.11 ? 92 TYR A H 1 +ATOM 1409 H HA . TYR A 1 93 ? 8.736 24.442 14.662 1.00 18.30 ? 92 TYR A HA 1 +ATOM 1410 H HB2 . TYR A 1 93 ? 9.219 24.174 12.370 1.00 20.55 ? 92 TYR A HB2 1 +ATOM 1411 H HB3 . TYR A 1 93 ? 7.732 23.773 12.737 1.00 20.55 ? 92 TYR A HB3 1 +ATOM 1412 H HD1 . TYR A 1 93 ? 9.558 26.392 11.172 1.00 16.74 ? 92 TYR A HD1 1 +ATOM 1413 H HD2 . TYR A 1 93 ? 5.951 24.724 11.547 1.00 20.93 ? 92 TYR A HD2 1 +ATOM 1414 H HE1 . TYR A 1 93 ? 8.747 27.755 9.454 1.00 15.01 ? 92 TYR A HE1 1 +ATOM 1415 H HE2 . TYR A 1 93 ? 5.143 26.047 9.870 1.00 19.12 ? 92 TYR A HE2 1 +ATOM 1416 H HH . TYR A 1 93 ? 6.912 28.346 8.194 1.00 17.83 ? 92 TYR A HH 1 +ATOM 1417 N N . VAL A 1 94 ? 10.895 25.536 14.040 1.00 15.69 ? 93 VAL A N 1 +ATOM 1418 C CA . VAL A 1 94 ? 12.128 26.274 13.812 1.00 16.05 ? 93 VAL A CA 1 +ATOM 1419 C C . VAL A 1 94 ? 12.537 26.118 12.356 1.00 16.81 ? 93 VAL A C 1 +ATOM 1420 O O . VAL A 1 94 ? 12.549 25.003 11.835 1.00 18.29 ? 93 VAL A O 1 +ATOM 1421 C CB . VAL A 1 94 ? 13.243 25.728 14.681 1.00 17.60 ? 93 VAL A CB 1 +ATOM 1422 C CG1 . VAL A 1 94 ? 14.556 26.429 14.388 1.00 17.82 ? 93 VAL A CG1 1 +ATOM 1423 C CG2 . VAL A 1 94 ? 12.907 25.902 16.141 1.00 17.62 ? 93 VAL A CG2 1 +ATOM 1424 H H . VAL A 1 94 ? 11.022 24.703 14.213 1.00 18.82 ? 93 VAL A H 1 +ATOM 1425 H HA . VAL A 1 94 ? 11.999 27.215 14.010 1.00 19.26 ? 93 VAL A HA 1 +ATOM 1426 H HB . VAL A 1 94 ? 13.356 24.781 14.503 1.00 21.12 ? 93 VAL A HB 1 +ATOM 1427 H HG11 . VAL A 1 94 ? 15.246 26.057 14.959 1.00 21.39 ? 93 VAL A HG11 1 +ATOM 1428 H HG12 . VAL A 1 94 ? 14.787 26.290 13.456 1.00 21.39 ? 93 VAL A HG12 1 +ATOM 1429 H HG13 . VAL A 1 94 ? 14.454 27.377 14.566 1.00 21.39 ? 93 VAL A HG13 1 +ATOM 1430 H HG21 . VAL A 1 94 ? 13.634 25.547 16.677 1.00 21.15 ? 93 VAL A HG21 1 +ATOM 1431 H HG22 . VAL A 1 94 ? 12.790 26.847 16.328 1.00 21.15 ? 93 VAL A HG22 1 +ATOM 1432 H HG23 . VAL A 1 94 ? 12.087 25.422 16.335 1.00 21.15 ? 93 VAL A HG23 1 +ATOM 1433 N N . GLN A 1 95 ? 12.865 27.230 11.714 1.00 15.45 ? 94 GLN A N 1 +ATOM 1434 C CA . GLN A 1 95 ? 13.240 27.218 10.304 1.00 15.23 ? 94 GLN A CA 1 +ATOM 1435 C C . GLN A 1 95 ? 14.638 27.800 10.221 1.00 15.91 ? 94 GLN A C 1 +ATOM 1436 O O . GLN A 1 95 ? 14.889 28.945 10.609 1.00 15.93 ? 94 GLN A O 1 +ATOM 1437 C CB . GLN A 1 95 ? 12.229 27.986 9.437 1.00 14.26 ? 94 GLN A CB 1 +ATOM 1438 C CG . GLN A 1 95 ? 12.694 28.164 7.968 1.00 14.15 ? 94 GLN A CG 1 +ATOM 1439 C CD . GLN A 1 95 ? 11.556 28.557 7.056 1.00 13.27 ? 94 GLN A CD 1 +ATOM 1440 O OE1 . GLN A 1 95 ? 10.517 27.896 7.031 1.00 14.82 ? 94 GLN A OE1 1 +ATOM 1441 N NE2 . GLN A 1 95 ? 11.731 29.657 6.323 1.00 13.08 ? 94 GLN A NE2 1 +ATOM 1442 H H . GLN A 1 95 ? 12.879 28.011 12.073 1.00 18.54 ? 94 GLN A H 1 +ATOM 1443 H HA . GLN A 1 95 ? 13.273 26.301 9.990 1.00 18.28 ? 94 GLN A HA 1 +ATOM 1444 H HB2 . GLN A 1 95 ? 11.390 27.500 9.428 1.00 17.12 ? 94 GLN A HB2 1 +ATOM 1445 H HB3 . GLN A 1 95 ? 12.095 28.868 9.817 1.00 17.12 ? 94 GLN A HB3 1 +ATOM 1446 H HG2 . GLN A 1 95 ? 13.367 28.862 7.930 1.00 16.98 ? 94 GLN A HG2 1 +ATOM 1447 H HG3 . GLN A 1 95 ? 13.063 27.326 7.648 1.00 16.98 ? 94 GLN A HG3 1 +ATOM 1448 H HE21 . GLN A 1 95 ? 12.464 30.103 6.385 1.00 15.70 ? 94 GLN A HE21 1 +ATOM 1449 H HE22 . GLN A 1 95 ? 11.112 29.921 5.789 1.00 15.70 ? 94 GLN A HE22 1 +ATOM 1450 N N . GLU A 1 96 ? 15.561 26.956 9.778 1.00 16.58 ? 95 GLU A N 1 +ATOM 1451 C CA . GLU A 1 96 ? 16.940 27.341 9.627 1.00 17.37 ? 95 GLU A CA 1 +ATOM 1452 C C . GLU A 1 96 ? 17.343 27.253 8.174 1.00 17.37 ? 95 GLU A C 1 +ATOM 1453 O O . GLU A 1 96 ? 16.919 26.338 7.455 1.00 18.53 ? 95 GLU A O 1 +ATOM 1454 C CB . GLU A 1 96 ? 17.850 26.444 10.471 1.00 18.45 ? 95 GLU A CB 1 +ATOM 1455 C CG . GLU A 1 96 ? 17.574 26.572 11.968 1.00 21.33 ? 95 GLU A CG 1 +ATOM 1456 C CD . GLU A 1 96 ? 18.336 25.567 12.810 1.00 35.83 ? 95 GLU A CD 1 +ATOM 1457 O OE1 . GLU A 1 96 ? 17.992 24.368 12.750 1.00 43.49 ? 95 GLU A OE1 1 +ATOM 1458 O OE2 . GLU A 1 96 ? 19.246 25.987 13.559 1.00 40.30 ? 95 GLU A OE2 1 +ATOM 1459 H H . GLU A 1 96 ? 15.402 26.140 9.556 1.00 19.90 ? 95 GLU A H 1 +ATOM 1460 H HA . GLU A 1 96 ? 17.053 28.258 9.922 1.00 20.84 ? 95 GLU A HA 1 +ATOM 1461 H HB2 . GLU A 1 96 ? 17.708 25.519 10.216 1.00 22.15 ? 95 GLU A HB2 1 +ATOM 1462 H HB3 . GLU A 1 96 ? 18.774 26.694 10.314 1.00 22.15 ? 95 GLU A HB3 1 +ATOM 1463 H HG2 . GLU A 1 96 ? 17.830 27.460 12.260 1.00 25.59 ? 95 GLU A HG2 1 +ATOM 1464 H HG3 . GLU A 1 96 ? 16.626 26.434 12.125 1.00 25.59 ? 95 GLU A HG3 1 +ATOM 1465 N N . ARG A 1 97 ? 18.141 28.212 7.740 1.00 17.62 ? 96 ARG A N 1 +ATOM 1466 C CA . ARG A 1 97 ? 18.701 28.190 6.396 1.00 17.85 ? 96 ARG A CA 1 +ATOM 1467 C C . ARG A 1 97 ? 20.153 28.571 6.356 1.00 19.82 ? 96 ARG A C 1 +ATOM 1468 O O . ARG A 1 97 ? 20.630 29.319 7.200 1.00 19.73 ? 96 ARG A O 1 +ATOM 1469 C CB . ARG A 1 97 ? 18.001 29.186 5.483 1.00 17.03 ? 96 ARG A CB 1 +ATOM 1470 C CG . ARG A 1 97 ? 16.559 28.922 5.191 1.00 16.05 ? 96 ARG A CG 1 +ATOM 1471 C CD . ARG A 1 97 ? 16.247 29.383 3.754 1.00 15.67 ? 96 ARG A CD 1 +ATOM 1472 N NE . ARG A 1 97 ? 14.855 29.108 3.368 1.00 16.69 ? 96 ARG A NE 1 +ATOM 1473 C CZ . ARG A 1 97 ? 13.840 29.955 3.525 1.00 16.33 ? 96 ARG A CZ 1 +ATOM 1474 N NH1 . ARG A 1 97 ? 14.030 31.141 4.067 1.00 16.61 ? 96 ARG A NH1 1 +ATOM 1475 N NH2 . ARG A 1 97 ? 12.629 29.626 3.128 1.00 13.37 ? 96 ARG A NH2 1 +ATOM 1476 H H . ARG A 1 97 ? 18.378 28.894 8.207 1.00 21.14 ? 96 ARG A H 1 +ATOM 1477 H HA . ARG A 1 97 ? 18.603 27.302 6.017 1.00 21.43 ? 96 ARG A HA 1 +ATOM 1478 H HB2 . ARG A 1 97 ? 18.055 30.063 5.893 1.00 20.44 ? 96 ARG A HB2 1 +ATOM 1479 H HB3 . ARG A 1 97 ? 18.469 29.200 4.633 1.00 20.44 ? 96 ARG A HB3 1 +ATOM 1480 H HG2 . ARG A 1 97 ? 16.379 27.971 5.259 1.00 19.26 ? 96 ARG A HG2 1 +ATOM 1481 H HG3 . ARG A 1 97 ? 16.002 29.423 5.807 1.00 19.26 ? 96 ARG A HG3 1 +ATOM 1482 H HD2 . ARG A 1 97 ? 16.394 30.339 3.689 1.00 18.80 ? 96 ARG A HD2 1 +ATOM 1483 H HD3 . ARG A 1 97 ? 16.829 28.913 3.137 1.00 18.80 ? 96 ARG A HD3 1 +ATOM 1484 H HE . ARG A 1 97 ? 14.684 28.344 3.013 1.00 20.02 ? 96 ARG A HE 1 +ATOM 1485 H HH11 . ARG A 1 97 ? 14.817 31.374 4.326 1.00 19.93 ? 96 ARG A HH11 1 +ATOM 1486 H HH12 . ARG A 1 97 ? 13.368 31.680 4.165 1.00 19.93 ? 96 ARG A HH12 1 +ATOM 1487 H HH21 . ARG A 1 97 ? 12.487 28.855 2.774 1.00 16.04 ? 96 ARG A HH21 1 +ATOM 1488 H HH22 . ARG A 1 97 ? 11.976 30.176 3.238 1.00 16.04 ? 96 ARG A HH22 1 +ATOM 1489 N N . THR A 1 98 ? 20.841 28.088 5.318 1.00 19.55 ? 97 THR A N 1 +ATOM 1490 C CA . THR A 1 98 ? 22.012 28.781 4.803 1.00 24.10 ? 97 THR A CA 1 +ATOM 1491 C C . THR A 1 98 ? 21.680 29.190 3.352 1.00 24.97 ? 97 THR A C 1 +ATOM 1492 O O . THR A 1 98 ? 21.149 28.402 2.582 1.00 21.90 ? 97 THR A O 1 +ATOM 1493 C CB . THR A 1 98 ? 23.283 27.932 4.870 1.00 21.62 ? 97 THR A CB 1 +ATOM 1494 O OG1 . THR A 1 98 ? 23.472 27.467 6.215 1.00 26.79 ? 97 THR A OG1 1 +ATOM 1495 C CG2 . THR A 1 98 ? 24.499 28.755 4.457 1.00 26.15 ? 97 THR A CG2 1 +ATOM 1496 H H . THR A 1 98 ? 20.646 27.363 4.899 1.00 23.45 ? 97 THR A H 1 +ATOM 1497 H HA . THR A 1 98 ? 22.159 29.588 5.320 1.00 28.92 ? 97 THR A HA 1 +ATOM 1498 H HB . THR A 1 98 ? 23.202 27.174 4.271 1.00 25.95 ? 97 THR A HB 1 +ATOM 1499 H HG1 . THR A 1 98 ? 24.168 26.999 6.262 1.00 32.15 ? 97 THR A HG1 1 +ATOM 1500 H HG21 . THR A 1 98 ? 25.300 28.209 4.503 1.00 31.38 ? 97 THR A HG21 1 +ATOM 1501 H HG22 . THR A 1 98 ? 24.388 29.076 3.548 1.00 31.38 ? 97 THR A HG22 1 +ATOM 1502 H HG23 . THR A 1 98 ? 24.602 29.516 5.050 1.00 31.38 ? 97 THR A HG23 1 +ATOM 1503 N N . ILE A 1 99 ? 21.920 30.452 3.025 1.00 20.09 ? 98 ILE A N 1 +ATOM 1504 C CA . ILE A 1 99 ? 21.685 30.945 1.679 1.00 19.52 ? 98 ILE A CA 1 +ATOM 1505 C C . ILE A 1 99 ? 23.039 31.333 1.134 1.00 20.64 ? 98 ILE A C 1 +ATOM 1506 O O . ILE A 1 99 ? 23.702 32.231 1.675 1.00 21.63 ? 98 ILE A O 1 +ATOM 1507 C CB . ILE A 1 99 ? 20.734 32.162 1.667 1.00 19.30 ? 98 ILE A CB 1 +ATOM 1508 C CG1 . ILE A 1 99 ? 19.436 31.835 2.415 1.00 17.56 ? 98 ILE A CG1 1 +ATOM 1509 C CG2 . ILE A 1 99 ? 20.472 32.610 0.222 1.00 20.68 ? 98 ILE A CG2 1 +ATOM 1510 C CD1 . ILE A 1 99 ? 18.517 33.037 2.614 1.00 16.73 ? 98 ILE A CD1 1 +ATOM 1511 H H . ILE A 1 99 ? 22.221 31.046 3.569 1.00 24.10 ? 98 ILE A H 1 +ATOM 1512 H HA . ILE A 1 99 ? 21.309 30.242 1.126 1.00 23.43 ? 98 ILE A HA 1 +ATOM 1513 H HB . ILE A 1 99 ? 21.173 32.891 2.132 1.00 23.16 ? 98 ILE A HB 1 +ATOM 1514 H HG12 . ILE A 1 99 ? 18.944 31.168 1.910 1.00 21.07 ? 98 ILE A HG12 1 +ATOM 1515 H HG13 . ILE A 1 99 ? 19.660 31.485 3.291 1.00 21.07 ? 98 ILE A HG13 1 +ATOM 1516 H HG21 . ILE A 1 99 ? 19.874 33.374 0.232 1.00 24.82 ? 98 ILE A HG21 1 +ATOM 1517 H HG22 . ILE A 1 99 ? 21.316 32.855 -0.190 1.00 24.82 ? 98 ILE A HG22 1 +ATOM 1518 H HG23 . ILE A 1 99 ? 20.066 31.877 -0.266 1.00 24.82 ? 98 ILE A HG23 1 +ATOM 1519 H HD11 . ILE A 1 99 ? 17.723 32.751 3.092 1.00 20.08 ? 98 ILE A HD11 1 +ATOM 1520 H HD12 . ILE A 1 99 ? 18.988 33.711 3.129 1.00 20.08 ? 98 ILE A HD12 1 +ATOM 1521 H HD13 . ILE A 1 99 ? 18.272 33.394 1.747 1.00 20.08 ? 98 ILE A HD13 1 +ATOM 1522 N N . PHE A 1 100 ? 23.479 30.614 0.099 1.00 24.99 ? 99 PHE A N 1 +ATOM 1523 C CA . PHE A 1 100 ? 24.761 30.879 -0.548 1.00 23.05 ? 99 PHE A CA 1 +ATOM 1524 C C . PHE A 1 100 ? 24.553 31.699 -1.799 1.00 23.92 ? 99 PHE A C 1 +ATOM 1525 O O . PHE A 1 100 ? 24.013 31.196 -2.786 1.00 22.24 ? 99 PHE A O 1 +ATOM 1526 C CB . PHE A 1 100 ? 25.447 29.570 -0.954 1.00 23.55 ? 99 PHE A CB 1 +ATOM 1527 C CG . PHE A 1 100 ? 25.746 28.658 0.199 1.00 23.89 ? 99 PHE A CG 1 +ATOM 1528 C CD1 . PHE A 1 100 ? 26.888 28.830 0.958 1.00 24.84 ? 99 PHE A CD1 1 +ATOM 1529 C CD2 . PHE A 1 100 ? 24.881 27.635 0.521 1.00 27.85 ? 99 PHE A CD2 1 +ATOM 1530 C CE1 . PHE A 1 100 ? 27.162 27.989 2.016 1.00 25.25 ? 99 PHE A CE1 1 +ATOM 1531 C CE2 . PHE A 1 100 ? 25.140 26.791 1.582 1.00 25.43 ? 99 PHE A CE2 1 +ATOM 1532 C CZ . PHE A 1 100 ? 26.291 26.965 2.326 1.00 30.08 ? 99 PHE A CZ 1 +ATOM 1533 H H . PHE A 1 100 ? 23.044 29.960 -0.251 1.00 29.99 ? 99 PHE A H 1 +ATOM 1534 H HA . PHE A 1 100 ? 25.342 31.367 0.057 1.00 27.66 ? 99 PHE A HA 1 +ATOM 1535 H HB2 . PHE A 1 100 ? 24.868 29.091 -1.568 1.00 28.26 ? 99 PHE A HB2 1 +ATOM 1536 H HB3 . PHE A 1 100 ? 26.287 29.780 -1.391 1.00 28.26 ? 99 PHE A HB3 1 +ATOM 1537 H HD1 . PHE A 1 100 ? 27.481 29.515 0.749 1.00 29.80 ? 99 PHE A HD1 1 +ATOM 1538 H HD2 . PHE A 1 100 ? 24.108 27.513 0.018 1.00 33.42 ? 99 PHE A HD2 1 +ATOM 1539 H HE1 . PHE A 1 100 ? 27.934 28.111 2.519 1.00 30.30 ? 99 PHE A HE1 1 +ATOM 1540 H HE2 . PHE A 1 100 ? 24.550 26.102 1.787 1.00 30.51 ? 99 PHE A HE2 1 +ATOM 1541 H HZ . PHE A 1 100 ? 26.472 26.400 3.043 1.00 36.10 ? 99 PHE A HZ 1 +ATOM 1542 N N . PHE A 1 101 ? 24.975 32.960 -1.760 1.00 24.64 ? 100 PHE A N 1 +ATOM 1543 C CA . PHE A 1 101 ? 24.881 33.820 -2.935 1.00 22.70 ? 100 PHE A CA 1 +ATOM 1544 C C . PHE A 1 101 ? 26.070 33.484 -3.858 1.00 26.60 ? 100 PHE A C 1 +ATOM 1545 O O . PHE A 1 101 ? 27.233 33.498 -3.443 1.00 25.11 ? 100 PHE A O 1 +ATOM 1546 C CB . PHE A 1 101 ? 24.855 35.304 -2.523 1.00 22.85 ? 100 PHE A CB 1 +ATOM 1547 C CG . PHE A 1 101 ? 23.565 35.728 -1.827 1.00 23.85 ? 100 PHE A CG 1 +ATOM 1548 C CD1 . PHE A 1 101 ? 23.431 35.629 -0.443 1.00 23.82 ? 100 PHE A CD1 1 +ATOM 1549 C CD2 . PHE A 1 101 ? 22.483 36.207 -2.564 1.00 20.32 ? 100 PHE A CD2 1 +ATOM 1550 C CE1 . PHE A 1 101 ? 22.230 36.008 0.198 1.00 24.35 ? 100 PHE A CE1 1 +ATOM 1551 C CE2 . PHE A 1 101 ? 21.276 36.588 -1.939 1.00 20.35 ? 100 PHE A CE2 1 +ATOM 1552 C CZ . PHE A 1 101 ? 21.147 36.482 -0.552 1.00 21.80 ? 100 PHE A CZ 1 +ATOM 1553 H H . PHE A 1 101 ? 25.318 33.339 -1.069 1.00 29.56 ? 100 PHE A H 1 +ATOM 1554 H HA . PHE A 1 101 ? 24.060 33.622 -3.412 1.00 27.24 ? 100 PHE A HA 1 +ATOM 1555 H HB2 . PHE A 1 101 ? 25.590 35.472 -1.913 1.00 27.42 ? 100 PHE A HB2 1 +ATOM 1556 H HB3 . PHE A 1 101 ? 24.956 35.850 -3.318 1.00 27.42 ? 100 PHE A HB3 1 +ATOM 1557 H HD1 . PHE A 1 101 ? 24.141 35.308 0.065 1.00 28.58 ? 100 PHE A HD1 1 +ATOM 1558 H HD2 . PHE A 1 101 ? 22.557 36.273 -3.488 1.00 24.39 ? 100 PHE A HD2 1 +ATOM 1559 H HE1 . PHE A 1 101 ? 22.157 35.937 1.122 1.00 29.22 ? 100 PHE A HE1 1 +ATOM 1560 H HE2 . PHE A 1 101 ? 20.567 36.906 -2.450 1.00 24.42 ? 100 PHE A HE2 1 +ATOM 1561 H HZ . PHE A 1 101 ? 20.359 36.739 -0.130 1.00 26.16 ? 100 PHE A HZ 1 +ATOM 1562 N N . LYS A 1 102 ? 25.784 33.125 -5.103 1.00 24.25 ? 101 LYS A N 1 +ATOM 1563 C CA . LYS A 1 102 ? 26.840 32.653 -5.971 1.00 25.68 ? 101 LYS A CA 1 +ATOM 1564 C C . LYS A 1 102 ? 27.872 33.750 -6.142 1.00 26.58 ? 101 LYS A C 1 +ATOM 1565 O O . LYS A 1 102 ? 27.521 34.920 -6.338 1.00 26.14 ? 101 LYS A O 1 +ATOM 1566 C CB . LYS A 1 102 ? 26.288 32.214 -7.327 1.00 25.76 ? 101 LYS A CB 1 +ATOM 1567 C CG . LYS A 1 102 ? 27.364 31.709 -8.255 1.00 27.37 ? 101 LYS A CG 1 +ATOM 1568 C CD . LYS A 1 102 ? 26.788 31.456 -9.633 1.00 34.20 ? 101 LYS A CD 1 +ATOM 1569 C CE . LYS A 1 102 ? 27.855 30.977 -10.617 1.00 41.85 ? 101 LYS A CE 1 +ATOM 1570 N NZ . LYS A 1 102 ? 28.256 29.563 -10.349 1.00 53.56 ? 101 LYS A NZ 1 +ATOM 1571 H H . LYS A 1 102 ? 25.001 33.146 -5.459 1.00 29.09 ? 101 LYS A H 1 +ATOM 1572 H HA . LYS A 1 102 ? 27.274 31.889 -5.560 1.00 30.81 ? 101 LYS A HA 1 +ATOM 1573 H HB2 . LYS A 1 102 ? 25.647 31.499 -7.191 1.00 30.92 ? 101 LYS A HB2 1 +ATOM 1574 H HB3 . LYS A 1 102 ? 25.855 32.971 -7.752 1.00 30.92 ? 101 LYS A HB3 1 +ATOM 1575 H HG2 . LYS A 1 102 ? 28.065 32.374 -8.332 1.00 32.85 ? 101 LYS A HG2 1 +ATOM 1576 H HG3 . LYS A 1 102 ? 27.722 30.875 -7.913 1.00 32.85 ? 101 LYS A HG3 1 +ATOM 1577 H HD2 . LYS A 1 102 ? 26.104 30.771 -9.572 1.00 41.04 ? 101 LYS A HD2 1 +ATOM 1578 H HD3 . LYS A 1 102 ? 26.408 32.279 -9.976 1.00 41.04 ? 101 LYS A HD3 1 +ATOM 1579 H HE2 . LYS A 1 102 ? 27.503 31.027 -11.520 1.00 50.22 ? 101 LYS A HE2 1 +ATOM 1580 H HE3 . LYS A 1 102 ? 28.642 31.537 -10.533 1.00 50.22 ? 101 LYS A HE3 1 +ATOM 1581 H HZ1 . LYS A 1 102 ? 28.877 29.307 -10.934 1.00 64.27 ? 101 LYS A HZ1 1 +ATOM 1582 H HZ2 . LYS A 1 102 ? 28.587 29.492 -9.526 1.00 64.27 ? 101 LYS A HZ2 1 +ATOM 1583 H HZ3 . LYS A 1 102 ? 27.549 29.027 -10.425 1.00 64.27 ? 101 LYS A HZ3 1 +ATOM 1584 N N . ASP A 1 103 ? 29.142 33.359 -6.035 0.83 27.92 ? 102 ASP A N 1 +ATOM 1585 C CA . ASP A 1 103 ? 30.276 34.277 -6.137 0.83 28.99 ? 102 ASP A CA 1 +ATOM 1586 C C . ASP A 1 103 ? 30.319 35.334 -5.037 0.83 32.15 ? 102 ASP A C 1 +ATOM 1587 O O . ASP A 1 103 ? 30.960 36.371 -5.184 0.83 29.03 ? 102 ASP A O 1 +ATOM 1588 C CB . ASP A 1 103 ? 30.290 34.959 -7.507 0.83 30.75 ? 102 ASP A CB 1 +ATOM 1589 C CG . ASP A 1 103 ? 30.505 33.977 -8.626 0.83 33.92 ? 102 ASP A CG 1 +ATOM 1590 O OD1 . ASP A 1 103 ? 31.458 33.195 -8.504 0.83 31.59 ? 102 ASP A OD1 1 +ATOM 1591 O OD2 . ASP A 1 103 ? 29.722 33.962 -9.602 0.83 30.10 ? 102 ASP A OD2 1 +ATOM 1592 H H . ASP A 1 103 ? 29.378 32.543 -5.900 0.83 33.50 ? 102 ASP A H 1 +ATOM 1593 H HA . ASP A 1 103 ? 31.092 33.757 -6.066 0.83 34.79 ? 102 ASP A HA 1 +ATOM 1594 H HB2 . ASP A 1 103 ? 29.438 35.399 -7.652 0.83 36.91 ? 102 ASP A HB2 1 +ATOM 1595 H HB3 . ASP A 1 103 ? 31.010 35.608 -7.533 0.83 36.91 ? 102 ASP A HB3 1 +ATOM 1596 N N . ASP A 1 104 ? 29.649 35.083 -3.924 1.00 29.88 ? 103 ASP A N 1 +ATOM 1597 C CA . ASP A 1 104 ? 29.581 36.111 -2.898 1.00 27.50 ? 103 ASP A CA 1 +ATOM 1598 C C . ASP A 1 104 ? 29.355 35.456 -1.538 1.00 28.22 ? 103 ASP A C 1 +ATOM 1599 O O . ASP A 1 104 ? 29.613 34.267 -1.374 1.00 26.84 ? 103 ASP A O 1 +ATOM 1600 C CB . ASP A 1 104 ? 28.470 37.098 -3.245 1.00 28.44 ? 103 ASP A CB 1 +ATOM 1601 C CG . ASP A 1 104 ? 28.735 38.490 -2.736 1.00 28.16 ? 103 ASP A CG 1 +ATOM 1602 O OD1 . ASP A 1 104 ? 29.450 38.632 -1.724 1.00 30.13 ? 103 ASP A OD1 1 +ATOM 1603 O OD2 . ASP A 1 104 ? 28.210 39.453 -3.338 1.00 28.75 ? 103 ASP A OD2 1 +ATOM 1604 H H . ASP A 1 104 ? 29.237 34.351 -3.740 0.83 35.86 ? 103 ASP A H 1 +ATOM 1605 H HA . ASP A 1 104 ? 30.422 36.594 -2.869 1.00 33.00 ? 103 ASP A HA 1 +ATOM 1606 H HB2 . ASP A 1 104 ? 28.381 37.144 -4.210 1.00 34.13 ? 103 ASP A HB2 1 +ATOM 1607 H HB3 . ASP A 1 104 ? 27.639 36.788 -2.851 1.00 34.13 ? 103 ASP A HB3 1 +ATOM 1608 N N . GLY A 1 105 ? 28.890 36.227 -0.564 1.00 30.53 ? 104 GLY A N 1 +ATOM 1609 C CA . GLY A 1 105 ? 28.773 35.723 0.785 1.00 25.23 ? 104 GLY A CA 1 +ATOM 1610 C C . GLY A 1 105 ? 27.541 34.864 1.002 1.00 24.44 ? 104 GLY A C 1 +ATOM 1611 O O . GLY A 1 105 ? 26.833 34.479 0.049 1.00 23.67 ? 104 GLY A O 1 +ATOM 1612 H H . GLY A 1 105 ? 28.637 37.043 -0.662 1.00 36.63 ? 104 GLY A H 1 +ATOM 1613 H HA2 . GLY A 1 105 ? 29.556 35.191 0.996 1.00 30.28 ? 104 GLY A HA2 1 +ATOM 1614 H HA3 . GLY A 1 105 ? 28.736 36.470 1.403 1.00 30.28 ? 104 GLY A HA3 1 +ATOM 1615 N N . ASN A 1 106 ? 27.279 34.539 2.265 1.00 23.77 ? 105 ASN A N 1 +ATOM 1616 C CA . ASN A 1 106 ? 26.134 33.716 2.600 1.00 22.81 ? 105 ASN A CA 1 +ATOM 1617 C C . ASN A 1 106 ? 25.394 34.251 3.800 1.00 23.90 ? 105 ASN A C 1 +ATOM 1618 O O . ASN A 1 106 ? 25.989 34.929 4.659 1.00 23.06 ? 105 ASN A O 1 +ATOM 1619 C CB . ASN A 1 106 ? 26.577 32.293 2.919 1.00 23.45 ? 105 ASN A CB 1 +ATOM 1620 C CG . ASN A 1 106 ? 27.494 32.235 4.129 1.00 29.41 ? 105 ASN A CG 1 +ATOM 1621 O OD1 . ASN A 1 106 ? 27.028 32.202 5.274 1.00 26.95 ? 105 ASN A OD1 1 +ATOM 1622 N ND2 . ASN A 1 106 ? 28.802 32.229 3.884 1.00 28.22 ? 105 ASN A ND2 1 +ATOM 1623 H H . ASN A 1 106 ? 27.750 34.784 2.941 1.00 28.53 ? 105 ASN A H 1 +ATOM 1624 H HA . ASN A 1 106 ? 25.523 33.688 1.848 1.00 27.38 ? 105 ASN A HA 1 +ATOM 1625 H HB2 . ASN A 1 106 ? 25.795 31.751 3.106 1.00 28.14 ? 105 ASN A HB2 1 +ATOM 1626 H HB3 . ASN A 1 106 ? 27.059 31.932 2.158 1.00 28.14 ? 105 ASN A HB3 1 +ATOM 1627 H HD21 . ASN A 1 106 ? 29.088 32.257 3.074 1.00 33.86 ? 105 ASN A HD21 1 +ATOM 1628 H HD22 . ASN A 1 106 ? 29.361 32.197 4.537 1.00 33.86 ? 105 ASN A HD22 1 +ATOM 1629 N N . TYR A 1 107 ? 24.103 33.935 3.862 1.00 23.65 ? 106 TYR A N 1 +ATOM 1630 C CA . TYR A 1 107 ? 23.316 34.175 5.064 1.00 20.90 ? 106 TYR A CA 1 +ATOM 1631 C C . TYR A 1 107 ? 23.092 32.877 5.802 1.00 24.50 ? 106 TYR A C 1 +ATOM 1632 O O . TYR A 1 107 ? 22.815 31.845 5.188 1.00 20.22 ? 106 TYR A O 1 +ATOM 1633 C CB . TYR A 1 107 ? 21.937 34.732 4.718 1.00 19.20 ? 106 TYR A CB 1 +ATOM 1634 C CG . TYR A 1 107 ? 21.885 36.118 4.106 1.00 19.95 ? 106 TYR A CG 1 +ATOM 1635 C CD1 . TYR A 1 107 ? 22.972 36.983 4.150 1.00 19.79 ? 106 TYR A CD1 1 +ATOM 1636 C CD2 . TYR A 1 107 ? 20.720 36.563 3.488 1.00 18.11 ? 106 TYR A CD2 1 +ATOM 1637 C CE1 . TYR A 1 107 ? 22.896 38.254 3.592 1.00 21.60 ? 106 TYR A CE1 1 +ATOM 1638 C CE2 . TYR A 1 107 ? 20.629 37.822 2.946 1.00 18.29 ? 106 TYR A CE2 1 +ATOM 1639 C CZ . TYR A 1 107 ? 21.720 38.667 2.990 1.00 24.40 ? 106 TYR A CZ 1 +ATOM 1640 O OH . TYR A 1 107 ? 21.622 39.925 2.435 1.00 18.90 ? 106 TYR A OH 1 +ATOM 1641 H H . TYR A 1 107 ? 23.659 33.578 3.218 1.00 28.38 ? 106 TYR A H 1 +ATOM 1642 H HA . TYR A 1 107 ? 23.776 34.799 5.647 1.00 25.08 ? 106 TYR A HA 1 +ATOM 1643 H HB2 . TYR A 1 107 ? 21.516 34.126 4.088 1.00 23.04 ? 106 TYR A HB2 1 +ATOM 1644 H HB3 . TYR A 1 107 ? 21.411 34.761 5.533 1.00 23.04 ? 106 TYR A HB3 1 +ATOM 1645 H HD1 . TYR A 1 107 ? 23.761 36.707 4.557 1.00 23.75 ? 106 TYR A HD1 1 +ATOM 1646 H HD2 . TYR A 1 107 ? 19.979 36.001 3.458 1.00 21.73 ? 106 TYR A HD2 1 +ATOM 1647 H HE1 . TYR A 1 107 ? 23.630 38.825 3.628 1.00 25.92 ? 106 TYR A HE1 1 +ATOM 1648 H HE2 . TYR A 1 107 ? 19.841 38.097 2.536 1.00 21.95 ? 106 TYR A HE2 1 +ATOM 1649 H HH . TYR A 1 107 ? 20.856 40.036 2.108 1.00 22.68 ? 106 TYR A HH 1 +ATOM 1650 N N . LYS A 1 108 ? 23.179 32.936 7.126 1.00 20.92 ? 107 LYS A N 1 +ATOM 1651 C CA . LYS A 1 108 ? 22.658 31.877 7.959 1.00 20.29 ? 107 LYS A CA 1 +ATOM 1652 C C . LYS A 1 108 ? 21.535 32.475 8.781 1.00 19.44 ? 107 LYS A C 1 +ATOM 1653 O O . LYS A 1 108 ? 21.698 33.539 9.395 1.00 19.53 ? 107 LYS A O 1 +ATOM 1654 C CB . LYS A 1 108 ? 23.751 31.310 8.853 1.00 22.82 ? 107 LYS A CB 1 +ATOM 1655 C CG . LYS A 1 108 ? 24.807 30.526 8.092 1.00 28.41 ? 107 LYS A CG 1 +ATOM 1656 C CD . LYS A 1 108 ? 25.895 30.017 9.035 1.00 34.84 ? 107 LYS A CD 1 +ATOM 1657 H H . LYS A 1 108 ? 23.538 33.584 7.563 1.00 25.10 ? 107 LYS A H 1 +ATOM 1658 H HA . LYS A 1 108 ? 22.301 31.165 7.405 1.00 24.35 ? 107 LYS A HA 1 +ATOM 1659 H HB2 . LYS A 1 108 ? 24.194 32.042 9.309 1.00 27.38 ? 107 LYS A HB2 1 +ATOM 1660 H HB3 . LYS A 1 108 ? 23.347 30.713 9.503 1.00 27.38 ? 107 LYS A HB3 1 +ATOM 1661 H HG2 . LYS A 1 108 ? 24.393 29.761 7.662 1.00 34.09 ? 107 LYS A HG2 1 +ATOM 1662 H HG3 . LYS A 1 108 ? 25.221 31.102 7.431 1.00 34.09 ? 107 LYS A HG3 1 +ATOM 1663 N N . THR A 1 109 ? 20.402 31.792 8.793 1.00 18.71 ? 108 THR A N 1 +ATOM 1664 C CA . THR A 1 109 ? 19.228 32.303 9.464 1.00 17.92 ? 108 THR A CA 1 +ATOM 1665 C C . THR A 1 109 ? 18.607 31.250 10.354 1.00 18.59 ? 108 THR A C 1 +ATOM 1666 O O . THR A 1 109 ? 18.663 30.060 10.060 1.00 18.03 ? 108 THR A O 1 +ATOM 1667 C CB . THR A 1 109 ? 18.177 32.788 8.482 1.00 16.96 ? 108 THR A CB 1 +ATOM 1668 O OG1 . THR A 1 109 ? 17.698 31.667 7.726 1.00 17.26 ? 108 THR A OG1 1 +ATOM 1669 C CG2 . THR A 1 109 ? 18.766 33.855 7.534 1.00 17.13 ? 108 THR A CG2 1 +ATOM 1670 H H . THR A 1 109 ? 20.289 31.027 8.416 1.00 22.45 ? 108 THR A H 1 +ATOM 1671 H HA . THR A 1 109 ? 19.486 33.053 10.022 1.00 21.51 ? 108 THR A HA 1 +ATOM 1672 H HB . THR A 1 109 ? 17.439 33.186 8.971 1.00 20.35 ? 108 THR A HB 1 +ATOM 1673 H HG1 . THR A 1 109 ? 17.359 31.096 8.241 1.00 20.71 ? 108 THR A HG1 1 +ATOM 1674 H HG21 . THR A 1 109 ? 18.085 34.157 6.912 1.00 20.56 ? 108 THR A HG21 1 +ATOM 1675 H HG22 . THR A 1 109 ? 19.084 34.614 8.047 1.00 20.56 ? 108 THR A HG22 1 +ATOM 1676 H HG23 . THR A 1 109 ? 19.507 33.480 7.033 1.00 20.56 ? 108 THR A HG23 1 +ATOM 1677 N N . ARG A 1 110 ? 18.016 31.715 11.452 1.00 17.68 ? 109 ARG A N 1 +ATOM 1678 C CA . ARG A 1 110 ? 17.268 30.857 12.326 1.00 17.59 ? 109 ARG A CA 1 +ATOM 1679 C C . ARG A 1 110 ? 16.042 31.624 12.736 1.00 16.86 ? 109 ARG A C 1 +ATOM 1680 O O . ARG A 1 110 ? 16.144 32.760 13.211 1.00 20.14 ? 109 ARG A O 1 +ATOM 1681 C CB . ARG A 1 110 ? 18.078 30.459 13.568 1.00 18.61 ? 109 ARG A CB 1 +ATOM 1682 C CG . ARG A 1 110 ? 17.298 29.582 14.525 1.00 18.64 ? 109 ARG A CG 1 +ATOM 1683 C CD . ARG A 1 110 ? 17.986 29.399 15.889 1.00 21.02 ? 109 ARG A CD 1 +ATOM 1684 N NE . ARG A 1 110 ? 17.301 28.338 16.628 1.00 27.39 ? 109 ARG A NE 1 +ATOM 1685 C CZ . ARG A 1 110 ? 16.215 28.509 17.383 1.00 30.06 ? 109 ARG A CZ 1 +ATOM 1686 N NH1 . ARG A 1 110 ? 15.682 29.719 17.563 1.00 25.98 ? 109 ARG A NH1 1 +ATOM 1687 N NH2 . ARG A 1 110 ? 15.661 27.457 17.969 1.00 30.27 ? 109 ARG A NH2 1 +ATOM 1688 H H . ARG A 1 110 ? 18.041 32.536 11.705 1.00 21.21 ? 109 ARG A H 1 +ATOM 1689 H HA . ARG A 1 110 ? 16.996 30.054 11.854 1.00 21.11 ? 109 ARG A HA 1 +ATOM 1690 H HB2 . ARG A 1 110 ? 18.866 29.969 13.286 1.00 22.33 ? 109 ARG A HB2 1 +ATOM 1691 H HB3 . ARG A 1 110 ? 18.340 31.262 14.044 1.00 22.33 ? 109 ARG A HB3 1 +ATOM 1692 H HG2 . ARG A 1 110 ? 16.429 29.983 14.682 1.00 22.36 ? 109 ARG A HG2 1 +ATOM 1693 H HG3 . ARG A 1 110 ? 17.188 28.704 14.127 1.00 22.36 ? 109 ARG A HG3 1 +ATOM 1694 H HD2 . ARG A 1 110 ? 18.912 29.140 15.758 1.00 25.23 ? 109 ARG A HD2 1 +ATOM 1695 H HD3 . ARG A 1 110 ? 17.928 30.222 16.399 1.00 25.23 ? 109 ARG A HD3 1 +ATOM 1696 H HE . ARG A 1 110 ? 17.623 27.542 16.571 1.00 32.87 ? 109 ARG A HE 1 +ATOM 1697 H HH11 . ARG A 1 110 ? 16.030 30.404 17.177 1.00 31.18 ? 109 ARG A HH11 1 +ATOM 1698 H HH12 . ARG A 1 110 ? 14.985 29.812 18.059 1.00 31.18 ? 109 ARG A HH12 1 +ATOM 1699 H HH21 . ARG A 1 110 ? 16.006 26.676 17.866 1.00 36.32 ? 109 ARG A HH21 1 +ATOM 1700 H HH22 . ARG A 1 110 ? 14.972 27.559 18.474 1.00 36.32 ? 109 ARG A HH22 1 +ATOM 1701 N N . ALA A 1 111 ? 14.897 30.976 12.572 1.00 16.22 ? 110 ALA A N 1 +ATOM 1702 C CA . ALA A 1 111 ? 13.615 31.587 12.832 1.00 15.82 ? 110 ALA A CA 1 +ATOM 1703 C C . ALA A 1 111 ? 12.700 30.649 13.617 1.00 16.32 ? 110 ALA A C 1 +ATOM 1704 O O . ALA A 1 111 ? 12.776 29.408 13.488 1.00 16.68 ? 110 ALA A O 1 +ATOM 1705 C CB . ALA A 1 111 ? 12.949 31.987 11.496 1.00 15.39 ? 110 ALA A CB 1 +ATOM 1706 H H . ALA A 1 111 ? 14.842 30.160 12.304 1.00 19.46 ? 110 ALA A H 1 +ATOM 1707 H HA . ALA A 1 111 ? 13.747 32.391 13.358 1.00 18.98 ? 110 ALA A HA 1 +ATOM 1708 H HB1 . ALA A 1 111 ? 12.089 32.396 11.683 1.00 18.47 ? 110 ALA A HB1 1 +ATOM 1709 H HB2 . ALA A 1 111 ? 13.522 32.618 11.034 1.00 18.47 ? 110 ALA A HB2 1 +ATOM 1710 H HB3 . ALA A 1 111 ? 12.826 31.191 10.954 1.00 18.47 ? 110 ALA A HB3 1 +ATOM 1711 N N . GLU A 1 112 ? 11.808 31.252 14.392 1.00 15.27 ? 111 GLU A N 1 +ATOM 1712 C CA . GLU A 1 112 ? 10.742 30.521 15.025 1.00 16.38 ? 111 GLU A CA 1 +ATOM 1713 C C . GLU A 1 112 ? 9.443 31.067 14.496 1.00 17.64 ? 111 GLU A C 1 +ATOM 1714 O O . GLU A 1 112 ? 9.200 32.274 14.556 1.00 14.13 ? 111 GLU A O 1 +ATOM 1715 C CB . GLU A 1 112 ? 10.807 30.642 16.559 1.00 16.01 ? 111 GLU A CB 1 +ATOM 1716 C CG . GLU A 1 112 ? 12.089 30.005 17.097 1.00 20.67 ? 111 GLU A CG 1 +ATOM 1717 C CD . GLU A 1 112 ? 12.095 29.863 18.607 1.00 30.32 ? 111 GLU A CD 1 +ATOM 1718 O OE1 . GLU A 1 112 ? 11.057 30.169 19.255 1.00 30.53 ? 111 GLU A OE1 1 +ATOM 1719 O OE2 . GLU A 1 112 ? 13.158 29.448 19.129 1.00 26.28 ? 111 GLU A OE2 1 +ATOM 1720 H H . GLU A 1 112 ? 11.805 32.095 14.564 1.00 18.33 ? 111 GLU A H 1 +ATOM 1721 H HA . GLU A 1 112 ? 10.804 29.583 14.786 1.00 19.65 ? 111 GLU A HA 1 +ATOM 1722 H HB2 . GLU A 1 112 ? 10.802 31.579 16.809 1.00 19.22 ? 111 GLU A HB2 1 +ATOM 1723 H HB3 . GLU A 1 112 ? 10.048 30.182 16.951 1.00 19.22 ? 111 GLU A HB3 1 +ATOM 1724 H HG2 . GLU A 1 112 ? 12.186 29.120 16.714 1.00 24.80 ? 111 GLU A HG2 1 +ATOM 1725 H HG3 . GLU A 1 112 ? 12.845 30.559 16.847 1.00 24.80 ? 111 GLU A HG3 1 +ATOM 1726 N N . VAL A 1 113 ? 8.626 30.157 13.983 1.00 14.34 ? 112 VAL A N 1 +ATOM 1727 C CA . VAL A 1 113 ? 7.324 30.486 13.432 1.00 13.02 ? 112 VAL A CA 1 +ATOM 1728 C C . VAL A 1 113 ? 6.240 29.779 14.237 1.00 18.52 ? 112 VAL A C 1 +ATOM 1729 O O . VAL A 1 113 ? 6.230 28.553 14.339 1.00 13.22 ? 112 VAL A O 1 +ATOM 1730 C CB . VAL A 1 113 ? 7.236 30.024 11.968 1.00 13.59 ? 112 VAL A CB 1 +ATOM 1731 C CG1 . VAL A 1 113 ? 5.906 30.427 11.353 1.00 11.69 ? 112 VAL A CG1 1 +ATOM 1732 C CG2 . VAL A 1 113 ? 8.413 30.569 11.154 1.00 16.60 ? 112 VAL A CG2 1 +ATOM 1733 H H . VAL A 1 113 ? 8.811 29.318 13.943 1.00 17.21 ? 112 VAL A H 1 +ATOM 1734 H HA . VAL A 1 113 ? 7.177 31.444 13.473 1.00 15.63 ? 112 VAL A HA 1 +ATOM 1735 H HB . VAL A 1 113 ? 7.288 29.056 11.945 1.00 16.31 ? 112 VAL A HB 1 +ATOM 1736 H HG11 . VAL A 1 113 ? 5.879 30.123 10.432 1.00 14.03 ? 112 VAL A HG11 1 +ATOM 1737 H HG12 . VAL A 1 113 ? 5.187 30.015 11.859 1.00 14.03 ? 112 VAL A HG12 1 +ATOM 1738 H HG13 . VAL A 1 113 ? 5.822 31.393 11.386 1.00 14.03 ? 112 VAL A HG13 1 +ATOM 1739 H HG21 . VAL A 1 113 ? 8.331 30.263 10.237 1.00 19.92 ? 112 VAL A HG21 1 +ATOM 1740 H HG22 . VAL A 1 113 ? 8.394 31.538 11.182 1.00 19.92 ? 112 VAL A HG22 1 +ATOM 1741 H HG23 . VAL A 1 113 ? 9.241 30.242 11.540 1.00 19.92 ? 112 VAL A HG23 1 +ATOM 1742 N N . LYS A 1 114 ? 5.318 30.537 14.817 1.00 13.85 ? 113 LYS A N 1 +ATOM 1743 C CA . LYS A 1 114 ? 4.313 29.938 15.705 1.00 14.07 ? 113 LYS A CA 1 +ATOM 1744 C C . LYS A 1 114 ? 3.144 30.865 15.903 1.00 14.06 ? 113 LYS A C 1 +ATOM 1745 O O . LYS A 1 114 ? 3.235 32.054 15.587 1.00 14.87 ? 113 LYS A O 1 +ATOM 1746 C CB . LYS A 1 114 ? 4.932 29.651 17.085 1.00 17.05 ? 113 LYS A CB 1 +ATOM 1747 C CG . LYS A 1 114 ? 5.286 30.903 17.881 1.00 22.26 ? 113 LYS A CG 1 +ATOM 1748 C CD . LYS A 1 114 ? 5.961 30.547 19.205 1.00 27.72 ? 113 LYS A CD 1 +ATOM 1749 H H . LYS A 1 114 ? 5.249 31.389 14.720 1.00 16.62 ? 113 LYS A H 1 +ATOM 1750 H HA . LYS A 1 114 ? 3.992 29.105 15.326 1.00 16.89 ? 113 LYS A HA 1 +ATOM 1751 H HB2 . LYS A 1 114 ? 4.299 29.137 17.610 1.00 20.46 ? 113 LYS A HB2 1 +ATOM 1752 H HB3 . LYS A 1 114 ? 5.747 29.140 16.960 1.00 20.46 ? 113 LYS A HB3 1 +ATOM 1753 H HG2 . LYS A 1 114 ? 5.899 31.449 17.364 1.00 26.71 ? 113 LYS A HG2 1 +ATOM 1754 H HG3 . LYS A 1 114 ? 4.476 31.399 18.076 1.00 26.71 ? 113 LYS A HG3 1 +ATOM 1755 N N . PHE A 1 115 ? 2.055 30.331 16.454 1.00 14.81 ? 114 PHE A N 1 +ATOM 1756 C CA . PHE A 1 115 ? 0.939 31.174 16.850 1.00 14.41 ? 114 PHE A CA 1 +ATOM 1757 C C . PHE A 1 115 ? 1.085 31.746 18.254 1.00 14.34 ? 114 PHE A C 1 +ATOM 1758 O O . PHE A 1 115 ? 1.469 31.035 19.203 1.00 19.86 ? 114 PHE A O 1 +ATOM 1759 C CB . PHE A 1 115 ? -0.346 30.384 16.803 1.00 20.54 ? 114 PHE A CB 1 +ATOM 1760 C CG . PHE A 1 115 ? -1.011 30.407 15.464 1.00 16.46 ? 114 PHE A CG 1 +ATOM 1761 C CD1 . PHE A 1 115 ? -0.804 29.389 14.576 1.00 18.21 ? 114 PHE A CD1 1 +ATOM 1762 C CD2 . PHE A 1 115 ? -1.844 31.461 15.110 1.00 15.80 ? 114 PHE A CD2 1 +ATOM 1763 C CE1 . PHE A 1 115 ? -1.434 29.404 13.330 1.00 15.22 ? 114 PHE A CE1 1 +ATOM 1764 C CE2 . PHE A 1 115 ? -2.471 31.482 13.894 1.00 21.37 ? 114 PHE A CE2 1 +ATOM 1765 C CZ . PHE A 1 115 ? -2.262 30.452 12.998 1.00 16.17 ? 114 PHE A CZ 1 +ATOM 1766 H H . PHE A 1 115 ? 1.941 29.493 16.606 1.00 17.77 ? 114 PHE A H 1 +ATOM 1767 H HA . PHE A 1 115 ? 0.863 31.915 16.228 1.00 17.29 ? 114 PHE A HA 1 +ATOM 1768 H HB2 . PHE A 1 115 ? -0.153 29.459 17.024 1.00 24.64 ? 114 PHE A HB2 1 +ATOM 1769 H HB3 . PHE A 1 115 ? -0.966 30.755 17.450 1.00 24.64 ? 114 PHE A HB3 1 +ATOM 1770 H HD1 . PHE A 1 115 ? -0.248 28.679 14.805 1.00 21.85 ? 114 PHE A HD1 1 +ATOM 1771 H HD2 . PHE A 1 115 ? -1.991 32.153 15.715 1.00 18.96 ? 114 PHE A HD2 1 +ATOM 1772 H HE1 . PHE A 1 115 ? -1.293 28.710 12.726 1.00 18.26 ? 114 PHE A HE1 1 +ATOM 1773 H HE2 . PHE A 1 115 ? -3.027 32.193 13.668 1.00 25.64 ? 114 PHE A HE2 1 +ATOM 1774 H HZ . PHE A 1 115 ? -2.679 30.468 12.167 1.00 19.41 ? 114 PHE A HZ 1 +ATOM 1775 N N . GLU A 1 116 ? 0.745 33.022 18.370 1.00 14.32 ? 115 GLU A N 1 +ATOM 1776 C CA . GLU A 1 116 ? 0.583 33.685 19.653 1.00 16.22 ? 115 GLU A CA 1 +ATOM 1777 C C . GLU A 1 116 ? -0.815 34.307 19.621 1.00 19.82 ? 115 GLU A C 1 +ATOM 1778 O O . GLU A 1 116 ? -1.048 35.344 19.022 1.00 16.65 ? 115 GLU A O 1 +ATOM 1779 C CB . GLU A 1 116 ? 1.738 34.681 19.909 1.00 18.75 ? 115 GLU A CB 1 +ATOM 1780 C CG . GLU A 1 116 ? 3.050 33.920 20.149 1.00 20.60 ? 115 GLU A CG 1 +ATOM 1781 C CD . GLU A 1 116 ? 4.248 34.788 20.496 1.00 31.63 ? 115 GLU A CD 1 +ATOM 1782 O OE1 . GLU A 1 116 ? 4.230 36.002 20.187 1.00 20.20 ? 115 GLU A OE1 1 +ATOM 1783 O OE2 . GLU A 1 116 ? 5.207 34.230 21.103 1.00 32.45 ? 115 GLU A OE2 1 +ATOM 1784 H H . GLU A 1 116 ? 0.599 33.538 17.698 1.00 17.18 ? 115 GLU A H 1 +ATOM 1785 H HA . GLU A 1 116 ? 0.600 33.020 20.359 1.00 19.47 ? 115 GLU A HA 1 +ATOM 1786 H HB2 . GLU A 1 116 ? 1.851 35.253 19.133 1.00 22.50 ? 115 GLU A HB2 1 +ATOM 1787 H HB3 . GLU A 1 116 ? 1.541 35.211 20.697 1.00 22.50 ? 115 GLU A HB3 1 +ATOM 1788 H HG2 . GLU A 1 116 ? 2.916 33.300 20.882 1.00 24.72 ? 115 GLU A HG2 1 +ATOM 1789 H HG3 . GLU A 1 116 ? 3.271 33.427 19.343 1.00 24.72 ? 115 GLU A HG3 1 +ATOM 1790 N N . GLY A 1 117 ? -1.763 33.613 20.241 1.00 19.37 ? 116 GLY A N 1 +ATOM 1791 C CA . GLY A 1 117 ? -3.158 33.973 20.113 1.00 18.29 ? 116 GLY A CA 1 +ATOM 1792 C C . GLY A 1 117 ? -3.587 33.814 18.657 1.00 14.11 ? 116 GLY A C 1 +ATOM 1793 O O . GLY A 1 117 ? -3.340 32.784 18.033 1.00 18.20 ? 116 GLY A O 1 +ATOM 1794 H H . GLY A 1 117 ? -1.619 32.929 20.741 1.00 23.24 ? 116 GLY A H 1 +ATOM 1795 H HA2 . GLY A 1 117 ? -3.704 33.396 20.669 1.00 21.94 ? 116 GLY A HA2 1 +ATOM 1796 H HA3 . GLY A 1 117 ? -3.291 34.895 20.384 1.00 21.94 ? 116 GLY A HA3 1 +ATOM 1797 N N . ASP A 1 118 ? -4.209 34.856 18.119 1.00 17.13 ? 117 ASP A N 1 +ATOM 1798 C CA . ASP A 1 118 ? -4.753 34.792 16.771 1.00 20.52 ? 117 ASP A CA 1 +ATOM 1799 C C . ASP A 1 118 ? -3.673 35.123 15.739 1.00 22.87 ? 117 ASP A C 1 +ATOM 1800 O O . ASP A 1 118 ? -3.937 35.049 14.546 1.00 18.51 ? 117 ASP A O 1 +ATOM 1801 C CB . ASP A 1 118 ? -5.964 35.731 16.613 1.00 24.72 ? 117 ASP A CB 1 +ATOM 1802 C CG . ASP A 1 118 ? -5.599 37.229 16.628 1.00 36.54 ? 117 ASP A CG 1 +ATOM 1803 O OD1 . ASP A 1 118 ? -4.444 37.612 16.924 1.00 33.00 ? 117 ASP A OD1 1 +ATOM 1804 O OD2 . ASP A 1 118 ? -6.502 38.055 16.356 1.00 48.96 ? 117 ASP A OD2 1 +ATOM 1805 H H . ASP A 1 118 ? -4.329 35.610 18.514 1.00 20.56 ? 117 ASP A H 1 +ATOM 1806 H HA . ASP A 1 118 ? -5.057 33.887 16.601 1.00 24.62 ? 117 ASP A HA 1 +ATOM 1807 H HB2 . ASP A 1 118 ? -6.398 35.541 15.766 1.00 29.67 ? 117 ASP A HB2 1 +ATOM 1808 H HB3 . ASP A 1 118 ? -6.582 35.570 17.342 1.00 29.67 ? 117 ASP A HB3 1 +ATOM 1809 N N . THR A 1 119 ? -2.466 35.477 16.191 1.00 12.71 ? 118 THR A N 1 +ATOM 1810 C CA . THR A 1 119 ? -1.415 35.949 15.261 1.00 12.90 ? 118 THR A CA 1 +ATOM 1811 C C . THR A 1 119 ? -0.307 34.929 14.988 1.00 15.35 ? 118 THR A C 1 +ATOM 1812 O O . THR A 1 119 ? 0.269 34.336 15.911 1.00 14.79 ? 118 THR A O 1 +ATOM 1813 C CB . THR A 1 119 ? -0.769 37.220 15.821 1.00 12.92 ? 118 THR A CB 1 +ATOM 1814 O OG1 . THR A 1 119 ? -1.766 38.239 15.965 1.00 22.39 ? 118 THR A OG1 1 +ATOM 1815 C CG2 . THR A 1 119 ? 0.343 37.760 14.910 1.00 14.38 ? 118 THR A CG2 1 +ATOM 1816 H H . THR A 1 119 ? -2.226 35.455 17.017 1.00 15.25 ? 118 THR A H 1 +ATOM 1817 H HA . THR A 1 119 ? -1.827 36.174 14.412 1.00 15.48 ? 118 THR A HA 1 +ATOM 1818 H HB . THR A 1 119 ? -0.382 37.026 16.689 1.00 15.51 ? 118 THR A HB 1 +ATOM 1819 H HG1 . THR A 1 119 ? -2.368 37.980 16.491 1.00 26.87 ? 118 THR A HG1 1 +ATOM 1820 H HG21 . THR A 1 119 ? 0.727 38.562 15.297 1.00 17.25 ? 118 THR A HG21 1 +ATOM 1821 H HG22 . THR A 1 119 ? 1.041 37.094 14.809 1.00 17.25 ? 118 THR A HG22 1 +ATOM 1822 H HG23 . THR A 1 119 ? -0.019 37.973 14.036 1.00 17.25 ? 118 THR A HG23 1 +ATOM 1823 N N . LEU A 1 120 ? 0.011 34.760 13.710 1.00 14.65 ? 119 LEU A N 1 +ATOM 1824 C CA . LEU A 1 120 ? 1.158 33.961 13.287 1.00 11.43 ? 119 LEU A CA 1 +ATOM 1825 C C . LEU A 1 120 ? 2.394 34.852 13.329 1.00 13.68 ? 119 LEU A C 1 +ATOM 1826 O O . LEU A 1 120 ? 2.462 35.874 12.641 1.00 14.73 ? 119 LEU A O 1 +ATOM 1827 C CB . LEU A 1 120 ? 0.889 33.415 11.877 1.00 12.67 ? 119 LEU A CB 1 +ATOM 1828 C CG . LEU A 1 120 ? 1.789 32.331 11.278 1.00 12.37 ? 119 LEU A CG 1 +ATOM 1829 C CD1 . LEU A 1 120 ? 3.107 32.976 10.826 1.00 14.62 ? 119 LEU A CD1 1 +ATOM 1830 C CD2 . LEU A 1 120 ? 2.023 31.196 12.295 1.00 13.83 ? 119 LEU A CD2 1 +ATOM 1831 H H . LEU A 1 120 ? -0.430 35.103 13.056 1.00 17.58 ? 119 LEU A H 1 +ATOM 1832 H HA . LEU A 1 120 ? 1.285 33.216 13.895 1.00 13.71 ? 119 LEU A HA 1 +ATOM 1833 H HB2 . LEU A 1 120 ? -0.011 33.055 11.873 1.00 15.20 ? 119 LEU A HB2 1 +ATOM 1834 H HB3 . LEU A 1 120 ? 0.924 34.167 11.265 1.00 15.20 ? 119 LEU A HB3 1 +ATOM 1835 H HG . LEU A 1 120 ? 1.354 31.953 10.497 1.00 14.85 ? 119 LEU A HG 1 +ATOM 1836 H HD11 . LEU A 1 120 ? 3.679 32.290 10.446 1.00 17.54 ? 119 LEU A HD11 1 +ATOM 1837 H HD12 . LEU A 1 120 ? 2.914 33.654 10.160 1.00 17.54 ? 119 LEU A HD12 1 +ATOM 1838 H HD13 . LEU A 1 120 ? 3.540 33.380 11.594 1.00 17.54 ? 119 LEU A HD13 1 +ATOM 1839 H HD21 . LEU A 1 120 ? 2.594 30.524 11.891 1.00 16.60 ? 119 LEU A HD21 1 +ATOM 1840 H HD22 . LEU A 1 120 ? 2.450 31.564 13.084 1.00 16.60 ? 119 LEU A HD22 1 +ATOM 1841 H HD23 . LEU A 1 120 ? 1.168 30.805 12.533 1.00 16.60 ? 119 LEU A HD23 1 +ATOM 1842 N N A VAL A 1 121 ? 3.385 34.437 14.111 0.25 12.90 ? 120 VAL A N 1 +ATOM 1843 N N B VAL A 1 121 ? 3.363 34.500 14.177 0.75 13.36 ? 120 VAL A N 1 +ATOM 1844 C CA A VAL A 1 121 ? 4.568 35.248 14.363 0.25 12.62 ? 120 VAL A CA 1 +ATOM 1845 C CA B VAL A 1 121 ? 4.581 35.297 14.312 0.75 12.61 ? 120 VAL A CA 1 +ATOM 1846 C C A VAL A 1 121 ? 5.821 34.565 13.819 0.25 13.15 ? 120 VAL A C 1 +ATOM 1847 C C B VAL A 1 121 ? 5.752 34.549 13.697 0.75 12.58 ? 120 VAL A C 1 +ATOM 1848 O O A VAL A 1 121 ? 6.044 33.385 14.074 0.25 16.38 ? 120 VAL A O 1 +ATOM 1849 O O B VAL A 1 121 ? 5.826 33.317 13.746 0.75 12.85 ? 120 VAL A O 1 +ATOM 1850 C CB A VAL A 1 121 ? 4.732 35.485 15.875 0.25 19.41 ? 120 VAL A CB 1 +ATOM 1851 C CB B VAL A 1 121 ? 4.910 35.665 15.791 0.75 13.45 ? 120 VAL A CB 1 +ATOM 1852 C CG1 A VAL A 1 121 ? 5.902 36.394 16.148 0.25 13.96 ? 120 VAL A CG1 1 +ATOM 1853 C CG1 B VAL A 1 121 ? 3.717 36.351 16.440 0.75 19.28 ? 120 VAL A CG1 1 +ATOM 1854 C CG2 A VAL A 1 121 ? 3.445 36.071 16.465 0.25 17.70 ? 120 VAL A CG2 1 +ATOM 1855 C CG2 B VAL A 1 121 ? 5.314 34.427 16.586 0.75 24.61 ? 120 VAL A CG2 1 +ATOM 1856 H H A VAL A 1 121 ? 3.395 33.676 14.513 0.25 15.48 ? 120 VAL A H 1 +ATOM 1857 H H B VAL A 1 121 ? 3.337 33.806 14.684 0.75 16.03 ? 120 VAL A H 1 +ATOM 1858 H HA A VAL A 1 121 ? 4.470 36.108 13.925 0.25 15.15 ? 120 VAL A HA 1 +ATOM 1859 H HA B VAL A 1 121 ? 4.468 36.125 13.819 0.75 15.13 ? 120 VAL A HA 1 +ATOM 1860 H HB A VAL A 1 121 ? 4.903 34.636 16.311 0.25 23.29 ? 120 VAL A HB 1 +ATOM 1861 H HB B VAL A 1 121 ? 5.656 36.285 15.803 0.75 16.14 ? 120 VAL A HB 1 +ATOM 1862 H HG11 A VAL A 1 121 ? 5.981 36.526 17.105 0.25 16.76 ? 120 VAL A HG11 1 +ATOM 1863 H HG11 B VAL A 1 121 ? 3.941 36.572 17.358 0.75 23.14 ? 120 VAL A HG11 1 +ATOM 1864 H HG12 A VAL A 1 121 ? 6.709 35.982 15.802 0.25 16.76 ? 120 VAL A HG12 1 +ATOM 1865 H HG12 B VAL A 1 121 ? 3.511 37.160 15.946 0.75 23.14 ? 120 VAL A HG12 1 +ATOM 1866 H HG13 A VAL A 1 121 ? 5.749 37.245 15.707 0.25 16.76 ? 120 VAL A HG13 1 +ATOM 1867 H HG13 B VAL A 1 121 ? 2.957 35.748 16.421 0.75 23.14 ? 120 VAL A HG13 1 +ATOM 1868 H HG21 A VAL A 1 121 ? 3.571 36.212 17.416 0.25 21.24 ? 120 VAL A HG21 1 +ATOM 1869 H HG21 B VAL A 1 121 ? 5.511 34.688 17.498 0.75 29.53 ? 120 VAL A HG21 1 +ATOM 1870 H HG22 A VAL A 1 121 ? 3.254 36.915 16.027 0.25 21.24 ? 120 VAL A HG22 1 +ATOM 1871 H HG22 B VAL A 1 121 ? 4.580 33.792 16.574 0.75 29.53 ? 120 VAL A HG22 1 +ATOM 1872 H HG23 A VAL A 1 121 ? 2.718 35.448 16.315 0.25 21.24 ? 120 VAL A HG23 1 +ATOM 1873 H HG23 B VAL A 1 121 ? 6.100 34.032 16.177 0.75 29.53 ? 120 VAL A HG23 1 +ATOM 1874 N N . ASN A 1 122 ? 6.623 35.311 13.063 1.00 13.56 ? 121 ASN A N 1 +ATOM 1875 C CA . ASN A 1 122 ? 7.866 34.811 12.493 1.00 12.77 ? 121 ASN A CA 1 +ATOM 1876 C C . ASN A 1 122 ? 8.984 35.699 13.047 1.00 15.74 ? 121 ASN A C 1 +ATOM 1877 O O . ASN A 1 122 ? 9.119 36.849 12.646 1.00 17.95 ? 121 ASN A O 1 +ATOM 1878 C CB . ASN A 1 122 ? 7.836 34.914 10.962 1.00 12.22 ? 121 ASN A CB 1 +ATOM 1879 C CG . ASN A 1 122 ? 9.106 34.382 10.316 1.00 13.48 ? 121 ASN A CG 1 +ATOM 1880 O OD1 . ASN A 1 122 ? 9.896 33.684 10.958 1.00 13.00 ? 121 ASN A OD1 1 +ATOM 1881 N ND2 . ASN A 1 122 ? 9.326 34.734 9.045 1.00 14.37 ? 121 ASN A ND2 1 +ATOM 1882 H H A ASN A 1 122 ? 6.461 36.132 12.863 0.25 16.28 ? 121 ASN A H 1 +ATOM 1883 H H B ASN A 1 122 ? 6.513 36.156 12.945 0.75 16.28 ? 121 ASN A H 1 +ATOM 1884 H HA . ASN A 1 122 ? 8.018 33.890 12.757 1.00 15.33 ? 121 ASN A HA 1 +ATOM 1885 H HB2 . ASN A 1 122 ? 7.088 34.397 10.624 1.00 14.66 ? 121 ASN A HB2 1 +ATOM 1886 H HB3 . ASN A 1 122 ? 7.738 35.845 10.709 1.00 14.66 ? 121 ASN A HB3 1 +ATOM 1887 H HD21 . ASN A 1 122 ? 8.762 35.238 8.635 1.00 17.24 ? 121 ASN A HD21 1 +ATOM 1888 H HD22 . ASN A 1 122 ? 10.031 34.457 8.638 1.00 17.24 ? 121 ASN A HD22 1 +ATOM 1889 N N A ARG A 1 123 ? 9.765 35.165 13.978 0.60 16.06 ? 122 ARG A N 1 +ATOM 1890 N N B ARG A 1 123 ? 9.780 35.158 13.968 0.40 15.86 ? 122 ARG A N 1 +ATOM 1891 C CA A ARG A 1 123 ? 10.895 35.901 14.539 0.60 15.41 ? 122 ARG A CA 1 +ATOM 1892 C CA B ARG A 1 123 ? 10.892 35.903 14.571 0.40 15.63 ? 122 ARG A CA 1 +ATOM 1893 C C A ARG A 1 123 ? 12.191 35.278 14.077 0.60 15.79 ? 122 ARG A C 1 +ATOM 1894 C C B ARG A 1 123 ? 12.242 35.295 14.191 0.40 16.06 ? 122 ARG A C 1 +ATOM 1895 O O A ARG A 1 123 ? 12.375 34.063 14.185 0.60 15.48 ? 122 ARG A O 1 +ATOM 1896 O O B ARG A 1 123 ? 12.514 34.124 14.479 0.40 15.57 ? 122 ARG A O 1 +ATOM 1897 C CB A ARG A 1 123 ? 10.835 35.912 16.059 0.60 15.58 ? 122 ARG A CB 1 +ATOM 1898 C CB B ARG A 1 123 ? 10.752 35.956 16.092 0.40 16.15 ? 122 ARG A CB 1 +ATOM 1899 C CG A ARG A 1 123 ? 9.728 36.784 16.617 0.60 20.22 ? 122 ARG A CG 1 +ATOM 1900 C CG B ARG A 1 123 ? 9.431 36.546 16.590 0.40 15.28 ? 122 ARG A CG 1 +ATOM 1901 C CD A ARG A 1 123 ? 9.795 36.846 18.148 0.60 25.22 ? 122 ARG A CD 1 +ATOM 1902 C CD B ARG A 1 123 ? 9.659 37.514 17.771 0.40 22.43 ? 122 ARG A CD 1 +ATOM 1903 N NE A ARG A 1 123 ? 9.320 35.605 18.751 0.60 22.59 ? 122 ARG A NE 1 +ATOM 1904 N NE B ARG A 1 123 ? 8.440 37.793 18.525 0.40 21.99 ? 122 ARG A NE 1 +ATOM 1905 C CZ A ARG A 1 123 ? 8.114 35.441 19.297 0.60 24.08 ? 122 ARG A CZ 1 +ATOM 1906 C CZ B ARG A 1 123 ? 7.451 38.562 18.089 0.40 18.03 ? 122 ARG A CZ 1 +ATOM 1907 N NH1 A ARG A 1 123 ? 7.238 36.437 19.324 0.60 16.16 ? 122 ARG A NH1 1 +ATOM 1908 N NH1 B ARG A 1 123 ? 7.518 39.119 16.892 0.40 25.88 ? 122 ARG A NH1 1 +ATOM 1909 N NH2 A ARG A 1 123 ? 7.787 34.271 19.825 0.60 30.34 ? 122 ARG A NH2 1 +ATOM 1910 N NH2 B ARG A 1 123 ? 6.386 38.761 18.836 0.40 15.94 ? 122 ARG A NH2 1 +ATOM 1911 H H A ARG A 1 123 ? 9.663 34.376 14.303 0.60 19.27 ? 122 ARG A H 1 +ATOM 1912 H H B ARG A 1 123 ? 9.699 34.355 14.265 0.40 19.03 ? 122 ARG A H 1 +ATOM 1913 H HA A ARG A 1 123 ? 10.869 36.819 14.226 0.60 18.49 ? 122 ARG A HA 1 +ATOM 1914 H HA B ARG A 1 123 ? 10.874 36.814 14.239 0.40 18.76 ? 122 ARG A HA 1 +ATOM 1915 H HB2 A ARG A 1 123 ? 10.687 35.007 16.373 0.60 18.70 ? 122 ARG A HB2 1 +ATOM 1916 H HB2 B ARG A 1 123 ? 10.821 35.054 16.441 0.40 19.38 ? 122 ARG A HB2 1 +ATOM 1917 H HB3 A ARG A 1 123 ? 11.679 36.246 16.403 0.60 18.70 ? 122 ARG A HB3 1 +ATOM 1918 H HB3 B ARG A 1 123 ? 11.470 36.500 16.451 0.40 19.38 ? 122 ARG A HB3 1 +ATOM 1919 H HG2 A ARG A 1 123 ? 9.823 37.685 16.270 0.60 24.26 ? 122 ARG A HG2 1 +ATOM 1920 H HG2 B ARG A 1 123 ? 9.007 37.038 15.870 0.40 18.33 ? 122 ARG A HG2 1 +ATOM 1921 H HG3 A ARG A 1 123 ? 8.868 36.414 16.363 0.60 24.26 ? 122 ARG A HG3 1 +ATOM 1922 H HG3 B ARG A 1 123 ? 8.852 35.828 16.892 0.40 18.33 ? 122 ARG A HG3 1 +ATOM 1923 H HD2 A ARG A 1 123 ? 10.714 36.987 18.424 0.60 30.27 ? 122 ARG A HD2 1 +ATOM 1924 H HD2 B ARG A 1 123 ? 10.305 37.122 18.380 0.40 26.92 ? 122 ARG A HD2 1 +ATOM 1925 H HD3 A ARG A 1 123 ? 9.234 37.572 18.464 0.60 30.27 ? 122 ARG A HD3 1 +ATOM 1926 H HD3 B ARG A 1 123 ? 9.998 38.356 17.428 0.40 26.92 ? 122 ARG A HD3 1 +ATOM 1927 H HE A ARG A 1 123 ? 9.855 34.931 18.754 0.60 27.11 ? 122 ARG A HE 1 +ATOM 1928 H HE B ARG A 1 123 ? 8.358 37.435 19.303 0.40 26.38 ? 122 ARG A HE 1 +ATOM 1929 H HH11 A ARG A 1 123 ? 7.444 37.200 18.986 0.60 19.39 ? 122 ARG A HH11 1 +ATOM 1930 H HH11 B ARG A 1 123 ? 8.211 38.992 16.397 0.40 31.05 ? 122 ARG A HH11 1 +ATOM 1931 H HH12 A ARG A 1 123 ? 6.464 36.319 19.679 0.60 19.39 ? 122 ARG A HH12 1 +ATOM 1932 H HH12 B ARG A 1 123 ? 6.874 39.614 16.611 0.40 31.05 ? 122 ARG A HH12 1 +ATOM 1933 H HH21 A ARG A 1 123 ? 8.349 33.620 19.810 0.60 36.40 ? 122 ARG A HH21 1 +ATOM 1934 H HH21 B ARG A 1 123 ? 6.333 38.400 19.614 0.40 19.13 ? 122 ARG A HH21 1 +ATOM 1935 H HH22 A ARG A 1 123 ? 7.009 34.160 20.176 0.60 36.40 ? 122 ARG A HH22 1 +ATOM 1936 H HH22 B ARG A 1 123 ? 5.745 39.257 18.547 0.40 19.13 ? 122 ARG A HH22 1 +ATOM 1937 N N . ILE A 1 124 ? 13.096 36.120 13.586 1.00 16.59 ? 123 ILE A N 1 +ATOM 1938 C CA . ILE A 1 124 ? 14.281 35.656 12.885 1.00 15.70 ? 123 ILE A CA 1 +ATOM 1939 C C . ILE A 1 124 ? 15.585 36.342 13.314 1.00 16.54 ? 123 ILE A C 1 +ATOM 1940 O O . ILE A 1 124 ? 15.600 37.531 13.593 1.00 17.07 ? 123 ILE A O 1 +ATOM 1941 C CB . ILE A 1 124 ? 14.156 35.991 11.370 1.00 16.33 ? 123 ILE A CB 1 +ATOM 1942 C CG1 . ILE A 1 124 ? 12.799 35.585 10.788 1.00 18.76 ? 123 ILE A CG1 1 +ATOM 1943 C CG2 . ILE A 1 124 ? 15.228 35.325 10.608 1.00 15.48 ? 123 ILE A CG2 1 +ATOM 1944 C CD1 . ILE A 1 124 ? 12.267 36.598 9.896 1.00 14.33 ? 123 ILE A CD1 1 +ATOM 1945 H H A ILE A 1 124 ? 13.042 36.976 13.648 0.60 19.91 ? 123 ILE A H 1 +ATOM 1946 H H B ILE A 1 124 ? 13.003 36.975 13.570 0.40 19.91 ? 123 ILE A H 1 +ATOM 1947 H HA . ILE A 1 124 ? 14.377 34.696 12.991 1.00 18.83 ? 123 ILE A HA 1 +ATOM 1948 H HB . ILE A 1 124 ? 14.258 36.949 11.262 1.00 19.59 ? 123 ILE A HB 1 +ATOM 1949 H HG12 . ILE A 1 124 ? 12.901 34.762 10.285 1.00 22.51 ? 123 ILE A HG12 1 +ATOM 1950 H HG13 . ILE A 1 124 ? 12.167 35.458 11.513 1.00 22.51 ? 123 ILE A HG13 1 +ATOM 1951 H HG21 . ILE A 1 124 ? 15.131 35.547 9.668 1.00 18.58 ? 123 ILE A HG21 1 +ATOM 1952 H HG22 . ILE A 1 124 ? 16.087 35.635 10.935 1.00 18.58 ? 123 ILE A HG22 1 +ATOM 1953 H HG23 . ILE A 1 124 ? 15.153 34.366 10.731 1.00 18.58 ? 123 ILE A HG23 1 +ATOM 1954 H HD11 . ILE A 1 124 ? 11.410 36.298 9.554 1.00 17.20 ? 123 ILE A HD11 1 +ATOM 1955 H HD12 . ILE A 1 124 ? 12.155 37.426 10.389 1.00 17.20 ? 123 ILE A HD12 1 +ATOM 1956 H HD13 . ILE A 1 124 ? 12.888 36.730 9.163 1.00 17.20 ? 123 ILE A HD13 1 +ATOM 1957 N N A GLU A 1 125 ? 16.659 35.559 13.388 0.46 17.15 ? 124 GLU A N 1 +ATOM 1958 N N B GLU A 1 125 ? 16.671 35.574 13.341 0.54 17.14 ? 124 GLU A N 1 +ATOM 1959 C CA A GLU A 1 125 ? 18.022 36.067 13.474 0.46 17.97 ? 124 GLU A CA 1 +ATOM 1960 C CA B GLU A 1 125 ? 18.022 36.102 13.478 0.54 17.97 ? 124 GLU A CA 1 +ATOM 1961 C C A GLU A 1 125 ? 18.724 35.746 12.155 0.46 19.33 ? 124 GLU A C 1 +ATOM 1962 C C B GLU A 1 125 ? 18.852 35.715 12.250 0.54 19.76 ? 124 GLU A C 1 +ATOM 1963 O O A GLU A 1 125 ? 18.578 34.647 11.633 0.46 19.29 ? 124 GLU A O 1 +ATOM 1964 O O B GLU A 1 125 ? 18.926 34.543 11.888 0.54 18.09 ? 124 GLU A O 1 +ATOM 1965 C CB A GLU A 1 125 ? 18.767 35.423 14.658 0.46 18.88 ? 124 GLU A CB 1 +ATOM 1966 C CB B GLU A 1 125 ? 18.666 35.582 14.768 0.54 18.86 ? 124 GLU A CB 1 +ATOM 1967 C CG A GLU A 1 125 ? 20.283 35.510 14.574 0.46 20.82 ? 124 GLU A CG 1 +ATOM 1968 C CG B GLU A 1 125 ? 17.855 35.958 16.011 0.54 23.91 ? 124 GLU A CG 1 +ATOM 1969 C CD A GLU A 1 125 ? 20.964 35.686 15.937 0.46 26.52 ? 124 GLU A CD 1 +ATOM 1970 C CD B GLU A 1 125 ? 18.458 35.443 17.307 0.54 31.52 ? 124 GLU A CD 1 +ATOM 1971 O OE1 A GLU A 1 125 ? 20.778 34.830 16.835 0.46 21.51 ? 124 GLU A OE1 1 +ATOM 1972 O OE1 B GLU A 1 125 ? 18.940 34.283 17.306 0.54 28.93 ? 124 GLU A OE1 1 +ATOM 1973 O OE2 A GLU A 1 125 ? 21.703 36.685 16.101 0.46 28.48 ? 124 GLU A OE2 1 +ATOM 1974 O OE2 B GLU A 1 125 ? 18.449 36.206 18.315 0.54 25.93 ? 124 GLU A OE2 1 +ATOM 1975 H H A GLU A 1 125 ? 16.618 34.700 13.388 0.46 20.59 ? 124 GLU A H 1 +ATOM 1976 H H B GLU A 1 125 ? 16.647 34.716 13.281 0.54 20.57 ? 124 GLU A H 1 +ATOM 1977 H HA A GLU A 1 125 ? 18.009 37.029 13.597 0.46 21.56 ? 124 GLU A HA 1 +ATOM 1978 H HA B GLU A 1 125 ? 17.984 37.070 13.526 0.54 21.56 ? 124 GLU A HA 1 +ATOM 1979 H HB2 A GLU A 1 125 ? 18.492 35.867 15.475 0.46 22.66 ? 124 GLU A HB2 1 +ATOM 1980 H HB2 B GLU A 1 125 ? 18.724 34.615 14.727 0.54 22.63 ? 124 GLU A HB2 1 +ATOM 1981 H HB3 A GLU A 1 125 ? 18.529 34.484 14.700 0.46 22.66 ? 124 GLU A HB3 1 +ATOM 1982 H HB3 B GLU A 1 125 ? 19.553 35.966 14.858 0.54 22.63 ? 124 GLU A HB3 1 +ATOM 1983 H HG2 A GLU A 1 125 ? 20.622 34.694 14.176 0.46 24.98 ? 124 GLU A HG2 1 +ATOM 1984 H HG2 B GLU A 1 125 ? 17.803 36.925 16.071 0.54 28.70 ? 124 GLU A HG2 1 +ATOM 1985 H HG3 A GLU A 1 125 ? 20.523 36.271 14.022 0.46 24.98 ? 124 GLU A HG3 1 +ATOM 1986 H HG3 B GLU A 1 125 ? 16.964 35.585 15.929 0.54 28.70 ? 124 GLU A HG3 1 +ATOM 1987 N N . LEU A 1 126 ? 19.469 36.714 11.623 1.00 18.28 ? 125 LEU A N 1 +ATOM 1988 C CA . LEU A 1 126 ? 20.265 36.517 10.414 1.00 18.50 ? 125 LEU A CA 1 +ATOM 1989 C C . LEU A 1 126 ? 21.690 37.024 10.565 1.00 19.50 ? 125 LEU A C 1 +ATOM 1990 O O . LEU A 1 126 ? 21.946 38.120 11.106 1.00 20.91 ? 125 LEU A O 1 +ATOM 1991 C CB . LEU A 1 126 ? 19.569 37.205 9.243 1.00 19.19 ? 125 LEU A CB 1 +ATOM 1992 C CG . LEU A 1 126 ? 20.262 37.187 7.880 1.00 18.02 ? 125 LEU A CG 1 +ATOM 1993 C CD1 . LEU A 1 126 ? 19.214 37.377 6.792 1.00 17.19 ? 125 LEU A CD1 1 +ATOM 1994 C CD2 . LEU A 1 126 ? 21.374 38.257 7.759 1.00 18.78 ? 125 LEU A CD2 1 +ATOM 1995 H H A LEU A 1 126 ? 19.530 37.506 11.951 0.46 21.93 ? 125 LEU A H 1 +ATOM 1996 H H B LEU A 1 126 ? 19.441 37.532 11.886 0.54 21.93 ? 125 LEU A H 1 +ATOM 1997 H HA . LEU A 1 126 ? 20.307 35.568 10.218 1.00 22.20 ? 125 LEU A HA 1 +ATOM 1998 H HB2 . LEU A 1 126 ? 18.702 36.786 9.124 1.00 23.03 ? 125 LEU A HB2 1 +ATOM 1999 H HB3 . LEU A 1 126 ? 19.439 38.137 9.481 1.00 23.03 ? 125 LEU A HB3 1 +ATOM 2000 H HG . LEU A 1 126 ? 20.672 36.318 7.749 1.00 21.63 ? 125 LEU A HG 1 +ATOM 2001 H HD11 . LEU A 1 126 ? 19.653 37.365 5.927 1.00 20.62 ? 125 LEU A HD11 1 +ATOM 2002 H HD12 . LEU A 1 126 ? 18.569 36.654 6.846 1.00 20.62 ? 125 LEU A HD12 1 +ATOM 2003 H HD13 . LEU A 1 126 ? 18.770 38.228 6.927 1.00 20.62 ? 125 LEU A HD13 1 +ATOM 2004 H HD21 . LEU A 1 126 ? 21.775 38.197 6.878 1.00 22.54 ? 125 LEU A HD21 1 +ATOM 2005 H HD22 . LEU A 1 126 ? 20.982 39.135 7.885 1.00 22.54 ? 125 LEU A HD22 1 +ATOM 2006 H HD23 . LEU A 1 126 ? 22.045 38.093 8.440 1.00 22.54 ? 125 LEU A HD23 1 +ATOM 2007 N N . LYS A 1 127 ? 22.622 36.200 10.100 1.00 20.33 ? 126 LYS A N 1 +ATOM 2008 C CA . LYS A 1 127 ? 24.027 36.541 10.104 1.00 21.48 ? 126 LYS A CA 1 +ATOM 2009 C C . LYS A 1 127 ? 24.577 36.320 8.707 1.00 22.94 ? 126 LYS A C 1 +ATOM 2010 O O . LYS A 1 127 ? 24.516 35.188 8.183 1.00 22.51 ? 126 LYS A O 1 +ATOM 2011 C CB . LYS A 1 127 ? 24.801 35.649 11.050 1.00 23.54 ? 126 LYS A CB 1 +ATOM 2012 C CG . LYS A 1 127 ? 26.295 35.931 10.991 1.00 31.80 ? 126 LYS A CG 1 +ATOM 2013 C CD . LYS A 1 127 ? 26.845 36.207 12.348 1.00 40.59 ? 126 LYS A CD 1 +ATOM 2014 C CE . LYS A 1 127 ? 28.339 36.483 12.274 1.00 42.22 ? 126 LYS A CE 1 +ATOM 2015 N NZ . LYS A 1 127 ? 28.958 36.170 13.571 1.00 41.88 ? 126 LYS A NZ 1 +ATOM 2016 H H . LYS A 1 127 ? 22.456 35.423 9.771 1.00 24.40 ? 126 LYS A H 1 +ATOM 2017 H HA . LYS A 1 127 ? 24.152 37.468 10.358 1.00 25.78 ? 126 LYS A HA 1 +ATOM 2018 H HB2 . LYS A 1 127 ? 24.498 35.807 11.958 1.00 28.24 ? 126 LYS A HB2 1 +ATOM 2019 H HB3 . LYS A 1 127 ? 24.657 34.721 10.805 1.00 28.24 ? 126 LYS A HB3 1 +ATOM 2020 H HG2 . LYS A 1 127 ? 26.753 35.157 10.627 1.00 38.16 ? 126 LYS A HG2 1 +ATOM 2021 H HG3 . LYS A 1 127 ? 26.452 36.709 10.433 1.00 38.16 ? 126 LYS A HG3 1 +ATOM 2022 H HD2 . LYS A 1 127 ? 26.407 36.988 12.722 1.00 48.71 ? 126 LYS A HD2 1 +ATOM 2023 H HD3 . LYS A 1 127 ? 26.703 35.435 12.918 1.00 48.71 ? 126 LYS A HD3 1 +ATOM 2024 H HE2 . LYS A 1 127 ? 28.742 35.921 11.594 1.00 50.66 ? 126 LYS A HE2 1 +ATOM 2025 H HE3 . LYS A 1 127 ? 28.490 37.421 12.077 1.00 50.66 ? 126 LYS A HE3 1 +ATOM 2026 H HZ1 . LYS A 1 127 ? 29.833 36.328 13.537 1.00 50.26 ? 126 LYS A HZ1 1 +ATOM 2027 H HZ2 . LYS A 1 127 ? 28.597 36.674 14.210 1.00 50.26 ? 126 LYS A HZ2 1 +ATOM 2028 H HZ3 . LYS A 1 127 ? 28.827 35.313 13.772 1.00 50.26 ? 126 LYS A HZ3 1 +ATOM 2029 N N . GLY A 1 128 ? 25.123 37.393 8.131 1.00 21.67 ? 127 GLY A N 1 +ATOM 2030 C CA . GLY A 1 128 ? 25.738 37.338 6.821 1.00 22.06 ? 127 GLY A CA 1 +ATOM 2031 C C . GLY A 1 128 ? 27.231 37.535 6.945 1.00 23.75 ? 127 GLY A C 1 +ATOM 2032 O O . GLY A 1 128 ? 27.682 38.399 7.710 1.00 23.72 ? 127 GLY A O 1 +ATOM 2033 H H . GLY A 1 128 ? 25.145 38.173 8.491 1.00 26.00 ? 127 GLY A H 1 +ATOM 2034 H HA2 . GLY A 1 128 ? 25.567 36.476 6.410 1.00 26.47 ? 127 GLY A HA2 1 +ATOM 2035 H HA3 . GLY A 1 128 ? 25.374 38.035 6.254 1.00 26.47 ? 127 GLY A HA3 1 +ATOM 2036 N N . ILE A 1 129 ? 27.999 36.746 6.195 1.00 24.50 ? 128 ILE A N 1 +ATOM 2037 C CA . ILE A 1 129 ? 29.466 36.827 6.254 1.00 25.85 ? 128 ILE A CA 1 +ATOM 2038 C C . ILE A 1 129 ? 30.066 36.621 4.872 1.00 31.52 ? 128 ILE A C 1 +ATOM 2039 O O . ILE A 1 129 ? 29.415 36.058 3.965 1.00 28.83 ? 128 ILE A O 1 +ATOM 2040 C CB . ILE A 1 129 ? 30.089 35.764 7.211 1.00 30.30 ? 128 ILE A CB 1 +ATOM 2041 C CG1 . ILE A 1 129 ? 29.925 34.340 6.645 1.00 36.14 ? 128 ILE A CG1 1 +ATOM 2042 C CG2 . ILE A 1 129 ? 29.456 35.850 8.613 1.00 36.84 ? 128 ILE A CG2 1 +ATOM 2043 C CD1 . ILE A 1 129 ? 30.636 33.266 7.450 1.00 39.30 ? 128 ILE A CD1 1 +ATOM 2044 H H . ILE A 1 129 ? 27.701 36.156 5.645 1.00 29.40 ? 128 ILE A H 1 +ATOM 2045 H HA . ILE A 1 129 ? 29.724 37.707 6.569 1.00 31.02 ? 128 ILE A HA 1 +ATOM 2046 H HB . ILE A 1 129 ? 31.037 35.950 7.294 1.00 36.37 ? 128 ILE A HB 1 +ATOM 2047 H HG12 . ILE A 1 129 ? 28.980 34.119 6.628 1.00 43.36 ? 128 ILE A HG12 1 +ATOM 2048 H HG13 . ILE A 1 129 ? 30.283 34.320 5.744 1.00 43.36 ? 128 ILE A HG13 1 +ATOM 2049 H HG21 . ILE A 1 129 ? 29.863 35.179 9.184 1.00 44.21 ? 128 ILE A HG21 1 +ATOM 2050 H HG22 . ILE A 1 129 ? 29.615 36.735 8.977 1.00 44.21 ? 128 ILE A HG22 1 +ATOM 2051 H HG23 . ILE A 1 129 ? 28.503 35.688 8.540 1.00 44.21 ? 128 ILE A HG23 1 +ATOM 2052 H HD11 . ILE A 1 129 ? 30.483 32.405 7.030 1.00 47.16 ? 128 ILE A HD11 1 +ATOM 2053 H HD12 . ILE A 1 129 ? 31.585 33.462 7.468 1.00 47.16 ? 128 ILE A HD12 1 +ATOM 2054 H HD13 . ILE A 1 129 ? 30.281 33.261 8.353 1.00 47.16 ? 128 ILE A HD13 1 +ATOM 2055 N N . ASP A 1 130 ? 31.310 37.087 4.744 1.00 35.42 ? 129 ASP A N 1 +ATOM 2056 C CA . ASP A 1 130 ? 32.134 36.916 3.539 1.00 36.40 ? 129 ASP A CA 1 +ATOM 2057 C C . ASP A 1 130 ? 31.548 37.519 2.265 1.00 36.19 ? 129 ASP A C 1 +ATOM 2058 O O . ASP A 1 130 ? 31.819 37.042 1.165 1.00 36.47 ? 129 ASP A O 1 +ATOM 2059 C CB . ASP A 1 130 ? 32.480 35.438 3.346 1.00 36.24 ? 129 ASP A CB 1 +ATOM 2060 C CG . ASP A 1 130 ? 33.578 34.983 4.283 1.00 37.18 ? 129 ASP A CG 1 +ATOM 2061 O OD1 . ASP A 1 130 ? 34.571 35.714 4.453 1.00 42.95 ? 129 ASP A OD1 1 +ATOM 2062 O OD2 . ASP A 1 130 ? 33.452 33.891 4.859 1.00 37.69 ? 129 ASP A OD2 1 +ATOM 2063 H H . ASP A 1 130 ? 31.715 37.524 5.365 1.00 42.50 ? 129 ASP A H 1 +ATOM 2064 H HA . ASP A 1 130 ? 32.973 37.375 3.695 1.00 43.68 ? 129 ASP A HA 1 +ATOM 2065 H HB2 . ASP A 1 130 ? 31.691 34.901 3.522 1.00 43.49 ? 129 ASP A HB2 1 +ATOM 2066 H HB3 . ASP A 1 130 ? 32.783 35.298 2.435 1.00 43.49 ? 129 ASP A HB3 1 +ATOM 2067 N N . PHE A 1 131 ? 30.806 38.606 2.417 1.00 35.84 ? 130 PHE A N 1 +ATOM 2068 C CA . PHE A 1 131 ? 30.329 39.368 1.281 1.00 35.98 ? 130 PHE A CA 1 +ATOM 2069 C C . PHE A 1 131 ? 31.372 40.338 0.738 1.00 37.78 ? 130 PHE A C 1 +ATOM 2070 O O . PHE A 1 131 ? 32.174 40.912 1.472 1.00 38.75 ? 130 PHE A O 1 +ATOM 2071 C CB . PHE A 1 131 ? 29.048 40.117 1.625 1.00 35.04 ? 130 PHE A CB 1 +ATOM 2072 C CG . PHE A 1 131 ? 27.855 39.218 1.728 1.00 33.29 ? 130 PHE A CG 1 +ATOM 2073 C CD1 . PHE A 1 131 ? 27.108 38.898 0.592 1.00 32.67 ? 130 PHE A CD1 1 +ATOM 2074 C CD2 . PHE A 1 131 ? 27.497 38.662 2.941 1.00 32.32 ? 130 PHE A CD2 1 +ATOM 2075 C CE1 . PHE A 1 131 ? 26.013 38.060 0.673 1.00 31.09 ? 130 PHE A CE1 1 +ATOM 2076 C CE2 . PHE A 1 131 ? 26.403 37.825 3.034 1.00 30.78 ? 130 PHE A CE2 1 +ATOM 2077 C CZ . PHE A 1 131 ? 25.664 37.512 1.890 1.00 30.14 ? 130 PHE A CZ 1 +ATOM 2078 H H . PHE A 1 131 ? 30.564 38.925 3.178 1.00 43.00 ? 130 PHE A H 1 +ATOM 2079 H HA . PHE A 1 131 ? 30.116 38.746 0.567 1.00 43.17 ? 130 PHE A HA 1 +ATOM 2080 H HB2 . PHE A 1 131 ? 29.163 40.561 2.480 1.00 42.05 ? 130 PHE A HB2 1 +ATOM 2081 H HB3 . PHE A 1 131 ? 28.870 40.772 0.932 1.00 42.05 ? 130 PHE A HB3 1 +ATOM 2082 H HD1 . PHE A 1 131 ? 27.346 39.262 -0.230 1.00 39.20 ? 130 PHE A HD1 1 +ATOM 2083 H HD2 . PHE A 1 131 ? 27.989 38.864 3.704 1.00 38.78 ? 130 PHE A HD2 1 +ATOM 2084 H HE1 . PHE A 1 131 ? 25.521 37.857 -0.090 1.00 37.31 ? 130 PHE A HE1 1 +ATOM 2085 H HE2 . PHE A 1 131 ? 26.166 37.457 3.855 1.00 36.94 ? 130 PHE A HE2 1 +ATOM 2086 H HZ . PHE A 1 131 ? 24.925 36.951 1.952 1.00 36.17 ? 130 PHE A HZ 1 +ATOM 2087 N N . LYS A 1 132 ? 31.330 40.515 -0.571 1.00 38.25 ? 131 LYS A N 1 +ATOM 2088 C CA . LYS A 1 132 ? 32.244 41.405 -1.255 1.00 39.97 ? 131 LYS A CA 1 +ATOM 2089 C C . LYS A 1 132 ? 31.687 42.820 -1.204 1.00 40.26 ? 131 LYS A C 1 +ATOM 2090 O O . LYS A 1 132 ? 30.502 43.042 -1.467 1.00 39.25 ? 131 LYS A O 1 +ATOM 2091 C CB . LYS A 1 132 ? 32.459 40.918 -2.697 1.00 40.39 ? 131 LYS A CB 1 +ATOM 2092 C CG . LYS A 1 132 ? 32.831 39.437 -2.739 1.00 39.91 ? 131 LYS A CG 1 +ATOM 2093 C CD . LYS A 1 132 ? 33.330 38.960 -4.087 1.00 40.67 ? 131 LYS A CD 1 +ATOM 2094 C CE . LYS A 1 132 ? 33.635 37.468 -4.031 1.00 40.12 ? 131 LYS A CE 1 +ATOM 2095 H H . LYS A 1 132 ? 30.770 40.124 -1.094 1.00 45.90 ? 131 LYS A H 1 +ATOM 2096 H HA . LYS A 1 132 ? 33.101 41.397 -0.800 1.00 47.97 ? 131 LYS A HA 1 +ATOM 2097 H HB2 . LYS A 1 132 ? 31.639 41.040 -3.201 1.00 48.47 ? 131 LYS A HB2 1 +ATOM 2098 H HB3 . LYS A 1 132 ? 33.180 41.424 -3.102 1.00 48.47 ? 131 LYS A HB3 1 +ATOM 2099 H HG2 . LYS A 1 132 ? 33.534 39.274 -2.090 1.00 47.90 ? 131 LYS A HG2 1 +ATOM 2100 H HG3 . LYS A 1 132 ? 32.048 38.912 -2.511 1.00 47.90 ? 131 LYS A HG3 1 +ATOM 2101 H HD2 . LYS A 1 132 ? 32.646 39.110 -4.759 1.00 48.80 ? 131 LYS A HD2 1 +ATOM 2102 H HD3 . LYS A 1 132 ? 34.144 39.433 -4.319 1.00 48.80 ? 131 LYS A HD3 1 +ATOM 2103 N N . GLU A 1 133 ? 32.553 43.765 -0.843 1.00 41.80 ? 132 GLU A N 1 +ATOM 2104 C CA . GLU A 1 133 ? 32.162 45.156 -0.636 1.00 43.35 ? 132 GLU A CA 1 +ATOM 2105 C C . GLU A 1 133 ? 31.607 45.771 -1.924 1.00 43.47 ? 132 GLU A C 1 +ATOM 2106 O O . GLU A 1 133 ? 30.773 46.679 -1.888 1.00 49.16 ? 132 GLU A O 1 +ATOM 2107 C CB . GLU A 1 133 ? 33.367 45.965 -0.129 1.00 43.90 ? 132 GLU A CB 1 +ATOM 2108 H H . GLU A 1 133 ? 33.390 43.621 -0.709 1.00 50.16 ? 132 GLU A H 1 +ATOM 2109 H HA . GLU A 1 133 ? 31.467 45.193 0.040 1.00 52.03 ? 132 GLU A HA 1 +ATOM 2110 N N . ASP A 1 134 ? 32.081 45.267 -3.056 1.00 45.27 ? 133 ASP A N 1 +ATOM 2111 C CA . ASP A 1 134 ? 31.644 45.738 -4.364 1.00 50.48 ? 133 ASP A CA 1 +ATOM 2112 C C . ASP A 1 134 ? 30.706 44.730 -5.038 1.00 47.59 ? 133 ASP A C 1 +ATOM 2113 O O . ASP A 1 134 ? 30.357 44.876 -6.210 1.00 51.91 ? 133 ASP A O 1 +ATOM 2114 C CB . ASP A 1 134 ? 32.868 45.999 -5.254 1.00 56.21 ? 133 ASP A CB 1 +ATOM 2115 C CG . ASP A 1 134 ? 33.766 44.765 -5.408 1.00 60.34 ? 133 ASP A CG 1 +ATOM 2116 O OD1 . ASP A 1 134 ? 34.055 44.091 -4.394 1.00 61.41 ? 133 ASP A OD1 1 +ATOM 2117 O OD2 . ASP A 1 134 ? 34.181 44.465 -6.549 1.00 70.01 ? 133 ASP A OD2 1 +ATOM 2118 H H . ASP A 1 134 ? 32.668 44.639 -3.093 1.00 54.33 ? 133 ASP A H 1 +ATOM 2119 H HA . ASP A 1 134 ? 31.164 46.574 -4.258 1.00 60.58 ? 133 ASP A HA 1 +ATOM 2120 H HB2 . ASP A 1 134 ? 32.566 46.261 -6.138 1.00 67.45 ? 133 ASP A HB2 1 +ATOM 2121 H HB3 . ASP A 1 134 ? 33.399 46.709 -4.861 1.00 67.45 ? 133 ASP A HB3 1 +ATOM 2122 N N . GLY A 1 135 ? 30.297 43.701 -4.302 1.00 40.44 ? 134 GLY A N 1 +ATOM 2123 C CA . GLY A 1 135 ? 29.426 42.678 -4.858 1.00 39.06 ? 134 GLY A CA 1 +ATOM 2124 C C . GLY A 1 135 ? 28.023 43.198 -5.133 1.00 38.04 ? 134 GLY A C 1 +ATOM 2125 O O . GLY A 1 135 ? 27.727 44.361 -4.876 1.00 38.41 ? 134 GLY A O 1 +ATOM 2126 H H . GLY A 1 135 ? 30.510 43.575 -3.479 1.00 48.53 ? 134 GLY A H 1 +ATOM 2127 H HA2 . GLY A 1 135 ? 29.801 42.352 -5.691 1.00 46.87 ? 134 GLY A HA2 1 +ATOM 2128 H HA3 . GLY A 1 135 ? 29.363 41.935 -4.238 1.00 46.87 ? 134 GLY A HA3 1 +ATOM 2129 N N . ASN A 1 136 ? 27.152 42.341 -5.660 1.00 36.78 ? 135 ASN A N 1 +ATOM 2130 C CA . ASN A 1 136 ? 25.799 42.757 -5.960 1.00 35.78 ? 135 ASN A CA 1 +ATOM 2131 C C . ASN A 1 136 ? 24.954 43.000 -4.699 1.00 34.66 ? 135 ASN A C 1 +ATOM 2132 O O . ASN A 1 136 ? 23.941 43.684 -4.770 1.00 34.14 ? 135 ASN A O 1 +ATOM 2133 C CB . ASN A 1 136 ? 25.109 41.711 -6.829 1.00 34.72 ? 135 ASN A CB 1 +ATOM 2134 C CG . ASN A 1 136 ? 25.691 41.641 -8.239 1.00 35.79 ? 135 ASN A CG 1 +ATOM 2135 O OD1 . ASN A 1 136 ? 26.253 42.614 -8.746 1.00 37.19 ? 135 ASN A OD1 1 +ATOM 2136 N ND2 . ASN A 1 136 ? 25.540 40.489 -8.879 1.00 35.16 ? 135 ASN A ND2 1 +ATOM 2137 H H . ASN A 1 136 ? 27.325 41.521 -5.851 1.00 44.13 ? 135 ASN A H 1 +ATOM 2138 H HA . ASN A 1 136 ? 25.831 43.587 -6.461 1.00 42.93 ? 135 ASN A HA 1 +ATOM 2139 H HB2 . ASN A 1 136 ? 25.212 40.839 -6.418 1.00 41.66 ? 135 ASN A HB2 1 +ATOM 2140 H HB3 . ASN A 1 136 ? 24.167 41.934 -6.904 1.00 41.66 ? 135 ASN A HB3 1 +ATOM 2141 H HD21 . ASN A 1 136 ? 25.133 39.834 -8.497 1.00 42.19 ? 135 ASN A HD21 1 +ATOM 2142 H HD22 . ASN A 1 136 ? 25.850 40.396 -9.676 1.00 42.19 ? 135 ASN A HD22 1 +ATOM 2143 N N . ILE A 1 137 ? 25.355 42.438 -3.559 1.00 34.32 ? 136 ILE A N 1 +ATOM 2144 C CA . ILE A 1 137 ? 24.559 42.601 -2.331 1.00 33.28 ? 136 ILE A CA 1 +ATOM 2145 C C . ILE A 1 137 ? 24.970 43.891 -1.621 1.00 34.31 ? 136 ILE A C 1 +ATOM 2146 O O . ILE A 1 137 ? 24.206 44.844 -1.590 1.00 34.20 ? 136 ILE A O 1 +ATOM 2147 C CB . ILE A 1 137 ? 24.653 41.384 -1.390 1.00 32.32 ? 136 ILE A CB 1 +ATOM 2148 C CG1 . ILE A 1 137 ? 23.895 40.177 -1.965 1.00 31.01 ? 136 ILE A CG1 1 +ATOM 2149 C CG2 . ILE A 1 137 ? 23.979 41.683 -0.040 1.00 31.51 ? 136 ILE A CG2 1 +ATOM 2150 C CD1 . ILE A 1 137 ? 24.512 39.553 -3.197 1.00 31.59 ? 136 ILE A CD1 1 +ATOM 2151 H H . ILE A 1 137 ? 26.069 41.967 -3.466 1.00 41.19 ? 136 ILE A H 1 +ATOM 2152 H HA . ILE A 1 137 ? 23.627 42.695 -2.584 1.00 39.93 ? 136 ILE A HA 1 +ATOM 2153 H HB . ILE A 1 137 ? 25.584 41.150 -1.247 1.00 38.79 ? 136 ILE A HB 1 +ATOM 2154 H HG12 . ILE A 1 137 ? 23.847 39.490 -1.283 1.00 37.21 ? 136 ILE A HG12 1 +ATOM 2155 H HG13 . ILE A 1 137 ? 22.998 40.462 -2.201 1.00 37.21 ? 136 ILE A HG13 1 +ATOM 2156 H HG21 . ILE A 1 137 ? 24.054 40.901 0.530 1.00 37.81 ? 136 ILE A HG21 1 +ATOM 2157 H HG22 . ILE A 1 137 ? 24.424 42.439 0.374 1.00 37.81 ? 136 ILE A HG22 1 +ATOM 2158 H HG23 . ILE A 1 137 ? 23.045 41.892 -0.194 1.00 37.81 ? 136 ILE A HG23 1 +ATOM 2159 H HD11 . ILE A 1 137 ? 23.963 38.805 -3.480 1.00 37.91 ? 136 ILE A HD11 1 +ATOM 2160 H HD12 . ILE A 1 137 ? 24.554 40.219 -3.901 1.00 37.91 ? 136 ILE A HD12 1 +ATOM 2161 H HD13 . ILE A 1 137 ? 25.406 39.244 -2.979 1.00 37.91 ? 136 ILE A HD13 1 +ATOM 2162 N N . LEU A 1 138 ? 26.188 43.942 -1.096 1.00 40.34 ? 137 LEU A N 1 +ATOM 2163 C CA . LEU A 1 138 ? 26.645 45.146 -0.385 1.00 41.29 ? 137 LEU A CA 1 +ATOM 2164 C C . LEU A 1 138 ? 26.717 46.343 -1.330 1.00 38.62 ? 137 LEU A C 1 +ATOM 2165 O O . LEU A 1 138 ? 26.571 47.482 -0.893 1.00 38.11 ? 137 LEU A O 1 +ATOM 2166 C CB . LEU A 1 138 ? 27.998 44.919 0.306 1.00 39.07 ? 137 LEU A CB 1 +ATOM 2167 C CG . LEU A 1 138 ? 28.030 43.936 1.490 1.00 36.46 ? 137 LEU A CG 1 +ATOM 2168 C CD1 . LEU A 1 138 ? 29.452 43.843 2.061 1.00 44.77 ? 137 LEU A CD1 1 +ATOM 2169 C CD2 . LEU A 1 138 ? 27.020 44.313 2.588 1.00 36.41 ? 137 LEU A CD2 1 +ATOM 2170 H H . LEU A 1 138 ? 26.767 43.307 -1.134 1.00 48.41 ? 137 LEU A H 1 +ATOM 2171 H HA . LEU A 1 138 ? 25.997 45.358 0.306 1.00 49.55 ? 137 LEU A HA 1 +ATOM 2172 H HB2 . LEU A 1 138 ? 28.622 44.585 -0.358 1.00 46.89 ? 137 LEU A HB2 1 +ATOM 2173 H HB3 . LEU A 1 138 ? 28.314 45.774 0.637 1.00 46.89 ? 137 LEU A HB3 1 +ATOM 2174 H HG . LEU A 1 138 ? 27.789 43.054 1.164 1.00 43.76 ? 137 LEU A HG 1 +ATOM 2175 H HD11 . LEU A 1 138 ? 29.454 43.221 2.805 1.00 53.72 ? 137 LEU A HD11 1 +ATOM 2176 H HD12 . LEU A 1 138 ? 30.051 43.530 1.365 1.00 53.72 ? 137 LEU A HD12 1 +ATOM 2177 H HD13 . LEU A 1 138 ? 29.728 44.722 2.364 1.00 53.72 ? 137 LEU A HD13 1 +ATOM 2178 H HD21 . LEU A 1 138 ? 27.079 43.665 3.307 1.00 43.69 ? 137 LEU A HD21 1 +ATOM 2179 H HD22 . LEU A 1 138 ? 27.232 45.199 2.921 1.00 43.69 ? 137 LEU A HD22 1 +ATOM 2180 H HD23 . LEU A 1 138 ? 26.126 44.307 2.210 1.00 43.69 ? 137 LEU A HD23 1 +ATOM 2181 N N . GLY A 1 139 ? 26.909 46.077 -2.625 1.00 37.99 ? 138 GLY A N 1 +ATOM 2182 C CA . GLY A 1 139 ? 26.932 47.126 -3.631 1.00 39.08 ? 138 GLY A CA 1 +ATOM 2183 C C . GLY A 1 139 ? 25.569 47.557 -4.147 1.00 38.20 ? 138 GLY A C 1 +ATOM 2184 O O . GLY A 1 139 ? 25.486 48.436 -5.008 1.00 39.04 ? 138 GLY A O 1 +ATOM 2185 H H . GLY A 1 139 ? 27.029 45.287 -2.943 1.00 45.59 ? 138 GLY A H 1 +ATOM 2186 H HA2 . GLY A 1 139 ? 27.370 47.907 -3.259 1.00 46.89 ? 138 GLY A HA2 1 +ATOM 2187 H HA3 . GLY A 1 139 ? 27.455 46.822 -4.389 1.00 46.89 ? 138 GLY A HA3 1 +ATOM 2188 N N . HIS A 1 140 ? 24.509 46.933 -3.635 1.00 36.55 ? 139 HIS A N 1 +ATOM 2189 C CA . HIS A 1 140 ? 23.127 47.279 -4.001 1.00 35.57 ? 139 HIS A CA 1 +ATOM 2190 C C . HIS A 1 140 ? 22.901 47.342 -5.520 1.00 35.89 ? 139 HIS A C 1 +ATOM 2191 O O . HIS A 1 140 ? 22.472 48.362 -6.057 1.00 36.39 ? 139 HIS A O 1 +ATOM 2192 C CB . HIS A 1 140 ? 22.728 48.610 -3.371 1.00 35.95 ? 139 HIS A CB 1 +ATOM 2193 C CG . HIS A 1 140 ? 22.678 48.578 -1.877 1.00 35.45 ? 139 HIS A CG 1 +ATOM 2194 N ND1 . HIS A 1 140 ? 21.569 48.151 -1.180 1.00 33.92 ? 139 HIS A ND1 1 +ATOM 2195 C CD2 . HIS A 1 140 ? 23.597 48.928 -0.946 1.00 36.31 ? 139 HIS A CD2 1 +ATOM 2196 C CE1 . HIS A 1 140 ? 21.808 48.234 0.119 1.00 33.87 ? 139 HIS A CE1 1 +ATOM 2197 N NE2 . HIS A 1 140 ? 23.031 48.708 0.287 1.00 35.29 ? 139 HIS A NE2 1 +ATOM 2198 H H . HIS A 1 140 ? 24.562 46.293 -3.064 1.00 43.85 ? 139 HIS A H 1 +ATOM 2199 H HA . HIS A 1 140 ? 22.535 46.598 -3.645 1.00 42.68 ? 139 HIS A HA 1 +ATOM 2200 H HB2 . HIS A 1 140 ? 23.374 49.285 -3.632 1.00 43.15 ? 139 HIS A HB2 1 +ATOM 2201 H HB3 . HIS A 1 140 ? 21.847 48.857 -3.693 1.00 43.15 ? 139 HIS A HB3 1 +ATOM 2202 H HD1 . HIS A 1 140 ? 20.837 47.871 -1.533 1.00 40.70 ? 139 HIS A HD1 1 +ATOM 2203 H HD2 . HIS A 1 140 ? 24.450 49.258 -1.110 1.00 43.57 ? 139 HIS A HD2 1 +ATOM 2204 H HE1 . HIS A 1 140 ? 21.215 48.004 0.798 1.00 40.64 ? 139 HIS A HE1 1 +ATOM 2205 H HE2 . HIS A 1 140 ? 23.413 48.848 1.045 1.00 42.35 ? 139 HIS A HE2 1 +ATOM 2206 N N . LYS A 1 141 ? 23.182 46.239 -6.195 1.00 35.61 ? 140 LYS A N 1 +ATOM 2207 C CA . LYS A 1 141 ? 23.080 46.196 -7.647 1.00 35.99 ? 140 LYS A CA 1 +ATOM 2208 C C . LYS A 1 141 ? 21.891 45.347 -8.093 1.00 34.40 ? 140 LYS A C 1 +ATOM 2209 O O . LYS A 1 141 ? 21.689 45.132 -9.286 1.00 34.49 ? 140 LYS A O 1 +ATOM 2210 C CB . LYS A 1 141 ? 24.384 45.654 -8.223 1.00 37.12 ? 140 LYS A CB 1 +ATOM 2211 C CG . LYS A 1 141 ? 25.626 46.370 -7.687 1.00 38.67 ? 140 LYS A CG 1 +ATOM 2212 C CD . LYS A 1 141 ? 26.911 45.853 -8.340 1.00 39.89 ? 140 LYS A CD 1 +ATOM 2213 C CE . LYS A 1 141 ? 28.162 46.535 -7.761 1.00 41.44 ? 140 LYS A CE 1 +ATOM 2214 N NZ . LYS A 1 141 ? 29.431 46.008 -8.389 1.00 43.28 ? 140 LYS A NZ 1 +ATOM 2215 H H . LYS A 1 141 ? 23.433 45.498 -5.837 1.00 42.73 ? 140 LYS A H 1 +ATOM 2216 H HA . LYS A 1 141 ? 22.951 47.097 -7.984 1.00 43.19 ? 140 LYS A HA 1 +ATOM 2217 H HB2 . LYS A 1 141 ? 24.461 44.714 -7.998 1.00 44.55 ? 140 LYS A HB2 1 +ATOM 2218 H HB3 . LYS A 1 141 ? 24.371 45.763 -9.187 1.00 44.55 ? 140 LYS A HB3 1 +ATOM 2219 H HG2 . LYS A 1 141 ? 25.553 47.319 -7.873 1.00 46.41 ? 140 LYS A HG2 1 +ATOM 2220 H HG3 . LYS A 1 141 ? 25.692 46.220 -6.731 1.00 46.41 ? 140 LYS A HG3 1 +ATOM 2221 H HD2 . LYS A 1 141 ? 26.986 44.899 -8.184 1.00 47.86 ? 140 LYS A HD2 1 +ATOM 2222 H HD3 . LYS A 1 141 ? 26.880 46.035 -9.292 1.00 47.86 ? 140 LYS A HD3 1 +ATOM 2223 H HE2 . LYS A 1 141 ? 28.114 47.489 -7.931 1.00 49.72 ? 140 LYS A HE2 1 +ATOM 2224 H HE3 . LYS A 1 141 ? 28.205 46.367 -6.806 1.00 49.72 ? 140 LYS A HE3 1 +ATOM 2225 H HZ1 . LYS A 1 141 ? 29.502 45.133 -8.243 1.00 51.93 ? 140 LYS A HZ1 1 +ATOM 2226 H HZ2 . LYS A 1 141 ? 29.419 46.154 -9.267 1.00 51.93 ? 140 LYS A HZ2 1 +ATOM 2227 H HZ3 . LYS A 1 141 ? 30.138 46.418 -8.037 1.00 51.93 ? 140 LYS A HZ3 1 +ATOM 2228 N N . LEU A 1 142 ? 21.093 44.863 -7.139 1.00 32.96 ? 141 LEU A N 1 +ATOM 2229 C CA . LEU A 1 142 ? 19.934 44.046 -7.493 1.00 31.42 ? 141 LEU A CA 1 +ATOM 2230 C C . LEU A 1 142 ? 18.756 44.945 -7.815 1.00 31.04 ? 141 LEU A C 1 +ATOM 2231 O O . LEU A 1 142 ? 18.532 45.940 -7.143 1.00 31.30 ? 141 LEU A O 1 +ATOM 2232 C CB . LEU A 1 142 ? 19.561 43.099 -6.342 1.00 30.07 ? 141 LEU A CB 1 +ATOM 2233 C CG . LEU A 1 142 ? 20.654 42.136 -5.865 1.00 30.32 ? 141 LEU A CG 1 +ATOM 2234 C CD1 . LEU A 1 142 ? 20.032 41.118 -4.936 1.00 31.59 ? 141 LEU A CD1 1 +ATOM 2235 C CD2 . LEU A 1 142 ? 21.343 41.439 -7.035 1.00 36.88 ? 141 LEU A CD2 1 +ATOM 2236 H H . LEU A 1 142 ? 21.198 44.991 -6.295 1.00 39.55 ? 141 LEU A H 1 +ATOM 2237 H HA . LEU A 1 142 ? 20.140 43.513 -8.278 1.00 37.71 ? 141 LEU A HA 1 +ATOM 2238 H HB2 . LEU A 1 142 ? 19.300 43.639 -5.579 1.00 36.08 ? 141 LEU A HB2 1 +ATOM 2239 H HB3 . LEU A 1 142 ? 18.806 42.560 -6.625 1.00 36.08 ? 141 LEU A HB3 1 +ATOM 2240 H HG . LEU A 1 142 ? 21.324 42.632 -5.368 1.00 36.38 ? 141 LEU A HG 1 +ATOM 2241 H HD11 . LEU A 1 142 ? 20.721 40.506 -4.632 1.00 37.91 ? 141 LEU A HD11 1 +ATOM 2242 H HD12 . LEU A 1 142 ? 19.641 41.580 -4.178 1.00 37.91 ? 141 LEU A HD12 1 +ATOM 2243 H HD13 . LEU A 1 142 ? 19.345 40.630 -5.417 1.00 37.91 ? 141 LEU A HD13 1 +ATOM 2244 H HD21 . LEU A 1 142 ? 22.025 40.842 -6.690 1.00 44.26 ? 141 LEU A HD21 1 +ATOM 2245 H HD22 . LEU A 1 142 ? 20.683 40.934 -7.535 1.00 44.26 ? 141 LEU A HD22 1 +ATOM 2246 H HD23 . LEU A 1 142 ? 21.750 42.110 -7.607 1.00 44.26 ? 141 LEU A HD23 1 +ATOM 2247 N N . GLU A 1 143 ? 17.989 44.585 -8.833 1.00 30.42 ? 142 GLU A N 1 +ATOM 2248 C CA . GLU A 1 143 ? 16.770 45.315 -9.147 1.00 29.90 ? 142 GLU A CA 1 +ATOM 2249 C C . GLU A 1 143 ? 15.724 45.082 -8.057 1.00 28.44 ? 142 GLU A C 1 +ATOM 2250 O O . GLU A 1 143 ? 15.714 44.034 -7.431 1.00 27.52 ? 142 GLU A O 1 +ATOM 2251 C CB . GLU A 1 143 ? 16.206 44.854 -10.494 1.00 29.53 ? 142 GLU A CB 1 +ATOM 2252 C CG . GLU A 1 143 ? 17.152 45.156 -11.682 1.00 31.05 ? 142 GLU A CG 1 +ATOM 2253 C CD . GLU A 1 143 ? 16.544 44.876 -13.068 1.00 30.82 ? 142 GLU A CD 1 +ATOM 2254 O OE1 . GLU A 1 143 ? 15.569 44.107 -13.189 1.00 29.43 ? 142 GLU A OE1 1 +ATOM 2255 O OE2 . GLU A 1 143 ? 17.065 45.437 -14.059 1.00 35.08 ? 142 GLU A OE2 1 +ATOM 2256 H H . GLU A 1 143 ? 18.151 43.923 -9.358 1.00 36.50 ? 142 GLU A H 1 +ATOM 2257 H HA . GLU A 1 143 ? 16.960 46.265 -9.197 1.00 35.88 ? 142 GLU A HA 1 +ATOM 2258 H HB2 . GLU A 1 143 ? 16.061 43.895 -10.463 1.00 35.44 ? 142 GLU A HB2 1 +ATOM 2259 H HB3 . GLU A 1 143 ? 15.366 45.310 -10.657 1.00 35.44 ? 142 GLU A HB3 1 +ATOM 2260 H HG2 . GLU A 1 143 ? 17.397 46.094 -11.652 1.00 37.26 ? 142 GLU A HG2 1 +ATOM 2261 H HG3 . GLU A 1 143 ? 17.947 44.607 -11.592 1.00 37.26 ? 142 GLU A HG3 1 +ATOM 2262 N N . TYR A 1 144 ? 14.837 46.056 -7.882 1.00 28.27 ? 143 TYR A N 1 +ATOM 2263 C CA . TYR A 1 144 ? 13.744 45.951 -6.926 1.00 26.96 ? 143 TYR A CA 1 +ATOM 2264 C C . TYR A 1 144 ? 12.569 45.223 -7.568 1.00 30.59 ? 143 TYR A C 1 +ATOM 2265 O O . TYR A 1 144 ? 11.563 45.815 -7.958 1.00 25.33 ? 143 TYR A O 1 +ATOM 2266 C CB . TYR A 1 144 ? 13.321 47.330 -6.422 1.00 27.44 ? 143 TYR A CB 1 +ATOM 2267 C CG . TYR A 1 144 ? 12.343 47.258 -5.260 1.00 26.25 ? 143 TYR A CG 1 +ATOM 2268 C CD1 . TYR A 1 144 ? 12.765 46.870 -3.987 1.00 26.01 ? 143 TYR A CD1 1 +ATOM 2269 C CD2 . TYR A 1 144 ? 11.017 47.594 -5.434 1.00 25.65 ? 143 TYR A CD2 1 +ATOM 2270 C CE1 . TYR A 1 144 ? 11.881 46.813 -2.934 1.00 25.00 ? 143 TYR A CE1 1 +ATOM 2271 C CE2 . TYR A 1 144 ? 10.112 47.522 -4.368 1.00 24.68 ? 143 TYR A CE2 1 +ATOM 2272 C CZ . TYR A 1 144 ? 10.559 47.136 -3.136 1.00 24.33 ? 143 TYR A CZ 1 +ATOM 2273 O OH . TYR A 1 144 ? 9.666 47.077 -2.094 1.00 23.45 ? 143 TYR A OH 1 +ATOM 2274 H H . TYR A 1 144 ? 14.848 46.800 -8.314 1.00 33.93 ? 143 TYR A H 1 +ATOM 2275 H HA . TYR A 1 144 ? 14.040 45.430 -6.164 1.00 32.35 ? 143 TYR A HA 1 +ATOM 2276 H HB2 . TYR A 1 144 ? 14.108 47.811 -6.122 1.00 32.92 ? 143 TYR A HB2 1 +ATOM 2277 H HB3 . TYR A 1 144 ? 12.892 47.813 -7.145 1.00 32.92 ? 143 TYR A HB3 1 +ATOM 2278 H HD1 . TYR A 1 144 ? 13.657 46.647 -3.849 1.00 31.21 ? 143 TYR A HD1 1 +ATOM 2279 H HD2 . TYR A 1 144 ? 10.715 47.851 -6.275 1.00 30.77 ? 143 TYR A HD2 1 +ATOM 2280 H HE1 . TYR A 1 144 ? 12.174 46.546 -2.092 1.00 30.00 ? 143 TYR A HE1 1 +ATOM 2281 H HE2 . TYR A 1 144 ? 9.218 47.746 -4.495 1.00 29.62 ? 143 TYR A HE2 1 +ATOM 2282 H HH . TYR A 1 144 ? 8.900 47.298 -2.359 1.00 28.13 ? 143 TYR A HH 1 +ATOM 2283 N N . ASN A 1 145 ? 12.714 43.909 -7.640 1.00 24.88 ? 144 ASN A N 1 +ATOM 2284 C CA . ASN A 1 145 ? 11.673 43.040 -8.161 1.00 23.56 ? 144 ASN A CA 1 +ATOM 2285 C C . ASN A 1 145 ? 12.009 41.616 -7.747 1.00 22.79 ? 144 ASN A C 1 +ATOM 2286 O O . ASN A 1 145 ? 12.962 41.380 -6.979 1.00 23.24 ? 144 ASN A O 1 +ATOM 2287 C CB . ASN A 1 145 ? 11.519 43.177 -9.679 1.00 23.97 ? 144 ASN A CB 1 +ATOM 2288 C CG . ASN A 1 145 ? 12.828 43.033 -10.419 1.00 26.61 ? 144 ASN A CG 1 +ATOM 2289 O OD1 . ASN A 1 145 ? 13.704 42.264 -10.015 1.00 25.37 ? 144 ASN A OD1 1 +ATOM 2290 N ND2 . ASN A 1 145 ? 12.977 43.781 -11.519 1.00 26.24 ? 144 ASN A ND2 1 +ATOM 2291 H H . ASN A 1 145 ? 13.421 43.489 -7.388 1.00 29.85 ? 144 ASN A H 1 +ATOM 2292 H HA . ASN A 1 145 ? 10.827 43.280 -7.752 1.00 28.27 ? 144 ASN A HA 1 +ATOM 2293 H HB2 . ASN A 1 145 ? 10.918 42.486 -9.998 1.00 28.76 ? 144 ASN A HB2 1 +ATOM 2294 H HB3 . ASN A 1 145 ? 11.156 44.053 -9.882 1.00 28.76 ? 144 ASN A HB3 1 +ATOM 2295 H HD21 . ASN A 1 145 ? 12.346 44.308 -11.770 1.00 31.49 ? 144 ASN A HD21 1 +ATOM 2296 H HD22 . ASN A 1 145 ? 13.705 43.735 -11.975 1.00 31.49 ? 144 ASN A HD22 1 +ATOM 2297 N N . TYR A 1 146 ? 11.214 40.669 -8.223 1.00 22.88 ? 145 TYR A N 1 +ATOM 2298 C CA . TYR A 1 146 ? 11.270 39.318 -7.686 1.00 25.74 ? 145 TYR A CA 1 +ATOM 2299 C C . TYR A 1 146 ? 10.726 38.308 -8.672 1.00 25.36 ? 145 TYR A C 1 +ATOM 2300 O O . TYR A 1 146 ? 9.716 38.536 -9.339 1.00 21.65 ? 145 TYR A O 1 +ATOM 2301 C CB . TYR A 1 146 ? 10.529 39.207 -6.337 1.00 20.25 ? 145 TYR A CB 1 +ATOM 2302 C CG . TYR A 1 146 ? 11.239 38.241 -5.420 1.00 19.45 ? 145 TYR A CG 1 +ATOM 2303 C CD1 . TYR A 1 146 ? 12.363 38.638 -4.712 1.00 23.92 ? 145 TYR A CD1 1 +ATOM 2304 C CD2 . TYR A 1 146 ? 10.822 36.921 -5.302 1.00 18.31 ? 145 TYR A CD2 1 +ATOM 2305 C CE1 . TYR A 1 146 ? 13.047 37.751 -3.896 1.00 20.31 ? 145 TYR A CE1 1 +ATOM 2306 C CE2 . TYR A 1 146 ? 11.500 36.035 -4.500 1.00 18.18 ? 145 TYR A CE2 1 +ATOM 2307 C CZ . TYR A 1 146 ? 12.612 36.449 -3.807 1.00 19.18 ? 145 TYR A CZ 1 +ATOM 2308 O OH . TYR A 1 146 ? 13.309 35.570 -3.007 1.00 22.30 ? 145 TYR A OH 1 +ATOM 2309 H H . TYR A 1 146 ? 10.638 40.781 -8.852 1.00 27.45 ? 145 TYR A H 1 +ATOM 2310 H HA . TYR A 1 146 ? 12.199 39.093 -7.525 1.00 30.89 ? 145 TYR A HA 1 +ATOM 2311 H HB2 . TYR A 1 146 ? 10.506 40.076 -5.908 1.00 24.30 ? 145 TYR A HB2 1 +ATOM 2312 H HB3 . TYR A 1 146 ? 9.629 38.880 -6.489 1.00 24.30 ? 145 TYR A HB3 1 +ATOM 2313 H HD1 . TYR A 1 146 ? 12.663 39.515 -4.786 1.00 28.70 ? 145 TYR A HD1 1 +ATOM 2314 H HD2 . TYR A 1 146 ? 10.078 36.631 -5.780 1.00 21.97 ? 145 TYR A HD2 1 +ATOM 2315 H HE1 . TYR A 1 146 ? 13.802 38.028 -3.429 1.00 24.37 ? 145 TYR A HE1 1 +ATOM 2316 H HE2 . TYR A 1 146 ? 11.211 35.154 -4.432 1.00 21.81 ? 145 TYR A HE2 1 +ATOM 2317 H HH . TYR A 1 146 ? 12.951 34.811 -3.034 1.00 26.76 ? 145 TYR A HH 1 +ATOM 2318 N N . ASN A 1 147 ? 11.413 37.181 -8.741 1.00 20.94 ? 146 ASN A N 1 +ATOM 2319 C CA . ASN A 1 147 ? 11.089 36.143 -9.703 1.00 19.26 ? 146 ASN A CA 1 +ATOM 2320 C C . ASN A 1 147 ? 10.195 35.076 -9.090 1.00 20.97 ? 146 ASN A C 1 +ATOM 2321 O O . ASN A 1 147 ? 9.728 35.228 -7.971 1.00 23.43 ? 146 ASN A O 1 +ATOM 2322 C CB . ASN A 1 147 ? 12.391 35.571 -10.253 1.00 25.69 ? 146 ASN A CB 1 +ATOM 2323 C CG . ASN A 1 147 ? 12.911 36.379 -11.433 1.00 39.91 ? 146 ASN A CG 1 +ATOM 2324 O OD1 . ASN A 1 147 ? 12.178 36.622 -12.391 1.00 41.81 ? 146 ASN A OD1 1 +ATOM 2325 N ND2 . ASN A 1 147 ? 14.164 36.829 -11.354 1.00 37.65 ? 146 ASN A ND2 1 +ATOM 2326 H H . ASN A 1 147 ? 12.082 36.991 -8.235 1.00 25.13 ? 146 ASN A H 1 +ATOM 2327 H HA . ASN A 1 147 ? 10.606 36.543 -10.442 1.00 23.11 ? 146 ASN A HA 1 +ATOM 2328 H HB2 . ASN A 1 147 ? 13.065 35.584 -9.556 1.00 30.83 ? 146 ASN A HB2 1 +ATOM 2329 H HB3 . ASN A 1 147 ? 12.237 34.661 -10.553 1.00 30.83 ? 146 ASN A HB3 1 +ATOM 2330 H HD21 . ASN A 1 147 ? 14.639 36.658 -10.658 1.00 45.18 ? 146 ASN A HD21 1 +ATOM 2331 H HD22 . ASN A 1 147 ? 14.497 37.289 -11.999 1.00 45.18 ? 146 ASN A HD22 1 +ATOM 2332 N N . HIS A 1 148 ? 9.947 34.005 -9.828 1.00 17.14 ? 147 HIS A N 1 +ATOM 2333 C CA . HIS A 1 148 ? 9.051 32.941 -9.370 1.00 15.70 ? 147 HIS A CA 1 +ATOM 2334 C C . HIS A 1 148 ? 9.874 31.675 -9.274 1.00 20.73 ? 147 HIS A C 1 +ATOM 2335 O O . HIS A 1 148 ? 10.699 31.400 -10.166 1.00 16.52 ? 147 HIS A O 1 +ATOM 2336 C CB . HIS A 1 148 ? 7.920 32.733 -10.367 1.00 14.93 ? 147 HIS A CB 1 +ATOM 2337 C CG . HIS A 1 148 ? 8.394 32.671 -11.779 1.00 21.39 ? 147 HIS A CG 1 +ATOM 2338 N ND1 . HIS A 1 148 ? 8.623 31.482 -12.431 1.00 26.08 ? 147 HIS A ND1 1 +ATOM 2339 C CD2 . HIS A 1 148 ? 8.709 33.650 -12.652 1.00 25.78 ? 147 HIS A CD2 1 +ATOM 2340 C CE1 . HIS A 1 148 ? 9.054 31.731 -13.653 1.00 27.20 ? 147 HIS A CE1 1 +ATOM 2341 N NE2 . HIS A 1 148 ? 9.104 33.041 -13.818 1.00 24.52 ? 147 HIS A NE2 1 +ATOM 2342 H H . HIS A 1 148 ? 10.286 33.865 -10.605 1.00 20.57 ? 147 HIS A H 1 +ATOM 2343 H HA . HIS A 1 148 ? 8.682 33.156 -8.499 1.00 18.84 ? 147 HIS A HA 1 +ATOM 2344 H HB2 . HIS A 1 148 ? 7.472 31.897 -10.164 1.00 17.92 ? 147 HIS A HB2 1 +ATOM 2345 H HB3 . HIS A 1 148 ? 7.295 33.471 -10.293 1.00 17.92 ? 147 HIS A HB3 1 +ATOM 2346 H HD1 . HIS A 1 148 ? 8.507 30.700 -12.094 1.00 31.30 ? 147 HIS A HD1 1 +ATOM 2347 H HD2 . HIS A 1 148 ? 8.655 34.566 -12.499 1.00 30.94 ? 147 HIS A HD2 1 +ATOM 2348 H HE1 . HIS A 1 148 ? 9.269 31.093 -14.295 1.00 32.65 ? 147 HIS A HE1 1 +ATOM 2349 H HE2 . HIS A 1 148 ? 9.355 33.445 -14.534 1.00 29.42 ? 147 HIS A HE2 1 +ATOM 2350 N N . HIS A 1 149 ? 9.664 30.912 -8.202 1.00 14.83 ? 148 HIS A N 1 +ATOM 2351 C CA . HIS A 1 149 ? 10.576 29.830 -7.859 1.00 14.31 ? 148 HIS A CA 1 +ATOM 2352 C C . HIS A 1 149 ? 9.852 28.536 -7.549 1.00 16.31 ? 148 HIS A C 1 +ATOM 2353 O O . HIS A 1 149 ? 8.631 28.518 -7.466 1.00 14.49 ? 148 HIS A O 1 +ATOM 2354 C CB . HIS A 1 149 ? 11.443 30.266 -6.688 1.00 13.49 ? 148 HIS A CB 1 +ATOM 2355 C CG . HIS A 1 149 ? 12.221 31.515 -6.974 1.00 14.60 ? 148 HIS A CG 1 +ATOM 2356 N ND1 . HIS A 1 149 ? 12.006 32.705 -6.308 1.00 14.17 ? 148 HIS A ND1 1 +ATOM 2357 C CD2 . HIS A 1 149 ? 13.159 31.775 -7.918 1.00 16.74 ? 148 HIS A CD2 1 +ATOM 2358 C CE1 . HIS A 1 149 ? 12.819 33.629 -6.793 1.00 14.21 ? 148 HIS A CE1 1 +ATOM 2359 N NE2 . HIS A 1 149 ? 13.528 33.088 -7.770 1.00 14.66 ? 148 HIS A NE2 1 +ATOM 2360 H H . HIS A 1 149 ? 9.002 31.001 -7.661 1.00 17.80 ? 148 HIS A H 1 +ATOM 2361 H HA . HIS A 1 149 ? 11.162 29.666 -8.614 1.00 17.17 ? 148 HIS A HA 1 +ATOM 2362 H HB2 . HIS A 1 149 ? 10.875 30.435 -5.920 1.00 16.19 ? 148 HIS A HB2 1 +ATOM 2363 H HB3 . HIS A 1 149 ? 12.075 29.559 -6.483 1.00 16.19 ? 148 HIS A HB3 1 +ATOM 2364 H HD1 . HIS A 1 149 ? 11.454 32.819 -5.659 1.00 17.00 ? 148 HIS A HD1 1 +ATOM 2365 H HD2 . HIS A 1 149 ? 13.512 31.168 -8.528 1.00 20.09 ? 148 HIS A HD2 1 +ATOM 2366 H HE1 . HIS A 1 149 ? 12.876 34.511 -6.503 1.00 17.05 ? 148 HIS A HE1 1 +ATOM 2367 H HE2 . HIS A 1 149 ? 14.119 33.496 -8.243 1.00 17.60 ? 148 HIS A HE2 1 +ATOM 2368 N N . LYS A 1 150 ? 10.615 27.447 -7.447 1.00 14.18 ? 149 LYS A N 1 +ATOM 2369 C CA . LYS A 1 150 ? 10.095 26.137 -7.073 1.00 14.16 ? 149 LYS A CA 1 +ATOM 2370 C C . LYS A 1 150 ? 10.863 25.695 -5.839 1.00 13.49 ? 149 LYS A C 1 +ATOM 2371 O O . LYS A 1 150 ? 12.085 25.585 -5.876 1.00 16.38 ? 149 LYS A O 1 +ATOM 2372 C CB . LYS A 1 150 ? 10.264 25.112 -8.216 1.00 16.14 ? 149 LYS A CB 1 +ATOM 2373 C CG . LYS A 1 150 ? 9.203 25.201 -9.244 1.00 24.50 ? 149 LYS A CG 1 +ATOM 2374 C CD . LYS A 1 150 ? 9.425 24.220 -10.402 1.00 27.03 ? 149 LYS A CD 1 +ATOM 2375 C CE . LYS A 1 150 ? 8.998 22.805 -10.098 1.00 22.45 ? 149 LYS A CE 1 +ATOM 2376 N NZ . LYS A 1 150 ? 8.770 22.062 -11.428 1.00 23.99 ? 149 LYS A NZ 1 +ATOM 2377 H H . LYS A 1 150 ? 11.463 27.445 -7.595 1.00 17.01 ? 149 LYS A H 1 +ATOM 2378 H HA . LYS A 1 150 ? 9.154 26.207 -6.850 1.00 16.99 ? 149 LYS A HA 1 +ATOM 2379 H HB2 . LYS A 1 150 ? 11.116 25.265 -8.653 1.00 19.37 ? 149 LYS A HB2 1 +ATOM 2380 H HB3 . LYS A 1 150 ? 10.241 24.217 -7.841 1.00 19.37 ? 149 LYS A HB3 1 +ATOM 2381 H HG2 . LYS A 1 150 ? 8.348 24.996 -8.835 1.00 29.39 ? 149 LYS A HG2 1 +ATOM 2382 H HG3 . LYS A 1 150 ? 9.191 26.100 -9.609 1.00 29.39 ? 149 LYS A HG3 1 +ATOM 2383 H HD2 . LYS A 1 150 ? 8.915 24.524 -11.170 1.00 32.43 ? 149 LYS A HD2 1 +ATOM 2384 H HD3 . LYS A 1 150 ? 10.370 24.204 -10.621 1.00 32.43 ? 149 LYS A HD3 1 +ATOM 2385 H HE2 . LYS A 1 150 ? 9.697 22.350 -9.601 1.00 26.94 ? 149 LYS A HE2 1 +ATOM 2386 H HE3 . LYS A 1 150 ? 8.168 22.812 -9.597 1.00 26.94 ? 149 LYS A HE3 1 +ATOM 2387 H HZ1 . LYS A 1 150 ? 9.522 22.052 -11.904 1.00 28.79 ? 149 LYS A HZ1 1 +ATOM 2388 H HZ2 . LYS A 1 150 ? 8.517 21.223 -11.268 1.00 28.79 ? 149 LYS A HZ2 1 +ATOM 2389 H HZ3 . LYS A 1 150 ? 8.135 22.470 -11.899 1.00 28.79 ? 149 LYS A HZ3 1 +ATOM 2390 N N . VAL A 1 151 ? 10.137 25.499 -4.741 1.00 14.31 ? 150 VAL A N 1 +ATOM 2391 C CA . VAL A 1 151 ? 10.699 25.175 -3.435 1.00 15.10 ? 150 VAL A CA 1 +ATOM 2392 C C . VAL A 1 151 ? 10.536 23.669 -3.172 1.00 13.60 ? 150 VAL A C 1 +ATOM 2393 O O . VAL A 1 151 ? 9.432 23.200 -2.998 1.00 14.69 ? 150 VAL A O 1 +ATOM 2394 C CB . VAL A 1 151 ? 9.922 25.997 -2.383 1.00 11.69 ? 150 VAL A CB 1 +ATOM 2395 C CG1 . VAL A 1 151 ? 10.311 25.624 -0.967 1.00 11.52 ? 150 VAL A CG1 1 +ATOM 2396 C CG2 . VAL A 1 151 ? 10.115 27.493 -2.652 1.00 15.74 ? 150 VAL A CG2 1 +ATOM 2397 H H . VAL A 1 151 ? 9.278 25.552 -4.730 1.00 17.17 ? 150 VAL A H 1 +ATOM 2398 H HA . VAL A 1 151 ? 11.639 25.410 -3.402 1.00 18.12 ? 150 VAL A HA 1 +ATOM 2399 H HB . VAL A 1 151 ? 8.976 25.805 -2.483 1.00 14.02 ? 150 VAL A HB 1 +ATOM 2400 H HG11 . VAL A 1 151 ? 9.798 26.165 -0.346 1.00 13.82 ? 150 VAL A HG11 1 +ATOM 2401 H HG12 . VAL A 1 151 ? 10.118 24.684 -0.824 1.00 13.82 ? 150 VAL A HG12 1 +ATOM 2402 H HG13 . VAL A 1 151 ? 11.259 25.790 -0.846 1.00 13.82 ? 150 VAL A HG13 1 +ATOM 2403 H HG21 . VAL A 1 151 ? 9.624 28.000 -1.987 1.00 18.89 ? 150 VAL A HG21 1 +ATOM 2404 H HG22 . VAL A 1 151 ? 11.061 27.704 -2.598 1.00 18.89 ? 150 VAL A HG22 1 +ATOM 2405 H HG23 . VAL A 1 151 ? 9.781 27.700 -3.539 1.00 18.89 ? 150 VAL A HG23 1 +ATOM 2406 N N . TYR A 1 152 ? 11.628 22.912 -3.185 1.00 12.90 ? 151 TYR A N 1 +ATOM 2407 C CA . TYR A 1 152 ? 11.538 21.460 -3.094 1.00 13.45 ? 151 TYR A CA 1 +ATOM 2408 C C . TYR A 1 152 ? 11.532 21.014 -1.643 1.00 13.06 ? 151 TYR A C 1 +ATOM 2409 O O . TYR A 1 152 ? 12.348 21.488 -0.854 1.00 14.08 ? 151 TYR A O 1 +ATOM 2410 C CB . TYR A 1 152 ? 12.719 20.843 -3.831 1.00 14.74 ? 151 TYR A CB 1 +ATOM 2411 C CG . TYR A 1 152 ? 12.603 21.056 -5.308 1.00 15.58 ? 151 TYR A CG 1 +ATOM 2412 C CD1 . TYR A 1 152 ? 11.745 20.281 -6.054 1.00 17.90 ? 151 TYR A CD1 1 +ATOM 2413 C CD2 . TYR A 1 152 ? 13.320 22.053 -5.948 1.00 18.65 ? 151 TYR A CD2 1 +ATOM 2414 C CE1 . TYR A 1 152 ? 11.614 20.470 -7.412 1.00 21.24 ? 151 TYR A CE1 1 +ATOM 2415 C CE2 . TYR A 1 152 ? 13.213 22.240 -7.315 1.00 22.24 ? 151 TYR A CE2 1 +ATOM 2416 C CZ . TYR A 1 152 ? 12.350 21.442 -8.037 1.00 23.23 ? 151 TYR A CZ 1 +ATOM 2417 O OH . TYR A 1 152 ? 12.193 21.616 -9.395 1.00 29.13 ? 151 TYR A OH 1 +ATOM 2418 H H . TYR A 1 152 ? 12.431 23.214 -3.244 1.00 15.48 ? 151 TYR A H 1 +ATOM 2419 H HA . TYR A 1 152 ? 10.718 21.157 -3.515 1.00 16.14 ? 151 TYR A HA 1 +ATOM 2420 H HB2 . TYR A 1 152 ? 13.541 21.259 -3.526 1.00 17.69 ? 151 TYR A HB2 1 +ATOM 2421 H HB3 . TYR A 1 152 ? 12.741 19.888 -3.661 1.00 17.69 ? 151 TYR A HB3 1 +ATOM 2422 H HD1 . TYR A 1 152 ? 11.249 19.615 -5.635 1.00 21.48 ? 151 TYR A HD1 1 +ATOM 2423 H HD2 . TYR A 1 152 ? 13.907 22.582 -5.458 1.00 22.38 ? 151 TYR A HD2 1 +ATOM 2424 H HE1 . TYR A 1 152 ? 11.036 19.933 -7.904 1.00 25.49 ? 151 TYR A HE1 1 +ATOM 2425 H HE2 . TYR A 1 152 ? 13.701 22.909 -7.738 1.00 26.69 ? 151 TYR A HE2 1 +ATOM 2426 H HH . TYR A 1 152 ? 12.693 22.235 -9.665 1.00 34.96 ? 151 TYR A HH 1 +ATOM 2427 N N . ILE A 1 153 ? 10.604 20.132 -1.296 1.00 14.34 ? 152 ILE A N 1 +ATOM 2428 C CA . ILE A 1 153 ? 10.447 19.664 0.083 1.00 12.81 ? 152 ILE A CA 1 +ATOM 2429 C C . ILE A 1 153 ? 10.557 18.153 0.169 1.00 16.03 ? 152 ILE A C 1 +ATOM 2430 O O . ILE A 1 153 ? 9.954 17.458 -0.636 1.00 15.08 ? 152 ILE A O 1 +ATOM 2431 C CB . ILE A 1 153 ? 9.070 20.082 0.609 1.00 16.48 ? 152 ILE A CB 1 +ATOM 2432 C CG1 . ILE A 1 153 ? 8.953 21.617 0.597 1.00 12.30 ? 152 ILE A CG1 1 +ATOM 2433 C CG2 . ILE A 1 153 ? 8.814 19.473 1.985 1.00 14.45 ? 152 ILE A CG2 1 +ATOM 2434 C CD1 . ILE A 1 153 ? 7.516 22.144 0.847 1.00 12.85 ? 152 ILE A CD1 1 +ATOM 2435 H H . ILE A 1 153 ? 10.043 19.783 -1.846 1.00 17.20 ? 152 ILE A H 1 +ATOM 2436 H HA . ILE A 1 153 ? 11.130 20.060 0.645 1.00 15.38 ? 152 ILE A HA 1 +ATOM 2437 H HB . ILE A 1 153 ? 8.401 19.729 0.001 1.00 19.78 ? 152 ILE A HB 1 +ATOM 2438 H HG12 . ILE A 1 153 ? 9.525 21.978 1.292 1.00 14.76 ? 152 ILE A HG12 1 +ATOM 2439 H HG13 . ILE A 1 153 ? 9.242 21.945 -0.269 1.00 14.76 ? 152 ILE A HG13 1 +ATOM 2440 H HG21 . ILE A 1 153 ? 7.938 19.752 2.296 1.00 17.33 ? 152 ILE A HG21 1 +ATOM 2441 H HG22 . ILE A 1 153 ? 8.848 18.506 1.914 1.00 17.33 ? 152 ILE A HG22 1 +ATOM 2442 H HG23 . ILE A 1 153 ? 9.497 19.784 2.599 1.00 17.33 ? 152 ILE A HG23 1 +ATOM 2443 H HD11 . ILE A 1 153 ? 7.528 23.114 0.824 1.00 15.42 ? 152 ILE A HD11 1 +ATOM 2444 H HD12 . ILE A 1 153 ? 6.930 21.804 0.153 1.00 15.42 ? 152 ILE A HD12 1 +ATOM 2445 H HD13 . ILE A 1 153 ? 7.214 21.837 1.716 1.00 15.42 ? 152 ILE A HD13 1 +ATOM 2446 N N . THR A 1 154 ? 11.313 17.649 1.156 1.00 14.11 ? 153 THR A N 1 +ATOM 2447 C CA . THR A 1 154 ? 11.382 16.216 1.452 1.00 15.03 ? 153 THR A CA 1 +ATOM 2448 C C . THR A 1 154 ? 11.326 16.034 2.966 1.00 19.03 ? 153 THR A C 1 +ATOM 2449 O O . THR A 1 154 ? 11.638 16.964 3.732 1.00 16.88 ? 153 THR A O 1 +ATOM 2450 C CB . THR A 1 154 ? 12.674 15.585 0.901 1.00 17.76 ? 153 THR A CB 1 +ATOM 2451 O OG1 . THR A 1 154 ? 12.606 14.149 0.965 1.00 19.90 ? 153 THR A OG1 1 +ATOM 2452 C CG2 . THR A 1 154 ? 13.916 16.107 1.646 1.00 17.19 ? 153 THR A CG2 1 +ATOM 2453 H H . THR A 1 154 ? 11.803 18.130 1.674 1.00 16.93 ? 153 THR A H 1 +ATOM 2454 H HA . THR A 1 154 ? 10.621 15.763 1.056 1.00 18.03 ? 153 THR A HA 1 +ATOM 2455 H HB . THR A 1 154 ? 12.766 15.844 -0.030 1.00 21.31 ? 153 THR A HB 1 +ATOM 2456 H HG1 . THR A 1 154 ? 11.957 13.871 0.510 1.00 23.89 ? 153 THR A HG1 1 +ATOM 2457 H HG21 . THR A 1 154 ? 14.716 15.697 1.283 1.00 20.63 ? 153 THR A HG21 1 +ATOM 2458 H HG22 . THR A 1 154 ? 13.981 17.069 1.547 1.00 20.63 ? 153 THR A HG22 1 +ATOM 2459 H HG23 . THR A 1 154 ? 13.851 15.891 2.590 1.00 20.63 ? 153 THR A HG23 1 +ATOM 2460 N N . ALA A 1 155 ? 10.918 14.846 3.397 1.00 17.31 ? 154 ALA A N 1 +ATOM 2461 C CA . ALA A 1 155 ? 10.871 14.537 4.817 1.00 19.48 ? 154 ALA A CA 1 +ATOM 2462 C C . ALA A 1 155 ? 12.266 14.377 5.382 1.00 17.35 ? 154 ALA A C 1 +ATOM 2463 O O . ALA A 1 155 ? 13.217 13.972 4.692 1.00 18.40 ? 154 ALA A O 1 +ATOM 2464 C CB . ALA A 1 155 ? 10.070 13.269 5.058 1.00 19.27 ? 154 ALA A CB 1 +ATOM 2465 H H . ALA A 1 155 ? 10.665 14.202 2.886 1.00 20.77 ? 154 ALA A H 1 +ATOM 2466 H HA . ALA A 1 155 ? 10.435 15.265 5.287 1.00 23.38 ? 154 ALA A HA 1 +ATOM 2467 H HB1 . ALA A 1 155 ? 10.052 13.084 6.010 1.00 23.12 ? 154 ALA A HB1 1 +ATOM 2468 H HB2 . ALA A 1 155 ? 9.167 13.399 4.729 1.00 23.12 ? 154 ALA A HB2 1 +ATOM 2469 H HB3 . ALA A 1 155 ? 10.493 12.535 4.585 1.00 23.12 ? 154 ALA A HB3 1 +ATOM 2470 N N . ASP A 1 156 ? 12.349 14.666 6.675 1.00 17.77 ? 155 ASP A N 1 +ATOM 2471 C CA . ASP A 1 156 ? 13.512 14.354 7.488 1.00 20.22 ? 155 ASP A CA 1 +ATOM 2472 C C . ASP A 1 156 ? 12.975 13.639 8.729 1.00 20.33 ? 155 ASP A C 1 +ATOM 2473 O O . ASP A 1 156 ? 12.888 14.233 9.814 1.00 21.02 ? 155 ASP A O 1 +ATOM 2474 C CB . ASP A 1 156 ? 14.199 15.662 7.883 1.00 21.44 ? 155 ASP A CB 1 +ATOM 2475 C CG . ASP A 1 156 ? 15.587 15.460 8.467 1.00 29.73 ? 155 ASP A CG 1 +ATOM 2476 O OD1 . ASP A 1 156 ? 16.016 14.300 8.691 1.00 31.92 ? 155 ASP A OD1 1 +ATOM 2477 O OD2 . ASP A 1 156 ? 16.251 16.492 8.712 1.00 28.45 ? 155 ASP A OD2 1 +ATOM 2478 H H . ASP A 1 156 ? 11.722 15.056 7.116 1.00 21.33 ? 155 ASP A H 1 +ATOM 2479 H HA . ASP A 1 156 ? 14.131 13.780 7.010 1.00 24.27 ? 155 ASP A HA 1 +ATOM 2480 H HB2 . ASP A 1 156 ? 14.287 16.221 7.095 1.00 25.73 ? 155 ASP A HB2 1 +ATOM 2481 H HB3 . ASP A 1 156 ? 13.658 16.112 8.549 1.00 25.73 ? 155 ASP A HB3 1 +ATOM 2482 N N . LYS A 1 157 ? 12.622 12.368 8.578 1.00 20.69 ? 156 LYS A N 1 +ATOM 2483 C CA . LYS A 1 157 ? 11.877 11.652 9.607 1.00 21.13 ? 156 LYS A CA 1 +ATOM 2484 C C . LYS A 1 157 ? 12.611 11.570 10.961 1.00 23.13 ? 156 LYS A C 1 +ATOM 2485 O O . LYS A 1 157 ? 11.971 11.622 11.998 1.00 23.40 ? 156 LYS A O 1 +ATOM 2486 C CB . LYS A 1 157 ? 11.490 10.230 9.151 1.00 21.52 ? 156 LYS A CB 1 +ATOM 2487 C CG . LYS A 1 157 ? 12.621 9.303 8.829 1.00 23.41 ? 156 LYS A CG 1 +ATOM 2488 C CD . LYS A 1 157 ? 12.117 7.909 8.348 1.00 23.99 ? 156 LYS A CD 1 +ATOM 2489 C CE . LYS A 1 157 ? 13.278 6.939 8.228 1.00 31.53 ? 156 LYS A CE 1 +ATOM 2490 N NZ . LYS A 1 157 ? 12.997 5.623 7.523 1.00 29.46 ? 156 LYS A NZ 1 +ATOM 2491 H H . LYS A 1 157 ? 12.804 11.893 7.884 1.00 24.83 ? 156 LYS A H 1 +ATOM 2492 H HA . LYS A 1 157 ? 11.049 12.133 9.763 1.00 25.35 ? 156 LYS A HA 1 +ATOM 2493 H HB2 . LYS A 1 157 ? 10.970 9.816 9.857 1.00 25.82 ? 156 LYS A HB2 1 +ATOM 2494 H HB3 . LYS A 1 157 ? 10.943 10.306 8.353 1.00 25.82 ? 156 LYS A HB3 1 +ATOM 2495 H HG2 . LYS A 1 157 ? 13.158 9.691 8.121 1.00 28.09 ? 156 LYS A HG2 1 +ATOM 2496 H HG3 . LYS A 1 157 ? 13.160 9.171 9.624 1.00 28.09 ? 156 LYS A HG3 1 +ATOM 2497 H HD2 . LYS A 1 157 ? 11.485 7.554 8.991 1.00 28.79 ? 156 LYS A HD2 1 +ATOM 2498 H HD3 . LYS A 1 157 ? 11.701 7.999 7.476 1.00 28.79 ? 156 LYS A HD3 1 +ATOM 2499 H HE2 . LYS A 1 157 ? 13.991 7.380 7.740 1.00 37.83 ? 156 LYS A HE2 1 +ATOM 2500 H HE3 . LYS A 1 157 ? 13.587 6.726 9.122 1.00 37.83 ? 156 LYS A HE3 1 +ATOM 2501 H HZ1 . LYS A 1 157 ? 13.735 5.126 7.503 1.00 35.36 ? 156 LYS A HZ1 1 +ATOM 2502 H HZ2 . LYS A 1 157 ? 12.359 5.178 7.955 1.00 35.36 ? 156 LYS A HZ2 1 +ATOM 2503 H HZ3 . LYS A 1 157 ? 12.729 5.777 6.689 1.00 35.36 ? 156 LYS A HZ3 1 +ATOM 2504 N N . GLN A 1 158 ? 13.930 11.445 10.949 1.00 24.89 ? 157 GLN A N 1 +ATOM 2505 C CA . GLN A 1 158 ? 14.645 11.159 12.196 1.00 27.42 ? 157 GLN A CA 1 +ATOM 2506 C C . GLN A 1 158 ? 14.682 12.420 13.075 1.00 27.70 ? 157 GLN A C 1 +ATOM 2507 O O . GLN A 1 158 ? 14.968 12.349 14.282 1.00 29.84 ? 157 GLN A O 1 +ATOM 2508 C CB . GLN A 1 158 ? 16.036 10.571 11.896 1.00 29.81 ? 157 GLN A CB 1 +ATOM 2509 C CG . GLN A 1 158 ? 16.481 9.380 12.805 1.00 35.37 ? 157 GLN A CG 1 +ATOM 2510 C CD . GLN A 1 158 ? 15.582 8.114 12.743 1.00 38.96 ? 157 GLN A CD 1 +ATOM 2511 O OE1 . GLN A 1 158 ? 14.855 7.884 11.766 1.00 30.15 ? 157 GLN A OE1 1 +ATOM 2512 N NE2 . GLN A 1 158 ? 15.642 7.291 13.804 1.00 34.25 ? 157 GLN A NE2 1 +ATOM 2513 H H . GLN A 1 158 ? 14.430 11.517 10.253 1.00 29.86 ? 157 GLN A H 1 +ATOM 2514 H HA . GLN A 1 158 ? 14.147 10.484 12.684 1.00 32.90 ? 157 GLN A HA 1 +ATOM 2515 H HB2 . GLN A 1 158 ? 16.042 10.255 10.979 1.00 35.77 ? 157 GLN A HB2 1 +ATOM 2516 H HB3 . GLN A 1 158 ? 16.694 11.276 11.999 1.00 35.77 ? 157 GLN A HB3 1 +ATOM 2517 H HG2 . GLN A 1 158 ? 17.376 9.113 12.544 1.00 42.44 ? 157 GLN A HG2 1 +ATOM 2518 H HG3 . GLN A 1 158 ? 16.490 9.684 13.726 1.00 42.44 ? 157 GLN A HG3 1 +ATOM 2519 H HE21 . GLN A 1 158 ? 16.158 7.479 14.466 1.00 41.10 ? 157 GLN A HE21 1 +ATOM 2520 H HE22 . GLN A 1 158 ? 15.165 6.576 13.820 1.00 41.10 ? 157 GLN A HE22 1 +ATOM 2521 N N . LYS A 1 159 ? 14.359 13.566 12.471 1.00 25.84 ? 158 LYS A N 1 +ATOM 2522 C CA . LYS A 1 159 ? 14.257 14.842 13.197 1.00 32.05 ? 158 LYS A CA 1 +ATOM 2523 C C . LYS A 1 159 ? 12.805 15.288 13.270 1.00 24.24 ? 158 LYS A C 1 +ATOM 2524 O O . LYS A 1 159 ? 12.499 16.370 13.777 1.00 24.39 ? 158 LYS A O 1 +ATOM 2525 C CB . LYS A 1 159 ? 15.092 15.936 12.515 1.00 25.92 ? 158 LYS A CB 1 +ATOM 2526 C CG . LYS A 1 159 ? 16.570 15.857 12.886 1.00 38.55 ? 158 LYS A CG 1 +ATOM 2527 C CD . LYS A 1 159 ? 17.384 17.023 12.348 1.00 43.26 ? 158 LYS A CD 1 +ATOM 2528 C CE . LYS A 1 159 ? 18.882 16.809 12.585 1.00 43.69 ? 158 LYS A CE 1 +ATOM 2529 H H . LYS A 1 159 ? 14.191 13.635 11.631 1.00 31.00 ? 158 LYS A H 1 +ATOM 2530 H HA . LYS A 1 159 ? 14.587 14.725 14.101 1.00 38.46 ? 158 LYS A HA 1 +ATOM 2531 H HB2 . LYS A 1 159 ? 15.018 15.838 11.552 1.00 31.10 ? 158 LYS A HB2 1 +ATOM 2532 H HB3 . LYS A 1 159 ? 14.759 16.805 12.787 1.00 31.10 ? 158 LYS A HB3 1 +ATOM 2533 H HG2 . LYS A 1 159 ? 16.652 15.857 13.853 1.00 46.26 ? 158 LYS A HG2 1 +ATOM 2534 H HG3 . LYS A 1 159 ? 16.943 15.039 12.522 1.00 46.26 ? 158 LYS A HG3 1 +ATOM 2535 H HD2 . LYS A 1 159 ? 17.235 17.105 11.393 1.00 51.92 ? 158 LYS A HD2 1 +ATOM 2536 H HD3 . LYS A 1 159 ? 17.117 17.838 12.802 1.00 51.92 ? 158 LYS A HD3 1 +ATOM 2537 H HE2 . LYS A 1 159 ? 19.086 17.001 13.514 1.00 52.43 ? 158 LYS A HE2 1 +ATOM 2538 H HE3 . LYS A 1 159 ? 19.106 15.887 12.381 1.00 52.43 ? 158 LYS A HE3 1 +ATOM 2539 N N . ASN A 1 160 ? 11.915 14.445 12.752 1.00 22.86 ? 159 ASN A N 1 +ATOM 2540 C CA . ASN A 1 160 ? 10.483 14.723 12.752 1.00 21.48 ? 159 ASN A CA 1 +ATOM 2541 C C . ASN A 1 160 ? 10.153 16.042 12.025 1.00 20.02 ? 159 ASN A C 1 +ATOM 2542 O O . ASN A 1 160 ? 9.259 16.784 12.434 1.00 20.02 ? 159 ASN A O 1 +ATOM 2543 C CB . ASN A 1 160 ? 9.919 14.743 14.178 1.00 28.13 ? 159 ASN A CB 1 +ATOM 2544 C CG . ASN A 1 160 ? 8.435 14.367 14.231 1.00 22.17 ? 159 ASN A CG 1 +ATOM 2545 O OD1 . ASN A 1 160 ? 7.976 13.504 13.485 1.00 23.25 ? 159 ASN A OD1 1 +ATOM 2546 N ND2 . ASN A 1 160 ? 7.688 15.005 15.136 1.00 27.36 ? 159 ASN A ND2 1 +ATOM 2547 H H . ASN A 1 160 ? 12.120 13.693 12.390 1.00 27.43 ? 159 ASN A H 1 +ATOM 2548 H HA . ASN A 1 160 ? 10.034 14.009 12.274 1.00 25.78 ? 159 ASN A HA 1 +ATOM 2549 H HB2 . ASN A 1 160 ? 10.410 14.107 14.721 1.00 33.76 ? 159 ASN A HB2 1 +ATOM 2550 H HB3 . ASN A 1 160 ? 10.016 15.637 14.544 1.00 33.76 ? 159 ASN A HB3 1 +ATOM 2551 H HD21 . ASN A 1 160 ? 8.046 15.593 15.652 1.00 32.83 ? 159 ASN A HD21 1 +ATOM 2552 H HD22 . ASN A 1 160 ? 6.849 14.828 15.204 1.00 32.83 ? 159 ASN A HD22 1 +ATOM 2553 N N . GLY A 1 161 ? 10.879 16.308 10.939 1.00 20.39 ? 160 GLY A N 1 +ATOM 2554 C CA . GLY A 1 161 ? 10.732 17.558 10.226 1.00 20.30 ? 160 GLY A CA 1 +ATOM 2555 C C . GLY A 1 161 ? 10.942 17.373 8.738 1.00 16.84 ? 160 GLY A C 1 +ATOM 2556 O O . GLY A 1 161 ? 10.723 16.286 8.203 1.00 21.45 ? 160 GLY A O 1 +ATOM 2557 H H . GLY A 1 161 ? 11.462 15.775 10.600 1.00 24.46 ? 160 GLY A H 1 +ATOM 2558 H HA2 . GLY A 1 161 ? 9.842 17.915 10.372 1.00 24.36 ? 160 GLY A HA2 1 +ATOM 2559 H HA3 . GLY A 1 161 ? 11.382 18.199 10.554 1.00 24.36 ? 160 GLY A HA3 1 +ATOM 2560 N N . ILE A 1 162 ? 11.396 18.438 8.089 1.00 17.26 ? 161 ILE A N 1 +ATOM 2561 C CA . ILE A 1 162 ? 11.602 18.449 6.633 1.00 18.85 ? 161 ILE A CA 1 +ATOM 2562 C C . ILE A 1 162 ? 12.911 19.154 6.292 1.00 17.99 ? 161 ILE A C 1 +ATOM 2563 O O . ILE A 1 162 ? 13.460 19.921 7.101 1.00 19.54 ? 161 ILE A O 1 +ATOM 2564 C CB . ILE A 1 162 ? 10.450 19.189 5.882 1.00 14.08 ? 161 ILE A CB 1 +ATOM 2565 C CG1 . ILE A 1 162 ? 10.292 20.622 6.420 1.00 14.29 ? 161 ILE A CG1 1 +ATOM 2566 C CG2 . ILE A 1 162 ? 9.179 18.410 6.007 1.00 15.66 ? 161 ILE A CG2 1 +ATOM 2567 C CD1 . ILE A 1 162 ? 9.271 21.450 5.670 1.00 14.84 ? 161 ILE A CD1 1 +ATOM 2568 H H . ILE A 1 162 ? 11.598 19.182 8.471 1.00 20.71 ? 161 ILE A H 1 +ATOM 2569 H HA . ILE A 1 162 ? 11.648 17.537 6.305 1.00 22.62 ? 161 ILE A HA 1 +ATOM 2570 H HB . ILE A 1 162 ? 10.684 19.242 4.942 1.00 16.89 ? 161 ILE A HB 1 +ATOM 2571 H HG12 . ILE A 1 162 ? 10.013 20.578 7.348 1.00 17.15 ? 161 ILE A HG12 1 +ATOM 2572 H HG13 . ILE A 1 162 ? 11.147 21.076 6.355 1.00 17.15 ? 161 ILE A HG13 1 +ATOM 2573 H HG21 . ILE A 1 162 ? 8.473 18.881 5.537 1.00 18.79 ? 161 ILE A HG21 1 +ATOM 2574 H HG22 . ILE A 1 162 ? 9.308 17.531 5.617 1.00 18.79 ? 161 ILE A HG22 1 +ATOM 2575 H HG23 . ILE A 1 162 ? 8.952 18.325 6.946 1.00 18.79 ? 161 ILE A HG23 1 +ATOM 2576 H HD11 . ILE A 1 162 ? 9.229 22.334 6.066 1.00 17.80 ? 161 ILE A HD11 1 +ATOM 2577 H HD12 . ILE A 1 162 ? 9.540 21.515 4.741 1.00 17.80 ? 161 ILE A HD12 1 +ATOM 2578 H HD13 . ILE A 1 162 ? 8.405 21.017 5.735 1.00 17.80 ? 161 ILE A HD13 1 +ATOM 2579 N N . LYS A 1 163 ? 13.406 18.847 5.099 1.00 15.87 ? 162 LYS A N 1 +ATOM 2580 C CA . LYS A 1 163 ? 14.515 19.520 4.481 1.00 16.41 ? 162 LYS A CA 1 +ATOM 2581 C C . LYS A 1 163 ? 13.977 20.114 3.186 1.00 15.12 ? 162 LYS A C 1 +ATOM 2582 O O . LYS A 1 163 ? 13.178 19.499 2.473 1.00 14.50 ? 162 LYS A O 1 +ATOM 2583 C CB . LYS A 1 163 ? 15.678 18.559 4.183 1.00 18.07 ? 162 LYS A CB 1 +ATOM 2584 C CG . LYS A 1 163 ? 16.609 18.319 5.397 1.00 23.15 ? 162 LYS A CG 1 +ATOM 2585 C CD . LYS A 1 163 ? 17.831 17.445 5.032 1.00 29.67 ? 162 LYS A CD 1 +ATOM 2586 C CE . LYS A 1 163 ? 18.828 17.360 6.191 1.00 40.16 ? 162 LYS A CE 1 +ATOM 2587 H H . LYS A 1 163 ? 13.088 18.215 4.610 1.00 19.05 ? 162 LYS A H 1 +ATOM 2588 H HA . LYS A 1 163 ? 14.832 20.236 5.053 1.00 19.70 ? 162 LYS A HA 1 +ATOM 2589 H HB2 . LYS A 1 163 ? 15.314 17.701 3.913 1.00 21.69 ? 162 LYS A HB2 1 +ATOM 2590 H HB3 . LYS A 1 163 ? 16.215 18.929 3.465 1.00 21.69 ? 162 LYS A HB3 1 +ATOM 2591 H HG2 . LYS A 1 163 ? 16.934 19.173 5.721 1.00 27.78 ? 162 LYS A HG2 1 +ATOM 2592 H HG3 . LYS A 1 163 ? 16.111 17.865 6.095 1.00 27.78 ? 162 LYS A HG3 1 +ATOM 2593 H HD2 . LYS A 1 163 ? 17.531 16.546 4.823 1.00 35.61 ? 162 LYS A HD2 1 +ATOM 2594 H HD3 . LYS A 1 163 ? 18.286 17.833 4.268 1.00 35.61 ? 162 LYS A HD3 1 +ATOM 2595 N N . VAL A 1 164 ? 14.436 21.316 2.893 1.00 15.08 ? 163 VAL A N 1 +ATOM 2596 C CA . VAL A 1 164 ? 13.912 22.110 1.791 1.00 15.81 ? 163 VAL A CA 1 +ATOM 2597 C C . VAL A 1 164 ? 15.110 22.700 1.035 1.00 18.80 ? 163 VAL A C 1 +ATOM 2598 O O . VAL A 1 164 ? 16.119 23.079 1.647 1.00 17.05 ? 163 VAL A O 1 +ATOM 2599 C CB . VAL A 1 164 ? 13.022 23.242 2.370 1.00 13.41 ? 163 VAL A CB 1 +ATOM 2600 C CG1 . VAL A 1 164 ? 12.533 24.169 1.290 1.00 13.30 ? 163 VAL A CG1 1 +ATOM 2601 C CG2 . VAL A 1 164 ? 11.845 22.629 3.196 1.00 16.39 ? 163 VAL A CG2 1 +ATOM 2602 H H . VAL A 1 164 ? 15.067 21.706 3.328 1.00 18.10 ? 163 VAL A H 1 +ATOM 2603 H HA . VAL A 1 164 ? 13.387 21.558 1.190 1.00 18.98 ? 163 VAL A HA 1 +ATOM 2604 H HB . VAL A 1 164 ? 13.559 23.770 2.982 1.00 16.09 ? 163 VAL A HB 1 +ATOM 2605 H HG11 . VAL A 1 164 ? 11.983 24.859 1.691 1.00 15.96 ? 163 VAL A HG11 1 +ATOM 2606 H HG12 . VAL A 1 164 ? 13.298 24.570 0.849 1.00 15.96 ? 163 VAL A HG12 1 +ATOM 2607 H HG13 . VAL A 1 164 ? 12.011 23.660 0.650 1.00 15.96 ? 163 VAL A HG13 1 +ATOM 2608 H HG21 . VAL A 1 164 ? 11.300 23.349 3.550 1.00 19.67 ? 163 VAL A HG21 1 +ATOM 2609 H HG22 . VAL A 1 164 ? 11.312 22.066 2.614 1.00 19.67 ? 163 VAL A HG22 1 +ATOM 2610 H HG23 . VAL A 1 164 ? 12.211 22.102 3.923 1.00 19.67 ? 163 VAL A HG23 1 +ATOM 2611 N N . ASN A 1 165 ? 15.042 22.740 -0.294 1.00 18.86 ? 164 ASN A N 1 +ATOM 2612 C CA . ASN A 1 165 ? 16.097 23.372 -1.065 1.00 16.51 ? 164 ASN A CA 1 +ATOM 2613 C C . ASN A 1 165 ? 15.508 24.057 -2.275 1.00 14.67 ? 164 ASN A C 1 +ATOM 2614 O O . ASN A 1 165 ? 14.504 23.588 -2.824 1.00 14.13 ? 164 ASN A O 1 +ATOM 2615 C CB . ASN A 1 165 ? 17.182 22.363 -1.494 1.00 17.11 ? 164 ASN A CB 1 +ATOM 2616 C CG . ASN A 1 165 ? 16.697 21.363 -2.560 1.00 21.66 ? 164 ASN A CG 1 +ATOM 2617 O OD1 . ASN A 1 165 ? 16.042 20.362 -2.244 1.00 28.33 ? 164 ASN A OD1 1 +ATOM 2618 N ND2 . ASN A 1 165 ? 17.072 21.606 -3.811 1.00 22.96 ? 164 ASN A ND2 1 +ATOM 2619 H H . ASN A 1 165 ? 14.401 22.412 -0.765 1.00 22.63 ? 164 ASN A H 1 +ATOM 2620 H HA . ASN A 1 165 ? 16.522 24.050 -0.517 1.00 19.81 ? 164 ASN A HA 1 +ATOM 2621 H HB2 . ASN A 1 165 ? 17.936 22.849 -1.863 1.00 20.53 ? 164 ASN A HB2 1 +ATOM 2622 H HB3 . ASN A 1 165 ? 17.464 21.856 -0.717 1.00 20.53 ? 164 ASN A HB3 1 +ATOM 2623 H HD21 . ASN A 1 165 ? 17.560 22.292 -3.989 1.00 27.55 ? 164 ASN A HD21 1 +ATOM 2624 H HD22 . ASN A 1 165 ? 16.828 21.077 -4.444 1.00 27.55 ? 164 ASN A HD22 1 +ATOM 2625 N N . PHE A 1 166 ? 16.122 25.166 -2.671 1.00 17.88 ? 165 PHE A N 1 +ATOM 2626 C CA . PHE A 1 166 ? 15.720 25.882 -3.878 1.00 16.10 ? 165 PHE A CA 1 +ATOM 2627 C C . PHE A 1 166 ? 16.706 26.962 -4.231 1.00 19.55 ? 165 PHE A C 1 +ATOM 2628 O O . PHE A 1 166 ? 17.492 27.379 -3.395 1.00 17.36 ? 165 PHE A O 1 +ATOM 2629 C CB . PHE A 1 166 ? 14.325 26.499 -3.751 1.00 14.76 ? 165 PHE A CB 1 +ATOM 2630 C CG . PHE A 1 166 ? 14.159 27.441 -2.564 1.00 12.95 ? 165 PHE A CG 1 +ATOM 2631 C CD1 . PHE A 1 166 ? 13.940 26.949 -1.301 1.00 12.81 ? 165 PHE A CD1 1 +ATOM 2632 C CD2 . PHE A 1 166 ? 14.207 28.815 -2.745 1.00 18.49 ? 165 PHE A CD2 1 +ATOM 2633 C CE1 . PHE A 1 166 ? 13.768 27.817 -0.221 1.00 16.33 ? 165 PHE A CE1 1 +ATOM 2634 C CE2 . PHE A 1 166 ? 14.011 29.676 -1.697 1.00 18.56 ? 165 PHE A CE2 1 +ATOM 2635 C CZ . PHE A 1 166 ? 13.823 29.181 -0.422 1.00 13.66 ? 165 PHE A CZ 1 +ATOM 2636 H H . PHE A 1 166 ? 16.781 25.529 -2.254 1.00 21.46 ? 165 PHE A H 1 +ATOM 2637 H HA . PHE A 1 166 ? 15.697 25.253 -4.616 1.00 19.32 ? 165 PHE A HA 1 +ATOM 2638 H HB2 . PHE A 1 166 ? 14.134 27.004 -4.557 1.00 17.71 ? 165 PHE A HB2 1 +ATOM 2639 H HB3 . PHE A 1 166 ? 13.676 25.784 -3.652 1.00 17.71 ? 165 PHE A HB3 1 +ATOM 2640 H HD1 . PHE A 1 166 ? 13.908 26.030 -1.163 1.00 15.37 ? 165 PHE A HD1 1 +ATOM 2641 H HD2 . PHE A 1 166 ? 14.337 29.158 -3.600 1.00 22.19 ? 165 PHE A HD2 1 +ATOM 2642 H HE1 . PHE A 1 166 ? 13.628 27.477 0.633 1.00 19.59 ? 165 PHE A HE1 1 +ATOM 2643 H HE2 . PHE A 1 166 ? 14.059 30.594 -1.835 1.00 22.27 ? 165 PHE A HE2 1 +ATOM 2644 H HZ . PHE A 1 166 ? 13.705 29.764 0.293 1.00 16.39 ? 165 PHE A HZ 1 +ATOM 2645 N N . LYS A 1 167 ? 16.667 27.404 -5.487 1.00 15.63 ? 166 LYS A N 1 +ATOM 2646 C CA . LYS A 1 167 ? 17.541 28.473 -5.934 1.00 16.38 ? 166 LYS A CA 1 +ATOM 2647 C C . LYS A 1 167 ? 16.648 29.650 -6.283 1.00 21.34 ? 166 LYS A C 1 +ATOM 2648 O O . LYS A 1 167 ? 15.638 29.474 -6.944 1.00 25.48 ? 166 LYS A O 1 +ATOM 2649 C CB . LYS A 1 167 ? 18.305 28.066 -7.222 1.00 21.52 ? 166 LYS A CB 1 +ATOM 2650 C CG . LYS A 1 167 ? 18.852 26.656 -7.248 1.00 28.18 ? 166 LYS A CG 1 +ATOM 2651 H H . LYS A 1 167 ? 16.142 27.099 -6.096 1.00 18.76 ? 166 LYS A H 1 +ATOM 2652 H HA . LYS A 1 167 ? 18.169 28.726 -5.239 1.00 19.66 ? 166 LYS A HA 1 +ATOM 2653 H HB2 . LYS A 1 167 ? 17.701 28.157 -7.976 1.00 25.82 ? 166 LYS A HB2 1 +ATOM 2654 H HB3 . LYS A 1 167 ? 19.055 28.670 -7.335 1.00 25.82 ? 166 LYS A HB3 1 +ATOM 2655 N N . THR A 1 168 ? 17.037 30.852 -5.907 1.00 20.23 ? 167 THR A N 1 +ATOM 2656 C CA . THR A 1 168 ? 16.329 32.032 -6.357 1.00 15.73 ? 167 THR A CA 1 +ATOM 2657 C C . THR A 1 168 ? 17.194 32.794 -7.361 1.00 21.55 ? 167 THR A C 1 +ATOM 2658 O O . THR A 1 168 ? 18.425 32.683 -7.354 1.00 19.14 ? 167 THR A O 1 +ATOM 2659 C CB . THR A 1 168 ? 15.956 32.953 -5.174 1.00 16.75 ? 167 THR A CB 1 +ATOM 2660 O OG1 . THR A 1 168 ? 17.138 33.347 -4.473 1.00 16.28 ? 167 THR A OG1 1 +ATOM 2661 C CG2 . THR A 1 168 ? 15.030 32.243 -4.190 1.00 13.95 ? 167 THR A CG2 1 +ATOM 2662 H H . THR A 1 168 ? 17.707 31.013 -5.392 1.00 24.27 ? 167 THR A H 1 +ATOM 2663 H HA . THR A 1 168 ? 15.510 31.764 -6.802 1.00 18.87 ? 167 THR A HA 1 +ATOM 2664 H HB . THR A 1 168 ? 15.501 33.742 -5.509 1.00 20.10 ? 167 THR A HB 1 +ATOM 2665 H HG1 . THR A 1 168 ? 17.654 33.761 -4.991 1.00 19.54 ? 167 THR A HG1 1 +ATOM 2666 H HG21 . THR A 1 168 ? 14.808 32.837 -3.456 1.00 16.74 ? 167 THR A HG21 1 +ATOM 2667 H HG22 . THR A 1 168 ? 14.213 31.976 -4.639 1.00 16.74 ? 167 THR A HG22 1 +ATOM 2668 H HG23 . THR A 1 168 ? 15.468 31.453 -3.836 1.00 16.74 ? 167 THR A HG23 1 +ATOM 2669 N N . ARG A 1 169 ? 16.520 33.564 -8.215 1.00 17.54 ? 168 ARG A N 1 +ATOM 2670 C CA . ARG A 1 169 ? 17.142 34.323 -9.301 1.00 21.59 ? 168 ARG A CA 1 +ATOM 2671 C C . ARG A 1 169 ? 16.812 35.794 -9.118 1.00 17.23 ? 168 ARG A C 1 +ATOM 2672 O O . ARG A 1 169 ? 15.649 36.168 -9.155 1.00 19.48 ? 168 ARG A O 1 +ATOM 2673 C CB . ARG A 1 169 ? 16.598 33.831 -10.662 1.00 21.04 ? 168 ARG A CB 1 +ATOM 2674 C CG . ARG A 1 169 ? 16.778 32.329 -10.885 1.00 27.96 ? 168 ARG A CG 1 +ATOM 2675 C CD . ARG A 1 169 ? 16.142 31.813 -12.189 1.00 30.82 ? 168 ARG A CD 1 +ATOM 2676 N NE . ARG A 1 169 ? 14.749 32.241 -12.389 1.00 41.54 ? 168 ARG A NE 1 +ATOM 2677 C CZ . ARG A 1 169 ? 13.670 31.604 -11.913 1.00 39.82 ? 168 ARG A CZ 1 +ATOM 2678 N NH1 . ARG A 1 169 ? 13.791 30.476 -11.207 1.00 37.97 ? 168 ARG A NH1 1 +ATOM 2679 N NH2 . ARG A 1 169 ? 12.458 32.091 -12.171 1.00 34.43 ? 168 ARG A NH2 1 +ATOM 2680 H H . ARG A 1 169 ? 15.666 33.665 -8.184 1.00 21.05 ? 168 ARG A H 1 +ATOM 2681 H HA . ARG A 1 169 ? 18.105 34.207 -9.282 1.00 25.91 ? 168 ARG A HA 1 +ATOM 2682 H HB2 . ARG A 1 169 ? 15.650 34.027 -10.710 1.00 25.25 ? 168 ARG A HB2 1 +ATOM 2683 H HB3 . ARG A 1 169 ? 17.067 34.295 -11.374 1.00 25.25 ? 168 ARG A HB3 1 +ATOM 2684 H HG2 . ARG A 1 169 ? 17.726 32.129 -10.919 1.00 33.55 ? 168 ARG A HG2 1 +ATOM 2685 H HG3 . ARG A 1 169 ? 16.368 31.852 -10.146 1.00 33.55 ? 168 ARG A HG3 1 +ATOM 2686 H HD2 . ARG A 1 169 ? 16.662 32.139 -12.939 1.00 36.98 ? 168 ARG A HD2 1 +ATOM 2687 H HD3 . ARG A 1 169 ? 16.154 30.843 -12.178 1.00 36.98 ? 168 ARG A HD3 1 +ATOM 2688 H HE . ARG A 1 169 ? 14.616 32.957 -12.847 1.00 49.85 ? 168 ARG A HE 1 +ATOM 2689 H HH11 . ARG A 1 169 ? 14.571 30.155 -11.040 1.00 45.57 ? 168 ARG A HH11 1 +ATOM 2690 H HH12 . ARG A 1 169 ? 13.089 30.077 -10.910 1.00 45.57 ? 168 ARG A HH12 1 +ATOM 2691 H HH21 . ARG A 1 169 ? 12.374 32.815 -12.627 1.00 41.31 ? 168 ARG A HH21 1 +ATOM 2692 H HH22 . ARG A 1 169 ? 11.760 31.688 -11.872 1.00 41.31 ? 168 ARG A HH22 1 +ATOM 2693 N N . HIS A 1 170 ? 17.828 36.619 -8.895 1.00 19.45 ? 169 HIS A N 1 +ATOM 2694 C CA . HIS A 1 170 ? 17.632 38.052 -8.631 1.00 18.21 ? 169 HIS A CA 1 +ATOM 2695 C C . HIS A 1 170 ? 18.224 38.876 -9.766 1.00 20.79 ? 169 HIS A C 1 +ATOM 2696 O O . HIS A 1 170 ? 19.429 38.843 -9.995 1.00 26.81 ? 169 HIS A O 1 +ATOM 2697 C CB . HIS A 1 170 ? 18.276 38.469 -7.303 1.00 18.52 ? 169 HIS A CB 1 +ATOM 2698 C CG . HIS A 1 170 ? 17.837 37.625 -6.152 1.00 20.81 ? 169 HIS A CG 1 +ATOM 2699 N ND1 . HIS A 1 170 ? 16.619 37.800 -5.534 1.00 20.54 ? 169 HIS A ND1 1 +ATOM 2700 C CD2 . HIS A 1 170 ? 18.429 36.574 -5.534 1.00 23.63 ? 169 HIS A CD2 1 +ATOM 2701 C CE1 . HIS A 1 170 ? 16.478 36.893 -4.582 1.00 21.07 ? 169 HIS A CE1 1 +ATOM 2702 N NE2 . HIS A 1 170 ? 17.564 36.136 -4.562 1.00 22.15 ? 169 HIS A NE2 1 +ATOM 2703 H H . HIS A 1 170 ? 18.653 36.377 -8.891 1.00 23.34 ? 169 HIS A H 1 +ATOM 2704 H HA . HIS A 1 170 ? 16.682 38.242 -8.581 1.00 21.86 ? 169 HIS A HA 1 +ATOM 2705 H HB2 . HIS A 1 170 ? 19.239 38.391 -7.381 1.00 22.22 ? 169 HIS A HB2 1 +ATOM 2706 H HB3 . HIS A 1 170 ? 18.032 39.388 -7.110 1.00 22.22 ? 169 HIS A HB3 1 +ATOM 2707 H HD1 . HIS A 1 170 ? 16.037 38.398 -5.742 1.00 24.65 ? 169 HIS A HD1 1 +ATOM 2708 H HD2 . HIS A 1 170 ? 19.261 36.212 -5.737 1.00 28.35 ? 169 HIS A HD2 1 +ATOM 2709 H HE1 . HIS A 1 170 ? 15.746 36.809 -4.014 1.00 25.29 ? 169 HIS A HE1 1 +ATOM 2710 H HE2 . HIS A 1 170 ? 17.710 35.485 -4.018 1.00 26.58 ? 169 HIS A HE2 1 +ATOM 2711 N N . ASN A 1 171 ? 17.362 39.616 -10.456 1.00 23.54 ? 170 ASN A N 1 +ATOM 2712 C CA . ASN A 1 171 ? 17.800 40.466 -11.558 1.00 23.89 ? 170 ASN A CA 1 +ATOM 2713 C C . ASN A 1 171 ? 18.814 41.469 -11.074 1.00 26.40 ? 170 ASN A C 1 +ATOM 2714 O O . ASN A 1 171 ? 18.625 42.085 -10.031 1.00 24.43 ? 170 ASN A O 1 +ATOM 2715 C CB . ASN A 1 171 ? 16.614 41.199 -12.174 1.00 33.06 ? 170 ASN A CB 1 +ATOM 2716 C CG . ASN A 1 171 ? 15.784 40.304 -13.066 1.00 33.14 ? 170 ASN A CG 1 +ATOM 2717 O OD1 . ASN A 1 171 ? 15.908 39.076 -13.019 1.00 29.64 ? 170 ASN A OD1 1 +ATOM 2718 N ND2 . ASN A 1 171 ? 14.941 40.910 -13.893 1.00 37.25 ? 170 ASN A ND2 1 +ATOM 2719 H H . ASN A 1 171 ? 16.516 39.644 -10.306 1.00 28.25 ? 170 ASN A H 1 +ATOM 2720 H HA . ASN A 1 171 ? 18.212 39.918 -12.244 1.00 28.66 ? 170 ASN A HA 1 +ATOM 2721 H HB2 . ASN A 1 171 ? 16.043 41.531 -11.464 1.00 39.67 ? 170 ASN A HB2 1 +ATOM 2722 H HB3 . ASN A 1 171 ? 16.942 41.938 -12.711 1.00 39.67 ? 170 ASN A HB3 1 +ATOM 2723 H HD21 . ASN A 1 171 ? 14.889 41.769 -13.901 1.00 44.70 ? 170 ASN A HD21 1 +ATOM 2724 H HD22 . ASN A 1 171 ? 14.446 40.445 -14.420 1.00 44.70 ? 170 ASN A HD22 1 +ATOM 2725 N N . ILE A 1 172 ? 19.898 41.604 -11.834 1.00 28.94 ? 171 ILE A N 1 +ATOM 2726 C CA . ILE A 1 172 ? 20.938 42.582 -11.558 1.00 30.46 ? 171 ILE A CA 1 +ATOM 2727 C C . ILE A 1 172 ? 20.766 43.725 -12.535 1.00 37.37 ? 171 ILE A C 1 +ATOM 2728 O O . ILE A 1 172 ? 20.389 43.515 -13.693 1.00 38.00 ? 171 ILE A O 1 +ATOM 2729 C CB . ILE A 1 172 ? 22.318 41.950 -11.713 1.00 31.56 ? 171 ILE A CB 1 +ATOM 2730 C CG1 . ILE A 1 172 ? 22.452 40.799 -10.726 1.00 34.78 ? 171 ILE A CG1 1 +ATOM 2731 C CG2 . ILE A 1 172 ? 23.424 42.976 -11.508 1.00 35.16 ? 171 ILE A CG2 1 +ATOM 2732 C CD1 . ILE A 1 172 ? 23.508 39.813 -11.098 1.00 43.98 ? 171 ILE A CD1 1 +ATOM 2733 H H . ILE A 1 172 ? 20.055 41.127 -12.532 1.00 34.73 ? 171 ILE A H 1 +ATOM 2734 H HA . ILE A 1 172 ? 20.845 42.921 -10.654 1.00 36.56 ? 171 ILE A HA 1 +ATOM 2735 H HB . ILE A 1 172 ? 22.393 41.594 -12.612 1.00 37.88 ? 171 ILE A HB 1 +ATOM 2736 H HG12 . ILE A 1 172 ? 22.676 41.160 -9.854 1.00 41.74 ? 171 ILE A HG12 1 +ATOM 2737 H HG13 . ILE A 1 172 ? 21.607 40.326 -10.680 1.00 41.74 ? 171 ILE A HG13 1 +ATOM 2738 H HG21 . ILE A 1 172 ? 24.283 42.539 -11.614 1.00 42.19 ? 171 ILE A HG21 1 +ATOM 2739 H HG22 . ILE A 1 172 ? 23.327 43.681 -12.167 1.00 42.19 ? 171 ILE A HG22 1 +ATOM 2740 H HG23 . ILE A 1 172 ? 23.349 43.346 -10.614 1.00 42.19 ? 171 ILE A HG23 1 +ATOM 2741 H HD11 . ILE A 1 172 ? 23.535 39.113 -10.427 1.00 52.78 ? 171 ILE A HD11 1 +ATOM 2742 H HD12 . ILE A 1 172 ? 23.294 39.434 -11.964 1.00 52.78 ? 171 ILE A HD12 1 +ATOM 2743 H HD13 . ILE A 1 172 ? 24.364 40.268 -11.138 1.00 52.78 ? 171 ILE A HD13 1 +ATOM 2744 N N . GLU A 1 173 ? 21.050 44.935 -12.060 1.00 35.72 ? 172 GLU A N 1 +ATOM 2745 C CA . GLU A 1 173 ? 20.784 46.159 -12.812 1.00 35.27 ? 172 GLU A CA 1 +ATOM 2746 C C . GLU A 1 173 ? 21.324 46.137 -14.249 1.00 41.80 ? 172 GLU A C 1 +ATOM 2747 O O . GLU A 1 173 ? 20.802 46.833 -15.117 1.00 40.59 ? 172 GLU A O 1 +ATOM 2748 C CB . GLU A 1 173 ? 21.378 47.361 -12.060 1.00 37.85 ? 172 GLU A CB 1 +ATOM 2749 H H . GLU A 1 173 ? 21.404 45.076 -11.289 1.00 42.87 ? 172 GLU A H 1 +ATOM 2750 H HA . GLU A 1 173 ? 19.824 46.288 -12.862 1.00 42.32 ? 172 GLU A HA 1 +ATOM 2751 N N . ASP A 1 174 ? 22.355 45.335 -14.501 1.00 42.04 ? 173 ASP A N 1 +ATOM 2752 C CA . ASP A 1 174 ? 23.005 45.326 -15.804 1.00 45.82 ? 173 ASP A CA 1 +ATOM 2753 C C . ASP A 1 174 ? 22.483 44.225 -16.712 1.00 44.14 ? 173 ASP A C 1 +ATOM 2754 O O . ASP A 1 174 ? 22.985 44.055 -17.806 1.00 42.15 ? 173 ASP A O 1 +ATOM 2755 C CB . ASP A 1 174 ? 24.526 45.186 -15.650 1.00 51.23 ? 173 ASP A CB 1 +ATOM 2756 C CG . ASP A 1 174 ? 24.953 43.805 -15.154 1.00 54.58 ? 173 ASP A CG 1 +ATOM 2757 O OD1 . ASP A 1 174 ? 24.083 42.961 -14.831 1.00 47.20 ? 173 ASP A OD1 1 +ATOM 2758 O OD2 . ASP A 1 174 ? 26.180 43.570 -15.071 1.00 55.58 ? 173 ASP A OD2 1 +ATOM 2759 H H . ASP A 1 174 ? 22.695 44.787 -13.932 1.00 50.44 ? 173 ASP A H 1 +ATOM 2760 H HA . ASP A 1 174 ? 22.831 46.174 -16.242 1.00 54.98 ? 173 ASP A HA 1 +ATOM 2761 H HB2 . ASP A 1 174 ? 24.944 45.337 -16.512 1.00 61.47 ? 173 ASP A HB2 1 +ATOM 2762 H HB3 . ASP A 1 174 ? 24.839 45.844 -15.010 1.00 61.47 ? 173 ASP A HB3 1 +ATOM 2763 N N . GLY A 1 175 ? 21.504 43.460 -16.243 1.00 41.25 ? 174 GLY A N 1 +ATOM 2764 C CA . GLY A 1 175 ? 20.903 42.408 -17.048 1.00 37.22 ? 174 GLY A CA 1 +ATOM 2765 C C . GLY A 1 175 ? 21.309 40.982 -16.708 1.00 41.85 ? 174 GLY A C 1 +ATOM 2766 O O . GLY A 1 175 ? 20.684 40.038 -17.185 1.00 40.76 ? 174 GLY A O 1 +ATOM 2767 H H . GLY A 1 175 ? 21.167 43.533 -15.455 1.00 49.51 ? 174 GLY A H 1 +ATOM 2768 H HA2 . GLY A 1 175 ? 19.939 42.467 -16.963 1.00 44.66 ? 174 GLY A HA2 1 +ATOM 2769 H HA3 . GLY A 1 175 ? 21.128 42.564 -17.978 1.00 44.66 ? 174 GLY A HA3 1 +ATOM 2770 N N . SER A 1 176 ? 22.341 40.806 -15.886 1.00 38.13 ? 175 SER A N 1 +ATOM 2771 C CA . SER A 1 176 ? 22.720 39.474 -15.449 1.00 35.66 ? 175 SER A CA 1 +ATOM 2772 C C . SER A 1 176 ? 21.800 39.055 -14.284 1.00 32.11 ? 175 SER A C 1 +ATOM 2773 O O . SER A 1 176 ? 20.874 39.788 -13.917 1.00 31.23 ? 175 SER A O 1 +ATOM 2774 C CB . SER A 1 176 ? 24.203 39.434 -15.053 1.00 42.97 ? 175 SER A CB 1 +ATOM 2775 O OG . SER A 1 176 ? 24.536 40.461 -14.120 1.00 43.15 ? 175 SER A OG 1 +ATOM 2776 H H . SER A 1 176 ? 22.831 41.439 -15.571 1.00 45.76 ? 175 SER A H 1 +ATOM 2777 H HA . SER A 1 176 ? 22.586 38.849 -16.180 1.00 42.79 ? 175 SER A HA 1 +ATOM 2778 H HB2 . SER A 1 176 ? 24.394 38.572 -14.650 1.00 51.57 ? 175 SER A HB2 1 +ATOM 2779 H HB3 . SER A 1 176 ? 24.742 39.550 -15.851 1.00 51.57 ? 175 SER A HB3 1 +ATOM 2780 H HG . SER A 1 176 ? 24.080 40.373 -13.420 1.00 51.78 ? 175 SER A HG 1 +ATOM 2781 N N . VAL A 1 177 ? 22.051 37.874 -13.726 1.00 30.32 ? 176 VAL A N 1 +ATOM 2782 C CA . VAL A 1 177 ? 21.212 37.309 -12.676 1.00 30.02 ? 176 VAL A CA 1 +ATOM 2783 C C . VAL A 1 177 ? 22.087 36.785 -11.544 1.00 34.94 ? 176 VAL A C 1 +ATOM 2784 O O . VAL A 1 177 ? 23.030 36.026 -11.768 1.00 30.25 ? 176 VAL A O 1 +ATOM 2785 C CB . VAL A 1 177 ? 20.338 36.154 -13.208 1.00 30.14 ? 176 VAL A CB 1 +ATOM 2786 C CG1 . VAL A 1 177 ? 19.479 35.569 -12.107 1.00 34.72 ? 176 VAL A CG1 1 +ATOM 2787 C CG2 . VAL A 1 177 ? 19.468 36.637 -14.342 1.00 32.51 ? 176 VAL A CG2 1 +ATOM 2788 H H . VAL A 1 177 ? 22.715 37.372 -13.944 1.00 36.39 ? 176 VAL A H 1 +ATOM 2789 H HA . VAL A 1 177 ? 20.629 37.999 -12.322 1.00 36.02 ? 176 VAL A HA 1 +ATOM 2790 H HB . VAL A 1 177 ? 20.914 35.451 -13.548 1.00 36.17 ? 176 VAL A HB 1 +ATOM 2791 H HG11 . VAL A 1 177 ? 18.944 34.847 -12.475 1.00 41.67 ? 176 VAL A HG11 1 +ATOM 2792 H HG12 . VAL A 1 177 ? 20.054 35.229 -11.404 1.00 41.67 ? 176 VAL A HG12 1 +ATOM 2793 H HG13 . VAL A 1 177 ? 18.900 36.263 -11.755 1.00 41.67 ? 176 VAL A HG13 1 +ATOM 2794 H HG21 . VAL A 1 177 ? 18.928 35.898 -14.662 1.00 39.01 ? 176 VAL A HG21 1 +ATOM 2795 H HG22 . VAL A 1 177 ? 18.895 37.350 -14.018 1.00 39.01 ? 176 VAL A HG22 1 +ATOM 2796 H HG23 . VAL A 1 177 ? 20.035 36.966 -15.057 1.00 39.01 ? 176 VAL A HG23 1 +ATOM 2797 N N . GLN A 1 178 ? 21.749 37.190 -10.325 1.00 27.08 ? 177 GLN A N 1 +ATOM 2798 C CA . GLN A 1 178 ? 22.442 36.721 -9.138 1.00 26.85 ? 177 GLN A CA 1 +ATOM 2799 C C . GLN A 1 178 ? 21.693 35.503 -8.610 1.00 26.93 ? 177 GLN A C 1 +ATOM 2800 O O . GLN A 1 178 ? 20.512 35.600 -8.293 1.00 28.02 ? 177 GLN A O 1 +ATOM 2801 C CB . GLN A 1 178 ? 22.460 37.841 -8.098 1.00 26.77 ? 177 GLN A CB 1 +ATOM 2802 C CG . GLN A 1 178 ? 22.923 37.418 -6.692 1.00 31.06 ? 177 GLN A CG 1 +ATOM 2803 C CD . GLN A 1 178 ? 24.395 37.064 -6.681 1.00 29.64 ? 177 GLN A CD 1 +ATOM 2804 O OE1 . GLN A 1 178 ? 25.231 37.900 -6.989 1.00 33.81 ? 177 GLN A OE1 1 +ATOM 2805 N NE2 . GLN A 1 178 ? 24.712 35.810 -6.371 1.00 31.64 ? 177 GLN A NE2 1 +ATOM 2806 H H . GLN A 1 178 ? 21.113 37.744 -10.160 1.00 32.49 ? 177 GLN A H 1 +ATOM 2807 H HA . GLN A 1 178 ? 23.353 36.469 -9.356 1.00 32.22 ? 177 GLN A HA 1 +ATOM 2808 H HB2 . GLN A 1 178 ? 23.061 38.537 -8.405 1.00 32.13 ? 177 GLN A HB2 1 +ATOM 2809 H HB3 . GLN A 1 178 ? 21.563 38.199 -8.014 1.00 32.13 ? 177 GLN A HB3 1 +ATOM 2810 H HG2 . GLN A 1 178 ? 22.781 38.151 -6.074 1.00 37.27 ? 177 GLN A HG2 1 +ATOM 2811 H HG3 . GLN A 1 178 ? 22.420 36.638 -6.410 1.00 37.27 ? 177 GLN A HG3 1 +ATOM 2812 H HE21 . GLN A 1 178 ? 24.093 35.242 -6.189 1.00 37.97 ? 177 GLN A HE21 1 +ATOM 2813 H HE22 . GLN A 1 178 ? 25.537 35.567 -6.354 1.00 37.97 ? 177 GLN A HE22 1 +ATOM 2814 N N . LEU A 1 179 ? 22.378 34.364 -8.536 1.00 25.39 ? 178 LEU A N 1 +ATOM 2815 C CA . LEU A 1 179 ? 21.796 33.140 -7.995 1.00 24.21 ? 178 LEU A CA 1 +ATOM 2816 C C . LEU A 1 179 ? 21.982 33.075 -6.468 1.00 23.59 ? 178 LEU A C 1 +ATOM 2817 O O . LEU A 1 179 ? 23.007 33.515 -5.933 1.00 24.59 ? 178 LEU A O 1 +ATOM 2818 C CB . LEU A 1 179 ? 22.435 31.902 -8.644 1.00 24.86 ? 178 LEU A CB 1 +ATOM 2819 H H . LEU A 1 179 ? 23.193 34.274 -8.796 1.00 30.46 ? 178 LEU A H 1 +ATOM 2820 H HA . LEU A 1 179 ? 20.846 33.127 -8.186 1.00 29.05 ? 178 LEU A HA 1 +ATOM 2821 N N . ALA A 1 180 ? 20.995 32.504 -5.787 1.00 22.14 ? 179 ALA A N 1 +ATOM 2822 C CA . ALA A 1 180 ? 21.129 32.228 -4.365 1.00 21.69 ? 179 ALA A CA 1 +ATOM 2823 C C . ALA A 1 180 ? 20.602 30.829 -4.054 1.00 20.85 ? 179 ALA A C 1 +ATOM 2824 O O . ALA A 1 180 ? 19.417 30.552 -4.203 1.00 20.44 ? 179 ALA A O 1 +ATOM 2825 C CB . ALA A 1 180 ? 20.396 33.277 -3.558 1.00 28.57 ? 179 ALA A CB 1 +ATOM 2826 H H . ALA A 1 180 ? 20.240 32.268 -6.124 1.00 26.57 ? 179 ALA A H 1 +ATOM 2827 H HA . ALA A 1 180 ? 22.067 32.259 -4.120 1.00 26.03 ? 179 ALA A HA 1 +ATOM 2828 H HB1 . ALA A 1 180 ? 20.496 33.077 -2.614 1.00 34.28 ? 179 ALA A HB1 1 +ATOM 2829 H HB2 . ALA A 1 180 ? 20.776 34.148 -3.753 1.00 34.28 ? 179 ALA A HB2 1 +ATOM 2830 H HB3 . ALA A 1 180 ? 19.457 33.263 -3.801 1.00 34.28 ? 179 ALA A HB3 1 +ATOM 2831 N N . ASP A 1 181 ? 21.502 29.944 -3.645 1.00 21.75 ? 180 ASP A N 1 +ATOM 2832 C CA . ASP A 1 181 ? 21.141 28.584 -3.285 1.00 23.64 ? 180 ASP A CA 1 +ATOM 2833 C C . ASP A 1 181 ? 20.672 28.554 -1.846 1.00 20.43 ? 180 ASP A C 1 +ATOM 2834 O O . ASP A 1 181 ? 21.423 28.924 -0.948 1.00 21.06 ? 180 ASP A O 1 +ATOM 2835 C CB . ASP A 1 181 ? 22.353 27.666 -3.383 1.00 25.35 ? 180 ASP A CB 1 +ATOM 2836 C CG . ASP A 1 181 ? 22.528 27.073 -4.732 1.00 27.70 ? 180 ASP A CG 1 +ATOM 2837 O OD1 . ASP A 1 181 ? 21.567 27.054 -5.521 1.00 28.78 ? 180 ASP A OD1 1 +ATOM 2838 O OD2 . ASP A 1 181 ? 23.647 26.606 -5.005 1.00 25.94 ? 180 ASP A OD2 1 +ATOM 2839 H H . ASP A 1 181 ? 22.342 30.112 -3.567 1.00 26.10 ? 180 ASP A H 1 +ATOM 2840 H HA . ASP A 1 181 ? 20.436 28.254 -3.864 1.00 28.37 ? 180 ASP A HA 1 +ATOM 2841 H HB2 . ASP A 1 181 ? 23.151 28.175 -3.174 1.00 30.42 ? 180 ASP A HB2 1 +ATOM 2842 H HB3 . ASP A 1 181 ? 22.249 26.939 -2.749 1.00 30.42 ? 180 ASP A HB3 1 +ATOM 2843 N N . HIS A 1 182 ? 19.438 28.112 -1.643 1.00 18.99 ? 181 HIS A N 1 +ATOM 2844 C CA . HIS A 1 182 ? 18.868 27.989 -0.295 1.00 18.19 ? 181 HIS A CA 1 +ATOM 2845 C C . HIS A 1 182 ? 18.845 26.542 0.154 1.00 19.03 ? 181 HIS A C 1 +ATOM 2846 O O . HIS A 1 182 ? 18.310 25.669 -0.545 1.00 18.40 ? 181 HIS A O 1 +ATOM 2847 C CB . HIS A 1 182 ? 17.425 28.491 -0.272 1.00 17.71 ? 181 HIS A CB 1 +ATOM 2848 C CG . HIS A 1 182 ? 17.269 29.959 -0.518 1.00 17.79 ? 181 HIS A CG 1 +ATOM 2849 N ND1 . HIS A 1 182 ? 17.580 30.558 -1.720 1.00 17.09 ? 181 HIS A ND1 1 +ATOM 2850 C CD2 . HIS A 1 182 ? 16.779 30.943 0.278 1.00 15.88 ? 181 HIS A CD2 1 +ATOM 2851 C CE1 . HIS A 1 182 ? 17.309 31.850 -1.648 1.00 16.89 ? 181 HIS A CE1 1 +ATOM 2852 N NE2 . HIS A 1 182 ? 16.811 32.106 -0.450 1.00 17.12 ? 181 HIS A NE2 1 +ATOM 2853 H H . HIS A 1 182 ? 18.902 27.873 -2.271 1.00 22.79 ? 181 HIS A H 1 +ATOM 2854 H HA . HIS A 1 182 ? 19.392 28.507 0.335 1.00 21.83 ? 181 HIS A HA 1 +ATOM 2855 H HB2 . HIS A 1 182 ? 16.924 28.023 -0.958 1.00 21.25 ? 181 HIS A HB2 1 +ATOM 2856 H HB3 . HIS A 1 182 ? 17.045 28.297 0.599 1.00 21.25 ? 181 HIS A HB3 1 +ATOM 2857 H HD1 . HIS A 1 182 ? 17.907 30.155 -2.406 1.00 20.51 ? 181 HIS A HD1 1 +ATOM 2858 H HD2 . HIS A 1 182 ? 16.473 30.846 1.151 1.00 19.06 ? 181 HIS A HD2 1 +ATOM 2859 H HE1 . HIS A 1 182 ? 17.439 32.472 -2.327 1.00 20.27 ? 181 HIS A HE1 1 +ATOM 2860 H HE2 . HIS A 1 182 ? 16.568 32.880 -0.165 1.00 20.55 ? 181 HIS A HE2 1 +ATOM 2861 N N . TYR A 1 183 ? 19.410 26.284 1.333 1.00 18.91 ? 182 TYR A N 1 +ATOM 2862 C CA . TYR A 1 183 ? 19.297 24.992 1.986 1.00 19.02 ? 182 TYR A CA 1 +ATOM 2863 C C . TYR A 1 183 ? 18.682 25.197 3.368 1.00 18.34 ? 182 TYR A C 1 +ATOM 2864 O O . TYR A 1 183 ? 19.163 26.008 4.151 1.00 18.69 ? 182 TYR A O 1 +ATOM 2865 C CB . TYR A 1 183 ? 20.673 24.346 2.064 1.00 20.67 ? 182 TYR A CB 1 +ATOM 2866 C CG . TYR A 1 183 ? 21.256 24.169 0.669 1.00 21.36 ? 182 TYR A CG 1 +ATOM 2867 C CD1 . TYR A 1 183 ? 22.219 25.037 0.172 1.00 23.03 ? 182 TYR A CD1 1 +ATOM 2868 C CD2 . TYR A 1 183 ? 20.798 23.163 -0.150 1.00 22.16 ? 182 TYR A CD2 1 +ATOM 2869 C CE1 . TYR A 1 183 ? 22.727 24.870 -1.126 1.00 24.00 ? 182 TYR A CE1 1 +ATOM 2870 C CE2 . TYR A 1 183 ? 21.286 22.999 -1.418 1.00 27.01 ? 182 TYR A CE2 1 +ATOM 2871 C CZ . TYR A 1 183 ? 22.242 23.852 -1.894 1.00 22.71 ? 182 TYR A CZ 1 +ATOM 2872 O OH . TYR A 1 183 ? 22.679 23.660 -3.162 1.00 23.42 ? 182 TYR A OH 1 +ATOM 2873 H H . TYR A 1 183 ? 19.872 26.856 1.779 1.00 22.69 ? 182 TYR A H 1 +ATOM 2874 H HA . TYR A 1 183 ? 18.712 24.416 1.469 1.00 22.82 ? 182 TYR A HA 1 +ATOM 2875 H HB2 . TYR A 1 183 ? 21.268 24.913 2.577 1.00 24.80 ? 182 TYR A HB2 1 +ATOM 2876 H HB3 . TYR A 1 183 ? 20.596 23.472 2.478 1.00 24.80 ? 182 TYR A HB3 1 +ATOM 2877 H HD1 . TYR A 1 183 ? 22.538 25.728 0.706 1.00 27.64 ? 182 TYR A HD1 1 +ATOM 2878 H HD2 . TYR A 1 183 ? 20.145 22.581 0.165 1.00 26.59 ? 182 TYR A HD2 1 +ATOM 2879 H HE1 . TYR A 1 183 ? 23.373 25.450 -1.461 1.00 28.80 ? 182 TYR A HE1 1 +ATOM 2880 H HE2 . TYR A 1 183 ? 20.965 22.312 -1.956 1.00 32.41 ? 182 TYR A HE2 1 +ATOM 2881 H HH . TYR A 1 183 ? 23.254 24.240 -3.359 1.00 28.10 ? 182 TYR A HH 1 +ATOM 2882 N N . GLN A 1 184 ? 17.631 24.439 3.646 1.00 17.65 ? 183 GLN A N 1 +ATOM 2883 C CA . GLN A 1 184 ? 16.696 24.771 4.706 1.00 16.67 ? 183 GLN A CA 1 +ATOM 2884 C C . GLN A 1 184 ? 16.279 23.521 5.461 1.00 18.58 ? 183 GLN A C 1 +ATOM 2885 O O . GLN A 1 184 ? 16.183 22.422 4.891 1.00 18.56 ? 183 GLN A O 1 +ATOM 2886 C CB . GLN A 1 184 ? 15.486 25.452 4.067 1.00 15.23 ? 183 GLN A CB 1 +ATOM 2887 C CG . GLN A 1 184 ? 14.302 25.699 4.972 1.00 14.08 ? 183 GLN A CG 1 +ATOM 2888 C CD . GLN A 1 184 ? 13.079 26.210 4.220 1.00 16.93 ? 183 GLN A CD 1 +ATOM 2889 O OE1 . GLN A 1 184 ? 13.172 26.794 3.130 1.00 13.86 ? 183 GLN A OE1 1 +ATOM 2890 N NE2 . GLN A 1 184 ? 11.917 25.955 4.787 1.00 16.14 ? 183 GLN A NE2 1 +ATOM 2891 H H . GLN A 1 184 ? 17.437 23.713 3.227 1.00 21.18 ? 183 GLN A H 1 +ATOM 2892 H HA . GLN A 1 184 ? 17.110 25.389 5.329 1.00 20.01 ? 183 GLN A HA 1 +ATOM 2893 H HB2 . GLN A 1 184 ? 15.769 26.313 3.722 1.00 18.28 ? 183 GLN A HB2 1 +ATOM 2894 H HB3 . GLN A 1 184 ? 15.178 24.897 3.334 1.00 18.28 ? 183 GLN A HB3 1 +ATOM 2895 H HG2 . GLN A 1 184 ? 14.059 24.867 5.408 1.00 16.89 ? 183 GLN A HG2 1 +ATOM 2896 H HG3 . GLN A 1 184 ? 14.545 26.363 5.636 1.00 16.89 ? 183 GLN A HG3 1 +ATOM 2897 H HE21 . GLN A 1 184 ? 11.888 25.526 5.532 1.00 19.37 ? 183 GLN A HE21 1 +ATOM 2898 H HE22 . GLN A 1 184 ? 11.189 26.217 4.413 1.00 19.37 ? 183 GLN A HE22 1 +ATOM 2899 N N . GLN A 1 185 ? 16.062 23.695 6.759 1.00 16.95 ? 184 GLN A N 1 +ATOM 2900 C CA . GLN A 1 185 ? 15.635 22.618 7.640 1.00 20.26 ? 184 GLN A CA 1 +ATOM 2901 C C . GLN A 1 185 ? 14.533 23.168 8.534 1.00 19.92 ? 184 GLN A C 1 +ATOM 2902 O O . GLN A 1 185 ? 14.667 24.289 9.049 1.00 19.79 ? 184 GLN A O 1 +ATOM 2903 C CB . GLN A 1 185 ? 16.824 22.169 8.512 1.00 26.62 ? 184 GLN A CB 1 +ATOM 2904 C CG . GLN A 1 185 ? 17.133 20.698 8.425 1.00 40.92 ? 184 GLN A CG 1 +ATOM 2905 H H . GLN A 1 185 ? 16.158 24.449 7.163 1.00 20.34 ? 184 GLN A H 1 +ATOM 2906 H HA . GLN A 1 185 ? 15.299 21.866 7.128 1.00 24.31 ? 184 GLN A HA 1 +ATOM 2907 H HB2 . GLN A 1 185 ? 17.616 22.654 8.232 1.00 31.94 ? 184 GLN A HB2 1 +ATOM 2908 H HB3 . GLN A 1 185 ? 16.625 22.375 9.439 1.00 31.94 ? 184 GLN A HB3 1 +ATOM 2909 N N . ASN A 1 186 ? 13.464 22.402 8.743 1.00 16.43 ? 185 ASN A N 1 +ATOM 2910 C CA . ASN A 1 186 ? 12.403 22.816 9.652 1.00 14.41 ? 185 ASN A CA 1 +ATOM 2911 C C . ASN A 1 186 ? 12.170 21.693 10.646 1.00 15.09 ? 185 ASN A C 1 +ATOM 2912 O O . ASN A 1 186 ? 12.118 20.522 10.256 1.00 17.31 ? 185 ASN A O 1 +ATOM 2913 C CB . ASN A 1 186 ? 11.089 23.116 8.939 1.00 14.59 ? 185 ASN A CB 1 +ATOM 2914 C CG . ASN A 1 186 ? 11.172 24.316 7.984 1.00 16.08 ? 185 ASN A CG 1 +ATOM 2915 O OD1 . ASN A 1 186 ? 11.934 24.309 7.035 1.00 21.86 ? 185 ASN A OD1 1 +ATOM 2916 N ND2 . ASN A 1 186 ? 10.337 25.309 8.211 1.00 12.77 ? 185 ASN A ND2 1 +ATOM 2917 H H . ASN A 1 186 ? 13.331 21.638 8.370 1.00 19.71 ? 185 ASN A H 1 +ATOM 2918 H HA . ASN A 1 186 ? 12.681 23.608 10.138 1.00 17.29 ? 185 ASN A HA 1 +ATOM 2919 H HB2 . ASN A 1 186 ? 10.830 22.340 8.419 1.00 17.51 ? 185 ASN A HB2 1 +ATOM 2920 H HB3 . ASN A 1 186 ? 10.409 23.311 9.603 1.00 17.51 ? 185 ASN A HB3 1 +ATOM 2921 H HD21 . ASN A 1 186 ? 9.783 25.264 8.867 1.00 15.33 ? 185 ASN A HD21 1 +ATOM 2922 H HD22 . ASN A 1 186 ? 10.346 26.003 7.703 1.00 15.33 ? 185 ASN A HD22 1 +ATOM 2923 N N A THR A 1 187 ? 12.056 22.031 11.928 0.48 15.15 ? 186 THR A N 1 +ATOM 2924 N N B THR A 1 187 ? 11.996 22.067 11.908 0.52 14.91 ? 186 THR A N 1 +ATOM 2925 C CA A THR A 1 187 ? 11.800 21.038 12.982 0.48 18.76 ? 186 THR A CA 1 +ATOM 2926 C CA B THR A 1 187 ? 11.801 21.119 13.000 0.52 18.44 ? 186 THR A CA 1 +ATOM 2927 C C A THR A 1 187 ? 10.709 21.525 13.925 0.48 16.50 ? 186 THR A C 1 +ATOM 2928 C C B THR A 1 187 ? 10.604 21.578 13.827 0.52 15.85 ? 186 THR A C 1 +ATOM 2929 O O A THR A 1 187 ? 10.709 22.684 14.318 0.48 17.50 ? 186 THR A O 1 +ATOM 2930 O O B THR A 1 187 ? 10.411 22.772 14.018 0.52 14.48 ? 186 THR A O 1 +ATOM 2931 C CB A THR A 1 187 ? 13.059 20.716 13.829 0.48 23.81 ? 186 THR A CB 1 +ATOM 2932 C CB B THR A 1 187 ? 13.044 21.056 13.912 0.52 22.90 ? 186 THR A CB 1 +ATOM 2933 O OG1 A THR A 1 187 ? 13.786 21.917 14.113 0.48 17.70 ? 186 THR A OG1 1 +ATOM 2934 O OG1 B THR A 1 187 ? 14.229 20.922 13.114 0.52 25.55 ? 186 THR A OG1 1 +ATOM 2935 C CG2 A THR A 1 187 ? 13.963 19.738 13.102 0.48 18.76 ? 186 THR A CG2 1 +ATOM 2936 C CG2 B THR A 1 187 ? 12.942 19.876 14.877 0.52 26.39 ? 186 THR A CG2 1 +ATOM 2937 H H A THR A 1 187 ? 12.122 22.837 12.221 0.48 18.18 ? 186 THR A H 1 +ATOM 2938 H H B THR A 1 187 ? 11.987 22.888 12.164 0.52 17.89 ? 186 THR A H 1 +ATOM 2939 H HA A THR A 1 187 ? 11.496 20.213 12.571 0.48 22.51 ? 186 THR A HA 1 +ATOM 2940 H HA B THR A 1 187 ? 11.622 20.234 12.646 0.52 22.13 ? 186 THR A HA 1 +ATOM 2941 H HB A THR A 1 187 ? 12.784 20.307 14.664 0.48 28.57 ? 186 THR A HB 1 +ATOM 2942 H HB B THR A 1 187 ? 13.100 21.872 14.434 0.52 27.48 ? 186 THR A HB 1 +ATOM 2943 H HG1 A THR A 1 187 ? 13.301 22.451 14.542 0.48 21.24 ? 186 THR A HG1 1 +ATOM 2944 H HG1 B THR A 1 187 ? 14.303 21.580 12.597 0.52 30.66 ? 186 THR A HG1 1 +ATOM 2945 H HG21 A THR A 1 187 ? 14.745 19.546 13.642 0.48 22.52 ? 186 THR A HG21 1 +ATOM 2946 H HG21 B THR A 1 187 ? 13.727 19.845 15.446 0.52 31.67 ? 186 THR A HG21 1 +ATOM 2947 H HG22 A THR A 1 187 ? 13.486 18.911 12.931 0.48 22.52 ? 186 THR A HG22 1 +ATOM 2948 H HG22 B THR A 1 187 ? 12.153 19.971 15.433 0.52 31.67 ? 186 THR A HG22 1 +ATOM 2949 H HG23 A THR A 1 187 ? 14.249 20.117 12.256 0.48 22.52 ? 186 THR A HG23 1 +ATOM 2950 H HG23 B THR A 1 187 ? 12.880 19.046 14.379 0.52 31.67 ? 186 THR A HG23 1 +ATOM 2951 N N . PRO A 1 188 ? 9.777 20.639 14.303 1.00 15.07 ? 187 PRO A N 1 +ATOM 2952 C CA . PRO A 1 188 ? 8.683 21.099 15.159 1.00 14.77 ? 187 PRO A CA 1 +ATOM 2953 C C . PRO A 1 188 ? 9.185 21.584 16.544 1.00 15.07 ? 187 PRO A C 1 +ATOM 2954 O O . PRO A 1 188 ? 10.157 21.025 17.066 1.00 18.28 ? 187 PRO A O 1 +ATOM 2955 C CB . PRO A 1 188 ? 7.776 19.859 15.282 1.00 19.75 ? 187 PRO A CB 1 +ATOM 2956 C CG . PRO A 1 188 ? 8.546 18.732 14.815 1.00 24.73 ? 187 PRO A CG 1 +ATOM 2957 C CD . PRO A 1 188 ? 9.683 19.210 13.986 1.00 23.23 ? 187 PRO A CD 1 +ATOM 2958 H HA . PRO A 1 188 ? 8.193 21.814 14.725 1.00 17.73 ? 187 PRO A HA 1 +ATOM 2959 H HB2 . PRO A 1 188 ? 7.524 19.735 16.210 1.00 23.70 ? 187 PRO A HB2 1 +ATOM 2960 H HB3 . PRO A 1 188 ? 6.987 19.981 14.731 1.00 23.70 ? 187 PRO A HB3 1 +ATOM 2961 H HG2 . PRO A 1 188 ? 8.881 18.242 15.582 1.00 29.67 ? 187 PRO A HG2 1 +ATOM 2962 H HG3 . PRO A 1 188 ? 7.971 18.158 14.284 1.00 29.67 ? 187 PRO A HG3 1 +ATOM 2963 H HD2 . PRO A 1 188 ? 10.501 18.754 14.242 1.00 27.87 ? 187 PRO A HD2 1 +ATOM 2964 H HD3 . PRO A 1 188 ? 9.489 19.086 13.044 1.00 27.87 ? 187 PRO A HD3 1 +ATOM 2965 N N . ILE A 1 189 ? 8.538 22.615 17.071 1.00 23.61 ? 188 ILE A N 1 +ATOM 2966 C CA . ILE A 1 189 ? 8.810 23.107 18.431 1.00 24.90 ? 188 ILE A CA 1 +ATOM 2967 C C . ILE A 1 189 ? 8.140 22.237 19.475 1.00 27.65 ? 188 ILE A C 1 +ATOM 2968 O O . ILE A 1 189 ? 8.689 21.992 20.554 1.00 30.98 ? 188 ILE A O 1 +ATOM 2969 C CB . ILE A 1 189 ? 8.371 24.578 18.555 1.00 24.57 ? 188 ILE A CB 1 +ATOM 2970 C CG1 . ILE A 1 189 ? 9.369 25.433 17.785 1.00 23.49 ? 188 ILE A CG1 1 +ATOM 2971 C CG2 . ILE A 1 189 ? 8.321 25.037 20.031 1.00 26.11 ? 188 ILE A CG2 1 +ATOM 2972 C CD1 . ILE A 1 189 ? 8.922 26.825 17.458 1.00 22.87 ? 188 ILE A CD1 1 +ATOM 2973 H H . ILE A 1 189 ? 7.926 23.058 16.660 1.00 28.34 ? 188 ILE A H 1 +ATOM 2974 H HA . ILE A 1 189 ? 9.766 23.071 18.589 1.00 29.88 ? 188 ILE A HA 1 +ATOM 2975 H HB . ILE A 1 189 ? 7.491 24.682 18.160 1.00 29.49 ? 188 ILE A HB 1 +ATOM 2976 H HG12 . ILE A 1 189 ? 10.180 25.505 18.312 1.00 28.18 ? 188 ILE A HG12 1 +ATOM 2977 H HG13 . ILE A 1 189 ? 9.568 24.989 16.946 1.00 28.18 ? 188 ILE A HG13 1 +ATOM 2978 H HG21 . ILE A 1 189 ? 8.041 25.965 20.063 1.00 31.33 ? 188 ILE A HG21 1 +ATOM 2979 H HG22 . ILE A 1 189 ? 7.686 24.483 20.512 1.00 31.33 ? 188 ILE A HG22 1 +ATOM 2980 H HG23 . ILE A 1 189 ? 9.204 24.943 20.421 1.00 31.33 ? 188 ILE A HG23 1 +ATOM 2981 H HD11 . ILE A 1 189 ? 9.629 27.277 16.971 1.00 27.44 ? 188 ILE A HD11 1 +ATOM 2982 H HD12 . ILE A 1 189 ? 8.121 26.780 16.914 1.00 27.44 ? 188 ILE A HD12 1 +ATOM 2983 H HD13 . ILE A 1 189 ? 8.735 27.298 18.285 1.00 27.44 ? 188 ILE A HD13 1 +ATOM 2984 N N . GLY A 1 190 ? 6.947 21.756 19.160 1.00 26.63 ? 189 GLY A N 1 +ATOM 2985 C CA . GLY A 1 190 ? 6.208 20.903 20.072 1.00 33.97 ? 189 GLY A CA 1 +ATOM 2986 C C . GLY A 1 190 ? 6.592 19.447 19.917 1.00 33.00 ? 189 GLY A C 1 +ATOM 2987 O O . GLY A 1 190 ? 7.313 19.087 18.992 1.00 32.93 ? 189 GLY A O 1 +ATOM 2988 H H . GLY A 1 190 ? 6.542 21.910 18.417 1.00 31.96 ? 189 GLY A H 1 +ATOM 2989 H HA2 . GLY A 1 190 ? 6.385 21.174 20.986 1.00 40.76 ? 189 GLY A HA2 1 +ATOM 2990 H HA3 . GLY A 1 190 ? 5.257 20.992 19.902 1.00 40.76 ? 189 GLY A HA3 1 +ATOM 2991 N N A ASP A 1 191 ? 6.114 18.605 20.824 0.58 40.93 ? 190 ASP A N 1 +ATOM 2992 N N B ASP A 1 191 ? 6.082 18.619 20.826 0.42 40.42 ? 190 ASP A N 1 +ATOM 2993 C CA A ASP A 1 191 ? 6.440 17.184 20.789 0.58 42.58 ? 190 ASP A CA 1 +ATOM 2994 C CA B ASP A 1 191 ? 6.396 17.195 20.866 0.42 42.07 ? 190 ASP A CA 1 +ATOM 2995 C C A ASP A 1 191 ? 5.380 16.397 20.015 0.58 42.32 ? 190 ASP A C 1 +ATOM 2996 C C B ASP A 1 191 ? 5.239 16.350 20.334 0.42 43.13 ? 190 ASP A C 1 +ATOM 2997 O O A ASP A 1 191 ? 5.624 15.262 19.612 0.58 43.44 ? 190 ASP A O 1 +ATOM 2998 O O B ASP A 1 191 ? 5.265 15.125 20.438 0.42 43.42 ? 190 ASP A O 1 +ATOM 2999 C CB A ASP A 1 191 ? 6.572 16.627 22.215 0.58 42.84 ? 190 ASP A CB 1 +ATOM 3000 C CB B ASP A 1 191 ? 6.720 16.765 22.303 0.42 42.18 ? 190 ASP A CB 1 +ATOM 3001 C CG A ASP A 1 191 ? 7.682 17.298 23.012 0.58 41.57 ? 190 ASP A CG 1 +ATOM 3002 C CG B ASP A 1 191 ? 5.473 16.464 23.126 0.42 45.59 ? 190 ASP A CG 1 +ATOM 3003 O OD1 A ASP A 1 191 ? 8.726 17.651 22.418 0.58 48.66 ? 190 ASP A OD1 1 +ATOM 3004 O OD1 B ASP A 1 191 ? 4.438 17.146 22.942 0.42 36.91 ? 190 ASP A OD1 1 +ATOM 3005 O OD2 A ASP A 1 191 ? 7.508 17.469 24.237 0.58 46.23 ? 190 ASP A OD2 1 +ATOM 3006 O OD2 B ASP A 1 191 ? 5.536 15.540 23.969 0.42 53.18 ? 190 ASP A OD2 1 +ATOM 3007 H H A ASP A 1 191 ? 5.597 18.831 21.473 0.58 49.11 ? 190 ASP A H 1 +ATOM 3008 H H B ASP A 1 191 ? 5.539 18.867 21.446 0.42 48.50 ? 190 ASP A H 1 +ATOM 3009 H HA A ASP A 1 191 ? 7.291 17.065 20.339 0.58 51.09 ? 190 ASP A HA 1 +ATOM 3010 H HA B ASP A 1 191 ? 7.175 17.024 20.314 0.42 50.48 ? 190 ASP A HA 1 +ATOM 3011 H HB2 A ASP A 1 191 ? 5.736 16.767 22.688 0.58 51.41 ? 190 ASP A HB2 1 +ATOM 3012 H HB2 B ASP A 1 191 ? 7.263 15.961 22.277 0.42 50.61 ? 190 ASP A HB2 1 +ATOM 3013 H HB3 A ASP A 1 191 ? 6.769 15.678 22.166 0.58 51.41 ? 190 ASP A HB3 1 +ATOM 3014 H HB3 B ASP A 1 191 ? 7.205 17.479 22.744 0.42 50.61 ? 190 ASP A HB3 1 +ATOM 3015 N N . GLY A 1 192 ? 4.218 17.012 19.795 1.00 44.03 ? 191 GLY A N 1 +ATOM 3016 C CA . GLY A 1 192 ? 3.080 16.326 19.203 1.00 43.26 ? 191 GLY A CA 1 +ATOM 3017 C C . GLY A 1 192 ? 3.362 15.877 17.771 1.00 38.74 ? 191 GLY A C 1 +ATOM 3018 O O . GLY A 1 192 ? 4.367 16.293 17.193 1.00 35.92 ? 191 GLY A O 1 +ATOM 3019 H H A GLY A 1 192 ? 4.066 17.837 19.984 0.58 52.84 ? 191 GLY A H 1 +ATOM 3020 H H B GLY A 1 192 ? 4.163 17.870 19.761 0.42 52.84 ? 191 GLY A H 1 +ATOM 3021 H HA2 . GLY A 1 192 ? 2.861 15.544 19.733 1.00 51.91 ? 191 GLY A HA2 1 +ATOM 3022 H HA3 . GLY A 1 192 ? 2.312 16.918 19.195 1.00 51.91 ? 191 GLY A HA3 1 +ATOM 3023 N N . PRO A 1 193 ? 2.496 15.010 17.209 1.00 38.02 ? 192 PRO A N 1 +ATOM 3024 C CA . PRO A 1 193 ? 2.686 14.452 15.853 1.00 34.12 ? 192 PRO A CA 1 +ATOM 3025 C C . PRO A 1 193 ? 2.602 15.511 14.764 1.00 29.08 ? 192 PRO A C 1 +ATOM 3026 O O . PRO A 1 193 ? 1.874 16.496 14.907 1.00 31.55 ? 192 PRO A O 1 +ATOM 3027 C CB . PRO A 1 193 ? 1.531 13.454 15.711 1.00 38.93 ? 192 PRO A CB 1 +ATOM 3028 C CG . PRO A 1 193 ? 0.504 13.895 16.713 1.00 44.73 ? 192 PRO A CG 1 +ATOM 3029 C CD . PRO A 1 193 ? 1.264 14.510 17.845 1.00 37.69 ? 192 PRO A CD 1 +ATOM 3030 H HA . PRO A 1 193 ? 3.532 13.983 15.790 1.00 40.94 ? 192 PRO A HA 1 +ATOM 3031 H HB2 . PRO A 1 193 ? 1.172 13.497 14.811 1.00 46.71 ? 192 PRO A HB2 1 +ATOM 3032 H HB3 . PRO A 1 193 ? 1.846 12.559 15.913 1.00 46.71 ? 192 PRO A HB3 1 +ATOM 3033 H HG2 . PRO A 1 193 ? -0.087 14.547 16.306 1.00 53.67 ? 192 PRO A HG2 1 +ATOM 3034 H HG3 . PRO A 1 193 ? 0.001 13.125 17.021 1.00 53.67 ? 192 PRO A HG3 1 +ATOM 3035 H HD2 . PRO A 1 193 ? 0.760 15.245 18.229 1.00 45.23 ? 192 PRO A HD2 1 +ATOM 3036 H HD3 . PRO A 1 193 ? 1.477 13.840 18.512 1.00 45.23 ? 192 PRO A HD3 1 +ATOM 3037 N N . VAL A 1 194 ? 3.353 15.308 13.685 1.00 25.54 ? 193 VAL A N 1 +ATOM 3038 C CA . VAL A 1 194 ? 3.312 16.219 12.550 1.00 23.04 ? 193 VAL A CA 1 +ATOM 3039 C C . VAL A 1 194 ? 3.193 15.387 11.291 1.00 22.41 ? 193 VAL A C 1 +ATOM 3040 O O . VAL A 1 194 ? 3.371 14.170 11.327 1.00 23.24 ? 193 VAL A O 1 +ATOM 3041 C CB . VAL A 1 194 ? 4.566 17.100 12.431 1.00 25.20 ? 193 VAL A CB 1 +ATOM 3042 C CG1 . VAL A 1 194 ? 4.759 17.945 13.693 1.00 24.45 ? 193 VAL A CG1 1 +ATOM 3043 C CG2 . VAL A 1 194 ? 5.813 16.243 12.114 1.00 24.00 ? 193 VAL A CG2 1 +ATOM 3044 H H . VAL A 1 194 ? 3.895 14.648 13.587 1.00 30.65 ? 193 VAL A H 1 +ATOM 3045 H HA . VAL A 1 194 ? 2.534 16.793 12.619 1.00 27.65 ? 193 VAL A HA 1 +ATOM 3046 H HB . VAL A 1 194 ? 4.440 17.712 11.689 1.00 30.24 ? 193 VAL A HB 1 +ATOM 3047 H HG11 . VAL A 1 194 ? 5.556 18.489 13.589 1.00 29.35 ? 193 VAL A HG11 1 +ATOM 3048 H HG12 . VAL A 1 194 ? 3.983 18.514 13.813 1.00 29.35 ? 193 VAL A HG12 1 +ATOM 3049 H HG13 . VAL A 1 194 ? 4.859 17.355 14.456 1.00 29.35 ? 193 VAL A HG13 1 +ATOM 3050 H HG21 . VAL A 1 194 ? 6.586 16.824 12.045 1.00 28.80 ? 193 VAL A HG21 1 +ATOM 3051 H HG22 . VAL A 1 194 ? 5.945 15.601 12.830 1.00 28.80 ? 193 VAL A HG22 1 +ATOM 3052 H HG23 . VAL A 1 194 ? 5.672 15.778 11.275 1.00 28.80 ? 193 VAL A HG23 1 +ATOM 3053 N N . LEU A 1 195 ? 2.857 16.049 10.190 1.00 20.99 ? 194 LEU A N 1 +ATOM 3054 C CA . LEU A 1 195 ? 2.717 15.350 8.930 1.00 20.37 ? 194 LEU A CA 1 +ATOM 3055 C C . LEU A 1 195 ? 4.084 15.346 8.269 1.00 19.53 ? 194 LEU A C 1 +ATOM 3056 O O . LEU A 1 195 ? 4.664 16.401 8.036 1.00 19.47 ? 194 LEU A O 1 +ATOM 3057 C CB . LEU A 1 195 ? 1.676 16.052 8.044 1.00 19.49 ? 194 LEU A CB 1 +ATOM 3058 C CG . LEU A 1 195 ? 0.223 15.923 8.508 1.00 20.44 ? 194 LEU A CG 1 +ATOM 3059 C CD1 . LEU A 1 195 ? -0.668 16.797 7.631 1.00 23.15 ? 194 LEU A CD1 1 +ATOM 3060 C CD2 . LEU A 1 195 ? -0.270 14.482 8.472 1.00 26.39 ? 194 LEU A CD2 1 +ATOM 3061 H H . LEU A 1 195 ? 2.707 16.895 10.150 1.00 25.19 ? 194 LEU A H 1 +ATOM 3062 H HA . LEU A 1 195 ? 2.437 14.434 9.085 1.00 24.44 ? 194 LEU A HA 1 +ATOM 3063 H HB2 . LEU A 1 195 ? 1.888 16.998 8.013 1.00 23.39 ? 194 LEU A HB2 1 +ATOM 3064 H HB3 . LEU A 1 195 ? 1.731 15.678 7.151 1.00 23.39 ? 194 LEU A HB3 1 +ATOM 3065 H HG . LEU A 1 195 ? 0.152 16.243 9.421 1.00 24.53 ? 194 LEU A HG 1 +ATOM 3066 H HD11 . LEU A 1 195 ? -1.587 16.710 7.930 1.00 27.78 ? 194 LEU A HD11 1 +ATOM 3067 H HD12 . LEU A 1 195 ? -0.380 17.720 7.709 1.00 27.78 ? 194 LEU A HD12 1 +ATOM 3068 H HD13 . LEU A 1 195 ? -0.590 16.502 6.710 1.00 27.78 ? 194 LEU A HD13 1 +ATOM 3069 H HD21 . LEU A 1 195 ? -1.191 14.457 8.774 1.00 31.67 ? 194 LEU A HD21 1 +ATOM 3070 H HD22 . LEU A 1 195 ? -0.210 14.151 7.563 1.00 31.67 ? 194 LEU A HD22 1 +ATOM 3071 H HD23 . LEU A 1 195 ? 0.286 13.944 9.058 1.00 31.67 ? 194 LEU A HD23 1 +ATOM 3072 N N . LEU A 1 196 ? 4.613 14.162 7.989 1.00 19.99 ? 195 LEU A N 1 +ATOM 3073 C CA . LEU A 1 196 ? 5.886 14.057 7.279 1.00 19.35 ? 195 LEU A CA 1 +ATOM 3074 C C . LEU A 1 196 ? 5.608 13.790 5.804 1.00 18.46 ? 195 LEU A C 1 +ATOM 3075 O O . LEU A 1 196 ? 5.029 12.765 5.464 1.00 19.00 ? 195 LEU A O 1 +ATOM 3076 C CB . LEU A 1 196 ? 6.716 12.924 7.863 1.00 20.58 ? 195 LEU A CB 1 +ATOM 3077 C CG . LEU A 1 196 ? 7.140 13.164 9.319 1.00 21.59 ? 195 LEU A CG 1 +ATOM 3078 C CD1 . LEU A 1 196 ? 7.839 11.927 9.843 1.00 27.32 ? 195 LEU A CD1 1 +ATOM 3079 C CD2 . LEU A 1 196 ? 8.039 14.399 9.439 1.00 20.78 ? 195 LEU A CD2 1 +ATOM 3080 H H . LEU A 1 196 ? 4.259 13.406 8.196 1.00 23.99 ? 195 LEU A H 1 +ATOM 3081 H HA . LEU A 1 196 ? 6.381 14.887 7.362 1.00 23.23 ? 195 LEU A HA 1 +ATOM 3082 H HB2 . LEU A 1 196 ? 6.194 12.107 7.836 1.00 24.70 ? 195 LEU A HB2 1 +ATOM 3083 H HB3 . LEU A 1 196 ? 7.521 12.819 7.332 1.00 24.70 ? 195 LEU A HB3 1 +ATOM 3084 H HG . LEU A 1 196 ? 6.348 13.314 9.859 1.00 25.91 ? 195 LEU A HG 1 +ATOM 3085 H HD11 . LEU A 1 196 ? 8.106 12.082 10.762 1.00 32.78 ? 195 LEU A HD11 1 +ATOM 3086 H HD12 . LEU A 1 196 ? 7.228 11.176 9.797 1.00 32.78 ? 195 LEU A HD12 1 +ATOM 3087 H HD13 . LEU A 1 196 ? 8.621 11.752 9.296 1.00 32.78 ? 195 LEU A HD13 1 +ATOM 3088 H HD21 . LEU A 1 196 ? 8.287 14.519 10.369 1.00 24.94 ? 195 LEU A HD21 1 +ATOM 3089 H HD22 . LEU A 1 196 ? 8.834 14.263 8.899 1.00 24.94 ? 195 LEU A HD22 1 +ATOM 3090 H HD23 . LEU A 1 196 ? 7.552 15.176 9.122 1.00 24.94 ? 195 LEU A HD23 1 +ATOM 3091 N N . PRO A 1 197 ? 6.018 14.707 4.932 1.00 17.21 ? 196 PRO A N 1 +ATOM 3092 C CA . PRO A 1 197 ? 5.429 14.614 3.590 1.00 16.44 ? 196 PRO A CA 1 +ATOM 3093 C C . PRO A 1 197 ? 6.189 13.708 2.607 1.00 16.38 ? 196 PRO A C 1 +ATOM 3094 O O . PRO A 1 197 ? 7.369 13.471 2.797 1.00 16.64 ? 196 PRO A O 1 +ATOM 3095 C CB . PRO A 1 197 ? 5.516 16.043 3.098 1.00 15.29 ? 196 PRO A CB 1 +ATOM 3096 C CG . PRO A 1 197 ? 6.772 16.579 3.748 1.00 16.59 ? 196 PRO A CG 1 +ATOM 3097 C CD . PRO A 1 197 ? 6.809 15.938 5.114 1.00 16.54 ? 196 PRO A CD 1 +ATOM 3098 H HA . PRO A 1 197 ? 4.499 14.341 3.640 1.00 19.73 ? 196 PRO A HA 1 +ATOM 3099 H HB2 . PRO A 1 197 ? 5.595 16.055 2.131 1.00 18.34 ? 196 PRO A HB2 1 +ATOM 3100 H HB3 . PRO A 1 197 ? 4.736 16.541 3.389 1.00 18.34 ? 196 PRO A HB3 1 +ATOM 3101 H HG2 . PRO A 1 197 ? 7.547 16.320 3.226 1.00 19.91 ? 196 PRO A HG2 1 +ATOM 3102 H HG3 . PRO A 1 197 ? 6.715 17.545 3.823 1.00 19.91 ? 196 PRO A HG3 1 +ATOM 3103 H HD2 . PRO A 1 197 ? 7.721 15.721 5.361 1.00 19.85 ? 196 PRO A HD2 1 +ATOM 3104 H HD3 . PRO A 1 197 ? 6.390 16.516 5.770 1.00 19.85 ? 196 PRO A HD3 1 +ATOM 3105 N N . ASP A 1 198 ? 5.511 13.219 1.572 1.00 16.14 ? 197 ASP A N 1 +ATOM 3106 C CA . ASP A 1 198 ? 6.186 12.735 0.370 1.00 15.80 ? 197 ASP A CA 1 +ATOM 3107 C C . ASP A 1 198 ? 6.865 13.925 -0.307 1.00 14.67 ? 197 ASP A C 1 +ATOM 3108 O O . ASP A 1 198 ? 6.520 15.098 -0.050 1.00 14.09 ? 197 ASP A O 1 +ATOM 3109 C CB . ASP A 1 198 ? 5.180 12.066 -0.599 1.00 15.82 ? 197 ASP A CB 1 +ATOM 3110 C CG . ASP A 1 198 ? 4.619 10.755 -0.057 1.00 20.43 ? 197 ASP A CG 1 +ATOM 3111 O OD1 . ASP A 1 198 ? 5.125 10.243 0.960 1.00 22.36 ? 197 ASP A OD1 1 +ATOM 3112 O OD2 . ASP A 1 198 ? 3.672 10.226 -0.658 1.00 25.23 ? 197 ASP A OD2 1 +ATOM 3113 H H . ASP A 1 198 ? 4.653 13.156 1.540 1.00 19.37 ? 197 ASP A H 1 +ATOM 3114 H HA . ASP A 1 198 ? 6.864 12.086 0.614 1.00 18.96 ? 197 ASP A HA 1 +ATOM 3115 H HB2 . ASP A 1 198 ? 4.436 12.671 -0.749 1.00 18.99 ? 197 ASP A HB2 1 +ATOM 3116 H HB3 . ASP A 1 198 ? 5.628 11.877 -1.438 1.00 18.99 ? 197 ASP A HB3 1 +ATOM 3117 N N . ASN A 1 199 ? 7.831 13.641 -1.181 1.00 14.49 ? 198 ASN A N 1 +ATOM 3118 C CA . ASN A 1 199 ? 8.519 14.689 -1.924 1.00 13.60 ? 198 ASN A CA 1 +ATOM 3119 C C . ASN A 1 199 ? 7.534 15.473 -2.789 1.00 12.77 ? 198 ASN A C 1 +ATOM 3120 O O . ASN A 1 199 ? 6.680 14.903 -3.454 1.00 12.81 ? 198 ASN A O 1 +ATOM 3121 C CB . ASN A 1 199 ? 9.644 14.112 -2.799 1.00 13.76 ? 198 ASN A CB 1 +ATOM 3122 C CG . ASN A 1 199 ? 10.817 13.586 -2.001 1.00 23.00 ? 198 ASN A CG 1 +ATOM 3123 O OD1 . ASN A 1 199 ? 10.786 13.477 -0.756 1.00 15.18 ? 198 ASN A OD1 1 +ATOM 3124 N ND2 . ASN A 1 199 ? 11.887 13.262 -2.721 1.00 18.20 ? 198 ASN A ND2 1 +ATOM 3125 H H . ASN A 1 199 ? 8.106 12.846 -1.360 1.00 17.39 ? 198 ASN A H 1 +ATOM 3126 H HA . ASN A 1 199 ? 8.920 15.308 -1.294 1.00 16.32 ? 198 ASN A HA 1 +ATOM 3127 H HB2 . ASN A 1 199 ? 9.289 13.379 -3.325 1.00 16.51 ? 198 ASN A HB2 1 +ATOM 3128 H HB3 . ASN A 1 199 ? 9.974 14.810 -3.387 1.00 16.51 ? 198 ASN A HB3 1 +ATOM 3129 H HD21 . ASN A 1 199 ? 11.876 13.360 -3.575 1.00 21.84 ? 198 ASN A HD21 1 +ATOM 3130 H HD22 . ASN A 1 199 ? 12.590 12.956 -2.332 1.00 21.84 ? 198 ASN A HD22 1 +ATOM 3131 N N . HIS A 1 200 ? 7.631 16.800 -2.720 1.00 12.14 ? 199 HIS A N 1 +ATOM 3132 C CA . HIS A 1 200 ? 6.763 17.686 -3.484 1.00 11.86 ? 199 HIS A CA 1 +ATOM 3133 C C . HIS A 1 200 ? 7.451 19.045 -3.519 1.00 11.44 ? 199 HIS A C 1 +ATOM 3134 O O . HIS A 1 200 ? 8.612 19.177 -3.077 1.00 11.45 ? 199 HIS A O 1 +ATOM 3135 C CB . HIS A 1 200 ? 5.344 17.725 -2.860 1.00 11.68 ? 199 HIS A CB 1 +ATOM 3136 C CG . HIS A 1 200 ? 5.288 18.384 -1.514 1.00 11.92 ? 199 HIS A CG 1 +ATOM 3137 N ND1 . HIS A 1 200 ? 5.701 17.749 -0.359 1.00 12.64 ? 199 HIS A ND1 1 +ATOM 3138 C CD2 . HIS A 1 200 ? 4.909 19.631 -1.145 1.00 11.84 ? 199 HIS A CD2 1 +ATOM 3139 C CE1 . HIS A 1 200 ? 5.569 18.575 0.666 1.00 16.61 ? 199 HIS A CE1 1 +ATOM 3140 N NE2 . HIS A 1 200 ? 5.078 19.719 0.221 1.00 14.19 ? 199 HIS A NE2 1 +ATOM 3141 H H . HIS A 1 200 ? 8.203 17.215 -2.229 1.00 14.57 ? 199 HIS A H 1 +ATOM 3142 H HA . HIS A 1 200 ? 6.688 17.358 -4.394 1.00 14.24 ? 199 HIS A HA 1 +ATOM 3143 H HB2 . HIS A 1 200 ? 4.756 18.216 -3.455 1.00 14.02 ? 199 HIS A HB2 1 +ATOM 3144 H HB3 . HIS A 1 200 ? 5.023 16.815 -2.759 1.00 14.02 ? 199 HIS A HB3 1 +ATOM 3145 H HD1 . HIS A 1 200 ? 6.001 16.944 -0.314 1.00 15.17 ? 199 HIS A HD1 1 +ATOM 3146 H HD2 . HIS A 1 200 ? 4.581 20.297 -1.705 1.00 14.21 ? 199 HIS A HD2 1 +ATOM 3147 H HE1 . HIS A 1 200 ? 5.768 18.377 1.553 1.00 19.93 ? 199 HIS A HE1 1 +ATOM 3148 H HE2 . HIS A 1 200 ? 4.905 20.410 0.702 1.00 17.02 ? 199 HIS A HE2 1 +ATOM 3149 N N . TYR A 1 201 ? 6.777 20.054 -4.038 1.00 10.62 ? 200 TYR A N 1 +ATOM 3150 C CA . TYR A 1 201 ? 7.337 21.388 -4.051 1.00 10.29 ? 200 TYR A CA 1 +ATOM 3151 C C . TYR A 1 201 ? 6.247 22.453 -3.960 1.00 14.27 ? 200 TYR A C 1 +ATOM 3152 O O . TYR A 1 201 ? 5.061 22.150 -4.073 1.00 12.70 ? 200 TYR A O 1 +ATOM 3153 C CB . TYR A 1 201 ? 8.195 21.594 -5.279 1.00 12.11 ? 200 TYR A CB 1 +ATOM 3154 C CG . TYR A 1 201 ? 7.430 21.444 -6.525 1.00 12.32 ? 200 TYR A CG 1 +ATOM 3155 C CD1 . TYR A 1 201 ? 7.400 20.249 -7.189 1.00 13.01 ? 200 TYR A CD1 1 +ATOM 3156 C CD2 . TYR A 1 201 ? 6.719 22.511 -7.037 1.00 19.75 ? 200 TYR A CD2 1 +ATOM 3157 C CE1 . TYR A 1 201 ? 6.671 20.113 -8.376 1.00 16.96 ? 200 TYR A CE1 1 +ATOM 3158 C CE2 . TYR A 1 201 ? 5.998 22.391 -8.180 1.00 28.79 ? 200 TYR A CE2 1 +ATOM 3159 C CZ . TYR A 1 201 ? 5.973 21.189 -8.851 1.00 26.28 ? 200 TYR A CZ 1 +ATOM 3160 O OH . TYR A 1 201 ? 5.242 21.102 -10.007 1.00 32.34 ? 200 TYR A OH 1 +ATOM 3161 H H . TYR A 1 201 ? 5.994 19.993 -4.388 1.00 12.75 ? 200 TYR A H 1 +ATOM 3162 H HA . TYR A 1 201 ? 7.910 21.489 -3.275 1.00 12.35 ? 200 TYR A HA 1 +ATOM 3163 H HB2 . TYR A 1 201 ? 8.567 22.489 -5.260 1.00 14.53 ? 200 TYR A HB2 1 +ATOM 3164 H HB3 . TYR A 1 201 ? 8.908 20.936 -5.283 1.00 14.53 ? 200 TYR A HB3 1 +ATOM 3165 H HD1 . TYR A 1 201 ? 7.877 19.524 -6.855 1.00 15.62 ? 200 TYR A HD1 1 +ATOM 3166 H HD2 . TYR A 1 201 ? 6.730 23.325 -6.587 1.00 23.70 ? 200 TYR A HD2 1 +ATOM 3167 H HE1 . TYR A 1 201 ? 6.651 19.300 -8.828 1.00 20.35 ? 200 TYR A HE1 1 +ATOM 3168 H HE2 . TYR A 1 201 ? 5.527 23.121 -8.512 1.00 34.55 ? 200 TYR A HE2 1 +ATOM 3169 H HH . TYR A 1 201 ? 4.872 21.838 -10.169 1.00 38.81 ? 200 TYR A HH 1 +ATOM 3170 N N . LEU A 1 202 ? 6.672 23.685 -3.709 1.00 10.70 ? 201 LEU A N 1 +ATOM 3171 C CA . LEU A 1 202 ? 5.782 24.847 -3.730 1.00 12.05 ? 201 LEU A CA 1 +ATOM 3172 C C . LEU A 1 202 ? 6.194 25.728 -4.902 1.00 11.30 ? 201 LEU A C 1 +ATOM 3173 O O . LEU A 1 202 ? 7.385 25.931 -5.108 1.00 11.86 ? 201 LEU A O 1 +ATOM 3174 C CB . LEU A 1 202 ? 5.949 25.666 -2.455 1.00 12.16 ? 201 LEU A CB 1 +ATOM 3175 C CG . LEU A 1 202 ? 5.925 24.901 -1.130 1.00 11.03 ? 201 LEU A CG 1 +ATOM 3176 C CD1 . LEU A 1 202 ? 6.193 25.826 0.052 1.00 13.90 ? 201 LEU A CD1 1 +ATOM 3177 C CD2 . LEU A 1 202 ? 4.593 24.123 -0.971 1.00 13.80 ? 201 LEU A CD2 1 +ATOM 3178 H H . LEU A 1 202 ? 7.488 23.881 -3.521 1.00 12.84 ? 201 LEU A H 1 +ATOM 3179 H HA . LEU A 1 202 ? 4.857 24.574 -3.830 1.00 14.46 ? 201 LEU A HA 1 +ATOM 3180 H HB2 . LEU A 1 202 ? 6.801 26.128 -2.503 1.00 14.59 ? 201 LEU A HB2 1 +ATOM 3181 H HB3 . LEU A 1 202 ? 5.233 26.319 -2.421 1.00 14.59 ? 201 LEU A HB3 1 +ATOM 3182 H HG . LEU A 1 202 ? 6.639 24.245 -1.146 1.00 13.24 ? 201 LEU A HG 1 +ATOM 3183 H HD11 . LEU A 1 202 ? 6.170 25.307 0.871 1.00 16.68 ? 201 LEU A HD11 1 +ATOM 3184 H HD12 . LEU A 1 202 ? 7.067 26.233 -0.058 1.00 16.68 ? 201 LEU A HD12 1 +ATOM 3185 H HD13 . LEU A 1 202 ? 5.509 26.513 0.076 1.00 16.68 ? 201 LEU A HD13 1 +ATOM 3186 H HD21 . LEU A 1 202 ? 4.603 23.649 -0.125 1.00 16.56 ? 201 LEU A HD21 1 +ATOM 3187 H HD22 . LEU A 1 202 ? 3.856 24.754 -0.988 1.00 16.56 ? 201 LEU A HD22 1 +ATOM 3188 H HD23 . LEU A 1 202 ? 4.507 23.493 -1.703 1.00 16.56 ? 201 LEU A HD23 1 +ATOM 3189 N N . HIS A 1 203 ? 5.211 26.230 -5.648 1.00 10.24 ? 202 HIS A N 1 +ATOM 3190 C CA . HIS A 1 203 ? 5.416 27.305 -6.616 1.00 14.79 ? 202 HIS A CA 1 +ATOM 3191 C C . HIS A 1 203 ? 5.248 28.629 -5.884 1.00 12.69 ? 202 HIS A C 1 +ATOM 3192 O O . HIS A 1 203 ? 4.247 28.826 -5.183 1.00 17.13 ? 202 HIS A O 1 +ATOM 3193 C CB . HIS A 1 203 ? 4.320 27.311 -7.653 1.00 18.33 ? 202 HIS A CB 1 +ATOM 3194 C CG . HIS A 1 203 ? 4.336 26.151 -8.588 1.00 21.16 ? 202 HIS A CG 1 +ATOM 3195 N ND1 . HIS A 1 203 ? 5.370 25.923 -9.467 1.00 26.58 ? 202 HIS A ND1 1 +ATOM 3196 C CD2 . HIS A 1 203 ? 3.404 25.198 -8.837 1.00 25.61 ? 202 HIS A CD2 1 +ATOM 3197 C CE1 . HIS A 1 203 ? 5.091 24.855 -10.196 1.00 26.73 ? 202 HIS A CE1 1 +ATOM 3198 N NE2 . HIS A 1 203 ? 3.904 24.399 -9.835 1.00 23.09 ? 202 HIS A NE2 1 +ATOM 3199 H H . HIS A 1 203 ? 4.396 25.957 -5.610 1.00 12.29 ? 202 HIS A H 1 +ATOM 3200 H HA . HIS A 1 203 ? 6.289 27.252 -7.037 1.00 17.75 ? 202 HIS A HA 1 +ATOM 3201 H HB2 . HIS A 1 203 ? 3.463 27.308 -7.197 1.00 22.00 ? 202 HIS A HB2 1 +ATOM 3202 H HB3 . HIS A 1 203 ? 4.402 28.117 -8.185 1.00 22.00 ? 202 HIS A HB3 1 +ATOM 3203 H HD1 . HIS A 1 203 ? 6.088 26.392 -9.524 1.00 31.90 ? 202 HIS A HD1 1 +ATOM 3204 H HD2 . HIS A 1 203 ? 2.587 25.098 -8.405 1.00 30.74 ? 202 HIS A HD2 1 +ATOM 3205 H HE1 . HIS A 1 203 ? 5.638 24.487 -10.852 1.00 32.08 ? 202 HIS A HE1 1 +ATOM 3206 H HE2 . HIS A 1 203 ? 3.511 23.708 -10.166 1.00 27.71 ? 202 HIS A HE2 1 +ATOM 3207 N N . THR A 1 204 ? 6.168 29.557 -6.107 1.00 13.16 ? 203 THR A N 1 +ATOM 3208 C CA . THR A 1 204 ? 6.048 30.887 -5.531 1.00 11.03 ? 203 THR A CA 1 +ATOM 3209 C C . THR A 1 204 ? 6.041 31.923 -6.619 1.00 13.10 ? 203 THR A C 1 +ATOM 3210 O O . THR A 1 204 ? 6.624 31.720 -7.695 1.00 15.69 ? 203 THR A O 1 +ATOM 3211 C CB . THR A 1 204 ? 7.247 31.168 -4.632 1.00 13.66 ? 203 THR A CB 1 +ATOM 3212 O OG1 . THR A 1 204 ? 8.434 31.130 -5.444 1.00 16.94 ? 203 THR A OG1 1 +ATOM 3213 C CG2 . THR A 1 204 ? 7.328 30.128 -3.555 1.00 14.48 ? 203 THR A CG2 1 +ATOM 3214 H H . THR A 1 204 ? 6.871 29.442 -6.589 1.00 15.80 ? 203 THR A H 1 +ATOM 3215 H HA . THR A 1 204 ? 5.232 30.959 -5.013 1.00 13.23 ? 203 THR A HA 1 +ATOM 3216 H HB . THR A 1 204 ? 7.154 32.041 -4.220 1.00 16.39 ? 203 THR A HB 1 +ATOM 3217 H HG1 . THR A 1 204 ? 9.111 31.282 -4.971 1.00 20.33 ? 203 THR A HG1 1 +ATOM 3218 H HG21 . THR A 1 204 ? 8.090 30.304 -2.981 1.00 17.38 ? 203 THR A HG21 1 +ATOM 3219 H HG22 . THR A 1 204 ? 6.520 30.142 -3.019 1.00 17.38 ? 203 THR A HG22 1 +ATOM 3220 H HG23 . THR A 1 204 ? 7.428 29.248 -3.951 1.00 17.38 ? 203 THR A HG23 1 +ATOM 3221 N N . HIS A 1 205 ? 5.330 33.017 -6.385 1.00 11.53 ? 204 HIS A N 1 +ATOM 3222 C CA . HIS A 1 205 ? 5.588 34.222 -7.155 1.00 14.57 ? 204 HIS A CA 1 +ATOM 3223 C C . HIS A 1 205 ? 5.194 35.438 -6.322 1.00 15.72 ? 204 HIS A C 1 +ATOM 3224 O O . HIS A 1 205 ? 4.232 35.403 -5.559 1.00 14.69 ? 204 HIS A O 1 +ATOM 3225 C CB . HIS A 1 205 ? 4.960 34.194 -8.559 1.00 22.28 ? 204 HIS A CB 1 +ATOM 3226 C CG . HIS A 1 205 ? 3.470 34.210 -8.586 1.00 19.79 ? 204 HIS A CG 1 +ATOM 3227 N ND1 . HIS A 1 205 ? 2.750 35.356 -8.839 1.00 17.58 ? 204 HIS A ND1 1 +ATOM 3228 C CD2 . HIS A 1 205 ? 2.560 33.211 -8.464 1.00 26.60 ? 204 HIS A CD2 1 +ATOM 3229 C CE1 . HIS A 1 205 ? 1.458 35.073 -8.826 1.00 23.88 ? 204 HIS A CE1 1 +ATOM 3230 N NE2 . HIS A 1 205 ? 1.315 33.775 -8.614 1.00 22.65 ? 204 HIS A NE2 1 +ATOM 3231 H H . HIS A 1 205 ? 4.705 33.088 -5.798 1.00 13.84 ? 204 HIS A H 1 +ATOM 3232 H HA . HIS A 1 205 ? 6.547 34.281 -7.288 1.00 17.49 ? 204 HIS A HA 1 +ATOM 3233 H HB2 . HIS A 1 205 ? 5.270 34.971 -9.051 1.00 26.74 ? 204 HIS A HB2 1 +ATOM 3234 H HB3 . HIS A 1 205 ? 5.252 33.386 -9.011 1.00 26.74 ? 204 HIS A HB3 1 +ATOM 3235 H HD1 . HIS A 1 205 ? 3.087 36.138 -8.959 1.00 21.09 ? 204 HIS A HD1 1 +ATOM 3236 H HD2 . HIS A 1 205 ? 2.743 32.315 -8.299 1.00 31.92 ? 204 HIS A HD2 1 +ATOM 3237 H HE1 . HIS A 1 205 ? 0.767 35.681 -8.963 1.00 28.66 ? 204 HIS A HE1 1 +ATOM 3238 H HE2 . HIS A 1 205 ? 0.566 33.355 -8.563 1.00 27.18 ? 204 HIS A HE2 1 +ATOM 3239 N N . SER A 1 206 ? 6.000 36.487 -6.455 1.00 18.19 ? 205 SER A N 1 +ATOM 3240 C CA . SER A 1 206 ? 5.965 37.627 -5.556 1.00 19.71 ? 205 SER A CA 1 +ATOM 3241 C C . SER A 1 206 ? 6.020 38.916 -6.346 1.00 19.11 ? 205 SER A C 1 +ATOM 3242 O O . SER A 1 206 ? 6.644 38.978 -7.407 1.00 18.96 ? 205 SER A O 1 +ATOM 3243 C CB . SER A 1 206 ? 7.157 37.572 -4.606 1.00 16.78 ? 205 SER A CB 1 +ATOM 3244 O OG . SER A 1 206 ? 7.159 36.388 -3.860 1.00 19.59 ? 205 SER A OG 1 +ATOM 3245 H H . SER A 1 206 ? 6.590 36.560 -7.077 1.00 21.83 ? 205 SER A H 1 +ATOM 3246 H HA . SER A 1 206 ? 5.147 37.613 -5.035 1.00 23.65 ? 205 SER A HA 1 +ATOM 3247 H HB2 . SER A 1 206 ? 7.975 37.618 -5.125 1.00 20.13 ? 205 SER A HB2 1 +ATOM 3248 H HB3 . SER A 1 206 ? 7.110 38.327 -3.998 1.00 20.13 ? 205 SER A HB3 1 +ATOM 3249 H HG . SER A 1 206 ? 7.201 35.725 -4.374 1.00 23.51 ? 205 SER A HG 1 +ATOM 3250 N N . LYS A 1 207 ? 5.344 39.939 -5.841 1.00 17.99 ? 206 LYS A N 1 +ATOM 3251 C CA . LYS A 1 207 ? 5.445 41.284 -6.388 1.00 18.17 ? 206 LYS A CA 1 +ATOM 3252 C C . LYS A 1 207 ? 5.888 42.243 -5.296 1.00 18.74 ? 206 LYS A C 1 +ATOM 3253 O O . LYS A 1 207 ? 5.255 42.317 -4.231 1.00 19.47 ? 206 LYS A O 1 +ATOM 3254 C CB . LYS A 1 207 ? 4.106 41.764 -6.966 1.00 25.28 ? 206 LYS A CB 1 +ATOM 3255 C CG . LYS A 1 207 ? 4.235 43.119 -7.696 1.00 34.79 ? 206 LYS A CG 1 +ATOM 3256 C CD . LYS A 1 207 ? 2.958 43.538 -8.389 1.00 40.99 ? 206 LYS A CD 1 +ATOM 3257 H H . LYS A 1 207 ? 4.811 39.878 -5.169 1.00 21.59 ? 206 LYS A H 1 +ATOM 3258 H HA . LYS A 1 207 ? 6.108 41.297 -7.096 1.00 21.80 ? 206 LYS A HA 1 +ATOM 3259 H HB2 . LYS A 1 207 ? 3.782 41.108 -7.603 1.00 30.34 ? 206 LYS A HB2 1 +ATOM 3260 H HB3 . LYS A 1 207 ? 3.469 41.871 -6.243 1.00 30.34 ? 206 LYS A HB3 1 +ATOM 3261 H HG2 . LYS A 1 207 ? 4.464 43.806 -7.050 1.00 41.74 ? 206 LYS A HG2 1 +ATOM 3262 H HG3 . LYS A 1 207 ? 4.931 43.051 -8.368 1.00 41.74 ? 206 LYS A HG3 1 +ATOM 3263 N N . LEU A 1 208 ? 6.960 42.981 -5.561 1.00 18.45 ? 207 LEU A N 1 +ATOM 3264 C CA . LEU A 1 208 ? 7.455 43.969 -4.607 1.00 21.13 ? 207 LEU A CA 1 +ATOM 3265 C C . LEU A 1 208 ? 6.991 45.353 -5.039 1.00 20.66 ? 207 LEU A C 1 +ATOM 3266 O O . LEU A 1 208 ? 6.962 45.653 -6.237 1.00 20.93 ? 207 LEU A O 1 +ATOM 3267 C CB . LEU A 1 208 ? 8.990 43.936 -4.518 1.00 18.51 ? 207 LEU A CB 1 +ATOM 3268 C CG . LEU A 1 208 ? 9.692 42.585 -4.427 1.00 17.05 ? 207 LEU A CG 1 +ATOM 3269 C CD1 . LEU A 1 208 ? 11.185 42.763 -4.158 1.00 25.24 ? 207 LEU A CD1 1 +ATOM 3270 C CD2 . LEU A 1 208 ? 9.055 41.703 -3.388 1.00 17.74 ? 207 LEU A CD2 1 +ATOM 3271 H H . LEU A 1 208 ? 7.419 42.929 -6.286 1.00 22.14 ? 207 LEU A H 1 +ATOM 3272 H HA . LEU A 1 208 ? 7.091 43.782 -3.728 1.00 25.36 ? 207 LEU A HA 1 +ATOM 3273 H HB2 . LEU A 1 208 ? 9.341 44.381 -5.305 1.00 22.21 ? 207 LEU A HB2 1 +ATOM 3274 H HB3 . LEU A 1 208 ? 9.251 44.439 -3.731 1.00 22.21 ? 207 LEU A HB3 1 +ATOM 3275 H HG . LEU A 1 208 ? 9.603 42.136 -5.283 1.00 20.46 ? 207 LEU A HG 1 +ATOM 3276 H HD11 . LEU A 1 208 ? 11.602 41.888 -4.106 1.00 30.29 ? 207 LEU A HD11 1 +ATOM 3277 H HD12 . LEU A 1 208 ? 11.577 43.274 -4.882 1.00 30.29 ? 207 LEU A HD12 1 +ATOM 3278 H HD13 . LEU A 1 208 ? 11.300 43.235 -3.318 1.00 30.29 ? 207 LEU A HD13 1 +ATOM 3279 H HD21 . LEU A 1 208 ? 9.527 40.856 -3.360 1.00 21.29 ? 207 LEU A HD21 1 +ATOM 3280 H HD22 . LEU A 1 208 ? 9.112 42.142 -2.524 1.00 21.29 ? 207 LEU A HD22 1 +ATOM 3281 H HD23 . LEU A 1 208 ? 8.126 41.557 -3.624 1.00 21.29 ? 207 LEU A HD23 1 +ATOM 3282 N N . SER A 1 209 ? 6.640 46.205 -4.073 1.00 19.76 ? 208 SER A N 1 +ATOM 3283 C CA . SER A 1 209 ? 6.198 47.567 -4.366 1.00 21.20 ? 208 SER A CA 1 +ATOM 3284 C C . SER A 1 209 ? 6.560 48.495 -3.215 1.00 22.80 ? 208 SER A C 1 +ATOM 3285 O O . SER A 1 209 ? 7.197 48.069 -2.255 1.00 22.70 ? 208 SER A O 1 +ATOM 3286 C CB . SER A 1 209 ? 4.685 47.603 -4.596 1.00 23.94 ? 208 SER A CB 1 +ATOM 3287 O OG . SER A 1 209 ? 4.015 47.027 -3.490 1.00 21.95 ? 208 SER A OG 1 +ATOM 3288 H H . SER A 1 209 ? 6.651 46.016 -3.235 1.00 23.71 ? 208 SER A H 1 +ATOM 3289 H HA . SER A 1 209 ? 6.640 47.885 -5.169 1.00 25.43 ? 208 SER A HA 1 +ATOM 3290 H HB2 . SER A 1 209 ? 4.400 48.525 -4.697 1.00 28.72 ? 208 SER A HB2 1 +ATOM 3291 H HB3 . SER A 1 209 ? 4.472 47.098 -5.396 1.00 28.72 ? 208 SER A HB3 1 +ATOM 3292 H HG . SER A 1 209 ? 3.185 47.047 -3.615 1.00 26.34 ? 208 SER A HG 1 +ATOM 3293 N N . LYS A 1 210 ? 6.153 49.755 -3.328 1.00 25.65 ? 209 LYS A N 1 +ATOM 3294 C CA . LYS A 1 210 ? 6.408 50.744 -2.282 1.00 26.06 ? 209 LYS A CA 1 +ATOM 3295 C C . LYS A 1 210 ? 5.110 51.408 -1.874 1.00 30.93 ? 209 LYS A C 1 +ATOM 3296 O O . LYS A 1 210 ? 4.189 51.522 -2.670 1.00 32.15 ? 209 LYS A O 1 +ATOM 3297 C CB . LYS A 1 210 ? 7.404 51.801 -2.760 1.00 26.06 ? 209 LYS A CB 1 +ATOM 3298 C CG . LYS A 1 210 ? 8.762 51.249 -3.149 1.00 28.86 ? 209 LYS A CG 1 +ATOM 3299 C CD . LYS A 1 210 ? 9.601 50.845 -1.961 1.00 26.24 ? 209 LYS A CD 1 +ATOM 3300 C CE . LYS A 1 210 ? 10.997 50.498 -2.396 1.00 24.65 ? 209 LYS A CE 1 +ATOM 3301 N NZ . LYS A 1 210 ? 11.882 49.995 -1.329 1.00 24.38 ? 209 LYS A NZ 1 +ATOM 3302 H H . LYS A 1 210 ? 5.725 50.066 -4.006 1.00 30.77 ? 209 LYS A H 1 +ATOM 3303 H HA . LYS A 1 210 ? 6.782 50.301 -1.504 1.00 31.27 ? 209 LYS A HA 1 +ATOM 3304 H HB2 . LYS A 1 210 ? 7.033 52.248 -3.537 1.00 31.27 ? 209 LYS A HB2 1 +ATOM 3305 H HB3 . LYS A 1 210 ? 7.540 52.445 -2.047 1.00 31.27 ? 209 LYS A HB3 1 +ATOM 3306 H HG2 . LYS A 1 210 ? 8.636 50.464 -3.706 1.00 34.63 ? 209 LYS A HG2 1 +ATOM 3307 H HG3 . LYS A 1 210 ? 9.249 51.928 -3.641 1.00 34.63 ? 209 LYS A HG3 1 +ATOM 3308 H HD2 . LYS A 1 210 ? 9.649 51.583 -1.333 1.00 31.48 ? 209 LYS A HD2 1 +ATOM 3309 H HD3 . LYS A 1 210 ? 9.208 50.065 -1.538 1.00 31.48 ? 209 LYS A HD3 1 +ATOM 3310 H HE2 . LYS A 1 210 ? 10.945 49.811 -3.079 1.00 29.58 ? 209 LYS A HE2 1 +ATOM 3311 H HE3 . LYS A 1 210 ? 11.410 51.294 -2.766 1.00 29.58 ? 209 LYS A HE3 1 +ATOM 3312 H HZ1 . LYS A 1 210 ? 11.966 50.608 -0.689 1.00 29.26 ? 209 LYS A HZ1 1 +ATOM 3313 H HZ2 . LYS A 1 210 ? 11.541 49.253 -0.975 1.00 29.26 ? 209 LYS A HZ2 1 +ATOM 3314 H HZ3 . LYS A 1 210 ? 12.687 49.813 -1.662 1.00 29.26 ? 209 LYS A HZ3 1 +ATOM 3315 N N . ASP A 1 211 ? 5.047 51.807 -0.608 1.00 27.94 ? 210 ASP A N 1 +ATOM 3316 C CA . ASP A 1 211 ? 4.004 52.665 -0.073 1.00 27.79 ? 210 ASP A CA 1 +ATOM 3317 C C . ASP A 1 211 ? 4.362 54.124 -0.335 1.00 29.61 ? 210 ASP A C 1 +ATOM 3318 O O . ASP A 1 211 ? 5.365 54.622 0.184 1.00 31.07 ? 210 ASP A O 1 +ATOM 3319 C CB . ASP A 1 211 ? 3.919 52.412 1.427 1.00 27.72 ? 210 ASP A CB 1 +ATOM 3320 C CG . ASP A 1 211 ? 2.855 53.244 2.118 1.00 34.59 ? 210 ASP A CG 1 +ATOM 3321 O OD1 . ASP A 1 211 ? 2.306 54.196 1.519 1.00 32.29 ? 210 ASP A OD1 1 +ATOM 3322 O OD2 . ASP A 1 211 ? 2.597 52.947 3.308 1.00 36.03 ? 210 ASP A OD2 1 +ATOM 3323 H H . ASP A 1 211 ? 5.627 51.580 -0.016 1.00 33.53 ? 210 ASP A H 1 +ATOM 3324 H HA . ASP A 1 211 ? 3.150 52.460 -0.485 1.00 33.35 ? 210 ASP A HA 1 +ATOM 3325 H HB2 . ASP A 1 211 ? 3.711 51.476 1.577 1.00 33.26 ? 210 ASP A HB2 1 +ATOM 3326 H HB3 . ASP A 1 211 ? 4.775 52.628 1.831 1.00 33.26 ? 210 ASP A HB3 1 +ATOM 3327 N N . PRO A 1 212 ? 3.543 54.828 -1.131 1.00 38.64 ? 211 PRO A N 1 +ATOM 3328 C CA . PRO A 1 212 ? 3.892 56.217 -1.468 1.00 43.21 ? 211 PRO A CA 1 +ATOM 3329 C C . PRO A 1 212 ? 3.965 57.154 -0.254 1.00 43.27 ? 211 PRO A C 1 +ATOM 3330 O O . PRO A 1 212 ? 4.613 58.203 -0.314 1.00 48.59 ? 211 PRO A O 1 +ATOM 3331 C CB . PRO A 1 212 ? 2.766 56.644 -2.421 1.00 42.85 ? 211 PRO A CB 1 +ATOM 3332 C CG . PRO A 1 212 ? 1.656 55.653 -2.187 1.00 40.59 ? 211 PRO A CG 1 +ATOM 3333 C CD . PRO A 1 212 ? 2.311 54.382 -1.811 1.00 34.27 ? 211 PRO A CD 1 +ATOM 3334 H HA . PRO A 1 212 ? 4.738 56.244 -1.942 1.00 51.85 ? 211 PRO A HA 1 +ATOM 3335 H HB2 . PRO A 1 212 ? 2.475 57.544 -2.202 1.00 51.42 ? 211 PRO A HB2 1 +ATOM 3336 H HB3 . PRO A 1 212 ? 3.079 56.598 -3.338 1.00 51.42 ? 211 PRO A HB3 1 +ATOM 3337 H HG2 . PRO A 1 212 ? 1.087 55.968 -1.466 1.00 48.70 ? 211 PRO A HG2 1 +ATOM 3338 H HG3 . PRO A 1 212 ? 1.142 55.543 -3.002 1.00 48.70 ? 211 PRO A HG3 1 +ATOM 3339 H HD2 . PRO A 1 212 ? 1.750 53.879 -1.201 1.00 41.13 ? 211 PRO A HD2 1 +ATOM 3340 H HD3 . PRO A 1 212 ? 2.529 53.867 -2.604 1.00 41.13 ? 211 PRO A HD3 1 +ATOM 3341 N N . ASN A 1 213 ? 3.322 56.757 0.836 1.00 42.79 ? 212 ASN A N 1 +ATOM 3342 C CA . ASN A 1 213 ? 3.283 57.559 2.045 1.00 43.39 ? 212 ASN A CA 1 +ATOM 3343 C C . ASN A 1 213 ? 4.293 57.117 3.100 1.00 42.76 ? 212 ASN A C 1 +ATOM 3344 O O . ASN A 1 213 ? 4.276 57.619 4.223 1.00 40.97 ? 212 ASN A O 1 +ATOM 3345 C CB . ASN A 1 213 ? 1.873 57.508 2.626 1.00 47.97 ? 212 ASN A CB 1 +ATOM 3346 C CG . ASN A 1 213 ? 0.841 58.057 1.666 1.00 52.23 ? 212 ASN A CG 1 +ATOM 3347 O OD1 . ASN A 1 213 ? 1.049 59.106 1.051 1.00 54.15 ? 212 ASN A OD1 1 +ATOM 3348 N ND2 . ASN A 1 213 ? -0.269 57.342 1.512 1.00 54.10 ? 212 ASN A ND2 1 +ATOM 3349 H H . ASN A 1 213 ? 2.894 56.014 0.899 1.00 51.35 ? 212 ASN A H 1 +ATOM 3350 H HA . ASN A 1 213 ? 3.477 58.481 1.815 1.00 52.07 ? 212 ASN A HA 1 +ATOM 3351 H HB2 . ASN A 1 213 ? 1.643 56.586 2.822 1.00 57.57 ? 212 ASN A HB2 1 +ATOM 3352 H HB3 . ASN A 1 213 ? 1.844 58.039 3.437 1.00 57.57 ? 212 ASN A HB3 1 +ATOM 3353 H HD21 . ASN A 1 213 ? -0.371 56.607 1.947 1.00 64.92 ? 212 ASN A HD21 1 +ATOM 3354 H HD22 . ASN A 1 213 ? -0.885 57.614 0.977 1.00 64.92 ? 212 ASN A HD22 1 +ATOM 3355 N N . GLU A 1 214 ? 5.163 56.174 2.755 1.00 32.75 ? 213 GLU A N 1 +ATOM 3356 C CA . GLU A 1 214 ? 6.132 55.664 3.727 1.00 32.07 ? 213 GLU A CA 1 +ATOM 3357 C C . GLU A 1 214 ? 7.507 56.253 3.474 1.00 32.92 ? 213 GLU A C 1 +ATOM 3358 O O . GLU A 1 214 ? 8.089 56.062 2.402 1.00 32.18 ? 213 GLU A O 1 +ATOM 3359 C CB . GLU A 1 214 ? 6.204 54.140 3.695 1.00 29.99 ? 213 GLU A CB 1 +ATOM 3360 C CG . GLU A 1 214 ? 7.178 53.558 4.704 1.00 29.39 ? 213 GLU A CG 1 +ATOM 3361 C CD . GLU A 1 214 ? 6.838 53.924 6.146 1.00 30.34 ? 213 GLU A CD 1 +ATOM 3362 O OE1 . GLU A 1 214 ? 5.813 53.437 6.650 1.00 30.06 ? 213 GLU A OE1 1 +ATOM 3363 O OE2 . GLU A 1 214 ? 7.599 54.706 6.768 1.00 31.48 ? 213 GLU A OE2 1 +ATOM 3364 H H . GLU A 1 214 ? 5.215 55.815 1.976 1.00 39.30 ? 213 GLU A H 1 +ATOM 3365 H HA . GLU A 1 214 ? 5.853 55.930 4.617 1.00 38.49 ? 213 GLU A HA 1 +ATOM 3366 H HB2 . GLU A 1 214 ? 5.324 53.781 3.889 1.00 35.99 ? 213 GLU A HB2 1 +ATOM 3367 H HB3 . GLU A 1 214 ? 6.488 53.859 2.811 1.00 35.99 ? 213 GLU A HB3 1 +ATOM 3368 H HG2 . GLU A 1 214 ? 7.166 52.591 4.631 1.00 35.26 ? 213 GLU A HG2 1 +ATOM 3369 H HG3 . GLU A 1 214 ? 8.068 53.893 4.512 1.00 35.26 ? 213 GLU A HG3 1 +ATOM 3370 N N . LYS A 1 215 ? 8.019 56.956 4.482 1.00 34.65 ? 214 LYS A N 1 +ATOM 3371 C CA . LYS A 1 215 ? 9.296 57.641 4.373 1.00 34.87 ? 214 LYS A CA 1 +ATOM 3372 C C . LYS A 1 215 ? 10.465 56.736 4.787 1.00 34.90 ? 214 LYS A C 1 +ATOM 3373 O O . LYS A 1 215 ? 11.599 56.900 4.327 1.00 35.08 ? 214 LYS A O 1 +ATOM 3374 C CB . LYS A 1 215 ? 9.259 58.910 5.232 1.00 36.91 ? 214 LYS A CB 1 +ATOM 3375 C CG . LYS A 1 215 ? 8.217 59.928 4.777 1.00 45.90 ? 214 LYS A CG 1 +ATOM 3376 H H . LYS A 1 215 ? 7.639 57.049 5.247 1.00 41.58 ? 214 LYS A H 1 +ATOM 3377 H HA . LYS A 1 215 ? 9.434 57.906 3.451 1.00 41.84 ? 214 LYS A HA 1 +ATOM 3378 H HB2 . LYS A 1 215 ? 9.053 58.662 6.147 1.00 44.29 ? 214 LYS A HB2 1 +ATOM 3379 H HB3 . LYS A 1 215 ? 10.129 59.338 5.195 1.00 44.29 ? 214 LYS A HB3 1 +ATOM 3380 N N . ARG A 1 216 ? 10.198 55.774 5.657 1.00 32.49 ? 215 ARG A N 1 +ATOM 3381 C CA . ARG A 1 216 ? 11.242 54.853 6.057 1.00 31.43 ? 215 ARG A CA 1 +ATOM 3382 C C . ARG A 1 216 ? 11.560 53.869 4.927 1.00 29.87 ? 215 ARG A C 1 +ATOM 3383 O O . ARG A 1 216 ? 10.768 53.669 4.008 1.00 29.31 ? 215 ARG A O 1 +ATOM 3384 C CB . ARG A 1 216 ? 10.821 54.097 7.316 1.00 30.84 ? 215 ARG A CB 1 +ATOM 3385 C CG . ARG A 1 216 ? 10.744 54.994 8.543 1.00 32.45 ? 215 ARG A CG 1 +ATOM 3386 C CD . ARG A 1 216 ? 10.058 54.263 9.674 1.00 35.38 ? 215 ARG A CD 1 +ATOM 3387 N NE . ARG A 1 216 ? 8.684 53.962 9.300 1.00 43.46 ? 215 ARG A NE 1 +ATOM 3388 C CZ . ARG A 1 216 ? 7.770 53.448 10.119 1.00 51.46 ? 215 ARG A CZ 1 +ATOM 3389 N NH1 . ARG A 1 216 ? 8.083 53.170 11.382 1.00 48.64 ? 215 ARG A NH1 1 +ATOM 3390 N NH2 . ARG A 1 216 ? 6.538 53.214 9.671 1.00 49.46 ? 215 ARG A NH2 1 +ATOM 3391 H H . ARG A 1 216 ? 9.433 55.635 6.023 1.00 38.99 ? 215 ARG A H 1 +ATOM 3392 H HA . ARG A 1 216 ? 12.048 55.353 6.259 1.00 37.72 ? 215 ARG A HA 1 +ATOM 3393 H HB2 . ARG A 1 216 ? 9.944 53.708 7.173 1.00 37.00 ? 215 ARG A HB2 1 +ATOM 3394 H HB3 . ARG A 1 216 ? 11.469 53.398 7.496 1.00 37.00 ? 215 ARG A HB3 1 +ATOM 3395 H HG2 . ARG A 1 216 ? 11.640 55.233 8.828 1.00 38.94 ? 215 ARG A HG2 1 +ATOM 3396 H HG3 . ARG A 1 216 ? 10.230 55.789 8.333 1.00 38.94 ? 215 ARG A HG3 1 +ATOM 3397 H HD2 . ARG A 1 216 ? 10.520 53.429 9.852 1.00 42.45 ? 215 ARG A HD2 1 +ATOM 3398 H HD3 . ARG A 1 216 ? 10.048 54.824 10.466 1.00 42.45 ? 215 ARG A HD3 1 +ATOM 3399 H HE . ARG A 1 216 ? 8.445 54.128 8.491 1.00 52.15 ? 215 ARG A HE 1 +ATOM 3400 H HH11 . ARG A 1 216 ? 8.878 53.322 11.671 1.00 58.37 ? 215 ARG A HH11 1 +ATOM 3401 H HH12 . ARG A 1 216 ? 7.489 52.838 11.908 1.00 58.37 ? 215 ARG A HH12 1 +ATOM 3402 H HH21 . ARG A 1 216 ? 6.336 53.394 8.854 1.00 59.35 ? 215 ARG A HH21 1 +ATOM 3403 H HH22 . ARG A 1 216 ? 5.945 52.881 10.197 1.00 59.35 ? 215 ARG A HH22 1 +ATOM 3404 N N . ASP A 1 217 ? 12.739 53.273 5.010 1.00 29.31 ? 216 ASP A N 1 +ATOM 3405 C CA . ASP A 1 217 ? 13.166 52.255 4.066 1.00 27.91 ? 216 ASP A CA 1 +ATOM 3406 C C . ASP A 1 217 ? 12.281 51.046 4.313 1.00 26.39 ? 216 ASP A C 1 +ATOM 3407 O O . ASP A 1 217 ? 12.176 50.571 5.451 1.00 26.17 ? 216 ASP A O 1 +ATOM 3408 C CB . ASP A 1 217 ? 14.633 51.911 4.332 1.00 27.91 ? 216 ASP A CB 1 +ATOM 3409 C CG . ASP A 1 217 ? 15.312 51.258 3.143 1.00 27.88 ? 216 ASP A CG 1 +ATOM 3410 O OD1 . ASP A 1 217 ? 14.648 51.085 2.097 1.00 26.50 ? 216 ASP A OD1 1 +ATOM 3411 O OD2 . ASP A 1 217 ? 16.518 50.940 3.274 1.00 27.16 ? 216 ASP A OD2 1 +ATOM 3412 H H . ASP A 1 217 ? 13.322 53.445 5.618 1.00 35.17 ? 216 ASP A H 1 +ATOM 3413 H HA . ASP A 1 217 ? 13.058 52.562 3.152 1.00 33.49 ? 216 ASP A HA 1 +ATOM 3414 H HB2 . ASP A 1 217 ? 15.115 52.726 4.541 1.00 33.49 ? 216 ASP A HB2 1 +ATOM 3415 H HB3 . ASP A 1 217 ? 14.682 51.295 5.080 1.00 33.49 ? 216 ASP A HB3 1 +ATOM 3416 N N . HIS A 1 218 ? 11.631 50.548 3.270 1.00 25.48 ? 217 HIS A N 1 +ATOM 3417 C CA . HIS A 1 218 ? 10.585 49.549 3.458 1.00 24.30 ? 217 HIS A CA 1 +ATOM 3418 C C . HIS A 1 218 ? 10.379 48.746 2.183 1.00 23.13 ? 217 HIS A C 1 +ATOM 3419 O O . HIS A 1 218 ? 10.942 49.050 1.113 1.00 23.31 ? 217 HIS A O 1 +ATOM 3420 C CB . HIS A 1 218 ? 9.265 50.239 3.812 1.00 25.08 ? 217 HIS A CB 1 +ATOM 3421 C CG . HIS A 1 218 ? 8.715 51.062 2.690 1.00 25.75 ? 217 HIS A CG 1 +ATOM 3422 N ND1 . HIS A 1 218 ? 9.315 52.229 2.274 1.00 27.07 ? 217 HIS A ND1 1 +ATOM 3423 C CD2 . HIS A 1 218 ? 7.655 50.868 1.864 1.00 25.38 ? 217 HIS A CD2 1 +ATOM 3424 C CE1 . HIS A 1 218 ? 8.636 52.734 1.261 1.00 27.52 ? 217 HIS A CE1 1 +ATOM 3425 N NE2 . HIS A 1 218 ? 7.622 51.937 0.999 1.00 26.52 ? 217 HIS A NE2 1 +ATOM 3426 H H . HIS A 1 218 ? 11.773 50.767 2.451 1.00 30.57 ? 217 HIS A H 1 +ATOM 3427 H HA . HIS A 1 218 ? 10.829 48.945 4.177 1.00 29.16 ? 217 HIS A HA 1 +ATOM 3428 H HB2 . HIS A 1 218 ? 8.606 49.563 4.037 1.00 30.10 ? 217 HIS A HB2 1 +ATOM 3429 H HB3 . HIS A 1 218 ? 9.409 50.826 4.570 1.00 30.10 ? 217 HIS A HB3 1 +ATOM 3430 H HD1 . HIS A 1 218 ? 10.016 52.580 2.627 1.00 32.48 ? 217 HIS A HD1 1 +ATOM 3431 H HD2 . HIS A 1 218 ? 7.051 50.162 1.895 1.00 30.46 ? 217 HIS A HD2 1 +ATOM 3432 H HE1 . HIS A 1 218 ? 8.835 53.524 0.813 1.00 33.03 ? 217 HIS A HE1 1 +ATOM 3433 H HE2 . HIS A 1 218 ? 7.042 52.056 0.376 1.00 31.82 ? 217 HIS A HE2 1 +ATOM 3434 N N . MET A 1 219 ? 9.531 47.734 2.321 1.00 22.06 ? 218 MET A N 1 +ATOM 3435 C CA . MET A 1 219 ? 9.163 46.867 1.218 1.00 21.87 ? 218 MET A CA 1 +ATOM 3436 C C . MET A 1 219 ? 7.739 46.420 1.444 1.00 20.57 ? 218 MET A C 1 +ATOM 3437 O O . MET A 1 219 ? 7.392 45.914 2.510 1.00 20.37 ? 218 MET A O 1 +ATOM 3438 C CB . MET A 1 219 ? 10.077 45.649 1.145 1.00 21.56 ? 218 MET A CB 1 +ATOM 3439 C CG . MET A 1 219 ? 9.615 44.597 0.122 1.00 24.36 ? 218 MET A CG 1 +ATOM 3440 S SD . MET A 1 219 ? 10.745 43.211 -0.016 1.00 19.36 ? 218 MET A SD 1 +ATOM 3441 C CE . MET A 1 219 ? 10.650 42.406 1.583 1.00 20.05 ? 218 MET A CE 1 +ATOM 3442 H H . MET A 1 219 ? 9.149 47.527 3.063 1.00 26.48 ? 218 MET A H 1 +ATOM 3443 H HA . MET A 1 219 ? 9.225 47.355 0.382 1.00 26.25 ? 218 MET A HA 1 +ATOM 3444 H HB2 . MET A 1 219 ? 10.967 45.940 0.891 1.00 25.87 ? 218 MET A HB2 1 +ATOM 3445 H HB3 . MET A 1 219 ? 10.104 45.225 2.016 1.00 25.87 ? 218 MET A HB3 1 +ATOM 3446 H HG2 . MET A 1 219 ? 8.750 44.252 0.393 1.00 29.23 ? 218 MET A HG2 1 +ATOM 3447 H HG3 . MET A 1 219 ? 9.546 45.015 -0.751 1.00 29.23 ? 218 MET A HG3 1 +ATOM 3448 H HE1 . MET A 1 219 ? 11.242 41.638 1.585 1.00 24.06 ? 218 MET A HE1 1 +ATOM 3449 H HE2 . MET A 1 219 ? 10.921 43.035 2.270 1.00 24.06 ? 218 MET A HE2 1 +ATOM 3450 H HE3 . MET A 1 219 ? 9.736 42.121 1.738 1.00 24.06 ? 218 MET A HE3 1 +ATOM 3451 N N . VAL A 1 220 ? 6.910 46.636 0.435 1.00 20.62 ? 219 VAL A N 1 +ATOM 3452 C CA . VAL A 1 220 ? 5.587 46.057 0.402 1.00 20.19 ? 219 VAL A CA 1 +ATOM 3453 C C . VAL A 1 220 ? 5.635 44.796 -0.462 1.00 18.85 ? 219 VAL A C 1 +ATOM 3454 O O . VAL A 1 220 ? 6.260 44.776 -1.540 1.00 18.61 ? 219 VAL A O 1 +ATOM 3455 C CB . VAL A 1 220 ? 4.570 47.035 -0.172 1.00 21.20 ? 219 VAL A CB 1 +ATOM 3456 C CG1 . VAL A 1 220 ? 3.199 46.373 -0.303 1.00 20.81 ? 219 VAL A CG1 1 +ATOM 3457 C CG2 . VAL A 1 220 ? 4.479 48.308 0.716 1.00 22.70 ? 219 VAL A CG2 1 +ATOM 3458 H H . VAL A 1 220 ? 7.096 47.122 -0.249 1.00 24.74 ? 219 VAL A H 1 +ATOM 3459 H HA . VAL A 1 220 ? 5.313 45.811 1.299 1.00 24.22 ? 219 VAL A HA 1 +ATOM 3460 H HB . VAL A 1 220 ? 4.858 47.307 -1.058 1.00 25.44 ? 219 VAL A HB 1 +ATOM 3461 H HG11 . VAL A 1 220 ? 2.572 47.016 -0.670 1.00 24.98 ? 219 VAL A HG11 1 +ATOM 3462 H HG12 . VAL A 1 220 ? 3.273 45.608 -0.894 1.00 24.98 ? 219 VAL A HG12 1 +ATOM 3463 H HG13 . VAL A 1 220 ? 2.902 46.086 0.575 1.00 24.98 ? 219 VAL A HG13 1 +ATOM 3464 H HG21 . VAL A 1 220 ? 3.827 48.915 0.332 1.00 27.24 ? 219 VAL A HG21 1 +ATOM 3465 H HG22 . VAL A 1 220 ? 4.205 48.050 1.610 1.00 27.24 ? 219 VAL A HG22 1 +ATOM 3466 H HG23 . VAL A 1 220 ? 5.350 48.734 0.747 1.00 27.24 ? 219 VAL A HG23 1 +ATOM 3467 N N . LEU A 1 221 ? 4.956 43.755 -0.004 1.00 18.68 ? 220 LEU A N 1 +ATOM 3468 C CA . LEU A 1 221 ? 5.095 42.444 -0.608 1.00 16.94 ? 220 LEU A CA 1 +ATOM 3469 C C . LEU A 1 221 ? 3.740 41.780 -0.811 1.00 19.19 ? 220 LEU A C 1 +ATOM 3470 O O . LEU A 1 221 ? 2.888 41.761 0.086 1.00 17.27 ? 220 LEU A O 1 +ATOM 3471 C CB . LEU A 1 221 ? 5.970 41.569 0.294 1.00 19.12 ? 220 LEU A CB 1 +ATOM 3472 C CG . LEU A 1 221 ? 6.114 40.098 -0.109 1.00 25.07 ? 220 LEU A CG 1 +ATOM 3473 C CD1 . LEU A 1 221 ? 6.821 39.979 -1.456 1.00 23.11 ? 220 LEU A CD1 1 +ATOM 3474 C CD2 . LEU A 1 221 ? 6.861 39.307 0.947 1.00 25.55 ? 220 LEU A CD2 1 +ATOM 3475 H H . LEU A 1 221 ? 4.408 43.783 0.658 1.00 22.41 ? 220 LEU A H 1 +ATOM 3476 H HA . LEU A 1 221 ? 5.529 42.529 -1.471 1.00 20.33 ? 220 LEU A HA 1 +ATOM 3477 H HB2 . LEU A 1 221 ? 6.862 41.950 0.313 1.00 22.95 ? 220 LEU A HB2 1 +ATOM 3478 H HB3 . LEU A 1 221 ? 5.596 41.585 1.189 1.00 22.95 ? 220 LEU A HB3 1 +ATOM 3479 H HG . LEU A 1 221 ? 5.230 39.711 -0.202 1.00 30.08 ? 220 LEU A HG 1 +ATOM 3480 H HD11 . LEU A 1 221 ? 6.900 39.040 -1.688 1.00 27.73 ? 220 LEU A HD11 1 +ATOM 3481 H HD12 . LEU A 1 221 ? 6.299 40.444 -2.128 1.00 27.73 ? 220 LEU A HD12 1 +ATOM 3482 H HD13 . LEU A 1 221 ? 7.702 40.378 -1.386 1.00 27.73 ? 220 LEU A HD13 1 +ATOM 3483 H HD21 . LEU A 1 221 ? 6.932 38.384 0.658 1.00 30.65 ? 220 LEU A HD21 1 +ATOM 3484 H HD22 . LEU A 1 221 ? 7.745 39.688 1.060 1.00 30.65 ? 220 LEU A HD22 1 +ATOM 3485 H HD23 . LEU A 1 221 ? 6.370 39.355 1.783 1.00 30.65 ? 220 LEU A HD23 1 +ATOM 3486 N N . LEU A 1 222 ? 3.542 41.238 -2.000 1.00 16.89 ? 221 LEU A N 1 +ATOM 3487 C CA . LEU A 1 222 ? 2.369 40.444 -2.279 1.00 16.57 ? 221 LEU A CA 1 +ATOM 3488 C C . LEU A 1 222 ? 2.876 39.133 -2.822 1.00 15.33 ? 221 LEU A C 1 +ATOM 3489 O O . LEU A 1 222 ? 3.609 39.115 -3.834 1.00 20.30 ? 221 LEU A O 1 +ATOM 3490 C CB . LEU A 1 222 ? 1.452 41.131 -3.300 1.00 16.82 ? 221 LEU A CB 1 +ATOM 3491 C CG . LEU A 1 222 ? 0.295 40.255 -3.798 1.00 16.03 ? 221 LEU A CG 1 +ATOM 3492 C CD1 . LEU A 1 222 ? -0.669 39.934 -2.684 1.00 20.35 ? 221 LEU A CD1 1 +ATOM 3493 C CD2 . LEU A 1 222 ? -0.451 40.948 -4.942 1.00 21.24 ? 221 LEU A CD2 1 +ATOM 3494 H H . LEU A 1 222 ? 4.080 41.318 -2.666 1.00 20.27 ? 221 LEU A H 1 +ATOM 3495 H HA . LEU A 1 222 ? 1.872 40.281 -1.462 1.00 19.89 ? 221 LEU A HA 1 +ATOM 3496 H HB2 . LEU A 1 222 ? 1.067 41.922 -2.890 1.00 20.19 ? 221 LEU A HB2 1 +ATOM 3497 H HB3 . LEU A 1 222 ? 1.982 41.386 -4.071 1.00 20.19 ? 221 LEU A HB3 1 +ATOM 3498 H HG . LEU A 1 222 ? 0.653 39.420 -4.136 1.00 19.24 ? 221 LEU A HG 1 +ATOM 3499 H HD11 . LEU A 1 222 ? -1.385 39.381 -3.036 1.00 24.42 ? 221 LEU A HD11 1 +ATOM 3500 H HD12 . LEU A 1 222 ? -0.196 39.458 -1.985 1.00 24.42 ? 221 LEU A HD12 1 +ATOM 3501 H HD13 . LEU A 1 222 ? -1.033 40.762 -2.333 1.00 24.42 ? 221 LEU A HD13 1 +ATOM 3502 H HD21 . LEU A 1 222 ? -1.175 40.376 -5.239 1.00 25.49 ? 221 LEU A HD21 1 +ATOM 3503 H HD22 . LEU A 1 222 ? -0.805 41.792 -4.622 1.00 25.49 ? 221 LEU A HD22 1 +ATOM 3504 H HD23 . LEU A 1 222 ? 0.168 41.105 -5.673 1.00 25.49 ? 221 LEU A HD23 1 +ATOM 3505 N N . GLU A 1 223 ? 2.466 38.028 -2.219 1.00 14.09 ? 222 GLU A N 1 +ATOM 3506 C CA . GLU A 1 223 ? 3.056 36.741 -2.580 1.00 13.64 ? 222 GLU A CA 1 +ATOM 3507 C C . GLU A 1 223 ? 2.023 35.631 -2.643 1.00 12.85 ? 222 GLU A C 1 +ATOM 3508 O O . GLU A 1 223 ? 1.072 35.597 -1.834 1.00 16.00 ? 222 GLU A O 1 +ATOM 3509 C CB . GLU A 1 223 ? 4.125 36.430 -1.526 1.00 16.73 ? 222 GLU A CB 1 +ATOM 3510 C CG . GLU A 1 223 ? 4.888 35.141 -1.701 1.00 20.87 ? 222 GLU A CG 1 +ATOM 3511 C CD . GLU A 1 223 ? 6.021 35.044 -0.669 1.00 35.31 ? 222 GLU A CD 1 +ATOM 3512 O OE1 . GLU A 1 223 ? 6.898 35.937 -0.670 1.00 38.09 ? 222 GLU A OE1 1 +ATOM 3513 O OE2 . GLU A 1 223 ? 6.016 34.096 0.146 1.00 32.77 ? 222 GLU A OE2 1 +ATOM 3514 H H . GLU A 1 223 ? 1.861 37.991 -1.608 1.00 16.91 ? 222 GLU A H 1 +ATOM 3515 H HA . GLU A 1 223 ? 3.486 36.812 -3.446 1.00 16.37 ? 222 GLU A HA 1 +ATOM 3516 H HB2 . GLU A 1 223 ? 4.774 37.151 -1.531 1.00 20.08 ? 222 GLU A HB2 1 +ATOM 3517 H HB3 . GLU A 1 223 ? 3.693 36.393 -0.658 1.00 20.08 ? 222 GLU A HB3 1 +ATOM 3518 H HG2 . GLU A 1 223 ? 4.288 34.390 -1.570 1.00 25.05 ? 222 GLU A HG2 1 +ATOM 3519 H HG3 . GLU A 1 223 ? 5.278 35.113 -2.588 1.00 25.05 ? 222 GLU A HG3 1 +ATOM 3520 N N . PHE A 1 224 ? 2.223 34.716 -3.585 1.00 12.55 ? 223 PHE A N 1 +ATOM 3521 C CA . PHE A 1 224 ? 1.363 33.551 -3.779 1.00 11.92 ? 223 PHE A CA 1 +ATOM 3522 C C . PHE A 1 224 ? 2.192 32.285 -3.758 1.00 17.10 ? 223 PHE A C 1 +ATOM 3523 O O . PHE A 1 224 ? 3.220 32.192 -4.436 1.00 14.69 ? 223 PHE A O 1 +ATOM 3524 C CB . PHE A 1 224 ? 0.629 33.612 -5.125 1.00 12.55 ? 223 PHE A CB 1 +ATOM 3525 C CG . PHE A 1 224 ? -0.321 34.746 -5.202 1.00 12.75 ? 223 PHE A CG 1 +ATOM 3526 C CD1 . PHE A 1 224 ? -1.619 34.592 -4.787 1.00 14.75 ? 223 PHE A CD1 1 +ATOM 3527 C CD2 . PHE A 1 224 ? 0.115 35.991 -5.595 1.00 14.27 ? 223 PHE A CD2 1 +ATOM 3528 C CE1 . PHE A 1 224 ? -2.501 35.670 -4.833 1.00 14.65 ? 223 PHE A CE1 1 +ATOM 3529 C CE2 . PHE A 1 224 ? -0.744 37.063 -5.616 1.00 18.35 ? 223 PHE A CE2 1 +ATOM 3530 C CZ . PHE A 1 224 ? -2.044 36.903 -5.233 1.00 14.57 ? 223 PHE A CZ 1 +ATOM 3531 H H . PHE A 1 224 ? 2.875 34.750 -4.145 1.00 15.06 ? 223 PHE A H 1 +ATOM 3532 H HA . PHE A 1 224 ? 0.706 33.507 -3.067 1.00 14.30 ? 223 PHE A HA 1 +ATOM 3533 H HB2 . PHE A 1 224 ? 1.280 33.715 -5.836 1.00 15.05 ? 223 PHE A HB2 1 +ATOM 3534 H HB3 . PHE A 1 224 ? 0.128 32.790 -5.249 1.00 15.05 ? 223 PHE A HB3 1 +ATOM 3535 H HD1 . PHE A 1 224 ? -1.922 33.757 -4.512 1.00 17.69 ? 223 PHE A HD1 1 +ATOM 3536 H HD2 . PHE A 1 224 ? 1.001 36.107 -5.852 1.00 17.13 ? 223 PHE A HD2 1 +ATOM 3537 H HE1 . PHE A 1 224 ? -3.385 35.563 -4.565 1.00 17.58 ? 223 PHE A HE1 1 +ATOM 3538 H HE2 . PHE A 1 224 ? -0.443 37.895 -5.903 1.00 22.02 ? 223 PHE A HE2 1 +ATOM 3539 H HZ . PHE A 1 224 ? -2.628 37.626 -5.265 1.00 17.48 ? 223 PHE A HZ 1 +ATOM 3540 N N . VAL A 1 225 ? 1.710 31.303 -3.015 1.00 14.77 ? 224 VAL A N 1 +ATOM 3541 C CA . VAL A 1 225 ? 2.432 30.065 -2.812 1.00 12.71 ? 224 VAL A CA 1 +ATOM 3542 C C . VAL A 1 225 ? 1.456 28.903 -2.924 1.00 15.70 ? 224 VAL A C 1 +ATOM 3543 O O . VAL A 1 225 ? 0.445 28.877 -2.223 1.00 15.25 ? 224 VAL A O 1 +ATOM 3544 C CB . VAL A 1 225 ? 3.092 30.039 -1.433 1.00 16.45 ? 224 VAL A CB 1 +ATOM 3545 C CG1 . VAL A 1 225 ? 3.904 28.737 -1.253 1.00 15.33 ? 224 VAL A CG1 1 +ATOM 3546 C CG2 . VAL A 1 225 ? 3.965 31.262 -1.254 1.00 20.16 ? 224 VAL A CG2 1 +ATOM 3547 H H . VAL A 1 225 ? 0.951 31.333 -2.610 1.00 17.72 ? 224 VAL A H 1 +ATOM 3548 H HA . VAL A 1 225 ? 3.118 29.967 -3.491 1.00 15.25 ? 224 VAL A HA 1 +ATOM 3549 H HB . VAL A 1 225 ? 2.402 30.059 -0.752 1.00 19.75 ? 224 VAL A HB 1 +ATOM 3550 H HG11 . VAL A 1 225 ? 4.313 28.741 -0.373 1.00 18.39 ? 224 VAL A HG11 1 +ATOM 3551 H HG12 . VAL A 1 225 ? 3.306 27.978 -1.337 1.00 18.39 ? 224 VAL A HG12 1 +ATOM 3552 H HG13 . VAL A 1 225 ? 4.590 28.696 -1.937 1.00 18.39 ? 224 VAL A HG13 1 +ATOM 3553 H HG21 . VAL A 1 225 ? 4.376 31.231 -0.376 1.00 24.19 ? 224 VAL A HG21 1 +ATOM 3554 H HG22 . VAL A 1 225 ? 4.651 31.264 -1.940 1.00 24.19 ? 224 VAL A HG22 1 +ATOM 3555 H HG23 . VAL A 1 225 ? 3.415 32.057 -1.334 1.00 24.19 ? 224 VAL A HG23 1 +ATOM 3556 N N . THR A 1 226 ? 1.754 27.953 -3.811 1.00 12.80 ? 225 THR A N 1 +ATOM 3557 C CA . THR A 1 226 ? 0.886 26.818 -4.074 1.00 11.08 ? 225 THR A CA 1 +ATOM 3558 C C . THR A 1 226 ? 1.667 25.511 -4.130 1.00 14.11 ? 225 THR A C 1 +ATOM 3559 O O . THR A 1 226 ? 2.660 25.395 -4.873 1.00 14.43 ? 225 THR A O 1 +ATOM 3560 C CB . THR A 1 226 ? 0.153 26.981 -5.443 1.00 17.71 ? 225 THR A CB 1 +ATOM 3561 O OG1 . THR A 1 226 ? -0.678 28.132 -5.386 1.00 22.39 ? 225 THR A OG1 1 +ATOM 3562 C CG2 . THR A 1 226 ? -0.720 25.767 -5.738 1.00 20.26 ? 225 THR A CG2 1 +ATOM 3563 H H . THR A 1 226 ? 2.474 27.949 -4.282 1.00 15.36 ? 225 THR A H 1 +ATOM 3564 H HA . THR A 1 226 ? 0.219 26.749 -3.373 1.00 13.30 ? 225 THR A HA 1 +ATOM 3565 H HB . THR A 1 226 ? 0.804 27.080 -6.155 1.00 21.25 ? 225 THR A HB 1 +ATOM 3566 H HG1 . THR A 1 226 ? -1.080 28.233 -6.117 1.00 26.86 ? 225 THR A HG1 1 +ATOM 3567 H HG21 . THR A 1 226 ? -1.169 25.882 -6.590 1.00 24.31 ? 225 THR A HG21 1 +ATOM 3568 H HG22 . THR A 1 226 ? -0.174 24.967 -5.774 1.00 24.31 ? 225 THR A HG22 1 +ATOM 3569 H HG23 . THR A 1 226 ? -1.387 25.662 -5.042 1.00 24.31 ? 225 THR A HG23 1 +ATOM 3570 N N . ALA A 1 227 ? 1.231 24.520 -3.352 1.00 13.22 ? 226 ALA A N 1 +ATOM 3571 C CA . ALA A 1 227 ? 1.906 23.222 -3.357 1.00 13.95 ? 226 ALA A CA 1 +ATOM 3572 C C . ALA A 1 227 ? 1.543 22.404 -4.590 1.00 10.55 ? 226 ALA A C 1 +ATOM 3573 O O . ALA A 1 227 ? 0.413 22.459 -5.069 1.00 12.80 ? 226 ALA A O 1 +ATOM 3574 C CB . ALA A 1 227 ? 1.543 22.412 -2.081 1.00 11.31 ? 226 ALA A CB 1 +ATOM 3575 H H . ALA A 1 227 ? 0.558 24.572 -2.819 1.00 15.86 ? 226 ALA A H 1 +ATOM 3576 H HA . ALA A 1 227 ? 2.866 23.363 -3.361 1.00 16.74 ? 226 ALA A HA 1 +ATOM 3577 H HB1 . ALA A 1 227 ? 2.002 21.557 -2.109 1.00 13.57 ? 226 ALA A HB1 1 +ATOM 3578 H HB2 . ALA A 1 227 ? 1.823 22.913 -1.299 1.00 13.57 ? 226 ALA A HB2 1 +ATOM 3579 H HB3 . ALA A 1 227 ? 0.584 22.272 -2.059 1.00 13.57 ? 226 ALA A HB3 1 +ATOM 3580 N N . ALA A 1 228 ? 2.510 21.649 -5.107 1.00 10.20 ? 227 ALA A N 1 +ATOM 3581 C CA . ALA A 1 228 ? 2.271 20.784 -6.240 1.00 13.12 ? 227 ALA A CA 1 +ATOM 3582 C C . ALA A 1 228 ? 3.296 19.659 -6.220 1.00 10.29 ? 227 ALA A C 1 +ATOM 3583 O O . ALA A 1 228 ? 4.043 19.504 -5.249 1.00 10.46 ? 227 ALA A O 1 +ATOM 3584 C CB . ALA A 1 228 ? 2.346 21.572 -7.555 1.00 17.42 ? 227 ALA A CB 1 +ATOM 3585 H H . ALA A 1 228 ? 3.317 21.626 -4.812 1.00 12.24 ? 227 ALA A H 1 +ATOM 3586 H HA . ALA A 1 228 ? 1.386 20.393 -6.166 1.00 15.75 ? 227 ALA A HA 1 +ATOM 3587 H HB1 . ALA A 1 228 ? 2.182 20.967 -8.295 1.00 20.90 ? 227 ALA A HB1 1 +ATOM 3588 H HB2 . ALA A 1 228 ? 1.672 22.270 -7.542 1.00 20.90 ? 227 ALA A HB2 1 +ATOM 3589 H HB3 . ALA A 1 228 ? 3.229 21.965 -7.637 1.00 20.90 ? 227 ALA A HB3 1 +ATOM 3590 N N . GLY A 1 229 ? 3.305 18.845 -7.281 1.00 10.81 ? 228 GLY A N 1 +ATOM 3591 C CA . GLY A 1 229 ? 4.332 17.830 -7.406 1.00 15.36 ? 228 GLY A CA 1 +ATOM 3592 C C . GLY A 1 229 ? 3.868 16.453 -6.953 1.00 23.03 ? 228 GLY A C 1 +ATOM 3593 O O . GLY A 1 229 ? 4.639 15.494 -6.927 1.00 18.78 ? 228 GLY A O 1 +ATOM 3594 H H . GLY A 1 229 ? 2.736 18.864 -7.925 1.00 12.97 ? 228 GLY A H 1 +ATOM 3595 H HA2 . GLY A 1 229 ? 4.611 17.769 -8.334 1.00 18.43 ? 228 GLY A HA2 1 +ATOM 3596 H HA3 . GLY A 1 229 ? 5.101 18.084 -6.873 1.00 18.43 ? 228 GLY A HA3 1 +ATOM 3597 N N . ILE A 1 230 ? 2.602 16.373 -6.579 1.00 14.11 ? 229 ILE A N 1 +ATOM 3598 C CA . ILE A 1 230 ? 1.940 15.099 -6.291 1.00 15.34 ? 229 ILE A CA 1 +ATOM 3599 C C . ILE A 1 230 ? 0.692 15.059 -7.132 1.00 16.41 ? 229 ILE A C 1 +ATOM 3600 O O . ILE A 1 230 ? -0.156 15.951 -7.053 1.00 21.01 ? 229 ILE A O 1 +ATOM 3601 C CB . ILE A 1 230 ? 1.626 14.973 -4.803 1.00 20.25 ? 229 ILE A CB 1 +ATOM 3602 C CG1 . ILE A 1 230 ? 2.954 14.779 -4.055 1.00 23.03 ? 229 ILE A CG1 1 +ATOM 3603 C CG2 . ILE A 1 230 ? 0.664 13.805 -4.542 1.00 22.91 ? 229 ILE A CG2 1 +ATOM 3604 C CD1 . ILE A 1 230 ? 2.833 14.699 -2.589 1.00 21.87 ? 229 ILE A CD1 1 +ATOM 3605 H H . ILE A 1 230 ? 2.088 17.056 -6.480 1.00 16.93 ? 229 ILE A H 1 +ATOM 3606 H HA . ILE A 1 230 ? 2.516 14.364 -6.552 1.00 18.41 ? 229 ILE A HA 1 +ATOM 3607 H HB . ILE A 1 230 ? 1.212 15.796 -4.499 1.00 24.30 ? 229 ILE A HB 1 +ATOM 3608 H HG12 . ILE A 1 230 ? 3.364 13.954 -4.361 1.00 27.64 ? 229 ILE A HG12 1 +ATOM 3609 H HG13 . ILE A 1 230 ? 3.537 15.527 -4.260 1.00 27.64 ? 229 ILE A HG13 1 +ATOM 3610 H HG21 . ILE A 1 230 ? 0.485 13.751 -3.590 1.00 27.50 ? 229 ILE A HG21 1 +ATOM 3611 H HG22 . ILE A 1 230 ? -0.161 13.962 -5.026 1.00 27.50 ? 229 ILE A HG22 1 +ATOM 3612 H HG23 . ILE A 1 230 ? 1.077 12.983 -4.848 1.00 27.50 ? 229 ILE A HG23 1 +ATOM 3613 H HD11 . ILE A 1 230 ? 3.716 14.577 -2.206 1.00 26.24 ? 229 ILE A HD11 1 +ATOM 3614 H HD12 . ILE A 1 230 ? 2.439 15.522 -2.260 1.00 26.24 ? 229 ILE A HD12 1 +ATOM 3615 H HD13 . ILE A 1 230 ? 2.266 13.946 -2.361 1.00 26.24 ? 229 ILE A HD13 1 +ATOM 3616 N N . THR A 1 231 ? 0.612 14.027 -7.963 1.00 19.63 ? 230 THR A N 1 +ATOM 3617 C CA . THR A 1 231 ? -0.365 13.952 -9.033 1.00 29.87 ? 230 THR A CA 1 +ATOM 3618 C C . THR A 1 231 ? -1.766 13.725 -8.525 1.00 31.95 ? 230 THR A C 1 +ATOM 3619 O O . THR A 1 231 ? -1.983 12.946 -7.600 1.00 36.23 ? 230 THR A O 1 +ATOM 3620 C CB . THR A 1 231 ? -0.003 12.797 -9.976 1.00 37.77 ? 230 THR A CB 1 +ATOM 3621 O OG1 . THR A 1 231 ? 1.136 13.183 -10.754 1.00 52.32 ? 230 THR A OG1 1 +ATOM 3622 C CG2 . THR A 1 231 ? -1.168 12.430 -10.910 1.00 32.85 ? 230 THR A CG2 1 +ATOM 3623 H H . THR A 1 231 ? 1.129 13.341 -7.924 1.00 23.56 ? 230 THR A H 1 +ATOM 3624 H HA . THR A 1 231 ? -0.352 14.779 -9.541 1.00 35.84 ? 230 THR A HA 1 +ATOM 3625 H HB . THR A 1 231 ? 0.222 12.014 -9.449 1.00 45.33 ? 230 THR A HB 1 +ATOM 3626 H HG1 . THR A 1 231 ? 1.786 13.350 -10.248 1.00 62.78 ? 230 THR A HG1 1 +ATOM 3627 H HG21 . THR A 1 231 ? -0.909 11.698 -11.492 1.00 39.43 ? 230 THR A HG21 1 +ATOM 3628 H HG22 . THR A 1 231 ? -1.939 12.159 -10.387 1.00 39.43 ? 230 THR A HG22 1 +ATOM 3629 H HG23 . THR A 1 231 ? -1.410 13.195 -11.454 1.00 39.43 ? 230 THR A HG23 1 +ATOM 3630 N N . LEU A 1 232 ? -2.708 14.403 -9.167 1.00 39.25 ? 231 LEU A N 1 +ATOM 3631 C CA . LEU A 1 232 ? -4.122 14.281 -8.869 1.00 40.15 ? 231 LEU A CA 1 +ATOM 3632 C C . LEU A 1 232 ? -4.776 13.248 -9.789 1.00 46.12 ? 231 LEU A C 1 +ATOM 3633 O O . LEU A 1 232 ? -4.788 12.052 -9.492 1.00 52.60 ? 231 LEU A O 1 +ATOM 3634 C CB . LEU A 1 232 ? -4.779 15.650 -9.051 1.00 37.22 ? 231 LEU A CB 1 +ATOM 3635 C CG . LEU A 1 232 ? -6.294 15.754 -8.871 1.00 46.02 ? 231 LEU A CG 1 +ATOM 3636 C CD1 . LEU A 1 232 ? -6.819 14.891 -7.702 1.00 46.37 ? 231 LEU A CD1 1 +ATOM 3637 C CD2 . LEU A 1 232 ? -6.668 17.234 -8.695 1.00 46.85 ? 231 LEU A CD2 1 +ATOM 3638 H H . LEU A 1 232 ? -2.543 14.960 -9.802 1.00 47.10 ? 231 LEU A H 1 +ATOM 3639 H HA . LEU A 1 232 ? -4.240 13.998 -7.949 1.00 48.18 ? 231 LEU A HA 1 +ATOM 3640 H HB2 . LEU A 1 232 ? -4.377 16.260 -8.413 1.00 44.66 ? 231 LEU A HB2 1 +ATOM 3641 H HB3 . LEU A 1 232 ? -4.581 15.958 -9.950 1.00 44.66 ? 231 LEU A HB3 1 +ATOM 3642 H HG . LEU A 1 232 ? -6.724 15.439 -9.681 1.00 55.23 ? 231 LEU A HG 1 +ATOM 3643 H HD11 . LEU A 1 232 ? -7.781 14.998 -7.638 1.00 55.64 ? 231 LEU A HD11 1 +ATOM 3644 H HD12 . LEU A 1 232 ? -6.599 13.962 -7.874 1.00 55.64 ? 231 LEU A HD12 1 +ATOM 3645 H HD13 . LEU A 1 232 ? -6.397 15.184 -6.879 1.00 55.64 ? 231 LEU A HD13 1 +ATOM 3646 H HD21 . LEU A 1 232 ? -7.628 17.305 -8.580 1.00 56.22 ? 231 LEU A HD21 1 +ATOM 3647 H HD22 . LEU A 1 232 ? -6.214 17.583 -7.913 1.00 56.22 ? 231 LEU A HD22 1 +ATOM 3648 H HD23 . LEU A 1 232 ? -6.392 17.724 -9.485 1.00 56.22 ? 231 LEU A HD23 1 +HETATM 3649 O O . HOH B 2 . ? 16.109 35.961 2.353 1.00 13.96 ? 301 HOH A O 1 +HETATM 3650 O O . HOH B 2 . ? 8.126 29.114 7.029 1.00 13.38 ? 302 HOH A O 1 +HETATM 3651 O O . HOH B 2 . ? 8.473 34.452 -5.601 1.00 13.09 ? 303 HOH A O 1 +HETATM 3652 O O . HOH B 2 . ? 10.775 31.631 9.097 1.00 12.25 ? 304 HOH A O 1 +HETATM 3653 O O . HOH B 2 . ? -4.928 31.430 6.331 1.00 14.29 ? 305 HOH A O 1 +HETATM 3654 O O . HOH B 2 . ? 16.385 32.304 5.352 1.00 11.56 ? 306 HOH A O 1 +HETATM 3655 O O . HOH B 2 . ? 5.189 20.177 3.855 1.00 11.63 ? 307 HOH A O 1 +HETATM 3656 O O . HOH B 2 . ? 6.194 32.265 3.178 1.00 16.11 ? 308 HOH A O 1 +HETATM 3657 O O . HOH B 2 . ? 16.356 47.181 -2.364 1.00 14.97 ? 309 HOH A O 1 +HETATM 3658 O O . HOH B 2 . ? 15.116 36.430 -1.081 1.00 13.91 ? 310 HOH A O 1 +HETATM 3659 O O . HOH B 2 . ? 5.272 21.705 16.943 1.00 20.08 ? 311 HOH A O 1 +HETATM 3660 O O . HOH B 2 . ? 13.116 10.994 6.040 1.00 14.86 ? 312 HOH A O 1 +HETATM 3661 O O . HOH B 2 . ? 8.353 42.688 -8.098 1.00 18.49 ? 313 HOH A O 1 +HETATM 3662 O O . HOH B 2 . ? 15.261 30.973 8.676 1.00 19.18 ? 314 HOH A O 1 +HETATM 3663 O O . HOH B 2 . ? 13.035 32.228 7.646 1.00 12.84 ? 315 HOH A O 1 +HETATM 3664 O O . HOH B 2 . ? 13.731 36.867 -7.210 1.00 14.30 ? 316 HOH A O 1 +HETATM 3665 O O . HOH B 2 . ? 9.761 12.825 1.621 1.00 15.51 ? 317 HOH A O 1 +HETATM 3666 O O . HOH B 2 . ? 14.554 39.598 -9.940 1.00 21.63 ? 318 HOH A O 1 +HETATM 3667 O O . HOH B 2 . ? -1.402 20.425 7.929 1.00 16.37 ? 319 HOH A O 1 +HETATM 3668 O O . HOH B 2 . ? -3.182 19.467 6.309 1.00 19.89 ? 320 HOH A O 1 +HETATM 3669 O O . HOH B 2 . ? 20.034 46.500 -4.849 1.00 23.37 ? 321 HOH A O 1 +HETATM 3670 O O . HOH B 2 . ? -6.081 31.119 13.643 1.00 18.53 ? 322 HOH A O 1 +HETATM 3671 O O . HOH B 2 . ? -3.734 24.895 2.364 1.00 21.28 ? 323 HOH A O 1 +HETATM 3672 O O . HOH B 2 . ? 17.429 35.329 -1.519 1.00 18.08 ? 324 HOH A O 1 +HETATM 3673 O O . HOH B 2 . ? -7.962 31.194 10.238 1.00 21.36 ? 325 HOH A O 1 +HETATM 3674 O O . HOH B 2 . ? 28.129 31.653 -0.902 1.00 23.47 ? 326 HOH A O 1 +HETATM 3675 O O . HOH B 2 . ? -7.528 30.794 4.420 1.00 24.02 ? 327 HOH A O 1 +HETATM 3676 O O . HOH B 2 . ? 16.826 41.559 -7.913 1.00 19.08 ? 328 HOH A O 1 +HETATM 3677 O O . HOH B 2 . ? 3.451 44.516 -3.793 1.00 19.13 ? 329 HOH A O 1 +HETATM 3678 O O . HOH B 2 . ? -1.697 19.478 13.713 1.00 27.39 ? 330 HOH A O 1 +HETATM 3679 O O . HOH B 2 . ? -6.980 18.334 -4.978 1.00 21.76 ? 331 HOH A O 1 +HETATM 3680 O O . HOH B 2 . ? 14.568 25.915 -7.101 1.00 17.77 ? 332 HOH A O 1 +HETATM 3681 O O . HOH B 2 . ? 16.066 32.620 16.324 1.00 30.32 ? 333 HOH A O 1 +HETATM 3682 O O . HOH B 2 . ? 15.078 39.755 -6.899 1.00 17.53 ? 334 HOH A O 1 +HETATM 3683 O O . HOH B 2 . ? 19.809 49.945 9.481 1.00 26.78 ? 335 HOH A O 1 +HETATM 3684 O O . HOH B 2 . ? 8.254 10.773 -1.468 1.00 19.25 ? 336 HOH A O 1 +HETATM 3685 O O . HOH B 2 . ? 9.946 15.880 -6.140 1.00 22.36 ? 337 HOH A O 1 +HETATM 3686 O O . HOH B 2 . ? -2.166 42.553 10.542 1.00 27.35 ? 338 HOH A O 1 +HETATM 3687 O O . HOH B 2 . ? 15.806 11.381 8.626 1.00 21.45 ? 339 HOH A O 1 +HETATM 3688 O O . HOH B 2 . ? 28.145 41.892 -1.918 1.00 26.80 ? 340 HOH A O 1 +HETATM 3689 O O . HOH B 2 . ? 14.343 49.709 -2.321 1.00 25.75 ? 341 HOH A O 1 +HETATM 3690 O O . HOH B 2 . ? 18.439 21.394 3.165 1.00 31.79 ? 342 HOH A O 1 +HETATM 3691 O O . HOH B 2 . ? -3.208 38.130 2.149 1.00 23.03 ? 343 HOH A O 1 +HETATM 3692 O O . HOH B 2 . ? 9.387 11.263 13.317 1.00 25.71 ? 344 HOH A O 1 +HETATM 3693 O O . HOH B 2 . ? 26.574 33.505 7.666 1.00 21.15 ? 345 HOH A O 1 +HETATM 3694 O O . HOH B 2 . ? 17.754 38.720 18.381 1.00 22.94 ? 346 HOH A O 1 +HETATM 3695 O O . HOH B 2 . ? 0.024 43.393 -7.655 1.00 26.29 ? 347 HOH A O 1 +HETATM 3696 O O . HOH B 2 . ? -5.901 33.644 13.486 1.00 20.15 ? 348 HOH A O 1 +HETATM 3697 O O . HOH B 2 . ? -2.185 43.430 4.962 1.00 39.40 ? 349 HOH A O 1 +HETATM 3698 O O . HOH B 2 . ? 6.368 12.437 -4.573 1.00 20.74 ? 350 HOH A O 1 +HETATM 3699 O O . HOH B 2 . ? 10.918 17.254 -3.526 1.00 26.35 ? 351 HOH A O 1 +HETATM 3700 O O . HOH B 2 . ? 19.200 48.199 -2.583 1.00 28.85 ? 352 HOH A O 1 +HETATM 3701 O O . HOH B 2 . ? 18.096 19.870 0.908 1.00 24.42 ? 353 HOH A O 1 +HETATM 3702 O O . HOH B 2 . ? 11.822 21.911 -12.343 1.00 21.57 ? 354 HOH A O 1 +HETATM 3703 O O . HOH B 2 . ? 6.183 38.366 21.683 1.00 24.62 ? 355 HOH A O 1 +HETATM 3704 O O . HOH B 2 . ? 1.840 48.539 -3.217 1.00 33.22 ? 356 HOH A O 1 +HETATM 3705 O O . HOH B 2 . ? 12.557 51.987 0.715 1.00 23.55 ? 357 HOH A O 1 +HETATM 3706 O O . HOH B 2 . ? 15.204 23.368 12.131 1.00 24.06 ? 358 HOH A O 1 +HETATM 3707 O O . HOH B 2 . ? 6.952 28.357 -9.664 1.00 28.42 ? 359 HOH A O 1 +HETATM 3708 O O . HOH B 2 . ? 26.394 48.010 12.417 1.00 24.10 ? 360 HOH A O 1 +HETATM 3709 O O . HOH B 2 . ? 16.204 50.200 -0.046 1.00 35.65 ? 361 HOH A O 1 +HETATM 3710 O O . HOH B 2 . ? 6.351 43.539 13.415 1.00 26.40 ? 362 HOH A O 1 +HETATM 3711 O O . HOH B 2 . ? 34.420 33.610 7.504 1.00 28.90 ? 363 HOH A O 1 +HETATM 3712 O O . HOH B 2 . ? 1.162 20.368 16.159 1.00 32.01 ? 364 HOH A O 1 +HETATM 3713 O O . HOH B 2 . ? -0.347 41.843 12.397 1.00 22.41 ? 365 HOH A O 1 +HETATM 3714 O O . HOH B 2 . ? -11.179 35.345 7.805 1.00 41.19 ? 366 HOH A O 1 +HETATM 3715 O O . HOH B 2 . ? 29.751 32.155 0.982 1.00 29.74 ? 367 HOH A O 1 +HETATM 3716 O O . HOH B 2 . ? 24.840 24.486 -3.800 1.00 33.28 ? 368 HOH A O 1 +HETATM 3717 O O . HOH B 2 . ? 7.440 36.621 -9.220 1.00 21.44 ? 369 HOH A O 1 +HETATM 3718 O O . HOH B 2 . ? 1.262 44.542 -5.359 1.00 29.09 ? 370 HOH A O 1 +HETATM 3719 O O . HOH B 2 . ? -5.633 38.385 2.912 1.00 31.46 ? 371 HOH A O 1 +HETATM 3720 O O . HOH B 2 . ? 15.160 48.400 -9.468 1.00 29.82 ? 372 HOH A O 1 +HETATM 3721 O O . HOH B 2 . ? 3.086 37.544 -9.336 1.00 32.88 ? 373 HOH A O 1 +HETATM 3722 O O . HOH B 2 . ? 6.664 31.514 0.715 1.00 32.87 ? 374 HOH A O 1 +HETATM 3723 O O . HOH B 2 . ? 27.662 29.031 -5.063 1.00 36.45 ? 375 HOH A O 1 +HETATM 3724 O O . HOH B 2 . ? 0.787 43.761 0.099 1.00 27.97 ? 376 HOH A O 1 +HETATM 3725 O O . HOH B 2 . ? 4.255 10.789 -3.890 1.00 37.06 ? 377 HOH A O 1 +HETATM 3726 O O . HOH B 2 . ? -8.039 21.684 -3.447 1.00 31.45 ? 378 HOH A O 1 +HETATM 3727 O O . HOH B 2 . ? 12.864 22.403 17.020 1.00 34.28 ? 379 HOH A O 1 +HETATM 3728 O O . HOH B 2 . ? 0.094 44.963 4.974 1.00 44.64 ? 380 HOH A O 1 +HETATM 3729 O O . HOH B 2 . ? 6.407 57.591 6.894 1.00 33.26 ? 381 HOH A O 1 +HETATM 3730 O O . HOH B 2 . ? -1.343 31.071 21.675 1.00 25.33 ? 382 HOH A O 1 +HETATM 3731 O O . HOH B 2 . ? 13.269 27.770 -8.581 1.00 27.74 ? 383 HOH A O 1 +HETATM 3732 O O . HOH B 2 . ? -9.527 29.409 11.897 1.00 36.57 ? 384 HOH A O 1 +HETATM 3733 O O . HOH B 2 . ? -0.123 18.683 -7.960 1.00 29.69 ? 385 HOH A O 1 +HETATM 3734 O O . HOH B 2 . ? 6.667 10.370 5.043 1.00 33.14 ? 386 HOH A O 1 +HETATM 3735 O O . HOH B 2 . ? 14.493 19.053 -0.296 1.00 25.20 ? 387 HOH A O 1 +HETATM 3736 O O . HOH B 2 . ? -0.548 23.398 -9.136 1.00 30.45 ? 388 HOH A O 1 +HETATM 3737 O O . HOH B 2 . ? -12.154 30.512 9.216 1.00 37.19 ? 389 HOH A O 1 +HETATM 3738 O O . HOH B 2 . ? 7.532 16.484 -6.776 1.00 28.87 ? 390 HOH A O 1 +HETATM 3739 O O . HOH B 2 . ? 9.186 47.189 15.746 1.00 38.04 ? 391 HOH A O 1 +HETATM 3740 O O . HOH B 2 . ? 22.462 38.624 13.975 1.00 38.23 ? 392 HOH A O 1 +HETATM 3741 O O . HOH B 2 . ? 5.680 50.632 -6.054 1.00 30.69 ? 393 HOH A O 1 +HETATM 3742 O O . HOH B 2 . ? 18.439 25.897 16.308 1.00 40.17 ? 394 HOH A O 1 +HETATM 3743 O O . HOH B 2 . ? 24.313 25.339 -7.068 1.00 35.20 ? 395 HOH A O 1 +HETATM 3744 O O . HOH B 2 . ? -3.927 41.742 14.869 1.00 34.70 ? 396 HOH A O 1 +HETATM 3745 O O . HOH B 2 . ? -1.464 40.838 15.209 1.00 32.29 ? 397 HOH A O 1 +HETATM 3746 O O . HOH B 2 . ? 27.759 32.412 10.159 1.00 27.67 ? 398 HOH A O 1 +HETATM 3747 O O . HOH B 2 . ? 25.229 29.863 -4.938 1.00 28.08 ? 399 HOH A O 1 +HETATM 3748 O O . HOH B 2 . ? -6.386 25.297 5.957 1.00 38.93 ? 400 HOH A O 1 +HETATM 3749 O O . HOH B 2 . ? -7.747 37.462 1.609 1.00 28.26 ? 401 HOH A O 1 +HETATM 3750 O O . HOH B 2 . ? 8.854 45.740 -8.376 1.00 34.24 ? 402 HOH A O 1 +HETATM 3751 O O . HOH B 2 . ? 5.993 47.615 -8.104 1.00 39.84 ? 403 HOH A O 1 +HETATM 3752 O O . HOH B 2 . ? 27.691 39.476 -5.757 1.00 32.46 ? 404 HOH A O 1 +HETATM 3753 O O . HOH B 2 . ? 0.165 17.948 16.582 1.00 36.20 ? 405 HOH A O 1 +HETATM 3754 O O . HOH B 2 . ? 12.705 45.977 13.791 1.00 32.30 ? 406 HOH A O 1 +HETATM 3755 O O . HOH B 2 . ? -0.114 44.362 13.169 1.00 43.09 ? 407 HOH A O 1 +HETATM 3756 O O . HOH B 2 . ? 29.720 44.977 13.838 1.00 41.32 ? 408 HOH A O 1 +HETATM 3757 O O . HOH B 2 . ? 28.408 48.735 10.643 1.00 45.07 ? 409 HOH A O 1 +HETATM 3758 O O . HOH B 2 . ? 13.678 23.643 -10.704 1.00 45.45 ? 410 HOH A O 1 +HETATM 3759 O O . HOH B 2 . ? 21.298 53.935 8.502 1.00 35.33 ? 411 HOH A O 1 +HETATM 3760 O O . HOH B 2 . ? -1.625 45.000 9.292 1.00 42.19 ? 412 HOH A O 1 +HETATM 3761 O O . HOH B 2 . ? 11.217 9.504 4.949 1.00 19.36 ? 413 HOH A O 1 +HETATM 3762 O O . HOH B 2 . ? 7.902 29.167 -0.335 1.00 26.22 ? 414 HOH A O 1 +HETATM 3763 O O . HOH B 2 . ? -0.278 11.239 -1.719 1.00 30.85 ? 415 HOH A O 1 +HETATM 3764 O O . HOH B 2 . ? 7.245 9.828 3.001 1.00 45.11 ? 416 HOH A O 1 +HETATM 3765 O O . HOH B 2 . ? 15.727 28.570 -10.388 1.00 34.32 ? 417 HOH A O 1 +HETATM 3766 O O . HOH B 2 . ? 0.847 30.405 23.734 1.00 29.68 ? 418 HOH A O 1 +HETATM 3767 O O . HOH B 2 . ? 3.676 31.012 2.267 1.00 33.06 ? 419 HOH A O 1 +HETATM 3768 O O . HOH B 2 . ? -0.110 44.634 -2.494 1.00 45.59 ? 420 HOH A O 1 +HETATM 3769 O O . HOH B 2 . ? 31.744 32.367 4.664 1.00 39.39 ? 421 HOH A O 1 +HETATM 3770 O O . HOH B 2 . ? 1.422 32.365 0.959 1.00 30.44 ? 422 HOH A O 1 +HETATM 3771 O O . HOH B 2 . ? 28.363 39.239 10.231 1.00 32.15 ? 423 HOH A O 1 +HETATM 3772 O O . HOH B 2 . ? 29.057 30.871 -2.866 1.00 29.47 ? 424 HOH A O 1 +HETATM 3773 O O . HOH B 2 . ? -2.308 43.006 -7.624 1.00 39.20 ? 425 HOH A O 1 +HETATM 3774 O O . HOH B 2 . ? 5.042 30.278 -9.625 1.00 30.24 ? 426 HOH A O 1 +HETATM 3775 O O . HOH B 2 . ? 2.185 10.699 -2.621 1.00 39.82 ? 427 HOH A O 1 +HETATM 3776 O O . HOH B 2 . ? -7.760 26.201 -1.115 1.00 37.98 ? 428 HOH A O 1 +HETATM 3777 O O . HOH B 2 . ? 19.045 50.552 1.456 1.00 43.46 ? 429 HOH A O 1 +HETATM 3778 O O . HOH B 2 . ? 14.323 50.642 -4.704 1.00 35.86 ? 430 HOH A O 1 +HETATM 3779 O O . HOH B 2 . ? 28.704 45.684 16.238 1.00 34.46 ? 431 HOH A O 1 +HETATM 3780 O O . HOH B 2 . ? 0.702 45.430 2.504 1.00 34.56 ? 432 HOH A O 1 +HETATM 3781 O O . HOH B 2 . ? 8.142 49.709 -6.614 1.00 43.16 ? 433 HOH A O 1 +HETATM 3782 O O . HOH B 2 . ? -3.013 43.345 7.334 1.00 44.70 ? 434 HOH A O 1 +HETATM 3783 O O . HOH B 2 . ? 3.746 19.774 17.171 1.00 43.44 ? 435 HOH A O 1 +HETATM 3784 O O . HOH B 2 . ? -8.811 33.658 10.524 1.00 40.11 ? 436 HOH A O 1 +HETATM 3785 O O . HOH B 2 . ? 16.609 7.093 9.753 1.00 42.27 ? 437 HOH A O 1 +HETATM 3786 O O . HOH B 2 . ? 7.442 40.199 -9.683 1.00 38.41 ? 438 HOH A O 1 +HETATM 3787 O O . HOH B 2 . ? 29.709 33.450 11.711 1.00 44.23 ? 439 HOH A O 1 +HETATM 3788 O O . HOH B 2 . ? -6.104 40.261 9.578 1.00 39.15 ? 440 HOH A O 1 +HETATM 3789 O O . HOH B 2 . ? 8.970 9.884 6.468 1.00 35.58 ? 441 HOH A O 1 +HETATM 3790 O O . HOH B 2 . ? 12.809 23.910 19.458 1.00 33.02 ? 442 HOH A O 1 +HETATM 3791 O O . HOH B 2 . ? -5.715 14.500 1.201 1.00 37.85 ? 443 HOH A O 1 +HETATM 3792 O O . HOH B 2 . ? -5.053 26.481 18.956 1.00 37.39 ? 444 HOH A O 1 +HETATM 3793 O O . HOH B 2 . ? 2.662 48.531 8.325 1.00 38.48 ? 445 HOH A O 1 +HETATM 3794 O O . HOH B 2 . ? 25.999 32.120 12.039 1.00 33.19 ? 446 HOH A O 1 +HETATM 3795 O O . HOH B 2 . ? 20.142 21.276 4.645 1.00 37.33 ? 447 HOH A O 1 +HETATM 3796 O O . HOH B 2 . ? 35.563 37.367 2.666 1.00 47.47 ? 448 HOH A O 1 +HETATM 3797 O O . HOH B 2 . ? 13.149 26.400 20.051 1.00 40.56 ? 449 HOH A O 1 +HETATM 3798 O O . HOH B 2 . ? -8.579 30.063 14.213 1.00 38.58 ? 450 HOH A O 1 +HETATM 3799 O O . HOH B 2 . ? 29.282 41.435 13.988 1.00 36.18 ? 451 HOH A O 1 +HETATM 3800 O O . HOH B 2 . ? 16.560 24.044 -7.285 1.00 40.05 ? 452 HOH A O 1 +HETATM 3801 O O . HOH B 2 . ? 16.585 46.492 -5.045 1.00 33.85 ? 453 HOH A O 1 +HETATM 3802 O O . HOH B 2 . ? 27.181 35.373 -9.596 1.00 36.07 ? 454 HOH A O 1 +HETATM 3803 O O . HOH B 2 . ? 14.475 53.336 7.412 1.00 37.57 ? 455 HOH A O 1 +HETATM 3804 O O . HOH B 2 . ? 5.335 47.415 8.745 1.00 31.30 ? 456 HOH A O 1 +HETATM 3805 O O . HOH B 2 . ? 18.036 48.440 0.218 1.00 36.95 ? 457 HOH A O 1 +HETATM 3806 O O . HOH B 2 . ? 16.540 18.043 1.035 1.00 33.95 ? 458 HOH A O 1 +HETATM 3807 O O . HOH B 2 . ? -4.273 28.891 18.404 1.00 41.53 ? 459 HOH A O 1 +HETATM 3808 O O . HOH B 2 . ? 27.326 43.262 -10.939 1.00 38.78 ? 460 HOH A O 1 +HETATM 3809 O O . HOH B 2 . ? -8.429 37.713 13.414 1.00 45.86 ? 461 HOH A O 1 +HETATM 3810 O O . HOH B 2 . ? 11.282 22.621 21.115 1.00 33.00 ? 462 HOH A O 1 +HETATM 3811 O O . HOH B 2 . ? 0.878 48.196 2.454 1.00 42.75 ? 463 HOH A O 1 +HETATM 3812 O O . HOH B 2 . ? -7.974 35.118 13.194 1.00 47.30 ? 464 HOH A O 1 +HETATM 3813 O O . HOH B 2 . ? 22.028 40.861 15.063 1.00 43.96 ? 465 HOH A O 1 +HETATM 3814 O O . HOH B 2 . ? -5.123 30.954 16.408 1.00 38.64 ? 466 HOH A O 1 +HETATM 3815 O O . HOH B 2 . ? -4.589 31.758 -5.520 1.00 27.92 ? 467 HOH A O 1 +HETATM 3816 O O . HOH B 2 . ? 33.013 35.996 -0.988 1.00 43.74 ? 468 HOH A O 1 +HETATM 3817 O O . HOH B 2 . ? 16.656 24.496 17.243 1.00 54.22 ? 469 HOH A O 1 +HETATM 3818 O O . HOH B 2 . ? 12.897 43.078 15.244 1.00 30.73 ? 470 HOH A O 1 +HETATM 3819 O O . HOH B 2 . ? 15.055 18.939 9.562 1.00 30.85 ? 471 HOH A O 1 +HETATM 3820 O O . HOH B 2 . ? 13.339 4.058 9.695 1.00 50.77 ? 472 HOH A O 1 +HETATM 3821 O O . HOH B 2 . ? 7.747 29.054 21.177 1.00 42.97 ? 473 HOH A O 1 +HETATM 3822 O O . HOH B 2 . ? 3.337 11.721 8.580 1.00 41.98 ? 474 HOH A O 1 +HETATM 3823 O O . HOH B 2 . ? 18.126 23.704 -4.842 1.00 36.02 ? 475 HOH A O 1 +HETATM 3824 O O . HOH B 2 . ? -2.652 12.194 -2.717 1.00 42.79 ? 476 HOH A O 1 +HETATM 3825 O O . HOH B 2 . ? 17.372 22.834 14.986 1.00 49.56 ? 477 HOH A O 1 +HETATM 3826 O O . HOH B 2 . ? 2.498 30.631 22.031 1.00 43.08 ? 478 HOH A O 1 +HETATM 3827 O O . HOH B 2 . ? 1.568 25.233 4.387 1.00 10.65 ? 479 HOH A O 1 +HETATM 3828 O O . HOH B 2 . ? 24.934 34.540 -9.973 1.00 24.30 ? 480 HOH A O 1 +HETATM 3829 O O . HOH B 2 . ? 14.211 33.673 16.999 1.00 31.69 ? 481 HOH A O 1 +HETATM 3830 O O . HOH B 2 . ? -3.570 32.017 23.499 1.00 31.91 ? 482 HOH A O 1 +HETATM 3831 O O . HOH B 2 . ? 1.608 12.152 5.566 1.00 31.76 ? 483 HOH A O 1 +HETATM 3832 O O . HOH B 2 . ? 5.048 51.662 12.029 1.00 40.34 ? 484 HOH A O 1 +HETATM 3833 O O . HOH B 2 . ? 12.626 25.843 -11.726 1.00 43.88 ? 485 HOH A O 1 +HETATM 3834 O O . HOH B 2 . ? 8.565 28.920 -11.766 1.00 33.04 ? 486 HOH A O 1 +HETATM 3835 O O . HOH B 2 . ? 14.228 25.869 -9.907 1.00 35.68 ? 487 HOH A O 1 +HETATM 3836 O O . HOH B 2 . ? 23.836 48.512 8.838 1.00 26.41 ? 488 HOH A O 1 +HETATM 3837 O O . HOH B 2 . ? 26.076 49.952 8.665 1.00 38.32 ? 489 HOH A O 1 +HETATM 3838 O O . HOH B 2 . ? 22.701 50.585 7.446 1.00 43.53 ? 490 HOH A O 1 +HETATM 3839 O O . HOH B 2 . ? 8.973 19.330 -10.968 1.00 36.49 ? 491 HOH A O 1 +HETATM 3840 O O . HOH B 2 . ? 22.071 24.844 6.276 1.00 51.24 ? 492 HOH A O 1 +HETATM 3841 O O . HOH B 2 . ? 7.054 48.311 14.125 1.00 37.90 ? 493 HOH A O 1 +HETATM 3842 O O . HOH B 2 . ? 15.637 34.724 -14.264 1.00 38.56 ? 494 HOH A O 1 +HETATM 3843 O O . HOH B 2 . ? -1.756 11.378 6.941 1.00 42.29 ? 495 HOH A O 1 +HETATM 3844 O O . HOH B 2 . ? 11.605 19.437 -11.301 1.00 45.19 ? 496 HOH A O 1 +HETATM 3845 O O . HOH B 2 . ? 17.811 33.485 -14.890 1.00 42.95 ? 497 HOH A O 1 +HETATM 3846 O O . HOH B 2 . ? 15.339 17.301 -1.997 1.00 41.79 ? 498 HOH A O 1 +HETATM 3847 O O . HOH B 2 . ? 26.846 39.917 -11.448 1.00 46.47 ? 499 HOH A O 1 +HETATM 3848 O O . HOH B 2 . ? 18.981 50.358 -3.698 1.00 42.85 ? 500 HOH A O 1 +HETATM 3849 O O . HOH B 2 . ? 17.309 43.480 -16.097 1.00 38.52 ? 501 HOH A O 1 +HETATM 3850 O O . HOH B 2 . ? 2.641 51.104 7.991 1.00 38.65 ? 502 HOH A O 1 +HETATM 3851 O O . HOH B 2 . ? 23.878 50.492 2.587 1.00 37.75 ? 503 HOH A O 1 +HETATM 3852 O O . HOH B 2 . ? -6.358 29.766 -5.180 1.00 47.79 ? 504 HOH A O 1 +HETATM 3853 O O . HOH B 2 . ? 13.610 18.426 -10.147 1.00 45.15 ? 505 HOH A O 1 +HETATM 3854 O O . HOH B 2 . ? 4.578 19.976 23.046 1.00 46.91 ? 506 HOH A O 1 +HETATM 3855 O O . HOH B 2 . ? 26.054 48.060 2.002 1.00 48.69 ? 507 HOH A O 1 +HETATM 3856 O O . HOH B 2 . ? 19.552 31.538 -14.059 1.00 46.01 ? 508 HOH A O 1 +HETATM 3857 O O . HOH B 2 . ? -7.322 26.995 4.404 1.00 43.96 ? 509 HOH A O 1 +HETATM 3858 O O . HOH B 2 . ? -0.513 13.625 12.477 1.00 42.96 ? 510 HOH A O 1 +HETATM 3859 O O . HOH B 2 . ? -9.175 16.778 -5.052 1.00 43.93 ? 511 HOH A O 1 +HETATM 3860 O O . HOH B 2 . ? 6.542 36.976 -11.686 1.00 40.78 ? 512 HOH A O 1 +HETATM 3861 O O . HOH B 2 . ? -0.589 16.199 12.501 1.00 48.92 ? 513 HOH A O 1 +HETATM 3862 O O . HOH B 2 . ? -2.407 21.376 16.433 1.00 33.94 ? 514 HOH A O 1 +HETATM 3863 O O . HOH B 2 . ? 30.608 48.809 11.596 1.00 49.83 ? 515 HOH A O 1 +HETATM 3864 O O . HOH B 2 . ? 23.826 49.580 12.514 1.00 39.87 ? 516 HOH A O 1 +HETATM 3865 O O . HOH B 2 . ? 17.982 27.980 -11.547 1.00 47.77 ? 517 HOH A O 1 +HETATM 3866 O O . HOH B 2 . ? 21.263 28.050 12.694 1.00 50.42 ? 518 HOH A O 1 +HETATM 3867 O O . HOH B 2 . ? 34.100 35.787 8.464 1.00 48.88 ? 519 HOH A O 1 +HETATM 3868 O O . HOH B 2 . ? 23.761 36.033 -15.365 1.00 40.05 ? 520 HOH A O 1 +HETATM 3869 O O . HOH B 2 . ? 15.805 3.602 10.499 1.00 54.00 ? 521 HOH A O 1 +HETATM 3870 O O . HOH B 2 . ? 6.760 59.548 1.417 1.00 46.91 ? 522 HOH A O 1 +HETATM 3871 O O . HOH B 2 . ? -1.121 21.688 -7.220 1.00 22.96 ? 523 HOH A O 1 +HETATM 3872 O O . HOH B 2 . ? 2.338 12.003 -7.509 1.00 33.26 ? 524 HOH A O 1 +HETATM 3873 O O . HOH B 2 . ? 20.559 28.296 -12.813 1.00 39.76 ? 525 HOH A O 1 +HETATM 3874 O O . HOH B 2 . ? -3.429 27.888 -6.783 1.00 50.39 ? 526 HOH A O 1 +HETATM 3875 O O . HOH B 2 . ? -7.001 24.112 -2.013 1.00 50.30 ? 527 HOH A O 1 +HETATM 3876 O O . HOH B 2 . ? 24.425 50.815 5.072 1.00 37.94 ? 528 HOH A O 1 +HETATM 3877 O O . HOH B 2 . ? 18.557 40.957 -15.020 1.00 45.61 ? 529 HOH A O 1 +HETATM 3878 O O . HOH B 2 . ? -8.133 38.007 10.648 1.00 38.65 ? 530 HOH A O 1 +HETATM 3879 O O . HOH B 2 . ? 34.514 40.013 2.980 1.00 50.69 ? 531 HOH A O 1 +HETATM 3880 O O . HOH B 2 . ? 7.679 55.825 -0.462 1.00 49.44 ? 532 HOH A O 1 +HETATM 3881 O O . HOH B 2 . ? 0.636 41.062 -8.721 1.00 26.58 ? 533 HOH A O 1 +HETATM 3882 O O . HOH B 2 . ? -2.556 24.892 -9.377 1.00 28.17 ? 534 HOH A O 1 +HETATM 3883 O O . HOH B 2 . ? 21.193 28.586 10.425 1.00 32.20 ? 535 HOH A O 1 +HETATM 3884 O O . HOH B 2 . ? 19.758 25.191 -3.944 1.00 45.88 ? 536 HOH A O 1 +HETATM 3885 O O . HOH B 2 . ? 31.375 46.337 3.991 1.00 40.06 ? 537 HOH A O 1 +HETATM 3886 O O . HOH B 2 . ? 32.515 45.285 10.510 1.00 50.15 ? 538 HOH A O 1 +HETATM 3887 O O . HOH B 2 . ? -2.803 29.844 19.714 1.00 45.26 ? 539 HOH A O 1 +HETATM 3888 O O . HOH B 2 . ? 29.936 31.030 -5.205 1.00 45.67 ? 540 HOH A O 1 +HETATM 3889 O O . HOH B 2 . ? 5.688 46.370 11.507 1.00 46.50 ? 541 HOH A O 1 +HETATM 3890 O O . HOH B 2 . ? -10.578 35.243 2.061 1.00 47.98 ? 542 HOH A O 1 +HETATM 3891 O O . HOH B 2 . ? 2.778 61.195 1.595 1.00 55.00 ? 543 HOH A O 1 +HETATM 3892 O O . HOH B 2 . ? 3.350 39.778 -10.200 1.00 46.61 ? 544 HOH A O 1 +HETATM 3893 O O . HOH B 2 . ? 3.304 51.568 10.036 1.00 54.60 ? 545 HOH A O 1 +HETATM 3894 O O . HOH B 2 . ? 18.688 16.789 9.357 1.00 43.85 ? 546 HOH A O 1 +HETATM 3895 O O . HOH B 2 . ? 23.323 34.026 -14.220 1.00 53.49 ? 547 HOH A O 1 +HETATM 3896 O O . HOH B 2 . ? 1.988 8.015 0.572 1.00 49.21 ? 548 HOH A O 1 +HETATM 3897 O O . HOH B 2 . ? 16.368 20.154 11.125 1.00 58.56 ? 549 HOH A O 1 +HETATM 3898 O O . HOH B 2 . ? -11.758 18.437 -3.562 1.00 48.47 ? 550 HOH A O 1 +HETATM 3899 O O . HOH B 2 . ? -6.461 14.114 3.347 1.00 60.09 ? 551 HOH A O 1 +HETATM 3900 O O . HOH B 2 . ? 4.239 10.569 3.630 1.00 50.88 ? 552 HOH A O 1 +HETATM 3901 O O . HOH B 2 . ? 10.271 50.981 -6.588 1.00 47.68 ? 553 HOH A O 1 +HETATM 3902 O O . HOH B 2 . ? 12.428 50.948 -5.939 1.00 47.14 ? 554 HOH A O 1 +HETATM 3903 O O . HOH B 2 . ? 15.044 37.058 -14.884 1.00 45.17 ? 555 HOH A O 1 +HETATM 3904 O O . HOH B 2 . ? -1.742 28.501 21.171 1.00 43.82 ? 556 HOH A O 1 +HETATM 3905 O O . HOH B 2 . ? 1.343 12.448 11.831 1.00 47.02 ? 557 HOH A O 1 +HETATM 3906 O O . HOH B 2 . ? 1.558 28.611 20.295 1.00 47.38 ? 558 HOH A O 1 +HETATM 3907 O O . HOH B 2 . ? 1.204 38.903 -8.294 1.00 47.86 ? 559 HOH A O 1 +HETATM 3908 O O . HOH B 2 . ? 3.060 27.722 22.147 1.00 48.45 ? 560 HOH A O 1 +HETATM 3909 O O . HOH B 2 . ? 0.607 47.486 6.778 1.00 45.73 ? 561 HOH A O 1 +HETATM 3910 O O . HOH B 2 . ? 13.736 43.909 -15.190 1.00 50.29 ? 562 HOH A O 1 +HETATM 3911 O O . HOH B 2 . ? 21.774 31.665 -14.651 1.00 48.62 ? 563 HOH A O 1 +HETATM 3912 O O . HOH B 2 . ? 27.540 41.354 -13.553 1.00 50.28 ? 564 HOH A O 1 +HETATM 3913 O O . HOH B 2 . ? 1.577 10.345 3.360 1.00 57.14 ? 565 HOH A O 1 +HETATM 3914 O O . HOH B 2 . ? 0.545 26.888 21.447 1.00 44.79 ? 566 HOH A O 1 +HETATM 3915 O O . HOH B 2 . ? 22.179 27.124 9.013 1.00 44.39 ? 567 HOH A O 1 +HETATM 3916 O O . HOH B 2 . ? 30.933 46.601 9.105 1.00 58.26 ? 568 HOH A O 1 +HETATM 3917 O O . HOH B 2 . ? 14.098 55.247 1.519 1.00 52.33 ? 569 HOH A O 1 +HETATM 3918 O O . HOH B 2 . ? 7.256 51.538 13.671 1.00 41.33 ? 570 HOH A O 1 +HETATM 3919 O O . HOH B 2 . ? 10.472 40.470 -12.056 1.00 40.56 ? 571 HOH A O 1 +HETATM 3920 O O . HOH B 2 . ? 6.308 9.148 -3.016 1.00 43.86 ? 572 HOH A O 1 +HETATM 3921 O O . HOH B 2 . ? 31.432 49.249 9.583 1.00 56.70 ? 573 HOH A O 1 +HETATM 3922 O O . HOH B 2 . ? -4.531 42.021 10.626 1.00 50.52 ? 574 HOH A O 1 +HETATM 3923 O O . HOH B 2 . ? 17.088 48.547 -5.947 1.00 53.23 ? 575 HOH A O 1 +HETATM 3924 O O . HOH B 2 . ? 12.334 39.277 -12.017 1.00 43.21 ? 576 HOH A O 1 +HETATM 3925 O O . HOH B 2 . ? 14.046 53.779 -0.512 1.00 57.31 ? 577 HOH A O 1 +HETATM 3926 O O . HOH B 2 . ? 32.611 44.353 4.536 1.00 56.03 ? 578 HOH A O 1 +HETATM 3927 O O . HOH B 2 . ? -7.077 24.854 1.028 1.00 48.13 ? 579 HOH A O 1 +HETATM 3928 O O . HOH B 2 . ? -2.041 11.113 -5.885 1.00 48.03 ? 580 HOH A O 1 +HETATM 3929 O O . HOH B 2 . ? -11.017 27.276 13.176 1.00 53.67 ? 581 HOH A O 1 +HETATM 3930 O O . HOH B 2 . ? -11.744 37.885 7.361 1.00 55.43 ? 582 HOH A O 1 +HETATM 3931 O O . HOH B 2 . ? -10.006 38.479 2.477 1.00 47.42 ? 583 HOH A O 1 +HETATM 3932 O O . HOH B 2 . ? 32.540 38.308 6.847 1.00 49.77 ? 584 HOH A O 1 +HETATM 3933 O O . HOH B 2 . ? 5.306 12.623 13.526 1.00 29.43 ? 585 HOH A O 1 +HETATM 3934 O O . HOH B 2 . ? -3.803 20.861 -8.119 1.00 35.40 ? 586 HOH A O 1 +HETATM 3935 O O . HOH B 2 . ? -7.852 21.113 -5.674 1.00 38.38 ? 587 HOH A O 1 +HETATM 3936 O O . HOH B 2 . ? 5.467 24.511 22.351 1.00 38.44 ? 588 HOH A O 1 +HETATM 3937 O O . HOH B 2 . ? -5.292 23.368 4.498 1.00 35.79 ? 589 HOH A O 1 +HETATM 3938 O O . HOH B 2 . ? 5.525 27.164 20.864 1.00 28.83 ? 590 HOH A O 1 +HETATM 3939 O O . HOH B 2 . ? 9.673 10.153 2.623 1.00 29.24 ? 591 HOH A O 1 +HETATM 3940 O O . HOH B 2 . ? 1.758 22.449 -11.067 1.00 32.43 ? 592 HOH A O 1 +HETATM 3941 O O . HOH B 2 . ? 9.352 51.695 14.799 1.00 48.40 ? 593 HOH A O 1 +HETATM 3942 O O . HOH B 2 . ? 13.924 30.699 21.391 1.00 36.69 ? 594 HOH A O 1 +HETATM 3943 O O . HOH B 2 . ? -6.572 19.374 7.255 1.00 41.16 ? 595 HOH A O 1 +HETATM 3944 O O . HOH B 2 . ? 7.010 16.779 17.469 1.00 38.67 ? 596 HOH A O 1 +HETATM 3945 O O . HOH B 2 . ? 16.943 38.935 -16.242 1.00 51.85 ? 597 HOH A O 1 +HETATM 3946 O O . HOH B 2 . ? -6.979 41.259 13.536 1.00 48.11 ? 598 HOH A O 1 +HETATM 3947 O O . HOH B 2 . ? 11.541 49.998 -9.050 1.00 49.26 ? 599 HOH A O 1 +HETATM 3948 O O . HOH B 2 . ? -11.878 33.990 10.136 1.00 46.44 ? 600 HOH A O 1 +HETATM 3949 O O . HOH B 2 . ? -6.822 17.137 7.018 1.00 53.44 ? 601 HOH A O 1 +HETATM 3950 O O . HOH B 2 . ? 19.274 37.480 -18.007 1.00 47.85 ? 602 HOH A O 1 +HETATM 3951 O O . HOH B 2 . ? 34.798 38.614 5.740 1.00 52.75 ? 603 HOH A O 1 +# +loop_ +_atom_site_anisotrop.id +_atom_site_anisotrop.type_symbol +_atom_site_anisotrop.pdbx_label_atom_id +_atom_site_anisotrop.pdbx_label_alt_id +_atom_site_anisotrop.pdbx_label_comp_id +_atom_site_anisotrop.pdbx_label_asym_id +_atom_site_anisotrop.pdbx_label_seq_id +_atom_site_anisotrop.pdbx_PDB_ins_code +_atom_site_anisotrop.U[1][1] +_atom_site_anisotrop.U[2][2] +_atom_site_anisotrop.U[3][3] +_atom_site_anisotrop.U[1][2] +_atom_site_anisotrop.U[1][3] +_atom_site_anisotrop.U[2][3] +_atom_site_anisotrop.pdbx_auth_seq_id +_atom_site_anisotrop.pdbx_auth_comp_id +_atom_site_anisotrop.pdbx_auth_asym_id +_atom_site_anisotrop.pdbx_auth_atom_id +1 N N . SER A 5 ? 0.4363 0.4730 0.8536 -0.0491 0.0249 -0.0795 2 SER A N +2 C CA . SER A 5 ? 0.4424 0.4709 0.8699 -0.0465 0.0183 -0.0414 2 SER A CA +3 C C . SER A 5 ? 0.4560 0.4948 0.8406 -0.0524 0.0144 -0.0159 2 SER A C +4 O O . SER A 5 ? 0.4682 0.5166 0.8083 -0.0548 0.0166 -0.0294 2 SER A O +5 C CB . SER A 5 ? 0.3082 0.3364 0.7376 -0.0425 0.0177 -0.0446 2 SER A CB +6 O OG . SER A 5 ? 0.1885 0.2295 0.5659 -0.0467 0.0181 -0.0526 2 SER A OG +11 N N . LYS A 6 ? 0.4182 0.4579 0.8113 -0.0524 0.0088 0.0221 3 LYS A N +12 C CA . LYS A 6 ? 0.3696 0.4231 0.7131 -0.0554 0.0065 0.0445 3 LYS A CA +13 C C . LYS A 6 ? 0.1729 0.2305 0.4570 -0.0519 0.0081 0.0313 3 LYS A C +14 O O . LYS A 6 ? 0.2093 0.2728 0.4478 -0.0523 0.0107 0.0265 3 LYS A O +15 C CB . LYS A 6 ? 0.3967 0.4613 0.7609 -0.0581 0.0000 0.0873 3 LYS A CB +16 C CG . LYS A 6 ? 0.3777 0.4631 0.6861 -0.0602 -0.0022 0.1047 3 LYS A CG +21 N N . GLY A 7 ? 0.1729 0.2272 0.4637 -0.0485 0.0072 0.0254 4 GLY A N +22 C CA . GLY A 7 ? 0.1668 0.2241 0.4079 -0.0462 0.0092 0.0133 4 GLY A CA +23 C C . GLY A 7 ? 0.1985 0.2552 0.4100 -0.0457 0.0145 -0.0137 4 GLY A C +24 O O . GLY A 7 ? 0.1584 0.2186 0.3259 -0.0447 0.0167 -0.0155 4 GLY A O +28 N N . GLU A 8 ? 0.2427 0.2986 0.4837 -0.0473 0.0168 -0.0339 5 GLU A N +29 C CA . GLU A 8 ? 0.2596 0.3256 0.4774 -0.0489 0.0206 -0.0578 5 GLU A CA +30 C C . GLU A 8 ? 0.2450 0.3161 0.4270 -0.0488 0.0209 -0.0470 5 GLU A C +31 O O . GLU A 8 ? 0.2067 0.2873 0.3577 -0.0480 0.0229 -0.0546 5 GLU A O +32 C CB . GLU A 8 ? 0.3925 0.4642 0.6539 -0.0538 0.0233 -0.0825 5 GLU A CB +33 C CG . GLU A 8 ? 0.4465 0.5407 0.6873 -0.0583 0.0265 -0.1079 5 GLU A CG +40 N N . GLU A 9 ? 0.1582 0.2259 0.3484 -0.0497 0.0192 -0.0273 6 GLU A N +41 C CA . GLU A 9 ? 0.1515 0.2259 0.3150 -0.0497 0.0207 -0.0193 6 GLU A CA +42 C C . GLU A 9 ? 0.1977 0.2727 0.3202 -0.0460 0.0231 -0.0142 6 GLU A C +43 O O . GLU A 9 ? 0.2529 0.3334 0.3549 -0.0441 0.0260 -0.0142 6 GLU A O +44 C CB . GLU A 9 ? 0.1556 0.2308 0.3377 -0.0531 0.0189 0.0015 6 GLU A CB +45 C CG . GLU A 9 ? 0.2461 0.3170 0.4800 -0.0572 0.0172 -0.0010 6 GLU A CG +50 N N . LEU A 10 ? 0.1776 0.2476 0.2936 -0.0450 0.0223 -0.0105 7 LEU A N +51 C CA . LEU A 10 ? 0.1498 0.2198 0.2332 -0.0431 0.0259 -0.0090 7 LEU A CA +52 C C . LEU A 10 ? 0.1477 0.2171 0.2150 -0.0399 0.0287 -0.0221 7 LEU A C +53 O O . LEU A 10 ? 0.1981 0.2654 0.2455 -0.0381 0.0328 -0.0209 7 LEU A O +54 C CB . LEU A 10 ? 0.1519 0.2215 0.2340 -0.0447 0.0240 -0.0020 7 LEU A CB +55 C CG . LEU A 10 ? 0.1890 0.2682 0.2876 -0.0493 0.0198 0.0182 7 LEU A CG +56 C CD1 . LEU A 10 ? 0.1986 0.2829 0.3006 -0.0508 0.0162 0.0258 7 LEU A CD1 +57 C CD2 . LEU A 10 ? 0.2653 0.3589 0.3455 -0.0533 0.0232 0.0273 7 LEU A CD2 +69 N N . PHE A 11 ? 0.1460 0.2212 0.2253 -0.0407 0.0270 -0.0343 8 PHE A N +70 C CA . PHE A 11 ? 0.1457 0.2300 0.2105 -0.0401 0.0286 -0.0428 8 PHE A CA +71 C C . PHE A 11 ? 0.1639 0.2662 0.2276 -0.0409 0.0284 -0.0450 8 PHE A C +72 O O . PHE A 11 ? 0.2086 0.3293 0.2652 -0.0428 0.0282 -0.0504 8 PHE A O +73 C CB . PHE A 11 ? 0.1455 0.2345 0.2215 -0.0428 0.0276 -0.0577 8 PHE A CB +74 C CG . PHE A 11 ? 0.1455 0.2214 0.2212 -0.0416 0.0274 -0.0538 8 PHE A CG +75 C CD1 . PHE A 11 ? 0.1462 0.2216 0.2021 -0.0410 0.0296 -0.0536 8 PHE A CD1 +76 C CD2 . PHE A 11 ? 0.1459 0.2133 0.2445 -0.0417 0.0245 -0.0472 8 PHE A CD2 +77 C CE1 . PHE A 11 ? 0.1591 0.2263 0.2148 -0.0409 0.0292 -0.0507 8 PHE A CE1 +78 C CE2 . PHE A 11 ? 0.1466 0.2089 0.2459 -0.0412 0.0230 -0.0406 8 PHE A CE2 +79 C CZ . PHE A 11 ? 0.1464 0.2090 0.2230 -0.0410 0.0255 -0.0442 8 PHE A CZ +89 N N . THR A 12 ? 0.2190 0.3216 0.2896 -0.0404 0.0281 -0.0390 9 THR A N +90 C CA . THR A 12 ? 0.2790 0.4034 0.3522 -0.0422 0.0269 -0.0414 9 THR A CA +91 C C . THR A 12 ? 0.3015 0.4359 0.3584 -0.0377 0.0283 -0.0289 9 THR A C +92 O O . THR A 12 ? 0.2765 0.4378 0.3339 -0.0398 0.0261 -0.0280 9 THR A O +93 C CB . THR A 12 ? 0.2604 0.3838 0.3480 -0.0433 0.0263 -0.0379 9 THR A CB +94 O OG1 . THR A 12 ? 0.2391 0.3469 0.3192 -0.0393 0.0291 -0.0239 9 THR A OG1 +95 C CG2 . THR A 12 ? 0.3693 0.4885 0.4849 -0.0490 0.0245 -0.0496 9 THR A CG2 +103 N N . GLY A 13 ? 0.2448 0.3611 0.2923 -0.0325 0.0324 -0.0189 10 GLY A N +104 C CA . GLY A 13 ? 0.2671 0.3880 0.3108 -0.0274 0.0352 -0.0055 10 GLY A CA +105 C C . GLY A 13 ? 0.2816 0.3924 0.3173 -0.0267 0.0379 -0.0035 10 GLY A C +106 O O . GLY A 13 ? 0.2058 0.3149 0.2355 -0.0308 0.0362 -0.0135 10 GLY A O +110 N N . VAL A 14 ? 0.1789 0.2828 0.2198 -0.0215 0.0430 0.0087 11 VAL A N +111 C CA . VAL A 14 ? 0.2238 0.3170 0.2624 -0.0213 0.0468 0.0120 11 VAL A CA +112 C C . VAL A 14 ? 0.2444 0.3132 0.2789 -0.0220 0.0524 0.0002 11 VAL A C +113 O O . VAL A 14 ? 0.1751 0.2364 0.2158 -0.0200 0.0573 -0.0025 11 VAL A O +114 C CB . VAL A 14 ? 0.2253 0.3210 0.2821 -0.0158 0.0509 0.0313 11 VAL A CB +115 C CG1 . VAL A 14 ? 0.2042 0.2852 0.2649 -0.0165 0.0563 0.0343 11 VAL A CG1 +116 C CG2 . VAL A 14 ? 0.2518 0.3827 0.3122 -0.0168 0.0437 0.0485 11 VAL A CG2 +126 N N . VAL A 15 ? 0.1669 0.2297 0.1914 -0.0261 0.0518 -0.0073 12 VAL A N +127 C CA . VAL A 15 ? 0.1915 0.2410 0.2101 -0.0291 0.0549 -0.0177 12 VAL A CA +128 C C . VAL A 15 ? 0.1742 0.2138 0.1938 -0.0305 0.0609 -0.0192 12 VAL A C +129 O O . VAL A 15 ? 0.1753 0.2189 0.1928 -0.0317 0.0589 -0.0150 12 VAL A O +130 C CB . VAL A 15 ? 0.1605 0.2141 0.1724 -0.0331 0.0480 -0.0246 12 VAL A CB +131 C CG1 . VAL A 15 ? 0.1620 0.2098 0.1687 -0.0370 0.0496 -0.0299 12 VAL A CG1 +132 C CG2 . VAL A 15 ? 0.1609 0.2225 0.1796 -0.0329 0.0428 -0.0241 12 VAL A CG2 +142 N N . PRO A 16 ? 0.1808 0.2109 0.2055 -0.0319 0.0693 -0.0271 13 PRO A N +143 C CA . PRO A 16 ? 0.1889 0.2094 0.2191 -0.0349 0.0760 -0.0318 13 PRO A CA +144 C C . PRO A 16 ? 0.1852 0.2088 0.1991 -0.0411 0.0718 -0.0396 13 PRO A C +145 O O . PRO A 16 ? 0.1857 0.2175 0.1888 -0.0437 0.0663 -0.0434 13 PRO A O +146 C CB . PRO A 16 ? 0.1983 0.2134 0.2424 -0.0365 0.0876 -0.0448 13 PRO A CB +147 C CG . PRO A 16 ? 0.2731 0.2995 0.3089 -0.0369 0.0851 -0.0479 13 PRO A CG +148 C CD . PRO A 16 ? 0.1833 0.2151 0.2129 -0.0321 0.0746 -0.0337 13 PRO A CD +156 N N . ILE A 17 ? 0.1898 0.2083 0.2064 -0.0435 0.0743 -0.0392 14 ILE A N +157 C CA . ILE A 17 ? 0.1866 0.2097 0.1910 -0.0488 0.0704 -0.0454 14 ILE A CA +158 C C . ILE A 17 ? 0.1968 0.2127 0.2074 -0.0551 0.0791 -0.0555 14 ILE A C +159 O O . ILE A 17 ? 0.2064 0.2112 0.2354 -0.0543 0.0871 -0.0523 14 ILE A O +160 C CB . ILE A 17 ? 0.1826 0.2132 0.1837 -0.0478 0.0647 -0.0368 14 ILE A CB +161 C CG1 . ILE A 17 ? 0.1742 0.2164 0.1723 -0.0440 0.0571 -0.0328 14 ILE A CG1 +162 C CG2 . ILE A 17 ? 0.1801 0.2159 0.1733 -0.0530 0.0621 -0.0448 14 ILE A CG2 +163 C CD1 . ILE A 17 ? 0.1728 0.2326 0.1690 -0.0453 0.0533 -0.0280 14 ILE A CD1 +175 N N . LEU A 18 ? 0.1955 0.2202 0.1954 -0.0616 0.0774 -0.0664 15 LEU A N +176 C CA . LEU A 18 ? 0.2042 0.2280 0.2076 -0.0698 0.0841 -0.0783 15 LEU A CA +177 C C . LEU A 18 ? 0.1978 0.2315 0.1899 -0.0727 0.0765 -0.0772 15 LEU A C +178 O O . LEU A 18 ? 0.1891 0.2353 0.1723 -0.0715 0.0675 -0.0742 15 LEU A O +179 C CB . LEU A 18 ? 0.2115 0.2475 0.2138 -0.0782 0.0903 -0.0962 15 LEU A CB +180 C CG . LEU A 18 ? 0.2211 0.2504 0.2406 -0.0776 0.1015 -0.1056 15 LEU A CG +181 C CD1 . LEU A 18 ? 0.2680 0.3233 0.2810 -0.0891 0.1069 -0.1268 15 LEU A CD1 +182 C CD2 . LEU A 18 ? 0.2631 0.2711 0.3118 -0.0773 0.1133 -0.1096 15 LEU A CD2 +194 N N . VAL A 19 ? 0.2032 0.2320 0.2008 -0.0765 0.0805 -0.0787 16 VAL A N +195 C CA . VAL A 19 ? 0.1985 0.2382 0.1886 -0.0799 0.0751 -0.0800 16 VAL A CA +196 C C . VAL A 19 ? 0.2085 0.2505 0.2029 -0.0903 0.0822 -0.0936 16 VAL A C +197 O O . VAL A 19 ? 0.2203 0.2487 0.2303 -0.0939 0.0926 -0.0979 16 VAL A O +198 C CB . VAL A 19 ? 0.1959 0.2349 0.1876 -0.0766 0.0730 -0.0689 16 VAL A CB +199 C CG1 . VAL A 19 ? 0.1909 0.2440 0.1775 -0.0799 0.0682 -0.0732 16 VAL A CG1 +200 C CG2 . VAL A 19 ? 0.1884 0.2299 0.1779 -0.0685 0.0673 -0.0590 16 VAL A CG2 +210 N N . GLU A 20 ? 0.2178 0.2785 0.2035 -0.0954 0.0767 -0.0995 17 GLU A N +211 C CA . GLU A 20 ? 0.2136 0.2837 0.2018 -0.1069 0.0821 -0.1137 17 GLU A CA +212 C C . GLU A 20 ? 0.2063 0.2908 0.1900 -0.1076 0.0743 -0.1100 17 GLU A C +213 O O . GLU A 20 ? 0.1966 0.2939 0.1764 -0.1021 0.0641 -0.1020 17 GLU A O +214 C CB . GLU A 20 ? 0.2186 0.3098 0.2024 -0.1150 0.0829 -0.1259 17 GLU A CB +215 C CG . GLU A 20 ? 0.2608 0.3413 0.2534 -0.1145 0.0914 -0.1327 17 GLU A CG +216 C CD . GLU A 20 ? 0.3263 0.3887 0.3413 -0.1201 0.1065 -0.1473 17 GLU A CD +217 O OE1 . GLU A 20 ? 0.2690 0.3321 0.2912 -0.1267 0.1100 -0.1529 17 GLU A OE1 +218 O OE2 . GLU A 20 ? 0.4633 0.5120 0.4935 -0.1177 0.1156 -0.1532 17 GLU A OE2 +225 N N A LEU A 21 ? 0.2127 0.2953 0.2024 -0.1144 0.0798 -0.1157 18 LEU A N +226 N N B LEU A 21 ? 0.2126 0.2952 0.2022 -0.1143 0.0797 -0.1155 18 LEU A N +227 C CA A LEU A 21 ? 0.2071 0.3046 0.1953 -0.1157 0.0741 -0.1143 18 LEU A CA +228 C CA B LEU A 21 ? 0.2068 0.3043 0.1950 -0.1155 0.0740 -0.1139 18 LEU A CA +229 C C A LEU A 21 ? 0.2169 0.3253 0.2092 -0.1289 0.0798 -0.1283 18 LEU A C +230 C C B LEU A 21 ? 0.2166 0.3248 0.2090 -0.1287 0.0797 -0.1278 18 LEU A C +231 O O A LEU A 21 ? 0.2292 0.3230 0.2323 -0.1358 0.0908 -0.1357 18 LEU A O +232 O O B LEU A 21 ? 0.2287 0.3221 0.2318 -0.1353 0.0905 -0.1347 18 LEU A O +233 C CB A LEU A 21 ? 0.2044 0.2928 0.1958 -0.1108 0.0749 -0.1044 18 LEU A CB +234 C CB B LEU A 21 ? 0.2040 0.2924 0.1953 -0.1104 0.0747 -0.1039 18 LEU A CB +235 C CG A LEU A 21 ? 0.1994 0.3058 0.1922 -0.1127 0.0712 -0.1060 18 LEU A CG +236 C CG B LEU A 21 ? 0.2015 0.3059 0.1949 -0.1141 0.0729 -0.1059 18 LEU A CG +237 C CD1 A LEU A 21 ? 0.1931 0.3023 0.1858 -0.1058 0.0688 -0.0983 18 LEU A CD1 +238 C CD1 B LEU A 21 ? 0.1899 0.3134 0.1847 -0.1085 0.0629 -0.1070 18 LEU A CD1 +239 C CD2 A LEU A 21 ? 0.2099 0.3180 0.2083 -0.1242 0.0789 -0.1119 18 LEU A CD2 +240 C CD2 B LEU A 21 ? 0.2034 0.3059 0.1987 -0.1133 0.0763 -0.0965 18 LEU A CD2 +263 N N . ASP A 22 ? 0.2122 0.3475 0.2020 -0.1314 0.0725 -0.1292 19 ASP A N +264 C CA . ASP A 22 ? 0.2203 0.3710 0.2148 -0.1398 0.0770 -0.1372 19 ASP A CA +265 C C . ASP A 22 ? 0.2368 0.3957 0.2327 -0.1375 0.0714 -0.1328 19 ASP A C +266 O O . ASP A 22 ? 0.2017 0.3759 0.1992 -0.1316 0.0608 -0.1261 19 ASP A O +267 C CB . ASP A 22 ? 0.2228 0.4069 0.2144 -0.1450 0.0729 -0.1396 19 ASP A CB +268 C CG . ASP A 22 ? 0.3896 0.5766 0.3849 -0.1514 0.0812 -0.1494 19 ASP A CG +269 O OD1 . ASP A 22 ? 0.2422 0.4028 0.2464 -0.1523 0.0927 -0.1578 19 ASP A OD1 +270 O OD2 . ASP A 22 ? 0.3904 0.6100 0.3817 -0.1565 0.0767 -0.1490 19 ASP A OD2 +276 N N . GLY A 23 ? 0.2760 0.4260 0.2757 -0.1424 0.0787 -0.1370 20 GLY A N +277 C CA . GLY A 23 ? 0.2372 0.3981 0.2398 -0.1413 0.0752 -0.1342 20 GLY A CA +278 C C . GLY A 23 ? 0.2391 0.4121 0.2431 -0.1485 0.0784 -0.1418 20 GLY A C +279 O O . GLY A 23 ? 0.2429 0.4102 0.2482 -0.1558 0.0864 -0.1507 20 GLY A O +283 N N . ASP A 24 ? 0.2204 0.4117 0.2278 -0.1460 0.0730 -0.1402 21 ASP A N +284 C CA . ASP A 24 ? 0.2287 0.4350 0.2383 -0.1518 0.0744 -0.1462 21 ASP A CA +285 C C . ASP A 24 ? 0.2218 0.4373 0.2374 -0.1479 0.0717 -0.1435 21 ASP A C +286 O O . ASP A 24 ? 0.2102 0.4419 0.2347 -0.1396 0.0643 -0.1415 21 ASP A O +287 C CB . ASP A 24 ? 0.2280 0.4621 0.2381 -0.1521 0.0676 -0.1474 21 ASP A CB +288 C CG . ASP A 24 ? 0.4130 0.6660 0.4255 -0.1586 0.0687 -0.1537 21 ASP A CG +289 O OD1 . ASP A 24 ? 0.3583 0.6060 0.3742 -0.1602 0.0723 -0.1557 21 ASP A OD1 +290 O OD2 . ASP A 24 ? 0.3876 0.6650 0.3982 -0.1630 0.0656 -0.1561 21 ASP A OD2 +295 N N . VAL A 25 ? 0.2309 0.4378 0.2459 -0.1538 0.0779 -0.1429 22 VAL A N +296 C CA . VAL A 25 ? 0.2279 0.4490 0.2465 -0.1519 0.0767 -0.1417 22 VAL A CA +297 C C . VAL A 25 ? 0.2397 0.4714 0.2605 -0.1602 0.0799 -0.1461 22 VAL A C +298 O O . VAL A 25 ? 0.2538 0.4723 0.2751 -0.1694 0.0865 -0.1439 22 VAL A O +299 C CB . VAL A 25 ? 0.2295 0.4410 0.2448 -0.1520 0.0799 -0.1317 22 VAL A CB +300 C CG1 . VAL A 25 ? 0.2306 0.4643 0.2470 -0.1520 0.0791 -0.1326 22 VAL A CG1 +301 C CG2 . VAL A 25 ? 0.2177 0.4207 0.2312 -0.1434 0.0767 -0.1285 22 VAL A CG2 +311 N N . ASN A 26 ? 0.2468 0.5022 0.2741 -0.1566 0.0758 -0.1520 23 ASN A N +312 C CA . ASN A 26 ? 0.2455 0.5145 0.2756 -0.1641 0.0780 -0.1572 23 ASN A CA +313 C C . ASN A 26 ? 0.2577 0.5176 0.2844 -0.1730 0.0819 -0.1607 23 ASN A C +314 O O . ASN A 26 ? 0.2728 0.5288 0.3014 -0.1832 0.0881 -0.1630 23 ASN A O +315 C CB . ASN A 26 ? 0.2546 0.5266 0.2836 -0.1704 0.0827 -0.1538 23 ASN A CB +316 C CG . ASN A 26 ? 0.2479 0.5432 0.2824 -0.1639 0.0797 -0.1592 23 ASN A CG +317 O OD1 . ASN A 26 ? 0.2357 0.5347 0.2764 -0.1533 0.0755 -0.1628 23 ASN A OD1 +318 N ND2 . ASN A 26 ? 0.2579 0.5695 0.2934 -0.1704 0.0825 -0.1612 23 ASN A ND2 +325 N N . GLY A 27 ? 0.2545 0.5123 0.2782 -0.1697 0.0789 -0.1616 24 GLY A N +326 C CA . GLY A 27 ? 0.3252 0.5824 0.3459 -0.1780 0.0833 -0.1694 24 GLY A CA +327 C C . GLY A 27 ? 0.3028 0.5300 0.3244 -0.1840 0.0928 -0.1717 24 GLY A C +328 O O . GLY A 27 ? 0.3062 0.5320 0.3291 -0.1903 0.0987 -0.1822 24 GLY A O +332 N N . HIS A 28 ? 0.3216 0.4428 0.3520 -0.2027 0.0483 -0.1240 25 HIS A N +333 C CA . HIS A 28 ? 0.3351 0.4260 0.3320 -0.2066 0.0583 -0.1214 25 HIS A CA +334 C C . HIS A 28 ? 0.3211 0.4013 0.3094 -0.1960 0.0520 -0.1143 25 HIS A C +335 O O . HIS A 28 ? 0.3017 0.3849 0.2967 -0.1855 0.0506 -0.1105 25 HIS A O +336 C CB . HIS A 28 ? 0.3417 0.4196 0.3257 -0.2092 0.0722 -0.1224 25 HIS A CB +337 C CG . HIS A 28 ? 0.3582 0.4451 0.3474 -0.2207 0.0806 -0.1301 25 HIS A CG +338 N ND1 . HIS A 28 ? 0.4364 0.5122 0.4113 -0.2346 0.0867 -0.1340 25 HIS A ND1 +339 C CD2 . HIS A 28 ? 0.3537 0.4591 0.3603 -0.2211 0.0850 -0.1356 25 HIS A CD2 +340 C CE1 . HIS A 28 ? 0.5162 0.6040 0.4993 -0.2435 0.0941 -0.1412 25 HIS A CE1 +341 N NE2 . HIS A 28 ? 0.4058 0.5119 0.4083 -0.2356 0.0937 -0.1428 25 HIS A NE2 +350 N N . LYS A 29 ? 0.3336 0.4012 0.3061 -0.1999 0.0493 -0.1134 26 LYS A N +351 C CA . LYS A 29 ? 0.3251 0.3829 0.2880 -0.1921 0.0445 -0.1082 26 LYS A CA +352 C C . LYS A 29 ? 0.3334 0.3618 0.2730 -0.1909 0.0559 -0.1063 26 LYS A C +353 O O . LYS A 29 ? 0.3673 0.3771 0.2920 -0.1988 0.0662 -0.1088 26 LYS A O +354 C CB . LYS A 29 ? 0.3384 0.3983 0.2956 -0.1982 0.0361 -0.1093 26 LYS A CB +355 C CG . LYS A 29 ? 0.3346 0.4221 0.3176 -0.1969 0.0202 -0.1086 26 LYS A CG +356 C CD . LYS A 29 ? 0.4405 0.5295 0.4153 -0.2034 0.0094 -0.1083 26 LYS A CD +357 C CE . LYS A 29 ? 0.4960 0.6105 0.4989 -0.2010 -0.0096 -0.1059 26 LYS A CE +358 N NZ . LYS A 29 ? 0.5422 0.6647 0.5607 -0.1873 -0.0194 -0.0989 26 LYS A NZ +372 N N . PHE A 30 ? 0.3187 0.3420 0.2567 -0.1808 0.0535 -0.1017 27 PHE A N +373 C CA . PHE A 30 ? 0.3265 0.3225 0.2472 -0.1780 0.0623 -0.0998 27 PHE A CA +374 C C . PHE A 30 ? 0.3116 0.3071 0.2331 -0.1682 0.0575 -0.0963 27 PHE A C +375 O O . PHE A 30 ? 0.2939 0.3100 0.2287 -0.1632 0.0474 -0.0941 27 PHE A O +376 C CB . PHE A 30 ? 0.3239 0.3128 0.2446 -0.1760 0.0686 -0.0975 27 PHE A CB +377 C CG . PHE A 30 ? 0.2967 0.3062 0.2356 -0.1669 0.0630 -0.0946 27 PHE A CG +378 C CD1 . PHE A 30 ? 0.2917 0.3257 0.2489 -0.1681 0.0600 -0.0973 27 PHE A CD1 +379 C CD2 . PHE A 30 ? 0.2913 0.2948 0.2302 -0.1572 0.0616 -0.0901 27 PHE A CD2 +380 C CE1 . PHE A 30 ? 0.2860 0.3374 0.2610 -0.1593 0.0560 -0.0958 27 PHE A CE1 +381 C CE2 . PHE A 30 ? 0.3163 0.3381 0.2717 -0.1492 0.0571 -0.0880 27 PHE A CE2 +382 C CZ . PHE A 30 ? 0.2555 0.3006 0.2286 -0.1501 0.0546 -0.0910 27 PHE A CZ +392 N N A SER A 31 ? 0.3210 0.2919 0.2293 -0.1651 0.0645 -0.0958 28 SER A N +393 N N B SER A 31 ? 0.3216 0.2923 0.2296 -0.1654 0.0645 -0.0960 28 SER A N +394 C CA A SER A 31 ? 0.3092 0.2783 0.2182 -0.1562 0.0620 -0.0938 28 SER A CA +395 C CA B SER A 31 ? 0.3101 0.2784 0.2185 -0.1564 0.0622 -0.0939 28 SER A CA +396 C C A SER A 31 ? 0.3117 0.2583 0.2165 -0.1493 0.0685 -0.0918 28 SER A C +397 C C B SER A 31 ? 0.3116 0.2582 0.2165 -0.1493 0.0685 -0.0918 28 SER A C +398 O O A SER A 31 ? 0.3334 0.2560 0.2278 -0.1526 0.0760 -0.0928 28 SER A O +399 O O B SER A 31 ? 0.3326 0.2557 0.2274 -0.1525 0.0758 -0.0925 28 SER A O +400 C CB A SER A 31 ? 0.3249 0.2877 0.2222 -0.1606 0.0632 -0.0977 28 SER A CB +401 C CB B SER A 31 ? 0.3266 0.2869 0.2228 -0.1606 0.0642 -0.0980 28 SER A CB +402 O OG A SER A 31 ? 0.3122 0.2806 0.2116 -0.1537 0.0593 -0.0958 28 SER A OG +403 O OG B SER A 31 ? 0.3297 0.3079 0.2267 -0.1683 0.0567 -0.0990 28 SER A OG +414 N N . VAL A 32 ? 0.2918 0.2450 0.2050 -0.1396 0.0645 -0.0887 29 VAL A N +415 C CA . VAL A 32 ? 0.2928 0.2265 0.2046 -0.1317 0.0682 -0.0865 29 VAL A CA +416 C C . VAL A 32 ? 0.3433 0.2755 0.2575 -0.1231 0.0680 -0.0882 29 VAL A C +417 O O . VAL A 32 ? 0.2718 0.2251 0.1923 -0.1217 0.0616 -0.0875 29 VAL A O +418 C CB . VAL A 32 ? 0.2743 0.2199 0.1959 -0.1282 0.0640 -0.0815 29 VAL A CB +419 C CG1 . VAL A 32 ? 0.2763 0.2019 0.1962 -0.1197 0.0655 -0.0785 29 VAL A CG1 +420 C CG2 . VAL A 32 ? 0.2836 0.2303 0.2020 -0.1369 0.0665 -0.0807 29 VAL A CG2 +431 N N . SER A 33 ? 0.3018 0.2082 0.2116 -0.1171 0.0749 -0.0903 30 SER A N +432 C CA A SER A 33 ? 0.2985 0.2033 0.2134 -0.1074 0.0769 -0.0930 30 SER A CA +433 C CA C SER A 33 ? 0.3153 0.2195 0.2301 -0.1074 0.0771 -0.0931 30 SER A CA +434 C C . SER A 33 ? 0.3014 0.1950 0.2259 -0.0931 0.0762 -0.0863 30 SER A C +435 O O . SER A 33 ? 0.3103 0.1822 0.2311 -0.0919 0.0779 -0.0826 30 SER A O +436 C CB A SER A 33 ? 0.3774 0.2685 0.2861 -0.1090 0.0859 -0.1001 30 SER A CB +437 C CB C SER A 33 ? 0.3702 0.2593 0.2787 -0.1088 0.0863 -0.1001 30 SER A CB +438 O OG A SER A 33 ? 0.3225 0.2283 0.2229 -0.1205 0.0844 -0.1024 30 SER A OG +439 O OG C SER A 33 ? 0.3772 0.2626 0.2938 -0.0983 0.0911 -0.1037 30 SER A OG +450 N N . GLY A 34 ? 0.2969 0.2072 0.2340 -0.0818 0.0720 -0.0822 31 GLY A N +451 C CA . GLY A 34 ? 0.2898 0.1952 0.2388 -0.0669 0.0690 -0.0743 31 GLY A CA +452 C C . GLY A 34 ? 0.3383 0.2489 0.3005 -0.0559 0.0719 -0.0773 31 GLY A C +453 O O . GLY A 34 ? 0.2668 0.1917 0.2278 -0.0601 0.0743 -0.0830 31 GLY A O +457 N N . GLU A 35 ? 0.2668 0.1659 0.2416 -0.0426 0.0712 -0.0732 32 GLU A N +458 C CA . GLU A 35 ? 0.2597 0.1670 0.2524 -0.0313 0.0740 -0.0762 32 GLU A CA +459 C C . GLU A 35 ? 0.2557 0.1613 0.2641 -0.0171 0.0655 -0.0661 32 GLU A C +460 O O . GLU A 35 ? 0.2680 0.1576 0.2708 -0.0160 0.0595 -0.0579 32 GLU A O +461 C CB . GLU A 35 ? 0.2912 0.1819 0.2873 -0.0309 0.0868 -0.0889 32 GLU A CB +462 C CG . GLU A 35 ? 0.3823 0.2421 0.3774 -0.0285 0.0889 -0.0888 32 GLU A CG +463 C CD . GLU A 35 ? 0.5464 0.3887 0.5489 -0.0271 0.1031 -0.1037 32 GLU A CD +464 O OE1 . GLU A 35 ? 0.5671 0.3812 0.5737 -0.0227 0.1050 -0.1042 32 GLU A OE1 +465 O OE2 . GLU A 35 ? 0.5017 0.3579 0.5056 -0.0310 0.1122 -0.1145 32 GLU A OE2 +472 N N . GLY A 36 ? 0.2399 0.1629 0.2661 -0.0080 0.0643 -0.0663 33 GLY A N +473 C CA . GLY A 36 ? 0.2356 0.1609 0.2795 0.0055 0.0550 -0.0574 33 GLY A CA +474 C C . GLY A 36 ? 0.2379 0.1889 0.2985 0.0108 0.0542 -0.0588 33 GLY A C +475 O O . GLY A 36 ? 0.2100 0.1701 0.2742 0.0076 0.0640 -0.0687 33 GLY A O +479 N N . GLU A 37 ? 0.2005 0.1626 0.2689 0.0171 0.0427 -0.0492 34 GLU A N +480 C CA . GLU A 37 ? 0.1809 0.1664 0.2662 0.0219 0.0412 -0.0501 34 GLU A CA +481 C C . GLU A 37 ? 0.1643 0.1636 0.2458 0.0211 0.0294 -0.0408 34 GLU A C +482 O O . GLU A 37 ? 0.1715 0.1613 0.2416 0.0201 0.0211 -0.0326 34 GLU A O +483 C CB . GLU A 37 ? 0.2726 0.2583 0.3871 0.0354 0.0419 -0.0528 34 GLU A CB +484 C CG . GLU A 37 ? 0.3749 0.3467 0.4977 0.0455 0.0295 -0.0427 34 GLU A CG +485 C CD . GLU A 37 ? 0.4052 0.3734 0.5611 0.0597 0.0309 -0.0471 34 GLU A CD +486 O OE1 . GLU A 37 ? 0.4484 0.4096 0.6132 0.0602 0.0450 -0.0595 34 GLU A OE1 +487 O OE2 . GLU A 37 ? 0.4121 0.3851 0.5864 0.0700 0.0178 -0.0389 34 GLU A OE2 +494 N N . GLY A 38 ? 0.1517 0.1720 0.2411 0.0201 0.0297 -0.0429 35 GLY A N +495 C CA . GLY A 38 ? 0.1787 0.2132 0.2679 0.0195 0.0200 -0.0365 35 GLY A CA +496 C C . GLY A 38 ? 0.1765 0.2265 0.2888 0.0274 0.0170 -0.0366 35 GLY A C +497 O O . GLY A 38 ? 0.1661 0.2225 0.2928 0.0296 0.0252 -0.0435 35 GLY A O +501 N N . ASP A 39 ? 0.1166 0.1732 0.2323 0.0305 0.0057 -0.0297 36 ASP A N +502 C CA . ASP A 39 ? 0.1133 0.1861 0.2516 0.0371 0.0007 -0.0294 36 ASP A CA +503 C C . ASP A 39 ? 0.0955 0.1806 0.2267 0.0316 -0.0060 -0.0264 36 ASP A C +504 O O . ASP A 39 ? 0.1121 0.1946 0.2349 0.0312 -0.0160 -0.0202 36 ASP A O +505 C CB . ASP A 39 ? 0.1259 0.1913 0.2772 0.0474 -0.0092 -0.0234 36 ASP A CB +506 C CG . ASP A 39 ? 0.2257 0.3093 0.4078 0.0555 -0.0134 -0.0250 36 ASP A CG +507 O OD1 . ASP A 39 ? 0.2358 0.3374 0.4258 0.0517 -0.0084 -0.0302 36 ASP A OD1 +508 O OD2 . ASP A 39 ? 0.2829 0.3625 0.4825 0.0655 -0.0222 -0.0209 36 ASP A OD2 +513 N N . ALA A 40 ? 0.1060 0.2025 0.2380 0.0259 -0.0003 -0.0309 37 ALA A N +514 C CA . ALA A 40 ? 0.1002 0.2049 0.2249 0.0200 -0.0050 -0.0297 37 ALA A CA +515 C C . ALA A 40 ? 0.1324 0.2488 0.2691 0.0231 -0.0144 -0.0272 37 ALA A C +516 O O . ALA A 40 ? 0.1062 0.2269 0.2359 0.0187 -0.0196 -0.0264 37 ALA A O +517 C CB . ALA A 40 ? 0.1031 0.2146 0.2280 0.0140 0.0014 -0.0336 37 ALA A CB +523 N N . THR A 41 ? 0.0976 0.2206 0.2544 0.0302 -0.0158 -0.0275 38 THR A N +524 C CA . THR A 41 ? 0.1581 0.2883 0.3211 0.0318 -0.0251 -0.0231 38 THR A CA +525 C C . THR A 41 ? 0.1151 0.2419 0.2699 0.0326 -0.0383 -0.0179 38 THR A C +526 O O . THR A 41 ? 0.1702 0.3050 0.3231 0.0295 -0.0472 -0.0161 38 THR A O +527 C CB . THR A 41 ? 0.2226 0.3559 0.4042 0.0389 -0.0242 -0.0228 38 THR A CB +528 O OG1 . THR A 41 ? 0.1900 0.3262 0.3744 0.0353 -0.0120 -0.0279 38 THR A OG1 +529 C CG2 . THR A 41 ? 0.2244 0.3667 0.4126 0.0401 -0.0351 -0.0180 38 THR A CG2 +537 N N . TYR A 42 ? 0.1234 0.2322 0.2641 0.0339 -0.0381 -0.0140 39 TYR A N +538 C CA . TYR A 42 ? 0.1680 0.2650 0.2884 0.0309 -0.0484 -0.0063 39 TYR A CA +539 C C . TYR A 42 ? 0.1881 0.2749 0.2820 0.0212 -0.0419 -0.0078 39 TYR A C +540 O O . TYR A 42 ? 0.1734 0.2494 0.2459 0.0155 -0.0473 -0.0027 39 TYR A O +541 C CB . TYR A 42 ? 0.2401 0.3225 0.3656 0.0394 -0.0553 0.0010 39 TYR A CB +542 C CG . TYR A 42 ? 0.2677 0.3635 0.4244 0.0496 -0.0635 0.0019 39 TYR A CG +543 C CD1 . TYR A 42 ? 0.2588 0.3627 0.4178 0.0494 -0.0796 0.0082 39 TYR A CD1 +544 C CD2 . TYR A 42 ? 0.2580 0.3608 0.4429 0.0578 -0.0546 -0.0050 39 TYR A CD2 +545 C CE1 . TYR A 42 ? 0.3305 0.4475 0.5167 0.0573 -0.0858 0.0087 39 TYR A CE1 +546 C CE2 . TYR A 42 ? 0.2265 0.3410 0.4357 0.0645 -0.0583 -0.0051 39 TYR A CE2 +547 C CZ . TYR A 42 ? 0.3375 0.4585 0.5451 0.0638 -0.0728 0.0019 39 TYR A CZ +548 O OH . TYR A 42 ? 0.4539 0.5857 0.6807 0.0684 -0.0747 0.0016 39 TYR A OH +558 N N . GLY A 43 ? 0.1034 0.1944 0.1989 0.0182 -0.0307 -0.0148 40 GLY A N +559 C CA . GLY A 43 ? 0.0994 0.1838 0.1764 0.0098 -0.0244 -0.0175 40 GLY A CA +560 C C . GLY A 43 ? 0.1169 0.1820 0.1789 0.0085 -0.0221 -0.0140 40 GLY A C +561 O O . GLY A 43 ? 0.1430 0.2016 0.1869 0.0001 -0.0195 -0.0146 40 GLY A O +565 N N . LYS A 44 ? 0.1243 0.1803 0.1955 0.0163 -0.0217 -0.0117 41 LYS A N +566 C CA . LYS A 44 ? 0.1466 0.1805 0.2051 0.0165 -0.0223 -0.0066 41 LYS A CA +567 C C . LYS A 44 ? 0.1464 0.1715 0.2050 0.0159 -0.0111 -0.0122 41 LYS A C +568 O O . LYS A 44 ? 0.1374 0.1690 0.2130 0.0213 -0.0053 -0.0177 41 LYS A O +569 C CB . LYS A 44 ? 0.1626 0.1895 0.2336 0.0268 -0.0330 0.0009 41 LYS A CB +570 C CG . LYS A 44 ? 0.1904 0.1906 0.2512 0.0286 -0.0358 0.0078 41 LYS A CG +571 C CD . LYS A 44 ? 0.2068 0.2018 0.2856 0.0405 -0.0495 0.0161 41 LYS A CD +572 C CE . LYS A 44 ? 0.4169 0.3823 0.4891 0.0439 -0.0534 0.0236 41 LYS A CE +573 N NZ . LYS A 44 ? 0.4254 0.3851 0.5230 0.0583 -0.0674 0.0311 41 LYS A NZ +587 N N . LEU A 45 ? 0.1603 0.1710 0.1990 0.0079 -0.0074 -0.0116 42 LEU A N +588 C CA . LEU A 45 ? 0.1639 0.1630 0.1993 0.0056 0.0022 -0.0167 42 LEU A CA +589 C C . LEU A 45 ? 0.2110 0.1835 0.2356 0.0061 0.0004 -0.0109 42 LEU A C +590 O O . LEU A 45 ? 0.2080 0.1702 0.2154 0.0007 -0.0057 -0.0035 42 LEU A O +591 C CB . LEU A 45 ? 0.2179 0.2229 0.2406 -0.0060 0.0083 -0.0219 42 LEU A CB +592 C CG . LEU A 45 ? 0.2978 0.3250 0.3303 -0.0076 0.0097 -0.0272 42 LEU A CG +593 C CD1 . LEU A 45 ? 0.3360 0.3689 0.3592 -0.0179 0.0120 -0.0306 42 LEU A CD1 +594 C CD2 . LEU A 45 ? 0.2875 0.3177 0.3291 -0.0053 0.0157 -0.0324 42 LEU A CD2 +606 N N . THR A 46 ? 0.2018 0.1620 0.2349 0.0112 0.0063 -0.0148 43 THR A N +607 C CA . THR A 46 ? 0.2310 0.1624 0.2546 0.0110 0.0062 -0.0108 43 THR A CA +608 C C . THR A 46 ? 0.2720 0.1963 0.2914 0.0051 0.0192 -0.0211 43 THR A C +609 O O . THR A 46 ? 0.2303 0.1618 0.2643 0.0095 0.0266 -0.0299 43 THR A O +610 C CB . THR A 46 ? 0.2826 0.2025 0.3264 0.0255 -0.0009 -0.0060 43 THR A CB +611 O OG1 . THR A 46 ? 0.4350 0.3666 0.5038 0.0336 0.0074 -0.0165 43 THR A OG1 +612 C CG2 . THR A 46 ? 0.3149 0.2446 0.3638 0.0308 -0.0158 0.0042 43 THR A CG2 +620 N N . LEU A 47 ? 0.2464 0.1570 0.2444 -0.0066 0.0224 -0.0206 44 LEU A N +621 C CA . LEU A 47 ? 0.2788 0.1855 0.2699 -0.0153 0.0335 -0.0306 44 LEU A CA +622 C C . LEU A 47 ? 0.3009 0.1795 0.2743 -0.0234 0.0358 -0.0282 44 LEU A C +623 O O . LEU A 47 ? 0.2979 0.1662 0.2573 -0.0278 0.0296 -0.0188 44 LEU A O +624 C CB . LEU A 47 ? 0.2837 0.2143 0.2690 -0.0254 0.0354 -0.0349 44 LEU A CB +625 C CG . LEU A 47 ? 0.2815 0.2375 0.2821 -0.0201 0.0346 -0.0384 44 LEU A CG +626 C CD1 . LEU A 47 ? 0.2780 0.2551 0.2762 -0.0267 0.0312 -0.0381 44 LEU A CD1 +627 C CD2 . LEU A 47 ? 0.2731 0.2296 0.2764 -0.0221 0.0433 -0.0479 44 LEU A CD2 +639 N N . LYS A 48 ? 0.2928 0.1579 0.2647 -0.0268 0.0451 -0.0370 45 LYS A N +640 C CA . LYS A 48 ? 0.3178 0.1569 0.2717 -0.0374 0.0491 -0.0368 45 LYS A CA +641 C C . LYS A 48 ? 0.3345 0.1840 0.2798 -0.0511 0.0580 -0.0482 45 LYS A C +642 O O . LYS A 48 ? 0.2997 0.1606 0.2532 -0.0497 0.0635 -0.0578 45 LYS A O +643 C CB . LYS A 48 ? 0.3482 0.1554 0.3090 -0.0289 0.0509 -0.0368 45 LYS A CB +644 C CG . LYS A 48 ? 0.3811 0.1569 0.3227 -0.0407 0.0553 -0.0366 45 LYS A CG +645 C CD . LYS A 48 ? 0.4224 0.1656 0.3747 -0.0316 0.0584 -0.0391 45 LYS A CD +646 C CE . LYS A 48 ? 0.4452 0.1571 0.3778 -0.0453 0.0648 -0.0415 45 LYS A CE +647 N NZ . LYS A 48 ? 0.4768 0.1558 0.4220 -0.0366 0.0693 -0.0463 45 LYS A NZ +661 N N . PHE A 49 ? 0.3187 0.1641 0.2470 -0.0654 0.0589 -0.0469 46 PHE A N +662 C CA . PHE A 49 ? 0.3145 0.1703 0.2353 -0.0799 0.0650 -0.0565 46 PHE A CA +663 C C . PHE A 49 ? 0.3573 0.1845 0.2626 -0.0917 0.0713 -0.0594 46 PHE A C +664 O O . PHE A 49 ? 0.3695 0.1741 0.2643 -0.0940 0.0696 -0.0510 46 PHE A O +665 C CB . PHE A 49 ? 0.2937 0.1759 0.2134 -0.0879 0.0612 -0.0548 46 PHE A CB +666 C CG . PHE A 49 ? 0.2638 0.1725 0.1984 -0.0776 0.0549 -0.0522 46 PHE A CG +667 C CD1 . PHE A 49 ? 0.2642 0.1940 0.2090 -0.0760 0.0546 -0.0584 46 PHE A CD1 +668 C CD2 . PHE A 49 ? 0.2596 0.1702 0.1959 -0.0706 0.0487 -0.0432 46 PHE A CD2 +669 C CE1 . PHE A 49 ? 0.2189 0.1701 0.1770 -0.0672 0.0488 -0.0556 46 PHE A CE1 +670 C CE2 . PHE A 49 ? 0.2338 0.1678 0.1839 -0.0621 0.0434 -0.0418 46 PHE A CE2 +671 C CZ . PHE A 49 ? 0.2474 0.2009 0.2091 -0.0601 0.0437 -0.0479 46 PHE A CZ +681 N N . ILE A 50 ? 0.3519 0.1794 0.2538 -0.1007 0.0782 -0.0710 47 ILE A N +682 C CA . ILE A 50 ? 0.3818 0.1853 0.2691 -0.1145 0.0850 -0.0760 47 ILE A CA +683 C C . ILE A 50 ? 0.3946 0.2275 0.2795 -0.1268 0.0848 -0.0805 47 ILE A C +684 O O . ILE A 50 ? 0.3521 0.2106 0.2447 -0.1258 0.0826 -0.0850 47 ILE A O +685 C CB . ILE A 50 ? 0.4648 0.2518 0.3552 -0.1088 0.0916 -0.0835 47 ILE A CB +686 C CG1 . ILE A 50 ? 0.5572 0.3192 0.4587 -0.0926 0.0916 -0.0804 47 ILE A CG1 +687 C CG2 . ILE A 50 ? 0.6048 0.3762 0.4833 -0.1194 0.0964 -0.0857 47 ILE A CG2 +688 C CD1 . ILE A 50 ? 0.5904 0.3164 0.4858 -0.0910 0.0899 -0.0718 47 ILE A CD1 +700 N N . CYS A 51 ? 0.3839 0.2126 0.2588 -0.1379 0.0867 -0.0789 48 CYS A N +701 C CA . CYS A 51 ? 0.3795 0.2308 0.2539 -0.1484 0.0875 -0.0844 48 CYS A CA +702 C C . CYS A 51 ? 0.4022 0.2381 0.2703 -0.1510 0.0934 -0.0913 48 CYS A C +703 O O . CYS A 51 ? 0.4316 0.2385 0.2907 -0.1529 0.0984 -0.0910 48 CYS A O +704 C CB . CYS A 51 ? 0.3885 0.2432 0.2562 -0.1594 0.0887 -0.0819 48 CYS A CB +705 S SG . CYS A 51 ? 0.4077 0.2927 0.2801 -0.1706 0.0885 -0.0893 48 CYS A SG +711 N N . THR A 52 ? 0.3912 0.2456 0.2634 -0.1515 0.0925 -0.0969 49 THR A N +712 C CA . THR A 52 ? 0.4134 0.2548 0.2790 -0.1545 0.0990 -0.1043 49 THR A CA +713 C C . THR A 52 ? 0.4280 0.2757 0.2853 -0.1687 0.1005 -0.1082 49 THR A C +714 O O . THR A 52 ? 0.4636 0.2994 0.3132 -0.1740 0.1065 -0.1149 49 THR A O +715 C CB . THR A 52 ? 0.3997 0.2568 0.2699 -0.1505 0.0978 -0.1082 49 THR A CB +716 O OG1 . THR A 52 ? 0.3781 0.2665 0.2519 -0.1557 0.0894 -0.1061 49 THR A OG1 +717 C CG2 . THR A 52 ? 0.3860 0.2382 0.2660 -0.1363 0.0972 -0.1057 49 THR A CG2 +725 N N . THR A 53 ? 0.4157 0.2834 0.2761 -0.1749 0.0955 -0.1052 50 THR A N +726 C CA . THR A 53 ? 0.4528 0.3307 0.3086 -0.1880 0.0959 -0.1094 50 THR A CA +727 C C . THR A 53 ? 0.5287 0.3890 0.3762 -0.1958 0.1014 -0.1087 50 THR A C +728 O O . THR A 53 ? 0.5172 0.3839 0.3610 -0.2073 0.1028 -0.1128 50 THR A O +729 C CB . THR A 53 ? 0.4020 0.3163 0.2707 -0.1898 0.0864 -0.1079 50 THR A CB +730 O OG1 . THR A 53 ? 0.3799 0.3037 0.2591 -0.1826 0.0830 -0.1022 50 THR A OG1 +731 C CG2 . THR A 53 ? 0.3896 0.3197 0.2617 -0.1868 0.0799 -0.1089 50 THR A CG2 +739 N N . GLY A 54 ? 0.4583 0.2957 0.3021 -0.1903 0.1038 -0.1030 51 GLY A N +740 C CA . GLY A 54 ? 0.4841 0.3015 0.3168 -0.1983 0.1083 -0.1004 51 GLY A CA +741 C C . GLY A 54 ? 0.5351 0.3548 0.3686 -0.1957 0.1055 -0.0923 51 GLY A C +742 O O . GLY A 54 ? 0.4922 0.3080 0.3303 -0.1849 0.1019 -0.0870 51 GLY A O +746 N N . LYS A 55 ? 0.5297 0.3563 0.3582 -0.2065 0.1077 -0.0919 52 LYS A N +747 C CA . LYS A 55 ? 0.5423 0.3740 0.3695 -0.2066 0.1064 -0.0856 52 LYS A CA +748 C C . LYS A 55 ? 0.5094 0.3808 0.3560 -0.2018 0.1014 -0.0880 52 LYS A C +749 O O . LYS A 55 ? 0.4224 0.3210 0.2817 -0.2045 0.0996 -0.0945 52 LYS A O +750 C CB . LYS A 55 ? 0.5504 0.3751 0.3642 -0.2212 0.1122 -0.0859 52 LYS A CB +751 C CG . LYS A 55 ? 0.6177 0.4468 0.4257 -0.2244 0.1126 -0.0807 52 LYS A CG +752 C CD . LYS A 55 ? 0.6611 0.4850 0.4551 -0.2405 0.1196 -0.0831 52 LYS A CD +759 N N . LEU A 56 ? 0.4582 0.3324 0.3080 -0.1944 0.0982 -0.0823 53 LEU A N +760 C CA . LEU A 56 ? 0.3867 0.2969 0.2561 -0.1894 0.0937 -0.0847 53 LEU A CA +761 C C . LEU A 56 ? 0.4311 0.3618 0.3045 -0.1990 0.0975 -0.0895 53 LEU A C +762 O O . LEU A 56 ? 0.4540 0.3704 0.3118 -0.2070 0.1028 -0.0872 53 LEU A O +763 C CB . LEU A 56 ? 0.4017 0.3074 0.2720 -0.1801 0.0901 -0.0779 53 LEU A CB +764 C CG . LEU A 56 ? 0.3370 0.2752 0.2294 -0.1711 0.0841 -0.0799 53 LEU A CG +765 C CD1 . LEU A 56 ? 0.3217 0.2683 0.2250 -0.1638 0.0788 -0.0825 53 LEU A CD1 +766 C CD2 . LEU A 56 ? 0.3632 0.2945 0.2533 -0.1648 0.0819 -0.0732 53 LEU A CD2 +778 N N . PRO A 57 ? 0.4615 0.4251 0.3563 -0.1981 0.0943 -0.0963 54 PRO A N +779 C CA . PRO A 57 ? 0.4499 0.4338 0.3529 -0.2067 0.0986 -0.1030 54 PRO A CA +780 C C . PRO A 57 ? 0.3718 0.3719 0.2840 -0.2033 0.0997 -0.1039 54 PRO A C +781 O O . PRO A 57 ? 0.3863 0.4021 0.3053 -0.2104 0.1049 -0.1110 54 PRO A O +782 C CB . PRO A 57 ? 0.4713 0.4823 0.3973 -0.2048 0.0921 -0.1087 54 PRO A CB +783 C CG . PRO A 57 ? 0.4054 0.4194 0.3394 -0.1919 0.0828 -0.1040 54 PRO A CG +784 C CD . PRO A 57 ? 0.3572 0.3381 0.2686 -0.1904 0.0861 -0.0980 54 PRO A CD +792 N N . VAL A 58 ? 0.3422 0.3387 0.2550 -0.1930 0.0954 -0.0980 55 VAL A N +793 C CA . VAL A 58 ? 0.3633 0.3723 0.2825 -0.1895 0.0963 -0.0988 55 VAL A CA +794 C C . VAL A 58 ? 0.3421 0.3228 0.2382 -0.1889 0.0965 -0.0892 55 VAL A C +795 O O . VAL A 58 ? 0.3712 0.3271 0.2548 -0.1869 0.0942 -0.0824 55 VAL A O +796 C CB . VAL A 58 ? 0.2955 0.3333 0.2447 -0.1758 0.0880 -0.1010 55 VAL A CB +797 C CG1 . VAL A 58 ? 0.3146 0.3773 0.2876 -0.1761 0.0849 -0.1083 55 VAL A CG1 +798 C CG2 . VAL A 58 ? 0.2797 0.3087 0.2294 -0.1650 0.0798 -0.0937 55 VAL A CG2 +808 N N . PRO A 59 ? 0.3448 0.3277 0.2350 -0.1910 0.0990 -0.0889 56 PRO A N +809 C CA . PRO A 59 ? 0.3583 0.3142 0.2266 -0.1908 0.0970 -0.0780 56 PRO A CA +810 C C . PRO A 59 ? 0.3316 0.2909 0.2131 -0.1768 0.0891 -0.0729 56 PRO A C +811 O O . PRO A 59 ? 0.3013 0.2887 0.2079 -0.1677 0.0857 -0.0784 56 PRO A O +812 C CB . PRO A 59 ? 0.3678 0.3310 0.2278 -0.1981 0.1015 -0.0811 56 PRO A CB +813 C CG . PRO A 59 ? 0.3719 0.3556 0.2423 -0.2060 0.1088 -0.0940 56 PRO A CG +814 C CD . PRO A 59 ? 0.3440 0.3496 0.2435 -0.1960 0.1046 -0.0987 56 PRO A CD +822 N N . TRP A 60 ? 0.3460 0.2749 0.2110 -0.1749 0.0859 -0.0621 57 TRP A N +823 C CA . TRP A 60 ? 0.3258 0.2535 0.2015 -0.1628 0.0791 -0.0576 57 TRP A CA +824 C C . TRP A 60 ? 0.3017 0.2537 0.1907 -0.1576 0.0766 -0.0589 57 TRP A C +825 O O . TRP A 60 ? 0.2728 0.2435 0.1836 -0.1471 0.0715 -0.0619 57 TRP A O +826 C CB . TRP A 60 ? 0.3522 0.2392 0.2075 -0.1617 0.0762 -0.0453 57 TRP A CB +827 C CG . TRP A 60 ? 0.3664 0.2317 0.2191 -0.1599 0.0771 -0.0464 57 TRP A CG +828 C CD1 . TRP A 60 ? 0.4280 0.2653 0.2620 -0.1672 0.0803 -0.0431 57 TRP A CD1 +829 C CD2 . TRP A 60 ? 0.3487 0.2194 0.2173 -0.1495 0.0747 -0.0518 57 TRP A CD2 +830 N NE1 . TRP A 60 ? 0.4148 0.2395 0.2539 -0.1622 0.0811 -0.0471 57 TRP A NE1 +831 C CE2 . TRP A 60 ? 0.3741 0.2187 0.2329 -0.1524 0.0781 -0.0529 57 TRP A CE2 +832 C CE3 . TRP A 60 ? 0.3156 0.2120 0.2050 -0.1363 0.0695 -0.0554 57 TRP A CE3 +833 C CZ2 . TRP A 60 ? 0.4107 0.2536 0.2787 -0.1454 0.0784 -0.0593 57 TRP A CZ2 +834 C CZ3 . TRP A 60 ? 0.3107 0.2050 0.2072 -0.1303 0.0692 -0.0604 57 TRP A CZ3 +835 C CH2 . TRP A 60 ? 0.3491 0.2160 0.2342 -0.1362 0.0744 -0.0634 57 TRP A CH2 +846 N N . PRO A 61 ? 0.3158 0.2673 0.1908 -0.1652 0.0798 -0.0571 58 PRO A N +847 C CA . PRO A 61 ? 0.2942 0.2682 0.1820 -0.1598 0.0778 -0.0595 58 PRO A CA +848 C C . PRO A 61 ? 0.2628 0.2727 0.1825 -0.1517 0.0775 -0.0721 58 PRO A C +849 O O . PRO A 61 ? 0.2406 0.2672 0.1766 -0.1428 0.0736 -0.0736 58 PRO A O +850 C CB . PRO A 61 ? 0.3213 0.2879 0.1849 -0.1717 0.0822 -0.0581 58 PRO A CB +851 C CG . PRO A 61 ? 0.3679 0.2973 0.2006 -0.1806 0.0823 -0.0472 58 PRO A CG +852 C CD . PRO A 61 ? 0.3552 0.2813 0.1992 -0.1781 0.0836 -0.0513 58 PRO A CD +860 N N . THR A 62 ? 0.2628 0.2826 0.1918 -0.1537 0.0804 -0.0796 59 THR A N +861 C CA . THR A 62 ? 0.2373 0.2870 0.1969 -0.1445 0.0778 -0.0884 59 THR A CA +862 C C . THR A 62 ? 0.2137 0.2697 0.1905 -0.1320 0.0685 -0.0849 59 THR A C +863 O O . THR A 62 ? 0.1942 0.2711 0.1953 -0.1227 0.0633 -0.0887 59 THR A O +864 C CB . THR A 62 ? 0.2588 0.3192 0.2261 -0.1506 0.0824 -0.0968 59 THR A CB +865 O OG1 . THR A 62 ? 0.2671 0.3163 0.2286 -0.1532 0.0806 -0.0935 59 THR A OG1 +866 C CG2 . THR A 62 ? 0.3132 0.3671 0.2618 -0.1650 0.0925 -0.1020 59 THR A CG2 +874 N N . LEU A 63 ? 0.2204 0.2559 0.1842 -0.1321 0.0660 -0.0777 60 LEU A N +875 C CA . LEU A 63 ? 0.2018 0.2410 0.1777 -0.1222 0.0581 -0.0757 60 LEU A CA +876 C C . LEU A 63 ? 0.1895 0.2256 0.1676 -0.1145 0.0533 -0.0710 60 LEU A C +877 O O . LEU A 63 ? 0.1750 0.2163 0.1630 -0.1052 0.0469 -0.0698 60 LEU A O +878 C CB . LEU A 63 ? 0.2182 0.2368 0.1801 -0.1270 0.0592 -0.0742 60 LEU A CB +879 C CG . LEU A 63 ? 0.2317 0.2527 0.1911 -0.1353 0.0631 -0.0787 60 LEU A CG +880 C CD1 . LEU A 63 ? 0.2487 0.2477 0.1938 -0.1389 0.0643 -0.0776 60 LEU A CD1 +881 C CD2 . LEU A 63 ? 0.3008 0.3507 0.2842 -0.1304 0.0575 -0.0835 60 LEU A CD2 +893 N N . VAL A 64 ? 0.1990 0.2251 0.1643 -0.1143 0.0552 -0.0661 61 VAL A N +894 C CA . VAL A 64 ? 0.1909 0.2126 0.1560 -0.1002 0.0485 -0.0587 61 VAL A CA +895 C C . VAL A 64 ? 0.1686 0.2149 0.1584 -0.0904 0.0429 -0.0622 61 VAL A C +896 O O . VAL A 64 ? 0.1618 0.2061 0.1565 -0.0797 0.0373 -0.0583 61 VAL A O +897 C CB . VAL A 64 ? 0.2071 0.2185 0.1548 -0.1033 0.0497 -0.0532 61 VAL A CB +898 C CG1 . VAL A 64 ? 0.2042 0.2171 0.1560 -0.0898 0.0417 -0.0470 61 VAL A CG1 +899 C CG2 . VAL A 64 ? 0.2733 0.2538 0.1953 -0.1100 0.0517 -0.0456 61 VAL A CG2 +909 N N . THR A 65 ? 0.1506 0.2195 0.1572 -0.0944 0.0447 -0.0702 62 THR A N +910 C CA . THR A 65 ? 0.1602 0.2472 0.1894 -0.0831 0.0380 -0.0717 62 THR A CA +911 C C . THR A 65 ? 0.1281 0.2180 0.1668 -0.0768 0.0311 -0.0697 62 THR A C +912 O O . THR A 65 ? 0.1058 0.2006 0.1544 -0.0676 0.0243 -0.0665 62 THR A O +913 C CB . THR A 65 ? 0.1251 0.2261 0.1667 -0.0807 0.0402 -0.0781 62 THR A CB +914 O OG1 . THR A 65 ? 0.1346 0.2385 0.1778 -0.0866 0.0442 -0.0831 62 THR A OG1 +915 C CG2 . THR A 65 ? 0.1347 0.2340 0.1646 -0.0874 0.0466 -0.0806 62 THR A CG2 +923 N N . THR A 66 ? 0.1291 0.2148 0.1624 -0.0832 0.0329 -0.0712 63 THR A N +924 C CA . THR A 66 ? 0.1261 0.2138 0.1638 -0.0808 0.0263 -0.0694 63 THR A CA +925 C C . THR A 66 ? 0.1638 0.2380 0.1893 -0.0813 0.0259 -0.0667 63 THR A C +926 O O . THR A 66 ? 0.1221 0.1998 0.1517 -0.0767 0.0198 -0.0643 63 THR A O +927 C CB . THR A 66 ? 0.1398 0.2270 0.1739 -0.0891 0.0287 -0.0726 63 THR A CB +928 O OG1 . THR A 66 ? 0.1370 0.2386 0.1866 -0.0881 0.0290 -0.0767 63 THR A OG1 +929 C CG2 . THR A 66 ? 0.1412 0.2290 0.1753 -0.0896 0.0215 -0.0707 63 THR A CG2 +937 N N . LEU A 67 ? 0.1442 0.1982 0.1517 -0.0835 0.0324 -0.0649 64 LEU A N +938 C CA . LEU A 67 ? 0.1541 0.1888 0.1487 -0.0783 0.0337 -0.0611 64 LEU A CA +939 C C . LEU A 67 ? 0.1988 0.2353 0.1996 -0.0656 0.0302 -0.0558 64 LEU A C +940 O O . LEU A 67 ? 0.1853 0.2200 0.1871 -0.0604 0.0290 -0.0548 64 LEU A O +941 C CB . LEU A 67 ? 0.1775 0.1876 0.1542 -0.0827 0.0404 -0.0596 64 LEU A CB +942 C CG . LEU A 67 ? 0.1989 0.2027 0.1668 -0.0967 0.0453 -0.0652 64 LEU A CG +943 C CD1 . LEU A 67 ? 0.2771 0.2555 0.2272 -0.1024 0.0514 -0.0624 64 LEU A CD1 +944 C CD2 . LEU A 67 ? 0.1998 0.1987 0.1636 -0.0995 0.0455 -0.0693 64 LEU A CD2 +956 N N1 . CRO A 68 ? 0.1743 0.2166 0.1795 -0.0624 0.0290 -0.0536 66 CRO A N1 +957 C CA1 . CRO A 68 ? 0.1294 0.1755 0.1414 -0.0519 0.0250 -0.0494 66 CRO A CA1 +958 C CB1 . CRO A 68 ? 0.2544 0.2850 0.2563 -0.0474 0.0252 -0.0435 66 CRO A CB1 +959 C CG1 . CRO A 68 ? 0.2543 0.2643 0.2466 -0.0465 0.0285 -0.0420 66 CRO A CG1 +960 O OG1 . CRO A 68 ? 0.2880 0.3143 0.2792 -0.0548 0.0272 -0.0430 66 CRO A OG1 +961 C C1 . CRO A 68 ? 0.1390 0.2049 0.1655 -0.0518 0.0218 -0.0521 66 CRO A C1 +962 N N2 . CRO A 68 ? 0.1377 0.2081 0.1642 -0.0535 0.0229 -0.0531 66 CRO A N2 +963 N N3 . CRO A 68 ? 0.1174 0.1997 0.1605 -0.0509 0.0170 -0.0548 66 CRO A N3 +964 C C2 . CRO A 68 ? 0.0883 0.1858 0.1465 -0.0503 0.0155 -0.0585 66 CRO A C2 +965 O O2 . CRO A 68 ? 0.1263 0.2307 0.1968 -0.0451 0.0105 -0.0579 66 CRO A O2 +966 C CA2 . CRO A 68 ? 0.1640 0.2544 0.2102 -0.0526 0.0204 -0.0584 66 CRO A CA2 +967 C CA3 . CRO A 68 ? 0.0990 0.1812 0.1423 -0.0520 0.0140 -0.0542 66 CRO A CA3 +968 C C3 . CRO A 68 ? 0.1257 0.2076 0.1715 -0.0447 0.0108 -0.0500 66 CRO A C3 +969 O O3 . CRO A 68 ? 0.1500 0.2356 0.1970 -0.0471 0.0065 -0.0492 66 CRO A O3 +970 C CB2 . CRO A 68 ? 0.1593 0.2607 0.2132 -0.0544 0.0222 -0.0635 66 CRO A CB2 +971 C CG2 . CRO A 68 ? 0.1771 0.2719 0.2140 -0.0615 0.0278 -0.0644 66 CRO A CG2 +972 C CD1 . CRO A 68 ? 0.1287 0.2373 0.1746 -0.0657 0.0317 -0.0729 66 CRO A CD1 +973 C CD2 . CRO A 68 ? 0.1391 0.2134 0.1516 -0.0646 0.0291 -0.0573 66 CRO A CD2 +974 C CE1 . CRO A 68 ? 0.1485 0.2513 0.1751 -0.0750 0.0376 -0.0744 66 CRO A CE1 +975 C CE2 . CRO A 68 ? 0.2267 0.2937 0.2202 -0.0732 0.0328 -0.0566 66 CRO A CE2 +976 C CZ . CRO A 68 ? 0.2047 0.2860 0.2029 -0.0792 0.0372 -0.0650 66 CRO A CZ +977 O OH . CRO A 68 ? 0.2049 0.2787 0.1796 -0.0904 0.0415 -0.0649 66 CRO A OH +978 N N . VAL A 69 ? 0.0899 0.1647 0.1326 -0.0378 0.0130 -0.0470 68 VAL A N +979 C CA . VAL A 69 ? 0.0861 0.1610 0.1319 -0.0320 0.0120 -0.0442 68 VAL A CA +980 C C . VAL A 69 ? 0.1262 0.2090 0.1831 -0.0253 0.0086 -0.0421 68 VAL A C +981 O O . VAL A 69 ? 0.1116 0.1906 0.1690 -0.0195 0.0095 -0.0399 68 VAL A O +982 C CB . VAL A 69 ? 0.0993 0.1596 0.1353 -0.0303 0.0184 -0.0444 68 VAL A CB +983 C CG1 . VAL A 69 ? 0.1251 0.1793 0.1499 -0.0387 0.0217 -0.0480 68 VAL A CG1 +984 C CG2 . VAL A 69 ? 0.1090 0.1573 0.1397 -0.0274 0.0207 -0.0430 68 VAL A CG2 +993 N N . GLN A 70 ? 0.1632 0.1483 0.1554 0.0326 -0.0029 -0.0093 69 GLN A N +994 C CA . GLN A 70 ? 0.1715 0.1585 0.1693 0.0266 -0.0059 -0.0056 69 GLN A CA +995 C C . GLN A 70 ? 0.1695 0.1669 0.1675 0.0206 -0.0052 0.0027 69 GLN A C +996 O O . GLN A 70 ? 0.1581 0.1597 0.1625 0.0150 -0.0080 0.0057 69 GLN A O +997 C CB . GLN A 70 ? 0.1621 0.1363 0.1648 0.0235 -0.0119 -0.0116 69 GLN A CB +998 C CG . GLN A 70 ? 0.1518 0.1194 0.1601 0.0256 -0.0073 -0.0238 69 GLN A CG +999 C CD . GLN A 70 ? 0.2095 0.1748 0.2302 0.0199 -0.0090 -0.0305 69 GLN A CD +1000 O OE1 . GLN A 70 ? 0.2654 0.2297 0.2936 0.0220 -0.0190 -0.0309 69 GLN A OE1 +1001 N NE2 . GLN A 70 ? 0.3101 0.2736 0.3289 0.0131 -0.0004 -0.0344 69 GLN A NE2 +1010 N N . CYS A 71 ? 0.1352 0.1357 0.1247 0.0196 0.0003 0.0049 70 CYS A N +1011 C CA . CYS A 71 ? 0.1759 0.1891 0.1671 0.0112 0.0080 0.0092 70 CYS A CA +1012 C C . CYS A 71 ? 0.0971 0.1350 0.1141 0.0147 0.0124 0.0064 70 CYS A C +1013 O O . CYS A 71 ? 0.1226 0.1769 0.1530 0.0070 0.0184 0.0067 70 CYS A O +1014 C CB . CYS A 71 ? 0.2053 0.2122 0.1754 0.0067 0.0173 0.0091 70 CYS A CB +1015 S SG . CYS A 71 ? 0.2107 0.2184 0.1778 0.0186 0.0227 0.0011 70 CYS A SG +1021 N N . PHE A 72 ? 0.1103 0.1487 0.1350 0.0256 0.0079 0.0028 71 PHE A N +1022 C CA . PHE A 72 ? 0.1296 0.1844 0.1775 0.0313 0.0043 0.0007 71 PHE A CA +1023 C C . PHE A 72 ? 0.1272 0.1758 0.1763 0.0286 -0.0093 0.0041 71 PHE A C +1024 O O . PHE A 72 ? 0.1237 0.1789 0.1874 0.0339 -0.0188 0.0031 71 PHE A O +1025 C CB . PHE A 72 ? 0.1157 0.1678 0.1660 0.0442 0.0047 -0.0043 71 PHE A CB +1026 C CG . PHE A 72 ? 0.1265 0.1912 0.1836 0.0467 0.0190 -0.0105 71 PHE A CG +1027 C CD1 . PHE A 72 ? 0.0899 0.1815 0.1780 0.0470 0.0266 -0.0169 71 PHE A CD1 +1028 C CD2 . PHE A 72 ? 0.1353 0.1854 0.1695 0.0473 0.0257 -0.0122 71 PHE A CD2 +1029 C CE1 . PHE A 72 ? 0.1490 0.2514 0.2414 0.0461 0.0450 -0.0258 71 PHE A CE1 +1030 C CE2 . PHE A 72 ? 0.1329 0.1903 0.1659 0.0470 0.0403 -0.0188 71 PHE A CE2 +1031 C CZ . PHE A 72 ? 0.1159 0.1984 0.1761 0.0458 0.0517 -0.0259 71 PHE A CZ +1041 N N . ALA A 73 ? 0.1297 0.1635 0.1634 0.0203 -0.0116 0.0069 72 ALA A N +1042 C CA . ALA A 73 ? 0.1473 0.1724 0.1772 0.0147 -0.0218 0.0086 72 ALA A CA +1043 C C . ALA A 73 ? 0.0966 0.1426 0.1487 0.0095 -0.0270 0.0103 72 ALA A C +1044 O O . ALA A 73 ? 0.0952 0.1592 0.1620 0.0044 -0.0182 0.0102 72 ALA A O +1045 C CB . ALA A 73 ? 0.1378 0.1463 0.1542 0.0070 -0.0205 0.0080 72 ALA A CB +1051 N N . ARG A 74 ? 0.1067 0.1483 0.1596 0.0091 -0.0412 0.0108 73 ARG A N +1052 C CA . ARG A 74 ? 0.1022 0.1635 0.1796 0.0029 -0.0495 0.0105 73 ARG A CA +1053 C C . ARG A 74 ? 0.1738 0.2236 0.2375 -0.0111 -0.0487 0.0130 73 ARG A C +1054 O O . ARG A 74 ? 0.1522 0.1772 0.1910 -0.0145 -0.0549 0.0132 73 ARG A O +1055 C CB . ARG A 74 ? 0.1205 0.1779 0.2030 0.0086 -0.0716 0.0099 73 ARG A CB +1056 C CG . ARG A 74 ? 0.1196 0.2037 0.2381 0.0031 -0.0821 0.0067 73 ARG A CG +1057 C CD . ARG A 74 ? 0.3131 0.3883 0.4329 0.0102 -0.1057 0.0053 73 ARG A CD +1058 N NE . ARG A 74 ? 0.3977 0.4352 0.4729 0.0020 -0.1174 0.0102 73 ARG A NE +1059 C CZ . ARG A 74 ? 0.4434 0.4783 0.5149 -0.0098 -0.1240 0.0100 73 ARG A CZ +1060 N NH1 . ARG A 74 ? 0.3223 0.3906 0.4328 -0.0154 -0.1209 0.0056 73 ARG A NH1 +1061 N NH2 . ARG A 74 ? 0.5484 0.5451 0.5747 -0.0178 -0.1311 0.0129 73 ARG A NH2 +1075 N N . TYR A 75 ? 0.1230 0.1872 0.2001 -0.0204 -0.0394 0.0138 74 TYR A N +1076 C CA . TYR A 75 ? 0.1110 0.1648 0.1801 -0.0341 -0.0410 0.0159 74 TYR A CA +1077 C C . TYR A 75 ? 0.1163 0.1909 0.2119 -0.0420 -0.0504 0.0134 74 TYR A C +1078 O O . TYR A 75 ? 0.1123 0.2160 0.2396 -0.0442 -0.0443 0.0097 74 TYR A O +1079 C CB . TYR A 75 ? 0.1510 0.1979 0.2108 -0.0417 -0.0279 0.0193 74 TYR A CB +1080 C CG . TYR A 75 ? 0.1412 0.1606 0.1762 -0.0361 -0.0274 0.0201 74 TYR A CG +1081 C CD1 . TYR A 75 ? 0.1437 0.1612 0.1729 -0.0244 -0.0234 0.0185 74 TYR A CD1 +1082 C CD2 . TYR A 75 ? 0.1336 0.1302 0.1566 -0.0422 -0.0318 0.0203 74 TYR A CD2 +1083 C CE1 . TYR A 75 ? 0.1389 0.1355 0.1543 -0.0194 -0.0242 0.0162 74 TYR A CE1 +1084 C CE2 . TYR A 75 ? 0.1621 0.1373 0.1739 -0.0356 -0.0330 0.0171 74 TYR A CE2 +1085 C CZ . TYR A 75 ? 0.1395 0.1164 0.1494 -0.0245 -0.0296 0.0146 74 TYR A CZ +1086 O OH . TYR A 75 ? 0.1558 0.1161 0.1632 -0.0179 -0.0320 0.0084 74 TYR A OH +1096 N N . PRO A 76 ? 0.1267 0.1871 0.2114 -0.0470 -0.0652 0.0131 75 PRO A N +1097 C CA . PRO A 76 ? 0.1350 0.2129 0.2445 -0.0561 -0.0773 0.0100 75 PRO A CA +1098 C C . PRO A 76 ? 0.1345 0.2263 0.2605 -0.0714 -0.0634 0.0097 75 PRO A C +1099 O O . PRO A 76 ? 0.1366 0.2093 0.2398 -0.0764 -0.0505 0.0143 75 PRO A O +1100 C CB . PRO A 76 ? 0.1739 0.2211 0.2515 -0.0618 -0.0898 0.0102 75 PRO A CB +1101 C CG . PRO A 76 ? 0.2476 0.2671 0.2911 -0.0537 -0.0879 0.0116 75 PRO A CG +1102 C CD . PRO A 76 ? 0.1939 0.2201 0.2422 -0.0468 -0.0697 0.0133 75 PRO A CD +1110 N N . ASP A 77 ? 0.1393 0.2580 0.2995 -0.0779 -0.0662 0.0028 76 ASP A N +1111 C CA . ASP A 77 ? 0.1914 0.3226 0.3666 -0.0951 -0.0492 0.0002 76 ASP A CA +1112 C C . ASP A 77 ? 0.1930 0.2892 0.3324 -0.1065 -0.0451 0.0066 76 ASP A C +1113 O O . ASP A 77 ? 0.1910 0.2768 0.3184 -0.1171 -0.0292 0.0109 76 ASP A O +1114 C CB . ASP A 77 ? 0.2518 0.4137 0.4647 -0.1004 -0.0537 -0.0123 76 ASP A CB +1115 C CG . ASP A 77 ? 0.2991 0.4980 0.5503 -0.0898 -0.0538 -0.0187 76 ASP A CG +1116 O OD1 . ASP A 77 ? 0.2831 0.4856 0.5366 -0.0800 -0.0444 -0.0172 76 ASP A OD1 +1117 O OD2 . ASP A 77 ? 0.3110 0.5320 0.5918 -0.0897 -0.0635 -0.0257 76 ASP A OD2 +1122 N N . HIS A 78 ? 0.1716 0.2452 0.2898 -0.1038 -0.0586 0.0068 77 HIS A N +1123 C CA . HIS A 78 ? 0.2400 0.2817 0.3301 -0.1113 -0.0546 0.0098 77 HIS A CA +1124 C C . HIS A 78 ? 0.2755 0.2894 0.3371 -0.1057 -0.0490 0.0162 77 HIS A C +1125 O O . HIS A 78 ? 0.2689 0.2562 0.3115 -0.1083 -0.0468 0.0176 77 HIS A O +1126 C CB . HIS A 78 ? 0.2123 0.2390 0.2894 -0.1108 -0.0672 0.0055 77 HIS A CB +1127 C CG . HIS A 78 ? 0.2008 0.2073 0.2523 -0.1003 -0.0739 0.0058 77 HIS A CG +1128 N ND1 . HIS A 78 ? 0.2395 0.2541 0.2925 -0.0914 -0.0843 0.0055 77 HIS A ND1 +1129 C CD2 . HIS A 78 ? 0.2592 0.2368 0.2839 -0.0977 -0.0702 0.0042 77 HIS A CD2 +1130 C CE1 . HIS A 78 ? 0.2494 0.2376 0.2718 -0.0868 -0.0848 0.0049 77 HIS A CE1 +1131 N NE2 . HIS A 78 ? 0.2555 0.2242 0.2639 -0.0905 -0.0749 0.0026 77 HIS A NE2 +1140 N N . MET A 79 ? 0.1871 0.2072 0.2492 -0.0967 -0.0483 0.0187 78 MET A N +1141 C CA . MET A 79 ? 0.1963 0.1917 0.2366 -0.0900 -0.0452 0.0221 78 MET A CA +1142 C C . MET A 79 ? 0.1987 0.1997 0.2367 -0.0878 -0.0335 0.0270 78 MET A C +1143 O O . MET A 79 ? 0.2278 0.2105 0.2491 -0.0788 -0.0326 0.0289 78 MET A O +1144 C CB . MET A 79 ? 0.1805 0.1709 0.2131 -0.0757 -0.0498 0.0176 78 MET A CB +1145 C CG . MET A 79 ? 0.2600 0.2334 0.2799 -0.0773 -0.0560 0.0111 78 MET A CG +1146 S SD . MET A 79 ? 0.2128 0.1723 0.2150 -0.0679 -0.0565 0.0049 78 MET A SD +1147 C CE . MET A 79 ? 0.2083 0.1552 0.2108 -0.0590 -0.0466 0.0022 78 MET A CE +1157 N N . LYS A 80 ? 0.1838 0.2086 0.2388 -0.0975 -0.0239 0.0270 79 LYS A N +1158 C CA . LYS A 80 ? 0.2006 0.2290 0.2484 -0.0975 -0.0095 0.0294 79 LYS A CA +1159 C C . LYS A 80 ? 0.3059 0.2944 0.3149 -0.1046 -0.0072 0.0378 79 LYS A C +1160 O O . LYS A 80 ? 0.2608 0.2396 0.2511 -0.0997 -0.0017 0.0405 79 LYS A O +1161 C CB . LYS A 80 ? 0.2079 0.2727 0.2871 -0.1085 0.0047 0.0231 79 LYS A CB +1162 C CG . LYS A 80 ? 0.2891 0.3886 0.4044 -0.0917 -0.0016 0.0148 79 LYS A CG +1163 C CD . LYS A 80 ? 0.3698 0.5108 0.5297 -0.0974 0.0105 0.0036 79 LYS A CD +1164 C CE . LYS A 80 ? 0.2985 0.4661 0.4947 -0.0780 -0.0050 -0.0040 79 LYS A CE +1165 N NZ . LYS A 80 ? 0.3497 0.5033 0.5254 -0.0585 -0.0084 -0.0004 79 LYS A NZ +1179 N N A GLN A 81 ? 0.2235 0.1849 0.2184 -0.1152 -0.0145 0.0416 80 GLN A N +1180 N N B GLN A 81 ? 0.2261 0.1873 0.2208 -0.1151 -0.0145 0.0416 80 GLN A N +1181 C CA A GLN A 81 ? 0.2579 0.1765 0.2157 -0.1152 -0.0187 0.0481 80 GLN A CA +1182 C CA B GLN A 81 ? 0.2581 0.1765 0.2155 -0.1152 -0.0186 0.0482 80 GLN A CA +1183 C C A GLN A 81 ? 0.2643 0.1603 0.2122 -0.0974 -0.0336 0.0484 80 GLN A C +1184 C C B GLN A 81 ? 0.2665 0.1619 0.2156 -0.0972 -0.0346 0.0479 80 GLN A C +1185 O O A GLN A 81 ? 0.2788 0.1428 0.2009 -0.0931 -0.0421 0.0520 80 GLN A O +1186 O O B GLN A 81 ? 0.2988 0.1614 0.2250 -0.0928 -0.0445 0.0506 80 GLN A O +1187 C CB A GLN A 81 ? 0.3591 0.2585 0.3085 -0.1234 -0.0223 0.0485 80 GLN A CB +1188 C CB B GLN A 81 ? 0.3456 0.2458 0.2938 -0.1251 -0.0204 0.0489 80 GLN A CB +1189 C CG A GLN A 81 ? 0.3374 0.2338 0.3010 -0.1144 -0.0348 0.0425 80 GLN A CG +1190 C CG B GLN A 81 ? 0.3558 0.2732 0.3107 -0.1440 -0.0030 0.0476 80 GLN A CG +1191 C CD A GLN A 81 ? 0.3955 0.3218 0.3862 -0.1207 -0.0312 0.0361 80 GLN A CD +1192 C CD B GLN A 81 ? 0.3363 0.2492 0.2690 -0.1527 0.0128 0.0505 80 GLN A CD +1193 O OE1 A GLN A 81 ? 0.2299 0.1883 0.2427 -0.1200 -0.0277 0.0328 80 GLN A OE1 +1194 O OE1 B GLN A 81 ? 0.3715 0.2456 0.2623 -0.1558 0.0096 0.0571 80 GLN A OE1 +1195 N NE2 A GLN A 81 ? 0.3612 0.2764 0.3510 -0.1264 -0.0342 0.0337 80 GLN A NE2 +1196 N NE2 B GLN A 81 ? 0.3092 0.2616 0.2702 -0.1558 0.0288 0.0436 80 GLN A NE2 +1213 N N . HIS A 82 ? 0.2178 0.1343 0.1886 -0.0837 -0.0367 0.0411 81 HIS A N +1214 C CA . HIS A 82 ? 0.2640 0.1663 0.2353 -0.0666 -0.0470 0.0357 81 HIS A CA +1215 C C . HIS A 82 ? 0.2018 0.1199 0.1756 -0.0538 -0.0421 0.0335 81 HIS A C +1216 O O . HIS A 82 ? 0.2103 0.1253 0.1922 -0.0405 -0.0474 0.0259 81 HIS A O +1217 C CB . HIS A 82 ? 0.2656 0.1733 0.2553 -0.0624 -0.0506 0.0255 81 HIS A CB +1218 C CG . HIS A 82 ? 0.2601 0.1589 0.2483 -0.0694 -0.0524 0.0243 81 HIS A CG +1219 N ND1 . HIS A 82 ? 0.2591 0.1330 0.2401 -0.0650 -0.0598 0.0230 81 HIS A ND1 +1220 C CD2 . HIS A 82 ? 0.2393 0.1508 0.2330 -0.0800 -0.0488 0.0239 81 HIS A CD2 +1221 C CE1 . HIS A 82 ? 0.2873 0.1570 0.2678 -0.0733 -0.0590 0.0223 81 HIS A CE1 +1222 N NE2 . HIS A 82 ? 0.2715 0.1637 0.2592 -0.0826 -0.0521 0.0225 81 HIS A NE2 +1232 N N . ASP A 83 ? 0.2282 0.1323 0.1862 0.0145 -0.0529 0.0197 82 ASP A N +1233 C CA . ASP A 83 ? 0.1704 0.0900 0.1340 0.0070 -0.0433 0.0162 82 ASP A CA +1234 C C . ASP A 83 ? 0.2500 0.1787 0.2102 0.0104 -0.0457 0.0139 82 ASP A C +1235 O O . ASP A 83 ? 0.2330 0.1549 0.1885 0.0067 -0.0445 0.0211 82 ASP A O +1236 C CB . ASP A 83 ? 0.1737 0.0831 0.1402 -0.0036 -0.0356 0.0252 82 ASP A CB +1237 C CG . ASP A 83 ? 0.1771 0.1007 0.1515 -0.0119 -0.0254 0.0210 82 ASP A CG +1238 O OD1 . ASP A 83 ? 0.2046 0.1458 0.1806 -0.0102 -0.0240 0.0121 82 ASP A OD1 +1239 O OD2 . ASP A 83 ? 0.2008 0.1175 0.1810 -0.0203 -0.0191 0.0269 82 ASP A OD2 +1244 N N . PHE A 84 ? 0.2016 0.1463 0.1641 0.0170 -0.0494 0.0040 83 PHE A N +1245 C CA . PHE A 84 ? 0.1804 0.1355 0.1399 0.0199 -0.0527 0.0014 83 PHE A CA +1246 C C . PHE A 84 ? 0.1977 0.1612 0.1584 0.0102 -0.0430 0.0012 83 PHE A C +1247 O O . PHE A 84 ? 0.2421 0.2040 0.1958 0.0084 -0.0441 0.0051 83 PHE A O +1248 C CB . PHE A 84 ? 0.1808 0.1546 0.1464 0.0275 -0.0568 -0.0105 83 PHE A CB +1249 C CG . PHE A 84 ? 0.1829 0.1719 0.1480 0.0279 -0.0582 -0.0147 83 PHE A CG +1250 C CD1 . PHE A 84 ? 0.2475 0.2327 0.2061 0.0350 -0.0694 -0.0115 83 PHE A CD1 +1251 C CD2 . PHE A 84 ? 0.1940 0.2003 0.1647 0.0207 -0.0492 -0.0212 83 PHE A CD2 +1252 C CE1 . PHE A 84 ? 0.2562 0.2554 0.2132 0.0346 -0.0716 -0.0148 83 PHE A CE1 +1253 C CE2 . PHE A 84 ? 0.1879 0.2084 0.1575 0.0205 -0.0509 -0.0253 83 PHE A CE2 +1254 C CZ . PHE A 84 ? 0.2248 0.2419 0.1871 0.0273 -0.0621 -0.0221 83 PHE A CZ +1264 N N . PHE A 85 ? 0.1610 0.1337 0.1304 0.0034 -0.0338 -0.0037 84 PHE A N +1265 C CA . PHE A 85 ? 0.1703 0.1538 0.1439 -0.0053 -0.0246 -0.0067 84 PHE A CA +1266 C C . PHE A 85 ? 0.1678 0.1386 0.1371 -0.0118 -0.0201 0.0019 84 PHE A C +1267 O O . PHE A 85 ? 0.1795 0.1562 0.1451 -0.0149 -0.0176 0.0004 84 PHE A O +1268 C CB . PHE A 85 ? 0.1743 0.1652 0.1586 -0.0124 -0.0163 -0.0109 84 PHE A CB +1269 C CG . PHE A 85 ? 0.1874 0.1917 0.1763 -0.0079 -0.0187 -0.0196 84 PHE A CG +1270 C CD1 . PHE A 85 ? 0.1378 0.1632 0.1306 -0.0058 -0.0189 -0.0296 84 PHE A CD1 +1271 C CD2 . PHE A 85 ? 0.1617 0.1585 0.1513 -0.0066 -0.0202 -0.0180 84 PHE A CD2 +1272 C CE1 . PHE A 85 ? 0.1615 0.2012 0.1600 -0.0024 -0.0199 -0.0381 84 PHE A CE1 +1273 C CE2 . PHE A 85 ? 0.1518 0.1627 0.1456 -0.0033 -0.0211 -0.0271 84 PHE A CE2 +1274 C CZ . PHE A 85 ? 0.1639 0.1964 0.1625 -0.0011 -0.0207 -0.0372 84 PHE A CZ +1284 N N . LYS A 86 ? 0.2075 0.1611 0.1771 -0.0142 -0.0189 0.0106 85 LYS A N +1285 C CA . LYS A 86 ? 0.2301 0.1730 0.1971 -0.0201 -0.0143 0.0183 85 LYS A CA +1286 C C . LYS A 86 ? 0.2671 0.2034 0.2210 -0.0157 -0.0215 0.0235 85 LYS A C +1287 O O . LYS A 86 ? 0.2271 0.1626 0.1765 -0.0207 -0.0174 0.0260 85 LYS A O +1288 C CB . LYS A 86 ? 0.2189 0.1458 0.1912 -0.0241 -0.0116 0.0267 85 LYS A CB +1289 C CG . LYS A 86 ? 0.1808 0.1126 0.1662 -0.0310 -0.0040 0.0236 85 LYS A CG +1290 C CD . LYS A 86 ? 0.1897 0.1132 0.1830 -0.0314 -0.0003 0.0297 85 LYS A CD +1291 C CE . LYS A 86 ? 0.1568 0.0890 0.1613 -0.0332 0.0063 0.0246 85 LYS A CE +1292 N NZ . LYS A 86 ? 0.1694 0.1015 0.1710 -0.0363 -0.0009 0.0231 85 LYS A NZ +1306 N N . SER A 87 ? 0.2139 0.1452 0.1619 -0.0069 -0.0325 0.0251 86 SER A N +1307 C CA . SER A 87 ? 0.2391 0.1615 0.1748 -0.0031 -0.0412 0.0320 86 SER A CA +1308 C C . SER A 87 ? 0.2451 0.1811 0.1742 -0.0038 -0.0421 0.0274 86 SER A C +1309 O O . SER A 87 ? 0.2392 0.1694 0.1569 -0.0052 -0.0457 0.0339 86 SER A O +1310 C CB . SER A 87 ? 0.2738 0.1880 0.2067 0.0072 -0.0537 0.0336 86 SER A CB +1311 O OG . SER A 87 ? 0.2595 0.1881 0.1939 0.0145 -0.0598 0.0246 86 SER A OG +1317 N N . ALA A 88 ? 0.2294 0.1836 0.1650 -0.0039 -0.0387 0.0167 87 ALA A N +1318 C CA . ALA A 88 ? 0.2525 0.2208 0.1825 -0.0051 -0.0399 0.0115 87 ALA A CA +1319 C C . ALA A 88 ? 0.2416 0.2131 0.1695 -0.0157 -0.0287 0.0109 87 ALA A C +1320 O O . ALA A 88 ? 0.2724 0.2535 0.1930 -0.0183 -0.0291 0.0075 87 ALA A O +1321 C CB . ALA A 88 ? 0.2536 0.2410 0.1924 -0.0011 -0.0411 0.0000 87 ALA A CB +1327 N N . MET A 89 ? 0.2239 0.1878 0.1591 -0.0220 -0.0187 0.0135 88 MET A N +1328 C CA . MET A 89 ? 0.2569 0.2239 0.1935 -0.0317 -0.0072 0.0115 88 MET A CA +1329 C C . MET A 89 ? 0.2838 0.2397 0.2082 -0.0351 -0.0072 0.0203 88 MET A C +1330 O O . MET A 89 ? 0.2854 0.2277 0.2044 -0.0311 -0.0143 0.0297 88 MET A O +1331 C CB . MET A 89 ? 0.1922 0.1558 0.1445 -0.0365 0.0025 0.0107 88 MET A CB +1332 C CG . MET A 89 ? 0.1751 0.1506 0.1384 -0.0351 0.0032 0.0024 88 MET A CG +1333 S SD . MET A 89 ? 0.1990 0.1960 0.1626 -0.0382 0.0064 -0.0102 88 MET A SD +1334 C CE . MET A 89 ? 0.1990 0.2087 0.1725 -0.0333 0.0024 -0.0172 88 MET A CE +1344 N N . PRO A 90 ? 0.2921 0.2539 0.2119 -0.0429 0.0009 0.0170 89 PRO A N +1345 C CA . PRO A 90 ? 0.2225 0.1989 0.1498 -0.0485 0.0102 0.0056 89 PRO A CA +1346 C C . PRO A 90 ? 0.2365 0.2287 0.1568 -0.0464 0.0044 -0.0025 89 PRO A C +1347 O O . PRO A 90 ? 0.2621 0.2666 0.1905 -0.0499 0.0103 -0.0123 89 PRO A O +1348 C CB . PRO A 90 ? 0.2206 0.1943 0.1446 -0.0575 0.0209 0.0061 89 PRO A CB +1349 C CG . PRO A 90 ? 0.2746 0.2393 0.1804 -0.0565 0.0134 0.0163 89 PRO A CG +1350 C CD . PRO A 90 ? 0.2734 0.2271 0.1802 -0.0477 0.0022 0.0246 89 PRO A CD +1358 N N A GLU A 91 ? 0.2710 0.2624 0.1779 -0.0409 -0.0077 0.0021 90 GLU A N +1359 N N B GLU A 91 ? 0.2672 0.2589 0.1738 -0.0411 -0.0076 0.0019 90 GLU A N +1360 C CA A GLU A 91 ? 0.2796 0.2855 0.1794 -0.0391 -0.0147 -0.0042 90 GLU A CA +1361 C CA B GLU A 91 ? 0.2686 0.2754 0.1687 -0.0394 -0.0142 -0.0049 90 GLU A CA +1362 C C A GLU A 91 ? 0.2673 0.2865 0.1810 -0.0346 -0.0158 -0.0134 90 GLU A C +1363 C C B GLU A 91 ? 0.2688 0.2884 0.1831 -0.0349 -0.0153 -0.0138 90 GLU A C +1364 O O A GLU A 91 ? 0.2650 0.2997 0.1790 -0.0368 -0.0155 -0.0221 90 GLU A O +1365 O O B GLU A 91 ? 0.2753 0.3104 0.1904 -0.0372 -0.0146 -0.0227 90 GLU A O +1366 C CB A GLU A 91 ? 0.3794 0.3793 0.2647 -0.0331 -0.0295 0.0043 90 GLU A CB +1367 C CB B GLU A 91 ? 0.3494 0.3516 0.2348 -0.0336 -0.0290 0.0029 90 GLU A CB +1368 C CG A GLU A 91 ? 0.4204 0.4084 0.2894 -0.0390 -0.0289 0.0141 90 GLU A CG +1369 C CG B GLU A 91 ? 0.4104 0.4036 0.2783 -0.0401 -0.0287 0.0112 90 GLU A CG +1370 C CD A GLU A 91 ? 0.3989 0.3683 0.2704 -0.0377 -0.0279 0.0246 90 GLU A CD +1371 C CD B GLU A 91 ? 0.4479 0.4336 0.3021 -0.0345 -0.0447 0.0210 90 GLU A CD +1372 O OE1 A GLU A 91 ? 0.2740 0.2383 0.1592 -0.0325 -0.0274 0.0245 90 GLU A OE1 +1373 O OE1 B GLU A 91 ? 0.4403 0.4140 0.2987 -0.0268 -0.0522 0.0279 90 GLU A OE1 +1374 O OE2 A GLU A 91 ? 0.4378 0.3979 0.2968 -0.0427 -0.0277 0.0332 90 GLU A OE2 +1375 O OE2 B GLU A 91 ? 0.4790 0.4703 0.3182 -0.0381 -0.0503 0.0220 90 GLU A OE2 +1388 N N . GLY A 92 ? 0.2411 0.2546 0.1659 -0.0291 -0.0171 -0.0115 91 GLY A N +1389 C CA . GLY A 92 ? 0.2157 0.2409 0.1547 -0.0265 -0.0158 -0.0197 91 GLY A CA +1390 C C . GLY A 92 ? 0.2057 0.2395 0.1461 -0.0166 -0.0275 -0.0225 91 GLY A C +1391 O O . GLY A 92 ? 0.2412 0.2683 0.1730 -0.0099 -0.0384 -0.0167 91 GLY A O +1396 N N . TYR A 93 ? 0.2119 0.2608 0.1642 -0.0159 -0.0253 -0.0315 92 TYR A N +1397 C CA . TYR A 93 ? 0.1876 0.2474 0.1445 -0.0065 -0.0350 -0.0361 92 TYR A CA +1398 C C . TYR A 93 ? 0.1796 0.2615 0.1457 -0.0090 -0.0321 -0.0472 92 TYR A C +1399 O O . TYR A 93 ? 0.1787 0.2653 0.1501 -0.0177 -0.0219 -0.0512 92 TYR A O +1400 C CB . TYR A 93 ? 0.2114 0.2638 0.1756 -0.0003 -0.0367 -0.0342 92 TYR A CB +1401 C CG . TYR A 93 ? 0.1596 0.2105 0.1335 -0.0068 -0.0257 -0.0357 92 TYR A CG +1402 C CD1 . TYR A 93 ? 0.1590 0.2270 0.1441 -0.0098 -0.0207 -0.0447 92 TYR A CD1 +1403 C CD2 . TYR A 93 ? 0.2194 0.2517 0.1916 -0.0102 -0.0215 -0.0272 92 TYR A CD2 +1404 C CE1 . TYR A 93 ? 0.1386 0.2044 0.1321 -0.0167 -0.0118 -0.0447 92 TYR A CE1 +1405 C CE2 . TYR A 93 ? 0.1980 0.2281 0.1792 -0.0163 -0.0132 -0.0274 92 TYR A CE2 +1406 C CZ . TYR A 93 ? 0.1525 0.1989 0.1440 -0.0196 -0.0086 -0.0359 92 TYR A CZ +1407 O OH . TYR A 93 ? 0.1739 0.2168 0.1739 -0.0268 -0.0012 -0.0346 92 TYR A OH +1417 N N . VAL A 94 ? 0.1772 0.2723 0.1465 -0.0012 -0.0416 -0.0520 93 VAL A N +1418 C CA . VAL A 94 ? 0.1706 0.2883 0.1510 -0.0021 -0.0401 -0.0628 93 VAL A CA +1419 C C . VAL A 94 ? 0.1740 0.2974 0.1673 0.0025 -0.0385 -0.0671 93 VAL A C +1420 O O . VAL A 94 ? 0.1948 0.3114 0.1886 0.0117 -0.0455 -0.0645 93 VAL A O +1421 C CB . VAL A 94 ? 0.1866 0.3171 0.1651 0.0039 -0.0517 -0.0659 93 VAL A CB +1422 C CG1 . VAL A 94 ? 0.1767 0.3319 0.1685 0.0034 -0.0506 -0.0771 93 VAL A CG1 +1423 C CG2 . VAL A 94 ? 0.1932 0.3194 0.1569 -0.0020 -0.0535 -0.0620 93 VAL A CG2 +1433 N N . GLN A 95 ? 0.1493 0.2850 0.1526 -0.0044 -0.0296 -0.0736 94 GLN A N +1434 C CA . GLN A 95 ? 0.1406 0.2833 0.1548 -0.0025 -0.0266 -0.0779 94 GLN A CA +1435 C C . GLN A 95 ? 0.1368 0.3057 0.1621 -0.0032 -0.0264 -0.0887 94 GLN A C +1436 O O . GLN A 95 ? 0.1329 0.3117 0.1609 -0.0121 -0.0208 -0.0925 94 GLN A O +1437 C CB . GLN A 95 ? 0.1315 0.2630 0.1474 -0.0115 -0.0163 -0.0739 94 GLN A CB +1438 C CG . GLN A 95 ? 0.1235 0.2648 0.1495 -0.0123 -0.0124 -0.0788 94 GLN A CG +1439 C CD . GLN A 95 ? 0.1177 0.2433 0.1433 -0.0193 -0.0054 -0.0721 94 GLN A CD +1440 O OE1 . GLN A 95 ? 0.1464 0.2518 0.1648 -0.0168 -0.0074 -0.0638 94 GLN A OE1 +1441 N NE2 . GLN A 95 ? 0.1097 0.2442 0.1433 -0.0289 0.0021 -0.0751 94 GLN A NE2 +1450 N N . GLU A 96 ? 0.1392 0.3194 0.1715 0.0066 -0.0332 -0.0939 95 GLU A N +1451 C CA . GLU A 96 ? 0.1361 0.3428 0.1808 0.0073 -0.0337 -0.1044 95 GLU A CA +1452 C C . GLU A 96 ? 0.1295 0.3458 0.1846 0.0087 -0.0292 -0.1102 95 GLU A C +1453 O O . GLU A 96 ? 0.1487 0.3535 0.2020 0.0153 -0.0313 -0.1077 95 GLU A O +1454 C CB . GLU A 96 ? 0.1463 0.3621 0.1929 0.0179 -0.0463 -0.1072 95 GLU A CB +1455 C CG . GLU A 96 ? 0.1890 0.3978 0.2236 0.0150 -0.0512 -0.1019 95 GLU A CG +1456 C CD . GLU A 96 ? 0.3712 0.5844 0.4059 0.0252 -0.0652 -0.1017 95 GLU A CD +1457 O OE1 . GLU A 96 ? 0.4738 0.6738 0.5049 0.0346 -0.0737 -0.0966 95 GLU A OE1 +1458 O OE2 . GLU A 96 ? 0.4229 0.6481 0.4605 0.0234 -0.0667 -0.1044 95 GLU A OE2 +1465 N N . ARG A 97 ? 0.1223 0.3596 0.1876 0.0018 -0.0229 -0.1178 96 ARG A N +1466 C CA . ARG A 97 ? 0.1184 0.3673 0.1927 0.0022 -0.0174 -0.1237 96 ARG A CA +1467 C C . ARG A 97 ? 0.1336 0.4027 0.2166 0.0031 -0.0149 -0.1317 96 ARG A C +1468 O O . ARG A 97 ? 0.1310 0.4051 0.2135 -0.0010 -0.0139 -0.1317 96 ARG A O +1469 C CB . ARG A 97 ? 0.1108 0.3533 0.1830 -0.0105 -0.0066 -0.1202 96 ARG A CB +1470 C CG . ARG A 97 ? 0.1099 0.3274 0.1725 -0.0126 -0.0057 -0.1107 96 ARG A CG +1471 C CD . ARG A 97 ? 0.1046 0.3217 0.1690 -0.0209 0.0023 -0.1102 96 ARG A CD +1472 N NE . ARG A 97 ? 0.1294 0.3201 0.1845 -0.0227 0.0033 -0.0998 96 ARG A NE +1473 C CZ . ARG A 97 ? 0.1310 0.3069 0.1826 -0.0324 0.0079 -0.0917 96 ARG A CZ +1474 N NH1 . ARG A 97 ? 0.1306 0.3140 0.1866 -0.0412 0.0120 -0.0930 96 ARG A NH1 +1475 N NH2 . ARG A 97 ? 0.1032 0.2566 0.1480 -0.0333 0.0081 -0.0827 96 ARG A NH2 +1489 N N . THR A 98 ? 0.1243 0.4044 0.2140 0.0078 -0.0134 -0.1389 97 THR A N +1490 C CA . THR A 98 ? 0.1755 0.4711 0.2693 0.0032 -0.0074 -0.1459 97 THR A CA +1491 C C . THR A 98 ? 0.1887 0.4813 0.2787 -0.0055 0.0007 -0.1461 97 THR A C +1492 O O . THR A 98 ? 0.1512 0.4394 0.2414 -0.0017 -0.0002 -0.1464 97 THR A O +1493 C CB . THR A 98 ? 0.1356 0.4467 0.2393 0.0144 -0.0135 -0.1550 97 THR A CB +1494 O OG1 . THR A 98 ? 0.2007 0.5108 0.3063 0.0221 -0.0229 -0.1528 97 THR A OG1 +1495 C CG2 . THR A 98 ? 0.1866 0.5134 0.2936 0.0080 -0.0079 -0.1617 97 THR A CG2 +1503 N N . ILE A 99 ? 0.1285 0.4210 0.2137 -0.0174 0.0076 -0.1445 98 ILE A N +1504 C CA . ILE A 99 ? 0.1245 0.4127 0.2045 -0.0269 0.0137 -0.1431 98 ILE A CA +1505 C C . ILE A 99 ? 0.1320 0.4369 0.2153 -0.0297 0.0155 -0.1508 98 ILE A C +1506 O O . ILE A 99 ? 0.1428 0.4528 0.2262 -0.0338 0.0170 -0.1512 98 ILE A O +1507 C CB . ILE A 99 ? 0.1307 0.4009 0.2019 -0.0386 0.0189 -0.1328 98 ILE A CB +1508 C CG1 . ILE A 99 ? 0.1144 0.3690 0.1837 -0.0362 0.0169 -0.1253 98 ILE A CG1 +1509 C CG2 . ILE A 99 ? 0.1520 0.4164 0.2174 -0.0476 0.0237 -0.1299 98 ILE A CG2 +1510 C CD1 . ILE A 99 ? 0.1125 0.3483 0.1749 -0.0463 0.0211 -0.1157 98 ILE A CD1 +1522 N N . PHE A 100 ? 0.1826 0.4972 0.2697 -0.0270 0.0152 -0.1574 99 PHE A N +1523 C CA . PHE A 100 ? 0.1508 0.4829 0.2422 -0.0300 0.0172 -0.1654 99 PHE A CA +1524 C C . PHE A 100 ? 0.1656 0.4939 0.2492 -0.0429 0.0234 -0.1620 99 PHE A C +1525 O O . PHE A 100 ? 0.1463 0.4712 0.2277 -0.0445 0.0245 -0.1616 99 PHE A O +1526 C CB . PHE A 100 ? 0.1489 0.4952 0.2507 -0.0191 0.0131 -0.1755 99 PHE A CB +1527 C CG . PHE A 100 ? 0.1493 0.4989 0.2594 -0.0047 0.0057 -0.1790 99 PHE A CG +1528 C CD1 . PHE A 100 ? 0.1544 0.5175 0.2718 -0.0010 0.0034 -0.1841 99 PHE A CD1 +1529 C CD2 . PHE A 100 ? 0.2030 0.5417 0.3136 0.0050 0.0006 -0.1765 99 PHE A CD2 +1530 C CE1 . PHE A 100 ? 0.1563 0.5215 0.2814 0.0120 -0.0044 -0.1862 99 PHE A CE1 +1531 C CE2 . PHE A 100 ? 0.1696 0.5094 0.2871 0.0184 -0.0075 -0.1784 99 PHE A CE2 +1532 C CZ . PHE A 100 ? 0.2218 0.5747 0.3466 0.0217 -0.0102 -0.1831 99 PHE A CZ +1542 N N . PHE A 101 ? 0.1760 0.5047 0.2554 -0.0520 0.0271 -0.1593 100 PHE A N +1543 C CA . PHE A 101 ? 0.1551 0.4805 0.2268 -0.0640 0.0323 -0.1556 100 PHE A CA +1544 C C . PHE A 101 ? 0.1954 0.5426 0.2728 -0.0649 0.0336 -0.1661 100 PHE A C +1545 O O . PHE A 101 ? 0.1683 0.5321 0.2537 -0.0616 0.0326 -0.1735 100 PHE A O +1546 C CB . PHE A 101 ? 0.1620 0.4783 0.2280 -0.0723 0.0351 -0.1482 100 PHE A CB +1547 C CG . PHE A 101 ? 0.1841 0.4774 0.2447 -0.0730 0.0347 -0.1374 100 PHE A CG +1548 C CD1 . PHE A 101 ? 0.1834 0.4739 0.2476 -0.0669 0.0318 -0.1370 100 PHE A CD1 +1549 C CD2 . PHE A 101 ? 0.1483 0.4233 0.2006 -0.0798 0.0371 -0.1277 100 PHE A CD2 +1550 C CE1 . PHE A 101 ? 0.1983 0.4685 0.2583 -0.0680 0.0317 -0.1278 100 PHE A CE1 +1551 C CE2 . PHE A 101 ? 0.1567 0.4104 0.2059 -0.0799 0.0365 -0.1178 100 PHE A CE2 +1552 C CZ . PHE A 101 ? 0.1745 0.4261 0.2277 -0.0742 0.0341 -0.1183 100 PHE A CZ +1562 N N . LYS A 102 ? 0.1663 0.5144 0.2405 -0.0693 0.0357 -0.1670 101 LYS A N +1563 C CA . LYS A 102 ? 0.1749 0.5445 0.2561 -0.0695 0.0370 -0.1778 101 LYS A CA +1564 C C . LYS A 102 ? 0.1829 0.5640 0.2631 -0.0777 0.0405 -0.1796 101 LYS A C +1565 O O . LYS A 102 ? 0.1843 0.5545 0.2545 -0.0876 0.0434 -0.1711 101 LYS A O +1566 C CB . LYS A 102 ? 0.1781 0.5461 0.2547 -0.0749 0.0395 -0.1777 101 LYS A CB +1567 C CG . LYS A 102 ? 0.1882 0.5791 0.2727 -0.0754 0.0416 -0.1893 101 LYS A CG +1568 C CD . LYS A 102 ? 0.2774 0.6664 0.3555 -0.0833 0.0450 -0.1883 101 LYS A CD +1569 C CE . LYS A 102 ? 0.3639 0.7764 0.4497 -0.0846 0.0482 -0.2004 101 LYS A CE +1570 N NZ . LYS A 102 ? 0.5040 0.9264 0.6047 -0.0694 0.0453 -0.2103 101 LYS A NZ +1584 N N . ASP A 103 ? 0.1888 0.5915 0.2803 -0.0727 0.0399 -0.1904 102 ASP A N +1585 C CA . ASP A 103 ? 0.1970 0.6143 0.2903 -0.0794 0.0430 -0.1936 102 ASP A CA +1586 C C . ASP A 103 ? 0.2406 0.6497 0.3313 -0.0811 0.0424 -0.1869 102 ASP A C +1587 O O . ASP A 103 ? 0.1997 0.6148 0.2885 -0.0893 0.0454 -0.1858 102 ASP A O +1588 C CB . ASP A 103 ? 0.2215 0.6413 0.3058 -0.0930 0.0483 -0.1918 102 ASP A CB +1589 C CG . ASP A 103 ? 0.2557 0.6887 0.3443 -0.0924 0.0498 -0.2005 102 ASP A CG +1590 O OD1 . ASP A 103 ? 0.2155 0.6672 0.3175 -0.0844 0.0489 -0.2117 102 ASP A OD1 +1591 O OD2 . ASP A 103 ? 0.2132 0.6379 0.2926 -0.0996 0.0519 -0.1963 102 ASP A OD2 +1596 N N . ASP A 104 ? 0.2162 0.6120 0.3071 -0.0738 0.0385 -0.1824 103 ASP A N +1597 C CA . ASP A 104 ? 0.1899 0.5769 0.2781 -0.0762 0.0383 -0.1758 103 ASP A CA +1598 C C . ASP A 104 ? 0.1985 0.5817 0.2922 -0.0651 0.0331 -0.1763 103 ASP A C +1599 O O . ASP A 104 ? 0.1753 0.5673 0.2772 -0.0548 0.0294 -0.1832 103 ASP A O +1600 C CB . ASP A 104 ? 0.2133 0.5783 0.2891 -0.0855 0.0410 -0.1637 103 ASP A CB +1601 C CG . ASP A 104 ? 0.2118 0.5726 0.2856 -0.0923 0.0426 -0.1582 103 ASP A CG +1602 O OD1 . ASP A 104 ? 0.2315 0.6011 0.3122 -0.0885 0.0408 -0.1619 103 ASP A OD1 +1603 O OD2 . ASP A 104 ? 0.2261 0.5744 0.2919 -0.1013 0.0452 -0.1498 103 ASP A OD2 +1608 N N . GLY A 105 ? 0.2331 0.6037 0.3230 -0.0669 0.0326 -0.1691 104 GLY A N +1609 C CA . GLY A 105 ? 0.1650 0.5341 0.2596 -0.0577 0.0279 -0.1697 104 GLY A CA +1610 C C . GLY A 105 ? 0.1611 0.5152 0.2524 -0.0516 0.0253 -0.1655 104 GLY A C +1611 O O . GLY A 105 ? 0.1555 0.5019 0.2422 -0.0533 0.0267 -0.1634 104 GLY A O +1615 N N . ASN A 106 ? 0.1529 0.5035 0.2468 -0.0448 0.0212 -0.1642 105 ASN A N +1616 C CA . ASN A 106 ? 0.1460 0.4834 0.2374 -0.0386 0.0183 -0.1600 105 ASN A CA +1617 C C . ASN A 106 ? 0.1654 0.4900 0.2528 -0.0401 0.0176 -0.1530 105 ASN A C +1618 O O . ASN A 106 ? 0.1522 0.4825 0.2417 -0.0420 0.0172 -0.1538 105 ASN A O +1619 C CB . ASN A 106 ? 0.1472 0.4957 0.2481 -0.0251 0.0119 -0.1670 105 ASN A CB +1620 C CG . ASN A 106 ? 0.2159 0.5765 0.3248 -0.0191 0.0072 -0.1706 105 ASN A CG +1621 O OD1 . ASN A 106 ? 0.1874 0.5412 0.2952 -0.0163 0.0036 -0.1661 105 ASN A OD1 +1622 N ND2 . ASN A 106 ? 0.1920 0.5709 0.3093 -0.0178 0.0069 -0.1786 105 ASN A ND2 +1629 N N . TYR A 107 ? 0.1694 0.4775 0.2517 -0.0394 0.0173 -0.1465 106 TYR A N +1630 C CA . TYR A 107 ? 0.1390 0.4362 0.2188 -0.0393 0.0158 -0.1408 106 TYR A CA +1631 C C . TYR A 107 ? 0.1823 0.4822 0.2666 -0.0279 0.0089 -0.1420 106 TYR A C +1632 O O . TYR A 107 ? 0.1275 0.4270 0.2138 -0.0214 0.0065 -0.1434 106 TYR A O +1633 C CB . TYR A 107 ? 0.1275 0.4028 0.1991 -0.0466 0.0197 -0.1317 106 TYR A CB +1634 C CG . TYR A 107 ? 0.1417 0.4082 0.2081 -0.0575 0.0251 -0.1274 106 TYR A CG +1635 C CD1 . TYR A 107 ? 0.1355 0.4126 0.2038 -0.0616 0.0266 -0.1311 106 TYR A CD1 +1636 C CD2 . TYR A 107 ? 0.1270 0.3736 0.1875 -0.0630 0.0279 -0.1189 106 TYR A CD2 +1637 C CE1 . TYR A 107 ? 0.1627 0.4310 0.2271 -0.0708 0.0305 -0.1264 106 TYR A CE1 +1638 C CE2 . TYR A 107 ? 0.1336 0.3707 0.1905 -0.0715 0.0313 -0.1138 106 TYR A CE2 +1639 C CZ . TYR A 107 ? 0.2067 0.4549 0.2656 -0.0753 0.0325 -0.1175 106 TYR A CZ +1640 O OH . TYR A 107 ? 0.1409 0.3797 0.1973 -0.0831 0.0351 -0.1119 106 TYR A OH +1650 N N . LYS A 108 ? 0.1359 0.4375 0.2214 -0.0255 0.0048 -0.1411 107 LYS A N +1651 C CA . LYS A 108 ? 0.1291 0.4266 0.2153 -0.0167 -0.0032 -0.1387 107 LYS A CA +1652 C C . LYS A 108 ? 0.1261 0.4082 0.2044 -0.0234 -0.0018 -0.1314 107 LYS A C +1653 O O . LYS A 108 ? 0.1279 0.4100 0.2040 -0.0307 0.0017 -0.1309 107 LYS A O +1654 C CB . LYS A 108 ? 0.1543 0.4657 0.2470 -0.0084 -0.0116 -0.1432 107 LYS A CB +1655 C CG . LYS A 108 ? 0.2171 0.5429 0.3193 0.0000 -0.0140 -0.1512 107 LYS A CG +1656 C CD . LYS A 108 ? 0.2919 0.6300 0.4017 0.0080 -0.0231 -0.1548 107 LYS A CD +1663 N N . THR A 109 ? 0.1227 0.3914 0.1967 -0.0208 -0.0046 -0.1261 108 THR A N +1664 C CA . THR A 109 ? 0.1208 0.3734 0.1868 -0.0276 -0.0027 -0.1197 108 THR A CA +1665 C C . THR A 109 ? 0.1347 0.3781 0.1935 -0.0208 -0.0123 -0.1161 108 THR A C +1666 O O . THR A 109 ? 0.1276 0.3706 0.1871 -0.0110 -0.0195 -0.1163 108 THR A O +1667 C CB . THR A 109 ? 0.1140 0.3526 0.1777 -0.0348 0.0048 -0.1149 108 THR A CB +1668 O OG1 . THR A 109 ? 0.1192 0.3535 0.1832 -0.0285 0.0011 -0.1136 108 THR A OG1 +1669 C CG2 . THR A 109 ? 0.1147 0.3565 0.1798 -0.0418 0.0127 -0.1168 108 THR A CG2 +1677 N N . ARG A 110 ? 0.1289 0.3634 0.1793 -0.0261 -0.0122 -0.1128 109 ARG A N +1678 C CA . ARG A 110 ? 0.1360 0.3577 0.1746 -0.0219 -0.0201 -0.1081 109 ARG A CA +1679 C C . ARG A 110 ? 0.1345 0.3411 0.1649 -0.0318 -0.0133 -0.1042 109 ARG A C +1680 O O . ARG A 110 ? 0.1747 0.3840 0.2066 -0.0401 -0.0068 -0.1062 109 ARG A O +1681 C CB . ARG A 110 ? 0.1479 0.3766 0.1823 -0.0171 -0.0290 -0.1090 109 ARG A CB +1682 C CG . ARG A 110 ? 0.1583 0.3723 0.1774 -0.0138 -0.0374 -0.1027 109 ARG A CG +1683 C CD . ARG A 110 ? 0.1891 0.4080 0.2016 -0.0124 -0.0456 -0.1022 109 ARG A CD +1684 N NE . ARG A 110 ? 0.2795 0.4841 0.2771 -0.0079 -0.0549 -0.0948 109 ARG A NE +1685 C CZ . ARG A 110 ? 0.3231 0.5140 0.3050 -0.0146 -0.0525 -0.0901 109 ARG A CZ +1686 N NH1 . ARG A 110 ? 0.2727 0.4616 0.2528 -0.0257 -0.0408 -0.0927 109 ARG A NH1 +1687 N NH2 . ARG A 110 ? 0.3350 0.5111 0.3039 -0.0099 -0.0605 -0.0813 109 ARG A NH2 +1701 N N . ALA A 111 ? 0.1357 0.3225 0.1581 -0.0294 -0.0135 -0.0967 110 ALA A N +1702 C CA . ALA A 111 ? 0.1384 0.3074 0.1551 -0.0372 -0.0057 -0.0913 110 ALA A CA +1703 C C . ALA A 111 ? 0.1557 0.3062 0.1581 -0.0328 -0.0102 -0.0829 110 ALA A C +1704 O O . ALA A 111 ? 0.1633 0.3089 0.1616 -0.0231 -0.0186 -0.0787 110 ALA A O +1705 C CB . ALA A 111 ? 0.1331 0.2940 0.1577 -0.0412 0.0019 -0.0883 110 ALA A CB +1711 N N . GLU A 112 ? 0.1482 0.2883 0.1438 -0.0402 -0.0042 -0.0805 111 GLU A N +1712 C CA . GLU A 112 ? 0.1726 0.2943 0.1554 -0.0385 -0.0058 -0.0719 111 GLU A CA +1713 C C . GLU A 112 ? 0.1924 0.2986 0.1792 -0.0444 0.0040 -0.0673 111 GLU A C +1714 O O . GLU A 112 ? 0.1452 0.2533 0.1385 -0.0532 0.0128 -0.0715 111 GLU A O +1715 C CB . GLU A 112 ? 0.1715 0.2955 0.1414 -0.0422 -0.0078 -0.0733 111 GLU A CB +1716 C CG . GLU A 112 ? 0.2268 0.3655 0.1931 -0.0359 -0.0196 -0.0765 111 GLU A CG +1717 C CD . GLU A 112 ? 0.3545 0.4931 0.3045 -0.0391 -0.0240 -0.0755 111 GLU A CD +1718 O OE1 . GLU A 112 ? 0.3642 0.4911 0.3046 -0.0459 -0.0172 -0.0725 111 GLU A OE1 +1719 O OE2 . GLU A 112 ? 0.3000 0.4511 0.2476 -0.0352 -0.0343 -0.0780 111 GLU A OE2 +1726 N N . VAL A 113 ? 0.1569 0.2474 0.1405 -0.0395 0.0018 -0.0586 112 VAL A N +1727 C CA . VAL A 113 ? 0.1442 0.2186 0.1320 -0.0441 0.0095 -0.0526 112 VAL A CA +1728 C C . VAL A 113 ? 0.2232 0.2814 0.1989 -0.0434 0.0086 -0.0443 112 VAL A C +1729 O O . VAL A 113 ? 0.1613 0.2130 0.1280 -0.0360 -0.0001 -0.0385 112 VAL A O +1730 C CB . VAL A 113 ? 0.1506 0.2201 0.1457 -0.0400 0.0077 -0.0490 112 VAL A CB +1731 C CG1 . VAL A 113 ? 0.1301 0.1834 0.1308 -0.0454 0.0148 -0.0423 112 VAL A CG1 +1732 C CG2 . VAL A 113 ? 0.1792 0.2667 0.1848 -0.0405 0.0080 -0.0571 112 VAL A CG2 +1742 N N . LYS A 114 ? 0.1662 0.2179 0.1421 -0.0512 0.0174 -0.0440 113 LYS A N +1743 C CA . LYS A 114 ? 0.1773 0.2162 0.1413 -0.0519 0.0178 -0.0369 113 LYS A CA +1744 C C . LYS A 114 ? 0.1776 0.2085 0.1483 -0.0603 0.0296 -0.0369 113 LYS A C +1745 O O . LYS A 114 ? 0.1816 0.2181 0.1653 -0.0659 0.0368 -0.0434 113 LYS A O +1746 C CB . LYS A 114 ? 0.2173 0.2645 0.1660 -0.0521 0.0129 -0.0399 113 LYS A CB +1747 C CG . LYS A 114 ? 0.2788 0.3379 0.2289 -0.0603 0.0203 -0.0502 113 LYS A CG +1748 C CD . LYS A 114 ? 0.3508 0.4184 0.2841 -0.0608 0.0140 -0.0526 113 LYS A CD +1755 N N . PHE A 115 ? 0.1937 0.2122 0.1567 -0.0614 0.0314 -0.0297 114 PHE A N +1756 C CA . PHE A 115 ? 0.1884 0.2010 0.1580 -0.0692 0.0430 -0.0307 114 PHE A CA +1757 C C . PHE A 115 ? 0.1878 0.2089 0.1483 -0.0754 0.0484 -0.0386 114 PHE A C +1758 O O . PHE A 115 ? 0.2626 0.2870 0.2050 -0.0742 0.0426 -0.0375 114 PHE A O +1759 C CB . PHE A 115 ? 0.2723 0.2689 0.2390 -0.0684 0.0436 -0.0198 114 PHE A CB +1760 C CG . PHE A 115 ? 0.2192 0.2052 0.2008 -0.0670 0.0444 -0.0137 114 PHE A CG +1761 C CD1 . PHE A 115 ? 0.2445 0.2243 0.2232 -0.0599 0.0350 -0.0066 114 PHE A CD1 +1762 C CD2 . PHE A 115 ? 0.2064 0.1885 0.2054 -0.0730 0.0542 -0.0153 114 PHE A CD2 +1763 C CE1 . PHE A 115 ? 0.2058 0.1756 0.1967 -0.0595 0.0354 -0.0009 114 PHE A CE1 +1764 C CE2 . PHE A 115 ? 0.2756 0.2500 0.2863 -0.0655 0.0489 -0.0082 114 PHE A CE2 +1765 C CZ . PHE A 115 ? 0.2132 0.1810 0.2202 -0.0629 0.0423 -0.0013 114 PHE A CZ +1775 N N . GLU A 116 ? 0.1824 0.2061 0.1554 -0.0824 0.0591 -0.0464 115 GLU A N +1776 C CA . GLU A 116 ? 0.2068 0.2362 0.1735 -0.0896 0.0670 -0.0548 115 GLU A CA +1777 C C . GLU A 116 ? 0.2510 0.2706 0.2313 -0.0947 0.0790 -0.0545 115 GLU A C +1778 O O . GLU A 116 ? 0.2066 0.2221 0.2039 -0.0921 0.0804 -0.0581 115 GLU A O +1779 C CB . GLU A 116 ? 0.2329 0.2771 0.2025 -0.0928 0.0677 -0.0670 115 GLU A CB +1780 C CG . GLU A 116 ? 0.2577 0.3123 0.2126 -0.0877 0.0555 -0.0667 115 GLU A CG +1781 C CD . GLU A 116 ? 0.3917 0.4622 0.3479 -0.0910 0.0549 -0.0783 115 GLU A CD +1782 O OE1 . GLU A 116 ? 0.2409 0.3141 0.2125 -0.0962 0.0625 -0.0860 115 GLU A OE1 +1783 O OE2 . GLU A 116 ? 0.4036 0.4836 0.3456 -0.0887 0.0459 -0.0792 115 GLU A OE2 +1790 N N . GLY A 117 ? 0.2511 0.2631 0.2216 -0.0957 0.0813 -0.0483 116 GLY A N +1791 C CA . GLY A 117 ? 0.2372 0.2372 0.2204 -0.0931 0.0855 -0.0454 116 GLY A CA +1792 C C . GLY A 117 ? 0.1827 0.1728 0.1807 -0.0843 0.0788 -0.0362 116 GLY A C +1793 O O . GLY A 117 ? 0.2373 0.2239 0.2302 -0.0823 0.0727 -0.0276 116 GLY A O +1797 N N . ASP A 118 ? 0.2166 0.2029 0.2314 -0.0791 0.0794 -0.0381 117 ASP A N +1798 C CA . ASP A 118 ? 0.2578 0.2375 0.2844 -0.0706 0.0720 -0.0285 117 ASP A CA +1799 C C . ASP A 118 ? 0.2847 0.2687 0.3154 -0.0683 0.0664 -0.0291 117 ASP A C +1800 O O . ASP A 118 ? 0.2284 0.2090 0.2658 -0.0625 0.0592 -0.0213 117 ASP A O +1801 C CB . ASP A 118 ? 0.3078 0.2837 0.3480 -0.0666 0.0739 -0.0285 117 ASP A CB +1802 C CG . ASP A 118 ? 0.4533 0.4327 0.5025 -0.0670 0.0777 -0.0382 117 ASP A CG +1803 O OD1 . ASP A 118 ? 0.4079 0.3934 0.4527 -0.0711 0.0796 -0.0462 117 ASP A OD1 +1804 O OD2 . ASP A 118 ? 0.6077 0.5839 0.6686 -0.0636 0.0787 -0.0379 117 ASP A OD2 +1809 N N . THR A 119 ? 0.1547 0.1478 0.1803 -0.0736 0.0690 -0.0385 118 THR A N +1810 C CA . THR A 119 ? 0.1535 0.1524 0.1842 -0.0718 0.0645 -0.0403 118 THR A CA +1811 C C . THR A 119 ? 0.1849 0.1909 0.2073 -0.0744 0.0605 -0.0398 118 THR A C +1812 O O . THR A 119 ? 0.1788 0.1934 0.1897 -0.0810 0.0627 -0.0442 118 THR A O +1813 C CB . THR A 119 ? 0.1504 0.1568 0.1838 -0.0754 0.0690 -0.0519 118 THR A CB +1814 O OG1 . THR A 119 ? 0.2694 0.2692 0.3121 -0.0730 0.0728 -0.0530 118 THR A OG1 +1815 C CG2 . THR A 119 ? 0.1650 0.1782 0.2030 -0.0739 0.0645 -0.0535 118 THR A CG2 +1823 N N . LEU A 120 ? 0.1746 0.1794 0.2024 -0.0699 0.0544 -0.0346 119 LEU A N +1824 C CA . LEU A 120 ? 0.1323 0.1463 0.1556 -0.0722 0.0506 -0.0362 119 LEU A CA +1825 C C . LEU A 120 ? 0.1547 0.1838 0.1811 -0.0746 0.0509 -0.0462 119 LEU A C +1826 O O . LEU A 120 ? 0.1662 0.1932 0.2002 -0.0713 0.0501 -0.0459 119 LEU A O +1827 C CB . LEU A 120 ? 0.1494 0.1551 0.1768 -0.0667 0.0445 -0.0271 119 LEU A CB +1828 C CG . LEU A 120 ? 0.1456 0.1569 0.1675 -0.0658 0.0388 -0.0270 119 LEU A CG +1829 C CD1 . LEU A 120 ? 0.1668 0.1949 0.1938 -0.0671 0.0377 -0.0355 119 LEU A CD1 +1830 C CD2 . LEU A 120 ? 0.1698 0.1814 0.1743 -0.0594 0.0327 -0.0256 119 LEU A CD2 +1842 N N A VAL A 121 ? 0.1431 0.1866 0.1604 -0.0767 0.0489 -0.0529 120 VAL A N +1843 N N B VAL A 121 ? 0.1489 0.1925 0.1663 -0.0771 0.0494 -0.0533 120 VAL A N +1844 C CA A VAL A 121 ? 0.1332 0.1933 0.1531 -0.0797 0.0491 -0.0632 120 VAL A CA +1845 C CA B VAL A 121 ? 0.1326 0.1929 0.1534 -0.0800 0.0492 -0.0633 120 VAL A CA +1846 C C A VAL A 121 ? 0.1372 0.2093 0.1531 -0.0732 0.0399 -0.0640 120 VAL A C +1847 C C B VAL A 121 ? 0.1301 0.2011 0.1469 -0.0732 0.0400 -0.0633 120 VAL A C +1848 O O A VAL A 121 ? 0.1824 0.2536 0.1863 -0.0658 0.0324 -0.0602 120 VAL A O +1849 O O B VAL A 121 ? 0.1381 0.2059 0.1441 -0.0655 0.0327 -0.0581 120 VAL A O +1850 C CB A VAL A 121 ? 0.2208 0.2868 0.2299 -0.0827 0.0514 -0.0700 120 VAL A CB +1851 C CB B VAL A 121 ? 0.1439 0.2123 0.1550 -0.0834 0.0516 -0.0714 120 VAL A CB +1852 C CG1 A VAL A 121 ? 0.1451 0.2277 0.1578 -0.0868 0.0516 -0.0807 120 VAL A CG1 +1853 C CG1 B VAL A 121 ? 0.2198 0.2780 0.2348 -0.0895 0.0615 -0.0727 120 VAL A CG1 +1854 C CG2 A VAL A 121 ? 0.2015 0.2565 0.2147 -0.0887 0.0614 -0.0701 120 VAL A CG2 +1855 C CG2 B VAL A 121 ? 0.2908 0.3617 0.2827 -0.0770 0.0432 -0.0686 120 VAL A CG2 +1874 N N . ASN A 122 ? 0.1351 0.2183 0.1620 -0.0763 0.0406 -0.0691 121 ASN A N +1875 C CA . ASN A 122 ? 0.1207 0.2180 0.1467 -0.0710 0.0334 -0.0717 121 ASN A CA +1876 C C . ASN A 122 ? 0.1511 0.2667 0.1803 -0.0755 0.0342 -0.0822 121 ASN A C +1877 O O . ASN A 122 ? 0.1781 0.2908 0.2130 -0.0777 0.0388 -0.0830 121 ASN A O +1878 C CB . ASN A 122 ? 0.1107 0.2064 0.1472 -0.0718 0.0339 -0.0683 121 ASN A CB +1879 C CG . ASN A 122 ? 0.1214 0.2330 0.1580 -0.0664 0.0278 -0.0721 121 ASN A CG +1880 O OD1 . ASN A 122 ? 0.1145 0.2356 0.1437 -0.0598 0.0215 -0.0755 121 ASN A OD1 +1881 N ND2 . ASN A 122 ? 0.1307 0.2420 0.1732 -0.0670 0.0291 -0.0701 121 ASN A ND2 +1889 N N A ARG A 123 ? 0.1553 0.2808 0.1740 -0.0713 0.0282 -0.0860 122 ARG A N +1890 N N B ARG A 123 ? 0.1527 0.2784 0.1714 -0.0712 0.0281 -0.0860 122 ARG A N +1891 C CA A ARG A 123 ? 0.1403 0.2840 0.1612 -0.0752 0.0275 -0.0957 122 ARG A CA +1892 C CA B ARG A 123 ? 0.1432 0.2869 0.1638 -0.0753 0.0275 -0.0957 122 ARG A CA +1893 C C A ARG A 123 ? 0.1390 0.2995 0.1616 -0.0686 0.0194 -0.0984 122 ARG A C +1894 C C B ARG A 123 ? 0.1423 0.3036 0.1643 -0.0687 0.0191 -0.0989 122 ARG A C +1895 O O A ARG A 123 ? 0.1380 0.2974 0.1528 -0.0594 0.0115 -0.0946 122 ARG A O +1896 O O B ARG A 123 ? 0.1388 0.3005 0.1521 -0.0599 0.0109 -0.0959 122 ARG A O +1897 C CB A ARG A 123 ? 0.1467 0.2906 0.1547 -0.0771 0.0268 -0.0988 122 ARG A CB +1898 C CB B ARG A 123 ? 0.1543 0.2972 0.1622 -0.0775 0.0274 -0.0988 122 ARG A CB +1899 C CG A ARG A 123 ? 0.2092 0.3411 0.2179 -0.0852 0.0366 -0.0999 122 ARG A CG +1900 C CG B ARG A 123 ? 0.1487 0.2761 0.1557 -0.0839 0.0366 -0.0974 122 ARG A CG +1901 C CD A ARG A 123 ? 0.2764 0.4112 0.2708 -0.0882 0.0364 -0.1048 122 ARG A CD +1902 C CD B ARG A 123 ? 0.2382 0.3720 0.2421 -0.0913 0.0411 -0.1061 122 ARG A CD +1903 N NE A ARG A 123 ? 0.2513 0.3776 0.2294 -0.0825 0.0312 -0.0972 122 ARG A NE +1904 N NE B ARG A 123 ? 0.2386 0.3593 0.2375 -0.0965 0.0489 -0.1065 122 ARG A NE +1905 C CZ A ARG A 123 ? 0.2774 0.3894 0.2482 -0.0847 0.0366 -0.0930 122 ARG A CZ +1906 C CZ B ARG A 123 ? 0.1883 0.2972 0.1995 -0.1001 0.0580 -0.1052 122 ARG A CZ +1907 N NH1 A ARG A 123 ? 0.1765 0.2812 0.1561 -0.0918 0.0476 -0.0963 122 ARG A NH1 +1908 N NH1 B ARG A 123 ? 0.2865 0.3885 0.3081 -0.0949 0.0581 -0.1006 122 ARG A NH1 +1909 N NH2 A ARG A 123 ? 0.3640 0.4693 0.3194 -0.0800 0.0306 -0.0855 122 ARG A NH2 +1910 N NH2 B ARG A 123 ? 0.1664 0.2652 0.1743 -0.1042 0.0653 -0.1063 122 ARG A NH2 +1937 N N . ILE A 124 ? 0.1422 0.3137 0.1746 -0.0701 0.0224 -0.1016 123 ILE A N +1938 C CA . ILE A 124 ? 0.1242 0.3105 0.1616 -0.0639 0.0175 -0.1035 123 ILE A CA +1939 C C . ILE A 124 ? 0.1285 0.3305 0.1693 -0.0646 0.0175 -0.1092 123 ILE A C +1940 O O . ILE A 124 ? 0.1357 0.3354 0.1776 -0.0709 0.0237 -0.1111 123 ILE A O +1941 C CB . ILE A 124 ? 0.1319 0.3126 0.1759 -0.0646 0.0223 -0.1002 123 ILE A CB +1942 C CG1 . ILE A 124 ? 0.1691 0.3317 0.2120 -0.0655 0.0239 -0.0930 123 ILE A CG1 +1943 C CG2 . ILE A 124 ? 0.1149 0.3103 0.1632 -0.0583 0.0179 -0.1029 123 ILE A CG2 +1944 C CD1 . ILE A 124 ? 0.1180 0.2643 0.1623 -0.0691 0.0299 -0.0876 123 ILE A CD1 +1957 N N A GLU A 125 ? 0.1310 0.3477 0.1731 -0.0574 0.0100 -0.1118 124 GLU A N +1958 N N B GLU A 125 ? 0.1307 0.3475 0.1732 -0.0574 0.0102 -0.1118 124 GLU A N +1959 C CA A GLU A 125 ? 0.1340 0.3670 0.1818 -0.0571 0.0096 -0.1170 124 GLU A CA +1960 C CA B GLU A 125 ? 0.1340 0.3670 0.1818 -0.0573 0.0098 -0.1170 124 GLU A CA +1961 C C A GLU A 125 ? 0.1460 0.3873 0.2013 -0.0527 0.0099 -0.1183 124 GLU A C +1962 C C B GLU A 125 ? 0.1508 0.3939 0.2062 -0.0522 0.0092 -0.1188 124 GLU A C +1963 O O A GLU A 125 ? 0.1452 0.3866 0.2013 -0.0457 0.0053 -0.1169 124 GLU A O +1964 O O B GLU A 125 ? 0.1283 0.3742 0.1849 -0.0442 0.0032 -0.1182 124 GLU A O +1965 C CB A GLU A 125 ? 0.1437 0.3864 0.1872 -0.0521 0.0004 -0.1190 124 GLU A CB +1966 C CB B GLU A 125 ? 0.1441 0.3855 0.1869 -0.0535 0.0013 -0.1190 124 GLU A CB +1967 C CG A GLU A 125 ? 0.1594 0.4208 0.2107 -0.0489 -0.0026 -0.1241 124 GLU A CG +1968 C CG B GLU A 125 ? 0.2152 0.4460 0.2474 -0.0594 0.0025 -0.1177 124 GLU A CG +1969 C CD A GLU A 125 ? 0.2306 0.4992 0.2777 -0.0500 -0.0081 -0.1264 124 GLU A CD +1970 C CD B GLU A 125 ? 0.3126 0.5490 0.3360 -0.0565 -0.0065 -0.1185 124 GLU A CD +1971 O OE1 A GLU A 125 ? 0.1716 0.4361 0.2096 -0.0459 -0.0165 -0.1238 124 GLU A OE1 +1972 O OE1 B GLU A 125 ? 0.2789 0.5195 0.3007 -0.0475 -0.0162 -0.1168 124 GLU A OE1 +1973 O OE2 A GLU A 125 ? 0.2512 0.5284 0.3026 -0.0553 -0.0043 -0.1304 124 GLU A OE2 +1974 O OE2 B GLU A 125 ? 0.2438 0.4796 0.2618 -0.0631 -0.0042 -0.1206 124 GLU A OE2 +1987 N N . LEU A 126 ? 0.1295 0.3765 0.1885 -0.0569 0.0150 -0.1211 125 LEU A N +1988 C CA . LEU A 126 ? 0.1279 0.3833 0.1916 -0.0541 0.0156 -0.1234 125 LEU A CA +1989 C C . LEU A 126 ? 0.1336 0.4055 0.2018 -0.0547 0.0151 -0.1293 125 LEU A C +1990 O O . LEU A 126 ? 0.1520 0.4236 0.2190 -0.0611 0.0179 -0.1304 125 LEU A O +1991 C CB . LEU A 126 ? 0.1429 0.3827 0.2035 -0.0600 0.0217 -0.1188 125 LEU A CB +1992 C CG . LEU A 126 ? 0.1256 0.3710 0.1881 -0.0598 0.0231 -0.1203 125 LEU A CG +1993 C CD1 . LEU A 126 ? 0.1225 0.3495 0.1810 -0.0635 0.0262 -0.1132 125 LEU A CD1 +1994 C CD2 . LEU A 126 ? 0.1317 0.3860 0.1959 -0.0648 0.0253 -0.1239 125 LEU A CD2 +2007 N N . LYS A 127 ? 0.1373 0.4238 0.2113 -0.0477 0.0113 -0.1335 126 LYS A N +2008 C CA . LYS A 127 ? 0.1444 0.4478 0.2241 -0.0476 0.0105 -0.1394 126 LYS A CA +2009 C C . LYS A 127 ? 0.1599 0.4693 0.2425 -0.0465 0.0129 -0.1422 126 LYS A C +2010 O O . LYS A 127 ? 0.1525 0.4648 0.2379 -0.0389 0.0099 -0.1437 126 LYS A O +2011 C CB . LYS A 127 ? 0.1640 0.4813 0.2490 -0.0393 0.0018 -0.1429 126 LYS A CB +2012 C CG . LYS A 127 ? 0.2599 0.5956 0.3526 -0.0388 0.0007 -0.1492 126 LYS A CG +2013 C CD . LYS A 127 ? 0.3687 0.7113 0.4622 -0.0396 -0.0045 -0.1502 126 LYS A CD +2014 C CE . LYS A 127 ? 0.3801 0.7415 0.4824 -0.0393 -0.0059 -0.1562 126 LYS A CE +2015 N NZ . LYS A 127 ? 0.3722 0.7419 0.4771 -0.0360 -0.0150 -0.1571 126 LYS A NZ +2029 N N . GLY A 128 ? 0.1435 0.4545 0.2253 -0.0541 0.0176 -0.1432 127 GLY A N +2030 C CA . GLY A 128 ? 0.1455 0.4634 0.2291 -0.0551 0.0199 -0.1461 127 GLY A CA +2031 C C . GLY A 128 ? 0.1577 0.4959 0.2487 -0.0546 0.0186 -0.1530 127 GLY A C +2032 O O . GLY A 128 ? 0.1560 0.4975 0.2479 -0.0589 0.0188 -0.1534 127 GLY A O +2036 N N . ILE A 129 ? 0.1607 0.5127 0.2576 -0.0494 0.0173 -0.1589 128 ILE A N +2037 C CA . ILE A 129 ? 0.1678 0.5406 0.2737 -0.0483 0.0158 -0.1661 128 ILE A CA +2038 C C . ILE A 129 ? 0.2357 0.6180 0.3439 -0.0496 0.0188 -0.1708 128 ILE A C +2039 O O . ILE A 129 ? 0.2054 0.5804 0.3097 -0.0485 0.0201 -0.1698 128 ILE A O +2040 C CB . ILE A 129 ? 0.2166 0.6025 0.3323 -0.0370 0.0081 -0.1709 128 ILE A CB +2041 C CG1 . ILE A 129 ? 0.2885 0.6763 0.4082 -0.0266 0.0046 -0.1742 128 ILE A CG1 +2042 C CG2 . ILE A 129 ? 0.3034 0.6805 0.4159 -0.0359 0.0041 -0.1660 128 ILE A CG2 +2043 C CD1 . ILE A 129 ? 0.3209 0.7207 0.4518 -0.0146 -0.0043 -0.1786 128 ILE A CD1 +2055 N N . ASP A 130 ? 0.3306 0.6318 0.3834 -0.2309 0.0374 -0.1305 129 ASP A N +2056 C CA . ASP A 130 ? 0.3353 0.6555 0.3921 -0.2351 0.0420 -0.1363 129 ASP A CA +2057 C C . ASP A 130 ? 0.3394 0.6516 0.3841 -0.2398 0.0481 -0.1322 129 ASP A C +2058 O O . ASP A 130 ? 0.3370 0.6632 0.3853 -0.2385 0.0504 -0.1355 129 ASP A O +2059 C CB . ASP A 130 ? 0.3218 0.6614 0.3939 -0.2235 0.0372 -0.1415 129 ASP A CB +2060 C CG . ASP A 130 ? 0.3246 0.6786 0.4094 -0.2230 0.0332 -0.1484 129 ASP A CG +2061 O OD1 . ASP A 130 ? 0.3954 0.7563 0.4804 -0.2340 0.0366 -0.1527 129 ASP A OD1 +2062 O OD2 . ASP A 130 ? 0.3263 0.6844 0.4212 -0.2117 0.0263 -0.1493 129 ASP A OD2 +2067 N N . PHE A 131 ? 0.3472 0.6370 0.3774 -0.2456 0.0508 -0.1256 130 PHE A N +2068 C CA . PHE A 131 ? 0.3566 0.6376 0.3728 -0.2529 0.0574 -0.1224 130 PHE A CA +2069 C C . PHE A 131 ? 0.3786 0.6677 0.3894 -0.2685 0.0644 -0.1268 130 PHE A C +2070 O O . PHE A 131 ? 0.3896 0.6804 0.4023 -0.2758 0.0647 -0.1294 130 PHE A O +2071 C CB . PHE A 131 ? 0.3589 0.6127 0.3596 -0.2535 0.0579 -0.1143 130 PHE A CB +2072 C CG . PHE A 131 ? 0.3385 0.5845 0.3419 -0.2394 0.0526 -0.1092 130 PHE A CG +2073 C CD1 . PHE A 131 ? 0.3327 0.5772 0.3313 -0.2359 0.0545 -0.1065 130 PHE A CD1 +2074 C CD2 . PHE A 131 ? 0.3254 0.5659 0.3366 -0.2295 0.0454 -0.1069 130 PHE A CD2 +2075 C CE1 . PHE A 131 ? 0.3141 0.5515 0.3157 -0.2230 0.0494 -0.1017 130 PHE A CE1 +2076 C CE2 . PHE A 131 ? 0.3074 0.5409 0.3212 -0.2168 0.0403 -0.1020 130 PHE A CE2 +2077 C CZ . PHE A 131 ? 0.3011 0.5332 0.3108 -0.2133 0.0423 -0.0992 130 PHE A CZ +2087 N N . LYS A 132 ? 0.3851 0.6789 0.3892 -0.2736 0.0698 -0.1274 131 LYS A N +2088 C CA . LYS A 132 ? 0.4064 0.7077 0.4047 -0.2884 0.0766 -0.1309 131 LYS A CA +2089 C C . LYS A 132 ? 0.4247 0.7010 0.4041 -0.2990 0.0808 -0.1247 131 LYS A C +2090 O O . LYS A 132 ? 0.4222 0.6791 0.3902 -0.2958 0.0809 -0.1181 131 LYS A O +2091 C CB . LYS A 132 ? 0.4057 0.7236 0.4056 -0.2888 0.0800 -0.1342 131 LYS A CB +2092 C CG . LYS A 132 ? 0.3863 0.7260 0.4043 -0.2759 0.0750 -0.1397 131 LYS A CG +2093 C CD . LYS A 132 ? 0.3877 0.7482 0.4092 -0.2773 0.0784 -0.1451 131 LYS A CD +2094 C CE . LYS A 132 ? 0.3685 0.7479 0.4078 -0.2630 0.0726 -0.1503 131 LYS A CE +2103 N N . GLU A 133 ? 0.4450 0.7215 0.4217 -0.3111 0.0838 -0.1268 132 GLU A N +2104 C CA . GLU A 133 ? 0.4784 0.7308 0.4381 -0.3212 0.0870 -0.1214 132 GLU A CA +2105 C C . GLU A 133 ? 0.4884 0.7300 0.4333 -0.3273 0.0924 -0.1171 132 GLU A C +2106 O O . GLU A 133 ? 0.5740 0.7902 0.5036 -0.3304 0.0937 -0.1105 132 GLU A O +2107 C CB . GLU A 133 ? 0.4825 0.7411 0.4442 -0.3335 0.0892 -0.1253 132 GLU A CB +2110 N N . ASP A 134 ? 0.5031 0.7640 0.4530 -0.3285 0.0951 -0.1208 133 ASP A N +2111 C CA . ASP A 134 ? 0.5756 0.8292 0.5134 -0.3338 0.0998 -0.1171 133 ASP A CA +2112 C C . ASP A 134 ? 0.5379 0.7926 0.4778 -0.3216 0.0975 -0.1152 133 ASP A C +2113 O O . ASP A 134 ? 0.5959 0.8481 0.5284 -0.3240 0.1007 -0.1127 133 ASP A O +2114 C CB . ASP A 134 ? 0.6401 0.9146 0.5809 -0.3455 0.1051 -0.1225 133 ASP A CB +2115 C CG . ASP A 134 ? 0.6756 0.9821 0.6349 -0.3397 0.1034 -0.1312 133 ASP A CG +2116 O OD1 . ASP A 134 ? 0.6823 0.9969 0.6541 -0.3321 0.0985 -0.1348 133 ASP A OD1 +2117 O OD2 . ASP A 134 ? 0.7917 1.1151 0.7534 -0.3425 0.1066 -0.1345 133 ASP A OD2 +2122 N N . GLY A 135 ? 0.4426 0.7010 0.3929 -0.3083 0.0916 -0.1160 134 GLY A N +2123 C CA . GLY A 135 ? 0.4234 0.6836 0.3772 -0.2961 0.0886 -0.1142 134 GLY A CA +2124 C C . GLY A 135 ? 0.4249 0.6569 0.3635 -0.2939 0.0889 -0.1053 134 GLY A C +2125 O O . GLY A 135 ? 0.4413 0.6518 0.3664 -0.3014 0.0913 -0.1006 134 GLY A O +2129 N N . ASN A 136 ? 0.4083 0.6399 0.3492 -0.2832 0.0862 -0.1029 135 ASN A N +2130 C CA . ASN A 136 ? 0.4088 0.6142 0.3364 -0.2801 0.0861 -0.0944 135 ASN A CA +2131 C C . ASN A 136 ? 0.4032 0.5871 0.3266 -0.2744 0.0822 -0.0894 135 ASN A C +2132 O O . ASN A 136 ? 0.4094 0.5680 0.3196 -0.2741 0.0828 -0.0824 135 ASN A O +2133 C CB . ASN A 136 ? 0.3916 0.6034 0.3243 -0.2698 0.0839 -0.0932 135 ASN A CB +2134 C CG . ASN A 136 ? 0.3997 0.6275 0.3328 -0.2757 0.0883 -0.0965 135 ASN A CG +2135 O OD1 . ASN A 136 ? 0.4209 0.6465 0.3456 -0.2881 0.0936 -0.0967 135 ASN A OD1 +2136 N ND2 . ASN A 136 ? 0.3831 0.6269 0.3260 -0.2667 0.0858 -0.0990 135 ASN A ND2 +2143 N N . ILE A 137 ? 0.3918 0.5856 0.3268 -0.2693 0.0780 -0.0929 136 ILE A N +2144 C CA . ILE A 137 ? 0.3858 0.5608 0.3177 -0.2635 0.0740 -0.0883 136 ILE A CA +2145 C C . ILE A 137 ? 0.4065 0.5684 0.3286 -0.2745 0.0768 -0.0879 136 ILE A C +2146 O O . ILE A 137 ? 0.4184 0.5555 0.3255 -0.2775 0.0784 -0.0822 136 ILE A O +2147 C CB . ILE A 137 ? 0.3635 0.5524 0.3123 -0.2517 0.0674 -0.0909 136 ILE A CB +2148 C CG1 . ILE A 137 ? 0.3423 0.5373 0.2987 -0.2391 0.0636 -0.0890 136 ILE A CG1 +2149 C CG2 . ILE A 137 ? 0.3604 0.5309 0.3058 -0.2477 0.0636 -0.0866 136 ILE A CG2 +2150 C CD1 . ILE A 137 ? 0.3402 0.5567 0.3035 -0.2396 0.0657 -0.0940 136 ILE A CD1 +2162 N N . LEU A 138 ? 0.4747 0.6527 0.4054 -0.2803 0.0771 -0.0940 137 LEU A N +2163 C CA . LEU A 138 ? 0.4933 0.6599 0.4158 -0.2908 0.0794 -0.0939 137 LEU A CA +2164 C C . LEU A 138 ? 0.4684 0.6232 0.3758 -0.3030 0.0856 -0.0915 137 LEU A C +2165 O O . LEU A 138 ? 0.4724 0.6079 0.3679 -0.3098 0.0872 -0.0884 137 LEU A O +2166 C CB . LEU A 138 ? 0.4536 0.6413 0.3897 -0.2946 0.0783 -0.1011 137 LEU A CB +2167 C CG . LEU A 138 ? 0.4128 0.6089 0.3637 -0.2835 0.0714 -0.1031 137 LEU A CG +2168 C CD1 . LEU A 138 ? 0.5073 0.7230 0.4708 -0.2884 0.0707 -0.1102 137 LEU A CD1 +2169 C CD2 . LEU A 138 ? 0.4226 0.5952 0.3657 -0.2788 0.0681 -0.0974 137 LEU A CD2 +2181 N N . GLY A 139 ? 0.4567 0.6224 0.3646 -0.3051 0.0887 -0.0926 138 GLY A N +2182 C CA . GLY A 139 ? 0.4785 0.6334 0.3728 -0.3157 0.0942 -0.0897 138 GLY A CA +2183 C C . GLY A 139 ? 0.4808 0.6093 0.3611 -0.3115 0.0944 -0.0815 138 GLY A C +2184 O O . GLY A 139 ? 0.4991 0.6162 0.3679 -0.3192 0.0986 -0.0782 138 GLY A O +2188 N N . HIS A 140 ? 0.4627 0.5815 0.3444 -0.2991 0.0898 -0.0782 139 HIS A N +2189 C CA . HIS A 140 ? 0.4630 0.5558 0.3326 -0.2932 0.0893 -0.0704 139 HIS A CA +2190 C C . HIS A 140 ? 0.4689 0.5611 0.3336 -0.2951 0.0926 -0.0678 139 HIS A C +2191 O O . HIS A 140 ? 0.4864 0.5585 0.3377 -0.2998 0.0955 -0.0627 139 HIS A O +2192 C CB . HIS A 140 ? 0.4816 0.5478 0.3367 -0.2982 0.0902 -0.0660 139 HIS A CB +2193 C CG . HIS A 140 ? 0.4755 0.5378 0.3336 -0.2948 0.0865 -0.0672 139 HIS A CG +2194 N ND1 . HIS A 140 ? 0.4604 0.5102 0.3182 -0.2832 0.0821 -0.0634 139 HIS A ND1 +2195 C CD2 . HIS A 140 ? 0.4828 0.5522 0.3445 -0.3015 0.0865 -0.0714 139 HIS A CD2 +2196 C CE1 . HIS A 140 ? 0.4588 0.5084 0.3196 -0.2830 0.0796 -0.0654 139 HIS A CE1 +2197 N NE2 . HIS A 140 ? 0.4722 0.5332 0.3356 -0.2939 0.0821 -0.0702 139 HIS A NE2 +2206 N N . LYS A 141 ? 0.4541 0.5685 0.3302 -0.2908 0.0920 -0.0714 140 LYS A N +2207 C CA . LYS A 141 ? 0.4589 0.5763 0.3321 -0.2927 0.0952 -0.0697 140 LYS A CA +2208 C C . LYS A 141 ? 0.4401 0.5514 0.3153 -0.2797 0.0918 -0.0653 140 LYS A C +2209 O O . LYS A 141 ? 0.4406 0.5549 0.3149 -0.2790 0.0937 -0.0636 140 LYS A O +2210 C CB . LYS A 141 ? 0.4592 0.6079 0.3434 -0.2988 0.0976 -0.0776 140 LYS A CB +2211 C CG . LYS A 141 ? 0.4757 0.6333 0.3604 -0.3109 0.1005 -0.0825 140 LYS A CG +2212 C CD . LYS A 141 ? 0.4769 0.6659 0.3727 -0.3168 0.1031 -0.0903 140 LYS A CD +2213 C CE . LYS A 141 ? 0.4928 0.6912 0.3903 -0.3286 0.1057 -0.0952 140 LYS A CE +2214 N NZ . LYS A 141 ? 0.5017 0.7319 0.4107 -0.3337 0.1083 -0.1032 140 LYS A NZ +2228 N N . LEU A 142 ? 0.4239 0.5265 0.3020 -0.2693 0.0868 -0.0632 141 LEU A N +2229 C CA . LEU A 142 ? 0.4057 0.5020 0.2863 -0.2568 0.0832 -0.0586 141 LEU A CA +2230 C C . LEU A 142 ? 0.4160 0.4812 0.2820 -0.2545 0.0841 -0.0499 141 LEU A C +2231 O O . LEU A 142 ? 0.4290 0.4750 0.2851 -0.2577 0.0847 -0.0474 141 LEU A O +2232 C CB . LEU A 142 ? 0.3835 0.4847 0.2743 -0.2462 0.0772 -0.0595 141 LEU A CB +2233 C CG . LEU A 142 ? 0.3712 0.5024 0.2783 -0.2456 0.0752 -0.0678 141 LEU A CG +2234 C CD1 . LEU A 142 ? 0.3834 0.5166 0.3004 -0.2329 0.0687 -0.0667 141 LEU A CD1 +2235 C CD2 . LEU A 142 ? 0.4435 0.5990 0.3589 -0.2469 0.0770 -0.0727 141 LEU A CD2 +2247 N N . GLU A 143 ? 0.4102 0.4703 0.2753 -0.2482 0.0840 -0.0455 142 GLU A N +2248 C CA . GLU A 143 ? 0.4173 0.4483 0.2705 -0.2433 0.0841 -0.0371 142 GLU A CA +2249 C C . GLU A 143 ? 0.4037 0.4196 0.2572 -0.2324 0.0790 -0.0335 142 GLU A C +2250 O O . GLU A 143 ? 0.3839 0.4132 0.2485 -0.2260 0.0750 -0.0360 142 GLU A O +2251 C CB . GLU A 143 ? 0.4123 0.4435 0.2664 -0.2379 0.0848 -0.0332 142 GLU A CB +2252 C CG . GLU A 143 ? 0.4276 0.4722 0.2800 -0.2487 0.0902 -0.0359 142 GLU A CG +2253 C CD . GLU A 143 ? 0.4261 0.4678 0.2771 -0.2439 0.0916 -0.0311 142 GLU A CD +2254 O OE1 . GLU A 143 ? 0.4086 0.4455 0.2640 -0.2317 0.0880 -0.0273 142 GLU A OE1 +2255 O OE2 . GLU A 143 ? 0.4809 0.5254 0.3265 -0.2525 0.0963 -0.0310 142 GLU A OE2 +2262 N N . TYR A 144 ? 0.4144 0.4035 0.2563 -0.2299 0.0791 -0.0275 143 TYR A N +2263 C CA . TYR A 144 ? 0.4033 0.3766 0.2445 -0.2191 0.0746 -0.0236 143 TYR A CA +2264 C C . TYR A 144 ? 0.4501 0.4172 0.2950 -0.2060 0.0718 -0.0179 143 TYR A C +2265 O O . TYR A 144 ? 0.3930 0.3393 0.2301 -0.2003 0.0718 -0.0120 143 TYR A O +2266 C CB . TYR A 144 ? 0.4219 0.3707 0.2498 -0.2216 0.0758 -0.0206 143 TYR A CB +2267 C CG . TYR A 144 ? 0.4115 0.3469 0.2390 -0.2115 0.0714 -0.0179 143 TYR A CG +2268 C CD1 . TYR A 144 ? 0.4037 0.3481 0.2364 -0.2124 0.0690 -0.0219 143 TYR A CD1 +2269 C CD2 . TYR A 144 ? 0.4140 0.3276 0.2328 -0.2034 0.0701 -0.0126 143 TYR A CD2 +2270 C CE1 . TYR A 144 ? 0.3951 0.3277 0.2271 -0.2037 0.0652 -0.0194 143 TYR A CE1 +2271 C CE2 . TYR A 144 ? 0.4061 0.3082 0.2236 -0.1948 0.0663 -0.0108 143 TYR A CE2 +2272 C CZ . TYR A 144 ? 0.3959 0.3079 0.2207 -0.1948 0.0639 -0.0138 143 TYR A CZ +2273 O OH . TYR A 144 ? 0.3889 0.2899 0.2120 -0.1867 0.0603 -0.0119 143 TYR A OH +2283 N N . ASN A 145 ? 0.3671 0.3535 0.2245 -0.2012 0.0691 -0.0202 144 ASN A N +2284 C CA . ASN A 145 ? 0.3495 0.3331 0.2125 -0.1886 0.0659 -0.0152 144 ASN A CA +2285 C C . ASN A 145 ? 0.3273 0.3341 0.2047 -0.1847 0.0619 -0.0192 144 ASN A C +2286 O O . ASN A 145 ? 0.3256 0.3489 0.2085 -0.1906 0.0613 -0.0256 144 ASN A O +2287 C CB . ASN A 145 ? 0.3564 0.3380 0.2162 -0.1889 0.0692 -0.0121 144 ASN A CB +2288 C CG . ASN A 145 ? 0.3815 0.3853 0.2442 -0.2003 0.0732 -0.0183 144 ASN A CG +2289 O OD1 . ASN A 145 ? 0.3548 0.3819 0.2274 -0.2036 0.0721 -0.0249 144 ASN A OD1 +2290 N ND2 . ASN A 145 ? 0.3816 0.3793 0.2362 -0.2061 0.0778 -0.0163 144 ASN A ND2 +2297 N N . TYR A 146 ? 0.3255 0.3340 0.2097 -0.1741 0.0587 -0.0153 145 TYR A N +2298 C CA . TYR A 146 ? 0.3509 0.3782 0.2488 -0.1681 0.0535 -0.0177 145 TYR A CA +2299 C C . TYR A 146 ? 0.3412 0.3758 0.2464 -0.1599 0.0517 -0.0148 145 TYR A C +2300 O O . TYR A 146 ? 0.3021 0.3187 0.2019 -0.1529 0.0521 -0.0077 145 TYR A O +2301 C CB . TYR A 146 ? 0.2849 0.3009 0.1836 -0.1609 0.0487 -0.0148 145 TYR A CB +2302 C CG . TYR A 146 ? 0.2628 0.3020 0.1743 -0.1611 0.0447 -0.0205 145 TYR A CG +2303 C CD1 . TYR A 146 ? 0.3157 0.3654 0.2276 -0.1702 0.0465 -0.0271 145 TYR A CD1 +2304 C CD2 . TYR A 146 ? 0.2399 0.2916 0.1641 -0.1515 0.0389 -0.0193 145 TYR A CD2 +2305 C CE1 . TYR A 146 ? 0.2583 0.3298 0.1836 -0.1685 0.0426 -0.0322 145 TYR A CE1 +2306 C CE2 . TYR A 146 ? 0.2264 0.3001 0.1641 -0.1500 0.0347 -0.0244 145 TYR A CE2 +2307 C CZ . TYR A 146 ? 0.2356 0.3188 0.1742 -0.1578 0.0366 -0.0309 145 TYR A CZ +2308 O OH . TYR A 146 ? 0.2631 0.3671 0.2170 -0.1541 0.0320 -0.0357 145 TYR A OH +2318 N N . ASN A 147 ? 0.2717 0.3338 0.1900 -0.1597 0.0492 -0.0205 146 ASN A N +2319 C CA . ASN A 147 ? 0.2437 0.3179 0.1702 -0.1529 0.0474 -0.0192 146 ASN A CA +2320 C C . ASN A 147 ? 0.2619 0.3370 0.1977 -0.1408 0.0402 -0.0152 146 ASN A C +2321 O O . ASN A 147 ? 0.2973 0.3608 0.2320 -0.1377 0.0372 -0.0126 146 ASN A O +2322 C CB . ASN A 147 ? 0.3115 0.4172 0.2475 -0.1588 0.0487 -0.0285 146 ASN A CB +2323 C CG . ASN A 147 ? 0.4950 0.5991 0.4221 -0.1679 0.0556 -0.0296 146 ASN A CG +2324 O OD1 . ASN A 147 ? 0.5262 0.6159 0.4466 -0.1649 0.0578 -0.0233 146 ASN A OD1 +2325 N ND2 . ASN A 147 ? 0.4619 0.5798 0.3888 -0.1788 0.0591 -0.0371 146 ASN A ND2 +2332 N N . HIS A 148 ? 0.2055 0.2950 0.1508 -0.1340 0.0374 -0.0146 147 HIS A N +2333 C CA . HIS A 148 ? 0.1834 0.2748 0.1383 -0.1222 0.0301 -0.0101 147 HIS A CA +2334 C C . HIS A 148 ? 0.2296 0.3550 0.2032 -0.1183 0.0248 -0.0180 147 HIS A C +2335 O O . HIS A 148 ? 0.1682 0.3133 0.1462 -0.1210 0.0272 -0.0244 147 HIS A O +2336 C CB . HIS A 148 ? 0.1798 0.2570 0.1306 -0.1142 0.0303 -0.0016 147 HIS A CB +2337 C CG . HIS A 148 ? 0.2580 0.3466 0.2081 -0.1173 0.0348 -0.0043 147 HIS A CG +2338 N ND1 . HIS A 148 ? 0.3042 0.4196 0.2673 -0.1124 0.0313 -0.0079 147 HIS A ND1 +2339 C CD2 . HIS A 148 ? 0.3208 0.3992 0.2595 -0.1244 0.0419 -0.0044 147 HIS A CD2 +2340 C CE1 . HIS A 148 ? 0.3181 0.4386 0.2769 -0.1167 0.0368 -0.0101 147 HIS A CE1 +2341 N NE2 . HIS A 148 ? 0.2966 0.3944 0.2405 -0.1243 0.0432 -0.0076 147 HIS A NE2 +2350 N N . HIS A 149 ? 0.1626 0.2363 0.1646 -0.0423 -0.0347 -0.0115 148 HIS A N +2351 C CA . HIS A 149 ? 0.1611 0.2314 0.1513 -0.0373 -0.0311 -0.0334 148 HIS A CA +2352 C C . HIS A 149 ? 0.1891 0.2533 0.1772 -0.0356 -0.0403 -0.0330 148 HIS A C +2353 O O . HIS A 149 ? 0.1614 0.2271 0.1620 -0.0383 -0.0498 -0.0151 148 HIS A O +2354 C CB . HIS A 149 ? 0.1450 0.2186 0.1492 -0.0265 -0.0213 -0.0437 148 HIS A CB +2355 C CG . HIS A 149 ? 0.1573 0.2351 0.1622 -0.0310 -0.0129 -0.0447 148 HIS A CG +2356 N ND1 . HIS A 149 ? 0.1512 0.2226 0.1646 -0.0295 -0.0069 -0.0374 148 HIS A ND1 +2357 C CD2 . HIS A 149 ? 0.1856 0.2691 0.1814 -0.0381 -0.0069 -0.0511 148 HIS A CD2 +2358 C CE1 . HIS A 149 ? 0.1517 0.2264 0.1617 -0.0364 -0.0005 -0.0399 148 HIS A CE1 +2359 N NE2 . HIS A 149 ? 0.1569 0.2415 0.1588 -0.0414 -0.0006 -0.0476 148 HIS A NE2 +2368 N N . LYS A 150 ? 0.1684 0.2259 0.1443 -0.0316 -0.0364 -0.0504 149 LYS A N +2369 C CA . LYS A 150 ? 0.1731 0.2205 0.1444 -0.0292 -0.0427 -0.0529 149 LYS A CA +2370 C C . LYS A 150 ? 0.1585 0.2088 0.1452 -0.0133 -0.0361 -0.0640 149 LYS A C +2371 O O . LYS A 150 ? 0.1931 0.2475 0.1819 -0.0081 -0.0272 -0.0756 149 LYS A O +2372 C CB . LYS A 150 ? 0.2175 0.2440 0.1519 -0.0413 -0.0428 -0.0620 149 LYS A CB +2373 C CG . LYS A 150 ? 0.3337 0.3514 0.2456 -0.0627 -0.0585 -0.0471 149 LYS A CG +2374 C CD . LYS A 150 ? 0.3942 0.3782 0.2546 -0.0786 -0.0560 -0.0579 149 LYS A CD +2375 C CE . LYS A 150 ? 0.3455 0.3102 0.1973 -0.0771 -0.0586 -0.0621 149 LYS A CE +2376 N NZ . LYS A 150 ? 0.3921 0.3220 0.1975 -0.0956 -0.0578 -0.0615 149 LYS A NZ +2390 N N . VAL A 151 ? 0.1651 0.2138 0.1648 -0.0065 -0.0406 -0.0574 150 VAL A N +2391 C CA . VAL A 151 ? 0.1726 0.2201 0.1811 0.0052 -0.0384 -0.0638 150 VAL A CA +2392 C C . VAL A 151 ? 0.1590 0.1954 0.1623 0.0099 -0.0421 -0.0686 150 VAL A C +2393 O O . VAL A 151 ? 0.1759 0.2042 0.1780 0.0076 -0.0472 -0.0606 150 VAL A O +2394 C CB . VAL A 151 ? 0.1285 0.1707 0.1449 0.0079 -0.0362 -0.0533 150 VAL A CB +2395 C CG1 . VAL A 151 ? 0.1312 0.1628 0.1438 0.0151 -0.0363 -0.0581 150 VAL A CG1 +2396 C CG2 . VAL A 151 ? 0.1776 0.2240 0.1966 0.0034 -0.0295 -0.0490 150 VAL A CG2 +2406 N N . TYR A 152 ? 0.1499 0.1862 0.1541 0.0167 -0.0380 -0.0792 151 TYR A N +2407 C CA . TYR A 152 ? 0.1642 0.1849 0.1617 0.0216 -0.0380 -0.0839 151 TYR A CA +2408 C C . TYR A 152 ? 0.1564 0.1753 0.1647 0.0316 -0.0438 -0.0804 151 TYR A C +2409 O O . TYR A 152 ? 0.1613 0.1914 0.1822 0.0364 -0.0461 -0.0793 151 TYR A O +2410 C CB . TYR A 152 ? 0.1819 0.1992 0.1792 0.0267 -0.0250 -0.0943 151 TYR A CB +2411 C CG . TYR A 152 ? 0.2050 0.2107 0.1762 0.0137 -0.0170 -0.0992 151 TYR A CG +2412 C CD1 . TYR A 152 ? 0.2550 0.2328 0.1923 0.0013 -0.0193 -0.1012 151 TYR A CD1 +2413 C CD2 . TYR A 152 ? 0.2380 0.2574 0.2133 0.0104 -0.0091 -0.1006 151 TYR A CD2 +2414 C CE1 . TYR A 152 ? 0.3151 0.2752 0.2168 -0.0158 -0.0151 -0.1045 151 TYR A CE1 +2415 C CE2 . TYR A 152 ? 0.2995 0.3028 0.2428 -0.0037 -0.0016 -0.1045 151 TYR A CE2 +2416 C CZ . TYR A 152 ? 0.3358 0.3077 0.2392 -0.0177 -0.0055 -0.1064 151 TYR A CZ +2417 O OH . TYR A 152 ? 0.4327 0.3816 0.2927 -0.0371 -0.0015 -0.1089 151 TYR A OH +2427 N N . ILE A 153 ? 0.1805 0.1835 0.1807 0.0316 -0.0477 -0.0773 152 ILE A N +2428 C CA . ILE A 153 ? 0.1626 0.1581 0.1661 0.0392 -0.0523 -0.0730 152 ILE A CA +2429 C C . ILE A 153 ? 0.2100 0.1893 0.2100 0.0458 -0.0520 -0.0765 152 ILE A C +2430 O O . ILE A 153 ? 0.2071 0.1718 0.1939 0.0394 -0.0499 -0.0794 152 ILE A O +2431 C CB . ILE A 153 ? 0.2124 0.2009 0.2129 0.0341 -0.0532 -0.0625 152 ILE A CB +2432 C CG1 . ILE A 153 ? 0.1548 0.1531 0.1594 0.0299 -0.0488 -0.0576 152 ILE A CG1 +2433 C CG2 . ILE A 153 ? 0.1937 0.1662 0.1889 0.0403 -0.0546 -0.0587 152 ILE A CG2 +2434 C CD1 . ILE A 153 ? 0.1610 0.1542 0.1731 0.0267 -0.0429 -0.0432 152 ILE A CD1 +2446 N N . THR A 154 ? 0.1826 0.1614 0.1919 0.0564 -0.0554 -0.0747 153 THR A N +2447 C CA . THR A 154 ? 0.2005 0.1614 0.2092 0.0648 -0.0546 -0.0749 153 THR A CA +2448 C C . THR A 154 ? 0.2533 0.2087 0.2609 0.0690 -0.0648 -0.0657 153 THR A C +2449 O O . THR A 154 ? 0.2235 0.1881 0.2299 0.0656 -0.0720 -0.0609 153 THR A O +2450 C CB . THR A 154 ? 0.2277 0.1923 0.2549 0.0763 -0.0450 -0.0790 153 THR A CB +2451 O OG1 . THR A 154 ? 0.2646 0.2037 0.2879 0.0846 -0.0389 -0.0800 153 THR A OG1 +2452 C CG2 . THR A 154 ? 0.2016 0.1929 0.2587 0.0836 -0.0531 -0.0701 153 THR A CG2 +2460 N N . ALA A 155 ? 0.2406 0.1752 0.2417 0.0737 -0.0652 -0.0634 154 ALA A N +2461 C CA . ALA A 155 ? 0.2744 0.1979 0.2680 0.0765 -0.0746 -0.0538 154 ALA A CA +2462 C C . ALA A 155 ? 0.2365 0.1733 0.2496 0.0850 -0.0849 -0.0461 154 ALA A C +2463 O O . ALA A 155 ? 0.2360 0.1861 0.2768 0.0948 -0.0798 -0.0469 154 ALA A O +2464 C CB . ALA A 155 ? 0.2840 0.1813 0.2668 0.0788 -0.0717 -0.0522 154 ALA A CB +2470 N N . ASP A 156 ? 0.2493 0.1793 0.2468 0.0799 -0.0986 -0.0364 155 ASP A N +2471 C CA . ASP A 156 ? 0.2721 0.2114 0.2849 0.0837 -0.1164 -0.0221 155 ASP A CA +2472 C C . ASP A 156 ? 0.2934 0.2022 0.2768 0.0816 -0.1249 -0.0130 155 ASP A C +2473 O O . ASP A 156 ? 0.3188 0.2120 0.2680 0.0682 -0.1367 -0.0068 155 ASP A O +2474 C CB . ASP A 156 ? 0.2837 0.2393 0.2918 0.0703 -0.1300 -0.0179 155 ASP A CB +2475 C CG . ASP A 156 ? 0.3717 0.3491 0.4089 0.0708 -0.1532 0.0012 155 ASP A CG +2476 O OD1 . ASP A 156 ? 0.3901 0.3698 0.4528 0.0832 -0.1571 0.0136 155 ASP A OD1 +2477 O OD2 . ASP A 156 ? 0.3508 0.3434 0.3868 0.0566 -0.1666 0.0060 155 ASP A OD2 +2482 N N . LYS A 157 ? 0.3006 0.1945 0.2910 0.0928 -0.1174 -0.0124 156 LYS A N +2483 C CA . LYS A 157 ? 0.3272 0.1884 0.2872 0.0905 -0.1204 -0.0059 156 LYS A CA +2484 C C . LYS A 157 ? 0.3594 0.2137 0.3056 0.0853 -0.1444 0.0129 156 LYS A C +2485 O O . LYS A 157 ? 0.3881 0.2111 0.2898 0.0746 -0.1476 0.0167 156 LYS A O +2486 C CB . LYS A 157 ? 0.3337 0.1787 0.3053 0.1027 -0.1088 -0.0078 156 LYS A CB +2487 C CG . LYS A 157 ? 0.3400 0.1991 0.3505 0.1163 -0.1072 0.0005 156 LYS A CG +2488 C CD . LYS A 157 ? 0.3549 0.1911 0.3657 0.1221 -0.0879 -0.0038 156 LYS A CD +2489 C CE . LYS A 157 ? 0.4352 0.2787 0.4840 0.1378 -0.0810 0.0091 156 LYS A CE +2490 N NZ . LYS A 157 ? 0.4182 0.2337 0.4676 0.1446 -0.0565 0.0032 156 LYS A NZ +2504 N N . GLN A 158 ? 0.3596 0.2424 0.3435 0.0903 -0.1594 0.0264 157 GLN A N +2505 C CA . GLN A 158 ? 0.3942 0.2764 0.3711 0.0804 -0.1804 0.0477 157 GLN A CA +2506 C C . GLN A 158 ? 0.4175 0.2880 0.3471 0.0553 -0.1962 0.0489 157 GLN A C +2507 O O . GLN A 158 ? 0.4597 0.3142 0.3597 0.0394 -0.2124 0.0626 157 GLN A O +2508 C CB . GLN A 158 ? 0.3899 0.3125 0.4301 0.0916 -0.1837 0.0652 157 GLN A CB +2509 C CG . GLN A 158 ? 0.4585 0.3765 0.5087 0.0961 -0.1933 0.0876 157 GLN A CG +2510 C CD . GLN A 158 ? 0.5183 0.4040 0.5579 0.1098 -0.1762 0.0825 157 GLN A CD +2511 O OE1 . GLN A 158 ? 0.4106 0.2842 0.4508 0.1194 -0.1535 0.0635 157 GLN A OE1 +2512 N NE2 . GLN A 158 ? 0.4682 0.3383 0.4949 0.1077 -0.1876 0.0997 157 GLN A NE2 +2521 N N . LYS A 159 ? 0.3969 0.2702 0.3146 0.0502 -0.1886 0.0335 158 LYS A N +2522 C CA . LYS A 159 ? 0.4999 0.3524 0.3655 0.0256 -0.1939 0.0302 158 LYS A CA +2523 C C . LYS A 159 ? 0.4315 0.2429 0.2465 0.0231 -0.1709 0.0142 158 LYS A C +2524 O O . LYS A 159 ? 0.4591 0.2424 0.2251 0.0055 -0.1653 0.0083 158 LYS A O +2525 C CB . LYS A 159 ? 0.4009 0.2891 0.2948 0.0190 -0.1959 0.0268 158 LYS A CB +2526 C CG . LYS A 159 ? 0.5375 0.4597 0.4677 0.0110 -0.2161 0.0469 158 LYS A CG +2527 C CD . LYS A 159 ? 0.5802 0.5324 0.5313 0.0012 -0.2178 0.0451 158 LYS A CD +2528 C CE . LYS A 159 ? 0.5568 0.5478 0.5555 -0.0028 -0.2368 0.0678 158 LYS A CE +2539 N N . ASN A 160 ? 0.4088 0.2179 0.2419 0.0392 -0.1507 0.0076 159 ASN A N +2540 C CA . ASN A 160 ? 0.4093 0.1908 0.2160 0.0379 -0.1227 -0.0032 159 ASN A CA +2541 C C . ASN A 160 ? 0.3855 0.1785 0.1967 0.0337 -0.1065 -0.0151 159 ASN A C +2542 O O . ASN A 160 ? 0.4065 0.1698 0.1845 0.0263 -0.0864 -0.0189 159 ASN A O +2543 C CB . ASN A 160 ? 0.5330 0.2611 0.2748 0.0244 -0.1193 0.0027 159 ASN A CB +2544 C CG . ASN A 160 ? 0.4681 0.1720 0.2022 0.0301 -0.0896 -0.0011 159 ASN A CG +2545 O OD1 . ASN A 160 ? 0.4621 0.1852 0.2361 0.0432 -0.0836 -0.0023 159 ASN A OD1 +2546 N ND2 . ASN A 160 ? 0.5670 0.2246 0.2479 0.0187 -0.0695 -0.0016 159 ASN A ND2 +2553 N N . GLY A 161 ? 0.3623 0.1961 0.2162 0.0397 -0.1124 -0.0194 160 GLY A N +2554 C CA . GLY A 161 ? 0.3551 0.2017 0.2145 0.0352 -0.1007 -0.0285 160 GLY A CA +2555 C C . GLY A 161 ? 0.2819 0.1675 0.1905 0.0464 -0.0969 -0.0349 160 GLY A C +2556 O O . GLY A 161 ? 0.3310 0.2229 0.2613 0.0571 -0.0942 -0.0355 160 GLY A O +2560 N N . ILE A 162 ? 0.2769 0.1825 0.1964 0.0419 -0.0957 -0.0399 161 ILE A N +2561 C CA . ILE A 162 ? 0.2745 0.2111 0.2307 0.0492 -0.0895 -0.0467 161 ILE A CA +2562 C C . ILE A 162 ? 0.2483 0.2118 0.2234 0.0457 -0.0993 -0.0464 161 ILE A C +2563 O O . ILE A 162 ? 0.2759 0.2339 0.2327 0.0337 -0.1109 -0.0418 161 ILE A O +2564 C CB . ILE A 162 ? 0.2151 0.1501 0.1697 0.0462 -0.0722 -0.0517 161 ILE A CB +2565 C CG1 . ILE A 162 ? 0.2301 0.1517 0.1613 0.0359 -0.0658 -0.0512 161 ILE A CG1 +2566 C CG2 . ILE A 162 ? 0.2422 0.1601 0.1928 0.0491 -0.0635 -0.0485 161 ILE A CG2 +2567 C CD1 . ILE A 162 ? 0.2331 0.1574 0.1733 0.0351 -0.0487 -0.0510 161 ILE A CD1 +2579 N N . LYS A 163 ? 0.2021 0.1905 0.2105 0.0542 -0.0937 -0.0507 162 LYS A N +2580 C CA . LYS A 163 ? 0.1908 0.2079 0.2249 0.0525 -0.0959 -0.0508 162 LYS A CA +2581 C C . LYS A 163 ? 0.1727 0.1951 0.2069 0.0511 -0.0795 -0.0613 162 LYS A C +2582 O O . LYS A 163 ? 0.1696 0.1821 0.1992 0.0551 -0.0693 -0.0667 162 LYS A O +2583 C CB . LYS A 163 ? 0.1907 0.2293 0.2667 0.0654 -0.0985 -0.0439 162 LYS A CB +2584 C CG . LYS A 163 ? 0.2476 0.2950 0.3370 0.0630 -0.1222 -0.0260 162 LYS A CG +2585 C CD . LYS A 163 ? 0.3012 0.3770 0.4492 0.0789 -0.1216 -0.0133 162 LYS A CD +2586 C CE . LYS A 163 ? 0.4235 0.5145 0.5878 0.0704 -0.1458 0.0111 162 LYS A CE +2595 N N . VAL A 164 ? 0.1667 0.2029 0.2036 0.0426 -0.0794 -0.0625 163 VAL A N +2596 C CA . VAL A 164 ? 0.1762 0.2157 0.2090 0.0384 -0.0667 -0.0692 163 VAL A CA +2597 C C . VAL A 164 ? 0.1973 0.2631 0.2540 0.0365 -0.0643 -0.0704 163 VAL A C +2598 O O . VAL A 164 ? 0.1657 0.2457 0.2364 0.0322 -0.0754 -0.0640 163 VAL A O +2599 C CB . VAL A 164 ? 0.1605 0.1819 0.1671 0.0287 -0.0644 -0.0674 163 VAL A CB +2600 C CG1 . VAL A 164 ? 0.1565 0.1841 0.1648 0.0244 -0.0536 -0.0694 163 VAL A CG1 +2601 C CG2 . VAL A 164 ? 0.2132 0.2084 0.2011 0.0315 -0.0622 -0.0639 163 VAL A CG2 +2611 N N . ASN A 165 ? 0.1950 0.2661 0.2556 0.0377 -0.0509 -0.0768 164 ASN A N +2612 C CA . ASN A 165 ? 0.1513 0.2440 0.2321 0.0354 -0.0440 -0.0778 164 ASN A CA +2613 C C . ASN A 165 ? 0.1357 0.2231 0.1986 0.0281 -0.0328 -0.0835 164 ASN A C +2614 O O . ASN A 165 ? 0.1415 0.2116 0.1838 0.0269 -0.0295 -0.0864 164 ASN A O +2615 C CB . ASN A 165 ? 0.1438 0.2493 0.2570 0.0479 -0.0343 -0.0769 164 ASN A CB +2616 C CG . ASN A 165 ? 0.2147 0.2976 0.3108 0.0538 -0.0161 -0.0865 164 ASN A CG +2617 O OD1 . ASN A 165 ? 0.3104 0.3730 0.3930 0.0588 -0.0184 -0.0879 164 ASN A OD1 +2618 N ND2 . ASN A 165 ? 0.2329 0.3145 0.3251 0.0513 0.0025 -0.0930 164 ASN A ND2 +2625 N N . PHE A 166 ? 0.1690 0.2710 0.2395 0.0207 -0.0295 -0.0828 165 PHE A N +2626 C CA . PHE A 166 ? 0.1530 0.2511 0.2074 0.0128 -0.0197 -0.0858 165 PHE A CA +2627 C C . PHE A 166 ? 0.1858 0.3021 0.2549 0.0063 -0.0146 -0.0847 165 PHE A C +2628 O O . PHE A 166 ? 0.1468 0.2776 0.2352 0.0041 -0.0229 -0.0802 165 PHE A O +2629 C CB . PHE A 166 ? 0.1484 0.2315 0.1810 0.0064 -0.0252 -0.0810 165 PHE A CB +2630 C CG . PHE A 166 ? 0.1273 0.2062 0.1586 0.0033 -0.0313 -0.0759 165 PHE A CG +2631 C CD1 . PHE A 166 ? 0.1304 0.1984 0.1578 0.0073 -0.0388 -0.0743 165 PHE A CD1 +2632 C CD2 . PHE A 166 ? 0.1989 0.2776 0.2261 -0.0052 -0.0272 -0.0729 165 PHE A CD2 +2633 C CE1 . PHE A 166 ? 0.1855 0.2370 0.1979 0.0013 -0.0406 -0.0712 165 PHE A CE1 +2634 C CE2 . PHE A 166 ? 0.2089 0.2715 0.2247 -0.0098 -0.0279 -0.0699 165 PHE A CE2 +2635 C CZ . PHE A 166 ? 0.1557 0.2024 0.1608 -0.0076 -0.0340 -0.0698 165 PHE A CZ +2645 N N . LYS A 167 ? 0.1412 0.2548 0.1980 0.0003 -0.0025 -0.0874 166 LYS A N +2646 C CA . LYS A 167 ? 0.1415 0.2705 0.2103 -0.0071 0.0045 -0.0860 166 LYS A CA +2647 C C . LYS A 167 ? 0.2160 0.3337 0.2610 -0.0177 0.0019 -0.0821 166 LYS A C +2648 O O . LYS A 167 ? 0.2812 0.3837 0.3031 -0.0204 0.0016 -0.0805 166 LYS A O +2649 C CB . LYS A 167 ? 0.2054 0.3357 0.2765 -0.0056 0.0263 -0.0913 166 LYS A CB +2650 C CG . LYS A 167 ? 0.2852 0.4135 0.3722 0.0081 0.0380 -0.0952 166 LYS A CG +2655 N N . THR A 168 ? 0.1976 0.3218 0.2492 -0.0253 -0.0001 -0.0784 167 THR A N +2656 C CA . THR A 168 ? 0.1503 0.2628 0.1844 -0.0337 0.0022 -0.0728 167 THR A CA +2657 C C . THR A 168 ? 0.2197 0.3421 0.2569 -0.0423 0.0135 -0.0732 167 THR A C +2658 O O . THR A 168 ? 0.1754 0.3165 0.2355 -0.0428 0.0187 -0.0763 167 THR A O +2659 C CB . THR A 168 ? 0.1694 0.2684 0.1986 -0.0372 -0.0033 -0.0685 167 THR A CB +2660 O OG1 . THR A 168 ? 0.1565 0.2650 0.1972 -0.0445 -0.0077 -0.0711 167 THR A OG1 +2661 C CG2 . THR A 168 ? 0.1409 0.2253 0.1636 -0.0290 -0.0100 -0.0672 167 THR A CG2 +2669 N N . ARG A 169 ? 0.1790 0.2902 0.1972 -0.0491 0.0172 -0.0669 168 ARG A N +2670 C CA . ARG A 169 ? 0.2310 0.3455 0.2437 -0.0587 0.0288 -0.0659 168 ARG A CA +2671 C C . ARG A 169 ? 0.1799 0.2857 0.1890 -0.0661 0.0282 -0.0569 168 ARG A C +2672 O O . ARG A 169 ? 0.2166 0.3082 0.2154 -0.0652 0.0237 -0.0464 168 ARG A O +2673 C CB . ARG A 169 ? 0.2384 0.3397 0.2213 -0.0633 0.0329 -0.0644 168 ARG A CB +2674 C CG . ARG A 169 ? 0.3299 0.4267 0.3057 -0.0570 0.0374 -0.0745 168 ARG A CG +2675 C CD . ARG A 169 ? 0.3895 0.4612 0.3202 -0.0677 0.0392 -0.0739 168 ARG A CD +2676 N NE . ARG A 169 ? 0.5336 0.5966 0.4481 -0.0763 0.0197 -0.0583 168 ARG A NE +2677 C CZ . ARG A 169 ? 0.5125 0.5722 0.4284 -0.0736 0.0034 -0.0520 168 ARG A CZ +2678 N NH1 . ARG A 169 ? 0.4861 0.5458 0.4110 -0.0629 0.0038 -0.0626 168 ARG A NH1 +2679 N NH2 . ARG A 169 ? 0.4461 0.5035 0.3585 -0.0817 -0.0130 -0.0323 168 ARG A NH2 +2693 N N . HIS A 170 ? 0.2014 0.3150 0.2225 -0.0737 0.0334 -0.0588 169 HIS A N +2694 C CA . HIS A 170 ? 0.1933 0.2915 0.2072 -0.0822 0.0357 -0.0520 169 HIS A CA +2695 C C . HIS A 170 ? 0.2261 0.3278 0.2361 -0.0928 0.0470 -0.0486 169 HIS A C +2696 O O . HIS A 170 ? 0.2909 0.4111 0.3168 -0.0987 0.0534 -0.0537 169 HIS A O +2697 C CB . HIS A 170 ? 0.1960 0.2907 0.2169 -0.0885 0.0300 -0.0565 169 HIS A CB +2698 C CG . HIS A 170 ? 0.2275 0.3160 0.2472 -0.0802 0.0194 -0.0601 169 HIS A CG +2699 N ND1 . HIS A 170 ? 0.2390 0.2996 0.2417 -0.0738 0.0207 -0.0560 169 HIS A ND1 +2700 C CD2 . HIS A 170 ? 0.2521 0.3581 0.2876 -0.0764 0.0091 -0.0653 169 HIS A CD2 +2701 C CE1 . HIS A 170 ? 0.2464 0.3054 0.2488 -0.0678 0.0118 -0.0605 169 HIS A CE1 +2702 N NE2 . HIS A 170 ? 0.2446 0.3310 0.2659 -0.0695 0.0028 -0.0659 169 HIS A NE2 +2711 N N . ASN A 171 ? 0.2722 0.3572 0.2651 -0.0952 0.0498 -0.0370 170 ASN A N +2712 C CA . ASN A 171 ? 0.2804 0.3636 0.2635 -0.1063 0.0602 -0.0316 170 ASN A CA +2713 C C . ASN A 171 ? 0.3082 0.3925 0.3025 -0.1167 0.0668 -0.0349 170 ASN A C +2714 O O . ASN A 171 ? 0.2884 0.3569 0.2829 -0.1182 0.0638 -0.0347 170 ASN A O +2715 C CB . ASN A 171 ? 0.4080 0.4724 0.3757 -0.1071 0.0581 -0.0132 170 ASN A CB +2716 C CG . ASN A 171 ? 0.4144 0.4792 0.3654 -0.1060 0.0484 -0.0059 170 ASN A CG +2717 O OD1 . ASN A 171 ? 0.3684 0.4413 0.3166 -0.1019 0.0446 -0.0170 170 ASN A OD1 +2718 N ND2 . ASN A 171 ? 0.4742 0.5283 0.4128 -0.1117 0.0431 0.0146 170 ASN A ND2 +2725 N N . ILE A 172 ? 0.3872 0.4811 0.2312 -0.1474 0.1250 -0.0428 171 ILE A N +2726 C CA . ILE A 172 ? 0.4029 0.4997 0.2548 -0.1641 0.1350 -0.0445 171 ILE A CA +2727 C C . ILE A 172 ? 0.5028 0.5789 0.3381 -0.1654 0.1468 -0.0301 171 ILE A C +2728 O O . ILE A 172 ? 0.5154 0.5915 0.3368 -0.1545 0.1492 -0.0223 171 ILE A O +2729 C CB . ILE A 172 ? 0.3980 0.5334 0.2680 -0.1693 0.1379 -0.0580 171 ILE A CB +2730 C CG1 . ILE A 172 ? 0.4254 0.5831 0.3131 -0.1656 0.1257 -0.0715 171 ILE A CG1 +2731 C CG2 . ILE A 172 ? 0.4395 0.5786 0.3179 -0.1861 0.1488 -0.0610 171 ILE A CG2 +2732 C CD1 . ILE A 172 ? 0.5230 0.7205 0.4277 -0.1630 0.1248 -0.0844 171 ILE A CD1 +2744 N N . GLU A 173 ? 0.4868 0.5464 0.3241 -0.1778 0.1540 -0.0267 172 GLU A N +2745 C CA . GLU A 173 ? 0.4937 0.5296 0.3167 -0.1789 0.1649 -0.0115 172 GLU A CA +2746 C C . GLU A 173 ? 0.5746 0.6246 0.3889 -0.1757 0.1757 -0.0054 172 GLU A C +2747 O O . GLU A 173 ? 0.5706 0.6036 0.3682 -0.1700 0.1824 0.0099 172 GLU A O +2748 C CB . GLU A 173 ? 0.5267 0.5514 0.3599 -0.1943 0.1724 -0.0133 172 GLU A CB +2751 N N . ASP A 174 ? 0.5630 0.6453 0.3889 -0.1786 0.1771 -0.0174 173 ASP A N +2752 C CA . ASP A 174 ? 0.6078 0.7057 0.4273 -0.1772 0.1880 -0.0137 173 ASP A CA +2753 C C . ASP A 174 ? 0.5856 0.6968 0.3949 -0.1602 0.1818 -0.0132 173 ASP A C +2754 O O . ASP A 174 ? 0.5570 0.6838 0.3608 -0.1573 0.1894 -0.0118 173 ASP A O +2755 C CB . ASP A 174 ? 0.6601 0.7870 0.4994 -0.1908 0.1944 -0.0282 173 ASP A CB +2756 C CG . ASP A 174 ? 0.6860 0.8447 0.5430 -0.1877 0.1826 -0.0461 173 ASP A CG +2757 O OD1 . ASP A 174 ? 0.5938 0.7507 0.4489 -0.1759 0.1699 -0.0474 173 ASP A OD1 +2758 O OD2 . ASP A 174 ? 0.6838 0.8701 0.5579 -0.1968 0.1861 -0.0591 173 ASP A OD2 +2763 N N . GLY A 175 ? 0.5514 0.6570 0.3591 -0.1490 0.1680 -0.0158 174 GLY A N +2764 C CA . GLY A 175 ? 0.4996 0.6159 0.2988 -0.1316 0.1611 -0.0169 174 GLY A CA +2765 C C . GLY A 175 ? 0.5421 0.6878 0.3601 -0.1276 0.1508 -0.0345 174 GLY A C +2766 O O . GLY A 175 ? 0.5276 0.6795 0.3417 -0.1125 0.1428 -0.0374 174 GLY A O +2770 N N . SER A 176 ? 0.4815 0.6463 0.3211 -0.1399 0.1505 -0.0468 175 SER A N +2771 C CA . SER A 176 ? 0.4337 0.6273 0.2937 -0.1350 0.1400 -0.0629 175 SER A CA +2772 C C . SER A 176 ? 0.3923 0.5719 0.2559 -0.1296 0.1274 -0.0645 175 SER A C +2773 O O . SER A 176 ? 0.3961 0.5445 0.2460 -0.1300 0.1267 -0.0538 175 SER A O +2774 C CB . SER A 176 ? 0.5094 0.7320 0.3913 -0.1484 0.1442 -0.0758 175 SER A CB +2775 O OG . SER A 176 ? 0.5147 0.7243 0.4004 -0.1636 0.1488 -0.0744 175 SER A OG +2781 N N . VAL A 177 ? 0.3555 0.5584 0.2383 -0.1239 0.1174 -0.0778 176 VAL A N +2782 C CA . VAL A 177 ? 0.3537 0.5460 0.2409 -0.1169 0.1055 -0.0799 176 VAL A CA +2783 C C . VAL A 177 ? 0.3995 0.6170 0.3109 -0.1226 0.1005 -0.0931 176 VAL A C +2784 O O . VAL A 177 ? 0.3233 0.5736 0.2524 -0.1205 0.0995 -0.1047 176 VAL A O +2785 C CB . VAL A 177 ? 0.3556 0.5483 0.2411 -0.0973 0.0961 -0.0820 176 VAL A CB +2786 C CG1 . VAL A 177 ? 0.4163 0.5960 0.3069 -0.0898 0.0844 -0.0840 176 VAL A CG1 +2787 C CG2 . VAL A 177 ? 0.4007 0.5721 0.2623 -0.0901 0.1002 -0.0701 176 VAL A CG2 +2797 N N . GLN A 178 ? 0.3046 0.5074 0.2168 -0.1289 0.0969 -0.0917 177 GLN A N +2798 C CA . GLN A 178 ? 0.2869 0.5129 0.2202 -0.1325 0.0912 -0.1033 177 GLN A CA +2799 C C . GLN A 178 ? 0.2859 0.5123 0.2251 -0.1158 0.0785 -0.1069 177 GLN A C +2800 O O . GLN A 178 ? 0.3142 0.5106 0.2401 -0.1105 0.0738 -0.0990 177 GLN A O +2801 C CB . GLN A 178 ? 0.2924 0.5020 0.2229 -0.1481 0.0942 -0.1001 177 GLN A CB +2802 C CG . GLN A 178 ? 0.3336 0.5637 0.2827 -0.1505 0.0868 -0.1108 177 GLN A CG +2803 C CD . GLN A 178 ? 0.2947 0.5658 0.2656 -0.1541 0.0881 -0.1245 177 GLN A CD +2804 O OE1 . GLN A 178 ? 0.3458 0.6211 0.3177 -0.1667 0.0969 -0.1263 177 GLN A OE1 +2805 N NE2 . GLN A 178 ? 0.3047 0.6046 0.2930 -0.1412 0.0792 -0.1344 177 GLN A NE2 +2814 N N . LEU A 179 ? 0.2487 0.5073 0.2086 -0.1066 0.0729 -0.1190 178 LEU A N +2815 C CA . LEU A 179 ? 0.2306 0.4897 0.1994 -0.0893 0.0608 -0.1233 178 LEU A CA +2816 C C . LEU A 179 ? 0.2179 0.4825 0.1961 -0.0917 0.0543 -0.1276 178 LEU A C +2817 O O . LEU A 179 ? 0.2189 0.5071 0.2082 -0.1035 0.0580 -0.1340 178 LEU A O +2818 C CB . LEU A 179 ? 0.2223 0.5120 0.2102 -0.0763 0.0573 -0.1343 178 LEU A CB +2821 N N . ALA A 180 ? 0.2079 0.4507 0.1826 -0.0800 0.0440 -0.1243 179 ALA A N +2822 C CA . ALA A 180 ? 0.1977 0.4442 0.1821 -0.0781 0.0343 -0.1272 179 ALA A CA +2823 C C . ALA A 180 ? 0.1853 0.4273 0.1797 -0.0570 0.0222 -0.1291 179 ALA A C +2824 O O . ALA A 180 ? 0.1937 0.4051 0.1777 -0.0485 0.0188 -0.1222 179 ALA A O +2825 C CB . ALA A 180 ? 0.3005 0.5158 0.2692 -0.0896 0.0343 -0.1175 179 ALA A CB +2831 N N . ASP A 181 ? 0.1791 0.4506 0.1967 -0.0479 0.0160 -0.1370 180 ASP A N +2832 C CA . ASP A 181 ? 0.1999 0.4683 0.2300 -0.0277 0.0055 -0.1386 180 ASP A CA +2833 C C . ASP A 181 ? 0.1660 0.4161 0.1941 -0.0252 -0.0042 -0.1313 180 ASP A C +2834 O O . ASP A 181 ? 0.1659 0.4332 0.2012 -0.0315 -0.0071 -0.1321 180 ASP A O +2835 C CB . ASP A 181 ? 0.1996 0.5074 0.2561 -0.0180 0.0029 -0.1494 180 ASP A CB +2836 C CG . ASP A 181 ? 0.2224 0.5447 0.2855 -0.0115 0.0088 -0.1578 180 ASP A CG +2837 O OD1 . ASP A 181 ? 0.2481 0.5485 0.2969 -0.0092 0.0124 -0.1554 180 ASP A OD1 +2838 O OD2 . ASP A 181 ? 0.1814 0.5395 0.2648 -0.0081 0.0096 -0.1679 180 ASP A OD2 +2843 N N . HIS A 182 ? 0.1619 0.3791 0.1807 -0.0160 -0.0087 -0.1252 181 HIS A N +2844 C CA . HIS A 182 ? 0.1594 0.3567 0.1750 -0.0126 -0.0175 -0.1178 181 HIS A CA +2845 C C . HIS A 182 ? 0.1637 0.3634 0.1959 0.0078 -0.0258 -0.1187 181 HIS A C +2846 O O . HIS A 182 ? 0.1574 0.3475 0.1941 0.0199 -0.0251 -0.1217 181 HIS A O +2847 C CB . HIS A 182 ? 0.1744 0.3300 0.1686 -0.0165 -0.0163 -0.1095 181 HIS A CB +2848 C CG . HIS A 182 ? 0.1849 0.3277 0.1633 -0.0345 -0.0079 -0.1028 181 HIS A CG +2849 N ND1 . HIS A 182 ? 0.1750 0.3265 0.1480 -0.0426 0.0018 -0.1052 181 HIS A ND1 +2850 C CD2 . HIS A 182 ? 0.1720 0.2925 0.1390 -0.0449 -0.0075 -0.0936 181 HIS A CD2 +2851 C CE1 . HIS A 182 ? 0.1826 0.3175 0.1415 -0.0575 0.0077 -0.0980 181 HIS A CE1 +2852 N NE2 . HIS A 182 ? 0.1928 0.3088 0.1490 -0.0588 0.0021 -0.0913 181 HIS A NE2 +2861 N N . TYR A 183 ? 0.1549 0.3673 0.1962 0.0120 -0.0335 -0.1163 182 TYR A N +2862 C CA . TYR A 183 ? 0.1531 0.3621 0.2073 0.0314 -0.0416 -0.1137 182 TYR A CA +2863 C C . TYR A 183 ? 0.1555 0.3433 0.1982 0.0306 -0.0481 -0.1034 182 TYR A C +2864 O O . TYR A 183 ? 0.1571 0.3576 0.1953 0.0200 -0.0504 -0.1018 182 TYR A O +2865 C CB . TYR A 183 ? 0.1529 0.4021 0.2303 0.0406 -0.0451 -0.1204 182 TYR A CB +2866 C CG . TYR A 183 ? 0.1507 0.4216 0.2393 0.0403 -0.0379 -0.1316 182 TYR A CG +2867 C CD1 . TYR A 183 ? 0.1617 0.4616 0.2519 0.0259 -0.0320 -0.1387 182 TYR A CD1 +2868 C CD2 . TYR A 183 ? 0.1610 0.4227 0.2582 0.0535 -0.0359 -0.1357 182 TYR A CD2 +2869 C CE1 . TYR A 183 ? 0.1643 0.4841 0.2635 0.0253 -0.0246 -0.1488 182 TYR A CE1 +2870 C CE2 . TYR A 183 ? 0.2124 0.4948 0.3190 0.0532 -0.0292 -0.1465 182 TYR A CE2 +2871 C CZ . TYR A 183 ? 0.1484 0.4596 0.2550 0.0392 -0.0237 -0.1525 182 TYR A CZ +2872 O OH . TYR A 183 ? 0.1479 0.4792 0.2627 0.0391 -0.0165 -0.1630 182 TYR A OH +2882 N N . GLN A 184 ? 0.1582 0.3151 0.1973 0.0418 -0.0505 -0.0977 183 GLN A N +2883 C CA . GLN A 184 ? 0.1607 0.2889 0.1839 0.0382 -0.0539 -0.0882 183 GLN A CA +2884 C C . GLN A 184 ? 0.1876 0.3007 0.2178 0.0565 -0.0593 -0.0816 183 GLN A C +2885 O O . GLN A 184 ? 0.1839 0.2936 0.2279 0.0709 -0.0579 -0.0847 183 GLN A O +2886 C CB . GLN A 184 ? 0.1588 0.2555 0.1644 0.0279 -0.0479 -0.0880 183 GLN A CB +2887 C CG . GLN A 184 ? 0.1608 0.2233 0.1507 0.0250 -0.0503 -0.0799 183 GLN A CG +2888 C CD . GLN A 184 ? 0.2118 0.2442 0.1871 0.0181 -0.0447 -0.0812 183 GLN A CD +2889 O OE1 . GLN A 184 ? 0.1725 0.2092 0.1451 0.0104 -0.0374 -0.0830 183 GLN A OE1 +2890 N NE2 . GLN A 184 ? 0.2146 0.2157 0.1829 0.0209 -0.0451 -0.0744 183 GLN A NE2 +2899 N N . GLN A 185 ? 0.1726 0.2775 0.1937 0.0557 -0.0649 -0.0728 184 GLN A N +2900 C CA . GLN A 185 ? 0.2192 0.3073 0.2433 0.0719 -0.0694 -0.0640 184 GLN A CA +2901 C C . GLN A 185 ? 0.2318 0.2894 0.2357 0.0635 -0.0701 -0.0562 184 GLN A C +2902 O O . GLN A 185 ? 0.2317 0.2968 0.2236 0.0486 -0.0717 -0.0557 184 GLN A O +2903 C CB . GLN A 185 ? 0.2854 0.4053 0.3207 0.0826 -0.0772 -0.0603 184 GLN A CB +2904 C CG . GLN A 185 ? 0.4594 0.5816 0.5137 0.1050 -0.0788 -0.0582 184 GLN A CG +2909 N N . ASN A 186 ? 0.1996 0.2239 0.2008 0.0724 -0.0684 -0.0510 185 ASN A N +2910 C CA . ASN A 186 ? 0.1896 0.1852 0.1728 0.0656 -0.0689 -0.0439 185 ASN A CA +2911 C C . ASN A 186 ? 0.2017 0.1839 0.1877 0.0817 -0.0717 -0.0333 185 ASN A C +2912 O O . ASN A 186 ? 0.2276 0.2021 0.2281 0.0971 -0.0692 -0.0332 185 ASN A O +2913 C CB . ASN A 186 ? 0.2057 0.1685 0.1800 0.0581 -0.0625 -0.0484 185 ASN A CB +2914 C CG . ASN A 186 ? 0.2241 0.1951 0.1917 0.0420 -0.0590 -0.0566 185 ASN A CG +2915 O OD1 . ASN A 186 ? 0.2866 0.2797 0.2642 0.0427 -0.0570 -0.0633 185 ASN A OD1 +2916 N ND2 . ASN A 186 ? 0.1943 0.1458 0.1452 0.0282 -0.0576 -0.0558 185 ASN A ND2 +2923 N N A THR A 187 ? 0.2075 0.1877 0.1803 0.0786 -0.0764 -0.0244 186 THR A N +2924 N N B THR A 187 ? 0.2052 0.1839 0.1773 0.0779 -0.0761 -0.0246 186 THR A N +2925 C CA A THR A 187 ? 0.2583 0.2245 0.2299 0.0935 -0.0786 -0.0120 186 THR A CA +2926 C CA B THR A 187 ? 0.2544 0.2212 0.2251 0.0924 -0.0787 -0.0122 186 THR A CA +2927 C C A THR A 187 ? 0.2453 0.1846 0.1969 0.0842 -0.0779 -0.0058 186 THR A C +2928 C C B THR A 187 ? 0.2382 0.1749 0.1893 0.0829 -0.0771 -0.0068 186 THR A C +2929 O O A THR A 187 ? 0.2593 0.2073 0.1982 0.0685 -0.0804 -0.0082 186 THR A O +2930 O O B THR A 187 ? 0.2240 0.1639 0.1625 0.0659 -0.0782 -0.0106 186 THR A O +2931 C CB A THR A 187 ? 0.3091 0.3095 0.2859 0.1045 -0.0868 -0.0049 186 THR A CB +2932 C CB B THR A 187 ? 0.2982 0.3009 0.2712 0.0998 -0.0875 -0.0059 186 THR A CB +2933 O OG1 A THR A 187 ? 0.2236 0.2550 0.1939 0.0903 -0.0919 -0.0100 186 THR A OG1 +2934 O OG1 B THR A 187 ? 0.3147 0.3506 0.3054 0.1044 -0.0892 -0.0138 186 THR A OG1 +2935 C CG2 A THR A 187 ? 0.2319 0.2499 0.2311 0.1168 -0.0841 -0.0078 186 THR A CG2 +2936 C CG2 B THR A 187 ? 0.3455 0.3369 0.3204 0.1118 -0.0841 0.0080 186 THR A CG2 +2951 N N . PRO A 188 ? 0.2354 0.1492 0.1880 0.0855 -0.0679 0.0004 187 PRO A N +2952 C CA . PRO A 188 ? 0.2438 0.1370 0.1806 0.0741 -0.0645 0.0039 187 PRO A CA +2953 C C . PRO A 188 ? 0.2478 0.1546 0.1703 0.0750 -0.0737 0.0130 187 PRO A C +2954 O O . PRO A 188 ? 0.2785 0.2086 0.2074 0.0863 -0.0778 0.0204 187 PRO A O +2955 C CB . PRO A 188 ? 0.3061 0.1879 0.2563 0.0736 -0.0500 0.0088 187 PRO A CB +2956 C CG . PRO A 188 ? 0.3593 0.2518 0.3285 0.0861 -0.0478 0.0116 187 PRO A CG +2957 C CD . PRO A 188 ? 0.3334 0.2442 0.3048 0.0924 -0.0572 0.0039 187 PRO A CD +2965 N N . ILE A 189 ? 0.4691 0.2760 0.1521 -0.1699 -0.0396 0.0335 188 ILE A N +2966 C CA . ILE A 189 ? 0.4933 0.2947 0.1580 -0.1776 -0.0381 0.0323 188 ILE A CA +2967 C C . ILE A 189 ? 0.5394 0.3275 0.1836 -0.1871 -0.0363 0.0357 188 ILE A C +2968 O O . ILE A 189 ? 0.5910 0.3690 0.2171 -0.1914 -0.0428 0.0397 188 ILE A O +2969 C CB . ILE A 189 ? 0.4848 0.2961 0.1527 -0.1806 -0.0243 0.0226 188 ILE A CB +2970 C CG1 . ILE A 189 ? 0.4626 0.2839 0.1458 -0.1724 -0.0292 0.0207 188 ILE A CG1 +2971 C CG2 . ILE A 189 ? 0.5132 0.3183 0.1604 -0.1900 -0.0200 0.0202 188 ILE A CG2 +2972 C CD1 . ILE A 189 ? 0.4491 0.2793 0.1404 -0.1725 -0.0166 0.0114 188 ILE A CD1 +2984 N N . GLY A 190 ? 0.5254 0.3143 0.1722 -0.1904 -0.0274 0.0343 189 GLY A N +2985 C CA . GLY A 190 ? 0.6281 0.4060 0.2565 -0.2002 -0.0243 0.0375 189 GLY A CA +2986 C C . GLY A 190 ? 0.6226 0.3858 0.2457 -0.1979 -0.0381 0.0474 189 GLY A C +2987 O O . GLY A 190 ? 0.6171 0.3806 0.2537 -0.1877 -0.0491 0.0507 189 GLY A O +2991 N N A ASP A 191 ? 0.7341 0.4838 0.3372 -0.2072 -0.0377 0.0519 190 ASP A N +2992 N N B ASP A 191 ? 0.7275 0.4775 0.3307 -0.2074 -0.0372 0.0517 190 ASP A N +2993 C CA A ASP A 191 ? 0.7635 0.4956 0.3586 -0.2058 -0.0510 0.0614 190 ASP A CA +2994 C CA B ASP A 191 ? 0.7576 0.4895 0.3514 -0.2066 -0.0504 0.0613 190 ASP A CA +2995 C C A ASP A 191 ? 0.7566 0.4900 0.3613 -0.2068 -0.0453 0.0618 190 ASP A C +2996 C C B ASP A 191 ? 0.7696 0.5008 0.3685 -0.2101 -0.0437 0.0621 190 ASP A C +2997 O O A ASP A 191 ? 0.7752 0.4958 0.3797 -0.2031 -0.0564 0.0685 190 ASP A O +2998 O O B ASP A 191 ? 0.7822 0.4965 0.3712 -0.2117 -0.0524 0.0697 190 ASP A O +2999 C CB A ASP A 191 ? 0.7828 0.4966 0.3484 -0.2156 -0.0550 0.0674 190 ASP A CB +3000 C CB B ASP A 191 ? 0.7744 0.4887 0.3394 -0.2152 -0.0557 0.0672 190 ASP A CB +3001 C CG A ASP A 191 ? 0.7706 0.4827 0.3263 -0.2139 -0.0622 0.0679 190 ASP A CG +3002 C CG B ASP A 191 ? 0.8247 0.5349 0.3728 -0.2295 -0.0427 0.0666 190 ASP A CG +3003 O OD1 A ASP A 191 ? 0.8535 0.5718 0.4235 -0.2027 -0.0717 0.0676 190 ASP A OD1 +3004 O OD1 B ASP A 191 ? 0.7061 0.4323 0.2638 -0.2337 -0.0263 0.0585 190 ASP A OD1 +3005 O OD2 A ASP A 191 ? 0.8391 0.5447 0.3727 -0.2237 -0.0581 0.0684 190 ASP A OD2 +3006 O OD2 B ASP A 191 ? 0.9348 0.6258 0.4600 -0.2364 -0.0490 0.0744 190 ASP A OD2 +3015 N N . GLY A 192 ? 0.7699 0.5190 0.3842 -0.2112 -0.0282 0.0542 191 GLY A N +3016 C CA . GLY A 192 ? 0.7558 0.5085 0.3794 -0.2137 -0.0205 0.0539 191 GLY A CA +3017 C C . GLY A 192 ? 0.6901 0.4460 0.3356 -0.2017 -0.0284 0.0558 191 GLY A C +3018 O O . GLY A 192 ? 0.6503 0.4091 0.3054 -0.1915 -0.0376 0.0558 191 GLY A O +3023 N N . PRO A 193 ? 0.6786 0.4340 0.3322 -0.2034 -0.0249 0.0574 192 PRO A N +3024 C CA . PRO A 193 ? 0.6218 0.3787 0.2959 -0.1926 -0.0325 0.0593 192 PRO A CA +3025 C C . PRO A 193 ? 0.5421 0.3208 0.2420 -0.1834 -0.0258 0.0519 192 PRO A C +3026 O O . PRO A 193 ? 0.5661 0.3607 0.2720 -0.1868 -0.0110 0.0443 192 PRO A O +3027 C CB . PRO A 193 ? 0.6831 0.4367 0.3592 -0.1999 -0.0262 0.0611 192 PRO A CB +3028 C CG . PRO A 193 ? 0.7579 0.5185 0.4231 -0.2133 -0.0101 0.0566 192 PRO A CG +3029 C CD . PRO A 193 ? 0.6781 0.4320 0.3221 -0.2165 -0.0132 0.0572 192 PRO A CD +3037 N N . VAL A 194 ? 0.4923 0.2711 0.2070 -0.1716 -0.0369 0.0540 193 VAL A N +3038 C CA . VAL A 194 ? 0.4463 0.2439 0.1854 -0.1627 -0.0317 0.0480 193 VAL A CA +3039 C C . VAL A 194 ? 0.4318 0.2292 0.1903 -0.1549 -0.0378 0.0498 193 VAL A C +3040 O O . VAL A 194 ? 0.4501 0.2313 0.2015 -0.1551 -0.0482 0.0557 193 VAL A O +3041 C CB . VAL A 194 ? 0.4725 0.2730 0.2119 -0.1554 -0.0395 0.0476 193 VAL A CB +3042 C CG1 . VAL A 194 ? 0.4695 0.2693 0.1904 -0.1630 -0.0344 0.0451 193 VAL A CG1 +3043 C CG2 . VAL A 194 ? 0.4626 0.2495 0.1997 -0.1472 -0.0596 0.0546 193 VAL A CG2 +3053 N N . LEU A 195 ? 0.4000 0.2147 0.1828 -0.1483 -0.0314 0.0439 194 LEU A N +3054 C CA . LEU A 195 ? 0.3848 0.2009 0.1882 -0.1407 -0.0370 0.0437 194 LEU A CA +3055 C C . LEU A 195 ? 0.3742 0.1857 0.1820 -0.1292 -0.0528 0.0466 194 LEU A C +3056 O O . LEU A 195 ? 0.3684 0.1898 0.1814 -0.1249 -0.0519 0.0440 194 LEU A O +3057 C CB . LEU A 195 ? 0.3581 0.1957 0.1868 -0.1391 -0.0235 0.0350 194 LEU A CB +3058 C CG . LEU A 195 ? 0.3674 0.2121 0.1972 -0.1496 -0.0086 0.0311 194 LEU A CG +3059 C CD1 . LEU A 195 ? 0.3856 0.2530 0.2410 -0.1465 0.0032 0.0214 194 LEU A CD1 +3060 C CD2 . LEU A 195 ? 0.4474 0.2802 0.2752 -0.1545 -0.0130 0.0353 194 LEU A CD2 +3072 N N . LEU A 196 ? 0.3860 0.1821 0.1916 -0.1242 -0.0676 0.0516 195 LEU A N +3073 C CA . LEU A 196 ? 0.3767 0.1695 0.1892 -0.1117 -0.0838 0.0534 195 LEU A CA +3074 C C . LEU A 196 ? 0.3517 0.1571 0.1926 -0.1007 -0.0851 0.0470 195 LEU A C +3075 O O . LEU A 196 ? 0.3613 0.1556 0.2052 -0.1026 -0.0879 0.0479 195 LEU A O +3076 C CB . LEU A 196 ? 0.4050 0.1767 0.2004 -0.1089 -0.1006 0.0600 195 LEU A CB +3077 C CG . LEU A 196 ? 0.4288 0.1925 0.1991 -0.1170 -0.1010 0.0636 195 LEU A CG +3078 C CD1 . LEU A 196 ? 0.5129 0.2552 0.2698 -0.1141 -0.1172 0.0686 195 LEU A CD1 +3079 C CD2 . LEU A 196 ? 0.4137 0.1906 0.1853 -0.1131 -0.1012 0.0616 195 LEU A CD2 +3091 N N . PRO A 197 ? 0.3209 0.1507 0.1823 -0.0890 -0.0827 0.0399 196 PRO A N +3092 C CA . PRO A 197 ? 0.2973 0.1427 0.1846 -0.0806 -0.0795 0.0327 196 PRO A CA +3093 C C . PRO A 197 ? 0.2927 0.1373 0.1922 -0.0661 -0.0946 0.0311 196 PRO A C +3094 O O . PRO A 197 ? 0.2996 0.1394 0.1931 -0.0590 -0.1069 0.0338 196 PRO A O +3095 C CB . PRO A 197 ? 0.2700 0.1399 0.1710 -0.0751 -0.0701 0.0265 196 PRO A CB +3096 C CG . PRO A 197 ? 0.2909 0.1597 0.1797 -0.0735 -0.0763 0.0298 196 PRO A CG +3097 C CD . PRO A 197 ? 0.3075 0.1519 0.1692 -0.0853 -0.0804 0.0378 196 PRO A CD +3105 N N . ASP A 198 ? 0.2819 0.1325 0.1990 -0.0615 -0.0937 0.0258 197 ASP A N +3106 C CA . ASP A 198 ? 0.2689 0.1283 0.2029 -0.0453 -0.1045 0.0207 197 ASP A CA +3107 C C . ASP A 198 ? 0.2414 0.1273 0.1888 -0.0352 -0.1009 0.0159 197 ASP A C +3108 O O . ASP A 198 ? 0.2304 0.1274 0.1775 -0.0406 -0.0888 0.0153 197 ASP A O +3109 C CB . ASP A 198 ? 0.2634 0.1250 0.2129 -0.0438 -0.1029 0.0150 197 ASP A CB +3110 C CG . ASP A 198 ? 0.3353 0.1687 0.2722 -0.0537 -0.1084 0.0196 197 ASP A CG +3111 O OD1 . ASP A 198 ? 0.3745 0.1847 0.2903 -0.0593 -0.1158 0.0277 197 ASP A OD1 +3112 O OD2 . ASP A 198 ? 0.3924 0.2261 0.3401 -0.0563 -0.1058 0.0152 197 ASP A OD2 +3117 N N . ASN A 199 ? 0.2319 0.1278 0.1908 -0.0208 -0.1109 0.0121 198 ASN A N +3118 C CA . ASN A 199 ? 0.2080 0.1293 0.1795 -0.0121 -0.1076 0.0078 198 ASN A CA +3119 C C . ASN A 199 ? 0.1875 0.1251 0.1725 -0.0119 -0.0950 0.0028 198 ASN A C +3120 O O . ASN A 199 ? 0.1851 0.1225 0.1791 -0.0102 -0.0943 -0.0009 198 ASN A O +3121 C CB . ASN A 199 ? 0.2026 0.1343 0.1860 0.0030 -0.1160 0.0031 198 ASN A CB +3122 C CG . ASN A 199 ? 0.3258 0.2481 0.3001 0.0049 -0.1225 0.0060 198 ASN A CG +3123 O OD1 . ASN A 199 ? 0.2392 0.1425 0.1952 -0.0044 -0.1275 0.0131 198 ASN A OD1 +3124 N ND2 . ASN A 199 ? 0.2562 0.1929 0.2422 0.0162 -0.1219 0.0003 198 ASN A ND2 +3131 N N . HIS A 200 ? 0.1752 0.1255 0.1605 -0.0141 -0.0857 0.0028 199 HIS A N +3132 C CA . HIS A 200 ? 0.1634 0.1278 0.1596 -0.0129 -0.0746 -0.0013 199 HIS A CA +3133 C C . HIS A 200 ? 0.1543 0.1307 0.1496 -0.0121 -0.0692 -0.0007 199 HIS A C +3134 O O . HIS A 200 ? 0.1565 0.1332 0.1455 -0.0121 -0.0747 0.0018 199 HIS A O +3135 C CB . HIS A 200 ? 0.1655 0.1209 0.1576 -0.0238 -0.0651 -0.0009 199 HIS A CB +3136 C CG . HIS A 200 ? 0.1771 0.1228 0.1530 -0.0355 -0.0584 0.0034 199 HIS A CG +3137 N ND1 . HIS A 200 ? 0.1980 0.1258 0.1565 -0.0435 -0.0639 0.0092 199 HIS A ND1 +3138 C CD2 . HIS A 200 ? 0.1754 0.1261 0.1484 -0.0401 -0.0474 0.0025 199 HIS A CD2 +3139 C CE1 . HIS A 200 ? 0.2541 0.1776 0.1995 -0.0530 -0.0559 0.0114 199 HIS A CE1 +3140 N NE2 . HIS A 200 ? 0.2158 0.1529 0.1703 -0.0510 -0.0456 0.0069 199 HIS A NE2 +3149 N N . TYR A 201 ? 0.1388 0.1246 0.1402 -0.0114 -0.0594 -0.0031 200 TYR A N +3150 C CA . TYR A 201 ? 0.1330 0.1263 0.1318 -0.0121 -0.0539 -0.0022 200 TYR A CA +3151 C C . TYR A 201 ? 0.1837 0.1764 0.1822 -0.0158 -0.0421 -0.0036 200 TYR A C +3152 O O . TYR A 201 ? 0.1624 0.1539 0.1662 -0.0162 -0.0383 -0.0063 200 TYR A O +3153 C CB . TYR A 201 ? 0.1471 0.1571 0.1559 -0.0021 -0.0576 -0.0042 200 TYR A CB +3154 C CG . TYR A 201 ? 0.1426 0.1620 0.1635 0.0062 -0.0561 -0.0082 200 TYR A CG +3155 C CD1 . TYR A 201 ? 0.1476 0.1701 0.1767 0.0134 -0.0639 -0.0116 200 TYR A CD1 +3156 C CD2 . TYR A 201 ? 0.2344 0.2583 0.2577 0.0074 -0.0476 -0.0091 200 TYR A CD2 +3157 C CE1 . TYR A 201 ? 0.1909 0.2228 0.2306 0.0211 -0.0631 -0.0161 200 TYR A CE1 +3158 C CE2 . TYR A 201 ? 0.3427 0.3754 0.3761 0.0155 -0.0473 -0.0129 200 TYR A CE2 +3159 C CZ . TYR A 201 ? 0.3065 0.3440 0.3481 0.0220 -0.0549 -0.0165 200 TYR A CZ +3160 O OH . TYR A 201 ? 0.3769 0.4240 0.4280 0.0300 -0.0549 -0.0208 200 TYR A OH +3170 N N . LEU A 202 ? 0.1402 0.1335 0.1328 -0.0186 -0.0369 -0.0024 201 LEU A N +3171 C CA . LEU A 202 ? 0.1576 0.1499 0.1502 -0.0198 -0.0267 -0.0043 201 LEU A CA +3172 C C . LEU A 202 ? 0.1429 0.1451 0.1413 -0.0122 -0.0258 -0.0045 201 LEU A C +3173 O O . LEU A 202 ? 0.1492 0.1561 0.1454 -0.0121 -0.0296 -0.0021 201 LEU A O +3174 C CB . LEU A 202 ? 0.1675 0.1488 0.1458 -0.0298 -0.0213 -0.0029 201 LEU A CB +3175 C CG . LEU A 202 ? 0.1609 0.1309 0.1274 -0.0394 -0.0230 -0.0011 201 LEU A CG +3176 C CD1 . LEU A 202 ? 0.2056 0.1661 0.1566 -0.0487 -0.0179 -0.0004 201 LEU A CD1 +3177 C CD2 . LEU A 202 ? 0.1955 0.1630 0.1660 -0.0413 -0.0195 -0.0034 201 LEU A CD2 +3189 N N . HIS A 203 ? 0.1260 0.1317 0.1315 -0.0062 -0.0211 -0.0072 202 HIS A N +3190 C CA . HIS A 203 ? 0.1818 0.1918 0.1883 -0.0005 -0.0188 -0.0063 202 HIS A CA +3191 C C . HIS A 203 ? 0.1626 0.1606 0.1592 -0.0062 -0.0114 -0.0057 202 HIS A C +3192 O O . HIS A 203 ? 0.2212 0.2127 0.2170 -0.0085 -0.0061 -0.0090 202 HIS A O +3193 C CB . HIS A 203 ? 0.2212 0.2377 0.2377 0.0091 -0.0179 -0.0095 202 HIS A CB +3194 C CG . HIS A 203 ? 0.2497 0.2780 0.2763 0.0161 -0.0249 -0.0114 202 HIS A CG +3195 N ND1 . HIS A 203 ? 0.3148 0.3527 0.3424 0.0206 -0.0300 -0.0097 202 HIS A ND1 +3196 C CD2 . HIS A 203 ? 0.3013 0.3340 0.3378 0.0195 -0.0273 -0.0158 202 HIS A CD2 +3197 C CE1 . HIS A 203 ? 0.3107 0.3573 0.3477 0.0272 -0.0356 -0.0133 202 HIS A CE1 +3198 N NE2 . HIS A 203 ? 0.2640 0.3070 0.3065 0.0264 -0.0344 -0.0168 202 HIS A NE2 +3207 N N . THR A 204 ? 0.1715 0.1674 0.1613 -0.0082 -0.0107 -0.0024 203 THR A N +3208 C CA . THR A 204 ? 0.1522 0.1346 0.1322 -0.0131 -0.0044 -0.0023 203 THR A CA +3209 C C . THR A 204 ? 0.1795 0.1598 0.1584 -0.0073 -0.0027 -0.0001 203 THR A C +3210 O O . THR A 204 ? 0.2077 0.1983 0.1901 -0.0030 -0.0064 0.0028 203 THR A O +3211 C CB . THR A 204 ? 0.1906 0.1681 0.1603 -0.0238 -0.0053 0.0001 203 THR A CB +3212 O OG1 . THR A 204 ? 0.2280 0.2161 0.1997 -0.0234 -0.0097 0.0036 203 THR A OG1 +3213 C CG2 . THR A 204 ? 0.2017 0.1792 0.1694 -0.0294 -0.0083 -0.0010 203 THR A CG2 +3221 N N . HIS A 205 ? 0.1658 0.1326 0.1396 -0.0063 0.0026 -0.0018 204 HIS A N +3222 C CA . HIS A 205 ? 0.2096 0.1675 0.1765 -0.0040 0.0039 0.0019 204 HIS A CA +3223 C C . HIS A 205 ? 0.2342 0.1719 0.1913 -0.0076 0.0094 -0.0005 204 HIS A C +3224 O O . HIS A 205 ? 0.2216 0.1556 0.1811 -0.0061 0.0129 -0.0064 204 HIS A O +3225 C CB . HIS A 205 ? 0.3031 0.2673 0.2763 0.0083 0.0015 0.0030 204 HIS A CB +3226 C CG . HIS A 205 ? 0.2693 0.2323 0.2503 0.0179 0.0029 -0.0025 204 HIS A CG +3227 N ND1 . HIS A 205 ? 0.2473 0.1965 0.2239 0.0245 0.0050 -0.0033 204 HIS A ND1 +3228 C CD2 . HIS A 205 ? 0.3473 0.3223 0.3410 0.0223 0.0019 -0.0080 204 HIS A CD2 +3229 C CE1 . HIS A 205 ? 0.3215 0.2766 0.3093 0.0331 0.0054 -0.0098 204 HIS A CE1 +3230 N NE2 . HIS A 205 ? 0.2970 0.2683 0.2954 0.0311 0.0039 -0.0126 204 HIS A NE2 +3239 N N . SER A 206 ? 0.2733 0.1987 0.2191 -0.0133 0.0104 0.0037 205 SER A N +3240 C CA . SER A 206 ? 0.3033 0.2079 0.2376 -0.0195 0.0148 0.0014 205 SER A CA +3241 C C . SER A 206 ? 0.3048 0.1917 0.2297 -0.0169 0.0155 0.0056 205 SER A C +3242 O O . SER A 206 ? 0.3019 0.1932 0.2252 -0.0166 0.0130 0.0123 205 SER A O +3243 C CB . SER A 206 ? 0.2686 0.1731 0.1957 -0.0338 0.0146 0.0022 205 SER A CB +3244 O OG . SER A 206 ? 0.2978 0.2158 0.2309 -0.0362 0.0129 -0.0006 205 SER A OG +3250 N N . LYS A 207 ? 0.2998 0.1658 0.2178 -0.0147 0.0188 0.0015 206 LYS A N +3251 C CA . LYS A 207 ? 0.3142 0.1564 0.2197 -0.0137 0.0190 0.0055 206 LYS A CA +3252 C C . LYS A 207 ? 0.3327 0.1538 0.2255 -0.0247 0.0223 0.0024 206 LYS A C +3253 O O . LYS A 207 ? 0.3434 0.1598 0.2368 -0.0240 0.0256 -0.0061 206 LYS A O +3254 C CB . LYS A 207 ? 0.4065 0.2391 0.3150 0.0027 0.0182 0.0028 206 LYS A CB +3255 C CG . LYS A 207 ? 0.5411 0.3461 0.4344 0.0049 0.0167 0.0088 206 LYS A CG +3256 C CD . LYS A 207 ? 0.6215 0.4180 0.5178 0.0230 0.0138 0.0069 206 LYS A CD +3263 N N . LEU A 208 ? 0.3370 0.1460 0.2181 -0.0355 0.0219 0.0087 207 LEU A N +3264 C CA . LEU A 208 ? 0.3826 0.1697 0.2506 -0.0472 0.0244 0.0057 207 LEU A CA +3265 C C . LEU A 208 ? 0.3917 0.1462 0.2471 -0.0421 0.0246 0.0071 207 LEU A C +3266 O O . LEU A 208 ? 0.3982 0.1470 0.2502 -0.0367 0.0222 0.0150 207 LEU A O +3267 C CB . LEU A 208 ? 0.3485 0.1428 0.2119 -0.0645 0.0235 0.0108 207 LEU A CB +3268 C CG . LEU A 208 ? 0.3153 0.1420 0.1906 -0.0686 0.0212 0.0117 207 LEU A CG +3269 C CD1 . LEU A 208 ? 0.4186 0.2509 0.2896 -0.0857 0.0203 0.0144 207 LEU A CD1 +3270 C CD2 . LEU A 208 ? 0.3179 0.1554 0.2006 -0.0647 0.0216 0.0041 207 LEU A CD2 +3282 N N . SER A 209 ? 0.3906 0.1224 0.2377 -0.0435 0.0271 -0.0005 208 SER A N +3283 C CA . SER A 209 ? 0.4249 0.1215 0.2589 -0.0381 0.0265 -0.0003 208 SER A CA +3284 C C . SER A 209 ? 0.4573 0.1304 0.2788 -0.0491 0.0289 -0.0072 208 SER A C +3285 O O . SER A 209 ? 0.4508 0.1377 0.2739 -0.0610 0.0308 -0.0112 208 SER A O +3286 C CB . SER A 209 ? 0.4578 0.1518 0.2998 -0.0173 0.0258 -0.0063 208 SER A CB +3287 O OG . SER A 209 ? 0.4243 0.1331 0.2765 -0.0142 0.0297 -0.0180 208 SER A OG +3293 N N . LYS A 210 ? 0.5039 0.1525 0.3180 -0.0429 0.0273 -0.0083 209 LYS A N +3294 C CA . LYS A 210 ? 0.5159 0.1509 0.3232 -0.0500 0.0283 -0.0153 209 LYS A CA +3295 C C . LYS A 210 ? 0.5822 0.2017 0.3912 -0.0340 0.0287 -0.0255 209 LYS A C +3296 O O . LYS A 210 ? 0.5984 0.2119 0.4114 -0.0179 0.0262 -0.0243 209 LYS A O +3297 C CB . LYS A 210 ? 0.5249 0.1441 0.3212 -0.0612 0.0256 -0.0069 209 LYS A CB +3298 C CG . LYS A 210 ? 0.5536 0.1924 0.3505 -0.0774 0.0255 0.0018 209 LYS A CG +3299 C CD . LYS A 210 ? 0.5136 0.1700 0.3133 -0.0910 0.0272 -0.0040 209 LYS A CD +3300 C CE . LYS A 210 ? 0.4862 0.1623 0.2881 -0.1057 0.0262 0.0038 209 LYS A CE +3301 N NZ . LYS A 210 ? 0.4745 0.1713 0.2806 -0.1175 0.0262 -0.0012 209 LYS A NZ +3315 N N . ASP A 211 ? 0.5459 0.1624 0.3532 -0.0379 0.0313 -0.0361 210 ASP A N +3316 C CA . ASP A 211 ? 0.5486 0.1502 0.3571 -0.0252 0.0317 -0.0471 210 ASP A CA +3317 C C . ASP A 211 ? 0.5853 0.1573 0.3825 -0.0276 0.0275 -0.0437 210 ASP A C +3318 O O . ASP A 211 ? 0.6091 0.1742 0.3973 -0.0429 0.0276 -0.0426 210 ASP A O +3319 C CB . ASP A 211 ? 0.5437 0.1563 0.3533 -0.0308 0.0366 -0.0594 210 ASP A CB +3320 C CG . ASP A 211 ? 0.6336 0.2349 0.4458 -0.0183 0.0378 -0.0729 210 ASP A CG +3321 O OD1 . ASP A 211 ? 0.6110 0.1925 0.4234 -0.0066 0.0338 -0.0729 210 ASP A OD1 +3322 O OD2 . ASP A 211 ? 0.6473 0.2606 0.4611 -0.0207 0.0426 -0.0837 210 ASP A OD2 +3327 N N . PRO A 212 ? 0.7052 0.2599 0.5032 -0.0122 0.0235 -0.0423 211 PRO A N +3328 C CA . PRO A 212 ? 0.7772 0.3013 0.5631 -0.0148 0.0191 -0.0379 211 PRO A CA +3329 C C . PRO A 212 ? 0.7846 0.2936 0.5658 -0.0193 0.0203 -0.0492 211 PRO A C +3330 O O . PRO A 212 ? 0.8636 0.3492 0.6332 -0.0279 0.0176 -0.0454 211 PRO A O +3331 C CB . PRO A 212 ? 0.7752 0.2876 0.5653 0.0057 0.0142 -0.0364 211 PRO A CB +3332 C CG . PRO A 212 ? 0.7323 0.2701 0.5397 0.0203 0.0169 -0.0456 211 PRO A CG +3333 C CD . PRO A 212 ? 0.6429 0.2063 0.4530 0.0077 0.0220 -0.0440 211 PRO A CD +3341 N N . ASN A 213 ? 0.7711 0.2941 0.5607 -0.0143 0.0245 -0.0630 212 ASN A N +3342 C CA . ASN A 213 ? 0.7838 0.2953 0.5695 -0.0171 0.0259 -0.0754 212 ASN A CA +3343 C C . ASN A 213 ? 0.7732 0.2982 0.5533 -0.0358 0.0296 -0.0776 212 ASN A C +3344 O O . ASN A 213 ? 0.7535 0.2731 0.5301 -0.0387 0.0313 -0.0887 212 ASN A O +3345 C CB . ASN A 213 ? 0.8349 0.3545 0.6334 0.0010 0.0283 -0.0908 212 ASN A CB +3346 C CG . ASN A 213 ? 0.8903 0.3978 0.6964 0.0206 0.0238 -0.0902 212 ASN A CG +3347 O OD1 . ASN A 213 ? 0.9268 0.4064 0.7243 0.0218 0.0184 -0.0839 212 ASN A OD1 +3348 N ND2 . ASN A 213 ? 0.9013 0.4307 0.7237 0.0358 0.0257 -0.0963 212 ASN A ND2 +3355 N N . GLU A 214 ? 0.6404 0.1840 0.4201 -0.0477 0.0306 -0.0675 213 GLU A N +3356 C CA . GLU A 214 ? 0.6276 0.1875 0.4036 -0.0646 0.0331 -0.0691 213 GLU A CA +3357 C C . GLU A 214 ? 0.6445 0.1951 0.4111 -0.0815 0.0300 -0.0603 213 GLU A C +3358 O O . GLU A 214 ? 0.6344 0.1875 0.4008 -0.0860 0.0280 -0.0481 213 GLU A O +3359 C CB . GLU A 214 ? 0.5883 0.1791 0.3722 -0.0669 0.0361 -0.0659 213 GLU A CB +3360 C CG . GLU A 214 ? 0.5757 0.1847 0.3562 -0.0829 0.0376 -0.0672 213 GLU A CG +3361 C CD . GLU A 214 ? 0.5902 0.1966 0.3660 -0.0834 0.0404 -0.0807 213 GLU A CD +3362 O OE1 . GLU A 214 ? 0.5816 0.1978 0.3627 -0.0736 0.0445 -0.0893 213 GLU A OE1 +3363 O OE2 . GLU A 214 ? 0.6112 0.2068 0.3782 -0.0938 0.0386 -0.0830 213 GLU A OE2 +3370 N N . LYS A 215 ? 0.6719 0.2135 0.4311 -0.0908 0.0299 -0.0672 214 LYS A N +3371 C CA . LYS A 215 ? 0.6805 0.2129 0.4315 -0.1071 0.0271 -0.0610 214 LYS A CA +3372 C C . LYS A 215 ? 0.6708 0.2316 0.4237 -0.1227 0.0278 -0.0575 214 LYS A C +3373 O O . LYS A 215 ? 0.6727 0.2368 0.4235 -0.1356 0.0258 -0.0495 214 LYS A O +3374 C CB . LYS A 215 ? 0.7176 0.2248 0.4601 -0.1089 0.0259 -0.0709 214 LYS A CB +3375 C CG . LYS A 215 ? 0.8419 0.3192 0.5829 -0.0936 0.0239 -0.0743 214 LYS A CG +3380 N N . ARG A 216 ? 0.6317 0.2139 0.3888 -0.1212 0.0305 -0.0638 215 ARG A N +3381 C CA . ARG A 216 ? 0.6085 0.2179 0.3679 -0.1339 0.0300 -0.0605 215 ARG A CA +3382 C C . ARG A 216 ? 0.5793 0.2082 0.3475 -0.1338 0.0293 -0.0493 215 ARG A C +3383 O O . ARG A 216 ? 0.5722 0.1968 0.3448 -0.1225 0.0301 -0.0454 215 ARG A O +3384 C CB . ARG A 216 ? 0.5957 0.2207 0.3552 -0.1322 0.0327 -0.0697 215 ARG A CB +3385 C CG . ARG A 216 ? 0.6242 0.2344 0.3743 -0.1350 0.0332 -0.0811 215 ARG A CG +3386 C CD . ARG A 216 ? 0.6569 0.2810 0.4062 -0.1307 0.0370 -0.0902 215 ARG A CD +3387 N NE . ARG A 216 ? 0.7574 0.3803 0.5134 -0.1149 0.0410 -0.0935 215 ARG A NE +3388 C CZ . ARG A 216 ? 0.8553 0.4879 0.6119 -0.1082 0.0458 -0.1025 215 ARG A CZ +3389 N NH1 . ARG A 216 ? 0.8188 0.4616 0.5679 -0.1162 0.0471 -0.1082 215 ARG A NH1 +3390 N NH2 . ARG A 216 ? 0.8270 0.4604 0.5919 -0.0935 0.0492 -0.1057 215 ARG A NH2 +3404 N N . ASP A 217 ? 0.5639 0.2148 0.3349 -0.1460 0.0273 -0.0448 216 ASP A N +3405 C CA . ASP A 217 ? 0.5355 0.2089 0.3160 -0.1467 0.0262 -0.0356 216 ASP A CA +3406 C C . ASP A 217 ? 0.5091 0.1977 0.2960 -0.1368 0.0282 -0.0382 216 ASP A C +3407 O O . ASP A 217 ? 0.5037 0.2017 0.2888 -0.1382 0.0290 -0.0449 216 ASP A O +3408 C CB . ASP A 217 ? 0.5274 0.2225 0.3106 -0.1612 0.0231 -0.0330 216 ASP A CB +3409 C CG . ASP A 217 ? 0.5174 0.2318 0.3100 -0.1639 0.0217 -0.0233 216 ASP A CG +3410 O OD1 . ASP A 217 ? 0.5006 0.2102 0.2962 -0.1550 0.0231 -0.0179 216 ASP A OD1 +3411 O OD2 . ASP A 217 ? 0.5002 0.2348 0.2971 -0.1747 0.0190 -0.0216 216 ASP A OD2 +3416 N N . HIS A 218 ? 0.4947 0.1851 0.2881 -0.1272 0.0291 -0.0330 217 HIS A N +3417 C CA . HIS A 218 ? 0.4747 0.1748 0.2739 -0.1167 0.0317 -0.0366 217 HIS A CA +3418 C C . HIS A 218 ? 0.4534 0.1637 0.2616 -0.1105 0.0310 -0.0284 217 HIS A C +3419 O O . HIS A 218 ? 0.4562 0.1644 0.2651 -0.1132 0.0290 -0.0199 217 HIS A O +3420 C CB . HIS A 218 ? 0.4930 0.1718 0.2884 -0.1047 0.0351 -0.0452 217 HIS A CB +3421 C CG . HIS A 218 ? 0.5088 0.1660 0.3036 -0.0951 0.0343 -0.0412 217 HIS A CG +3422 N ND1 . HIS A 218 ? 0.5344 0.1723 0.3217 -0.1006 0.0317 -0.0370 217 HIS A ND1 +3423 C CD2 . HIS A 218 ? 0.5040 0.1562 0.3042 -0.0804 0.0351 -0.0401 217 HIS A CD2 +3424 C CE1 . HIS A 218 ? 0.5461 0.1666 0.3330 -0.0896 0.0307 -0.0330 217 HIS A CE1 +3425 N NE2 . HIS A 218 ? 0.5278 0.1569 0.3228 -0.0766 0.0324 -0.0350 217 HIS A NE2 +3434 N N . MET A 219 ? 0.4342 0.1554 0.2487 -0.1024 0.0331 -0.0314 218 MET A N +3435 C CA . MET A 219 ? 0.4256 0.1564 0.2491 -0.0951 0.0326 -0.0252 218 MET A CA +3436 C C . MET A 219 ? 0.4085 0.1370 0.2360 -0.0821 0.0366 -0.0325 218 MET A C +3437 O O . MET A 219 ? 0.4030 0.1405 0.2306 -0.0832 0.0392 -0.0400 218 MET A O +3438 C CB . MET A 219 ? 0.4099 0.1684 0.2409 -0.1031 0.0296 -0.0201 218 MET A CB +3439 C CG . MET A 219 ? 0.4370 0.2094 0.2791 -0.0944 0.0290 -0.0148 218 MET A CG +3440 S SD . MET A 219 ? 0.3585 0.1656 0.2116 -0.1014 0.0240 -0.0090 218 MET A SD +3441 C CE . MET A 219 ? 0.3648 0.1815 0.2156 -0.1059 0.0237 -0.0168 218 MET A CE +3451 N N . VAL A 220 ? 0.4115 0.1294 0.2424 -0.0692 0.0369 -0.0304 219 VAL A N +3452 C CA . VAL A 220 ? 0.3981 0.1281 0.2408 -0.0536 0.0393 -0.0357 219 VAL A CA +3453 C C . VAL A 220 ? 0.3668 0.1255 0.2241 -0.0493 0.0365 -0.0279 219 VAL A C +3454 O O . VAL A 220 ? 0.3625 0.1236 0.2208 -0.0503 0.0327 -0.0182 219 VAL A O +3455 C CB . VAL A 220 ? 0.4187 0.1265 0.2603 -0.0385 0.0396 -0.0387 219 VAL A CB +3456 C CG1 . VAL A 220 ? 0.4027 0.1282 0.2600 -0.0221 0.0417 -0.0446 219 VAL A CG1 +3457 C CG2 . VAL A 220 ? 0.4497 0.1329 0.2797 -0.0407 0.0413 -0.0471 219 VAL A CG2 +3467 N N . LEU A 221 ? 0.3540 0.1337 0.2220 -0.0447 0.0385 -0.0326 220 LEU A N +3468 C CA . LEU A 221 ? 0.3188 0.1252 0.1996 -0.0428 0.0355 -0.0265 220 LEU A CA +3469 C C . LEU A 221 ? 0.3380 0.1583 0.2329 -0.0292 0.0375 -0.0313 220 LEU A C +3470 O O . LEU A 221 ? 0.3132 0.1340 0.2092 -0.0271 0.0427 -0.0406 220 LEU A O +3471 C CB . LEU A 221 ? 0.3425 0.1631 0.2210 -0.0559 0.0344 -0.0259 220 LEU A CB +3472 C CG . LEU A 221 ? 0.4049 0.2516 0.2959 -0.0541 0.0308 -0.0211 220 LEU A CG +3473 C CD1 . LEU A 221 ? 0.3759 0.2299 0.2722 -0.0520 0.0259 -0.0121 220 LEU A CD1 +3474 C CD2 . LEU A 221 ? 0.4093 0.2656 0.2957 -0.0657 0.0290 -0.0215 220 LEU A CD2 +3486 N N . LEU A 222 ? 0.3011 0.1339 0.2068 -0.0207 0.0338 -0.0255 221 LEU A N +3487 C CA . LEU A 222 ? 0.2862 0.1362 0.2072 -0.0094 0.0346 -0.0296 221 LEU A CA +3488 C C . LEU A 222 ? 0.2603 0.1322 0.1900 -0.0118 0.0302 -0.0232 221 LEU A C +3489 O O . LEU A 222 ? 0.3227 0.1966 0.2519 -0.0114 0.0255 -0.0152 221 LEU A O +3490 C CB . LEU A 222 ? 0.2901 0.1327 0.2164 0.0064 0.0329 -0.0303 221 LEU A CB +3491 C CG . LEU A 222 ? 0.2669 0.1309 0.2114 0.0182 0.0323 -0.0341 221 LEU A CG +3492 C CD1 . LEU A 222 ? 0.3162 0.1892 0.2679 0.0181 0.0389 -0.0453 221 LEU A CD1 +3493 C CD2 . LEU A 222 ? 0.3339 0.1907 0.2824 0.0343 0.0283 -0.0335 221 LEU A CD2 +3505 N N . GLU A 223 ? 0.2367 0.1247 0.1741 -0.0139 0.0318 -0.0267 222 GLU A N +3506 C CA . GLU A 223 ? 0.2229 0.1287 0.1668 -0.0171 0.0269 -0.0212 222 GLU A CA +3507 C C . GLU A 223 ? 0.2025 0.1251 0.1605 -0.0115 0.0275 -0.0251 222 GLU A C +3508 O O . GLU A 223 ? 0.2414 0.1649 0.2016 -0.0117 0.0333 -0.0325 222 GLU A O +3509 C CB . GLU A 223 ? 0.2660 0.1702 0.1994 -0.0311 0.0263 -0.0195 222 GLU A CB +3510 C CG . GLU A 223 ? 0.3118 0.2315 0.2499 -0.0348 0.0203 -0.0144 222 GLU A CG +3511 C CD . GLU A 223 ? 0.4997 0.4160 0.4261 -0.0477 0.0184 -0.0128 222 GLU A CD +3512 O OE1 . GLU A 223 ? 0.5405 0.4482 0.4588 -0.0532 0.0177 -0.0108 222 GLU A OE1 +3513 O OE2 . GLU A 223 ? 0.4663 0.3878 0.3911 -0.0526 0.0171 -0.0135 222 GLU A OE2 +3520 N N . PHE A 224 ? 0.1910 0.1275 0.1583 -0.0074 0.0219 -0.0207 223 PHE A N +3521 C CA . PHE A 224 ? 0.1731 0.1255 0.1541 -0.0033 0.0210 -0.0237 223 PHE A CA +3522 C C . PHE A 224 ? 0.2355 0.1971 0.2173 -0.0093 0.0155 -0.0191 223 PHE A C +3523 O O . PHE A 224 ? 0.2047 0.1687 0.1848 -0.0090 0.0102 -0.0134 223 PHE A O +3524 C CB . PHE A 224 ? 0.1744 0.1348 0.1675 0.0104 0.0180 -0.0244 223 PHE A CB +3525 C CG . PHE A 224 ? 0.1793 0.1316 0.1736 0.0189 0.0218 -0.0296 223 PHE A CG +3526 C CD1 . PHE A 224 ? 0.1982 0.1585 0.2035 0.0230 0.0262 -0.0384 223 PHE A CD1 +3527 C CD2 . PHE A 224 ? 0.2076 0.1432 0.1914 0.0219 0.0211 -0.0262 223 PHE A CD2 +3528 C CE1 . PHE A 224 ? 0.1985 0.1521 0.2061 0.0326 0.0292 -0.0446 223 PHE A CE1 +3529 C CE2 . PHE A 224 ? 0.2628 0.1877 0.2466 0.0308 0.0236 -0.0313 223 PHE A CE2 +3530 C CZ . PHE A 224 ? 0.2076 0.1420 0.2038 0.0370 0.0273 -0.0409 223 PHE A CZ +3540 N N . VAL A 225 ? 0.2031 0.1701 0.1879 -0.0143 0.0169 -0.0218 224 VAL A N +3541 C CA . VAL A 225 ? 0.1757 0.1475 0.1595 -0.0200 0.0111 -0.0178 224 VAL A CA +3542 C C . VAL A 225 ? 0.2066 0.1881 0.2018 -0.0184 0.0107 -0.0209 224 VAL A C +3543 O O . VAL A 225 ? 0.2003 0.1820 0.1971 -0.0218 0.0173 -0.0260 224 VAL A O +3544 C CB . VAL A 225 ? 0.2315 0.1935 0.2002 -0.0322 0.0124 -0.0163 224 VAL A CB +3545 C CG1 . VAL A 225 ? 0.2167 0.1820 0.1837 -0.0365 0.0044 -0.0117 224 VAL A CG1 +3546 C CG2 . VAL A 225 ? 0.2852 0.2375 0.2432 -0.0351 0.0134 -0.0146 224 VAL A CG2 +3556 N N . THR A 226 ? 0.1643 0.1544 0.1677 -0.0137 0.0033 -0.0186 225 THR A N +3557 C CA . THR A 226 ? 0.1358 0.1344 0.1508 -0.0123 0.0016 -0.0217 225 THR A CA +3558 C C . THR A 226 ? 0.1745 0.1732 0.1884 -0.0149 -0.0069 -0.0178 225 THR A C +3559 O O . THR A 226 ? 0.1774 0.1793 0.1917 -0.0098 -0.0136 -0.0146 225 THR A O +3560 C CB . THR A 226 ? 0.2109 0.2212 0.2408 0.0002 -0.0001 -0.0252 225 THR A CB +3561 O OG1 . THR A 226 ? 0.2696 0.2793 0.3016 0.0042 0.0067 -0.0294 225 THR A OG1 +3562 C CG2 . THR A 226 ? 0.2357 0.2556 0.2785 0.0007 -0.0025 -0.0292 225 THR A CG2 +3570 N N . ALA A 227 ? 0.1651 0.1598 0.1772 -0.0229 -0.0066 -0.0182 226 ALA A N +3571 C CA . ALA A 227 ? 0.1763 0.1674 0.1864 -0.0248 -0.0158 -0.0147 226 ALA A CA +3572 C C . ALA A 227 ? 0.1248 0.1259 0.1500 -0.0161 -0.0217 -0.0177 226 ALA A C +3573 O O . ALA A 227 ? 0.1467 0.1562 0.1835 -0.0131 -0.0180 -0.0228 226 ALA A O +3574 C CB . ALA A 227 ? 0.1501 0.1298 0.1500 -0.0374 -0.0140 -0.0130 226 ALA A CB +3580 N N . ALA A 228 ? 0.1202 0.1216 0.1458 -0.0115 -0.0314 -0.0154 227 ALA A N +3581 C CA . ALA A 228 ? 0.1503 0.1598 0.1885 -0.0033 -0.0379 -0.0190 227 ALA A CA +3582 C C . ALA A 228 ? 0.1177 0.1211 0.1522 -0.0022 -0.0485 -0.0166 227 ALA A C +3583 O O . ALA A 228 ? 0.1275 0.1199 0.1499 -0.0084 -0.0508 -0.0119 227 ALA A O +3584 C CB . ALA A 228 ? 0.1972 0.2208 0.2437 0.0083 -0.0377 -0.0213 227 ALA A CB +3590 N N . GLY A 229 ? 0.1186 0.1287 0.1634 0.0063 -0.0557 -0.0205 228 GLY A N +3591 C CA . GLY A 229 ? 0.1783 0.1840 0.2213 0.0103 -0.0666 -0.0197 228 GLY A CA +3592 C C . GLY A 229 ? 0.2809 0.2715 0.3224 0.0051 -0.0724 -0.0202 228 GLY A C +3593 O O . GLY A 229 ? 0.2307 0.2132 0.2695 0.0084 -0.0826 -0.0196 228 GLY A O +3597 N N . ILE A 230 ? 0.1686 0.1554 0.2120 -0.0033 -0.0660 -0.0214 229 ILE A N +3598 C CA . ILE A 230 ? 0.1887 0.1620 0.2321 -0.0101 -0.0701 -0.0223 229 ILE A CA +3599 C C . ILE A 230 ? 0.1927 0.1788 0.2518 -0.0085 -0.0663 -0.0296 229 ILE A C +3600 O O . ILE A 230 ? 0.2458 0.2425 0.3099 -0.0112 -0.0564 -0.0314 229 ILE A O +3601 C CB . ILE A 230 ? 0.2617 0.2177 0.2901 -0.0254 -0.0652 -0.0163 229 ILE A CB +3602 C CG1 . ILE A 230 ? 0.3068 0.2489 0.3194 -0.0254 -0.0727 -0.0095 229 ILE A CG1 +3603 C CG2 . ILE A 230 ? 0.2994 0.2428 0.3284 -0.0354 -0.0665 -0.0173 229 ILE A CG2 +3604 C CD1 . ILE A 230 ? 0.3042 0.2285 0.2983 -0.0396 -0.0692 -0.0027 229 ILE A CD1 +3616 N N . THR A 231 ? 0.2311 0.2165 0.2985 -0.0030 -0.0750 -0.0345 230 THR A N +3617 C CA . THR A 231 ? 0.3502 0.3508 0.4339 0.0018 -0.0743 -0.0427 230 THR A CA +3618 C C . THR A 231 ? 0.3750 0.3748 0.4641 -0.0108 -0.0674 -0.0451 230 THR A C +3619 O O . THR A 231 ? 0.4379 0.4201 0.5188 -0.0235 -0.0675 -0.0416 230 THR A O +3620 C CB . THR A 231 ? 0.4494 0.4472 0.5387 0.0103 -0.0864 -0.0481 230 THR A CB +3621 O OG1 . THR A 231 ? 0.6313 0.6380 0.7186 0.0239 -0.0892 -0.0479 230 THR A OG1 +3622 C CG2 . THR A 231 ? 0.3779 0.3875 0.4830 0.0119 -0.0871 -0.0572 230 THR A CG2 +3630 N N . LEU A 232 ? 0.4564 0.4759 0.5592 -0.0071 -0.0618 -0.0512 231 LEU A N +3631 C CA . LEU A 232 ? 0.4621 0.4882 0.5751 -0.0173 -0.0549 -0.0559 231 LEU A CA +3632 C C . LEU A 232 ? 0.5315 0.5624 0.6584 -0.0159 -0.0622 -0.0641 231 LEU A C +3633 O O . LEU A 232 ? 0.6203 0.6347 0.7437 -0.0244 -0.0675 -0.0636 231 LEU A O +3634 C CB . LEU A 232 ? 0.4156 0.4616 0.5369 -0.0123 -0.0457 -0.0589 231 LEU A CB +3635 C CG . LEU A 232 ? 0.5174 0.5779 0.6534 -0.0198 -0.0378 -0.0660 231 LEU A CG +3636 C CD1 . LEU A 232 ? 0.5275 0.5756 0.6586 -0.0392 -0.0329 -0.0642 231 LEU A CD1 +3637 C CD2 . LEU A 232 ? 0.5225 0.5964 0.6613 -0.0146 -0.0285 -0.0670 231 LEU A CD2 +# diff --git a/tests/resources/5imm.cif b/tests/resources/5imm.cif new file mode 100644 index 0000000..0b5be95 --- /dev/null +++ b/tests/resources/5imm.cif @@ -0,0 +1,7330 @@ +data_5IMM +# +_entry.id 5IMM +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.398 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 5IMM pdb_00005imm 10.2210/pdb5imm/pdb +WWPDB D_1000219085 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2017-01-11 +2 'Structure model' 1 1 2017-07-05 +3 'Structure model' 1 2 2024-11-20 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Data collection' +2 2 'Structure model' 'Database references' +3 3 'Structure model' 'Data collection' +4 3 'Structure model' 'Database references' +5 3 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 2 'Structure model' citation +2 2 'Structure model' diffrn_detector +3 3 'Structure model' chem_comp_atom +4 3 'Structure model' chem_comp_bond +5 3 'Structure model' database_2 +6 3 'Structure model' pdbx_entry_details +7 3 'Structure model' pdbx_modification_feature +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 2 'Structure model' '_citation.journal_volume' +2 2 'Structure model' '_citation.page_first' +3 2 'Structure model' '_citation.page_last' +4 2 'Structure model' '_citation.year' +5 2 'Structure model' '_diffrn_detector.detector' +6 3 'Structure model' '_database_2.pdbx_DOI' +7 3 'Structure model' '_database_2.pdbx_database_accession' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.entry_id 5IMM +_pdbx_database_status.recvd_initial_deposition_date 2016-03-06 +_pdbx_database_status.SG_entry N +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site PDBJ +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_pdbx_database_related.content_type +_pdbx_database_related.db_id +_pdbx_database_related.db_name +_pdbx_database_related.details +unspecified 5IMK PDB . +unspecified 5IML PDB . +unspecified 5IMO PDB . +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Wen, Y.' 1 +'Zheng, F.' 2 +# +_citation.abstract ? +_citation.abstract_id_CAS ? +_citation.book_id_ISBN ? +_citation.book_publisher ? +_citation.book_publisher_city ? +_citation.book_title ? +_citation.coordinate_linkage ? +_citation.country GE +_citation.database_id_Medline ? +_citation.details ? +_citation.id primary +_citation.journal_abbrev Immunobiology +_citation.journal_id_ASTM ? +_citation.journal_id_CSD ? +_citation.journal_id_ISSN 1878-3279 +_citation.journal_full ? +_citation.journal_issue ? +_citation.journal_volume 222 +_citation.language ? +_citation.page_first 807 +_citation.page_last 813 +_citation.title +'Structural evaluation of a nanobody targeting complement receptor Vsig4 and its cross reactivity' +_citation.year 2017 +_citation.database_id_CSD ? +_citation.pdbx_database_id_DOI 10.1016/j.imbio.2016.11.008 +_citation.pdbx_database_id_PubMed 27889311 +_citation.unpublished_flag ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Wen, Y.' 1 ? +primary 'Ouyang, Z.' 2 ? +primary 'Schoonooghe, S.' 3 ? +primary 'Luo, S.' 4 ? +primary 'De Baetselier, P.' 5 ? +primary 'Lu, W.' 6 ? +primary 'Muyldermans, S.' 7 ? +primary 'Raes, G.' 8 ? +primary 'Zheng, F.' 9 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man Nanobody 14599.001 1 ? ? ? ? +2 polymer man 'Protein Vsig4' 14867.874 1 ? ? 'IgV domain, UNP residues 19-139' ? +3 water nat water 18.015 436 ? ? ? ? +# +loop_ +_entity_poly.entity_id +_entity_poly.type +_entity_poly.nstd_linkage +_entity_poly.nstd_monomer +_entity_poly.pdbx_seq_one_letter_code +_entity_poly.pdbx_seq_one_letter_code_can +_entity_poly.pdbx_strand_id +_entity_poly.pdbx_target_identifier +1 'polypeptide(L)' no no +;QVQLVESGGGLVQAGGSLRLSCAASGRTFSSYGMGWFRQAPGKEREFVAAIRWNGGSTYYADSVKGRFTISRDNAKNTVY +LQMNSLKPEDTAVYYCAAGRWDKYGSSFQDEYDYWGQGTQVTVSSHHHHHH +; +;QVQLVESGGGLVQAGGSLRLSCAASGRTFSSYGMGWFRQAPGKEREFVAAIRWNGGSTYYADSVKGRFTISRDNAKNTVY +LQMNSLKPEDTAVYYCAAGRWDKYGSSFQDEYDYWGQGTQVTVSSHHHHHH +; +B ? +2 'polypeptide(L)' no no +;HHHHHHGHPTLKTPESVTGTWKGDVKIQCIYDPLRGYRQVLVKWLVRHGSDSVTIFLRDSTGDHIQQAKYRGRLKVSHKV +PGDVSLQINTLQMDDRNHYTCEVTWQTPDGNQVIRDKIIELRVRKYN +; +;HHHHHHGHPTLKTPESVTGTWKGDVKIQCIYDPLRGYRQVLVKWLVRHGSDSVTIFLRDSTGDHIQQAKYRGRLKVSHKV +PGDVSLQINTLQMDDRNHYTCEVTWQTPDGNQVIRDKIIELRVRKYN +; +A ? +# +_pdbx_entity_nonpoly.entity_id 3 +_pdbx_entity_nonpoly.name water +_pdbx_entity_nonpoly.comp_id HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 GLN n +1 2 VAL n +1 3 GLN n +1 4 LEU n +1 5 VAL n +1 6 GLU n +1 7 SER n +1 8 GLY n +1 9 GLY n +1 10 GLY n +1 11 LEU n +1 12 VAL n +1 13 GLN n +1 14 ALA n +1 15 GLY n +1 16 GLY n +1 17 SER n +1 18 LEU n +1 19 ARG n +1 20 LEU n +1 21 SER n +1 22 CYS n +1 23 ALA n +1 24 ALA n +1 25 SER n +1 26 GLY n +1 27 ARG n +1 28 THR n +1 29 PHE n +1 30 SER n +1 31 SER n +1 32 TYR n +1 33 GLY n +1 34 MET n +1 35 GLY n +1 36 TRP n +1 37 PHE n +1 38 ARG n +1 39 GLN n +1 40 ALA n +1 41 PRO n +1 42 GLY n +1 43 LYS n +1 44 GLU n +1 45 ARG n +1 46 GLU n +1 47 PHE n +1 48 VAL n +1 49 ALA n +1 50 ALA n +1 51 ILE n +1 52 ARG n +1 53 TRP n +1 54 ASN n +1 55 GLY n +1 56 GLY n +1 57 SER n +1 58 THR n +1 59 TYR n +1 60 TYR n +1 61 ALA n +1 62 ASP n +1 63 SER n +1 64 VAL n +1 65 LYS n +1 66 GLY n +1 67 ARG n +1 68 PHE n +1 69 THR n +1 70 ILE n +1 71 SER n +1 72 ARG n +1 73 ASP n +1 74 ASN n +1 75 ALA n +1 76 LYS n +1 77 ASN n +1 78 THR n +1 79 VAL n +1 80 TYR n +1 81 LEU n +1 82 GLN n +1 83 MET n +1 84 ASN n +1 85 SER n +1 86 LEU n +1 87 LYS n +1 88 PRO n +1 89 GLU n +1 90 ASP n +1 91 THR n +1 92 ALA n +1 93 VAL n +1 94 TYR n +1 95 TYR n +1 96 CYS n +1 97 ALA n +1 98 ALA n +1 99 GLY n +1 100 ARG n +1 101 TRP n +1 102 ASP n +1 103 LYS n +1 104 TYR n +1 105 GLY n +1 106 SER n +1 107 SER n +1 108 PHE n +1 109 GLN n +1 110 ASP n +1 111 GLU n +1 112 TYR n +1 113 ASP n +1 114 TYR n +1 115 TRP n +1 116 GLY n +1 117 GLN n +1 118 GLY n +1 119 THR n +1 120 GLN n +1 121 VAL n +1 122 THR n +1 123 VAL n +1 124 SER n +1 125 SER n +1 126 HIS n +1 127 HIS n +1 128 HIS n +1 129 HIS n +1 130 HIS n +1 131 HIS n +2 1 HIS n +2 2 HIS n +2 3 HIS n +2 4 HIS n +2 5 HIS n +2 6 HIS n +2 7 GLY n +2 8 HIS n +2 9 PRO n +2 10 THR n +2 11 LEU n +2 12 LYS n +2 13 THR n +2 14 PRO n +2 15 GLU n +2 16 SER n +2 17 VAL n +2 18 THR n +2 19 GLY n +2 20 THR n +2 21 TRP n +2 22 LYS n +2 23 GLY n +2 24 ASP n +2 25 VAL n +2 26 LYS n +2 27 ILE n +2 28 GLN n +2 29 CYS n +2 30 ILE n +2 31 TYR n +2 32 ASP n +2 33 PRO n +2 34 LEU n +2 35 ARG n +2 36 GLY n +2 37 TYR n +2 38 ARG n +2 39 GLN n +2 40 VAL n +2 41 LEU n +2 42 VAL n +2 43 LYS n +2 44 TRP n +2 45 LEU n +2 46 VAL n +2 47 ARG n +2 48 HIS n +2 49 GLY n +2 50 SER n +2 51 ASP n +2 52 SER n +2 53 VAL n +2 54 THR n +2 55 ILE n +2 56 PHE n +2 57 LEU n +2 58 ARG n +2 59 ASP n +2 60 SER n +2 61 THR n +2 62 GLY n +2 63 ASP n +2 64 HIS n +2 65 ILE n +2 66 GLN n +2 67 GLN n +2 68 ALA n +2 69 LYS n +2 70 TYR n +2 71 ARG n +2 72 GLY n +2 73 ARG n +2 74 LEU n +2 75 LYS n +2 76 VAL n +2 77 SER n +2 78 HIS n +2 79 LYS n +2 80 VAL n +2 81 PRO n +2 82 GLY n +2 83 ASP n +2 84 VAL n +2 85 SER n +2 86 LEU n +2 87 GLN n +2 88 ILE n +2 89 ASN n +2 90 THR n +2 91 LEU n +2 92 GLN n +2 93 MET n +2 94 ASP n +2 95 ASP n +2 96 ARG n +2 97 ASN n +2 98 HIS n +2 99 TYR n +2 100 THR n +2 101 CYS n +2 102 GLU n +2 103 VAL n +2 104 THR n +2 105 TRP n +2 106 GLN n +2 107 THR n +2 108 PRO n +2 109 ASP n +2 110 GLY n +2 111 ASN n +2 112 GLN n +2 113 VAL n +2 114 ILE n +2 115 ARG n +2 116 ASP n +2 117 LYS n +2 118 ILE n +2 119 ILE n +2 120 GLU n +2 121 LEU n +2 122 ARG n +2 123 VAL n +2 124 ARG n +2 125 LYS n +2 126 TYR n +2 127 ASN n +# +loop_ +_entity_src_gen.entity_id +_entity_src_gen.pdbx_src_id +_entity_src_gen.pdbx_alt_source_flag +_entity_src_gen.pdbx_seq_type +_entity_src_gen.pdbx_beg_seq_num +_entity_src_gen.pdbx_end_seq_num +_entity_src_gen.gene_src_common_name +_entity_src_gen.gene_src_genus +_entity_src_gen.pdbx_gene_src_gene +_entity_src_gen.gene_src_species +_entity_src_gen.gene_src_strain +_entity_src_gen.gene_src_tissue +_entity_src_gen.gene_src_tissue_fraction +_entity_src_gen.gene_src_details +_entity_src_gen.pdbx_gene_src_fragment +_entity_src_gen.pdbx_gene_src_scientific_name +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id +_entity_src_gen.pdbx_gene_src_variant +_entity_src_gen.pdbx_gene_src_cell_line +_entity_src_gen.pdbx_gene_src_atcc +_entity_src_gen.pdbx_gene_src_organ +_entity_src_gen.pdbx_gene_src_organelle +_entity_src_gen.pdbx_gene_src_cell +_entity_src_gen.pdbx_gene_src_cellular_location +_entity_src_gen.host_org_common_name +_entity_src_gen.pdbx_host_org_scientific_name +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id +_entity_src_gen.host_org_genus +_entity_src_gen.pdbx_host_org_gene +_entity_src_gen.pdbx_host_org_organ +_entity_src_gen.host_org_species +_entity_src_gen.pdbx_host_org_tissue +_entity_src_gen.pdbx_host_org_tissue_fraction +_entity_src_gen.pdbx_host_org_strain +_entity_src_gen.pdbx_host_org_variant +_entity_src_gen.pdbx_host_org_cell_line +_entity_src_gen.pdbx_host_org_atcc +_entity_src_gen.pdbx_host_org_culture_collection +_entity_src_gen.pdbx_host_org_cell +_entity_src_gen.pdbx_host_org_organelle +_entity_src_gen.pdbx_host_org_cellular_location +_entity_src_gen.pdbx_host_org_vector_type +_entity_src_gen.pdbx_host_org_vector +_entity_src_gen.host_org_details +_entity_src_gen.expression_system_id +_entity_src_gen.plasmid_name +_entity_src_gen.plasmid_details +_entity_src_gen.pdbx_description +1 1 sample 'Biological sequence' 1 131 ? ? ? ? ? ? ? ? ? Camelidae 9835 ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? +? ? ? ? ? ? ? ? ? ? ? plasmid ? ? ? ? ? ? +2 1 sample 'Biological sequence' 1 127 Mouse ? Vsig4 ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? +? ? ? ? ? ? ? ? ? ? ? plasmid ? ? ? ? ? ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 GLN 1 0 0 GLN GLN B . n +A 1 2 VAL 2 1 1 VAL VAL B . n +A 1 3 GLN 3 2 2 GLN GLN B . n +A 1 4 LEU 4 3 3 LEU LEU B . n +A 1 5 VAL 5 4 4 VAL VAL B . n +A 1 6 GLU 6 5 5 GLU GLU B . n +A 1 7 SER 7 6 6 SER SER B . n +A 1 8 GLY 8 7 7 GLY GLY B . n +A 1 9 GLY 9 8 8 GLY GLY B . n +A 1 10 GLY 10 9 9 GLY GLY B . n +A 1 11 LEU 11 10 10 LEU LEU B . n +A 1 12 VAL 12 11 11 VAL VAL B . n +A 1 13 GLN 13 12 12 GLN GLN B . n +A 1 14 ALA 14 13 13 ALA ALA B . n +A 1 15 GLY 15 14 14 GLY GLY B . n +A 1 16 GLY 16 15 15 GLY GLY B . n +A 1 17 SER 17 16 16 SER SER B . n +A 1 18 LEU 18 17 17 LEU LEU B . n +A 1 19 ARG 19 18 18 ARG ARG B . n +A 1 20 LEU 20 19 19 LEU LEU B . n +A 1 21 SER 21 20 20 SER SER B . n +A 1 22 CYS 22 21 21 CYS CYS B . n +A 1 23 ALA 23 22 22 ALA ALA B . n +A 1 24 ALA 24 23 23 ALA ALA B . n +A 1 25 SER 25 24 24 SER SER B . n +A 1 26 GLY 26 25 25 GLY GLY B . n +A 1 27 ARG 27 26 26 ARG ARG B . n +A 1 28 THR 28 27 27 THR THR B . n +A 1 29 PHE 29 28 28 PHE PHE B . n +A 1 30 SER 30 29 29 SER SER B . n +A 1 31 SER 31 30 30 SER SER B . n +A 1 32 TYR 32 31 31 TYR TYR B . n +A 1 33 GLY 33 32 32 GLY GLY B . n +A 1 34 MET 34 33 33 MET MET B . n +A 1 35 GLY 35 34 34 GLY GLY B . n +A 1 36 TRP 36 35 35 TRP TRP B . n +A 1 37 PHE 37 36 36 PHE PHE B . n +A 1 38 ARG 38 37 37 ARG ARG B . n +A 1 39 GLN 39 38 38 GLN GLN B . n +A 1 40 ALA 40 39 39 ALA ALA B . n +A 1 41 PRO 41 40 40 PRO PRO B . n +A 1 42 GLY 42 41 41 GLY GLY B . n +A 1 43 LYS 43 42 42 LYS LYS B . n +A 1 44 GLU 44 43 43 GLU GLU B . n +A 1 45 ARG 45 44 44 ARG ARG B . n +A 1 46 GLU 46 45 45 GLU GLU B . n +A 1 47 PHE 47 46 46 PHE PHE B . n +A 1 48 VAL 48 47 47 VAL VAL B . n +A 1 49 ALA 49 48 48 ALA ALA B . n +A 1 50 ALA 50 49 49 ALA ALA B . n +A 1 51 ILE 51 50 50 ILE ILE B . n +A 1 52 ARG 52 51 51 ARG ARG B . n +A 1 53 TRP 53 52 52 TRP TRP B . n +A 1 54 ASN 54 53 53 ASN ASN B . n +A 1 55 GLY 55 54 54 GLY GLY B . n +A 1 56 GLY 56 55 55 GLY GLY B . n +A 1 57 SER 57 56 56 SER SER B . n +A 1 58 THR 58 57 57 THR THR B . n +A 1 59 TYR 59 58 58 TYR TYR B . n +A 1 60 TYR 60 59 59 TYR TYR B . n +A 1 61 ALA 61 60 60 ALA ALA B . n +A 1 62 ASP 62 61 61 ASP ASP B . n +A 1 63 SER 63 62 62 SER SER B . n +A 1 64 VAL 64 63 63 VAL VAL B . n +A 1 65 LYS 65 64 64 LYS LYS B . n +A 1 66 GLY 66 65 65 GLY GLY B . n +A 1 67 ARG 67 66 66 ARG ARG B . n +A 1 68 PHE 68 67 67 PHE PHE B . n +A 1 69 THR 69 68 68 THR THR B . n +A 1 70 ILE 70 69 69 ILE ILE B . n +A 1 71 SER 71 70 70 SER SER B . n +A 1 72 ARG 72 71 71 ARG ARG B . n +A 1 73 ASP 73 72 72 ASP ASP B . n +A 1 74 ASN 74 73 73 ASN ASN B . n +A 1 75 ALA 75 74 74 ALA ALA B . n +A 1 76 LYS 76 75 75 LYS LYS B . n +A 1 77 ASN 77 76 76 ASN ASN B . n +A 1 78 THR 78 77 77 THR THR B . n +A 1 79 VAL 79 78 78 VAL VAL B . n +A 1 80 TYR 80 79 79 TYR TYR B . n +A 1 81 LEU 81 80 80 LEU LEU B . n +A 1 82 GLN 82 81 81 GLN GLN B . n +A 1 83 MET 83 82 82 MET MET B . n +A 1 84 ASN 84 83 83 ASN ASN B . n +A 1 85 SER 85 84 84 SER SER B . n +A 1 86 LEU 86 85 85 LEU LEU B . n +A 1 87 LYS 87 86 86 LYS LYS B . n +A 1 88 PRO 88 87 87 PRO PRO B . n +A 1 89 GLU 89 88 88 GLU GLU B . n +A 1 90 ASP 90 89 89 ASP ASP B . n +A 1 91 THR 91 90 90 THR THR B . n +A 1 92 ALA 92 91 91 ALA ALA B . n +A 1 93 VAL 93 92 92 VAL VAL B . n +A 1 94 TYR 94 93 93 TYR TYR B . n +A 1 95 TYR 95 94 94 TYR TYR B . n +A 1 96 CYS 96 95 95 CYS CYS B . n +A 1 97 ALA 97 96 96 ALA ALA B . n +A 1 98 ALA 98 97 97 ALA ALA B . n +A 1 99 GLY 99 98 98 GLY GLY B . n +A 1 100 ARG 100 99 99 ARG ARG B . n +A 1 101 TRP 101 100 100 TRP TRP B . n +A 1 102 ASP 102 101 101 ASP ASP B . n +A 1 103 LYS 103 102 102 LYS LYS B . n +A 1 104 TYR 104 103 103 TYR TYR B . n +A 1 105 GLY 105 104 104 GLY GLY B . n +A 1 106 SER 106 105 105 SER SER B . n +A 1 107 SER 107 106 106 SER SER B . n +A 1 108 PHE 108 107 107 PHE PHE B . n +A 1 109 GLN 109 108 108 GLN GLN B . n +A 1 110 ASP 110 109 109 ASP ASP B . n +A 1 111 GLU 111 110 110 GLU GLU B . n +A 1 112 TYR 112 111 111 TYR TYR B . n +A 1 113 ASP 113 112 112 ASP ASP B . n +A 1 114 TYR 114 113 113 TYR TYR B . n +A 1 115 TRP 115 114 114 TRP TRP B . n +A 1 116 GLY 116 115 115 GLY GLY B . n +A 1 117 GLN 117 116 116 GLN GLN B . n +A 1 118 GLY 118 117 117 GLY GLY B . n +A 1 119 THR 119 118 118 THR THR B . n +A 1 120 GLN 120 119 119 GLN GLN B . n +A 1 121 VAL 121 120 120 VAL VAL B . n +A 1 122 THR 122 121 121 THR THR B . n +A 1 123 VAL 123 122 122 VAL VAL B . n +A 1 124 SER 124 123 123 SER SER B . n +A 1 125 SER 125 124 124 SER SER B . n +A 1 126 HIS 126 125 ? ? ? B . n +A 1 127 HIS 127 126 ? ? ? B . n +A 1 128 HIS 128 127 ? ? ? B . n +A 1 129 HIS 129 128 ? ? ? B . n +A 1 130 HIS 130 129 ? ? ? B . n +A 1 131 HIS 131 130 ? ? ? B . n +B 2 1 HIS 1 -7 ? ? ? A . n +B 2 2 HIS 2 -6 ? ? ? A . n +B 2 3 HIS 3 -5 ? ? ? A . n +B 2 4 HIS 4 -4 ? ? ? A . n +B 2 5 HIS 5 -3 ? ? ? A . n +B 2 6 HIS 6 -2 ? ? ? A . n +B 2 7 GLY 7 -1 ? ? ? A . n +B 2 8 HIS 8 0 0 HIS HIS A . n +B 2 9 PRO 9 1 1 PRO PRO A . n +B 2 10 THR 10 2 2 THR THR A . n +B 2 11 LEU 11 3 3 LEU LEU A . n +B 2 12 LYS 12 4 4 LYS LYS A . n +B 2 13 THR 13 5 5 THR THR A . n +B 2 14 PRO 14 6 6 PRO PRO A . n +B 2 15 GLU 15 7 7 GLU GLU A . n +B 2 16 SER 16 8 8 SER SER A . n +B 2 17 VAL 17 9 9 VAL VAL A . n +B 2 18 THR 18 10 10 THR THR A . n +B 2 19 GLY 19 11 11 GLY GLY A . n +B 2 20 THR 20 12 12 THR THR A . n +B 2 21 TRP 21 13 13 TRP TRP A . n +B 2 22 LYS 22 14 14 LYS LYS A . n +B 2 23 GLY 23 15 15 GLY GLY A . n +B 2 24 ASP 24 16 16 ASP ASP A . n +B 2 25 VAL 25 17 17 VAL VAL A . n +B 2 26 LYS 26 18 18 LYS LYS A . n +B 2 27 ILE 27 19 19 ILE ILE A . n +B 2 28 GLN 28 20 20 GLN GLN A . n +B 2 29 CYS 29 21 21 CYS CYS A . n +B 2 30 ILE 30 22 22 ILE ILE A . n +B 2 31 TYR 31 23 23 TYR TYR A . n +B 2 32 ASP 32 24 24 ASP ASP A . n +B 2 33 PRO 33 25 25 PRO PRO A . n +B 2 34 LEU 34 26 26 LEU LEU A . n +B 2 35 ARG 35 27 27 ARG ARG A . n +B 2 36 GLY 36 28 28 GLY GLY A . n +B 2 37 TYR 37 29 29 TYR TYR A . n +B 2 38 ARG 38 30 30 ARG ARG A . n +B 2 39 GLN 39 31 31 GLN GLN A . n +B 2 40 VAL 40 32 32 VAL VAL A . n +B 2 41 LEU 41 33 33 LEU LEU A . n +B 2 42 VAL 42 34 34 VAL VAL A . n +B 2 43 LYS 43 35 35 LYS LYS A . n +B 2 44 TRP 44 36 36 TRP TRP A . n +B 2 45 LEU 45 37 37 LEU LEU A . n +B 2 46 VAL 46 38 38 VAL VAL A . n +B 2 47 ARG 47 39 39 ARG ARG A . n +B 2 48 HIS 48 40 40 HIS HIS A . n +B 2 49 GLY 49 41 41 GLY GLY A . n +B 2 50 SER 50 42 42 SER SER A . n +B 2 51 ASP 51 43 43 ASP ASP A . n +B 2 52 SER 52 44 44 SER SER A . n +B 2 53 VAL 53 45 45 VAL VAL A . n +B 2 54 THR 54 46 46 THR THR A . n +B 2 55 ILE 55 47 47 ILE ILE A . n +B 2 56 PHE 56 48 48 PHE PHE A . n +B 2 57 LEU 57 49 49 LEU LEU A . n +B 2 58 ARG 58 50 50 ARG ARG A . n +B 2 59 ASP 59 51 51 ASP ASP A . n +B 2 60 SER 60 52 52 SER SER A . n +B 2 61 THR 61 53 53 THR THR A . n +B 2 62 GLY 62 54 54 GLY GLY A . n +B 2 63 ASP 63 55 55 ASP ASP A . n +B 2 64 HIS 64 56 56 HIS HIS A . n +B 2 65 ILE 65 57 57 ILE ILE A . n +B 2 66 GLN 66 58 58 GLN GLN A . n +B 2 67 GLN 67 59 59 GLN GLN A . n +B 2 68 ALA 68 60 60 ALA ALA A . n +B 2 69 LYS 69 61 61 LYS LYS A . n +B 2 70 TYR 70 62 62 TYR TYR A . n +B 2 71 ARG 71 63 63 ARG ARG A . n +B 2 72 GLY 72 64 64 GLY GLY A . n +B 2 73 ARG 73 65 65 ARG ARG A . n +B 2 74 LEU 74 66 66 LEU LEU A . n +B 2 75 LYS 75 67 67 LYS LYS A . n +B 2 76 VAL 76 68 68 VAL VAL A . n +B 2 77 SER 77 69 69 SER SER A . n +B 2 78 HIS 78 70 70 HIS HIS A . n +B 2 79 LYS 79 71 71 LYS LYS A . n +B 2 80 VAL 80 72 72 VAL VAL A . n +B 2 81 PRO 81 73 73 PRO PRO A . n +B 2 82 GLY 82 74 74 GLY GLY A . n +B 2 83 ASP 83 75 75 ASP ASP A . n +B 2 84 VAL 84 76 76 VAL VAL A . n +B 2 85 SER 85 77 77 SER SER A . n +B 2 86 LEU 86 78 78 LEU LEU A . n +B 2 87 GLN 87 79 79 GLN GLN A . n +B 2 88 ILE 88 80 80 ILE ILE A . n +B 2 89 ASN 89 81 81 ASN ASN A . n +B 2 90 THR 90 82 82 THR THR A . n +B 2 91 LEU 91 83 83 LEU LEU A . n +B 2 92 GLN 92 84 84 GLN GLN A . n +B 2 93 MET 93 85 85 MET MET A . n +B 2 94 ASP 94 86 86 ASP ASP A . n +B 2 95 ASP 95 87 87 ASP ASP A . n +B 2 96 ARG 96 88 88 ARG ARG A . n +B 2 97 ASN 97 89 89 ASN ASN A . n +B 2 98 HIS 98 90 90 HIS HIS A . n +B 2 99 TYR 99 91 91 TYR TYR A . n +B 2 100 THR 100 92 92 THR THR A . n +B 2 101 CYS 101 93 93 CYS CYS A . n +B 2 102 GLU 102 94 94 GLU GLU A . n +B 2 103 VAL 103 95 95 VAL VAL A . n +B 2 104 THR 104 96 96 THR THR A . n +B 2 105 TRP 105 97 97 TRP TRP A . n +B 2 106 GLN 106 98 98 GLN GLN A . n +B 2 107 THR 107 99 99 THR THR A . n +B 2 108 PRO 108 100 100 PRO PRO A . n +B 2 109 ASP 109 101 101 ASP ASP A . n +B 2 110 GLY 110 102 102 GLY GLY A . n +B 2 111 ASN 111 103 103 ASN ASN A . n +B 2 112 GLN 112 104 104 GLN GLN A . n +B 2 113 VAL 113 105 105 VAL VAL A . n +B 2 114 ILE 114 106 106 ILE ILE A . n +B 2 115 ARG 115 107 107 ARG ARG A . n +B 2 116 ASP 116 108 108 ASP ASP A . n +B 2 117 LYS 117 109 109 LYS LYS A . n +B 2 118 ILE 118 110 110 ILE ILE A . n +B 2 119 ILE 119 111 111 ILE ILE A . n +B 2 120 GLU 120 112 112 GLU GLU A . n +B 2 121 LEU 121 113 113 LEU LEU A . n +B 2 122 ARG 122 114 114 ARG ARG A . n +B 2 123 VAL 123 115 115 VAL VAL A . n +B 2 124 ARG 124 116 116 ARG ARG A . n +B 2 125 LYS 125 117 117 LYS LYS A . n +B 2 126 TYR 126 118 118 TYR TYR A . n +B 2 127 ASN 127 119 119 ASN ASN A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +C 3 HOH 1 201 393 HOH HOH B . +C 3 HOH 2 202 376 HOH HOH B . +C 3 HOH 3 203 226 HOH HOH B . +C 3 HOH 4 204 396 HOH HOH B . +C 3 HOH 5 205 308 HOH HOH B . +C 3 HOH 6 206 151 HOH HOH B . +C 3 HOH 7 207 203 HOH HOH B . +C 3 HOH 8 208 310 HOH HOH B . +C 3 HOH 9 209 353 HOH HOH B . +C 3 HOH 10 210 362 HOH HOH B . +C 3 HOH 11 211 187 HOH HOH B . +C 3 HOH 12 212 251 HOH HOH B . +C 3 HOH 13 213 330 HOH HOH B . +C 3 HOH 14 214 301 HOH HOH B . +C 3 HOH 15 215 397 HOH HOH B . +C 3 HOH 16 216 246 HOH HOH B . +C 3 HOH 17 217 146 HOH HOH B . +C 3 HOH 18 218 124 HOH HOH B . +C 3 HOH 19 219 227 HOH HOH B . +C 3 HOH 20 220 359 HOH HOH B . +C 3 HOH 21 221 252 HOH HOH B . +C 3 HOH 22 222 47 HOH HOH B . +C 3 HOH 23 223 216 HOH HOH B . +C 3 HOH 24 224 250 HOH HOH B . +C 3 HOH 25 225 290 HOH HOH B . +C 3 HOH 26 226 347 HOH HOH B . +C 3 HOH 27 227 235 HOH HOH B . +C 3 HOH 28 228 428 HOH HOH B . +C 3 HOH 29 229 3 HOH HOH B . +C 3 HOH 30 230 336 HOH HOH B . +C 3 HOH 31 231 34 HOH HOH B . +C 3 HOH 32 232 165 HOH HOH B . +C 3 HOH 33 233 287 HOH HOH B . +C 3 HOH 34 234 348 HOH HOH B . +C 3 HOH 35 235 236 HOH HOH B . +C 3 HOH 36 236 422 HOH HOH B . +C 3 HOH 37 237 10 HOH HOH B . +C 3 HOH 38 238 36 HOH HOH B . +C 3 HOH 39 239 132 HOH HOH B . +C 3 HOH 40 240 90 HOH HOH B . +C 3 HOH 41 241 29 HOH HOH B . +C 3 HOH 42 242 55 HOH HOH B . +C 3 HOH 43 243 5 HOH HOH B . +C 3 HOH 44 244 207 HOH HOH B . +C 3 HOH 45 245 193 HOH HOH B . +C 3 HOH 46 246 164 HOH HOH B . +C 3 HOH 47 247 23 HOH HOH B . +C 3 HOH 48 248 46 HOH HOH B . +C 3 HOH 49 249 2 HOH HOH B . +C 3 HOH 50 250 231 HOH HOH B . +C 3 HOH 51 251 407 HOH HOH B . +C 3 HOH 52 252 178 HOH HOH B . +C 3 HOH 53 253 153 HOH HOH B . +C 3 HOH 54 254 68 HOH HOH B . +C 3 HOH 55 255 121 HOH HOH B . +C 3 HOH 56 256 101 HOH HOH B . +C 3 HOH 57 257 162 HOH HOH B . +C 3 HOH 58 258 291 HOH HOH B . +C 3 HOH 59 259 88 HOH HOH B . +C 3 HOH 60 260 15 HOH HOH B . +C 3 HOH 61 261 48 HOH HOH B . +C 3 HOH 62 262 111 HOH HOH B . +C 3 HOH 63 263 120 HOH HOH B . +C 3 HOH 64 264 62 HOH HOH B . +C 3 HOH 65 265 81 HOH HOH B . +C 3 HOH 66 266 240 HOH HOH B . +C 3 HOH 67 267 149 HOH HOH B . +C 3 HOH 68 268 123 HOH HOH B . +C 3 HOH 69 269 217 HOH HOH B . +C 3 HOH 70 270 327 HOH HOH B . +C 3 HOH 71 271 105 HOH HOH B . +C 3 HOH 72 272 12 HOH HOH B . +C 3 HOH 73 273 196 HOH HOH B . +C 3 HOH 74 274 314 HOH HOH B . +C 3 HOH 75 275 31 HOH HOH B . +C 3 HOH 76 276 234 HOH HOH B . +C 3 HOH 77 277 75 HOH HOH B . +C 3 HOH 78 278 154 HOH HOH B . +C 3 HOH 79 279 16 HOH HOH B . +C 3 HOH 80 280 369 HOH HOH B . +C 3 HOH 81 281 130 HOH HOH B . +C 3 HOH 82 282 127 HOH HOH B . +C 3 HOH 83 283 67 HOH HOH B . +C 3 HOH 84 284 332 HOH HOH B . +C 3 HOH 85 285 135 HOH HOH B . +C 3 HOH 86 286 51 HOH HOH B . +C 3 HOH 87 287 1 HOH HOH B . +C 3 HOH 88 288 261 HOH HOH B . +C 3 HOH 89 289 188 HOH HOH B . +C 3 HOH 90 290 423 HOH HOH B . +C 3 HOH 91 291 391 HOH HOH B . +C 3 HOH 92 292 54 HOH HOH B . +C 3 HOH 93 293 86 HOH HOH B . +C 3 HOH 94 294 24 HOH HOH B . +C 3 HOH 95 295 390 HOH HOH B . +C 3 HOH 96 296 89 HOH HOH B . +C 3 HOH 97 297 125 HOH HOH B . +C 3 HOH 98 298 133 HOH HOH B . +C 3 HOH 99 299 41 HOH HOH B . +C 3 HOH 100 300 271 HOH HOH B . +C 3 HOH 101 301 225 HOH HOH B . +C 3 HOH 102 302 244 HOH HOH B . +C 3 HOH 103 303 263 HOH HOH B . +C 3 HOH 104 304 307 HOH HOH B . +C 3 HOH 105 305 321 HOH HOH B . +C 3 HOH 106 306 221 HOH HOH B . +C 3 HOH 107 307 264 HOH HOH B . +C 3 HOH 108 308 300 HOH HOH B . +C 3 HOH 109 309 201 HOH HOH B . +C 3 HOH 110 310 169 HOH HOH B . +C 3 HOH 111 311 197 HOH HOH B . +C 3 HOH 112 312 93 HOH HOH B . +C 3 HOH 113 313 138 HOH HOH B . +C 3 HOH 114 314 223 HOH HOH B . +C 3 HOH 115 315 319 HOH HOH B . +C 3 HOH 116 316 406 HOH HOH B . +C 3 HOH 117 317 361 HOH HOH B . +C 3 HOH 118 318 288 HOH HOH B . +C 3 HOH 119 319 134 HOH HOH B . +C 3 HOH 120 320 272 HOH HOH B . +C 3 HOH 121 321 7 HOH HOH B . +C 3 HOH 122 322 113 HOH HOH B . +C 3 HOH 123 323 112 HOH HOH B . +C 3 HOH 124 324 317 HOH HOH B . +C 3 HOH 125 325 80 HOH HOH B . +C 3 HOH 126 326 367 HOH HOH B . +C 3 HOH 127 327 103 HOH HOH B . +C 3 HOH 128 328 245 HOH HOH B . +C 3 HOH 129 329 398 HOH HOH B . +C 3 HOH 130 330 44 HOH HOH B . +C 3 HOH 131 331 262 HOH HOH B . +C 3 HOH 132 332 208 HOH HOH B . +C 3 HOH 133 333 180 HOH HOH B . +C 3 HOH 134 334 224 HOH HOH B . +C 3 HOH 135 335 292 HOH HOH B . +C 3 HOH 136 336 364 HOH HOH B . +C 3 HOH 137 337 99 HOH HOH B . +C 3 HOH 138 338 94 HOH HOH B . +C 3 HOH 139 339 402 HOH HOH B . +C 3 HOH 140 340 119 HOH HOH B . +C 3 HOH 141 341 43 HOH HOH B . +C 3 HOH 142 342 280 HOH HOH B . +C 3 HOH 143 343 392 HOH HOH B . +C 3 HOH 144 344 140 HOH HOH B . +C 3 HOH 145 345 161 HOH HOH B . +C 3 HOH 146 346 239 HOH HOH B . +C 3 HOH 147 347 191 HOH HOH B . +C 3 HOH 148 348 418 HOH HOH B . +C 3 HOH 149 349 346 HOH HOH B . +C 3 HOH 150 350 349 HOH HOH B . +C 3 HOH 151 351 78 HOH HOH B . +C 3 HOH 152 352 389 HOH HOH B . +C 3 HOH 153 353 417 HOH HOH B . +C 3 HOH 154 354 59 HOH HOH B . +C 3 HOH 155 355 296 HOH HOH B . +C 3 HOH 156 356 345 HOH HOH B . +C 3 HOH 157 357 377 HOH HOH B . +C 3 HOH 158 358 274 HOH HOH B . +C 3 HOH 159 359 340 HOH HOH B . +C 3 HOH 160 360 229 HOH HOH B . +C 3 HOH 161 361 354 HOH HOH B . +C 3 HOH 162 362 419 HOH HOH B . +C 3 HOH 163 363 168 HOH HOH B . +C 3 HOH 164 364 328 HOH HOH B . +C 3 HOH 165 365 404 HOH HOH B . +C 3 HOH 166 366 415 HOH HOH B . +C 3 HOH 167 367 166 HOH HOH B . +C 3 HOH 168 368 410 HOH HOH B . +C 3 HOH 169 369 355 HOH HOH B . +C 3 HOH 170 370 26 HOH HOH B . +C 3 HOH 171 371 365 HOH HOH B . +C 3 HOH 172 372 360 HOH HOH B . +C 3 HOH 173 373 258 HOH HOH B . +C 3 HOH 174 374 214 HOH HOH B . +C 3 HOH 175 375 213 HOH HOH B . +C 3 HOH 176 376 435 HOH HOH B . +C 3 HOH 177 377 237 HOH HOH B . +C 3 HOH 178 378 242 HOH HOH B . +C 3 HOH 179 379 358 HOH HOH B . +C 3 HOH 180 380 311 HOH HOH B . +C 3 HOH 181 381 400 HOH HOH B . +C 3 HOH 182 382 285 HOH HOH B . +C 3 HOH 183 383 273 HOH HOH B . +C 3 HOH 184 384 399 HOH HOH B . +C 3 HOH 185 385 241 HOH HOH B . +C 3 HOH 186 386 420 HOH HOH B . +C 3 HOH 187 387 320 HOH HOH B . +C 3 HOH 188 388 257 HOH HOH B . +C 3 HOH 189 389 408 HOH HOH B . +C 3 HOH 190 390 278 HOH HOH B . +C 3 HOH 191 391 281 HOH HOH B . +C 3 HOH 192 392 381 HOH HOH B . +C 3 HOH 193 393 401 HOH HOH B . +C 3 HOH 194 394 220 HOH HOH B . +C 3 HOH 195 395 117 HOH HOH B . +C 3 HOH 196 396 411 HOH HOH B . +C 3 HOH 197 397 388 HOH HOH B . +C 3 HOH 198 398 126 HOH HOH B . +C 3 HOH 199 399 350 HOH HOH B . +C 3 HOH 200 400 335 HOH HOH B . +C 3 HOH 201 401 337 HOH HOH B . +C 3 HOH 202 402 427 HOH HOH B . +C 3 HOH 203 403 341 HOH HOH B . +C 3 HOH 204 404 433 HOH HOH B . +C 3 HOH 205 405 139 HOH HOH B . +C 3 HOH 206 406 375 HOH HOH B . +C 3 HOH 207 407 230 HOH HOH B . +C 3 HOH 208 408 344 HOH HOH B . +C 3 HOH 209 409 363 HOH HOH B . +C 3 HOH 210 410 384 HOH HOH B . +D 3 HOH 1 201 373 HOH HOH A . +D 3 HOH 2 202 331 HOH HOH A . +D 3 HOH 3 203 155 HOH HOH A . +D 3 HOH 4 204 368 HOH HOH A . +D 3 HOH 5 205 315 HOH HOH A . +D 3 HOH 6 206 383 HOH HOH A . +D 3 HOH 7 207 322 HOH HOH A . +D 3 HOH 8 208 128 HOH HOH A . +D 3 HOH 9 209 256 HOH HOH A . +D 3 HOH 10 210 293 HOH HOH A . +D 3 HOH 11 211 110 HOH HOH A . +D 3 HOH 12 212 352 HOH HOH A . +D 3 HOH 13 213 150 HOH HOH A . +D 3 HOH 14 214 386 HOH HOH A . +D 3 HOH 15 215 370 HOH HOH A . +D 3 HOH 16 216 294 HOH HOH A . +D 3 HOH 17 217 431 HOH HOH A . +D 3 HOH 18 218 73 HOH HOH A . +D 3 HOH 19 219 60 HOH HOH A . +D 3 HOH 20 220 21 HOH HOH A . +D 3 HOH 21 221 233 HOH HOH A . +D 3 HOH 22 222 17 HOH HOH A . +D 3 HOH 23 223 109 HOH HOH A . +D 3 HOH 24 224 104 HOH HOH A . +D 3 HOH 25 225 72 HOH HOH A . +D 3 HOH 26 226 385 HOH HOH A . +D 3 HOH 27 227 35 HOH HOH A . +D 3 HOH 28 228 11 HOH HOH A . +D 3 HOH 29 229 163 HOH HOH A . +D 3 HOH 30 230 96 HOH HOH A . +D 3 HOH 31 231 228 HOH HOH A . +D 3 HOH 32 232 115 HOH HOH A . +D 3 HOH 33 233 177 HOH HOH A . +D 3 HOH 34 234 84 HOH HOH A . +D 3 HOH 35 235 42 HOH HOH A . +D 3 HOH 36 236 413 HOH HOH A . +D 3 HOH 37 237 409 HOH HOH A . +D 3 HOH 38 238 8 HOH HOH A . +D 3 HOH 39 239 85 HOH HOH A . +D 3 HOH 40 240 351 HOH HOH A . +D 3 HOH 41 241 323 HOH HOH A . +D 3 HOH 42 242 158 HOH HOH A . +D 3 HOH 43 243 40 HOH HOH A . +D 3 HOH 44 244 9 HOH HOH A . +D 3 HOH 45 245 97 HOH HOH A . +D 3 HOH 46 246 343 HOH HOH A . +D 3 HOH 47 247 284 HOH HOH A . +D 3 HOH 48 248 27 HOH HOH A . +D 3 HOH 49 249 171 HOH HOH A . +D 3 HOH 50 250 100 HOH HOH A . +D 3 HOH 51 251 50 HOH HOH A . +D 3 HOH 52 252 70 HOH HOH A . +D 3 HOH 53 253 131 HOH HOH A . +D 3 HOH 54 254 32 HOH HOH A . +D 3 HOH 55 255 18 HOH HOH A . +D 3 HOH 56 256 53 HOH HOH A . +D 3 HOH 57 257 200 HOH HOH A . +D 3 HOH 58 258 74 HOH HOH A . +D 3 HOH 59 259 61 HOH HOH A . +D 3 HOH 60 260 122 HOH HOH A . +D 3 HOH 61 261 182 HOH HOH A . +D 3 HOH 62 262 14 HOH HOH A . +D 3 HOH 63 263 77 HOH HOH A . +D 3 HOH 64 264 13 HOH HOH A . +D 3 HOH 65 265 22 HOH HOH A . +D 3 HOH 66 266 33 HOH HOH A . +D 3 HOH 67 267 106 HOH HOH A . +D 3 HOH 68 268 366 HOH HOH A . +D 3 HOH 69 269 58 HOH HOH A . +D 3 HOH 70 270 38 HOH HOH A . +D 3 HOH 71 271 299 HOH HOH A . +D 3 HOH 72 272 309 HOH HOH A . +D 3 HOH 73 273 141 HOH HOH A . +D 3 HOH 74 274 49 HOH HOH A . +D 3 HOH 75 275 6 HOH HOH A . +D 3 HOH 76 276 143 HOH HOH A . +D 3 HOH 77 277 186 HOH HOH A . +D 3 HOH 78 278 129 HOH HOH A . +D 3 HOH 79 279 20 HOH HOH A . +D 3 HOH 80 280 107 HOH HOH A . +D 3 HOH 81 281 28 HOH HOH A . +D 3 HOH 82 282 69 HOH HOH A . +D 3 HOH 83 283 108 HOH HOH A . +D 3 HOH 84 284 102 HOH HOH A . +D 3 HOH 85 285 249 HOH HOH A . +D 3 HOH 86 286 92 HOH HOH A . +D 3 HOH 87 287 184 HOH HOH A . +D 3 HOH 88 288 63 HOH HOH A . +D 3 HOH 89 289 426 HOH HOH A . +D 3 HOH 90 290 255 HOH HOH A . +D 3 HOH 91 291 306 HOH HOH A . +D 3 HOH 92 292 189 HOH HOH A . +D 3 HOH 93 293 83 HOH HOH A . +D 3 HOH 94 294 91 HOH HOH A . +D 3 HOH 95 295 297 HOH HOH A . +D 3 HOH 96 296 160 HOH HOH A . +D 3 HOH 97 297 116 HOH HOH A . +D 3 HOH 98 298 179 HOH HOH A . +D 3 HOH 99 299 4 HOH HOH A . +D 3 HOH 100 300 209 HOH HOH A . +D 3 HOH 101 301 79 HOH HOH A . +D 3 HOH 102 302 305 HOH HOH A . +D 3 HOH 103 303 267 HOH HOH A . +D 3 HOH 104 304 254 HOH HOH A . +D 3 HOH 105 305 181 HOH HOH A . +D 3 HOH 106 306 156 HOH HOH A . +D 3 HOH 107 307 159 HOH HOH A . +D 3 HOH 108 308 95 HOH HOH A . +D 3 HOH 109 309 114 HOH HOH A . +D 3 HOH 110 310 198 HOH HOH A . +D 3 HOH 111 311 136 HOH HOH A . +D 3 HOH 112 312 333 HOH HOH A . +D 3 HOH 113 313 303 HOH HOH A . +D 3 HOH 114 314 195 HOH HOH A . +D 3 HOH 115 315 144 HOH HOH A . +D 3 HOH 116 316 218 HOH HOH A . +D 3 HOH 117 317 219 HOH HOH A . +D 3 HOH 118 318 183 HOH HOH A . +D 3 HOH 119 319 37 HOH HOH A . +D 3 HOH 120 320 268 HOH HOH A . +D 3 HOH 121 321 424 HOH HOH A . +D 3 HOH 122 322 148 HOH HOH A . +D 3 HOH 123 323 425 HOH HOH A . +D 3 HOH 124 324 71 HOH HOH A . +D 3 HOH 125 325 175 HOH HOH A . +D 3 HOH 126 326 298 HOH HOH A . +D 3 HOH 127 327 382 HOH HOH A . +D 3 HOH 128 328 19 HOH HOH A . +D 3 HOH 129 329 316 HOH HOH A . +D 3 HOH 130 330 82 HOH HOH A . +D 3 HOH 131 331 30 HOH HOH A . +D 3 HOH 132 332 39 HOH HOH A . +D 3 HOH 133 333 57 HOH HOH A . +D 3 HOH 134 334 64 HOH HOH A . +D 3 HOH 135 335 87 HOH HOH A . +D 3 HOH 136 336 25 HOH HOH A . +D 3 HOH 137 337 56 HOH HOH A . +D 3 HOH 138 338 206 HOH HOH A . +D 3 HOH 139 339 356 HOH HOH A . +D 3 HOH 140 340 118 HOH HOH A . +D 3 HOH 141 341 202 HOH HOH A . +D 3 HOH 142 342 276 HOH HOH A . +D 3 HOH 143 343 204 HOH HOH A . +D 3 HOH 144 344 379 HOH HOH A . +D 3 HOH 145 345 412 HOH HOH A . +D 3 HOH 146 346 65 HOH HOH A . +D 3 HOH 147 347 211 HOH HOH A . +D 3 HOH 148 348 295 HOH HOH A . +D 3 HOH 149 349 282 HOH HOH A . +D 3 HOH 150 350 152 HOH HOH A . +D 3 HOH 151 351 145 HOH HOH A . +D 3 HOH 152 352 313 HOH HOH A . +D 3 HOH 153 353 266 HOH HOH A . +D 3 HOH 154 354 172 HOH HOH A . +D 3 HOH 155 355 167 HOH HOH A . +D 3 HOH 156 356 326 HOH HOH A . +D 3 HOH 157 357 334 HOH HOH A . +D 3 HOH 158 358 405 HOH HOH A . +D 3 HOH 159 359 394 HOH HOH A . +D 3 HOH 160 360 205 HOH HOH A . +D 3 HOH 161 361 76 HOH HOH A . +D 3 HOH 162 362 342 HOH HOH A . +D 3 HOH 163 363 374 HOH HOH A . +D 3 HOH 164 364 232 HOH HOH A . +D 3 HOH 165 365 434 HOH HOH A . +D 3 HOH 166 366 416 HOH HOH A . +D 3 HOH 167 367 436 HOH HOH A . +D 3 HOH 168 368 357 HOH HOH A . +D 3 HOH 169 369 302 HOH HOH A . +D 3 HOH 170 370 277 HOH HOH A . +D 3 HOH 171 371 430 HOH HOH A . +D 3 HOH 172 372 243 HOH HOH A . +D 3 HOH 173 373 414 HOH HOH A . +D 3 HOH 174 374 199 HOH HOH A . +D 3 HOH 175 375 212 HOH HOH A . +D 3 HOH 176 376 432 HOH HOH A . +D 3 HOH 177 377 312 HOH HOH A . +D 3 HOH 178 378 403 HOH HOH A . +D 3 HOH 179 379 52 HOH HOH A . +D 3 HOH 180 380 338 HOH HOH A . +D 3 HOH 181 381 147 HOH HOH A . +D 3 HOH 182 382 395 HOH HOH A . +D 3 HOH 183 383 45 HOH HOH A . +D 3 HOH 184 384 137 HOH HOH A . +D 3 HOH 185 385 248 HOH HOH A . +D 3 HOH 186 386 98 HOH HOH A . +D 3 HOH 187 387 371 HOH HOH A . +D 3 HOH 188 388 325 HOH HOH A . +D 3 HOH 189 389 304 HOH HOH A . +D 3 HOH 190 390 238 HOH HOH A . +D 3 HOH 191 391 173 HOH HOH A . +D 3 HOH 192 392 194 HOH HOH A . +D 3 HOH 193 393 222 HOH HOH A . +D 3 HOH 194 394 215 HOH HOH A . +D 3 HOH 195 395 380 HOH HOH A . +D 3 HOH 196 396 265 HOH HOH A . +D 3 HOH 197 397 289 HOH HOH A . +D 3 HOH 198 398 275 HOH HOH A . +D 3 HOH 199 399 185 HOH HOH A . +D 3 HOH 200 400 372 HOH HOH A . +D 3 HOH 201 401 142 HOH HOH A . +D 3 HOH 202 402 329 HOH HOH A . +D 3 HOH 203 403 324 HOH HOH A . +D 3 HOH 204 404 170 HOH HOH A . +D 3 HOH 205 405 378 HOH HOH A . +D 3 HOH 206 406 279 HOH HOH A . +D 3 HOH 207 407 286 HOH HOH A . +D 3 HOH 208 408 318 HOH HOH A . +D 3 HOH 209 409 192 HOH HOH A . +D 3 HOH 210 410 283 HOH HOH A . +D 3 HOH 211 411 421 HOH HOH A . +D 3 HOH 212 412 247 HOH HOH A . +D 3 HOH 213 413 210 HOH HOH A . +D 3 HOH 214 414 260 HOH HOH A . +D 3 HOH 215 415 270 HOH HOH A . +D 3 HOH 216 416 339 HOH HOH A . +D 3 HOH 217 417 176 HOH HOH A . +D 3 HOH 218 418 190 HOH HOH A . +D 3 HOH 219 419 259 HOH HOH A . +D 3 HOH 220 420 429 HOH HOH A . +D 3 HOH 221 421 253 HOH HOH A . +D 3 HOH 222 422 157 HOH HOH A . +D 3 HOH 223 423 269 HOH HOH A . +D 3 HOH 224 424 66 HOH HOH A . +D 3 HOH 225 425 174 HOH HOH A . +D 3 HOH 226 426 387 HOH HOH A . +# +loop_ +_software.citation_id +_software.classification +_software.compiler_name +_software.compiler_version +_software.contact_author +_software.contact_author_email +_software.date +_software.description +_software.dependencies +_software.hardware +_software.language +_software.location +_software.mods +_software.name +_software.os +_software.os_version +_software.type +_software.version +_software.pdbx_ordinal +? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.9_1692 1 +? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS ? ? ? . 2 +? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? XDS ? ? ? . 3 +? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 +# +_cell.angle_alpha 90.00 +_cell.angle_alpha_esd ? +_cell.angle_beta 90.00 +_cell.angle_beta_esd ? +_cell.angle_gamma 90.00 +_cell.angle_gamma_esd ? +_cell.entry_id 5IMM +_cell.details ? +_cell.formula_units_Z ? +_cell.length_a 29.598 +_cell.length_a_esd ? +_cell.length_b 50.285 +_cell.length_b_esd ? +_cell.length_c 163.209 +_cell.length_c_esd ? +_cell.volume ? +_cell.volume_esd ? +_cell.Z_PDB 4 +_cell.reciprocal_angle_alpha ? +_cell.reciprocal_angle_beta ? +_cell.reciprocal_angle_gamma ? +_cell.reciprocal_angle_alpha_esd ? +_cell.reciprocal_angle_beta_esd ? +_cell.reciprocal_angle_gamma_esd ? +_cell.reciprocal_length_a ? +_cell.reciprocal_length_b ? +_cell.reciprocal_length_c ? +_cell.reciprocal_length_a_esd ? +_cell.reciprocal_length_b_esd ? +_cell.reciprocal_length_c_esd ? +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 5IMM +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 19 +_symmetry.space_group_name_Hall ? +_symmetry.space_group_name_H-M 'P 21 21 21' +_symmetry.pdbx_full_space_group_name_H-M ? +# +_exptl.absorpt_coefficient_mu ? +_exptl.absorpt_correction_T_max ? +_exptl.absorpt_correction_T_min ? +_exptl.absorpt_correction_type ? +_exptl.absorpt_process_details ? +_exptl.entry_id 5IMM +_exptl.crystals_number 1 +_exptl.details ? +_exptl.method 'X-RAY DIFFRACTION' +_exptl.method_details ? +# +_exptl_crystal.colour ? +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_Matthews 2.06 +_exptl_crystal.density_method ? +_exptl_crystal.density_percent_sol 40.32 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.id 1 +_exptl_crystal.preparation ? +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.colour_lustre ? +_exptl_crystal.colour_modifier ? +_exptl_crystal.colour_primary ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_esd ? +_exptl_crystal.density_meas_gt ? +_exptl_crystal.density_meas_lt ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_meas_temp_esd ? +_exptl_crystal.density_meas_temp_gt ? +_exptl_crystal.density_meas_temp_lt ? +_exptl_crystal.pdbx_crystal_image_url ? +_exptl_crystal.pdbx_crystal_image_format ? +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +# +_exptl_crystal_grow.apparatus ? +_exptl_crystal_grow.atmosphere ? +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.details ? +_exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' +_exptl_crystal_grow.method_ref ? +_exptl_crystal_grow.pH 5.5 +_exptl_crystal_grow.pressure ? +_exptl_crystal_grow.pressure_esd ? +_exptl_crystal_grow.seeding ? +_exptl_crystal_grow.seeding_ref ? +_exptl_crystal_grow.temp 293 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.temp_esd ? +_exptl_crystal_grow.time ? +_exptl_crystal_grow.pdbx_details '0.2M Ammonium sulfate, 0.1M BIS-Tris, 25% PEG 3350 pH 5.5' +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.ambient_environment ? +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.ambient_temp_esd ? +_diffrn.crystal_id 1 +_diffrn.crystal_support ? +_diffrn.crystal_treatment ? +_diffrn.details ? +_diffrn.id 1 +_diffrn.ambient_pressure ? +_diffrn.ambient_pressure_esd ? +_diffrn.ambient_pressure_gt ? +_diffrn.ambient_pressure_lt ? +_diffrn.ambient_temp_gt ? +_diffrn.ambient_temp_lt ? +# +_diffrn_detector.details ? +_diffrn_detector.detector PIXEL +_diffrn_detector.diffrn_id 1 +_diffrn_detector.type 'DECTRIS PILATUS3 6M' +_diffrn_detector.area_resol_mean ? +_diffrn_detector.dtime ? +_diffrn_detector.pdbx_frames_total ? +_diffrn_detector.pdbx_collection_time_total ? +_diffrn_detector.pdbx_collection_date 2015-07-23 +# +_diffrn_radiation.collimation ? +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.filter_edge ? +_diffrn_radiation.inhomogeneity ? +_diffrn_radiation.monochromator ? +_diffrn_radiation.polarisn_norm ? +_diffrn_radiation.polarisn_ratio ? +_diffrn_radiation.probe ? +_diffrn_radiation.type ? +_diffrn_radiation.xray_symbol ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_wavelength_list ? +_diffrn_radiation.pdbx_wavelength ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_analyzer ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 0.987 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.current ? +_diffrn_source.details ? +_diffrn_source.diffrn_id 1 +_diffrn_source.power ? +_diffrn_source.size ? +_diffrn_source.source SYNCHROTRON +_diffrn_source.target ? +_diffrn_source.type 'SSRF BEAMLINE BL19U1' +_diffrn_source.voltage ? +_diffrn_source.take-off_angle ? +_diffrn_source.pdbx_wavelength_list 0.987 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_beamline BL19U1 +_diffrn_source.pdbx_synchrotron_site SSRF +# +_reflns.B_iso_Wilson_estimate ? +_reflns.entry_id 5IMM +_reflns.data_reduction_details ? +_reflns.data_reduction_method ? +_reflns.d_resolution_high 1.2 +_reflns.d_resolution_low 42.81 +_reflns.details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.number_all ? +_reflns.number_obs 75159 +_reflns.observed_criterion ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.observed_criterion_I_max ? +_reflns.observed_criterion_I_min ? +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.percent_possible_obs 97.0 +_reflns.R_free_details ? +_reflns.Rmerge_F_all ? +_reflns.Rmerge_F_obs ? +_reflns.Friedel_coverage ? +_reflns.number_gt ? +_reflns.threshold_expression ? +_reflns.pdbx_redundancy 4.4 +_reflns.pdbx_Rmerge_I_obs ? +_reflns.pdbx_Rmerge_I_all ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_av_sigmaI ? +_reflns.pdbx_netI_over_sigmaI 8.06 +_reflns.pdbx_res_netI_over_av_sigmaI_2 ? +_reflns.pdbx_res_netI_over_sigmaI_2 ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_d_res_high_opt ? +_reflns.pdbx_d_res_low_opt ? +_reflns.pdbx_d_res_opt_method ? +_reflns.phase_calculation_details ? +_reflns.pdbx_Rrim_I_all ? +_reflns.pdbx_Rpim_I_all ? +_reflns.pdbx_d_opt ? +_reflns.pdbx_number_measured_all ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.pdbx_CC_half ? +_reflns.pdbx_R_split ? +# +_reflns_shell.d_res_high . +_reflns_shell.d_res_low ? +_reflns_shell.meanI_over_sigI_all ? +_reflns_shell.meanI_over_sigI_obs ? +_reflns_shell.number_measured_all ? +_reflns_shell.number_measured_obs ? +_reflns_shell.number_possible ? +_reflns_shell.number_unique_all ? +_reflns_shell.number_unique_obs ? +_reflns_shell.percent_possible_all ? +_reflns_shell.percent_possible_obs ? +_reflns_shell.Rmerge_F_all ? +_reflns_shell.Rmerge_F_obs ? +_reflns_shell.Rmerge_I_all ? +_reflns_shell.Rmerge_I_obs ? +_reflns_shell.meanI_over_sigI_gt ? +_reflns_shell.meanI_over_uI_all ? +_reflns_shell.meanI_over_uI_gt ? +_reflns_shell.number_measured_gt ? +_reflns_shell.number_unique_gt ? +_reflns_shell.percent_possible_gt ? +_reflns_shell.Rmerge_F_gt ? +_reflns_shell.Rmerge_I_gt ? +_reflns_shell.pdbx_redundancy ? +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.pdbx_chi_squared ? +_reflns_shell.pdbx_netI_over_sigmaI_all ? +_reflns_shell.pdbx_netI_over_sigmaI_obs ? +_reflns_shell.pdbx_Rrim_I_all ? +_reflns_shell.pdbx_Rpim_I_all ? +_reflns_shell.pdbx_rejects ? +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.pdbx_CC_half ? +_reflns_shell.pdbx_R_split ? +# +_refine.aniso_B[1][1] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[2][3] ? +_refine.aniso_B[3][3] ? +_refine.B_iso_max ? +_refine.B_iso_mean ? +_refine.B_iso_min ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.details ? +_refine.diff_density_max ? +_refine.diff_density_max_esd ? +_refine.diff_density_min ? +_refine.diff_density_min_esd ? +_refine.diff_density_rms ? +_refine.diff_density_rms_esd ? +_refine.entry_id 5IMM +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.ls_abs_structure_details ? +_refine.ls_abs_structure_Flack ? +_refine.ls_abs_structure_Flack_esd ? +_refine.ls_abs_structure_Rogers ? +_refine.ls_abs_structure_Rogers_esd ? +_refine.ls_d_res_high 1.200 +_refine.ls_d_res_low 42.810 +_refine.ls_extinction_coef ? +_refine.ls_extinction_coef_esd ? +_refine.ls_extinction_expression ? +_refine.ls_extinction_method ? +_refine.ls_goodness_of_fit_all ? +_refine.ls_goodness_of_fit_all_esd ? +_refine.ls_goodness_of_fit_obs ? +_refine.ls_goodness_of_fit_obs_esd ? +_refine.ls_hydrogen_treatment ? +_refine.ls_matrix_type ? +_refine.ls_number_constraints ? +_refine.ls_number_parameters ? +_refine.ls_number_reflns_all ? +_refine.ls_number_reflns_obs 75156 +_refine.ls_number_reflns_R_free 2000 +_refine.ls_number_reflns_R_work ? +_refine.ls_number_restraints ? +_refine.ls_percent_reflns_obs 96.96 +_refine.ls_percent_reflns_R_free 2.66 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.1566 +_refine.ls_R_factor_R_free 0.1755 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_R_factor_R_work 0.1561 +_refine.ls_R_Fsqd_factor_obs ? +_refine.ls_R_I_factor_obs ? +_refine.ls_redundancy_reflns_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_restrained_S_all ? +_refine.ls_restrained_S_obs ? +_refine.ls_shift_over_esd_max ? +_refine.ls_shift_over_esd_mean ? +_refine.ls_structure_factor_coef ? +_refine.ls_weighting_details ? +_refine.ls_weighting_scheme ? +_refine.ls_wR_factor_all ? +_refine.ls_wR_factor_obs ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.solvent_model_details ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.ls_R_factor_gt ? +_refine.ls_goodness_of_fit_gt ? +_refine.ls_goodness_of_fit_ref ? +_refine.ls_shift_over_su_max ? +_refine.ls_shift_over_su_max_lt ? +_refine.ls_shift_over_su_mean ? +_refine.ls_shift_over_su_mean_lt ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 1.36 +_refine.pdbx_ls_sigma_Fsqd ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' +_refine.pdbx_method_to_determine_struct ? +_refine.pdbx_starting_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_R_Free_selection_details ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.pdbx_solvent_vdw_probe_radii 1.11 +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii 0.90 +_refine.pdbx_real_space_R ? +_refine.pdbx_density_correlation ? +_refine.pdbx_pd_number_of_powder_patterns ? +_refine.pdbx_pd_number_of_points ? +_refine.pdbx_pd_meas_number_of_points ? +_refine.pdbx_pd_proc_ls_prof_R_factor ? +_refine.pdbx_pd_proc_ls_prof_wR_factor ? +_refine.pdbx_pd_Marquardt_correlation_coeff ? +_refine.pdbx_pd_Fsqrd_R_factor ? +_refine.pdbx_pd_ls_matrix_band_width ? +_refine.pdbx_overall_phase_error 16.23 +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_diffrn_id 1 +_refine.overall_SU_B ? +_refine.overall_SU_ML 0.10 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_average_fsc_overall ? +_refine.pdbx_average_fsc_work ? +_refine.pdbx_average_fsc_free ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 1953 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 0 +_refine_hist.number_atoms_solvent 436 +_refine_hist.number_atoms_total 2389 +_refine_hist.d_res_high 1.200 +_refine_hist.d_res_low 42.810 +# +loop_ +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.criterion +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.number +_refine_ls_restr.rejects +_refine_ls_restr.type +_refine_ls_restr.weight +_refine_ls_restr.pdbx_restraint_function +'X-RAY DIFFRACTION' ? 0.009 ? 2014 ? f_bond_d ? ? +'X-RAY DIFFRACTION' ? 1.330 ? 2724 ? f_angle_d ? ? +'X-RAY DIFFRACTION' ? 13.143 ? 740 ? f_dihedral_angle_d ? ? +'X-RAY DIFFRACTION' ? 0.081 ? 286 ? f_chiral_restr ? ? +'X-RAY DIFFRACTION' ? 0.006 ? 352 ? f_plane_restr ? ? +# +loop_ +_refine_ls_shell.pdbx_refine_id +_refine_ls_shell.d_res_high +_refine_ls_shell.d_res_low +_refine_ls_shell.number_reflns_all +_refine_ls_shell.number_reflns_obs +_refine_ls_shell.number_reflns_R_free +_refine_ls_shell.number_reflns_R_work +_refine_ls_shell.percent_reflns_obs +_refine_ls_shell.percent_reflns_R_free +_refine_ls_shell.R_factor_all +_refine_ls_shell.R_factor_obs +_refine_ls_shell.R_factor_R_free +_refine_ls_shell.R_factor_R_free_error +_refine_ls_shell.R_factor_R_work +_refine_ls_shell.redundancy_reflns_all +_refine_ls_shell.redundancy_reflns_obs +_refine_ls_shell.wR_factor_all +_refine_ls_shell.wR_factor_obs +_refine_ls_shell.wR_factor_R_free +_refine_ls_shell.wR_factor_R_work +_refine_ls_shell.pdbx_total_number_of_bins_used +_refine_ls_shell.pdbx_phase_error +_refine_ls_shell.pdbx_fsc_work +_refine_ls_shell.pdbx_fsc_free +'X-RAY DIFFRACTION' 1.2001 1.2301 . . 144 5236 98.00 . . . 0.2833 . 0.2306 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.2301 1.2633 . . 141 5212 99.00 . . . 0.2360 . 0.2123 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.2633 1.3005 . . 145 5282 99.00 . . . 0.2321 . 0.1977 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.3005 1.3425 . . 144 5283 99.00 . . . 0.1979 . 0.1835 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.3425 1.3905 . . 144 5272 99.00 . . . 0.1742 . 0.1723 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.3905 1.4461 . . 144 5244 99.00 . . . 0.1667 . 0.1666 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.4461 1.5120 . . 143 5248 99.00 . . . 0.1825 . 0.1574 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.5120 1.5917 . . 144 5243 98.00 . . . 0.1863 . 0.1544 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.5917 1.6914 . . 143 5231 97.00 . . . 0.1695 . 0.1493 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.6914 1.8220 . . 144 5246 97.00 . . . 0.1800 . 0.1510 . . . . . . . . . . +'X-RAY DIFFRACTION' 1.8220 2.0054 . . 141 5190 96.00 . . . 0.1716 . 0.1426 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.0054 2.2955 . . 141 5149 95.00 . . . 0.1565 . 0.1389 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.2955 2.8920 . . 140 5135 94.00 . . . 0.1691 . 0.1552 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.8920 42.8372 . . 142 5185 90.00 . . . 0.1588 . 0.1447 . . . . . . . . . . +# +_struct.entry_id 5IMM +_struct.title 'Nanobody targeting mouse Vsig4 in Spacegroup P212121' +_struct.pdbx_model_details ? +_struct.pdbx_formula_weight ? +_struct.pdbx_formula_weight_method ? +_struct.pdbx_model_type_details ? +_struct.pdbx_CASP_flag ? +# +_struct_keywords.entry_id 5IMM +_struct_keywords.text 'Nanobody, Complement Receptor, Vsig4 CRIg, IMMUNE SYSTEM' +_struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 3 ? +D N N 3 ? +# +loop_ +_struct_ref.id +_struct_ref.db_name +_struct_ref.db_code +_struct_ref.pdbx_db_accession +_struct_ref.pdbx_db_isoform +_struct_ref.entity_id +_struct_ref.pdbx_seq_one_letter_code +_struct_ref.pdbx_align_begin +1 PDB 5IMM 5IMM ? 1 ? 1 +2 UNP F6TUL9_MOUSE F6TUL9 ? 2 +;GHPTLKTPESVTGTWKGDVKIQCIYDPLRGYRQVLVKWLVRHGSDSVTIFLRDSTGDHIQQAKYRGRLKVSHKVPGDVSL +QINTLQMDDRNHYTCEVTWQTPDGNQVIRDKIIELRVRKYN +; +19 +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 5IMM B 1 ? 131 ? 5IMM 0 ? 130 ? 0 130 +2 2 5IMM A 7 ? 127 ? F6TUL9 19 ? 139 ? -1 119 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +2 5IMM HIS A 1 ? UNP F6TUL9 ? ? 'expression tag' -7 1 +2 5IMM HIS A 2 ? UNP F6TUL9 ? ? 'expression tag' -6 2 +2 5IMM HIS A 3 ? UNP F6TUL9 ? ? 'expression tag' -5 3 +2 5IMM HIS A 4 ? UNP F6TUL9 ? ? 'expression tag' -4 4 +2 5IMM HIS A 5 ? UNP F6TUL9 ? ? 'expression tag' -3 5 +2 5IMM HIS A 6 ? UNP F6TUL9 ? ? 'expression tag' -2 6 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details dimeric +_pdbx_struct_assembly.oligomeric_count 2 +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 1510 ? +1 MORE 1 ? +1 'SSA (A^2)' 12180 ? +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 AA1 THR A 28 ? TYR A 32 ? THR B 27 TYR B 31 5 ? 5 +HELX_P HELX_P2 AA2 ASN A 74 ? LYS A 76 ? ASN B 73 LYS B 75 5 ? 3 +HELX_P HELX_P3 AA3 LYS A 87 ? THR A 91 ? LYS B 86 THR B 90 5 ? 5 +HELX_P HELX_P4 AA4 PHE A 108 ? TYR A 112 ? PHE B 107 TYR B 111 5 ? 5 +HELX_P HELX_P5 AA5 GLN B 92 ? ARG B 96 ? GLN A 84 ARG A 88 5 ? 5 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +disulf1 disulf ? ? A CYS 22 SG ? ? ? 1_555 A CYS 96 SG ? ? B CYS 21 B CYS 95 1_555 ? ? ? ? ? ? ? 2.040 ? ? +disulf2 disulf ? ? B CYS 29 SG ? ? ? 1_555 B CYS 101 SG ? ? A CYS 21 A CYS 93 1_555 ? ? ? ? ? ? ? 2.038 ? ? +# +_struct_conn_type.id disulf +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 CYS A 22 ? CYS A 96 ? CYS B 21 ? 1_555 CYS B 95 ? 1_555 SG SG . . . None 'Disulfide bridge' +2 CYS B 29 ? CYS B 101 ? CYS A 21 ? 1_555 CYS A 93 ? 1_555 SG SG . . . None 'Disulfide bridge' +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +AA1 ? 4 ? +AA2 ? 6 ? +AA3 ? 4 ? +AA4 ? 6 ? +AA5 ? 3 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +AA1 1 2 ? anti-parallel +AA1 2 3 ? anti-parallel +AA1 3 4 ? anti-parallel +AA2 1 2 ? parallel +AA2 2 3 ? anti-parallel +AA2 3 4 ? anti-parallel +AA2 4 5 ? anti-parallel +AA2 5 6 ? anti-parallel +AA3 1 2 ? parallel +AA3 2 3 ? anti-parallel +AA3 3 4 ? anti-parallel +AA4 1 2 ? parallel +AA4 2 3 ? anti-parallel +AA4 3 4 ? anti-parallel +AA4 4 5 ? anti-parallel +AA4 5 6 ? anti-parallel +AA5 1 2 ? anti-parallel +AA5 2 3 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA1 1 LEU A 4 ? SER A 7 ? LEU B 3 SER B 6 +AA1 2 LEU A 18 ? ALA A 24 ? LEU B 17 ALA B 23 +AA1 3 THR A 78 ? MET A 83 ? THR B 77 MET B 82 +AA1 4 PHE A 68 ? ASP A 73 ? PHE B 67 ASP B 72 +AA2 1 GLY A 10 ? GLN A 13 ? GLY B 9 GLN B 12 +AA2 2 THR A 119 ? SER A 124 ? THR B 118 SER B 123 +AA2 3 ALA A 92 ? GLY A 99 ? ALA B 91 GLY B 98 +AA2 4 GLY A 33 ? GLN A 39 ? GLY B 32 GLN B 38 +AA2 5 GLU A 46 ? ILE A 51 ? GLU B 45 ILE B 50 +AA2 6 THR A 58 ? TYR A 60 ? THR B 57 TYR B 59 +AA3 1 GLY A 10 ? GLN A 13 ? GLY B 9 GLN B 12 +AA3 2 THR A 119 ? SER A 124 ? THR B 118 SER B 123 +AA3 3 ALA A 92 ? GLY A 99 ? ALA B 91 GLY B 98 +AA3 4 TYR A 114 ? TRP A 115 ? TYR B 113 TRP B 114 +AA4 1 SER B 16 ? THR B 20 ? SER A 8 THR A 12 +AA4 2 GLN B 112 ? ARG B 124 ? GLN A 104 ARG A 116 +AA4 3 ASN B 97 ? GLN B 106 ? ASN A 89 GLN A 98 +AA4 4 ARG B 38 ? HIS B 48 ? ARG A 30 HIS A 40 +AA4 5 ASP B 51 ? ASP B 59 ? ASP A 43 ASP A 51 +AA4 6 GLY B 62 ? HIS B 64 ? GLY A 54 HIS A 56 +AA5 1 VAL B 25 ? ILE B 27 ? VAL A 17 ILE A 19 +AA5 2 LEU B 86 ? ILE B 88 ? LEU A 78 ILE A 80 +AA5 3 LEU B 74 ? VAL B 76 ? LEU A 66 VAL A 68 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +AA1 1 2 N SER A 7 ? N SER B 6 O SER A 21 ? O SER B 20 +AA1 2 3 N LEU A 18 ? N LEU B 17 O MET A 83 ? O MET B 82 +AA1 3 4 O GLN A 82 ? O GLN B 81 N THR A 69 ? N THR B 68 +AA2 1 2 N GLY A 10 ? N GLY B 9 O THR A 122 ? O THR B 121 +AA2 2 3 O THR A 119 ? O THR B 118 N TYR A 94 ? N TYR B 93 +AA2 3 4 O TYR A 95 ? O TYR B 94 N PHE A 37 ? N PHE B 36 +AA2 4 5 N TRP A 36 ? N TRP B 35 O ALA A 49 ? O ALA B 48 +AA2 5 6 N ALA A 50 ? N ALA B 49 O TYR A 59 ? O TYR B 58 +AA3 1 2 N GLY A 10 ? N GLY B 9 O THR A 122 ? O THR B 121 +AA3 2 3 O THR A 119 ? O THR B 118 N TYR A 94 ? N TYR B 93 +AA3 3 4 N ALA A 98 ? N ALA B 97 O TYR A 114 ? O TYR B 113 +AA4 1 2 N VAL B 17 ? N VAL A 9 O ARG B 122 ? O ARG A 114 +AA4 2 3 O LEU B 121 ? O LEU A 113 N ASN B 97 ? N ASN A 89 +AA4 3 4 O THR B 104 ? O THR A 96 N VAL B 40 ? N VAL A 32 +AA4 4 5 N HIS B 48 ? N HIS A 40 O ASP B 51 ? O ASP A 43 +AA4 5 6 N LEU B 57 ? N LEU A 49 O HIS B 64 ? O HIS A 56 +AA5 1 2 N ILE B 27 ? N ILE A 19 O LEU B 86 ? O LEU A 78 +AA5 2 3 O GLN B 87 ? O GLN A 79 N LYS B 75 ? N LYS A 67 +# +_pdbx_entry_details.entry_id 5IMM +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 HE21 A GLN 104 ? ? O A HOH 208 ? ? 1.54 +2 1 O A HOH 413 ? ? O A HOH 418 ? ? 1.62 +3 1 O B HOH 317 ? ? O B HOH 365 ? ? 1.86 +4 1 NH1 A ARG 27 ? ? O A HOH 201 ? ? 1.91 +5 1 O A HOH 231 ? ? O A HOH 283 ? ? 1.92 +6 1 O B HOH 204 ? ? O B HOH 270 ? ? 1.93 +7 1 O A HOH 364 ? ? O A HOH 407 ? ? 1.97 +8 1 O A HOH 292 ? ? O A HOH 302 ? ? 1.97 +9 1 O B HOH 236 ? ? O B HOH 364 ? ? 1.98 +10 1 O B HOH 255 ? ? O B HOH 361 ? ? 1.99 +11 1 O A HOH 348 ? ? O A HOH 382 ? ? 1.99 +12 1 O B HOH 276 ? ? O B HOH 311 ? ? 2.03 +13 1 NZ A LYS 117 ? ? O A HOH 202 ? ? 2.08 +14 1 OD1 A ASN 103 ? ? O A HOH 203 ? ? 2.09 +15 1 O B HOH 308 ? ? O B HOH 348 ? ? 2.10 +16 1 O A HOH 224 ? ? O A HOH 388 ? ? 2.15 +17 1 O A HOH 316 ? ? O A HOH 317 ? ? 2.15 +18 1 O A HOH 320 ? ? O A HOH 415 ? ? 2.17 +19 1 O A HOH 211 ? ? O A HOH 362 ? ? 2.17 +20 1 O A HOH 237 ? ? O A HOH 356 ? ? 2.18 +21 1 O A HOH 212 ? ? O A HOH 260 ? ? 2.18 +22 1 OD2 B ASP 101 ? ? O B HOH 201 ? ? 2.19 +23 1 ND1 A HIS 40 ? ? O A HOH 204 ? ? 2.19 +# +loop_ +_pdbx_validate_symm_contact.id +_pdbx_validate_symm_contact.PDB_model_num +_pdbx_validate_symm_contact.auth_atom_id_1 +_pdbx_validate_symm_contact.auth_asym_id_1 +_pdbx_validate_symm_contact.auth_comp_id_1 +_pdbx_validate_symm_contact.auth_seq_id_1 +_pdbx_validate_symm_contact.PDB_ins_code_1 +_pdbx_validate_symm_contact.label_alt_id_1 +_pdbx_validate_symm_contact.site_symmetry_1 +_pdbx_validate_symm_contact.auth_atom_id_2 +_pdbx_validate_symm_contact.auth_asym_id_2 +_pdbx_validate_symm_contact.auth_comp_id_2 +_pdbx_validate_symm_contact.auth_seq_id_2 +_pdbx_validate_symm_contact.PDB_ins_code_2 +_pdbx_validate_symm_contact.label_alt_id_2 +_pdbx_validate_symm_contact.site_symmetry_2 +_pdbx_validate_symm_contact.dist +1 1 O A HOH 206 ? ? 1_555 O A HOH 226 ? ? 3_355 2.00 +2 1 O B HOH 397 ? ? 1_555 O A HOH 426 ? ? 1_655 2.01 +3 1 O B HOH 274 ? ? 1_555 O B HOH 318 ? ? 1_455 2.11 +4 1 O B HOH 324 ? ? 1_555 O A HOH 247 ? ? 1_655 2.15 +5 1 O B HOH 220 ? ? 1_555 O B HOH 318 ? ? 1_455 2.17 +# +_pdbx_validate_rmsd_angle.id 1 +_pdbx_validate_rmsd_angle.PDB_model_num 1 +_pdbx_validate_rmsd_angle.auth_atom_id_1 CG +_pdbx_validate_rmsd_angle.auth_asym_id_1 B +_pdbx_validate_rmsd_angle.auth_comp_id_1 MET +_pdbx_validate_rmsd_angle.auth_seq_id_1 82 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 ? +_pdbx_validate_rmsd_angle.label_alt_id_1 ? +_pdbx_validate_rmsd_angle.auth_atom_id_2 SD +_pdbx_validate_rmsd_angle.auth_asym_id_2 B +_pdbx_validate_rmsd_angle.auth_comp_id_2 MET +_pdbx_validate_rmsd_angle.auth_seq_id_2 82 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 ? +_pdbx_validate_rmsd_angle.label_alt_id_2 ? +_pdbx_validate_rmsd_angle.auth_atom_id_3 CE +_pdbx_validate_rmsd_angle.auth_asym_id_3 B +_pdbx_validate_rmsd_angle.auth_comp_id_3 MET +_pdbx_validate_rmsd_angle.auth_seq_id_3 82 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 ? +_pdbx_validate_rmsd_angle.label_alt_id_3 ? +_pdbx_validate_rmsd_angle.angle_value 84.52 +_pdbx_validate_rmsd_angle.angle_target_value 100.20 +_pdbx_validate_rmsd_angle.angle_deviation -15.68 +_pdbx_validate_rmsd_angle.angle_standard_deviation 1.60 +_pdbx_validate_rmsd_angle.linker_flag N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 ALA B 91 ? ? 179.69 168.20 +2 1 ASP B 101 ? ? -109.65 -74.79 +3 1 THR A 82 ? ? 64.89 75.77 +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 B HIS 125 ? A HIS 126 +2 1 Y 1 B HIS 126 ? A HIS 127 +3 1 Y 1 B HIS 127 ? A HIS 128 +4 1 Y 1 B HIS 128 ? A HIS 129 +5 1 Y 1 B HIS 129 ? A HIS 130 +6 1 Y 1 B HIS 130 ? A HIS 131 +7 1 Y 1 A HIS -7 ? B HIS 1 +8 1 Y 1 A HIS -6 ? B HIS 2 +9 1 Y 1 A HIS -5 ? B HIS 3 +10 1 Y 1 A HIS -4 ? B HIS 4 +11 1 Y 1 A HIS -3 ? B HIS 5 +12 1 Y 1 A HIS -2 ? B HIS 6 +13 1 Y 1 A GLY -1 ? B GLY 7 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +GLN N N N N 88 +GLN CA C N S 89 +GLN C C N N 90 +GLN O O N N 91 +GLN CB C N N 92 +GLN CG C N N 93 +GLN CD C N N 94 +GLN OE1 O N N 95 +GLN NE2 N N N 96 +GLN OXT O N N 97 +GLN H H N N 98 +GLN H2 H N N 99 +GLN HA H N N 100 +GLN HB2 H N N 101 +GLN HB3 H N N 102 +GLN HG2 H N N 103 +GLN HG3 H N N 104 +GLN HE21 H N N 105 +GLN HE22 H N N 106 +GLN HXT H N N 107 +GLU N N N N 108 +GLU CA C N S 109 +GLU C C N N 110 +GLU O O N N 111 +GLU CB C N N 112 +GLU CG C N N 113 +GLU CD C N N 114 +GLU OE1 O N N 115 +GLU OE2 O N N 116 +GLU OXT O N N 117 +GLU H H N N 118 +GLU H2 H N N 119 +GLU HA H N N 120 +GLU HB2 H N N 121 +GLU HB3 H N N 122 +GLU HG2 H N N 123 +GLU HG3 H N N 124 +GLU HE2 H N N 125 +GLU HXT H N N 126 +GLY N N N N 127 +GLY CA C N N 128 +GLY C C N N 129 +GLY O O N N 130 +GLY OXT O N N 131 +GLY H H N N 132 +GLY H2 H N N 133 +GLY HA2 H N N 134 +GLY HA3 H N N 135 +GLY HXT H N N 136 +HIS N N N N 137 +HIS CA C N S 138 +HIS C C N N 139 +HIS O O N N 140 +HIS CB C N N 141 +HIS CG C Y N 142 +HIS ND1 N Y N 143 +HIS CD2 C Y N 144 +HIS CE1 C Y N 145 +HIS NE2 N Y N 146 +HIS OXT O N N 147 +HIS H H N N 148 +HIS H2 H N N 149 +HIS HA H N N 150 +HIS HB2 H N N 151 +HIS HB3 H N N 152 +HIS HD1 H N N 153 +HIS HD2 H N N 154 +HIS HE1 H N N 155 +HIS HE2 H N N 156 +HIS HXT H N N 157 +HOH O O N N 158 +HOH H1 H N N 159 +HOH H2 H N N 160 +ILE N N N N 161 +ILE CA C N S 162 +ILE C C N N 163 +ILE O O N N 164 +ILE CB C N S 165 +ILE CG1 C N N 166 +ILE CG2 C N N 167 +ILE CD1 C N N 168 +ILE OXT O N N 169 +ILE H H N N 170 +ILE H2 H N N 171 +ILE HA H N N 172 +ILE HB H N N 173 +ILE HG12 H N N 174 +ILE HG13 H N N 175 +ILE HG21 H N N 176 +ILE HG22 H N N 177 +ILE HG23 H N N 178 +ILE HD11 H N N 179 +ILE HD12 H N N 180 +ILE HD13 H N N 181 +ILE HXT H N N 182 +LEU N N N N 183 +LEU CA C N S 184 +LEU C C N N 185 +LEU O O N N 186 +LEU CB C N N 187 +LEU CG C N N 188 +LEU CD1 C N N 189 +LEU CD2 C N N 190 +LEU OXT O N N 191 +LEU H H N N 192 +LEU H2 H N N 193 +LEU HA H N N 194 +LEU HB2 H N N 195 +LEU HB3 H N N 196 +LEU HG H N N 197 +LEU HD11 H N N 198 +LEU HD12 H N N 199 +LEU HD13 H N N 200 +LEU HD21 H N N 201 +LEU HD22 H N N 202 +LEU HD23 H N N 203 +LEU HXT H N N 204 +LYS N N N N 205 +LYS CA C N S 206 +LYS C C N N 207 +LYS O O N N 208 +LYS CB C N N 209 +LYS CG C N N 210 +LYS CD C N N 211 +LYS CE C N N 212 +LYS NZ N N N 213 +LYS OXT O N N 214 +LYS H H N N 215 +LYS H2 H N N 216 +LYS HA H N N 217 +LYS HB2 H N N 218 +LYS HB3 H N N 219 +LYS HG2 H N N 220 +LYS HG3 H N N 221 +LYS HD2 H N N 222 +LYS HD3 H N N 223 +LYS HE2 H N N 224 +LYS HE3 H N N 225 +LYS HZ1 H N N 226 +LYS HZ2 H N N 227 +LYS HZ3 H N N 228 +LYS HXT H N N 229 +MET N N N N 230 +MET CA C N S 231 +MET C C N N 232 +MET O O N N 233 +MET CB C N N 234 +MET CG C N N 235 +MET SD S N N 236 +MET CE C N N 237 +MET OXT O N N 238 +MET H H N N 239 +MET H2 H N N 240 +MET HA H N N 241 +MET HB2 H N N 242 +MET HB3 H N N 243 +MET HG2 H N N 244 +MET HG3 H N N 245 +MET HE1 H N N 246 +MET HE2 H N N 247 +MET HE3 H N N 248 +MET HXT H N N 249 +PHE N N N N 250 +PHE CA C N S 251 +PHE C C N N 252 +PHE O O N N 253 +PHE CB C N N 254 +PHE CG C Y N 255 +PHE CD1 C Y N 256 +PHE CD2 C Y N 257 +PHE CE1 C Y N 258 +PHE CE2 C Y N 259 +PHE CZ C Y N 260 +PHE OXT O N N 261 +PHE H H N N 262 +PHE H2 H N N 263 +PHE HA H N N 264 +PHE HB2 H N N 265 +PHE HB3 H N N 266 +PHE HD1 H N N 267 +PHE HD2 H N N 268 +PHE HE1 H N N 269 +PHE HE2 H N N 270 +PHE HZ H N N 271 +PHE HXT H N N 272 +PRO N N N N 273 +PRO CA C N S 274 +PRO C C N N 275 +PRO O O N N 276 +PRO CB C N N 277 +PRO CG C N N 278 +PRO CD C N N 279 +PRO OXT O N N 280 +PRO H H N N 281 +PRO HA H N N 282 +PRO HB2 H N N 283 +PRO HB3 H N N 284 +PRO HG2 H N N 285 +PRO HG3 H N N 286 +PRO HD2 H N N 287 +PRO HD3 H N N 288 +PRO HXT H N N 289 +SER N N N N 290 +SER CA C N S 291 +SER C C N N 292 +SER O O N N 293 +SER CB C N N 294 +SER OG O N N 295 +SER OXT O N N 296 +SER H H N N 297 +SER H2 H N N 298 +SER HA H N N 299 +SER HB2 H N N 300 +SER HB3 H N N 301 +SER HG H N N 302 +SER HXT H N N 303 +THR N N N N 304 +THR CA C N S 305 +THR C C N N 306 +THR O O N N 307 +THR CB C N R 308 +THR OG1 O N N 309 +THR CG2 C N N 310 +THR OXT O N N 311 +THR H H N N 312 +THR H2 H N N 313 +THR HA H N N 314 +THR HB H N N 315 +THR HG1 H N N 316 +THR HG21 H N N 317 +THR HG22 H N N 318 +THR HG23 H N N 319 +THR HXT H N N 320 +TRP N N N N 321 +TRP CA C N S 322 +TRP C C N N 323 +TRP O O N N 324 +TRP CB C N N 325 +TRP CG C Y N 326 +TRP CD1 C Y N 327 +TRP CD2 C Y N 328 +TRP NE1 N Y N 329 +TRP CE2 C Y N 330 +TRP CE3 C Y N 331 +TRP CZ2 C Y N 332 +TRP CZ3 C Y N 333 +TRP CH2 C Y N 334 +TRP OXT O N N 335 +TRP H H N N 336 +TRP H2 H N N 337 +TRP HA H N N 338 +TRP HB2 H N N 339 +TRP HB3 H N N 340 +TRP HD1 H N N 341 +TRP HE1 H N N 342 +TRP HE3 H N N 343 +TRP HZ2 H N N 344 +TRP HZ3 H N N 345 +TRP HH2 H N N 346 +TRP HXT H N N 347 +TYR N N N N 348 +TYR CA C N S 349 +TYR C C N N 350 +TYR O O N N 351 +TYR CB C N N 352 +TYR CG C Y N 353 +TYR CD1 C Y N 354 +TYR CD2 C Y N 355 +TYR CE1 C Y N 356 +TYR CE2 C Y N 357 +TYR CZ C Y N 358 +TYR OH O N N 359 +TYR OXT O N N 360 +TYR H H N N 361 +TYR H2 H N N 362 +TYR HA H N N 363 +TYR HB2 H N N 364 +TYR HB3 H N N 365 +TYR HD1 H N N 366 +TYR HD2 H N N 367 +TYR HE1 H N N 368 +TYR HE2 H N N 369 +TYR HH H N N 370 +TYR HXT H N N 371 +VAL N N N N 372 +VAL CA C N S 373 +VAL C C N N 374 +VAL O O N N 375 +VAL CB C N N 376 +VAL CG1 C N N 377 +VAL CG2 C N N 378 +VAL OXT O N N 379 +VAL H H N N 380 +VAL H2 H N N 381 +VAL HA H N N 382 +VAL HB H N N 383 +VAL HG11 H N N 384 +VAL HG12 H N N 385 +VAL HG13 H N N 386 +VAL HG21 H N N 387 +VAL HG22 H N N 388 +VAL HG23 H N N 389 +VAL HXT H N N 390 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +GLN N CA sing N N 83 +GLN N H sing N N 84 +GLN N H2 sing N N 85 +GLN CA C sing N N 86 +GLN CA CB sing N N 87 +GLN CA HA sing N N 88 +GLN C O doub N N 89 +GLN C OXT sing N N 90 +GLN CB CG sing N N 91 +GLN CB HB2 sing N N 92 +GLN CB HB3 sing N N 93 +GLN CG CD sing N N 94 +GLN CG HG2 sing N N 95 +GLN CG HG3 sing N N 96 +GLN CD OE1 doub N N 97 +GLN CD NE2 sing N N 98 +GLN NE2 HE21 sing N N 99 +GLN NE2 HE22 sing N N 100 +GLN OXT HXT sing N N 101 +GLU N CA sing N N 102 +GLU N H sing N N 103 +GLU N H2 sing N N 104 +GLU CA C sing N N 105 +GLU CA CB sing N N 106 +GLU CA HA sing N N 107 +GLU C O doub N N 108 +GLU C OXT sing N N 109 +GLU CB CG sing N N 110 +GLU CB HB2 sing N N 111 +GLU CB HB3 sing N N 112 +GLU CG CD sing N N 113 +GLU CG HG2 sing N N 114 +GLU CG HG3 sing N N 115 +GLU CD OE1 doub N N 116 +GLU CD OE2 sing N N 117 +GLU OE2 HE2 sing N N 118 +GLU OXT HXT sing N N 119 +GLY N CA sing N N 120 +GLY N H sing N N 121 +GLY N H2 sing N N 122 +GLY CA C sing N N 123 +GLY CA HA2 sing N N 124 +GLY CA HA3 sing N N 125 +GLY C O doub N N 126 +GLY C OXT sing N N 127 +GLY OXT HXT sing N N 128 +HIS N CA sing N N 129 +HIS N H sing N N 130 +HIS N H2 sing N N 131 +HIS CA C sing N N 132 +HIS CA CB sing N N 133 +HIS CA HA sing N N 134 +HIS C O doub N N 135 +HIS C OXT sing N N 136 +HIS CB CG sing N N 137 +HIS CB HB2 sing N N 138 +HIS CB HB3 sing N N 139 +HIS CG ND1 sing Y N 140 +HIS CG CD2 doub Y N 141 +HIS ND1 CE1 doub Y N 142 +HIS ND1 HD1 sing N N 143 +HIS CD2 NE2 sing Y N 144 +HIS CD2 HD2 sing N N 145 +HIS CE1 NE2 sing Y N 146 +HIS CE1 HE1 sing N N 147 +HIS NE2 HE2 sing N N 148 +HIS OXT HXT sing N N 149 +HOH O H1 sing N N 150 +HOH O H2 sing N N 151 +ILE N CA sing N N 152 +ILE N H sing N N 153 +ILE N H2 sing N N 154 +ILE CA C sing N N 155 +ILE CA CB sing N N 156 +ILE CA HA sing N N 157 +ILE C O doub N N 158 +ILE C OXT sing N N 159 +ILE CB CG1 sing N N 160 +ILE CB CG2 sing N N 161 +ILE CB HB sing N N 162 +ILE CG1 CD1 sing N N 163 +ILE CG1 HG12 sing N N 164 +ILE CG1 HG13 sing N N 165 +ILE CG2 HG21 sing N N 166 +ILE CG2 HG22 sing N N 167 +ILE CG2 HG23 sing N N 168 +ILE CD1 HD11 sing N N 169 +ILE CD1 HD12 sing N N 170 +ILE CD1 HD13 sing N N 171 +ILE OXT HXT sing N N 172 +LEU N CA sing N N 173 +LEU N H sing N N 174 +LEU N H2 sing N N 175 +LEU CA C sing N N 176 +LEU CA CB sing N N 177 +LEU CA HA sing N N 178 +LEU C O doub N N 179 +LEU C OXT sing N N 180 +LEU CB CG sing N N 181 +LEU CB HB2 sing N N 182 +LEU CB HB3 sing N N 183 +LEU CG CD1 sing N N 184 +LEU CG CD2 sing N N 185 +LEU CG HG sing N N 186 +LEU CD1 HD11 sing N N 187 +LEU CD1 HD12 sing N N 188 +LEU CD1 HD13 sing N N 189 +LEU CD2 HD21 sing N N 190 +LEU CD2 HD22 sing N N 191 +LEU CD2 HD23 sing N N 192 +LEU OXT HXT sing N N 193 +LYS N CA sing N N 194 +LYS N H sing N N 195 +LYS N H2 sing N N 196 +LYS CA C sing N N 197 +LYS CA CB sing N N 198 +LYS CA HA sing N N 199 +LYS C O doub N N 200 +LYS C OXT sing N N 201 +LYS CB CG sing N N 202 +LYS CB HB2 sing N N 203 +LYS CB HB3 sing N N 204 +LYS CG CD sing N N 205 +LYS CG HG2 sing N N 206 +LYS CG HG3 sing N N 207 +LYS CD CE sing N N 208 +LYS CD HD2 sing N N 209 +LYS CD HD3 sing N N 210 +LYS CE NZ sing N N 211 +LYS CE HE2 sing N N 212 +LYS CE HE3 sing N N 213 +LYS NZ HZ1 sing N N 214 +LYS NZ HZ2 sing N N 215 +LYS NZ HZ3 sing N N 216 +LYS OXT HXT sing N N 217 +MET N CA sing N N 218 +MET N H sing N N 219 +MET N H2 sing N N 220 +MET CA C sing N N 221 +MET CA CB sing N N 222 +MET CA HA sing N N 223 +MET C O doub N N 224 +MET C OXT sing N N 225 +MET CB CG sing N N 226 +MET CB HB2 sing N N 227 +MET CB HB3 sing N N 228 +MET CG SD sing N N 229 +MET CG HG2 sing N N 230 +MET CG HG3 sing N N 231 +MET SD CE sing N N 232 +MET CE HE1 sing N N 233 +MET CE HE2 sing N N 234 +MET CE HE3 sing N N 235 +MET OXT HXT sing N N 236 +PHE N CA sing N N 237 +PHE N H sing N N 238 +PHE N H2 sing N N 239 +PHE CA C sing N N 240 +PHE CA CB sing N N 241 +PHE CA HA sing N N 242 +PHE C O doub N N 243 +PHE C OXT sing N N 244 +PHE CB CG sing N N 245 +PHE CB HB2 sing N N 246 +PHE CB HB3 sing N N 247 +PHE CG CD1 doub Y N 248 +PHE CG CD2 sing Y N 249 +PHE CD1 CE1 sing Y N 250 +PHE CD1 HD1 sing N N 251 +PHE CD2 CE2 doub Y N 252 +PHE CD2 HD2 sing N N 253 +PHE CE1 CZ doub Y N 254 +PHE CE1 HE1 sing N N 255 +PHE CE2 CZ sing Y N 256 +PHE CE2 HE2 sing N N 257 +PHE CZ HZ sing N N 258 +PHE OXT HXT sing N N 259 +PRO N CA sing N N 260 +PRO N CD sing N N 261 +PRO N H sing N N 262 +PRO CA C sing N N 263 +PRO CA CB sing N N 264 +PRO CA HA sing N N 265 +PRO C O doub N N 266 +PRO C OXT sing N N 267 +PRO CB CG sing N N 268 +PRO CB HB2 sing N N 269 +PRO CB HB3 sing N N 270 +PRO CG CD sing N N 271 +PRO CG HG2 sing N N 272 +PRO CG HG3 sing N N 273 +PRO CD HD2 sing N N 274 +PRO CD HD3 sing N N 275 +PRO OXT HXT sing N N 276 +SER N CA sing N N 277 +SER N H sing N N 278 +SER N H2 sing N N 279 +SER CA C sing N N 280 +SER CA CB sing N N 281 +SER CA HA sing N N 282 +SER C O doub N N 283 +SER C OXT sing N N 284 +SER CB OG sing N N 285 +SER CB HB2 sing N N 286 +SER CB HB3 sing N N 287 +SER OG HG sing N N 288 +SER OXT HXT sing N N 289 +THR N CA sing N N 290 +THR N H sing N N 291 +THR N H2 sing N N 292 +THR CA C sing N N 293 +THR CA CB sing N N 294 +THR CA HA sing N N 295 +THR C O doub N N 296 +THR C OXT sing N N 297 +THR CB OG1 sing N N 298 +THR CB CG2 sing N N 299 +THR CB HB sing N N 300 +THR OG1 HG1 sing N N 301 +THR CG2 HG21 sing N N 302 +THR CG2 HG22 sing N N 303 +THR CG2 HG23 sing N N 304 +THR OXT HXT sing N N 305 +TRP N CA sing N N 306 +TRP N H sing N N 307 +TRP N H2 sing N N 308 +TRP CA C sing N N 309 +TRP CA CB sing N N 310 +TRP CA HA sing N N 311 +TRP C O doub N N 312 +TRP C OXT sing N N 313 +TRP CB CG sing N N 314 +TRP CB HB2 sing N N 315 +TRP CB HB3 sing N N 316 +TRP CG CD1 doub Y N 317 +TRP CG CD2 sing Y N 318 +TRP CD1 NE1 sing Y N 319 +TRP CD1 HD1 sing N N 320 +TRP CD2 CE2 doub Y N 321 +TRP CD2 CE3 sing Y N 322 +TRP NE1 CE2 sing Y N 323 +TRP NE1 HE1 sing N N 324 +TRP CE2 CZ2 sing Y N 325 +TRP CE3 CZ3 doub Y N 326 +TRP CE3 HE3 sing N N 327 +TRP CZ2 CH2 doub Y N 328 +TRP CZ2 HZ2 sing N N 329 +TRP CZ3 CH2 sing Y N 330 +TRP CZ3 HZ3 sing N N 331 +TRP CH2 HH2 sing N N 332 +TRP OXT HXT sing N N 333 +TYR N CA sing N N 334 +TYR N H sing N N 335 +TYR N H2 sing N N 336 +TYR CA C sing N N 337 +TYR CA CB sing N N 338 +TYR CA HA sing N N 339 +TYR C O doub N N 340 +TYR C OXT sing N N 341 +TYR CB CG sing N N 342 +TYR CB HB2 sing N N 343 +TYR CB HB3 sing N N 344 +TYR CG CD1 doub Y N 345 +TYR CG CD2 sing Y N 346 +TYR CD1 CE1 sing Y N 347 +TYR CD1 HD1 sing N N 348 +TYR CD2 CE2 doub Y N 349 +TYR CD2 HD2 sing N N 350 +TYR CE1 CZ doub Y N 351 +TYR CE1 HE1 sing N N 352 +TYR CE2 CZ sing Y N 353 +TYR CE2 HE2 sing N N 354 +TYR CZ OH sing N N 355 +TYR OH HH sing N N 356 +TYR OXT HXT sing N N 357 +VAL N CA sing N N 358 +VAL N H sing N N 359 +VAL N H2 sing N N 360 +VAL CA C sing N N 361 +VAL CA CB sing N N 362 +VAL CA HA sing N N 363 +VAL C O doub N N 364 +VAL C OXT sing N N 365 +VAL CB CG1 sing N N 366 +VAL CB CG2 sing N N 367 +VAL CB HB sing N N 368 +VAL CG1 HG11 sing N N 369 +VAL CG1 HG12 sing N N 370 +VAL CG1 HG13 sing N N 371 +VAL CG2 HG21 sing N N 372 +VAL CG2 HG22 sing N N 373 +VAL CG2 HG23 sing N N 374 +VAL OXT HXT sing N N 375 +# +_atom_sites.entry_id 5IMM +_atom_sites.fract_transf_matrix[1][1] 0.033786 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.019887 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.006127 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +H +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . GLN A 1 1 ? -24.931 18.015 10.995 1.00 34.89 ? 0 GLN B N 1 +ATOM 2 C CA . GLN A 1 1 ? -24.335 17.010 10.073 1.00 30.35 ? 0 GLN B CA 1 +ATOM 3 C C . GLN A 1 1 ? -22.920 17.410 9.649 1.00 25.47 ? 0 GLN B C 1 +ATOM 4 O O . GLN A 1 1 ? -22.737 18.290 8.805 1.00 32.17 ? 0 GLN B O 1 +ATOM 5 C CB . GLN A 1 1 ? -25.216 16.856 8.837 1.00 28.56 ? 0 GLN B CB 1 +ATOM 6 C CG . GLN A 1 1 ? -24.828 15.683 7.959 1.00 30.33 ? 0 GLN B CG 1 +ATOM 7 C CD . GLN A 1 1 ? -25.238 15.863 6.508 1.00 32.62 ? 0 GLN B CD 1 +ATOM 8 O OE1 . GLN A 1 1 ? -25.994 16.777 6.166 1.00 41.73 ? 0 GLN B OE1 1 +ATOM 9 N NE2 . GLN A 1 1 ? -24.735 14.991 5.644 1.00 37.11 ? 0 GLN B NE2 1 +ATOM 10 H H1 . GLN A 1 1 ? -25.755 17.763 11.215 1.00 41.87 ? 0 GLN B H1 1 +ATOM 11 H H2 . GLN A 1 1 ? -24.432 18.075 11.730 1.00 41.87 ? 0 GLN B H2 1 +ATOM 12 H H3 . GLN A 1 1 ? -24.960 18.807 10.591 1.00 41.87 ? 0 GLN B H3 1 +ATOM 13 H HA . GLN A 1 1 ? -24.287 16.151 10.522 1.00 36.42 ? 0 GLN B HA 1 +ATOM 14 H HB2 . GLN A 1 1 ? -26.134 16.724 9.121 1.00 34.28 ? 0 GLN B HB2 1 +ATOM 15 H HB3 . GLN A 1 1 ? -25.149 17.662 8.302 1.00 34.28 ? 0 GLN B HB3 1 +ATOM 16 H HG2 . GLN A 1 1 ? -23.865 15.574 7.986 1.00 36.39 ? 0 GLN B HG2 1 +ATOM 17 H HG3 . GLN A 1 1 ? -25.261 14.882 8.295 1.00 36.39 ? 0 GLN B HG3 1 +ATOM 18 H HE21 . GLN A 1 1 ? -24.208 14.369 5.919 1.00 44.53 ? 0 GLN B HE21 1 +ATOM 19 H HE22 . GLN A 1 1 ? -24.935 15.048 4.810 1.00 44.53 ? 0 GLN B HE22 1 +ATOM 20 N N . VAL A 1 2 ? -21.927 16.738 10.215 1.00 20.01 ? 1 VAL B N 1 +ATOM 21 C CA . VAL A 1 2 ? -20.541 17.012 9.888 1.00 14.71 ? 1 VAL B CA 1 +ATOM 22 C C . VAL A 1 2 ? -20.156 16.159 8.692 1.00 13.94 ? 1 VAL B C 1 +ATOM 23 O O . VAL A 1 2 ? -20.455 14.965 8.641 1.00 16.42 ? 1 VAL B O 1 +ATOM 24 C CB . VAL A 1 2 ? -19.637 16.692 11.091 1.00 17.39 ? 1 VAL B CB 1 +ATOM 25 C CG1 . VAL A 1 2 ? -18.175 16.856 10.745 1.00 16.45 ? 1 VAL B CG1 1 +ATOM 26 C CG2 . VAL A 1 2 ? -20.005 17.590 12.257 1.00 18.74 ? 1 VAL B CG2 1 +ATOM 27 H H . VAL A 1 2 ? -22.033 16.113 10.796 1.00 24.01 ? 1 VAL B H 1 +ATOM 28 H HA . VAL A 1 2 ? -20.435 17.947 9.655 1.00 17.66 ? 1 VAL B HA 1 +ATOM 29 H HB . VAL A 1 2 ? -19.781 15.772 11.361 1.00 20.87 ? 1 VAL B HB 1 +ATOM 30 H HG11 . VAL A 1 2 ? -17.640 16.646 11.527 1.00 19.73 ? 1 VAL B HG11 1 +ATOM 31 H HG12 . VAL A 1 2 ? -17.952 16.251 10.020 1.00 19.73 ? 1 VAL B HG12 1 +ATOM 32 H HG13 . VAL A 1 2 ? -18.016 17.773 10.472 1.00 19.73 ? 1 VAL B HG13 1 +ATOM 33 H HG21 . VAL A 1 2 ? -19.430 17.381 13.010 1.00 22.49 ? 1 VAL B HG21 1 +ATOM 34 H HG22 . VAL A 1 2 ? -19.883 18.516 11.994 1.00 22.49 ? 1 VAL B HG22 1 +ATOM 35 H HG23 . VAL A 1 2 ? -20.933 17.433 12.495 1.00 22.49 ? 1 VAL B HG23 1 +ATOM 36 N N . GLN A 1 3 ? -19.494 16.781 7.728 1.00 10.72 ? 2 GLN B N 1 +ATOM 37 C CA . GLN A 1 3 ? -18.998 16.072 6.554 1.00 10.52 ? 2 GLN B CA 1 +ATOM 38 C C . GLN A 1 3 ? -17.513 15.856 6.722 1.00 10.13 ? 2 GLN B C 1 +ATOM 39 O O . GLN A 1 3 ? -16.805 16.764 7.120 1.00 10.87 ? 2 GLN B O 1 +ATOM 40 C CB . GLN A 1 3 ? -19.225 16.894 5.296 1.00 12.38 ? 2 GLN B CB 1 +ATOM 41 C CG . GLN A 1 3 ? -20.647 17.347 5.093 1.00 16.33 ? 2 GLN B CG 1 +ATOM 42 C CD . GLN A 1 3 ? -20.717 18.445 4.078 1.00 18.81 ? 2 GLN B CD 1 +ATOM 43 O OE1 . GLN A 1 3 ? -20.429 19.603 4.388 1.00 21.09 ? 2 GLN B OE1 1 +ATOM 44 N NE2 . GLN A 1 3 ? -21.069 18.095 2.853 1.00 16.04 ? 2 GLN B NE2 1 +ATOM 45 H H . GLN A 1 3 ? -19.315 17.622 7.728 1.00 12.87 ? 2 GLN B H 1 +ATOM 46 H HA . GLN A 1 3 ? -19.442 15.214 6.465 1.00 12.62 ? 2 GLN B HA 1 +ATOM 47 H HB2 . GLN A 1 3 ? -18.667 17.686 5.338 1.00 14.86 ? 2 GLN B HB2 1 +ATOM 48 H HB3 . GLN A 1 3 ? -18.975 16.358 4.526 1.00 14.86 ? 2 GLN B HB3 1 +ATOM 49 H HG2 . GLN A 1 3 ? -21.180 16.602 4.776 1.00 19.60 ? 2 GLN B HG2 1 +ATOM 50 H HG3 . GLN A 1 3 ? -21.000 17.683 5.932 1.00 19.60 ? 2 GLN B HG3 1 +ATOM 51 H HE21 . GLN A 1 3 ? -21.243 17.273 2.674 1.00 19.25 ? 2 GLN B HE21 1 +ATOM 52 H HE22 . GLN A 1 3 ? -21.124 18.691 2.235 1.00 19.25 ? 2 GLN B HE22 1 +ATOM 53 N N . LEU A 1 4 ? -17.039 14.663 6.375 1.00 9.31 ? 3 LEU B N 1 +ATOM 54 C CA . LEU A 1 4 ? -15.641 14.296 6.510 1.00 8.58 ? 3 LEU B CA 1 +ATOM 55 C C . LEU A 1 4 ? -15.082 13.909 5.163 1.00 8.16 ? 3 LEU B C 1 +ATOM 56 O O . LEU A 1 4 ? -15.752 13.198 4.403 1.00 9.10 ? 3 LEU B O 1 +ATOM 57 C CB . LEU A 1 4 ? -15.521 13.094 7.428 1.00 8.80 ? 3 LEU B CB 1 +ATOM 58 C CG . LEU A 1 4 ? -16.098 13.280 8.825 1.00 8.73 ? 3 LEU B CG 1 +ATOM 59 C CD1 . LEU A 1 4 ? -16.035 11.971 9.586 1.00 10.81 ? 3 LEU B CD1 1 +ATOM 60 C CD2 . LEU A 1 4 ? -15.396 14.395 9.584 1.00 9.93 ? 3 LEU B CD2 1 +ATOM 61 H H . LEU A 1 4 ? -17.526 14.033 6.049 1.00 11.17 ? 3 LEU B H 1 +ATOM 62 H HA . LEU A 1 4 ? -15.128 15.035 6.875 1.00 10.29 ? 3 LEU B HA 1 +ATOM 63 H HB2 . LEU A 1 4 ? -15.986 12.347 7.019 1.00 10.57 ? 3 LEU B HB2 1 +ATOM 64 H HB3 . LEU A 1 4 ? -14.581 12.876 7.528 1.00 10.57 ? 3 LEU B HB3 1 +ATOM 65 H HG . LEU A 1 4 ? -17.032 13.526 8.742 1.00 10.48 ? 3 LEU B HG 1 +ATOM 66 H HD11 . LEU A 1 4 ? -16.405 12.105 10.473 1.00 12.98 ? 3 LEU B HD11 1 +ATOM 67 H HD12 . LEU A 1 4 ? -16.552 11.304 9.109 1.00 12.98 ? 3 LEU B HD12 1 +ATOM 68 H HD13 . LEU A 1 4 ? -15.109 11.689 9.653 1.00 12.98 ? 3 LEU B HD13 1 +ATOM 69 H HD21 . LEU A 1 4 ? -15.796 14.476 10.464 1.00 11.91 ? 3 LEU B HD21 1 +ATOM 70 H HD22 . LEU A 1 4 ? -14.455 14.176 9.667 1.00 11.91 ? 3 LEU B HD22 1 +ATOM 71 H HD23 . LEU A 1 4 ? -15.502 15.225 9.094 1.00 11.91 ? 3 LEU B HD23 1 +ATOM 72 N N . VAL A 1 5 ? -13.874 14.368 4.861 1.00 7.92 ? 4 VAL B N 1 +ATOM 73 C CA . VAL A 1 5 ? -13.227 14.048 3.595 1.00 8.36 ? 4 VAL B CA 1 +ATOM 74 C C . VAL A 1 5 ? -11.789 13.628 3.844 1.00 7.84 ? 4 VAL B C 1 +ATOM 75 O O . VAL A 1 5 ? -10.992 14.407 4.371 1.00 8.50 ? 4 VAL B O 1 +ATOM 76 C CB . VAL A 1 5 ? -13.225 15.260 2.644 1.00 10.79 ? 4 VAL B CB 1 +ATOM 77 C CG1 . VAL A 1 5 ? -12.500 14.933 1.345 1.00 11.32 ? 4 VAL B CG1 1 +ATOM 78 C CG2 . VAL A 1 5 ? -14.642 15.709 2.350 1.00 11.30 ? 4 VAL B CG2 1 +ATOM 79 H H . VAL A 1 5 ? -13.404 14.870 5.376 1.00 9.51 ? 4 VAL B H 1 +ATOM 80 H HA . VAL A 1 5 ? -13.695 13.316 3.164 1.00 10.03 ? 4 VAL B HA 1 +ATOM 81 H HB . VAL A 1 5 ? -12.759 15.996 3.071 1.00 12.94 ? 4 VAL B HB 1 +ATOM 82 H HG11 . VAL A 1 5 ? -12.516 15.714 0.770 1.00 13.59 ? 4 VAL B HG11 1 +ATOM 83 H HG12 . VAL A 1 5 ? -11.583 14.690 1.549 1.00 13.59 ? 4 VAL B HG12 1 +ATOM 84 H HG13 . VAL A 1 5 ? -12.950 14.192 0.911 1.00 13.59 ? 4 VAL B HG13 1 +ATOM 85 H HG21 . VAL A 1 5 ? -14.613 16.471 1.751 1.00 13.56 ? 4 VAL B HG21 1 +ATOM 86 H HG22 . VAL A 1 5 ? -15.125 14.978 1.934 1.00 13.56 ? 4 VAL B HG22 1 +ATOM 87 H HG23 . VAL A 1 5 ? -15.073 15.959 3.183 1.00 13.56 ? 4 VAL B HG23 1 +ATOM 88 N N . GLU A 1 6 ? -11.467 12.402 3.456 1.00 8.73 ? 5 GLU B N 1 +ATOM 89 C CA . GLU A 1 6 ? -10.101 11.891 3.543 1.00 8.92 ? 5 GLU B CA 1 +ATOM 90 C C . GLU A 1 6 ? -9.247 12.321 2.362 1.00 8.67 ? 5 GLU B C 1 +ATOM 91 O O . GLU A 1 6 ? -9.745 12.422 1.231 1.00 10.79 ? 5 GLU B O 1 +ATOM 92 C CB . GLU A 1 6 ? -10.111 10.370 3.550 1.00 9.31 ? 5 GLU B CB 1 +ATOM 93 C CG . GLU A 1 6 ? -10.956 9.742 4.640 1.00 10.27 ? 5 GLU B CG 1 +ATOM 94 C CD . GLU A 1 6 ? -12.404 9.498 4.270 1.00 8.81 ? 5 GLU B CD 1 +ATOM 95 O OE1 . GLU A 1 6 ? -12.851 9.966 3.196 1.00 9.72 ? 5 GLU B OE1 1 +ATOM 96 O OE2 . GLU A 1 6 ? -13.100 8.845 5.069 1.00 8.83 -1 5 GLU B OE2 1 +ATOM 97 H H . GLU A 1 6 ? -12.028 11.835 3.134 1.00 10.47 ? 5 GLU B H 1 +ATOM 98 H HA . GLU A 1 6 ? -9.685 12.205 4.361 1.00 10.70 ? 5 GLU B HA 1 +ATOM 99 H HB2 . GLU A 1 6 ? -10.455 10.060 2.698 1.00 11.18 ? 5 GLU B HB2 1 +ATOM 100 H HB3 . GLU A 1 6 ? -9.201 10.056 3.668 1.00 11.18 ? 5 GLU B HB3 1 +ATOM 101 H HG2 . GLU A 1 6 ? -10.566 8.886 4.877 1.00 12.32 ? 5 GLU B HG2 1 +ATOM 102 H HG3 . GLU A 1 6 ? -10.947 10.328 5.413 1.00 12.32 ? 5 GLU B HG3 1 +ATOM 103 N N . SER A 1 7 ? -7.962 12.530 2.613 1.00 8.36 ? 6 SER B N 1 +ATOM 104 C CA . SER A 1 7 ? -6.983 12.820 1.567 1.00 9.99 ? 6 SER B CA 1 +ATOM 105 C C . SER A 1 7 ? -5.687 12.081 1.866 1.00 9.25 ? 6 SER B C 1 +ATOM 106 O O . SER A 1 7 ? -5.433 11.664 3.005 1.00 9.76 ? 6 SER B O 1 +ATOM 107 C CB . SER A 1 7 ? -6.678 14.316 1.507 1.00 12.57 ? 6 SER B CB 1 +ATOM 108 O OG . SER A 1 7 ? -7.811 15.073 1.117 1.00 15.52 ? 6 SER B OG 1 +ATOM 109 H H . SER A 1 7 ? -7.621 12.508 3.403 1.00 10.03 ? 6 SER B H 1 +ATOM 110 H HA . SER A 1 7 ? -7.321 12.531 0.705 1.00 11.98 ? 6 SER B HA 1 +ATOM 111 H HB2 . SER A 1 7 ? -6.392 14.611 2.386 1.00 15.08 ? 6 SER B HB2 1 +ATOM 112 H HB3 . SER A 1 7 ? -5.967 14.464 0.864 1.00 15.08 ? 6 SER B HB3 1 +ATOM 113 H HG . SER A 1 7 ? -7.617 15.889 1.092 1.00 18.63 ? 6 SER B HG 1 +ATOM 114 N N . GLY A 1 8 ? -4.843 11.956 0.845 1.00 10.50 ? 7 GLY B N 1 +ATOM 115 C CA . GLY A 1 8 ? -3.499 11.455 1.025 1.00 10.09 ? 7 GLY B CA 1 +ATOM 116 C C . GLY A 1 8 ? -3.315 9.996 0.657 1.00 10.12 ? 7 GLY B C 1 +ATOM 117 O O . GLY A 1 8 ? -2.208 9.457 0.765 1.00 10.55 ? 7 GLY B O 1 +ATOM 118 H H . GLY A 1 8 ? -5.033 12.159 0.032 1.00 12.60 ? 7 GLY B H 1 +ATOM 119 H HA2 . GLY A 1 8 ? -2.891 11.980 0.481 1.00 12.11 ? 7 GLY B HA2 1 +ATOM 120 H HA3 . GLY A 1 8 ? -3.243 11.564 1.954 1.00 12.11 ? 7 GLY B HA3 1 +ATOM 121 N N . GLY A 1 9 ? -4.382 9.327 0.238 1.00 9.82 ? 8 GLY B N 1 +ATOM 122 C CA . GLY A 1 9 ? -4.251 7.933 -0.136 1.00 10.39 ? 8 GLY B CA 1 +ATOM 123 C C . GLY A 1 9 ? -3.433 7.757 -1.412 1.00 10.44 ? 8 GLY B C 1 +ATOM 124 O O . GLY A 1 9 ? -3.228 8.696 -2.177 1.00 10.76 ? 8 GLY B O 1 +ATOM 125 H H . GLY A 1 9 ? -5.175 9.651 0.163 1.00 11.78 ? 8 GLY B H 1 +ATOM 126 H HA2 . GLY A 1 9 ? -3.814 7.445 0.580 1.00 12.47 ? 8 GLY B HA2 1 +ATOM 127 H HA3 . GLY A 1 9 ? -5.131 7.551 -0.278 1.00 12.47 ? 8 GLY B HA3 1 +ATOM 128 N N . GLY A 1 10 ? -2.981 6.536 -1.634 1.00 11.04 ? 9 GLY B N 1 +ATOM 129 C CA . GLY A 1 10 ? -2.272 6.223 -2.857 1.00 12.06 ? 9 GLY B CA 1 +ATOM 130 C C . GLY A 1 10 ? -1.510 4.930 -2.742 1.00 12.54 ? 9 GLY B C 1 +ATOM 131 O O . GLY A 1 10 ? -1.809 4.061 -1.899 1.00 14.57 ? 9 GLY B O 1 +ATOM 132 H H . GLY A 1 10 ? -3.072 5.873 -1.095 1.00 13.25 ? 9 GLY B H 1 +ATOM 133 H HA2 . GLY A 1 10 ? -2.903 6.147 -3.589 1.00 14.47 ? 9 GLY B HA2 1 +ATOM 134 H HA3 . GLY A 1 10 ? -1.645 6.935 -3.061 1.00 14.47 ? 9 GLY B HA3 1 +ATOM 135 N N . LEU A 1 11 ? -0.520 4.802 -3.625 1.00 13.88 ? 10 LEU B N 1 +ATOM 136 C CA . LEU A 1 11 ? 0.337 3.632 -3.705 1.00 12.94 ? 10 LEU B CA 1 +ATOM 137 C C . LEU A 1 11 ? 1.656 3.966 -3.019 1.00 19.81 ? 10 LEU B C 1 +ATOM 138 O O . LEU A 1 11 ? 2.218 5.067 -3.182 1.00 20.16 ? 10 LEU B O 1 +ATOM 139 C CB . LEU A 1 11 ? 0.605 3.249 -5.170 1.00 19.39 ? 10 LEU B CB 1 +ATOM 140 C CG . LEU A 1 11 ? 1.156 1.838 -5.508 1.00 20.84 ? 10 LEU B CG 1 +ATOM 141 C CD1 . LEU A 1 11 ? 2.475 1.490 -4.851 1.00 34.78 ? 10 LEU B CD1 1 +ATOM 142 C CD2 . LEU A 1 11 ? 0.147 0.755 -5.191 1.00 30.63 ? 10 LEU B CD2 1 +ATOM 143 H H . LEU A 1 11 ? -0.324 5.405 -4.206 1.00 16.65 ? 10 LEU B H 1 +ATOM 144 H HA . LEU A 1 11 ? -0.077 2.882 -3.251 1.00 15.52 ? 10 LEU B HA 1 +ATOM 145 H HB2 . LEU A 1 11 ? -0.231 3.341 -5.653 1.00 23.26 ? 10 LEU B HB2 1 +ATOM 146 H HB3 . LEU A 1 11 ? 1.243 3.887 -5.526 1.00 23.26 ? 10 LEU B HB3 1 +ATOM 147 H HG . LEU A 1 11 ? 1.307 1.805 -6.465 1.00 25.00 ? 10 LEU B HG 1 +ATOM 148 H HD11 . LEU A 1 11 ? 2.736 0.596 -5.121 1.00 41.74 ? 10 LEU B HD11 1 +ATOM 149 H HD12 . LEU A 1 11 ? 3.147 2.131 -5.135 1.00 41.74 ? 10 LEU B HD12 1 +ATOM 150 H HD13 . LEU A 1 11 ? 2.368 1.528 -3.888 1.00 41.74 ? 10 LEU B HD13 1 +ATOM 151 H HD21 . LEU A 1 11 ? 0.530 -0.108 -5.416 1.00 36.76 ? 10 LEU B HD21 1 +ATOM 152 H HD22 . LEU A 1 11 ? -0.064 0.787 -4.245 1.00 36.76 ? 10 LEU B HD22 1 +ATOM 153 H HD23 . LEU A 1 11 ? -0.655 0.908 -5.715 1.00 36.76 ? 10 LEU B HD23 1 +ATOM 154 N N . VAL A 1 12 ? 2.124 3.014 -2.225 1.00 13.81 ? 11 VAL B N 1 +ATOM 155 C CA . VAL A 1 12 ? 3.366 3.145 -1.492 1.00 13.69 ? 11 VAL B CA 1 +ATOM 156 C C . VAL A 1 12 ? 4.006 1.754 -1.440 1.00 13.93 ? 11 VAL B C 1 +ATOM 157 O O . VAL A 1 12 ? 3.325 0.742 -1.450 1.00 15.07 ? 11 VAL B O 1 +ATOM 158 C CB . VAL A 1 12 ? 3.088 3.742 -0.086 1.00 16.57 ? 11 VAL B CB 1 +ATOM 159 C CG1 . VAL A 1 12 ? 2.023 2.938 0.644 1.00 18.63 ? 11 VAL B CG1 1 +ATOM 160 C CG2 . VAL A 1 12 ? 4.362 3.846 0.736 1.00 16.94 ? 11 VAL B CG2 1 +ATOM 161 H H . VAL A 1 12 ? 1.725 2.264 -2.092 1.00 16.57 ? 11 VAL B H 1 +ATOM 162 H HA . VAL A 1 12 ? 3.963 3.742 -1.968 1.00 16.43 ? 11 VAL B HA 1 +ATOM 163 H HB . VAL A 1 12 ? 2.744 4.642 -0.200 1.00 19.88 ? 11 VAL B HB 1 +ATOM 164 H HG11 . VAL A 1 12 ? 1.871 3.334 1.517 1.00 22.36 ? 11 VAL B HG11 1 +ATOM 165 H HG12 . VAL A 1 12 ? 1.203 2.956 0.126 1.00 22.36 ? 11 VAL B HG12 1 +ATOM 166 H HG13 . VAL A 1 12 ? 2.331 2.024 0.745 1.00 22.36 ? 11 VAL B HG13 1 +ATOM 167 H HG21 . VAL A 1 12 ? 4.147 4.222 1.604 1.00 20.33 ? 11 VAL B HG21 1 +ATOM 168 H HG22 . VAL A 1 12 ? 4.741 2.959 0.844 1.00 20.33 ? 11 VAL B HG22 1 +ATOM 169 H HG23 . VAL A 1 12 ? 4.990 4.421 0.273 1.00 20.33 ? 11 VAL B HG23 1 +ATOM 170 N N . GLN A 1 13 ? 5.331 1.692 -1.419 1.00 16.83 ? 12 GLN B N 1 +ATOM 171 C CA . GLN A 1 13 ? 5.998 0.394 -1.333 1.00 15.77 ? 12 GLN B CA 1 +ATOM 172 C C . GLN A 1 13 ? 6.046 -0.119 0.101 1.00 15.89 ? 12 GLN B C 1 +ATOM 173 O O . GLN A 1 13 ? 6.108 0.657 1.053 1.00 16.92 ? 12 GLN B O 1 +ATOM 174 C CB . GLN A 1 13 ? 7.421 0.467 -1.889 1.00 21.86 ? 12 GLN B CB 1 +ATOM 175 C CG . GLN A 1 13 ? 7.490 0.627 -3.402 1.00 23.36 ? 12 GLN B CG 1 +ATOM 176 C CD . GLN A 1 13 ? 6.862 -0.537 -4.145 1.00 32.58 ? 12 GLN B CD 1 +ATOM 177 O OE1 . GLN A 1 13 ? 5.828 -0.385 -4.798 1.00 42.44 ? 12 GLN B OE1 1 +ATOM 178 N NE2 . GLN A 1 13 ? 7.483 -1.707 -4.049 1.00 37.18 ? 12 GLN B NE2 1 +ATOM 179 H H . GLN A 1 13 ? 5.860 2.370 -1.452 1.00 20.19 ? 12 GLN B H 1 +ATOM 180 H HA . GLN A 1 13 ? 5.503 -0.249 -1.864 1.00 18.92 ? 12 GLN B HA 1 +ATOM 181 H HB2 . GLN A 1 13 ? 7.873 1.228 -1.491 1.00 26.24 ? 12 GLN B HB2 1 +ATOM 182 H HB3 . GLN A 1 13 ? 7.889 -0.350 -1.657 1.00 26.24 ? 12 GLN B HB3 1 +ATOM 183 H HG2 . GLN A 1 13 ? 7.018 1.435 -3.656 1.00 28.04 ? 12 GLN B HG2 1 +ATOM 184 H HG3 . GLN A 1 13 ? 8.420 0.688 -3.671 1.00 28.04 ? 12 GLN B HG3 1 +ATOM 185 H HE21 . GLN A 1 13 ? 8.202 -1.774 -3.583 1.00 44.61 ? 12 GLN B HE21 1 +ATOM 186 H HE22 . GLN A 1 13 ? 7.165 -2.397 -4.453 1.00 44.61 ? 12 GLN B HE22 1 +ATOM 187 N N . ALA A 1 14 ? 6.005 -1.437 0.246 1.00 15.03 ? 13 ALA B N 1 +ATOM 188 C CA . ALA A 1 14 ? 6.191 -2.057 1.543 1.00 13.89 ? 13 ALA B CA 1 +ATOM 189 C C . ALA A 1 14 ? 7.470 -1.531 2.190 1.00 15.01 ? 13 ALA B C 1 +ATOM 190 O O . ALA A 1 14 ? 8.500 -1.351 1.521 1.00 14.87 ? 13 ALA B O 1 +ATOM 191 C CB . ALA A 1 14 ? 6.244 -3.565 1.403 1.00 17.58 ? 13 ALA B CB 1 +ATOM 192 H H . ALA A 1 14 ? 5.869 -1.994 -0.395 1.00 18.04 ? 13 ALA B H 1 +ATOM 193 H HA . ALA A 1 14 ? 5.443 -1.830 2.117 1.00 16.67 ? 13 ALA B HA 1 +ATOM 194 H HB1 . ALA A 1 14 ? 6.369 -3.959 2.281 1.00 21.09 ? 13 ALA B HB1 1 +ATOM 195 H HB2 . ALA A 1 14 ? 5.410 -3.875 1.017 1.00 21.09 ? 13 ALA B HB2 1 +ATOM 196 H HB3 . ALA A 1 14 ? 6.986 -3.802 0.825 1.00 21.09 ? 13 ALA B HB3 1 +ATOM 197 N N . GLY A 1 15 ? 7.384 -1.266 3.490 1.00 12.29 ? 14 GLY B N 1 +ATOM 198 C CA . GLY A 1 15 ? 8.479 -0.680 4.234 1.00 14.79 ? 14 GLY B CA 1 +ATOM 199 C C . GLY A 1 15 ? 8.456 0.836 4.217 1.00 15.09 ? 14 GLY B C 1 +ATOM 200 O O . GLY A 1 15 ? 9.197 1.468 4.961 1.00 17.20 ? 14 GLY B O 1 +ATOM 201 H H . GLY A 1 15 ? 6.686 -1.422 3.967 1.00 14.74 ? 14 GLY B H 1 +ATOM 202 H HA2 . GLY A 1 15 ? 8.437 -0.976 5.157 1.00 17.75 ? 14 GLY B HA2 1 +ATOM 203 H HA3 . GLY A 1 15 ? 9.321 -0.977 3.855 1.00 17.75 ? 14 GLY B HA3 1 +ATOM 204 N N . GLY A 1 16 ? 7.605 1.425 3.375 1.00 12.96 ? 15 GLY B N 1 +ATOM 205 C CA . GLY A 1 16 ? 7.533 2.872 3.260 1.00 12.63 ? 15 GLY B CA 1 +ATOM 206 C C . GLY A 1 16 ? 6.597 3.500 4.291 1.00 10.24 ? 15 GLY B C 1 +ATOM 207 O O . GLY A 1 16 ? 6.155 2.841 5.245 1.00 12.84 ? 15 GLY B O 1 +ATOM 208 H H . GLY A 1 16 ? 7.059 1.004 2.861 1.00 15.55 ? 15 GLY B H 1 +ATOM 209 H HA2 . GLY A 1 16 ? 8.419 3.249 3.381 1.00 15.15 ? 15 GLY B HA2 1 +ATOM 210 H HA3 . GLY A 1 16 ? 7.217 3.110 2.374 1.00 15.15 ? 15 GLY B HA3 1 +ATOM 211 N N . SER A 1 17 ? 6.290 4.778 4.086 1.00 10.32 ? 16 SER B N 1 +ATOM 212 C CA . SER A 1 17 ? 5.441 5.530 4.996 1.00 11.52 ? 16 SER B CA 1 +ATOM 213 C C . SER A 1 17 ? 4.491 6.397 4.188 1.00 11.52 ? 16 SER B C 1 +ATOM 214 O O . SER A 1 17 ? 4.780 6.781 3.045 1.00 12.90 ? 16 SER B O 1 +ATOM 215 C CB . SER A 1 17 ? 6.276 6.391 5.941 1.00 16.09 ? 16 SER B CB 1 +ATOM 216 O OG . SER A 1 17 ? 6.921 7.447 5.267 1.00 24.93 ? 16 SER B OG 1 +ATOM 217 H H . SER A 1 17 ? 6.567 5.237 3.414 1.00 12.39 ? 16 SER B H 1 +ATOM 218 H HA . SER A 1 17 ? 4.915 4.913 5.529 1.00 13.82 ? 16 SER B HA 1 +ATOM 219 H HB2 . SER A 1 17 ? 5.693 6.764 6.620 1.00 19.31 ? 16 SER B HB2 1 +ATOM 220 H HB3 . SER A 1 17 ? 6.949 5.831 6.360 1.00 19.31 ? 16 SER B HB3 1 +ATOM 221 H HG . SER A 1 17 ? 7.372 7.902 5.811 1.00 29.91 ? 16 SER B HG 1 +ATOM 222 N N . LEU A 1 18 ? 3.336 6.682 4.771 1.00 10.29 ? 17 LEU B N 1 +ATOM 223 C CA . LEU A 1 18 ? 2.276 7.442 4.112 1.00 9.97 ? 17 LEU B CA 1 +ATOM 224 C C . LEU A 1 18 ? 1.483 8.204 5.159 1.00 8.82 ? 17 LEU B C 1 +ATOM 225 O O . LEU A 1 18 ? 1.230 7.677 6.243 1.00 10.55 ? 17 LEU B O 1 +ATOM 226 C CB . LEU A 1 18 ? 1.352 6.496 3.353 1.00 11.58 ? 17 LEU B CB 1 +ATOM 227 C CG . LEU A 1 18 ? 0.303 7.137 2.457 1.00 11.46 ? 17 LEU B CG 1 +ATOM 228 C CD1 . LEU A 1 18 ? 0.943 7.731 1.232 1.00 15.27 ? 17 LEU B CD1 1 +ATOM 229 C CD2 . LEU A 1 18 ? -0.743 6.097 2.059 1.00 15.53 ? 17 LEU B CD2 1 +ATOM 230 H H . LEU A 1 18 ? 3.134 6.441 5.571 1.00 12.34 ? 17 LEU B H 1 +ATOM 231 H HA . LEU A 1 18 ? 2.662 8.074 3.486 1.00 11.96 ? 17 LEU B HA 1 +ATOM 232 H HB2 . LEU A 1 18 ? 1.899 5.925 2.790 1.00 13.90 ? 17 LEU B HB2 1 +ATOM 233 H HB3 . LEU A 1 18 ? 0.880 5.950 4.000 1.00 13.90 ? 17 LEU B HB3 1 +ATOM 234 H HG . LEU A 1 18 ? -0.143 7.848 2.943 1.00 13.76 ? 17 LEU B HG 1 +ATOM 235 H HD11 . LEU A 1 18 ? 0.255 8.132 0.679 1.00 18.32 ? 17 LEU B HD11 1 +ATOM 236 H HD12 . LEU A 1 18 ? 1.583 8.407 1.507 1.00 18.32 ? 17 LEU B HD12 1 +ATOM 237 H HD13 . LEU A 1 18 ? 1.396 7.028 0.740 1.00 18.32 ? 17 LEU B HD13 1 +ATOM 238 H HD21 . LEU A 1 18 ? -1.405 6.518 1.488 1.00 18.64 ? 17 LEU B HD21 1 +ATOM 239 H HD22 . LEU A 1 18 ? -0.304 5.376 1.581 1.00 18.64 ? 17 LEU B HD22 1 +ATOM 240 H HD23 . LEU A 1 18 ? -1.167 5.753 2.861 1.00 18.64 ? 17 LEU B HD23 1 +ATOM 241 N N . ARG A 1 19 ? 1.092 9.432 4.845 1.00 9.16 ? 18 ARG B N 1 +ATOM 242 C CA . ARG A 1 19 ? 0.350 10.250 5.790 1.00 8.75 ? 18 ARG B CA 1 +ATOM 243 C C . ARG A 1 19 ? -1.016 10.571 5.235 1.00 8.83 ? 18 ARG B C 1 +ATOM 244 O O . ARG A 1 19 ? -1.122 11.206 4.192 1.00 9.70 ? 18 ARG B O 1 +ATOM 245 C CB . ARG A 1 19 ? 1.122 11.531 6.075 1.00 10.94 ? 18 ARG B CB 1 +ATOM 246 C CG . ARG A 1 19 ? 0.495 12.451 7.083 1.00 10.84 ? 18 ARG B CG 1 +ATOM 247 C CD . ARG A 1 19 ? 1.368 13.678 7.192 1.00 14.12 ? 18 ARG B CD 1 +ATOM 248 N NE . ARG A 1 19 ? 0.907 14.635 8.185 1.00 16.22 ? 18 ARG B NE 1 +ATOM 249 C CZ . ARG A 1 19 ? 1.215 14.576 9.469 1.00 14.49 ? 18 ARG B CZ 1 +ATOM 250 N NH1 . ARG A 1 19 ? 1.955 13.586 9.947 1.00 14.99 1 18 ARG B NH1 1 +ATOM 251 N NH2 . ARG A 1 19 ? 0.763 15.519 10.288 1.00 18.49 ? 18 ARG B NH2 1 +ATOM 252 H H . ARG A 1 19 ? 1.245 9.814 4.091 1.00 11.00 ? 18 ARG B H 1 +ATOM 253 H HA . ARG A 1 19 ? 0.238 9.765 6.622 1.00 10.50 ? 18 ARG B HA 1 +ATOM 254 H HB2 . ARG A 1 19 ? 2.001 11.291 6.407 1.00 13.13 ? 18 ARG B HB2 1 +ATOM 255 H HB3 . ARG A 1 19 ? 1.212 12.026 5.246 1.00 13.13 ? 18 ARG B HB3 1 +ATOM 256 H HG2 . ARG A 1 19 ? -0.388 12.718 6.784 1.00 13.01 ? 18 ARG B HG2 1 +ATOM 257 H HG3 . ARG A 1 19 ? 0.453 12.016 7.949 1.00 13.01 ? 18 ARG B HG3 1 +ATOM 258 H HD2 . ARG A 1 19 ? 2.265 13.403 7.439 1.00 16.95 ? 18 ARG B HD2 1 +ATOM 259 H HD3 . ARG A 1 19 ? 1.386 14.127 6.333 1.00 16.95 ? 18 ARG B HD3 1 +ATOM 260 H HE . ARG A 1 19 ? 0.365 15.251 7.929 1.00 19.47 ? 18 ARG B HE 1 +ATOM 261 H HH11 . ARG A 1 19 ? 2.254 12.978 9.416 1.00 17.99 ? 18 ARG B HH11 1 +ATOM 262 H HH12 . ARG A 1 19 ? 2.144 13.556 10.785 1.00 17.99 ? 18 ARG B HH12 1 +ATOM 263 H HH21 . ARG A 1 19 ? 0.275 16.157 9.981 1.00 22.19 ? 18 ARG B HH21 1 +ATOM 264 H HH22 . ARG A 1 19 ? 0.945 15.482 11.128 1.00 22.19 ? 18 ARG B HH22 1 +ATOM 265 N N . LEU A 1 20 ? -2.059 10.121 5.912 1.00 7.71 ? 19 LEU B N 1 +ATOM 266 C CA . LEU A 1 20 ? -3.425 10.459 5.552 1.00 8.00 ? 19 LEU B CA 1 +ATOM 267 C C . LEU A 1 20 ? -3.873 11.670 6.335 1.00 7.12 ? 19 LEU B C 1 +ATOM 268 O O . LEU A 1 20 ? -3.396 11.918 7.452 1.00 7.69 ? 19 LEU B O 1 +ATOM 269 C CB . LEU A 1 20 ? -4.378 9.308 5.855 1.00 8.44 ? 19 LEU B CB 1 +ATOM 270 C CG . LEU A 1 20 ? -4.036 7.962 5.218 1.00 8.46 ? 19 LEU B CG 1 +ATOM 271 C CD1 . LEU A 1 20 ? -5.084 6.931 5.580 1.00 10.32 ? 19 LEU B CD1 1 +ATOM 272 C CD2 . LEU A 1 20 ? -3.868 8.055 3.707 1.00 13.15 ? 19 LEU B CD2 1 +ATOM 273 H H . LEU A 1 20 ? -2.001 9.606 6.598 1.00 9.25 ? 19 LEU B H 1 +ATOM 274 H HA . LEU A 1 20 ? -3.473 10.663 4.605 1.00 9.60 ? 19 LEU B HA 1 +ATOM 275 H HB2 . LEU A 1 20 ? -4.399 9.175 6.815 1.00 10.13 ? 19 LEU B HB2 1 +ATOM 276 H HB3 . LEU A 1 20 ? -5.263 9.557 5.545 1.00 10.13 ? 19 LEU B HB3 1 +ATOM 277 H HG . LEU A 1 20 ? -3.191 7.657 5.584 1.00 10.15 ? 19 LEU B HG 1 +ATOM 278 H HD11 . LEU A 1 20 ? -4.850 6.085 5.167 1.00 12.38 ? 19 LEU B HD11 1 +ATOM 279 H HD12 . LEU A 1 20 ? -5.109 6.833 6.545 1.00 12.38 ? 19 LEU B HD12 1 +ATOM 280 H HD13 . LEU A 1 20 ? -5.947 7.231 5.255 1.00 12.38 ? 19 LEU B HD13 1 +ATOM 281 H HD21 . LEU A 1 20 ? -3.653 7.176 3.358 1.00 15.77 ? 19 LEU B HD21 1 +ATOM 282 H HD22 . LEU A 1 20 ? -4.697 8.373 3.316 1.00 15.77 ? 19 LEU B HD22 1 +ATOM 283 H HD23 . LEU A 1 20 ? -3.149 8.676 3.507 1.00 15.77 ? 19 LEU B HD23 1 +ATOM 284 N N . SER A 1 21 ? -4.842 12.387 5.785 1.00 7.59 ? 20 SER B N 1 +ATOM 285 C CA . SER A 1 21 ? -5.518 13.417 6.549 1.00 8.10 ? 20 SER B CA 1 +ATOM 286 C C . SER A 1 21 ? -7.009 13.337 6.333 1.00 8.60 ? 20 SER B C 1 +ATOM 287 O O . SER A 1 21 ? -7.492 12.717 5.394 1.00 8.50 ? 20 SER B O 1 +ATOM 288 C CB . SER A 1 21 ? -5.001 14.805 6.184 1.00 11.42 ? 20 SER B CB 1 +ATOM 289 O OG . SER A 1 21 ? -5.343 15.135 4.865 1.00 14.23 ? 20 SER B OG 1 +ATOM 290 H H . SER A 1 21 ? -5.124 12.297 4.977 1.00 9.11 ? 20 SER B H 1 +ATOM 291 H HA . SER A 1 21 ? -5.345 13.272 7.493 1.00 9.72 ? 20 SER B HA 1 +ATOM 292 H HB2 . SER A 1 21 ? -5.394 15.456 6.785 1.00 13.70 ? 20 SER B HB2 1 +ATOM 293 H HB3 . SER A 1 21 ? -4.035 14.814 6.271 1.00 13.70 ? 20 SER B HB3 1 +ATOM 294 H HG . SER A 1 21 ? -5.053 15.900 4.676 1.00 17.08 ? 20 SER B HG 1 +ATOM 295 N N . CYS A 1 22 ? -7.749 13.974 7.223 1.00 8.11 ? 21 CYS B N 1 +ATOM 296 C CA . CYS A 1 22 ? -9.188 14.038 7.125 1.00 8.33 ? 21 CYS B CA 1 +ATOM 297 C C . CYS A 1 22 ? -9.624 15.406 7.603 1.00 9.21 ? 21 CYS B C 1 +ATOM 298 O O . CYS A 1 22 ? -9.256 15.833 8.705 1.00 9.98 ? 21 CYS B O 1 +ATOM 299 C CB . CYS A 1 22 ? -9.830 12.949 7.977 1.00 10.31 ? 21 CYS B CB 1 +ATOM 300 S SG . CYS A 1 22 ? -11.600 13.148 8.187 1.00 11.39 ? 21 CYS B SG 1 +ATOM 301 H H . CYS A 1 22 ? -7.430 14.386 7.907 1.00 9.73 ? 21 CYS B H 1 +ATOM 302 H HA . CYS A 1 22 ? -9.464 13.922 6.202 1.00 10.00 ? 21 CYS B HA 1 +ATOM 303 H HB2 . CYS A 1 22 ? -9.676 12.090 7.555 1.00 12.38 ? 21 CYS B HB2 1 +ATOM 304 H HB3 . CYS A 1 22 ? -9.424 12.961 8.858 1.00 12.38 ? 21 CYS B HB3 1 +ATOM 305 N N . ALA A 1 23 ? -10.387 16.091 6.763 1.00 9.52 ? 22 ALA B N 1 +ATOM 306 C CA . ALA A 1 23 ? -10.935 17.402 7.080 1.00 9.79 ? 22 ALA B CA 1 +ATOM 307 C C . ALA A 1 23 ? -12.395 17.246 7.434 1.00 10.29 ? 22 ALA B C 1 +ATOM 308 O O . ALA A 1 23 ? -13.138 16.548 6.743 1.00 10.27 ? 22 ALA B O 1 +ATOM 309 C CB . ALA A 1 23 ? -10.803 18.334 5.900 1.00 13.01 ? 22 ALA B CB 1 +ATOM 310 H H . ALA A 1 23 ? -10.608 15.809 5.981 1.00 11.42 ? 22 ALA B H 1 +ATOM 311 H HA . ALA A 1 23 ? -10.466 17.784 7.838 1.00 11.75 ? 22 ALA B HA 1 +ATOM 312 H HB1 . ALA A 1 23 ? -11.174 19.198 6.136 1.00 15.61 ? 22 ALA B HB1 1 +ATOM 313 H HB2 . ALA A 1 23 ? -9.864 18.428 5.676 1.00 15.61 ? 22 ALA B HB2 1 +ATOM 314 H HB3 . ALA A 1 23 ? -11.287 17.960 5.147 1.00 15.61 ? 22 ALA B HB3 1 +ATOM 315 N N . ALA A 1 24 ? -12.800 17.920 8.505 1.00 10.49 ? 23 ALA B N 1 +ATOM 316 C CA . ALA A 1 24 ? -14.187 17.960 8.949 1.00 10.95 ? 23 ALA B CA 1 +ATOM 317 C C . ALA A 1 24 ? -14.783 19.334 8.689 1.00 12.53 ? 23 ALA B C 1 +ATOM 318 O O . ALA A 1 24 ? -14.134 20.357 8.876 1.00 13.81 ? 23 ALA B O 1 +ATOM 319 C CB . ALA A 1 24 ? -14.258 17.669 10.409 1.00 12.13 ? 23 ALA B CB 1 +ATOM 320 H H . ALA A 1 24 ? -12.272 18.376 9.007 1.00 12.58 ? 23 ALA B H 1 +ATOM 321 H HA . ALA A 1 24 ? -14.707 17.295 8.470 1.00 13.14 ? 23 ALA B HA 1 +ATOM 322 H HB1 . ALA A 1 24 ? -15.185 17.698 10.691 1.00 14.55 ? 23 ALA B HB1 1 +ATOM 323 H HB2 . ALA A 1 24 ? -13.890 16.786 10.573 1.00 14.55 ? 23 ALA B HB2 1 +ATOM 324 H HB3 . ALA A 1 24 ? -13.744 18.337 10.889 1.00 14.55 ? 23 ALA B HB3 1 +ATOM 325 N N . SER A 1 25 ? -16.030 19.366 8.253 1.00 11.17 ? 24 SER B N 1 +ATOM 326 C CA . SER A 1 25 ? -16.722 20.629 8.045 1.00 11.15 ? 24 SER B CA 1 +ATOM 327 C C . SER A 1 25 ? -17.246 21.156 9.375 1.00 13.01 ? 24 SER B C 1 +ATOM 328 O O . SER A 1 25 ? -17.278 20.425 10.375 1.00 13.46 ? 24 SER B O 1 +ATOM 329 C CB . SER A 1 25 ? -17.877 20.436 7.065 1.00 12.02 ? 24 SER B CB 1 +ATOM 330 O OG . SER A 1 25 ? -18.874 19.624 7.656 1.00 14.58 ? 24 SER B OG 1 +ATOM 331 H H . SER A 1 25 ? -16.501 18.671 8.069 1.00 13.40 ? 24 SER B H 1 +ATOM 332 H HA . SER A 1 25 ? -16.107 21.281 7.674 1.00 13.38 ? 24 SER B HA 1 +ATOM 333 H HB2 . SER A 1 25 ? -18.258 21.301 6.846 1.00 14.42 ? 24 SER B HB2 1 +ATOM 334 H HB3 . SER A 1 25 ? -17.547 20.003 6.263 1.00 14.42 ? 24 SER B HB3 1 +ATOM 335 H HG . SER A 1 25 ? -19.511 19.515 7.120 1.00 17.49 ? 24 SER B HG 1 +ATOM 336 N N . GLY A 1 26 ? -17.664 22.421 9.381 1.00 12.59 ? 25 GLY B N 1 +ATOM 337 C CA . GLY A 1 26 ? -18.358 22.992 10.520 1.00 12.75 ? 25 GLY B CA 1 +ATOM 338 C C . GLY A 1 26 ? -17.455 23.713 11.489 1.00 12.74 ? 25 GLY B C 1 +ATOM 339 O O . GLY A 1 26 ? -16.262 23.877 11.258 1.00 13.07 ? 25 GLY B O 1 +ATOM 340 H H . GLY A 1 26 ? -17.555 22.970 8.728 1.00 15.11 ? 25 GLY B H 1 +ATOM 341 H HA2 . GLY A 1 26 ? -19.025 23.621 10.203 1.00 15.31 ? 25 GLY B HA2 1 +ATOM 342 H HA3 . GLY A 1 26 ? -18.814 22.285 11.002 1.00 15.31 ? 25 GLY B HA3 1 +ATOM 343 N N . ARG A 1 27 ? -18.058 24.141 12.591 1.00 11.75 ? 26 ARG B N 1 +ATOM 344 C CA . ARG A 1 27 ? -17.379 24.934 13.606 1.00 13.15 ? 26 ARG B CA 1 +ATOM 345 C C . ARG A 1 27 ? -17.392 24.231 14.960 1.00 12.58 ? 26 ARG B C 1 +ATOM 346 O O . ARG A 1 27 ? -17.195 24.878 15.999 1.00 15.32 ? 26 ARG B O 1 +ATOM 347 C CB . ARG A 1 27 ? -18.081 26.287 13.737 1.00 17.22 ? 26 ARG B CB 1 +ATOM 348 C CG . ARG A 1 27 ? -18.146 27.079 12.437 1.00 26.93 ? 26 ARG B CG 1 +ATOM 349 C CD . ARG A 1 27 ? -16.816 27.755 12.143 1.00 38.38 ? 26 ARG B CD 1 +ATOM 350 N NE . ARG A 1 27 ? -16.758 28.314 10.792 1.00 49.12 ? 26 ARG B NE 1 +ATOM 351 C CZ . ARG A 1 27 ? -17.399 29.413 10.403 1.00 52.65 ? 26 ARG B CZ 1 +ATOM 352 N NH1 . ARG A 1 27 ? -18.168 30.080 11.255 1.00 56.19 1 26 ARG B NH1 1 +ATOM 353 N NH2 . ARG A 1 27 ? -17.278 29.841 9.153 1.00 51.80 ? 26 ARG B NH2 1 +ATOM 354 H H . ARG A 1 27 ? -18.882 23.980 12.778 1.00 14.09 ? 26 ARG B H 1 +ATOM 355 H HA . ARG A 1 27 ? -16.458 25.085 13.342 1.00 15.78 ? 26 ARG B HA 1 +ATOM 356 H HB2 . ARG A 1 27 ? -18.991 26.138 14.039 1.00 20.67 ? 26 ARG B HB2 1 +ATOM 357 H HB3 . ARG A 1 27 ? -17.603 26.825 14.387 1.00 20.67 ? 26 ARG B HB3 1 +ATOM 358 H HG2 . ARG A 1 27 ? -18.352 26.478 11.704 1.00 32.32 ? 26 ARG B HG2 1 +ATOM 359 H HG3 . ARG A 1 27 ? -18.828 27.765 12.513 1.00 32.32 ? 26 ARG B HG3 1 +ATOM 360 H HD2 . ARG A 1 27 ? -16.682 28.479 12.774 1.00 46.05 ? 26 ARG B HD2 1 +ATOM 361 H HD3 . ARG A 1 27 ? -16.103 27.103 12.229 1.00 46.05 ? 26 ARG B HD3 1 +ATOM 362 H HE . ARG A 1 27 ? -16.277 27.903 10.209 1.00 58.95 ? 26 ARG B HE 1 +ATOM 363 H HH11 . ARG A 1 27 ? -18.249 29.806 12.067 1.00 67.43 ? 26 ARG B HH11 1 +ATOM 364 H HH12 . ARG A 1 27 ? -18.581 30.789 10.998 1.00 67.43 ? 26 ARG B HH12 1 +ATOM 365 H HH21 . ARG A 1 27 ? -16.783 29.411 8.596 1.00 62.16 ? 26 ARG B HH21 1 +ATOM 366 H HH22 . ARG A 1 27 ? -17.695 30.549 8.899 1.00 62.16 ? 26 ARG B HH22 1 +ATOM 367 N N . THR A 1 28 ? -17.637 22.923 14.953 1.00 10.17 ? 27 THR B N 1 +ATOM 368 C CA . THR A 1 28 ? -17.762 22.169 16.190 1.00 11.24 ? 27 THR B CA 1 +ATOM 369 C C . THR A 1 28 ? -16.845 20.945 16.213 1.00 8.33 ? 27 THR B C 1 +ATOM 370 O O . THR A 1 28 ? -17.171 19.933 16.836 1.00 7.87 ? 27 THR B O 1 +ATOM 371 C CB . THR A 1 28 ? -19.217 21.718 16.394 1.00 14.89 ? 27 THR B CB 1 +ATOM 372 O OG1 . THR A 1 28 ? -19.670 21.062 15.211 1.00 15.06 ? 27 THR B OG1 1 +ATOM 373 C CG2 . THR A 1 28 ? -20.114 22.918 16.705 1.00 20.14 ? 27 THR B CG2 1 +ATOM 374 H H . THR A 1 28 ? -17.734 22.450 14.241 1.00 12.21 ? 27 THR B H 1 +ATOM 375 H HA . THR A 1 28 ? -17.518 22.741 16.935 1.00 13.49 ? 27 THR B HA 1 +ATOM 376 H HB . THR A 1 28 ? -19.261 21.101 17.141 1.00 17.87 ? 27 THR B HB 1 +ATOM 377 H HG1 . THR A 1 28 ? -20.465 20.810 15.309 1.00 18.07 ? 27 THR B HG1 1 +ATOM 378 H HG21 . THR A 1 28 ? -21.030 22.623 16.832 1.00 24.16 ? 27 THR B HG21 1 +ATOM 379 H HG22 . THR A 1 28 ? -19.810 23.358 17.515 1.00 24.16 ? 27 THR B HG22 1 +ATOM 380 H HG23 . THR A 1 28 ? -20.086 23.552 15.972 1.00 24.16 ? 27 THR B HG23 1 +ATOM 381 N N . PHE A 1 29 ? -15.688 21.042 15.582 1.00 8.99 ? 28 PHE B N 1 +ATOM 382 C CA . PHE A 1 29 ? -14.775 19.909 15.478 1.00 8.64 ? 28 PHE B CA 1 +ATOM 383 C C . PHE A 1 29 ? -14.379 19.371 16.853 1.00 8.00 ? 28 PHE B C 1 +ATOM 384 O O . PHE A 1 29 ? -14.280 18.154 17.043 1.00 8.01 ? 28 PHE B O 1 +ATOM 385 C CB . PHE A 1 29 ? -13.566 20.345 14.677 1.00 9.53 ? 28 PHE B CB 1 +ATOM 386 C CG . PHE A 1 29 ? -12.553 19.268 14.404 1.00 8.59 ? 28 PHE B CG 1 +ATOM 387 C CD1 . PHE A 1 29 ? -12.869 18.113 13.712 1.00 9.79 ? 28 PHE B CD1 1 +ATOM 388 C CD2 . PHE A 1 29 ? -11.251 19.456 14.813 1.00 9.91 ? 28 PHE B CD2 1 +ATOM 389 C CE1 . PHE A 1 29 ? -11.903 17.174 13.432 1.00 10.28 ? 28 PHE B CE1 1 +ATOM 390 C CE2 . PHE A 1 29 ? -10.274 18.524 14.518 1.00 10.06 ? 28 PHE B CE2 1 +ATOM 391 C CZ . PHE A 1 29 ? -10.604 17.384 13.827 1.00 9.41 ? 28 PHE B CZ 1 +ATOM 392 H H . PHE A 1 29 ? -15.403 21.757 15.200 1.00 10.79 ? 28 PHE B H 1 +ATOM 393 H HA . PHE A 1 29 ? -15.214 19.194 14.992 1.00 10.37 ? 28 PHE B HA 1 +ATOM 394 H HB2 . PHE A 1 29 ? -13.871 20.682 13.820 1.00 11.44 ? 28 PHE B HB2 1 +ATOM 395 H HB3 . PHE A 1 29 ? -13.115 21.053 15.162 1.00 11.44 ? 28 PHE B HB3 1 +ATOM 396 H HD1 . PHE A 1 29 ? -13.742 17.976 13.421 1.00 11.74 ? 28 PHE B HD1 1 +ATOM 397 H HD2 . PHE A 1 29 ? -11.019 20.238 15.259 1.00 11.89 ? 28 PHE B HD2 1 +ATOM 398 H HE1 . PHE A 1 29 ? -12.128 16.400 12.968 1.00 12.34 ? 28 PHE B HE1 1 +ATOM 399 H HE2 . PHE A 1 29 ? -9.400 18.659 14.804 1.00 12.07 ? 28 PHE B HE2 1 +ATOM 400 H HZ . PHE A 1 29 ? -9.956 16.739 13.657 1.00 11.29 ? 28 PHE B HZ 1 +ATOM 401 N N . SER A 1 30 ? -14.176 20.262 17.810 1.00 7.69 ? 29 SER B N 1 +ATOM 402 C CA . SER A 1 30 ? -13.760 19.848 19.140 1.00 9.19 ? 29 SER B CA 1 +ATOM 403 C C . SER A 1 30 ? -14.882 19.199 19.932 1.00 7.90 ? 29 SER B C 1 +ATOM 404 O O . SER A 1 30 ? -14.649 18.789 21.085 1.00 8.55 ? 29 SER B O 1 +ATOM 405 C CB . SER A 1 30 ? -13.225 21.044 19.926 1.00 11.98 ? 29 SER B CB 1 +ATOM 406 O OG . SER A 1 30 ? -14.292 21.849 20.380 1.00 14.27 ? 29 SER B OG 1 +ATOM 407 H H . SER A 1 30 ? -14.272 21.112 17.716 1.00 9.23 ? 29 SER B H 1 +ATOM 408 H HA . SER A 1 30 ? -13.042 19.201 19.056 1.00 11.03 ? 29 SER B HA 1 +ATOM 409 H HB2 . SER A 1 30 ? -12.723 20.723 20.691 1.00 14.37 ? 29 SER B HB2 1 +ATOM 410 H HB3 . SER A 1 30 ? -12.652 21.573 19.350 1.00 14.37 ? 29 SER B HB3 1 +ATOM 411 H HG . SER A 1 30 ? -14.736 22.132 19.725 1.00 17.12 ? 29 SER B HG 1 +ATOM 412 N N . SER A 1 31 ? -16.081 19.093 19.357 1.00 7.36 ? 30 SER B N 1 +ATOM 413 C CA . SER A 1 31 ? -17.159 18.339 19.980 1.00 7.64 ? 30 SER B CA 1 +ATOM 414 C C . SER A 1 31 ? -17.059 16.838 19.742 1.00 7.57 ? 30 SER B C 1 +ATOM 415 O O . SER A 1 31 ? -17.855 16.085 20.284 1.00 7.48 ? 30 SER B O 1 +ATOM 416 C CB . SER A 1 31 ? -18.505 18.823 19.459 1.00 7.71 ? 30 SER B CB 1 +ATOM 417 O OG . SER A 1 31 ? -18.736 20.184 19.792 1.00 9.56 ? 30 SER B OG 1 +ATOM 418 H H . SER A 1 31 ? -16.293 19.452 18.604 1.00 8.83 ? 30 SER B H 1 +ATOM 419 H HA . SER A 1 31 ? -17.136 18.491 20.937 1.00 9.16 ? 30 SER B HA 1 +ATOM 420 H HB2 . SER A 1 31 ? -18.519 18.730 18.493 1.00 9.25 ? 30 SER B HB2 1 +ATOM 421 H HB3 . SER A 1 31 ? -19.206 18.281 19.852 1.00 9.25 ? 30 SER B HB3 1 +ATOM 422 H HG . SER A 1 31 ? -18.137 20.668 19.457 1.00 11.47 ? 30 SER B HG 1 +ATOM 423 N N . TYR A 1 32 ? -16.081 16.410 18.940 1.00 6.61 ? 31 TYR B N 1 +ATOM 424 C CA . TYR A 1 32 ? -15.999 15.025 18.467 1.00 5.99 ? 31 TYR B CA 1 +ATOM 425 C C . TYR A 1 32 ? -14.673 14.346 18.732 1.00 5.20 ? 31 TYR B C 1 +ATOM 426 O O . TYR A 1 32 ? -13.612 14.904 18.442 1.00 6.37 ? 31 TYR B O 1 +ATOM 427 C CB . TYR A 1 32 ? -16.251 14.969 16.937 1.00 6.63 ? 31 TYR B CB 1 +ATOM 428 C CG . TYR A 1 32 ? -17.626 15.451 16.564 1.00 6.65 ? 31 TYR B CG 1 +ATOM 429 C CD1 . TYR A 1 32 ? -18.719 14.611 16.597 1.00 9.17 ? 31 TYR B CD1 1 +ATOM 430 C CD2 . TYR A 1 32 ? -17.846 16.786 16.236 1.00 8.80 ? 31 TYR B CD2 1 +ATOM 431 C CE1 . TYR A 1 32 ? -20.004 15.088 16.286 1.00 9.31 ? 31 TYR B CE1 1 +ATOM 432 C CE2 . TYR A 1 32 ? -19.110 17.260 15.952 1.00 10.26 ? 31 TYR B CE2 1 +ATOM 433 C CZ . TYR A 1 32 ? -20.172 16.419 15.990 1.00 9.53 ? 31 TYR B CZ 1 +ATOM 434 O OH . TYR A 1 32 ? -21.428 16.897 15.675 1.00 12.38 ? 31 TYR B OH 1 +ATOM 435 H H . TYR A 1 32 ? -15.444 16.911 18.651 1.00 7.94 ? 31 TYR B H 1 +ATOM 436 H HA . TYR A 1 32 ? -16.692 14.504 18.903 1.00 7.19 ? 31 TYR B HA 1 +ATOM 437 H HB2 . TYR A 1 32 ? -15.602 15.533 16.488 1.00 7.96 ? 31 TYR B HB2 1 +ATOM 438 H HB3 . TYR A 1 32 ? -16.161 14.051 16.634 1.00 7.96 ? 31 TYR B HB3 1 +ATOM 439 H HD1 . TYR A 1 32 ? -18.604 13.716 16.820 1.00 11.00 ? 31 TYR B HD1 1 +ATOM 440 H HD2 . TYR A 1 32 ? -17.128 17.376 16.231 1.00 10.56 ? 31 TYR B HD2 1 +ATOM 441 H HE1 . TYR A 1 32 ? -20.737 14.516 16.309 1.00 11.17 ? 31 TYR B HE1 1 +ATOM 442 H HE2 . TYR A 1 32 ? -19.232 18.155 15.731 1.00 12.31 ? 31 TYR B HE2 1 +ATOM 443 H HH . TYR A 1 32 ? -21.988 16.271 15.702 1.00 14.85 ? 31 TYR B HH 1 +ATOM 444 N N . GLY A 1 33 ? -14.747 13.111 19.202 1.00 5.14 ? 32 GLY B N 1 +ATOM 445 C CA . GLY A 1 33 ? -13.658 12.166 19.061 1.00 6.35 ? 32 GLY B CA 1 +ATOM 446 C C . GLY A 1 33 ? -13.580 11.751 17.606 1.00 5.38 ? 32 GLY B C 1 +ATOM 447 O O . GLY A 1 33 ? -14.607 11.624 16.921 1.00 6.71 ? 32 GLY B O 1 +ATOM 448 H H . GLY A 1 33 ? -15.431 12.793 19.614 1.00 6.17 ? 32 GLY B H 1 +ATOM 449 H HA2 . GLY A 1 33 ? -12.819 12.576 19.323 1.00 7.62 ? 32 GLY B HA2 1 +ATOM 450 H HA3 . GLY A 1 33 ? -13.818 11.383 19.610 1.00 7.62 ? 32 GLY B HA3 1 +ATOM 451 N N . MET A 1 34 ? -12.371 11.580 17.088 1.00 5.29 ? 33 MET B N 1 +ATOM 452 C CA . MET A 1 34 ? -12.171 11.261 15.677 1.00 4.85 ? 33 MET B CA 1 +ATOM 453 C C . MET A 1 34 ? -11.486 9.914 15.563 1.00 6.01 ? 33 MET B C 1 +ATOM 454 O O . MET A 1 34 ? -10.661 9.538 16.406 1.00 6.29 ? 33 MET B O 1 +ATOM 455 C CB . MET A 1 34 ? -11.331 12.339 14.992 1.00 5.73 ? 33 MET B CB 1 +ATOM 456 C CG . MET A 1 34 ? -11.976 13.701 14.935 1.00 6.14 ? 33 MET B CG 1 +ATOM 457 S SD . MET A 1 34 ? -13.495 13.776 14.001 1.00 7.75 ? 33 MET B SD 1 +ATOM 458 C CE . MET A 1 34 ? -12.976 13.270 12.354 1.00 10.49 ? 33 MET B CE 1 +ATOM 459 H H . MET A 1 34 ? -11.640 11.644 17.537 1.00 6.35 ? 33 MET B H 1 +ATOM 460 H HA . MET A 1 34 ? -13.033 11.221 15.234 1.00 5.82 ? 33 MET B HA 1 +ATOM 461 H HB2 . MET A 1 34 ? -10.493 12.430 15.472 1.00 6.87 ? 33 MET B HB2 1 +ATOM 462 H HB3 . MET A 1 34 ? -11.154 12.059 14.080 1.00 6.87 ? 33 MET B HB3 1 +ATOM 463 H HG2 . MET A 1 34 ? -12.174 13.986 15.840 1.00 7.36 ? 33 MET B HG2 1 +ATOM 464 H HG3 . MET A 1 34 ? -11.351 14.321 14.528 1.00 7.36 ? 33 MET B HG3 1 +ATOM 465 H HE1 . MET A 1 34 ? -13.746 13.279 11.764 1.00 12.59 ? 33 MET B HE1 1 +ATOM 466 H HE2 . MET A 1 34 ? -12.303 13.890 12.031 1.00 12.59 ? 33 MET B HE2 1 +ATOM 467 H HE3 . MET A 1 34 ? -12.606 12.374 12.402 1.00 12.59 ? 33 MET B HE3 1 +ATOM 468 N N . GLY A 1 35 ? -11.807 9.162 14.517 1.00 5.78 ? 34 GLY B N 1 +ATOM 469 C CA . GLY A 1 35 ? -11.221 7.853 14.336 1.00 6.55 ? 34 GLY B CA 1 +ATOM 470 C C . GLY A 1 35 ? -10.923 7.523 12.889 1.00 5.63 ? 34 GLY B C 1 +ATOM 471 O O . GLY A 1 35 ? -11.499 8.109 11.959 1.00 6.97 ? 34 GLY B O 1 +ATOM 472 H H . GLY A 1 35 ? -12.362 9.392 13.901 1.00 6.93 ? 34 GLY B H 1 +ATOM 473 H HA2 . GLY A 1 35 ? -10.392 7.801 14.836 1.00 7.86 ? 34 GLY B HA2 1 +ATOM 474 H HA3 . GLY A 1 35 ? -11.828 7.180 14.682 1.00 7.86 ? 34 GLY B HA3 1 +ATOM 475 N N . TRP A 1 36 ? -10.017 6.569 12.721 1.00 5.99 ? 35 TRP B N 1 +ATOM 476 C CA . TRP A 1 36 ? -9.732 5.955 11.452 1.00 5.54 ? 35 TRP B CA 1 +ATOM 477 C C . TRP A 1 36 ? -10.076 4.489 11.559 1.00 5.49 ? 35 TRP B C 1 +ATOM 478 O O . TRP A 1 36 ? -9.713 3.819 12.534 1.00 6.27 ? 35 TRP B O 1 +ATOM 479 C CB . TRP A 1 36 ? -8.257 6.090 11.108 1.00 6.70 ? 35 TRP B CB 1 +ATOM 480 C CG . TRP A 1 36 ? -7.857 7.462 10.677 1.00 6.67 ? 35 TRP B CG 1 +ATOM 481 C CD1 . TRP A 1 36 ? -7.272 8.425 11.444 1.00 8.00 ? 35 TRP B CD1 1 +ATOM 482 C CD2 . TRP A 1 36 ? -7.995 8.016 9.364 1.00 7.29 ? 35 TRP B CD2 1 +ATOM 483 N NE1 . TRP A 1 36 ? -7.042 9.551 10.690 1.00 8.61 ? 35 TRP B NE1 1 +ATOM 484 C CE2 . TRP A 1 36 ? -7.476 9.321 9.409 1.00 7.67 ? 35 TRP B CE2 1 +ATOM 485 C CE3 . TRP A 1 36 ? -8.481 7.528 8.155 1.00 7.04 ? 35 TRP B CE3 1 +ATOM 486 C CZ2 . TRP A 1 36 ? -7.438 10.141 8.293 1.00 9.37 ? 35 TRP B CZ2 1 +ATOM 487 C CZ3 . TRP A 1 36 ? -8.449 8.359 7.054 1.00 9.13 ? 35 TRP B CZ3 1 +ATOM 488 C CH2 . TRP A 1 36 ? -7.932 9.638 7.134 1.00 9.62 ? 35 TRP B CH2 1 +ATOM 489 H H . TRP A 1 36 ? -9.539 6.253 13.363 1.00 7.19 ? 35 TRP B H 1 +ATOM 490 H HA . TRP A 1 36 ? -10.265 6.361 10.751 1.00 6.64 ? 35 TRP B HA 1 +ATOM 491 H HB2 . TRP A 1 36 ? -7.732 5.861 11.891 1.00 8.04 ? 35 TRP B HB2 1 +ATOM 492 H HB3 . TRP A 1 36 ? -8.048 5.480 10.383 1.00 8.04 ? 35 TRP B HB3 1 +ATOM 493 H HD1 . TRP A 1 36 ? -7.074 8.339 12.348 1.00 9.60 ? 35 TRP B HD1 1 +ATOM 494 H HE1 . TRP A 1 36 ? -6.687 10.281 10.975 1.00 10.33 ? 35 TRP B HE1 1 +ATOM 495 H HE3 . TRP A 1 36 ? -8.828 6.667 8.093 1.00 8.45 ? 35 TRP B HE3 1 +ATOM 496 H HZ2 . TRP A 1 36 ? -7.097 11.005 8.339 1.00 11.24 ? 35 TRP B HZ2 1 +ATOM 497 H HZ3 . TRP A 1 36 ? -8.780 8.051 6.241 1.00 10.95 ? 35 TRP B HZ3 1 +ATOM 498 H HH2 . TRP A 1 36 ? -7.930 10.172 6.373 1.00 11.54 ? 35 TRP B HH2 1 +ATOM 499 N N . PHE A 1 37 ? -10.758 3.996 10.519 1.00 6.19 ? 36 PHE B N 1 +ATOM 500 C CA . PHE A 1 37 ? -11.094 2.599 10.326 1.00 6.63 ? 36 PHE B CA 1 +ATOM 501 C C . PHE A 1 37 ? -10.602 2.206 8.943 1.00 6.87 ? 36 PHE B C 1 +ATOM 502 O O . PHE A 1 37 ? -10.280 3.071 8.125 1.00 7.96 ? 36 PHE B O 1 +ATOM 503 C CB . PHE A 1 37 ? -12.619 2.420 10.408 1.00 7.62 ? 36 PHE B CB 1 +ATOM 504 C CG . PHE A 1 37 ? -13.168 2.607 11.787 1.00 7.36 ? 36 PHE B CG 1 +ATOM 505 C CD1 . PHE A 1 37 ? -13.515 1.514 12.543 1.00 8.81 ? 36 PHE B CD1 1 +ATOM 506 C CD2 . PHE A 1 37 ? -13.319 3.874 12.335 1.00 8.12 ? 36 PHE B CD2 1 +ATOM 507 C CE1 . PHE A 1 37 ? -13.976 1.672 13.819 1.00 8.72 ? 36 PHE B CE1 1 +ATOM 508 C CE2 . PHE A 1 37 ? -13.792 4.028 13.611 1.00 9.35 ? 36 PHE B CE2 1 +ATOM 509 C CZ . PHE A 1 37 ? -14.122 2.932 14.347 1.00 9.31 ? 36 PHE B CZ 1 +ATOM 510 H H . PHE A 1 37 ? -11.049 4.492 9.880 1.00 7.43 ? 36 PHE B H 1 +ATOM 511 H HA . PHE A 1 37 ? -10.662 2.047 10.997 1.00 7.96 ? 36 PHE B HA 1 +ATOM 512 H HB2 . PHE A 1 37 ? -13.043 3.071 9.827 1.00 9.15 ? 36 PHE B HB2 1 +ATOM 513 H HB3 . PHE A 1 37 ? -12.845 1.522 10.117 1.00 9.15 ? 36 PHE B HB3 1 +ATOM 514 H HD1 . PHE A 1 37 ? -13.407 0.659 12.194 1.00 10.57 ? 36 PHE B HD1 1 +ATOM 515 H HD2 . PHE A 1 37 ? -13.084 4.623 11.837 1.00 9.74 ? 36 PHE B HD2 1 +ATOM 516 H HE1 . PHE A 1 37 ? -14.212 0.927 14.323 1.00 10.47 ? 36 PHE B HE1 1 +ATOM 517 H HE2 . PHE A 1 37 ? -13.893 4.879 13.972 1.00 11.22 ? 36 PHE B HE2 1 +ATOM 518 H HZ . PHE A 1 37 ? -14.453 3.037 15.209 1.00 11.17 ? 36 PHE B HZ 1 +ATOM 519 N N . ARG A 1 38 ? -10.562 0.910 8.658 1.00 7.67 ? 37 ARG B N 1 +ATOM 520 C CA . ARG A 1 38 ? -10.166 0.471 7.330 1.00 8.65 ? 37 ARG B CA 1 +ATOM 521 C C . ARG A 1 38 ? -10.916 -0.791 6.946 1.00 8.96 ? 37 ARG B C 1 +ATOM 522 O O . ARG A 1 38 ? -11.371 -1.552 7.780 1.00 9.04 ? 37 ARG B O 1 +ATOM 523 C CB . ARG A 1 38 ? -8.654 0.240 7.234 1.00 9.46 ? 37 ARG B CB 1 +ATOM 524 C CG . ARG A 1 38 ? -8.147 -0.937 8.043 1.00 8.79 ? 37 ARG B CG 1 +ATOM 525 C CD . ARG A 1 38 ? -6.645 -1.030 8.012 1.00 9.31 ? 37 ARG B CD 1 +ATOM 526 N NE . ARG A 1 38 ? -6.146 -2.158 8.782 1.00 10.07 ? 37 ARG B NE 1 +ATOM 527 C CZ . ARG A 1 38 ? -4.855 -2.452 8.918 1.00 9.47 ? 37 ARG B CZ 1 +ATOM 528 N NH1 . ARG A 1 38 ? -3.927 -1.667 8.404 1.00 9.81 1 37 ARG B NH1 1 +ATOM 529 N NH2 . ARG A 1 38 ? -4.490 -3.515 9.617 1.00 12.71 ? 37 ARG B NH2 1 +ATOM 530 H H . ARG A 1 38 ? -10.756 0.276 9.206 1.00 9.21 ? 37 ARG B H 1 +ATOM 531 H HA . ARG A 1 38 ? -10.401 1.161 6.690 1.00 10.38 ? 37 ARG B HA 1 +ATOM 532 H HB2 . ARG A 1 38 ? -8.422 0.081 6.306 1.00 11.35 ? 37 ARG B HB2 1 +ATOM 533 H HB3 . ARG A 1 38 ? -8.198 1.035 7.553 1.00 11.35 ? 37 ARG B HB3 1 +ATOM 534 H HG2 . ARG A 1 38 ? -8.425 -0.833 8.967 1.00 10.54 ? 37 ARG B HG2 1 +ATOM 535 H HG3 . ARG A 1 38 ? -8.510 -1.757 7.675 1.00 10.54 ? 37 ARG B HG3 1 +ATOM 536 H HD2 . ARG A 1 38 ? -6.353 -1.140 7.094 1.00 11.17 ? 37 ARG B HD2 1 +ATOM 537 H HD3 . ARG A 1 38 ? -6.268 -0.219 8.387 1.00 11.17 ? 37 ARG B HD3 1 +ATOM 538 H HE . ARG A 1 38 ? -6.713 -2.615 9.239 1.00 12.08 ? 37 ARG B HE 1 +ATOM 539 H HH11 . ARG A 1 38 ? -4.154 -0.977 7.945 1.00 11.77 ? 37 ARG B HH11 1 +ATOM 540 H HH12 . ARG A 1 38 ? -3.095 -1.860 8.508 1.00 11.77 ? 37 ARG B HH12 1 +ATOM 541 H HH21 . ARG A 1 38 ? -5.088 -4.023 9.969 1.00 15.25 ? 37 ARG B HH21 1 +ATOM 542 H HH22 . ARG A 1 38 ? -3.656 -3.693 9.725 1.00 15.25 ? 37 ARG B HH22 1 +ATOM 543 N N . GLN A 1 39 ? -11.032 -0.998 5.643 1.00 9.25 ? 38 GLN B N 1 +ATOM 544 C CA . GLN A 1 39 ? -11.709 -2.193 5.131 1.00 11.49 ? 38 GLN B CA 1 +ATOM 545 C C . GLN A 1 39 ? -10.953 -2.717 3.918 1.00 13.71 ? 38 GLN B C 1 +ATOM 546 O O . GLN A 1 39 ? -10.816 -2.021 2.913 1.00 13.76 ? 38 GLN B O 1 +ATOM 547 C CB . GLN A 1 39 ? -13.170 -1.884 4.801 1.00 13.73 ? 38 GLN B CB 1 +ATOM 548 C CG . GLN A 1 39 ? -13.995 -3.120 4.447 1.00 20.74 ? 38 GLN B CG 1 +ATOM 549 C CD . GLN A 1 39 ? -15.495 -2.893 4.583 1.00 25.28 ? 38 GLN B CD 1 +ATOM 550 O OE1 . GLN A 1 39 ? -15.969 -1.760 4.657 1.00 21.34 ? 38 GLN B OE1 1 +ATOM 551 N NE2 . GLN A 1 39 ? -16.249 -3.983 4.639 1.00 27.25 ? 38 GLN B NE2 1 +ATOM 552 H H . GLN A 1 39 ? -10.732 -0.470 5.034 1.00 11.10 ? 38 GLN B H 1 +ATOM 553 H HA . GLN A 1 39 ? -11.694 -2.881 5.813 1.00 13.78 ? 38 GLN B HA 1 +ATOM 554 H HB2 . GLN A 1 39 ? -13.583 -1.464 5.572 1.00 16.48 ? 38 GLN B HB2 1 +ATOM 555 H HB3 . GLN A 1 39 ? -13.200 -1.281 4.043 1.00 16.48 ? 38 GLN B HB3 1 +ATOM 556 H HG2 . GLN A 1 39 ? -13.812 -3.369 3.528 1.00 24.89 ? 38 GLN B HG2 1 +ATOM 557 H HG3 . GLN A 1 39 ? -13.748 -3.846 5.042 1.00 24.89 ? 38 GLN B HG3 1 +ATOM 558 H HE21 . GLN A 1 39 ? -15.883 -4.761 4.600 1.00 32.70 ? 38 GLN B HE21 1 +ATOM 559 H HE22 . GLN A 1 39 ? -17.102 -3.912 4.716 1.00 32.70 ? 38 GLN B HE22 1 +ATOM 560 N N . ALA A 1 40 ? -10.396 -3.916 4.074 1.00 17.04 ? 39 ALA B N 1 +ATOM 561 C CA . ALA A 1 40 ? -9.624 -4.588 3.034 1.00 21.17 ? 39 ALA B CA 1 +ATOM 562 C C . ALA A 1 40 ? -10.559 -5.467 2.223 1.00 25.97 ? 39 ALA B C 1 +ATOM 563 O O . ALA A 1 40 ? -11.700 -5.688 2.627 1.00 22.85 ? 39 ALA B O 1 +ATOM 564 C CB . ALA A 1 40 ? -8.521 -5.419 3.675 1.00 27.04 ? 39 ALA B CB 1 +ATOM 565 H H . ALA A 1 40 ? -10.454 -4.374 4.799 1.00 20.45 ? 39 ALA B H 1 +ATOM 566 H HA . ALA A 1 40 ? -9.221 -3.931 2.446 1.00 25.40 ? 39 ALA B HA 1 +ATOM 567 H HB1 . ALA A 1 40 ? -8.014 -5.862 2.976 1.00 32.45 ? 39 ALA B HB1 1 +ATOM 568 H HB2 . ALA A 1 40 ? -7.941 -4.833 4.185 1.00 32.45 ? 39 ALA B HB2 1 +ATOM 569 H HB3 . ALA A 1 40 ? -8.924 -6.079 4.261 1.00 32.45 ? 39 ALA B HB3 1 +ATOM 570 N N . PRO A 1 41 ? -10.085 -5.969 1.066 1.00 31.14 ? 40 PRO B N 1 +ATOM 571 C CA . PRO A 1 41 ? -10.947 -6.780 0.198 1.00 33.21 ? 40 PRO B CA 1 +ATOM 572 C C . PRO A 1 41 ? -11.471 -8.024 0.907 1.00 24.36 ? 40 PRO B C 1 +ATOM 573 O O . PRO A 1 41 ? -10.681 -8.784 1.471 1.00 31.34 ? 40 PRO B O 1 +ATOM 574 C CB . PRO A 1 41 ? -10.016 -7.179 -0.953 1.00 33.35 ? 40 PRO B CB 1 +ATOM 575 C CG . PRO A 1 41 ? -8.903 -6.194 -0.921 1.00 29.17 ? 40 PRO B CG 1 +ATOM 576 C CD . PRO A 1 41 ? -8.730 -5.819 0.511 1.00 31.36 ? 40 PRO B CD 1 +ATOM 577 H HA . PRO A 1 41 ? -11.688 -6.255 -0.143 1.00 39.85 ? 40 PRO B HA 1 +ATOM 578 H HB2 . PRO A 1 41 ? -9.682 -8.078 -0.806 1.00 40.03 ? 40 PRO B HB2 1 +ATOM 579 H HB3 . PRO A 1 41 ? -10.496 -7.126 -1.794 1.00 40.03 ? 40 PRO B HB3 1 +ATOM 580 H HG2 . PRO A 1 41 ? -8.095 -6.606 -1.265 1.00 35.00 ? 40 PRO B HG2 1 +ATOM 581 H HG3 . PRO A 1 41 ? -9.141 -5.417 -1.450 1.00 35.00 ? 40 PRO B HG3 1 +ATOM 582 H HD2 . PRO A 1 41 ? -8.116 -6.429 0.949 1.00 37.64 ? 40 PRO B HD2 1 +ATOM 583 H HD3 . PRO A 1 41 ? -8.433 -4.899 0.586 1.00 37.64 ? 40 PRO B HD3 1 +ATOM 584 N N . GLY A 1 42 ? -12.788 -8.197 0.900 1.00 25.22 ? 41 GLY B N 1 +ATOM 585 C CA . GLY A 1 42 ? -13.421 -9.372 1.473 1.00 35.50 ? 41 GLY B CA 1 +ATOM 586 C C . GLY A 1 42 ? -13.627 -9.319 2.977 1.00 36.22 ? 41 GLY B C 1 +ATOM 587 O O . GLY A 1 42 ? -14.415 -10.093 3.520 1.00 37.37 ? 41 GLY B O 1 +ATOM 588 H HA2 . GLY A 1 42 ? -14.289 -9.496 1.057 1.00 42.60 ? 41 GLY B HA2 1 +ATOM 589 H HA3 . GLY A 1 42 ? -12.879 -10.151 1.273 1.00 42.60 ? 41 GLY B HA3 1 +ATOM 590 N N . LYS A 1 43 ? -12.927 -8.406 3.648 1.00 28.83 ? 42 LYS B N 1 +ATOM 591 C CA . LYS A 1 43 ? -12.950 -8.328 5.109 1.00 25.39 ? 42 LYS B CA 1 +ATOM 592 C C . LYS A 1 43 ? -13.959 -7.305 5.636 1.00 23.41 ? 42 LYS B C 1 +ATOM 593 O O . LYS A 1 43 ? -14.366 -6.385 4.927 1.00 24.99 ? 42 LYS B O 1 +ATOM 594 C CB . LYS A 1 43 ? -11.557 -7.978 5.633 1.00 32.34 ? 42 LYS B CB 1 +ATOM 595 C CG . LYS A 1 43 ? -10.472 -8.968 5.235 1.00 33.70 ? 42 LYS B CG 1 +ATOM 596 C CD . LYS A 1 43 ? -9.217 -8.775 6.082 1.00 40.62 ? 42 LYS B CD 1 +ATOM 597 C CE . LYS A 1 43 ? -8.131 -9.785 5.725 1.00 45.12 ? 42 LYS B CE 1 +ATOM 598 N NZ . LYS A 1 43 ? -7.202 -10.027 6.869 1.00 50.22 1 42 LYS B NZ 1 +ATOM 599 H H . LYS A 1 43 ? -12.426 -7.814 3.277 1.00 34.59 ? 42 LYS B H 1 +ATOM 600 H HA . LYS A 1 43 ? -13.193 -9.197 5.466 1.00 30.47 ? 42 LYS B HA 1 +ATOM 601 H HB2 . LYS A 1 43 ? -11.304 -7.108 5.286 1.00 38.81 ? 42 LYS B HB2 1 +ATOM 602 H HB3 . LYS A 1 43 ? -11.587 -7.948 6.602 1.00 38.81 ? 42 LYS B HB3 1 +ATOM 603 H HG2 . LYS A 1 43 ? -10.796 -9.872 5.371 1.00 40.45 ? 42 LYS B HG2 1 +ATOM 604 H HG3 . LYS A 1 43 ? -10.237 -8.830 4.304 1.00 40.45 ? 42 LYS B HG3 1 +ATOM 605 H HD2 . LYS A 1 43 ? -8.863 -7.885 5.930 1.00 48.75 ? 42 LYS B HD2 1 +ATOM 606 H HD3 . LYS A 1 43 ? -9.442 -8.891 7.018 1.00 48.75 ? 42 LYS B HD3 1 +ATOM 607 H HE2 . LYS A 1 43 ? -8.546 -10.629 5.488 1.00 54.14 ? 42 LYS B HE2 1 +ATOM 608 H HE3 . LYS A 1 43 ? -7.612 -9.446 4.979 1.00 54.14 ? 42 LYS B HE3 1 +ATOM 609 H HZ1 . LYS A 1 43 ? -6.804 -9.266 7.103 1.00 60.26 ? 42 LYS B HZ1 1 +ATOM 610 H HZ2 . LYS A 1 43 ? -7.655 -10.343 7.566 1.00 60.26 ? 42 LYS B HZ2 1 +ATOM 611 H HZ3 . LYS A 1 43 ? -6.580 -10.618 6.635 1.00 60.26 ? 42 LYS B HZ3 1 +ATOM 612 N N . GLU A 1 44 ? -14.366 -7.462 6.891 1.00 19.15 ? 43 GLU B N 1 +ATOM 613 C CA . GLU A 1 44 ? -15.208 -6.451 7.513 1.00 18.98 ? 43 GLU B CA 1 +ATOM 614 C C . GLU A 1 44 ? -14.367 -5.244 7.926 1.00 13.77 ? 43 GLU B C 1 +ATOM 615 O O . GLU A 1 44 ? -13.137 -5.340 8.089 1.00 13.86 ? 43 GLU B O 1 +ATOM 616 C CB . GLU A 1 44 ? -15.984 -7.017 8.701 1.00 24.26 ? 43 GLU B CB 1 +ATOM 617 C CG . GLU A 1 44 ? -15.145 -7.460 9.874 1.00 33.47 ? 43 GLU B CG 1 +ATOM 618 C CD . GLU A 1 44 ? -15.963 -8.219 10.904 1.00 44.86 ? 43 GLU B CD 1 +ATOM 619 O OE1 . GLU A 1 44 ? -16.727 -9.128 10.508 1.00 50.35 ? 43 GLU B OE1 1 +ATOM 620 O OE2 . GLU A 1 44 ? -15.852 -7.899 12.107 1.00 47.87 -1 43 GLU B OE2 1 +ATOM 621 H H . GLU A 1 44 ? -14.173 -8.132 7.395 1.00 22.98 ? 43 GLU B H 1 +ATOM 622 H HA . GLU A 1 44 ? -15.857 -6.145 6.859 1.00 22.78 ? 43 GLU B HA 1 +ATOM 623 H HB2 . GLU A 1 44 ? -16.595 -6.336 9.021 1.00 29.12 ? 43 GLU B HB2 1 +ATOM 624 H HB3 . GLU A 1 44 ? -16.490 -7.788 8.397 1.00 29.12 ? 43 GLU B HB3 1 +ATOM 625 H HG2 . GLU A 1 44 ? -14.439 -8.046 9.557 1.00 40.16 ? 43 GLU B HG2 1 +ATOM 626 H HG3 . GLU A 1 44 ? -14.764 -6.680 10.305 1.00 40.16 ? 43 GLU B HG3 1 +ATOM 627 N N . ARG A 1 45 ? -15.050 -4.114 8.070 1.00 13.37 ? 44 ARG B N 1 +ATOM 628 C CA . ARG A 1 45 ? -14.403 -2.870 8.464 1.00 11.10 ? 44 ARG B CA 1 +ATOM 629 C C . ARG A 1 45 ? -13.850 -3.048 9.864 1.00 11.47 ? 44 ARG B C 1 +ATOM 630 O O . ARG A 1 45 ? -14.508 -3.626 10.733 1.00 12.69 ? 44 ARG B O 1 +ATOM 631 C CB . ARG A 1 45 ? -15.381 -1.696 8.407 1.00 12.98 ? 44 ARG B CB 1 +ATOM 632 C CG . ARG A 1 45 ? -14.735 -0.351 8.689 1.00 12.84 ? 44 ARG B CG 1 +ATOM 633 C CD . ARG A 1 45 ? -15.473 0.812 8.056 1.00 11.55 ? 44 ARG B CD 1 +ATOM 634 N NE . ARG A 1 45 ? -16.800 1.052 8.607 1.00 14.68 ? 44 ARG B NE 1 +ATOM 635 C CZ . ARG A 1 45 ? -17.670 1.929 8.106 1.00 13.03 ? 44 ARG B CZ 1 +ATOM 636 N NH1 . ARG A 1 45 ? -17.356 2.658 7.041 1.00 12.19 1 44 ARG B NH1 1 +ATOM 637 N NH2 . ARG A 1 45 ? -18.863 2.081 8.675 1.00 14.34 ? 44 ARG B NH2 1 +ATOM 638 H H . ARG A 1 45 ? -15.898 -4.041 7.943 1.00 16.04 ? 44 ARG B H 1 +ATOM 639 H HA . ARG A 1 45 ? -13.665 -2.685 7.863 1.00 13.32 ? 44 ARG B HA 1 +ATOM 640 H HB2 . ARG A 1 45 ? -15.772 -1.657 7.520 1.00 15.58 ? 44 ARG B HB2 1 +ATOM 641 H HB3 . ARG A 1 45 ? -16.077 -1.836 9.068 1.00 15.58 ? 44 ARG B HB3 1 +ATOM 642 H HG2 . ARG A 1 45 ? -14.717 -0.207 9.648 1.00 15.41 ? 44 ARG B HG2 1 +ATOM 643 H HG3 . ARG A 1 45 ? -13.831 -0.357 8.338 1.00 15.41 ? 44 ARG B HG3 1 +ATOM 644 H HD2 . ARG A 1 45 ? -14.950 1.619 8.184 1.00 13.85 ? 44 ARG B HD2 1 +ATOM 645 H HD3 . ARG A 1 45 ? -15.576 0.637 7.107 1.00 13.85 ? 44 ARG B HD3 1 +ATOM 646 H HE . ARG A 1 45 ? -17.057 0.561 9.265 1.00 17.61 ? 44 ARG B HE 1 +ATOM 647 H HH11 . ARG A 1 45 ? -16.587 2.564 6.668 1.00 14.63 ? 44 ARG B HH11 1 +ATOM 648 H HH12 . ARG A 1 45 ? -17.922 3.222 6.723 1.00 14.63 ? 44 ARG B HH12 1 +ATOM 649 H HH21 . ARG A 1 45 ? -19.072 1.613 9.365 1.00 17.21 ? 44 ARG B HH21 1 +ATOM 650 H HH22 . ARG A 1 45 ? -19.424 2.647 8.353 1.00 17.21 ? 44 ARG B HH22 1 +ATOM 651 N N . GLU A 1 46 ? -12.636 -2.544 10.090 1.00 9.38 ? 45 GLU B N 1 +ATOM 652 C CA . GLU A 1 46 ? -12.001 -2.686 11.390 1.00 9.96 ? 45 GLU B CA 1 +ATOM 653 C C . GLU A 1 46 ? -11.371 -1.373 11.860 1.00 8.31 ? 45 GLU B C 1 +ATOM 654 O O . GLU A 1 46 ? -11.032 -0.500 11.081 1.00 8.16 ? 45 GLU B O 1 +ATOM 655 C CB . GLU A 1 46 ? -10.948 -3.788 11.328 1.00 12.52 ? 45 GLU B CB 1 +ATOM 656 C CG . GLU A 1 46 ? -9.782 -3.409 10.470 1.00 11.25 ? 45 GLU B CG 1 +ATOM 657 C CD . GLU A 1 46 ? -8.828 -4.545 10.156 1.00 16.41 ? 45 GLU B CD 1 +ATOM 658 O OE1 . GLU A 1 46 ? -9.279 -5.716 10.086 1.00 20.06 ? 45 GLU B OE1 1 +ATOM 659 O OE2 . GLU A 1 46 ? -7.624 -4.260 9.938 1.00 15.71 -1 45 GLU B OE2 1 +ATOM 660 H H . GLU A 1 46 ? -12.166 -2.119 9.509 1.00 11.26 ? 45 GLU B H 1 +ATOM 661 H HA . GLU A 1 46 ? -12.671 -2.947 12.042 1.00 11.95 ? 45 GLU B HA 1 +ATOM 662 H HB2 . GLU A 1 46 ? -10.619 -3.963 12.224 1.00 15.02 ? 45 GLU B HB2 1 +ATOM 663 H HB3 . GLU A 1 46 ? -11.348 -4.589 10.956 1.00 15.02 ? 45 GLU B HB3 1 +ATOM 664 H HG2 . GLU A 1 46 ? -10.117 -3.065 9.628 1.00 13.50 ? 45 GLU B HG2 1 +ATOM 665 H HG3 . GLU A 1 46 ? -9.275 -2.718 10.925 1.00 13.50 ? 45 GLU B HG3 1 +ATOM 666 N N . PHE A 1 47 ? -11.233 -1.273 13.167 1.00 7.93 ? 46 PHE B N 1 +ATOM 667 C CA . PHE A 1 47 ? -10.627 -0.118 13.807 1.00 7.80 ? 46 PHE B CA 1 +ATOM 668 C C . PHE A 1 47 ? -9.161 -0.029 13.509 1.00 7.86 ? 46 PHE B C 1 +ATOM 669 O O . PHE A 1 47 ? -8.478 -1.039 13.426 1.00 8.99 ? 46 PHE B O 1 +ATOM 670 C CB . PHE A 1 47 ? -10.811 -0.274 15.305 1.00 9.17 ? 46 PHE B CB 1 +ATOM 671 C CG . PHE A 1 47 ? -10.251 0.856 16.120 1.00 7.33 ? 46 PHE B CG 1 +ATOM 672 C CD1 . PHE A 1 47 ? -10.681 2.154 15.908 1.00 7.32 ? 46 PHE B CD1 1 +ATOM 673 C CD2 . PHE A 1 47 ? -9.340 0.612 17.122 1.00 8.06 ? 46 PHE B CD2 1 +ATOM 674 C CE1 . PHE A 1 47 ? -10.192 3.179 16.667 1.00 7.70 ? 46 PHE B CE1 1 +ATOM 675 C CE2 . PHE A 1 47 ? -8.852 1.657 17.890 1.00 8.66 ? 46 PHE B CE2 1 +ATOM 676 C CZ . PHE A 1 47 ? -9.282 2.931 17.656 1.00 7.44 ? 46 PHE B CZ 1 +ATOM 677 H H . PHE A 1 47 ? -11.488 -1.878 13.722 1.00 9.52 ? 46 PHE B H 1 +ATOM 678 H HA . PHE A 1 47 ? -11.064 0.697 13.513 1.00 9.36 ? 46 PHE B HA 1 +ATOM 679 H HB2 . PHE A 1 47 ? -11.760 -0.333 15.497 1.00 11.00 ? 46 PHE B HB2 1 +ATOM 680 H HB3 . PHE A 1 47 ? -10.369 -1.089 15.589 1.00 11.00 ? 46 PHE B HB3 1 +ATOM 681 H HD1 . PHE A 1 47 ? -11.303 2.331 15.239 1.00 8.78 ? 46 PHE B HD1 1 +ATOM 682 H HD2 . PHE A 1 47 ? -9.050 -0.257 17.284 1.00 9.67 ? 46 PHE B HD2 1 +ATOM 683 H HE1 . PHE A 1 47 ? -10.481 4.049 16.511 1.00 9.24 ? 46 PHE B HE1 1 +ATOM 684 H HE2 . PHE A 1 47 ? -8.229 1.490 18.560 1.00 10.39 ? 46 PHE B HE2 1 +ATOM 685 H HZ . PHE A 1 47 ? -8.948 3.634 18.166 1.00 8.92 ? 46 PHE B HZ 1 +ATOM 686 N N . VAL A 1 48 ? -8.677 1.198 13.354 1.00 7.11 ? 47 VAL B N 1 +ATOM 687 C CA . VAL A 1 48 ? -7.263 1.494 13.207 1.00 6.82 ? 47 VAL B CA 1 +ATOM 688 C C . VAL A 1 48 ? -6.769 2.366 14.376 1.00 6.61 ? 47 VAL B C 1 +ATOM 689 O O . VAL A 1 48 ? -5.880 1.949 15.117 1.00 7.10 ? 47 VAL B O 1 +ATOM 690 C CB . VAL A 1 48 ? -6.971 2.165 11.861 1.00 6.21 ? 47 VAL B CB 1 +ATOM 691 C CG1 . VAL A 1 48 ? -5.513 2.525 11.725 1.00 7.85 ? 47 VAL B CG1 1 +ATOM 692 C CG2 . VAL A 1 48 ? -7.374 1.225 10.733 1.00 7.27 ? 47 VAL B CG2 1 +ATOM 693 H H . VAL A 1 48 ? -9.171 1.901 13.330 1.00 8.53 ? 47 VAL B H 1 +ATOM 694 H HA . VAL A 1 48 ? -6.768 0.660 13.233 1.00 8.18 ? 47 VAL B HA 1 +ATOM 695 H HB . VAL A 1 48 ? -7.496 2.978 11.784 1.00 7.46 ? 47 VAL B HB 1 +ATOM 696 H HG11 . VAL A 1 48 ? -5.371 2.946 10.863 1.00 9.42 ? 47 VAL B HG11 1 +ATOM 697 H HG12 . VAL A 1 48 ? -5.272 3.138 12.437 1.00 9.42 ? 47 VAL B HG12 1 +ATOM 698 H HG13 . VAL A 1 48 ? -4.981 1.716 11.791 1.00 9.42 ? 47 VAL B HG13 1 +ATOM 699 H HG21 . VAL A 1 48 ? -7.187 1.653 9.883 1.00 8.72 ? 47 VAL B HG21 1 +ATOM 700 H HG22 . VAL A 1 48 ? -6.862 0.404 10.809 1.00 8.72 ? 47 VAL B HG22 1 +ATOM 701 H HG23 . VAL A 1 48 ? -8.321 1.032 10.806 1.00 8.72 ? 47 VAL B HG23 1 +ATOM 702 N N . ALA A 1 49 ? -7.322 3.567 14.539 1.00 5.85 ? 48 ALA B N 1 +ATOM 703 C CA . ALA A 1 49 ? -6.819 4.478 15.570 1.00 6.34 ? 48 ALA B CA 1 +ATOM 704 C C . ALA A 1 49 ? -7.865 5.527 15.871 1.00 5.73 ? 48 ALA B C 1 +ATOM 705 O O . ALA A 1 49 ? -8.718 5.815 15.031 1.00 6.54 ? 48 ALA B O 1 +ATOM 706 C CB . ALA A 1 49 ? -5.522 5.143 15.097 1.00 6.75 ? 48 ALA B CB 1 +ATOM 707 H H . ALA A 1 49 ? -7.978 3.875 14.077 1.00 7.02 ? 48 ALA B H 1 +ATOM 708 H HA . ALA A 1 49 ? -6.635 3.981 16.382 1.00 7.61 ? 48 ALA B HA 1 +ATOM 709 H HB1 . ALA A 1 49 ? -5.204 5.741 15.791 1.00 8.11 ? 48 ALA B HB1 1 +ATOM 710 H HB2 . ALA A 1 49 ? -4.860 4.455 14.923 1.00 8.11 ? 48 ALA B HB2 1 +ATOM 711 H HB3 . ALA A 1 49 ? -5.702 5.642 14.285 1.00 8.11 ? 48 ALA B HB3 1 +ATOM 712 N N . ALA A 1 50 ? -7.795 6.141 17.044 1.00 5.65 ? 49 ALA B N 1 +ATOM 713 C CA . ALA A 1 50 ? -8.720 7.214 17.407 1.00 5.83 ? 49 ALA B CA 1 +ATOM 714 C C . ALA A 1 50 ? -8.028 8.234 18.279 1.00 5.34 ? 49 ALA B C 1 +ATOM 715 O O . ALA A 1 50 ? -6.986 7.944 18.900 1.00 5.43 ? 49 ALA B O 1 +ATOM 716 C CB . ALA A 1 50 ? -9.934 6.663 18.122 1.00 6.00 ? 49 ALA B CB 1 +ATOM 717 H H . ALA A 1 50 ? -7.218 5.955 17.654 1.00 6.78 ? 49 ALA B H 1 +ATOM 718 H HA . ALA A 1 50 ? -9.021 7.660 16.600 1.00 6.99 ? 49 ALA B HA 1 +ATOM 719 H HB1 . ALA A 1 50 ? -10.526 7.397 18.348 1.00 7.20 ? 49 ALA B HB1 1 +ATOM 720 H HB2 . ALA A 1 50 ? -10.389 6.039 17.535 1.00 7.20 ? 49 ALA B HB2 1 +ATOM 721 H HB3 . ALA A 1 50 ? -9.645 6.209 18.929 1.00 7.20 ? 49 ALA B HB3 1 +ATOM 722 N N . ILE A 1 51 ? -8.605 9.421 18.337 1.00 5.32 ? 50 ILE B N 1 +ATOM 723 C CA . ILE A 1 51 ? -8.034 10.519 19.087 1.00 5.41 ? 50 ILE B CA 1 +ATOM 724 C C . ILE A 1 51 ? -9.153 11.337 19.734 1.00 5.35 ? 50 ILE B C 1 +ATOM 725 O O . ILE A 1 51 ? -10.150 11.725 19.096 1.00 5.76 ? 50 ILE B O 1 +ATOM 726 C CB . ILE A 1 51 ? -7.128 11.396 18.193 1.00 5.48 ? 50 ILE B CB 1 +ATOM 727 C CG1 . ILE A 1 51 ? -6.433 12.474 19.028 1.00 5.15 ? 50 ILE B CG1 1 +ATOM 728 C CG2 . ILE A 1 51 ? -7.882 11.969 17.003 1.00 6.24 ? 50 ILE B CG2 1 +ATOM 729 C CD1 . ILE A 1 51 ? -5.199 13.007 18.343 1.00 7.41 ? 50 ILE B CD1 1 +ATOM 730 H H . ILE A 1 51 ? -9.344 9.618 17.942 1.00 6.38 ? 50 ILE B H 1 +ATOM 731 H HA . ILE A 1 51 ? -7.484 10.157 19.799 1.00 6.49 ? 50 ILE B HA 1 +ATOM 732 H HB . ILE A 1 51 ? -6.434 10.818 17.838 1.00 6.58 ? 50 ILE B HB 1 +ATOM 733 H HG12 . ILE A 1 51 ? -7.046 13.213 19.167 1.00 6.18 ? 50 ILE B HG12 1 +ATOM 734 H HG13 . ILE A 1 51 ? -6.167 12.095 19.880 1.00 6.18 ? 50 ILE B HG13 1 +ATOM 735 H HG21 . ILE A 1 51 ? -7.273 12.509 16.475 1.00 7.48 ? 50 ILE B HG21 1 +ATOM 736 H HG22 . ILE A 1 51 ? -8.227 11.238 16.467 1.00 7.48 ? 50 ILE B HG22 1 +ATOM 737 H HG23 . ILE A 1 51 ? -8.614 12.517 17.328 1.00 7.48 ? 50 ILE B HG23 1 +ATOM 738 H HD11 . ILE A 1 51 ? -4.794 13.685 18.906 1.00 8.89 ? 50 ILE B HD11 1 +ATOM 739 H HD12 . ILE A 1 51 ? -4.576 12.277 18.203 1.00 8.89 ? 50 ILE B HD12 1 +ATOM 740 H HD13 . ILE A 1 51 ? -5.454 13.394 17.491 1.00 8.89 ? 50 ILE B HD13 1 +ATOM 741 N N . ARG A 1 52 ? -8.982 11.582 21.024 1.00 5.80 ? 51 ARG B N 1 +ATOM 742 C CA . ARG A 1 52 ? -9.927 12.334 21.815 1.00 4.92 ? 51 ARG B CA 1 +ATOM 743 C C . ARG A 1 52 ? -10.072 13.751 21.289 1.00 5.44 ? 51 ARG B C 1 +ATOM 744 O O . ARG A 1 52 ? -9.182 14.287 20.621 1.00 5.59 ? 51 ARG B O 1 +ATOM 745 C CB . ARG A 1 52 ? -9.401 12.324 23.252 1.00 5.14 ? 51 ARG B CB 1 +ATOM 746 C CG . ARG A 1 52 ? -10.311 12.879 24.303 1.00 5.63 ? 51 ARG B CG 1 +ATOM 747 C CD . ARG A 1 52 ? -9.771 12.606 25.717 1.00 6.05 ? 51 ARG B CD 1 +ATOM 748 N NE . ARG A 1 52 ? -10.765 13.031 26.689 1.00 5.49 ? 51 ARG B NE 1 +ATOM 749 C CZ . ARG A 1 52 ? -10.537 13.638 27.847 1.00 5.99 ? 51 ARG B CZ 1 +ATOM 750 N NH1 . ARG A 1 52 ? -9.300 13.887 28.262 1.00 6.14 1 51 ARG B NH1 1 +ATOM 751 N NH2 . ARG A 1 52 ? -11.565 14.020 28.577 1.00 6.18 ? 51 ARG B NH2 1 +ATOM 752 H H . ARG A 1 52 ? -8.301 11.311 21.475 1.00 6.96 ? 51 ARG B H 1 +ATOM 753 H HA . ARG A 1 52 ? -10.795 11.900 21.794 1.00 5.90 ? 51 ARG B HA 1 +ATOM 754 H HB2 . ARG A 1 52 ? -9.206 11.406 23.496 1.00 6.17 ? 51 ARG B HB2 1 +ATOM 755 H HB3 . ARG A 1 52 ? -8.582 12.843 23.278 1.00 6.17 ? 51 ARG B HB3 1 +ATOM 756 H HG2 . ARG A 1 52 ? -10.386 13.839 24.187 1.00 6.76 ? 51 ARG B HG2 1 +ATOM 757 H HG3 . ARG A 1 52 ? -11.183 12.462 24.225 1.00 6.76 ? 51 ARG B HG3 1 +ATOM 758 H HD2 . ARG A 1 52 ? -9.611 11.656 25.830 1.00 7.26 ? 51 ARG B HD2 1 +ATOM 759 H HD3 . ARG A 1 52 ? -8.956 13.112 25.862 1.00 7.26 ? 51 ARG B HD3 1 +ATOM 760 H HE . ARG A 1 52 ? -11.587 12.872 26.492 1.00 6.59 ? 51 ARG B HE 1 +ATOM 761 H HH11 . ARG A 1 52 ? -8.629 13.655 27.777 1.00 7.37 ? 51 ARG B HH11 1 +ATOM 762 H HH12 . ARG A 1 52 ? -9.170 14.275 29.018 1.00 7.37 ? 51 ARG B HH12 1 +ATOM 763 H HH21 . ARG A 1 52 ? -12.366 13.850 28.314 1.00 7.42 ? 51 ARG B HH21 1 +ATOM 764 H HH22 . ARG A 1 52 ? -11.434 14.393 29.341 1.00 7.42 ? 51 ARG B HH22 1 +ATOM 765 N N . TRP A 1 53 ? -11.212 14.358 21.608 1.00 5.60 ? 52 TRP B N 1 +ATOM 766 C CA . TRP A 1 53 ? -11.526 15.733 21.218 1.00 6.09 ? 52 TRP B CA 1 +ATOM 767 C C . TRP A 1 53 ? -10.406 16.724 21.466 1.00 6.36 ? 52 TRP B C 1 +ATOM 768 O O . TRP A 1 53 ? -10.250 17.668 20.710 1.00 7.74 ? 52 TRP B O 1 +ATOM 769 C CB . TRP A 1 53 ? -12.801 16.220 21.944 1.00 5.84 ? 52 TRP B CB 1 +ATOM 770 C CG . TRP A 1 53 ? -12.670 16.268 23.429 1.00 6.25 ? 52 TRP B CG 1 +ATOM 771 C CD1 . TRP A 1 53 ? -12.978 15.279 24.307 1.00 6.70 ? 52 TRP B CD1 1 +ATOM 772 C CD2 . TRP A 1 53 ? -12.164 17.355 24.220 1.00 6.52 ? 52 TRP B CD2 1 +ATOM 773 N NE1 . TRP A 1 53 ? -12.697 15.671 25.590 1.00 6.69 ? 52 TRP B NE1 1 +ATOM 774 C CE2 . TRP A 1 53 ? -12.194 16.940 25.565 1.00 5.52 ? 52 TRP B CE2 1 +ATOM 775 C CE3 . TRP A 1 53 ? -11.702 18.641 23.926 1.00 6.81 ? 52 TRP B CE3 1 +ATOM 776 C CZ2 . TRP A 1 53 ? -11.770 17.769 26.618 1.00 6.21 ? 52 TRP B CZ2 1 +ATOM 777 C CZ3 . TRP A 1 53 ? -11.290 19.451 24.968 1.00 7.48 ? 52 TRP B CZ3 1 +ATOM 778 C CH2 . TRP A 1 53 ? -11.315 19.010 26.286 1.00 7.44 ? 52 TRP B CH2 1 +ATOM 779 H H . TRP A 1 53 ? -11.838 13.984 22.063 1.00 6.72 ? 52 TRP B H 1 +ATOM 780 H HA . TRP A 1 53 ? -11.714 15.743 20.266 1.00 7.30 ? 52 TRP B HA 1 +ATOM 781 H HB2 . TRP A 1 53 ? -13.012 17.115 21.636 1.00 7.00 ? 52 TRP B HB2 1 +ATOM 782 H HB3 . TRP A 1 53 ? -13.531 15.618 21.730 1.00 7.00 ? 52 TRP B HB3 1 +ATOM 783 H HD1 . TRP A 1 53 ? -13.313 14.444 24.069 1.00 8.04 ? 52 TRP B HD1 1 +ATOM 784 H HE1 . TRP A 1 53 ? -12.812 15.193 26.296 1.00 8.03 ? 52 TRP B HE1 1 +ATOM 785 H HE3 . TRP A 1 53 ? -11.661 18.941 23.046 1.00 8.17 ? 52 TRP B HE3 1 +ATOM 786 H HZ2 . TRP A 1 53 ? -11.804 17.486 27.503 1.00 7.46 ? 52 TRP B HZ2 1 +ATOM 787 H HZ3 . TRP A 1 53 ? -10.967 20.302 24.781 1.00 8.97 ? 52 TRP B HZ3 1 +ATOM 788 H HH2 . TRP A 1 53 ? -11.038 19.586 26.961 1.00 8.93 ? 52 TRP B HH2 1 +ATOM 789 N N . ASN A 1 54 ? -9.648 16.527 22.534 1.00 5.96 ? 53 ASN B N 1 +ATOM 790 C CA . ASN A 1 54 ? -8.612 17.475 22.939 1.00 6.37 ? 53 ASN B CA 1 +ATOM 791 C C . ASN A 1 54 ? -7.274 17.223 22.275 1.00 6.78 ? 53 ASN B C 1 +ATOM 792 O O . ASN A 1 54 ? -6.335 18.000 22.469 1.00 8.36 ? 53 ASN B O 1 +ATOM 793 C CB . ASN A 1 54 ? -8.434 17.458 24.473 1.00 6.37 ? 53 ASN B CB 1 +ATOM 794 C CG . ASN A 1 54 ? -7.876 16.154 24.987 1.00 6.40 ? 53 ASN B CG 1 +ATOM 795 O OD1 . ASN A 1 54 ? -7.894 15.141 24.301 1.00 7.23 ? 53 ASN B OD1 1 +ATOM 796 N ND2 . ASN A 1 54 ? -7.362 16.176 26.208 1.00 6.75 ? 53 ASN B ND2 1 +ATOM 797 H H . ASN A 1 54 ? -9.713 15.843 23.052 1.00 7.15 ? 53 ASN B H 1 +ATOM 798 H HA . ASN A 1 54 ? -8.898 18.367 22.688 1.00 7.65 ? 53 ASN B HA 1 +ATOM 799 H HB2 . ASN A 1 54 ? -7.822 18.167 24.727 1.00 7.65 ? 53 ASN B HB2 1 +ATOM 800 H HB3 . ASN A 1 54 ? -9.297 17.600 24.891 1.00 7.65 ? 53 ASN B HB3 1 +ATOM 801 H HD21 . ASN A 1 54 ? -7.031 15.459 26.548 1.00 8.10 ? 53 ASN B HD21 1 +ATOM 802 H HD22 . ASN A 1 54 ? -7.360 16.907 26.661 1.00 8.10 ? 53 ASN B HD22 1 +ATOM 803 N N . GLY A 1 55 ? -7.178 16.172 21.473 1.00 7.03 ? 54 GLY B N 1 +ATOM 804 C CA . GLY A 1 55 ? -5.914 15.812 20.874 1.00 7.30 ? 54 GLY B CA 1 +ATOM 805 C C . GLY A 1 55 ? -4.913 15.229 21.850 1.00 7.68 ? 54 GLY B C 1 +ATOM 806 O O . GLY A 1 55 ? -3.739 15.049 21.462 1.00 9.41 ? 54 GLY B O 1 +ATOM 807 H H . GLY A 1 55 ? -7.831 15.655 21.262 1.00 8.44 ? 54 GLY B H 1 +ATOM 808 H HA2 . GLY A 1 55 ? -6.069 15.159 20.174 1.00 8.76 ? 54 GLY B HA2 1 +ATOM 809 H HA3 . GLY A 1 55 ? -5.518 16.600 20.470 1.00 8.76 ? 54 GLY B HA3 1 +ATOM 810 N N . GLY A 1 56 ? -5.332 14.910 23.074 1.00 6.57 ? 55 GLY B N 1 +ATOM 811 C CA . GLY A 1 56 ? -4.419 14.556 24.150 1.00 7.83 ? 55 GLY B CA 1 +ATOM 812 C C . GLY A 1 56 ? -4.424 13.104 24.571 1.00 7.00 ? 55 GLY B C 1 +ATOM 813 O O . GLY A 1 56 ? -3.595 12.729 25.407 1.00 7.74 ? 55 GLY B O 1 +ATOM 814 H H . GLY A 1 56 ? -6.160 14.893 23.307 1.00 7.89 ? 55 GLY B H 1 +ATOM 815 H HA2 . GLY A 1 56 ? -3.515 14.782 23.878 1.00 9.40 ? 55 GLY B HA2 1 +ATOM 816 H HA3 . GLY A 1 56 ? -4.636 15.090 24.930 1.00 9.40 ? 55 GLY B HA3 1 +ATOM 817 N N . SER A 1 57 ? -5.361 12.309 24.049 1.00 6.37 ? 56 SER B N 1 +ATOM 818 C CA . SER A 1 57 ? -5.423 10.865 24.261 1.00 5.95 ? 56 SER B CA 1 +ATOM 819 C C . SER A 1 57 ? -5.626 10.218 22.921 1.00 5.96 ? 56 SER B C 1 +ATOM 820 O O . SER A 1 57 ? -6.389 10.741 22.090 1.00 5.64 ? 56 SER B O 1 +ATOM 821 C CB . SER A 1 57 ? -6.583 10.439 25.158 1.00 6.23 ? 56 SER B CB 1 +ATOM 822 O OG . SER A 1 57 ? -6.426 10.983 26.450 1.00 7.25 ? 56 SER B OG 1 +ATOM 823 H H . SER A 1 57 ? -5.997 12.599 23.548 1.00 7.65 ? 56 SER B H 1 +ATOM 824 H HA . SER A 1 57 ? -4.591 10.547 24.644 1.00 7.14 ? 56 SER B HA 1 +ATOM 825 H HB2 . SER A 1 57 ? -7.415 10.761 24.777 1.00 7.48 ? 56 SER B HB2 1 +ATOM 826 H HB3 . SER A 1 57 ? -6.598 9.471 25.221 1.00 7.48 ? 56 SER B HB3 1 +ATOM 827 H HG . SER A 1 57 ? -7.065 10.747 26.941 1.00 8.70 ? 56 SER B HG 1 +ATOM 828 N N . THR A 1 58 ? -4.990 9.063 22.729 1.00 5.28 ? 57 THR B N 1 +ATOM 829 C CA . THR A 1 58 ? -5.075 8.316 21.485 1.00 5.52 ? 57 THR B CA 1 +ATOM 830 C C . THR A 1 58 ? -5.268 6.848 21.802 1.00 6.30 ? 57 THR B C 1 +ATOM 831 O O . THR A 1 58 ? -5.070 6.415 22.950 1.00 6.45 ? 57 THR B O 1 +ATOM 832 C CB . THR A 1 58 ? -3.820 8.540 20.630 1.00 5.82 ? 57 THR B CB 1 +ATOM 833 O OG1 . THR A 1 58 ? -2.659 8.360 21.451 1.00 6.09 ? 57 THR B OG1 1 +ATOM 834 C CG2 . THR A 1 58 ? -3.814 9.943 20.056 1.00 6.26 ? 57 THR B CG2 1 +ATOM 835 H H . THR A 1 58 ? -4.492 8.687 23.321 1.00 6.33 ? 57 THR B H 1 +ATOM 836 H HA . THR A 1 58 ? -5.845 8.621 20.981 1.00 6.62 ? 57 THR B HA 1 +ATOM 837 H HB . THR A 1 58 ? -3.805 7.904 19.898 1.00 6.98 ? 57 THR B HB 1 +ATOM 838 H HG1 . THR A 1 58 ? -1.964 8.480 20.995 1.00 7.31 ? 57 THR B HG1 1 +ATOM 839 H HG21 . THR A 1 58 ? -3.018 10.077 19.517 1.00 7.51 ? 57 THR B HG21 1 +ATOM 840 H HG22 . THR A 1 58 ? -4.597 10.076 19.499 1.00 7.51 ? 57 THR B HG22 1 +ATOM 841 H HG23 . THR A 1 58 ? -3.822 10.595 20.773 1.00 7.51 ? 57 THR B HG23 1 +ATOM 842 N N . TYR A 1 59 ? -5.655 6.099 20.778 1.00 5.73 ? 58 TYR B N 1 +ATOM 843 C CA . TYR A 1 59 ? -6.079 4.718 20.929 1.00 5.86 ? 58 TYR B CA 1 +ATOM 844 C C . TYR A 1 59 ? -5.743 4.005 19.642 1.00 7.19 ? 58 TYR B C 1 +ATOM 845 O O . TYR A 1 59 ? -5.963 4.563 18.567 1.00 7.08 ? 58 TYR B O 1 +ATOM 846 C CB . TYR A 1 59 ? -7.593 4.644 21.165 1.00 7.86 ? 58 TYR B CB 1 +ATOM 847 C CG . TYR A 1 59 ? -8.101 5.601 22.219 1.00 6.96 ? 58 TYR B CG 1 +ATOM 848 C CD1 . TYR A 1 59 ? -8.257 5.200 23.534 1.00 8.97 ? 58 TYR B CD1 1 +ATOM 849 C CD2 . TYR A 1 59 ? -8.399 6.915 21.905 1.00 7.25 ? 58 TYR B CD2 1 +ATOM 850 C CE1 . TYR A 1 59 ? -8.711 6.076 24.496 1.00 8.36 ? 58 TYR B CE1 1 +ATOM 851 C CE2 . TYR A 1 59 ? -8.824 7.801 22.885 1.00 8.12 ? 58 TYR B CE2 1 +ATOM 852 C CZ . TYR A 1 59 ? -8.977 7.363 24.162 1.00 7.70 ? 58 TYR B CZ 1 +ATOM 853 O OH . TYR A 1 59 ? -9.439 8.243 25.121 1.00 10.09 ? 58 TYR B OH 1 +ATOM 854 H H . TYR A 1 59 ? -5.681 6.378 19.965 1.00 6.87 ? 58 TYR B H 1 +ATOM 855 H HA . TYR A 1 59 ? -5.613 4.295 21.667 1.00 7.03 ? 58 TYR B HA 1 +ATOM 856 H HB2 . TYR A 1 59 ? -8.049 4.851 20.334 1.00 9.44 ? 58 TYR B HB2 1 +ATOM 857 H HB3 . TYR A 1 59 ? -7.821 3.745 21.449 1.00 9.44 ? 58 TYR B HB3 1 +ATOM 858 H HD1 . TYR A 1 59 ? -8.068 4.320 23.770 1.00 10.77 ? 58 TYR B HD1 1 +ATOM 859 H HD2 . TYR A 1 59 ? -8.284 7.215 21.033 1.00 8.70 ? 58 TYR B HD2 1 +ATOM 860 H HE1 . TYR A 1 59 ? -8.813 5.791 25.375 1.00 10.04 ? 58 TYR B HE1 1 +ATOM 861 H HE2 . TYR A 1 59 ? -9.031 8.680 22.664 1.00 9.75 ? 58 TYR B HE2 1 +ATOM 862 H HH . TYR A 1 59 ? -9.509 7.852 25.861 1.00 12.10 ? 58 TYR B HH 1 +ATOM 863 N N . TYR A 1 60 ? -5.219 2.788 19.737 1.00 6.64 ? 59 TYR B N 1 +ATOM 864 C CA . TYR A 1 60 ? -4.746 2.061 18.562 1.00 7.86 ? 59 TYR B CA 1 +ATOM 865 C C . TYR A 1 60 ? -5.170 0.619 18.561 1.00 7.80 ? 59 TYR B C 1 +ATOM 866 O O . TYR A 1 60 ? -5.160 -0.044 19.596 1.00 9.81 ? 59 TYR B O 1 +ATOM 867 C CB . TYR A 1 60 ? -3.221 2.108 18.479 1.00 7.62 ? 59 TYR B CB 1 +ATOM 868 C CG . TYR A 1 60 ? -2.712 3.496 18.331 1.00 7.16 ? 59 TYR B CG 1 +ATOM 869 C CD1 . TYR A 1 60 ? -2.667 4.100 17.087 1.00 6.77 ? 59 TYR B CD1 1 +ATOM 870 C CD2 . TYR A 1 60 ? -2.300 4.242 19.431 1.00 6.70 ? 59 TYR B CD2 1 +ATOM 871 C CE1 . TYR A 1 60 ? -2.248 5.391 16.946 1.00 5.96 ? 59 TYR B CE1 1 +ATOM 872 C CE2 . TYR A 1 60 ? -1.859 5.533 19.290 1.00 6.69 ? 59 TYR B CE2 1 +ATOM 873 C CZ . TYR A 1 60 ? -1.819 6.103 18.039 1.00 6.98 ? 59 TYR B CZ 1 +ATOM 874 O OH . TYR A 1 60 ? -1.401 7.402 17.854 1.00 6.83 ? 59 TYR B OH 1 +ATOM 875 H H . TYR A 1 60 ? -5.125 2.358 20.476 1.00 7.97 ? 59 TYR B H 1 +ATOM 876 H HA . TYR A 1 60 ? -5.105 2.481 17.764 1.00 9.43 ? 59 TYR B HA 1 +ATOM 877 H HB2 . TYR A 1 60 ? -2.846 1.734 19.292 1.00 9.14 ? 59 TYR B HB2 1 +ATOM 878 H HB3 . TYR A 1 60 ? -2.927 1.595 17.710 1.00 9.14 ? 59 TYR B HB3 1 +ATOM 879 H HD1 . TYR A 1 60 ? -2.953 3.628 16.339 1.00 8.13 ? 59 TYR B HD1 1 +ATOM 880 H HD2 . TYR A 1 60 ? -2.324 3.858 20.277 1.00 8.03 ? 59 TYR B HD2 1 +ATOM 881 H HE1 . TYR A 1 60 ? -2.217 5.778 16.101 1.00 7.15 ? 59 TYR B HE1 1 +ATOM 882 H HE2 . TYR A 1 60 ? -1.583 6.018 20.034 1.00 8.02 ? 59 TYR B HE2 1 +ATOM 883 H HH . TYR A 1 60 ? -1.164 7.735 18.588 1.00 8.20 ? 59 TYR B HH 1 +ATOM 884 N N . ALA A 1 61 ? -5.491 0.110 17.379 1.00 7.80 ? 60 ALA B N 1 +ATOM 885 C CA . ALA A 1 61 ? -5.644 -1.326 17.188 1.00 8.28 ? 60 ALA B CA 1 +ATOM 886 C C . ALA A 1 61 ? -4.304 -2.036 17.328 1.00 9.22 ? 60 ALA B C 1 +ATOM 887 O O . ALA A 1 61 ? -3.270 -1.504 16.937 1.00 8.25 ? 60 ALA B O 1 +ATOM 888 C CB . ALA A 1 61 ? -6.239 -1.608 15.822 1.00 9.27 ? 60 ALA B CB 1 +ATOM 889 H H . ALA A 1 61 ? -5.626 0.576 16.668 1.00 9.36 ? 60 ALA B H 1 +ATOM 890 H HA . ALA A 1 61 ? -6.248 -1.677 17.861 1.00 9.93 ? 60 ALA B HA 1 +ATOM 891 H HB1 . ALA A 1 61 ? -6.334 -2.567 15.711 1.00 11.13 ? 60 ALA B HB1 1 +ATOM 892 H HB2 . ALA A 1 61 ? -7.107 -1.179 15.761 1.00 11.13 ? 60 ALA B HB2 1 +ATOM 893 H HB3 . ALA A 1 61 ? -5.646 -1.253 15.141 1.00 11.13 ? 60 ALA B HB3 1 +ATOM 894 N N . ASP A 1 62 ? -4.314 -3.254 17.860 1.00 9.50 ? 61 ASP B N 1 +ATOM 895 C CA . ASP A 1 62 ? -3.050 -3.974 18.046 1.00 11.34 ? 61 ASP B CA 1 +ATOM 896 C C . ASP A 1 62 ? -2.293 -4.172 16.735 1.00 10.81 ? 61 ASP B C 1 +ATOM 897 O O . ASP A 1 62 ? -1.080 -4.212 16.714 1.00 12.39 ? 61 ASP B O 1 +ATOM 898 C CB . ASP A 1 62 ? -3.263 -5.346 18.703 1.00 14.52 ? 61 ASP B CB 1 +ATOM 899 C CG . ASP A 1 62 ? -3.679 -5.256 20.159 1.00 22.74 ? 61 ASP B CG 1 +ATOM 900 O OD1 . ASP A 1 62 ? -3.444 -4.209 20.800 1.00 20.79 ? 61 ASP B OD1 1 +ATOM 901 O OD2 . ASP A 1 62 ? -4.235 -6.254 20.668 1.00 25.93 -1 61 ASP B OD2 1 +ATOM 902 H H . ASP A 1 62 ? -5.017 -3.679 18.116 1.00 11.39 ? 61 ASP B H 1 +ATOM 903 H HA . ASP A 1 62 ? -2.483 -3.452 18.636 1.00 13.61 ? 61 ASP B HA 1 +ATOM 904 H HB2 . ASP A 1 62 ? -3.961 -5.819 18.222 1.00 17.43 ? 61 ASP B HB2 1 +ATOM 905 H HB3 . ASP A 1 62 ? -2.434 -5.847 18.660 1.00 17.43 ? 61 ASP B HB3 1 +ATOM 906 N N . SER A 1 63 ? -3.032 -4.290 15.639 1.00 9.46 ? 62 SER B N 1 +ATOM 907 C CA . SER A 1 63 ? -2.452 -4.502 14.318 1.00 11.50 ? 62 SER B CA 1 +ATOM 908 C C . SER A 1 63 ? -1.548 -3.371 13.850 1.00 10.93 ? 62 SER B C 1 +ATOM 909 O O . SER A 1 63 ? -0.721 -3.577 12.958 1.00 11.91 ? 62 SER B O 1 +ATOM 910 C CB . SER A 1 63 ? -3.579 -4.656 13.294 1.00 12.54 ? 62 SER B CB 1 +ATOM 911 O OG . SER A 1 63 ? -4.464 -3.550 13.383 1.00 15.52 ? 62 SER B OG 1 +ATOM 912 H H . SER A 1 63 ? -3.891 -4.250 15.635 1.00 11.36 ? 62 SER B H 1 +ATOM 913 H HA . SER A 1 63 ? -1.934 -5.322 14.325 1.00 13.80 ? 62 SER B HA 1 +ATOM 914 H HB2 . SER A 1 63 ? -3.198 -4.688 12.403 1.00 15.05 ? 62 SER B HB2 1 +ATOM 915 H HB3 . SER A 1 63 ? -4.069 -5.472 13.479 1.00 15.05 ? 62 SER B HB3 1 +ATOM 916 H HG . SER A 1 63 ? -5.084 -3.632 12.822 1.00 18.62 ? 62 SER B HG 1 +ATOM 917 N N . VAL A 1 64 ? -1.722 -2.177 14.409 1.00 9.23 ? 63 VAL B N 1 +ATOM 918 C CA . VAL A 1 64 ? -0.998 -1.008 13.925 1.00 8.59 ? 63 VAL B CA 1 +ATOM 919 C C . VAL A 1 64 ? -0.218 -0.304 15.022 1.00 9.22 ? 63 VAL B C 1 +ATOM 920 O O . VAL A 1 64 ? 0.476 0.696 14.771 1.00 9.45 ? 63 VAL B O 1 +ATOM 921 C CB . VAL A 1 64 ? -1.921 0.011 13.206 1.00 8.89 ? 63 VAL B CB 1 +ATOM 922 C CG1 . VAL A 1 64 ? -2.676 -0.674 12.072 1.00 10.51 ? 63 VAL B CG1 1 +ATOM 923 C CG2 . VAL A 1 64 ? -2.877 0.685 14.175 1.00 9.44 ? 63 VAL B CG2 1 +ATOM 924 H H . VAL A 1 64 ? -2.251 -2.018 15.068 1.00 11.08 ? 63 VAL B H 1 +ATOM 925 H HA . VAL A 1 64 ? -0.350 -1.311 13.270 1.00 10.31 ? 63 VAL B HA 1 +ATOM 926 H HB . VAL A 1 64 ? -1.367 0.703 12.812 1.00 10.67 ? 63 VAL B HB 1 +ATOM 927 H HG11 . VAL A 1 64 ? -3.247 -0.023 11.635 1.00 12.62 ? 63 VAL B HG11 1 +ATOM 928 H HG12 . VAL A 1 64 ? -2.035 -1.032 11.438 1.00 12.62 ? 63 VAL B HG12 1 +ATOM 929 H HG13 . VAL A 1 64 ? -3.214 -1.392 12.440 1.00 12.62 ? 63 VAL B HG13 1 +ATOM 930 H HG21 . VAL A 1 64 ? -3.433 1.311 13.685 1.00 11.33 ? 63 VAL B HG21 1 +ATOM 931 H HG22 . VAL A 1 64 ? -3.431 0.007 14.593 1.00 11.33 ? 63 VAL B HG22 1 +ATOM 932 H HG23 . VAL A 1 64 ? -2.363 1.156 14.849 1.00 11.33 ? 63 VAL B HG23 1 +ATOM 933 N N . LYS A 1 65 ? -0.318 -0.836 16.234 1.00 10.04 ? 64 LYS B N 1 +ATOM 934 C CA . LYS A 1 65 ? 0.400 -0.269 17.368 1.00 11.93 ? 64 LYS B CA 1 +ATOM 935 C C . LYS A 1 65 ? 1.858 -0.062 17.044 1.00 11.11 ? 64 LYS B C 1 +ATOM 936 O O . LYS A 1 65 ? 2.508 -0.946 16.489 1.00 12.49 ? 64 LYS B O 1 +ATOM 937 C CB . LYS A 1 65 ? 0.297 -1.190 18.583 1.00 13.44 ? 64 LYS B CB 1 +ATOM 938 C CG . LYS A 1 65 ? -0.891 -0.898 19.442 1.00 21.47 ? 64 LYS B CG 1 +ATOM 939 C CD . LYS A 1 65 ? -0.737 -1.538 20.806 1.00 24.47 ? 64 LYS B CD 1 +ATOM 940 C CE . LYS A 1 65 ? -1.963 -1.292 21.649 1.00 30.33 ? 64 LYS B CE 1 +ATOM 941 N NZ . LYS A 1 65 ? -3.167 -1.473 20.813 1.00 20.62 1 64 LYS B NZ 1 +ATOM 942 H H . LYS A 1 65 ? -0.794 -1.525 16.426 1.00 12.04 ? 64 LYS B H 1 +ATOM 943 H HA . LYS A 1 65 ? 0.012 0.589 17.600 1.00 14.31 ? 64 LYS B HA 1 +ATOM 944 H HB2 . LYS A 1 65 ? 0.227 -2.108 18.277 1.00 16.13 ? 64 LYS B HB2 1 +ATOM 945 H HB3 . LYS A 1 65 ? 1.093 -1.083 19.128 1.00 16.13 ? 64 LYS B HB3 1 +ATOM 946 H HG2 . LYS A 1 65 ? -0.976 0.061 19.561 1.00 25.77 ? 64 LYS B HG2 1 +ATOM 947 H HG3 . LYS A 1 65 ? -1.688 -1.259 19.023 1.00 25.77 ? 64 LYS B HG3 1 +ATOM 948 H HD2 . LYS A 1 65 ? -0.622 -2.496 20.703 1.00 29.37 ? 64 LYS B HD2 1 +ATOM 949 H HD3 . LYS A 1 65 ? 0.029 -1.153 21.259 1.00 29.37 ? 64 LYS B HD3 1 +ATOM 950 H HE2 . LYS A 1 65 ? -1.992 -1.930 22.379 1.00 36.40 ? 64 LYS B HE2 1 +ATOM 951 H HE3 . LYS A 1 65 ? -1.952 -0.383 21.986 1.00 36.40 ? 64 LYS B HE3 1 +ATOM 952 H HZ1 . LYS A 1 65 ? -3.192 -2.302 20.490 1.00 24.75 ? 64 LYS B HZ1 1 +ATOM 953 H HZ2 . LYS A 1 65 ? -3.899 -1.330 21.299 1.00 24.75 ? 64 LYS B HZ2 1 +ATOM 954 H HZ3 . LYS A 1 65 ? -3.155 -0.898 20.133 1.00 24.75 ? 64 LYS B HZ3 1 +ATOM 955 N N . GLY A 1 66 ? 2.358 1.115 17.386 1.00 10.80 ? 65 GLY B N 1 +ATOM 956 C CA . GLY A 1 66 ? 3.763 1.422 17.197 1.00 11.76 ? 65 GLY B CA 1 +ATOM 957 C C . GLY A 1 66 ? 4.086 2.006 15.835 1.00 10.21 ? 65 GLY B C 1 +ATOM 958 O O . GLY A 1 66 ? 4.909 2.908 15.730 1.00 13.32 ? 65 GLY B O 1 +ATOM 959 H H . GLY A 1 66 ? 1.901 1.756 17.732 1.00 12.96 ? 65 GLY B H 1 +ATOM 960 H HA2 . GLY A 1 66 ? 4.044 2.058 17.873 1.00 14.12 ? 65 GLY B HA2 1 +ATOM 961 H HA3 . GLY A 1 66 ? 4.284 0.611 17.309 1.00 14.12 ? 65 GLY B HA3 1 +ATOM 962 N N . ARG A 1 67 ? 3.425 1.500 14.795 1.00 8.45 ? 66 ARG B N 1 +ATOM 963 C CA . ARG A 1 67 ? 3.704 1.899 13.419 1.00 8.59 ? 66 ARG B CA 1 +ATOM 964 C C . ARG A 1 67 ? 2.902 3.111 12.967 1.00 7.41 ? 66 ARG B C 1 +ATOM 965 O O . ARG A 1 67 ? 3.370 3.895 12.154 1.00 7.78 ? 66 ARG B O 1 +ATOM 966 C CB . ARG A 1 67 ? 3.411 0.731 12.484 1.00 10.21 ? 66 ARG B CB 1 +ATOM 967 C CG . ARG A 1 67 ? 4.276 -0.492 12.746 1.00 9.60 ? 66 ARG B CG 1 +ATOM 968 C CD . ARG A 1 67 ? 4.076 -1.585 11.707 1.00 11.57 ? 66 ARG B CD 1 +ATOM 969 N NE . ARG A 1 67 ? 2.684 -2.032 11.629 1.00 10.55 ? 66 ARG B NE 1 +ATOM 970 C CZ . ARG A 1 67 ? 1.903 -1.982 10.549 1.00 9.96 ? 66 ARG B CZ 1 +ATOM 971 N NH1 . ARG A 1 67 ? 2.342 -1.495 9.402 1.00 10.07 1 66 ARG B NH1 1 +ATOM 972 N NH2 . ARG A 1 67 ? 0.665 -2.430 10.629 1.00 9.96 ? 66 ARG B NH2 1 +ATOM 973 H H . ARG A 1 67 ? 2.799 0.913 14.863 1.00 10.14 ? 66 ARG B H 1 +ATOM 974 H HA . ARG A 1 67 ? 4.645 2.118 13.340 1.00 10.31 ? 66 ARG B HA 1 +ATOM 975 H HB2 . ARG A 1 67 ? 2.484 0.468 12.592 1.00 12.26 ? 66 ARG B HB2 1 +ATOM 976 H HB3 . ARG A 1 67 ? 3.568 1.015 11.570 1.00 12.26 ? 66 ARG B HB3 1 +ATOM 977 H HG2 . ARG A 1 67 ? 5.210 -0.229 12.729 1.00 11.52 ? 66 ARG B HG2 1 +ATOM 978 H HG3 . ARG A 1 67 ? 4.050 -0.859 13.615 1.00 11.52 ? 66 ARG B HG3 1 +ATOM 979 H HD2 . ARG A 1 67 ? 4.331 -1.244 10.835 1.00 13.88 ? 66 ARG B HD2 1 +ATOM 980 H HD3 . ARG A 1 67 ? 4.625 -2.349 11.940 1.00 13.88 ? 66 ARG B HD3 1 +ATOM 981 H HE . ARG A 1 67 ? 2.338 -2.358 12.346 1.00 12.66 ? 66 ARG B HE 1 +ATOM 982 H HH11 . ARG A 1 67 ? 3.148 -1.202 9.340 1.00 12.08 ? 66 ARG B HH11 1 +ATOM 983 H HH12 . ARG A 1 67 ? 1.822 -1.471 8.718 1.00 12.08 ? 66 ARG B HH12 1 +ATOM 984 H HH21 . ARG A 1 67 ? 0.370 -2.748 11.372 1.00 11.96 ? 66 ARG B HH21 1 +ATOM 985 H HH22 . ARG A 1 67 ? 0.152 -2.400 9.940 1.00 11.96 ? 66 ARG B HH22 1 +ATOM 986 N N . PHE A 1 68 ? 1.674 3.215 13.454 1.00 8.37 ? 67 PHE B N 1 +ATOM 987 C CA . PHE A 1 68 ? 0.754 4.276 13.048 1.00 7.13 ? 67 PHE B CA 1 +ATOM 988 C C . PHE A 1 68 ? 0.544 5.224 14.225 1.00 7.49 ? 67 PHE B C 1 +ATOM 989 O O . PHE A 1 68 ? 0.445 4.767 15.376 1.00 9.44 ? 67 PHE B O 1 +ATOM 990 C CB . PHE A 1 68 ? -0.623 3.734 12.658 1.00 7.70 ? 67 PHE B CB 1 +ATOM 991 C CG . PHE A 1 68 ? -0.683 2.934 11.387 1.00 8.52 ? 67 PHE B CG 1 +ATOM 992 C CD1 . PHE A 1 68 ? 0.433 2.468 10.727 1.00 8.67 ? 67 PHE B CD1 1 +ATOM 993 C CD2 . PHE A 1 68 ? -1.929 2.644 10.855 1.00 8.91 ? 67 PHE B CD2 1 +ATOM 994 C CE1 . PHE A 1 68 ? 0.304 1.711 9.574 1.00 9.66 ? 67 PHE B CE1 1 +ATOM 995 C CE2 . PHE A 1 68 ? -2.063 1.906 9.707 1.00 10.35 ? 67 PHE B CE2 1 +ATOM 996 C CZ . PHE A 1 68 ? -0.955 1.433 9.068 1.00 10.11 ? 67 PHE B CZ 1 +ATOM 997 H H . PHE A 1 68 ? 1.340 2.673 14.033 1.00 10.05 ? 67 PHE B H 1 +ATOM 998 H HA . PHE A 1 68 ? 1.125 4.773 12.302 1.00 8.55 ? 67 PHE B HA 1 +ATOM 999 H HB2 . PHE A 1 68 ? -0.939 3.161 13.374 1.00 9.24 ? 67 PHE B HB2 1 +ATOM 1000 H HB3 . PHE A 1 68 ? -1.228 4.485 12.555 1.00 9.24 ? 67 PHE B HB3 1 +ATOM 1001 H HD1 . PHE A 1 68 ? 1.279 2.642 11.072 1.00 10.40 ? 67 PHE B HD1 1 +ATOM 1002 H HD2 . PHE A 1 68 ? -2.692 2.952 11.289 1.00 10.69 ? 67 PHE B HD2 1 +ATOM 1003 H HE1 . PHE A 1 68 ? 1.062 1.399 9.135 1.00 11.59 ? 67 PHE B HE1 1 +ATOM 1004 H HE2 . PHE A 1 68 ? -2.910 1.721 9.370 1.00 12.41 ? 67 PHE B HE2 1 +ATOM 1005 H HZ . PHE A 1 68 ? -1.044 0.939 8.286 1.00 12.13 ? 67 PHE B HZ 1 +ATOM 1006 N N . THR A 1 69 ? 0.446 6.522 13.943 1.00 6.60 ? 68 THR B N 1 +ATOM 1007 C CA . THR A 1 69 ? 0.200 7.527 14.959 1.00 7.60 ? 68 THR B CA 1 +ATOM 1008 C C . THR A 1 69 ? -0.868 8.463 14.452 1.00 6.26 ? 68 THR B C 1 +ATOM 1009 O O . THR A 1 69 ? -0.778 8.956 13.321 1.00 7.07 ? 68 THR B O 1 +ATOM 1010 C CB . THR A 1 69 ? 1.485 8.312 15.287 1.00 7.88 ? 68 THR B CB 1 +ATOM 1011 O OG1 . THR A 1 69 ? 2.498 7.396 15.715 1.00 10.33 ? 68 THR B OG1 1 +ATOM 1012 C CG2 . THR A 1 69 ? 1.265 9.326 16.402 1.00 10.35 ? 68 THR B CG2 1 +ATOM 1013 H H . THR A 1 69 ? 0.521 6.847 13.150 1.00 7.92 ? 68 THR B H 1 +ATOM 1014 H HA . THR A 1 69 ? -0.119 7.101 15.770 1.00 9.12 ? 68 THR B HA 1 +ATOM 1015 H HB . THR A 1 69 ? 1.788 8.784 14.496 1.00 9.46 ? 68 THR B HB 1 +ATOM 1016 H HG1 . THR A 1 69 ? 3.204 7.814 15.897 1.00 12.39 ? 68 THR B HG1 1 +ATOM 1017 H HG21 . THR A 1 69 ? 2.090 9.803 16.585 1.00 12.42 ? 68 THR B HG21 1 +ATOM 1018 H HG22 . THR A 1 69 ? 0.584 9.965 16.139 1.00 12.42 ? 68 THR B HG22 1 +ATOM 1019 H HG23 . THR A 1 69 ? 0.977 8.873 17.210 1.00 12.42 ? 68 THR B HG23 1 +ATOM 1020 N N . ILE A 1 70 ? -1.855 8.720 15.292 1.00 6.73 ? 69 ILE B N 1 +ATOM 1021 C CA . ILE A 1 70 ? -2.942 9.632 14.975 1.00 6.34 ? 69 ILE B CA 1 +ATOM 1022 C C . ILE A 1 70 ? -2.716 10.940 15.729 1.00 6.65 ? 69 ILE B C 1 +ATOM 1023 O O . ILE A 1 70 ? -2.211 10.941 16.864 1.00 7.32 ? 69 ILE B O 1 +ATOM 1024 C CB . ILE A 1 70 ? -4.311 8.985 15.308 1.00 5.99 ? 69 ILE B CB 1 +ATOM 1025 C CG1 . ILE A 1 70 ? -5.459 9.833 14.767 1.00 6.16 ? 69 ILE B CG1 1 +ATOM 1026 C CG2 . ILE A 1 70 ? -4.436 8.683 16.796 1.00 6.25 ? 69 ILE B CG2 1 +ATOM 1027 C CD1 . ILE A 1 70 ? -6.811 9.159 14.963 1.00 7.27 ? 69 ILE B CD1 1 +ATOM 1028 H H . ILE A 1 70 ? -1.920 8.370 16.074 1.00 8.08 ? 69 ILE B H 1 +ATOM 1029 H HA . ILE A 1 70 ? -2.925 9.826 14.024 1.00 7.61 ? 69 ILE B HA 1 +ATOM 1030 H HB . ILE A 1 70 ? -4.344 8.135 14.843 1.00 7.19 ? 69 ILE B HB 1 +ATOM 1031 H HG12 . ILE A 1 70 ? -5.474 10.683 15.234 1.00 7.40 ? 69 ILE B HG12 1 +ATOM 1032 H HG13 . ILE A 1 70 ? -5.327 9.976 13.816 1.00 7.40 ? 69 ILE B HG13 1 +ATOM 1033 H HG21 . ILE A 1 70 ? -5.302 8.281 16.964 1.00 7.50 ? 69 ILE B HG21 1 +ATOM 1034 H HG22 . ILE A 1 70 ? -3.730 8.069 17.053 1.00 7.50 ? 69 ILE B HG22 1 +ATOM 1035 H HG23 . ILE A 1 70 ? -4.352 9.511 17.294 1.00 7.50 ? 69 ILE B HG23 1 +ATOM 1036 H HD11 . ILE A 1 70 ? -7.505 9.734 14.604 1.00 8.72 ? 69 ILE B HD11 1 +ATOM 1037 H HD12 . ILE A 1 70 ? -6.810 8.309 14.495 1.00 8.72 ? 69 ILE B HD12 1 +ATOM 1038 H HD13 . ILE A 1 70 ? -6.957 9.015 15.911 1.00 8.72 ? 69 ILE B HD13 1 +ATOM 1039 N N . SER A 1 71 ? -3.059 12.043 15.087 1.00 6.06 ? 70 SER B N 1 +ATOM 1040 C CA . SER A 1 71 ? -2.927 13.370 15.655 1.00 6.79 ? 70 SER B CA 1 +ATOM 1041 C C . SER A 1 71 ? -4.031 14.254 15.094 1.00 6.82 ? 70 SER B C 1 +ATOM 1042 O O . SER A 1 71 ? -4.703 13.876 14.135 1.00 6.98 ? 70 SER B O 1 +ATOM 1043 C CB . SER A 1 71 ? -1.556 13.956 15.346 1.00 7.85 ? 70 SER B CB 1 +ATOM 1044 O OG . SER A 1 71 ? -1.319 14.001 13.955 1.00 8.75 ? 70 SER B OG 1 +ATOM 1045 H H . SER A 1 71 ? -3.383 12.047 14.290 1.00 7.27 ? 70 SER B H 1 +ATOM 1046 H HA . SER A 1 71 ? -3.030 13.321 16.618 1.00 8.15 ? 70 SER B HA 1 +ATOM 1047 H HB2 . SER A 1 71 ? -1.511 14.857 15.701 1.00 9.42 ? 70 SER B HB2 1 +ATOM 1048 H HB3 . SER A 1 71 ? -0.876 13.402 15.762 1.00 9.42 ? 70 SER B HB3 1 +ATOM 1049 H HG . SER A 1 71 ? -0.559 14.326 13.803 1.00 10.50 ? 70 SER B HG 1 +ATOM 1050 N N . ARG A 1 72 ? -4.244 15.421 15.692 1.00 7.35 ? 71 ARG B N 1 +ATOM 1051 C CA . ARG A 1 72 ? -5.274 16.310 15.173 1.00 6.92 ? 71 ARG B CA 1 +ATOM 1052 C C . ARG A 1 72 ? -4.845 17.748 15.400 1.00 8.53 ? 71 ARG B C 1 +ATOM 1053 O O . ARG A 1 72 ? -4.041 18.059 16.280 1.00 8.44 ? 71 ARG B O 1 +ATOM 1054 C CB . ARG A 1 72 ? -6.682 16.022 15.753 1.00 8.72 ? 71 ARG B CB 1 +ATOM 1055 C CG . ARG A 1 72 ? -6.862 16.451 17.180 1.00 9.29 ? 71 ARG B CG 1 +ATOM 1056 C CD . ARG A 1 72 ? -8.130 15.891 17.814 1.00 7.58 ? 71 ARG B CD 1 +ATOM 1057 N NE . ARG A 1 72 ? -9.359 16.587 17.434 1.00 7.38 ? 71 ARG B NE 1 +ATOM 1058 C CZ . ARG A 1 72 ? -10.581 16.067 17.581 1.00 6.07 ? 71 ARG B CZ 1 +ATOM 1059 N NH1 . ARG A 1 72 ? -10.743 14.846 18.044 1.00 6.20 1 71 ARG B NH1 1 +ATOM 1060 N NH2 . ARG A 1 72 ? -11.651 16.761 17.237 1.00 7.30 ? 71 ARG B NH2 1 +ATOM 1061 H H . ARG A 1 72 ? -3.820 15.715 16.380 1.00 8.82 ? 71 ARG B H 1 +ATOM 1062 H HA . ARG A 1 72 ? -5.330 16.177 14.214 1.00 8.30 ? 71 ARG B HA 1 +ATOM 1063 H HB2 . ARG A 1 72 ? -7.340 16.493 15.219 1.00 10.46 ? 71 ARG B HB2 1 +ATOM 1064 H HB3 . ARG A 1 72 ? -6.847 15.068 15.710 1.00 10.46 ? 71 ARG B HB3 1 +ATOM 1065 H HG2 . ARG A 1 72 ? -6.105 16.141 17.700 1.00 11.15 ? 71 ARG B HG2 1 +ATOM 1066 H HG3 . ARG A 1 72 ? -6.913 17.419 17.214 1.00 11.15 ? 71 ARG B HG3 1 +ATOM 1067 H HD2 . ARG A 1 72 ? -8.225 14.963 17.549 1.00 9.09 ? 71 ARG B HD2 1 +ATOM 1068 H HD3 . ARG A 1 72 ? -8.046 15.948 18.778 1.00 9.09 ? 71 ARG B HD3 1 +ATOM 1069 H HE . ARG A 1 72 ? -9.298 17.412 17.198 1.00 8.86 ? 71 ARG B HE 1 +ATOM 1070 H HH11 . ARG A 1 72 ? -10.058 14.381 18.278 1.00 7.44 ? 71 ARG B HH11 1 +ATOM 1071 H HH12 . ARG A 1 72 ? -11.534 14.519 18.128 1.00 7.44 ? 71 ARG B HH12 1 +ATOM 1072 H HH21 . ARG A 1 72 ? -11.565 17.556 16.922 1.00 8.77 ? 71 ARG B HH21 1 +ATOM 1073 H HH22 . ARG A 1 72 ? -12.433 16.413 17.319 1.00 8.77 ? 71 ARG B HH22 1 +ATOM 1074 N N . ASP A 1 73 ? -5.391 18.623 14.578 1.00 8.36 ? 72 ASP B N 1 +ATOM 1075 C CA . ASP A 1 73 ? -5.173 20.052 14.711 1.00 9.16 ? 72 ASP B CA 1 +ATOM 1076 C C . ASP A 1 73 ? -6.536 20.707 14.749 1.00 9.18 ? 72 ASP B C 1 +ATOM 1077 O O . ASP A 1 73 ? -7.196 20.829 13.727 1.00 9.61 ? 72 ASP B O 1 +ATOM 1078 C CB . ASP A 1 73 ? -4.361 20.560 13.524 1.00 12.44 ? 72 ASP B CB 1 +ATOM 1079 C CG . ASP A 1 73 ? -3.965 22.015 13.650 1.00 14.86 ? 72 ASP B CG 1 +ATOM 1080 O OD1 . ASP A 1 73 ? -4.621 22.763 14.397 1.00 15.06 ? 72 ASP B OD1 1 +ATOM 1081 O OD2 . ASP A 1 73 ? -2.977 22.408 12.980 1.00 20.02 -1 72 ASP B OD2 1 +ATOM 1082 H H . ASP A 1 73 ? -5.903 18.410 13.920 1.00 10.03 ? 72 ASP B H 1 +ATOM 1083 H HA . ASP A 1 73 ? -4.699 20.247 15.534 1.00 10.99 ? 72 ASP B HA 1 +ATOM 1084 H HB2 . ASP A 1 73 ? -3.549 20.035 13.451 1.00 14.93 ? 72 ASP B HB2 1 +ATOM 1085 H HB3 . ASP A 1 73 ? -4.890 20.464 12.717 1.00 14.93 ? 72 ASP B HB3 1 +ATOM 1086 N N . ASN A 1 74 ? -6.972 21.116 15.925 1.00 10.44 ? 73 ASN B N 1 +ATOM 1087 C CA . ASN A 1 74 ? -8.329 21.604 16.053 1.00 12.21 ? 73 ASN B CA 1 +ATOM 1088 C C . ASN A 1 74 ? -8.514 22.950 15.375 1.00 14.60 ? 73 ASN B C 1 +ATOM 1089 O O . ASN A 1 74 ? -9.626 23.292 14.980 1.00 20.68 ? 73 ASN B O 1 +ATOM 1090 C CB . ASN A 1 74 ? -8.781 21.650 17.512 1.00 13.98 ? 73 ASN B CB 1 +ATOM 1091 C CG . ASN A 1 74 ? -9.078 20.268 18.063 1.00 11.35 ? 73 ASN B CG 1 +ATOM 1092 O OD1 . ASN A 1 74 ? -9.140 19.305 17.318 1.00 11.82 ? 73 ASN B OD1 1 +ATOM 1093 N ND2 . ASN A 1 74 ? -9.309 20.181 19.363 1.00 13.70 ? 73 ASN B ND2 1 +ATOM 1094 H H . ASN A 1 74 ? -6.512 21.123 16.652 1.00 12.53 ? 73 ASN B H 1 +ATOM 1095 H HA . ASN A 1 74 ? -8.914 20.978 15.598 1.00 14.65 ? 73 ASN B HA 1 +ATOM 1096 H HB2 . ASN A 1 74 ? -8.077 22.044 18.050 1.00 16.77 ? 73 ASN B HB2 1 +ATOM 1097 H HB3 . ASN A 1 74 ? -9.589 22.181 17.578 1.00 16.77 ? 73 ASN B HB3 1 +ATOM 1098 H HD21 . ASN A 1 74 ? -9.481 19.418 19.720 1.00 16.44 ? 73 ASN B HD21 1 +ATOM 1099 H HD22 . ASN A 1 74 ? -9.286 20.888 19.852 1.00 16.44 ? 73 ASN B HD22 1 +ATOM 1100 N N . ALA A 1 75 ? -7.422 23.692 15.208 1.00 12.04 ? 74 ALA B N 1 +ATOM 1101 C CA . ALA A 1 75 ? -7.473 24.958 14.489 1.00 13.47 ? 74 ALA B CA 1 +ATOM 1102 C C . ALA A 1 75 ? -7.739 24.764 13.004 1.00 12.64 ? 74 ALA B C 1 +ATOM 1103 O O . ALA A 1 75 ? -8.188 25.693 12.340 1.00 18.42 ? 74 ALA B O 1 +ATOM 1104 C CB . ALA A 1 75 ? -6.178 25.746 14.696 1.00 16.66 ? 74 ALA B CB 1 +ATOM 1105 H H . ALA A 1 75 ? -6.641 23.483 15.502 1.00 14.45 ? 74 ALA B H 1 +ATOM 1106 H HA . ALA A 1 75 ? -8.201 25.489 14.850 1.00 16.16 ? 74 ALA B HA 1 +ATOM 1107 H HB1 . ALA A 1 75 ? -6.237 26.583 14.209 1.00 19.99 ? 74 ALA B HB1 1 +ATOM 1108 H HB2 . ALA A 1 75 ? -6.064 25.922 15.643 1.00 19.99 ? 74 ALA B HB2 1 +ATOM 1109 H HB3 . ALA A 1 75 ? -5.433 25.221 14.364 1.00 19.99 ? 74 ALA B HB3 1 +ATOM 1110 N N . LYS A 1 76 ? -7.473 23.569 12.485 1.00 11.96 ? 75 LYS B N 1 +ATOM 1111 C CA . LYS A 1 76 ? -7.613 23.282 11.063 1.00 11.26 ? 75 LYS B CA 1 +ATOM 1112 C C . LYS A 1 76 ? -8.719 22.273 10.766 1.00 10.85 ? 75 LYS B C 1 +ATOM 1113 O O . LYS A 1 76 ? -8.874 21.846 9.627 1.00 11.10 ? 75 LYS B O 1 +ATOM 1114 C CB . LYS A 1 76 ? -6.308 22.716 10.491 1.00 13.42 ? 75 LYS B CB 1 +ATOM 1115 C CG . LYS A 1 76 ? -5.114 23.658 10.540 1.00 18.41 ? 75 LYS B CG 1 +ATOM 1116 C CD . LYS A 1 76 ? -3.972 23.083 9.707 1.00 22.88 ? 75 LYS B CD 1 +ATOM 1117 C CE . LYS A 1 76 ? -2.657 23.815 9.919 1.00 33.99 ? 75 LYS B CE 1 +ATOM 1118 N NZ . LYS A 1 76 ? -2.742 25.254 9.558 1.00 42.40 1 75 LYS B NZ 1 +ATOM 1119 H H . LYS A 1 76 ? -7.205 22.895 12.947 1.00 14.35 ? 75 LYS B H 1 +ATOM 1120 H HA . LYS A 1 76 ? -7.819 24.104 10.591 1.00 13.51 ? 75 LYS B HA 1 +ATOM 1121 H HB2 . LYS A 1 76 ? -6.072 21.920 10.992 1.00 16.11 ? 75 LYS B HB2 1 +ATOM 1122 H HB3 . LYS A 1 76 ? -6.456 22.482 9.561 1.00 16.11 ? 75 LYS B HB3 1 +ATOM 1123 H HG2 . LYS A 1 76 ? -5.362 24.520 10.171 1.00 22.09 ? 75 LYS B HG2 1 +ATOM 1124 H HG3 . LYS A 1 76 ? -4.811 23.752 11.456 1.00 22.09 ? 75 LYS B HG3 1 +ATOM 1125 H HD2 . LYS A 1 76 ? -3.841 22.153 9.951 1.00 27.45 ? 75 LYS B HD2 1 +ATOM 1126 H HD3 . LYS A 1 76 ? -4.204 23.149 8.767 1.00 27.45 ? 75 LYS B HD3 1 +ATOM 1127 H HE2 . LYS A 1 76 ? -2.407 23.753 10.854 1.00 40.79 ? 75 LYS B HE2 1 +ATOM 1128 H HE3 . LYS A 1 76 ? -1.973 23.405 9.365 1.00 40.79 ? 75 LYS B HE3 1 +ATOM 1129 H HZ1 . LYS A 1 76 ? -1.956 25.649 9.695 1.00 50.88 ? 75 LYS B HZ1 1 +ATOM 1130 H HZ2 . LYS A 1 76 ? -2.963 25.340 8.700 1.00 50.88 ? 75 LYS B HZ2 1 +ATOM 1131 H HZ3 . LYS A 1 76 ? -3.358 25.657 10.058 1.00 50.88 ? 75 LYS B HZ3 1 +ATOM 1132 N N . ASN A 1 77 ? -9.454 21.838 11.788 1.00 8.76 ? 76 ASN B N 1 +ATOM 1133 C CA . ASN A 1 77 ? -10.518 20.856 11.605 1.00 9.23 ? 76 ASN B CA 1 +ATOM 1134 C C . ASN A 1 77 ? -9.975 19.590 10.931 1.00 7.61 ? 76 ASN B C 1 +ATOM 1135 O O . ASN A 1 77 ? -10.662 18.958 10.134 1.00 9.77 ? 76 ASN B O 1 +ATOM 1136 C CB . ASN A 1 77 ? -11.677 21.431 10.772 1.00 9.53 ? 76 ASN B CB 1 +ATOM 1137 C CG . ASN A 1 77 ? -12.704 22.165 11.599 1.00 10.98 ? 76 ASN B CG 1 +ATOM 1138 O OD1 . ASN A 1 77 ? -12.410 22.714 12.653 1.00 11.08 ? 76 ASN B OD1 1 +ATOM 1139 N ND2 . ASN A 1 77 ? -13.935 22.181 11.109 1.00 12.74 ? 76 ASN B ND2 1 +ATOM 1140 H H . ASN A 1 77 ? -9.356 22.099 12.602 1.00 10.51 ? 76 ASN B H 1 +ATOM 1141 H HA . ASN A 1 77 ? -10.869 20.605 12.474 1.00 11.08 ? 76 ASN B HA 1 +ATOM 1142 H HB2 . ASN A 1 77 ? -11.318 22.055 10.122 1.00 11.44 ? 76 ASN B HB2 1 +ATOM 1143 H HB3 . ASN A 1 77 ? -12.128 20.703 10.317 1.00 11.44 ? 76 ASN B HB3 1 +ATOM 1144 H HD21 . ASN A 1 77 ? -14.563 22.585 11.537 1.00 15.29 ? 76 ASN B HD21 1 +ATOM 1145 H HD22 . ASN A 1 77 ? -14.106 21.788 10.364 1.00 15.29 ? 76 ASN B HD22 1 +ATOM 1146 N N . THR A 1 78 ? -8.756 19.196 11.288 1.00 8.02 ? 77 THR B N 1 +ATOM 1147 C CA . THR A 1 78 ? -8.087 18.085 10.612 1.00 9.05 ? 77 THR B CA 1 +ATOM 1148 C C . THR A 1 78 ? -7.540 17.047 11.562 1.00 8.33 ? 77 THR B C 1 +ATOM 1149 O O . THR A 1 78 ? -7.033 17.356 12.639 1.00 8.67 ? 77 THR B O 1 +ATOM 1150 C CB . THR A 1 78 ? -6.957 18.605 9.704 1.00 8.76 ? 77 THR B CB 1 +ATOM 1151 O OG1 . THR A 1 78 ? -7.513 19.493 8.727 1.00 12.25 ? 77 THR B OG1 1 +ATOM 1152 C CG2 . THR A 1 78 ? -6.261 17.481 8.961 1.00 12.88 ? 77 THR B CG2 1 +ATOM 1153 H H . THR A 1 78 ? -8.294 19.553 11.919 1.00 9.63 ? 77 THR B H 1 +ATOM 1154 H HA . THR A 1 78 ? -8.735 17.642 10.042 1.00 10.86 ? 77 THR B HA 1 +ATOM 1155 H HB . THR A 1 78 ? -6.300 19.079 10.238 1.00 10.51 ? 77 THR B HB 1 +ATOM 1156 H HG1 . THR A 1 78 ? -7.886 20.142 9.107 1.00 14.70 ? 77 THR B HG1 1 +ATOM 1157 H HG21 . THR A 1 78 ? -5.556 17.841 8.399 1.00 15.46 ? 77 THR B HG21 1 +ATOM 1158 H HG22 . THR A 1 78 ? -5.872 16.857 9.593 1.00 15.46 ? 77 THR B HG22 1 +ATOM 1159 H HG23 . THR A 1 78 ? -6.898 17.008 8.403 1.00 15.46 ? 77 THR B HG23 1 +ATOM 1160 N N . VAL A 1 79 ? -7.666 15.796 11.142 1.00 7.62 ? 78 VAL B N 1 +ATOM 1161 C CA . VAL A 1 79 ? -7.018 14.678 11.814 1.00 8.25 ? 78 VAL B CA 1 +ATOM 1162 C C . VAL A 1 79 ? -6.044 14.020 10.842 1.00 7.70 ? 78 VAL B C 1 +ATOM 1163 O O . VAL A 1 79 ? -6.291 14.014 9.627 1.00 9.67 ? 78 VAL B O 1 +ATOM 1164 C CB . VAL A 1 79 ? -8.093 13.678 12.364 1.00 12.61 ? 78 VAL B CB 1 +ATOM 1165 C CG1 . VAL A 1 79 ? -9.002 13.152 11.303 1.00 18.18 ? 78 VAL B CG1 1 +ATOM 1166 C CG2 . VAL A 1 79 ? -7.476 12.524 13.123 1.00 11.84 ? 78 VAL B CG2 1 +ATOM 1167 H H . VAL A 1 79 ? -8.130 15.564 10.456 1.00 9.14 ? 78 VAL B H 1 +ATOM 1168 H HA . VAL A 1 79 ? -6.508 15.014 12.568 1.00 9.90 ? 78 VAL B HA 1 +ATOM 1169 H HB . VAL A 1 79 ? -8.650 14.162 12.994 1.00 15.14 ? 78 VAL B HB 1 +ATOM 1170 H HG11 . VAL A 1 79 ? -9.640 12.543 11.708 1.00 21.81 ? 78 VAL B HG11 1 +ATOM 1171 H HG12 . VAL A 1 79 ? -9.470 13.895 10.891 1.00 21.81 ? 78 VAL B HG12 1 +ATOM 1172 H HG13 . VAL A 1 79 ? -8.473 12.684 10.638 1.00 21.81 ? 78 VAL B HG13 1 +ATOM 1173 H HG21 . VAL A 1 79 ? -8.184 11.940 13.439 1.00 14.21 ? 78 VAL B HG21 1 +ATOM 1174 H HG22 . VAL A 1 79 ? -6.885 12.036 12.529 1.00 14.21 ? 78 VAL B HG22 1 +ATOM 1175 H HG23 . VAL A 1 79 ? -6.975 12.874 13.876 1.00 14.21 ? 78 VAL B HG23 1 +ATOM 1176 N N . TYR A 1 80 ? -4.933 13.505 11.349 1.00 7.81 ? 79 TYR B N 1 +ATOM 1177 C CA . TYR A 1 80 ? -3.869 12.908 10.528 1.00 7.27 ? 79 TYR B CA 1 +ATOM 1178 C C . TYR A 1 80 ? -3.599 11.503 10.981 1.00 7.62 ? 79 TYR B C 1 +ATOM 1179 O O . TYR A 1 80 ? -3.731 11.197 12.179 1.00 8.45 ? 79 TYR B O 1 +ATOM 1180 C CB . TYR A 1 80 ? -2.572 13.700 10.649 1.00 8.70 ? 79 TYR B CB 1 +ATOM 1181 C CG . TYR A 1 80 ? -2.740 15.162 10.364 1.00 9.55 ? 79 TYR B CG 1 +ATOM 1182 C CD1 . TYR A 1 80 ? -2.760 15.630 9.056 1.00 10.76 ? 79 TYR B CD1 1 +ATOM 1183 C CD2 . TYR A 1 80 ? -2.906 16.078 11.396 1.00 12.71 ? 79 TYR B CD2 1 +ATOM 1184 C CE1 . TYR A 1 80 ? -2.925 16.984 8.794 1.00 12.68 ? 79 TYR B CE1 1 +ATOM 1185 C CE2 . TYR A 1 80 ? -3.081 17.420 11.143 1.00 14.24 ? 79 TYR B CE2 1 +ATOM 1186 C CZ . TYR A 1 80 ? -3.084 17.870 9.848 1.00 14.34 ? 79 TYR B CZ 1 +ATOM 1187 O OH . TYR A 1 80 ? -3.261 19.223 9.607 1.00 19.03 ? 79 TYR B OH 1 +ATOM 1188 H H . TYR A 1 80 ? -4.760 13.486 12.192 1.00 9.38 ? 79 TYR B H 1 +ATOM 1189 H HA . TYR A 1 80 ? -4.141 12.891 9.598 1.00 8.72 ? 79 TYR B HA 1 +ATOM 1190 H HB2 . TYR A 1 80 ? -2.232 13.610 11.553 1.00 10.44 ? 79 TYR B HB2 1 +ATOM 1191 H HB3 . TYR A 1 80 ? -1.927 13.346 10.017 1.00 10.44 ? 79 TYR B HB3 1 +ATOM 1192 H HD1 . TYR A 1 80 ? -2.651 15.034 8.351 1.00 12.91 ? 79 TYR B HD1 1 +ATOM 1193 H HD2 . TYR A 1 80 ? -2.904 15.777 12.276 1.00 15.25 ? 79 TYR B HD2 1 +ATOM 1194 H HE1 . TYR A 1 80 ? -2.935 17.294 7.917 1.00 15.21 ? 79 TYR B HE1 1 +ATOM 1195 H HE2 . TYR A 1 80 ? -3.185 18.019 11.847 1.00 17.09 ? 79 TYR B HE2 1 +ATOM 1196 H HH . TYR A 1 80 ? -3.344 19.636 10.333 1.00 22.83 ? 79 TYR B HH 1 +ATOM 1197 N N . LEU A 1 81 ? -3.187 10.646 10.051 1.00 7.15 ? 80 LEU B N 1 +ATOM 1198 C CA . LEU A 1 81 ? -2.727 9.306 10.373 1.00 7.56 ? 80 LEU B CA 1 +ATOM 1199 C C . LEU A 1 81 ? -1.374 9.120 9.698 1.00 7.08 ? 80 LEU B C 1 +ATOM 1200 O O . LEU A 1 81 ? -1.281 9.069 8.460 1.00 7.61 ? 80 LEU B O 1 +ATOM 1201 C CB . LEU A 1 81 ? -3.730 8.249 9.911 1.00 8.32 ? 80 LEU B CB 1 +ATOM 1202 C CG . LEU A 1 81 ? -3.413 6.833 10.387 1.00 7.72 ? 80 LEU B CG 1 +ATOM 1203 C CD1 . LEU A 1 81 ? -3.584 6.718 11.883 1.00 8.44 ? 80 LEU B CD1 1 +ATOM 1204 C CD2 . LEU A 1 81 ? -4.276 5.817 9.650 1.00 9.27 ? 80 LEU B CD2 1 +ATOM 1205 H H . LEU A 1 81 ? -3.165 10.825 9.210 1.00 8.58 ? 80 LEU B H 1 +ATOM 1206 H HA . LEU A 1 81 ? -2.609 9.223 11.333 1.00 9.07 ? 80 LEU B HA 1 +ATOM 1207 H HB2 . LEU A 1 81 ? -4.608 8.484 10.250 1.00 9.98 ? 80 LEU B HB2 1 +ATOM 1208 H HB3 . LEU A 1 81 ? -3.745 8.237 8.942 1.00 9.98 ? 80 LEU B HB3 1 +ATOM 1209 H HG . LEU A 1 81 ? -2.486 6.637 10.181 1.00 9.27 ? 80 LEU B HG 1 +ATOM 1210 H HD11 . LEU A 1 81 ? -3.377 5.811 12.155 1.00 10.13 ? 80 LEU B HD11 1 +ATOM 1211 H HD12 . LEU A 1 81 ? -2.981 7.341 12.318 1.00 10.13 ? 80 LEU B HD12 1 +ATOM 1212 H HD13 . LEU A 1 81 ? -4.503 6.931 12.112 1.00 10.13 ? 80 LEU B HD13 1 +ATOM 1213 H HD21 . LEU A 1 81 ? -4.057 4.928 9.968 1.00 11.13 ? 80 LEU B HD21 1 +ATOM 1214 H HD22 . LEU A 1 81 ? -5.210 6.011 9.825 1.00 11.13 ? 80 LEU B HD22 1 +ATOM 1215 H HD23 . LEU A 1 81 ? -4.097 5.882 8.699 1.00 11.13 ? 80 LEU B HD23 1 +ATOM 1216 N N . GLN A 1 82 ? -0.321 9.083 10.514 1.00 6.82 ? 81 GLN B N 1 +ATOM 1217 C CA . GLN A 1 82 ? 1.030 8.860 10.028 1.00 8.01 ? 81 GLN B CA 1 +ATOM 1218 C C . GLN A 1 82 ? 1.303 7.379 10.075 1.00 7.45 ? 81 GLN B C 1 +ATOM 1219 O O . GLN A 1 82 ? 1.364 6.782 11.159 1.00 8.32 ? 81 GLN B O 1 +ATOM 1220 C CB . GLN A 1 82 ? 2.034 9.580 10.923 1.00 9.09 ? 81 GLN B CB 1 +ATOM 1221 C CG . GLN A 1 82 ? 3.468 9.466 10.446 1.00 10.05 ? 81 GLN B CG 1 +ATOM 1222 C CD . GLN A 1 82 ? 3.649 10.030 9.055 1.00 15.40 ? 81 GLN B CD 1 +ATOM 1223 O OE1 . GLN A 1 82 ? 3.288 11.175 8.788 1.00 14.11 ? 81 GLN B OE1 1 +ATOM 1224 N NE2 . GLN A 1 82 ? 4.211 9.223 8.150 1.00 16.88 ? 81 GLN B NE2 1 +ATOM 1225 H H . GLN A 1 82 ? -0.370 9.187 11.366 1.00 8.18 ? 81 GLN B H 1 +ATOM 1226 H HA . GLN A 1 82 ? 1.121 9.179 9.116 1.00 9.61 ? 81 GLN B HA 1 +ATOM 1227 H HB2 . GLN A 1 82 ? 1.805 10.523 10.954 1.00 10.91 ? 81 GLN B HB2 1 +ATOM 1228 H HB3 . GLN A 1 82 ? 1.986 9.201 11.814 1.00 10.91 ? 81 GLN B HB3 1 +ATOM 1229 H HG2 . GLN A 1 82 ? 4.045 9.960 11.050 1.00 12.06 ? 81 GLN B HG2 1 +ATOM 1230 H HG3 . GLN A 1 82 ? 3.725 8.531 10.429 1.00 12.06 ? 81 GLN B HG3 1 +ATOM 1231 H HE21 . GLN A 1 82 ? 4.449 8.427 8.373 1.00 20.26 ? 81 GLN B HE21 1 +ATOM 1232 H HE22 . GLN A 1 82 ? 4.335 9.499 7.345 1.00 20.26 ? 81 GLN B HE22 1 +ATOM 1233 N N . MET A 1 83 ? 1.433 6.772 8.897 1.00 6.92 ? 82 MET B N 1 +ATOM 1234 C CA . MET A 1 83 ? 1.559 5.331 8.779 1.00 8.18 ? 82 MET B CA 1 +ATOM 1235 C C . MET A 1 83 ? 2.978 4.968 8.377 1.00 7.23 ? 82 MET B C 1 +ATOM 1236 O O . MET A 1 83 ? 3.392 5.224 7.240 1.00 9.02 ? 82 MET B O 1 +ATOM 1237 C CB . MET A 1 83 ? 0.589 4.811 7.727 1.00 8.26 ? 82 MET B CB 1 +ATOM 1238 C CG . MET A 1 83 ? -0.823 5.416 7.869 1.00 9.07 ? 82 MET B CG 1 +ATOM 1239 S SD . MET A 1 83 ? -1.856 5.296 6.391 1.00 17.50 ? 82 MET B SD 1 +ATOM 1240 C CE . MET A 1 83 ? -2.220 3.762 6.966 1.00 10.71 ? 82 MET B CE 1 +ATOM 1241 H H . MET A 1 83 ? 1.451 7.185 8.142 1.00 8.30 ? 82 MET B H 1 +ATOM 1242 H HA . MET A 1 83 ? 1.345 4.915 9.629 1.00 9.82 ? 82 MET B HA 1 +ATOM 1243 H HB2 . MET A 1 83 ? 0.926 5.039 6.846 1.00 9.91 ? 82 MET B HB2 1 +ATOM 1244 H HB3 . MET A 1 83 ? 0.513 3.848 7.815 1.00 9.91 ? 82 MET B HB3 1 +ATOM 1245 H HG2 . MET A 1 83 ? -1.285 4.956 8.587 1.00 10.89 ? 82 MET B HG2 1 +ATOM 1246 H HG3 . MET A 1 83 ? -0.735 6.357 8.089 1.00 10.89 ? 82 MET B HG3 1 +ATOM 1247 H HE1 . MET A 1 83 ? -2.630 3.842 7.841 1.00 12.85 ? 82 MET B HE1 1 +ATOM 1248 H HE2 . MET A 1 83 ? -2.834 3.332 6.350 1.00 12.85 ? 82 MET B HE2 1 +ATOM 1249 H HE3 . MET A 1 83 ? -1.401 3.247 7.030 1.00 12.85 ? 82 MET B HE3 1 +ATOM 1250 N N . ASN A 1 84 ? 3.716 4.381 9.306 1.00 7.39 ? 83 ASN B N 1 +ATOM 1251 C CA . ASN A 1 84 ? 5.094 3.990 9.055 1.00 7.83 ? 83 ASN B CA 1 +ATOM 1252 C C . ASN A 1 84 ? 5.213 2.476 8.935 1.00 8.30 ? 83 ASN B C 1 +ATOM 1253 O O . ASN A 1 84 ? 4.313 1.742 9.284 1.00 8.97 ? 83 ASN B O 1 +ATOM 1254 C CB . ASN A 1 84 ? 5.980 4.505 10.185 1.00 8.47 ? 83 ASN B CB 1 +ATOM 1255 C CG . ASN A 1 84 ? 6.038 6.014 10.223 1.00 8.01 ? 83 ASN B CG 1 +ATOM 1256 O OD1 . ASN A 1 84 ? 5.898 6.676 9.195 1.00 10.97 ? 83 ASN B OD1 1 +ATOM 1257 N ND2 . ASN A 1 84 ? 6.243 6.574 11.390 1.00 8.96 ? 83 ASN B ND2 1 +ATOM 1258 H H . ASN A 1 84 ? 3.440 4.196 10.099 1.00 8.87 ? 83 ASN B H 1 +ATOM 1259 H HA . ASN A 1 84 ? 5.395 4.388 8.223 1.00 9.40 ? 83 ASN B HA 1 +ATOM 1260 H HB2 . ASN A 1 84 ? 5.626 4.195 11.033 1.00 10.16 ? 83 ASN B HB2 1 +ATOM 1261 H HB3 . ASN A 1 84 ? 6.882 4.171 10.058 1.00 10.16 ? 83 ASN B HB3 1 +ATOM 1262 H HD21 . ASN A 1 84 ? 6.282 7.431 11.455 1.00 10.75 ? 83 ASN B HD21 1 +ATOM 1263 H HD22 . ASN A 1 84 ? 6.337 6.085 12.092 1.00 10.75 ? 83 ASN B HD22 1 +ATOM 1264 N N . SER A 1 85 ? 6.354 2.025 8.422 1.00 9.64 ? 84 SER B N 1 +ATOM 1265 C CA . SER A 1 85 ? 6.679 0.595 8.345 1.00 12.24 ? 84 SER B CA 1 +ATOM 1266 C C . SER A 1 85 ? 5.537 -0.172 7.703 1.00 9.80 ? 84 SER B C 1 +ATOM 1267 O O . SER A 1 85 ? 5.075 -1.184 8.200 1.00 10.36 ? 84 SER B O 1 +ATOM 1268 C CB . SER A 1 85 ? 7.012 0.038 9.733 1.00 13.59 ? 84 SER B CB 1 +ATOM 1269 O OG . SER A 1 85 ? 8.115 0.737 10.303 1.00 15.45 ? 84 SER B OG 1 +ATOM 1270 H H . SER A 1 85 ? 6.970 2.534 8.104 1.00 11.56 ? 84 SER B H 1 +ATOM 1271 H HA . SER A 1 85 ? 7.463 0.483 7.785 1.00 14.68 ? 84 SER B HA 1 +ATOM 1272 H HB2 . SER A 1 85 ? 6.239 0.143 10.310 1.00 16.30 ? 84 SER B HB2 1 +ATOM 1273 H HB3 . SER A 1 85 ? 7.240 -0.901 9.651 1.00 16.30 ? 84 SER B HB3 1 +ATOM 1274 H HG . SER A 1 85 ? 8.291 0.425 11.063 1.00 18.54 ? 84 SER B HG 1 +ATOM 1275 N N . LEU A 1 86 ? 5.056 0.345 6.588 1.00 10.78 ? 85 LEU B N 1 +ATOM 1276 C CA . LEU A 1 86 ? 3.880 -0.232 5.940 1.00 10.58 ? 85 LEU B CA 1 +ATOM 1277 C C . LEU A 1 86 ? 4.111 -1.647 5.408 1.00 11.40 ? 85 LEU B C 1 +ATOM 1278 O O . LEU A 1 86 ? 5.222 -1.991 4.971 1.00 12.64 ? 85 LEU B O 1 +ATOM 1279 C CB . LEU A 1 86 ? 3.385 0.696 4.827 1.00 11.54 ? 85 LEU B CB 1 +ATOM 1280 C CG . LEU A 1 86 ? 2.605 1.892 5.377 1.00 12.55 ? 85 LEU B CG 1 +ATOM 1281 C CD1 . LEU A 1 86 ? 2.539 2.987 4.339 1.00 14.22 ? 85 LEU B CD1 1 +ATOM 1282 C CD2 . LEU A 1 86 ? 1.212 1.459 5.800 1.00 12.83 ? 85 LEU B CD2 1 +ATOM 1283 H H . LEU A 1 86 ? 5.387 1.028 6.182 1.00 12.94 ? 85 LEU B H 1 +ATOM 1284 H HA . LEU A 1 86 ? 3.171 -0.289 6.600 1.00 12.69 ? 85 LEU B HA 1 +ATOM 1285 H HB2 . LEU A 1 86 ? 4.147 1.035 4.332 1.00 13.84 ? 85 LEU B HB2 1 +ATOM 1286 H HB3 . LEU A 1 86 ? 2.798 0.199 4.236 1.00 13.84 ? 85 LEU B HB3 1 +ATOM 1287 H HG . LEU A 1 86 ? 3.064 2.241 6.157 1.00 15.06 ? 85 LEU B HG 1 +ATOM 1288 H HD11 . LEU A 1 86 ? 2.042 3.736 4.703 1.00 17.06 ? 85 LEU B HD11 1 +ATOM 1289 H HD12 . LEU A 1 86 ? 3.441 3.264 4.116 1.00 17.06 ? 85 LEU B HD12 1 +ATOM 1290 H HD13 . LEU A 1 86 ? 2.092 2.645 3.549 1.00 17.06 ? 85 LEU B HD13 1 +ATOM 1291 H HD21 . LEU A 1 86 ? 0.734 2.229 6.146 1.00 15.40 ? 85 LEU B HD21 1 +ATOM 1292 H HD22 . LEU A 1 86 ? 0.747 1.098 5.029 1.00 15.40 ? 85 LEU B HD22 1 +ATOM 1293 H HD23 . LEU A 1 86 ? 1.289 0.780 6.488 1.00 15.40 ? 85 LEU B HD23 1 +ATOM 1294 N N . LYS A 1 87 ? 3.052 -2.445 5.472 1.00 11.64 ? 86 LYS B N 1 +ATOM 1295 C CA . LYS A 1 87 ? 3.060 -3.851 5.104 1.00 13.67 ? 86 LYS B CA 1 +ATOM 1296 C C . LYS A 1 87 ? 1.958 -4.060 4.076 1.00 13.88 ? 86 LYS B C 1 +ATOM 1297 O O . LYS A 1 87 ? 0.973 -3.327 4.077 1.00 12.20 ? 86 LYS B O 1 +ATOM 1298 C CB . LYS A 1 87 ? 2.778 -4.707 6.337 1.00 17.49 ? 86 LYS B CB 1 +ATOM 1299 C CG . LYS A 1 87 ? 3.816 -4.555 7.423 1.00 19.70 ? 86 LYS B CG 1 +ATOM 1300 C CD . LYS A 1 87 ? 3.337 -5.101 8.756 1.00 26.98 ? 86 LYS B CD 1 +ATOM 1301 C CE . LYS A 1 87 ? 4.409 -4.915 9.841 1.00 29.98 ? 86 LYS B CE 1 +ATOM 1302 N NZ . LYS A 1 87 ? 5.486 -3.924 9.465 1.00 24.69 1 86 LYS B NZ 1 +ATOM 1303 H H . LYS A 1 87 ? 2.279 -2.177 5.740 1.00 13.97 ? 86 LYS B H 1 +ATOM 1304 H HA . LYS A 1 87 ? 3.916 -4.100 4.721 1.00 16.40 ? 86 LYS B HA 1 +ATOM 1305 H HB2 . LYS A 1 87 ? 1.920 -4.449 6.708 1.00 20.99 ? 86 LYS B HB2 1 +ATOM 1306 H HB3 . LYS A 1 87 ? 2.757 -5.640 6.074 1.00 20.99 ? 86 LYS B HB3 1 +ATOM 1307 H HG2 . LYS A 1 87 ? 4.616 -5.042 7.167 1.00 23.63 ? 86 LYS B HG2 1 +ATOM 1308 H HG3 . LYS A 1 87 ? 4.021 -3.614 7.538 1.00 23.63 ? 86 LYS B HG3 1 +ATOM 1309 H HD2 . LYS A 1 87 ? 2.538 -4.624 9.031 1.00 32.37 ? 86 LYS B HD2 1 +ATOM 1310 H HD3 . LYS A 1 87 ? 3.152 -6.049 8.669 1.00 32.37 ? 86 LYS B HD3 1 +ATOM 1311 H HE2 . LYS A 1 87 ? 3.982 -4.596 10.652 1.00 35.98 ? 86 LYS B HE2 1 +ATOM 1312 H HE3 . LYS A 1 87 ? 4.837 -5.770 10.008 1.00 35.98 ? 86 LYS B HE3 1 +ATOM 1313 H HZ1 . LYS A 1 87 ? 5.905 -4.196 8.728 1.00 29.63 ? 86 LYS B HZ1 1 +ATOM 1314 H HZ2 . LYS A 1 87 ? 5.125 -3.125 9.315 1.00 29.63 ? 86 LYS B HZ2 1 +ATOM 1315 H HZ3 . LYS A 1 87 ? 6.079 -3.855 10.126 1.00 29.63 ? 86 LYS B HZ3 1 +ATOM 1316 N N . PRO A 1 88 ? 2.106 -5.058 3.192 1.00 15.33 ? 87 PRO B N 1 +ATOM 1317 C CA . PRO A 1 88 ? 1.049 -5.249 2.193 1.00 15.24 ? 87 PRO B CA 1 +ATOM 1318 C C . PRO A 1 88 ? -0.322 -5.458 2.829 1.00 14.54 ? 87 PRO B C 1 +ATOM 1319 O O . PRO A 1 88 ? -1.331 -5.032 2.269 1.00 14.70 ? 87 PRO B O 1 +ATOM 1320 C CB . PRO A 1 88 ? 1.530 -6.488 1.414 1.00 16.52 ? 87 PRO B CB 1 +ATOM 1321 C CG . PRO A 1 88 ? 3.015 -6.456 1.554 1.00 19.61 ? 87 PRO B CG 1 +ATOM 1322 C CD . PRO A 1 88 ? 3.265 -5.940 2.945 1.00 14.22 ? 87 PRO B CD 1 +ATOM 1323 H HA . PRO A 1 88 ? 1.012 -4.488 1.593 1.00 18.29 ? 87 PRO B HA 1 +ATOM 1324 H HB2 . PRO A 1 88 ? 1.162 -7.292 1.814 1.00 19.82 ? 87 PRO B HB2 1 +ATOM 1325 H HB3 . PRO A 1 88 ? 1.269 -6.414 0.483 1.00 19.82 ? 87 PRO B HB3 1 +ATOM 1326 H HG2 . PRO A 1 88 ? 3.373 -7.352 1.451 1.00 23.53 ? 87 PRO B HG2 1 +ATOM 1327 H HG3 . PRO A 1 88 ? 3.393 -5.856 0.893 1.00 23.53 ? 87 PRO B HG3 1 +ATOM 1328 H HD2 . PRO A 1 88 ? 3.276 -6.673 3.581 1.00 17.06 ? 87 PRO B HD2 1 +ATOM 1329 H HD3 . PRO A 1 88 ? 4.091 -5.431 2.974 1.00 17.06 ? 87 PRO B HD3 1 +ATOM 1330 N N . GLU A 1 89 ? -0.350 -6.048 4.012 1.00 15.65 ? 88 GLU B N 1 +ATOM 1331 C CA . GLU A 1 89 ? -1.599 -6.301 4.708 1.00 16.14 ? 88 GLU B CA 1 +ATOM 1332 C C . GLU A 1 89 ? -2.260 -5.028 5.274 1.00 12.78 ? 88 GLU B C 1 +ATOM 1333 O O . GLU A 1 89 ? -3.371 -5.087 5.777 1.00 13.88 ? 88 GLU B O 1 +ATOM 1334 C CB . GLU A 1 89 ? -1.405 -7.354 5.809 1.00 22.14 ? 88 GLU B CB 1 +ATOM 1335 C CG . GLU A 1 89 ? -0.287 -7.059 6.798 1.00 26.64 ? 88 GLU B CG 1 +ATOM 1336 C CD . GLU A 1 89 ? 1.041 -7.732 6.446 1.00 23.82 ? 88 GLU B CD 1 +ATOM 1337 O OE1 . GLU A 1 89 ? 1.407 -7.821 5.256 1.00 20.13 ? 88 GLU B OE1 1 +ATOM 1338 O OE2 . GLU A 1 89 ? 1.732 -8.173 7.388 1.00 43.01 -1 88 GLU B OE2 1 +ATOM 1339 H H . GLU A 1 89 ? 0.348 -6.314 4.438 1.00 18.78 ? 88 GLU B H 1 +ATOM 1340 H HA . GLU A 1 89 ? -2.223 -6.677 4.067 1.00 19.37 ? 88 GLU B HA 1 +ATOM 1341 H HB2 . GLU A 1 89 ? -2.229 -7.427 6.314 1.00 26.57 ? 88 GLU B HB2 1 +ATOM 1342 H HB3 . GLU A 1 89 ? -1.205 -8.205 5.389 1.00 26.57 ? 88 GLU B HB3 1 +ATOM 1343 H HG2 . GLU A 1 89 ? -0.137 -6.101 6.823 1.00 31.97 ? 88 GLU B HG2 1 +ATOM 1344 H HG3 . GLU A 1 89 ? -0.556 -7.373 7.675 1.00 31.97 ? 88 GLU B HG3 1 +ATOM 1345 N N . ASP A 1 90 ? -1.587 -3.888 5.148 1.00 11.79 ? 89 ASP B N 1 +ATOM 1346 C CA . ASP A 1 90 ? -2.211 -2.595 5.466 1.00 11.07 ? 89 ASP B CA 1 +ATOM 1347 C C . ASP A 1 90 ? -3.032 -2.045 4.293 1.00 12.09 ? 89 ASP B C 1 +ATOM 1348 O O . ASP A 1 90 ? -3.665 -0.991 4.409 1.00 10.33 ? 89 ASP B O 1 +ATOM 1349 C CB . ASP A 1 90 ? -1.151 -1.562 5.845 1.00 10.31 ? 89 ASP B CB 1 +ATOM 1350 C CG . ASP A 1 90 ? -0.419 -1.904 7.128 1.00 9.78 ? 89 ASP B CG 1 +ATOM 1351 O OD1 . ASP A 1 90 ? -1.087 -2.283 8.110 1.00 10.42 ? 89 ASP B OD1 1 +ATOM 1352 O OD2 . ASP A 1 90 ? 0.820 -1.759 7.123 1.00 11.22 -1 89 ASP B OD2 1 +ATOM 1353 H H . ASP A 1 90 ? -0.771 -3.830 4.883 1.00 14.15 ? 89 ASP B H 1 +ATOM 1354 H HA . ASP A 1 90 ? -2.806 -2.708 6.223 1.00 13.28 ? 89 ASP B HA 1 +ATOM 1355 H HB2 . ASP A 1 90 ? -0.495 -1.508 5.132 1.00 12.38 ? 89 ASP B HB2 1 +ATOM 1356 H HB3 . ASP A 1 90 ? -1.579 -0.700 5.966 1.00 12.38 ? 89 ASP B HB3 1 +ATOM 1357 N N . THR A 1 91 ? -3.025 -2.748 3.160 1.00 10.88 ? 90 THR B N 1 +ATOM 1358 C CA . THR A 1 91 ? -3.826 -2.342 1.998 1.00 11.01 ? 90 THR B CA 1 +ATOM 1359 C C . THR A 1 91 ? -5.306 -2.373 2.348 1.00 9.39 ? 90 THR B C 1 +ATOM 1360 O O . THR A 1 91 ? -5.799 -3.356 2.870 1.00 12.14 ? 90 THR B O 1 +ATOM 1361 C CB . THR A 1 91 ? -3.530 -3.246 0.785 1.00 11.08 ? 90 THR B CB 1 +ATOM 1362 O OG1 . THR A 1 91 ? -2.165 -3.066 0.406 1.00 13.28 ? 90 THR B OG1 1 +ATOM 1363 C CG2 . THR A 1 91 ? -4.449 -2.908 -0.402 1.00 11.39 ? 90 THR B CG2 1 +ATOM 1364 H H . THR A 1 91 ? -2.566 -3.465 3.035 1.00 13.06 ? 90 THR B H 1 +ATOM 1365 H HA . THR A 1 91 ? -3.594 -1.432 1.757 1.00 13.21 ? 90 THR B HA 1 +ATOM 1366 H HB . THR A 1 91 ? -3.675 -4.173 1.031 1.00 13.30 ? 90 THR B HB 1 +ATOM 1367 H HG1 . THR A 1 91 ? -1.660 -3.274 1.043 1.00 15.94 ? 90 THR B HG1 1 +ATOM 1368 H HG21 . THR A 1 91 ? -4.246 -3.487 -1.153 1.00 13.67 ? 90 THR B HG21 1 +ATOM 1369 H HG22 . THR A 1 91 ? -5.377 -3.034 -0.149 1.00 13.67 ? 90 THR B HG22 1 +ATOM 1370 H HG23 . THR A 1 91 ? -4.318 -1.986 -0.671 1.00 13.67 ? 90 THR B HG23 1 +ATOM 1371 N N . ALA A 1 92 ? -6.006 -1.268 2.089 1.00 10.44 ? 91 ALA B N 1 +ATOM 1372 C CA . ALA A 1 92 ? -7.419 -1.144 2.433 1.00 9.29 ? 91 ALA B CA 1 +ATOM 1373 C C . ALA A 1 92 ? -7.934 0.223 2.023 1.00 7.81 ? 91 ALA B C 1 +ATOM 1374 O O . ALA A 1 92 ? -7.158 1.122 1.729 1.00 8.90 ? 91 ALA B O 1 +ATOM 1375 C CB . ALA A 1 92 ? -7.637 -1.314 3.955 1.00 10.03 ? 91 ALA B CB 1 +ATOM 1376 H H . ALA A 1 92 ? -5.678 -0.569 1.710 1.00 12.53 ? 91 ALA B H 1 +ATOM 1377 H HA . ALA A 1 92 ? -7.931 -1.823 1.966 1.00 11.15 ? 91 ALA B HA 1 +ATOM 1378 H HB1 . ALA A 1 92 ? -8.584 -1.226 4.150 1.00 12.04 ? 91 ALA B HB1 1 +ATOM 1379 H HB2 . ALA A 1 92 ? -7.325 -2.193 4.222 1.00 12.04 ? 91 ALA B HB2 1 +ATOM 1380 H HB3 . ALA A 1 92 ? -7.138 -0.628 4.424 1.00 12.04 ? 91 ALA B HB3 1 +ATOM 1381 N N . VAL A 1 93 ? -9.251 0.364 2.060 1.00 9.03 ? 92 VAL B N 1 +ATOM 1382 C CA . VAL A 1 93 ? -9.861 1.675 2.079 1.00 8.54 ? 92 VAL B CA 1 +ATOM 1383 C C . VAL A 1 93 ? -9.876 2.171 3.532 1.00 7.91 ? 92 VAL B C 1 +ATOM 1384 O O . VAL A 1 93 ? -10.344 1.463 4.421 1.00 8.60 ? 92 VAL B O 1 +ATOM 1385 C CB . VAL A 1 93 ? -11.304 1.638 1.532 1.00 8.95 ? 92 VAL B CB 1 +ATOM 1386 C CG1 . VAL A 1 93 ? -11.930 3.014 1.617 1.00 11.34 ? 92 VAL B CG1 1 +ATOM 1387 C CG2 . VAL A 1 93 ? -11.341 1.114 0.091 1.00 13.55 ? 92 VAL B CG2 1 +ATOM 1388 H H . VAL A 1 93 ? -9.812 -0.288 2.075 1.00 10.84 ? 92 VAL B H 1 +ATOM 1389 H HA . VAL A 1 93 ? -9.337 2.290 1.543 1.00 10.24 ? 92 VAL B HA 1 +ATOM 1390 H HB . VAL A 1 93 ? -11.831 1.037 2.081 1.00 10.73 ? 92 VAL B HB 1 +ATOM 1391 H HG11 . VAL A 1 93 ? -12.835 2.970 1.269 1.00 13.61 ? 92 VAL B HG11 1 +ATOM 1392 H HG12 . VAL A 1 93 ? -11.945 3.297 2.544 1.00 13.61 ? 92 VAL B HG12 1 +ATOM 1393 H HG13 . VAL A 1 93 ? -11.403 3.634 1.089 1.00 13.61 ? 92 VAL B HG13 1 +ATOM 1394 H HG21 . VAL A 1 93 ? -12.261 1.105 -0.218 1.00 16.26 ? 92 VAL B HG21 1 +ATOM 1395 H HG22 . VAL A 1 93 ? -10.809 1.698 -0.471 1.00 16.26 ? 92 VAL B HG22 1 +ATOM 1396 H HG23 . VAL A 1 93 ? -10.977 0.215 0.073 1.00 16.26 ? 92 VAL B HG23 1 +ATOM 1397 N N . TYR A 1 94 ? -9.335 3.370 3.734 1.00 7.72 ? 93 TYR B N 1 +ATOM 1398 C CA . TYR A 1 94 ? -9.259 4.001 5.047 1.00 7.20 ? 93 TYR B CA 1 +ATOM 1399 C C . TYR A 1 94 ? -10.338 5.071 5.177 1.00 7.66 ? 93 TYR B C 1 +ATOM 1400 O O . TYR A 1 94 ? -10.470 5.956 4.315 1.00 8.13 ? 93 TYR B O 1 +ATOM 1401 C CB . TYR A 1 94 ? -7.861 4.603 5.279 1.00 7.73 ? 93 TYR B CB 1 +ATOM 1402 C CG . TYR A 1 94 ? -6.826 3.554 5.601 1.00 7.63 ? 93 TYR B CG 1 +ATOM 1403 C CD1 . TYR A 1 94 ? -6.356 2.686 4.625 1.00 8.04 ? 93 TYR B CD1 1 +ATOM 1404 C CD2 . TYR A 1 94 ? -6.342 3.402 6.891 1.00 8.43 ? 93 TYR B CD2 1 +ATOM 1405 C CE1 . TYR A 1 94 ? -5.423 1.700 4.931 1.00 9.36 ? 93 TYR B CE1 1 +ATOM 1406 C CE2 . TYR A 1 94 ? -5.422 2.425 7.198 1.00 8.06 ? 93 TYR B CE2 1 +ATOM 1407 C CZ . TYR A 1 94 ? -4.977 1.578 6.214 1.00 7.65 ? 93 TYR B CZ 1 +ATOM 1408 O OH . TYR A 1 94 ? -4.061 0.616 6.541 1.00 9.29 ? 93 TYR B OH 1 +ATOM 1409 H H . TYR A 1 94 ? -8.996 3.850 3.106 1.00 9.26 ? 93 TYR B H 1 +ATOM 1410 H HA . TYR A 1 94 ? -9.416 3.331 5.731 1.00 8.64 ? 93 TYR B HA 1 +ATOM 1411 H HB2 . TYR A 1 94 ? -7.579 5.066 4.475 1.00 9.28 ? 93 TYR B HB2 1 +ATOM 1412 H HB3 . TYR A 1 94 ? -7.903 5.223 6.023 1.00 9.28 ? 93 TYR B HB3 1 +ATOM 1413 H HD1 . TYR A 1 94 ? -6.671 2.764 3.753 1.00 9.65 ? 93 TYR B HD1 1 +ATOM 1414 H HD2 . TYR A 1 94 ? -6.652 3.965 7.564 1.00 10.12 ? 93 TYR B HD2 1 +ATOM 1415 H HE1 . TYR A 1 94 ? -5.115 1.123 4.269 1.00 11.23 ? 93 TYR B HE1 1 +ATOM 1416 H HE2 . TYR A 1 94 ? -5.108 2.336 8.069 1.00 9.68 ? 93 TYR B HE2 1 +ATOM 1417 H HH . TYR A 1 94 ? -3.857 0.170 5.859 1.00 11.14 ? 93 TYR B HH 1 +ATOM 1418 N N . TYR A 1 95 ? -11.118 4.964 6.248 1.00 6.70 ? 94 TYR B N 1 +ATOM 1419 C CA . TYR A 1 95 ? -12.252 5.823 6.525 1.00 7.15 ? 94 TYR B CA 1 +ATOM 1420 C C . TYR A 1 95 ? -12.014 6.663 7.761 1.00 6.60 ? 94 TYR B C 1 +ATOM 1421 O O . TYR A 1 95 ? -11.592 6.152 8.809 1.00 7.54 ? 94 TYR B O 1 +ATOM 1422 C CB . TYR A 1 95 ? -13.489 4.989 6.847 1.00 9.27 ? 94 TYR B CB 1 +ATOM 1423 C CG . TYR A 1 95 ? -14.000 4.163 5.694 1.00 9.72 ? 94 TYR B CG 1 +ATOM 1424 C CD1 . TYR A 1 95 ? -14.923 4.692 4.811 1.00 13.64 ? 94 TYR B CD1 1 +ATOM 1425 C CD2 . TYR A 1 95 ? -13.554 2.870 5.484 1.00 12.20 ? 94 TYR B CD2 1 +ATOM 1426 C CE1 . TYR A 1 95 ? -15.405 3.953 3.753 1.00 17.62 ? 94 TYR B CE1 1 +ATOM 1427 C CE2 . TYR A 1 95 ? -14.030 2.121 4.414 1.00 14.81 ? 94 TYR B CE2 1 +ATOM 1428 C CZ . TYR A 1 95 ? -14.947 2.682 3.555 1.00 15.26 ? 94 TYR B CZ 1 +ATOM 1429 O OH . TYR A 1 95 ? -15.440 1.954 2.486 1.00 21.39 ? 94 TYR B OH 1 +ATOM 1430 H H . TYR A 1 95 ? -10.998 4.368 6.856 1.00 8.04 ? 94 TYR B H 1 +ATOM 1431 H HA . TYR A 1 95 ? -12.437 6.402 5.768 1.00 8.59 ? 94 TYR B HA 1 +ATOM 1432 H HB2 . TYR A 1 95 ? -13.273 4.381 7.572 1.00 11.13 ? 94 TYR B HB2 1 +ATOM 1433 H HB3 . TYR A 1 95 ? -14.203 5.585 7.122 1.00 11.13 ? 94 TYR B HB3 1 +ATOM 1434 H HD1 . TYR A 1 95 ? -15.232 5.559 4.940 1.00 16.37 ? 94 TYR B HD1 1 +ATOM 1435 H HD2 . TYR A 1 95 ? -12.930 2.499 6.064 1.00 14.64 ? 94 TYR B HD2 1 +ATOM 1436 H HE1 . TYR A 1 95 ? -16.024 4.324 3.167 1.00 21.14 ? 94 TYR B HE1 1 +ATOM 1437 H HE2 . TYR A 1 95 ? -13.727 1.253 4.277 1.00 17.77 ? 94 TYR B HE2 1 +ATOM 1438 H HH . TYR A 1 95 ? -15.085 1.193 2.469 1.00 25.67 ? 94 TYR B HH 1 +ATOM 1439 N N . CYS A 1 96 ? -12.322 7.941 7.655 1.00 6.61 ? 95 CYS B N 1 +ATOM 1440 C CA . CYS A 1 96 ? -12.361 8.842 8.792 1.00 7.80 ? 95 CYS B CA 1 +ATOM 1441 C C . CYS A 1 96 ? -13.774 8.866 9.376 1.00 6.45 ? 95 CYS B C 1 +ATOM 1442 O O . CYS A 1 96 ? -14.754 8.776 8.624 1.00 8.02 ? 95 CYS B O 1 +ATOM 1443 C CB . CYS A 1 96 ? -11.950 10.236 8.283 1.00 11.74 ? 95 CYS B CB 1 +ATOM 1444 S SG . CYS A 1 96 ? -12.086 11.597 9.419 1.00 11.73 ? 95 CYS B SG 1 +ATOM 1445 H H . CYS A 1 96 ? -12.519 8.323 6.910 1.00 7.93 ? 95 CYS B H 1 +ATOM 1446 H HA . CYS A 1 96 ? -11.735 8.552 9.474 1.00 9.36 ? 95 CYS B HA 1 +ATOM 1447 H HB2 . CYS A 1 96 ? -11.022 10.192 8.003 1.00 14.08 ? 95 CYS B HB2 1 +ATOM 1448 H HB3 . CYS A 1 96 ? -12.503 10.450 7.515 1.00 14.08 ? 95 CYS B HB3 1 +ATOM 1449 N N . ALA A 1 97 ? -13.899 9.013 10.684 1.00 5.99 ? 96 ALA B N 1 +ATOM 1450 C CA . ALA A 1 97 ? -15.193 9.017 11.348 1.00 6.00 ? 96 ALA B CA 1 +ATOM 1451 C C . ALA A 1 97 ? -15.166 9.947 12.549 1.00 5.68 ? 96 ALA B C 1 +ATOM 1452 O O . ALA A 1 97 ? -14.116 10.148 13.162 1.00 6.72 ? 96 ALA B O 1 +ATOM 1453 C CB . ALA A 1 97 ? -15.550 7.628 11.784 1.00 7.84 ? 96 ALA B CB 1 +ATOM 1454 H H . ALA A 1 97 ? -13.236 9.114 11.221 1.00 7.19 ? 96 ALA B H 1 +ATOM 1455 H HA . ALA A 1 97 ? -15.873 9.331 10.732 1.00 7.20 ? 96 ALA B HA 1 +ATOM 1456 H HB1 . ALA A 1 97 ? -16.414 7.649 12.225 1.00 9.41 ? 96 ALA B HB1 1 +ATOM 1457 H HB2 . ALA A 1 97 ? -15.589 7.054 11.004 1.00 9.41 ? 96 ALA B HB2 1 +ATOM 1458 H HB3 . ALA A 1 97 ? -14.872 7.307 12.398 1.00 9.41 ? 96 ALA B HB3 1 +ATOM 1459 N N . ALA A 1 98 ? -16.326 10.505 12.889 1.00 6.06 ? 97 ALA B N 1 +ATOM 1460 C CA . ALA A 1 98 ? -16.473 11.431 14.018 1.00 5.45 ? 97 ALA B CA 1 +ATOM 1461 C C . ALA A 1 98 ? -17.598 10.935 14.911 1.00 5.57 ? 97 ALA B C 1 +ATOM 1462 O O . ALA A 1 98 ? -18.659 10.523 14.410 1.00 7.16 ? 97 ALA B O 1 +ATOM 1463 C CB . ALA A 1 98 ? -16.791 12.835 13.528 1.00 7.23 ? 97 ALA B CB 1 +ATOM 1464 H H . ALA A 1 98 ? -17.064 10.360 12.471 1.00 7.28 ? 97 ALA B H 1 +ATOM 1465 H HA . ALA A 1 98 ? -15.651 11.456 14.533 1.00 6.54 ? 97 ALA B HA 1 +ATOM 1466 H HB1 . ALA A 1 98 ? -16.882 13.423 14.294 1.00 8.67 ? 97 ALA B HB1 1 +ATOM 1467 H HB2 . ALA A 1 98 ? -16.068 13.142 12.959 1.00 8.67 ? 97 ALA B HB2 1 +ATOM 1468 H HB3 . ALA A 1 98 ? -17.621 12.814 13.027 1.00 8.67 ? 97 ALA B HB3 1 +ATOM 1469 N N . GLY A 1 99 ? -17.403 10.991 16.222 1.00 5.16 ? 98 GLY B N 1 +ATOM 1470 C CA . GLY A 1 99 ? -18.462 10.644 17.166 1.00 6.63 ? 98 GLY B CA 1 +ATOM 1471 C C . GLY A 1 99 ? -18.328 11.439 18.444 1.00 5.25 ? 98 GLY B C 1 +ATOM 1472 O O . GLY A 1 99 ? -17.347 12.147 18.638 1.00 6.40 ? 98 GLY B O 1 +ATOM 1473 H H . GLY A 1 99 ? -16.665 11.227 16.594 1.00 6.19 ? 98 GLY B H 1 +ATOM 1474 H HA2 . GLY A 1 99 ? -19.328 10.832 16.771 1.00 7.96 ? 98 GLY B HA2 1 +ATOM 1475 H HA3 . GLY A 1 99 ? -18.415 9.699 17.379 1.00 7.96 ? 98 GLY B HA3 1 +ATOM 1476 N N . ARG A 1 100 ? -19.324 11.315 19.317 1.00 5.47 ? 99 ARG B N 1 +ATOM 1477 C CA . ARG A 1 100 ? -19.394 12.113 20.534 1.00 6.05 ? 99 ARG B CA 1 +ATOM 1478 C C . ARG A 1 100 ? -18.946 11.354 21.773 1.00 5.41 ? 99 ARG B C 1 +ATOM 1479 O O . ARG A 1 100 ? -19.254 11.758 22.890 1.00 6.52 ? 99 ARG B O 1 +ATOM 1480 C CB . ARG A 1 100 ? -20.790 12.697 20.696 1.00 7.15 ? 99 ARG B CB 1 +ATOM 1481 C CG . ARG A 1 100 ? -21.130 13.718 19.618 1.00 6.60 ? 99 ARG B CG 1 +ATOM 1482 C CD . ARG A 1 100 ? -22.377 14.514 19.927 1.00 8.98 ? 99 ARG B CD 1 +ATOM 1483 N NE . ARG A 1 100 ? -23.575 13.693 19.951 1.00 8.74 ? 99 ARG B NE 1 +ATOM 1484 C CZ . ARG A 1 100 ? -24.279 13.371 21.034 1.00 8.90 ? 99 ARG B CZ 1 +ATOM 1485 N NH1 . ARG A 1 100 ? -23.929 13.761 22.264 1.00 9.05 1 99 ARG B NH1 1 +ATOM 1486 N NH2 . ARG A 1 100 ? -25.365 12.629 20.873 1.00 8.33 ? 99 ARG B NH2 1 +ATOM 1487 H H . ARG A 1 100 ? -19.980 10.768 19.223 1.00 6.56 ? 99 ARG B H 1 +ATOM 1488 H HA . ARG A 1 100 ? -18.787 12.862 20.432 1.00 7.26 ? 99 ARG B HA 1 +ATOM 1489 H HB2 . ARG A 1 100 ? -21.441 11.979 20.645 1.00 8.57 ? 99 ARG B HB2 1 +ATOM 1490 H HB3 . ARG A 1 100 ? -20.850 13.139 21.557 1.00 8.57 ? 99 ARG B HB3 1 +ATOM 1491 H HG2 . ARG A 1 100 ? -20.392 14.341 19.531 1.00 7.92 ? 99 ARG B HG2 1 +ATOM 1492 H HG3 . ARG A 1 100 ? -21.272 13.254 18.778 1.00 7.92 ? 99 ARG B HG3 1 +ATOM 1493 H HD2 . ARG A 1 100 ? -22.280 14.928 20.799 1.00 10.78 ? 99 ARG B HD2 1 +ATOM 1494 H HD3 . ARG A 1 100 ? -22.494 15.196 19.247 1.00 10.78 ? 99 ARG B HD3 1 +ATOM 1495 H HE . ARG A 1 100 ? -23.854 13.387 19.198 1.00 10.48 ? 99 ARG B HE 1 +ATOM 1496 H HH11 . ARG A 1 100 ? -23.229 14.247 22.378 1.00 10.87 ? 99 ARG B HH11 1 +ATOM 1497 H HH12 . ARG A 1 100 ? -24.407 13.529 22.941 1.00 10.87 ? 99 ARG B HH12 1 +ATOM 1498 H HH21 . ARG A 1 100 ? -25.594 12.368 20.087 1.00 9.99 ? 99 ARG B HH21 1 +ATOM 1499 H HH22 . ARG A 1 100 ? -25.832 12.397 21.557 1.00 9.99 ? 99 ARG B HH22 1 +ATOM 1500 N N . TRP A 1 101 ? -18.180 10.293 21.599 1.00 5.77 ? 100 TRP B N 1 +ATOM 1501 C CA . TRP A 1 101 ? -17.503 9.672 22.729 1.00 5.57 ? 100 TRP B CA 1 +ATOM 1502 C C . TRP A 1 101 ? -16.429 10.643 23.220 1.00 5.29 ? 100 TRP B C 1 +ATOM 1503 O O . TRP A 1 101 ? -15.968 11.519 22.463 1.00 5.59 ? 100 TRP B O 1 +ATOM 1504 C CB . TRP A 1 101 ? -16.915 8.315 22.328 1.00 6.39 ? 100 TRP B CB 1 +ATOM 1505 C CG . TRP A 1 101 ? -16.010 8.371 21.138 1.00 7.68 ? 100 TRP B CG 1 +ATOM 1506 C CD1 . TRP A 1 101 ? -16.345 8.212 19.814 1.00 7.60 ? 100 TRP B CD1 1 +ATOM 1507 C CD2 . TRP A 1 101 ? -14.603 8.601 21.164 1.00 6.64 ? 100 TRP B CD2 1 +ATOM 1508 N NE1 . TRP A 1 101 ? -15.230 8.358 19.027 1.00 8.18 ? 100 TRP B NE1 1 +ATOM 1509 C CE2 . TRP A 1 101 ? -14.150 8.598 19.830 1.00 7.51 ? 100 TRP B CE2 1 +ATOM 1510 C CE3 . TRP A 1 101 ? -13.685 8.839 22.178 1.00 6.71 ? 100 TRP B CE3 1 +ATOM 1511 C CZ2 . TRP A 1 101 ? -12.812 8.798 19.496 1.00 8.05 ? 100 TRP B CZ2 1 +ATOM 1512 C CZ3 . TRP A 1 101 ? -12.351 9.031 21.830 1.00 8.92 ? 100 TRP B CZ3 1 +ATOM 1513 C CH2 . TRP A 1 101 ? -11.938 9.013 20.502 1.00 8.95 ? 100 TRP B CH2 1 +ATOM 1514 H H . TRP A 1 101 ? -18.034 9.912 20.841 1.00 6.93 ? 100 TRP B H 1 +ATOM 1515 H HA . TRP A 1 101 ? -18.139 9.530 23.448 1.00 6.68 ? 100 TRP B HA 1 +ATOM 1516 H HB2 . TRP A 1 101 ? -16.402 7.965 23.073 1.00 7.66 ? 100 TRP B HB2 1 +ATOM 1517 H HB3 . TRP A 1 101 ? -17.643 7.710 22.118 1.00 7.66 ? 100 TRP B HB3 1 +ATOM 1518 H HD1 . TRP A 1 101 ? -17.205 8.055 19.496 1.00 9.12 ? 100 TRP B HD1 1 +ATOM 1519 H HE1 . TRP A 1 101 ? -15.211 8.296 18.169 1.00 9.82 ? 100 TRP B HE1 1 +ATOM 1520 H HE3 . TRP A 1 101 ? -13.952 8.857 23.069 1.00 8.06 ? 100 TRP B HE3 1 +ATOM 1521 H HZ2 . TRP A 1 101 ? -12.530 8.779 18.610 1.00 9.66 ? 100 TRP B HZ2 1 +ATOM 1522 H HZ3 . TRP A 1 101 ? -11.725 9.190 22.499 1.00 10.71 ? 100 TRP B HZ3 1 +ATOM 1523 H HH2 . TRP A 1 101 ? -11.040 9.148 20.304 1.00 10.73 ? 100 TRP B HH2 1 +ATOM 1524 N N . ASP A 1 102 ? -16.042 10.484 24.483 1.00 5.69 ? 101 ASP B N 1 +ATOM 1525 C CA . ASP A 1 102 ? -15.063 11.363 25.122 1.00 5.57 ? 101 ASP B CA 1 +ATOM 1526 C C . ASP A 1 102 ? -13.778 10.568 25.329 1.00 5.71 ? 101 ASP B C 1 +ATOM 1527 O O . ASP A 1 102 ? -12.812 10.745 24.581 1.00 6.38 ? 101 ASP B O 1 +ATOM 1528 C CB . ASP A 1 102 ? -15.642 11.979 26.402 1.00 6.12 ? 101 ASP B CB 1 +ATOM 1529 C CG . ASP A 1 102 ? -14.787 13.101 26.947 1.00 6.51 ? 101 ASP B CG 1 +ATOM 1530 O OD1 . ASP A 1 102 ? -13.574 13.109 26.660 1.00 7.05 ? 101 ASP B OD1 1 +ATOM 1531 O OD2 . ASP A 1 102 ? -15.321 13.995 27.643 1.00 7.41 -1 101 ASP B OD2 1 +ATOM 1532 H H . ASP A 1 102 ? -16.337 9.864 25.001 1.00 6.83 ? 101 ASP B H 1 +ATOM 1533 H HA . ASP A 1 102 ? -14.860 12.092 24.515 1.00 6.69 ? 101 ASP B HA 1 +ATOM 1534 H HB2 . ASP A 1 102 ? -16.522 12.339 26.209 1.00 7.35 ? 101 ASP B HB2 1 +ATOM 1535 H HB3 . ASP A 1 102 ? -15.706 11.291 27.083 1.00 7.35 ? 101 ASP B HB3 1 +ATOM 1536 N N . LYS A 1 103 ? -13.782 9.678 26.306 1.00 6.09 ? 102 LYS B N 1 +ATOM 1537 C CA . LYS A 1 103 ? -12.616 8.841 26.606 1.00 7.49 ? 102 LYS B CA 1 +ATOM 1538 C C . LYS A 1 103 ? -12.776 7.384 26.210 1.00 7.44 ? 102 LYS B C 1 +ATOM 1539 O O . LYS A 1 103 ? -11.770 6.671 26.107 1.00 8.42 ? 102 LYS B O 1 +ATOM 1540 C CB . LYS A 1 103 ? -12.313 8.838 28.105 1.00 7.91 ? 102 LYS B CB 1 +ATOM 1541 C CG . LYS A 1 103 ? -12.040 10.192 28.712 1.00 9.22 ? 102 LYS B CG 1 +ATOM 1542 C CD . LYS A 1 103 ? -11.747 10.022 30.197 1.00 10.51 ? 102 LYS B CD 1 +ATOM 1543 C CE . LYS A 1 103 ? -11.682 11.331 30.939 1.00 12.14 ? 102 LYS B CE 1 +ATOM 1544 N NZ . LYS A 1 103 ? -11.577 11.090 32.408 1.00 13.57 1 102 LYS B NZ 1 +ATOM 1545 H H . LYS A 1 103 ? -14.454 9.532 26.822 1.00 7.31 ? 102 LYS B H 1 +ATOM 1546 H HA . LYS A 1 103 ? -11.843 9.196 26.141 1.00 8.99 ? 102 LYS B HA 1 +ATOM 1547 H HB2 . LYS A 1 103 ? -13.073 8.457 28.571 1.00 9.50 ? 102 LYS B HB2 1 +ATOM 1548 H HB3 . LYS A 1 103 ? -11.529 8.287 28.258 1.00 9.50 ? 102 LYS B HB3 1 +ATOM 1549 H HG2 . LYS A 1 103 ? -11.265 10.593 28.286 1.00 11.07 ? 102 LYS B HG2 1 +ATOM 1550 H HG3 . LYS A 1 103 ? -12.819 10.760 28.611 1.00 11.07 ? 102 LYS B HG3 1 +ATOM 1551 H HD2 . LYS A 1 103 ? -12.450 9.487 30.597 1.00 12.62 ? 102 LYS B HD2 1 +ATOM 1552 H HD3 . LYS A 1 103 ? -10.892 9.576 30.301 1.00 12.62 ? 102 LYS B HD3 1 +ATOM 1553 H HE2 . LYS A 1 103 ? -10.899 11.827 30.652 1.00 14.56 ? 102 LYS B HE2 1 +ATOM 1554 H HE3 . LYS A 1 103 ? -12.489 11.841 30.767 1.00 14.56 ? 102 LYS B HE3 1 +ATOM 1555 H HZ1 . LYS A 1 103 ? -10.842 10.621 32.587 1.00 16.29 ? 102 LYS B HZ1 1 +ATOM 1556 H HZ2 . LYS A 1 103 ? -11.539 11.866 32.842 1.00 16.29 ? 102 LYS B HZ2 1 +ATOM 1557 H HZ3 . LYS A 1 103 ? -12.287 10.634 32.692 1.00 16.29 ? 102 LYS B HZ3 1 +ATOM 1558 N N . TYR A 1 104 ? -14.003 6.917 26.030 1.00 6.71 ? 103 TYR B N 1 +ATOM 1559 C CA . TYR A 1 104 ? -14.271 5.480 25.973 1.00 6.92 ? 103 TYR B CA 1 +ATOM 1560 C C . TYR A 1 104 ? -14.955 5.040 24.695 1.00 7.97 ? 103 TYR B C 1 +ATOM 1561 O O . TYR A 1 104 ? -15.632 5.827 24.049 1.00 8.65 ? 103 TYR B O 1 +ATOM 1562 C CB . TYR A 1 104 ? -15.144 5.077 27.165 1.00 8.16 ? 103 TYR B CB 1 +ATOM 1563 C CG . TYR A 1 104 ? -14.439 5.325 28.466 1.00 8.47 ? 103 TYR B CG 1 +ATOM 1564 C CD1 . TYR A 1 104 ? -13.350 4.556 28.843 1.00 9.80 ? 103 TYR B CD1 1 +ATOM 1565 C CD2 . TYR A 1 104 ? -14.847 6.341 29.321 1.00 10.27 ? 103 TYR B CD2 1 +ATOM 1566 C CE1 . TYR A 1 104 ? -12.699 4.784 30.049 1.00 13.46 ? 103 TYR B CE1 1 +ATOM 1567 C CE2 . TYR A 1 104 ? -14.189 6.583 30.505 1.00 11.56 ? 103 TYR B CE2 1 +ATOM 1568 C CZ . TYR A 1 104 ? -13.123 5.812 30.857 1.00 11.90 ? 103 TYR B CZ 1 +ATOM 1569 O OH . TYR A 1 104 ? -12.462 6.038 32.054 1.00 18.18 ? 103 TYR B OH 1 +ATOM 1570 H H . TYR A 1 104 ? -14.702 7.410 25.938 1.00 8.05 ? 103 TYR B H 1 +ATOM 1571 H HA . TYR A 1 104 ? -13.431 5.001 26.041 1.00 8.30 ? 103 TYR B HA 1 +ATOM 1572 H HB2 . TYR A 1 104 ? -15.961 5.601 27.156 1.00 9.79 ? 103 TYR B HB2 1 +ATOM 1573 H HB3 . TYR A 1 104 ? -15.351 4.131 27.106 1.00 9.79 ? 103 TYR B HB3 1 +ATOM 1574 H HD1 . TYR A 1 104 ? -13.061 3.867 28.289 1.00 11.76 ? 103 TYR B HD1 1 +ATOM 1575 H HD2 . TYR A 1 104 ? -15.569 6.876 29.083 1.00 12.33 ? 103 TYR B HD2 1 +ATOM 1576 H HE1 . TYR A 1 104 ? -11.966 4.266 30.293 1.00 16.15 ? 103 TYR B HE1 1 +ATOM 1577 H HE2 . TYR A 1 104 ? -14.475 7.266 31.067 1.00 13.88 ? 103 TYR B HE2 1 +ATOM 1578 H HH . TYR A 1 104 ? -12.811 6.688 32.456 1.00 21.82 ? 103 TYR B HH 1 +ATOM 1579 N N . GLY A 1 105 ? -14.792 3.766 24.361 1.00 8.08 ? 104 GLY B N 1 +ATOM 1580 C CA . GLY A 1 105 ? -15.529 3.145 23.273 1.00 8.99 ? 104 GLY B CA 1 +ATOM 1581 C C . GLY A 1 105 ? -15.019 3.416 21.868 1.00 7.20 ? 104 GLY B C 1 +ATOM 1582 O O . GLY A 1 105 ? -15.674 3.009 20.898 1.00 8.30 ? 104 GLY B O 1 +ATOM 1583 H H . GLY A 1 105 ? -14.248 3.232 24.758 1.00 9.70 ? 104 GLY B H 1 +ATOM 1584 H HA2 . GLY A 1 105 ? -15.525 2.184 23.406 1.00 10.79 ? 104 GLY B HA2 1 +ATOM 1585 H HA3 . GLY A 1 105 ? -16.451 3.445 23.313 1.00 10.79 ? 104 GLY B HA3 1 +ATOM 1586 N N . SER A 1 106 ? -13.859 4.055 21.726 1.00 6.68 ? 105 SER B N 1 +ATOM 1587 C CA . SER A 1 106 ? -13.467 4.598 20.428 1.00 8.04 ? 105 SER B CA 1 +ATOM 1588 C C . SER A 1 106 ? -13.137 3.557 19.387 1.00 6.61 ? 105 SER B C 1 +ATOM 1589 O O . SER A 1 106 ? -13.037 3.876 18.209 1.00 7.01 ? 105 SER B O 1 +ATOM 1590 C CB . SER A 1 106 ? -12.283 5.551 20.576 1.00 7.25 ? 105 SER B CB 1 +ATOM 1591 O OG . SER A 1 106 ? -11.134 4.879 21.081 1.00 7.96 ? 105 SER B OG 1 +ATOM 1592 H H . SER A 1 106 ? -13.289 4.186 22.357 1.00 8.02 ? 105 SER B H 1 +ATOM 1593 H HA . SER A 1 106 ? -14.210 5.118 20.084 1.00 9.65 ? 105 SER B HA 1 +ATOM 1594 H HB2 . SER A 1 106 ? -12.071 5.925 19.707 1.00 8.70 ? 105 SER B HB2 1 +ATOM 1595 H HB3 . SER A 1 106 ? -12.526 6.261 21.191 1.00 8.70 ? 105 SER B HB3 1 +ATOM 1596 H HG . SER A 1 106 ? -10.495 5.419 21.155 1.00 9.55 ? 105 SER B HG 1 +ATOM 1597 N N . SER A 1 107 ? -12.949 2.308 19.803 1.00 7.09 ? 106 SER B N 1 +ATOM 1598 C CA . SER A 1 107 ? -12.640 1.269 18.841 1.00 8.09 ? 106 SER B CA 1 +ATOM 1599 C C . SER A 1 107 ? -13.869 0.690 18.150 1.00 8.11 ? 106 SER B C 1 +ATOM 1600 O O . SER A 1 107 ? -13.725 -0.115 17.241 1.00 9.28 ? 106 SER B O 1 +ATOM 1601 C CB . SER A 1 107 ? -11.819 0.139 19.468 1.00 11.52 ? 106 SER B CB 1 +ATOM 1602 O OG . SER A 1 107 ? -12.618 -0.640 20.316 1.00 12.99 ? 106 SER B OG 1 +ATOM 1603 H H . SER A 1 107 ? -12.994 2.045 20.620 1.00 8.51 ? 106 SER B H 1 +ATOM 1604 H HA . SER A 1 107 ? -12.090 1.664 18.147 1.00 9.70 ? 106 SER B HA 1 +ATOM 1605 H HB2 . SER A 1 107 ? -11.464 -0.423 18.762 1.00 13.82 ? 106 SER B HB2 1 +ATOM 1606 H HB3 . SER A 1 107 ? -11.093 0.524 19.983 1.00 13.82 ? 106 SER B HB3 1 +ATOM 1607 H HG . SER A 1 107 ? -12.933 -0.164 20.932 1.00 15.59 ? 106 SER B HG 1 +ATOM 1608 N N . PHE A 1 108 ? -15.059 1.119 18.551 1.00 6.98 ? 107 PHE B N 1 +ATOM 1609 C CA . PHE A 1 108 ? -16.292 0.547 18.039 1.00 7.78 ? 107 PHE B CA 1 +ATOM 1610 C C . PHE A 1 108 ? -16.947 1.489 17.035 1.00 7.51 ? 107 PHE B C 1 +ATOM 1611 O O . PHE A 1 108 ? -17.258 2.647 17.345 1.00 9.09 ? 107 PHE B O 1 +ATOM 1612 C CB . PHE A 1 108 ? -17.229 0.203 19.177 1.00 9.91 ? 107 PHE B CB 1 +ATOM 1613 C CG . PHE A 1 108 ? -16.701 -0.900 20.031 1.00 11.78 ? 107 PHE B CG 1 +ATOM 1614 C CD1 . PHE A 1 108 ? -16.959 -2.221 19.702 1.00 15.66 ? 107 PHE B CD1 1 +ATOM 1615 C CD2 . PHE A 1 108 ? -15.887 -0.634 21.116 1.00 12.53 ? 107 PHE B CD2 1 +ATOM 1616 C CE1 . PHE A 1 108 ? -16.450 -3.254 20.477 1.00 24.84 ? 107 PHE B CE1 1 +ATOM 1617 C CE2 . PHE A 1 108 ? -15.371 -1.667 21.899 1.00 16.51 ? 107 PHE B CE2 1 +ATOM 1618 C CZ . PHE A 1 108 ? -15.653 -2.969 21.575 1.00 20.56 ? 107 PHE B CZ 1 +ATOM 1619 H H . PHE A 1 108 ? -15.178 1.747 19.126 1.00 8.38 ? 107 PHE B H 1 +ATOM 1620 H HA . PHE A 1 108 ? -16.081 -0.277 17.573 1.00 9.34 ? 107 PHE B HA 1 +ATOM 1621 H HB2 . PHE A 1 108 ? -17.350 0.986 19.736 1.00 11.89 ? 107 PHE B HB2 1 +ATOM 1622 H HB3 . PHE A 1 108 ? -18.082 -0.081 18.811 1.00 11.89 ? 107 PHE B HB3 1 +ATOM 1623 H HD1 . PHE A 1 108 ? -17.496 -2.417 18.969 1.00 18.79 ? 107 PHE B HD1 1 +ATOM 1624 H HD2 . PHE A 1 108 ? -15.697 0.249 21.339 1.00 15.04 ? 107 PHE B HD2 1 +ATOM 1625 H HE1 . PHE A 1 108 ? -16.641 -4.137 20.258 1.00 29.81 ? 107 PHE B HE1 1 +ATOM 1626 H HE2 . PHE A 1 108 ? -14.836 -1.474 22.635 1.00 19.81 ? 107 PHE B HE2 1 +ATOM 1627 H HZ . PHE A 1 108 ? -15.312 -3.662 22.093 1.00 24.67 ? 107 PHE B HZ 1 +ATOM 1628 N N . GLN A 1 109 ? -17.224 0.974 15.845 1.00 8.61 ? 108 GLN B N 1 +ATOM 1629 C CA . GLN A 1 109 ? -17.789 1.813 14.793 1.00 8.68 ? 108 GLN B CA 1 +ATOM 1630 C C . GLN A 1 109 ? -19.126 2.437 15.163 1.00 8.89 ? 108 GLN B C 1 +ATOM 1631 O O . GLN A 1 109 ? -19.422 3.544 14.725 1.00 9.32 ? 108 GLN B O 1 +ATOM 1632 C CB . GLN A 1 109 ? -17.855 1.101 13.442 1.00 15.21 ? 108 GLN B CB 1 +ATOM 1633 C CG . GLN A 1 109 ? -18.592 -0.172 13.362 1.00 17.32 ? 108 GLN B CG 1 +ATOM 1634 C CD . GLN A 1 109 ? -18.517 -0.760 11.932 1.00 24.30 ? 108 GLN B CD 1 +ATOM 1635 O OE1 . GLN A 1 109 ? -17.531 -0.561 11.198 1.00 20.48 ? 108 GLN B OE1 1 +ATOM 1636 N NE2 . GLN A 1 109 ? -19.569 -1.463 11.532 1.00 33.71 ? 108 GLN B NE2 1 +ATOM 1637 H H . GLN A 1 109 ? -17.097 0.153 15.621 1.00 10.33 ? 108 GLN B H 1 +ATOM 1638 H HA . GLN A 1 109 ? -17.178 2.556 14.670 1.00 10.41 ? 108 GLN B HA 1 +ATOM 1639 H HB2 . GLN A 1 109 ? -18.268 1.706 12.807 1.00 18.25 ? 108 GLN B HB2 1 +ATOM 1640 H HB3 . GLN A 1 109 ? -16.946 0.917 13.158 1.00 18.25 ? 108 GLN B HB3 1 +ATOM 1641 H HG2 . GLN A 1 109 ? -18.201 -0.811 13.977 1.00 20.78 ? 108 GLN B HG2 1 +ATOM 1642 H HG3 . GLN A 1 109 ? -19.525 -0.019 13.581 1.00 20.78 ? 108 GLN B HG3 1 +ATOM 1643 H HE21 . GLN A 1 109 ? -19.579 -1.812 10.746 1.00 40.46 ? 108 GLN B HE21 1 +ATOM 1644 H HE22 . GLN A 1 109 ? -20.241 -1.569 12.058 1.00 40.46 ? 108 GLN B HE22 1 +ATOM 1645 N N . ASP A 1 110 ? -19.916 1.762 15.985 1.00 8.35 ? 109 ASP B N 1 +ATOM 1646 C CA . ASP A 1 110 ? -21.216 2.299 16.364 1.00 10.16 ? 109 ASP B CA 1 +ATOM 1647 C C . ASP A 1 110 ? -21.102 3.554 17.222 1.00 11.78 ? 109 ASP B C 1 +ATOM 1648 O O . ASP A 1 110 ? -22.089 4.279 17.392 1.00 11.84 ? 109 ASP B O 1 +ATOM 1649 C CB . ASP A 1 110 ? -22.040 1.248 17.096 1.00 12.28 ? 109 ASP B CB 1 +ATOM 1650 C CG . ASP A 1 110 ? -22.530 0.145 16.184 1.00 13.82 ? 109 ASP B CG 1 +ATOM 1651 O OD1 . ASP A 1 110 ? -22.342 0.198 14.947 1.00 12.28 ? 109 ASP B OD1 1 +ATOM 1652 O OD2 . ASP A 1 110 ? -23.146 -0.786 16.741 1.00 16.78 -1 109 ASP B OD2 1 +ATOM 1653 H H . ASP A 1 110 ? -19.727 0.999 16.334 1.00 10.03 ? 109 ASP B H 1 +ATOM 1654 H HA . ASP A 1 110 ? -21.697 2.539 15.557 1.00 12.20 ? 109 ASP B HA 1 +ATOM 1655 H HB2 . ASP A 1 110 ? -21.494 0.843 17.788 1.00 14.73 ? 109 ASP B HB2 1 +ATOM 1656 H HB3 . ASP A 1 110 ? -22.815 1.675 17.493 1.00 14.73 ? 109 ASP B HB3 1 +ATOM 1657 N N . GLU A 1 111 ? -19.915 3.837 17.757 1.00 9.25 ? 110 GLU B N 1 +ATOM 1658 C CA . GLU A 1 111 ? -19.718 5.048 18.564 1.00 8.79 ? 110 GLU B CA 1 +ATOM 1659 C C . GLU A 1 111 ? -19.512 6.291 17.707 1.00 9.04 ? 110 GLU B C 1 +ATOM 1660 O O . GLU A 1 111 ? -19.295 7.387 18.242 1.00 10.48 ? 110 GLU B O 1 +ATOM 1661 C CB . GLU A 1 111 ? -18.509 4.852 19.474 1.00 10.10 ? 110 GLU B CB 1 +ATOM 1662 C CG . GLU A 1 111 ? -18.669 3.722 20.469 1.00 13.42 ? 110 GLU B CG 1 +ATOM 1663 C CD . GLU A 1 111 ? -19.873 3.846 21.363 1.00 15.22 ? 110 GLU B CD 1 +ATOM 1664 O OE1 . GLU A 1 111 ? -20.393 4.964 21.537 1.00 18.09 ? 110 GLU B OE1 1 +ATOM 1665 O OE2 . GLU A 1 111 ? -20.285 2.803 21.915 1.00 17.76 -1 110 GLU B OE2 1 +ATOM 1666 H H . GLU A 1 111 ? -19.211 3.350 17.671 1.00 11.10 ? 110 GLU B H 1 +ATOM 1667 H HA . GLU A 1 111 ? -20.499 5.190 19.122 1.00 10.55 ? 110 GLU B HA 1 +ATOM 1668 H HB2 . GLU A 1 111 ? -17.733 4.657 18.926 1.00 12.13 ? 110 GLU B HB2 1 +ATOM 1669 H HB3 . GLU A 1 111 ? -18.360 5.669 19.976 1.00 12.13 ? 110 GLU B HB3 1 +ATOM 1670 H HG2 . GLU A 1 111 ? -18.749 2.888 19.981 1.00 16.10 ? 110 GLU B HG2 1 +ATOM 1671 H HG3 . GLU A 1 111 ? -17.882 3.694 21.036 1.00 16.10 ? 110 GLU B HG3 1 +ATOM 1672 N N . TYR A 1 112 ? -19.574 6.129 16.393 1.00 9.00 ? 111 TYR B N 1 +ATOM 1673 C CA . TYR A 1 112 ? -19.352 7.237 15.489 1.00 8.45 ? 111 TYR B CA 1 +ATOM 1674 C C . TYR A 1 112 ? -20.631 7.585 14.758 1.00 9.80 ? 111 TYR B C 1 +ATOM 1675 O O . TYR A 1 112 ? -21.404 6.701 14.379 1.00 14.68 ? 111 TYR B O 1 +ATOM 1676 C CB . TYR A 1 112 ? -18.229 6.909 14.510 1.00 8.12 ? 111 TYR B CB 1 +ATOM 1677 C CG . TYR A 1 112 ? -16.905 6.710 15.198 1.00 7.31 ? 111 TYR B CG 1 +ATOM 1678 C CD1 . TYR A 1 112 ? -15.955 7.722 15.198 1.00 7.24 ? 111 TYR B CD1 1 +ATOM 1679 C CD2 . TYR A 1 112 ? -16.614 5.532 15.864 1.00 8.66 ? 111 TYR B CD2 1 +ATOM 1680 C CE1 . TYR A 1 112 ? -14.740 7.568 15.828 1.00 5.98 ? 111 TYR B CE1 1 +ATOM 1681 C CE2 . TYR A 1 112 ? -15.388 5.365 16.509 1.00 7.08 ? 111 TYR B CE2 1 +ATOM 1682 C CZ . TYR A 1 112 ? -14.457 6.386 16.463 1.00 6.74 ? 111 TYR B CZ 1 +ATOM 1683 O OH . TYR A 1 112 ? -13.234 6.258 17.068 1.00 6.65 ? 111 TYR B OH 1 +ATOM 1684 H H . TYR A 1 112 ? -19.743 5.382 16.002 1.00 10.81 ? 111 TYR B H 1 +ATOM 1685 H HA . TYR A 1 112 ? -19.082 8.014 16.004 1.00 10.14 ? 111 TYR B HA 1 +ATOM 1686 H HB2 . TYR A 1 112 ? -18.449 6.091 14.039 1.00 9.75 ? 111 TYR B HB2 1 +ATOM 1687 H HB3 . TYR A 1 112 ? -18.134 7.641 13.881 1.00 9.75 ? 111 TYR B HB3 1 +ATOM 1688 H HD1 . TYR A 1 112 ? -16.139 8.519 14.757 1.00 8.69 ? 111 TYR B HD1 1 +ATOM 1689 H HD2 . TYR A 1 112 ? -17.240 4.845 15.880 1.00 10.39 ? 111 TYR B HD2 1 +ATOM 1690 H HE1 . TYR A 1 112 ? -14.108 8.250 15.804 1.00 7.18 ? 111 TYR B HE1 1 +ATOM 1691 H HE2 . TYR A 1 112 ? -15.189 4.566 16.941 1.00 8.50 ? 111 TYR B HE2 1 +ATOM 1692 H HH . TYR A 1 112 ? -13.167 5.500 17.423 1.00 7.98 ? 111 TYR B HH 1 +ATOM 1693 N N . ASP A 1 113 ? -20.839 8.871 14.567 1.00 7.61 ? 112 ASP B N 1 +ATOM 1694 C CA . ASP A 1 113 ? -22.003 9.396 13.865 1.00 9.47 ? 112 ASP B CA 1 +ATOM 1695 C C . ASP A 1 113 ? -21.811 9.609 12.394 1.00 10.09 ? 112 ASP B C 1 +ATOM 1696 O O . ASP A 1 113 ? -22.754 9.411 11.606 1.00 11.13 ? 112 ASP B O 1 +ATOM 1697 C CB . ASP A 1 113 ? -22.372 10.755 14.438 1.00 11.24 ? 112 ASP B CB 1 +ATOM 1698 C CG . ASP A 1 113 ? -22.884 10.657 15.811 1.00 15.15 ? 112 ASP B CG 1 +ATOM 1699 O OD1 . ASP A 1 113 ? -23.806 9.840 16.029 1.00 20.06 ? 112 ASP B OD1 1 +ATOM 1700 O OD2 . ASP A 1 113 ? -22.357 11.379 16.665 1.00 14.50 -1 112 ASP B OD2 1 +ATOM 1701 H H . ASP A 1 113 ? -20.303 9.485 14.842 1.00 9.13 ? 112 ASP B H 1 +ATOM 1702 H HA . ASP A 1 113 ? -22.754 8.796 13.993 1.00 11.37 ? 112 ASP B HA 1 +ATOM 1703 H HB2 . ASP A 1 113 ? -21.583 11.320 14.450 1.00 13.49 ? 112 ASP B HB2 1 +ATOM 1704 H HB3 . ASP A 1 113 ? -23.061 11.156 13.886 1.00 13.49 ? 112 ASP B HB3 1 +ATOM 1705 N N . TYR A 1 114 ? -20.631 10.061 12.005 1.00 8.04 ? 113 TYR B N 1 +ATOM 1706 C CA . TYR A 1 114 ? -20.399 10.513 10.642 1.00 8.20 ? 113 TYR B CA 1 +ATOM 1707 C C . TYR A 1 114 ? -19.185 9.824 10.083 1.00 7.80 ? 113 TYR B C 1 +ATOM 1708 O O . TYR A 1 114 ? -18.208 9.608 10.810 1.00 8.11 ? 113 TYR B O 1 +ATOM 1709 C CB . TYR A 1 114 ? -20.163 12.020 10.601 1.00 9.18 ? 113 TYR B CB 1 +ATOM 1710 C CG . TYR A 1 114 ? -21.240 12.779 11.293 1.00 11.90 ? 113 TYR B CG 1 +ATOM 1711 C CD1 . TYR A 1 114 ? -22.539 12.716 10.834 1.00 12.20 ? 113 TYR B CD1 1 +ATOM 1712 C CD2 . TYR A 1 114 ? -20.973 13.538 12.431 1.00 12.66 ? 113 TYR B CD2 1 +ATOM 1713 C CE1 . TYR A 1 114 ? -23.571 13.403 11.497 1.00 15.16 ? 113 TYR B CE1 1 +ATOM 1714 C CE2 . TYR A 1 114 ? -21.978 14.218 13.091 1.00 13.68 ? 113 TYR B CE2 1 +ATOM 1715 C CZ . TYR A 1 114 ? -23.272 14.149 12.611 1.00 12.25 ? 113 TYR B CZ 1 +ATOM 1716 O OH . TYR A 1 114 ? -24.264 14.832 13.276 1.00 13.69 ? 113 TYR B OH 1 +ATOM 1717 H H . TYR A 1 114 ? -19.941 10.117 12.515 1.00 9.65 ? 113 TYR B H 1 +ATOM 1718 H HA . TYR A 1 114 ? -21.166 10.299 10.088 1.00 9.83 ? 113 TYR B HA 1 +ATOM 1719 H HB2 . TYR A 1 114 ? -19.322 12.222 11.041 1.00 11.01 ? 113 TYR B HB2 1 +ATOM 1720 H HB3 . TYR A 1 114 ? -20.134 12.312 9.677 1.00 11.01 ? 113 TYR B HB3 1 +ATOM 1721 H HD1 . TYR A 1 114 ? -22.736 12.208 10.080 1.00 14.64 ? 113 TYR B HD1 1 +ATOM 1722 H HD2 . TYR A 1 114 ? -20.103 13.583 12.756 1.00 15.20 ? 113 TYR B HD2 1 +ATOM 1723 H HE1 . TYR A 1 114 ? -24.444 13.361 11.179 1.00 18.20 ? 113 TYR B HE1 1 +ATOM 1724 H HE2 . TYR A 1 114 ? -21.784 14.724 13.846 1.00 16.42 ? 113 TYR B HE2 1 +ATOM 1725 H HH . TYR A 1 114 ? -25.003 14.708 12.897 1.00 16.43 ? 113 TYR B HH 1 +ATOM 1726 N N . TRP A 1 115 ? -19.226 9.540 8.783 1.00 8.03 ? 114 TRP B N 1 +ATOM 1727 C CA . TRP A 1 115 ? -18.222 8.766 8.081 1.00 8.61 ? 114 TRP B CA 1 +ATOM 1728 C C . TRP A 1 115 ? -17.825 9.466 6.803 1.00 8.91 ? 114 TRP B C 1 +ATOM 1729 O O . TRP A 1 115 ? -18.683 9.979 6.073 1.00 9.60 ? 114 TRP B O 1 +ATOM 1730 C CB . TRP A 1 115 ? -18.770 7.373 7.740 1.00 9.33 ? 114 TRP B CB 1 +ATOM 1731 C CG . TRP A 1 115 ? -18.977 6.581 8.954 1.00 9.13 ? 114 TRP B CG 1 +ATOM 1732 C CD1 . TRP A 1 115 ? -20.058 6.587 9.777 1.00 9.06 ? 114 TRP B CD1 1 +ATOM 1733 C CD2 . TRP A 1 115 ? -18.033 5.686 9.537 1.00 8.13 ? 114 TRP B CD2 1 +ATOM 1734 N NE1 . TRP A 1 115 ? -19.842 5.756 10.849 1.00 9.38 ? 114 TRP B NE1 1 +ATOM 1735 C CE2 . TRP A 1 115 ? -18.597 5.200 10.728 1.00 8.23 ? 114 TRP B CE2 1 +ATOM 1736 C CE3 . TRP A 1 115 ? -16.744 5.280 9.189 1.00 8.63 ? 114 TRP B CE3 1 +ATOM 1737 C CZ2 . TRP A 1 115 ? -17.942 4.287 11.545 1.00 10.47 ? 114 TRP B CZ2 1 +ATOM 1738 C CZ3 . TRP A 1 115 ? -16.095 4.384 9.998 1.00 9.35 ? 114 TRP B CZ3 1 +ATOM 1739 C CH2 . TRP A 1 115 ? -16.687 3.898 11.166 1.00 9.78 ? 114 TRP B CH2 1 +ATOM 1740 H H . TRP A 1 115 ? -19.862 9.802 8.268 1.00 9.63 ? 114 TRP B H 1 +ATOM 1741 H HA . TRP A 1 115 ? -17.435 8.665 8.640 1.00 10.33 ? 114 TRP B HA 1 +ATOM 1742 H HB2 . TRP A 1 115 ? -19.623 7.465 7.286 1.00 11.20 ? 114 TRP B HB2 1 +ATOM 1743 H HB3 . TRP A 1 115 ? -18.135 6.906 7.175 1.00 11.20 ? 114 TRP B HB3 1 +ATOM 1744 H HD1 . TRP A 1 115 ? -20.825 7.095 9.644 1.00 10.88 ? 114 TRP B HD1 1 +ATOM 1745 H HE1 . TRP A 1 115 ? -20.399 5.603 11.485 1.00 11.26 ? 114 TRP B HE1 1 +ATOM 1746 H HE3 . TRP A 1 115 ? -16.337 5.605 8.418 1.00 10.36 ? 114 TRP B HE3 1 +ATOM 1747 H HZ2 . TRP A 1 115 ? -18.338 3.957 12.319 1.00 12.56 ? 114 TRP B HZ2 1 +ATOM 1748 H HZ3 . TRP A 1 115 ? -15.239 4.101 9.769 1.00 11.22 ? 114 TRP B HZ3 1 +ATOM 1749 H HH2 . TRP A 1 115 ? -16.223 3.287 11.691 1.00 11.74 ? 114 TRP B HH2 1 +ATOM 1750 N N . GLY A 1 116 ? -16.538 9.462 6.494 1.00 7.76 ? 115 GLY B N 1 +ATOM 1751 C CA . GLY A 1 116 ? -16.083 9.817 5.162 1.00 9.80 ? 115 GLY B CA 1 +ATOM 1752 C C . GLY A 1 116 ? -16.348 8.701 4.163 1.00 8.30 ? 115 GLY B C 1 +ATOM 1753 O O . GLY A 1 116 ? -16.734 7.581 4.507 1.00 10.07 ? 115 GLY B O 1 +ATOM 1754 H H . GLY A 1 116 ? -15.906 9.257 7.040 1.00 9.32 ? 115 GLY B H 1 +ATOM 1755 H HA2 . GLY A 1 116 ? -16.543 10.616 4.862 1.00 11.76 ? 115 GLY B HA2 1 +ATOM 1756 H HA3 . GLY A 1 116 ? -15.130 9.996 5.180 1.00 11.76 ? 115 GLY B HA3 1 +ATOM 1757 N N . GLN A 1 117 ? -16.117 9.029 2.895 1.00 9.76 ? 116 GLN B N 1 +ATOM 1758 C CA . GLN A 1 117 ? -16.295 8.080 1.809 1.00 10.14 ? 116 GLN B CA 1 +ATOM 1759 C C . GLN A 1 117 ? -15.140 7.109 1.709 1.00 10.36 ? 116 GLN B C 1 +ATOM 1760 O O . GLN A 1 117 ? -15.261 6.077 1.056 1.00 13.68 ? 116 GLN B O 1 +ATOM 1761 C CB . GLN A 1 117 ? -16.461 8.807 0.471 1.00 13.55 ? 116 GLN B CB 1 +ATOM 1762 C CG . GLN A 1 117 ? -17.717 9.672 0.371 1.00 16.97 ? 116 GLN B CG 1 +ATOM 1763 C CD . GLN A 1 117 ? -18.988 8.820 0.482 1.00 26.20 ? 116 GLN B CD 1 +ATOM 1764 O OE1 . GLN A 1 117 ? -19.240 7.940 -0.351 1.00 38.29 ? 116 GLN B OE1 1 +ATOM 1765 N NE2 . GLN A 1 117 ? -19.760 9.046 1.542 1.00 29.94 ? 116 GLN B NE2 1 +ATOM 1766 H H . GLN A 1 117 ? -15.852 9.806 2.637 1.00 11.71 ? 116 GLN B H 1 +ATOM 1767 H HA . GLN A 1 117 ? -17.102 7.567 1.971 1.00 12.16 ? 116 GLN B HA 1 +ATOM 1768 H HB2 . GLN A 1 117 ? -15.694 9.385 0.335 1.00 16.26 ? 116 GLN B HB2 1 +ATOM 1769 H HB3 . GLN A 1 117 ? -16.502 8.147 -0.238 1.00 16.26 ? 116 GLN B HB3 1 +ATOM 1770 H HG2 . GLN A 1 117 ? -17.719 10.319 1.094 1.00 20.36 ? 116 GLN B HG2 1 +ATOM 1771 H HG3 . GLN A 1 117 ? -17.727 10.125 -0.487 1.00 20.36 ? 116 GLN B HG3 1 +ATOM 1772 H HE21 . GLN A 1 117 ? -19.535 9.643 2.119 1.00 35.93 ? 116 GLN B HE21 1 +ATOM 1773 H HE22 . GLN A 1 117 ? -20.484 8.595 1.651 1.00 35.93 ? 116 GLN B HE22 1 +ATOM 1774 N N . GLY A 1 118 ? -14.015 7.442 2.329 1.00 9.65 ? 117 GLY B N 1 +ATOM 1775 C CA . GLY A 1 118 ? -12.846 6.575 2.348 1.00 10.51 ? 117 GLY B CA 1 +ATOM 1776 C C . GLY A 1 118 ? -11.830 6.861 1.259 1.00 11.88 ? 117 GLY B C 1 +ATOM 1777 O O . GLY A 1 118 ? -12.193 7.323 0.170 1.00 13.27 ? 117 GLY B O 1 +ATOM 1778 H H . GLY A 1 118 ? -13.902 8.181 2.754 1.00 11.58 ? 117 GLY B H 1 +ATOM 1779 H HA2 . GLY A 1 118 ? -12.400 6.665 3.204 1.00 12.61 ? 117 GLY B HA2 1 +ATOM 1780 H HA3 . GLY A 1 118 ? -13.135 5.654 2.254 1.00 12.61 ? 117 GLY B HA3 1 +ATOM 1781 N N . THR A 1 119 ? -10.564 6.555 1.536 1.00 10.04 ? 118 THR B N 1 +ATOM 1782 C CA . THR A 1 119 ? -9.474 6.732 0.573 1.00 12.50 ? 118 THR B CA 1 +ATOM 1783 C C . THR A 1 119 ? -8.680 5.433 0.485 1.00 9.53 ? 118 THR B C 1 +ATOM 1784 O O . THR A 1 119 ? -8.357 4.801 1.503 1.00 10.58 ? 118 THR B O 1 +ATOM 1785 C CB . THR A 1 119 ? -8.559 7.934 0.952 1.00 12.60 ? 118 THR B CB 1 +ATOM 1786 O OG1 . THR A 1 119 ? -7.578 8.155 -0.080 1.00 17.00 ? 118 THR B OG1 1 +ATOM 1787 C CG2 . THR A 1 119 ? -7.841 7.706 2.247 1.00 13.43 ? 118 THR B CG2 1 +ATOM 1788 H H . THR A 1 119 ? -10.304 6.236 2.291 1.00 12.05 ? 118 THR B H 1 +ATOM 1789 H HA . THR A 1 119 ? -9.853 6.910 -0.302 1.00 15.01 ? 118 THR B HA 1 +ATOM 1790 H HB . THR A 1 119 ? -9.104 8.730 1.047 1.00 15.12 ? 118 THR B HB 1 +ATOM 1791 H HG1 . THR A 1 119 ? -7.085 8.803 0.126 1.00 20.40 ? 118 THR B HG1 1 +ATOM 1792 H HG21 . THR A 1 119 ? -7.280 8.470 2.454 1.00 16.12 ? 118 THR B HG21 1 +ATOM 1793 H HG22 . THR A 1 119 ? -8.482 7.582 2.964 1.00 16.12 ? 118 THR B HG22 1 +ATOM 1794 H HG23 . THR A 1 119 ? -7.283 6.915 2.181 1.00 16.12 ? 118 THR B HG23 1 +ATOM 1795 N N . GLN A 1 120 ? -8.357 5.034 -0.743 1.00 9.83 ? 119 GLN B N 1 +ATOM 1796 C CA . GLN A 1 120 ? -7.638 3.797 -0.960 1.00 9.36 ? 119 GLN B CA 1 +ATOM 1797 C C . GLN A 1 120 ? -6.165 3.959 -0.621 1.00 9.22 ? 119 GLN B C 1 +ATOM 1798 O O . GLN A 1 120 ? -5.517 4.924 -1.027 1.00 10.70 ? 119 GLN B O 1 +ATOM 1799 C CB . GLN A 1 120 ? -7.766 3.350 -2.414 1.00 10.43 ? 119 GLN B CB 1 +ATOM 1800 C CG . GLN A 1 120 ? -7.046 2.033 -2.737 1.00 11.37 ? 119 GLN B CG 1 +ATOM 1801 C CD . GLN A 1 120 ? -7.728 0.833 -2.122 1.00 12.79 ? 119 GLN B CD 1 +ATOM 1802 O OE1 . GLN A 1 120 ? -8.938 0.663 -2.239 1.00 16.86 ? 119 GLN B OE1 1 +ATOM 1803 N NE2 . GLN A 1 120 ? -6.958 -0.014 -1.466 1.00 14.55 ? 119 GLN B NE2 1 +ATOM 1804 H H . GLN A 1 120 ? -8.545 5.466 -1.462 1.00 11.79 ? 119 GLN B H 1 +ATOM 1805 H HA . GLN A 1 120 ? -8.009 3.104 -0.392 1.00 11.23 ? 119 GLN B HA 1 +ATOM 1806 H HB2 . GLN A 1 120 ? -8.706 3.231 -2.620 1.00 12.51 ? 119 GLN B HB2 1 +ATOM 1807 H HB3 . GLN A 1 120 ? -7.390 4.038 -2.985 1.00 12.51 ? 119 GLN B HB3 1 +ATOM 1808 H HG2 . GLN A 1 120 ? -7.031 1.909 -3.699 1.00 13.64 ? 119 GLN B HG2 1 +ATOM 1809 H HG3 . GLN A 1 120 ? -6.141 2.073 -2.393 1.00 13.64 ? 119 GLN B HG3 1 +ATOM 1810 H HE21 . GLN A 1 120 ? -6.113 0.132 -1.406 1.00 17.47 ? 119 GLN B HE21 1 +ATOM 1811 H HE22 . GLN A 1 120 ? -7.302 -0.711 -1.099 1.00 17.47 ? 119 GLN B HE22 1 +ATOM 1812 N N . VAL A 1 121 ? -5.649 2.993 0.126 1.00 8.79 ? 120 VAL B N 1 +ATOM 1813 C CA . VAL A 1 121 ? -4.225 2.847 0.369 1.00 10.20 ? 120 VAL B CA 1 +ATOM 1814 C C . VAL A 1 121 ? -3.797 1.472 -0.134 1.00 10.15 ? 120 VAL B C 1 +ATOM 1815 O O . VAL A 1 121 ? -4.373 0.470 0.249 1.00 10.33 ? 120 VAL B O 1 +ATOM 1816 C CB . VAL A 1 121 ? -3.901 2.986 1.869 1.00 10.52 ? 120 VAL B CB 1 +ATOM 1817 C CG1 . VAL A 1 121 ? -2.442 2.660 2.141 1.00 14.06 ? 120 VAL B CG1 1 +ATOM 1818 C CG2 . VAL A 1 121 ? -4.216 4.394 2.330 1.00 11.51 ? 120 VAL B CG2 1 +ATOM 1819 H H . VAL A 1 121 ? -6.123 2.390 0.516 1.00 10.55 ? 120 VAL B H 1 +ATOM 1820 H HA . VAL A 1 121 ? -3.737 3.527 -0.122 1.00 12.24 ? 120 VAL B HA 1 +ATOM 1821 H HB . VAL A 1 121 ? -4.452 2.369 2.375 1.00 12.63 ? 120 VAL B HB 1 +ATOM 1822 H HG11 . VAL A 1 121 ? -2.270 2.756 3.091 1.00 16.88 ? 120 VAL B HG11 1 +ATOM 1823 H HG12 . VAL A 1 121 ? -2.266 1.747 1.863 1.00 16.88 ? 120 VAL B HG12 1 +ATOM 1824 H HG13 . VAL A 1 121 ? -1.883 3.273 1.639 1.00 16.88 ? 120 VAL B HG13 1 +ATOM 1825 H HG21 . VAL A 1 121 ? -4.009 4.470 3.274 1.00 13.81 ? 120 VAL B HG21 1 +ATOM 1826 H HG22 . VAL A 1 121 ? -3.678 5.020 1.821 1.00 13.81 ? 120 VAL B HG22 1 +ATOM 1827 H HG23 . VAL A 1 121 ? -5.158 4.571 2.183 1.00 13.81 ? 120 VAL B HG23 1 +ATOM 1828 N N . THR A 1 122 ? -2.792 1.450 -0.999 1.00 10.89 ? 121 THR B N 1 +ATOM 1829 C CA . THR A 1 122 ? -2.272 0.196 -1.512 1.00 11.30 ? 121 THR B CA 1 +ATOM 1830 C C . THR A 1 122 ? -0.789 0.140 -1.242 1.00 10.49 ? 121 THR B C 1 +ATOM 1831 O O . THR A 1 122 ? -0.049 1.039 -1.617 1.00 13.30 ? 121 THR B O 1 +ATOM 1832 C CB . THR A 1 122 ? -2.563 0.047 -3.009 1.00 12.92 ? 121 THR B CB 1 +ATOM 1833 O OG1 . THR A 1 122 ? -3.985 0.026 -3.183 1.00 15.68 ? 121 THR B OG1 1 +ATOM 1834 C CG2 . THR A 1 122 ? -1.942 -1.241 -3.570 1.00 15.96 ? 121 THR B CG2 1 +ATOM 1835 H H . THR A 1 122 ? -2.395 2.149 -1.304 1.00 13.07 ? 121 THR B H 1 +ATOM 1836 H HA . THR A 1 122 ? -2.694 -0.541 -1.045 1.00 13.56 ? 121 THR B HA 1 +ATOM 1837 H HB . THR A 1 122 ? -2.190 0.803 -3.488 1.00 15.50 ? 121 THR B HB 1 +ATOM 1838 H HG1 . THR A 1 122 ? -4.173 -0.056 -3.998 1.00 18.81 ? 121 THR B HG1 1 +ATOM 1839 H HG21 . THR A 1 122 ? -2.137 -1.317 -4.518 1.00 19.15 ? 121 THR B HG21 1 +ATOM 1840 H HG22 . THR A 1 122 ? -0.980 -1.226 -3.447 1.00 19.15 ? 121 THR B HG22 1 +ATOM 1841 H HG23 . THR A 1 122 ? -2.307 -2.013 -3.110 1.00 19.15 ? 121 THR B HG23 1 +ATOM 1842 N N . VAL A 1 123 ? -0.392 -0.930 -0.563 1.00 12.88 ? 122 VAL B N 1 +ATOM 1843 C CA . VAL A 1 123 ? 0.994 -1.159 -0.206 1.00 12.18 ? 122 VAL B CA 1 +ATOM 1844 C C . VAL A 1 123 ? 1.503 -2.336 -1.015 1.00 15.32 ? 122 VAL B C 1 +ATOM 1845 O O . VAL A 1 123 ? 1.061 -3.462 -0.808 1.00 15.68 ? 122 VAL B O 1 +ATOM 1846 C CB . VAL A 1 123 ? 1.141 -1.482 1.293 1.00 12.07 ? 122 VAL B CB 1 +ATOM 1847 C CG1 . VAL A 1 123 ? 2.611 -1.653 1.645 1.00 14.28 ? 122 VAL B CG1 1 +ATOM 1848 C CG2 . VAL A 1 123 ? 0.519 -0.389 2.149 1.00 10.52 ? 122 VAL B CG2 1 +ATOM 1849 H H . VAL A 1 123 ? -0.924 -1.550 -0.293 1.00 15.46 ? 122 VAL B H 1 +ATOM 1850 H HA . VAL A 1 123 ? 1.526 -0.376 -0.416 1.00 14.61 ? 122 VAL B HA 1 +ATOM 1851 H HB . VAL A 1 123 ? 0.684 -2.315 1.486 1.00 14.48 ? 122 VAL B HB 1 +ATOM 1852 H HG11 . VAL A 1 123 ? 2.687 -1.856 2.591 1.00 17.14 ? 122 VAL B HG11 1 +ATOM 1853 H HG12 . VAL A 1 123 ? 2.978 -2.381 1.120 1.00 17.14 ? 122 VAL B HG12 1 +ATOM 1854 H HG13 . VAL A 1 123 ? 3.081 -0.829 1.444 1.00 17.14 ? 122 VAL B HG13 1 +ATOM 1855 H HG21 . VAL A 1 123 ? 0.629 -0.622 3.085 1.00 12.62 ? 122 VAL B HG21 1 +ATOM 1856 H HG22 . VAL A 1 123 ? 0.967 0.451 1.962 1.00 12.62 ? 122 VAL B HG22 1 +ATOM 1857 H HG23 . VAL A 1 123 ? -0.424 -0.318 1.933 1.00 12.62 ? 122 VAL B HG23 1 +ATOM 1858 N N . SER A 1 124 ? 2.430 -2.060 -1.922 1.00 17.89 ? 123 SER B N 1 +ATOM 1859 C CA . SER A 1 124 ? 2.936 -3.081 -2.842 1.00 19.62 ? 123 SER B CA 1 +ATOM 1860 C C . SER A 1 124 ? 4.285 -3.634 -2.406 1.00 26.31 ? 123 SER B C 1 +ATOM 1861 O O . SER A 1 124 ? 4.998 -3.012 -1.623 1.00 24.13 ? 123 SER B O 1 +ATOM 1862 C CB . SER A 1 124 ? 3.072 -2.496 -4.242 1.00 28.47 ? 123 SER B CB 1 +ATOM 1863 O OG . SER A 1 124 ? 3.681 -3.433 -5.114 1.00 43.15 ? 123 SER B OG 1 +ATOM 1864 H H . SER A 1 124 ? 2.787 -1.285 -2.029 1.00 21.47 ? 123 SER B H 1 +ATOM 1865 H HA . SER A 1 124 ? 2.305 -3.816 -2.880 1.00 23.55 ? 123 SER B HA 1 +ATOM 1866 H HB2 . SER A 1 124 ? 2.190 -2.275 -4.581 1.00 34.16 ? 123 SER B HB2 1 +ATOM 1867 H HB3 . SER A 1 124 ? 3.621 -1.698 -4.201 1.00 34.16 ? 123 SER B HB3 1 +ATOM 1868 H HG . SER A 1 124 ? 3.753 -3.105 -5.884 1.00 51.77 ? 123 SER B HG 1 +ATOM 1869 N N . SER A 1 125 ? 4.631 -4.811 -2.920 1.00 35.74 ? 124 SER B N 1 +ATOM 1870 C CA . SER A 1 125 ? 5.965 -5.372 -2.724 1.00 37.86 ? 124 SER B CA 1 +ATOM 1871 C C . SER A 1 125 ? 6.429 -6.104 -3.978 1.00 43.37 ? 124 SER B C 1 +ATOM 1872 O O . SER A 1 125 ? 7.457 -6.782 -3.966 1.00 54.30 ? 124 SER B O 1 +ATOM 1873 C CB . SER A 1 125 ? 5.987 -6.327 -1.532 1.00 41.42 ? 124 SER B CB 1 +ATOM 1874 O OG . SER A 1 125 ? 7.315 -6.737 -1.246 1.00 53.21 ? 124 SER B OG 1 +ATOM 1875 H H . SER A 1 125 ? 4.108 -5.307 -3.389 1.00 42.88 ? 124 SER B H 1 +ATOM 1876 H HA . SER A 1 125 ? 6.590 -4.652 -2.546 1.00 45.44 ? 124 SER B HA 1 +ATOM 1877 H HB2 . SER A 1 125 ? 5.622 -5.873 -0.756 1.00 49.71 ? 124 SER B HB2 1 +ATOM 1878 H HB3 . SER A 1 125 ? 5.452 -7.108 -1.742 1.00 49.71 ? 124 SER B HB3 1 +ATOM 1879 H HG . SER A 1 125 ? 7.643 -7.131 -1.912 1.00 63.85 ? 124 SER B HG 1 +ATOM 1880 N N . HIS B 2 8 ? -23.902 -4.086 25.456 1.00 17.34 ? 0 HIS A N 1 +ATOM 1881 C CA . HIS B 2 8 ? -24.201 -3.096 26.526 1.00 14.20 ? 0 HIS A CA 1 +ATOM 1882 C C . HIS B 2 8 ? -25.248 -2.099 26.011 1.00 14.51 ? 0 HIS A C 1 +ATOM 1883 O O . HIS B 2 8 ? -25.450 -1.979 24.796 1.00 14.36 ? 0 HIS A O 1 +ATOM 1884 C CB . HIS B 2 8 ? -22.926 -2.346 26.899 1.00 17.17 ? 0 HIS A CB 1 +ATOM 1885 C CG . HIS B 2 8 ? -22.367 -1.553 25.761 1.00 16.30 ? 0 HIS A CG 1 +ATOM 1886 N ND1 . HIS B 2 8 ? -21.399 -2.048 24.913 1.00 20.65 ? 0 HIS A ND1 1 +ATOM 1887 C CD2 . HIS B 2 8 ? -22.685 -0.323 25.295 1.00 15.97 ? 0 HIS A CD2 1 +ATOM 1888 C CE1 . HIS B 2 8 ? -21.127 -1.144 23.987 1.00 19.17 ? 0 HIS A CE1 1 +ATOM 1889 N NE2 . HIS B 2 8 ? -21.893 -0.089 24.195 1.00 16.10 ? 0 HIS A NE2 1 +ATOM 1890 H H . HIS B 2 8 ? -23.142 -4.508 25.647 1.00 20.80 ? 0 HIS A H 1 +ATOM 1891 H HA . HIS B 2 8 ? -24.549 -3.546 27.311 1.00 17.04 ? 0 HIS A HA 1 +ATOM 1892 H HB2 . HIS B 2 8 ? -23.122 -1.732 27.624 1.00 20.61 ? 0 HIS A HB2 1 +ATOM 1893 H HB3 . HIS B 2 8 ? -22.253 -2.986 27.178 1.00 20.61 ? 0 HIS A HB3 1 +ATOM 1894 H HD2 . HIS B 2 8 ? -23.314 0.259 25.656 1.00 19.17 ? 0 HIS A HD2 1 +ATOM 1895 H HE1 . HIS B 2 8 ? -20.500 -1.235 23.306 1.00 23.00 ? 0 HIS A HE1 1 +ATOM 1896 H HE2 . HIS B 2 8 ? -21.893 0.630 23.723 1.00 19.32 ? 0 HIS A HE2 1 +ATOM 1897 N N . PRO B 2 9 ? -25.907 -1.364 26.922 1.00 13.23 ? 1 PRO A N 1 +ATOM 1898 C CA . PRO B 2 9 ? -26.909 -0.362 26.522 1.00 15.14 ? 1 PRO A CA 1 +ATOM 1899 C C . PRO B 2 9 ? -26.273 0.828 25.807 1.00 13.31 ? 1 PRO A C 1 +ATOM 1900 O O . PRO B 2 9 ? -25.195 1.273 26.194 1.00 15.52 ? 1 PRO A O 1 +ATOM 1901 C CB . PRO B 2 9 ? -27.472 0.126 27.852 1.00 12.76 ? 1 PRO A CB 1 +ATOM 1902 C CG . PRO B 2 9 ? -27.092 -0.922 28.846 1.00 14.52 ? 1 PRO A CG 1 +ATOM 1903 C CD . PRO B 2 9 ? -25.777 -1.446 28.384 1.00 16.02 ? 1 PRO A CD 1 +ATOM 1904 H HA . PRO B 2 9 ? -27.610 -0.754 25.979 1.00 18.16 ? 1 PRO A HA 1 +ATOM 1905 H HB2 . PRO B 2 9 ? -27.071 0.979 28.083 1.00 15.31 ? 1 PRO A HB2 1 +ATOM 1906 H HB3 . PRO B 2 9 ? -28.436 0.205 27.788 1.00 15.31 ? 1 PRO A HB3 1 +ATOM 1907 H HG2 . PRO B 2 9 ? -27.012 -0.523 29.726 1.00 17.43 ? 1 PRO A HG2 1 +ATOM 1908 H HG3 . PRO B 2 9 ? -27.759 -1.626 28.848 1.00 17.43 ? 1 PRO A HG3 1 +ATOM 1909 H HD2 . PRO B 2 9 ? -25.055 -0.878 28.695 1.00 19.22 ? 1 PRO A HD2 1 +ATOM 1910 H HD3 . PRO B 2 9 ? -25.659 -2.367 28.666 1.00 19.22 ? 1 PRO A HD3 1 +ATOM 1911 N N . THR B 2 10 ? -26.929 1.361 24.791 1.00 14.39 ? 2 THR A N 1 +ATOM 1912 C CA . THR B 2 10 ? -26.470 2.602 24.168 1.00 12.88 ? 2 THR A CA 1 +ATOM 1913 C C . THR B 2 10 ? -26.744 3.783 25.123 1.00 10.60 ? 2 THR A C 1 +ATOM 1914 O O . THR B 2 10 ? -27.864 3.906 25.603 1.00 10.08 ? 2 THR A O 1 +ATOM 1915 C CB . THR B 2 10 ? -27.218 2.813 22.832 1.00 12.55 ? 2 THR A CB 1 +ATOM 1916 O OG1 . THR B 2 10 ? -26.957 1.714 21.941 1.00 15.75 ? 2 THR A OG1 1 +ATOM 1917 C CG2 . THR B 2 10 ? -26.789 4.109 22.163 1.00 13.97 ? 2 THR A CG2 1 +ATOM 1918 H H . THR B 2 10 ? -27.641 1.029 24.441 1.00 17.27 ? 2 THR A H 1 +ATOM 1919 H HA . THR B 2 10 ? -25.518 2.552 23.993 1.00 15.46 ? 2 THR A HA 1 +ATOM 1920 H HB . THR B 2 10 ? -28.172 2.863 23.005 1.00 15.07 ? 2 THR A HB 1 +ATOM 1921 H HG1 . THR B 2 10 ? -27.364 1.830 21.216 1.00 18.90 ? 2 THR A HG1 1 +ATOM 1922 H HG21 . THR B 2 10 ? -27.268 4.225 21.327 1.00 16.77 ? 2 THR A HG21 1 +ATOM 1923 H HG22 . THR B 2 10 ? -26.983 4.862 22.744 1.00 16.77 ? 2 THR A HG22 1 +ATOM 1924 H HG23 . THR B 2 10 ? -25.837 4.088 21.981 1.00 16.77 ? 2 THR A HG23 1 +ATOM 1925 N N . LEU B 2 11 ? -25.763 4.654 25.360 1.00 10.53 ? 3 LEU A N 1 +ATOM 1926 C CA . LEU B 2 11 ? -26.008 5.923 26.066 1.00 8.50 ? 3 LEU A CA 1 +ATOM 1927 C C . LEU B 2 11 ? -26.565 6.913 25.075 1.00 7.75 ? 3 LEU A C 1 +ATOM 1928 O O . LEU B 2 11 ? -25.858 7.309 24.135 1.00 9.11 ? 3 LEU A O 1 +ATOM 1929 C CB . LEU B 2 11 ? -24.714 6.510 26.616 1.00 13.44 ? 3 LEU A CB 1 +ATOM 1930 C CG . LEU B 2 11 ? -24.121 6.019 27.922 1.00 14.11 ? 3 LEU A CG 1 +ATOM 1931 C CD1 . LEU B 2 11 ? -23.064 6.995 28.365 1.00 12.77 ? 3 LEU A CD1 1 +ATOM 1932 C CD2 . LEU B 2 11 ? -25.145 5.868 29.023 1.00 11.54 ? 3 LEU A CD2 1 +ATOM 1933 H H . LEU B 2 11 ? -24.944 4.538 25.124 1.00 12.64 ? 3 LEU A H 1 +ATOM 1934 H HA . LEU B 2 11 ? -26.641 5.795 26.790 1.00 10.20 ? 3 LEU A HA 1 +ATOM 1935 H HB2 . LEU B 2 11 ? -24.030 6.376 25.941 1.00 16.13 ? 3 LEU A HB2 1 +ATOM 1936 H HB3 . LEU B 2 11 ? -24.856 7.463 26.725 1.00 16.13 ? 3 LEU A HB3 1 +ATOM 1937 H HG . LEU B 2 11 ? -23.699 5.157 27.778 1.00 16.93 ? 3 LEU A HG 1 +ATOM 1938 H HD11 . LEU B 2 11 ? -22.680 6.687 29.201 1.00 15.32 ? 3 LEU A HD11 1 +ATOM 1939 H HD12 . LEU B 2 11 ? -22.376 7.046 27.683 1.00 15.32 ? 3 LEU A HD12 1 +ATOM 1940 H HD13 . LEU B 2 11 ? -23.471 7.867 28.489 1.00 15.32 ? 3 LEU A HD13 1 +ATOM 1941 H HD21 . LEU B 2 11 ? -24.701 5.553 29.826 1.00 13.85 ? 3 LEU A HD21 1 +ATOM 1942 H HD22 . LEU B 2 11 ? -25.558 6.730 29.190 1.00 13.85 ? 3 LEU A HD22 1 +ATOM 1943 H HD23 . LEU B 2 11 ? -25.818 5.228 28.743 1.00 13.85 ? 3 LEU A HD23 1 +ATOM 1944 N N . LYS B 2 12 ? -27.802 7.334 25.304 1.00 6.82 ? 4 LYS A N 1 +ATOM 1945 C CA . LYS B 2 12 ? -28.523 8.200 24.376 1.00 6.30 ? 4 LYS A CA 1 +ATOM 1946 C C . LYS B 2 12 ? -28.594 9.616 24.933 1.00 6.11 ? 4 LYS A C 1 +ATOM 1947 O O . LYS B 2 12 ? -29.091 9.868 26.039 1.00 6.31 ? 4 LYS A O 1 +ATOM 1948 C CB . LYS B 2 12 ? -29.904 7.626 24.096 1.00 7.36 ? 4 LYS A CB 1 +ATOM 1949 C CG . LYS B 2 12 ? -29.836 6.233 23.466 1.00 7.65 ? 4 LYS A CG 1 +ATOM 1950 C CD . LYS B 2 12 ? -31.213 5.587 23.281 1.00 7.99 ? 4 LYS A CD 1 +ATOM 1951 C CE . LYS B 2 12 ? -31.833 5.150 24.578 1.00 8.11 ? 4 LYS A CE 1 +ATOM 1952 N NZ . LYS B 2 12 ? -33.148 4.498 24.336 1.00 10.04 1 4 LYS A NZ 1 +ATOM 1953 H H . LYS B 2 12 ? -28.255 7.128 26.005 1.00 8.18 ? 4 LYS A H 1 +ATOM 1954 H HA . LYS B 2 12 ? -28.039 8.234 23.536 1.00 7.56 ? 4 LYS A HA 1 +ATOM 1955 H HB2 . LYS B 2 12 ? -30.394 7.557 24.930 1.00 8.84 ? 4 LYS A HB2 1 +ATOM 1956 H HB3 . LYS B 2 12 ? -30.372 8.212 23.481 1.00 8.84 ? 4 LYS A HB3 1 +ATOM 1957 H HG2 . LYS B 2 12 ? -29.419 6.302 22.593 1.00 9.18 ? 4 LYS A HG2 1 +ATOM 1958 H HG3 . LYS B 2 12 ? -29.310 5.654 24.039 1.00 9.18 ? 4 LYS A HG3 1 +ATOM 1959 H HD2 . LYS B 2 12 ? -31.810 6.228 22.865 1.00 9.59 ? 4 LYS A HD2 1 +ATOM 1960 H HD3 . LYS B 2 12 ? -31.121 4.804 22.715 1.00 9.59 ? 4 LYS A HD3 1 +ATOM 1961 H HE2 . LYS B 2 12 ? -31.250 4.511 25.017 1.00 9.73 ? 4 LYS A HE2 1 +ATOM 1962 H HE3 . LYS B 2 12 ? -31.975 5.924 25.146 1.00 9.73 ? 4 LYS A HE3 1 +ATOM 1963 H HZ1 . LYS B 2 12 ? -33.508 4.243 25.108 1.00 12.05 ? 4 LYS A HZ1 1 +ATOM 1964 H HZ2 . LYS B 2 12 ? -33.700 5.068 23.933 1.00 12.05 ? 4 LYS A HZ2 1 +ATOM 1965 H HZ3 . LYS B 2 12 ? -33.041 3.783 23.816 1.00 12.05 ? 4 LYS A HZ3 1 +ATOM 1966 N N . THR B 2 13 ? -28.094 10.549 24.130 1.00 6.44 ? 5 THR A N 1 +ATOM 1967 C CA . THR B 2 13 ? -28.023 11.946 24.508 1.00 7.05 ? 5 THR A CA 1 +ATOM 1968 C C . THR B 2 13 ? -28.335 12.817 23.304 1.00 6.90 ? 5 THR A C 1 +ATOM 1969 O O . THR B 2 13 ? -28.032 12.443 22.171 1.00 7.24 ? 5 THR A O 1 +ATOM 1970 C CB . THR B 2 13 ? -26.600 12.325 25.020 1.00 6.43 ? 5 THR A CB 1 +ATOM 1971 O OG1 . THR B 2 13 ? -25.649 12.164 23.960 1.00 9.62 ? 5 THR A OG1 1 +ATOM 1972 C CG2 . THR B 2 13 ? -26.162 11.459 26.149 1.00 6.96 ? 5 THR A CG2 1 +ATOM 1973 H H . THR B 2 13 ? -27.783 10.389 23.344 1.00 7.73 ? 5 THR A H 1 +ATOM 1974 H HA . THR B 2 13 ? -28.669 12.133 25.207 1.00 8.46 ? 5 THR A HA 1 +ATOM 1975 H HB . THR B 2 13 ? -26.598 13.247 25.321 1.00 7.71 ? 5 THR A HB 1 +ATOM 1976 H HG1 . THR B 2 13 ? -25.644 11.366 23.698 1.00 11.55 ? 5 THR A HG1 1 +ATOM 1977 H HG21 . THR B 2 13 ? -25.276 11.721 26.443 1.00 8.35 ? 5 THR A HG21 1 +ATOM 1978 H HG22 . THR B 2 13 ? -26.779 11.546 26.892 1.00 8.35 ? 5 THR A HG22 1 +ATOM 1979 H HG23 . THR B 2 13 ? -26.139 10.532 25.865 1.00 8.35 ? 5 THR A HG23 1 +ATOM 1980 N N . PRO B 2 14 ? -28.916 14.000 23.527 1.00 6.59 ? 6 PRO A N 1 +ATOM 1981 C CA . PRO B 2 14 ? -28.990 14.970 22.426 1.00 7.09 ? 6 PRO A CA 1 +ATOM 1982 C C . PRO B 2 14 ? -27.598 15.507 22.128 1.00 7.06 ? 6 PRO A C 1 +ATOM 1983 O O . PRO B 2 14 ? -26.726 15.450 22.973 1.00 8.09 ? 6 PRO A O 1 +ATOM 1984 C CB . PRO B 2 14 ? -29.871 16.068 23.001 1.00 8.71 ? 6 PRO A CB 1 +ATOM 1985 C CG . PRO B 2 14 ? -29.619 15.996 24.476 1.00 8.45 ? 6 PRO A CG 1 +ATOM 1986 C CD . PRO B 2 14 ? -29.501 14.525 24.767 1.00 8.08 ? 6 PRO A CD 1 +ATOM 1987 H HA . PRO B 2 14 ? -29.392 14.585 21.631 1.00 8.51 ? 6 PRO A HA 1 +ATOM 1988 H HB2 . PRO B 2 14 ? -29.600 16.929 22.645 1.00 10.46 ? 6 PRO A HB2 1 +ATOM 1989 H HB3 . PRO B 2 14 ? -30.802 15.885 22.799 1.00 10.46 ? 6 PRO A HB3 1 +ATOM 1990 H HG2 . PRO B 2 14 ? -28.794 16.457 24.692 1.00 10.14 ? 6 PRO A HG2 1 +ATOM 1991 H HG3 . PRO B 2 14 ? -30.367 16.384 24.957 1.00 10.14 ? 6 PRO A HG3 1 +ATOM 1992 H HD2 . PRO B 2 14 ? -28.905 14.373 25.516 1.00 9.70 ? 6 PRO A HD2 1 +ATOM 1993 H HD3 . PRO B 2 14 ? -30.377 14.138 24.921 1.00 9.70 ? 6 PRO A HD3 1 +ATOM 1994 N N . GLU B 2 15 ? -27.394 16.035 20.932 1.00 7.97 ? 7 GLU A N 1 +ATOM 1995 C CA . GLU B 2 15 ? -26.098 16.606 20.583 1.00 9.06 ? 7 GLU A CA 1 +ATOM 1996 C C . GLU B 2 15 ? -25.815 17.888 21.350 1.00 8.17 ? 7 GLU A C 1 +ATOM 1997 O O . GLU B 2 15 ? -24.679 18.185 21.712 1.00 8.43 ? 7 GLU A O 1 +ATOM 1998 C CB . GLU B 2 15 ? -26.008 16.910 19.089 1.00 12.32 ? 7 GLU A CB 1 +ATOM 1999 C CG . GLU B 2 15 ? -26.225 15.730 18.185 1.00 21.20 ? 7 GLU A CG 1 +ATOM 2000 C CD . GLU B 2 15 ? -26.544 16.173 16.777 1.00 26.49 ? 7 GLU A CD 1 +ATOM 2001 O OE1 . GLU B 2 15 ? -27.485 15.601 16.170 1.00 32.78 ? 7 GLU A OE1 1 +ATOM 2002 O OE2 . GLU B 2 15 ? -25.860 17.110 16.291 1.00 25.65 -1 7 GLU A OE2 1 +ATOM 2003 H H . GLU B 2 15 ? -27.983 16.076 20.306 1.00 9.56 ? 7 GLU A H 1 +ATOM 2004 H HA . GLU B 2 15 ? -25.403 15.966 20.802 1.00 10.87 ? 7 GLU A HA 1 +ATOM 2005 H HB2 . GLU B 2 15 ? -26.680 17.574 18.868 1.00 14.78 ? 7 GLU A HB2 1 +ATOM 2006 H HB3 . GLU B 2 15 ? -25.126 17.265 18.899 1.00 14.78 ? 7 GLU A HB3 1 +ATOM 2007 H HG2 . GLU B 2 15 ? -25.418 15.192 18.159 1.00 25.44 ? 7 GLU A HG2 1 +ATOM 2008 H HG3 . GLU B 2 15 ? -26.970 15.204 18.515 1.00 25.44 ? 7 GLU A HG3 1 +ATOM 2009 N N . SER B 2 16 ? -26.851 18.669 21.569 1.00 8.09 ? 8 SER A N 1 +ATOM 2010 C CA . SER B 2 16 ? -26.714 19.901 22.311 1.00 8.26 ? 8 SER A CA 1 +ATOM 2011 C C . SER B 2 16 ? -28.004 20.233 23.033 1.00 8.00 ? 8 SER A C 1 +ATOM 2012 O O . SER B 2 16 ? -29.069 19.737 22.696 1.00 9.14 ? 8 SER A O 1 +ATOM 2013 C CB . SER B 2 16 ? -26.322 21.057 21.396 1.00 11.95 ? 8 SER A CB 1 +ATOM 2014 O OG . SER B 2 16 ? -27.415 21.469 20.609 1.00 16.20 ? 8 SER A OG 1 +ATOM 2015 H H . SER B 2 16 ? -27.651 18.506 21.297 1.00 9.70 ? 8 SER A H 1 +ATOM 2016 H HA . SER B 2 16 ? -26.016 19.794 22.976 1.00 9.91 ? 8 SER A HA 1 +ATOM 2017 H HB2 . SER B 2 16 ? -26.025 21.803 21.940 1.00 14.34 ? 8 SER A HB2 1 +ATOM 2018 H HB3 . SER B 2 16 ? -25.604 20.766 20.811 1.00 14.34 ? 8 SER A HB3 1 +ATOM 2019 H HG . SER B 2 16 ? -27.186 22.105 20.110 1.00 19.44 ? 8 SER A HG 1 +ATOM 2020 N N . VAL B 2 17 ? -27.875 21.092 24.032 1.00 7.99 ? 9 VAL A N 1 +ATOM 2021 C CA . VAL B 2 17 ? -28.978 21.567 24.830 1.00 8.01 ? 9 VAL A CA 1 +ATOM 2022 C C . VAL B 2 17 ? -28.770 23.054 25.014 1.00 8.48 ? 9 VAL A C 1 +ATOM 2023 O O . VAL B 2 17 ? -27.648 23.523 25.166 1.00 9.68 ? 9 VAL A O 1 +ATOM 2024 C CB . VAL B 2 17 ? -28.991 20.857 26.196 1.00 10.30 ? 9 VAL A CB 1 +ATOM 2025 C CG1 . VAL B 2 17 ? -29.994 21.495 27.152 1.00 12.47 ? 9 VAL A CG1 1 +ATOM 2026 C CG2 . VAL B 2 17 ? -29.282 19.379 26.016 1.00 10.96 ? 9 VAL A CG2 1 +ATOM 2027 H H . VAL B 2 17 ? -27.119 21.424 24.273 1.00 9.58 ? 9 VAL A H 1 +ATOM 2028 H HA . VAL B 2 17 ? -29.820 21.411 24.375 1.00 9.61 ? 9 VAL A HA 1 +ATOM 2029 H HB . VAL B 2 17 ? -28.111 20.937 26.596 1.00 12.36 ? 9 VAL A HB 1 +ATOM 2030 H HG11 . VAL B 2 17 ? -29.971 21.019 27.997 1.00 14.97 ? 9 VAL A HG11 1 +ATOM 2031 H HG12 . VAL B 2 17 ? -29.753 22.425 27.289 1.00 14.97 ? 9 VAL A HG12 1 +ATOM 2032 H HG13 . VAL B 2 17 ? -30.881 21.437 26.764 1.00 14.97 ? 9 VAL A HG13 1 +ATOM 2033 H HG21 . VAL B 2 17 ? -29.286 18.951 26.887 1.00 13.15 ? 9 VAL A HG21 1 +ATOM 2034 H HG22 . VAL B 2 17 ? -30.148 19.277 25.593 1.00 13.15 ? 9 VAL A HG22 1 +ATOM 2035 H HG23 . VAL B 2 17 ? -28.592 18.988 25.458 1.00 13.15 ? 9 VAL A HG23 1 +ATOM 2036 N N . THR B 2 18 ? -29.869 23.801 25.014 1.00 9.43 ? 10 THR A N 1 +ATOM 2037 C CA . THR B 2 18 ? -29.822 25.232 25.289 1.00 9.95 ? 10 THR A CA 1 +ATOM 2038 C C . THR B 2 18 ? -30.691 25.557 26.486 1.00 10.60 ? 10 THR A C 1 +ATOM 2039 O O . THR B 2 18 ? -31.833 25.138 26.561 1.00 12.11 ? 10 THR A O 1 +ATOM 2040 C CB . THR B 2 18 ? -30.284 26.060 24.081 1.00 11.76 ? 10 THR A CB 1 +ATOM 2041 O OG1 . THR B 2 18 ? -29.437 25.745 22.977 1.00 13.62 ? 10 THR A OG1 1 +ATOM 2042 C CG2 . THR B 2 18 ? -30.199 27.557 24.376 1.00 14.42 ? 10 THR A CG2 1 +ATOM 2043 H H . THR B 2 18 ? -30.659 23.501 24.857 1.00 11.31 ? 10 THR A H 1 +ATOM 2044 H HA . THR B 2 18 ? -28.910 25.486 25.500 1.00 11.94 ? 10 THR A HA 1 +ATOM 2045 H HB . THR B 2 18 ? -31.202 25.837 23.863 1.00 14.11 ? 10 THR A HB 1 +ATOM 2046 H HG1 . THR B 2 18 ? -29.670 26.187 22.301 1.00 16.34 ? 10 THR A HG1 1 +ATOM 2047 H HG21 . THR B 2 18 ? -30.764 27.778 25.132 1.00 17.30 ? 10 THR A HG21 1 +ATOM 2048 H HG22 . THR B 2 18 ? -29.284 27.802 24.583 1.00 17.30 ? 10 THR A HG22 1 +ATOM 2049 H HG23 . THR B 2 18 ? -30.494 28.063 23.603 1.00 17.30 ? 10 THR A HG23 1 +ATOM 2050 N N . GLY B 2 19 ? -30.127 26.301 27.429 1.00 10.01 ? 11 GLY A N 1 +ATOM 2051 C CA . GLY B 2 19 ? -30.858 26.750 28.598 1.00 10.24 ? 11 GLY A CA 1 +ATOM 2052 C C . GLY B 2 19 ? -30.820 28.259 28.711 1.00 9.71 ? 11 GLY A C 1 +ATOM 2053 O O . GLY B 2 19 ? -30.038 28.909 28.032 1.00 11.70 ? 11 GLY A O 1 +ATOM 2054 H H . GLY B 2 19 ? -29.308 26.562 27.412 1.00 12.02 ? 11 GLY A H 1 +ATOM 2055 H HA2 . GLY B 2 19 ? -31.783 26.464 28.536 1.00 12.29 ? 11 GLY A HA2 1 +ATOM 2056 H HA3 . GLY B 2 19 ? -30.466 26.366 29.398 1.00 12.29 ? 11 GLY A HA3 1 +ATOM 2057 N N . THR B 2 20 ? -31.657 28.809 29.576 1.00 9.22 ? 12 THR A N 1 +ATOM 2058 C CA . THR B 2 20 ? -31.725 30.243 29.796 1.00 9.28 ? 12 THR A CA 1 +ATOM 2059 C C . THR B 2 20 ? -30.919 30.638 31.034 1.00 7.89 ? 12 THR A C 1 +ATOM 2060 O O . THR B 2 20 ? -31.035 30.001 32.081 1.00 8.27 ? 12 THR A O 1 +ATOM 2061 C CB . THR B 2 20 ? -33.186 30.668 29.987 1.00 10.56 ? 12 THR A CB 1 +ATOM 2062 O OG1 . THR B 2 20 ? -33.915 30.328 28.800 1.00 14.58 ? 12 THR A OG1 1 +ATOM 2063 C CG2 . THR B 2 20 ? -33.282 32.166 30.237 1.00 11.40 ? 12 THR A CG2 1 +ATOM 2064 H H . THR B 2 20 ? -32.209 28.361 30.060 1.00 11.07 ? 12 THR A H 1 +ATOM 2065 H HA . THR B 2 20 ? -31.363 30.710 29.027 1.00 11.13 ? 12 THR A HA 1 +ATOM 2066 H HB . THR B 2 20 ? -33.565 30.201 30.748 1.00 12.68 ? 12 THR A HB 1 +ATOM 2067 H HG1 . THR B 2 20 ? -34.721 30.552 28.883 1.00 17.50 ? 12 THR A HG1 1 +ATOM 2068 H HG21 . THR B 2 20 ? -34.210 32.423 30.356 1.00 13.68 ? 12 THR A HG21 1 +ATOM 2069 H HG22 . THR B 2 20 ? -32.785 32.401 31.036 1.00 13.68 ? 12 THR A HG22 1 +ATOM 2070 H HG23 . THR B 2 20 ? -32.914 32.653 29.483 1.00 13.68 ? 12 THR A HG23 1 +ATOM 2071 N N . TRP B 2 21 ? -30.125 31.688 30.896 1.00 8.43 ? 13 TRP A N 1 +ATOM 2072 C CA . TRP B 2 21 ? -29.358 32.274 31.986 1.00 8.08 ? 13 TRP A CA 1 +ATOM 2073 C C . TRP B 2 21 ? -30.219 32.463 33.226 1.00 8.31 ? 13 TRP A C 1 +ATOM 2074 O O . TRP B 2 21 ? -31.287 33.058 33.151 1.00 8.69 ? 13 TRP A O 1 +ATOM 2075 C CB . TRP B 2 21 ? -28.815 33.621 31.504 1.00 10.25 ? 13 TRP A CB 1 +ATOM 2076 C CG . TRP B 2 21 ? -27.945 34.330 32.493 1.00 9.22 ? 13 TRP A CG 1 +ATOM 2077 C CD1 . TRP B 2 21 ? -26.962 33.795 33.267 1.00 9.66 ? 13 TRP A CD1 1 +ATOM 2078 C CD2 . TRP B 2 21 ? -27.989 35.726 32.817 1.00 9.44 ? 13 TRP A CD2 1 +ATOM 2079 N NE1 . TRP B 2 21 ? -26.387 34.765 34.048 1.00 11.22 ? 13 TRP A NE1 1 +ATOM 2080 C CE2 . TRP B 2 21 ? -26.999 35.959 33.787 1.00 9.71 ? 13 TRP A CE2 1 +ATOM 2081 C CE3 . TRP B 2 21 ? -28.772 36.802 32.381 1.00 10.31 ? 13 TRP A CE3 1 +ATOM 2082 C CZ2 . TRP B 2 21 ? -26.785 37.216 34.357 1.00 12.46 ? 13 TRP A CZ2 1 +ATOM 2083 C CZ3 . TRP B 2 21 ? -28.542 38.055 32.940 1.00 11.94 ? 13 TRP A CZ3 1 +ATOM 2084 C CH2 . TRP B 2 21 ? -27.556 38.248 33.908 1.00 13.47 ? 13 TRP A CH2 1 +ATOM 2085 H H . TRP B 2 21 ? -30.010 32.096 30.148 1.00 10.12 ? 13 TRP A H 1 +ATOM 2086 H HA . TRP B 2 21 ? -28.610 31.697 32.209 1.00 9.70 ? 13 TRP A HA 1 +ATOM 2087 H HB2 . TRP B 2 21 ? -28.290 33.475 30.702 1.00 12.30 ? 13 TRP A HB2 1 +ATOM 2088 H HB3 . TRP B 2 21 ? -29.565 34.203 31.302 1.00 12.30 ? 13 TRP A HB3 1 +ATOM 2089 H HD1 . TRP B 2 21 ? -26.707 32.901 33.258 1.00 11.59 ? 13 TRP A HD1 1 +ATOM 2090 H HE1 . TRP B 2 21 ? -25.749 34.642 34.611 1.00 13.46 ? 13 TRP A HE1 1 +ATOM 2091 H HE3 . TRP B 2 21 ? -29.436 36.680 31.741 1.00 12.37 ? 13 TRP A HE3 1 +ATOM 2092 H HZ2 . TRP B 2 21 ? -26.121 37.351 34.994 1.00 14.95 ? 13 TRP A HZ2 1 +ATOM 2093 H HZ3 . TRP B 2 21 ? -29.053 38.780 32.659 1.00 14.33 ? 13 TRP A HZ3 1 +ATOM 2094 H HH2 . TRP B 2 21 ? -27.422 39.099 34.257 1.00 16.16 ? 13 TRP A HH2 1 +ATOM 2095 N N . LYS B 2 22 ? -29.751 31.903 34.336 1.00 6.75 ? 14 LYS A N 1 +ATOM 2096 C CA . LYS B 2 22 ? -30.396 31.942 35.648 1.00 7.00 ? 14 LYS A CA 1 +ATOM 2097 C C . LYS B 2 22 ? -31.645 31.095 35.788 1.00 6.66 ? 14 LYS A C 1 +ATOM 2098 O O . LYS B 2 22 ? -32.225 31.032 36.860 1.00 7.22 ? 14 LYS A O 1 +ATOM 2099 C CB . LYS B 2 22 ? -30.594 33.375 36.141 1.00 7.38 ? 14 LYS A CB 1 +ATOM 2100 C CG . LYS B 2 22 ? -29.245 34.107 36.278 1.00 8.53 ? 14 LYS A CG 1 +ATOM 2101 C CD . LYS B 2 22 ? -29.365 35.507 36.843 1.00 9.06 ? 14 LYS A CD 1 +ATOM 2102 C CE . LYS B 2 22 ? -29.992 36.444 35.859 1.00 8.49 ? 14 LYS A CE 1 +ATOM 2103 N NZ . LYS B 2 22 ? -30.105 37.812 36.419 1.00 10.38 1 14 LYS A NZ 1 +ATOM 2104 H H . LYS B 2 22 ? -29.011 31.466 34.354 1.00 8.10 ? 14 LYS A H 1 +ATOM 2105 H HA . LYS B 2 22 ? -29.760 31.550 36.267 1.00 8.40 ? 14 LYS A HA 1 +ATOM 2106 H HB2 . LYS B 2 22 ? -31.142 33.861 35.504 1.00 8.86 ? 14 LYS A HB2 1 +ATOM 2107 H HB3 . LYS B 2 22 ? -31.023 33.360 37.011 1.00 8.86 ? 14 LYS A HB3 1 +ATOM 2108 H HG2 . LYS B 2 22 ? -28.672 33.597 36.870 1.00 10.24 ? 14 LYS A HG2 1 +ATOM 2109 H HG3 . LYS B 2 22 ? -28.836 34.175 35.401 1.00 10.24 ? 14 LYS A HG3 1 +ATOM 2110 H HD2 . LYS B 2 22 ? -29.921 35.486 37.638 1.00 10.87 ? 14 LYS A HD2 1 +ATOM 2111 H HD3 . LYS B 2 22 ? -28.481 35.842 37.060 1.00 10.87 ? 14 LYS A HD3 1 +ATOM 2112 H HE2 . LYS B 2 22 ? -29.442 36.486 35.060 1.00 10.19 ? 14 LYS A HE2 1 +ATOM 2113 H HE3 . LYS B 2 22 ? -30.883 36.130 35.639 1.00 10.19 ? 14 LYS A HE3 1 +ATOM 2114 H HZ1 . LYS B 2 22 ? -29.297 38.123 36.627 1.00 12.45 ? 14 LYS A HZ1 1 +ATOM 2115 H HZ2 . LYS B 2 22 ? -30.479 38.355 35.822 1.00 12.45 ? 14 LYS A HZ2 1 +ATOM 2116 H HZ3 . LYS B 2 22 ? -30.608 37.799 37.153 1.00 12.45 ? 14 LYS A HZ3 1 +ATOM 2117 N N . GLY B 2 23 ? -32.014 30.404 34.712 1.00 7.03 ? 15 GLY A N 1 +ATOM 2118 C CA . GLY B 2 23 ? -33.061 29.413 34.740 1.00 7.31 ? 15 GLY A CA 1 +ATOM 2119 C C . GLY B 2 23 ? -32.458 28.046 34.979 1.00 6.88 ? 15 GLY A C 1 +ATOM 2120 O O . GLY B 2 23 ? -31.318 27.913 35.401 1.00 7.34 ? 15 GLY A O 1 +ATOM 2121 H H . GLY B 2 23 ? -31.657 30.502 33.936 1.00 8.43 ? 15 GLY A H 1 +ATOM 2122 H HA2 . GLY B 2 23 ? -33.688 29.612 35.452 1.00 8.77 ? 15 GLY A HA2 1 +ATOM 2123 H HA3 . GLY B 2 23 ? -33.534 29.407 33.893 1.00 8.77 ? 15 GLY A HA3 1 +ATOM 2124 N N . ASP B 2 24 ? -33.242 27.019 34.697 1.00 6.39 ? 16 ASP A N 1 +ATOM 2125 C CA . ASP B 2 24 ? -32.848 25.641 34.930 1.00 6.93 ? 16 ASP A CA 1 +ATOM 2126 C C . ASP B 2 24 ? -32.875 24.877 33.612 1.00 6.32 ? 16 ASP A C 1 +ATOM 2127 O O . ASP B 2 24 ? -33.643 25.217 32.715 1.00 7.55 ? 16 ASP A O 1 +ATOM 2128 C CB . ASP B 2 24 ? -33.837 24.957 35.877 1.00 7.72 ? 16 ASP A CB 1 +ATOM 2129 C CG . ASP B 2 24 ? -33.998 25.676 37.207 1.00 9.09 ? 16 ASP A CG 1 +ATOM 2130 O OD1 . ASP B 2 24 ? -33.089 26.425 37.635 1.00 8.18 ? 16 ASP A OD1 1 +ATOM 2131 O OD2 . ASP B 2 24 ? -35.042 25.449 37.854 1.00 9.29 -1 16 ASP A OD2 1 +ATOM 2132 H H . ASP B 2 24 ? -34.030 27.097 34.360 1.00 7.67 ? 16 ASP A H 1 +ATOM 2133 H HA . ASP B 2 24 ? -31.956 25.602 35.309 1.00 8.32 ? 16 ASP A HA 1 +ATOM 2134 H HB2 . ASP B 2 24 ? -34.707 24.922 35.450 1.00 9.26 ? 16 ASP A HB2 1 +ATOM 2135 H HB3 . ASP B 2 24 ? -33.524 24.057 36.060 1.00 9.26 ? 16 ASP A HB3 1 +ATOM 2136 N N . VAL B 2 25 ? -32.090 23.815 33.493 1.00 6.21 ? 17 VAL A N 1 +ATOM 2137 C CA . VAL B 2 25 ? -32.171 22.988 32.301 1.00 6.34 ? 17 VAL A CA 1 +ATOM 2138 C C . VAL B 2 25 ? -31.724 21.581 32.630 1.00 5.70 ? 17 VAL A C 1 +ATOM 2139 O O . VAL B 2 25 ? -30.860 21.388 33.490 1.00 7.31 ? 17 VAL A O 1 +ATOM 2140 C CB . VAL B 2 25 ? -31.371 23.605 31.130 1.00 7.70 ? 17 VAL A CB 1 +ATOM 2141 C CG1 . VAL B 2 25 ? -29.890 23.378 31.280 1.00 9.90 ? 17 VAL A CG1 1 +ATOM 2142 C CG2 . VAL B 2 25 ? -31.852 23.037 29.790 1.00 9.36 ? 17 VAL A CG2 1 +ATOM 2143 H H . VAL B 2 25 ? -31.513 23.557 34.075 1.00 7.45 ? 17 VAL A H 1 +ATOM 2144 H HA . VAL B 2 25 ? -33.099 22.940 32.024 1.00 7.61 ? 17 VAL A HA 1 +ATOM 2145 H HB . VAL B 2 25 ? -31.524 24.563 31.118 1.00 9.24 ? 17 VAL A HB 1 +ATOM 2146 H HG11 . VAL B 2 25 ? -29.432 23.780 30.526 1.00 11.88 ? 17 VAL A HG11 1 +ATOM 2147 H HG12 . VAL B 2 25 ? -29.591 23.786 32.107 1.00 11.88 ? 17 VAL A HG12 1 +ATOM 2148 H HG13 . VAL B 2 25 ? -29.719 22.423 31.301 1.00 11.88 ? 17 VAL A HG13 1 +ATOM 2149 H HG21 . VAL B 2 25 ? -31.336 23.439 29.073 1.00 11.23 ? 17 VAL A HG21 1 +ATOM 2150 H HG22 . VAL B 2 25 ? -31.724 22.075 29.791 1.00 11.23 ? 17 VAL A HG22 1 +ATOM 2151 H HG23 . VAL B 2 25 ? -32.793 23.245 29.678 1.00 11.23 ? 17 VAL A HG23 1 +ATOM 2152 N N . LYS B 2 26 ? -32.280 20.619 31.913 1.00 6.49 ? 18 LYS A N 1 +ATOM 2153 C CA . LYS B 2 26 ? -31.843 19.238 31.977 1.00 6.56 ? 18 LYS A CA 1 +ATOM 2154 C C . LYS B 2 26 ? -31.034 18.872 30.741 1.00 6.04 ? 18 LYS A C 1 +ATOM 2155 O O . LYS B 2 26 ? -31.392 19.219 29.615 1.00 7.03 ? 18 LYS A O 1 +ATOM 2156 C CB . LYS B 2 26 ? -33.048 18.302 32.111 1.00 6.70 ? 18 LYS A CB 1 +ATOM 2157 C CG . LYS B 2 26 ? -32.701 16.825 32.138 1.00 8.23 ? 18 LYS A CG 1 +ATOM 2158 C CD . LYS B 2 26 ? -33.891 15.922 32.404 1.00 8.79 ? 18 LYS A CD 1 +ATOM 2159 C CE . LYS B 2 26 ? -34.252 15.882 33.875 1.00 9.50 ? 18 LYS A CE 1 +ATOM 2160 N NZ . LYS B 2 26 ? -35.437 15.000 34.118 1.00 10.21 1 18 LYS A NZ 1 +ATOM 2161 H H . LYS B 2 26 ? -32.932 20.747 31.366 1.00 7.79 ? 18 LYS A H 1 +ATOM 2162 H HA . LYS B 2 26 ? -31.277 19.118 32.756 1.00 7.87 ? 18 LYS A HA 1 +ATOM 2163 H HB2 . LYS B 2 26 ? -33.511 18.510 32.938 1.00 8.03 ? 18 LYS A HB2 1 +ATOM 2164 H HB3 . LYS B 2 26 ? -33.641 18.451 31.358 1.00 8.03 ? 18 LYS A HB3 1 +ATOM 2165 H HG2 . LYS B 2 26 ? -32.326 16.576 31.279 1.00 9.88 ? 18 LYS A HG2 1 +ATOM 2166 H HG3 . LYS B 2 26 ? -32.049 16.669 32.839 1.00 9.88 ? 18 LYS A HG3 1 +ATOM 2167 H HD2 . LYS B 2 26 ? -34.659 16.254 31.913 1.00 10.55 ? 18 LYS A HD2 1 +ATOM 2168 H HD3 . LYS B 2 26 ? -33.677 15.019 32.120 1.00 10.55 ? 18 LYS A HD3 1 +ATOM 2169 H HE2 . LYS B 2 26 ? -33.501 15.531 34.380 1.00 11.40 ? 18 LYS A HE2 1 +ATOM 2170 H HE3 . LYS B 2 26 ? -34.471 16.778 34.177 1.00 11.40 ? 18 LYS A HE3 1 +ATOM 2171 H HZ1 . LYS B 2 26 ? -35.634 14.988 34.986 1.00 12.25 ? 18 LYS A HZ1 1 +ATOM 2172 H HZ2 . LYS B 2 26 ? -36.140 15.304 33.666 1.00 12.25 ? 18 LYS A HZ2 1 +ATOM 2173 H HZ3 . LYS B 2 26 ? -35.258 14.170 33.851 1.00 12.25 ? 18 LYS A HZ3 1 +ATOM 2174 N N . ILE B 2 27 ? -29.922 18.177 30.961 1.00 5.40 ? 19 ILE A N 1 +ATOM 2175 C CA . ILE B 2 27 ? -29.161 17.551 29.901 1.00 6.61 ? 19 ILE A CA 1 +ATOM 2176 C C . ILE B 2 27 ? -29.433 16.060 29.970 1.00 4.92 ? 19 ILE A C 1 +ATOM 2177 O O . ILE B 2 27 ? -29.021 15.378 30.909 1.00 5.74 ? 19 ILE A O 1 +ATOM 2178 C CB . ILE B 2 27 ? -27.644 17.780 30.052 1.00 6.42 ? 19 ILE A CB 1 +ATOM 2179 C CG1 . ILE B 2 27 ? -27.321 19.274 30.216 1.00 8.38 ? 19 ILE A CG1 1 +ATOM 2180 C CG2 . ILE B 2 27 ? -26.920 17.184 28.866 1.00 8.13 ? 19 ILE A CG2 1 +ATOM 2181 C CD1 . ILE B 2 27 ? -25.844 19.592 30.359 1.00 10.85 ? 19 ILE A CD1 1 +ATOM 2182 H H . ILE B 2 27 ? -29.583 18.054 31.742 1.00 6.48 ? 19 ILE A H 1 +ATOM 2183 H HA . ILE B 2 27 ? -29.449 17.888 29.039 1.00 7.93 ? 19 ILE A HA 1 +ATOM 2184 H HB . ILE B 2 27 ? -27.347 17.317 30.851 1.00 7.70 ? 19 ILE A HB 1 +ATOM 2185 H HG12 . ILE B 2 27 ? -27.649 19.749 29.436 1.00 10.05 ? 19 ILE A HG12 1 +ATOM 2186 H HG13 . ILE B 2 27 ? -27.770 19.603 31.010 1.00 10.05 ? 19 ILE A HG13 1 +ATOM 2187 H HG21 . ILE B 2 27 ? -25.967 17.333 28.971 1.00 9.75 ? 19 ILE A HG21 1 +ATOM 2188 H HG22 . ILE B 2 27 ? -27.104 16.232 28.829 1.00 9.75 ? 19 ILE A HG22 1 +ATOM 2189 H HG23 . ILE B 2 27 ? -27.235 17.614 28.055 1.00 9.75 ? 19 ILE A HG23 1 +ATOM 2190 H HD11 . ILE B 2 27 ? -25.736 20.551 30.457 1.00 13.02 ? 19 ILE A HD11 1 +ATOM 2191 H HD12 . ILE B 2 27 ? -25.498 19.139 31.144 1.00 13.02 ? 19 ILE A HD12 1 +ATOM 2192 H HD13 . ILE B 2 27 ? -25.377 19.285 29.566 1.00 13.02 ? 19 ILE A HD13 1 +ATOM 2193 N N . GLN B 2 28 ? -30.168 15.547 28.998 1.00 5.39 ? 20 GLN A N 1 +ATOM 2194 C CA . GLN B 2 28 ? -30.593 14.160 29.047 1.00 5.60 ? 20 GLN A CA 1 +ATOM 2195 C C . GLN B 2 28 ? -29.445 13.205 28.781 1.00 5.04 ? 20 GLN A C 1 +ATOM 2196 O O . GLN B 2 28 ? -28.622 13.429 27.888 1.00 6.53 ? 20 GLN A O 1 +ATOM 2197 C CB . GLN B 2 28 ? -31.686 13.875 28.025 1.00 6.13 ? 20 GLN A CB 1 +ATOM 2198 C CG . GLN B 2 28 ? -33.028 14.559 28.277 1.00 6.66 ? 20 GLN A CG 1 +ATOM 2199 C CD . GLN B 2 28 ? -33.076 16.016 27.898 1.00 6.58 ? 20 GLN A CD 1 +ATOM 2200 O OE1 . GLN B 2 28 ? -32.220 16.504 27.166 1.00 7.54 ? 20 GLN A OE1 1 +ATOM 2201 N NE2 . GLN B 2 28 ? -34.111 16.716 28.373 1.00 7.90 ? 20 GLN A NE2 1 +ATOM 2202 H H . GLN B 2 28 ? -30.432 15.978 28.303 1.00 6.46 ? 20 GLN A H 1 +ATOM 2203 H HA . GLN B 2 28 ? -30.947 13.968 29.929 1.00 6.72 ? 20 GLN A HA 1 +ATOM 2204 H HB2 . GLN B 2 28 ? -31.373 14.166 27.154 1.00 7.35 ? 20 GLN A HB2 1 +ATOM 2205 H HB3 . GLN B 2 28 ? -31.846 12.919 28.007 1.00 7.35 ? 20 GLN A HB3 1 +ATOM 2206 H HG2 . GLN B 2 28 ? -33.711 14.099 27.763 1.00 7.99 ? 20 GLN A HG2 1 +ATOM 2207 H HG3 . GLN B 2 28 ? -33.235 14.494 29.223 1.00 7.99 ? 20 GLN A HG3 1 +ATOM 2208 H HE21 . GLN B 2 28 ? -34.702 16.330 28.865 1.00 9.48 ? 20 GLN A HE21 1 +ATOM 2209 H HE22 . GLN B 2 28 ? -34.186 17.552 28.187 1.00 9.48 ? 20 GLN A HE22 1 +ATOM 2210 N N . CYS B 2 29 ? -29.434 12.114 29.534 1.00 5.32 ? 21 CYS A N 1 +ATOM 2211 C CA . CYS B 2 29 ? -28.523 11.015 29.312 1.00 5.34 ? 21 CYS A CA 1 +ATOM 2212 C C . CYS B 2 29 ? -29.250 9.782 29.781 1.00 5.74 ? 21 CYS A C 1 +ATOM 2213 O O . CYS B 2 29 ? -29.459 9.617 30.978 1.00 6.16 ? 21 CYS A O 1 +ATOM 2214 C CB . CYS B 2 29 ? -27.212 11.217 30.076 1.00 6.02 ? 21 CYS A CB 1 +ATOM 2215 S SG . CYS B 2 29 ? -26.012 9.926 29.683 1.00 6.99 ? 21 CYS A SG 1 +ATOM 2216 H H . CYS B 2 29 ? -29.965 11.988 30.199 1.00 6.38 ? 21 CYS A H 1 +ATOM 2217 H HA . CYS B 2 29 ? -28.329 10.929 28.366 1.00 6.41 ? 21 CYS A HA 1 +ATOM 2218 H HB2 . CYS B 2 29 ? -26.828 12.074 29.831 1.00 7.22 ? 21 CYS A HB2 1 +ATOM 2219 H HB3 . CYS B 2 29 ? -27.389 11.189 31.029 1.00 7.22 ? 21 CYS A HB3 1 +ATOM 2220 N N . ILE B 2 30 ? -29.662 8.935 28.833 1.00 5.52 ? 22 ILE A N 1 +ATOM 2221 C CA . ILE B 2 30 ? -30.572 7.842 29.115 1.00 6.02 ? 22 ILE A CA 1 +ATOM 2222 C C . ILE B 2 30 ? -30.116 6.615 28.370 1.00 6.72 ? 22 ILE A C 1 +ATOM 2223 O O . ILE B 2 30 ? -29.738 6.699 27.193 1.00 7.42 ? 22 ILE A O 1 +ATOM 2224 C CB . ILE B 2 30 ? -32.016 8.201 28.683 1.00 6.23 ? 22 ILE A CB 1 +ATOM 2225 C CG1 . ILE B 2 30 ? -32.519 9.416 29.459 1.00 7.33 ? 22 ILE A CG1 1 +ATOM 2226 C CG2 . ILE B 2 30 ? -32.953 7.006 28.827 1.00 9.04 ? 22 ILE A CG2 1 +ATOM 2227 C CD1 . ILE B 2 30 ? -33.844 9.967 28.985 1.00 9.43 ? 22 ILE A CD1 1 +ATOM 2228 H H . ILE B 2 30 ? -29.421 8.980 28.009 1.00 6.62 ? 22 ILE A H 1 +ATOM 2229 H HA . ILE B 2 30 ? -30.569 7.649 30.066 1.00 7.22 ? 22 ILE A HA 1 +ATOM 2230 H HB . ILE B 2 30 ? -31.990 8.442 27.743 1.00 7.47 ? 22 ILE A HB 1 +ATOM 2231 H HG12 . ILE B 2 30 ? -32.621 9.168 30.391 1.00 8.79 ? 22 ILE A HG12 1 +ATOM 2232 H HG13 . ILE B 2 30 ? -31.862 10.126 29.381 1.00 8.79 ? 22 ILE A HG13 1 +ATOM 2233 H HG21 . ILE B 2 30 ? -33.844 7.268 28.548 1.00 10.84 ? 22 ILE A HG21 1 +ATOM 2234 H HG22 . ILE B 2 30 ? -32.630 6.282 28.267 1.00 10.84 ? 22 ILE A HG22 1 +ATOM 2235 H HG23 . ILE B 2 30 ? -32.966 6.725 29.756 1.00 10.84 ? 22 ILE A HG23 1 +ATOM 2236 H HD11 . ILE B 2 30 ? -34.082 10.731 29.533 1.00 11.32 ? 22 ILE A HD11 1 +ATOM 2237 H HD12 . ILE B 2 30 ? -33.760 10.237 28.058 1.00 11.32 ? 22 ILE A HD12 1 +ATOM 2238 H HD13 . ILE B 2 30 ? -34.520 9.276 29.070 1.00 11.32 ? 22 ILE A HD13 1 +ATOM 2239 N N . TYR B 2 31 ? -30.173 5.469 29.033 1.00 6.88 ? 23 TYR A N 1 +ATOM 2240 C CA . TYR B 2 31 ? -29.993 4.187 28.352 1.00 7.34 ? 23 TYR A CA 1 +ATOM 2241 C C . TYR B 2 31 ? -31.139 3.262 28.718 1.00 7.24 ? 23 TYR A C 1 +ATOM 2242 O O . TYR B 2 31 ? -31.785 3.447 29.727 1.00 8.78 ? 23 TYR A O 1 +ATOM 2243 C CB . TYR B 2 31 ? -28.651 3.541 28.706 1.00 7.35 ? 23 TYR A CB 1 +ATOM 2244 C CG . TYR B 2 31 ? -28.481 3.149 30.158 1.00 7.18 ? 23 TYR A CG 1 +ATOM 2245 C CD1 . TYR B 2 31 ? -28.846 1.883 30.589 1.00 6.95 ? 23 TYR A CD1 1 +ATOM 2246 C CD2 . TYR B 2 31 ? -27.920 4.019 31.085 1.00 7.30 ? 23 TYR A CD2 1 +ATOM 2247 C CE1 . TYR B 2 31 ? -28.671 1.501 31.904 1.00 7.04 ? 23 TYR A CE1 1 +ATOM 2248 C CE2 . TYR B 2 31 ? -27.750 3.637 32.415 1.00 6.71 ? 23 TYR A CE2 1 +ATOM 2249 C CZ . TYR B 2 31 ? -28.124 2.370 32.813 1.00 6.46 ? 23 TYR A CZ 1 +ATOM 2250 O OH . TYR B 2 31 ? -27.998 1.929 34.106 1.00 7.89 ? 23 TYR A OH 1 +ATOM 2251 H H . TYR B 2 31 ? -30.315 5.402 29.878 1.00 8.26 ? 23 TYR A H 1 +ATOM 2252 H HA . TYR B 2 31 ? -30.015 4.330 27.393 1.00 8.80 ? 23 TYR A HA 1 +ATOM 2253 H HB2 . TYR B 2 31 ? -28.547 2.737 28.174 1.00 8.82 ? 23 TYR A HB2 1 +ATOM 2254 H HB3 . TYR B 2 31 ? -27.943 4.167 28.489 1.00 8.82 ? 23 TYR A HB3 1 +ATOM 2255 H HD1 . TYR B 2 31 ? -29.212 1.282 29.982 1.00 8.34 ? 23 TYR A HD1 1 +ATOM 2256 H HD2 . TYR B 2 31 ? -27.663 4.871 30.817 1.00 8.76 ? 23 TYR A HD2 1 +ATOM 2257 H HE1 . TYR B 2 31 ? -28.930 0.650 32.176 1.00 8.44 ? 23 TYR A HE1 1 +ATOM 2258 H HE2 . TYR B 2 31 ? -27.381 4.230 33.028 1.00 8.06 ? 23 TYR A HE2 1 +ATOM 2259 H HH . TYR B 2 31 ? -27.655 2.530 34.582 1.00 9.47 ? 23 TYR A HH 1 +ATOM 2260 N N . ASP B 2 32 ? -31.416 2.291 27.845 1.00 9.46 ? 24 ASP A N 1 +ATOM 2261 C CA A ASP B 2 32 ? -32.430 1.292 28.144 0.48 9.72 ? 24 ASP A CA 1 +ATOM 2262 C CA B ASP B 2 32 ? -32.426 1.279 28.147 0.52 9.71 ? 24 ASP A CA 1 +ATOM 2263 C C . ASP B 2 32 ? -31.755 0.190 28.960 1.00 9.64 ? 24 ASP A C 1 +ATOM 2264 O O . ASP B 2 32 ? -30.760 -0.359 28.515 1.00 10.18 ? 24 ASP A O 1 +ATOM 2265 C CB A ASP B 2 32 ? -33.012 0.749 26.839 0.48 11.97 ? 24 ASP A CB 1 +ATOM 2266 C CB B ASP B 2 32 ? -32.977 0.640 26.870 0.52 12.05 ? 24 ASP A CB 1 +ATOM 2267 C CG A ASP B 2 32 ? -34.237 -0.112 27.055 0.48 16.34 ? 24 ASP A CG 1 +ATOM 2268 C CG B ASP B 2 32 ? -33.681 1.619 25.973 0.52 10.35 ? 24 ASP A CG 1 +ATOM 2269 O OD1 A ASP B 2 32 ? -34.954 0.096 28.056 0.48 19.52 ? 24 ASP A OD1 1 +ATOM 2270 O OD1 B ASP B 2 32 ? -33.884 2.778 26.386 0.52 11.41 ? 24 ASP A OD1 1 +ATOM 2271 O OD2 A ASP B 2 32 ? -34.486 -0.996 26.213 0.48 21.81 -1 24 ASP A OD2 1 +ATOM 2272 O OD2 B ASP B 2 32 ? -34.053 1.211 24.855 0.52 14.53 -1 24 ASP A OD2 1 +ATOM 2273 H HA . ASP B 2 32 ? -33.148 1.676 28.665 1.00 11.65 ? 24 ASP A HA 1 +ATOM 2274 H HB2 A ASP B 2 32 ? -33.266 1.494 26.273 0.48 14.37 ? 24 ASP A HB2 1 +ATOM 2275 H HB2 B ASP B 2 32 ? -32.242 0.252 26.370 0.52 14.46 ? 24 ASP A HB2 1 +ATOM 2276 H HB3 A ASP B 2 32 ? -32.341 0.208 26.395 0.48 14.37 ? 24 ASP A HB3 1 +ATOM 2277 H HB3 B ASP B 2 32 ? -33.612 -0.052 27.113 0.52 14.46 ? 24 ASP A HB3 1 +ATOM 2278 N N . PRO B 2 33 ? -32.288 -0.117 30.153 1.00 9.79 ? 25 PRO A N 1 +ATOM 2279 C CA . PRO B 2 33 ? -31.639 -1.195 30.912 1.00 11.40 ? 25 PRO A CA 1 +ATOM 2280 C C . PRO B 2 33 ? -31.613 -2.495 30.127 1.00 10.60 ? 25 PRO A C 1 +ATOM 2281 O O . PRO B 2 33 ? -32.549 -2.798 29.394 1.00 12.02 ? 25 PRO A O 1 +ATOM 2282 C CB . PRO B 2 33 ? -32.520 -1.330 32.151 1.00 14.64 ? 25 PRO A CB 1 +ATOM 2283 C CG . PRO B 2 33 ? -33.133 0.022 32.317 1.00 13.33 ? 25 PRO A CG 1 +ATOM 2284 C CD . PRO B 2 33 ? -33.322 0.573 30.942 1.00 10.53 ? 25 PRO A CD 1 +ATOM 2285 H HA . PRO B 2 33 ? -30.739 -0.944 31.171 1.00 13.68 ? 25 PRO A HA 1 +ATOM 2286 H HB2 . PRO B 2 33 ? -33.202 -2.002 31.998 1.00 17.57 ? 25 PRO A HB2 1 +ATOM 2287 H HB3 . PRO B 2 33 ? -31.974 -1.558 32.919 1.00 17.57 ? 25 PRO A HB3 1 +ATOM 2288 H HG2 . PRO B 2 33 ? -33.987 -0.065 32.768 1.00 15.99 ? 25 PRO A HG2 1 +ATOM 2289 H HG3 . PRO B 2 33 ? -32.534 0.587 32.830 1.00 15.99 ? 25 PRO A HG3 1 +ATOM 2290 H HD2 . PRO B 2 33 ? -34.206 0.353 30.607 1.00 12.64 ? 25 PRO A HD2 1 +ATOM 2291 H HD3 . PRO B 2 33 ? -33.168 1.531 30.937 1.00 12.64 ? 25 PRO A HD3 1 +ATOM 2292 N N . LEU B 2 34 ? -30.536 -3.248 30.299 1.00 11.14 ? 26 LEU A N 1 +ATOM 2293 C CA . LEU B 2 34 ? -30.308 -4.463 29.528 1.00 11.73 ? 26 LEU A CA 1 +ATOM 2294 C C . LEU B 2 34 ? -29.900 -5.570 30.454 1.00 13.64 ? 26 LEU A C 1 +ATOM 2295 O O . LEU B 2 34 ? -29.005 -5.398 31.288 1.00 12.59 ? 26 LEU A O 1 +ATOM 2296 C CB . LEU B 2 34 ? -29.186 -4.218 28.537 1.00 13.01 ? 26 LEU A CB 1 +ATOM 2297 C CG . LEU B 2 34 ? -28.874 -5.269 27.477 1.00 17.99 ? 26 LEU A CG 1 +ATOM 2298 C CD1 . LEU B 2 34 ? -30.115 -5.690 26.698 1.00 19.83 ? 26 LEU A CD1 1 +ATOM 2299 C CD2 . LEU B 2 34 ? -27.828 -4.698 26.534 1.00 20.88 ? 26 LEU A CD2 1 +ATOM 2300 H H . LEU B 2 34 ? -29.912 -3.075 30.865 1.00 13.37 ? 26 LEU A H 1 +ATOM 2301 H HA . LEU B 2 34 ? -31.113 -4.719 29.050 1.00 14.08 ? 26 LEU A HA 1 +ATOM 2302 H HB2 . LEU B 2 34 ? -29.391 -3.398 28.060 1.00 15.61 ? 26 LEU A HB2 1 +ATOM 2303 H HB3 . LEU B 2 34 ? -28.371 -4.088 29.045 1.00 15.61 ? 26 LEU A HB3 1 +ATOM 2304 H HG . LEU B 2 34 ? -28.501 -6.055 27.906 1.00 21.58 ? 26 LEU A HG 1 +ATOM 2305 H HD11 . LEU B 2 34 ? -29.863 -6.356 26.040 1.00 23.79 ? 26 LEU A HD11 1 +ATOM 2306 H HD12 . LEU B 2 34 ? -30.764 -6.062 27.316 1.00 23.79 ? 26 LEU A HD12 1 +ATOM 2307 H HD13 . LEU B 2 34 ? -30.488 -4.911 26.256 1.00 23.79 ? 26 LEU A HD13 1 +ATOM 2308 H HD21 . LEU B 2 34 ? -27.621 -5.359 25.855 1.00 25.06 ? 26 LEU A HD21 1 +ATOM 2309 H HD22 . LEU B 2 34 ? -28.182 -3.896 26.118 1.00 25.06 ? 26 LEU A HD22 1 +ATOM 2310 H HD23 . LEU B 2 34 ? -27.029 -4.483 27.040 1.00 25.06 ? 26 LEU A HD23 1 +ATOM 2311 N N . ARG B 2 35 ? -30.545 -6.720 30.293 1.00 13.16 ? 27 ARG A N 1 +ATOM 2312 C CA . ARG B 2 35 ? -30.277 -7.847 31.167 1.00 15.88 ? 27 ARG A CA 1 +ATOM 2313 C C . ARG B 2 35 ? -28.787 -8.196 31.186 1.00 12.59 ? 27 ARG A C 1 +ATOM 2314 O O . ARG B 2 35 ? -28.125 -8.270 30.164 1.00 19.44 ? 27 ARG A O 1 +ATOM 2315 C CB . ARG B 2 35 ? -31.122 -9.064 30.778 1.00 18.53 ? 27 ARG A CB 1 +ATOM 2316 C CG . ARG B 2 35 ? -30.757 -9.698 29.472 1.00 23.52 ? 27 ARG A CG 1 +ATOM 2317 C CD . ARG B 2 35 ? -31.701 -10.845 29.161 1.00 28.99 ? 27 ARG A CD 1 +ATOM 2318 N NE . ARG B 2 35 ? -33.049 -10.371 28.848 1.00 34.71 ? 27 ARG A NE 1 +ATOM 2319 C CZ . ARG B 2 35 ? -33.418 -9.896 27.661 1.00 35.67 ? 27 ARG A CZ 1 +ATOM 2320 N NH1 . ARG B 2 35 ? -32.537 -9.815 26.673 1.00 32.43 1 27 ARG A NH1 1 +ATOM 2321 N NH2 . ARG B 2 35 ? -34.665 -9.488 27.462 1.00 35.83 ? 27 ARG A NH2 1 +ATOM 2322 H H . ARG B 2 35 ? -31.139 -6.870 29.689 1.00 15.79 ? 27 ARG A H 1 +ATOM 2323 H HA . ARG B 2 35 ? -30.528 -7.598 32.071 1.00 19.06 ? 27 ARG A HA 1 +ATOM 2324 H HB2 . ARG B 2 35 ? -31.025 -9.740 31.468 1.00 22.24 ? 27 ARG A HB2 1 +ATOM 2325 H HB3 . ARG B 2 35 ? -32.050 -8.790 30.720 1.00 22.24 ? 27 ARG A HB3 1 +ATOM 2326 H HG2 . ARG B 2 35 ? -30.826 -9.041 28.762 1.00 28.22 ? 27 ARG A HG2 1 +ATOM 2327 H HG3 . ARG B 2 35 ? -29.853 -10.048 29.523 1.00 28.22 ? 27 ARG A HG3 1 +ATOM 2328 H HD2 . ARG B 2 35 ? -31.366 -11.335 28.394 1.00 34.79 ? 27 ARG A HD2 1 +ATOM 2329 H HD3 . ARG B 2 35 ? -31.757 -11.430 29.933 1.00 34.79 ? 27 ARG A HD3 1 +ATOM 2330 H HE . ARG B 2 35 ? -33.642 -10.402 29.470 1.00 41.65 ? 27 ARG A HE 1 +ATOM 2331 H HH11 . ARG B 2 35 ? -31.728 -10.077 26.796 1.00 38.91 ? 27 ARG A HH11 1 +ATOM 2332 H HH12 . ARG B 2 35 ? -32.777 -9.505 25.907 1.00 38.91 ? 27 ARG A HH12 1 +ATOM 2333 H HH21 . ARG B 2 35 ? -35.240 -9.536 28.099 1.00 43.00 ? 27 ARG A HH21 1 +ATOM 2334 H HH22 . ARG B 2 35 ? -34.899 -9.178 26.694 1.00 43.00 ? 27 ARG A HH22 1 +ATOM 2335 N N . GLY B 2 36 ? -28.294 -8.358 32.409 1.00 18.60 ? 28 GLY A N 1 +ATOM 2336 C CA . GLY B 2 36 ? -26.909 -8.688 32.663 1.00 23.95 ? 28 GLY A CA 1 +ATOM 2337 C C . GLY B 2 36 ? -26.099 -7.492 33.124 1.00 22.99 ? 28 GLY A C 1 +ATOM 2338 O O . GLY B 2 36 ? -25.119 -7.643 33.829 1.00 24.85 ? 28 GLY A O 1 +ATOM 2339 H H . GLY B 2 36 ? -28.762 -8.277 33.125 1.00 22.32 ? 28 GLY A H 1 +ATOM 2340 H HA2 . GLY B 2 36 ? -26.862 -9.373 33.349 1.00 28.74 ? 28 GLY A HA2 1 +ATOM 2341 H HA3 . GLY B 2 36 ? -26.506 -9.037 31.853 1.00 28.74 ? 28 GLY A HA3 1 +ATOM 2342 N N . TYR B 2 37 ? -26.464 -6.306 32.654 1.00 13.47 ? 29 TYR A N 1 +ATOM 2343 C CA . TYR B 2 37 ? -25.635 -5.115 32.845 1.00 12.25 ? 29 TYR A CA 1 +ATOM 2344 C C . TYR B 2 37 ? -26.069 -4.360 34.084 1.00 12.07 ? 29 TYR A C 1 +ATOM 2345 O O . TYR B 2 37 ? -27.121 -3.739 34.088 1.00 15.97 ? 29 TYR A O 1 +ATOM 2346 C CB . TYR B 2 37 ? -25.701 -4.222 31.598 1.00 12.74 ? 29 TYR A CB 1 +ATOM 2347 C CG . TYR B 2 37 ? -25.030 -4.865 30.417 1.00 15.32 ? 29 TYR A CG 1 +ATOM 2348 C CD1 . TYR B 2 37 ? -25.710 -5.751 29.603 1.00 14.13 ? 29 TYR A CD1 1 +ATOM 2349 C CD2 . TYR B 2 37 ? -23.700 -4.608 30.128 1.00 14.84 ? 29 TYR A CD2 1 +ATOM 2350 C CE1 . TYR B 2 37 ? -25.081 -6.366 28.522 1.00 18.53 ? 29 TYR A CE1 1 +ATOM 2351 C CE2 . TYR B 2 37 ? -23.066 -5.211 29.055 1.00 14.99 ? 29 TYR A CE2 1 +ATOM 2352 C CZ . TYR B 2 37 ? -23.756 -6.087 28.258 1.00 18.05 ? 29 TYR A CZ 1 +ATOM 2353 O OH . TYR B 2 37 ? -23.132 -6.692 27.191 1.00 19.93 ? 29 TYR A OH 1 +ATOM 2354 H H . TYR B 2 37 ? -27.191 -6.160 32.218 1.00 16.17 ? 29 TYR A H 1 +ATOM 2355 H HA . TYR B 2 37 ? -24.713 -5.389 32.969 1.00 14.71 ? 29 TYR A HA 1 +ATOM 2356 H HB2 . TYR B 2 37 ? -26.630 -4.062 31.368 1.00 15.29 ? 29 TYR A HB2 1 +ATOM 2357 H HB3 . TYR B 2 37 ? -25.252 -3.382 31.782 1.00 15.29 ? 29 TYR A HB3 1 +ATOM 2358 H HD1 . TYR B 2 37 ? -26.602 -5.944 29.782 1.00 16.96 ? 29 TYR A HD1 1 +ATOM 2359 H HD2 . TYR B 2 37 ? -23.223 -4.019 30.667 1.00 17.81 ? 29 TYR A HD2 1 +ATOM 2360 H HE1 . TYR B 2 37 ? -25.551 -6.958 27.981 1.00 22.23 ? 29 TYR A HE1 1 +ATOM 2361 H HE2 . TYR B 2 37 ? -22.173 -5.024 28.878 1.00 17.99 ? 29 TYR A HE2 1 +ATOM 2362 H HH . TYR B 2 37 ? -23.670 -7.200 26.793 1.00 23.91 ? 29 TYR A HH 1 +ATOM 2363 N N . ARG B 2 38 ? -25.272 -4.430 35.143 1.00 10.15 ? 30 ARG A N 1 +ATOM 2364 C CA . ARG B 2 38 ? -25.553 -3.716 36.379 1.00 9.16 ? 30 ARG A CA 1 +ATOM 2365 C C . ARG B 2 38 ? -24.810 -2.396 36.354 1.00 8.69 ? 30 ARG A C 1 +ATOM 2366 O O . ARG B 2 38 ? -23.609 -2.364 36.130 1.00 9.09 ? 30 ARG A O 1 +ATOM 2367 C CB . ARG B 2 38 ? -25.102 -4.532 37.601 1.00 9.89 ? 30 ARG A CB 1 +ATOM 2368 C CG . ARG B 2 38 ? -25.196 -3.779 38.908 1.00 10.21 ? 30 ARG A CG 1 +ATOM 2369 C CD . ARG B 2 38 ? -25.090 -4.735 40.087 1.00 10.74 ? 30 ARG A CD 1 +ATOM 2370 N NE . ARG B 2 38 ? -23.791 -5.410 40.159 1.00 13.06 ? 30 ARG A NE 1 +ATOM 2371 C CZ . ARG B 2 38 ? -22.743 -4.959 40.843 1.00 14.51 ? 30 ARG A CZ 1 +ATOM 2372 N NH1 . ARG B 2 38 ? -22.813 -3.818 41.504 1.00 15.33 1 30 ARG A NH1 1 +ATOM 2373 N NH2 . ARG B 2 38 ? -21.607 -5.655 40.859 1.00 18.50 ? 30 ARG A NH2 1 +ATOM 2374 H H . ARG B 2 38 ? -24.548 -4.894 35.170 1.00 12.18 ? 30 ARG A H 1 +ATOM 2375 H HA . ARG B 2 38 ? -26.504 -3.540 36.451 1.00 10.99 ? 30 ARG A HA 1 +ATOM 2376 H HB2 . ARG B 2 38 ? -25.662 -5.321 37.673 1.00 11.87 ? 30 ARG A HB2 1 +ATOM 2377 H HB3 . ARG B 2 38 ? -24.177 -4.796 37.477 1.00 11.87 ? 30 ARG A HB3 1 +ATOM 2378 H HG2 . ARG B 2 38 ? -24.469 -3.140 38.966 1.00 12.26 ? 30 ARG A HG2 1 +ATOM 2379 H HG3 . ARG B 2 38 ? -26.051 -3.324 38.959 1.00 12.26 ? 30 ARG A HG3 1 +ATOM 2380 H HD2 . ARG B 2 38 ? -25.214 -4.237 40.910 1.00 12.89 ? 30 ARG A HD2 1 +ATOM 2381 H HD3 . ARG B 2 38 ? -25.776 -5.415 40.005 1.00 12.89 ? 30 ARG A HD3 1 +ATOM 2382 H HE . ARG B 2 38 ? -23.700 -6.149 39.729 1.00 15.67 ? 30 ARG A HE 1 +ATOM 2383 H HH11 . ARG B 2 38 ? -23.543 -3.364 41.502 1.00 18.39 ? 30 ARG A HH11 1 +ATOM 2384 H HH12 . ARG B 2 38 ? -22.129 -3.532 41.941 1.00 18.39 ? 30 ARG A HH12 1 +ATOM 2385 H HH21 . ARG B 2 38 ? -21.551 -6.396 40.427 1.00 22.20 ? 30 ARG A HH21 1 +ATOM 2386 H HH22 . ARG B 2 38 ? -20.927 -5.358 41.294 1.00 22.20 ? 30 ARG A HH22 1 +ATOM 2387 N N . GLN B 2 39 ? -25.505 -1.303 36.594 1.00 7.61 ? 31 GLN A N 1 +ATOM 2388 C CA . GLN B 2 39 ? -24.855 -0.012 36.655 1.00 6.46 ? 31 GLN A CA 1 +ATOM 2389 C C . GLN B 2 39 ? -24.046 0.071 37.928 1.00 7.43 ? 31 GLN A C 1 +ATOM 2390 O O . GLN B 2 39 ? -24.582 -0.153 39.016 1.00 7.84 ? 31 GLN A O 1 +ATOM 2391 C CB . GLN B 2 39 ? -25.902 1.073 36.700 1.00 7.32 ? 31 GLN A CB 1 +ATOM 2392 C CG . GLN B 2 39 ? -25.327 2.476 36.676 1.00 6.98 ? 31 GLN A CG 1 +ATOM 2393 C CD . GLN B 2 39 ? -26.410 3.506 36.828 1.00 6.54 ? 31 GLN A CD 1 +ATOM 2394 O OE1 . GLN B 2 39 ? -27.198 3.735 35.899 1.00 7.20 ? 31 GLN A OE1 1 +ATOM 2395 N NE2 . GLN B 2 39 ? -26.520 4.085 38.000 1.00 6.65 ? 31 GLN A NE2 1 +ATOM 2396 H H . GLN B 2 39 ? -26.355 -1.280 36.724 1.00 9.13 ? 31 GLN A H 1 +ATOM 2397 H HA . GLN B 2 39 ? -24.277 0.120 35.888 1.00 7.75 ? 31 GLN A HA 1 +ATOM 2398 H HB2 . GLN B 2 39 ? -26.484 0.978 35.930 1.00 8.79 ? 31 GLN A HB2 1 +ATOM 2399 H HB3 . GLN B 2 39 ? -26.417 0.977 37.516 1.00 8.79 ? 31 GLN A HB3 1 +ATOM 2400 H HG2 . GLN B 2 39 ? -24.701 2.580 37.410 1.00 8.37 ? 31 GLN A HG2 1 +ATOM 2401 H HG3 . GLN B 2 39 ? -24.880 2.626 35.828 1.00 8.37 ? 31 GLN A HG3 1 +ATOM 2402 H HE21 . GLN B 2 39 ? -25.985 3.869 38.638 1.00 7.98 ? 31 GLN A HE21 1 +ATOM 2403 H HE22 . GLN B 2 39 ? -27.127 4.680 38.131 1.00 7.98 ? 31 GLN A HE22 1 +ATOM 2404 N N . VAL B 2 40 ? -22.775 0.432 37.804 1.00 6.99 ? 32 VAL A N 1 +ATOM 2405 C CA . VAL B 2 40 ? -21.878 0.498 38.949 1.00 8.75 ? 32 VAL A CA 1 +ATOM 2406 C C . VAL B 2 40 ? -21.231 1.849 39.206 1.00 11.25 ? 32 VAL A C 1 +ATOM 2407 O O . VAL B 2 40 ? -20.641 2.023 40.270 1.00 15.07 ? 32 VAL A O 1 +ATOM 2408 C CB . VAL B 2 40 ? -20.751 -0.576 38.871 1.00 11.16 ? 32 VAL A CB 1 +ATOM 2409 C CG1 . VAL B 2 40 ? -21.341 -1.973 39.028 1.00 14.08 ? 32 VAL A CG1 1 +ATOM 2410 C CG2 . VAL B 2 40 ? -19.924 -0.488 37.596 1.00 13.76 ? 32 VAL A CG2 1 +ATOM 2411 H H . VAL B 2 40 ? -22.404 0.647 37.058 1.00 8.39 ? 32 VAL A H 1 +ATOM 2412 H HA . VAL B 2 40 ? -22.402 0.290 39.739 1.00 10.50 ? 32 VAL A HA 1 +ATOM 2413 H HB . VAL B 2 40 ? -20.145 -0.434 39.616 1.00 13.39 ? 32 VAL A HB 1 +ATOM 2414 H HG11 . VAL B 2 40 ? -20.624 -2.625 38.977 1.00 16.90 ? 32 VAL A HG11 1 +ATOM 2415 H HG12 . VAL B 2 40 ? -21.783 -2.034 39.889 1.00 16.90 ? 32 VAL A HG12 1 +ATOM 2416 H HG13 . VAL B 2 40 ? -21.980 -2.127 38.316 1.00 16.90 ? 32 VAL A HG13 1 +ATOM 2417 H HG21 . VAL B 2 40 ? -19.244 -1.180 37.612 1.00 16.51 ? 32 VAL A HG21 1 +ATOM 2418 H HG22 . VAL B 2 40 ? -20.508 -0.615 36.832 1.00 16.51 ? 32 VAL A HG22 1 +ATOM 2419 H HG23 . VAL B 2 40 ? -19.505 0.386 37.551 1.00 16.51 ? 32 VAL A HG23 1 +ATOM 2420 N N . LEU B 2 41 ? -21.255 2.771 38.244 1.00 8.66 ? 33 LEU A N 1 +ATOM 2421 C CA . LEU B 2 41 ? -20.751 4.131 38.432 1.00 8.44 ? 33 LEU A CA 1 +ATOM 2422 C C . LEU B 2 41 ? -21.383 5.053 37.408 1.00 6.88 ? 33 LEU A C 1 +ATOM 2423 O O . LEU B 2 41 ? -21.562 4.653 36.254 1.00 7.30 ? 33 LEU A O 1 +ATOM 2424 C CB . LEU B 2 41 ? -19.238 4.180 38.259 1.00 12.83 ? 33 LEU A CB 1 +ATOM 2425 C CG . LEU B 2 41 ? -18.342 3.533 39.316 1.00 15.46 ? 33 LEU A CG 1 +ATOM 2426 C CD1 . LEU B 2 41 ? -16.913 3.658 38.890 1.00 19.06 ? 33 LEU A CD1 1 +ATOM 2427 C CD2 . LEU B 2 41 ? -18.551 4.104 40.720 1.00 20.12 ? 33 LEU A CD2 1 +ATOM 2428 H H . LEU B 2 41 ? -21.566 2.628 37.455 1.00 10.39 ? 33 LEU A H 1 +ATOM 2429 H HA . LEU B 2 41 ? -20.976 4.447 39.321 1.00 10.13 ? 33 LEU A HA 1 +ATOM 2430 H HB2 . LEU B 2 41 ? -19.026 3.752 37.415 1.00 15.39 ? 33 LEU A HB2 1 +ATOM 2431 H HB3 . LEU B 2 41 ? -18.979 5.114 38.209 1.00 15.39 ? 33 LEU A HB3 1 +ATOM 2432 H HG . LEU B 2 41 ? -18.550 2.587 39.354 1.00 18.55 ? 33 LEU A HG 1 +ATOM 2433 H HD11 . LEU B 2 41 ? -16.347 3.247 39.562 1.00 22.87 ? 33 LEU A HD11 1 +ATOM 2434 H HD12 . LEU B 2 41 ? -16.797 3.208 38.039 1.00 22.87 ? 33 LEU A HD12 1 +ATOM 2435 H HD13 . LEU B 2 41 ? -16.691 4.598 38.801 1.00 22.87 ? 33 LEU A HD13 1 +ATOM 2436 H HD21 . LEU B 2 41 ? -17.954 3.651 41.337 1.00 24.14 ? 33 LEU A HD21 1 +ATOM 2437 H HD22 . LEU B 2 41 ? -18.355 5.054 40.707 1.00 24.14 ? 33 LEU A HD22 1 +ATOM 2438 H HD23 . LEU B 2 41 ? -19.473 3.959 40.985 1.00 24.14 ? 33 LEU A HD23 1 +ATOM 2439 N N . VAL B 2 42 ? -21.674 6.274 37.834 1.00 6.43 ? 34 VAL A N 1 +ATOM 2440 C CA . VAL B 2 42 ? -22.104 7.333 36.934 1.00 6.81 ? 34 VAL A CA 1 +ATOM 2441 C C . VAL B 2 42 ? -21.255 8.542 37.249 1.00 6.91 ? 34 VAL A C 1 +ATOM 2442 O O . VAL B 2 42 ? -21.103 8.925 38.418 1.00 7.80 ? 34 VAL A O 1 +ATOM 2443 C CB . VAL B 2 42 ? -23.576 7.716 37.153 1.00 7.47 ? 34 VAL A CB 1 +ATOM 2444 C CG1 . VAL B 2 42 ? -24.001 8.791 36.162 1.00 8.92 ? 34 VAL A CG1 1 +ATOM 2445 C CG2 . VAL B 2 42 ? -24.473 6.506 37.034 1.00 10.26 ? 34 VAL A CG2 1 +ATOM 2446 H H . VAL B 2 42 ? -21.629 6.518 38.657 1.00 7.71 ? 34 VAL A H 1 +ATOM 2447 H HA . VAL B 2 42 ? -21.968 7.072 36.009 1.00 8.17 ? 34 VAL A HA 1 +ATOM 2448 H HB . VAL B 2 42 ? -23.678 8.077 38.048 1.00 8.96 ? 34 VAL A HB 1 +ATOM 2449 H HG11 . VAL B 2 42 ? -24.931 9.016 36.320 1.00 10.71 ? 34 VAL A HG11 1 +ATOM 2450 H HG12 . VAL B 2 42 ? -23.444 9.575 36.291 1.00 10.71 ? 34 VAL A HG12 1 +ATOM 2451 H HG13 . VAL B 2 42 ? -23.890 8.450 35.261 1.00 10.71 ? 34 VAL A HG13 1 +ATOM 2452 H HG21 . VAL B 2 42 ? -25.392 6.780 37.177 1.00 12.31 ? 34 VAL A HG21 1 +ATOM 2453 H HG22 . VAL B 2 42 ? -24.374 6.127 36.147 1.00 12.31 ? 34 VAL A HG22 1 +ATOM 2454 H HG23 . VAL B 2 42 ? -24.213 5.855 37.704 1.00 12.31 ? 34 VAL A HG23 1 +ATOM 2455 N N . LYS B 2 43 ? -20.711 9.176 36.214 1.00 6.48 ? 35 LYS A N 1 +ATOM 2456 C CA . LYS B 2 43 ? -20.043 10.451 36.378 1.00 6.50 ? 35 LYS A CA 1 +ATOM 2457 C C . LYS B 2 43 ? -20.578 11.458 35.378 1.00 6.51 ? 35 LYS A C 1 +ATOM 2458 O O . LYS B 2 43 ? -20.943 11.101 34.249 1.00 6.80 ? 35 LYS A O 1 +ATOM 2459 C CB . LYS B 2 43 ? -18.533 10.330 36.162 1.00 9.02 ? 35 LYS A CB 1 +ATOM 2460 C CG . LYS B 2 43 ? -17.780 9.545 37.200 1.00 11.73 ? 35 LYS A CG 1 +ATOM 2461 C CD . LYS B 2 43 ? -16.275 9.574 36.896 1.00 15.54 ? 35 LYS A CD 1 +ATOM 2462 C CE . LYS B 2 43 ? -15.481 8.832 37.941 1.00 24.39 ? 35 LYS A CE 1 +ATOM 2463 N NZ . LYS B 2 43 ? -14.044 8.817 37.562 1.00 26.63 1 35 LYS A NZ 1 +ATOM 2464 H H . LYS B 2 43 ? -20.719 8.884 35.405 1.00 7.77 ? 35 LYS A H 1 +ATOM 2465 H HA . LYS B 2 43 ? -20.201 10.789 37.273 1.00 7.79 ? 35 LYS A HA 1 +ATOM 2466 H HB2 . LYS B 2 43 ? -18.380 9.899 35.307 1.00 10.82 ? 35 LYS A HB2 1 +ATOM 2467 H HB3 . LYS B 2 43 ? -18.155 11.223 36.145 1.00 10.82 ? 35 LYS A HB3 1 +ATOM 2468 H HG2 . LYS B 2 43 ? -17.926 9.940 38.074 1.00 14.07 ? 35 LYS A HG2 1 +ATOM 2469 H HG3 . LYS B 2 43 ? -18.079 8.623 37.189 1.00 14.07 ? 35 LYS A HG3 1 +ATOM 2470 H HD2 . LYS B 2 43 ? -16.114 9.153 36.037 1.00 18.65 ? 35 LYS A HD2 1 +ATOM 2471 H HD3 . LYS B 2 43 ? -15.970 10.495 36.880 1.00 18.65 ? 35 LYS A HD3 1 +ATOM 2472 H HE2 . LYS B 2 43 ? -15.571 9.279 38.797 1.00 29.26 ? 35 LYS A HE2 1 +ATOM 2473 H HE3 . LYS B 2 43 ? -15.795 7.916 37.999 1.00 29.26 ? 35 LYS A HE3 1 +ATOM 2474 H HZ1 . LYS B 2 43 ? -13.572 8.380 38.177 1.00 31.96 ? 35 LYS A HZ1 1 +ATOM 2475 H HZ2 . LYS B 2 43 ? -13.941 8.413 36.776 1.00 31.96 ? 35 LYS A HZ2 1 +ATOM 2476 H HZ3 . LYS B 2 43 ? -13.737 9.650 37.501 1.00 31.96 ? 35 LYS A HZ3 1 +ATOM 2477 N N . TRP B 2 44 ? -20.609 12.714 35.791 1.00 5.91 ? 36 TRP A N 1 +ATOM 2478 C CA . TRP B 2 44 ? -20.700 13.828 34.853 1.00 5.79 ? 36 TRP A CA 1 +ATOM 2479 C C . TRP B 2 44 ? -19.426 14.645 34.987 1.00 5.01 ? 36 TRP A C 1 +ATOM 2480 O O . TRP B 2 44 ? -18.911 14.845 36.097 1.00 6.40 ? 36 TRP A O 1 +ATOM 2481 C CB . TRP B 2 44 ? -21.926 14.696 35.104 1.00 5.30 ? 36 TRP A CB 1 +ATOM 2482 C CG . TRP B 2 44 ? -23.204 14.131 34.585 1.00 5.92 ? 36 TRP A CG 1 +ATOM 2483 C CD1 . TRP B 2 44 ? -24.049 13.262 35.215 1.00 6.45 ? 36 TRP A CD1 1 +ATOM 2484 C CD2 . TRP B 2 44 ? -23.791 14.416 33.319 1.00 5.07 ? 36 TRP A CD2 1 +ATOM 2485 N NE1 . TRP B 2 44 ? -25.113 12.975 34.393 1.00 6.29 ? 36 TRP A NE1 1 +ATOM 2486 C CE2 . TRP B 2 44 ? -24.987 13.680 33.230 1.00 5.52 ? 36 TRP A CE2 1 +ATOM 2487 C CE3 . TRP B 2 44 ? -23.424 15.232 32.244 1.00 5.81 ? 36 TRP A CE3 1 +ATOM 2488 C CZ2 . TRP B 2 44 ? -25.820 13.757 32.118 1.00 6.09 ? 36 TRP A CZ2 1 +ATOM 2489 C CZ3 . TRP B 2 44 ? -24.248 15.305 31.150 1.00 6.90 ? 36 TRP A CZ3 1 +ATOM 2490 C CH2 . TRP B 2 44 ? -25.431 14.587 31.096 1.00 5.86 ? 36 TRP A CH2 1 +ATOM 2491 H H . TRP B 2 44 ? -20.579 12.954 36.617 1.00 7.10 ? 36 TRP A H 1 +ATOM 2492 H HA . TRP B 2 44 ? -20.749 13.484 33.947 1.00 6.95 ? 36 TRP A HA 1 +ATOM 2493 H HB2 . TRP B 2 44 ? -22.027 14.820 36.061 1.00 6.37 ? 36 TRP A HB2 1 +ATOM 2494 H HB3 . TRP B 2 44 ? -21.790 15.556 34.676 1.00 6.37 ? 36 TRP A HB3 1 +ATOM 2495 H HD1 . TRP B 2 44 ? -23.904 12.887 36.054 1.00 7.74 ? 36 TRP A HD1 1 +ATOM 2496 H HE1 . TRP B 2 44 ? -25.769 12.455 34.590 1.00 7.55 ? 36 TRP A HE1 1 +ATOM 2497 H HE3 . TRP B 2 44 ? -22.645 15.738 32.281 1.00 6.97 ? 36 TRP A HE3 1 +ATOM 2498 H HZ2 . TRP B 2 44 ? -26.609 13.267 32.070 1.00 7.31 ? 36 TRP A HZ2 1 +ATOM 2499 H HZ3 . TRP B 2 44 ? -24.008 15.845 30.433 1.00 8.28 ? 36 TRP A HZ3 1 +ATOM 2500 H HH2 . TRP B 2 44 ? -25.954 14.635 30.328 1.00 7.03 ? 36 TRP A HH2 1 +ATOM 2501 N N . LEU B 2 45 ? -18.922 15.066 33.828 1.00 5.55 ? 37 LEU A N 1 +ATOM 2502 C CA . LEU B 2 45 ? -17.689 15.821 33.718 1.00 5.39 ? 37 LEU A CA 1 +ATOM 2503 C C . LEU B 2 45 ? -17.947 17.052 32.880 1.00 6.79 ? 37 LEU A C 1 +ATOM 2504 O O . LEU B 2 45 ? -18.904 17.109 32.100 1.00 6.66 ? 37 LEU A O 1 +ATOM 2505 C CB . LEU B 2 45 ? -16.560 14.990 33.082 1.00 6.68 ? 37 LEU A CB 1 +ATOM 2506 C CG . LEU B 2 45 ? -16.331 13.636 33.752 1.00 6.52 ? 37 LEU A CG 1 +ATOM 2507 C CD1 . LEU B 2 45 ? -17.099 12.529 33.069 1.00 8.28 ? 37 LEU A CD1 1 +ATOM 2508 C CD2 . LEU B 2 45 ? -14.854 13.289 33.780 1.00 7.86 ? 37 LEU A CD2 1 +ATOM 2509 H H . LEU B 2 45 ? -19.295 14.918 33.067 1.00 6.66 ? 37 LEU A H 1 +ATOM 2510 H HA . LEU B 2 45 ? -17.403 16.103 34.600 1.00 6.47 ? 37 LEU A HA 1 +ATOM 2511 H HB2 . LEU B 2 45 ? -16.780 14.826 32.151 1.00 8.02 ? 37 LEU A HB2 1 +ATOM 2512 H HB3 . LEU B 2 45 ? -15.733 15.492 33.140 1.00 8.02 ? 37 LEU A HB3 1 +ATOM 2513 H HG . LEU B 2 45 ? -16.640 13.687 34.670 1.00 7.83 ? 37 LEU A HG 1 +ATOM 2514 H HD11 . LEU B 2 45 ? -16.922 11.693 33.528 1.00 9.94 ? 37 LEU A HD11 1 +ATOM 2515 H HD12 . LEU B 2 45 ? -18.046 12.734 33.105 1.00 9.94 ? 37 LEU A HD12 1 +ATOM 2516 H HD13 . LEU B 2 45 ? -16.808 12.468 32.145 1.00 9.94 ? 37 LEU A HD13 1 +ATOM 2517 H HD21 . LEU B 2 45 ? -14.741 12.427 34.210 1.00 9.44 ? 37 LEU A HD21 1 +ATOM 2518 H HD22 . LEU B 2 45 ? -14.521 13.251 32.870 1.00 9.44 ? 37 LEU A HD22 1 +ATOM 2519 H HD23 . LEU B 2 45 ? -14.379 13.972 34.278 1.00 9.44 ? 37 LEU A HD23 1 +ATOM 2520 N N . VAL B 2 46 ? -17.121 18.066 33.081 1.00 6.48 ? 38 VAL A N 1 +ATOM 2521 C CA . VAL B 2 46 ? -17.174 19.260 32.277 1.00 6.48 ? 38 VAL A CA 1 +ATOM 2522 C C . VAL B 2 46 ? -15.786 19.546 31.779 1.00 7.25 ? 38 VAL A C 1 +ATOM 2523 O O . VAL B 2 46 ? -14.780 19.164 32.379 1.00 6.68 ? 38 VAL A O 1 +ATOM 2524 C CB . VAL B 2 46 ? -17.758 20.438 33.078 1.00 9.02 ? 38 VAL A CB 1 +ATOM 2525 C CG1 . VAL B 2 46 ? -16.773 20.948 34.135 1.00 9.12 ? 38 VAL A CG1 1 +ATOM 2526 C CG2 . VAL B 2 46 ? -18.240 21.550 32.174 1.00 11.36 ? 38 VAL A CG2 1 +ATOM 2527 H H . VAL B 2 46 ? -16.513 18.081 33.689 1.00 7.78 ? 38 VAL A H 1 +ATOM 2528 H HA . VAL B 2 46 ? -17.746 19.103 31.509 1.00 7.77 ? 38 VAL A HA 1 +ATOM 2529 H HB . VAL B 2 46 ? -18.536 20.112 33.557 1.00 10.83 ? 38 VAL A HB 1 +ATOM 2530 H HG11 . VAL B 2 46 ? -17.179 21.687 34.614 1.00 10.95 ? 38 VAL A HG11 1 +ATOM 2531 H HG12 . VAL B 2 46 ? -16.568 20.226 34.750 1.00 10.95 ? 38 VAL A HG12 1 +ATOM 2532 H HG13 . VAL B 2 46 ? -15.962 21.246 33.693 1.00 10.95 ? 38 VAL A HG13 1 +ATOM 2533 H HG21 . VAL B 2 46 ? -18.598 22.267 32.720 1.00 13.63 ? 38 VAL A HG21 1 +ATOM 2534 H HG22 . VAL B 2 46 ? -17.492 21.875 31.649 1.00 13.63 ? 38 VAL A HG22 1 +ATOM 2535 H HG23 . VAL B 2 46 ? -18.931 21.203 31.589 1.00 13.63 ? 38 VAL A HG23 1 +ATOM 2536 N N . ARG B 2 47 ? -15.725 20.213 30.641 1.00 8.88 ? 39 ARG A N 1 +ATOM 2537 C CA A ARG B 2 47 ? -14.465 20.553 30.042 0.51 9.63 ? 39 ARG A CA 1 +ATOM 2538 C CA B ARG B 2 47 ? -14.437 20.569 30.082 0.49 9.60 ? 39 ARG A CA 1 +ATOM 2539 C C . ARG B 2 47 ? -13.823 21.652 30.867 1.00 10.69 ? 39 ARG A C 1 +ATOM 2540 O O . ARG B 2 47 ? -14.498 22.560 31.362 1.00 12.59 ? 39 ARG A O 1 +ATOM 2541 C CB A ARG B 2 47 ? -14.728 20.991 28.598 0.51 13.53 ? 39 ARG A CB 1 +ATOM 2542 C CB B ARG B 2 47 ? -14.527 21.036 28.658 0.49 13.33 ? 39 ARG A CB 1 +ATOM 2543 C CG A ARG B 2 47 ? -13.565 20.936 27.676 0.51 10.16 ? 39 ARG A CG 1 +ATOM 2544 C CG B ARG B 2 47 ? -14.571 19.915 27.781 0.49 7.70 ? 39 ARG A CG 1 +ATOM 2545 C CD A ARG B 2 47 ? -14.012 21.087 26.235 0.51 7.77 ? 39 ARG A CD 1 +ATOM 2546 C CD B ARG B 2 47 ? -14.489 20.341 26.363 0.49 7.49 ? 39 ARG A CD 1 +ATOM 2547 N NE A ARG B 2 47 ? -14.553 19.850 25.689 0.51 7.19 ? 39 ARG A NE 1 +ATOM 2548 N NE B ARG B 2 47 ? -14.862 19.209 25.541 0.49 6.75 ? 39 ARG A NE 1 +ATOM 2549 C CZ A ARG B 2 47 ? -14.839 19.676 24.408 0.51 6.82 ? 39 ARG A CZ 1 +ATOM 2550 C CZ B ARG B 2 47 ? -14.988 19.248 24.225 0.49 7.48 ? 39 ARG A CZ 1 +ATOM 2551 N NH1 A ARG B 2 47 ? -14.640 20.662 23.552 0.51 8.36 1 39 ARG A NH1 1 +ATOM 2552 N NH1 B ARG B 2 47 ? -14.766 20.377 23.583 0.49 7.40 1 39 ARG A NH1 1 +ATOM 2553 N NH2 A ARG B 2 47 ? -15.318 18.514 23.988 0.51 7.54 ? 39 ARG A NH2 1 +ATOM 2554 N NH2 B ARG B 2 47 ? -15.339 18.156 23.562 0.49 7.83 ? 39 ARG A NH2 1 +ATOM 2555 H HA . ARG B 2 47 ? -13.865 19.788 30.074 1.00 11.52 ? 39 ARG A HA 1 +ATOM 2556 H HB2 A ARG B 2 47 ? -15.417 20.418 28.227 0.51 16.23 ? 39 ARG A HB2 1 +ATOM 2557 H HB2 B ARG B 2 47 ? -15.338 21.555 28.537 0.49 16.00 ? 39 ARG A HB2 1 +ATOM 2558 H HB3 A ARG B 2 47 ? -15.043 21.908 28.610 0.51 16.23 ? 39 ARG A HB3 1 +ATOM 2559 H HB3 B ARG B 2 47 ? -13.746 21.569 28.441 0.49 16.00 ? 39 ARG A HB3 1 +ATOM 2560 H HG2 A ARG B 2 47 ? -12.955 21.660 27.885 0.51 12.20 ? 39 ARG A HG2 1 +ATOM 2561 H HG2 B ARG B 2 47 ? -13.820 19.331 27.968 0.49 9.23 ? 39 ARG A HG2 1 +ATOM 2562 H HG3 A ARG B 2 47 ? -13.119 20.080 27.770 0.51 12.20 ? 39 ARG A HG3 1 +ATOM 2563 H HG3 B ARG B 2 47 ? -15.407 19.440 27.909 0.49 9.23 ? 39 ARG A HG3 1 +ATOM 2564 H HD2 A ARG B 2 47 ? -14.703 21.765 26.187 0.51 9.33 ? 39 ARG A HD2 1 +ATOM 2565 H HD2 B ARG B 2 47 ? -15.109 21.068 26.198 0.49 8.99 ? 39 ARG A HD2 1 +ATOM 2566 H HD3 A ARG B 2 47 ? -13.251 21.347 25.693 0.51 9.33 ? 39 ARG A HD3 1 +ATOM 2567 H HD3 B ARG B 2 47 ? -13.580 20.602 26.147 0.49 8.99 ? 39 ARG A HD3 1 +ATOM 2568 H HE A ARG B 2 47 ? -14.589 19.164 26.207 0.51 8.63 ? 39 ARG A HE 1 +ATOM 2569 H HE B ARG B 2 47 ? -15.011 18.460 25.936 0.49 8.10 ? 39 ARG A HE 1 +ATOM 2570 H HH11 A ARG B 2 47 ? -14.326 21.414 23.827 0.51 10.03 ? 39 ARG A HH11 1 +ATOM 2571 H HH11 B ARG B 2 47 ? -14.540 21.083 24.019 0.49 8.88 ? 39 ARG A HH11 1 +ATOM 2572 H HH12 A ARG B 2 47 ? -14.826 20.552 22.719 0.51 10.03 ? 39 ARG A HH12 1 +ATOM 2573 H HH12 B ARG B 2 47 ? -14.846 20.408 22.727 0.49 8.88 ? 39 ARG A HH12 1 +ATOM 2574 H HH21 A ARG B 2 47 ? -15.448 17.875 24.548 0.51 9.05 ? 39 ARG A HH21 1 +ATOM 2575 H HH21 B ARG B 2 47 ? -15.482 17.422 23.987 0.49 9.39 ? 39 ARG A HH21 1 +ATOM 2576 H HH22 A ARG B 2 47 ? -15.508 18.403 23.156 0.51 9.05 ? 39 ARG A HH22 1 +ATOM 2577 H HH22 B ARG B 2 47 ? -15.420 18.181 22.706 0.49 9.39 ? 39 ARG A HH22 1 +ATOM 2578 N N . HIS B 2 48 ? -12.528 21.560 30.974 1.00 13.45 ? 40 HIS A N 1 +ATOM 2579 C CA . HIS B 2 48 ? -11.756 22.454 31.717 1.00 10.47 ? 40 HIS A CA 1 +ATOM 2580 C C . HIS B 2 48 ? -10.510 22.796 30.868 1.00 10.64 ? 40 HIS A C 1 +ATOM 2581 O O . HIS B 2 48 ? -9.489 22.120 30.947 1.00 12.11 ? 40 HIS A O 1 +ATOM 2582 C CB . HIS B 2 48 ? -11.395 21.711 32.985 1.00 16.39 ? 40 HIS A CB 1 +ATOM 2583 C CG . HIS B 2 48 ? -10.861 22.590 34.043 1.00 18.88 ? 40 HIS A CG 1 +ATOM 2584 N ND1 . HIS B 2 48 ? -11.616 23.580 34.626 1.00 20.16 ? 40 HIS A ND1 1 +ATOM 2585 C CD2 . HIS B 2 48 ? -9.642 22.644 34.622 1.00 17.54 ? 40 HIS A CD2 1 +ATOM 2586 C CE1 . HIS B 2 48 ? -10.877 24.212 35.523 1.00 21.18 ? 40 HIS A CE1 1 +ATOM 2587 N NE2 . HIS B 2 48 ? -9.678 23.661 35.542 1.00 22.61 ? 40 HIS A NE2 1 +ATOM 2588 H H . HIS B 2 48 ? -12.063 20.943 30.596 1.00 16.15 ? 40 HIS A H 1 +ATOM 2589 H HA . HIS B 2 48 ? -12.254 23.260 31.928 1.00 12.57 ? 40 HIS A HA 1 +ATOM 2590 H HB2 . HIS B 2 48 ? -12.190 21.276 33.331 1.00 19.67 ? 40 HIS A HB2 1 +ATOM 2591 H HB3 . HIS B 2 48 ? -10.719 21.047 32.779 1.00 19.67 ? 40 HIS A HB3 1 +ATOM 2592 H HD2 . HIS B 2 48 ? -8.915 22.096 34.432 1.00 21.05 ? 40 HIS A HD2 1 +ATOM 2593 H HE1 . HIS B 2 48 ? -11.159 24.920 36.057 1.00 25.41 ? 40 HIS A HE1 1 +ATOM 2594 H HE2 . HIS B 2 48 ? -9.026 23.900 36.049 1.00 27.13 ? 40 HIS A HE2 1 +ATOM 2595 N N . GLY B 2 49 ? -10.612 23.784 29.987 1.00 9.95 ? 41 GLY A N 1 +ATOM 2596 C CA . GLY B 2 49 ? -9.579 23.995 28.984 1.00 10.38 ? 41 GLY A CA 1 +ATOM 2597 C C . GLY B 2 49 ? -9.439 22.767 28.100 1.00 9.75 ? 41 GLY A C 1 +ATOM 2598 O O . GLY B 2 49 ? -10.432 22.291 27.527 1.00 10.10 ? 41 GLY A O 1 +ATOM 2599 H H . GLY B 2 49 ? -11.266 24.342 29.949 1.00 11.94 ? 41 GLY A H 1 +ATOM 2600 H HA2 . GLY B 2 49 ? -9.808 24.756 28.429 1.00 12.46 ? 41 GLY A HA2 1 +ATOM 2601 H HA3 . GLY B 2 49 ? -8.728 24.167 29.418 1.00 12.46 ? 41 GLY A HA3 1 +ATOM 2602 N N . SER B 2 50 ? -8.230 22.210 28.028 1.00 7.80 ? 42 SER A N 1 +ATOM 2603 C CA . SER B 2 50 ? -7.952 21.093 27.141 1.00 7.38 ? 42 SER A CA 1 +ATOM 2604 C C . SER B 2 50 ? -8.037 19.732 27.805 1.00 6.70 ? 42 SER A C 1 +ATOM 2605 O O . SER B 2 50 ? -7.438 18.778 27.328 1.00 7.76 ? 42 SER A O 1 +ATOM 2606 C CB . SER B 2 50 ? -6.609 21.258 26.436 1.00 9.43 ? 42 SER A CB 1 +ATOM 2607 O OG . SER B 2 50 ? -5.561 21.567 27.323 1.00 19.52 ? 42 SER A OG 1 +ATOM 2608 H H . SER B 2 50 ? -7.551 22.467 28.489 1.00 9.36 ? 42 SER A H 1 +ATOM 2609 H HA . SER B 2 50 ? -8.629 21.101 26.446 1.00 8.86 ? 42 SER A HA 1 +ATOM 2610 H HB2 . SER B 2 50 ? -6.394 20.428 25.981 1.00 11.32 ? 42 SER A HB2 1 +ATOM 2611 H HB3 . SER B 2 50 ? -6.686 21.975 25.787 1.00 11.32 ? 42 SER A HB3 1 +ATOM 2612 H HG . SER B 2 50 ? -5.474 20.954 27.891 1.00 23.43 ? 42 SER A HG 1 +ATOM 2613 N N . ASP B 2 51 ? -8.791 19.633 28.890 1.00 7.13 ? 43 ASP A N 1 +ATOM 2614 C CA . ASP B 2 51 ? -9.118 18.314 29.445 1.00 7.10 ? 43 ASP A CA 1 +ATOM 2615 C C . ASP B 2 51 ? -10.452 18.437 30.158 1.00 7.54 ? 43 ASP A C 1 +ATOM 2616 O O . ASP B 2 51 ? -11.166 19.422 29.957 1.00 11.03 ? 43 ASP A O 1 +ATOM 2617 C CB . ASP B 2 51 ? -7.987 17.784 30.345 1.00 7.84 ? 43 ASP A CB 1 +ATOM 2618 C CG . ASP B 2 51 ? -7.860 16.275 30.306 1.00 7.45 ? 43 ASP A CG 1 +ATOM 2619 O OD1 . ASP B 2 51 ? -8.882 15.588 30.523 1.00 6.92 ? 43 ASP A OD1 1 +ATOM 2620 O OD2 . ASP B 2 51 ? -6.736 15.756 30.039 1.00 9.03 -1 43 ASP A OD2 1 +ATOM 2621 H H . ASP B 2 51 ? -9.123 20.297 29.323 1.00 8.55 ? 43 ASP A H 1 +ATOM 2622 H HA . ASP B 2 51 ? -9.230 17.687 28.714 1.00 8.52 ? 43 ASP A HA 1 +ATOM 2623 H HB2 . ASP B 2 51 ? -7.144 18.163 30.048 1.00 9.41 ? 43 ASP A HB2 1 +ATOM 2624 H HB3 . ASP B 2 51 ? -8.164 18.047 31.261 1.00 9.41 ? 43 ASP A HB3 1 +ATOM 2625 N N . SER B 2 52 ? -10.851 17.419 30.905 1.00 7.56 ? 44 SER A N 1 +ATOM 2626 C CA . SER B 2 52 ? -12.126 17.436 31.621 1.00 7.56 ? 44 SER A CA 1 +ATOM 2627 C C . SER B 2 52 ? -11.925 17.172 33.102 1.00 7.63 ? 44 SER A C 1 +ATOM 2628 O O . SER B 2 52 ? -10.909 16.604 33.514 1.00 8.58 ? 44 SER A O 1 +ATOM 2629 C CB . SER B 2 52 ? -13.098 16.424 31.019 1.00 9.45 ? 44 SER A CB 1 +ATOM 2630 O OG . SER B 2 52 ? -12.620 15.097 31.155 1.00 8.87 ? 44 SER A OG 1 +ATOM 2631 H H . SER B 2 52 ? -10.399 16.696 31.018 1.00 9.07 ? 44 SER A H 1 +ATOM 2632 H HA . SER B 2 52 ? -12.522 18.317 31.529 1.00 9.07 ? 44 SER A HA 1 +ATOM 2633 H HB2 . SER B 2 52 ? -13.950 16.498 31.477 1.00 11.34 ? 44 SER A HB2 1 +ATOM 2634 H HB3 . SER B 2 52 ? -13.212 16.621 30.076 1.00 11.34 ? 44 SER A HB3 1 +ATOM 2635 H HG . SER B 2 52 ? -13.169 14.558 30.818 1.00 10.65 ? 44 SER A HG 1 +ATOM 2636 N N . VAL B 2 53 ? -12.905 17.576 33.899 1.00 6.28 ? 45 VAL A N 1 +ATOM 2637 C CA . VAL B 2 53 ? -12.906 17.357 35.333 1.00 7.15 ? 45 VAL A CA 1 +ATOM 2638 C C . VAL B 2 53 ? -14.267 16.841 35.757 1.00 7.03 ? 45 VAL A C 1 +ATOM 2639 O O . VAL B 2 53 ? -15.300 17.194 35.182 1.00 6.91 ? 45 VAL A O 1 +ATOM 2640 C CB . VAL B 2 53 ? -12.578 18.633 36.106 1.00 8.21 ? 45 VAL A CB 1 +ATOM 2641 C CG1 . VAL B 2 53 ? -11.194 19.146 35.715 1.00 11.91 ? 45 VAL A CG1 1 +ATOM 2642 C CG2 . VAL B 2 53 ? -13.624 19.696 35.917 1.00 12.79 ? 45 VAL A CG2 1 +ATOM 2643 H H . VAL B 2 53 ? -13.603 17.994 33.619 1.00 7.54 ? 45 VAL A H 1 +ATOM 2644 H HA . VAL B 2 53 ? -12.242 16.686 35.556 1.00 8.58 ? 45 VAL A HA 1 +ATOM 2645 H HB . VAL B 2 53 ? -12.551 18.420 37.052 1.00 9.85 ? 45 VAL A HB 1 +ATOM 2646 H HG11 . VAL B 2 53 ? -11.005 19.955 36.215 1.00 14.30 ? 45 VAL A HG11 1 +ATOM 2647 H HG12 . VAL B 2 53 ? -10.535 18.465 35.925 1.00 14.30 ? 45 VAL A HG12 1 +ATOM 2648 H HG13 . VAL B 2 53 ? -11.184 19.334 34.764 1.00 14.30 ? 45 VAL A HG13 1 +ATOM 2649 H HG21 . VAL B 2 53 ? -13.370 20.483 36.425 1.00 15.35 ? 45 VAL A HG21 1 +ATOM 2650 H HG22 . VAL B 2 53 ? -13.683 19.916 34.974 1.00 15.35 ? 45 VAL A HG22 1 +ATOM 2651 H HG23 . VAL B 2 53 ? -14.477 19.359 36.232 1.00 15.35 ? 45 VAL A HG23 1 +ATOM 2652 N N . THR B 2 54 ? -14.273 16.020 36.783 1.00 6.72 ? 46 THR A N 1 +ATOM 2653 C CA . THR B 2 54 ? -15.504 15.453 37.305 1.00 6.40 ? 46 THR A CA 1 +ATOM 2654 C C . THR B 2 54 ? -16.260 16.482 38.112 1.00 7.50 ? 46 THR A C 1 +ATOM 2655 O O . THR B 2 54 ? -15.675 17.156 38.961 1.00 8.97 ? 46 THR A O 1 +ATOM 2656 C CB . THR B 2 54 ? -15.169 14.249 38.184 1.00 8.62 ? 46 THR A CB 1 +ATOM 2657 O OG1 . THR B 2 54 ? -14.498 13.286 37.376 1.00 10.11 ? 46 THR A OG1 1 +ATOM 2658 C CG2 . THR B 2 54 ? -16.414 13.641 38.776 1.00 9.60 ? 46 THR A CG2 1 +ATOM 2659 H H . THR B 2 54 ? -13.567 15.768 37.204 1.00 8.07 ? 46 THR A H 1 +ATOM 2660 H HA . THR B 2 54 ? -16.065 15.158 36.572 1.00 7.68 ? 46 THR A HA 1 +ATOM 2661 H HB . THR B 2 54 ? -14.586 14.527 38.908 1.00 10.34 ? 46 THR A HB 1 +ATOM 2662 H HG1 . THR B 2 54 ? -14.302 12.611 37.836 1.00 12.13 ? 46 THR A HG1 1 +ATOM 2663 H HG21 . THR B 2 54 ? -16.180 12.879 39.330 1.00 11.53 ? 46 THR A HG21 1 +ATOM 2664 H HG22 . THR B 2 54 ? -16.876 14.297 39.322 1.00 11.53 ? 46 THR A HG22 1 +ATOM 2665 H HG23 . THR B 2 54 ? -17.008 13.345 38.068 1.00 11.53 ? 46 THR A HG23 1 +ATOM 2666 N N . ILE B 2 55 ? -17.559 16.581 37.879 1.00 6.57 ? 47 ILE A N 1 +ATOM 2667 C CA . ILE B 2 55 ? -18.415 17.463 38.651 1.00 7.87 ? 47 ILE A CA 1 +ATOM 2668 C C . ILE B 2 55 ? -19.454 16.698 39.460 1.00 6.19 ? 47 ILE A C 1 +ATOM 2669 O O . ILE B 2 55 ? -20.082 17.277 40.330 1.00 7.86 ? 47 ILE A O 1 +ATOM 2670 C CB . ILE B 2 55 ? -19.104 18.536 37.762 1.00 8.02 ? 47 ILE A CB 1 +ATOM 2671 C CG1 . ILE B 2 55 ? -20.203 17.925 36.898 1.00 9.37 ? 47 ILE A CG1 1 +ATOM 2672 C CG2 . ILE B 2 55 ? -18.074 19.265 36.902 1.00 9.14 ? 47 ILE A CG2 1 +ATOM 2673 C CD1 . ILE B 2 55 ? -20.969 18.945 36.055 1.00 11.43 ? 47 ILE A CD1 1 +ATOM 2674 H H . ILE B 2 55 ? -17.974 16.141 37.268 1.00 7.88 ? 47 ILE A H 1 +ATOM 2675 H HA . ILE B 2 55 ? -17.857 17.938 39.286 1.00 9.45 ? 47 ILE A HA 1 +ATOM 2676 H HB . ILE B 2 55 ? -19.516 19.188 38.349 1.00 9.62 ? 47 ILE A HB 1 +ATOM 2677 H HG12 . ILE B 2 55 ? -19.802 17.282 36.292 1.00 11.24 ? 47 ILE A HG12 1 +ATOM 2678 H HG13 . ILE B 2 55 ? -20.841 17.478 37.475 1.00 11.24 ? 47 ILE A HG13 1 +ATOM 2679 H HG21 . ILE B 2 55 ? -18.529 19.927 36.358 1.00 10.97 ? 47 ILE A HG21 1 +ATOM 2680 H HG22 . ILE B 2 55 ? -17.429 19.699 37.482 1.00 10.97 ? 47 ILE A HG22 1 +ATOM 2681 H HG23 . ILE B 2 55 ? -17.625 18.620 36.332 1.00 10.97 ? 47 ILE A HG23 1 +ATOM 2682 H HD11 . ILE B 2 55 ? -21.646 18.482 35.537 1.00 13.72 ? 47 ILE A HD11 1 +ATOM 2683 H HD12 . ILE B 2 55 ? -21.388 19.590 36.646 1.00 13.72 ? 47 ILE A HD12 1 +ATOM 2684 H HD13 . ILE B 2 55 ? -20.348 19.394 35.461 1.00 13.72 ? 47 ILE A HD13 1 +ATOM 2685 N N . PHE B 2 56 ? -19.625 15.414 39.169 1.00 6.37 ? 48 PHE A N 1 +ATOM 2686 C CA . PHE B 2 56 ? -20.614 14.582 39.838 1.00 6.85 ? 48 PHE A CA 1 +ATOM 2687 C C . PHE B 2 56 ? -20.173 13.147 39.735 1.00 5.73 ? 48 PHE A C 1 +ATOM 2688 O O . PHE B 2 56 ? -19.718 12.712 38.694 1.00 6.74 ? 48 PHE A O 1 +ATOM 2689 C CB . PHE B 2 56 ? -21.989 14.726 39.161 1.00 7.11 ? 48 PHE A CB 1 +ATOM 2690 C CG . PHE B 2 56 ? -22.993 13.710 39.615 1.00 7.31 ? 48 PHE A CG 1 +ATOM 2691 C CD1 . PHE B 2 56 ? -23.838 13.988 40.672 1.00 8.09 ? 48 PHE A CD1 1 +ATOM 2692 C CD2 . PHE B 2 56 ? -23.051 12.463 39.037 1.00 6.83 ? 48 PHE A CD2 1 +ATOM 2693 C CE1 . PHE B 2 56 ? -24.746 13.044 41.115 1.00 8.36 ? 48 PHE A CE1 1 +ATOM 2694 C CE2 . PHE B 2 56 ? -23.941 11.524 39.489 1.00 7.22 ? 48 PHE A CE2 1 +ATOM 2695 C CZ . PHE B 2 56 ? -24.781 11.806 40.516 1.00 8.36 ? 48 PHE A CZ 1 +ATOM 2696 H H . PHE B 2 56 ? -19.169 14.993 38.573 1.00 7.65 ? 48 PHE A H 1 +ATOM 2697 H HA . PHE B 2 56 ? -20.687 14.830 40.773 1.00 8.21 ? 48 PHE A HA 1 +ATOM 2698 H HB2 . PHE B 2 56 ? -22.345 15.606 39.362 1.00 8.54 ? 48 PHE A HB2 1 +ATOM 2699 H HB3 . PHE B 2 56 ? -21.878 14.628 38.203 1.00 8.54 ? 48 PHE A HB3 1 +ATOM 2700 H HD1 . PHE B 2 56 ? -23.806 14.823 41.078 1.00 9.71 ? 48 PHE A HD1 1 +ATOM 2701 H HD2 . PHE B 2 56 ? -22.476 12.253 38.337 1.00 8.20 ? 48 PHE A HD2 1 +ATOM 2702 H HE1 . PHE B 2 56 ? -25.318 13.240 41.821 1.00 10.03 ? 48 PHE A HE1 1 +ATOM 2703 H HE2 . PHE B 2 56 ? -23.978 10.689 39.080 1.00 8.66 ? 48 PHE A HE2 1 +ATOM 2704 H HZ . PHE B 2 56 ? -25.393 11.168 40.806 1.00 10.03 ? 48 PHE A HZ 1 +ATOM 2705 N N . LEU B 2 57 ? -20.368 12.405 40.817 1.00 6.56 ? 49 LEU A N 1 +ATOM 2706 C CA . LEU B 2 57 ? -20.137 10.982 40.839 1.00 6.87 ? 49 LEU A CA 1 +ATOM 2707 C C . LEU B 2 57 ? -21.238 10.310 41.649 1.00 6.97 ? 49 LEU A C 1 +ATOM 2708 O O . LEU B 2 57 ? -21.561 10.775 42.750 1.00 8.01 ? 49 LEU A O 1 +ATOM 2709 C CB . LEU B 2 57 ? -18.785 10.706 41.495 1.00 9.11 ? 49 LEU A CB 1 +ATOM 2710 C CG . LEU B 2 57 ? -18.539 9.260 41.929 1.00 16.64 ? 49 LEU A CG 1 +ATOM 2711 C CD1 . LEU B 2 57 ? -18.269 8.426 40.733 1.00 14.89 ? 49 LEU A CD1 1 +ATOM 2712 C CD2 . LEU B 2 57 ? -17.392 9.174 42.930 1.00 18.03 ? 49 LEU A CD2 1 +ATOM 2713 H H . LEU B 2 57 ? -20.642 12.720 41.569 1.00 7.87 ? 49 LEU A H 1 +ATOM 2714 H HA . LEU B 2 57 ? -20.137 10.625 39.937 1.00 8.24 ? 49 LEU A HA 1 +ATOM 2715 H HB2 . LEU B 2 57 ? -18.086 10.942 40.865 1.00 10.93 ? 49 LEU A HB2 1 +ATOM 2716 H HB3 . LEU B 2 57 ? -18.709 11.263 42.285 1.00 10.93 ? 49 LEU A HB3 1 +ATOM 2717 H HG . LEU B 2 57 ? -19.338 8.918 42.359 1.00 19.97 ? 49 LEU A HG 1 +ATOM 2718 H HD11 . LEU B 2 57 ? -18.114 7.511 41.015 1.00 17.87 ? 49 LEU A HD11 1 +ATOM 2719 H HD12 . LEU B 2 57 ? -19.037 8.465 40.142 1.00 17.87 ? 49 LEU A HD12 1 +ATOM 2720 H HD13 . LEU B 2 57 ? -17.484 8.770 40.279 1.00 17.87 ? 49 LEU A HD13 1 +ATOM 2721 H HD21 . LEU B 2 57 ? -17.263 8.246 43.184 1.00 21.64 ? 49 LEU A HD21 1 +ATOM 2722 H HD22 . LEU B 2 57 ? -16.585 9.519 42.516 1.00 21.64 ? 49 LEU A HD22 1 +ATOM 2723 H HD23 . LEU B 2 57 ? -17.615 9.703 43.712 1.00 21.64 ? 49 LEU A HD23 1 +ATOM 2724 N N . ARG B 2 58 ? -21.791 9.226 41.121 1.00 7.03 ? 50 ARG A N 1 +ATOM 2725 C CA . ARG B 2 58 ? -22.692 8.354 41.868 1.00 7.45 ? 50 ARG A CA 1 +ATOM 2726 C C . ARG B 2 58 ? -22.057 7.000 41.903 1.00 6.47 ? 50 ARG A C 1 +ATOM 2727 O O . ARG B 2 58 ? -21.668 6.448 40.872 1.00 7.85 ? 50 ARG A O 1 +ATOM 2728 C CB . ARG B 2 58 ? -24.075 8.254 41.218 1.00 7.55 ? 50 ARG A CB 1 +ATOM 2729 C CG . ARG B 2 58 ? -24.993 7.214 41.889 1.00 6.62 ? 50 ARG A CG 1 +ATOM 2730 C CD . ARG B 2 58 ? -26.402 7.247 41.331 1.00 7.46 ? 50 ARG A CD 1 +ATOM 2731 N NE . ARG B 2 58 ? -26.999 8.539 41.577 1.00 6.74 ? 50 ARG A NE 1 +ATOM 2732 C CZ . ARG B 2 58 ? -27.948 9.099 40.836 1.00 7.03 ? 50 ARG A CZ 1 +ATOM 2733 N NH1 . ARG B 2 58 ? -28.474 8.452 39.808 1.00 6.55 1 50 ARG A NH1 1 +ATOM 2734 N NH2 . ARG B 2 58 ? -28.358 10.317 41.127 1.00 6.92 ? 50 ARG A NH2 1 +ATOM 2735 H H . ARG B 2 58 ? -21.657 8.967 40.312 1.00 8.43 ? 50 ARG A H 1 +ATOM 2736 H HA . ARG B 2 58 ? -22.792 8.679 42.776 1.00 8.94 ? 50 ARG A HA 1 +ATOM 2737 H HB2 . ARG B 2 58 ? -24.512 9.118 41.275 1.00 9.06 ? 50 ARG A HB2 1 +ATOM 2738 H HB3 . ARG B 2 58 ? -23.967 8.000 40.288 1.00 9.06 ? 50 ARG A HB3 1 +ATOM 2739 H HG2 . ARG B 2 58 ? -24.630 6.327 41.739 1.00 7.95 ? 50 ARG A HG2 1 +ATOM 2740 H HG3 . ARG B 2 58 ? -25.040 7.399 42.840 1.00 7.95 ? 50 ARG A HG3 1 +ATOM 2741 H HD2 . ARG B 2 58 ? -26.377 7.095 40.374 1.00 8.96 ? 50 ARG A HD2 1 +ATOM 2742 H HD3 . ARG B 2 58 ? -26.941 6.570 41.770 1.00 8.96 ? 50 ARG A HD3 1 +ATOM 2743 H HE . ARG B 2 58 ? -26.717 8.982 42.258 1.00 8.09 ? 50 ARG A HE 1 +ATOM 2744 H HH11 . ARG B 2 58 ? -28.192 7.664 39.606 1.00 7.86 ? 50 ARG A HH11 1 +ATOM 2745 H HH12 . ARG B 2 58 ? -29.094 8.820 39.339 1.00 7.86 ? 50 ARG A HH12 1 +ATOM 2746 H HH21 . ARG B 2 58 ? -28.026 10.732 41.803 1.00 8.30 ? 50 ARG A HH21 1 +ATOM 2747 H HH22 . ARG B 2 58 ? -28.992 10.677 40.671 1.00 8.30 ? 50 ARG A HH22 1 +ATOM 2748 N N . ASP B 2 59 ? -21.943 6.474 43.119 1.00 8.34 ? 51 ASP A N 1 +ATOM 2749 C CA . ASP B 2 59 ? -21.413 5.152 43.342 1.00 9.93 ? 51 ASP A CA 1 +ATOM 2750 C C . ASP B 2 59 ? -22.205 4.478 44.465 1.00 9.42 ? 51 ASP A C 1 +ATOM 2751 O O . ASP B 2 59 ? -23.302 4.876 44.788 1.00 8.50 ? 51 ASP A O 1 +ATOM 2752 C CB . ASP B 2 59 ? -19.898 5.224 43.632 1.00 12.93 ? 51 ASP A CB 1 +ATOM 2753 C CG . ASP B 2 59 ? -19.549 5.988 44.913 1.00 13.48 ? 51 ASP A CG 1 +ATOM 2754 O OD1 . ASP B 2 59 ? -20.420 6.336 45.734 1.00 12.05 ? 51 ASP A OD1 1 +ATOM 2755 O OD2 . ASP B 2 59 ? -18.332 6.274 45.080 1.00 16.37 -1 51 ASP A OD2 1 +ATOM 2756 H H . ASP B 2 59 ? -22.174 6.880 43.842 1.00 10.01 ? 51 ASP A H 1 +ATOM 2757 H HA . ASP B 2 59 ? -21.535 4.626 42.536 1.00 11.91 ? 51 ASP A HA 1 +ATOM 2758 H HB2 . ASP B 2 59 ? -19.553 4.322 43.721 1.00 15.52 ? 51 ASP A HB2 1 +ATOM 2759 H HB3 . ASP B 2 59 ? -19.460 5.672 42.891 1.00 15.52 ? 51 ASP A HB3 1 +ATOM 2760 N N . SER B 2 60 ? -21.618 3.451 45.074 1.00 10.02 ? 52 SER A N 1 +ATOM 2761 C CA . SER B 2 60 ? -22.348 2.638 46.039 1.00 9.60 ? 52 SER A CA 1 +ATOM 2762 C C . SER B 2 60 ? -22.627 3.411 47.310 1.00 9.96 ? 52 SER A C 1 +ATOM 2763 O O . SER B 2 60 ? -23.451 2.980 48.114 1.00 9.53 ? 52 SER A O 1 +ATOM 2764 C CB . SER B 2 60 ? -21.574 1.373 46.372 1.00 13.41 ? 52 SER A CB 1 +ATOM 2765 O OG . SER B 2 60 ? -20.409 1.714 47.107 1.00 15.08 ? 52 SER A OG 1 +ATOM 2766 H H . SER B 2 60 ? -20.804 3.206 44.946 1.00 12.03 ? 52 SER A H 1 +ATOM 2767 H HA . SER B 2 60 ? -23.199 2.377 45.654 1.00 11.52 ? 52 SER A HA 1 +ATOM 2768 H HB2 . SER B 2 60 ? -22.131 0.788 46.909 1.00 16.09 ? 52 SER A HB2 1 +ATOM 2769 H HB3 . SER B 2 60 ? -21.315 0.929 45.549 1.00 16.09 ? 52 SER A HB3 1 +ATOM 2770 H HG . SER B 2 60 ? -19.975 1.020 47.296 1.00 18.09 ? 52 SER A HG 1 +ATOM 2771 N N . THR B 2 61 ? -21.939 4.536 47.525 1.00 10.92 ? 53 THR A N 1 +ATOM 2772 C CA . THR B 2 61 ? -22.231 5.383 48.681 1.00 14.19 ? 53 THR A CA 1 +ATOM 2773 C C . THR B 2 61 ? -23.042 6.625 48.344 1.00 12.54 ? 53 THR A C 1 +ATOM 2774 O O . THR B 2 61 ? -23.155 7.552 49.152 1.00 13.04 ? 53 THR A O 1 +ATOM 2775 C CB . THR B 2 61 ? -20.968 5.815 49.467 1.00 15.23 ? 53 THR A CB 1 +ATOM 2776 O OG1 . THR B 2 61 ? -20.197 6.747 48.709 1.00 16.39 ? 53 THR A OG1 1 +ATOM 2777 C CG2 . THR B 2 61 ? -20.115 4.603 49.834 1.00 20.29 ? 53 THR A CG2 1 +ATOM 2778 H H . THR B 2 61 ? -21.306 4.827 47.021 1.00 13.11 ? 53 THR A H 1 +ATOM 2779 H HA . THR B 2 61 ? -22.772 4.860 49.293 1.00 17.02 ? 53 THR A HA 1 +ATOM 2780 H HB . THR B 2 61 ? -21.247 6.241 50.293 1.00 18.28 ? 53 THR A HB 1 +ATOM 2781 H HG1 . THR B 2 61 ? -19.956 6.397 47.984 1.00 19.67 ? 53 THR A HG1 1 +ATOM 2782 H HG21 . THR B 2 61 ? -19.329 4.888 50.326 1.00 24.34 ? 53 THR A HG21 1 +ATOM 2783 H HG22 . THR B 2 61 ? -20.627 3.992 50.387 1.00 24.34 ? 53 THR A HG22 1 +ATOM 2784 H HG23 . THR B 2 61 ? -19.833 4.140 49.030 1.00 24.34 ? 53 THR A HG23 1 +ATOM 2785 N N . GLY B 2 62 ? -23.631 6.633 47.146 1.00 10.47 ? 54 GLY A N 1 +ATOM 2786 C CA . GLY B 2 62 ? -24.506 7.710 46.746 1.00 9.95 ? 54 GLY A CA 1 +ATOM 2787 C C . GLY B 2 62 ? -23.825 8.757 45.888 1.00 7.34 ? 54 GLY A C 1 +ATOM 2788 O O . GLY B 2 62 ? -22.907 8.459 45.140 1.00 8.39 ? 54 GLY A O 1 +ATOM 2789 H H . GLY B 2 62 ? -23.532 6.020 46.551 1.00 12.57 ? 54 GLY A H 1 +ATOM 2790 H HA2 . GLY B 2 62 ? -25.252 7.346 46.245 1.00 11.94 ? 54 GLY A HA2 1 +ATOM 2791 H HA3 . GLY B 2 62 ? -24.856 8.148 47.538 1.00 11.94 ? 54 GLY A HA3 1 +ATOM 2792 N N . ASP B 2 63 ? -24.320 9.975 46.009 1.00 7.64 ? 55 ASP A N 1 +ATOM 2793 C CA . ASP B 2 63 ? -23.949 11.058 45.111 1.00 8.60 ? 55 ASP A CA 1 +ATOM 2794 C C . ASP B 2 63 ? -22.919 11.939 45.777 1.00 9.23 ? 55 ASP A C 1 +ATOM 2795 O O . ASP B 2 63 ? -22.986 12.232 46.991 1.00 11.41 ? 55 ASP A O 1 +ATOM 2796 C CB . ASP B 2 63 ? -25.174 11.906 44.743 1.00 9.12 ? 55 ASP A CB 1 +ATOM 2797 C CG . ASP B 2 63 ? -26.106 11.206 43.781 1.00 7.84 ? 55 ASP A CG 1 +ATOM 2798 O OD1 . ASP B 2 63 ? -25.858 10.028 43.482 1.00 8.61 ? 55 ASP A OD1 1 +ATOM 2799 O OD2 . ASP B 2 63 ? -27.086 11.822 43.323 1.00 8.66 -1 55 ASP A OD2 1 +ATOM 2800 H H . ASP B 2 63 ? -24.884 10.207 46.615 1.00 9.17 ? 55 ASP A H 1 +ATOM 2801 H HA . ASP B 2 63 ? -23.567 10.692 44.297 1.00 10.32 ? 55 ASP A HA 1 +ATOM 2802 H HB2 . ASP B 2 63 ? -25.673 12.106 45.551 1.00 10.95 ? 55 ASP A HB2 1 +ATOM 2803 H HB3 . ASP B 2 63 ? -24.875 12.728 44.326 1.00 10.95 ? 55 ASP A HB3 1 +ATOM 2804 N N . HIS B 2 64 ? -21.974 12.390 44.970 1.00 7.89 ? 56 HIS A N 1 +ATOM 2805 C CA . HIS B 2 64 ? -20.881 13.227 45.422 1.00 8.61 ? 56 HIS A CA 1 +ATOM 2806 C C . HIS B 2 64 ? -20.713 14.394 44.481 1.00 8.31 ? 56 HIS A C 1 +ATOM 2807 O O . HIS B 2 64 ? -20.449 14.206 43.288 1.00 8.80 ? 56 HIS A O 1 +ATOM 2808 C CB . HIS B 2 64 ? -19.601 12.406 45.459 1.00 9.93 ? 56 HIS A CB 1 +ATOM 2809 C CG . HIS B 2 64 ? -19.768 11.098 46.163 1.00 10.47 ? 56 HIS A CG 1 +ATOM 2810 N ND1 . HIS B 2 64 ? -19.760 10.986 47.536 1.00 15.83 ? 56 HIS A ND1 1 +ATOM 2811 C CD2 . HIS B 2 64 ? -20.039 9.862 45.686 1.00 11.58 ? 56 HIS A CD2 1 +ATOM 2812 C CE1 . HIS B 2 64 ? -19.987 9.725 47.871 1.00 14.00 ? 56 HIS A CE1 1 +ATOM 2813 N NE2 . HIS B 2 64 ? -20.154 9.025 46.765 1.00 13.68 ? 56 HIS A NE2 1 +ATOM 2814 H H . HIS B 2 64 ? -21.945 12.217 44.128 1.00 9.47 ? 56 HIS A H 1 +ATOM 2815 H HA . HIS B 2 64 ? -21.067 13.564 46.312 1.00 10.33 ? 56 HIS A HA 1 +ATOM 2816 H HB2 . HIS B 2 64 ? -19.318 12.222 44.550 1.00 11.92 ? 56 HIS A HB2 1 +ATOM 2817 H HB3 . HIS B 2 64 ? -18.916 12.910 45.925 1.00 11.92 ? 56 HIS A HB3 1 +ATOM 2818 H HD2 . HIS B 2 64 ? -20.116 9.621 44.791 1.00 13.89 ? 56 HIS A HD2 1 +ATOM 2819 H HE1 . HIS B 2 64 ? -20.012 9.389 48.737 1.00 16.80 ? 56 HIS A HE1 1 +ATOM 2820 H HE2 . HIS B 2 64 ? -20.308 8.180 46.727 1.00 16.42 ? 56 HIS A HE2 1 +ATOM 2821 N N . ILE B 2 65 ? -20.933 15.583 45.018 1.00 9.50 ? 57 ILE A N 1 +ATOM 2822 C CA . ILE B 2 65 ? -20.807 16.840 44.286 1.00 11.30 ? 57 ILE A CA 1 +ATOM 2823 C C . ILE B 2 65 ? -20.054 17.757 45.220 1.00 13.43 ? 57 ILE A C 1 +ATOM 2824 O O . ILE B 2 65 ? -20.628 18.344 46.147 1.00 14.54 ? 57 ILE A O 1 +ATOM 2825 C CB . ILE B 2 65 ? -22.162 17.471 43.986 1.00 12.20 ? 57 ILE A CB 1 +ATOM 2826 C CG1 . ILE B 2 65 ? -23.034 16.498 43.202 1.00 15.17 ? 57 ILE A CG1 1 +ATOM 2827 C CG2 . ILE B 2 65 ? -21.992 18.778 43.194 1.00 12.97 ? 57 ILE A CG2 1 +ATOM 2828 C CD1 . ILE B 2 65 ? -24.473 16.916 43.101 1.00 16.43 ? 57 ILE A CD1 1 +ATOM 2829 H H . ILE B 2 65 ? -21.166 15.694 45.838 1.00 11.40 ? 57 ILE A H 1 +ATOM 2830 H HA . ILE B 2 65 ? -20.306 16.717 43.465 1.00 13.56 ? 57 ILE A HA 1 +ATOM 2831 H HB . ILE B 2 65 ? -22.602 17.674 44.826 1.00 14.63 ? 57 ILE A HB 1 +ATOM 2832 H HG12 . ILE B 2 65 ? -22.684 16.421 42.301 1.00 18.20 ? 57 ILE A HG12 1 +ATOM 2833 H HG13 . ILE B 2 65 ? -23.007 15.632 43.639 1.00 18.20 ? 57 ILE A HG13 1 +ATOM 2834 H HG21 . ILE B 2 65 ? -22.868 19.156 43.018 1.00 15.56 ? 57 ILE A HG21 1 +ATOM 2835 H HG22 . ILE B 2 65 ? -21.462 19.399 43.719 1.00 15.56 ? 57 ILE A HG22 1 +ATOM 2836 H HG23 . ILE B 2 65 ? -21.541 18.583 42.358 1.00 15.56 ? 57 ILE A HG23 1 +ATOM 2837 H HD11 . ILE B 2 65 ? -24.960 16.249 42.591 1.00 19.72 ? 57 ILE A HD11 1 +ATOM 2838 H HD12 . ILE B 2 65 ? -24.844 16.986 43.994 1.00 19.72 ? 57 ILE A HD12 1 +ATOM 2839 H HD13 . ILE B 2 65 ? -24.521 17.775 42.654 1.00 19.72 ? 57 ILE A HD13 1 +ATOM 2840 N N . GLN B 2 66 ? -18.753 17.856 44.998 1.00 13.68 ? 58 GLN A N 1 +ATOM 2841 C CA . GLN B 2 66 ? -17.873 18.421 46.016 1.00 16.74 ? 58 GLN A CA 1 +ATOM 2842 C C . GLN B 2 66 ? -17.281 19.791 45.690 1.00 16.67 ? 58 GLN A C 1 +ATOM 2843 O O . GLN B 2 66 ? -16.629 20.393 46.548 1.00 18.00 ? 58 GLN A O 1 +ATOM 2844 C CB . GLN B 2 66 ? -16.752 17.428 46.305 1.00 20.54 ? 58 GLN A CB 1 +ATOM 2845 C CG . GLN B 2 66 ? -17.260 16.084 46.815 1.00 24.42 ? 58 GLN A CG 1 +ATOM 2846 C CD . GLN B 2 66 ? -16.214 14.997 46.727 1.00 26.20 ? 58 GLN A CD 1 +ATOM 2847 O OE1 . GLN B 2 66 ? -15.980 14.427 45.659 1.00 30.43 ? 58 GLN A OE1 1 +ATOM 2848 N NE2 . GLN B 2 66 ? -15.576 14.705 47.850 1.00 33.33 ? 58 GLN A NE2 1 +ATOM 2849 H H . GLN B 2 66 ? -18.355 17.608 44.277 1.00 16.42 ? 58 GLN A H 1 +ATOM 2850 H HA . GLN B 2 66 ? -18.385 18.521 46.833 1.00 20.08 ? 58 GLN A HA 1 +ATOM 2851 H HB2 . GLN B 2 66 ? -16.254 17.269 45.488 1.00 24.65 ? 58 GLN A HB2 1 +ATOM 2852 H HB3 . GLN B 2 66 ? -16.167 17.803 46.982 1.00 24.65 ? 58 GLN A HB3 1 +ATOM 2853 H HG2 . GLN B 2 66 ? -17.520 16.176 47.745 1.00 29.30 ? 58 GLN A HG2 1 +ATOM 2854 H HG3 . GLN B 2 66 ? -18.023 15.811 46.282 1.00 29.30 ? 58 GLN A HG3 1 +ATOM 2855 H HE21 . GLN B 2 66 ? -15.767 15.127 48.575 1.00 40.00 ? 58 GLN A HE21 1 +ATOM 2856 H HE22 . GLN B 2 66 ? -14.972 14.094 47.854 1.00 40.00 ? 58 GLN A HE22 1 +ATOM 2857 N N . GLN B 2 67 ? -17.475 20.288 44.474 1.00 13.90 ? 59 GLN A N 1 +ATOM 2858 C CA . GLN B 2 67 ? -17.056 21.654 44.169 1.00 11.10 ? 59 GLN A CA 1 +ATOM 2859 C C . GLN B 2 67 ? -18.101 22.664 44.670 1.00 11.00 ? 59 GLN A C 1 +ATOM 2860 O O . GLN B 2 67 ? -19.303 22.490 44.434 1.00 9.61 ? 59 GLN A O 1 +ATOM 2861 C CB . GLN B 2 67 ? -16.823 21.830 42.666 1.00 13.78 ? 59 GLN A CB 1 +ATOM 2862 C CG . GLN B 2 67 ? -15.803 20.863 42.033 1.00 16.40 ? 59 GLN A CG 1 +ATOM 2863 C CD . GLN B 2 67 ? -15.565 21.137 40.555 1.00 14.59 ? 59 GLN A CD 1 +ATOM 2864 O OE1 . GLN B 2 67 ? -15.414 22.280 40.148 1.00 17.41 ? 59 GLN A OE1 1 +ATOM 2865 N NE2 . GLN B 2 67 ? -15.489 20.080 39.758 1.00 22.88 ? 59 GLN A NE2 1 +ATOM 2866 H H . GLN B 2 67 ? -17.838 19.866 43.818 1.00 16.69 ? 59 GLN A H 1 +ATOM 2867 H HA . GLN B 2 67 ? -16.220 21.836 44.626 1.00 13.32 ? 59 GLN A HA 1 +ATOM 2868 H HB2 . GLN B 2 67 ? -17.668 21.703 42.208 1.00 16.54 ? 59 GLN A HB2 1 +ATOM 2869 H HB3 . GLN B 2 67 ? -16.503 22.733 42.510 1.00 16.54 ? 59 GLN A HB3 1 +ATOM 2870 H HG2 . GLN B 2 67 ? -14.955 20.952 42.495 1.00 19.68 ? 59 GLN A HG2 1 +ATOM 2871 H HG3 . GLN B 2 67 ? -16.134 19.955 42.120 1.00 19.68 ? 59 GLN A HG3 1 +ATOM 2872 H HE21 . GLN B 2 67 ? -15.573 19.289 40.084 1.00 27.46 ? 59 GLN A HE21 1 +ATOM 2873 H HE22 . GLN B 2 67 ? -15.355 20.186 38.915 1.00 27.46 ? 59 GLN A HE22 1 +ATOM 2874 N N . ALA B 2 68 ? -17.662 23.727 45.352 1.00 12.93 ? 60 ALA A N 1 +ATOM 2875 C CA . ALA B 2 68 ? -18.571 24.748 45.860 1.00 13.00 ? 60 ALA A CA 1 +ATOM 2876 C C . ALA B 2 68 ? -19.425 25.368 44.764 1.00 11.15 ? 60 ALA A C 1 +ATOM 2877 O O . ALA B 2 68 ? -20.559 25.776 45.011 1.00 12.18 ? 60 ALA A O 1 +ATOM 2878 C CB . ALA B 2 68 ? -17.803 25.855 46.586 1.00 16.21 ? 60 ALA A CB 1 +ATOM 2879 H H . ALA B 2 68 ? -16.834 23.876 45.534 1.00 15.51 ? 60 ALA A H 1 +ATOM 2880 H HA . ALA B 2 68 ? -19.171 24.336 46.502 1.00 15.60 ? 60 ALA A HA 1 +ATOM 2881 H HB1 . ALA B 2 68 ? -18.434 26.516 46.910 1.00 19.45 ? 60 ALA A HB1 1 +ATOM 2882 H HB2 . ALA B 2 68 ? -17.319 25.466 47.331 1.00 19.45 ? 60 ALA A HB2 1 +ATOM 2883 H HB3 . ALA B 2 68 ? -17.182 26.267 45.965 1.00 19.45 ? 60 ALA A HB3 1 +ATOM 2884 N N . LYS B 2 69 ? -18.873 25.464 43.562 1.00 11.07 ? 61 LYS A N 1 +ATOM 2885 C CA . LYS B 2 69 ? -19.618 26.086 42.486 1.00 10.93 ? 61 LYS A CA 1 +ATOM 2886 C C . LYS B 2 69 ? -20.807 25.233 42.040 1.00 10.28 ? 61 LYS A C 1 +ATOM 2887 O O . LYS B 2 69 ? -21.698 25.759 41.373 1.00 12.10 ? 61 LYS A O 1 +ATOM 2888 C CB . LYS B 2 69 ? -18.719 26.414 41.293 1.00 14.51 ? 61 LYS A CB 1 +ATOM 2889 C CG . LYS B 2 69 ? -18.210 25.211 40.559 1.00 13.85 ? 61 LYS A CG 1 +ATOM 2890 C CD . LYS B 2 69 ? -17.085 25.537 39.562 1.00 19.76 ? 61 LYS A CD 1 +ATOM 2891 C CE . LYS B 2 69 ? -17.582 26.190 38.300 1.00 21.57 ? 61 LYS A CE 1 +ATOM 2892 N NZ . LYS B 2 69 ? -16.424 26.517 37.409 1.00 23.18 1 61 LYS A NZ 1 +ATOM 2893 H H . LYS B 2 69 ? -18.088 25.185 43.349 1.00 13.29 ? 61 LYS A H 1 +ATOM 2894 H HA . LYS B 2 69 ? -19.976 26.926 42.814 1.00 13.11 ? 61 LYS A HA 1 +ATOM 2895 H HB2 . LYS B 2 69 ? -19.223 26.953 40.663 1.00 17.42 ? 61 LYS A HB2 1 +ATOM 2896 H HB3 . LYS B 2 69 ? -17.950 26.914 41.610 1.00 17.42 ? 61 LYS A HB3 1 +ATOM 2897 H HG2 . LYS B 2 69 ? -17.863 24.574 41.203 1.00 16.62 ? 61 LYS A HG2 1 +ATOM 2898 H HG3 . LYS B 2 69 ? -18.943 24.813 40.063 1.00 16.62 ? 61 LYS A HG3 1 +ATOM 2899 H HD2 . LYS B 2 69 ? -16.456 26.143 39.984 1.00 23.71 ? 61 LYS A HD2 1 +ATOM 2900 H HD3 . LYS B 2 69 ? -16.636 24.713 39.314 1.00 23.71 ? 61 LYS A HD3 1 +ATOM 2901 H HE2 . LYS B 2 69 ? -18.173 25.582 37.829 1.00 25.89 ? 61 LYS A HE2 1 +ATOM 2902 H HE3 . LYS B 2 69 ? -18.045 27.014 38.520 1.00 25.89 ? 61 LYS A HE3 1 +ATOM 2903 H HZ1 . LYS B 2 69 ? -16.715 26.904 36.662 1.00 27.81 ? 61 LYS A HZ1 1 +ATOM 2904 H HZ2 . LYS B 2 69 ? -15.868 27.074 37.825 1.00 27.81 ? 61 LYS A HZ2 1 +ATOM 2905 H HZ3 . LYS B 2 69 ? -15.984 25.773 37.197 1.00 27.81 ? 61 LYS A HZ3 1 +ATOM 2906 N N . TYR B 2 70 ? -20.827 23.948 42.408 1.00 7.41 ? 62 TYR A N 1 +ATOM 2907 C CA . TYR B 2 70 ? -21.887 23.036 41.947 1.00 7.19 ? 62 TYR A CA 1 +ATOM 2908 C C . TYR B 2 70 ? -22.752 22.490 43.070 1.00 7.21 ? 62 TYR A C 1 +ATOM 2909 O O . TYR B 2 70 ? -23.921 22.138 42.848 1.00 7.45 ? 62 TYR A O 1 +ATOM 2910 C CB . TYR B 2 70 ? -21.284 21.855 41.187 1.00 7.81 ? 62 TYR A CB 1 +ATOM 2911 C CG . TYR B 2 70 ? -20.631 22.245 39.890 1.00 7.05 ? 62 TYR A CG 1 +ATOM 2912 C CD1 . TYR B 2 70 ? -21.356 22.901 38.911 1.00 6.43 ? 62 TYR A CD1 1 +ATOM 2913 C CD2 . TYR B 2 70 ? -19.295 21.953 39.634 1.00 8.12 ? 62 TYR A CD2 1 +ATOM 2914 C CE1 . TYR B 2 70 ? -20.773 23.264 37.726 1.00 8.01 ? 62 TYR A CE1 1 +ATOM 2915 C CE2 . TYR B 2 70 ? -18.707 22.316 38.451 1.00 9.44 ? 62 TYR A CE2 1 +ATOM 2916 C CZ . TYR B 2 70 ? -19.447 22.956 37.499 1.00 7.32 ? 62 TYR A CZ 1 +ATOM 2917 O OH . TYR B 2 70 ? -18.833 23.302 36.328 1.00 8.91 ? 62 TYR A OH 1 +ATOM 2918 H H . TYR B 2 70 ? -20.243 23.579 42.921 1.00 8.89 ? 62 TYR A H 1 +ATOM 2919 H HA . TYR B 2 70 ? -22.466 23.517 41.335 1.00 8.62 ? 62 TYR A HA 1 +ATOM 2920 H HB2 . TYR B 2 70 ? -20.610 21.435 41.744 1.00 9.37 ? 62 TYR A HB2 1 +ATOM 2921 H HB3 . TYR B 2 70 ? -21.988 21.219 40.986 1.00 9.37 ? 62 TYR A HB3 1 +ATOM 2922 H HD1 . TYR B 2 70 ? -22.251 23.104 39.063 1.00 7.71 ? 62 TYR A HD1 1 +ATOM 2923 H HD2 . TYR B 2 70 ? -18.791 21.513 40.280 1.00 9.75 ? 62 TYR A HD2 1 +ATOM 2924 H HE1 . TYR B 2 70 ? -21.270 23.703 37.074 1.00 9.61 ? 62 TYR A HE1 1 +ATOM 2925 H HE2 . TYR B 2 70 ? -17.813 22.113 38.291 1.00 11.33 ? 62 TYR A HE2 1 +ATOM 2926 H HH . TYR B 2 70 ? -19.376 23.700 35.826 1.00 10.69 ? 62 TYR A HH 1 +ATOM 2927 N N . ARG B 2 71 ? -22.192 22.366 44.268 1.00 8.34 ? 63 ARG A N 1 +ATOM 2928 C CA . ARG B 2 71 ? -22.889 21.699 45.349 1.00 8.02 ? 63 ARG A CA 1 +ATOM 2929 C C . ARG B 2 71 ? -24.123 22.496 45.736 1.00 7.98 ? 63 ARG A C 1 +ATOM 2930 O O . ARG B 2 71 ? -24.031 23.654 46.148 1.00 9.73 ? 63 ARG A O 1 +ATOM 2931 C CB . ARG B 2 71 ? -21.951 21.523 46.539 1.00 9.96 ? 63 ARG A CB 1 +ATOM 2932 C CG . ARG B 2 71 ? -22.582 20.806 47.684 1.00 12.37 ? 63 ARG A CG 1 +ATOM 2933 C CD . ARG B 2 71 ? -21.556 20.475 48.760 1.00 17.61 ? 63 ARG A CD 1 +ATOM 2934 N NE . ARG B 2 71 ? -22.086 19.512 49.722 1.00 35.51 ? 63 ARG A NE 1 +ATOM 2935 C CZ . ARG B 2 71 ? -21.681 18.246 49.840 1.00 40.21 ? 63 ARG A CZ 1 +ATOM 2936 N NH1 . ARG B 2 71 ? -20.708 17.759 49.073 1.00 38.51 1 63 ARG A NH1 1 +ATOM 2937 N NH2 . ARG B 2 71 ? -22.245 17.463 50.750 1.00 42.99 ? 63 ARG A NH2 1 +ATOM 2938 H H . ARG B 2 71 ? -21.411 22.660 44.476 1.00 10.01 ? 63 ARG A H 1 +ATOM 2939 H HA . ARG B 2 71 ? -23.174 20.820 45.053 1.00 9.62 ? 63 ARG A HA 1 +ATOM 2940 H HB2 . ARG B 2 71 ? -21.177 21.011 46.257 1.00 11.95 ? 63 ARG A HB2 1 +ATOM 2941 H HB3 . ARG B 2 71 ? -21.673 22.398 46.852 1.00 11.95 ? 63 ARG A HB3 1 +ATOM 2942 H HG2 . ARG B 2 71 ? -23.267 21.369 48.078 1.00 14.84 ? 63 ARG A HG2 1 +ATOM 2943 H HG3 . ARG B 2 71 ? -22.971 19.975 47.368 1.00 14.84 ? 63 ARG A HG3 1 +ATOM 2944 H HD2 . ARG B 2 71 ? -20.769 20.089 48.344 1.00 21.13 ? 63 ARG A HD2 1 +ATOM 2945 H HD3 . ARG B 2 71 ? -21.321 21.285 49.238 1.00 21.13 ? 63 ARG A HD3 1 +ATOM 2946 H HE . ARG B 2 71 ? -22.706 19.781 50.253 1.00 42.61 ? 63 ARG A HE 1 +ATOM 2947 H HH11 . ARG B 2 71 ? -20.337 18.258 48.479 1.00 46.21 ? 63 ARG A HH11 1 +ATOM 2948 H HH12 . ARG B 2 71 ? -20.457 16.941 49.165 1.00 46.21 ? 63 ARG A HH12 1 +ATOM 2949 H HH21 . ARG B 2 71 ? -22.871 17.771 51.253 1.00 51.59 ? 63 ARG A HH21 1 +ATOM 2950 H HH22 . ARG B 2 71 ? -21.985 16.648 50.837 1.00 51.59 ? 63 ARG A HH22 1 +ATOM 2951 N N . GLY B 2 72 ? -25.294 21.885 45.604 1.00 7.72 ? 64 GLY A N 1 +ATOM 2952 C CA . GLY B 2 72 ? -26.551 22.546 45.883 1.00 8.51 ? 64 GLY A CA 1 +ATOM 2953 C C . GLY B 2 72 ? -27.312 22.999 44.656 1.00 7.45 ? 64 GLY A C 1 +ATOM 2954 O O . GLY B 2 72 ? -28.421 23.490 44.811 1.00 9.40 ? 64 GLY A O 1 +ATOM 2955 H H . GLY B 2 72 ? -25.383 21.069 45.347 1.00 9.26 ? 64 GLY A H 1 +ATOM 2956 H HA2 . GLY B 2 72 ? -27.121 21.941 46.384 1.00 10.22 ? 64 GLY A HA2 1 +ATOM 2957 H HA3 . GLY B 2 72 ? -26.381 23.325 46.435 1.00 10.22 ? 64 GLY A HA3 1 +ATOM 2958 N N . ARG B 2 73 ? -26.756 22.815 43.462 1.00 7.26 ? 65 ARG A N 1 +ATOM 2959 C CA . ARG B 2 73 ? -27.442 23.213 42.232 1.00 6.98 ? 65 ARG A CA 1 +ATOM 2960 C C . ARG B 2 73 ? -27.385 22.186 41.112 1.00 7.00 ? 65 ARG A C 1 +ATOM 2961 O O . ARG B 2 73 ? -27.824 22.494 40.007 1.00 7.75 ? 65 ARG A O 1 +ATOM 2962 C CB . ARG B 2 73 ? -26.990 24.603 41.753 1.00 8.18 ? 65 ARG A CB 1 +ATOM 2963 C CG . ARG B 2 73 ? -25.638 24.664 41.127 1.00 9.19 ? 65 ARG A CG 1 +ATOM 2964 C CD . ARG B 2 73 ? -25.349 26.063 40.583 1.00 8.66 ? 65 ARG A CD 1 +ATOM 2965 N NE . ARG B 2 73 ? -24.083 26.077 39.872 1.00 8.64 ? 65 ARG A NE 1 +ATOM 2966 C CZ . ARG B 2 73 ? -23.937 26.261 38.570 1.00 7.83 ? 65 ARG A CZ 1 +ATOM 2967 N NH1 . ARG B 2 73 ? -24.973 26.508 37.774 1.00 8.05 1 65 ARG A NH1 1 +ATOM 2968 N NH2 . ARG B 2 73 ? -22.725 26.226 38.062 1.00 8.66 ? 65 ARG A NH2 1 +ATOM 2969 H H . ARG B 2 73 ? -25.982 22.462 43.335 1.00 8.71 ? 65 ARG A H 1 +ATOM 2970 H HA . ARG B 2 73 ? -28.382 23.304 42.456 1.00 8.38 ? 65 ARG A HA 1 +ATOM 2971 H HB2 . ARG B 2 73 ? -27.628 24.922 41.096 1.00 9.82 ? 65 ARG A HB2 1 +ATOM 2972 H HB3 . ARG B 2 73 ? -26.984 25.202 42.516 1.00 9.82 ? 65 ARG A HB3 1 +ATOM 2973 H HG2 . ARG B 2 73 ? -24.966 24.450 41.793 1.00 11.03 ? 65 ARG A HG2 1 +ATOM 2974 H HG3 . ARG B 2 73 ? -25.596 24.035 40.391 1.00 11.03 ? 65 ARG A HG3 1 +ATOM 2975 H HD2 . ARG B 2 73 ? -26.051 26.322 39.966 1.00 10.39 ? 65 ARG A HD2 1 +ATOM 2976 H HD3 . ARG B 2 73 ? -25.295 26.692 41.320 1.00 10.39 ? 65 ARG A HD3 1 +ATOM 2977 H HE . ARG B 2 73 ? -23.368 25.956 40.335 1.00 10.36 ? 65 ARG A HE 1 +ATOM 2978 H HH11 . ARG B 2 73 ? -25.769 26.529 38.098 1.00 9.66 ? 65 ARG A HH11 1 +ATOM 2979 H HH12 . ARG B 2 73 ? -24.848 26.632 36.932 1.00 9.66 ? 65 ARG A HH12 1 +ATOM 2980 H HH21 . ARG B 2 73 ? -22.049 26.077 38.573 1.00 10.39 ? 65 ARG A HH21 1 +ATOM 2981 H HH22 . ARG B 2 73 ? -22.607 26.359 37.221 1.00 10.39 ? 65 ARG A HH22 1 +ATOM 2982 N N . LEU B 2 74 ? -26.866 20.989 41.375 1.00 7.21 ? 66 LEU A N 1 +ATOM 2983 C CA . LEU B 2 74 ? -26.890 19.897 40.392 1.00 6.23 ? 66 LEU A CA 1 +ATOM 2984 C C . LEU B 2 74 ? -27.715 18.755 40.934 1.00 6.45 ? 66 LEU A C 1 +ATOM 2985 O O . LEU B 2 74 ? -27.589 18.401 42.126 1.00 8.29 ? 66 LEU A O 1 +ATOM 2986 C CB . LEU B 2 74 ? -25.509 19.333 40.112 1.00 7.92 ? 66 LEU A CB 1 +ATOM 2987 C CG . LEU B 2 74 ? -24.446 20.254 39.548 1.00 7.48 ? 66 LEU A CG 1 +ATOM 2988 C CD1 . LEU B 2 74 ? -23.195 19.432 39.216 1.00 9.81 ? 66 LEU A CD1 1 +ATOM 2989 C CD2 . LEU B 2 74 ? -24.955 21.024 38.350 1.00 8.75 ? 66 LEU A CD2 1 +ATOM 2990 H H . LEU B 2 74 ? -26.492 20.778 42.120 1.00 8.65 ? 66 LEU A H 1 +ATOM 2991 H HA . LEU B 2 74 ? -27.282 20.205 39.560 1.00 7.47 ? 66 LEU A HA 1 +ATOM 2992 H HB2 . LEU B 2 74 ? -25.160 18.981 40.945 1.00 9.50 ? 66 LEU A HB2 1 +ATOM 2993 H HB3 . LEU B 2 74 ? -25.611 18.604 39.481 1.00 9.50 ? 66 LEU A HB3 1 +ATOM 2994 H HG . LEU B 2 74 ? -24.202 20.900 40.230 1.00 8.98 ? 66 LEU A HG 1 +ATOM 2995 H HD11 . LEU B 2 74 ? -22.516 20.023 38.855 1.00 11.77 ? 66 LEU A HD11 1 +ATOM 2996 H HD12 . LEU B 2 74 ? -22.871 19.010 40.027 1.00 11.77 ? 66 LEU A HD12 1 +ATOM 2997 H HD13 . LEU B 2 74 ? -23.427 18.755 38.561 1.00 11.77 ? 66 LEU A HD13 1 +ATOM 2998 H HD21 . LEU B 2 74 ? -24.247 21.599 38.021 1.00 10.50 ? 66 LEU A HD21 1 +ATOM 2999 H HD22 . LEU B 2 74 ? -25.219 20.395 37.660 1.00 10.50 ? 66 LEU A HD22 1 +ATOM 3000 H HD23 . LEU B 2 74 ? -25.718 21.559 38.619 1.00 10.50 ? 66 LEU A HD23 1 +ATOM 3001 N N . LYS B 2 75 ? -28.519 18.145 40.070 1.00 6.68 ? 67 LYS A N 1 +ATOM 3002 C CA . LYS B 2 75 ? -29.303 16.969 40.436 1.00 7.56 ? 67 LYS A CA 1 +ATOM 3003 C C . LYS B 2 75 ? -29.215 15.988 39.291 1.00 6.84 ? 67 LYS A C 1 +ATOM 3004 O O . LYS B 2 75 ? -29.497 16.368 38.141 1.00 8.57 ? 67 LYS A O 1 +ATOM 3005 C CB . LYS B 2 75 ? -30.764 17.345 40.642 1.00 8.40 ? 67 LYS A CB 1 +ATOM 3006 C CG . LYS B 2 75 ? -31.683 16.134 40.860 1.00 10.18 ? 67 LYS A CG 1 +ATOM 3007 C CD . LYS B 2 75 ? -33.140 16.525 41.070 1.00 12.27 ? 67 LYS A CD 1 +ATOM 3008 C CE . LYS B 2 75 ? -33.802 17.019 39.785 1.00 13.20 ? 67 LYS A CE 1 +ATOM 3009 N NZ . LYS B 2 75 ? -34.066 15.922 38.787 1.00 12.71 1 67 LYS A NZ 1 +ATOM 3010 H H . LYS B 2 75 ? -28.630 18.396 39.255 1.00 8.01 ? 67 LYS A H 1 +ATOM 3011 H HA . LYS B 2 75 ? -28.953 16.561 41.243 1.00 9.07 ? 67 LYS A HA 1 +ATOM 3012 H HB2 . LYS B 2 75 ? -30.834 17.915 41.424 1.00 10.08 ? 67 LYS A HB2 1 +ATOM 3013 H HB3 . LYS B 2 75 ? -31.079 17.820 39.858 1.00 10.08 ? 67 LYS A HB3 1 +ATOM 3014 H HG2 . LYS B 2 75 ? -31.636 15.559 40.081 1.00 12.22 ? 67 LYS A HG2 1 +ATOM 3015 H HG3 . LYS B 2 75 ? -31.386 15.651 41.647 1.00 12.22 ? 67 LYS A HG3 1 +ATOM 3016 H HD2 . LYS B 2 75 ? -33.634 15.751 41.384 1.00 14.72 ? 67 LYS A HD2 1 +ATOM 3017 H HD3 . LYS B 2 75 ? -33.186 17.238 41.726 1.00 14.72 ? 67 LYS A HD3 1 +ATOM 3018 H HE2 . LYS B 2 75 ? -34.652 17.429 40.008 1.00 15.83 ? 67 LYS A HE2 1 +ATOM 3019 H HE3 . LYS B 2 75 ? -33.221 17.672 39.364 1.00 15.83 ? 67 LYS A HE3 1 +ATOM 3020 H HZ1 . LYS B 2 75 ? -34.450 16.260 38.059 1.00 15.25 ? 67 LYS A HZ1 1 +ATOM 3021 H HZ2 . LYS B 2 75 ? -33.300 15.532 38.555 1.00 15.25 ? 67 LYS A HZ2 1 +ATOM 3022 H HZ3 . LYS B 2 75 ? -34.606 15.311 39.143 1.00 15.25 ? 67 LYS A HZ3 1 +ATOM 3023 N N . VAL B 2 76 ? -28.839 14.745 39.569 1.00 6.22 ? 68 VAL A N 1 +ATOM 3024 C CA . VAL B 2 76 ? -28.820 13.701 38.556 1.00 6.21 ? 68 VAL A CA 1 +ATOM 3025 C C . VAL B 2 76 ? -29.971 12.772 38.847 1.00 5.77 ? 68 VAL A C 1 +ATOM 3026 O O . VAL B 2 76 ? -30.168 12.343 39.986 1.00 5.77 ? 68 VAL A O 1 +ATOM 3027 C CB . VAL B 2 76 ? -27.472 12.958 38.553 1.00 6.53 ? 68 VAL A CB 1 +ATOM 3028 C CG1 . VAL B 2 76 ? -27.504 11.712 37.668 1.00 6.80 ? 68 VAL A CG1 1 +ATOM 3029 C CG2 . VAL B 2 76 ? -26.374 13.894 38.092 1.00 7.37 ? 68 VAL A CG2 1 +ATOM 3030 H H . VAL B 2 76 ? -28.587 14.479 40.348 1.00 7.46 ? 68 VAL A H 1 +ATOM 3031 H HA . VAL B 2 76 ? -28.956 14.096 37.681 1.00 7.46 ? 68 VAL A HA 1 +ATOM 3032 H HB . VAL B 2 76 ? -27.265 12.677 39.458 1.00 7.84 ? 68 VAL A HB 1 +ATOM 3033 H HG11 . VAL B 2 76 ? -26.635 11.281 37.699 1.00 8.16 ? 68 VAL A HG11 1 +ATOM 3034 H HG12 . VAL B 2 76 ? -28.186 11.107 38.001 1.00 8.16 ? 68 VAL A HG12 1 +ATOM 3035 H HG13 . VAL B 2 76 ? -27.711 11.976 36.758 1.00 8.16 ? 68 VAL A HG13 1 +ATOM 3036 H HG21 . VAL B 2 76 ? -25.530 13.416 38.094 1.00 8.85 ? 68 VAL A HG21 1 +ATOM 3037 H HG22 . VAL B 2 76 ? -26.577 14.203 37.196 1.00 8.85 ? 68 VAL A HG22 1 +ATOM 3038 H HG23 . VAL B 2 76 ? -26.328 14.649 38.700 1.00 8.85 ? 68 VAL A HG23 1 +ATOM 3039 N N . SER B 2 77 ? -30.775 12.495 37.838 1.00 5.95 ? 69 SER A N 1 +ATOM 3040 C CA . SER B 2 77 ? -31.973 11.676 38.000 1.00 6.62 ? 69 SER A CA 1 +ATOM 3041 C C . SER B 2 77 ? -31.648 10.347 38.651 1.00 6.30 ? 69 SER A C 1 +ATOM 3042 O O . SER B 2 77 ? -30.594 9.776 38.374 1.00 7.00 ? 69 SER A O 1 +ATOM 3043 C CB . SER B 2 77 ? -32.623 11.467 36.644 1.00 7.55 ? 69 SER A CB 1 +ATOM 3044 O OG . SER B 2 77 ? -32.937 12.722 36.074 1.00 8.24 ? 69 SER A OG 1 +ATOM 3045 H H . SER B 2 77 ? -30.652 12.772 37.033 1.00 7.14 ? 69 SER A H 1 +ATOM 3046 H HA . SER B 2 77 ? -32.605 12.144 38.569 1.00 7.94 ? 69 SER A HA 1 +ATOM 3047 H HB2 . SER B 2 77 ? -32.005 10.997 36.062 1.00 9.06 ? 69 SER A HB2 1 +ATOM 3048 H HB3 . SER B 2 77 ? -33.438 10.952 36.755 1.00 9.06 ? 69 SER A HB3 1 +ATOM 3049 H HG . SER B 2 77 ? -33.297 12.614 35.323 1.00 9.89 ? 69 SER A HG 1 +ATOM 3050 N N . HIS B 2 78 ? -32.534 9.877 39.526 1.00 6.96 ? 70 HIS A N 1 +ATOM 3051 C CA . HIS B 2 78 ? -32.229 8.659 40.270 1.00 7.19 ? 70 HIS A CA 1 +ATOM 3052 C C . HIS B 2 78 ? -33.351 7.652 40.412 1.00 8.51 ? 70 HIS A C 1 +ATOM 3053 O O . HIS B 2 78 ? -33.096 6.569 40.942 1.00 10.66 ? 70 HIS A O 1 +ATOM 3054 C CB . HIS B 2 78 ? -31.661 8.958 41.669 1.00 7.49 ? 70 HIS A CB 1 +ATOM 3055 C CG . HIS B 2 78 ? -32.702 9.265 42.694 1.00 9.05 ? 70 HIS A CG 1 +ATOM 3056 N ND1 . HIS B 2 78 ? -33.249 10.516 42.832 1.00 9.18 ? 70 HIS A ND1 1 +ATOM 3057 C CD2 . HIS B 2 78 ? -33.266 8.497 43.662 1.00 8.38 ? 70 HIS A CD2 1 +ATOM 3058 C CE1 . HIS B 2 78 ? -34.132 10.503 43.820 1.00 9.14 ? 70 HIS A CE1 1 +ATOM 3059 N NE2 . HIS B 2 78 ? -34.162 9.288 44.336 1.00 10.52 ? 70 HIS A NE2 1 +ATOM 3060 H H . HIS B 2 78 ? -33.297 10.233 39.703 1.00 8.36 ? 70 HIS A H 1 +ATOM 3061 H HA . HIS B 2 78 ? -31.523 8.204 39.785 1.00 8.63 ? 70 HIS A HA 1 +ATOM 3062 H HB2 . HIS B 2 78 ? -31.164 8.183 41.976 1.00 8.99 ? 70 HIS A HB2 1 +ATOM 3063 H HB3 . HIS B 2 78 ? -31.070 9.724 41.609 1.00 8.99 ? 70 HIS A HB3 1 +ATOM 3064 H HD1 . HIS B 2 78 ? -33.062 11.197 42.342 1.00 11.01 ? 70 HIS A HD1 1 +ATOM 3065 H HD2 . HIS B 2 78 ? -33.096 7.597 43.822 1.00 10.06 ? 70 HIS A HD2 1 +ATOM 3066 H HE1 . HIS B 2 78 ? -34.641 11.228 44.104 1.00 10.97 ? 70 HIS A HE1 1 +ATOM 3067 N N . LYS B 2 79 ? -34.574 7.960 39.999 1.00 6.86 ? 71 LYS A N 1 +ATOM 3068 C CA . LYS B 2 79 ? -35.691 7.045 40.268 1.00 7.60 ? 71 LYS A CA 1 +ATOM 3069 C C . LYS B 2 79 ? -36.046 6.104 39.133 1.00 8.82 ? 71 LYS A C 1 +ATOM 3070 O O . LYS B 2 79 ? -36.792 5.142 39.341 1.00 12.92 ? 71 LYS A O 1 +ATOM 3071 C CB . LYS B 2 79 ? -36.953 7.815 40.645 1.00 9.68 ? 71 LYS A CB 1 +ATOM 3072 C CG . LYS B 2 79 ? -36.792 8.634 41.898 1.00 10.91 ? 71 LYS A CG 1 +ATOM 3073 C CD . LYS B 2 79 ? -38.123 9.115 42.392 1.00 15.51 ? 71 LYS A CD 1 +ATOM 3074 C CE . LYS B 2 79 ? -37.978 9.916 43.648 1.00 15.22 ? 71 LYS A CE 1 +ATOM 3075 N NZ . LYS B 2 79 ? -39.303 10.288 44.227 1.00 23.14 1 71 LYS A NZ 1 +ATOM 3076 H H . LYS B 2 79 ? -34.787 8.675 39.571 1.00 8.23 ? 71 LYS A H 1 +ATOM 3077 H HA . LYS B 2 79 ? -35.452 6.495 41.030 1.00 9.12 ? 71 LYS A HA 1 +ATOM 3078 H HB2 . LYS B 2 79 ? -37.182 8.418 39.920 1.00 11.62 ? 71 LYS A HB2 1 +ATOM 3079 H HB3 . LYS B 2 79 ? -37.675 7.183 40.791 1.00 11.62 ? 71 LYS A HB3 1 +ATOM 3080 H HG2 . LYS B 2 79 ? -36.387 8.088 42.590 1.00 13.10 ? 71 LYS A HG2 1 +ATOM 3081 H HG3 . LYS B 2 79 ? -36.237 9.407 41.709 1.00 13.10 ? 71 LYS A HG3 1 +ATOM 3082 H HD2 . LYS B 2 79 ? -38.531 9.678 41.717 1.00 18.61 ? 71 LYS A HD2 1 +ATOM 3083 H HD3 . LYS B 2 79 ? -38.690 8.351 42.581 1.00 18.61 ? 71 LYS A HD3 1 +ATOM 3084 H HE2 . LYS B 2 79 ? -37.497 9.391 44.307 1.00 18.26 ? 71 LYS A HE2 1 +ATOM 3085 H HE3 . LYS B 2 79 ? -37.494 10.732 43.451 1.00 18.26 ? 71 LYS A HE3 1 +ATOM 3086 H HZ1 . LYS B 2 79 ? -39.764 10.776 43.642 1.00 27.77 ? 71 LYS A HZ1 1 +ATOM 3087 H HZ2 . LYS B 2 79 ? -39.767 9.554 44.422 1.00 27.77 ? 71 LYS A HZ2 1 +ATOM 3088 H HZ3 . LYS B 2 79 ? -39.187 10.763 44.971 1.00 27.77 ? 71 LYS A HZ3 1 +ATOM 3089 N N . VAL B 2 80 ? -35.606 6.411 37.924 1.00 8.02 ? 72 VAL A N 1 +ATOM 3090 C CA . VAL B 2 80 ? -35.950 5.639 36.739 1.00 7.54 ? 72 VAL A CA 1 +ATOM 3091 C C . VAL B 2 80 ? -34.697 4.940 36.249 1.00 7.64 ? 72 VAL A C 1 +ATOM 3092 O O . VAL B 2 80 ? -33.753 5.593 35.824 1.00 7.18 ? 72 VAL A O 1 +ATOM 3093 C CB . VAL B 2 80 ? -36.505 6.559 35.638 1.00 7.87 ? 72 VAL A CB 1 +ATOM 3094 C CG1 . VAL B 2 80 ? -36.719 5.792 34.336 1.00 8.43 ? 72 VAL A CG1 1 +ATOM 3095 C CG2 . VAL B 2 80 ? -37.804 7.231 36.107 1.00 11.04 ? 72 VAL A CG2 1 +ATOM 3096 H H . VAL B 2 80 ? -35.092 7.080 37.759 1.00 9.62 ? 72 VAL A H 1 +ATOM 3097 H HA . VAL B 2 80 ? -36.618 4.972 36.959 1.00 9.05 ? 72 VAL A HA 1 +ATOM 3098 H HB . VAL B 2 80 ? -35.858 7.260 35.463 1.00 9.45 ? 72 VAL A HB 1 +ATOM 3099 H HG11 . VAL B 2 80 ? -37.069 6.400 33.666 1.00 10.11 ? 72 VAL A HG11 1 +ATOM 3100 H HG12 . VAL B 2 80 ? -35.870 5.427 34.041 1.00 10.11 ? 72 VAL A HG12 1 +ATOM 3101 H HG13 . VAL B 2 80 ? -37.352 5.074 34.493 1.00 10.11 ? 72 VAL A HG13 1 +ATOM 3102 H HG21 . VAL B 2 80 ? -38.136 7.805 35.399 1.00 13.25 ? 72 VAL A HG21 1 +ATOM 3103 H HG22 . VAL B 2 80 ? -38.459 6.545 36.311 1.00 13.25 ? 72 VAL A HG22 1 +ATOM 3104 H HG23 . VAL B 2 80 ? -37.618 7.758 36.900 1.00 13.25 ? 72 VAL A HG23 1 +ATOM 3105 N N . PRO B 2 81 ? -34.669 3.595 36.299 1.00 7.14 ? 73 PRO A N 1 +ATOM 3106 C CA . PRO B 2 81 ? -33.465 2.909 35.839 1.00 7.26 ? 73 PRO A CA 1 +ATOM 3107 C C . PRO B 2 81 ? -33.108 3.302 34.405 1.00 6.98 ? 73 PRO A C 1 +ATOM 3108 O O . PRO B 2 81 ? -33.957 3.363 33.525 1.00 7.30 ? 73 PRO A O 1 +ATOM 3109 C CB . PRO B 2 81 ? -33.850 1.434 35.944 1.00 7.29 ? 73 PRO A CB 1 +ATOM 3110 C CG . PRO B 2 81 ? -34.809 1.415 37.080 1.00 9.30 ? 73 PRO A CG 1 +ATOM 3111 C CD . PRO B 2 81 ? -35.636 2.649 36.883 1.00 7.98 ? 73 PRO A CD 1 +ATOM 3112 H HA . PRO B 2 81 ? -32.717 3.096 36.427 1.00 8.71 ? 73 PRO A HA 1 +ATOM 3113 H HB2 . PRO B 2 81 ? -34.276 1.142 35.123 1.00 8.75 ? 73 PRO A HB2 1 +ATOM 3114 H HB3 . PRO B 2 81 ? -33.065 0.899 36.141 1.00 8.75 ? 73 PRO A HB3 1 +ATOM 3115 H HG2 . PRO B 2 81 ? -35.360 0.619 37.033 1.00 11.16 ? 73 PRO A HG2 1 +ATOM 3116 H HG3 . PRO B 2 81 ? -34.326 1.454 37.920 1.00 11.16 ? 73 PRO A HG3 1 +ATOM 3117 H HD2 . PRO B 2 81 ? -36.361 2.477 36.262 1.00 9.58 ? 73 PRO A HD2 1 +ATOM 3118 H HD3 . PRO B 2 81 ? -35.964 2.979 37.734 1.00 9.58 ? 73 PRO A HD3 1 +ATOM 3119 N N . GLY B 2 82 ? -31.834 3.598 34.197 1.00 6.46 ? 74 GLY A N 1 +ATOM 3120 C CA . GLY B 2 82 ? -31.342 4.026 32.910 1.00 6.35 ? 74 GLY A CA 1 +ATOM 3121 C C . GLY B 2 82 ? -31.315 5.520 32.684 1.00 6.05 ? 74 GLY A C 1 +ATOM 3122 O O . GLY B 2 82 ? -30.653 5.962 31.748 1.00 7.11 ? 74 GLY A O 1 +ATOM 3123 H H . GLY B 2 82 ? -31.225 3.555 34.803 1.00 7.75 ? 74 GLY A H 1 +ATOM 3124 H HA2 . GLY B 2 82 ? -30.439 3.693 32.795 1.00 7.62 ? 74 GLY A HA2 1 +ATOM 3125 H HA3 . GLY B 2 82 ? -31.896 3.632 32.218 1.00 7.62 ? 74 GLY A HA3 1 +ATOM 3126 N N . ASP B 2 83 ? -31.966 6.304 33.538 1.00 5.60 ? 75 ASP A N 1 +ATOM 3127 C CA . ASP B 2 83 ? -32.009 7.744 33.349 1.00 6.70 ? 75 ASP A CA 1 +ATOM 3128 C C . ASP B 2 83 ? -31.026 8.415 34.290 1.00 5.67 ? 75 ASP A C 1 +ATOM 3129 O O . ASP B 2 83 ? -31.248 8.471 35.499 1.00 6.81 ? 75 ASP A O 1 +ATOM 3130 C CB . ASP B 2 83 ? -33.421 8.262 33.561 1.00 6.09 ? 75 ASP A CB 1 +ATOM 3131 C CG . ASP B 2 83 ? -33.547 9.751 33.307 1.00 6.75 ? 75 ASP A CG 1 +ATOM 3132 O OD1 . ASP B 2 83 ? -32.527 10.444 33.075 1.00 7.07 ? 75 ASP A OD1 1 +ATOM 3133 O OD2 . ASP B 2 83 ? -34.701 10.262 33.331 1.00 8.13 -1 75 ASP A OD2 1 +ATOM 3134 H H . ASP B 2 83 ? -32.389 6.025 34.233 1.00 6.73 ? 75 ASP A H 1 +ATOM 3135 H HA . ASP B 2 83 ? -31.745 7.952 32.439 1.00 8.04 ? 75 ASP A HA 1 +ATOM 3136 H HB2 . ASP B 2 83 ? -34.020 7.802 32.952 1.00 7.31 ? 75 ASP A HB2 1 +ATOM 3137 H HB3 . ASP B 2 83 ? -33.685 8.091 34.478 1.00 7.31 ? 75 ASP A HB3 1 +ATOM 3138 N N . VAL B 2 84 ? -29.920 8.900 33.736 1.00 5.57 ? 76 VAL A N 1 +ATOM 3139 C CA . VAL B 2 84 ? -28.873 9.553 34.534 1.00 5.83 ? 76 VAL A CA 1 +ATOM 3140 C C . VAL B 2 84 ? -28.694 11.005 34.084 1.00 5.34 ? 76 VAL A C 1 +ATOM 3141 O O . VAL B 2 84 ? -27.600 11.584 34.145 1.00 6.52 ? 76 VAL A O 1 +ATOM 3142 C CB . VAL B 2 84 ? -27.550 8.750 34.530 1.00 6.82 ? 76 VAL A CB 1 +ATOM 3143 C CG1 . VAL B 2 84 ? -27.747 7.419 35.263 1.00 8.31 ? 76 VAL A CG1 1 +ATOM 3144 C CG2 . VAL B 2 84 ? -27.031 8.534 33.109 1.00 8.12 ? 76 VAL A CG2 1 +ATOM 3145 H H . VAL B 2 84 ? -29.746 8.867 32.894 1.00 6.69 ? 76 VAL A H 1 +ATOM 3146 H HA . VAL B 2 84 ? -29.178 9.582 35.455 1.00 7.00 ? 76 VAL A HA 1 +ATOM 3147 H HB . VAL B 2 84 ? -26.879 9.256 35.014 1.00 8.18 ? 76 VAL A HB 1 +ATOM 3148 H HG11 . VAL B 2 84 ? -26.911 6.927 35.253 1.00 9.97 ? 76 VAL A HG11 1 +ATOM 3149 H HG12 . VAL B 2 84 ? -28.013 7.600 36.178 1.00 9.97 ? 76 VAL A HG12 1 +ATOM 3150 H HG13 . VAL B 2 84 ? -28.437 6.909 34.811 1.00 9.97 ? 76 VAL A HG13 1 +ATOM 3151 H HG21 . VAL B 2 84 ? -26.204 8.029 33.149 1.00 9.74 ? 76 VAL A HG21 1 +ATOM 3152 H HG22 . VAL B 2 84 ? -27.696 8.042 32.602 1.00 9.74 ? 76 VAL A HG22 1 +ATOM 3153 H HG23 . VAL B 2 84 ? -26.873 9.398 32.696 1.00 9.74 ? 76 VAL A HG23 1 +ATOM 3154 N N . SER B 2 85 ? -29.807 11.626 33.709 1.00 5.14 ? 77 SER A N 1 +ATOM 3155 C CA . SER B 2 85 ? -29.810 13.000 33.229 1.00 5.19 ? 77 SER A CA 1 +ATOM 3156 C C . SER B 2 85 ? -29.367 13.983 34.308 1.00 5.50 ? 77 SER A C 1 +ATOM 3157 O O . SER B 2 85 ? -29.663 13.805 35.499 1.00 6.29 ? 77 SER A O 1 +ATOM 3158 C CB . SER B 2 85 ? -31.201 13.392 32.740 1.00 5.66 ? 77 SER A CB 1 +ATOM 3159 O OG . SER B 2 85 ? -31.626 12.544 31.676 1.00 5.57 ? 77 SER A OG 1 +ATOM 3160 H H . SER B 2 85 ? -30.587 11.264 33.724 1.00 6.17 ? 77 SER A H 1 +ATOM 3161 H HA . SER B 2 85 ? -29.195 13.075 32.482 1.00 6.23 ? 77 SER A HA 1 +ATOM 3162 H HB2 . SER B 2 85 ? -31.828 13.312 33.476 1.00 6.79 ? 77 SER A HB2 1 +ATOM 3163 H HB3 . SER B 2 85 ? -31.178 14.308 32.423 1.00 6.79 ? 77 SER A HB3 1 +ATOM 3164 H HG . SER B 2 85 ? -31.651 11.746 31.937 1.00 6.69 ? 77 SER A HG 1 +ATOM 3165 N N . LEU B 2 86 ? -28.677 15.029 33.870 1.00 5.60 ? 78 LEU A N 1 +ATOM 3166 C CA . LEU B 2 86 ? -28.204 16.071 34.774 1.00 5.29 ? 78 LEU A CA 1 +ATOM 3167 C C . LEU B 2 86 ? -29.089 17.299 34.685 1.00 5.70 ? 78 LEU A C 1 +ATOM 3168 O O . LEU B 2 86 ? -29.306 17.823 33.580 1.00 7.91 ? 78 LEU A O 1 +ATOM 3169 C CB . LEU B 2 86 ? -26.788 16.476 34.375 1.00 6.69 ? 78 LEU A CB 1 +ATOM 3170 C CG . LEU B 2 86 ? -26.163 17.639 35.152 1.00 6.23 ? 78 LEU A CG 1 +ATOM 3171 C CD1 . LEU B 2 86 ? -25.966 17.305 36.610 1.00 8.24 ? 78 LEU A CD1 1 +ATOM 3172 C CD2 . LEU B 2 86 ? -24.857 18.054 34.515 1.00 8.68 ? 78 LEU A CD2 1 +ATOM 3173 H H . LEU B 2 86 ? -28.467 15.160 33.047 1.00 6.72 ? 78 LEU A H 1 +ATOM 3174 H HA . LEU B 2 86 ? -28.198 15.746 35.688 1.00 6.35 ? 78 LEU A HA 1 +ATOM 3175 H HB2 . LEU B 2 86 ? -26.208 15.707 34.493 1.00 8.02 ? 78 LEU A HB2 1 +ATOM 3176 H HB3 . LEU B 2 86 ? -26.797 16.728 33.438 1.00 8.02 ? 78 LEU A HB3 1 +ATOM 3177 H HG . LEU B 2 86 ? -26.765 18.398 35.105 1.00 7.48 ? 78 LEU A HG 1 +ATOM 3178 H HD11 . LEU B 2 86 ? -25.569 18.069 37.057 1.00 9.89 ? 78 LEU A HD11 1 +ATOM 3179 H HD12 . LEU B 2 86 ? -26.827 17.100 37.006 1.00 9.89 ? 78 LEU A HD12 1 +ATOM 3180 H HD13 . LEU B 2 86 ? -25.377 16.538 36.681 1.00 9.89 ? 78 LEU A HD13 1 +ATOM 3181 H HD21 . LEU B 2 86 ? -24.480 18.790 35.022 1.00 10.41 ? 78 LEU A HD21 1 +ATOM 3182 H HD22 . LEU B 2 86 ? -24.248 17.299 34.524 1.00 10.41 ? 78 LEU A HD22 1 +ATOM 3183 H HD23 . LEU B 2 86 ? -25.026 18.333 33.602 1.00 10.41 ? 78 LEU A HD23 1 +ATOM 3184 N N . GLN B 2 87 ? -29.590 17.786 35.808 1.00 6.09 ? 79 GLN A N 1 +ATOM 3185 C CA . GLN B 2 87 ? -30.301 19.049 35.832 1.00 6.82 ? 79 GLN A CA 1 +ATOM 3186 C C . GLN B 2 87 ? -29.524 20.099 36.589 1.00 6.88 ? 79 GLN A C 1 +ATOM 3187 O O . GLN B 2 87 ? -29.046 19.868 37.707 1.00 6.51 ? 79 GLN A O 1 +ATOM 3188 C CB . GLN B 2 87 ? -31.685 18.888 36.419 1.00 10.11 ? 79 GLN A CB 1 +ATOM 3189 C CG . GLN B 2 87 ? -32.531 20.140 36.190 1.00 10.97 ? 79 GLN A CG 1 +ATOM 3190 C CD . GLN B 2 87 ? -33.995 19.861 36.262 1.00 10.68 ? 79 GLN A CD 1 +ATOM 3191 O OE1 . GLN B 2 87 ? -34.510 19.029 35.512 1.00 12.04 ? 79 GLN A OE1 1 +ATOM 3192 N NE2 . GLN B 2 87 ? -34.683 20.530 37.182 1.00 11.92 ? 79 GLN A NE2 1 +ATOM 3193 H H . GLN B 2 87 ? -29.530 17.401 36.575 1.00 7.31 ? 79 GLN A H 1 +ATOM 3194 H HA . GLN B 2 87 ? -30.405 19.362 34.920 1.00 8.19 ? 79 GLN A HA 1 +ATOM 3195 H HB2 . GLN B 2 87 ? -32.129 18.138 35.994 1.00 12.14 ? 79 GLN A HB2 1 +ATOM 3196 H HB3 . GLN B 2 87 ? -31.613 18.740 37.375 1.00 12.14 ? 79 GLN A HB3 1 +ATOM 3197 H HG2 . GLN B 2 87 ? -32.316 20.797 36.870 1.00 13.17 ? 79 GLN A HG2 1 +ATOM 3198 H HG3 . GLN B 2 87 ? -32.336 20.497 35.309 1.00 13.17 ? 79 GLN A HG3 1 +ATOM 3199 H HE21 . GLN B 2 87 ? -34.282 21.090 37.698 1.00 14.31 ? 79 GLN A HE21 1 +ATOM 3200 H HE22 . GLN B 2 87 ? -35.530 20.404 37.263 1.00 14.31 ? 79 GLN A HE22 1 +ATOM 3201 N N . ILE B 2 88 ? -29.366 21.240 35.944 1.00 6.52 ? 80 ILE A N 1 +ATOM 3202 C CA . ILE B 2 88 ? -28.633 22.357 36.493 1.00 6.31 ? 80 ILE A CA 1 +ATOM 3203 C C . ILE B 2 88 ? -29.618 23.437 36.898 1.00 6.18 ? 80 ILE A C 1 +ATOM 3204 O O . ILE B 2 88 ? -30.410 23.912 36.073 1.00 7.37 ? 80 ILE A O 1 +ATOM 3205 C CB . ILE B 2 88 ? -27.651 22.948 35.472 1.00 7.89 ? 80 ILE A CB 1 +ATOM 3206 C CG1 . ILE B 2 88 ? -26.682 21.871 34.959 1.00 8.19 ? 80 ILE A CG1 1 +ATOM 3207 C CG2 . ILE B 2 88 ? -26.897 24.142 36.065 1.00 9.13 ? 80 ILE A CG2 1 +ATOM 3208 C CD1 . ILE B 2 88 ? -25.864 22.303 33.731 1.00 10.92 ? 80 ILE A CD1 1 +ATOM 3209 H H . ILE B 2 88 ? -29.685 21.394 35.160 1.00 7.82 ? 80 ILE A H 1 +ATOM 3210 H HA . ILE B 2 88 ? -28.138 22.073 37.278 1.00 7.58 ? 80 ILE A HA 1 +ATOM 3211 H HB . ILE B 2 88 ? -28.166 23.269 34.715 1.00 9.47 ? 80 ILE A HB 1 +ATOM 3212 H HG12 . ILE B 2 88 ? -26.058 21.649 35.668 1.00 9.83 ? 80 ILE A HG12 1 +ATOM 3213 H HG13 . ILE B 2 88 ? -27.193 21.084 34.713 1.00 9.83 ? 80 ILE A HG13 1 +ATOM 3214 H HG21 . ILE B 2 88 ? -26.286 24.492 35.398 1.00 10.96 ? 80 ILE A HG21 1 +ATOM 3215 H HG22 . ILE B 2 88 ? -27.537 24.825 36.319 1.00 10.96 ? 80 ILE A HG22 1 +ATOM 3216 H HG23 . ILE B 2 88 ? -26.401 23.846 36.845 1.00 10.96 ? 80 ILE A HG23 1 +ATOM 3217 H HD11 . ILE B 2 88 ? -25.280 21.574 33.468 1.00 13.10 ? 80 ILE A HD11 1 +ATOM 3218 H HD12 . ILE B 2 88 ? -26.473 22.517 33.006 1.00 13.10 ? 80 ILE A HD12 1 +ATOM 3219 H HD13 . ILE B 2 88 ? -25.337 23.084 33.962 1.00 13.10 ? 80 ILE A HD13 1 +ATOM 3220 N N . ASN B 2 89 ? -29.536 23.842 38.167 1.00 6.75 ? 81 ASN A N 1 +ATOM 3221 C CA . ASN B 2 89 ? -30.327 24.924 38.739 1.00 6.88 ? 81 ASN A CA 1 +ATOM 3222 C C . ASN B 2 89 ? -29.542 26.225 38.653 1.00 7.88 ? 81 ASN A C 1 +ATOM 3223 O O . ASN B 2 89 ? -28.388 26.283 39.086 1.00 9.01 ? 81 ASN A O 1 +ATOM 3224 C CB . ASN B 2 89 ? -30.652 24.544 40.203 1.00 7.87 ? 81 ASN A CB 1 +ATOM 3225 C CG . ASN B 2 89 ? -31.409 25.621 41.005 1.00 8.21 ? 81 ASN A CG 1 +ATOM 3226 O OD1 . ASN B 2 89 ? -31.124 25.793 42.209 1.00 9.40 ? 81 ASN A OD1 1 +ATOM 3227 N ND2 . ASN B 2 89 ? -32.390 26.260 40.417 1.00 9.07 ? 81 ASN A ND2 1 +ATOM 3228 H H . ASN B 2 89 ? -29.003 23.484 38.738 1.00 8.10 ? 81 ASN A H 1 +ATOM 3229 H HA . ASN B 2 89 ? -31.157 25.023 38.247 1.00 8.26 ? 81 ASN A HA 1 +ATOM 3230 H HB2 . ASN B 2 89 ? -31.201 23.743 40.199 1.00 9.45 ? 81 ASN A HB2 1 +ATOM 3231 H HB3 . ASN B 2 89 ? -29.820 24.365 40.667 1.00 9.45 ? 81 ASN A HB3 1 +ATOM 3232 H HD21 . ASN B 2 89 ? -32.826 26.865 40.845 1.00 10.88 ? 81 ASN A HD21 1 +ATOM 3233 H HD22 . ASN B 2 89 ? -32.598 26.074 39.604 1.00 10.88 ? 81 ASN A HD22 1 +ATOM 3234 N N . THR B 2 90 ? -30.166 27.249 38.079 1.00 5.94 ? 82 THR A N 1 +ATOM 3235 C CA . THR B 2 90 ? -29.624 28.604 37.989 1.00 6.72 ? 82 THR A CA 1 +ATOM 3236 C C . THR B 2 90 ? -28.371 28.646 37.121 1.00 6.76 ? 82 THR A C 1 +ATOM 3237 O O . THR B 2 90 ? -27.230 28.759 37.586 1.00 7.34 ? 82 THR A O 1 +ATOM 3238 C CB . THR B 2 90 ? -29.394 29.270 39.359 1.00 6.57 ? 82 THR A CB 1 +ATOM 3239 O OG1 . THR B 2 90 ? -30.555 29.085 40.180 1.00 7.30 ? 82 THR A OG1 1 +ATOM 3240 C CG2 . THR B 2 90 ? -29.143 30.758 39.183 1.00 8.07 ? 82 THR A CG2 1 +ATOM 3241 H H . THR B 2 90 ? -30.943 27.179 37.717 1.00 7.13 ? 82 THR A H 1 +ATOM 3242 H HA . THR B 2 90 ? -30.287 29.146 37.533 1.00 8.07 ? 82 THR A HA 1 +ATOM 3243 H HB . THR B 2 90 ? -28.621 28.873 39.790 1.00 7.88 ? 82 THR A HB 1 +ATOM 3244 H HG1 . THR B 2 90 ? -30.700 28.265 40.292 1.00 8.76 ? 82 THR A HG1 1 +ATOM 3245 H HG21 . THR B 2 90 ? -28.998 31.174 40.047 1.00 9.68 ? 82 THR A HG21 1 +ATOM 3246 H HG22 . THR B 2 90 ? -28.358 30.899 38.630 1.00 9.68 ? 82 THR A HG22 1 +ATOM 3247 H HG23 . THR B 2 90 ? -29.908 31.175 38.756 1.00 9.68 ? 82 THR A HG23 1 +ATOM 3248 N N . LEU B 2 91 ? -28.598 28.571 35.819 1.00 6.55 ? 83 LEU A N 1 +ATOM 3249 C CA . LEU B 2 91 ? -27.513 28.567 34.857 1.00 6.47 ? 83 LEU A CA 1 +ATOM 3250 C C . LEU B 2 91 ? -26.713 29.843 34.902 1.00 7.44 ? 83 LEU A C 1 +ATOM 3251 O O . LEU B 2 91 ? -27.257 30.951 34.947 1.00 8.94 ? 83 LEU A O 1 +ATOM 3252 C CB . LEU B 2 91 ? -28.073 28.401 33.465 1.00 7.55 ? 83 LEU A CB 1 +ATOM 3253 C CG . LEU B 2 91 ? -28.514 26.982 33.149 1.00 7.68 ? 83 LEU A CG 1 +ATOM 3254 C CD1 . LEU B 2 91 ? -29.429 26.978 31.923 1.00 9.75 ? 83 LEU A CD1 1 +ATOM 3255 C CD2 . LEU B 2 91 ? -27.288 26.106 32.900 1.00 8.95 ? 83 LEU A CD2 1 +ATOM 3256 H H . LEU B 2 91 ? -29.380 28.522 35.465 1.00 7.86 ? 83 LEU A H 1 +ATOM 3257 H HA . LEU B 2 91 ? -26.919 27.823 35.041 1.00 7.77 ? 83 LEU A HA 1 +ATOM 3258 H HB2 . LEU B 2 91 ? -28.845 28.981 33.367 1.00 9.06 ? 83 LEU A HB2 1 +ATOM 3259 H HB3 . LEU B 2 91 ? -27.391 28.650 32.822 1.00 9.06 ? 83 LEU A HB3 1 +ATOM 3260 H HG . LEU B 2 91 ? -29.006 26.619 33.902 1.00 9.22 ? 83 LEU A HG 1 +ATOM 3261 H HD11 . LEU B 2 91 ? -29.701 26.066 31.736 1.00 11.70 ? 83 LEU A HD11 1 +ATOM 3262 H HD12 . LEU B 2 91 ? -30.209 27.524 32.110 1.00 11.70 ? 83 LEU A HD12 1 +ATOM 3263 H HD13 . LEU B 2 91 ? -28.944 27.341 31.166 1.00 11.70 ? 83 LEU A HD13 1 +ATOM 3264 H HD21 . LEU B 2 91 ? -27.581 25.203 32.699 1.00 10.74 ? 83 LEU A HD21 1 +ATOM 3265 H HD22 . LEU B 2 91 ? -26.789 26.467 32.151 1.00 10.74 ? 83 LEU A HD22 1 +ATOM 3266 H HD23 . LEU B 2 91 ? -26.734 26.105 33.697 1.00 10.74 ? 83 LEU A HD23 1 +ATOM 3267 N N . GLN B 2 92 ? -25.404 29.678 34.875 1.00 7.40 ? 84 GLN A N 1 +ATOM 3268 C CA . GLN B 2 92 ? -24.467 30.785 34.783 1.00 8.29 ? 84 GLN A CA 1 +ATOM 3269 C C . GLN B 2 92 ? -23.975 30.883 33.360 1.00 8.42 ? 84 GLN A C 1 +ATOM 3270 O O . GLN B 2 92 ? -23.927 29.901 32.626 1.00 8.63 ? 84 GLN A O 1 +ATOM 3271 C CB . GLN B 2 92 ? -23.301 30.540 35.739 1.00 8.14 ? 84 GLN A CB 1 +ATOM 3272 C CG . GLN B 2 92 ? -23.766 30.402 37.166 1.00 9.54 ? 84 GLN A CG 1 +ATOM 3273 C CD . GLN B 2 92 ? -22.672 30.005 38.122 1.00 9.09 ? 84 GLN A CD 1 +ATOM 3274 O OE1 . GLN B 2 92 ? -21.484 30.227 37.868 1.00 13.19 ? 84 GLN A OE1 1 +ATOM 3275 N NE2 . GLN B 2 92 ? -23.061 29.438 39.240 1.00 9.49 ? 84 GLN A NE2 1 +ATOM 3276 H H . GLN B 2 92 ? -25.021 28.909 34.910 1.00 8.87 ? 84 GLN A H 1 +ATOM 3277 H HA . GLN B 2 92 ? -24.907 31.615 35.025 1.00 9.94 ? 84 GLN A HA 1 +ATOM 3278 H HB2 . GLN B 2 92 ? -22.849 29.719 35.487 1.00 9.76 ? 84 GLN A HB2 1 +ATOM 3279 H HB3 . GLN B 2 92 ? -22.686 31.289 35.692 1.00 9.76 ? 84 GLN A HB3 1 +ATOM 3280 H HG2 . GLN B 2 92 ? -24.125 31.253 37.462 1.00 11.45 ? 84 GLN A HG2 1 +ATOM 3281 H HG3 . GLN B 2 92 ? -24.456 29.722 37.206 1.00 11.45 ? 84 GLN A HG3 1 +ATOM 3282 H HE21 . GLN B 2 92 ? -23.898 29.313 39.390 1.00 11.39 ? 84 GLN A HE21 1 +ATOM 3283 H HE22 . GLN B 2 92 ? -22.478 29.192 39.822 1.00 11.39 ? 84 GLN A HE22 1 +ATOM 3284 N N . MET B 2 93 ? -23.581 32.078 32.952 1.00 9.68 ? 85 MET A N 1 +ATOM 3285 C CA . MET B 2 93 ? -23.036 32.219 31.613 1.00 10.15 ? 85 MET A CA 1 +ATOM 3286 C C . MET B 2 93 ? -21.800 31.343 31.447 1.00 10.61 ? 85 MET A C 1 +ATOM 3287 O O . MET B 2 93 ? -21.604 30.754 30.381 1.00 12.11 ? 85 MET A O 1 +ATOM 3288 C CB . MET B 2 93 ? -22.724 33.683 31.263 1.00 12.01 ? 85 MET A CB 1 +ATOM 3289 C CG . MET B 2 93 ? -23.959 34.599 31.175 1.00 16.47 ? 85 MET A CG 1 +ATOM 3290 S SD . MET B 2 93 ? -25.313 34.040 30.121 1.00 16.33 ? 85 MET A SD 1 +ATOM 3291 C CE . MET B 2 93 ? -24.501 33.846 28.552 1.00 18.99 ? 85 MET A CE 1 +ATOM 3292 H H . MET B 2 93 ? -23.617 32.803 33.414 1.00 11.61 ? 85 MET A H 1 +ATOM 3293 H HA . MET B 2 93 ? -23.707 31.913 30.983 1.00 12.18 ? 85 MET A HA 1 +ATOM 3294 H HB2 . MET B 2 93 ? -22.136 34.046 31.944 1.00 14.41 ? 85 MET A HB2 1 +ATOM 3295 H HB3 . MET B 2 93 ? -22.279 33.707 30.401 1.00 14.41 ? 85 MET A HB3 1 +ATOM 3296 H HG2 . MET B 2 93 ? -24.319 34.708 32.069 1.00 19.76 ? 85 MET A HG2 1 +ATOM 3297 H HG3 . MET B 2 93 ? -23.672 35.462 30.839 1.00 19.76 ? 85 MET A HG3 1 +ATOM 3298 H HE1 . MET B 2 93 ? -25.148 33.542 27.897 1.00 22.79 ? 85 MET A HE1 1 +ATOM 3299 H HE2 . MET B 2 93 ? -24.130 34.701 28.281 1.00 22.79 ? 85 MET A HE2 1 +ATOM 3300 H HE3 . MET B 2 93 ? -23.790 33.191 28.644 1.00 22.79 ? 85 MET A HE3 1 +ATOM 3301 N N . ASP B 2 94 ? -21.010 31.203 32.495 1.00 10.31 ? 86 ASP A N 1 +ATOM 3302 C CA . ASP B 2 94 ? -19.832 30.332 32.442 1.00 13.30 ? 86 ASP A CA 1 +ATOM 3303 C C . ASP B 2 94 ? -20.166 28.839 32.426 1.00 11.49 ? 86 ASP A C 1 +ATOM 3304 O O . ASP B 2 94 ? -19.250 28.024 32.274 1.00 11.54 ? 86 ASP A O 1 +ATOM 3305 C CB . ASP B 2 94 ? -18.897 30.603 33.621 1.00 16.23 ? 86 ASP A CB 1 +ATOM 3306 C CG . ASP B 2 94 ? -18.124 31.896 33.481 1.00 27.48 ? 86 ASP A CG 1 +ATOM 3307 O OD1 . ASP B 2 94 ? -17.936 32.371 32.342 1.00 33.47 ? 86 ASP A OD1 1 +ATOM 3308 O OD2 . ASP B 2 94 ? -17.691 32.427 34.526 1.00 38.99 -1 86 ASP A OD2 1 +ATOM 3309 H H . ASP B 2 94 ? -21.126 31.597 33.250 1.00 12.38 ? 86 ASP A H 1 +ATOM 3310 H HA . ASP B 2 94 ? -19.342 30.529 31.629 1.00 15.95 ? 86 ASP A HA 1 +ATOM 3311 H HB2 . ASP B 2 94 ? -19.422 30.656 34.434 1.00 19.48 ? 86 ASP A HB2 1 +ATOM 3312 H HB3 . ASP B 2 94 ? -18.256 29.878 33.687 1.00 19.48 ? 86 ASP A HB3 1 +ATOM 3313 N N . ASP B 2 95 ? -21.442 28.466 32.574 1.00 8.83 ? 87 ASP A N 1 +ATOM 3314 C CA . ASP B 2 95 ? -21.824 27.062 32.428 1.00 7.22 ? 87 ASP A CA 1 +ATOM 3315 C C . ASP B 2 95 ? -21.841 26.627 30.964 1.00 7.30 ? 87 ASP A C 1 +ATOM 3316 O O . ASP B 2 95 ? -21.933 25.441 30.681 1.00 8.02 ? 87 ASP A O 1 +ATOM 3317 C CB . ASP B 2 95 ? -23.193 26.794 33.056 1.00 7.56 ? 87 ASP A CB 1 +ATOM 3318 C CG . ASP B 2 95 ? -23.180 26.814 34.565 1.00 7.39 ? 87 ASP A CG 1 +ATOM 3319 O OD1 . ASP B 2 95 ? -22.134 26.495 35.178 1.00 8.10 ? 87 ASP A OD1 1 +ATOM 3320 O OD2 . ASP B 2 95 ? -24.255 27.093 35.142 1.00 8.26 -1 87 ASP A OD2 1 +ATOM 3321 H H . ASP B 2 95 ? -22.093 28.997 32.756 1.00 10.60 ? 87 ASP A H 1 +ATOM 3322 H HA . ASP B 2 95 ? -21.173 26.512 32.892 1.00 8.66 ? 87 ASP A HA 1 +ATOM 3323 H HB2 . ASP B 2 95 ? -23.814 27.476 32.755 1.00 9.07 ? 87 ASP A HB2 1 +ATOM 3324 H HB3 . ASP B 2 95 ? -23.502 25.919 32.773 1.00 9.07 ? 87 ASP A HB3 1 +ATOM 3325 N N . ARG B 2 96 ? -21.771 27.566 30.023 1.00 8.17 ? 88 ARG A N 1 +ATOM 3326 C CA . ARG B 2 96 ? -21.612 27.225 28.614 1.00 8.27 ? 88 ARG A CA 1 +ATOM 3327 C C . ARG B 2 96 ? -20.358 26.381 28.476 1.00 8.75 ? 88 ARG A C 1 +ATOM 3328 O O . ARG B 2 96 ? -19.270 26.819 28.823 1.00 10.68 ? 88 ARG A O 1 +ATOM 3329 C CB . ARG B 2 96 ? -21.471 28.487 27.744 1.00 10.68 ? 88 ARG A CB 1 +ATOM 3330 C CG . ARG B 2 96 ? -22.715 29.347 27.672 1.00 14.95 ? 88 ARG A CG 1 +ATOM 3331 C CD . ARG B 2 96 ? -22.461 30.660 26.929 1.00 16.86 ? 88 ARG A CD 1 +ATOM 3332 N NE . ARG B 2 96 ? -21.601 31.547 27.707 1.00 20.46 ? 88 ARG A NE 1 +ATOM 3333 C CZ . ARG B 2 96 ? -21.223 32.757 27.307 1.00 21.99 ? 88 ARG A CZ 1 +ATOM 3334 N NH1 . ARG B 2 96 ? -21.630 33.226 26.134 1.00 25.79 1 88 ARG A NH1 1 +ATOM 3335 N NH2 . ARG B 2 96 ? -20.439 33.495 28.081 1.00 21.75 ? 88 ARG A NH2 1 +ATOM 3336 H H . ARG B 2 96 ? -21.813 28.411 30.177 1.00 9.80 ? 88 ARG A H 1 +ATOM 3337 H HA . ARG B 2 96 ? -22.375 26.712 28.308 1.00 9.93 ? 88 ARG A HA 1 +ATOM 3338 H HB2 . ARG B 2 96 ? -20.756 29.034 28.105 1.00 12.81 ? 88 ARG A HB2 1 +ATOM 3339 H HB3 . ARG B 2 96 ? -21.249 28.215 26.839 1.00 12.81 ? 88 ARG A HB3 1 +ATOM 3340 H HG2 . ARG B 2 96 ? -23.411 28.863 27.201 1.00 17.95 ? 88 ARG A HG2 1 +ATOM 3341 H HG3 . ARG B 2 96 ? -23.007 29.561 28.572 1.00 17.95 ? 88 ARG A HG3 1 +ATOM 3342 H HD2 . ARG B 2 96 ? -22.021 30.472 26.085 1.00 20.24 ? 88 ARG A HD2 1 +ATOM 3343 H HD3 . ARG B 2 96 ? -23.305 31.112 26.776 1.00 20.24 ? 88 ARG A HD3 1 +ATOM 3344 H HE . ARG B 2 96 ? -21.291 31.255 28.453 1.00 24.55 ? 88 ARG A HE 1 +ATOM 3345 H HH11 . ARG B 2 96 ? -22.138 32.747 25.632 1.00 30.95 ? 88 ARG A HH11 1 +ATOM 3346 H HH12 . ARG B 2 96 ? -21.385 34.009 25.875 1.00 30.95 ? 88 ARG A HH12 1 +ATOM 3347 H HH21 . ARG B 2 96 ? -20.175 33.190 28.841 1.00 26.10 ? 88 ARG A HH21 1 +ATOM 3348 H HH22 . ARG B 2 96 ? -20.194 34.277 27.823 1.00 26.10 ? 88 ARG A HH22 1 +ATOM 3349 N N . ASN B 2 97 ? -20.516 25.153 28.017 1.00 7.67 ? 89 ASN A N 1 +ATOM 3350 C CA . ASN B 2 97 ? -19.425 24.198 28.039 1.00 7.32 ? 89 ASN A CA 1 +ATOM 3351 C C . ASN B 2 97 ? -19.881 22.904 27.407 1.00 6.16 ? 89 ASN A C 1 +ATOM 3352 O O . ASN B 2 97 ? -21.053 22.766 27.049 1.00 7.36 ? 89 ASN A O 1 +ATOM 3353 C CB . ASN B 2 97 ? -18.949 23.943 29.480 1.00 8.10 ? 89 ASN A CB 1 +ATOM 3354 C CG . ASN B 2 97 ? -17.467 23.786 29.562 1.00 8.98 ? 89 ASN A CG 1 +ATOM 3355 O OD1 . ASN B 2 97 ? -16.846 23.278 28.627 1.00 10.45 ? 89 ASN A OD1 1 +ATOM 3356 N ND2 . ASN B 2 97 ? -16.877 24.233 30.645 1.00 10.87 ? 89 ASN A ND2 1 +ATOM 3357 H H . ASN B 2 97 ? -21.248 24.846 27.687 1.00 9.20 ? 89 ASN A H 1 +ATOM 3358 H HA . ASN B 2 97 ? -18.680 24.546 27.525 1.00 8.79 ? 89 ASN A HA 1 +ATOM 3359 H HB2 . ASN B 2 97 ? -19.204 24.696 30.037 1.00 9.72 ? 89 ASN A HB2 1 +ATOM 3360 H HB3 . ASN B 2 97 ? -19.359 23.129 29.811 1.00 9.72 ? 89 ASN A HB3 1 +ATOM 3361 H HD21 . ASN B 2 97 ? -16.024 24.162 30.731 1.00 13.04 ? 89 ASN A HD21 1 +ATOM 3362 H HD22 . ASN B 2 97 ? -17.343 24.598 31.269 1.00 13.04 ? 89 ASN A HD22 1 +ATOM 3363 N N . HIS B 2 98 ? -18.946 21.958 27.302 1.00 6.00 ? 90 HIS A N 1 +ATOM 3364 C CA . HIS B 2 98 ? -19.256 20.584 26.925 1.00 6.19 ? 90 HIS A CA 1 +ATOM 3365 C C . HIS B 2 98 ? -19.302 19.724 28.186 1.00 6.27 ? 90 HIS A C 1 +ATOM 3366 O O . HIS B 2 98 ? -18.365 19.757 29.000 1.00 7.00 ? 90 HIS A O 1 +ATOM 3367 C CB . HIS B 2 98 ? -18.196 20.024 25.989 1.00 6.66 ? 90 HIS A CB 1 +ATOM 3368 C CG . HIS B 2 98 ? -18.244 20.605 24.614 1.00 8.18 ? 90 HIS A CG 1 +ATOM 3369 N ND1 . HIS B 2 98 ? -17.817 21.877 24.325 1.00 9.72 ? 90 HIS A ND1 1 +ATOM 3370 C CD2 . HIS B 2 98 ? -18.674 20.067 23.452 1.00 9.29 ? 90 HIS A CD2 1 +ATOM 3371 C CE1 . HIS B 2 98 ? -17.965 22.095 23.024 1.00 10.93 ? 90 HIS A CE1 1 +ATOM 3372 N NE2 . HIS B 2 98 ? -18.487 21.017 22.476 1.00 10.36 ? 90 HIS A NE2 1 +ATOM 3373 H H . HIS B 2 98 ? -18.109 22.093 27.447 1.00 7.19 ? 90 HIS A H 1 +ATOM 3374 H HA . HIS B 2 98 ? -20.119 20.546 26.484 1.00 7.43 ? 90 HIS A HA 1 +ATOM 3375 H HB2 . HIS B 2 98 ? -17.320 20.212 26.360 1.00 8.00 ? 90 HIS A HB2 1 +ATOM 3376 H HB3 . HIS B 2 98 ? -18.322 19.066 25.911 1.00 8.00 ? 90 HIS A HB3 1 +ATOM 3377 H HD1 . HIS B 2 98 ? -17.487 22.434 24.891 1.00 11.67 ? 90 HIS A HD1 1 +ATOM 3378 H HD2 . HIS B 2 98 ? -19.020 19.212 23.333 1.00 11.15 ? 90 HIS A HD2 1 +ATOM 3379 H HE1 . HIS B 2 98 ? -17.753 22.884 22.578 1.00 13.12 ? 90 HIS A HE1 1 +ATOM 3380 N N . TYR B 2 99 ? -20.371 18.964 28.329 1.00 5.34 ? 91 TYR A N 1 +ATOM 3381 C CA . TYR B 2 99 ? -20.607 18.091 29.467 1.00 5.93 ? 91 TYR A CA 1 +ATOM 3382 C C . TYR B 2 99 ? -20.553 16.649 29.034 1.00 5.75 ? 91 TYR A C 1 +ATOM 3383 O O . TYR B 2 99 ? -21.104 16.290 27.990 1.00 7.91 ? 91 TYR A O 1 +ATOM 3384 C CB . TYR B 2 99 ? -21.993 18.401 30.067 1.00 5.86 ? 91 TYR A CB 1 +ATOM 3385 C CG . TYR B 2 99 ? -22.030 19.746 30.701 1.00 5.71 ? 91 TYR A CG 1 +ATOM 3386 C CD1 . TYR B 2 99 ? -21.972 19.886 32.086 1.00 8.01 ? 91 TYR A CD1 1 +ATOM 3387 C CD2 . TYR B 2 99 ? -22.089 20.892 29.932 1.00 5.65 ? 91 TYR A CD2 1 +ATOM 3388 C CE1 . TYR B 2 99 ? -21.958 21.130 32.683 1.00 8.72 ? 91 TYR A CE1 1 +ATOM 3389 C CE2 . TYR B 2 99 ? -22.076 22.133 30.523 1.00 6.09 ? 91 TYR A CE2 1 +ATOM 3390 C CZ . TYR B 2 99 ? -22.015 22.248 31.896 1.00 6.87 ? 91 TYR A CZ 1 +ATOM 3391 O OH . TYR B 2 99 ? -22.015 23.491 32.510 1.00 8.40 ? 91 TYR A OH 1 +ATOM 3392 H H . TYR B 2 99 ? -21.007 18.935 27.751 1.00 6.40 ? 91 TYR A H 1 +ATOM 3393 H HA . TYR B 2 99 ? -19.930 18.242 30.145 1.00 7.12 ? 91 TYR A HA 1 +ATOM 3394 H HB2 . TYR B 2 99 ? -22.659 18.380 29.362 1.00 7.03 ? 91 TYR A HB2 1 +ATOM 3395 H HB3 . TYR B 2 99 ? -22.203 17.740 30.746 1.00 7.03 ? 91 TYR A HB3 1 +ATOM 3396 H HD1 . TYR B 2 99 ? -21.920 19.126 32.619 1.00 9.62 ? 91 TYR A HD1 1 +ATOM 3397 H HD2 . TYR B 2 99 ? -22.117 20.824 29.005 1.00 6.78 ? 91 TYR A HD2 1 +ATOM 3398 H HE1 . TYR B 2 99 ? -21.921 21.207 33.609 1.00 10.47 ? 91 TYR A HE1 1 +ATOM 3399 H HE2 . TYR B 2 99 ? -22.118 22.898 29.996 1.00 7.31 ? 91 TYR A HE2 1 +ATOM 3400 H HH . TYR B 2 99 ? -22.052 24.098 31.930 1.00 10.08 ? 91 TYR A HH 1 +ATOM 3401 N N . THR B 2 100 ? -19.934 15.813 29.852 1.00 5.75 ? 92 THR A N 1 +ATOM 3402 C CA . THR B 2 100 ? -19.839 14.408 29.527 1.00 5.45 ? 92 THR A CA 1 +ATOM 3403 C C . THR B 2 100 ? -20.605 13.569 30.527 1.00 4.88 ? 92 THR A C 1 +ATOM 3404 O O . THR B 2 100 ? -20.418 13.713 31.729 1.00 5.69 ? 92 THR A O 1 +ATOM 3405 C CB . THR B 2 100 ? -18.389 13.967 29.471 1.00 5.17 ? 92 THR A CB 1 +ATOM 3406 O OG1 . THR B 2 100 ? -17.756 14.757 28.477 1.00 6.88 ? 92 THR A OG1 1 +ATOM 3407 C CG2 . THR B 2 100 ? -18.261 12.494 29.115 1.00 6.74 ? 92 THR A CG2 1 +ATOM 3408 H H . THR B 2 100 ? -19.562 16.035 30.595 1.00 6.90 ? 92 THR A H 1 +ATOM 3409 H HA . THR B 2 100 ? -20.230 14.260 28.652 1.00 6.54 ? 92 THR A HA 1 +ATOM 3410 H HB . THR B 2 100 ? -17.965 14.119 30.331 1.00 6.21 ? 92 THR A HB 1 +ATOM 3411 H HG1 . THR B 2 100 ? -16.946 14.545 28.413 1.00 8.26 ? 92 THR A HG1 1 +ATOM 3412 H HG21 . THR B 2 100 ? -17.326 12.240 29.086 1.00 8.09 ? 92 THR A HG21 1 +ATOM 3413 H HG22 . THR B 2 100 ? -18.715 11.952 29.779 1.00 8.09 ? 92 THR A HG22 1 +ATOM 3414 H HG23 . THR B 2 100 ? -18.660 12.328 28.246 1.00 8.09 ? 92 THR A HG23 1 +ATOM 3415 N N . CYS B 2 101 ? -21.450 12.689 30.001 1.00 5.19 ? 93 CYS A N 1 +ATOM 3416 C CA . CYS B 2 101 ? -22.127 11.682 30.781 1.00 5.67 ? 93 CYS A CA 1 +ATOM 3417 C C . CYS B 2 101 ? -21.366 10.376 30.606 1.00 5.36 ? 93 CYS A C 1 +ATOM 3418 O O . CYS B 2 101 ? -21.087 9.968 29.472 1.00 6.09 ? 93 CYS A O 1 +ATOM 3419 C CB . CYS B 2 101 ? -23.536 11.547 30.240 1.00 6.85 ? 93 CYS A CB 1 +ATOM 3420 S SG . CYS B 2 101 ? -24.524 10.270 31.033 1.00 7.36 ? 93 CYS A SG 1 +ATOM 3421 H H . CYS B 2 101 ? -21.649 12.662 29.165 1.00 6.23 ? 93 CYS A H 1 +ATOM 3422 H HA . CYS B 2 101 ? -22.153 11.928 31.719 1.00 6.80 ? 93 CYS A HA 1 +ATOM 3423 H HB2 . CYS B 2 101 ? -23.996 12.392 30.360 1.00 8.22 ? 93 CYS A HB2 1 +ATOM 3424 H HB3 . CYS B 2 101 ? -23.485 11.334 29.294 1.00 8.22 ? 93 CYS A HB3 1 +ATOM 3425 N N . GLU B 2 102 ? -21.028 9.715 31.716 1.00 5.55 ? 94 GLU A N 1 +ATOM 3426 C CA . GLU B 2 102 ? -20.180 8.525 31.693 1.00 6.06 ? 94 GLU A CA 1 +ATOM 3427 C C . GLU B 2 102 ? -20.770 7.462 32.607 1.00 6.14 ? 94 GLU A C 1 +ATOM 3428 O O . GLU B 2 102 ? -20.979 7.717 33.804 1.00 7.87 ? 94 GLU A O 1 +ATOM 3429 C CB . GLU B 2 102 ? -18.765 8.890 32.141 1.00 7.22 ? 94 GLU A CB 1 +ATOM 3430 C CG . GLU B 2 102 ? -17.778 7.722 32.132 1.00 7.77 ? 94 GLU A CG 1 +ATOM 3431 C CD . GLU B 2 102 ? -16.597 8.003 32.991 1.00 8.97 ? 94 GLU A CD 1 +ATOM 3432 O OE1 . GLU B 2 102 ? -16.482 7.353 34.067 1.00 10.45 ? 94 GLU A OE1 1 +ATOM 3433 O OE2 . GLU B 2 102 ? -15.814 8.893 32.632 1.00 9.47 -1 94 GLU A OE2 1 +ATOM 3434 H H . GLU B 2 102 ? -21.282 9.942 32.505 1.00 6.66 ? 94 GLU A H 1 +ATOM 3435 H HA . GLU B 2 102 ? -20.139 8.170 30.791 1.00 7.27 ? 94 GLU A HA 1 +ATOM 3436 H HB2 . GLU B 2 102 ? -18.418 9.573 31.547 1.00 8.66 ? 94 GLU A HB2 1 +ATOM 3437 H HB3 . GLU B 2 102 ? -18.806 9.234 33.047 1.00 8.66 ? 94 GLU A HB3 1 +ATOM 3438 H HG2 . GLU B 2 102 ? -18.219 6.927 32.471 1.00 9.33 ? 94 GLU A HG2 1 +ATOM 3439 H HG3 . GLU B 2 102 ? -17.467 7.573 31.226 1.00 9.33 ? 94 GLU A HG3 1 +ATOM 3440 N N . VAL B 2 103 ? -21.019 6.283 32.080 1.00 5.94 ? 95 VAL A N 1 +ATOM 3441 C CA . VAL B 2 103 ? -21.607 5.202 32.867 1.00 6.53 ? 95 VAL A CA 1 +ATOM 3442 C C . VAL B 2 103 ? -20.730 3.969 32.755 1.00 6.57 ? 95 VAL A C 1 +ATOM 3443 O O . VAL B 2 103 ? -20.230 3.635 31.683 1.00 7.09 ? 95 VAL A O 1 +ATOM 3444 C CB . VAL B 2 103 ? -23.040 4.870 32.394 1.00 6.20 ? 95 VAL A CB 1 +ATOM 3445 C CG1 . VAL B 2 103 ? -23.637 3.721 33.217 1.00 7.87 ? 95 VAL A CG1 1 +ATOM 3446 C CG2 . VAL B 2 103 ? -23.939 6.091 32.510 1.00 7.43 ? 95 VAL A CG2 1 +ATOM 3447 H H . VAL B 2 103 ? -20.857 6.073 31.261 1.00 7.12 ? 95 VAL A H 1 +ATOM 3448 H HA . VAL B 2 103 ? -21.646 5.467 33.799 1.00 7.84 ? 95 VAL A HA 1 +ATOM 3449 H HB . VAL B 2 103 ? -23.015 4.597 31.463 1.00 7.44 ? 95 VAL A HB 1 +ATOM 3450 H HG11 . VAL B 2 103 ? -24.534 3.537 32.897 1.00 9.45 ? 95 VAL A HG11 1 +ATOM 3451 H HG12 . VAL B 2 103 ? -23.080 2.934 33.111 1.00 9.45 ? 95 VAL A HG12 1 +ATOM 3452 H HG13 . VAL B 2 103 ? -23.666 3.984 34.150 1.00 9.45 ? 95 VAL A HG13 1 +ATOM 3453 H HG21 . VAL B 2 103 ? -24.830 5.857 32.208 1.00 8.92 ? 95 VAL A HG21 1 +ATOM 3454 H HG22 . VAL B 2 103 ? -23.967 6.375 33.438 1.00 8.92 ? 95 VAL A HG22 1 +ATOM 3455 H HG23 . VAL B 2 103 ? -23.578 6.802 31.958 1.00 8.92 ? 95 VAL A HG23 1 +ATOM 3456 N N . THR B 2 104 ? -20.547 3.317 33.901 1.00 7.33 ? 96 THR A N 1 +ATOM 3457 C CA . THR B 2 104 ? -19.855 2.041 33.993 1.00 8.50 ? 96 THR A CA 1 +ATOM 3458 C C . THR B 2 104 ? -20.851 0.938 34.373 1.00 9.04 ? 96 THR A C 1 +ATOM 3459 O O . THR B 2 104 ? -21.586 1.096 35.358 1.00 10.01 ? 96 THR A O 1 +ATOM 3460 C CB . THR B 2 104 ? -18.754 2.078 35.062 1.00 11.17 ? 96 THR A CB 1 +ATOM 3461 O OG1 . THR B 2 104 ? -17.852 3.166 34.791 1.00 10.25 ? 96 THR A OG1 1 +ATOM 3462 C CG2 . THR B 2 104 ? -17.975 0.756 35.069 1.00 12.31 ? 96 THR A CG2 1 +ATOM 3463 H H . THR B 2 104 ? -20.825 3.607 34.662 1.00 8.79 ? 96 THR A H 1 +ATOM 3464 H HA . THR B 2 104 ? -19.454 1.821 33.137 1.00 10.20 ? 96 THR A HA 1 +ATOM 3465 H HB . THR B 2 104 ? -19.157 2.202 35.936 1.00 13.41 ? 96 THR A HB 1 +ATOM 3466 H HG1 . THR B 2 104 ? -17.248 3.190 35.374 1.00 12.30 ? 96 THR A HG1 1 +ATOM 3467 H HG21 . THR B 2 104 ? -17.281 0.784 35.746 1.00 14.77 ? 96 THR A HG21 1 +ATOM 3468 H HG22 . THR B 2 104 ? -18.575 0.019 35.263 1.00 14.77 ? 96 THR A HG22 1 +ATOM 3469 H HG23 . THR B 2 104 ? -17.564 0.610 34.203 1.00 14.77 ? 96 THR A HG23 1 +ATOM 3470 N N . TRP B 2 105 ? -20.891 -0.139 33.600 1.00 8.16 ? 97 TRP A N 1 +ATOM 3471 C CA . TRP B 2 105 ? -21.676 -1.323 33.944 1.00 10.73 ? 97 TRP A CA 1 +ATOM 3472 C C . TRP B 2 105 ? -20.781 -2.514 34.216 1.00 10.72 ? 97 TRP A C 1 +ATOM 3473 O O . TRP B 2 105 ? -19.669 -2.605 33.680 1.00 11.73 ? 97 TRP A O 1 +ATOM 3474 C CB . TRP B 2 105 ? -22.573 -1.739 32.805 1.00 10.01 ? 97 TRP A CB 1 +ATOM 3475 C CG . TRP B 2 105 ? -23.559 -0.720 32.365 1.00 9.70 ? 97 TRP A CG 1 +ATOM 3476 C CD1 . TRP B 2 105 ? -24.795 -0.478 32.890 1.00 9.70 ? 97 TRP A CD1 1 +ATOM 3477 C CD2 . TRP B 2 105 ? -23.416 0.175 31.257 1.00 8.88 ? 97 TRP A CD2 1 +ATOM 3478 N NE1 . TRP B 2 105 ? -25.416 0.526 32.193 1.00 8.70 ? 97 TRP A NE1 1 +ATOM 3479 C CE2 . TRP B 2 105 ? -24.596 0.945 31.181 1.00 10.35 ? 97 TRP A CE2 1 +ATOM 3480 C CE3 . TRP B 2 105 ? -22.404 0.402 30.318 1.00 12.23 ? 97 TRP A CE3 1 +ATOM 3481 C CZ2 . TRP B 2 105 ? -24.791 1.927 30.202 1.00 10.37 ? 97 TRP A CZ2 1 +ATOM 3482 C CZ3 . TRP B 2 105 ? -22.594 1.380 29.351 1.00 13.26 ? 97 TRP A CZ3 1 +ATOM 3483 C CH2 . TRP B 2 105 ? -23.780 2.131 29.307 1.00 12.61 ? 97 TRP A CH2 1 +ATOM 3484 H H . TRP B 2 105 ? -20.465 -0.212 32.856 1.00 9.79 ? 97 TRP A H 1 +ATOM 3485 H HA . TRP B 2 105 ? -22.218 -1.147 34.729 1.00 12.88 ? 97 TRP A HA 1 +ATOM 3486 H HB2 . TRP B 2 105 ? -22.018 -1.956 32.040 1.00 12.01 ? 97 TRP A HB2 1 +ATOM 3487 H HB3 . TRP B 2 105 ? -23.070 -2.526 33.078 1.00 12.01 ? 97 TRP A HB3 1 +ATOM 3488 H HD1 . TRP B 2 105 ? -25.157 -0.919 33.625 1.00 11.63 ? 97 TRP A HD1 1 +ATOM 3489 H HE1 . TRP B 2 105 ? -26.198 0.840 32.361 1.00 10.44 ? 97 TRP A HE1 1 +ATOM 3490 H HE3 . TRP B 2 105 ? -21.616 -0.091 30.343 1.00 14.68 ? 97 TRP A HE3 1 +ATOM 3491 H HZ2 . TRP B 2 105 ? -25.573 2.429 30.171 1.00 12.45 ? 97 TRP A HZ2 1 +ATOM 3492 H HZ3 . TRP B 2 105 ? -21.925 1.542 28.726 1.00 15.92 ? 97 TRP A HZ3 1 +ATOM 3493 H HH2 . TRP B 2 105 ? -23.881 2.781 28.649 1.00 15.13 ? 97 TRP A HH2 1 +ATOM 3494 N N . GLN B 2 106 ? -21.298 -3.459 34.989 1.00 11.08 ? 98 GLN A N 1 +ATOM 3495 C CA . GLN B 2 106 ? -20.663 -4.756 35.180 1.00 11.39 ? 98 GLN A CA 1 +ATOM 3496 C C . GLN B 2 106 ? -21.515 -5.850 34.561 1.00 13.01 ? 98 GLN A C 1 +ATOM 3497 O O . GLN B 2 106 ? -22.740 -5.847 34.690 1.00 13.48 ? 98 GLN A O 1 +ATOM 3498 C CB . GLN B 2 106 ? -20.440 -5.020 36.661 1.00 13.94 ? 98 GLN A CB 1 +ATOM 3499 C CG . GLN B 2 106 ? -19.607 -6.258 36.931 1.00 16.86 ? 98 GLN A CG 1 +ATOM 3500 C CD . GLN B 2 106 ? -19.039 -6.276 38.330 1.00 19.03 ? 98 GLN A CD 1 +ATOM 3501 O OE1 . GLN B 2 106 ? -19.143 -7.282 39.039 1.00 25.28 ? 98 GLN A OE1 1 +ATOM 3502 N NE2 . GLN B 2 106 ? -18.426 -5.173 38.737 1.00 15.82 ? 98 GLN A NE2 1 +ATOM 3503 H H . GLN B 2 106 ? -22.035 -3.371 35.425 1.00 13.29 ? 98 GLN A H 1 +ATOM 3504 H HA . GLN B 2 106 ? -19.800 -4.756 34.737 1.00 13.67 ? 98 GLN A HA 1 +ATOM 3505 H HB2 . GLN B 2 106 ? -19.979 -4.260 37.049 1.00 16.72 ? 98 GLN A HB2 1 +ATOM 3506 H HB3 . GLN B 2 106 ? -21.300 -5.140 37.092 1.00 16.72 ? 98 GLN A HB3 1 +ATOM 3507 H HG2 . GLN B 2 106 ? -20.164 -7.045 36.823 1.00 20.23 ? 98 GLN A HG2 1 +ATOM 3508 H HG3 . GLN B 2 106 ? -18.866 -6.285 36.305 1.00 20.23 ? 98 GLN A HG3 1 +ATOM 3509 H HE21 . GLN B 2 106 ? -18.368 -4.494 38.212 1.00 18.98 ? 98 GLN A HE21 1 +ATOM 3510 H HE22 . GLN B 2 106 ? -18.087 -5.136 39.526 1.00 18.98 ? 98 GLN A HE22 1 +ATOM 3511 N N . THR B 2 107 ? -20.853 -6.791 33.889 1.00 13.21 ? 99 THR A N 1 +ATOM 3512 C CA . THR B 2 107 ? -21.511 -7.929 33.233 1.00 14.55 ? 99 THR A CA 1 +ATOM 3513 C C . THR B 2 107 ? -21.441 -9.195 34.100 1.00 13.92 ? 99 THR A C 1 +ATOM 3514 O O . THR B 2 107 ? -20.744 -9.212 35.113 1.00 15.24 ? 99 THR A O 1 +ATOM 3515 C CB . THR B 2 107 ? -20.880 -8.196 31.856 1.00 18.31 ? 99 THR A CB 1 +ATOM 3516 O OG1 . THR B 2 107 ? -19.505 -8.544 32.021 1.00 23.13 ? 99 THR A OG1 1 +ATOM 3517 C CG2 . THR B 2 107 ? -20.982 -6.968 30.983 1.00 19.40 ? 99 THR A CG2 1 +ATOM 3518 H H . THR B 2 107 ? -19.998 -6.794 33.795 1.00 15.85 ? 99 THR A H 1 +ATOM 3519 H HA . THR B 2 107 ? -22.447 -7.714 33.095 1.00 17.46 ? 99 THR A HA 1 +ATOM 3520 H HB . THR B 2 107 ? -21.349 -8.924 31.420 1.00 21.97 ? 99 THR A HB 1 +ATOM 3521 H HG1 . THR B 2 107 ? -19.154 -8.692 31.272 1.00 27.75 ? 99 THR A HG1 1 +ATOM 3522 H HG21 . THR B 2 107 ? -20.582 -7.143 30.116 1.00 23.28 ? 99 THR A HG21 1 +ATOM 3523 H HG22 . THR B 2 107 ? -21.913 -6.727 30.857 1.00 23.28 ? 99 THR A HG22 1 +ATOM 3524 H HG23 . THR B 2 107 ? -20.518 -6.225 31.400 1.00 23.28 ? 99 THR A HG23 1 +ATOM 3525 N N . PRO B 2 108 ? -22.165 -10.264 33.720 1.00 15.81 ? 100 PRO A N 1 +ATOM 3526 C CA . PRO B 2 108 ? -22.228 -11.447 34.589 1.00 19.39 ? 100 PRO A CA 1 +ATOM 3527 C C . PRO B 2 108 ? -20.871 -12.063 34.912 1.00 20.64 ? 100 PRO A C 1 +ATOM 3528 O O . PRO B 2 108 ? -20.696 -12.629 35.999 1.00 21.83 ? 100 PRO A O 1 +ATOM 3529 C CB . PRO B 2 108 ? -23.077 -12.421 33.772 1.00 19.55 ? 100 PRO A CB 1 +ATOM 3530 C CG . PRO B 2 108 ? -23.962 -11.544 32.979 1.00 20.26 ? 100 PRO A CG 1 +ATOM 3531 C CD . PRO B 2 108 ? -23.124 -10.369 32.604 1.00 16.16 ? 100 PRO A CD 1 +ATOM 3532 H HA . PRO B 2 108 ? -22.689 -11.234 35.416 1.00 23.26 ? 100 PRO A HA 1 +ATOM 3533 H HB2 . PRO B 2 108 ? -22.507 -12.952 33.194 1.00 23.46 ? 100 PRO A HB2 1 +ATOM 3534 H HB3 . PRO B 2 108 ? -23.593 -12.988 34.366 1.00 23.46 ? 100 PRO A HB3 1 +ATOM 3535 H HG2 . PRO B 2 108 ? -24.264 -12.016 32.187 1.00 24.31 ? 100 PRO A HG2 1 +ATOM 3536 H HG3 . PRO B 2 108 ? -24.717 -11.266 33.522 1.00 24.31 ? 100 PRO A HG3 1 +ATOM 3537 H HD2 . PRO B 2 108 ? -22.656 -10.539 31.771 1.00 19.40 ? 100 PRO A HD2 1 +ATOM 3538 H HD3 . PRO B 2 108 ? -23.668 -9.568 32.550 1.00 19.40 ? 100 PRO A HD3 1 +ATOM 3539 N N . ASP B 2 109 ? -19.926 -11.937 33.986 1.00 17.86 ? 101 ASP A N 1 +ATOM 3540 C CA . ASP B 2 109 ? -18.592 -12.503 34.154 1.00 18.84 ? 101 ASP A CA 1 +ATOM 3541 C C . ASP B 2 109 ? -17.661 -11.590 34.948 1.00 20.86 ? 101 ASP A C 1 +ATOM 3542 O O . ASP B 2 109 ? -16.521 -11.955 35.234 1.00 22.97 ? 101 ASP A O 1 +ATOM 3543 C CB . ASP B 2 109 ? -17.983 -12.798 32.782 1.00 26.60 ? 101 ASP A CB 1 +ATOM 3544 C CG . ASP B 2 109 ? -18.029 -11.599 31.848 1.00 35.38 ? 101 ASP A CG 1 +ATOM 3545 O OD1 . ASP B 2 109 ? -16.984 -10.938 31.682 1.00 36.08 ? 101 ASP A OD1 1 +ATOM 3546 O OD2 . ASP B 2 109 ? -19.111 -11.320 31.282 1.00 39.15 -1 101 ASP A OD2 1 +ATOM 3547 H H . ASP B 2 109 ? -20.035 -11.522 33.240 1.00 21.43 ? 101 ASP A H 1 +ATOM 3548 H HA . ASP B 2 109 ? -18.666 -13.342 34.635 1.00 22.61 ? 101 ASP A HA 1 +ATOM 3549 H HB2 . ASP B 2 109 ? -17.054 -13.053 32.896 1.00 31.92 ? 101 ASP A HB2 1 +ATOM 3550 H HB3 . ASP B 2 109 ? -18.477 -13.521 32.366 1.00 31.92 ? 101 ASP A HB3 1 +ATOM 3551 N N . GLY B 2 110 ? -18.143 -10.403 35.295 1.00 17.07 ? 102 GLY A N 1 +ATOM 3552 C CA . GLY B 2 110 ? -17.369 -9.483 36.111 1.00 17.25 ? 102 GLY A CA 1 +ATOM 3553 C C . GLY B 2 110 ? -16.678 -8.410 35.301 1.00 14.64 ? 102 GLY A C 1 +ATOM 3554 O O . GLY B 2 110 ? -16.045 -7.513 35.872 1.00 16.66 ? 102 GLY A O 1 +ATOM 3555 H H . GLY B 2 110 ? -18.918 -10.107 35.070 1.00 20.49 ? 102 GLY A H 1 +ATOM 3556 H HA2 . GLY B 2 110 ? -17.956 -9.051 36.751 1.00 20.70 ? 102 GLY A HA2 1 +ATOM 3557 H HA3 . GLY B 2 110 ? -16.694 -9.978 36.601 1.00 20.70 ? 102 GLY A HA3 1 +ATOM 3558 N N . ASN B 2 111 ? -16.773 -8.509 33.977 1.00 16.09 ? 103 ASN A N 1 +ATOM 3559 C CA . ASN B 2 111 ? -16.204 -7.497 33.109 1.00 15.84 ? 103 ASN A CA 1 +ATOM 3560 C C . ASN B 2 111 ? -16.918 -6.184 33.350 1.00 12.95 ? 103 ASN A C 1 +ATOM 3561 O O . ASN B 2 111 ? -18.096 -6.159 33.712 1.00 13.91 ? 103 ASN A O 1 +ATOM 3562 C CB . ASN B 2 111 ? -16.319 -7.895 31.638 1.00 19.76 ? 103 ASN A CB 1 +ATOM 3563 C CG . ASN B 2 111 ? -15.597 -6.933 30.712 1.00 31.96 ? 103 ASN A CG 1 +ATOM 3564 O OD1 . ASN B 2 111 ? -14.484 -6.496 31.002 1.00 30.51 ? 103 ASN A OD1 1 +ATOM 3565 N ND2 . ASN B 2 111 ? -16.233 -6.593 29.590 1.00 29.93 ? 103 ASN A ND2 1 +ATOM 3566 H H . ASN B 2 111 ? -17.163 -9.153 33.561 1.00 19.31 ? 103 ASN A H 1 +ATOM 3567 H HA . ASN B 2 111 ? -15.265 -7.380 33.323 1.00 19.01 ? 103 ASN A HA 1 +ATOM 3568 H HB2 . ASN B 2 111 ? -15.931 -8.776 31.518 1.00 23.72 ? 103 ASN A HB2 1 +ATOM 3569 H HB3 . ASN B 2 111 ? -17.256 -7.908 31.387 1.00 23.72 ? 103 ASN A HB3 1 +ATOM 3570 H HD21 . ASN B 2 111 ? -17.013 -6.916 29.423 1.00 35.92 ? 103 ASN A HD21 1 +ATOM 3571 H HD22 . ASN B 2 111 ? -15.864 -6.051 29.034 1.00 35.92 ? 103 ASN A HD22 1 +ATOM 3572 N N . GLN B 2 112 ? -16.195 -5.090 33.165 1.00 12.03 ? 104 GLN A N 1 +ATOM 3573 C CA . GLN B 2 112 ? -16.801 -3.771 33.231 1.00 9.92 ? 104 GLN A CA 1 +ATOM 3574 C C . GLN B 2 112 ? -16.650 -3.057 31.910 1.00 10.59 ? 104 GLN A C 1 +ATOM 3575 O O . GLN B 2 112 ? -15.574 -3.039 31.305 1.00 12.79 ? 104 GLN A O 1 +ATOM 3576 C CB . GLN B 2 112 ? -16.207 -2.939 34.360 1.00 11.63 ? 104 GLN A CB 1 +ATOM 3577 C CG . GLN B 2 112 ? -16.559 -3.471 35.744 1.00 12.94 ? 104 GLN A CG 1 +ATOM 3578 C CD . GLN B 2 112 ? -16.234 -2.509 36.885 1.00 12.15 ? 104 GLN A CD 1 +ATOM 3579 O OE1 . GLN B 2 112 ? -16.779 -2.654 37.991 1.00 19.88 ? 104 GLN A OE1 1 +ATOM 3580 N NE2 . GLN B 2 112 ? -15.329 -1.598 36.658 1.00 13.31 ? 104 GLN A NE2 1 +ATOM 3581 H H . GLN B 2 112 ? -15.351 -5.085 33.000 1.00 14.44 ? 104 GLN A H 1 +ATOM 3582 H HA . GLN B 2 112 ? -17.750 -3.873 33.405 1.00 11.90 ? 104 GLN A HA 1 +ATOM 3583 H HB2 . GLN B 2 112 ? -15.240 -2.940 34.277 1.00 13.95 ? 104 GLN A HB2 1 +ATOM 3584 H HB3 . GLN B 2 112 ? -16.544 -2.032 34.294 1.00 13.95 ? 104 GLN A HB3 1 +ATOM 3585 H HG2 . GLN B 2 112 ? -17.511 -3.654 35.774 1.00 15.53 ? 104 GLN A HG2 1 +ATOM 3586 H HG3 . GLN B 2 112 ? -16.062 -4.290 35.898 1.00 15.53 ? 104 GLN A HG3 1 +ATOM 3587 H HE21 . GLN B 2 112 ? -14.942 -1.558 35.890 1.00 15.98 ? 104 GLN A HE21 1 +ATOM 3588 H HE22 . GLN B 2 112 ? -15.118 -1.038 37.275 1.00 15.98 ? 104 GLN A HE22 1 +ATOM 3589 N N . VAL B 2 113 ? -17.751 -2.456 31.482 1.00 9.04 ? 105 VAL A N 1 +ATOM 3590 C CA . VAL B 2 113 ? -17.833 -1.699 30.251 1.00 8.78 ? 105 VAL A CA 1 +ATOM 3591 C C . VAL B 2 113 ? -18.146 -0.261 30.623 1.00 9.10 ? 105 VAL A C 1 +ATOM 3592 O O . VAL B 2 113 ? -19.053 -0.008 31.423 1.00 9.78 ? 105 VAL A O 1 +ATOM 3593 C CB . VAL B 2 113 ? -18.943 -2.262 29.379 1.00 9.85 ? 105 VAL A CB 1 +ATOM 3594 C CG1 . VAL B 2 113 ? -19.143 -1.428 28.121 1.00 12.44 ? 105 VAL A CG1 1 +ATOM 3595 C CG2 . VAL B 2 113 ? -18.626 -3.694 29.014 1.00 15.16 ? 105 VAL A CG2 1 +ATOM 3596 H H . VAL B 2 113 ? -18.495 -2.477 31.912 1.00 10.85 ? 105 VAL A H 1 +ATOM 3597 H HA . VAL B 2 113 ? -16.991 -1.735 29.770 1.00 10.53 ? 105 VAL A HA 1 +ATOM 3598 H HB . VAL B 2 113 ? -19.774 -2.255 29.879 1.00 11.82 ? 105 VAL A HB 1 +ATOM 3599 H HG11 . VAL B 2 113 ? -19.857 -1.819 27.594 1.00 14.92 ? 105 VAL A HG11 1 +ATOM 3600 H HG12 . VAL B 2 113 ? -19.378 -0.522 28.377 1.00 14.92 ? 105 VAL A HG12 1 +ATOM 3601 H HG13 . VAL B 2 113 ? -18.318 -1.424 27.610 1.00 14.92 ? 105 VAL A HG13 1 +ATOM 3602 H HG21 . VAL B 2 113 ? -19.341 -4.043 28.458 1.00 18.20 ? 105 VAL A HG21 1 +ATOM 3603 H HG22 . VAL B 2 113 ? -17.787 -3.717 28.528 1.00 18.20 ? 105 VAL A HG22 1 +ATOM 3604 H HG23 . VAL B 2 113 ? -18.553 -4.218 29.827 1.00 18.20 ? 105 VAL A HG23 1 +ATOM 3605 N N . ILE B 2 114 ? -17.400 0.677 30.046 1.00 7.01 ? 106 ILE A N 1 +ATOM 3606 C CA . ILE B 2 114 ? -17.577 2.104 30.317 1.00 7.38 ? 106 ILE A CA 1 +ATOM 3607 C C . ILE B 2 114 ? -17.896 2.804 29.008 1.00 6.58 ? 106 ILE A C 1 +ATOM 3608 O O . ILE B 2 114 ? -17.244 2.538 27.997 1.00 8.11 ? 106 ILE A O 1 +ATOM 3609 C CB . ILE B 2 114 ? -16.327 2.763 30.914 1.00 7.98 ? 106 ILE A CB 1 +ATOM 3610 C CG1 . ILE B 2 114 ? -15.772 1.932 32.076 1.00 9.46 ? 106 ILE A CG1 1 +ATOM 3611 C CG2 . ILE B 2 114 ? -16.661 4.175 31.357 1.00 9.83 ? 106 ILE A CG2 1 +ATOM 3612 C CD1 . ILE B 2 114 ? -14.426 2.448 32.560 1.00 13.97 ? 106 ILE A CD1 1 +ATOM 3613 H H . ILE B 2 114 ? -16.773 0.510 29.482 1.00 8.41 ? 106 ILE A H 1 +ATOM 3614 H HA . ILE B 2 114 ? -18.320 2.232 30.928 1.00 8.85 ? 106 ILE A HA 1 +ATOM 3615 H HB . ILE B 2 114 ? -15.648 2.812 30.223 1.00 9.57 ? 106 ILE A HB 1 +ATOM 3616 H HG12 . ILE B 2 114 ? -16.395 1.969 32.819 1.00 11.35 ? 106 ILE A HG12 1 +ATOM 3617 H HG13 . ILE B 2 114 ? -15.656 1.015 31.783 1.00 11.35 ? 106 ILE A HG13 1 +ATOM 3618 H HG21 . ILE B 2 114 ? -15.865 4.584 31.733 1.00 11.80 ? 106 ILE A HG21 1 +ATOM 3619 H HG22 . ILE B 2 114 ? -16.962 4.683 30.588 1.00 11.80 ? 106 ILE A HG22 1 +ATOM 3620 H HG23 . ILE B 2 114 ? -17.362 4.139 32.026 1.00 11.80 ? 106 ILE A HG23 1 +ATOM 3621 H HD11 . ILE B 2 114 ? -14.119 1.891 33.292 1.00 16.77 ? 106 ILE A HD11 1 +ATOM 3622 H HD12 . ILE B 2 114 ? -13.792 2.410 31.827 1.00 16.77 ? 106 ILE A HD12 1 +ATOM 3623 H HD13 . ILE B 2 114 ? -14.529 3.364 32.861 1.00 16.77 ? 106 ILE A HD13 1 +ATOM 3624 N N . ARG B 2 115 ? -18.920 3.650 29.009 1.00 7.02 ? 107 ARG A N 1 +ATOM 3625 C CA . ARG B 2 115 ? -19.227 4.469 27.836 1.00 6.48 ? 107 ARG A CA 1 +ATOM 3626 C C . ARG B 2 115 ? -19.471 5.891 28.271 1.00 6.12 ? 107 ARG A C 1 +ATOM 3627 O O . ARG B 2 115 ? -19.891 6.138 29.398 1.00 6.85 ? 107 ARG A O 1 +ATOM 3628 C CB . ARG B 2 115 ? -20.434 3.926 27.070 1.00 7.42 ? 107 ARG A CB 1 +ATOM 3629 C CG . ARG B 2 115 ? -20.166 2.629 26.316 1.00 9.49 ? 107 ARG A CG 1 +ATOM 3630 C CD . ARG B 2 115 ? -19.157 2.844 25.179 1.00 9.90 ? 107 ARG A CD 1 +ATOM 3631 N NE . ARG B 2 115 ? -18.892 1.649 24.364 1.00 12.63 ? 107 ARG A NE 1 +ATOM 3632 C CZ . ARG B 2 115 ? -17.990 0.722 24.662 1.00 11.83 ? 107 ARG A CZ 1 +ATOM 3633 N NH1 . ARG B 2 115 ? -17.258 0.818 25.761 1.00 10.49 1 107 ARG A NH1 1 +ATOM 3634 N NH2 . ARG B 2 115 ? -17.819 -0.309 23.834 1.00 16.97 ? 107 ARG A NH2 1 +ATOM 3635 H H . ARG B 2 115 ? -19.453 3.770 29.673 1.00 8.43 ? 107 ARG A H 1 +ATOM 3636 H HA . ARG B 2 115 ? -18.464 4.464 27.237 1.00 7.78 ? 107 ARG A HA 1 +ATOM 3637 H HB2 . ARG B 2 115 ? -21.152 3.758 27.700 1.00 8.90 ? 107 ARG A HB2 1 +ATOM 3638 H HB3 . ARG B 2 115 ? -20.716 4.591 26.422 1.00 8.90 ? 107 ARG A HB3 1 +ATOM 3639 H HG2 . ARG B 2 115 ? -19.800 1.972 26.928 1.00 11.39 ? 107 ARG A HG2 1 +ATOM 3640 H HG3 . ARG B 2 115 ? -20.995 2.306 25.930 1.00 11.39 ? 107 ARG A HG3 1 +ATOM 3641 H HD2 . ARG B 2 115 ? -19.498 3.533 24.588 1.00 11.88 ? 107 ARG A HD2 1 +ATOM 3642 H HD3 . ARG B 2 115 ? -18.314 3.131 25.563 1.00 11.88 ? 107 ARG A HD3 1 +ATOM 3643 H HE . ARG B 2 115 ? -19.353 1.543 23.646 1.00 15.16 ? 107 ARG A HE 1 +ATOM 3644 H HH11 . ARG B 2 115 ? -17.364 1.487 26.291 1.00 12.59 ? 107 ARG A HH11 1 +ATOM 3645 H HH12 . ARG B 2 115 ? -16.678 0.211 25.945 1.00 12.59 ? 107 ARG A HH12 1 +ATOM 3646 H HH21 . ARG B 2 115 ? -18.297 -0.373 23.122 1.00 20.36 ? 107 ARG A HH21 1 +ATOM 3647 H HH22 . ARG B 2 115 ? -17.243 -0.920 24.021 1.00 20.36 ? 107 ARG A HH22 1 +ATOM 3648 N N . ASP B 2 116 ? -19.211 6.814 27.356 1.00 5.71 ? 108 ASP A N 1 +ATOM 3649 C CA . ASP B 2 116 ? -19.431 8.224 27.614 1.00 5.78 ? 108 ASP A CA 1 +ATOM 3650 C C . ASP B 2 116 ? -19.919 8.964 26.372 1.00 5.80 ? 108 ASP A C 1 +ATOM 3651 O O . ASP B 2 116 ? -19.804 8.464 25.256 1.00 7.05 ? 108 ASP A O 1 +ATOM 3652 C CB . ASP B 2 116 ? -18.217 8.897 28.300 1.00 6.39 ? 108 ASP A CB 1 +ATOM 3653 C CG . ASP B 2 116 ? -16.914 8.837 27.513 1.00 6.49 ? 108 ASP A CG 1 +ATOM 3654 O OD1 . ASP B 2 116 ? -16.895 8.420 26.335 1.00 7.82 ? 108 ASP A OD1 1 +ATOM 3655 O OD2 . ASP B 2 116 ? -15.897 9.280 28.115 1.00 7.33 -1 108 ASP A OD2 1 +ATOM 3656 H H . ASP B 2 116 ? -18.903 6.646 26.571 1.00 6.85 ? 108 ASP A H 1 +ATOM 3657 H HA . ASP B 2 116 ? -20.157 8.280 28.254 1.00 6.93 ? 108 ASP A HA 1 +ATOM 3658 H HB2 . ASP B 2 116 ? -18.426 9.832 28.448 1.00 7.67 ? 108 ASP A HB2 1 +ATOM 3659 H HB3 . ASP B 2 116 ? -18.063 8.460 29.153 1.00 7.67 ? 108 ASP A HB3 1 +ATOM 3660 N N . LYS B 2 117 ? -20.508 10.131 26.596 1.00 5.71 ? 109 LYS A N 1 +ATOM 3661 C CA . LYS B 2 117 ? -21.039 10.975 25.543 1.00 4.82 ? 109 LYS A CA 1 +ATOM 3662 C C . LYS B 2 117 ? -20.875 12.417 25.926 1.00 5.12 ? 109 LYS A C 1 +ATOM 3663 O O . LYS B 2 117 ? -21.112 12.802 27.072 1.00 5.66 ? 109 LYS A O 1 +ATOM 3664 C CB . LYS B 2 117 ? -22.517 10.727 25.333 1.00 6.63 ? 109 LYS A CB 1 +ATOM 3665 C CG . LYS B 2 117 ? -22.886 9.441 24.638 1.00 9.62 ? 109 LYS A CG 1 +ATOM 3666 C CD . LYS B 2 117 ? -22.502 9.422 23.150 1.00 10.88 ? 109 LYS A CD 1 +ATOM 3667 C CE . LYS B 2 117 ? -22.981 8.147 22.478 1.00 13.43 ? 109 LYS A CE 1 +ATOM 3668 N NZ . LYS B 2 117 ? -22.788 8.181 21.005 1.00 15.08 1 109 LYS A NZ 1 +ATOM 3669 H H . LYS B 2 117 ? -20.614 10.464 27.382 1.00 6.85 ? 109 LYS A H 1 +ATOM 3670 H HA . LYS B 2 117 ? -20.566 10.810 24.712 1.00 5.78 ? 109 LYS A HA 1 +ATOM 3671 H HB2 . LYS B 2 117 ? -22.951 10.719 26.201 1.00 7.96 ? 109 LYS A HB2 1 +ATOM 3672 H HB3 . LYS B 2 117 ? -22.875 11.455 24.801 1.00 7.96 ? 109 LYS A HB3 1 +ATOM 3673 H HG2 . LYS B 2 117 ? -22.427 8.706 25.074 1.00 11.54 ? 109 LYS A HG2 1 +ATOM 3674 H HG3 . LYS B 2 117 ? -23.845 9.315 24.700 1.00 11.54 ? 109 LYS A HG3 1 +ATOM 3675 H HD2 . LYS B 2 117 ? -22.915 10.177 22.702 1.00 13.06 ? 109 LYS A HD2 1 +ATOM 3676 H HD3 . LYS B 2 117 ? -21.537 9.467 23.066 1.00 13.06 ? 109 LYS A HD3 1 +ATOM 3677 H HE2 . LYS B 2 117 ? -22.481 7.395 22.830 1.00 16.12 ? 109 LYS A HE2 1 +ATOM 3678 H HE3 . LYS B 2 117 ? -23.928 8.031 22.656 1.00 16.12 ? 109 LYS A HE3 1 +ATOM 3679 H HZ1 . LYS B 2 117 ? -23.243 8.861 20.655 1.00 18.10 ? 109 LYS A HZ1 1 +ATOM 3680 H HZ2 . LYS B 2 117 ? -21.925 8.282 20.814 1.00 18.10 ? 109 LYS A HZ2 1 +ATOM 3681 H HZ3 . LYS B 2 117 ? -23.078 7.422 20.643 1.00 18.10 ? 109 LYS A HZ3 1 +ATOM 3682 N N . ILE B 2 118 ? -20.483 13.215 24.946 1.00 5.09 ? 110 ILE A N 1 +ATOM 3683 C CA . ILE B 2 118 ? -20.294 14.645 25.108 1.00 6.08 ? 110 ILE A CA 1 +ATOM 3684 C C . ILE B 2 118 ? -21.480 15.419 24.557 1.00 5.31 ? 110 ILE A C 1 +ATOM 3685 O O . ILE B 2 118 ? -21.823 15.254 23.387 1.00 5.79 ? 110 ILE A O 1 +ATOM 3686 C CB . ILE B 2 118 ? -19.028 15.130 24.378 1.00 6.16 ? 110 ILE A CB 1 +ATOM 3687 C CG1 . ILE B 2 118 ? -17.805 14.296 24.747 1.00 6.70 ? 110 ILE A CG1 1 +ATOM 3688 C CG2 . ILE B 2 118 ? -18.809 16.621 24.697 1.00 8.39 ? 110 ILE A CG2 1 +ATOM 3689 C CD1 . ILE B 2 118 ? -16.618 14.607 23.873 1.00 9.22 ? 110 ILE A CD1 1 +ATOM 3690 H H . ILE B 2 118 ? -20.315 12.940 24.148 1.00 6.10 ? 110 ILE A H 1 +ATOM 3691 H HA . ILE B 2 118 ? -20.203 14.853 26.052 1.00 7.30 ? 110 ILE A HA 1 +ATOM 3692 H HB . ILE B 2 118 ? -19.177 15.044 23.424 1.00 7.40 ? 110 ILE A HB 1 +ATOM 3693 H HG12 . ILE B 2 118 ? -17.559 14.481 25.666 1.00 8.04 ? 110 ILE A HG12 1 +ATOM 3694 H HG13 . ILE B 2 118 ? -18.019 13.355 24.641 1.00 8.04 ? 110 ILE A HG13 1 +ATOM 3695 H HG21 . ILE B 2 118 ? -18.011 16.928 24.238 1.00 10.06 ? 110 ILE A HG21 1 +ATOM 3696 H HG22 . ILE B 2 118 ? -19.580 17.125 24.394 1.00 10.06 ? 110 ILE A HG22 1 +ATOM 3697 H HG23 . ILE B 2 118 ? -18.700 16.726 25.655 1.00 10.06 ? 110 ILE A HG23 1 +ATOM 3698 H HD11 . ILE B 2 118 ? -15.871 14.053 24.146 1.00 11.06 ? 110 ILE A HD11 1 +ATOM 3699 H HD12 . ILE B 2 118 ? -16.849 14.420 22.949 1.00 11.06 ? 110 ILE A HD12 1 +ATOM 3700 H HD13 . ILE B 2 118 ? -16.390 15.544 23.974 1.00 11.06 ? 110 ILE A HD13 1 +ATOM 3701 N N . ILE B 2 119 ? -22.058 16.291 25.381 1.00 6.06 ? 111 ILE A N 1 +ATOM 3702 C CA . ILE B 2 119 ? -23.187 17.143 24.990 1.00 5.53 ? 111 ILE A CA 1 +ATOM 3703 C C . ILE B 2 119 ? -22.754 18.582 25.144 1.00 6.02 ? 111 ILE A C 1 +ATOM 3704 O O . ILE B 2 119 ? -22.226 18.969 26.175 1.00 7.08 ? 111 ILE A O 1 +ATOM 3705 C CB . ILE B 2 119 ? -24.418 16.919 25.898 1.00 6.44 ? 111 ILE A CB 1 +ATOM 3706 C CG1 . ILE B 2 119 ? -24.773 15.431 25.997 1.00 8.00 ? 111 ILE A CG1 1 +ATOM 3707 C CG2 . ILE B 2 119 ? -25.605 17.707 25.388 1.00 7.11 ? 111 ILE A CG2 1 +ATOM 3708 C CD1 . ILE B 2 119 ? -24.221 14.731 27.207 1.00 10.09 ? 111 ILE A CD1 1 +ATOM 3709 H H . ILE B 2 119 ? -21.809 16.412 26.195 1.00 7.27 ? 111 ILE A H 1 +ATOM 3710 H HA . ILE B 2 119 ? -23.433 16.977 24.066 1.00 6.63 ? 111 ILE A HA 1 +ATOM 3711 H HB . ILE B 2 119 ? -24.201 17.239 26.788 1.00 7.73 ? 111 ILE A HB 1 +ATOM 3712 H HG12 . ILE B 2 119 ? -25.739 15.344 26.023 1.00 9.60 ? 111 ILE A HG12 1 +ATOM 3713 H HG13 . ILE B 2 119 ? -24.427 14.978 25.213 1.00 9.60 ? 111 ILE A HG13 1 +ATOM 3714 H HG21 . ILE B 2 119 ? -26.363 17.550 25.973 1.00 8.53 ? 111 ILE A HG21 1 +ATOM 3715 H HG22 . ILE B 2 119 ? -25.379 18.650 25.384 1.00 8.53 ? 111 ILE A HG22 1 +ATOM 3716 H HG23 . ILE B 2 119 ? -25.815 17.413 24.487 1.00 8.53 ? 111 ILE A HG23 1 +ATOM 3717 H HD11 . ILE B 2 119 ? -24.495 13.801 27.185 1.00 12.11 ? 111 ILE A HD11 1 +ATOM 3718 H HD12 . ILE B 2 119 ? -23.253 14.793 27.193 1.00 12.11 ? 111 ILE A HD12 1 +ATOM 3719 H HD13 . ILE B 2 119 ? -24.568 15.160 28.005 1.00 12.11 ? 111 ILE A HD13 1 +ATOM 3720 N N . GLU B 2 120 ? -22.997 19.410 24.139 1.00 6.84 ? 112 GLU A N 1 +ATOM 3721 C CA . GLU B 2 120 ? -22.701 20.831 24.294 1.00 7.54 ? 112 GLU A CA 1 +ATOM 3722 C C . GLU B 2 120 ? -23.876 21.537 24.947 1.00 6.67 ? 112 GLU A C 1 +ATOM 3723 O O . GLU B 2 120 ? -25.011 21.366 24.512 1.00 8.64 ? 112 GLU A O 1 +ATOM 3724 C CB . GLU B 2 120 ? -22.395 21.503 22.957 1.00 9.93 ? 112 GLU A CB 1 +ATOM 3725 C CG . GLU B 2 120 ? -21.925 22.951 23.176 1.00 12.49 ? 112 GLU A CG 1 +ATOM 3726 C CD . GLU B 2 120 ? -21.662 23.757 21.916 1.00 19.54 ? 112 GLU A CD 1 +ATOM 3727 O OE1 . GLU B 2 120 ? -21.628 23.192 20.801 1.00 17.89 ? 112 GLU A OE1 1 +ATOM 3728 O OE2 . GLU B 2 120 ? -21.501 24.988 22.072 1.00 18.48 -1 112 GLU A OE2 1 +ATOM 3729 H H . GLU B 2 120 ? -23.325 19.186 23.376 1.00 8.21 ? 112 GLU A H 1 +ATOM 3730 H HA . GLU B 2 120 ? -21.927 20.935 24.870 1.00 9.05 ? 112 GLU A HA 1 +ATOM 3731 H HB2 . GLU B 2 120 ? -21.688 21.017 22.505 1.00 11.91 ? 112 GLU A HB2 1 +ATOM 3732 H HB3 . GLU B 2 120 ? -23.197 21.520 22.413 1.00 11.91 ? 112 GLU A HB3 1 +ATOM 3733 H HG2 . GLU B 2 120 ? -22.606 23.420 23.683 1.00 14.99 ? 112 GLU A HG2 1 +ATOM 3734 H HG3 . GLU B 2 120 ? -21.100 22.931 23.685 1.00 14.99 ? 112 GLU A HG3 1 +ATOM 3735 N N . LEU B 2 121 ? -23.609 22.343 25.971 1.00 7.16 ? 113 LEU A N 1 +ATOM 3736 C CA . LEU B 2 121 ? -24.615 23.196 26.594 1.00 6.76 ? 113 LEU A CA 1 +ATOM 3737 C C . LEU B 2 121 ? -24.401 24.628 26.177 1.00 7.69 ? 113 LEU A C 1 +ATOM 3738 O O . LEU B 2 121 ? -23.313 25.173 26.341 1.00 7.76 ? 113 LEU A O 1 +ATOM 3739 C CB . LEU B 2 121 ? -24.547 23.095 28.117 1.00 7.40 ? 113 LEU A CB 1 +ATOM 3740 C CG . LEU B 2 121 ? -25.509 24.016 28.873 1.00 7.46 ? 113 LEU A CG 1 +ATOM 3741 C CD1 . LEU B 2 121 ? -26.954 23.636 28.632 1.00 9.17 ? 113 LEU A CD1 1 +ATOM 3742 C CD2 . LEU B 2 121 ? -25.207 24.009 30.366 1.00 9.15 ? 113 LEU A CD2 1 +ATOM 3743 H H . LEU B 2 121 ? -22.831 22.415 26.330 1.00 8.59 ? 113 LEU A H 1 +ATOM 3744 H HA . LEU B 2 121 ? -25.499 22.919 26.306 1.00 8.11 ? 113 LEU A HA 1 +ATOM 3745 H HB2 . LEU B 2 121 ? -24.752 22.183 28.375 1.00 8.88 ? 113 LEU A HB2 1 +ATOM 3746 H HB3 . LEU B 2 121 ? -23.647 23.318 28.400 1.00 8.88 ? 113 LEU A HB3 1 +ATOM 3747 H HG . LEU B 2 121 ? -25.387 24.923 28.552 1.00 8.96 ? 113 LEU A HG 1 +ATOM 3748 H HD11 . LEU B 2 121 ? -27.526 24.242 29.128 1.00 11.01 ? 113 LEU A HD11 1 +ATOM 3749 H HD12 . LEU B 2 121 ? -27.144 23.702 27.683 1.00 11.01 ? 113 LEU A HD12 1 +ATOM 3750 H HD13 . LEU B 2 121 ? -27.095 22.725 28.936 1.00 11.01 ? 113 LEU A HD13 1 +ATOM 3751 H HD21 . LEU B 2 121 ? -25.831 24.599 30.817 1.00 10.97 ? 113 LEU A HD21 1 +ATOM 3752 H HD22 . LEU B 2 121 ? -25.305 23.104 30.703 1.00 10.97 ? 113 LEU A HD22 1 +ATOM 3753 H HD23 . LEU B 2 121 ? -24.299 24.318 30.506 1.00 10.97 ? 113 LEU A HD23 1 +ATOM 3754 N N . ARG B 2 122 ? -25.471 25.219 25.638 1.00 8.12 ? 114 ARG A N 1 +ATOM 3755 C CA . ARG B 2 122 ? -25.506 26.646 25.322 1.00 10.01 ? 114 ARG A CA 1 +ATOM 3756 C C . ARG B 2 122 ? -26.396 27.361 26.340 1.00 9.64 ? 114 ARG A C 1 +ATOM 3757 O O . ARG B 2 122 ? -27.334 26.776 26.864 1.00 9.74 ? 114 ARG A O 1 +ATOM 3758 C CB . ARG B 2 122 ? -26.038 26.844 23.899 1.00 12.30 ? 114 ARG A CB 1 +ATOM 3759 C CG . ARG B 2 122 ? -25.180 26.092 22.866 1.00 13.73 ? 114 ARG A CG 1 +ATOM 3760 C CD . ARG B 2 122 ? -25.694 26.089 21.438 1.00 24.14 ? 114 ARG A CD 1 +ATOM 3761 N NE . ARG B 2 122 ? -24.769 25.306 20.614 1.00 31.80 ? 114 ARG A NE 1 +ATOM 3762 C CZ . ARG B 2 122 ? -24.925 25.045 19.319 1.00 41.49 ? 114 ARG A CZ 1 +ATOM 3763 N NH1 . ARG B 2 122 ? -25.982 25.500 18.659 1.00 39.60 1 114 ARG A NH1 1 +ATOM 3764 N NH2 . ARG B 2 122 ? -24.010 24.322 18.683 1.00 37.66 ? 114 ARG A NH2 1 +ATOM 3765 H H . ARG B 2 122 ? -26.199 24.806 25.444 1.00 9.74 ? 114 ARG A H 1 +ATOM 3766 H HA . ARG B 2 122 ? -24.612 27.017 25.375 1.00 12.02 ? 114 ARG A HA 1 +ATOM 3767 H HB2 . ARG B 2 122 ? -26.945 26.504 23.846 1.00 14.76 ? 114 ARG A HB2 1 +ATOM 3768 H HB3 . ARG B 2 122 ? -26.020 27.789 23.679 1.00 14.76 ? 114 ARG A HB3 1 +ATOM 3769 H HG2 . ARG B 2 122 ? -24.297 26.494 22.854 1.00 16.48 ? 114 ARG A HG2 1 +ATOM 3770 H HG3 . ARG B 2 122 ? -25.108 25.167 23.148 1.00 16.48 ? 114 ARG A HG3 1 +ATOM 3771 H HD2 . ARG B 2 122 ? -26.571 25.676 21.404 1.00 28.96 ? 114 ARG A HD2 1 +ATOM 3772 H HD3 . ARG B 2 122 ? -25.726 26.997 21.098 1.00 28.96 ? 114 ARG A HD3 1 +ATOM 3773 H HE . ARG B 2 122 ? -24.068 24.990 20.999 1.00 38.16 ? 114 ARG A HE 1 +ATOM 3774 H HH11 . ARG B 2 122 ? -26.576 25.969 19.068 1.00 47.52 ? 114 ARG A HH11 1 +ATOM 3775 H HH12 . ARG B 2 122 ? -26.074 25.326 17.822 1.00 47.52 ? 114 ARG A HH12 1 +ATOM 3776 H HH21 . ARG B 2 122 ? -23.324 24.025 19.108 1.00 45.19 ? 114 ARG A HH21 1 +ATOM 3777 H HH22 . ARG B 2 122 ? -24.105 24.149 17.846 1.00 45.19 ? 114 ARG A HH22 1 +ATOM 3778 N N . VAL B 2 123 ? -26.100 28.631 26.610 1.00 10.52 ? 115 VAL A N 1 +ATOM 3779 C CA . VAL B 2 123 ? -26.869 29.426 27.564 1.00 10.43 ? 115 VAL A CA 1 +ATOM 3780 C C . VAL B 2 123 ? -27.266 30.739 26.894 1.00 11.63 ? 115 VAL A C 1 +ATOM 3781 O O . VAL B 2 123 ? -26.395 31.515 26.494 1.00 16.45 ? 115 VAL A O 1 +ATOM 3782 C CB . VAL B 2 123 ? -26.076 29.690 28.843 1.00 10.87 ? 115 VAL A CB 1 +ATOM 3783 C CG1 . VAL B 2 123 ? -26.901 30.497 29.826 1.00 12.80 ? 115 VAL A CG1 1 +ATOM 3784 C CG2 . VAL B 2 123 ? -25.673 28.381 29.477 1.00 11.54 ? 115 VAL A CG2 1 +ATOM 3785 H H . VAL B 2 123 ? -25.450 29.061 26.247 1.00 12.62 ? 115 VAL A H 1 +ATOM 3786 H HA . VAL B 2 123 ? -27.679 28.948 27.801 1.00 12.52 ? 115 VAL A HA 1 +ATOM 3787 H HB . VAL B 2 123 ? -25.273 30.190 28.630 1.00 13.04 ? 115 VAL A HB 1 +ATOM 3788 H HG11 . VAL B 2 123 ? -26.376 30.650 30.627 1.00 15.36 ? 115 VAL A HG11 1 +ATOM 3789 H HG12 . VAL B 2 123 ? -27.138 31.344 29.418 1.00 15.36 ? 115 VAL A HG12 1 +ATOM 3790 H HG13 . VAL B 2 123 ? -27.704 29.999 30.046 1.00 15.36 ? 115 VAL A HG13 1 +ATOM 3791 H HG21 . VAL B 2 123 ? -25.171 28.563 30.286 1.00 13.85 ? 115 VAL A HG21 1 +ATOM 3792 H HG22 . VAL B 2 123 ? -26.472 27.874 29.689 1.00 13.85 ? 115 VAL A HG22 1 +ATOM 3793 H HG23 . VAL B 2 123 ? -25.122 27.884 28.851 1.00 13.85 ? 115 VAL A HG23 1 +ATOM 3794 N N . ARG B 2 124 ? -28.570 30.936 26.732 1.00 12.51 ? 116 ARG A N 1 +ATOM 3795 C CA . ARG B 2 124 ? -29.135 32.136 26.118 1.00 15.16 ? 116 ARG A CA 1 +ATOM 3796 C C . ARG B 2 124 ? -29.486 33.121 27.218 1.00 13.56 ? 116 ARG A C 1 +ATOM 3797 O O . ARG B 2 124 ? -29.899 32.722 28.307 1.00 12.17 ? 116 ARG A O 1 +ATOM 3798 C CB . ARG B 2 124 ? -30.401 31.787 25.321 1.00 18.03 ? 116 ARG A CB 1 +ATOM 3799 C CG . ARG B 2 124 ? -31.504 31.100 26.145 1.00 20.04 ? 116 ARG A CG 1 +ATOM 3800 C CD . ARG B 2 124 ? -32.858 30.999 25.436 1.00 26.89 ? 116 ARG A CD 1 +ATOM 3801 N NE . ARG B 2 124 ? -33.063 29.746 24.706 1.00 24.70 ? 116 ARG A NE 1 +ATOM 3802 C CZ . ARG B 2 124 ? -33.473 28.600 25.253 1.00 28.30 ? 116 ARG A CZ 1 +ATOM 3803 N NH1 . ARG B 2 124 ? -33.638 27.526 24.488 1.00 26.85 1 116 ARG A NH1 1 +ATOM 3804 N NH2 . ARG B 2 124 ? -33.705 28.508 26.555 1.00 23.94 ? 116 ARG A NH2 1 +ATOM 3805 H H . ARG B 2 124 ? -29.169 30.370 26.978 1.00 15.02 ? 116 ARG A H 1 +ATOM 3806 H HA . ARG B 2 124 ? -28.487 32.543 25.522 1.00 18.19 ? 116 ARG A HA 1 +ATOM 3807 H HB2 . ARG B 2 124 ? -30.773 32.606 24.957 1.00 21.63 ? 116 ARG A HB2 1 +ATOM 3808 H HB3 . ARG B 2 124 ? -30.158 31.189 24.598 1.00 21.63 ? 116 ARG A HB3 1 +ATOM 3809 H HG2 . ARG B 2 124 ? -31.216 30.199 26.358 1.00 24.04 ? 116 ARG A HG2 1 +ATOM 3810 H HG3 . ARG B 2 124 ? -31.638 31.602 26.964 1.00 24.04 ? 116 ARG A HG3 1 +ATOM 3811 H HD2 . ARG B 2 124 ? -33.563 31.074 26.098 1.00 32.27 ? 116 ARG A HD2 1 +ATOM 3812 H HD3 . ARG B 2 124 ? -32.930 31.727 24.798 1.00 32.27 ? 116 ARG A HD3 1 +ATOM 3813 H HE . ARG B 2 124 ? -32.908 29.750 23.860 1.00 29.65 ? 116 ARG A HE 1 +ATOM 3814 H HH11 . ARG B 2 124 ? -33.485 27.572 23.643 1.00 32.22 ? 116 ARG A HH11 1 +ATOM 3815 H HH12 . ARG B 2 124 ? -33.893 26.783 24.839 1.00 32.22 ? 116 ARG A HH12 1 +ATOM 3816 H HH21 . ARG B 2 124 ? -33.604 29.198 27.060 1.00 28.73 ? 116 ARG A HH21 1 +ATOM 3817 H HH22 . ARG B 2 124 ? -33.964 27.762 26.894 1.00 28.73 ? 116 ARG A HH22 1 +ATOM 3818 N N . LYS B 2 125 ? -29.351 34.416 26.949 1.00 16.96 ? 117 LYS A N 1 +ATOM 3819 C CA . LYS B 2 125 ? -29.633 35.400 27.987 1.00 16.16 ? 117 LYS A CA 1 +ATOM 3820 C C . LYS B 2 125 ? -31.112 35.628 28.245 1.00 19.73 ? 117 LYS A C 1 +ATOM 3821 O O . LYS B 2 125 ? -31.473 36.044 29.341 1.00 23.08 ? 117 LYS A O 1 +ATOM 3822 C CB . LYS B 2 125 ? -28.905 36.730 27.748 1.00 24.53 ? 117 LYS A CB 1 +ATOM 3823 C CG . LYS B 2 125 ? -27.595 36.781 28.520 1.00 27.01 ? 117 LYS A CG 1 +ATOM 3824 C CD . LYS B 2 125 ? -27.003 38.164 28.648 1.00 33.03 ? 117 LYS A CD 1 +ATOM 3825 C CE . LYS B 2 125 ? -25.745 38.088 29.497 1.00 33.72 ? 117 LYS A CE 1 +ATOM 3826 N NZ . LYS B 2 125 ? -24.809 39.216 29.256 1.00 45.84 1 117 LYS A NZ 1 +ATOM 3827 H H . LYS B 2 125 ? -29.104 34.745 26.194 1.00 20.35 ? 117 LYS A H 1 +ATOM 3828 H HA . LYS B 2 125 ? -29.273 35.044 28.815 1.00 19.39 ? 117 LYS A HA 1 +ATOM 3829 H HB2 . LYS B 2 125 ? -28.707 36.823 26.804 1.00 29.43 ? 117 LYS A HB2 1 +ATOM 3830 H HB3 . LYS B 2 125 ? -29.466 37.462 28.049 1.00 29.43 ? 117 LYS A HB3 1 +ATOM 3831 H HG2 . LYS B 2 125 ? -27.748 36.442 29.416 1.00 32.41 ? 117 LYS A HG2 1 +ATOM 3832 H HG3 . LYS B 2 125 ? -26.944 36.223 28.066 1.00 32.41 ? 117 LYS A HG3 1 +ATOM 3833 H HD2 . LYS B 2 125 ? -26.767 38.503 27.771 1.00 39.63 ? 117 LYS A HD2 1 +ATOM 3834 H HD3 . LYS B 2 125 ? -27.638 38.754 29.085 1.00 39.63 ? 117 LYS A HD3 1 +ATOM 3835 H HE2 . LYS B 2 125 ? -25.996 38.103 30.434 1.00 40.46 ? 117 LYS A HE2 1 +ATOM 3836 H HE3 . LYS B 2 125 ? -25.278 37.263 29.293 1.00 40.46 ? 117 LYS A HE3 1 +ATOM 3837 H HZ1 . LYS B 2 125 ? -25.209 39.989 29.444 1.00 55.00 ? 117 LYS A HZ1 1 +ATOM 3838 H HZ2 . LYS B 2 125 ? -24.089 39.130 29.773 1.00 55.00 ? 117 LYS A HZ2 1 +ATOM 3839 H HZ3 . LYS B 2 125 ? -24.553 39.223 28.403 1.00 55.00 ? 117 LYS A HZ3 1 +ATOM 3840 N N . TYR B 2 126 ? -31.974 35.360 27.272 1.00 23.23 ? 118 TYR A N 1 +ATOM 3841 C CA . TYR B 2 126 ? -33.408 35.472 27.528 1.00 28.03 ? 118 TYR A CA 1 +ATOM 3842 C C . TYR B 2 126 ? -34.214 34.466 26.724 1.00 27.62 ? 118 TYR A C 1 +ATOM 3843 O O . TYR B 2 126 ? -33.704 33.865 25.787 1.00 27.04 ? 118 TYR A O 1 +ATOM 3844 C CB . TYR B 2 126 ? -33.898 36.904 27.281 1.00 33.33 ? 118 TYR A CB 1 +ATOM 3845 C CG . TYR B 2 126 ? -33.611 37.456 25.903 1.00 34.86 ? 118 TYR A CG 1 +ATOM 3846 C CD1 . TYR B 2 126 ? -34.591 37.459 24.916 1.00 41.82 ? 118 TYR A CD1 1 +ATOM 3847 C CD2 . TYR B 2 126 ? -32.367 37.991 25.591 1.00 32.50 ? 118 TYR A CD2 1 +ATOM 3848 C CE1 . TYR B 2 126 ? -34.337 37.974 23.654 1.00 44.58 ? 118 TYR A CE1 1 +ATOM 3849 C CE2 . TYR B 2 126 ? -32.103 38.510 24.334 1.00 43.48 ? 118 TYR A CE2 1 +ATOM 3850 C CZ . TYR B 2 126 ? -33.092 38.497 23.368 1.00 46.89 ? 118 TYR A CZ 1 +ATOM 3851 O OH . TYR B 2 126 ? -32.842 39.007 22.113 1.00 42.95 ? 118 TYR A OH 1 +ATOM 3852 H H . TYR B 2 126 ? -31.765 35.116 26.474 1.00 27.87 ? 118 TYR A H 1 +ATOM 3853 H HA . TYR B 2 126 ? -33.561 35.276 28.465 1.00 33.63 ? 118 TYR A HA 1 +ATOM 3854 H HB2 . TYR B 2 126 ? -34.859 36.926 27.410 1.00 40.00 ? 118 TYR A HB2 1 +ATOM 3855 H HB3 . TYR B 2 126 ? -33.471 37.490 27.925 1.00 40.00 ? 118 TYR A HB3 1 +ATOM 3856 H HD1 . TYR B 2 126 ? -35.432 37.108 25.105 1.00 50.19 ? 118 TYR A HD1 1 +ATOM 3857 H HD2 . TYR B 2 126 ? -31.699 38.002 26.239 1.00 39.00 ? 118 TYR A HD2 1 +ATOM 3858 H HE1 . TYR B 2 126 ? -35.001 37.966 23.003 1.00 53.49 ? 118 TYR A HE1 1 +ATOM 3859 H HE2 . TYR B 2 126 ? -31.264 38.861 24.139 1.00 52.17 ? 118 TYR A HE2 1 +ATOM 3860 H HH . TYR B 2 126 ? -32.052 39.291 22.071 1.00 51.54 ? 118 TYR A HH 1 +ATOM 3861 N N . ASN B 2 127 ? -35.468 34.270 27.123 1.00 28.44 ? 119 ASN A N 1 +ATOM 3862 C CA . ASN B 2 127 ? -36.360 33.342 26.435 1.00 32.59 ? 119 ASN A CA 1 +ATOM 3863 C C . ASN B 2 127 ? -36.977 33.980 25.196 1.00 29.75 ? 119 ASN A C 1 +ATOM 3864 O O . ASN B 2 127 ? -37.139 33.326 24.165 1.00 33.29 ? 119 ASN A O 1 +ATOM 3865 C CB . ASN B 2 127 ? -37.471 32.876 27.377 1.00 32.48 ? 119 ASN A CB 1 +ATOM 3866 C CG . ASN B 2 127 ? -36.935 32.285 28.667 1.00 23.09 ? 119 ASN A CG 1 +ATOM 3867 O OD1 . ASN B 2 127 ? -36.478 31.139 28.702 1.00 30.25 ? 119 ASN A OD1 1 +ATOM 3868 N ND2 . ASN B 2 127 ? -36.991 33.065 29.738 1.00 27.63 ? 119 ASN A ND2 1 +ATOM 3869 H H . ASN B 2 127 ? -35.829 34.666 27.795 1.00 34.12 ? 119 ASN A H 1 +ATOM 3870 H HA . ASN B 2 127 ? -35.854 32.563 26.154 1.00 39.10 ? 119 ASN A HA 1 +ATOM 3871 H HB2 . ASN B 2 127 ? -38.032 33.635 27.604 1.00 38.97 ? 119 ASN A HB2 1 +ATOM 3872 H HB3 . ASN B 2 127 ? -37.999 32.195 26.931 1.00 38.97 ? 119 ASN A HB3 1 +ATOM 3873 H HD21 . ASN B 2 127 ? -37.318 33.859 29.676 1.00 33.15 ? 119 ASN A HD21 1 +ATOM 3874 H HD22 . ASN B 2 127 ? -36.700 32.778 30.495 1.00 33.15 ? 119 ASN A HD22 1 +HETATM 3875 O O . HOH C 3 . ? -14.321 15.770 28.445 1.00 25.97 ? 201 HOH B O 1 +HETATM 3876 O O . HOH C 3 . ? -26.995 18.802 10.531 1.00 38.18 ? 202 HOH B O 1 +HETATM 3877 O O . HOH C 3 . ? -19.018 21.322 3.845 1.00 21.08 ? 203 HOH B O 1 +HETATM 3878 O O . HOH C 3 . ? -12.144 9.019 -1.388 1.00 30.99 ? 204 HOH B O 1 +HETATM 3879 O O . HOH C 3 . ? 8.968 8.414 4.665 1.00 25.98 ? 205 HOH B O 1 +HETATM 3880 O O . HOH C 3 . ? -22.510 2.145 22.830 1.00 18.43 ? 206 HOH B O 1 +HETATM 3881 O O . HOH C 3 . ? -25.115 8.330 17.529 1.00 20.96 ? 207 HOH B O 1 +HETATM 3882 O O . HOH C 3 . ? -3.463 15.542 3.213 1.00 25.51 ? 208 HOH B O 1 +HETATM 3883 O O . HOH C 3 . ? -24.838 -2.585 16.156 1.00 29.27 ? 209 HOH B O 1 +HETATM 3884 O O . HOH C 3 . ? -7.575 -7.592 10.420 1.00 32.90 ? 210 HOH B O 1 +HETATM 3885 O O . HOH C 3 . ? -13.893 -2.605 16.687 1.00 25.10 ? 211 HOH B O 1 +HETATM 3886 O O . HOH C 3 . ? -20.637 6.910 -2.232 1.00 28.30 ? 212 HOH B O 1 +HETATM 3887 O O . HOH C 3 . ? 10.475 0.258 1.176 1.00 30.27 ? 213 HOH B O 1 +HETATM 3888 O O . HOH C 3 . ? -11.365 7.720 33.677 1.00 25.87 ? 214 HOH B O 1 +HETATM 3889 O O . HOH C 3 . ? -6.971 10.480 -1.040 1.00 31.43 ? 215 HOH B O 1 +HETATM 3890 O O . HOH C 3 . ? -14.693 -0.411 1.723 1.00 31.83 ? 216 HOH B O 1 +HETATM 3891 O O . HOH C 3 . ? -24.053 13.274 17.194 1.00 13.76 ? 217 HOH B O 1 +HETATM 3892 O O . HOH C 3 . ? -23.643 15.541 15.867 1.00 16.87 ? 218 HOH B O 1 +HETATM 3893 O O . HOH C 3 . ? -4.430 1.656 -5.169 1.00 20.23 ? 219 HOH B O 1 +HETATM 3894 O O . HOH C 3 . ? -17.400 1.322 4.798 1.00 32.81 ? 220 HOH B O 1 +HETATM 3895 O O . HOH C 3 . ? -22.779 18.333 17.404 1.00 27.04 ? 221 HOH B O 1 +HETATM 3896 O O . HOH C 3 . ? -16.155 11.920 2.148 1.00 13.69 ? 222 HOH B O 1 +HETATM 3897 O O . HOH C 3 . ? -21.435 13.160 7.003 1.00 23.52 ? 223 HOH B O 1 +HETATM 3898 O O . HOH C 3 . ? -21.754 7.734 0.435 1.00 29.82 ? 224 HOH B O 1 +HETATM 3899 O O . HOH C 3 . ? -17.489 4.967 0.184 1.00 29.37 ? 225 HOH B O 1 +HETATM 3900 O O . HOH C 3 . ? -14.470 25.458 10.137 1.00 34.32 ? 226 HOH B O 1 +HETATM 3901 O O . HOH C 3 . ? -6.955 -2.924 12.345 1.00 21.03 ? 227 HOH B O 1 +HETATM 3902 O O . HOH C 3 . ? 6.991 -5.569 8.010 1.00 39.81 ? 228 HOH B O 1 +HETATM 3903 O O . HOH C 3 . ? -0.300 8.398 20.065 1.00 7.71 ? 229 HOH B O 1 +HETATM 3904 O O . HOH C 3 . ? -3.359 23.895 16.451 1.00 32.71 ? 230 HOH B O 1 +HETATM 3905 O O . HOH C 3 . ? -11.461 13.577 33.358 1.00 12.32 ? 231 HOH B O 1 +HETATM 3906 O O . HOH C 3 . ? -11.679 -7.079 9.489 1.00 22.90 ? 232 HOH B O 1 +HETATM 3907 O O . HOH C 3 . ? 1.111 -5.085 15.462 1.00 22.87 ? 233 HOH B O 1 +HETATM 3908 O O . HOH C 3 . ? -26.746 14.002 12.744 1.00 18.32 ? 234 HOH B O 1 +HETATM 3909 O O . HOH C 3 . ? -21.844 19.538 15.562 1.00 23.10 ? 235 HOH B O 1 +HETATM 3910 O O . HOH C 3 . ? -6.729 -0.760 21.645 1.00 37.44 ? 236 HOH B O 1 +HETATM 3911 O O . HOH C 3 . ? -0.139 11.739 13.139 1.00 9.55 ? 237 HOH B O 1 +HETATM 3912 O O . HOH C 3 . ? -0.172 10.964 1.651 1.00 11.97 ? 238 HOH B O 1 +HETATM 3913 O O . HOH C 3 . ? -18.929 6.098 4.045 1.00 16.37 ? 239 HOH B O 1 +HETATM 3914 O O . HOH C 3 . ? -21.367 20.714 19.567 1.00 15.94 ? 240 HOH B O 1 +HETATM 3915 O O . HOH C 3 . ? -9.254 16.099 3.199 1.00 13.34 ? 241 HOH B O 1 +HETATM 3916 O O . HOH C 3 . ? 7.390 1.746 12.694 1.00 15.07 ? 242 HOH B O 1 +HETATM 3917 O O . HOH C 3 . ? -2.143 10.481 25.737 1.00 8.44 ? 243 HOH B O 1 +HETATM 3918 O O . HOH C 3 . ? -6.288 20.642 23.012 1.00 24.41 ? 244 HOH B O 1 +HETATM 3919 O O . HOH C 3 . ? -10.457 -1.569 -2.186 1.00 25.36 ? 245 HOH B O 1 +HETATM 3920 O O . HOH C 3 . ? -3.458 11.347 -2.641 1.00 18.08 ? 246 HOH B O 1 +HETATM 3921 O O . HOH C 3 . ? -1.922 10.549 22.858 1.00 8.07 ? 247 HOH B O 1 +HETATM 3922 O O . HOH C 3 . ? -8.471 10.117 28.001 1.00 9.59 ? 248 HOH B O 1 +HETATM 3923 O O . HOH C 3 . ? -6.587 13.561 27.272 1.00 6.48 ? 249 HOH B O 1 +HETATM 3924 O O . HOH C 3 . ? -22.309 -2.221 13.720 1.00 25.40 ? 250 HOH B O 1 +HETATM 3925 O O . HOH C 3 . ? -1.520 13.889 4.146 1.00 22.52 ? 251 HOH B O 1 +HETATM 3926 O O . HOH C 3 . ? -1.612 20.823 11.251 1.00 24.86 ? 252 HOH B O 1 +HETATM 3927 O O . HOH C 3 . ? 4.640 7.876 0.565 1.00 22.40 ? 253 HOH B O 1 +HETATM 3928 O O . HOH C 3 . ? 3.691 6.648 13.394 1.00 11.78 ? 254 HOH B O 1 +HETATM 3929 O O . HOH C 3 . ? -26.519 11.270 18.822 1.00 18.73 ? 255 HOH B O 1 +HETATM 3930 O O . HOH C 3 . ? -17.071 22.306 19.426 1.00 14.25 ? 256 HOH B O 1 +HETATM 3931 O O . HOH C 3 . ? -10.911 2.064 -3.489 1.00 23.41 ? 257 HOH B O 1 +HETATM 3932 O O . HOH C 3 . ? 3.968 -8.566 5.873 1.00 32.43 ? 258 HOH B O 1 +HETATM 3933 O O . HOH C 3 . ? -7.164 17.164 4.636 1.00 18.02 ? 259 HOH B O 1 +HETATM 3934 O O . HOH C 3 . ? -11.782 5.018 23.736 1.00 9.89 ? 260 HOH B O 1 +HETATM 3935 O O . HOH C 3 . ? -5.723 -3.685 5.780 1.00 14.71 ? 261 HOH B O 1 +HETATM 3936 O O . HOH C 3 . ? -6.989 19.467 6.039 1.00 21.42 ? 262 HOH B O 1 +HETATM 3937 O O . HOH C 3 . ? -1.869 -4.687 9.180 1.00 17.33 ? 263 HOH B O 1 +HETATM 3938 O O . HOH C 3 . ? -1.056 12.493 18.812 1.00 11.16 ? 264 HOH B O 1 +HETATM 3939 O O . HOH C 3 . ? -14.327 23.521 14.447 1.00 12.71 ? 265 HOH B O 1 +HETATM 3940 O O . HOH C 3 . ? 4.984 12.806 7.368 1.00 28.34 ? 266 HOH B O 1 +HETATM 3941 O O . HOH C 3 . ? -19.706 0.130 21.570 1.00 16.18 ? 267 HOH B O 1 +HETATM 3942 O O . HOH C 3 . ? -20.936 20.778 9.087 1.00 25.29 ? 268 HOH B O 1 +HETATM 3943 O O . HOH C 3 . ? -5.423 -2.182 -4.053 1.00 24.84 ? 269 HOH B O 1 +HETATM 3944 O O . HOH C 3 . ? -13.776 8.150 -1.955 1.00 29.31 ? 270 HOH B O 1 +HETATM 3945 O O . HOH C 3 . ? 0.754 15.672 13.166 1.00 19.56 ? 271 HOH B O 1 +HETATM 3946 O O . HOH C 3 . ? -18.337 6.009 24.675 1.00 8.98 ? 272 HOH B O 1 +HETATM 3947 O O . HOH C 3 . ? -14.145 4.665 -1.068 1.00 20.98 ? 273 HOH B O 1 +HETATM 3948 O O . HOH C 3 . ? -18.318 -2.308 6.048 1.00 28.25 ? 274 HOH B O 1 +HETATM 3949 O O . HOH C 3 . ? -21.431 4.347 12.891 1.00 13.41 ? 275 HOH B O 1 +HETATM 3950 O O . HOH C 3 . ? -23.497 6.509 16.493 1.00 27.39 ? 276 HOH B O 1 +HETATM 3951 O O . HOH C 3 . ? -17.673 20.768 13.121 1.00 15.04 ? 277 HOH B O 1 +HETATM 3952 O O . HOH C 3 . ? -3.436 20.092 6.953 1.00 27.68 ? 278 HOH B O 1 +HETATM 3953 O O . HOH C 3 . ? -1.944 12.899 21.465 1.00 8.55 ? 279 HOH B O 1 +HETATM 3954 O O . HOH C 3 . ? -15.220 -1.427 12.525 1.00 19.99 ? 280 HOH B O 1 +HETATM 3955 O O . HOH C 3 . ? 5.754 5.141 14.263 1.00 13.12 ? 281 HOH B O 1 +HETATM 3956 O O . HOH C 3 . ? -9.557 9.388 33.351 1.00 15.49 ? 282 HOH B O 1 +HETATM 3957 O O . HOH C 3 . ? -20.270 16.792 21.527 1.00 10.33 ? 283 HOH B O 1 +HETATM 3958 O O . HOH C 3 . ? 9.259 -2.855 -0.725 1.00 30.70 ? 284 HOH B O 1 +HETATM 3959 O O . HOH C 3 . ? 2.081 -2.767 14.392 1.00 15.92 ? 285 HOH B O 1 +HETATM 3960 O O . HOH C 3 . ? -15.018 17.996 5.235 1.00 13.14 ? 286 HOH B O 1 +HETATM 3961 O O . HOH C 3 . ? -13.284 12.505 22.437 1.00 6.05 ? 287 HOH B O 1 +HETATM 3962 O O . HOH C 3 . ? -13.731 24.222 21.785 1.00 27.71 ? 288 HOH B O 1 +HETATM 3963 O O . HOH C 3 . ? -21.153 5.980 24.053 1.00 15.74 ? 289 HOH B O 1 +HETATM 3964 O O . HOH C 3 . ? 7.248 3.724 -1.037 1.00 39.03 ? 290 HOH B O 1 +HETATM 3965 O O . HOH C 3 . ? -21.736 15.370 3.209 1.00 35.84 ? 291 HOH B O 1 +HETATM 3966 O O . HOH C 3 . ? -21.520 9.616 18.715 1.00 12.03 ? 292 HOH B O 1 +HETATM 3967 O O . HOH C 3 . ? -18.966 12.712 5.387 1.00 14.15 ? 293 HOH B O 1 +HETATM 3968 O O . HOH C 3 . ? -12.895 0.974 22.627 1.00 11.54 ? 294 HOH B O 1 +HETATM 3969 O O . HOH C 3 . ? -0.630 -5.500 -1.814 1.00 33.18 ? 295 HOH B O 1 +HETATM 3970 O O . HOH C 3 . ? -19.432 4.033 5.687 1.00 14.80 ? 296 HOH B O 1 +HETATM 3971 O O . HOH C 3 . ? -17.877 -4.237 7.847 1.00 23.65 ? 297 HOH B O 1 +HETATM 3972 O O . HOH C 3 . ? -4.411 18.425 19.071 1.00 16.14 ? 298 HOH B O 1 +HETATM 3973 O O . HOH C 3 . ? 0.870 3.484 17.882 1.00 13.18 ? 299 HOH B O 1 +HETATM 3974 O O . HOH C 3 . ? -7.260 -5.228 7.291 1.00 26.41 ? 300 HOH B O 1 +HETATM 3975 O O . HOH C 3 . ? -4.828 -6.012 2.587 1.00 22.77 ? 301 HOH B O 1 +HETATM 3976 O O . HOH C 3 . ? -13.639 -9.945 8.069 1.00 33.38 ? 302 HOH B O 1 +HETATM 3977 O O . HOH C 3 . ? 0.038 16.884 6.674 1.00 26.72 ? 303 HOH B O 1 +HETATM 3978 O O . HOH C 3 . ? -2.441 17.392 20.499 1.00 26.94 ? 304 HOH B O 1 +HETATM 3979 O O . HOH C 3 . ? -9.387 9.253 -1.984 1.00 30.23 ? 305 HOH B O 1 +HETATM 3980 O O . HOH C 3 . ? -24.655 4.237 18.625 1.00 17.26 ? 306 HOH B O 1 +HETATM 3981 O O . HOH C 3 . ? -10.466 -5.014 6.701 1.00 17.69 ? 307 HOH B O 1 +HETATM 3982 O O . HOH C 3 . ? -0.444 -5.853 11.268 1.00 23.33 ? 308 HOH B O 1 +HETATM 3983 O O . HOH C 3 . ? -13.819 -5.177 13.030 1.00 25.97 ? 309 HOH B O 1 +HETATM 3984 O O . HOH C 3 . ? -5.417 20.830 18.306 1.00 19.05 ? 310 HOH B O 1 +HETATM 3985 O O . HOH C 3 . ? -22.462 7.010 18.166 1.00 16.45 ? 311 HOH B O 1 +HETATM 3986 O O . HOH C 3 . ? -10.301 2.255 21.868 1.00 15.76 ? 312 HOH B O 1 +HETATM 3987 O O . HOH C 3 . ? -20.927 3.932 7.941 1.00 14.69 ? 313 HOH B O 1 +HETATM 3988 O O . HOH C 3 . ? -17.404 23.960 6.974 1.00 21.96 ? 314 HOH B O 1 +HETATM 3989 O O . HOH C 3 . ? -1.324 18.926 15.935 1.00 28.20 ? 315 HOH B O 1 +HETATM 3990 O O . HOH C 3 . ? -12.102 10.956 0.489 1.00 18.24 ? 316 HOH B O 1 +HETATM 3991 O O . HOH C 3 . ? -7.575 27.490 10.181 1.00 41.63 ? 317 HOH B O 1 +HETATM 3992 O O . HOH C 3 . ? 11.276 -0.198 6.048 1.00 24.44 ? 318 HOH B O 1 +HETATM 3993 O O . HOH C 3 . ? 2.545 5.515 17.892 1.00 15.86 ? 319 HOH B O 1 +HETATM 3994 O O . HOH C 3 . ? -11.100 25.180 13.353 1.00 29.03 ? 320 HOH B O 1 +HETATM 3995 O O . HOH C 3 . ? -3.598 8.186 25.101 1.00 7.60 ? 321 HOH B O 1 +HETATM 3996 O O . HOH C 3 . ? -9.841 5.731 28.043 1.00 13.29 ? 322 HOH B O 1 +HETATM 3997 O O . HOH C 3 . ? -6.820 -4.540 18.508 1.00 20.63 ? 323 HOH B O 1 +HETATM 3998 O O . HOH C 3 . ? -3.515 17.973 23.111 1.00 26.50 ? 324 HOH B O 1 +HETATM 3999 O O . HOH C 3 . ? -9.624 6.332 -3.002 1.00 15.62 ? 325 HOH B O 1 +HETATM 4000 O O . HOH C 3 . ? -5.479 13.194 -1.708 1.00 22.06 ? 326 HOH B O 1 +HETATM 4001 O O . HOH C 3 . ? -19.636 -0.983 16.909 1.00 12.83 ? 327 HOH B O 1 +HETATM 4002 O O . HOH C 3 . ? -23.463 -0.536 19.623 1.00 23.80 ? 328 HOH B O 1 +HETATM 4003 O O . HOH C 3 . ? -2.567 25.287 13.164 1.00 36.72 ? 329 HOH B O 1 +HETATM 4004 O O . HOH C 3 . ? -12.165 -3.560 14.728 1.00 13.72 ? 330 HOH B O 1 +HETATM 4005 O O . HOH C 3 . ? -25.407 9.429 13.619 1.00 12.33 ? 331 HOH B O 1 +HETATM 4006 O O . HOH C 3 . ? -15.384 25.324 18.251 1.00 27.22 ? 332 HOH B O 1 +HETATM 4007 O O . HOH C 3 . ? -20.687 23.035 13.250 1.00 20.38 ? 333 HOH B O 1 +HETATM 4008 O O . HOH C 3 . ? -21.741 10.342 7.512 1.00 20.89 ? 334 HOH B O 1 +HETATM 4009 O O . HOH C 3 . ? -9.745 22.765 20.676 1.00 27.91 ? 335 HOH B O 1 +HETATM 4010 O O . HOH C 3 . ? -1.790 -4.468 23.231 1.00 36.64 ? 336 HOH B O 1 +HETATM 4011 O O . HOH C 3 . ? -8.213 -2.514 -0.522 1.00 17.62 ? 337 HOH B O 1 +HETATM 4012 O O . HOH C 3 . ? -2.833 15.645 18.305 1.00 15.15 ? 338 HOH B O 1 +HETATM 4013 O O . HOH C 3 . ? -24.386 12.220 4.599 1.00 35.40 ? 339 HOH B O 1 +HETATM 4014 O O . HOH C 3 . ? -5.751 -5.532 15.907 1.00 18.29 ? 340 HOH B O 1 +HETATM 4015 O O . HOH C 3 . ? 2.394 10.731 2.467 1.00 13.81 ? 341 HOH B O 1 +HETATM 4016 O O . HOH C 3 . ? -16.400 -1.860 15.270 1.00 23.89 ? 342 HOH B O 1 +HETATM 4017 O O . HOH C 3 . ? -17.491 -4.224 10.745 1.00 32.22 ? 343 HOH B O 1 +HETATM 4018 O O . HOH C 3 . ? 4.310 6.917 -1.971 1.00 17.03 ? 344 HOH B O 1 +HETATM 4019 O O . HOH C 3 . ? 7.518 5.619 1.428 1.00 20.34 ? 345 HOH B O 1 +HETATM 4020 O O . HOH C 3 . ? -19.460 -1.679 8.481 1.00 26.02 ? 346 HOH B O 1 +HETATM 4021 O O . HOH C 3 . ? 4.727 9.818 5.187 1.00 22.23 ? 347 HOH B O 1 +HETATM 4022 O O . HOH C 3 . ? 1.354 -5.757 12.354 1.00 36.31 ? 348 HOH B O 1 +HETATM 4023 O O . HOH C 3 . ? -4.057 -6.625 8.346 1.00 30.80 ? 349 HOH B O 1 +HETATM 4024 O O . HOH C 3 . ? -10.062 14.596 -0.941 1.00 20.21 ? 350 HOH B O 1 +HETATM 4025 O O . HOH C 3 . ? -13.291 1.869 26.297 1.00 16.30 ? 351 HOH B O 1 +HETATM 4026 O O . HOH C 3 . ? -13.317 -2.063 1.055 1.00 31.54 ? 352 HOH B O 1 +HETATM 4027 O O . HOH C 3 . ? -5.534 -7.225 6.542 1.00 40.89 ? 353 HOH B O 1 +HETATM 4028 O O . HOH C 3 . ? -5.813 6.789 25.977 1.00 10.37 ? 354 HOH B O 1 +HETATM 4029 O O . HOH C 3 . ? -5.297 -6.329 10.781 1.00 28.89 ? 355 HOH B O 1 +HETATM 4030 O O . HOH C 3 . ? 0.265 18.345 8.925 1.00 31.02 ? 356 HOH B O 1 +HETATM 4031 O O . HOH C 3 . ? -7.394 -6.566 20.156 1.00 40.44 ? 357 HOH B O 1 +HETATM 4032 O O . HOH C 3 . ? -18.608 2.659 2.309 1.00 27.75 ? 358 HOH B O 1 +HETATM 4033 O O . HOH C 3 . ? -10.878 4.670 34.579 1.00 29.85 ? 359 HOH B O 1 +HETATM 4034 O O . HOH C 3 . ? -9.299 5.716 30.958 1.00 19.08 ? 360 HOH B O 1 +HETATM 4035 O O . HOH C 3 . ? -25.951 9.548 19.643 1.00 25.17 ? 361 HOH B O 1 +HETATM 4036 O O . HOH C 3 . ? -23.087 19.825 13.257 1.00 37.53 ? 362 HOH B O 1 +HETATM 4037 O O . HOH C 3 . ? -26.472 13.245 3.211 1.00 24.91 ? 363 HOH B O 1 +HETATM 4038 O O . HOH C 3 . ? -7.925 0.811 21.585 1.00 27.97 ? 364 HOH B O 1 +HETATM 4039 O O . HOH C 3 . ? -5.750 27.505 10.514 1.00 42.32 ? 365 HOH B O 1 +HETATM 4040 O O . HOH C 3 . ? 9.665 -3.792 4.540 1.00 29.21 ? 366 HOH B O 1 +HETATM 4041 O O . HOH C 3 . ? -7.614 7.398 28.071 1.00 12.99 ? 367 HOH B O 1 +HETATM 4042 O O . HOH C 3 . ? -6.849 25.423 18.331 1.00 33.57 ? 368 HOH B O 1 +HETATM 4043 O O . HOH C 3 . ? -6.487 22.047 20.675 1.00 29.42 ? 369 HOH B O 1 +HETATM 4044 O O . HOH C 3 . ? -8.099 11.292 30.498 1.00 10.16 ? 370 HOH B O 1 +HETATM 4045 O O . HOH C 3 . ? 7.946 -0.863 -7.789 1.00 42.78 ? 371 HOH B O 1 +HETATM 4046 O O . HOH C 3 . ? -5.490 -7.884 4.361 1.00 31.58 ? 372 HOH B O 1 +HETATM 4047 O O . HOH C 3 . ? -19.370 4.839 1.716 1.00 27.86 ? 373 HOH B O 1 +HETATM 4048 O O . HOH C 3 . ? -14.185 26.196 14.192 1.00 26.44 ? 374 HOH B O 1 +HETATM 4049 O O . HOH C 3 . ? -11.734 4.460 -2.299 1.00 29.71 ? 375 HOH B O 1 +HETATM 4050 O O . HOH C 3 . ? -14.309 -4.080 0.436 1.00 45.57 ? 376 HOH B O 1 +HETATM 4051 O O . HOH C 3 . ? -9.270 10.703 35.462 1.00 24.48 ? 377 HOH B O 1 +HETATM 4052 O O . HOH C 3 . ? -2.542 17.802 5.121 1.00 31.40 ? 378 HOH B O 1 +HETATM 4053 O O . HOH C 3 . ? -4.481 -7.888 15.870 1.00 32.45 ? 379 HOH B O 1 +HETATM 4054 O O . HOH C 3 . ? -28.508 15.162 3.671 1.00 27.15 ? 380 HOH B O 1 +HETATM 4055 O O . HOH C 3 . ? -16.190 26.338 7.453 1.00 34.33 ? 381 HOH B O 1 +HETATM 4056 O O . HOH C 3 . ? -7.857 -5.298 14.320 1.00 22.45 ? 382 HOH B O 1 +HETATM 4057 O O . HOH C 3 . ? 4.825 -4.256 14.067 1.00 27.16 ? 383 HOH B O 1 +HETATM 4058 O O . HOH C 3 . ? -2.854 21.987 17.880 1.00 33.97 ? 384 HOH B O 1 +HETATM 4059 O O . HOH C 3 . ? -6.919 -3.817 -2.663 1.00 23.80 ? 385 HOH B O 1 +HETATM 4060 O O . HOH C 3 . ? -8.835 -7.707 13.614 1.00 44.92 ? 386 HOH B O 1 +HETATM 4061 O O . HOH C 3 . ? -19.164 -5.962 6.719 1.00 29.29 ? 387 HOH B O 1 +HETATM 4062 O O . HOH C 3 . ? -15.806 6.605 -2.991 1.00 37.56 ? 388 HOH B O 1 +HETATM 4063 O O . HOH C 3 . ? -9.376 3.365 32.648 1.00 24.71 ? 389 HOH B O 1 +HETATM 4064 O O . HOH C 3 . ? -20.265 -3.364 15.193 1.00 32.83 ? 390 HOH B O 1 +HETATM 4065 O O . HOH C 3 . ? -10.725 2.849 24.912 1.00 23.85 ? 391 HOH B O 1 +HETATM 4066 O O . HOH C 3 . ? -22.054 21.567 11.270 1.00 27.42 ? 392 HOH B O 1 +HETATM 4067 O O . HOH C 3 . ? -10.183 -2.606 -4.529 1.00 34.18 ? 393 HOH B O 1 +HETATM 4068 O O . HOH C 3 . ? 2.000 6.977 20.296 1.00 16.33 ? 394 HOH B O 1 +HETATM 4069 O O . HOH C 3 . ? -26.971 11.609 13.785 1.00 13.79 ? 395 HOH B O 1 +HETATM 4070 O O . HOH C 3 . ? -8.668 27.111 17.385 1.00 38.66 ? 396 HOH B O 1 +HETATM 4071 O O . HOH C 3 . ? -9.428 3.196 27.139 1.00 31.65 ? 397 HOH B O 1 +HETATM 4072 O O . HOH C 3 . ? -14.741 11.973 -0.199 1.00 16.33 ? 398 HOH B O 1 +HETATM 4073 O O . HOH C 3 . ? -13.457 4.293 35.959 1.00 22.05 ? 399 HOH B O 1 +HETATM 4074 O O . HOH C 3 . ? -0.451 18.718 13.343 1.00 32.03 ? 400 HOH B O 1 +HETATM 4075 O O . HOH C 3 . ? -4.854 -7.012 0.169 1.00 31.05 ? 401 HOH B O 1 +HETATM 4076 O O . HOH C 3 . ? -4.437 25.679 18.034 1.00 39.71 ? 402 HOH B O 1 +HETATM 4077 O O . HOH C 3 . ? -12.993 -1.460 -1.705 1.00 29.10 ? 403 HOH B O 1 +HETATM 4078 O O . HOH C 3 . ? -13.548 0.853 -2.919 1.00 41.75 ? 404 HOH B O 1 +HETATM 4079 O O . HOH C 3 . ? -9.052 -2.912 17.893 1.00 25.52 ? 405 HOH B O 1 +HETATM 4080 O O . HOH C 3 . ? -3.700 -9.678 3.677 1.00 36.68 ? 406 HOH B O 1 +HETATM 4081 O O . HOH C 3 . ? -10.647 1.526 31.275 1.00 26.62 ? 407 HOH B O 1 +HETATM 4082 O O . HOH C 3 . ? 2.219 -7.412 13.955 1.00 40.11 ? 408 HOH B O 1 +HETATM 4083 O O . HOH C 3 . ? -5.232 -6.012 -2.482 1.00 32.31 ? 409 HOH B O 1 +HETATM 4084 O O . HOH C 3 . ? -8.862 -4.425 -4.608 1.00 30.15 ? 410 HOH B O 1 +HETATM 4085 O O . HOH D 3 . ? -31.160 -8.495 26.623 1.00 37.93 ? 201 HOH A O 1 +HETATM 4086 O O . HOH D 3 . ? -23.755 40.930 29.776 1.00 30.94 ? 202 HOH A O 1 +HETATM 4087 O O . HOH D 3 . ? -13.429 -5.534 32.534 1.00 20.98 ? 203 HOH A O 1 +HETATM 4088 O O . HOH D 3 . ? -13.412 23.323 35.856 1.00 24.40 ? 204 HOH A O 1 +HETATM 4089 O O . HOH D 3 . ? -35.050 -1.979 28.783 1.00 23.57 ? 205 HOH A O 1 +HETATM 4090 O O . HOH D 3 . ? -24.415 17.054 50.809 1.00 32.03 ? 206 HOH A O 1 +HETATM 4091 O O . HOH D 3 . ? -34.001 -1.199 24.063 1.00 27.96 ? 207 HOH A O 1 +HETATM 4092 O O . HOH D 3 . ? -14.400 -0.409 35.016 1.00 18.22 ? 208 HOH A O 1 +HETATM 4093 O O . HOH D 3 . ? -19.188 33.415 30.638 1.00 28.28 ? 209 HOH A O 1 +HETATM 4094 O O . HOH D 3 . ? -37.700 3.294 40.500 1.00 23.12 ? 210 HOH A O 1 +HETATM 4095 O O . HOH D 3 . ? -21.029 15.641 47.957 1.00 18.94 ? 211 HOH A O 1 +HETATM 4096 O O . HOH D 3 . ? -31.866 35.315 31.625 1.00 25.50 ? 212 HOH A O 1 +HETATM 4097 O O . HOH D 3 . ? -24.588 -8.157 36.166 1.00 23.29 ? 213 HOH A O 1 +HETATM 4098 O O . HOH D 3 . ? -27.891 20.535 18.342 1.00 31.19 ? 214 HOH A O 1 +HETATM 4099 O O . HOH D 3 . ? -25.954 19.495 17.036 1.00 35.38 ? 215 HOH A O 1 +HETATM 4100 O O . HOH D 3 . ? -29.739 -8.663 34.468 1.00 23.72 ? 216 HOH A O 1 +HETATM 4101 O O . HOH D 3 . ? -26.953 8.811 27.243 1.00 43.56 ? 217 HOH A O 1 +HETATM 4102 O O . HOH D 3 . ? -4.151 19.639 28.344 1.00 14.94 ? 218 HOH A O 1 +HETATM 4103 O O . HOH D 3 . ? -15.370 16.968 26.776 1.00 12.40 ? 219 HOH A O 1 +HETATM 4104 O O . HOH D 3 . ? -33.402 2.183 22.511 1.00 10.41 ? 220 HOH A O 1 +HETATM 4105 O O . HOH D 3 . ? -40.846 11.185 42.303 1.00 27.48 ? 221 HOH A O 1 +HETATM 4106 O O . HOH D 3 . ? -32.823 7.528 37.378 1.00 9.34 ? 222 HOH A O 1 +HETATM 4107 O O . HOH D 3 . ? -34.806 12.768 32.531 1.00 12.92 ? 223 HOH A O 1 +HETATM 4108 O O . HOH D 3 . ? -14.552 23.970 33.589 1.00 18.22 ? 224 HOH A O 1 +HETATM 4109 O O . HOH D 3 . ? -13.441 9.388 33.671 1.00 15.49 ? 225 HOH A O 1 +HETATM 4110 O O . HOH D 3 . ? -34.483 -10.054 31.039 1.00 32.66 ? 226 HOH A O 1 +HETATM 4111 O O . HOH D 3 . ? -6.187 13.164 29.974 1.00 8.66 ? 227 HOH A O 1 +HETATM 4112 O O . HOH D 3 . ? -33.364 4.033 41.709 1.00 7.47 ? 228 HOH A O 1 +HETATM 4113 O O . HOH D 3 . ? -14.098 24.300 41.284 1.00 20.67 ? 229 HOH A O 1 +HETATM 4114 O O . HOH D 3 . ? -20.657 1.011 49.670 1.00 18.66 ? 230 HOH A O 1 +HETATM 4115 O O . HOH D 3 . ? -34.391 3.850 29.308 1.00 21.80 ? 231 HOH A O 1 +HETATM 4116 O O . HOH D 3 . ? -35.442 13.506 36.638 1.00 15.72 ? 232 HOH A O 1 +HETATM 4117 O O . HOH D 3 . ? -13.114 22.850 23.870 1.00 20.55 ? 233 HOH A O 1 +HETATM 4118 O O . HOH D 3 . ? -20.156 7.648 20.869 1.00 14.21 ? 234 HOH A O 1 +HETATM 4119 O O . HOH D 3 . ? -22.038 25.158 47.171 1.00 10.48 ? 235 HOH A O 1 +HETATM 4120 O O . HOH D 3 . ? -4.420 23.442 25.766 1.00 34.18 ? 236 HOH A O 1 +HETATM 4121 O O . HOH D 3 . ? -25.899 33.829 25.211 1.00 31.88 ? 237 HOH A O 1 +HETATM 4122 O O . HOH D 3 . ? -20.404 24.505 34.490 1.00 9.52 ? 238 HOH A O 1 +HETATM 4123 O O . HOH D 3 . ? -21.438 26.100 24.537 1.00 14.58 ? 239 HOH A O 1 +HETATM 4124 O O . HOH D 3 . ? -13.286 16.942 40.216 1.00 26.93 ? 240 HOH A O 1 +HETATM 4125 O O . HOH D 3 . ? -17.713 -5.284 41.348 1.00 32.65 ? 241 HOH A O 1 +HETATM 4126 O O . HOH D 3 . ? -31.496 39.309 34.640 1.00 17.54 ? 242 HOH A O 1 +HETATM 4127 O O . HOH D 3 . ? -36.789 9.114 32.033 1.00 9.80 ? 243 HOH A O 1 +HETATM 4128 O O . HOH D 3 . ? -30.054 2.312 25.439 1.00 11.28 ? 244 HOH A O 1 +HETATM 4129 O O . HOH D 3 . ? -14.174 5.938 34.305 1.00 21.69 ? 245 HOH A O 1 +HETATM 4130 O O . HOH D 3 . ? -17.964 5.484 47.656 1.00 26.62 ? 246 HOH A O 1 +HETATM 4131 O O . HOH D 3 . ? -31.739 19.618 23.222 1.00 23.25 ? 247 HOH A O 1 +HETATM 4132 O O . HOH D 3 . ? -31.031 23.581 43.798 1.00 9.03 ? 248 HOH A O 1 +HETATM 4133 O O . HOH D 3 . ? -7.189 23.553 36.647 1.00 17.68 ? 249 HOH A O 1 +HETATM 4134 O O . HOH D 3 . ? -13.398 11.261 38.834 1.00 19.18 ? 250 HOH A O 1 +HETATM 4135 O O . HOH D 3 . ? -12.367 23.895 26.466 1.00 13.60 ? 251 HOH A O 1 +HETATM 4136 O O . HOH D 3 . ? -7.426 20.818 32.173 1.00 10.88 ? 252 HOH A O 1 +HETATM 4137 O O . HOH D 3 . ? -36.080 10.833 35.619 1.00 13.99 ? 253 HOH A O 1 +HETATM 4138 O O . HOH D 3 . ? -18.567 5.834 34.981 1.00 12.15 ? 254 HOH A O 1 +HETATM 4139 O O . HOH D 3 . ? -18.316 25.503 32.795 1.00 11.00 ? 255 HOH A O 1 +HETATM 4140 O O . HOH D 3 . ? -27.939 16.334 43.889 1.00 14.26 ? 256 HOH A O 1 +HETATM 4141 O O . HOH D 3 . ? -23.046 10.289 49.138 1.00 23.43 ? 257 HOH A O 1 +HETATM 4142 O O . HOH D 3 . ? -33.548 26.876 30.534 1.00 13.31 ? 258 HOH A O 1 +HETATM 4143 O O . HOH D 3 . ? -36.424 2.286 33.000 1.00 12.67 ? 259 HOH A O 1 +HETATM 4144 O O . HOH D 3 . ? -32.695 35.362 33.646 1.00 15.71 ? 260 HOH A O 1 +HETATM 4145 O O . HOH D 3 . ? -16.142 5.657 43.541 1.00 29.97 ? 261 HOH A O 1 +HETATM 4146 O O . HOH D 3 . ? -28.132 14.133 42.269 1.00 9.61 ? 262 HOH A O 1 +HETATM 4147 O O . HOH D 3 . ? -22.297 18.156 20.338 1.00 13.59 ? 263 HOH A O 1 +HETATM 4148 O O . HOH D 3 . ? -29.916 3.937 36.307 1.00 7.54 ? 264 HOH A O 1 +HETATM 4149 O O . HOH D 3 . ? -32.338 12.842 41.611 1.00 9.98 ? 265 HOH A O 1 +HETATM 4150 O O . HOH D 3 . ? -24.445 -1.391 41.476 1.00 10.51 ? 266 HOH A O 1 +HETATM 4151 O O . HOH D 3 . ? -16.802 24.158 25.500 1.00 17.98 ? 267 HOH A O 1 +HETATM 4152 O O . HOH D 3 . ? -14.654 24.733 27.790 1.00 19.56 ? 268 HOH A O 1 +HETATM 4153 O O . HOH D 3 . ? -28.789 10.871 20.030 1.00 9.77 ? 269 HOH A O 1 +HETATM 4154 O O . HOH D 3 . ? -14.576 13.372 30.234 1.00 9.60 ? 270 HOH A O 1 +HETATM 4155 O O . HOH D 3 . ? -12.685 10.561 35.891 1.00 22.81 ? 271 HOH A O 1 +HETATM 4156 O O . HOH D 3 . ? -33.130 18.572 25.558 1.00 23.65 ? 272 HOH A O 1 +HETATM 4157 O O . HOH D 3 . ? -17.911 14.470 42.195 1.00 19.26 ? 273 HOH A O 1 +HETATM 4158 O O . HOH D 3 . ? -32.072 15.339 36.945 1.00 12.06 ? 274 HOH A O 1 +HETATM 4159 O O . HOH D 3 . ? -30.614 30.794 42.368 1.00 6.85 ? 275 HOH A O 1 +HETATM 4160 O O . HOH D 3 . ? -29.262 23.301 21.670 1.00 18.81 ? 276 HOH A O 1 +HETATM 4161 O O . HOH D 3 . ? -23.132 4.244 24.565 1.00 22.16 ? 277 HOH A O 1 +HETATM 4162 O O . HOH D 3 . ? -12.109 13.039 35.976 1.00 16.41 ? 278 HOH A O 1 +HETATM 4163 O O . HOH D 3 . ? -15.385 10.681 30.462 1.00 9.18 ? 279 HOH A O 1 +HETATM 4164 O O . HOH D 3 . ? -37.069 19.231 34.431 1.00 13.63 ? 280 HOH A O 1 +HETATM 4165 O O . HOH D 3 . ? -32.981 29.053 38.669 1.00 8.96 ? 281 HOH A O 1 +HETATM 4166 O O . HOH D 3 . ? -8.883 13.369 32.213 1.00 11.28 ? 282 HOH A O 1 +HETATM 4167 O O . HOH D 3 . ? -34.270 4.634 31.060 1.00 14.46 ? 283 HOH A O 1 +HETATM 4168 O O . HOH D 3 . ? -37.652 16.626 33.614 1.00 13.73 ? 284 HOH A O 1 +HETATM 4169 O O . HOH D 3 . ? -16.012 0.708 38.080 1.00 23.89 ? 285 HOH A O 1 +HETATM 4170 O O . HOH D 3 . ? -29.065 -2.332 32.655 1.00 15.18 ? 286 HOH A O 1 +HETATM 4171 O O . HOH D 3 . ? -28.216 -8.822 27.424 1.00 27.47 ? 287 HOH A O 1 +HETATM 4172 O O . HOH D 3 . ? -16.834 17.329 29.074 1.00 10.92 ? 288 HOH A O 1 +HETATM 4173 O O . HOH D 3 . ? -19.942 28.360 45.889 1.00 34.54 ? 289 HOH A O 1 +HETATM 4174 O O . HOH D 3 . ? -23.316 3.032 50.909 1.00 23.54 ? 290 HOH A O 1 +HETATM 4175 O O . HOH D 3 . ? -25.556 -6.109 24.452 1.00 27.34 ? 291 HOH A O 1 +HETATM 4176 O O . HOH D 3 . ? -35.934 27.349 39.716 1.00 18.85 ? 292 HOH A O 1 +HETATM 4177 O O . HOH D 3 . ? -29.318 24.785 47.133 1.00 12.13 ? 293 HOH A O 1 +HETATM 4178 O O . HOH D 3 . ? -36.321 24.606 32.129 1.00 12.71 ? 294 HOH A O 1 +HETATM 4179 O O . HOH D 3 . ? -30.207 -1.519 26.012 1.00 22.39 ? 295 HOH A O 1 +HETATM 4180 O O . HOH D 3 . ? -35.756 16.772 36.703 1.00 15.43 ? 296 HOH A O 1 +HETATM 4181 O O . HOH D 3 . ? -25.998 9.601 22.507 1.00 13.15 ? 297 HOH A O 1 +HETATM 4182 O O . HOH D 3 . ? -20.337 -9.686 37.858 1.00 18.96 ? 298 HOH A O 1 +HETATM 4183 O O . HOH D 3 . ? -35.753 9.108 46.652 1.00 10.66 ? 299 HOH A O 1 +HETATM 4184 O O . HOH D 3 . ? -24.425 1.837 20.708 1.00 18.31 ? 300 HOH A O 1 +HETATM 4185 O O . HOH D 3 . ? -16.110 23.997 36.082 1.00 17.30 ? 301 HOH A O 1 +HETATM 4186 O O . HOH D 3 . ? -37.464 26.610 38.722 1.00 21.58 ? 302 HOH A O 1 +HETATM 4187 O O . HOH D 3 . ? -15.398 2.137 35.733 1.00 17.47 ? 303 HOH A O 1 +HETATM 4188 O O . HOH D 3 . ? -19.213 13.486 48.735 1.00 26.86 ? 304 HOH A O 1 +HETATM 4189 O O . HOH D 3 . ? -18.844 2.156 44.789 1.00 26.48 ? 305 HOH A O 1 +HETATM 4190 O O . HOH D 3 . ? -23.163 -7.604 38.481 1.00 15.69 ? 306 HOH A O 1 +HETATM 4191 O O . HOH D 3 . ? -32.248 22.583 24.071 1.00 17.49 ? 307 HOH A O 1 +HETATM 4192 O O . HOH D 3 . ? -26.214 19.438 44.378 1.00 14.17 ? 308 HOH A O 1 +HETATM 4193 O O . HOH D 3 . ? -19.990 28.193 35.937 1.00 20.20 ? 309 HOH A O 1 +HETATM 4194 O O . HOH D 3 . ? -23.215 -3.553 22.752 1.00 25.71 ? 310 HOH A O 1 +HETATM 4195 O O . HOH D 3 . ? -33.102 -6.717 29.055 1.00 22.77 ? 311 HOH A O 1 +HETATM 4196 O O . HOH D 3 . ? -16.902 8.393 46.351 1.00 28.69 ? 312 HOH A O 1 +HETATM 4197 O O . HOH D 3 . ? -17.119 28.229 30.067 1.00 24.46 ? 313 HOH A O 1 +HETATM 4198 O O . HOH D 3 . ? -15.165 -7.791 38.579 1.00 21.76 ? 314 HOH A O 1 +HETATM 4199 O O . HOH D 3 . ? -19.788 32.261 36.781 1.00 21.63 ? 315 HOH A O 1 +HETATM 4200 O O . HOH D 3 . ? -34.967 11.355 39.829 1.00 11.04 ? 316 HOH A O 1 +HETATM 4201 O O . HOH D 3 . ? -34.594 13.453 40.140 1.00 14.97 ? 317 HOH A O 1 +HETATM 4202 O O . HOH D 3 . ? -39.662 5.239 39.151 1.00 21.07 ? 318 HOH A O 1 +HETATM 4203 O O . HOH D 3 . ? -18.530 19.162 41.855 1.00 13.14 ? 319 HOH A O 1 +HETATM 4204 O O . HOH D 3 . ? -21.059 -4.766 25.800 1.00 25.71 ? 320 HOH A O 1 +HETATM 4205 O O . HOH D 3 . ? -37.067 29.660 26.291 1.00 45.59 ? 321 HOH A O 1 +HETATM 4206 O O . HOH D 3 . ? -11.751 15.448 38.077 1.00 19.08 ? 322 HOH A O 1 +HETATM 4207 O O . HOH D 3 . ? -32.413 -3.010 26.349 1.00 32.16 ? 323 HOH A O 1 +HETATM 4208 O O . HOH D 3 . ? -28.833 27.002 43.512 1.00 11.70 ? 324 HOH A O 1 +HETATM 4209 O O . HOH D 3 . ? -29.304 2.114 20.285 1.00 17.77 ? 325 HOH A O 1 +HETATM 4210 O O . HOH D 3 . ? -12.977 25.477 29.967 1.00 21.79 ? 326 HOH A O 1 +HETATM 4211 O O . HOH D 3 . ? -19.058 8.294 50.896 1.00 31.43 ? 327 HOH A O 1 +HETATM 4212 O O . HOH D 3 . ? -6.176 23.441 29.686 1.00 9.34 ? 328 HOH A O 1 +HETATM 4213 O O . HOH D 3 . ? -3.753 20.738 25.172 1.00 34.81 ? 329 HOH A O 1 +HETATM 4214 O O . HOH D 3 . ? -20.820 33.160 34.667 1.00 16.63 ? 330 HOH A O 1 +HETATM 4215 O O . HOH D 3 . ? -34.800 21.044 30.454 1.00 10.09 ? 331 HOH A O 1 +HETATM 4216 O O . HOH D 3 . ? -27.611 38.957 37.503 1.00 12.07 ? 332 HOH A O 1 +HETATM 4217 O O . HOH D 3 . ? -32.923 22.494 38.509 1.00 10.18 ? 333 HOH A O 1 +HETATM 4218 O O . HOH D 3 . ? -30.989 20.906 39.679 1.00 9.73 ? 334 HOH A O 1 +HETATM 4219 O O . HOH D 3 . ? -37.558 19.831 37.126 1.00 14.19 ? 335 HOH A O 1 +HETATM 4220 O O . HOH D 3 . ? -24.356 29.656 24.450 1.00 17.31 ? 336 HOH A O 1 +HETATM 4221 O O . HOH D 3 . ? -24.942 3.540 40.446 1.00 9.82 ? 337 HOH A O 1 +HETATM 4222 O O . HOH D 3 . ? -18.725 -7.270 41.975 1.00 26.05 ? 338 HOH A O 1 +HETATM 4223 O O . HOH D 3 . ? -16.042 12.783 43.181 1.00 31.06 ? 339 HOH A O 1 +HETATM 4224 O O . HOH D 3 . ? -13.790 0.256 38.413 1.00 15.63 ? 340 HOH A O 1 +HETATM 4225 O O . HOH D 3 . ? -13.432 -1.409 32.595 1.00 23.53 ? 341 HOH A O 1 +HETATM 4226 O O . HOH D 3 . ? -19.025 24.427 20.002 1.00 24.36 ? 342 HOH A O 1 +HETATM 4227 O O . HOH D 3 . ? -23.290 5.242 20.760 1.00 24.17 ? 343 HOH A O 1 +HETATM 4228 O O . HOH D 3 . ? -14.968 -0.189 28.481 1.00 17.21 ? 344 HOH A O 1 +HETATM 4229 O O . HOH D 3 . ? -28.631 28.171 21.371 1.00 33.26 ? 345 HOH A O 1 +HETATM 4230 O O . HOH D 3 . ? -26.668 12.686 16.408 1.00 16.88 ? 346 HOH A O 1 +HETATM 4231 O O . HOH D 3 . ? -29.498 -0.022 23.860 1.00 16.78 ? 347 HOH A O 1 +HETATM 4232 O O . HOH D 3 . ? -29.324 15.374 18.614 1.00 14.38 ? 348 HOH A O 1 +HETATM 4233 O O . HOH D 3 . ? -23.106 -12.040 37.805 1.00 20.88 ? 349 HOH A O 1 +HETATM 4234 O O . HOH D 3 . ? -34.351 25.300 28.313 1.00 16.82 ? 350 HOH A O 1 +HETATM 4235 O O . HOH D 3 . ? -36.155 9.766 38.080 1.00 14.22 ? 351 HOH A O 1 +HETATM 4236 O O . HOH D 3 . ? -29.828 35.368 24.065 1.00 29.23 ? 352 HOH A O 1 +HETATM 4237 O O . HOH D 3 . ? -15.791 -1.892 25.533 1.00 27.32 ? 353 HOH A O 1 +HETATM 4238 O O . HOH D 3 . ? -9.601 15.598 36.135 1.00 20.63 ? 354 HOH A O 1 +HETATM 4239 O O . HOH D 3 . ? -17.149 16.797 42.565 1.00 25.50 ? 355 HOH A O 1 +HETATM 4240 O O . HOH D 3 . ? -27.311 35.450 24.826 1.00 34.07 ? 356 HOH A O 1 +HETATM 4241 O O . HOH D 3 . ? -24.123 32.431 24.422 1.00 29.45 ? 357 HOH A O 1 +HETATM 4242 O O . HOH D 3 . ? -33.058 28.232 21.491 1.00 38.93 ? 358 HOH A O 1 +HETATM 4243 O O . HOH D 3 . ? -20.352 -3.095 43.330 1.00 27.97 ? 359 HOH A O 1 +HETATM 4244 O O . HOH D 3 . ? -37.931 13.205 34.832 1.00 20.93 ? 360 HOH A O 1 +HETATM 4245 O O . HOH D 3 . ? -29.562 18.306 19.927 1.00 19.33 ? 361 HOH A O 1 +HETATM 4246 O O . HOH D 3 . ? -23.131 16.169 47.780 1.00 32.15 ? 362 HOH A O 1 +HETATM 4247 O O . HOH D 3 . ? -22.404 22.468 50.870 1.00 34.81 ? 363 HOH A O 1 +HETATM 4248 O O . HOH D 3 . ? -36.898 16.134 40.245 1.00 22.00 ? 364 HOH A O 1 +HETATM 4249 O O . HOH D 3 . ? -32.329 36.879 19.785 1.00 45.49 ? 365 HOH A O 1 +HETATM 4250 O O . HOH D 3 . ? -34.887 -8.537 24.417 1.00 41.25 ? 366 HOH A O 1 +HETATM 4251 O O . HOH D 3 . ? -22.488 14.184 49.475 1.00 45.37 ? 367 HOH A O 1 +HETATM 4252 O O . HOH D 3 . ? -19.252 35.122 33.730 1.00 32.09 ? 368 HOH A O 1 +HETATM 4253 O O . HOH D 3 . ? -14.304 28.146 39.200 1.00 28.91 ? 369 HOH A O 1 +HETATM 4254 O O . HOH D 3 . ? -18.222 -11.550 38.323 1.00 26.30 ? 370 HOH A O 1 +HETATM 4255 O O . HOH D 3 . ? -21.807 40.342 28.668 1.00 42.69 ? 371 HOH A O 1 +HETATM 4256 O O . HOH D 3 . ? -33.526 -5.019 31.613 1.00 31.14 ? 372 HOH A O 1 +HETATM 4257 O O . HOH D 3 . ? -39.025 35.633 30.351 1.00 40.42 ? 373 HOH A O 1 +HETATM 4258 O O . HOH D 3 . ? -31.584 -4.657 33.281 1.00 24.94 ? 374 HOH A O 1 +HETATM 4259 O O . HOH D 3 . ? -36.416 2.272 30.192 1.00 22.06 ? 375 HOH A O 1 +HETATM 4260 O O . HOH D 3 . ? -16.818 7.179 48.534 1.00 42.62 ? 376 HOH A O 1 +HETATM 4261 O O . HOH D 3 . ? -12.075 6.454 36.035 1.00 29.08 ? 377 HOH A O 1 +HETATM 4262 O O . HOH D 3 . ? -18.181 25.984 21.946 1.00 33.27 ? 378 HOH A O 1 +HETATM 4263 O O . HOH D 3 . ? -31.077 5.595 38.188 1.00 9.25 ? 379 HOH A O 1 +HETATM 4264 O O . HOH D 3 . ? -29.072 -5.276 36.642 1.00 27.27 ? 380 HOH A O 1 +HETATM 4265 O O . HOH D 3 . ? -6.565 22.718 34.052 1.00 15.82 ? 381 HOH A O 1 +HETATM 4266 O O . HOH D 3 . ? -30.230 17.043 18.003 1.00 36.27 ? 382 HOH A O 1 +HETATM 4267 O O . HOH D 3 . ? -30.332 21.214 42.360 1.00 10.42 ? 383 HOH A O 1 +HETATM 4268 O O . HOH D 3 . ? -37.266 14.269 38.538 1.00 20.29 ? 384 HOH A O 1 +HETATM 4269 O O . HOH D 3 . ? -18.494 22.577 48.764 1.00 25.70 ? 385 HOH A O 1 +HETATM 4270 O O . HOH D 3 . ? -32.337 3.457 39.120 1.00 9.61 ? 386 HOH A O 1 +HETATM 4271 O O . HOH D 3 . ? -14.133 26.213 32.047 1.00 36.00 ? 387 HOH A O 1 +HETATM 4272 O O . HOH D 3 . ? -15.648 25.810 33.766 1.00 38.32 ? 388 HOH A O 1 +HETATM 4273 O O . HOH D 3 . ? -28.839 41.249 37.039 1.00 27.90 ? 389 HOH A O 1 +HETATM 4274 O O . HOH D 3 . ? -18.370 29.052 44.434 1.00 25.74 ? 390 HOH A O 1 +HETATM 4275 O O . HOH D 3 . ? -18.657 26.197 24.958 1.00 23.71 ? 391 HOH A O 1 +HETATM 4276 O O . HOH D 3 . ? -25.357 18.246 46.537 1.00 22.23 ? 392 HOH A O 1 +HETATM 4277 O O . HOH D 3 . ? -21.001 -8.024 43.726 1.00 21.19 ? 393 HOH A O 1 +HETATM 4278 O O . HOH D 3 . ? -30.752 1.896 22.591 1.00 21.97 ? 394 HOH A O 1 +HETATM 4279 O O . HOH D 3 . ? -11.735 22.247 38.529 1.00 31.51 ? 395 HOH A O 1 +HETATM 4280 O O . HOH D 3 . ? -15.908 28.073 43.732 1.00 16.72 ? 396 HOH A O 1 +HETATM 4281 O O . HOH D 3 . ? -13.551 -0.363 24.929 1.00 28.40 ? 397 HOH A O 1 +HETATM 4282 O O . HOH D 3 . ? -27.413 -7.121 37.166 1.00 30.37 ? 398 HOH A O 1 +HETATM 4283 O O . HOH D 3 . ? -21.861 28.642 23.786 1.00 21.04 ? 399 HOH A O 1 +HETATM 4284 O O . HOH D 3 . ? -14.251 12.487 41.378 1.00 37.72 ? 400 HOH A O 1 +HETATM 4285 O O . HOH D 3 . ? -25.128 -10.850 36.486 1.00 16.42 ? 401 HOH A O 1 +HETATM 4286 O O . HOH D 3 . ? -16.214 -10.091 39.623 1.00 30.11 ? 402 HOH A O 1 +HETATM 4287 O O . HOH D 3 . ? -10.883 26.090 25.943 1.00 31.46 ? 403 HOH A O 1 +HETATM 4288 O O . HOH D 3 . ? -12.781 25.728 39.263 1.00 22.82 ? 404 HOH A O 1 +HETATM 4289 O O . HOH D 3 . ? -37.734 27.211 29.273 1.00 39.15 ? 405 HOH A O 1 +HETATM 4290 O O . HOH D 3 . ? -24.684 -2.788 20.758 1.00 32.88 ? 406 HOH A O 1 +HETATM 4291 O O . HOH D 3 . ? -36.853 14.976 41.833 1.00 23.84 ? 407 HOH A O 1 +HETATM 4292 O O . HOH D 3 . ? -30.674 -6.313 35.272 1.00 27.86 ? 408 HOH A O 1 +HETATM 4293 O O . HOH D 3 . ? -8.546 21.866 23.738 1.00 23.82 ? 409 HOH A O 1 +HETATM 4294 O O . HOH D 3 . ? -12.728 0.001 30.430 1.00 21.38 ? 410 HOH A O 1 +HETATM 4295 O O . HOH D 3 . ? -15.066 27.435 28.247 1.00 38.38 ? 411 HOH A O 1 +HETATM 4296 O O . HOH D 3 . ? -24.666 36.285 25.856 1.00 38.14 ? 412 HOH A O 1 +HETATM 4297 O O . HOH D 3 . ? -10.268 13.178 38.278 1.00 31.74 ? 413 HOH A O 1 +HETATM 4298 O O . HOH D 3 . ? -26.933 -8.223 25.695 1.00 32.95 ? 414 HOH A O 1 +HETATM 4299 O O . HOH D 3 . ? -19.171 -5.787 25.474 1.00 34.28 ? 415 HOH A O 1 +HETATM 4300 O O . HOH D 3 . ? -14.429 7.501 43.487 1.00 35.63 ? 416 HOH A O 1 +HETATM 4301 O O . HOH D 3 . ? -20.553 24.210 49.238 1.00 21.85 ? 417 HOH A O 1 +HETATM 4302 O O . HOH D 3 . ? -10.632 12.159 39.483 1.00 27.09 ? 418 HOH A O 1 +HETATM 4303 O O . HOH D 3 . ? -22.454 24.926 14.377 1.00 32.51 ? 419 HOH A O 1 +HETATM 4304 O O . HOH D 3 . ? -11.628 -2.411 28.946 1.00 40.57 ? 420 HOH A O 1 +HETATM 4305 O O . HOH D 3 . ? -36.922 12.603 40.348 1.00 27.89 ? 421 HOH A O 1 +HETATM 4306 O O . HOH D 3 . ? -32.954 41.377 35.497 1.00 22.39 ? 422 HOH A O 1 +HETATM 4307 O O . HOH D 3 . ? -15.667 29.270 41.135 1.00 23.19 ? 423 HOH A O 1 +HETATM 4308 O O . HOH D 3 . ? -36.254 6.649 30.684 1.00 13.32 ? 424 HOH A O 1 +HETATM 4309 O O . HOH D 3 . ? -9.413 9.837 38.267 1.00 16.96 ? 425 HOH A O 1 +HETATM 4310 O O . HOH D 3 . ? -38.760 3.267 29.126 1.00 25.81 ? 426 HOH A O 1 +# diff --git a/tests/resources/5jg9.cif b/tests/resources/5jg9.cif new file mode 100644 index 0000000..3029dd8 --- /dev/null +++ b/tests/resources/5jg9.cif @@ -0,0 +1,4606 @@ +data_5JG9 +# +_entry.id 5JG9 +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.398 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 5JG9 pdb_00005jg9 10.2210/pdb5jg9/pdb +WWPDB D_1000220536 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2016-09-28 +2 'Structure model' 1 1 2016-10-12 +3 'Structure model' 1 2 2016-10-26 +4 'Structure model' 1 3 2016-11-02 +5 'Structure model' 1 4 2024-11-06 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Structure summary' +2 3 'Structure model' 'Database references' +3 4 'Structure model' 'Database references' +4 5 'Structure model' 'Data collection' +5 5 'Structure model' 'Database references' +6 5 'Structure model' 'Derived calculations' +7 5 'Structure model' 'Refinement description' +8 5 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 5 'Structure model' chem_comp_atom +2 5 'Structure model' chem_comp_bond +3 5 'Structure model' citation +4 5 'Structure model' database_2 +5 5 'Structure model' pdbx_entry_details +6 5 'Structure model' pdbx_modification_feature +7 5 'Structure model' pdbx_struct_oper_list +8 5 'Structure model' struct_ncs_dom_lim +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 5 'Structure model' '_citation.journal_id_CSD' +2 5 'Structure model' '_database_2.pdbx_DOI' +3 5 'Structure model' '_database_2.pdbx_database_accession' +4 5 'Structure model' '_pdbx_struct_oper_list.symmetry_operation' +5 5 'Structure model' '_struct_ncs_dom_lim.beg_auth_comp_id' +6 5 'Structure model' '_struct_ncs_dom_lim.beg_label_asym_id' +7 5 'Structure model' '_struct_ncs_dom_lim.beg_label_comp_id' +8 5 'Structure model' '_struct_ncs_dom_lim.beg_label_seq_id' +9 5 'Structure model' '_struct_ncs_dom_lim.end_auth_comp_id' +10 5 'Structure model' '_struct_ncs_dom_lim.end_label_asym_id' +11 5 'Structure model' '_struct_ncs_dom_lim.end_label_comp_id' +12 5 'Structure model' '_struct_ncs_dom_lim.end_label_seq_id' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.entry_id 5JG9 +_pdbx_database_status.recvd_initial_deposition_date 2016-04-19 +_pdbx_database_status.SG_entry N +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Rupert, P.B.' 1 +'Johnsen, W.A.' 2 +# +_citation.abstract ? +_citation.abstract_id_CAS ? +_citation.book_id_ISBN ? +_citation.book_publisher ? +_citation.book_publisher_city ? +_citation.book_title ? +_citation.coordinate_linkage ? +_citation.country UK +_citation.database_id_Medline ? +_citation.details ? +_citation.id primary +_citation.journal_abbrev Nature +_citation.journal_id_ASTM NATUAS +_citation.journal_id_CSD 0006 +_citation.journal_id_ISSN 1476-4687 +_citation.journal_full ? +_citation.journal_issue ? +_citation.journal_volume 538 +_citation.language ? +_citation.page_first 329 +_citation.page_last 335 +_citation.title 'Accurate de novo design of hyperstable constrained peptides.' +_citation.year 2016 +_citation.database_id_CSD ? +_citation.pdbx_database_id_DOI 10.1038/nature19791 +_citation.pdbx_database_id_PubMed 27626386 +_citation.unpublished_flag ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Bhardwaj, G.' 1 ? +primary 'Mulligan, V.K.' 2 ? +primary 'Bahl, C.D.' 3 ? +primary 'Gilmore, J.M.' 4 ? +primary 'Harvey, P.J.' 5 ? +primary 'Cheneval, O.' 6 ? +primary 'Buchko, G.W.' 7 ? +primary 'Pulavarti, S.V.' 8 ? +primary 'Kaas, Q.' 9 ? +primary 'Eletsky, A.' 10 ? +primary 'Huang, P.S.' 11 ? +primary 'Johnsen, W.A.' 12 ? +primary 'Greisen, P.J.' 13 ? +primary 'Rocklin, G.J.' 14 ? +primary 'Song, Y.' 15 ? +primary 'Linsky, T.W.' 16 ? +primary 'Watkins, A.' 17 ? +primary 'Rettie, S.A.' 18 ? +primary 'Xu, X.' 19 ? +primary 'Carter, L.P.' 20 ? +primary 'Bonneau, R.' 21 ? +primary 'Olson, J.M.' 22 ? +primary 'Coutsias, E.' 23 ? +primary 'Correnti, C.E.' 24 ? +primary 'Szyperski, T.' 25 ? +primary 'Craik, D.J.' 26 ? +primary 'Baker, D.' 27 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'de novo design, hyper stable, disulfide-rich mini protein' 5843.565 3 ? ? ? ? +2 non-polymer syn 'CHLORIDE ION' 35.453 1 ? ? ? ? +3 non-polymer syn GLYCEROL 92.094 1 ? ? ? ? +4 water nat water 18.015 68 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer no +_entity_poly.pdbx_seq_one_letter_code GSEERRYKRCGQDEERVRRECKERGERQNCQYQIRKEGNCYVCEIRC +_entity_poly.pdbx_seq_one_letter_code_can GSEERRYKRCGQDEERVRRECKERGERQNCQYQIRKEGNCYVCEIRC +_entity_poly.pdbx_strand_id A,B,C +_entity_poly.pdbx_target_identifier ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +2 'CHLORIDE ION' CL +3 GLYCEROL GOL +4 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 GLY n +1 2 SER n +1 3 GLU n +1 4 GLU n +1 5 ARG n +1 6 ARG n +1 7 TYR n +1 8 LYS n +1 9 ARG n +1 10 CYS n +1 11 GLY n +1 12 GLN n +1 13 ASP n +1 14 GLU n +1 15 GLU n +1 16 ARG n +1 17 VAL n +1 18 ARG n +1 19 ARG n +1 20 GLU n +1 21 CYS n +1 22 LYS n +1 23 GLU n +1 24 ARG n +1 25 GLY n +1 26 GLU n +1 27 ARG n +1 28 GLN n +1 29 ASN n +1 30 CYS n +1 31 GLN n +1 32 TYR n +1 33 GLN n +1 34 ILE n +1 35 ARG n +1 36 LYS n +1 37 GLU n +1 38 GLY n +1 39 ASN n +1 40 CYS n +1 41 TYR n +1 42 VAL n +1 43 CYS n +1 44 GLU n +1 45 ILE n +1 46 ARG n +1 47 CYS n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type 'Biological sequence' +_entity_src_gen.pdbx_beg_seq_num 1 +_entity_src_gen.pdbx_end_seq_num 47 +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'synthetic construct' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 32630 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Homo sapiens' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain ? +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type ? +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name ? +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CL non-polymer . 'CHLORIDE ION' ? 'Cl -1' 35.453 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 GLY 1 -1 ? ? ? A . n +A 1 2 SER 2 0 0 SER SER A . n +A 1 3 GLU 3 1 1 GLU GLU A . n +A 1 4 GLU 4 2 2 GLU GLU A . n +A 1 5 ARG 5 3 3 ARG ARG A . n +A 1 6 ARG 6 4 4 ARG ARG A . n +A 1 7 TYR 7 5 5 TYR TYR A . n +A 1 8 LYS 8 6 6 LYS LYS A . n +A 1 9 ARG 9 7 7 ARG ARG A . n +A 1 10 CYS 10 8 8 CYS CYS A . n +A 1 11 GLY 11 9 9 GLY GLY A . n +A 1 12 GLN 12 10 10 GLN GLN A . n +A 1 13 ASP 13 11 11 ASP ASP A . n +A 1 14 GLU 14 12 12 GLU GLU A . n +A 1 15 GLU 15 13 13 GLU GLU A . n +A 1 16 ARG 16 14 14 ARG ARG A . n +A 1 17 VAL 17 15 15 VAL VAL A . n +A 1 18 ARG 18 16 16 ARG ARG A . n +A 1 19 ARG 19 17 17 ARG ARG A . n +A 1 20 GLU 20 18 18 GLU GLU A . n +A 1 21 CYS 21 19 19 CYS CYS A . n +A 1 22 LYS 22 20 20 LYS LYS A . n +A 1 23 GLU 23 21 21 GLU GLU A . n +A 1 24 ARG 24 22 22 ARG ARG A . n +A 1 25 GLY 25 23 23 GLY GLY A . n +A 1 26 GLU 26 24 24 GLU GLU A . n +A 1 27 ARG 27 25 25 ARG ARG A . n +A 1 28 GLN 28 26 26 GLN GLN A . n +A 1 29 ASN 29 27 27 ASN ASN A . n +A 1 30 CYS 30 28 28 CYS CYS A . n +A 1 31 GLN 31 29 29 GLN GLN A . n +A 1 32 TYR 32 30 30 TYR TYR A . n +A 1 33 GLN 33 31 31 GLN GLN A . n +A 1 34 ILE 34 32 32 ILE ILE A . n +A 1 35 ARG 35 33 33 ARG ARG A . n +A 1 36 LYS 36 34 34 LYS LYS A . n +A 1 37 GLU 37 35 35 GLU GLU A . n +A 1 38 GLY 38 36 36 GLY GLY A . n +A 1 39 ASN 39 37 37 ASN ASN A . n +A 1 40 CYS 40 38 38 CYS CYS A . n +A 1 41 TYR 41 39 39 TYR TYR A . n +A 1 42 VAL 42 40 40 VAL VAL A . n +A 1 43 CYS 43 41 41 CYS CYS A . n +A 1 44 GLU 44 42 42 GLU GLU A . n +A 1 45 ILE 45 43 43 ILE ILE A . n +A 1 46 ARG 46 44 44 ARG ARG A . n +A 1 47 CYS 47 45 45 CYS CYS A . n +B 1 1 GLY 1 -1 -1 GLY GLY B . n +B 1 2 SER 2 0 0 SER SER B . n +B 1 3 GLU 3 1 1 GLU GLU B . n +B 1 4 GLU 4 2 2 GLU GLU B . n +B 1 5 ARG 5 3 3 ARG ARG B . n +B 1 6 ARG 6 4 4 ARG ARG B . n +B 1 7 TYR 7 5 5 TYR TYR B . n +B 1 8 LYS 8 6 6 LYS LYS B . n +B 1 9 ARG 9 7 7 ARG ARG B . n +B 1 10 CYS 10 8 8 CYS CYS B . n +B 1 11 GLY 11 9 9 GLY GLY B . n +B 1 12 GLN 12 10 10 GLN GLN B . n +B 1 13 ASP 13 11 11 ASP ASP B . n +B 1 14 GLU 14 12 12 GLU GLU B . n +B 1 15 GLU 15 13 13 GLU GLU B . n +B 1 16 ARG 16 14 14 ARG ARG B . n +B 1 17 VAL 17 15 15 VAL VAL B . n +B 1 18 ARG 18 16 16 ARG ARG B . n +B 1 19 ARG 19 17 17 ARG ARG B . n +B 1 20 GLU 20 18 18 GLU GLU B . n +B 1 21 CYS 21 19 19 CYS CYS B . n +B 1 22 LYS 22 20 20 LYS LYS B . n +B 1 23 GLU 23 21 21 GLU GLU B . n +B 1 24 ARG 24 22 22 ARG ARG B . n +B 1 25 GLY 25 23 23 GLY GLY B . n +B 1 26 GLU 26 24 24 GLU GLU B . n +B 1 27 ARG 27 25 25 ARG ARG B . n +B 1 28 GLN 28 26 26 GLN GLN B . n +B 1 29 ASN 29 27 27 ASN ASN B . n +B 1 30 CYS 30 28 28 CYS CYS B . n +B 1 31 GLN 31 29 29 GLN GLN B . n +B 1 32 TYR 32 30 30 TYR TYR B . n +B 1 33 GLN 33 31 31 GLN GLN B . n +B 1 34 ILE 34 32 32 ILE ILE B . n +B 1 35 ARG 35 33 33 ARG ARG B . n +B 1 36 LYS 36 34 34 LYS LYS B . n +B 1 37 GLU 37 35 35 GLU GLU B . n +B 1 38 GLY 38 36 36 GLY GLY B . n +B 1 39 ASN 39 37 37 ASN ASN B . n +B 1 40 CYS 40 38 38 CYS CYS B . n +B 1 41 TYR 41 39 39 TYR TYR B . n +B 1 42 VAL 42 40 40 VAL VAL B . n +B 1 43 CYS 43 41 41 CYS CYS B . n +B 1 44 GLU 44 42 42 GLU GLU B . n +B 1 45 ILE 45 43 43 ILE ILE B . n +B 1 46 ARG 46 44 44 ARG ARG B . n +B 1 47 CYS 47 45 45 CYS CYS B . n +C 1 1 GLY 1 -1 -1 GLY GLY C . n +C 1 2 SER 2 0 0 SER SER C . n +C 1 3 GLU 3 1 1 GLU GLU C . n +C 1 4 GLU 4 2 2 GLU GLU C . n +C 1 5 ARG 5 3 3 ARG ARG C . n +C 1 6 ARG 6 4 4 ARG ARG C . n +C 1 7 TYR 7 5 5 TYR TYR C . n +C 1 8 LYS 8 6 6 LYS LYS C . n +C 1 9 ARG 9 7 7 ARG ARG C . n +C 1 10 CYS 10 8 8 CYS CYS C . n +C 1 11 GLY 11 9 9 GLY GLY C . n +C 1 12 GLN 12 10 10 GLN GLN C . n +C 1 13 ASP 13 11 11 ASP ASP C . n +C 1 14 GLU 14 12 12 GLU GLU C . n +C 1 15 GLU 15 13 13 GLU GLU C . n +C 1 16 ARG 16 14 14 ARG ARG C . n +C 1 17 VAL 17 15 15 VAL VAL C . n +C 1 18 ARG 18 16 16 ARG ARG C . n +C 1 19 ARG 19 17 17 ARG ARG C . n +C 1 20 GLU 20 18 18 GLU GLU C . n +C 1 21 CYS 21 19 19 CYS CYS C . n +C 1 22 LYS 22 20 20 LYS LYS C . n +C 1 23 GLU 23 21 21 GLU GLU C . n +C 1 24 ARG 24 22 22 ARG ARG C . n +C 1 25 GLY 25 23 23 GLY GLY C . n +C 1 26 GLU 26 24 24 GLU GLU C . n +C 1 27 ARG 27 25 25 ARG ARG C . n +C 1 28 GLN 28 26 26 GLN GLN C . n +C 1 29 ASN 29 27 27 ASN ASN C . n +C 1 30 CYS 30 28 28 CYS CYS C . n +C 1 31 GLN 31 29 29 GLN GLN C . n +C 1 32 TYR 32 30 30 TYR TYR C . n +C 1 33 GLN 33 31 31 GLN GLN C . n +C 1 34 ILE 34 32 32 ILE ILE C . n +C 1 35 ARG 35 33 33 ARG ARG C . n +C 1 36 LYS 36 34 34 LYS LYS C . n +C 1 37 GLU 37 35 35 GLU GLU C . n +C 1 38 GLY 38 36 36 GLY GLY C . n +C 1 39 ASN 39 37 37 ASN ASN C . n +C 1 40 CYS 40 38 38 CYS CYS C . n +C 1 41 TYR 41 39 39 TYR TYR C . n +C 1 42 VAL 42 40 40 VAL VAL C . n +C 1 43 CYS 43 41 41 CYS CYS C . n +C 1 44 GLU 44 42 42 GLU GLU C . n +C 1 45 ILE 45 43 43 ILE ILE C . n +C 1 46 ARG 46 44 44 ARG ARG C . n +C 1 47 CYS 47 45 45 CYS CYS C . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +D 2 CL 1 101 1 CL CL B . +E 3 GOL 1 101 1 GOL GOL C . +F 4 HOH 1 101 66 HOH HOH A . +F 4 HOH 2 102 30 HOH HOH A . +F 4 HOH 3 103 72 HOH HOH A . +F 4 HOH 4 104 31 HOH HOH A . +F 4 HOH 5 105 16 HOH HOH A . +F 4 HOH 6 106 36 HOH HOH A . +F 4 HOH 7 107 3 HOH HOH A . +F 4 HOH 8 108 14 HOH HOH A . +F 4 HOH 9 109 70 HOH HOH A . +F 4 HOH 10 110 42 HOH HOH A . +F 4 HOH 11 111 23 HOH HOH A . +F 4 HOH 12 112 47 HOH HOH A . +F 4 HOH 13 113 44 HOH HOH A . +F 4 HOH 14 114 73 HOH HOH A . +F 4 HOH 15 115 35 HOH HOH A . +F 4 HOH 16 116 24 HOH HOH A . +F 4 HOH 17 117 22 HOH HOH A . +F 4 HOH 18 118 26 HOH HOH A . +F 4 HOH 19 119 37 HOH HOH A . +F 4 HOH 20 120 50 HOH HOH A . +F 4 HOH 21 121 54 HOH HOH A . +F 4 HOH 22 122 1 HOH HOH A . +F 4 HOH 23 123 38 HOH HOH A . +G 4 HOH 1 201 55 HOH HOH B . +G 4 HOH 2 202 28 HOH HOH B . +G 4 HOH 3 203 56 HOH HOH B . +G 4 HOH 4 204 32 HOH HOH B . +G 4 HOH 5 205 71 HOH HOH B . +G 4 HOH 6 206 65 HOH HOH B . +G 4 HOH 7 207 69 HOH HOH B . +G 4 HOH 8 208 20 HOH HOH B . +G 4 HOH 9 209 12 HOH HOH B . +G 4 HOH 10 210 68 HOH HOH B . +G 4 HOH 11 211 74 HOH HOH B . +G 4 HOH 12 212 11 HOH HOH B . +G 4 HOH 13 213 9 HOH HOH B . +G 4 HOH 14 214 17 HOH HOH B . +G 4 HOH 15 215 13 HOH HOH B . +G 4 HOH 16 216 39 HOH HOH B . +G 4 HOH 17 217 25 HOH HOH B . +G 4 HOH 18 218 61 HOH HOH B . +G 4 HOH 19 219 33 HOH HOH B . +G 4 HOH 20 220 59 HOH HOH B . +G 4 HOH 21 221 57 HOH HOH B . +G 4 HOH 22 222 62 HOH HOH B . +H 4 HOH 1 201 48 HOH HOH C . +H 4 HOH 2 202 5 HOH HOH C . +H 4 HOH 3 203 64 HOH HOH C . +H 4 HOH 4 204 27 HOH HOH C . +H 4 HOH 5 205 52 HOH HOH C . +H 4 HOH 6 206 34 HOH HOH C . +H 4 HOH 7 207 18 HOH HOH C . +H 4 HOH 8 208 41 HOH HOH C . +H 4 HOH 9 209 46 HOH HOH C . +H 4 HOH 10 210 8 HOH HOH C . +H 4 HOH 11 211 63 HOH HOH C . +H 4 HOH 12 212 43 HOH HOH C . +H 4 HOH 13 213 15 HOH HOH C . +H 4 HOH 14 214 7 HOH HOH C . +H 4 HOH 15 215 51 HOH HOH C . +H 4 HOH 16 216 19 HOH HOH C . +H 4 HOH 17 217 40 HOH HOH C . +H 4 HOH 18 218 45 HOH HOH C . +H 4 HOH 19 219 60 HOH HOH C . +H 4 HOH 20 220 21 HOH HOH C . +H 4 HOH 21 221 67 HOH HOH C . +H 4 HOH 22 222 49 HOH HOH C . +H 4 HOH 23 223 4 HOH HOH C . +# +_pdbx_unobs_or_zero_occ_atoms.id 1 +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 1 +_pdbx_unobs_or_zero_occ_atoms.polymer_flag Y +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 1 +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id B +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id SER +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 0 +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code ? +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id OG +_pdbx_unobs_or_zero_occ_atoms.label_alt_id ? +_pdbx_unobs_or_zero_occ_atoms.label_asym_id B +_pdbx_unobs_or_zero_occ_atoms.label_comp_id SER +_pdbx_unobs_or_zero_occ_atoms.label_seq_id 2 +_pdbx_unobs_or_zero_occ_atoms.label_atom_id OG +# +loop_ +_software.citation_id +_software.classification +_software.compiler_name +_software.compiler_version +_software.contact_author +_software.contact_author_email +_software.date +_software.description +_software.dependencies +_software.hardware +_software.language +_software.location +_software.mods +_software.name +_software.os +_software.os_version +_software.type +_software.version +_software.pdbx_ordinal +? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0124 1 +? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 +? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? SCALEPACK ? ? ? . 3 +? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 +# +_cell.angle_alpha 90.00 +_cell.angle_alpha_esd ? +_cell.angle_beta 105.09 +_cell.angle_beta_esd ? +_cell.angle_gamma 90.00 +_cell.angle_gamma_esd ? +_cell.entry_id 5JG9 +_cell.details ? +_cell.formula_units_Z ? +_cell.length_a 34.920 +_cell.length_a_esd ? +_cell.length_b 45.533 +_cell.length_b_esd ? +_cell.length_c 49.704 +_cell.length_c_esd ? +_cell.volume ? +_cell.volume_esd ? +_cell.Z_PDB 6 +_cell.reciprocal_angle_alpha ? +_cell.reciprocal_angle_beta ? +_cell.reciprocal_angle_gamma ? +_cell.reciprocal_angle_alpha_esd ? +_cell.reciprocal_angle_beta_esd ? +_cell.reciprocal_angle_gamma_esd ? +_cell.reciprocal_length_a ? +_cell.reciprocal_length_b ? +_cell.reciprocal_length_c ? +_cell.reciprocal_length_a_esd ? +_cell.reciprocal_length_b_esd ? +_cell.reciprocal_length_c_esd ? +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 5JG9 +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 4 +_symmetry.space_group_name_Hall ? +_symmetry.space_group_name_H-M 'P 1 21 1' +_symmetry.pdbx_full_space_group_name_H-M ? +# +_exptl.absorpt_coefficient_mu ? +_exptl.absorpt_correction_T_max ? +_exptl.absorpt_correction_T_min ? +_exptl.absorpt_correction_type ? +_exptl.absorpt_process_details ? +_exptl.entry_id 5JG9 +_exptl.crystals_number 1 +_exptl.details ? +_exptl.method 'X-RAY DIFFRACTION' +_exptl.method_details ? +# +_exptl_crystal.colour ? +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_Matthews 2.18 +_exptl_crystal.density_method ? +_exptl_crystal.density_percent_sol 43.48 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.id 1 +_exptl_crystal.preparation ? +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.colour_lustre ? +_exptl_crystal.colour_modifier ? +_exptl_crystal.colour_primary ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_esd ? +_exptl_crystal.density_meas_gt ? +_exptl_crystal.density_meas_lt ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_meas_temp_esd ? +_exptl_crystal.density_meas_temp_gt ? +_exptl_crystal.density_meas_temp_lt ? +_exptl_crystal.pdbx_crystal_image_url ? +_exptl_crystal.pdbx_crystal_image_format ? +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +# +_exptl_crystal_grow.apparatus ? +_exptl_crystal_grow.atmosphere ? +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.details ? +_exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' +_exptl_crystal_grow.method_ref ? +_exptl_crystal_grow.pH ? +_exptl_crystal_grow.pressure ? +_exptl_crystal_grow.pressure_esd ? +_exptl_crystal_grow.seeding ? +_exptl_crystal_grow.seeding_ref ? +_exptl_crystal_grow.temp 298 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.temp_esd ? +_exptl_crystal_grow.time ? +_exptl_crystal_grow.pdbx_details 'Peg, buffer 7' +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.ambient_environment ? +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.ambient_temp_esd ? +_diffrn.crystal_id 1 +_diffrn.crystal_support ? +_diffrn.crystal_treatment ? +_diffrn.details ? +_diffrn.id 1 +_diffrn.ambient_pressure ? +_diffrn.ambient_pressure_esd ? +_diffrn.ambient_pressure_gt ? +_diffrn.ambient_pressure_lt ? +_diffrn.ambient_temp_gt ? +_diffrn.ambient_temp_lt ? +# +_diffrn_detector.details ? +_diffrn_detector.detector CCD +_diffrn_detector.diffrn_id 1 +_diffrn_detector.type 'RIGAKU SATURN 944+' +_diffrn_detector.area_resol_mean ? +_diffrn_detector.dtime ? +_diffrn_detector.pdbx_frames_total ? +_diffrn_detector.pdbx_collection_time_total ? +_diffrn_detector.pdbx_collection_date 2014-04-08 +# +_diffrn_radiation.collimation ? +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.filter_edge ? +_diffrn_radiation.inhomogeneity ? +_diffrn_radiation.monochromator ? +_diffrn_radiation.polarisn_norm ? +_diffrn_radiation.polarisn_ratio ? +_diffrn_radiation.probe ? +_diffrn_radiation.type ? +_diffrn_radiation.xray_symbol ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_wavelength_list ? +_diffrn_radiation.pdbx_wavelength ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_analyzer ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1.54 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.current ? +_diffrn_source.details ? +_diffrn_source.diffrn_id 1 +_diffrn_source.power ? +_diffrn_source.size ? +_diffrn_source.source 'ROTATING ANODE' +_diffrn_source.target ? +_diffrn_source.type 'RIGAKU MICROMAX-007 HF' +_diffrn_source.voltage ? +_diffrn_source.take-off_angle ? +_diffrn_source.pdbx_wavelength_list 1.54 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_beamline ? +_diffrn_source.pdbx_synchrotron_site ? +# +_reflns.B_iso_Wilson_estimate ? +_reflns.entry_id 5JG9 +_reflns.data_reduction_details ? +_reflns.data_reduction_method ? +_reflns.d_resolution_high 2.09 +_reflns.d_resolution_low 50 +_reflns.details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.number_all ? +_reflns.number_obs 8734 +_reflns.observed_criterion ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.observed_criterion_I_max ? +_reflns.observed_criterion_I_min ? +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.percent_possible_obs 96.7 +_reflns.R_free_details ? +_reflns.Rmerge_F_all ? +_reflns.Rmerge_F_obs ? +_reflns.Friedel_coverage ? +_reflns.number_gt ? +_reflns.threshold_expression ? +_reflns.pdbx_redundancy 3.6 +_reflns.pdbx_Rmerge_I_obs 0.111 +_reflns.pdbx_Rmerge_I_all ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_av_sigmaI ? +_reflns.pdbx_netI_over_sigmaI 14.4 +_reflns.pdbx_res_netI_over_av_sigmaI_2 ? +_reflns.pdbx_res_netI_over_sigmaI_2 ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_d_res_high_opt ? +_reflns.pdbx_d_res_low_opt ? +_reflns.pdbx_d_res_opt_method ? +_reflns.phase_calculation_details ? +_reflns.pdbx_Rrim_I_all ? +_reflns.pdbx_Rpim_I_all ? +_reflns.pdbx_d_opt ? +_reflns.pdbx_number_measured_all ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.pdbx_CC_half ? +_reflns.pdbx_R_split ? +# +_refine.aniso_B[1][1] -0.61 +_refine.aniso_B[1][2] 0.00 +_refine.aniso_B[1][3] 0.40 +_refine.aniso_B[2][2] 2.12 +_refine.aniso_B[2][3] 0.00 +_refine.aniso_B[3][3] -1.51 +_refine.B_iso_max ? +_refine.B_iso_mean 35.892 +_refine.B_iso_min ? +_refine.correlation_coeff_Fo_to_Fc 0.949 +_refine.correlation_coeff_Fo_to_Fc_free 0.918 +_refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' +_refine.diff_density_max ? +_refine.diff_density_max_esd ? +_refine.diff_density_min ? +_refine.diff_density_min_esd ? +_refine.diff_density_rms ? +_refine.diff_density_rms_esd ? +_refine.entry_id 5JG9 +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.ls_abs_structure_details ? +_refine.ls_abs_structure_Flack ? +_refine.ls_abs_structure_Flack_esd ? +_refine.ls_abs_structure_Rogers ? +_refine.ls_abs_structure_Rogers_esd ? +_refine.ls_d_res_high 2.09 +_refine.ls_d_res_low 47.99 +_refine.ls_extinction_coef ? +_refine.ls_extinction_coef_esd ? +_refine.ls_extinction_expression ? +_refine.ls_extinction_method ? +_refine.ls_goodness_of_fit_all ? +_refine.ls_goodness_of_fit_all_esd ? +_refine.ls_goodness_of_fit_obs ? +_refine.ls_goodness_of_fit_obs_esd ? +_refine.ls_hydrogen_treatment ? +_refine.ls_matrix_type ? +_refine.ls_number_constraints ? +_refine.ls_number_parameters ? +_refine.ls_number_reflns_all ? +_refine.ls_number_reflns_obs 8310 +_refine.ls_number_reflns_R_free 412 +_refine.ls_number_reflns_R_work ? +_refine.ls_number_restraints ? +_refine.ls_percent_reflns_obs 96.59 +_refine.ls_percent_reflns_R_free 4.7 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.20306 +_refine.ls_R_factor_R_free 0.25084 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_R_factor_R_work 0.20067 +_refine.ls_R_Fsqd_factor_obs ? +_refine.ls_R_I_factor_obs ? +_refine.ls_redundancy_reflns_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_restrained_S_all ? +_refine.ls_restrained_S_obs ? +_refine.ls_shift_over_esd_max ? +_refine.ls_shift_over_esd_mean ? +_refine.ls_structure_factor_coef ? +_refine.ls_weighting_details ? +_refine.ls_weighting_scheme ? +_refine.ls_wR_factor_all ? +_refine.ls_wR_factor_obs ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.solvent_model_details ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.ls_R_factor_gt ? +_refine.ls_goodness_of_fit_gt ? +_refine.ls_goodness_of_fit_ref ? +_refine.ls_shift_over_su_max ? +_refine.ls_shift_over_su_max_lt ? +_refine.ls_shift_over_su_mean ? +_refine.ls_shift_over_su_mean_lt ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F ? +_refine.pdbx_ls_sigma_Fsqd ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_starting_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_overall_ESU_R 0.279 +_refine.pdbx_overall_ESU_R_Free 0.214 +_refine.pdbx_solvent_vdw_probe_radii 1.20 +_refine.pdbx_solvent_ion_probe_radii 0.80 +_refine.pdbx_solvent_shrinkage_radii 0.80 +_refine.pdbx_real_space_R ? +_refine.pdbx_density_correlation ? +_refine.pdbx_pd_number_of_powder_patterns ? +_refine.pdbx_pd_number_of_points ? +_refine.pdbx_pd_meas_number_of_points ? +_refine.pdbx_pd_proc_ls_prof_R_factor ? +_refine.pdbx_pd_proc_ls_prof_wR_factor ? +_refine.pdbx_pd_Marquardt_correlation_coeff ? +_refine.pdbx_pd_Fsqrd_R_factor ? +_refine.pdbx_pd_ls_matrix_band_width ? +_refine.pdbx_overall_phase_error ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_diffrn_id 1 +_refine.overall_SU_B 11.042 +_refine.overall_SU_ML 0.156 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_average_fsc_overall ? +_refine.pdbx_average_fsc_work ? +_refine.pdbx_average_fsc_free ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id 1 +_refine_hist.pdbx_number_atoms_protein 1204 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 7 +_refine_hist.number_atoms_solvent 68 +_refine_hist.number_atoms_total 1279 +_refine_hist.d_res_high 2.09 +_refine_hist.d_res_low 47.99 +# +loop_ +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.criterion +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.number +_refine_ls_restr.rejects +_refine_ls_restr.type +_refine_ls_restr.weight +_refine_ls_restr.pdbx_restraint_function +'X-RAY DIFFRACTION' ? 0.023 0.019 1249 ? r_bond_refined_d ? ? +'X-RAY DIFFRACTION' ? 0.012 0.020 1162 ? r_bond_other_d ? ? +'X-RAY DIFFRACTION' ? 2.199 1.960 1653 ? r_angle_refined_deg ? ? +'X-RAY DIFFRACTION' ? 2.078 3.000 2657 ? r_angle_other_deg ? ? +'X-RAY DIFFRACTION' ? 6.531 5.000 143 ? r_dihedral_angle_1_deg ? ? +'X-RAY DIFFRACTION' ? 29.923 21.889 90 ? r_dihedral_angle_2_deg ? ? +'X-RAY DIFFRACTION' ? 15.015 15.000 268 ? r_dihedral_angle_3_deg ? ? +'X-RAY DIFFRACTION' ? 20.045 15.000 32 ? r_dihedral_angle_4_deg ? ? +'X-RAY DIFFRACTION' ? 0.135 0.200 145 ? r_chiral_restr ? ? +'X-RAY DIFFRACTION' ? 0.014 0.020 1456 ? r_gen_planes_refined ? ? +'X-RAY DIFFRACTION' ? 0.010 0.020 340 ? r_gen_planes_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_other ? ? +'X-RAY DIFFRACTION' ? 1.599 2.003 563 ? r_mcbond_it ? ? +'X-RAY DIFFRACTION' ? 1.595 2.004 562 ? r_mcbond_other ? ? +'X-RAY DIFFRACTION' ? 2.302 2.988 700 ? r_mcangle_it ? ? +'X-RAY DIFFRACTION' ? 2.301 2.988 701 ? r_mcangle_other ? ? +'X-RAY DIFFRACTION' ? 2.122 2.382 686 ? r_scbond_it ? ? +'X-RAY DIFFRACTION' ? 2.122 2.381 686 ? r_scbond_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_scangle_it ? ? +'X-RAY DIFFRACTION' ? 3.345 3.461 951 ? r_scangle_other ? ? +'X-RAY DIFFRACTION' ? 5.740 15.736 1357 ? r_long_range_B_refined ? ? +'X-RAY DIFFRACTION' ? 5.738 15.753 1358 ? r_long_range_B_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_rigid_bond_restr ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_free ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_bonded ? ? +# +loop_ +_refine_ls_restr_ncs.pdbx_refine_id +_refine_ls_restr_ncs.dom_id +_refine_ls_restr_ncs.pdbx_ens_id +_refine_ls_restr_ncs.pdbx_ordinal +_refine_ls_restr_ncs.ncs_model_details +_refine_ls_restr_ncs.rms_dev_position +_refine_ls_restr_ncs.weight_position +_refine_ls_restr_ncs.rms_dev_B_iso +_refine_ls_restr_ncs.weight_B_iso +_refine_ls_restr_ncs.pdbx_auth_asym_id +_refine_ls_restr_ncs.pdbx_number +_refine_ls_restr_ncs.pdbx_type +_refine_ls_restr_ncs.pdbx_asym_id +_refine_ls_restr_ncs.pdbx_rms +_refine_ls_restr_ncs.pdbx_weight +'X-RAY DIFFRACTION' 1 1 1 ? 0.18 0.05 ? ? A 4820 'interatomic distance' ? ? ? +'X-RAY DIFFRACTION' 2 1 2 ? 0.18 0.05 ? ? B 4820 'interatomic distance' ? ? ? +'X-RAY DIFFRACTION' 1 2 3 ? 0.18 0.05 ? ? A 4934 'interatomic distance' ? ? ? +'X-RAY DIFFRACTION' 2 2 4 ? 0.18 0.05 ? ? C 4934 'interatomic distance' ? ? ? +'X-RAY DIFFRACTION' 1 3 5 ? 0.18 0.05 ? ? B 4820 'interatomic distance' ? ? ? +'X-RAY DIFFRACTION' 2 3 6 ? 0.18 0.05 ? ? C 4820 'interatomic distance' ? ? ? +# +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.d_res_high 2.093 +_refine_ls_shell.d_res_low 2.147 +_refine_ls_shell.number_reflns_all ? +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.number_reflns_R_free 37 +_refine_ls_shell.number_reflns_R_work 499 +_refine_ls_shell.percent_reflns_obs 80.84 +_refine_ls_shell.percent_reflns_R_free ? +_refine_ls_shell.R_factor_all ? +_refine_ls_shell.R_factor_obs ? +_refine_ls_shell.R_factor_R_free 0.284 +_refine_ls_shell.R_factor_R_free_error ? +_refine_ls_shell.R_factor_R_work 0.215 +_refine_ls_shell.redundancy_reflns_all ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.wR_factor_all ? +_refine_ls_shell.wR_factor_obs ? +_refine_ls_shell.wR_factor_R_free ? +_refine_ls_shell.wR_factor_R_work ? +_refine_ls_shell.pdbx_total_number_of_bins_used 20 +_refine_ls_shell.pdbx_phase_error ? +_refine_ls_shell.pdbx_fsc_work ? +_refine_ls_shell.pdbx_fsc_free ? +# +loop_ +_struct_ncs_dom.id +_struct_ncs_dom.details +_struct_ncs_dom.pdbx_ens_id +1 A 1 +2 B 1 +1 A 2 +2 C 2 +1 B 3 +2 C 3 +# +loop_ +_struct_ncs_dom_lim.pdbx_ens_id +_struct_ncs_dom_lim.dom_id +_struct_ncs_dom_lim.pdbx_component_id +_struct_ncs_dom_lim.beg_label_asym_id +_struct_ncs_dom_lim.beg_label_comp_id +_struct_ncs_dom_lim.beg_label_seq_id +_struct_ncs_dom_lim.beg_label_alt_id +_struct_ncs_dom_lim.end_label_asym_id +_struct_ncs_dom_lim.end_label_comp_id +_struct_ncs_dom_lim.end_label_seq_id +_struct_ncs_dom_lim.end_label_alt_id +_struct_ncs_dom_lim.beg_auth_asym_id +_struct_ncs_dom_lim.beg_auth_comp_id +_struct_ncs_dom_lim.beg_auth_seq_id +_struct_ncs_dom_lim.end_auth_asym_id +_struct_ncs_dom_lim.end_auth_comp_id +_struct_ncs_dom_lim.end_auth_seq_id +_struct_ncs_dom_lim.pdbx_refine_code +_struct_ncs_dom_lim.selection_details +1 1 0 A SER 2 . A ARG 46 . A SER 0 A ARG 44 0 ? +1 2 0 B SER 2 . B ARG 46 . B SER 0 B ARG 44 0 ? +2 1 0 A SER 2 . A ARG 46 . A SER 0 A ARG 44 0 ? +2 2 0 C SER 2 . C ARG 46 . C SER 0 C ARG 44 0 ? +3 1 0 B GLY 1 . B CYS 47 . B GLY -1 B CYS 45 0 ? +3 2 0 C GLY 1 . C CYS 47 . C GLY -1 C CYS 45 0 ? +# +loop_ +_struct_ncs_ens.id +_struct_ncs_ens.details +1 ? +2 ? +3 ? +# +_struct.entry_id 5JG9 +_struct.title 'Crystal structure of the de novo mini protein gEHEE_06' +_struct.pdbx_model_details ? +_struct.pdbx_formula_weight ? +_struct.pdbx_formula_weight_method ? +_struct.pdbx_model_type_details ? +_struct.pdbx_CASP_flag N +# +_struct_keywords.entry_id 5JG9 +_struct_keywords.text 'de novo design of hyper stable, disulfide-rich, DE NOVO PROTEIN' +_struct_keywords.pdbx_keywords 'DE NOVO PROTEIN' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 1 ? +C N N 1 ? +D N N 2 ? +E N N 3 ? +F N N 4 ? +G N N 4 ? +H N N 4 ? +# +_struct_ref.id 1 +_struct_ref.db_name PDB +_struct_ref.db_code 5JG9 +_struct_ref.pdbx_db_accession 5JG9 +_struct_ref.pdbx_db_isoform ? +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code ? +_struct_ref.pdbx_align_begin 1 +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 5JG9 A 1 ? 47 ? 5JG9 -1 ? 45 ? -1 45 +2 1 5JG9 B 1 ? 47 ? 5JG9 -1 ? 45 ? -1 45 +3 1 5JG9 C 1 ? 47 ? 5JG9 -1 ? 45 ? -1 45 +# +loop_ +_pdbx_struct_assembly.id +_pdbx_struct_assembly.details +_pdbx_struct_assembly.method_details +_pdbx_struct_assembly.oligomeric_details +_pdbx_struct_assembly.oligomeric_count +1 author_and_software_defined_assembly PISA monomeric 1 +2 author_and_software_defined_assembly PISA monomeric 1 +3 author_and_software_defined_assembly PISA monomeric 1 +# +loop_ +_pdbx_struct_assembly_gen.assembly_id +_pdbx_struct_assembly_gen.oper_expression +_pdbx_struct_assembly_gen.asym_id_list +1 1 A,F +2 1 B,D,G +3 1 C,E,H +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 AA1 ASP A 13 ? GLN A 28 ? ASP A 11 GLN A 26 1 ? 16 +HELX_P HELX_P2 AA2 ASP B 13 ? GLN B 28 ? ASP B 11 GLN B 26 1 ? 16 +HELX_P HELX_P3 AA3 ASP C 13 ? ASN C 29 ? ASP C 11 ASN C 27 1 ? 17 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +disulf1 disulf ? ? A CYS 10 SG ? ? ? 1_555 A CYS 40 SG ? ? A CYS 8 A CYS 38 1_555 ? ? ? ? ? ? ? 2.005 ? ? +disulf2 disulf ? ? A CYS 21 SG ? ? ? 1_555 A CYS 43 SG ? ? A CYS 19 A CYS 41 1_555 ? ? ? ? ? ? ? 2.076 ? ? +disulf3 disulf ? ? A CYS 30 SG ? ? ? 1_555 A CYS 47 SG ? ? A CYS 28 A CYS 45 1_555 ? ? ? ? ? ? ? 1.989 ? ? +disulf4 disulf ? ? B CYS 10 SG ? ? ? 1_555 B CYS 40 SG ? ? B CYS 8 B CYS 38 1_555 ? ? ? ? ? ? ? 2.021 ? ? +disulf5 disulf ? ? B CYS 21 SG ? ? ? 1_555 B CYS 43 SG ? ? B CYS 19 B CYS 41 1_555 ? ? ? ? ? ? ? 2.067 ? ? +disulf6 disulf ? ? B CYS 30 SG ? ? ? 1_555 B CYS 47 SG ? ? B CYS 28 B CYS 45 1_555 ? ? ? ? ? ? ? 1.975 ? ? +disulf7 disulf ? ? C CYS 10 SG ? ? ? 1_555 C CYS 40 SG ? ? C CYS 8 C CYS 38 1_555 ? ? ? ? ? ? ? 2.037 ? ? +disulf8 disulf ? ? C CYS 21 SG ? ? ? 1_555 C CYS 43 SG ? ? C CYS 19 C CYS 41 1_555 ? ? ? ? ? ? ? 2.063 ? ? +disulf9 disulf ? ? C CYS 30 SG ? ? ? 1_555 C CYS 47 SG ? ? C CYS 28 C CYS 45 1_555 ? ? ? ? ? ? ? 1.988 ? ? +# +_struct_conn_type.id disulf +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 CYS A 10 ? CYS A 40 ? CYS A 8 ? 1_555 CYS A 38 ? 1_555 SG SG . . . None 'Disulfide bridge' +2 CYS A 21 ? CYS A 43 ? CYS A 19 ? 1_555 CYS A 41 ? 1_555 SG SG . . . None 'Disulfide bridge' +3 CYS A 30 ? CYS A 47 ? CYS A 28 ? 1_555 CYS A 45 ? 1_555 SG SG . . . None 'Disulfide bridge' +4 CYS B 10 ? CYS B 40 ? CYS B 8 ? 1_555 CYS B 38 ? 1_555 SG SG . . . None 'Disulfide bridge' +5 CYS B 21 ? CYS B 43 ? CYS B 19 ? 1_555 CYS B 41 ? 1_555 SG SG . . . None 'Disulfide bridge' +6 CYS B 30 ? CYS B 47 ? CYS B 28 ? 1_555 CYS B 45 ? 1_555 SG SG . . . None 'Disulfide bridge' +7 CYS C 10 ? CYS C 40 ? CYS C 8 ? 1_555 CYS C 38 ? 1_555 SG SG . . . None 'Disulfide bridge' +8 CYS C 21 ? CYS C 43 ? CYS C 19 ? 1_555 CYS C 41 ? 1_555 SG SG . . . None 'Disulfide bridge' +9 CYS C 30 ? CYS C 47 ? CYS C 28 ? 1_555 CYS C 45 ? 1_555 SG SG . . . None 'Disulfide bridge' +# +_struct_sheet.id AA1 +_struct_sheet.type ? +_struct_sheet.number_strands 9 +_struct_sheet.details ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +AA1 1 2 ? anti-parallel +AA1 2 3 ? anti-parallel +AA1 3 4 ? anti-parallel +AA1 4 5 ? anti-parallel +AA1 5 6 ? anti-parallel +AA1 6 7 ? parallel +AA1 7 8 ? anti-parallel +AA1 8 9 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA1 1 GLN B 31 ? GLU B 37 ? GLN B 29 GLU B 35 +AA1 2 CYS B 40 ? CYS B 47 ? CYS B 38 CYS B 45 +AA1 3 SER B 2 ? LYS B 8 ? SER B 0 LYS B 6 +AA1 4 GLU A 3 ? LYS A 8 ? GLU A 1 LYS A 6 +AA1 5 CYS A 40 ? ARG A 46 ? CYS A 38 ARG A 44 +AA1 6 GLN A 31 ? GLU A 37 ? GLN A 29 GLU A 35 +AA1 7 GLU C 4 ? LYS C 8 ? GLU C 2 LYS C 6 +AA1 8 CYS C 40 ? ARG C 46 ? CYS C 38 ARG C 44 +AA1 9 GLN C 31 ? GLU C 37 ? GLN C 29 GLU C 35 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +AA1 1 2 N GLN B 33 ? N GLN B 31 O GLU B 44 ? O GLU B 42 +AA1 2 3 O ILE B 45 ? O ILE B 43 N ARG B 5 ? N ARG B 3 +AA1 3 4 O ARG B 6 ? O ARG B 4 N GLU A 4 ? N GLU A 2 +AA1 4 5 N ARG A 5 ? N ARG A 3 O ILE A 45 ? O ILE A 43 +AA1 5 6 O GLU A 44 ? O GLU A 42 N GLN A 33 ? N GLN A 31 +AA1 6 7 N LYS A 36 ? N LYS A 34 O ARG C 6 ? O ARG C 4 +AA1 7 8 N ARG C 5 ? N ARG C 3 O ILE C 45 ? O ILE C 43 +AA1 8 9 O GLU C 44 ? O GLU C 42 N GLN C 33 ? N GLN C 31 +# +loop_ +_struct_site.id +_struct_site.pdbx_evidence_code +_struct_site.pdbx_auth_asym_id +_struct_site.pdbx_auth_comp_id +_struct_site.pdbx_auth_seq_id +_struct_site.pdbx_auth_ins_code +_struct_site.pdbx_num_residues +_struct_site.details +AC1 Software B CL 101 ? 3 'binding site for residue CL B 101' +AC2 Software C GOL 101 ? 5 'binding site for residue GOL C 101' +# +loop_ +_struct_site_gen.id +_struct_site_gen.site_id +_struct_site_gen.pdbx_num_res +_struct_site_gen.label_comp_id +_struct_site_gen.label_asym_id +_struct_site_gen.label_seq_id +_struct_site_gen.pdbx_auth_ins_code +_struct_site_gen.auth_comp_id +_struct_site_gen.auth_asym_id +_struct_site_gen.auth_seq_id +_struct_site_gen.label_atom_id +_struct_site_gen.label_alt_id +_struct_site_gen.symmetry +_struct_site_gen.details +1 AC1 3 ARG B 9 ? ARG B 7 . ? 1_555 ? +2 AC1 3 GLY B 11 ? GLY B 9 . ? 1_555 ? +3 AC1 3 GLN B 12 ? GLN B 10 . ? 1_555 ? +4 AC2 5 GLY A 38 ? GLY A 36 . ? 1_555 ? +5 AC2 5 TYR C 7 ? TYR C 5 . ? 1_555 ? +6 AC2 5 LYS C 8 ? LYS C 6 . ? 1_555 ? +7 AC2 5 ARG C 9 ? ARG C 7 . ? 1_555 ? +8 AC2 5 HOH H . ? HOH C 206 . ? 1_555 ? +# +_pdbx_entry_details.entry_id 5JG9 +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 CD A ARG 4 ? ? NE A ARG 4 ? ? CZ A ARG 4 ? ? 132.85 123.60 9.25 1.40 N +2 1 NE A ARG 4 ? ? CZ A ARG 4 ? ? NH1 A ARG 4 ? ? 126.21 120.30 5.91 0.50 N +3 1 NE A ARG 4 ? ? CZ A ARG 4 ? ? NH2 A ARG 4 ? ? 113.38 120.30 -6.92 0.50 N +4 1 NE A ARG 7 ? ? CZ A ARG 7 ? ? NH1 A ARG 7 ? ? 123.54 120.30 3.24 0.50 N +5 1 NE A ARG 7 ? ? CZ A ARG 7 ? ? NH2 A ARG 7 ? ? 115.96 120.30 -4.34 0.50 N +6 1 NE A ARG 16 ? ? CZ A ARG 16 ? ? NH1 A ARG 16 ? ? 124.55 120.30 4.25 0.50 N +7 1 NE A ARG 16 ? ? CZ A ARG 16 ? ? NH2 A ARG 16 ? ? 116.48 120.30 -3.82 0.50 N +8 1 NE B ARG 7 ? ? CZ B ARG 7 ? ? NH2 B ARG 7 ? ? 116.92 120.30 -3.38 0.50 N +9 1 NE B ARG 25 ? ? CZ B ARG 25 ? ? NH1 B ARG 25 ? ? 124.32 120.30 4.02 0.50 N +10 1 NE B ARG 25 ? ? CZ B ARG 25 ? ? NH2 B ARG 25 ? ? 117.09 120.30 -3.21 0.50 N +11 1 NE C ARG 4 ? ? CZ C ARG 4 ? ? NH2 C ARG 4 ? ? 117.23 120.30 -3.07 0.50 N +12 1 NE C ARG 16 ? ? CZ C ARG 16 ? ? NH1 C ARG 16 ? ? 124.52 120.30 4.22 0.50 N +13 1 NE C ARG 16 ? ? CZ C ARG 16 ? ? NH2 C ARG 16 ? ? 116.67 120.30 -3.63 0.50 N +14 1 NE C ARG 44 ? ? CZ C ARG 44 ? ? NH1 C ARG 44 ? ? 124.38 120.30 4.08 0.50 N +# +loop_ +_pdbx_refine_tls.pdbx_refine_id +_pdbx_refine_tls.id +_pdbx_refine_tls.details +_pdbx_refine_tls.method +_pdbx_refine_tls.origin_x +_pdbx_refine_tls.origin_y +_pdbx_refine_tls.origin_z +_pdbx_refine_tls.T[1][1] +_pdbx_refine_tls.T[2][2] +_pdbx_refine_tls.T[3][3] +_pdbx_refine_tls.T[1][2] +_pdbx_refine_tls.T[1][3] +_pdbx_refine_tls.T[2][3] +_pdbx_refine_tls.L[1][1] +_pdbx_refine_tls.L[2][2] +_pdbx_refine_tls.L[3][3] +_pdbx_refine_tls.L[1][2] +_pdbx_refine_tls.L[1][3] +_pdbx_refine_tls.L[2][3] +_pdbx_refine_tls.S[1][1] +_pdbx_refine_tls.S[1][2] +_pdbx_refine_tls.S[1][3] +_pdbx_refine_tls.S[2][1] +_pdbx_refine_tls.S[2][2] +_pdbx_refine_tls.S[2][3] +_pdbx_refine_tls.S[3][1] +_pdbx_refine_tls.S[3][2] +_pdbx_refine_tls.S[3][3] +'X-RAY DIFFRACTION' 1 ? refined -5.1680 -10.0749 -3.1830 0.0152 0.1081 0.0681 -0.0272 0.0033 0.0305 10.7312 3.0466 3.5315 +-1.1532 -3.4117 0.1244 -0.0824 0.0100 0.1013 -0.0952 -0.0753 -0.4115 -0.0648 0.0876 0.1577 +'X-RAY DIFFRACTION' 2 ? refined -12.4749 -27.7360 -11.2320 0.0393 0.1097 0.0544 0.0176 -0.0154 -0.0049 3.4553 1.3783 11.4777 +0.6462 -2.9775 -2.1757 0.1180 0.1590 -0.2748 -0.1828 -0.0249 -0.0397 0.2533 -0.3724 -0.0932 +'X-RAY DIFFRACTION' 3 ? refined -21.2446 -5.9396 -16.3155 0.0412 0.1007 0.0041 0.0202 -0.0027 -0.0061 8.9611 3.7624 6.2766 +1.7585 -5.2451 -2.2373 -0.1049 -0.0399 -0.0200 0.0268 0.0498 0.0481 -0.2059 0.0439 0.0552 +# +loop_ +_pdbx_refine_tls_group.pdbx_refine_id +_pdbx_refine_tls_group.id +_pdbx_refine_tls_group.refine_tls_id +_pdbx_refine_tls_group.beg_auth_asym_id +_pdbx_refine_tls_group.beg_auth_seq_id +_pdbx_refine_tls_group.beg_label_asym_id +_pdbx_refine_tls_group.beg_label_seq_id +_pdbx_refine_tls_group.end_auth_asym_id +_pdbx_refine_tls_group.end_auth_seq_id +_pdbx_refine_tls_group.end_label_asym_id +_pdbx_refine_tls_group.end_label_seq_id +_pdbx_refine_tls_group.selection +_pdbx_refine_tls_group.selection_details +'X-RAY DIFFRACTION' 1 1 A 0 ? ? A 45 ? ? ? ? +'X-RAY DIFFRACTION' 2 2 B -1 ? ? B 45 ? ? ? ? +'X-RAY DIFFRACTION' 3 3 C -1 ? ? C 45 ? ? ? ? +# +_pdbx_unobs_or_zero_occ_residues.id 1 +_pdbx_unobs_or_zero_occ_residues.PDB_model_num 1 +_pdbx_unobs_or_zero_occ_residues.polymer_flag Y +_pdbx_unobs_or_zero_occ_residues.occupancy_flag 1 +_pdbx_unobs_or_zero_occ_residues.auth_asym_id A +_pdbx_unobs_or_zero_occ_residues.auth_comp_id GLY +_pdbx_unobs_or_zero_occ_residues.auth_seq_id -1 +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code ? +_pdbx_unobs_or_zero_occ_residues.label_asym_id A +_pdbx_unobs_or_zero_occ_residues.label_comp_id GLY +_pdbx_unobs_or_zero_occ_residues.label_seq_id 1 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ARG N N N N 1 +ARG CA C N S 2 +ARG C C N N 3 +ARG O O N N 4 +ARG CB C N N 5 +ARG CG C N N 6 +ARG CD C N N 7 +ARG NE N N N 8 +ARG CZ C N N 9 +ARG NH1 N N N 10 +ARG NH2 N N N 11 +ARG OXT O N N 12 +ARG H H N N 13 +ARG H2 H N N 14 +ARG HA H N N 15 +ARG HB2 H N N 16 +ARG HB3 H N N 17 +ARG HG2 H N N 18 +ARG HG3 H N N 19 +ARG HD2 H N N 20 +ARG HD3 H N N 21 +ARG HE H N N 22 +ARG HH11 H N N 23 +ARG HH12 H N N 24 +ARG HH21 H N N 25 +ARG HH22 H N N 26 +ARG HXT H N N 27 +ASN N N N N 28 +ASN CA C N S 29 +ASN C C N N 30 +ASN O O N N 31 +ASN CB C N N 32 +ASN CG C N N 33 +ASN OD1 O N N 34 +ASN ND2 N N N 35 +ASN OXT O N N 36 +ASN H H N N 37 +ASN H2 H N N 38 +ASN HA H N N 39 +ASN HB2 H N N 40 +ASN HB3 H N N 41 +ASN HD21 H N N 42 +ASN HD22 H N N 43 +ASN HXT H N N 44 +ASP N N N N 45 +ASP CA C N S 46 +ASP C C N N 47 +ASP O O N N 48 +ASP CB C N N 49 +ASP CG C N N 50 +ASP OD1 O N N 51 +ASP OD2 O N N 52 +ASP OXT O N N 53 +ASP H H N N 54 +ASP H2 H N N 55 +ASP HA H N N 56 +ASP HB2 H N N 57 +ASP HB3 H N N 58 +ASP HD2 H N N 59 +ASP HXT H N N 60 +CL CL CL N N 61 +CYS N N N N 62 +CYS CA C N R 63 +CYS C C N N 64 +CYS O O N N 65 +CYS CB C N N 66 +CYS SG S N N 67 +CYS OXT O N N 68 +CYS H H N N 69 +CYS H2 H N N 70 +CYS HA H N N 71 +CYS HB2 H N N 72 +CYS HB3 H N N 73 +CYS HG H N N 74 +CYS HXT H N N 75 +GLN N N N N 76 +GLN CA C N S 77 +GLN C C N N 78 +GLN O O N N 79 +GLN CB C N N 80 +GLN CG C N N 81 +GLN CD C N N 82 +GLN OE1 O N N 83 +GLN NE2 N N N 84 +GLN OXT O N N 85 +GLN H H N N 86 +GLN H2 H N N 87 +GLN HA H N N 88 +GLN HB2 H N N 89 +GLN HB3 H N N 90 +GLN HG2 H N N 91 +GLN HG3 H N N 92 +GLN HE21 H N N 93 +GLN HE22 H N N 94 +GLN HXT H N N 95 +GLU N N N N 96 +GLU CA C N S 97 +GLU C C N N 98 +GLU O O N N 99 +GLU CB C N N 100 +GLU CG C N N 101 +GLU CD C N N 102 +GLU OE1 O N N 103 +GLU OE2 O N N 104 +GLU OXT O N N 105 +GLU H H N N 106 +GLU H2 H N N 107 +GLU HA H N N 108 +GLU HB2 H N N 109 +GLU HB3 H N N 110 +GLU HG2 H N N 111 +GLU HG3 H N N 112 +GLU HE2 H N N 113 +GLU HXT H N N 114 +GLY N N N N 115 +GLY CA C N N 116 +GLY C C N N 117 +GLY O O N N 118 +GLY OXT O N N 119 +GLY H H N N 120 +GLY H2 H N N 121 +GLY HA2 H N N 122 +GLY HA3 H N N 123 +GLY HXT H N N 124 +GOL C1 C N N 125 +GOL O1 O N N 126 +GOL C2 C N N 127 +GOL O2 O N N 128 +GOL C3 C N N 129 +GOL O3 O N N 130 +GOL H11 H N N 131 +GOL H12 H N N 132 +GOL HO1 H N N 133 +GOL H2 H N N 134 +GOL HO2 H N N 135 +GOL H31 H N N 136 +GOL H32 H N N 137 +GOL HO3 H N N 138 +HOH O O N N 139 +HOH H1 H N N 140 +HOH H2 H N N 141 +ILE N N N N 142 +ILE CA C N S 143 +ILE C C N N 144 +ILE O O N N 145 +ILE CB C N S 146 +ILE CG1 C N N 147 +ILE CG2 C N N 148 +ILE CD1 C N N 149 +ILE OXT O N N 150 +ILE H H N N 151 +ILE H2 H N N 152 +ILE HA H N N 153 +ILE HB H N N 154 +ILE HG12 H N N 155 +ILE HG13 H N N 156 +ILE HG21 H N N 157 +ILE HG22 H N N 158 +ILE HG23 H N N 159 +ILE HD11 H N N 160 +ILE HD12 H N N 161 +ILE HD13 H N N 162 +ILE HXT H N N 163 +LYS N N N N 164 +LYS CA C N S 165 +LYS C C N N 166 +LYS O O N N 167 +LYS CB C N N 168 +LYS CG C N N 169 +LYS CD C N N 170 +LYS CE C N N 171 +LYS NZ N N N 172 +LYS OXT O N N 173 +LYS H H N N 174 +LYS H2 H N N 175 +LYS HA H N N 176 +LYS HB2 H N N 177 +LYS HB3 H N N 178 +LYS HG2 H N N 179 +LYS HG3 H N N 180 +LYS HD2 H N N 181 +LYS HD3 H N N 182 +LYS HE2 H N N 183 +LYS HE3 H N N 184 +LYS HZ1 H N N 185 +LYS HZ2 H N N 186 +LYS HZ3 H N N 187 +LYS HXT H N N 188 +SER N N N N 189 +SER CA C N S 190 +SER C C N N 191 +SER O O N N 192 +SER CB C N N 193 +SER OG O N N 194 +SER OXT O N N 195 +SER H H N N 196 +SER H2 H N N 197 +SER HA H N N 198 +SER HB2 H N N 199 +SER HB3 H N N 200 +SER HG H N N 201 +SER HXT H N N 202 +TYR N N N N 203 +TYR CA C N S 204 +TYR C C N N 205 +TYR O O N N 206 +TYR CB C N N 207 +TYR CG C Y N 208 +TYR CD1 C Y N 209 +TYR CD2 C Y N 210 +TYR CE1 C Y N 211 +TYR CE2 C Y N 212 +TYR CZ C Y N 213 +TYR OH O N N 214 +TYR OXT O N N 215 +TYR H H N N 216 +TYR H2 H N N 217 +TYR HA H N N 218 +TYR HB2 H N N 219 +TYR HB3 H N N 220 +TYR HD1 H N N 221 +TYR HD2 H N N 222 +TYR HE1 H N N 223 +TYR HE2 H N N 224 +TYR HH H N N 225 +TYR HXT H N N 226 +VAL N N N N 227 +VAL CA C N S 228 +VAL C C N N 229 +VAL O O N N 230 +VAL CB C N N 231 +VAL CG1 C N N 232 +VAL CG2 C N N 233 +VAL OXT O N N 234 +VAL H H N N 235 +VAL H2 H N N 236 +VAL HA H N N 237 +VAL HB H N N 238 +VAL HG11 H N N 239 +VAL HG12 H N N 240 +VAL HG13 H N N 241 +VAL HG21 H N N 242 +VAL HG22 H N N 243 +VAL HG23 H N N 244 +VAL HXT H N N 245 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ARG N CA sing N N 1 +ARG N H sing N N 2 +ARG N H2 sing N N 3 +ARG CA C sing N N 4 +ARG CA CB sing N N 5 +ARG CA HA sing N N 6 +ARG C O doub N N 7 +ARG C OXT sing N N 8 +ARG CB CG sing N N 9 +ARG CB HB2 sing N N 10 +ARG CB HB3 sing N N 11 +ARG CG CD sing N N 12 +ARG CG HG2 sing N N 13 +ARG CG HG3 sing N N 14 +ARG CD NE sing N N 15 +ARG CD HD2 sing N N 16 +ARG CD HD3 sing N N 17 +ARG NE CZ sing N N 18 +ARG NE HE sing N N 19 +ARG CZ NH1 sing N N 20 +ARG CZ NH2 doub N N 21 +ARG NH1 HH11 sing N N 22 +ARG NH1 HH12 sing N N 23 +ARG NH2 HH21 sing N N 24 +ARG NH2 HH22 sing N N 25 +ARG OXT HXT sing N N 26 +ASN N CA sing N N 27 +ASN N H sing N N 28 +ASN N H2 sing N N 29 +ASN CA C sing N N 30 +ASN CA CB sing N N 31 +ASN CA HA sing N N 32 +ASN C O doub N N 33 +ASN C OXT sing N N 34 +ASN CB CG sing N N 35 +ASN CB HB2 sing N N 36 +ASN CB HB3 sing N N 37 +ASN CG OD1 doub N N 38 +ASN CG ND2 sing N N 39 +ASN ND2 HD21 sing N N 40 +ASN ND2 HD22 sing N N 41 +ASN OXT HXT sing N N 42 +ASP N CA sing N N 43 +ASP N H sing N N 44 +ASP N H2 sing N N 45 +ASP CA C sing N N 46 +ASP CA CB sing N N 47 +ASP CA HA sing N N 48 +ASP C O doub N N 49 +ASP C OXT sing N N 50 +ASP CB CG sing N N 51 +ASP CB HB2 sing N N 52 +ASP CB HB3 sing N N 53 +ASP CG OD1 doub N N 54 +ASP CG OD2 sing N N 55 +ASP OD2 HD2 sing N N 56 +ASP OXT HXT sing N N 57 +CYS N CA sing N N 58 +CYS N H sing N N 59 +CYS N H2 sing N N 60 +CYS CA C sing N N 61 +CYS CA CB sing N N 62 +CYS CA HA sing N N 63 +CYS C O doub N N 64 +CYS C OXT sing N N 65 +CYS CB SG sing N N 66 +CYS CB HB2 sing N N 67 +CYS CB HB3 sing N N 68 +CYS SG HG sing N N 69 +CYS OXT HXT sing N N 70 +GLN N CA sing N N 71 +GLN N H sing N N 72 +GLN N H2 sing N N 73 +GLN CA C sing N N 74 +GLN CA CB sing N N 75 +GLN CA HA sing N N 76 +GLN C O doub N N 77 +GLN C OXT sing N N 78 +GLN CB CG sing N N 79 +GLN CB HB2 sing N N 80 +GLN CB HB3 sing N N 81 +GLN CG CD sing N N 82 +GLN CG HG2 sing N N 83 +GLN CG HG3 sing N N 84 +GLN CD OE1 doub N N 85 +GLN CD NE2 sing N N 86 +GLN NE2 HE21 sing N N 87 +GLN NE2 HE22 sing N N 88 +GLN OXT HXT sing N N 89 +GLU N CA sing N N 90 +GLU N H sing N N 91 +GLU N H2 sing N N 92 +GLU CA C sing N N 93 +GLU CA CB sing N N 94 +GLU CA HA sing N N 95 +GLU C O doub N N 96 +GLU C OXT sing N N 97 +GLU CB CG sing N N 98 +GLU CB HB2 sing N N 99 +GLU CB HB3 sing N N 100 +GLU CG CD sing N N 101 +GLU CG HG2 sing N N 102 +GLU CG HG3 sing N N 103 +GLU CD OE1 doub N N 104 +GLU CD OE2 sing N N 105 +GLU OE2 HE2 sing N N 106 +GLU OXT HXT sing N N 107 +GLY N CA sing N N 108 +GLY N H sing N N 109 +GLY N H2 sing N N 110 +GLY CA C sing N N 111 +GLY CA HA2 sing N N 112 +GLY CA HA3 sing N N 113 +GLY C O doub N N 114 +GLY C OXT sing N N 115 +GLY OXT HXT sing N N 116 +GOL C1 O1 sing N N 117 +GOL C1 C2 sing N N 118 +GOL C1 H11 sing N N 119 +GOL C1 H12 sing N N 120 +GOL O1 HO1 sing N N 121 +GOL C2 O2 sing N N 122 +GOL C2 C3 sing N N 123 +GOL C2 H2 sing N N 124 +GOL O2 HO2 sing N N 125 +GOL C3 O3 sing N N 126 +GOL C3 H31 sing N N 127 +GOL C3 H32 sing N N 128 +GOL O3 HO3 sing N N 129 +HOH O H1 sing N N 130 +HOH O H2 sing N N 131 +ILE N CA sing N N 132 +ILE N H sing N N 133 +ILE N H2 sing N N 134 +ILE CA C sing N N 135 +ILE CA CB sing N N 136 +ILE CA HA sing N N 137 +ILE C O doub N N 138 +ILE C OXT sing N N 139 +ILE CB CG1 sing N N 140 +ILE CB CG2 sing N N 141 +ILE CB HB sing N N 142 +ILE CG1 CD1 sing N N 143 +ILE CG1 HG12 sing N N 144 +ILE CG1 HG13 sing N N 145 +ILE CG2 HG21 sing N N 146 +ILE CG2 HG22 sing N N 147 +ILE CG2 HG23 sing N N 148 +ILE CD1 HD11 sing N N 149 +ILE CD1 HD12 sing N N 150 +ILE CD1 HD13 sing N N 151 +ILE OXT HXT sing N N 152 +LYS N CA sing N N 153 +LYS N H sing N N 154 +LYS N H2 sing N N 155 +LYS CA C sing N N 156 +LYS CA CB sing N N 157 +LYS CA HA sing N N 158 +LYS C O doub N N 159 +LYS C OXT sing N N 160 +LYS CB CG sing N N 161 +LYS CB HB2 sing N N 162 +LYS CB HB3 sing N N 163 +LYS CG CD sing N N 164 +LYS CG HG2 sing N N 165 +LYS CG HG3 sing N N 166 +LYS CD CE sing N N 167 +LYS CD HD2 sing N N 168 +LYS CD HD3 sing N N 169 +LYS CE NZ sing N N 170 +LYS CE HE2 sing N N 171 +LYS CE HE3 sing N N 172 +LYS NZ HZ1 sing N N 173 +LYS NZ HZ2 sing N N 174 +LYS NZ HZ3 sing N N 175 +LYS OXT HXT sing N N 176 +SER N CA sing N N 177 +SER N H sing N N 178 +SER N H2 sing N N 179 +SER CA C sing N N 180 +SER CA CB sing N N 181 +SER CA HA sing N N 182 +SER C O doub N N 183 +SER C OXT sing N N 184 +SER CB OG sing N N 185 +SER CB HB2 sing N N 186 +SER CB HB3 sing N N 187 +SER OG HG sing N N 188 +SER OXT HXT sing N N 189 +TYR N CA sing N N 190 +TYR N H sing N N 191 +TYR N H2 sing N N 192 +TYR CA C sing N N 193 +TYR CA CB sing N N 194 +TYR CA HA sing N N 195 +TYR C O doub N N 196 +TYR C OXT sing N N 197 +TYR CB CG sing N N 198 +TYR CB HB2 sing N N 199 +TYR CB HB3 sing N N 200 +TYR CG CD1 doub Y N 201 +TYR CG CD2 sing Y N 202 +TYR CD1 CE1 sing Y N 203 +TYR CD1 HD1 sing N N 204 +TYR CD2 CE2 doub Y N 205 +TYR CD2 HD2 sing N N 206 +TYR CE1 CZ doub Y N 207 +TYR CE1 HE1 sing N N 208 +TYR CE2 CZ sing Y N 209 +TYR CE2 HE2 sing N N 210 +TYR CZ OH sing N N 211 +TYR OH HH sing N N 212 +TYR OXT HXT sing N N 213 +VAL N CA sing N N 214 +VAL N H sing N N 215 +VAL N H2 sing N N 216 +VAL CA C sing N N 217 +VAL CA CB sing N N 218 +VAL CA HA sing N N 219 +VAL C O doub N N 220 +VAL C OXT sing N N 221 +VAL CB CG1 sing N N 222 +VAL CB CG2 sing N N 223 +VAL CB HB sing N N 224 +VAL CG1 HG11 sing N N 225 +VAL CG1 HG12 sing N N 226 +VAL CG1 HG13 sing N N 227 +VAL CG2 HG21 sing N N 228 +VAL CG2 HG22 sing N N 229 +VAL CG2 HG23 sing N N 230 +VAL OXT HXT sing N N 231 +# +_atom_sites.entry_id 5JG9 +_atom_sites.fract_transf_matrix[1][1] 0.028637 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.007723 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.021962 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.020838 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +CL +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . SER A 1 2 ? -2.361 -21.011 -15.661 1.00 55.66 ? 0 SER A N 1 +ATOM 2 C CA . SER A 1 2 ? -3.505 -21.987 -15.659 1.00 58.16 ? 0 SER A CA 1 +ATOM 3 C C . SER A 1 2 ? -4.281 -21.908 -14.341 1.00 55.53 ? 0 SER A C 1 +ATOM 4 O O . SER A 1 2 ? -5.517 -21.948 -14.364 1.00 56.41 ? 0 SER A O 1 +ATOM 5 C CB . SER A 1 2 ? -2.942 -23.378 -15.924 1.00 62.49 ? 0 SER A CB 1 +ATOM 6 O OG . SER A 1 2 ? -3.821 -24.277 -16.540 1.00 67.28 ? 0 SER A OG 1 +ATOM 7 N N . GLU A 1 3 ? -3.578 -21.702 -13.205 1.00 51.97 ? 1 GLU A N 1 +ATOM 8 C CA . GLU A 1 3 ? -4.227 -21.525 -11.888 1.00 50.85 ? 1 GLU A CA 1 +ATOM 9 C C . GLU A 1 3 ? -4.385 -20.079 -11.342 1.00 45.68 ? 1 GLU A C 1 +ATOM 10 O O . GLU A 1 3 ? -3.414 -19.351 -11.178 1.00 42.71 ? 1 GLU A O 1 +ATOM 11 C CB . GLU A 1 3 ? -3.533 -22.317 -10.804 1.00 53.97 ? 1 GLU A CB 1 +ATOM 12 C CG . GLU A 1 3 ? -4.296 -22.348 -9.462 1.00 54.14 ? 1 GLU A CG 1 +ATOM 13 C CD . GLU A 1 3 ? -3.401 -22.556 -8.222 1.00 56.98 ? 1 GLU A CD 1 +ATOM 14 O OE1 . GLU A 1 3 ? -2.130 -22.653 -8.364 1.00 61.15 ? 1 GLU A OE1 1 +ATOM 15 O OE2 . GLU A 1 3 ? -3.969 -22.545 -7.081 1.00 55.63 ? 1 GLU A OE2 1 +ATOM 16 N N . GLU A 1 4 ? -5.618 -19.722 -10.935 1.00 42.00 ? 2 GLU A N 1 +ATOM 17 C CA . GLU A 1 4 ? -5.940 -18.424 -10.459 1.00 38.53 ? 2 GLU A CA 1 +ATOM 18 C C . GLU A 1 4 ? -6.654 -18.563 -9.095 1.00 35.90 ? 2 GLU A C 1 +ATOM 19 O O . GLU A 1 4 ? -7.630 -19.342 -8.989 1.00 34.52 ? 2 GLU A O 1 +ATOM 20 C CB . GLU A 1 4 ? -6.899 -17.860 -11.507 1.00 44.26 ? 2 GLU A CB 1 +ATOM 21 C CG . GLU A 1 4 ? -7.029 -16.352 -11.688 1.00 46.56 ? 2 GLU A CG 1 +ATOM 22 C CD . GLU A 1 4 ? -7.462 -16.049 -13.144 1.00 51.91 ? 2 GLU A CD 1 +ATOM 23 O OE1 . GLU A 1 4 ? -8.484 -15.381 -13.417 1.00 56.84 ? 2 GLU A OE1 1 +ATOM 24 O OE2 . GLU A 1 4 ? -6.760 -16.486 -14.022 1.00 55.81 ? 2 GLU A OE2 1 +ATOM 25 N N . ARG A 1 5 ? -6.183 -17.833 -8.091 1.00 30.83 ? 3 ARG A N 1 +ATOM 26 C CA . ARG A 1 5 ? -6.798 -17.856 -6.730 1.00 31.84 ? 3 ARG A CA 1 +ATOM 27 C C . ARG A 1 5 ? -7.280 -16.467 -6.469 1.00 28.20 ? 3 ARG A C 1 +ATOM 28 O O . ARG A 1 5 ? -6.550 -15.521 -6.722 1.00 25.46 ? 3 ARG A O 1 +ATOM 29 C CB . ARG A 1 5 ? -5.812 -18.208 -5.607 1.00 33.98 ? 3 ARG A CB 1 +ATOM 30 C CG . ARG A 1 5 ? -5.094 -19.545 -5.749 1.00 36.93 ? 3 ARG A CG 1 +ATOM 31 C CD . ARG A 1 5 ? -3.734 -19.490 -5.019 1.00 39.78 ? 3 ARG A CD 1 +ATOM 32 N NE . ARG A 1 5 ? -2.689 -20.399 -5.519 1.00 45.27 ? 3 ARG A NE 1 +ATOM 33 C CZ . ARG A 1 5 ? -1.593 -20.845 -4.844 1.00 48.51 ? 3 ARG A CZ 1 +ATOM 34 N NH1 . ARG A 1 5 ? -1.341 -20.477 -3.588 1.00 45.84 ? 3 ARG A NH1 1 +ATOM 35 N NH2 . ARG A 1 5 ? -0.746 -21.728 -5.445 1.00 50.08 ? 3 ARG A NH2 1 +ATOM 36 N N . ARG A 1 6 ? -8.504 -16.357 -5.971 1.00 25.86 ? 4 ARG A N 1 +ATOM 37 C CA . ARG A 1 6 ? -9.085 -15.116 -5.509 1.00 24.78 ? 4 ARG A CA 1 +ATOM 38 C C . ARG A 1 6 ? -9.547 -15.173 -4.083 1.00 23.15 ? 4 ARG A C 1 +ATOM 39 O O . ARG A 1 6 ? -10.257 -16.120 -3.705 1.00 21.86 ? 4 ARG A O 1 +ATOM 40 C CB . ARG A 1 6 ? -10.323 -14.826 -6.337 1.00 27.82 ? 4 ARG A CB 1 +ATOM 41 C CG . ARG A 1 6 ? -10.178 -14.417 -7.765 1.00 29.17 ? 4 ARG A CG 1 +ATOM 42 C CD . ARG A 1 6 ? -11.652 -14.126 -8.144 1.00 32.20 ? 4 ARG A CD 1 +ATOM 43 N NE . ARG A 1 6 ? -11.628 -13.042 -9.068 1.00 35.70 ? 4 ARG A NE 1 +ATOM 44 C CZ . ARG A 1 6 ? -12.200 -11.833 -9.067 1.00 33.06 ? 4 ARG A CZ 1 +ATOM 45 N NH1 . ARG A 1 6 ? -13.106 -11.399 -8.209 1.00 30.56 ? 4 ARG A NH1 1 +ATOM 46 N NH2 . ARG A 1 6 ? -11.817 -11.071 -10.076 1.00 33.52 ? 4 ARG A NH2 1 +ATOM 47 N N . TYR A 1 7 ? -9.135 -14.170 -3.290 1.00 21.90 ? 5 TYR A N 1 +ATOM 48 C CA . TYR A 1 7 ? -9.499 -14.096 -1.837 1.00 23.69 ? 5 TYR A CA 1 +ATOM 49 C C . TYR A 1 7 ? -10.324 -12.793 -1.703 1.00 22.28 ? 5 TYR A C 1 +ATOM 50 O O . TYR A 1 7 ? -9.766 -11.720 -1.838 1.00 18.61 ? 5 TYR A O 1 +ATOM 51 C CB . TYR A 1 7 ? -8.261 -13.988 -0.991 1.00 26.01 ? 5 TYR A CB 1 +ATOM 52 C CG . TYR A 1 7 ? -7.252 -15.129 -1.139 1.00 26.75 ? 5 TYR A CG 1 +ATOM 53 C CD1 . TYR A 1 7 ? -7.354 -16.282 -0.330 1.00 30.08 ? 5 TYR A CD1 1 +ATOM 54 C CD2 . TYR A 1 7 ? -6.322 -15.087 -2.073 1.00 28.39 ? 5 TYR A CD2 1 +ATOM 55 C CE1 . TYR A 1 7 ? -6.470 -17.334 -0.484 1.00 31.21 ? 5 TYR A CE1 1 +ATOM 56 C CE2 . TYR A 1 7 ? -5.398 -16.119 -2.238 1.00 28.78 ? 5 TYR A CE2 1 +ATOM 57 C CZ . TYR A 1 7 ? -5.498 -17.230 -1.453 1.00 30.25 ? 5 TYR A CZ 1 +ATOM 58 O OH . TYR A 1 7 ? -4.617 -18.260 -1.595 1.00 32.10 ? 5 TYR A OH 1 +ATOM 59 N N . LYS A 1 8 ? -11.641 -12.901 -1.564 1.00 22.47 ? 6 LYS A N 1 +ATOM 60 C CA . LYS A 1 8 ? -12.512 -11.739 -1.403 1.00 22.90 ? 6 LYS A CA 1 +ATOM 61 C C . LYS A 1 8 ? -12.462 -11.348 0.082 1.00 23.64 ? 6 LYS A C 1 +ATOM 62 O O . LYS A 1 8 ? -12.685 -12.181 0.933 1.00 21.08 ? 6 LYS A O 1 +ATOM 63 C CB . LYS A 1 8 ? -13.948 -11.980 -1.883 1.00 27.44 ? 6 LYS A CB 1 +ATOM 64 C CG . LYS A 1 8 ? -14.809 -10.697 -1.991 1.00 29.30 ? 6 LYS A CG 1 +ATOM 65 C CD . LYS A 1 8 ? -16.269 -10.907 -2.373 1.00 33.09 ? 6 LYS A CD 1 +ATOM 66 C CE . LYS A 1 8 ? -16.978 -11.917 -1.458 1.00 36.03 ? 6 LYS A CE 1 +ATOM 67 N NZ . LYS A 1 8 ? -18.281 -12.239 -2.043 1.00 40.36 ? 6 LYS A NZ 1 +ATOM 68 N N . ARG A 1 9 ? -12.276 -10.051 0.379 1.00 24.76 ? 7 ARG A N 1 +ATOM 69 C CA . ARG A 1 9 ? -12.016 -9.609 1.777 1.00 25.32 ? 7 ARG A CA 1 +ATOM 70 C C . ARG A 1 9 ? -12.916 -8.487 2.232 1.00 22.88 ? 7 ARG A C 1 +ATOM 71 O O . ARG A 1 9 ? -12.438 -7.420 2.552 1.00 20.92 ? 7 ARG A O 1 +ATOM 72 C CB . ARG A 1 9 ? -10.532 -9.225 1.945 1.00 25.53 ? 7 ARG A CB 1 +ATOM 73 C CG . ARG A 1 9 ? -9.587 -10.403 1.726 1.00 27.71 ? 7 ARG A CG 1 +ATOM 74 C CD . ARG A 1 9 ? -9.797 -11.359 2.866 1.00 30.04 ? 7 ARG A CD 1 +ATOM 75 N NE . ARG A 1 9 ? -8.885 -12.470 2.867 1.00 33.49 ? 7 ARG A NE 1 +ATOM 76 C CZ . ARG A 1 9 ? -9.199 -13.754 2.592 1.00 38.11 ? 7 ARG A CZ 1 +ATOM 77 N NH1 . ARG A 1 9 ? -10.454 -14.161 2.153 1.00 35.33 ? 7 ARG A NH1 1 +ATOM 78 N NH2 . ARG A 1 9 ? -8.190 -14.633 2.664 1.00 42.50 ? 7 ARG A NH2 1 +ATOM 79 N N . CYS A 1 10 ? -14.224 -8.735 2.220 1.00 24.20 ? 8 CYS A N 1 +ATOM 80 C CA . CYS A 1 10 ? -15.198 -7.703 2.598 1.00 22.35 ? 8 CYS A CA 1 +ATOM 81 C C . CYS A 1 10 ? -14.985 -7.209 4.039 1.00 22.73 ? 8 CYS A C 1 +ATOM 82 O O . CYS A 1 10 ? -15.369 -6.087 4.375 1.00 22.41 ? 8 CYS A O 1 +ATOM 83 C CB . CYS A 1 10 ? -16.633 -8.229 2.405 1.00 23.49 ? 8 CYS A CB 1 +ATOM 84 S SG . CYS A 1 10 ? -17.097 -8.622 0.675 1.00 24.21 ? 8 CYS A SG 1 +ATOM 85 N N . GLY A 1 11 ? -14.392 -8.049 4.890 1.00 21.49 ? 9 GLY A N 1 +ATOM 86 C CA . GLY A 1 11 ? -14.174 -7.664 6.348 1.00 24.82 ? 9 GLY A CA 1 +ATOM 87 C C . GLY A 1 11 ? -12.889 -6.889 6.546 1.00 26.30 ? 9 GLY A C 1 +ATOM 88 O O . GLY A 1 11 ? -12.443 -6.782 7.647 1.00 26.98 ? 9 GLY A O 1 +ATOM 89 N N . GLN A 1 12 ? -12.257 -6.418 5.463 1.00 25.97 ? 10 GLN A N 1 +ATOM 90 C CA . GLN A 1 12 ? -11.035 -5.643 5.551 1.00 29.48 ? 10 GLN A CA 1 +ATOM 91 C C . GLN A 1 12 ? -11.164 -4.436 4.661 1.00 30.87 ? 10 GLN A C 1 +ATOM 92 O O . GLN A 1 12 ? -11.738 -4.484 3.599 1.00 30.36 ? 10 GLN A O 1 +ATOM 93 C CB . GLN A 1 12 ? -9.890 -6.490 5.033 1.00 28.69 ? 10 GLN A CB 1 +ATOM 94 C CG . GLN A 1 12 ? -9.699 -7.816 5.782 1.00 29.66 ? 10 GLN A CG 1 +ATOM 95 C CD . GLN A 1 12 ? -8.457 -8.651 5.442 1.00 29.36 ? 10 GLN A CD 1 +ATOM 96 O OE1 . GLN A 1 12 ? -8.111 -9.621 6.174 1.00 35.50 ? 10 GLN A OE1 1 +ATOM 97 N NE2 . GLN A 1 12 ? -7.867 -8.391 4.335 1.00 27.97 ? 10 GLN A NE2 1 +ATOM 98 N N . ASP A 1 13 ? -10.499 -3.362 5.060 1.00 36.31 ? 11 ASP A N 1 +ATOM 99 C CA . ASP A 1 13 ? -10.293 -2.202 4.163 1.00 38.24 ? 11 ASP A CA 1 +ATOM 100 C C . ASP A 1 13 ? -9.262 -2.413 3.028 1.00 35.57 ? 11 ASP A C 1 +ATOM 101 O O . ASP A 1 13 ? -8.435 -3.369 2.988 1.00 34.02 ? 11 ASP A O 1 +ATOM 102 C CB . ASP A 1 13 ? -10.033 -0.894 4.942 1.00 44.34 ? 11 ASP A CB 1 +ATOM 103 C CG . ASP A 1 13 ? -8.643 -0.781 5.569 1.00 48.21 ? 11 ASP A CG 1 +ATOM 104 O OD1 . ASP A 1 13 ? -8.492 0.144 6.393 1.00 53.09 ? 11 ASP A OD1 1 +ATOM 105 O OD2 . ASP A 1 13 ? -7.726 -1.554 5.254 1.00 50.83 ? 11 ASP A OD2 1 +ATOM 106 N N . GLU A 1 14 ? -9.369 -1.522 2.054 1.00 36.44 ? 12 GLU A N 1 +ATOM 107 C CA . GLU A 1 14 ? -8.583 -1.617 0.845 1.00 37.54 ? 12 GLU A CA 1 +ATOM 108 C C . GLU A 1 14 ? -7.069 -1.659 1.190 1.00 39.40 ? 12 GLU A C 1 +ATOM 109 O O . GLU A 1 14 ? -6.306 -2.413 0.633 1.00 39.04 ? 12 GLU A O 1 +ATOM 110 C CB . GLU A 1 14 ? -8.870 -0.398 -0.010 1.00 40.58 ? 12 GLU A CB 1 +ATOM 111 C CG . GLU A 1 14 ? -8.058 -0.362 -1.297 1.00 41.76 ? 12 GLU A CG 1 +ATOM 112 C CD . GLU A 1 14 ? -8.295 0.897 -2.098 1.00 43.77 ? 12 GLU A CD 1 +ATOM 113 O OE1 . GLU A 1 14 ? -9.045 1.782 -1.646 1.00 48.18 ? 12 GLU A OE1 1 +ATOM 114 O OE2 . GLU A 1 14 ? -7.733 0.981 -3.183 1.00 45.35 ? 12 GLU A OE2 1 +ATOM 115 N N . GLU A 1 15 ? -6.662 -0.827 2.144 1.00 42.13 ? 13 GLU A N 1 +ATOM 116 C CA . GLU A 1 15 ? -5.237 -0.654 2.484 1.00 45.66 ? 13 GLU A CA 1 +ATOM 117 C C . GLU A 1 15 ? -4.646 -2.007 2.943 1.00 41.47 ? 13 GLU A C 1 +ATOM 118 O O . GLU A 1 15 ? -3.662 -2.478 2.390 1.00 40.07 ? 13 GLU A O 1 +ATOM 119 C CB . GLU A 1 15 ? -5.104 0.494 3.523 1.00 50.69 ? 13 GLU A CB 1 +ATOM 120 C CG . GLU A 1 15 ? -3.699 1.063 3.644 1.00 55.88 ? 13 GLU A CG 1 +ATOM 121 C CD . GLU A 1 15 ? -2.735 0.182 4.439 1.00 57.42 ? 13 GLU A CD 1 +ATOM 122 O OE1 . GLU A 1 15 ? -1.488 0.207 4.085 1.00 59.83 ? 13 GLU A OE1 1 +ATOM 123 O OE2 . GLU A 1 15 ? -3.222 -0.506 5.428 1.00 54.80 ? 13 GLU A OE2 1 +ATOM 124 N N . ARG A 1 16 ? -5.379 -2.698 3.822 1.00 42.27 ? 14 ARG A N 1 +ATOM 125 C CA . ARG A 1 16 ? -4.970 -4.002 4.372 1.00 40.56 ? 14 ARG A CA 1 +ATOM 126 C C . ARG A 1 16 ? -4.963 -5.089 3.338 1.00 35.59 ? 14 ARG A C 1 +ATOM 127 O O . ARG A 1 16 ? -4.055 -5.914 3.264 1.00 33.04 ? 14 ARG A O 1 +ATOM 128 C CB . ARG A 1 16 ? -5.934 -4.418 5.465 1.00 42.42 ? 14 ARG A CB 1 +ATOM 129 C CG . ARG A 1 16 ? -5.497 -5.662 6.164 1.00 43.17 ? 14 ARG A CG 1 +ATOM 130 C CD . ARG A 1 16 ? -6.323 -5.913 7.414 1.00 47.67 ? 14 ARG A CD 1 +ATOM 131 N NE . ARG A 1 16 ? -5.977 -7.215 7.971 1.00 51.04 ? 14 ARG A NE 1 +ATOM 132 C CZ . ARG A 1 16 ? -6.753 -7.981 8.775 1.00 51.82 ? 14 ARG A CZ 1 +ATOM 133 N NH1 . ARG A 1 16 ? -7.957 -7.571 9.158 1.00 54.02 ? 14 ARG A NH1 1 +ATOM 134 N NH2 . ARG A 1 16 ? -6.323 -9.191 9.182 1.00 49.41 ? 14 ARG A NH2 1 +ATOM 135 N N . VAL A 1 17 ? -5.994 -5.102 2.500 1.00 33.66 ? 15 VAL A N 1 +ATOM 136 C CA . VAL A 1 17 ? -6.092 -6.113 1.498 1.00 28.88 ? 15 VAL A CA 1 +ATOM 137 C C . VAL A 1 17 ? -4.841 -6.011 0.562 1.00 28.91 ? 15 VAL A C 1 +ATOM 138 O O . VAL A 1 17 ? -4.263 -7.051 0.154 1.00 26.89 ? 15 VAL A O 1 +ATOM 139 C CB . VAL A 1 17 ? -7.417 -6.032 0.697 1.00 27.59 ? 15 VAL A CB 1 +ATOM 140 C CG1 . VAL A 1 17 ? -7.443 -7.012 -0.443 1.00 24.81 ? 15 VAL A CG1 1 +ATOM 141 C CG2 . VAL A 1 17 ? -8.610 -6.349 1.591 1.00 28.28 ? 15 VAL A CG2 1 +ATOM 142 N N . ARG A 1 18 ? -4.549 -4.790 0.131 1.00 29.88 ? 16 ARG A N 1 +ATOM 143 C CA . ARG A 1 18 ? -3.488 -4.509 -0.845 1.00 31.35 ? 16 ARG A CA 1 +ATOM 144 C C . ARG A 1 18 ? -2.133 -4.949 -0.283 1.00 31.57 ? 16 ARG A C 1 +ATOM 145 O O . ARG A 1 18 ? -1.329 -5.593 -0.961 1.00 30.23 ? 16 ARG A O 1 +ATOM 146 C CB . ARG A 1 18 ? -3.484 -2.990 -1.196 1.00 35.66 ? 16 ARG A CB 1 +ATOM 147 C CG . ARG A 1 18 ? -4.541 -2.603 -2.235 1.00 38.13 ? 16 ARG A CG 1 +ATOM 148 C CD . ARG A 1 18 ? -4.552 -1.109 -2.452 1.00 44.62 ? 16 ARG A CD 1 +ATOM 149 N NE . ARG A 1 18 ? -5.632 -0.730 -3.349 1.00 48.29 ? 16 ARG A NE 1 +ATOM 150 C CZ . ARG A 1 18 ? -5.694 -1.040 -4.658 1.00 48.66 ? 16 ARG A CZ 1 +ATOM 151 N NH1 . ARG A 1 18 ? -4.734 -1.719 -5.334 1.00 46.64 ? 16 ARG A NH1 1 +ATOM 152 N NH2 . ARG A 1 18 ? -6.775 -0.662 -5.298 1.00 54.78 ? 16 ARG A NH2 1 +ATOM 153 N N . ARG A 1 19 ? -1.905 -4.513 0.958 1.00 35.72 ? 17 ARG A N 1 +ATOM 154 C CA . ARG A 1 19 ? -0.702 -4.862 1.783 1.00 36.11 ? 17 ARG A CA 1 +ATOM 155 C C . ARG A 1 19 ? -0.513 -6.351 1.876 1.00 33.02 ? 17 ARG A C 1 +ATOM 156 O O . ARG A 1 19 ? 0.542 -6.925 1.525 1.00 33.58 ? 17 ARG A O 1 +ATOM 157 C CB . ARG A 1 19 ? -0.839 -4.215 3.232 1.00 40.91 ? 17 ARG A CB 1 +ATOM 158 C CG . ARG A 1 19 ? -0.104 -2.924 3.498 1.00 46.50 ? 17 ARG A CG 1 +ATOM 159 C CD . ARG A 1 19 ? 0.175 -2.605 5.005 1.00 53.03 ? 17 ARG A CD 1 +ATOM 160 N NE . ARG A 1 19 ? -1.089 -2.537 5.800 1.00 54.64 ? 17 ARG A NE 1 +ATOM 161 C CZ . ARG A 1 19 ? -1.700 -3.518 6.488 1.00 52.04 ? 17 ARG A CZ 1 +ATOM 162 N NH1 . ARG A 1 19 ? -2.899 -3.260 7.050 1.00 54.47 ? 17 ARG A NH1 1 +ATOM 163 N NH2 . ARG A 1 19 ? -1.159 -4.732 6.626 1.00 50.62 ? 17 ARG A NH2 1 +ATOM 164 N N . GLU A 1 20 ? -1.554 -7.025 2.307 1.00 30.16 ? 18 GLU A N 1 +ATOM 165 C CA . GLU A 1 20 ? -1.433 -8.468 2.508 1.00 30.17 ? 18 GLU A CA 1 +ATOM 166 C C . GLU A 1 20 ? -1.436 -9.291 1.204 1.00 28.21 ? 18 GLU A C 1 +ATOM 167 O O . GLU A 1 20 ? -0.852 -10.338 1.110 1.00 26.10 ? 18 GLU A O 1 +ATOM 168 C CB . GLU A 1 20 ? -2.579 -8.984 3.421 1.00 31.04 ? 18 GLU A CB 1 +ATOM 169 C CG . GLU A 1 20 ? -2.555 -8.449 4.859 1.00 34.19 ? 18 GLU A CG 1 +ATOM 170 C CD . GLU A 1 20 ? -3.629 -9.004 5.727 1.00 34.36 ? 18 GLU A CD 1 +ATOM 171 O OE1 . GLU A 1 20 ? -3.717 -8.560 6.899 1.00 38.93 ? 18 GLU A OE1 1 +ATOM 172 O OE2 . GLU A 1 20 ? -4.327 -9.961 5.347 1.00 37.44 ? 18 GLU A OE2 1 +ATOM 173 N N . CYS A 1 21 ? -2.071 -8.781 0.167 1.00 27.69 ? 19 CYS A N 1 +ATOM 174 C CA . CYS A 1 21 ? -1.958 -9.413 -1.174 1.00 25.40 ? 19 CYS A CA 1 +ATOM 175 C C . CYS A 1 21 ? -0.524 -9.413 -1.780 1.00 27.01 ? 19 CYS A C 1 +ATOM 176 O O . CYS A 1 21 ? -0.054 -10.427 -2.270 1.00 26.61 ? 19 CYS A O 1 +ATOM 177 C CB . CYS A 1 21 ? -2.890 -8.729 -2.153 1.00 26.94 ? 19 CYS A CB 1 +ATOM 178 S SG . CYS A 1 21 ? -3.274 -9.678 -3.627 1.00 24.90 ? 19 CYS A SG 1 +ATOM 179 N N . LYS A 1 22 ? 0.126 -8.245 -1.714 1.00 27.64 ? 20 LYS A N 1 +ATOM 180 C CA . LYS A 1 22 ? 1.536 -8.080 -2.049 1.00 29.17 ? 20 LYS A CA 1 +ATOM 181 C C . LYS A 1 22 ? 2.444 -9.039 -1.265 1.00 31.53 ? 20 LYS A C 1 +ATOM 182 O O . LYS A 1 22 ? 3.279 -9.691 -1.849 1.00 30.43 ? 20 LYS A O 1 +ATOM 183 C CB . LYS A 1 22 ? 1.956 -6.670 -1.757 1.00 30.36 ? 20 LYS A CB 1 +ATOM 184 C CG . LYS A 1 22 ? 3.411 -6.394 -2.011 1.00 32.79 ? 20 LYS A CG 1 +ATOM 185 C CD . LYS A 1 22 ? 3.651 -4.924 -1.904 1.00 34.74 ? 20 LYS A CD 1 +ATOM 186 C CE . LYS A 1 22 ? 4.954 -4.505 -2.547 1.00 37.21 ? 20 LYS A CE 1 +ATOM 187 N NZ . LYS A 1 22 ? 6.084 -4.940 -1.694 1.00 39.19 ? 20 LYS A NZ 1 +ATOM 188 N N . GLU A 1 23 ? 2.256 -9.047 0.067 1.00 33.24 ? 21 GLU A N 1 +ATOM 189 C CA . GLU A 1 23 ? 2.930 -9.988 0.952 1.00 35.88 ? 21 GLU A CA 1 +ATOM 190 C C . GLU A 1 23 ? 2.752 -11.417 0.507 1.00 33.55 ? 21 GLU A C 1 +ATOM 191 O O . GLU A 1 23 ? 3.689 -12.138 0.377 1.00 32.47 ? 21 GLU A O 1 +ATOM 192 C CB . GLU A 1 23 ? 2.419 -9.830 2.395 1.00 38.95 ? 21 GLU A CB 1 +ATOM 193 C CG . GLU A 1 23 ? 3.084 -8.683 3.148 1.00 43.09 ? 21 GLU A CG 1 +ATOM 194 C CD . GLU A 1 23 ? 2.463 -8.328 4.526 1.00 46.58 ? 21 GLU A CD 1 +ATOM 195 O OE1 . GLU A 1 23 ? 1.364 -8.884 4.935 1.00 46.76 ? 21 GLU A OE1 1 +ATOM 196 O OE2 . GLU A 1 23 ? 3.035 -7.403 5.135 1.00 46.00 ? 21 GLU A OE2 1 +ATOM 197 N N . ARG A 1 24 ? 1.497 -11.795 0.239 1.00 32.88 ? 22 ARG A N 1 +ATOM 198 C CA A ARG A 1 24 ? 1.134 -13.159 -0.154 0.50 33.05 ? 22 ARG A CA 1 +ATOM 199 C CA B ARG A 1 24 ? 1.135 -13.158 -0.154 0.50 32.08 ? 22 ARG A CA 1 +ATOM 200 C C . ARG A 1 24 ? 1.808 -13.543 -1.475 1.00 31.55 ? 22 ARG A C 1 +ATOM 201 O O . ARG A 1 24 ? 2.410 -14.616 -1.624 1.00 35.34 ? 22 ARG A O 1 +ATOM 202 C CB A ARG A 1 24 ? -0.407 -13.276 -0.199 0.50 32.59 ? 22 ARG A CB 1 +ATOM 203 C CB B ARG A 1 24 ? -0.405 -13.276 -0.200 0.50 30.18 ? 22 ARG A CB 1 +ATOM 204 C CG A ARG A 1 24 ? -1.028 -14.571 -0.684 0.50 33.59 ? 22 ARG A CG 1 +ATOM 205 C CG B ARG A 1 24 ? -1.012 -14.576 -0.694 0.50 29.70 ? 22 ARG A CG 1 +ATOM 206 C CD A ARG A 1 24 ? -2.577 -14.520 -0.654 0.50 33.54 ? 22 ARG A CD 1 +ATOM 207 C CD B ARG A 1 24 ? -2.549 -14.544 -0.660 0.50 28.14 ? 22 ARG A CD 1 +ATOM 208 N NE A ARG A 1 24 ? -3.353 -14.354 0.613 0.50 34.22 ? 22 ARG A NE 1 +ATOM 209 N NE B ARG A 1 24 ? -3.255 -14.409 0.644 0.50 27.52 ? 22 ARG A NE 1 +ATOM 210 C CZ A ARG A 1 24 ? -3.843 -13.206 1.086 0.50 34.55 ? 22 ARG A CZ 1 +ATOM 211 C CZ B ARG A 1 24 ? -3.633 -15.449 1.391 0.50 28.28 ? 22 ARG A CZ 1 +ATOM 212 N NH1 A ARG A 1 24 ? -3.598 -12.057 0.488 0.50 34.11 ? 22 ARG A NH1 1 +ATOM 213 N NH1 B ARG A 1 24 ? -4.280 -15.243 2.540 0.50 28.12 ? 22 ARG A NH1 1 +ATOM 214 N NH2 A ARG A 1 24 ? -4.574 -13.199 2.181 0.50 35.70 ? 22 ARG A NH2 1 +ATOM 215 N NH2 B ARG A 1 24 ? -3.301 -16.690 1.029 0.50 28.64 ? 22 ARG A NH2 1 +ATOM 216 N N . GLY A 1 25 ? 1.750 -12.687 -2.452 1.00 30.90 ? 23 GLY A N 1 +ATOM 217 C CA . GLY A 1 25 ? 2.418 -12.959 -3.774 1.00 30.14 ? 23 GLY A CA 1 +ATOM 218 C C . GLY A 1 25 ? 3.921 -13.068 -3.600 1.00 32.50 ? 23 GLY A C 1 +ATOM 219 O O . GLY A 1 25 ? 4.572 -14.033 -4.065 1.00 31.66 ? 23 GLY A O 1 +ATOM 220 N N . GLU A 1 26 ? 4.499 -12.078 -2.918 1.00 32.84 ? 24 GLU A N 1 +ATOM 221 C CA . GLU A 1 26 ? 5.957 -11.960 -2.853 1.00 34.70 ? 24 GLU A CA 1 +ATOM 222 C C . GLU A 1 26 ? 6.544 -13.115 -2.098 1.00 38.20 ? 24 GLU A C 1 +ATOM 223 O O . GLU A 1 26 ? 7.551 -13.696 -2.560 1.00 39.90 ? 24 GLU A O 1 +ATOM 224 C CB . GLU A 1 26 ? 6.377 -10.615 -2.263 1.00 36.12 ? 24 GLU A CB 1 +ATOM 225 C CG . GLU A 1 26 ? 6.132 -9.554 -3.309 1.00 36.63 ? 24 GLU A CG 1 +ATOM 226 C CD . GLU A 1 26 ? 6.624 -8.205 -2.969 1.00 39.46 ? 24 GLU A CD 1 +ATOM 227 O OE1 . GLU A 1 26 ? 6.796 -7.863 -1.779 1.00 42.26 ? 24 GLU A OE1 1 +ATOM 228 O OE2 . GLU A 1 26 ? 6.757 -7.479 -3.962 1.00 42.08 ? 24 GLU A OE2 1 +ATOM 229 N N . ARG A 1 27 ? 5.883 -13.504 -0.993 1.00 37.36 ? 25 ARG A N 1 +ATOM 230 C CA . ARG A 1 27 ? 6.316 -14.620 -0.184 1.00 41.29 ? 25 ARG A CA 1 +ATOM 231 C C . ARG A 1 27 ? 6.401 -15.941 -1.015 1.00 40.15 ? 25 ARG A C 1 +ATOM 232 O O . ARG A 1 27 ? 7.187 -16.835 -0.708 1.00 41.55 ? 25 ARG A O 1 +ATOM 233 C CB . ARG A 1 27 ? 5.392 -14.707 1.017 1.00 43.01 ? 25 ARG A CB 1 +ATOM 234 C CG . ARG A 1 27 ? 5.470 -15.932 1.872 1.00 50.28 ? 25 ARG A CG 1 +ATOM 235 C CD . ARG A 1 27 ? 4.058 -16.351 2.297 1.00 51.02 ? 25 ARG A CD 1 +ATOM 236 N NE . ARG A 1 27 ? 3.288 -15.259 2.850 1.00 52.79 ? 25 ARG A NE 1 +ATOM 237 C CZ . ARG A 1 27 ? 1.942 -15.198 2.888 1.00 54.91 ? 25 ARG A CZ 1 +ATOM 238 N NH1 . ARG A 1 27 ? 1.171 -16.132 2.310 1.00 54.40 ? 25 ARG A NH1 1 +ATOM 239 N NH2 . ARG A 1 27 ? 1.364 -14.131 3.471 1.00 55.15 ? 25 ARG A NH2 1 +ATOM 240 N N . GLN A 1 28 ? 5.552 -16.075 -2.008 1.00 37.57 ? 26 GLN A N 1 +ATOM 241 C CA . GLN A 1 28 ? 5.403 -17.294 -2.734 1.00 40.26 ? 26 GLN A CA 1 +ATOM 242 C C . GLN A 1 28 ? 6.020 -17.207 -4.101 1.00 37.60 ? 26 GLN A C 1 +ATOM 243 O O . GLN A 1 28 ? 5.926 -18.174 -4.855 1.00 37.33 ? 26 GLN A O 1 +ATOM 244 C CB . GLN A 1 28 ? 3.900 -17.546 -2.985 1.00 41.60 ? 26 GLN A CB 1 +ATOM 245 C CG . GLN A 1 28 ? 3.074 -17.983 -1.797 1.00 46.66 ? 26 GLN A CG 1 +ATOM 246 C CD . GLN A 1 28 ? 1.588 -18.017 -2.212 1.00 47.40 ? 26 GLN A CD 1 +ATOM 247 O OE1 . GLN A 1 28 ? 1.214 -18.715 -3.161 1.00 54.30 ? 26 GLN A OE1 1 +ATOM 248 N NE2 . GLN A 1 28 ? 0.769 -17.289 -1.532 1.00 47.14 ? 26 GLN A NE2 1 +ATOM 249 N N . ASN A 1 29 ? 6.577 -16.056 -4.480 1.00 37.21 ? 27 ASN A N 1 +ATOM 250 C CA . ASN A 1 29 ? 6.906 -15.781 -5.897 1.00 36.85 ? 27 ASN A CA 1 +ATOM 251 C C . ASN A 1 29 ? 5.783 -16.141 -6.879 1.00 35.61 ? 27 ASN A C 1 +ATOM 252 O O . ASN A 1 29 ? 5.971 -16.835 -7.843 1.00 37.99 ? 27 ASN A O 1 +ATOM 253 C CB . ASN A 1 29 ? 8.240 -16.414 -6.308 1.00 40.40 ? 27 ASN A CB 1 +ATOM 254 C CG . ASN A 1 29 ? 9.378 -15.902 -5.499 1.00 41.94 ? 27 ASN A CG 1 +ATOM 255 O OD1 . ASN A 1 29 ? 9.456 -14.726 -5.150 1.00 41.17 ? 27 ASN A OD1 1 +ATOM 256 N ND2 . ASN A 1 29 ? 10.268 -16.812 -5.119 1.00 46.43 ? 27 ASN A ND2 1 +ATOM 257 N N . CYS A 1 30 ? 4.601 -15.639 -6.588 1.00 32.65 ? 28 CYS A N 1 +ATOM 258 C CA . CYS A 1 30 ? 3.420 -15.697 -7.461 1.00 32.45 ? 28 CYS A CA 1 +ATOM 259 C C . CYS A 1 30 ? 2.961 -14.257 -7.686 1.00 28.84 ? 28 CYS A C 1 +ATOM 260 O O . CYS A 1 30 ? 3.251 -13.373 -6.867 1.00 29.72 ? 28 CYS A O 1 +ATOM 261 C CB . CYS A 1 30 ? 2.274 -16.468 -6.742 1.00 32.78 ? 28 CYS A CB 1 +ATOM 262 S SG . CYS A 1 30 ? 2.721 -18.189 -6.310 1.00 39.45 ? 28 CYS A SG 1 +ATOM 263 N N . GLN A 1 31 ? 2.369 -14.011 -8.846 1.00 28.33 ? 29 GLN A N 1 +ATOM 264 C CA . GLN A 1 31 ? 1.939 -12.724 -9.264 1.00 27.59 ? 29 GLN A CA 1 +ATOM 265 C C . GLN A 1 31 ? 0.684 -12.335 -8.494 1.00 26.02 ? 29 GLN A C 1 +ATOM 266 O O . GLN A 1 31 ? -0.128 -13.218 -8.105 1.00 25.36 ? 29 GLN A O 1 +ATOM 267 C CB . GLN A 1 31 ? 1.608 -12.724 -10.751 1.00 29.34 ? 29 GLN A CB 1 +ATOM 268 C CG . GLN A 1 31 ? 2.846 -12.845 -11.667 1.00 32.03 ? 29 GLN A CG 1 +ATOM 269 C CD . GLN A 1 31 ? 2.528 -12.808 -13.178 1.00 34.48 ? 29 GLN A CD 1 +ATOM 270 O OE1 . GLN A 1 31 ? 1.474 -12.309 -13.605 1.00 33.83 ? 29 GLN A OE1 1 +ATOM 271 N NE2 . GLN A 1 31 ? 3.473 -13.278 -14.003 1.00 37.38 ? 29 GLN A NE2 1 +ATOM 272 N N . TYR A 1 32 ? 0.536 -11.067 -8.195 1.00 25.18 ? 30 TYR A N 1 +ATOM 273 C CA . TYR A 1 32 ? -0.631 -10.664 -7.379 1.00 23.15 ? 30 TYR A CA 1 +ATOM 274 C C . TYR A 1 32 ? -1.230 -9.433 -7.998 1.00 23.94 ? 30 TYR A C 1 +ATOM 275 O O . TYR A 1 32 ? -0.556 -8.592 -8.529 1.00 25.90 ? 30 TYR A O 1 +ATOM 276 C CB . TYR A 1 32 ? -0.225 -10.398 -5.914 1.00 22.67 ? 30 TYR A CB 1 +ATOM 277 C CG . TYR A 1 32 ? 0.641 -9.137 -5.757 1.00 23.96 ? 30 TYR A CG 1 +ATOM 278 C CD1 . TYR A 1 32 ? 0.053 -7.886 -5.470 1.00 23.99 ? 30 TYR A CD1 1 +ATOM 279 C CD2 . TYR A 1 32 ? 2.008 -9.208 -5.787 1.00 24.73 ? 30 TYR A CD2 1 +ATOM 280 C CE1 . TYR A 1 32 ? 0.846 -6.736 -5.325 1.00 25.39 ? 30 TYR A CE1 1 +ATOM 281 C CE2 . TYR A 1 32 ? 2.805 -8.056 -5.608 1.00 27.38 ? 30 TYR A CE2 1 +ATOM 282 C CZ . TYR A 1 32 ? 2.218 -6.831 -5.456 1.00 27.78 ? 30 TYR A CZ 1 +ATOM 283 O OH . TYR A 1 32 ? 3.049 -5.726 -5.250 1.00 29.18 ? 30 TYR A OH 1 +ATOM 284 N N . GLN A 1 33 ? -2.533 -9.313 -7.872 1.00 24.22 ? 31 GLN A N 1 +ATOM 285 C CA . GLN A 1 33 ? -3.311 -8.166 -8.301 1.00 25.38 ? 31 GLN A CA 1 +ATOM 286 C C . GLN A 1 33 ? -4.525 -7.930 -7.362 1.00 24.57 ? 31 GLN A C 1 +ATOM 287 O O . GLN A 1 33 ? -5.035 -8.894 -6.825 1.00 22.34 ? 31 GLN A O 1 +ATOM 288 C CB . GLN A 1 33 ? -3.910 -8.507 -9.673 1.00 29.34 ? 31 GLN A CB 1 +ATOM 289 C CG . GLN A 1 33 ? -2.887 -8.687 -10.803 1.00 32.30 ? 31 GLN A CG 1 +ATOM 290 C CD . GLN A 1 33 ? -2.080 -7.480 -11.264 1.00 37.09 ? 31 GLN A CD 1 +ATOM 291 O OE1 . GLN A 1 33 ? -1.039 -7.574 -12.064 1.00 39.67 ? 31 GLN A OE1 1 +ATOM 292 N NE2 . GLN A 1 33 ? -2.602 -6.325 -10.942 1.00 38.06 ? 31 GLN A NE2 1 +ATOM 293 N N . ILE A 1 34 ? -4.969 -6.675 -7.243 1.00 25.91 ? 32 ILE A N 1 +ATOM 294 C CA . ILE A 1 34 ? -6.097 -6.323 -6.420 1.00 26.90 ? 32 ILE A CA 1 +ATOM 295 C C . ILE A 1 34 ? -7.205 -5.962 -7.373 1.00 27.30 ? 32 ILE A C 1 +ATOM 296 O O . ILE A 1 34 ? -7.024 -5.182 -8.317 1.00 25.21 ? 32 ILE A O 1 +ATOM 297 C CB . ILE A 1 34 ? -5.767 -5.206 -5.417 1.00 29.15 ? 32 ILE A CB 1 +ATOM 298 C CG1 . ILE A 1 34 ? -4.969 -5.787 -4.226 1.00 30.12 ? 32 ILE A CG1 1 +ATOM 299 C CG2 . ILE A 1 34 ? -7.006 -4.619 -4.822 1.00 30.88 ? 32 ILE A CG2 1 +ATOM 300 C CD1 . ILE A 1 34 ? -3.475 -5.914 -4.541 1.00 33.68 ? 32 ILE A CD1 1 +ATOM 301 N N . ARG A 1 35 ? -8.348 -6.641 -7.161 1.00 27.00 ? 33 ARG A N 1 +ATOM 302 C CA . ARG A 1 35 ? -9.566 -6.458 -7.948 1.00 28.39 ? 33 ARG A CA 1 +ATOM 303 C C . ARG A 1 35 ? -10.671 -5.953 -6.986 1.00 29.19 ? 33 ARG A C 1 +ATOM 304 O O . ARG A 1 35 ? -10.431 -5.866 -5.781 1.00 27.74 ? 33 ARG A O 1 +ATOM 305 C CB . ARG A 1 35 ? -10.003 -7.794 -8.583 1.00 28.52 ? 33 ARG A CB 1 +ATOM 306 C CG . ARG A 1 35 ? -8.857 -8.668 -9.176 1.00 28.90 ? 33 ARG A CG 1 +ATOM 307 C CD . ARG A 1 35 ? -8.203 -7.973 -10.326 1.00 31.08 ? 33 ARG A CD 1 +ATOM 308 N NE . ARG A 1 35 ? -7.345 -8.821 -11.121 1.00 30.27 ? 33 ARG A NE 1 +ATOM 309 C CZ . ARG A 1 35 ? -6.506 -8.326 -12.017 1.00 34.28 ? 33 ARG A CZ 1 +ATOM 310 N NH1 . ARG A 1 35 ? -6.340 -6.999 -12.157 1.00 35.24 ? 33 ARG A NH1 1 +ATOM 311 N NH2 . ARG A 1 35 ? -5.769 -9.151 -12.763 1.00 36.72 ? 33 ARG A NH2 1 +ATOM 312 N N . LYS A 1 36 ? -11.847 -5.641 -7.533 1.00 29.62 ? 34 LYS A N 1 +ATOM 313 C CA . LYS A 1 36 ? -13.041 -5.332 -6.677 1.00 31.16 ? 34 LYS A CA 1 +ATOM 314 C C . LYS A 1 36 ? -14.236 -6.115 -7.112 1.00 29.79 ? 34 LYS A C 1 +ATOM 315 O O . LYS A 1 36 ? -14.448 -6.376 -8.299 1.00 29.43 ? 34 LYS A O 1 +ATOM 316 C CB . LYS A 1 36 ? -13.437 -3.902 -6.741 1.00 34.67 ? 34 LYS A CB 1 +ATOM 317 C CG . LYS A 1 36 ? -12.498 -2.991 -6.067 1.00 37.10 ? 34 LYS A CG 1 +ATOM 318 C CD . LYS A 1 36 ? -13.119 -1.601 -5.984 1.00 40.47 ? 34 LYS A CD 1 +ATOM 319 C CE . LYS A 1 36 ? -14.021 -1.518 -4.798 1.00 41.82 ? 34 LYS A CE 1 +ATOM 320 N NZ . LYS A 1 36 ? -14.351 -0.070 -4.582 1.00 47.33 ? 34 LYS A NZ 1 +ATOM 321 N N . GLU A 1 37 ? -14.958 -6.574 -6.126 1.00 27.52 ? 35 GLU A N 1 +ATOM 322 C CA . GLU A 1 37 ? -16.217 -7.174 -6.334 1.00 27.90 ? 35 GLU A CA 1 +ATOM 323 C C . GLU A 1 37 ? -17.202 -6.337 -5.511 1.00 27.89 ? 35 GLU A C 1 +ATOM 324 O O . GLU A 1 37 ? -17.155 -6.357 -4.259 1.00 24.62 ? 35 GLU A O 1 +ATOM 325 C CB . GLU A 1 37 ? -16.216 -8.613 -5.864 1.00 29.32 ? 35 GLU A CB 1 +ATOM 326 C CG . GLU A 1 37 ? -16.848 -9.609 -6.783 1.00 32.59 ? 35 GLU A CG 1 +ATOM 327 C CD . GLU A 1 37 ? -16.590 -11.053 -6.346 1.00 32.52 ? 35 GLU A CD 1 +ATOM 328 O OE1 . GLU A 1 37 ? -15.446 -11.501 -6.106 1.00 27.48 ? 35 GLU A OE1 1 +ATOM 329 O OE2 . GLU A 1 37 ? -17.559 -11.806 -6.275 1.00 35.36 ? 35 GLU A OE2 1 +ATOM 330 N N . GLY A 1 38 ? -18.109 -5.579 -6.196 1.00 27.56 ? 36 GLY A N 1 +ATOM 331 C CA . GLY A 1 38 ? -18.904 -4.638 -5.475 1.00 29.11 ? 36 GLY A CA 1 +ATOM 332 C C . GLY A 1 38 ? -18.003 -3.611 -4.825 1.00 28.77 ? 36 GLY A C 1 +ATOM 333 O O . GLY A 1 38 ? -17.131 -3.046 -5.510 1.00 28.12 ? 36 GLY A O 1 +ATOM 334 N N . ASN A 1 39 ? -18.157 -3.417 -3.527 1.00 26.27 ? 37 ASN A N 1 +ATOM 335 C CA . ASN A 1 39 ? -17.182 -2.550 -2.804 1.00 27.58 ? 37 ASN A CA 1 +ATOM 336 C C . ASN A 1 39 ? -16.116 -3.293 -2.008 1.00 25.12 ? 37 ASN A C 1 +ATOM 337 O O . ASN A 1 39 ? -15.404 -2.633 -1.223 1.00 24.90 ? 37 ASN A O 1 +ATOM 338 C CB . ASN A 1 39 ? -17.950 -1.615 -1.843 1.00 30.63 ? 37 ASN A CB 1 +ATOM 339 C CG . ASN A 1 39 ? -17.138 -0.431 -1.385 1.00 34.18 ? 37 ASN A CG 1 +ATOM 340 O OD1 . ASN A 1 39 ? -16.267 0.117 -2.125 1.00 37.80 ? 37 ASN A OD1 1 +ATOM 341 N ND2 . ASN A 1 39 ? -17.361 -0.031 -0.110 1.00 35.44 ? 37 ASN A ND2 1 +ATOM 342 N N . CYS A 1 40 ? -16.039 -4.612 -2.156 1.00 23.67 ? 38 CYS A N 1 +ATOM 343 C CA . CYS A 1 40 ? -15.071 -5.466 -1.473 1.00 23.91 ? 38 CYS A CA 1 +ATOM 344 C C . CYS A 1 40 ? -13.867 -5.639 -2.329 1.00 26.32 ? 38 CYS A C 1 +ATOM 345 O O . CYS A 1 40 ? -14.000 -5.851 -3.556 1.00 26.06 ? 38 CYS A O 1 +ATOM 346 C CB . CYS A 1 40 ? -15.682 -6.841 -1.256 1.00 23.79 ? 38 CYS A CB 1 +ATOM 347 S SG . CYS A 1 40 ? -17.146 -6.829 -0.222 1.00 23.33 ? 38 CYS A SG 1 +ATOM 348 N N . TYR A 1 41 ? -12.691 -5.555 -1.727 1.00 25.47 ? 39 TYR A N 1 +ATOM 349 C CA . TYR A 1 41 ? -11.447 -5.766 -2.399 1.00 25.96 ? 39 TYR A CA 1 +ATOM 350 C C . TYR A 1 41 ? -11.102 -7.245 -2.345 1.00 23.79 ? 39 TYR A C 1 +ATOM 351 O O . TYR A 1 41 ? -11.502 -7.963 -1.421 1.00 20.31 ? 39 TYR A O 1 +ATOM 352 C CB . TYR A 1 41 ? -10.333 -4.891 -1.794 1.00 26.60 ? 39 TYR A CB 1 +ATOM 353 C CG . TYR A 1 41 ? -10.579 -3.473 -2.176 1.00 27.17 ? 39 TYR A CG 1 +ATOM 354 C CD1 . TYR A 1 41 ? -11.405 -2.683 -1.419 1.00 28.25 ? 39 TYR A CD1 1 +ATOM 355 C CD2 . TYR A 1 41 ? -9.997 -2.926 -3.338 1.00 28.84 ? 39 TYR A CD2 1 +ATOM 356 C CE1 . TYR A 1 41 ? -11.753 -1.411 -1.826 1.00 30.57 ? 39 TYR A CE1 1 +ATOM 357 C CE2 . TYR A 1 41 ? -10.262 -1.629 -3.726 1.00 31.16 ? 39 TYR A CE2 1 +ATOM 358 C CZ . TYR A 1 41 ? -11.143 -0.883 -2.985 1.00 32.43 ? 39 TYR A CZ 1 +ATOM 359 O OH . TYR A 1 41 ? -11.447 0.384 -3.363 1.00 34.92 ? 39 TYR A OH 1 +ATOM 360 N N . VAL A 1 42 ? -10.429 -7.659 -3.426 1.00 21.69 ? 40 VAL A N 1 +ATOM 361 C CA . VAL A 1 42 ? -10.182 -9.050 -3.774 1.00 21.74 ? 40 VAL A CA 1 +ATOM 362 C C . VAL A 1 42 ? -8.674 -9.142 -4.089 1.00 20.90 ? 40 VAL A C 1 +ATOM 363 O O . VAL A 1 42 ? -8.166 -8.432 -4.901 1.00 21.09 ? 40 VAL A O 1 +ATOM 364 C CB . VAL A 1 42 ? -11.058 -9.535 -4.996 1.00 21.89 ? 40 VAL A CB 1 +ATOM 365 C CG1 . VAL A 1 42 ? -10.722 -10.987 -5.364 1.00 21.75 ? 40 VAL A CG1 1 +ATOM 366 C CG2 . VAL A 1 42 ? -12.532 -9.421 -4.683 1.00 23.64 ? 40 VAL A CG2 1 +ATOM 367 N N . CYS A 1 43 ? -7.979 -10.018 -3.390 1.00 21.15 ? 41 CYS A N 1 +ATOM 368 C CA . CYS A 1 43 ? -6.616 -10.438 -3.722 1.00 22.30 ? 41 CYS A CA 1 +ATOM 369 C C . CYS A 1 43 ? -6.633 -11.590 -4.745 1.00 22.99 ? 41 CYS A C 1 +ATOM 370 O O . CYS A 1 43 ? -7.165 -12.691 -4.457 1.00 23.23 ? 41 CYS A O 1 +ATOM 371 C CB . CYS A 1 43 ? -5.859 -10.876 -2.484 1.00 22.16 ? 41 CYS A CB 1 +ATOM 372 S SG . CYS A 1 43 ? -4.196 -11.391 -2.903 1.00 23.38 ? 41 CYS A SG 1 +ATOM 373 N N . GLU A 1 44 ? -6.083 -11.363 -5.911 1.00 22.83 ? 42 GLU A N 1 +ATOM 374 C CA . GLU A 1 44 ? -5.902 -12.443 -6.910 1.00 23.98 ? 42 GLU A CA 1 +ATOM 375 C C . GLU A 1 44 ? -4.467 -12.852 -6.990 1.00 23.85 ? 42 GLU A C 1 +ATOM 376 O O . GLU A 1 44 ? -3.580 -11.998 -7.239 1.00 24.61 ? 42 GLU A O 1 +ATOM 377 C CB . GLU A 1 44 ? -6.364 -11.926 -8.270 1.00 27.11 ? 42 GLU A CB 1 +ATOM 378 C CG . GLU A 1 44 ? -5.967 -12.904 -9.408 1.00 31.24 ? 42 GLU A CG 1 +ATOM 379 C CD . GLU A 1 44 ? -6.215 -12.270 -10.786 1.00 33.86 ? 42 GLU A CD 1 +ATOM 380 O OE1 . GLU A 1 44 ? -5.190 -11.977 -11.481 1.00 35.09 ? 42 GLU A OE1 1 +ATOM 381 O OE2 . GLU A 1 44 ? -7.387 -11.997 -11.088 1.00 33.09 ? 42 GLU A OE2 1 +ATOM 382 N N . ILE A 1 45 ? -4.214 -14.144 -6.874 1.00 23.38 ? 43 ILE A N 1 +ATOM 383 C CA . ILE A 1 45 ? -2.826 -14.696 -6.859 1.00 25.51 ? 43 ILE A CA 1 +ATOM 384 C C . ILE A 1 45 ? -2.773 -15.611 -8.087 1.00 28.12 ? 43 ILE A C 1 +ATOM 385 O O . ILE A 1 45 ? -3.731 -16.391 -8.348 1.00 25.25 ? 43 ILE A O 1 +ATOM 386 C CB . ILE A 1 45 ? -2.499 -15.495 -5.546 1.00 26.27 ? 43 ILE A CB 1 +ATOM 387 C CG1 . ILE A 1 45 ? -2.614 -14.551 -4.259 1.00 24.38 ? 43 ILE A CG1 1 +ATOM 388 C CG2 . ILE A 1 45 ? -1.132 -16.191 -5.591 1.00 28.37 ? 43 ILE A CG2 1 +ATOM 389 C CD1 . ILE A 1 45 ? -1.677 -13.382 -4.254 1.00 24.45 ? 43 ILE A CD1 1 +ATOM 390 N N . ARG A 1 46 ? -1.716 -15.474 -8.847 1.00 29.79 ? 44 ARG A N 1 +ATOM 391 C CA . ARG A 1 46 ? -1.422 -16.373 -10.012 1.00 34.13 ? 44 ARG A CA 1 +ATOM 392 C C . ARG A 1 46 ? 0.036 -16.976 -9.814 1.00 34.99 ? 44 ARG A C 1 +ATOM 393 O O . ARG A 1 46 ? 0.996 -16.277 -10.043 1.00 35.46 ? 44 ARG A O 1 +ATOM 394 C CB . ARG A 1 46 ? -1.486 -15.631 -11.383 1.00 37.69 ? 44 ARG A CB 1 +ATOM 395 C CG . ARG A 1 46 ? -2.787 -14.964 -11.661 1.00 40.31 ? 44 ARG A CG 1 +ATOM 396 C CD . ARG A 1 46 ? -2.884 -14.421 -13.076 1.00 44.64 ? 44 ARG A CD 1 +ATOM 397 N NE . ARG A 1 46 ? -4.247 -13.954 -13.297 1.00 52.63 ? 44 ARG A NE 1 +ATOM 398 C CZ . ARG A 1 46 ? -4.730 -13.367 -14.404 1.00 58.03 ? 44 ARG A CZ 1 +ATOM 399 N NH1 . ARG A 1 46 ? -3.950 -13.127 -15.458 1.00 59.38 ? 44 ARG A NH1 1 +ATOM 400 N NH2 . ARG A 1 46 ? -6.038 -13.009 -14.453 1.00 61.09 ? 44 ARG A NH2 1 +ATOM 401 N N . CYS A 1 47 ? 0.153 -18.251 -9.432 1.00 36.67 ? 45 CYS A N 1 +ATOM 402 C CA . CYS A 1 47 ? 1.418 -18.946 -9.282 1.00 38.56 ? 45 CYS A CA 1 +ATOM 403 C C . CYS A 1 47 ? 1.764 -19.763 -10.531 1.00 41.59 ? 45 CYS A C 1 +ATOM 404 O O . CYS A 1 47 ? 0.841 -19.841 -11.384 1.00 41.68 ? 45 CYS A O 1 +ATOM 405 C CB . CYS A 1 47 ? 1.314 -19.927 -8.149 1.00 40.22 ? 45 CYS A CB 1 +ATOM 406 S SG . CYS A 1 47 ? 1.011 -19.172 -6.570 1.00 36.19 ? 45 CYS A SG 1 +ATOM 407 O OXT . CYS A 1 47 ? 2.911 -20.367 -10.617 1.00 42.13 ? 45 CYS A OXT 1 +ATOM 408 N N . GLY B 1 1 ? -13.447 -14.018 4.951 1.00 70.97 ? -1 GLY B N 1 +ATOM 409 C CA . GLY B 1 1 ? -13.793 -13.822 3.498 1.00 69.87 ? -1 GLY B CA 1 +ATOM 410 C C . GLY B 1 1 ? -14.366 -15.051 2.794 1.00 63.52 ? -1 GLY B C 1 +ATOM 411 O O . GLY B 1 1 ? -15.162 -15.802 3.387 1.00 63.13 ? -1 GLY B O 1 +ATOM 412 N N . SER B 1 2 ? -13.980 -15.232 1.531 1.00 57.96 ? 0 SER B N 1 +ATOM 413 C CA . SER B 1 2 ? -14.332 -16.396 0.712 1.00 52.88 ? 0 SER B CA 1 +ATOM 414 C C . SER B 1 2 ? -13.150 -16.714 -0.295 1.00 47.94 ? 0 SER B C 1 +ATOM 415 O O . SER B 1 2 ? -12.721 -15.813 -1.006 1.00 47.39 ? 0 SER B O 1 +ATOM 416 C CB . SER B 1 2 ? -15.704 -16.120 -0.006 1.00 54.10 ? 0 SER B CB 1 +ATOM 417 N N . GLU B 1 3 ? -12.642 -17.976 -0.311 1.00 43.22 ? 1 GLU B N 1 +ATOM 418 C CA A GLU B 1 3 ? -11.551 -18.400 -1.249 0.50 39.13 ? 1 GLU B CA 1 +ATOM 419 C CA B GLU B 1 3 ? -11.537 -18.422 -1.210 0.50 39.93 ? 1 GLU B CA 1 +ATOM 420 C C . GLU B 1 3 ? -11.938 -19.270 -2.448 1.00 37.03 ? 1 GLU B C 1 +ATOM 421 O O . GLU B 1 3 ? -12.462 -20.389 -2.299 1.00 33.59 ? 1 GLU B O 1 +ATOM 422 C CB A GLU B 1 3 ? -10.440 -19.138 -0.531 0.50 38.22 ? 1 GLU B CB 1 +ATOM 423 C CB B GLU B 1 3 ? -10.522 -19.235 -0.391 0.50 39.93 ? 1 GLU B CB 1 +ATOM 424 C CG A GLU B 1 3 ? -9.223 -19.382 -1.427 0.50 37.23 ? 1 GLU B CG 1 +ATOM 425 C CG B GLU B 1 3 ? -9.909 -18.473 0.797 0.50 43.64 ? 1 GLU B CG 1 +ATOM 426 C CD A GLU B 1 3 ? -8.365 -20.427 -0.838 0.50 36.54 ? 1 GLU B CD 1 +ATOM 427 C CD B GLU B 1 3 ? -10.816 -18.379 1.999 0.50 45.08 ? 1 GLU B CD 1 +ATOM 428 O OE1 A GLU B 1 3 ? -7.348 -20.808 -1.403 0.50 35.39 ? 1 GLU B OE1 1 +ATOM 429 O OE1 B GLU B 1 3 ? -11.058 -19.403 2.672 0.50 43.27 ? 1 GLU B OE1 1 +ATOM 430 O OE2 A GLU B 1 3 ? -8.696 -20.763 0.296 0.50 37.09 ? 1 GLU B OE2 1 +ATOM 431 O OE2 B GLU B 1 3 ? -11.280 -17.268 2.298 0.50 50.10 ? 1 GLU B OE2 1 +ATOM 432 N N . GLU B 1 4 ? -11.592 -18.780 -3.654 1.00 32.80 ? 2 GLU B N 1 +ATOM 433 C CA . GLU B 1 4 ? -11.861 -19.461 -4.856 1.00 30.41 ? 2 GLU B CA 1 +ATOM 434 C C . GLU B 1 4 ? -10.596 -19.752 -5.588 1.00 28.59 ? 2 GLU B C 1 +ATOM 435 O O . GLU B 1 4 ? -9.758 -18.859 -5.737 1.00 28.23 ? 2 GLU B O 1 +ATOM 436 C CB . GLU B 1 4 ? -12.666 -18.592 -5.798 1.00 32.67 ? 2 GLU B CB 1 +ATOM 437 C CG . GLU B 1 4 ? -12.913 -19.264 -7.141 1.00 32.34 ? 2 GLU B CG 1 +ATOM 438 C CD . GLU B 1 4 ? -13.733 -18.339 -8.000 1.00 35.33 ? 2 GLU B CD 1 +ATOM 439 O OE1 . GLU B 1 4 ? -13.134 -17.512 -8.736 1.00 36.56 ? 2 GLU B OE1 1 +ATOM 440 O OE2 . GLU B 1 4 ? -14.973 -18.344 -7.812 1.00 38.56 ? 2 GLU B OE2 1 +ATOM 441 N N . ARG B 1 5 ? -10.479 -20.963 -6.068 1.00 26.14 ? 3 ARG B N 1 +ATOM 442 C CA A ARG B 1 5 ? -9.354 -21.342 -6.960 0.50 26.56 ? 3 ARG B CA 1 +ATOM 443 C CA B ARG B 1 5 ? -9.354 -21.335 -6.955 0.50 25.91 ? 3 ARG B CA 1 +ATOM 444 C C . ARG B 1 5 ? -9.885 -21.937 -8.243 1.00 24.82 ? 3 ARG B C 1 +ATOM 445 O O . ARG B 1 5 ? -10.770 -22.765 -8.194 1.00 23.84 ? 3 ARG B O 1 +ATOM 446 C CB A ARG B 1 5 ? -8.475 -22.410 -6.309 0.50 26.43 ? 3 ARG B CB 1 +ATOM 447 C CB B ARG B 1 5 ? -8.446 -22.352 -6.260 0.50 24.94 ? 3 ARG B CB 1 +ATOM 448 C CG A ARG B 1 5 ? -7.851 -22.021 -5.022 0.50 28.17 ? 3 ARG B CG 1 +ATOM 449 C CG B ARG B 1 5 ? -7.778 -21.827 -5.027 0.50 26.14 ? 3 ARG B CG 1 +ATOM 450 C CD A ARG B 1 5 ? -7.382 -23.286 -4.352 0.50 28.14 ? 3 ARG B CD 1 +ATOM 451 C CD B ARG B 1 5 ? -6.474 -22.568 -4.739 0.50 26.07 ? 3 ARG B CD 1 +ATOM 452 N NE A ARG B 1 5 ? -7.056 -23.106 -2.985 0.50 28.09 ? 3 ARG B NE 1 +ATOM 453 N NE B ARG B 1 5 ? -5.900 -22.143 -3.485 0.50 27.39 ? 3 ARG B NE 1 +ATOM 454 C CZ A ARG B 1 5 ? -7.711 -23.754 -2.052 0.50 27.58 ? 3 ARG B CZ 1 +ATOM 455 C CZ B ARG B 1 5 ? -4.695 -22.493 -3.068 0.50 27.70 ? 3 ARG B CZ 1 +ATOM 456 N NH1 A ARG B 1 5 ? -8.685 -24.535 -2.421 0.50 25.69 ? 3 ARG B NH1 1 +ATOM 457 N NH1 B ARG B 1 5 ? -3.926 -23.280 -3.804 0.50 27.49 ? 3 ARG B NH1 1 +ATOM 458 N NH2 A ARG B 1 5 ? -7.368 -23.625 -0.790 0.50 27.93 ? 3 ARG B NH2 1 +ATOM 459 N NH2 B ARG B 1 5 ? -4.291 -22.054 -1.937 0.50 29.94 ? 3 ARG B NH2 1 +ATOM 460 N N . ARG B 1 6 ? -9.331 -21.510 -9.348 1.00 24.96 ? 4 ARG B N 1 +ATOM 461 C CA . ARG B 1 6 ? -9.737 -21.914 -10.680 1.00 24.62 ? 4 ARG B CA 1 +ATOM 462 C C . ARG B 1 6 ? -8.541 -22.433 -11.434 1.00 23.92 ? 4 ARG B C 1 +ATOM 463 O O . ARG B 1 6 ? -7.578 -21.728 -11.558 1.00 24.56 ? 4 ARG B O 1 +ATOM 464 C CB . ARG B 1 6 ? -10.306 -20.689 -11.444 1.00 28.21 ? 4 ARG B CB 1 +ATOM 465 C CG . ARG B 1 6 ? -11.729 -20.216 -10.971 1.00 30.35 ? 4 ARG B CG 1 +ATOM 466 C CD . ARG B 1 6 ? -12.145 -19.044 -11.782 1.00 34.48 ? 4 ARG B CD 1 +ATOM 467 N NE . ARG B 1 6 ? -12.322 -19.251 -13.209 1.00 34.73 ? 4 ARG B NE 1 +ATOM 468 C CZ . ARG B 1 6 ? -13.487 -19.244 -13.882 1.00 40.20 ? 4 ARG B CZ 1 +ATOM 469 N NH1 . ARG B 1 6 ? -14.669 -19.107 -13.246 1.00 40.84 ? 4 ARG B NH1 1 +ATOM 470 N NH2 . ARG B 1 6 ? -13.458 -19.337 -15.218 1.00 37.94 ? 4 ARG B NH2 1 +ATOM 471 N N . TYR B 1 7 ? -8.689 -23.637 -11.932 1.00 22.59 ? 5 TYR B N 1 +ATOM 472 C CA . TYR B 1 7 ? -7.657 -24.460 -12.619 1.00 24.61 ? 5 TYR B CA 1 +ATOM 473 C C . TYR B 1 7 ? -8.156 -24.718 -14.035 1.00 24.74 ? 5 TYR B C 1 +ATOM 474 O O . TYR B 1 7 ? -9.113 -25.460 -14.218 1.00 24.22 ? 5 TYR B O 1 +ATOM 475 C CB . TYR B 1 7 ? -7.501 -25.819 -11.930 1.00 25.22 ? 5 TYR B CB 1 +ATOM 476 C CG . TYR B 1 7 ? -7.148 -25.720 -10.502 1.00 25.17 ? 5 TYR B CG 1 +ATOM 477 C CD1 . TYR B 1 7 ? -8.156 -25.580 -9.561 1.00 25.22 ? 5 TYR B CD1 1 +ATOM 478 C CD2 . TYR B 1 7 ? -5.834 -25.683 -10.088 1.00 27.10 ? 5 TYR B CD2 1 +ATOM 479 C CE1 . TYR B 1 7 ? -7.856 -25.499 -8.265 1.00 24.90 ? 5 TYR B CE1 1 +ATOM 480 C CE2 . TYR B 1 7 ? -5.507 -25.530 -8.743 1.00 27.81 ? 5 TYR B CE2 1 +ATOM 481 C CZ . TYR B 1 7 ? -6.550 -25.448 -7.861 1.00 26.59 ? 5 TYR B CZ 1 +ATOM 482 O OH . TYR B 1 7 ? -6.297 -25.329 -6.504 1.00 28.23 ? 5 TYR B OH 1 +ATOM 483 N N . LYS B 1 8 ? -7.635 -23.959 -14.987 1.00 24.89 ? 6 LYS B N 1 +ATOM 484 C CA . LYS B 1 8 ? -8.007 -24.067 -16.381 1.00 25.69 ? 6 LYS B CA 1 +ATOM 485 C C . LYS B 1 8 ? -7.276 -25.213 -16.998 1.00 25.44 ? 6 LYS B C 1 +ATOM 486 O O . LYS B 1 8 ? -6.050 -25.325 -16.874 1.00 25.89 ? 6 LYS B O 1 +ATOM 487 C CB . LYS B 1 8 ? -7.769 -22.764 -17.120 1.00 26.50 ? 6 LYS B CB 1 +ATOM 488 C CG . LYS B 1 8 ? -8.421 -22.685 -18.527 1.00 27.66 ? 6 LYS B CG 1 +ATOM 489 C CD . LYS B 1 8 ? -8.085 -21.463 -19.321 1.00 28.95 ? 6 LYS B CD 1 +ATOM 490 C CE . LYS B 1 8 ? -6.560 -21.246 -19.435 1.00 30.54 ? 6 LYS B CE 1 +ATOM 491 N NZ . LYS B 1 8 ? -6.377 -19.865 -20.010 1.00 33.23 ? 6 LYS B NZ 1 +ATOM 492 N N . ARG B 1 9 ? -8.038 -26.086 -17.683 1.00 25.02 ? 7 ARG B N 1 +ATOM 493 C CA . ARG B 1 9 ? -7.446 -27.344 -18.232 1.00 26.90 ? 7 ARG B CA 1 +ATOM 494 C C . ARG B 1 9 ? -7.690 -27.551 -19.727 1.00 26.50 ? 7 ARG B C 1 +ATOM 495 O O . ARG B 1 9 ? -8.260 -28.548 -20.117 1.00 26.29 ? 7 ARG B O 1 +ATOM 496 C CB . ARG B 1 9 ? -7.977 -28.523 -17.407 1.00 28.04 ? 7 ARG B CB 1 +ATOM 497 C CG . ARG B 1 9 ? -7.550 -28.467 -15.917 1.00 28.67 ? 7 ARG B CG 1 +ATOM 498 C CD . ARG B 1 9 ? -6.094 -28.728 -15.776 1.00 33.03 ? 7 ARG B CD 1 +ATOM 499 N NE . ARG B 1 9 ? -5.655 -28.922 -14.390 1.00 34.77 ? 7 ARG B NE 1 +ATOM 500 C CZ . ARG B 1 9 ? -4.986 -28.005 -13.707 1.00 39.19 ? 7 ARG B CZ 1 +ATOM 501 N NH1 . ARG B 1 9 ? -4.651 -26.768 -14.250 1.00 40.84 ? 7 ARG B NH1 1 +ATOM 502 N NH2 . ARG B 1 9 ? -4.763 -28.255 -12.432 1.00 41.84 ? 7 ARG B NH2 1 +ATOM 503 N N . CYS B 1 10 ? -7.098 -26.652 -20.519 1.00 27.51 ? 8 CYS B N 1 +ATOM 504 C CA . CYS B 1 10 ? -7.173 -26.673 -21.988 1.00 27.16 ? 8 CYS B CA 1 +ATOM 505 C C . CYS B 1 10 ? -6.639 -27.940 -22.583 1.00 29.10 ? 8 CYS B C 1 +ATOM 506 O O . CYS B 1 10 ? -7.062 -28.367 -23.687 1.00 29.89 ? 8 CYS B O 1 +ATOM 507 C CB . CYS B 1 10 ? -6.505 -25.420 -22.632 1.00 27.85 ? 8 CYS B CB 1 +ATOM 508 S SG . CYS B 1 10 ? -7.300 -23.830 -22.207 1.00 26.28 ? 8 CYS B SG 1 +ATOM 509 N N . GLY B 1 11 ? -5.711 -28.595 -21.883 1.00 30.15 ? 9 GLY B N 1 +ATOM 510 C CA . GLY B 1 11 ? -5.129 -29.881 -22.396 1.00 32.23 ? 9 GLY B CA 1 +ATOM 511 C C . GLY B 1 11 ? -5.831 -31.172 -22.034 1.00 34.55 ? 9 GLY B C 1 +ATOM 512 O O . GLY B 1 11 ? -5.340 -32.244 -22.373 1.00 34.86 ? 9 GLY B O 1 +ATOM 513 N N . GLN B 1 12 ? -6.983 -31.102 -21.370 1.00 33.37 ? 10 GLN B N 1 +ATOM 514 C CA . GLN B 1 12 ? -7.654 -32.274 -20.879 1.00 37.15 ? 10 GLN B CA 1 +ATOM 515 C C . GLN B 1 12 ? -9.072 -32.269 -21.323 1.00 41.19 ? 10 GLN B C 1 +ATOM 516 O O . GLN B 1 12 ? -9.640 -31.202 -21.561 1.00 41.01 ? 10 GLN B O 1 +ATOM 517 C CB . GLN B 1 12 ? -7.730 -32.225 -19.379 1.00 36.77 ? 10 GLN B CB 1 +ATOM 518 C CG . GLN B 1 12 ? -6.391 -32.168 -18.727 1.00 35.83 ? 10 GLN B CG 1 +ATOM 519 C CD . GLN B 1 12 ? -6.509 -32.311 -17.228 1.00 37.61 ? 10 GLN B CD 1 +ATOM 520 O OE1 . GLN B 1 12 ? -7.582 -32.054 -16.615 1.00 32.32 ? 10 GLN B OE1 1 +ATOM 521 N NE2 . GLN B 1 12 ? -5.376 -32.640 -16.599 1.00 39.15 ? 10 GLN B NE2 1 +ATOM 522 N N . ASP B 1 13 ? -9.580 -33.506 -21.423 1.00 48.89 ? 11 ASP B N 1 +ATOM 523 C CA . ASP B 1 13 ? -10.935 -33.947 -21.603 1.00 55.71 ? 11 ASP B CA 1 +ATOM 524 C C . ASP B 1 13 ? -11.927 -33.420 -20.570 1.00 53.20 ? 11 ASP B C 1 +ATOM 525 O O . ASP B 1 13 ? -11.580 -33.270 -19.419 1.00 53.87 ? 11 ASP B O 1 +ATOM 526 C CB . ASP B 1 13 ? -10.826 -35.470 -21.565 1.00 63.73 ? 11 ASP B CB 1 +ATOM 527 C CG . ASP B 1 13 ? -11.934 -36.149 -22.271 1.00 71.75 ? 11 ASP B CG 1 +ATOM 528 O OD1 . ASP B 1 13 ? -11.869 -37.428 -22.270 1.00 83.23 ? 11 ASP B OD1 1 +ATOM 529 O OD2 . ASP B 1 13 ? -12.839 -35.433 -22.811 1.00 71.19 ? 11 ASP B OD2 1 +ATOM 530 N N . GLU B 1 14 ? -13.125 -33.043 -20.985 1.00 52.61 ? 12 GLU B N 1 +ATOM 531 C CA . GLU B 1 14 ? -14.124 -32.546 -20.062 1.00 50.56 ? 12 GLU B CA 1 +ATOM 532 C C . GLU B 1 14 ? -14.344 -33.538 -18.914 1.00 50.59 ? 12 GLU B C 1 +ATOM 533 O O . GLU B 1 14 ? -14.430 -33.168 -17.753 1.00 41.00 ? 12 GLU B O 1 +ATOM 534 C CB . GLU B 1 14 ? -15.410 -32.360 -20.820 1.00 54.43 ? 12 GLU B CB 1 +ATOM 535 C CG . GLU B 1 14 ? -16.573 -31.891 -19.959 1.00 55.73 ? 12 GLU B CG 1 +ATOM 536 C CD . GLU B 1 14 ? -17.873 -31.810 -20.737 1.00 61.23 ? 12 GLU B CD 1 +ATOM 537 O OE1 . GLU B 1 14 ? -17.889 -32.153 -21.954 1.00 69.21 ? 12 GLU B OE1 1 +ATOM 538 O OE2 . GLU B 1 14 ? -18.872 -31.369 -20.161 1.00 63.36 ? 12 GLU B OE2 1 +ATOM 539 N N . GLU B 1 15 ? -14.435 -34.822 -19.266 1.00 53.45 ? 13 GLU B N 1 +ATOM 540 C CA . GLU B 1 15 ? -14.669 -35.865 -18.266 1.00 55.07 ? 13 GLU B CA 1 +ATOM 541 C C . GLU B 1 15 ? -13.554 -35.979 -17.209 1.00 52.83 ? 13 GLU B C 1 +ATOM 542 O O . GLU B 1 15 ? -13.829 -36.196 -16.011 1.00 48.95 ? 13 GLU B O 1 +ATOM 543 C CB . GLU B 1 15 ? -14.927 -37.241 -18.913 1.00 62.08 ? 13 GLU B CB 1 +ATOM 544 C CG . GLU B 1 15 ? -16.361 -37.319 -19.405 1.00 66.22 ? 13 GLU B CG 1 +ATOM 545 C CD . GLU B 1 15 ? -17.364 -37.335 -18.248 1.00 69.25 ? 13 GLU B CD 1 +ATOM 546 O OE1 . GLU B 1 15 ? -18.544 -36.966 -18.518 1.00 71.56 ? 13 GLU B OE1 1 +ATOM 547 O OE2 . GLU B 1 15 ? -16.965 -37.702 -17.082 1.00 68.24 ? 13 GLU B OE2 1 +ATOM 548 N N . ARG B 1 16 ? -12.293 -35.821 -17.645 1.00 51.06 ? 14 ARG B N 1 +ATOM 549 C CA . ARG B 1 16 ? -11.113 -35.836 -16.735 1.00 49.15 ? 14 ARG B CA 1 +ATOM 550 C C . ARG B 1 16 ? -11.122 -34.636 -15.809 1.00 42.24 ? 14 ARG B C 1 +ATOM 551 O O . ARG B 1 16 ? -10.827 -34.765 -14.611 1.00 38.71 ? 14 ARG B O 1 +ATOM 552 C CB . ARG B 1 16 ? -9.785 -35.779 -17.511 1.00 51.20 ? 14 ARG B CB 1 +ATOM 553 C CG . ARG B 1 16 ? -8.568 -35.888 -16.620 1.00 52.10 ? 14 ARG B CG 1 +ATOM 554 C CD . ARG B 1 16 ? -7.300 -36.069 -17.407 1.00 54.09 ? 14 ARG B CD 1 +ATOM 555 N NE . ARG B 1 16 ? -6.199 -35.876 -16.459 1.00 56.07 ? 14 ARG B NE 1 +ATOM 556 C CZ . ARG B 1 16 ? -4.912 -35.758 -16.774 1.00 59.15 ? 14 ARG B CZ 1 +ATOM 557 N NH1 . ARG B 1 16 ? -4.015 -35.556 -15.802 1.00 58.85 ? 14 ARG B NH1 1 +ATOM 558 N NH2 . ARG B 1 16 ? -4.512 -35.828 -18.042 1.00 62.18 ? 14 ARG B NH2 1 +ATOM 559 N N . VAL B 1 17 ? -11.422 -33.482 -16.398 1.00 37.94 ? 15 VAL B N 1 +ATOM 560 C CA . VAL B 1 17 ? -11.479 -32.276 -15.638 1.00 35.23 ? 15 VAL B CA 1 +ATOM 561 C C . VAL B 1 17 ? -12.529 -32.480 -14.514 1.00 34.50 ? 15 VAL B C 1 +ATOM 562 O O . VAL B 1 17 ? -12.273 -32.129 -13.347 1.00 33.28 ? 15 VAL B O 1 +ATOM 563 C CB . VAL B 1 17 ? -11.763 -31.026 -16.547 1.00 33.06 ? 15 VAL B CB 1 +ATOM 564 C CG1 . VAL B 1 17 ? -11.901 -29.809 -15.733 1.00 30.15 ? 15 VAL B CG1 1 +ATOM 565 C CG2 . VAL B 1 17 ? -10.582 -30.778 -17.508 1.00 32.93 ? 15 VAL B CG2 1 +ATOM 566 N N . ARG B 1 18 ? -13.709 -33.019 -14.865 1.00 36.14 ? 16 ARG B N 1 +ATOM 567 C CA . ARG B 1 18 ? -14.820 -33.166 -13.922 1.00 37.68 ? 16 ARG B CA 1 +ATOM 568 C C . ARG B 1 18 ? -14.520 -34.091 -12.791 1.00 38.79 ? 16 ARG B C 1 +ATOM 569 O O . ARG B 1 18 ? -14.816 -33.826 -11.638 1.00 37.39 ? 16 ARG B O 1 +ATOM 570 C CB . ARG B 1 18 ? -16.052 -33.765 -14.572 1.00 43.86 ? 16 ARG B CB 1 +ATOM 571 C CG . ARG B 1 18 ? -17.313 -33.422 -13.793 1.00 47.06 ? 16 ARG B CG 1 +ATOM 572 C CD . ARG B 1 18 ? -18.632 -33.663 -14.555 1.00 54.75 ? 16 ARG B CD 1 +ATOM 573 N NE . ARG B 1 18 ? -19.270 -32.359 -14.903 1.00 54.29 ? 16 ARG B NE 1 +ATOM 574 C CZ . ARG B 1 18 ? -19.123 -31.706 -16.063 1.00 55.81 ? 16 ARG B CZ 1 +ATOM 575 N NH1 . ARG B 1 18 ? -18.385 -32.198 -17.089 1.00 56.65 ? 16 ARG B NH1 1 +ATOM 576 N NH2 . ARG B 1 18 ? -19.784 -30.547 -16.236 1.00 56.94 ? 16 ARG B NH2 1 +ATOM 577 N N . ARG B 1 19 ? -14.002 -35.256 -13.149 1.00 41.03 ? 17 ARG B N 1 +ATOM 578 C CA . ARG B 1 19 ? -13.530 -36.259 -12.188 1.00 42.81 ? 17 ARG B CA 1 +ATOM 579 C C . ARG B 1 19 ? -12.495 -35.695 -11.234 1.00 37.96 ? 17 ARG B C 1 +ATOM 580 O O . ARG B 1 19 ? -12.614 -35.886 -10.023 1.00 37.42 ? 17 ARG B O 1 +ATOM 581 C CB . ARG B 1 19 ? -12.894 -37.405 -12.971 1.00 47.76 ? 17 ARG B CB 1 +ATOM 582 C CG . ARG B 1 19 ? -12.634 -38.642 -12.137 1.00 53.02 ? 17 ARG B CG 1 +ATOM 583 C CD . ARG B 1 19 ? -11.475 -39.514 -12.701 1.00 58.47 ? 17 ARG B CD 1 +ATOM 584 N NE . ARG B 1 19 ? -11.331 -39.401 -14.163 1.00 60.32 ? 17 ARG B NE 1 +ATOM 585 C CZ . ARG B 1 19 ? -10.211 -39.062 -14.826 1.00 61.50 ? 17 ARG B CZ 1 +ATOM 586 N NH1 . ARG B 1 19 ? -9.028 -38.831 -14.207 1.00 59.77 ? 17 ARG B NH1 1 +ATOM 587 N NH2 . ARG B 1 19 ? -10.269 -39.020 -16.166 1.00 63.39 ? 17 ARG B NH2 1 +ATOM 588 N N . GLU B 1 20 ? -11.442 -35.062 -11.764 1.00 35.46 ? 18 GLU B N 1 +ATOM 589 C CA . GLU B 1 20 ? -10.380 -34.599 -10.884 1.00 33.50 ? 18 GLU B CA 1 +ATOM 590 C C . GLU B 1 20 ? -10.820 -33.381 -10.042 1.00 29.96 ? 18 GLU B C 1 +ATOM 591 O O . GLU B 1 20 ? -10.364 -33.161 -8.918 1.00 30.89 ? 18 GLU B O 1 +ATOM 592 C CB . GLU B 1 20 ? -9.103 -34.291 -11.671 1.00 34.47 ? 18 GLU B CB 1 +ATOM 593 C CG . GLU B 1 20 ? -8.432 -35.495 -12.302 1.00 37.91 ? 18 GLU B CG 1 +ATOM 594 C CD . GLU B 1 20 ? -7.129 -35.170 -13.021 1.00 38.84 ? 18 GLU B CD 1 +ATOM 595 O OE1 . GLU B 1 20 ? -6.601 -36.090 -13.667 1.00 42.74 ? 18 GLU B OE1 1 +ATOM 596 O OE2 . GLU B 1 20 ? -6.628 -34.013 -12.931 1.00 37.93 ? 18 GLU B OE2 1 +ATOM 597 N N . CYS B 1 21 ? -11.744 -32.577 -10.565 1.00 28.26 ? 19 CYS B N 1 +ATOM 598 C CA . CYS B 1 21 ? -12.332 -31.478 -9.817 1.00 24.98 ? 19 CYS B CA 1 +ATOM 599 C C . CYS B 1 21 ? -13.116 -31.944 -8.573 1.00 25.30 ? 19 CYS B C 1 +ATOM 600 O O . CYS B 1 21 ? -13.012 -31.352 -7.498 1.00 22.15 ? 19 CYS B O 1 +ATOM 601 C CB . CYS B 1 21 ? -13.226 -30.623 -10.732 1.00 25.02 ? 19 CYS B CB 1 +ATOM 602 S SG . CYS B 1 21 ? -13.567 -28.995 -10.153 1.00 24.01 ? 19 CYS B SG 1 +ATOM 603 N N . LYS B 1 22 ? -13.961 -32.944 -8.793 1.00 28.60 ? 20 LYS B N 1 +ATOM 604 C CA . LYS B 1 22 ? -14.763 -33.592 -7.737 1.00 29.54 ? 20 LYS B CA 1 +ATOM 605 C C . LYS B 1 22 ? -13.875 -34.162 -6.643 1.00 30.88 ? 20 LYS B C 1 +ATOM 606 O O . LYS B 1 22 ? -14.118 -33.921 -5.457 1.00 29.31 ? 20 LYS B O 1 +ATOM 607 C CB . LYS B 1 22 ? -15.572 -34.704 -8.310 1.00 32.70 ? 20 LYS B CB 1 +ATOM 608 C CG . LYS B 1 22 ? -16.308 -35.540 -7.293 1.00 34.25 ? 20 LYS B CG 1 +ATOM 609 C CD . LYS B 1 22 ? -17.205 -36.485 -8.055 1.00 38.92 ? 20 LYS B CD 1 +ATOM 610 C CE . LYS B 1 22 ? -18.300 -37.005 -7.185 1.00 42.69 ? 20 LYS B CE 1 +ATOM 611 N NZ . LYS B 1 22 ? -17.755 -37.962 -6.205 1.00 45.45 ? 20 LYS B NZ 1 +ATOM 612 N N . GLU B 1 23 ? -12.885 -34.935 -7.060 1.00 33.28 ? 21 GLU B N 1 +ATOM 613 C CA . GLU B 1 23 ? -11.798 -35.391 -6.160 1.00 35.82 ? 21 GLU B CA 1 +ATOM 614 C C . GLU B 1 23 ? -11.167 -34.258 -5.337 1.00 33.15 ? 21 GLU B C 1 +ATOM 615 O O . GLU B 1 23 ? -11.052 -34.354 -4.112 1.00 33.76 ? 21 GLU B O 1 +ATOM 616 C CB . GLU B 1 23 ? -10.676 -36.085 -6.965 1.00 40.72 ? 21 GLU B CB 1 +ATOM 617 C CG . GLU B 1 23 ? -10.994 -37.516 -7.345 1.00 47.27 ? 21 GLU B CG 1 +ATOM 618 C CD . GLU B 1 23 ? -10.052 -38.164 -8.383 1.00 51.95 ? 21 GLU B CD 1 +ATOM 619 O OE1 . GLU B 1 23 ? -9.128 -37.530 -8.971 1.00 53.22 ? 21 GLU B OE1 1 +ATOM 620 O OE2 . GLU B 1 23 ? -10.291 -39.359 -8.633 1.00 61.27 ? 21 GLU B OE2 1 +ATOM 621 N N . ARG B 1 24 ? -10.836 -33.170 -6.001 1.00 29.85 ? 22 ARG B N 1 +ATOM 622 C CA . ARG B 1 24 ? -10.133 -32.059 -5.349 1.00 27.97 ? 22 ARG B CA 1 +ATOM 623 C C . ARG B 1 24 ? -11.033 -31.331 -4.320 1.00 26.95 ? 22 ARG B C 1 +ATOM 624 O O . ARG B 1 24 ? -10.645 -31.042 -3.194 1.00 27.88 ? 22 ARG B O 1 +ATOM 625 C CB . ARG B 1 24 ? -9.590 -31.110 -6.474 1.00 25.56 ? 22 ARG B CB 1 +ATOM 626 C CG . ARG B 1 24 ? -8.972 -29.789 -6.026 1.00 23.99 ? 22 ARG B CG 1 +ATOM 627 C CD . ARG B 1 24 ? -8.565 -28.929 -7.225 1.00 23.94 ? 22 ARG B CD 1 +ATOM 628 N NE . ARG B 1 24 ? -7.585 -29.525 -8.117 1.00 24.23 ? 22 ARG B NE 1 +ATOM 629 C CZ . ARG B 1 24 ? -6.271 -29.454 -7.924 1.00 25.18 ? 22 ARG B CZ 1 +ATOM 630 N NH1 . ARG B 1 24 ? -5.756 -28.873 -6.856 1.00 26.29 ? 22 ARG B NH1 1 +ATOM 631 N NH2 . ARG B 1 24 ? -5.444 -29.980 -8.823 1.00 26.69 ? 22 ARG B NH2 1 +ATOM 632 N N . GLY B 1 25 ? -12.251 -31.028 -4.709 1.00 27.32 ? 23 GLY B N 1 +ATOM 633 C CA . GLY B 1 25 ? -13.270 -30.483 -3.785 1.00 25.20 ? 23 GLY B CA 1 +ATOM 634 C C . GLY B 1 25 ? -13.513 -31.400 -2.563 1.00 26.05 ? 23 GLY B C 1 +ATOM 635 O O . GLY B 1 25 ? -13.445 -30.972 -1.411 1.00 25.28 ? 23 GLY B O 1 +ATOM 636 N N . GLU B 1 26 ? -13.829 -32.671 -2.838 1.00 26.56 ? 24 GLU B N 1 +ATOM 637 C CA . GLU B 1 26 ? -14.266 -33.586 -1.792 1.00 28.01 ? 24 GLU B CA 1 +ATOM 638 C C . GLU B 1 26 ? -13.170 -33.797 -0.795 1.00 29.60 ? 24 GLU B C 1 +ATOM 639 O O . GLU B 1 26 ? -13.448 -33.790 0.392 1.00 31.26 ? 24 GLU B O 1 +ATOM 640 C CB . GLU B 1 26 ? -14.779 -34.881 -2.393 1.00 30.58 ? 24 GLU B CB 1 +ATOM 641 C CG . GLU B 1 26 ? -16.128 -34.575 -3.070 1.00 30.85 ? 24 GLU B CG 1 +ATOM 642 C CD . GLU B 1 26 ? -16.871 -35.778 -3.552 1.00 34.62 ? 24 GLU B CD 1 +ATOM 643 O OE1 . GLU B 1 26 ? -16.277 -36.847 -3.840 1.00 35.99 ? 24 GLU B OE1 1 +ATOM 644 O OE2 . GLU B 1 26 ? -18.085 -35.582 -3.704 1.00 37.54 ? 24 GLU B OE2 1 +ATOM 645 N N . ARG B 1 27 ? -11.928 -33.937 -1.255 1.00 29.77 ? 25 ARG B N 1 +ATOM 646 C CA . ARG B 1 27 ? -10.768 -34.133 -0.346 1.00 32.08 ? 25 ARG B CA 1 +ATOM 647 C C . ARG B 1 27 ? -10.574 -32.991 0.701 1.00 29.53 ? 25 ARG B C 1 +ATOM 648 O O . ARG B 1 27 ? -10.069 -33.158 1.742 1.00 31.49 ? 25 ARG B O 1 +ATOM 649 C CB . ARG B 1 27 ? -9.573 -34.338 -1.292 1.00 34.13 ? 25 ARG B CB 1 +ATOM 650 C CG . ARG B 1 27 ? -8.205 -34.327 -0.708 1.00 40.08 ? 25 ARG B CG 1 +ATOM 651 C CD . ARG B 1 27 ? -7.138 -34.275 -1.820 1.00 40.59 ? 25 ARG B CD 1 +ATOM 652 N NE . ARG B 1 27 ? -6.954 -32.959 -2.408 1.00 41.03 ? 25 ARG B NE 1 +ATOM 653 C CZ . ARG B 1 27 ? -6.717 -32.738 -3.709 1.00 42.25 ? 25 ARG B CZ 1 +ATOM 654 N NH1 . ARG B 1 27 ? -6.679 -33.720 -4.666 1.00 44.47 ? 25 ARG B NH1 1 +ATOM 655 N NH2 . ARG B 1 27 ? -6.563 -31.477 -4.089 1.00 43.31 ? 25 ARG B NH2 1 +ATOM 656 N N . GLN B 1 28 ? -10.978 -31.810 0.350 1.00 27.97 ? 26 GLN B N 1 +ATOM 657 C CA . GLN B 1 28 ? -10.769 -30.589 1.112 1.00 29.61 ? 26 GLN B CA 1 +ATOM 658 C C . GLN B 1 28 ? -12.042 -30.126 1.772 1.00 28.24 ? 26 GLN B C 1 +ATOM 659 O O . GLN B 1 28 ? -12.032 -29.060 2.367 1.00 27.36 ? 26 GLN B O 1 +ATOM 660 C CB . GLN B 1 28 ? -10.401 -29.428 0.097 1.00 28.71 ? 26 GLN B CB 1 +ATOM 661 C CG . GLN B 1 28 ? -9.075 -29.487 -0.494 1.00 31.47 ? 26 GLN B CG 1 +ATOM 662 C CD . GLN B 1 28 ? -8.958 -28.339 -1.402 1.00 29.42 ? 26 GLN B CD 1 +ATOM 663 O OE1 . GLN B 1 28 ? -9.262 -28.426 -2.547 1.00 27.94 ? 26 GLN B OE1 1 +ATOM 664 N NE2 . GLN B 1 28 ? -8.619 -27.218 -0.843 1.00 31.91 ? 26 GLN B NE2 1 +ATOM 665 N N . ASN B 1 29 ? -13.171 -30.796 1.498 1.00 29.26 ? 27 ASN B N 1 +ATOM 666 C CA . ASN B 1 29 ? -14.481 -30.240 1.801 1.00 27.36 ? 27 ASN B CA 1 +ATOM 667 C C . ASN B 1 29 ? -14.651 -28.803 1.356 1.00 26.94 ? 27 ASN B C 1 +ATOM 668 O O . ASN B 1 29 ? -15.083 -27.921 2.129 1.00 24.52 ? 27 ASN B O 1 +ATOM 669 C CB . ASN B 1 29 ? -14.829 -30.365 3.276 1.00 28.89 ? 27 ASN B CB 1 +ATOM 670 C CG . ASN B 1 29 ? -14.871 -31.794 3.745 1.00 30.01 ? 27 ASN B CG 1 +ATOM 671 O OD1 . ASN B 1 29 ? -15.264 -32.710 3.009 1.00 30.18 ? 27 ASN B OD1 1 +ATOM 672 N ND2 . ASN B 1 29 ? -14.506 -31.992 4.970 1.00 29.36 ? 27 ASN B ND2 1 +ATOM 673 N N . CYS B 1 30 ? -14.339 -28.566 0.072 1.00 24.63 ? 28 CYS B N 1 +ATOM 674 C CA . CYS B 1 30 ? -14.675 -27.329 -0.604 1.00 24.76 ? 28 CYS B CA 1 +ATOM 675 C C . CYS B 1 30 ? -15.696 -27.657 -1.715 1.00 24.96 ? 28 CYS B C 1 +ATOM 676 O O . CYS B 1 30 ? -15.606 -28.758 -2.255 1.00 25.79 ? 28 CYS B O 1 +ATOM 677 C CB . CYS B 1 30 ? -13.364 -26.713 -1.161 1.00 25.56 ? 28 CYS B CB 1 +ATOM 678 S SG . CYS B 1 30 ? -12.327 -26.160 0.220 1.00 27.87 ? 28 CYS B SG 1 +ATOM 679 N N . GLN B 1 31 ? -16.585 -26.687 -2.034 1.00 23.93 ? 29 GLN B N 1 +ATOM 680 C CA . GLN B 1 31 ? -17.408 -26.777 -3.147 1.00 26.14 ? 29 GLN B CA 1 +ATOM 681 C C . GLN B 1 31 ? -16.540 -26.885 -4.430 1.00 25.20 ? 29 GLN B C 1 +ATOM 682 O O . GLN B 1 31 ? -15.563 -26.153 -4.639 1.00 21.41 ? 29 GLN B O 1 +ATOM 683 C CB . GLN B 1 31 ? -18.398 -25.580 -3.252 1.00 27.39 ? 29 GLN B CB 1 +ATOM 684 C CG . GLN B 1 31 ? -19.412 -25.555 -2.073 1.00 30.39 ? 29 GLN B CG 1 +ATOM 685 C CD . GLN B 1 31 ? -20.428 -24.444 -2.099 1.00 32.90 ? 29 GLN B CD 1 +ATOM 686 O OE1 . GLN B 1 31 ? -20.636 -23.784 -3.141 1.00 37.74 ? 29 GLN B OE1 1 +ATOM 687 N NE2 . GLN B 1 31 ? -21.095 -24.230 -0.991 1.00 32.90 ? 29 GLN B NE2 1 +ATOM 688 N N . TYR B 1 32 ? -17.020 -27.720 -5.348 1.00 25.97 ? 30 TYR B N 1 +ATOM 689 C CA . TYR B 1 32 ? -16.413 -27.739 -6.705 1.00 25.40 ? 30 TYR B CA 1 +ATOM 690 C C . TYR B 1 32 ? -17.453 -27.586 -7.790 1.00 28.46 ? 30 TYR B C 1 +ATOM 691 O O . TYR B 1 32 ? -18.629 -27.990 -7.618 1.00 27.34 ? 30 TYR B O 1 +ATOM 692 C CB . TYR B 1 32 ? -15.664 -29.004 -6.896 1.00 25.55 ? 30 TYR B CB 1 +ATOM 693 C CG . TYR B 1 32 ? -16.524 -30.243 -7.041 1.00 28.13 ? 30 TYR B CG 1 +ATOM 694 C CD1 . TYR B 1 32 ? -17.004 -30.646 -8.302 1.00 29.47 ? 30 TYR B CD1 1 +ATOM 695 C CD2 . TYR B 1 32 ? -16.896 -30.985 -5.929 1.00 30.55 ? 30 TYR B CD2 1 +ATOM 696 C CE1 . TYR B 1 32 ? -17.753 -31.757 -8.430 1.00 31.04 ? 30 TYR B CE1 1 +ATOM 697 C CE2 . TYR B 1 32 ? -17.730 -32.090 -6.054 1.00 30.81 ? 30 TYR B CE2 1 +ATOM 698 C CZ . TYR B 1 32 ? -18.137 -32.472 -7.309 1.00 32.36 ? 30 TYR B CZ 1 +ATOM 699 O OH . TYR B 1 32 ? -18.965 -33.555 -7.444 1.00 36.16 ? 30 TYR B OH 1 +ATOM 700 N N . GLN B 1 33 ? -17.043 -26.913 -8.878 1.00 26.80 ? 31 GLN B N 1 +ATOM 701 C CA . GLN B 1 33 ? -17.919 -26.611 -9.971 1.00 30.54 ? 31 GLN B CA 1 +ATOM 702 C C . GLN B 1 33 ? -17.089 -26.566 -11.272 1.00 30.87 ? 31 GLN B C 1 +ATOM 703 O O . GLN B 1 33 ? -15.898 -26.253 -11.230 1.00 26.65 ? 31 GLN B O 1 +ATOM 704 C CB . GLN B 1 33 ? -18.615 -25.292 -9.686 1.00 33.89 ? 31 GLN B CB 1 +ATOM 705 C CG . GLN B 1 33 ? -19.583 -24.903 -10.747 1.00 41.93 ? 31 GLN B CG 1 +ATOM 706 C CD . GLN B 1 33 ? -20.358 -23.603 -10.415 1.00 48.52 ? 31 GLN B CD 1 +ATOM 707 O OE1 . GLN B 1 33 ? -20.270 -23.111 -9.285 1.00 47.27 ? 31 GLN B OE1 1 +ATOM 708 N NE2 . GLN B 1 33 ? -21.054 -23.023 -11.420 1.00 48.19 ? 31 GLN B NE2 1 +ATOM 709 N N . ILE B 1 34 ? -17.660 -27.066 -12.362 1.00 32.46 ? 32 ILE B N 1 +ATOM 710 C CA . ILE B 1 34 ? -16.944 -27.150 -13.621 1.00 33.31 ? 32 ILE B CA 1 +ATOM 711 C C . ILE B 1 34 ? -17.489 -26.031 -14.471 1.00 34.68 ? 32 ILE B C 1 +ATOM 712 O O . ILE B 1 34 ? -18.718 -25.885 -14.607 1.00 37.18 ? 32 ILE B O 1 +ATOM 713 C CB . ILE B 1 34 ? -17.008 -28.525 -14.297 1.00 35.85 ? 32 ILE B CB 1 +ATOM 714 C CG1 . ILE B 1 34 ? -16.049 -29.498 -13.638 1.00 36.21 ? 32 ILE B CG1 1 +ATOM 715 C CG2 . ILE B 1 34 ? -16.554 -28.429 -15.761 1.00 37.42 ? 32 ILE B CG2 1 +ATOM 716 C CD1 . ILE B 1 34 ? -16.575 -30.103 -12.352 1.00 37.21 ? 32 ILE B CD1 1 +ATOM 717 N N . ARG B 1 35 ? -16.559 -25.160 -14.918 1.00 33.90 ? 33 ARG B N 1 +ATOM 718 C CA . ARG B 1 35 ? -16.922 -23.971 -15.679 1.00 37.88 ? 33 ARG B CA 1 +ATOM 719 C C . ARG B 1 35 ? -16.198 -24.088 -17.036 1.00 36.46 ? 33 ARG B C 1 +ATOM 720 O O . ARG B 1 35 ? -15.459 -25.036 -17.274 1.00 34.84 ? 33 ARG B O 1 +ATOM 721 C CB . ARG B 1 35 ? -16.457 -22.696 -14.957 1.00 38.26 ? 33 ARG B CB 1 +ATOM 722 C CG . ARG B 1 35 ? -16.741 -22.628 -13.443 1.00 41.89 ? 33 ARG B CG 1 +ATOM 723 C CD . ARG B 1 35 ? -18.246 -22.630 -13.208 1.00 46.17 ? 33 ARG B CD 1 +ATOM 724 N NE . ARG B 1 35 ? -18.887 -21.322 -13.244 1.00 52.35 ? 33 ARG B NE 1 +ATOM 725 C CZ . ARG B 1 35 ? -19.128 -20.528 -12.182 1.00 59.33 ? 33 ARG B CZ 1 +ATOM 726 N NH1 . ARG B 1 35 ? -18.747 -20.863 -10.954 1.00 60.15 ? 33 ARG B NH1 1 +ATOM 727 N NH2 . ARG B 1 35 ? -19.786 -19.365 -12.344 1.00 66.14 ? 33 ARG B NH2 1 +ATOM 728 N N . LYS B 1 36 ? -16.397 -23.098 -17.867 1.00 37.21 ? 34 LYS B N 1 +ATOM 729 C CA . LYS B 1 36 ? -15.627 -23.009 -19.119 1.00 39.14 ? 34 LYS B CA 1 +ATOM 730 C C . LYS B 1 36 ? -15.020 -21.628 -19.229 1.00 40.42 ? 34 LYS B C 1 +ATOM 731 O O . LYS B 1 36 ? -15.679 -20.633 -18.969 1.00 43.22 ? 34 LYS B O 1 +ATOM 732 C CB . LYS B 1 36 ? -16.503 -23.319 -20.314 1.00 39.91 ? 34 LYS B CB 1 +ATOM 733 C CG . LYS B 1 36 ? -16.864 -24.751 -20.461 1.00 39.58 ? 34 LYS B CG 1 +ATOM 734 C CD . LYS B 1 36 ? -17.494 -25.040 -21.811 1.00 42.94 ? 34 LYS B CD 1 +ATOM 735 C CE . LYS B 1 36 ? -16.445 -25.191 -22.904 1.00 41.87 ? 34 LYS B CE 1 +ATOM 736 N NZ . LYS B 1 36 ? -17.153 -25.690 -24.106 1.00 43.21 ? 34 LYS B NZ 1 +ATOM 737 N N . GLU B 1 37 ? -13.830 -21.578 -19.783 1.00 40.06 ? 35 GLU B N 1 +ATOM 738 C CA . GLU B 1 37 ? -13.278 -20.336 -20.323 1.00 39.96 ? 35 GLU B CA 1 +ATOM 739 C C . GLU B 1 37 ? -13.007 -20.581 -21.790 1.00 37.75 ? 35 GLU B C 1 +ATOM 740 O O . GLU B 1 37 ? -12.140 -21.413 -22.147 1.00 35.89 ? 35 GLU B O 1 +ATOM 741 C CB . GLU B 1 37 ? -11.999 -20.023 -19.616 1.00 41.36 ? 35 GLU B CB 1 +ATOM 742 C CG . GLU B 1 37 ? -11.900 -18.585 -19.200 1.00 44.53 ? 35 GLU B CG 1 +ATOM 743 C CD . GLU B 1 37 ? -10.942 -18.358 -18.058 1.00 47.29 ? 35 GLU B CD 1 +ATOM 744 O OE1 . GLU B 1 37 ? -11.317 -17.958 -16.875 1.00 42.34 ? 35 GLU B OE1 1 +ATOM 745 O OE2 . GLU B 1 37 ? -9.786 -18.561 -18.420 1.00 47.62 ? 35 GLU B OE2 1 +ATOM 746 N N . GLY B 1 38 ? -13.761 -19.903 -22.654 1.00 36.42 ? 36 GLY B N 1 +ATOM 747 C CA . GLY B 1 38 ? -13.653 -20.222 -24.036 1.00 38.03 ? 36 GLY B CA 1 +ATOM 748 C C . GLY B 1 38 ? -14.106 -21.655 -24.159 1.00 36.20 ? 36 GLY B C 1 +ATOM 749 O O . GLY B 1 38 ? -15.223 -21.994 -23.758 1.00 38.91 ? 36 GLY B O 1 +ATOM 750 N N . ASN B 1 39 ? -13.340 -22.453 -24.887 1.00 33.95 ? 37 ASN B N 1 +ATOM 751 C CA . ASN B 1 39 ? -13.667 -23.858 -25.078 1.00 32.51 ? 37 ASN B CA 1 +ATOM 752 C C . ASN B 1 39 ? -12.947 -24.800 -24.114 1.00 30.10 ? 37 ASN B C 1 +ATOM 753 O O . ASN B 1 39 ? -13.077 -26.002 -24.281 1.00 29.35 ? 37 ASN B O 1 +ATOM 754 C CB . ASN B 1 39 ? -13.339 -24.327 -26.535 1.00 33.97 ? 37 ASN B CB 1 +ATOM 755 C CG . ASN B 1 39 ? -13.996 -25.665 -26.868 1.00 35.78 ? 37 ASN B CG 1 +ATOM 756 O OD1 . ASN B 1 39 ? -15.140 -25.977 -26.381 1.00 34.62 ? 37 ASN B OD1 1 +ATOM 757 N ND2 . ASN B 1 39 ? -13.312 -26.484 -27.622 1.00 36.55 ? 37 ASN B ND2 1 +ATOM 758 N N . CYS B 1 40 ? -12.190 -24.239 -23.143 1.00 27.54 ? 38 CYS B N 1 +ATOM 759 C CA . CYS B 1 40 ? -11.484 -24.952 -22.131 1.00 26.89 ? 38 CYS B CA 1 +ATOM 760 C C . CYS B 1 40 ? -12.271 -25.134 -20.828 1.00 27.07 ? 38 CYS B C 1 +ATOM 761 O O . CYS B 1 40 ? -12.846 -24.156 -20.308 1.00 24.39 ? 38 CYS B O 1 +ATOM 762 C CB . CYS B 1 40 ? -10.192 -24.164 -21.776 1.00 25.62 ? 38 CYS B CB 1 +ATOM 763 S SG . CYS B 1 40 ? -9.074 -23.932 -23.169 1.00 27.28 ? 38 CYS B SG 1 +ATOM 764 N N . TYR B 1 41 ? -12.284 -26.356 -20.307 1.00 28.24 ? 39 TYR B N 1 +ATOM 765 C CA . TYR B 1 41 ? -12.934 -26.639 -19.048 1.00 27.63 ? 39 TYR B CA 1 +ATOM 766 C C . TYR B 1 41 ? -12.037 -26.153 -17.904 1.00 26.02 ? 39 TYR B C 1 +ATOM 767 O O . TYR B 1 41 ? -10.830 -26.245 -18.003 1.00 22.10 ? 39 TYR B O 1 +ATOM 768 C CB . TYR B 1 41 ? -13.348 -28.119 -18.881 1.00 30.47 ? 39 TYR B CB 1 +ATOM 769 C CG . TYR B 1 41 ? -14.405 -28.423 -19.820 1.00 32.83 ? 39 TYR B CG 1 +ATOM 770 C CD1 . TYR B 1 41 ? -14.100 -28.817 -21.123 1.00 34.86 ? 39 TYR B CD1 1 +ATOM 771 C CD2 . TYR B 1 41 ? -15.723 -28.161 -19.489 1.00 35.92 ? 39 TYR B CD2 1 +ATOM 772 C CE1 . TYR B 1 41 ? -15.091 -29.019 -22.076 1.00 38.70 ? 39 TYR B CE1 1 +ATOM 773 C CE2 . TYR B 1 41 ? -16.731 -28.384 -20.426 1.00 39.39 ? 39 TYR B CE2 1 +ATOM 774 C CZ . TYR B 1 41 ? -16.403 -28.805 -21.719 1.00 41.98 ? 39 TYR B CZ 1 +ATOM 775 O OH . TYR B 1 41 ? -17.400 -28.986 -22.662 1.00 44.85 ? 39 TYR B OH 1 +ATOM 776 N N . VAL B 1 42 ? -12.695 -25.734 -16.819 1.00 24.96 ? 40 VAL B N 1 +ATOM 777 C CA . VAL B 1 42 ? -12.095 -25.060 -15.642 1.00 24.93 ? 40 VAL B CA 1 +ATOM 778 C C . VAL B 1 42 ? -12.688 -25.700 -14.365 1.00 23.49 ? 40 VAL B C 1 +ATOM 779 O O . VAL B 1 42 ? -13.842 -25.921 -14.294 1.00 22.83 ? 40 VAL B O 1 +ATOM 780 C CB . VAL B 1 42 ? -12.400 -23.521 -15.596 1.00 24.65 ? 40 VAL B CB 1 +ATOM 781 C CG1 . VAL B 1 42 ? -11.885 -22.827 -14.352 1.00 23.73 ? 40 VAL B CG1 1 +ATOM 782 C CG2 . VAL B 1 42 ? -11.796 -22.804 -16.841 1.00 25.21 ? 40 VAL B CG2 1 +ATOM 783 N N . CYS B 1 43 ? -11.811 -26.177 -13.481 1.00 21.75 ? 41 CYS B N 1 +ATOM 784 C CA . CYS B 1 43 ? -12.229 -26.658 -12.164 1.00 22.70 ? 41 CYS B CA 1 +ATOM 785 C C . CYS B 1 43 ? -12.196 -25.420 -11.271 1.00 23.04 ? 41 CYS B C 1 +ATOM 786 O O . CYS B 1 43 ? -11.133 -24.810 -11.074 1.00 18.98 ? 41 CYS B O 1 +ATOM 787 C CB . CYS B 1 43 ? -11.252 -27.705 -11.623 1.00 25.10 ? 41 CYS B CB 1 +ATOM 788 S SG . CYS B 1 43 ? -11.673 -28.201 -9.923 1.00 23.03 ? 41 CYS B SG 1 +ATOM 789 N N . GLU B 1 44 ? -13.362 -25.051 -10.748 1.00 21.49 ? 42 GLU B N 1 +ATOM 790 C CA . GLU B 1 44 ? -13.458 -23.992 -9.824 1.00 24.18 ? 42 GLU B CA 1 +ATOM 791 C C . GLU B 1 44 ? -13.734 -24.574 -8.423 1.00 23.80 ? 42 GLU B C 1 +ATOM 792 O O . GLU B 1 44 ? -14.706 -25.319 -8.199 1.00 21.70 ? 42 GLU B O 1 +ATOM 793 C CB . GLU B 1 44 ? -14.599 -23.048 -10.221 1.00 24.93 ? 42 GLU B CB 1 +ATOM 794 C CG . GLU B 1 44 ? -14.863 -22.014 -9.155 1.00 28.00 ? 42 GLU B CG 1 +ATOM 795 C CD . GLU B 1 44 ? -16.102 -21.197 -9.513 1.00 31.79 ? 42 GLU B CD 1 +ATOM 796 O OE1 . GLU B 1 44 ? -17.133 -21.334 -8.806 1.00 33.07 ? 42 GLU B OE1 1 +ATOM 797 O OE2 . GLU B 1 44 ? -15.980 -20.388 -10.439 1.00 30.90 ? 42 GLU B OE2 1 +ATOM 798 N N . ILE B 1 45 ? -12.896 -24.225 -7.489 1.00 24.33 ? 43 ILE B N 1 +ATOM 799 C CA . ILE B 1 45 ? -12.952 -24.770 -6.096 1.00 25.64 ? 43 ILE B CA 1 +ATOM 800 C C . ILE B 1 45 ? -13.301 -23.534 -5.259 1.00 25.12 ? 43 ILE B C 1 +ATOM 801 O O . ILE B 1 45 ? -12.661 -22.523 -5.418 1.00 26.04 ? 43 ILE B O 1 +ATOM 802 C CB . ILE B 1 45 ? -11.561 -25.391 -5.635 1.00 27.99 ? 43 ILE B CB 1 +ATOM 803 C CG1 . ILE B 1 45 ? -11.190 -26.594 -6.524 1.00 26.71 ? 43 ILE B CG1 1 +ATOM 804 C CG2 . ILE B 1 45 ? -11.580 -25.756 -4.134 1.00 28.13 ? 43 ILE B CG2 1 +ATOM 805 C CD1 . ILE B 1 45 ? -12.188 -27.713 -6.498 1.00 26.74 ? 43 ILE B CD1 1 +ATOM 806 N N . ARG B 1 46 ? -14.327 -23.630 -4.412 1.00 25.65 ? 44 ARG B N 1 +ATOM 807 C CA . ARG B 1 46 ? -14.718 -22.578 -3.465 1.00 26.21 ? 44 ARG B CA 1 +ATOM 808 C C . ARG B 1 46 ? -14.731 -23.072 -2.041 1.00 26.02 ? 44 ARG B C 1 +ATOM 809 O O . ARG B 1 46 ? -15.538 -23.933 -1.598 1.00 22.75 ? 44 ARG B O 1 +ATOM 810 C CB . ARG B 1 46 ? -16.086 -21.981 -3.732 1.00 28.94 ? 44 ARG B CB 1 +ATOM 811 C CG . ARG B 1 46 ? -16.197 -21.354 -5.092 1.00 29.10 ? 44 ARG B CG 1 +ATOM 812 C CD . ARG B 1 46 ? -17.484 -20.553 -5.254 1.00 33.93 ? 44 ARG B CD 1 +ATOM 813 N NE . ARG B 1 46 ? -17.421 -19.738 -6.522 1.00 36.44 ? 44 ARG B NE 1 +ATOM 814 C CZ . ARG B 1 46 ? -18.408 -18.986 -7.022 1.00 39.44 ? 44 ARG B CZ 1 +ATOM 815 N NH1 . ARG B 1 46 ? -19.571 -18.896 -6.394 1.00 41.67 ? 44 ARG B NH1 1 +ATOM 816 N NH2 . ARG B 1 46 ? -18.234 -18.340 -8.182 1.00 39.19 ? 44 ARG B NH2 1 +ATOM 817 N N . CYS B 1 47 ? -13.784 -22.517 -1.323 1.00 26.61 ? 45 CYS B N 1 +ATOM 818 C CA . CYS B 1 47 ? -13.520 -22.915 0.063 1.00 27.14 ? 45 CYS B CA 1 +ATOM 819 C C . CYS B 1 47 ? -14.009 -21.712 0.929 1.00 29.09 ? 45 CYS B C 1 +ATOM 820 O O . CYS B 1 47 ? -14.166 -20.522 0.628 1.00 29.61 ? 45 CYS B O 1 +ATOM 821 C CB . CYS B 1 47 ? -11.995 -23.178 0.291 1.00 27.03 ? 45 CYS B CB 1 +ATOM 822 S SG . CYS B 1 47 ? -11.312 -24.638 -0.525 1.00 25.41 ? 45 CYS B SG 1 +ATOM 823 O OXT . CYS B 1 47 ? -14.207 -22.019 2.048 1.00 31.12 ? 45 CYS B OXT 1 +ATOM 824 N N . GLY C 1 1 ? -9.702 2.451 -5.516 1.00 82.75 ? -1 GLY C N 1 +ATOM 825 C CA . GLY C 1 1 ? -10.463 1.462 -6.329 1.00 75.82 ? -1 GLY C CA 1 +ATOM 826 C C . GLY C 1 1 ? -9.639 0.417 -7.081 1.00 72.43 ? -1 GLY C C 1 +ATOM 827 O O . GLY C 1 1 ? -8.613 -0.049 -6.606 1.00 74.08 ? -1 GLY C O 1 +ATOM 828 N N . SER C 1 2 ? -10.122 0.019 -8.251 1.00 68.85 ? 0 SER C N 1 +ATOM 829 C CA . SER C 1 2 ? -9.428 -1.005 -9.066 1.00 67.14 ? 0 SER C CA 1 +ATOM 830 C C . SER C 1 2 ? -9.531 -0.812 -10.611 1.00 61.39 ? 0 SER C C 1 +ATOM 831 O O . SER C 1 2 ? -10.453 -0.150 -11.101 1.00 61.76 ? 0 SER C O 1 +ATOM 832 C CB . SER C 1 2 ? -9.960 -2.387 -8.722 1.00 63.99 ? 0 SER C CB 1 +ATOM 833 O OG . SER C 1 2 ? -9.375 -3.305 -9.610 1.00 61.73 ? 0 SER C OG 1 +ATOM 834 N N . GLU C 1 3 ? -8.601 -1.432 -11.351 1.00 58.81 ? 1 GLU C N 1 +ATOM 835 C CA . GLU C 1 3 ? -8.727 -1.546 -12.821 1.00 54.00 ? 1 GLU C CA 1 +ATOM 836 C C . GLU C 1 3 ? -9.630 -2.700 -13.312 1.00 46.04 ? 1 GLU C C 1 +ATOM 837 O O . GLU C 1 3 ? -10.104 -2.629 -14.448 1.00 39.21 ? 1 GLU C O 1 +ATOM 838 C CB . GLU C 1 3 ? -7.353 -1.598 -13.481 1.00 58.59 ? 1 GLU C CB 1 +ATOM 839 C CG . GLU C 1 3 ? -6.581 -0.328 -13.235 1.00 65.71 ? 1 GLU C CG 1 +ATOM 840 C CD . GLU C 1 3 ? -7.037 0.837 -14.101 1.00 68.08 ? 1 GLU C CD 1 +ATOM 841 O OE1 . GLU C 1 3 ? -6.303 1.109 -15.089 1.00 73.93 ? 1 GLU C OE1 1 +ATOM 842 O OE2 . GLU C 1 3 ? -8.090 1.470 -13.797 1.00 68.51 ? 1 GLU C OE2 1 +ATOM 843 N N . GLU C 1 4 ? -9.913 -3.719 -12.465 1.00 41.76 ? 2 GLU C N 1 +ATOM 844 C CA . GLU C 1 4 ? -10.975 -4.700 -12.744 1.00 37.54 ? 2 GLU C CA 1 +ATOM 845 C C . GLU C 1 4 ? -12.006 -4.588 -11.623 1.00 36.95 ? 2 GLU C C 1 +ATOM 846 O O . GLU C 1 4 ? -11.654 -4.529 -10.425 1.00 34.54 ? 2 GLU C O 1 +ATOM 847 C CB . GLU C 1 4 ? -10.537 -6.153 -12.863 1.00 38.82 ? 2 GLU C CB 1 +ATOM 848 C CG . GLU C 1 4 ? -9.610 -6.457 -14.094 1.00 40.03 ? 2 GLU C CG 1 +ATOM 849 C CD . GLU C 1 4 ? -9.166 -7.962 -14.322 1.00 43.01 ? 2 GLU C CD 1 +ATOM 850 O OE1 . GLU C 1 4 ? -9.608 -8.923 -13.566 1.00 43.92 ? 2 GLU C OE1 1 +ATOM 851 O OE2 . GLU C 1 4 ? -8.283 -8.177 -15.240 1.00 43.92 ? 2 GLU C OE2 1 +ATOM 852 N N . ARG C 1 5 ? -13.231 -4.451 -12.043 1.00 32.99 ? 3 ARG C N 1 +ATOM 853 C CA . ARG C 1 5 ? -14.402 -4.375 -11.133 1.00 35.68 ? 3 ARG C CA 1 +ATOM 854 C C . ARG C 1 5 ? -15.485 -5.276 -11.566 1.00 30.53 ? 3 ARG C C 1 +ATOM 855 O O . ARG C 1 5 ? -15.755 -5.398 -12.772 1.00 25.19 ? 3 ARG C O 1 +ATOM 856 C CB . ARG C 1 5 ? -14.998 -2.972 -11.110 1.00 40.20 ? 3 ARG C CB 1 +ATOM 857 C CG . ARG C 1 5 ? -14.063 -1.911 -10.481 1.00 47.89 ? 3 ARG C CG 1 +ATOM 858 C CD . ARG C 1 5 ? -14.428 -0.544 -10.994 1.00 52.55 ? 3 ARG C CD 1 +ATOM 859 N NE . ARG C 1 5 ? -13.263 0.153 -11.595 1.00 63.06 ? 3 ARG C NE 1 +ATOM 860 C CZ . ARG C 1 5 ? -12.870 0.092 -12.896 1.00 59.86 ? 3 ARG C CZ 1 +ATOM 861 N NH1 . ARG C 1 5 ? -11.821 0.833 -13.285 1.00 64.28 ? 3 ARG C NH1 1 +ATOM 862 N NH2 . ARG C 1 5 ? -13.460 -0.697 -13.783 1.00 54.61 ? 3 ARG C NH2 1 +ATOM 863 N N . ARG C 1 6 ? -16.117 -5.945 -10.604 1.00 27.93 ? 4 ARG C N 1 +ATOM 864 C CA . ARG C 1 6 ? -17.306 -6.768 -10.894 1.00 26.87 ? 4 ARG C CA 1 +ATOM 865 C C . ARG C 1 6 ? -18.505 -6.348 -10.103 1.00 26.36 ? 4 ARG C C 1 +ATOM 866 O O . ARG C 1 6 ? -18.377 -6.026 -8.910 1.00 25.21 ? 4 ARG C O 1 +ATOM 867 C CB . ARG C 1 6 ? -17.147 -8.217 -10.439 1.00 29.48 ? 4 ARG C CB 1 +ATOM 868 C CG . ARG C 1 6 ? -16.294 -9.047 -11.312 1.00 30.62 ? 4 ARG C CG 1 +ATOM 869 C CD . ARG C 1 6 ? -16.179 -10.462 -10.809 1.00 31.90 ? 4 ARG C CD 1 +ATOM 870 N NE . ARG C 1 6 ? -15.235 -11.109 -11.663 1.00 31.53 ? 4 ARG C NE 1 +ATOM 871 C CZ . ARG C 1 6 ? -14.710 -12.268 -11.400 1.00 34.29 ? 4 ARG C CZ 1 +ATOM 872 N NH1 . ARG C 1 6 ? -15.105 -12.969 -10.320 1.00 35.74 ? 4 ARG C NH1 1 +ATOM 873 N NH2 . ARG C 1 6 ? -13.837 -12.730 -12.243 1.00 35.28 ? 4 ARG C NH2 1 +ATOM 874 N N . TYR C 1 7 ? -19.658 -6.396 -10.765 1.00 24.63 ? 5 TYR C N 1 +ATOM 875 C CA . TYR C 1 7 ? -20.947 -5.825 -10.206 1.00 26.76 ? 5 TYR C CA 1 +ATOM 876 C C . TYR C 1 7 ? -22.028 -6.947 -10.361 1.00 24.59 ? 5 TYR C C 1 +ATOM 877 O O . TYR C 1 7 ? -22.407 -7.245 -11.479 1.00 24.16 ? 5 TYR C O 1 +ATOM 878 C CB . TYR C 1 7 ? -21.396 -4.581 -11.040 1.00 27.83 ? 5 TYR C CB 1 +ATOM 879 C CG . TYR C 1 7 ? -20.417 -3.490 -11.070 1.00 29.82 ? 5 TYR C CG 1 +ATOM 880 C CD1 . TYR C 1 7 ? -20.284 -2.619 -9.985 1.00 35.84 ? 5 TYR C CD1 1 +ATOM 881 C CD2 . TYR C 1 7 ? -19.682 -3.226 -12.215 1.00 30.66 ? 5 TYR C CD2 1 +ATOM 882 C CE1 . TYR C 1 7 ? -19.345 -1.580 -9.990 1.00 37.07 ? 5 TYR C CE1 1 +ATOM 883 C CE2 . TYR C 1 7 ? -18.709 -2.233 -12.235 1.00 33.28 ? 5 TYR C CE2 1 +ATOM 884 C CZ . TYR C 1 7 ? -18.540 -1.414 -11.158 1.00 35.87 ? 5 TYR C CZ 1 +ATOM 885 O OH . TYR C 1 7 ? -17.646 -0.391 -11.204 1.00 39.25 ? 5 TYR C OH 1 +ATOM 886 N N . LYS C 1 8 ? -22.446 -7.566 -9.266 1.00 25.06 ? 6 LYS C N 1 +ATOM 887 C CA . LYS C 1 8 ? -23.539 -8.572 -9.280 1.00 26.12 ? 6 LYS C CA 1 +ATOM 888 C C . LYS C 1 8 ? -24.929 -7.910 -9.217 1.00 24.85 ? 6 LYS C C 1 +ATOM 889 O O . LYS C 1 8 ? -25.120 -6.998 -8.417 1.00 24.11 ? 6 LYS C O 1 +ATOM 890 C CB . LYS C 1 8 ? -23.399 -9.570 -8.148 1.00 29.65 ? 6 LYS C CB 1 +ATOM 891 C CG . LYS C 1 8 ? -24.305 -10.814 -8.251 1.00 29.39 ? 6 LYS C CG 1 +ATOM 892 C CD . LYS C 1 8 ? -24.306 -11.717 -7.028 1.00 32.97 ? 6 LYS C CD 1 +ATOM 893 C CE . LYS C 1 8 ? -24.547 -11.009 -5.681 1.00 36.82 ? 6 LYS C CE 1 +ATOM 894 N NZ . LYS C 1 8 ? -24.185 -11.910 -4.551 1.00 36.95 ? 6 LYS C NZ 1 +ATOM 895 N N . ARG C 1 9 ? -25.832 -8.291 -10.131 1.00 24.84 ? 7 ARG C N 1 +ATOM 896 C CA . ARG C 1 9 ? -27.097 -7.543 -10.315 1.00 25.87 ? 7 ARG C CA 1 +ATOM 897 C C . ARG C 1 9 ? -28.366 -8.387 -10.188 1.00 25.04 ? 7 ARG C C 1 +ATOM 898 O O . ARG C 1 9 ? -29.065 -8.562 -11.150 1.00 23.27 ? 7 ARG C O 1 +ATOM 899 C CB . ARG C 1 9 ? -27.069 -6.812 -11.684 1.00 27.86 ? 7 ARG C CB 1 +ATOM 900 C CG . ARG C 1 9 ? -25.997 -5.752 -11.813 1.00 31.46 ? 7 ARG C CG 1 +ATOM 901 C CD . ARG C 1 9 ? -26.465 -4.433 -11.212 1.00 35.90 ? 7 ARG C CD 1 +ATOM 902 N NE . ARG C 1 9 ? -25.687 -4.132 -10.053 1.00 41.04 ? 7 ARG C NE 1 +ATOM 903 C CZ . ARG C 1 9 ? -24.711 -3.204 -9.946 1.00 47.23 ? 7 ARG C CZ 1 +ATOM 904 N NH1 . ARG C 1 9 ? -24.101 -3.054 -8.731 1.00 49.30 ? 7 ARG C NH1 1 +ATOM 905 N NH2 . ARG C 1 9 ? -24.298 -2.447 -10.997 1.00 47.57 ? 7 ARG C NH2 1 +ATOM 906 N N . CYS C 1 10 ? -28.576 -8.972 -9.002 1.00 24.54 ? 8 CYS C N 1 +ATOM 907 C CA . CYS C 1 10 ? -29.628 -9.884 -8.768 1.00 25.84 ? 8 CYS C CA 1 +ATOM 908 C C . CYS C 1 10 ? -30.983 -9.194 -8.928 1.00 26.04 ? 8 CYS C C 1 +ATOM 909 O O . CYS C 1 10 ? -31.966 -9.847 -9.191 1.00 27.71 ? 8 CYS C O 1 +ATOM 910 C CB . CYS C 1 10 ? -29.550 -10.556 -7.345 1.00 27.30 ? 8 CYS C CB 1 +ATOM 911 S SG . CYS C 1 10 ? -28.102 -11.632 -7.101 1.00 28.04 ? 8 CYS C SG 1 +ATOM 912 N N . GLY C 1 11 ? -31.007 -7.888 -8.721 1.00 26.50 ? 9 GLY C N 1 +ATOM 913 C CA . GLY C 1 11 ? -32.263 -7.117 -8.870 1.00 29.80 ? 9 GLY C CA 1 +ATOM 914 C C . GLY C 1 11 ? -32.544 -6.670 -10.320 1.00 29.79 ? 9 GLY C C 1 +ATOM 915 O O . GLY C 1 11 ? -33.434 -5.890 -10.531 1.00 30.56 ? 9 GLY C O 1 +ATOM 916 N N . GLN C 1 12 ? -31.856 -7.254 -11.290 1.00 29.16 ? 10 GLN C N 1 +ATOM 917 C CA . GLN C 1 12 ? -32.106 -6.973 -12.694 1.00 31.63 ? 10 GLN C CA 1 +ATOM 918 C C . GLN C 1 12 ? -32.114 -8.221 -13.535 1.00 32.72 ? 10 GLN C C 1 +ATOM 919 O O . GLN C 1 12 ? -31.450 -9.186 -13.222 1.00 30.37 ? 10 GLN C O 1 +ATOM 920 C CB . GLN C 1 12 ? -30.925 -6.143 -13.209 1.00 30.79 ? 10 GLN C CB 1 +ATOM 921 C CG . GLN C 1 12 ? -30.691 -4.916 -12.415 1.00 31.34 ? 10 GLN C CG 1 +ATOM 922 C CD . GLN C 1 12 ? -29.619 -4.027 -13.014 1.00 30.38 ? 10 GLN C CD 1 +ATOM 923 O OE1 . GLN C 1 12 ? -28.825 -4.448 -13.855 1.00 29.86 ? 10 GLN C OE1 1 +ATOM 924 N NE2 . GLN C 1 12 ? -29.543 -2.837 -12.496 1.00 30.55 ? 10 GLN C NE2 1 +ATOM 925 N N . ASP C 1 13 ? -32.832 -8.168 -14.651 1.00 34.99 ? 11 ASP C N 1 +ATOM 926 C CA . ASP C 1 13 ? -32.774 -9.252 -15.595 1.00 35.77 ? 11 ASP C CA 1 +ATOM 927 C C . ASP C 1 13 ? -31.498 -9.231 -16.505 1.00 34.72 ? 11 ASP C C 1 +ATOM 928 O O . ASP C 1 13 ? -30.741 -8.244 -16.610 1.00 30.65 ? 11 ASP C O 1 +ATOM 929 C CB . ASP C 1 13 ? -34.081 -9.371 -16.409 1.00 39.68 ? 11 ASP C CB 1 +ATOM 930 C CG . ASP C 1 13 ? -34.303 -8.214 -17.390 1.00 45.25 ? 11 ASP C CG 1 +ATOM 931 O OD1 . ASP C 1 13 ? -35.455 -8.108 -17.848 1.00 47.19 ? 11 ASP C OD1 1 +ATOM 932 O OD2 . ASP C 1 13 ? -33.371 -7.453 -17.725 1.00 43.72 ? 11 ASP C OD2 1 +ATOM 933 N N . GLU C 1 14 ? -31.317 -10.347 -17.157 1.00 35.56 ? 12 GLU C N 1 +ATOM 934 C CA . GLU C 1 14 ? -30.165 -10.535 -17.993 1.00 37.30 ? 12 GLU C CA 1 +ATOM 935 C C . GLU C 1 14 ? -30.076 -9.418 -19.053 1.00 36.15 ? 12 GLU C C 1 +ATOM 936 O O . GLU C 1 14 ? -28.991 -8.908 -19.330 1.00 33.07 ? 12 GLU C O 1 +ATOM 937 C CB . GLU C 1 14 ? -30.287 -11.893 -18.687 1.00 40.54 ? 12 GLU C CB 1 +ATOM 938 C CG . GLU C 1 14 ? -29.117 -12.204 -19.587 1.00 43.81 ? 12 GLU C CG 1 +ATOM 939 C CD . GLU C 1 14 ? -29.265 -13.513 -20.307 1.00 47.51 ? 12 GLU C CD 1 +ATOM 940 O OE1 . GLU C 1 14 ? -30.347 -14.147 -20.205 1.00 52.88 ? 12 GLU C OE1 1 +ATOM 941 O OE2 . GLU C 1 14 ? -28.295 -13.879 -21.009 1.00 48.21 ? 12 GLU C OE2 1 +ATOM 942 N N . GLU C 1 15 ? -31.224 -9.082 -19.675 1.00 39.23 ? 13 GLU C N 1 +ATOM 943 C CA . GLU C 1 15 ? -31.196 -8.145 -20.800 1.00 43.47 ? 13 GLU C CA 1 +ATOM 944 C C . GLU C 1 15 ? -30.528 -6.841 -20.321 1.00 39.16 ? 13 GLU C C 1 +ATOM 945 O O . GLU C 1 15 ? -29.632 -6.332 -20.964 1.00 37.14 ? 13 GLU C O 1 +ATOM 946 C CB . GLU C 1 15 ? -32.591 -7.903 -21.333 1.00 52.51 ? 13 GLU C CB 1 +ATOM 947 C CG . GLU C 1 15 ? -32.675 -7.114 -22.650 1.00 61.40 ? 13 GLU C CG 1 +ATOM 948 C CD . GLU C 1 15 ? -32.606 -5.577 -22.499 1.00 65.78 ? 13 GLU C CD 1 +ATOM 949 O OE1 . GLU C 1 15 ? -32.154 -4.914 -23.497 1.00 71.31 ? 13 GLU C OE1 1 +ATOM 950 O OE2 . GLU C 1 15 ? -33.009 -5.053 -21.406 1.00 66.28 ? 13 GLU C OE2 1 +ATOM 951 N N . ARG C 1 16 ? -30.947 -6.378 -19.143 1.00 33.82 ? 14 ARG C N 1 +ATOM 952 C CA . ARG C 1 16 ? -30.545 -5.086 -18.645 1.00 32.39 ? 14 ARG C CA 1 +ATOM 953 C C . ARG C 1 16 ? -29.097 -5.094 -18.265 1.00 28.57 ? 14 ARG C C 1 +ATOM 954 O O . ARG C 1 16 ? -28.409 -4.135 -18.452 1.00 29.65 ? 14 ARG C O 1 +ATOM 955 C CB . ARG C 1 16 ? -31.389 -4.734 -17.388 1.00 33.47 ? 14 ARG C CB 1 +ATOM 956 C CG . ARG C 1 16 ? -31.110 -3.333 -16.845 1.00 35.37 ? 14 ARG C CG 1 +ATOM 957 C CD . ARG C 1 16 ? -32.122 -2.924 -15.803 1.00 40.94 ? 14 ARG C CD 1 +ATOM 958 N NE . ARG C 1 16 ? -31.678 -1.705 -15.156 1.00 45.20 ? 14 ARG C NE 1 +ATOM 959 C CZ . ARG C 1 16 ? -32.108 -1.245 -13.967 1.00 51.88 ? 14 ARG C CZ 1 +ATOM 960 N NH1 . ARG C 1 16 ? -33.026 -1.898 -13.244 1.00 54.53 ? 14 ARG C NH1 1 +ATOM 961 N NH2 . ARG C 1 16 ? -31.653 -0.076 -13.497 1.00 55.44 ? 14 ARG C NH2 1 +ATOM 962 N N . VAL C 1 17 ? -28.698 -6.165 -17.621 1.00 25.86 ? 15 VAL C N 1 +ATOM 963 C CA . VAL C 1 17 ? -27.344 -6.272 -17.097 1.00 24.99 ? 15 VAL C CA 1 +ATOM 964 C C . VAL C 1 17 ? -26.362 -6.210 -18.299 1.00 25.62 ? 15 VAL C C 1 +ATOM 965 O O . VAL C 1 17 ? -25.377 -5.473 -18.226 1.00 23.68 ? 15 VAL C O 1 +ATOM 966 C CB . VAL C 1 17 ? -27.159 -7.578 -16.250 1.00 23.21 ? 15 VAL C CB 1 +ATOM 967 C CG1 . VAL C 1 17 ? -25.730 -7.712 -15.828 1.00 22.85 ? 15 VAL C CG1 1 +ATOM 968 C CG2 . VAL C 1 17 ? -27.983 -7.526 -14.997 1.00 23.96 ? 15 VAL C CG2 1 +ATOM 969 N N . ARG C 1 18 ? -26.684 -6.967 -19.355 1.00 27.64 ? 16 ARG C N 1 +ATOM 970 C CA . ARG C 1 18 ? -25.861 -7.079 -20.543 1.00 30.52 ? 16 ARG C CA 1 +ATOM 971 C C . ARG C 1 18 ? -25.737 -5.766 -21.246 1.00 29.59 ? 16 ARG C C 1 +ATOM 972 O O . ARG C 1 18 ? -24.663 -5.321 -21.580 1.00 30.98 ? 16 ARG C O 1 +ATOM 973 C CB . ARG C 1 18 ? -26.470 -8.112 -21.543 1.00 33.72 ? 16 ARG C CB 1 +ATOM 974 C CG . ARG C 1 18 ? -26.146 -9.540 -21.161 1.00 36.22 ? 16 ARG C CG 1 +ATOM 975 C CD . ARG C 1 18 ? -26.855 -10.499 -22.082 1.00 41.42 ? 16 ARG C CD 1 +ATOM 976 N NE . ARG C 1 18 ? -26.650 -11.848 -21.638 1.00 42.77 ? 16 ARG C NE 1 +ATOM 977 C CZ . ARG C 1 18 ? -25.474 -12.494 -21.625 1.00 43.32 ? 16 ARG C CZ 1 +ATOM 978 N NH1 . ARG C 1 18 ? -24.305 -11.983 -22.112 1.00 42.52 ? 16 ARG C NH1 1 +ATOM 979 N NH2 . ARG C 1 18 ? -25.481 -13.737 -21.153 1.00 45.35 ? 16 ARG C NH2 1 +ATOM 980 N N . ARG C 1 19 ? -26.877 -5.181 -21.519 1.00 31.87 ? 17 ARG C N 1 +ATOM 981 C CA . ARG C 1 19 ? -26.962 -3.855 -22.090 1.00 32.06 ? 17 ARG C CA 1 +ATOM 982 C C . ARG C 1 19 ? -26.195 -2.801 -21.267 1.00 29.84 ? 17 ARG C C 1 +ATOM 983 O O . ARG C 1 19 ? -25.454 -2.052 -21.841 1.00 29.33 ? 17 ARG C O 1 +ATOM 984 C CB . ARG C 1 19 ? -28.413 -3.432 -22.138 1.00 37.22 ? 17 ARG C CB 1 +ATOM 985 C CG . ARG C 1 19 ? -28.638 -2.326 -23.114 1.00 40.82 ? 17 ARG C CG 1 +ATOM 986 C CD . ARG C 1 19 ? -29.994 -1.689 -23.003 1.00 45.49 ? 17 ARG C CD 1 +ATOM 987 N NE . ARG C 1 19 ? -30.212 -1.112 -21.671 1.00 45.51 ? 17 ARG C NE 1 +ATOM 988 C CZ . ARG C 1 19 ? -31.187 -1.427 -20.847 1.00 45.90 ? 17 ARG C CZ 1 +ATOM 989 N NH1 . ARG C 1 19 ? -32.098 -2.358 -21.143 1.00 46.68 ? 17 ARG C NH1 1 +ATOM 990 N NH2 . ARG C 1 19 ? -31.257 -0.766 -19.680 1.00 47.82 ? 17 ARG C NH2 1 +ATOM 991 N N . GLU C 1 20 ? -26.445 -2.681 -19.942 1.00 27.31 ? 18 GLU C N 1 +ATOM 992 C CA . GLU C 1 20 ? -25.825 -1.638 -19.204 1.00 27.05 ? 18 GLU C CA 1 +ATOM 993 C C . GLU C 1 20 ? -24.299 -1.935 -19.024 1.00 24.64 ? 18 GLU C C 1 +ATOM 994 O O . GLU C 1 20 ? -23.502 -0.997 -18.962 1.00 25.95 ? 18 GLU C O 1 +ATOM 995 C CB . GLU C 1 20 ? -26.431 -1.442 -17.847 1.00 29.08 ? 18 GLU C CB 1 +ATOM 996 C CG . GLU C 1 20 ? -27.833 -0.841 -17.871 1.00 32.27 ? 18 GLU C CG 1 +ATOM 997 C CD . GLU C 1 20 ? -28.377 -0.583 -16.480 1.00 35.15 ? 18 GLU C CD 1 +ATOM 998 O OE1 . GLU C 1 20 ? -29.566 -0.223 -16.395 1.00 39.37 ? 18 GLU C OE1 1 +ATOM 999 O OE2 . GLU C 1 20 ? -27.640 -0.731 -15.485 1.00 33.80 ? 18 GLU C OE2 1 +ATOM 1000 N N . CYS C 1 21 ? -23.922 -3.192 -19.034 1.00 22.83 ? 19 CYS C N 1 +ATOM 1001 C CA . CYS C 1 21 ? -22.450 -3.573 -18.926 1.00 22.41 ? 19 CYS C CA 1 +ATOM 1002 C C . CYS C 1 21 ? -21.725 -3.153 -20.185 1.00 23.73 ? 19 CYS C C 1 +ATOM 1003 O O . CYS C 1 21 ? -20.674 -2.552 -20.145 1.00 25.14 ? 19 CYS C O 1 +ATOM 1004 C CB . CYS C 1 21 ? -22.282 -5.070 -18.727 1.00 21.67 ? 19 CYS C CB 1 +ATOM 1005 S SG . CYS C 1 21 ? -20.684 -5.717 -18.121 1.00 21.86 ? 19 CYS C SG 1 +ATOM 1006 N N . LYS C 1 22 ? -22.304 -3.465 -21.333 1.00 24.79 ? 20 LYS C N 1 +ATOM 1007 C CA . LYS C 1 22 ? -21.821 -2.992 -22.653 1.00 27.32 ? 20 LYS C CA 1 +ATOM 1008 C C . LYS C 1 22 ? -21.714 -1.523 -22.734 1.00 29.47 ? 20 LYS C C 1 +ATOM 1009 O O . LYS C 1 22 ? -20.685 -1.001 -23.262 1.00 31.46 ? 20 LYS C O 1 +ATOM 1010 C CB . LYS C 1 22 ? -22.783 -3.465 -23.758 1.00 31.05 ? 20 LYS C CB 1 +ATOM 1011 C CG . LYS C 1 22 ? -22.467 -3.021 -25.157 1.00 34.76 ? 20 LYS C CG 1 +ATOM 1012 C CD . LYS C 1 22 ? -23.404 -3.768 -26.082 1.00 39.30 ? 20 LYS C CD 1 +ATOM 1013 C CE . LYS C 1 22 ? -22.893 -3.738 -27.473 1.00 42.87 ? 20 LYS C CE 1 +ATOM 1014 N NZ . LYS C 1 22 ? -23.036 -2.374 -28.054 1.00 46.87 ? 20 LYS C NZ 1 +ATOM 1015 N N . GLU C 1 23 ? -22.814 -0.810 -22.374 1.00 31.99 ? 21 GLU C N 1 +ATOM 1016 C CA . GLU C 1 23 ? -22.832 0.653 -22.303 1.00 34.30 ? 21 GLU C CA 1 +ATOM 1017 C C . GLU C 1 23 ? -21.653 1.201 -21.451 1.00 34.63 ? 21 GLU C C 1 +ATOM 1018 O O . GLU C 1 23 ? -20.940 2.058 -21.904 1.00 33.02 ? 21 GLU C O 1 +ATOM 1019 C CB . GLU C 1 23 ? -24.115 1.176 -21.709 1.00 39.44 ? 21 GLU C CB 1 +ATOM 1020 C CG . GLU C 1 23 ? -25.246 1.274 -22.737 1.00 43.20 ? 21 GLU C CG 1 +ATOM 1021 C CD . GLU C 1 23 ? -26.646 1.562 -22.154 1.00 46.47 ? 21 GLU C CD 1 +ATOM 1022 O OE1 . GLU C 1 23 ? -26.903 1.550 -20.880 1.00 45.28 ? 21 GLU C OE1 1 +ATOM 1023 O OE2 . GLU C 1 23 ? -27.526 1.735 -23.039 1.00 49.29 ? 21 GLU C OE2 1 +ATOM 1024 N N . ARG C 1 24 ? -21.482 0.641 -20.256 1.00 33.55 ? 22 ARG C N 1 +ATOM 1025 C CA . ARG C 1 24 ? -20.460 1.035 -19.338 1.00 37.05 ? 22 ARG C CA 1 +ATOM 1026 C C . ARG C 1 24 ? -19.049 0.829 -19.987 1.00 34.32 ? 22 ARG C C 1 +ATOM 1027 O O . ARG C 1 24 ? -18.204 1.715 -19.916 1.00 35.92 ? 22 ARG C O 1 +ATOM 1028 C CB . ARG C 1 24 ? -20.651 0.285 -18.010 1.00 39.86 ? 22 ARG C CB 1 +ATOM 1029 C CG . ARG C 1 24 ? -19.515 0.415 -16.993 1.00 47.05 ? 22 ARG C CG 1 +ATOM 1030 C CD . ARG C 1 24 ? -19.828 1.364 -15.881 1.00 51.50 ? 22 ARG C CD 1 +ATOM 1031 N NE . ARG C 1 24 ? -21.072 0.962 -15.215 1.00 62.35 ? 22 ARG C NE 1 +ATOM 1032 C CZ . ARG C 1 24 ? -21.240 0.723 -13.906 1.00 63.07 ? 22 ARG C CZ 1 +ATOM 1033 N NH1 . ARG C 1 24 ? -20.249 0.891 -13.038 1.00 61.71 ? 22 ARG C NH1 1 +ATOM 1034 N NH2 . ARG C 1 24 ? -22.451 0.327 -13.475 1.00 64.01 ? 22 ARG C NH2 1 +ATOM 1035 N N . GLY C 1 25 ? -18.783 -0.348 -20.528 1.00 29.45 ? 23 GLY C N 1 +ATOM 1036 C CA . GLY C 1 25 ? -17.478 -0.668 -21.092 1.00 28.96 ? 23 GLY C CA 1 +ATOM 1037 C C . GLY C 1 25 ? -17.203 0.274 -22.255 1.00 29.41 ? 23 GLY C C 1 +ATOM 1038 O O . GLY C 1 25 ? -16.202 0.991 -22.251 1.00 30.73 ? 23 GLY C O 1 +ATOM 1039 N N . GLU C 1 26 ? -18.194 0.405 -23.137 1.00 30.82 ? 24 GLU C N 1 +ATOM 1040 C CA . GLU C 1 26 ? -17.988 1.158 -24.419 1.00 32.29 ? 24 GLU C CA 1 +ATOM 1041 C C . GLU C 1 26 ? -17.788 2.642 -24.143 1.00 36.16 ? 24 GLU C C 1 +ATOM 1042 O O . GLU C 1 26 ? -16.862 3.241 -24.645 1.00 35.81 ? 24 GLU C O 1 +ATOM 1043 C CB . GLU C 1 26 ? -19.089 0.864 -25.389 1.00 32.79 ? 24 GLU C CB 1 +ATOM 1044 C CG . GLU C 1 26 ? -18.948 -0.552 -25.907 1.00 31.06 ? 24 GLU C CG 1 +ATOM 1045 C CD . GLU C 1 26 ? -19.923 -0.944 -26.943 1.00 33.96 ? 24 GLU C CD 1 +ATOM 1046 O OE1 . GLU C 1 26 ? -21.016 -0.283 -27.126 1.00 37.05 ? 24 GLU C OE1 1 +ATOM 1047 O OE2 . GLU C 1 26 ? -19.570 -1.895 -27.660 1.00 32.97 ? 24 GLU C OE2 1 +ATOM 1048 N N . ARG C 1 27 ? -18.587 3.200 -23.229 1.00 38.25 ? 25 ARG C N 1 +ATOM 1049 C CA . ARG C 1 27 ? -18.440 4.631 -22.801 1.00 42.49 ? 25 ARG C CA 1 +ATOM 1050 C C . ARG C 1 27 ? -17.064 4.981 -22.160 1.00 41.93 ? 25 ARG C C 1 +ATOM 1051 O O . ARG C 1 27 ? -16.558 6.085 -22.298 1.00 46.27 ? 25 ARG C O 1 +ATOM 1052 C CB . ARG C 1 27 ? -19.613 4.924 -21.813 1.00 42.67 ? 25 ARG C CB 1 +ATOM 1053 C CG . ARG C 1 27 ? -19.605 6.247 -21.076 1.00 47.59 ? 25 ARG C CG 1 +ATOM 1054 C CD . ARG C 1 27 ? -20.249 6.111 -19.691 1.00 48.38 ? 25 ARG C CD 1 +ATOM 1055 N NE . ARG C 1 27 ? -21.475 5.326 -19.793 1.00 48.24 ? 25 ARG C NE 1 +ATOM 1056 C CZ . ARG C 1 27 ? -21.943 4.490 -18.869 1.00 47.60 ? 25 ARG C CZ 1 +ATOM 1057 N NH1 . ARG C 1 27 ? -21.356 4.392 -17.637 1.00 46.93 ? 25 ARG C NH1 1 +ATOM 1058 N NH2 . ARG C 1 27 ? -23.035 3.757 -19.161 1.00 46.46 ? 25 ARG C NH2 1 +ATOM 1059 N N . GLN C 1 28 ? -16.447 4.012 -21.518 1.00 40.39 ? 26 GLN C N 1 +ATOM 1060 C CA . GLN C 1 28 ? -15.171 4.179 -20.841 1.00 41.78 ? 26 GLN C CA 1 +ATOM 1061 C C . GLN C 1 28 ? -13.989 3.606 -21.602 1.00 39.40 ? 26 GLN C C 1 +ATOM 1062 O O . GLN C 1 28 ? -12.878 3.720 -21.111 1.00 39.47 ? 26 GLN C O 1 +ATOM 1063 C CB . GLN C 1 28 ? -15.209 3.394 -19.533 1.00 42.20 ? 26 GLN C CB 1 +ATOM 1064 C CG . GLN C 1 28 ? -16.083 3.995 -18.450 1.00 47.07 ? 26 GLN C CG 1 +ATOM 1065 C CD . GLN C 1 28 ? -16.105 3.097 -17.216 1.00 45.96 ? 26 GLN C CD 1 +ATOM 1066 O OE1 . GLN C 1 28 ? -15.083 2.624 -16.745 1.00 47.95 ? 26 GLN C OE1 1 +ATOM 1067 N NE2 . GLN C 1 28 ? -17.267 2.740 -16.821 1.00 50.02 ? 26 GLN C NE2 1 +ATOM 1068 N N . ASN C 1 29 ? -14.206 2.967 -22.765 1.00 36.41 ? 27 ASN C N 1 +ATOM 1069 C CA . ASN C 1 29 ? -13.162 2.179 -23.425 1.00 33.91 ? 27 ASN C CA 1 +ATOM 1070 C C . ASN C 1 29 ? -12.473 1.237 -22.482 1.00 31.95 ? 27 ASN C C 1 +ATOM 1071 O O . ASN C 1 29 ? -11.263 1.150 -22.430 1.00 32.77 ? 27 ASN C O 1 +ATOM 1072 C CB . ASN C 1 29 ? -12.166 3.056 -24.199 1.00 36.70 ? 27 ASN C CB 1 +ATOM 1073 C CG . ASN C 1 29 ? -12.862 3.910 -25.247 1.00 38.64 ? 27 ASN C CG 1 +ATOM 1074 O OD1 . ASN C 1 29 ? -13.769 3.455 -25.934 1.00 37.15 ? 27 ASN C OD1 1 +ATOM 1075 N ND2 . ASN C 1 29 ? -12.486 5.122 -25.318 1.00 42.03 ? 27 ASN C ND2 1 +ATOM 1076 N N . CYS C 1 30 ? -13.297 0.506 -21.752 1.00 30.05 ? 28 CYS C N 1 +ATOM 1077 C CA . CYS C 1 30 ? -12.862 -0.613 -20.921 1.00 28.04 ? 28 CYS C CA 1 +ATOM 1078 C C . CYS C 1 30 ? -13.544 -1.843 -21.446 1.00 26.20 ? 28 CYS C C 1 +ATOM 1079 O O . CYS C 1 30 ? -14.644 -1.746 -22.020 1.00 25.38 ? 28 CYS C O 1 +ATOM 1080 C CB . CYS C 1 30 ? -13.231 -0.350 -19.462 1.00 29.22 ? 28 CYS C CB 1 +ATOM 1081 S SG . CYS C 1 30 ? -12.361 1.111 -18.793 1.00 35.40 ? 28 CYS C SG 1 +ATOM 1082 N N . GLN C 1 31 ? -12.834 -2.971 -21.387 1.00 26.89 ? 29 GLN C N 1 +ATOM 1083 C CA . GLN C 1 31 ? -13.369 -4.261 -21.715 1.00 25.96 ? 29 GLN C CA 1 +ATOM 1084 C C . GLN C 1 31 ? -14.538 -4.573 -20.799 1.00 25.91 ? 29 GLN C C 1 +ATOM 1085 O O . GLN C 1 31 ? -14.521 -4.303 -19.559 1.00 27.48 ? 29 GLN C O 1 +ATOM 1086 C CB . GLN C 1 31 ? -12.347 -5.343 -21.623 1.00 28.34 ? 29 GLN C CB 1 +ATOM 1087 C CG . GLN C 1 31 ? -11.212 -5.201 -22.655 1.00 30.19 ? 29 GLN C CG 1 +ATOM 1088 C CD . GLN C 1 31 ? -10.079 -6.254 -22.531 1.00 33.42 ? 29 GLN C CD 1 +ATOM 1089 O OE1 . GLN C 1 31 ? -10.323 -7.393 -22.139 1.00 35.71 ? 29 GLN C OE1 1 +ATOM 1090 N NE2 . GLN C 1 31 ? -8.863 -5.916 -23.025 1.00 33.60 ? 29 GLN C NE2 1 +ATOM 1091 N N . TYR C 1 32 ? -15.521 -5.249 -21.340 1.00 22.75 ? 30 TYR C N 1 +ATOM 1092 C CA . TYR C 1 32 ? -16.593 -5.710 -20.531 1.00 22.12 ? 30 TYR C CA 1 +ATOM 1093 C C . TYR C 1 32 ? -16.967 -7.133 -20.818 1.00 23.66 ? 30 TYR C C 1 +ATOM 1094 O O . TYR C 1 32 ? -16.874 -7.599 -21.952 1.00 24.23 ? 30 TYR C O 1 +ATOM 1095 C CB . TYR C 1 32 ? -17.859 -4.802 -20.706 1.00 22.27 ? 30 TYR C CB 1 +ATOM 1096 C CG . TYR C 1 32 ? -18.522 -5.011 -22.033 1.00 21.98 ? 30 TYR C CG 1 +ATOM 1097 C CD1 . TYR C 1 32 ? -19.606 -5.907 -22.172 1.00 21.48 ? 30 TYR C CD1 1 +ATOM 1098 C CD2 . TYR C 1 32 ? -18.171 -4.266 -23.149 1.00 24.61 ? 30 TYR C CD2 1 +ATOM 1099 C CE1 . TYR C 1 32 ? -20.168 -6.122 -23.412 1.00 23.53 ? 30 TYR C CE1 1 +ATOM 1100 C CE2 . TYR C 1 32 ? -18.849 -4.445 -24.372 1.00 25.17 ? 30 TYR C CE2 1 +ATOM 1101 C CZ . TYR C 1 32 ? -19.779 -5.430 -24.486 1.00 25.64 ? 30 TYR C CZ 1 +ATOM 1102 O OH . TYR C 1 32 ? -20.465 -5.608 -25.682 1.00 27.00 ? 30 TYR C OH 1 +ATOM 1103 N N . GLN C 1 33 ? -17.434 -7.810 -19.769 1.00 23.07 ? 31 GLN C N 1 +ATOM 1104 C CA . GLN C 1 33 ? -17.812 -9.218 -19.884 1.00 25.61 ? 31 GLN C CA 1 +ATOM 1105 C C . GLN C 1 33 ? -18.945 -9.560 -18.860 1.00 26.28 ? 31 GLN C C 1 +ATOM 1106 O O . GLN C 1 33 ? -18.977 -9.027 -17.779 1.00 27.01 ? 31 GLN C O 1 +ATOM 1107 C CB . GLN C 1 33 ? -16.534 -10.068 -19.629 1.00 25.40 ? 31 GLN C CB 1 +ATOM 1108 C CG . GLN C 1 33 ? -16.761 -11.541 -19.516 1.00 28.32 ? 31 GLN C CG 1 +ATOM 1109 C CD . GLN C 1 33 ? -15.485 -12.282 -19.086 1.00 29.81 ? 31 GLN C CD 1 +ATOM 1110 O OE1 . GLN C 1 33 ? -14.419 -11.761 -19.283 1.00 29.57 ? 31 GLN C OE1 1 +ATOM 1111 N NE2 . GLN C 1 33 ? -15.619 -13.444 -18.519 1.00 30.16 ? 31 GLN C NE2 1 +ATOM 1112 N N . ILE C 1 34 ? -19.867 -10.431 -19.241 1.00 28.83 ? 32 ILE C N 1 +ATOM 1113 C CA . ILE C 1 34 ? -21.014 -10.781 -18.465 1.00 28.85 ? 32 ILE C CA 1 +ATOM 1114 C C . ILE C 1 34 ? -20.765 -12.229 -17.988 1.00 31.75 ? 32 ILE C C 1 +ATOM 1115 O O . ILE C 1 34 ? -20.492 -13.156 -18.807 1.00 30.96 ? 32 ILE C O 1 +ATOM 1116 C CB . ILE C 1 34 ? -22.385 -10.616 -19.222 1.00 31.36 ? 32 ILE C CB 1 +ATOM 1117 C CG1 . ILE C 1 34 ? -22.842 -9.155 -19.269 1.00 30.47 ? 32 ILE C CG1 1 +ATOM 1118 C CG2 . ILE C 1 34 ? -23.524 -11.315 -18.450 1.00 32.32 ? 32 ILE C CG2 1 +ATOM 1119 C CD1 . ILE C 1 34 ? -22.158 -8.435 -20.368 1.00 33.10 ? 32 ILE C CD1 1 +ATOM 1120 N N . ARG C 1 35 ? -20.883 -12.412 -16.684 1.00 33.18 ? 33 ARG C N 1 +ATOM 1121 C CA . ARG C 1 35 ? -20.759 -13.735 -16.020 1.00 34.08 ? 33 ARG C CA 1 +ATOM 1122 C C . ARG C 1 35 ? -22.080 -14.030 -15.281 1.00 34.93 ? 33 ARG C C 1 +ATOM 1123 O O . ARG C 1 35 ? -23.008 -13.205 -15.286 1.00 29.29 ? 33 ARG C O 1 +ATOM 1124 C CB . ARG C 1 35 ? -19.616 -13.700 -15.009 1.00 35.34 ? 33 ARG C CB 1 +ATOM 1125 C CG . ARG C 1 35 ? -18.276 -13.176 -15.514 1.00 37.23 ? 33 ARG C CG 1 +ATOM 1126 C CD . ARG C 1 35 ? -17.244 -13.168 -14.426 1.00 40.07 ? 33 ARG C CD 1 +ATOM 1127 N NE . ARG C 1 35 ? -15.938 -12.742 -14.960 1.00 41.85 ? 33 ARG C NE 1 +ATOM 1128 C CZ . ARG C 1 35 ? -15.007 -13.565 -15.450 1.00 43.93 ? 33 ARG C CZ 1 +ATOM 1129 N NH1 . ARG C 1 35 ? -15.196 -14.878 -15.467 1.00 47.33 ? 33 ARG C NH1 1 +ATOM 1130 N NH2 . ARG C 1 35 ? -13.839 -13.087 -15.896 1.00 44.51 ? 33 ARG C NH2 1 +ATOM 1131 N N . LYS C 1 36 ? -22.131 -15.174 -14.610 1.00 37.12 ? 34 LYS C N 1 +ATOM 1132 C CA . LYS C 1 36 ? -23.291 -15.534 -13.708 1.00 41.86 ? 34 LYS C CA 1 +ATOM 1133 C C . LYS C 1 36 ? -22.867 -16.097 -12.400 1.00 42.82 ? 34 LYS C C 1 +ATOM 1134 O O . LYS C 1 36 ? -21.858 -16.812 -12.301 1.00 42.84 ? 34 LYS C O 1 +ATOM 1135 C CB . LYS C 1 36 ? -24.170 -16.609 -14.302 1.00 46.08 ? 34 LYS C CB 1 +ATOM 1136 C CG . LYS C 1 36 ? -24.965 -16.141 -15.489 1.00 47.41 ? 34 LYS C CG 1 +ATOM 1137 C CD . LYS C 1 36 ? -26.011 -17.175 -15.840 1.00 52.53 ? 34 LYS C CD 1 +ATOM 1138 C CE . LYS C 1 36 ? -27.232 -17.013 -14.954 1.00 53.85 ? 34 LYS C CE 1 +ATOM 1139 N NZ . LYS C 1 36 ? -28.320 -17.872 -15.520 1.00 58.65 ? 34 LYS C NZ 1 +ATOM 1140 N N . GLU C 1 37 ? -23.593 -15.678 -11.379 1.00 43.54 ? 35 GLU C N 1 +ATOM 1141 C CA . GLU C 1 37 ? -23.382 -16.200 -10.075 1.00 46.69 ? 35 GLU C CA 1 +ATOM 1142 C C . GLU C 1 37 ? -24.754 -16.676 -9.699 1.00 45.31 ? 35 GLU C C 1 +ATOM 1143 O O . GLU C 1 37 ? -25.660 -15.867 -9.453 1.00 40.84 ? 35 GLU C O 1 +ATOM 1144 C CB . GLU C 1 37 ? -22.872 -15.088 -9.136 1.00 50.15 ? 35 GLU C CB 1 +ATOM 1145 C CG . GLU C 1 37 ? -21.558 -15.355 -8.425 1.00 56.76 ? 35 GLU C CG 1 +ATOM 1146 C CD . GLU C 1 37 ? -20.589 -14.162 -8.671 1.00 61.97 ? 35 GLU C CD 1 +ATOM 1147 O OE1 . GLU C 1 37 ? -20.776 -13.146 -7.985 1.00 66.92 ? 35 GLU C OE1 1 +ATOM 1148 O OE2 . GLU C 1 37 ? -19.661 -14.198 -9.573 1.00 62.76 ? 35 GLU C OE2 1 +ATOM 1149 N N . GLY C 1 38 ? -24.910 -17.994 -9.608 1.00 47.66 ? 36 GLY C N 1 +ATOM 1150 C CA . GLY C 1 38 ? -26.234 -18.572 -9.444 1.00 48.87 ? 36 GLY C CA 1 +ATOM 1151 C C . GLY C 1 38 ? -27.066 -18.171 -10.646 1.00 44.57 ? 36 GLY C C 1 +ATOM 1152 O O . GLY C 1 38 ? -26.622 -18.374 -11.758 1.00 41.23 ? 36 GLY C O 1 +ATOM 1153 N N . ASN C 1 39 ? -28.238 -17.578 -10.403 1.00 40.74 ? 37 ASN C N 1 +ATOM 1154 C CA . ASN C 1 39 ? -29.044 -16.997 -11.482 1.00 37.15 ? 37 ASN C CA 1 +ATOM 1155 C C . ASN C 1 39 ? -28.942 -15.503 -11.644 1.00 32.72 ? 37 ASN C C 1 +ATOM 1156 O O . ASN C 1 39 ? -29.649 -14.957 -12.483 1.00 31.37 ? 37 ASN C O 1 +ATOM 1157 C CB . ASN C 1 39 ? -30.515 -17.327 -11.342 1.00 39.64 ? 37 ASN C CB 1 +ATOM 1158 C CG . ASN C 1 39 ? -31.295 -17.090 -12.641 1.00 38.73 ? 37 ASN C CG 1 +ATOM 1159 O OD1 . ASN C 1 39 ? -30.826 -17.453 -13.733 1.00 41.29 ? 37 ASN C OD1 1 +ATOM 1160 N ND2 . ASN C 1 39 ? -32.497 -16.557 -12.532 1.00 39.42 ? 37 ASN C ND2 1 +ATOM 1161 N N . CYS C 1 40 ? -28.032 -14.857 -10.897 1.00 30.09 ? 38 CYS C N 1 +ATOM 1162 C CA . CYS C 1 40 ? -27.785 -13.463 -11.003 1.00 28.16 ? 38 CYS C CA 1 +ATOM 1163 C C . CYS C 1 40 ? -26.689 -13.192 -12.066 1.00 27.91 ? 38 CYS C C 1 +ATOM 1164 O O . CYS C 1 40 ? -25.638 -13.866 -12.099 1.00 31.26 ? 38 CYS C O 1 +ATOM 1165 C CB . CYS C 1 40 ? -27.289 -12.912 -9.677 1.00 28.46 ? 38 CYS C CB 1 +ATOM 1166 S SG . CYS C 1 40 ? -28.524 -13.112 -8.435 1.00 28.65 ? 38 CYS C SG 1 +ATOM 1167 N N . TYR C 1 41 ? -26.941 -12.204 -12.909 1.00 27.05 ? 39 TYR C N 1 +ATOM 1168 C CA . TYR C 1 41 ? -25.928 -11.823 -13.907 1.00 25.88 ? 39 TYR C CA 1 +ATOM 1169 C C . TYR C 1 41 ? -25.001 -10.771 -13.260 1.00 23.53 ? 39 TYR C C 1 +ATOM 1170 O O . TYR C 1 41 ? -25.396 -10.056 -12.348 1.00 19.69 ? 39 TYR C O 1 +ATOM 1171 C CB . TYR C 1 41 ? -26.631 -11.303 -15.154 1.00 27.68 ? 39 TYR C CB 1 +ATOM 1172 C CG . TYR C 1 41 ? -27.240 -12.433 -15.894 1.00 28.99 ? 39 TYR C CG 1 +ATOM 1173 C CD1 . TYR C 1 41 ? -28.514 -12.908 -15.553 1.00 29.97 ? 39 TYR C CD1 1 +ATOM 1174 C CD2 . TYR C 1 41 ? -26.514 -13.095 -16.889 1.00 30.06 ? 39 TYR C CD2 1 +ATOM 1175 C CE1 . TYR C 1 41 ? -29.028 -14.060 -16.161 1.00 33.25 ? 39 TYR C CE1 1 +ATOM 1176 C CE2 . TYR C 1 41 ? -27.051 -14.196 -17.550 1.00 32.81 ? 39 TYR C CE2 1 +ATOM 1177 C CZ . TYR C 1 41 ? -28.291 -14.691 -17.183 1.00 34.77 ? 39 TYR C CZ 1 +ATOM 1178 O OH . TYR C 1 41 ? -28.783 -15.814 -17.843 1.00 39.12 ? 39 TYR C OH 1 +ATOM 1179 N N . VAL C 1 42 ? -23.747 -10.789 -13.719 1.00 23.84 ? 40 VAL C N 1 +ATOM 1180 C CA . VAL C 1 42 ? -22.603 -10.106 -13.148 1.00 21.92 ? 40 VAL C CA 1 +ATOM 1181 C C . VAL C 1 42 ? -21.841 -9.389 -14.302 1.00 22.98 ? 40 VAL C C 1 +ATOM 1182 O O . VAL C 1 42 ? -21.607 -9.971 -15.336 1.00 24.85 ? 40 VAL C O 1 +ATOM 1183 C CB . VAL C 1 42 ? -21.614 -11.059 -12.454 1.00 24.18 ? 40 VAL C CB 1 +ATOM 1184 C CG1 . VAL C 1 42 ? -20.341 -10.322 -11.977 1.00 22.59 ? 40 VAL C CG1 1 +ATOM 1185 C CG2 . VAL C 1 42 ? -22.295 -11.799 -11.247 1.00 24.69 ? 40 VAL C CG2 1 +ATOM 1186 N N . CYS C 1 43 ? -21.628 -8.101 -14.147 1.00 23.41 ? 41 CYS C N 1 +ATOM 1187 C CA . CYS C 1 43 ? -20.865 -7.260 -15.101 1.00 23.64 ? 41 CYS C CA 1 +ATOM 1188 C C . CYS C 1 43 ? -19.445 -7.129 -14.610 1.00 24.86 ? 41 CYS C C 1 +ATOM 1189 O O . CYS C 1 43 ? -19.208 -6.707 -13.503 1.00 24.43 ? 41 CYS C O 1 +ATOM 1190 C CB . CYS C 1 43 ? -21.486 -5.860 -15.197 1.00 23.62 ? 41 CYS C CB 1 +ATOM 1191 S SG . CYS C 1 43 ? -20.552 -4.767 -16.295 1.00 22.89 ? 41 CYS C SG 1 +ATOM 1192 N N . GLU C 1 44 ? -18.508 -7.580 -15.415 1.00 27.23 ? 42 GLU C N 1 +ATOM 1193 C CA . GLU C 1 44 ? -17.109 -7.305 -15.144 1.00 26.15 ? 42 GLU C CA 1 +ATOM 1194 C C . GLU C 1 44 ? -16.571 -6.236 -16.112 1.00 25.65 ? 42 GLU C C 1 +ATOM 1195 O O . GLU C 1 44 ? -16.653 -6.441 -17.330 1.00 21.83 ? 42 GLU C O 1 +ATOM 1196 C CB . GLU C 1 44 ? -16.301 -8.585 -15.280 1.00 27.51 ? 42 GLU C CB 1 +ATOM 1197 C CG . GLU C 1 44 ? -14.815 -8.275 -15.074 1.00 30.24 ? 42 GLU C CG 1 +ATOM 1198 C CD . GLU C 1 44 ? -13.945 -9.448 -14.977 1.00 33.04 ? 42 GLU C CD 1 +ATOM 1199 O OE1 . GLU C 1 44 ? -13.365 -9.847 -15.968 1.00 34.90 ? 42 GLU C OE1 1 +ATOM 1200 O OE2 . GLU C 1 44 ? -13.902 -10.045 -13.881 1.00 40.45 ? 42 GLU C OE2 1 +ATOM 1201 N N . ILE C 1 45 ? -15.908 -5.210 -15.569 1.00 24.81 ? 43 ILE C N 1 +ATOM 1202 C CA . ILE C 1 45 ? -15.339 -4.098 -16.372 1.00 26.23 ? 43 ILE C CA 1 +ATOM 1203 C C . ILE C 1 45 ? -13.831 -4.153 -16.112 1.00 28.58 ? 43 ILE C C 1 +ATOM 1204 O O . ILE C 1 45 ? -13.414 -4.280 -14.905 1.00 28.99 ? 43 ILE C O 1 +ATOM 1205 C CB . ILE C 1 45 ? -15.887 -2.700 -15.914 1.00 27.71 ? 43 ILE C CB 1 +ATOM 1206 C CG1 . ILE C 1 45 ? -17.421 -2.612 -16.134 1.00 27.57 ? 43 ILE C CG1 1 +ATOM 1207 C CG2 . ILE C 1 45 ? -15.119 -1.568 -16.630 1.00 30.19 ? 43 ILE C CG2 1 +ATOM 1208 C CD1 . ILE C 1 45 ? -17.838 -2.797 -17.594 1.00 26.48 ? 43 ILE C CD1 1 +ATOM 1209 N N . ARG C 1 46 ? -13.042 -4.193 -17.171 1.00 27.98 ? 44 ARG C N 1 +ATOM 1210 C CA . ARG C 1 46 ? -11.544 -4.222 -17.077 1.00 29.84 ? 44 ARG C CA 1 +ATOM 1211 C C . ARG C 1 46 ? -11.017 -3.073 -17.853 1.00 31.48 ? 44 ARG C C 1 +ATOM 1212 O O . ARG C 1 46 ? -10.977 -3.051 -19.115 1.00 30.27 ? 44 ARG C O 1 +ATOM 1213 C CB . ARG C 1 46 ? -10.927 -5.527 -17.592 1.00 31.00 ? 44 ARG C CB 1 +ATOM 1214 C CG . ARG C 1 46 ? -11.438 -6.750 -16.869 1.00 33.15 ? 44 ARG C CG 1 +ATOM 1215 C CD . ARG C 1 46 ? -10.757 -7.973 -17.429 1.00 36.79 ? 44 ARG C CD 1 +ATOM 1216 N NE . ARG C 1 46 ? -11.119 -8.179 -18.846 1.00 35.57 ? 44 ARG C NE 1 +ATOM 1217 C CZ . ARG C 1 46 ? -12.190 -8.805 -19.351 1.00 34.18 ? 44 ARG C CZ 1 +ATOM 1218 N NH1 . ARG C 1 46 ? -13.146 -9.352 -18.623 1.00 31.03 ? 44 ARG C NH1 1 +ATOM 1219 N NH2 . ARG C 1 46 ? -12.309 -8.857 -20.704 1.00 34.70 ? 44 ARG C NH2 1 +ATOM 1220 N N . CYS C 1 47 ? -10.574 -2.123 -17.089 1.00 33.10 ? 45 CYS C N 1 +ATOM 1221 C CA . CYS C 1 47 ? -9.936 -0.893 -17.595 1.00 35.99 ? 45 CYS C CA 1 +ATOM 1222 C C . CYS C 1 47 ? -8.402 -0.955 -17.705 1.00 35.76 ? 45 CYS C C 1 +ATOM 1223 O O . CYS C 1 47 ? -7.703 -1.840 -17.212 1.00 35.28 ? 45 CYS C O 1 +ATOM 1224 C CB . CYS C 1 47 ? -10.412 0.281 -16.725 1.00 37.92 ? 45 CYS C CB 1 +ATOM 1225 S SG . CYS C 1 47 ? -12.166 0.615 -16.878 1.00 38.84 ? 45 CYS C SG 1 +ATOM 1226 O OXT . CYS C 1 47 ? -7.864 -0.071 -18.314 1.00 37.01 ? 45 CYS C OXT 1 +HETATM 1227 CL CL . CL D 2 . ? -4.534 -29.036 -19.110 1.00 34.31 ? 101 CL B CL 1 +HETATM 1228 C C1 . GOL E 3 . ? -21.806 -5.039 -6.946 1.00 37.45 ? 101 GOL C C1 1 +HETATM 1229 O O1 . GOL E 3 . ? -22.134 -3.701 -6.486 1.00 38.79 ? 101 GOL C O1 1 +HETATM 1230 C C2 . GOL E 3 . ? -22.057 -6.206 -6.025 1.00 37.98 ? 101 GOL C C2 1 +HETATM 1231 O O2 . GOL E 3 . ? -21.408 -7.425 -6.470 1.00 33.94 ? 101 GOL C O2 1 +HETATM 1232 C C3 . GOL E 3 . ? -23.574 -6.480 -6.034 1.00 45.61 ? 101 GOL C C3 1 +HETATM 1233 O O3 . GOL E 3 . ? -24.139 -7.291 -4.988 1.00 41.55 ? 101 GOL C O3 1 +HETATM 1234 O O . HOH F 4 . ? -9.387 -14.850 -15.479 1.00 43.10 ? 101 HOH A O 1 +HETATM 1235 O O . HOH F 4 . ? 5.302 -6.230 -5.821 1.00 37.26 ? 102 HOH A O 1 +HETATM 1236 O O . HOH F 4 . ? 0.660 -9.227 -11.369 1.00 41.26 ? 103 HOH A O 1 +HETATM 1237 O O . HOH F 4 . ? -1.959 -20.170 -8.493 1.00 35.50 ? 104 HOH A O 1 +HETATM 1238 O O . HOH F 4 . ? -2.068 -18.038 -1.882 1.00 29.96 ? 105 HOH A O 1 +HETATM 1239 O O . HOH F 4 . ? -7.540 -4.958 -11.041 1.00 27.33 ? 106 HOH A O 1 +HETATM 1240 O O . HOH F 4 . ? -12.745 -4.917 1.196 1.00 19.81 ? 107 HOH A O 1 +HETATM 1241 O O . HOH F 4 . ? -14.277 -3.980 5.683 1.00 26.11 ? 108 HOH A O 1 +HETATM 1242 O O . HOH F 4 . ? -11.831 -8.972 -11.794 1.00 33.50 ? 109 HOH A O 1 +HETATM 1243 O O . HOH F 4 . ? -13.379 -8.578 -9.498 1.00 24.41 ? 110 HOH A O 1 +HETATM 1244 O O . HOH F 4 . ? -5.901 -10.131 3.068 1.00 24.84 ? 111 HOH A O 1 +HETATM 1245 O O . HOH F 4 . ? 2.893 -5.393 1.518 1.00 34.16 ? 112 HOH A O 1 +HETATM 1246 O O . HOH F 4 . ? -16.787 -3.423 -8.279 1.00 33.27 ? 113 HOH A O 1 +HETATM 1247 O O . HOH F 4 . ? -6.011 -11.909 6.542 1.00 33.71 ? 114 HOH A O 1 +HETATM 1248 O O . HOH F 4 . ? -3.263 -4.662 -8.731 1.00 39.47 ? 115 HOH A O 1 +HETATM 1249 O O . HOH F 4 . ? -5.248 -9.698 0.556 1.00 29.10 ? 116 HOH A O 1 +HETATM 1250 O O . HOH F 4 . ? -10.189 -16.022 -11.169 1.00 43.03 ? 117 HOH A O 1 +HETATM 1251 O O . HOH F 4 . ? 7.820 -8.469 -6.487 1.00 22.43 ? 118 HOH A O 1 +HETATM 1252 O O . HOH F 4 . ? -13.874 -13.973 -5.834 1.00 41.72 ? 119 HOH A O 1 +HETATM 1253 O O . HOH F 4 . ? -16.549 2.622 1.184 1.00 24.04 ? 120 HOH A O 1 +HETATM 1254 O O . HOH F 4 . ? -9.376 -4.005 7.958 1.00 34.26 ? 121 HOH A O 1 +HETATM 1255 O O . HOH F 4 . ? -12.513 -10.632 5.146 1.00 13.11 ? 122 HOH A O 1 +HETATM 1256 O O . HOH F 4 . ? -13.390 -3.720 8.866 1.00 43.66 ? 123 HOH A O 1 +HETATM 1257 O O . HOH G 4 . ? -14.044 -24.069 3.523 1.00 34.95 ? 201 HOH B O 1 +HETATM 1258 O O . HOH G 4 . ? -20.213 -34.194 -5.329 1.00 29.45 ? 202 HOH B O 1 +HETATM 1259 O O . HOH G 4 . ? -17.349 -23.412 -7.289 1.00 34.75 ? 203 HOH B O 1 +HETATM 1260 O O . HOH G 4 . ? -6.266 -30.959 -0.805 1.00 26.65 ? 204 HOH B O 1 +HETATM 1261 O O . HOH G 4 . ? -13.627 -38.068 -8.872 1.00 39.71 ? 205 HOH B O 1 +HETATM 1262 O O . HOH G 4 . ? -11.942 -15.675 -15.635 1.00 32.91 ? 206 HOH B O 1 +HETATM 1263 O O . HOH G 4 . ? -20.334 -33.062 -9.708 1.00 51.42 ? 207 HOH B O 1 +HETATM 1264 O O . HOH G 4 . ? -13.811 -37.821 -4.374 1.00 30.16 ? 208 HOH B O 1 +HETATM 1265 O O . HOH G 4 . ? -7.904 -31.673 -13.955 1.00 27.11 ? 209 HOH B O 1 +HETATM 1266 O O . HOH G 4 . ? -14.178 -16.321 -10.949 1.00 34.88 ? 210 HOH B O 1 +HETATM 1267 O O . HOH G 4 . ? -8.384 -30.610 -24.509 1.00 34.75 ? 211 HOH B O 1 +HETATM 1268 O O . HOH G 4 . ? -19.635 -34.175 -1.912 1.00 29.56 ? 212 HOH B O 1 +HETATM 1269 O O . HOH G 4 . ? -9.968 -30.715 -12.661 1.00 23.28 ? 213 HOH B O 1 +HETATM 1270 O O . HOH G 4 . ? -13.182 -15.613 -3.773 1.00 22.35 ? 214 HOH B O 1 +HETATM 1271 O O . HOH G 4 . ? -7.672 -26.770 -4.502 1.00 28.69 ? 215 HOH B O 1 +HETATM 1272 O O . HOH G 4 . ? -20.367 -27.993 -12.490 1.00 27.56 ? 216 HOH B O 1 +HETATM 1273 O O . HOH G 4 . ? -10.622 -28.277 -21.717 1.00 24.48 ? 217 HOH B O 1 +HETATM 1274 O O . HOH G 4 . ? -18.757 -21.468 -17.465 1.00 34.39 ? 218 HOH B O 1 +HETATM 1275 O O . HOH G 4 . ? -10.271 -17.527 -9.262 1.00 27.54 ? 219 HOH B O 1 +HETATM 1276 O O . HOH G 4 . ? -8.216 -30.483 -10.815 1.00 42.18 ? 220 HOH B O 1 +HETATM 1277 O O . HOH G 4 . ? -19.576 -23.605 -5.892 1.00 35.88 ? 221 HOH B O 1 +HETATM 1278 O O . HOH G 4 . ? -17.503 -24.348 -28.782 1.00 44.17 ? 222 HOH B O 1 +HETATM 1279 O O . HOH H 4 . ? -19.655 -4.144 -27.371 1.00 35.10 ? 201 HOH C O 1 +HETATM 1280 O O . HOH H 4 . ? -29.262 -10.639 -12.714 1.00 28.93 ? 202 HOH C O 1 +HETATM 1281 O O . HOH H 4 . ? -21.620 3.397 -24.060 1.00 40.07 ? 203 HOH C O 1 +HETATM 1282 O O . HOH H 4 . ? -35.233 -5.606 -8.580 1.00 30.50 ? 204 HOH C O 1 +HETATM 1283 O O . HOH H 4 . ? -21.754 -12.032 -3.436 1.00 38.60 ? 205 HOH C O 1 +HETATM 1284 O O . HOH H 4 . ? -21.863 -3.764 -3.801 1.00 30.14 ? 206 HOH C O 1 +HETATM 1285 O O . HOH H 4 . ? -29.407 -6.918 -23.597 1.00 37.17 ? 207 HOH C O 1 +HETATM 1286 O O . HOH H 4 . ? -23.783 -9.642 -23.438 1.00 49.95 ? 208 HOH C O 1 +HETATM 1287 O O . HOH H 4 . ? -24.394 1.595 -18.162 1.00 33.38 ? 209 HOH C O 1 +HETATM 1288 O O . HOH H 4 . ? -26.448 -3.240 -14.654 1.00 23.52 ? 210 HOH C O 1 +HETATM 1289 O O . HOH H 4 . ? -22.732 1.439 -25.768 1.00 33.95 ? 211 HOH C O 1 +HETATM 1290 O O . HOH H 4 . ? -24.010 -6.938 -23.812 1.00 40.01 ? 212 HOH C O 1 +HETATM 1291 O O . HOH H 4 . ? -24.478 -4.120 -15.895 1.00 28.71 ? 213 HOH C O 1 +HETATM 1292 O O . HOH H 4 . ? -16.783 -1.908 -28.362 1.00 26.45 ? 214 HOH C O 1 +HETATM 1293 O O . HOH H 4 . ? -33.875 -10.316 -19.819 1.00 44.16 ? 215 HOH C O 1 +HETATM 1294 O O . HOH H 4 . ? -19.496 -11.334 -22.025 1.00 28.70 ? 216 HOH C O 1 +HETATM 1295 O O . HOH H 4 . ? -32.882 -12.848 -16.920 1.00 39.29 ? 217 HOH C O 1 +HETATM 1296 O O . HOH H 4 . ? -16.911 0.638 -13.918 1.00 32.29 ? 218 HOH C O 1 +HETATM 1297 O O . HOH H 4 . ? -22.637 -19.842 -10.283 1.00 47.29 ? 219 HOH C O 1 +HETATM 1298 O O . HOH H 4 . ? -34.468 -5.644 -14.742 1.00 30.12 ? 220 HOH C O 1 +HETATM 1299 O O . HOH H 4 . ? -12.394 -15.411 -12.625 1.00 30.32 ? 221 HOH C O 1 +HETATM 1300 O O . HOH H 4 . ? -23.053 -1.955 -15.495 1.00 29.63 ? 222 HOH C O 1 +HETATM 1301 O O . HOH H 4 . ? -29.219 -5.205 -8.656 1.00 14.20 ? 223 HOH C O 1 +# +loop_ +_atom_site_anisotrop.id +_atom_site_anisotrop.type_symbol +_atom_site_anisotrop.pdbx_label_atom_id +_atom_site_anisotrop.pdbx_label_alt_id +_atom_site_anisotrop.pdbx_label_comp_id +_atom_site_anisotrop.pdbx_label_asym_id +_atom_site_anisotrop.pdbx_label_seq_id +_atom_site_anisotrop.pdbx_PDB_ins_code +_atom_site_anisotrop.U[1][1] +_atom_site_anisotrop.U[2][2] +_atom_site_anisotrop.U[3][3] +_atom_site_anisotrop.U[1][2] +_atom_site_anisotrop.U[1][3] +_atom_site_anisotrop.U[2][3] +_atom_site_anisotrop.pdbx_auth_seq_id +_atom_site_anisotrop.pdbx_auth_comp_id +_atom_site_anisotrop.pdbx_auth_asym_id +_atom_site_anisotrop.pdbx_auth_atom_id +1 N N . SER A 2 ? 0.5639 0.8350 0.7156 -0.0706 0.2511 -0.3401 0 SER A N +2 C CA . SER A 2 ? 0.5840 0.8547 0.7708 -0.0917 0.2593 -0.4008 0 SER A CA +3 C C . SER A 2 ? 0.5604 0.7807 0.7688 -0.0941 0.2424 -0.3654 0 SER A C +4 O O . SER A 2 ? 0.5656 0.8104 0.7674 -0.1084 0.2291 -0.3928 0 SER A O +5 C CB . SER A 2 ? 0.6246 0.8654 0.8843 -0.0993 0.3038 -0.4537 0 SER A CB +6 O OG . SER A 2 ? 0.6660 0.9350 0.9551 -0.1232 0.3199 -0.5368 0 SER A OG +7 N N . GLU A 3 ? 0.5276 0.6900 0.7567 -0.0790 0.2403 -0.3035 1 GLU A N +8 C CA . GLU A 3 ? 0.5224 0.6461 0.7633 -0.0775 0.2237 -0.2640 1 GLU A CA +9 C C . GLU A 3 ? 0.4723 0.6077 0.6555 -0.0671 0.1860 -0.2101 1 GLU A C +10 O O . GLU A 3 ? 0.4414 0.5738 0.6075 -0.0536 0.1782 -0.1705 1 GLU A O +11 C CB . GLU A 3 ? 0.5611 0.6228 0.8668 -0.0668 0.2458 -0.2313 1 GLU A CB +12 C CG . GLU A 3 ? 0.5683 0.5986 0.8901 -0.0651 0.2354 -0.1959 1 GLU A CG +13 C CD . GLU A 3 ? 0.6053 0.5984 0.9612 -0.0438 0.2419 -0.1352 1 GLU A CD +14 O OE1 . GLU A 3 ? 0.6537 0.6438 1.0257 -0.0298 0.2529 -0.1183 1 GLU A OE1 +15 O OE2 . GLU A 3 ? 0.5913 0.5683 0.9540 -0.0392 0.2338 -0.1016 1 GLU A OE2 +16 N N . GLU A 4 ? 0.4287 0.5727 0.5943 -0.0741 0.1660 -0.2095 2 GLU A N +17 C CA . GLU A 4 ? 0.3966 0.5502 0.5170 -0.0657 0.1353 -0.1685 2 GLU A CA +18 C C . GLU A 4 ? 0.3679 0.4866 0.5092 -0.0664 0.1284 -0.1468 2 GLU A C +19 O O . GLU A 4 ? 0.3421 0.4581 0.5113 -0.0790 0.1376 -0.1757 2 GLU A O +20 C CB . GLU A 4 ? 0.4632 0.6788 0.5395 -0.0713 0.1201 -0.1941 2 GLU A CB +21 C CG . GLU A 4 ? 0.5001 0.7439 0.5248 -0.0586 0.0955 -0.1554 2 GLU A CG +22 C CD . GLU A 4 ? 0.5555 0.8768 0.5399 -0.0576 0.0915 -0.1792 2 GLU A CD +23 O OE1 . GLU A 4 ? 0.6127 0.9784 0.5684 -0.0539 0.0728 -0.1739 2 GLU A OE1 +24 O OE2 . GLU A 4 ? 0.5979 0.9429 0.5796 -0.0582 0.1080 -0.2018 2 GLU A OE2 +25 N N . ARG A 5 ? 0.3138 0.4126 0.4449 -0.0542 0.1142 -0.1007 3 ARG A N +26 C CA . ARG A 5 ? 0.3304 0.4067 0.4727 -0.0516 0.1070 -0.0767 3 ARG A CA +27 C C . ARG A 5 ? 0.2932 0.3865 0.3915 -0.0477 0.0793 -0.0586 3 ARG A C +28 O O . ARG A 5 ? 0.2631 0.3647 0.3394 -0.0413 0.0690 -0.0424 3 ARG A O +29 C CB . ARG A 5 ? 0.3569 0.4068 0.5273 -0.0383 0.1142 -0.0397 3 ARG A CB +30 C CG . ARG A 5 ? 0.3835 0.4108 0.6088 -0.0353 0.1463 -0.0449 3 ARG A CG +31 C CD . ARG A 5 ? 0.4158 0.4395 0.6562 -0.0170 0.1463 -0.0037 3 ARG A CD +32 N NE . ARG A 5 ? 0.4742 0.4856 0.7600 -0.0103 0.1741 -0.0075 3 ARG A NE +33 C CZ . ARG A 5 ? 0.5041 0.5118 0.8271 0.0085 0.1846 0.0292 3 ARG A CZ +34 N NH1 . ARG A 5 ? 0.4672 0.4910 0.7836 0.0227 0.1670 0.0725 3 ARG A NH1 +35 N NH2 . ARG A 5 ? 0.5125 0.5067 0.8835 0.0147 0.2149 0.0205 3 ARG A NH2 +36 N N . ARG A 6 ? 0.2639 0.3610 0.3574 -0.0518 0.0711 -0.0619 4 ARG A N +37 C CA . ARG A 6 ? 0.2574 0.3645 0.3196 -0.0465 0.0491 -0.0448 4 ARG A CA +38 C C . ARG A 6 ? 0.2391 0.3306 0.3097 -0.0429 0.0464 -0.0269 4 ARG A C +39 O O . ARG A 6 ? 0.2166 0.3011 0.3127 -0.0484 0.0594 -0.0345 4 ARG A O +40 C CB . ARG A 6 ? 0.2901 0.4312 0.3357 -0.0523 0.0413 -0.0668 4 ARG A CB +41 C CG . ARG A 6 ? 0.3023 0.4812 0.3245 -0.0513 0.0382 -0.0791 4 ARG A CG +42 C CD . ARG A 6 ? 0.3307 0.5518 0.3409 -0.0536 0.0262 -0.0936 4 ARG A CD +43 N NE . ARG A 6 ? 0.3731 0.6324 0.3506 -0.0413 0.0157 -0.0778 4 ARG A NE +44 C CZ . ARG A 6 ? 0.3401 0.6157 0.3002 -0.0276 0.0028 -0.0510 4 ARG A CZ +45 N NH1 . ARG A 6 ? 0.3095 0.5747 0.2768 -0.0247 -0.0053 -0.0422 4 ARG A NH1 +46 N NH2 . ARG A 6 ? 0.3427 0.6505 0.2802 -0.0148 0.0022 -0.0316 4 ARG A NH2 +47 N N . TYR A 7 ? 0.2298 0.3194 0.2829 -0.0344 0.0321 -0.0052 5 TYR A N +48 C CA . TYR A 7 ? 0.2532 0.3405 0.3063 -0.0287 0.0280 0.0107 5 TYR A CA +49 C C . TYR A 7 ? 0.2401 0.3375 0.2688 -0.0274 0.0121 0.0066 5 TYR A C +50 O O . TYR A 7 ? 0.1970 0.2947 0.2153 -0.0247 0.0025 0.0098 5 TYR A O +51 C CB . TYR A 7 ? 0.2808 0.3699 0.3374 -0.0201 0.0244 0.0308 5 TYR A CB +52 C CG . TYR A 7 ? 0.2828 0.3643 0.3690 -0.0162 0.0408 0.0416 5 TYR A CG +53 C CD1 . TYR A 7 ? 0.3176 0.3948 0.4302 -0.0085 0.0577 0.0612 5 TYR A CD1 +54 C CD2 . TYR A 7 ? 0.3026 0.3809 0.3951 -0.0182 0.0438 0.0355 5 TYR A CD2 +55 C CE1 . TYR A 7 ? 0.3231 0.3899 0.4725 -0.0017 0.0774 0.0745 5 TYR A CE1 +56 C CE2 . TYR A 7 ? 0.2992 0.3699 0.4242 -0.0128 0.0616 0.0441 5 TYR A CE2 +57 C CZ . TYR A 7 ? 0.3102 0.3734 0.4654 -0.0043 0.0784 0.0630 5 TYR A CZ +58 O OH . TYR A 7 ? 0.3234 0.3763 0.5198 0.0041 0.1003 0.0753 5 TYR A OH +59 N N . LYS A 8 ? 0.2401 0.3450 0.2683 -0.0298 0.0130 -0.0011 6 LYS A N +60 C CA . LYS A 8 ? 0.2475 0.3621 0.2603 -0.0256 0.0017 -0.0032 6 LYS A CA +61 C C . LYS A 8 ? 0.2592 0.3731 0.2659 -0.0194 -0.0013 0.0051 6 LYS A C +62 O O . LYS A 8 ? 0.2235 0.3411 0.2363 -0.0182 0.0070 0.0128 6 LYS A O +63 C CB . LYS A 8 ? 0.2970 0.4304 0.3152 -0.0294 0.0032 -0.0160 6 LYS A CB +64 C CG . LYS A 8 ? 0.3195 0.4668 0.3270 -0.0208 -0.0071 -0.0142 6 LYS A CG +65 C CD . LYS A 8 ? 0.3542 0.5321 0.3710 -0.0226 -0.0078 -0.0251 6 LYS A CD +66 C CE . LYS A 8 ? 0.3853 0.5622 0.4211 -0.0306 0.0033 -0.0312 6 LYS A CE +67 N NZ . LYS A 8 ? 0.4222 0.6350 0.4762 -0.0370 0.0030 -0.0479 6 LYS A NZ +68 N N . ARG A 9 ? 0.2766 0.3898 0.2743 -0.0152 -0.0107 0.0021 7 ARG A N +69 C CA . ARG A 9 ? 0.2827 0.4058 0.2734 -0.0112 -0.0148 -0.0001 7 ARG A CA +70 C C . ARG A 9 ? 0.2519 0.3777 0.2396 -0.0072 -0.0170 -0.0131 7 ARG A C +71 O O . ARG A 9 ? 0.2266 0.3491 0.2191 -0.0074 -0.0211 -0.0258 7 ARG A O +72 C CB . ARG A 9 ? 0.2834 0.4081 0.2784 -0.0132 -0.0214 -0.0011 7 ARG A CB +73 C CG . ARG A 9 ? 0.3079 0.4348 0.3101 -0.0133 -0.0170 0.0144 7 ARG A CG +74 C CD . ARG A 9 ? 0.3319 0.4797 0.3299 -0.0058 -0.0118 0.0289 7 ARG A CD +75 N NE . ARG A 9 ? 0.3692 0.5207 0.3823 -0.0011 -0.0040 0.0497 7 ARG A NE +76 C CZ . ARG A 9 ? 0.4262 0.5633 0.4583 0.0006 0.0142 0.0648 7 ARG A CZ +77 N NH1 . ARG A 9 ? 0.3942 0.5146 0.4334 -0.0059 0.0253 0.0565 7 ARG A NH1 +78 N NH2 . ARG A 9 ? 0.4739 0.6140 0.5270 0.0080 0.0232 0.0857 7 ARG A NH2 +79 N N . CYS A 10 ? 0.2667 0.3985 0.2542 -0.0044 -0.0119 -0.0126 8 CYS A N +80 C CA . CYS A 10 ? 0.2413 0.3763 0.2314 0.0020 -0.0108 -0.0236 8 CYS A CA +81 C C . CYS A 10 ? 0.2446 0.3937 0.2250 0.0047 -0.0109 -0.0388 8 CYS A C +82 O O . CYS A 10 ? 0.2390 0.3848 0.2277 0.0087 -0.0087 -0.0567 8 CYS A O +83 C CB . CYS A 10 ? 0.2493 0.3981 0.2449 0.0041 -0.0050 -0.0198 8 CYS A CB +84 S SG . CYS A 10 ? 0.2525 0.4075 0.2598 0.0008 -0.0080 -0.0141 8 CYS A SG +85 N N . GLY A 11 ? 0.2269 0.3972 0.1923 0.0042 -0.0115 -0.0320 9 GLY A N +86 C CA . GLY A 11 ? 0.2630 0.4683 0.2115 0.0085 -0.0134 -0.0480 9 GLY A CA +87 C C . GLY A 11 ? 0.2779 0.4900 0.2311 0.0024 -0.0243 -0.0692 9 GLY A C +88 O O . GLY A 11 ? 0.2774 0.5316 0.2159 0.0042 -0.0294 -0.0836 9 GLY A O +89 N N . GLN A 12 ? 0.2776 0.4560 0.2529 -0.0047 -0.0272 -0.0697 10 GLN A N +90 C CA . GLN A 12 ? 0.3153 0.4971 0.3075 -0.0136 -0.0343 -0.0908 10 GLN A CA +91 C C . GLN A 12 ? 0.3359 0.4752 0.3616 -0.0178 -0.0267 -0.1010 10 GLN A C +92 O O . GLN A 12 ? 0.3370 0.4481 0.3682 -0.0129 -0.0206 -0.0790 10 GLN A O +93 C CB . GLN A 12 ? 0.3039 0.4885 0.2974 -0.0165 -0.0402 -0.0685 10 GLN A CB +94 C CG . GLN A 12 ? 0.3113 0.5338 0.2818 -0.0078 -0.0425 -0.0454 10 GLN A CG +95 C CD . GLN A 12 ? 0.3018 0.5327 0.2811 -0.0072 -0.0461 -0.0236 10 GLN A CD +96 O OE1 . GLN A 12 ? 0.3706 0.6385 0.3395 0.0032 -0.0464 -0.0011 10 GLN A OE1 +97 N NE2 . GLN A 12 ? 0.2880 0.4871 0.2875 -0.0150 -0.0450 -0.0233 10 GLN A NE2 +98 N N . ASP A 13 ? 0.3953 0.5353 0.4488 -0.0272 -0.0260 -0.1339 11 ASP A N +99 C CA . ASP A 13 ? 0.4191 0.5145 0.5191 -0.0317 -0.0134 -0.1368 11 ASP A CA +100 C C . ASP A 13 ? 0.3864 0.4639 0.5010 -0.0366 -0.0135 -0.1104 11 ASP A C +101 O O . ASP A 13 ? 0.3657 0.4653 0.4616 -0.0398 -0.0244 -0.0983 11 ASP A O +102 C CB . ASP A 13 ? 0.4829 0.5771 0.6245 -0.0425 -0.0052 -0.1865 11 ASP A CB +103 C CG . ASP A 13 ? 0.5149 0.6446 0.6719 -0.0604 -0.0160 -0.2196 11 ASP A CG +104 O OD1 . ASP A 13 ? 0.5619 0.7055 0.7497 -0.0720 -0.0114 -0.2719 11 ASP A OD1 +105 O OD2 . ASP A 13 ? 0.5466 0.6937 0.6910 -0.0634 -0.0278 -0.1983 11 ASP A OD2 +106 N N . GLU A 14 ? 0.3985 0.4370 0.5489 -0.0340 0.0021 -0.0963 12 GLU A N +107 C CA . GLU A 14 ? 0.4134 0.4363 0.5764 -0.0349 0.0072 -0.0659 12 GLU A CA +108 C C . GLU A 14 ? 0.4248 0.4639 0.6082 -0.0520 0.0012 -0.0844 12 GLU A C +109 O O . GLU A 14 ? 0.4209 0.4699 0.5924 -0.0532 -0.0036 -0.0645 12 GLU A O +110 C CB . GLU A 14 ? 0.4495 0.4342 0.6580 -0.0277 0.0298 -0.0480 12 GLU A CB +111 C CG . GLU A 14 ? 0.4633 0.4370 0.6864 -0.0263 0.0398 -0.0120 12 GLU A CG +112 C CD . GLU A 14 ? 0.4830 0.4224 0.7574 -0.0155 0.0670 0.0153 12 GLU A CD +113 O OE1 . GLU A 14 ? 0.5352 0.4535 0.8418 -0.0096 0.0796 0.0037 12 GLU A OE1 +114 O OE2 . GLU A 14 ? 0.5010 0.4366 0.7854 -0.0107 0.0786 0.0512 12 GLU A OE2 +115 N N . GLU A 15 ? 0.4450 0.4923 0.6633 -0.0656 0.0022 -0.1273 13 GLU A N +116 C CA . GLU A 15 ? 0.4708 0.5420 0.7220 -0.0843 -0.0031 -0.1518 13 GLU A CA +117 C C . GLU A 15 ? 0.4155 0.5385 0.6214 -0.0819 -0.0261 -0.1438 13 GLU A C +118 O O . GLU A 15 ? 0.3926 0.5233 0.6065 -0.0849 -0.0283 -0.1252 13 GLU A O +119 C CB . GLU A 15 ? 0.5155 0.5961 0.8142 -0.1012 0.0017 -0.2118 13 GLU A CB +120 C CG . GLU A 15 ? 0.5557 0.6528 0.9146 -0.1249 0.0035 -0.2428 13 GLU A CG +121 C CD . GLU A 15 ? 0.5586 0.7321 0.8907 -0.1317 -0.0247 -0.2595 13 GLU A CD +122 O OE1 . GLU A 15 ? 0.5714 0.7597 0.9421 -0.1450 -0.0256 -0.2591 13 GLU A OE1 +123 O OE2 . GLU A 15 ? 0.5274 0.7505 0.8040 -0.1219 -0.0440 -0.2698 13 GLU A OE2 +124 N N . ARG A 16 ? 0.4310 0.5847 0.5903 -0.0722 -0.0385 -0.1482 14 ARG A N +125 C CA . ARG A 16 ? 0.4058 0.6086 0.5267 -0.0646 -0.0552 -0.1327 14 ARG A CA +126 C C . ARG A 16 ? 0.3567 0.5365 0.4589 -0.0541 -0.0508 -0.0871 14 ARG A C +127 O O . ARG A 16 ? 0.3169 0.5200 0.4183 -0.0520 -0.0565 -0.0707 14 ARG A O +128 C CB . ARG A 16 ? 0.4324 0.6671 0.5123 -0.0541 -0.0617 -0.1400 14 ARG A CB +129 C CG . ARG A 16 ? 0.4338 0.7240 0.4825 -0.0431 -0.0743 -0.1188 14 ARG A CG +130 C CD . ARG A 16 ? 0.4880 0.8231 0.4999 -0.0326 -0.0784 -0.1271 14 ARG A CD +131 N NE . ARG A 16 ? 0.5231 0.9070 0.5090 -0.0166 -0.0845 -0.0907 14 ARG A NE +132 C CZ . ARG A 16 ? 0.5345 0.9486 0.4858 -0.0001 -0.0807 -0.0685 14 ARG A CZ +133 N NH1 . ARG A 16 ? 0.5713 0.9757 0.5054 0.0012 -0.0731 -0.0842 14 ARG A NH1 +134 N NH2 . ARG A 16 ? 0.4945 0.9483 0.4342 0.0171 -0.0809 -0.0256 14 ARG A NH2 +135 N N . VAL A 17 ? 0.3500 0.4882 0.4405 -0.0469 -0.0397 -0.0685 15 VAL A N +136 C CA . VAL A 17 ? 0.3001 0.4230 0.3741 -0.0394 -0.0347 -0.0361 15 VAL A CA +137 C C . VAL A 17 ? 0.2943 0.4091 0.3949 -0.0456 -0.0293 -0.0256 15 VAL A C +138 O O . VAL A 17 ? 0.2681 0.3911 0.3622 -0.0418 -0.0285 -0.0081 15 VAL A O +139 C CB . VAL A 17 ? 0.2978 0.3924 0.3578 -0.0319 -0.0260 -0.0237 15 VAL A CB +140 C CG1 . VAL A 17 ? 0.2690 0.3570 0.3164 -0.0278 -0.0206 -0.0012 15 VAL A CG1 +141 C CG2 . VAL A 17 ? 0.3103 0.4169 0.3470 -0.0257 -0.0293 -0.0307 15 VAL A CG2 +142 N N . ARG A 18 ? 0.3021 0.3965 0.4367 -0.0534 -0.0205 -0.0333 16 ARG A N +143 C CA . ARG A 18 ? 0.3140 0.3981 0.4790 -0.0588 -0.0096 -0.0195 16 ARG A CA +144 C C . ARG A 18 ? 0.2988 0.4188 0.4819 -0.0670 -0.0194 -0.0295 16 ARG A C +145 O O . ARG A 18 ? 0.2787 0.4041 0.4658 -0.0649 -0.0149 -0.0110 16 ARG A O +146 C CB . ARG A 18 ? 0.3631 0.4174 0.5743 -0.0656 0.0067 -0.0246 16 ARG A CB +147 C CG . ARG A 18 ? 0.4078 0.4328 0.6082 -0.0513 0.0213 0.0044 16 ARG A CG +148 C CD . ARG A 18 ? 0.4819 0.4752 0.7380 -0.0541 0.0425 0.0059 16 ARG A CD +149 N NE . ARG A 18 ? 0.5374 0.5137 0.7836 -0.0347 0.0556 0.0400 16 ARG A NE +150 C CZ . ARG A 18 ? 0.5463 0.5310 0.7712 -0.0208 0.0637 0.0807 16 ARG A CZ +151 N NH1 . ARG A 18 ? 0.5192 0.5207 0.7320 -0.0244 0.0643 0.0928 16 ARG A NH1 +152 N NH2 . ARG A 18 ? 0.6274 0.6113 0.8426 -0.0014 0.0717 0.1088 16 ARG A NH2 +153 N N . ARG A 19 ? 0.3364 0.4872 0.5333 -0.0758 -0.0321 -0.0618 17 ARG A N +154 C CA . ARG A 19 ? 0.3169 0.5245 0.5306 -0.0821 -0.0473 -0.0766 17 ARG A CA +155 C C . ARG A 19 ? 0.2800 0.5125 0.4618 -0.0659 -0.0543 -0.0475 17 ARG A C +156 O O . ARG A 19 ? 0.2751 0.5257 0.4749 -0.0638 -0.0533 -0.0319 17 ARG A O +157 C CB . ARG A 19 ? 0.3610 0.6131 0.5801 -0.0911 -0.0624 -0.1219 17 ARG A CB +158 C CG . ARG A 19 ? 0.4077 0.6708 0.6882 -0.1147 -0.0599 -0.1661 17 ARG A CG +159 C CD . ARG A 19 ? 0.4630 0.8029 0.7487 -0.1249 -0.0805 -0.2188 17 ARG A CD +160 N NE . ARG A 19 ? 0.4970 0.8390 0.7398 -0.1159 -0.0836 -0.2343 17 ARG A NE +161 C CZ . ARG A 19 ? 0.4723 0.8500 0.6550 -0.0962 -0.0957 -0.2145 17 ARG A CZ +162 N NH1 . ARG A 19 ? 0.5154 0.8846 0.6693 -0.0904 -0.0921 -0.2295 17 ARG A NH1 +163 N NH2 . ARG A 19 ? 0.4488 0.8686 0.6059 -0.0809 -0.1073 -0.1776 17 ARG A NH2 +164 N N . GLU A 20 ? 0.2582 0.4888 0.3987 -0.0532 -0.0571 -0.0376 18 GLU A N +165 C CA . GLU A 20 ? 0.2582 0.5088 0.3792 -0.0369 -0.0581 -0.0082 18 GLU A CA +166 C C . GLU A 20 ? 0.2472 0.4565 0.3680 -0.0314 -0.0409 0.0174 18 GLU A C +167 O O . GLU A 20 ? 0.2141 0.4351 0.3424 -0.0216 -0.0360 0.0380 18 GLU A O +168 C CB . GLU A 20 ? 0.2775 0.5397 0.3619 -0.0255 -0.0614 -0.0032 18 GLU A CB +169 C CG . GLU A 20 ? 0.3007 0.6224 0.3760 -0.0263 -0.0781 -0.0276 18 GLU A CG +170 C CD . GLU A 20 ? 0.3094 0.6475 0.3483 -0.0127 -0.0774 -0.0166 18 GLU A CD +171 O OE1 . GLU A 20 ? 0.3538 0.7470 0.3783 -0.0119 -0.0895 -0.0386 18 GLU A OE1 +172 O OE2 . GLU A 20 ? 0.3629 0.6696 0.3897 -0.0025 -0.0640 0.0130 18 GLU A OE2 +173 N N . CYS A 21 ? 0.2567 0.4229 0.3722 -0.0367 -0.0303 0.0150 19 CYS A N +174 C CA . CYS A 21 ? 0.2364 0.3772 0.3513 -0.0336 -0.0144 0.0308 19 CYS A CA +175 C C . CYS A 21 ? 0.2429 0.3937 0.3894 -0.0366 -0.0076 0.0376 19 CYS A C +176 O O . CYS A 21 ? 0.2359 0.3876 0.3873 -0.0296 0.0025 0.0498 19 CYS A O +177 C CB . CYS A 21 ? 0.2705 0.3816 0.3714 -0.0360 -0.0066 0.0294 19 CYS A CB +178 S SG . CYS A 21 ? 0.2546 0.3535 0.3378 -0.0306 0.0090 0.0390 19 CYS A SG +179 N N . LYS A 22 ? 0.2394 0.3968 0.4140 -0.0480 -0.0104 0.0270 20 LYS A N +180 C CA . LYS A 22 ? 0.2396 0.4149 0.4539 -0.0537 -0.0052 0.0304 20 LYS A CA +181 C C . LYS A 22 ? 0.2498 0.4697 0.4782 -0.0459 -0.0150 0.0362 20 LYS A C +182 O O . LYS A 22 ? 0.2279 0.4539 0.4742 -0.0401 -0.0042 0.0508 20 LYS A O +183 C CB . LYS A 22 ? 0.2404 0.4200 0.4928 -0.0703 -0.0075 0.0109 20 LYS A CB +184 C CG . LYS A 22 ? 0.2462 0.4495 0.5501 -0.0800 -0.0018 0.0107 20 LYS A CG +185 C CD . LYS A 22 ? 0.2577 0.4527 0.6094 -0.0996 0.0036 -0.0106 20 LYS A CD +186 C CE . LYS A 22 ? 0.2663 0.4709 0.6765 -0.1110 0.0193 -0.0048 20 LYS A CE +187 N NZ . LYS A 22 ? 0.2599 0.5285 0.7004 -0.1163 0.0011 -0.0212 20 LYS A NZ +188 N N . GLU A 23 ? 0.2619 0.5182 0.4829 -0.0438 -0.0341 0.0256 21 GLU A N +189 C CA . GLU A 23 ? 0.2748 0.5848 0.5034 -0.0298 -0.0444 0.0399 21 GLU A CA +190 C C . GLU A 23 ? 0.2555 0.5445 0.4744 -0.0112 -0.0283 0.0705 21 GLU A C +191 O O . GLU A 23 ? 0.2258 0.5356 0.4722 -0.0007 -0.0218 0.0887 21 GLU A O +192 C CB . GLU A 23 ? 0.3060 0.6610 0.5128 -0.0263 -0.0648 0.0280 21 GLU A CB +193 C CG . GLU A 23 ? 0.3319 0.7400 0.5652 -0.0433 -0.0834 -0.0085 21 GLU A CG +194 C CD . GLU A 23 ? 0.3688 0.8258 0.5751 -0.0428 -0.1023 -0.0325 21 GLU A CD +195 O OE1 . GLU A 23 ? 0.3898 0.8338 0.5528 -0.0286 -0.0999 -0.0170 21 GLU A OE1 +196 O OE2 . GLU A 23 ? 0.3360 0.8430 0.5688 -0.0593 -0.1169 -0.0723 21 GLU A OE2 +197 N N . ARG A 24 ? 0.2722 0.5185 0.4584 -0.0083 -0.0194 0.0726 22 ARG A N +198 C CA A ARG A 24 ? 0.2833 0.5045 0.4677 0.0052 -0.0003 0.0927 22 ARG A CA +199 C CA B ARG A 24 ? 0.2710 0.4922 0.4555 0.0052 -0.0003 0.0927 22 ARG A CA +200 C C . ARG A 24 ? 0.2650 0.4628 0.4708 0.0040 0.0197 0.0937 22 ARG A C +201 O O . ARG A 24 ? 0.3032 0.5036 0.5360 0.0169 0.0353 0.1103 22 ARG A O +202 C CB A ARG A 24 ? 0.3002 0.4868 0.4511 0.0026 0.0034 0.0852 22 ARG A CB +203 C CB B ARG A 24 ? 0.2696 0.4562 0.4206 0.0026 0.0034 0.0852 22 ARG A CB +204 C CG A ARG A 24 ? 0.3219 0.4770 0.4773 0.0095 0.0257 0.0939 22 ARG A CG +205 C CG B ARG A 24 ? 0.2724 0.4276 0.4283 0.0095 0.0258 0.0939 22 ARG A CG +206 C CD A ARG A 24 ? 0.3382 0.4703 0.4657 0.0034 0.0260 0.0819 22 ARG A CD +207 C CD B ARG A 24 ? 0.2695 0.4018 0.3979 0.0037 0.0263 0.0823 22 ARG A CD +208 N NE A ARG A 24 ? 0.3469 0.4970 0.4562 0.0082 0.0150 0.0890 22 ARG A NE +209 N NE B ARG A 24 ? 0.2607 0.4126 0.3722 0.0092 0.0153 0.0908 22 ARG A NE +210 C CZ A ARG A 24 ? 0.3555 0.5170 0.4400 0.0015 -0.0025 0.0737 22 ARG A CZ +211 C CZ B ARG A 24 ? 0.2654 0.4220 0.3871 0.0218 0.0273 0.1140 22 ARG A CZ +212 N NH1 A ARG A 24 ? 0.3535 0.5081 0.4343 -0.0096 -0.0109 0.0549 22 ARG A NH1 +213 N NH1 B ARG A 24 ? 0.2618 0.4432 0.3633 0.0277 0.0185 0.1227 22 ARG A NH1 +214 N NH2 A ARG A 24 ? 0.3694 0.5497 0.4371 0.0071 -0.0081 0.0784 22 ARG A NH2 +215 N NH2 B ARG A 24 ? 0.2640 0.4026 0.4213 0.0300 0.0513 0.1304 22 ARG A NH2 +216 N N . GLY A 25 ? 0.2661 0.4441 0.4636 -0.0091 0.0228 0.0782 23 GLY A N +217 C CA . GLY A 25 ? 0.2557 0.4212 0.4680 -0.0097 0.0435 0.0784 23 GLY A CA +218 C C . GLY A 25 ? 0.2604 0.4585 0.5158 -0.0051 0.0452 0.0900 23 GLY A C +219 O O . GLY A 25 ? 0.2415 0.4400 0.5212 0.0054 0.0639 0.0990 23 GLY A O +220 N N . GLU A 26 ? 0.2488 0.4783 0.5207 -0.0135 0.0270 0.0863 24 GLU A N +221 C CA . GLU A 26 ? 0.2433 0.5126 0.5624 -0.0135 0.0270 0.0926 24 GLU A CA +222 C C . GLU A 26 ? 0.2680 0.5733 0.6101 0.0069 0.0253 0.1137 24 GLU A C +223 O O . GLU A 26 ? 0.2726 0.5916 0.6516 0.0163 0.0404 0.1267 24 GLU A O +224 C CB . GLU A 26 ? 0.2442 0.5435 0.5845 -0.0314 0.0085 0.0750 24 GLU A CB +225 C CG . GLU A 26 ? 0.2643 0.5244 0.6030 -0.0471 0.0226 0.0665 24 GLU A CG +226 C CD . GLU A 26 ? 0.2817 0.5583 0.6592 -0.0674 0.0154 0.0479 24 GLU A CD +227 O OE1 . GLU A 26 ? 0.2985 0.6157 0.6913 -0.0743 -0.0067 0.0280 24 GLU A OE1 +228 O OE2 . GLU A 26 ? 0.3190 0.5679 0.7117 -0.0761 0.0353 0.0531 24 GLU A OE2 +229 N N . ARG A 27 ? 0.2589 0.5796 0.5809 0.0169 0.0112 0.1217 25 ARG A N +230 C CA . ARG A 27 ? 0.2888 0.6473 0.6325 0.0418 0.0121 0.1527 25 ARG A CA +231 C C . ARG A 27 ? 0.2809 0.5981 0.6464 0.0577 0.0459 0.1708 25 ARG A C +232 O O . ARG A 27 ? 0.2758 0.6209 0.6821 0.0799 0.0562 0.2001 25 ARG A O +233 C CB . ARG A 27 ? 0.3153 0.6924 0.6263 0.0491 -0.0037 0.1597 25 ARG A CB +234 C CG . ARG A 27 ? 0.3922 0.8001 0.7178 0.0791 0.0030 0.2021 25 ARG A CG +235 C CD . ARG A 27 ? 0.4249 0.7986 0.7148 0.0830 0.0094 0.2088 25 ARG A CD +236 N NE . ARG A 27 ? 0.4580 0.8434 0.7042 0.0662 -0.0143 0.1804 25 ARG A NE +237 C CZ . ARG A 27 ? 0.5103 0.8544 0.7213 0.0593 -0.0102 0.1702 25 ARG A CZ +238 N NH1 . ARG A 27 ? 0.5219 0.8085 0.7366 0.0633 0.0158 0.1803 25 ARG A NH1 +239 N NH2 . ARG A 27 ? 0.5185 0.8805 0.6961 0.0461 -0.0314 0.1434 25 ARG A NH2 +240 N N . GLN A 28 ? 0.2763 0.5329 0.6181 0.0474 0.0635 0.1520 26 GLN A N +241 C CA . GLN A 28 ? 0.3171 0.5343 0.6781 0.0575 0.0958 0.1554 26 GLN A CA +242 C C . GLN A 28 ? 0.2847 0.4863 0.6576 0.0498 0.1154 0.1367 26 GLN A C +243 O O . GLN A 28 ? 0.2857 0.4568 0.6755 0.0552 0.1449 0.1281 26 GLN A O +244 C CB . GLN A 28 ? 0.3616 0.5319 0.6869 0.0484 0.1025 0.1372 26 GLN A CB +245 C CG . GLN A 28 ? 0.4272 0.6006 0.7448 0.0583 0.0959 0.1571 26 GLN A CG +246 C CD . GLN A 28 ? 0.4618 0.5927 0.7463 0.0436 0.1009 0.1317 26 GLN A CD +247 O OE1 . GLN A 28 ? 0.5569 0.6528 0.8533 0.0382 0.1253 0.1112 26 GLN A OE1 +248 N NE2 . GLN A 28 ? 0.4677 0.6078 0.7155 0.0370 0.0790 0.1291 26 GLN A NE2 +249 N N . ASN A 29 ? 0.2755 0.4968 0.6413 0.0359 0.1031 0.1272 27 ASN A N +250 C CA . ASN A 29 ? 0.2768 0.4836 0.6395 0.0268 0.1229 0.1103 27 ASN A CA +251 C C . ASN A 29 ? 0.2867 0.4549 0.6113 0.0205 0.1388 0.0859 27 ASN A C +252 O O . ASN A 29 ? 0.3172 0.4753 0.6508 0.0238 0.1653 0.0716 27 ASN A O +253 C CB . ASN A 29 ? 0.2979 0.5243 0.7126 0.0395 0.1450 0.1209 27 ASN A CB +254 C CG . ASN A 29 ? 0.2869 0.5653 0.7410 0.0426 0.1271 0.1404 27 ASN A CG +255 O OD1 . ASN A 29 ? 0.2732 0.5722 0.7189 0.0270 0.1045 0.1353 27 ASN A OD1 +256 N ND2 . ASN A 29 ? 0.3181 0.6229 0.8229 0.0638 0.1374 0.1624 27 ASN A ND2 +257 N N . CYS A 30 ? 0.2676 0.4216 0.5513 0.0113 0.1216 0.0778 28 CYS A N +258 C CA . CYS A 30 ? 0.2855 0.4183 0.5291 0.0030 0.1285 0.0536 28 CYS A CA +259 C C . CYS A 30 ? 0.2496 0.3886 0.4574 -0.0078 0.1109 0.0549 28 CYS A C +260 O O . CYS A 30 ? 0.2551 0.4030 0.4709 -0.0113 0.0923 0.0680 28 CYS A O +261 C CB . CYS A 30 ? 0.2989 0.4104 0.5363 0.0046 0.1252 0.0481 28 CYS A CB +262 S SG . CYS A 30 ? 0.3691 0.4649 0.6646 0.0208 0.1528 0.0565 28 CYS A SG +263 N N . GLN A 31 ? 0.2535 0.3940 0.4286 -0.0120 0.1197 0.0412 29 GLN A N +264 C CA . GLN A 31 ? 0.2512 0.3985 0.3985 -0.0171 0.1109 0.0498 29 GLN A CA +265 C C . GLN A 31 ? 0.2433 0.3771 0.3682 -0.0205 0.0900 0.0474 29 GLN A C +266 O O . GLN A 31 ? 0.2406 0.3644 0.3583 -0.0202 0.0874 0.0327 29 GLN A O +267 C CB . GLN A 31 ? 0.2771 0.4451 0.3926 -0.0151 0.1271 0.0403 29 GLN A CB +268 C CG . GLN A 31 ? 0.2988 0.4870 0.4309 -0.0109 0.1511 0.0452 29 GLN A CG +269 C CD . GLN A 31 ? 0.3309 0.5556 0.4236 -0.0066 0.1680 0.0363 29 GLN A CD +270 O OE1 . GLN A 31 ? 0.3302 0.5717 0.3834 -0.0053 0.1592 0.0374 29 GLN A OE1 +271 N NE2 . GLN A 31 ? 0.3570 0.6030 0.4603 -0.0021 0.1929 0.0296 29 GLN A NE2 +272 N N . TYR A 32 ? 0.2343 0.3657 0.3567 -0.0241 0.0785 0.0608 30 TYR A N +273 C CA . TYR A 32 ? 0.2183 0.3376 0.3235 -0.0262 0.0604 0.0568 30 TYR A CA +274 C C . TYR A 32 ? 0.2333 0.3533 0.3229 -0.0253 0.0609 0.0686 30 TYR A C +275 O O . TYR A 32 ? 0.2517 0.3751 0.3573 -0.0254 0.0713 0.0856 30 TYR A O +276 C CB . TYR A 32 ? 0.2051 0.3214 0.3345 -0.0297 0.0447 0.0579 30 TYR A CB +277 C CG . TYR A 32 ? 0.2100 0.3305 0.3697 -0.0371 0.0433 0.0650 30 TYR A CG +278 C CD1 . TYR A 32 ? 0.2138 0.3222 0.3755 -0.0424 0.0374 0.0637 30 TYR A CD1 +279 C CD2 . TYR A 32 ? 0.2024 0.3390 0.3982 -0.0396 0.0494 0.0699 30 TYR A CD2 +280 C CE1 . TYR A 32 ? 0.2177 0.3254 0.4215 -0.0524 0.0414 0.0649 30 TYR A CE1 +281 C CE2 . TYR A 32 ? 0.2207 0.3635 0.4561 -0.0505 0.0500 0.0712 30 TYR A CE2 +282 C CZ . TYR A 32 ? 0.2297 0.3551 0.4705 -0.0577 0.0483 0.0681 30 TYR A CZ +283 O OH . TYR A 32 ? 0.2287 0.3570 0.5229 -0.0716 0.0534 0.0639 30 TYR A OH +284 N N . GLN A 33 ? 0.2460 0.3636 0.3106 -0.0231 0.0515 0.0632 31 GLN A N +285 C CA . GLN A 33 ? 0.2637 0.3834 0.3173 -0.0177 0.0513 0.0788 31 GLN A CA +286 C C . GLN A 33 ? 0.2601 0.3678 0.3056 -0.0179 0.0358 0.0696 31 GLN A C +287 O O . GLN A 33 ? 0.2353 0.3434 0.2701 -0.0207 0.0281 0.0517 31 GLN A O +288 C CB . GLN A 33 ? 0.3136 0.4675 0.3334 -0.0089 0.0592 0.0813 31 GLN A CB +289 C CG . GLN A 33 ? 0.3439 0.5206 0.3626 -0.0055 0.0779 0.0906 31 GLN A CG +290 C CD . GLN A 33 ? 0.3978 0.5727 0.4386 -0.0005 0.0934 0.1264 31 GLN A CD +291 O OE1 . GLN A 33 ? 0.4225 0.6143 0.4703 0.0014 0.1121 0.1375 31 GLN A OE1 +292 N NE2 . GLN A 33 ? 0.4110 0.5695 0.4654 0.0034 0.0912 0.1471 31 GLN A NE2 +293 N N . ILE A 34 ? 0.2770 0.3743 0.3331 -0.0138 0.0361 0.0837 32 ILE A N +294 C CA . ILE A 34 ? 0.2941 0.3817 0.3462 -0.0121 0.0252 0.0753 32 ILE A CA +295 C C . ILE A 34 ? 0.2986 0.4073 0.3310 0.0016 0.0281 0.0922 32 ILE A C +296 O O . ILE A 34 ? 0.2670 0.3855 0.3054 0.0122 0.0410 0.1209 32 ILE A O +297 C CB . ILE A 34 ? 0.3192 0.3811 0.4071 -0.0180 0.0250 0.0709 32 ILE A CB +298 C CG1 . ILE A 34 ? 0.3281 0.3909 0.4255 -0.0300 0.0140 0.0476 32 ILE A CG1 +299 C CG2 . ILE A 34 ? 0.3444 0.3980 0.4306 -0.0125 0.0200 0.0653 32 ILE A CG2 +300 C CD1 . ILE A 34 ? 0.3633 0.4316 0.4848 -0.0368 0.0208 0.0523 32 ILE A CD1 +301 N N . ARG A 35 ? 0.2971 0.4213 0.3074 0.0025 0.0170 0.0763 33 ARG A N +302 C CA . ARG A 35 ? 0.3092 0.4685 0.3008 0.0153 0.0146 0.0864 33 ARG A CA +303 C C . ARG A 35 ? 0.3206 0.4666 0.3219 0.0187 0.0070 0.0818 33 ARG A C +304 O O . ARG A 35 ? 0.3081 0.4218 0.3240 0.0100 0.0042 0.0673 33 ARG A O +305 C CB . ARG A 35 ? 0.3066 0.5047 0.2724 0.0099 0.0095 0.0624 33 ARG A CB +306 C CG . ARG A 35 ? 0.3114 0.5139 0.2725 0.0018 0.0186 0.0510 33 ARG A CG +307 C CD . ARG A 35 ? 0.3337 0.5599 0.2872 0.0132 0.0302 0.0789 33 ARG A CD +308 N NE . ARG A 35 ? 0.3202 0.5661 0.2637 0.0083 0.0404 0.0650 33 ARG A NE +309 C CZ . ARG A 35 ? 0.3665 0.6298 0.3062 0.0169 0.0547 0.0897 33 ARG A CZ +310 N NH1 . ARG A 35 ? 0.3769 0.6322 0.3298 0.0295 0.0625 0.1323 33 ARG A NH1 +311 N NH2 . ARG A 35 ? 0.3931 0.6792 0.3227 0.0130 0.0658 0.0726 33 ARG A NH2 +312 N N . LYS A 36 ? 0.3176 0.4973 0.3105 0.0326 0.0039 0.0937 34 LYS A N +313 C CA . LYS A 36 ? 0.3356 0.5103 0.3379 0.0366 -0.0023 0.0864 34 LYS A CA +314 C C . LYS A 36 ? 0.3073 0.5325 0.2919 0.0380 -0.0128 0.0738 34 LYS A C +315 O O . LYS A 36 ? 0.2910 0.5684 0.2584 0.0445 -0.0153 0.0800 34 LYS A O +316 C CB . LYS A 36 ? 0.3747 0.5396 0.4027 0.0555 0.0073 0.1161 34 LYS A CB +317 C CG . LYS A 36 ? 0.4122 0.5238 0.4734 0.0506 0.0198 0.1183 34 LYS A CG +318 C CD . LYS A 36 ? 0.4476 0.5423 0.5476 0.0691 0.0344 0.1419 34 LYS A CD +319 C CE . LYS A 36 ? 0.4663 0.5483 0.5742 0.0667 0.0291 0.1147 34 LYS A CE +320 N NZ . LYS A 36 ? 0.5291 0.5804 0.6886 0.0822 0.0496 0.1308 34 LYS A NZ +321 N N . GLU A 37 ? 0.2800 0.4956 0.2699 0.0298 -0.0181 0.0520 35 GLU A N +322 C CA . GLU A 37 ? 0.2709 0.5314 0.2577 0.0292 -0.0261 0.0379 35 GLU A CA +323 C C . GLU A 37 ? 0.2677 0.5195 0.2725 0.0407 -0.0257 0.0461 35 GLU A C +324 O O . GLU A 37 ? 0.2362 0.4498 0.2491 0.0334 -0.0223 0.0337 35 GLU A O +325 C CB . GLU A 37 ? 0.2907 0.5457 0.2775 0.0077 -0.0264 0.0051 35 GLU A CB +326 C CG . GLU A 37 ? 0.3146 0.6241 0.2994 -0.0014 -0.0306 -0.0193 35 GLU A CG +327 C CD . GLU A 37 ? 0.3159 0.6048 0.3149 -0.0235 -0.0220 -0.0498 35 GLU A CD +328 O OE1 . GLU A 37 ? 0.2650 0.5153 0.2639 -0.0297 -0.0134 -0.0497 35 GLU A OE1 +329 O OE2 . GLU A 37 ? 0.3370 0.6511 0.3551 -0.0347 -0.0213 -0.0737 35 GLU A OE2 +330 N N . GLY A 38 ? 0.2469 0.5409 0.2591 0.0614 -0.0280 0.0686 36 GLY A N +331 C CA . GLY A 38 ? 0.2631 0.5429 0.2997 0.0760 -0.0228 0.0797 36 GLY A CA +332 C C . GLY A 38 ? 0.2743 0.4901 0.3285 0.0792 -0.0088 0.0896 36 GLY A C +333 O O . GLY A 38 ? 0.2688 0.4725 0.3270 0.0856 -0.0012 0.1128 36 GLY A O +334 N N . ASN A 39 ? 0.2504 0.4308 0.3169 0.0728 -0.0042 0.0688 37 ASN A N +335 C CA . ASN A 39 ? 0.2787 0.4045 0.3646 0.0690 0.0077 0.0630 37 ASN A CA +336 C C . ASN A 39 ? 0.2609 0.3650 0.3283 0.0465 0.0023 0.0361 37 ASN A C +337 O O . ASN A 39 ? 0.2631 0.3353 0.3477 0.0405 0.0091 0.0212 37 ASN A O +338 C CB . ASN A 39 ? 0.3135 0.4204 0.4298 0.0789 0.0191 0.0527 37 ASN A CB +339 C CG . ASN A 39 ? 0.3624 0.4205 0.5158 0.0782 0.0362 0.0457 37 ASN A CG +340 O OD1 . ASN A 39 ? 0.4083 0.4472 0.5807 0.0802 0.0453 0.0670 37 ASN A OD1 +341 N ND2 . ASN A 39 ? 0.3797 0.4197 0.5472 0.0731 0.0429 0.0111 37 ASN A ND2 +342 N N . CYS A 40 ? 0.2447 0.3698 0.2847 0.0348 -0.0078 0.0282 38 CYS A N +343 C CA . CYS A 40 ? 0.2568 0.3690 0.2824 0.0184 -0.0114 0.0119 38 CYS A CA +344 C C . CYS A 40 ? 0.2906 0.3963 0.3130 0.0134 -0.0113 0.0218 38 CYS A C +345 O O . CYS A 40 ? 0.2825 0.4096 0.2978 0.0181 -0.0117 0.0357 38 CYS A O +346 C CB . CYS A 40 ? 0.2529 0.3868 0.2640 0.0105 -0.0153 0.0027 38 CYS A CB +347 S SG . CYS A 40 ? 0.2406 0.3889 0.2570 0.0152 -0.0124 -0.0068 38 CYS A SG +348 N N . TYR A 41 ? 0.2849 0.3705 0.3123 0.0046 -0.0108 0.0136 39 TYR A N +349 C CA . TYR A 41 ? 0.2924 0.3726 0.3212 -0.0010 -0.0091 0.0216 39 TYR A CA +350 C C . TYR A 41 ? 0.2667 0.3583 0.2787 -0.0091 -0.0129 0.0154 39 TYR A C +351 O O . TYR A 41 ? 0.2231 0.3198 0.2286 -0.0119 -0.0155 0.0061 39 TYR A O +352 C CB . TYR A 41 ? 0.2991 0.3586 0.3527 -0.0074 -0.0059 0.0137 39 TYR A CB +353 C CG . TYR A 41 ? 0.3025 0.3431 0.3867 0.0005 0.0060 0.0240 39 TYR A CG +354 C CD1 . TYR A 41 ? 0.3141 0.3449 0.4144 0.0054 0.0099 0.0109 39 TYR A CD1 +355 C CD2 . TYR A 41 ? 0.3203 0.3535 0.4218 0.0055 0.0179 0.0507 39 TYR A CD2 +356 C CE1 . TYR A 41 ? 0.3379 0.3477 0.4758 0.0165 0.0263 0.0251 39 TYR A CE1 +357 C CE2 . TYR A 41 ? 0.3438 0.3577 0.4822 0.0167 0.0348 0.0699 39 TYR A CE2 +358 C CZ . TYR A 41 ? 0.3576 0.3573 0.5170 0.0226 0.0396 0.0576 39 TYR A CZ +359 O OH . TYR A 41 ? 0.3815 0.3580 0.5871 0.0364 0.0611 0.0796 39 TYR A OH +360 N N . VAL A 42 ? 0.2393 0.3362 0.2483 -0.0106 -0.0092 0.0235 40 VAL A N +361 C CA . VAL A 42 ? 0.2392 0.3456 0.2411 -0.0168 -0.0067 0.0166 40 VAL A CA +362 C C . VAL A 42 ? 0.2283 0.3265 0.2392 -0.0200 -0.0018 0.0225 40 VAL A C +363 O O . VAL A 42 ? 0.2293 0.3284 0.2433 -0.0171 0.0025 0.0338 40 VAL A O +364 C CB . VAL A 42 ? 0.2354 0.3705 0.2258 -0.0156 -0.0051 0.0112 40 VAL A CB +365 C CG1 . VAL A 42 ? 0.2305 0.3708 0.2250 -0.0252 0.0026 -0.0055 40 VAL A CG1 +366 C CG2 . VAL A 42 ? 0.2530 0.4035 0.2417 -0.0126 -0.0105 0.0055 40 VAL A CG2 +367 N N . CYS A 43 ? 0.2303 0.3237 0.2494 -0.0239 -0.0006 0.0191 41 CYS A N +368 C CA . CYS A 43 ? 0.2409 0.3331 0.2732 -0.0257 0.0056 0.0239 41 CYS A CA +369 C C . CYS A 43 ? 0.2481 0.3458 0.2793 -0.0273 0.0179 0.0161 41 CYS A C +370 O O . CYS A 43 ? 0.2499 0.3451 0.2876 -0.0295 0.0238 0.0067 41 CYS A O +371 C CB . CYS A 43 ? 0.2337 0.3284 0.2797 -0.0250 0.0018 0.0277 41 CYS A CB +372 S SG . CYS A 43 ? 0.2395 0.3391 0.3093 -0.0245 0.0100 0.0361 41 CYS A SG +373 N N . GLU A 44 ? 0.2443 0.3512 0.2719 -0.0267 0.0249 0.0177 42 GLU A N +374 C CA . GLU A 44 ? 0.2546 0.3729 0.2833 -0.0293 0.0390 0.0020 42 GLU A CA +375 C C . GLU A 44 ? 0.2481 0.3596 0.2983 -0.0281 0.0501 0.0079 42 GLU A C +376 O O . GLU A 44 ? 0.2557 0.3702 0.3091 -0.0258 0.0500 0.0236 42 GLU A O +377 C CB . GLU A 44 ? 0.2921 0.4422 0.2957 -0.0265 0.0402 -0.0009 42 GLU A CB +378 C CG . GLU A 44 ? 0.3373 0.5101 0.3395 -0.0297 0.0561 -0.0239 42 GLU A CG +379 C CD . GLU A 44 ? 0.3648 0.5860 0.3355 -0.0228 0.0572 -0.0204 42 GLU A CD +380 O OE1 . GLU A 44 ? 0.3780 0.6094 0.3458 -0.0176 0.0688 -0.0069 42 GLU A OE1 +381 O OE2 . GLU A 44 ? 0.3513 0.6035 0.3025 -0.0205 0.0468 -0.0253 42 GLU A OE2 +382 N N . ILE A 45 ? 0.2377 0.3407 0.3098 -0.0293 0.0634 -0.0036 43 ILE A N +383 C CA . ILE A 45 ? 0.2566 0.3542 0.3581 -0.0248 0.0767 0.0042 43 ILE A CA +384 C C . ILE A 45 ? 0.2853 0.3907 0.3922 -0.0280 0.0984 -0.0231 43 ILE A C +385 O O . ILE A 45 ? 0.2484 0.3535 0.3575 -0.0349 0.1057 -0.0503 43 ILE A O +386 C CB . ILE A 45 ? 0.2606 0.3439 0.3937 -0.0183 0.0787 0.0196 43 ILE A CB +387 C CG1 . ILE A 45 ? 0.2380 0.3285 0.3596 -0.0158 0.0552 0.0388 43 ILE A CG1 +388 C CG2 . ILE A 45 ? 0.2744 0.3581 0.4450 -0.0098 0.0947 0.0303 43 ILE A CG2 +389 C CD1 . ILE A 45 ? 0.2342 0.3387 0.3559 -0.0172 0.0438 0.0472 43 ILE A CD1 +390 N N . ARG A 46 ? 0.3012 0.4183 0.4124 -0.0248 0.1093 -0.0205 44 ARG A N +391 C CA . ARG A 46 ? 0.3490 0.4791 0.4685 -0.0266 0.1339 -0.0509 44 ARG A CA +392 C C . ARG A 46 ? 0.3493 0.4666 0.5132 -0.0182 0.1525 -0.0390 44 ARG A C +393 O O . ARG A 46 ? 0.3513 0.4817 0.5143 -0.0137 0.1516 -0.0193 44 ARG A O +394 C CB . ARG A 46 ? 0.3938 0.5657 0.4723 -0.0268 0.1349 -0.0585 44 ARG A CB +395 C CG . ARG A 46 ? 0.4324 0.6282 0.4710 -0.0296 0.1172 -0.0622 44 ARG A CG +396 C CD . ARG A 46 ? 0.4820 0.7330 0.4810 -0.0249 0.1214 -0.0659 44 ARG A CD +397 N NE . ARG A 46 ? 0.5834 0.8657 0.5503 -0.0249 0.1040 -0.0698 44 ARG A NE +398 C CZ . ARG A 46 ? 0.6446 0.9888 0.5712 -0.0169 0.1011 -0.0660 44 ARG A CZ +399 N NH1 . ARG A 46 ? 0.6550 1.0381 0.5629 -0.0080 0.1165 -0.0567 44 ARG A NH1 +400 N NH2 . ARG A 46 ? 0.6802 1.0553 0.5854 -0.0153 0.0834 -0.0678 44 ARG A NH2 +401 N N . CYS A 47 ? 0.3638 0.4576 0.5719 -0.0153 0.1720 -0.0494 45 CYS A N +402 C CA . CYS A 47 ? 0.3743 0.4590 0.6316 -0.0037 0.1930 -0.0371 45 CYS A CA +403 C C . CYS A 47 ? 0.4050 0.4958 0.6793 -0.0059 0.2254 -0.0768 45 CYS A C +404 O O . CYS A 47 ? 0.4109 0.5172 0.6555 -0.0184 0.2276 -0.1171 45 CYS A O +405 C CB . CYS A 47 ? 0.3893 0.4448 0.6940 0.0051 0.2021 -0.0199 45 CYS A CB +406 S SG . CYS A 47 ? 0.3422 0.4023 0.6302 0.0109 0.1684 0.0236 45 CYS A SG +407 O OXT . CYS A 47 ? 0.3983 0.4838 0.7184 0.0054 0.2490 -0.0703 45 CYS A OXT +408 N N . GLY B 1 ? 1.3474 0.7534 0.5957 -0.1336 0.2507 -0.1120 -1 GLY B N +409 C CA . GLY B 1 ? 1.3344 0.7168 0.6034 -0.0860 0.2577 -0.0958 -1 GLY B CA +410 C C . GLY B 1 ? 1.1707 0.6800 0.5626 -0.0418 0.2236 -0.0685 -1 GLY B C +411 O O . GLY B 1 ? 1.1244 0.7074 0.5668 -0.0152 0.2111 -0.0559 -1 GLY B O +412 N N . SER B 2 ? 1.0805 0.6096 0.5121 -0.0378 0.2108 -0.0603 0 SER B N +413 C CA . SER B 2 ? 0.9450 0.5826 0.4813 -0.0092 0.1788 -0.0394 0 SER B CA +414 C C . SER B 2 ? 0.8614 0.5265 0.4334 -0.0429 0.1574 -0.0423 0 SER B C +415 O O . SER B 2 ? 0.8968 0.4875 0.4162 -0.0506 0.1766 -0.0485 0 SER B O +416 C CB . SER B 2 ? 0.9627 0.5929 0.4999 0.0629 0.1975 -0.0184 0 SER B CB +417 N N . GLU B 3 ? 0.7409 0.5067 0.3946 -0.0601 0.1217 -0.0362 1 GLU B N +418 C CA A GLU B 3 ? 0.6637 0.4674 0.3554 -0.0829 0.1029 -0.0357 1 GLU B CA +419 C CA B GLU B 3 ? 0.6730 0.4785 0.3655 -0.0838 0.1023 -0.0358 1 GLU B CA +420 C C . GLU B 3 ? 0.5981 0.4528 0.3559 -0.0485 0.0861 -0.0211 1 GLU B C +421 O O . GLU B 3 ? 0.5147 0.4323 0.3290 -0.0324 0.0673 -0.0108 1 GLU B O +422 C CB A GLU B 3 ? 0.6177 0.4925 0.3417 -0.1257 0.0798 -0.0378 1 GLU B CB +423 C CB B GLU B 3 ? 0.6363 0.5168 0.3639 -0.1243 0.0784 -0.0369 1 GLU B CB +424 C CG A GLU B 3 ? 0.5837 0.4968 0.3339 -0.1474 0.0670 -0.0361 1 GLU B CG +425 C CG B GLU B 3 ? 0.7141 0.5659 0.3779 -0.1739 0.0896 -0.0529 1 GLU B CG +426 C CD A GLU B 3 ? 0.5267 0.5344 0.3271 -0.1661 0.0430 -0.0272 1 GLU B CD +427 C CD B GLU B 3 ? 0.7473 0.5798 0.3856 -0.1627 0.0995 -0.0556 1 GLU B CD +428 O OE1 A GLU B 3 ? 0.4854 0.5450 0.3142 -0.1775 0.0319 -0.0211 1 GLU B OE1 +429 O OE1 B GLU B 3 ? 0.6823 0.5882 0.3736 -0.1540 0.0799 -0.0442 1 GLU B OE1 +430 O OE2 A GLU B 3 ? 0.5257 0.5546 0.3288 -0.1691 0.0385 -0.0252 1 GLU B OE2 +431 O OE2 B GLU B 3 ? 0.8690 0.6069 0.4276 -0.1617 0.1298 -0.0686 1 GLU B OE2 +432 N N . GLU B 4 ? 0.5586 0.3838 0.3038 -0.0440 0.0932 -0.0215 2 GLU B N +433 C CA . GLU B 4 ? 0.4985 0.3642 0.2928 -0.0179 0.0801 -0.0111 2 GLU B CA +434 C C . GLU B 4 ? 0.4604 0.3508 0.2749 -0.0428 0.0684 -0.0145 2 GLU B C +435 O O . GLU B 4 ? 0.4838 0.3337 0.2548 -0.0707 0.0810 -0.0225 2 GLU B O +436 C CB . GLU B 4 ? 0.5544 0.3714 0.3153 0.0186 0.1011 -0.0041 2 GLU B CB +437 C CG . GLU B 4 ? 0.5185 0.3840 0.3260 0.0399 0.0867 0.0054 2 GLU B CG +438 C CD . GLU B 4 ? 0.5806 0.4089 0.3525 0.0795 0.1086 0.0171 2 GLU B CD +439 O OE1 . GLU B 4 ? 0.6270 0.4016 0.3605 0.0752 0.1234 0.0154 2 GLU B OE1 +440 O OE2 . GLU B 4 ? 0.6127 0.4641 0.3880 0.1153 0.1143 0.0304 2 GLU B OE2 +441 N N . ARG B 5 ? 0.3897 0.3410 0.2622 -0.0334 0.0476 -0.0081 3 ARG B N +442 C CA A ARG B 5 ? 0.3780 0.3586 0.2725 -0.0446 0.0388 -0.0081 3 ARG B CA +443 C CA B ARG B 5 ? 0.3700 0.3503 0.2641 -0.0447 0.0389 -0.0081 3 ARG B CA +444 C C . ARG B 5 ? 0.3428 0.3359 0.2643 -0.0157 0.0329 -0.0034 3 ARG B C +445 O O . ARG B 5 ? 0.3151 0.3288 0.2619 0.0013 0.0238 0.0008 3 ARG B O +446 C CB A ARG B 5 ? 0.3431 0.3857 0.2753 -0.0584 0.0221 -0.0037 3 ARG B CB +447 C CB B ARG B 5 ? 0.3252 0.3669 0.2552 -0.0602 0.0226 -0.0040 3 ARG B CB +448 C CG A ARG B 5 ? 0.3673 0.4233 0.2797 -0.0914 0.0231 -0.0062 3 ARG B CG +449 C CG B ARG B 5 ? 0.3458 0.3963 0.2509 -0.0958 0.0253 -0.0077 3 ARG B CG +450 C CD A ARG B 5 ? 0.3298 0.4534 0.2857 -0.0876 0.0067 0.0056 3 ARG B CD +451 C CD B ARG B 5 ? 0.3083 0.4372 0.2448 -0.1114 0.0122 0.0015 3 ARG B CD +452 N NE A ARG B 5 ? 0.3252 0.4742 0.2680 -0.1142 0.0048 0.0063 3 ARG B NE +453 N NE B ARG B 5 ? 0.3237 0.4792 0.2378 -0.1496 0.0120 -0.0003 3 ARG B NE +454 C CZ A ARG B 5 ? 0.3105 0.4699 0.2673 -0.1033 -0.0011 0.0124 3 ARG B CZ +455 C CZ B ARG B 5 ? 0.2941 0.5326 0.2256 -0.1709 0.0027 0.0101 3 ARG B CZ +456 N NH1 A ARG B 5 ? 0.2840 0.4275 0.2645 -0.0721 -0.0047 0.0171 3 ARG B NH1 +457 N NH1 B ARG B 5 ? 0.2587 0.5559 0.2299 -0.1502 -0.0041 0.0244 3 ARG B NH1 +458 N NH2 A ARG B 5 ? 0.3089 0.4989 0.2534 -0.1282 -0.0036 0.0140 3 ARG B NH2 +459 N NH2 B ARG B 5 ? 0.3218 0.5877 0.2280 -0.2103 0.0021 0.0073 3 ARG B NH2 +460 N N . ARG B 6 ? 0.3513 0.3339 0.2629 -0.0163 0.0383 -0.0047 4 ARG B N +461 C CA . ARG B 6 ? 0.3382 0.3313 0.2659 0.0065 0.0346 -0.0019 4 ARG B CA +462 C C . ARG B 6 ? 0.3136 0.3353 0.2599 -0.0014 0.0286 -0.0035 4 ARG B C +463 O O . ARG B 6 ? 0.3292 0.3462 0.2575 -0.0208 0.0361 -0.0046 4 ARG B O +464 C CB . ARG B 6 ? 0.4118 0.3601 0.2999 0.0217 0.0525 0.0018 4 ARG B CB +465 C CG . ARG B 6 ? 0.4513 0.3808 0.3208 0.0476 0.0624 0.0096 4 ARG B CG +466 C CD . ARG B 6 ? 0.5330 0.4180 0.3591 0.0713 0.0838 0.0186 4 ARG B CD +467 N NE . ARG B 6 ? 0.5215 0.4358 0.3621 0.0885 0.0790 0.0254 4 ARG B NE +468 C CZ . ARG B 6 ? 0.5785 0.5255 0.4234 0.1222 0.0801 0.0398 4 ARG B CZ +469 N NH1 . ARG B 6 ? 0.5821 0.5458 0.4237 0.1472 0.0856 0.0515 4 ARG B NH1 +470 N NH2 . ARG B 6 ? 0.5393 0.5118 0.3904 0.1313 0.0764 0.0446 4 ARG B NH2 +471 N N . TYR B 7 ? 0.2784 0.3259 0.2538 0.0127 0.0178 -0.0034 5 TYR B N +472 C CA . TYR B 7 ? 0.2892 0.3635 0.2823 0.0166 0.0142 -0.0036 5 TYR B CA +473 C C . TYR B 7 ? 0.2948 0.3610 0.2842 0.0319 0.0145 -0.0080 5 TYR B C +474 O O . TYR B 7 ? 0.2882 0.3503 0.2816 0.0390 0.0083 -0.0111 5 TYR B O +475 C CB . TYR B 7 ? 0.2837 0.3753 0.2992 0.0239 0.0062 -0.0003 5 TYR B CB +476 C CG . TYR B 7 ? 0.2750 0.3850 0.2963 0.0109 0.0037 0.0061 5 TYR B CG +477 C CD1 . TYR B 7 ? 0.2825 0.3762 0.2995 0.0054 0.0009 0.0055 5 TYR B CD1 +478 C CD2 . TYR B 7 ? 0.2820 0.4361 0.3113 0.0024 0.0046 0.0142 5 TYR B CD2 +479 C CE1 . TYR B 7 ? 0.2719 0.3832 0.2909 -0.0077 -0.0011 0.0105 5 TYR B CE1 +480 C CE2 . TYR B 7 ? 0.2809 0.4631 0.3125 -0.0148 0.0013 0.0207 5 TYR B CE2 +481 C CZ . TYR B 7 ? 0.2771 0.4311 0.3019 -0.0195 -0.0014 0.0173 5 TYR B CZ +482 O OH . TYR B 7 ? 0.2895 0.4700 0.3131 -0.0372 -0.0046 0.0226 5 TYR B OH +483 N N . LYS B 8 ? 0.3017 0.3663 0.2775 0.0311 0.0222 -0.0078 6 LYS B N +484 C CA . LYS B 8 ? 0.3147 0.3780 0.2834 0.0439 0.0232 -0.0110 6 LYS B CA +485 C C . LYS B 8 ? 0.3027 0.3813 0.2824 0.0520 0.0213 -0.0163 6 LYS B C +486 O O . LYS B 8 ? 0.2985 0.3984 0.2865 0.0517 0.0254 -0.0124 6 LYS B O +487 C CB . LYS B 8 ? 0.3376 0.3873 0.2819 0.0417 0.0348 -0.0061 6 LYS B CB +488 C CG . LYS B 8 ? 0.3547 0.4081 0.2881 0.0575 0.0359 -0.0054 6 LYS B CG +489 C CD . LYS B 8 ? 0.3859 0.4221 0.2918 0.0584 0.0497 0.0027 6 LYS B CD +490 C CE . LYS B 8 ? 0.4036 0.4479 0.3087 0.0394 0.0557 0.0015 6 LYS B CE +491 N NZ . LYS B 8 ? 0.4620 0.4720 0.3282 0.0328 0.0724 0.0108 6 LYS B NZ +492 N N . ARG B 9 ? 0.3021 0.3719 0.2764 0.0589 0.0168 -0.0245 7 ARG B N +493 C CA . ARG B 9 ? 0.3303 0.3916 0.3000 0.0691 0.0200 -0.0324 7 ARG B CA +494 C C . ARG B 9 ? 0.3339 0.3906 0.2823 0.0722 0.0226 -0.0427 7 ARG B C +495 O O . ARG B 9 ? 0.3453 0.3786 0.2747 0.0678 0.0212 -0.0548 7 ARG B O +496 C CB . ARG B 9 ? 0.3537 0.3894 0.3222 0.0666 0.0158 -0.0360 7 ARG B CB +497 C CG . ARG B 9 ? 0.3511 0.3976 0.3403 0.0668 0.0141 -0.0240 7 ARG B CG +498 C CD . ARG B 9 ? 0.3961 0.4644 0.3944 0.0839 0.0226 -0.0147 7 ARG B CD +499 N NE . ARG B 9 ? 0.4056 0.4942 0.4211 0.0851 0.0206 -0.0014 7 ARG B NE +500 C CZ . ARG B 9 ? 0.4415 0.5753 0.4722 0.0727 0.0185 0.0082 7 ARG B CZ +501 N NH1 . ARG B 9 ? 0.4576 0.6098 0.4841 0.0560 0.0204 0.0061 7 ARG B NH1 +502 N NH2 . ARG B 9 ? 0.4638 0.6187 0.5069 0.0706 0.0150 0.0192 7 ARG B NH2 +503 N N . CYS B 10 ? 0.3405 0.4172 0.2872 0.0765 0.0284 -0.0381 8 CYS B N +504 C CA . CYS B 10 ? 0.3413 0.4225 0.2678 0.0805 0.0319 -0.0455 8 CYS B CA +505 C C . CYS B 10 ? 0.3789 0.4394 0.2874 0.0910 0.0394 -0.0586 8 CYS B C +506 O O . CYS B 10 ? 0.4014 0.4520 0.2822 0.0875 0.0407 -0.0718 8 CYS B O +507 C CB . CYS B 10 ? 0.3429 0.4463 0.2687 0.0826 0.0392 -0.0347 8 CYS B CB +508 S SG . CYS B 10 ? 0.3259 0.4248 0.2476 0.0754 0.0390 -0.0194 8 CYS B SG +509 N N . GLY B 11 ? 0.3920 0.4443 0.3091 0.1059 0.0470 -0.0546 9 GLY B N +510 C CA . GLY B 11 ? 0.4392 0.4568 0.3285 0.1272 0.0616 -0.0644 9 GLY B CA +511 C C . GLY B 11 ? 0.5006 0.4528 0.3591 0.1223 0.0639 -0.0773 9 GLY B C +512 O O . GLY B 11 ? 0.5327 0.4360 0.3558 0.1428 0.0815 -0.0849 9 GLY B O +513 N N . GLN B 12 ? 0.4859 0.4314 0.3504 0.0956 0.0494 -0.0795 10 GLN B N +514 C CA . GLN B 12 ? 0.5638 0.4492 0.3985 0.0828 0.0513 -0.0894 10 GLN B CA +515 C C . GLN B 12 ? 0.6203 0.5081 0.4365 0.0435 0.0380 -0.1031 10 GLN B C +516 O O . GLN B 12 ? 0.5898 0.5371 0.4312 0.0337 0.0248 -0.0966 10 GLN B O +517 C CB . GLN B 12 ? 0.5459 0.4398 0.4113 0.0836 0.0447 -0.0739 10 GLN B CB +518 C CG . GLN B 12 ? 0.5187 0.4341 0.4083 0.1177 0.0542 -0.0553 10 GLN B CG +519 C CD . GLN B 12 ? 0.5323 0.4525 0.4441 0.1164 0.0484 -0.0410 10 GLN B CD +520 O OE1 . GLN B 12 ? 0.4616 0.3840 0.3823 0.0891 0.0346 -0.0431 10 GLN B OE1 +521 N NE2 . GLN B 12 ? 0.5424 0.4790 0.4659 0.1479 0.0590 -0.0229 10 GLN B NE2 +522 N N . ASP B 13 ? 0.7571 0.5776 0.5229 0.0225 0.0448 -0.1202 11 ASP B N +523 C CA . ASP B 13 ? 0.8556 0.6696 0.5914 -0.0256 0.0345 -0.1344 11 ASP B CA +524 C C . ASP B 13 ? 0.7920 0.6610 0.5681 -0.0446 0.0158 -0.1199 11 ASP B C +525 O O . ASP B 13 ? 0.7904 0.6582 0.5980 -0.0260 0.0158 -0.1046 11 ASP B O +526 C CB . ASP B 13 ? 1.0173 0.7204 0.6838 -0.0371 0.0541 -0.1519 11 ASP B CB +527 C CG . ASP B 13 ? 1.1477 0.8242 0.7542 -0.0954 0.0510 -0.1764 11 ASP B CG +528 O OD1 . ASP B 13 ? 1.3552 0.9189 0.8880 -0.1111 0.0714 -0.1937 11 ASP B OD1 +529 O OD2 . ASP B 13 ? 1.1044 0.8696 0.7307 -0.1249 0.0307 -0.1767 11 ASP B OD2 +530 N N . GLU B 14 ? 0.7638 0.6938 0.5413 -0.0773 0.0005 -0.1217 12 GLU B N +531 C CA . GLU B 14 ? 0.7061 0.6961 0.5187 -0.0901 -0.0142 -0.1058 12 GLU B CA +532 C C . GLU B 14 ? 0.7290 0.6649 0.5280 -0.1086 -0.0112 -0.1072 12 GLU B C +533 O O . GLU B 14 ? 0.5888 0.5445 0.4243 -0.0961 -0.0157 -0.0907 12 GLU B O +534 C CB . GLU B 14 ? 0.7335 0.7990 0.5356 -0.1258 -0.0278 -0.1079 12 GLU B CB +535 C CG . GLU B 14 ? 0.7130 0.8561 0.5481 -0.1368 -0.0412 -0.0888 12 GLU B CG +536 C CD . GLU B 14 ? 0.7544 0.9938 0.5783 -0.1727 -0.0544 -0.0866 12 GLU B CD +537 O OE1 . GLU B 14 ? 0.8667 1.1091 0.6535 -0.1958 -0.0546 -0.1027 12 GLU B OE1 +538 O OE2 . GLU B 14 ? 0.7447 1.0667 0.5960 -0.1761 -0.0639 -0.0670 12 GLU B OE2 +539 N N . GLU B 15 ? 0.8116 0.6701 0.5491 -0.1403 -0.0012 -0.1276 13 GLU B N +540 C CA . GLU B 15 ? 0.8638 0.6544 0.5741 -0.1615 0.0054 -0.1287 13 GLU B CA +541 C C . GLU B 15 ? 0.8442 0.5863 0.5766 -0.1128 0.0176 -0.1130 13 GLU B C +542 O O . GLU B 15 ? 0.7914 0.5294 0.5387 -0.1169 0.0150 -0.1001 13 GLU B O +543 C CB . GLU B 15 ? 1.0153 0.7071 0.6363 -0.2076 0.0200 -0.1554 13 GLU B CB +544 C CG . GLU B 15 ? 1.0528 0.8100 0.6530 -0.2768 0.0032 -0.1660 13 GLU B CG +545 C CD . GLU B 15 ? 1.0650 0.8738 0.6923 -0.3064 -0.0101 -0.1502 13 GLU B CD +546 O OE1 . GLU B 15 ? 1.0535 0.9707 0.6945 -0.3476 -0.0288 -0.1467 13 GLU B OE1 +547 O OE2 . GLU B 15 ? 1.0687 0.8197 0.7043 -0.2858 -0.0014 -0.1386 13 GLU B OE2 +548 N N . ARG B 16 ? 0.8288 0.5468 0.5643 -0.0672 0.0308 -0.1117 14 ARG B N +549 C CA . ARG B 16 ? 0.8021 0.5022 0.5632 -0.0181 0.0416 -0.0925 14 ARG B CA +550 C C . ARG B 16 ? 0.6621 0.4502 0.4926 -0.0058 0.0248 -0.0723 14 ARG B C +551 O O . ARG B 16 ? 0.6114 0.3978 0.4613 0.0080 0.0258 -0.0563 14 ARG B O +552 C CB . ARG B 16 ? 0.8349 0.5205 0.5898 0.0262 0.0579 -0.0925 14 ARG B CB +553 C CG . ARG B 16 ? 0.8383 0.5244 0.6168 0.0751 0.0696 -0.0693 14 ARG B CG +554 C CD . ARG B 16 ? 0.8728 0.5459 0.6363 0.1195 0.0898 -0.0673 14 ARG B CD +555 N NE . ARG B 16 ? 0.8689 0.5889 0.6724 0.1618 0.0943 -0.0388 14 ARG B NE +556 C CZ . ARG B 16 ? 0.8920 0.6480 0.7071 0.2062 0.1079 -0.0248 14 ARG B CZ +557 N NH1 . ARG B 16 ? 0.8540 0.6737 0.7082 0.2360 0.1085 0.0036 14 ARG B NH1 +558 N NH2 . ARG B 16 ? 0.9445 0.6849 0.7328 0.2193 0.1206 -0.0377 14 ARG B NH2 +559 N N . VAL B 17 ? 0.5747 0.4325 0.4343 -0.0095 0.0124 -0.0729 15 VAL B N +560 C CA . VAL B 17 ? 0.5022 0.4251 0.4112 0.0002 0.0016 -0.0569 15 VAL B CA +561 C C . VAL B 17 ? 0.4863 0.4205 0.4037 -0.0224 -0.0075 -0.0503 15 VAL B C +562 O O . VAL B 17 ? 0.4569 0.4064 0.4011 -0.0106 -0.0093 -0.0365 15 VAL B O +563 C CB . VAL B 17 ? 0.4508 0.4302 0.3752 0.0019 -0.0051 -0.0570 15 VAL B CB +564 C CG1 . VAL B 17 ? 0.3882 0.4110 0.3463 0.0113 -0.0104 -0.0419 15 VAL B CG1 +565 C CG2 . VAL B 17 ? 0.4533 0.4252 0.3727 0.0248 0.0047 -0.0605 15 VAL B CG2 +566 N N . ARG B 18 ? 0.5148 0.4503 0.4079 -0.0588 -0.0133 -0.0597 16 ARG B N +567 C CA . ARG B 18 ? 0.5222 0.4856 0.4239 -0.0846 -0.0224 -0.0521 16 ARG B CA +568 C C . ARG B 18 ? 0.5585 0.4656 0.4495 -0.0858 -0.0156 -0.0463 16 ARG B C +569 O O . ARG B 18 ? 0.5230 0.4577 0.4397 -0.0840 -0.0207 -0.0326 16 ARG B O +570 C CB . ARG B 18 ? 0.6052 0.5857 0.4753 -0.1327 -0.0290 -0.0632 16 ARG B CB +571 C CG . ARG B 18 ? 0.6122 0.6692 0.5065 -0.1531 -0.0412 -0.0495 16 ARG B CG +572 C CD . ARG B 18 ? 0.6941 0.8171 0.5690 -0.2010 -0.0515 -0.0546 16 ARG B CD +573 N NE . ARG B 18 ? 0.6391 0.8720 0.5516 -0.1777 -0.0601 -0.0380 16 ARG B NE +574 C CZ . ARG B 18 ? 0.6477 0.9125 0.5603 -0.1610 -0.0607 -0.0396 16 ARG B CZ +575 N NH1 . ARG B 18 ? 0.6892 0.8944 0.5687 -0.1684 -0.0554 -0.0597 16 ARG B NH1 +576 N NH2 . ARG B 18 ? 0.6210 0.9801 0.5621 -0.1342 -0.0646 -0.0188 16 ARG B NH2 +577 N N . ARG B 19 ? 0.6312 0.4523 0.4753 -0.0890 -0.0013 -0.0566 17 ARG B N +578 C CA . ARG B 19 ? 0.6848 0.4344 0.5071 -0.0797 0.0116 -0.0476 17 ARG B CA +579 C C . ARG B 19 ? 0.5991 0.3779 0.4653 -0.0347 0.0125 -0.0271 17 ARG B C +580 O O . ARG B 19 ? 0.5869 0.3695 0.4654 -0.0341 0.0109 -0.0122 17 ARG B O +581 C CB . ARG B 19 ? 0.8045 0.4481 0.5618 -0.0732 0.0339 -0.0606 17 ARG B CB +582 C CG . ARG B 19 ? 0.9182 0.4655 0.6308 -0.0669 0.0531 -0.0512 17 ARG B CG +583 C CD . ARG B 19 ? 1.0389 0.4852 0.6972 -0.0247 0.0830 -0.0529 17 ARG B CD +584 N NE . ARG B 19 ? 1.0759 0.5087 0.7071 -0.0296 0.0877 -0.0763 17 ARG B NE +585 C CZ . ARG B 19 ? 1.0821 0.5288 0.7254 0.0185 0.0973 -0.0740 17 ARG B CZ +586 N NH1 . ARG B 19 ? 1.0368 0.5162 0.7179 0.0770 0.1046 -0.0482 17 ARG B NH1 +587 N NH2 . ARG B 19 ? 1.1216 0.5532 0.7336 0.0053 0.1010 -0.0974 17 ARG B NH2 +588 N N . GLU B 20 ? 0.5532 0.3551 0.4389 -0.0008 0.0159 -0.0256 18 GLU B N +589 C CA . GLU B 20 ? 0.5045 0.3425 0.4255 0.0333 0.0172 -0.0061 18 GLU B CA +590 C C . GLU B 20 ? 0.4207 0.3322 0.3853 0.0224 0.0012 0.0009 18 GLU B C +591 O O . GLU B 20 ? 0.4164 0.3549 0.4022 0.0330 -0.0004 0.0161 18 GLU B O +592 C CB . GLU B 20 ? 0.5106 0.3620 0.4371 0.0666 0.0263 -0.0049 18 GLU B CB +593 C CG . GLU B 20 ? 0.5943 0.3712 0.4747 0.0925 0.0485 -0.0066 18 GLU B CG +594 C CD . GLU B 20 ? 0.5926 0.4000 0.4830 0.1300 0.0586 -0.0013 18 GLU B CD +595 O OE1 . GLU B 20 ? 0.6768 0.4224 0.5247 0.1568 0.0801 -0.0035 18 GLU B OE1 +596 O OE2 . GLU B 20 ? 0.5393 0.4282 0.4736 0.1316 0.0476 0.0053 18 GLU B OE2 +597 N N . CYS B 21 ? 0.3857 0.3297 0.3582 0.0026 -0.0085 -0.0089 19 CYS B N +598 C CA . CYS B 21 ? 0.3178 0.3142 0.3172 -0.0034 -0.0177 -0.0025 19 CYS B CA +599 C C . CYS B 21 ? 0.3198 0.3193 0.3219 -0.0187 -0.0219 0.0062 19 CYS B C +600 O O . CYS B 21 ? 0.2647 0.2916 0.2851 -0.0134 -0.0242 0.0158 19 CYS B O +601 C CB . CYS B 21 ? 0.3070 0.3363 0.3073 -0.0117 -0.0227 -0.0097 19 CYS B CB +602 S SG . CYS B 21 ? 0.2733 0.3467 0.2922 -0.0010 -0.0234 -0.0011 19 CYS B SG +603 N N . LYS B 22 ? 0.3785 0.3511 0.3570 -0.0431 -0.0224 0.0012 20 LYS B N +604 C CA . LYS B 22 ? 0.3927 0.3628 0.3666 -0.0646 -0.0251 0.0096 20 LYS B CA +605 C C . LYS B 22 ? 0.4201 0.3590 0.3941 -0.0463 -0.0183 0.0238 20 LYS B C +606 O O . LYS B 22 ? 0.3844 0.3532 0.3758 -0.0476 -0.0224 0.0358 20 LYS B O +607 C CB . LYS B 22 ? 0.4587 0.3900 0.3938 -0.1012 -0.0234 0.0000 20 LYS B CB +608 C CG . LYS B 22 ? 0.4881 0.4042 0.4088 -0.1295 -0.0233 0.0089 20 LYS B CG +609 C CD . LYS B 22 ? 0.5735 0.4573 0.4477 -0.1795 -0.0220 -0.0046 20 LYS B CD +610 C CE . LYS B 22 ? 0.6177 0.5208 0.4835 -0.2208 -0.0262 0.0041 20 LYS B CE +611 N NZ . LYS B 22 ? 0.6887 0.5094 0.5288 -0.2142 -0.0133 0.0155 20 LYS B NZ +612 N N . GLU B 23 ? 0.4768 0.3595 0.4282 -0.0267 -0.0062 0.0243 21 GLU B N +613 C CA . GLU B 23 ? 0.5127 0.3815 0.4666 0.0042 0.0025 0.0439 21 GLU B CA +614 C C . GLU B 23 ? 0.4395 0.3843 0.4355 0.0190 -0.0058 0.0545 21 GLU B C +615 O O . GLU B 23 ? 0.4367 0.4029 0.4430 0.0221 -0.0077 0.0706 21 GLU B O +616 C CB . GLU B 23 ? 0.6007 0.4178 0.5285 0.0368 0.0195 0.0450 21 GLU B CB +617 C CG . GLU B 23 ? 0.7393 0.4509 0.6057 0.0292 0.0370 0.0405 21 GLU B CG +618 C CD . GLU B 23 ? 0.8334 0.4798 0.6606 0.0625 0.0585 0.0363 21 GLU B CD +619 O OE1 . GLU B 23 ? 0.8259 0.5182 0.6779 0.0917 0.0588 0.0367 21 GLU B OE1 +620 O OE2 . GLU B 23 ? 1.0083 0.5486 0.7709 0.0563 0.0779 0.0318 21 GLU B OE2 +621 N N . ARG B 24 ? 0.3794 0.3615 0.3930 0.0223 -0.0102 0.0446 22 ARG B N +622 C CA . ARG B 24 ? 0.3275 0.3686 0.3665 0.0277 -0.0150 0.0508 22 ARG B CA +623 C C . ARG B 24 ? 0.3022 0.3712 0.3504 0.0080 -0.0227 0.0507 22 ARG B C +624 O O . ARG B 24 ? 0.3007 0.4010 0.3573 0.0069 -0.0247 0.0608 22 ARG B O +625 C CB . ARG B 24 ? 0.2903 0.3471 0.3337 0.0316 -0.0140 0.0390 22 ARG B CB +626 C CG . ARG B 24 ? 0.2508 0.3544 0.3061 0.0242 -0.0165 0.0397 22 ARG B CG +627 C CD . ARG B 24 ? 0.2508 0.3566 0.3023 0.0242 -0.0131 0.0288 22 ARG B CD +628 N NE . ARG B 24 ? 0.2537 0.3608 0.3058 0.0435 -0.0072 0.0319 22 ARG B NE +629 C CZ . ARG B 24 ? 0.2470 0.4003 0.3093 0.0523 -0.0041 0.0440 22 ARG B CZ +630 N NH1 . ARG B 24 ? 0.2421 0.4441 0.3127 0.0370 -0.0082 0.0528 22 ARG B NH1 +631 N NH2 . ARG B 24 ? 0.2649 0.4228 0.3262 0.0758 0.0039 0.0481 22 ARG B NH2 +632 N N . GLY B 25 ? 0.3099 0.3740 0.3539 -0.0063 -0.0258 0.0405 23 GLY B N +633 C CA . GLY B 25 ? 0.2730 0.3630 0.3215 -0.0183 -0.0293 0.0429 23 GLY B CA +634 C C . GLY B 25 ? 0.2841 0.3729 0.3326 -0.0256 -0.0310 0.0566 23 GLY B C +635 O O . GLY B 25 ? 0.2637 0.3789 0.3179 -0.0269 -0.0320 0.0637 23 GLY B O +636 N N . GLU B 26 ? 0.3076 0.3591 0.3422 -0.0334 -0.0294 0.0598 24 GLU B N +637 C CA . GLU B 26 ? 0.3324 0.3727 0.3591 -0.0447 -0.0288 0.0737 24 GLU B CA +638 C C . GLU B 26 ? 0.3483 0.3957 0.3806 -0.0248 -0.0260 0.0908 24 GLU B C +639 O O . GLU B 26 ? 0.3591 0.4317 0.3967 -0.0308 -0.0286 0.1023 24 GLU B O +640 C CB . GLU B 26 ? 0.3951 0.3759 0.3907 -0.0631 -0.0236 0.0714 24 GLU B CB +641 C CG . GLU B 26 ? 0.3892 0.3986 0.3841 -0.0933 -0.0304 0.0586 24 GLU B CG +642 C CD . GLU B 26 ? 0.4652 0.4275 0.4226 -0.1300 -0.0271 0.0539 24 GLU B CD +643 O OE1 . GLU B 26 ? 0.5230 0.4016 0.4429 -0.1289 -0.0153 0.0533 24 GLU B OE1 +644 O OE2 . GLU B 26 ? 0.4841 0.4966 0.4454 -0.1604 -0.0346 0.0509 24 GLU B OE2 +645 N N . ARG B 27 ? 0.3536 0.3919 0.3856 -0.0003 -0.0207 0.0945 25 ARG B N +646 C CA . ARG B 27 ? 0.3700 0.4388 0.4099 0.0221 -0.0181 0.1163 25 ARG B CA +647 C C . ARG B 27 ? 0.3076 0.4472 0.3669 0.0108 -0.0271 0.1174 25 ARG B C +648 O O . ARG B 27 ? 0.3189 0.4947 0.3826 0.0162 -0.0282 0.1352 25 ARG B O +649 C CB . ARG B 27 ? 0.3991 0.4606 0.4368 0.0506 -0.0101 0.1187 25 ARG B CB +650 C CG . ARG B 27 ? 0.4502 0.5710 0.5014 0.0771 -0.0077 0.1416 25 ARG B CG +651 C CD . ARG B 27 ? 0.4531 0.5829 0.5062 0.1023 -0.0002 0.1409 25 ARG B CD +652 N NE . ARG B 27 ? 0.4400 0.6097 0.5090 0.0811 -0.0087 0.1208 25 ARG B NE +653 C CZ . ARG B 27 ? 0.4632 0.6135 0.5284 0.0868 -0.0044 0.1066 25 ARG B CZ +654 N NH1 . ARG B 27 ? 0.5191 0.6074 0.5630 0.1111 0.0082 0.1056 25 ARG B NH1 +655 N NH2 . ARG B 27 ? 0.4622 0.6462 0.5372 0.0651 -0.0108 0.0916 25 ARG B NH2 +656 N N . GLN B 28 ? 0.2821 0.4353 0.3453 -0.0048 -0.0310 0.0976 26 GLN B N +657 C CA . GLN B 28 ? 0.2880 0.4843 0.3524 -0.0191 -0.0341 0.0919 26 GLN B CA +658 C C . GLN B 28 ? 0.2740 0.4676 0.3313 -0.0336 -0.0344 0.0852 26 GLN B C +659 O O . GLN B 28 ? 0.2610 0.4715 0.3068 -0.0449 -0.0323 0.0769 26 GLN B O +660 C CB . GLN B 28 ? 0.2797 0.4719 0.3391 -0.0236 -0.0315 0.0731 26 GLN B CB +661 C CG . GLN B 28 ? 0.3054 0.5188 0.3713 -0.0145 -0.0307 0.0777 26 GLN B CG +662 C CD . GLN B 28 ? 0.2870 0.4882 0.3427 -0.0243 -0.0271 0.0595 26 GLN B CD +663 O OE1 . GLN B 28 ? 0.2784 0.4489 0.3343 -0.0144 -0.0246 0.0516 26 GLN B OE1 +664 N NE2 . GLN B 28 ? 0.3184 0.5368 0.3572 -0.0475 -0.0251 0.0520 26 GLN B NE2 +665 N N . ASN B 29 ? 0.2946 0.4646 0.3524 -0.0352 -0.0345 0.0861 27 ASN B N +666 C CA . ASN B 29 ? 0.2684 0.4490 0.3222 -0.0440 -0.0331 0.0803 27 ASN B CA +667 C C . ASN B 29 ? 0.2666 0.4472 0.3095 -0.0392 -0.0266 0.0648 27 ASN B C +668 O O . ASN B 29 ? 0.2378 0.4282 0.2656 -0.0398 -0.0197 0.0616 27 ASN B O +669 C CB . ASN B 29 ? 0.2797 0.4865 0.3314 -0.0518 -0.0336 0.0916 27 ASN B CB +670 C CG . ASN B 29 ? 0.2956 0.4936 0.3508 -0.0559 -0.0367 0.1104 27 ASN B CG +671 O OD1 . ASN B 29 ? 0.3097 0.4750 0.3617 -0.0603 -0.0364 0.1122 27 ASN B OD1 +672 N ND2 . ASN B 29 ? 0.2799 0.5014 0.3341 -0.0569 -0.0378 0.1244 27 ASN B ND2 +673 N N . CYS B 30 ? 0.2437 0.4052 0.2870 -0.0322 -0.0255 0.0558 28 CYS B N +674 C CA . CYS B 30 ? 0.2537 0.4047 0.2821 -0.0234 -0.0168 0.0446 28 CYS B CA +675 C C . CYS B 30 ? 0.2512 0.4090 0.2880 -0.0171 -0.0187 0.0450 28 CYS B C +676 O O . CYS B 30 ? 0.2599 0.4123 0.3075 -0.0253 -0.0265 0.0467 28 CYS B O +677 C CB . CYS B 30 ? 0.2730 0.4058 0.2924 -0.0249 -0.0140 0.0360 28 CYS B CB +678 S SG . CYS B 30 ? 0.3038 0.4492 0.3059 -0.0441 -0.0120 0.0353 28 CYS B SG +679 N N . GLN B 31 ? 0.2385 0.4067 0.2637 -0.0019 -0.0093 0.0445 29 GLN B N +680 C CA . GLN B 31 ? 0.2572 0.4475 0.2885 0.0049 -0.0109 0.0468 29 GLN B CA +681 C C . GLN B 31 ? 0.2541 0.4172 0.2859 0.0043 -0.0142 0.0375 29 GLN B C +682 O O . GLN B 31 ? 0.2208 0.3522 0.2403 0.0104 -0.0078 0.0305 29 GLN B O +683 C CB . GLN B 31 ? 0.2714 0.4826 0.2865 0.0334 0.0040 0.0538 29 GLN B CB +684 C CG . GLN B 31 ? 0.2963 0.5468 0.3115 0.0386 0.0091 0.0654 29 GLN B CG +685 C CD . GLN B 31 ? 0.3265 0.6014 0.3219 0.0770 0.0286 0.0772 29 GLN B CD +686 O OE1 . GLN B 31 ? 0.3911 0.6667 0.3762 0.1017 0.0371 0.0813 29 GLN B OE1 +687 N NE2 . GLN B 31 ? 0.3217 0.6191 0.3091 0.0877 0.0382 0.0857 29 GLN B NE2 +688 N N . TYR B 32 ? 0.2554 0.4354 0.2959 -0.0059 -0.0225 0.0371 30 TYR B N +689 C CA . TYR B 32 ? 0.2561 0.4163 0.2927 -0.0033 -0.0235 0.0282 30 TYR B CA +690 C C . TYR B 32 ? 0.2815 0.4831 0.3166 -0.0008 -0.0252 0.0311 30 TYR B C +691 O O . TYR B 32 ? 0.2485 0.5010 0.2893 -0.0126 -0.0302 0.0393 30 TYR B O +692 C CB . TYR B 32 ? 0.2682 0.3965 0.3058 -0.0191 -0.0297 0.0223 30 TYR B CB +693 C CG . TYR B 32 ? 0.3008 0.4348 0.3331 -0.0451 -0.0363 0.0224 30 TYR B CG +694 C CD1 . TYR B 32 ? 0.3195 0.4602 0.3397 -0.0598 -0.0397 0.0144 30 TYR B CD1 +695 C CD2 . TYR B 32 ? 0.3315 0.4646 0.3646 -0.0608 -0.0386 0.0302 30 TYR B CD2 +696 C CE1 . TYR B 32 ? 0.3450 0.4848 0.3493 -0.0945 -0.0443 0.0118 30 TYR B CE1 +697 C CE2 . TYR B 32 ? 0.3397 0.4720 0.3588 -0.0935 -0.0427 0.0300 30 TYR B CE2 +698 C CZ . TYR B 32 ? 0.3646 0.4978 0.3668 -0.1131 -0.0453 0.0196 30 TYR B CZ +699 O OH . TYR B 32 ? 0.4223 0.5513 0.4003 -0.1568 -0.0484 0.0168 30 TYR B OH +700 N N . GLN B 33 ? 0.2667 0.4577 0.2936 0.0143 -0.0205 0.0272 31 GLN B N +701 C CA . GLN B 33 ? 0.2993 0.5374 0.3234 0.0221 -0.0210 0.0331 31 GLN B CA +702 C C . GLN B 33 ? 0.3156 0.5263 0.3310 0.0237 -0.0210 0.0227 31 GLN B C +703 O O . GLN B 33 ? 0.2801 0.4413 0.2909 0.0298 -0.0154 0.0156 31 GLN B O +704 C CB . GLN B 33 ? 0.3361 0.5995 0.3519 0.0574 -0.0069 0.0493 31 GLN B CB +705 C CG . GLN B 33 ? 0.4167 0.7457 0.4306 0.0748 -0.0055 0.0634 31 GLN B CG +706 C CD . GLN B 33 ? 0.4976 0.8495 0.4964 0.1226 0.0146 0.0858 31 GLN B CD +707 O OE1 . GLN B 33 ? 0.4980 0.8128 0.4852 0.1355 0.0269 0.0870 31 GLN B OE1 +708 N NE2 . GLN B 33 ? 0.4771 0.8844 0.4693 0.1519 0.0208 0.1042 31 GLN B NE2 +709 N N . ILE B 34 ? 0.3243 0.5720 0.3366 0.0106 -0.0285 0.0206 32 ILE B N +710 C CA . ILE B 34 ? 0.3463 0.5715 0.3476 0.0098 -0.0285 0.0097 32 ILE B CA +711 C C . ILE B 34 ? 0.3508 0.6200 0.3469 0.0367 -0.0224 0.0237 32 ILE B C +712 O O . ILE B 34 ? 0.3566 0.6998 0.3563 0.0403 -0.0254 0.0385 32 ILE B O +713 C CB . ILE B 34 ? 0.3854 0.6029 0.3739 -0.0256 -0.0377 -0.0058 32 ILE B CB +714 C CG1 . ILE B 34 ? 0.4152 0.5619 0.3987 -0.0362 -0.0357 -0.0170 32 ILE B CG1 +715 C CG2 . ILE B 34 ? 0.4121 0.6245 0.3852 -0.0225 -0.0363 -0.0148 32 ILE B CG2 +716 C CD1 . ILE B 34 ? 0.4258 0.5725 0.4154 -0.0526 -0.0391 -0.0114 32 ILE B CD1 +717 N N . ARG B 35 ? 0.3584 0.5852 0.3442 0.0582 -0.0115 0.0230 33 ARG B N +718 C CA . ARG B 35 ? 0.4064 0.6544 0.3784 0.0902 -0.0002 0.0393 33 ARG B CA +719 C C . ARG B 35 ? 0.3952 0.6320 0.3580 0.0851 -0.0019 0.0298 33 ARG B C +720 O O . ARG B 35 ? 0.3822 0.5933 0.3481 0.0609 -0.0095 0.0111 33 ARG B O +721 C CB . ARG B 35 ? 0.4364 0.6273 0.3900 0.1167 0.0195 0.0473 33 ARG B CB +722 C CG . ARG B 35 ? 0.4860 0.6627 0.4427 0.1167 0.0233 0.0493 33 ARG B CG +723 C CD . ARG B 35 ? 0.5130 0.7638 0.4774 0.1341 0.0228 0.0683 33 ARG B CD +724 N NE . ARG B 35 ? 0.6000 0.8518 0.5370 0.1821 0.0458 0.0915 33 ARG B NE +725 C CZ . ARG B 35 ? 0.7088 0.9228 0.6224 0.2069 0.0655 0.0997 33 ARG B CZ +726 N NH1 . ARG B 35 ? 0.7290 0.9087 0.6476 0.1840 0.0623 0.0858 33 ARG B NH1 +727 N NH2 . ARG B 35 ? 0.8086 1.0168 0.6873 0.2593 0.0918 0.1240 33 ARG B NH2 +728 N N . LYS B 36 ? 0.4050 0.6563 0.3523 0.1126 0.0084 0.0450 34 LYS B N +729 C CA . LYS B 36 ? 0.4380 0.6752 0.3737 0.1113 0.0098 0.0383 34 LYS B CA +730 C C . LYS B 36 ? 0.4796 0.6648 0.3912 0.1386 0.0305 0.0505 34 LYS B C +731 O O . LYS B 36 ? 0.5216 0.7052 0.4153 0.1701 0.0455 0.0717 34 LYS B O +732 C CB . LYS B 36 ? 0.4229 0.7375 0.3559 0.1093 0.0006 0.0449 34 LYS B CB +733 C CG . LYS B 36 ? 0.4058 0.7520 0.3459 0.0678 -0.0176 0.0259 34 LYS B CG +734 C CD . LYS B 36 ? 0.4285 0.8468 0.3562 0.0553 -0.0264 0.0272 34 LYS B CD +735 C CE . LYS B 36 ? 0.4345 0.8115 0.3448 0.0505 -0.0232 0.0109 34 LYS B CE +736 N NZ . LYS B 36 ? 0.4330 0.8826 0.3261 0.0271 -0.0341 0.0073 34 LYS B NZ +737 N N . GLU B 37 ? 0.4904 0.6367 0.3950 0.1278 0.0336 0.0393 35 GLU B N +738 C CA . GLU B 37 ? 0.5134 0.6176 0.3871 0.1455 0.0529 0.0510 35 GLU B CA +739 C C . GLU B 37 ? 0.4760 0.6107 0.3476 0.1443 0.0483 0.0492 35 GLU B C +740 O O . GLU B 37 ? 0.4485 0.5823 0.3328 0.1216 0.0393 0.0299 35 GLU B O +741 C CB . GLU B 37 ? 0.5548 0.5959 0.4208 0.1254 0.0608 0.0398 35 GLU B CB +742 C CG . GLU B 37 ? 0.6320 0.6061 0.4537 0.1378 0.0857 0.0529 35 GLU B CG +743 C CD . GLU B 37 ? 0.6868 0.6106 0.4992 0.1079 0.0908 0.0404 35 GLU B CD +744 O OE1 . GLU B 37 ? 0.6414 0.5303 0.4370 0.1089 0.0993 0.0412 35 GLU B OE1 +745 O OE2 . GLU B 37 ? 0.6877 0.6143 0.5071 0.0833 0.0871 0.0309 35 GLU B OE2 +746 N N . GLY B 38 ? 0.4548 0.6207 0.3079 0.1723 0.0558 0.0708 36 GLY B N +747 C CA . GLY B 38 ? 0.4621 0.6697 0.3131 0.1691 0.0492 0.0691 36 GLY B CA +748 C C . GLY B 38 ? 0.4126 0.6754 0.2871 0.1413 0.0266 0.0495 36 GLY B C +749 O O . GLY B 38 ? 0.4261 0.7408 0.3115 0.1407 0.0174 0.0560 36 GLY B O +750 N N . ASN B 39 ? 0.3861 0.6432 0.2603 0.1191 0.0200 0.0282 37 ASN B N +751 C CA . ASN B 39 ? 0.3577 0.6412 0.2363 0.0883 0.0039 0.0057 37 ASN B CA +752 C C . ASN B 39 ? 0.3416 0.5702 0.2318 0.0692 0.0016 -0.0155 37 ASN B C +753 O O . ASN B 39 ? 0.3360 0.5614 0.2175 0.0442 -0.0061 -0.0354 37 ASN B O +754 C CB . ASN B 39 ? 0.3769 0.6792 0.2346 0.0769 0.0017 -0.0071 37 ASN B CB +755 C CG . ASN B 39 ? 0.3954 0.7248 0.2391 0.0398 -0.0121 -0.0291 37 ASN B CG +756 O OD1 . ASN B 39 ? 0.3632 0.7390 0.2130 0.0237 -0.0231 -0.0245 37 ASN B OD1 +757 N ND2 . ASN B 39 ? 0.4237 0.7214 0.2434 0.0232 -0.0097 -0.0533 37 ASN B ND2 +758 N N . CYS B 40 ? 0.3200 0.5040 0.2223 0.0799 0.0103 -0.0103 38 CYS B N +759 C CA . CYS B 40 ? 0.3203 0.4655 0.2359 0.0689 0.0093 -0.0226 38 CYS B CA +760 C C . CYS B 40 ? 0.3171 0.4642 0.2471 0.0633 0.0032 -0.0184 38 CYS B C +761 O O . CYS B 40 ? 0.2795 0.4359 0.2113 0.0775 0.0076 -0.0018 38 CYS B O +762 C CB . CYS B 40 ? 0.3134 0.4272 0.2328 0.0769 0.0212 -0.0173 38 CYS B CB +763 S SG . CYS B 40 ? 0.3380 0.4545 0.2437 0.0819 0.0304 -0.0198 38 CYS B SG +764 N N . TYR B 41 ? 0.3358 0.4674 0.2696 0.0454 -0.0035 -0.0321 39 TYR B N +765 C CA . TYR B 41 ? 0.3233 0.4559 0.2702 0.0373 -0.0091 -0.0284 39 TYR B CA +766 C C . TYR B 41 ? 0.3086 0.4105 0.2696 0.0468 -0.0025 -0.0229 39 TYR B C +767 O O . TYR B 41 ? 0.2658 0.3462 0.2278 0.0504 0.0031 -0.0271 39 TYR B O +768 C CB . TYR B 41 ? 0.3671 0.4866 0.3040 0.0106 -0.0165 -0.0431 39 TYR B CB +769 C CG . TYR B 41 ? 0.3884 0.5510 0.3077 -0.0094 -0.0243 -0.0473 39 TYR B CG +770 C CD1 . TYR B 41 ? 0.4252 0.5810 0.3181 -0.0176 -0.0224 -0.0613 39 TYR B CD1 +771 C CD2 . TYR B 41 ? 0.4036 0.6290 0.3321 -0.0180 -0.0328 -0.0344 39 TYR B CD2 +772 C CE1 . TYR B 41 ? 0.4625 0.6721 0.3355 -0.0415 -0.0308 -0.0649 39 TYR B CE1 +773 C CE2 . TYR B 41 ? 0.4308 0.7217 0.3440 -0.0400 -0.0416 -0.0347 39 TYR B CE2 +774 C CZ . TYR B 41 ? 0.4759 0.7586 0.3605 -0.0543 -0.0413 -0.0507 39 TYR B CZ +775 O OH . TYR B 41 ? 0.4927 0.8518 0.3593 -0.0812 -0.0512 -0.0507 39 TYR B OH +776 N N . VAL B 42 ? 0.2897 0.3990 0.2595 0.0483 -0.0035 -0.0134 40 VAL B N +777 C CA . VAL B 42 ? 0.2953 0.3812 0.2705 0.0521 0.0029 -0.0078 40 VAL B CA +778 C C . VAL B 42 ? 0.2715 0.3616 0.2593 0.0426 -0.0038 -0.0067 40 VAL B C +779 O O . VAL B 42 ? 0.2534 0.3710 0.2430 0.0401 -0.0091 -0.0027 40 VAL B O +780 C CB . VAL B 42 ? 0.3009 0.3777 0.2580 0.0683 0.0158 0.0048 40 VAL B CB +781 C CG1 . VAL B 42 ? 0.3030 0.3466 0.2517 0.0630 0.0244 0.0064 40 VAL B CG1 +782 C CG2 . VAL B 42 ? 0.3172 0.3840 0.2567 0.0764 0.0248 0.0067 40 VAL B CG2 +783 N N . CYS B 43 ? 0.2525 0.3244 0.2495 0.0358 -0.0044 -0.0093 41 CYS B N +784 C CA . CYS B 43 ? 0.2607 0.3342 0.2675 0.0280 -0.0091 -0.0058 41 CYS B CA +785 C C . CYS B 43 ? 0.2687 0.3375 0.2690 0.0318 -0.0014 0.0005 41 CYS B C +786 O O . CYS B 43 ? 0.2242 0.2793 0.2177 0.0279 0.0047 -0.0004 41 CYS B O +787 C CB . CYS B 43 ? 0.2933 0.3522 0.3082 0.0243 -0.0108 -0.0072 41 CYS B CB +788 S SG . CYS B 43 ? 0.2626 0.3248 0.2876 0.0157 -0.0155 0.0007 41 CYS B SG +789 N N . GLU B 44 ? 0.2460 0.3273 0.2429 0.0373 0.0000 0.0071 42 GLU B N +790 C CA . GLU B 44 ? 0.2918 0.3553 0.2715 0.0427 0.0111 0.0115 42 GLU B CA +791 C C . GLU B 44 ? 0.2793 0.3538 0.2710 0.0322 0.0052 0.0134 42 GLU B C +792 O O . GLU B 44 ? 0.2380 0.3421 0.2440 0.0308 -0.0025 0.0181 42 GLU B O +793 C CB . GLU B 44 ? 0.3056 0.3753 0.2662 0.0679 0.0228 0.0221 42 GLU B CB +794 C CG . GLU B 44 ? 0.3652 0.4024 0.2962 0.0785 0.0398 0.0264 42 GLU B CG +795 C CD . GLU B 44 ? 0.4161 0.4651 0.3265 0.1161 0.0553 0.0430 42 GLU B CD +796 O OE1 . GLU B 44 ? 0.4182 0.5030 0.3352 0.1291 0.0564 0.0529 42 GLU B OE1 +797 O OE2 . GLU B 44 ? 0.4217 0.4451 0.3070 0.1344 0.0683 0.0483 42 GLU B OE2 +798 N N . ILE B 45 ? 0.2951 0.3512 0.2781 0.0208 0.0090 0.0106 43 ILE B N +799 C CA . ILE B 45 ? 0.3040 0.3732 0.2970 0.0095 0.0034 0.0134 43 ILE B CA +800 C C . ILE B 45 ? 0.3169 0.3611 0.2761 0.0120 0.0186 0.0126 43 ILE B C +801 O O . ILE B 45 ? 0.3512 0.3593 0.2789 0.0061 0.0309 0.0064 43 ILE B O +802 C CB . ILE B 45 ? 0.3261 0.4054 0.3320 -0.0059 -0.0036 0.0131 43 ILE B CB +803 C CG1 . ILE B 45 ? 0.3005 0.3872 0.3271 0.0006 -0.0115 0.0146 43 ILE B CG1 +804 C CG2 . ILE B 45 ? 0.3207 0.4167 0.3312 -0.0162 -0.0076 0.0189 43 ILE B CG2 +805 C CD1 . ILE B 45 ? 0.2974 0.3850 0.3336 0.0018 -0.0181 0.0177 43 ILE B CD1 +806 N N . ARG B 46 ? 0.3186 0.3775 0.2782 0.0195 0.0202 0.0186 44 ARG B N +807 C CA . ARG B 46 ? 0.3484 0.3781 0.2694 0.0256 0.0381 0.0175 44 ARG B CA +808 C C . ARG B 46 ? 0.3371 0.3865 0.2651 0.0100 0.0321 0.0185 44 ARG B C +809 O O . ARG B 46 ? 0.2728 0.3635 0.2280 0.0135 0.0226 0.0279 44 ARG B O +810 C CB . ARG B 46 ? 0.3868 0.4203 0.2924 0.0607 0.0528 0.0280 44 ARG B CB +811 C CG . ARG B 46 ? 0.3988 0.4156 0.2911 0.0826 0.0620 0.0316 44 ARG B CG +812 C CD . ARG B 46 ? 0.4662 0.4889 0.3339 0.1269 0.0826 0.0478 44 ARG B CD +813 N NE . ARG B 46 ? 0.5163 0.5093 0.3589 0.1512 0.0965 0.0536 44 ARG B NE +814 C CZ . ARG B 46 ? 0.5594 0.5603 0.3785 0.1989 0.1166 0.0733 44 ARG B CZ +815 N NH1 . ARG B 46 ? 0.5739 0.6174 0.3918 0.2303 0.1265 0.0898 44 ARG B NH1 +816 N NH2 . ARG B 46 ? 0.5725 0.5467 0.3697 0.2186 0.1277 0.0801 44 ARG B NH2 +817 N N . CYS B 47 ? 0.3629 0.3855 0.2627 -0.0126 0.0376 0.0090 45 CYS B N +818 C CA . CYS B 47 ? 0.3611 0.4067 0.2632 -0.0328 0.0313 0.0095 45 CYS B CA +819 C C . CYS B 47 ? 0.4216 0.4192 0.2644 -0.0311 0.0548 0.0011 45 CYS B C +820 O O . CYS B 47 ? 0.4674 0.4006 0.2568 -0.0218 0.0781 -0.0070 45 CYS B O +821 C CB . CYS B 47 ? 0.3504 0.4170 0.2594 -0.0644 0.0204 0.0064 45 CYS B CB +822 S SG . CYS B 47 ? 0.2950 0.4089 0.2614 -0.0572 0.0000 0.0188 45 CYS B SG +823 O OXT . CYS B 47 ? 0.4395 0.4594 0.2833 -0.0396 0.0518 0.0032 45 CYS B OXT +824 N N . GLY C 1 ? 0.9419 1.5434 0.6585 -0.4758 -0.0703 -0.2515 -1 GLY C N +825 C CA . GLY C 1 ? 0.8601 1.4062 0.6146 -0.3946 -0.0707 -0.1991 -1 GLY C CA +826 C C . GLY C 1 ? 0.7744 1.3879 0.5896 -0.3549 -0.0952 -0.1351 -1 GLY C C +827 O O . GLY C 1 ? 0.7466 1.4896 0.5783 -0.3711 -0.1221 -0.1061 -1 GLY C O +828 N N . SER C 2 ? 0.7454 1.2756 0.5948 -0.3020 -0.0832 -0.1110 0 SER C N +829 C CA . SER C 2 ? 0.6903 1.2644 0.5961 -0.2616 -0.0957 -0.0556 0 SER C CA +830 C C . SER C 2 ? 0.6391 1.1196 0.5738 -0.2349 -0.0775 -0.0530 0 SER C C +831 O O . SER C 2 ? 0.6845 1.0616 0.6003 -0.2295 -0.0568 -0.0800 0 SER C O +832 C CB . SER C 2 ? 0.6365 1.2389 0.5557 -0.2115 -0.1024 -0.0098 0 SER C CB +833 O OG . SER C 2 ? 0.5840 1.2034 0.5579 -0.1726 -0.1019 0.0360 0 SER C OG +834 N N . GLU C 3 ? 0.5762 1.1007 0.5576 -0.2159 -0.0833 -0.0158 1 GLU C N +835 C CA . GLU C 3 ? 0.5322 0.9817 0.5376 -0.1847 -0.0664 -0.0062 1 GLU C CA +836 C C . GLU C 3 ? 0.4430 0.8488 0.4573 -0.1319 -0.0583 0.0177 1 GLU C C +837 O O . GLU C 3 ? 0.3801 0.7137 0.3957 -0.1137 -0.0437 0.0132 1 GLU C O +838 C CB . GLU C 3 ? 0.5573 1.0629 0.6059 -0.1915 -0.0684 0.0158 1 GLU C CB +839 C CG . GLU C 3 ? 0.6420 1.1718 0.6827 -0.2492 -0.0709 -0.0154 1 GLU C CG +840 C CD . GLU C 3 ? 0.7146 1.1341 0.7378 -0.2621 -0.0466 -0.0490 1 GLU C CD +841 O OE1 . GLU C 3 ? 0.7814 1.1947 0.8326 -0.2640 -0.0371 -0.0390 1 GLU C OE1 +842 O OE2 . GLU C 3 ? 0.7577 1.1016 0.7438 -0.2680 -0.0341 -0.0801 1 GLU C OE2 +843 N N . GLU C 4 ? 0.3728 0.8227 0.3911 -0.1112 -0.0656 0.0421 2 GLU C N +844 C CA . GLU C 4 ? 0.3360 0.7340 0.3563 -0.0712 -0.0538 0.0543 2 GLU C CA +845 C C . GLU C 4 ? 0.3429 0.7335 0.3273 -0.0767 -0.0587 0.0396 2 GLU C C +846 O O . GLU C 4 ? 0.2925 0.7555 0.2641 -0.0956 -0.0725 0.0445 2 GLU C O +847 C CB . GLU C 4 ? 0.3247 0.7609 0.3893 -0.0348 -0.0453 0.0998 2 GLU C CB +848 C CG . GLU C 4 ? 0.3285 0.7609 0.4316 -0.0221 -0.0305 0.1150 2 GLU C CG +849 C CD . GLU C 4 ? 0.3421 0.7954 0.4964 0.0183 -0.0075 0.1595 2 GLU C CD +850 O OE1 . GLU C 4 ? 0.3450 0.8123 0.5114 0.0417 -0.0006 0.1853 2 GLU C OE1 +851 O OE2 . GLU C 4 ? 0.3413 0.7985 0.5287 0.0274 0.0088 0.1719 2 GLU C OE2 +852 N N . ARG C 5 ? 0.3251 0.6364 0.2918 -0.0642 -0.0474 0.0208 3 ARG C N +853 C CA . ARG C 5 ? 0.3761 0.6669 0.3127 -0.0635 -0.0456 0.0069 3 ARG C CA +854 C C . ARG C 5 ? 0.3217 0.5689 0.2694 -0.0312 -0.0348 0.0182 3 ARG C C +855 O O . ARG C 5 ? 0.2647 0.4668 0.2254 -0.0190 -0.0266 0.0162 3 ARG C O +856 C CB . ARG C 5 ? 0.4632 0.6969 0.3672 -0.0872 -0.0370 -0.0335 3 ARG C CB +857 C CG . ARG C 5 ? 0.5560 0.8235 0.4399 -0.1325 -0.0416 -0.0589 3 ARG C CG +858 C CD . ARG C 5 ? 0.6460 0.8344 0.5160 -0.1501 -0.0212 -0.0933 3 ARG C CD +859 N NE . ARG C 5 ? 0.7716 0.9691 0.6552 -0.1769 -0.0211 -0.1005 3 ARG C NE +860 C CZ . ARG C 5 ? 0.7283 0.9052 0.6408 -0.1605 -0.0186 -0.0821 3 ARG C CZ +861 N NH1 . ARG C 5 ? 0.7774 0.9640 0.7006 -0.1898 -0.0154 -0.0910 3 ARG C NH1 +862 N NH2 . ARG C 5 ? 0.6643 0.8175 0.5931 -0.1210 -0.0182 -0.0577 3 ARG C NH2 +863 N N . ARG C 6 ? 0.2846 0.5502 0.2264 -0.0201 -0.0338 0.0301 4 ARG C N +864 C CA . ARG C 6 ? 0.2819 0.5051 0.2338 0.0044 -0.0212 0.0362 4 ARG C CA +865 C C . ARG C 6 ? 0.2914 0.4939 0.2162 0.0013 -0.0174 0.0195 4 ARG C C +866 O O . ARG C 6 ? 0.2730 0.5122 0.1725 -0.0123 -0.0220 0.0159 4 ARG C O +867 C CB . ARG C 6 ? 0.2942 0.5511 0.2747 0.0274 -0.0134 0.0737 4 ARG C CB +868 C CG . ARG C 6 ? 0.2946 0.5547 0.3139 0.0422 -0.0029 0.0952 4 ARG C CG +869 C CD . ARG C 6 ? 0.2913 0.5746 0.3460 0.0686 0.0151 0.1364 4 ARG C CD +870 N NE . ARG C 6 ? 0.2740 0.5563 0.3676 0.0822 0.0317 0.1545 4 ARG C NE +871 C CZ . ARG C 6 ? 0.2865 0.5921 0.4243 0.1087 0.0547 0.1979 4 ARG C CZ +872 N NH1 . ARG C 6 ? 0.2925 0.6243 0.4409 0.1252 0.0626 0.2308 4 ARG C NH1 +873 N NH2 . ARG C 6 ? 0.2895 0.5881 0.4628 0.1206 0.0747 0.2101 4 ARG C NH2 +874 N N . TYR C 7 ? 0.2842 0.4367 0.2147 0.0127 -0.0081 0.0108 5 TYR C N +875 C CA . TYR C 7 ? 0.3262 0.4522 0.2383 0.0131 0.0002 -0.0049 5 TYR C CA +876 C C . TYR C 7 ? 0.2942 0.4111 0.2289 0.0321 0.0086 0.0096 5 TYR C C +877 O O . TYR C 7 ? 0.2892 0.3856 0.2429 0.0369 0.0103 0.0091 5 TYR C O +878 C CB . TYR C 7 ? 0.3566 0.4367 0.2641 0.0085 0.0058 -0.0248 5 TYR C CB +879 C CG . TYR C 7 ? 0.3886 0.4639 0.2803 -0.0125 0.0045 -0.0414 5 TYR C CG +880 C CD1 . TYR C 7 ? 0.4752 0.5501 0.3364 -0.0339 0.0126 -0.0646 5 TYR C CD1 +881 C CD2 . TYR C 7 ? 0.3978 0.4646 0.3026 -0.0156 0.0000 -0.0384 5 TYR C CD2 +882 C CE1 . TYR C 7 ? 0.4977 0.5664 0.3444 -0.0623 0.0152 -0.0863 5 TYR C CE1 +883 C CE2 . TYR C 7 ? 0.4355 0.4990 0.3299 -0.0388 0.0009 -0.0533 5 TYR C CE2 +884 C CZ . TYR C 7 ? 0.4773 0.5406 0.3449 -0.0635 0.0086 -0.0779 5 TYR C CZ +885 O OH . TYR C 7 ? 0.5260 0.5809 0.3843 -0.0931 0.0140 -0.0984 5 TYR C OH +886 N N . LYS C 8 ? 0.2943 0.4318 0.2258 0.0385 0.0147 0.0220 6 LYS C N +887 C CA . LYS C 8 ? 0.3035 0.4305 0.2581 0.0519 0.0271 0.0338 6 LYS C CA +888 C C . LYS C 8 ? 0.2962 0.4013 0.2464 0.0534 0.0342 0.0192 6 LYS C C +889 O O . LYS C 8 ? 0.2961 0.3998 0.2200 0.0492 0.0382 0.0071 6 LYS C O +890 C CB . LYS C 8 ? 0.3359 0.4954 0.2950 0.0614 0.0353 0.0612 6 LYS C CB +891 C CG . LYS C 8 ? 0.3269 0.4706 0.3189 0.0729 0.0541 0.0764 6 LYS C CG +892 C CD . LYS C 8 ? 0.3603 0.5339 0.3585 0.0857 0.0677 0.1102 6 LYS C CD +893 C CE . LYS C 8 ? 0.4110 0.6189 0.3689 0.0821 0.0629 0.1098 6 LYS C CE +894 N NZ . LYS C 8 ? 0.3955 0.6515 0.3567 0.0952 0.0722 0.1529 6 LYS C NZ +895 N N . ARG C 9 ? 0.2919 0.3835 0.2683 0.0566 0.0374 0.0188 7 ARG C N +896 C CA . ARG C 9 ? 0.3055 0.3889 0.2884 0.0607 0.0423 0.0123 7 ARG C CA +897 C C . ARG C 9 ? 0.2821 0.3770 0.2922 0.0644 0.0522 0.0213 7 ARG C C +898 O O . ARG C 9 ? 0.2488 0.3530 0.2823 0.0599 0.0486 0.0210 7 ARG C O +899 C CB . ARG C 9 ? 0.3309 0.4065 0.3210 0.0579 0.0328 0.0071 7 ARG C CB +900 C CG . ARG C 9 ? 0.3896 0.4482 0.3572 0.0533 0.0284 -0.0020 7 ARG C CG +901 C CD . ARG C 9 ? 0.4571 0.4935 0.4132 0.0585 0.0434 -0.0099 7 ARG C CD +902 N NE . ARG C 9 ? 0.5345 0.5664 0.4582 0.0469 0.0482 -0.0250 7 ARG C NE +903 C CZ . ARG C 9 ? 0.6258 0.6419 0.5267 0.0313 0.0496 -0.0421 7 ARG C CZ +904 N NH1 . ARG C 9 ? 0.6588 0.6884 0.5258 0.0134 0.0524 -0.0583 7 ARG C NH1 +905 N NH2 . ARG C 9 ? 0.6344 0.6286 0.5442 0.0295 0.0487 -0.0429 7 ARG C NH2 +906 N N . CYS C 10 ? 0.2745 0.3767 0.2810 0.0694 0.0644 0.0308 8 CYS C N +907 C CA . CYS C 10 ? 0.2786 0.3903 0.3127 0.0706 0.0774 0.0409 8 CYS C CA +908 C C . CYS C 10 ? 0.2720 0.3937 0.3235 0.0752 0.0820 0.0389 8 CYS C C +909 O O . CYS C 10 ? 0.2765 0.4158 0.3606 0.0702 0.0876 0.0446 8 CYS C O +910 C CB . CYS C 10 ? 0.2973 0.4183 0.3217 0.0783 0.0927 0.0583 8 CYS C CB +911 S SG . CYS C 10 ? 0.3053 0.4315 0.3287 0.0808 0.0936 0.0794 8 CYS C SG +912 N N . GLY C 11 ? 0.2872 0.3988 0.3207 0.0841 0.0838 0.0322 9 GLY C N +913 C CA . GLY C 11 ? 0.3174 0.4390 0.3758 0.0962 0.0946 0.0383 9 GLY C CA +914 C C . GLY C 11 ? 0.3024 0.4421 0.3871 0.0956 0.0801 0.0449 9 GLY C C +915 O O . GLY C 11 ? 0.2989 0.4534 0.4086 0.1104 0.0890 0.0584 9 GLY C O +916 N N . GLN C 12 ? 0.2935 0.4391 0.3754 0.0796 0.0609 0.0395 10 GLN C N +917 C CA . GLN C 12 ? 0.3087 0.4844 0.4087 0.0741 0.0454 0.0464 10 GLN C CA +918 C C . GLN C 12 ? 0.3109 0.5117 0.4203 0.0476 0.0337 0.0374 10 GLN C C +919 O O . GLN C 12 ? 0.2935 0.4690 0.3913 0.0368 0.0388 0.0248 10 GLN C O +920 C CB . GLN C 12 ? 0.3166 0.4634 0.3896 0.0761 0.0378 0.0405 10 GLN C CB +921 C CG . GLN C 12 ? 0.3413 0.4503 0.3989 0.0929 0.0547 0.0393 10 GLN C CG +922 C CD . GLN C 12 ? 0.3447 0.4266 0.3829 0.0912 0.0504 0.0342 10 GLN C CD +923 O OE1 . GLN C 12 ? 0.3387 0.4276 0.3680 0.0781 0.0333 0.0302 10 GLN C OE1 +924 N NE2 . GLN C 12 ? 0.3618 0.4070 0.3920 0.1020 0.0713 0.0310 10 GLN C NE2 +925 N N . ASP C 13 ? 0.3150 0.5686 0.4455 0.0362 0.0207 0.0450 11 ASP C N +926 C CA . ASP C 13 ? 0.3172 0.5939 0.4479 0.0022 0.0123 0.0270 11 ASP C CA +927 C C . ASP C 13 ? 0.3225 0.5756 0.4210 -0.0078 0.0035 0.0122 11 ASP C C +928 O O . ASP C 13 ? 0.2841 0.5159 0.3645 0.0104 -0.0013 0.0206 11 ASP C O +929 C CB . ASP C 13 ? 0.3282 0.6887 0.4906 -0.0168 0.0003 0.0367 11 ASP C CB +930 C CG . ASP C 13 ? 0.3791 0.7939 0.5460 -0.0049 -0.0178 0.0635 11 ASP C CG +931 O OD1 . ASP C 13 ? 0.3648 0.8633 0.5650 -0.0115 -0.0279 0.0845 11 ASP C OD1 +932 O OD2 . ASP C 13 ? 0.3788 0.7616 0.5207 0.0099 -0.0212 0.0675 11 ASP C OD2 +933 N N . GLU C 14 ? 0.3339 0.5893 0.4279 -0.0394 0.0066 -0.0116 12 GLU C N +934 C CA . GLU C 14 ? 0.3730 0.6046 0.4394 -0.0511 0.0056 -0.0285 12 GLU C CA +935 C C . GLU C 14 ? 0.3497 0.6216 0.4021 -0.0472 -0.0153 -0.0143 12 GLU C C +936 O O . GLU C 14 ? 0.3278 0.5701 0.3585 -0.0368 -0.0168 -0.0135 12 GLU C O +937 C CB . GLU C 14 ? 0.4131 0.6472 0.4796 -0.0922 0.0191 -0.0609 12 GLU C CB +938 C CG . GLU C 14 ? 0.4734 0.6791 0.5120 -0.1058 0.0262 -0.0822 12 GLU C CG +939 C CD . GLU C 14 ? 0.5233 0.7227 0.5591 -0.1507 0.0486 -0.1215 12 GLU C CD +940 O OE1 . GLU C 14 ? 0.5758 0.8017 0.6314 -0.1773 0.0544 -0.1336 12 GLU C OE1 +941 O OE2 . GLU C 14 ? 0.5498 0.7178 0.5640 -0.1619 0.0634 -0.1423 12 GLU C OE2 +942 N N . GLU C 15 ? 0.3580 0.7054 0.4268 -0.0563 -0.0304 0.0009 13 GLU C N +943 C CA . GLU C 15 ? 0.3980 0.7970 0.4565 -0.0534 -0.0486 0.0223 13 GLU C CA +944 C C . GLU C 15 ? 0.3596 0.7120 0.4160 -0.0122 -0.0442 0.0476 13 GLU C C +945 O O . GLU C 15 ? 0.3462 0.6841 0.3806 -0.0092 -0.0472 0.0503 13 GLU C O +946 C CB . GLU C 15 ? 0.4691 0.9702 0.5557 -0.0616 -0.0651 0.0482 13 GLU C CB +947 C CG . GLU C 15 ? 0.5585 1.1381 0.6361 -0.0633 -0.0853 0.0775 13 GLU C CG +948 C CD . GLU C 15 ? 0.6105 1.1818 0.7070 -0.0128 -0.0822 0.1287 13 GLU C CD +949 O OE1 . GLU C 15 ? 0.6765 1.2763 0.7565 -0.0086 -0.0909 0.1507 13 GLU C OE1 +950 O OE2 . GLU C 15 ? 0.6188 1.1532 0.7460 0.0205 -0.0666 0.1458 13 GLU C OE2 +951 N N . ARG C 16 ? 0.2940 0.6188 0.3719 0.0146 -0.0326 0.0610 14 ARG C N +952 C CA . ARG C 16 ? 0.2898 0.5724 0.3684 0.0473 -0.0220 0.0803 14 ARG C CA +953 C C . ARG C 16 ? 0.2746 0.4888 0.3220 0.0453 -0.0157 0.0572 14 ARG C C +954 O O . ARG C 16 ? 0.3001 0.4880 0.3381 0.0568 -0.0117 0.0656 14 ARG C O +955 C CB . ARG C 16 ? 0.3001 0.5673 0.4041 0.0702 -0.0047 0.0907 14 ARG C CB +956 C CG . ARG C 16 ? 0.3402 0.5578 0.4458 0.0998 0.0158 0.1049 14 ARG C CG +957 C CD . ARG C 16 ? 0.4040 0.6147 0.5366 0.1222 0.0384 0.1168 14 ARG C CD +958 N NE . ARG C 16 ? 0.4829 0.6272 0.6073 0.1417 0.0665 0.1152 14 ARG C NE +959 C CZ . ARG C 16 ? 0.5789 0.6847 0.7073 0.1563 0.0963 0.1085 14 ARG C CZ +960 N NH1 . ARG C 16 ? 0.5993 0.7297 0.7429 0.1585 0.1007 0.1084 14 ARG C NH1 +961 N NH2 . ARG C 16 ? 0.6495 0.6900 0.7670 0.1667 0.1271 0.1003 14 ARG C NH2 +962 N N . VAL C 17 ? 0.2520 0.4406 0.2899 0.0324 -0.0117 0.0325 15 VAL C N +963 C CA . VAL C 17 ? 0.2648 0.4038 0.2807 0.0324 -0.0061 0.0172 15 VAL C CA +964 C C . VAL C 17 ? 0.2780 0.4186 0.2767 0.0209 -0.0133 0.0125 15 VAL C C +965 O O . VAL C 17 ? 0.2665 0.3799 0.2532 0.0273 -0.0115 0.0139 15 VAL C O +966 C CB . VAL C 17 ? 0.2470 0.3699 0.2647 0.0247 0.0027 0.0029 15 VAL C CB +967 C CG1 . VAL C 17 ? 0.2579 0.3505 0.2598 0.0265 0.0064 -0.0028 15 VAL C CG1 +968 C CG2 . VAL C 17 ? 0.2536 0.3741 0.2826 0.0372 0.0117 0.0096 15 VAL C CG2 +969 N N . ARG C 18 ? 0.2928 0.4677 0.2897 0.0004 -0.0192 0.0046 16 ARG C N +970 C CA . ARG C 18 ? 0.3341 0.5151 0.3104 -0.0143 -0.0221 -0.0037 16 ARG C CA +971 C C . ARG C 18 ? 0.3184 0.5165 0.2893 -0.0023 -0.0304 0.0208 16 ARG C C +972 O O . ARG C 18 ? 0.3483 0.5231 0.3055 0.0000 -0.0275 0.0212 16 ARG C O +973 C CB . ARG C 18 ? 0.3628 0.5857 0.3326 -0.0465 -0.0239 -0.0227 16 ARG C CB +974 C CG . ARG C 18 ? 0.4058 0.5919 0.3783 -0.0628 -0.0036 -0.0524 16 ARG C CG +975 C CD . ARG C 18 ? 0.4622 0.6839 0.4275 -0.1024 0.0006 -0.0792 16 ARG C CD +976 N NE . ARG C 18 ? 0.4915 0.6658 0.4675 -0.1163 0.0297 -0.1058 16 ARG C NE +977 C CZ . ARG C 18 ? 0.5181 0.6368 0.4909 -0.1129 0.0557 -0.1188 16 ARG C CZ +978 N NH1 . ARG C 18 ? 0.5181 0.6239 0.4736 -0.1012 0.0549 -0.1134 16 ARG C NH1 +979 N NH2 . ARG C 18 ? 0.5515 0.6275 0.5441 -0.1215 0.0883 -0.1352 16 ARG C NH2 +980 N N . ARG C 19 ? 0.3264 0.5709 0.3134 0.0058 -0.0384 0.0459 17 ARG C N +981 C CA . ARG C 19 ? 0.3209 0.5829 0.3142 0.0252 -0.0399 0.0817 17 ARG C CA +982 C C . ARG C 19 ? 0.3144 0.5078 0.3113 0.0469 -0.0233 0.0866 17 ARG C C +983 O O . ARG C 19 ? 0.3152 0.4948 0.3041 0.0508 -0.0190 0.0982 17 ARG C O +984 C CB . ARG C 19 ? 0.3561 0.6771 0.3810 0.0394 -0.0445 0.1154 17 ARG C CB +985 C CG . ARG C 19 ? 0.3831 0.7491 0.4187 0.0569 -0.0467 0.1622 17 ARG C CG +986 C CD . ARG C 19 ? 0.4090 0.8299 0.4892 0.0830 -0.0441 0.2083 17 ARG C CD +987 N NE . ARG C 19 ? 0.4241 0.7761 0.5289 0.1102 -0.0186 0.2081 17 ARG C NE +988 C CZ . ARG C 19 ? 0.4164 0.7805 0.5469 0.1169 -0.0139 0.2072 17 ARG C CZ +989 N NH1 . ARG C 19 ? 0.3962 0.8397 0.5375 0.0971 -0.0340 0.2063 17 ARG C NH1 +990 N NH2 . ARG C 19 ? 0.4588 0.7541 0.6038 0.1409 0.0148 0.2048 17 ARG C NH2 +991 N N . GLU C 20 ? 0.2914 0.4465 0.2996 0.0579 -0.0118 0.0777 18 GLU C N +992 C CA . GLU C 20 ? 0.3078 0.4052 0.3148 0.0696 0.0061 0.0762 18 GLU C CA +993 C C . GLU C 20 ? 0.2964 0.3612 0.2786 0.0519 0.0039 0.0498 18 GLU C C +994 O O . GLU C 20 ? 0.3259 0.3563 0.3036 0.0517 0.0151 0.0495 18 GLU C O +995 C CB . GLU C 20 ? 0.3394 0.4092 0.3560 0.0802 0.0212 0.0684 18 GLU C CB +996 C CG . GLU C 20 ? 0.3610 0.4537 0.4112 0.1043 0.0332 0.0995 18 GLU C CG +997 C CD . GLU C 20 ? 0.4071 0.4645 0.4637 0.1149 0.0555 0.0882 18 GLU C CD +998 O OE1 . GLU C 20 ? 0.4427 0.5210 0.5321 0.1367 0.0687 0.1139 18 GLU C OE1 +999 O OE2 . GLU C 20 ? 0.4123 0.4296 0.4421 0.1014 0.0608 0.0564 18 GLU C OE2 +1000 N N . CYS C 21 ? 0.2721 0.3509 0.2443 0.0374 -0.0066 0.0317 19 CYS C N +1001 C CA . CYS C 21 ? 0.2773 0.3381 0.2359 0.0252 -0.0069 0.0153 19 CYS C CA +1002 C C . CYS C 21 ? 0.2946 0.3615 0.2455 0.0198 -0.0080 0.0233 19 CYS C C +1003 O O . CYS C 21 ? 0.3203 0.3672 0.2676 0.0158 -0.0030 0.0216 19 CYS C O +1004 C CB . CYS C 21 ? 0.2644 0.3356 0.2234 0.0170 -0.0088 0.0016 19 CYS C CB +1005 S SG . CYS C 21 ? 0.2702 0.3311 0.2291 0.0124 -0.0041 -0.0062 19 CYS C SG +1006 N N . LYS C 22 ? 0.2976 0.3996 0.2446 0.0163 -0.0144 0.0320 20 LYS C N +1007 C CA . LYS C 22 ? 0.3277 0.4470 0.2630 0.0119 -0.0151 0.0454 20 LYS C CA +1008 C C . LYS C 22 ? 0.3581 0.4588 0.3028 0.0263 -0.0062 0.0710 20 LYS C C +1009 O O . LYS C 22 ? 0.3901 0.4765 0.3284 0.0219 0.0005 0.0754 20 LYS C O +1010 C CB . LYS C 22 ? 0.3584 0.5366 0.2847 0.0029 -0.0257 0.0535 20 LYS C CB +1011 C CG . LYS C 22 ? 0.4000 0.6126 0.3082 -0.0026 -0.0278 0.0716 20 LYS C CG +1012 C CD . LYS C 22 ? 0.4391 0.7225 0.3314 -0.0226 -0.0407 0.0686 20 LYS C CD +1013 C CE . LYS C 22 ? 0.4823 0.8037 0.3428 -0.0387 -0.0414 0.0728 20 LYS C CE +1014 N NZ . LYS C 22 ? 0.5206 0.8707 0.3894 -0.0168 -0.0435 0.1251 20 LYS C NZ +1015 N N . GLU C 23 ? 0.3828 0.4856 0.3468 0.0444 -0.0014 0.0925 21 GLU C N +1016 C CA . GLU C 23 ? 0.4174 0.4870 0.3989 0.0620 0.0191 0.1183 21 GLU C CA +1017 C C . GLU C 23 ? 0.4442 0.4506 0.4210 0.0509 0.0346 0.0931 21 GLU C C +1018 O O . GLU C 23 ? 0.4307 0.4135 0.4102 0.0490 0.0486 0.1036 21 GLU C O +1019 C CB . GLU C 23 ? 0.4740 0.5423 0.4823 0.0847 0.0307 0.1381 21 GLU C CB +1020 C CG . GLU C 23 ? 0.4916 0.6318 0.5180 0.1013 0.0221 0.1835 21 GLU C CG +1021 C CD . GLU C 23 ? 0.5155 0.6728 0.5772 0.1257 0.0318 0.2072 21 GLU C CD +1022 O OE1 . GLU C 23 ? 0.5137 0.6247 0.5820 0.1293 0.0457 0.1832 21 GLU C OE1 +1023 O OE2 . GLU C 23 ? 0.5195 0.7508 0.6022 0.1403 0.0240 0.2530 21 GLU C OE2 +1024 N N . ARG C 24 ? 0.4381 0.4284 0.4079 0.0408 0.0310 0.0617 22 ARG C N +1025 C CA . ARG C 24 ? 0.4974 0.4504 0.4597 0.0238 0.0403 0.0360 22 ARG C CA +1026 C C . ARG C 24 ? 0.4619 0.4255 0.4166 0.0067 0.0332 0.0312 22 ARG C C +1027 O O . ARG C 24 ? 0.4904 0.4267 0.4475 -0.0062 0.0470 0.0261 22 ARG C O +1028 C CB . ARG C 24 ? 0.5346 0.4918 0.4881 0.0176 0.0330 0.0116 22 ARG C CB +1029 C CG . ARG C 24 ? 0.6331 0.5806 0.5736 -0.0062 0.0342 -0.0149 22 ARG C CG +1030 C CD . ARG C 24 ? 0.7049 0.6141 0.6377 -0.0146 0.0557 -0.0343 22 ARG C CD +1031 N NE . ARG C 24 ? 0.8414 0.7532 0.7744 0.0020 0.0580 -0.0329 22 ARG C NE +1032 C CZ . ARG C 24 ? 0.8551 0.7703 0.7709 -0.0072 0.0601 -0.0537 22 ARG C CZ +1033 N NH1 . ARG C 24 ? 0.8427 0.7657 0.7361 -0.0365 0.0586 -0.0791 22 ARG C NH1 +1034 N NH2 . ARG C 24 ? 0.8638 0.7830 0.7850 0.0114 0.0640 -0.0469 22 ARG C NH2 +1035 N N . GLY C 25 ? 0.3903 0.3903 0.3384 0.0045 0.0168 0.0296 23 GLY C N +1036 C CA . GLY C 25 ? 0.3809 0.3930 0.3262 -0.0079 0.0148 0.0259 23 GLY C CA +1037 C C . GLY C 25 ? 0.3888 0.3940 0.3347 -0.0066 0.0253 0.0467 23 GLY C C +1038 O O . GLY C 25 ? 0.4093 0.3970 0.3612 -0.0188 0.0357 0.0452 23 GLY C O +1039 N N . GLU C 26 ? 0.4019 0.4243 0.3445 0.0073 0.0242 0.0698 24 GLU C N +1040 C CA . GLU C 26 ? 0.4181 0.4498 0.3588 0.0116 0.0333 0.0996 24 GLU C CA +1041 C C . GLU C 26 ? 0.4766 0.4603 0.4368 0.0163 0.0576 0.1151 24 GLU C C +1042 O O . GLU C 26 ? 0.4759 0.4453 0.4393 0.0079 0.0707 0.1230 24 GLU C O +1043 C CB . GLU C 26 ? 0.4107 0.4928 0.3420 0.0225 0.0229 0.1239 24 GLU C CB +1044 C CG . GLU C 26 ? 0.3843 0.5045 0.2913 0.0065 0.0086 0.1001 24 GLU C CG +1045 C CD . GLU C 26 ? 0.4059 0.5887 0.2954 0.0042 -0.0031 0.1148 24 GLU C CD +1046 O OE1 . GLU C 26 ? 0.4306 0.6443 0.3328 0.0201 -0.0073 0.1497 24 GLU C OE1 +1047 O OE2 . GLU C 26 ? 0.3940 0.6016 0.2571 -0.0151 -0.0055 0.0934 24 GLU C OE2 +1048 N N . ARG C 27 ? 0.5090 0.4606 0.4835 0.0264 0.0688 0.1140 25 ARG C N +1049 C CA . ARG C 27 ? 0.5771 0.4653 0.5718 0.0272 0.1034 0.1199 25 ARG C CA +1050 C C . ARG C 27 ? 0.5828 0.4359 0.5745 -0.0059 0.1131 0.0847 25 ARG C C +1051 O O . ARG C 27 ? 0.6479 0.4561 0.6538 -0.0148 0.1427 0.0901 25 ARG C O +1052 C CB . ARG C 27 ? 0.5842 0.4457 0.5912 0.0426 0.1163 0.1163 25 ARG C CB +1053 C CG . ARG C 27 ? 0.6666 0.4501 0.6913 0.0397 0.1600 0.1080 25 ARG C CG +1054 C CD . ARG C 27 ? 0.6864 0.4463 0.7052 0.0365 0.1662 0.0751 25 ARG C CD +1055 N NE . ARG C 27 ? 0.6666 0.4758 0.6905 0.0635 0.1456 0.0963 25 ARG C NE +1056 C CZ . ARG C 27 ? 0.6568 0.4844 0.6671 0.0596 0.1287 0.0713 25 ARG C CZ +1057 N NH1 . ARG C 27 ? 0.6643 0.4665 0.6522 0.0320 0.1312 0.0254 25 ARG C NH1 +1058 N NH2 . ARG C 27 ? 0.6222 0.5011 0.6418 0.0809 0.1100 0.0939 25 ARG C NH2 +1059 N N . GLN C 28 ? 0.5588 0.4401 0.5358 -0.0247 0.0894 0.0529 26 GLN C N +1060 C CA . GLN C 28 ? 0.5785 0.4543 0.5547 -0.0581 0.0910 0.0230 26 GLN C CA +1061 C C . GLN C 28 ? 0.5343 0.4508 0.5120 -0.0680 0.0781 0.0285 26 GLN C C +1062 O O . GLN C 28 ? 0.5294 0.4569 0.5132 -0.0956 0.0775 0.0098 26 GLN C O +1063 C CB . GLN C 28 ? 0.5803 0.4789 0.5442 -0.0693 0.0726 -0.0067 26 GLN C CB +1064 C CG . GLN C 28 ? 0.6574 0.5156 0.6153 -0.0708 0.0893 -0.0250 26 GLN C CG +1065 C CD . GLN C 28 ? 0.6370 0.5310 0.5783 -0.0806 0.0686 -0.0486 26 GLN C CD +1066 O OE1 . GLN C 28 ? 0.6494 0.5858 0.5866 -0.1029 0.0524 -0.0614 26 GLN C OE1 +1067 N NE2 . GLN C 28 ? 0.6915 0.5807 0.6282 -0.0598 0.0675 -0.0454 26 GLN C NE2 +1068 N N . ASN C 29 ? 0.4886 0.4341 0.4606 -0.0487 0.0689 0.0522 27 ASN C N +1069 C CA . ASN C 29 ? 0.4442 0.4285 0.4154 -0.0553 0.0603 0.0530 27 ASN C CA +1070 C C . ASN C 29 ? 0.4074 0.4222 0.3843 -0.0666 0.0456 0.0312 27 ASN C C +1071 O O . ASN C 29 ? 0.4048 0.4435 0.3965 -0.0820 0.0465 0.0282 27 ASN C O +1072 C CB . ASN C 29 ? 0.4791 0.4535 0.4618 -0.0679 0.0789 0.0666 27 ASN C CB +1073 C CG . ASN C 29 ? 0.5117 0.4650 0.4911 -0.0505 0.0957 0.1007 27 ASN C CG +1074 O OD1 . ASN C 29 ? 0.4903 0.4673 0.4536 -0.0302 0.0866 0.1187 27 ASN C OD1 +1075 N ND2 . ASN C 29 ? 0.5621 0.4763 0.5585 -0.0598 0.1212 0.1109 27 ASN C ND2 +1076 N N . CYS C 30 ? 0.3839 0.4046 0.3530 -0.0563 0.0332 0.0219 28 CYS C N +1077 C CA . CYS C 30 ? 0.3445 0.4002 0.3206 -0.0576 0.0206 0.0122 28 CYS C CA +1078 C C . CYS C 30 ? 0.3206 0.3855 0.2894 -0.0383 0.0172 0.0162 28 CYS C C +1079 O O . CYS C 30 ? 0.3199 0.3702 0.2739 -0.0286 0.0172 0.0202 28 CYS C O +1080 C CB . CYS C 30 ? 0.3619 0.4142 0.3340 -0.0670 0.0141 -0.0036 28 CYS C CB +1081 S SG . CYS C 30 ? 0.4430 0.4833 0.4184 -0.1039 0.0239 -0.0214 28 CYS C SG +1082 N N . GLN C 31 ? 0.3155 0.4076 0.2982 -0.0343 0.0187 0.0174 29 GLN C N +1083 C CA . GLN C 31 ? 0.3046 0.3974 0.2842 -0.0213 0.0237 0.0147 29 GLN C CA +1084 C C . GLN C 31 ? 0.3087 0.3931 0.2823 -0.0150 0.0145 0.0086 29 GLN C C +1085 O O . GLN C 31 ? 0.3242 0.4163 0.3033 -0.0172 0.0057 0.0083 29 GLN C O +1086 C CB . GLN C 31 ? 0.3187 0.4338 0.3242 -0.0145 0.0364 0.0213 29 GLN C CB +1087 C CG . GLN C 31 ? 0.3360 0.4608 0.3503 -0.0183 0.0514 0.0276 29 GLN C CG +1088 C CD . GLN C 31 ? 0.3556 0.5065 0.4077 -0.0062 0.0708 0.0410 29 GLN C CD +1089 O OE1 . GLN C 31 ? 0.3811 0.5280 0.4475 0.0083 0.0829 0.0434 29 GLN C OE1 +1090 N NE2 . GLN C 31 ? 0.3434 0.5177 0.4155 -0.0102 0.0807 0.0526 29 GLN C NE2 +1091 N N . TYR C 32 ? 0.2756 0.3511 0.2376 -0.0103 0.0176 0.0023 30 TYR C N +1092 C CA . TYR C 32 ? 0.2692 0.3403 0.2310 -0.0047 0.0122 -0.0020 30 TYR C CA +1093 C C . TYR C 32 ? 0.2881 0.3562 0.2544 -0.0029 0.0255 -0.0107 30 TYR C C +1094 O O . TYR C 32 ? 0.2994 0.3650 0.2560 -0.0107 0.0377 -0.0205 30 TYR C O +1095 C CB . TYR C 32 ? 0.2784 0.3422 0.2255 -0.0042 0.0026 -0.0007 30 TYR C CB +1096 C CG . TYR C 32 ? 0.2755 0.3516 0.2080 -0.0089 0.0032 -0.0012 30 TYR C CG +1097 C CD1 . TYR C 32 ? 0.2662 0.3543 0.1955 -0.0131 0.0023 -0.0108 30 TYR C CD1 +1098 C CD2 . TYR C 32 ? 0.3101 0.3943 0.2307 -0.0128 0.0043 0.0088 30 TYR C CD2 +1099 C CE1 . TYR C 32 ? 0.2892 0.4041 0.2004 -0.0261 0.0009 -0.0148 30 TYR C CE1 +1100 C CE2 . TYR C 32 ? 0.3140 0.4269 0.2152 -0.0205 0.0020 0.0110 30 TYR C CE2 +1101 C CZ . TYR C 32 ? 0.3159 0.4470 0.2110 -0.0298 -0.0002 -0.0039 30 TYR C CZ +1102 O OH . TYR C 32 ? 0.3263 0.5011 0.1982 -0.0456 -0.0051 -0.0049 30 TYR C OH +1103 N N . GLN C 33 ? 0.2769 0.3432 0.2560 0.0045 0.0268 -0.0090 31 GLN C N +1104 C CA . GLN C 33 ? 0.3097 0.3635 0.2998 0.0050 0.0470 -0.0171 31 GLN C CA +1105 C C . GLN C 33 ? 0.3169 0.3688 0.3125 0.0095 0.0424 -0.0155 31 GLN C C +1106 O O . GLN C 33 ? 0.3220 0.3847 0.3193 0.0177 0.0298 -0.0036 31 GLN C O +1107 C CB . GLN C 33 ? 0.2973 0.3509 0.3168 0.0175 0.0695 -0.0034 31 GLN C CB +1108 C CG . GLN C 33 ? 0.3348 0.3643 0.3767 0.0234 0.1014 -0.0056 31 GLN C CG +1109 C CD . GLN C 33 ? 0.3377 0.3741 0.4208 0.0454 0.1268 0.0223 31 GLN C CD +1110 O OE1 . GLN C 33 ? 0.3243 0.3847 0.4143 0.0495 0.1215 0.0348 31 GLN C OE1 +1111 N NE2 . GLN C 33 ? 0.3375 0.3569 0.4515 0.0599 0.1555 0.0361 31 GLN C NE2 +1112 N N . ILE C 34 ? 0.3529 0.3933 0.3492 -0.0002 0.0548 -0.0306 32 ILE C N +1113 C CA . ILE C 34 ? 0.3507 0.3912 0.3543 0.0006 0.0532 -0.0302 32 ILE C CA +1114 C C . ILE C 34 ? 0.3859 0.4029 0.4174 0.0067 0.0850 -0.0263 32 ILE C C +1115 O O . ILE C 34 ? 0.3819 0.3741 0.4202 -0.0040 0.1137 -0.0428 32 ILE C O +1116 C CB . ILE C 34 ? 0.3819 0.4380 0.3716 -0.0186 0.0432 -0.0469 32 ILE C CB +1117 C CG1 . ILE C 34 ? 0.3670 0.4469 0.3436 -0.0124 0.0172 -0.0348 32 ILE C CG1 +1118 C CG2 . ILE C 34 ? 0.3886 0.4441 0.3953 -0.0207 0.0499 -0.0480 32 ILE C CG2 +1119 C CD1 . ILE C 34 ? 0.4036 0.4915 0.3625 -0.0173 0.0108 -0.0345 32 ILE C CD1 +1120 N N . ARG C 35 ? 0.3968 0.4199 0.4439 0.0235 0.0848 -0.0044 33 ARG C N +1121 C CA . ARG C 35 ? 0.4034 0.4078 0.4837 0.0359 0.1173 0.0120 33 ARG C CA +1122 C C . ARG C 35 ? 0.4131 0.4165 0.4975 0.0326 0.1176 0.0119 33 ARG C C +1123 O O . ARG C 35 ? 0.3427 0.3633 0.4068 0.0230 0.0929 0.0002 33 ARG C O +1124 C CB . ARG C 35 ? 0.4044 0.4360 0.5021 0.0618 0.1162 0.0507 33 ARG C CB +1125 C CG . ARG C 35 ? 0.4224 0.4721 0.5197 0.0656 0.1092 0.0569 33 ARG C CG +1126 C CD . ARG C 35 ? 0.4355 0.5331 0.5535 0.0865 0.1044 0.0984 33 ARG C CD +1127 N NE . ARG C 35 ? 0.4478 0.5688 0.5734 0.0878 0.1003 0.1055 33 ARG C NE +1128 C CZ . ARG C 35 ? 0.4637 0.5786 0.6266 0.1033 0.1320 0.1235 33 ARG C CZ +1129 N NH1 . ARG C 35 ? 0.5076 0.5861 0.7047 0.1192 0.1746 0.1357 33 ARG C NH1 +1130 N NH2 . ARG C 35 ? 0.4585 0.6024 0.6301 0.1039 0.1266 0.1315 33 ARG C NH2 +1131 N N . LYS C 36 ? 0.4366 0.4216 0.5521 0.0440 0.1489 0.0305 34 LYS C N +1132 C CA . LYS C 36 ? 0.4931 0.4794 0.6179 0.0443 0.1536 0.0382 34 LYS C CA +1133 C C . LYS C 36 ? 0.4936 0.4914 0.6420 0.0725 0.1693 0.0828 34 LYS C C +1134 O O . LYS C 36 ? 0.4867 0.4771 0.6635 0.0916 0.1951 0.1102 34 LYS C O +1135 C CB . LYS C 36 ? 0.5528 0.5010 0.6968 0.0208 0.1860 0.0132 34 LYS C CB +1136 C CG . LYS C 36 ? 0.5746 0.5323 0.6943 -0.0137 0.1676 -0.0288 34 LYS C CG +1137 C CD . LYS C 36 ? 0.6408 0.5764 0.7786 -0.0452 0.1962 -0.0552 34 LYS C CD +1138 C CE . LYS C 36 ? 0.6454 0.6075 0.7930 -0.0442 0.1841 -0.0431 34 LYS C CE +1139 N NZ . LYS C 36 ? 0.7035 0.6577 0.8671 -0.0858 0.2059 -0.0760 34 LYS C NZ +1140 N N . GLU C 37 ? 0.4979 0.5223 0.6338 0.0773 0.1532 0.0944 35 GLU C N +1141 C CA . GLU C 37 ? 0.5251 0.5717 0.6771 0.1011 0.1664 0.1387 35 GLU C CA +1142 C C . GLU C 37 ? 0.5101 0.5395 0.6719 0.0927 0.1815 0.1330 35 GLU C C +1143 O O . GLU C 37 ? 0.4560 0.5027 0.5929 0.0826 0.1586 0.1158 35 GLU C O +1144 C CB . GLU C 37 ? 0.5611 0.6660 0.6780 0.1092 0.1314 0.1537 35 GLU C CB +1145 C CG . GLU C 37 ? 0.6246 0.7776 0.7542 0.1312 0.1330 0.2000 35 GLU C CG +1146 C CD . GLU C 37 ? 0.6886 0.8775 0.7883 0.1207 0.0986 0.1855 35 GLU C CD +1147 O OE1 . GLU C 37 ? 0.7539 0.9751 0.8136 0.1090 0.0728 0.1733 35 GLU C OE1 +1148 O OE2 . GLU C 37 ? 0.6961 0.8769 0.8115 0.1213 0.1010 0.1824 35 GLU C OE2 +1149 N N . GLY C 38 ? 0.5377 0.5321 0.7410 0.0980 0.2252 0.1504 36 GLY C N +1150 C CA . GLY C 38 ? 0.5550 0.5268 0.7751 0.0826 0.2455 0.1394 36 GLY C CA +1151 C C . GLY C 38 ? 0.5091 0.4689 0.7154 0.0457 0.2301 0.0848 36 GLY C C +1152 O O . GLY C 38 ? 0.4750 0.4093 0.6820 0.0296 0.2375 0.0581 36 GLY C O +1153 N N . ASN C 39 ? 0.4556 0.4423 0.6498 0.0339 0.2095 0.0724 37 ASN C N +1154 C CA . ASN C 39 ? 0.4094 0.4105 0.5913 0.0034 0.1870 0.0319 37 ASN C CA +1155 C C . ASN C 39 ? 0.3529 0.3905 0.4994 0.0112 0.1447 0.0269 37 ASN C C +1156 O O . ASN C 39 ? 0.3302 0.3905 0.4712 -0.0079 0.1263 0.0048 37 ASN C O +1157 C CB . ASN C 39 ? 0.4291 0.4440 0.6329 -0.0175 0.1953 0.0225 37 ASN C CB +1158 C CG . ASN C 39 ? 0.4096 0.4502 0.6116 -0.0560 0.1789 -0.0161 37 ASN C CG +1159 O OD1 . ASN C 39 ? 0.4501 0.4729 0.6456 -0.0797 0.1851 -0.0438 37 ASN C OD1 +1160 N ND2 . ASN C 39 ? 0.3999 0.4881 0.6094 -0.0639 0.1613 -0.0161 37 ASN C ND2 +1161 N N . CYS C 40 ? 0.3240 0.3706 0.4486 0.0368 0.1319 0.0482 38 CYS C N +1162 C CA . CYS C 40 ? 0.3031 0.3708 0.3960 0.0421 0.1011 0.0414 38 CYS C CA +1163 C C . CYS C 40 ? 0.3071 0.3651 0.3882 0.0366 0.0908 0.0287 38 CYS C C +1164 O O . CYS C 40 ? 0.3515 0.3945 0.4416 0.0433 0.1050 0.0393 38 CYS C O +1165 C CB . CYS C 40 ? 0.3084 0.3934 0.3792 0.0623 0.0953 0.0629 38 CYS C CB +1166 S SG . CYS C 40 ? 0.3043 0.4029 0.3813 0.0694 0.1094 0.0772 38 CYS C SG +1167 N N . TYR C 41 ? 0.2975 0.3674 0.3629 0.0275 0.0695 0.0118 39 TYR C N +1168 C CA . TYR C 41 ? 0.2892 0.3532 0.3406 0.0225 0.0598 0.0019 39 TYR C CA +1169 C C . TYR C 41 ? 0.2646 0.3350 0.2942 0.0373 0.0452 0.0127 39 TYR C C +1170 O O . TYR C 41 ? 0.2168 0.2964 0.2348 0.0451 0.0396 0.0179 39 TYR C O +1171 C CB . TYR C 41 ? 0.3080 0.3895 0.3539 0.0050 0.0458 -0.0151 39 TYR C CB +1172 C CG . TYR C 41 ? 0.3196 0.4008 0.3808 -0.0205 0.0608 -0.0335 39 TYR C CG +1173 C CD1 . TYR C 41 ? 0.3198 0.4173 0.4017 -0.0311 0.0673 -0.0350 39 TYR C CD1 +1174 C CD2 . TYR C 41 ? 0.3412 0.4035 0.3971 -0.0378 0.0741 -0.0526 39 TYR C CD2 +1175 C CE1 . TYR C 41 ? 0.3575 0.4512 0.4546 -0.0632 0.0867 -0.0580 39 TYR C CE1 +1176 C CE2 . TYR C 41 ? 0.3751 0.4300 0.4413 -0.0695 0.0955 -0.0788 39 TYR C CE2 +1177 C CZ . TYR C 41 ? 0.3881 0.4582 0.4748 -0.0847 0.1017 -0.0830 39 TYR C CZ +1178 O OH . TYR C 41 ? 0.4431 0.5035 0.5397 -0.1247 0.1270 -0.1156 39 TYR C OH +1179 N N . VAL C 42 ? 0.2714 0.3372 0.2971 0.0376 0.0442 0.0137 40 VAL C N +1180 C CA . VAL C 42 ? 0.2473 0.3266 0.2590 0.0446 0.0339 0.0237 40 VAL C CA +1181 C C . VAL C 42 ? 0.2656 0.3399 0.2675 0.0362 0.0241 0.0122 40 VAL C C +1182 O O . VAL C 42 ? 0.2900 0.3534 0.3005 0.0304 0.0328 0.0053 40 VAL C O +1183 C CB . VAL C 42 ? 0.2651 0.3588 0.2948 0.0568 0.0466 0.0490 40 VAL C CB +1184 C CG1 . VAL C 42 ? 0.2379 0.3654 0.2549 0.0572 0.0314 0.0594 40 VAL C CG1 +1185 C CG2 . VAL C 42 ? 0.2651 0.3681 0.3049 0.0677 0.0592 0.0688 40 VAL C CG2 +1186 N N . CYS C 43 ? 0.2762 0.3542 0.2588 0.0330 0.0106 0.0072 41 CYS C N +1187 C CA . CYS C 43 ? 0.2836 0.3567 0.2577 0.0255 0.0035 0.0008 41 CYS C CA +1188 C C . CYS C 43 ? 0.2926 0.3849 0.2668 0.0229 0.0003 0.0083 41 CYS C C +1189 O O . CYS C 43 ? 0.2849 0.3949 0.2485 0.0193 -0.0048 0.0099 41 CYS C O +1190 C CB . CYS C 43 ? 0.2923 0.3525 0.2524 0.0234 -0.0014 -0.0060 41 CYS C CB +1191 S SG . CYS C 43 ? 0.2887 0.3391 0.2418 0.0152 -0.0046 -0.0078 41 CYS C SG +1192 N N . GLU C 44 ? 0.3171 0.4133 0.3041 0.0228 0.0051 0.0132 42 GLU C N +1193 C CA . GLU C 44 ? 0.2917 0.4168 0.2850 0.0188 0.0005 0.0233 42 GLU C CA +1194 C C . GLU C 44 ? 0.2923 0.4060 0.2761 0.0062 -0.0039 0.0124 42 GLU C C +1195 O O . GLU C 44 ? 0.2496 0.3451 0.2346 0.0075 0.0032 0.0085 42 GLU C O +1196 C CB . GLU C 44 ? 0.2929 0.4346 0.3175 0.0325 0.0160 0.0443 42 GLU C CB +1197 C CG . GLU C 44 ? 0.3074 0.4946 0.3468 0.0293 0.0101 0.0609 42 GLU C CG +1198 C CD . GLU C 44 ? 0.3201 0.5354 0.4000 0.0491 0.0282 0.0928 42 GLU C CD +1199 O OE1 . GLU C 44 ? 0.3425 0.5426 0.4409 0.0549 0.0463 0.0941 42 GLU C OE1 +1200 O OE2 . GLU C 44 ? 0.3963 0.6487 0.4916 0.0617 0.0290 0.1200 42 GLU C OE2 +1201 N N . ILE C 45 ? 0.2796 0.4086 0.2545 -0.0088 -0.0126 0.0080 43 ILE C N +1202 C CA . ILE C 45 ? 0.3040 0.4186 0.2737 -0.0229 -0.0123 -0.0003 43 ILE C CA +1203 C C . ILE C 45 ? 0.3124 0.4739 0.2994 -0.0342 -0.0164 0.0095 43 ILE C C +1204 O O . ILE C 45 ? 0.3019 0.5093 0.2903 -0.0425 -0.0256 0.0145 43 ILE C O +1205 C CB . ILE C 45 ? 0.3397 0.4244 0.2885 -0.0372 -0.0107 -0.0182 43 ILE C CB +1206 C CG1 . ILE C 45 ? 0.3521 0.4019 0.2935 -0.0213 -0.0050 -0.0196 43 ILE C CG1 +1207 C CG2 . ILE C 45 ? 0.3761 0.4445 0.3262 -0.0537 -0.0042 -0.0231 43 ILE C CG2 +1208 C CD1 . ILE C 45 ? 0.3400 0.3790 0.2870 -0.0098 -0.0028 -0.0089 43 ILE C CD1 +1209 N N . ARG C 46 ? 0.2995 0.4622 0.3011 -0.0335 -0.0097 0.0164 44 ARG C N +1210 C CA . ARG C 46 ? 0.2972 0.5122 0.3244 -0.0430 -0.0115 0.0304 44 ARG C CA +1211 C C . ARG C 46 ? 0.3251 0.5227 0.3481 -0.0624 -0.0079 0.0204 44 ARG C C +1212 O O . ARG C 46 ? 0.3187 0.4891 0.3421 -0.0548 0.0038 0.0230 44 ARG C O +1213 C CB . ARG C 46 ? 0.2939 0.5300 0.3538 -0.0198 0.0024 0.0542 44 ARG C CB +1214 C CG . ARG C 46 ? 0.3142 0.5594 0.3858 0.0021 0.0074 0.0693 44 ARG C CG +1215 C CD . ARG C 46 ? 0.3447 0.5983 0.4548 0.0255 0.0328 0.0925 44 ARG C CD +1216 N NE . ARG C 46 ? 0.3526 0.5495 0.4493 0.0270 0.0525 0.0724 44 ARG C NE +1217 C CZ . ARG C 46 ? 0.3569 0.5054 0.4361 0.0311 0.0654 0.0545 44 ARG C CZ +1218 N NH1 . ARG C 46 ? 0.3223 0.4587 0.3980 0.0376 0.0641 0.0536 44 ARG C NH1 +1219 N NH2 . ARG C 46 ? 0.3801 0.4963 0.4419 0.0242 0.0807 0.0353 44 ARG C NH2 +1220 N N . CYS C 47 ? 0.3410 0.5576 0.3587 -0.0909 -0.0156 0.0081 45 CYS C N +1221 C CA . CYS C 47 ? 0.3826 0.5836 0.4011 -0.1175 -0.0082 -0.0031 45 CYS C CA +1222 C C . CYS C 47 ? 0.3471 0.6131 0.3984 -0.1337 -0.0109 0.0106 45 CYS C C +1223 O O . CYS C 47 ? 0.3090 0.6453 0.3861 -0.1264 -0.0202 0.0318 45 CYS C O +1224 C CB . CYS C 47 ? 0.4255 0.5966 0.4187 -0.1464 -0.0058 -0.0326 45 CYS C CB +1225 S SG . CYS C 47 ? 0.4726 0.5633 0.4396 -0.1235 0.0062 -0.0415 45 CYS C SG +1226 O OXT . CYS C 47 ? 0.3664 0.6166 0.4230 -0.1530 -0.0011 0.0046 45 CYS C OXT +# diff --git a/tests/resources/5sv5.cif b/tests/resources/5sv5.cif new file mode 100644 index 0000000..eee359b --- /dev/null +++ b/tests/resources/5sv5.cif @@ -0,0 +1,4958 @@ +data_5SV5 +# +_entry.id 5SV5 +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.397 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 5SV5 pdb_00005sv5 10.2210/pdb5sv5/pdb +WWPDB D_1000223193 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2016-08-17 +2 'Structure model' 1 1 2024-10-30 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Data collection' +2 2 'Structure model' 'Database references' +3 2 'Structure model' 'Derived calculations' +4 2 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 2 'Structure model' chem_comp_atom +2 2 'Structure model' chem_comp_bond +3 2 'Structure model' database_2 +4 2 'Structure model' pdbx_entry_details +5 2 'Structure model' pdbx_modification_feature +6 2 'Structure model' pdbx_struct_conn_angle +7 2 'Structure model' pdbx_struct_oper_list +8 2 'Structure model' struct_conn +9 2 'Structure model' struct_conn_type +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 2 'Structure model' '_database_2.pdbx_DOI' +2 2 'Structure model' '_database_2.pdbx_database_accession' +3 2 'Structure model' '_pdbx_struct_conn_angle.ptnr1_auth_seq_id' +4 2 'Structure model' '_pdbx_struct_conn_angle.ptnr1_label_alt_id' +5 2 'Structure model' '_pdbx_struct_conn_angle.ptnr3_auth_seq_id' +6 2 'Structure model' '_pdbx_struct_conn_angle.ptnr3_label_alt_id' +7 2 'Structure model' '_pdbx_struct_conn_angle.value' +8 2 'Structure model' '_pdbx_struct_oper_list.symmetry_operation' +9 2 'Structure model' '_struct_conn.conn_type_id' +10 2 'Structure model' '_struct_conn.id' +11 2 'Structure model' '_struct_conn.pdbx_dist_value' +12 2 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +13 2 'Structure model' '_struct_conn.pdbx_ptnr1_label_alt_id' +14 2 'Structure model' '_struct_conn.pdbx_ptnr2_label_alt_id' +15 2 'Structure model' '_struct_conn.ptnr1_auth_comp_id' +16 2 'Structure model' '_struct_conn.ptnr1_auth_seq_id' +17 2 'Structure model' '_struct_conn.ptnr1_label_atom_id' +18 2 'Structure model' '_struct_conn.ptnr1_label_comp_id' +19 2 'Structure model' '_struct_conn.ptnr1_label_seq_id' +20 2 'Structure model' '_struct_conn.ptnr2_auth_comp_id' +21 2 'Structure model' '_struct_conn.ptnr2_auth_seq_id' +22 2 'Structure model' '_struct_conn.ptnr2_label_asym_id' +23 2 'Structure model' '_struct_conn.ptnr2_label_atom_id' +24 2 'Structure model' '_struct_conn.ptnr2_label_comp_id' +25 2 'Structure model' '_struct_conn.ptnr2_label_seq_id' +26 2 'Structure model' '_struct_conn_type.id' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.entry_id 5SV5 +_pdbx_database_status.recvd_initial_deposition_date 2016-08-04 +_pdbx_database_status.SG_entry Y +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_nmr_data ? +# +_pdbx_database_related.db_name TargetTrack +_pdbx_database_related.db_id CSGID-IDP02298 +_pdbx_database_related.content_type unspecified +_pdbx_database_related.details . +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Minasov, G.' 1 +'Shuvalova, L.' 2 +'Kiryukhina, O.' 3 +'Dubrovska, I.' 4 +'Shatsman, S.' 5 +'Kwon, K.' 6 +'Anderson, W.F.' 7 +'Center for Structural Genomics of Infectious Diseases (CSGID)' 8 +# +_citation.abstract ? +_citation.abstract_id_CAS ? +_citation.book_id_ISBN ? +_citation.book_publisher ? +_citation.book_publisher_city ? +_citation.book_title ? +_citation.coordinate_linkage ? +_citation.country ? +_citation.database_id_Medline ? +_citation.details ? +_citation.id primary +_citation.journal_abbrev 'To Be Published' +_citation.journal_id_ASTM ? +_citation.journal_id_CSD 0353 +_citation.journal_id_ISSN ? +_citation.journal_full ? +_citation.journal_issue ? +_citation.journal_volume ? +_citation.language ? +_citation.page_first ? +_citation.page_last ? +_citation.title +'1.0 Angstrom Crystal Structure of pre-Peptidase C-terminal Domain of Collagenase from Bacillus anthracis.' +_citation.year ? +_citation.database_id_CSD ? +_citation.pdbx_database_id_DOI ? +_citation.pdbx_database_id_PubMed ? +_citation.unpublished_flag ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Minasov, G.' 1 ? +primary 'Shuvalova, L.' 2 ? +primary 'Kiryukhina, O.' 3 ? +primary 'Dubrovska, I.' 4 ? +primary 'Shatsman, S.' 5 ? +primary 'Kwon, K.' 6 ? +primary 'Anderson, W.F.' 7 ? +primary 'Center for Structural Genomics of Infectious Diseases (CSGID)' 8 ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Microbial collagenase' 11831.623 1 3.4.24.3 ? ? ? +2 non-polymer syn 'SODIUM ION' 22.990 3 ? ? ? ? +3 water nat water 18.015 150 ? ? ? ? +# +_entity_name_com.entity_id 1 +_entity_name_com.name 'Putative microbial collagenase' +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer yes +_entity_poly.pdbx_seq_one_letter_code +;NNRPEEANRIGLNTTIKGSLIGGDHTDVYTFNVASAKNIDISVLNEYGIG(MSE)TWVLHHESD(MSE)QNYAAYGQANG +NHIEANFNAKPGKYYLYVYKYDNGDGTYELSVK +; +_entity_poly.pdbx_seq_one_letter_code_can +;NNRPEEANRIGLNTTIKGSLIGGDHTDVYTFNVASAKNIDISVLNEYGIGMTWVLHHESDMQNYAAYGQANGNHIEANFN +AKPGKYYLYVYKYDNGDGTYELSVK +; +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier CSGID-IDP02298 +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +2 'SODIUM ION' NA +3 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 ASN n +1 2 ASN n +1 3 ARG n +1 4 PRO n +1 5 GLU n +1 6 GLU n +1 7 ALA n +1 8 ASN n +1 9 ARG n +1 10 ILE n +1 11 GLY n +1 12 LEU n +1 13 ASN n +1 14 THR n +1 15 THR n +1 16 ILE n +1 17 LYS n +1 18 GLY n +1 19 SER n +1 20 LEU n +1 21 ILE n +1 22 GLY n +1 23 GLY n +1 24 ASP n +1 25 HIS n +1 26 THR n +1 27 ASP n +1 28 VAL n +1 29 TYR n +1 30 THR n +1 31 PHE n +1 32 ASN n +1 33 VAL n +1 34 ALA n +1 35 SER n +1 36 ALA n +1 37 LYS n +1 38 ASN n +1 39 ILE n +1 40 ASP n +1 41 ILE n +1 42 SER n +1 43 VAL n +1 44 LEU n +1 45 ASN n +1 46 GLU n +1 47 TYR n +1 48 GLY n +1 49 ILE n +1 50 GLY n +1 51 MSE n +1 52 THR n +1 53 TRP n +1 54 VAL n +1 55 LEU n +1 56 HIS n +1 57 HIS n +1 58 GLU n +1 59 SER n +1 60 ASP n +1 61 MSE n +1 62 GLN n +1 63 ASN n +1 64 TYR n +1 65 ALA n +1 66 ALA n +1 67 TYR n +1 68 GLY n +1 69 GLN n +1 70 ALA n +1 71 ASN n +1 72 GLY n +1 73 ASN n +1 74 HIS n +1 75 ILE n +1 76 GLU n +1 77 ALA n +1 78 ASN n +1 79 PHE n +1 80 ASN n +1 81 ALA n +1 82 LYS n +1 83 PRO n +1 84 GLY n +1 85 LYS n +1 86 TYR n +1 87 TYR n +1 88 LEU n +1 89 TYR n +1 90 VAL n +1 91 TYR n +1 92 LYS n +1 93 TYR n +1 94 ASP n +1 95 ASN n +1 96 GLY n +1 97 ASP n +1 98 GLY n +1 99 THR n +1 100 TYR n +1 101 GLU n +1 102 LEU n +1 103 SER n +1 104 VAL n +1 105 LYS n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type 'Biological sequence' +_entity_src_gen.pdbx_beg_seq_num 1 +_entity_src_gen.pdbx_end_seq_num 105 +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene 'colA, GBAA_0555, BASH2_05262' +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Bacillus anthracis' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 1392 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli BL21(DE3)' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 469008 +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain ' BL21 (DE3) magic ' +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type plasmid +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name pMCSG53 +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MSE 'L-peptide linking' n SELENOMETHIONINE ? 'C5 H11 N O2 Se' 196.106 +NA non-polymer . 'SODIUM ION' ? 'Na 1' 22.990 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 ASN 1 861 861 ASN ASN A . n +A 1 2 ASN 2 862 862 ASN ASN A . n +A 1 3 ARG 3 863 863 ARG ARG A . n +A 1 4 PRO 4 864 864 PRO PRO A . n +A 1 5 GLU 5 865 865 GLU GLU A . n +A 1 6 GLU 6 866 866 GLU GLU A . n +A 1 7 ALA 7 867 867 ALA ALA A . n +A 1 8 ASN 8 868 868 ASN ASN A . n +A 1 9 ARG 9 869 869 ARG ARG A . n +A 1 10 ILE 10 870 870 ILE ILE A . n +A 1 11 GLY 11 871 871 GLY GLY A . n +A 1 12 LEU 12 872 872 LEU LEU A . n +A 1 13 ASN 13 873 873 ASN ASN A . n +A 1 14 THR 14 874 874 THR THR A . n +A 1 15 THR 15 875 875 THR THR A . n +A 1 16 ILE 16 876 876 ILE ILE A . n +A 1 17 LYS 17 877 877 LYS LYS A . n +A 1 18 GLY 18 878 878 GLY GLY A . n +A 1 19 SER 19 879 879 SER SER A . n +A 1 20 LEU 20 880 880 LEU LEU A . n +A 1 21 ILE 21 881 881 ILE ILE A . n +A 1 22 GLY 22 882 882 GLY GLY A . n +A 1 23 GLY 23 883 883 GLY GLY A . n +A 1 24 ASP 24 884 884 ASP ASP A . n +A 1 25 HIS 25 885 885 HIS HIS A . n +A 1 26 THR 26 886 886 THR THR A . n +A 1 27 ASP 27 887 887 ASP ASP A . n +A 1 28 VAL 28 888 888 VAL VAL A . n +A 1 29 TYR 29 889 889 TYR TYR A . n +A 1 30 THR 30 890 890 THR THR A . n +A 1 31 PHE 31 891 891 PHE PHE A . n +A 1 32 ASN 32 892 892 ASN ASN A . n +A 1 33 VAL 33 893 893 VAL VAL A . n +A 1 34 ALA 34 894 894 ALA ALA A . n +A 1 35 SER 35 895 895 SER SER A . n +A 1 36 ALA 36 896 896 ALA ALA A . n +A 1 37 LYS 37 897 897 LYS LYS A . n +A 1 38 ASN 38 898 898 ASN ASN A . n +A 1 39 ILE 39 899 899 ILE ILE A . n +A 1 40 ASP 40 900 900 ASP ASP A . n +A 1 41 ILE 41 901 901 ILE ILE A . n +A 1 42 SER 42 902 902 SER SER A . n +A 1 43 VAL 43 903 903 VAL VAL A . n +A 1 44 LEU 44 904 904 LEU LEU A . n +A 1 45 ASN 45 905 905 ASN ASN A . n +A 1 46 GLU 46 906 906 GLU GLU A . n +A 1 47 TYR 47 907 907 TYR TYR A . n +A 1 48 GLY 48 908 908 GLY GLY A . n +A 1 49 ILE 49 909 909 ILE ILE A . n +A 1 50 GLY 50 910 910 GLY GLY A . n +A 1 51 MSE 51 911 911 MSE MSE A . n +A 1 52 THR 52 912 912 THR THR A . n +A 1 53 TRP 53 913 913 TRP TRP A . n +A 1 54 VAL 54 914 914 VAL VAL A . n +A 1 55 LEU 55 915 915 LEU LEU A . n +A 1 56 HIS 56 916 916 HIS HIS A . n +A 1 57 HIS 57 917 917 HIS HIS A . n +A 1 58 GLU 58 918 918 GLU GLU A . n +A 1 59 SER 59 919 919 SER SER A . n +A 1 60 ASP 60 920 920 ASP ASP A . n +A 1 61 MSE 61 921 921 MSE MSE A . n +A 1 62 GLN 62 922 922 GLN GLN A . n +A 1 63 ASN 63 923 923 ASN ASN A . n +A 1 64 TYR 64 924 924 TYR TYR A . n +A 1 65 ALA 65 925 925 ALA ALA A . n +A 1 66 ALA 66 926 926 ALA ALA A . n +A 1 67 TYR 67 927 927 TYR TYR A . n +A 1 68 GLY 68 928 928 GLY GLY A . n +A 1 69 GLN 69 929 929 GLN GLN A . n +A 1 70 ALA 70 930 930 ALA ALA A . n +A 1 71 ASN 71 931 931 ASN ASN A . n +A 1 72 GLY 72 932 932 GLY GLY A . n +A 1 73 ASN 73 933 933 ASN ASN A . n +A 1 74 HIS 74 934 934 HIS HIS A . n +A 1 75 ILE 75 935 935 ILE ILE A . n +A 1 76 GLU 76 936 936 GLU GLU A . n +A 1 77 ALA 77 937 937 ALA ALA A . n +A 1 78 ASN 78 938 938 ASN ASN A . n +A 1 79 PHE 79 939 939 PHE PHE A . n +A 1 80 ASN 80 940 940 ASN ASN A . n +A 1 81 ALA 81 941 941 ALA ALA A . n +A 1 82 LYS 82 942 942 LYS LYS A . n +A 1 83 PRO 83 943 943 PRO PRO A . n +A 1 84 GLY 84 944 944 GLY GLY A . n +A 1 85 LYS 85 945 945 LYS LYS A . n +A 1 86 TYR 86 946 946 TYR TYR A . n +A 1 87 TYR 87 947 947 TYR TYR A . n +A 1 88 LEU 88 948 948 LEU LEU A . n +A 1 89 TYR 89 949 949 TYR TYR A . n +A 1 90 VAL 90 950 950 VAL VAL A . n +A 1 91 TYR 91 951 951 TYR TYR A . n +A 1 92 LYS 92 952 952 LYS LYS A . n +A 1 93 TYR 93 953 953 TYR TYR A . n +A 1 94 ASP 94 954 954 ASP ASP A . n +A 1 95 ASN 95 955 955 ASN ASN A . n +A 1 96 GLY 96 956 956 GLY GLY A . n +A 1 97 ASP 97 957 957 ASP ASP A . n +A 1 98 GLY 98 958 958 GLY GLY A . n +A 1 99 THR 99 959 959 THR THR A . n +A 1 100 TYR 100 960 960 TYR TYR A . n +A 1 101 GLU 101 961 961 GLU GLU A . n +A 1 102 LEU 102 962 962 LEU LEU A . n +A 1 103 SER 103 963 963 SER SER A . n +A 1 104 VAL 104 964 964 VAL VAL A . n +A 1 105 LYS 105 965 965 LYS LYS A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +B 2 NA 1 1001 1 NA NA A . +C 2 NA 1 1002 2 NA NA A . +D 2 NA 1 1003 3 NA NA A . +E 3 HOH 1 1101 148 HOH HOH A . +E 3 HOH 2 1102 117 HOH HOH A . +E 3 HOH 3 1103 72 HOH HOH A . +E 3 HOH 4 1104 121 HOH HOH A . +E 3 HOH 5 1105 35 HOH HOH A . +E 3 HOH 6 1106 29 HOH HOH A . +E 3 HOH 7 1107 56 HOH HOH A . +E 3 HOH 8 1108 153 HOH HOH A . +E 3 HOH 9 1109 10 HOH HOH A . +E 3 HOH 10 1110 83 HOH HOH A . +E 3 HOH 11 1111 62 HOH HOH A . +E 3 HOH 12 1112 60 HOH HOH A . +E 3 HOH 13 1113 11 HOH HOH A . +E 3 HOH 14 1114 50 HOH HOH A . +E 3 HOH 15 1115 142 HOH HOH A . +E 3 HOH 16 1116 154 HOH HOH A . +E 3 HOH 17 1117 94 HOH HOH A . +E 3 HOH 18 1118 145 HOH HOH A . +E 3 HOH 19 1119 69 HOH HOH A . +E 3 HOH 20 1120 46 HOH HOH A . +E 3 HOH 21 1121 68 HOH HOH A . +E 3 HOH 22 1122 5 HOH HOH A . +E 3 HOH 23 1123 139 HOH HOH A . +E 3 HOH 24 1124 135 HOH HOH A . +E 3 HOH 25 1125 105 HOH HOH A . +E 3 HOH 26 1126 59 HOH HOH A . +E 3 HOH 27 1127 28 HOH HOH A . +E 3 HOH 28 1128 20 HOH HOH A . +E 3 HOH 29 1129 131 HOH HOH A . +E 3 HOH 30 1130 91 HOH HOH A . +E 3 HOH 31 1131 90 HOH HOH A . +E 3 HOH 32 1132 58 HOH HOH A . +E 3 HOH 33 1133 31 HOH HOH A . +E 3 HOH 34 1134 43 HOH HOH A . +E 3 HOH 35 1135 123 HOH HOH A . +E 3 HOH 36 1136 144 HOH HOH A . +E 3 HOH 37 1137 52 HOH HOH A . +E 3 HOH 38 1138 143 HOH HOH A . +E 3 HOH 39 1139 147 HOH HOH A . +E 3 HOH 40 1140 32 HOH HOH A . +E 3 HOH 41 1141 34 HOH HOH A . +E 3 HOH 42 1142 53 HOH HOH A . +E 3 HOH 43 1143 4 HOH HOH A . +E 3 HOH 44 1144 49 HOH HOH A . +E 3 HOH 45 1145 51 HOH HOH A . +E 3 HOH 46 1146 71 HOH HOH A . +E 3 HOH 47 1147 14 HOH HOH A . +E 3 HOH 48 1148 99 HOH HOH A . +E 3 HOH 49 1149 13 HOH HOH A . +E 3 HOH 50 1150 93 HOH HOH A . +E 3 HOH 51 1151 57 HOH HOH A . +E 3 HOH 52 1152 152 HOH HOH A . +E 3 HOH 53 1153 101 HOH HOH A . +E 3 HOH 54 1154 6 HOH HOH A . +E 3 HOH 55 1155 70 HOH HOH A . +E 3 HOH 56 1156 33 HOH HOH A . +E 3 HOH 57 1157 37 HOH HOH A . +E 3 HOH 58 1158 132 HOH HOH A . +E 3 HOH 59 1159 146 HOH HOH A . +E 3 HOH 60 1160 19 HOH HOH A . +E 3 HOH 61 1161 55 HOH HOH A . +E 3 HOH 62 1162 30 HOH HOH A . +E 3 HOH 63 1163 138 HOH HOH A . +E 3 HOH 64 1164 122 HOH HOH A . +E 3 HOH 65 1165 120 HOH HOH A . +E 3 HOH 66 1166 12 HOH HOH A . +E 3 HOH 67 1167 92 HOH HOH A . +E 3 HOH 68 1168 38 HOH HOH A . +E 3 HOH 69 1169 9 HOH HOH A . +E 3 HOH 70 1170 129 HOH HOH A . +E 3 HOH 71 1171 75 HOH HOH A . +E 3 HOH 72 1172 114 HOH HOH A . +E 3 HOH 73 1173 8 HOH HOH A . +E 3 HOH 74 1174 36 HOH HOH A . +E 3 HOH 75 1175 15 HOH HOH A . +E 3 HOH 76 1176 133 HOH HOH A . +E 3 HOH 77 1177 39 HOH HOH A . +E 3 HOH 78 1178 22 HOH HOH A . +E 3 HOH 79 1179 118 HOH HOH A . +E 3 HOH 80 1180 141 HOH HOH A . +E 3 HOH 81 1181 73 HOH HOH A . +E 3 HOH 82 1182 7 HOH HOH A . +E 3 HOH 83 1183 80 HOH HOH A . +E 3 HOH 84 1184 65 HOH HOH A . +E 3 HOH 85 1185 119 HOH HOH A . +E 3 HOH 86 1186 42 HOH HOH A . +E 3 HOH 87 1187 41 HOH HOH A . +E 3 HOH 88 1188 54 HOH HOH A . +E 3 HOH 89 1189 17 HOH HOH A . +E 3 HOH 90 1190 116 HOH HOH A . +E 3 HOH 91 1191 98 HOH HOH A . +E 3 HOH 92 1192 16 HOH HOH A . +E 3 HOH 93 1193 130 HOH HOH A . +E 3 HOH 94 1194 45 HOH HOH A . +E 3 HOH 95 1195 108 HOH HOH A . +E 3 HOH 96 1196 76 HOH HOH A . +E 3 HOH 97 1197 44 HOH HOH A . +E 3 HOH 98 1198 18 HOH HOH A . +E 3 HOH 99 1199 85 HOH HOH A . +E 3 HOH 100 1200 74 HOH HOH A . +E 3 HOH 101 1201 82 HOH HOH A . +E 3 HOH 102 1202 64 HOH HOH A . +E 3 HOH 103 1203 78 HOH HOH A . +E 3 HOH 104 1204 61 HOH HOH A . +E 3 HOH 105 1205 96 HOH HOH A . +E 3 HOH 106 1206 140 HOH HOH A . +E 3 HOH 107 1207 88 HOH HOH A . +E 3 HOH 108 1208 66 HOH HOH A . +E 3 HOH 109 1209 21 HOH HOH A . +E 3 HOH 110 1210 86 HOH HOH A . +E 3 HOH 111 1211 95 HOH HOH A . +E 3 HOH 112 1212 47 HOH HOH A . +E 3 HOH 113 1213 63 HOH HOH A . +E 3 HOH 114 1214 128 HOH HOH A . +E 3 HOH 115 1215 40 HOH HOH A . +E 3 HOH 116 1216 115 HOH HOH A . +E 3 HOH 117 1217 27 HOH HOH A . +E 3 HOH 118 1218 97 HOH HOH A . +E 3 HOH 119 1219 110 HOH HOH A . +E 3 HOH 120 1220 87 HOH HOH A . +E 3 HOH 121 1221 134 HOH HOH A . +E 3 HOH 122 1222 100 HOH HOH A . +E 3 HOH 123 1223 126 HOH HOH A . +E 3 HOH 124 1224 113 HOH HOH A . +E 3 HOH 125 1225 112 HOH HOH A . +E 3 HOH 126 1226 127 HOH HOH A . +E 3 HOH 127 1227 25 HOH HOH A . +E 3 HOH 128 1228 23 HOH HOH A . +E 3 HOH 129 1229 137 HOH HOH A . +E 3 HOH 130 1230 124 HOH HOH A . +E 3 HOH 131 1231 103 HOH HOH A . +E 3 HOH 132 1232 84 HOH HOH A . +E 3 HOH 133 1233 109 HOH HOH A . +E 3 HOH 134 1234 89 HOH HOH A . +E 3 HOH 135 1235 150 HOH HOH A . +E 3 HOH 136 1236 79 HOH HOH A . +E 3 HOH 137 1237 26 HOH HOH A . +E 3 HOH 138 1238 106 HOH HOH A . +E 3 HOH 139 1239 81 HOH HOH A . +E 3 HOH 140 1240 111 HOH HOH A . +E 3 HOH 141 1241 107 HOH HOH A . +E 3 HOH 142 1242 104 HOH HOH A . +E 3 HOH 143 1243 125 HOH HOH A . +E 3 HOH 144 1244 151 HOH HOH A . +E 3 HOH 145 1245 77 HOH HOH A . +E 3 HOH 146 1246 136 HOH HOH A . +E 3 HOH 147 1247 67 HOH HOH A . +E 3 HOH 148 1248 149 HOH HOH A . +E 3 HOH 149 1249 24 HOH HOH A . +E 3 HOH 150 1250 102 HOH HOH A . +# +loop_ +_software.citation_id +_software.classification +_software.compiler_name +_software.compiler_version +_software.contact_author +_software.contact_author_email +_software.date +_software.description +_software.dependencies +_software.hardware +_software.language +_software.location +_software.mods +_software.name +_software.os +_software.os_version +_software.type +_software.version +_software.pdbx_ordinal +? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0155 1 +? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-3000 ? ? ? . 2 +? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-3000 ? ? ? . 3 +? phasing ? ? ? ? ? ? ? ? ? ? ? HKL-3000 ? ? ? . 4 +# +_cell.angle_alpha 90.00 +_cell.angle_alpha_esd ? +_cell.angle_beta 106.95 +_cell.angle_beta_esd ? +_cell.angle_gamma 90.00 +_cell.angle_gamma_esd ? +_cell.entry_id 5SV5 +_cell.details ? +_cell.formula_units_Z ? +_cell.length_a 33.533 +_cell.length_a_esd ? +_cell.length_b 37.764 +_cell.length_b_esd ? +_cell.length_c 42.810 +_cell.length_c_esd ? +_cell.volume ? +_cell.volume_esd ? +_cell.Z_PDB 2 +_cell.reciprocal_angle_alpha ? +_cell.reciprocal_angle_beta ? +_cell.reciprocal_angle_gamma ? +_cell.reciprocal_angle_alpha_esd ? +_cell.reciprocal_angle_beta_esd ? +_cell.reciprocal_angle_gamma_esd ? +_cell.reciprocal_length_a ? +_cell.reciprocal_length_b ? +_cell.reciprocal_length_c ? +_cell.reciprocal_length_a_esd ? +_cell.reciprocal_length_b_esd ? +_cell.reciprocal_length_c_esd ? +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 5SV5 +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 4 +_symmetry.space_group_name_Hall ? +_symmetry.space_group_name_H-M 'P 1 21 1' +_symmetry.pdbx_full_space_group_name_H-M ? +# +_exptl.absorpt_coefficient_mu ? +_exptl.absorpt_correction_T_max ? +_exptl.absorpt_correction_T_min ? +_exptl.absorpt_correction_type ? +_exptl.absorpt_process_details ? +_exptl.entry_id 5SV5 +_exptl.crystals_number 1 +_exptl.details ? +_exptl.method 'X-RAY DIFFRACTION' +_exptl.method_details ? +# +_exptl_crystal.colour ? +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_Matthews 2.27 +_exptl_crystal.density_method ? +_exptl_crystal.density_percent_sol 45.8 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.id 1 +_exptl_crystal.preparation ? +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.colour_lustre ? +_exptl_crystal.colour_modifier ? +_exptl_crystal.colour_primary ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_esd ? +_exptl_crystal.density_meas_gt ? +_exptl_crystal.density_meas_lt ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_meas_temp_esd ? +_exptl_crystal.density_meas_temp_gt ? +_exptl_crystal.density_meas_temp_lt ? +_exptl_crystal.pdbx_crystal_image_url ? +_exptl_crystal.pdbx_crystal_image_format ? +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +# +_exptl_crystal_grow.apparatus ? +_exptl_crystal_grow.atmosphere ? +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.details ? +_exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' +_exptl_crystal_grow.method_ref ? +_exptl_crystal_grow.pH 7.0 +_exptl_crystal_grow.pressure ? +_exptl_crystal_grow.pressure_esd ? +_exptl_crystal_grow.seeding ? +_exptl_crystal_grow.seeding_ref ? +_exptl_crystal_grow.temp 292 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.temp_esd ? +_exptl_crystal_grow.time ? +_exptl_crystal_grow.pdbx_details +;Protein: 16.0 mg/ml, 0.5M Sodium chloride, 0.01M Tris-HCL (pH 8.3); +Screen: Classics II (C9), 1.1M Sodium malonate, 0.1M HEPES (pH 7.0), 0.5% (v/v) Jeffamine ED-2001; +Cryo: 4M Sodium formate +; +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.ambient_environment ? +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.ambient_temp_esd ? +_diffrn.crystal_id 1 +_diffrn.crystal_support ? +_diffrn.crystal_treatment ? +_diffrn.details ? +_diffrn.id 1 +_diffrn.ambient_pressure ? +_diffrn.ambient_pressure_esd ? +_diffrn.ambient_pressure_gt ? +_diffrn.ambient_pressure_lt ? +_diffrn.ambient_temp_gt ? +_diffrn.ambient_temp_lt ? +# +_diffrn_detector.details 'C(111)' +_diffrn_detector.detector CCD +_diffrn_detector.diffrn_id 1 +_diffrn_detector.type 'MARMOSAIC 300 mm CCD' +_diffrn_detector.area_resol_mean ? +_diffrn_detector.dtime ? +_diffrn_detector.pdbx_frames_total ? +_diffrn_detector.pdbx_collection_time_total ? +_diffrn_detector.pdbx_collection_date 2016-08-02 +# +_diffrn_radiation.collimation ? +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.filter_edge ? +_diffrn_radiation.inhomogeneity ? +_diffrn_radiation.monochromator 'beryllium lenses' +_diffrn_radiation.polarisn_norm ? +_diffrn_radiation.polarisn_ratio ? +_diffrn_radiation.probe ? +_diffrn_radiation.type ? +_diffrn_radiation.xray_symbol ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_wavelength_list ? +_diffrn_radiation.pdbx_wavelength ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_analyzer ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 0.97856 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.current ? +_diffrn_source.details ? +_diffrn_source.diffrn_id 1 +_diffrn_source.power ? +_diffrn_source.size ? +_diffrn_source.source SYNCHROTRON +_diffrn_source.target ? +_diffrn_source.type 'APS BEAMLINE 21-ID-G' +_diffrn_source.voltage ? +_diffrn_source.take-off_angle ? +_diffrn_source.pdbx_wavelength_list 0.97856 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_beamline 21-ID-G +_diffrn_source.pdbx_synchrotron_site APS +# +_reflns.B_iso_Wilson_estimate 7.1 +_reflns.entry_id 5SV5 +_reflns.data_reduction_details ? +_reflns.data_reduction_method ? +_reflns.d_resolution_high 1.00 +_reflns.d_resolution_low 30.00 +_reflns.details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.number_all ? +_reflns.number_obs 55101 +_reflns.observed_criterion ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.observed_criterion_I_max ? +_reflns.observed_criterion_I_min ? +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I -3.0 +_reflns.percent_possible_obs 99.5 +_reflns.R_free_details ? +_reflns.Rmerge_F_all ? +_reflns.Rmerge_F_obs ? +_reflns.Friedel_coverage ? +_reflns.number_gt ? +_reflns.threshold_expression ? +_reflns.pdbx_redundancy 6.8 +_reflns.pdbx_Rmerge_I_obs 0.080 +_reflns.pdbx_Rmerge_I_all ? +_reflns.pdbx_Rsym_value 0.080 +_reflns.pdbx_netI_over_av_sigmaI ? +_reflns.pdbx_netI_over_sigmaI 44.5 +_reflns.pdbx_res_netI_over_av_sigmaI_2 ? +_reflns.pdbx_res_netI_over_sigmaI_2 ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_d_res_high_opt ? +_reflns.pdbx_d_res_low_opt ? +_reflns.pdbx_d_res_opt_method ? +_reflns.phase_calculation_details ? +_reflns.pdbx_Rrim_I_all ? +_reflns.pdbx_Rpim_I_all ? +_reflns.pdbx_d_opt ? +_reflns.pdbx_number_measured_all ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.pdbx_CC_half ? +_reflns.pdbx_R_split ? +# +_reflns_shell.d_res_high 1.00 +_reflns_shell.d_res_low 1.02 +_reflns_shell.meanI_over_sigI_all ? +_reflns_shell.meanI_over_sigI_obs 2.7 +_reflns_shell.number_measured_all ? +_reflns_shell.number_measured_obs ? +_reflns_shell.number_possible ? +_reflns_shell.number_unique_all ? +_reflns_shell.number_unique_obs ? +_reflns_shell.percent_possible_all 97.7 +_reflns_shell.percent_possible_obs ? +_reflns_shell.Rmerge_F_all ? +_reflns_shell.Rmerge_F_obs ? +_reflns_shell.Rmerge_I_all ? +_reflns_shell.Rmerge_I_obs 0.726 +_reflns_shell.meanI_over_sigI_gt ? +_reflns_shell.meanI_over_uI_all ? +_reflns_shell.meanI_over_uI_gt ? +_reflns_shell.number_measured_gt ? +_reflns_shell.number_unique_gt ? +_reflns_shell.percent_possible_gt ? +_reflns_shell.Rmerge_F_gt ? +_reflns_shell.Rmerge_I_gt ? +_reflns_shell.pdbx_redundancy 4.3 +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.pdbx_chi_squared ? +_reflns_shell.pdbx_netI_over_sigmaI_all ? +_reflns_shell.pdbx_netI_over_sigmaI_obs ? +_reflns_shell.pdbx_Rrim_I_all ? +_reflns_shell.pdbx_Rpim_I_all ? +_reflns_shell.pdbx_rejects ? +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.pdbx_CC_half 0.818 +_reflns_shell.pdbx_R_split ? +# +_refine.aniso_B[1][1] 0.03 +_refine.aniso_B[1][2] 0.00 +_refine.aniso_B[1][3] 0.15 +_refine.aniso_B[2][2] -0.07 +_refine.aniso_B[2][3] 0.00 +_refine.aniso_B[3][3] -0.05 +_refine.B_iso_max ? +_refine.B_iso_mean 14.727 +_refine.B_iso_min ? +_refine.correlation_coeff_Fo_to_Fc 0.977 +_refine.correlation_coeff_Fo_to_Fc_free 0.974 +_refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' +_refine.diff_density_max ? +_refine.diff_density_max_esd ? +_refine.diff_density_min ? +_refine.diff_density_min_esd ? +_refine.diff_density_rms ? +_refine.diff_density_rms_esd ? +_refine.entry_id 5SV5 +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.ls_abs_structure_details ? +_refine.ls_abs_structure_Flack ? +_refine.ls_abs_structure_Flack_esd ? +_refine.ls_abs_structure_Rogers ? +_refine.ls_abs_structure_Rogers_esd ? +_refine.ls_d_res_high 1.00 +_refine.ls_d_res_low 29.82 +_refine.ls_extinction_coef ? +_refine.ls_extinction_coef_esd ? +_refine.ls_extinction_expression ? +_refine.ls_extinction_method ? +_refine.ls_goodness_of_fit_all ? +_refine.ls_goodness_of_fit_all_esd ? +_refine.ls_goodness_of_fit_obs ? +_refine.ls_goodness_of_fit_obs_esd ? +_refine.ls_hydrogen_treatment ? +_refine.ls_matrix_type ? +_refine.ls_number_constraints ? +_refine.ls_number_parameters ? +_refine.ls_number_reflns_all ? +_refine.ls_number_reflns_obs 52260 +_refine.ls_number_reflns_R_free 2804 +_refine.ls_number_reflns_R_work ? +_refine.ls_number_restraints ? +_refine.ls_percent_reflns_obs 99.41 +_refine.ls_percent_reflns_R_free 5.1 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.13335 +_refine.ls_R_factor_R_free 0.14813 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_R_factor_R_work 0.13255 +_refine.ls_R_Fsqd_factor_obs ? +_refine.ls_R_I_factor_obs ? +_refine.ls_redundancy_reflns_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_restrained_S_all ? +_refine.ls_restrained_S_obs ? +_refine.ls_shift_over_esd_max ? +_refine.ls_shift_over_esd_mean ? +_refine.ls_structure_factor_coef ? +_refine.ls_weighting_details ? +_refine.ls_weighting_scheme ? +_refine.ls_wR_factor_all ? +_refine.ls_wR_factor_obs ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.solvent_model_details ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.ls_R_factor_gt ? +_refine.ls_goodness_of_fit_gt ? +_refine.ls_goodness_of_fit_ref ? +_refine.ls_shift_over_su_max ? +_refine.ls_shift_over_su_max_lt ? +_refine.ls_shift_over_su_mean ? +_refine.ls_shift_over_su_mean_lt ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F ? +_refine.pdbx_ls_sigma_Fsqd ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.pdbx_method_to_determine_struct SAD +_refine.pdbx_starting_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_overall_ESU_R 0.024 +_refine.pdbx_overall_ESU_R_Free 0.024 +_refine.pdbx_solvent_vdw_probe_radii 1.20 +_refine.pdbx_solvent_ion_probe_radii 0.80 +_refine.pdbx_solvent_shrinkage_radii 0.80 +_refine.pdbx_real_space_R ? +_refine.pdbx_density_correlation ? +_refine.pdbx_pd_number_of_powder_patterns ? +_refine.pdbx_pd_number_of_points ? +_refine.pdbx_pd_meas_number_of_points ? +_refine.pdbx_pd_proc_ls_prof_R_factor ? +_refine.pdbx_pd_proc_ls_prof_wR_factor ? +_refine.pdbx_pd_Marquardt_correlation_coeff ? +_refine.pdbx_pd_Fsqrd_R_factor ? +_refine.pdbx_pd_ls_matrix_band_width ? +_refine.pdbx_overall_phase_error ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_diffrn_id 1 +_refine.overall_SU_B 0.564 +_refine.overall_SU_ML 0.013 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_average_fsc_overall ? +_refine.pdbx_average_fsc_work ? +_refine.pdbx_average_fsc_free ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id 1 +_refine_hist.pdbx_number_atoms_protein 829 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 3 +_refine_hist.number_atoms_solvent 150 +_refine_hist.number_atoms_total 982 +_refine_hist.d_res_high 1.00 +_refine_hist.d_res_low 29.82 +# +loop_ +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.criterion +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.number +_refine_ls_restr.rejects +_refine_ls_restr.type +_refine_ls_restr.weight +_refine_ls_restr.pdbx_restraint_function +'X-RAY DIFFRACTION' ? 0.008 0.019 1131 ? r_bond_refined_d ? ? +'X-RAY DIFFRACTION' ? 0.002 0.020 1002 ? r_bond_other_d ? ? +'X-RAY DIFFRACTION' ? 1.453 1.938 1563 ? r_angle_refined_deg ? ? +'X-RAY DIFFRACTION' ? 0.783 3.000 2327 ? r_angle_other_deg ? ? +'X-RAY DIFFRACTION' ? 5.951 5.000 154 ? r_dihedral_angle_1_deg ? ? +'X-RAY DIFFRACTION' ? 34.303 26.167 60 ? r_dihedral_angle_2_deg ? ? +'X-RAY DIFFRACTION' ? 9.359 15.000 176 ? r_dihedral_angle_3_deg ? ? +'X-RAY DIFFRACTION' ? 1.569 15.000 2 ? r_dihedral_angle_4_deg ? ? +'X-RAY DIFFRACTION' ? 0.088 0.200 158 ? r_chiral_restr ? ? +'X-RAY DIFFRACTION' ? 0.019 0.020 1443 ? r_gen_planes_refined ? ? +'X-RAY DIFFRACTION' ? 0.015 0.020 283 ? r_gen_planes_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_refined ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_other ? ? +'X-RAY DIFFRACTION' ? 0.668 36.470 565 ? r_mcbond_it ? ? +'X-RAY DIFFRACTION' ? 0.673 36.801 563 ? r_mcbond_other ? ? +'X-RAY DIFFRACTION' ? 0.841 ? 736 ? r_mcangle_it ? ? +'X-RAY DIFFRACTION' ? 0.842 ? 737 ? r_mcangle_other ? ? +'X-RAY DIFFRACTION' ? 0.763 ? 566 ? r_scbond_it ? ? +'X-RAY DIFFRACTION' ? 0.761 ? 565 ? r_scbond_other ? ? +'X-RAY DIFFRACTION' ? ? ? ? ? r_scangle_it ? ? +'X-RAY DIFFRACTION' ? 0.993 ? 826 ? r_scangle_other ? ? +'X-RAY DIFFRACTION' ? 2.385 ? 1131 ? r_long_range_B_refined ? ? +'X-RAY DIFFRACTION' ? 1.924 ? 1100 ? r_long_range_B_other ? ? +'X-RAY DIFFRACTION' ? 2.201 3.000 976 ? r_rigid_bond_restr ? ? +'X-RAY DIFFRACTION' ? 19.466 5.000 72 ? r_sphericity_free ? ? +'X-RAY DIFFRACTION' ? 6.304 5.000 979 ? r_sphericity_bonded ? ? +# +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.d_res_high 1.000 +_refine_ls_shell.d_res_low 1.026 +_refine_ls_shell.number_reflns_all ? +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.number_reflns_R_free 203 +_refine_ls_shell.number_reflns_R_work 3778 +_refine_ls_shell.percent_reflns_obs 97.24 +_refine_ls_shell.percent_reflns_R_free ? +_refine_ls_shell.R_factor_all ? +_refine_ls_shell.R_factor_obs ? +_refine_ls_shell.R_factor_R_free 0.322 +_refine_ls_shell.R_factor_R_free_error ? +_refine_ls_shell.R_factor_R_work 0.325 +_refine_ls_shell.redundancy_reflns_all ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.wR_factor_all ? +_refine_ls_shell.wR_factor_obs ? +_refine_ls_shell.wR_factor_R_free ? +_refine_ls_shell.wR_factor_R_work ? +_refine_ls_shell.pdbx_total_number_of_bins_used 20 +_refine_ls_shell.pdbx_phase_error ? +_refine_ls_shell.pdbx_fsc_work ? +_refine_ls_shell.pdbx_fsc_free ? +# +_struct.entry_id 5SV5 +_struct.title +'1.0 Angstrom Crystal Structure of pre-Peptidase C-terminal Domain of Collagenase from Bacillus anthracis.' +_struct.pdbx_model_details ? +_struct.pdbx_formula_weight ? +_struct.pdbx_formula_weight_method ? +_struct.pdbx_model_type_details ? +_struct.pdbx_CASP_flag N +# +_struct_keywords.entry_id 5SV5 +_struct_keywords.text +'Collagenase Structural Genomics, Center for Structural Genomics of Infectious Diseases, CSGID, HYDROLASE' +_struct_keywords.pdbx_keywords HYDROLASE +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 2 ? +D N N 2 ? +E N N 3 ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code Q81YS7_BACAN +_struct_ref.pdbx_db_accession Q81YS7 +_struct_ref.pdbx_db_isoform ? +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code +;NNRPEEANRIGLNTTIKGSLIGGDHTDVYTFNVASAKNIDISVLNEYGIGMTWVLHHESDMQNYAAYGQANGNHIEANFN +AKPGKYYLYVYKYDNGDGTYELSVK +; +_struct_ref.pdbx_align_begin 861 +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 5SV5 +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 1 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 105 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession Q81YS7 +_struct_ref_seq.db_align_beg 861 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 965 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 861 +_struct_ref_seq.pdbx_auth_seq_align_end 965 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_and_software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 390 ? +1 MORE -29 ? +1 'SSA (A^2)' 6180 ? +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +covale1 covale both ? A GLY 50 C ? ? ? 1_555 A MSE 51 N ? ? A GLY 910 A MSE 911 1_555 ? ? ? ? ? ? ? 1.327 ? ? +covale2 covale both ? A MSE 51 C ? ? ? 1_555 A THR 52 N ? ? A MSE 911 A THR 912 1_555 ? ? ? ? ? ? ? 1.324 ? ? +covale3 covale both ? A ASP 60 C ? ? ? 1_555 A MSE 61 N A ? A ASP 920 A MSE 921 1_555 ? ? ? ? ? ? ? 1.331 ? ? +covale4 covale both ? A ASP 60 C ? ? ? 1_555 A MSE 61 N B ? A ASP 920 A MSE 921 1_555 ? ? ? ? ? ? ? 1.326 ? ? +covale5 covale both ? A MSE 61 C A ? ? 1_555 A GLN 62 N A ? A MSE 921 A GLN 922 1_555 ? ? ? ? ? ? ? 1.352 ? ? +covale6 covale both ? A MSE 61 C B ? ? 1_555 A GLN 62 N B ? A MSE 921 A GLN 922 1_555 ? ? ? ? ? ? ? 1.342 ? ? +metalc1 metalc ? ? A GLU 5 OE2 B ? ? 1_555 D NA . NA ? ? A GLU 865 A NA 1003 1_555 ? ? ? ? ? ? ? 2.386 ? ? +metalc2 metalc ? ? A SER 19 O ? ? ? 1_555 B NA . NA ? ? A SER 879 A NA 1001 1_555 ? ? ? ? ? ? ? 2.291 ? ? +metalc3 metalc ? ? A ASP 24 OD2 ? ? ? 1_555 B NA . NA ? ? A ASP 884 A NA 1001 1_555 ? ? ? ? ? ? ? 2.334 ? ? +metalc4 metalc ? ? A ASP 24 OD1 ? ? ? 1_555 D NA . NA ? ? A ASP 884 A NA 1003 1_555 ? ? ? ? ? ? ? 2.270 ? ? +metalc5 metalc ? ? A THR 26 O ? ? ? 1_555 D NA . NA ? ? A THR 886 A NA 1003 1_555 ? ? ? ? ? ? ? 2.357 ? ? +metalc6 metalc ? ? A ASP 27 OD1 ? ? ? 1_555 B NA . NA ? ? A ASP 887 A NA 1001 1_555 ? ? ? ? ? ? ? 2.418 ? ? +metalc7 metalc ? ? A ASP 27 OD2 ? ? ? 1_555 B NA . NA ? ? A ASP 887 A NA 1001 1_555 ? ? ? ? ? ? ? 2.666 ? ? +metalc8 metalc ? ? A ASP 27 OD1 ? ? ? 1_555 D NA . NA ? ? A ASP 887 A NA 1003 1_555 ? ? ? ? ? ? ? 2.271 ? ? +metalc9 metalc ? ? A ASN 73 OD1 ? ? ? 1_555 C NA . NA ? ? A ASN 933 A NA 1002 1_555 ? ? ? ? ? ? ? 2.385 ? ? +metalc10 metalc ? ? B NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1001 A HOH 1178 1_555 ? ? ? ? ? ? ? 2.391 ? ? +metalc11 metalc ? ? B NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1001 A HOH 1209 1_555 ? ? ? ? ? ? ? 2.427 ? ? +metalc12 metalc ? ? C NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1002 A HOH 1174 1_555 ? ? ? ? ? ? ? 2.393 ? ? +metalc13 metalc ? ? C NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1002 A HOH 1208 1_555 ? ? ? ? ? ? ? 2.451 ? ? +metalc14 metalc ? ? C NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1002 A HOH 1227 1_555 ? ? ? ? ? ? ? 2.724 ? ? +metalc15 metalc ? ? C NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1002 A HOH 1228 1_555 ? ? ? ? ? ? ? 2.423 ? ? +metalc16 metalc ? ? C NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1002 A HOH 1249 1_555 ? ? ? ? ? ? ? 2.422 ? ? +metalc17 metalc ? ? D NA . NA ? ? ? 1_555 E HOH . O A ? A NA 1003 A HOH 1203 1_555 ? ? ? ? ? ? ? 2.408 ? ? +metalc18 metalc ? ? D NA . NA ? ? ? 1_555 E HOH . O ? ? A NA 1003 A HOH 1216 1_555 ? ? ? ? ? ? ? 2.417 ? ? +# +loop_ +_struct_conn_type.id +_struct_conn_type.criteria +_struct_conn_type.reference +covale ? ? +metalc ? ? +# +loop_ +_pdbx_struct_conn_angle.id +_pdbx_struct_conn_angle.ptnr1_label_atom_id +_pdbx_struct_conn_angle.ptnr1_label_alt_id +_pdbx_struct_conn_angle.ptnr1_label_asym_id +_pdbx_struct_conn_angle.ptnr1_label_comp_id +_pdbx_struct_conn_angle.ptnr1_label_seq_id +_pdbx_struct_conn_angle.ptnr1_auth_atom_id +_pdbx_struct_conn_angle.ptnr1_auth_asym_id +_pdbx_struct_conn_angle.ptnr1_auth_comp_id +_pdbx_struct_conn_angle.ptnr1_auth_seq_id +_pdbx_struct_conn_angle.ptnr1_PDB_ins_code +_pdbx_struct_conn_angle.ptnr1_symmetry +_pdbx_struct_conn_angle.ptnr2_label_atom_id +_pdbx_struct_conn_angle.ptnr2_label_alt_id +_pdbx_struct_conn_angle.ptnr2_label_asym_id +_pdbx_struct_conn_angle.ptnr2_label_comp_id +_pdbx_struct_conn_angle.ptnr2_label_seq_id +_pdbx_struct_conn_angle.ptnr2_auth_atom_id +_pdbx_struct_conn_angle.ptnr2_auth_asym_id +_pdbx_struct_conn_angle.ptnr2_auth_comp_id +_pdbx_struct_conn_angle.ptnr2_auth_seq_id +_pdbx_struct_conn_angle.ptnr2_PDB_ins_code +_pdbx_struct_conn_angle.ptnr2_symmetry +_pdbx_struct_conn_angle.ptnr3_label_atom_id +_pdbx_struct_conn_angle.ptnr3_label_alt_id +_pdbx_struct_conn_angle.ptnr3_label_asym_id +_pdbx_struct_conn_angle.ptnr3_label_comp_id +_pdbx_struct_conn_angle.ptnr3_label_seq_id +_pdbx_struct_conn_angle.ptnr3_auth_atom_id +_pdbx_struct_conn_angle.ptnr3_auth_asym_id +_pdbx_struct_conn_angle.ptnr3_auth_comp_id +_pdbx_struct_conn_angle.ptnr3_auth_seq_id +_pdbx_struct_conn_angle.ptnr3_PDB_ins_code +_pdbx_struct_conn_angle.ptnr3_symmetry +_pdbx_struct_conn_angle.value +_pdbx_struct_conn_angle.value_esd +1 OE2 B A GLU 5 ? A GLU 865 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 OD1 ? A ASP 24 ? A ASP 884 ? 1_555 137.8 ? +2 OE2 B A GLU 5 ? A GLU 865 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? A THR 26 ? A THR 886 ? 1_555 86.4 ? +3 OD1 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? A THR 26 ? A THR 886 ? 1_555 97.0 ? +4 OE2 B A GLU 5 ? A GLU 865 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 112.9 ? +5 OD1 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 109.2 ? +6 O ? A THR 26 ? A THR 886 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 89.1 ? +7 OE2 B A GLU 5 ? A GLU 865 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O A E HOH . ? A HOH 1203 ? 1_555 7.6 ? +8 OD1 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O A E HOH . ? A HOH 1203 ? 1_555 140.0 ? +9 O ? A THR 26 ? A THR 886 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O A E HOH . ? A HOH 1203 ? 1_555 79.1 ? +10 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O A E HOH . ? A HOH 1203 ? 1_555 110.4 ? +11 OE2 B A GLU 5 ? A GLU 865 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? E HOH . ? A HOH 1216 ? 1_555 84.3 ? +12 OD1 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? E HOH . ? A HOH 1216 ? 1_555 90.3 ? +13 O ? A THR 26 ? A THR 886 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? E HOH . ? A HOH 1216 ? 1_555 170.7 ? +14 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? E HOH . ? A HOH 1216 ? 1_555 93.9 ? +15 O A E HOH . ? A HOH 1203 ? 1_555 NA ? D NA . ? A NA 1003 ? 1_555 O ? E HOH . ? A HOH 1216 ? 1_555 91.6 ? +16 O ? A SER 19 ? A SER 879 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 OD2 ? A ASP 24 ? A ASP 884 ? 1_555 86.9 ? +17 O ? A SER 19 ? A SER 879 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 122.2 ? +18 OD2 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 104.0 ? +19 O ? A SER 19 ? A SER 879 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 OD2 ? A ASP 27 ? A ASP 887 ? 1_555 87.2 ? +20 OD2 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 OD2 ? A ASP 27 ? A ASP 887 ? 1_555 142.4 ? +21 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 OD2 ? A ASP 27 ? A ASP 887 ? 1_555 50.4 ? +22 O ? A SER 19 ? A SER 879 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1178 ? 1_555 89.6 ? +23 OD2 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1178 ? 1_555 144.6 ? +24 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1178 ? 1_555 107.6 ? +25 OD2 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1178 ? 1_555 72.4 ? +26 O ? A SER 19 ? A SER 879 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1209 ? 1_555 127.1 ? +27 OD2 ? A ASP 24 ? A ASP 884 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1209 ? 1_555 81.5 ? +28 OD1 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1209 ? 1_555 110.7 ? +29 OD2 ? A ASP 27 ? A ASP 887 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1209 ? 1_555 129.9 ? +30 O ? E HOH . ? A HOH 1178 ? 1_555 NA ? B NA . ? A NA 1001 ? 1_555 O ? E HOH . ? A HOH 1209 ? 1_555 72.8 ? +31 OD1 ? A ASN 73 ? A ASN 933 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1174 ? 1_555 80.3 ? +32 OD1 ? A ASN 73 ? A ASN 933 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1208 ? 1_555 82.6 ? +33 O ? E HOH . ? A HOH 1174 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1208 ? 1_555 97.6 ? +34 OD1 ? A ASN 73 ? A ASN 933 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1227 ? 1_555 89.4 ? +35 O ? E HOH . ? A HOH 1174 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1227 ? 1_555 169.7 ? +36 O ? E HOH . ? A HOH 1208 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1227 ? 1_555 81.4 ? +37 OD1 ? A ASN 73 ? A ASN 933 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1228 ? 1_555 97.5 ? +38 O ? E HOH . ? A HOH 1174 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1228 ? 1_555 96.7 ? +39 O ? E HOH . ? A HOH 1208 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1228 ? 1_555 165.6 ? +40 O ? E HOH . ? A HOH 1227 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1228 ? 1_555 84.2 ? +41 OD1 ? A ASN 73 ? A ASN 933 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1249 ? 1_555 173.2 ? +42 O ? E HOH . ? A HOH 1174 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1249 ? 1_555 97.0 ? +43 O ? E HOH . ? A HOH 1208 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1249 ? 1_555 91.7 ? +44 O ? E HOH . ? A HOH 1227 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1249 ? 1_555 93.3 ? +45 O ? E HOH . ? A HOH 1228 ? 1_555 NA ? C NA . ? A NA 1002 ? 1_555 O ? E HOH . ? A HOH 1249 ? 1_555 88.9 ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 MSE A 51 ? . . . . MSE A 911 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +2 MSE A 61 A . . . . MSE A 921 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +3 MSE A 61 B . . . . MSE A 921 ? 1_555 . . . . . . . MET 1 MSE Selenomethionine 'Named protein modification' +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +AA1 ? 5 ? +AA2 ? 5 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +AA1 1 2 ? parallel +AA1 2 3 ? anti-parallel +AA1 3 4 ? anti-parallel +AA1 4 5 ? anti-parallel +AA2 1 2 ? anti-parallel +AA2 2 3 ? anti-parallel +AA2 3 4 ? anti-parallel +AA2 4 5 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA1 1 ASN A 8 ? ARG A 9 ? ASN A 868 ARG A 869 +AA1 2 THR A 26 ? VAL A 33 ? THR A 886 VAL A 893 +AA1 3 GLY A 84 ? LYS A 92 ? GLY A 944 LYS A 952 +AA1 4 MSE A 51 ? HIS A 57 ? MSE A 911 HIS A 917 +AA1 5 ALA A 66 ? TYR A 67 ? ALA A 926 TYR A 927 +AA2 1 THR A 14 ? LEU A 20 ? THR A 874 LEU A 880 +AA2 2 GLY A 98 ? VAL A 104 ? GLY A 958 VAL A 964 +AA2 3 LYS A 37 ? ASN A 45 ? LYS A 897 ASN A 905 +AA2 4 HIS A 74 ? ALA A 81 ? HIS A 934 ALA A 941 +AA2 5 GLN A 69 ? ASN A 71 ? GLN A 929 ASN A 931 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +AA1 1 2 N ASN A 8 ? N ASN A 868 O VAL A 28 ? O VAL A 888 +AA1 2 3 N TYR A 29 ? N TYR A 889 O LEU A 88 ? O LEU A 948 +AA1 3 4 O TYR A 89 ? O TYR A 949 N VAL A 54 ? N VAL A 914 +AA1 4 5 N LEU A 55 ? N LEU A 915 O ALA A 66 ? O ALA A 926 +AA2 1 2 N ILE A 16 ? N ILE A 876 O LEU A 102 ? O LEU A 962 +AA2 2 3 O SER A 103 ? O SER A 963 N SER A 42 ? N SER A 902 +AA2 3 4 N LYS A 37 ? N LYS A 897 O ALA A 81 ? O ALA A 941 +AA2 4 5 O HIS A 74 ? O HIS A 934 N ASN A 71 ? N ASN A 931 +# +loop_ +_struct_site.id +_struct_site.pdbx_evidence_code +_struct_site.pdbx_auth_asym_id +_struct_site.pdbx_auth_comp_id +_struct_site.pdbx_auth_seq_id +_struct_site.pdbx_auth_ins_code +_struct_site.pdbx_num_residues +_struct_site.details +AC1 Software A NA 1001 ? 6 'binding site for residue NA A 1001' +AC2 Software A NA 1002 ? 6 'binding site for residue NA A 1002' +AC3 Software A NA 1003 ? 7 'binding site for residue NA A 1003' +# +loop_ +_struct_site_gen.id +_struct_site_gen.site_id +_struct_site_gen.pdbx_num_res +_struct_site_gen.label_comp_id +_struct_site_gen.label_asym_id +_struct_site_gen.label_seq_id +_struct_site_gen.pdbx_auth_ins_code +_struct_site_gen.auth_comp_id +_struct_site_gen.auth_asym_id +_struct_site_gen.auth_seq_id +_struct_site_gen.label_atom_id +_struct_site_gen.label_alt_id +_struct_site_gen.symmetry +_struct_site_gen.details +1 AC1 6 SER A 19 ? SER A 879 . ? 1_555 ? +2 AC1 6 ASP A 24 ? ASP A 884 . ? 1_555 ? +3 AC1 6 ASP A 27 ? ASP A 887 . ? 1_555 ? +4 AC1 6 NA D . ? NA A 1003 . ? 1_555 ? +5 AC1 6 HOH E . ? HOH A 1178 . ? 1_555 ? +6 AC1 6 HOH E . ? HOH A 1209 . ? 1_555 ? +7 AC2 6 ASN A 73 ? ASN A 933 . ? 1_555 ? +8 AC2 6 HOH E . ? HOH A 1174 . ? 1_555 ? +9 AC2 6 HOH E . ? HOH A 1208 . ? 1_555 ? +10 AC2 6 HOH E . ? HOH A 1227 . ? 1_555 ? +11 AC2 6 HOH E . ? HOH A 1228 . ? 1_555 ? +12 AC2 6 HOH E . ? HOH A 1249 . ? 1_555 ? +13 AC3 7 GLU A 5 ? GLU A 865 . ? 1_555 ? +14 AC3 7 ASP A 24 ? ASP A 884 . ? 1_555 ? +15 AC3 7 THR A 26 ? THR A 886 . ? 1_555 ? +16 AC3 7 ASP A 27 ? ASP A 887 . ? 1_555 ? +17 AC3 7 NA B . ? NA A 1001 . ? 1_555 ? +18 AC3 7 HOH E . ? HOH A 1203 . ? 1_555 ? +19 AC3 7 HOH E . ? HOH A 1216 . ? 1_555 ? +# +_pdbx_entry_details.entry_id 5SV5 +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_ligand_of_interest ? +_pdbx_entry_details.has_protein_modification Y +# +_pdbx_validate_torsion.id 1 +_pdbx_validate_torsion.PDB_model_num 1 +_pdbx_validate_torsion.auth_comp_id ASN +_pdbx_validate_torsion.auth_asym_id A +_pdbx_validate_torsion.auth_seq_id 873 +_pdbx_validate_torsion.PDB_ins_code ? +_pdbx_validate_torsion.label_alt_id B +_pdbx_validate_torsion.phi 70.96 +_pdbx_validate_torsion.psi 44.01 +# +_pdbx_SG_project.id 1 +_pdbx_SG_project.project_name 'NIAID, National Institute of Allergy and Infectious Diseases' +_pdbx_SG_project.full_name_of_center 'Center for Structural Genomics of Infectious Diseases' +_pdbx_SG_project.initial_of_center CSGID +# +loop_ +_pdbx_struct_mod_residue.id +_pdbx_struct_mod_residue.label_asym_id +_pdbx_struct_mod_residue.label_comp_id +_pdbx_struct_mod_residue.label_seq_id +_pdbx_struct_mod_residue.auth_asym_id +_pdbx_struct_mod_residue.auth_comp_id +_pdbx_struct_mod_residue.auth_seq_id +_pdbx_struct_mod_residue.PDB_ins_code +_pdbx_struct_mod_residue.parent_comp_id +_pdbx_struct_mod_residue.details +1 A MSE 51 A MSE 911 ? MET 'modified residue' +2 A MSE 61 A MSE 921 ? MET 'modified residue' +# +loop_ +_pdbx_refine_tls.pdbx_refine_id +_pdbx_refine_tls.id +_pdbx_refine_tls.details +_pdbx_refine_tls.method +_pdbx_refine_tls.origin_x +_pdbx_refine_tls.origin_y +_pdbx_refine_tls.origin_z +_pdbx_refine_tls.T[1][1] +_pdbx_refine_tls.T[2][2] +_pdbx_refine_tls.T[3][3] +_pdbx_refine_tls.T[1][2] +_pdbx_refine_tls.T[1][3] +_pdbx_refine_tls.T[2][3] +_pdbx_refine_tls.L[1][1] +_pdbx_refine_tls.L[2][2] +_pdbx_refine_tls.L[3][3] +_pdbx_refine_tls.L[1][2] +_pdbx_refine_tls.L[1][3] +_pdbx_refine_tls.L[2][3] +_pdbx_refine_tls.S[1][1] +_pdbx_refine_tls.S[1][2] +_pdbx_refine_tls.S[1][3] +_pdbx_refine_tls.S[2][1] +_pdbx_refine_tls.S[2][2] +_pdbx_refine_tls.S[2][3] +_pdbx_refine_tls.S[3][1] +_pdbx_refine_tls.S[3][2] +_pdbx_refine_tls.S[3][3] +'X-RAY DIFFRACTION' 1 ? refined 7.6348 3.6011 21.0376 0.0650 0.0688 0.0450 -0.0027 -0.0111 0.0236 0.3512 1.0285 9.6848 -0.5899 +1.8071 -3.1367 0.0267 0.0604 -0.0009 0.0010 -0.0882 -0.0058 -0.0149 0.3552 0.0616 +'X-RAY DIFFRACTION' 2 ? refined -0.5491 5.2022 4.2001 0.0576 0.0222 0.0802 -0.0096 0.0015 -0.0137 0.1094 0.6686 3.3922 -0.2670 +-0.0091 0.2543 -0.0220 0.0124 -0.0111 0.0531 -0.0211 0.0246 0.0538 0.0654 0.0431 +'X-RAY DIFFRACTION' 3 ? refined 2.3948 8.6458 12.0083 0.0272 0.0019 0.0343 -0.0004 -0.0034 0.0022 2.8830 0.2219 3.7717 -0.2740 +-3.0156 0.5214 -0.0005 0.0365 -0.0944 0.0195 -0.0047 -0.0180 -0.0244 -0.0359 0.0052 +'X-RAY DIFFRACTION' 4 ? refined 3.6757 16.5255 8.1432 0.0092 0.0063 0.0469 -0.0016 -0.0037 0.0003 0.6587 0.4223 0.6771 -0.0661 +-0.0397 0.1501 0.0287 -0.0369 0.0227 -0.0197 -0.0012 -0.0482 -0.0172 0.0505 -0.0274 +'X-RAY DIFFRACTION' 5 ? refined -2.4038 21.2062 4.6370 0.0260 0.0024 0.0336 0.0017 -0.0028 0.0013 3.4697 0.6606 2.1413 -0.5733 +-1.4040 -0.2118 0.0060 0.0206 0.0388 -0.0584 0.0209 -0.0027 0.0024 -0.0566 -0.0269 +'X-RAY DIFFRACTION' 6 ? refined 7.7400 12.4445 8.6860 0.0073 0.0057 0.0389 -0.0022 -0.0088 -0.0011 2.9007 0.6328 3.2948 -0.8063 +-2.6231 1.0338 0.0223 -0.0337 -0.0581 0.0164 0.0233 -0.0520 -0.0271 0.0940 -0.0456 +'X-RAY DIFFRACTION' 7 ? refined -5.1721 13.1566 12.0776 0.0154 0.0030 0.0446 0.0032 -0.0114 0.0014 1.2541 1.5493 2.9804 -0.1386 +-1.0743 0.7122 -0.0597 -0.0180 -0.0582 -0.0091 0.0243 -0.0146 -0.0329 -0.0420 0.0353 +# +loop_ +_pdbx_refine_tls_group.pdbx_refine_id +_pdbx_refine_tls_group.id +_pdbx_refine_tls_group.refine_tls_id +_pdbx_refine_tls_group.beg_auth_asym_id +_pdbx_refine_tls_group.beg_auth_seq_id +_pdbx_refine_tls_group.beg_label_asym_id +_pdbx_refine_tls_group.beg_label_seq_id +_pdbx_refine_tls_group.end_auth_asym_id +_pdbx_refine_tls_group.end_auth_seq_id +_pdbx_refine_tls_group.end_label_asym_id +_pdbx_refine_tls_group.end_label_seq_id +_pdbx_refine_tls_group.selection +_pdbx_refine_tls_group.selection_details +'X-RAY DIFFRACTION' 1 1 A 861 ? ? A 868 ? ? ? ? +'X-RAY DIFFRACTION' 2 2 A 869 ? ? A 878 ? ? ? ? +'X-RAY DIFFRACTION' 3 3 A 879 ? ? A 895 ? ? ? ? +'X-RAY DIFFRACTION' 4 4 A 896 ? ? A 927 ? ? ? ? +'X-RAY DIFFRACTION' 5 5 A 928 ? ? A 940 ? ? ? ? +'X-RAY DIFFRACTION' 6 6 A 941 ? ? A 952 ? ? ? ? +'X-RAY DIFFRACTION' 7 7 A 953 ? ? A 965 ? ? ? ? +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +GLN N N N N 74 +GLN CA C N S 75 +GLN C C N N 76 +GLN O O N N 77 +GLN CB C N N 78 +GLN CG C N N 79 +GLN CD C N N 80 +GLN OE1 O N N 81 +GLN NE2 N N N 82 +GLN OXT O N N 83 +GLN H H N N 84 +GLN H2 H N N 85 +GLN HA H N N 86 +GLN HB2 H N N 87 +GLN HB3 H N N 88 +GLN HG2 H N N 89 +GLN HG3 H N N 90 +GLN HE21 H N N 91 +GLN HE22 H N N 92 +GLN HXT H N N 93 +GLU N N N N 94 +GLU CA C N S 95 +GLU C C N N 96 +GLU O O N N 97 +GLU CB C N N 98 +GLU CG C N N 99 +GLU CD C N N 100 +GLU OE1 O N N 101 +GLU OE2 O N N 102 +GLU OXT O N N 103 +GLU H H N N 104 +GLU H2 H N N 105 +GLU HA H N N 106 +GLU HB2 H N N 107 +GLU HB3 H N N 108 +GLU HG2 H N N 109 +GLU HG3 H N N 110 +GLU HE2 H N N 111 +GLU HXT H N N 112 +GLY N N N N 113 +GLY CA C N N 114 +GLY C C N N 115 +GLY O O N N 116 +GLY OXT O N N 117 +GLY H H N N 118 +GLY H2 H N N 119 +GLY HA2 H N N 120 +GLY HA3 H N N 121 +GLY HXT H N N 122 +HIS N N N N 123 +HIS CA C N S 124 +HIS C C N N 125 +HIS O O N N 126 +HIS CB C N N 127 +HIS CG C Y N 128 +HIS ND1 N Y N 129 +HIS CD2 C Y N 130 +HIS CE1 C Y N 131 +HIS NE2 N Y N 132 +HIS OXT O N N 133 +HIS H H N N 134 +HIS H2 H N N 135 +HIS HA H N N 136 +HIS HB2 H N N 137 +HIS HB3 H N N 138 +HIS HD1 H N N 139 +HIS HD2 H N N 140 +HIS HE1 H N N 141 +HIS HE2 H N N 142 +HIS HXT H N N 143 +HOH O O N N 144 +HOH H1 H N N 145 +HOH H2 H N N 146 +ILE N N N N 147 +ILE CA C N S 148 +ILE C C N N 149 +ILE O O N N 150 +ILE CB C N S 151 +ILE CG1 C N N 152 +ILE CG2 C N N 153 +ILE CD1 C N N 154 +ILE OXT O N N 155 +ILE H H N N 156 +ILE H2 H N N 157 +ILE HA H N N 158 +ILE HB H N N 159 +ILE HG12 H N N 160 +ILE HG13 H N N 161 +ILE HG21 H N N 162 +ILE HG22 H N N 163 +ILE HG23 H N N 164 +ILE HD11 H N N 165 +ILE HD12 H N N 166 +ILE HD13 H N N 167 +ILE HXT H N N 168 +LEU N N N N 169 +LEU CA C N S 170 +LEU C C N N 171 +LEU O O N N 172 +LEU CB C N N 173 +LEU CG C N N 174 +LEU CD1 C N N 175 +LEU CD2 C N N 176 +LEU OXT O N N 177 +LEU H H N N 178 +LEU H2 H N N 179 +LEU HA H N N 180 +LEU HB2 H N N 181 +LEU HB3 H N N 182 +LEU HG H N N 183 +LEU HD11 H N N 184 +LEU HD12 H N N 185 +LEU HD13 H N N 186 +LEU HD21 H N N 187 +LEU HD22 H N N 188 +LEU HD23 H N N 189 +LEU HXT H N N 190 +LYS N N N N 191 +LYS CA C N S 192 +LYS C C N N 193 +LYS O O N N 194 +LYS CB C N N 195 +LYS CG C N N 196 +LYS CD C N N 197 +LYS CE C N N 198 +LYS NZ N N N 199 +LYS OXT O N N 200 +LYS H H N N 201 +LYS H2 H N N 202 +LYS HA H N N 203 +LYS HB2 H N N 204 +LYS HB3 H N N 205 +LYS HG2 H N N 206 +LYS HG3 H N N 207 +LYS HD2 H N N 208 +LYS HD3 H N N 209 +LYS HE2 H N N 210 +LYS HE3 H N N 211 +LYS HZ1 H N N 212 +LYS HZ2 H N N 213 +LYS HZ3 H N N 214 +LYS HXT H N N 215 +MSE N N N N 216 +MSE CA C N S 217 +MSE C C N N 218 +MSE O O N N 219 +MSE OXT O N N 220 +MSE CB C N N 221 +MSE CG C N N 222 +MSE SE SE N N 223 +MSE CE C N N 224 +MSE H H N N 225 +MSE H2 H N N 226 +MSE HA H N N 227 +MSE HXT H N N 228 +MSE HB2 H N N 229 +MSE HB3 H N N 230 +MSE HG2 H N N 231 +MSE HG3 H N N 232 +MSE HE1 H N N 233 +MSE HE2 H N N 234 +MSE HE3 H N N 235 +NA NA NA N N 236 +PHE N N N N 237 +PHE CA C N S 238 +PHE C C N N 239 +PHE O O N N 240 +PHE CB C N N 241 +PHE CG C Y N 242 +PHE CD1 C Y N 243 +PHE CD2 C Y N 244 +PHE CE1 C Y N 245 +PHE CE2 C Y N 246 +PHE CZ C Y N 247 +PHE OXT O N N 248 +PHE H H N N 249 +PHE H2 H N N 250 +PHE HA H N N 251 +PHE HB2 H N N 252 +PHE HB3 H N N 253 +PHE HD1 H N N 254 +PHE HD2 H N N 255 +PHE HE1 H N N 256 +PHE HE2 H N N 257 +PHE HZ H N N 258 +PHE HXT H N N 259 +PRO N N N N 260 +PRO CA C N S 261 +PRO C C N N 262 +PRO O O N N 263 +PRO CB C N N 264 +PRO CG C N N 265 +PRO CD C N N 266 +PRO OXT O N N 267 +PRO H H N N 268 +PRO HA H N N 269 +PRO HB2 H N N 270 +PRO HB3 H N N 271 +PRO HG2 H N N 272 +PRO HG3 H N N 273 +PRO HD2 H N N 274 +PRO HD3 H N N 275 +PRO HXT H N N 276 +SER N N N N 277 +SER CA C N S 278 +SER C C N N 279 +SER O O N N 280 +SER CB C N N 281 +SER OG O N N 282 +SER OXT O N N 283 +SER H H N N 284 +SER H2 H N N 285 +SER HA H N N 286 +SER HB2 H N N 287 +SER HB3 H N N 288 +SER HG H N N 289 +SER HXT H N N 290 +THR N N N N 291 +THR CA C N S 292 +THR C C N N 293 +THR O O N N 294 +THR CB C N R 295 +THR OG1 O N N 296 +THR CG2 C N N 297 +THR OXT O N N 298 +THR H H N N 299 +THR H2 H N N 300 +THR HA H N N 301 +THR HB H N N 302 +THR HG1 H N N 303 +THR HG21 H N N 304 +THR HG22 H N N 305 +THR HG23 H N N 306 +THR HXT H N N 307 +TRP N N N N 308 +TRP CA C N S 309 +TRP C C N N 310 +TRP O O N N 311 +TRP CB C N N 312 +TRP CG C Y N 313 +TRP CD1 C Y N 314 +TRP CD2 C Y N 315 +TRP NE1 N Y N 316 +TRP CE2 C Y N 317 +TRP CE3 C Y N 318 +TRP CZ2 C Y N 319 +TRP CZ3 C Y N 320 +TRP CH2 C Y N 321 +TRP OXT O N N 322 +TRP H H N N 323 +TRP H2 H N N 324 +TRP HA H N N 325 +TRP HB2 H N N 326 +TRP HB3 H N N 327 +TRP HD1 H N N 328 +TRP HE1 H N N 329 +TRP HE3 H N N 330 +TRP HZ2 H N N 331 +TRP HZ3 H N N 332 +TRP HH2 H N N 333 +TRP HXT H N N 334 +TYR N N N N 335 +TYR CA C N S 336 +TYR C C N N 337 +TYR O O N N 338 +TYR CB C N N 339 +TYR CG C Y N 340 +TYR CD1 C Y N 341 +TYR CD2 C Y N 342 +TYR CE1 C Y N 343 +TYR CE2 C Y N 344 +TYR CZ C Y N 345 +TYR OH O N N 346 +TYR OXT O N N 347 +TYR H H N N 348 +TYR H2 H N N 349 +TYR HA H N N 350 +TYR HB2 H N N 351 +TYR HB3 H N N 352 +TYR HD1 H N N 353 +TYR HD2 H N N 354 +TYR HE1 H N N 355 +TYR HE2 H N N 356 +TYR HH H N N 357 +TYR HXT H N N 358 +VAL N N N N 359 +VAL CA C N S 360 +VAL C C N N 361 +VAL O O N N 362 +VAL CB C N N 363 +VAL CG1 C N N 364 +VAL CG2 C N N 365 +VAL OXT O N N 366 +VAL H H N N 367 +VAL H2 H N N 368 +VAL HA H N N 369 +VAL HB H N N 370 +VAL HG11 H N N 371 +VAL HG12 H N N 372 +VAL HG13 H N N 373 +VAL HG21 H N N 374 +VAL HG22 H N N 375 +VAL HG23 H N N 376 +VAL HXT H N N 377 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +GLN N CA sing N N 70 +GLN N H sing N N 71 +GLN N H2 sing N N 72 +GLN CA C sing N N 73 +GLN CA CB sing N N 74 +GLN CA HA sing N N 75 +GLN C O doub N N 76 +GLN C OXT sing N N 77 +GLN CB CG sing N N 78 +GLN CB HB2 sing N N 79 +GLN CB HB3 sing N N 80 +GLN CG CD sing N N 81 +GLN CG HG2 sing N N 82 +GLN CG HG3 sing N N 83 +GLN CD OE1 doub N N 84 +GLN CD NE2 sing N N 85 +GLN NE2 HE21 sing N N 86 +GLN NE2 HE22 sing N N 87 +GLN OXT HXT sing N N 88 +GLU N CA sing N N 89 +GLU N H sing N N 90 +GLU N H2 sing N N 91 +GLU CA C sing N N 92 +GLU CA CB sing N N 93 +GLU CA HA sing N N 94 +GLU C O doub N N 95 +GLU C OXT sing N N 96 +GLU CB CG sing N N 97 +GLU CB HB2 sing N N 98 +GLU CB HB3 sing N N 99 +GLU CG CD sing N N 100 +GLU CG HG2 sing N N 101 +GLU CG HG3 sing N N 102 +GLU CD OE1 doub N N 103 +GLU CD OE2 sing N N 104 +GLU OE2 HE2 sing N N 105 +GLU OXT HXT sing N N 106 +GLY N CA sing N N 107 +GLY N H sing N N 108 +GLY N H2 sing N N 109 +GLY CA C sing N N 110 +GLY CA HA2 sing N N 111 +GLY CA HA3 sing N N 112 +GLY C O doub N N 113 +GLY C OXT sing N N 114 +GLY OXT HXT sing N N 115 +HIS N CA sing N N 116 +HIS N H sing N N 117 +HIS N H2 sing N N 118 +HIS CA C sing N N 119 +HIS CA CB sing N N 120 +HIS CA HA sing N N 121 +HIS C O doub N N 122 +HIS C OXT sing N N 123 +HIS CB CG sing N N 124 +HIS CB HB2 sing N N 125 +HIS CB HB3 sing N N 126 +HIS CG ND1 sing Y N 127 +HIS CG CD2 doub Y N 128 +HIS ND1 CE1 doub Y N 129 +HIS ND1 HD1 sing N N 130 +HIS CD2 NE2 sing Y N 131 +HIS CD2 HD2 sing N N 132 +HIS CE1 NE2 sing Y N 133 +HIS CE1 HE1 sing N N 134 +HIS NE2 HE2 sing N N 135 +HIS OXT HXT sing N N 136 +HOH O H1 sing N N 137 +HOH O H2 sing N N 138 +ILE N CA sing N N 139 +ILE N H sing N N 140 +ILE N H2 sing N N 141 +ILE CA C sing N N 142 +ILE CA CB sing N N 143 +ILE CA HA sing N N 144 +ILE C O doub N N 145 +ILE C OXT sing N N 146 +ILE CB CG1 sing N N 147 +ILE CB CG2 sing N N 148 +ILE CB HB sing N N 149 +ILE CG1 CD1 sing N N 150 +ILE CG1 HG12 sing N N 151 +ILE CG1 HG13 sing N N 152 +ILE CG2 HG21 sing N N 153 +ILE CG2 HG22 sing N N 154 +ILE CG2 HG23 sing N N 155 +ILE CD1 HD11 sing N N 156 +ILE CD1 HD12 sing N N 157 +ILE CD1 HD13 sing N N 158 +ILE OXT HXT sing N N 159 +LEU N CA sing N N 160 +LEU N H sing N N 161 +LEU N H2 sing N N 162 +LEU CA C sing N N 163 +LEU CA CB sing N N 164 +LEU CA HA sing N N 165 +LEU C O doub N N 166 +LEU C OXT sing N N 167 +LEU CB CG sing N N 168 +LEU CB HB2 sing N N 169 +LEU CB HB3 sing N N 170 +LEU CG CD1 sing N N 171 +LEU CG CD2 sing N N 172 +LEU CG HG sing N N 173 +LEU CD1 HD11 sing N N 174 +LEU CD1 HD12 sing N N 175 +LEU CD1 HD13 sing N N 176 +LEU CD2 HD21 sing N N 177 +LEU CD2 HD22 sing N N 178 +LEU CD2 HD23 sing N N 179 +LEU OXT HXT sing N N 180 +LYS N CA sing N N 181 +LYS N H sing N N 182 +LYS N H2 sing N N 183 +LYS CA C sing N N 184 +LYS CA CB sing N N 185 +LYS CA HA sing N N 186 +LYS C O doub N N 187 +LYS C OXT sing N N 188 +LYS CB CG sing N N 189 +LYS CB HB2 sing N N 190 +LYS CB HB3 sing N N 191 +LYS CG CD sing N N 192 +LYS CG HG2 sing N N 193 +LYS CG HG3 sing N N 194 +LYS CD CE sing N N 195 +LYS CD HD2 sing N N 196 +LYS CD HD3 sing N N 197 +LYS CE NZ sing N N 198 +LYS CE HE2 sing N N 199 +LYS CE HE3 sing N N 200 +LYS NZ HZ1 sing N N 201 +LYS NZ HZ2 sing N N 202 +LYS NZ HZ3 sing N N 203 +LYS OXT HXT sing N N 204 +MSE N CA sing N N 205 +MSE N H sing N N 206 +MSE N H2 sing N N 207 +MSE CA C sing N N 208 +MSE CA CB sing N N 209 +MSE CA HA sing N N 210 +MSE C O doub N N 211 +MSE C OXT sing N N 212 +MSE OXT HXT sing N N 213 +MSE CB CG sing N N 214 +MSE CB HB2 sing N N 215 +MSE CB HB3 sing N N 216 +MSE CG SE sing N N 217 +MSE CG HG2 sing N N 218 +MSE CG HG3 sing N N 219 +MSE SE CE sing N N 220 +MSE CE HE1 sing N N 221 +MSE CE HE2 sing N N 222 +MSE CE HE3 sing N N 223 +PHE N CA sing N N 224 +PHE N H sing N N 225 +PHE N H2 sing N N 226 +PHE CA C sing N N 227 +PHE CA CB sing N N 228 +PHE CA HA sing N N 229 +PHE C O doub N N 230 +PHE C OXT sing N N 231 +PHE CB CG sing N N 232 +PHE CB HB2 sing N N 233 +PHE CB HB3 sing N N 234 +PHE CG CD1 doub Y N 235 +PHE CG CD2 sing Y N 236 +PHE CD1 CE1 sing Y N 237 +PHE CD1 HD1 sing N N 238 +PHE CD2 CE2 doub Y N 239 +PHE CD2 HD2 sing N N 240 +PHE CE1 CZ doub Y N 241 +PHE CE1 HE1 sing N N 242 +PHE CE2 CZ sing Y N 243 +PHE CE2 HE2 sing N N 244 +PHE CZ HZ sing N N 245 +PHE OXT HXT sing N N 246 +PRO N CA sing N N 247 +PRO N CD sing N N 248 +PRO N H sing N N 249 +PRO CA C sing N N 250 +PRO CA CB sing N N 251 +PRO CA HA sing N N 252 +PRO C O doub N N 253 +PRO C OXT sing N N 254 +PRO CB CG sing N N 255 +PRO CB HB2 sing N N 256 +PRO CB HB3 sing N N 257 +PRO CG CD sing N N 258 +PRO CG HG2 sing N N 259 +PRO CG HG3 sing N N 260 +PRO CD HD2 sing N N 261 +PRO CD HD3 sing N N 262 +PRO OXT HXT sing N N 263 +SER N CA sing N N 264 +SER N H sing N N 265 +SER N H2 sing N N 266 +SER CA C sing N N 267 +SER CA CB sing N N 268 +SER CA HA sing N N 269 +SER C O doub N N 270 +SER C OXT sing N N 271 +SER CB OG sing N N 272 +SER CB HB2 sing N N 273 +SER CB HB3 sing N N 274 +SER OG HG sing N N 275 +SER OXT HXT sing N N 276 +THR N CA sing N N 277 +THR N H sing N N 278 +THR N H2 sing N N 279 +THR CA C sing N N 280 +THR CA CB sing N N 281 +THR CA HA sing N N 282 +THR C O doub N N 283 +THR C OXT sing N N 284 +THR CB OG1 sing N N 285 +THR CB CG2 sing N N 286 +THR CB HB sing N N 287 +THR OG1 HG1 sing N N 288 +THR CG2 HG21 sing N N 289 +THR CG2 HG22 sing N N 290 +THR CG2 HG23 sing N N 291 +THR OXT HXT sing N N 292 +TRP N CA sing N N 293 +TRP N H sing N N 294 +TRP N H2 sing N N 295 +TRP CA C sing N N 296 +TRP CA CB sing N N 297 +TRP CA HA sing N N 298 +TRP C O doub N N 299 +TRP C OXT sing N N 300 +TRP CB CG sing N N 301 +TRP CB HB2 sing N N 302 +TRP CB HB3 sing N N 303 +TRP CG CD1 doub Y N 304 +TRP CG CD2 sing Y N 305 +TRP CD1 NE1 sing Y N 306 +TRP CD1 HD1 sing N N 307 +TRP CD2 CE2 doub Y N 308 +TRP CD2 CE3 sing Y N 309 +TRP NE1 CE2 sing Y N 310 +TRP NE1 HE1 sing N N 311 +TRP CE2 CZ2 sing Y N 312 +TRP CE3 CZ3 doub Y N 313 +TRP CE3 HE3 sing N N 314 +TRP CZ2 CH2 doub Y N 315 +TRP CZ2 HZ2 sing N N 316 +TRP CZ3 CH2 sing Y N 317 +TRP CZ3 HZ3 sing N N 318 +TRP CH2 HH2 sing N N 319 +TRP OXT HXT sing N N 320 +TYR N CA sing N N 321 +TYR N H sing N N 322 +TYR N H2 sing N N 323 +TYR CA C sing N N 324 +TYR CA CB sing N N 325 +TYR CA HA sing N N 326 +TYR C O doub N N 327 +TYR C OXT sing N N 328 +TYR CB CG sing N N 329 +TYR CB HB2 sing N N 330 +TYR CB HB3 sing N N 331 +TYR CG CD1 doub Y N 332 +TYR CG CD2 sing Y N 333 +TYR CD1 CE1 sing Y N 334 +TYR CD1 HD1 sing N N 335 +TYR CD2 CE2 doub Y N 336 +TYR CD2 HD2 sing N N 337 +TYR CE1 CZ doub Y N 338 +TYR CE1 HE1 sing N N 339 +TYR CE2 CZ sing Y N 340 +TYR CE2 HE2 sing N N 341 +TYR CZ OH sing N N 342 +TYR OH HH sing N N 343 +TYR OXT HXT sing N N 344 +VAL N CA sing N N 345 +VAL N H sing N N 346 +VAL N H2 sing N N 347 +VAL CA C sing N N 348 +VAL CA CB sing N N 349 +VAL CA HA sing N N 350 +VAL C O doub N N 351 +VAL C OXT sing N N 352 +VAL CB CG1 sing N N 353 +VAL CB CG2 sing N N 354 +VAL CB HB sing N N 355 +VAL CG1 HG11 sing N N 356 +VAL CG1 HG12 sing N N 357 +VAL CG1 HG13 sing N N 358 +VAL CG2 HG21 sing N N 359 +VAL CG2 HG22 sing N N 360 +VAL CG2 HG23 sing N N 361 +VAL OXT HXT sing N N 362 +# +_atom_sites.entry_id 5SV5 +_atom_sites.fract_transf_matrix[1][1] 0.029821 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.009087 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.026480 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.024419 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +NA +O +SE +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . ASN A 1 1 ? 9.441 8.283 30.342 1.00 59.99 ? 861 ASN A N 1 +ATOM 2 C CA . ASN A 1 1 ? 10.391 7.133 30.209 1.00 58.79 ? 861 ASN A CA 1 +ATOM 3 C C . ASN A 1 1 ? 9.693 5.933 29.563 1.00 22.24 ? 861 ASN A C 1 +ATOM 4 O O . ASN A 1 1 ? 9.227 5.021 30.241 1.00 20.23 ? 861 ASN A O 1 +ATOM 5 C CB . ASN A 1 1 ? 10.974 6.757 31.579 1.00 59.21 ? 861 ASN A CB 1 +ATOM 6 C CG . ASN A 1 1 ? 11.692 7.919 32.250 1.00 61.19 ? 861 ASN A CG 1 +ATOM 7 O OD1 . ASN A 1 1 ? 12.070 8.894 31.599 1.00 62.63 ? 861 ASN A OD1 1 +ATOM 8 N ND2 . ASN A 1 1 ? 11.887 7.815 33.561 1.00 61.66 ? 861 ASN A ND2 1 +ATOM 9 N N . ASN A 1 2 ? 9.635 5.942 28.238 1.00 23.50 ? 862 ASN A N 1 +ATOM 10 C CA . ASN A 1 2 ? 8.938 4.890 27.517 1.00 21.31 ? 862 ASN A CA 1 +ATOM 11 C C . ASN A 1 2 ? 9.519 4.599 26.148 1.00 20.86 ? 862 ASN A C 1 +ATOM 12 O O . ASN A 1 2 ? 10.306 5.382 25.605 1.00 23.03 ? 862 ASN A O 1 +ATOM 13 C CB . ASN A 1 2 ? 7.439 5.224 27.410 1.00 35.66 ? 862 ASN A CB 1 +ATOM 14 C CG . ASN A 1 2 ? 7.171 6.602 26.814 1.00 36.86 ? 862 ASN A CG 1 +ATOM 15 O OD1 . ASN A 1 2 ? 7.701 6.954 25.760 1.00 37.20 ? 862 ASN A OD1 1 +ATOM 16 N ND2 . ASN A 1 2 ? 6.315 7.378 27.477 1.00 37.96 ? 862 ASN A ND2 1 +ATOM 17 N N . ARG A 1 3 ? 9.110 3.458 25.601 1.00 19.44 ? 863 ARG A N 1 +ATOM 18 C CA . ARG A 1 3 ? 9.540 3.035 24.277 1.00 21.25 ? 863 ARG A CA 1 +ATOM 19 C C . ARG A 1 3 ? 9.085 4.020 23.214 1.00 21.61 ? 863 ARG A C 1 +ATOM 20 O O . ARG A 1 3 ? 8.046 4.668 23.382 1.00 21.40 ? 863 ARG A O 1 +ATOM 21 C CB . ARG A 1 3 ? 8.987 1.644 23.941 1.00 21.58 ? 863 ARG A CB 1 +ATOM 22 C CG . ARG A 1 3 ? 9.690 0.549 24.727 1.00 34.27 ? 863 ARG A CG 1 +ATOM 23 C CD . ARG A 1 3 ? 9.461 -0.855 24.181 1.00 35.25 ? 863 ARG A CD 1 +ATOM 24 N NE . ARG A 1 3 ? 10.488 -1.776 24.690 1.00 36.62 ? 863 ARG A NE 1 +ATOM 25 C CZ . ARG A 1 3 ? 10.574 -3.074 24.399 1.00 38.17 ? 863 ARG A CZ 1 +ATOM 26 N NH1 . ARG A 1 3 ? 11.558 -3.798 24.930 1.00 39.27 ? 863 ARG A NH1 1 +ATOM 27 N NH2 . ARG A 1 3 ? 9.695 -3.659 23.585 1.00 39.01 ? 863 ARG A NH2 1 +ATOM 28 N N A PRO A 1 4 ? 9.835 4.123 22.101 0.50 23.44 ? 864 PRO A N 1 +ATOM 29 N N B PRO A 1 4 ? 9.874 4.175 22.135 0.50 23.11 ? 864 PRO A N 1 +ATOM 30 C CA A PRO A 1 4 ? 9.411 5.017 21.026 0.50 24.08 ? 864 PRO A CA 1 +ATOM 31 C CA B PRO A 1 4 ? 9.432 5.054 21.057 0.50 23.09 ? 864 PRO A CA 1 +ATOM 32 C C A PRO A 1 4 ? 8.177 4.469 20.318 0.50 24.59 ? 864 PRO A C 1 +ATOM 33 C C B PRO A 1 4 ? 8.149 4.553 20.405 0.50 22.54 ? 864 PRO A C 1 +ATOM 34 O O A PRO A 1 4 ? 7.916 3.266 20.378 0.50 24.93 ? 864 PRO A O 1 +ATOM 35 O O B PRO A 1 4 ? 7.883 3.350 20.392 0.50 22.01 ? 864 PRO A O 1 +ATOM 36 C CB A PRO A 1 4 ? 10.611 5.017 20.078 0.50 30.85 ? 864 PRO A CB 1 +ATOM 37 C CB B PRO A 1 4 ? 10.586 4.991 20.054 0.50 27.04 ? 864 PRO A CB 1 +ATOM 38 C CG A PRO A 1 4 ? 11.261 3.698 20.298 0.50 31.18 ? 864 PRO A CG 1 +ATOM 39 C CG B PRO A 1 4 ? 11.779 4.643 20.866 0.50 27.97 ? 864 PRO A CG 1 +ATOM 40 C CD A PRO A 1 4 ? 11.065 3.386 21.753 0.50 30.78 ? 864 PRO A CD 1 +ATOM 41 C CD B PRO A 1 4 ? 11.277 3.752 21.960 0.50 27.20 ? 864 PRO A CD 1 +ATOM 42 N N A GLU A 1 5 ? 7.415 5.345 19.675 0.50 35.03 ? 865 GLU A N 1 +ATOM 43 N N B GLU A 1 5 ? 7.354 5.484 19.898 0.50 19.74 ? 865 GLU A N 1 +ATOM 44 C CA A GLU A 1 5 ? 6.238 4.912 18.945 0.50 34.50 ? 865 GLU A CA 1 +ATOM 45 C CA B GLU A 1 5 ? 6.141 5.154 19.185 0.50 19.37 ? 865 GLU A CA 1 +ATOM 46 C C A GLU A 1 5 ? 6.683 4.003 17.811 0.50 22.38 ? 865 GLU A C 1 +ATOM 47 C C B GLU A 1 5 ? 6.525 4.412 17.910 0.50 23.21 ? 865 GLU A C 1 +ATOM 48 O O A GLU A 1 5 ? 7.741 4.214 17.218 0.50 24.55 ? 865 GLU A O 1 +ATOM 49 O O B GLU A 1 5 ? 7.278 4.936 17.092 0.50 25.57 ? 865 GLU A O 1 +ATOM 50 C CB A GLU A 1 5 ? 5.484 6.116 18.376 0.50 34.55 ? 865 GLU A CB 1 +ATOM 51 C CB B GLU A 1 5 ? 5.400 6.443 18.843 0.50 19.55 ? 865 GLU A CB 1 +ATOM 52 C CG A GLU A 1 5 ? 5.116 7.173 19.406 0.50 35.14 ? 865 GLU A CG 1 +ATOM 53 C CG B GLU A 1 5 ? 4.126 6.243 18.056 0.50 19.50 ? 865 GLU A CG 1 +ATOM 54 C CD A GLU A 1 5 ? 4.237 6.633 20.516 0.50 35.16 ? 865 GLU A CD 1 +ATOM 55 C CD B GLU A 1 5 ? 3.044 5.572 18.862 0.50 19.58 ? 865 GLU A CD 1 +ATOM 56 O OE1 A GLU A 1 5 ? 4.132 5.396 20.651 0.50 35.19 ? 865 GLU A OE1 1 +ATOM 57 O OE1 B GLU A 1 5 ? 3.128 5.575 20.112 0.50 20.09 ? 865 GLU A OE1 1 +ATOM 58 O OE2 A GLU A 1 5 ? 3.657 7.450 21.262 0.50 35.86 ? 865 GLU A OE2 1 +ATOM 59 O OE2 B GLU A 1 5 ? 2.077 5.081 18.235 0.50 19.49 ? 865 GLU A OE2 1 +ATOM 60 N N A GLU A 1 6 ? 5.883 2.985 17.516 0.50 23.29 ? 866 GLU A N 1 +ATOM 61 N N B GLU A 1 6 ? 6.023 3.192 17.742 0.50 23.59 ? 866 GLU A N 1 +ATOM 62 C CA A GLU A 1 6 ? 6.191 2.072 16.425 0.50 37.95 ? 866 GLU A CA 1 +ATOM 63 C CA B GLU A 1 6 ? 6.359 2.391 16.564 0.50 29.35 ? 866 GLU A CA 1 +ATOM 64 C C A GLU A 1 6 ? 5.746 2.708 15.112 0.50 20.95 ? 866 GLU A C 1 +ATOM 65 C C B GLU A 1 6 ? 5.875 3.075 15.285 0.50 20.40 ? 866 GLU A C 1 +ATOM 66 O O A GLU A 1 6 ? 4.546 2.900 14.899 0.50 20.02 ? 866 GLU A O 1 +ATOM 67 O O B GLU A 1 6 ? 4.769 3.606 15.244 0.50 21.50 ? 866 GLU A O 1 +ATOM 68 C CB A GLU A 1 6 ? 5.481 0.733 16.639 0.50 38.93 ? 866 GLU A CB 1 +ATOM 69 C CB B GLU A 1 6 ? 5.761 0.986 16.669 0.50 30.67 ? 866 GLU A CB 1 +ATOM 70 C CG A GLU A 1 6 ? 3.979 0.855 16.843 0.50 39.08 ? 866 GLU A CG 1 +ATOM 71 C CG B GLU A 1 6 ? 6.165 0.068 15.524 0.50 32.00 ? 866 GLU A CG 1 +ATOM 72 C CD A GLU A 1 6 ? 3.319 -0.472 17.171 0.50 40.43 ? 866 GLU A CD 1 +ATOM 73 C CD B GLU A 1 6 ? 5.608 -1.335 15.666 0.50 33.55 ? 866 GLU A CD 1 +ATOM 74 O OE1 A GLU A 1 6 ? 2.103 -0.477 17.456 0.50 41.14 ? 866 GLU A OE1 1 +ATOM 75 O OE1 B GLU A 1 6 ? 4.897 -1.598 16.660 0.50 33.88 ? 866 GLU A OE1 1 +ATOM 76 O OE2 A GLU A 1 6 ? 4.015 -1.509 17.149 0.50 41.37 ? 866 GLU A OE2 1 +ATOM 77 O OE2 B GLU A 1 6 ? 5.883 -2.177 14.785 0.50 35.20 ? 866 GLU A OE2 1 +ATOM 78 N N . ALA A 1 7 ? 6.708 3.042 14.245 1.00 20.94 ? 867 ALA A N 1 +ATOM 79 C CA . ALA A 1 7 ? 6.397 3.689 12.967 1.00 18.82 ? 867 ALA A CA 1 +ATOM 80 C C . ALA A 1 7 ? 5.686 2.753 12.012 1.00 17.56 ? 867 ALA A C 1 +ATOM 81 O O . ALA A 1 7 ? 6.106 1.615 11.797 1.00 22.65 ? 867 ALA A O 1 +ATOM 82 C CB . ALA A 1 7 ? 7.645 4.241 12.305 1.00 22.36 ? 867 ALA A CB 1 +ATOM 83 N N A ASN A 1 8 ? 4.601 3.257 11.442 0.50 14.39 ? 868 ASN A N 1 +ATOM 84 N N B ASN A 1 8 ? 4.589 3.238 11.450 0.50 14.65 ? 868 ASN A N 1 +ATOM 85 C CA A ASN A 1 8 ? 3.802 2.560 10.453 0.50 14.25 ? 868 ASN A CA 1 +ATOM 86 C CA B ASN A 1 8 ? 3.825 2.498 10.468 0.50 14.69 ? 868 ASN A CA 1 +ATOM 87 C C A ASN A 1 8 ? 4.420 2.815 9.086 0.50 13.55 ? 868 ASN A C 1 +ATOM 88 C C B ASN A 1 8 ? 4.414 2.800 9.098 0.50 13.58 ? 868 ASN A C 1 +ATOM 89 O O A ASN A 1 8 ? 4.494 3.975 8.645 0.50 11.68 ? 868 ASN A O 1 +ATOM 90 O O B ASN A 1 8 ? 4.471 3.970 8.676 0.50 11.48 ? 868 ASN A O 1 +ATOM 91 C CB A ASN A 1 8 ? 2.380 3.116 10.477 0.50 14.84 ? 868 ASN A CB 1 +ATOM 92 C CB B ASN A 1 8 ? 2.355 2.897 10.518 0.50 15.82 ? 868 ASN A CB 1 +ATOM 93 C CG A ASN A 1 8 ? 1.693 2.908 11.814 0.50 19.92 ? 868 ASN A CG 1 +ATOM 94 C CG B ASN A 1 8 ? 1.495 2.052 9.603 0.50 27.29 ? 868 ASN A CG 1 +ATOM 95 O OD1 A ASN A 1 8 ? 1.460 1.774 12.236 0.50 21.11 ? 868 ASN A OD1 1 +ATOM 96 O OD1 B ASN A 1 8 ? 2.004 1.229 8.842 0.50 28.23 ? 868 ASN A OD1 1 +ATOM 97 N ND2 A ASN A 1 8 ? 1.337 4.003 12.475 0.50 19.46 ? 868 ASN A ND2 1 +ATOM 98 N ND2 B ASN A 1 8 ? 0.184 2.249 9.672 0.50 27.84 ? 868 ASN A ND2 1 +ATOM 99 N N . ARG A 1 9 ? 4.876 1.755 8.420 1.00 13.78 ? 869 ARG A N 1 +ATOM 100 C CA . ARG A 1 9 ? 5.469 1.900 7.107 1.00 13.72 ? 869 ARG A CA 1 +ATOM 101 C C . ARG A 1 9 ? 4.399 2.041 6.052 1.00 13.25 ? 869 ARG A C 1 +ATOM 102 O O . ARG A 1 9 ? 3.566 1.146 5.893 1.00 15.73 ? 869 ARG A O 1 +ATOM 103 C CB . ARG A 1 9 ? 6.335 0.697 6.793 1.00 17.27 ? 869 ARG A CB 1 +ATOM 104 C CG . ARG A 1 9 ? 7.488 0.531 7.756 1.00 19.32 ? 869 ARG A CG 1 +ATOM 105 C CD . ARG A 1 9 ? 8.373 -0.627 7.323 1.00 50.00 ? 869 ARG A CD 1 +ATOM 106 N NE . ARG A 1 9 ? 9.524 -0.814 8.205 1.00 51.21 ? 869 ARG A NE 1 +ATOM 107 C CZ . ARG A 1 9 ? 10.478 -1.730 8.028 1.00 52.37 ? 869 ARG A CZ 1 +ATOM 108 N NH1 . ARG A 1 9 ? 11.483 -1.812 8.897 1.00 53.25 ? 869 ARG A NH1 1 +ATOM 109 N NH2 . ARG A 1 9 ? 10.440 -2.566 6.989 1.00 52.72 ? 869 ARG A NH2 1 +ATOM 110 N N . ILE A 1 10 ? 4.444 3.151 5.325 1.00 11.56 ? 870 ILE A N 1 +ATOM 111 C CA . ILE A 1 10 ? 3.490 3.429 4.257 1.00 11.29 ? 870 ILE A CA 1 +ATOM 112 C C . ILE A 1 10 ? 4.255 3.873 3.006 1.00 11.76 ? 870 ILE A C 1 +ATOM 113 O O . ILE A 1 10 ? 5.482 3.958 2.999 1.00 14.14 ? 870 ILE A O 1 +ATOM 114 C CB . ILE A 1 10 ? 2.420 4.476 4.691 1.00 11.42 ? 870 ILE A CB 1 +ATOM 115 C CG1 . ILE A 1 10 ? 3.081 5.809 5.081 1.00 11.17 ? 870 ILE A CG1 1 +ATOM 116 C CG2 . ILE A 1 10 ? 1.570 3.903 5.820 1.00 12.30 ? 870 ILE A CG2 1 +ATOM 117 C CD1 . ILE A 1 10 ? 2.110 6.969 5.203 1.00 11.24 ? 870 ILE A CD1 1 +ATOM 118 N N . GLY A 1 11 ? 3.530 4.201 1.955 1.00 13.94 ? 871 GLY A N 1 +ATOM 119 C CA . GLY A 1 11 ? 4.134 4.678 0.725 1.00 13.36 ? 871 GLY A CA 1 +ATOM 120 C C . GLY A 1 11 ? 3.458 5.932 0.267 1.00 11.78 ? 871 GLY A C 1 +ATOM 121 O O . GLY A 1 11 ? 2.615 6.480 0.959 1.00 13.71 ? 871 GLY A O 1 +ATOM 122 N N A LEU A 1 12 ? 3.840 6.453 -0.911 0.50 11.37 ? 872 LEU A N 1 +ATOM 123 N N B LEU A 1 12 ? 3.833 6.334 -0.920 0.50 10.98 ? 872 LEU A N 1 +ATOM 124 C CA A LEU A 1 12 ? 3.371 7.792 -1.433 0.50 11.61 ? 872 LEU A CA 1 +ATOM 125 C CA B LEU A 1 12 ? 3.095 7.324 -1.581 0.50 10.42 ? 872 LEU A CA 1 +ATOM 126 C C A LEU A 1 12 ? 1.977 7.901 -2.091 0.50 9.99 ? 872 LEU A C 1 +ATOM 127 C C B LEU A 1 12 ? 1.844 6.586 -2.069 0.50 9.01 ? 872 LEU A C 1 +ATOM 128 O O A LEU A 1 12 ? 1.644 8.915 -2.723 0.50 11.63 ? 872 LEU A O 1 +ATOM 129 O O B LEU A 1 12 ? 1.854 5.371 -2.361 0.50 9.64 ? 872 LEU A O 1 +ATOM 130 C CB A LEU A 1 12 ? 4.392 8.343 -2.427 0.50 11.68 ? 872 LEU A CB 1 +ATOM 131 C CB B LEU A 1 12 ? 3.908 7.949 -2.694 0.50 10.44 ? 872 LEU A CB 1 +ATOM 132 C CG A LEU A 1 12 ? 5.744 8.667 -1.812 0.50 12.89 ? 872 LEU A CG 1 +ATOM 133 C CG B LEU A 1 12 ? 5.205 8.612 -2.204 0.50 11.13 ? 872 LEU A CG 1 +ATOM 134 C CD1 A LEU A 1 12 ? 6.635 9.308 -2.861 0.50 13.32 ? 872 LEU A CD1 1 +ATOM 135 C CD1 B LEU A 1 12 ? 5.880 9.317 -3.364 0.50 10.89 ? 872 LEU A CD1 1 +ATOM 136 C CD2 A LEU A 1 12 ? 5.583 9.586 -0.612 0.50 13.74 ? 872 LEU A CD2 1 +ATOM 137 C CD2 B LEU A 1 12 ? 4.964 9.594 -1.064 0.50 11.04 ? 872 LEU A CD2 1 +ATOM 138 N N A ASN A 1 13 ? 1.173 6.861 -1.926 0.50 9.28 ? 873 ASN A N 1 +ATOM 139 N N B ASN A 1 13 ? 0.763 7.340 -2.102 0.50 8.46 ? 873 ASN A N 1 +ATOM 140 C CA A ASN A 1 13 ? -0.182 6.796 -2.463 0.50 8.44 ? 873 ASN A CA 1 +ATOM 141 C CA B ASN A 1 13 ? -0.570 6.835 -2.408 0.50 8.08 ? 873 ASN A CA 1 +ATOM 142 C C A ASN A 1 13 ? -0.987 6.057 -1.409 0.50 7.88 ? 873 ASN A C 1 +ATOM 143 C C B ASN A 1 13 ? -1.138 5.966 -1.279 0.50 7.68 ? 873 ASN A C 1 +ATOM 144 O O A ASN A 1 13 ? -1.342 4.883 -1.563 0.50 8.32 ? 873 ASN A O 1 +ATOM 145 O O B ASN A 1 13 ? -1.734 4.906 -1.525 0.50 7.89 ? 873 ASN A O 1 +ATOM 146 C CB A ASN A 1 13 ? -0.154 6.042 -3.778 0.50 8.62 ? 873 ASN A CB 1 +ATOM 147 C CB B ASN A 1 13 ? -0.654 6.119 -3.749 0.50 8.61 ? 873 ASN A CB 1 +ATOM 148 C CG A ASN A 1 13 ? -1.514 5.896 -4.397 0.50 8.72 ? 873 ASN A CG 1 +ATOM 149 C CG B ASN A 1 13 ? -2.081 5.910 -4.168 0.50 9.44 ? 873 ASN A CG 1 +ATOM 150 O OD1 A ASN A 1 13 ? -2.392 6.761 -4.261 0.50 9.71 ? 873 ASN A OD1 1 +ATOM 151 O OD1 B ASN A 1 13 ? -2.978 6.564 -3.642 0.50 10.88 ? 873 ASN A OD1 1 +ATOM 152 N ND2 A ASN A 1 13 ? -1.693 4.796 -5.117 0.50 8.50 ? 873 ASN A ND2 1 +ATOM 153 N ND2 B ASN A 1 13 ? -2.312 5.000 -5.102 0.50 10.16 ? 873 ASN A ND2 1 +ATOM 154 N N A THR A 1 14 ? -1.282 6.779 -0.333 0.50 7.84 ? 874 THR A N 1 +ATOM 155 N N B THR A 1 14 ? -0.963 6.445 -0.047 0.50 7.90 ? 874 THR A N 1 +ATOM 156 C CA A THR A 1 14 ? -1.831 6.191 0.883 0.50 7.87 ? 874 THR A CA 1 +ATOM 157 C CA B THR A 1 14 ? -1.550 5.836 1.130 0.50 8.02 ? 874 THR A CA 1 +ATOM 158 C C A THR A 1 14 ? -3.049 6.931 1.388 0.50 7.69 ? 874 THR A C 1 +ATOM 159 C C B THR A 1 14 ? -2.663 6.716 1.668 0.50 8.34 ? 874 THR A C 1 +ATOM 160 O O A THR A 1 14 ? -3.045 8.170 1.382 0.50 7.73 ? 874 THR A O 1 +ATOM 161 O O B THR A 1 14 ? -2.500 7.923 1.840 0.50 8.56 ? 874 THR A O 1 +ATOM 162 C CB A THR A 1 14 ? -0.772 6.271 2.021 0.50 8.32 ? 874 THR A CB 1 +ATOM 163 C CB B THR A 1 14 ? -0.537 5.638 2.267 0.50 8.36 ? 874 THR A CB 1 +ATOM 164 O OG1 A THR A 1 14 ? 0.341 5.427 1.701 0.50 9.17 ? 874 THR A OG1 1 +ATOM 165 O OG1 B THR A 1 14 ? 0.417 4.653 1.875 0.50 8.86 ? 874 THR A OG1 1 +ATOM 166 C CG2 A THR A 1 14 ? -1.343 5.859 3.375 0.50 8.72 ? 874 THR A CG2 1 +ATOM 167 C CG2 B THR A 1 14 ? -1.224 5.174 3.546 0.50 8.63 ? 874 THR A CG2 1 +ATOM 168 N N A THR A 1 15 ? -4.068 6.171 1.837 0.60 7.86 ? 875 THR A N 1 +ATOM 169 N N B THR A 1 15 ? -3.836 6.099 1.879 0.40 8.28 ? 875 THR A N 1 +ATOM 170 C CA A THR A 1 15 ? -5.149 6.738 2.608 0.60 8.11 ? 875 THR A CA 1 +ATOM 171 C CA B THR A 1 15 ? -4.941 6.718 2.628 0.40 8.23 ? 875 THR A CA 1 +ATOM 172 C C A THR A 1 15 ? -5.381 5.797 3.784 0.60 7.80 ? 875 THR A C 1 +ATOM 173 C C B THR A 1 15 ? -5.232 5.777 3.785 0.40 8.02 ? 875 THR A C 1 +ATOM 174 O O A THR A 1 15 ? -5.699 4.622 3.569 0.60 8.51 ? 875 THR A O 1 +ATOM 175 O O B THR A 1 15 ? -5.418 4.575 3.565 0.40 8.45 ? 875 THR A O 1 +ATOM 176 C CB A THR A 1 15 ? -6.401 6.883 1.758 0.60 9.78 ? 875 THR A CB 1 +ATOM 177 C CB B THR A 1 15 ? -6.223 6.989 1.799 0.40 9.80 ? 875 THR A CB 1 +ATOM 178 O OG1 A THR A 1 15 ? -6.087 7.633 0.574 0.60 12.03 ? 875 THR A OG1 1 +ATOM 179 O OG1 B THR A 1 15 ? -6.632 5.821 1.062 0.40 11.33 ? 875 THR A OG1 1 +ATOM 180 C CG2 A THR A 1 15 ? -7.444 7.616 2.546 0.60 10.21 ? 875 THR A CG2 1 +ATOM 181 C CG2 B THR A 1 15 ? -6.002 8.160 0.851 0.40 9.86 ? 875 THR A CG2 1 +ATOM 182 N N . ILE A 1 16 ? -5.229 6.298 5.010 1.00 8.04 ? 876 ILE A N 1 +ATOM 183 C CA . ILE A 1 16 ? -5.351 5.451 6.190 1.00 8.40 ? 876 ILE A CA 1 +ATOM 184 C C . ILE A 1 16 ? -5.934 6.236 7.356 1.00 8.48 ? 876 ILE A C 1 +ATOM 185 O O . ILE A 1 16 ? -5.573 7.397 7.579 1.00 9.15 ? 876 ILE A O 1 +ATOM 186 C CB . ILE A 1 16 ? -3.958 4.840 6.537 1.00 9.36 ? 876 ILE A CB 1 +ATOM 187 C CG1 . ILE A 1 16 ? -4.085 3.742 7.592 1.00 10.90 ? 876 ILE A CG1 1 +ATOM 188 C CG2 . ILE A 1 16 ? -2.938 5.911 6.939 1.00 9.73 ? 876 ILE A CG2 1 +ATOM 189 C CD1 . ILE A 1 16 ? -2.831 2.889 7.713 1.00 12.84 ? 876 ILE A CD1 1 +ATOM 190 N N A LYS A 1 17 ? -6.849 5.613 8.094 0.50 8.95 ? 877 LYS A N 1 +ATOM 191 N N B LYS A 1 17 ? -6.828 5.588 8.097 0.50 8.96 ? 877 LYS A N 1 +ATOM 192 C CA A LYS A 1 17 ? -7.424 6.254 9.269 0.50 9.35 ? 877 LYS A CA 1 +ATOM 193 C CA B LYS A 1 17 ? -7.426 6.172 9.283 0.50 9.35 ? 877 LYS A CA 1 +ATOM 194 C C A LYS A 1 17 ? -6.708 5.837 10.546 0.50 9.37 ? 877 LYS A C 1 +ATOM 195 C C B LYS A 1 17 ? -6.564 5.881 10.508 0.50 8.97 ? 877 LYS A C 1 +ATOM 196 O O A LYS A 1 17 ? -6.221 4.697 10.675 0.50 9.99 ? 877 LYS A O 1 +ATOM 197 O O B LYS A 1 17 ? -5.801 4.897 10.548 0.50 9.01 ? 877 LYS A O 1 +ATOM 198 C CB A LYS A 1 17 ? -8.925 6.000 9.383 0.50 10.48 ? 877 LYS A CB 1 +ATOM 199 C CB B LYS A 1 17 ? -8.853 5.639 9.489 0.50 10.69 ? 877 LYS A CB 1 +ATOM 200 C CG A LYS A 1 17 ? -9.757 6.668 8.298 0.50 11.10 ? 877 LYS A CG 1 +ATOM 201 C CG B LYS A 1 17 ? -9.779 5.995 8.335 0.50 12.33 ? 877 LYS A CG 1 +ATOM 202 C CD A LYS A 1 17 ? -11.159 6.988 8.809 0.50 12.35 ? 877 LYS A CD 1 +ATOM 203 C CD B LYS A 1 17 ? -11.241 6.030 8.723 0.50 14.22 ? 877 LYS A CD 1 +ATOM 204 C CE A LYS A 1 17 ? -12.111 7.440 7.707 0.50 12.77 ? 877 LYS A CE 1 +ATOM 205 C CE B LYS A 1 17 ? -12.107 6.465 7.555 0.50 14.92 ? 877 LYS A CE 1 +ATOM 206 N NZ A LYS A 1 17 ? -13.376 8.030 8.222 0.50 14.18 ? 877 LYS A NZ 1 +ATOM 207 N NZ B LYS A 1 17 ? -11.616 7.712 6.909 0.50 16.95 ? 877 LYS A NZ 1 +ATOM 208 N N . GLY A 1 18 ? -6.667 6.767 11.494 1.00 9.21 ? 878 GLY A N 1 +ATOM 209 C CA . GLY A 1 18 ? -6.068 6.533 12.794 1.00 9.46 ? 878 GLY A CA 1 +ATOM 210 C C . GLY A 1 18 ? -6.879 7.233 13.870 1.00 9.51 ? 878 GLY A C 1 +ATOM 211 O O . GLY A 1 18 ? -7.922 7.875 13.583 1.00 9.55 ? 878 GLY A O 1 +ATOM 212 N N . SER A 1 19 ? -6.432 7.108 15.111 1.00 8.50 ? 879 SER A N 1 +ATOM 213 C CA . SER A 1 19 ? -7.087 7.795 16.197 1.00 8.90 ? 879 SER A CA 1 +ATOM 214 C C . SER A 1 19 ? -6.062 8.256 17.205 1.00 8.46 ? 879 SER A C 1 +ATOM 215 O O . SER A 1 19 ? -4.964 7.690 17.320 1.00 9.40 ? 879 SER A O 1 +ATOM 216 C CB . SER A 1 19 ? -8.147 6.919 16.860 1.00 11.03 ? 879 SER A CB 1 +ATOM 217 O OG . SER A 1 19 ? -7.549 5.826 17.506 1.00 12.61 ? 879 SER A OG 1 +ATOM 218 N N . LEU A 1 20 ? -6.446 9.301 17.939 1.00 8.22 ? 880 LEU A N 1 +ATOM 219 C CA . LEU A 1 20 ? -5.640 9.878 19.015 1.00 8.58 ? 880 LEU A CA 1 +ATOM 220 C C . LEU A 1 20 ? -6.574 9.996 20.217 1.00 8.66 ? 880 LEU A C 1 +ATOM 221 O O . LEU A 1 20 ? -7.040 11.082 20.566 1.00 9.75 ? 880 LEU A O 1 +ATOM 222 C CB . LEU A 1 20 ? -5.040 11.225 18.606 1.00 8.79 ? 880 LEU A CB 1 +ATOM 223 C CG . LEU A 1 20 ? -4.090 11.179 17.398 1.00 8.86 ? 880 LEU A CG 1 +ATOM 224 C CD1 . LEU A 1 20 ? -3.766 12.591 16.943 1.00 10.39 ? 880 LEU A CD1 1 +ATOM 225 C CD2 . LEU A 1 20 ? -2.811 10.417 17.693 1.00 9.71 ? 880 LEU A CD2 1 +ATOM 226 N N A ILE A 1 21 ? -6.824 8.869 20.864 0.70 9.21 ? 881 ILE A N 1 +ATOM 227 N N B ILE A 1 21 ? -6.873 8.840 20.816 0.30 9.19 ? 881 ILE A N 1 +ATOM 228 C CA A ILE A 1 21 ? -7.778 8.785 21.960 0.70 9.99 ? 881 ILE A CA 1 +ATOM 229 C CA B ILE A 1 21 ? -7.779 8.720 21.965 0.30 9.81 ? 881 ILE A CA 1 +ATOM 230 C C A ILE A 1 21 ? -7.029 8.600 23.273 0.70 9.80 ? 881 ILE A C 1 +ATOM 231 C C B ILE A 1 21 ? -6.993 8.626 23.262 0.30 9.85 ? 881 ILE A C 1 +ATOM 232 O O A ILE A 1 21 ? -6.118 7.766 23.377 0.70 10.33 ? 881 ILE A O 1 +ATOM 233 O O B ILE A 1 21 ? -6.028 7.858 23.346 0.30 10.37 ? 881 ILE A O 1 +ATOM 234 C CB A ILE A 1 21 ? -8.784 7.644 21.674 0.70 11.30 ? 881 ILE A CB 1 +ATOM 235 C CB B ILE A 1 21 ? -8.620 7.422 21.886 0.30 10.43 ? 881 ILE A CB 1 +ATOM 236 C CG1 A ILE A 1 21 ? -9.656 8.046 20.474 0.70 12.28 ? 881 ILE A CG1 1 +ATOM 237 C CG1 B ILE A 1 21 ? -9.309 7.289 20.526 0.30 10.48 ? 881 ILE A CG1 1 +ATOM 238 C CG2 A ILE A 1 21 ? -9.621 7.317 22.907 0.70 11.97 ? 881 ILE A CG2 1 +ATOM 239 C CG2 B ILE A 1 21 ? -9.624 7.364 23.029 0.30 10.83 ? 881 ILE A CG2 1 +ATOM 240 C CD1 A ILE A 1 21 ? -10.432 6.901 19.862 0.70 13.56 ? 881 ILE A CD1 1 +ATOM 241 C CD1 B ILE A 1 21 ? -10.263 8.418 20.202 0.30 10.83 ? 881 ILE A CD1 1 +ATOM 242 N N . GLY A 1 22 ? -7.401 9.391 24.273 1.00 10.63 ? 882 GLY A N 1 +ATOM 243 C CA . GLY A 1 22 ? -6.798 9.278 25.595 1.00 11.93 ? 882 GLY A CA 1 +ATOM 244 C C . GLY A 1 22 ? -5.319 9.593 25.574 1.00 11.80 ? 882 GLY A C 1 +ATOM 245 O O . GLY A 1 22 ? -4.897 10.606 25.012 1.00 12.39 ? 882 GLY A O 1 +ATOM 246 N N . GLY A 1 23 ? -4.534 8.707 26.174 1.00 12.31 ? 883 GLY A N 1 +ATOM 247 C CA . GLY A 1 23 ? -3.095 8.850 26.238 1.00 13.33 ? 883 GLY A CA 1 +ATOM 248 C C . GLY A 1 23 ? -2.348 8.588 24.949 1.00 12.41 ? 883 GLY A C 1 +ATOM 249 O O . GLY A 1 23 ? -1.122 8.746 24.920 1.00 14.45 ? 883 GLY A O 1 +ATOM 250 N N . ASP A 1 24 ? -3.056 8.164 23.896 1.00 11.11 ? 884 ASP A N 1 +ATOM 251 C CA . ASP A 1 24 ? -2.427 7.978 22.583 1.00 10.05 ? 884 ASP A CA 1 +ATOM 252 C C . ASP A 1 24 ? -2.396 9.343 21.897 1.00 9.73 ? 884 ASP A C 1 +ATOM 253 O O . ASP A 1 24 ? -3.372 9.758 21.259 1.00 11.48 ? 884 ASP A O 1 +ATOM 254 C CB . ASP A 1 24 ? -3.204 6.966 21.751 1.00 10.57 ? 884 ASP A CB 1 +ATOM 255 C CG . ASP A 1 24 ? -2.547 6.665 20.439 1.00 11.09 ? 884 ASP A CG 1 +ATOM 256 O OD1 . ASP A 1 24 ? -1.304 6.837 20.322 1.00 15.05 ? 884 ASP A OD1 1 +ATOM 257 O OD2 . ASP A 1 24 ? -3.260 6.172 19.535 1.00 13.05 ? 884 ASP A OD2 1 +ATOM 258 N N . HIS A 1 25 ? -1.284 10.052 22.075 1.00 9.73 ? 885 HIS A N 1 +ATOM 259 C CA . HIS A 1 25 ? -1.174 11.419 21.561 1.00 9.56 ? 885 HIS A CA 1 +ATOM 260 C C . HIS A 1 25 ? -0.375 11.565 20.275 1.00 8.78 ? 885 HIS A C 1 +ATOM 261 O O . HIS A 1 25 ? -0.435 12.637 19.665 1.00 9.47 ? 885 HIS A O 1 +ATOM 262 C CB . HIS A 1 25 ? -0.626 12.362 22.634 1.00 11.97 ? 885 HIS A CB 1 +ATOM 263 C CG . HIS A 1 25 ? 0.662 11.912 23.208 1.00 13.57 ? 885 HIS A CG 1 +ATOM 264 N ND1 . HIS A 1 25 ? 1.839 11.940 22.497 1.00 15.64 ? 885 HIS A ND1 1 +ATOM 265 C CD2 . HIS A 1 25 ? 0.951 11.352 24.402 1.00 16.71 ? 885 HIS A CD2 1 +ATOM 266 C CE1 . HIS A 1 25 ? 2.808 11.447 23.245 1.00 18.05 ? 885 HIS A CE1 1 +ATOM 267 N NE2 . HIS A 1 25 ? 2.295 11.088 24.408 1.00 19.03 ? 885 HIS A NE2 1 +ATOM 268 N N . THR A 1 26 ? 0.354 10.525 19.862 1.00 8.83 ? 886 THR A N 1 +ATOM 269 C CA . THR A 1 26 ? 1.205 10.594 18.672 1.00 9.07 ? 886 THR A CA 1 +ATOM 270 C C . THR A 1 26 ? 1.164 9.301 17.896 1.00 8.75 ? 886 THR A C 1 +ATOM 271 O O . THR A 1 26 ? 1.289 8.222 18.487 1.00 9.83 ? 886 THR A O 1 +ATOM 272 C CB . THR A 1 26 ? 2.681 10.850 19.075 1.00 10.64 ? 886 THR A CB 1 +ATOM 273 O OG1 . THR A 1 26 ? 2.770 12.076 19.810 1.00 12.00 ? 886 THR A OG1 1 +ATOM 274 C CG2 . THR A 1 26 ? 3.583 10.960 17.859 1.00 11.51 ? 886 THR A CG2 1 +ATOM 275 N N . ASP A 1 27 ? 0.990 9.404 16.580 1.00 8.53 ? 887 ASP A N 1 +ATOM 276 C CA . ASP A 1 27 ? 1.194 8.311 15.633 1.00 8.47 ? 887 ASP A CA 1 +ATOM 277 C C . ASP A 1 27 ? 2.348 8.686 14.710 1.00 8.20 ? 887 ASP A C 1 +ATOM 278 O O . ASP A 1 27 ? 2.474 9.829 14.283 1.00 10.54 ? 887 ASP A O 1 +ATOM 279 C CB . ASP A 1 27 ? -0.051 8.056 14.793 1.00 9.46 ? 887 ASP A CB 1 +ATOM 280 C CG . ASP A 1 27 ? -1.202 7.456 15.573 1.00 9.72 ? 887 ASP A CG 1 +ATOM 281 O OD1 . ASP A 1 27 ? -0.989 6.838 16.633 1.00 11.89 ? 887 ASP A OD1 1 +ATOM 282 O OD2 . ASP A 1 27 ? -2.354 7.556 15.099 1.00 11.02 ? 887 ASP A OD2 1 +ATOM 283 N N . VAL A 1 28 ? 3.179 7.707 14.385 1.00 8.47 ? 888 VAL A N 1 +ATOM 284 C CA . VAL A 1 28 ? 4.325 7.927 13.499 1.00 8.73 ? 888 VAL A CA 1 +ATOM 285 C C . VAL A 1 28 ? 4.187 7.053 12.261 1.00 8.55 ? 888 VAL A C 1 +ATOM 286 O O . VAL A 1 28 ? 3.833 5.859 12.352 1.00 9.94 ? 888 VAL A O 1 +ATOM 287 C CB . VAL A 1 28 ? 5.658 7.628 14.218 1.00 10.87 ? 888 VAL A CB 1 +ATOM 288 C CG1 . VAL A 1 28 ? 6.848 7.963 13.327 1.00 12.83 ? 888 VAL A CG1 1 +ATOM 289 C CG2 . VAL A 1 28 ? 5.745 8.414 15.516 1.00 12.50 ? 888 VAL A CG2 1 +ATOM 290 N N . TYR A 1 29 ? 4.479 7.657 11.115 1.00 8.32 ? 889 TYR A N 1 +ATOM 291 C CA . TYR A 1 29 ? 4.493 6.972 9.839 1.00 8.43 ? 889 TYR A CA 1 +ATOM 292 C C . TYR A 1 29 ? 5.850 7.194 9.192 1.00 8.44 ? 889 TYR A C 1 +ATOM 293 O O . TYR A 1 29 ? 6.498 8.222 9.428 1.00 9.53 ? 889 TYR A O 1 +ATOM 294 C CB . TYR A 1 29 ? 3.402 7.514 8.902 1.00 8.29 ? 889 TYR A CB 1 +ATOM 295 C CG . TYR A 1 29 ? 2.016 7.340 9.450 1.00 8.30 ? 889 TYR A CG 1 +ATOM 296 C CD1 . TYR A 1 29 ? 1.465 8.252 10.334 1.00 8.38 ? 889 TYR A CD1 1 +ATOM 297 C CD2 . TYR A 1 29 ? 1.255 6.230 9.105 1.00 9.04 ? 889 TYR A CD2 1 +ATOM 298 C CE1 . TYR A 1 29 ? 0.177 8.078 10.849 1.00 9.18 ? 889 TYR A CE1 1 +ATOM 299 C CE2 . TYR A 1 29 ? -0.016 6.029 9.625 1.00 9.52 ? 889 TYR A CE2 1 +ATOM 300 C CZ . TYR A 1 29 ? -0.557 6.955 10.494 1.00 9.33 ? 889 TYR A CZ 1 +ATOM 301 O OH . TYR A 1 29 ? -1.829 6.739 10.990 1.00 11.13 ? 889 TYR A OH 1 +ATOM 302 N N A THR A 1 30 ? 6.284 6.251 8.364 0.50 8.63 ? 890 THR A N 1 +ATOM 303 N N B THR A 1 30 ? 6.294 6.237 8.382 0.50 8.79 ? 890 THR A N 1 +ATOM 304 C CA A THR A 1 30 ? 7.501 6.444 7.598 0.50 8.58 ? 890 THR A CA 1 +ATOM 305 C CA B THR A 1 30 ? 7.509 6.412 7.597 0.50 8.98 ? 890 THR A CA 1 +ATOM 306 C C A THR A 1 30 ? 7.285 6.035 6.152 0.50 8.82 ? 890 THR A C 1 +ATOM 307 C C B THR A 1 30 ? 7.235 6.069 6.143 0.50 8.90 ? 890 THR A C 1 +ATOM 308 O O A THR A 1 30 ? 6.546 5.088 5.864 0.50 9.69 ? 890 THR A O 1 +ATOM 309 O O B THR A 1 30 ? 6.400 5.208 5.841 0.50 9.71 ? 890 THR A O 1 +ATOM 310 C CB A THR A 1 30 ? 8.716 5.723 8.216 0.50 9.44 ? 890 THR A CB 1 +ATOM 311 C CB B THR A 1 30 ? 8.701 5.579 8.123 0.50 10.49 ? 890 THR A CB 1 +ATOM 312 O OG1 A THR A 1 30 ? 9.876 5.977 7.413 0.50 9.36 ? 890 THR A OG1 1 +ATOM 313 O OG1 B THR A 1 30 ? 8.375 4.185 8.132 0.50 12.80 ? 890 THR A OG1 1 +ATOM 314 C CG2 A THR A 1 30 ? 8.493 4.227 8.312 0.50 10.34 ? 890 THR A CG2 1 +ATOM 315 C CG2 B THR A 1 30 ? 9.109 6.024 9.528 0.50 11.44 ? 890 THR A CG2 1 +ATOM 316 N N . PHE A 1 31 ? 7.924 6.769 5.245 1.00 9.09 ? 891 PHE A N 1 +ATOM 317 C CA . PHE A 1 31 ? 7.848 6.486 3.815 1.00 9.38 ? 891 PHE A CA 1 +ATOM 318 C C . PHE A 1 31 ? 9.146 6.914 3.162 1.00 9.41 ? 891 PHE A C 1 +ATOM 319 O O . PHE A 1 31 ? 9.923 7.671 3.745 1.00 10.08 ? 891 PHE A O 1 +ATOM 320 C CB . PHE A 1 31 ? 6.623 7.141 3.147 1.00 9.77 ? 891 PHE A CB 1 +ATOM 321 C CG . PHE A 1 31 ? 6.571 8.643 3.275 1.00 9.60 ? 891 PHE A CG 1 +ATOM 322 C CD1 . PHE A 1 31 ? 7.201 9.467 2.348 1.00 10.70 ? 891 PHE A CD1 1 +ATOM 323 C CD2 . PHE A 1 31 ? 5.853 9.243 4.300 1.00 10.86 ? 891 PHE A CD2 1 +ATOM 324 C CE1 . PHE A 1 31 ? 7.137 10.853 2.447 1.00 10.86 ? 891 PHE A CE1 1 +ATOM 325 C CE2 . PHE A 1 31 ? 5.795 10.624 4.411 1.00 11.25 ? 891 PHE A CE2 1 +ATOM 326 C CZ . PHE A 1 31 ? 6.428 11.430 3.475 1.00 10.87 ? 891 PHE A CZ 1 +ATOM 327 N N A ASN A 1 32 ? 9.349 6.443 1.942 0.50 10.01 ? 892 ASN A N 1 +ATOM 328 N N B ASN A 1 32 ? 9.381 6.420 1.947 0.50 10.15 ? 892 ASN A N 1 +ATOM 329 C CA A ASN A 1 32 ? 10.520 6.752 1.158 0.50 10.31 ? 892 ASN A CA 1 +ATOM 330 C CA B ASN A 1 32 ? 10.586 6.717 1.171 0.50 10.58 ? 892 ASN A CA 1 +ATOM 331 C C A ASN A 1 32 ? 10.092 7.526 -0.076 0.50 10.12 ? 892 ASN A C 1 +ATOM 332 C C B ASN A 1 32 ? 10.239 7.366 -0.163 0.50 10.78 ? 892 ASN A C 1 +ATOM 333 O O A ASN A 1 32 ? 8.989 7.321 -0.609 0.50 10.19 ? 892 ASN A O 1 +ATOM 334 O O B ASN A 1 32 ? 9.369 6.864 -0.891 0.50 12.49 ? 892 ASN A O 1 +ATOM 335 C CB A ASN A 1 32 ? 11.214 5.456 0.740 0.50 11.93 ? 892 ASN A CB 1 +ATOM 336 C CB B ASN A 1 32 ? 11.366 5.436 0.876 0.50 12.45 ? 892 ASN A CB 1 +ATOM 337 C CG A ASN A 1 32 ? 11.693 4.645 1.928 0.50 18.06 ? 892 ASN A CG 1 +ATOM 338 C CG B ASN A 1 32 ? 12.629 5.708 0.087 0.50 18.16 ? 892 ASN A CG 1 +ATOM 339 O OD1 A ASN A 1 32 ? 12.314 5.171 2.852 0.50 17.93 ? 892 ASN A OD1 1 +ATOM 340 O OD1 B ASN A 1 32 ? 13.578 6.280 0.614 0.50 18.39 ? 892 ASN A OD1 1 +ATOM 341 N ND2 A ASN A 1 32 ? 11.444 3.343 1.888 0.50 19.30 ? 892 ASN A ND2 1 +ATOM 342 N ND2 B ASN A 1 32 ? 12.641 5.316 -1.184 0.50 18.66 ? 892 ASN A ND2 1 +ATOM 343 N N . VAL A 1 33 ? 10.959 8.441 -0.498 1.00 10.17 ? 893 VAL A N 1 +ATOM 344 C CA . VAL A 1 33 ? 10.779 9.160 -1.752 1.00 10.68 ? 893 VAL A CA 1 +ATOM 345 C C . VAL A 1 33 ? 11.963 8.790 -2.647 1.00 10.97 ? 893 VAL A C 1 +ATOM 346 O O . VAL A 1 33 ? 13.114 9.036 -2.282 1.00 11.53 ? 893 VAL A O 1 +ATOM 347 C CB . VAL A 1 33 ? 10.716 10.673 -1.507 1.00 10.93 ? 893 VAL A CB 1 +ATOM 348 C CG1 . VAL A 1 33 ? 10.672 11.439 -2.820 1.00 12.72 ? 893 VAL A CG1 1 +ATOM 349 C CG2 . VAL A 1 33 ? 9.509 11.017 -0.637 1.00 11.46 ? 893 VAL A CG2 1 +ATOM 350 N N . ALA A 1 34 ? 11.699 8.205 -3.811 1.00 11.74 ? 894 ALA A N 1 +ATOM 351 C CA . ALA A 1 34 ? 12.784 7.749 -4.687 1.00 12.59 ? 894 ALA A CA 1 +ATOM 352 C C . ALA A 1 34 ? 13.450 8.858 -5.472 1.00 13.36 ? 894 ALA A C 1 +ATOM 353 O O . ALA A 1 34 ? 14.657 8.815 -5.684 1.00 14.94 ? 894 ALA A O 1 +ATOM 354 C CB . ALA A 1 34 ? 12.277 6.708 -5.653 1.00 14.53 ? 894 ALA A CB 1 +ATOM 355 N N A SER A 1 35 ? 12.665 9.814 -5.953 0.60 16.01 ? 895 SER A N 1 +ATOM 356 N N B SER A 1 35 ? 12.652 9.809 -5.946 0.40 15.70 ? 895 SER A N 1 +ATOM 357 C CA A SER A 1 35 ? 13.183 10.935 -6.738 0.60 17.81 ? 895 SER A CA 1 +ATOM 358 C CA B SER A 1 35 ? 13.139 10.930 -6.737 0.40 17.32 ? 895 SER A CA 1 +ATOM 359 C C A SER A 1 35 ? 12.365 12.159 -6.386 0.60 18.87 ? 895 SER A C 1 +ATOM 360 C C B SER A 1 35 ? 12.391 12.158 -6.278 0.40 18.70 ? 895 SER A C 1 +ATOM 361 O O A SER A 1 35 ? 11.173 12.048 -6.067 0.60 20.24 ? 895 SER A O 1 +ATOM 362 O O B SER A 1 35 ? 11.270 12.053 -5.764 0.40 19.51 ? 895 SER A O 1 +ATOM 363 C CB A SER A 1 35 ? 13.110 10.637 -8.233 0.60 20.47 ? 895 SER A CB 1 +ATOM 364 C CB B SER A 1 35 ? 12.883 10.688 -8.224 0.40 19.30 ? 895 SER A CB 1 +ATOM 365 O OG A SER A 1 35 ? 11.801 10.266 -8.611 0.60 27.99 ? 895 SER A OG 1 +ATOM 366 O OG B SER A 1 35 ? 13.474 11.706 -9.014 0.40 24.54 ? 895 SER A OG 1 +ATOM 367 N N . ALA A 1 36 ? 13.009 13.320 -6.447 1.00 18.39 ? 896 ALA A N 1 +ATOM 368 C CA . ALA A 1 36 ? 12.381 14.574 -6.031 1.00 19.03 ? 896 ALA A CA 1 +ATOM 369 C C . ALA A 1 36 ? 11.038 14.764 -6.709 1.00 18.85 ? 896 ALA A C 1 +ATOM 370 O O . ALA A 1 36 ? 10.926 14.604 -7.922 1.00 22.17 ? 896 ALA A O 1 +ATOM 371 C CB . ALA A 1 36 ? 13.287 15.755 -6.333 1.00 22.71 ? 896 ALA A CB 1 +ATOM 372 N N A LYS A 1 37 ? 10.058 15.114 -5.913 0.60 18.75 ? 897 LYS A N 1 +ATOM 373 N N B LYS A 1 37 ? 9.976 15.055 -5.935 0.40 17.61 ? 897 LYS A N 1 +ATOM 374 C CA A LYS A 1 37 ? 8.788 15.411 -6.453 0.60 18.11 ? 897 LYS A CA 1 +ATOM 375 C CA B LYS A 1 37 ? 8.610 15.231 -6.510 0.40 17.42 ? 897 LYS A CA 1 +ATOM 376 C C A LYS A 1 37 ? 8.028 16.147 -5.390 0.60 13.82 ? 897 LYS A C 1 +ATOM 377 C C B LYS A 1 37 ? 7.606 15.959 -5.601 0.40 13.93 ? 897 LYS A C 1 +ATOM 378 O O A LYS A 1 37 ? 8.353 16.077 -4.201 0.60 13.58 ? 897 LYS A O 1 +ATOM 379 O O B LYS A 1 37 ? 7.773 15.995 -4.378 0.40 12.40 ? 897 LYS A O 1 +ATOM 380 C CB A LYS A 1 37 ? 8.052 14.115 -6.852 0.60 21.71 ? 897 LYS A CB 1 +ATOM 381 C CB B LYS A 1 37 ? 8.013 13.875 -6.860 0.40 20.18 ? 897 LYS A CB 1 +ATOM 382 C CG A LYS A 1 37 ? 7.858 13.102 -5.727 0.60 22.30 ? 897 LYS A CG 1 +ATOM 383 C CG B LYS A 1 37 ? 7.806 12.996 -5.644 0.40 27.01 ? 897 LYS A CG 1 +ATOM 384 C CD A LYS A 1 37 ? 6.900 11.970 -6.118 0.60 22.54 ? 897 LYS A CD 1 +ATOM 385 C CD B LYS A 1 37 ? 7.067 11.711 -5.979 0.40 27.12 ? 897 LYS A CD 1 +ATOM 386 C CE A LYS A 1 37 ? 7.491 10.942 -7.080 0.60 22.72 ? 897 LYS A CE 1 +ATOM 387 C CE B LYS A 1 37 ? 5.640 11.990 -6.423 0.40 26.97 ? 897 LYS A CE 1 +ATOM 388 N NZ A LYS A 1 37 ? 8.237 9.835 -6.404 0.60 22.26 ? 897 LYS A NZ 1 +ATOM 389 N NZ B LYS A 1 37 ? 4.806 10.756 -6.397 0.40 26.88 ? 897 LYS A NZ 1 +ATOM 390 N N A ASN A 1 38 ? 7.004 16.885 -5.831 0.50 11.28 ? 898 ASN A N 1 +ATOM 391 N N B ASN A 1 38 ? 6.532 16.493 -6.200 0.50 13.01 ? 898 ASN A N 1 +ATOM 392 C CA A ASN A 1 38 ? 6.043 17.434 -4.895 0.50 10.19 ? 898 ASN A CA 1 +ATOM 393 C CA B ASN A 1 38 ? 5.547 17.230 -5.457 0.50 12.50 ? 898 ASN A CA 1 +ATOM 394 C C A ASN A 1 38 ? 5.158 16.315 -4.417 0.50 11.04 ? 898 ASN A C 1 +ATOM 395 C C B ASN A 1 38 ? 4.642 16.267 -4.684 0.50 12.83 ? 898 ASN A C 1 +ATOM 396 O O A ASN A 1 38 ? 4.809 15.404 -5.166 0.50 12.55 ? 898 ASN A O 1 +ATOM 397 O O B ASN A 1 38 ? 3.916 15.488 -5.293 0.50 14.04 ? 898 ASN A O 1 +ATOM 398 C CB A ASN A 1 38 ? 5.159 18.545 -5.481 0.50 9.50 ? 898 ASN A CB 1 +ATOM 399 C CB B ASN A 1 38 ? 4.783 18.101 -6.447 0.50 13.47 ? 898 ASN A CB 1 +ATOM 400 C CG A ASN A 1 38 ? 5.777 19.908 -5.325 0.50 9.06 ? 898 ASN A CG 1 +ATOM 401 C CG B ASN A 1 38 ? 5.695 19.094 -7.157 0.50 13.69 ? 898 ASN A CG 1 +ATOM 402 O OD1 A ASN A 1 38 ? 6.905 20.131 -5.752 0.50 9.93 ? 898 ASN A OD1 1 +ATOM 403 O OD1 B ASN A 1 38 ? 6.561 19.717 -6.523 0.50 13.36 ? 898 ASN A OD1 1 +ATOM 404 N ND2 A ASN A 1 38 ? 5.046 20.833 -4.710 0.50 8.74 ? 898 ASN A ND2 1 +ATOM 405 N ND2 B ASN A 1 38 ? 5.501 19.263 -8.466 0.50 15.14 ? 898 ASN A ND2 1 +ATOM 406 N N A ILE A 1 39 ? 4.811 16.379 -3.149 0.50 11.28 ? 899 ILE A N 1 +ATOM 407 N N B ILE A 1 39 ? 4.752 16.313 -3.345 0.50 12.59 ? 899 ILE A N 1 +ATOM 408 C CA A ILE A 1 39 ? 3.834 15.472 -2.625 0.50 12.10 ? 899 ILE A CA 1 +ATOM 409 C CA B ILE A 1 39 ? 3.971 15.468 -2.409 0.50 12.69 ? 899 ILE A CA 1 +ATOM 410 C C A ILE A 1 39 ? 2.813 16.334 -1.894 0.50 11.72 ? 899 ILE A C 1 +ATOM 411 C C B ILE A 1 39 ? 2.917 16.275 -1.647 0.50 11.73 ? 899 ILE A C 1 +ATOM 412 O O A ILE A 1 39 ? 2.986 17.548 -1.728 0.50 12.33 ? 899 ILE A O 1 +ATOM 413 O O B ILE A 1 39 ? 3.200 17.373 -1.142 0.50 11.00 ? 899 ILE A O 1 +ATOM 414 C CB A ILE A 1 39 ? 4.468 14.386 -1.737 0.50 11.44 ? 899 ILE A CB 1 +ATOM 415 C CB B ILE A 1 39 ? 4.862 14.807 -1.329 0.50 12.98 ? 899 ILE A CB 1 +ATOM 416 C CG1 A ILE A 1 39 ? 5.254 15.018 -0.585 0.50 11.55 ? 899 ILE A CG1 1 +ATOM 417 C CG1 B ILE A 1 39 ? 5.988 14.006 -1.982 0.50 23.00 ? 899 ILE A CG1 1 +ATOM 418 C CG2 A ILE A 1 39 ? 5.395 13.519 -2.578 0.50 11.57 ? 899 ILE A CG2 1 +ATOM 419 C CG2 B ILE A 1 39 ? 4.033 13.900 -0.427 0.50 22.77 ? 899 ILE A CG2 1 +ATOM 420 C CD1 A ILE A 1 39 ? 5.783 14.008 0.414 0.50 11.70 ? 899 ILE A CD1 1 +ATOM 421 C CD1 B ILE A 1 39 ? 5.494 13.018 -3.009 0.50 23.50 ? 899 ILE A CD1 1 +ATOM 422 N N . ASP A 1 40 ? 1.722 15.685 -1.534 1.00 11.49 ? 900 ASP A N 1 +ATOM 423 C CA . ASP A 1 40 ? 0.611 16.279 -0.839 1.00 10.96 ? 900 ASP A CA 1 +ATOM 424 C C . ASP A 1 40 ? 0.342 15.444 0.404 1.00 9.42 ? 900 ASP A C 1 +ATOM 425 O O . ASP A 1 40 ? 0.098 14.245 0.288 1.00 11.67 ? 900 ASP A O 1 +ATOM 426 C CB . ASP A 1 40 ? -0.619 16.291 -1.750 1.00 14.76 ? 900 ASP A CB 1 +ATOM 427 C CG . ASP A 1 40 ? -1.706 17.145 -1.208 1.00 17.86 ? 900 ASP A CG 1 +ATOM 428 O OD1 . ASP A 1 40 ? -2.398 16.701 -0.294 1.00 18.40 ? 900 ASP A OD1 1 +ATOM 429 O OD2 . ASP A 1 40 ? -1.840 18.285 -1.671 1.00 22.28 ? 900 ASP A OD2 1 +ATOM 430 N N . ILE A 1 41 ? 0.432 16.056 1.586 1.00 7.51 ? 901 ILE A N 1 +ATOM 431 C CA . ILE A 1 41 ? 0.107 15.390 2.854 1.00 7.51 ? 901 ILE A CA 1 +ATOM 432 C C . ILE A 1 41 ? -1.100 16.104 3.442 1.00 7.26 ? 901 ILE A C 1 +ATOM 433 O O . ILE A 1 41 ? -1.049 17.315 3.677 1.00 7.98 ? 901 ILE A O 1 +ATOM 434 C CB . ILE A 1 41 ? 1.289 15.392 3.840 1.00 8.12 ? 901 ILE A CB 1 +ATOM 435 C CG1 . ILE A 1 41 ? 2.485 14.651 3.233 1.00 9.23 ? 901 ILE A CG1 1 +ATOM 436 C CG2 . ILE A 1 41 ? 0.882 14.773 5.173 1.00 8.92 ? 901 ILE A CG2 1 +ATOM 437 C CD1 . ILE A 1 41 ? 3.733 14.661 4.080 1.00 11.19 ? 901 ILE A CD1 1 +ATOM 438 N N . SER A 1 42 ? -2.173 15.351 3.680 1.00 7.39 ? 902 SER A N 1 +ATOM 439 C CA . SER A 1 42 ? -3.403 15.910 4.193 1.00 7.70 ? 902 SER A CA 1 +ATOM 440 C C . SER A 1 42 ? -3.953 15.023 5.291 1.00 7.31 ? 902 SER A C 1 +ATOM 441 O O . SER A 1 42 ? -4.093 13.815 5.100 1.00 9.05 ? 902 SER A O 1 +ATOM 442 C CB . SER A 1 42 ? -4.417 16.008 3.050 1.00 10.49 ? 902 SER A CB 1 +ATOM 443 O OG . SER A 1 42 ? -5.668 16.481 3.462 1.00 13.82 ? 902 SER A OG 1 +ATOM 444 N N . VAL A 1 43 ? -4.269 15.628 6.429 1.00 6.82 ? 903 VAL A N 1 +ATOM 445 C CA . VAL A 1 43 ? -4.916 14.939 7.539 1.00 6.88 ? 903 VAL A CA 1 +ATOM 446 C C . VAL A 1 43 ? -6.268 15.585 7.783 1.00 6.87 ? 903 VAL A C 1 +ATOM 447 O O . VAL A 1 43 ? -6.351 16.798 7.966 1.00 8.14 ? 903 VAL A O 1 +ATOM 448 C CB . VAL A 1 43 ? -4.053 14.984 8.816 1.00 7.72 ? 903 VAL A CB 1 +ATOM 449 C CG1 . VAL A 1 43 ? -4.815 14.432 10.015 1.00 9.26 ? 903 VAL A CG1 1 +ATOM 450 C CG2 . VAL A 1 43 ? -2.759 14.200 8.595 1.00 7.97 ? 903 VAL A CG2 1 +ATOM 451 N N . LEU A 1 44 ? -7.321 14.771 7.765 1.00 6.77 ? 904 LEU A N 1 +ATOM 452 C CA . LEU A 1 44 ? -8.673 15.239 8.066 1.00 7.16 ? 904 LEU A CA 1 +ATOM 453 C C . LEU A 1 44 ? -8.898 15.038 9.560 1.00 6.93 ? 904 LEU A C 1 +ATOM 454 O O . LEU A 1 44 ? -8.876 13.913 10.066 1.00 7.57 ? 904 LEU A O 1 +ATOM 455 C CB . LEU A 1 44 ? -9.712 14.478 7.241 1.00 7.95 ? 904 LEU A CB 1 +ATOM 456 C CG . LEU A 1 44 ? -9.478 14.567 5.722 1.00 9.92 ? 904 LEU A CG 1 +ATOM 457 C CD1 . LEU A 1 44 ? -10.522 13.768 4.957 1.00 11.39 ? 904 LEU A CD1 1 +ATOM 458 C CD2 . LEU A 1 44 ? -9.337 15.984 5.204 1.00 13.30 ? 904 LEU A CD2 1 +ATOM 459 N N . ASN A 1 45 ? -9.103 16.156 10.251 1.00 7.04 ? 905 ASN A N 1 +ATOM 460 C CA . ASN A 1 45 ? -9.287 16.221 11.704 1.00 7.13 ? 905 ASN A CA 1 +ATOM 461 C C . ASN A 1 45 ? -10.780 16.063 11.957 1.00 7.23 ? 905 ASN A C 1 +ATOM 462 O O . ASN A 1 45 ? -11.525 17.049 12.041 1.00 7.95 ? 905 ASN A O 1 +ATOM 463 C CB . ASN A 1 45 ? -8.734 17.565 12.178 1.00 7.77 ? 905 ASN A CB 1 +ATOM 464 C CG . ASN A 1 45 ? -8.872 17.806 13.657 1.00 7.26 ? 905 ASN A CG 1 +ATOM 465 O OD1 . ASN A 1 45 ? -9.288 16.942 14.436 1.00 7.67 ? 905 ASN A OD1 1 +ATOM 466 N ND2 . ASN A 1 45 ? -8.510 19.013 14.058 1.00 8.30 ? 905 ASN A ND2 1 +ATOM 467 N N . GLU A 1 46 ? -11.229 14.812 12.052 1.00 7.17 ? 906 GLU A N 1 +ATOM 468 C CA . GLU A 1 46 ? -12.654 14.508 11.992 1.00 7.88 ? 906 GLU A CA 1 +ATOM 469 C C . GLU A 1 46 ? -13.463 15.088 13.142 1.00 8.11 ? 906 GLU A C 1 +ATOM 470 O O . GLU A 1 46 ? -14.626 15.442 12.943 1.00 10.30 ? 906 GLU A O 1 +ATOM 471 C CB . GLU A 1 46 ? -12.860 12.996 11.862 1.00 8.58 ? 906 GLU A CB 1 +ATOM 472 C CG . GLU A 1 46 ? -12.231 12.418 10.594 1.00 9.57 ? 906 GLU A CG 1 +ATOM 473 C CD . GLU A 1 46 ? -12.488 10.937 10.385 1.00 11.64 ? 906 GLU A CD 1 +ATOM 474 O OE1 . GLU A 1 46 ? -12.806 10.215 11.365 1.00 13.80 ? 906 GLU A OE1 1 +ATOM 475 O OE2 . GLU A 1 46 ? -12.372 10.491 9.221 1.00 14.27 ? 906 GLU A OE2 1 +ATOM 476 N N . TYR A 1 47 ? -12.880 15.162 14.330 1.00 7.88 ? 907 TYR A N 1 +ATOM 477 C CA . TYR A 1 47 ? -13.577 15.693 15.511 1.00 8.69 ? 907 TYR A CA 1 +ATOM 478 C C . TYR A 1 47 ? -13.123 17.092 15.899 1.00 8.77 ? 907 TYR A C 1 +ATOM 479 O O . TYR A 1 47 ? -13.567 17.624 16.915 1.00 10.23 ? 907 TYR A O 1 +ATOM 480 C CB . TYR A 1 47 ? -13.487 14.700 16.684 1.00 9.44 ? 907 TYR A CB 1 +ATOM 481 C CG . TYR A 1 47 ? -14.442 13.550 16.500 1.00 10.02 ? 907 TYR A CG 1 +ATOM 482 C CD1 . TYR A 1 47 ? -14.127 12.484 15.673 1.00 10.46 ? 907 TYR A CD1 1 +ATOM 483 C CD2 . TYR A 1 47 ? -15.706 13.571 17.081 1.00 11.82 ? 907 TYR A CD2 1 +ATOM 484 C CE1 . TYR A 1 47 ? -15.036 11.457 15.449 1.00 11.94 ? 907 TYR A CE1 1 +ATOM 485 C CE2 . TYR A 1 47 ? -16.620 12.550 16.870 1.00 13.12 ? 907 TYR A CE2 1 +ATOM 486 C CZ . TYR A 1 47 ? -16.281 11.494 16.055 1.00 12.85 ? 907 TYR A CZ 1 +ATOM 487 O OH . TYR A 1 47 ? -17.180 10.468 15.846 1.00 16.03 ? 907 TYR A OH 1 +ATOM 488 N N . GLY A 1 48 ? -12.274 17.717 15.082 1.00 8.33 ? 908 GLY A N 1 +ATOM 489 C CA . GLY A 1 48 ? -11.897 19.103 15.324 1.00 9.04 ? 908 GLY A CA 1 +ATOM 490 C C . GLY A 1 48 ? -11.141 19.309 16.613 1.00 9.24 ? 908 GLY A C 1 +ATOM 491 O O . GLY A 1 48 ? -11.341 20.317 17.278 1.00 11.50 ? 908 GLY A O 1 +ATOM 492 N N . ILE A 1 49 ? -10.259 18.367 16.958 1.00 8.84 ? 909 ILE A N 1 +ATOM 493 C CA . ILE A 1 49 ? -9.457 18.485 18.171 1.00 8.90 ? 909 ILE A CA 1 +ATOM 494 C C . ILE A 1 49 ? -8.197 19.304 17.892 1.00 8.49 ? 909 ILE A C 1 +ATOM 495 O O . ILE A 1 49 ? -7.928 19.718 16.756 1.00 8.78 ? 909 ILE A O 1 +ATOM 496 C CB . ILE A 1 49 ? -9.092 17.087 18.758 1.00 9.49 ? 909 ILE A CB 1 +ATOM 497 C CG1 . ILE A 1 49 ? -8.128 16.299 17.850 1.00 9.13 ? 909 ILE A CG1 1 +ATOM 498 C CG2 . ILE A 1 49 ? -10.362 16.286 19.026 1.00 11.23 ? 909 ILE A CG2 1 +ATOM 499 C CD1 . ILE A 1 49 ? -7.528 15.078 18.510 1.00 11.14 ? 909 ILE A CD1 1 +ATOM 500 N N . GLY A 1 50 ? -7.432 19.568 18.940 1.00 8.24 ? 910 GLY A N 1 +ATOM 501 C CA . GLY A 1 50 ? -6.162 20.292 18.785 1.00 8.31 ? 910 GLY A CA 1 +ATOM 502 C C . GLY A 1 50 ? -5.090 19.326 18.338 1.00 8.03 ? 910 GLY A C 1 +ATOM 503 O O . GLY A 1 50 ? -4.418 18.719 19.173 1.00 9.32 ? 910 GLY A O 1 +HETATM 504 N N . MSE A 1 51 ? -4.949 19.164 17.029 1.00 7.87 ? 911 MSE A N 1 +HETATM 505 C CA . MSE A 1 51 ? -3.967 18.233 16.446 1.00 7.70 ? 911 MSE A CA 1 +HETATM 506 C C . MSE A 1 51 ? -3.315 18.853 15.229 1.00 7.54 ? 911 MSE A C 1 +HETATM 507 O O . MSE A 1 51 ? -3.829 19.818 14.635 1.00 8.44 ? 911 MSE A O 1 +HETATM 508 C CB . MSE A 1 51 ? -4.610 16.872 16.139 1.00 7.95 ? 911 MSE A CB 1 +HETATM 509 C CG . MSE A 1 51 ? -5.630 16.996 15.000 1.00 8.00 ? 911 MSE A CG 1 +HETATM 510 SE SE . MSE A 1 51 ? -6.297 15.224 14.421 1.00 8.15 ? 911 MSE A SE 1 +HETATM 511 C CE . MSE A 1 51 ? -4.578 14.575 13.737 1.00 8.96 ? 911 MSE A CE 1 +ATOM 512 N N . THR A 1 52 ? -2.173 18.291 14.863 1.00 7.54 ? 912 THR A N 1 +ATOM 513 C CA . THR A 1 52 ? -1.433 18.751 13.707 1.00 7.54 ? 912 THR A CA 1 +ATOM 514 C C . THR A 1 52 ? -0.503 17.637 13.238 1.00 7.16 ? 912 THR A C 1 +ATOM 515 O O . THR A 1 52 ? -0.583 16.506 13.723 1.00 7.55 ? 912 THR A O 1 +ATOM 516 C CB . THR A 1 52 ? -0.688 20.068 14.014 1.00 9.25 ? 912 THR A CB 1 +ATOM 517 O OG1 . THR A 1 52 ? -0.223 20.640 12.795 1.00 10.80 ? 912 THR A OG1 1 +ATOM 518 C CG2 . THR A 1 52 ? 0.453 19.870 14.982 1.00 11.18 ? 912 THR A CG2 1 +ATOM 519 N N . TRP A 1 53 ? 0.365 17.946 12.277 1.00 7.27 ? 913 TRP A N 1 +ATOM 520 C CA . TRP A 1 53 ? 1.409 17.012 11.904 1.00 7.04 ? 913 TRP A CA 1 +ATOM 521 C C . TRP A 1 53 ? 2.673 17.776 11.527 1.00 6.91 ? 913 TRP A C 1 +ATOM 522 O O . TRP A 1 53 ? 2.616 18.945 11.108 1.00 7.32 ? 913 TRP A O 1 +ATOM 523 C CB . TRP A 1 53 ? 0.972 16.062 10.767 1.00 7.28 ? 913 TRP A CB 1 +ATOM 524 C CG . TRP A 1 53 ? 0.652 16.698 9.443 1.00 6.77 ? 913 TRP A CG 1 +ATOM 525 C CD1 . TRP A 1 53 ? -0.589 16.970 8.964 1.00 7.16 ? 913 TRP A CD1 1 +ATOM 526 C CD2 . TRP A 1 53 ? 1.578 17.116 8.427 1.00 6.54 ? 913 TRP A CD2 1 +ATOM 527 N NE1 . TRP A 1 53 ? -0.507 17.540 7.709 1.00 7.17 ? 913 TRP A NE1 1 +ATOM 528 C CE2 . TRP A 1 53 ? 0.818 17.648 7.361 1.00 6.65 ? 913 TRP A CE2 1 +ATOM 529 C CE3 . TRP A 1 53 ? 2.976 17.096 8.315 1.00 6.99 ? 913 TRP A CE3 1 +ATOM 530 C CZ2 . TRP A 1 53 ? 1.417 18.166 6.200 1.00 7.14 ? 913 TRP A CZ2 1 +ATOM 531 C CZ3 . TRP A 1 53 ? 3.561 17.633 7.179 1.00 7.29 ? 913 TRP A CZ3 1 +ATOM 532 C CH2 . TRP A 1 53 ? 2.785 18.154 6.134 1.00 7.21 ? 913 TRP A CH2 1 +ATOM 533 N N . VAL A 1 54 ? 3.813 17.110 11.702 1.00 7.09 ? 914 VAL A N 1 +ATOM 534 C CA . VAL A 1 54 ? 5.106 17.620 11.262 1.00 7.27 ? 914 VAL A CA 1 +ATOM 535 C C . VAL A 1 54 ? 5.860 16.478 10.570 1.00 7.00 ? 914 VAL A C 1 +ATOM 536 O O . VAL A 1 54 ? 5.652 15.299 10.879 1.00 7.72 ? 914 VAL A O 1 +ATOM 537 C CB . VAL A 1 54 ? 5.952 18.227 12.401 1.00 8.56 ? 914 VAL A CB 1 +ATOM 538 C CG1 . VAL A 1 54 ? 5.271 19.419 13.026 1.00 10.49 ? 914 VAL A CG1 1 +ATOM 539 C CG2 . VAL A 1 54 ? 6.350 17.202 13.456 1.00 9.51 ? 914 VAL A CG2 1 +ATOM 540 N N . LEU A 1 55 ? 6.744 16.841 9.650 1.00 7.37 ? 915 LEU A N 1 +ATOM 541 C CA . LEU A 1 55 ? 7.487 15.887 8.838 1.00 7.19 ? 915 LEU A CA 1 +ATOM 542 C C . LEU A 1 55 ? 8.974 16.169 8.907 1.00 7.33 ? 915 LEU A C 1 +ATOM 543 O O . LEU A 1 55 ? 9.383 17.331 8.755 1.00 8.25 ? 915 LEU A O 1 +ATOM 544 C CB . LEU A 1 55 ? 7.033 16.009 7.379 1.00 7.38 ? 915 LEU A CB 1 +ATOM 545 C CG . LEU A 1 55 ? 7.662 15.042 6.376 1.00 7.74 ? 915 LEU A CG 1 +ATOM 546 C CD1 . LEU A 1 55 ? 7.095 13.645 6.536 1.00 8.23 ? 915 LEU A CD1 1 +ATOM 547 C CD2 . LEU A 1 55 ? 7.459 15.549 4.953 1.00 8.65 ? 915 LEU A CD2 1 +ATOM 548 N N . HIS A 1 56 ? 9.783 15.125 9.103 1.00 7.54 ? 916 HIS A N 1 +ATOM 549 C CA . HIS A 1 56 ? 11.226 15.232 9.042 1.00 8.10 ? 916 HIS A CA 1 +ATOM 550 C C . HIS A 1 56 ? 11.797 14.289 7.998 1.00 8.39 ? 916 HIS A C 1 +ATOM 551 O O . HIS A 1 56 ? 11.439 13.110 7.951 1.00 9.26 ? 916 HIS A O 1 +ATOM 552 C CB . HIS A 1 56 ? 11.887 14.878 10.390 1.00 9.27 ? 916 HIS A CB 1 +ATOM 553 C CG . HIS A 1 56 ? 11.597 15.852 11.477 1.00 9.80 ? 916 HIS A CG 1 +ATOM 554 N ND1 . HIS A 1 56 ? 12.301 17.020 11.622 1.00 10.18 ? 916 HIS A ND1 1 +ATOM 555 C CD2 . HIS A 1 56 ? 10.671 15.850 12.460 1.00 12.88 ? 916 HIS A CD2 1 +ATOM 556 C CE1 . HIS A 1 56 ? 11.821 17.692 12.654 1.00 11.24 ? 916 HIS A CE1 1 +ATOM 557 N NE2 . HIS A 1 56 ? 10.820 17.010 13.171 1.00 13.81 ? 916 HIS A NE2 1 +ATOM 558 N N . HIS A 1 57 ? 12.711 14.806 7.181 1.00 8.62 ? 917 HIS A N 1 +ATOM 559 C CA . HIS A 1 57 ? 13.596 13.940 6.405 1.00 8.91 ? 917 HIS A CA 1 +ATOM 560 C C . HIS A 1 57 ? 14.591 13.317 7.396 1.00 8.83 ? 917 HIS A C 1 +ATOM 561 O O . HIS A 1 57 ? 15.000 13.989 8.353 1.00 9.71 ? 917 HIS A O 1 +ATOM 562 C CB . HIS A 1 57 ? 14.314 14.782 5.356 1.00 9.82 ? 917 HIS A CB 1 +ATOM 563 C CG . HIS A 1 57 ? 15.171 14.002 4.410 1.00 10.20 ? 917 HIS A CG 1 +ATOM 564 N ND1 . HIS A 1 57 ? 16.481 13.719 4.664 1.00 12.28 ? 917 HIS A ND1 1 +ATOM 565 C CD2 . HIS A 1 57 ? 14.905 13.498 3.185 1.00 11.76 ? 917 HIS A CD2 1 +ATOM 566 C CE1 . HIS A 1 57 ? 16.983 13.046 3.650 1.00 12.59 ? 917 HIS A CE1 1 +ATOM 567 N NE2 . HIS A 1 57 ? 16.047 12.898 2.739 1.00 11.61 ? 917 HIS A NE2 1 +ATOM 568 N N A GLU A 1 58 ? 14.940 12.040 7.172 0.70 9.21 ? 918 GLU A N 1 +ATOM 569 N N B GLU A 1 58 ? 15.039 12.091 7.163 0.30 8.75 ? 918 GLU A N 1 +ATOM 570 C CA A GLU A 1 58 ? 15.845 11.257 8.041 0.70 10.36 ? 918 GLU A CA 1 +ATOM 571 C CA B GLU A 1 58 ? 15.948 11.482 8.123 0.30 9.18 ? 918 GLU A CA 1 +ATOM 572 C C A GLU A 1 58 ? 17.085 12.023 8.488 0.70 9.93 ? 918 GLU A C 1 +ATOM 573 C C B GLU A 1 58 ? 17.299 12.221 8.257 0.30 9.02 ? 918 GLU A C 1 +ATOM 574 O O A GLU A 1 58 ? 17.599 11.874 9.596 0.70 10.87 ? 918 GLU A O 1 +ATOM 575 O O B GLU A 1 58 ? 17.992 12.019 9.244 0.30 8.83 ? 918 GLU A O 1 +ATOM 576 C CB A GLU A 1 58 ? 16.316 9.958 7.299 0.70 11.06 ? 918 GLU A CB 1 +ATOM 577 C CB B GLU A 1 58 ? 16.180 10.009 7.808 0.30 9.58 ? 918 GLU A CB 1 +ATOM 578 C CG A GLU A 1 58 ? 16.995 10.167 5.933 0.70 12.46 ? 918 GLU A CG 1 +ATOM 579 C CG B GLU A 1 58 ? 16.959 9.782 6.529 0.30 15.36 ? 918 GLU A CG 1 +ATOM 580 C CD A GLU A 1 58 ? 17.447 8.883 5.252 0.70 12.94 ? 918 GLU A CD 1 +ATOM 581 C CD B GLU A 1 58 ? 17.722 8.472 6.530 0.30 16.02 ? 918 GLU A CD 1 +ATOM 582 O OE1 A GLU A 1 58 ? 17.130 8.690 4.050 0.70 12.46 ? 918 GLU A OE1 1 +ATOM 583 O OE1 B GLU A 1 58 ? 17.370 7.573 7.320 0.30 16.21 ? 918 GLU A OE1 1 +ATOM 584 O OE2 A GLU A 1 58 ? 18.139 8.069 5.897 0.70 14.29 ? 918 GLU A OE2 1 +ATOM 585 O OE2 B GLU A 1 58 ? 18.696 8.356 5.751 0.30 16.23 ? 918 GLU A OE2 1 +ATOM 586 N N A SER A 1 59 ? 17.594 12.823 7.565 0.50 8.95 ? 919 SER A N 1 +ATOM 587 N N B SER A 1 59 ? 17.677 13.059 7.291 0.50 9.37 ? 919 SER A N 1 +ATOM 588 C CA A SER A 1 59 ? 18.868 13.528 7.748 0.50 9.29 ? 919 SER A CA 1 +ATOM 589 C CA B SER A 1 59 ? 18.913 13.813 7.443 0.50 10.09 ? 919 SER A CA 1 +ATOM 590 C C A SER A 1 59 ? 18.779 14.812 8.569 0.50 8.91 ? 919 SER A C 1 +ATOM 591 C C B SER A 1 59 ? 18.791 14.940 8.454 0.50 9.23 ? 919 SER A C 1 +ATOM 592 O O A SER A 1 59 ? 19.823 15.416 8.857 0.50 9.28 ? 919 SER A O 1 +ATOM 593 O O B SER A 1 59 ? 19.818 15.523 8.830 0.50 9.56 ? 919 SER A O 1 +ATOM 594 C CB A SER A 1 59 ? 19.512 13.879 6.378 0.50 9.97 ? 919 SER A CB 1 +ATOM 595 C CB B SER A 1 59 ? 19.352 14.410 6.100 0.50 11.91 ? 919 SER A CB 1 +ATOM 596 O OG A SER A 1 59 ? 19.721 12.766 5.526 0.50 10.91 ? 919 SER A OG 1 +ATOM 597 O OG B SER A 1 59 ? 18.448 15.411 5.670 0.50 13.85 ? 919 SER A OG 1 +ATOM 598 N N . ASP A 1 60 ? 17.568 15.271 8.886 1.00 8.75 ? 920 ASP A N 1 +ATOM 599 C CA . ASP A 1 60 ? 17.401 16.430 9.743 1.00 8.86 ? 920 ASP A CA 1 +ATOM 600 C C . ASP A 1 60 ? 16.176 16.256 10.619 1.00 8.57 ? 920 ASP A C 1 +ATOM 601 O O . ASP A 1 60 ? 15.039 16.538 10.221 1.00 9.32 ? 920 ASP A O 1 +ATOM 602 C CB . ASP A 1 60 ? 17.362 17.718 8.927 1.00 9.72 ? 920 ASP A CB 1 +ATOM 603 C CG . ASP A 1 60 ? 17.545 18.950 9.776 1.00 10.72 ? 920 ASP A CG 1 +ATOM 604 O OD1 . ASP A 1 60 ? 17.318 18.888 11.000 1.00 10.81 ? 920 ASP A OD1 1 +ATOM 605 O OD2 . ASP A 1 60 ? 17.897 20.005 9.217 1.00 13.07 ? 920 ASP A OD2 1 +HETATM 606 N N A MSE A 1 61 ? 16.436 15.719 11.809 0.60 9.17 ? 921 MSE A N 1 +HETATM 607 N N B MSE A 1 61 ? 16.429 15.853 11.857 0.40 9.17 ? 921 MSE A N 1 +HETATM 608 C CA A MSE A 1 61 ? 15.408 15.417 12.811 0.60 9.93 ? 921 MSE A CA 1 +HETATM 609 C CA B MSE A 1 61 ? 15.363 15.673 12.826 0.40 9.91 ? 921 MSE A CA 1 +HETATM 610 C C A MSE A 1 61 ? 15.026 16.603 13.675 0.60 10.78 ? 921 MSE A C 1 +HETATM 611 C C B MSE A 1 61 ? 15.168 16.934 13.658 0.40 10.80 ? 921 MSE A C 1 +HETATM 612 O O A MSE A 1 61 ? 14.257 16.456 14.629 0.60 12.91 ? 921 MSE A O 1 +HETATM 613 O O B MSE A 1 61 ? 14.386 16.920 14.603 0.40 11.92 ? 921 MSE A O 1 +HETATM 614 C CB A MSE A 1 61 ? 15.904 14.253 13.682 0.60 10.89 ? 921 MSE A CB 1 +HETATM 615 C CB B MSE A 1 61 ? 15.615 14.395 13.649 0.40 10.36 ? 921 MSE A CB 1 +HETATM 616 C CG A MSE A 1 61 ? 16.092 12.969 12.882 0.60 11.55 ? 921 MSE A CG 1 +HETATM 617 C CG B MSE A 1 61 ? 16.045 13.193 12.786 0.40 10.71 ? 921 MSE A CG 1 +HETATM 618 SE SE A MSE A 1 61 ? 14.427 12.396 12.001 0.60 11.99 ? 921 MSE A SE 1 +HETATM 619 SE SE B MSE A 1 61 ? 14.606 12.336 11.714 0.40 10.24 ? 921 MSE A SE 1 +HETATM 620 C CE A MSE A 1 61 ? 13.253 12.284 13.558 0.60 14.33 ? 921 MSE A CE 1 +HETATM 621 C CE B MSE A 1 61 ? 13.718 11.366 13.187 0.40 11.09 ? 921 MSE A CE 1 +ATOM 622 N N A GLN A 1 62 ? 15.547 17.800 13.324 0.50 10.94 ? 922 GLN A N 1 +ATOM 623 N N B GLN A 1 62 ? 15.825 18.048 13.299 0.50 11.66 ? 922 GLN A N 1 +ATOM 624 C CA A GLN A 1 62 ? 15.250 19.086 14.015 0.50 11.59 ? 922 GLN A CA 1 +ATOM 625 C CA B GLN A 1 62 ? 15.632 19.291 14.040 0.50 12.64 ? 922 GLN A CA 1 +ATOM 626 C C A GLN A 1 62 ? 14.461 20.051 13.139 0.50 11.75 ? 922 GLN A C 1 +ATOM 627 C C B GLN A 1 62 ? 14.720 20.236 13.262 0.50 12.62 ? 922 GLN A C 1 +ATOM 628 O O A GLN A 1 62 ? 13.400 20.545 13.528 0.50 11.95 ? 922 GLN A O 1 +ATOM 629 O O B GLN A 1 62 ? 13.802 20.821 13.829 0.50 15.06 ? 922 GLN A O 1 +ATOM 630 C CB A GLN A 1 62 ? 16.545 19.787 14.415 0.50 12.11 ? 922 GLN A CB 1 +ATOM 631 C CB B GLN A 1 62 ? 16.983 19.947 14.330 0.50 13.86 ? 922 GLN A CB 1 +ATOM 632 C CG A GLN A 1 62 ? 17.364 19.062 15.462 0.50 13.95 ? 922 GLN A CG 1 +ATOM 633 C CG B GLN A 1 62 ? 16.870 21.314 14.984 0.50 24.84 ? 922 GLN A CG 1 +ATOM 634 C CD A GLN A 1 62 ? 16.670 19.016 16.818 0.50 14.18 ? 922 GLN A CD 1 +ATOM 635 C CD B GLN A 1 62 ? 16.100 21.282 16.292 0.50 24.77 ? 922 GLN A CD 1 +ATOM 636 O OE1 A GLN A 1 62 ? 15.621 19.645 17.028 0.50 14.60 ? 922 GLN A OE1 1 +ATOM 637 O OE1 B GLN A 1 62 ? 16.097 20.278 17.001 0.50 24.51 ? 922 GLN A OE1 1 +ATOM 638 N NE2 A GLN A 1 62 ? 17.246 18.263 17.745 0.50 14.87 ? 922 GLN A NE2 1 +ATOM 639 N NE2 B GLN A 1 62 ? 15.449 22.394 16.624 0.50 24.45 ? 922 GLN A NE2 1 +ATOM 640 N N . ASN A 1 63 ? 14.976 20.368 11.966 1.00 12.45 ? 923 ASN A N 1 +ATOM 641 C CA . ASN A 1 63 ? 14.226 21.255 11.084 1.00 12.91 ? 923 ASN A CA 1 +ATOM 642 C C . ASN A 1 63 ? 13.167 20.464 10.364 1.00 11.20 ? 923 ASN A C 1 +ATOM 643 O O . ASN A 1 63 ? 13.429 19.351 9.927 1.00 12.37 ? 923 ASN A O 1 +ATOM 644 C CB . ASN A 1 63 ? 15.179 21.919 10.112 1.00 15.51 ? 923 ASN A CB 1 +ATOM 645 C CG . ASN A 1 63 ? 16.211 22.767 10.829 1.00 18.34 ? 923 ASN A CG 1 +ATOM 646 O OD1 . ASN A 1 63 ? 15.877 23.735 11.515 1.00 22.80 ? 923 ASN A OD1 1 +ATOM 647 N ND2 . ASN A 1 63 ? 17.470 22.401 10.693 1.00 19.92 ? 923 ASN A ND2 1 +ATOM 648 N N . TYR A 1 64 ? 11.979 21.038 10.236 1.00 11.45 ? 924 TYR A N 1 +ATOM 649 C CA . TYR A 1 64 ? 10.907 20.335 9.557 1.00 11.31 ? 924 TYR A CA 1 +ATOM 650 C C . TYR A 1 64 ? 11.103 20.388 8.061 1.00 11.27 ? 924 TYR A C 1 +ATOM 651 O O . TYR A 1 64 ? 11.393 21.434 7.507 1.00 14.86 ? 924 TYR A O 1 +ATOM 652 C CB . TYR A 1 64 ? 9.546 20.966 9.865 1.00 12.49 ? 924 TYR A CB 1 +ATOM 653 C CG . TYR A 1 64 ? 9.224 21.064 11.325 1.00 13.36 ? 924 TYR A CG 1 +ATOM 654 C CD1 . TYR A 1 64 ? 9.253 19.930 12.121 1.00 13.42 ? 924 TYR A CD1 1 +ATOM 655 C CD2 . TYR A 1 64 ? 8.850 22.273 11.913 1.00 15.08 ? 924 TYR A CD2 1 +ATOM 656 C CE1 . TYR A 1 64 ? 8.957 19.987 13.468 1.00 14.93 ? 924 TYR A CE1 1 +ATOM 657 C CE2 . TYR A 1 64 ? 8.528 22.339 13.267 1.00 16.57 ? 924 TYR A CE2 1 +ATOM 658 C CZ . TYR A 1 64 ? 8.582 21.182 14.037 1.00 15.76 ? 924 TYR A CZ 1 +ATOM 659 O OH . TYR A 1 64 ? 8.271 21.202 15.375 1.00 18.97 ? 924 TYR A OH 1 +ATOM 660 N N . ALA A 1 65 ? 10.914 19.258 7.407 1.00 9.38 ? 925 ALA A N 1 +ATOM 661 C CA . ALA A 1 65 ? 10.833 19.234 5.958 1.00 9.82 ? 925 ALA A CA 1 +ATOM 662 C C . ALA A 1 65 ? 9.524 19.881 5.489 1.00 9.92 ? 925 ALA A C 1 +ATOM 663 O O . ALA A 1 65 ? 9.492 20.497 4.433 1.00 12.13 ? 925 ALA A O 1 +ATOM 664 C CB . ALA A 1 65 ? 10.937 17.812 5.456 1.00 10.55 ? 925 ALA A CB 1 +ATOM 665 N N . ALA A 1 66 ? 8.465 19.712 6.282 1.00 8.89 ? 926 ALA A N 1 +ATOM 666 C CA . ALA A 1 66 ? 7.156 20.310 6.025 1.00 8.82 ? 926 ALA A CA 1 +ATOM 667 C C . ALA A 1 66 ? 6.360 20.220 7.321 1.00 7.90 ? 926 ALA A C 1 +ATOM 668 O O . ALA A 1 66 ? 6.721 19.449 8.227 1.00 7.95 ? 926 ALA A O 1 +ATOM 669 C CB . ALA A 1 66 ? 6.432 19.587 4.901 1.00 9.58 ? 926 ALA A CB 1 +ATOM 670 N N . TYR A 1 67 ? 5.271 20.969 7.396 1.00 8.12 ? 927 TYR A N 1 +ATOM 671 C CA . TYR A 1 67 ? 4.360 20.857 8.528 1.00 8.15 ? 927 TYR A CA 1 +ATOM 672 C C . TYR A 1 67 ? 2.960 21.148 8.051 1.00 7.56 ? 927 TYR A C 1 +ATOM 673 O O . TYR A 1 67 ? 2.746 21.825 7.033 1.00 8.86 ? 927 TYR A O 1 +ATOM 674 C CB . TYR A 1 67 ? 4.767 21.781 9.683 1.00 10.37 ? 927 TYR A CB 1 +ATOM 675 C CG . TYR A 1 67 ? 4.943 23.205 9.294 1.00 14.22 ? 927 TYR A CG 1 +ATOM 676 C CD1 . TYR A 1 67 ? 3.857 24.061 9.246 1.00 17.22 ? 927 TYR A CD1 1 +ATOM 677 C CD2 . TYR A 1 67 ? 6.200 23.704 8.962 1.00 18.07 ? 927 TYR A CD2 1 +ATOM 678 C CE1 . TYR A 1 67 ? 4.012 25.387 8.887 1.00 21.73 ? 927 TYR A CE1 1 +ATOM 679 C CE2 . TYR A 1 67 ? 6.374 25.032 8.615 1.00 22.07 ? 927 TYR A CE2 1 +ATOM 680 C CZ . TYR A 1 67 ? 5.274 25.862 8.566 1.00 24.19 ? 927 TYR A CZ 1 +ATOM 681 O OH . TYR A 1 67 ? 5.442 27.175 8.213 1.00 30.67 ? 927 TYR A OH 1 +ATOM 682 N N . GLY A 1 68 ? 1.980 20.630 8.778 1.00 7.62 ? 928 GLY A N 1 +ATOM 683 C CA . GLY A 1 68 ? 0.607 20.857 8.410 1.00 7.85 ? 928 GLY A CA 1 +ATOM 684 C C . GLY A 1 68 ? 0.093 22.229 8.772 1.00 8.31 ? 928 GLY A C 1 +ATOM 685 O O . GLY A 1 68 ? 0.450 22.793 9.811 1.00 11.31 ? 928 GLY A O 1 +ATOM 686 N N A GLN A 1 69 ? -0.737 22.787 7.905 0.50 7.71 ? 929 GLN A N 1 +ATOM 687 N N B GLN A 1 69 ? -0.718 22.787 7.870 0.50 7.69 ? 929 GLN A N 1 +ATOM 688 C CA A GLN A 1 69 ? -1.426 24.028 8.220 0.50 7.90 ? 929 GLN A CA 1 +ATOM 689 C CA B GLN A 1 69 ? -1.446 24.039 8.107 0.50 7.90 ? 929 GLN A CA 1 +ATOM 690 C C A GLN A 1 69 ? -2.911 23.746 8.161 0.50 7.29 ? 929 GLN A C 1 +ATOM 691 C C B GLN A 1 69 ? -2.929 23.718 8.153 0.50 7.32 ? 929 GLN A C 1 +ATOM 692 O O A GLN A 1 69 ? -3.423 23.198 7.176 0.50 7.62 ? 929 GLN A O 1 +ATOM 693 O O B GLN A 1 69 ? -3.466 23.116 7.215 0.50 7.50 ? 929 GLN A O 1 +ATOM 694 C CB A GLN A 1 69 ? -1.033 25.130 7.254 0.50 9.16 ? 929 GLN A CB 1 +ATOM 695 C CB B GLN A 1 69 ? -1.179 25.066 6.995 0.50 9.29 ? 929 GLN A CB 1 +ATOM 696 C CG A GLN A 1 69 ? -1.800 26.418 7.426 0.50 10.59 ? 929 GLN A CG 1 +ATOM 697 C CG B GLN A 1 69 ? -2.068 26.295 7.087 0.50 11.26 ? 929 GLN A CG 1 +ATOM 698 C CD A GLN A 1 69 ? -1.417 27.419 6.370 0.50 12.46 ? 929 GLN A CD 1 +ATOM 699 C CD B GLN A 1 69 ? -1.693 27.388 6.103 0.50 13.00 ? 929 GLN A CD 1 +ATOM 700 O OE1 A GLN A 1 69 ? -0.249 27.774 6.245 0.50 14.78 ? 929 GLN A OE1 1 +ATOM 701 O OE1 B GLN A 1 69 ? -0.562 27.438 5.608 0.50 15.22 ? 929 GLN A OE1 1 +ATOM 702 N NE2 A GLN A 1 69 ? -2.384 27.843 5.569 0.50 14.54 ? 929 GLN A NE2 1 +ATOM 703 N NE2 B GLN A 1 69 ? -2.635 28.287 5.831 0.50 14.40 ? 929 GLN A NE2 1 +ATOM 704 N N . ALA A 1 70 ? -3.606 24.125 9.227 1.00 8.02 ? 930 ALA A N 1 +ATOM 705 C CA . ALA A 1 70 ? -5.026 23.882 9.348 1.00 8.63 ? 930 ALA A CA 1 +ATOM 706 C C . ALA A 1 70 ? -5.820 24.841 8.460 1.00 9.04 ? 930 ALA A C 1 +ATOM 707 O O . ALA A 1 70 ? -5.584 26.044 8.442 1.00 11.94 ? 930 ALA A O 1 +ATOM 708 C CB . ALA A 1 70 ? -5.466 24.023 10.794 1.00 11.45 ? 930 ALA A CB 1 +ATOM 709 N N . ASN A 1 71 ? -6.744 24.265 7.708 1.00 9.39 ? 931 ASN A N 1 +ATOM 710 C CA . ASN A 1 71 ? -7.691 24.963 6.836 1.00 9.46 ? 931 ASN A CA 1 +ATOM 711 C C . ASN A 1 71 ? -9.020 24.282 7.131 1.00 9.38 ? 931 ASN A C 1 +ATOM 712 O O . ASN A 1 71 ? -9.353 23.268 6.517 1.00 9.42 ? 931 ASN A O 1 +ATOM 713 C CB . ASN A 1 71 ? -7.234 24.795 5.384 1.00 9.68 ? 931 ASN A CB 1 +ATOM 714 C CG . ASN A 1 71 ? -8.184 25.415 4.381 1.00 10.53 ? 931 ASN A CG 1 +ATOM 715 O OD1 . ASN A 1 71 ? -9.044 26.246 4.712 1.00 11.41 ? 931 ASN A OD1 1 +ATOM 716 N ND2 . ASN A 1 71 ? -8.004 25.033 3.127 1.00 11.65 ? 931 ASN A ND2 1 +ATOM 717 N N . GLY A 1 72 ? -9.739 24.805 8.125 1.00 10.41 ? 932 GLY A N 1 +ATOM 718 C CA . GLY A 1 72 ? -10.892 24.069 8.658 1.00 11.14 ? 932 GLY A CA 1 +ATOM 719 C C . GLY A 1 72 ? -10.427 22.709 9.204 1.00 11.08 ? 932 GLY A C 1 +ATOM 720 O O . GLY A 1 72 ? -9.440 22.636 9.939 1.00 12.86 ? 932 GLY A O 1 +ATOM 721 N N . ASN A 1 73 ? -11.111 21.639 8.793 1.00 10.40 ? 933 ASN A N 1 +ATOM 722 C CA . ASN A 1 73 ? -10.769 20.262 9.200 1.00 10.50 ? 933 ASN A CA 1 +ATOM 723 C C . ASN A 1 73 ? -9.611 19.663 8.418 1.00 8.97 ? 933 ASN A C 1 +ATOM 724 O O . ASN A 1 73 ? -9.203 18.566 8.730 1.00 10.18 ? 933 ASN A O 1 +ATOM 725 C CB . ASN A 1 73 ? -11.996 19.300 9.086 1.00 11.61 ? 933 ASN A CB 1 +ATOM 726 C CG . ASN A 1 73 ? -12.415 19.035 7.643 1.00 11.81 ? 933 ASN A CG 1 +ATOM 727 O OD1 . ASN A 1 73 ? -12.363 19.924 6.786 1.00 13.64 ? 933 ASN A OD1 1 +ATOM 728 N ND2 . ASN A 1 73 ? -12.852 17.806 7.366 1.00 13.66 ? 933 ASN A ND2 1 +ATOM 729 N N . HIS A 1 74 ? -9.115 20.345 7.391 1.00 8.58 ? 934 HIS A N 1 +ATOM 730 C CA . HIS A 1 74 ? -8.008 19.835 6.579 1.00 8.46 ? 934 HIS A CA 1 +ATOM 731 C C . HIS A 1 74 ? -6.696 20.387 7.097 1.00 8.51 ? 934 HIS A C 1 +ATOM 732 O O . HIS A 1 74 ? -6.520 21.592 7.142 1.00 13.00 ? 934 HIS A O 1 +ATOM 733 C CB . HIS A 1 74 ? -8.160 20.292 5.116 1.00 10.26 ? 934 HIS A CB 1 +ATOM 734 C CG . HIS A 1 74 ? -9.146 19.521 4.294 1.00 12.68 ? 934 HIS A CG 1 +ATOM 735 N ND1 . HIS A 1 74 ? -10.487 19.456 4.580 1.00 14.33 ? 934 HIS A ND1 1 +ATOM 736 C CD2 . HIS A 1 74 ? -8.976 18.825 3.145 1.00 15.10 ? 934 HIS A CD2 1 +ATOM 737 C CE1 . HIS A 1 74 ? -11.099 18.734 3.659 1.00 16.27 ? 934 HIS A CE1 1 +ATOM 738 N NE2 . HIS A 1 74 ? -10.202 18.340 2.776 1.00 17.95 ? 934 HIS A NE2 1 +ATOM 739 N N . ILE A 1 75 ? -5.759 19.518 7.448 1.00 6.88 ? 935 ILE A N 1 +ATOM 740 C CA . ILE A 1 75 ? -4.444 19.930 7.941 1.00 6.67 ? 935 ILE A CA 1 +ATOM 741 C C . ILE A 1 75 ? -3.458 19.473 6.850 1.00 6.41 ? 935 ILE A C 1 +ATOM 742 O O . ILE A 1 75 ? -3.202 18.268 6.729 1.00 6.52 ? 935 ILE A O 1 +ATOM 743 C CB . ILE A 1 75 ? -4.127 19.323 9.307 1.00 7.16 ? 935 ILE A CB 1 +ATOM 744 C CG1 . ILE A 1 75 ? -5.255 19.612 10.313 1.00 8.12 ? 935 ILE A CG1 1 +ATOM 745 C CG2 . ILE A 1 75 ? -2.790 19.840 9.790 1.00 7.90 ? 935 ILE A CG2 1 +ATOM 746 C CD1 . ILE A 1 75 ? -5.119 18.843 11.603 1.00 9.50 ? 935 ILE A CD1 1 +ATOM 747 N N A GLU A 1 76 ? -2.983 20.407 6.019 0.50 7.08 ? 936 GLU A N 1 +ATOM 748 N N B GLU A 1 76 ? -2.905 20.428 6.102 0.50 6.76 ? 936 GLU A N 1 +ATOM 749 C CA A GLU A 1 76 ? -2.313 20.021 4.774 0.50 7.50 ? 936 GLU A CA 1 +ATOM 750 C CA B GLU A 1 76 ? -2.363 20.112 4.784 0.50 7.28 ? 936 GLU A CA 1 +ATOM 751 C C A GLU A 1 76 ? -1.021 20.758 4.500 0.50 6.70 ? 936 GLU A C 1 +ATOM 752 C C B GLU A 1 76 ? -1.068 20.821 4.432 0.50 6.87 ? 936 GLU A C 1 +ATOM 753 O O A GLU A 1 76 ? -0.685 21.775 5.131 0.50 7.10 ? 936 GLU A O 1 +ATOM 754 O O B GLU A 1 76 ? -0.779 21.905 4.942 0.50 7.10 ? 936 GLU A O 1 +ATOM 755 C CB A GLU A 1 76 ? -3.252 20.242 3.550 0.50 9.27 ? 936 GLU A CB 1 +ATOM 756 C CB B GLU A 1 76 ? -3.432 20.519 3.746 0.50 7.86 ? 936 GLU A CB 1 +ATOM 757 C CG A GLU A 1 76 ? -4.671 19.737 3.732 0.50 10.33 ? 936 GLU A CG 1 +ATOM 758 C CG B GLU A 1 76 ? -3.757 21.996 3.812 0.50 10.78 ? 936 GLU A CG 1 +ATOM 759 C CD A GLU A 1 76 ? -5.522 19.796 2.466 0.50 10.81 ? 936 GLU A CD 1 +ATOM 760 C CD B GLU A 1 76 ? -4.997 22.408 3.022 0.50 11.20 ? 936 GLU A CD 1 +ATOM 761 O OE1 A GLU A 1 76 ? -5.759 20.900 1.905 0.50 11.08 ? 936 GLU A OE1 1 +ATOM 762 O OE1 B GLU A 1 76 ? -5.755 21.534 2.542 0.50 11.81 ? 936 GLU A OE1 1 +ATOM 763 O OE2 A GLU A 1 76 ? -5.994 18.727 2.042 0.50 11.44 ? 936 GLU A OE2 1 +ATOM 764 O OE2 B GLU A 1 76 ? -5.229 23.639 2.910 0.50 11.16 ? 936 GLU A OE2 1 +ATOM 765 N N . ALA A 1 77 ? -0.319 20.213 3.510 1.00 7.02 ? 937 ALA A N 1 +ATOM 766 C CA . ALA A 1 77 ? 0.853 20.830 2.884 1.00 7.13 ? 937 ALA A CA 1 +ATOM 767 C C . ALA A 1 77 ? 1.060 20.181 1.519 1.00 7.20 ? 937 ALA A C 1 +ATOM 768 O O . ALA A 1 77 ? 0.750 19.005 1.329 1.00 8.13 ? 937 ALA A O 1 +ATOM 769 C CB . ALA A 1 77 ? 2.109 20.650 3.715 1.00 8.18 ? 937 ALA A CB 1 +ATOM 770 N N A ASN A 1 78 ? 1.753 20.886 0.629 0.50 7.41 ? 938 ASN A N 1 +ATOM 771 N N B ASN A 1 78 ? 1.517 21.015 0.582 0.50 7.76 ? 938 ASN A N 1 +ATOM 772 C CA A ASN A 1 78 ? 2.149 20.335 -0.679 0.50 7.58 ? 938 ASN A CA 1 +ATOM 773 C CA B ASN A 1 78 ? 1.935 20.619 -0.752 0.50 8.55 ? 938 ASN A CA 1 +ATOM 774 C C A ASN A 1 78 ? 3.493 20.983 -1.003 0.50 7.52 ? 938 ASN A C 1 +ATOM 775 C C B ASN A 1 78 ? 3.350 21.153 -0.844 0.50 8.19 ? 938 ASN A C 1 +ATOM 776 O O A ASN A 1 78 ? 3.592 22.219 -1.093 0.50 7.67 ? 938 ASN A O 1 +ATOM 777 O O B ASN A 1 78 ? 3.573 22.333 -0.627 0.50 8.00 ? 938 ASN A O 1 +ATOM 778 C CB A ASN A 1 78 ? 1.066 20.630 -1.714 0.50 7.81 ? 938 ASN A CB 1 +ATOM 779 C CB B ASN A 1 78 ? 1.116 21.307 -1.850 0.50 9.86 ? 938 ASN A CB 1 +ATOM 780 C CG A ASN A 1 78 ? 1.373 20.068 -3.080 0.50 11.40 ? 938 ASN A CG 1 +ATOM 781 C CG B ASN A 1 78 ? -0.220 20.664 -2.085 0.50 14.82 ? 938 ASN A CG 1 +ATOM 782 O OD1 A ASN A 1 78 ? 2.459 20.266 -3.619 0.50 11.74 ? 938 ASN A OD1 1 +ATOM 783 O OD1 B ASN A 1 78 ? -0.369 19.855 -3.006 0.50 15.94 ? 938 ASN A OD1 1 +ATOM 784 N ND2 A ASN A 1 78 ? 0.383 19.418 -3.677 0.50 12.08 ? 938 ASN A ND2 1 +ATOM 785 N ND2 B ASN A 1 78 ? -1.203 21.012 -1.260 0.50 14.77 ? 938 ASN A ND2 1 +ATOM 786 N N A PHE A 1 79 ? 4.530 20.161 -1.159 0.60 8.43 ? 939 PHE A N 1 +ATOM 787 N N B PHE A 1 79 ? 4.337 20.295 -1.132 0.40 8.82 ? 939 PHE A N 1 +ATOM 788 C CA A PHE A 1 79 ? 5.878 20.677 -1.166 0.60 8.91 ? 939 PHE A CA 1 +ATOM 789 C CA B PHE A 1 79 ? 5.746 20.751 -1.262 0.40 9.02 ? 939 PHE A CA 1 +ATOM 790 C C A PHE A 1 79 ? 6.744 19.696 -1.897 0.60 10.02 ? 939 PHE A C 1 +ATOM 791 C C B PHE A 1 79 ? 6.616 19.763 -2.063 0.40 9.88 ? 939 PHE A C 1 +ATOM 792 O O A PHE A 1 79 ? 6.449 18.509 -1.962 0.60 10.45 ? 939 PHE A O 1 +ATOM 793 O O B PHE A 1 79 ? 6.175 18.636 -2.353 0.40 9.77 ? 939 PHE A O 1 +ATOM 794 C CB A PHE A 1 79 ? 6.337 20.787 0.287 0.60 10.03 ? 939 PHE A CB 1 +ATOM 795 C CB B PHE A 1 79 ? 6.386 21.012 0.121 0.40 9.43 ? 939 PHE A CB 1 +ATOM 796 C CG A PHE A 1 79 ? 6.190 19.495 1.028 0.60 12.33 ? 939 PHE A CG 1 +ATOM 797 C CG B PHE A 1 79 ? 6.968 19.773 0.782 0.40 12.96 ? 939 PHE A CG 1 +ATOM 798 C CD1 A PHE A 1 79 ? 4.951 19.105 1.530 0.60 12.13 ? 939 PHE A CD1 1 +ATOM 799 C CD1 B PHE A 1 79 ? 6.140 18.785 1.303 0.40 12.80 ? 939 PHE A CD1 1 +ATOM 800 C CD2 A PHE A 1 79 ? 7.256 18.615 1.131 0.60 12.77 ? 939 PHE A CD2 1 +ATOM 801 C CD2 B PHE A 1 79 ? 8.349 19.601 0.900 0.40 13.45 ? 939 PHE A CD2 1 +ATOM 802 C CE1 A PHE A 1 79 ? 4.787 17.885 2.153 0.60 12.54 ? 939 PHE A CE1 1 +ATOM 803 C CE1 B PHE A 1 79 ? 6.677 17.650 1.903 0.40 13.18 ? 939 PHE A CE1 1 +ATOM 804 C CE2 A PHE A 1 79 ? 7.098 17.392 1.768 0.60 12.98 ? 939 PHE A CE2 1 +ATOM 805 C CE2 B PHE A 1 79 ? 8.884 18.473 1.502 0.40 13.75 ? 939 PHE A CE2 1 +ATOM 806 C CZ A PHE A 1 79 ? 5.863 17.036 2.278 0.60 13.00 ? 939 PHE A CZ 1 +ATOM 807 C CZ B PHE A 1 79 ? 8.050 17.500 1.996 0.40 13.63 ? 939 PHE A CZ 1 +ATOM 808 N N . ASN A 1 80 ? 7.843 20.194 -2.419 1.00 10.93 ? 940 ASN A N 1 +ATOM 809 C CA . ASN A 1 80 ? 8.785 19.353 -3.143 1.00 12.63 ? 940 ASN A CA 1 +ATOM 810 C C . ASN A 1 80 ? 9.654 18.604 -2.141 1.00 13.22 ? 940 ASN A C 1 +ATOM 811 O O . ASN A 1 80 ? 10.360 19.208 -1.342 1.00 16.11 ? 940 ASN A O 1 +ATOM 812 C CB . ASN A 1 80 ? 9.635 20.199 -4.076 1.00 14.74 ? 940 ASN A CB 1 +ATOM 813 C CG . ASN A 1 80 ? 10.353 19.361 -5.113 1.00 17.56 ? 940 ASN A CG 1 +ATOM 814 O OD1 . ASN A 1 80 ? 11.534 19.098 -4.979 1.00 21.41 ? 940 ASN A OD1 1 +ATOM 815 N ND2 . ASN A 1 80 ? 9.621 18.882 -6.119 1.00 18.57 ? 940 ASN A ND2 1 +ATOM 816 N N . ALA A 1 81 ? 9.549 17.281 -2.172 1.00 13.69 ? 941 ALA A N 1 +ATOM 817 C CA . ALA A 1 81 ? 10.278 16.387 -1.274 1.00 13.27 ? 941 ALA A CA 1 +ATOM 818 C C . ALA A 1 81 ? 11.495 15.806 -1.960 1.00 13.90 ? 941 ALA A C 1 +ATOM 819 O O . ALA A 1 81 ? 11.381 15.157 -3.003 1.00 15.37 ? 941 ALA A O 1 +ATOM 820 C CB . ALA A 1 81 ? 9.373 15.254 -0.833 1.00 13.17 ? 941 ALA A CB 1 +ATOM 821 N N . LYS A 1 82 ? 12.662 16.050 -1.377 1.00 14.19 ? 942 LYS A N 1 +ATOM 822 C CA . LYS A 1 82 ? 13.892 15.460 -1.886 1.00 14.19 ? 942 LYS A CA 1 +ATOM 823 C C . LYS A 1 82 ? 13.912 13.958 -1.565 1.00 12.19 ? 942 LYS A C 1 +ATOM 824 O O . LYS A 1 82 ? 13.185 13.479 -0.690 1.00 11.69 ? 942 LYS A O 1 +ATOM 825 C CB . LYS A 1 82 ? 15.115 16.172 -1.317 1.00 16.41 ? 942 LYS A CB 1 +ATOM 826 C CG . LYS A 1 82 ? 15.355 15.916 0.149 1.00 15.62 ? 942 LYS A CG 1 +ATOM 827 C CD . LYS A 1 82 ? 16.546 16.732 0.620 1.00 31.54 ? 942 LYS A CD 1 +ATOM 828 C CE . LYS A 1 82 ? 16.811 16.547 2.102 1.00 31.61 ? 942 LYS A CE 1 +ATOM 829 N NZ . LYS A 1 82 ? 17.990 17.343 2.542 1.00 33.19 ? 942 LYS A NZ 1 +ATOM 830 N N A PRO A 1 83 ? 14.748 13.197 -2.287 0.50 11.65 ? 943 PRO A N 1 +ATOM 831 N N B PRO A 1 83 ? 14.767 13.202 -2.262 0.50 12.07 ? 943 PRO A N 1 +ATOM 832 C CA A PRO A 1 83 ? 14.808 11.768 -2.035 0.50 10.89 ? 943 PRO A CA 1 +ATOM 833 C CA B PRO A 1 83 ? 14.750 11.766 -2.041 0.50 11.40 ? 943 PRO A CA 1 +ATOM 834 C C A PRO A 1 83 ? 15.211 11.379 -0.615 0.50 10.05 ? 943 PRO A C 1 +ATOM 835 C C B PRO A 1 83 ? 15.250 11.344 -0.661 0.50 10.60 ? 943 PRO A C 1 +ATOM 836 O O A PRO A 1 83 ? 15.946 12.115 0.057 0.50 10.47 ? 943 PRO A O 1 +ATOM 837 O O B PRO A 1 83 ? 16.087 12.027 -0.062 0.50 11.02 ? 943 PRO A O 1 +ATOM 838 C CB A PRO A 1 83 ? 15.878 11.287 -3.025 0.50 11.58 ? 943 PRO A CB 1 +ATOM 839 C CB B PRO A 1 83 ? 15.666 11.223 -3.147 0.50 13.00 ? 943 PRO A CB 1 +ATOM 840 C CG A PRO A 1 83 ? 15.766 12.237 -4.160 0.50 11.99 ? 943 PRO A CG 1 +ATOM 841 C CG B PRO A 1 83 ? 16.555 12.360 -3.508 0.50 13.95 ? 943 PRO A CG 1 +ATOM 842 C CD A PRO A 1 83 ? 15.471 13.561 -3.523 0.50 12.61 ? 943 PRO A CD 1 +ATOM 843 C CD B PRO A 1 83 ? 15.774 13.606 -3.263 0.50 13.80 ? 943 PRO A CD 1 +ATOM 844 N N . GLY A 1 84 ? 14.726 10.216 -0.185 1.00 10.27 ? 944 GLY A N 1 +ATOM 845 C CA . GLY A 1 84 ? 15.143 9.610 1.062 1.00 10.47 ? 944 GLY A CA 1 +ATOM 846 C C . GLY A 1 84 ? 13.988 9.192 1.938 1.00 9.20 ? 944 GLY A C 1 +ATOM 847 O O . GLY A 1 84 ? 12.822 9.208 1.526 1.00 10.02 ? 944 GLY A O 1 +ATOM 848 N N A LYS A 1 85 ? 14.338 8.842 3.170 0.50 9.47 ? 945 LYS A N 1 +ATOM 849 N N B LYS A 1 85 ? 14.331 8.772 3.156 0.50 9.56 ? 945 LYS A N 1 +ATOM 850 C CA A LYS A 1 85 ? 13.395 8.352 4.165 0.50 9.38 ? 945 LYS A CA 1 +ATOM 851 C CA B LYS A 1 85 ? 13.343 8.339 4.145 0.50 9.39 ? 945 LYS A CA 1 +ATOM 852 C C A LYS A 1 85 ? 12.849 9.489 5.033 0.50 8.77 ? 945 LYS A C 1 +ATOM 853 C C B LYS A 1 85 ? 12.819 9.538 4.914 0.50 8.76 ? 945 LYS A C 1 +ATOM 854 O O A LYS A 1 85 ? 13.618 10.331 5.524 0.50 8.98 ? 945 LYS A O 1 +ATOM 855 O O B LYS A 1 85 ? 13.567 10.485 5.199 0.50 9.01 ? 945 LYS A O 1 +ATOM 856 C CB A LYS A 1 85 ? 14.113 7.323 5.038 0.50 10.97 ? 945 LYS A CB 1 +ATOM 857 C CB B LYS A 1 85 ? 13.953 7.320 5.126 0.50 10.79 ? 945 LYS A CB 1 +ATOM 858 C CG A LYS A 1 85 ? 13.224 6.594 6.019 0.50 12.00 ? 945 LYS A CG 1 +ATOM 859 C CG B LYS A 1 85 ? 12.982 6.781 6.177 0.50 11.81 ? 945 LYS A CG 1 +ATOM 860 C CD A LYS A 1 85 ? 14.027 5.606 6.846 0.50 14.21 ? 945 LYS A CD 1 +ATOM 861 C CD B LYS A 1 85 ? 13.669 5.776 7.099 0.50 12.95 ? 945 LYS A CD 1 +ATOM 862 C CE A LYS A 1 85 ? 13.153 4.917 7.876 0.50 22.84 ? 945 LYS A CE 1 +ATOM 863 C CE B LYS A 1 85 ? 12.736 5.161 8.133 0.50 16.82 ? 945 LYS A CE 1 +ATOM 864 N NZ A LYS A 1 85 ? 12.069 4.121 7.244 0.50 23.17 ? 945 LYS A NZ 1 +ATOM 865 N NZ B LYS A 1 85 ? 13.473 4.265 9.072 0.50 18.17 ? 945 LYS A NZ 1 +ATOM 866 N N . TYR A 1 86 ? 11.530 9.473 5.242 1.00 8.62 ? 946 TYR A N 1 +ATOM 867 C CA . TYR A 1 86 ? 10.833 10.486 6.011 1.00 8.37 ? 946 TYR A CA 1 +ATOM 868 C C . TYR A 1 86 ? 10.109 9.877 7.205 1.00 8.24 ? 946 TYR A C 1 +ATOM 869 O O . TYR A 1 86 ? 9.650 8.726 7.156 1.00 9.11 ? 946 TYR A O 1 +ATOM 870 C CB . TYR A 1 86 ? 9.777 11.180 5.129 1.00 9.16 ? 946 TYR A CB 1 +ATOM 871 C CG . TYR A 1 86 ? 10.376 12.117 4.121 1.00 8.99 ? 946 TYR A CG 1 +ATOM 872 C CD1 . TYR A 1 86 ? 10.878 11.645 2.912 1.00 9.52 ? 946 TYR A CD1 1 +ATOM 873 C CD2 . TYR A 1 86 ? 10.476 13.477 4.380 1.00 9.30 ? 946 TYR A CD2 1 +ATOM 874 C CE1 . TYR A 1 86 ? 11.461 12.508 1.990 1.00 9.91 ? 946 TYR A CE1 1 +ATOM 875 C CE2 . TYR A 1 86 ? 11.030 14.351 3.460 1.00 9.68 ? 946 TYR A CE2 1 +ATOM 876 C CZ . TYR A 1 86 ? 11.522 13.859 2.267 1.00 9.95 ? 946 TYR A CZ 1 +ATOM 877 O OH . TYR A 1 86 ? 12.090 14.746 1.367 1.00 11.16 ? 946 TYR A OH 1 +ATOM 878 N N A TYR A 1 87 ? 9.991 10.687 8.256 0.50 8.03 ? 947 TYR A N 1 +ATOM 879 N N B TYR A 1 87 ? 9.971 10.707 8.244 0.50 7.93 ? 947 TYR A N 1 +ATOM 880 C CA A TYR A 1 87 ? 9.202 10.370 9.435 0.50 8.11 ? 947 TYR A CA 1 +ATOM 881 C CA B TYR A 1 87 ? 9.238 10.405 9.471 0.50 7.95 ? 947 TYR A CA 1 +ATOM 882 C C A TYR A 1 87 ? 8.132 11.449 9.561 0.50 7.46 ? 947 TYR A C 1 +ATOM 883 C C B TYR A 1 87 ? 8.134 11.456 9.641 0.50 7.43 ? 947 TYR A C 1 +ATOM 884 O O A TYR A 1 87 ? 8.436 12.644 9.561 0.50 7.57 ? 947 TYR A O 1 +ATOM 885 O O B TYR A 1 87 ? 8.422 12.646 9.793 0.50 7.76 ? 947 TYR A O 1 +ATOM 886 C CB A TYR A 1 87 ? 10.059 10.310 10.691 0.50 9.42 ? 947 TYR A CB 1 +ATOM 887 C CB B TYR A 1 87 ? 10.162 10.465 10.677 0.50 9.04 ? 947 TYR A CB 1 +ATOM 888 C CG A TYR A 1 87 ? 11.064 9.193 10.649 0.50 10.99 ? 947 TYR A CG 1 +ATOM 889 C CG B TYR A 1 87 ? 11.283 9.463 10.641 0.50 10.21 ? 947 TYR A CG 1 +ATOM 890 C CD1 A TYR A 1 87 ? 10.672 7.869 10.818 0.50 12.41 ? 947 TYR A CD1 1 +ATOM 891 C CD1 B TYR A 1 87 ? 12.475 9.743 9.978 0.50 10.57 ? 947 TYR A CD1 1 +ATOM 892 C CD2 A TYR A 1 87 ? 12.407 9.454 10.434 0.50 12.46 ? 947 TYR A CD2 1 +ATOM 893 C CD2 B TYR A 1 87 ? 11.167 8.248 11.297 0.50 11.63 ? 947 TYR A CD2 1 +ATOM 894 C CE1 A TYR A 1 87 ? 11.594 6.840 10.769 0.50 14.52 ? 947 TYR A CE1 1 +ATOM 895 C CE1 B TYR A 1 87 ? 13.518 8.829 9.958 0.50 11.57 ? 947 TYR A CE1 1 +ATOM 896 C CE2 A TYR A 1 87 ? 13.340 8.433 10.396 0.50 14.49 ? 947 TYR A CE2 1 +ATOM 897 C CE2 B TYR A 1 87 ? 12.199 7.323 11.279 0.50 12.61 ? 947 TYR A CE2 1 +ATOM 898 C CZ A TYR A 1 87 ? 12.926 7.127 10.564 0.50 15.48 ? 947 TYR A CZ 1 +ATOM 899 C CZ B TYR A 1 87 ? 13.375 7.613 10.607 0.50 12.45 ? 947 TYR A CZ 1 +ATOM 900 O OH A TYR A 1 87 ? 13.836 6.097 10.524 0.50 18.13 ? 947 TYR A OH 1 +ATOM 901 O OH B TYR A 1 87 ? 14.406 6.695 10.588 0.50 14.08 ? 947 TYR A OH 1 +ATOM 902 N N . LEU A 1 88 ? 6.882 11.000 9.619 1.00 7.39 ? 948 LEU A N 1 +ATOM 903 C CA . LEU A 1 88 ? 5.700 11.852 9.730 1.00 7.30 ? 948 LEU A CA 1 +ATOM 904 C C . LEU A 1 88 ? 5.069 11.615 11.100 1.00 7.23 ? 948 LEU A C 1 +ATOM 905 O O . LEU A 1 88 ? 4.728 10.478 11.451 1.00 8.57 ? 948 LEU A O 1 +ATOM 906 C CB . LEU A 1 88 ? 4.716 11.482 8.617 1.00 7.52 ? 948 LEU A CB 1 +ATOM 907 C CG . LEU A 1 88 ? 3.340 12.144 8.681 1.00 8.45 ? 948 LEU A CG 1 +ATOM 908 C CD1 . LEU A 1 88 ? 3.426 13.659 8.544 1.00 8.39 ? 948 LEU A CD1 1 +ATOM 909 C CD2 . LEU A 1 88 ? 2.430 11.564 7.621 1.00 9.75 ? 948 LEU A CD2 1 +ATOM 910 N N . TYR A 1 89 ? 4.897 12.696 11.860 1.00 7.07 ? 949 TYR A N 1 +ATOM 911 C CA . TYR A 1 89 ? 4.328 12.645 13.206 1.00 7.43 ? 949 TYR A CA 1 +ATOM 912 C C . TYR A 1 89 ? 2.970 13.324 13.178 1.00 7.22 ? 949 TYR A C 1 +ATOM 913 O O . TYR A 1 89 ? 2.886 14.516 12.885 1.00 8.01 ? 949 TYR A O 1 +ATOM 914 C CB . TYR A 1 89 ? 5.248 13.372 14.205 1.00 8.15 ? 949 TYR A CB 1 +ATOM 915 C CG . TYR A 1 89 ? 6.626 12.757 14.270 1.00 8.61 ? 949 TYR A CG 1 +ATOM 916 C CD1 . TYR A 1 89 ? 7.619 13.090 13.347 1.00 9.66 ? 949 TYR A CD1 1 +ATOM 917 C CD2 . TYR A 1 89 ? 6.940 11.819 15.237 1.00 10.81 ? 949 TYR A CD2 1 +ATOM 918 C CE1 . TYR A 1 89 ? 8.863 12.487 13.374 1.00 11.14 ? 949 TYR A CE1 1 +ATOM 919 C CE2 . TYR A 1 89 ? 8.189 11.212 15.272 1.00 12.63 ? 949 TYR A CE2 1 +ATOM 920 C CZ . TYR A 1 89 ? 9.139 11.550 14.331 1.00 12.46 ? 949 TYR A CZ 1 +ATOM 921 O OH . TYR A 1 89 ? 10.375 10.965 14.344 1.00 16.17 ? 949 TYR A OH 1 +ATOM 922 N N . VAL A 1 90 ? 1.913 12.555 13.448 1.00 7.33 ? 950 VAL A N 1 +ATOM 923 C CA . VAL A 1 90 ? 0.542 13.062 13.546 1.00 7.14 ? 950 VAL A CA 1 +ATOM 924 C C . VAL A 1 90 ? 0.211 13.056 15.033 1.00 7.47 ? 950 VAL A C 1 +ATOM 925 O O . VAL A 1 90 ? 0.253 11.994 15.665 1.00 8.46 ? 950 VAL A O 1 +ATOM 926 C CB . VAL A 1 90 ? -0.434 12.186 12.740 1.00 7.75 ? 950 VAL A CB 1 +ATOM 927 C CG1 . VAL A 1 90 ? -1.850 12.716 12.877 1.00 8.35 ? 950 VAL A CG1 1 +ATOM 928 C CG2 . VAL A 1 90 ? 0.001 12.079 11.281 1.00 8.51 ? 950 VAL A CG2 1 +ATOM 929 N N . TYR A 1 91 ? -0.084 14.218 15.612 1.00 7.49 ? 951 TYR A N 1 +ATOM 930 C CA . TYR A 1 91 ? -0.157 14.283 17.063 1.00 7.95 ? 951 TYR A CA 1 +ATOM 931 C C . TYR A 1 91 ? -1.145 15.328 17.541 1.00 7.59 ? 951 TYR A C 1 +ATOM 932 O O . TYR A 1 91 ? -1.483 16.272 16.823 1.00 7.93 ? 951 TYR A O 1 +ATOM 933 C CB . TYR A 1 91 ? 1.245 14.535 17.661 1.00 8.94 ? 951 TYR A CB 1 +ATOM 934 C CG . TYR A 1 91 ? 1.827 15.910 17.390 1.00 9.44 ? 951 TYR A CG 1 +ATOM 935 C CD1 . TYR A 1 91 ? 2.507 16.187 16.211 1.00 10.55 ? 951 TYR A CD1 1 +ATOM 936 C CD2 . TYR A 1 91 ? 1.679 16.925 18.313 1.00 10.98 ? 951 TYR A CD2 1 +ATOM 937 C CE1 . TYR A 1 91 ? 3.049 17.438 15.975 1.00 13.17 ? 951 TYR A CE1 1 +ATOM 938 C CE2 . TYR A 1 91 ? 2.210 18.183 18.088 1.00 12.75 ? 951 TYR A CE2 1 +ATOM 939 C CZ . TYR A 1 91 ? 2.898 18.436 16.916 1.00 13.52 ? 951 TYR A CZ 1 +ATOM 940 O OH . TYR A 1 91 ? 3.444 19.678 16.662 1.00 17.70 ? 951 TYR A OH 1 +ATOM 941 N N . LYS A 1 92 ? -1.585 15.151 18.779 1.00 8.26 ? 952 LYS A N 1 +ATOM 942 C CA . LYS A 1 92 ? -2.458 16.115 19.425 1.00 8.47 ? 952 LYS A CA 1 +ATOM 943 C C . LYS A 1 92 ? -1.716 16.862 20.531 1.00 9.10 ? 952 LYS A C 1 +ATOM 944 O O . LYS A 1 92 ? -0.820 16.344 21.189 1.00 10.90 ? 952 LYS A O 1 +ATOM 945 C CB . LYS A 1 92 ? -3.763 15.499 19.926 1.00 9.06 ? 952 LYS A CB 1 +ATOM 946 C CG . LYS A 1 92 ? -3.606 14.425 20.984 1.00 9.93 ? 952 LYS A CG 1 +ATOM 947 C CD . LYS A 1 92 ? -4.953 13.929 21.475 1.00 9.85 ? 952 LYS A CD 1 +ATOM 948 C CE . LYS A 1 92 ? -4.782 12.862 22.546 1.00 10.74 ? 952 LYS A CE 1 +ATOM 949 N NZ . LYS A 1 92 ? -6.085 12.329 23.012 1.00 11.09 ? 952 LYS A NZ 1 +ATOM 950 N N . TYR A 1 93 ? -2.135 18.111 20.718 1.00 11.37 ? 953 TYR A N 1 +ATOM 951 C CA . TYR A 1 93 ? -1.547 19.014 21.715 1.00 12.62 ? 953 TYR A CA 1 +ATOM 952 C C . TYR A 1 93 ? -2.569 19.526 22.732 1.00 13.45 ? 953 TYR A C 1 +ATOM 953 O O . TYR A 1 93 ? -2.220 20.350 23.576 1.00 17.57 ? 953 TYR A O 1 +ATOM 954 C CB . TYR A 1 93 ? -0.829 20.200 21.030 1.00 13.03 ? 953 TYR A CB 1 +ATOM 955 C CG . TYR A 1 93 ? -1.685 20.930 20.018 1.00 11.42 ? 953 TYR A CG 1 +ATOM 956 C CD1 . TYR A 1 93 ? -2.659 21.844 20.427 1.00 11.29 ? 953 TYR A CD1 1 +ATOM 957 C CD2 . TYR A 1 93 ? -1.543 20.702 18.656 1.00 11.22 ? 953 TYR A CD2 1 +ATOM 958 C CE1 . TYR A 1 93 ? -3.469 22.498 19.509 1.00 11.12 ? 953 TYR A CE1 1 +ATOM 959 C CE2 . TYR A 1 93 ? -2.348 21.352 17.734 1.00 10.98 ? 953 TYR A CE2 1 +ATOM 960 C CZ . TYR A 1 93 ? -3.302 22.255 18.171 1.00 10.60 ? 953 TYR A CZ 1 +ATOM 961 O OH . TYR A 1 93 ? -4.109 22.878 17.248 1.00 12.09 ? 953 TYR A OH 1 +ATOM 962 N N . ASP A 1 94 ? -3.821 19.093 22.636 1.00 13.96 ? 954 ASP A N 1 +ATOM 963 C CA . ASP A 1 94 ? -4.826 19.443 23.655 1.00 15.57 ? 954 ASP A CA 1 +ATOM 964 C C . ASP A 1 94 ? -5.459 18.163 24.205 1.00 16.45 ? 954 ASP A C 1 +ATOM 965 O O . ASP A 1 94 ? -5.032 17.064 23.847 1.00 19.23 ? 954 ASP A O 1 +ATOM 966 C CB . ASP A 1 94 ? -5.847 20.500 23.154 1.00 16.31 ? 954 ASP A CB 1 +ATOM 967 C CG . ASP A 1 94 ? -6.922 19.953 22.216 1.00 15.48 ? 954 ASP A CG 1 +ATOM 968 O OD1 . ASP A 1 94 ? -6.900 18.762 21.849 1.00 15.00 ? 954 ASP A OD1 1 +ATOM 969 O OD2 . ASP A 1 94 ? -7.795 20.778 21.832 1.00 17.79 ? 954 ASP A OD2 1 +ATOM 970 N N . ASN A 1 95 ? -6.465 18.301 25.064 1.00 19.35 ? 955 ASN A N 1 +ATOM 971 C CA . ASN A 1 95 ? -7.085 17.136 25.714 1.00 20.81 ? 955 ASN A CA 1 +ATOM 972 C C . ASN A 1 95 ? -8.248 16.470 24.953 1.00 19.63 ? 955 ASN A C 1 +ATOM 973 O O . ASN A 1 95 ? -8.954 15.639 25.520 1.00 21.47 ? 955 ASN A O 1 +ATOM 974 C CB . ASN A 1 95 ? -7.514 17.506 27.148 1.00 23.95 ? 955 ASN A CB 1 +ATOM 975 C CG . ASN A 1 95 ? -6.327 17.754 28.069 1.00 46.46 ? 955 ASN A CG 1 +ATOM 976 O OD1 . ASN A 1 95 ? -5.328 17.036 28.019 1.00 47.01 ? 955 ASN A OD1 1 +ATOM 977 N ND2 . ASN A 1 95 ? -6.441 18.757 28.932 1.00 47.83 ? 955 ASN A ND2 1 +ATOM 978 N N . GLY A 1 96 ? -8.433 16.797 23.680 1.00 16.52 ? 956 GLY A N 1 +ATOM 979 C CA . GLY A 1 96 ? -9.493 16.165 22.905 1.00 14.88 ? 956 GLY A CA 1 +ATOM 980 C C . GLY A 1 96 ? -9.206 14.730 22.485 1.00 12.61 ? 956 GLY A C 1 +ATOM 981 O O . GLY A 1 96 ? -8.059 14.320 22.404 1.00 14.07 ? 956 GLY A O 1 +ATOM 982 N N . ASP A 1 97 ? -10.273 13.976 22.240 1.00 11.78 ? 957 ASP A N 1 +ATOM 983 C CA . ASP A 1 97 ? -10.206 12.643 21.653 1.00 10.82 ? 957 ASP A CA 1 +ATOM 984 C C . ASP A 1 97 ? -10.763 12.741 20.235 1.00 10.13 ? 957 ASP A C 1 +ATOM 985 O O . ASP A 1 97 ? -11.859 13.275 20.012 1.00 11.79 ? 957 ASP A O 1 +ATOM 986 C CB . ASP A 1 97 ? -11.047 11.653 22.449 1.00 12.89 ? 957 ASP A CB 1 +ATOM 987 C CG . ASP A 1 97 ? -10.445 11.312 23.798 1.00 15.84 ? 957 ASP A CG 1 +ATOM 988 O OD1 . ASP A 1 97 ? -9.218 11.426 23.967 1.00 15.42 ? 957 ASP A OD1 1 +ATOM 989 O OD2 . ASP A 1 97 ? -11.213 10.899 24.687 1.00 21.43 ? 957 ASP A OD2 1 +ATOM 990 N N . GLY A 1 98 ? -10.034 12.197 19.274 1.00 9.88 ? 958 GLY A N 1 +ATOM 991 C CA . GLY A 1 98 ? -10.510 12.271 17.905 1.00 10.50 ? 958 GLY A CA 1 +ATOM 992 C C . GLY A 1 98 ? -9.894 11.231 17.017 1.00 8.81 ? 958 GLY A C 1 +ATOM 993 O O . GLY A 1 98 ? -8.920 10.570 17.356 1.00 10.51 ? 958 GLY A O 1 +ATOM 994 N N . THR A 1 99 ? -10.528 11.072 15.874 1.00 10.08 ? 959 THR A N 1 +ATOM 995 C CA . THR A 1 99 ? -10.079 10.229 14.789 1.00 8.94 ? 959 THR A CA 1 +ATOM 996 C C . THR A 1 99 ? -9.593 11.107 13.642 1.00 7.71 ? 959 THR A C 1 +ATOM 997 O O . THR A 1 99 ? -9.934 12.305 13.570 1.00 8.42 ? 959 THR A O 1 +ATOM 998 C CB . THR A 1 99 ? -11.222 9.328 14.302 1.00 10.76 ? 959 THR A CB 1 +ATOM 999 O OG1 . THR A 1 99 ? -12.340 10.149 13.966 1.00 12.24 ? 959 THR A OG1 1 +ATOM 1000 C CG2 . THR A 1 99 ? -11.636 8.338 15.390 1.00 13.28 ? 959 THR A CG2 1 +ATOM 1001 N N . TYR A 1 100 ? -8.829 10.517 12.728 1.00 7.28 ? 960 TYR A N 1 +ATOM 1002 C CA . TYR A 1 100 ? -8.338 11.274 11.588 1.00 7.14 ? 960 TYR A CA 1 +ATOM 1003 C C . TYR A 1 100 ? -8.166 10.359 10.387 1.00 7.20 ? 960 TYR A C 1 +ATOM 1004 O O . TYR A 1 100 ? -8.100 9.127 10.525 1.00 8.18 ? 960 TYR A O 1 +ATOM 1005 C CB . TYR A 1 100 ? -7.013 12.007 11.925 1.00 7.52 ? 960 TYR A CB 1 +ATOM 1006 C CG . TYR A 1 100 ? -5.833 11.091 12.174 1.00 7.46 ? 960 TYR A CG 1 +ATOM 1007 C CD1 . TYR A 1 100 ? -5.079 10.581 11.111 1.00 7.85 ? 960 TYR A CD1 1 +ATOM 1008 C CD2 . TYR A 1 100 ? -5.500 10.677 13.455 1.00 7.74 ? 960 TYR A CD2 1 +ATOM 1009 C CE1 . TYR A 1 100 ? -4.016 9.725 11.330 1.00 8.66 ? 960 TYR A CE1 1 +ATOM 1010 C CE2 . TYR A 1 100 ? -4.426 9.825 13.685 1.00 8.52 ? 960 TYR A CE2 1 +ATOM 1011 C CZ . TYR A 1 100 ? -3.695 9.339 12.616 1.00 9.07 ? 960 TYR A CZ 1 +ATOM 1012 O OH . TYR A 1 100 ? -2.626 8.492 12.810 1.00 10.95 ? 960 TYR A OH 1 +ATOM 1013 N N A GLU A 1 101 ? -8.084 10.976 9.206 0.50 7.32 ? 961 GLU A N 1 +ATOM 1014 N N B GLU A 1 101 ? -8.058 10.978 9.215 0.50 7.23 ? 961 GLU A N 1 +ATOM 1015 C CA A GLU A 1 101 ? -7.735 10.255 7.985 0.50 7.71 ? 961 GLU A CA 1 +ATOM 1016 C CA B GLU A 1 101 ? -7.740 10.263 7.988 0.50 7.55 ? 961 GLU A CA 1 +ATOM 1017 C C A GLU A 1 101 ? -6.542 10.930 7.332 0.50 7.37 ? 961 GLU A C 1 +ATOM 1018 C C B GLU A 1 101 ? -6.546 10.929 7.327 0.50 7.21 ? 961 GLU A C 1 +ATOM 1019 O O A GLU A 1 101 ? -6.590 12.119 7.007 0.50 8.37 ? 961 GLU A O 1 +ATOM 1020 O O B GLU A 1 101 ? -6.600 12.112 6.982 0.50 8.11 ? 961 GLU A O 1 +ATOM 1021 C CB A GLU A 1 101 ? -8.893 10.169 6.992 0.50 9.31 ? 961 GLU A CB 1 +ATOM 1022 C CB B GLU A 1 101 ? -8.920 10.254 7.029 0.50 8.97 ? 961 GLU A CB 1 +ATOM 1023 C CG A GLU A 1 101 ? -8.589 9.177 5.874 0.50 10.28 ? 961 GLU A CG 1 +ATOM 1024 C CG B GLU A 1 101 ? -8.614 9.528 5.733 0.50 10.25 ? 961 GLU A CG 1 +ATOM 1025 C CD A GLU A 1 101 ? -9.828 8.774 5.100 0.50 18.57 ? 961 GLU A CD 1 +ATOM 1026 C CD B GLU A 1 101 ? -9.735 9.695 4.739 0.50 17.98 ? 961 GLU A CD 1 +ATOM 1027 O OE1 A GLU A 1 101 ? -9.834 7.673 4.511 0.50 19.31 ? 961 GLU A OE1 1 +ATOM 1028 O OE1 B GLU A 1 101 ? -9.515 10.391 3.729 0.50 18.74 ? 961 GLU A OE1 1 +ATOM 1029 O OE2 A GLU A 1 101 ? -10.819 9.537 5.099 0.50 19.53 ? 961 GLU A OE2 1 +ATOM 1030 O OE2 B GLU A 1 101 ? -10.851 9.197 5.019 0.50 18.42 ? 961 GLU A OE2 1 +ATOM 1031 N N . LEU A 1 102 ? -5.470 10.164 7.157 1.00 7.27 ? 962 LEU A N 1 +ATOM 1032 C CA . LEU A 1 102 ? -4.241 10.629 6.538 1.00 6.94 ? 962 LEU A CA 1 +ATOM 1033 C C . LEU A 1 102 ? -4.173 10.213 5.086 1.00 7.17 ? 962 LEU A C 1 +ATOM 1034 O O . LEU A 1 102 ? -4.422 9.047 4.768 1.00 8.05 ? 962 LEU A O 1 +ATOM 1035 C CB . LEU A 1 102 ? -3.040 9.999 7.273 1.00 7.42 ? 962 LEU A CB 1 +ATOM 1036 C CG . LEU A 1 102 ? -1.672 10.128 6.599 1.00 7.87 ? 962 LEU A CG 1 +ATOM 1037 C CD1 . LEU A 1 102 ? -1.209 11.564 6.533 1.00 7.83 ? 962 LEU A CD1 1 +ATOM 1038 C CD2 . LEU A 1 102 ? -0.654 9.269 7.338 1.00 8.76 ? 962 LEU A CD2 1 +ATOM 1039 N N A SER A 1 103 ? -3.840 11.162 4.216 0.50 7.31 ? 963 SER A N 1 +ATOM 1040 N N B SER A 1 103 ? -3.782 11.130 4.204 0.30 7.19 ? 963 SER A N 1 +ATOM 1041 N N C SER A 1 103 ? -3.824 11.172 4.230 0.20 7.30 ? 963 SER A N 1 +ATOM 1042 C CA A SER A 1 103 ? -3.546 10.884 2.828 0.50 8.55 ? 963 SER A CA 1 +ATOM 1043 C CA B SER A 1 103 ? -3.460 10.777 2.820 0.30 7.94 ? 963 SER A CA 1 +ATOM 1044 C CA C SER A 1 103 ? -3.559 10.952 2.819 0.20 8.07 ? 963 SER A CA 1 +ATOM 1045 C C A SER A 1 103 ? -2.167 11.415 2.474 0.50 8.35 ? 963 SER A C 1 +ATOM 1046 C C B SER A 1 103 ? -2.131 11.408 2.419 0.30 7.74 ? 963 SER A C 1 +ATOM 1047 C C C SER A 1 103 ? -2.144 11.464 2.567 0.20 7.85 ? 963 SER A C 1 +ATOM 1048 O O A SER A 1 103 ? -1.769 12.526 2.877 0.50 7.91 ? 963 SER A O 1 +ATOM 1049 O O B SER A 1 103 ? -1.945 12.627 2.503 0.30 7.85 ? 963 SER A O 1 +ATOM 1050 O O C SER A 1 103 ? -1.765 12.532 3.059 0.20 7.42 ? 963 SER A O 1 +ATOM 1051 C CB A SER A 1 103 ? -4.579 11.541 1.920 0.50 10.09 ? 963 SER A CB 1 +ATOM 1052 C CB B SER A 1 103 ? -4.562 11.202 1.861 0.30 9.22 ? 963 SER A CB 1 +ATOM 1053 C CB C SER A 1 103 ? -4.561 11.729 1.965 0.20 8.88 ? 963 SER A CB 1 +ATOM 1054 O OG A SER A 1 103 ? -5.836 10.910 2.045 0.50 11.62 ? 963 SER A OG 1 +ATOM 1055 O OG B SER A 1 103 ? -4.757 12.599 1.897 0.30 10.28 ? 963 SER A OG 1 +ATOM 1056 O OG C SER A 1 103 ? -4.247 11.636 0.585 0.20 10.27 ? 963 SER A OG 1 +ATOM 1057 N N A VAL A 1 104 ? -1.459 10.605 1.694 0.50 8.82 ? 964 VAL A N 1 +ATOM 1058 N N B VAL A 1 104 ? -1.225 10.552 1.966 0.50 7.83 ? 964 VAL A N 1 +ATOM 1059 C CA A VAL A 1 104 ? -0.197 10.996 1.099 0.50 9.60 ? 964 VAL A CA 1 +ATOM 1060 C CA B VAL A 1 104 ? 0.104 10.946 1.502 0.50 8.16 ? 964 VAL A CA 1 +ATOM 1061 C C A VAL A 1 104 ? -0.316 10.689 -0.381 0.50 11.01 ? 964 VAL A C 1 +ATOM 1062 C C B VAL A 1 104 ? 0.275 10.504 0.053 0.50 8.56 ? 964 VAL A C 1 +ATOM 1063 O O A VAL A 1 104 ? -0.551 9.530 -0.758 0.50 11.66 ? 964 VAL A O 1 +ATOM 1064 O O B VAL A 1 104 ? 0.169 9.313 -0.233 0.50 8.49 ? 964 VAL A O 1 +ATOM 1065 C CB A VAL A 1 104 ? 1.013 10.244 1.683 0.50 10.28 ? 964 VAL A CB 1 +ATOM 1066 C CB B VAL A 1 104 ? 1.216 10.253 2.315 0.50 8.43 ? 964 VAL A CB 1 +ATOM 1067 C CG1 A VAL A 1 104 ? 2.300 10.748 1.045 0.50 11.41 ? 964 VAL A CG1 1 +ATOM 1068 C CG1 B VAL A 1 104 ? 2.587 10.647 1.790 0.50 9.38 ? 964 VAL A CG1 1 +ATOM 1069 C CG2 A VAL A 1 104 ? 1.063 10.408 3.194 0.50 10.08 ? 964 VAL A CG2 1 +ATOM 1070 C CG2 B VAL A 1 104 ? 1.089 10.580 3.793 0.50 8.08 ? 964 VAL A CG2 1 +ATOM 1071 N N A LYS A 1 105 ? -0.224 11.723 -1.213 0.50 12.70 ? 965 LYS A N 1 +ATOM 1072 N N B LYS A 1 105 ? 0.562 11.424 -0.864 0.50 9.68 ? 965 LYS A N 1 +ATOM 1073 C CA A LYS A 1 105 ? -0.242 11.529 -2.660 0.50 15.28 ? 965 LYS A CA 1 +ATOM 1074 C CA B LYS A 1 105 ? 0.694 11.042 -2.277 0.50 11.68 ? 965 LYS A CA 1 +ATOM 1075 C C A LYS A 1 105 ? 0.989 12.202 -3.266 0.50 16.40 ? 965 LYS A C 1 +ATOM 1076 C C B LYS A 1 105 ? 1.582 11.986 -3.069 0.50 13.49 ? 965 LYS A C 1 +ATOM 1077 O O A LYS A 1 105 ? 1.564 11.743 -4.273 0.50 17.97 ? 965 LYS A O 1 +ATOM 1078 O O B LYS A 1 105 ? 2.519 11.514 -3.749 0.50 15.25 ? 965 LYS A O 1 +ATOM 1079 C CB A LYS A 1 105 ? -1.492 12.125 -3.299 0.50 17.65 ? 965 LYS A CB 1 +ATOM 1080 C CB B LYS A 1 105 ? -0.690 10.985 -2.930 0.50 13.48 ? 965 LYS A CB 1 +ATOM 1081 C CG A LYS A 1 105 ? -2.705 12.208 -2.404 0.50 24.23 ? 965 LYS A CG 1 +ATOM 1082 C CG B LYS A 1 105 ? -1.466 12.290 -2.852 0.50 31.79 ? 965 LYS A CG 1 +ATOM 1083 C CD A LYS A 1 105 ? -3.119 10.873 -1.820 0.50 23.92 ? 965 LYS A CD 1 +ATOM 1084 C CD B LYS A 1 105 ? -2.790 12.188 -3.593 0.50 32.40 ? 965 LYS A CD 1 +ATOM 1085 C CE A LYS A 1 105 ? -3.617 9.910 -2.882 0.50 24.57 ? 965 LYS A CE 1 +ATOM 1086 C CE B LYS A 1 105 ? -3.504 13.530 -3.665 0.50 32.88 ? 965 LYS A CE 1 +ATOM 1087 N NZ A LYS A 1 105 ? -4.290 8.740 -2.254 0.50 24.57 ? 965 LYS A NZ 1 +ATOM 1088 N NZ B LYS A 1 105 ? -3.838 14.073 -2.320 0.50 32.27 ? 965 LYS A NZ 1 +ATOM 1089 O OXT A LYS A 1 105 ? 1.418 13.229 -2.725 0.50 16.29 ? 965 LYS A OXT 1 +ATOM 1090 O OXT B LYS A 1 105 ? 1.312 13.193 -3.053 0.50 14.24 ? 965 LYS A OXT 1 +HETATM 1091 NA NA . NA B 2 . ? -3.245 6.180 17.201 1.00 11.72 ? 1001 NA A NA 1 +HETATM 1092 NA NA . NA C 2 . ? -13.705 21.472 5.565 0.70 17.63 ? 1002 NA A NA 1 +HETATM 1093 NA NA . NA D 2 . ? 0.019 6.238 18.577 1.00 12.09 ? 1003 NA A NA 1 +HETATM 1094 O O B HOH E 3 . ? -5.528 19.172 1.666 0.50 27.63 ? 1101 HOH A O 1 +HETATM 1095 O O . HOH E 3 . ? 1.282 2.708 18.748 0.50 25.13 ? 1102 HOH A O 1 +HETATM 1096 O O . HOH E 3 . ? -12.359 11.066 6.724 1.00 23.92 ? 1103 HOH A O 1 +HETATM 1097 O O B HOH E 3 . ? -6.207 5.940 -1.468 0.40 18.15 ? 1104 HOH A O 1 +HETATM 1098 O O . HOH E 3 . ? 16.807 7.492 10.090 1.00 23.75 ? 1105 HOH A O 1 +HETATM 1099 O O . HOH E 3 . ? 17.798 9.913 11.264 1.00 18.40 ? 1106 HOH A O 1 +HETATM 1100 O O . HOH E 3 . ? -6.794 2.210 10.278 1.00 25.42 ? 1107 HOH A O 1 +HETATM 1101 O O B HOH E 3 . ? -8.658 5.053 -0.392 0.40 29.65 ? 1108 HOH A O 1 +HETATM 1102 O O A HOH E 3 . ? -5.624 23.440 2.489 0.50 11.23 ? 1109 HOH A O 1 +HETATM 1103 O O . HOH E 3 . ? 12.723 14.063 -9.877 0.50 27.06 ? 1110 HOH A O 1 +HETATM 1104 O O A HOH E 3 . ? -4.578 21.975 13.344 0.50 20.61 ? 1111 HOH A O 1 +HETATM 1105 O O B HOH E 3 . ? -5.890 21.613 13.829 0.50 16.46 ? 1111 HOH A O 1 +HETATM 1106 O O . HOH E 3 . ? -10.851 7.388 2.109 1.00 53.02 ? 1112 HOH A O 1 +HETATM 1107 O O . HOH E 3 . ? 8.081 22.108 -7.045 1.00 15.68 ? 1113 HOH A O 1 +HETATM 1108 O O A HOH E 3 . ? -10.707 9.068 26.537 0.50 34.31 ? 1114 HOH A O 1 +HETATM 1109 O O B HOH E 3 . ? -10.096 9.829 26.927 0.50 21.93 ? 1114 HOH A O 1 +HETATM 1110 O O A HOH E 3 . ? -7.365 9.911 0.090 0.60 23.76 ? 1115 HOH A O 1 +HETATM 1111 O O B HOH E 3 . ? -7.488 11.311 -0.192 0.40 26.51 ? 1115 HOH A O 1 +HETATM 1112 O O . HOH E 3 . ? 7.429 23.477 16.519 0.50 29.93 ? 1116 HOH A O 1 +HETATM 1113 O O . HOH E 3 . ? 11.186 9.538 16.468 0.50 27.78 ? 1117 HOH A O 1 +HETATM 1114 O O B HOH E 3 . ? -9.525 28.342 6.335 0.40 21.77 ? 1118 HOH A O 1 +HETATM 1115 O O . HOH E 3 . ? 3.540 21.292 18.819 1.00 31.28 ? 1119 HOH A O 1 +HETATM 1116 O O A HOH E 3 . ? 15.370 13.255 -7.758 0.50 22.17 ? 1120 HOH A O 1 +HETATM 1117 O O B HOH E 3 . ? 16.107 13.617 -7.098 0.50 23.71 ? 1120 HOH A O 1 +HETATM 1118 O O . HOH E 3 . ? -8.168 21.860 1.133 1.00 24.75 ? 1121 HOH A O 1 +HETATM 1119 O O . HOH E 3 . ? 13.760 17.383 7.990 1.00 9.97 ? 1122 HOH A O 1 +HETATM 1120 O O . HOH E 3 . ? -19.489 10.475 17.268 0.50 25.95 ? 1123 HOH A O 1 +HETATM 1121 O O . HOH E 3 . ? 13.420 19.224 -3.033 0.50 27.79 ? 1124 HOH A O 1 +HETATM 1122 O O A HOH E 3 . ? 3.295 12.986 -5.953 0.50 20.96 ? 1125 HOH A O 1 +HETATM 1123 O O . HOH E 3 . ? -7.553 22.384 16.410 1.00 56.21 ? 1126 HOH A O 1 +HETATM 1124 O O . HOH E 3 . ? 1.878 22.281 12.065 1.00 22.36 ? 1127 HOH A O 1 +HETATM 1125 O O . HOH E 3 . ? 1.087 8.177 21.785 1.00 19.01 ? 1128 HOH A O 1 +HETATM 1126 O O . HOH E 3 . ? 0.915 14.945 -5.099 0.50 26.23 ? 1129 HOH A O 1 +HETATM 1127 O O A HOH E 3 . ? 7.061 -3.030 23.291 0.50 29.36 ? 1130 HOH A O 1 +HETATM 1128 O O B HOH E 3 . ? 6.703 -4.366 22.206 0.50 26.22 ? 1130 HOH A O 1 +HETATM 1129 O O . HOH E 3 . ? 8.340 22.492 2.975 1.00 27.95 ? 1131 HOH A O 1 +HETATM 1130 O O . HOH E 3 . ? -13.829 15.087 20.536 1.00 27.65 ? 1132 HOH A O 1 +HETATM 1131 O O . HOH E 3 . ? -7.388 14.578 2.531 1.00 20.74 ? 1133 HOH A O 1 +HETATM 1132 O O . HOH E 3 . ? -16.722 8.918 13.647 1.00 24.69 ? 1134 HOH A O 1 +HETATM 1133 O O . HOH E 3 . ? -8.781 3.741 16.245 0.50 18.23 ? 1135 HOH A O 1 +HETATM 1134 O O . HOH E 3 . ? 17.830 5.254 5.954 1.00 35.44 ? 1136 HOH A O 1 +HETATM 1135 O O A HOH E 3 . ? -2.714 20.084 0.189 0.50 21.26 ? 1137 HOH A O 1 +HETATM 1136 O O . HOH E 3 . ? 10.300 7.437 23.805 0.50 33.37 ? 1138 HOH A O 1 +HETATM 1137 O O . HOH E 3 . ? -4.062 27.883 9.775 0.50 22.89 ? 1139 HOH A O 1 +HETATM 1138 O O . HOH E 3 . ? -2.232 22.401 12.212 1.00 19.14 ? 1140 HOH A O 1 +HETATM 1139 O O A HOH E 3 . ? -3.260 4.447 11.422 0.80 18.09 ? 1141 HOH A O 1 +HETATM 1140 O O B HOH E 3 . ? -4.430 3.144 11.866 0.20 16.61 ? 1141 HOH A O 1 +HETATM 1141 O O . HOH E 3 . ? 17.242 6.295 2.724 1.00 29.96 ? 1142 HOH A O 1 +HETATM 1142 O O . HOH E 3 . ? -10.238 14.442 15.258 1.00 8.12 ? 1143 HOH A O 1 +HETATM 1143 O O . HOH E 3 . ? -7.922 12.882 25.893 1.00 28.55 ? 1144 HOH A O 1 +HETATM 1144 O O . HOH E 3 . ? 0.334 9.076 27.218 1.00 38.47 ? 1145 HOH A O 1 +HETATM 1145 O O . HOH E 3 . ? 5.330 12.087 20.792 1.00 33.73 ? 1146 HOH A O 1 +HETATM 1146 O O . HOH E 3 . ? -2.928 14.021 0.270 1.00 19.60 ? 1147 HOH A O 1 +HETATM 1147 O O A HOH E 3 . ? 16.594 7.504 -4.246 0.50 27.29 ? 1148 HOH A O 1 +HETATM 1148 O O B HOH E 3 . ? 16.375 6.683 -5.192 0.50 29.69 ? 1148 HOH A O 1 +HETATM 1149 O O . HOH E 3 . ? -6.125 5.067 22.871 1.00 15.05 ? 1149 HOH A O 1 +HETATM 1150 O O . HOH E 3 . ? -5.062 17.420 -0.331 1.00 25.95 ? 1150 HOH A O 1 +HETATM 1151 O O . HOH E 3 . ? 18.121 13.752 -0.788 1.00 25.96 ? 1151 HOH A O 1 +HETATM 1152 O O . HOH E 3 . ? 6.682 19.203 16.434 1.00 37.65 ? 1152 HOH A O 1 +HETATM 1153 O O . HOH E 3 . ? -5.514 20.362 -0.797 1.00 27.62 ? 1153 HOH A O 1 +HETATM 1154 O O . HOH E 3 . ? -6.002 6.274 19.885 1.00 12.03 ? 1154 HOH A O 1 +HETATM 1155 O O . HOH E 3 . ? 12.692 18.594 0.015 1.00 30.56 ? 1155 HOH A O 1 +HETATM 1156 O O . HOH E 3 . ? -9.235 4.991 4.865 1.00 24.86 ? 1156 HOH A O 1 +HETATM 1157 O O A HOH E 3 . ? -3.776 23.817 4.497 0.50 11.66 ? 1157 HOH A O 1 +HETATM 1158 O O B HOH E 3 . ? -3.705 25.052 4.936 0.50 14.09 ? 1157 HOH A O 1 +HETATM 1159 O O A HOH E 3 . ? -10.545 22.114 19.245 0.50 24.47 ? 1158 HOH A O 1 +HETATM 1160 O O B HOH E 3 . ? -9.783 22.437 17.958 0.50 23.67 ? 1158 HOH A O 1 +HETATM 1161 O O A HOH E 3 . ? 5.615 3.995 24.564 0.50 32.12 ? 1159 HOH A O 1 +HETATM 1162 O O . HOH E 3 . ? -7.034 12.454 4.042 1.00 20.71 ? 1160 HOH A O 1 +HETATM 1163 O O . HOH E 3 . ? -9.001 27.253 9.253 1.00 27.52 ? 1161 HOH A O 1 +HETATM 1164 O O . HOH E 3 . ? 10.315 4.313 5.075 1.00 25.19 ? 1162 HOH A O 1 +HETATM 1165 O O . HOH E 3 . ? -5.994 14.331 0.080 0.50 22.54 ? 1163 HOH A O 1 +HETATM 1166 O O . HOH E 3 . ? -12.862 7.456 11.853 0.50 18.04 ? 1164 HOH A O 1 +HETATM 1167 O O A HOH E 3 . ? -8.608 11.193 2.354 0.40 24.86 ? 1165 HOH A O 1 +HETATM 1168 O O . HOH E 3 . ? 19.773 18.879 12.376 1.00 14.76 ? 1166 HOH A O 1 +HETATM 1169 O O . HOH E 3 . ? -13.417 18.961 19.391 0.50 26.90 ? 1167 HOH A O 1 +HETATM 1170 O O . HOH E 3 . ? -5.332 6.198 27.199 1.00 23.93 ? 1168 HOH A O 1 +HETATM 1171 O O . HOH E 3 . ? 7.719 4.235 1.256 1.00 18.42 ? 1169 HOH A O 1 +HETATM 1172 O O . HOH E 3 . ? 1.664 14.994 21.436 0.50 21.33 ? 1170 HOH A O 1 +HETATM 1173 O O . HOH E 3 . ? -2.827 12.474 25.582 1.00 26.85 ? 1171 HOH A O 1 +HETATM 1174 O O . HOH E 3 . ? 1.155 7.150 24.252 1.00 32.21 ? 1172 HOH A O 1 +HETATM 1175 O O . HOH E 3 . ? -2.088 25.133 11.432 1.00 15.29 ? 1173 HOH A O 1 +HETATM 1176 O O . HOH E 3 . ? -11.528 22.258 4.957 1.00 18.66 ? 1174 HOH A O 1 +HETATM 1177 O O . HOH E 3 . ? 8.424 22.996 -2.332 1.00 17.94 ? 1175 HOH A O 1 +HETATM 1178 O O B HOH E 3 . ? -11.918 21.046 19.987 0.50 31.06 ? 1176 HOH A O 1 +HETATM 1179 O O . HOH E 3 . ? -8.995 24.836 11.730 1.00 20.35 ? 1177 HOH A O 1 +HETATM 1180 O O . HOH E 3 . ? -4.236 5.232 15.242 1.00 19.00 ? 1178 HOH A O 1 +HETATM 1181 O O . HOH E 3 . ? 9.463 2.203 14.506 0.50 29.64 ? 1179 HOH A O 1 +HETATM 1182 O O B HOH E 3 . ? 4.983 20.874 -4.388 0.50 12.52 ? 1180 HOH A O 1 +HETATM 1183 O O . HOH E 3 . ? -12.809 15.170 23.032 1.00 33.47 ? 1181 HOH A O 1 +HETATM 1184 O O . HOH E 3 . ? -8.078 21.216 12.088 1.00 14.27 ? 1182 HOH A O 1 +HETATM 1185 O O . HOH E 3 . ? 10.621 3.467 -2.183 1.00 22.96 ? 1183 HOH A O 1 +HETATM 1186 O O . HOH E 3 . ? 4.474 -0.913 9.535 1.00 24.94 ? 1184 HOH A O 1 +HETATM 1187 O O B HOH E 3 . ? 1.096 5.167 13.103 0.30 16.56 ? 1185 HOH A O 1 +HETATM 1188 O O A HOH E 3 . ? 6.812 17.236 -8.730 0.50 23.02 ? 1186 HOH A O 1 +HETATM 1189 O O B HOH E 3 . ? 6.322 16.058 -8.997 0.50 26.51 ? 1186 HOH A O 1 +HETATM 1190 O O A HOH E 3 . ? 11.337 19.661 2.310 0.40 26.95 ? 1187 HOH A O 1 +HETATM 1191 O O B HOH E 3 . ? 11.667 21.187 2.921 0.60 23.87 ? 1187 HOH A O 1 +HETATM 1192 O O A HOH E 3 . ? 12.855 17.405 2.349 0.70 23.15 ? 1188 HOH A O 1 +HETATM 1193 O O B HOH E 3 . ? 13.673 18.859 3.354 0.30 21.23 ? 1188 HOH A O 1 +HETATM 1194 O O A HOH E 3 . ? 3.645 5.419 16.174 0.30 17.55 ? 1189 HOH A O 1 +HETATM 1195 O O B HOH E 3 . ? 2.607 5.118 15.505 0.70 16.34 ? 1189 HOH A O 1 +HETATM 1196 O O . HOH E 3 . ? -13.967 21.647 17.034 0.50 21.47 ? 1190 HOH A O 1 +HETATM 1197 O O A HOH E 3 . ? -12.967 7.729 4.156 0.50 22.31 ? 1191 HOH A O 1 +HETATM 1198 O O . HOH E 3 . ? 5.270 23.043 5.280 1.00 21.22 ? 1192 HOH A O 1 +HETATM 1199 O O . HOH E 3 . ? 15.460 7.274 -1.804 0.50 29.80 ? 1193 HOH A O 1 +HETATM 1200 O O A HOH E 3 . ? -10.287 6.278 12.740 0.50 15.68 ? 1194 HOH A O 1 +HETATM 1201 O O B HOH E 3 . ? -10.682 5.660 12.692 0.50 28.56 ? 1194 HOH A O 1 +HETATM 1202 O O . HOH E 3 . ? 20.179 23.591 11.011 1.00 29.57 ? 1195 HOH A O 1 +HETATM 1203 O O . HOH E 3 . ? 10.506 17.872 -8.775 0.50 33.72 ? 1196 HOH A O 1 +HETATM 1204 O O . HOH E 3 . ? -13.969 17.383 4.639 1.00 30.64 ? 1197 HOH A O 1 +HETATM 1205 O O A HOH E 3 . ? 1.417 3.915 -0.975 0.50 12.83 ? 1198 HOH A O 1 +HETATM 1206 O O B HOH E 3 . ? 1.355 3.160 -0.487 0.50 12.34 ? 1198 HOH A O 1 +HETATM 1207 O O . HOH E 3 . ? -4.398 3.809 20.969 0.50 15.78 ? 1199 HOH A O 1 +HETATM 1208 O O . HOH E 3 . ? 0.632 25.679 10.653 1.00 29.51 ? 1200 HOH A O 1 +HETATM 1209 O O . HOH E 3 . ? -0.189 4.088 15.081 1.00 27.40 ? 1201 HOH A O 1 +HETATM 1210 O O A HOH E 3 . ? 0.921 18.810 -6.594 0.50 24.54 ? 1202 HOH A O 1 +HETATM 1211 O O B HOH E 3 . ? 0.920 17.638 -5.709 0.50 27.92 ? 1202 HOH A O 1 +HETATM 1212 O O A HOH E 3 . ? 2.217 5.354 18.146 0.50 50.19 ? 1203 HOH A O 1 +HETATM 1213 O O A HOH E 3 . ? 14.845 5.855 1.313 0.50 22.47 ? 1204 HOH A O 1 +HETATM 1214 O O . HOH E 3 . ? 7.865 2.660 4.375 1.00 29.16 ? 1205 HOH A O 1 +HETATM 1215 O O . HOH E 3 . ? 20.662 15.891 2.642 0.50 33.38 ? 1206 HOH A O 1 +HETATM 1216 O O . HOH E 3 . ? 3.858 -0.481 20.040 0.50 27.29 ? 1207 HOH A O 1 +HETATM 1217 O O . HOH E 3 . ? -13.850 22.578 7.747 1.00 24.97 ? 1208 HOH A O 1 +HETATM 1218 O O . HOH E 3 . ? -3.376 3.782 17.552 1.00 29.87 ? 1209 HOH A O 1 +HETATM 1219 O O A HOH E 3 . ? 10.068 21.660 0.569 0.50 26.78 ? 1210 HOH A O 1 +HETATM 1220 O O B HOH E 3 . ? 10.744 21.633 -0.110 0.50 27.64 ? 1210 HOH A O 1 +HETATM 1221 O O A HOH E 3 . ? -9.701 15.583 1.377 0.50 25.12 ? 1211 HOH A O 1 +HETATM 1222 O O B HOH E 3 . ? -9.619 14.392 1.015 0.50 30.82 ? 1211 HOH A O 1 +HETATM 1223 O O A HOH E 3 . ? 20.331 13.355 2.493 0.50 21.06 ? 1212 HOH A O 1 +HETATM 1224 O O B HOH E 3 . ? 20.354 12.213 3.038 0.50 20.87 ? 1212 HOH A O 1 +HETATM 1225 O O A HOH E 3 . ? -4.644 23.813 14.255 0.50 49.99 ? 1213 HOH A O 1 +HETATM 1226 O O B HOH E 3 . ? -2.553 23.697 15.045 0.50 25.67 ? 1213 HOH A O 1 +HETATM 1227 O O A HOH E 3 . ? -1.823 16.345 24.215 0.50 33.51 ? 1214 HOH A O 1 +HETATM 1228 O O B HOH E 3 . ? -1.357 15.872 25.487 0.50 32.68 ? 1214 HOH A O 1 +HETATM 1229 O O A HOH E 3 . ? 4.683 24.224 1.164 0.50 15.45 ? 1215 HOH A O 1 +HETATM 1230 O O B HOH E 3 . ? 4.291 23.192 2.193 0.50 15.66 ? 1215 HOH A O 1 +HETATM 1231 O O . HOH E 3 . ? -0.946 4.022 18.587 0.50 18.91 ? 1216 HOH A O 1 +HETATM 1232 O O A HOH E 3 . ? 17.046 23.844 14.522 0.50 23.91 ? 1217 HOH A O 1 +HETATM 1233 O O A HOH E 3 . ? -0.139 4.923 22.693 0.50 24.22 ? 1218 HOH A O 1 +HETATM 1234 O O A HOH E 3 . ? -9.030 20.295 25.388 0.50 27.72 ? 1219 HOH A O 1 +HETATM 1235 O O B HOH E 3 . ? -10.201 19.631 24.575 0.50 31.60 ? 1219 HOH A O 1 +HETATM 1236 O O A HOH E 3 . ? 18.778 10.395 1.754 0.60 35.70 ? 1220 HOH A O 1 +HETATM 1237 O O B HOH E 3 . ? 18.441 10.310 2.395 0.40 20.16 ? 1220 HOH A O 1 +HETATM 1238 O O B HOH E 3 . ? 2.719 19.330 -4.108 0.50 17.32 ? 1221 HOH A O 1 +HETATM 1239 O O . HOH E 3 . ? 12.765 1.997 -1.136 0.50 26.35 ? 1222 HOH A O 1 +HETATM 1240 O O . HOH E 3 . ? -5.587 11.562 28.237 0.50 34.95 ? 1223 HOH A O 1 +HETATM 1241 O O . HOH E 3 . ? 16.134 20.263 2.267 0.50 32.12 ? 1224 HOH A O 1 +HETATM 1242 O O B HOH E 3 . ? 1.092 27.652 8.752 0.50 30.87 ? 1225 HOH A O 1 +HETATM 1243 O O . HOH E 3 . ? -4.888 13.670 26.889 0.50 33.13 ? 1226 HOH A O 1 +HETATM 1244 O O . HOH E 3 . ? -15.940 20.230 6.505 1.00 25.33 ? 1227 HOH A O 1 +HETATM 1245 O O . HOH E 3 . ? -14.066 20.098 3.602 1.00 29.50 ? 1228 HOH A O 1 +HETATM 1246 O O A HOH E 3 . ? 11.495 3.337 11.206 0.50 23.78 ? 1229 HOH A O 1 +HETATM 1247 O O B HOH E 3 . ? 11.157 4.099 13.268 0.50 32.99 ? 1229 HOH A O 1 +HETATM 1248 O O . HOH E 3 . ? -6.980 8.771 28.935 0.50 23.15 ? 1230 HOH A O 1 +HETATM 1249 O O A HOH E 3 . ? 9.533 20.900 -9.289 0.50 23.91 ? 1231 HOH A O 1 +HETATM 1250 O O B HOH E 3 . ? 10.255 21.307 -8.470 0.50 22.17 ? 1231 HOH A O 1 +HETATM 1251 O O . HOH E 3 . ? 13.110 17.349 -9.535 0.50 38.41 ? 1232 HOH A O 1 +HETATM 1252 O O . HOH E 3 . ? -0.986 6.360 28.095 1.00 35.14 ? 1233 HOH A O 1 +HETATM 1253 O O A HOH E 3 . ? -2.661 3.705 13.909 0.50 24.00 ? 1234 HOH A O 1 +HETATM 1254 O O B HOH E 3 . ? -5.320 2.396 14.508 0.50 36.40 ? 1234 HOH A O 1 +HETATM 1255 O O . HOH E 3 . ? -14.852 6.921 13.760 0.50 27.87 ? 1235 HOH A O 1 +HETATM 1256 O O . HOH E 3 . ? -8.911 7.378 27.544 1.00 30.42 ? 1236 HOH A O 1 +HETATM 1257 O O . HOH E 3 . ? -1.063 11.919 27.606 1.00 54.81 ? 1237 HOH A O 1 +HETATM 1258 O O A HOH E 3 . ? -11.529 18.875 21.352 0.40 25.02 ? 1238 HOH A O 1 +HETATM 1259 O O B HOH E 3 . ? -10.308 19.443 21.409 0.60 19.70 ? 1238 HOH A O 1 +HETATM 1260 O O . HOH E 3 . ? -12.926 21.382 12.636 1.00 23.03 ? 1239 HOH A O 1 +HETATM 1261 O O A HOH E 3 . ? 12.703 7.297 14.456 0.40 37.63 ? 1240 HOH A O 1 +HETATM 1262 O O B HOH E 3 . ? 14.741 7.079 13.960 0.60 28.51 ? 1240 HOH A O 1 +HETATM 1263 O O . HOH E 3 . ? -14.288 22.334 14.757 0.50 26.59 ? 1241 HOH A O 1 +HETATM 1264 O O A HOH E 3 . ? 8.826 13.328 17.720 0.60 43.73 ? 1242 HOH A O 1 +HETATM 1265 O O B HOH E 3 . ? 7.545 13.011 18.762 0.40 31.55 ? 1242 HOH A O 1 +HETATM 1266 O O . HOH E 3 . ? -8.599 11.829 28.323 0.50 29.95 ? 1243 HOH A O 1 +HETATM 1267 O O A HOH E 3 . ? 16.809 15.637 -6.140 0.50 36.17 ? 1244 HOH A O 1 +HETATM 1268 O O . HOH E 3 . ? 14.966 18.388 5.685 1.00 23.56 ? 1245 HOH A O 1 +HETATM 1269 O O . HOH E 3 . ? 14.649 20.376 -0.632 0.50 28.89 ? 1246 HOH A O 1 +HETATM 1270 O O A HOH E 3 . ? 4.193 11.612 -8.115 0.50 24.96 ? 1247 HOH A O 1 +HETATM 1271 O O . HOH E 3 . ? 16.221 22.174 5.328 1.00 35.19 ? 1248 HOH A O 1 +HETATM 1272 O O . HOH E 3 . ? -14.967 23.245 4.501 1.00 48.96 ? 1249 HOH A O 1 +HETATM 1273 O O . HOH E 3 . ? 6.902 15.457 17.815 1.00 34.93 ? 1250 HOH A O 1 +# +loop_ +_atom_site_anisotrop.id +_atom_site_anisotrop.type_symbol +_atom_site_anisotrop.pdbx_label_atom_id +_atom_site_anisotrop.pdbx_label_alt_id +_atom_site_anisotrop.pdbx_label_comp_id +_atom_site_anisotrop.pdbx_label_asym_id +_atom_site_anisotrop.pdbx_label_seq_id +_atom_site_anisotrop.pdbx_PDB_ins_code +_atom_site_anisotrop.U[1][1] +_atom_site_anisotrop.U[2][2] +_atom_site_anisotrop.U[3][3] +_atom_site_anisotrop.U[1][2] +_atom_site_anisotrop.U[1][3] +_atom_site_anisotrop.U[2][3] +_atom_site_anisotrop.pdbx_auth_seq_id +_atom_site_anisotrop.pdbx_auth_comp_id +_atom_site_anisotrop.pdbx_auth_asym_id +_atom_site_anisotrop.pdbx_auth_atom_id +1 N N . ASN A 1 ? 0.8804 0.7095 0.6892 -0.0523 -0.0481 0.0334 861 ASN A N +2 C CA . ASN A 1 ? 0.8261 0.7211 0.6866 -0.0636 -0.0441 0.0392 861 ASN A CA +3 C C . ASN A 1 ? 0.3306 0.2033 0.3111 -0.0890 -0.0265 0.0401 861 ASN A C +4 O O . ASN A 1 ? 0.2604 0.1647 0.3435 -0.0132 0.0001 0.0514 861 ASN A O +5 C CB . ASN A 1 ? 0.8304 0.7296 0.6895 -0.0707 -0.0466 0.0423 861 ASN A CB +6 C CG . ASN A 1 ? 0.8891 0.7419 0.6937 -0.0989 -0.0648 0.0509 861 ASN A CG +7 O OD1 . ASN A 1 ? 0.9271 0.7545 0.6979 -0.1210 -0.0780 0.0582 861 ASN A OD1 +8 N ND2 . ASN A 1 ? 0.9054 0.7420 0.6952 -0.1015 -0.0680 0.0512 861 ASN A ND2 +9 N N . ASN A 2 ? 0.3284 0.2561 0.3082 -0.1015 -0.0263 0.0483 862 ASN A N +10 C CA . ASN A 2 ? 0.2467 0.2792 0.2835 -0.0795 -0.0289 0.0444 862 ASN A CA +11 C C . ASN A 2 ? 0.2490 0.2804 0.2630 -0.0854 -0.0276 0.0801 862 ASN A C +12 O O . ASN A 2 ? 0.2615 0.3371 0.2763 -0.1108 -0.0328 0.0895 862 ASN A O +13 C CB . ASN A 2 ? 0.4878 0.4403 0.4267 -0.0103 -0.0153 0.0238 862 ASN A CB +14 C CG . ASN A 2 ? 0.5235 0.4447 0.4320 -0.0105 -0.0193 0.0236 862 ASN A CG +15 O OD1 . ASN A 2 ? 0.5266 0.4510 0.4355 -0.0212 -0.0229 0.0257 862 ASN A OD1 +16 N ND2 . ASN A 2 ? 0.5590 0.4480 0.4352 0.0049 -0.0188 0.0220 862 ASN A ND2 +17 N N . ARG A 3 ? 0.2006 0.2810 0.2568 -0.0424 -0.0289 0.0644 863 ARG A N +18 C CA . ARG A 3 ? 0.2190 0.3240 0.2642 -0.0274 -0.0057 0.0728 863 ARG A CA +19 C C . ARG A 3 ? 0.2197 0.3438 0.2576 -0.0124 -0.0097 0.0718 863 ARG A C +20 O O . ARG A 3 ? 0.2342 0.3138 0.2649 -0.0079 -0.0031 0.0780 863 ARG A O +21 C CB . ARG A 3 ? 0.2316 0.3099 0.2785 -0.0177 -0.0147 0.0833 863 ARG A CB +22 C CG . ARG A 3 ? 0.4372 0.4555 0.4091 0.0158 -0.0091 0.0261 863 ARG A CG +23 C CD . ARG A 3 ? 0.4664 0.4581 0.4145 0.0307 -0.0111 0.0228 863 ARG A CD +24 N NE . ARG A 3 ? 0.4878 0.4840 0.4194 0.0494 -0.0092 0.0249 863 ARG A NE +25 C CZ . ARG A 3 ? 0.5325 0.4928 0.4250 0.0693 -0.0122 0.0223 863 ARG A CZ +26 N NH1 . ARG A 3 ? 0.5504 0.5174 0.4243 0.0922 -0.0090 0.0251 863 ARG A NH1 +27 N NH2 . ARG A 3 ? 0.5684 0.4814 0.4322 0.0667 -0.0200 0.0181 863 ARG A NH2 +28 N N A PRO A 4 ? 0.2374 0.3823 0.2709 -0.0124 0.0029 0.0833 864 PRO A N +29 N N B PRO A 4 ? 0.2409 0.3729 0.2643 -0.0122 -0.0008 0.0875 864 PRO A N +30 C CA A PRO A 4 ? 0.2723 0.3683 0.2743 -0.0165 -0.0036 0.0813 864 PRO A CA +31 C CA B PRO A 4 ? 0.2625 0.3563 0.2583 -0.0177 0.0000 0.0826 864 PRO A CA +32 C C A PRO A 4 ? 0.2952 0.3341 0.3050 -0.0077 -0.0271 0.0727 864 PRO A C +33 C C B PRO A 4 ? 0.2736 0.3152 0.2673 -0.0011 -0.0165 0.0782 864 PRO A C +34 O O A PRO A 4 ? 0.3197 0.3244 0.3029 0.0100 -0.0395 0.0703 864 PRO A O +35 O O B PRO A 4 ? 0.2758 0.3089 0.2516 0.0129 -0.0283 0.0750 864 PRO A O +36 C CB A PRO A 4 ? 0.3744 0.4422 0.3552 -0.0206 -0.0158 0.0442 864 PRO A CB +37 C CB B PRO A 4 ? 0.3263 0.3937 0.3072 -0.0200 -0.0157 0.0439 864 PRO A CB +38 C CG A PRO A 4 ? 0.3692 0.4612 0.3541 -0.0011 -0.0106 0.0463 864 PRO A CG +39 C CG B PRO A 4 ? 0.3248 0.4284 0.3093 -0.0220 -0.0162 0.0544 864 PRO A CG +40 C CD A PRO A 4 ? 0.3693 0.4463 0.3536 -0.0038 -0.0111 0.0427 864 PRO A CD +41 C CD B PRO A 4 ? 0.3223 0.4042 0.3067 -0.0110 -0.0129 0.0456 864 PRO A CD +42 N N A GLU A 5 ? 0.4528 0.4509 0.4270 -0.0108 -0.0129 0.0248 865 GLU A N +43 N N B GLU A 5 ? 0.2608 0.2558 0.2332 -0.0116 -0.0132 0.0247 865 GLU A N +44 C CA A GLU A 5 ? 0.4468 0.4389 0.4249 -0.0043 -0.0112 0.0218 865 GLU A CA +45 C CA B GLU A 5 ? 0.2567 0.2463 0.2330 -0.0049 -0.0112 0.0219 865 GLU A CA +46 C C A GLU A 5 ? 0.2984 0.2841 0.2679 -0.0010 -0.0884 0.1362 865 GLU A C +47 C C B GLU A 5 ? 0.2851 0.3090 0.2876 -0.0035 0.0072 0.0303 865 GLU A C +48 O O A GLU A 5 ? 0.3116 0.3385 0.2824 0.0197 -0.0644 0.1286 865 GLU A O +49 O O B GLU A 5 ? 0.3246 0.3388 0.3081 -0.0038 0.0296 0.0373 865 GLU A O +50 C CB A GLU A 5 ? 0.4535 0.4351 0.4239 -0.0043 -0.0112 0.0216 865 GLU A CB +51 C CB B GLU A 5 ? 0.2674 0.2431 0.2322 -0.0038 -0.0113 0.0217 865 GLU A CB +52 C CG A GLU A 5 ? 0.4744 0.4358 0.4248 -0.0010 -0.0117 0.0217 865 GLU A CG +53 C CG B GLU A 5 ? 0.2624 0.2451 0.2333 0.0024 -0.0091 0.0227 865 GLU A CG +54 C CD A GLU A 5 ? 0.4707 0.4399 0.4251 0.0083 -0.0083 0.0230 865 GLU A CD +55 C CD B GLU A 5 ? 0.2564 0.2539 0.2335 0.0062 -0.0078 0.0274 865 GLU A CD +56 O OE1 A GLU A 5 ? 0.4594 0.4462 0.4315 0.0047 -0.0081 0.0243 865 GLU A OE1 +57 O OE1 B GLU A 5 ? 0.2646 0.2606 0.2379 0.0095 -0.0067 0.0277 865 GLU A OE1 +58 O OE2 A GLU A 5 ? 0.4918 0.4461 0.4245 0.0205 -0.0067 0.0239 865 GLU A OE2 +59 O OE2 B GLU A 5 ? 0.2475 0.2614 0.2316 0.0037 -0.0090 0.0331 865 GLU A OE2 +60 N N A GLU A 6 ? 0.3091 0.2900 0.2855 -0.0023 -0.0827 0.1170 866 GLU A N +61 N N B GLU A 6 ? 0.3332 0.3001 0.2628 0.0116 -0.0069 0.0083 866 GLU A N +62 C CA A GLU A 6 ? 0.5053 0.4759 0.4606 0.0112 -0.0164 0.0193 866 GLU A CA +63 C CA B GLU A 6 ? 0.3921 0.3700 0.3530 0.0106 -0.0149 0.0196 866 GLU A CA +64 C C A GLU A 6 ? 0.3000 0.2511 0.2446 0.0584 -0.0848 0.0378 866 GLU A C +65 C C B GLU A 6 ? 0.2915 0.2514 0.2319 0.0714 -0.0830 0.0168 866 GLU A C +66 O O A GLU A 6 ? 0.2849 0.2202 0.2556 0.0389 -0.0590 0.0112 866 GLU A O +67 O O B GLU A 6 ? 0.2879 0.2851 0.2438 0.0741 -0.0816 -0.0093 866 GLU A O +68 C CB A GLU A 6 ? 0.5362 0.4751 0.4677 0.0076 -0.0245 0.0196 866 GLU A CB +69 C CB B GLU A 6 ? 0.4272 0.3739 0.3641 0.0102 -0.0220 0.0191 866 GLU A CB +70 C CG A GLU A 6 ? 0.5339 0.4774 0.4736 -0.0110 -0.0295 0.0253 866 GLU A CG +71 C CG B GLU A 6 ? 0.4657 0.3821 0.3679 0.0237 -0.0262 0.0172 866 GLU A CG +72 C CD A GLU A 6 ? 0.5697 0.4848 0.4814 -0.0250 -0.0421 0.0307 866 GLU A CD +73 C CD B GLU A 6 ? 0.5172 0.3816 0.3756 0.0190 -0.0386 0.0176 866 GLU A CD +74 O OE1 A GLU A 6 ? 0.5697 0.5036 0.4895 -0.0439 -0.0476 0.0412 866 GLU A OE1 +75 O OE1 B GLU A 6 ? 0.5199 0.3836 0.3835 0.0015 -0.0437 0.0212 866 GLU A OE1 +76 O OE2 A GLU A 6 ? 0.6070 0.4819 0.4830 -0.0166 -0.0475 0.0266 866 GLU A OE2 +77 O OE2 B GLU A 6 ? 0.5687 0.3885 0.3801 0.0327 -0.0448 0.0154 866 GLU A OE2 +78 N N . ALA A 7 ? 0.2826 0.2555 0.2575 0.0847 -0.0730 0.0150 867 ALA A N +79 C CA . ALA A 7 ? 0.2641 0.2088 0.2421 0.0737 -0.0715 -0.0044 867 ALA A CA +80 C C . ALA A 7 ? 0.2834 0.1509 0.2329 0.0798 -0.0474 -0.0022 867 ALA A C +81 O O . ALA A 7 ? 0.3800 0.1782 0.3022 0.1319 -0.0695 -0.0248 867 ALA A O +82 C CB . ALA A 7 ? 0.2968 0.2854 0.2672 0.0618 -0.0398 -0.0012 867 ALA A CB +83 N N A ASN A 8 ? 0.2534 0.0992 0.1938 0.0345 -0.0320 0.0125 868 ASN A N +84 N N B ASN A 8 ? 0.2582 0.1012 0.1969 0.0397 -0.0329 0.0136 868 ASN A N +85 C CA A ASN A 8 ? 0.2631 0.0831 0.1953 0.0039 -0.0204 0.0219 868 ASN A CA +86 C CA B ASN A 8 ? 0.2682 0.0935 0.1964 0.0103 -0.0227 0.0232 868 ASN A CA +87 C C A ASN A 8 ? 0.2308 0.0908 0.1929 0.0054 -0.0233 0.0120 868 ASN A C +88 C C B ASN A 8 ? 0.2311 0.0903 0.1943 0.0089 -0.0255 0.0135 868 ASN A C +89 O O A ASN A 8 ? 0.1671 0.0967 0.1796 -0.0098 -0.0120 0.0112 868 ASN A O +90 O O B ASN A 8 ? 0.1629 0.0924 0.1807 -0.0050 -0.0146 0.0092 868 ASN A O +91 C CB A ASN A 8 ? 0.2365 0.1230 0.2040 -0.0246 -0.0121 0.0243 868 ASN A CB +92 C CB B ASN A 8 ? 0.2566 0.1335 0.2109 -0.0081 -0.0205 0.0282 868 ASN A CB +93 C CG A ASN A 8 ? 0.2807 0.2436 0.2325 -0.0240 -0.0321 0.0326 868 ASN A CG +94 C CG B ASN A 8 ? 0.4014 0.3203 0.3150 -0.0304 -0.0444 0.0324 868 ASN A CG +95 O OD1 A ASN A 8 ? 0.3090 0.2521 0.2406 -0.0345 -0.0415 0.0364 868 ASN A OD1 +96 O OD1 B ASN A 8 ? 0.4394 0.3161 0.3169 -0.0244 -0.0508 0.0283 868 ASN A OD1 +97 N ND2 A ASN A 8 ? 0.2577 0.2502 0.2312 -0.0191 -0.0243 0.0345 868 ASN A ND2 +98 N ND2 B ASN A 8 ? 0.3955 0.3411 0.3211 -0.0485 -0.0489 0.0441 868 ASN A ND2 +99 N N . ARG A 9 ? 0.2142 0.0892 0.2201 0.0201 -0.0043 -0.0090 869 ARG A N +100 C CA . ARG A 9 ? 0.1975 0.0999 0.2240 0.0110 -0.0037 -0.0199 869 ARG A CA +101 C C . ARG A 9 ? 0.1920 0.1023 0.2090 -0.0149 0.0007 -0.0190 869 ARG A C +102 O O . ARG A 9 ? 0.2405 0.1198 0.2372 -0.0480 -0.0087 -0.0070 869 ARG A O +103 C CB . ARG A 9 ? 0.2528 0.1323 0.2708 0.0495 0.0141 -0.0202 869 ARG A CB +104 C CG . ARG A 9 ? 0.2674 0.1645 0.3022 0.0676 0.0003 -0.0140 869 ARG A CG +105 C CD . ARG A 9 ? 0.6401 0.6498 0.6096 0.0622 -0.0069 -0.0120 869 ARG A CD +106 N NE . ARG A 9 ? 0.6506 0.6790 0.6159 0.0739 -0.0101 -0.0131 869 ARG A NE +107 C CZ . ARG A 9 ? 0.6664 0.7040 0.6193 0.0922 -0.0114 -0.0138 869 ARG A CZ +108 N NH1 . ARG A 9 ? 0.6715 0.7299 0.6217 0.1032 -0.0149 -0.0153 869 ARG A NH1 +109 N NH2 . ARG A 9 ? 0.6781 0.7048 0.6200 0.1009 -0.0096 -0.0134 869 ARG A NH2 +110 N N . ILE A 10 ? 0.1457 0.0991 0.1942 -0.0163 -0.0054 -0.0252 870 ILE A N +111 C CA . ILE A 10 ? 0.1350 0.1101 0.1836 -0.0356 -0.0019 -0.0242 870 ILE A CA +112 C C . ILE A 10 ? 0.1361 0.1340 0.1765 -0.0448 -0.0037 -0.0302 870 ILE A C +113 O O . ILE A 10 ? 0.1297 0.2096 0.1979 -0.0074 0.0039 -0.0312 870 ILE A O +114 C CB . ILE A 10 ? 0.1234 0.1238 0.1864 -0.0288 -0.0107 -0.0203 870 ILE A CB +115 C CG1 . ILE A 10 ? 0.1203 0.1149 0.1892 -0.0160 -0.0166 -0.0221 870 ILE A CG1 +116 C CG2 . ILE A 10 ? 0.1430 0.1329 0.1913 -0.0274 -0.0001 -0.0196 870 ILE A CG2 +117 C CD1 . ILE A 10 ? 0.1244 0.1168 0.1857 -0.0112 -0.0152 -0.0113 870 ILE A CD1 +118 N N . GLY A 11 ? 0.1299 0.2018 0.1978 -0.0320 0.0020 0.0124 871 GLY A N +119 C CA . GLY A 11 ? 0.1213 0.1903 0.1961 -0.0286 0.0055 0.0042 871 GLY A CA +120 C C . GLY A 11 ? 0.0977 0.1829 0.1667 -0.0295 0.0023 -0.0113 871 GLY A C +121 O O . GLY A 11 ? 0.1233 0.2250 0.1723 -0.0128 0.0146 -0.0162 871 GLY A O +122 N N A LEU A 12 ? 0.1065 0.1510 0.1743 -0.0275 0.0134 -0.0144 872 LEU A N +123 N N B LEU A 12 ? 0.1010 0.1471 0.1689 -0.0192 0.0099 -0.0147 872 LEU A N +124 C CA A LEU A 12 ? 0.1185 0.1483 0.1743 -0.0293 -0.0015 -0.0145 872 LEU A CA +125 C CA B LEU A 12 ? 0.1108 0.1241 0.1607 -0.0211 0.0092 -0.0237 872 LEU A CA +126 C C A LEU A 12 ? 0.1108 0.0984 0.1704 -0.0243 0.0088 -0.0044 872 LEU A C +127 C C B LEU A 12 ? 0.1018 0.0835 0.1568 -0.0066 0.0121 -0.0159 872 LEU A C +128 O O A LEU A 12 ? 0.1293 0.1153 0.1971 -0.0154 0.0061 0.0121 872 LEU A O +129 O O B LEU A 12 ? 0.1161 0.0871 0.1630 0.0081 0.0083 -0.0238 872 LEU A O +130 C CB A LEU A 12 ? 0.1224 0.1538 0.1675 -0.0258 -0.0003 -0.0160 872 LEU A CB +131 C CB B LEU A 12 ? 0.1134 0.1186 0.1646 -0.0166 0.0105 -0.0202 872 LEU A CB +132 C CG A LEU A 12 ? 0.1312 0.1840 0.1743 -0.0325 -0.0092 -0.0146 872 LEU A CG +133 C CG B LEU A 12 ? 0.1175 0.1393 0.1660 -0.0279 0.0082 -0.0129 872 LEU A CG +134 C CD1 A LEU A 12 ? 0.1435 0.1900 0.1724 -0.0369 -0.0049 -0.0178 872 LEU A CD1 +135 C CD1 B LEU A 12 ? 0.1143 0.1306 0.1689 -0.0319 0.0117 -0.0198 872 LEU A CD1 +136 C CD2 A LEU A 12 ? 0.1579 0.1883 0.1758 -0.0416 -0.0096 -0.0181 872 LEU A CD2 +137 C CD2 B LEU A 12 ? 0.1124 0.1367 0.1701 -0.0341 -0.0010 -0.0170 872 LEU A CD2 +138 N N A ASN A 13 ? 0.1071 0.0889 0.1566 -0.0166 0.0098 -0.0035 873 ASN A N +139 N N B ASN A 13 ? 0.1013 0.0705 0.1493 -0.0113 0.0111 -0.0124 873 ASN A N +140 C CA A ASN A 13 ? 0.1074 0.0667 0.1466 -0.0049 0.0091 -0.0106 873 ASN A CA +141 C CA B ASN A 13 ? 0.1026 0.0622 0.1422 -0.0098 0.0095 -0.0134 873 ASN A CA +142 C C A ASN A 13 ? 0.0946 0.0607 0.1438 -0.0044 0.0069 -0.0171 873 ASN A C +143 C C B ASN A 13 ? 0.0916 0.0593 0.1408 -0.0108 0.0095 -0.0175 873 ASN A C +144 O O A ASN A 13 ? 0.1083 0.0595 0.1483 -0.0044 0.0125 -0.0196 873 ASN A O +145 O O B ASN A 13 ? 0.0937 0.0584 0.1477 -0.0101 0.0067 -0.0188 873 ASN A O +146 C CB A ASN A 13 ? 0.1073 0.0733 0.1467 -0.0032 0.0078 -0.0119 873 ASN A CB +147 C CB B ASN A 13 ? 0.1208 0.0653 0.1408 -0.0105 0.0102 -0.0122 873 ASN A CB +148 C CG A ASN A 13 ? 0.1050 0.0736 0.1527 0.0030 0.0070 -0.0106 873 ASN A CG +149 C CG B ASN A 13 ? 0.1312 0.0726 0.1548 -0.0198 -0.0021 -0.0098 873 ASN A CG +150 O OD1 A ASN A 13 ? 0.1141 0.0890 0.1657 0.0143 0.0072 -0.0131 873 ASN A OD1 +151 O OD1 B ASN A 13 ? 0.1269 0.1149 0.1714 -0.0135 -0.0038 -0.0232 873 ASN A OD1 +152 N ND2 A ASN A 13 ? 0.0973 0.0740 0.1513 0.0115 0.0021 -0.0115 873 ASN A ND2 +153 N ND2 B ASN A 13 ? 0.1414 0.0874 0.1570 -0.0267 -0.0002 -0.0173 873 ASN A ND2 +154 N N A THR A 14 ? 0.0926 0.0653 0.1397 -0.0108 0.0050 -0.0180 874 THR A N +155 N N B THR A 14 ? 0.0911 0.0704 0.1387 -0.0194 0.0088 -0.0156 874 THR A N +156 C CA A THR A 14 ? 0.0913 0.0655 0.1422 -0.0116 0.0057 -0.0171 874 THR A CA +157 C CA B THR A 14 ? 0.0932 0.0734 0.1378 -0.0183 0.0087 -0.0149 874 THR A CA +158 C C A THR A 14 ? 0.0876 0.0638 0.1406 -0.0144 0.0030 -0.0200 874 THR A C +159 C C B THR A 14 ? 0.0966 0.0737 0.1464 -0.0181 0.0077 -0.0216 874 THR A C +160 O O A THR A 14 ? 0.0902 0.0639 0.1395 -0.0147 0.0016 -0.0234 874 THR A O +161 O O B THR A 14 ? 0.1002 0.0746 0.1502 -0.0217 0.0070 -0.0225 874 THR A O +162 C CB A THR A 14 ? 0.0943 0.0770 0.1446 -0.0088 0.0030 -0.0155 874 THR A CB +163 C CB B THR A 14 ? 0.0979 0.0790 0.1407 -0.0155 0.0060 -0.0113 874 THR A CB +164 O OG1 A THR A 14 ? 0.0971 0.0889 0.1622 -0.0048 0.0099 -0.0177 874 THR A OG1 +165 O OG1 B THR A 14 ? 0.0969 0.0894 0.1501 -0.0088 0.0075 -0.0078 874 THR A OG1 +166 C CG2 A THR A 14 ? 0.1022 0.0812 0.1476 -0.0126 0.0047 -0.0130 874 THR A CG2 +167 C CG2 B THR A 14 ? 0.1040 0.0831 0.1408 -0.0138 0.0061 -0.0076 874 THR A CG2 +168 N N A THR A 15 ? 0.0876 0.0667 0.1443 -0.0160 0.0048 -0.0221 875 THR A N +169 N N B THR A 15 ? 0.0955 0.0729 0.1461 -0.0164 0.0087 -0.0213 875 THR A N +170 C CA A THR A 15 ? 0.0933 0.0690 0.1457 -0.0125 0.0078 -0.0195 875 THR A CA +171 C CA B THR A 15 ? 0.0969 0.0693 0.1464 -0.0137 0.0070 -0.0198 875 THR A CA +172 C C A THR A 15 ? 0.0845 0.0641 0.1478 -0.0129 0.0084 -0.0202 875 THR A C +173 C C B THR A 15 ? 0.0903 0.0668 0.1474 -0.0141 0.0079 -0.0202 875 THR A C +174 O O A THR A 15 ? 0.0956 0.0681 0.1593 -0.0228 0.0106 -0.0206 875 THR A O +175 O O B THR A 15 ? 0.0988 0.0687 0.1535 -0.0201 0.0108 -0.0223 875 THR A O +176 C CB A THR A 15 ? 0.1040 0.1063 0.1611 -0.0121 -0.0043 -0.0171 875 THR A CB +177 C CB B THR A 15 ? 0.1067 0.1062 0.1595 -0.0088 -0.0018 -0.0114 875 THR A CB +178 O OG1 A THR A 15 ? 0.1589 0.1327 0.1655 -0.0081 -0.0072 -0.0020 875 THR A OG1 +179 O OG1 B THR A 15 ? 0.1314 0.1197 0.1794 -0.0156 -0.0114 -0.0198 875 THR A OG1 +180 C CG2 A THR A 15 ? 0.1047 0.1168 0.1662 -0.0021 -0.0044 -0.0125 875 THR A CG2 +181 C CG2 B THR A 15 ? 0.1289 0.0867 0.1588 -0.0094 -0.0069 -0.0223 875 THR A CG2 +182 N N . ILE A 16 ? 0.0956 0.0642 0.1454 -0.0129 0.0079 -0.0166 876 ILE A N +183 C CA . ILE A 16 ? 0.1068 0.0619 0.1504 -0.0097 0.0079 -0.0140 876 ILE A CA +184 C C . ILE A 16 ? 0.1081 0.0648 0.1493 -0.0090 0.0075 -0.0151 876 ILE A C +185 O O . ILE A 16 ? 0.1252 0.0623 0.1599 -0.0110 0.0141 -0.0148 876 ILE A O +186 C CB . ILE A 16 ? 0.1196 0.0722 0.1637 0.0028 0.0018 -0.0090 876 ILE A CB +187 C CG1 . ILE A 16 ? 0.1542 0.0847 0.1751 0.0067 0.0039 0.0030 876 ILE A CG1 +188 C CG2 . ILE A 16 ? 0.1122 0.0921 0.1653 0.0027 -0.0126 -0.0115 876 ILE A CG2 +189 C CD1 . ILE A 16 ? 0.1695 0.1123 0.2057 0.0252 -0.0108 0.0044 876 ILE A CD1 +190 N N A LYS A 17 ? 0.1165 0.0732 0.1502 -0.0128 0.0134 -0.0175 877 LYS A N +191 N N B LYS A 17 ? 0.1156 0.0732 0.1515 -0.0125 0.0136 -0.0167 877 LYS A N +192 C CA A LYS A 17 ? 0.1235 0.0803 0.1512 -0.0056 0.0141 -0.0173 877 LYS A CA +193 C CA B LYS A 17 ? 0.1217 0.0811 0.1523 -0.0057 0.0152 -0.0153 877 LYS A CA +194 C C A LYS A 17 ? 0.1279 0.0746 0.1532 -0.0046 0.0151 -0.0115 877 LYS A C +195 C C B LYS A 17 ? 0.1155 0.0723 0.1530 -0.0072 0.0179 -0.0108 877 LYS A C +196 O O A LYS A 17 ? 0.1432 0.0756 0.1608 -0.0009 0.0153 -0.0081 877 LYS A O +197 O O B LYS A 17 ? 0.1123 0.0695 0.1604 -0.0097 0.0201 -0.0064 877 LYS A O +198 C CB A LYS A 17 ? 0.1257 0.1071 0.1652 -0.0124 0.0170 -0.0211 877 LYS A CB +199 C CB B LYS A 17 ? 0.1245 0.1149 0.1668 -0.0125 0.0212 -0.0182 877 LYS A CB +200 C CG A LYS A 17 ? 0.1344 0.1132 0.1741 -0.0116 0.0059 -0.0227 877 LYS A CG +201 C CG B LYS A 17 ? 0.1504 0.1410 0.1770 -0.0094 0.0046 -0.0187 877 LYS A CG +202 C CD A LYS A 17 ? 0.1360 0.1435 0.1897 -0.0095 0.0096 -0.0239 877 LYS A CD +203 C CD B LYS A 17 ? 0.1592 0.1776 0.2034 -0.0275 0.0188 -0.0207 877 LYS A CD +204 C CE A LYS A 17 ? 0.1331 0.1611 0.1908 -0.0100 0.0051 -0.0304 877 LYS A CE +205 C CE B LYS A 17 ? 0.1786 0.1915 0.1964 -0.0457 0.0081 0.0032 877 LYS A CE +206 N NZ A LYS A 17 ? 0.1420 0.1896 0.2072 0.0000 0.0095 -0.0405 877 LYS A NZ +207 N NZ B LYS A 17 ? 0.2424 0.2056 0.1961 -0.0494 0.0017 -0.0085 877 LYS A NZ +208 N N . GLY A 18 ? 0.1238 0.0748 0.1513 0.0004 0.0148 -0.0107 878 GLY A N +209 C CA . GLY A 18 ? 0.1278 0.0742 0.1571 0.0033 0.0102 -0.0084 878 GLY A CA +210 C C . GLY A 18 ? 0.1174 0.0736 0.1701 -0.0019 0.0157 -0.0115 878 GLY A C +211 O O . GLY A 18 ? 0.1185 0.0889 0.1553 0.0000 0.0115 -0.0073 878 GLY A O +212 N N . SER A 19 ? 0.0980 0.0900 0.1348 0.0004 -0.0095 -0.0033 879 SER A N +213 C CA . SER A 19 ? 0.0933 0.0944 0.1502 0.0108 -0.0084 -0.0049 879 SER A CA +214 C C . SER A 19 ? 0.0929 0.0788 0.1495 0.0036 -0.0082 0.0093 879 SER A C +215 O O . SER A 19 ? 0.0978 0.0948 0.1646 0.0124 -0.0100 0.0021 879 SER A O +216 C CB . SER A 19 ? 0.1191 0.1270 0.1726 -0.0175 -0.0035 -0.0059 879 SER A CB +217 O OG . SER A 19 ? 0.1471 0.1370 0.1950 -0.0317 -0.0196 0.0185 879 SER A OG +218 N N . LEU A 20 ? 0.0863 0.0841 0.1417 0.0050 -0.0098 0.0071 880 LEU A N +219 C CA . LEU A 20 ? 0.1017 0.0836 0.1405 0.0040 -0.0106 0.0043 880 LEU A CA +220 C C . LEU A 20 ? 0.1014 0.0844 0.1432 0.0051 -0.0079 0.0112 880 LEU A C +221 O O . LEU A 20 ? 0.1274 0.0872 0.1557 0.0050 0.0098 0.0056 880 LEU A O +222 C CB . LEU A 20 ? 0.1057 0.0870 0.1410 0.0035 -0.0066 0.0071 880 LEU A CB +223 C CG . LEU A 20 ? 0.1080 0.0913 0.1372 -0.0087 -0.0075 0.0045 880 LEU A CG +224 C CD1 . LEU A 20 ? 0.1344 0.1021 0.1582 -0.0052 0.0153 0.0228 880 LEU A CD1 +225 C CD2 . LEU A 20 ? 0.0988 0.1158 0.1541 -0.0094 -0.0014 0.0143 880 LEU A CD2 +226 N N A ILE A 21 ? 0.1113 0.0859 0.1524 0.0077 0.0061 0.0149 881 ILE A N +227 N N B ILE A 21 ? 0.1121 0.0897 0.1471 0.0008 0.0028 0.0132 881 ILE A N +228 C CA A ILE A 21 ? 0.1197 0.0978 0.1620 0.0039 0.0139 0.0156 881 ILE A CA +229 C CA B ILE A 21 ? 0.1222 0.1000 0.1503 -0.0003 0.0083 0.0148 881 ILE A CA +230 C C A ILE A 21 ? 0.1275 0.0876 0.1572 -0.0065 0.0172 0.0201 881 ILE A C +231 C C B ILE A 21 ? 0.1299 0.0961 0.1481 -0.0042 0.0096 0.0194 881 ILE A C +232 O O A ILE A 21 ? 0.1326 0.0961 0.1635 -0.0023 0.0000 0.0267 881 ILE A O +233 O O B ILE A 21 ? 0.1290 0.1003 0.1646 -0.0031 0.0079 0.0233 881 ILE A O +234 C CB A ILE A 21 ? 0.1267 0.1189 0.1838 -0.0086 0.0096 0.0111 881 ILE A CB +235 C CB B ILE A 21 ? 0.1292 0.1112 0.1559 -0.0103 0.0069 0.0102 881 ILE A CB +236 C CG1 A ILE A 21 ? 0.1325 0.1489 0.1851 -0.0044 0.0053 0.0079 881 ILE A CG1 +237 C CG1 B ILE A 21 ? 0.1233 0.1185 0.1563 -0.0107 0.0075 0.0093 881 ILE A CG1 +238 C CG2 A ILE A 21 ? 0.1471 0.1246 0.1830 -0.0137 0.0116 0.0159 881 ILE A CG2 +239 C CG2 B ILE A 21 ? 0.1353 0.1156 0.1605 -0.0108 0.0116 0.0131 881 ILE A CG2 +240 C CD1 A ILE A 21 ? 0.1472 0.1609 0.2069 -0.0214 -0.0057 0.0147 881 ILE A CD1 +241 C CD1 B ILE A 21 ? 0.1271 0.1309 0.1534 -0.0069 -0.0020 0.0133 881 ILE A CD1 +242 N N . GLY A 22 ? 0.1461 0.1078 0.1497 0.0008 0.0124 0.0162 882 GLY A N +243 C CA . GLY A 22 ? 0.1630 0.1323 0.1579 -0.0011 0.0027 0.0240 882 GLY A CA +244 C C . GLY A 22 ? 0.1661 0.1321 0.1498 -0.0065 -0.0060 0.0280 882 GLY A C +245 O O . GLY A 22 ? 0.1758 0.1247 0.1703 -0.0173 -0.0154 0.0280 882 GLY A O +246 N N . GLY A 23 ? 0.1668 0.1468 0.1538 -0.0097 -0.0113 0.0397 883 GLY A N +247 C CA . GLY A 23 ? 0.1669 0.1799 0.1595 -0.0081 -0.0286 0.0378 883 GLY A CA +248 C C . GLY A 23 ? 0.1471 0.1660 0.1583 -0.0111 -0.0283 0.0525 883 GLY A C +249 O O . GLY A 23 ? 0.1492 0.2151 0.1849 -0.0141 -0.0404 0.0494 883 GLY A O +250 N N . ASP A 24 ? 0.1321 0.1335 0.1563 -0.0106 -0.0112 0.0386 884 ASP A N +251 C CA . ASP A 24 ? 0.1132 0.1055 0.1630 -0.0038 -0.0102 0.0381 884 ASP A CA +252 C C . ASP A 24 ? 0.1122 0.0958 0.1615 -0.0028 -0.0103 0.0293 884 ASP A C +253 O O . ASP A 24 ? 0.1331 0.1128 0.1903 -0.0102 -0.0353 0.0448 884 ASP A O +254 C CB . ASP A 24 ? 0.1312 0.1024 0.1681 -0.0031 -0.0078 0.0296 884 ASP A CB +255 C CG . ASP A 24 ? 0.1458 0.1009 0.1744 -0.0045 -0.0021 0.0233 884 ASP A CG +256 O OD1 . ASP A 24 ? 0.1618 0.1953 0.2145 -0.0444 0.0184 -0.0055 884 ASP A OD1 +257 O OD2 . ASP A 24 ? 0.1459 0.1722 0.1776 0.0315 -0.0183 -0.0019 884 ASP A OD2 +258 N N . HIS A 25 ? 0.1091 0.1026 0.1577 -0.0017 -0.0128 0.0293 885 HIS A N +259 C CA . HIS A 25 ? 0.1110 0.0973 0.1549 -0.0038 -0.0109 0.0218 885 HIS A CA +260 C C . HIS A 25 ? 0.1076 0.0806 0.1451 -0.0002 -0.0141 0.0173 885 HIS A C +261 O O . HIS A 25 ? 0.1242 0.0775 0.1580 0.0035 -0.0026 0.0199 885 HIS A O +262 C CB . HIS A 25 ? 0.1747 0.1291 0.1507 -0.0270 -0.0049 0.0113 885 HIS A CB +263 C CG . HIS A 25 ? 0.1778 0.1660 0.1715 -0.0373 -0.0250 0.0079 885 HIS A CG +264 N ND1 . HIS A 25 ? 0.1597 0.2473 0.1871 -0.0370 -0.0381 0.0073 885 HIS A ND1 +265 C CD2 . HIS A 25 ? 0.1975 0.2492 0.1881 -0.0274 -0.0431 0.0316 885 HIS A CD2 +266 C CE1 . HIS A 25 ? 0.1580 0.3123 0.2156 -0.0355 -0.0570 0.0090 885 HIS A CE1 +267 N NE2 . HIS A 25 ? 0.1960 0.3167 0.2101 -0.0281 -0.0727 0.0338 885 HIS A NE2 +268 N N . THR A 26 ? 0.0989 0.0880 0.1485 0.0050 -0.0122 0.0218 886 THR A N +269 C CA . THR A 26 ? 0.1065 0.0810 0.1571 0.0052 -0.0048 0.0211 886 THR A CA +270 C C . THR A 26 ? 0.0998 0.0748 0.1577 0.0102 -0.0080 0.0243 886 THR A C +271 O O . THR A 26 ? 0.1289 0.0805 0.1639 0.0153 -0.0099 0.0302 886 THR A O +272 C CB . THR A 26 ? 0.1101 0.1168 0.1774 -0.0033 -0.0114 0.0210 886 THR A CB +273 O OG1 . THR A 26 ? 0.1171 0.1419 0.1970 -0.0185 -0.0166 -0.0014 886 THR A OG1 +274 C CG2 . THR A 26 ? 0.1195 0.1298 0.1879 -0.0021 0.0008 0.0113 886 THR A CG2 +275 N N . ASP A 27 ? 0.0972 0.0707 0.1558 0.0122 -0.0041 0.0215 887 ASP A N +276 C CA . ASP A 27 ? 0.0972 0.0668 0.1577 0.0085 -0.0013 0.0237 887 ASP A CA +277 C C . ASP A 27 ? 0.0908 0.0646 0.1560 0.0094 -0.0031 0.0187 887 ASP A C +278 O O . ASP A 27 ? 0.1325 0.0683 0.1994 0.0231 0.0276 0.0328 887 ASP A O +279 C CB . ASP A 27 ? 0.1025 0.0996 0.1571 0.0042 -0.0058 0.0182 887 ASP A CB +280 C CG . ASP A 27 ? 0.0994 0.1021 0.1675 0.0057 -0.0015 0.0151 887 ASP A CG +281 O OD1 . ASP A 27 ? 0.1164 0.1489 0.1865 -0.0089 -0.0024 0.0443 887 ASP A OD1 +282 O OD2 . ASP A 27 ? 0.0951 0.1293 0.1944 0.0131 -0.0005 0.0240 887 ASP A OD2 +283 N N . VAL A 28 ? 0.0931 0.0721 0.1563 0.0160 -0.0043 0.0208 888 VAL A N +284 C CA . VAL A 28 ? 0.0954 0.0791 0.1570 0.0130 -0.0023 0.0114 888 VAL A CA +285 C C . VAL A 28 ? 0.0982 0.0651 0.1614 0.0126 -0.0030 0.0122 888 VAL A C +286 O O . VAL A 28 ? 0.1401 0.0645 0.1727 0.0076 0.0084 0.0132 888 VAL A O +287 C CB . VAL A 28 ? 0.1047 0.1331 0.1752 0.0243 -0.0141 0.0076 888 VAL A CB +288 C CG1 . VAL A 28 ? 0.0998 0.1879 0.1997 0.0161 -0.0096 0.0086 888 VAL A CG1 +289 C CG2 . VAL A 28 ? 0.1277 0.1687 0.1782 0.0068 -0.0267 -0.0010 888 VAL A CG2 +290 N N . TYR A 29 ? 0.0913 0.0673 0.1574 -0.0001 -0.0007 0.0062 889 TYR A N +291 C CA . TYR A 29 ? 0.0954 0.0607 0.1638 -0.0031 0.0027 0.0019 889 TYR A CA +292 C C . TYR A 29 ? 0.0963 0.0627 0.1616 0.0006 0.0030 0.0026 889 TYR A C +293 O O . TYR A 29 ? 0.1054 0.0717 0.1849 -0.0069 0.0171 -0.0132 889 TYR A O +294 C CB . TYR A 29 ? 0.0973 0.0660 0.1517 -0.0091 0.0006 0.0009 889 TYR A CB +295 C CG . TYR A 29 ? 0.0928 0.0706 0.1516 -0.0023 -0.0033 0.0060 889 TYR A CG +296 C CD1 . TYR A 29 ? 0.0955 0.0647 0.1580 -0.0008 -0.0119 0.0017 889 TYR A CD1 +297 C CD2 . TYR A 29 ? 0.0994 0.0766 0.1674 -0.0022 -0.0022 -0.0053 889 TYR A CD2 +298 C CE1 . TYR A 29 ? 0.0989 0.0853 0.1645 0.0093 -0.0062 0.0046 889 TYR A CE1 +299 C CE2 . TYR A 29 ? 0.0966 0.0883 0.1768 -0.0090 -0.0056 -0.0037 889 TYR A CE2 +300 C CZ . TYR A 29 ? 0.0900 0.0877 0.1768 0.0068 -0.0065 0.0068 889 TYR A CZ +301 O OH . TYR A 29 ? 0.0886 0.1262 0.2080 0.0023 -0.0026 0.0020 889 TYR A OH +302 N N A THR A 30 ? 0.0940 0.0669 0.1667 0.0026 0.0022 -0.0021 890 THR A N +303 N N B THR A 30 ? 0.0977 0.0670 0.1692 0.0044 0.0019 -0.0022 890 THR A N +304 C CA A THR A 30 ? 0.0888 0.0745 0.1625 0.0021 -0.0041 -0.0018 890 THR A CA +305 C CA B THR A 30 ? 0.0949 0.0786 0.1676 0.0000 -0.0032 0.0000 890 THR A CA +306 C C A THR A 30 ? 0.0931 0.0775 0.1644 0.0016 -0.0019 -0.0061 890 THR A C +307 C C B THR A 30 ? 0.0937 0.0767 0.1678 0.0031 -0.0010 -0.0031 890 THR A C +308 O O A THR A 30 ? 0.1110 0.0798 0.1773 -0.0082 0.0033 -0.0073 890 THR A O +309 O O B THR A 30 ? 0.1077 0.0858 0.1752 -0.0088 0.0016 -0.0040 890 THR A O +310 C CB A THR A 30 ? 0.0946 0.0963 0.1674 0.0144 -0.0045 -0.0021 890 THR A CB +311 C CB B THR A 30 ? 0.1088 0.1062 0.1832 0.0160 -0.0087 0.0042 890 THR A CB +312 O OG1 A THR A 30 ? 0.0844 0.0954 0.1757 0.0155 -0.0063 -0.0074 890 THR A OG1 +313 O OG1 B THR A 30 ? 0.1669 0.0992 0.2200 0.0241 -0.0172 0.0067 890 THR A OG1 +314 C CG2 A THR A 30 ? 0.1161 0.0932 0.1835 0.0240 -0.0163 0.0025 890 THR A CG2 +315 C CG2 B THR A 30 ? 0.1145 0.1349 0.1850 0.0105 -0.0134 0.0046 890 THR A CG2 +316 N N . PHE A 31 ? 0.0956 0.0933 0.1565 -0.0067 -0.0027 -0.0094 891 PHE A N +317 C CA . PHE A 31 ? 0.1018 0.0946 0.1599 -0.0119 -0.0080 -0.0157 891 PHE A CA +318 C C . PHE A 31 ? 0.1054 0.0875 0.1645 -0.0126 -0.0048 -0.0168 891 PHE A C +319 O O . PHE A 31 ? 0.1055 0.1082 0.1691 -0.0248 0.0019 -0.0213 891 PHE A O +320 C CB . PHE A 31 ? 0.0984 0.1162 0.1567 -0.0095 -0.0073 -0.0158 891 PHE A CB +321 C CG . PHE A 31 ? 0.0918 0.1164 0.1563 0.0032 -0.0185 -0.0137 891 PHE A CG +322 C CD1 . PHE A 31 ? 0.1216 0.1159 0.1689 0.0195 0.0022 -0.0044 891 PHE A CD1 +323 C CD2 . PHE A 31 ? 0.1094 0.1335 0.1694 -0.0001 0.0031 -0.0137 891 PHE A CD2 +324 C CE1 . PHE A 31 ? 0.1197 0.1144 0.1784 0.0155 -0.0044 0.0046 891 PHE A CE1 +325 C CE2 . PHE A 31 ? 0.1144 0.1366 0.1763 0.0165 0.0001 -0.0200 891 PHE A CE2 +326 C CZ . PHE A 31 ? 0.1115 0.1186 0.1826 0.0187 -0.0141 -0.0075 891 PHE A CZ +327 N N A ASN A 32 ? 0.1060 0.1038 0.1705 -0.0219 0.0003 -0.0276 892 ASN A N +328 N N B ASN A 32 ? 0.1079 0.1064 0.1712 -0.0226 -0.0019 -0.0297 892 ASN A N +329 C CA A ASN A 32 ? 0.1094 0.1124 0.1700 -0.0173 0.0039 -0.0252 892 ASN A CA +330 C CA B ASN A 32 ? 0.1132 0.1172 0.1715 -0.0216 0.0020 -0.0277 892 ASN A CA +331 C C A ASN A 32 ? 0.1043 0.1185 0.1616 -0.0215 0.0014 -0.0308 892 ASN A C +332 C C B ASN A 32 ? 0.1197 0.1243 0.1655 -0.0313 -0.0033 -0.0330 892 ASN A C +333 O O A ASN A 32 ? 0.0970 0.1354 0.1545 -0.0244 0.0097 -0.0259 892 ASN A O +334 O O B ASN A 32 ? 0.1495 0.1570 0.1677 -0.0601 -0.0098 -0.0328 892 ASN A O +335 C CB A ASN A 32 ? 0.1266 0.1242 0.2022 -0.0112 0.0120 -0.0373 892 ASN A CB +336 C CB B ASN A 32 ? 0.1307 0.1354 0.2069 -0.0096 0.0103 -0.0426 892 ASN A CB +337 C CG A ASN A 32 ? 0.2195 0.2096 0.2571 -0.0068 0.0087 -0.0225 892 ASN A CG +338 C CG B ASN A 32 ? 0.2182 0.2185 0.2533 -0.0108 0.0056 -0.0271 892 ASN A CG +339 O OD1 A ASN A 32 ? 0.2171 0.2107 0.2532 -0.0031 0.0055 -0.0177 892 ASN A OD1 +340 O OD1 B ASN A 32 ? 0.2208 0.2228 0.2548 -0.0095 0.0039 -0.0248 892 ASN A OD1 +341 N ND2 A ASN A 32 ? 0.2367 0.2180 0.2784 -0.0069 0.0171 -0.0247 892 ASN A ND2 +342 N ND2 B ASN A 32 ? 0.2223 0.2274 0.2592 -0.0139 0.0078 -0.0325 892 ASN A ND2 +343 N N . VAL A 33 ? 0.0964 0.1224 0.1675 -0.0181 -0.0016 -0.0227 893 VAL A N +344 C CA . VAL A 33 ? 0.1051 0.1349 0.1655 -0.0119 -0.0039 -0.0210 893 VAL A CA +345 C C . VAL A 33 ? 0.1016 0.1419 0.1732 -0.0203 -0.0010 -0.0264 893 VAL A C +346 O O . VAL A 33 ? 0.0975 0.1533 0.1873 -0.0224 0.0021 -0.0264 893 VAL A O +347 C CB . VAL A 33 ? 0.1120 0.1324 0.1707 -0.0166 -0.0036 -0.0127 893 VAL A CB +348 C CG1 . VAL A 33 ? 0.1482 0.1521 0.1828 -0.0085 0.0043 0.0047 893 VAL A CG1 +349 C CG2 . VAL A 33 ? 0.1189 0.1284 0.1882 -0.0066 0.0015 -0.0141 893 VAL A CG2 +350 N N . ALA A 34 ? 0.1080 0.1520 0.1858 -0.0171 0.0010 -0.0430 894 ALA A N +351 C CA . ALA A 34 ? 0.1152 0.1563 0.2068 -0.0094 0.0114 -0.0403 894 ALA A CA +352 C C . ALA A 34 ? 0.1316 0.1625 0.2134 0.0163 0.0353 -0.0239 894 ALA A C +353 O O . ALA A 34 ? 0.1318 0.1835 0.2521 0.0164 0.0403 -0.0038 894 ALA A O +354 C CB . ALA A 34 ? 0.1380 0.1888 0.2252 -0.0293 0.0143 -0.0590 894 ALA A CB +355 N N A SER A 35 ? 0.1582 0.2110 0.2389 0.0498 0.0363 -0.0053 895 SER A N +356 N N B SER A 35 ? 0.1564 0.2089 0.2313 0.0484 0.0357 -0.0093 895 SER A N +357 C CA A SER A 35 ? 0.2166 0.2210 0.2389 0.0696 0.0605 0.0085 895 SER A CA +358 C CA B SER A 35 ? 0.2076 0.2219 0.2284 0.0687 0.0610 0.0035 895 SER A CA +359 C C A SER A 35 ? 0.2533 0.2576 0.2058 0.1080 0.0642 0.0120 895 SER A C +360 C C B SER A 35 ? 0.2364 0.2579 0.2161 0.1066 0.0684 0.0091 895 SER A C +361 O O A SER A 35 ? 0.2566 0.2831 0.2292 0.1058 0.0579 0.0395 895 SER A O +362 O O B SER A 35 ? 0.2474 0.2602 0.2335 0.1250 0.0829 0.0372 895 SER A O +363 C CB A SER A 35 ? 0.2757 0.2584 0.2436 0.0656 0.0544 0.0001 895 SER A CB +364 C CB B SER A 35 ? 0.2434 0.2575 0.2321 0.0699 0.0553 -0.0040 895 SER A CB +365 O OG A SER A 35 ? 0.3321 0.4104 0.3209 0.0160 0.0204 -0.0116 895 SER A OG +366 O OG B SER A 35 ? 0.3053 0.3448 0.2820 0.0184 0.0342 -0.0033 895 SER A OG +367 N N . ALA A 36 ? 0.2287 0.2378 0.2321 0.1003 0.0615 0.0058 896 ALA A N +368 C CA . ALA A 36 ? 0.2443 0.2640 0.2147 0.1202 0.0482 -0.0117 896 ALA A CA +369 C C . ALA A 36 ? 0.2580 0.2457 0.2123 0.1239 0.0357 -0.0087 896 ALA A C +370 O O . ALA A 36 ? 0.3247 0.3116 0.2058 0.1600 0.0422 -0.0042 896 ALA A O +371 C CB . ALA A 36 ? 0.2827 0.2804 0.2996 0.0981 0.0499 -0.0133 896 ALA A CB +372 N N A LYS A 37 ? 0.2649 0.2410 0.2062 0.1234 0.0327 -0.0179 897 LYS A N +373 N N B LYS A 37 ? 0.2264 0.2298 0.2129 0.1066 0.0206 -0.0043 897 LYS A N +374 C CA A LYS A 37 ? 0.2520 0.2355 0.2007 0.0868 0.0306 -0.0218 897 LYS A CA +375 C CA B LYS A 37 ? 0.2165 0.2230 0.2220 0.0693 0.0180 -0.0029 897 LYS A CA +376 C C A LYS A 37 ? 0.2056 0.1434 0.1758 0.0541 0.0153 0.0037 897 LYS A C +377 C C B LYS A 37 ? 0.1699 0.1703 0.1888 0.0385 0.0000 0.0113 897 LYS A C +378 O O A LYS A 37 ? 0.2254 0.1178 0.1729 0.0662 0.0169 0.0000 897 LYS A O +379 O O B LYS A 37 ? 0.1493 0.1348 0.1870 0.0567 0.0014 0.0162 897 LYS A O +380 C CB A LYS A 37 ? 0.2971 0.2607 0.2670 0.0703 0.0191 -0.0508 897 LYS A CB +381 C CB B LYS A 37 ? 0.2555 0.2352 0.2758 0.0616 0.0112 -0.0232 897 LYS A CB +382 C CG A LYS A 37 ? 0.2781 0.2752 0.2938 0.0109 0.0120 -0.0028 897 LYS A CG +383 C CG B LYS A 37 ? 0.3377 0.3347 0.3538 0.0110 0.0116 -0.0030 897 LYS A CG +384 C CD A LYS A 37 ? 0.2830 0.2777 0.2958 0.0130 0.0091 -0.0049 897 LYS A CD +385 C CD B LYS A 37 ? 0.3404 0.3355 0.3544 0.0133 0.0089 -0.0055 897 LYS A CD +386 C CE A LYS A 37 ? 0.2850 0.2817 0.2963 0.0154 0.0101 -0.0080 897 LYS A CE +387 C CE B LYS A 37 ? 0.3414 0.3331 0.3502 0.0133 0.0069 -0.0046 897 LYS A CE +388 N NZ A LYS A 37 ? 0.2769 0.2750 0.2939 0.0168 0.0092 -0.0104 897 LYS A NZ +389 N NZ B LYS A 37 ? 0.3410 0.3307 0.3496 0.0145 0.0038 -0.0071 897 LYS A NZ +390 N N A ASN A 38 ? 0.1806 0.0963 0.1514 0.0260 0.0295 0.0028 898 ASN A N +391 N N B ASN A 38 ? 0.1491 0.1549 0.1902 0.0198 0.0077 0.0172 898 ASN A N +392 C CA A ASN A 38 ? 0.1675 0.0709 0.1486 0.0133 0.0289 0.0107 898 ASN A CA +393 C CA B ASN A 38 ? 0.1580 0.1209 0.1961 0.0045 0.0183 0.0164 898 ASN A CA +394 C C A ASN A 38 ? 0.1916 0.0638 0.1640 0.0042 0.0361 0.0000 898 ASN A C +395 C C B ASN A 38 ? 0.1702 0.1093 0.2079 0.0040 0.0261 0.0122 898 ASN A C +396 O O A ASN A 38 ? 0.2031 0.0932 0.1803 -0.0176 0.0386 -0.0160 898 ASN A O +397 O O B ASN A 38 ? 0.1702 0.1453 0.2178 -0.0147 0.0229 0.0134 898 ASN A O +398 C CB A ASN A 38 ? 0.1515 0.0699 0.1395 0.0028 0.0201 0.0069 898 ASN A CB +399 C CB B ASN A 38 ? 0.1744 0.1315 0.2056 0.0061 0.0089 0.0218 898 ASN A CB +400 C CG A ASN A 38 ? 0.1378 0.0633 0.1428 0.0094 0.0255 0.0170 898 ASN A CG +401 C CG B ASN A 38 ? 0.1829 0.1325 0.2048 -0.0031 0.0093 0.0144 898 ASN A CG +402 O OD1 A ASN A 38 ? 0.1373 0.0767 0.1632 0.0098 0.0275 0.0233 898 ASN A OD1 +403 O OD1 B ASN A 38 ? 0.1772 0.1322 0.1981 -0.0045 0.0082 0.0260 898 ASN A OD1 +404 N ND2 A ASN A 38 ? 0.1198 0.0663 0.1458 0.0071 0.0198 0.0150 898 ASN A ND2 +405 N ND2 B ASN A 38 ? 0.2292 0.1408 0.2053 -0.0016 0.0135 0.0157 898 ASN A ND2 +406 N N A ILE A 39 ? 0.1989 0.0557 0.1738 0.0037 0.0528 -0.0015 899 ILE A N +407 N N B ILE A 39 ? 0.1901 0.0840 0.2042 0.0021 0.0469 0.0020 899 ILE A N +408 C CA A ILE A 39 ? 0.2063 0.0653 0.1881 -0.0073 0.0533 -0.0053 899 ILE A CA +409 C CA B ILE A 39 ? 0.2047 0.0896 0.1878 -0.0054 0.0423 -0.0018 899 ILE A CA +410 C C A ILE A 39 ? 0.1976 0.0621 0.1855 -0.0140 0.0527 -0.0034 899 ILE A C +411 C C B ILE A 39 ? 0.1943 0.0767 0.1744 -0.0191 0.0350 -0.0092 899 ILE A C +412 O O A ILE A 39 ? 0.2076 0.0640 0.1967 -0.0267 0.0674 -0.0015 899 ILE A O +413 O O B ILE A 39 ? 0.1793 0.0733 0.1650 -0.0040 0.0308 -0.0101 899 ILE A O +414 C CB A ILE A 39 ? 0.1856 0.0539 0.1952 -0.0119 0.0578 -0.0086 899 ILE A CB +415 C CB B ILE A 39 ? 0.1835 0.1047 0.2047 -0.0169 0.0383 0.0087 899 ILE A CB +416 C CG1 A ILE A 39 ? 0.1410 0.1310 0.1667 0.0049 0.0041 0.0015 899 ILE A CG1 +417 C CG1 B ILE A 39 ? 0.2861 0.2778 0.3098 0.0070 0.0054 0.0000 899 ILE A CG1 +418 C CG2 A ILE A 39 ? 0.1427 0.1330 0.1636 0.0082 0.0045 -0.0004 899 ILE A CG2 +419 C CG2 B ILE A 39 ? 0.2840 0.2723 0.3085 0.0062 0.0010 0.0007 899 ILE A CG2 +420 C CD1 A ILE A 39 ? 0.1407 0.1331 0.1706 0.0052 0.0025 0.0003 899 ILE A CD1 +421 C CD1 B ILE A 39 ? 0.2940 0.2846 0.3141 0.0091 0.0045 -0.0013 899 ILE A CD1 +422 N N . ASP A 40 ? 0.2033 0.0676 0.1657 -0.0279 0.0415 -0.0083 900 ASP A N +423 C CA . ASP A 40 ? 0.1802 0.0765 0.1596 -0.0278 0.0249 -0.0057 900 ASP A CA +424 C C . ASP A 40 ? 0.1453 0.0605 0.1521 -0.0203 0.0171 -0.0107 900 ASP A C +425 O O . ASP A 40 ? 0.2213 0.0670 0.1548 -0.0430 0.0273 -0.0180 900 ASP A O +426 C CB . ASP A 40 ? 0.2287 0.1399 0.1920 -0.0307 -0.0180 0.0120 900 ASP A CB +427 C CG . ASP A 40 ? 0.2415 0.1927 0.2442 0.0024 -0.0198 0.0167 900 ASP A CG +428 O OD1 . ASP A 40 ? 0.2061 0.1974 0.2955 0.0141 -0.0143 0.0523 900 ASP A OD1 +429 O OD2 . ASP A 40 ? 0.3277 0.1999 0.3189 -0.0007 -0.0334 0.0404 900 ASP A OD2 +430 N N . ILE A 41 ? 0.0873 0.0533 0.1447 -0.0064 0.0137 -0.0040 901 ILE A N +431 C CA . ILE A 41 ? 0.0881 0.0528 0.1442 -0.0056 0.0076 -0.0031 901 ILE A CA +432 C C . ILE A 41 ? 0.0861 0.0496 0.1400 -0.0061 0.0063 0.0024 901 ILE A C +433 O O . ILE A 41 ? 0.0918 0.0535 0.1575 -0.0064 0.0156 -0.0079 901 ILE A O +434 C CB . ILE A 41 ? 0.0877 0.0641 0.1565 -0.0001 0.0031 -0.0062 901 ILE A CB +435 C CG1 . ILE A 41 ? 0.0921 0.0861 0.1723 0.0066 0.0045 -0.0125 901 ILE A CG1 +436 C CG2 . ILE A 41 ? 0.1088 0.0687 0.1613 -0.0001 -0.0005 0.0022 901 ILE A CG2 +437 C CD1 . ILE A 41 ? 0.1020 0.1286 0.1944 0.0270 -0.0091 -0.0133 901 ILE A CD1 +438 N N . SER A 42 ? 0.0822 0.0579 0.1406 -0.0071 0.0082 -0.0049 902 SER A N +439 C CA . SER A 42 ? 0.0782 0.0599 0.1542 -0.0021 0.0047 0.0023 902 SER A CA +440 C C . SER A 42 ? 0.0719 0.0542 0.1515 -0.0071 0.0069 -0.0050 902 SER A C +441 O O . SER A 42 ? 0.1223 0.0556 0.1658 -0.0130 0.0294 -0.0090 902 SER A O +442 C CB . SER A 42 ? 0.1100 0.1178 0.1707 0.0033 -0.0138 0.0229 902 SER A CB +443 O OG . SER A 42 ? 0.1259 0.1895 0.2097 0.0270 -0.0077 0.0162 902 SER A OG +444 N N . VAL A 43 ? 0.0636 0.0506 0.1448 -0.0049 -0.0014 -0.0037 903 VAL A N +445 C CA . VAL A 43 ? 0.0636 0.0494 0.1482 -0.0039 -0.0023 -0.0023 903 VAL A CA +446 C C . VAL A 43 ? 0.0641 0.0516 0.1454 -0.0050 -0.0019 -0.0007 903 VAL A C +447 O O . VAL A 43 ? 0.0735 0.0560 0.1798 -0.0017 0.0091 -0.0153 903 VAL A O +448 C CB . VAL A 43 ? 0.0782 0.0596 0.1555 -0.0063 -0.0130 -0.0053 903 VAL A CB +449 C CG1 . VAL A 43 ? 0.0943 0.0950 0.1626 -0.0149 -0.0093 0.0066 903 VAL A CG1 +450 C CG2 . VAL A 43 ? 0.0816 0.0623 0.1588 -0.0014 -0.0181 0.0007 903 VAL A CG2 +451 N N . LEU A 44 ? 0.0577 0.0553 0.1439 -0.0028 -0.0024 0.0030 904 LEU A N +452 C CA . LEU A 44 ? 0.0589 0.0669 0.1460 0.0046 -0.0066 0.0048 904 LEU A CA +453 C C . LEU A 44 ? 0.0562 0.0634 0.1437 0.0038 -0.0093 0.0053 904 LEU A C +454 O O . LEU A 44 ? 0.0758 0.0647 0.1469 0.0022 -0.0090 0.0066 904 LEU A O +455 C CB . LEU A 44 ? 0.0582 0.0885 0.1553 0.0035 -0.0121 0.0005 904 LEU A CB +456 C CG . LEU A 44 ? 0.1013 0.1237 0.1517 0.0001 -0.0121 -0.0075 904 LEU A CG +457 C CD1 . LEU A 44 ? 0.1041 0.1627 0.1660 -0.0017 -0.0255 -0.0146 904 LEU A CD1 +458 C CD2 . LEU A 44 ? 0.1979 0.1382 0.1691 -0.0027 -0.0249 0.0126 904 LEU A CD2 +459 N N . ASN A 45 ? 0.0655 0.0670 0.1350 0.0065 -0.0064 0.0055 905 ASN A N +460 C CA . ASN A 45 ? 0.0671 0.0697 0.1341 0.0053 -0.0117 0.0052 905 ASN A CA +461 C C . ASN A 45 ? 0.0673 0.0719 0.1352 0.0045 -0.0102 0.0077 905 ASN A C +462 O O . ASN A 45 ? 0.0709 0.0767 0.1542 0.0092 -0.0061 0.0096 905 ASN A O +463 C CB . ASN A 45 ? 0.0800 0.0734 0.1418 -0.0024 -0.0027 0.0007 905 ASN A CB +464 C CG . ASN A 45 ? 0.0660 0.0702 0.1396 0.0027 -0.0044 0.0019 905 ASN A CG +465 O OD1 . ASN A 45 ? 0.0803 0.0747 0.1360 -0.0011 -0.0058 0.0034 905 ASN A OD1 +466 N ND2 . ASN A 45 ? 0.0936 0.0782 0.1433 -0.0056 -0.0045 -0.0057 905 ASN A ND2 +467 N N . GLU A 46 ? 0.0593 0.0758 0.1373 -0.0005 -0.0174 0.0031 906 GLU A N +468 C CA . GLU A 46 ? 0.0586 0.0948 0.1456 0.0005 -0.0188 -0.0001 906 GLU A CA +469 C C . GLU A 46 ? 0.0584 0.0997 0.1501 0.0004 -0.0143 -0.0011 906 GLU A C +470 O O . GLU A 46 ? 0.0612 0.1640 0.1660 0.0171 -0.0133 -0.0070 906 GLU A O +471 C CB . GLU A 46 ? 0.0640 0.0983 0.1636 -0.0063 -0.0203 -0.0057 906 GLU A CB +472 C CG . GLU A 46 ? 0.0918 0.1081 0.1637 0.0047 -0.0239 -0.0130 906 GLU A CG +473 C CD . GLU A 46 ? 0.1401 0.1126 0.1894 0.0036 -0.0260 -0.0254 906 GLU A CD +474 O OE1 . GLU A 46 ? 0.2037 0.1114 0.2093 -0.0080 -0.0378 -0.0099 906 GLU A OE1 +475 O OE2 . GLU A 46 ? 0.1777 0.1558 0.2086 0.0100 -0.0122 -0.0536 906 GLU A OE2 +476 N N . TYR A 47 ? 0.0635 0.0919 0.1440 0.0024 -0.0092 -0.0012 907 TYR A N +477 C CA . TYR A 47 ? 0.0738 0.1113 0.1447 0.0026 -0.0041 -0.0041 907 TYR A CA +478 C C . TYR A 47 ? 0.0707 0.1092 0.1533 0.0104 -0.0066 -0.0080 907 TYR A C +479 O O . TYR A 47 ? 0.1051 0.1200 0.1636 0.0047 0.0076 -0.0158 907 TYR A O +480 C CB . TYR A 47 ? 0.0876 0.1202 0.1507 -0.0028 0.0021 0.0034 907 TYR A CB +481 C CG . TYR A 47 ? 0.1009 0.1176 0.1621 -0.0068 -0.0051 0.0129 907 TYR A CG +482 C CD1 . TYR A 47 ? 0.1075 0.1120 0.1780 -0.0036 -0.0041 0.0119 907 TYR A CD1 +483 C CD2 . TYR A 47 ? 0.1109 0.1515 0.1866 -0.0149 0.0108 0.0083 907 TYR A CD2 +484 C CE1 . TYR A 47 ? 0.1337 0.1213 0.1984 -0.0214 -0.0094 0.0184 907 TYR A CE1 +485 C CE2 . TYR A 47 ? 0.1166 0.1743 0.2073 -0.0323 0.0083 0.0178 907 TYR A CE2 +486 C CZ . TYR A 47 ? 0.1337 0.1503 0.2041 -0.0368 -0.0062 0.0274 907 TYR A CZ +487 O OH . TYR A 47 ? 0.1671 0.1846 0.2571 -0.0688 -0.0036 0.0136 907 TYR A OH +488 N N . GLY A 48 ? 0.0671 0.0917 0.1577 0.0152 -0.0081 -0.0058 908 GLY A N +489 C CA . GLY A 48 ? 0.0817 0.0928 0.1687 0.0137 -0.0052 -0.0098 908 GLY A CA +490 C C . GLY A 48 ? 0.0828 0.0978 0.1701 0.0115 -0.0048 -0.0192 908 GLY A C +491 O O . GLY A 48 ? 0.1310 0.1026 0.2031 0.0211 -0.0162 -0.0338 908 GLY A O +492 N N . ILE A 49 ? 0.0812 0.0987 0.1558 0.0060 -0.0084 -0.0122 909 ILE A N +493 C CA . ILE A 49 ? 0.0852 0.1038 0.1489 -0.0045 -0.0033 -0.0124 909 ILE A CA +494 C C . ILE A 49 ? 0.0904 0.0848 0.1471 -0.0010 -0.0063 -0.0111 909 ILE A C +495 O O . ILE A 49 ? 0.0938 0.0883 0.1515 -0.0092 -0.0096 -0.0045 909 ILE A O +496 C CB . ILE A 49 ? 0.1004 0.1094 0.1506 -0.0177 -0.0102 0.0005 909 ILE A CB +497 C CG1 . ILE A 49 ? 0.1038 0.0847 0.1584 -0.0120 -0.0146 0.0035 909 ILE A CG1 +498 C CG2 . ILE A 49 ? 0.1107 0.1412 0.1745 -0.0330 -0.0038 0.0070 909 ILE A CG2 +499 C CD1 . ILE A 49 ? 0.1227 0.1093 0.1911 -0.0021 -0.0058 0.0331 909 ILE A CD1 +500 N N . GLY A 50 ? 0.0882 0.0849 0.1398 -0.0013 -0.0008 -0.0140 910 GLY A N +501 C CA . GLY A 50 ? 0.0925 0.0812 0.1420 -0.0036 -0.0031 -0.0138 910 GLY A CA +502 C C . GLY A 50 ? 0.0911 0.0722 0.1416 -0.0057 -0.0044 -0.0088 910 GLY A C +503 O O . GLY A 50 ? 0.1126 0.0936 0.1480 0.0099 -0.0075 -0.0038 910 GLY A O +504 N N . MSE A 51 ? 0.0824 0.0763 0.1402 0.0033 -0.0051 -0.0021 911 MSE A N +505 C CA . MSE A 51 ? 0.0793 0.0769 0.1363 0.0047 -0.0042 0.0041 911 MSE A CA +506 C C . MSE A 51 ? 0.0781 0.0753 0.1330 0.0053 -0.0063 0.0027 911 MSE A C +507 O O . MSE A 51 ? 0.0894 0.0845 0.1467 0.0166 -0.0048 0.0084 911 MSE A O +508 C CB . MSE A 51 ? 0.0811 0.0811 0.1398 0.0006 -0.0054 0.0042 911 MSE A CB +509 C CG . MSE A 51 ? 0.0832 0.0787 0.1418 0.0066 -0.0084 -0.0040 911 MSE A CG +510 SE SE . MSE A 51 ? 0.0718 0.0815 0.1563 0.0017 -0.0172 -0.0051 911 MSE A SE +511 C CE . MSE A 51 ? 0.0830 0.0935 0.1637 0.0053 -0.0160 -0.0128 911 MSE A CE +512 N N . THR A 52 ? 0.0748 0.0689 0.1427 0.0020 -0.0003 0.0120 912 THR A N +513 C CA . THR A 52 ? 0.0714 0.0718 0.1431 0.0054 -0.0017 0.0142 912 THR A CA +514 C C . THR A 52 ? 0.0681 0.0653 0.1384 0.0003 -0.0045 0.0129 912 THR A C +515 O O . THR A 52 ? 0.0771 0.0669 0.1428 0.0029 -0.0023 0.0176 912 THR A O +516 C CB . THR A 52 ? 0.0963 0.0770 0.1778 -0.0052 0.0144 -0.0010 912 THR A CB +517 O OG1 . THR A 52 ? 0.1276 0.0808 0.2018 0.0046 0.0351 0.0158 912 THR A OG1 +518 C CG2 . THR A 52 ? 0.1106 0.1264 0.1875 -0.0207 -0.0013 -0.0152 912 THR A CG2 +519 N N . TRP A 53 ? 0.0691 0.0648 0.1422 0.0095 0.0004 0.0158 913 TRP A N +520 C CA . TRP A 53 ? 0.0617 0.0648 0.1410 0.0056 -0.0021 0.0124 913 TRP A CA +521 C C . TRP A 53 ? 0.0644 0.0603 0.1375 0.0019 -0.0048 0.0058 913 TRP A C +522 O O . TRP A 53 ? 0.0660 0.0602 0.1518 -0.0001 -0.0049 0.0101 913 TRP A O +523 C CB . TRP A 53 ? 0.0608 0.0660 0.1495 0.0040 -0.0042 0.0088 913 TRP A CB +524 C CG . TRP A 53 ? 0.0606 0.0492 0.1472 0.0018 -0.0057 0.0015 913 TRP A CG +525 C CD1 . TRP A 53 ? 0.0612 0.0544 0.1561 0.0025 -0.0081 0.0000 913 TRP A CD1 +526 C CD2 . TRP A 53 ? 0.0606 0.0494 0.1383 0.0018 -0.0126 0.0025 913 TRP A CD2 +527 N NE1 . TRP A 53 ? 0.0586 0.0616 0.1522 0.0041 -0.0195 0.0002 913 TRP A NE1 +528 C CE2 . TRP A 53 ? 0.0578 0.0511 0.1437 0.0050 -0.0181 -0.0022 913 TRP A CE2 +529 C CE3 . TRP A 53 ? 0.0608 0.0637 0.1409 0.0051 -0.0145 0.0067 913 TRP A CE3 +530 C CZ2 . TRP A 53 ? 0.0748 0.0567 0.1398 0.0092 -0.0198 -0.0009 913 TRP A CZ2 +531 C CZ3 . TRP A 53 ? 0.0650 0.0669 0.1448 0.0062 -0.0080 0.0054 913 TRP A CZ3 +532 C CH2 . TRP A 53 ? 0.0748 0.0588 0.1399 0.0078 -0.0089 0.0011 913 TRP A CH2 +533 N N . VAL A 54 ? 0.0616 0.0643 0.1433 0.0015 -0.0038 0.0084 914 VAL A N +534 C CA . VAL A 54 ? 0.0627 0.0686 0.1450 -0.0029 -0.0054 0.0080 914 VAL A CA +535 C C . VAL A 54 ? 0.0529 0.0632 0.1498 -0.0034 -0.0123 0.0087 914 VAL A C +536 O O . VAL A 54 ? 0.0713 0.0616 0.1602 0.0049 0.0031 0.0114 914 VAL A O +537 C CB . VAL A 54 ? 0.0780 0.0911 0.1560 -0.0157 -0.0121 0.0018 914 VAL A CB +538 C CG1 . VAL A 54 ? 0.1250 0.0986 0.1748 -0.0031 -0.0180 -0.0091 914 VAL A CG1 +539 C CG2 . VAL A 54 ? 0.0941 0.1046 0.1624 -0.0023 -0.0284 0.0014 914 VAL A CG2 +540 N N . LEU A 55 ? 0.0590 0.0632 0.1577 -0.0020 -0.0043 0.0048 915 LEU A N +541 C CA . LEU A 55 ? 0.0527 0.0635 0.1569 0.0056 -0.0078 0.0108 915 LEU A CA +542 C C . LEU A 55 ? 0.0549 0.0678 0.1556 0.0005 -0.0077 0.0091 915 LEU A C +543 O O . LEU A 55 ? 0.0600 0.0713 0.1820 -0.0065 -0.0082 0.0103 915 LEU A O +544 C CB . LEU A 55 ? 0.0542 0.0694 0.1567 0.0015 -0.0084 0.0059 915 LEU A CB +545 C CG . LEU A 55 ? 0.0613 0.0779 0.1547 0.0093 -0.0110 0.0046 915 LEU A CG +546 C CD1 . LEU A 55 ? 0.0778 0.0754 0.1592 0.0114 -0.0168 0.0035 915 LEU A CD1 +547 C CD2 . LEU A 55 ? 0.0746 0.0920 0.1621 0.0057 -0.0133 0.0147 915 LEU A CD2 +548 N N . HIS A 56 ? 0.0539 0.0737 0.1585 0.0034 -0.0135 0.0060 916 HIS A N +549 C CA . HIS A 56 ? 0.0530 0.0808 0.1740 -0.0009 -0.0186 -0.0043 916 HIS A CA +550 C C . HIS A 56 ? 0.0550 0.0839 0.1795 -0.0032 -0.0129 -0.0072 916 HIS A C +551 O O . HIS A 56 ? 0.0736 0.0846 0.1936 -0.0067 0.0033 -0.0114 916 HIS A O +552 C CB . HIS A 56 ? 0.0665 0.1057 0.1800 0.0027 -0.0208 0.0029 916 HIS A CB +553 C CG . HIS A 56 ? 0.0683 0.1176 0.1863 -0.0025 -0.0224 -0.0057 916 HIS A CG +554 N ND1 . HIS A 56 ? 0.0806 0.1258 0.1801 -0.0112 -0.0086 -0.0160 916 HIS A ND1 +555 C CD2 . HIS A 56 ? 0.1230 0.1690 0.1973 -0.0384 0.0077 -0.0096 916 HIS A CD2 +556 C CE1 . HIS A 56 ? 0.0902 0.1456 0.1912 -0.0067 -0.0079 -0.0305 916 HIS A CE1 +557 N NE2 . HIS A 56 ? 0.1267 0.1969 0.2010 -0.0275 0.0217 -0.0339 916 HIS A NE2 +558 N N . HIS A 57 ? 0.0591 0.0901 0.1784 -0.0006 -0.0078 -0.0098 917 HIS A N +559 C CA . HIS A 57 ? 0.0632 0.0937 0.1816 0.0036 -0.0111 -0.0141 917 HIS A CA +560 C C . HIS A 57 ? 0.0564 0.0998 0.1793 0.0050 -0.0112 -0.0196 917 HIS A C +561 O O . HIS A 57 ? 0.0600 0.1125 0.1961 0.0075 -0.0202 -0.0312 917 HIS A O +562 C CB . HIS A 57 ? 0.0841 0.1048 0.1842 0.0006 -0.0051 -0.0112 917 HIS A CB +563 C CG . HIS A 57 ? 0.0758 0.1224 0.1893 -0.0044 -0.0022 -0.0171 917 HIS A CG +564 N ND1 . HIS A 57 ? 0.0780 0.1840 0.2043 0.0009 -0.0168 -0.0477 917 HIS A ND1 +565 C CD2 . HIS A 57 ? 0.1027 0.1593 0.1845 0.0047 -0.0030 -0.0200 917 HIS A CD2 +566 C CE1 . HIS A 57 ? 0.0919 0.1790 0.2072 0.0110 -0.0061 -0.0400 917 HIS A CE1 +567 N NE2 . HIS A 57 ? 0.1035 0.1473 0.1902 0.0025 -0.0041 -0.0256 917 HIS A NE2 +568 N N A GLU A 58 ? 0.0616 0.1016 0.1865 0.0075 -0.0234 -0.0263 918 GLU A N +569 N N B GLU A 58 ? 0.0567 0.1034 0.1720 0.0103 -0.0172 -0.0204 918 GLU A N +570 C CA A GLU A 58 ? 0.0814 0.1232 0.1889 0.0088 -0.0333 -0.0168 918 GLU A CA +571 C CA B GLU A 58 ? 0.0671 0.1137 0.1679 0.0119 -0.0194 -0.0172 918 GLU A CA +572 C C A GLU A 58 ? 0.0702 0.1247 0.1823 0.0155 -0.0268 -0.0182 918 GLU A C +573 C C B GLU A 58 ? 0.0612 0.1186 0.1627 0.0149 -0.0173 -0.0151 918 GLU A C +574 O O A GLU A 58 ? 0.0714 0.1540 0.1873 0.0152 -0.0316 -0.0157 918 GLU A O +575 O O B GLU A 58 ? 0.0484 0.1217 0.1653 0.0153 -0.0131 -0.0079 918 GLU A O +576 C CB A GLU A 58 ? 0.1120 0.1157 0.1925 0.0070 -0.0506 -0.0195 918 GLU A CB +577 C CB B GLU A 58 ? 0.0776 0.1174 0.1689 0.0239 -0.0279 -0.0181 918 GLU A CB +578 C CG A GLU A 58 ? 0.1156 0.1648 0.1928 0.0171 -0.0033 -0.0101 918 GLU A CG +579 C CG B GLU A 58 ? 0.1524 0.2015 0.2295 0.0185 -0.0053 -0.0095 918 GLU A CG +580 C CD A GLU A 58 ? 0.1215 0.1705 0.1997 0.0222 -0.0034 -0.0109 918 GLU A CD +581 C CD B GLU A 58 ? 0.1589 0.2106 0.2389 0.0242 -0.0071 -0.0100 918 GLU A CD +582 O OE1 A GLU A 58 ? 0.1177 0.1626 0.1932 0.0225 -0.0009 -0.0114 918 GLU A OE1 +583 O OE1 B GLU A 58 ? 0.1634 0.2110 0.2412 0.0272 -0.0104 -0.0081 918 GLU A OE1 +584 O OE2 A GLU A 58 ? 0.1361 0.1891 0.2176 0.0262 -0.0060 -0.0111 918 GLU A OE2 +585 O OE2 B GLU A 58 ? 0.1580 0.2159 0.2425 0.0258 -0.0050 -0.0123 918 GLU A OE2 +586 N N A SER A 59 ? 0.0511 0.1236 0.1651 0.0148 -0.0281 -0.0276 919 SER A N +587 N N B SER A 59 ? 0.0680 0.1230 0.1648 0.0112 -0.0147 -0.0144 919 SER A N +588 C CA A SER A 59 ? 0.0534 0.1328 0.1666 0.0076 -0.0213 -0.0234 919 SER A CA +589 C CA B SER A 59 ? 0.0694 0.1413 0.1726 0.0045 -0.0139 -0.0186 919 SER A CA +590 C C A SER A 59 ? 0.0524 0.1236 0.1626 0.0037 -0.0224 -0.0157 919 SER A C +591 C C B SER A 59 ? 0.0559 0.1273 0.1673 0.0044 -0.0167 -0.0096 919 SER A C +592 O O A SER A 59 ? 0.0556 0.1291 0.1678 -0.0013 -0.0222 -0.0146 919 SER A O +593 O O B SER A 59 ? 0.0632 0.1281 0.1718 -0.0025 -0.0173 -0.0092 919 SER A O +594 C CB A SER A 59 ? 0.0608 0.1499 0.1679 -0.0006 -0.0181 -0.0257 919 SER A CB +595 C CB B SER A 59 ? 0.0944 0.1763 0.1818 -0.0175 -0.0019 -0.0143 919 SER A CB +596 O OG A SER A 59 ? 0.0781 0.1645 0.1717 0.0043 -0.0102 -0.0343 919 SER A OG +597 O OG B SER A 59 ? 0.1291 0.1848 0.2123 -0.0101 -0.0110 -0.0001 919 SER A OG +598 N N . ASP A 60 ? 0.0576 0.1094 0.1654 0.0044 -0.0162 -0.0109 920 ASP A N +599 C CA . ASP A 60 ? 0.0580 0.1101 0.1682 0.0022 -0.0131 -0.0121 920 ASP A CA +600 C C . ASP A 60 ? 0.0579 0.1050 0.1626 0.0000 -0.0132 -0.0150 920 ASP A C +601 O O . ASP A 60 ? 0.0616 0.1176 0.1748 0.0056 -0.0168 -0.0094 920 ASP A O +602 C CB . ASP A 60 ? 0.0728 0.1160 0.1803 -0.0040 -0.0090 -0.0033 920 ASP A CB +603 C CG . ASP A 60 ? 0.0890 0.1120 0.2063 -0.0063 -0.0100 -0.0084 920 ASP A CG +604 O OD1 . ASP A 60 ? 0.0852 0.1214 0.2041 -0.0061 -0.0152 -0.0201 920 ASP A OD1 +605 O OD2 . ASP A 60 ? 0.1378 0.1162 0.2425 -0.0252 -0.0042 -0.0043 920 ASP A OD2 +606 N N A MSE A 61 ? 0.0633 0.1225 0.1624 0.0031 -0.0123 -0.0118 921 MSE A N +607 N N B MSE A 61 ? 0.0630 0.1212 0.1640 0.0033 -0.0130 -0.0108 921 MSE A N +608 C CA A MSE A 61 ? 0.0717 0.1362 0.1693 -0.0004 -0.0076 -0.0037 921 MSE A CA +609 C CA B MSE A 61 ? 0.0728 0.1351 0.1686 -0.0042 -0.0074 -0.0075 921 MSE A CA +610 C C A MSE A 61 ? 0.0878 0.1430 0.1785 -0.0145 -0.0019 -0.0160 921 MSE A C +611 C C B MSE A 61 ? 0.0912 0.1418 0.1772 -0.0095 0.0006 -0.0155 921 MSE A C +612 O O A MSE A 61 ? 0.1387 0.1603 0.1913 -0.0213 0.0248 -0.0135 921 MSE A O +613 O O B MSE A 61 ? 0.1321 0.1423 0.1783 -0.0093 0.0177 -0.0097 921 MSE A O +614 C CB A MSE A 61 ? 0.0852 0.1517 0.1768 0.0031 -0.0176 0.0048 921 MSE A CB +615 C CB B MSE A 61 ? 0.0725 0.1469 0.1740 -0.0028 -0.0197 0.0001 921 MSE A CB +616 C CG A MSE A 61 ? 0.1011 0.1335 0.2042 0.0058 -0.0175 0.0126 921 MSE A CG +617 C CG B MSE A 61 ? 0.0796 0.1427 0.1846 0.0031 -0.0173 0.0037 921 MSE A CG +618 SE SE A MSE A 61 ? 0.1118 0.1313 0.2123 0.0053 -0.0269 0.0022 921 MSE A SE +619 SE SE B MSE A 61 ? 0.0716 0.1401 0.1773 0.0115 -0.0161 0.0026 921 MSE A SE +620 C CE A MSE A 61 ? 0.1433 0.1798 0.2210 0.0137 -0.0140 0.0054 921 MSE A CE +621 C CE B MSE A 61 ? 0.0870 0.1512 0.1830 -0.0032 -0.0133 0.0030 921 MSE A CE +622 N N A GLN A 62 ? 0.0869 0.1434 0.1853 -0.0293 -0.0009 -0.0364 922 GLN A N +623 N N B GLN A 62 ? 0.0951 0.1519 0.1960 -0.0252 0.0092 -0.0295 922 GLN A N +624 C CA A GLN A 62 ? 0.1003 0.1477 0.1923 -0.0320 -0.0096 -0.0457 922 GLN A CA +625 C CA B GLN A 62 ? 0.1163 0.1581 0.2057 -0.0297 0.0078 -0.0395 922 GLN A CA +626 C C A GLN A 62 ? 0.0945 0.1335 0.2182 -0.0282 -0.0162 -0.0521 922 GLN A C +627 C C B GLN A 62 ? 0.0927 0.1587 0.2279 -0.0278 0.0025 -0.0473 922 GLN A C +628 O O A GLN A 62 ? 0.0917 0.1388 0.2234 -0.0289 -0.0171 -0.0542 922 GLN A O +629 O O B GLN A 62 ? 0.1282 0.1804 0.2635 -0.0158 0.0287 -0.0614 922 GLN A O +630 C CB A GLN A 62 ? 0.0998 0.1519 0.2081 -0.0304 -0.0177 -0.0428 922 GLN A CB +631 C CB B GLN A 62 ? 0.1270 0.1765 0.2229 -0.0437 0.0113 -0.0513 922 GLN A CB +632 C CG A GLN A 62 ? 0.1213 0.2008 0.2078 -0.0135 -0.0142 -0.0252 922 GLN A CG +633 C CG B GLN A 62 ? 0.2618 0.3326 0.3492 -0.0217 -0.0093 -0.0286 922 GLN A CG +634 C CD A GLN A 62 ? 0.1260 0.2054 0.2073 -0.0125 -0.0174 -0.0253 922 GLN A CD +635 C CD B GLN A 62 ? 0.2628 0.3330 0.3450 -0.0205 -0.0124 -0.0292 922 GLN A CD +636 O OE1 A GLN A 62 ? 0.1352 0.2073 0.2120 -0.0141 -0.0164 -0.0253 922 GLN A OE1 +637 O OE1 B GLN A 62 ? 0.2588 0.3334 0.3388 -0.0167 -0.0157 -0.0277 922 GLN A OE1 +638 N NE2 A GLN A 62 ? 0.1318 0.2195 0.2136 -0.0095 -0.0214 -0.0254 922 GLN A NE2 +639 N NE2 B GLN A 62 ? 0.2613 0.3260 0.3415 -0.0236 -0.0113 -0.0313 922 GLN A NE2 +640 N N . ASN A 63 ? 0.0995 0.1506 0.2229 -0.0089 -0.0125 -0.0454 923 ASN A N +641 C CA . ASN A 63 ? 0.0943 0.1374 0.2588 -0.0036 -0.0139 -0.0401 923 ASN A CA +642 C C . ASN A 63 ? 0.0911 0.1117 0.2226 -0.0010 0.0000 -0.0304 923 ASN A C +643 O O . ASN A 63 ? 0.1236 0.1210 0.2250 0.0215 -0.0212 -0.0371 923 ASN A O +644 C CB . ASN A 63 ? 0.1269 0.1498 0.3124 -0.0144 0.0018 -0.0134 923 ASN A CB +645 C CG . ASN A 63 ? 0.1651 0.1697 0.3618 -0.0252 -0.0072 -0.0490 923 ASN A CG +646 O OD1 . ASN A 63 ? 0.2380 0.1794 0.4488 -0.0226 -0.0087 -0.0902 923 ASN A OD1 +647 N ND2 . ASN A 63 ? 0.1633 0.1991 0.3941 -0.0286 0.0022 -0.0695 923 ASN A ND2 +648 N N . TYR A 64 ? 0.0875 0.1128 0.2346 -0.0063 -0.0111 -0.0371 924 TYR A N +649 C CA . TYR A 64 ? 0.1003 0.1152 0.2141 -0.0240 -0.0101 -0.0168 924 TYR A CA +650 C C . TYR A 64 ? 0.1142 0.0952 0.2188 -0.0271 0.0101 -0.0019 924 TYR A C +651 O O . TYR A 64 ? 0.2078 0.0918 0.2648 -0.0414 0.0353 0.0007 924 TYR A O +652 C CB . TYR A 64 ? 0.0996 0.1514 0.2233 -0.0146 -0.0114 -0.0129 924 TYR A CB +653 C CG . TYR A 64 ? 0.1060 0.1803 0.2211 -0.0165 -0.0182 -0.0218 924 TYR A CG +654 C CD1 . TYR A 64 ? 0.1072 0.1889 0.2136 -0.0221 -0.0237 -0.0166 924 TYR A CD1 +655 C CD2 . TYR A 64 ? 0.1473 0.1902 0.2352 0.0105 -0.0066 -0.0221 924 TYR A CD2 +656 C CE1 . TYR A 64 ? 0.1408 0.2085 0.2178 -0.0396 -0.0084 -0.0109 924 TYR A CE1 +657 C CE2 . TYR A 64 ? 0.1753 0.2175 0.2367 0.0084 -0.0025 -0.0333 924 TYR A CE2 +658 C CZ . TYR A 64 ? 0.1385 0.2331 0.2272 -0.0160 -0.0097 -0.0239 924 TYR A CZ +659 O OH . TYR A 64 ? 0.1796 0.3130 0.2282 -0.0259 -0.0080 -0.0373 924 TYR A OH +660 N N . ALA A 65 ? 0.0651 0.0912 0.1999 -0.0090 -0.0021 0.0063 925 ALA A N +661 C CA . ALA A 65 ? 0.0684 0.1097 0.1949 -0.0016 0.0112 0.0204 925 ALA A CA +662 C C . ALA A 65 ? 0.0789 0.1080 0.1900 0.0047 0.0107 0.0280 925 ALA A C +663 O O . ALA A 65 ? 0.0992 0.1577 0.2039 0.0221 0.0180 0.0538 925 ALA A O +664 C CB . ALA A 65 ? 0.0901 0.1218 0.1886 0.0156 0.0001 0.0081 925 ALA A CB +665 N N . ALA A 66 ? 0.0676 0.0908 0.1792 0.0049 0.0009 0.0176 926 ALA A N +666 C CA . ALA A 66 ? 0.0731 0.0883 0.1735 0.0088 -0.0012 0.0182 926 ALA A CA +667 C C . ALA A 66 ? 0.0620 0.0718 0.1661 -0.0019 -0.0095 0.0148 926 ALA A C +668 O O . ALA A 66 ? 0.0653 0.0743 0.1625 -0.0003 -0.0130 0.0116 926 ALA A O +669 C CB . ALA A 66 ? 0.0749 0.1231 0.1656 0.0117 -0.0081 0.0196 926 ALA A CB +670 N N . TYR A 67 ? 0.0675 0.0773 0.1635 0.0035 -0.0041 0.0193 927 TYR A N +671 C CA . TYR A 67 ? 0.0706 0.0793 0.1597 -0.0008 -0.0061 0.0127 927 TYR A CA +672 C C . TYR A 67 ? 0.0710 0.0643 0.1517 0.0023 -0.0025 0.0080 927 TYR A C +673 O O . TYR A 67 ? 0.0819 0.0891 0.1656 0.0171 -0.0059 0.0233 927 TYR A O +674 C CB . TYR A 67 ? 0.0939 0.1078 0.1922 -0.0072 -0.0047 -0.0149 927 TYR A CB +675 C CG . TYR A 67 ? 0.1775 0.1155 0.2471 -0.0269 0.0202 -0.0117 927 TYR A CG +676 C CD1 . TYR A 67 ? 0.2073 0.1240 0.3229 -0.0070 0.0051 -0.0244 927 TYR A CD1 +677 C CD2 . TYR A 67 ? 0.1916 0.1624 0.3324 -0.0618 0.0215 -0.0224 927 TYR A CD2 +678 C CE1 . TYR A 67 ? 0.2867 0.1306 0.4083 -0.0036 0.0327 -0.0107 927 TYR A CE1 +679 C CE2 . TYR A 67 ? 0.2434 0.1749 0.4203 -0.0922 0.0385 -0.0051 927 TYR A CE2 +680 C CZ . TYR A 67 ? 0.3173 0.1656 0.4361 -0.0478 0.0293 0.0335 927 TYR A CZ +681 O OH . TYR A 67 ? 0.4400 0.1649 0.5604 -0.0663 0.0273 0.0423 927 TYR A OH +682 N N . GLY A 68 ? 0.0717 0.0665 0.1513 0.0074 -0.0078 0.0030 928 GLY A N +683 C CA . GLY A 68 ? 0.0698 0.0705 0.1580 0.0094 -0.0048 0.0006 928 GLY A CA +684 C C . GLY A 68 ? 0.0823 0.0754 0.1577 0.0134 -0.0106 -0.0080 928 GLY A C +685 O O . GLY A 68 ? 0.1428 0.1192 0.1675 0.0390 -0.0276 -0.0245 928 GLY A O +686 N N A GLN A 69 ? 0.0786 0.0613 0.1528 0.0078 -0.0072 -0.0075 929 GLN A N +687 N N B GLN A 69 ? 0.0800 0.0605 0.1515 0.0092 -0.0058 -0.0074 929 GLN A N +688 C CA A GLN A 69 ? 0.0839 0.0601 0.1561 0.0079 -0.0007 -0.0050 929 GLN A CA +689 C CA B GLN A 69 ? 0.0878 0.0578 0.1545 0.0087 0.0001 -0.0057 929 GLN A CA +690 C C A GLN A 69 ? 0.0813 0.0544 0.1412 0.0155 -0.0035 0.0000 929 GLN A C +691 C C B GLN A 69 ? 0.0838 0.0537 0.1405 0.0172 -0.0029 0.0010 929 GLN A C +692 O O A GLN A 69 ? 0.0844 0.0641 0.1407 0.0089 -0.0031 0.0006 929 GLN A O +693 O O B GLN A 69 ? 0.0851 0.0611 0.1385 0.0098 -0.0012 0.0031 929 GLN A O +694 C CB A GLN A 69 ? 0.0996 0.0684 0.1798 -0.0069 0.0060 0.0021 929 GLN A CB +695 C CB B GLN A 69 ? 0.1112 0.0704 0.1714 -0.0005 0.0109 0.0043 929 GLN A CB +696 C CG A GLN A 69 ? 0.1254 0.0793 0.1976 0.0059 0.0022 -0.0029 929 GLN A CG +697 C CG B GLN A 69 ? 0.1424 0.0818 0.2036 0.0156 0.0065 -0.0002 929 GLN A CG +698 C CD A GLN A 69 ? 0.1688 0.0935 0.2110 0.0000 0.0092 0.0066 929 GLN A CD +699 C CD B GLN A 69 ? 0.1704 0.0990 0.2244 0.0123 0.0140 0.0137 929 GLN A CD +700 O OE1 A GLN A 69 ? 0.1890 0.1153 0.2570 -0.0382 -0.0039 0.0123 929 GLN A OE1 +701 O OE1 B GLN A 69 ? 0.1802 0.1483 0.2495 -0.0150 0.0247 0.0013 929 GLN A OE1 +702 N NE2 A GLN A 69 ? 0.1951 0.1290 0.2281 0.0161 0.0002 0.0273 929 GLN A NE2 +703 N NE2 B GLN A 69 ? 0.1937 0.1138 0.2393 0.0346 0.0239 0.0108 929 GLN A NE2 +704 N N . ALA A 70 ? 0.0877 0.0761 0.1406 0.0139 -0.0031 -0.0067 930 ALA A N +705 C CA . ALA A 70 ? 0.0863 0.0830 0.1584 0.0168 -0.0037 -0.0018 930 ALA A CA +706 C C . ALA A 70 ? 0.0906 0.0723 0.1804 0.0177 0.0006 0.0059 930 ALA A C +707 O O . ALA A 70 ? 0.1265 0.0720 0.2548 0.0145 -0.0298 -0.0042 930 ALA A O +708 C CB . ALA A 70 ? 0.1134 0.1531 0.1683 0.0141 0.0149 -0.0078 930 ALA A CB +709 N N . ASN A 71 ? 0.0921 0.0764 0.1882 0.0182 -0.0105 0.0137 931 ASN A N +710 C CA . ASN A 71 ? 0.0954 0.0827 0.1811 0.0203 -0.0069 0.0142 931 ASN A CA +711 C C . ASN A 71 ? 0.0948 0.0865 0.1750 0.0198 -0.0073 0.0160 931 ASN A C +712 O O . ASN A 71 ? 0.0900 0.0902 0.1778 0.0114 -0.0051 0.0177 931 ASN A O +713 C CB . ASN A 71 ? 0.0940 0.0925 0.1813 0.0090 -0.0056 0.0206 931 ASN A CB +714 C CG . ASN A 71 ? 0.0935 0.1183 0.1880 0.0153 -0.0049 0.0280 931 ASN A CG +715 O OD1 . ASN A 71 ? 0.1036 0.1336 0.1962 0.0279 0.0045 0.0378 931 ASN A OD1 +716 N ND2 . ASN A 71 ? 0.1176 0.1354 0.1894 0.0258 -0.0124 0.0238 931 ASN A ND2 +717 N N . GLY A 72 ? 0.1136 0.0912 0.1906 0.0226 0.0013 0.0094 932 GLY A N +718 C CA . GLY A 72 ? 0.1224 0.1164 0.1842 0.0205 0.0126 0.0172 932 GLY A CA +719 C C . GLY A 72 ? 0.1135 0.1255 0.1819 0.0240 0.0118 0.0218 932 GLY A C +720 O O . GLY A 72 ? 0.1495 0.1520 0.1871 0.0063 -0.0125 0.0362 932 GLY A O +721 N N . ASN A 73 ? 0.1043 0.1107 0.1799 0.0322 0.0149 0.0288 933 ASN A N +722 C CA . ASN A 73 ? 0.1026 0.1118 0.1844 0.0254 0.0135 0.0375 933 ASN A CA +723 C C . ASN A 73 ? 0.0795 0.0851 0.1762 0.0139 -0.0052 0.0306 933 ASN A C +724 O O . ASN A 73 ? 0.1172 0.0831 0.1865 0.0209 0.0045 0.0328 933 ASN A O +725 C CB . ASN A 73 ? 0.1056 0.1276 0.2077 0.0141 0.0203 0.0356 933 ASN A CB +726 C CG . ASN A 73 ? 0.0934 0.1371 0.2183 -0.0070 0.0023 0.0339 933 ASN A CG +727 O OD1 . ASN A 73 ? 0.1463 0.1597 0.2122 -0.0178 -0.0300 0.0400 933 ASN A OD1 +728 N ND2 . ASN A 73 ? 0.1344 0.1521 0.2323 -0.0320 -0.0008 0.0276 933 ASN A ND2 +729 N N . HIS A 74 ? 0.0734 0.0827 0.1698 0.0157 -0.0053 0.0226 934 HIS A N +730 C CA . HIS A 74 ? 0.0701 0.0766 0.1744 0.0116 -0.0100 0.0145 934 HIS A CA +731 C C . HIS A 74 ? 0.0673 0.0668 0.1890 0.0123 -0.0091 0.0112 934 HIS A C +732 O O . HIS A 74 ? 0.1006 0.0661 0.3270 0.0150 -0.0464 0.0131 934 HIS A O +733 C CB . HIS A 74 ? 0.1001 0.1171 0.1724 0.0181 -0.0032 0.0207 934 HIS A CB +734 C CG . HIS A 74 ? 0.1587 0.1387 0.1841 0.0130 -0.0386 0.0208 934 HIS A CG +735 N ND1 . HIS A 74 ? 0.1607 0.1666 0.2171 0.0090 -0.0470 0.0118 934 HIS A ND1 +736 C CD2 . HIS A 74 ? 0.2167 0.1662 0.1907 0.0174 -0.0358 0.0103 934 HIS A CD2 +737 C CE1 . HIS A 74 ? 0.1935 0.2061 0.2184 0.0006 -0.0708 0.0115 934 HIS A CE1 +738 N NE2 . HIS A 74 ? 0.2355 0.2288 0.2176 0.0067 -0.0634 -0.0063 934 HIS A NE2 +739 N N . ILE A 75 ? 0.0588 0.0572 0.1451 0.0069 -0.0025 0.0036 935 ILE A N +740 C CA . ILE A 75 ? 0.0636 0.0479 0.1417 0.0062 -0.0040 -0.0026 935 ILE A CA +741 C C . ILE A 75 ? 0.0623 0.0471 0.1340 0.0022 -0.0076 -0.0029 935 ILE A C +742 O O . ILE A 75 ? 0.0623 0.0465 0.1388 0.0019 -0.0059 -0.0011 935 ILE A O +743 C CB . ILE A 75 ? 0.0711 0.0591 0.1418 0.0046 -0.0050 0.0002 935 ILE A CB +744 C CG1 . ILE A 75 ? 0.0755 0.0879 0.1450 0.0000 -0.0002 0.0007 935 ILE A CG1 +745 C CG2 . ILE A 75 ? 0.0768 0.0854 0.1378 -0.0027 -0.0075 -0.0033 935 ILE A CG2 +746 C CD1 . ILE A 75 ? 0.0796 0.1292 0.1519 -0.0041 -0.0166 0.0160 935 ILE A CD1 +747 N N A GLU A 76 ? 0.0730 0.0560 0.1398 0.0027 0.0011 0.0012 936 GLU A N +748 N N B GLU A 76 ? 0.0689 0.0470 0.1410 0.0013 -0.0027 -0.0020 936 GLU A N +749 C CA A GLU A 76 ? 0.0818 0.0654 0.1374 -0.0022 0.0005 -0.0031 936 GLU A CA +750 C CA B GLU A 76 ? 0.0819 0.0552 0.1395 -0.0034 -0.0021 -0.0016 936 GLU A CA +751 C C A GLU A 76 ? 0.0843 0.0430 0.1273 0.0034 -0.0020 0.0086 936 GLU A C +752 C C B GLU A 76 ? 0.0834 0.0443 0.1333 0.0008 -0.0005 0.0047 936 GLU A C +753 O O A GLU A 76 ? 0.0928 0.0439 0.1329 0.0000 0.0092 0.0046 936 GLU A O +754 O O B GLU A 76 ? 0.0909 0.0399 0.1387 0.0007 0.0052 0.0067 936 GLU A O +755 C CB A GLU A 76 ? 0.0896 0.1133 0.1490 -0.0012 -0.0104 -0.0082 936 GLU A CB +756 C CB B GLU A 76 ? 0.0842 0.0552 0.1592 -0.0022 -0.0083 0.0047 936 GLU A CB +757 C CG A GLU A 76 ? 0.1341 0.1179 0.1402 -0.0028 -0.0058 0.0004 936 GLU A CG +758 C CG B GLU A 76 ? 0.1407 0.1211 0.1478 0.0032 -0.0034 0.0043 936 GLU A CG +759 C CD A GLU A 76 ? 0.1376 0.1316 0.1414 -0.0042 -0.0080 -0.0007 936 GLU A CD +760 C CD B GLU A 76 ? 0.1433 0.1323 0.1497 0.0053 -0.0043 0.0081 936 GLU A CD +761 O OE1 A GLU A 76 ? 0.1392 0.1400 0.1415 0.0002 -0.0083 0.0036 936 GLU A OE1 +762 O OE1 B GLU A 76 ? 0.1489 0.1462 0.1534 0.0026 -0.0071 0.0063 936 GLU A OE1 +763 O OE2 A GLU A 76 ? 0.1443 0.1414 0.1487 -0.0095 -0.0087 -0.0062 936 GLU A OE2 +764 O OE2 B GLU A 76 ? 0.1422 0.1308 0.1511 0.0099 -0.0014 0.0127 936 GLU A OE2 +765 N N . ALA A 77 ? 0.0837 0.0503 0.1325 -0.0042 0.0034 0.0033 937 ALA A N +766 C CA . ALA A 77 ? 0.0869 0.0503 0.1334 -0.0056 0.0046 0.0070 937 ALA A CA +767 C C . ALA A 77 ? 0.0892 0.0493 0.1350 -0.0017 0.0065 0.0076 937 ALA A C +768 O O . ALA A 77 ? 0.1101 0.0555 0.1431 -0.0142 0.0185 0.0020 937 ALA A O +769 C CB . ALA A 77 ? 0.0861 0.0878 0.1369 -0.0034 0.0042 0.0061 937 ALA A CB +770 N N A ASN A 78 ? 0.0980 0.0519 0.1317 -0.0056 0.0106 0.0034 938 ASN A N +771 N N B ASN A 78 ? 0.0957 0.0613 0.1377 -0.0027 0.0067 0.0132 938 ASN A N +772 C CA A ASN A 78 ? 0.1045 0.0541 0.1291 -0.0037 0.0142 0.0070 938 ASN A CA +773 C CA B ASN A 78 ? 0.1070 0.0736 0.1442 -0.0042 0.0124 0.0066 938 ASN A CA +774 C C A ASN A 78 ? 0.0996 0.0557 0.1304 0.0043 0.0205 0.0069 938 ASN A C +775 C C B ASN A 78 ? 0.1037 0.0640 0.1432 0.0022 0.0156 0.0076 938 ASN A C +776 O O A ASN A 78 ? 0.1054 0.0559 0.1297 0.0006 0.0276 0.0057 938 ASN A O +777 O O B ASN A 78 ? 0.0982 0.0622 0.1433 0.0052 0.0231 0.0057 938 ASN A O +778 C CB A ASN A 78 ? 0.1033 0.0695 0.1239 -0.0112 0.0127 0.0036 938 ASN A CB +779 C CB B ASN A 78 ? 0.1142 0.1087 0.1515 -0.0019 0.0022 0.0112 938 ASN A CB +780 C CG A ASN A 78 ? 0.1539 0.1459 0.1332 0.0100 0.0058 0.0015 938 ASN A CG +781 C CG B ASN A 78 ? 0.1956 0.1873 0.1800 0.0075 0.0019 0.0033 938 ASN A CG +782 O OD1 A ASN A 78 ? 0.1579 0.1515 0.1365 0.0129 0.0093 0.0048 938 ASN A OD1 +783 O OD1 B ASN A 78 ? 0.2096 0.2086 0.1873 0.0070 0.0011 -0.0024 938 ASN A OD1 +784 N ND2 A ASN A 78 ? 0.1617 0.1618 0.1353 0.0083 0.0031 -0.0050 938 ASN A ND2 +785 N ND2 B ASN A 78 ? 0.1940 0.1847 0.1825 0.0061 -0.0001 0.0044 938 ASN A ND2 +786 N N A PHE A 79 ? 0.1104 0.0622 0.1475 0.0133 0.0228 0.0040 939 PHE A N +787 N N B PHE A 79 ? 0.1113 0.0693 0.1543 0.0093 0.0178 0.0086 939 PHE A N +788 C CA A PHE A 79 ? 0.1084 0.0716 0.1584 0.0156 0.0176 0.0134 939 PHE A CA +789 C CA B PHE A 79 ? 0.1055 0.0775 0.1595 0.0192 0.0182 0.0145 939 PHE A CA +790 C C A PHE A 79 ? 0.1370 0.0814 0.1623 0.0310 0.0248 0.0160 939 PHE A C +791 C C B PHE A 79 ? 0.1288 0.0869 0.1596 0.0345 0.0223 0.0184 939 PHE A C +792 O O A PHE A 79 ? 0.1686 0.0751 0.1532 0.0368 0.0292 0.0221 939 PHE A O +793 O O B PHE A 79 ? 0.1514 0.0783 0.1416 0.0414 0.0211 0.0207 939 PHE A O +794 C CB A PHE A 79 ? 0.1250 0.0881 0.1678 0.0169 0.0034 0.0070 939 PHE A CB +795 C CB B PHE A 79 ? 0.1242 0.0718 0.1622 0.0240 0.0110 0.0150 939 PHE A CB +796 C CG A PHE A 79 ? 0.1592 0.1438 0.1653 0.0106 0.0124 0.0059 939 PHE A CG +797 C CG B PHE A 79 ? 0.1647 0.1544 0.1733 0.0109 0.0141 0.0074 939 PHE A CG +798 C CD1 A PHE A 79 ? 0.1598 0.1377 0.1632 0.0095 0.0099 0.0037 939 PHE A CD1 +799 C CD1 B PHE A 79 ? 0.1662 0.1490 0.1709 0.0125 0.0128 0.0055 939 PHE A CD1 +800 C CD2 A PHE A 79 ? 0.1630 0.1524 0.1698 0.0153 0.0154 0.0077 939 PHE A CD2 +801 C CD2 B PHE A 79 ? 0.1656 0.1663 0.1790 0.0132 0.0166 0.0098 939 PHE A CD2 +802 C CE1 A PHE A 79 ? 0.1665 0.1406 0.1692 0.0123 0.0111 0.0037 939 PHE A CE1 +803 C CE1 B PHE A 79 ? 0.1705 0.1545 0.1759 0.0176 0.0153 0.0075 939 PHE A CE1 +804 C CE2 A PHE A 79 ? 0.1674 0.1526 0.1729 0.0197 0.0169 0.0084 939 PHE A CE2 +805 C CE2 B PHE A 79 ? 0.1680 0.1730 0.1812 0.0190 0.0180 0.0115 939 PHE A CE2 +806 C CZ A PHE A 79 ? 0.1710 0.1477 0.1750 0.0177 0.0151 0.0066 939 PHE A CZ +807 C CZ B PHE A 79 ? 0.1711 0.1664 0.1803 0.0218 0.0180 0.0111 939 PHE A CZ +808 N N . ASN A 80 ? 0.1233 0.1069 0.1848 0.0412 0.0260 0.0239 940 ASN A N +809 C CA . ASN A 80 ? 0.1493 0.1345 0.1961 0.0648 0.0351 0.0263 940 ASN A CA +810 C C . ASN A 80 ? 0.1628 0.1344 0.2050 0.0718 0.0268 0.0227 940 ASN A C +811 O O . ASN A 80 ? 0.1825 0.1545 0.2752 0.0613 -0.0213 0.0286 940 ASN A O +812 C CB . ASN A 80 ? 0.1607 0.1733 0.2259 0.0703 0.0536 0.0517 940 ASN A CB +813 C CG . ASN A 80 ? 0.2038 0.2238 0.2394 0.0880 0.0688 0.0386 940 ASN A CG +814 O OD1 . ASN A 80 ? 0.2207 0.3107 0.2820 0.1328 0.0636 0.0239 940 ASN A OD1 +815 N ND2 . ASN A 80 ? 0.2199 0.2359 0.2498 0.0845 0.0697 0.0232 940 ASN A ND2 +816 N N . ALA A 81 ? 0.1922 0.1510 0.1768 0.0908 0.0362 0.0310 941 ALA A N +817 C CA . ALA A 81 ? 0.1900 0.1341 0.1800 0.0746 0.0238 0.0274 941 ALA A CA +818 C C . ALA A 81 ? 0.1956 0.1424 0.1902 0.0767 0.0302 0.0318 941 ALA A C +819 O O . ALA A 81 ? 0.1993 0.1901 0.1945 0.0954 0.0356 0.0128 941 ALA A O +820 C CB . ALA A 81 ? 0.1743 0.1482 0.1779 0.0719 0.0179 0.0297 941 ALA A CB +821 N N . LYS A 82 ? 0.1844 0.1405 0.2142 0.0427 0.0506 0.0181 942 LYS A N +822 C CA . LYS A 82 ? 0.1680 0.1439 0.2270 0.0255 0.0493 0.0116 942 LYS A CA +823 C C . LYS A 82 ? 0.1193 0.1414 0.2022 0.0159 0.0277 0.0043 942 LYS A C +824 O O . LYS A 82 ? 0.1063 0.1403 0.1973 0.0193 0.0207 0.0056 942 LYS A O +825 C CB . LYS A 82 ? 0.1944 0.1586 0.2702 0.0035 0.0487 -0.0133 942 LYS A CB +826 C CG . LYS A 82 ? 0.1454 0.1683 0.2795 -0.0262 0.0070 -0.0233 942 LYS A CG +827 C CD . LYS A 82 ? 0.3915 0.3789 0.4279 -0.0302 0.0498 -0.0289 942 LYS A CD +828 C CE . LYS A 82 ? 0.3837 0.3872 0.4301 -0.0372 0.0427 -0.0382 942 LYS A CE +829 N NZ . LYS A 82 ? 0.3981 0.4096 0.4531 -0.0521 0.0541 -0.0536 942 LYS A NZ +830 N N A PRO A 83 ? 0.1140 0.1379 0.1907 0.0137 0.0198 0.0012 943 PRO A N +831 N N B PRO A 83 ? 0.1158 0.1427 0.1999 0.0101 0.0247 -0.0030 943 PRO A N +832 C CA A PRO A 83 ? 0.0979 0.1331 0.1828 0.0076 0.0051 -0.0137 943 PRO A CA +833 C CA B PRO A 83 ? 0.1002 0.1403 0.1926 0.0007 0.0062 -0.0148 943 PRO A CA +834 C C A PRO A 83 ? 0.0801 0.1236 0.1782 0.0029 0.0068 -0.0221 943 PRO A C +835 C C B PRO A 83 ? 0.0843 0.1291 0.1892 -0.0055 0.0053 -0.0219 943 PRO A C +836 O O A PRO A 83 ? 0.0881 0.1232 0.1862 -0.0088 0.0110 -0.0225 943 PRO A O +837 O O B PRO A 83 ? 0.0836 0.1323 0.2025 -0.0126 0.0048 -0.0202 943 PRO A O +838 C CB A PRO A 83 ? 0.1194 0.1397 0.1808 0.0165 0.0111 -0.0131 943 PRO A CB +839 C CB B PRO A 83 ? 0.1299 0.1665 0.1973 0.0049 0.0170 -0.0223 943 PRO A CB +840 C CG A PRO A 83 ? 0.1134 0.1640 0.1782 0.0315 0.0164 -0.0048 943 PRO A CG +841 C CG B PRO A 83 ? 0.1348 0.1801 0.2149 0.0027 0.0298 -0.0121 943 PRO A CG +842 C CD A PRO A 83 ? 0.1278 0.1589 0.1924 0.0238 0.0302 -0.0021 943 PRO A CD +843 C CD B PRO A 83 ? 0.1321 0.1765 0.2158 0.0019 0.0380 -0.0008 943 PRO A CD +844 N N . GLY A 84 ? 0.0843 0.1258 0.1798 -0.0022 0.0022 -0.0230 944 GLY A N +845 C CA . GLY A 84 ? 0.0828 0.1250 0.1898 0.0026 -0.0019 -0.0168 944 GLY A CA +846 C C . GLY A 84 ? 0.0766 0.0988 0.1741 0.0049 -0.0064 -0.0272 944 GLY A C +847 O O . GLY A 84 ? 0.0763 0.1208 0.1833 -0.0057 -0.0086 -0.0155 944 GLY A O +848 N N A LYS A 85 ? 0.0766 0.1041 0.1791 0.0091 -0.0101 -0.0213 945 LYS A N +849 N N B LYS A 85 ? 0.0767 0.1077 0.1788 0.0077 -0.0079 -0.0194 945 LYS A N +850 C CA A LYS A 85 ? 0.0766 0.0982 0.1816 0.0061 -0.0132 -0.0184 945 LYS A CA +851 C CA B LYS A 85 ? 0.0758 0.0998 0.1810 0.0072 -0.0099 -0.0165 945 LYS A CA +852 C C A LYS A 85 ? 0.0687 0.0944 0.1699 0.0033 -0.0155 -0.0129 945 LYS A C +853 C C B LYS A 85 ? 0.0688 0.0985 0.1653 0.0066 -0.0134 -0.0109 945 LYS A C +854 O O A LYS A 85 ? 0.0640 0.1091 0.1678 0.0005 -0.0149 -0.0170 945 LYS A O +855 O O B LYS A 85 ? 0.0738 0.1041 0.1645 0.0049 -0.0101 -0.0206 945 LYS A O +856 C CB A LYS A 85 ? 0.1018 0.1116 0.2035 0.0252 -0.0198 -0.0150 945 LYS A CB +857 C CB B LYS A 85 ? 0.1010 0.1106 0.1982 0.0219 -0.0098 -0.0080 945 LYS A CB +858 C CG A LYS A 85 ? 0.1181 0.1285 0.2094 0.0261 -0.0133 -0.0042 945 LYS A CG +859 C CG B LYS A 85 ? 0.1258 0.1151 0.2076 0.0206 0.0019 0.0003 945 LYS A CG +860 C CD A LYS A 85 ? 0.1570 0.1494 0.2334 0.0560 -0.0101 0.0051 945 LYS A CD +861 C CD B LYS A 85 ? 0.1292 0.1412 0.2215 0.0408 0.0132 0.0132 945 LYS A CD +862 C CE A LYS A 85 ? 0.2761 0.2688 0.3230 0.0423 0.0132 0.0150 945 LYS A CE +863 C CE B LYS A 85 ? 0.2006 0.1920 0.2463 0.0398 0.0121 0.0149 945 LYS A CE +864 N NZ A LYS A 85 ? 0.2875 0.2554 0.3373 0.0344 0.0236 0.0109 945 LYS A NZ +865 N NZ B LYS A 85 ? 0.2194 0.2121 0.2588 0.0588 0.0185 0.0265 945 LYS A NZ +866 N N . TYR A 86 ? 0.0713 0.0894 0.1667 0.0035 -0.0084 -0.0178 946 TYR A N +867 C CA . TYR A 86 ? 0.0700 0.0878 0.1600 0.0027 -0.0056 -0.0128 946 TYR A CA +868 C C . TYR A 86 ? 0.0695 0.0835 0.1600 0.0000 -0.0138 -0.0065 946 TYR A C +869 O O . TYR A 86 ? 0.0917 0.0868 0.1675 -0.0064 -0.0031 -0.0089 946 TYR A O +870 C CB . TYR A 86 ? 0.0787 0.1063 0.1630 0.0095 -0.0059 -0.0067 946 TYR A CB +871 C CG . TYR A 86 ? 0.0766 0.1029 0.1621 0.0135 -0.0098 -0.0041 946 TYR A CG +872 C CD1 . TYR A 86 ? 0.0851 0.1127 0.1639 0.0048 -0.0058 -0.0098 946 TYR A CD1 +873 C CD2 . TYR A 86 ? 0.0828 0.1048 0.1654 0.0175 -0.0041 -0.0069 946 TYR A CD2 +874 C CE1 . TYR A 86 ? 0.0963 0.1186 0.1616 0.0072 -0.0040 -0.0063 946 TYR A CE1 +875 C CE2 . TYR A 86 ? 0.0899 0.0983 0.1796 0.0154 -0.0044 -0.0021 946 TYR A CE2 +876 C CZ . TYR A 86 ? 0.0934 0.1110 0.1737 0.0159 0.0015 0.0075 946 TYR A CZ +877 O OH . TYR A 86 ? 0.1196 0.1165 0.1878 0.0100 0.0128 0.0143 946 TYR A OH +878 N N A TYR A 87 ? 0.0644 0.0837 0.1569 0.0003 -0.0119 -0.0050 947 TYR A N +879 N N B TYR A 87 ? 0.0618 0.0835 0.1558 -0.0004 -0.0121 -0.0046 947 TYR A N +880 C CA A TYR A 87 ? 0.0713 0.0784 0.1582 0.0056 -0.0112 0.0034 947 TYR A CA +881 C CA B TYR A 87 ? 0.0678 0.0781 0.1559 0.0054 -0.0126 0.0039 947 TYR A CA +882 C C A TYR A 87 ? 0.0675 0.0717 0.1440 0.0005 -0.0112 0.0005 947 TYR A C +883 C C B TYR A 87 ? 0.0662 0.0724 0.1436 0.0020 -0.0141 0.0006 947 TYR A C +884 O O A TYR A 87 ? 0.0681 0.0719 0.1475 0.0007 -0.0075 0.0018 947 TYR A O +885 O O B TYR A 87 ? 0.0669 0.0752 0.1527 -0.0005 -0.0137 -0.0036 947 TYR A O +886 C CB A TYR A 87 ? 0.0826 0.1085 0.1666 0.0155 -0.0204 0.0019 947 TYR A CB +887 C CB B TYR A 87 ? 0.0798 0.1027 0.1608 0.0089 -0.0204 0.0029 947 TYR A CB +888 C CG A TYR A 87 ? 0.0978 0.1287 0.1910 0.0342 -0.0264 0.0025 947 TYR A CG +889 C CG B TYR A 87 ? 0.0880 0.1213 0.1782 0.0224 -0.0162 0.0107 947 TYR A CG +890 C CD1 A TYR A 87 ? 0.1317 0.1276 0.2119 0.0352 -0.0314 0.0140 947 TYR A CD1 +891 C CD1 B TYR A 87 ? 0.0879 0.1303 0.1834 0.0205 -0.0156 0.0138 947 TYR A CD1 +892 C CD2 A TYR A 87 ? 0.0945 0.1755 0.2032 0.0371 -0.0297 0.0078 947 TYR A CD2 +893 C CD2 B TYR A 87 ? 0.1088 0.1384 0.1944 0.0252 -0.0179 0.0318 947 TYR A CD2 +894 C CE1 A TYR A 87 ? 0.1610 0.1449 0.2457 0.0562 -0.0294 0.0130 947 TYR A CE1 +895 C CE1 B TYR A 87 ? 0.0863 0.1470 0.2063 0.0266 -0.0069 0.0227 947 TYR A CE1 +896 C CE2 A TYR A 87 ? 0.1218 0.1888 0.2397 0.0564 -0.0303 0.0115 947 TYR A CE2 +897 C CE2 B TYR A 87 ? 0.1131 0.1503 0.2156 0.0323 -0.0106 0.0430 947 TYR A CE2 +898 C CZ A TYR A 87 ? 0.1567 0.1750 0.2565 0.0696 -0.0194 0.0038 947 TYR A CZ +899 C CZ B TYR A 87 ? 0.1015 0.1458 0.2255 0.0335 -0.0135 0.0294 947 TYR A CZ +900 O OH A TYR A 87 ? 0.1822 0.2001 0.3066 0.0937 -0.0152 -0.0019 947 TYR A OH +901 O OH B TYR A 87 ? 0.1152 0.1564 0.2630 0.0452 -0.0102 0.0308 947 TYR A OH +902 N N . LEU A 88 ? 0.0671 0.0632 0.1505 0.0020 -0.0132 0.0040 948 LEU A N +903 C CA . LEU A 88 ? 0.0639 0.0635 0.1499 0.0009 -0.0144 0.0074 948 LEU A CA +904 C C . LEU A 88 ? 0.0647 0.0616 0.1482 0.0020 -0.0166 0.0084 948 LEU A C +905 O O . LEU A 88 ? 0.1011 0.0626 0.1616 -0.0037 0.0021 0.0065 948 LEU A O +906 C CB . LEU A 88 ? 0.0681 0.0623 0.1551 -0.0058 -0.0167 0.0076 948 LEU A CB +907 C CG . LEU A 88 ? 0.0698 0.0860 0.1651 0.0000 -0.0204 0.0096 948 LEU A CG +908 C CD1 . LEU A 88 ? 0.0756 0.0841 0.1590 0.0079 -0.0191 0.0069 948 LEU A CD1 +909 C CD2 . LEU A 88 ? 0.0833 0.0966 0.1905 -0.0084 -0.0328 0.0054 948 LEU A CD2 +910 N N . TYR A 89 ? 0.0642 0.0594 0.1448 0.0062 -0.0119 0.0124 949 TYR A N +911 C CA . TYR A 89 ? 0.0722 0.0640 0.1461 0.0086 -0.0075 0.0121 949 TYR A CA +912 C C . TYR A 89 ? 0.0696 0.0625 0.1422 0.0041 -0.0058 0.0128 949 TYR A C +913 O O . TYR A 89 ? 0.0721 0.0644 0.1678 0.0051 -0.0052 0.0198 949 TYR A O +914 C CB . TYR A 89 ? 0.0791 0.0822 0.1483 0.0055 -0.0160 0.0108 949 TYR A CB +915 C CG . TYR A 89 ? 0.0763 0.0983 0.1524 0.0047 -0.0198 0.0019 949 TYR A CG +916 C CD1 . TYR A 89 ? 0.0809 0.1188 0.1674 -0.0052 -0.0117 -0.0048 949 TYR A CD1 +917 C CD2 . TYR A 89 ? 0.0999 0.1434 0.1675 0.0215 -0.0241 0.0243 949 TYR A CD2 +918 C CE1 . TYR A 89 ? 0.0750 0.1500 0.1983 -0.0030 -0.0129 -0.0138 949 TYR A CE1 +919 C CE2 . TYR A 89 ? 0.1094 0.1707 0.1996 0.0359 -0.0277 0.0234 949 TYR A CE2 +920 C CZ . TYR A 89 ? 0.0841 0.1786 0.2107 0.0247 -0.0266 -0.0074 949 TYR A CZ +921 O OH . TYR A 89 ? 0.1010 0.2407 0.2726 0.0573 -0.0297 -0.0043 949 TYR A OH +922 N N . VAL A 90 ? 0.0673 0.0595 0.1515 0.0072 -0.0049 0.0165 950 VAL A N +923 C CA . VAL A 90 ? 0.0655 0.0588 0.1468 0.0070 -0.0074 0.0179 950 VAL A CA +924 C C . VAL A 90 ? 0.0724 0.0642 0.1471 0.0056 -0.0058 0.0171 950 VAL A C +925 O O . VAL A 90 ? 0.1000 0.0664 0.1549 0.0122 0.0043 0.0207 950 VAL A O +926 C CB . VAL A 90 ? 0.0759 0.0622 0.1564 -0.0007 -0.0069 0.0133 950 VAL A CB +927 C CG1 . VAL A 90 ? 0.0726 0.0848 0.1596 -0.0015 -0.0084 0.0062 950 VAL A CG1 +928 C CG2 . VAL A 90 ? 0.0849 0.0829 0.1552 0.0065 -0.0099 0.0073 950 VAL A CG2 +929 N N . TYR A 91 ? 0.0718 0.0675 0.1452 0.0047 -0.0025 0.0164 951 TYR A N +930 C CA . TYR A 91 ? 0.0855 0.0724 0.1439 0.0039 -0.0126 0.0176 951 TYR A CA +931 C C . TYR A 91 ? 0.0859 0.0618 0.1407 -0.0063 -0.0121 0.0097 951 TYR A C +932 O O . TYR A 91 ? 0.0896 0.0654 0.1463 0.0084 -0.0044 0.0089 951 TYR A O +933 C CB . TYR A 91 ? 0.0834 0.0986 0.1573 0.0046 -0.0158 0.0228 951 TYR A CB +934 C CG . TYR A 91 ? 0.0790 0.1068 0.1728 -0.0052 -0.0238 0.0182 951 TYR A CG +935 C CD1 . TYR A 91 ? 0.1012 0.1167 0.1828 -0.0114 -0.0112 0.0177 951 TYR A CD1 +936 C CD2 . TYR A 91 ? 0.1064 0.1295 0.1811 -0.0147 -0.0222 0.0019 951 TYR A CD2 +937 C CE1 . TYR A 91 ? 0.1343 0.1376 0.2284 -0.0385 -0.0006 0.0297 951 TYR A CE1 +938 C CE2 . TYR A 91 ? 0.1363 0.1241 0.2239 -0.0205 -0.0306 -0.0077 951 TYR A CE2 +939 C CZ . TYR A 91 ? 0.1323 0.1294 0.2517 -0.0392 -0.0185 0.0213 951 TYR A CZ +940 O OH . TYR A 91 ? 0.1921 0.1436 0.3367 -0.0642 -0.0121 0.0357 951 TYR A OH +941 N N . LYS A 92 ? 0.1033 0.0698 0.1407 0.0016 -0.0066 0.0120 952 LYS A N +942 C CA . LYS A 92 ? 0.1107 0.0717 0.1392 0.0024 -0.0070 0.0050 952 LYS A CA +943 C C . LYS A 92 ? 0.1247 0.0752 0.1456 0.0056 -0.0181 0.0045 952 LYS A C +944 O O . LYS A 92 ? 0.1343 0.1122 0.1676 0.0178 -0.0331 0.0004 952 LYS A O +945 C CB . LYS A 92 ? 0.1145 0.0878 0.1417 0.0012 -0.0001 0.0024 952 LYS A CB +946 C CG . LYS A 92 ? 0.1271 0.0979 0.1521 0.0006 -0.0017 0.0129 952 LYS A CG +947 C CD . LYS A 92 ? 0.1327 0.0859 0.1553 -0.0011 0.0032 0.0123 952 LYS A CD +948 C CE . LYS A 92 ? 0.1371 0.1133 0.1576 -0.0040 -0.0038 0.0241 952 LYS A CE +949 N NZ . LYS A 92 ? 0.1541 0.1038 0.1633 -0.0123 0.0102 0.0263 952 LYS A NZ +950 N N . TYR A 93 ? 0.1567 0.1049 0.1703 0.0084 -0.0502 -0.0140 953 TYR A N +951 C CA . TYR A 93 ? 0.1689 0.1181 0.1922 0.0002 -0.0576 -0.0232 953 TYR A CA +952 C C . TYR A 93 ? 0.2010 0.1260 0.1837 0.0018 -0.0497 -0.0273 953 TYR A C +953 O O . TYR A 93 ? 0.2636 0.1893 0.2146 -0.0363 -0.0429 -0.0673 953 TYR A O +954 C CB . TYR A 93 ? 0.1582 0.1358 0.2008 -0.0072 -0.0448 -0.0253 953 TYR A CB +955 C CG . TYR A 93 ? 0.1370 0.1003 0.1963 -0.0157 -0.0250 -0.0209 953 TYR A CG +956 C CD1 . TYR A 93 ? 0.1520 0.0958 0.1812 -0.0118 -0.0211 -0.0172 953 TYR A CD1 +957 C CD2 . TYR A 93 ? 0.1230 0.1030 0.2002 -0.0174 -0.0069 -0.0207 953 TYR A CD2 +958 C CE1 . TYR A 93 ? 0.1528 0.0860 0.1838 -0.0147 -0.0157 -0.0089 953 TYR A CE1 +959 C CE2 . TYR A 93 ? 0.1314 0.0984 0.1871 -0.0247 -0.0021 -0.0158 953 TYR A CE2 +960 C CZ . TYR A 93 ? 0.1404 0.0797 0.1826 -0.0211 -0.0071 -0.0039 953 TYR A CZ +961 O OH . TYR A 93 ? 0.1728 0.0963 0.1902 -0.0128 -0.0144 0.0075 953 TYR A OH +962 N N . ASP A 94 ? 0.2048 0.1368 0.1888 -0.0044 -0.0459 -0.0288 954 ASP A N +963 C CA . ASP A 94 ? 0.2316 0.1696 0.1903 -0.0069 -0.0285 -0.0223 954 ASP A CA +964 C C . ASP A 94 ? 0.2408 0.1801 0.2037 -0.0130 -0.0416 -0.0044 954 ASP A C +965 O O . ASP A 94 ? 0.2722 0.1727 0.2858 -0.0155 -0.0235 -0.0033 954 ASP A O +966 C CB . ASP A 94 ? 0.2487 0.1649 0.2061 0.0016 -0.0192 -0.0170 954 ASP A CB +967 C CG . ASP A 94 ? 0.2284 0.1628 0.1967 0.0199 -0.0086 -0.0184 954 ASP A CG +968 O OD1 . ASP A 94 ? 0.2117 0.1622 0.1961 0.0066 -0.0230 -0.0116 954 ASP A OD1 +969 O OD2 . ASP A 94 ? 0.2617 0.1943 0.2199 0.0463 -0.0118 -0.0092 954 ASP A OD2 +970 N N . ASN A 95 ? 0.2816 0.2482 0.2052 -0.0330 -0.0189 -0.0099 955 ASN A N +971 C CA . ASN A 95 ? 0.2977 0.2677 0.2252 -0.0377 -0.0308 0.0176 955 ASN A CA +972 C C . ASN A 95 ? 0.2587 0.2596 0.2275 -0.0237 -0.0153 0.0257 955 ASN A C +973 O O . ASN A 95 ? 0.2758 0.2737 0.2662 -0.0406 -0.0080 0.0308 955 ASN A O +974 C CB . ASN A 95 ? 0.3440 0.3383 0.2274 -0.0733 -0.0239 -0.0044 955 ASN A CB +975 C CG . ASN A 95 ? 0.6225 0.6005 0.5420 0.0182 -0.0118 -0.0098 955 ASN A CG +976 O OD1 . ASN A 95 ? 0.6260 0.6132 0.5469 0.0200 -0.0185 -0.0069 955 ASN A OD1 +977 N ND2 . ASN A 95 ? 0.6456 0.6190 0.5524 0.0156 -0.0103 -0.0166 955 ASN A ND2 +978 N N . GLY A 96 ? 0.2321 0.1830 0.2125 -0.0286 -0.0170 -0.0213 956 GLY A N +979 C CA . GLY A 96 ? 0.1919 0.1611 0.2120 -0.0015 -0.0014 -0.0335 956 GLY A CA +980 C C . GLY A 96 ? 0.1521 0.1449 0.1821 0.0060 -0.0054 0.0000 956 GLY A C +981 O O . GLY A 96 ? 0.1548 0.1465 0.2332 0.0051 0.0178 -0.0046 956 GLY A O +982 N N . ASP A 97 ? 0.1407 0.1288 0.1779 0.0194 0.0078 -0.0122 957 ASP A N +983 C CA . ASP A 97 ? 0.1339 0.1156 0.1614 0.0204 0.0046 0.0066 957 ASP A CA +984 C C . ASP A 97 ? 0.1231 0.1014 0.1602 0.0179 0.0063 0.0061 957 ASP A C +985 O O . ASP A 97 ? 0.1247 0.1492 0.1739 0.0320 0.0097 0.0083 957 ASP A O +986 C CB . ASP A 97 ? 0.1675 0.1390 0.1833 0.0138 0.0200 0.0237 957 ASP A CB +987 C CG . ASP A 97 ? 0.2174 0.1991 0.1851 0.0242 0.0111 0.0261 957 ASP A CG +988 O OD1 . ASP A 97 ? 0.2205 0.1713 0.1940 0.0521 -0.0124 0.0120 957 ASP A OD1 +989 O OD2 . ASP A 97 ? 0.2660 0.3052 0.2429 -0.0023 0.0392 0.0660 957 ASP A OD2 +990 N N . GLY A 98 ? 0.1308 0.0913 0.1532 0.0195 0.0063 0.0119 958 GLY A N +991 C CA . GLY A 98 ? 0.1394 0.1056 0.1538 0.0292 0.0066 0.0036 958 GLY A CA +992 C C . GLY A 98 ? 0.0975 0.0781 0.1591 0.0120 0.0041 0.0109 958 GLY A C +993 O O . GLY A 98 ? 0.1112 0.1156 0.1723 0.0324 -0.0186 -0.0148 958 GLY A O +994 N N . THR A 99 ? 0.1116 0.1134 0.1579 0.0336 -0.0036 0.0117 959 THR A N +995 C CA . THR A 99 ? 0.0909 0.0894 0.1590 0.0105 -0.0017 0.0146 959 THR A CA +996 C C . THR A 99 ? 0.0730 0.0733 0.1464 0.0073 -0.0074 -0.0002 959 THR A C +997 O O . THR A 99 ? 0.0890 0.0764 0.1544 0.0144 -0.0066 -0.0061 959 THR A O +998 C CB . THR A 99 ? 0.1066 0.1114 0.1907 -0.0119 -0.0030 0.0199 959 THR A CB +999 O OG1 . THR A 99 ? 0.0932 0.1527 0.2192 -0.0053 -0.0140 0.0133 959 THR A OG1 +1000 C CG2 . THR A 99 ? 0.1432 0.1416 0.2196 -0.0301 0.0054 0.0416 959 THR A CG2 +1001 N N . TYR A 100 ? 0.0755 0.0607 0.1402 0.0017 -0.0077 -0.0003 960 TYR A N +1002 C CA . TYR A 100 ? 0.0738 0.0588 0.1385 0.0047 -0.0072 -0.0021 960 TYR A CA +1003 C C . TYR A 100 ? 0.0700 0.0606 0.1428 -0.0022 -0.0039 -0.0073 960 TYR A C +1004 O O . TYR A 100 ? 0.0993 0.0607 0.1508 0.0007 -0.0057 -0.0074 960 TYR A O +1005 C CB . TYR A 100 ? 0.0823 0.0608 0.1424 -0.0019 -0.0090 -0.0011 960 TYR A CB +1006 C CG . TYR A 100 ? 0.0741 0.0670 0.1423 -0.0073 -0.0129 -0.0032 960 TYR A CG +1007 C CD1 . TYR A 100 ? 0.0722 0.0830 0.1427 -0.0047 -0.0110 -0.0006 960 TYR A CD1 +1008 C CD2 . TYR A 100 ? 0.0754 0.0786 0.1400 -0.0051 -0.0057 -0.0017 960 TYR A CD2 +1009 C CE1 . TYR A 100 ? 0.0694 0.1069 0.1525 0.0030 -0.0055 -0.0037 960 TYR A CE1 +1010 C CE2 . TYR A 100 ? 0.0798 0.0943 0.1496 -0.0001 -0.0151 0.0066 960 TYR A CE2 +1011 C CZ . TYR A 100 ? 0.0752 0.1062 0.1630 0.0101 -0.0116 0.0057 960 TYR A CZ +1012 O OH . TYR A 100 ? 0.0879 0.1439 0.1841 0.0347 -0.0092 0.0037 960 TYR A OH +1013 N N A GLU A 101 ? 0.0717 0.0640 0.1423 -0.0049 -0.0043 -0.0077 961 GLU A N +1014 N N B GLU A 101 ? 0.0716 0.0632 0.1399 -0.0039 -0.0055 -0.0091 961 GLU A N +1015 C CA A GLU A 101 ? 0.0721 0.0697 0.1511 -0.0103 0.0006 -0.0150 961 GLU A CA +1016 C CA B GLU A 101 ? 0.0727 0.0687 0.1452 -0.0089 -0.0016 -0.0141 961 GLU A CA +1017 C C A GLU A 101 ? 0.0716 0.0584 0.1500 -0.0080 -0.0024 -0.0123 961 GLU A C +1018 C C B GLU A 101 ? 0.0714 0.0589 0.1436 -0.0073 -0.0056 -0.0119 961 GLU A C +1019 O O A GLU A 101 ? 0.0797 0.0617 0.1766 -0.0016 0.0096 -0.0031 961 GLU A O +1020 O O B GLU A 101 ? 0.0816 0.0635 0.1628 -0.0013 0.0024 -0.0019 961 GLU A O +1021 C CB A GLU A 101 ? 0.0786 0.1124 0.1627 -0.0230 -0.0074 -0.0216 961 GLU A CB +1022 C CB B GLU A 101 ? 0.0785 0.1095 0.1526 -0.0212 -0.0085 -0.0195 961 GLU A CB +1023 C CG A GLU A 101 ? 0.0916 0.1295 0.1694 -0.0290 -0.0143 -0.0374 961 GLU A CG +1024 C CG B GLU A 101 ? 0.1016 0.1323 0.1556 -0.0296 -0.0151 -0.0338 961 GLU A CG +1025 C CD A GLU A 101 ? 0.2165 0.2418 0.2473 -0.0269 -0.0089 -0.0295 961 GLU A CD +1026 C CD B GLU A 101 ? 0.2098 0.2372 0.2359 -0.0205 -0.0140 -0.0265 961 GLU A CD +1027 O OE1 A GLU A 101 ? 0.2274 0.2493 0.2569 -0.0359 -0.0041 -0.0358 961 GLU A OE1 +1028 O OE1 B GLU A 101 ? 0.2229 0.2498 0.2391 -0.0161 -0.0183 -0.0253 961 GLU A OE1 +1029 O OE2 A GLU A 101 ? 0.2219 0.2647 0.2554 -0.0226 -0.0154 -0.0305 961 GLU A OE2 +1030 O OE2 B GLU A 101 ? 0.2076 0.2504 0.2418 -0.0255 -0.0140 -0.0322 961 GLU A OE2 +1031 N N . LEU A 102 ? 0.0716 0.0579 0.1467 -0.0083 0.0027 -0.0062 962 LEU A N +1032 C CA . LEU A 102 ? 0.0711 0.0512 0.1414 -0.0101 -0.0011 -0.0077 962 LEU A CA +1033 C C . LEU A 102 ? 0.0794 0.0517 0.1411 -0.0085 0.0020 -0.0101 962 LEU A C +1034 O O . LEU A 102 ? 0.1049 0.0544 0.1466 -0.0151 0.0039 -0.0122 962 LEU A O +1035 C CB . LEU A 102 ? 0.0745 0.0578 0.1497 -0.0067 -0.0041 -0.0042 962 LEU A CB +1036 C CG . LEU A 102 ? 0.0741 0.0686 0.1561 -0.0008 -0.0024 -0.0031 962 LEU A CG +1037 C CD1 . LEU A 102 ? 0.0714 0.0692 0.1567 0.0003 -0.0057 0.0008 962 LEU A CD1 +1038 C CD2 . LEU A 102 ? 0.0825 0.0729 0.1773 0.0025 -0.0069 0.0043 962 LEU A CD2 +1039 N N A SER A 103 ? 0.0837 0.0515 0.1424 -0.0113 0.0033 -0.0102 963 SER A N +1040 N N B SER A 103 ? 0.0859 0.0552 0.1319 -0.0100 0.0034 -0.0130 963 SER A N +1041 N N C SER A 103 ? 0.0897 0.0581 0.1296 -0.0100 0.0021 -0.0112 963 SER A N +1042 C CA A SER A 103 ? 0.1118 0.0692 0.1436 -0.0215 0.0026 -0.0164 963 SER A CA +1043 C CA B SER A 103 ? 0.1009 0.0683 0.1323 -0.0158 0.0046 -0.0171 963 SER A CA +1044 C CA C SER A 103 ? 0.1068 0.0697 0.1298 -0.0168 0.0030 -0.0152 963 SER A CA +1045 C C A SER A 103 ? 0.1159 0.0580 0.1431 -0.0173 0.0123 -0.0146 963 SER A C +1046 C C B SER A 103 ? 0.1050 0.0584 0.1306 -0.0143 0.0101 -0.0171 963 SER A C +1047 C C C SER A 103 ? 0.1086 0.0615 0.1282 -0.0147 0.0090 -0.0146 963 SER A C +1048 O O A SER A 103 ? 0.1099 0.0529 0.1374 -0.0125 0.0129 -0.0105 963 SER A O +1049 O O B SER A 103 ? 0.1141 0.0579 0.1263 -0.0159 0.0101 -0.0144 963 SER A O +1050 O O C SER A 103 ? 0.1008 0.0569 0.1242 -0.0117 0.0099 -0.0108 963 SER A O +1051 C CB A SER A 103 ? 0.1302 0.1013 0.1518 -0.0219 -0.0139 -0.0112 963 SER A CB +1052 C CB B SER A 103 ? 0.1150 0.0999 0.1351 -0.0163 -0.0065 -0.0161 963 SER A CB +1053 C CB C SER A 103 ? 0.1229 0.0873 0.1271 -0.0127 -0.0052 -0.0129 963 SER A CB +1054 O OG A SER A 103 ? 0.1306 0.1473 0.1633 -0.0348 -0.0242 -0.0068 963 SER A OG +1055 O OG B SER A 103 ? 0.1342 0.1047 0.1515 -0.0014 -0.0082 -0.0048 963 SER A OG +1056 O OG C SER A 103 ? 0.1489 0.1128 0.1285 -0.0179 -0.0001 -0.0153 963 SER A OG +1057 N N A VAL A 104 ? 0.1315 0.0575 0.1460 -0.0146 0.0153 -0.0169 964 VAL A N +1058 N N B VAL A 104 ? 0.1068 0.0597 0.1309 -0.0145 0.0139 -0.0172 964 VAL A N +1059 C CA A VAL A 104 ? 0.1464 0.0652 0.1531 -0.0282 0.0247 -0.0210 964 VAL A CA +1060 C CA B VAL A 104 ? 0.1075 0.0683 0.1341 -0.0166 0.0156 -0.0195 964 VAL A CA +1061 C C A VAL A 104 ? 0.1852 0.0748 0.1583 -0.0436 0.0233 -0.0330 964 VAL A C +1062 C C B VAL A 104 ? 0.1246 0.0637 0.1367 -0.0263 0.0164 -0.0235 964 VAL A C +1063 O O A VAL A 104 ? 0.2068 0.0761 0.1602 -0.0479 0.0304 -0.0364 964 VAL A O +1064 O O B VAL A 104 ? 0.1177 0.0630 0.1419 -0.0255 0.0191 -0.0245 964 VAL A O +1065 C CB A VAL A 104 ? 0.1455 0.0836 0.1615 -0.0153 0.0295 -0.0259 964 VAL A CB +1066 C CB B VAL A 104 ? 0.1027 0.0829 0.1346 -0.0098 0.0170 -0.0251 964 VAL A CB +1067 C CG1 A VAL A 104 ? 0.1484 0.1121 0.1730 -0.0212 0.0375 -0.0303 964 VAL A CG1 +1068 C CG1 B VAL A 104 ? 0.1046 0.1053 0.1464 -0.0065 0.0270 -0.0256 964 VAL A CG1 +1069 C CG2 A VAL A 104 ? 0.1269 0.0944 0.1614 -0.0052 0.0251 -0.0263 964 VAL A CG2 +1070 C CG2 B VAL A 104 ? 0.0934 0.0822 0.1313 -0.0054 0.0089 -0.0204 964 VAL A CG2 +1071 N N A LYS A 105 ? 0.2292 0.0799 0.1732 -0.0580 0.0141 -0.0249 965 LYS A N +1072 N N B LYS A 105 ? 0.1481 0.0748 0.1448 -0.0295 0.0171 -0.0145 965 LYS A N +1073 C CA A LYS A 105 ? 0.2897 0.1142 0.1766 -0.0605 0.0108 -0.0359 965 LYS A CA +1074 C CA B LYS A 105 ? 0.1889 0.1023 0.1524 -0.0332 0.0229 -0.0270 965 LYS A CA +1075 C C A LYS A 105 ? 0.3150 0.1260 0.1819 -0.0606 0.0325 -0.0445 965 LYS A C +1076 C C B LYS A 105 ? 0.2149 0.1254 0.1722 -0.0467 0.0368 -0.0223 965 LYS A C +1077 O O A LYS A 105 ? 0.3373 0.1655 0.1797 -0.0739 0.0467 -0.0512 965 LYS A O +1078 O O B LYS A 105 ? 0.2287 0.1262 0.2243 -0.0464 0.0606 -0.0259 965 LYS A O +1079 C CB A LYS A 105 ? 0.3040 0.1471 0.2194 -0.0441 0.0015 -0.0249 965 LYS A CB +1080 C CB B LYS A 105 ? 0.2048 0.1432 0.1640 -0.0423 0.0048 -0.0187 965 LYS A CB +1081 C CG A LYS A 105 ? 0.3475 0.2873 0.2856 -0.0213 0.0103 -0.0167 965 LYS A CG +1082 C CG B LYS A 105 ? 0.4473 0.3775 0.3827 -0.0253 0.0195 -0.0172 965 LYS A CG +1083 C CD A LYS A 105 ? 0.3344 0.2853 0.2890 -0.0241 0.0090 -0.0218 965 LYS A CD +1084 C CD B LYS A 105 ? 0.4583 0.3930 0.3795 -0.0224 0.0113 -0.0183 965 LYS A CD +1085 C CE A LYS A 105 ? 0.3446 0.2978 0.2908 -0.0288 0.0093 -0.0288 965 LYS A CE +1086 C CE B LYS A 105 ? 0.4710 0.4013 0.3767 -0.0143 0.0051 -0.0117 965 LYS A CE +1087 N NZ A LYS A 105 ? 0.3374 0.2990 0.2969 -0.0327 0.0085 -0.0340 965 LYS A NZ +1088 N NZ B LYS A 105 ? 0.4573 0.3922 0.3767 -0.0101 0.0011 -0.0081 965 LYS A NZ +1089 O OXT A LYS A 105 ? 0.3487 0.1117 0.1582 -0.0673 0.0627 -0.0555 965 LYS A OXT +1090 O OXT B LYS A 105 ? 0.2409 0.1241 0.1760 -0.0495 0.0275 -0.0053 965 LYS A OXT +1091 NA NA . NA B . ? 0.1011 0.1357 0.2085 0.0226 0.0022 0.0207 1001 NA A NA +1092 NA NA . NA C . ? 0.1660 0.2036 0.3000 0.0050 -0.0455 0.0513 1002 NA A NA +1093 NA NA . NA D . ? 0.1319 0.1034 0.2241 0.0095 0.0013 0.0513 1003 NA A NA +1096 O O . HOH E . ? 0.3188 0.3110 0.2788 0.1683 0.0256 0.0070 1103 HOH A O +1097 O O B HOH E . ? 0.2031 0.2836 0.2029 0.0679 0.0193 -0.0478 1104 HOH A O +1098 O O . HOH E . ? 0.1801 0.2990 0.4231 0.0843 -0.0384 -0.0248 1105 HOH A O +1099 O O . HOH E . ? 0.1657 0.2273 0.3057 0.0005 -0.0017 0.0496 1106 HOH A O +1100 O O . HOH E . ? 0.4195 0.1770 0.3691 -0.0094 0.0416 0.0031 1107 HOH A O +1102 O O A HOH E . ? 0.1277 0.1369 0.1621 0.0378 -0.0267 0.0131 1109 HOH A O +1106 O O . HOH E . ? 0.3344 1.0473 0.6325 -0.1923 -0.1175 -0.2248 1112 HOH A O +1107 O O . HOH E . ? 0.1609 0.1302 0.3046 0.0614 0.0678 0.0887 1113 HOH A O +1108 O O A HOH E . ? 0.4877 0.3748 0.4410 -0.0325 0.1163 0.0987 1114 HOH A O +1109 O O B HOH E . ? 0.2722 0.3641 0.1968 0.0383 -0.0009 0.1252 1114 HOH A O +1110 O O A HOH E . ? 0.4084 0.2489 0.2455 -0.0222 -0.0430 0.0366 1115 HOH A O +1111 O O B HOH E . ? 0.3466 0.3363 0.3242 0.0184 -0.0704 0.0259 1115 HOH A O +1116 O O A HOH E . ? 0.1710 0.4212 0.2499 0.0734 0.0233 -0.0283 1120 HOH A O +1117 O O B HOH E . ? 0.2343 0.3693 0.2971 0.0649 0.0274 0.0200 1120 HOH A O +1119 O O . HOH E . ? 0.0813 0.0919 0.2055 -0.0025 -0.0250 -0.0120 1122 HOH A O +1123 O O . HOH E . ? 0.6266 0.5468 0.9621 -0.1628 0.0317 -0.1743 1126 HOH A O +1124 O O . HOH E . ? 0.2328 0.3646 0.2520 -0.1012 -0.0523 0.0506 1127 HOH A O +1125 O O . HOH E . ? 0.2084 0.2098 0.3040 0.0619 0.0008 0.1076 1128 HOH A O +1126 O O . HOH E . ? 0.4486 0.3185 0.2291 0.0275 -0.0760 -0.0378 1129 HOH A O +1130 O O . HOH E . ? 0.2911 0.3828 0.3767 0.1077 0.0676 0.0711 1132 HOH A O +1131 O O . HOH E . ? 0.1883 0.3322 0.2672 -0.0941 -0.0406 0.0235 1133 HOH A O +1132 O O . HOH E . ? 0.2821 0.2870 0.3687 -0.1122 -0.0192 0.0134 1134 HOH A O +1135 O O A HOH E . ? 0.1881 0.3832 0.2363 -0.0540 0.0463 -0.0491 1137 HOH A O +1138 O O . HOH E . ? 0.2238 0.1347 0.3685 0.0351 -0.1169 -0.0043 1140 HOH A O +1139 O O A HOH E . ? 0.1827 0.1691 0.3355 -0.0068 -0.0263 0.0412 1141 HOH A O +1142 O O . HOH E . ? 0.0743 0.0786 0.1554 0.0096 -0.0194 0.0004 1143 HOH A O +1143 O O . HOH E . ? 0.5353 0.2351 0.3141 0.0373 -0.1278 -0.0461 1144 HOH A O +1144 O O . HOH E . ? 0.4299 0.6238 0.4076 -0.0860 -0.1305 0.1215 1145 HOH A O +1145 O O . HOH E . ? 0.2009 0.6782 0.4025 -0.0564 -0.0558 -0.0235 1146 HOH A O +1146 O O . HOH E . ? 0.2561 0.2387 0.2498 -0.0998 -0.0251 0.0719 1147 HOH A O +1147 O O A HOH E . ? 0.2413 0.4169 0.3787 0.1227 -0.0917 -0.0098 1148 HOH A O +1148 O O B HOH E . ? 0.2071 0.4241 0.4969 0.0146 0.0315 0.0528 1148 HOH A O +1149 O O . HOH E . ? 0.1791 0.1046 0.2880 -0.0195 -0.0236 -0.0120 1149 HOH A O +1150 O O . HOH E . ? 0.3246 0.3648 0.2964 -0.0413 -0.0300 0.0602 1150 HOH A O +1154 O O . HOH E . ? 0.1665 0.0967 0.1939 0.0128 -0.0064 0.0072 1154 HOH A O +1155 O O . HOH E . ? 0.3247 0.3285 0.5076 0.0086 -0.0019 -0.1684 1155 HOH A O +1156 O O . HOH E . ? 0.3926 0.2666 0.2851 0.0017 0.0060 -0.0747 1156 HOH A O +1157 O O A HOH E . ? 0.1173 0.1708 0.1548 -0.0119 -0.0125 0.0331 1157 HOH A O +1158 O O B HOH E . ? 0.1910 0.1198 0.2245 0.0114 -0.0405 0.0178 1157 HOH A O +1162 O O . HOH E . ? 0.1953 0.3866 0.2049 0.1310 0.0012 0.0070 1160 HOH A O +1163 O O . HOH E . ? 0.2957 0.2579 0.4919 0.0188 -0.0483 -0.1528 1161 HOH A O +1164 O O . HOH E . ? 0.3151 0.2804 0.3616 0.0230 0.0091 -0.1180 1162 HOH A O +1166 O O . HOH E . ? 0.2298 0.1385 0.3170 -0.0009 -0.0615 0.0239 1164 HOH A O +1168 O O . HOH E . ? 0.1424 0.1539 0.2644 0.0384 -0.0618 -0.0511 1166 HOH A O +1171 O O . HOH E . ? 0.1526 0.2491 0.2978 -0.0741 0.0406 -0.1202 1169 HOH A O +1172 O O . HOH E . ? 0.2360 0.2236 0.3508 0.0300 -0.0087 0.0548 1170 HOH A O +1173 O O . HOH E . ? 0.3842 0.3327 0.3032 -0.1416 -0.0406 0.0463 1171 HOH A O +1174 O O . HOH E . ? 0.4682 0.4204 0.3353 0.1435 -0.0053 0.1566 1172 HOH A O +1175 O O . HOH E . ? 0.1747 0.2094 0.1968 0.0086 -0.0117 -0.0604 1173 HOH A O +1176 O O . HOH E . ? 0.2090 0.1791 0.3207 0.0277 -0.0575 0.0001 1174 HOH A O +1177 O O . HOH E . ? 0.1644 0.1449 0.3721 0.0200 0.0498 0.0295 1175 HOH A O +1179 O O . HOH E . ? 0.2549 0.2445 0.2737 0.0188 -0.0446 -0.0275 1177 HOH A O +1180 O O . HOH E . ? 0.1978 0.1731 0.3508 0.0785 -0.0796 -0.0534 1178 HOH A O +1181 O O . HOH E . ? 0.2941 0.4185 0.4134 0.0844 -0.0534 0.0479 1179 HOH A O +1182 O O B HOH E . ? 0.2068 0.1020 0.1667 0.0058 0.0050 0.0286 1180 HOH A O +1184 O O . HOH E . ? 0.1966 0.1298 0.2157 -0.0080 0.0006 0.0413 1182 HOH A O +1185 O O . HOH E . ? 0.2708 0.2964 0.3049 0.0211 -0.0865 -0.0933 1183 HOH A O +1187 O O B HOH E . ? 0.1622 0.1038 0.3630 -0.0108 0.0475 -0.0216 1185 HOH A O +1190 O O A HOH E . ? 0.3469 0.3912 0.2858 0.1340 0.1429 0.0716 1187 HOH A O +1191 O O B HOH E . ? 0.1968 0.3372 0.3728 0.0083 0.1040 0.0888 1187 HOH A O +1194 O O A HOH E . ? 0.2415 0.1690 0.2561 0.0086 -0.0059 0.0868 1189 HOH A O +1195 O O B HOH E . ? 0.2334 0.0915 0.2957 0.0095 0.0177 0.0543 1189 HOH A O +1196 O O . HOH E . ? 0.2172 0.2039 0.3944 0.0693 -0.0414 -0.1041 1190 HOH A O +1198 O O . HOH E . ? 0.2955 0.1433 0.3672 0.0478 0.1030 0.1051 1192 HOH A O +1200 O O A HOH E . ? 0.1477 0.1369 0.3108 -0.0225 -0.0302 -0.0304 1194 HOH A O +1201 O O B HOH E . ? 0.5494 0.1844 0.3510 0.0384 0.1486 0.0031 1194 HOH A O +1202 O O . HOH E . ? 0.2416 0.3496 0.5322 -0.0405 -0.0213 0.0378 1195 HOH A O +1204 O O . HOH E . ? 0.3321 0.3891 0.4429 -0.1688 -0.1394 0.1313 1197 HOH A O +1205 O O A HOH E . ? 0.1011 0.1271 0.2591 -0.0187 -0.0220 -0.0317 1198 HOH A O +1206 O O B HOH E . ? 0.1658 0.1338 0.1690 -0.0338 0.0058 0.0228 1198 HOH A O +1207 O O . HOH E . ? 0.3271 0.1115 0.1609 -0.0663 0.0021 0.0371 1199 HOH A O +1209 O O . HOH E . ? 0.3407 0.2707 0.4295 0.0695 0.0713 0.0638 1201 HOH A O +1212 O O A HOH E . ? 0.6320 0.4477 0.8271 -0.0097 -0.0148 0.3901 1203 HOH A O +1213 O O A HOH E . ? 0.1620 0.2453 0.4462 0.0006 -0.0047 -0.1272 1204 HOH A O +1214 O O . HOH E . ? 0.2998 0.2370 0.5708 0.0790 0.0826 0.0420 1205 HOH A O +1217 O O . HOH E . ? 0.1700 0.3963 0.3824 -0.0173 -0.0392 -0.0104 1208 HOH A O +1218 O O . HOH E . ? 0.6552 0.2192 0.2606 -0.0561 0.0556 0.0063 1209 HOH A O +1221 O O A HOH E . ? 0.2695 0.4376 0.2474 0.0593 -0.0759 0.0118 1211 HOH A O +1222 O O B HOH E . ? 0.2116 0.6130 0.3463 -0.0497 -0.0594 0.0179 1211 HOH A O +1224 O O B HOH E . ? 0.1353 0.3283 0.3292 -0.0307 -0.0044 -0.1097 1212 HOH A O +1225 O O A HOH E . ? 1.0822 0.4888 0.3284 -0.3223 0.4673 -0.0645 1213 HOH A O +1226 O O B HOH E . ? 0.3840 0.2721 0.3191 -0.0557 -0.0104 0.0763 1213 HOH A O +1227 O O A HOH E . ? 0.5402 0.3893 0.3435 -0.0047 -0.0202 0.0036 1214 HOH A O +1228 O O B HOH E . ? 0.4220 0.2666 0.5529 -0.1041 -0.0270 0.0085 1214 HOH A O +1229 O O A HOH E . ? 0.1839 0.1727 0.2302 -0.0105 -0.0200 0.0182 1215 HOH A O +1230 O O B HOH E . ? 0.1140 0.1818 0.2990 0.0363 -0.0061 -0.0854 1215 HOH A O +1232 O O A HOH E . ? 0.2065 0.2735 0.4282 0.0365 0.0168 -0.0434 1217 HOH A O +1236 O O A HOH E . ? 0.3074 0.5759 0.4729 -0.0680 0.0921 -0.1031 1220 HOH A O +1237 O O B HOH E . ? 0.1922 0.3232 0.2505 -0.0854 -0.0151 -0.0620 1220 HOH A O +1238 O O B HOH E . ? 0.1794 0.1328 0.3457 0.0098 -0.0006 0.0619 1221 HOH A O +1244 O O . HOH E . ? 0.4270 0.2373 0.2978 -0.0432 -0.0433 0.0266 1227 HOH A O +1245 O O . HOH E . ? 0.2912 0.3867 0.4428 0.0073 -0.1480 -0.0474 1228 HOH A O +1248 O O . HOH E . ? 0.2795 0.3689 0.2311 -0.0186 0.0110 0.0137 1230 HOH A O +1252 O O . HOH E . ? 0.3552 0.3921 0.5879 0.0716 0.0639 0.0998 1233 HOH A O +1256 O O . HOH E . ? 0.4191 0.3676 0.3690 -0.0479 0.0300 0.0873 1236 HOH A O +1257 O O . HOH E . ? 0.5530 0.9701 0.5592 -0.1703 -0.1084 -0.0116 1237 HOH A O +1259 O O B HOH E . ? 0.2479 0.2296 0.2710 -0.0109 -0.0022 -0.1087 1238 HOH A O +1260 O O . HOH E . ? 0.2790 0.1792 0.4168 0.0137 -0.1577 -0.0221 1239 HOH A O +1263 O O . HOH E . ? 0.2126 0.4358 0.3617 0.0243 0.0250 -0.0636 1241 HOH A O +1264 O O A HOH E . ? 0.4848 0.5660 0.6104 -0.1156 0.0284 -0.1901 1242 HOH A O +1265 O O B HOH E . ? 0.2593 0.5959 0.3434 -0.0014 -0.0394 -0.0009 1242 HOH A O +1268 O O . HOH E . ? 0.3440 0.2369 0.3139 -0.0594 0.0977 0.0260 1245 HOH A O +1270 O O A HOH E . ? 0.4254 0.1934 0.3294 -0.0326 0.1011 -0.0621 1247 HOH A O +1272 O O . HOH E . ? 0.5097 0.5222 0.8280 0.1119 -0.0953 -0.1246 1249 HOH A O +1273 O O . HOH E . ? 0.3162 0.6527 0.3583 -0.0416 -0.0070 -0.0211 1250 HOH A O +# diff --git a/tests/resources/6wgl.cif b/tests/resources/6wgl.cif new file mode 100644 index 0000000..55cc29e --- /dev/null +++ b/tests/resources/6wgl.cif @@ -0,0 +1,8745 @@ +data_6WGL +# +_entry.id 6WGL +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.397 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 6WGL pdb_00006wgl 10.2210/pdb6wgl/pdb +WWPDB D_1000248167 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2020-09-16 +2 'Structure model' 2 0 2020-09-23 +3 'Structure model' 2 1 2023-10-18 +4 'Structure model' 2 2 2024-10-30 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Atomic model' +2 2 'Structure model' 'Data collection' +3 2 'Structure model' 'Database references' +4 2 'Structure model' 'Derived calculations' +5 3 'Structure model' 'Data collection' +6 3 'Structure model' 'Database references' +7 3 'Structure model' 'Refinement description' +8 4 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 2 'Structure model' atom_site +2 2 'Structure model' citation +3 2 'Structure model' citation_author +4 2 'Structure model' pdbx_nonpoly_scheme +5 2 'Structure model' pdbx_struct_assembly_gen +6 2 'Structure model' pdbx_struct_assembly_prop +7 2 'Structure model' pdbx_struct_oper_list +8 2 'Structure model' struct_conn +9 3 'Structure model' chem_comp_atom +10 3 'Structure model' chem_comp_bond +11 3 'Structure model' database_2 +12 3 'Structure model' pdbx_initial_refinement_model +13 4 'Structure model' pdbx_entry_details +14 4 'Structure model' pdbx_modification_feature +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 2 'Structure model' '_atom_site.auth_seq_id' +2 2 'Structure model' '_citation.country' +3 2 'Structure model' '_citation.journal_abbrev' +4 2 'Structure model' '_citation.journal_id_CSD' +5 2 'Structure model' '_citation.journal_id_ISSN' +6 2 'Structure model' '_citation.journal_volume' +7 2 'Structure model' '_citation.page_first' +8 2 'Structure model' '_citation.page_last' +9 2 'Structure model' '_citation.pdbx_database_id_DOI' +10 2 'Structure model' '_citation.pdbx_database_id_PubMed' +11 2 'Structure model' '_citation.title' +12 2 'Structure model' '_citation.year' +13 2 'Structure model' '_pdbx_nonpoly_scheme.pdb_seq_num' +14 2 'Structure model' '_pdbx_struct_assembly_prop.value' +15 2 'Structure model' '_struct_conn.ptnr2_auth_seq_id' +16 3 'Structure model' '_database_2.pdbx_DOI' +17 3 'Structure model' '_database_2.pdbx_database_accession' +18 4 'Structure model' '_pdbx_entry_details.has_protein_modification' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.entry_id 6WGL +_pdbx_database_status.recvd_initial_deposition_date 2020-04-05 +_pdbx_database_status.SG_entry N +_pdbx_database_status.deposit_site RCSB +_pdbx_database_status.process_site RCSB +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.status_code_nmr_data ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +# +loop_ +_pdbx_database_related.db_name +_pdbx_database_related.details +_pdbx_database_related.db_id +_pdbx_database_related.content_type +PDB . 6WGB unspecified +PDB . 6WG8 unspecified +PDB . 6WGJ unspecified +PDB . 6WGK unspecified +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +_audit_author.identifier_ORCID +'Druzina, Z.' 1 ? +'Atwell, S.' 2 ? +'Pustilnik, A.' 3 ? +'Antonysamy, S.' 4 ? +'Ho, C.' 5 ? +'Lieu, R.' 6 ? +'Hendle, J.' 7 ? +'Benach, J.' 8 ? +'Wang, J.' 9 ? +# +_citation.abstract ? +_citation.abstract_id_CAS ? +_citation.book_id_ISBN ? +_citation.book_publisher ? +_citation.book_publisher_city ? +_citation.book_title ? +_citation.coordinate_linkage ? +_citation.country US +_citation.database_id_Medline ? +_citation.details ? +_citation.id primary +_citation.journal_abbrev 'Plos One' +_citation.journal_id_ASTM ? +_citation.journal_id_CSD ? +_citation.journal_id_ISSN 1932-6203 +_citation.journal_full ? +_citation.journal_issue ? +_citation.journal_volume 15 +_citation.language ? +_citation.page_first e0232311 +_citation.page_last e0232311 +_citation.title +'Rapid and robust antibody Fab fragment crystallization utilizing edge-to-edge beta-sheet packing.' +_citation.year 2020 +_citation.database_id_CSD ? +_citation.pdbx_database_id_DOI 10.1371/journal.pone.0232311 +_citation.pdbx_database_id_PubMed 32915778 +_citation.unpublished_flag ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Lieu, R.' 1 ? +primary 'Antonysamy, S.' 2 ? +primary 'Druzina, Z.' 3 ? +primary 'Ho, C.' 4 ? +primary 'Kang, N.R.' 5 ? +primary 'Pustilnik, A.' 6 ? +primary 'Wang, J.' 7 ? +primary 'Atwell, S.' 8 0000-0002-2578-2462 +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Dupilumab Fab heavy chain' 25233.113 1 ? ? ? ? +2 polymer man 'Dupilumab Fab light chain' 23809.496 1 ? ? ? ? +3 polymer man 'Interleukin-4 receptor subunit alpha' 24908.830 1 ? ? ? ? +4 branched man '2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose' 424.401 2 ? ? ? ? +5 non-polymer man 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208 1 ? ? ? ? +6 water nat water 18.015 26 ? ? ? ? +# +_entity_name_com.entity_id 3 +_entity_name_com.name IL-4RA +# +loop_ +_entity_poly.entity_id +_entity_poly.type +_entity_poly.nstd_linkage +_entity_poly.nstd_monomer +_entity_poly.pdbx_seq_one_letter_code +_entity_poly.pdbx_seq_one_letter_code_can +_entity_poly.pdbx_strand_id +_entity_poly.pdbx_target_identifier +1 'polypeptide(L)' no no +;EVQLVESGGGLEQPGGSLRLSCAGSGFTFRDYAMTWVRQAPGKGLEWVSSISGSGGNTYYADSVKGRFTISRDNSKNTLY +LQMNSLRAEDTAVYYCAKDRLSITIRPRYYGLDVWGQGTTVTVSSASTKGPSVFPLAPCSRSTSESTAALGCLVKDYFPE +PVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVESKYGHHHHHH +; +;EVQLVESGGGLEQPGGSLRLSCAGSGFTFRDYAMTWVRQAPGKGLEWVSSISGSGGNTYYADSVKGRFTISRDNSKNTLY +LQMNSLRAEDTAVYYCAKDRLSITIRPRYYGLDVWGQGTTVTVSSASTKGPSVFPLAPCSRSTSESTAALGCLVKDYFPE +PVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVESKYGHHHHHH +; +A ? +2 'polypeptide(L)' no no +;DIVMTQSPLSLPVTPGEPASISCRSSQSLLYSIGYNYLDWYLQKSGQSPQLLIYLGSNRASGVPDRFSGSGSGTDFTLKI +SRVEAEDVGFYYCMQALQTPYTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQ +SGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTQGTTSVTKSFNRGEC +; +;DIVMTQSPLSLPVTPGEPASISCRSSQSLLYSIGYNYLDWYLQKSGQSPQLLIYLGSNRASGVPDRFSGSGSGTDFTLKI +SRVEAEDVGFYYCMQALQTPYTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQ +SGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTQGTTSVTKSFNRGEC +; +B ? +3 'polypeptide(L)' no no +;MKVLQEPTCVSDYMSISTCEWKMNGPTNCSTELRLLYQLVFLLSEAHTCIPENNGGAGCVCHLLMDDVVSADNYTLDLWA +GQQLLWKGSFKPSEHVKPRAPGNLTVHTNVSDTLLLTWSNPYPPDNYLYNHLTYAVNIWSENDPADFRIYNVTYLEPSLR +IAASTLKSGISYRARVRAWAQLYNTTWSEWSPSTKWHNSYREPFEQHGGGGSHHHHHH +; +;MKVLQEPTCVSDYMSISTCEWKMNGPTNCSTELRLLYQLVFLLSEAHTCIPENNGGAGCVCHLLMDDVVSADNYTLDLWA +GQQLLWKGSFKPSEHVKPRAPGNLTVHTNVSDTLLLTWSNPYPPDNYLYNHLTYAVNIWSENDPADFRIYNVTYLEPSLR +IAASTLKSGISYRARVRAWAQLYNTTWSEWSPSTKWHNSYREPFEQHGGGGSHHHHHH +; +C ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +5 2-acetamido-2-deoxy-beta-D-glucopyranose NAG +6 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 GLU n +1 2 VAL n +1 3 GLN n +1 4 LEU n +1 5 VAL n +1 6 GLU n +1 7 SER n +1 8 GLY n +1 9 GLY n +1 10 GLY n +1 11 LEU n +1 12 GLU n +1 13 GLN n +1 14 PRO n +1 15 GLY n +1 16 GLY n +1 17 SER n +1 18 LEU n +1 19 ARG n +1 20 LEU n +1 21 SER n +1 22 CYS n +1 23 ALA n +1 24 GLY n +1 25 SER n +1 26 GLY n +1 27 PHE n +1 28 THR n +1 29 PHE n +1 30 ARG n +1 31 ASP n +1 32 TYR n +1 33 ALA n +1 34 MET n +1 35 THR n +1 36 TRP n +1 37 VAL n +1 38 ARG n +1 39 GLN n +1 40 ALA n +1 41 PRO n +1 42 GLY n +1 43 LYS n +1 44 GLY n +1 45 LEU n +1 46 GLU n +1 47 TRP n +1 48 VAL n +1 49 SER n +1 50 SER n +1 51 ILE n +1 52 SER n +1 53 GLY n +1 54 SER n +1 55 GLY n +1 56 GLY n +1 57 ASN n +1 58 THR n +1 59 TYR n +1 60 TYR n +1 61 ALA n +1 62 ASP n +1 63 SER n +1 64 VAL n +1 65 LYS n +1 66 GLY n +1 67 ARG n +1 68 PHE n +1 69 THR n +1 70 ILE n +1 71 SER n +1 72 ARG n +1 73 ASP n +1 74 ASN n +1 75 SER n +1 76 LYS n +1 77 ASN n +1 78 THR n +1 79 LEU n +1 80 TYR n +1 81 LEU n +1 82 GLN n +1 83 MET n +1 84 ASN n +1 85 SER n +1 86 LEU n +1 87 ARG n +1 88 ALA n +1 89 GLU n +1 90 ASP n +1 91 THR n +1 92 ALA n +1 93 VAL n +1 94 TYR n +1 95 TYR n +1 96 CYS n +1 97 ALA n +1 98 LYS n +1 99 ASP n +1 100 ARG n +1 101 LEU n +1 102 SER n +1 103 ILE n +1 104 THR n +1 105 ILE n +1 106 ARG n +1 107 PRO n +1 108 ARG n +1 109 TYR n +1 110 TYR n +1 111 GLY n +1 112 LEU n +1 113 ASP n +1 114 VAL n +1 115 TRP n +1 116 GLY n +1 117 GLN n +1 118 GLY n +1 119 THR n +1 120 THR n +1 121 VAL n +1 122 THR n +1 123 VAL n +1 124 SER n +1 125 SER n +1 126 ALA n +1 127 SER n +1 128 THR n +1 129 LYS n +1 130 GLY n +1 131 PRO n +1 132 SER n +1 133 VAL n +1 134 PHE n +1 135 PRO n +1 136 LEU n +1 137 ALA n +1 138 PRO n +1 139 CYS n +1 140 SER n +1 141 ARG n +1 142 SER n +1 143 THR n +1 144 SER n +1 145 GLU n +1 146 SER n +1 147 THR n +1 148 ALA n +1 149 ALA n +1 150 LEU n +1 151 GLY n +1 152 CYS n +1 153 LEU n +1 154 VAL n +1 155 LYS n +1 156 ASP n +1 157 TYR n +1 158 PHE n +1 159 PRO n +1 160 GLU n +1 161 PRO n +1 162 VAL n +1 163 THR n +1 164 VAL n +1 165 SER n +1 166 TRP n +1 167 ASN n +1 168 SER n +1 169 GLY n +1 170 ALA n +1 171 LEU n +1 172 THR n +1 173 SER n +1 174 GLY n +1 175 VAL n +1 176 HIS n +1 177 THR n +1 178 PHE n +1 179 PRO n +1 180 ALA n +1 181 VAL n +1 182 LEU n +1 183 GLN n +1 184 SER n +1 185 SER n +1 186 GLY n +1 187 LEU n +1 188 TYR n +1 189 SER n +1 190 LEU n +1 191 SER n +1 192 SER n +1 193 VAL n +1 194 VAL n +1 195 THR n +1 196 VAL n +1 197 PRO n +1 198 SER n +1 199 SER n +1 200 SER n +1 201 LEU n +1 202 GLY n +1 203 THR n +1 204 LYS n +1 205 THR n +1 206 TYR n +1 207 THR n +1 208 CYS n +1 209 ASN n +1 210 VAL n +1 211 ASP n +1 212 HIS n +1 213 LYS n +1 214 PRO n +1 215 SER n +1 216 ASN n +1 217 THR n +1 218 LYS n +1 219 VAL n +1 220 ASP n +1 221 LYS n +1 222 ARG n +1 223 VAL n +1 224 GLU n +1 225 SER n +1 226 LYS n +1 227 TYR n +1 228 GLY n +1 229 HIS n +1 230 HIS n +1 231 HIS n +1 232 HIS n +1 233 HIS n +1 234 HIS n +2 1 ASP n +2 2 ILE n +2 3 VAL n +2 4 MET n +2 5 THR n +2 6 GLN n +2 7 SER n +2 8 PRO n +2 9 LEU n +2 10 SER n +2 11 LEU n +2 12 PRO n +2 13 VAL n +2 14 THR n +2 15 PRO n +2 16 GLY n +2 17 GLU n +2 18 PRO n +2 19 ALA n +2 20 SER n +2 21 ILE n +2 22 SER n +2 23 CYS n +2 24 ARG n +2 25 SER n +2 26 SER n +2 27 GLN n +2 28 SER n +2 29 LEU n +2 30 LEU n +2 31 TYR n +2 32 SER n +2 33 ILE n +2 34 GLY n +2 35 TYR n +2 36 ASN n +2 37 TYR n +2 38 LEU n +2 39 ASP n +2 40 TRP n +2 41 TYR n +2 42 LEU n +2 43 GLN n +2 44 LYS n +2 45 SER n +2 46 GLY n +2 47 GLN n +2 48 SER n +2 49 PRO n +2 50 GLN n +2 51 LEU n +2 52 LEU n +2 53 ILE n +2 54 TYR n +2 55 LEU n +2 56 GLY n +2 57 SER n +2 58 ASN n +2 59 ARG n +2 60 ALA n +2 61 SER n +2 62 GLY n +2 63 VAL n +2 64 PRO n +2 65 ASP n +2 66 ARG n +2 67 PHE n +2 68 SER n +2 69 GLY n +2 70 SER n +2 71 GLY n +2 72 SER n +2 73 GLY n +2 74 THR n +2 75 ASP n +2 76 PHE n +2 77 THR n +2 78 LEU n +2 79 LYS n +2 80 ILE n +2 81 SER n +2 82 ARG n +2 83 VAL n +2 84 GLU n +2 85 ALA n +2 86 GLU n +2 87 ASP n +2 88 VAL n +2 89 GLY n +2 90 PHE n +2 91 TYR n +2 92 TYR n +2 93 CYS n +2 94 MET n +2 95 GLN n +2 96 ALA n +2 97 LEU n +2 98 GLN n +2 99 THR n +2 100 PRO n +2 101 TYR n +2 102 THR n +2 103 PHE n +2 104 GLY n +2 105 GLN n +2 106 GLY n +2 107 THR n +2 108 LYS n +2 109 LEU n +2 110 GLU n +2 111 ILE n +2 112 LYS n +2 113 ARG n +2 114 THR n +2 115 VAL n +2 116 ALA n +2 117 ALA n +2 118 PRO n +2 119 SER n +2 120 VAL n +2 121 PHE n +2 122 ILE n +2 123 PHE n +2 124 PRO n +2 125 PRO n +2 126 SER n +2 127 ASP n +2 128 GLU n +2 129 GLN n +2 130 LEU n +2 131 LYS n +2 132 SER n +2 133 GLY n +2 134 THR n +2 135 ALA n +2 136 SER n +2 137 VAL n +2 138 VAL n +2 139 CYS n +2 140 LEU n +2 141 LEU n +2 142 ASN n +2 143 ASN n +2 144 PHE n +2 145 TYR n +2 146 PRO n +2 147 ARG n +2 148 GLU n +2 149 ALA n +2 150 LYS n +2 151 VAL n +2 152 GLN n +2 153 TRP n +2 154 LYS n +2 155 VAL n +2 156 ASP n +2 157 ASN n +2 158 ALA n +2 159 LEU n +2 160 GLN n +2 161 SER n +2 162 GLY n +2 163 ASN n +2 164 SER n +2 165 GLN n +2 166 GLU n +2 167 SER n +2 168 VAL n +2 169 THR n +2 170 GLU n +2 171 GLN n +2 172 ASP n +2 173 SER n +2 174 LYS n +2 175 ASP n +2 176 SER n +2 177 THR n +2 178 TYR n +2 179 SER n +2 180 LEU n +2 181 SER n +2 182 SER n +2 183 THR n +2 184 LEU n +2 185 THR n +2 186 LEU n +2 187 SER n +2 188 LYS n +2 189 ALA n +2 190 ASP n +2 191 TYR n +2 192 GLU n +2 193 LYS n +2 194 HIS n +2 195 LYS n +2 196 VAL n +2 197 TYR n +2 198 ALA n +2 199 CYS n +2 200 GLU n +2 201 VAL n +2 202 THR n +2 203 GLN n +2 204 GLY n +2 205 THR n +2 206 THR n +2 207 SER n +2 208 VAL n +2 209 THR n +2 210 LYS n +2 211 SER n +2 212 PHE n +2 213 ASN n +2 214 ARG n +2 215 GLY n +2 216 GLU n +2 217 CYS n +3 1 MET n +3 2 LYS n +3 3 VAL n +3 4 LEU n +3 5 GLN n +3 6 GLU n +3 7 PRO n +3 8 THR n +3 9 CYS n +3 10 VAL n +3 11 SER n +3 12 ASP n +3 13 TYR n +3 14 MET n +3 15 SER n +3 16 ILE n +3 17 SER n +3 18 THR n +3 19 CYS n +3 20 GLU n +3 21 TRP n +3 22 LYS n +3 23 MET n +3 24 ASN n +3 25 GLY n +3 26 PRO n +3 27 THR n +3 28 ASN n +3 29 CYS n +3 30 SER n +3 31 THR n +3 32 GLU n +3 33 LEU n +3 34 ARG n +3 35 LEU n +3 36 LEU n +3 37 TYR n +3 38 GLN n +3 39 LEU n +3 40 VAL n +3 41 PHE n +3 42 LEU n +3 43 LEU n +3 44 SER n +3 45 GLU n +3 46 ALA n +3 47 HIS n +3 48 THR n +3 49 CYS n +3 50 ILE n +3 51 PRO n +3 52 GLU n +3 53 ASN n +3 54 ASN n +3 55 GLY n +3 56 GLY n +3 57 ALA n +3 58 GLY n +3 59 CYS n +3 60 VAL n +3 61 CYS n +3 62 HIS n +3 63 LEU n +3 64 LEU n +3 65 MET n +3 66 ASP n +3 67 ASP n +3 68 VAL n +3 69 VAL n +3 70 SER n +3 71 ALA n +3 72 ASP n +3 73 ASN n +3 74 TYR n +3 75 THR n +3 76 LEU n +3 77 ASP n +3 78 LEU n +3 79 TRP n +3 80 ALA n +3 81 GLY n +3 82 GLN n +3 83 GLN n +3 84 LEU n +3 85 LEU n +3 86 TRP n +3 87 LYS n +3 88 GLY n +3 89 SER n +3 90 PHE n +3 91 LYS n +3 92 PRO n +3 93 SER n +3 94 GLU n +3 95 HIS n +3 96 VAL n +3 97 LYS n +3 98 PRO n +3 99 ARG n +3 100 ALA n +3 101 PRO n +3 102 GLY n +3 103 ASN n +3 104 LEU n +3 105 THR n +3 106 VAL n +3 107 HIS n +3 108 THR n +3 109 ASN n +3 110 VAL n +3 111 SER n +3 112 ASP n +3 113 THR n +3 114 LEU n +3 115 LEU n +3 116 LEU n +3 117 THR n +3 118 TRP n +3 119 SER n +3 120 ASN n +3 121 PRO n +3 122 TYR n +3 123 PRO n +3 124 PRO n +3 125 ASP n +3 126 ASN n +3 127 TYR n +3 128 LEU n +3 129 TYR n +3 130 ASN n +3 131 HIS n +3 132 LEU n +3 133 THR n +3 134 TYR n +3 135 ALA n +3 136 VAL n +3 137 ASN n +3 138 ILE n +3 139 TRP n +3 140 SER n +3 141 GLU n +3 142 ASN n +3 143 ASP n +3 144 PRO n +3 145 ALA n +3 146 ASP n +3 147 PHE n +3 148 ARG n +3 149 ILE n +3 150 TYR n +3 151 ASN n +3 152 VAL n +3 153 THR n +3 154 TYR n +3 155 LEU n +3 156 GLU n +3 157 PRO n +3 158 SER n +3 159 LEU n +3 160 ARG n +3 161 ILE n +3 162 ALA n +3 163 ALA n +3 164 SER n +3 165 THR n +3 166 LEU n +3 167 LYS n +3 168 SER n +3 169 GLY n +3 170 ILE n +3 171 SER n +3 172 TYR n +3 173 ARG n +3 174 ALA n +3 175 ARG n +3 176 VAL n +3 177 ARG n +3 178 ALA n +3 179 TRP n +3 180 ALA n +3 181 GLN n +3 182 LEU n +3 183 TYR n +3 184 ASN n +3 185 THR n +3 186 THR n +3 187 TRP n +3 188 SER n +3 189 GLU n +3 190 TRP n +3 191 SER n +3 192 PRO n +3 193 SER n +3 194 THR n +3 195 LYS n +3 196 TRP n +3 197 HIS n +3 198 ASN n +3 199 SER n +3 200 TYR n +3 201 ARG n +3 202 GLU n +3 203 PRO n +3 204 PHE n +3 205 GLU n +3 206 GLN n +3 207 HIS n +3 208 GLY n +3 209 GLY n +3 210 GLY n +3 211 GLY n +3 212 SER n +3 213 HIS n +3 214 HIS n +3 215 HIS n +3 216 HIS n +3 217 HIS n +3 218 HIS n +# +loop_ +_entity_src_gen.entity_id +_entity_src_gen.pdbx_src_id +_entity_src_gen.pdbx_alt_source_flag +_entity_src_gen.pdbx_seq_type +_entity_src_gen.pdbx_beg_seq_num +_entity_src_gen.pdbx_end_seq_num +_entity_src_gen.gene_src_common_name +_entity_src_gen.gene_src_genus +_entity_src_gen.pdbx_gene_src_gene +_entity_src_gen.gene_src_species +_entity_src_gen.gene_src_strain +_entity_src_gen.gene_src_tissue +_entity_src_gen.gene_src_tissue_fraction +_entity_src_gen.gene_src_details +_entity_src_gen.pdbx_gene_src_fragment +_entity_src_gen.pdbx_gene_src_scientific_name +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id +_entity_src_gen.pdbx_gene_src_variant +_entity_src_gen.pdbx_gene_src_cell_line +_entity_src_gen.pdbx_gene_src_atcc +_entity_src_gen.pdbx_gene_src_organ +_entity_src_gen.pdbx_gene_src_organelle +_entity_src_gen.pdbx_gene_src_cell +_entity_src_gen.pdbx_gene_src_cellular_location +_entity_src_gen.host_org_common_name +_entity_src_gen.pdbx_host_org_scientific_name +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id +_entity_src_gen.host_org_genus +_entity_src_gen.pdbx_host_org_gene +_entity_src_gen.pdbx_host_org_organ +_entity_src_gen.host_org_species +_entity_src_gen.pdbx_host_org_tissue +_entity_src_gen.pdbx_host_org_tissue_fraction +_entity_src_gen.pdbx_host_org_strain +_entity_src_gen.pdbx_host_org_variant +_entity_src_gen.pdbx_host_org_cell_line +_entity_src_gen.pdbx_host_org_atcc +_entity_src_gen.pdbx_host_org_culture_collection +_entity_src_gen.pdbx_host_org_cell +_entity_src_gen.pdbx_host_org_organelle +_entity_src_gen.pdbx_host_org_cellular_location +_entity_src_gen.pdbx_host_org_vector_type +_entity_src_gen.pdbx_host_org_vector +_entity_src_gen.host_org_details +_entity_src_gen.expression_system_id +_entity_src_gen.plasmid_name +_entity_src_gen.plasmid_details +_entity_src_gen.pdbx_description +1 1 sample 'Biological sequence' 1 234 human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? +'Chinese hamster' 'Cricetulus griseus' 10029 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +2 1 sample 'Biological sequence' 1 217 human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? +'Chinese hamster' 'Cricetulus griseus' 10029 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +3 1 sample 'Biological sequence' 1 218 Human ? 'IL4R, IL4RA, 582J2.1' ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? +'Chinese hamster' 'Cricetulus griseus' 10029 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +# +_pdbx_entity_branch.entity_id 4 +_pdbx_entity_branch.type oligosaccharide +# +loop_ +_pdbx_entity_branch_descriptor.ordinal +_pdbx_entity_branch_descriptor.entity_id +_pdbx_entity_branch_descriptor.descriptor +_pdbx_entity_branch_descriptor.type +_pdbx_entity_branch_descriptor.program +_pdbx_entity_branch_descriptor.program_version +1 4 DGlcpNAcb1-4DGlcpNAcb1- 'Glycam Condensed Sequence' GMML 1.0 +2 4 'WURCS=2.0/1,2,1/[a2122h-1b_1-5_2*NCC/3=O]/1-1/a4-b1' WURCS PDB2Glycan 1.1.0 +3 4 '[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{}}}' LINUCS PDB-CARE ? +# +_pdbx_entity_branch_link.link_id 1 +_pdbx_entity_branch_link.entity_id 4 +_pdbx_entity_branch_link.entity_branch_list_num_1 2 +_pdbx_entity_branch_link.comp_id_1 NAG +_pdbx_entity_branch_link.atom_id_1 C1 +_pdbx_entity_branch_link.leaving_atom_id_1 O1 +_pdbx_entity_branch_link.entity_branch_list_num_2 1 +_pdbx_entity_branch_link.comp_id_2 NAG +_pdbx_entity_branch_link.atom_id_2 O4 +_pdbx_entity_branch_link.leaving_atom_id_2 HO4 +_pdbx_entity_branch_link.value_order sing +_pdbx_entity_branch_link.details ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose +;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE +; +'C8 H15 N O6' 221.208 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_chem_comp_identifier.comp_id +_pdbx_chem_comp_identifier.type +_pdbx_chem_comp_identifier.program +_pdbx_chem_comp_identifier.program_version +_pdbx_chem_comp_identifier.identifier +NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DGlcpNAcb +NAG 'COMMON NAME' GMML 1.0 N-acetyl-b-D-glucopyranosamine +NAG 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 b-D-GlcpNAc +NAG 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 GlcNAc +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 GLU 1 1 1 GLU GLU A . n +A 1 2 VAL 2 2 2 VAL VAL A . n +A 1 3 GLN 3 3 3 GLN GLN A . n +A 1 4 LEU 4 4 4 LEU LEU A . n +A 1 5 VAL 5 5 5 VAL VAL A . n +A 1 6 GLU 6 6 6 GLU GLU A . n +A 1 7 SER 7 7 7 SER SER A . n +A 1 8 GLY 8 8 8 GLY GLY A . n +A 1 9 GLY 9 9 9 GLY GLY A . n +A 1 10 GLY 10 10 10 GLY GLY A . n +A 1 11 LEU 11 11 11 LEU LEU A . n +A 1 12 GLU 12 12 12 GLU GLU A . n +A 1 13 GLN 13 13 13 GLN GLN A . n +A 1 14 PRO 14 14 14 PRO PRO A . n +A 1 15 GLY 15 15 15 GLY GLY A . n +A 1 16 GLY 16 16 16 GLY GLY A . n +A 1 17 SER 17 17 17 SER SER A . n +A 1 18 LEU 18 18 18 LEU LEU A . n +A 1 19 ARG 19 19 19 ARG ARG A . n +A 1 20 LEU 20 20 20 LEU LEU A . n +A 1 21 SER 21 21 21 SER SER A . n +A 1 22 CYS 22 22 22 CYS CYS A . n +A 1 23 ALA 23 23 23 ALA ALA A . n +A 1 24 GLY 24 24 24 GLY GLY A . n +A 1 25 SER 25 25 25 SER SER A . n +A 1 26 GLY 26 26 26 GLY GLY A . n +A 1 27 PHE 27 27 27 PHE PHE A . n +A 1 28 THR 28 28 28 THR THR A . n +A 1 29 PHE 29 29 29 PHE PHE A . n +A 1 30 ARG 30 30 30 ARG ARG A . n +A 1 31 ASP 31 31 31 ASP ASP A . n +A 1 32 TYR 32 32 32 TYR TYR A . n +A 1 33 ALA 33 33 33 ALA ALA A . n +A 1 34 MET 34 34 34 MET MET A . n +A 1 35 THR 35 35 35 THR THR A . n +A 1 36 TRP 36 36 36 TRP TRP A . n +A 1 37 VAL 37 37 37 VAL VAL A . n +A 1 38 ARG 38 38 38 ARG ARG A . n +A 1 39 GLN 39 39 39 GLN GLN A . n +A 1 40 ALA 40 40 40 ALA ALA A . n +A 1 41 PRO 41 41 41 PRO PRO A . n +A 1 42 GLY 42 42 42 GLY GLY A . n +A 1 43 LYS 43 43 43 LYS LYS A . n +A 1 44 GLY 44 44 44 GLY GLY A . n +A 1 45 LEU 45 45 45 LEU LEU A . n +A 1 46 GLU 46 46 46 GLU GLU A . n +A 1 47 TRP 47 47 47 TRP TRP A . n +A 1 48 VAL 48 48 48 VAL VAL A . n +A 1 49 SER 49 49 49 SER SER A . n +A 1 50 SER 50 50 50 SER SER A . n +A 1 51 ILE 51 51 51 ILE ILE A . n +A 1 52 SER 52 52 52 SER SER A . n +A 1 53 GLY 53 53 53 GLY GLY A . n +A 1 54 SER 54 54 54 SER SER A . n +A 1 55 GLY 55 55 55 GLY GLY A . n +A 1 56 GLY 56 56 56 GLY GLY A . n +A 1 57 ASN 57 57 57 ASN ASN A . n +A 1 58 THR 58 58 58 THR THR A . n +A 1 59 TYR 59 59 59 TYR TYR A . n +A 1 60 TYR 60 60 60 TYR TYR A . n +A 1 61 ALA 61 61 61 ALA ALA A . n +A 1 62 ASP 62 62 62 ASP ASP A . n +A 1 63 SER 63 63 63 SER SER A . n +A 1 64 VAL 64 64 64 VAL VAL A . n +A 1 65 LYS 65 65 65 LYS LYS A . n +A 1 66 GLY 66 66 66 GLY GLY A . n +A 1 67 ARG 67 67 67 ARG ARG A . n +A 1 68 PHE 68 68 68 PHE PHE A . n +A 1 69 THR 69 69 69 THR THR A . n +A 1 70 ILE 70 70 70 ILE ILE A . n +A 1 71 SER 71 71 71 SER SER A . n +A 1 72 ARG 72 72 72 ARG ARG A . n +A 1 73 ASP 73 73 73 ASP ASP A . n +A 1 74 ASN 74 74 74 ASN ASN A . n +A 1 75 SER 75 75 75 SER SER A . n +A 1 76 LYS 76 76 76 LYS LYS A . n +A 1 77 ASN 77 77 77 ASN ASN A . n +A 1 78 THR 78 78 78 THR THR A . n +A 1 79 LEU 79 79 79 LEU LEU A . n +A 1 80 TYR 80 80 80 TYR TYR A . n +A 1 81 LEU 81 81 81 LEU LEU A . n +A 1 82 GLN 82 82 82 GLN GLN A . n +A 1 83 MET 83 83 83 MET MET A . n +A 1 84 ASN 84 84 84 ASN ASN A . n +A 1 85 SER 85 85 85 SER SER A . n +A 1 86 LEU 86 86 86 LEU LEU A . n +A 1 87 ARG 87 87 87 ARG ARG A . n +A 1 88 ALA 88 88 88 ALA ALA A . n +A 1 89 GLU 89 89 89 GLU GLU A . n +A 1 90 ASP 90 90 90 ASP ASP A . n +A 1 91 THR 91 91 91 THR THR A . n +A 1 92 ALA 92 92 92 ALA ALA A . n +A 1 93 VAL 93 93 93 VAL VAL A . n +A 1 94 TYR 94 94 94 TYR TYR A . n +A 1 95 TYR 95 95 95 TYR TYR A . n +A 1 96 CYS 96 96 96 CYS CYS A . n +A 1 97 ALA 97 97 97 ALA ALA A . n +A 1 98 LYS 98 98 98 LYS LYS A . n +A 1 99 ASP 99 99 99 ASP ASP A . n +A 1 100 ARG 100 100 100 ARG ARG A . n +A 1 101 LEU 101 101 101 LEU LEU A . n +A 1 102 SER 102 102 102 SER SER A . n +A 1 103 ILE 103 103 103 ILE ILE A . n +A 1 104 THR 104 104 104 THR THR A . n +A 1 105 ILE 105 105 105 ILE ILE A . n +A 1 106 ARG 106 106 106 ARG ARG A . n +A 1 107 PRO 107 107 107 PRO PRO A . n +A 1 108 ARG 108 108 108 ARG ARG A . n +A 1 109 TYR 109 109 109 TYR TYR A . n +A 1 110 TYR 110 110 110 TYR TYR A . n +A 1 111 GLY 111 111 111 GLY GLY A . n +A 1 112 LEU 112 112 112 LEU LEU A . n +A 1 113 ASP 113 113 113 ASP ASP A . n +A 1 114 VAL 114 114 114 VAL VAL A . n +A 1 115 TRP 115 115 115 TRP TRP A . n +A 1 116 GLY 116 116 116 GLY GLY A . n +A 1 117 GLN 117 117 117 GLN GLN A . n +A 1 118 GLY 118 118 118 GLY GLY A . n +A 1 119 THR 119 119 119 THR THR A . n +A 1 120 THR 120 120 120 THR THR A . n +A 1 121 VAL 121 121 121 VAL VAL A . n +A 1 122 THR 122 122 122 THR THR A . n +A 1 123 VAL 123 123 123 VAL VAL A . n +A 1 124 SER 124 124 124 SER SER A . n +A 1 125 SER 125 125 125 SER SER A . n +A 1 126 ALA 126 126 126 ALA ALA A . n +A 1 127 SER 127 127 127 SER SER A . n +A 1 128 THR 128 128 128 THR THR A . n +A 1 129 LYS 129 129 129 LYS LYS A . n +A 1 130 GLY 130 130 130 GLY GLY A . n +A 1 131 PRO 131 131 131 PRO PRO A . n +A 1 132 SER 132 132 132 SER SER A . n +A 1 133 VAL 133 133 133 VAL VAL A . n +A 1 134 PHE 134 134 134 PHE PHE A . n +A 1 135 PRO 135 135 135 PRO PRO A . n +A 1 136 LEU 136 136 136 LEU LEU A . n +A 1 137 ALA 137 137 137 ALA ALA A . n +A 1 138 PRO 138 138 138 PRO PRO A . n +A 1 139 CYS 139 139 139 CYS CYS A . n +A 1 140 SER 140 140 140 SER SER A . n +A 1 141 ARG 141 141 141 ARG ARG A . n +A 1 142 SER 142 142 142 SER SER A . n +A 1 143 THR 143 143 ? ? ? A . n +A 1 144 SER 144 144 ? ? ? A . n +A 1 145 GLU 145 145 145 GLU GLU A . n +A 1 146 SER 146 146 146 SER SER A . n +A 1 147 THR 147 147 147 THR THR A . n +A 1 148 ALA 148 148 148 ALA ALA A . n +A 1 149 ALA 149 149 149 ALA ALA A . n +A 1 150 LEU 150 150 150 LEU LEU A . n +A 1 151 GLY 151 151 151 GLY GLY A . n +A 1 152 CYS 152 152 152 CYS CYS A . n +A 1 153 LEU 153 153 153 LEU LEU A . n +A 1 154 VAL 154 154 154 VAL VAL A . n +A 1 155 LYS 155 155 155 LYS LYS A . n +A 1 156 ASP 156 156 156 ASP ASP A . n +A 1 157 TYR 157 157 157 TYR TYR A . n +A 1 158 PHE 158 158 158 PHE PHE A . n +A 1 159 PRO 159 159 159 PRO PRO A . n +A 1 160 GLU 160 160 160 GLU GLU A . n +A 1 161 PRO 161 161 161 PRO PRO A . n +A 1 162 VAL 162 162 162 VAL VAL A . n +A 1 163 THR 163 163 163 THR THR A . n +A 1 164 VAL 164 164 164 VAL VAL A . n +A 1 165 SER 165 165 165 SER SER A . n +A 1 166 TRP 166 166 166 TRP TRP A . n +A 1 167 ASN 167 167 167 ASN ASN A . n +A 1 168 SER 168 168 168 SER SER A . n +A 1 169 GLY 169 169 169 GLY GLY A . n +A 1 170 ALA 170 170 170 ALA ALA A . n +A 1 171 LEU 171 171 171 LEU LEU A . n +A 1 172 THR 172 172 172 THR THR A . n +A 1 173 SER 173 173 173 SER SER A . n +A 1 174 GLY 174 174 174 GLY GLY A . n +A 1 175 VAL 175 175 175 VAL VAL A . n +A 1 176 HIS 176 176 176 HIS HIS A . n +A 1 177 THR 177 177 177 THR THR A . n +A 1 178 PHE 178 178 178 PHE PHE A . n +A 1 179 PRO 179 179 179 PRO PRO A . n +A 1 180 ALA 180 180 180 ALA ALA A . n +A 1 181 VAL 181 181 181 VAL VAL A . n +A 1 182 LEU 182 182 182 LEU LEU A . n +A 1 183 GLN 183 183 183 GLN GLN A . n +A 1 184 SER 184 184 184 SER SER A . n +A 1 185 SER 185 185 185 SER SER A . n +A 1 186 GLY 186 186 186 GLY GLY A . n +A 1 187 LEU 187 187 187 LEU LEU A . n +A 1 188 TYR 188 188 188 TYR TYR A . n +A 1 189 SER 189 189 189 SER SER A . n +A 1 190 LEU 190 190 190 LEU LEU A . n +A 1 191 SER 191 191 191 SER SER A . n +A 1 192 SER 192 192 192 SER SER A . n +A 1 193 VAL 193 193 193 VAL VAL A . n +A 1 194 VAL 194 194 194 VAL VAL A . n +A 1 195 THR 195 195 195 THR THR A . n +A 1 196 VAL 196 196 196 VAL VAL A . n +A 1 197 PRO 197 197 197 PRO PRO A . n +A 1 198 SER 198 198 198 SER SER A . n +A 1 199 SER 199 199 199 SER SER A . n +A 1 200 SER 200 200 200 SER SER A . n +A 1 201 LEU 201 201 201 LEU LEU A . n +A 1 202 GLY 202 202 202 GLY GLY A . n +A 1 203 THR 203 203 203 THR THR A . n +A 1 204 LYS 204 204 204 LYS LYS A . n +A 1 205 THR 205 205 205 THR THR A . n +A 1 206 TYR 206 206 206 TYR TYR A . n +A 1 207 THR 207 207 207 THR THR A . n +A 1 208 CYS 208 208 208 CYS CYS A . n +A 1 209 ASN 209 209 209 ASN ASN A . n +A 1 210 VAL 210 210 210 VAL VAL A . n +A 1 211 ASP 211 211 211 ASP ASP A . n +A 1 212 HIS 212 212 212 HIS HIS A . n +A 1 213 LYS 213 213 213 LYS LYS A . n +A 1 214 PRO 214 214 214 PRO PRO A . n +A 1 215 SER 215 215 215 SER SER A . n +A 1 216 ASN 216 216 216 ASN ASN A . n +A 1 217 THR 217 217 217 THR THR A . n +A 1 218 LYS 218 218 218 LYS LYS A . n +A 1 219 VAL 219 219 219 VAL VAL A . n +A 1 220 ASP 220 220 220 ASP ASP A . n +A 1 221 LYS 221 221 221 LYS LYS A . n +A 1 222 ARG 222 222 222 ARG ARG A . n +A 1 223 VAL 223 223 223 VAL VAL A . n +A 1 224 GLU 224 224 224 GLU GLU A . n +A 1 225 SER 225 225 ? ? ? A . n +A 1 226 LYS 226 226 ? ? ? A . n +A 1 227 TYR 227 227 ? ? ? A . n +A 1 228 GLY 228 228 ? ? ? A . n +A 1 229 HIS 229 229 ? ? ? A . n +A 1 230 HIS 230 230 ? ? ? A . n +A 1 231 HIS 231 231 ? ? ? A . n +A 1 232 HIS 232 232 ? ? ? A . n +A 1 233 HIS 233 233 ? ? ? A . n +A 1 234 HIS 234 234 ? ? ? A . n +B 2 1 ASP 1 1 1 ASP ASP B . n +B 2 2 ILE 2 2 2 ILE ILE B . n +B 2 3 VAL 3 3 3 VAL VAL B . n +B 2 4 MET 4 4 4 MET MET B . n +B 2 5 THR 5 5 5 THR THR B . n +B 2 6 GLN 6 6 6 GLN GLN B . n +B 2 7 SER 7 7 7 SER SER B . n +B 2 8 PRO 8 8 8 PRO PRO B . n +B 2 9 LEU 9 9 9 LEU LEU B . n +B 2 10 SER 10 10 10 SER SER B . n +B 2 11 LEU 11 11 11 LEU LEU B . n +B 2 12 PRO 12 12 12 PRO PRO B . n +B 2 13 VAL 13 13 13 VAL VAL B . n +B 2 14 THR 14 14 14 THR THR B . n +B 2 15 PRO 15 15 15 PRO PRO B . n +B 2 16 GLY 16 16 16 GLY GLY B . n +B 2 17 GLU 17 17 17 GLU GLU B . n +B 2 18 PRO 18 18 18 PRO PRO B . n +B 2 19 ALA 19 19 19 ALA ALA B . n +B 2 20 SER 20 20 20 SER SER B . n +B 2 21 ILE 21 21 21 ILE ILE B . n +B 2 22 SER 22 22 22 SER SER B . n +B 2 23 CYS 23 23 23 CYS CYS B . n +B 2 24 ARG 24 24 24 ARG ARG B . n +B 2 25 SER 25 25 25 SER SER B . n +B 2 26 SER 26 26 26 SER SER B . n +B 2 27 GLN 27 27 27 GLN GLN B . n +B 2 28 SER 28 28 28 SER SER B . n +B 2 29 LEU 29 29 29 LEU LEU B . n +B 2 30 LEU 30 30 30 LEU LEU B . n +B 2 31 TYR 31 31 31 TYR TYR B . n +B 2 32 SER 32 32 32 SER SER B . n +B 2 33 ILE 33 33 33 ILE ILE B . n +B 2 34 GLY 34 34 34 GLY GLY B . n +B 2 35 TYR 35 35 35 TYR TYR B . n +B 2 36 ASN 36 36 36 ASN ASN B . n +B 2 37 TYR 37 37 37 TYR TYR B . n +B 2 38 LEU 38 38 38 LEU LEU B . n +B 2 39 ASP 39 39 39 ASP ASP B . n +B 2 40 TRP 40 40 40 TRP TRP B . n +B 2 41 TYR 41 41 41 TYR TYR B . n +B 2 42 LEU 42 42 42 LEU LEU B . n +B 2 43 GLN 43 43 43 GLN GLN B . n +B 2 44 LYS 44 44 44 LYS LYS B . n +B 2 45 SER 45 45 45 SER SER B . n +B 2 46 GLY 46 46 46 GLY GLY B . n +B 2 47 GLN 47 47 47 GLN GLN B . n +B 2 48 SER 48 48 48 SER SER B . n +B 2 49 PRO 49 49 49 PRO PRO B . n +B 2 50 GLN 50 50 50 GLN GLN B . n +B 2 51 LEU 51 51 51 LEU LEU B . n +B 2 52 LEU 52 52 52 LEU LEU B . n +B 2 53 ILE 53 53 53 ILE ILE B . n +B 2 54 TYR 54 54 54 TYR TYR B . n +B 2 55 LEU 55 55 55 LEU LEU B . n +B 2 56 GLY 56 56 56 GLY GLY B . n +B 2 57 SER 57 57 57 SER SER B . n +B 2 58 ASN 58 58 58 ASN ASN B . n +B 2 59 ARG 59 59 59 ARG ARG B . n +B 2 60 ALA 60 60 60 ALA ALA B . n +B 2 61 SER 61 61 61 SER SER B . n +B 2 62 GLY 62 62 62 GLY GLY B . n +B 2 63 VAL 63 63 63 VAL VAL B . n +B 2 64 PRO 64 64 64 PRO PRO B . n +B 2 65 ASP 65 65 65 ASP ASP B . n +B 2 66 ARG 66 66 66 ARG ARG B . n +B 2 67 PHE 67 67 67 PHE PHE B . n +B 2 68 SER 68 68 68 SER SER B . n +B 2 69 GLY 69 69 69 GLY GLY B . n +B 2 70 SER 70 70 70 SER SER B . n +B 2 71 GLY 71 71 71 GLY GLY B . n +B 2 72 SER 72 72 72 SER SER B . n +B 2 73 GLY 73 73 73 GLY GLY B . n +B 2 74 THR 74 74 74 THR THR B . n +B 2 75 ASP 75 75 75 ASP ASP B . n +B 2 76 PHE 76 76 76 PHE PHE B . n +B 2 77 THR 77 77 77 THR THR B . n +B 2 78 LEU 78 78 78 LEU LEU B . n +B 2 79 LYS 79 79 79 LYS LYS B . n +B 2 80 ILE 80 80 80 ILE ILE B . n +B 2 81 SER 81 81 81 SER SER B . n +B 2 82 ARG 82 82 82 ARG ARG B . n +B 2 83 VAL 83 83 83 VAL VAL B . n +B 2 84 GLU 84 84 84 GLU GLU B . n +B 2 85 ALA 85 85 85 ALA ALA B . n +B 2 86 GLU 86 86 86 GLU GLU B . n +B 2 87 ASP 87 87 87 ASP ASP B . n +B 2 88 VAL 88 88 88 VAL VAL B . n +B 2 89 GLY 89 89 89 GLY GLY B . n +B 2 90 PHE 90 90 90 PHE PHE B . n +B 2 91 TYR 91 91 91 TYR TYR B . n +B 2 92 TYR 92 92 92 TYR TYR B . n +B 2 93 CYS 93 93 93 CYS CYS B . n +B 2 94 MET 94 94 94 MET MET B . n +B 2 95 GLN 95 95 95 GLN GLN B . n +B 2 96 ALA 96 96 96 ALA ALA B . n +B 2 97 LEU 97 97 97 LEU LEU B . n +B 2 98 GLN 98 98 98 GLN GLN B . n +B 2 99 THR 99 99 99 THR THR B . n +B 2 100 PRO 100 100 100 PRO PRO B . n +B 2 101 TYR 101 101 101 TYR TYR B . n +B 2 102 THR 102 102 102 THR THR B . n +B 2 103 PHE 103 103 103 PHE PHE B . n +B 2 104 GLY 104 104 104 GLY GLY B . n +B 2 105 GLN 105 105 105 GLN GLN B . n +B 2 106 GLY 106 106 106 GLY GLY B . n +B 2 107 THR 107 107 107 THR THR B . n +B 2 108 LYS 108 108 108 LYS LYS B . n +B 2 109 LEU 109 109 109 LEU LEU B . n +B 2 110 GLU 110 110 110 GLU GLU B . n +B 2 111 ILE 111 111 111 ILE ILE B . n +B 2 112 LYS 112 112 112 LYS LYS B . n +B 2 113 ARG 113 113 113 ARG ARG B . n +B 2 114 THR 114 114 114 THR THR B . n +B 2 115 VAL 115 115 115 VAL VAL B . n +B 2 116 ALA 116 116 116 ALA ALA B . n +B 2 117 ALA 117 117 117 ALA ALA B . n +B 2 118 PRO 118 118 118 PRO PRO B . n +B 2 119 SER 119 119 119 SER SER B . n +B 2 120 VAL 120 120 120 VAL VAL B . n +B 2 121 PHE 121 121 121 PHE PHE B . n +B 2 122 ILE 122 122 122 ILE ILE B . n +B 2 123 PHE 123 123 123 PHE PHE B . n +B 2 124 PRO 124 124 124 PRO PRO B . n +B 2 125 PRO 125 125 125 PRO PRO B . n +B 2 126 SER 126 126 126 SER SER B . n +B 2 127 ASP 127 127 127 ASP ASP B . n +B 2 128 GLU 128 128 128 GLU GLU B . n +B 2 129 GLN 129 129 129 GLN GLN B . n +B 2 130 LEU 130 130 130 LEU LEU B . n +B 2 131 LYS 131 131 131 LYS LYS B . n +B 2 132 SER 132 132 132 SER SER B . n +B 2 133 GLY 133 133 133 GLY GLY B . n +B 2 134 THR 134 134 134 THR THR B . n +B 2 135 ALA 135 135 135 ALA ALA B . n +B 2 136 SER 136 136 136 SER SER B . n +B 2 137 VAL 137 137 137 VAL VAL B . n +B 2 138 VAL 138 138 138 VAL VAL B . n +B 2 139 CYS 139 139 139 CYS CYS B . n +B 2 140 LEU 140 140 140 LEU LEU B . n +B 2 141 LEU 141 141 141 LEU LEU B . n +B 2 142 ASN 142 142 142 ASN ASN B . n +B 2 143 ASN 143 143 143 ASN ASN B . n +B 2 144 PHE 144 144 144 PHE PHE B . n +B 2 145 TYR 145 145 145 TYR TYR B . n +B 2 146 PRO 146 146 146 PRO PRO B . n +B 2 147 ARG 147 147 147 ARG ARG B . n +B 2 148 GLU 148 148 148 GLU GLU B . n +B 2 149 ALA 149 149 149 ALA ALA B . n +B 2 150 LYS 150 150 150 LYS LYS B . n +B 2 151 VAL 151 151 151 VAL VAL B . n +B 2 152 GLN 152 152 152 GLN GLN B . n +B 2 153 TRP 153 153 153 TRP TRP B . n +B 2 154 LYS 154 154 154 LYS LYS B . n +B 2 155 VAL 155 155 155 VAL VAL B . n +B 2 156 ASP 156 156 156 ASP ASP B . n +B 2 157 ASN 157 157 157 ASN ASN B . n +B 2 158 ALA 158 158 158 ALA ALA B . n +B 2 159 LEU 159 159 159 LEU LEU B . n +B 2 160 GLN 160 160 160 GLN GLN B . n +B 2 161 SER 161 161 161 SER SER B . n +B 2 162 GLY 162 162 162 GLY GLY B . n +B 2 163 ASN 163 163 163 ASN ASN B . n +B 2 164 SER 164 164 164 SER SER B . n +B 2 165 GLN 165 165 165 GLN GLN B . n +B 2 166 GLU 166 166 166 GLU GLU B . n +B 2 167 SER 167 167 167 SER SER B . n +B 2 168 VAL 168 168 168 VAL VAL B . n +B 2 169 THR 169 169 169 THR THR B . n +B 2 170 GLU 170 170 170 GLU GLU B . n +B 2 171 GLN 171 171 171 GLN GLN B . n +B 2 172 ASP 172 172 172 ASP ASP B . n +B 2 173 SER 173 173 173 SER SER B . n +B 2 174 LYS 174 174 174 LYS LYS B . n +B 2 175 ASP 175 175 175 ASP ASP B . n +B 2 176 SER 176 176 176 SER SER B . n +B 2 177 THR 177 177 177 THR THR B . n +B 2 178 TYR 178 178 178 TYR TYR B . n +B 2 179 SER 179 179 179 SER SER B . n +B 2 180 LEU 180 180 180 LEU LEU B . n +B 2 181 SER 181 181 181 SER SER B . n +B 2 182 SER 182 182 182 SER SER B . n +B 2 183 THR 183 183 183 THR THR B . n +B 2 184 LEU 184 184 184 LEU LEU B . n +B 2 185 THR 185 185 185 THR THR B . n +B 2 186 LEU 186 186 186 LEU LEU B . n +B 2 187 SER 187 187 187 SER SER B . n +B 2 188 LYS 188 188 188 LYS LYS B . n +B 2 189 ALA 189 189 189 ALA ALA B . n +B 2 190 ASP 190 190 190 ASP ASP B . n +B 2 191 TYR 191 191 191 TYR TYR B . n +B 2 192 GLU 192 192 192 GLU GLU B . n +B 2 193 LYS 193 193 193 LYS LYS B . n +B 2 194 HIS 194 194 194 HIS HIS B . n +B 2 195 LYS 195 195 195 LYS LYS B . n +B 2 196 VAL 196 196 196 VAL VAL B . n +B 2 197 TYR 197 197 197 TYR TYR B . n +B 2 198 ALA 198 198 198 ALA ALA B . n +B 2 199 CYS 199 199 199 CYS CYS B . n +B 2 200 GLU 200 200 200 GLU GLU B . n +B 2 201 VAL 201 201 201 VAL VAL B . n +B 2 202 THR 202 202 202 THR THR B . n +B 2 203 GLN 203 203 203 GLN GLN B . n +B 2 204 GLY 204 204 204 GLY GLY B . n +B 2 205 THR 205 205 205 THR THR B . n +B 2 206 THR 206 206 206 THR THR B . n +B 2 207 SER 207 207 207 SER SER B . n +B 2 208 VAL 208 208 208 VAL VAL B . n +B 2 209 THR 209 209 209 THR THR B . n +B 2 210 LYS 210 210 210 LYS LYS B . n +B 2 211 SER 211 211 211 SER SER B . n +B 2 212 PHE 212 212 212 PHE PHE B . n +B 2 213 ASN 213 213 213 ASN ASN B . n +B 2 214 ARG 214 214 214 ARG ARG B . n +B 2 215 GLY 215 215 215 GLY GLY B . n +B 2 216 GLU 216 216 216 GLU GLU B . n +B 2 217 CYS 217 217 ? ? ? B . n +C 3 1 MET 1 1 1 MET MET C . n +C 3 2 LYS 2 2 2 LYS LYS C . n +C 3 3 VAL 3 3 3 VAL VAL C . n +C 3 4 LEU 4 4 4 LEU LEU C . n +C 3 5 GLN 5 5 5 GLN GLN C . n +C 3 6 GLU 6 6 6 GLU GLU C . n +C 3 7 PRO 7 7 7 PRO PRO C . n +C 3 8 THR 8 8 8 THR THR C . n +C 3 9 CYS 9 9 9 CYS CYS C . n +C 3 10 VAL 10 10 10 VAL VAL C . n +C 3 11 SER 11 11 11 SER SER C . n +C 3 12 ASP 12 12 12 ASP ASP C . n +C 3 13 TYR 13 13 13 TYR TYR C . n +C 3 14 MET 14 14 14 MET MET C . n +C 3 15 SER 15 15 15 SER SER C . n +C 3 16 ILE 16 16 16 ILE ILE C . n +C 3 17 SER 17 17 17 SER SER C . n +C 3 18 THR 18 18 18 THR THR C . n +C 3 19 CYS 19 19 19 CYS CYS C . n +C 3 20 GLU 20 20 20 GLU GLU C . n +C 3 21 TRP 21 21 21 TRP TRP C . n +C 3 22 LYS 22 22 22 LYS LYS C . n +C 3 23 MET 23 23 23 MET MET C . n +C 3 24 ASN 24 24 24 ASN ASN C . n +C 3 25 GLY 25 25 25 GLY GLY C . n +C 3 26 PRO 26 26 26 PRO PRO C . n +C 3 27 THR 27 27 27 THR THR C . n +C 3 28 ASN 28 28 28 ASN ASN C . n +C 3 29 CYS 29 29 29 CYS CYS C . n +C 3 30 SER 30 30 30 SER SER C . n +C 3 31 THR 31 31 31 THR THR C . n +C 3 32 GLU 32 32 32 GLU GLU C . n +C 3 33 LEU 33 33 33 LEU LEU C . n +C 3 34 ARG 34 34 34 ARG ARG C . n +C 3 35 LEU 35 35 35 LEU LEU C . n +C 3 36 LEU 36 36 36 LEU LEU C . n +C 3 37 TYR 37 37 37 TYR TYR C . n +C 3 38 GLN 38 38 38 GLN GLN C . n +C 3 39 LEU 39 39 39 LEU LEU C . n +C 3 40 VAL 40 40 40 VAL VAL C . n +C 3 41 PHE 41 41 41 PHE PHE C . n +C 3 42 LEU 42 42 42 LEU LEU C . n +C 3 43 LEU 43 43 43 LEU LEU C . n +C 3 44 SER 44 44 44 SER SER C . n +C 3 45 GLU 45 45 45 GLU GLU C . n +C 3 46 ALA 46 46 46 ALA ALA C . n +C 3 47 HIS 47 47 47 HIS HIS C . n +C 3 48 THR 48 48 48 THR THR C . n +C 3 49 CYS 49 49 49 CYS CYS C . n +C 3 50 ILE 50 50 50 ILE ILE C . n +C 3 51 PRO 51 51 51 PRO PRO C . n +C 3 52 GLU 52 52 52 GLU GLU C . n +C 3 53 ASN 53 53 53 ASN ASN C . n +C 3 54 ASN 54 54 54 ASN ASN C . n +C 3 55 GLY 55 55 55 GLY GLY C . n +C 3 56 GLY 56 56 56 GLY GLY C . n +C 3 57 ALA 57 57 57 ALA ALA C . n +C 3 58 GLY 58 58 58 GLY GLY C . n +C 3 59 CYS 59 59 59 CYS CYS C . n +C 3 60 VAL 60 60 60 VAL VAL C . n +C 3 61 CYS 61 61 61 CYS CYS C . n +C 3 62 HIS 62 62 62 HIS HIS C . n +C 3 63 LEU 63 63 63 LEU LEU C . n +C 3 64 LEU 64 64 64 LEU LEU C . n +C 3 65 MET 65 65 65 MET MET C . n +C 3 66 ASP 66 66 66 ASP ASP C . n +C 3 67 ASP 67 67 67 ASP ASP C . n +C 3 68 VAL 68 68 68 VAL VAL C . n +C 3 69 VAL 69 69 69 VAL VAL C . n +C 3 70 SER 70 70 70 SER SER C . n +C 3 71 ALA 71 71 71 ALA ALA C . n +C 3 72 ASP 72 72 72 ASP ASP C . n +C 3 73 ASN 73 73 73 ASN ASN C . n +C 3 74 TYR 74 74 74 TYR TYR C . n +C 3 75 THR 75 75 75 THR THR C . n +C 3 76 LEU 76 76 76 LEU LEU C . n +C 3 77 ASP 77 77 77 ASP ASP C . n +C 3 78 LEU 78 78 78 LEU LEU C . n +C 3 79 TRP 79 79 79 TRP TRP C . n +C 3 80 ALA 80 80 80 ALA ALA C . n +C 3 81 GLY 81 81 81 GLY GLY C . n +C 3 82 GLN 82 82 82 GLN GLN C . n +C 3 83 GLN 83 83 83 GLN GLN C . n +C 3 84 LEU 84 84 84 LEU LEU C . n +C 3 85 LEU 85 85 85 LEU LEU C . n +C 3 86 TRP 86 86 86 TRP TRP C . n +C 3 87 LYS 87 87 87 LYS LYS C . n +C 3 88 GLY 88 88 88 GLY GLY C . n +C 3 89 SER 89 89 89 SER SER C . n +C 3 90 PHE 90 90 90 PHE PHE C . n +C 3 91 LYS 91 91 91 LYS LYS C . n +C 3 92 PRO 92 92 92 PRO PRO C . n +C 3 93 SER 93 93 93 SER SER C . n +C 3 94 GLU 94 94 94 GLU GLU C . n +C 3 95 HIS 95 95 95 HIS HIS C . n +C 3 96 VAL 96 96 96 VAL VAL C . n +C 3 97 LYS 97 97 97 LYS LYS C . n +C 3 98 PRO 98 98 98 PRO PRO C . n +C 3 99 ARG 99 99 99 ARG ARG C . n +C 3 100 ALA 100 100 100 ALA ALA C . n +C 3 101 PRO 101 101 101 PRO PRO C . n +C 3 102 GLY 102 102 102 GLY GLY C . n +C 3 103 ASN 103 103 103 ASN ASN C . n +C 3 104 LEU 104 104 104 LEU LEU C . n +C 3 105 THR 105 105 105 THR THR C . n +C 3 106 VAL 106 106 106 VAL VAL C . n +C 3 107 HIS 107 107 107 HIS HIS C . n +C 3 108 THR 108 108 ? ? ? C . n +C 3 109 ASN 109 109 ? ? ? C . n +C 3 110 VAL 110 110 ? ? ? C . n +C 3 111 SER 111 111 ? ? ? C . n +C 3 112 ASP 112 112 112 ASP ASP C . n +C 3 113 THR 113 113 113 THR THR C . n +C 3 114 LEU 114 114 114 LEU LEU C . n +C 3 115 LEU 115 115 115 LEU LEU C . n +C 3 116 LEU 116 116 116 LEU LEU C . n +C 3 117 THR 117 117 117 THR THR C . n +C 3 118 TRP 118 118 118 TRP TRP C . n +C 3 119 SER 119 119 119 SER SER C . n +C 3 120 ASN 120 120 120 ASN ASN C . n +C 3 121 PRO 121 121 121 PRO PRO C . n +C 3 122 TYR 122 122 122 TYR TYR C . n +C 3 123 PRO 123 123 123 PRO PRO C . n +C 3 124 PRO 124 124 124 PRO PRO C . n +C 3 125 ASP 125 125 125 ASP ASP C . n +C 3 126 ASN 126 126 126 ASN ASN C . n +C 3 127 TYR 127 127 127 TYR TYR C . n +C 3 128 LEU 128 128 128 LEU LEU C . n +C 3 129 TYR 129 129 129 TYR TYR C . n +C 3 130 ASN 130 130 130 ASN ASN C . n +C 3 131 HIS 131 131 131 HIS HIS C . n +C 3 132 LEU 132 132 132 LEU LEU C . n +C 3 133 THR 133 133 133 THR THR C . n +C 3 134 TYR 134 134 134 TYR TYR C . n +C 3 135 ALA 135 135 135 ALA ALA C . n +C 3 136 VAL 136 136 136 VAL VAL C . n +C 3 137 ASN 137 137 137 ASN ASN C . n +C 3 138 ILE 138 138 138 ILE ILE C . n +C 3 139 TRP 139 139 ? ? ? C . n +C 3 140 SER 140 140 ? ? ? C . n +C 3 141 GLU 141 141 ? ? ? C . n +C 3 142 ASN 142 142 ? ? ? C . n +C 3 143 ASP 143 143 ? ? ? C . n +C 3 144 PRO 144 144 144 PRO PRO C . n +C 3 145 ALA 145 145 145 ALA ALA C . n +C 3 146 ASP 146 146 146 ASP ASP C . n +C 3 147 PHE 147 147 147 PHE PHE C . n +C 3 148 ARG 148 148 148 ARG ARG C . n +C 3 149 ILE 149 149 149 ILE ILE C . n +C 3 150 TYR 150 150 150 TYR TYR C . n +C 3 151 ASN 151 151 151 ASN ASN C . n +C 3 152 VAL 152 152 152 VAL VAL C . n +C 3 153 THR 153 153 153 THR THR C . n +C 3 154 TYR 154 154 154 TYR TYR C . n +C 3 155 LEU 155 155 155 LEU LEU C . n +C 3 156 GLU 156 156 156 GLU GLU C . n +C 3 157 PRO 157 157 157 PRO PRO C . n +C 3 158 SER 158 158 158 SER SER C . n +C 3 159 LEU 159 159 159 LEU LEU C . n +C 3 160 ARG 160 160 160 ARG ARG C . n +C 3 161 ILE 161 161 161 ILE ILE C . n +C 3 162 ALA 162 162 162 ALA ALA C . n +C 3 163 ALA 163 163 163 ALA ALA C . n +C 3 164 SER 164 164 ? ? ? C . n +C 3 165 THR 165 165 ? ? ? C . n +C 3 166 LEU 166 166 ? ? ? C . n +C 3 167 LYS 167 167 ? ? ? C . n +C 3 168 SER 168 168 ? ? ? C . n +C 3 169 GLY 169 169 ? ? ? C . n +C 3 170 ILE 170 170 ? ? ? C . n +C 3 171 SER 171 171 ? ? ? C . n +C 3 172 TYR 172 172 ? ? ? C . n +C 3 173 ARG 173 173 173 ARG ARG C . n +C 3 174 ALA 174 174 174 ALA ALA C . n +C 3 175 ARG 175 175 175 ARG ARG C . n +C 3 176 VAL 176 176 176 VAL VAL C . n +C 3 177 ARG 177 177 177 ARG ARG C . n +C 3 178 ALA 178 178 178 ALA ALA C . n +C 3 179 TRP 179 179 179 TRP TRP C . n +C 3 180 ALA 180 180 180 ALA ALA C . n +C 3 181 GLN 181 181 181 GLN GLN C . n +C 3 182 LEU 182 182 182 LEU LEU C . n +C 3 183 TYR 183 183 183 TYR TYR C . n +C 3 184 ASN 184 184 184 ASN ASN C . n +C 3 185 THR 185 185 185 THR THR C . n +C 3 186 THR 186 186 186 THR THR C . n +C 3 187 TRP 187 187 187 TRP TRP C . n +C 3 188 SER 188 188 188 SER SER C . n +C 3 189 GLU 189 189 189 GLU GLU C . n +C 3 190 TRP 190 190 190 TRP TRP C . n +C 3 191 SER 191 191 191 SER SER C . n +C 3 192 PRO 192 192 192 PRO PRO C . n +C 3 193 SER 193 193 193 SER SER C . n +C 3 194 THR 194 194 194 THR THR C . n +C 3 195 LYS 195 195 195 LYS LYS C . n +C 3 196 TRP 196 196 196 TRP TRP C . n +C 3 197 HIS 197 197 ? ? ? C . n +C 3 198 ASN 198 198 ? ? ? C . n +C 3 199 SER 199 199 ? ? ? C . n +C 3 200 TYR 200 200 ? ? ? C . n +C 3 201 ARG 201 201 ? ? ? C . n +C 3 202 GLU 202 202 ? ? ? C . n +C 3 203 PRO 203 203 ? ? ? C . n +C 3 204 PHE 204 204 ? ? ? C . n +C 3 205 GLU 205 205 ? ? ? C . n +C 3 206 GLN 206 206 ? ? ? C . n +C 3 207 HIS 207 207 ? ? ? C . n +C 3 208 GLY 208 208 ? ? ? C . n +C 3 209 GLY 209 209 ? ? ? C . n +C 3 210 GLY 210 210 ? ? ? C . n +C 3 211 GLY 211 211 ? ? ? C . n +C 3 212 SER 212 212 ? ? ? C . n +C 3 213 HIS 213 213 ? ? ? C . n +C 3 214 HIS 214 214 ? ? ? C . n +C 3 215 HIS 215 215 ? ? ? C . n +C 3 216 HIS 216 216 ? ? ? C . n +C 3 217 HIS 217 217 ? ? ? C . n +C 3 218 HIS 218 218 ? ? ? C . n +# +loop_ +_pdbx_branch_scheme.asym_id +_pdbx_branch_scheme.entity_id +_pdbx_branch_scheme.mon_id +_pdbx_branch_scheme.num +_pdbx_branch_scheme.pdb_asym_id +_pdbx_branch_scheme.pdb_mon_id +_pdbx_branch_scheme.pdb_seq_num +_pdbx_branch_scheme.auth_asym_id +_pdbx_branch_scheme.auth_mon_id +_pdbx_branch_scheme.auth_seq_num +_pdbx_branch_scheme.hetero +D 4 NAG 1 D NAG 1 K NAG 1 n +D 4 NAG 2 D NAG 2 K NAG 2 n +E 4 NAG 1 E NAG 1 K NAG 4 n +E 4 NAG 2 E NAG 2 K NAG 5 n +# +_pdbx_entity_instance_feature.ordinal 1 +_pdbx_entity_instance_feature.comp_id NAG +_pdbx_entity_instance_feature.asym_id ? +_pdbx_entity_instance_feature.seq_num ? +_pdbx_entity_instance_feature.auth_comp_id NAG +_pdbx_entity_instance_feature.auth_asym_id ? +_pdbx_entity_instance_feature.auth_seq_num ? +_pdbx_entity_instance_feature.feature_type 'SUBJECT OF INVESTIGATION' +_pdbx_entity_instance_feature.details ? +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +F 5 NAG 1 301 3 NAG NAG C . +G 6 HOH 1 301 13 HOH HOH A . +G 6 HOH 2 302 16 HOH HOH A . +G 6 HOH 3 303 24 HOH HOH A . +G 6 HOH 4 304 26 HOH HOH A . +G 6 HOH 5 305 10 HOH HOH A . +G 6 HOH 6 306 23 HOH HOH A . +H 6 HOH 1 301 15 HOH HOH B . +H 6 HOH 2 302 20 HOH HOH B . +H 6 HOH 3 303 25 HOH HOH B . +H 6 HOH 4 304 3 HOH HOH B . +H 6 HOH 5 305 22 HOH HOH B . +H 6 HOH 6 306 2 HOH HOH B . +H 6 HOH 7 307 12 HOH HOH B . +H 6 HOH 8 308 9 HOH HOH B . +H 6 HOH 9 309 11 HOH HOH B . +H 6 HOH 10 310 4 HOH HOH B . +H 6 HOH 11 311 21 HOH HOH B . +I 6 HOH 1 401 14 HOH HOH C . +I 6 HOH 2 402 17 HOH HOH C . +I 6 HOH 3 403 8 HOH HOH C . +I 6 HOH 4 404 5 HOH HOH C . +I 6 HOH 5 405 18 HOH HOH C . +I 6 HOH 6 406 1 HOH HOH C . +I 6 HOH 7 407 7 HOH HOH C . +I 6 HOH 8 408 6 HOH HOH C . +I 6 HOH 9 409 19 HOH HOH C . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 A GLU 1 ? CG ? A GLU 1 CG +2 1 Y 1 A GLU 1 ? CD ? A GLU 1 CD +3 1 Y 1 A GLU 1 ? OE1 ? A GLU 1 OE1 +4 1 Y 1 A GLU 1 ? OE2 ? A GLU 1 OE2 +5 1 Y 1 A GLN 13 ? CG ? A GLN 13 CG +6 1 Y 1 A GLN 13 ? CD ? A GLN 13 CD +7 1 Y 1 A GLN 13 ? OE1 ? A GLN 13 OE1 +8 1 Y 1 A GLN 13 ? NE2 ? A GLN 13 NE2 +9 1 Y 1 A LYS 76 ? CG ? A LYS 76 CG +10 1 Y 1 A LYS 76 ? CD ? A LYS 76 CD +11 1 Y 1 A LYS 76 ? CE ? A LYS 76 CE +12 1 Y 1 A LYS 76 ? NZ ? A LYS 76 NZ +13 1 Y 1 A ARG 87 ? CG ? A ARG 87 CG +14 1 Y 1 A ARG 87 ? CD ? A ARG 87 CD +15 1 Y 1 A ARG 87 ? NE ? A ARG 87 NE +16 1 Y 1 A ARG 87 ? CZ ? A ARG 87 CZ +17 1 Y 1 A ARG 87 ? NH1 ? A ARG 87 NH1 +18 1 Y 1 A ARG 87 ? NH2 ? A ARG 87 NH2 +19 1 Y 1 A ILE 105 ? CG1 ? A ILE 105 CG1 +20 1 Y 1 A ILE 105 ? CG2 ? A ILE 105 CG2 +21 1 Y 1 A ILE 105 ? CD1 ? A ILE 105 CD1 +22 1 Y 1 A LYS 129 ? CG ? A LYS 129 CG +23 1 Y 1 A LYS 129 ? CD ? A LYS 129 CD +24 1 Y 1 A LYS 129 ? CE ? A LYS 129 CE +25 1 Y 1 A LYS 129 ? NZ ? A LYS 129 NZ +26 1 Y 1 A ARG 141 ? CG ? A ARG 141 CG +27 1 Y 1 A ARG 141 ? CD ? A ARG 141 CD +28 1 Y 1 A ARG 141 ? NE ? A ARG 141 NE +29 1 Y 1 A ARG 141 ? CZ ? A ARG 141 CZ +30 1 Y 1 A ARG 141 ? NH1 ? A ARG 141 NH1 +31 1 Y 1 A ARG 141 ? NH2 ? A ARG 141 NH2 +32 1 Y 1 A SER 142 ? OG ? A SER 142 OG +33 1 Y 1 A SER 146 ? OG ? A SER 146 OG +34 1 Y 1 A THR 203 ? OG1 ? A THR 203 OG1 +35 1 Y 1 A THR 203 ? CG2 ? A THR 203 CG2 +36 1 Y 1 A ARG 222 ? CG ? A ARG 222 CG +37 1 Y 1 A ARG 222 ? CD ? A ARG 222 CD +38 1 Y 1 A ARG 222 ? NE ? A ARG 222 NE +39 1 Y 1 A ARG 222 ? CZ ? A ARG 222 CZ +40 1 Y 1 A ARG 222 ? NH1 ? A ARG 222 NH1 +41 1 Y 1 A ARG 222 ? NH2 ? A ARG 222 NH2 +42 1 Y 1 B VAL 83 ? CG1 ? B VAL 83 CG1 +43 1 Y 1 B VAL 83 ? CG2 ? B VAL 83 CG2 +44 1 Y 1 B ARG 147 ? CG ? B ARG 147 CG +45 1 Y 1 B ARG 147 ? CD ? B ARG 147 CD +46 1 Y 1 B ARG 147 ? NE ? B ARG 147 NE +47 1 Y 1 B ARG 147 ? CZ ? B ARG 147 CZ +48 1 Y 1 B ARG 147 ? NH1 ? B ARG 147 NH1 +49 1 Y 1 B ARG 147 ? NH2 ? B ARG 147 NH2 +50 1 Y 1 B GLN 152 ? CG ? B GLN 152 CG +51 1 Y 1 B GLN 152 ? CD ? B GLN 152 CD +52 1 Y 1 B GLN 152 ? OE1 ? B GLN 152 OE1 +53 1 Y 1 B GLN 152 ? NE2 ? B GLN 152 NE2 +54 1 Y 1 B ASN 157 ? CG ? B ASN 157 CG +55 1 Y 1 B ASN 157 ? OD1 ? B ASN 157 OD1 +56 1 Y 1 B ASN 157 ? ND2 ? B ASN 157 ND2 +57 1 Y 1 B GLU 170 ? CG ? B GLU 170 CG +58 1 Y 1 B GLU 170 ? CD ? B GLU 170 CD +59 1 Y 1 B GLU 170 ? OE1 ? B GLU 170 OE1 +60 1 Y 1 B GLU 170 ? OE2 ? B GLU 170 OE2 +61 1 Y 1 B LYS 174 ? CG ? B LYS 174 CG +62 1 Y 1 B LYS 174 ? CD ? B LYS 174 CD +63 1 Y 1 B LYS 174 ? CE ? B LYS 174 CE +64 1 Y 1 B LYS 174 ? NZ ? B LYS 174 NZ +65 1 Y 1 B LYS 193 ? CG ? B LYS 193 CG +66 1 Y 1 B LYS 193 ? CD ? B LYS 193 CD +67 1 Y 1 B LYS 193 ? CE ? B LYS 193 CE +68 1 Y 1 B LYS 193 ? NZ ? B LYS 193 NZ +69 1 Y 1 B LYS 195 ? CG ? B LYS 195 CG +70 1 Y 1 B LYS 195 ? CD ? B LYS 195 CD +71 1 Y 1 B LYS 195 ? CE ? B LYS 195 CE +72 1 Y 1 B LYS 195 ? NZ ? B LYS 195 NZ +73 1 Y 1 B VAL 201 ? CG1 ? B VAL 201 CG1 +74 1 Y 1 B VAL 201 ? CG2 ? B VAL 201 CG2 +75 1 Y 1 B GLU 216 ? CG ? B GLU 216 CG +76 1 Y 1 B GLU 216 ? CD ? B GLU 216 CD +77 1 Y 1 B GLU 216 ? OE1 ? B GLU 216 OE1 +78 1 Y 1 B GLU 216 ? OE2 ? B GLU 216 OE2 +79 1 Y 1 C GLU 52 ? CG ? C GLU 52 CG +80 1 Y 1 C GLU 52 ? CD ? C GLU 52 CD +81 1 Y 1 C GLU 52 ? OE1 ? C GLU 52 OE1 +82 1 Y 1 C GLU 52 ? OE2 ? C GLU 52 OE2 +83 1 Y 1 C VAL 106 ? CG1 ? C VAL 106 CG1 +84 1 Y 1 C VAL 106 ? CG2 ? C VAL 106 CG2 +85 1 Y 1 C HIS 107 ? CG ? C HIS 107 CG +86 1 Y 1 C HIS 107 ? ND1 ? C HIS 107 ND1 +87 1 Y 1 C HIS 107 ? CD2 ? C HIS 107 CD2 +88 1 Y 1 C HIS 107 ? CE1 ? C HIS 107 CE1 +89 1 Y 1 C HIS 107 ? NE2 ? C HIS 107 NE2 +90 1 Y 1 C ASP 146 ? CG ? C ASP 146 CG +91 1 Y 1 C ASP 146 ? OD1 ? C ASP 146 OD1 +92 1 Y 1 C ASP 146 ? OD2 ? C ASP 146 OD2 +93 1 Y 1 C ARG 148 ? CG ? C ARG 148 CG +94 1 Y 1 C ARG 148 ? CD ? C ARG 148 CD +95 1 Y 1 C ARG 148 ? NE ? C ARG 148 NE +96 1 Y 1 C ARG 148 ? CZ ? C ARG 148 CZ +97 1 Y 1 C ARG 148 ? NH1 ? C ARG 148 NH1 +98 1 Y 1 C ARG 148 ? NH2 ? C ARG 148 NH2 +99 1 Y 1 C ARG 160 ? NE ? C ARG 160 NE +100 1 Y 1 C ARG 160 ? CZ ? C ARG 160 CZ +101 1 Y 1 C ARG 160 ? NH1 ? C ARG 160 NH1 +102 1 Y 1 C ARG 160 ? NH2 ? C ARG 160 NH2 +103 1 Y 1 C ARG 173 ? CG ? C ARG 173 CG +104 1 Y 1 C ARG 173 ? CD ? C ARG 173 CD +105 1 Y 1 C ARG 173 ? NE ? C ARG 173 NE +106 1 Y 1 C ARG 173 ? CZ ? C ARG 173 CZ +107 1 Y 1 C ARG 173 ? NH1 ? C ARG 173 NH1 +108 1 Y 1 C ARG 173 ? NH2 ? C ARG 173 NH2 +109 1 Y 1 C ARG 175 ? CG ? C ARG 175 CG +110 1 Y 1 C ARG 175 ? CD ? C ARG 175 CD +111 1 Y 1 C ARG 175 ? NE ? C ARG 175 NE +112 1 Y 1 C ARG 175 ? CZ ? C ARG 175 CZ +113 1 Y 1 C ARG 175 ? NH1 ? C ARG 175 NH1 +114 1 Y 1 C ARG 175 ? NH2 ? C ARG 175 NH2 +115 1 Y 1 C LYS 195 ? CG ? C LYS 195 CG +116 1 Y 1 C LYS 195 ? CD ? C LYS 195 CD +117 1 Y 1 C LYS 195 ? CE ? C LYS 195 CE +118 1 Y 1 C LYS 195 ? NZ ? C LYS 195 NZ +119 1 Y 1 C TRP 196 ? CG ? C TRP 196 CG +120 1 Y 1 C TRP 196 ? CD1 ? C TRP 196 CD1 +121 1 Y 1 C TRP 196 ? CD2 ? C TRP 196 CD2 +122 1 Y 1 C TRP 196 ? NE1 ? C TRP 196 NE1 +123 1 Y 1 C TRP 196 ? CE2 ? C TRP 196 CE2 +124 1 Y 1 C TRP 196 ? CE3 ? C TRP 196 CE3 +125 1 Y 1 C TRP 196 ? CZ2 ? C TRP 196 CZ2 +126 1 Y 1 C TRP 196 ? CZ3 ? C TRP 196 CZ3 +127 1 Y 1 C TRP 196 ? CH2 ? C TRP 196 CH2 +# +loop_ +_software.citation_id +_software.classification +_software.compiler_name +_software.compiler_version +_software.contact_author +_software.contact_author_email +_software.date +_software.description +_software.dependencies +_software.hardware +_software.language +_software.location +_software.mods +_software.name +_software.os +_software.os_version +_software.type +_software.version +_software.pdbx_ordinal +? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? 0.7.4 1 +? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0103 2 +? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.25 3 +? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? MOSFLM ? ? ? . 4 +? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 5 +# +_cell.angle_alpha 90.000 +_cell.angle_alpha_esd ? +_cell.angle_beta 90.000 +_cell.angle_beta_esd ? +_cell.angle_gamma 90.000 +_cell.angle_gamma_esd ? +_cell.entry_id 6WGL +_cell.details ? +_cell.formula_units_Z ? +_cell.length_a 73.490 +_cell.length_a_esd ? +_cell.length_b 73.490 +_cell.length_b_esd ? +_cell.length_c 412.441 +_cell.length_c_esd ? +_cell.volume ? +_cell.volume_esd ? +_cell.Z_PDB 8 +_cell.reciprocal_angle_alpha ? +_cell.reciprocal_angle_beta ? +_cell.reciprocal_angle_gamma ? +_cell.reciprocal_angle_alpha_esd ? +_cell.reciprocal_angle_beta_esd ? +_cell.reciprocal_angle_gamma_esd ? +_cell.reciprocal_length_a ? +_cell.reciprocal_length_b ? +_cell.reciprocal_length_c ? +_cell.reciprocal_length_a_esd ? +_cell.reciprocal_length_b_esd ? +_cell.reciprocal_length_c_esd ? +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 6WGL +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 96 +_symmetry.space_group_name_Hall ? +_symmetry.space_group_name_H-M 'P 43 21 2' +_symmetry.pdbx_full_space_group_name_H-M ? +# +_exptl.absorpt_coefficient_mu ? +_exptl.absorpt_correction_T_max ? +_exptl.absorpt_correction_T_min ? +_exptl.absorpt_correction_type ? +_exptl.absorpt_process_details ? +_exptl.entry_id 6WGL +_exptl.crystals_number 1 +_exptl.details ? +_exptl.method 'X-RAY DIFFRACTION' +_exptl.method_details ? +# +_exptl_crystal.colour ? +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_Matthews 3.77 +_exptl_crystal.density_method ? +_exptl_crystal.density_percent_sol 67.33 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.id 1 +_exptl_crystal.preparation ? +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.colour_lustre ? +_exptl_crystal.colour_modifier ? +_exptl_crystal.colour_primary ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_esd ? +_exptl_crystal.density_meas_gt ? +_exptl_crystal.density_meas_lt ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_meas_temp_esd ? +_exptl_crystal.density_meas_temp_gt ? +_exptl_crystal.density_meas_temp_lt ? +_exptl_crystal.pdbx_crystal_image_url ? +_exptl_crystal.pdbx_crystal_image_format ? +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +# +_exptl_crystal_grow.apparatus ? +_exptl_crystal_grow.atmosphere ? +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.details ? +_exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' +_exptl_crystal_grow.method_ref ? +_exptl_crystal_grow.pH ? +_exptl_crystal_grow.pressure ? +_exptl_crystal_grow.pressure_esd ? +_exptl_crystal_grow.seeding ? +_exptl_crystal_grow.seeding_ref ? +_exptl_crystal_grow.temp 294 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.temp_esd ? +_exptl_crystal_grow.time ? +_exptl_crystal_grow.pdbx_details '100mM Hepes pH 7.5, 25% PEG MME 550' +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.ambient_environment ? +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.ambient_temp_esd ? +_diffrn.crystal_id 1 +_diffrn.crystal_support ? +_diffrn.crystal_treatment ? +_diffrn.details ? +_diffrn.id 1 +_diffrn.ambient_pressure ? +_diffrn.ambient_pressure_esd ? +_diffrn.ambient_pressure_gt ? +_diffrn.ambient_pressure_lt ? +_diffrn.ambient_temp_gt ? +_diffrn.ambient_temp_lt ? +_diffrn.pdbx_serial_crystal_experiment N +# +_diffrn_detector.details ? +_diffrn_detector.detector CCD +_diffrn_detector.diffrn_id 1 +_diffrn_detector.type 'RAYONIX MX225-HS' +_diffrn_detector.area_resol_mean ? +_diffrn_detector.dtime ? +_diffrn_detector.pdbx_frames_total ? +_diffrn_detector.pdbx_collection_time_total ? +_diffrn_detector.pdbx_collection_date 2019-02-28 +_diffrn_detector.pdbx_frequency ? +# +_diffrn_radiation.collimation ? +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.filter_edge ? +_diffrn_radiation.inhomogeneity ? +_diffrn_radiation.monochromator ? +_diffrn_radiation.polarisn_norm ? +_diffrn_radiation.polarisn_ratio ? +_diffrn_radiation.probe ? +_diffrn_radiation.type ? +_diffrn_radiation.xray_symbol ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_wavelength_list ? +_diffrn_radiation.pdbx_wavelength ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_analyzer ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 0.9793 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.current ? +_diffrn_source.details ? +_diffrn_source.diffrn_id 1 +_diffrn_source.power ? +_diffrn_source.size ? +_diffrn_source.source SYNCHROTRON +_diffrn_source.target ? +_diffrn_source.type 'APS BEAMLINE 31-ID' +_diffrn_source.voltage ? +_diffrn_source.take-off_angle ? +_diffrn_source.pdbx_wavelength_list 0.9793 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_beamline 31-ID +_diffrn_source.pdbx_synchrotron_site APS +# +_reflns.B_iso_Wilson_estimate ? +_reflns.entry_id 6WGL +_reflns.data_reduction_details ? +_reflns.data_reduction_method ? +_reflns.d_resolution_high 2.820 +_reflns.d_resolution_low 103.110 +_reflns.details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.number_all ? +_reflns.number_obs 28706 +_reflns.observed_criterion ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.observed_criterion_I_max ? +_reflns.observed_criterion_I_min ? +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.percent_possible_obs 99.900 +_reflns.R_free_details ? +_reflns.Rmerge_F_all ? +_reflns.Rmerge_F_obs ? +_reflns.Friedel_coverage ? +_reflns.number_gt ? +_reflns.threshold_expression ? +_reflns.pdbx_redundancy 21.500 +_reflns.pdbx_Rmerge_I_obs 0.140 +_reflns.pdbx_Rmerge_I_all ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_av_sigmaI ? +_reflns.pdbx_netI_over_sigmaI 18.100 +_reflns.pdbx_res_netI_over_av_sigmaI_2 ? +_reflns.pdbx_res_netI_over_sigmaI_2 ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects 64 +_reflns.pdbx_d_res_high_opt ? +_reflns.pdbx_d_res_low_opt ? +_reflns.pdbx_d_res_opt_method ? +_reflns.phase_calculation_details ? +_reflns.pdbx_Rrim_I_all 0.143 +_reflns.pdbx_Rpim_I_all 0.031 +_reflns.pdbx_d_opt ? +_reflns.pdbx_number_measured_all 617796 +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.pdbx_CC_half 0.988 +_reflns.pdbx_CC_star ? +_reflns.pdbx_R_split ? +# +loop_ +_reflns_shell.d_res_high +_reflns_shell.d_res_low +_reflns_shell.meanI_over_sigI_all +_reflns_shell.meanI_over_sigI_obs +_reflns_shell.number_measured_all +_reflns_shell.number_measured_obs +_reflns_shell.number_possible +_reflns_shell.number_unique_all +_reflns_shell.number_unique_obs +_reflns_shell.percent_possible_all +_reflns_shell.percent_possible_obs +_reflns_shell.Rmerge_F_all +_reflns_shell.Rmerge_F_obs +_reflns_shell.Rmerge_I_all +_reflns_shell.Rmerge_I_obs +_reflns_shell.meanI_over_sigI_gt +_reflns_shell.meanI_over_uI_all +_reflns_shell.meanI_over_uI_gt +_reflns_shell.number_measured_gt +_reflns_shell.number_unique_gt +_reflns_shell.percent_possible_gt +_reflns_shell.Rmerge_F_gt +_reflns_shell.Rmerge_I_gt +_reflns_shell.pdbx_redundancy +_reflns_shell.pdbx_Rsym_value +_reflns_shell.pdbx_chi_squared +_reflns_shell.pdbx_netI_over_sigmaI_all +_reflns_shell.pdbx_netI_over_sigmaI_obs +_reflns_shell.pdbx_Rrim_I_all +_reflns_shell.pdbx_Rpim_I_all +_reflns_shell.pdbx_rejects +_reflns_shell.pdbx_ordinal +_reflns_shell.pdbx_diffrn_id +_reflns_shell.pdbx_CC_half +_reflns_shell.pdbx_CC_star +_reflns_shell.pdbx_R_split +2.820 2.970 ? ? 92510 ? ? ? 4060 99.900 ? ? ? ? 1.055 ? ? ? ? ? ? ? ? 22.800 ? ? ? 2.900 1.079 0.221 ? 1 1 0.730 ? ? +8.920 103.110 ? ? 20556 ? ? ? 1096 99.600 ? ? ? ? 0.056 ? ? ? ? ? ? ? ? 18.800 ? ? ? 38.700 0.057 0.013 ? 2 1 0.996 ? ? +# +_refine.aniso_B[1][1] 0.0400 +_refine.aniso_B[1][2] 0.0000 +_refine.aniso_B[1][3] -0.0000 +_refine.aniso_B[2][2] 0.0400 +_refine.aniso_B[2][3] -0.0000 +_refine.aniso_B[3][3] -0.0800 +_refine.B_iso_max 172.460 +_refine.B_iso_mean 69.6110 +_refine.B_iso_min 25.470 +_refine.correlation_coeff_Fo_to_Fc 0.9120 +_refine.correlation_coeff_Fo_to_Fc_free 0.8660 +_refine.details 'U VALUES : REFINED INDIVIDUALLY' +_refine.diff_density_max ? +_refine.diff_density_max_esd ? +_refine.diff_density_min ? +_refine.diff_density_min_esd ? +_refine.diff_density_rms ? +_refine.diff_density_rms_esd ? +_refine.entry_id 6WGL +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.ls_abs_structure_details ? +_refine.ls_abs_structure_Flack ? +_refine.ls_abs_structure_Flack_esd ? +_refine.ls_abs_structure_Rogers ? +_refine.ls_abs_structure_Rogers_esd ? +_refine.ls_d_res_high 2.8200 +_refine.ls_d_res_low 30.0000 +_refine.ls_extinction_coef ? +_refine.ls_extinction_coef_esd ? +_refine.ls_extinction_expression ? +_refine.ls_extinction_method ? +_refine.ls_goodness_of_fit_all ? +_refine.ls_goodness_of_fit_all_esd ? +_refine.ls_goodness_of_fit_obs ? +_refine.ls_goodness_of_fit_obs_esd ? +_refine.ls_hydrogen_treatment ? +_refine.ls_matrix_type ? +_refine.ls_number_constraints ? +_refine.ls_number_parameters ? +_refine.ls_number_reflns_all ? +_refine.ls_number_reflns_obs 27133 +_refine.ls_number_reflns_R_free 1420 +_refine.ls_number_reflns_R_work ? +_refine.ls_number_restraints ? +_refine.ls_percent_reflns_obs 99.7300 +_refine.ls_percent_reflns_R_free 5.0000 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.2481 +_refine.ls_R_factor_R_free 0.3037 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_R_factor_R_work 0.2451 +_refine.ls_R_Fsqd_factor_obs ? +_refine.ls_R_I_factor_obs ? +_refine.ls_redundancy_reflns_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_restrained_S_all ? +_refine.ls_restrained_S_obs ? +_refine.ls_shift_over_esd_max ? +_refine.ls_shift_over_esd_mean ? +_refine.ls_structure_factor_coef ? +_refine.ls_weighting_details ? +_refine.ls_weighting_scheme ? +_refine.ls_wR_factor_all ? +_refine.ls_wR_factor_obs ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.solvent_model_details ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.pdbx_R_complete ? +_refine.ls_R_factor_gt ? +_refine.ls_goodness_of_fit_gt ? +_refine.ls_goodness_of_fit_ref ? +_refine.ls_shift_over_su_max ? +_refine.ls_shift_over_su_max_lt ? +_refine.ls_shift_over_su_mean ? +_refine.ls_shift_over_su_mean_lt ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 0.000 +_refine.pdbx_ls_sigma_Fsqd ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_starting_model 6WG8 +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_overall_ESU_R 0.5370 +_refine.pdbx_overall_ESU_R_Free 0.3650 +_refine.pdbx_solvent_vdw_probe_radii 1.2000 +_refine.pdbx_solvent_ion_probe_radii 0.8000 +_refine.pdbx_solvent_shrinkage_radii 0.8000 +_refine.pdbx_real_space_R ? +_refine.pdbx_density_correlation ? +_refine.pdbx_pd_number_of_powder_patterns ? +_refine.pdbx_pd_number_of_points ? +_refine.pdbx_pd_meas_number_of_points ? +_refine.pdbx_pd_proc_ls_prof_R_factor ? +_refine.pdbx_pd_proc_ls_prof_wR_factor ? +_refine.pdbx_pd_Marquardt_correlation_coeff ? +_refine.pdbx_pd_Fsqrd_R_factor ? +_refine.pdbx_pd_ls_matrix_band_width ? +_refine.pdbx_overall_phase_error ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_diffrn_id 1 +_refine.overall_SU_B 19.1470 +_refine.overall_SU_ML 0.3690 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_average_fsc_overall ? +_refine.pdbx_average_fsc_work ? +_refine.pdbx_average_fsc_free ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id final +_refine_hist.details ? +_refine_hist.d_res_high 2.8200 +_refine_hist.d_res_low 30.0000 +_refine_hist.number_atoms_solvent 26 +_refine_hist.number_atoms_total 4737 +_refine_hist.number_reflns_all ? +_refine_hist.number_reflns_obs ? +_refine_hist.number_reflns_R_free ? +_refine_hist.number_reflns_R_work ? +_refine_hist.R_factor_all ? +_refine_hist.R_factor_obs ? +_refine_hist.R_factor_R_free ? +_refine_hist.R_factor_R_work ? +_refine_hist.pdbx_number_residues_total 616 +_refine_hist.pdbx_B_iso_mean_ligand 102.36 +_refine_hist.pdbx_B_iso_mean_solvent 48.25 +_refine_hist.pdbx_number_atoms_protein 4641 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 70 +_refine_hist.pdbx_number_atoms_lipid ? +_refine_hist.pdbx_number_atoms_carb ? +_refine_hist.pdbx_pseudo_atom_details ? +# +loop_ +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.criterion +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.number +_refine_ls_restr.rejects +_refine_ls_restr.type +_refine_ls_restr.weight +_refine_ls_restr.pdbx_restraint_function +'X-RAY DIFFRACTION' ? 0.004 0.012 4838 ? r_bond_refined_d ? ? +'X-RAY DIFFRACTION' ? 1.242 1.659 6613 ? r_angle_refined_deg ? ? +'X-RAY DIFFRACTION' ? 7.692 5.016 614 ? r_dihedral_angle_1_deg ? ? +'X-RAY DIFFRACTION' ? 39.126 24.348 184 ? r_dihedral_angle_2_deg ? ? +'X-RAY DIFFRACTION' ? 19.984 15.000 708 ? r_dihedral_angle_3_deg ? ? +'X-RAY DIFFRACTION' ? 14.851 15.000 17 ? r_dihedral_angle_4_deg ? ? +'X-RAY DIFFRACTION' ? 0.090 0.200 661 ? r_chiral_restr ? ? +'X-RAY DIFFRACTION' ? 0.004 0.020 3622 ? r_gen_planes_refined ? ? +# +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.d_res_high 2.8200 +_refine_ls_shell.d_res_low 2.8930 +_refine_ls_shell.number_reflns_all 2015 +_refine_ls_shell.number_reflns_obs ? +_refine_ls_shell.number_reflns_R_free 96 +_refine_ls_shell.number_reflns_R_work 1919 +_refine_ls_shell.percent_reflns_obs 99.8000 +_refine_ls_shell.percent_reflns_R_free ? +_refine_ls_shell.R_factor_all ? +_refine_ls_shell.R_factor_obs ? +_refine_ls_shell.R_factor_R_free 0.4200 +_refine_ls_shell.R_factor_R_free_error 0.0000 +_refine_ls_shell.R_factor_R_work 0.2980 +_refine_ls_shell.redundancy_reflns_all ? +_refine_ls_shell.redundancy_reflns_obs ? +_refine_ls_shell.wR_factor_all ? +_refine_ls_shell.wR_factor_obs ? +_refine_ls_shell.wR_factor_R_free ? +_refine_ls_shell.wR_factor_R_work ? +_refine_ls_shell.pdbx_R_complete ? +_refine_ls_shell.pdbx_total_number_of_bins_used 20 +_refine_ls_shell.pdbx_phase_error ? +_refine_ls_shell.pdbx_fsc_work ? +_refine_ls_shell.pdbx_fsc_free ? +# +_struct.entry_id 6WGL +_struct.title 'Dupilumab fab with Crystal Kappa design complexed with human IL-4 receptor' +_struct.pdbx_model_details ? +_struct.pdbx_formula_weight ? +_struct.pdbx_formula_weight_method ? +_struct.pdbx_model_type_details ? +_struct.pdbx_CASP_flag N +# +_struct_keywords.entry_id 6WGL +_struct_keywords.text 'Dupilumab, hIL4R, IMMUNE SYSTEM' +_struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 3 ? +D N N 4 ? +E N N 4 ? +F N N 5 ? +G N N 6 ? +H N N 6 ? +I N N 6 ? +# +loop_ +_struct_ref.id +_struct_ref.db_name +_struct_ref.db_code +_struct_ref.pdbx_db_accession +_struct_ref.pdbx_db_isoform +_struct_ref.entity_id +_struct_ref.pdbx_seq_one_letter_code +_struct_ref.pdbx_align_begin +1 PDB 6WGL 6WGL ? 1 ? 1 +2 PDB 6WGL 6WGL ? 2 ? 1 +3 UNP IL4RA_HUMAN P24394 ? 3 +;MKVLQEPTCVSDYMSISTCEWKMNGPTNCSTELRLLYQLVFLLSEAHTCIPENNGGAGCVCHLLMDDVVSADNYTLDLWA +GQQLLWKGSFKPSEHVKPRAPGNLTVHTNVSDTLLLTWSNPYPPDNYLYNHLTYAVNIWSENDPADFRIYNVTYLEPSLR +IAASTLKSGISYRARVRAWAQCYNTTWSEWSPSTKWHNSYREPFEQH +; +26 +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 6WGL A 1 ? 234 ? 6WGL 1 ? 234 ? 1 234 +2 2 6WGL B 1 ? 217 ? 6WGL 1 ? 217 ? 1 217 +3 3 6WGL C 1 ? 207 ? P24394 26 ? 232 ? 1 207 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +3 6WGL LEU C 182 ? UNP P24394 CYS 207 conflict 182 1 +3 6WGL GLY C 208 ? UNP P24394 ? ? 'expression tag' 208 2 +3 6WGL GLY C 209 ? UNP P24394 ? ? 'expression tag' 209 3 +3 6WGL GLY C 210 ? UNP P24394 ? ? 'expression tag' 210 4 +3 6WGL GLY C 211 ? UNP P24394 ? ? 'expression tag' 211 5 +3 6WGL SER C 212 ? UNP P24394 ? ? 'expression tag' 212 6 +3 6WGL HIS C 213 ? UNP P24394 ? ? 'expression tag' 213 7 +3 6WGL HIS C 214 ? UNP P24394 ? ? 'expression tag' 214 8 +3 6WGL HIS C 215 ? UNP P24394 ? ? 'expression tag' 215 9 +3 6WGL HIS C 216 ? UNP P24394 ? ? 'expression tag' 216 10 +3 6WGL HIS C 217 ? UNP P24394 ? ? 'expression tag' 217 11 +3 6WGL HIS C 218 ? UNP P24394 ? ? 'expression tag' 218 12 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_and_software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details trimeric +_pdbx_struct_assembly.oligomeric_count 3 +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 5390 ? +1 MORE -35 ? +1 'SSA (A^2)' 28690 ? +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I +# +_pdbx_struct_assembly_auth_evidence.id 1 +_pdbx_struct_assembly_auth_evidence.assembly_id 1 +_pdbx_struct_assembly_auth_evidence.experimental_support 'gel filtration' +_pdbx_struct_assembly_auth_evidence.details ? +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 AA1 THR A 28 ? ARG A 30 ? THR A 28 ARG A 30 5 ? 3 +HELX_P HELX_P2 AA2 ASP A 62 ? LYS A 65 ? ASP A 62 LYS A 65 5 ? 4 +HELX_P HELX_P3 AA3 ARG A 87 ? THR A 91 ? ARG A 87 THR A 91 5 ? 5 +HELX_P HELX_P4 AA4 SER A 199 ? GLY A 202 ? SER A 199 GLY A 202 5 ? 4 +HELX_P HELX_P5 AA5 LYS A 213 ? ASN A 216 ? LYS A 213 ASN A 216 5 ? 4 +HELX_P HELX_P6 AA6 GLU B 84 ? VAL B 88 ? GLU B 84 VAL B 88 5 ? 5 +HELX_P HELX_P7 AA7 SER B 126 ? SER B 132 ? SER B 126 SER B 132 5 ? 7 +HELX_P HELX_P8 AA8 LYS B 188 ? HIS B 194 ? LYS B 188 HIS B 194 1 ? 7 +HELX_P HELX_P9 AA9 ASN C 28 ? GLU C 32 ? ASN C 28 GLU C 32 1 ? 5 +HELX_P HELX_P10 AB1 LYS C 91 ? HIS C 95 ? LYS C 91 HIS C 95 5 ? 5 +HELX_P HELX_P11 AB2 ASN C 126 ? ASN C 130 ? ASN C 126 ASN C 130 5 ? 5 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +disulf1 disulf ? ? A CYS 22 SG ? ? ? 1_555 A CYS 96 SG ? ? A CYS 22 A CYS 96 1_555 ? ? ? ? ? ? ? 2.757 ? ? +disulf2 disulf ? ? A CYS 152 SG A ? ? 1_555 A CYS 208 SG ? ? A CYS 152 A CYS 208 1_555 ? ? ? ? ? ? ? 2.068 ? ? +disulf3 disulf ? ? A CYS 152 SG B ? ? 1_555 A CYS 208 SG ? ? A CYS 152 A CYS 208 1_555 ? ? ? ? ? ? ? 2.797 ? ? +disulf4 disulf ? ? B CYS 23 SG ? ? ? 1_555 B CYS 93 SG ? ? B CYS 23 B CYS 93 1_555 ? ? ? ? ? ? ? 2.921 ? ? +disulf5 disulf ? ? B CYS 139 SG ? ? ? 1_555 B CYS 199 SG ? ? B CYS 139 B CYS 199 1_555 ? ? ? ? ? ? ? 2.054 ? ? +disulf6 disulf ? ? C CYS 9 SG ? ? ? 1_555 C CYS 19 SG ? ? C CYS 9 C CYS 19 1_555 ? ? ? ? ? ? ? 2.039 ? ? +disulf7 disulf ? ? C CYS 29 SG ? ? ? 1_555 C CYS 59 SG ? ? C CYS 29 C CYS 59 1_555 ? ? ? ? ? ? ? 2.051 ? ? +covale1 covale one ? C ASN 28 ND2 ? ? ? 1_555 D NAG . C1 ? ? C ASN 28 D NAG 1 1_555 ? ? ? ? ? ? ? 1.432 ? N-Glycosylation +covale2 covale one ? C ASN 73 ND2 ? ? ? 1_555 E NAG . C1 ? ? C ASN 73 E NAG 1 1_555 ? ? ? ? ? ? ? 1.449 ? N-Glycosylation +covale3 covale one ? C ASN 184 ND2 ? ? ? 1_555 F NAG . C1 ? ? C ASN 184 C NAG 301 1_555 ? ? ? ? ? ? ? 1.458 ? N-Glycosylation +covale4 covale both ? D NAG . O4 ? ? ? 1_555 D NAG . C1 ? ? D NAG 1 D NAG 2 1_555 ? ? ? ? ? ? ? 1.462 ? ? +covale5 covale both ? E NAG . O4 ? ? ? 1_555 E NAG . C1 ? ? E NAG 1 E NAG 2 1_555 ? ? ? ? ? ? ? 1.455 ? ? +# +loop_ +_struct_conn_type.id +_struct_conn_type.criteria +_struct_conn_type.reference +disulf ? ? +covale ? ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 NAG D . ? ASN C 28 ? NAG D 1 ? 1_555 ASN C 28 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +2 NAG E . ? ASN C 73 ? NAG E 1 ? 1_555 ASN C 73 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +3 NAG F . ? ASN C 184 ? NAG C 301 ? 1_555 ASN C 184 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +4 CYS A 22 ? CYS A 96 ? CYS A 22 ? 1_555 CYS A 96 ? 1_555 SG SG . . . None 'Disulfide bridge' +5 CYS A 152 A CYS A 208 ? CYS A 152 ? 1_555 CYS A 208 ? 1_555 SG SG . . . None 'Disulfide bridge' +6 CYS A 152 B CYS A 208 ? CYS A 152 ? 1_555 CYS A 208 ? 1_555 SG SG . . . None 'Disulfide bridge' +7 CYS B 23 ? CYS B 93 ? CYS B 23 ? 1_555 CYS B 93 ? 1_555 SG SG . . . None 'Disulfide bridge' +8 CYS B 139 ? CYS B 199 ? CYS B 139 ? 1_555 CYS B 199 ? 1_555 SG SG . . . None 'Disulfide bridge' +9 CYS C 9 ? CYS C 19 ? CYS C 9 ? 1_555 CYS C 19 ? 1_555 SG SG . . . None 'Disulfide bridge' +10 CYS C 29 ? CYS C 59 ? CYS C 29 ? 1_555 CYS C 59 ? 1_555 SG SG . . . None 'Disulfide bridge' +# +loop_ +_struct_mon_prot_cis.pdbx_id +_struct_mon_prot_cis.label_comp_id +_struct_mon_prot_cis.label_seq_id +_struct_mon_prot_cis.label_asym_id +_struct_mon_prot_cis.label_alt_id +_struct_mon_prot_cis.pdbx_PDB_ins_code +_struct_mon_prot_cis.auth_comp_id +_struct_mon_prot_cis.auth_seq_id +_struct_mon_prot_cis.auth_asym_id +_struct_mon_prot_cis.pdbx_label_comp_id_2 +_struct_mon_prot_cis.pdbx_label_seq_id_2 +_struct_mon_prot_cis.pdbx_label_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 +_struct_mon_prot_cis.pdbx_auth_comp_id_2 +_struct_mon_prot_cis.pdbx_auth_seq_id_2 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_model_num +_struct_mon_prot_cis.pdbx_omega_angle +1 PHE 158 A . ? PHE 158 A PRO 159 A ? PRO 159 A 1 -6.32 +2 GLU 160 A . ? GLU 160 A PRO 161 A ? PRO 161 A 1 12.69 +3 SER 7 B . ? SER 7 B PRO 8 B ? PRO 8 B 1 3.07 +4 THR 99 B . ? THR 99 B PRO 100 B ? PRO 100 B 1 -7.17 +5 TYR 145 B . ? TYR 145 B PRO 146 B ? PRO 146 B 1 11.91 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +AA1 ? 4 ? +AA2 ? 6 ? +AA3 ? 4 ? +AA4 ? 4 ? +AA5 ? 3 ? +AA6 ? 4 ? +AA7 ? 6 ? +AA8 ? 4 ? +AA9 ? 2 ? +AB1 ? 4 ? +AB2 ? 4 ? +AB3 ? 4 ? +AB4 ? 4 ? +AB5 ? 2 ? +AB6 ? 3 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +AA1 1 2 ? anti-parallel +AA1 2 3 ? anti-parallel +AA1 3 4 ? anti-parallel +AA2 1 2 ? parallel +AA2 2 3 ? anti-parallel +AA2 3 4 ? anti-parallel +AA2 4 5 ? anti-parallel +AA2 5 6 ? anti-parallel +AA3 1 2 ? anti-parallel +AA3 2 3 ? anti-parallel +AA3 3 4 ? anti-parallel +AA4 1 2 ? anti-parallel +AA4 2 3 ? anti-parallel +AA4 3 4 ? anti-parallel +AA5 1 2 ? anti-parallel +AA5 2 3 ? anti-parallel +AA6 1 2 ? anti-parallel +AA6 2 3 ? anti-parallel +AA6 3 4 ? anti-parallel +AA7 1 2 ? parallel +AA7 2 3 ? anti-parallel +AA7 3 4 ? anti-parallel +AA7 4 5 ? anti-parallel +AA7 5 6 ? anti-parallel +AA8 1 2 ? parallel +AA8 2 3 ? anti-parallel +AA8 3 4 ? anti-parallel +AA9 1 2 ? anti-parallel +AB1 1 2 ? anti-parallel +AB1 2 3 ? anti-parallel +AB1 3 4 ? anti-parallel +AB2 1 2 ? anti-parallel +AB2 2 3 ? anti-parallel +AB2 3 4 ? anti-parallel +AB3 1 2 ? anti-parallel +AB3 2 3 ? anti-parallel +AB3 3 4 ? anti-parallel +AB4 1 2 ? anti-parallel +AB4 2 3 ? anti-parallel +AB4 3 4 ? anti-parallel +AB5 1 2 ? anti-parallel +AB6 1 2 ? anti-parallel +AB6 2 3 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA1 1 GLN A 3 ? SER A 7 ? GLN A 3 SER A 7 +AA1 2 LEU A 18 ? SER A 25 ? LEU A 18 SER A 25 +AA1 3 THR A 78 ? MET A 83 ? THR A 78 MET A 83 +AA1 4 ILE A 70 ? ASP A 73 ? ILE A 70 ASP A 73 +AA2 1 LEU A 11 ? GLU A 12 ? LEU A 11 GLU A 12 +AA2 2 THR A 119 ? VAL A 123 ? THR A 119 VAL A 123 +AA2 3 ALA A 92 ? LEU A 101 ? ALA A 92 LEU A 101 +AA2 4 TYR A 32 ? GLN A 39 ? TYR A 32 GLN A 39 +AA2 5 LEU A 45 ? ILE A 51 ? LEU A 45 ILE A 51 +AA2 6 THR A 58 ? TYR A 60 ? THR A 58 TYR A 60 +AA3 1 SER A 132 ? LEU A 136 ? SER A 132 LEU A 136 +AA3 2 THR A 147 ? TYR A 157 ? THR A 147 TYR A 157 +AA3 3 TYR A 188 ? PRO A 197 ? TYR A 188 PRO A 197 +AA3 4 HIS A 176 ? THR A 177 ? HIS A 176 THR A 177 +AA4 1 SER A 132 ? LEU A 136 ? SER A 132 LEU A 136 +AA4 2 THR A 147 ? TYR A 157 ? THR A 147 TYR A 157 +AA4 3 TYR A 188 ? PRO A 197 ? TYR A 188 PRO A 197 +AA4 4 VAL A 181 ? LEU A 182 ? VAL A 181 LEU A 182 +AA5 1 THR A 163 ? TRP A 166 ? THR A 163 TRP A 166 +AA5 2 THR A 207 ? HIS A 212 ? THR A 207 HIS A 212 +AA5 3 THR A 217 ? ARG A 222 ? THR A 217 ARG A 222 +AA6 1 MET B 4 ? SER B 7 ? MET B 4 SER B 7 +AA6 2 ALA B 19 ? SER B 25 ? ALA B 19 SER B 25 +AA6 3 ASP B 75 ? ILE B 80 ? ASP B 75 ILE B 80 +AA6 4 PHE B 67 ? SER B 72 ? PHE B 67 SER B 72 +AA7 1 SER B 10 ? VAL B 13 ? SER B 10 VAL B 13 +AA7 2 THR B 107 ? ILE B 111 ? THR B 107 ILE B 111 +AA7 3 GLY B 89 ? GLN B 95 ? GLY B 89 GLN B 95 +AA7 4 LEU B 38 ? GLN B 43 ? LEU B 38 GLN B 43 +AA7 5 GLN B 50 ? TYR B 54 ? GLN B 50 TYR B 54 +AA7 6 ASN B 58 ? ARG B 59 ? ASN B 58 ARG B 59 +AA8 1 SER B 10 ? VAL B 13 ? SER B 10 VAL B 13 +AA8 2 THR B 107 ? ILE B 111 ? THR B 107 ILE B 111 +AA8 3 GLY B 89 ? GLN B 95 ? GLY B 89 GLN B 95 +AA8 4 THR B 102 ? PHE B 103 ? THR B 102 PHE B 103 +AA9 1 LEU B 30 ? SER B 32 ? LEU B 30 SER B 32 +AA9 2 TYR B 35 ? ASN B 36 ? TYR B 35 ASN B 36 +AB1 1 SER B 119 ? PHE B 123 ? SER B 119 PHE B 123 +AB1 2 THR B 134 ? PHE B 144 ? THR B 134 PHE B 144 +AB1 3 TYR B 178 ? SER B 187 ? TYR B 178 SER B 187 +AB1 4 SER B 164 ? VAL B 168 ? SER B 164 VAL B 168 +AB2 1 ALA B 158 ? LEU B 159 ? ALA B 158 LEU B 159 +AB2 2 LYS B 150 ? VAL B 155 ? LYS B 150 VAL B 155 +AB2 3 VAL B 196 ? GLN B 203 ? VAL B 196 GLN B 203 +AB2 4 THR B 206 ? ASN B 213 ? THR B 206 ASN B 213 +AB3 1 LYS C 2 ? SER C 11 ? LYS C 2 SER C 11 +AB3 2 ILE C 16 ? ASN C 24 ? ILE C 16 ASN C 24 +AB3 3 GLY C 58 ? LEU C 64 ? GLY C 58 LEU C 64 +AB3 4 GLU C 52 ? ASN C 53 ? GLU C 52 ASN C 53 +AB4 1 HIS C 47 ? CYS C 49 ? HIS C 47 CYS C 49 +AB4 2 LEU C 33 ? LEU C 39 ? LEU C 33 LEU C 39 +AB4 3 TYR C 74 ? ALA C 80 ? TYR C 74 ALA C 80 +AB4 4 GLN C 83 ? PHE C 90 ? GLN C 83 PHE C 90 +AB5 1 LEU C 116 ? THR C 117 ? LEU C 116 THR C 117 +AB5 2 SER C 158 ? LEU C 159 ? SER C 158 LEU C 159 +AB6 1 ILE C 149 ? VAL C 152 ? ILE C 149 VAL C 152 +AB6 2 LEU C 132 ? ASN C 137 ? LEU C 132 ASN C 137 +AB6 3 ARG C 175 ? ALA C 180 ? ARG C 175 ALA C 180 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +AA1 1 2 N VAL A 5 ? N VAL A 5 O ALA A 23 ? O ALA A 23 +AA1 2 3 N LEU A 18 ? N LEU A 18 O MET A 83 ? O MET A 83 +AA1 3 4 O TYR A 80 ? O TYR A 80 N SER A 71 ? N SER A 71 +AA2 1 2 N GLU A 12 ? N GLU A 12 O THR A 122 ? O THR A 122 +AA2 2 3 O THR A 119 ? O THR A 119 N TYR A 94 ? N TYR A 94 +AA2 3 4 O TYR A 95 ? O TYR A 95 N VAL A 37 ? N VAL A 37 +AA2 4 5 N TRP A 36 ? N TRP A 36 O SER A 49 ? O SER A 49 +AA2 5 6 N SER A 50 ? N SER A 50 O TYR A 59 ? O TYR A 59 +AA3 1 2 N PHE A 134 ? N PHE A 134 O LEU A 153 ? O LEU A 153 +AA3 2 3 N VAL A 154 ? N VAL A 154 O LEU A 190 ? O LEU A 190 +AA3 3 4 O VAL A 193 ? O VAL A 193 N HIS A 176 ? N HIS A 176 +AA4 1 2 N PHE A 134 ? N PHE A 134 O LEU A 153 ? O LEU A 153 +AA4 2 3 N VAL A 154 ? N VAL A 154 O LEU A 190 ? O LEU A 190 +AA4 3 4 O SER A 189 ? O SER A 189 N VAL A 181 ? N VAL A 181 +AA5 1 2 N THR A 163 ? N THR A 163 O ASP A 211 ? O ASP A 211 +AA5 2 3 N VAL A 210 ? N VAL A 210 O VAL A 219 ? O VAL A 219 +AA6 1 2 N SER B 7 ? N SER B 7 O SER B 22 ? O SER B 22 +AA6 2 3 N CYS B 23 ? N CYS B 23 O PHE B 76 ? O PHE B 76 +AA6 3 4 O LYS B 79 ? O LYS B 79 N SER B 68 ? N SER B 68 +AA7 1 2 N LEU B 11 ? N LEU B 11 O LYS B 108 ? O LYS B 108 +AA7 2 3 O LEU B 109 ? O LEU B 109 N GLY B 89 ? N GLY B 89 +AA7 3 4 O TYR B 92 ? O TYR B 92 N TYR B 41 ? N TYR B 41 +AA7 4 5 N TRP B 40 ? N TRP B 40 O LEU B 52 ? O LEU B 52 +AA7 5 6 N TYR B 54 ? N TYR B 54 O ASN B 58 ? O ASN B 58 +AA8 1 2 N LEU B 11 ? N LEU B 11 O LYS B 108 ? O LYS B 108 +AA8 2 3 O LEU B 109 ? O LEU B 109 N GLY B 89 ? N GLY B 89 +AA8 3 4 N GLN B 95 ? N GLN B 95 O THR B 102 ? O THR B 102 +AA9 1 2 N TYR B 31 ? N TYR B 31 O TYR B 35 ? O TYR B 35 +AB1 1 2 N SER B 119 ? N SER B 119 O ASN B 142 ? O ASN B 142 +AB1 2 3 N VAL B 137 ? N VAL B 137 O LEU B 184 ? O LEU B 184 +AB1 3 4 O THR B 183 ? O THR B 183 N GLN B 165 ? N GLN B 165 +AB2 1 2 O ALA B 158 ? O ALA B 158 N VAL B 155 ? N VAL B 155 +AB2 2 3 N LYS B 154 ? N LYS B 154 O ALA B 198 ? O ALA B 198 +AB2 3 4 N VAL B 201 ? N VAL B 201 O VAL B 208 ? O VAL B 208 +AB3 1 2 N LYS C 2 ? N LYS C 2 O ASN C 24 ? O ASN C 24 +AB3 2 3 N TRP C 21 ? N TRP C 21 O CYS C 59 ? O CYS C 59 +AB3 3 4 O VAL C 60 ? O VAL C 60 N GLU C 52 ? N GLU C 52 +AB4 1 2 O HIS C 47 ? O HIS C 47 N TYR C 37 ? N TYR C 37 +AB4 2 3 N ARG C 34 ? N ARG C 34 O TRP C 79 ? O TRP C 79 +AB4 3 4 N TYR C 74 ? N TYR C 74 O PHE C 90 ? O PHE C 90 +AB5 1 2 N LEU C 116 ? N LEU C 116 O LEU C 159 ? O LEU C 159 +AB6 1 2 O VAL C 152 ? O VAL C 152 N TYR C 134 ? N TYR C 134 +AB6 2 3 N THR C 133 ? N THR C 133 O TRP C 179 ? O TRP C 179 +# +_pdbx_entry_details.entry_id 6WGL +_pdbx_entry_details.has_ligand_of_interest Y +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_protein_modification Y +# +_pdbx_validate_symm_contact.id 1 +_pdbx_validate_symm_contact.PDB_model_num 1 +_pdbx_validate_symm_contact.auth_atom_id_1 O +_pdbx_validate_symm_contact.auth_asym_id_1 B +_pdbx_validate_symm_contact.auth_comp_id_1 HOH +_pdbx_validate_symm_contact.auth_seq_id_1 304 +_pdbx_validate_symm_contact.PDB_ins_code_1 ? +_pdbx_validate_symm_contact.label_alt_id_1 ? +_pdbx_validate_symm_contact.site_symmetry_1 1_555 +_pdbx_validate_symm_contact.auth_atom_id_2 O +_pdbx_validate_symm_contact.auth_asym_id_2 B +_pdbx_validate_symm_contact.auth_comp_id_2 HOH +_pdbx_validate_symm_contact.auth_seq_id_2 310 +_pdbx_validate_symm_contact.PDB_ins_code_2 ? +_pdbx_validate_symm_contact.label_alt_id_2 ? +_pdbx_validate_symm_contact.site_symmetry_2 7_645 +_pdbx_validate_symm_contact.dist 2.12 +# +_pdbx_validate_rmsd_angle.id 1 +_pdbx_validate_rmsd_angle.PDB_model_num 1 +_pdbx_validate_rmsd_angle.auth_atom_id_1 CB +_pdbx_validate_rmsd_angle.auth_asym_id_1 C +_pdbx_validate_rmsd_angle.auth_comp_id_1 ASP +_pdbx_validate_rmsd_angle.auth_seq_id_1 112 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 ? +_pdbx_validate_rmsd_angle.label_alt_id_1 ? +_pdbx_validate_rmsd_angle.auth_atom_id_2 CG +_pdbx_validate_rmsd_angle.auth_asym_id_2 C +_pdbx_validate_rmsd_angle.auth_comp_id_2 ASP +_pdbx_validate_rmsd_angle.auth_seq_id_2 112 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 ? +_pdbx_validate_rmsd_angle.label_alt_id_2 ? +_pdbx_validate_rmsd_angle.auth_atom_id_3 OD2 +_pdbx_validate_rmsd_angle.auth_asym_id_3 C +_pdbx_validate_rmsd_angle.auth_comp_id_3 ASP +_pdbx_validate_rmsd_angle.auth_seq_id_3 112 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 ? +_pdbx_validate_rmsd_angle.label_alt_id_3 ? +_pdbx_validate_rmsd_angle.angle_value 124.52 +_pdbx_validate_rmsd_angle.angle_target_value 118.30 +_pdbx_validate_rmsd_angle.angle_deviation 6.22 +_pdbx_validate_rmsd_angle.angle_standard_deviation 0.90 +_pdbx_validate_rmsd_angle.linker_flag N +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 PHE A 27 ? ? -166.06 -166.25 +2 1 ARG A 67 ? ? -90.88 -61.70 +3 1 ASP A 99 ? ? -93.49 -145.30 +4 1 ASP A 156 ? ? 61.54 77.76 +5 1 PRO A 159 ? ? -89.14 -154.07 +6 1 TYR B 31 ? ? -95.30 -62.28 +7 1 TYR B 37 ? ? -102.54 75.77 +8 1 SER B 57 ? ? -151.43 19.89 +9 1 SER B 70 ? ? -172.86 147.13 +10 1 ASN B 143 ? ? 59.52 80.26 +11 1 ALA B 149 ? ? -175.73 145.73 +12 1 ASN B 157 ? ? 68.98 -11.59 +13 1 GLU B 170 ? ? -58.95 171.68 +14 1 LYS B 195 ? ? -123.55 -55.43 +15 1 MET C 14 ? ? -149.40 -50.90 +16 1 SER C 15 ? ? -140.87 -35.83 +17 1 THR C 31 ? ? -132.95 -40.31 +18 1 VAL C 40 ? ? -65.50 89.26 +19 1 ASP C 66 ? ? -86.59 44.95 +20 1 ASP C 67 ? ? 75.70 163.25 +21 1 ASN C 103 ? ? -67.15 96.74 +22 1 ALA C 145 ? ? -164.35 -89.17 +23 1 PHE C 147 ? ? -122.21 -166.08 +24 1 GLN C 181 ? ? -68.49 71.64 +25 1 TYR C 183 ? ? -99.04 -71.02 +# +loop_ +_pdbx_validate_planes.id +_pdbx_validate_planes.PDB_model_num +_pdbx_validate_planes.auth_comp_id +_pdbx_validate_planes.auth_asym_id +_pdbx_validate_planes.auth_seq_id +_pdbx_validate_planes.PDB_ins_code +_pdbx_validate_planes.label_alt_id +_pdbx_validate_planes.rmsd +_pdbx_validate_planes.type +1 1 ARG A 30 ? ? 0.166 'SIDE CHAIN' +2 1 ARG A 100 ? ? 0.083 'SIDE CHAIN' +3 1 ARG A 106 ? ? 0.166 'SIDE CHAIN' +4 1 ARG B 59 ? ? 0.101 'SIDE CHAIN' +5 1 ARG B 113 ? ? 0.166 'SIDE CHAIN' +6 1 ARG C 99 ? ? 0.148 'SIDE CHAIN' +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A THR 143 ? A THR 143 +2 1 Y 1 A SER 144 ? A SER 144 +3 1 Y 1 A SER 225 ? A SER 225 +4 1 Y 1 A LYS 226 ? A LYS 226 +5 1 Y 1 A TYR 227 ? A TYR 227 +6 1 Y 1 A GLY 228 ? A GLY 228 +7 1 Y 1 A HIS 229 ? A HIS 229 +8 1 Y 1 A HIS 230 ? A HIS 230 +9 1 Y 1 A HIS 231 ? A HIS 231 +10 1 Y 1 A HIS 232 ? A HIS 232 +11 1 Y 1 A HIS 233 ? A HIS 233 +12 1 Y 1 A HIS 234 ? A HIS 234 +13 1 Y 1 B CYS 217 ? B CYS 217 +14 1 Y 1 C THR 108 ? C THR 108 +15 1 Y 1 C ASN 109 ? C ASN 109 +16 1 Y 1 C VAL 110 ? C VAL 110 +17 1 Y 1 C SER 111 ? C SER 111 +18 1 Y 1 C TRP 139 ? C TRP 139 +19 1 Y 1 C SER 140 ? C SER 140 +20 1 Y 1 C GLU 141 ? C GLU 141 +21 1 Y 1 C ASN 142 ? C ASN 142 +22 1 Y 1 C ASP 143 ? C ASP 143 +23 1 Y 1 C SER 164 ? C SER 164 +24 1 Y 1 C THR 165 ? C THR 165 +25 1 Y 1 C LEU 166 ? C LEU 166 +26 1 Y 1 C LYS 167 ? C LYS 167 +27 1 Y 1 C SER 168 ? C SER 168 +28 1 Y 1 C GLY 169 ? C GLY 169 +29 1 Y 1 C ILE 170 ? C ILE 170 +30 1 Y 1 C SER 171 ? C SER 171 +31 1 Y 1 C TYR 172 ? C TYR 172 +32 1 Y 1 C HIS 197 ? C HIS 197 +33 1 Y 1 C ASN 198 ? C ASN 198 +34 1 Y 1 C SER 199 ? C SER 199 +35 1 Y 1 C TYR 200 ? C TYR 200 +36 1 Y 1 C ARG 201 ? C ARG 201 +37 1 Y 1 C GLU 202 ? C GLU 202 +38 1 Y 1 C PRO 203 ? C PRO 203 +39 1 Y 1 C PHE 204 ? C PHE 204 +40 1 Y 1 C GLU 205 ? C GLU 205 +41 1 Y 1 C GLN 206 ? C GLN 206 +42 1 Y 1 C HIS 207 ? C HIS 207 +43 1 Y 1 C GLY 208 ? C GLY 208 +44 1 Y 1 C GLY 209 ? C GLY 209 +45 1 Y 1 C GLY 210 ? C GLY 210 +46 1 Y 1 C GLY 211 ? C GLY 211 +47 1 Y 1 C SER 212 ? C SER 212 +48 1 Y 1 C HIS 213 ? C HIS 213 +49 1 Y 1 C HIS 214 ? C HIS 214 +50 1 Y 1 C HIS 215 ? C HIS 215 +51 1 Y 1 C HIS 216 ? C HIS 216 +52 1 Y 1 C HIS 217 ? C HIS 217 +53 1 Y 1 C HIS 218 ? C HIS 218 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +GLN N N N N 88 +GLN CA C N S 89 +GLN C C N N 90 +GLN O O N N 91 +GLN CB C N N 92 +GLN CG C N N 93 +GLN CD C N N 94 +GLN OE1 O N N 95 +GLN NE2 N N N 96 +GLN OXT O N N 97 +GLN H H N N 98 +GLN H2 H N N 99 +GLN HA H N N 100 +GLN HB2 H N N 101 +GLN HB3 H N N 102 +GLN HG2 H N N 103 +GLN HG3 H N N 104 +GLN HE21 H N N 105 +GLN HE22 H N N 106 +GLN HXT H N N 107 +GLU N N N N 108 +GLU CA C N S 109 +GLU C C N N 110 +GLU O O N N 111 +GLU CB C N N 112 +GLU CG C N N 113 +GLU CD C N N 114 +GLU OE1 O N N 115 +GLU OE2 O N N 116 +GLU OXT O N N 117 +GLU H H N N 118 +GLU H2 H N N 119 +GLU HA H N N 120 +GLU HB2 H N N 121 +GLU HB3 H N N 122 +GLU HG2 H N N 123 +GLU HG3 H N N 124 +GLU HE2 H N N 125 +GLU HXT H N N 126 +GLY N N N N 127 +GLY CA C N N 128 +GLY C C N N 129 +GLY O O N N 130 +GLY OXT O N N 131 +GLY H H N N 132 +GLY H2 H N N 133 +GLY HA2 H N N 134 +GLY HA3 H N N 135 +GLY HXT H N N 136 +HIS N N N N 137 +HIS CA C N S 138 +HIS C C N N 139 +HIS O O N N 140 +HIS CB C N N 141 +HIS CG C Y N 142 +HIS ND1 N Y N 143 +HIS CD2 C Y N 144 +HIS CE1 C Y N 145 +HIS NE2 N Y N 146 +HIS OXT O N N 147 +HIS H H N N 148 +HIS H2 H N N 149 +HIS HA H N N 150 +HIS HB2 H N N 151 +HIS HB3 H N N 152 +HIS HD1 H N N 153 +HIS HD2 H N N 154 +HIS HE1 H N N 155 +HIS HE2 H N N 156 +HIS HXT H N N 157 +HOH O O N N 158 +HOH H1 H N N 159 +HOH H2 H N N 160 +ILE N N N N 161 +ILE CA C N S 162 +ILE C C N N 163 +ILE O O N N 164 +ILE CB C N S 165 +ILE CG1 C N N 166 +ILE CG2 C N N 167 +ILE CD1 C N N 168 +ILE OXT O N N 169 +ILE H H N N 170 +ILE H2 H N N 171 +ILE HA H N N 172 +ILE HB H N N 173 +ILE HG12 H N N 174 +ILE HG13 H N N 175 +ILE HG21 H N N 176 +ILE HG22 H N N 177 +ILE HG23 H N N 178 +ILE HD11 H N N 179 +ILE HD12 H N N 180 +ILE HD13 H N N 181 +ILE HXT H N N 182 +LEU N N N N 183 +LEU CA C N S 184 +LEU C C N N 185 +LEU O O N N 186 +LEU CB C N N 187 +LEU CG C N N 188 +LEU CD1 C N N 189 +LEU CD2 C N N 190 +LEU OXT O N N 191 +LEU H H N N 192 +LEU H2 H N N 193 +LEU HA H N N 194 +LEU HB2 H N N 195 +LEU HB3 H N N 196 +LEU HG H N N 197 +LEU HD11 H N N 198 +LEU HD12 H N N 199 +LEU HD13 H N N 200 +LEU HD21 H N N 201 +LEU HD22 H N N 202 +LEU HD23 H N N 203 +LEU HXT H N N 204 +LYS N N N N 205 +LYS CA C N S 206 +LYS C C N N 207 +LYS O O N N 208 +LYS CB C N N 209 +LYS CG C N N 210 +LYS CD C N N 211 +LYS CE C N N 212 +LYS NZ N N N 213 +LYS OXT O N N 214 +LYS H H N N 215 +LYS H2 H N N 216 +LYS HA H N N 217 +LYS HB2 H N N 218 +LYS HB3 H N N 219 +LYS HG2 H N N 220 +LYS HG3 H N N 221 +LYS HD2 H N N 222 +LYS HD3 H N N 223 +LYS HE2 H N N 224 +LYS HE3 H N N 225 +LYS HZ1 H N N 226 +LYS HZ2 H N N 227 +LYS HZ3 H N N 228 +LYS HXT H N N 229 +MET N N N N 230 +MET CA C N S 231 +MET C C N N 232 +MET O O N N 233 +MET CB C N N 234 +MET CG C N N 235 +MET SD S N N 236 +MET CE C N N 237 +MET OXT O N N 238 +MET H H N N 239 +MET H2 H N N 240 +MET HA H N N 241 +MET HB2 H N N 242 +MET HB3 H N N 243 +MET HG2 H N N 244 +MET HG3 H N N 245 +MET HE1 H N N 246 +MET HE2 H N N 247 +MET HE3 H N N 248 +MET HXT H N N 249 +NAG C1 C N R 250 +NAG C2 C N R 251 +NAG C3 C N R 252 +NAG C4 C N S 253 +NAG C5 C N R 254 +NAG C6 C N N 255 +NAG C7 C N N 256 +NAG C8 C N N 257 +NAG N2 N N N 258 +NAG O1 O N N 259 +NAG O3 O N N 260 +NAG O4 O N N 261 +NAG O5 O N N 262 +NAG O6 O N N 263 +NAG O7 O N N 264 +NAG H1 H N N 265 +NAG H2 H N N 266 +NAG H3 H N N 267 +NAG H4 H N N 268 +NAG H5 H N N 269 +NAG H61 H N N 270 +NAG H62 H N N 271 +NAG H81 H N N 272 +NAG H82 H N N 273 +NAG H83 H N N 274 +NAG HN2 H N N 275 +NAG HO1 H N N 276 +NAG HO3 H N N 277 +NAG HO4 H N N 278 +NAG HO6 H N N 279 +PHE N N N N 280 +PHE CA C N S 281 +PHE C C N N 282 +PHE O O N N 283 +PHE CB C N N 284 +PHE CG C Y N 285 +PHE CD1 C Y N 286 +PHE CD2 C Y N 287 +PHE CE1 C Y N 288 +PHE CE2 C Y N 289 +PHE CZ C Y N 290 +PHE OXT O N N 291 +PHE H H N N 292 +PHE H2 H N N 293 +PHE HA H N N 294 +PHE HB2 H N N 295 +PHE HB3 H N N 296 +PHE HD1 H N N 297 +PHE HD2 H N N 298 +PHE HE1 H N N 299 +PHE HE2 H N N 300 +PHE HZ H N N 301 +PHE HXT H N N 302 +PRO N N N N 303 +PRO CA C N S 304 +PRO C C N N 305 +PRO O O N N 306 +PRO CB C N N 307 +PRO CG C N N 308 +PRO CD C N N 309 +PRO OXT O N N 310 +PRO H H N N 311 +PRO HA H N N 312 +PRO HB2 H N N 313 +PRO HB3 H N N 314 +PRO HG2 H N N 315 +PRO HG3 H N N 316 +PRO HD2 H N N 317 +PRO HD3 H N N 318 +PRO HXT H N N 319 +SER N N N N 320 +SER CA C N S 321 +SER C C N N 322 +SER O O N N 323 +SER CB C N N 324 +SER OG O N N 325 +SER OXT O N N 326 +SER H H N N 327 +SER H2 H N N 328 +SER HA H N N 329 +SER HB2 H N N 330 +SER HB3 H N N 331 +SER HG H N N 332 +SER HXT H N N 333 +THR N N N N 334 +THR CA C N S 335 +THR C C N N 336 +THR O O N N 337 +THR CB C N R 338 +THR OG1 O N N 339 +THR CG2 C N N 340 +THR OXT O N N 341 +THR H H N N 342 +THR H2 H N N 343 +THR HA H N N 344 +THR HB H N N 345 +THR HG1 H N N 346 +THR HG21 H N N 347 +THR HG22 H N N 348 +THR HG23 H N N 349 +THR HXT H N N 350 +TRP N N N N 351 +TRP CA C N S 352 +TRP C C N N 353 +TRP O O N N 354 +TRP CB C N N 355 +TRP CG C Y N 356 +TRP CD1 C Y N 357 +TRP CD2 C Y N 358 +TRP NE1 N Y N 359 +TRP CE2 C Y N 360 +TRP CE3 C Y N 361 +TRP CZ2 C Y N 362 +TRP CZ3 C Y N 363 +TRP CH2 C Y N 364 +TRP OXT O N N 365 +TRP H H N N 366 +TRP H2 H N N 367 +TRP HA H N N 368 +TRP HB2 H N N 369 +TRP HB3 H N N 370 +TRP HD1 H N N 371 +TRP HE1 H N N 372 +TRP HE3 H N N 373 +TRP HZ2 H N N 374 +TRP HZ3 H N N 375 +TRP HH2 H N N 376 +TRP HXT H N N 377 +TYR N N N N 378 +TYR CA C N S 379 +TYR C C N N 380 +TYR O O N N 381 +TYR CB C N N 382 +TYR CG C Y N 383 +TYR CD1 C Y N 384 +TYR CD2 C Y N 385 +TYR CE1 C Y N 386 +TYR CE2 C Y N 387 +TYR CZ C Y N 388 +TYR OH O N N 389 +TYR OXT O N N 390 +TYR H H N N 391 +TYR H2 H N N 392 +TYR HA H N N 393 +TYR HB2 H N N 394 +TYR HB3 H N N 395 +TYR HD1 H N N 396 +TYR HD2 H N N 397 +TYR HE1 H N N 398 +TYR HE2 H N N 399 +TYR HH H N N 400 +TYR HXT H N N 401 +VAL N N N N 402 +VAL CA C N S 403 +VAL C C N N 404 +VAL O O N N 405 +VAL CB C N N 406 +VAL CG1 C N N 407 +VAL CG2 C N N 408 +VAL OXT O N N 409 +VAL H H N N 410 +VAL H2 H N N 411 +VAL HA H N N 412 +VAL HB H N N 413 +VAL HG11 H N N 414 +VAL HG12 H N N 415 +VAL HG13 H N N 416 +VAL HG21 H N N 417 +VAL HG22 H N N 418 +VAL HG23 H N N 419 +VAL HXT H N N 420 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +GLN N CA sing N N 83 +GLN N H sing N N 84 +GLN N H2 sing N N 85 +GLN CA C sing N N 86 +GLN CA CB sing N N 87 +GLN CA HA sing N N 88 +GLN C O doub N N 89 +GLN C OXT sing N N 90 +GLN CB CG sing N N 91 +GLN CB HB2 sing N N 92 +GLN CB HB3 sing N N 93 +GLN CG CD sing N N 94 +GLN CG HG2 sing N N 95 +GLN CG HG3 sing N N 96 +GLN CD OE1 doub N N 97 +GLN CD NE2 sing N N 98 +GLN NE2 HE21 sing N N 99 +GLN NE2 HE22 sing N N 100 +GLN OXT HXT sing N N 101 +GLU N CA sing N N 102 +GLU N H sing N N 103 +GLU N H2 sing N N 104 +GLU CA C sing N N 105 +GLU CA CB sing N N 106 +GLU CA HA sing N N 107 +GLU C O doub N N 108 +GLU C OXT sing N N 109 +GLU CB CG sing N N 110 +GLU CB HB2 sing N N 111 +GLU CB HB3 sing N N 112 +GLU CG CD sing N N 113 +GLU CG HG2 sing N N 114 +GLU CG HG3 sing N N 115 +GLU CD OE1 doub N N 116 +GLU CD OE2 sing N N 117 +GLU OE2 HE2 sing N N 118 +GLU OXT HXT sing N N 119 +GLY N CA sing N N 120 +GLY N H sing N N 121 +GLY N H2 sing N N 122 +GLY CA C sing N N 123 +GLY CA HA2 sing N N 124 +GLY CA HA3 sing N N 125 +GLY C O doub N N 126 +GLY C OXT sing N N 127 +GLY OXT HXT sing N N 128 +HIS N CA sing N N 129 +HIS N H sing N N 130 +HIS N H2 sing N N 131 +HIS CA C sing N N 132 +HIS CA CB sing N N 133 +HIS CA HA sing N N 134 +HIS C O doub N N 135 +HIS C OXT sing N N 136 +HIS CB CG sing N N 137 +HIS CB HB2 sing N N 138 +HIS CB HB3 sing N N 139 +HIS CG ND1 sing Y N 140 +HIS CG CD2 doub Y N 141 +HIS ND1 CE1 doub Y N 142 +HIS ND1 HD1 sing N N 143 +HIS CD2 NE2 sing Y N 144 +HIS CD2 HD2 sing N N 145 +HIS CE1 NE2 sing Y N 146 +HIS CE1 HE1 sing N N 147 +HIS NE2 HE2 sing N N 148 +HIS OXT HXT sing N N 149 +HOH O H1 sing N N 150 +HOH O H2 sing N N 151 +ILE N CA sing N N 152 +ILE N H sing N N 153 +ILE N H2 sing N N 154 +ILE CA C sing N N 155 +ILE CA CB sing N N 156 +ILE CA HA sing N N 157 +ILE C O doub N N 158 +ILE C OXT sing N N 159 +ILE CB CG1 sing N N 160 +ILE CB CG2 sing N N 161 +ILE CB HB sing N N 162 +ILE CG1 CD1 sing N N 163 +ILE CG1 HG12 sing N N 164 +ILE CG1 HG13 sing N N 165 +ILE CG2 HG21 sing N N 166 +ILE CG2 HG22 sing N N 167 +ILE CG2 HG23 sing N N 168 +ILE CD1 HD11 sing N N 169 +ILE CD1 HD12 sing N N 170 +ILE CD1 HD13 sing N N 171 +ILE OXT HXT sing N N 172 +LEU N CA sing N N 173 +LEU N H sing N N 174 +LEU N H2 sing N N 175 +LEU CA C sing N N 176 +LEU CA CB sing N N 177 +LEU CA HA sing N N 178 +LEU C O doub N N 179 +LEU C OXT sing N N 180 +LEU CB CG sing N N 181 +LEU CB HB2 sing N N 182 +LEU CB HB3 sing N N 183 +LEU CG CD1 sing N N 184 +LEU CG CD2 sing N N 185 +LEU CG HG sing N N 186 +LEU CD1 HD11 sing N N 187 +LEU CD1 HD12 sing N N 188 +LEU CD1 HD13 sing N N 189 +LEU CD2 HD21 sing N N 190 +LEU CD2 HD22 sing N N 191 +LEU CD2 HD23 sing N N 192 +LEU OXT HXT sing N N 193 +LYS N CA sing N N 194 +LYS N H sing N N 195 +LYS N H2 sing N N 196 +LYS CA C sing N N 197 +LYS CA CB sing N N 198 +LYS CA HA sing N N 199 +LYS C O doub N N 200 +LYS C OXT sing N N 201 +LYS CB CG sing N N 202 +LYS CB HB2 sing N N 203 +LYS CB HB3 sing N N 204 +LYS CG CD sing N N 205 +LYS CG HG2 sing N N 206 +LYS CG HG3 sing N N 207 +LYS CD CE sing N N 208 +LYS CD HD2 sing N N 209 +LYS CD HD3 sing N N 210 +LYS CE NZ sing N N 211 +LYS CE HE2 sing N N 212 +LYS CE HE3 sing N N 213 +LYS NZ HZ1 sing N N 214 +LYS NZ HZ2 sing N N 215 +LYS NZ HZ3 sing N N 216 +LYS OXT HXT sing N N 217 +MET N CA sing N N 218 +MET N H sing N N 219 +MET N H2 sing N N 220 +MET CA C sing N N 221 +MET CA CB sing N N 222 +MET CA HA sing N N 223 +MET C O doub N N 224 +MET C OXT sing N N 225 +MET CB CG sing N N 226 +MET CB HB2 sing N N 227 +MET CB HB3 sing N N 228 +MET CG SD sing N N 229 +MET CG HG2 sing N N 230 +MET CG HG3 sing N N 231 +MET SD CE sing N N 232 +MET CE HE1 sing N N 233 +MET CE HE2 sing N N 234 +MET CE HE3 sing N N 235 +MET OXT HXT sing N N 236 +NAG C1 C2 sing N N 237 +NAG C1 O1 sing N N 238 +NAG C1 O5 sing N N 239 +NAG C1 H1 sing N N 240 +NAG C2 C3 sing N N 241 +NAG C2 N2 sing N N 242 +NAG C2 H2 sing N N 243 +NAG C3 C4 sing N N 244 +NAG C3 O3 sing N N 245 +NAG C3 H3 sing N N 246 +NAG C4 C5 sing N N 247 +NAG C4 O4 sing N N 248 +NAG C4 H4 sing N N 249 +NAG C5 C6 sing N N 250 +NAG C5 O5 sing N N 251 +NAG C5 H5 sing N N 252 +NAG C6 O6 sing N N 253 +NAG C6 H61 sing N N 254 +NAG C6 H62 sing N N 255 +NAG C7 C8 sing N N 256 +NAG C7 N2 sing N N 257 +NAG C7 O7 doub N N 258 +NAG C8 H81 sing N N 259 +NAG C8 H82 sing N N 260 +NAG C8 H83 sing N N 261 +NAG N2 HN2 sing N N 262 +NAG O1 HO1 sing N N 263 +NAG O3 HO3 sing N N 264 +NAG O4 HO4 sing N N 265 +NAG O6 HO6 sing N N 266 +PHE N CA sing N N 267 +PHE N H sing N N 268 +PHE N H2 sing N N 269 +PHE CA C sing N N 270 +PHE CA CB sing N N 271 +PHE CA HA sing N N 272 +PHE C O doub N N 273 +PHE C OXT sing N N 274 +PHE CB CG sing N N 275 +PHE CB HB2 sing N N 276 +PHE CB HB3 sing N N 277 +PHE CG CD1 doub Y N 278 +PHE CG CD2 sing Y N 279 +PHE CD1 CE1 sing Y N 280 +PHE CD1 HD1 sing N N 281 +PHE CD2 CE2 doub Y N 282 +PHE CD2 HD2 sing N N 283 +PHE CE1 CZ doub Y N 284 +PHE CE1 HE1 sing N N 285 +PHE CE2 CZ sing Y N 286 +PHE CE2 HE2 sing N N 287 +PHE CZ HZ sing N N 288 +PHE OXT HXT sing N N 289 +PRO N CA sing N N 290 +PRO N CD sing N N 291 +PRO N H sing N N 292 +PRO CA C sing N N 293 +PRO CA CB sing N N 294 +PRO CA HA sing N N 295 +PRO C O doub N N 296 +PRO C OXT sing N N 297 +PRO CB CG sing N N 298 +PRO CB HB2 sing N N 299 +PRO CB HB3 sing N N 300 +PRO CG CD sing N N 301 +PRO CG HG2 sing N N 302 +PRO CG HG3 sing N N 303 +PRO CD HD2 sing N N 304 +PRO CD HD3 sing N N 305 +PRO OXT HXT sing N N 306 +SER N CA sing N N 307 +SER N H sing N N 308 +SER N H2 sing N N 309 +SER CA C sing N N 310 +SER CA CB sing N N 311 +SER CA HA sing N N 312 +SER C O doub N N 313 +SER C OXT sing N N 314 +SER CB OG sing N N 315 +SER CB HB2 sing N N 316 +SER CB HB3 sing N N 317 +SER OG HG sing N N 318 +SER OXT HXT sing N N 319 +THR N CA sing N N 320 +THR N H sing N N 321 +THR N H2 sing N N 322 +THR CA C sing N N 323 +THR CA CB sing N N 324 +THR CA HA sing N N 325 +THR C O doub N N 326 +THR C OXT sing N N 327 +THR CB OG1 sing N N 328 +THR CB CG2 sing N N 329 +THR CB HB sing N N 330 +THR OG1 HG1 sing N N 331 +THR CG2 HG21 sing N N 332 +THR CG2 HG22 sing N N 333 +THR CG2 HG23 sing N N 334 +THR OXT HXT sing N N 335 +TRP N CA sing N N 336 +TRP N H sing N N 337 +TRP N H2 sing N N 338 +TRP CA C sing N N 339 +TRP CA CB sing N N 340 +TRP CA HA sing N N 341 +TRP C O doub N N 342 +TRP C OXT sing N N 343 +TRP CB CG sing N N 344 +TRP CB HB2 sing N N 345 +TRP CB HB3 sing N N 346 +TRP CG CD1 doub Y N 347 +TRP CG CD2 sing Y N 348 +TRP CD1 NE1 sing Y N 349 +TRP CD1 HD1 sing N N 350 +TRP CD2 CE2 doub Y N 351 +TRP CD2 CE3 sing Y N 352 +TRP NE1 CE2 sing Y N 353 +TRP NE1 HE1 sing N N 354 +TRP CE2 CZ2 sing Y N 355 +TRP CE3 CZ3 doub Y N 356 +TRP CE3 HE3 sing N N 357 +TRP CZ2 CH2 doub Y N 358 +TRP CZ2 HZ2 sing N N 359 +TRP CZ3 CH2 sing Y N 360 +TRP CZ3 HZ3 sing N N 361 +TRP CH2 HH2 sing N N 362 +TRP OXT HXT sing N N 363 +TYR N CA sing N N 364 +TYR N H sing N N 365 +TYR N H2 sing N N 366 +TYR CA C sing N N 367 +TYR CA CB sing N N 368 +TYR CA HA sing N N 369 +TYR C O doub N N 370 +TYR C OXT sing N N 371 +TYR CB CG sing N N 372 +TYR CB HB2 sing N N 373 +TYR CB HB3 sing N N 374 +TYR CG CD1 doub Y N 375 +TYR CG CD2 sing Y N 376 +TYR CD1 CE1 sing Y N 377 +TYR CD1 HD1 sing N N 378 +TYR CD2 CE2 doub Y N 379 +TYR CD2 HD2 sing N N 380 +TYR CE1 CZ doub Y N 381 +TYR CE1 HE1 sing N N 382 +TYR CE2 CZ sing Y N 383 +TYR CE2 HE2 sing N N 384 +TYR CZ OH sing N N 385 +TYR OH HH sing N N 386 +TYR OXT HXT sing N N 387 +VAL N CA sing N N 388 +VAL N H sing N N 389 +VAL N H2 sing N N 390 +VAL CA C sing N N 391 +VAL CA CB sing N N 392 +VAL CA HA sing N N 393 +VAL C O doub N N 394 +VAL C OXT sing N N 395 +VAL CB CG1 sing N N 396 +VAL CB CG2 sing N N 397 +VAL CB HB sing N N 398 +VAL CG1 HG11 sing N N 399 +VAL CG1 HG12 sing N N 400 +VAL CG1 HG13 sing N N 401 +VAL CG2 HG21 sing N N 402 +VAL CG2 HG22 sing N N 403 +VAL CG2 HG23 sing N N 404 +VAL OXT HXT sing N N 405 +# +loop_ +_pdbx_entity_branch_list.entity_id +_pdbx_entity_branch_list.comp_id +_pdbx_entity_branch_list.num +_pdbx_entity_branch_list.hetero +4 NAG 1 n +4 NAG 2 n +# +_pdbx_initial_refinement_model.id 1 +_pdbx_initial_refinement_model.entity_id_list ? +_pdbx_initial_refinement_model.type 'experimental model' +_pdbx_initial_refinement_model.source_name PDB +_pdbx_initial_refinement_model.accession_code 6WG8 +_pdbx_initial_refinement_model.details ? +# +_atom_sites.entry_id 6WGL +_atom_sites.Cartn_transf_matrix[1][1] ? +_atom_sites.Cartn_transf_matrix[1][2] ? +_atom_sites.Cartn_transf_matrix[1][3] ? +_atom_sites.Cartn_transf_matrix[2][1] ? +_atom_sites.Cartn_transf_matrix[2][2] ? +_atom_sites.Cartn_transf_matrix[2][3] ? +_atom_sites.Cartn_transf_matrix[3][1] ? +_atom_sites.Cartn_transf_matrix[3][2] ? +_atom_sites.Cartn_transf_matrix[3][3] ? +_atom_sites.Cartn_transf_vector[1] ? +_atom_sites.Cartn_transf_vector[2] ? +_atom_sites.Cartn_transf_vector[3] ? +_atom_sites.fract_transf_matrix[1][1] 0.013607 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] -0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.013607 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] -0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.002425 +_atom_sites.fract_transf_vector[1] 0.000000 +_atom_sites.fract_transf_vector[2] 0.000000 +_atom_sites.fract_transf_vector[3] 0.000000 +_atom_sites.solution_primary ? +_atom_sites.solution_secondary ? +_atom_sites.solution_hydrogens ? +_atom_sites.special_details ? +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . GLU A 1 1 ? 64.420 -54.458 -18.934 1.00 92.58 ? 1 GLU A N 1 +ATOM 2 C CA . GLU A 1 1 ? 63.147 -53.754 -18.577 1.00 97.93 ? 1 GLU A CA 1 +ATOM 3 C C . GLU A 1 1 ? 62.059 -54.785 -18.255 1.00 98.38 ? 1 GLU A C 1 +ATOM 4 O O . GLU A 1 1 ? 62.358 -55.931 -17.918 1.00 78.79 ? 1 GLU A O 1 +ATOM 5 C CB . GLU A 1 1 ? 62.771 -52.750 -19.675 1.00 54.69 ? 1 GLU A CB 1 +ATOM 6 N N . VAL A 1 2 ? 60.793 -54.351 -18.331 1.00 83.59 ? 2 VAL A N 1 +ATOM 7 C CA . VAL A 1 2 ? 59.635 -55.177 -18.031 1.00 70.21 ? 2 VAL A CA 1 +ATOM 8 C C . VAL A 1 2 ? 58.664 -55.017 -19.193 1.00 65.68 ? 2 VAL A C 1 +ATOM 9 O O . VAL A 1 2 ? 58.152 -53.920 -19.404 1.00 64.05 ? 2 VAL A O 1 +ATOM 10 C CB . VAL A 1 2 ? 58.985 -54.751 -16.699 1.00 86.94 ? 2 VAL A CB 1 +ATOM 11 C CG1 . VAL A 1 2 ? 57.586 -55.322 -16.516 1.00 88.14 ? 2 VAL A CG1 1 +ATOM 12 C CG2 . VAL A 1 2 ? 59.857 -55.086 -15.501 1.00 112.14 ? 2 VAL A CG2 1 +ATOM 13 N N . GLN A 1 3 ? 58.415 -56.116 -19.920 1.00 74.22 ? 3 GLN A N 1 +ATOM 14 C CA . GLN A 1 3 ? 57.743 -56.052 -21.209 1.00 73.42 ? 3 GLN A CA 1 +ATOM 15 C C . GLN A 1 3 ? 56.642 -57.105 -21.330 1.00 69.74 ? 3 GLN A C 1 +ATOM 16 O O . GLN A 1 3 ? 56.727 -58.188 -20.749 1.00 64.44 ? 3 GLN A O 1 +ATOM 17 C CB . GLN A 1 3 ? 58.765 -56.195 -22.337 1.00 78.92 ? 3 GLN A CB 1 +ATOM 18 C CG . GLN A 1 3 ? 59.426 -54.883 -22.727 1.00 90.76 ? 3 GLN A CG 1 +ATOM 19 C CD . GLN A 1 3 ? 60.850 -55.085 -23.183 1.00 100.99 ? 3 GLN A CD 1 +ATOM 20 O OE1 . GLN A 1 3 ? 61.787 -55.090 -22.384 1.00 101.33 ? 3 GLN A OE1 1 +ATOM 21 N NE2 . GLN A 1 3 ? 61.021 -55.242 -24.486 1.00 83.91 ? 3 GLN A NE2 1 +ATOM 22 N N . LEU A 1 4 ? 55.612 -56.748 -22.108 1.00 54.55 ? 4 LEU A N 1 +ATOM 23 C CA . LEU A 1 4 ? 54.577 -57.663 -22.563 1.00 56.44 ? 4 LEU A CA 1 +ATOM 24 C C . LEU A 1 4 ? 54.526 -57.617 -24.088 1.00 56.45 ? 4 LEU A C 1 +ATOM 25 O O . LEU A 1 4 ? 54.478 -56.536 -24.674 1.00 52.64 ? 4 LEU A O 1 +ATOM 26 C CB . LEU A 1 4 ? 53.224 -57.249 -21.972 1.00 59.64 ? 4 LEU A CB 1 +ATOM 27 C CG . LEU A 1 4 ? 53.057 -57.412 -20.461 1.00 75.88 ? 4 LEU A CG 1 +ATOM 28 C CD1 . LEU A 1 4 ? 51.813 -56.681 -19.977 1.00 80.70 ? 4 LEU A CD1 1 +ATOM 29 C CD2 . LEU A 1 4 ? 52.994 -58.880 -20.061 1.00 83.47 ? 4 LEU A CD2 1 +ATOM 30 N N . VAL A 1 5 ? 54.538 -58.802 -24.713 1.00 47.82 ? 5 VAL A N 1 +ATOM 31 C CA . VAL A 1 5 ? 54.538 -58.925 -26.164 1.00 58.33 ? 5 VAL A CA 1 +ATOM 32 C C . VAL A 1 5 ? 53.393 -59.841 -26.584 1.00 65.27 ? 5 VAL A C 1 +ATOM 33 O O . VAL A 1 5 ? 53.288 -60.971 -26.102 1.00 65.16 ? 5 VAL A O 1 +ATOM 34 C CB . VAL A 1 5 ? 55.888 -59.431 -26.716 1.00 65.37 ? 5 VAL A CB 1 +ATOM 35 C CG1 . VAL A 1 5 ? 55.802 -59.728 -28.207 1.00 55.01 ? 5 VAL A CG1 1 +ATOM 36 C CG2 . VAL A 1 5 ? 57.040 -58.474 -26.421 1.00 56.46 ? 5 VAL A CG2 1 +ATOM 37 N N . GLU A 1 6 ? 52.574 -59.335 -27.515 1.00 57.91 ? 6 GLU A N 1 +ATOM 38 C CA . GLU A 1 6 ? 51.352 -60.000 -27.938 1.00 71.85 ? 6 GLU A CA 1 +ATOM 39 C C . GLU A 1 6 ? 51.544 -60.610 -29.325 1.00 68.15 ? 6 GLU A C 1 +ATOM 40 O O . GLU A 1 6 ? 52.455 -60.221 -30.050 1.00 83.95 ? 6 GLU A O 1 +ATOM 41 C CB . GLU A 1 6 ? 50.184 -59.012 -27.948 1.00 74.91 ? 6 GLU A CB 1 +ATOM 42 C CG . GLU A 1 6 ? 50.104 -58.143 -26.707 1.00 80.10 ? 6 GLU A CG 1 +ATOM 43 C CD . GLU A 1 6 ? 48.816 -57.350 -26.562 1.00 91.05 ? 6 GLU A CD 1 +ATOM 44 O OE1 . GLU A 1 6 ? 48.906 -56.125 -26.327 1.00 70.45 ? 6 GLU A OE1 1 +ATOM 45 O OE2 . GLU A 1 6 ? 47.725 -57.962 -26.674 1.00 77.59 ? 6 GLU A OE2 1 +ATOM 46 N N . SER A 1 7 ? 50.655 -61.550 -29.679 1.00 69.28 ? 7 SER A N 1 +ATOM 47 C CA . SER A 1 7 ? 50.675 -62.261 -30.949 1.00 69.11 ? 7 SER A CA 1 +ATOM 48 C C . SER A 1 7 ? 49.305 -62.878 -31.214 1.00 59.54 ? 7 SER A C 1 +ATOM 49 O O . SER A 1 7 ? 48.429 -62.835 -30.357 1.00 63.19 ? 7 SER A O 1 +ATOM 50 C CB . SER A 1 7 ? 51.711 -63.342 -30.908 1.00 64.86 ? 7 SER A CB 1 +ATOM 51 O OG . SER A 1 7 ? 51.512 -64.135 -29.749 1.00 70.31 ? 7 SER A OG 1 +ATOM 52 N N . GLY A 1 8 ? 49.152 -63.469 -32.404 1.00 78.41 ? 8 GLY A N 1 +ATOM 53 C CA . GLY A 1 8 ? 48.056 -64.377 -32.703 1.00 79.55 ? 8 GLY A CA 1 +ATOM 54 C C . GLY A 1 8 ? 46.837 -63.681 -33.304 1.00 71.89 ? 8 GLY A C 1 +ATOM 55 O O . GLY A 1 8 ? 45.740 -64.235 -33.281 1.00 92.97 ? 8 GLY A O 1 +ATOM 56 N N . GLY A 1 9 ? 47.036 -62.478 -33.851 1.00 58.69 ? 9 GLY A N 1 +ATOM 57 C CA . GLY A 1 9 ? 45.947 -61.734 -34.457 1.00 57.08 ? 9 GLY A CA 1 +ATOM 58 C C . GLY A 1 9 ? 46.007 -61.744 -35.983 1.00 83.77 ? 9 GLY A C 1 +ATOM 59 O O . GLY A 1 9 ? 47.072 -61.578 -36.584 1.00 97.28 ? 9 GLY A O 1 +ATOM 60 N N . GLY A 1 10 ? 44.829 -61.929 -36.588 1.00 65.58 ? 10 GLY A N 1 +ATOM 61 C CA . GLY A 1 10 ? 44.641 -61.829 -38.023 1.00 62.07 ? 10 GLY A CA 1 +ATOM 62 C C . GLY A 1 10 ? 43.160 -61.849 -38.386 1.00 61.86 ? 10 GLY A C 1 +ATOM 63 O O . GLY A 1 10 ? 42.314 -61.518 -37.556 1.00 63.00 ? 10 GLY A O 1 +ATOM 64 N N . LEU A 1 11 ? 42.871 -62.233 -39.638 1.00 77.67 ? 11 LEU A N 1 +ATOM 65 C CA . LEU A 1 11 ? 41.510 -62.306 -40.145 1.00 66.54 ? 11 LEU A CA 1 +ATOM 66 C C . LEU A 1 11 ? 40.952 -63.704 -39.903 1.00 71.84 ? 11 LEU A C 1 +ATOM 67 O O . LEU A 1 11 ? 41.574 -64.693 -40.290 1.00 75.86 ? 11 LEU A O 1 +ATOM 68 C CB . LEU A 1 11 ? 41.485 -61.949 -41.635 1.00 60.72 ? 11 LEU A CB 1 +ATOM 69 C CG . LEU A 1 11 ? 40.114 -62.041 -42.304 1.00 63.19 ? 11 LEU A CG 1 +ATOM 70 C CD1 . LEU A 1 11 ? 39.247 -60.845 -41.940 1.00 48.85 ? 11 LEU A CD1 1 +ATOM 71 C CD2 . LEU A 1 11 ? 40.245 -62.177 -43.815 1.00 61.06 ? 11 LEU A CD2 1 +ATOM 72 N N . GLU A 1 12 ? 39.780 -63.745 -39.249 1.00 80.74 ? 12 GLU A N 1 +ATOM 73 C CA . GLU A 1 12 ? 39.000 -64.951 -39.016 1.00 63.65 ? 12 GLU A CA 1 +ATOM 74 C C . GLU A 1 12 ? 37.572 -64.775 -39.533 1.00 67.14 ? 12 GLU A C 1 +ATOM 75 O O . GLU A 1 12 ? 37.102 -63.651 -39.721 1.00 77.84 ? 12 GLU A O 1 +ATOM 76 C CB . GLU A 1 12 ? 39.038 -65.366 -37.544 1.00 60.17 ? 12 GLU A CB 1 +ATOM 77 C CG . GLU A 1 12 ? 39.739 -66.698 -37.330 1.00 91.36 ? 12 GLU A CG 1 +ATOM 78 C CD . GLU A 1 12 ? 39.434 -67.787 -38.352 1.00 102.50 ? 12 GLU A CD 1 +ATOM 79 O OE1 . GLU A 1 12 ? 38.238 -68.068 -38.590 1.00 93.07 ? 12 GLU A OE1 1 +ATOM 80 O OE2 . GLU A 1 12 ? 40.395 -68.340 -38.929 1.00 105.29 ? 12 GLU A OE2 1 +ATOM 81 N N . GLN A 1 13 ? 36.893 -65.906 -39.767 1.00 57.03 ? 13 GLN A N 1 +ATOM 82 C CA . GLN A 1 13 ? 35.559 -65.910 -40.354 1.00 59.23 ? 13 GLN A CA 1 +ATOM 83 C C . GLN A 1 13 ? 34.514 -65.680 -39.263 1.00 65.53 ? 13 GLN A C 1 +ATOM 84 O O . GLN A 1 13 ? 34.748 -66.033 -38.105 1.00 75.08 ? 13 GLN A O 1 +ATOM 85 C CB . GLN A 1 13 ? 35.313 -67.230 -41.091 1.00 67.26 ? 13 GLN A CB 1 +ATOM 86 N N . PRO A 1 14 ? 33.343 -65.069 -39.581 1.00 70.06 ? 14 PRO A N 1 +ATOM 87 C CA . PRO A 1 14 ? 32.218 -65.017 -38.642 1.00 65.66 ? 14 PRO A CA 1 +ATOM 88 C C . PRO A 1 14 ? 31.741 -66.427 -38.313 1.00 68.45 ? 14 PRO A C 1 +ATOM 89 O O . PRO A 1 14 ? 31.187 -67.113 -39.170 1.00 91.97 ? 14 PRO A O 1 +ATOM 90 C CB . PRO A 1 14 ? 31.136 -64.219 -39.385 1.00 57.20 ? 14 PRO A CB 1 +ATOM 91 C CG . PRO A 1 14 ? 31.916 -63.424 -40.414 1.00 69.84 ? 14 PRO A CG 1 +ATOM 92 C CD . PRO A 1 14 ? 33.050 -64.340 -40.828 1.00 74.47 ? 14 PRO A CD 1 +ATOM 93 N N . GLY A 1 15 ? 31.998 -66.848 -37.069 1.00 61.25 ? 15 GLY A N 1 +ATOM 94 C CA . GLY A 1 15 ? 31.702 -68.194 -36.609 1.00 51.75 ? 15 GLY A CA 1 +ATOM 95 C C . GLY A 1 15 ? 32.971 -68.957 -36.236 1.00 71.25 ? 15 GLY A C 1 +ATOM 96 O O . GLY A 1 15 ? 32.896 -70.021 -35.618 1.00 81.88 ? 15 GLY A O 1 +ATOM 97 N N . GLY A 1 16 ? 34.130 -68.389 -36.601 1.00 77.17 ? 16 GLY A N 1 +ATOM 98 C CA . GLY A 1 16 ? 35.426 -69.015 -36.388 1.00 68.05 ? 16 GLY A CA 1 +ATOM 99 C C . GLY A 1 16 ? 35.959 -68.858 -34.964 1.00 56.90 ? 16 GLY A C 1 +ATOM 100 O O . GLY A 1 16 ? 35.303 -68.301 -34.084 1.00 59.05 ? 16 GLY A O 1 +ATOM 101 N N . SER A 1 17 ? 37.182 -69.360 -34.772 1.00 55.44 ? 17 SER A N 1 +ATOM 102 C CA . SER A 1 17 ? 37.904 -69.309 -33.515 1.00 62.27 ? 17 SER A CA 1 +ATOM 103 C C . SER A 1 17 ? 39.311 -68.760 -33.749 1.00 75.43 ? 17 SER A C 1 +ATOM 104 O O . SER A 1 17 ? 39.873 -68.934 -34.830 1.00 81.62 ? 17 SER A O 1 +ATOM 105 C CB . SER A 1 17 ? 37.924 -70.676 -32.871 1.00 63.38 ? 17 SER A CB 1 +ATOM 106 O OG . SER A 1 17 ? 39.203 -70.977 -32.330 1.00 78.47 ? 17 SER A OG 1 +ATOM 107 N N . LEU A 1 18 ? 39.857 -68.095 -32.719 1.00 85.67 ? 18 LEU A N 1 +ATOM 108 C CA . LEU A 1 18 ? 41.210 -67.555 -32.711 1.00 77.11 ? 18 LEU A CA 1 +ATOM 109 C C . LEU A 1 18 ? 41.764 -67.615 -31.288 1.00 71.15 ? 18 LEU A C 1 +ATOM 110 O O . LEU A 1 18 ? 41.000 -67.525 -30.329 1.00 96.57 ? 18 LEU A O 1 +ATOM 111 C CB . LEU A 1 18 ? 41.167 -66.113 -33.231 1.00 83.73 ? 18 LEU A CB 1 +ATOM 112 C CG . LEU A 1 18 ? 42.454 -65.586 -33.868 1.00 89.44 ? 18 LEU A CG 1 +ATOM 113 C CD1 . LEU A 1 18 ? 42.693 -66.215 -35.235 1.00 114.98 ? 18 LEU A CD1 1 +ATOM 114 C CD2 . LEU A 1 18 ? 42.404 -64.075 -34.001 1.00 79.85 ? 18 LEU A CD2 1 +ATOM 115 N N . ARG A 1 19 ? 43.090 -67.782 -31.162 1.00 57.51 ? 19 ARG A N 1 +ATOM 116 C CA . ARG A 1 19 ? 43.751 -67.827 -29.865 1.00 78.36 ? 19 ARG A CA 1 +ATOM 117 C C . ARG A 1 19 ? 44.811 -66.730 -29.792 1.00 94.80 ? 19 ARG A C 1 +ATOM 118 O O . ARG A 1 19 ? 45.741 -66.706 -30.599 1.00 107.56 ? 19 ARG A O 1 +ATOM 119 C CB . ARG A 1 19 ? 44.350 -69.205 -29.551 1.00 66.52 ? 19 ARG A CB 1 +ATOM 120 C CG . ARG A 1 19 ? 44.928 -69.305 -28.144 1.00 66.60 ? 19 ARG A CG 1 +ATOM 121 C CD . ARG A 1 19 ? 45.526 -70.636 -27.725 1.00 92.47 ? 19 ARG A CD 1 +ATOM 122 N NE . ARG A 1 19 ? 46.934 -70.783 -28.082 1.00 105.97 ? 19 ARG A NE 1 +ATOM 123 C CZ . ARG A 1 19 ? 47.743 -71.751 -27.650 1.00 119.38 ? 19 ARG A CZ 1 +ATOM 124 N NH1 . ARG A 1 19 ? 48.976 -71.838 -28.121 1.00 95.38 ? 19 ARG A NH1 1 +ATOM 125 N NH2 . ARG A 1 19 ? 47.323 -72.630 -26.755 1.00 143.23 ? 19 ARG A NH2 1 +ATOM 126 N N . LEU A 1 20 ? 44.653 -65.839 -28.803 1.00 76.72 ? 20 LEU A N 1 +ATOM 127 C CA . LEU A 1 20 ? 45.583 -64.743 -28.589 1.00 60.32 ? 20 LEU A CA 1 +ATOM 128 C C . LEU A 1 20 ? 46.612 -65.173 -27.554 1.00 56.69 ? 20 LEU A C 1 +ATOM 129 O O . LEU A 1 20 ? 46.365 -66.097 -26.784 1.00 67.81 ? 20 LEU A O 1 +ATOM 130 C CB . LEU A 1 20 ? 44.814 -63.500 -28.129 1.00 72.39 ? 20 LEU A CB 1 +ATOM 131 C CG . LEU A 1 20 ? 43.836 -62.898 -29.139 1.00 60.08 ? 20 LEU A CG 1 +ATOM 132 C CD1 . LEU A 1 20 ? 43.226 -61.615 -28.586 1.00 48.19 ? 20 LEU A CD1 1 +ATOM 133 C CD2 . LEU A 1 20 ? 44.530 -62.625 -30.463 1.00 45.50 ? 20 LEU A CD2 1 +ATOM 134 N N . SER A 1 21 ? 47.764 -64.493 -27.561 1.00 59.48 ? 21 SER A N 1 +ATOM 135 C CA . SER A 1 21 ? 48.879 -64.861 -26.705 1.00 60.51 ? 21 SER A CA 1 +ATOM 136 C C . SER A 1 21 ? 49.600 -63.622 -26.183 1.00 60.68 ? 21 SER A C 1 +ATOM 137 O O . SER A 1 21 ? 49.648 -62.591 -26.849 1.00 72.60 ? 21 SER A O 1 +ATOM 138 C CB . SER A 1 21 ? 49.826 -65.787 -27.405 1.00 55.89 ? 21 SER A CB 1 +ATOM 139 O OG . SER A 1 21 ? 50.877 -66.148 -26.528 1.00 52.57 ? 21 SER A OG 1 +ATOM 140 N N . CYS A 1 22 ? 50.174 -63.760 -24.985 1.00 53.49 ? 22 CYS A N 1 +ATOM 141 C CA . CYS A 1 22 ? 50.848 -62.664 -24.319 1.00 64.03 ? 22 CYS A CA 1 +ATOM 142 C C . CYS A 1 22 ? 52.076 -63.191 -23.586 1.00 63.81 ? 22 CYS A C 1 +ATOM 143 O O . CYS A 1 22 ? 51.982 -63.717 -22.474 1.00 57.62 ? 22 CYS A O 1 +ATOM 144 C CB . CYS A 1 22 ? 49.914 -61.942 -23.359 1.00 77.88 ? 22 CYS A CB 1 +ATOM 145 S SG . CYS A 1 22 ? 50.752 -60.649 -22.406 1.00 88.20 ? 22 CYS A SG 1 +ATOM 146 N N . ALA A 1 23 ? 53.221 -63.046 -24.257 1.00 62.66 ? 23 ALA A N 1 +ATOM 147 C CA . ALA A 1 23 ? 54.521 -63.288 -23.664 1.00 66.45 ? 23 ALA A CA 1 +ATOM 148 C C . ALA A 1 23 ? 54.831 -62.115 -22.744 1.00 66.91 ? 23 ALA A C 1 +ATOM 149 O O . ALA A 1 23 ? 54.545 -60.971 -23.092 1.00 62.84 ? 23 ALA A O 1 +ATOM 150 C CB . ALA A 1 23 ? 55.548 -63.418 -24.759 1.00 72.72 ? 23 ALA A CB 1 +ATOM 151 N N . GLY A 1 24 ? 55.395 -62.419 -21.571 1.00 60.83 ? 24 GLY A N 1 +ATOM 152 C CA . GLY A 1 24 ? 55.710 -61.407 -20.580 1.00 60.49 ? 24 GLY A CA 1 +ATOM 153 C C . GLY A 1 24 ? 57.028 -61.712 -19.880 1.00 70.23 ? 24 GLY A C 1 +ATOM 154 O O . GLY A 1 24 ? 57.270 -62.858 -19.494 1.00 54.33 ? 24 GLY A O 1 +ATOM 155 N N . SER A 1 25 ? 57.845 -60.661 -19.715 1.00 69.67 ? 25 SER A N 1 +ATOM 156 C CA . SER A 1 25 ? 59.210 -60.776 -19.223 1.00 66.05 ? 25 SER A CA 1 +ATOM 157 C C . SER A 1 25 ? 59.524 -59.637 -18.260 1.00 59.25 ? 25 SER A C 1 +ATOM 158 O O . SER A 1 25 ? 59.001 -58.536 -18.409 1.00 79.27 ? 25 SER A O 1 +ATOM 159 C CB . SER A 1 25 ? 60.183 -60.781 -20.373 1.00 70.04 ? 25 SER A CB 1 +ATOM 160 O OG . SER A 1 25 ? 60.061 -59.590 -21.138 1.00 73.25 ? 25 SER A OG 1 +ATOM 161 N N . GLY A 1 26 ? 60.390 -59.922 -17.280 1.00 65.07 ? 26 GLY A N 1 +ATOM 162 C CA . GLY A 1 26 ? 60.965 -58.897 -16.421 1.00 71.54 ? 26 GLY A CA 1 +ATOM 163 C C . GLY A 1 26 ? 60.420 -58.906 -14.993 1.00 81.26 ? 26 GLY A C 1 +ATOM 164 O O . GLY A 1 26 ? 60.628 -57.944 -14.253 1.00 73.54 ? 26 GLY A O 1 +ATOM 165 N N . PHE A 1 27 ? 59.737 -59.997 -14.613 1.00 77.01 ? 27 PHE A N 1 +ATOM 166 C CA . PHE A 1 27 ? 59.127 -60.131 -13.297 1.00 71.37 ? 27 PHE A CA 1 +ATOM 167 C C . PHE A 1 27 ? 58.734 -61.586 -13.051 1.00 79.58 ? 27 PHE A C 1 +ATOM 168 O O . PHE A 1 27 ? 59.171 -62.483 -13.774 1.00 93.14 ? 27 PHE A O 1 +ATOM 169 C CB . PHE A 1 27 ? 57.913 -59.206 -13.165 1.00 77.27 ? 27 PHE A CB 1 +ATOM 170 C CG . PHE A 1 27 ? 56.851 -59.359 -14.229 1.00 84.38 ? 27 PHE A CG 1 +ATOM 171 C CD1 . PHE A 1 27 ? 56.936 -58.664 -15.427 1.00 85.80 ? 27 PHE A CD1 1 +ATOM 172 C CD2 . PHE A 1 27 ? 55.745 -60.173 -14.023 1.00 76.90 ? 27 PHE A CD2 1 +ATOM 173 C CE1 . PHE A 1 27 ? 55.951 -58.786 -16.398 1.00 78.37 ? 27 PHE A CE1 1 +ATOM 174 C CE2 . PHE A 1 27 ? 54.762 -60.298 -14.995 1.00 75.88 ? 27 PHE A CE2 1 +ATOM 175 C CZ . PHE A 1 27 ? 54.865 -59.604 -16.181 1.00 75.52 ? 27 PHE A CZ 1 +ATOM 176 N N . THR A 1 28 ? 57.913 -61.798 -12.013 1.00 51.74 ? 28 THR A N 1 +ATOM 177 C CA . THR A 1 28 ? 57.312 -63.093 -11.748 1.00 47.68 ? 28 THR A CA 1 +ATOM 178 C C . THR A 1 28 ? 55.880 -63.070 -12.273 1.00 54.51 ? 28 THR A C 1 +ATOM 179 O O . THR A 1 28 ? 54.984 -62.554 -11.607 1.00 67.64 ? 28 THR A O 1 +ATOM 180 C CB . THR A 1 28 ? 57.450 -63.501 -10.270 1.00 53.40 ? 28 THR A CB 1 +ATOM 181 O OG1 . THR A 1 28 ? 58.823 -63.443 -9.870 1.00 47.28 ? 28 THR A OG1 1 +ATOM 182 C CG2 . THR A 1 28 ? 56.894 -64.883 -9.980 1.00 42.53 ? 28 THR A CG2 1 +ATOM 183 N N . PHE A 1 29 ? 55.687 -63.642 -13.470 1.00 55.43 ? 29 PHE A N 1 +ATOM 184 C CA . PHE A 1 29 ? 54.400 -63.674 -14.148 1.00 51.89 ? 29 PHE A CA 1 +ATOM 185 C C . PHE A 1 29 ? 53.297 -64.110 -13.178 1.00 52.06 ? 29 PHE A C 1 +ATOM 186 O O . PHE A 1 29 ? 52.261 -63.456 -13.077 1.00 71.33 ? 29 PHE A O 1 +ATOM 187 C CB . PHE A 1 29 ? 54.487 -64.520 -15.423 1.00 40.84 ? 29 PHE A CB 1 +ATOM 188 C CG . PHE A 1 29 ? 53.355 -64.322 -16.404 1.00 45.77 ? 29 PHE A CG 1 +ATOM 189 C CD1 . PHE A 1 29 ? 53.278 -63.175 -17.191 1.00 48.30 ? 29 PHE A CD1 1 +ATOM 190 C CD2 . PHE A 1 29 ? 52.367 -65.288 -16.560 1.00 41.69 ? 29 PHE A CD2 1 +ATOM 191 C CE1 . PHE A 1 29 ? 52.239 -62.989 -18.098 1.00 38.58 ? 29 PHE A CE1 1 +ATOM 192 C CE2 . PHE A 1 29 ? 51.325 -65.103 -17.462 1.00 42.43 ? 29 PHE A CE2 1 +ATOM 193 C CZ . PHE A 1 29 ? 51.262 -63.952 -18.230 1.00 39.58 ? 29 PHE A CZ 1 +ATOM 194 N N . ARG A 1 30 ? 53.572 -65.183 -12.430 1.00 48.05 ? 30 ARG A N 1 +ATOM 195 C CA . ARG A 1 30 ? 52.656 -65.856 -11.522 1.00 61.49 ? 30 ARG A CA 1 +ATOM 196 C C . ARG A 1 30 ? 52.177 -64.922 -10.403 1.00 79.90 ? 30 ARG A C 1 +ATOM 197 O O . ARG A 1 30 ? 51.049 -65.061 -9.935 1.00 80.99 ? 30 ARG A O 1 +ATOM 198 C CB . ARG A 1 30 ? 53.358 -67.114 -10.993 1.00 71.26 ? 30 ARG A CB 1 +ATOM 199 C CG . ARG A 1 30 ? 52.457 -68.146 -10.328 1.00 78.82 ? 30 ARG A CG 1 +ATOM 200 C CD . ARG A 1 30 ? 52.691 -68.209 -8.830 1.00 85.15 ? 30 ARG A CD 1 +ATOM 201 N NE . ARG A 1 30 ? 51.996 -67.131 -8.141 1.00 83.88 ? 30 ARG A NE 1 +ATOM 202 C CZ . ARG A 1 30 ? 50.800 -67.227 -7.568 1.00 89.84 ? 30 ARG A CZ 1 +ATOM 203 N NH1 . ARG A 1 30 ? 49.972 -66.198 -7.617 1.00 95.46 ? 30 ARG A NH1 1 +ATOM 204 N NH2 . ARG A 1 30 ? 50.425 -68.347 -6.972 1.00 89.43 ? 30 ARG A NH2 1 +ATOM 205 N N . ASP A 1 31 ? 53.022 -63.970 -9.976 1.00 71.40 ? 31 ASP A N 1 +ATOM 206 C CA . ASP A 1 31 ? 52.699 -63.085 -8.863 1.00 68.28 ? 31 ASP A CA 1 +ATOM 207 C C . ASP A 1 31 ? 51.535 -62.152 -9.196 1.00 69.54 ? 31 ASP A C 1 +ATOM 208 O O . ASP A 1 31 ? 50.910 -61.618 -8.281 1.00 66.35 ? 31 ASP A O 1 +ATOM 209 C CB . ASP A 1 31 ? 53.902 -62.244 -8.422 1.00 63.58 ? 31 ASP A CB 1 +ATOM 210 C CG . ASP A 1 31 ? 54.923 -62.988 -7.578 1.00 60.53 ? 31 ASP A CG 1 +ATOM 211 O OD1 . ASP A 1 31 ? 54.731 -64.195 -7.357 1.00 55.43 ? 31 ASP A OD1 1 +ATOM 212 O OD2 . ASP A 1 31 ? 55.912 -62.350 -7.154 1.00 63.92 ? 31 ASP A OD2 1 +ATOM 213 N N . TYR A 1 32 ? 51.242 -61.977 -10.494 1.00 65.63 ? 32 TYR A N 1 +ATOM 214 C CA . TYR A 1 32 ? 50.437 -60.861 -10.968 1.00 50.99 ? 32 TYR A CA 1 +ATOM 215 C C . TYR A 1 32 ? 49.180 -61.332 -11.697 1.00 58.78 ? 32 TYR A C 1 +ATOM 216 O O . TYR A 1 32 ? 49.185 -62.354 -12.380 1.00 57.41 ? 32 TYR A O 1 +ATOM 217 C CB . TYR A 1 32 ? 51.298 -59.929 -11.823 1.00 39.69 ? 32 TYR A CB 1 +ATOM 218 C CG . TYR A 1 32 ? 52.417 -59.287 -11.047 1.00 54.88 ? 32 TYR A CG 1 +ATOM 219 C CD1 . TYR A 1 32 ? 52.185 -58.176 -10.247 1.00 64.42 ? 32 TYR A CD1 1 +ATOM 220 C CD2 . TYR A 1 32 ? 53.704 -59.808 -11.077 1.00 54.20 ? 32 TYR A CD2 1 +ATOM 221 C CE1 . TYR A 1 32 ? 53.200 -57.597 -9.499 1.00 54.64 ? 32 TYR A CE1 1 +ATOM 222 C CE2 . TYR A 1 32 ? 54.733 -59.234 -10.344 1.00 62.02 ? 32 TYR A CE2 1 +ATOM 223 C CZ . TYR A 1 32 ? 54.478 -58.127 -9.550 1.00 59.14 ? 32 TYR A CZ 1 +ATOM 224 O OH . TYR A 1 32 ? 55.475 -57.554 -8.817 1.00 70.01 ? 32 TYR A OH 1 +ATOM 225 N N . ALA A 1 33 ? 48.104 -60.554 -11.532 1.00 47.51 ? 33 ALA A N 1 +ATOM 226 C CA . ALA A 1 33 ? 46.892 -60.703 -12.316 1.00 58.67 ? 33 ALA A CA 1 +ATOM 227 C C . ALA A 1 33 ? 47.123 -60.077 -13.687 1.00 59.09 ? 33 ALA A C 1 +ATOM 228 O O . ALA A 1 33 ? 47.991 -59.218 -13.820 1.00 67.00 ? 33 ALA A O 1 +ATOM 229 C CB . ALA A 1 33 ? 45.738 -60.041 -11.607 1.00 60.74 ? 33 ALA A CB 1 +ATOM 230 N N . MET A 1 34 ? 46.355 -60.530 -14.690 1.00 49.35 ? 34 MET A N 1 +ATOM 231 C CA . MET A 1 34 ? 46.433 -59.989 -16.038 1.00 52.46 ? 34 MET A CA 1 +ATOM 232 C C . MET A 1 34 ? 45.030 -59.713 -16.567 1.00 57.25 ? 34 MET A C 1 +ATOM 233 O O . MET A 1 34 ? 44.056 -60.321 -16.114 1.00 43.46 ? 34 MET A O 1 +ATOM 234 C CB . MET A 1 34 ? 47.141 -60.940 -17.008 1.00 57.34 ? 34 MET A CB 1 +ATOM 235 C CG . MET A 1 34 ? 48.466 -61.494 -16.505 1.00 61.54 ? 34 MET A CG 1 +ATOM 236 S SD . MET A 1 34 ? 49.798 -60.279 -16.389 1.00 61.65 ? 34 MET A SD 1 +ATOM 237 C CE . MET A 1 34 ? 49.894 -59.716 -18.088 1.00 61.95 ? 34 MET A CE 1 +ATOM 238 N N . THR A 1 35 ? 44.975 -58.804 -17.553 1.00 50.32 ? 35 THR A N 1 +ATOM 239 C CA . THR A 1 35 ? 43.742 -58.230 -18.065 1.00 49.91 ? 35 THR A CA 1 +ATOM 240 C C . THR A 1 35 ? 43.838 -58.090 -19.581 1.00 46.86 ? 35 THR A C 1 +ATOM 241 O O . THR A 1 35 ? 44.890 -57.732 -20.100 1.00 62.70 ? 35 THR A O 1 +ATOM 242 C CB . THR A 1 35 ? 43.466 -56.876 -17.391 1.00 58.29 ? 35 THR A CB 1 +ATOM 243 O OG1 . THR A 1 35 ? 42.989 -57.133 -16.070 1.00 73.05 ? 35 THR A OG1 1 +ATOM 244 C CG2 . THR A 1 35 ? 42.466 -56.006 -18.123 1.00 46.89 ? 35 THR A CG2 1 +ATOM 245 N N . TRP A 1 36 ? 42.719 -58.349 -20.265 1.00 44.98 ? 36 TRP A N 1 +ATOM 246 C CA . TRP A 1 36 ? 42.576 -58.089 -21.688 1.00 51.10 ? 36 TRP A CA 1 +ATOM 247 C C . TRP A 1 36 ? 41.642 -56.900 -21.915 1.00 50.35 ? 36 TRP A C 1 +ATOM 248 O O . TRP A 1 36 ? 40.507 -56.905 -21.441 1.00 55.03 ? 36 TRP A O 1 +ATOM 249 C CB . TRP A 1 36 ? 42.084 -59.354 -22.407 1.00 66.29 ? 36 TRP A CB 1 +ATOM 250 C CG . TRP A 1 36 ? 43.104 -60.450 -22.505 1.00 73.20 ? 36 TRP A CG 1 +ATOM 251 C CD1 . TRP A 1 36 ? 43.251 -61.517 -21.667 1.00 70.13 ? 36 TRP A CD1 1 +ATOM 252 C CD2 . TRP A 1 36 ? 44.125 -60.595 -23.509 1.00 80.36 ? 36 TRP A CD2 1 +ATOM 253 N NE1 . TRP A 1 36 ? 44.290 -62.311 -22.073 1.00 63.94 ? 36 TRP A NE1 1 +ATOM 254 C CE2 . TRP A 1 36 ? 44.849 -61.769 -23.197 1.00 79.36 ? 36 TRP A CE2 1 +ATOM 255 C CE3 . TRP A 1 36 ? 44.503 -59.849 -24.634 1.00 69.51 ? 36 TRP A CE3 1 +ATOM 256 C CZ2 . TRP A 1 36 ? 45.923 -62.210 -23.972 1.00 89.69 ? 36 TRP A CZ2 1 +ATOM 257 C CZ3 . TRP A 1 36 ? 45.567 -60.283 -25.397 1.00 66.98 ? 36 TRP A CZ3 1 +ATOM 258 C CH2 . TRP A 1 36 ? 46.266 -61.448 -25.068 1.00 72.92 ? 36 TRP A CH2 1 +ATOM 259 N N . VAL A 1 37 ? 42.136 -55.887 -22.642 1.00 50.49 ? 37 VAL A N 1 +ATOM 260 C CA . VAL A 1 37 ? 41.346 -54.734 -23.056 1.00 57.87 ? 37 VAL A CA 1 +ATOM 261 C C . VAL A 1 37 ? 41.292 -54.701 -24.586 1.00 63.60 ? 37 VAL A C 1 +ATOM 262 O O . VAL A 1 37 ? 42.262 -55.076 -25.245 1.00 55.98 ? 37 VAL A O 1 +ATOM 263 C CB . VAL A 1 37 ? 41.898 -53.415 -22.469 1.00 53.31 ? 37 VAL A CB 1 +ATOM 264 C CG1 . VAL A 1 37 ? 41.078 -52.201 -22.881 1.00 57.42 ? 37 VAL A CG1 1 +ATOM 265 C CG2 . VAL A 1 37 ? 42.027 -53.461 -20.957 1.00 42.04 ? 37 VAL A CG2 1 +ATOM 266 N N . ARG A 1 38 ? 40.150 -54.247 -25.129 1.00 56.75 ? 38 ARG A N 1 +ATOM 267 C CA . ARG A 1 38 ? 39.909 -54.184 -26.563 1.00 60.92 ? 38 ARG A CA 1 +ATOM 268 C C . ARG A 1 38 ? 39.403 -52.798 -26.972 1.00 61.96 ? 38 ARG A C 1 +ATOM 269 O O . ARG A 1 38 ? 38.629 -52.175 -26.242 1.00 66.95 ? 38 ARG A O 1 +ATOM 270 C CB . ARG A 1 38 ? 38.993 -55.330 -27.015 1.00 72.12 ? 38 ARG A CB 1 +ATOM 271 C CG . ARG A 1 38 ? 37.494 -55.101 -26.854 1.00 73.93 ? 38 ARG A CG 1 +ATOM 272 C CD . ARG A 1 38 ? 36.722 -56.313 -27.342 1.00 72.97 ? 38 ARG A CD 1 +ATOM 273 N NE . ARG A 1 38 ? 35.311 -56.077 -27.622 1.00 84.23 ? 38 ARG A NE 1 +ATOM 274 C CZ . ARG A 1 38 ? 34.480 -56.962 -28.172 1.00 95.36 ? 38 ARG A CZ 1 +ATOM 275 N NH1 . ARG A 1 38 ? 34.900 -58.178 -28.490 1.00 66.50 ? 38 ARG A NH1 1 +ATOM 276 N NH2 . ARG A 1 38 ? 33.222 -56.625 -28.401 1.00 97.88 ? 38 ARG A NH2 1 +ATOM 277 N N . GLN A 1 39 ? 39.840 -52.344 -28.159 1.00 53.13 ? 39 GLN A N 1 +ATOM 278 C CA . GLN A 1 39 ? 39.468 -51.047 -28.706 1.00 47.21 ? 39 GLN A CA 1 +ATOM 279 C C . GLN A 1 39 ? 39.085 -51.188 -30.174 1.00 53.40 ? 39 GLN A C 1 +ATOM 280 O O . GLN A 1 39 ? 39.949 -51.351 -31.037 1.00 89.73 ? 39 GLN A O 1 +ATOM 281 C CB . GLN A 1 39 ? 40.587 -50.028 -28.499 1.00 48.08 ? 39 GLN A CB 1 +ATOM 282 C CG . GLN A 1 39 ? 40.298 -48.661 -29.113 1.00 62.03 ? 39 GLN A CG 1 +ATOM 283 C CD . GLN A 1 39 ? 41.065 -47.523 -28.473 1.00 76.02 ? 39 GLN A CD 1 +ATOM 284 O OE1 . GLN A 1 39 ? 40.489 -46.517 -28.059 1.00 79.41 ? 39 GLN A OE1 1 +ATOM 285 N NE2 . GLN A 1 39 ? 42.378 -47.670 -28.379 1.00 71.65 ? 39 GLN A NE2 1 +ATOM 286 N N . ALA A 1 40 ? 37.769 -51.135 -30.417 1.00 63.34 ? 40 ALA A N 1 +ATOM 287 C CA . ALA A 1 40 ? 37.148 -51.048 -31.731 1.00 59.80 ? 40 ALA A CA 1 +ATOM 288 C C . ALA A 1 40 ? 37.616 -49.777 -32.439 1.00 76.41 ? 40 ALA A C 1 +ATOM 289 O O . ALA A 1 40 ? 37.845 -48.760 -31.784 1.00 83.27 ? 40 ALA A O 1 +ATOM 290 C CB . ALA A 1 40 ? 35.646 -51.055 -31.568 1.00 51.44 ? 40 ALA A CB 1 +ATOM 291 N N . PRO A 1 41 ? 37.783 -49.791 -33.785 1.00 97.74 ? 41 PRO A N 1 +ATOM 292 C CA . PRO A 1 41 ? 38.199 -48.596 -34.528 1.00 101.19 ? 41 PRO A CA 1 +ATOM 293 C C . PRO A 1 41 ? 37.257 -47.416 -34.298 1.00 86.47 ? 41 PRO A C 1 +ATOM 294 O O . PRO A 1 41 ? 36.039 -47.585 -34.287 1.00 77.77 ? 41 PRO A O 1 +ATOM 295 C CB . PRO A 1 41 ? 38.147 -49.051 -35.994 1.00 106.53 ? 41 PRO A CB 1 +ATOM 296 C CG . PRO A 1 41 ? 38.348 -50.548 -35.917 1.00 112.01 ? 41 PRO A CG 1 +ATOM 297 C CD . PRO A 1 41 ? 37.607 -50.961 -34.664 1.00 105.98 ? 41 PRO A CD 1 +ATOM 298 N N . GLY A 1 42 ? 37.848 -46.235 -34.067 1.00 92.24 ? 42 GLY A N 1 +ATOM 299 C CA . GLY A 1 42 ? 37.110 -45.024 -33.738 1.00 92.69 ? 42 GLY A CA 1 +ATOM 300 C C . GLY A 1 42 ? 36.709 -44.964 -32.264 1.00 96.16 ? 42 GLY A C 1 +ATOM 301 O O . GLY A 1 42 ? 36.870 -43.932 -31.615 1.00 97.74 ? 42 GLY A O 1 +ATOM 302 N N . LYS A 1 43 ? 36.207 -46.092 -31.746 1.00 84.34 ? 43 LYS A N 1 +ATOM 303 C CA . LYS A 1 43 ? 35.601 -46.183 -30.426 1.00 90.06 ? 43 LYS A CA 1 +ATOM 304 C C . LYS A 1 43 ? 36.682 -46.240 -29.341 1.00 82.93 ? 43 LYS A C 1 +ATOM 305 O O . LYS A 1 43 ? 37.865 -46.360 -29.654 1.00 84.34 ? 43 LYS A O 1 +ATOM 306 C CB . LYS A 1 43 ? 34.621 -47.362 -30.409 1.00 82.72 ? 43 LYS A CB 1 +ATOM 307 C CG . LYS A 1 43 ? 33.474 -47.272 -31.414 1.00 62.85 ? 43 LYS A CG 1 +ATOM 308 C CD . LYS A 1 43 ? 32.317 -48.201 -31.086 1.00 81.44 ? 43 LYS A CD 1 +ATOM 309 C CE . LYS A 1 43 ? 31.266 -48.305 -32.173 1.00 109.46 ? 43 LYS A CE 1 +ATOM 310 N NZ . LYS A 1 43 ? 30.362 -47.130 -32.203 1.00 110.55 ? 43 LYS A NZ 1 +ATOM 311 N N . GLY A 1 44 ? 36.264 -46.133 -28.068 1.00 73.44 ? 44 GLY A N 1 +ATOM 312 C CA . GLY A 1 44 ? 37.158 -46.093 -26.915 1.00 54.00 ? 44 GLY A CA 1 +ATOM 313 C C . GLY A 1 44 ? 37.456 -47.482 -26.349 1.00 48.97 ? 44 GLY A C 1 +ATOM 314 O O . GLY A 1 44 ? 37.133 -48.494 -26.970 1.00 59.73 ? 44 GLY A O 1 +ATOM 315 N N . LEU A 1 45 ? 38.078 -47.519 -25.162 1.00 46.55 ? 45 LEU A N 1 +ATOM 316 C CA . LEU A 1 45 ? 38.537 -48.766 -24.556 1.00 58.54 ? 45 LEU A CA 1 +ATOM 317 C C . LEU A 1 45 ? 37.342 -49.573 -24.051 1.00 56.99 ? 45 LEU A C 1 +ATOM 318 O O . LEU A 1 45 ? 36.261 -49.015 -23.857 1.00 53.92 ? 45 LEU A O 1 +ATOM 319 C CB . LEU A 1 45 ? 39.553 -48.481 -23.439 1.00 51.67 ? 45 LEU A CB 1 +ATOM 320 C CG . LEU A 1 45 ? 40.863 -47.812 -23.879 1.00 66.22 ? 45 LEU A CG 1 +ATOM 321 C CD1 . LEU A 1 45 ? 41.750 -47.478 -22.689 1.00 58.68 ? 45 LEU A CD1 1 +ATOM 322 C CD2 . LEU A 1 45 ? 41.634 -48.664 -24.882 1.00 82.53 ? 45 LEU A CD2 1 +ATOM 323 N N . GLU A 1 46 ? 37.544 -50.893 -23.891 1.00 43.08 ? 46 GLU A N 1 +ATOM 324 C CA . GLU A 1 46 ? 36.504 -51.789 -23.401 1.00 42.77 ? 46 GLU A CA 1 +ATOM 325 C C . GLU A 1 46 ? 37.139 -53.031 -22.773 1.00 48.00 ? 46 GLU A C 1 +ATOM 326 O O . GLU A 1 46 ? 37.682 -53.863 -23.501 1.00 65.44 ? 46 GLU A O 1 +ATOM 327 C CB . GLU A 1 46 ? 35.501 -52.076 -24.524 1.00 47.44 ? 46 GLU A CB 1 +ATOM 328 C CG . GLU A 1 46 ? 34.426 -53.100 -24.194 1.00 60.71 ? 46 GLU A CG 1 +ATOM 329 C CD . GLU A 1 46 ? 33.673 -53.622 -25.412 1.00 85.53 ? 46 GLU A CD 1 +ATOM 330 O OE1 . GLU A 1 46 ? 33.298 -52.801 -26.285 1.00 98.97 ? 46 GLU A OE1 1 +ATOM 331 O OE2 . GLU A 1 46 ? 33.468 -54.852 -25.498 1.00 74.58 ? 46 GLU A OE2 1 +ATOM 332 N N . TRP A 1 47 ? 37.066 -53.134 -21.428 1.00 36.79 ? 47 TRP A N 1 +ATOM 333 C CA . TRP A 1 47 ? 37.571 -54.276 -20.677 1.00 38.88 ? 47 TRP A CA 1 +ATOM 334 C C . TRP A 1 47 ? 36.869 -55.556 -21.117 1.00 41.08 ? 47 TRP A C 1 +ATOM 335 O O . TRP A 1 47 ? 35.641 -55.596 -21.193 1.00 52.64 ? 47 TRP A O 1 +ATOM 336 C CB . TRP A 1 47 ? 37.427 -54.084 -19.168 1.00 43.85 ? 47 TRP A CB 1 +ATOM 337 C CG . TRP A 1 47 ? 37.803 -55.286 -18.346 1.00 45.68 ? 47 TRP A CG 1 +ATOM 338 C CD1 . TRP A 1 47 ? 39.049 -55.590 -17.881 1.00 54.44 ? 47 TRP A CD1 1 +ATOM 339 C CD2 . TRP A 1 47 ? 36.932 -56.325 -17.843 1.00 38.62 ? 47 TRP A CD2 1 +ATOM 340 N NE1 . TRP A 1 47 ? 39.022 -56.747 -17.147 1.00 60.50 ? 47 TRP A NE1 1 +ATOM 341 C CE2 . TRP A 1 47 ? 37.738 -57.224 -17.107 1.00 43.96 ? 47 TRP A CE2 1 +ATOM 342 C CE3 . TRP A 1 47 ? 35.565 -56.607 -17.968 1.00 40.19 ? 47 TRP A CE3 1 +ATOM 343 C CZ2 . TRP A 1 47 ? 37.221 -58.368 -16.497 1.00 41.15 ? 47 TRP A CZ2 1 +ATOM 344 C CZ3 . TRP A 1 47 ? 35.049 -57.734 -17.362 1.00 40.11 ? 47 TRP A CZ3 1 +ATOM 345 C CH2 . TRP A 1 47 ? 35.869 -58.602 -16.633 1.00 42.51 ? 47 TRP A CH2 1 +ATOM 346 N N . VAL A 1 48 ? 37.685 -56.589 -21.353 1.00 37.79 ? 48 VAL A N 1 +ATOM 347 C CA . VAL A 1 48 ? 37.251 -57.847 -21.938 1.00 56.02 ? 48 VAL A CA 1 +ATOM 348 C C . VAL A 1 48 ? 37.260 -58.935 -20.871 1.00 48.08 ? 48 VAL A C 1 +ATOM 349 O O . VAL A 1 48 ? 36.221 -59.550 -20.643 1.00 43.79 ? 48 VAL A O 1 +ATOM 350 C CB . VAL A 1 48 ? 38.124 -58.264 -23.142 1.00 68.47 ? 48 VAL A CB 1 +ATOM 351 C CG1 . VAL A 1 48 ? 37.665 -59.577 -23.764 1.00 53.98 ? 48 VAL A CG1 1 +ATOM 352 C CG2 . VAL A 1 48 ? 38.211 -57.176 -24.197 1.00 49.43 ? 48 VAL A CG2 1 +ATOM 353 N N . SER A 1 49 ? 38.437 -59.182 -20.265 1.00 41.41 ? 49 SER A N 1 +ATOM 354 C CA . SER A 1 49 ? 38.625 -60.332 -19.392 1.00 51.97 ? 49 SER A CA 1 +ATOM 355 C C . SER A 1 49 ? 39.764 -60.102 -18.400 1.00 49.99 ? 49 SER A C 1 +ATOM 356 O O . SER A 1 49 ? 40.674 -59.332 -18.700 1.00 54.93 ? 49 SER A O 1 +ATOM 357 C CB . SER A 1 49 ? 38.864 -61.573 -20.221 1.00 59.12 ? 49 SER A CB 1 +ATOM 358 O OG . SER A 1 49 ? 38.656 -62.746 -19.448 1.00 70.49 ? 49 SER A OG 1 +ATOM 359 N N . SER A 1 50 ? 39.722 -60.793 -17.241 1.00 45.50 ? 50 SER A N 1 +ATOM 360 C CA . SER A 1 50 ? 40.794 -60.743 -16.245 1.00 48.56 ? 50 SER A CA 1 +ATOM 361 C C . SER A 1 50 ? 40.960 -62.071 -15.505 1.00 47.50 ? 50 SER A C 1 +ATOM 362 O O . SER A 1 50 ? 40.017 -62.855 -15.408 1.00 55.18 ? 50 SER A O 1 +ATOM 363 C CB . SER A 1 50 ? 40.620 -59.596 -15.278 1.00 49.65 ? 50 SER A CB 1 +ATOM 364 O OG . SER A 1 50 ? 40.625 -58.347 -15.958 1.00 54.37 ? 50 SER A OG 1 +ATOM 365 N N . ILE A 1 51 ? 42.168 -62.303 -14.966 1.00 46.21 ? 51 ILE A N 1 +ATOM 366 C CA . ILE A 1 51 ? 42.512 -63.564 -14.322 1.00 54.48 ? 51 ILE A CA 1 +ATOM 367 C C . ILE A 1 51 ? 43.579 -63.343 -13.249 1.00 57.13 ? 51 ILE A C 1 +ATOM 368 O O . ILE A 1 51 ? 44.571 -62.654 -13.478 1.00 50.47 ? 51 ILE A O 1 +ATOM 369 C CB . ILE A 1 51 ? 42.944 -64.633 -15.355 1.00 70.62 ? 51 ILE A CB 1 +ATOM 370 C CG1 . ILE A 1 51 ? 43.189 -66.003 -14.707 1.00 76.19 ? 51 ILE A CG1 1 +ATOM 371 C CG2 . ILE A 1 51 ? 44.145 -64.162 -16.168 1.00 71.30 ? 51 ILE A CG2 1 +ATOM 372 C CD1 . ILE A 1 51 ? 43.213 -67.173 -15.669 1.00 82.34 ? 51 ILE A CD1 1 +ATOM 373 N N . SER A 1 52 ? 43.369 -63.992 -12.095 1.00 63.66 ? 52 SER A N 1 +ATOM 374 C CA . SER A 1 52 ? 44.292 -63.983 -10.970 1.00 68.30 ? 52 SER A CA 1 +ATOM 375 C C . SER A 1 52 ? 45.569 -64.743 -11.316 1.00 70.82 ? 52 SER A C 1 +ATOM 376 O O . SER A 1 52 ? 45.579 -65.575 -12.223 1.00 78.84 ? 52 SER A O 1 +ATOM 377 C CB . SER A 1 52 ? 43.642 -64.504 -9.700 1.00 83.16 ? 52 SER A CB 1 +ATOM 378 O OG . SER A 1 52 ? 43.154 -65.830 -9.856 1.00 71.11 ? 52 SER A OG 1 +ATOM 379 N N . GLY A 1 53 ? 46.631 -64.443 -10.559 1.00 78.07 ? 53 GLY A N 1 +ATOM 380 C CA . GLY A 1 53 ? 47.985 -64.903 -10.824 1.00 65.68 ? 53 GLY A CA 1 +ATOM 381 C C . GLY A 1 53 ? 48.180 -66.403 -10.613 1.00 62.64 ? 53 GLY A C 1 +ATOM 382 O O . GLY A 1 53 ? 49.201 -66.951 -11.018 1.00 79.07 ? 53 GLY A O 1 +ATOM 383 N N . SER A 1 54 ? 47.206 -67.048 -9.966 1.00 61.14 ? 54 SER A N 1 +ATOM 384 C CA . SER A 1 54 ? 47.253 -68.474 -9.687 1.00 51.26 ? 54 SER A CA 1 +ATOM 385 C C . SER A 1 54 ? 46.531 -69.229 -10.798 1.00 58.94 ? 54 SER A C 1 +ATOM 386 O O . SER A 1 54 ? 46.746 -70.426 -10.979 1.00 59.41 ? 54 SER A O 1 +ATOM 387 C CB . SER A 1 54 ? 46.625 -68.777 -8.349 1.00 64.52 ? 54 SER A CB 1 +ATOM 388 O OG . SER A 1 54 ? 45.213 -68.567 -8.379 1.00 68.00 ? 54 SER A OG 1 +ATOM 389 N N . GLY A 1 55 ? 45.666 -68.510 -11.522 1.00 50.19 ? 55 GLY A N 1 +ATOM 390 C CA . GLY A 1 55 ? 44.704 -69.119 -12.423 1.00 45.88 ? 55 GLY A CA 1 +ATOM 391 C C . GLY A 1 55 ? 43.337 -69.287 -11.764 1.00 60.59 ? 55 GLY A C 1 +ATOM 392 O O . GLY A 1 55 ? 42.371 -69.635 -12.440 1.00 59.57 ? 55 GLY A O 1 +ATOM 393 N N . GLY A 1 56 ? 43.269 -68.992 -10.456 1.00 74.19 ? 56 GLY A N 1 +ATOM 394 C CA . GLY A 1 56 ? 42.139 -69.298 -9.588 1.00 73.47 ? 56 GLY A CA 1 +ATOM 395 C C . GLY A 1 56 ? 40.810 -68.686 -10.033 1.00 81.08 ? 56 GLY A C 1 +ATOM 396 O O . GLY A 1 56 ? 39.821 -69.405 -10.156 1.00 76.08 ? 56 GLY A O 1 +ATOM 397 N N . ASN A 1 57 ? 40.785 -67.360 -10.240 1.00 77.53 ? 57 ASN A N 1 +ATOM 398 C CA . ASN A 1 57 ? 39.545 -66.665 -10.556 1.00 68.02 ? 57 ASN A CA 1 +ATOM 399 C C . ASN A 1 57 ? 39.612 -66.073 -11.956 1.00 54.98 ? 57 ASN A C 1 +ATOM 400 O O . ASN A 1 57 ? 40.641 -65.543 -12.367 1.00 66.13 ? 57 ASN A O 1 +ATOM 401 C CB . ASN A 1 57 ? 39.227 -65.553 -9.555 1.00 71.57 ? 57 ASN A CB 1 +ATOM 402 C CG . ASN A 1 57 ? 39.316 -66.015 -8.121 1.00 70.99 ? 57 ASN A CG 1 +ATOM 403 O OD1 . ASN A 1 57 ? 38.742 -67.041 -7.757 1.00 62.88 ? 57 ASN A OD1 1 +ATOM 404 N ND2 . ASN A 1 57 ? 40.048 -65.267 -7.312 1.00 81.93 ? 57 ASN A ND2 1 +ATOM 405 N N . THR A 1 58 ? 38.491 -66.167 -12.672 1.00 47.21 ? 58 THR A N 1 +ATOM 406 C CA . THR A 1 58 ? 38.371 -65.531 -13.971 1.00 65.60 ? 58 THR A CA 1 +ATOM 407 C C . THR A 1 58 ? 37.206 -64.548 -13.949 1.00 64.47 ? 58 THR A C 1 +ATOM 408 O O . THR A 1 58 ? 36.264 -64.708 -13.170 1.00 73.33 ? 58 THR A O 1 +ATOM 409 C CB . THR A 1 58 ? 38.287 -66.555 -15.111 1.00 70.22 ? 58 THR A CB 1 +ATOM 410 O OG1 . THR A 1 58 ? 37.020 -67.217 -15.084 1.00 63.12 ? 58 THR A OG1 1 +ATOM 411 C CG2 . THR A 1 58 ? 39.429 -67.549 -15.093 1.00 54.84 ? 58 THR A CG2 1 +ATOM 412 N N . TYR A 1 59 ? 37.309 -63.524 -14.807 1.00 53.32 ? 59 TYR A N 1 +ATOM 413 C CA . TYR A 1 59 ? 36.303 -62.478 -14.927 1.00 61.57 ? 59 TYR A CA 1 +ATOM 414 C C . TYR A 1 59 ? 36.105 -62.138 -16.404 1.00 50.93 ? 59 TYR A C 1 +ATOM 415 O O . TYR A 1 59 ? 37.067 -61.901 -17.130 1.00 58.19 ? 59 TYR A O 1 +ATOM 416 C CB . TYR A 1 59 ? 36.676 -61.246 -14.090 1.00 50.10 ? 59 TYR A CB 1 +ATOM 417 C CG . TYR A 1 59 ? 36.982 -61.508 -12.635 1.00 53.58 ? 59 TYR A CG 1 +ATOM 418 C CD1 . TYR A 1 59 ? 38.242 -61.932 -12.232 1.00 51.30 ? 59 TYR A CD1 1 +ATOM 419 C CD2 . TYR A 1 59 ? 36.017 -61.322 -11.654 1.00 67.61 ? 59 TYR A CD2 1 +ATOM 420 C CE1 . TYR A 1 59 ? 38.531 -62.183 -10.900 1.00 79.24 ? 59 TYR A CE1 1 +ATOM 421 C CE2 . TYR A 1 59 ? 36.293 -61.556 -10.313 1.00 81.86 ? 59 TYR A CE2 1 +ATOM 422 C CZ . TYR A 1 59 ? 37.556 -61.985 -9.934 1.00 91.84 ? 59 TYR A CZ 1 +ATOM 423 O OH . TYR A 1 59 ? 37.852 -62.221 -8.622 1.00 93.36 ? 59 TYR A OH 1 +ATOM 424 N N . TYR A 1 60 ? 34.838 -62.085 -16.815 1.00 46.85 ? 60 TYR A N 1 +ATOM 425 C CA . TYR A 1 60 ? 34.455 -61.958 -18.206 1.00 40.40 ? 60 TYR A CA 1 +ATOM 426 C C . TYR A 1 60 ? 33.416 -60.858 -18.357 1.00 45.32 ? 60 TYR A C 1 +ATOM 427 O O . TYR A 1 60 ? 32.458 -60.807 -17.589 1.00 74.35 ? 60 TYR A O 1 +ATOM 428 C CB . TYR A 1 60 ? 33.857 -63.287 -18.678 1.00 42.96 ? 60 TYR A CB 1 +ATOM 429 C CG . TYR A 1 60 ? 34.872 -64.385 -18.848 1.00 43.62 ? 60 TYR A CG 1 +ATOM 430 C CD1 . TYR A 1 60 ? 35.796 -64.351 -19.890 1.00 47.45 ? 60 TYR A CD1 1 +ATOM 431 C CD2 . TYR A 1 60 ? 34.918 -65.454 -17.967 1.00 41.10 ? 60 TYR A CD2 1 +ATOM 432 C CE1 . TYR A 1 60 ? 36.736 -65.358 -20.063 1.00 42.38 ? 60 TYR A CE1 1 +ATOM 433 C CE2 . TYR A 1 60 ? 35.860 -66.464 -18.122 1.00 59.75 ? 60 TYR A CE2 1 +ATOM 434 C CZ . TYR A 1 60 ? 36.766 -66.418 -19.173 1.00 55.52 ? 60 TYR A CZ 1 +ATOM 435 O OH . TYR A 1 60 ? 37.689 -67.409 -19.331 1.00 66.74 ? 60 TYR A OH 1 +ATOM 436 N N . ALA A 1 61 ? 33.614 -60.001 -19.366 1.00 50.67 ? 61 ALA A N 1 +ATOM 437 C CA . ALA A 1 61 ? 32.593 -59.070 -19.826 1.00 65.30 ? 61 ALA A CA 1 +ATOM 438 C C . ALA A 1 61 ? 31.400 -59.863 -20.355 1.00 76.53 ? 61 ALA A C 1 +ATOM 439 O O . ALA A 1 61 ? 31.571 -60.931 -20.940 1.00 91.70 ? 61 ALA A O 1 +ATOM 440 C CB . ALA A 1 61 ? 33.154 -58.142 -20.881 1.00 66.94 ? 61 ALA A CB 1 +ATOM 441 N N . ASP A 1 62 ? 30.198 -59.318 -20.137 1.00 71.06 ? 62 ASP A N 1 +ATOM 442 C CA . ASP A 1 62 ? 28.949 -59.985 -20.460 1.00 73.95 ? 62 ASP A CA 1 +ATOM 443 C C . ASP A 1 62 ? 28.911 -60.459 -21.908 1.00 88.15 ? 62 ASP A C 1 +ATOM 444 O O . ASP A 1 62 ? 28.661 -61.638 -22.159 1.00 111.00 ? 62 ASP A O 1 +ATOM 445 C CB . ASP A 1 62 ? 27.742 -59.102 -20.147 1.00 83.39 ? 62 ASP A CB 1 +ATOM 446 C CG . ASP A 1 62 ? 26.856 -59.691 -19.067 1.00 88.86 ? 62 ASP A CG 1 +ATOM 447 O OD1 . ASP A 1 62 ? 27.178 -60.797 -18.576 1.00 105.62 ? 62 ASP A OD1 1 +ATOM 448 O OD2 . ASP A 1 62 ? 25.847 -59.047 -18.739 1.00 95.36 ? 62 ASP A OD2 1 +ATOM 449 N N . SER A 1 63 ? 29.177 -59.542 -22.847 1.00 85.09 ? 63 SER A N 1 +ATOM 450 C CA . SER A 1 63 ? 28.939 -59.789 -24.262 1.00 77.15 ? 63 SER A CA 1 +ATOM 451 C C . SER A 1 63 ? 29.868 -60.871 -24.819 1.00 72.33 ? 63 SER A C 1 +ATOM 452 O O . SER A 1 63 ? 29.752 -61.231 -25.988 1.00 78.61 ? 63 SER A O 1 +ATOM 453 C CB . SER A 1 63 ? 29.006 -58.512 -25.062 1.00 76.85 ? 63 SER A CB 1 +ATOM 454 O OG . SER A 1 63 ? 30.300 -57.936 -24.988 1.00 79.69 ? 63 SER A OG 1 +ATOM 455 N N . VAL A 1 64 ? 30.772 -61.397 -23.977 1.00 50.63 ? 64 VAL A N 1 +ATOM 456 C CA . VAL A 1 64 ? 31.694 -62.442 -24.392 1.00 53.58 ? 64 VAL A CA 1 +ATOM 457 C C . VAL A 1 64 ? 31.608 -63.646 -23.455 1.00 63.16 ? 64 VAL A C 1 +ATOM 458 O O . VAL A 1 64 ? 32.367 -64.603 -23.624 1.00 59.60 ? 64 VAL A O 1 +ATOM 459 C CB . VAL A 1 64 ? 33.149 -61.945 -24.556 1.00 60.19 ? 64 VAL A CB 1 +ATOM 460 C CG1 . VAL A 1 64 ? 33.286 -60.850 -25.613 1.00 55.88 ? 64 VAL A CG1 1 +ATOM 461 C CG2 . VAL A 1 64 ? 33.807 -61.552 -23.235 1.00 59.08 ? 64 VAL A CG2 1 +ATOM 462 N N . LYS A 1 65 ? 30.688 -63.592 -22.478 1.00 61.38 ? 65 LYS A N 1 +ATOM 463 C CA . LYS A 1 65 ? 30.526 -64.678 -21.519 1.00 65.87 ? 65 LYS A CA 1 +ATOM 464 C C . LYS A 1 65 ? 30.171 -65.965 -22.260 1.00 63.78 ? 65 LYS A C 1 +ATOM 465 O O . LYS A 1 65 ? 29.274 -65.981 -23.105 1.00 64.85 ? 65 LYS A O 1 +ATOM 466 C CB . LYS A 1 65 ? 29.542 -64.323 -20.395 1.00 63.67 ? 65 LYS A CB 1 +ATOM 467 C CG . LYS A 1 65 ? 30.162 -64.202 -19.007 1.00 55.28 ? 65 LYS A CG 1 +ATOM 468 C CD . LYS A 1 65 ? 29.320 -63.416 -18.020 1.00 66.88 ? 65 LYS A CD 1 +ATOM 469 C CE . LYS A 1 65 ? 29.761 -63.601 -16.581 1.00 85.81 ? 65 LYS A CE 1 +ATOM 470 N NZ . LYS A 1 65 ? 29.224 -62.548 -15.684 1.00 70.68 ? 65 LYS A NZ 1 +ATOM 471 N N . GLY A 1 66 ? 30.930 -67.024 -21.958 1.00 59.71 ? 66 GLY A N 1 +ATOM 472 C CA . GLY A 1 66 ? 30.707 -68.329 -22.556 1.00 80.23 ? 66 GLY A CA 1 +ATOM 473 C C . GLY A 1 66 ? 31.506 -68.546 -23.840 1.00 87.81 ? 66 GLY A C 1 +ATOM 474 O O . GLY A 1 66 ? 31.833 -69.683 -24.173 1.00 99.64 ? 66 GLY A O 1 +ATOM 475 N N . ARG A 1 67 ? 31.818 -67.454 -24.549 1.00 97.40 ? 67 ARG A N 1 +ATOM 476 C CA . ARG A 1 67 ? 32.480 -67.531 -25.843 1.00 82.88 ? 67 ARG A CA 1 +ATOM 477 C C . ARG A 1 67 ? 33.999 -67.480 -25.666 1.00 86.90 ? 67 ARG A C 1 +ATOM 478 O O . ARG A 1 67 ? 34.688 -68.437 -26.017 1.00 92.80 ? 67 ARG A O 1 +ATOM 479 C CB . ARG A 1 67 ? 31.913 -66.487 -26.810 1.00 68.67 ? 67 ARG A CB 1 +ATOM 480 C CG . ARG A 1 67 ? 30.406 -66.584 -27.015 1.00 64.85 ? 67 ARG A CG 1 +ATOM 481 C CD . ARG A 1 67 ? 29.874 -65.727 -28.145 1.00 72.01 ? 67 ARG A CD 1 +ATOM 482 N NE . ARG A 1 67 ? 30.072 -64.297 -27.928 1.00 85.83 ? 67 ARG A NE 1 +ATOM 483 C CZ . ARG A 1 67 ? 31.030 -63.554 -28.482 1.00 74.35 ? 67 ARG A CZ 1 +ATOM 484 N NH1 . ARG A 1 67 ? 31.921 -64.093 -29.297 1.00 82.45 ? 67 ARG A NH1 1 +ATOM 485 N NH2 . ARG A 1 67 ? 31.093 -62.263 -28.215 1.00 88.66 ? 67 ARG A NH2 1 +ATOM 486 N N . PHE A 1 68 ? 34.513 -66.374 -25.111 1.00 70.78 ? 68 PHE A N 1 +ATOM 487 C CA . PHE A 1 68 ? 35.948 -66.196 -24.924 1.00 64.63 ? 68 PHE A CA 1 +ATOM 488 C C . PHE A 1 68 ? 36.395 -66.950 -23.672 1.00 51.79 ? 68 PHE A C 1 +ATOM 489 O O . PHE A 1 68 ? 35.615 -67.128 -22.739 1.00 64.57 ? 68 PHE A O 1 +ATOM 490 C CB . PHE A 1 68 ? 36.309 -64.707 -24.845 1.00 68.66 ? 68 PHE A CB 1 +ATOM 491 C CG . PHE A 1 68 ? 36.139 -63.881 -26.100 1.00 70.91 ? 68 PHE A CG 1 +ATOM 492 C CD1 . PHE A 1 68 ? 35.288 -64.274 -27.132 1.00 69.38 ? 68 PHE A CD1 1 +ATOM 493 C CD2 . PHE A 1 68 ? 36.806 -62.669 -26.231 1.00 60.12 ? 68 PHE A CD2 1 +ATOM 494 C CE1 . PHE A 1 68 ? 35.129 -63.491 -28.269 1.00 71.25 ? 68 PHE A CE1 1 +ATOM 495 C CE2 . PHE A 1 68 ? 36.643 -61.882 -27.364 1.00 65.97 ? 68 PHE A CE2 1 +ATOM 496 C CZ . PHE A 1 68 ? 35.804 -62.293 -28.382 1.00 70.94 ? 68 PHE A CZ 1 +ATOM 497 N N . THR A 1 69 ? 37.663 -67.377 -23.658 1.00 44.53 ? 69 THR A N 1 +ATOM 498 C CA . THR A 1 69 ? 38.216 -68.132 -22.543 1.00 47.29 ? 69 THR A CA 1 +ATOM 499 C C . THR A 1 69 ? 39.585 -67.571 -22.162 1.00 63.64 ? 69 THR A C 1 +ATOM 500 O O . THR A 1 69 ? 40.485 -67.514 -23.002 1.00 85.35 ? 69 THR A O 1 +ATOM 501 C CB . THR A 1 69 ? 38.307 -69.626 -22.881 1.00 51.21 ? 69 THR A CB 1 +ATOM 502 O OG1 . THR A 1 69 ? 37.064 -70.049 -23.445 1.00 66.75 ? 69 THR A OG1 1 +ATOM 503 C CG2 . THR A 1 69 ? 38.669 -70.487 -21.689 1.00 53.52 ? 69 THR A CG2 1 +ATOM 504 N N . ILE A 1 70 ? 39.732 -67.187 -20.885 1.00 48.54 ? 70 ILE A N 1 +ATOM 505 C CA . ILE A 1 70 ? 40.996 -66.683 -20.366 1.00 48.43 ? 70 ILE A CA 1 +ATOM 506 C C . ILE A 1 70 ? 41.753 -67.824 -19.688 1.00 44.14 ? 70 ILE A C 1 +ATOM 507 O O . ILE A 1 70 ? 41.145 -68.645 -19.005 1.00 53.95 ? 70 ILE A O 1 +ATOM 508 C CB . ILE A 1 70 ? 40.804 -65.432 -19.472 1.00 52.06 ? 70 ILE A CB 1 +ATOM 509 C CG1 . ILE A 1 70 ? 42.110 -64.663 -19.248 1.00 44.38 ? 70 ILE A CG1 1 +ATOM 510 C CG2 . ILE A 1 70 ? 40.113 -65.762 -18.155 1.00 70.94 ? 70 ILE A CG2 1 +ATOM 511 C CD1 . ILE A 1 70 ? 41.922 -63.229 -18.809 1.00 47.08 ? 70 ILE A CD1 1 +ATOM 512 N N . SER A 1 71 ? 43.076 -67.861 -19.904 1.00 45.80 ? 71 SER A N 1 +ATOM 513 C CA . SER A 1 71 ? 43.958 -68.913 -19.414 1.00 55.77 ? 71 SER A CA 1 +ATOM 514 C C . SER A 1 71 ? 45.413 -68.436 -19.406 1.00 67.13 ? 71 SER A C 1 +ATOM 515 O O . SER A 1 71 ? 45.766 -67.479 -20.103 1.00 50.44 ? 71 SER A O 1 +ATOM 516 C CB . SER A 1 71 ? 43.793 -70.183 -20.222 1.00 72.97 ? 71 SER A CB 1 +ATOM 517 O OG . SER A 1 71 ? 43.260 -69.912 -21.515 1.00 75.78 ? 71 SER A OG 1 +ATOM 518 N N . ARG A 1 72 ? 46.254 -69.125 -18.615 1.00 74.91 ? 72 ARG A N 1 +ATOM 519 C CA . ARG A 1 72 ? 47.641 -68.725 -18.406 1.00 76.18 ? 72 ARG A CA 1 +ATOM 520 C C . ARG A 1 72 ? 48.531 -69.938 -18.131 1.00 71.46 ? 72 ARG A C 1 +ATOM 521 O O . ARG A 1 72 ? 48.079 -70.929 -17.553 1.00 59.44 ? 72 ARG A O 1 +ATOM 522 C CB . ARG A 1 72 ? 47.752 -67.679 -17.287 1.00 74.94 ? 72 ARG A CB 1 +ATOM 523 C CG . ARG A 1 72 ? 47.378 -68.172 -15.895 1.00 62.87 ? 72 ARG A CG 1 +ATOM 524 C CD . ARG A 1 72 ? 47.225 -67.056 -14.882 1.00 74.02 ? 72 ARG A CD 1 +ATOM 525 N NE . ARG A 1 72 ? 48.484 -66.393 -14.558 1.00 66.04 ? 72 ARG A NE 1 +ATOM 526 C CZ . ARG A 1 72 ? 48.614 -65.109 -14.222 1.00 62.38 ? 72 ARG A CZ 1 +ATOM 527 N NH1 . ARG A 1 72 ? 49.791 -64.652 -13.832 1.00 54.83 ? 72 ARG A NH1 1 +ATOM 528 N NH2 . ARG A 1 72 ? 47.579 -64.283 -14.273 1.00 62.49 ? 72 ARG A NH2 1 +ATOM 529 N N . ASP A 1 73 ? 49.801 -69.826 -18.555 1.00 76.18 ? 73 ASP A N 1 +ATOM 530 C CA . ASP A 1 73 ? 50.865 -70.750 -18.188 1.00 78.30 ? 73 ASP A CA 1 +ATOM 531 C C . ASP A 1 73 ? 52.014 -69.969 -17.552 1.00 74.48 ? 73 ASP A C 1 +ATOM 532 O O . ASP A 1 73 ? 52.715 -69.216 -18.227 1.00 58.46 ? 73 ASP A O 1 +ATOM 533 C CB . ASP A 1 73 ? 51.326 -71.608 -19.370 1.00 83.94 ? 73 ASP A CB 1 +ATOM 534 C CG . ASP A 1 73 ? 52.470 -72.564 -19.050 1.00 90.99 ? 73 ASP A CG 1 +ATOM 535 O OD1 . ASP A 1 73 ? 52.847 -72.677 -17.865 1.00 87.63 ? 73 ASP A OD1 1 +ATOM 536 O OD2 . ASP A 1 73 ? 52.977 -73.195 -19.993 1.00 105.61 ? 73 ASP A OD2 1 +ATOM 537 N N . ASN A 1 74 ? 52.220 -70.222 -16.255 1.00 74.41 ? 74 ASN A N 1 +ATOM 538 C CA . ASN A 1 74 ? 53.104 -69.434 -15.412 1.00 73.27 ? 74 ASN A CA 1 +ATOM 539 C C . ASN A 1 74 ? 54.521 -70.003 -15.430 1.00 84.05 ? 74 ASN A C 1 +ATOM 540 O O . ASN A 1 74 ? 55.434 -69.397 -14.871 1.00 80.07 ? 74 ASN A O 1 +ATOM 541 C CB . ASN A 1 74 ? 52.540 -69.305 -13.998 1.00 61.99 ? 74 ASN A CB 1 +ATOM 542 C CG . ASN A 1 74 ? 51.113 -68.798 -13.982 1.00 75.19 ? 74 ASN A CG 1 +ATOM 543 O OD1 . ASN A 1 74 ? 50.835 -67.677 -14.402 1.00 63.09 ? 74 ASN A OD1 1 +ATOM 544 N ND2 . ASN A 1 74 ? 50.196 -69.622 -13.504 1.00 99.04 ? 74 ASN A ND2 1 +ATOM 545 N N . SER A 1 75 ? 54.688 -71.168 -16.069 1.00 102.28 ? 75 SER A N 1 +ATOM 546 C CA . SER A 1 75 ? 56.002 -71.741 -16.319 1.00 106.47 ? 75 SER A CA 1 +ATOM 547 C C . SER A 1 75 ? 56.569 -71.200 -17.630 1.00 103.34 ? 75 SER A C 1 +ATOM 548 O O . SER A 1 75 ? 57.773 -70.978 -17.736 1.00 112.64 ? 75 SER A O 1 +ATOM 549 C CB . SER A 1 75 ? 55.958 -73.247 -16.309 1.00 104.51 ? 75 SER A CB 1 +ATOM 550 O OG . SER A 1 75 ? 55.121 -73.738 -17.346 1.00 103.71 ? 75 SER A OG 1 +ATOM 551 N N . LYS A 1 76 ? 55.686 -70.985 -18.616 1.00 84.04 ? 76 LYS A N 1 +ATOM 552 C CA . LYS A 1 76 ? 56.072 -70.465 -19.918 1.00 69.60 ? 76 LYS A CA 1 +ATOM 553 C C . LYS A 1 76 ? 55.879 -68.946 -19.973 1.00 82.12 ? 76 LYS A C 1 +ATOM 554 O O . LYS A 1 76 ? 56.197 -68.324 -20.986 1.00 72.28 ? 76 LYS A O 1 +ATOM 555 C CB . LYS A 1 76 ? 55.318 -71.206 -21.029 1.00 45.92 ? 76 LYS A CB 1 +ATOM 556 N N . ASN A 1 77 ? 55.365 -68.360 -18.878 1.00 89.37 ? 77 ASN A N 1 +ATOM 557 C CA . ASN A 1 77 ? 55.140 -66.925 -18.725 1.00 82.01 ? 77 ASN A CA 1 +ATOM 558 C C . ASN A 1 77 ? 54.285 -66.380 -19.871 1.00 75.22 ? 77 ASN A C 1 +ATOM 559 O O . ASN A 1 77 ? 54.669 -65.418 -20.536 1.00 68.65 ? 77 ASN A O 1 +ATOM 560 C CB . ASN A 1 77 ? 56.445 -66.142 -18.537 1.00 71.80 ? 77 ASN A CB 1 +ATOM 561 C CG . ASN A 1 77 ? 57.169 -66.464 -17.247 1.00 78.23 ? 77 ASN A CG 1 +ATOM 562 O OD1 . ASN A 1 77 ? 56.590 -67.034 -16.324 1.00 111.46 ? 77 ASN A OD1 1 +ATOM 563 N ND2 . ASN A 1 77 ? 58.437 -66.096 -17.170 1.00 58.30 ? 77 ASN A ND2 1 +ATOM 564 N N . THR A 1 78 ? 53.111 -66.996 -20.071 1.00 70.52 ? 78 THR A N 1 +ATOM 565 C CA . THR A 1 78 ? 52.240 -66.686 -21.195 1.00 64.82 ? 78 THR A CA 1 +ATOM 566 C C . THR A 1 78 ? 50.767 -66.740 -20.779 1.00 81.65 ? 78 THR A C 1 +ATOM 567 O O . THR A 1 78 ? 50.369 -67.532 -19.924 1.00 76.20 ? 78 THR A O 1 +ATOM 568 C CB . THR A 1 78 ? 52.548 -67.612 -22.377 1.00 63.58 ? 78 THR A CB 1 +ATOM 569 O OG1 . THR A 1 78 ? 53.955 -67.850 -22.400 1.00 77.61 ? 78 THR A OG1 1 +ATOM 570 C CG2 . THR A 1 78 ? 52.111 -67.045 -23.708 1.00 70.71 ? 78 THR A CG2 1 +ATOM 571 N N . LEU A 1 79 ? 49.960 -65.908 -21.448 1.00 71.43 ? 79 LEU A N 1 +ATOM 572 C CA . LEU A 1 79 ? 48.566 -65.663 -21.121 1.00 67.75 ? 79 LEU A CA 1 +ATOM 573 C C . LEU A 1 79 ? 47.765 -65.709 -22.419 1.00 70.09 ? 79 LEU A C 1 +ATOM 574 O O . LEU A 1 79 ? 48.213 -65.169 -23.427 1.00 82.04 ? 79 LEU A O 1 +ATOM 575 C CB . LEU A 1 79 ? 48.528 -64.271 -20.475 1.00 66.33 ? 79 LEU A CB 1 +ATOM 576 C CG . LEU A 1 79 ? 47.193 -63.533 -20.445 1.00 48.87 ? 79 LEU A CG 1 +ATOM 577 C CD1 . LEU A 1 79 ? 46.472 -63.788 -19.136 1.00 44.43 ? 79 LEU A CD1 1 +ATOM 578 C CD2 . LEU A 1 79 ? 47.419 -62.042 -20.635 1.00 59.71 ? 79 LEU A CD2 1 +ATOM 579 N N . TYR A 1 80 ? 46.582 -66.339 -22.384 1.00 77.86 ? 80 TYR A N 1 +ATOM 580 C CA . TYR A 1 80 ? 45.807 -66.567 -23.597 1.00 76.73 ? 80 TYR A CA 1 +ATOM 581 C C . TYR A 1 80 ? 44.364 -66.107 -23.427 1.00 71.69 ? 80 TYR A C 1 +ATOM 582 O O . TYR A 1 80 ? 43.774 -66.254 -22.360 1.00 82.42 ? 80 TYR A O 1 +ATOM 583 C CB . TYR A 1 80 ? 45.807 -68.043 -24.011 1.00 84.91 ? 80 TYR A CB 1 +ATOM 584 C CG . TYR A 1 80 ? 47.150 -68.730 -23.988 1.00 80.49 ? 80 TYR A CG 1 +ATOM 585 C CD1 . TYR A 1 80 ? 47.990 -68.716 -25.093 1.00 79.09 ? 80 TYR A CD1 1 +ATOM 586 C CD2 . TYR A 1 80 ? 47.580 -69.401 -22.853 1.00 85.38 ? 80 TYR A CD2 1 +ATOM 587 C CE1 . TYR A 1 80 ? 49.227 -69.345 -25.065 1.00 78.32 ? 80 TYR A CE1 1 +ATOM 588 C CE2 . TYR A 1 80 ? 48.813 -70.031 -22.808 1.00 79.61 ? 80 TYR A CE2 1 +ATOM 589 C CZ . TYR A 1 80 ? 49.636 -70.005 -23.917 1.00 65.75 ? 80 TYR A CZ 1 +ATOM 590 O OH . TYR A 1 80 ? 50.845 -70.630 -23.855 1.00 82.31 ? 80 TYR A OH 1 +ATOM 591 N N . LEU A 1 81 ? 43.819 -65.558 -24.514 1.00 70.77 ? 81 LEU A N 1 +ATOM 592 C CA . LEU A 1 81 ? 42.391 -65.364 -24.690 1.00 83.70 ? 81 LEU A CA 1 +ATOM 593 C C . LEU A 1 81 ? 41.928 -66.261 -25.843 1.00 96.18 ? 81 LEU A C 1 +ATOM 594 O O . LEU A 1 81 ? 42.363 -66.109 -26.990 1.00 67.39 ? 81 LEU A O 1 +ATOM 595 C CB . LEU A 1 81 ? 42.129 -63.872 -24.940 1.00 64.52 ? 81 LEU A CB 1 +ATOM 596 C CG . LEU A 1 81 ? 40.676 -63.456 -25.181 1.00 52.00 ? 81 LEU A CG 1 +ATOM 597 C CD1 . LEU A 1 81 ? 39.881 -63.447 -23.880 1.00 57.35 ? 81 LEU A CD1 1 +ATOM 598 C CD2 . LEU A 1 81 ? 40.611 -62.088 -25.845 1.00 43.07 ? 81 LEU A CD2 1 +ATOM 599 N N . GLN A 1 82 ? 41.069 -67.231 -25.508 1.00 85.73 ? 82 GLN A N 1 +ATOM 600 C CA . GLN A 1 82 ? 40.627 -68.255 -26.442 1.00 75.76 ? 82 GLN A CA 1 +ATOM 601 C C . GLN A 1 82 ? 39.295 -67.824 -27.050 1.00 71.78 ? 82 GLN A C 1 +ATOM 602 O O . GLN A 1 82 ? 38.227 -68.199 -26.565 1.00 83.56 ? 82 GLN A O 1 +ATOM 603 C CB . GLN A 1 82 ? 40.608 -69.626 -25.753 1.00 78.58 ? 82 GLN A CB 1 +ATOM 604 C CG . GLN A 1 82 ? 40.189 -70.791 -26.649 1.00 108.72 ? 82 GLN A CG 1 +ATOM 605 C CD . GLN A 1 82 ? 41.090 -71.033 -27.839 1.00 104.20 ? 82 GLN A CD 1 +ATOM 606 O OE1 . GLN A 1 82 ? 42.237 -71.463 -27.707 1.00 93.99 ? 82 GLN A OE1 1 +ATOM 607 N NE2 . GLN A 1 82 ? 40.560 -70.772 -29.023 1.00 69.66 ? 82 GLN A NE2 1 +ATOM 608 N N . MET A 1 83 ? 39.384 -67.020 -28.117 1.00 58.55 ? 83 MET A N 1 +ATOM 609 C CA . MET A 1 83 ? 38.218 -66.436 -28.763 1.00 65.36 ? 83 MET A CA 1 +ATOM 610 C C . MET A 1 83 ? 37.503 -67.498 -29.597 1.00 69.31 ? 83 MET A C 1 +ATOM 611 O O . MET A 1 83 ? 38.111 -68.078 -30.499 1.00 59.79 ? 83 MET A O 1 +ATOM 612 C CB . MET A 1 83 ? 38.627 -65.236 -29.624 1.00 48.93 ? 83 MET A CB 1 +ATOM 613 C CG . MET A 1 83 ? 39.039 -64.061 -28.772 1.00 63.68 ? 83 MET A CG 1 +ATOM 614 S SD . MET A 1 83 ? 39.959 -62.765 -29.603 1.00 63.81 ? 83 MET A SD 1 +ATOM 615 C CE . MET A 1 83 ? 38.650 -61.966 -30.531 1.00 54.74 ? 83 MET A CE 1 +ATOM 616 N N . ASN A 1 84 ? 36.226 -67.758 -29.257 1.00 49.68 ? 84 ASN A N 1 +ATOM 617 C CA . ASN A 1 84 ? 35.436 -68.818 -29.876 1.00 63.27 ? 84 ASN A CA 1 +ATOM 618 C C . ASN A 1 84 ? 34.100 -68.266 -30.377 1.00 68.94 ? 84 ASN A C 1 +ATOM 619 O O . ASN A 1 84 ? 33.488 -67.425 -29.721 1.00 52.47 ? 84 ASN A O 1 +ATOM 620 C CB . ASN A 1 84 ? 35.212 -70.010 -28.932 1.00 56.85 ? 84 ASN A CB 1 +ATOM 621 C CG . ASN A 1 84 ? 36.422 -70.895 -28.688 1.00 60.29 ? 84 ASN A CG 1 +ATOM 622 O OD1 . ASN A 1 84 ? 37.545 -70.590 -29.088 1.00 89.73 ? 84 ASN A OD1 1 +ATOM 623 N ND2 . ASN A 1 84 ? 36.209 -72.011 -28.013 1.00 49.03 ? 84 ASN A ND2 1 +ATOM 624 N N . SER A 1 85 ? 33.662 -68.765 -31.545 1.00 91.09 ? 85 SER A N 1 +ATOM 625 C CA . SER A 1 85 ? 32.392 -68.434 -32.185 1.00 74.75 ? 85 SER A CA 1 +ATOM 626 C C . SER A 1 85 ? 32.236 -66.922 -32.381 1.00 76.68 ? 85 SER A C 1 +ATOM 627 O O . SER A 1 85 ? 31.351 -66.294 -31.799 1.00 68.92 ? 85 SER A O 1 +ATOM 628 C CB . SER A 1 85 ? 31.231 -69.051 -31.439 1.00 76.49 ? 85 SER A CB 1 +ATOM 629 O OG . SER A 1 85 ? 30.009 -68.818 -32.124 1.00 103.94 ? 85 SER A OG 1 +ATOM 630 N N . LEU A 1 86 ? 33.092 -66.348 -33.237 1.00 75.44 ? 86 LEU A N 1 +ATOM 631 C CA . LEU A 1 86 ? 33.268 -64.904 -33.312 1.00 77.80 ? 86 LEU A CA 1 +ATOM 632 C C . LEU A 1 86 ? 32.153 -64.262 -34.132 1.00 72.04 ? 86 LEU A C 1 +ATOM 633 O O . LEU A 1 86 ? 31.691 -64.836 -35.115 1.00 74.74 ? 86 LEU A O 1 +ATOM 634 C CB . LEU A 1 86 ? 34.643 -64.578 -33.910 1.00 71.23 ? 86 LEU A CB 1 +ATOM 635 C CG . LEU A 1 86 ? 35.876 -65.092 -33.160 1.00 65.93 ? 86 LEU A CG 1 +ATOM 636 C CD1 . LEU A 1 86 ? 37.124 -64.358 -33.629 1.00 54.01 ? 86 LEU A CD1 1 +ATOM 637 C CD2 . LEU A 1 86 ? 35.725 -64.941 -31.654 1.00 89.19 ? 86 LEU A CD2 1 +ATOM 638 N N . ARG A 1 87 ? 31.746 -63.057 -33.706 1.00 78.21 ? 87 ARG A N 1 +ATOM 639 C CA . ARG A 1 87 ? 30.786 -62.219 -34.412 1.00 75.42 ? 87 ARG A CA 1 +ATOM 640 C C . ARG A 1 87 ? 31.501 -60.980 -34.957 1.00 64.57 ? 87 ARG A C 1 +ATOM 641 O O . ARG A 1 87 ? 32.654 -60.723 -34.622 1.00 66.79 ? 87 ARG A O 1 +ATOM 642 C CB . ARG A 1 87 ? 29.615 -61.867 -33.485 1.00 65.67 ? 87 ARG A CB 1 +ATOM 643 N N . ALA A 1 88 ? 30.787 -60.195 -35.771 1.00 61.09 ? 88 ALA A N 1 +ATOM 644 C CA . ALA A 1 88 ? 31.355 -59.086 -36.524 1.00 66.97 ? 88 ALA A CA 1 +ATOM 645 C C . ALA A 1 88 ? 31.872 -57.975 -35.610 1.00 80.09 ? 88 ALA A C 1 +ATOM 646 O O . ALA A 1 88 ? 32.833 -57.296 -35.962 1.00 100.34 ? 88 ALA A O 1 +ATOM 647 C CB . ALA A 1 88 ? 30.342 -58.552 -37.507 1.00 62.76 ? 88 ALA A CB 1 +ATOM 648 N N . GLU A 1 89 ? 31.233 -57.787 -34.450 1.00 77.80 ? 89 GLU A N 1 +ATOM 649 C CA . GLU A 1 89 ? 31.591 -56.687 -33.567 1.00 75.34 ? 89 GLU A CA 1 +ATOM 650 C C . GLU A 1 89 ? 32.630 -57.141 -32.541 1.00 71.62 ? 89 GLU A C 1 +ATOM 651 O O . GLU A 1 89 ? 32.843 -56.472 -31.532 1.00 60.86 ? 89 GLU A O 1 +ATOM 652 C CB . GLU A 1 89 ? 30.358 -55.976 -32.992 1.00 83.39 ? 89 GLU A CB 1 +ATOM 653 C CG . GLU A 1 89 ? 29.204 -56.899 -32.619 1.00 113.13 ? 89 GLU A CG 1 +ATOM 654 C CD . GLU A 1 89 ? 29.266 -57.605 -31.272 1.00 127.32 ? 89 GLU A CD 1 +ATOM 655 O OE1 . GLU A 1 89 ? 30.234 -57.382 -30.515 1.00 131.37 ? 89 GLU A OE1 1 +ATOM 656 O OE2 . GLU A 1 89 ? 28.332 -58.380 -30.978 1.00 118.10 ? 89 GLU A OE2 1 +ATOM 657 N N . ASP A 1 90 ? 33.287 -58.273 -32.828 1.00 71.13 ? 90 ASP A N 1 +ATOM 658 C CA . ASP A 1 90 ? 34.480 -58.682 -32.101 1.00 68.06 ? 90 ASP A CA 1 +ATOM 659 C C . ASP A 1 90 ? 35.709 -58.005 -32.716 1.00 64.54 ? 90 ASP A C 1 +ATOM 660 O O . ASP A 1 90 ? 36.795 -58.032 -32.133 1.00 67.78 ? 90 ASP A O 1 +ATOM 661 C CB . ASP A 1 90 ? 34.564 -60.207 -31.974 1.00 74.66 ? 90 ASP A CB 1 +ATOM 662 C CG . ASP A 1 90 ? 33.405 -60.825 -31.200 1.00 88.40 ? 90 ASP A CG 1 +ATOM 663 O OD1 . ASP A 1 90 ? 32.832 -60.129 -30.340 1.00 96.40 ? 90 ASP A OD1 1 +ATOM 664 O OD2 . ASP A 1 90 ? 33.080 -62.002 -31.462 1.00 79.24 ? 90 ASP A OD2 1 +ATOM 665 N N . THR A 1 91 ? 35.501 -57.373 -33.881 1.00 49.56 ? 91 THR A N 1 +ATOM 666 C CA . THR A 1 91 ? 36.502 -56.601 -34.601 1.00 56.53 ? 91 THR A CA 1 +ATOM 667 C C . THR A 1 91 ? 36.966 -55.438 -33.726 1.00 60.08 ? 91 THR A C 1 +ATOM 668 O O . THR A 1 91 ? 36.209 -54.490 -33.490 1.00 50.29 ? 91 THR A O 1 +ATOM 669 C CB . THR A 1 91 ? 35.985 -56.198 -35.994 1.00 67.87 ? 91 THR A CB 1 +ATOM 670 O OG1 . THR A 1 91 ? 35.876 -57.377 -36.795 1.00 74.05 ? 91 THR A OG1 1 +ATOM 671 C CG2 . THR A 1 91 ? 36.855 -55.189 -36.713 1.00 55.39 ? 91 THR A CG2 1 +ATOM 672 N N . ALA A 1 92 ? 38.216 -55.561 -33.248 1.00 53.13 ? 92 ALA A N 1 +ATOM 673 C CA . ALA A 1 92 ? 38.872 -54.602 -32.371 1.00 56.53 ? 92 ALA A CA 1 +ATOM 674 C C . ALA A 1 92 ? 40.357 -54.933 -32.272 1.00 73.74 ? 92 ALA A C 1 +ATOM 675 O O . ALA A 1 92 ? 40.788 -56.012 -32.685 1.00 86.61 ? 92 ALA A O 1 +ATOM 676 C CB . ALA A 1 92 ? 38.235 -54.631 -31.001 1.00 61.30 ? 92 ALA A CB 1 +ATOM 677 N N . VAL A 1 93 ? 41.116 -53.989 -31.697 1.00 65.26 ? 93 VAL A N 1 +ATOM 678 C CA . VAL A 1 93 ? 42.526 -54.163 -31.384 1.00 58.55 ? 93 VAL A CA 1 +ATOM 679 C C . VAL A 1 93 ? 42.633 -54.576 -29.918 1.00 57.14 ? 93 VAL A C 1 +ATOM 680 O O . VAL A 1 93 ? 42.044 -53.925 -29.058 1.00 77.57 ? 93 VAL A O 1 +ATOM 681 C CB . VAL A 1 93 ? 43.325 -52.873 -31.665 1.00 54.94 ? 93 VAL A CB 1 +ATOM 682 C CG1 . VAL A 1 93 ? 44.824 -53.108 -31.578 1.00 44.59 ? 93 VAL A CG1 1 +ATOM 683 C CG2 . VAL A 1 93 ? 42.964 -52.246 -33.005 1.00 69.84 ? 93 VAL A CG2 1 +ATOM 684 N N . TYR A 1 94 ? 43.411 -55.634 -29.644 1.00 55.23 ? 94 TYR A N 1 +ATOM 685 C CA . TYR A 1 94 ? 43.445 -56.265 -28.329 1.00 54.25 ? 94 TYR A CA 1 +ATOM 686 C C . TYR A 1 94 ? 44.769 -56.000 -27.617 1.00 57.67 ? 94 TYR A C 1 +ATOM 687 O O . TYR A 1 94 ? 45.836 -56.253 -28.177 1.00 68.33 ? 94 TYR A O 1 +ATOM 688 C CB . TYR A 1 94 ? 43.141 -57.762 -28.438 1.00 52.62 ? 94 TYR A CB 1 +ATOM 689 C CG . TYR A 1 94 ? 41.689 -58.082 -28.713 1.00 73.45 ? 94 TYR A CG 1 +ATOM 690 C CD1 . TYR A 1 94 ? 41.097 -57.762 -29.929 1.00 54.10 ? 94 TYR A CD1 1 +ATOM 691 C CD2 . TYR A 1 94 ? 40.899 -58.704 -27.752 1.00 77.01 ? 94 TYR A CD2 1 +ATOM 692 C CE1 . TYR A 1 94 ? 39.762 -58.045 -30.181 1.00 77.80 ? 94 TYR A CE1 1 +ATOM 693 C CE2 . TYR A 1 94 ? 39.564 -58.998 -27.990 1.00 64.36 ? 94 TYR A CE2 1 +ATOM 694 C CZ . TYR A 1 94 ? 38.993 -58.663 -29.207 1.00 74.05 ? 94 TYR A CZ 1 +ATOM 695 O OH . TYR A 1 94 ? 37.680 -58.943 -29.452 1.00 86.19 ? 94 TYR A OH 1 +ATOM 696 N N . TYR A 1 95 ? 44.666 -55.488 -26.380 1.00 48.64 ? 95 TYR A N 1 +ATOM 697 C CA . TYR A 1 95 ? 45.795 -55.211 -25.505 1.00 33.80 ? 95 TYR A CA 1 +ATOM 698 C C . TYR A 1 95 ? 45.699 -56.111 -24.286 1.00 33.92 ? 95 TYR A C 1 +ATOM 699 O O . TYR A 1 95 ? 44.596 -56.445 -23.869 1.00 50.34 ? 95 TYR A O 1 +ATOM 700 C CB . TYR A 1 95 ? 45.774 -53.756 -25.029 1.00 33.97 ? 95 TYR A CB 1 +ATOM 701 C CG . TYR A 1 95 ? 45.789 -52.744 -26.144 1.00 34.66 ? 95 TYR A CG 1 +ATOM 702 C CD1 . TYR A 1 95 ? 44.607 -52.342 -26.741 1.00 35.58 ? 95 TYR A CD1 1 +ATOM 703 C CD2 . TYR A 1 95 ? 46.977 -52.229 -26.646 1.00 45.31 ? 95 TYR A CD2 1 +ATOM 704 C CE1 . TYR A 1 95 ? 44.596 -51.442 -27.792 1.00 41.90 ? 95 TYR A CE1 1 +ATOM 705 C CE2 . TYR A 1 95 ? 46.986 -51.329 -27.704 1.00 44.86 ? 95 TYR A CE2 1 +ATOM 706 C CZ . TYR A 1 95 ? 45.788 -50.931 -28.273 1.00 45.49 ? 95 TYR A CZ 1 +ATOM 707 O OH . TYR A 1 95 ? 45.741 -50.035 -29.299 1.00 45.43 ? 95 TYR A OH 1 +ATOM 708 N N . CYS A 1 96 ? 46.861 -56.505 -23.751 1.00 43.70 ? 96 CYS A N 1 +ATOM 709 C CA . CYS A 1 96 ? 46.972 -57.118 -22.434 1.00 64.74 ? 96 CYS A CA 1 +ATOM 710 C C . CYS A 1 96 ? 47.746 -56.175 -21.511 1.00 70.03 ? 96 CYS A C 1 +ATOM 711 O O . CYS A 1 96 ? 48.457 -55.291 -21.988 1.00 73.73 ? 96 CYS A O 1 +ATOM 712 C CB . CYS A 1 96 ? 47.657 -58.479 -22.506 1.00 58.77 ? 96 CYS A CB 1 +ATOM 713 S SG . CYS A 1 96 ? 49.361 -58.376 -23.114 1.00 87.20 ? 96 CYS A SG 1 +ATOM 714 N N . ALA A 1 97 ? 47.594 -56.364 -20.192 1.00 57.85 ? 97 ALA A N 1 +ATOM 715 C CA . ALA A 1 97 ? 48.199 -55.471 -19.215 1.00 52.17 ? 97 ALA A CA 1 +ATOM 716 C C . ALA A 1 97 ? 48.514 -56.195 -17.905 1.00 58.98 ? 97 ALA A C 1 +ATOM 717 O O . ALA A 1 97 ? 47.796 -57.110 -17.489 1.00 57.83 ? 97 ALA A O 1 +ATOM 718 C CB . ALA A 1 97 ? 47.301 -54.282 -18.992 1.00 45.66 ? 97 ALA A CB 1 +ATOM 719 N N . LYS A 1 98 ? 49.621 -55.770 -17.277 1.00 51.10 ? 98 LYS A N 1 +ATOM 720 C CA . LYS A 1 98 ? 49.959 -56.159 -15.917 1.00 58.97 ? 98 LYS A CA 1 +ATOM 721 C C . LYS A 1 98 ? 48.998 -55.457 -14.952 1.00 60.20 ? 98 LYS A C 1 +ATOM 722 O O . LYS A 1 98 ? 49.030 -54.231 -14.820 1.00 51.95 ? 98 LYS A O 1 +ATOM 723 C CB . LYS A 1 98 ? 51.451 -55.921 -15.622 1.00 48.53 ? 98 LYS A CB 1 +ATOM 724 C CG . LYS A 1 98 ? 51.926 -56.398 -14.250 1.00 57.18 ? 98 LYS A CG 1 +ATOM 725 C CD . LYS A 1 98 ? 53.424 -56.350 -13.952 1.00 40.63 ? 98 LYS A CD 1 +ATOM 726 C CE . LYS A 1 98 ? 53.929 -55.039 -13.387 1.00 52.21 ? 98 LYS A CE 1 +ATOM 727 N NZ . LYS A 1 98 ? 52.989 -54.443 -12.406 1.00 68.49 ? 98 LYS A NZ 1 +ATOM 728 N N . ASP A 1 99 ? 48.121 -56.264 -14.329 1.00 55.78 ? 99 ASP A N 1 +ATOM 729 C CA . ASP A 1 99 ? 47.195 -55.858 -13.279 1.00 50.35 ? 99 ASP A CA 1 +ATOM 730 C C . ASP A 1 99 ? 47.844 -56.113 -11.914 1.00 43.20 ? 99 ASP A C 1 +ATOM 731 O O . ASP A 1 99 ? 49.064 -55.996 -11.771 1.00 42.00 ? 99 ASP A O 1 +ATOM 732 C CB . ASP A 1 99 ? 45.816 -56.515 -13.460 1.00 53.95 ? 99 ASP A CB 1 +ATOM 733 C CG . ASP A 1 99 ? 44.659 -55.797 -12.766 1.00 60.56 ? 99 ASP A CG 1 +ATOM 734 O OD1 . ASP A 1 99 ? 44.733 -55.600 -11.532 1.00 58.65 ? 99 ASP A OD1 1 +ATOM 735 O OD2 . ASP A 1 99 ? 43.683 -55.439 -13.462 1.00 53.33 ? 99 ASP A OD2 1 +ATOM 736 N N . ARG A 1 100 ? 47.024 -56.494 -10.926 1.00 33.76 ? 100 ARG A N 1 +ATOM 737 C CA . ARG A 1 100 ? 47.415 -56.426 -9.524 1.00 55.65 ? 100 ARG A CA 1 +ATOM 738 C C . ARG A 1 100 ? 48.254 -57.629 -9.091 1.00 42.85 ? 100 ARG A C 1 +ATOM 739 O O . ARG A 1 100 ? 47.969 -58.772 -9.448 1.00 52.03 ? 100 ARG A O 1 +ATOM 740 C CB . ARG A 1 100 ? 46.208 -56.149 -8.612 1.00 58.94 ? 100 ARG A CB 1 +ATOM 741 C CG . ARG A 1 100 ? 45.122 -57.218 -8.613 1.00 58.14 ? 100 ARG A CG 1 +ATOM 742 C CD . ARG A 1 100 ? 43.794 -56.707 -8.083 1.00 59.88 ? 100 ARG A CD 1 +ATOM 743 N NE . ARG A 1 100 ? 43.203 -55.754 -9.015 1.00 70.04 ? 100 ARG A NE 1 +ATOM 744 C CZ . ARG A 1 100 ? 42.191 -54.931 -8.750 1.00 65.14 ? 100 ARG A CZ 1 +ATOM 745 N NH1 . ARG A 1 100 ? 41.977 -53.892 -9.539 1.00 48.88 ? 100 ARG A NH1 1 +ATOM 746 N NH2 . ARG A 1 100 ? 41.414 -55.127 -7.695 1.00 60.44 ? 100 ARG A NH2 1 +ATOM 747 N N . LEU A 1 101 ? 49.294 -57.341 -8.302 1.00 38.98 ? 101 LEU A N 1 +ATOM 748 C CA . LEU A 1 101 ? 49.968 -58.349 -7.498 1.00 58.70 ? 101 LEU A CA 1 +ATOM 749 C C . LEU A 1 101 ? 48.921 -59.091 -6.669 1.00 62.00 ? 101 LEU A C 1 +ATOM 750 O O . LEU A 1 101 ? 48.214 -58.456 -5.888 1.00 54.01 ? 101 LEU A O 1 +ATOM 751 C CB . LEU A 1 101 ? 50.998 -57.661 -6.594 1.00 48.95 ? 101 LEU A CB 1 +ATOM 752 C CG . LEU A 1 101 ? 51.650 -58.554 -5.539 1.00 53.54 ? 101 LEU A CG 1 +ATOM 753 C CD1 . LEU A 1 101 ? 53.164 -58.432 -5.554 1.00 52.20 ? 101 LEU A CD1 1 +ATOM 754 C CD2 . LEU A 1 101 ? 51.112 -58.233 -4.159 1.00 73.22 ? 101 LEU A CD2 1 +ATOM 755 N N . SER A 1 102 ? 48.850 -60.423 -6.851 1.00 51.51 ? 102 SER A N 1 +ATOM 756 C CA . SER A 1 102 ? 47.825 -61.251 -6.237 1.00 42.74 ? 102 SER A CA 1 +ATOM 757 C C . SER A 1 102 ? 48.389 -62.322 -5.298 1.00 58.93 ? 102 SER A C 1 +ATOM 758 O O . SER A 1 102 ? 47.620 -62.900 -4.526 1.00 64.42 ? 102 SER A O 1 +ATOM 759 C CB . SER A 1 102 ? 46.902 -61.843 -7.261 1.00 46.83 ? 102 SER A CB 1 +ATOM 760 O OG . SER A 1 102 ? 47.471 -63.006 -7.839 1.00 59.88 ? 102 SER A OG 1 +ATOM 761 N N . ILE A 1 103 ? 49.707 -62.592 -5.340 1.00 54.29 ? 103 ILE A N 1 +ATOM 762 C CA . ILE A 1 103 ? 50.253 -63.624 -4.461 1.00 59.44 ? 103 ILE A CA 1 +ATOM 763 C C . ILE A 1 103 ? 49.779 -63.393 -3.031 1.00 53.11 ? 103 ILE A C 1 +ATOM 764 O O . ILE A 1 103 ? 49.269 -64.319 -2.415 1.00 73.45 ? 103 ILE A O 1 +ATOM 765 C CB . ILE A 1 103 ? 51.788 -63.786 -4.481 1.00 52.42 ? 103 ILE A CB 1 +ATOM 766 C CG1 . ILE A 1 103 ? 52.531 -62.502 -4.855 1.00 61.85 ? 103 ILE A CG1 1 +ATOM 767 C CG2 . ILE A 1 103 ? 52.215 -65.000 -5.296 1.00 40.83 ? 103 ILE A CG2 1 +ATOM 768 C CD1 . ILE A 1 103 ? 53.701 -62.194 -3.937 1.00 82.26 ? 103 ILE A CD1 1 +ATOM 769 N N . THR A 1 104 ? 49.942 -62.160 -2.537 1.00 52.97 ? 104 THR A N 1 +ATOM 770 C CA . THR A 1 104 ? 49.829 -61.829 -1.122 1.00 57.28 ? 104 THR A CA 1 +ATOM 771 C C . THR A 1 104 ? 48.364 -61.809 -0.682 1.00 66.51 ? 104 THR A C 1 +ATOM 772 O O . THR A 1 104 ? 47.461 -61.702 -1.518 1.00 63.54 ? 104 THR A O 1 +ATOM 773 C CB . THR A 1 104 ? 50.493 -60.478 -0.842 1.00 51.03 ? 104 THR A CB 1 +ATOM 774 O OG1 . THR A 1 104 ? 49.846 -59.545 -1.709 1.00 51.94 ? 104 THR A OG1 1 +ATOM 775 C CG2 . THR A 1 104 ? 51.984 -60.480 -1.103 1.00 43.68 ? 104 THR A CG2 1 +ATOM 776 N N . ILE A 1 105 ? 48.155 -61.896 0.641 1.00 48.75 ? 105 ILE A N 1 +ATOM 777 C CA . ILE A 1 105 ? 46.831 -61.990 1.237 1.00 53.84 ? 105 ILE A CA 1 +ATOM 778 C C . ILE A 1 105 ? 45.959 -60.839 0.739 1.00 52.09 ? 105 ILE A C 1 +ATOM 779 O O . ILE A 1 105 ? 44.825 -61.074 0.334 1.00 46.42 ? 105 ILE A O 1 +ATOM 780 C CB . ILE A 1 105 ? 46.893 -62.069 2.778 1.00 53.29 ? 105 ILE A CB 1 +ATOM 781 N N . ARG A 1 106 ? 46.495 -59.606 0.756 1.00 63.32 ? 106 ARG A N 1 +ATOM 782 C CA . ARG A 1 106 ? 45.826 -58.466 0.136 1.00 58.30 ? 106 ARG A CA 1 +ATOM 783 C C . ARG A 1 106 ? 46.496 -58.149 -1.199 1.00 49.37 ? 106 ARG A C 1 +ATOM 784 O O . ARG A 1 106 ? 47.714 -57.971 -1.249 1.00 43.58 ? 106 ARG A O 1 +ATOM 785 C CB . ARG A 1 106 ? 45.806 -57.225 1.038 1.00 50.50 ? 106 ARG A CB 1 +ATOM 786 C CG . ARG A 1 106 ? 44.872 -56.114 0.565 1.00 68.08 ? 106 ARG A CG 1 +ATOM 787 C CD . ARG A 1 106 ? 45.016 -54.703 1.144 1.00 70.13 ? 106 ARG A CD 1 +ATOM 788 N NE . ARG A 1 106 ? 45.216 -54.616 2.589 1.00 63.21 ? 106 ARG A NE 1 +ATOM 789 C CZ . ARG A 1 106 ? 44.308 -54.924 3.516 1.00 65.96 ? 106 ARG A CZ 1 +ATOM 790 N NH1 . ARG A 1 106 ? 44.695 -55.494 4.645 1.00 52.12 ? 106 ARG A NH1 1 +ATOM 791 N NH2 . ARG A 1 106 ? 43.019 -54.713 3.298 1.00 44.44 ? 106 ARG A NH2 1 +ATOM 792 N N . PRO A 1 107 ? 45.723 -58.060 -2.311 1.00 51.32 ? 107 PRO A N 1 +ATOM 793 C CA . PRO A 1 107 ? 46.256 -57.594 -3.591 1.00 52.12 ? 107 PRO A CA 1 +ATOM 794 C C . PRO A 1 107 ? 46.840 -56.185 -3.481 1.00 65.54 ? 107 PRO A C 1 +ATOM 795 O O . PRO A 1 107 ? 46.357 -55.372 -2.693 1.00 75.11 ? 107 PRO A O 1 +ATOM 796 C CB . PRO A 1 107 ? 45.040 -57.550 -4.533 1.00 39.51 ? 107 PRO A CB 1 +ATOM 797 C CG . PRO A 1 107 ? 44.000 -58.426 -3.879 1.00 47.92 ? 107 PRO A CG 1 +ATOM 798 C CD . PRO A 1 107 ? 44.292 -58.397 -2.393 1.00 50.12 ? 107 PRO A CD 1 +ATOM 799 N N . ARG A 1 108 ? 47.899 -55.925 -4.258 1.00 63.00 ? 108 ARG A N 1 +ATOM 800 C CA . ARG A 1 108 ? 48.411 -54.577 -4.462 1.00 54.98 ? 108 ARG A CA 1 +ATOM 801 C C . ARG A 1 108 ? 48.245 -54.217 -5.935 1.00 50.07 ? 108 ARG A C 1 +ATOM 802 O O . ARG A 1 108 ? 48.699 -54.944 -6.816 1.00 60.36 ? 108 ARG A O 1 +ATOM 803 C CB . ARG A 1 108 ? 49.875 -54.461 -4.021 1.00 65.93 ? 108 ARG A CB 1 +ATOM 804 C CG . ARG A 1 108 ? 50.139 -54.889 -2.583 1.00 61.62 ? 108 ARG A CG 1 +ATOM 805 C CD . ARG A 1 108 ? 51.619 -54.906 -2.256 1.00 68.77 ? 108 ARG A CD 1 +ATOM 806 N NE . ARG A 1 108 ? 51.890 -55.643 -1.027 1.00 97.82 ? 108 ARG A NE 1 +ATOM 807 C CZ . ARG A 1 108 ? 53.100 -56.007 -0.607 1.00 92.36 ? 108 ARG A CZ 1 +ATOM 808 N NH1 . ARG A 1 108 ? 54.180 -55.602 -1.253 1.00 100.16 ? 108 ARG A NH1 1 +ATOM 809 N NH2 . ARG A 1 108 ? 53.228 -56.777 0.458 1.00 82.42 ? 108 ARG A NH2 1 +ATOM 810 N N . TYR A 1 109 ? 47.573 -53.092 -6.178 1.00 46.58 ? 109 TYR A N 1 +ATOM 811 C CA . TYR A 1 109 ? 47.270 -52.614 -7.515 1.00 51.96 ? 109 TYR A CA 1 +ATOM 812 C C . TYR A 1 109 ? 47.834 -51.206 -7.689 1.00 57.84 ? 109 TYR A C 1 +ATOM 813 O O . TYR A 1 109 ? 47.527 -50.312 -6.903 1.00 78.23 ? 109 TYR A O 1 +ATOM 814 C CB . TYR A 1 109 ? 45.756 -52.650 -7.734 1.00 47.77 ? 109 TYR A CB 1 +ATOM 815 C CG . TYR A 1 109 ? 45.256 -51.897 -8.937 1.00 43.76 ? 109 TYR A CG 1 +ATOM 816 C CD1 . TYR A 1 109 ? 45.118 -52.528 -10.167 1.00 47.31 ? 109 TYR A CD1 1 +ATOM 817 C CD2 . TYR A 1 109 ? 44.888 -50.563 -8.837 1.00 50.54 ? 109 TYR A CD2 1 +ATOM 818 C CE1 . TYR A 1 109 ? 44.646 -51.840 -11.276 1.00 56.95 ? 109 TYR A CE1 1 +ATOM 819 C CE2 . TYR A 1 109 ? 44.406 -49.863 -9.933 1.00 54.02 ? 109 TYR A CE2 1 +ATOM 820 C CZ . TYR A 1 109 ? 44.290 -50.503 -11.158 1.00 56.38 ? 109 TYR A CZ 1 +ATOM 821 O OH . TYR A 1 109 ? 43.837 -49.806 -12.243 1.00 41.80 ? 109 TYR A OH 1 +ATOM 822 N N . TYR A 1 110 ? 48.653 -51.035 -8.733 1.00 56.28 ? 110 TYR A N 1 +ATOM 823 C CA . TYR A 1 110 ? 49.288 -49.772 -9.062 1.00 44.79 ? 110 TYR A CA 1 +ATOM 824 C C . TYR A 1 110 ? 48.897 -49.379 -10.486 1.00 58.36 ? 110 TYR A C 1 +ATOM 825 O O . TYR A 1 110 ? 49.727 -48.893 -11.254 1.00 72.58 ? 110 TYR A O 1 +ATOM 826 C CB . TYR A 1 110 ? 50.808 -49.909 -8.938 1.00 46.45 ? 110 TYR A CB 1 +ATOM 827 C CG . TYR A 1 110 ? 51.324 -50.504 -7.651 1.00 75.69 ? 110 TYR A CG 1 +ATOM 828 C CD1 . TYR A 1 110 ? 51.419 -49.745 -6.487 1.00 85.84 ? 110 TYR A CD1 1 +ATOM 829 C CD2 . TYR A 1 110 ? 51.753 -51.826 -7.603 1.00 85.90 ? 110 TYR A CD2 1 +ATOM 830 C CE1 . TYR A 1 110 ? 51.908 -50.285 -5.304 1.00 64.09 ? 110 TYR A CE1 1 +ATOM 831 C CE2 . TYR A 1 110 ? 52.244 -52.382 -6.429 1.00 88.22 ? 110 TYR A CE2 1 +ATOM 832 C CZ . TYR A 1 110 ? 52.323 -51.610 -5.278 1.00 83.12 ? 110 TYR A CZ 1 +ATOM 833 O OH . TYR A 1 110 ? 52.804 -52.170 -4.128 1.00 67.91 ? 110 TYR A OH 1 +ATOM 834 N N . GLY A 1 111 ? 47.629 -49.620 -10.845 1.00 52.32 ? 111 GLY A N 1 +ATOM 835 C CA . GLY A 1 111 ? 47.146 -49.357 -12.195 1.00 64.77 ? 111 GLY A CA 1 +ATOM 836 C C . GLY A 1 111 ? 47.556 -50.443 -13.188 1.00 59.87 ? 111 GLY A C 1 +ATOM 837 O O . GLY A 1 111 ? 48.359 -51.321 -12.868 1.00 61.86 ? 111 GLY A O 1 +ATOM 838 N N . LEU A 1 112 ? 46.987 -50.381 -14.397 1.00 39.93 ? 112 LEU A N 1 +ATOM 839 C CA . LEU A 1 112 ? 47.543 -51.149 -15.504 1.00 53.53 ? 112 LEU A CA 1 +ATOM 840 C C . LEU A 1 112 ? 48.816 -50.453 -15.995 1.00 55.68 ? 112 LEU A C 1 +ATOM 841 O O . LEU A 1 112 ? 48.771 -49.549 -16.837 1.00 42.74 ? 112 LEU A O 1 +ATOM 842 C CB . LEU A 1 112 ? 46.483 -51.325 -16.599 1.00 49.90 ? 112 LEU A CB 1 +ATOM 843 C CG . LEU A 1 112 ? 45.157 -51.931 -16.129 1.00 49.17 ? 112 LEU A CG 1 +ATOM 844 C CD1 . LEU A 1 112 ? 44.079 -51.778 -17.191 1.00 72.35 ? 112 LEU A CD1 1 +ATOM 845 C CD2 . LEU A 1 112 ? 45.310 -53.396 -15.721 1.00 47.31 ? 112 LEU A CD2 1 +ATOM 846 N N . ASP A 1 113 ? 49.953 -50.864 -15.413 1.00 52.65 ? 113 ASP A N 1 +ATOM 847 C CA . ASP A 1 113 ? 51.154 -50.038 -15.407 1.00 56.20 ? 113 ASP A CA 1 +ATOM 848 C C . ASP A 1 113 ? 52.113 -50.420 -16.534 1.00 68.89 ? 113 ASP A C 1 +ATOM 849 O O . ASP A 1 113 ? 53.057 -49.680 -16.804 1.00 65.08 ? 113 ASP A O 1 +ATOM 850 C CB . ASP A 1 113 ? 51.821 -50.007 -14.028 1.00 51.16 ? 113 ASP A CB 1 +ATOM 851 C CG . ASP A 1 113 ? 52.204 -51.363 -13.456 1.00 68.57 ? 113 ASP A CG 1 +ATOM 852 O OD1 . ASP A 1 113 ? 51.734 -52.395 -13.989 1.00 77.18 ? 113 ASP A OD1 1 +ATOM 853 O OD2 . ASP A 1 113 ? 52.961 -51.375 -12.460 1.00 68.23 ? 113 ASP A OD2 1 +ATOM 854 N N . VAL A 1 114 ? 51.864 -51.578 -17.163 1.00 70.71 ? 114 VAL A N 1 +ATOM 855 C CA . VAL A 1 114 ? 52.650 -52.104 -18.269 1.00 60.15 ? 114 VAL A CA 1 +ATOM 856 C C . VAL A 1 114 ? 51.671 -52.604 -19.331 1.00 65.63 ? 114 VAL A C 1 +ATOM 857 O O . VAL A 1 114 ? 50.771 -53.385 -19.020 1.00 57.22 ? 114 VAL A O 1 +ATOM 858 C CB . VAL A 1 114 ? 53.596 -53.229 -17.795 1.00 58.00 ? 114 VAL A CB 1 +ATOM 859 C CG1 . VAL A 1 114 ? 54.213 -54.000 -18.953 1.00 64.58 ? 114 VAL A CG1 1 +ATOM 860 C CG2 . VAL A 1 114 ? 54.685 -52.723 -16.859 1.00 60.72 ? 114 VAL A CG2 1 +ATOM 861 N N . TRP A 1 115 ? 51.862 -52.158 -20.581 1.00 61.31 ? 115 TRP A N 1 +ATOM 862 C CA . TRP A 1 115 ? 50.943 -52.506 -21.657 1.00 62.31 ? 115 TRP A CA 1 +ATOM 863 C C . TRP A 1 115 ? 51.650 -53.229 -22.804 1.00 62.72 ? 115 TRP A C 1 +ATOM 864 O O . TRP A 1 115 ? 52.794 -52.928 -23.145 1.00 78.07 ? 115 TRP A O 1 +ATOM 865 C CB . TRP A 1 115 ? 50.180 -51.274 -22.159 1.00 58.72 ? 115 TRP A CB 1 +ATOM 866 C CG . TRP A 1 115 ? 49.109 -50.778 -21.237 1.00 54.07 ? 115 TRP A CG 1 +ATOM 867 C CD1 . TRP A 1 115 ? 49.289 -50.130 -20.051 1.00 77.61 ? 115 TRP A CD1 1 +ATOM 868 C CD2 . TRP A 1 115 ? 47.686 -50.849 -21.436 1.00 58.13 ? 115 TRP A CD2 1 +ATOM 869 N NE1 . TRP A 1 115 ? 48.082 -49.801 -19.496 1.00 77.61 ? 115 TRP A NE1 1 +ATOM 870 C CE2 . TRP A 1 115 ? 47.080 -50.226 -20.320 1.00 63.55 ? 115 TRP A CE2 1 +ATOM 871 C CE3 . TRP A 1 115 ? 46.864 -51.370 -22.444 1.00 56.00 ? 115 TRP A CE3 1 +ATOM 872 C CZ2 . TRP A 1 115 ? 45.696 -50.118 -20.178 1.00 59.75 ? 115 TRP A CZ2 1 +ATOM 873 C CZ3 . TRP A 1 115 ? 45.497 -51.268 -22.304 1.00 62.35 ? 115 TRP A CZ3 1 +ATOM 874 C CH2 . TRP A 1 115 ? 44.923 -50.650 -21.187 1.00 72.38 ? 115 TRP A CH2 1 +ATOM 875 N N . GLY A 1 116 ? 50.930 -54.187 -23.397 1.00 63.13 ? 116 GLY A N 1 +ATOM 876 C CA . GLY A 1 116 ? 51.338 -54.845 -24.627 1.00 61.16 ? 116 GLY A CA 1 +ATOM 877 C C . GLY A 1 116 ? 51.105 -53.950 -25.842 1.00 51.68 ? 116 GLY A C 1 +ATOM 878 O O . GLY A 1 116 ? 50.321 -53.003 -25.784 1.00 47.52 ? 116 GLY A O 1 +ATOM 879 N N . GLN A 1 117 ? 51.769 -54.304 -26.948 1.00 52.00 ? 117 GLN A N 1 +ATOM 880 C CA . GLN A 1 117 ? 51.871 -53.477 -28.141 1.00 53.67 ? 117 GLN A CA 1 +ATOM 881 C C . GLN A 1 117 ? 50.558 -53.492 -28.927 1.00 55.89 ? 117 GLN A C 1 +ATOM 882 O O . GLN A 1 117 ? 50.320 -52.613 -29.755 1.00 67.67 ? 117 GLN A O 1 +ATOM 883 C CB . GLN A 1 117 ? 53.098 -53.888 -28.963 1.00 48.70 ? 117 GLN A CB 1 +ATOM 884 C CG . GLN A 1 117 ? 52.846 -54.965 -30.016 1.00 50.20 ? 117 GLN A CG 1 +ATOM 885 C CD . GLN A 1 117 ? 52.911 -56.401 -29.546 1.00 60.81 ? 117 GLN A CD 1 +ATOM 886 O OE1 . GLN A 1 117 ? 53.682 -56.775 -28.663 1.00 59.36 ? 117 GLN A OE1 1 +ATOM 887 N NE2 . GLN A 1 117 ? 52.111 -57.245 -30.176 1.00 70.22 ? 117 GLN A NE2 1 +ATOM 888 N N . GLY A 1 118 ? 49.715 -54.492 -28.647 1.00 53.00 ? 118 GLY A N 1 +ATOM 889 C CA . GLY A 1 118 ? 48.437 -54.663 -29.318 1.00 60.58 ? 118 GLY A CA 1 +ATOM 890 C C . GLY A 1 118 ? 48.532 -55.724 -30.408 1.00 65.39 ? 118 GLY A C 1 +ATOM 891 O O . GLY A 1 118 ? 49.629 -56.053 -30.851 1.00 61.04 ? 118 GLY A O 1 +ATOM 892 N N . THR A 1 119 ? 47.369 -56.259 -30.802 1.00 66.21 ? 119 THR A N 1 +ATOM 893 C CA . THR A 1 119 ? 47.232 -57.169 -31.930 1.00 61.72 ? 119 THR A CA 1 +ATOM 894 C C . THR A 1 119 ? 45.794 -57.113 -32.435 1.00 62.92 ? 119 THR A C 1 +ATOM 895 O O . THR A 1 119 ? 44.855 -56.969 -31.650 1.00 62.04 ? 119 THR A O 1 +ATOM 896 C CB . THR A 1 119 ? 47.724 -58.587 -31.604 1.00 72.91 ? 119 THR A CB 1 +ATOM 897 O OG1 . THR A 1 119 ? 47.422 -59.437 -32.712 1.00 88.33 ? 119 THR A OG1 1 +ATOM 898 C CG2 . THR A 1 119 ? 47.137 -59.158 -30.332 1.00 67.94 ? 119 THR A CG2 1 +ATOM 899 N N . THR A 1 120 ? 45.636 -57.238 -33.754 1.00 51.01 ? 120 THR A N 1 +ATOM 900 C CA . THR A 1 120 ? 44.359 -56.925 -34.370 1.00 48.81 ? 120 THR A CA 1 +ATOM 901 C C . THR A 1 120 ? 43.625 -58.207 -34.741 1.00 52.39 ? 120 THR A C 1 +ATOM 902 O O . THR A 1 120 ? 44.230 -59.147 -35.251 1.00 54.35 ? 120 THR A O 1 +ATOM 903 C CB . THR A 1 120 ? 44.552 -55.926 -35.515 1.00 50.05 ? 120 THR A CB 1 +ATOM 904 O OG1 . THR A 1 120 ? 45.166 -54.772 -34.937 1.00 48.54 ? 120 THR A OG1 1 +ATOM 905 C CG2 . THR A 1 120 ? 43.265 -55.560 -36.223 1.00 37.21 ? 120 THR A CG2 1 +ATOM 906 N N . VAL A 1 121 ? 42.316 -58.215 -34.459 1.00 45.52 ? 121 VAL A N 1 +ATOM 907 C CA . VAL A 1 121 ? 41.405 -59.259 -34.895 1.00 40.79 ? 121 VAL A CA 1 +ATOM 908 C C . VAL A 1 121 ? 40.349 -58.616 -35.791 1.00 51.44 ? 121 VAL A C 1 +ATOM 909 O O . VAL A 1 121 ? 39.669 -57.676 -35.381 1.00 59.08 ? 121 VAL A O 1 +ATOM 910 C CB . VAL A 1 121 ? 40.744 -59.962 -33.694 1.00 48.50 ? 121 VAL A CB 1 +ATOM 911 C CG1 . VAL A 1 121 ? 39.618 -60.894 -34.128 1.00 39.59 ? 121 VAL A CG1 1 +ATOM 912 C CG2 . VAL A 1 121 ? 41.756 -60.679 -32.804 1.00 37.21 ? 121 VAL A CG2 1 +ATOM 913 N N . THR A 1 122 ? 40.234 -59.133 -37.019 1.00 60.82 ? 122 THR A N 1 +ATOM 914 C CA . THR A 1 122 ? 39.189 -58.737 -37.949 1.00 65.55 ? 122 THR A CA 1 +ATOM 915 C C . THR A 1 122 ? 38.320 -59.962 -38.227 1.00 73.34 ? 122 THR A C 1 +ATOM 916 O O . THR A 1 122 ? 38.841 -61.056 -38.436 1.00 69.82 ? 122 THR A O 1 +ATOM 917 C CB . THR A 1 122 ? 39.768 -58.095 -39.221 1.00 59.53 ? 122 THR A CB 1 +ATOM 918 O OG1 . THR A 1 122 ? 40.729 -57.089 -38.892 1.00 57.19 ? 122 THR A OG1 1 +ATOM 919 C CG2 . THR A 1 122 ? 38.711 -57.486 -40.119 1.00 50.29 ? 122 THR A CG2 1 +ATOM 920 N N . VAL A 1 123 ? 36.995 -59.762 -38.204 1.00 70.51 ? 123 VAL A N 1 +ATOM 921 C CA . VAL A 1 123 ? 36.043 -60.850 -38.359 1.00 63.47 ? 123 VAL A CA 1 +ATOM 922 C C . VAL A 1 123 ? 35.226 -60.575 -39.618 1.00 61.04 ? 123 VAL A C 1 +ATOM 923 O O . VAL A 1 123 ? 34.257 -59.819 -39.576 1.00 63.99 ? 123 VAL A O 1 +ATOM 924 C CB . VAL A 1 123 ? 35.167 -61.030 -37.098 1.00 63.85 ? 123 VAL A CB 1 +ATOM 925 C CG1 . VAL A 1 123 ? 34.233 -62.224 -37.210 1.00 65.15 ? 123 VAL A CG1 1 +ATOM 926 C CG2 . VAL A 1 123 ? 35.994 -61.146 -35.825 1.00 60.04 ? 123 VAL A CG2 1 +ATOM 927 N N . SER A 1 124 ? 35.643 -61.191 -40.735 1.00 74.54 ? 124 SER A N 1 +ATOM 928 C CA . SER A 1 124 ? 35.104 -60.867 -42.049 1.00 79.98 ? 124 SER A CA 1 +ATOM 929 C C . SER A 1 124 ? 35.060 -62.084 -42.975 1.00 80.97 ? 124 SER A C 1 +ATOM 930 O O . SER A 1 124 ? 35.725 -63.095 -42.747 1.00 71.65 ? 124 SER A O 1 +ATOM 931 C CB . SER A 1 124 ? 35.862 -59.724 -42.678 1.00 85.36 ? 124 SER A CB 1 +ATOM 932 O OG . SER A 1 124 ? 35.244 -59.308 -43.887 1.00 107.13 ? 124 SER A OG 1 +ATOM 933 N N . SER A 1 125 ? 34.280 -61.936 -44.052 1.00 88.83 ? 125 SER A N 1 +ATOM 934 C CA . SER A 1 125 ? 33.999 -62.995 -45.009 1.00 111.27 ? 125 SER A CA 1 +ATOM 935 C C . SER A 1 125 ? 34.785 -62.808 -46.310 1.00 106.67 ? 125 SER A C 1 +ATOM 936 O O . SER A 1 125 ? 34.787 -63.698 -47.158 1.00 124.42 ? 125 SER A O 1 +ATOM 937 C CB . SER A 1 125 ? 32.512 -63.107 -45.254 1.00 118.36 ? 125 SER A CB 1 +ATOM 938 O OG . SER A 1 125 ? 31.896 -61.825 -45.263 1.00 89.89 ? 125 SER A OG 1 +ATOM 939 N N . ALA A 1 126 ? 35.443 -61.650 -46.465 1.00 103.39 ? 126 ALA A N 1 +ATOM 940 C CA . ALA A 1 126 ? 36.356 -61.405 -47.573 1.00 102.14 ? 126 ALA A CA 1 +ATOM 941 C C . ALA A 1 126 ? 37.712 -62.041 -47.262 1.00 96.88 ? 126 ALA A C 1 +ATOM 942 O O . ALA A 1 126 ? 37.936 -62.511 -46.144 1.00 95.12 ? 126 ALA A O 1 +ATOM 943 C CB . ALA A 1 126 ? 36.464 -59.921 -47.843 1.00 108.34 ? 126 ALA A CB 1 +ATOM 944 N N . SER A 1 127 ? 38.608 -62.054 -48.259 1.00 79.58 ? 127 SER A N 1 +ATOM 945 C CA . SER A 1 127 ? 39.857 -62.795 -48.166 1.00 73.97 ? 127 SER A CA 1 +ATOM 946 C C . SER A 1 127 ? 41.051 -61.857 -47.994 1.00 73.21 ? 127 SER A C 1 +ATOM 947 O O . SER A 1 127 ? 41.084 -60.769 -48.569 1.00 84.59 ? 127 SER A O 1 +ATOM 948 C CB . SER A 1 127 ? 40.032 -63.715 -49.348 1.00 81.20 ? 127 SER A CB 1 +ATOM 949 O OG . SER A 1 127 ? 40.893 -64.798 -49.022 1.00 83.28 ? 127 SER A OG 1 +ATOM 950 N N . THR A 1 128 ? 42.040 -62.330 -47.221 1.00 68.60 ? 128 THR A N 1 +ATOM 951 C CA . THR A 1 128 ? 43.230 -61.590 -46.819 1.00 69.94 ? 128 THR A CA 1 +ATOM 952 C C . THR A 1 128 ? 44.201 -61.419 -47.993 1.00 70.97 ? 128 THR A C 1 +ATOM 953 O O . THR A 1 128 ? 44.647 -62.402 -48.582 1.00 90.79 ? 128 THR A O 1 +ATOM 954 C CB . THR A 1 128 ? 43.859 -62.231 -45.571 1.00 55.15 ? 128 THR A CB 1 +ATOM 955 O OG1 . THR A 1 128 ? 45.238 -61.866 -45.493 1.00 55.83 ? 128 THR A OG1 1 +ATOM 956 C CG2 . THR A 1 128 ? 43.748 -63.740 -45.553 1.00 46.57 ? 128 THR A CG2 1 +ATOM 957 N N . LYS A 1 129 ? 44.536 -60.156 -48.303 1.00 58.15 ? 129 LYS A N 1 +ATOM 958 C CA . LYS A 1 129 ? 45.451 -59.793 -49.377 1.00 59.68 ? 129 LYS A CA 1 +ATOM 959 C C . LYS A 1 129 ? 46.645 -59.030 -48.808 1.00 66.87 ? 129 LYS A C 1 +ATOM 960 O O . LYS A 1 129 ? 46.483 -57.945 -48.246 1.00 66.82 ? 129 LYS A O 1 +ATOM 961 C CB . LYS A 1 129 ? 44.744 -58.937 -50.437 1.00 56.92 ? 129 LYS A CB 1 +ATOM 962 N N . GLY A 1 130 ? 47.842 -59.612 -48.976 1.00 74.12 ? 130 GLY A N 1 +ATOM 963 C CA . GLY A 1 130 ? 49.110 -58.966 -48.654 1.00 74.57 ? 130 GLY A CA 1 +ATOM 964 C C . GLY A 1 130 ? 49.326 -57.679 -49.454 1.00 64.25 ? 130 GLY A C 1 +ATOM 965 O O . GLY A 1 130 ? 48.696 -57.490 -50.494 1.00 58.32 ? 130 GLY A O 1 +ATOM 966 N N . PRO A 1 131 ? 50.216 -56.758 -49.004 1.00 63.95 ? 131 PRO A N 1 +ATOM 967 C CA . PRO A 1 131 ? 50.333 -55.423 -49.605 1.00 70.89 ? 131 PRO A CA 1 +ATOM 968 C C . PRO A 1 131 ? 51.208 -55.304 -50.855 1.00 82.68 ? 131 PRO A C 1 +ATOM 969 O O . PRO A 1 131 ? 52.046 -56.165 -51.123 1.00 89.30 ? 131 PRO A O 1 +ATOM 970 C CB . PRO A 1 131 ? 50.963 -54.606 -48.468 1.00 48.69 ? 131 PRO A CB 1 +ATOM 971 C CG . PRO A 1 131 ? 51.849 -55.602 -47.755 1.00 59.19 ? 131 PRO A CG 1 +ATOM 972 C CD . PRO A 1 131 ? 51.150 -56.943 -47.882 1.00 58.81 ? 131 PRO A CD 1 +ATOM 973 N N . SER A 1 132 ? 50.977 -54.218 -51.608 1.00 77.15 ? 132 SER A N 1 +ATOM 974 C CA . SER A 1 132 ? 51.815 -53.785 -52.715 1.00 63.07 ? 132 SER A CA 1 +ATOM 975 C C . SER A 1 132 ? 52.525 -52.495 -52.314 1.00 66.48 ? 132 SER A C 1 +ATOM 976 O O . SER A 1 132 ? 51.877 -51.547 -51.876 1.00 68.66 ? 132 SER A O 1 +ATOM 977 C CB . SER A 1 132 ? 50.997 -53.581 -53.965 1.00 64.15 ? 132 SER A CB 1 +ATOM 978 O OG . SER A 1 132 ? 50.311 -54.770 -54.330 1.00 78.34 ? 132 SER A OG 1 +ATOM 979 N N . VAL A 1 133 ? 53.855 -52.471 -52.475 1.00 64.38 ? 133 VAL A N 1 +ATOM 980 C CA . VAL A 1 133 ? 54.677 -51.366 -52.003 1.00 62.68 ? 133 VAL A CA 1 +ATOM 981 C C . VAL A 1 133 ? 55.445 -50.745 -53.175 1.00 60.77 ? 133 VAL A C 1 +ATOM 982 O O . VAL A 1 133 ? 56.370 -51.346 -53.724 1.00 57.39 ? 133 VAL A O 1 +ATOM 983 C CB . VAL A 1 133 ? 55.591 -51.788 -50.829 1.00 53.91 ? 133 VAL A CB 1 +ATOM 984 C CG1 . VAL A 1 133 ? 56.521 -50.667 -50.386 1.00 54.06 ? 133 VAL A CG1 1 +ATOM 985 C CG2 . VAL A 1 133 ? 54.796 -52.294 -49.635 1.00 46.50 ? 133 VAL A CG2 1 +ATOM 986 N N . PHE A 1 134 ? 55.056 -49.510 -53.514 1.00 61.83 ? 134 PHE A N 1 +ATOM 987 C CA . PHE A 1 134 ? 55.664 -48.703 -54.562 1.00 57.40 ? 134 PHE A CA 1 +ATOM 988 C C . PHE A 1 134 ? 56.373 -47.505 -53.937 1.00 58.78 ? 134 PHE A C 1 +ATOM 989 O O . PHE A 1 134 ? 55.861 -46.934 -52.977 1.00 78.42 ? 134 PHE A O 1 +ATOM 990 C CB . PHE A 1 134 ? 54.577 -48.218 -55.522 1.00 55.69 ? 134 PHE A CB 1 +ATOM 991 C CG . PHE A 1 134 ? 53.691 -49.321 -56.037 1.00 57.54 ? 134 PHE A CG 1 +ATOM 992 C CD1 . PHE A 1 134 ? 54.150 -50.206 -57.005 1.00 63.87 ? 134 PHE A CD1 1 +ATOM 993 C CD2 . PHE A 1 134 ? 52.405 -49.483 -55.543 1.00 62.45 ? 134 PHE A CD2 1 +ATOM 994 C CE1 . PHE A 1 134 ? 53.338 -51.230 -57.470 1.00 69.49 ? 134 PHE A CE1 1 +ATOM 995 C CE2 . PHE A 1 134 ? 51.592 -50.507 -56.007 1.00 67.30 ? 134 PHE A CE2 1 +ATOM 996 C CZ . PHE A 1 134 ? 52.059 -51.375 -56.973 1.00 68.47 ? 134 PHE A CZ 1 +ATOM 997 N N . PRO A 1 135 ? 57.558 -47.081 -54.444 1.00 53.21 ? 135 PRO A N 1 +ATOM 998 C CA . PRO A 1 135 ? 58.270 -45.929 -53.884 1.00 54.76 ? 135 PRO A CA 1 +ATOM 999 C C . PRO A 1 135 ? 57.635 -44.596 -54.276 1.00 58.37 ? 135 PRO A C 1 +ATOM 1000 O O . PRO A 1 135 ? 56.919 -44.517 -55.275 1.00 57.63 ? 135 PRO A O 1 +ATOM 1001 C CB . PRO A 1 135 ? 59.676 -46.064 -54.490 1.00 60.80 ? 135 PRO A CB 1 +ATOM 1002 C CG . PRO A 1 135 ? 59.446 -46.742 -55.821 1.00 61.74 ? 135 PRO A CG 1 +ATOM 1003 C CD . PRO A 1 135 ? 58.277 -47.678 -55.582 1.00 68.76 ? 135 PRO A CD 1 +ATOM 1004 N N . LEU A 1 136 ? 57.897 -43.561 -53.465 1.00 63.28 ? 136 LEU A N 1 +ATOM 1005 C CA . LEU A 1 136 ? 57.454 -42.201 -53.737 1.00 67.91 ? 136 LEU A CA 1 +ATOM 1006 C C . LEU A 1 136 ? 58.678 -41.300 -53.852 1.00 71.32 ? 136 LEU A C 1 +ATOM 1007 O O . LEU A 1 136 ? 59.282 -40.953 -52.838 1.00 85.40 ? 136 LEU A O 1 +ATOM 1008 C CB . LEU A 1 136 ? 56.514 -41.721 -52.624 1.00 60.86 ? 136 LEU A CB 1 +ATOM 1009 C CG . LEU A 1 136 ? 55.128 -42.370 -52.588 1.00 70.51 ? 136 LEU A CG 1 +ATOM 1010 C CD1 . LEU A 1 136 ? 54.375 -41.975 -51.322 1.00 45.00 ? 136 LEU A CD1 1 +ATOM 1011 C CD2 . LEU A 1 136 ? 54.316 -42.028 -53.838 1.00 73.17 ? 136 LEU A CD2 1 +ATOM 1012 N N . ALA A 1 137 ? 59.015 -40.931 -55.098 1.00 81.10 ? 137 ALA A N 1 +ATOM 1013 C CA . ALA A 1 137 ? 60.216 -40.171 -55.428 1.00 76.81 ? 137 ALA A CA 1 +ATOM 1014 C C . ALA A 1 137 ? 59.867 -38.939 -56.267 1.00 68.54 ? 137 ALA A C 1 +ATOM 1015 O O . ALA A 1 137 ? 59.023 -39.022 -57.160 1.00 68.98 ? 137 ALA A O 1 +ATOM 1016 C CB . ALA A 1 137 ? 61.196 -41.066 -56.147 1.00 68.26 ? 137 ALA A CB 1 +ATOM 1017 N N . PRO A 1 138 ? 60.498 -37.761 -56.025 1.00 79.41 ? 138 PRO A N 1 +ATOM 1018 C CA . PRO A 1 138 ? 60.227 -36.568 -56.833 1.00 77.45 ? 138 PRO A CA 1 +ATOM 1019 C C . PRO A 1 138 ? 60.665 -36.753 -58.283 1.00 86.34 ? 138 PRO A C 1 +ATOM 1020 O O . PRO A 1 138 ? 61.521 -37.595 -58.566 1.00 59.97 ? 138 PRO A O 1 +ATOM 1021 C CB . PRO A 1 138 ? 61.030 -35.436 -56.172 1.00 65.29 ? 138 PRO A CB 1 +ATOM 1022 C CG . PRO A 1 138 ? 62.068 -36.140 -55.306 1.00 73.75 ? 138 PRO A CG 1 +ATOM 1023 C CD . PRO A 1 138 ? 61.494 -37.504 -54.968 1.00 76.72 ? 138 PRO A CD 1 +ATOM 1024 N N . CYS A 1 139 ? 60.027 -35.975 -59.172 1.00 101.06 ? 139 CYS A N 1 +ATOM 1025 C CA . CYS A 1 139 ? 60.338 -35.875 -60.590 1.00 88.87 ? 139 CYS A CA 1 +ATOM 1026 C C . CYS A 1 139 ? 61.417 -34.805 -60.774 1.00 108.81 ? 139 CYS A C 1 +ATOM 1027 O O . CYS A 1 139 ? 61.162 -33.619 -60.563 1.00 115.96 ? 139 CYS A O 1 +ATOM 1028 C CB . CYS A 1 139 ? 59.079 -35.494 -61.362 1.00 98.03 ? 139 CYS A CB 1 +ATOM 1029 S SG . CYS A 1 139 ? 59.000 -36.161 -63.045 1.00 99.12 ? 139 CYS A SG 1 +ATOM 1030 N N . SER A 1 140 ? 62.615 -35.246 -61.189 1.00 122.88 ? 140 SER A N 1 +ATOM 1031 C CA . SER A 1 140 ? 63.860 -34.511 -61.005 1.00 118.87 ? 140 SER A CA 1 +ATOM 1032 C C . SER A 1 140 ? 64.118 -33.529 -62.148 1.00 108.15 ? 140 SER A C 1 +ATOM 1033 O O . SER A 1 140 ? 64.070 -33.900 -63.320 1.00 99.08 ? 140 SER A O 1 +ATOM 1034 C CB . SER A 1 140 ? 65.020 -35.467 -60.818 1.00 106.41 ? 140 SER A CB 1 +ATOM 1035 O OG . SER A 1 140 ? 66.003 -34.926 -59.945 1.00 81.53 ? 140 SER A OG 1 +ATOM 1036 N N . ARG A 1 141 ? 64.385 -32.271 -61.771 1.00 113.00 ? 141 ARG A N 1 +ATOM 1037 C CA . ARG A 1 141 ? 64.935 -31.246 -62.647 1.00 114.08 ? 141 ARG A CA 1 +ATOM 1038 C C . ARG A 1 141 ? 66.022 -30.482 -61.885 1.00 116.08 ? 141 ARG A C 1 +ATOM 1039 O O . ARG A 1 141 ? 66.215 -29.282 -62.097 1.00 86.42 ? 141 ARG A O 1 +ATOM 1040 C CB . ARG A 1 141 ? 63.823 -30.348 -63.204 1.00 90.61 ? 141 ARG A CB 1 +ATOM 1041 N N . SER A 1 142 ? 66.710 -31.218 -60.993 1.00 126.42 ? 142 SER A N 1 +ATOM 1042 C CA . SER A 1 142 ? 67.842 -30.794 -60.176 1.00 119.96 ? 142 SER A CA 1 +ATOM 1043 C C . SER A 1 142 ? 67.533 -29.514 -59.388 1.00 95.06 ? 142 SER A C 1 +ATOM 1044 O O . SER A 1 142 ? 67.741 -29.456 -58.176 1.00 71.27 ? 142 SER A O 1 +ATOM 1045 C CB . SER A 1 142 ? 69.109 -30.673 -60.986 1.00 120.64 ? 142 SER A CB 1 +ATOM 1046 N N . GLU A 1 145 ? 66.545 -28.902 -54.532 1.00 61.71 ? 145 GLU A N 1 +ATOM 1047 C CA . GLU A 1 145 ? 65.919 -28.265 -53.373 1.00 61.30 ? 145 GLU A CA 1 +ATOM 1048 C C . GLU A 1 145 ? 66.676 -28.645 -52.104 1.00 59.82 ? 145 GLU A C 1 +ATOM 1049 O O . GLU A 1 145 ? 67.188 -29.755 -52.018 1.00 73.87 ? 145 GLU A O 1 +ATOM 1050 C CB . GLU A 1 145 ? 64.453 -28.682 -53.286 1.00 74.35 ? 145 GLU A CB 1 +ATOM 1051 C CG . GLU A 1 145 ? 63.573 -27.618 -52.654 1.00 85.42 ? 145 GLU A CG 1 +ATOM 1052 C CD . GLU A 1 145 ? 62.208 -27.471 -53.303 1.00 103.71 ? 145 GLU A CD 1 +ATOM 1053 O OE1 . GLU A 1 145 ? 61.754 -26.314 -53.451 1.00 90.53 ? 145 GLU A OE1 1 +ATOM 1054 O OE2 . GLU A 1 145 ? 61.602 -28.513 -53.664 1.00 101.96 ? 145 GLU A OE2 1 +ATOM 1055 N N . SER A 1 146 ? 66.719 -27.725 -51.125 1.00 73.58 ? 146 SER A N 1 +ATOM 1056 C CA . SER A 1 146 ? 67.524 -27.880 -49.918 1.00 66.02 ? 146 SER A CA 1 +ATOM 1057 C C . SER A 1 146 ? 67.132 -29.145 -49.155 1.00 90.41 ? 146 SER A C 1 +ATOM 1058 O O . SER A 1 146 ? 68.007 -29.891 -48.717 1.00 83.81 ? 146 SER A O 1 +ATOM 1059 C CB . SER A 1 146 ? 67.446 -26.669 -49.027 1.00 41.76 ? 146 SER A CB 1 +ATOM 1060 N N . THR A 1 147 ? 65.816 -29.368 -49.007 1.00 91.78 ? 147 THR A N 1 +ATOM 1061 C CA . THR A 1 147 ? 65.284 -30.524 -48.297 1.00 82.03 ? 147 THR A CA 1 +ATOM 1062 C C . THR A 1 147 ? 64.387 -31.350 -49.218 1.00 84.70 ? 147 THR A C 1 +ATOM 1063 O O . THR A 1 147 ? 63.409 -30.847 -49.778 1.00 76.69 ? 147 THR A O 1 +ATOM 1064 C CB . THR A 1 147 ? 64.631 -30.147 -46.957 1.00 77.91 ? 147 THR A CB 1 +ATOM 1065 O OG1 . THR A 1 147 ? 64.038 -28.850 -47.046 1.00 88.87 ? 147 THR A OG1 1 +ATOM 1066 C CG2 . THR A 1 147 ? 65.606 -30.174 -45.800 1.00 73.34 ? 147 THR A CG2 1 +ATOM 1067 N N . ALA A 1 148 ? 64.748 -32.632 -49.349 1.00 77.73 ? 148 ALA A N 1 +ATOM 1068 C CA . ALA A 1 148 ? 64.078 -33.578 -50.228 1.00 81.85 ? 148 ALA A CA 1 +ATOM 1069 C C . ALA A 1 148 ? 62.991 -34.324 -49.459 1.00 89.82 ? 148 ALA A C 1 +ATOM 1070 O O . ALA A 1 148 ? 63.062 -34.438 -48.236 1.00 83.68 ? 148 ALA A O 1 +ATOM 1071 C CB . ALA A 1 148 ? 65.098 -34.534 -50.796 1.00 78.77 ? 148 ALA A CB 1 +ATOM 1072 N N . ALA A 1 149 ? 62.001 -34.843 -50.197 1.00 82.85 ? 149 ALA A N 1 +ATOM 1073 C CA . ALA A 1 149 ? 60.905 -35.594 -49.607 1.00 75.24 ? 149 ALA A CA 1 +ATOM 1074 C C . ALA A 1 149 ? 60.757 -36.945 -50.302 1.00 71.31 ? 149 ALA A C 1 +ATOM 1075 O O . ALA A 1 149 ? 60.318 -37.005 -51.450 1.00 82.66 ? 149 ALA A O 1 +ATOM 1076 C CB . ALA A 1 149 ? 59.634 -34.782 -49.680 1.00 89.60 ? 149 ALA A CB 1 +ATOM 1077 N N . LEU A 1 150 ? 61.131 -38.015 -49.583 1.00 69.03 ? 150 LEU A N 1 +ATOM 1078 C CA . LEU A 1 150 ? 61.004 -39.394 -50.041 1.00 67.38 ? 150 LEU A CA 1 +ATOM 1079 C C . LEU A 1 150 ? 59.848 -40.085 -49.323 1.00 68.19 ? 150 LEU A C 1 +ATOM 1080 O O . LEU A 1 150 ? 59.289 -39.544 -48.370 1.00 82.13 ? 150 LEU A O 1 +ATOM 1081 C CB . LEU A 1 150 ? 62.309 -40.140 -49.746 1.00 70.26 ? 150 LEU A CB 1 +ATOM 1082 C CG . LEU A 1 150 ? 63.499 -39.798 -50.636 1.00 73.26 ? 150 LEU A CG 1 +ATOM 1083 C CD1 . LEU A 1 150 ? 64.802 -40.170 -49.948 1.00 60.07 ? 150 LEU A CD1 1 +ATOM 1084 C CD2 . LEU A 1 150 ? 63.391 -40.485 -51.990 1.00 96.13 ? 150 LEU A CD2 1 +ATOM 1085 N N . GLY A 1 151 ? 59.520 -41.299 -49.782 1.00 64.63 ? 151 GLY A N 1 +ATOM 1086 C CA . GLY A 1 151 ? 58.520 -42.128 -49.127 1.00 70.26 ? 151 GLY A CA 1 +ATOM 1087 C C . GLY A 1 151 ? 58.220 -43.416 -49.889 1.00 69.98 ? 151 GLY A C 1 +ATOM 1088 O O . GLY A 1 151 ? 58.831 -43.677 -50.925 1.00 77.87 ? 151 GLY A O 1 +ATOM 1089 N N . CYS A 1 152 ? 57.299 -44.218 -49.324 1.00 60.39 ? 152 CYS A N 1 +ATOM 1090 C CA A CYS A 1 152 ? 56.758 -45.439 -49.914 0.50 55.76 ? 152 CYS A CA 1 +ATOM 1091 C CA B CYS A 1 152 ? 56.736 -45.337 -50.056 0.50 57.26 ? 152 CYS A CA 1 +ATOM 1092 C C . CYS A 1 152 ? 55.226 -45.376 -49.860 1.00 49.90 ? 152 CYS A C 1 +ATOM 1093 O O . CYS A 1 152 ? 54.682 -44.957 -48.843 1.00 68.72 ? 152 CYS A O 1 +ATOM 1094 C CB A CYS A 1 152 ? 57.228 -46.678 -49.145 0.50 56.32 ? 152 CYS A CB 1 +ATOM 1095 C CB B CYS A 1 152 ? 57.402 -46.661 -49.706 0.50 58.95 ? 152 CYS A CB 1 +ATOM 1096 S SG A CYS A 1 152 ? 59.029 -46.863 -48.978 0.50 57.14 ? 152 CYS A SG 1 +ATOM 1097 S SG B CYS A 1 152 ? 56.826 -47.395 -48.152 0.50 63.47 ? 152 CYS A SG 1 +ATOM 1098 N N . LEU A 1 153 ? 54.544 -45.820 -50.916 1.00 45.40 ? 153 LEU A N 1 +ATOM 1099 C CA . LEU A 1 153 ? 53.097 -45.942 -50.913 1.00 44.86 ? 153 LEU A CA 1 +ATOM 1100 C C . LEU A 1 153 ? 52.756 -47.424 -50.807 1.00 55.70 ? 153 LEU A C 1 +ATOM 1101 O O . LEU A 1 153 ? 53.374 -48.246 -51.480 1.00 53.85 ? 153 LEU A O 1 +ATOM 1102 C CB . LEU A 1 153 ? 52.530 -45.330 -52.196 1.00 41.54 ? 153 LEU A CB 1 +ATOM 1103 C CG . LEU A 1 153 ? 51.126 -45.783 -52.598 1.00 60.12 ? 153 LEU A CG 1 +ATOM 1104 C CD1 . LEU A 1 153 ? 50.060 -45.032 -51.813 1.00 74.14 ? 153 LEU A CD1 1 +ATOM 1105 C CD2 . LEU A 1 153 ? 50.908 -45.606 -54.092 1.00 71.88 ? 153 LEU A CD2 1 +ATOM 1106 N N . VAL A 1 154 ? 51.771 -47.731 -49.950 1.00 63.96 ? 154 VAL A N 1 +ATOM 1107 C CA . VAL A 1 154 ? 51.388 -49.087 -49.588 1.00 53.68 ? 154 VAL A CA 1 +ATOM 1108 C C . VAL A 1 154 ? 49.913 -49.277 -49.921 1.00 52.78 ? 154 VAL A C 1 +ATOM 1109 O O . VAL A 1 154 ? 49.034 -48.831 -49.183 1.00 64.81 ? 154 VAL A O 1 +ATOM 1110 C CB . VAL A 1 154 ? 51.694 -49.396 -48.108 1.00 55.75 ? 154 VAL A CB 1 +ATOM 1111 C CG1 . VAL A 1 154 ? 51.311 -50.822 -47.725 1.00 66.65 ? 154 VAL A CG1 1 +ATOM 1112 C CG2 . VAL A 1 154 ? 53.152 -49.127 -47.762 1.00 53.16 ? 154 VAL A CG2 1 +ATOM 1113 N N . LYS A 1 155 ? 49.671 -49.965 -51.041 1.00 62.54 ? 155 LYS A N 1 +ATOM 1114 C CA . LYS A 1 155 ? 48.360 -50.009 -51.663 1.00 80.77 ? 155 LYS A CA 1 +ATOM 1115 C C . LYS A 1 155 ? 47.881 -51.454 -51.736 1.00 78.01 ? 155 LYS A C 1 +ATOM 1116 O O . LYS A 1 155 ? 48.689 -52.376 -51.856 1.00 78.45 ? 155 LYS A O 1 +ATOM 1117 C CB . LYS A 1 155 ? 48.399 -49.331 -53.037 1.00 64.30 ? 155 LYS A CB 1 +ATOM 1118 C CG . LYS A 1 155 ? 47.043 -48.970 -53.631 1.00 74.30 ? 155 LYS A CG 1 +ATOM 1119 C CD . LYS A 1 155 ? 47.142 -48.322 -55.002 1.00 73.47 ? 155 LYS A CD 1 +ATOM 1120 C CE . LYS A 1 155 ? 46.130 -48.848 -55.999 1.00 59.97 ? 155 LYS A CE 1 +ATOM 1121 N NZ . LYS A 1 155 ? 44.757 -48.357 -55.735 1.00 65.05 ? 155 LYS A NZ 1 +ATOM 1122 N N . ASP A 1 156 ? 46.556 -51.607 -51.623 1.00 65.80 ? 156 ASP A N 1 +ATOM 1123 C CA . ASP A 1 156 ? 45.825 -52.848 -51.821 1.00 79.88 ? 156 ASP A CA 1 +ATOM 1124 C C . ASP A 1 156 ? 46.268 -53.912 -50.816 1.00 81.14 ? 156 ASP A C 1 +ATOM 1125 O O . ASP A 1 156 ? 47.037 -54.817 -51.139 1.00 103.48 ? 156 ASP A O 1 +ATOM 1126 C CB . ASP A 1 156 ? 45.790 -53.218 -53.305 1.00 71.44 ? 156 ASP A CB 1 +ATOM 1127 C CG . ASP A 1 156 ? 45.227 -52.088 -54.151 1.00 95.22 ? 156 ASP A CG 1 +ATOM 1128 O OD1 . ASP A 1 156 ? 44.473 -51.256 -53.597 1.00 97.54 ? 156 ASP A OD1 1 +ATOM 1129 O OD2 . ASP A 1 156 ? 45.551 -52.040 -55.350 1.00 124.06 ? 156 ASP A OD2 1 +ATOM 1130 N N . TYR A 1 157 ? 45.767 -53.770 -49.585 1.00 62.25 ? 157 TYR A N 1 +ATOM 1131 C CA . TYR A 1 157 ? 45.999 -54.746 -48.534 1.00 64.17 ? 157 TYR A CA 1 +ATOM 1132 C C . TYR A 1 157 ? 44.716 -54.973 -47.728 1.00 61.91 ? 157 TYR A C 1 +ATOM 1133 O O . TYR A 1 157 ? 43.841 -54.105 -47.674 1.00 47.98 ? 157 TYR A O 1 +ATOM 1134 C CB . TYR A 1 157 ? 47.256 -54.387 -47.731 1.00 66.51 ? 157 TYR A CB 1 +ATOM 1135 C CG . TYR A 1 157 ? 47.107 -53.315 -46.678 1.00 64.11 ? 157 TYR A CG 1 +ATOM 1136 C CD1 . TYR A 1 157 ? 46.717 -53.637 -45.386 1.00 64.28 ? 157 TYR A CD1 1 +ATOM 1137 C CD2 . TYR A 1 157 ? 47.388 -51.983 -46.954 1.00 66.11 ? 157 TYR A CD2 1 +ATOM 1138 C CE1 . TYR A 1 157 ? 46.582 -52.669 -44.404 1.00 64.15 ? 157 TYR A CE1 1 +ATOM 1139 C CE2 . TYR A 1 157 ? 47.260 -50.999 -45.982 1.00 68.23 ? 157 TYR A CE2 1 +ATOM 1140 C CZ . TYR A 1 157 ? 46.861 -51.344 -44.698 1.00 70.93 ? 157 TYR A CZ 1 +ATOM 1141 O OH . TYR A 1 157 ? 46.731 -50.401 -43.717 1.00 53.55 ? 157 TYR A OH 1 +ATOM 1142 N N . PHE A 1 158 ? 44.605 -56.177 -47.144 1.00 54.39 ? 158 PHE A N 1 +ATOM 1143 C CA . PHE A 1 158 ? 43.528 -56.528 -46.230 1.00 67.06 ? 158 PHE A CA 1 +ATOM 1144 C C . PHE A 1 158 ? 43.961 -57.680 -45.318 1.00 73.34 ? 158 PHE A C 1 +ATOM 1145 O O . PHE A 1 158 ? 44.622 -58.608 -45.776 1.00 76.63 ? 158 PHE A O 1 +ATOM 1146 C CB . PHE A 1 158 ? 42.239 -56.847 -46.995 1.00 65.05 ? 158 PHE A CB 1 +ATOM 1147 C CG . PHE A 1 158 ? 41.022 -56.926 -46.110 1.00 78.07 ? 158 PHE A CG 1 +ATOM 1148 C CD1 . PHE A 1 158 ? 40.354 -55.772 -45.720 1.00 86.11 ? 158 PHE A CD1 1 +ATOM 1149 C CD2 . PHE A 1 158 ? 40.573 -58.149 -45.629 1.00 75.68 ? 158 PHE A CD2 1 +ATOM 1150 C CE1 . PHE A 1 158 ? 39.248 -55.839 -44.884 1.00 79.75 ? 158 PHE A CE1 1 +ATOM 1151 C CE2 . PHE A 1 158 ? 39.466 -58.216 -44.796 1.00 95.65 ? 158 PHE A CE2 1 +ATOM 1152 C CZ . PHE A 1 158 ? 38.805 -57.062 -44.427 1.00 96.99 ? 158 PHE A CZ 1 +ATOM 1153 N N . PRO A 1 159 ? 43.605 -57.624 -44.023 1.00 73.35 ? 159 PRO A N 1 +ATOM 1154 C CA . PRO A 1 159 ? 42.950 -56.501 -43.368 1.00 62.05 ? 159 PRO A CA 1 +ATOM 1155 C C . PRO A 1 159 ? 43.997 -55.534 -42.825 1.00 70.46 ? 159 PRO A C 1 +ATOM 1156 O O . PRO A 1 159 ? 45.110 -55.483 -43.343 1.00 98.61 ? 159 PRO A O 1 +ATOM 1157 C CB . PRO A 1 159 ? 42.216 -57.203 -42.221 1.00 74.33 ? 159 PRO A CB 1 +ATOM 1158 C CG . PRO A 1 159 ? 43.223 -58.221 -41.748 1.00 76.12 ? 159 PRO A CG 1 +ATOM 1159 C CD . PRO A 1 159 ? 43.859 -58.693 -43.039 1.00 75.63 ? 159 PRO A CD 1 +ATOM 1160 N N . GLU A 1 160 ? 43.628 -54.781 -41.782 1.00 60.58 ? 160 GLU A N 1 +ATOM 1161 C CA . GLU A 1 160 ? 44.571 -53.986 -41.012 1.00 52.46 ? 160 GLU A CA 1 +ATOM 1162 C C . GLU A 1 160 ? 45.117 -54.834 -39.866 1.00 54.33 ? 160 GLU A C 1 +ATOM 1163 O O . GLU A 1 160 ? 44.417 -55.734 -39.403 1.00 87.18 ? 160 GLU A O 1 +ATOM 1164 C CB . GLU A 1 160 ? 43.889 -52.710 -40.526 1.00 72.31 ? 160 GLU A CB 1 +ATOM 1165 C CG . GLU A 1 160 ? 44.289 -51.497 -41.352 1.00 75.81 ? 160 GLU A CG 1 +ATOM 1166 C CD . GLU A 1 160 ? 43.703 -50.201 -40.834 1.00 86.35 ? 160 GLU A CD 1 +ATOM 1167 O OE1 . GLU A 1 160 ? 42.462 -50.093 -40.795 1.00 76.73 ? 160 GLU A OE1 1 +ATOM 1168 O OE2 . GLU A 1 160 ? 44.494 -49.312 -40.465 1.00 120.08 ? 160 GLU A OE2 1 +ATOM 1169 N N . PRO A 1 161 ? 46.348 -54.554 -39.397 1.00 56.06 ? 161 PRO A N 1 +ATOM 1170 C CA . PRO A 1 161 ? 47.138 -53.361 -39.684 1.00 63.86 ? 161 PRO A CA 1 +ATOM 1171 C C . PRO A 1 161 ? 48.419 -53.538 -40.508 1.00 70.16 ? 161 PRO A C 1 +ATOM 1172 O O . PRO A 1 161 ? 48.805 -54.658 -40.841 1.00 52.53 ? 161 PRO A O 1 +ATOM 1173 C CB . PRO A 1 161 ? 47.534 -52.956 -38.255 1.00 54.43 ? 161 PRO A CB 1 +ATOM 1174 C CG . PRO A 1 161 ? 47.874 -54.277 -37.588 1.00 56.22 ? 161 PRO A CG 1 +ATOM 1175 C CD . PRO A 1 161 ? 46.996 -55.294 -38.295 1.00 50.37 ? 161 PRO A CD 1 +ATOM 1176 N N . VAL A 1 162 ? 49.072 -52.405 -40.812 1.00 72.18 ? 162 VAL A N 1 +ATOM 1177 C CA . VAL A 1 162 ? 50.425 -52.363 -41.350 1.00 64.55 ? 162 VAL A CA 1 +ATOM 1178 C C . VAL A 1 162 ? 51.292 -51.477 -40.450 1.00 63.30 ? 162 VAL A C 1 +ATOM 1179 O O . VAL A 1 162 ? 50.821 -50.453 -39.970 1.00 71.37 ? 162 VAL A O 1 +ATOM 1180 C CB . VAL A 1 162 ? 50.428 -51.930 -42.833 1.00 48.05 ? 162 VAL A CB 1 +ATOM 1181 C CG1 . VAL A 1 162 ? 51.552 -50.969 -43.179 1.00 44.51 ? 162 VAL A CG1 1 +ATOM 1182 C CG2 . VAL A 1 162 ? 50.480 -53.135 -43.755 1.00 36.20 ? 162 VAL A CG2 1 +ATOM 1183 N N . THR A 1 163 ? 52.546 -51.890 -40.211 1.00 57.35 ? 163 THR A N 1 +ATOM 1184 C CA . THR A 1 163 ? 53.513 -51.107 -39.456 1.00 55.46 ? 163 THR A CA 1 +ATOM 1185 C C . THR A 1 163 ? 54.676 -50.730 -40.369 1.00 59.49 ? 163 THR A C 1 +ATOM 1186 O O . THR A 1 163 ? 55.280 -51.602 -40.990 1.00 82.77 ? 163 THR A O 1 +ATOM 1187 C CB . THR A 1 163 ? 54.039 -51.868 -38.229 1.00 78.71 ? 163 THR A CB 1 +ATOM 1188 O OG1 . THR A 1 163 ? 54.975 -52.853 -38.666 1.00 89.11 ? 163 THR A OG1 1 +ATOM 1189 C CG2 . THR A 1 163 ? 52.958 -52.517 -37.389 1.00 72.81 ? 163 THR A CG2 1 +ATOM 1190 N N . VAL A 1 164 ? 54.995 -49.429 -40.427 1.00 72.69 ? 164 VAL A N 1 +ATOM 1191 C CA . VAL A 1 164 ? 56.007 -48.907 -41.339 1.00 56.35 ? 164 VAL A CA 1 +ATOM 1192 C C . VAL A 1 164 ? 57.180 -48.346 -40.542 1.00 48.22 ? 164 VAL A C 1 +ATOM 1193 O O . VAL A 1 164 ? 56.990 -47.701 -39.513 1.00 75.24 ? 164 VAL A O 1 +ATOM 1194 C CB . VAL A 1 164 ? 55.448 -47.873 -42.342 1.00 57.68 ? 164 VAL A CB 1 +ATOM 1195 C CG1 . VAL A 1 164 ? 56.531 -47.321 -43.256 1.00 53.32 ? 164 VAL A CG1 1 +ATOM 1196 C CG2 . VAL A 1 164 ? 54.322 -48.444 -43.191 1.00 67.87 ? 164 VAL A CG2 1 +ATOM 1197 N N . SER A 1 165 ? 58.384 -48.592 -41.068 1.00 49.97 ? 165 SER A N 1 +ATOM 1198 C CA . SER A 1 165 ? 59.660 -48.249 -40.462 1.00 51.23 ? 165 SER A CA 1 +ATOM 1199 C C . SER A 1 165 ? 60.596 -47.685 -41.537 1.00 57.61 ? 165 SER A C 1 +ATOM 1200 O O . SER A 1 165 ? 60.325 -47.815 -42.729 1.00 64.83 ? 165 SER A O 1 +ATOM 1201 C CB . SER A 1 165 ? 60.214 -49.481 -39.778 1.00 57.65 ? 165 SER A CB 1 +ATOM 1202 O OG . SER A 1 165 ? 61.630 -49.483 -39.725 1.00 54.05 ? 165 SER A OG 1 +ATOM 1203 N N . TRP A 1 166 ? 61.693 -47.046 -41.111 1.00 59.51 ? 166 TRP A N 1 +ATOM 1204 C CA . TRP A 1 166 ? 62.648 -46.442 -42.029 1.00 45.83 ? 166 TRP A CA 1 +ATOM 1205 C C . TRP A 1 166 ? 64.076 -46.755 -41.595 1.00 54.17 ? 166 TRP A C 1 +ATOM 1206 O O . TRP A 1 166 ? 64.484 -46.417 -40.481 1.00 81.38 ? 166 TRP A O 1 +ATOM 1207 C CB . TRP A 1 166 ? 62.417 -44.930 -42.159 1.00 49.44 ? 166 TRP A CB 1 +ATOM 1208 C CG . TRP A 1 166 ? 61.277 -44.582 -43.067 1.00 52.48 ? 166 TRP A CG 1 +ATOM 1209 C CD1 . TRP A 1 166 ? 59.990 -44.301 -42.711 1.00 52.92 ? 166 TRP A CD1 1 +ATOM 1210 C CD2 . TRP A 1 166 ? 61.322 -44.501 -44.500 1.00 52.09 ? 166 TRP A CD2 1 +ATOM 1211 N NE1 . TRP A 1 166 ? 59.230 -44.047 -43.821 1.00 52.80 ? 166 TRP A NE1 1 +ATOM 1212 C CE2 . TRP A 1 166 ? 60.018 -44.166 -44.934 1.00 55.94 ? 166 TRP A CE2 1 +ATOM 1213 C CE3 . TRP A 1 166 ? 62.333 -44.677 -45.455 1.00 50.11 ? 166 TRP A CE3 1 +ATOM 1214 C CZ2 . TRP A 1 166 ? 59.701 -44.006 -46.283 1.00 57.67 ? 166 TRP A CZ2 1 +ATOM 1215 C CZ3 . TRP A 1 166 ? 62.019 -44.514 -46.787 1.00 60.72 ? 166 TRP A CZ3 1 +ATOM 1216 C CH2 . TRP A 1 166 ? 60.722 -44.182 -47.192 1.00 57.82 ? 166 TRP A CH2 1 +ATOM 1217 N N . ASN A 1 167 ? 64.821 -47.383 -42.515 1.00 51.46 ? 167 ASN A N 1 +ATOM 1218 C CA . ASN A 1 167 ? 66.194 -47.815 -42.305 1.00 58.61 ? 167 ASN A CA 1 +ATOM 1219 C C . ASN A 1 167 ? 66.262 -48.670 -41.037 1.00 64.11 ? 167 ASN A C 1 +ATOM 1220 O O . ASN A 1 167 ? 67.001 -48.369 -40.100 1.00 57.26 ? 167 ASN A O 1 +ATOM 1221 C CB . ASN A 1 167 ? 67.187 -46.652 -42.454 1.00 50.02 ? 167 ASN A CB 1 +ATOM 1222 C CG . ASN A 1 167 ? 67.371 -46.221 -43.897 1.00 61.31 ? 167 ASN A CG 1 +ATOM 1223 O OD1 . ASN A 1 167 ? 67.164 -47.016 -44.810 1.00 53.59 ? 167 ASN A OD1 1 +ATOM 1224 N ND2 . ASN A 1 167 ? 67.763 -44.973 -44.121 1.00 51.60 ? 167 ASN A ND2 1 +ATOM 1225 N N . SER A 1 168 ? 65.426 -49.718 -41.009 1.00 62.30 ? 168 SER A N 1 +ATOM 1226 C CA . SER A 1 168 ? 65.415 -50.726 -39.958 1.00 72.03 ? 168 SER A CA 1 +ATOM 1227 C C . SER A 1 168 ? 65.428 -50.069 -38.577 1.00 70.83 ? 168 SER A C 1 +ATOM 1228 O O . SER A 1 168 ? 66.093 -50.544 -37.659 1.00 62.71 ? 168 SER A O 1 +ATOM 1229 C CB . SER A 1 168 ? 66.544 -51.715 -40.148 1.00 84.71 ? 168 SER A CB 1 +ATOM 1230 O OG . SER A 1 168 ? 66.669 -52.073 -41.520 1.00 90.36 ? 168 SER A OG 1 +ATOM 1231 N N . GLY A 1 169 ? 64.695 -48.952 -38.470 1.00 71.60 ? 169 GLY A N 1 +ATOM 1232 C CA . GLY A 1 169 ? 64.486 -48.233 -37.227 1.00 54.96 ? 169 GLY A CA 1 +ATOM 1233 C C . GLY A 1 169 ? 65.469 -47.082 -37.019 1.00 68.48 ? 169 GLY A C 1 +ATOM 1234 O O . GLY A 1 169 ? 65.280 -46.293 -36.095 1.00 84.87 ? 169 GLY A O 1 +ATOM 1235 N N . ALA A 1 170 ? 66.502 -46.980 -37.870 1.00 53.99 ? 170 ALA A N 1 +ATOM 1236 C CA . ALA A 1 170 ? 67.602 -46.063 -37.596 1.00 69.45 ? 170 ALA A CA 1 +ATOM 1237 C C . ALA A 1 170 ? 67.236 -44.609 -37.905 1.00 84.55 ? 170 ALA A C 1 +ATOM 1238 O O . ALA A 1 170 ? 67.872 -43.702 -37.368 1.00 107.73 ? 170 ALA A O 1 +ATOM 1239 C CB . ALA A 1 170 ? 68.880 -46.499 -38.276 1.00 57.92 ? 170 ALA A CB 1 +ATOM 1240 N N . LEU A 1 171 ? 66.209 -44.389 -38.743 1.00 68.41 ? 171 LEU A N 1 +ATOM 1241 C CA . LEU A 1 171 ? 65.770 -43.041 -39.083 1.00 55.56 ? 171 LEU A CA 1 +ATOM 1242 C C . LEU A 1 171 ? 64.349 -42.810 -38.579 1.00 68.39 ? 171 LEU A C 1 +ATOM 1243 O O . LEU A 1 171 ? 63.416 -43.456 -39.056 1.00 72.27 ? 171 LEU A O 1 +ATOM 1244 C CB . LEU A 1 171 ? 65.859 -42.830 -40.599 1.00 51.82 ? 171 LEU A CB 1 +ATOM 1245 C CG . LEU A 1 171 ? 65.245 -41.536 -41.145 1.00 55.21 ? 171 LEU A CG 1 +ATOM 1246 C CD1 . LEU A 1 171 ? 66.000 -40.303 -40.671 1.00 63.87 ? 171 LEU A CD1 1 +ATOM 1247 C CD2 . LEU A 1 171 ? 65.200 -41.552 -42.662 1.00 61.97 ? 171 LEU A CD2 1 +ATOM 1248 N N . THR A 1 172 ? 64.208 -41.845 -37.653 1.00 73.79 ? 172 THR A N 1 +ATOM 1249 C CA . THR A 1 172 ? 62.938 -41.506 -37.022 1.00 68.89 ? 172 THR A CA 1 +ATOM 1250 C C . THR A 1 172 ? 62.480 -40.101 -37.413 1.00 67.74 ? 172 THR A C 1 +ATOM 1251 O O . THR A 1 172 ? 61.298 -39.903 -37.670 1.00 73.88 ? 172 THR A O 1 +ATOM 1252 C CB . THR A 1 172 ? 63.000 -41.655 -35.497 1.00 78.73 ? 172 THR A CB 1 +ATOM 1253 O OG1 . THR A 1 172 ? 64.131 -40.908 -35.047 1.00 91.51 ? 172 THR A OG1 1 +ATOM 1254 C CG2 . THR A 1 172 ? 63.098 -43.094 -35.036 1.00 63.76 ? 172 THR A CG2 1 +ATOM 1255 N N . SER A 1 173 ? 63.417 -39.143 -37.460 1.00 76.55 ? 173 SER A N 1 +ATOM 1256 C CA . SER A 1 173 ? 63.136 -37.738 -37.739 1.00 79.45 ? 173 SER A CA 1 +ATOM 1257 C C . SER A 1 173 ? 62.445 -37.553 -39.089 1.00 75.75 ? 173 SER A C 1 +ATOM 1258 O O . SER A 1 173 ? 62.830 -38.172 -40.077 1.00 102.66 ? 173 SER A O 1 +ATOM 1259 C CB . SER A 1 173 ? 64.398 -36.921 -37.678 1.00 76.67 ? 173 SER A CB 1 +ATOM 1260 O OG . SER A 1 173 ? 64.684 -36.559 -36.338 1.00 90.78 ? 173 SER A OG 1 +ATOM 1261 N N . GLY A 1 174 ? 61.427 -36.685 -39.112 1.00 72.06 ? 174 GLY A N 1 +ATOM 1262 C CA . GLY A 1 174 ? 60.749 -36.288 -40.338 1.00 85.82 ? 174 GLY A CA 1 +ATOM 1263 C C . GLY A 1 174 ? 59.780 -37.332 -40.902 1.00 91.80 ? 174 GLY A C 1 +ATOM 1264 O O . GLY A 1 174 ? 59.164 -37.093 -41.941 1.00 60.04 ? 174 GLY A O 1 +ATOM 1265 N N . VAL A 1 175 ? 59.630 -38.481 -40.223 1.00 80.07 ? 175 VAL A N 1 +ATOM 1266 C CA . VAL A 1 175 ? 58.751 -39.538 -40.705 1.00 66.51 ? 175 VAL A CA 1 +ATOM 1267 C C . VAL A 1 175 ? 57.305 -39.163 -40.394 1.00 74.30 ? 175 VAL A C 1 +ATOM 1268 O O . VAL A 1 175 ? 56.973 -38.833 -39.255 1.00 74.47 ? 175 VAL A O 1 +ATOM 1269 C CB . VAL A 1 175 ? 59.097 -40.930 -40.133 1.00 70.85 ? 175 VAL A CB 1 +ATOM 1270 C CG1 . VAL A 1 175 ? 58.129 -42.001 -40.624 1.00 51.10 ? 175 VAL A CG1 1 +ATOM 1271 C CG2 . VAL A 1 175 ? 60.531 -41.349 -40.430 1.00 78.22 ? 175 VAL A CG2 1 +ATOM 1272 N N . HIS A 1 176 ? 56.464 -39.222 -41.432 1.00 70.78 ? 176 HIS A N 1 +ATOM 1273 C CA . HIS A 1 176 ? 55.019 -39.201 -41.280 1.00 60.88 ? 176 HIS A CA 1 +ATOM 1274 C C . HIS A 1 176 ? 54.419 -40.402 -42.015 1.00 69.63 ? 176 HIS A C 1 +ATOM 1275 O O . HIS A 1 176 ? 54.522 -40.527 -43.238 1.00 57.91 ? 176 HIS A O 1 +ATOM 1276 C CB . HIS A 1 176 ? 54.441 -37.832 -41.682 1.00 58.24 ? 176 HIS A CB 1 +ATOM 1277 C CG . HIS A 1 176 ? 55.023 -36.680 -40.926 1.00 84.18 ? 176 HIS A CG 1 +ATOM 1278 N ND1 . HIS A 1 176 ? 54.608 -36.340 -39.649 1.00 91.26 ? 176 HIS A ND1 1 +ATOM 1279 C CD2 . HIS A 1 176 ? 55.983 -35.788 -41.256 1.00 96.99 ? 176 HIS A CD2 1 +ATOM 1280 C CE1 . HIS A 1 176 ? 55.288 -35.292 -39.226 1.00 93.71 ? 176 HIS A CE1 1 +ATOM 1281 N NE2 . HIS A 1 176 ? 56.140 -34.935 -40.194 1.00 115.70 ? 176 HIS A NE2 1 +ATOM 1282 N N . THR A 1 177 ? 53.822 -41.307 -41.234 1.00 60.35 ? 177 THR A N 1 +ATOM 1283 C CA . THR A 1 177 ? 53.054 -42.417 -41.771 1.00 49.11 ? 177 THR A CA 1 +ATOM 1284 C C . THR A 1 177 ? 51.570 -42.102 -41.587 1.00 52.24 ? 177 THR A C 1 +ATOM 1285 O O . THR A 1 177 ? 51.107 -41.871 -40.473 1.00 66.02 ? 177 THR A O 1 +ATOM 1286 C CB . THR A 1 177 ? 53.479 -43.743 -41.128 1.00 39.08 ? 177 THR A CB 1 +ATOM 1287 O OG1 . THR A 1 177 ? 54.905 -43.862 -41.117 1.00 38.19 ? 177 THR A OG1 1 +ATOM 1288 C CG2 . THR A 1 177 ? 52.866 -44.943 -41.811 1.00 36.60 ? 177 THR A CG2 1 +ATOM 1289 N N . PHE A 1 178 ? 50.839 -42.075 -42.701 1.00 56.90 ? 178 PHE A N 1 +ATOM 1290 C CA . PHE A 1 178 ? 49.451 -41.649 -42.705 1.00 58.09 ? 178 PHE A CA 1 +ATOM 1291 C C . PHE A 1 178 ? 48.536 -42.789 -42.261 1.00 72.79 ? 178 PHE A C 1 +ATOM 1292 O O . PHE A 1 178 ? 48.815 -43.952 -42.545 1.00 66.56 ? 178 PHE A O 1 +ATOM 1293 C CB . PHE A 1 178 ? 49.088 -41.054 -44.066 1.00 43.40 ? 178 PHE A CB 1 +ATOM 1294 C CG . PHE A 1 178 ? 49.761 -39.733 -44.319 1.00 66.50 ? 178 PHE A CG 1 +ATOM 1295 C CD1 . PHE A 1 178 ? 49.200 -38.554 -43.841 1.00 66.36 ? 178 PHE A CD1 1 +ATOM 1296 C CD2 . PHE A 1 178 ? 50.973 -39.671 -44.997 1.00 79.62 ? 178 PHE A CD2 1 +ATOM 1297 C CE1 . PHE A 1 178 ? 49.834 -37.339 -44.048 1.00 74.51 ? 178 PHE A CE1 1 +ATOM 1298 C CE2 . PHE A 1 178 ? 51.602 -38.451 -45.212 1.00 79.75 ? 178 PHE A CE2 1 +ATOM 1299 C CZ . PHE A 1 178 ? 51.027 -37.288 -44.739 1.00 97.82 ? 178 PHE A CZ 1 +ATOM 1300 N N . PRO A 1 179 ? 47.456 -42.489 -41.494 1.00 77.08 ? 179 PRO A N 1 +ATOM 1301 C CA . PRO A 1 179 ? 46.333 -43.414 -41.319 1.00 66.32 ? 179 PRO A CA 1 +ATOM 1302 C C . PRO A 1 179 ? 45.802 -43.948 -42.646 1.00 64.60 ? 179 PRO A C 1 +ATOM 1303 O O . PRO A 1 179 ? 45.791 -43.233 -43.649 1.00 59.90 ? 179 PRO A O 1 +ATOM 1304 C CB . PRO A 1 179 ? 45.264 -42.517 -40.676 1.00 61.54 ? 179 PRO A CB 1 +ATOM 1305 C CG . PRO A 1 179 ? 46.068 -41.553 -39.846 1.00 53.12 ? 179 PRO A CG 1 +ATOM 1306 C CD . PRO A 1 179 ? 47.297 -41.269 -40.683 1.00 58.54 ? 179 PRO A CD 1 +ATOM 1307 N N . ALA A 1 180 ? 45.360 -45.211 -42.619 1.00 69.02 ? 180 ALA A N 1 +ATOM 1308 C CA . ALA A 1 180 ? 44.866 -45.915 -43.791 1.00 68.95 ? 180 ALA A CA 1 +ATOM 1309 C C . ALA A 1 180 ? 43.429 -45.499 -44.093 1.00 61.31 ? 180 ALA A C 1 +ATOM 1310 O O . ALA A 1 180 ? 42.623 -45.306 -43.186 1.00 76.75 ? 180 ALA A O 1 +ATOM 1311 C CB . ALA A 1 180 ? 44.970 -47.404 -43.576 1.00 86.00 ? 180 ALA A CB 1 +ATOM 1312 N N . VAL A 1 181 ? 43.125 -45.365 -45.384 1.00 56.37 ? 181 VAL A N 1 +ATOM 1313 C CA . VAL A 1 181 ? 41.759 -45.129 -45.822 1.00 61.51 ? 181 VAL A CA 1 +ATOM 1314 C C . VAL A 1 181 ? 41.233 -46.413 -46.454 1.00 58.17 ? 181 VAL A C 1 +ATOM 1315 O O . VAL A 1 181 ? 42.010 -47.237 -46.932 1.00 55.06 ? 181 VAL A O 1 +ATOM 1316 C CB . VAL A 1 181 ? 41.641 -43.923 -46.779 1.00 62.22 ? 181 VAL A CB 1 +ATOM 1317 C CG1 . VAL A 1 181 ? 42.074 -42.619 -46.112 1.00 57.19 ? 181 VAL A CG1 1 +ATOM 1318 C CG2 . VAL A 1 181 ? 42.368 -44.139 -48.105 1.00 55.41 ? 181 VAL A CG2 1 +ATOM 1319 N N . LEU A 1 182 ? 39.910 -46.578 -46.433 1.00 57.62 ? 182 LEU A N 1 +ATOM 1320 C CA . LEU A 1 182 ? 39.304 -47.667 -47.170 1.00 62.57 ? 182 LEU A CA 1 +ATOM 1321 C C . LEU A 1 182 ? 38.943 -47.156 -48.559 1.00 64.02 ? 182 LEU A C 1 +ATOM 1322 O O . LEU A 1 182 ? 38.242 -46.154 -48.687 1.00 71.80 ? 182 LEU A O 1 +ATOM 1323 C CB . LEU A 1 182 ? 38.072 -48.184 -46.423 1.00 66.88 ? 182 LEU A CB 1 +ATOM 1324 C CG . LEU A 1 182 ? 37.590 -49.565 -46.868 1.00 76.13 ? 182 LEU A CG 1 +ATOM 1325 C CD1 . LEU A 1 182 ? 38.122 -50.656 -45.951 1.00 79.88 ? 182 LEU A CD1 1 +ATOM 1326 C CD2 . LEU A 1 182 ? 36.073 -49.615 -46.929 1.00 77.86 ? 182 LEU A CD2 1 +ATOM 1327 N N . GLN A 1 183 ? 39.481 -47.839 -49.576 1.00 76.50 ? 183 GLN A N 1 +ATOM 1328 C CA . GLN A 1 183 ? 39.108 -47.654 -50.971 1.00 74.64 ? 183 GLN A CA 1 +ATOM 1329 C C . GLN A 1 183 ? 37.784 -48.380 -51.196 1.00 74.75 ? 183 GLN A C 1 +ATOM 1330 O O . GLN A 1 183 ? 37.489 -49.355 -50.505 1.00 80.77 ? 183 GLN A O 1 +ATOM 1331 C CB . GLN A 1 183 ? 40.226 -48.160 -51.888 1.00 60.18 ? 183 GLN A CB 1 +ATOM 1332 C CG . GLN A 1 183 ? 41.597 -47.611 -51.510 1.00 76.40 ? 183 GLN A CG 1 +ATOM 1333 C CD . GLN A 1 183 ? 42.737 -48.213 -52.295 1.00 80.94 ? 183 GLN A CD 1 +ATOM 1334 O OE1 . GLN A 1 183 ? 43.034 -47.791 -53.408 1.00 91.77 ? 183 GLN A OE1 1 +ATOM 1335 N NE2 . GLN A 1 183 ? 43.407 -49.193 -51.708 1.00 72.81 ? 183 GLN A NE2 1 +ATOM 1336 N N . SER A 1 184 ? 36.993 -47.899 -52.161 1.00 78.79 ? 184 SER A N 1 +ATOM 1337 C CA . SER A 1 184 ? 35.625 -48.367 -52.338 1.00 107.33 ? 184 SER A CA 1 +ATOM 1338 C C . SER A 1 184 ? 35.584 -49.820 -52.818 1.00 120.08 ? 184 SER A C 1 +ATOM 1339 O O . SER A 1 184 ? 34.514 -50.429 -52.851 1.00 132.30 ? 184 SER A O 1 +ATOM 1340 C CB . SER A 1 184 ? 34.832 -47.439 -53.229 1.00 119.52 ? 184 SER A CB 1 +ATOM 1341 O OG . SER A 1 184 ? 35.514 -47.192 -54.449 1.00 125.33 ? 184 SER A OG 1 +ATOM 1342 N N . SER A 1 185 ? 36.759 -50.371 -53.160 1.00 94.69 ? 185 SER A N 1 +ATOM 1343 C CA . SER A 1 185 ? 36.904 -51.771 -53.531 1.00 87.42 ? 185 SER A CA 1 +ATOM 1344 C C . SER A 1 185 ? 36.951 -52.665 -52.289 1.00 93.44 ? 185 SER A C 1 +ATOM 1345 O O . SER A 1 185 ? 36.794 -53.882 -52.392 1.00 111.19 ? 185 SER A O 1 +ATOM 1346 C CB . SER A 1 185 ? 38.108 -51.977 -54.413 1.00 73.18 ? 185 SER A CB 1 +ATOM 1347 O OG . SER A 1 185 ? 39.303 -51.689 -53.706 1.00 78.33 ? 185 SER A OG 1 +ATOM 1348 N N . GLY A 1 186 ? 37.184 -52.053 -51.120 1.00 75.83 ? 186 GLY A N 1 +ATOM 1349 C CA . GLY A 1 186 ? 37.150 -52.754 -49.845 1.00 73.98 ? 186 GLY A CA 1 +ATOM 1350 C C . GLY A 1 186 ? 38.538 -53.180 -49.374 1.00 83.12 ? 186 GLY A C 1 +ATOM 1351 O O . GLY A 1 186 ? 38.673 -54.155 -48.636 1.00 72.81 ? 186 GLY A O 1 +ATOM 1352 N N . LEU A 1 187 ? 39.557 -52.425 -49.802 1.00 93.15 ? 187 LEU A N 1 +ATOM 1353 C CA . LEU A 1 187 ? 40.942 -52.645 -49.414 1.00 91.36 ? 187 LEU A CA 1 +ATOM 1354 C C . LEU A 1 187 ? 41.481 -51.377 -48.751 1.00 88.39 ? 187 LEU A C 1 +ATOM 1355 O O . LEU A 1 187 ? 40.857 -50.315 -48.820 1.00 80.26 ? 187 LEU A O 1 +ATOM 1356 C CB . LEU A 1 187 ? 41.746 -53.004 -50.669 1.00 110.40 ? 187 LEU A CB 1 +ATOM 1357 C CG . LEU A 1 187 ? 41.480 -54.391 -51.256 1.00 95.17 ? 187 LEU A CG 1 +ATOM 1358 C CD1 . LEU A 1 187 ? 41.118 -54.297 -52.727 1.00 76.48 ? 187 LEU A CD1 1 +ATOM 1359 C CD2 . LEU A 1 187 ? 42.674 -55.312 -51.055 1.00 103.79 ? 187 LEU A CD2 1 +ATOM 1360 N N . TYR A 1 188 ? 42.650 -51.499 -48.110 1.00 71.26 ? 188 TYR A N 1 +ATOM 1361 C CA . TYR A 1 188 ? 43.261 -50.374 -47.425 1.00 65.42 ? 188 TYR A CA 1 +ATOM 1362 C C . TYR A 1 188 ? 44.441 -49.838 -48.230 1.00 75.71 ? 188 TYR A C 1 +ATOM 1363 O O . TYR A 1 188 ? 45.192 -50.608 -48.824 1.00 81.50 ? 188 TYR A O 1 +ATOM 1364 C CB . TYR A 1 188 ? 43.679 -50.765 -46.005 1.00 84.28 ? 188 TYR A CB 1 +ATOM 1365 C CG . TYR A 1 188 ? 42.546 -50.932 -45.024 1.00 92.35 ? 188 TYR A CG 1 +ATOM 1366 C CD1 . TYR A 1 188 ? 41.914 -49.829 -44.464 1.00 108.95 ? 188 TYR A CD1 1 +ATOM 1367 C CD2 . TYR A 1 188 ? 42.113 -52.194 -44.641 1.00 95.80 ? 188 TYR A CD2 1 +ATOM 1368 C CE1 . TYR A 1 188 ? 40.873 -49.974 -43.559 1.00 101.66 ? 188 TYR A CE1 1 +ATOM 1369 C CE2 . TYR A 1 188 ? 41.076 -52.358 -43.735 1.00 93.71 ? 188 TYR A CE2 1 +ATOM 1370 C CZ . TYR A 1 188 ? 40.456 -51.243 -43.194 1.00 90.61 ? 188 TYR A CZ 1 +ATOM 1371 O OH . TYR A 1 188 ? 39.435 -51.395 -42.305 1.00 104.27 ? 188 TYR A OH 1 +ATOM 1372 N N . SER A 1 189 ? 44.573 -48.505 -48.232 1.00 78.29 ? 189 SER A N 1 +ATOM 1373 C CA . SER A 1 189 ? 45.722 -47.794 -48.770 1.00 72.50 ? 189 SER A CA 1 +ATOM 1374 C C . SER A 1 189 ? 46.314 -46.894 -47.686 1.00 72.70 ? 189 SER A C 1 +ATOM 1375 O O . SER A 1 189 ? 45.585 -46.364 -46.848 1.00 79.26 ? 189 SER A O 1 +ATOM 1376 C CB . SER A 1 189 ? 45.331 -47.001 -49.990 1.00 90.89 ? 189 SER A CB 1 +ATOM 1377 O OG . SER A 1 189 ? 46.477 -46.545 -50.696 1.00 111.47 ? 189 SER A OG 1 +ATOM 1378 N N . LEU A 1 190 ? 47.641 -46.722 -47.729 1.00 58.13 ? 190 LEU A N 1 +ATOM 1379 C CA . LEU A 1 190 ? 48.400 -45.980 -46.735 1.00 56.25 ? 190 LEU A CA 1 +ATOM 1380 C C . LEU A 1 190 ? 49.695 -45.494 -47.382 1.00 70.09 ? 190 LEU A C 1 +ATOM 1381 O O . LEU A 1 190 ? 50.276 -46.215 -48.189 1.00 97.85 ? 190 LEU A O 1 +ATOM 1382 C CB . LEU A 1 190 ? 48.685 -46.947 -45.579 1.00 55.57 ? 190 LEU A CB 1 +ATOM 1383 C CG . LEU A 1 190 ? 49.729 -46.530 -44.544 1.00 68.58 ? 190 LEU A CG 1 +ATOM 1384 C CD1 . LEU A 1 190 ? 49.360 -47.066 -43.170 1.00 82.84 ? 190 LEU A CD1 1 +ATOM 1385 C CD2 . LEU A 1 190 ? 51.125 -46.997 -44.941 1.00 61.66 ? 190 LEU A CD2 1 +ATOM 1386 N N . SER A 1 191 ? 50.148 -44.286 -47.014 1.00 61.16 ? 191 SER A N 1 +ATOM 1387 C CA . SER A 1 191 ? 51.444 -43.781 -47.454 1.00 52.84 ? 191 SER A CA 1 +ATOM 1388 C C . SER A 1 191 ? 52.341 -43.560 -46.246 1.00 48.30 ? 191 SER A C 1 +ATOM 1389 O O . SER A 1 191 ? 51.850 -43.473 -45.125 1.00 64.14 ? 191 SER A O 1 +ATOM 1390 C CB . SER A 1 191 ? 51.321 -42.514 -48.262 1.00 49.04 ? 191 SER A CB 1 +ATOM 1391 O OG . SER A 1 191 ? 50.128 -42.526 -49.039 1.00 66.72 ? 191 SER A OG 1 +ATOM 1392 N N . SER A 1 192 ? 53.653 -43.485 -46.493 1.00 43.02 ? 192 SER A N 1 +ATOM 1393 C CA . SER A 1 192 ? 54.627 -43.114 -45.479 1.00 40.32 ? 192 SER A CA 1 +ATOM 1394 C C . SER A 1 192 ? 55.727 -42.294 -46.134 1.00 45.79 ? 192 SER A C 1 +ATOM 1395 O O . SER A 1 192 ? 56.347 -42.746 -47.093 1.00 52.54 ? 192 SER A O 1 +ATOM 1396 C CB . SER A 1 192 ? 55.196 -44.305 -44.751 1.00 45.25 ? 192 SER A CB 1 +ATOM 1397 O OG . SER A 1 192 ? 56.303 -43.922 -43.930 1.00 45.09 ? 192 SER A OG 1 +ATOM 1398 N N . VAL A 1 193 ? 55.938 -41.088 -45.600 1.00 55.91 ? 193 VAL A N 1 +ATOM 1399 C CA . VAL A 1 193 ? 56.868 -40.137 -46.182 1.00 60.25 ? 193 VAL A CA 1 +ATOM 1400 C C . VAL A 1 193 ? 57.876 -39.697 -45.127 1.00 66.83 ? 193 VAL A C 1 +ATOM 1401 O O . VAL A 1 193 ? 57.613 -39.770 -43.926 1.00 71.15 ? 193 VAL A O 1 +ATOM 1402 C CB . VAL A 1 193 ? 56.162 -38.937 -46.845 1.00 57.24 ? 193 VAL A CB 1 +ATOM 1403 C CG1 . VAL A 1 193 ? 55.472 -39.329 -48.140 1.00 64.30 ? 193 VAL A CG1 1 +ATOM 1404 C CG2 . VAL A 1 193 ? 55.199 -38.232 -45.901 1.00 80.97 ? 193 VAL A CG2 1 +ATOM 1405 N N . VAL A 1 194 ? 59.031 -39.242 -45.622 1.00 52.96 ? 194 VAL A N 1 +ATOM 1406 C CA . VAL A 1 194 ? 60.135 -38.787 -44.804 1.00 52.83 ? 194 VAL A CA 1 +ATOM 1407 C C . VAL A 1 194 ? 60.722 -37.553 -45.484 1.00 51.93 ? 194 VAL A C 1 +ATOM 1408 O O . VAL A 1 194 ? 60.419 -37.300 -46.643 1.00 55.31 ? 194 VAL A O 1 +ATOM 1409 C CB . VAL A 1 194 ? 61.165 -39.918 -44.648 1.00 52.80 ? 194 VAL A CB 1 +ATOM 1410 C CG1 . VAL A 1 194 ? 61.992 -40.102 -45.915 1.00 48.83 ? 194 VAL A CG1 1 +ATOM 1411 C CG2 . VAL A 1 194 ? 62.032 -39.750 -43.404 1.00 37.03 ? 194 VAL A CG2 1 +ATOM 1412 N N . THR A 1 195 ? 61.525 -36.781 -44.742 1.00 58.52 ? 195 THR A N 1 +ATOM 1413 C CA . THR A 1 195 ? 62.207 -35.614 -45.277 1.00 62.66 ? 195 THR A CA 1 +ATOM 1414 C C . THR A 1 195 ? 63.671 -35.628 -44.850 1.00 66.72 ? 195 THR A C 1 +ATOM 1415 O O . THR A 1 195 ? 63.988 -35.809 -43.676 1.00 80.45 ? 195 THR A O 1 +ATOM 1416 C CB . THR A 1 195 ? 61.513 -34.295 -44.912 1.00 60.91 ? 195 THR A CB 1 +ATOM 1417 O OG1 . THR A 1 195 ? 61.012 -34.361 -43.576 1.00 62.58 ? 195 THR A OG1 1 +ATOM 1418 C CG2 . THR A 1 195 ? 60.416 -33.909 -45.880 1.00 50.05 ? 195 THR A CG2 1 +ATOM 1419 N N . VAL A 1 196 ? 64.543 -35.400 -45.836 1.00 76.87 ? 196 VAL A N 1 +ATOM 1420 C CA . VAL A 1 196 ? 65.984 -35.535 -45.696 1.00 72.78 ? 196 VAL A CA 1 +ATOM 1421 C C . VAL A 1 196 ? 66.659 -34.296 -46.288 1.00 64.09 ? 196 VAL A C 1 +ATOM 1422 O O . VAL A 1 196 ? 66.054 -33.598 -47.104 1.00 48.09 ? 196 VAL A O 1 +ATOM 1423 C CB . VAL A 1 196 ? 66.476 -36.844 -46.353 1.00 69.80 ? 196 VAL A CB 1 +ATOM 1424 C CG1 . VAL A 1 196 ? 66.077 -38.061 -45.531 1.00 72.17 ? 196 VAL A CG1 1 +ATOM 1425 C CG2 . VAL A 1 196 ? 66.014 -36.995 -47.799 1.00 50.50 ? 196 VAL A CG2 1 +ATOM 1426 N N . PRO A 1 197 ? 67.918 -33.965 -45.900 1.00 71.63 ? 197 PRO A N 1 +ATOM 1427 C CA . PRO A 1 197 ? 68.660 -32.901 -46.578 1.00 72.28 ? 197 PRO A CA 1 +ATOM 1428 C C . PRO A 1 197 ? 69.053 -33.370 -47.978 1.00 82.64 ? 197 PRO A C 1 +ATOM 1429 O O . PRO A 1 197 ? 69.213 -34.570 -48.212 1.00 104.85 ? 197 PRO A O 1 +ATOM 1430 C CB . PRO A 1 197 ? 69.902 -32.695 -45.698 1.00 63.06 ? 197 PRO A CB 1 +ATOM 1431 C CG . PRO A 1 197 ? 70.094 -34.030 -44.995 1.00 58.45 ? 197 PRO A CG 1 +ATOM 1432 C CD . PRO A 1 197 ? 68.697 -34.592 -44.816 1.00 61.15 ? 197 PRO A CD 1 +ATOM 1433 N N . SER A 1 198 ? 69.182 -32.410 -48.901 1.00 84.09 ? 198 SER A N 1 +ATOM 1434 C CA . SER A 1 198 ? 69.657 -32.670 -50.251 1.00 82.56 ? 198 SER A CA 1 +ATOM 1435 C C . SER A 1 198 ? 71.068 -33.251 -50.220 1.00 75.55 ? 198 SER A C 1 +ATOM 1436 O O . SER A 1 198 ? 71.363 -34.170 -50.976 1.00 78.62 ? 198 SER A O 1 +ATOM 1437 C CB . SER A 1 198 ? 69.608 -31.428 -51.095 1.00 102.33 ? 198 SER A CB 1 +ATOM 1438 O OG . SER A 1 198 ? 70.110 -30.309 -50.377 1.00 126.42 ? 198 SER A OG 1 +ATOM 1439 N N . SER A 1 199 ? 71.907 -32.723 -49.316 1.00 86.77 ? 199 SER A N 1 +ATOM 1440 C CA . SER A 1 199 ? 73.330 -33.026 -49.222 1.00 91.68 ? 199 SER A CA 1 +ATOM 1441 C C . SER A 1 199 ? 73.588 -34.531 -49.120 1.00 94.59 ? 199 SER A C 1 +ATOM 1442 O O . SER A 1 199 ? 74.333 -35.091 -49.925 1.00 94.08 ? 199 SER A O 1 +ATOM 1443 C CB . SER A 1 199 ? 73.984 -32.261 -48.086 1.00 82.14 ? 199 SER A CB 1 +ATOM 1444 O OG . SER A 1 199 ? 73.379 -32.567 -46.838 1.00 85.66 ? 199 SER A OG 1 +ATOM 1445 N N . SER A 1 200 ? 72.936 -35.178 -48.148 1.00 102.87 ? 200 SER A N 1 +ATOM 1446 C CA . SER A 1 200 ? 73.256 -36.542 -47.762 1.00 105.79 ? 200 SER A CA 1 +ATOM 1447 C C . SER A 1 200 ? 72.591 -37.562 -48.689 1.00 98.15 ? 200 SER A C 1 +ATOM 1448 O O . SER A 1 200 ? 72.573 -38.753 -48.376 1.00 118.31 ? 200 SER A O 1 +ATOM 1449 C CB . SER A 1 200 ? 72.897 -36.775 -46.313 1.00 124.58 ? 200 SER A CB 1 +ATOM 1450 O OG . SER A 1 200 ? 71.497 -36.639 -46.112 1.00 131.87 ? 200 SER A OG 1 +ATOM 1451 N N . LEU A 1 201 ? 72.077 -37.098 -49.837 1.00 78.84 ? 201 LEU A N 1 +ATOM 1452 C CA . LEU A 1 201 ? 71.330 -37.954 -50.748 1.00 80.36 ? 201 LEU A CA 1 +ATOM 1453 C C . LEU A 1 201 ? 72.249 -38.897 -51.516 1.00 85.33 ? 201 LEU A C 1 +ATOM 1454 O O . LEU A 1 201 ? 71.863 -40.032 -51.788 1.00 96.82 ? 201 LEU A O 1 +ATOM 1455 C CB . LEU A 1 201 ? 70.499 -37.104 -51.708 1.00 87.56 ? 201 LEU A CB 1 +ATOM 1456 C CG . LEU A 1 201 ? 69.119 -36.704 -51.193 1.00 101.28 ? 201 LEU A CG 1 +ATOM 1457 C CD1 . LEU A 1 201 ? 68.481 -35.682 -52.119 1.00 110.46 ? 201 LEU A CD1 1 +ATOM 1458 C CD2 . LEU A 1 201 ? 68.219 -37.924 -51.050 1.00 91.96 ? 201 LEU A CD2 1 +ATOM 1459 N N . GLY A 1 202 ? 73.447 -38.410 -51.871 1.00 86.36 ? 202 GLY A N 1 +ATOM 1460 C CA . GLY A 1 202 ? 74.438 -39.188 -52.599 1.00 69.93 ? 202 GLY A CA 1 +ATOM 1461 C C . GLY A 1 202 ? 75.092 -40.264 -51.734 1.00 84.14 ? 202 GLY A C 1 +ATOM 1462 O O . GLY A 1 202 ? 75.362 -41.363 -52.217 1.00 81.62 ? 202 GLY A O 1 +ATOM 1463 N N . THR A 1 203 ? 75.331 -39.934 -50.456 1.00 97.32 ? 203 THR A N 1 +ATOM 1464 C CA . THR A 1 203 ? 76.017 -40.804 -49.512 1.00 80.56 ? 203 THR A CA 1 +ATOM 1465 C C . THR A 1 203 ? 75.058 -41.844 -48.930 1.00 90.29 ? 203 THR A C 1 +ATOM 1466 O O . THR A 1 203 ? 75.304 -43.041 -49.067 1.00 104.08 ? 203 THR A O 1 +ATOM 1467 C CB . THR A 1 203 ? 76.743 -39.990 -48.432 1.00 73.51 ? 203 THR A CB 1 +ATOM 1468 N N . LYS A 1 204 ? 73.974 -41.379 -48.287 1.00 88.60 ? 204 LYS A N 1 +ATOM 1469 C CA . LYS A 1 204 ? 73.087 -42.239 -47.513 1.00 93.80 ? 204 LYS A CA 1 +ATOM 1470 C C . LYS A 1 204 ? 72.106 -42.970 -48.435 1.00 85.36 ? 204 LYS A C 1 +ATOM 1471 O O . LYS A 1 204 ? 71.905 -42.579 -49.583 1.00 82.48 ? 204 LYS A O 1 +ATOM 1472 C CB . LYS A 1 204 ? 72.445 -41.450 -46.359 1.00 96.47 ? 204 LYS A CB 1 +ATOM 1473 C CG . LYS A 1 204 ? 71.620 -42.230 -45.329 1.00 110.50 ? 204 LYS A CG 1 +ATOM 1474 C CD . LYS A 1 204 ? 72.325 -43.393 -44.634 1.00 88.38 ? 204 LYS A CD 1 +ATOM 1475 C CE . LYS A 1 204 ? 71.371 -44.362 -43.966 1.00 69.58 ? 204 LYS A CE 1 +ATOM 1476 N NZ . LYS A 1 204 ? 71.813 -45.767 -44.143 1.00 76.28 ? 204 LYS A NZ 1 +ATOM 1477 N N . THR A 1 205 ? 71.510 -44.044 -47.900 1.00 89.64 ? 205 THR A N 1 +ATOM 1478 C CA . THR A 1 205 ? 70.566 -44.922 -48.576 1.00 69.98 ? 205 THR A CA 1 +ATOM 1479 C C . THR A 1 205 ? 69.280 -45.017 -47.745 1.00 68.03 ? 205 THR A C 1 +ATOM 1480 O O . THR A 1 205 ? 69.328 -44.922 -46.518 1.00 79.74 ? 205 THR A O 1 +ATOM 1481 C CB . THR A 1 205 ? 71.251 -46.266 -48.858 1.00 65.32 ? 205 THR A CB 1 +ATOM 1482 O OG1 . THR A 1 205 ? 70.270 -47.137 -49.414 1.00 78.35 ? 205 THR A OG1 1 +ATOM 1483 C CG2 . THR A 1 205 ? 71.895 -46.892 -47.635 1.00 60.71 ? 205 THR A CG2 1 +ATOM 1484 N N . TYR A 1 206 ? 68.130 -45.230 -48.409 1.00 54.44 ? 206 TYR A N 1 +ATOM 1485 C CA . TYR A 1 206 ? 66.839 -44.957 -47.789 1.00 50.20 ? 206 TYR A CA 1 +ATOM 1486 C C . TYR A 1 206 ? 65.805 -46.063 -48.031 1.00 56.26 ? 206 TYR A C 1 +ATOM 1487 O O . TYR A 1 206 ? 65.107 -46.062 -49.047 1.00 57.14 ? 206 TYR A O 1 +ATOM 1488 C CB . TYR A 1 206 ? 66.345 -43.579 -48.243 1.00 70.34 ? 206 TYR A CB 1 +ATOM 1489 C CG . TYR A 1 206 ? 67.129 -42.413 -47.691 1.00 88.96 ? 206 TYR A CG 1 +ATOM 1490 C CD1 . TYR A 1 206 ? 67.176 -42.166 -46.325 1.00 89.39 ? 206 TYR A CD1 1 +ATOM 1491 C CD2 . TYR A 1 206 ? 67.818 -41.545 -48.530 1.00 87.61 ? 206 TYR A CD2 1 +ATOM 1492 C CE1 . TYR A 1 206 ? 67.890 -41.098 -45.803 1.00 83.16 ? 206 TYR A CE1 1 +ATOM 1493 C CE2 . TYR A 1 206 ? 68.528 -40.465 -48.023 1.00 101.59 ? 206 TYR A CE2 1 +ATOM 1494 C CZ . TYR A 1 206 ? 68.566 -40.242 -46.654 1.00 86.45 ? 206 TYR A CZ 1 +ATOM 1495 O OH . TYR A 1 206 ? 69.259 -39.187 -46.135 1.00 92.63 ? 206 TYR A OH 1 +ATOM 1496 N N . THR A 1 207 ? 65.652 -46.947 -47.030 1.00 67.51 ? 207 THR A N 1 +ATOM 1497 C CA . THR A 1 207 ? 64.817 -48.146 -47.078 1.00 68.09 ? 207 THR A CA 1 +ATOM 1498 C C . THR A 1 207 ? 63.621 -48.004 -46.137 1.00 59.75 ? 207 THR A C 1 +ATOM 1499 O O . THR A 1 207 ? 63.777 -47.515 -45.023 1.00 66.48 ? 207 THR A O 1 +ATOM 1500 C CB . THR A 1 207 ? 65.594 -49.360 -46.550 1.00 58.64 ? 207 THR A CB 1 +ATOM 1501 O OG1 . THR A 1 207 ? 66.910 -49.369 -47.102 1.00 69.22 ? 207 THR A OG1 1 +ATOM 1502 C CG2 . THR A 1 207 ? 64.903 -50.683 -46.792 1.00 53.12 ? 207 THR A CG2 1 +ATOM 1503 N N . CYS A 1 208 ? 62.444 -48.484 -46.569 1.00 62.41 ? 208 CYS A N 1 +ATOM 1504 C CA . CYS A 1 208 ? 61.281 -48.523 -45.695 1.00 62.50 ? 208 CYS A CA 1 +ATOM 1505 C C . CYS A 1 208 ? 60.801 -49.955 -45.459 1.00 68.25 ? 208 CYS A C 1 +ATOM 1506 O O . CYS A 1 208 ? 60.750 -50.764 -46.385 1.00 60.63 ? 208 CYS A O 1 +ATOM 1507 C CB . CYS A 1 208 ? 60.146 -47.687 -46.259 1.00 63.98 ? 208 CYS A CB 1 +ATOM 1508 S SG . CYS A 1 208 ? 59.376 -48.452 -47.701 1.00 54.09 ? 208 CYS A SG 1 +ATOM 1509 N N . ASN A 1 209 ? 60.402 -50.225 -44.208 1.00 67.55 ? 209 ASN A N 1 +ATOM 1510 C CA . ASN A 1 209 ? 60.116 -51.568 -43.726 1.00 66.46 ? 209 ASN A CA 1 +ATOM 1511 C C . ASN A 1 209 ? 58.631 -51.701 -43.416 1.00 63.95 ? 209 ASN A C 1 +ATOM 1512 O O . ASN A 1 209 ? 58.163 -51.245 -42.373 1.00 69.51 ? 209 ASN A O 1 +ATOM 1513 C CB . ASN A 1 209 ? 60.944 -51.922 -42.487 1.00 55.24 ? 209 ASN A CB 1 +ATOM 1514 C CG . ASN A 1 209 ? 62.356 -51.385 -42.543 1.00 59.54 ? 209 ASN A CG 1 +ATOM 1515 O OD1 . ASN A 1 209 ? 62.787 -50.676 -41.641 1.00 69.92 ? 209 ASN A OD1 1 +ATOM 1516 N ND2 . ASN A 1 209 ? 63.077 -51.697 -43.607 1.00 62.76 ? 209 ASN A ND2 1 +ATOM 1517 N N . VAL A 1 210 ? 57.914 -52.360 -44.329 1.00 51.19 ? 210 VAL A N 1 +ATOM 1518 C CA . VAL A 1 210 ? 56.490 -52.600 -44.179 1.00 44.98 ? 210 VAL A CA 1 +ATOM 1519 C C . VAL A 1 210 ? 56.291 -53.995 -43.596 1.00 53.20 ? 210 VAL A C 1 +ATOM 1520 O O . VAL A 1 210 ? 56.872 -54.966 -44.077 1.00 47.84 ? 210 VAL A O 1 +ATOM 1521 C CB . VAL A 1 210 ? 55.758 -52.442 -45.523 1.00 47.61 ? 210 VAL A CB 1 +ATOM 1522 C CG1 . VAL A 1 210 ? 54.245 -52.499 -45.365 1.00 45.80 ? 210 VAL A CG1 1 +ATOM 1523 C CG2 . VAL A 1 210 ? 56.163 -51.158 -46.224 1.00 61.49 ? 210 VAL A CG2 1 +ATOM 1524 N N . ASP A 1 211 ? 55.470 -54.068 -42.541 1.00 79.65 ? 211 ASP A N 1 +ATOM 1525 C CA . ASP A 1 211 ? 55.060 -55.334 -41.958 1.00 66.33 ? 211 ASP A CA 1 +ATOM 1526 C C . ASP A 1 211 ? 53.541 -55.444 -41.999 1.00 54.69 ? 211 ASP A C 1 +ATOM 1527 O O . ASP A 1 211 ? 52.840 -54.506 -41.632 1.00 78.55 ? 211 ASP A O 1 +ATOM 1528 C CB . ASP A 1 211 ? 55.597 -55.511 -40.537 1.00 57.27 ? 211 ASP A CB 1 +ATOM 1529 C CG . ASP A 1 211 ? 55.603 -56.961 -40.070 1.00 83.58 ? 211 ASP A CG 1 +ATOM 1530 O OD1 . ASP A 1 211 ? 54.936 -57.809 -40.717 1.00 97.96 ? 211 ASP A OD1 1 +ATOM 1531 O OD2 . ASP A 1 211 ? 56.276 -57.239 -39.059 1.00 77.63 ? 211 ASP A OD2 1 +ATOM 1532 N N . HIS A 1 212 ? 53.057 -56.607 -42.446 1.00 47.65 ? 212 HIS A N 1 +ATOM 1533 C CA . HIS A 1 212 ? 51.646 -56.957 -42.402 1.00 51.90 ? 212 HIS A CA 1 +ATOM 1534 C C . HIS A 1 212 ? 51.525 -58.368 -41.838 1.00 59.29 ? 212 HIS A C 1 +ATOM 1535 O O . HIS A 1 212 ? 51.462 -59.337 -42.593 1.00 75.79 ? 212 HIS A O 1 +ATOM 1536 C CB . HIS A 1 212 ? 51.016 -56.780 -43.794 1.00 56.71 ? 212 HIS A CB 1 +ATOM 1537 C CG . HIS A 1 212 ? 49.554 -57.082 -43.907 1.00 70.21 ? 212 HIS A CG 1 +ATOM 1538 N ND1 . HIS A 1 212 ? 49.016 -57.686 -45.032 1.00 61.28 ? 212 HIS A ND1 1 +ATOM 1539 C CD2 . HIS A 1 212 ? 48.511 -56.836 -43.083 1.00 67.98 ? 212 HIS A CD2 1 +ATOM 1540 C CE1 . HIS A 1 212 ? 47.712 -57.811 -44.885 1.00 59.31 ? 212 HIS A CE1 1 +ATOM 1541 N NE2 . HIS A 1 212 ? 47.378 -57.299 -43.700 1.00 66.65 ? 212 HIS A NE2 1 +ATOM 1542 N N . LYS A 1 213 ? 51.518 -58.456 -40.500 1.00 63.40 ? 213 LYS A N 1 +ATOM 1543 C CA . LYS A 1 213 ? 51.451 -59.710 -39.758 1.00 70.62 ? 213 LYS A CA 1 +ATOM 1544 C C . LYS A 1 213 ? 50.282 -60.583 -40.230 1.00 62.68 ? 213 LYS A C 1 +ATOM 1545 O O . LYS A 1 213 ? 50.478 -61.777 -40.444 1.00 64.00 ? 213 LYS A O 1 +ATOM 1546 C CB . LYS A 1 213 ? 51.433 -59.454 -38.247 1.00 62.04 ? 213 LYS A CB 1 +ATOM 1547 C CG . LYS A 1 213 ? 52.753 -59.001 -37.637 1.00 56.49 ? 213 LYS A CG 1 +ATOM 1548 C CD . LYS A 1 213 ? 52.553 -58.052 -36.472 1.00 87.21 ? 213 LYS A CD 1 +ATOM 1549 C CE . LYS A 1 213 ? 53.683 -58.081 -35.461 1.00 113.82 ? 213 LYS A CE 1 +ATOM 1550 N NZ . LYS A 1 213 ? 53.396 -57.254 -34.262 1.00 91.25 ? 213 LYS A NZ 1 +ATOM 1551 N N . PRO A 1 214 ? 49.049 -60.049 -40.428 1.00 63.54 ? 214 PRO A N 1 +ATOM 1552 C CA . PRO A 1 214 ? 47.933 -60.846 -40.962 1.00 59.24 ? 214 PRO A CA 1 +ATOM 1553 C C . PRO A 1 214 ? 48.102 -61.604 -42.286 1.00 59.81 ? 214 PRO A C 1 +ATOM 1554 O O . PRO A 1 214 ? 47.253 -62.414 -42.649 1.00 63.50 ? 214 PRO A O 1 +ATOM 1555 C CB . PRO A 1 214 ? 46.795 -59.821 -41.114 1.00 63.21 ? 214 PRO A CB 1 +ATOM 1556 C CG . PRO A 1 214 ? 47.120 -58.723 -40.125 1.00 64.61 ? 214 PRO A CG 1 +ATOM 1557 C CD . PRO A 1 214 ? 48.632 -58.675 -40.082 1.00 59.51 ? 214 PRO A CD 1 +ATOM 1558 N N . SER A 1 215 ? 49.177 -61.338 -43.031 1.00 76.66 ? 215 SER A N 1 +ATOM 1559 C CA . SER A 1 215 ? 49.471 -62.133 -44.214 1.00 64.95 ? 215 SER A CA 1 +ATOM 1560 C C . SER A 1 215 ? 50.864 -62.741 -44.097 1.00 53.57 ? 215 SER A C 1 +ATOM 1561 O O . SER A 1 215 ? 51.301 -63.464 -44.987 1.00 67.04 ? 215 SER A O 1 +ATOM 1562 C CB . SER A 1 215 ? 49.332 -61.321 -45.469 1.00 64.87 ? 215 SER A CB 1 +ATOM 1563 O OG . SER A 1 215 ? 50.270 -60.258 -45.473 1.00 67.70 ? 215 SER A OG 1 +ATOM 1564 N N . ASN A 1 216 ? 51.544 -62.423 -42.988 1.00 48.89 ? 216 ASN A N 1 +ATOM 1565 C CA . ASN A 1 216 ? 52.898 -62.865 -42.688 1.00 59.34 ? 216 ASN A CA 1 +ATOM 1566 C C . ASN A 1 216 ? 53.894 -62.310 -43.704 1.00 64.58 ? 216 ASN A C 1 +ATOM 1567 O O . ASN A 1 216 ? 55.006 -62.823 -43.818 1.00 59.43 ? 216 ASN A O 1 +ATOM 1568 C CB . ASN A 1 216 ? 52.977 -64.384 -42.526 1.00 58.40 ? 216 ASN A CB 1 +ATOM 1569 C CG . ASN A 1 216 ? 52.335 -64.834 -41.234 1.00 64.04 ? 216 ASN A CG 1 +ATOM 1570 O OD1 . ASN A 1 216 ? 52.987 -64.830 -40.191 1.00 47.31 ? 216 ASN A OD1 1 +ATOM 1571 N ND2 . ASN A 1 216 ? 51.059 -65.193 -41.293 1.00 48.64 ? 216 ASN A ND2 1 +ATOM 1572 N N . THR A 1 217 ? 53.482 -61.250 -44.412 1.00 66.04 ? 217 THR A N 1 +ATOM 1573 C CA . THR A 1 217 ? 54.269 -60.621 -45.459 1.00 62.60 ? 217 THR A CA 1 +ATOM 1574 C C . THR A 1 217 ? 55.065 -59.471 -44.844 1.00 57.31 ? 217 THR A C 1 +ATOM 1575 O O . THR A 1 217 ? 54.585 -58.792 -43.939 1.00 57.26 ? 217 THR A O 1 +ATOM 1576 C CB . THR A 1 217 ? 53.387 -60.246 -46.664 1.00 85.85 ? 217 THR A CB 1 +ATOM 1577 O OG1 . THR A 1 217 ? 52.406 -61.261 -46.885 1.00 82.14 ? 217 THR A OG1 1 +ATOM 1578 C CG2 . THR A 1 217 ? 54.155 -60.054 -47.955 1.00 92.23 ? 217 THR A CG2 1 +ATOM 1579 N N . LYS A 1 218 ? 56.293 -59.284 -45.348 1.00 72.99 ? 218 LYS A N 1 +ATOM 1580 C CA . LYS A 1 218 ? 57.213 -58.235 -44.932 1.00 69.43 ? 218 LYS A CA 1 +ATOM 1581 C C . LYS A 1 218 ? 57.946 -57.700 -46.174 1.00 58.60 ? 218 LYS A C 1 +ATOM 1582 O O . LYS A 1 218 ? 58.662 -58.440 -46.847 1.00 62.98 ? 218 LYS A O 1 +ATOM 1583 C CB . LYS A 1 218 ? 58.114 -58.796 -43.822 1.00 51.16 ? 218 LYS A CB 1 +ATOM 1584 C CG . LYS A 1 218 ? 58.555 -57.810 -42.750 1.00 70.42 ? 218 LYS A CG 1 +ATOM 1585 C CD . LYS A 1 218 ? 59.825 -57.058 -43.102 1.00 84.59 ? 218 LYS A CD 1 +ATOM 1586 C CE . LYS A 1 218 ? 59.931 -55.708 -42.423 1.00 102.12 ? 218 LYS A CE 1 +ATOM 1587 N NZ . LYS A 1 218 ? 60.479 -55.812 -41.049 1.00 111.23 ? 218 LYS A NZ 1 +ATOM 1588 N N . VAL A 1 219 ? 57.745 -56.412 -46.494 1.00 51.30 ? 219 VAL A N 1 +ATOM 1589 C CA . VAL A 1 219 ? 58.225 -55.819 -47.738 1.00 57.46 ? 219 VAL A CA 1 +ATOM 1590 C C . VAL A 1 219 ? 59.230 -54.708 -47.439 1.00 52.53 ? 219 VAL A C 1 +ATOM 1591 O O . VAL A 1 219 ? 58.965 -53.831 -46.618 1.00 71.96 ? 219 VAL A O 1 +ATOM 1592 C CB . VAL A 1 219 ? 57.072 -55.281 -48.610 1.00 72.38 ? 219 VAL A CB 1 +ATOM 1593 C CG1 . VAL A 1 219 ? 57.530 -55.005 -50.037 1.00 79.31 ? 219 VAL A CG1 1 +ATOM 1594 C CG2 . VAL A 1 219 ? 55.854 -56.197 -48.613 1.00 83.40 ? 219 VAL A CG2 1 +ATOM 1595 N N . ASP A 1 220 ? 60.377 -54.752 -48.133 1.00 57.09 ? 220 ASP A N 1 +ATOM 1596 C CA . ASP A 1 220 ? 61.414 -53.730 -48.045 1.00 67.16 ? 220 ASP A CA 1 +ATOM 1597 C C . ASP A 1 220 ? 61.653 -53.104 -49.422 1.00 60.35 ? 220 ASP A C 1 +ATOM 1598 O O . ASP A 1 220 ? 61.915 -53.812 -50.388 1.00 68.55 ? 220 ASP A O 1 +ATOM 1599 C CB . ASP A 1 220 ? 62.693 -54.281 -47.405 1.00 50.06 ? 220 ASP A CB 1 +ATOM 1600 C CG . ASP A 1 220 ? 62.543 -54.677 -45.944 1.00 65.70 ? 220 ASP A CG 1 +ATOM 1601 O OD1 . ASP A 1 220 ? 61.455 -54.455 -45.377 1.00 70.42 ? 220 ASP A OD1 1 +ATOM 1602 O OD2 . ASP A 1 220 ? 63.523 -55.204 -45.376 1.00 68.97 ? 220 ASP A OD2 1 +ATOM 1603 N N . LYS A 1 221 ? 61.557 -51.769 -49.495 1.00 70.00 ? 221 LYS A N 1 +ATOM 1604 C CA . LYS A 1 221 ? 61.774 -51.014 -50.721 1.00 63.39 ? 221 LYS A CA 1 +ATOM 1605 C C . LYS A 1 221 ? 62.878 -49.981 -50.503 1.00 65.75 ? 221 LYS A C 1 +ATOM 1606 O O . LYS A 1 221 ? 62.733 -49.078 -49.676 1.00 69.51 ? 221 LYS A O 1 +ATOM 1607 C CB . LYS A 1 221 ? 60.483 -50.304 -51.140 1.00 48.29 ? 221 LYS A CB 1 +ATOM 1608 C CG . LYS A 1 221 ? 60.335 -50.039 -52.631 1.00 60.65 ? 221 LYS A CG 1 +ATOM 1609 C CD . LYS A 1 221 ? 59.741 -51.214 -53.387 1.00 66.12 ? 221 LYS A CD 1 +ATOM 1610 C CE . LYS A 1 221 ? 59.974 -51.142 -54.881 1.00 102.61 ? 221 LYS A CE 1 +ATOM 1611 N NZ . LYS A 1 221 ? 61.383 -51.407 -55.265 1.00 85.64 ? 221 LYS A NZ 1 +ATOM 1612 N N . ARG A 1 222 ? 63.989 -50.138 -51.235 1.00 58.02 ? 222 ARG A N 1 +ATOM 1613 C CA . ARG A 1 222 ? 64.995 -49.088 -51.309 1.00 62.95 ? 222 ARG A CA 1 +ATOM 1614 C C . ARG A 1 222 ? 64.523 -48.069 -52.348 1.00 68.05 ? 222 ARG A C 1 +ATOM 1615 O O . ARG A 1 222 ? 64.187 -48.438 -53.473 1.00 64.64 ? 222 ARG A O 1 +ATOM 1616 C CB . ARG A 1 222 ? 66.398 -49.662 -51.549 1.00 45.41 ? 222 ARG A CB 1 +ATOM 1617 N N . VAL A 1 223 ? 64.484 -46.795 -51.932 1.00 65.14 ? 223 VAL A N 1 +ATOM 1618 C CA . VAL A 1 223 ? 63.768 -45.719 -52.604 1.00 66.91 ? 223 VAL A CA 1 +ATOM 1619 C C . VAL A 1 223 ? 64.785 -44.825 -53.312 1.00 61.88 ? 223 VAL A C 1 +ATOM 1620 O O . VAL A 1 223 ? 65.815 -44.499 -52.728 1.00 80.53 ? 223 VAL A O 1 +ATOM 1621 C CB . VAL A 1 223 ? 62.932 -44.911 -51.586 1.00 87.34 ? 223 VAL A CB 1 +ATOM 1622 C CG1 . VAL A 1 223 ? 61.934 -43.981 -52.258 1.00 92.48 ? 223 VAL A CG1 1 +ATOM 1623 C CG2 . VAL A 1 223 ? 62.218 -45.798 -50.574 1.00 85.89 ? 223 VAL A CG2 1 +ATOM 1624 N N . GLU A 1 224 ? 64.479 -44.416 -54.555 1.00 69.16 ? 224 GLU A N 1 +ATOM 1625 C CA . GLU A 1 224 ? 65.350 -43.526 -55.314 1.00 91.46 ? 224 GLU A CA 1 +ATOM 1626 C C . GLU A 1 224 ? 64.533 -42.615 -56.237 1.00 105.13 ? 224 GLU A C 1 +ATOM 1627 O O . GLU A 1 224 ? 65.094 -41.726 -56.890 1.00 110.21 ? 224 GLU A O 1 +ATOM 1628 C CB . GLU A 1 224 ? 66.364 -44.324 -56.133 1.00 99.61 ? 224 GLU A CB 1 +ATOM 1629 C CG . GLU A 1 224 ? 67.695 -44.504 -55.429 1.00 90.43 ? 224 GLU A CG 1 +ATOM 1630 C CD . GLU A 1 224 ? 68.216 -45.932 -55.393 1.00 95.15 ? 224 GLU A CD 1 +ATOM 1631 O OE1 . GLU A 1 224 ? 67.704 -46.788 -56.162 1.00 79.57 ? 224 GLU A OE1 1 +ATOM 1632 O OE2 . GLU A 1 224 ? 69.129 -46.189 -54.584 1.00 97.85 ? 224 GLU A OE2 1 +ATOM 1633 N N . ASP B 2 1 ? 26.817 -51.960 -13.698 1.00 69.27 ? 1 ASP B N 1 +ATOM 1634 C CA . ASP B 2 1 ? 28.253 -51.545 -13.576 1.00 84.78 ? 1 ASP B CA 1 +ATOM 1635 C C . ASP B 2 1 ? 28.345 -50.035 -13.360 1.00 90.35 ? 1 ASP B C 1 +ATOM 1636 O O . ASP B 2 1 ? 27.421 -49.292 -13.699 1.00 93.87 ? 1 ASP B O 1 +ATOM 1637 C CB . ASP B 2 1 ? 29.104 -52.023 -14.761 1.00 101.76 ? 1 ASP B CB 1 +ATOM 1638 C CG . ASP B 2 1 ? 28.326 -52.435 -16.005 1.00 88.37 ? 1 ASP B CG 1 +ATOM 1639 O OD1 . ASP B 2 1 ? 27.703 -53.517 -15.973 1.00 77.13 ? 1 ASP B OD1 1 +ATOM 1640 O OD2 . ASP B 2 1 ? 28.356 -51.679 -17.002 1.00 72.82 ? 1 ASP B OD2 1 +ATOM 1641 N N . ILE B 2 2 ? 29.483 -49.603 -12.799 1.00 69.56 ? 2 ILE B N 1 +ATOM 1642 C CA . ILE B 2 2 ? 29.767 -48.205 -12.510 1.00 57.57 ? 2 ILE B CA 1 +ATOM 1643 C C . ILE B 2 2 ? 29.900 -47.415 -13.818 1.00 63.61 ? 2 ILE B C 1 +ATOM 1644 O O . ILE B 2 2 ? 30.735 -47.723 -14.665 1.00 59.57 ? 2 ILE B O 1 +ATOM 1645 C CB . ILE B 2 2 ? 31.005 -48.105 -11.596 1.00 52.07 ? 2 ILE B CB 1 +ATOM 1646 C CG1 . ILE B 2 2 ? 30.793 -48.927 -10.317 1.00 56.89 ? 2 ILE B CG1 1 +ATOM 1647 C CG2 . ILE B 2 2 ? 31.329 -46.648 -11.289 1.00 58.96 ? 2 ILE B CG2 1 +ATOM 1648 C CD1 . ILE B 2 2 ? 32.049 -49.367 -9.600 1.00 50.04 ? 2 ILE B CD1 1 +ATOM 1649 N N . VAL B 2 3 ? 29.034 -46.407 -13.985 1.00 58.34 ? 3 VAL B N 1 +ATOM 1650 C CA . VAL B 2 3 ? 29.066 -45.517 -15.134 1.00 46.72 ? 3 VAL B CA 1 +ATOM 1651 C C . VAL B 2 3 ? 30.067 -44.404 -14.840 1.00 51.55 ? 3 VAL B C 1 +ATOM 1652 O O . VAL B 2 3 ? 29.900 -43.671 -13.871 1.00 62.37 ? 3 VAL B O 1 +ATOM 1653 C CB . VAL B 2 3 ? 27.670 -44.925 -15.418 1.00 53.94 ? 3 VAL B CB 1 +ATOM 1654 C CG1 . VAL B 2 3 ? 27.706 -43.876 -16.524 1.00 65.00 ? 3 VAL B CG1 1 +ATOM 1655 C CG2 . VAL B 2 3 ? 26.628 -45.993 -15.727 1.00 50.99 ? 3 VAL B CG2 1 +ATOM 1656 N N . MET B 2 4 ? 31.098 -44.276 -15.684 1.00 43.27 ? 4 MET B N 1 +ATOM 1657 C CA . MET B 2 4 ? 31.980 -43.122 -15.601 1.00 38.87 ? 4 MET B CA 1 +ATOM 1658 C C . MET B 2 4 ? 31.528 -42.069 -16.612 1.00 54.54 ? 4 MET B C 1 +ATOM 1659 O O . MET B 2 4 ? 31.213 -42.392 -17.757 1.00 55.46 ? 4 MET B O 1 +ATOM 1660 C CB . MET B 2 4 ? 33.441 -43.493 -15.860 1.00 32.85 ? 4 MET B CB 1 +ATOM 1661 C CG . MET B 2 4 ? 33.874 -44.787 -15.201 1.00 47.00 ? 4 MET B CG 1 +ATOM 1662 S SD . MET B 2 4 ? 34.129 -44.638 -13.407 1.00 56.63 ? 4 MET B SD 1 +ATOM 1663 C CE . MET B 2 4 ? 35.687 -43.762 -13.336 1.00 44.73 ? 4 MET B CE 1 +ATOM 1664 N N . THR B 2 5 ? 31.481 -40.807 -16.164 1.00 58.26 ? 5 THR B N 1 +ATOM 1665 C CA . THR B 2 5 ? 31.161 -39.678 -17.025 1.00 54.98 ? 5 THR B CA 1 +ATOM 1666 C C . THR B 2 5 ? 32.353 -38.717 -17.030 1.00 68.23 ? 5 THR B C 1 +ATOM 1667 O O . THR B 2 5 ? 32.628 -38.050 -16.026 1.00 62.51 ? 5 THR B O 1 +ATOM 1668 C CB . THR B 2 5 ? 29.805 -39.050 -16.662 1.00 65.26 ? 5 THR B CB 1 +ATOM 1669 O OG1 . THR B 2 5 ? 30.006 -38.026 -15.686 1.00 79.79 ? 5 THR B OG1 1 +ATOM 1670 C CG2 . THR B 2 5 ? 28.781 -40.042 -16.150 1.00 63.97 ? 5 THR B CG2 1 +ATOM 1671 N N . GLN B 2 6 ? 33.063 -38.692 -18.171 1.00 66.85 ? 6 GLN B N 1 +ATOM 1672 C CA . GLN B 2 6 ? 34.280 -37.916 -18.372 1.00 56.00 ? 6 GLN B CA 1 +ATOM 1673 C C . GLN B 2 6 ? 33.931 -36.634 -19.120 1.00 51.10 ? 6 GLN B C 1 +ATOM 1674 O O . GLN B 2 6 ? 33.134 -36.672 -20.054 1.00 64.23 ? 6 GLN B O 1 +ATOM 1675 C CB . GLN B 2 6 ? 35.323 -38.727 -19.151 1.00 63.31 ? 6 GLN B CB 1 +ATOM 1676 C CG . GLN B 2 6 ? 36.758 -38.253 -18.929 1.00 82.02 ? 6 GLN B CG 1 +ATOM 1677 C CD . GLN B 2 6 ? 37.780 -38.884 -19.847 1.00 72.01 ? 6 GLN B CD 1 +ATOM 1678 O OE1 . GLN B 2 6 ? 38.128 -40.054 -19.717 1.00 63.39 ? 6 GLN B OE1 1 +ATOM 1679 N NE2 . GLN B 2 6 ? 38.303 -38.096 -20.771 1.00 54.49 ? 6 GLN B NE2 1 +ATOM 1680 N N . SER B 2 7 ? 34.534 -35.511 -18.699 1.00 50.82 ? 7 SER B N 1 +ATOM 1681 C CA . SER B 2 7 ? 34.205 -34.202 -19.246 1.00 55.50 ? 7 SER B CA 1 +ATOM 1682 C C . SER B 2 7 ? 35.416 -33.271 -19.184 1.00 56.48 ? 7 SER B C 1 +ATOM 1683 O O . SER B 2 7 ? 36.057 -33.206 -18.131 1.00 48.91 ? 7 SER B O 1 +ATOM 1684 C CB . SER B 2 7 ? 33.021 -33.600 -18.534 1.00 45.69 ? 7 SER B CB 1 +ATOM 1685 O OG . SER B 2 7 ? 32.551 -32.470 -19.247 1.00 55.58 ? 7 SER B OG 1 +ATOM 1686 N N . PRO B 2 8 ? 35.705 -32.537 -20.285 1.00 44.26 ? 8 PRO B N 1 +ATOM 1687 C CA . PRO B 2 8 ? 34.932 -32.497 -21.521 1.00 44.68 ? 8 PRO B CA 1 +ATOM 1688 C C . PRO B 2 8 ? 35.357 -33.569 -22.520 1.00 58.05 ? 8 PRO B C 1 +ATOM 1689 O O . PRO B 2 8 ? 36.318 -34.291 -22.257 1.00 56.23 ? 8 PRO B O 1 +ATOM 1690 C CB . PRO B 2 8 ? 35.264 -31.127 -22.127 1.00 44.90 ? 8 PRO B CB 1 +ATOM 1691 C CG . PRO B 2 8 ? 36.705 -30.927 -21.750 1.00 42.73 ? 8 PRO B CG 1 +ATOM 1692 C CD . PRO B 2 8 ? 36.822 -31.578 -20.389 1.00 44.62 ? 8 PRO B CD 1 +ATOM 1693 N N . LEU B 2 9 ? 34.629 -33.659 -23.649 1.00 58.27 ? 9 LEU B N 1 +ATOM 1694 C CA . LEU B 2 9 ? 35.010 -34.519 -24.762 1.00 61.08 ? 9 LEU B CA 1 +ATOM 1695 C C . LEU B 2 9 ? 36.160 -33.862 -25.515 1.00 52.70 ? 9 LEU B C 1 +ATOM 1696 O O . LEU B 2 9 ? 37.105 -34.536 -25.921 1.00 47.12 ? 9 LEU B O 1 +ATOM 1697 C CB . LEU B 2 9 ? 33.834 -34.761 -25.718 1.00 63.57 ? 9 LEU B CB 1 +ATOM 1698 C CG . LEU B 2 9 ? 32.497 -35.205 -25.117 1.00 81.54 ? 9 LEU B CG 1 +ATOM 1699 C CD1 . LEU B 2 9 ? 31.465 -35.388 -26.220 1.00 75.07 ? 9 LEU B CD1 1 +ATOM 1700 C CD2 . LEU B 2 9 ? 32.626 -36.486 -24.301 1.00 76.14 ? 9 LEU B CD2 1 +ATOM 1701 N N . SER B 2 10 ? 36.060 -32.538 -25.675 1.00 56.49 ? 10 SER B N 1 +ATOM 1702 C CA . SER B 2 10 ? 37.024 -31.764 -26.436 1.00 58.34 ? 10 SER B CA 1 +ATOM 1703 C C . SER B 2 10 ? 37.699 -30.740 -25.526 1.00 52.43 ? 10 SER B C 1 +ATOM 1704 O O . SER B 2 10 ? 37.026 -30.012 -24.795 1.00 78.90 ? 10 SER B O 1 +ATOM 1705 C CB . SER B 2 10 ? 36.345 -31.113 -27.617 1.00 62.22 ? 10 SER B CB 1 +ATOM 1706 O OG . SER B 2 10 ? 37.247 -30.922 -28.695 1.00 72.11 ? 10 SER B OG 1 +ATOM 1707 N N . LEU B 2 11 ? 39.035 -30.699 -25.588 1.00 53.52 ? 11 LEU B N 1 +ATOM 1708 C CA . LEU B 2 11 ? 39.832 -29.755 -24.822 1.00 55.18 ? 11 LEU B CA 1 +ATOM 1709 C C . LEU B 2 11 ? 40.881 -29.080 -25.710 1.00 55.62 ? 11 LEU B C 1 +ATOM 1710 O O . LEU B 2 11 ? 42.048 -29.482 -25.694 1.00 53.51 ? 11 LEU B O 1 +ATOM 1711 C CB . LEU B 2 11 ? 40.510 -30.511 -23.677 1.00 48.21 ? 11 LEU B CB 1 +ATOM 1712 C CG . LEU B 2 11 ? 40.792 -29.710 -22.404 1.00 51.38 ? 11 LEU B CG 1 +ATOM 1713 C CD1 . LEU B 2 11 ? 41.689 -30.513 -21.477 1.00 51.96 ? 11 LEU B CD1 1 +ATOM 1714 C CD2 . LEU B 2 11 ? 41.416 -28.349 -22.688 1.00 43.07 ? 11 LEU B CD2 1 +ATOM 1715 N N . PRO B 2 12 ? 40.523 -28.019 -26.477 1.00 53.15 ? 12 PRO B N 1 +ATOM 1716 C CA . PRO B 2 12 ? 41.518 -27.117 -27.055 1.00 59.87 ? 12 PRO B CA 1 +ATOM 1717 C C . PRO B 2 12 ? 42.133 -26.278 -25.938 1.00 62.40 ? 12 PRO B C 1 +ATOM 1718 O O . PRO B 2 12 ? 41.414 -25.769 -25.083 1.00 67.11 ? 12 PRO B O 1 +ATOM 1719 C CB . PRO B 2 12 ? 40.702 -26.201 -27.988 1.00 55.62 ? 12 PRO B CB 1 +ATOM 1720 C CG . PRO B 2 12 ? 39.369 -26.900 -28.165 1.00 50.18 ? 12 PRO B CG 1 +ATOM 1721 C CD . PRO B 2 12 ? 39.155 -27.635 -26.859 1.00 67.63 ? 12 PRO B CD 1 +ATOM 1722 N N . VAL B 2 13 ? 43.467 -26.184 -25.933 1.00 67.85 ? 13 VAL B N 1 +ATOM 1723 C CA . VAL B 2 13 ? 44.176 -25.239 -25.080 1.00 68.36 ? 13 VAL B CA 1 +ATOM 1724 C C . VAL B 2 13 ? 45.381 -24.674 -25.821 1.00 75.38 ? 13 VAL B C 1 +ATOM 1725 O O . VAL B 2 13 ? 45.619 -24.968 -26.991 1.00 58.56 ? 13 VAL B O 1 +ATOM 1726 C CB . VAL B 2 13 ? 44.615 -25.809 -23.715 1.00 63.68 ? 13 VAL B CB 1 +ATOM 1727 C CG1 . VAL B 2 13 ? 43.632 -25.480 -22.603 1.00 95.59 ? 13 VAL B CG1 1 +ATOM 1728 C CG2 . VAL B 2 13 ? 44.997 -27.283 -23.751 1.00 60.46 ? 13 VAL B CG2 1 +ATOM 1729 N N . THR B 2 14 ? 46.150 -23.882 -25.073 1.00 77.85 ? 14 THR B N 1 +ATOM 1730 C CA . THR B 2 14 ? 47.285 -23.144 -25.582 1.00 66.37 ? 14 THR B CA 1 +ATOM 1731 C C . THR B 2 14 ? 48.508 -23.553 -24.765 1.00 62.04 ? 14 THR B C 1 +ATOM 1732 O O . THR B 2 14 ? 48.399 -23.712 -23.552 1.00 74.08 ? 14 THR B O 1 +ATOM 1733 C CB . THR B 2 14 ? 46.900 -21.660 -25.652 1.00 61.83 ? 14 THR B CB 1 +ATOM 1734 O OG1 . THR B 2 14 ? 46.412 -21.472 -26.983 1.00 50.23 ? 14 THR B OG1 1 +ATOM 1735 C CG2 . THR B 2 14 ? 48.030 -20.702 -25.339 1.00 62.00 ? 14 THR B CG2 1 +ATOM 1736 N N . PRO B 2 15 ? 49.695 -23.760 -25.390 1.00 67.25 ? 15 PRO B N 1 +ATOM 1737 C CA . PRO B 2 15 ? 50.868 -24.246 -24.655 1.00 60.05 ? 15 PRO B CA 1 +ATOM 1738 C C . PRO B 2 15 ? 51.230 -23.295 -23.516 1.00 51.22 ? 15 PRO B C 1 +ATOM 1739 O O . PRO B 2 15 ? 51.148 -22.080 -23.676 1.00 55.32 ? 15 PRO B O 1 +ATOM 1740 C CB . PRO B 2 15 ? 51.987 -24.313 -25.704 1.00 62.76 ? 15 PRO B CB 1 +ATOM 1741 C CG . PRO B 2 15 ? 51.269 -24.286 -27.048 1.00 66.48 ? 15 PRO B CG 1 +ATOM 1742 C CD . PRO B 2 15 ? 49.976 -23.532 -26.820 1.00 58.79 ? 15 PRO B CD 1 +ATOM 1743 N N . GLY B 2 16 ? 51.559 -23.871 -22.352 1.00 58.47 ? 16 GLY B N 1 +ATOM 1744 C CA . GLY B 2 16 ? 51.931 -23.115 -21.167 1.00 52.92 ? 16 GLY B CA 1 +ATOM 1745 C C . GLY B 2 16 ? 50.753 -22.821 -20.236 1.00 62.83 ? 16 GLY B C 1 +ATOM 1746 O O . GLY B 2 16 ? 50.972 -22.525 -19.063 1.00 83.84 ? 16 GLY B O 1 +ATOM 1747 N N . GLU B 2 17 ? 49.519 -22.906 -20.760 1.00 54.31 ? 17 GLU B N 1 +ATOM 1748 C CA . GLU B 2 17 ? 48.299 -22.647 -20.002 1.00 69.39 ? 17 GLU B CA 1 +ATOM 1749 C C . GLU B 2 17 ? 47.894 -23.887 -19.193 1.00 79.65 ? 17 GLU B C 1 +ATOM 1750 O O . GLU B 2 17 ? 48.321 -24.998 -19.509 1.00 81.03 ? 17 GLU B O 1 +ATOM 1751 C CB . GLU B 2 17 ? 47.175 -22.178 -20.938 1.00 77.59 ? 17 GLU B CB 1 +ATOM 1752 C CG . GLU B 2 17 ? 47.461 -20.858 -21.646 1.00 109.17 ? 17 GLU B CG 1 +ATOM 1753 C CD . GLU B 2 17 ? 47.738 -19.647 -20.764 1.00 108.89 ? 17 GLU B CD 1 +ATOM 1754 O OE1 . GLU B 2 17 ? 46.898 -19.350 -19.892 1.00 112.69 ? 17 GLU B OE1 1 +ATOM 1755 O OE2 . GLU B 2 17 ? 48.797 -19.004 -20.949 1.00 86.01 ? 17 GLU B OE2 1 +ATOM 1756 N N . PRO B 2 18 ? 47.083 -23.751 -18.109 1.00 77.82 ? 18 PRO B N 1 +ATOM 1757 C CA . PRO B 2 18 ? 46.554 -24.915 -17.388 1.00 80.85 ? 18 PRO B CA 1 +ATOM 1758 C C . PRO B 2 18 ? 45.349 -25.584 -18.058 1.00 77.98 ? 18 PRO B C 1 +ATOM 1759 O O . PRO B 2 18 ? 44.655 -24.953 -18.856 1.00 70.07 ? 18 PRO B O 1 +ATOM 1760 C CB . PRO B 2 18 ? 46.189 -24.327 -16.016 1.00 77.98 ? 18 PRO B CB 1 +ATOM 1761 C CG . PRO B 2 18 ? 45.796 -22.898 -16.321 1.00 83.18 ? 18 PRO B CG 1 +ATOM 1762 C CD . PRO B 2 18 ? 46.690 -22.481 -17.470 1.00 75.08 ? 18 PRO B CD 1 +ATOM 1763 N N . ALA B 2 19 ? 45.116 -26.865 -17.712 1.00 71.00 ? 19 ALA B N 1 +ATOM 1764 C CA . ALA B 2 19 ? 44.083 -27.700 -18.316 1.00 60.31 ? 19 ALA B CA 1 +ATOM 1765 C C . ALA B 2 19 ? 43.520 -28.712 -17.316 1.00 61.10 ? 19 ALA B C 1 +ATOM 1766 O O . ALA B 2 19 ? 44.222 -29.202 -16.424 1.00 57.62 ? 19 ALA B O 1 +ATOM 1767 C CB . ALA B 2 19 ? 44.623 -28.386 -19.549 1.00 66.01 ? 19 ALA B CB 1 +ATOM 1768 N N . SER B 2 20 ? 42.236 -29.043 -17.509 1.00 61.03 ? 20 SER B N 1 +ATOM 1769 C CA . SER B 2 20 ? 41.469 -29.783 -16.521 1.00 59.06 ? 20 SER B CA 1 +ATOM 1770 C C . SER B 2 20 ? 40.518 -30.767 -17.195 1.00 51.32 ? 20 SER B C 1 +ATOM 1771 O O . SER B 2 20 ? 39.883 -30.422 -18.192 1.00 48.11 ? 20 SER B O 1 +ATOM 1772 C CB . SER B 2 20 ? 40.713 -28.839 -15.633 1.00 45.85 ? 20 SER B CB 1 +ATOM 1773 O OG . SER B 2 20 ? 40.645 -29.366 -14.326 1.00 73.56 ? 20 SER B OG 1 +ATOM 1774 N N . ILE B 2 21 ? 40.427 -31.978 -16.620 1.00 40.20 ? 21 ILE B N 1 +ATOM 1775 C CA . ILE B 2 21 ? 39.471 -32.989 -17.043 1.00 45.86 ? 21 ILE B CA 1 +ATOM 1776 C C . ILE B 2 21 ? 38.764 -33.519 -15.801 1.00 44.29 ? 21 ILE B C 1 +ATOM 1777 O O . ILE B 2 21 ? 39.425 -33.934 -14.855 1.00 46.87 ? 21 ILE B O 1 +ATOM 1778 C CB . ILE B 2 21 ? 40.154 -34.102 -17.877 1.00 48.79 ? 21 ILE B CB 1 +ATOM 1779 C CG1 . ILE B 2 21 ? 40.432 -33.638 -19.308 1.00 46.44 ? 21 ILE B CG1 1 +ATOM 1780 C CG2 . ILE B 2 21 ? 39.347 -35.392 -17.887 1.00 43.86 ? 21 ILE B CG2 1 +ATOM 1781 C CD1 . ILE B 2 21 ? 41.654 -34.278 -19.926 1.00 46.13 ? 21 ILE B CD1 1 +ATOM 1782 N N . SER B 2 22 ? 37.423 -33.479 -15.831 1.00 47.67 ? 22 SER B N 1 +ATOM 1783 C CA . SER B 2 22 ? 36.566 -34.003 -14.778 1.00 37.00 ? 22 SER B CA 1 +ATOM 1784 C C . SER B 2 22 ? 36.127 -35.428 -15.110 1.00 53.16 ? 22 SER B C 1 +ATOM 1785 O O . SER B 2 22 ? 36.086 -35.818 -16.275 1.00 52.75 ? 22 SER B O 1 +ATOM 1786 C CB . SER B 2 22 ? 35.372 -33.102 -14.546 1.00 38.02 ? 22 SER B CB 1 +ATOM 1787 O OG . SER B 2 22 ? 34.256 -33.824 -14.017 1.00 41.21 ? 22 SER B OG 1 +ATOM 1788 N N . CYS B 2 23 ? 35.755 -36.162 -14.052 1.00 60.07 ? 23 CYS B N 1 +ATOM 1789 C CA . CYS B 2 23 ? 35.339 -37.550 -14.104 1.00 50.71 ? 23 CYS B CA 1 +ATOM 1790 C C . CYS B 2 23 ? 34.396 -37.845 -12.936 1.00 56.08 ? 23 CYS B C 1 +ATOM 1791 O O . CYS B 2 23 ? 34.789 -37.762 -11.772 1.00 67.16 ? 23 CYS B O 1 +ATOM 1792 C CB . CYS B 2 23 ? 36.564 -38.451 -14.019 1.00 60.10 ? 23 CYS B CB 1 +ATOM 1793 S SG . CYS B 2 23 ? 36.177 -40.212 -14.187 1.00 59.33 ? 23 CYS B SG 1 +ATOM 1794 N N . ARG B 2 24 ? 33.151 -38.207 -13.270 1.00 64.19 ? 24 ARG B N 1 +ATOM 1795 C CA . ARG B 2 24 ? 32.118 -38.493 -12.286 1.00 44.57 ? 24 ARG B CA 1 +ATOM 1796 C C . ARG B 2 24 ? 31.611 -39.927 -12.468 1.00 50.58 ? 24 ARG B C 1 +ATOM 1797 O O . ARG B 2 24 ? 30.964 -40.246 -13.469 1.00 56.86 ? 24 ARG B O 1 +ATOM 1798 C CB . ARG B 2 24 ? 30.962 -37.493 -12.410 1.00 41.16 ? 24 ARG B CB 1 +ATOM 1799 C CG . ARG B 2 24 ? 31.304 -36.029 -12.157 1.00 47.61 ? 24 ARG B CG 1 +ATOM 1800 C CD . ARG B 2 24 ? 31.734 -35.594 -10.765 1.00 68.64 ? 24 ARG B CD 1 +ATOM 1801 N NE . ARG B 2 24 ? 31.085 -36.244 -9.628 1.00 83.79 ? 24 ARG B NE 1 +ATOM 1802 C CZ . ARG B 2 24 ? 29.909 -35.896 -9.110 1.00 68.82 ? 24 ARG B CZ 1 +ATOM 1803 N NH1 . ARG B 2 24 ? 29.316 -36.687 -8.234 1.00 46.59 ? 24 ARG B NH1 1 +ATOM 1804 N NH2 . ARG B 2 24 ? 29.313 -34.778 -9.487 1.00 80.41 ? 24 ARG B NH2 1 +ATOM 1805 N N . SER B 2 25 ? 31.907 -40.779 -11.477 1.00 43.45 ? 25 SER B N 1 +ATOM 1806 C CA . SER B 2 25 ? 31.398 -42.143 -11.401 1.00 50.62 ? 25 SER B CA 1 +ATOM 1807 C C . SER B 2 25 ? 29.989 -42.187 -10.793 1.00 46.67 ? 25 SER B C 1 +ATOM 1808 O O . SER B 2 25 ? 29.593 -41.299 -10.039 1.00 46.84 ? 25 SER B O 1 +ATOM 1809 C CB . SER B 2 25 ? 32.353 -43.013 -10.630 1.00 48.05 ? 25 SER B CB 1 +ATOM 1810 O OG . SER B 2 25 ? 32.266 -42.734 -9.238 1.00 48.03 ? 25 SER B OG 1 +ATOM 1811 N N . SER B 2 26 ? 29.249 -43.261 -11.094 1.00 44.27 ? 26 SER B N 1 +ATOM 1812 C CA . SER B 2 26 ? 27.868 -43.401 -10.657 1.00 45.13 ? 26 SER B CA 1 +ATOM 1813 C C . SER B 2 26 ? 27.794 -43.975 -9.242 1.00 57.30 ? 26 SER B C 1 +ATOM 1814 O O . SER B 2 26 ? 26.704 -44.057 -8.683 1.00 63.71 ? 26 SER B O 1 +ATOM 1815 C CB . SER B 2 26 ? 27.053 -44.218 -11.629 1.00 39.54 ? 26 SER B CB 1 +ATOM 1816 O OG . SER B 2 26 ? 27.407 -45.588 -11.556 1.00 49.53 ? 26 SER B OG 1 +ATOM 1817 N N . GLN B 2 27 ? 28.947 -44.376 -8.680 1.00 61.95 ? 27 GLN B N 1 +ATOM 1818 C CA . GLN B 2 27 ? 29.062 -44.793 -7.286 1.00 61.51 ? 27 GLN B CA 1 +ATOM 1819 C C . GLN B 2 27 ? 30.456 -44.485 -6.761 1.00 61.18 ? 27 GLN B C 1 +ATOM 1820 O O . GLN B 2 27 ? 31.368 -44.215 -7.542 1.00 65.75 ? 27 GLN B O 1 +ATOM 1821 C CB . GLN B 2 27 ? 29.021 -46.310 -7.129 1.00 65.57 ? 27 GLN B CB 1 +ATOM 1822 C CG . GLN B 2 27 ? 27.646 -46.927 -7.254 1.00 74.61 ? 27 GLN B CG 1 +ATOM 1823 C CD . GLN B 2 27 ? 27.846 -48.187 -8.050 1.00 70.94 ? 27 GLN B CD 1 +ATOM 1824 O OE1 . GLN B 2 27 ? 27.439 -48.269 -9.208 1.00 75.89 ? 27 GLN B OE1 1 +ATOM 1825 N NE2 . GLN B 2 27 ? 28.540 -49.144 -7.450 1.00 51.30 ? 27 GLN B NE2 1 +ATOM 1826 N N . SER B 2 28 ? 30.601 -44.591 -5.432 1.00 57.82 ? 28 SER B N 1 +ATOM 1827 C CA . SER B 2 28 ? 31.864 -44.368 -4.751 1.00 56.55 ? 28 SER B CA 1 +ATOM 1828 C C . SER B 2 28 ? 32.856 -45.458 -5.133 1.00 56.45 ? 28 SER B C 1 +ATOM 1829 O O . SER B 2 28 ? 32.505 -46.637 -5.151 1.00 55.70 ? 28 SER B O 1 +ATOM 1830 C CB . SER B 2 28 ? 31.683 -44.295 -3.263 1.00 53.98 ? 28 SER B CB 1 +ATOM 1831 O OG . SER B 2 28 ? 32.948 -44.276 -2.614 1.00 73.55 ? 28 SER B OG 1 +ATOM 1832 N N . LEU B 2 29 ? 34.087 -45.026 -5.428 1.00 56.88 ? 29 LEU B N 1 +ATOM 1833 C CA . LEU B 2 29 ? 35.187 -45.910 -5.784 1.00 62.81 ? 29 LEU B CA 1 +ATOM 1834 C C . LEU B 2 29 ? 36.214 -45.950 -4.657 1.00 64.80 ? 29 LEU B C 1 +ATOM 1835 O O . LEU B 2 29 ? 37.316 -46.462 -4.855 1.00 50.69 ? 29 LEU B O 1 +ATOM 1836 C CB . LEU B 2 29 ? 35.851 -45.420 -7.074 1.00 43.87 ? 29 LEU B CB 1 +ATOM 1837 C CG . LEU B 2 29 ? 34.907 -45.066 -8.210 1.00 40.87 ? 29 LEU B CG 1 +ATOM 1838 C CD1 . LEU B 2 29 ? 35.641 -44.247 -9.253 1.00 49.28 ? 29 LEU B CD1 1 +ATOM 1839 C CD2 . LEU B 2 29 ? 34.303 -46.321 -8.820 1.00 59.15 ? 29 LEU B CD2 1 +ATOM 1840 N N . LEU B 2 30 ? 35.861 -45.385 -3.494 1.00 56.05 ? 30 LEU B N 1 +ATOM 1841 C CA . LEU B 2 30 ? 36.709 -45.517 -2.322 1.00 60.41 ? 30 LEU B CA 1 +ATOM 1842 C C . LEU B 2 30 ? 36.428 -46.876 -1.683 1.00 53.53 ? 30 LEU B C 1 +ATOM 1843 O O . LEU B 2 30 ? 35.274 -47.268 -1.533 1.00 63.12 ? 30 LEU B O 1 +ATOM 1844 C CB . LEU B 2 30 ? 36.420 -44.350 -1.371 1.00 64.30 ? 30 LEU B CB 1 +ATOM 1845 C CG . LEU B 2 30 ? 37.218 -44.316 -0.066 1.00 75.30 ? 30 LEU B CG 1 +ATOM 1846 C CD1 . LEU B 2 30 ? 37.522 -42.885 0.350 1.00 59.03 ? 30 LEU B CD1 1 +ATOM 1847 C CD2 . LEU B 2 30 ? 36.493 -45.053 1.056 1.00 80.45 ? 30 LEU B CD2 1 +ATOM 1848 N N . TYR B 2 31 ? 37.495 -47.601 -1.343 1.00 56.22 ? 31 TYR B N 1 +ATOM 1849 C CA . TYR B 2 31 ? 37.376 -48.849 -0.604 1.00 56.78 ? 31 TYR B CA 1 +ATOM 1850 C C . TYR B 2 31 ? 37.567 -48.553 0.882 1.00 55.29 ? 31 TYR B C 1 +ATOM 1851 O O . TYR B 2 31 ? 36.668 -48.781 1.683 1.00 82.59 ? 31 TYR B O 1 +ATOM 1852 C CB . TYR B 2 31 ? 38.364 -49.895 -1.143 1.00 43.86 ? 31 TYR B CB 1 +ATOM 1853 C CG . TYR B 2 31 ? 38.474 -51.144 -0.305 1.00 36.69 ? 31 TYR B CG 1 +ATOM 1854 C CD1 . TYR B 2 31 ? 37.538 -52.165 -0.410 1.00 38.85 ? 31 TYR B CD1 1 +ATOM 1855 C CD2 . TYR B 2 31 ? 39.502 -51.298 0.615 1.00 45.27 ? 31 TYR B CD2 1 +ATOM 1856 C CE1 . TYR B 2 31 ? 37.622 -53.308 0.371 1.00 33.08 ? 31 TYR B CE1 1 +ATOM 1857 C CE2 . TYR B 2 31 ? 39.592 -52.426 1.418 1.00 42.84 ? 31 TYR B CE2 1 +ATOM 1858 C CZ . TYR B 2 31 ? 38.648 -53.434 1.294 1.00 37.94 ? 31 TYR B CZ 1 +ATOM 1859 O OH . TYR B 2 31 ? 38.743 -54.552 2.068 1.00 45.22 ? 31 TYR B OH 1 +ATOM 1860 N N . SER B 2 32 ? 38.767 -48.058 1.212 1.00 50.07 ? 32 SER B N 1 +ATOM 1861 C CA . SER B 2 32 ? 39.191 -47.621 2.529 1.00 53.37 ? 32 SER B CA 1 +ATOM 1862 C C . SER B 2 32 ? 39.662 -46.168 2.416 1.00 64.70 ? 32 SER B C 1 +ATOM 1863 O O . SER B 2 32 ? 39.710 -45.625 1.314 1.00 78.78 ? 32 SER B O 1 +ATOM 1864 C CB . SER B 2 32 ? 40.280 -48.548 3.023 1.00 48.63 ? 32 SER B CB 1 +ATOM 1865 O OG . SER B 2 32 ? 41.254 -47.859 3.798 1.00 60.66 ? 32 SER B OG 1 +ATOM 1866 N N . ILE B 2 33 ? 40.010 -45.534 3.542 1.00 52.44 ? 33 ILE B N 1 +ATOM 1867 C CA . ILE B 2 33 ? 40.544 -44.179 3.496 1.00 53.18 ? 33 ILE B CA 1 +ATOM 1868 C C . ILE B 2 33 ? 41.912 -44.214 2.811 1.00 55.68 ? 33 ILE B C 1 +ATOM 1869 O O . ILE B 2 33 ? 42.734 -45.087 3.098 1.00 52.53 ? 33 ILE B O 1 +ATOM 1870 C CB . ILE B 2 33 ? 40.539 -43.521 4.898 1.00 50.11 ? 33 ILE B CB 1 +ATOM 1871 C CG1 . ILE B 2 33 ? 39.186 -42.878 5.216 1.00 47.93 ? 33 ILE B CG1 1 +ATOM 1872 C CG2 . ILE B 2 33 ? 41.656 -42.504 5.058 1.00 47.87 ? 33 ILE B CG2 1 +ATOM 1873 C CD1 . ILE B 2 33 ? 38.047 -43.849 5.450 1.00 42.22 ? 33 ILE B CD1 1 +ATOM 1874 N N . GLY B 2 34 ? 42.107 -43.299 1.850 1.00 48.60 ? 34 GLY B N 1 +ATOM 1875 C CA . GLY B 2 34 ? 43.325 -43.233 1.056 1.00 49.09 ? 34 GLY B CA 1 +ATOM 1876 C C . GLY B 2 34 ? 43.289 -44.086 -0.215 1.00 54.60 ? 34 GLY B C 1 +ATOM 1877 O O . GLY B 2 34 ? 44.171 -43.959 -1.061 1.00 61.27 ? 34 GLY B O 1 +ATOM 1878 N N . TYR B 2 35 ? 42.270 -44.946 -0.356 1.00 56.44 ? 35 TYR B N 1 +ATOM 1879 C CA . TYR B 2 35 ? 42.217 -45.923 -1.433 1.00 42.75 ? 35 TYR B CA 1 +ATOM 1880 C C . TYR B 2 35 ? 40.949 -45.737 -2.265 1.00 52.97 ? 35 TYR B C 1 +ATOM 1881 O O . TYR B 2 35 ? 39.962 -46.451 -2.073 1.00 49.58 ? 35 TYR B O 1 +ATOM 1882 C CB . TYR B 2 35 ? 42.344 -47.348 -0.888 1.00 45.33 ? 35 TYR B CB 1 +ATOM 1883 C CG . TYR B 2 35 ? 43.676 -47.683 -0.264 1.00 61.64 ? 35 TYR B CG 1 +ATOM 1884 C CD1 . TYR B 2 35 ? 44.776 -48.020 -1.042 1.00 67.64 ? 35 TYR B CD1 1 +ATOM 1885 C CD2 . TYR B 2 35 ? 43.839 -47.673 1.115 1.00 66.73 ? 35 TYR B CD2 1 +ATOM 1886 C CE1 . TYR B 2 35 ? 46.004 -48.322 -0.465 1.00 79.32 ? 35 TYR B CE1 1 +ATOM 1887 C CE2 . TYR B 2 35 ? 45.057 -47.972 1.707 1.00 58.05 ? 35 TYR B CE2 1 +ATOM 1888 C CZ . TYR B 2 35 ? 46.143 -48.298 0.914 1.00 69.40 ? 35 TYR B CZ 1 +ATOM 1889 O OH . TYR B 2 35 ? 47.335 -48.594 1.501 1.00 74.11 ? 35 TYR B OH 1 +ATOM 1890 N N . ASN B 2 36 ? 40.997 -44.755 -3.178 1.00 52.74 ? 36 ASN B N 1 +ATOM 1891 C CA . ASN B 2 36 ? 40.059 -44.656 -4.285 1.00 54.54 ? 36 ASN B CA 1 +ATOM 1892 C C . ASN B 2 36 ? 40.635 -45.411 -5.480 1.00 59.14 ? 36 ASN B C 1 +ATOM 1893 O O . ASN B 2 36 ? 41.819 -45.286 -5.770 1.00 83.94 ? 36 ASN B O 1 +ATOM 1894 C CB . ASN B 2 36 ? 39.781 -43.207 -4.698 1.00 61.87 ? 36 ASN B CB 1 +ATOM 1895 C CG . ASN B 2 36 ? 39.239 -42.337 -3.583 1.00 68.81 ? 36 ASN B CG 1 +ATOM 1896 O OD1 . ASN B 2 36 ? 38.025 -42.154 -3.449 1.00 54.76 ? 36 ASN B OD1 1 +ATOM 1897 N ND2 . ASN B 2 36 ? 40.140 -41.785 -2.788 1.00 74.26 ? 36 ASN B ND2 1 +ATOM 1898 N N . TYR B 2 37 ? 39.782 -46.162 -6.188 1.00 72.83 ? 37 TYR B N 1 +ATOM 1899 C CA . TYR B 2 37 ? 40.193 -46.929 -7.356 1.00 65.50 ? 37 TYR B CA 1 +ATOM 1900 C C . TYR B 2 37 ? 39.767 -46.215 -8.639 1.00 63.54 ? 37 TYR B C 1 +ATOM 1901 O O . TYR B 2 37 ? 38.812 -46.621 -9.299 1.00 76.13 ? 37 TYR B O 1 +ATOM 1902 C CB . TYR B 2 37 ? 39.759 -48.393 -7.220 1.00 60.35 ? 37 TYR B CB 1 +ATOM 1903 C CG . TYR B 2 37 ? 40.615 -49.172 -6.250 1.00 58.61 ? 37 TYR B CG 1 +ATOM 1904 C CD1 . TYR B 2 37 ? 41.763 -49.820 -6.683 1.00 62.62 ? 37 TYR B CD1 1 +ATOM 1905 C CD2 . TYR B 2 37 ? 40.308 -49.236 -4.896 1.00 46.32 ? 37 TYR B CD2 1 +ATOM 1906 C CE1 . TYR B 2 37 ? 42.583 -50.515 -5.809 1.00 50.28 ? 37 TYR B CE1 1 +ATOM 1907 C CE2 . TYR B 2 37 ? 41.113 -49.935 -4.007 1.00 48.28 ? 37 TYR B CE2 1 +ATOM 1908 C CZ . TYR B 2 37 ? 42.256 -50.571 -4.466 1.00 54.51 ? 37 TYR B CZ 1 +ATOM 1909 O OH . TYR B 2 37 ? 43.067 -51.266 -3.622 1.00 63.84 ? 37 TYR B OH 1 +ATOM 1910 N N . LEU B 2 38 ? 40.512 -45.152 -8.974 1.00 69.95 ? 38 LEU B N 1 +ATOM 1911 C CA . LEU B 2 38 ? 40.338 -44.378 -10.196 1.00 61.03 ? 38 LEU B CA 1 +ATOM 1912 C C . LEU B 2 38 ? 41.704 -44.116 -10.825 1.00 61.23 ? 38 LEU B C 1 +ATOM 1913 O O . LEU B 2 38 ? 42.646 -43.716 -10.142 1.00 70.64 ? 38 LEU B O 1 +ATOM 1914 C CB . LEU B 2 38 ? 39.638 -43.057 -9.856 1.00 52.71 ? 38 LEU B CB 1 +ATOM 1915 C CG . LEU B 2 38 ? 38.902 -42.357 -10.998 1.00 50.87 ? 38 LEU B CG 1 +ATOM 1916 C CD1 . LEU B 2 38 ? 39.781 -41.329 -11.692 1.00 48.15 ? 38 LEU B CD1 1 +ATOM 1917 C CD2 . LEU B 2 38 ? 38.354 -43.361 -11.988 1.00 40.74 ? 38 LEU B CD2 1 +ATOM 1918 N N . ASP B 2 39 ? 41.788 -44.347 -12.138 1.00 68.69 ? 39 ASP B N 1 +ATOM 1919 C CA . ASP B 2 39 ? 43.039 -44.292 -12.879 1.00 53.88 ? 39 ASP B CA 1 +ATOM 1920 C C . ASP B 2 39 ? 42.905 -43.320 -14.040 1.00 45.50 ? 39 ASP B C 1 +ATOM 1921 O O . ASP B 2 39 ? 41.796 -43.097 -14.527 1.00 49.33 ? 39 ASP B O 1 +ATOM 1922 C CB . ASP B 2 39 ? 43.404 -45.667 -13.437 1.00 59.29 ? 39 ASP B CB 1 +ATOM 1923 C CG . ASP B 2 39 ? 43.890 -46.642 -12.382 1.00 59.58 ? 39 ASP B CG 1 +ATOM 1924 O OD1 . ASP B 2 39 ? 43.675 -46.375 -11.180 1.00 83.79 ? 39 ASP B OD1 1 +ATOM 1925 O OD2 . ASP B 2 39 ? 44.494 -47.651 -12.771 1.00 58.97 ? 39 ASP B OD2 1 +ATOM 1926 N N . TRP B 2 40 ? 44.048 -42.771 -14.474 1.00 54.41 ? 40 TRP B N 1 +ATOM 1927 C CA . TRP B 2 40 ? 44.117 -41.926 -15.659 1.00 64.10 ? 40 TRP B CA 1 +ATOM 1928 C C . TRP B 2 40 ? 45.118 -42.505 -16.660 1.00 56.92 ? 40 TRP B C 1 +ATOM 1929 O O . TRP B 2 40 ? 46.235 -42.856 -16.284 1.00 70.50 ? 40 TRP B O 1 +ATOM 1930 C CB . TRP B 2 40 ? 44.488 -40.487 -15.281 1.00 67.67 ? 40 TRP B CB 1 +ATOM 1931 C CG . TRP B 2 40 ? 43.430 -39.738 -14.531 1.00 59.61 ? 40 TRP B CG 1 +ATOM 1932 C CD1 . TRP B 2 40 ? 43.423 -39.429 -13.201 1.00 53.88 ? 40 TRP B CD1 1 +ATOM 1933 C CD2 . TRP B 2 40 ? 42.227 -39.177 -15.079 1.00 65.60 ? 40 TRP B CD2 1 +ATOM 1934 N NE1 . TRP B 2 40 ? 42.297 -38.717 -12.881 1.00 60.85 ? 40 TRP B NE1 1 +ATOM 1935 C CE2 . TRP B 2 40 ? 41.543 -38.550 -14.012 1.00 60.79 ? 40 TRP B CE2 1 +ATOM 1936 C CE3 . TRP B 2 40 ? 41.662 -39.144 -16.361 1.00 68.02 ? 40 TRP B CE3 1 +ATOM 1937 C CZ2 . TRP B 2 40 ? 40.322 -37.900 -14.196 1.00 55.90 ? 40 TRP B CZ2 1 +ATOM 1938 C CZ3 . TRP B 2 40 ? 40.457 -38.498 -16.543 1.00 65.27 ? 40 TRP B CZ3 1 +ATOM 1939 C CH2 . TRP B 2 40 ? 39.797 -37.890 -15.471 1.00 69.10 ? 40 TRP B CH2 1 +ATOM 1940 N N . TYR B 2 41 ? 44.695 -42.585 -17.929 1.00 43.55 ? 41 TYR B N 1 +ATOM 1941 C CA . TYR B 2 41 ? 45.499 -43.074 -19.041 1.00 43.61 ? 41 TYR B CA 1 +ATOM 1942 C C . TYR B 2 41 ? 45.558 -42.010 -20.135 1.00 47.56 ? 41 TYR B C 1 +ATOM 1943 O O . TYR B 2 41 ? 44.598 -41.255 -20.301 1.00 46.71 ? 41 TYR B O 1 +ATOM 1944 C CB . TYR B 2 41 ? 44.915 -44.389 -19.580 1.00 38.29 ? 41 TYR B CB 1 +ATOM 1945 C CG . TYR B 2 41 ? 44.926 -45.519 -18.579 1.00 42.28 ? 41 TYR B CG 1 +ATOM 1946 C CD1 . TYR B 2 41 ? 46.080 -46.251 -18.351 1.00 35.39 ? 41 TYR B CD1 1 +ATOM 1947 C CD2 . TYR B 2 41 ? 43.807 -45.827 -17.812 1.00 49.44 ? 41 TYR B CD2 1 +ATOM 1948 C CE1 . TYR B 2 41 ? 46.119 -47.282 -17.427 1.00 42.69 ? 41 TYR B CE1 1 +ATOM 1949 C CE2 . TYR B 2 41 ? 43.829 -46.850 -16.871 1.00 45.84 ? 41 TYR B CE2 1 +ATOM 1950 C CZ . TYR B 2 41 ? 44.992 -47.583 -16.680 1.00 47.06 ? 41 TYR B CZ 1 +ATOM 1951 O OH . TYR B 2 41 ? 45.058 -48.596 -15.764 1.00 52.36 ? 41 TYR B OH 1 +ATOM 1952 N N . LEU B 2 42 ? 46.685 -41.959 -20.871 1.00 50.08 ? 42 LEU B N 1 +ATOM 1953 C CA . LEU B 2 42 ? 46.768 -41.230 -22.136 1.00 49.44 ? 42 LEU B CA 1 +ATOM 1954 C C . LEU B 2 42 ? 47.072 -42.192 -23.286 1.00 49.02 ? 42 LEU B C 1 +ATOM 1955 O O . LEU B 2 42 ? 47.838 -43.139 -23.118 1.00 57.11 ? 42 LEU B O 1 +ATOM 1956 C CB . LEU B 2 42 ? 47.824 -40.120 -22.049 1.00 49.46 ? 42 LEU B CB 1 +ATOM 1957 C CG . LEU B 2 42 ? 48.294 -39.511 -23.375 1.00 57.57 ? 42 LEU B CG 1 +ATOM 1958 C CD1 . LEU B 2 42 ? 47.195 -38.726 -24.073 1.00 59.03 ? 42 LEU B CD1 1 +ATOM 1959 C CD2 . LEU B 2 42 ? 49.520 -38.637 -23.176 1.00 69.85 ? 42 LEU B CD2 1 +ATOM 1960 N N . GLN B 2 43 ? 46.484 -41.916 -24.456 1.00 45.94 ? 43 GLN B N 1 +ATOM 1961 C CA . GLN B 2 43 ? 46.819 -42.636 -25.674 1.00 53.44 ? 43 GLN B CA 1 +ATOM 1962 C C . GLN B 2 43 ? 47.108 -41.665 -26.823 1.00 58.19 ? 43 GLN B C 1 +ATOM 1963 O O . GLN B 2 43 ? 46.213 -40.961 -27.307 1.00 40.84 ? 43 GLN B O 1 +ATOM 1964 C CB . GLN B 2 43 ? 45.721 -43.647 -26.000 1.00 60.82 ? 43 GLN B CB 1 +ATOM 1965 C CG . GLN B 2 43 ? 46.214 -44.838 -26.807 1.00 73.37 ? 43 GLN B CG 1 +ATOM 1966 C CD . GLN B 2 43 ? 45.103 -45.767 -27.234 1.00 85.12 ? 43 GLN B CD 1 +ATOM 1967 O OE1 . GLN B 2 43 ? 43.920 -45.457 -27.110 1.00 65.96 ? 43 GLN B OE1 1 +ATOM 1968 N NE2 . GLN B 2 43 ? 45.481 -46.924 -27.755 1.00 95.89 ? 43 GLN B NE2 1 +ATOM 1969 N N . LYS B 2 44 ? 48.384 -41.632 -27.243 1.00 63.51 ? 44 LYS B N 1 +ATOM 1970 C CA . LYS B 2 44 ? 48.792 -41.036 -28.508 1.00 56.37 ? 44 LYS B CA 1 +ATOM 1971 C C . LYS B 2 44 ? 48.398 -42.004 -29.619 1.00 65.98 ? 44 LYS B C 1 +ATOM 1972 O O . LYS B 2 44 ? 48.737 -43.184 -29.548 1.00 73.27 ? 44 LYS B O 1 +ATOM 1973 C CB . LYS B 2 44 ? 50.306 -40.808 -28.524 1.00 57.65 ? 44 LYS B CB 1 +ATOM 1974 C CG . LYS B 2 44 ? 50.812 -39.531 -27.863 1.00 70.59 ? 44 LYS B CG 1 +ATOM 1975 C CD . LYS B 2 44 ? 52.138 -39.747 -27.159 1.00 72.75 ? 44 LYS B CD 1 +ATOM 1976 C CE . LYS B 2 44 ? 53.039 -38.532 -27.160 1.00 80.66 ? 44 LYS B CE 1 +ATOM 1977 N NZ . LYS B 2 44 ? 54.411 -38.872 -26.709 1.00 75.94 ? 44 LYS B NZ 1 +ATOM 1978 N N . SER B 2 45 ? 47.665 -41.504 -30.622 1.00 75.70 ? 45 SER B N 1 +ATOM 1979 C CA . SER B 2 45 ? 47.110 -42.347 -31.673 1.00 90.35 ? 45 SER B CA 1 +ATOM 1980 C C . SER B 2 45 ? 48.220 -43.113 -32.394 1.00 89.91 ? 45 SER B C 1 +ATOM 1981 O O . SER B 2 45 ? 49.245 -42.538 -32.769 1.00 67.21 ? 45 SER B O 1 +ATOM 1982 C CB . SER B 2 45 ? 46.260 -41.557 -32.627 1.00 89.28 ? 45 SER B CB 1 +ATOM 1983 O OG . SER B 2 45 ? 47.034 -40.555 -33.261 1.00 121.83 ? 45 SER B OG 1 +ATOM 1984 N N . GLY B 2 46 ? 47.996 -44.426 -32.546 1.00 68.09 ? 46 GLY B N 1 +ATOM 1985 C CA . GLY B 2 46 ? 48.980 -45.355 -33.072 1.00 55.13 ? 46 GLY B CA 1 +ATOM 1986 C C . GLY B 2 46 ? 49.710 -46.111 -31.964 1.00 73.27 ? 46 GLY B C 1 +ATOM 1987 O O . GLY B 2 46 ? 50.248 -47.188 -32.209 1.00 80.89 ? 46 GLY B O 1 +ATOM 1988 N N . GLN B 2 47 ? 49.714 -45.542 -30.749 1.00 71.27 ? 47 GLN B N 1 +ATOM 1989 C CA . GLN B 2 47 ? 50.419 -46.116 -29.611 1.00 57.22 ? 47 GLN B CA 1 +ATOM 1990 C C . GLN B 2 47 ? 49.449 -46.845 -28.678 1.00 57.45 ? 47 GLN B C 1 +ATOM 1991 O O . GLN B 2 47 ? 48.232 -46.664 -28.762 1.00 47.37 ? 47 GLN B O 1 +ATOM 1992 C CB . GLN B 2 47 ? 51.212 -45.038 -28.868 1.00 65.62 ? 47 GLN B CB 1 +ATOM 1993 C CG . GLN B 2 47 ? 52.260 -44.332 -29.720 1.00 73.78 ? 47 GLN B CG 1 +ATOM 1994 C CD . GLN B 2 47 ? 53.321 -43.636 -28.901 1.00 90.79 ? 47 GLN B CD 1 +ATOM 1995 O OE1 . GLN B 2 47 ? 53.039 -42.916 -27.942 1.00 89.60 ? 47 GLN B OE1 1 +ATOM 1996 N NE2 . GLN B 2 47 ? 54.569 -43.842 -29.290 1.00 116.92 ? 47 GLN B NE2 1 +ATOM 1997 N N . SER B 2 48 ? 50.023 -47.684 -27.800 1.00 54.82 ? 48 SER B N 1 +ATOM 1998 C CA . SER B 2 48 ? 49.322 -48.361 -26.719 1.00 54.54 ? 48 SER B CA 1 +ATOM 1999 C C . SER B 2 48 ? 49.042 -47.390 -25.576 1.00 66.00 ? 48 SER B C 1 +ATOM 2000 O O . SER B 2 48 ? 49.857 -46.510 -25.305 1.00 71.34 ? 48 SER B O 1 +ATOM 2001 C CB . SER B 2 48 ? 50.120 -49.528 -26.225 1.00 45.23 ? 48 SER B CB 1 +ATOM 2002 O OG . SER B 2 48 ? 50.248 -50.495 -27.256 1.00 71.38 ? 48 SER B OG 1 +ATOM 2003 N N . PRO B 2 49 ? 47.904 -47.533 -24.852 1.00 60.77 ? 49 PRO B N 1 +ATOM 2004 C CA . PRO B 2 49 ? 47.598 -46.668 -23.714 1.00 53.24 ? 49 PRO B CA 1 +ATOM 2005 C C . PRO B 2 49 ? 48.690 -46.754 -22.651 1.00 58.56 ? 49 PRO B C 1 +ATOM 2006 O O . PRO B 2 49 ? 49.352 -47.785 -22.515 1.00 53.69 ? 49 PRO B O 1 +ATOM 2007 C CB . PRO B 2 49 ? 46.329 -47.301 -23.115 1.00 65.49 ? 49 PRO B CB 1 +ATOM 2008 C CG . PRO B 2 49 ? 45.693 -48.047 -24.257 1.00 63.51 ? 49 PRO B CG 1 +ATOM 2009 C CD . PRO B 2 49 ? 46.864 -48.555 -25.068 1.00 72.88 ? 49 PRO B CD 1 +ATOM 2010 N N . GLN B 2 50 ? 48.860 -45.655 -21.905 1.00 60.97 ? 50 GLN B N 1 +ATOM 2011 C CA . GLN B 2 50 ? 49.819 -45.586 -20.814 1.00 53.91 ? 50 GLN B CA 1 +ATOM 2012 C C . GLN B 2 50 ? 49.196 -44.843 -19.642 1.00 56.33 ? 50 GLN B C 1 +ATOM 2013 O O . GLN B 2 50 ? 48.526 -43.826 -19.815 1.00 65.24 ? 50 GLN B O 1 +ATOM 2014 C CB . GLN B 2 50 ? 51.146 -44.944 -21.233 1.00 59.63 ? 50 GLN B CB 1 +ATOM 2015 C CG . GLN B 2 50 ? 51.035 -43.464 -21.585 1.00 79.80 ? 50 GLN B CG 1 +ATOM 2016 C CD . GLN B 2 50 ? 52.323 -42.855 -22.081 1.00 86.52 ? 50 GLN B CD 1 +ATOM 2017 O OE1 . GLN B 2 50 ? 52.562 -42.767 -23.288 1.00 63.03 ? 50 GLN B OE1 1 +ATOM 2018 N NE2 . GLN B 2 50 ? 53.158 -42.419 -21.148 1.00 75.69 ? 50 GLN B NE2 1 +ATOM 2019 N N . LEU B 2 51 ? 49.466 -45.389 -18.456 1.00 60.59 ? 51 LEU B N 1 +ATOM 2020 C CA . LEU B 2 51 ? 49.011 -44.907 -17.166 1.00 60.01 ? 51 LEU B CA 1 +ATOM 2021 C C . LEU B 2 51 ? 49.709 -43.585 -16.840 1.00 49.87 ? 51 LEU B C 1 +ATOM 2022 O O . LEU B 2 51 ? 50.923 -43.474 -16.980 1.00 50.22 ? 51 LEU B O 1 +ATOM 2023 C CB . LEU B 2 51 ? 49.366 -46.020 -16.171 1.00 50.10 ? 51 LEU B CB 1 +ATOM 2024 C CG . LEU B 2 51 ? 49.094 -45.773 -14.691 1.00 37.92 ? 51 LEU B CG 1 +ATOM 2025 C CD1 . LEU B 2 51 ? 47.635 -46.075 -14.351 1.00 38.71 ? 51 LEU B CD1 1 +ATOM 2026 C CD2 . LEU B 2 51 ? 50.021 -46.648 -13.859 1.00 29.55 ? 51 LEU B CD2 1 +ATOM 2027 N N . LEU B 2 52 ? 48.922 -42.578 -16.439 1.00 51.87 ? 52 LEU B N 1 +ATOM 2028 C CA . LEU B 2 52 ? 49.464 -41.371 -15.833 1.00 58.32 ? 52 LEU B CA 1 +ATOM 2029 C C . LEU B 2 52 ? 49.334 -41.471 -14.320 1.00 55.68 ? 52 LEU B C 1 +ATOM 2030 O O . LEU B 2 52 ? 50.302 -41.224 -13.604 1.00 49.61 ? 52 LEU B O 1 +ATOM 2031 C CB . LEU B 2 52 ? 48.742 -40.113 -16.333 1.00 46.88 ? 52 LEU B CB 1 +ATOM 2032 C CG . LEU B 2 52 ? 48.658 -39.917 -17.844 1.00 48.24 ? 52 LEU B CG 1 +ATOM 2033 C CD1 . LEU B 2 52 ? 47.560 -38.923 -18.176 1.00 49.87 ? 52 LEU B CD1 1 +ATOM 2034 C CD2 . LEU B 2 52 ? 49.988 -39.454 -18.422 1.00 47.77 ? 52 LEU B CD2 1 +ATOM 2035 N N . ILE B 2 53 ? 48.125 -41.821 -13.859 1.00 52.62 ? 53 ILE B N 1 +ATOM 2036 C CA . ILE B 2 53 ? 47.771 -41.706 -12.455 1.00 55.72 ? 53 ILE B CA 1 +ATOM 2037 C C . ILE B 2 53 ? 47.024 -42.962 -12.028 1.00 58.23 ? 53 ILE B C 1 +ATOM 2038 O O . ILE B 2 53 ? 46.078 -43.363 -12.701 1.00 84.04 ? 53 ILE B O 1 +ATOM 2039 C CB . ILE B 2 53 ? 46.934 -40.433 -12.221 1.00 53.38 ? 53 ILE B CB 1 +ATOM 2040 C CG1 . ILE B 2 53 ? 47.758 -39.149 -12.383 1.00 44.88 ? 53 ILE B CG1 1 +ATOM 2041 C CG2 . ILE B 2 53 ? 46.216 -40.497 -10.878 1.00 64.08 ? 53 ILE B CG2 1 +ATOM 2042 C CD1 . ILE B 2 53 ? 48.617 -38.777 -11.177 1.00 53.96 ? 53 ILE B CD1 1 +ATOM 2043 N N . TYR B 2 54 ? 47.457 -43.561 -10.910 1.00 59.62 ? 54 TYR B N 1 +ATOM 2044 C CA . TYR B 2 54 ? 46.748 -44.680 -10.302 1.00 63.79 ? 54 TYR B CA 1 +ATOM 2045 C C . TYR B 2 54 ? 46.241 -44.291 -8.921 1.00 64.48 ? 54 TYR B C 1 +ATOM 2046 O O . TYR B 2 54 ? 46.837 -43.437 -8.266 1.00 75.60 ? 54 TYR B O 1 +ATOM 2047 C CB . TYR B 2 54 ? 47.615 -45.939 -10.233 1.00 51.33 ? 54 TYR B CB 1 +ATOM 2048 C CG . TYR B 2 54 ? 48.831 -45.890 -9.342 1.00 55.76 ? 54 TYR B CG 1 +ATOM 2049 C CD1 . TYR B 2 54 ? 50.042 -45.375 -9.795 1.00 63.35 ? 54 TYR B CD1 1 +ATOM 2050 C CD2 . TYR B 2 54 ? 48.793 -46.423 -8.061 1.00 58.83 ? 54 TYR B CD2 1 +ATOM 2051 C CE1 . TYR B 2 54 ? 51.174 -45.366 -8.989 1.00 58.88 ? 54 TYR B CE1 1 +ATOM 2052 C CE2 . TYR B 2 54 ? 49.912 -46.419 -7.240 1.00 63.67 ? 54 TYR B CE2 1 +ATOM 2053 C CZ . TYR B 2 54 ? 51.106 -45.888 -7.705 1.00 73.30 ? 54 TYR B CZ 1 +ATOM 2054 O OH . TYR B 2 54 ? 52.199 -45.877 -6.885 1.00 69.45 ? 54 TYR B OH 1 +ATOM 2055 N N . LEU B 2 55 ? 45.140 -44.937 -8.503 1.00 50.84 ? 55 LEU B N 1 +ATOM 2056 C CA . LEU B 2 55 ? 44.538 -44.761 -7.187 1.00 44.89 ? 55 LEU B CA 1 +ATOM 2057 C C . LEU B 2 55 ? 44.315 -43.281 -6.874 1.00 56.06 ? 55 LEU B C 1 +ATOM 2058 O O . LEU B 2 55 ? 44.714 -42.804 -5.808 1.00 44.41 ? 55 LEU B O 1 +ATOM 2059 C CB . LEU B 2 55 ? 45.426 -45.408 -6.118 1.00 36.97 ? 55 LEU B CB 1 +ATOM 2060 C CG . LEU B 2 55 ? 45.265 -46.909 -5.907 1.00 52.54 ? 55 LEU B CG 1 +ATOM 2061 C CD1 . LEU B 2 55 ? 46.541 -47.499 -5.332 1.00 68.84 ? 55 LEU B CD1 1 +ATOM 2062 C CD2 . LEU B 2 55 ? 44.089 -47.215 -4.992 1.00 54.60 ? 55 LEU B CD2 1 +ATOM 2063 N N . GLY B 2 56 ? 43.699 -42.563 -7.827 1.00 50.99 ? 56 GLY B N 1 +ATOM 2064 C CA . GLY B 2 56 ? 43.222 -41.206 -7.615 1.00 40.22 ? 56 GLY B CA 1 +ATOM 2065 C C . GLY B 2 56 ? 44.270 -40.134 -7.910 1.00 48.09 ? 56 GLY B C 1 +ATOM 2066 O O . GLY B 2 56 ? 43.996 -39.216 -8.689 1.00 40.70 ? 56 GLY B O 1 +ATOM 2067 N N . SER B 2 57 ? 45.455 -40.252 -7.280 1.00 50.22 ? 57 SER B N 1 +ATOM 2068 C CA . SER B 2 57 ? 46.432 -39.172 -7.305 1.00 60.03 ? 57 SER B CA 1 +ATOM 2069 C C . SER B 2 57 ? 47.887 -39.646 -7.187 1.00 67.04 ? 57 SER B C 1 +ATOM 2070 O O . SER B 2 57 ? 48.763 -38.847 -6.856 1.00 70.11 ? 57 SER B O 1 +ATOM 2071 C CB . SER B 2 57 ? 46.093 -38.132 -6.261 1.00 51.62 ? 57 SER B CB 1 +ATOM 2072 O OG . SER B 2 57 ? 46.248 -38.668 -4.959 1.00 69.59 ? 57 SER B OG 1 +ATOM 2073 N N . ASN B 2 58 ? 48.164 -40.923 -7.479 1.00 60.18 ? 58 ASN B N 1 +ATOM 2074 C CA . ASN B 2 58 ? 49.544 -41.388 -7.511 1.00 51.23 ? 58 ASN B CA 1 +ATOM 2075 C C . ASN B 2 58 ? 50.051 -41.355 -8.945 1.00 56.71 ? 58 ASN B C 1 +ATOM 2076 O O . ASN B 2 58 ? 49.381 -41.845 -9.849 1.00 75.45 ? 58 ASN B O 1 +ATOM 2077 C CB . ASN B 2 58 ? 49.716 -42.805 -6.971 1.00 61.64 ? 58 ASN B CB 1 +ATOM 2078 C CG . ASN B 2 58 ? 49.153 -42.985 -5.581 1.00 70.52 ? 58 ASN B CG 1 +ATOM 2079 O OD1 . ASN B 2 58 ? 49.897 -42.969 -4.610 1.00 47.08 ? 58 ASN B OD1 1 +ATOM 2080 N ND2 . ASN B 2 58 ? 47.843 -43.145 -5.478 1.00 79.47 ? 58 ASN B ND2 1 +ATOM 2081 N N . ARG B 2 59 ? 51.244 -40.781 -9.121 1.00 65.93 ? 59 ARG B N 1 +ATOM 2082 C CA . ARG B 2 59 ? 51.878 -40.657 -10.423 1.00 67.72 ? 59 ARG B CA 1 +ATOM 2083 C C . ARG B 2 59 ? 52.523 -41.984 -10.808 1.00 61.05 ? 59 ARG B C 1 +ATOM 2084 O O . ARG B 2 59 ? 53.213 -42.597 -9.995 1.00 66.23 ? 59 ARG B O 1 +ATOM 2085 C CB . ARG B 2 59 ? 52.936 -39.550 -10.394 1.00 71.06 ? 59 ARG B CB 1 +ATOM 2086 C CG . ARG B 2 59 ? 52.520 -38.267 -11.096 1.00 74.95 ? 59 ARG B CG 1 +ATOM 2087 C CD . ARG B 2 59 ? 53.621 -37.226 -11.018 1.00 76.57 ? 59 ARG B CD 1 +ATOM 2088 N NE . ARG B 2 59 ? 53.656 -36.593 -9.705 1.00 74.92 ? 59 ARG B NE 1 +ATOM 2089 C CZ . ARG B 2 59 ? 52.910 -35.553 -9.334 1.00 82.41 ? 59 ARG B CZ 1 +ATOM 2090 N NH1 . ARG B 2 59 ? 52.387 -34.749 -10.245 1.00 57.53 ? 59 ARG B NH1 1 +ATOM 2091 N NH2 . ARG B 2 59 ? 52.704 -35.311 -8.049 1.00 73.23 ? 59 ARG B NH2 1 +ATOM 2092 N N . ALA B 2 60 ? 52.287 -42.406 -12.056 1.00 61.48 ? 60 ALA B N 1 +ATOM 2093 C CA . ALA B 2 60 ? 52.995 -43.520 -12.670 1.00 59.92 ? 60 ALA B CA 1 +ATOM 2094 C C . ALA B 2 60 ? 54.449 -43.123 -12.902 1.00 64.05 ? 60 ALA B C 1 +ATOM 2095 O O . ALA B 2 60 ? 54.733 -41.957 -13.189 1.00 48.61 ? 60 ALA B O 1 +ATOM 2096 C CB . ALA B 2 60 ? 52.337 -43.871 -13.975 1.00 65.06 ? 60 ALA B CB 1 +ATOM 2097 N N . SER B 2 61 ? 55.351 -44.107 -12.776 1.00 66.04 ? 61 SER B N 1 +ATOM 2098 C CA . SER B 2 61 ? 56.768 -43.911 -13.049 1.00 70.22 ? 61 SER B CA 1 +ATOM 2099 C C . SER B 2 61 ? 56.974 -43.601 -14.535 1.00 57.87 ? 61 SER B C 1 +ATOM 2100 O O . SER B 2 61 ? 56.630 -44.403 -15.399 1.00 55.51 ? 61 SER B O 1 +ATOM 2101 C CB . SER B 2 61 ? 57.585 -45.098 -12.595 1.00 54.43 ? 61 SER B CB 1 +ATOM 2102 O OG . SER B 2 61 ? 58.867 -44.679 -12.144 1.00 80.98 ? 61 SER B OG 1 +ATOM 2103 N N . GLY B 2 62 ? 57.535 -42.418 -14.811 1.00 50.84 ? 62 GLY B N 1 +ATOM 2104 C CA . GLY B 2 62 ? 57.628 -41.877 -16.155 1.00 51.69 ? 62 GLY B CA 1 +ATOM 2105 C C . GLY B 2 62 ? 56.903 -40.539 -16.294 1.00 56.36 ? 62 GLY B C 1 +ATOM 2106 O O . GLY B 2 62 ? 57.190 -39.778 -17.217 1.00 61.42 ? 62 GLY B O 1 +ATOM 2107 N N . VAL B 2 63 ? 55.986 -40.258 -15.356 1.00 58.08 ? 63 VAL B N 1 +ATOM 2108 C CA . VAL B 2 63 ? 55.039 -39.159 -15.468 1.00 58.81 ? 63 VAL B CA 1 +ATOM 2109 C C . VAL B 2 63 ? 55.581 -37.931 -14.737 1.00 60.52 ? 63 VAL B C 1 +ATOM 2110 O O . VAL B 2 63 ? 55.798 -37.996 -13.527 1.00 44.07 ? 63 VAL B O 1 +ATOM 2111 C CB . VAL B 2 63 ? 53.645 -39.570 -14.956 1.00 55.68 ? 63 VAL B CB 1 +ATOM 2112 C CG1 . VAL B 2 63 ? 52.689 -38.392 -14.883 1.00 60.75 ? 63 VAL B CG1 1 +ATOM 2113 C CG2 . VAL B 2 63 ? 53.045 -40.688 -15.795 1.00 53.54 ? 63 VAL B CG2 1 +ATOM 2114 N N . PRO B 2 64 ? 55.782 -36.785 -15.447 1.00 61.77 ? 64 PRO B N 1 +ATOM 2115 C CA . PRO B 2 64 ? 56.340 -35.567 -14.851 1.00 64.41 ? 64 PRO B CA 1 +ATOM 2116 C C . PRO B 2 64 ? 55.430 -34.912 -13.818 1.00 62.69 ? 64 PRO B C 1 +ATOM 2117 O O . PRO B 2 64 ? 54.217 -35.120 -13.830 1.00 63.27 ? 64 PRO B O 1 +ATOM 2118 C CB . PRO B 2 64 ? 56.505 -34.607 -16.044 1.00 56.80 ? 64 PRO B CB 1 +ATOM 2119 C CG . PRO B 2 64 ? 55.492 -35.084 -17.049 1.00 40.61 ? 64 PRO B CG 1 +ATOM 2120 C CD . PRO B 2 64 ? 55.484 -36.591 -16.878 1.00 44.83 ? 64 PRO B CD 1 +ATOM 2121 N N . ASP B 2 65 ? 56.050 -34.075 -12.976 1.00 68.30 ? 65 ASP B N 1 +ATOM 2122 C CA . ASP B 2 65 ? 55.438 -33.374 -11.857 1.00 78.14 ? 65 ASP B CA 1 +ATOM 2123 C C . ASP B 2 65 ? 54.260 -32.503 -12.306 1.00 72.11 ? 65 ASP B C 1 +ATOM 2124 O O . ASP B 2 65 ? 53.421 -32.144 -11.480 1.00 67.13 ? 65 ASP B O 1 +ATOM 2125 C CB . ASP B 2 65 ? 56.503 -32.561 -11.111 1.00 89.04 ? 65 ASP B CB 1 +ATOM 2126 C CG . ASP B 2 65 ? 56.247 -32.385 -9.621 1.00 131.41 ? 65 ASP B CG 1 +ATOM 2127 O OD1 . ASP B 2 65 ? 55.826 -33.366 -8.968 1.00 148.65 ? 65 ASP B OD1 1 +ATOM 2128 O OD2 . ASP B 2 65 ? 56.490 -31.267 -9.119 1.00 160.22 ? 65 ASP B OD2 1 +ATOM 2129 N N . ARG B 2 66 ? 54.200 -32.181 -13.610 1.00 63.52 ? 66 ARG B N 1 +ATOM 2130 C CA . ARG B 2 66 ? 53.194 -31.312 -14.211 1.00 63.51 ? 66 ARG B CA 1 +ATOM 2131 C C . ARG B 2 66 ? 51.785 -31.899 -14.110 1.00 72.97 ? 66 ARG B C 1 +ATOM 2132 O O . ARG B 2 66 ? 50.815 -31.142 -14.048 1.00 79.86 ? 66 ARG B O 1 +ATOM 2133 C CB . ARG B 2 66 ? 53.477 -31.099 -15.699 1.00 60.98 ? 66 ARG B CB 1 +ATOM 2134 C CG . ARG B 2 66 ? 54.737 -30.303 -16.004 1.00 72.57 ? 66 ARG B CG 1 +ATOM 2135 C CD . ARG B 2 66 ? 54.747 -29.861 -17.455 1.00 57.74 ? 66 ARG B CD 1 +ATOM 2136 N NE . ARG B 2 66 ? 54.964 -30.967 -18.376 1.00 58.40 ? 66 ARG B NE 1 +ATOM 2137 C CZ . ARG B 2 66 ? 54.028 -31.548 -19.127 1.00 78.61 ? 66 ARG B CZ 1 +ATOM 2138 N NH1 . ARG B 2 66 ? 52.781 -31.107 -19.110 1.00 70.20 ? 66 ARG B NH1 1 +ATOM 2139 N NH2 . ARG B 2 66 ? 54.348 -32.573 -19.901 1.00 81.22 ? 66 ARG B NH2 1 +ATOM 2140 N N . PHE B 2 67 ? 51.686 -33.240 -14.142 1.00 66.39 ? 67 PHE B N 1 +ATOM 2141 C CA . PHE B 2 67 ? 50.421 -33.961 -14.119 1.00 52.46 ? 67 PHE B CA 1 +ATOM 2142 C C . PHE B 2 67 ? 50.025 -34.285 -12.679 1.00 54.34 ? 67 PHE B C 1 +ATOM 2143 O O . PHE B 2 67 ? 50.784 -34.938 -11.962 1.00 57.72 ? 67 PHE B O 1 +ATOM 2144 C CB . PHE B 2 67 ? 50.542 -35.271 -14.903 1.00 50.86 ? 67 PHE B CB 1 +ATOM 2145 C CG . PHE B 2 67 ? 50.665 -35.146 -16.401 1.00 61.76 ? 67 PHE B CG 1 +ATOM 2146 C CD1 . PHE B 2 67 ? 51.912 -35.025 -17.007 1.00 64.09 ? 67 PHE B CD1 1 +ATOM 2147 C CD2 . PHE B 2 67 ? 49.537 -35.184 -17.213 1.00 60.69 ? 67 PHE B CD2 1 +ATOM 2148 C CE1 . PHE B 2 67 ? 52.030 -34.921 -18.387 1.00 45.03 ? 67 PHE B CE1 1 +ATOM 2149 C CE2 . PHE B 2 67 ? 49.656 -35.073 -18.593 1.00 72.27 ? 67 PHE B CE2 1 +ATOM 2150 C CZ . PHE B 2 67 ? 50.901 -34.942 -19.179 1.00 50.30 ? 67 PHE B CZ 1 +ATOM 2151 N N . SER B 2 68 ? 48.815 -33.865 -12.279 1.00 56.87 ? 68 SER B N 1 +ATOM 2152 C CA . SER B 2 68 ? 48.355 -34.031 -10.905 1.00 57.71 ? 68 SER B CA 1 +ATOM 2153 C C . SER B 2 68 ? 46.938 -34.593 -10.843 1.00 57.27 ? 68 SER B C 1 +ATOM 2154 O O . SER B 2 68 ? 46.023 -34.081 -11.491 1.00 48.66 ? 68 SER B O 1 +ATOM 2155 C CB . SER B 2 68 ? 48.476 -32.749 -10.121 1.00 56.93 ? 68 SER B CB 1 +ATOM 2156 O OG . SER B 2 68 ? 48.232 -31.622 -10.954 1.00 75.26 ? 68 SER B OG 1 +ATOM 2157 N N . GLY B 2 69 ? 46.781 -35.647 -10.034 1.00 58.31 ? 69 GLY B N 1 +ATOM 2158 C CA . GLY B 2 69 ? 45.483 -36.232 -9.742 1.00 65.25 ? 69 GLY B CA 1 +ATOM 2159 C C . GLY B 2 69 ? 44.893 -35.676 -8.450 1.00 64.61 ? 69 GLY B C 1 +ATOM 2160 O O . GLY B 2 69 ? 45.625 -35.142 -7.618 1.00 81.38 ? 69 GLY B O 1 +ATOM 2161 N N . SER B 2 70 ? 43.571 -35.843 -8.297 1.00 60.54 ? 70 SER B N 1 +ATOM 2162 C CA . SER B 2 70 ? 42.772 -35.276 -7.216 1.00 57.23 ? 70 SER B CA 1 +ATOM 2163 C C . SER B 2 70 ? 41.346 -35.820 -7.267 1.00 48.94 ? 70 SER B C 1 +ATOM 2164 O O . SER B 2 70 ? 40.802 -36.065 -8.342 1.00 76.27 ? 70 SER B O 1 +ATOM 2165 C CB . SER B 2 70 ? 42.762 -33.743 -7.232 1.00 70.21 ? 70 SER B CB 1 +ATOM 2166 O OG . SER B 2 70 ? 42.558 -33.207 -8.540 1.00 67.00 ? 70 SER B OG 1 +ATOM 2167 N N . GLY B 2 71 ? 40.736 -35.970 -6.089 1.00 61.90 ? 71 GLY B N 1 +ATOM 2168 C CA . GLY B 2 71 ? 39.327 -36.309 -5.982 1.00 55.05 ? 71 GLY B CA 1 +ATOM 2169 C C . GLY B 2 71 ? 39.090 -37.536 -5.107 1.00 55.26 ? 71 GLY B C 1 +ATOM 2170 O O . GLY B 2 71 ? 40.021 -38.270 -4.770 1.00 45.85 ? 71 GLY B O 1 +ATOM 2171 N N . SER B 2 72 ? 37.820 -37.745 -4.748 1.00 49.41 ? 72 SER B N 1 +ATOM 2172 C CA . SER B 2 72 ? 37.442 -38.825 -3.853 1.00 47.78 ? 72 SER B CA 1 +ATOM 2173 C C . SER B 2 72 ? 36.003 -39.233 -4.133 1.00 43.11 ? 72 SER B C 1 +ATOM 2174 O O . SER B 2 72 ? 35.243 -38.450 -4.699 1.00 42.85 ? 72 SER B O 1 +ATOM 2175 C CB . SER B 2 72 ? 37.628 -38.450 -2.408 1.00 43.43 ? 72 SER B CB 1 +ATOM 2176 O OG . SER B 2 72 ? 37.603 -39.618 -1.606 1.00 57.71 ? 72 SER B OG 1 +ATOM 2177 N N . GLY B 2 73 ? 35.673 -40.480 -3.779 1.00 35.62 ? 73 GLY B N 1 +ATOM 2178 C CA . GLY B 2 73 ? 34.309 -40.959 -3.873 1.00 45.42 ? 73 GLY B CA 1 +ATOM 2179 C C . GLY B 2 73 ? 33.871 -41.100 -5.324 1.00 55.44 ? 73 GLY B C 1 +ATOM 2180 O O . GLY B 2 73 ? 34.105 -42.138 -5.941 1.00 73.62 ? 73 GLY B O 1 +ATOM 2181 N N . THR B 2 74 ? 33.250 -40.037 -5.851 1.00 44.84 ? 74 THR B N 1 +ATOM 2182 C CA . THR B 2 74 ? 32.669 -40.069 -7.182 1.00 40.20 ? 74 THR B CA 1 +ATOM 2183 C C . THR B 2 74 ? 33.103 -38.854 -7.992 1.00 46.14 ? 74 THR B C 1 +ATOM 2184 O O . THR B 2 74 ? 32.541 -38.599 -9.054 1.00 76.49 ? 74 THR B O 1 +ATOM 2185 C CB . THR B 2 74 ? 31.131 -40.125 -7.136 1.00 46.31 ? 74 THR B CB 1 +ATOM 2186 O OG1 . THR B 2 74 ? 30.574 -38.858 -6.779 1.00 44.16 ? 74 THR B OG1 1 +ATOM 2187 C CG2 . THR B 2 74 ? 30.587 -41.194 -6.217 1.00 40.72 ? 74 THR B CG2 1 +ATOM 2188 N N . ASP B 2 75 ? 34.073 -38.087 -7.485 1.00 52.87 ? 75 ASP B N 1 +ATOM 2189 C CA . ASP B 2 75 ? 34.441 -36.862 -8.175 1.00 53.21 ? 75 ASP B CA 1 +ATOM 2190 C C . ASP B 2 75 ? 35.953 -36.767 -8.328 1.00 59.54 ? 75 ASP B C 1 +ATOM 2191 O O . ASP B 2 75 ? 36.671 -36.531 -7.351 1.00 53.04 ? 75 ASP B O 1 +ATOM 2192 C CB . ASP B 2 75 ? 33.843 -35.629 -7.502 1.00 64.43 ? 75 ASP B CB 1 +ATOM 2193 C CG . ASP B 2 75 ? 34.021 -34.367 -8.328 1.00 89.40 ? 75 ASP B CG 1 +ATOM 2194 O OD1 . ASP B 2 75 ? 34.306 -34.488 -9.545 1.00 86.57 ? 75 ASP B OD1 1 +ATOM 2195 O OD2 . ASP B 2 75 ? 33.879 -33.272 -7.749 1.00 116.40 ? 75 ASP B OD2 1 +ATOM 2196 N N . PHE B 2 76 ? 36.407 -36.915 -9.580 1.00 46.33 ? 76 PHE B N 1 +ATOM 2197 C CA . PHE B 2 76 ? 37.833 -36.937 -9.875 1.00 48.26 ? 76 PHE B CA 1 +ATOM 2198 C C . PHE B 2 76 ? 38.207 -35.867 -10.896 1.00 40.70 ? 76 PHE B C 1 +ATOM 2199 O O . PHE B 2 76 ? 37.410 -35.531 -11.767 1.00 47.82 ? 76 PHE B O 1 +ATOM 2200 C CB . PHE B 2 76 ? 38.281 -38.352 -10.238 1.00 41.33 ? 76 PHE B CB 1 +ATOM 2201 C CG . PHE B 2 76 ? 38.041 -39.332 -9.120 1.00 47.66 ? 76 PHE B CG 1 +ATOM 2202 C CD1 . PHE B 2 76 ? 38.985 -39.502 -8.115 1.00 40.99 ? 76 PHE B CD1 1 +ATOM 2203 C CD2 . PHE B 2 76 ? 36.844 -40.035 -9.040 1.00 43.41 ? 76 PHE B CD2 1 +ATOM 2204 C CE1 . PHE B 2 76 ? 38.751 -40.387 -7.070 1.00 44.82 ? 76 PHE B CE1 1 +ATOM 2205 C CE2 . PHE B 2 76 ? 36.619 -40.929 -8.002 1.00 45.76 ? 76 PHE B CE2 1 +ATOM 2206 C CZ . PHE B 2 76 ? 37.572 -41.101 -7.016 1.00 47.56 ? 76 PHE B CZ 1 +ATOM 2207 N N . THR B 2 77 ? 39.420 -35.319 -10.734 1.00 38.72 ? 77 THR B N 1 +ATOM 2208 C CA . THR B 2 77 ? 39.955 -34.271 -11.585 1.00 43.88 ? 77 THR B CA 1 +ATOM 2209 C C . THR B 2 77 ? 41.436 -34.537 -11.873 1.00 55.66 ? 77 THR B C 1 +ATOM 2210 O O . THR B 2 77 ? 42.215 -34.852 -10.966 1.00 58.74 ? 77 THR B O 1 +ATOM 2211 C CB . THR B 2 77 ? 39.679 -32.886 -10.983 1.00 56.52 ? 77 THR B CB 1 +ATOM 2212 O OG1 . THR B 2 77 ? 38.302 -32.835 -10.613 1.00 60.54 ? 77 THR B OG1 1 +ATOM 2213 C CG2 . THR B 2 77 ? 39.950 -31.746 -11.942 1.00 68.32 ? 77 THR B CG2 1 +ATOM 2214 N N . LEU B 2 78 ? 41.798 -34.414 -13.158 1.00 40.47 ? 78 LEU B N 1 +ATOM 2215 C CA . LEU B 2 78 ? 43.179 -34.474 -13.610 1.00 49.79 ? 78 LEU B CA 1 +ATOM 2216 C C . LEU B 2 78 ? 43.584 -33.077 -14.068 1.00 55.48 ? 78 LEU B C 1 +ATOM 2217 O O . LEU B 2 78 ? 42.914 -32.484 -14.914 1.00 56.25 ? 78 LEU B O 1 +ATOM 2218 C CB . LEU B 2 78 ? 43.310 -35.502 -14.743 1.00 57.51 ? 78 LEU B CB 1 +ATOM 2219 C CG . LEU B 2 78 ? 44.561 -35.388 -15.620 1.00 64.26 ? 78 LEU B CG 1 +ATOM 2220 C CD1 . LEU B 2 78 ? 45.707 -36.239 -15.086 1.00 59.90 ? 78 LEU B CD1 1 +ATOM 2221 C CD2 . LEU B 2 78 ? 44.245 -35.772 -17.053 1.00 48.57 ? 78 LEU B CD2 1 +ATOM 2222 N N . LYS B 2 79 ? 44.675 -32.576 -13.473 1.00 53.03 ? 79 LYS B N 1 +ATOM 2223 C CA . LYS B 2 79 ? 45.183 -31.234 -13.706 1.00 60.17 ? 79 LYS B CA 1 +ATOM 2224 C C . LYS B 2 79 ? 46.474 -31.321 -14.511 1.00 72.86 ? 79 LYS B C 1 +ATOM 2225 O O . LYS B 2 79 ? 47.347 -32.139 -14.208 1.00 67.81 ? 79 LYS B O 1 +ATOM 2226 C CB . LYS B 2 79 ? 45.495 -30.538 -12.377 1.00 44.77 ? 79 LYS B CB 1 +ATOM 2227 C CG . LYS B 2 79 ? 44.585 -29.385 -11.982 1.00 71.32 ? 79 LYS B CG 1 +ATOM 2228 C CD . LYS B 2 79 ? 43.570 -29.736 -10.907 1.00 85.34 ? 79 LYS B CD 1 +ATOM 2229 C CE . LYS B 2 79 ? 42.987 -28.512 -10.229 1.00 80.57 ? 79 LYS B CE 1 +ATOM 2230 N NZ . LYS B 2 79 ? 41.590 -28.740 -9.792 1.00 81.47 ? 79 LYS B NZ 1 +ATOM 2231 N N . ILE B 2 80 ? 46.577 -30.470 -15.537 1.00 58.87 ? 80 ILE B N 1 +ATOM 2232 C CA . ILE B 2 80 ? 47.854 -30.235 -16.189 1.00 65.63 ? 80 ILE B CA 1 +ATOM 2233 C C . ILE B 2 80 ? 48.203 -28.766 -15.984 1.00 83.91 ? 80 ILE B C 1 +ATOM 2234 O O . ILE B 2 80 ? 47.484 -27.887 -16.456 1.00 84.42 ? 80 ILE B O 1 +ATOM 2235 C CB . ILE B 2 80 ? 47.843 -30.665 -17.673 1.00 66.82 ? 80 ILE B CB 1 +ATOM 2236 C CG1 . ILE B 2 80 ? 47.473 -32.145 -17.832 1.00 65.61 ? 80 ILE B CG1 1 +ATOM 2237 C CG2 . ILE B 2 80 ? 49.186 -30.356 -18.325 1.00 60.77 ? 80 ILE B CG2 1 +ATOM 2238 C CD1 . ILE B 2 80 ? 46.877 -32.513 -19.176 1.00 81.47 ? 80 ILE B CD1 1 +ATOM 2239 N N . SER B 2 81 ? 49.308 -28.536 -15.261 1.00 78.15 ? 81 SER B N 1 +ATOM 2240 C CA . SER B 2 81 ? 49.687 -27.229 -14.742 1.00 59.91 ? 81 SER B CA 1 +ATOM 2241 C C . SER B 2 81 ? 50.110 -26.279 -15.863 1.00 76.11 ? 81 SER B C 1 +ATOM 2242 O O . SER B 2 81 ? 49.712 -25.115 -15.861 1.00 77.30 ? 81 SER B O 1 +ATOM 2243 C CB . SER B 2 81 ? 50.742 -27.364 -13.684 1.00 51.74 ? 81 SER B CB 1 +ATOM 2244 O OG . SER B 2 81 ? 51.677 -28.374 -14.034 1.00 73.56 ? 81 SER B OG 1 +ATOM 2245 N N . ARG B 2 82 ? 50.934 -26.781 -16.795 1.00 89.52 ? 82 ARG B N 1 +ATOM 2246 C CA . ARG B 2 82 ? 51.263 -26.109 -18.047 1.00 73.72 ? 82 ARG B CA 1 +ATOM 2247 C C . ARG B 2 82 ? 51.275 -27.164 -19.152 1.00 73.89 ? 82 ARG B C 1 +ATOM 2248 O O . ARG B 2 82 ? 52.047 -28.125 -19.084 1.00 61.28 ? 82 ARG B O 1 +ATOM 2249 C CB . ARG B 2 82 ? 52.637 -25.421 -18.000 1.00 77.10 ? 82 ARG B CB 1 +ATOM 2250 C CG . ARG B 2 82 ? 52.886 -24.455 -16.845 1.00 100.48 ? 82 ARG B CG 1 +ATOM 2251 C CD . ARG B 2 82 ? 54.365 -24.252 -16.531 1.00 100.04 ? 82 ARG B CD 1 +ATOM 2252 N NE . ARG B 2 82 ? 55.044 -25.496 -16.162 1.00 128.25 ? 82 ARG B NE 1 +ATOM 2253 C CZ . ARG B 2 82 ? 56.361 -25.719 -16.193 1.00 119.97 ? 82 ARG B CZ 1 +ATOM 2254 N NH1 . ARG B 2 82 ? 57.209 -24.718 -16.365 1.00 118.93 ? 82 ARG B NH1 1 +ATOM 2255 N NH2 . ARG B 2 82 ? 56.826 -26.949 -16.042 1.00 83.92 ? 82 ARG B NH2 1 +ATOM 2256 N N . VAL B 2 83 ? 50.407 -26.985 -20.160 1.00 61.80 ? 83 VAL B N 1 +ATOM 2257 C CA . VAL B 2 83 ? 50.335 -27.912 -21.281 1.00 63.86 ? 83 VAL B CA 1 +ATOM 2258 C C . VAL B 2 83 ? 51.580 -27.756 -22.156 1.00 72.41 ? 83 VAL B C 1 +ATOM 2259 O O . VAL B 2 83 ? 52.249 -26.722 -22.124 1.00 72.99 ? 83 VAL B O 1 +ATOM 2260 C CB . VAL B 2 83 ? 49.023 -27.786 -22.086 1.00 38.21 ? 83 VAL B CB 1 +ATOM 2261 N N . GLU B 2 84 ? 51.885 -28.820 -22.911 1.00 72.76 ? 84 GLU B N 1 +ATOM 2262 C CA . GLU B 2 84 ? 53.036 -28.912 -23.795 1.00 67.92 ? 84 GLU B CA 1 +ATOM 2263 C C . GLU B 2 84 ? 52.644 -29.711 -25.037 1.00 70.92 ? 84 GLU B C 1 +ATOM 2264 O O . GLU B 2 84 ? 51.648 -30.430 -25.020 1.00 85.89 ? 84 GLU B O 1 +ATOM 2265 C CB . GLU B 2 84 ? 54.193 -29.589 -23.059 1.00 74.73 ? 84 GLU B CB 1 +ATOM 2266 C CG . GLU B 2 84 ? 55.006 -28.640 -22.199 1.00 82.26 ? 84 GLU B CG 1 +ATOM 2267 C CD . GLU B 2 84 ? 56.102 -29.293 -21.377 1.00 87.16 ? 84 GLU B CD 1 +ATOM 2268 O OE1 . GLU B 2 84 ? 56.354 -30.502 -21.575 1.00 95.52 ? 84 GLU B OE1 1 +ATOM 2269 O OE2 . GLU B 2 84 ? 56.702 -28.589 -20.538 1.00 80.02 ? 84 GLU B OE2 1 +ATOM 2270 N N . ALA B 2 85 ? 53.461 -29.608 -26.096 1.00 79.22 ? 85 ALA B N 1 +ATOM 2271 C CA . ALA B 2 85 ? 53.147 -30.129 -27.420 1.00 76.31 ? 85 ALA B CA 1 +ATOM 2272 C C . ALA B 2 85 ? 52.979 -31.652 -27.427 1.00 72.95 ? 85 ALA B C 1 +ATOM 2273 O O . ALA B 2 85 ? 52.352 -32.184 -28.343 1.00 60.51 ? 85 ALA B O 1 +ATOM 2274 C CB . ALA B 2 85 ? 54.199 -29.685 -28.406 1.00 59.61 ? 85 ALA B CB 1 +ATOM 2275 N N . GLU B 2 86 ? 53.532 -32.332 -26.407 1.00 63.11 ? 86 GLU B N 1 +ATOM 2276 C CA . GLU B 2 86 ? 53.566 -33.789 -26.313 1.00 72.64 ? 86 GLU B CA 1 +ATOM 2277 C C . GLU B 2 86 ? 52.494 -34.294 -25.350 1.00 73.93 ? 86 GLU B C 1 +ATOM 2278 O O . GLU B 2 86 ? 52.519 -35.455 -24.936 1.00 72.58 ? 86 GLU B O 1 +ATOM 2279 C CB . GLU B 2 86 ? 54.956 -34.326 -25.939 1.00 71.41 ? 86 GLU B CB 1 +ATOM 2280 C CG . GLU B 2 86 ? 55.668 -33.567 -24.831 1.00 77.58 ? 86 GLU B CG 1 +ATOM 2281 C CD . GLU B 2 86 ? 56.512 -32.408 -25.336 1.00 118.03 ? 86 GLU B CD 1 +ATOM 2282 O OE1 . GLU B 2 86 ? 57.594 -32.668 -25.903 1.00 134.66 ? 86 GLU B OE1 1 +ATOM 2283 O OE2 . GLU B 2 86 ? 56.075 -31.248 -25.185 1.00 121.95 ? 86 GLU B OE2 1 +ATOM 2284 N N . ASP B 2 87 ? 51.553 -33.407 -25.011 1.00 61.31 ? 87 ASP B N 1 +ATOM 2285 C CA . ASP B 2 87 ? 50.417 -33.758 -24.176 1.00 63.72 ? 87 ASP B CA 1 +ATOM 2286 C C . ASP B 2 87 ? 49.233 -34.089 -25.074 1.00 71.97 ? 87 ASP B C 1 +ATOM 2287 O O . ASP B 2 87 ? 48.205 -34.583 -24.605 1.00 76.85 ? 87 ASP B O 1 +ATOM 2288 C CB . ASP B 2 87 ? 50.119 -32.663 -23.149 1.00 49.68 ? 87 ASP B CB 1 +ATOM 2289 C CG . ASP B 2 87 ? 51.331 -32.327 -22.301 1.00 56.66 ? 87 ASP B CG 1 +ATOM 2290 O OD1 . ASP B 2 87 ? 52.222 -33.202 -22.169 1.00 59.99 ? 87 ASP B OD1 1 +ATOM 2291 O OD2 . ASP B 2 87 ? 51.385 -31.196 -21.797 1.00 64.91 ? 87 ASP B OD2 1 +ATOM 2292 N N . VAL B 2 88 ? 49.420 -33.814 -26.371 1.00 61.72 ? 88 VAL B N 1 +ATOM 2293 C CA . VAL B 2 88 ? 48.444 -34.101 -27.407 1.00 52.91 ? 88 VAL B CA 1 +ATOM 2294 C C . VAL B 2 88 ? 48.115 -35.595 -27.368 1.00 46.99 ? 88 VAL B C 1 +ATOM 2295 O O . VAL B 2 88 ? 48.972 -36.408 -27.023 1.00 37.42 ? 88 VAL B O 1 +ATOM 2296 C CB . VAL B 2 88 ? 48.963 -33.598 -28.769 1.00 44.21 ? 88 VAL B CB 1 +ATOM 2297 C CG1 . VAL B 2 88 ? 49.485 -34.708 -29.666 1.00 41.05 ? 88 VAL B CG1 1 +ATOM 2298 C CG2 . VAL B 2 88 ? 47.929 -32.755 -29.491 1.00 61.74 ? 88 VAL B CG2 1 +ATOM 2299 N N . GLY B 2 89 ? 46.849 -35.928 -27.660 1.00 55.03 ? 89 GLY B N 1 +ATOM 2300 C CA . GLY B 2 89 ? 46.351 -37.295 -27.619 1.00 50.89 ? 89 GLY B CA 1 +ATOM 2301 C C . GLY B 2 89 ? 44.980 -37.391 -26.951 1.00 59.11 ? 89 GLY B C 1 +ATOM 2302 O O . GLY B 2 89 ? 44.252 -36.403 -26.869 1.00 73.91 ? 89 GLY B O 1 +ATOM 2303 N N . PHE B 2 90 ? 44.650 -38.600 -26.480 1.00 54.82 ? 90 PHE B N 1 +ATOM 2304 C CA . PHE B 2 90 ? 43.344 -38.924 -25.928 1.00 66.17 ? 90 PHE B CA 1 +ATOM 2305 C C . PHE B 2 90 ? 43.490 -39.368 -24.473 1.00 68.48 ? 90 PHE B C 1 +ATOM 2306 O O . PHE B 2 90 ? 44.290 -40.256 -24.172 1.00 66.14 ? 90 PHE B O 1 +ATOM 2307 C CB . PHE B 2 90 ? 42.666 -40.026 -26.747 1.00 57.27 ? 90 PHE B CB 1 +ATOM 2308 C CG . PHE B 2 90 ? 42.009 -39.584 -28.029 1.00 52.73 ? 90 PHE B CG 1 +ATOM 2309 C CD1 . PHE B 2 90 ? 42.716 -39.571 -29.225 1.00 58.12 ? 90 PHE B CD1 1 +ATOM 2310 C CD2 . PHE B 2 90 ? 40.665 -39.227 -28.054 1.00 58.11 ? 90 PHE B CD2 1 +ATOM 2311 C CE1 . PHE B 2 90 ? 42.102 -39.183 -30.411 1.00 60.67 ? 90 PHE B CE1 1 +ATOM 2312 C CE2 . PHE B 2 90 ? 40.049 -38.840 -29.239 1.00 57.23 ? 90 PHE B CE2 1 +ATOM 2313 C CZ . PHE B 2 90 ? 40.770 -38.816 -30.416 1.00 59.56 ? 90 PHE B CZ 1 +ATOM 2314 N N . TYR B 2 91 ? 42.687 -38.754 -23.590 1.00 46.65 ? 91 TYR B N 1 +ATOM 2315 C CA . TYR B 2 91 ? 42.761 -38.984 -22.156 1.00 38.52 ? 91 TYR B CA 1 +ATOM 2316 C C . TYR B 2 91 ? 41.534 -39.753 -21.663 1.00 53.52 ? 91 TYR B C 1 +ATOM 2317 O O . TYR B 2 91 ? 40.388 -39.357 -21.913 1.00 44.66 ? 91 TYR B O 1 +ATOM 2318 C CB . TYR B 2 91 ? 42.969 -37.668 -21.406 1.00 29.90 ? 91 TYR B CB 1 +ATOM 2319 C CG . TYR B 2 91 ? 44.348 -37.080 -21.574 1.00 35.82 ? 91 TYR B CG 1 +ATOM 2320 C CD1 . TYR B 2 91 ? 45.385 -37.425 -20.714 1.00 34.69 ? 91 TYR B CD1 1 +ATOM 2321 C CD2 . TYR B 2 91 ? 44.620 -36.163 -22.582 1.00 39.38 ? 91 TYR B CD2 1 +ATOM 2322 C CE1 . TYR B 2 91 ? 46.657 -36.892 -20.855 1.00 33.35 ? 91 TYR B CE1 1 +ATOM 2323 C CE2 . TYR B 2 91 ? 45.885 -35.615 -22.734 1.00 42.00 ? 91 TYR B CE2 1 +ATOM 2324 C CZ . TYR B 2 91 ? 46.904 -35.982 -21.869 1.00 46.77 ? 91 TYR B CZ 1 +ATOM 2325 O OH . TYR B 2 91 ? 48.154 -35.461 -22.021 1.00 69.83 ? 91 TYR B OH 1 +ATOM 2326 N N . TYR B 2 92 ? 41.814 -40.842 -20.929 1.00 45.64 ? 92 TYR B N 1 +ATOM 2327 C CA . TYR B 2 92 ? 40.797 -41.746 -20.424 1.00 53.08 ? 92 TYR B CA 1 +ATOM 2328 C C . TYR B 2 92 ? 40.930 -41.905 -18.914 1.00 48.16 ? 92 TYR B C 1 +ATOM 2329 O O . TYR B 2 92 ? 42.038 -41.917 -18.385 1.00 44.03 ? 92 TYR B O 1 +ATOM 2330 C CB . TYR B 2 92 ? 40.901 -43.110 -21.111 1.00 50.27 ? 92 TYR B CB 1 +ATOM 2331 C CG . TYR B 2 92 ? 40.520 -43.124 -22.567 1.00 56.53 ? 92 TYR B CG 1 +ATOM 2332 C CD1 . TYR B 2 92 ? 39.188 -43.163 -22.955 1.00 68.00 ? 92 TYR B CD1 1 +ATOM 2333 C CD2 . TYR B 2 92 ? 41.491 -43.119 -23.561 1.00 74.03 ? 92 TYR B CD2 1 +ATOM 2334 C CE1 . TYR B 2 92 ? 38.832 -43.190 -24.296 1.00 93.02 ? 92 TYR B CE1 1 +ATOM 2335 C CE2 . TYR B 2 92 ? 41.152 -43.144 -24.907 1.00 75.34 ? 92 TYR B CE2 1 +ATOM 2336 C CZ . TYR B 2 92 ? 39.816 -43.181 -25.272 1.00 87.39 ? 92 TYR B CZ 1 +ATOM 2337 O OH . TYR B 2 92 ? 39.460 -43.207 -26.587 1.00 83.60 ? 92 TYR B OH 1 +ATOM 2338 N N . CYS B 2 93 ? 39.779 -42.036 -18.240 1.00 53.54 ? 93 CYS B N 1 +ATOM 2339 C CA . CYS B 2 93 ? 39.721 -42.449 -16.846 1.00 54.11 ? 93 CYS B CA 1 +ATOM 2340 C C . CYS B 2 93 ? 39.091 -43.835 -16.762 1.00 54.70 ? 93 CYS B C 1 +ATOM 2341 O O . CYS B 2 93 ? 38.280 -44.202 -17.611 1.00 55.43 ? 93 CYS B O 1 +ATOM 2342 C CB . CYS B 2 93 ? 38.863 -41.499 -16.028 1.00 46.31 ? 93 CYS B CB 1 +ATOM 2343 S SG . CYS B 2 93 ? 37.182 -41.353 -16.681 1.00 67.39 ? 93 CYS B SG 1 +ATOM 2344 N N . MET B 2 94 ? 39.449 -44.585 -15.716 1.00 46.75 ? 94 MET B N 1 +ATOM 2345 C CA . MET B 2 94 ? 38.966 -45.948 -15.598 1.00 55.00 ? 94 MET B CA 1 +ATOM 2346 C C . MET B 2 94 ? 38.782 -46.299 -14.126 1.00 48.71 ? 94 MET B C 1 +ATOM 2347 O O . MET B 2 94 ? 39.713 -46.138 -13.338 1.00 75.35 ? 94 MET B O 1 +ATOM 2348 C CB . MET B 2 94 ? 39.948 -46.927 -16.256 1.00 51.26 ? 94 MET B CB 1 +ATOM 2349 C CG . MET B 2 94 ? 39.507 -48.373 -16.156 1.00 42.16 ? 94 MET B CG 1 +ATOM 2350 S SD . MET B 2 94 ? 40.786 -49.581 -16.504 1.00 63.60 ? 94 MET B SD 1 +ATOM 2351 C CE . MET B 2 94 ? 41.837 -49.460 -15.056 1.00 42.07 ? 94 MET B CE 1 +ATOM 2352 N N . GLN B 2 95 ? 37.583 -46.785 -13.769 1.00 46.58 ? 95 GLN B N 1 +ATOM 2353 C CA . GLN B 2 95 ? 37.390 -47.368 -12.444 1.00 54.47 ? 95 GLN B CA 1 +ATOM 2354 C C . GLN B 2 95 ? 37.938 -48.791 -12.440 1.00 44.83 ? 95 GLN B C 1 +ATOM 2355 O O . GLN B 2 95 ? 37.771 -49.518 -13.417 1.00 45.69 ? 95 GLN B O 1 +ATOM 2356 C CB . GLN B 2 95 ? 35.957 -47.241 -11.907 1.00 40.37 ? 95 GLN B CB 1 +ATOM 2357 C CG . GLN B 2 95 ? 34.886 -48.084 -12.605 1.00 37.02 ? 95 GLN B CG 1 +ATOM 2358 C CD . GLN B 2 95 ? 34.863 -49.577 -12.340 1.00 44.65 ? 95 GLN B CD 1 +ATOM 2359 O OE1 . GLN B 2 95 ? 35.321 -50.090 -11.311 1.00 36.69 ? 95 GLN B OE1 1 +ATOM 2360 N NE2 . GLN B 2 95 ? 34.311 -50.305 -13.297 1.00 48.48 ? 95 GLN B NE2 1 +ATOM 2361 N N . ALA B 2 96 ? 38.579 -49.155 -11.328 1.00 41.27 ? 96 ALA B N 1 +ATOM 2362 C CA . ALA B 2 96 ? 39.222 -50.448 -11.178 1.00 44.40 ? 96 ALA B CA 1 +ATOM 2363 C C . ALA B 2 96 ? 38.764 -51.125 -9.887 1.00 44.20 ? 96 ALA B C 1 +ATOM 2364 O O . ALA B 2 96 ? 39.525 -51.873 -9.269 1.00 51.70 ? 96 ALA B O 1 +ATOM 2365 C CB . ALA B 2 96 ? 40.721 -50.265 -11.214 1.00 39.15 ? 96 ALA B CB 1 +ATOM 2366 N N . LEU B 2 97 ? 37.510 -50.874 -9.493 1.00 49.65 ? 97 LEU B N 1 +ATOM 2367 C CA . LEU B 2 97 ? 37.009 -51.362 -8.216 1.00 56.42 ? 97 LEU B CA 1 +ATOM 2368 C C . LEU B 2 97 ? 36.171 -52.616 -8.445 1.00 59.06 ? 97 LEU B C 1 +ATOM 2369 O O . LEU B 2 97 ? 36.463 -53.672 -7.888 1.00 64.27 ? 97 LEU B O 1 +ATOM 2370 C CB . LEU B 2 97 ? 36.196 -50.264 -7.523 1.00 54.65 ? 97 LEU B CB 1 +ATOM 2371 C CG . LEU B 2 97 ? 35.493 -50.689 -6.234 1.00 54.97 ? 97 LEU B CG 1 +ATOM 2372 C CD1 . LEU B 2 97 ? 36.491 -50.836 -5.093 1.00 51.56 ? 97 LEU B CD1 1 +ATOM 2373 C CD2 . LEU B 2 97 ? 34.399 -49.701 -5.867 1.00 42.94 ? 97 LEU B CD2 1 +ATOM 2374 N N . GLN B 2 98 ? 35.126 -52.465 -9.262 1.00 67.17 ? 98 GLN B N 1 +ATOM 2375 C CA . GLN B 2 98 ? 34.312 -53.577 -9.714 1.00 69.22 ? 98 GLN B CA 1 +ATOM 2376 C C . GLN B 2 98 ? 34.541 -53.808 -11.204 1.00 68.96 ? 98 GLN B C 1 +ATOM 2377 O O . GLN B 2 98 ? 34.662 -52.863 -11.989 1.00 53.03 ? 98 GLN B O 1 +ATOM 2378 C CB . GLN B 2 98 ? 32.832 -53.273 -9.497 1.00 71.57 ? 98 GLN B CB 1 +ATOM 2379 C CG . GLN B 2 98 ? 32.316 -53.702 -8.136 1.00 78.57 ? 98 GLN B CG 1 +ATOM 2380 C CD . GLN B 2 98 ? 31.108 -52.890 -7.744 1.00 77.61 ? 98 GLN B CD 1 +ATOM 2381 O OE1 . GLN B 2 98 ? 30.260 -52.555 -8.570 1.00 77.83 ? 98 GLN B OE1 1 +ATOM 2382 N NE2 . GLN B 2 98 ? 31.038 -52.546 -6.469 1.00 60.62 ? 98 GLN B NE2 1 +ATOM 2383 N N . THR B 2 99 ? 34.578 -55.092 -11.565 1.00 52.73 ? 99 THR B N 1 +ATOM 2384 C CA . THR B 2 99 ? 34.387 -55.529 -12.936 1.00 62.78 ? 99 THR B CA 1 +ATOM 2385 C C . THR B 2 99 ? 32.931 -55.280 -13.332 1.00 60.91 ? 99 THR B C 1 +ATOM 2386 O O . THR B 2 99 ? 32.041 -55.331 -12.484 1.00 81.22 ? 99 THR B O 1 +ATOM 2387 C CB . THR B 2 99 ? 34.764 -57.008 -13.093 1.00 73.81 ? 99 THR B CB 1 +ATOM 2388 O OG1 . THR B 2 99 ? 34.266 -57.690 -11.940 1.00 73.64 ? 99 THR B OG1 1 +ATOM 2389 C CG2 . THR B 2 99 ? 36.256 -57.231 -13.242 1.00 57.77 ? 99 THR B CG2 1 +ATOM 2390 N N . PRO B 2 100 ? 32.684 -54.975 -14.609 1.00 50.82 ? 100 PRO B N 1 +ATOM 2391 C CA . PRO B 2 100 ? 33.702 -54.718 -15.612 1.00 47.62 ? 100 PRO B CA 1 +ATOM 2392 C C . PRO B 2 100 ? 34.364 -53.366 -15.368 1.00 58.03 ? 100 PRO B C 1 +ATOM 2393 O O . PRO B 2 100 ? 33.688 -52.425 -14.939 1.00 52.95 ? 100 PRO B O 1 +ATOM 2394 C CB . PRO B 2 100 ? 32.910 -54.707 -16.927 1.00 51.73 ? 100 PRO B CB 1 +ATOM 2395 C CG . PRO B 2 100 ? 31.517 -54.287 -16.526 1.00 56.80 ? 100 PRO B CG 1 +ATOM 2396 C CD . PRO B 2 100 ? 31.328 -54.930 -15.173 1.00 55.71 ? 100 PRO B CD 1 +ATOM 2397 N N . TYR B 2 101 ? 35.688 -53.305 -15.608 1.00 50.47 ? 101 TYR B N 1 +ATOM 2398 C CA . TYR B 2 101 ? 36.415 -52.042 -15.624 1.00 38.88 ? 101 TYR B CA 1 +ATOM 2399 C C . TYR B 2 101 ? 35.746 -51.146 -16.660 1.00 44.44 ? 101 TYR B C 1 +ATOM 2400 O O . TYR B 2 101 ? 35.538 -51.559 -17.798 1.00 59.18 ? 101 TYR B O 1 +ATOM 2401 C CB . TYR B 2 101 ? 37.891 -52.223 -16.001 1.00 45.31 ? 101 TYR B CB 1 +ATOM 2402 C CG . TYR B 2 101 ? 38.817 -52.882 -15.003 1.00 57.57 ? 101 TYR B CG 1 +ATOM 2403 C CD1 . TYR B 2 101 ? 38.466 -53.064 -13.673 1.00 48.84 ? 101 TYR B CD1 1 +ATOM 2404 C CD2 . TYR B 2 101 ? 40.090 -53.287 -15.388 1.00 61.73 ? 101 TYR B CD2 1 +ATOM 2405 C CE1 . TYR B 2 101 ? 39.335 -53.662 -12.770 1.00 48.00 ? 101 TYR B CE1 1 +ATOM 2406 C CE2 . TYR B 2 101 ? 40.975 -53.877 -14.496 1.00 56.47 ? 101 TYR B CE2 1 +ATOM 2407 C CZ . TYR B 2 101 ? 40.595 -54.067 -13.178 1.00 52.78 ? 101 TYR B CZ 1 +ATOM 2408 O OH . TYR B 2 101 ? 41.447 -54.650 -12.284 1.00 48.81 ? 101 TYR B OH 1 +ATOM 2409 N N . THR B 2 102 ? 35.355 -49.941 -16.249 1.00 42.24 ? 102 THR B N 1 +ATOM 2410 C CA . THR B 2 102 ? 34.629 -49.077 -17.165 1.00 45.98 ? 102 THR B CA 1 +ATOM 2411 C C . THR B 2 102 ? 35.466 -47.836 -17.453 1.00 46.32 ? 102 THR B C 1 +ATOM 2412 O O . THR B 2 102 ? 36.271 -47.437 -16.614 1.00 48.06 ? 102 THR B O 1 +ATOM 2413 C CB . THR B 2 102 ? 33.189 -48.803 -16.703 1.00 46.52 ? 102 THR B CB 1 +ATOM 2414 O OG1 . THR B 2 102 ? 33.166 -48.700 -15.280 1.00 51.37 ? 102 THR B OG1 1 +ATOM 2415 C CG2 . THR B 2 102 ? 32.206 -49.864 -17.150 1.00 37.75 ? 102 THR B CG2 1 +ATOM 2416 N N . PHE B 2 103 ? 35.256 -47.251 -18.644 1.00 44.65 ? 103 PHE B N 1 +ATOM 2417 C CA . PHE B 2 103 ? 36.046 -46.124 -19.112 1.00 41.56 ? 103 PHE B CA 1 +ATOM 2418 C C . PHE B 2 103 ? 35.153 -44.909 -19.329 1.00 38.99 ? 103 PHE B C 1 +ATOM 2419 O O . PHE B 2 103 ? 34.024 -45.046 -19.794 1.00 36.02 ? 103 PHE B O 1 +ATOM 2420 C CB . PHE B 2 103 ? 36.814 -46.490 -20.384 1.00 52.59 ? 103 PHE B CB 1 +ATOM 2421 C CG . PHE B 2 103 ? 37.833 -47.589 -20.209 1.00 68.01 ? 103 PHE B CG 1 +ATOM 2422 C CD1 . PHE B 2 103 ? 39.135 -47.298 -19.817 1.00 69.87 ? 103 PHE B CD1 1 +ATOM 2423 C CD2 . PHE B 2 103 ? 37.492 -48.921 -20.424 1.00 59.99 ? 103 PHE B CD2 1 +ATOM 2424 C CE1 . PHE B 2 103 ? 40.070 -48.310 -19.647 1.00 72.06 ? 103 PHE B CE1 1 +ATOM 2425 C CE2 . PHE B 2 103 ? 38.428 -49.932 -20.246 1.00 71.51 ? 103 PHE B CE2 1 +ATOM 2426 C CZ . PHE B 2 103 ? 39.718 -49.626 -19.865 1.00 63.18 ? 103 PHE B CZ 1 +ATOM 2427 N N . GLY B 2 104 ? 35.669 -43.728 -18.958 1.00 48.74 ? 104 GLY B N 1 +ATOM 2428 C CA . GLY B 2 104 ? 35.087 -42.458 -19.370 1.00 48.24 ? 104 GLY B CA 1 +ATOM 2429 C C . GLY B 2 104 ? 35.136 -42.338 -20.891 1.00 59.02 ? 104 GLY B C 1 +ATOM 2430 O O . GLY B 2 104 ? 35.906 -43.052 -21.535 1.00 56.94 ? 104 GLY B O 1 +ATOM 2431 N N . GLN B 2 105 ? 34.305 -41.447 -21.451 1.00 64.55 ? 105 GLN B N 1 +ATOM 2432 C CA . GLN B 2 105 ? 34.139 -41.353 -22.893 1.00 70.13 ? 105 GLN B CA 1 +ATOM 2433 C C . GLN B 2 105 ? 35.480 -41.033 -23.551 1.00 71.33 ? 105 GLN B C 1 +ATOM 2434 O O . GLN B 2 105 ? 35.872 -41.706 -24.500 1.00 63.78 ? 105 GLN B O 1 +ATOM 2435 C CB . GLN B 2 105 ? 33.041 -40.354 -23.260 1.00 96.80 ? 105 GLN B CB 1 +ATOM 2436 C CG . GLN B 2 105 ? 32.524 -40.520 -24.685 1.00 91.04 ? 105 GLN B CG 1 +ATOM 2437 C CD . GLN B 2 105 ? 31.066 -40.162 -24.853 1.00 111.53 ? 105 GLN B CD 1 +ATOM 2438 O OE1 . GLN B 2 105 ? 30.298 -40.091 -23.892 1.00 120.32 ? 105 GLN B OE1 1 +ATOM 2439 N NE2 . GLN B 2 105 ? 30.664 -39.946 -26.095 1.00 92.98 ? 105 GLN B NE2 1 +ATOM 2440 N N . GLY B 2 106 ? 36.180 -40.024 -23.019 1.00 69.59 ? 106 GLY B N 1 +ATOM 2441 C CA . GLY B 2 106 ? 37.488 -39.647 -23.528 1.00 71.68 ? 106 GLY B CA 1 +ATOM 2442 C C . GLY B 2 106 ? 37.576 -38.166 -23.893 1.00 71.14 ? 106 GLY B C 1 +ATOM 2443 O O . GLY B 2 106 ? 36.604 -37.559 -24.341 1.00 66.62 ? 106 GLY B O 1 +ATOM 2444 N N . THR B 2 107 ? 38.771 -37.603 -23.701 1.00 66.66 ? 107 THR B N 1 +ATOM 2445 C CA . THR B 2 107 ? 39.022 -36.205 -24.000 1.00 65.13 ? 107 THR B CA 1 +ATOM 2446 C C . THR B 2 107 ? 40.087 -36.117 -25.085 1.00 56.54 ? 107 THR B C 1 +ATOM 2447 O O . THR B 2 107 ? 41.156 -36.716 -24.962 1.00 53.36 ? 107 THR B O 1 +ATOM 2448 C CB . THR B 2 107 ? 39.448 -35.425 -22.748 1.00 58.84 ? 107 THR B CB 1 +ATOM 2449 O OG1 . THR B 2 107 ? 38.518 -35.727 -21.710 1.00 67.44 ? 107 THR B OG1 1 +ATOM 2450 C CG2 . THR B 2 107 ? 39.491 -33.928 -22.971 1.00 49.44 ? 107 THR B CG2 1 +ATOM 2451 N N . LYS B 2 108 ? 39.777 -35.358 -26.138 1.00 50.65 ? 108 LYS B N 1 +ATOM 2452 C CA . LYS B 2 108 ? 40.778 -35.040 -27.135 1.00 46.35 ? 108 LYS B CA 1 +ATOM 2453 C C . LYS B 2 108 ? 41.450 -33.751 -26.695 1.00 48.14 ? 108 LYS B C 1 +ATOM 2454 O O . LYS B 2 108 ? 40.794 -32.719 -26.598 1.00 65.29 ? 108 LYS B O 1 +ATOM 2455 C CB . LYS B 2 108 ? 40.165 -34.933 -28.536 1.00 49.91 ? 108 LYS B CB 1 +ATOM 2456 C CG . LYS B 2 108 ? 41.135 -35.280 -29.658 1.00 72.25 ? 108 LYS B CG 1 +ATOM 2457 C CD . LYS B 2 108 ? 40.730 -34.815 -31.040 1.00 78.17 ? 108 LYS B CD 1 +ATOM 2458 C CE . LYS B 2 108 ? 41.727 -35.221 -32.107 1.00 67.26 ? 108 LYS B CE 1 +ATOM 2459 N NZ . LYS B 2 108 ? 41.376 -34.651 -33.430 1.00 77.99 ? 108 LYS B NZ 1 +ATOM 2460 N N . LEU B 2 109 ? 42.747 -33.844 -26.388 1.00 59.96 ? 109 LEU B N 1 +ATOM 2461 C CA . LEU B 2 109 ? 43.566 -32.666 -26.140 1.00 58.88 ? 109 LEU B CA 1 +ATOM 2462 C C . LEU B 2 109 ? 44.246 -32.239 -27.448 1.00 54.03 ? 109 LEU B C 1 +ATOM 2463 O O . LEU B 2 109 ? 44.863 -33.050 -28.138 1.00 54.02 ? 109 LEU B O 1 +ATOM 2464 C CB . LEU B 2 109 ? 44.548 -32.972 -25.002 1.00 40.75 ? 109 LEU B CB 1 +ATOM 2465 C CG . LEU B 2 109 ? 45.374 -31.788 -24.502 1.00 42.76 ? 109 LEU B CG 1 +ATOM 2466 C CD1 . LEU B 2 109 ? 45.727 -31.945 -23.036 1.00 39.30 ? 109 LEU B CD1 1 +ATOM 2467 C CD2 . LEU B 2 109 ? 46.645 -31.631 -25.313 1.00 55.04 ? 109 LEU B CD2 1 +ATOM 2468 N N . GLU B 2 110 ? 44.086 -30.950 -27.776 1.00 46.83 ? 110 GLU B N 1 +ATOM 2469 C CA . GLU B 2 110 ? 44.466 -30.308 -29.028 1.00 44.64 ? 110 GLU B CA 1 +ATOM 2470 C C . GLU B 2 110 ? 45.129 -28.968 -28.700 1.00 57.08 ? 110 GLU B C 1 +ATOM 2471 O O . GLU B 2 110 ? 44.579 -28.165 -27.934 1.00 49.64 ? 110 GLU B O 1 +ATOM 2472 C CB . GLU B 2 110 ? 43.227 -30.028 -29.885 1.00 40.08 ? 110 GLU B CB 1 +ATOM 2473 C CG . GLU B 2 110 ? 42.342 -31.241 -30.126 1.00 87.35 ? 110 GLU B CG 1 +ATOM 2474 C CD . GLU B 2 110 ? 40.844 -30.990 -30.239 1.00 109.19 ? 110 GLU B CD 1 +ATOM 2475 O OE1 . GLU B 2 110 ? 40.240 -30.538 -29.242 1.00 97.98 ? 110 GLU B OE1 1 +ATOM 2476 O OE2 . GLU B 2 110 ? 40.278 -31.262 -31.321 1.00 133.73 ? 110 GLU B OE2 1 +ATOM 2477 N N . ILE B 2 111 ? 46.314 -28.738 -29.288 1.00 47.52 ? 111 ILE B N 1 +ATOM 2478 C CA . ILE B 2 111 ? 47.068 -27.507 -29.094 1.00 59.66 ? 111 ILE B CA 1 +ATOM 2479 C C . ILE B 2 111 ? 46.694 -26.468 -30.159 1.00 56.40 ? 111 ILE B C 1 +ATOM 2480 O O . ILE B 2 111 ? 46.718 -26.738 -31.358 1.00 50.82 ? 111 ILE B O 1 +ATOM 2481 C CB . ILE B 2 111 ? 48.586 -27.791 -28.982 1.00 67.06 ? 111 ILE B CB 1 +ATOM 2482 C CG1 . ILE B 2 111 ? 48.971 -28.252 -27.573 1.00 58.89 ? 111 ILE B CG1 1 +ATOM 2483 C CG2 . ILE B 2 111 ? 49.432 -26.599 -29.415 1.00 66.82 ? 111 ILE B CG2 1 +ATOM 2484 C CD1 . ILE B 2 111 ? 49.055 -29.748 -27.408 1.00 79.05 ? 111 ILE B CD1 1 +ATOM 2485 N N . LYS B 2 112 ? 46.300 -25.280 -29.680 1.00 70.34 ? 112 LYS B N 1 +ATOM 2486 C CA . LYS B 2 112 ? 46.186 -24.070 -30.478 1.00 68.22 ? 112 LYS B CA 1 +ATOM 2487 C C . LYS B 2 112 ? 47.580 -23.454 -30.544 1.00 78.97 ? 112 LYS B C 1 +ATOM 2488 O O . LYS B 2 112 ? 48.084 -22.949 -29.541 1.00 78.60 ? 112 LYS B O 1 +ATOM 2489 C CB . LYS B 2 112 ? 45.191 -23.095 -29.834 1.00 69.18 ? 112 LYS B CB 1 +ATOM 2490 C CG . LYS B 2 112 ? 43.706 -23.387 -30.050 1.00 65.20 ? 112 LYS B CG 1 +ATOM 2491 C CD . LYS B 2 112 ? 42.819 -23.162 -28.823 1.00 55.22 ? 112 LYS B CD 1 +ATOM 2492 C CE . LYS B 2 112 ? 42.364 -21.733 -28.598 1.00 68.10 ? 112 LYS B CE 1 +ATOM 2493 N NZ . LYS B 2 112 ? 41.326 -21.640 -27.543 1.00 71.79 ? 112 LYS B NZ 1 +ATOM 2494 N N . ARG B 2 113 ? 48.224 -23.597 -31.708 1.00 83.51 ? 113 ARG B N 1 +ATOM 2495 C CA . ARG B 2 113 ? 49.484 -22.930 -32.005 1.00 59.06 ? 113 ARG B CA 1 +ATOM 2496 C C . ARG B 2 113 ? 49.226 -21.950 -33.142 1.00 45.81 ? 113 ARG B C 1 +ATOM 2497 O O . ARG B 2 113 ? 48.082 -21.797 -33.571 1.00 44.78 ? 113 ARG B O 1 +ATOM 2498 C CB . ARG B 2 113 ? 50.611 -23.928 -32.306 1.00 69.38 ? 113 ARG B CB 1 +ATOM 2499 C CG . ARG B 2 113 ? 50.297 -24.964 -33.378 1.00 90.20 ? 113 ARG B CG 1 +ATOM 2500 C CD . ARG B 2 113 ? 51.480 -25.407 -34.224 1.00 86.49 ? 113 ARG B CD 1 +ATOM 2501 N NE . ARG B 2 113 ? 51.757 -24.437 -35.277 1.00 93.89 ? 113 ARG B NE 1 +ATOM 2502 C CZ . ARG B 2 113 ? 52.899 -23.771 -35.436 1.00 65.73 ? 113 ARG B CZ 1 +ATOM 2503 N NH1 . ARG B 2 113 ? 52.866 -22.520 -35.860 1.00 71.75 ? 113 ARG B NH1 1 +ATOM 2504 N NH2 . ARG B 2 113 ? 54.061 -24.336 -35.152 1.00 40.72 ? 113 ARG B NH2 1 +ATOM 2505 N N . THR B 2 114 ? 50.289 -21.288 -33.611 1.00 45.26 ? 114 THR B N 1 +ATOM 2506 C CA . THR B 2 114 ? 50.169 -20.233 -34.609 1.00 44.57 ? 114 THR B CA 1 +ATOM 2507 C C . THR B 2 114 ? 50.041 -20.853 -36.000 1.00 55.27 ? 114 THR B C 1 +ATOM 2508 O O . THR B 2 114 ? 50.286 -22.053 -36.178 1.00 48.33 ? 114 THR B O 1 +ATOM 2509 C CB . THR B 2 114 ? 51.340 -19.255 -34.487 1.00 48.81 ? 114 THR B CB 1 +ATOM 2510 O OG1 . THR B 2 114 ? 52.515 -20.057 -34.615 1.00 49.41 ? 114 THR B OG1 1 +ATOM 2511 C CG2 . THR B 2 114 ? 51.360 -18.517 -33.162 1.00 50.44 ? 114 THR B CG2 1 +ATOM 2512 N N . VAL B 2 115 ? 49.636 -20.030 -36.978 1.00 53.58 ? 115 VAL B N 1 +ATOM 2513 C CA . VAL B 2 115 ? 49.418 -20.535 -38.326 1.00 60.41 ? 115 VAL B CA 1 +ATOM 2514 C C . VAL B 2 115 ? 50.764 -20.960 -38.909 1.00 69.96 ? 115 VAL B C 1 +ATOM 2515 O O . VAL B 2 115 ? 51.801 -20.380 -38.587 1.00 74.35 ? 115 VAL B O 1 +ATOM 2516 C CB . VAL B 2 115 ? 48.657 -19.547 -39.236 1.00 52.41 ? 115 VAL B CB 1 +ATOM 2517 C CG1 . VAL B 2 115 ? 48.699 -19.947 -40.703 1.00 64.89 ? 115 VAL B CG1 1 +ATOM 2518 C CG2 . VAL B 2 115 ? 47.208 -19.381 -38.804 1.00 51.85 ? 115 VAL B CG2 1 +ATOM 2519 N N . ALA B 2 116 ? 50.716 -22.028 -39.713 1.00 66.09 ? 116 ALA B N 1 +ATOM 2520 C CA . ALA B 2 116 ? 51.861 -22.540 -40.442 1.00 68.61 ? 116 ALA B CA 1 +ATOM 2521 C C . ALA B 2 116 ? 51.440 -22.876 -41.870 1.00 70.24 ? 116 ALA B C 1 +ATOM 2522 O O . ALA B 2 116 ? 50.339 -23.381 -42.096 1.00 52.34 ? 116 ALA B O 1 +ATOM 2523 C CB . ALA B 2 116 ? 52.431 -23.739 -39.727 1.00 55.91 ? 116 ALA B CB 1 +ATOM 2524 N N . ALA B 2 117 ? 52.322 -22.555 -42.825 1.00 67.44 ? 117 ALA B N 1 +ATOM 2525 C CA . ALA B 2 117 ? 52.146 -22.979 -44.202 1.00 58.12 ? 117 ALA B CA 1 +ATOM 2526 C C . ALA B 2 117 ? 52.707 -24.391 -44.360 1.00 62.47 ? 117 ALA B C 1 +ATOM 2527 O O . ALA B 2 117 ? 53.719 -24.723 -43.736 1.00 58.80 ? 117 ALA B O 1 +ATOM 2528 C CB . ALA B 2 117 ? 52.816 -22.007 -45.133 1.00 64.27 ? 117 ALA B CB 1 +ATOM 2529 N N . PRO B 2 118 ? 52.047 -25.271 -45.157 1.00 53.48 ? 118 PRO B N 1 +ATOM 2530 C CA . PRO B 2 118 ? 52.645 -26.553 -45.543 1.00 54.75 ? 118 PRO B CA 1 +ATOM 2531 C C . PRO B 2 118 ? 53.778 -26.393 -46.554 1.00 61.82 ? 118 PRO B C 1 +ATOM 2532 O O . PRO B 2 118 ? 53.705 -25.525 -47.431 1.00 78.45 ? 118 PRO B O 1 +ATOM 2533 C CB . PRO B 2 118 ? 51.475 -27.288 -46.226 1.00 57.29 ? 118 PRO B CB 1 +ATOM 2534 C CG . PRO B 2 118 ? 50.578 -26.183 -46.748 1.00 43.25 ? 118 PRO B CG 1 +ATOM 2535 C CD . PRO B 2 118 ? 50.686 -25.095 -45.701 1.00 38.86 ? 118 PRO B CD 1 +ATOM 2536 N N . SER B 2 119 ? 54.822 -27.227 -46.413 1.00 57.79 ? 119 SER B N 1 +ATOM 2537 C CA . SER B 2 119 ? 55.705 -27.552 -47.530 1.00 62.22 ? 119 SER B CA 1 +ATOM 2538 C C . SER B 2 119 ? 54.948 -28.518 -48.436 1.00 57.59 ? 119 SER B C 1 +ATOM 2539 O O . SER B 2 119 ? 54.471 -29.544 -47.953 1.00 70.54 ? 119 SER B O 1 +ATOM 2540 C CB . SER B 2 119 ? 57.019 -28.178 -47.083 1.00 73.64 ? 119 SER B CB 1 +ATOM 2541 O OG . SER B 2 119 ? 57.455 -27.710 -45.813 1.00 76.79 ? 119 SER B OG 1 +ATOM 2542 N N . VAL B 2 120 ? 54.822 -28.194 -49.730 1.00 45.55 ? 120 VAL B N 1 +ATOM 2543 C CA . VAL B 2 120 ? 54.021 -29.029 -50.623 1.00 67.88 ? 120 VAL B CA 1 +ATOM 2544 C C . VAL B 2 120 ? 54.913 -29.765 -51.629 1.00 73.79 ? 120 VAL B C 1 +ATOM 2545 O O . VAL B 2 120 ? 55.729 -29.143 -52.306 1.00 88.41 ? 120 VAL B O 1 +ATOM 2546 C CB . VAL B 2 120 ? 52.890 -28.238 -51.314 1.00 66.22 ? 120 VAL B CB 1 +ATOM 2547 C CG1 . VAL B 2 120 ? 51.893 -29.153 -52.008 1.00 56.75 ? 120 VAL B CG1 1 +ATOM 2548 C CG2 . VAL B 2 120 ? 52.165 -27.314 -50.347 1.00 76.44 ? 120 VAL B CG2 1 +ATOM 2549 N N . PHE B 2 121 ? 54.723 -31.092 -51.728 1.00 75.28 ? 121 PHE B N 1 +ATOM 2550 C CA . PHE B 2 121 ? 55.479 -31.958 -52.627 1.00 64.99 ? 121 PHE B CA 1 +ATOM 2551 C C . PHE B 2 121 ? 54.537 -32.846 -53.441 1.00 60.20 ? 121 PHE B C 1 +ATOM 2552 O O . PHE B 2 121 ? 53.612 -33.437 -52.887 1.00 80.57 ? 121 PHE B O 1 +ATOM 2553 C CB . PHE B 2 121 ? 56.414 -32.884 -51.846 1.00 53.50 ? 121 PHE B CB 1 +ATOM 2554 C CG . PHE B 2 121 ? 57.378 -32.214 -50.902 1.00 62.31 ? 121 PHE B CG 1 +ATOM 2555 C CD1 . PHE B 2 121 ? 58.634 -31.810 -51.337 1.00 65.54 ? 121 PHE B CD1 1 +ATOM 2556 C CD2 . PHE B 2 121 ? 57.042 -32.017 -49.569 1.00 64.63 ? 121 PHE B CD2 1 +ATOM 2557 C CE1 . PHE B 2 121 ? 59.530 -31.210 -50.462 1.00 55.48 ? 121 PHE B CE1 1 +ATOM 2558 C CE2 . PHE B 2 121 ? 57.939 -31.421 -48.694 1.00 67.64 ? 121 PHE B CE2 1 +ATOM 2559 C CZ . PHE B 2 121 ? 59.180 -31.018 -49.142 1.00 63.23 ? 121 PHE B CZ 1 +ATOM 2560 N N . ILE B 2 122 ? 54.818 -32.965 -54.749 1.00 70.92 ? 122 ILE B N 1 +ATOM 2561 C CA . ILE B 2 122 ? 54.075 -33.821 -55.669 1.00 68.29 ? 122 ILE B CA 1 +ATOM 2562 C C . ILE B 2 122 ? 54.905 -35.061 -56.017 1.00 54.65 ? 122 ILE B C 1 +ATOM 2563 O O . ILE B 2 122 ? 56.131 -35.001 -56.050 1.00 67.77 ? 122 ILE B O 1 +ATOM 2564 C CB . ILE B 2 122 ? 53.606 -33.030 -56.913 1.00 58.45 ? 122 ILE B CB 1 +ATOM 2565 C CG1 . ILE B 2 122 ? 52.599 -33.818 -57.761 1.00 52.92 ? 122 ILE B CG1 1 +ATOM 2566 C CG2 . ILE B 2 122 ? 54.788 -32.510 -57.725 1.00 44.29 ? 122 ILE B CG2 1 +ATOM 2567 C CD1 . ILE B 2 122 ? 51.546 -32.960 -58.448 1.00 41.66 ? 122 ILE B CD1 1 +ATOM 2568 N N . PHE B 2 123 ? 54.217 -36.190 -56.246 1.00 55.86 ? 123 PHE B N 1 +ATOM 2569 C CA . PHE B 2 123 ? 54.846 -37.470 -56.543 1.00 49.87 ? 123 PHE B CA 1 +ATOM 2570 C C . PHE B 2 123 ? 54.135 -38.141 -57.716 1.00 53.33 ? 123 PHE B C 1 +ATOM 2571 O O . PHE B 2 123 ? 52.914 -38.298 -57.709 1.00 50.72 ? 123 PHE B O 1 +ATOM 2572 C CB . PHE B 2 123 ? 54.784 -38.427 -55.348 1.00 59.23 ? 123 PHE B CB 1 +ATOM 2573 C CG . PHE B 2 123 ? 55.619 -38.058 -54.148 1.00 54.22 ? 123 PHE B CG 1 +ATOM 2574 C CD1 . PHE B 2 123 ? 56.988 -38.283 -54.135 1.00 54.55 ? 123 PHE B CD1 1 +ATOM 2575 C CD2 . PHE B 2 123 ? 55.029 -37.526 -53.010 1.00 62.22 ? 123 PHE B CD2 1 +ATOM 2576 C CE1 . PHE B 2 123 ? 57.755 -37.960 -53.025 1.00 49.41 ? 123 PHE B CE1 1 +ATOM 2577 C CE2 . PHE B 2 123 ? 55.795 -37.200 -51.898 1.00 60.59 ? 123 PHE B CE2 1 +ATOM 2578 C CZ . PHE B 2 123 ? 57.157 -37.418 -51.908 1.00 62.20 ? 123 PHE B CZ 1 +ATOM 2579 N N . PRO B 2 124 ? 54.876 -38.582 -58.757 1.00 56.60 ? 124 PRO B N 1 +ATOM 2580 C CA . PRO B 2 124 ? 54.289 -39.391 -59.824 1.00 50.06 ? 124 PRO B CA 1 +ATOM 2581 C C . PRO B 2 124 ? 54.124 -40.849 -59.393 1.00 58.00 ? 124 PRO B C 1 +ATOM 2582 O O . PRO B 2 124 ? 54.724 -41.273 -58.406 1.00 71.92 ? 124 PRO B O 1 +ATOM 2583 C CB . PRO B 2 124 ? 55.363 -39.276 -60.912 1.00 64.21 ? 124 PRO B CB 1 +ATOM 2584 C CG . PRO B 2 124 ? 56.666 -39.185 -60.146 1.00 61.72 ? 124 PRO B CG 1 +ATOM 2585 C CD . PRO B 2 124 ? 56.315 -38.330 -58.950 1.00 73.66 ? 124 PRO B CD 1 +ATOM 2586 N N . PRO B 2 125 ? 53.313 -41.667 -60.106 1.00 63.78 ? 125 PRO B N 1 +ATOM 2587 C CA . PRO B 2 125 ? 53.342 -43.124 -59.933 1.00 64.12 ? 125 PRO B CA 1 +ATOM 2588 C C . PRO B 2 125 ? 54.677 -43.753 -60.328 1.00 65.64 ? 125 PRO B C 1 +ATOM 2589 O O . PRO B 2 125 ? 55.325 -43.296 -61.268 1.00 74.59 ? 125 PRO B O 1 +ATOM 2590 C CB . PRO B 2 125 ? 52.252 -43.638 -60.885 1.00 70.27 ? 125 PRO B CB 1 +ATOM 2591 C CG . PRO B 2 125 ? 52.031 -42.509 -61.870 1.00 71.55 ? 125 PRO B CG 1 +ATOM 2592 C CD . PRO B 2 125 ? 52.305 -41.239 -61.091 1.00 73.24 ? 125 PRO B CD 1 +ATOM 2593 N N . SER B 2 126 ? 55.071 -44.802 -59.591 1.00 59.96 ? 126 SER B N 1 +ATOM 2594 C CA . SER B 2 126 ? 56.253 -45.592 -59.897 1.00 52.69 ? 126 SER B CA 1 +ATOM 2595 C C . SER B 2 126 ? 56.048 -46.310 -61.226 1.00 55.23 ? 126 SER B C 1 +ATOM 2596 O O . SER B 2 126 ? 54.921 -46.699 -61.537 1.00 59.19 ? 126 SER B O 1 +ATOM 2597 C CB . SER B 2 126 ? 56.506 -46.593 -58.804 1.00 65.48 ? 126 SER B CB 1 +ATOM 2598 O OG . SER B 2 126 ? 55.649 -47.719 -58.952 1.00 57.10 ? 126 SER B OG 1 +ATOM 2599 N N . ASP B 2 127 ? 57.149 -46.505 -61.973 1.00 63.64 ? 127 ASP B N 1 +ATOM 2600 C CA . ASP B 2 127 ? 57.155 -47.288 -63.206 1.00 75.77 ? 127 ASP B CA 1 +ATOM 2601 C C . ASP B 2 127 ? 56.605 -48.686 -62.927 1.00 68.90 ? 127 ASP B C 1 +ATOM 2602 O O . ASP B 2 127 ? 55.875 -49.249 -63.744 1.00 59.59 ? 127 ASP B O 1 +ATOM 2603 C CB . ASP B 2 127 ? 58.552 -47.372 -63.832 1.00 93.46 ? 127 ASP B CB 1 +ATOM 2604 C CG . ASP B 2 127 ? 59.179 -46.020 -64.136 1.00 122.53 ? 127 ASP B CG 1 +ATOM 2605 O OD1 . ASP B 2 127 ? 59.601 -45.339 -63.175 1.00 129.24 ? 127 ASP B OD1 1 +ATOM 2606 O OD2 . ASP B 2 127 ? 59.240 -45.657 -65.330 1.00 109.74 ? 127 ASP B OD2 1 +ATOM 2607 N N . GLU B 2 128 ? 56.936 -49.191 -61.731 1.00 63.55 ? 128 GLU B N 1 +ATOM 2608 C CA . GLU B 2 128 ? 56.547 -50.493 -61.218 1.00 70.11 ? 128 GLU B CA 1 +ATOM 2609 C C . GLU B 2 128 ? 55.028 -50.635 -61.121 1.00 71.95 ? 128 GLU B C 1 +ATOM 2610 O O . GLU B 2 128 ? 54.517 -51.749 -61.223 1.00 70.40 ? 128 GLU B O 1 +ATOM 2611 C CB . GLU B 2 128 ? 57.167 -50.673 -59.836 1.00 77.10 ? 128 GLU B CB 1 +ATOM 2612 C CG . GLU B 2 128 ? 57.275 -52.120 -59.401 1.00 87.37 ? 128 GLU B CG 1 +ATOM 2613 C CD . GLU B 2 128 ? 57.835 -52.276 -58.001 1.00 85.56 ? 128 GLU B CD 1 +ATOM 2614 O OE1 . GLU B 2 128 ? 58.708 -51.471 -57.628 1.00 77.36 ? 128 GLU B OE1 1 +ATOM 2615 O OE2 . GLU B 2 128 ? 57.384 -53.191 -57.286 1.00 90.66 ? 128 GLU B OE2 1 +ATOM 2616 N N . GLN B 2 129 ? 54.321 -49.514 -60.917 1.00 58.60 ? 129 GLN B N 1 +ATOM 2617 C CA . GLN B 2 129 ? 52.892 -49.545 -60.640 1.00 66.93 ? 129 GLN B CA 1 +ATOM 2618 C C . GLN B 2 129 ? 52.090 -49.616 -61.934 1.00 62.71 ? 129 GLN B C 1 +ATOM 2619 O O . GLN B 2 129 ? 50.967 -50.114 -61.943 1.00 83.35 ? 129 GLN B O 1 +ATOM 2620 C CB . GLN B 2 129 ? 52.455 -48.332 -59.812 1.00 82.76 ? 129 GLN B CB 1 +ATOM 2621 C CG . GLN B 2 129 ? 51.125 -48.530 -59.090 1.00 73.55 ? 129 GLN B CG 1 +ATOM 2622 C CD . GLN B 2 129 ? 50.483 -47.260 -58.584 1.00 76.68 ? 129 GLN B CD 1 +ATOM 2623 O OE1 . GLN B 2 129 ? 51.141 -46.249 -58.342 1.00 91.01 ? 129 GLN B OE1 1 +ATOM 2624 N NE2 . GLN B 2 129 ? 49.175 -47.308 -58.403 1.00 84.54 ? 129 GLN B NE2 1 +ATOM 2625 N N . LEU B 2 130 ? 52.670 -49.106 -63.020 1.00 83.34 ? 130 LEU B N 1 +ATOM 2626 C CA . LEU B 2 130 ? 51.918 -48.855 -64.240 1.00 91.60 ? 130 LEU B CA 1 +ATOM 2627 C C . LEU B 2 130 ? 51.701 -50.154 -65.011 1.00 89.78 ? 130 LEU B C 1 +ATOM 2628 O O . LEU B 2 130 ? 50.853 -50.216 -65.901 1.00 82.44 ? 130 LEU B O 1 +ATOM 2629 C CB . LEU B 2 130 ? 52.672 -47.806 -65.058 1.00 80.43 ? 130 LEU B CB 1 +ATOM 2630 C CG . LEU B 2 130 ? 52.766 -46.439 -64.381 1.00 70.08 ? 130 LEU B CG 1 +ATOM 2631 C CD1 . LEU B 2 130 ? 54.126 -45.805 -64.612 1.00 54.38 ? 130 LEU B CD1 1 +ATOM 2632 C CD2 . LEU B 2 130 ? 51.637 -45.519 -64.829 1.00 68.80 ? 130 LEU B CD2 1 +ATOM 2633 N N . LYS B 2 131 ? 52.468 -51.184 -64.632 1.00 85.59 ? 131 LYS B N 1 +ATOM 2634 C CA . LYS B 2 131 ? 52.308 -52.542 -65.127 1.00 72.14 ? 131 LYS B CA 1 +ATOM 2635 C C . LYS B 2 131 ? 50.948 -53.080 -64.687 1.00 71.97 ? 131 LYS B C 1 +ATOM 2636 O O . LYS B 2 131 ? 50.233 -53.684 -65.484 1.00 74.06 ? 131 LYS B O 1 +ATOM 2637 C CB . LYS B 2 131 ? 53.483 -53.413 -64.662 1.00 57.97 ? 131 LYS B CB 1 +ATOM 2638 C CG . LYS B 2 131 ? 54.866 -52.899 -65.053 1.00 63.72 ? 131 LYS B CG 1 +ATOM 2639 C CD . LYS B 2 131 ? 56.016 -53.684 -64.456 1.00 74.26 ? 131 LYS B CD 1 +ATOM 2640 C CE . LYS B 2 131 ? 57.285 -52.867 -64.321 1.00 86.85 ? 131 LYS B CE 1 +ATOM 2641 N NZ . LYS B 2 131 ? 58.143 -53.355 -63.213 1.00 89.90 ? 131 LYS B NZ 1 +ATOM 2642 N N . SER B 2 132 ? 50.581 -52.812 -63.426 1.00 81.09 ? 132 SER B N 1 +ATOM 2643 C CA . SER B 2 132 ? 49.341 -53.312 -62.852 1.00 90.19 ? 132 SER B CA 1 +ATOM 2644 C C . SER B 2 132 ? 48.138 -52.490 -63.317 1.00 87.14 ? 132 SER B C 1 +ATOM 2645 O O . SER B 2 132 ? 47.006 -52.783 -62.933 1.00 109.27 ? 132 SER B O 1 +ATOM 2646 C CB . SER B 2 132 ? 49.424 -53.452 -61.341 1.00 110.49 ? 132 SER B CB 1 +ATOM 2647 O OG . SER B 2 132 ? 49.372 -52.189 -60.693 1.00 128.88 ? 132 SER B OG 1 +ATOM 2648 N N . GLY B 2 133 ? 48.395 -51.465 -64.145 1.00 90.25 ? 133 GLY B N 1 +ATOM 2649 C CA . GLY B 2 133 ? 47.357 -50.760 -64.887 1.00 84.38 ? 133 GLY B CA 1 +ATOM 2650 C C . GLY B 2 133 ? 46.715 -49.610 -64.112 1.00 100.32 ? 133 GLY B C 1 +ATOM 2651 O O . GLY B 2 133 ? 45.876 -48.896 -64.661 1.00 86.97 ? 133 GLY B O 1 +ATOM 2652 N N . THR B 2 134 ? 47.103 -49.452 -62.837 1.00 116.07 ? 134 THR B N 1 +ATOM 2653 C CA . THR B 2 134 ? 46.646 -48.360 -61.990 1.00 93.75 ? 134 THR B CA 1 +ATOM 2654 C C . THR B 2 134 ? 47.781 -47.353 -61.824 1.00 95.84 ? 134 THR B C 1 +ATOM 2655 O O . THR B 2 134 ? 48.909 -47.734 -61.512 1.00 114.13 ? 134 THR B O 1 +ATOM 2656 C CB . THR B 2 134 ? 46.145 -48.863 -60.626 1.00 79.84 ? 134 THR B CB 1 +ATOM 2657 O OG1 . THR B 2 134 ? 45.103 -49.817 -60.825 1.00 84.88 ? 134 THR B OG1 1 +ATOM 2658 C CG2 . THR B 2 134 ? 45.611 -47.758 -59.741 1.00 71.01 ? 134 THR B CG2 1 +ATOM 2659 N N . ALA B 2 135 ? 47.456 -46.074 -62.044 1.00 93.32 ? 135 ALA B N 1 +ATOM 2660 C CA . ALA B 2 135 ? 48.367 -44.969 -61.796 1.00 99.23 ? 135 ALA B CA 1 +ATOM 2661 C C . ALA B 2 135 ? 47.873 -44.148 -60.604 1.00 108.36 ? 135 ALA B C 1 +ATOM 2662 O O . ALA B 2 135 ? 46.776 -43.588 -60.640 1.00 97.63 ? 135 ALA B O 1 +ATOM 2663 C CB . ALA B 2 135 ? 48.506 -44.132 -63.043 1.00 106.95 ? 135 ALA B CB 1 +ATOM 2664 N N . SER B 2 136 ? 48.700 -44.103 -59.550 1.00 85.87 ? 136 SER B N 1 +ATOM 2665 C CA . SER B 2 136 ? 48.429 -43.338 -58.343 1.00 77.00 ? 136 SER B CA 1 +ATOM 2666 C C . SER B 2 136 ? 49.343 -42.114 -58.280 1.00 67.89 ? 136 SER B C 1 +ATOM 2667 O O . SER B 2 136 ? 50.563 -42.244 -58.354 1.00 73.97 ? 136 SER B O 1 +ATOM 2668 C CB . SER B 2 136 ? 48.585 -44.197 -57.110 1.00 79.80 ? 136 SER B CB 1 +ATOM 2669 O OG . SER B 2 136 ? 47.520 -45.128 -56.991 1.00 79.60 ? 136 SER B OG 1 +ATOM 2670 N N . VAL B 2 137 ? 48.736 -40.931 -58.125 1.00 64.93 ? 137 VAL B N 1 +ATOM 2671 C CA . VAL B 2 137 ? 49.467 -39.682 -57.938 1.00 65.23 ? 137 VAL B CA 1 +ATOM 2672 C C . VAL B 2 137 ? 49.232 -39.175 -56.513 1.00 47.15 ? 137 VAL B C 1 +ATOM 2673 O O . VAL B 2 137 ? 48.084 -39.042 -56.083 1.00 43.27 ? 137 VAL B O 1 +ATOM 2674 C CB . VAL B 2 137 ? 49.075 -38.612 -58.980 1.00 57.64 ? 137 VAL B CB 1 +ATOM 2675 C CG1 . VAL B 2 137 ? 50.226 -37.664 -59.255 1.00 45.17 ? 137 VAL B CG1 1 +ATOM 2676 C CG2 . VAL B 2 137 ? 48.547 -39.206 -60.281 1.00 54.94 ? 137 VAL B CG2 1 +ATOM 2677 N N . VAL B 2 138 ? 50.329 -38.868 -55.804 1.00 42.53 ? 138 VAL B N 1 +ATOM 2678 C CA . VAL B 2 138 ? 50.279 -38.471 -54.402 1.00 52.03 ? 138 VAL B CA 1 +ATOM 2679 C C . VAL B 2 138 ? 50.825 -37.057 -54.221 1.00 69.49 ? 138 VAL B C 1 +ATOM 2680 O O . VAL B 2 138 ? 51.992 -36.792 -54.516 1.00 70.18 ? 138 VAL B O 1 +ATOM 2681 C CB . VAL B 2 138 ? 51.031 -39.463 -53.490 1.00 58.68 ? 138 VAL B CB 1 +ATOM 2682 C CG1 . VAL B 2 138 ? 51.034 -39.014 -52.031 1.00 60.30 ? 138 VAL B CG1 1 +ATOM 2683 C CG2 . VAL B 2 138 ? 50.489 -40.881 -53.611 1.00 45.80 ? 138 VAL B CG2 1 +ATOM 2684 N N . CYS B 2 139 ? 49.962 -36.185 -53.681 1.00 73.70 ? 139 CYS B N 1 +ATOM 2685 C CA . CYS B 2 139 ? 50.294 -34.863 -53.168 1.00 61.85 ? 139 CYS B CA 1 +ATOM 2686 C C . CYS B 2 139 ? 50.501 -34.960 -51.654 1.00 55.82 ? 139 CYS B C 1 +ATOM 2687 O O . CYS B 2 139 ? 49.788 -35.705 -50.983 1.00 61.97 ? 139 CYS B O 1 +ATOM 2688 C CB . CYS B 2 139 ? 49.131 -33.924 -53.465 1.00 61.41 ? 139 CYS B CB 1 +ATOM 2689 S SG . CYS B 2 139 ? 49.497 -32.166 -53.246 1.00 82.71 ? 139 CYS B SG 1 +ATOM 2690 N N . LEU B 2 140 ? 51.481 -34.215 -51.122 1.00 62.32 ? 140 LEU B N 1 +ATOM 2691 C CA . LEU B 2 140 ? 51.754 -34.169 -49.688 1.00 69.99 ? 140 LEU B CA 1 +ATOM 2692 C C . LEU B 2 140 ? 51.942 -32.725 -49.213 1.00 74.47 ? 140 LEU B C 1 +ATOM 2693 O O . LEU B 2 140 ? 52.711 -31.960 -49.801 1.00 61.68 ? 140 LEU B O 1 +ATOM 2694 C CB . LEU B 2 140 ? 52.973 -35.047 -49.359 1.00 62.32 ? 140 LEU B CB 1 +ATOM 2695 C CG . LEU B 2 140 ? 53.801 -34.665 -48.125 1.00 63.26 ? 140 LEU B CG 1 +ATOM 2696 C CD1 . LEU B 2 140 ? 53.130 -35.116 -46.837 1.00 81.51 ? 140 LEU B CD1 1 +ATOM 2697 C CD2 . LEU B 2 140 ? 55.216 -35.230 -48.197 1.00 57.24 ? 140 LEU B CD2 1 +ATOM 2698 N N . LEU B 2 141 ? 51.225 -32.395 -48.126 1.00 69.72 ? 141 LEU B N 1 +ATOM 2699 C CA . LEU B 2 141 ? 51.307 -31.146 -47.379 1.00 49.83 ? 141 LEU B CA 1 +ATOM 2700 C C . LEU B 2 141 ? 51.983 -31.472 -46.051 1.00 55.53 ? 141 LEU B C 1 +ATOM 2701 O O . LEU B 2 141 ? 51.446 -32.259 -45.268 1.00 67.67 ? 141 LEU B O 1 +ATOM 2702 C CB . LEU B 2 141 ? 49.888 -30.620 -47.113 1.00 50.56 ? 141 LEU B CB 1 +ATOM 2703 C CG . LEU B 2 141 ? 48.975 -30.289 -48.300 1.00 55.51 ? 141 LEU B CG 1 +ATOM 2704 C CD1 . LEU B 2 141 ? 48.615 -31.520 -49.123 1.00 69.38 ? 141 LEU B CD1 1 +ATOM 2705 C CD2 . LEU B 2 141 ? 47.688 -29.644 -47.805 1.00 50.15 ? 141 LEU B CD2 1 +ATOM 2706 N N . ASN B 2 142 ? 53.156 -30.870 -45.807 1.00 63.23 ? 142 ASN B N 1 +ATOM 2707 C CA . ASN B 2 142 ? 54.005 -31.226 -44.677 1.00 70.15 ? 142 ASN B CA 1 +ATOM 2708 C C . ASN B 2 142 ? 54.052 -30.093 -43.647 1.00 71.34 ? 142 ASN B C 1 +ATOM 2709 O O . ASN B 2 142 ? 54.434 -28.967 -43.967 1.00 74.99 ? 142 ASN B O 1 +ATOM 2710 C CB . ASN B 2 142 ? 55.412 -31.626 -45.132 1.00 55.08 ? 142 ASN B CB 1 +ATOM 2711 C CG . ASN B 2 142 ? 56.026 -32.754 -44.326 1.00 70.89 ? 142 ASN B CG 1 +ATOM 2712 O OD1 . ASN B 2 142 ? 55.340 -33.691 -43.915 1.00 83.07 ? 142 ASN B OD1 1 +ATOM 2713 N ND2 . ASN B 2 142 ? 57.330 -32.688 -44.116 1.00 50.59 ? 142 ASN B ND2 1 +ATOM 2714 N N . ASN B 2 143 ? 53.649 -30.423 -42.411 1.00 54.89 ? 143 ASN B N 1 +ATOM 2715 C CA . ASN B 2 143 ? 53.830 -29.604 -41.222 1.00 67.16 ? 143 ASN B CA 1 +ATOM 2716 C C . ASN B 2 143 ? 53.142 -28.246 -41.385 1.00 79.58 ? 143 ASN B C 1 +ATOM 2717 O O . ASN B 2 143 ? 53.789 -27.244 -41.689 1.00 83.25 ? 143 ASN B O 1 +ATOM 2718 C CB . ASN B 2 143 ? 55.296 -29.554 -40.768 1.00 67.04 ? 143 ASN B CB 1 +ATOM 2719 C CG . ASN B 2 143 ? 56.014 -30.889 -40.819 1.00 69.50 ? 143 ASN B CG 1 +ATOM 2720 O OD1 . ASN B 2 143 ? 57.157 -30.962 -41.264 1.00 76.91 ? 143 ASN B OD1 1 +ATOM 2721 N ND2 . ASN B 2 143 ? 55.366 -31.947 -40.360 1.00 63.12 ? 143 ASN B ND2 1 +ATOM 2722 N N . PHE B 2 144 ? 51.819 -28.236 -41.171 1.00 72.78 ? 144 PHE B N 1 +ATOM 2723 C CA . PHE B 2 144 ? 51.004 -27.034 -41.271 1.00 53.19 ? 144 PHE B CA 1 +ATOM 2724 C C . PHE B 2 144 ? 50.016 -26.981 -40.107 1.00 70.94 ? 144 PHE B C 1 +ATOM 2725 O O . PHE B 2 144 ? 49.767 -27.997 -39.459 1.00 72.27 ? 144 PHE B O 1 +ATOM 2726 C CB . PHE B 2 144 ? 50.280 -27.001 -42.617 1.00 52.69 ? 144 PHE B CB 1 +ATOM 2727 C CG . PHE B 2 144 ? 49.222 -28.061 -42.813 1.00 71.14 ? 144 PHE B CG 1 +ATOM 2728 C CD1 . PHE B 2 144 ? 49.569 -29.371 -43.123 1.00 68.38 ? 144 PHE B CD1 1 +ATOM 2729 C CD2 . PHE B 2 144 ? 47.871 -27.745 -42.703 1.00 70.68 ? 144 PHE B CD2 1 +ATOM 2730 C CE1 . PHE B 2 144 ? 48.596 -30.345 -43.302 1.00 62.79 ? 144 PHE B CE1 1 +ATOM 2731 C CE2 . PHE B 2 144 ? 46.897 -28.720 -42.883 1.00 73.18 ? 144 PHE B CE2 1 +ATOM 2732 C CZ . PHE B 2 144 ? 47.261 -30.017 -43.183 1.00 64.06 ? 144 PHE B CZ 1 +ATOM 2733 N N . TYR B 2 145 ? 49.477 -25.777 -39.855 1.00 80.71 ? 145 TYR B N 1 +ATOM 2734 C CA . TYR B 2 145 ? 48.356 -25.558 -38.952 1.00 82.65 ? 145 TYR B CA 1 +ATOM 2735 C C . TYR B 2 145 ? 47.502 -24.398 -39.469 1.00 87.94 ? 145 TYR B C 1 +ATOM 2736 O O . TYR B 2 145 ? 48.049 -23.328 -39.734 1.00 100.07 ? 145 TYR B O 1 +ATOM 2737 C CB . TYR B 2 145 ? 48.849 -25.270 -37.532 1.00 63.03 ? 145 TYR B CB 1 +ATOM 2738 C CG . TYR B 2 145 ? 47.737 -25.224 -36.516 1.00 65.06 ? 145 TYR B CG 1 +ATOM 2739 C CD1 . TYR B 2 145 ? 47.072 -24.038 -36.234 1.00 58.89 ? 145 TYR B CD1 1 +ATOM 2740 C CD2 . TYR B 2 145 ? 47.320 -26.376 -35.867 1.00 73.13 ? 145 TYR B CD2 1 +ATOM 2741 C CE1 . TYR B 2 145 ? 46.040 -23.992 -35.309 1.00 87.33 ? 145 TYR B CE1 1 +ATOM 2742 C CE2 . TYR B 2 145 ? 46.290 -26.348 -34.940 1.00 112.61 ? 145 TYR B CE2 1 +ATOM 2743 C CZ . TYR B 2 145 ? 45.650 -25.152 -34.658 1.00 124.14 ? 145 TYR B CZ 1 +ATOM 2744 O OH . TYR B 2 145 ? 44.638 -25.120 -33.743 1.00 153.64 ? 145 TYR B OH 1 +ATOM 2745 N N . PRO B 2 146 ? 46.166 -24.568 -39.549 1.00 78.04 ? 146 PRO B N 1 +ATOM 2746 C CA . PRO B 2 146 ? 45.397 -25.664 -38.969 1.00 82.99 ? 146 PRO B CA 1 +ATOM 2747 C C . PRO B 2 146 ? 44.930 -26.736 -39.952 1.00 77.54 ? 146 PRO B C 1 +ATOM 2748 O O . PRO B 2 146 ? 45.144 -26.606 -41.156 1.00 98.31 ? 146 PRO B O 1 +ATOM 2749 C CB . PRO B 2 146 ? 44.180 -24.957 -38.351 1.00 85.45 ? 146 PRO B CB 1 +ATOM 2750 C CG . PRO B 2 146 ? 43.908 -23.809 -39.292 1.00 78.80 ? 146 PRO B CG 1 +ATOM 2751 C CD . PRO B 2 146 ? 45.270 -23.434 -39.838 1.00 75.26 ? 146 PRO B CD 1 +ATOM 2752 N N . ARG B 2 147 ? 44.258 -27.767 -39.410 1.00 72.05 ? 147 ARG B N 1 +ATOM 2753 C CA . ARG B 2 147 ? 43.879 -28.990 -40.108 1.00 66.12 ? 147 ARG B CA 1 +ATOM 2754 C C . ARG B 2 147 ? 43.030 -28.675 -41.337 1.00 64.21 ? 147 ARG B C 1 +ATOM 2755 O O . ARG B 2 147 ? 42.873 -29.525 -42.209 1.00 66.23 ? 147 ARG B O 1 +ATOM 2756 C CB . ARG B 2 147 ? 43.125 -29.945 -39.173 1.00 58.93 ? 147 ARG B CB 1 +ATOM 2757 N N . GLU B 2 148 ? 42.505 -27.444 -41.388 1.00 59.40 ? 148 GLU B N 1 +ATOM 2758 C CA . GLU B 2 148 ? 41.617 -26.989 -42.445 1.00 76.32 ? 148 GLU B CA 1 +ATOM 2759 C C . GLU B 2 148 ? 42.457 -26.514 -43.629 1.00 82.07 ? 148 GLU B C 1 +ATOM 2760 O O . GLU B 2 148 ? 43.420 -25.764 -43.458 1.00 82.74 ? 148 GLU B O 1 +ATOM 2761 C CB . GLU B 2 148 ? 40.669 -25.905 -41.925 1.00 91.08 ? 148 GLU B CB 1 +ATOM 2762 C CG . GLU B 2 148 ? 39.772 -26.360 -40.780 1.00 110.16 ? 148 GLU B CG 1 +ATOM 2763 C CD . GLU B 2 148 ? 40.325 -26.189 -39.372 1.00 118.78 ? 148 GLU B CD 1 +ATOM 2764 O OE1 . GLU B 2 148 ? 39.700 -25.451 -38.584 1.00 125.01 ? 148 GLU B OE1 1 +ATOM 2765 O OE2 . GLU B 2 148 ? 41.368 -26.802 -39.056 1.00 133.59 ? 148 GLU B OE2 1 +ATOM 2766 N N . ALA B 2 149 ? 42.070 -26.981 -44.822 1.00 67.15 ? 149 ALA B N 1 +ATOM 2767 C CA . ALA B 2 149 ? 42.821 -26.835 -46.057 1.00 55.30 ? 149 ALA B CA 1 +ATOM 2768 C C . ALA B 2 149 ? 41.989 -27.409 -47.197 1.00 77.59 ? 149 ALA B C 1 +ATOM 2769 O O . ALA B 2 149 ? 41.275 -28.395 -47.009 1.00 102.78 ? 149 ALA B O 1 +ATOM 2770 C CB . ALA B 2 149 ? 44.131 -27.576 -45.954 1.00 48.32 ? 149 ALA B CB 1 +ATOM 2771 N N . LYS B 2 150 ? 42.112 -26.790 -48.375 1.00 64.66 ? 150 LYS B N 1 +ATOM 2772 C CA . LYS B 2 150 ? 41.443 -27.258 -49.576 1.00 61.00 ? 150 LYS B CA 1 +ATOM 2773 C C . LYS B 2 150 ? 42.516 -27.693 -50.577 1.00 76.88 ? 150 LYS B C 1 +ATOM 2774 O O . LYS B 2 150 ? 43.307 -26.870 -51.038 1.00 91.54 ? 150 LYS B O 1 +ATOM 2775 C CB . LYS B 2 150 ? 40.497 -26.162 -50.084 1.00 59.86 ? 150 LYS B CB 1 +ATOM 2776 C CG . LYS B 2 150 ? 39.626 -26.512 -51.286 1.00 72.62 ? 150 LYS B CG 1 +ATOM 2777 C CD . LYS B 2 150 ? 39.379 -25.345 -52.239 1.00 62.40 ? 150 LYS B CD 1 +ATOM 2778 C CE . LYS B 2 150 ? 38.063 -24.625 -52.021 1.00 81.09 ? 150 LYS B CE 1 +ATOM 2779 N NZ . LYS B 2 150 ? 36.925 -25.353 -52.635 1.00 75.01 ? 150 LYS B NZ 1 +ATOM 2780 N N . VAL B 2 151 ? 42.553 -29.002 -50.873 1.00 76.93 ? 151 VAL B N 1 +ATOM 2781 C CA . VAL B 2 151 ? 43.440 -29.579 -51.876 1.00 71.68 ? 151 VAL B CA 1 +ATOM 2782 C C . VAL B 2 151 ? 42.613 -29.886 -53.123 1.00 84.90 ? 151 VAL B C 1 +ATOM 2783 O O . VAL B 2 151 ? 41.602 -30.577 -53.025 1.00 100.72 ? 151 VAL B O 1 +ATOM 2784 C CB . VAL B 2 151 ? 44.170 -30.840 -51.362 1.00 66.55 ? 151 VAL B CB 1 +ATOM 2785 C CG1 . VAL B 2 151 ? 45.260 -31.297 -52.321 1.00 73.24 ? 151 VAL B CG1 1 +ATOM 2786 C CG2 . VAL B 2 151 ? 44.751 -30.653 -49.966 1.00 78.83 ? 151 VAL B CG2 1 +ATOM 2787 N N . GLN B 2 152 ? 43.043 -29.375 -54.287 1.00 72.53 ? 152 GLN B N 1 +ATOM 2788 C CA . GLN B 2 152 ? 42.336 -29.649 -55.531 1.00 83.23 ? 152 GLN B CA 1 +ATOM 2789 C C . GLN B 2 152 ? 43.314 -30.145 -56.595 1.00 91.71 ? 152 GLN B C 1 +ATOM 2790 O O . GLN B 2 152 ? 44.333 -29.506 -56.844 1.00 119.65 ? 152 GLN B O 1 +ATOM 2791 C CB . GLN B 2 152 ? 41.524 -28.432 -55.988 1.00 70.94 ? 152 GLN B CB 1 +ATOM 2792 N N . TRP B 2 153 ? 42.985 -31.290 -57.210 1.00 82.62 ? 153 TRP B N 1 +ATOM 2793 C CA . TRP B 2 153 ? 43.777 -31.880 -58.281 1.00 73.76 ? 153 TRP B CA 1 +ATOM 2794 C C . TRP B 2 153 ? 43.371 -31.287 -59.628 1.00 67.15 ? 153 TRP B C 1 +ATOM 2795 O O . TRP B 2 153 ? 42.180 -31.148 -59.911 1.00 76.11 ? 153 TRP B O 1 +ATOM 2796 C CB . TRP B 2 153 ? 43.651 -33.415 -58.287 1.00 68.44 ? 153 TRP B CB 1 +ATOM 2797 C CG . TRP B 2 153 ? 44.490 -34.119 -57.262 1.00 53.02 ? 153 TRP B CG 1 +ATOM 2798 C CD1 . TRP B 2 153 ? 44.076 -34.589 -56.051 1.00 57.56 ? 153 TRP B CD1 1 +ATOM 2799 C CD2 . TRP B 2 153 ? 45.896 -34.427 -57.348 1.00 54.90 ? 153 TRP B CD2 1 +ATOM 2800 N NE1 . TRP B 2 153 ? 45.121 -35.163 -55.377 1.00 65.09 ? 153 TRP B NE1 1 +ATOM 2801 C CE2 . TRP B 2 153 ? 46.250 -35.078 -56.145 1.00 55.50 ? 153 TRP B CE2 1 +ATOM 2802 C CE3 . TRP B 2 153 ? 46.893 -34.217 -58.314 1.00 60.04 ? 153 TRP B CE3 1 +ATOM 2803 C CZ2 . TRP B 2 153 ? 47.551 -35.521 -55.895 1.00 66.09 ? 153 TRP B CZ2 1 +ATOM 2804 C CZ3 . TRP B 2 153 ? 48.180 -34.650 -58.066 1.00 50.84 ? 153 TRP B CZ3 1 +ATOM 2805 C CH2 . TRP B 2 153 ? 48.502 -35.292 -56.868 1.00 63.46 ? 153 TRP B CH2 1 +ATOM 2806 N N . LYS B 2 154 ? 44.377 -30.960 -60.454 1.00 78.09 ? 154 LYS B N 1 +ATOM 2807 C CA . LYS B 2 154 ? 44.178 -30.494 -61.820 1.00 83.19 ? 154 LYS B CA 1 +ATOM 2808 C C . LYS B 2 154 ? 45.019 -31.325 -62.787 1.00 98.65 ? 154 LYS B C 1 +ATOM 2809 O O . LYS B 2 154 ? 46.220 -31.503 -62.582 1.00 115.46 ? 154 LYS B O 1 +ATOM 2810 C CB . LYS B 2 154 ? 44.520 -29.008 -61.965 1.00 81.85 ? 154 LYS B CB 1 +ATOM 2811 C CG . LYS B 2 154 ? 43.339 -28.055 -61.844 1.00 98.25 ? 154 LYS B CG 1 +ATOM 2812 C CD . LYS B 2 154 ? 43.741 -26.598 -61.870 1.00 93.04 ? 154 LYS B CD 1 +ATOM 2813 C CE . LYS B 2 154 ? 42.611 -25.675 -61.468 1.00 110.61 ? 154 LYS B CE 1 +ATOM 2814 N NZ . LYS B 2 154 ? 43.011 -24.252 -61.566 1.00 111.64 ? 154 LYS B NZ 1 +ATOM 2815 N N . VAL B 2 155 ? 44.358 -31.812 -63.844 1.00 94.14 ? 155 VAL B N 1 +ATOM 2816 C CA . VAL B 2 155 ? 44.980 -32.570 -64.920 1.00 83.64 ? 155 VAL B CA 1 +ATOM 2817 C C . VAL B 2 155 ? 44.835 -31.746 -66.195 1.00 69.80 ? 155 VAL B C 1 +ATOM 2818 O O . VAL B 2 155 ? 43.742 -31.661 -66.744 1.00 63.37 ? 155 VAL B O 1 +ATOM 2819 C CB . VAL B 2 155 ? 44.328 -33.962 -65.059 1.00 77.23 ? 155 VAL B CB 1 +ATOM 2820 C CG1 . VAL B 2 155 ? 44.833 -34.725 -66.271 1.00 79.32 ? 155 VAL B CG1 1 +ATOM 2821 C CG2 . VAL B 2 155 ? 44.509 -34.799 -63.805 1.00 97.59 ? 155 VAL B CG2 1 +ATOM 2822 N N . ASP B 2 156 ? 45.941 -31.131 -66.639 1.00 84.96 ? 156 ASP B N 1 +ATOM 2823 C CA . ASP B 2 156 ? 45.951 -30.166 -67.734 1.00 89.89 ? 156 ASP B CA 1 +ATOM 2824 C C . ASP B 2 156 ? 44.822 -29.153 -67.542 1.00 85.15 ? 156 ASP B C 1 +ATOM 2825 O O . ASP B 2 156 ? 43.907 -29.078 -68.363 1.00 85.15 ? 156 ASP B O 1 +ATOM 2826 C CB . ASP B 2 156 ? 45.863 -30.832 -69.114 1.00 77.74 ? 156 ASP B CB 1 +ATOM 2827 C CG . ASP B 2 156 ? 46.790 -32.017 -69.318 1.00 85.39 ? 156 ASP B CG 1 +ATOM 2828 O OD1 . ASP B 2 156 ? 47.876 -32.026 -68.709 1.00 90.03 ? 156 ASP B OD1 1 +ATOM 2829 O OD2 . ASP B 2 156 ? 46.416 -32.922 -70.092 1.00 77.43 ? 156 ASP B OD2 1 +ATOM 2830 N N . ASN B 2 157 ? 44.876 -28.423 -66.420 1.00 84.97 ? 157 ASN B N 1 +ATOM 2831 C CA . ASN B 2 157 ? 43.929 -27.372 -66.061 1.00 100.84 ? 157 ASN B CA 1 +ATOM 2832 C C . ASN B 2 157 ? 42.539 -27.934 -65.733 1.00 114.63 ? 157 ASN B C 1 +ATOM 2833 O O . ASN B 2 157 ? 41.703 -27.209 -65.193 1.00 125.20 ? 157 ASN B O 1 +ATOM 2834 C CB . ASN B 2 157 ? 43.922 -26.220 -67.075 1.00 74.44 ? 157 ASN B CB 1 +ATOM 2835 N N . ALA B 2 158 ? 42.299 -29.221 -66.038 1.00 94.74 ? 158 ALA B N 1 +ATOM 2836 C CA . ALA B 2 158 ? 41.006 -29.856 -65.808 1.00 90.24 ? 158 ALA B CA 1 +ATOM 2837 C C . ALA B 2 158 ? 40.867 -30.276 -64.346 1.00 87.18 ? 158 ALA B C 1 +ATOM 2838 O O . ALA B 2 158 ? 41.658 -31.067 -63.833 1.00 102.05 ? 158 ALA B O 1 +ATOM 2839 C CB . ALA B 2 158 ? 40.792 -31.019 -66.750 1.00 69.54 ? 158 ALA B CB 1 +ATOM 2840 N N . LEU B 2 159 ? 39.830 -29.741 -63.697 1.00 69.49 ? 159 LEU B N 1 +ATOM 2841 C CA . LEU B 2 159 ? 39.606 -29.953 -62.279 1.00 72.00 ? 159 LEU B CA 1 +ATOM 2842 C C . LEU B 2 159 ? 38.900 -31.292 -62.078 1.00 62.89 ? 159 LEU B C 1 +ATOM 2843 O O . LEU B 2 159 ? 37.679 -31.386 -62.214 1.00 58.60 ? 159 LEU B O 1 +ATOM 2844 C CB . LEU B 2 159 ? 38.811 -28.760 -61.729 1.00 77.22 ? 159 LEU B CB 1 +ATOM 2845 C CG . LEU B 2 159 ? 38.636 -28.698 -60.212 1.00 61.36 ? 159 LEU B CG 1 +ATOM 2846 C CD1 . LEU B 2 159 ? 39.196 -27.399 -59.654 1.00 71.45 ? 159 LEU B CD1 1 +ATOM 2847 C CD2 . LEU B 2 159 ? 37.168 -28.846 -59.838 1.00 64.12 ? 159 LEU B CD2 1 +ATOM 2848 N N . GLN B 2 160 ? 39.704 -32.317 -61.763 1.00 70.88 ? 160 GLN B N 1 +ATOM 2849 C CA . GLN B 2 160 ? 39.236 -33.639 -61.370 1.00 72.81 ? 160 GLN B CA 1 +ATOM 2850 C C . GLN B 2 160 ? 38.409 -33.537 -60.093 1.00 88.39 ? 160 GLN B C 1 +ATOM 2851 O O . GLN B 2 160 ? 38.723 -32.727 -59.218 1.00 88.99 ? 160 GLN B O 1 +ATOM 2852 C CB . GLN B 2 160 ? 40.420 -34.557 -61.067 1.00 66.43 ? 160 GLN B CB 1 +ATOM 2853 C CG . GLN B 2 160 ? 41.385 -34.735 -62.225 1.00 82.61 ? 160 GLN B CG 1 +ATOM 2854 C CD . GLN B 2 160 ? 40.721 -35.301 -63.456 1.00 96.94 ? 160 GLN B CD 1 +ATOM 2855 O OE1 . GLN B 2 160 ? 40.284 -36.450 -63.483 1.00 78.10 ? 160 GLN B OE1 1 +ATOM 2856 N NE2 . GLN B 2 160 ? 40.647 -34.485 -64.493 1.00 120.81 ? 160 GLN B NE2 1 +ATOM 2857 N N . SER B 2 161 ? 37.365 -34.377 -60.004 1.00 93.31 ? 161 SER B N 1 +ATOM 2858 C CA . SER B 2 161 ? 36.495 -34.445 -58.837 1.00 99.08 ? 161 SER B CA 1 +ATOM 2859 C C . SER B 2 161 ? 36.011 -35.874 -58.604 1.00 94.74 ? 161 SER B C 1 +ATOM 2860 O O . SER B 2 161 ? 35.546 -36.532 -59.536 1.00 82.64 ? 161 SER B O 1 +ATOM 2861 C CB . SER B 2 161 ? 35.337 -33.484 -58.953 1.00 103.19 ? 161 SER B CB 1 +ATOM 2862 O OG . SER B 2 161 ? 35.663 -32.228 -58.375 1.00 85.99 ? 161 SER B OG 1 +ATOM 2863 N N . GLY B 2 162 ? 36.131 -36.325 -57.345 1.00 81.72 ? 162 GLY B N 1 +ATOM 2864 C CA . GLY B 2 162 ? 35.656 -37.626 -56.895 1.00 77.73 ? 162 GLY B CA 1 +ATOM 2865 C C . GLY B 2 162 ? 36.456 -38.796 -57.469 1.00 90.54 ? 162 GLY B C 1 +ATOM 2866 O O . GLY B 2 162 ? 35.878 -39.826 -57.812 1.00 97.84 ? 162 GLY B O 1 +ATOM 2867 N N . ASN B 2 163 ? 37.782 -38.622 -57.568 1.00 87.64 ? 163 ASN B N 1 +ATOM 2868 C CA . ASN B 2 163 ? 38.718 -39.659 -57.980 1.00 64.06 ? 163 ASN B CA 1 +ATOM 2869 C C . ASN B 2 163 ? 39.946 -39.614 -57.070 1.00 73.21 ? 163 ASN B C 1 +ATOM 2870 O O . ASN B 2 163 ? 41.013 -40.118 -57.424 1.00 81.49 ? 163 ASN B O 1 +ATOM 2871 C CB . ASN B 2 163 ? 39.064 -39.550 -59.472 1.00 66.06 ? 163 ASN B CB 1 +ATOM 2872 C CG . ASN B 2 163 ? 39.894 -38.332 -59.836 1.00 71.88 ? 163 ASN B CG 1 +ATOM 2873 O OD1 . ASN B 2 163 ? 39.725 -37.252 -59.275 1.00 76.35 ? 163 ASN B OD1 1 +ATOM 2874 N ND2 . ASN B 2 163 ? 40.799 -38.489 -60.788 1.00 74.08 ? 163 ASN B ND2 1 +ATOM 2875 N N . SER B 2 164 ? 39.769 -39.005 -55.888 1.00 72.63 ? 164 SER B N 1 +ATOM 2876 C CA . SER B 2 164 ? 40.836 -38.760 -54.932 1.00 60.20 ? 164 SER B CA 1 +ATOM 2877 C C . SER B 2 164 ? 40.318 -38.908 -53.505 1.00 66.73 ? 164 SER B C 1 +ATOM 2878 O O . SER B 2 164 ? 39.174 -38.557 -53.224 1.00 68.80 ? 164 SER B O 1 +ATOM 2879 C CB . SER B 2 164 ? 41.457 -37.401 -55.148 1.00 77.86 ? 164 SER B CB 1 +ATOM 2880 O OG . SER B 2 164 ? 40.466 -36.398 -55.331 1.00 60.87 ? 164 SER B OG 1 +ATOM 2881 N N . GLN B 2 165 ? 41.189 -39.434 -52.630 1.00 75.44 ? 165 GLN B N 1 +ATOM 2882 C CA . GLN B 2 165 ? 40.960 -39.612 -51.202 1.00 70.12 ? 165 GLN B CA 1 +ATOM 2883 C C . GLN B 2 165 ? 42.103 -38.944 -50.444 1.00 71.32 ? 165 GLN B C 1 +ATOM 2884 O O . GLN B 2 165 ? 43.220 -38.888 -50.962 1.00 62.75 ? 165 GLN B O 1 +ATOM 2885 C CB . GLN B 2 165 ? 41.003 -41.098 -50.834 1.00 74.55 ? 165 GLN B CB 1 +ATOM 2886 C CG . GLN B 2 165 ? 39.773 -41.906 -51.232 1.00 84.16 ? 165 GLN B CG 1 +ATOM 2887 C CD . GLN B 2 165 ? 39.897 -43.353 -50.812 1.00 90.96 ? 165 GLN B CD 1 +ATOM 2888 O OE1 . GLN B 2 165 ? 40.656 -44.133 -51.388 1.00 92.87 ? 165 GLN B OE1 1 +ATOM 2889 N NE2 . GLN B 2 165 ? 39.144 -43.728 -49.791 1.00 95.14 ? 165 GLN B NE2 1 +ATOM 2890 N N . GLU B 2 166 ? 41.825 -38.467 -49.217 1.00 69.59 ? 166 GLU B N 1 +ATOM 2891 C CA . GLU B 2 166 ? 42.872 -37.911 -48.365 1.00 50.83 ? 166 GLU B CA 1 +ATOM 2892 C C . GLU B 2 166 ? 42.895 -38.528 -46.968 1.00 53.47 ? 166 GLU B C 1 +ATOM 2893 O O . GLU B 2 166 ? 41.982 -39.250 -46.569 1.00 69.89 ? 166 GLU B O 1 +ATOM 2894 C CB . GLU B 2 166 ? 42.899 -36.381 -48.340 1.00 42.57 ? 166 GLU B CB 1 +ATOM 2895 C CG . GLU B 2 166 ? 41.554 -35.713 -48.163 1.00 55.40 ? 166 GLU B CG 1 +ATOM 2896 C CD . GLU B 2 166 ? 41.583 -34.240 -48.539 1.00 65.16 ? 166 GLU B CD 1 +ATOM 2897 O OE1 . GLU B 2 166 ? 42.478 -33.514 -48.046 1.00 61.91 ? 166 GLU B OE1 1 +ATOM 2898 O OE2 . GLU B 2 166 ? 40.721 -33.822 -49.339 1.00 81.19 ? 166 GLU B OE2 1 +ATOM 2899 N N . SER B 2 167 ? 43.997 -38.238 -46.259 1.00 57.05 ? 167 SER B N 1 +ATOM 2900 C CA . SER B 2 167 ? 44.277 -38.685 -44.903 1.00 54.58 ? 167 SER B CA 1 +ATOM 2901 C C . SER B 2 167 ? 45.165 -37.657 -44.199 1.00 55.89 ? 167 SER B C 1 +ATOM 2902 O O . SER B 2 167 ? 46.100 -37.127 -44.799 1.00 67.11 ? 167 SER B O 1 +ATOM 2903 C CB . SER B 2 167 ? 44.905 -40.057 -44.909 1.00 42.82 ? 167 SER B CB 1 +ATOM 2904 O OG . SER B 2 167 ? 45.792 -40.232 -43.811 1.00 43.94 ? 167 SER B OG 1 +ATOM 2905 N N . VAL B 2 168 ? 44.847 -37.387 -42.925 1.00 37.64 ? 168 VAL B N 1 +ATOM 2906 C CA . VAL B 2 168 ? 45.600 -36.457 -42.102 1.00 42.65 ? 168 VAL B CA 1 +ATOM 2907 C C . VAL B 2 168 ? 46.164 -37.239 -40.920 1.00 55.35 ? 168 VAL B C 1 +ATOM 2908 O O . VAL B 2 168 ? 45.532 -38.187 -40.458 1.00 67.22 ? 168 VAL B O 1 +ATOM 2909 C CB . VAL B 2 168 ? 44.722 -35.282 -41.623 1.00 46.29 ? 168 VAL B CB 1 +ATOM 2910 C CG1 . VAL B 2 168 ? 45.557 -34.082 -41.202 1.00 45.24 ? 168 VAL B CG1 1 +ATOM 2911 C CG2 . VAL B 2 168 ? 43.689 -34.857 -42.656 1.00 47.66 ? 168 VAL B CG2 1 +ATOM 2912 N N . THR B 2 169 ? 47.354 -36.850 -40.445 1.00 53.39 ? 169 THR B N 1 +ATOM 2913 C CA . THR B 2 169 ? 47.881 -37.424 -39.216 1.00 63.47 ? 169 THR B CA 1 +ATOM 2914 C C . THR B 2 169 ? 47.263 -36.703 -38.026 1.00 77.07 ? 169 THR B C 1 +ATOM 2915 O O . THR B 2 169 ? 46.693 -35.618 -38.173 1.00 67.27 ? 169 THR B O 1 +ATOM 2916 C CB . THR B 2 169 ? 49.402 -37.268 -39.066 1.00 64.54 ? 169 THR B CB 1 +ATOM 2917 O OG1 . THR B 2 169 ? 49.808 -35.976 -39.519 1.00 66.48 ? 169 THR B OG1 1 +ATOM 2918 C CG2 . THR B 2 169 ? 50.200 -38.363 -39.738 1.00 61.55 ? 169 THR B CG2 1 +ATOM 2919 N N . GLU B 2 170 ? 47.423 -37.318 -36.847 1.00 71.10 ? 170 GLU B N 1 +ATOM 2920 C CA . GLU B 2 170 ? 47.167 -36.661 -35.578 1.00 78.33 ? 170 GLU B CA 1 +ATOM 2921 C C . GLU B 2 170 ? 48.071 -35.430 -35.473 1.00 64.49 ? 170 GLU B C 1 +ATOM 2922 O O . GLU B 2 170 ? 48.941 -35.216 -36.317 1.00 71.89 ? 170 GLU B O 1 +ATOM 2923 C CB . GLU B 2 170 ? 47.358 -37.661 -34.434 1.00 57.91 ? 170 GLU B CB 1 +ATOM 2924 N N . GLN B 2 171 ? 47.838 -34.614 -34.439 1.00 59.12 ? 171 GLN B N 1 +ATOM 2925 C CA . GLN B 2 171 ? 48.666 -33.452 -34.168 1.00 56.89 ? 171 GLN B CA 1 +ATOM 2926 C C . GLN B 2 171 ? 50.027 -33.923 -33.662 1.00 47.53 ? 171 GLN B C 1 +ATOM 2927 O O . GLN B 2 171 ? 50.095 -34.725 -32.738 1.00 62.25 ? 171 GLN B O 1 +ATOM 2928 C CB . GLN B 2 171 ? 47.960 -32.532 -33.172 1.00 58.76 ? 171 GLN B CB 1 +ATOM 2929 C CG . GLN B 2 171 ? 48.039 -31.063 -33.555 1.00 64.85 ? 171 GLN B CG 1 +ATOM 2930 C CD . GLN B 2 171 ? 47.455 -30.176 -32.486 1.00 68.90 ? 171 GLN B CD 1 +ATOM 2931 O OE1 . GLN B 2 171 ? 48.042 -29.980 -31.424 1.00 78.41 ? 171 GLN B OE1 1 +ATOM 2932 N NE2 . GLN B 2 171 ? 46.286 -29.630 -32.767 1.00 56.10 ? 171 GLN B NE2 1 +ATOM 2933 N N . ASP B 2 172 ? 51.100 -33.432 -34.296 1.00 50.11 ? 172 ASP B N 1 +ATOM 2934 C CA . ASP B 2 172 ? 52.469 -33.831 -33.992 1.00 54.46 ? 172 ASP B CA 1 +ATOM 2935 C C . ASP B 2 172 ? 52.852 -33.445 -32.564 1.00 45.73 ? 172 ASP B C 1 +ATOM 2936 O O . ASP B 2 172 ? 52.500 -32.360 -32.100 1.00 54.51 ? 172 ASP B O 1 +ATOM 2937 C CB . ASP B 2 172 ? 53.443 -33.245 -35.015 1.00 72.08 ? 172 ASP B CB 1 +ATOM 2938 C CG . ASP B 2 172 ? 54.890 -33.566 -34.700 1.00 71.21 ? 172 ASP B CG 1 +ATOM 2939 O OD1 . ASP B 2 172 ? 55.324 -34.691 -35.009 1.00 85.91 ? 172 ASP B OD1 1 +ATOM 2940 O OD2 . ASP B 2 172 ? 55.556 -32.694 -34.126 1.00 78.48 ? 172 ASP B OD2 1 +ATOM 2941 N N . SER B 2 173 ? 53.600 -34.339 -31.895 1.00 53.62 ? 173 SER B N 1 +ATOM 2942 C CA . SER B 2 173 ? 53.975 -34.202 -30.489 1.00 52.38 ? 173 SER B CA 1 +ATOM 2943 C C . SER B 2 173 ? 55.138 -33.232 -30.292 1.00 60.18 ? 173 SER B C 1 +ATOM 2944 O O . SER B 2 173 ? 55.337 -32.749 -29.180 1.00 74.74 ? 173 SER B O 1 +ATOM 2945 C CB . SER B 2 173 ? 54.266 -35.530 -29.836 1.00 40.66 ? 173 SER B CB 1 +ATOM 2946 O OG . SER B 2 173 ? 53.078 -36.300 -29.735 1.00 59.54 ? 173 SER B OG 1 +ATOM 2947 N N . LYS B 2 174 ? 55.896 -32.955 -31.364 1.00 79.04 ? 174 LYS B N 1 +ATOM 2948 C CA . LYS B 2 174 ? 57.092 -32.127 -31.280 1.00 68.36 ? 174 LYS B CA 1 +ATOM 2949 C C . LYS B 2 174 ? 56.780 -30.673 -31.644 1.00 67.77 ? 174 LYS B C 1 +ATOM 2950 O O . LYS B 2 174 ? 57.136 -29.771 -30.885 1.00 57.36 ? 174 LYS B O 1 +ATOM 2951 C CB . LYS B 2 174 ? 58.237 -32.733 -32.099 1.00 63.64 ? 174 LYS B CB 1 +ATOM 2952 N N . ASP B 2 175 ? 56.096 -30.460 -32.782 1.00 62.34 ? 175 ASP B N 1 +ATOM 2953 C CA . ASP B 2 175 ? 55.913 -29.130 -33.353 1.00 56.52 ? 175 ASP B CA 1 +ATOM 2954 C C . ASP B 2 175 ? 54.434 -28.759 -33.492 1.00 55.10 ? 175 ASP B C 1 +ATOM 2955 O O . ASP B 2 175 ? 54.131 -27.688 -34.021 1.00 67.35 ? 175 ASP B O 1 +ATOM 2956 C CB . ASP B 2 175 ? 56.709 -28.948 -34.657 1.00 56.77 ? 175 ASP B CB 1 +ATOM 2957 C CG . ASP B 2 175 ? 56.240 -29.777 -35.852 1.00 86.61 ? 175 ASP B CG 1 +ATOM 2958 O OD1 . ASP B 2 175 ? 55.068 -30.214 -35.860 1.00 87.20 ? 175 ASP B OD1 1 +ATOM 2959 O OD2 . ASP B 2 175 ? 57.053 -29.978 -36.786 1.00 86.65 ? 175 ASP B OD2 1 +ATOM 2960 N N . SER B 2 176 ? 53.530 -29.664 -33.069 1.00 57.85 ? 176 SER B N 1 +ATOM 2961 C CA . SER B 2 176 ? 52.083 -29.451 -33.004 1.00 51.24 ? 176 SER B CA 1 +ATOM 2962 C C . SER B 2 176 ? 51.459 -29.172 -34.377 1.00 55.67 ? 176 SER B C 1 +ATOM 2963 O O . SER B 2 176 ? 50.385 -28.579 -34.472 1.00 55.57 ? 176 SER B O 1 +ATOM 2964 C CB . SER B 2 176 ? 51.707 -28.383 -31.987 1.00 45.11 ? 176 SER B CB 1 +ATOM 2965 O OG . SER B 2 176 ? 51.714 -28.894 -30.661 1.00 65.05 ? 176 SER B OG 1 +ATOM 2966 N N . THR B 2 177 ? 52.120 -29.607 -35.452 1.00 54.69 ? 177 THR B N 1 +ATOM 2967 C CA . THR B 2 177 ? 51.549 -29.395 -36.772 1.00 54.79 ? 177 THR B CA 1 +ATOM 2968 C C . THR B 2 177 ? 50.798 -30.642 -37.219 1.00 58.59 ? 177 THR B C 1 +ATOM 2969 O O . THR B 2 177 ? 50.792 -31.671 -36.538 1.00 56.29 ? 177 THR B O 1 +ATOM 2970 C CB . THR B 2 177 ? 52.587 -28.950 -37.811 1.00 56.90 ? 177 THR B CB 1 +ATOM 2971 O OG1 . THR B 2 177 ? 53.710 -29.834 -37.784 1.00 51.22 ? 177 THR B OG1 1 +ATOM 2972 C CG2 . THR B 2 177 ? 53.023 -27.511 -37.636 1.00 68.29 ? 177 THR B CG2 1 +ATOM 2973 N N . TYR B 2 178 ? 50.156 -30.503 -38.377 1.00 49.14 ? 178 TYR B N 1 +ATOM 2974 C CA . TYR B 2 178 ? 49.510 -31.604 -39.057 1.00 55.48 ? 178 TYR B CA 1 +ATOM 2975 C C . TYR B 2 178 ? 50.238 -31.874 -40.367 1.00 63.65 ? 178 TYR B C 1 +ATOM 2976 O O . TYR B 2 178 ? 50.894 -30.986 -40.917 1.00 70.59 ? 178 TYR B O 1 +ATOM 2977 C CB . TYR B 2 178 ? 48.063 -31.234 -39.376 1.00 63.20 ? 178 TYR B CB 1 +ATOM 2978 C CG . TYR B 2 178 ? 47.150 -31.179 -38.183 1.00 58.64 ? 178 TYR B CG 1 +ATOM 2979 C CD1 . TYR B 2 178 ? 46.831 -32.332 -37.478 1.00 73.08 ? 178 TYR B CD1 1 +ATOM 2980 C CD2 . TYR B 2 178 ? 46.583 -29.980 -37.778 1.00 53.84 ? 178 TYR B CD2 1 +ATOM 2981 C CE1 . TYR B 2 178 ? 45.981 -32.294 -36.384 1.00 71.43 ? 178 TYR B CE1 1 +ATOM 2982 C CE2 . TYR B 2 178 ? 45.728 -29.925 -36.688 1.00 67.49 ? 178 TYR B CE2 1 +ATOM 2983 C CZ . TYR B 2 178 ? 45.429 -31.086 -35.993 1.00 60.24 ? 178 TYR B CZ 1 +ATOM 2984 O OH . TYR B 2 178 ? 44.597 -31.049 -34.920 1.00 73.28 ? 178 TYR B OH 1 +ATOM 2985 N N . SER B 2 179 ? 50.093 -33.114 -40.846 1.00 46.53 ? 179 SER B N 1 +ATOM 2986 C CA . SER B 2 179 ? 50.509 -33.509 -42.176 1.00 44.72 ? 179 SER B CA 1 +ATOM 2987 C C . SER B 2 179 ? 49.349 -34.207 -42.873 1.00 53.77 ? 179 SER B C 1 +ATOM 2988 O O . SER B 2 179 ? 48.607 -34.956 -42.242 1.00 73.81 ? 179 SER B O 1 +ATOM 2989 C CB . SER B 2 179 ? 51.740 -34.364 -42.128 1.00 46.70 ? 179 SER B CB 1 +ATOM 2990 O OG . SER B 2 179 ? 52.899 -33.568 -41.898 1.00 57.00 ? 179 SER B OG 1 +ATOM 2991 N N . LEU B 2 180 ? 49.212 -33.942 -44.176 1.00 55.40 ? 180 LEU B N 1 +ATOM 2992 C CA . LEU B 2 180 ? 48.112 -34.465 -44.966 1.00 62.11 ? 180 LEU B CA 1 +ATOM 2993 C C . LEU B 2 180 ? 48.646 -34.986 -46.299 1.00 66.04 ? 180 LEU B C 1 +ATOM 2994 O O . LEU B 2 180 ? 49.483 -34.346 -46.934 1.00 74.01 ? 180 LEU B O 1 +ATOM 2995 C CB . LEU B 2 180 ? 47.093 -33.338 -45.159 1.00 67.88 ? 180 LEU B CB 1 +ATOM 2996 C CG . LEU B 2 180 ? 45.809 -33.693 -45.908 1.00 78.41 ? 180 LEU B CG 1 +ATOM 2997 C CD1 . LEU B 2 180 ? 44.689 -32.727 -45.538 1.00 67.54 ? 180 LEU B CD1 1 +ATOM 2998 C CD2 . LEU B 2 180 ? 46.034 -33.689 -47.412 1.00 56.91 ? 180 LEU B CD2 1 +ATOM 2999 N N . SER B 2 181 ? 48.136 -36.153 -46.708 1.00 65.00 ? 181 SER B N 1 +ATOM 3000 C CA . SER B 2 181 ? 48.409 -36.727 -48.016 1.00 57.06 ? 181 SER B CA 1 +ATOM 3001 C C . SER B 2 181 ? 47.113 -36.798 -48.823 1.00 70.73 ? 181 SER B C 1 +ATOM 3002 O O . SER B 2 181 ? 46.051 -37.061 -48.263 1.00 79.64 ? 181 SER B O 1 +ATOM 3003 C CB . SER B 2 181 ? 49.087 -38.078 -47.898 1.00 58.63 ? 181 SER B CB 1 +ATOM 3004 O OG . SER B 2 181 ? 48.163 -39.115 -47.588 1.00 72.00 ? 181 SER B OG 1 +ATOM 3005 N N . SER B 2 182 ? 47.220 -36.531 -50.132 1.00 64.05 ? 182 SER B N 1 +ATOM 3006 C CA . SER B 2 182 ? 46.107 -36.630 -51.064 1.00 67.47 ? 182 SER B CA 1 +ATOM 3007 C C . SER B 2 182 ? 46.502 -37.519 -52.243 1.00 77.35 ? 182 SER B C 1 +ATOM 3008 O O . SER B 2 182 ? 47.571 -37.345 -52.825 1.00 88.52 ? 182 SER B O 1 +ATOM 3009 C CB . SER B 2 182 ? 45.671 -35.262 -51.510 1.00 60.11 ? 182 SER B CB 1 +ATOM 3010 O OG . SER B 2 182 ? 44.559 -35.341 -52.388 1.00 67.96 ? 182 SER B OG 1 +ATOM 3011 N N . THR B 2 183 ? 45.621 -38.464 -52.595 1.00 77.26 ? 183 THR B N 1 +ATOM 3012 C CA . THR B 2 183 ? 45.952 -39.523 -53.538 1.00 75.21 ? 183 THR B CA 1 +ATOM 3013 C C . THR B 2 183 ? 44.961 -39.530 -54.700 1.00 70.64 ? 183 THR B C 1 +ATOM 3014 O O . THR B 2 183 ? 43.763 -39.726 -54.497 1.00 66.09 ? 183 THR B O 1 +ATOM 3015 C CB . THR B 2 183 ? 46.006 -40.886 -52.834 1.00 77.49 ? 183 THR B CB 1 +ATOM 3016 O OG1 . THR B 2 183 ? 46.869 -40.769 -51.702 1.00 88.12 ? 183 THR B OG1 1 +ATOM 3017 C CG2 . THR B 2 183 ? 46.471 -42.010 -53.736 1.00 62.43 ? 183 THR B CG2 1 +ATOM 3018 N N . LEU B 2 184 ? 45.494 -39.350 -55.915 1.00 47.73 ? 184 LEU B N 1 +ATOM 3019 C CA . LEU B 2 184 ? 44.697 -39.406 -57.130 1.00 71.69 ? 184 LEU B CA 1 +ATOM 3020 C C . LEU B 2 184 ? 44.907 -40.753 -57.821 1.00 75.08 ? 184 LEU B C 1 +ATOM 3021 O O . LEU B 2 184 ? 46.039 -41.214 -57.955 1.00 86.99 ? 184 LEU B O 1 +ATOM 3022 C CB . LEU B 2 184 ? 45.107 -38.246 -58.044 1.00 75.64 ? 184 LEU B CB 1 +ATOM 3023 C CG . LEU B 2 184 ? 44.199 -37.999 -59.246 1.00 61.27 ? 184 LEU B CG 1 +ATOM 3024 C CD1 . LEU B 2 184 ? 43.057 -37.078 -58.862 1.00 61.37 ? 184 LEU B CD1 1 +ATOM 3025 C CD2 . LEU B 2 184 ? 44.989 -37.411 -60.405 1.00 50.73 ? 184 LEU B CD2 1 +ATOM 3026 N N . THR B 2 185 ? 43.804 -41.356 -58.282 1.00 60.66 ? 185 THR B N 1 +ATOM 3027 C CA . THR B 2 185 ? 43.823 -42.709 -58.818 1.00 66.13 ? 185 THR B CA 1 +ATOM 3028 C C . THR B 2 185 ? 43.314 -42.688 -60.258 1.00 70.71 ? 185 THR B C 1 +ATOM 3029 O O . THR B 2 185 ? 42.202 -42.229 -60.519 1.00 62.12 ? 185 THR B O 1 +ATOM 3030 C CB . THR B 2 185 ? 43.084 -43.679 -57.884 1.00 62.11 ? 185 THR B CB 1 +ATOM 3031 O OG1 . THR B 2 185 ? 43.544 -43.441 -56.554 1.00 76.73 ? 185 THR B OG1 1 +ATOM 3032 C CG2 . THR B 2 185 ? 43.318 -45.138 -58.215 1.00 72.52 ? 185 THR B CG2 1 +ATOM 3033 N N . LEU B 2 186 ? 44.158 -43.183 -61.177 1.00 77.78 ? 186 LEU B N 1 +ATOM 3034 C CA . LEU B 2 186 ? 43.874 -43.206 -62.605 1.00 76.77 ? 186 LEU B CA 1 +ATOM 3035 C C . LEU B 2 186 ? 44.086 -44.612 -63.170 1.00 87.64 ? 186 LEU B C 1 +ATOM 3036 O O . LEU B 2 186 ? 44.857 -45.410 -62.628 1.00 66.44 ? 186 LEU B O 1 +ATOM 3037 C CB . LEU B 2 186 ? 44.780 -42.200 -63.327 1.00 55.25 ? 186 LEU B CB 1 +ATOM 3038 C CG . LEU B 2 186 ? 44.534 -40.719 -63.032 1.00 69.13 ? 186 LEU B CG 1 +ATOM 3039 C CD1 . LEU B 2 186 ? 45.758 -39.891 -63.392 1.00 82.08 ? 186 LEU B CD1 1 +ATOM 3040 C CD2 . LEU B 2 186 ? 43.309 -40.197 -63.767 1.00 66.73 ? 186 LEU B CD2 1 +ATOM 3041 N N . SER B 2 187 ? 43.360 -44.895 -64.261 1.00 81.74 ? 187 SER B N 1 +ATOM 3042 C CA . SER B 2 187 ? 43.707 -45.942 -65.208 1.00 79.68 ? 187 SER B CA 1 +ATOM 3043 C C . SER B 2 187 ? 45.002 -45.539 -65.906 1.00 87.95 ? 187 SER B C 1 +ATOM 3044 O O . SER B 2 187 ? 45.206 -44.356 -66.184 1.00 97.25 ? 187 SER B O 1 +ATOM 3045 C CB . SER B 2 187 ? 42.605 -46.120 -66.211 1.00 66.76 ? 187 SER B CB 1 +ATOM 3046 O OG . SER B 2 187 ? 42.329 -44.886 -66.859 1.00 77.00 ? 187 SER B OG 1 +ATOM 3047 N N . LYS B 2 188 ? 45.862 -46.527 -66.188 1.00 92.10 ? 188 LYS B N 1 +ATOM 3048 C CA . LYS B 2 188 ? 47.104 -46.290 -66.910 1.00 89.21 ? 188 LYS B CA 1 +ATOM 3049 C C . LYS B 2 188 ? 46.786 -45.555 -68.211 1.00 86.69 ? 188 LYS B C 1 +ATOM 3050 O O . LYS B 2 188 ? 47.547 -44.686 -68.634 1.00 74.02 ? 188 LYS B O 1 +ATOM 3051 C CB . LYS B 2 188 ? 47.857 -47.601 -67.161 1.00 83.92 ? 188 LYS B CB 1 +ATOM 3052 C CG . LYS B 2 188 ? 49.252 -47.448 -67.756 1.00 76.24 ? 188 LYS B CG 1 +ATOM 3053 C CD . LYS B 2 188 ? 49.615 -48.569 -68.703 1.00 77.64 ? 188 LYS B CD 1 +ATOM 3054 C CE . LYS B 2 188 ? 50.630 -48.163 -69.750 1.00 90.48 ? 188 LYS B CE 1 +ATOM 3055 N NZ . LYS B 2 188 ? 51.078 -49.328 -70.550 1.00 95.94 ? 188 LYS B NZ 1 +ATOM 3056 N N . ALA B 2 189 ? 45.631 -45.905 -68.795 1.00 91.59 ? 189 ALA B N 1 +ATOM 3057 C CA . ALA B 2 189 ? 45.067 -45.281 -69.982 1.00 113.20 ? 189 ALA B CA 1 +ATOM 3058 C C . ALA B 2 189 ? 45.051 -43.759 -69.836 1.00 124.68 ? 189 ALA B C 1 +ATOM 3059 O O . ALA B 2 189 ? 45.567 -43.054 -70.704 1.00 137.30 ? 189 ALA B O 1 +ATOM 3060 C CB . ALA B 2 189 ? 43.686 -45.839 -70.246 1.00 93.97 ? 189 ALA B CB 1 +ATOM 3061 N N . ASP B 2 190 ? 44.485 -43.271 -68.722 1.00 97.25 ? 190 ASP B N 1 +ATOM 3062 C CA . ASP B 2 190 ? 44.326 -41.844 -68.493 1.00 88.32 ? 190 ASP B CA 1 +ATOM 3063 C C . ASP B 2 190 ? 45.682 -41.166 -68.330 1.00 99.98 ? 190 ASP B C 1 +ATOM 3064 O O . ASP B 2 190 ? 45.892 -40.085 -68.880 1.00 109.92 ? 190 ASP B O 1 +ATOM 3065 C CB . ASP B 2 190 ? 43.395 -41.551 -67.318 1.00 84.53 ? 190 ASP B CB 1 +ATOM 3066 C CG . ASP B 2 190 ? 42.149 -40.781 -67.719 1.00 114.42 ? 190 ASP B CG 1 +ATOM 3067 O OD1 . ASP B 2 190 ? 41.635 -41.017 -68.836 1.00 103.78 ? 190 ASP B OD1 1 +ATOM 3068 O OD2 . ASP B 2 190 ? 41.706 -39.944 -66.911 1.00 134.54 ? 190 ASP B OD2 1 +ATOM 3069 N N . TYR B 2 191 ? 46.590 -41.827 -67.596 1.00 89.26 ? 191 TYR B N 1 +ATOM 3070 C CA . TYR B 2 191 ? 47.879 -41.255 -67.232 1.00 92.17 ? 191 TYR B CA 1 +ATOM 3071 C C . TYR B 2 191 ? 48.752 -41.030 -68.466 1.00 88.64 ? 191 TYR B C 1 +ATOM 3072 O O . TYR B 2 191 ? 49.618 -40.158 -68.453 1.00 83.23 ? 191 TYR B O 1 +ATOM 3073 C CB . TYR B 2 191 ? 48.579 -42.083 -66.148 1.00 81.49 ? 191 TYR B CB 1 +ATOM 3074 C CG . TYR B 2 191 ? 49.888 -41.524 -65.641 1.00 83.24 ? 191 TYR B CG 1 +ATOM 3075 C CD1 . TYR B 2 191 ? 49.926 -40.454 -64.754 1.00 77.60 ? 191 TYR B CD1 1 +ATOM 3076 C CD2 . TYR B 2 191 ? 51.102 -42.067 -66.043 1.00 104.24 ? 191 TYR B CD2 1 +ATOM 3077 C CE1 . TYR B 2 191 ? 51.129 -39.939 -64.288 1.00 66.00 ? 191 TYR B CE1 1 +ATOM 3078 C CE2 . TYR B 2 191 ? 52.314 -41.568 -65.584 1.00 94.82 ? 191 TYR B CE2 1 +ATOM 3079 C CZ . TYR B 2 191 ? 52.329 -40.499 -64.703 1.00 86.57 ? 191 TYR B CZ 1 +ATOM 3080 O OH . TYR B 2 191 ? 53.521 -40.014 -64.242 1.00 74.16 ? 191 TYR B OH 1 +ATOM 3081 N N . GLU B 2 192 ? 48.511 -41.814 -69.524 1.00 104.24 ? 192 GLU B N 1 +ATOM 3082 C CA . GLU B 2 192 ? 49.251 -41.678 -70.768 1.00 99.00 ? 192 GLU B CA 1 +ATOM 3083 C C . GLU B 2 192 ? 48.637 -40.564 -71.610 1.00 94.49 ? 192 GLU B C 1 +ATOM 3084 O O . GLU B 2 192 ? 49.354 -39.865 -72.331 1.00 78.02 ? 192 GLU B O 1 +ATOM 3085 C CB . GLU B 2 192 ? 49.287 -42.999 -71.541 1.00 90.39 ? 192 GLU B CB 1 +ATOM 3086 C CG . GLU B 2 192 ? 50.068 -44.107 -70.846 1.00 102.00 ? 192 GLU B CG 1 +ATOM 3087 C CD . GLU B 2 192 ? 51.445 -43.762 -70.297 1.00 103.47 ? 192 GLU B CD 1 +ATOM 3088 O OE1 . GLU B 2 192 ? 51.776 -44.276 -69.216 1.00 99.51 ? 192 GLU B OE1 1 +ATOM 3089 O OE2 . GLU B 2 192 ? 52.188 -42.992 -70.951 1.00 105.93 ? 192 GLU B OE2 1 +ATOM 3090 N N . LYS B 2 193 ? 47.311 -40.413 -71.484 1.00 78.34 ? 193 LYS B N 1 +ATOM 3091 C CA . LYS B 2 193 ? 46.519 -39.522 -72.316 1.00 89.41 ? 193 LYS B CA 1 +ATOM 3092 C C . LYS B 2 193 ? 46.891 -38.068 -72.032 1.00 102.78 ? 193 LYS B C 1 +ATOM 3093 O O . LYS B 2 193 ? 46.911 -37.247 -72.948 1.00 98.44 ? 193 LYS B O 1 +ATOM 3094 C CB . LYS B 2 193 ? 45.023 -39.776 -72.102 1.00 84.14 ? 193 LYS B CB 1 +ATOM 3095 N N . HIS B 2 194 ? 47.201 -37.771 -70.764 1.00 80.46 ? 194 HIS B N 1 +ATOM 3096 C CA . HIS B 2 194 ? 47.486 -36.415 -70.324 1.00 77.31 ? 194 HIS B CA 1 +ATOM 3097 C C . HIS B 2 194 ? 48.944 -36.304 -69.880 1.00 73.29 ? 194 HIS B C 1 +ATOM 3098 O O . HIS B 2 194 ? 49.625 -37.318 -69.742 1.00 62.93 ? 194 HIS B O 1 +ATOM 3099 C CB . HIS B 2 194 ? 46.480 -36.004 -69.246 1.00 81.07 ? 194 HIS B CB 1 +ATOM 3100 C CG . HIS B 2 194 ? 45.055 -36.086 -69.681 1.00 80.05 ? 194 HIS B CG 1 +ATOM 3101 N ND1 . HIS B 2 194 ? 44.320 -37.256 -69.588 1.00 81.31 ? 194 HIS B ND1 1 +ATOM 3102 C CD2 . HIS B 2 194 ? 44.219 -35.150 -70.185 1.00 79.05 ? 194 HIS B CD2 1 +ATOM 3103 C CE1 . HIS B 2 194 ? 43.092 -37.037 -70.016 1.00 70.77 ? 194 HIS B CE1 1 +ATOM 3104 N NE2 . HIS B 2 194 ? 43.007 -35.753 -70.395 1.00 85.82 ? 194 HIS B NE2 1 +ATOM 3105 N N . LYS B 2 195 ? 49.411 -35.065 -69.661 1.00 95.32 ? 195 LYS B N 1 +ATOM 3106 C CA . LYS B 2 195 ? 50.827 -34.786 -69.453 1.00 109.67 ? 195 LYS B CA 1 +ATOM 3107 C C . LYS B 2 195 ? 51.074 -34.066 -68.125 1.00 103.37 ? 195 LYS B C 1 +ATOM 3108 O O . LYS B 2 195 ? 51.874 -34.539 -67.317 1.00 109.38 ? 195 LYS B O 1 +ATOM 3109 C CB . LYS B 2 195 ? 51.415 -34.025 -70.649 1.00 87.95 ? 195 LYS B CB 1 +ATOM 3110 N N . VAL B 2 196 ? 50.400 -32.922 -67.919 1.00 85.28 ? 196 VAL B N 1 +ATOM 3111 C CA . VAL B 2 196 ? 50.644 -32.035 -66.789 1.00 80.56 ? 196 VAL B CA 1 +ATOM 3112 C C . VAL B 2 196 ? 49.707 -32.415 -65.646 1.00 81.89 ? 196 VAL B C 1 +ATOM 3113 O O . VAL B 2 196 ? 48.484 -32.417 -65.809 1.00 106.54 ? 196 VAL B O 1 +ATOM 3114 C CB . VAL B 2 196 ? 50.497 -30.546 -67.170 1.00 78.09 ? 196 VAL B CB 1 +ATOM 3115 C CG1 . VAL B 2 196 ? 50.726 -29.617 -65.985 1.00 61.59 ? 196 VAL B CG1 1 +ATOM 3116 C CG2 . VAL B 2 196 ? 51.416 -30.160 -68.319 1.00 102.34 ? 196 VAL B CG2 1 +ATOM 3117 N N . TYR B 2 197 ? 50.311 -32.720 -64.491 1.00 54.26 ? 197 TYR B N 1 +ATOM 3118 C CA . TYR B 2 197 ? 49.582 -33.063 -63.281 1.00 56.93 ? 197 TYR B CA 1 +ATOM 3119 C C . TYR B 2 197 ? 49.975 -32.070 -62.193 1.00 68.24 ? 197 TYR B C 1 +ATOM 3120 O O . TYR B 2 197 ? 51.155 -31.753 -62.071 1.00 79.57 ? 197 TYR B O 1 +ATOM 3121 C CB . TYR B 2 197 ? 49.837 -34.529 -62.903 1.00 50.78 ? 197 TYR B CB 1 +ATOM 3122 C CG . TYR B 2 197 ? 49.329 -35.527 -63.915 1.00 60.47 ? 197 TYR B CG 1 +ATOM 3123 C CD1 . TYR B 2 197 ? 47.987 -35.885 -63.957 1.00 67.33 ? 197 TYR B CD1 1 +ATOM 3124 C CD2 . TYR B 2 197 ? 50.177 -36.091 -64.859 1.00 60.83 ? 197 TYR B CD2 1 +ATOM 3125 C CE1 . TYR B 2 197 ? 47.502 -36.779 -64.901 1.00 65.29 ? 197 TYR B CE1 1 +ATOM 3126 C CE2 . TYR B 2 197 ? 49.708 -36.986 -65.811 1.00 64.29 ? 197 TYR B CE2 1 +ATOM 3127 C CZ . TYR B 2 197 ? 48.366 -37.333 -65.829 1.00 71.24 ? 197 TYR B CZ 1 +ATOM 3128 O OH . TYR B 2 197 ? 47.892 -38.212 -66.757 1.00 74.98 ? 197 TYR B OH 1 +ATOM 3129 N N . ALA B 2 198 ? 48.978 -31.583 -61.435 1.00 72.65 ? 198 ALA B N 1 +ATOM 3130 C CA . ALA B 2 198 ? 49.166 -30.568 -60.404 1.00 77.79 ? 198 ALA B CA 1 +ATOM 3131 C C . ALA B 2 198 ? 48.141 -30.726 -59.281 1.00 64.58 ? 198 ALA B C 1 +ATOM 3132 O O . ALA B 2 198 ? 46.985 -31.059 -59.546 1.00 56.94 ? 198 ALA B O 1 +ATOM 3133 C CB . ALA B 2 198 ? 49.048 -29.197 -61.024 1.00 75.99 ? 198 ALA B CB 1 +ATOM 3134 N N . CYS B 2 199 ? 48.577 -30.449 -58.039 1.00 49.79 ? 199 CYS B N 1 +ATOM 3135 C CA . CYS B 2 199 ? 47.697 -30.329 -56.880 1.00 48.25 ? 199 CYS B CA 1 +ATOM 3136 C C . CYS B 2 199 ? 47.842 -28.946 -56.241 1.00 51.29 ? 199 CYS B C 1 +ATOM 3137 O O . CYS B 2 199 ? 48.952 -28.490 -55.960 1.00 52.32 ? 199 CYS B O 1 +ATOM 3138 C CB . CYS B 2 199 ? 47.948 -31.413 -55.835 1.00 50.17 ? 199 CYS B CB 1 +ATOM 3139 S SG . CYS B 2 199 ? 49.624 -31.385 -55.141 1.00 84.39 ? 199 CYS B SG 1 +ATOM 3140 N N . GLU B 2 200 ? 46.692 -28.302 -56.014 1.00 60.90 ? 200 GLU B N 1 +ATOM 3141 C CA . GLU B 2 200 ? 46.580 -26.970 -55.437 1.00 67.92 ? 200 GLU B CA 1 +ATOM 3142 C C . GLU B 2 200 ? 46.248 -27.101 -53.956 1.00 73.09 ? 200 GLU B C 1 +ATOM 3143 O O . GLU B 2 200 ? 45.245 -27.718 -53.599 1.00 74.98 ? 200 GLU B O 1 +ATOM 3144 C CB . GLU B 2 200 ? 45.459 -26.200 -56.140 1.00 66.65 ? 200 GLU B CB 1 +ATOM 3145 C CG . GLU B 2 200 ? 45.571 -24.691 -56.032 1.00 66.01 ? 200 GLU B CG 1 +ATOM 3146 C CD . GLU B 2 200 ? 45.060 -23.938 -57.252 1.00 73.37 ? 200 GLU B CD 1 +ATOM 3147 O OE1 . GLU B 2 200 ? 45.113 -24.502 -58.366 1.00 81.00 ? 200 GLU B OE1 1 +ATOM 3148 O OE2 . GLU B 2 200 ? 44.615 -22.780 -57.091 1.00 59.14 ? 200 GLU B OE2 1 +ATOM 3149 N N . VAL B 2 201 ? 47.114 -26.527 -53.114 1.00 60.71 ? 201 VAL B N 1 +ATOM 3150 C CA . VAL B 2 201 ? 46.876 -26.439 -51.684 1.00 64.98 ? 201 VAL B CA 1 +ATOM 3151 C C . VAL B 2 201 ? 46.442 -25.009 -51.375 1.00 74.26 ? 201 VAL B C 1 +ATOM 3152 O O . VAL B 2 201 ? 47.204 -24.071 -51.604 1.00 87.00 ? 201 VAL B O 1 +ATOM 3153 C CB . VAL B 2 201 ? 48.114 -26.865 -50.869 1.00 58.89 ? 201 VAL B CB 1 +ATOM 3154 N N . THR B 2 202 ? 45.207 -24.875 -50.868 1.00 88.30 ? 202 THR B N 1 +ATOM 3155 C CA . THR B 2 202 ? 44.555 -23.599 -50.605 1.00 81.73 ? 202 THR B CA 1 +ATOM 3156 C C . THR B 2 202 ? 44.299 -23.449 -49.106 1.00 75.71 ? 202 THR B C 1 +ATOM 3157 O O . THR B 2 202 ? 43.621 -24.281 -48.503 1.00 86.53 ? 202 THR B O 1 +ATOM 3158 C CB . THR B 2 202 ? 43.268 -23.464 -51.434 1.00 75.95 ? 202 THR B CB 1 +ATOM 3159 O OG1 . THR B 2 202 ? 43.615 -23.556 -52.816 1.00 66.90 ? 202 THR B OG1 1 +ATOM 3160 C CG2 . THR B 2 202 ? 42.514 -22.176 -51.186 1.00 64.70 ? 202 THR B CG2 1 +ATOM 3161 N N . GLN B 2 203 ? 44.840 -22.368 -48.529 1.00 72.00 ? 203 GLN B N 1 +ATOM 3162 C CA . GLN B 2 203 ? 44.737 -22.074 -47.107 1.00 61.39 ? 203 GLN B CA 1 +ATOM 3163 C C . GLN B 2 203 ? 44.735 -20.560 -46.907 1.00 65.25 ? 203 GLN B C 1 +ATOM 3164 O O . GLN B 2 203 ? 45.708 -19.874 -47.229 1.00 66.32 ? 203 GLN B O 1 +ATOM 3165 C CB . GLN B 2 203 ? 45.866 -22.780 -46.347 1.00 58.11 ? 203 GLN B CB 1 +ATOM 3166 C CG . GLN B 2 203 ? 46.233 -22.178 -44.996 1.00 58.98 ? 203 GLN B CG 1 +ATOM 3167 C CD . GLN B 2 203 ? 47.020 -23.134 -44.130 1.00 84.79 ? 203 GLN B CD 1 +ATOM 3168 O OE1 . GLN B 2 203 ? 46.560 -24.230 -43.794 1.00 85.88 ? 203 GLN B OE1 1 +ATOM 3169 N NE2 . GLN B 2 203 ? 48.216 -22.716 -43.743 1.00 68.14 ? 203 GLN B NE2 1 +ATOM 3170 N N . GLY B 2 204 ? 43.623 -20.061 -46.362 1.00 59.80 ? 204 GLY B N 1 +ATOM 3171 C CA . GLY B 2 204 ? 43.502 -18.659 -46.006 1.00 72.30 ? 204 GLY B CA 1 +ATOM 3172 C C . GLY B 2 204 ? 43.469 -17.785 -47.251 1.00 64.15 ? 204 GLY B C 1 +ATOM 3173 O O . GLY B 2 204 ? 42.449 -17.713 -47.931 1.00 70.77 ? 204 GLY B O 1 +ATOM 3174 N N . THR B 2 205 ? 44.611 -17.159 -47.543 1.00 69.49 ? 205 THR B N 1 +ATOM 3175 C CA . THR B 2 205 ? 44.743 -16.270 -48.688 1.00 80.30 ? 205 THR B CA 1 +ATOM 3176 C C . THR B 2 205 ? 45.854 -16.756 -49.622 1.00 67.86 ? 205 THR B C 1 +ATOM 3177 O O . THR B 2 205 ? 46.299 -16.013 -50.497 1.00 75.69 ? 205 THR B O 1 +ATOM 3178 C CB . THR B 2 205 ? 44.948 -14.818 -48.230 1.00 75.94 ? 205 THR B CB 1 +ATOM 3179 O OG1 . THR B 2 205 ? 46.062 -14.790 -47.333 1.00 54.53 ? 205 THR B OG1 1 +ATOM 3180 C CG2 . THR B 2 205 ? 43.719 -14.213 -47.584 1.00 63.86 ? 205 THR B CG2 1 +ATOM 3181 N N . THR B 2 206 ? 46.282 -18.010 -49.433 1.00 63.77 ? 206 THR B N 1 +ATOM 3182 C CA . THR B 2 206 ? 47.391 -18.607 -50.161 1.00 69.66 ? 206 THR B CA 1 +ATOM 3183 C C . THR B 2 206 ? 46.900 -19.823 -50.948 1.00 73.14 ? 206 THR B C 1 +ATOM 3184 O O . THR B 2 206 ? 46.069 -20.589 -50.464 1.00 97.04 ? 206 THR B O 1 +ATOM 3185 C CB . THR B 2 206 ? 48.557 -18.896 -49.205 1.00 70.69 ? 206 THR B CB 1 +ATOM 3186 O OG1 . THR B 2 206 ? 49.048 -17.625 -48.779 1.00 76.23 ? 206 THR B OG1 1 +ATOM 3187 C CG2 . THR B 2 206 ? 49.698 -19.676 -49.823 1.00 73.33 ? 206 THR B CG2 1 +ATOM 3188 N N . SER B 2 207 ? 47.420 -19.971 -52.170 1.00 57.87 ? 207 SER B N 1 +ATOM 3189 C CA . SER B 2 207 ? 47.231 -21.164 -52.979 1.00 60.89 ? 207 SER B CA 1 +ATOM 3190 C C . SER B 2 207 ? 48.548 -21.553 -53.640 1.00 72.00 ? 207 SER B C 1 +ATOM 3191 O O . SER B 2 207 ? 48.964 -20.958 -54.636 1.00 67.64 ? 207 SER B O 1 +ATOM 3192 C CB . SER B 2 207 ? 46.125 -20.997 -53.986 1.00 49.39 ? 207 SER B CB 1 +ATOM 3193 O OG . SER B 2 207 ? 44.861 -21.024 -53.346 1.00 52.43 ? 207 SER B OG 1 +ATOM 3194 N N . VAL B 2 208 ? 49.201 -22.553 -53.044 1.00 81.16 ? 208 VAL B N 1 +ATOM 3195 C CA . VAL B 2 208 ? 50.405 -23.147 -53.600 1.00 73.06 ? 208 VAL B CA 1 +ATOM 3196 C C . VAL B 2 208 ? 49.976 -24.258 -54.559 1.00 55.81 ? 208 VAL B C 1 +ATOM 3197 O O . VAL B 2 208 ? 49.074 -25.033 -54.251 1.00 71.43 ? 208 VAL B O 1 +ATOM 3198 C CB . VAL B 2 208 ? 51.346 -23.660 -52.487 1.00 65.10 ? 208 VAL B CB 1 +ATOM 3199 C CG1 . VAL B 2 208 ? 52.703 -24.084 -53.035 1.00 65.76 ? 208 VAL B CG1 1 +ATOM 3200 C CG2 . VAL B 2 208 ? 51.523 -22.647 -51.357 1.00 54.59 ? 208 VAL B CG2 1 +ATOM 3201 N N . THR B 2 209 ? 50.610 -24.304 -55.733 1.00 52.31 ? 209 THR B N 1 +ATOM 3202 C CA . THR B 2 209 ? 50.352 -25.352 -56.710 1.00 76.88 ? 209 THR B CA 1 +ATOM 3203 C C . THR B 2 209 ? 51.680 -25.950 -57.168 1.00 70.25 ? 209 THR B C 1 +ATOM 3204 O O . THR B 2 209 ? 52.410 -25.314 -57.926 1.00 77.61 ? 209 THR B O 1 +ATOM 3205 C CB . THR B 2 209 ? 49.501 -24.843 -57.885 1.00 74.82 ? 209 THR B CB 1 +ATOM 3206 O OG1 . THR B 2 209 ? 48.380 -24.115 -57.383 1.00 78.17 ? 209 THR B OG1 1 +ATOM 3207 C CG2 . THR B 2 209 ? 48.997 -25.952 -58.782 1.00 60.56 ? 209 THR B CG2 1 +ATOM 3208 N N . LYS B 2 210 ? 51.986 -27.160 -56.679 1.00 66.18 ? 210 LYS B N 1 +ATOM 3209 C CA . LYS B 2 210 ? 53.085 -27.955 -57.209 1.00 47.96 ? 210 LYS B CA 1 +ATOM 3210 C C . LYS B 2 210 ? 52.565 -28.807 -58.364 1.00 51.83 ? 210 LYS B C 1 +ATOM 3211 O O . LYS B 2 210 ? 51.393 -29.191 -58.385 1.00 55.83 ? 210 LYS B O 1 +ATOM 3212 C CB . LYS B 2 210 ? 53.769 -28.780 -56.116 1.00 52.03 ? 210 LYS B CB 1 +ATOM 3213 C CG . LYS B 2 210 ? 54.943 -28.103 -55.417 1.00 67.30 ? 210 LYS B CG 1 +ATOM 3214 C CD . LYS B 2 210 ? 56.285 -28.281 -56.118 1.00 75.35 ? 210 LYS B CD 1 +ATOM 3215 C CE . LYS B 2 210 ? 57.481 -28.030 -55.219 1.00 84.72 ? 210 LYS B CE 1 +ATOM 3216 N NZ . LYS B 2 210 ? 57.881 -29.240 -54.458 1.00 86.47 ? 210 LYS B NZ 1 +ATOM 3217 N N . SER B 2 211 ? 53.455 -29.057 -59.333 1.00 58.53 ? 211 SER B N 1 +ATOM 3218 C CA A SER B 2 211 ? 53.109 -29.755 -60.561 0.50 62.41 ? 211 SER B CA 1 +ATOM 3219 C CA B SER B 2 211 ? 53.109 -29.755 -60.561 0.50 62.41 ? 211 SER B CA 1 +ATOM 3220 C C . SER B 2 211 ? 54.312 -30.527 -61.098 1.00 62.84 ? 211 SER B C 1 +ATOM 3221 O O . SER B 2 211 ? 55.449 -30.302 -60.671 1.00 48.94 ? 211 SER B O 1 +ATOM 3222 C CB A SER B 2 211 ? 52.559 -28.799 -61.596 0.50 61.41 ? 211 SER B CB 1 +ATOM 3223 C CB B SER B 2 211 ? 52.559 -28.799 -61.596 0.50 61.41 ? 211 SER B CB 1 +ATOM 3224 O OG A SER B 2 211 ? 53.479 -27.751 -61.861 0.50 73.06 ? 211 SER B OG 1 +ATOM 3225 O OG B SER B 2 211 ? 53.479 -27.751 -61.861 0.50 73.06 ? 211 SER B OG 1 +ATOM 3226 N N . PHE B 2 212 ? 54.032 -31.446 -62.032 1.00 66.84 ? 212 PHE B N 1 +ATOM 3227 C CA . PHE B 2 212 ? 55.049 -32.164 -62.785 1.00 81.83 ? 212 PHE B CA 1 +ATOM 3228 C C . PHE B 2 212 ? 54.517 -32.437 -64.193 1.00 86.96 ? 212 PHE B C 1 +ATOM 3229 O O . PHE B 2 212 ? 53.309 -32.348 -64.436 1.00 71.49 ? 212 PHE B O 1 +ATOM 3230 C CB . PHE B 2 212 ? 55.522 -33.410 -62.025 1.00 75.49 ? 212 PHE B CB 1 +ATOM 3231 C CG . PHE B 2 212 ? 54.610 -34.610 -62.107 1.00 88.37 ? 212 PHE B CG 1 +ATOM 3232 C CD1 . PHE B 2 212 ? 53.474 -34.702 -61.315 1.00 78.92 ? 212 PHE B CD1 1 +ATOM 3233 C CD2 . PHE B 2 212 ? 54.890 -35.656 -62.975 1.00 88.29 ? 212 PHE B CD2 1 +ATOM 3234 C CE1 . PHE B 2 212 ? 52.635 -35.806 -61.395 1.00 63.11 ? 212 PHE B CE1 1 +ATOM 3235 C CE2 . PHE B 2 212 ? 54.044 -36.755 -63.059 1.00 75.33 ? 212 PHE B CE2 1 +ATOM 3236 C CZ . PHE B 2 212 ? 52.916 -36.829 -62.272 1.00 48.58 ? 212 PHE B CZ 1 +ATOM 3237 N N . ASN B 2 213 ? 55.443 -32.736 -65.113 1.00 95.01 ? 213 ASN B N 1 +ATOM 3238 C CA . ASN B 2 213 ? 55.105 -33.147 -66.467 1.00 98.56 ? 213 ASN B CA 1 +ATOM 3239 C C . ASN B 2 213 ? 55.643 -34.555 -66.706 1.00 90.43 ? 213 ASN B C 1 +ATOM 3240 O O . ASN B 2 213 ? 56.855 -34.769 -66.641 1.00 102.50 ? 213 ASN B O 1 +ATOM 3241 C CB . ASN B 2 213 ? 55.629 -32.162 -67.517 1.00 102.66 ? 213 ASN B CB 1 +ATOM 3242 C CG . ASN B 2 213 ? 54.897 -32.246 -68.843 1.00 127.75 ? 213 ASN B CG 1 +ATOM 3243 O OD1 . ASN B 2 213 ? 54.500 -33.323 -69.288 1.00 104.82 ? 213 ASN B OD1 1 +ATOM 3244 N ND2 . ASN B 2 213 ? 54.715 -31.105 -69.489 1.00 134.00 ? 213 ASN B ND2 1 +ATOM 3245 N N . ARG B 2 214 ? 54.724 -35.487 -67.006 1.00 66.55 ? 214 ARG B N 1 +ATOM 3246 C CA . ARG B 2 214 ? 55.005 -36.909 -67.184 1.00 72.56 ? 214 ARG B CA 1 +ATOM 3247 C C . ARG B 2 214 ? 56.225 -37.117 -68.087 1.00 82.82 ? 214 ARG B C 1 +ATOM 3248 O O . ARG B 2 214 ? 56.911 -38.137 -67.977 1.00 68.71 ? 214 ARG B O 1 +ATOM 3249 C CB . ARG B 2 214 ? 53.746 -37.630 -67.681 1.00 67.15 ? 214 ARG B CB 1 +ATOM 3250 C CG . ARG B 2 214 ? 53.944 -39.094 -68.051 1.00 75.74 ? 214 ARG B CG 1 +ATOM 3251 C CD . ARG B 2 214 ? 52.743 -39.683 -68.766 1.00 84.28 ? 214 ARG B CD 1 +ATOM 3252 N NE . ARG B 2 214 ? 52.386 -39.008 -70.011 1.00 98.35 ? 214 ARG B NE 1 +ATOM 3253 C CZ . ARG B 2 214 ? 52.915 -39.259 -71.209 1.00 114.41 ? 214 ARG B CZ 1 +ATOM 3254 N NH1 . ARG B 2 214 ? 53.857 -40.177 -71.353 1.00 119.99 ? 214 ARG B NH1 1 +ATOM 3255 N NH2 . ARG B 2 214 ? 52.499 -38.583 -72.266 1.00 110.31 ? 214 ARG B NH2 1 +ATOM 3256 N N . GLY B 2 215 ? 56.481 -36.122 -68.954 1.00 86.79 ? 215 GLY B N 1 +ATOM 3257 C CA . GLY B 2 215 ? 57.633 -36.045 -69.840 1.00 83.66 ? 215 GLY B CA 1 +ATOM 3258 C C . GLY B 2 215 ? 58.957 -35.947 -69.086 1.00 107.13 ? 215 GLY B C 1 +ATOM 3259 O O . GLY B 2 215 ? 59.768 -36.868 -69.163 1.00 145.27 ? 215 GLY B O 1 +ATOM 3260 N N . GLU B 2 216 ? 59.169 -34.829 -68.374 1.00 101.93 ? 216 GLU B N 1 +ATOM 3261 C CA . GLU B 2 216 ? 60.418 -34.580 -67.662 1.00 84.31 ? 216 GLU B CA 1 +ATOM 3262 C C . GLU B 2 216 ? 60.455 -35.412 -66.373 1.00 91.56 ? 216 GLU B C 1 +ATOM 3263 O O . GLU B 2 216 ? 60.700 -36.625 -66.401 1.00 71.14 ? 216 GLU B O 1 +ATOM 3264 C CB . GLU B 2 216 ? 60.604 -33.087 -67.375 1.00 63.57 ? 216 GLU B CB 1 +ATOM 3265 N N . MET C 3 1 ? 32.438 -87.070 10.482 1.00 109.18 ? 1 MET C N 1 +ATOM 3266 C CA . MET C 3 1 ? 32.997 -85.747 10.901 1.00 93.05 ? 1 MET C CA 1 +ATOM 3267 C C . MET C 3 1 ? 31.966 -84.659 10.615 1.00 104.85 ? 1 MET C C 1 +ATOM 3268 O O . MET C 3 1 ? 31.421 -84.595 9.516 1.00 129.61 ? 1 MET C O 1 +ATOM 3269 C CB . MET C 3 1 ? 34.301 -85.427 10.160 1.00 75.63 ? 1 MET C CB 1 +ATOM 3270 C CG . MET C 3 1 ? 35.414 -86.438 10.419 1.00 92.78 ? 1 MET C CG 1 +ATOM 3271 S SD . MET C 3 1 ? 37.021 -86.022 9.668 1.00 101.75 ? 1 MET C SD 1 +ATOM 3272 C CE . MET C 3 1 ? 37.658 -87.667 9.339 1.00 83.52 ? 1 MET C CE 1 +ATOM 3273 N N . LYS C 3 2 ? 31.698 -83.827 11.629 1.00 106.78 ? 2 LYS C N 1 +ATOM 3274 C CA . LYS C 3 2 ? 30.759 -82.718 11.536 1.00 85.88 ? 2 LYS C CA 1 +ATOM 3275 C C . LYS C 3 2 ? 31.230 -81.581 12.438 1.00 93.18 ? 2 LYS C C 1 +ATOM 3276 O O . LYS C 3 2 ? 31.932 -81.813 13.422 1.00 81.13 ? 2 LYS C O 1 +ATOM 3277 C CB . LYS C 3 2 ? 29.352 -83.164 11.948 1.00 98.59 ? 2 LYS C CB 1 +ATOM 3278 C CG . LYS C 3 2 ? 28.491 -83.763 10.843 1.00 105.69 ? 2 LYS C CG 1 +ATOM 3279 C CD . LYS C 3 2 ? 27.068 -84.075 11.275 1.00 104.93 ? 2 LYS C CD 1 +ATOM 3280 C CE . LYS C 3 2 ? 26.916 -85.429 11.936 1.00 119.65 ? 2 LYS C CE 1 +ATOM 3281 N NZ . LYS C 3 2 ? 25.576 -85.595 12.548 1.00 132.29 ? 2 LYS C NZ 1 +ATOM 3282 N N . VAL C 3 3 ? 30.821 -80.355 12.084 1.00 88.18 ? 3 VAL C N 1 +ATOM 3283 C CA . VAL C 3 3 ? 31.157 -79.152 12.830 1.00 81.26 ? 3 VAL C CA 1 +ATOM 3284 C C . VAL C 3 3 ? 30.148 -78.999 13.967 1.00 80.38 ? 3 VAL C C 1 +ATOM 3285 O O . VAL C 3 3 ? 28.957 -78.834 13.713 1.00 79.79 ? 3 VAL C O 1 +ATOM 3286 C CB . VAL C 3 3 ? 31.178 -77.905 11.917 1.00 85.78 ? 3 VAL C CB 1 +ATOM 3287 C CG1 . VAL C 3 3 ? 31.652 -76.661 12.654 1.00 87.10 ? 3 VAL C CG1 1 +ATOM 3288 C CG2 . VAL C 3 3 ? 31.991 -78.108 10.644 1.00 60.76 ? 3 VAL C CG2 1 +ATOM 3289 N N . LEU C 3 4 ? 30.635 -79.048 15.216 1.00 91.56 ? 4 LEU C N 1 +ATOM 3290 C CA . LEU C 3 4 ? 29.770 -78.914 16.380 1.00 99.78 ? 4 LEU C CA 1 +ATOM 3291 C C . LEU C 3 4 ? 29.550 -77.436 16.705 1.00 98.69 ? 4 LEU C C 1 +ATOM 3292 O O . LEU C 3 4 ? 28.424 -77.037 17.005 1.00 93.82 ? 4 LEU C O 1 +ATOM 3293 C CB . LEU C 3 4 ? 30.357 -79.678 17.576 1.00 97.59 ? 4 LEU C CB 1 +ATOM 3294 C CG . LEU C 3 4 ? 29.358 -80.408 18.481 1.00 86.25 ? 4 LEU C CG 1 +ATOM 3295 C CD1 . LEU C 3 4 ? 30.066 -81.471 19.305 1.00 87.23 ? 4 LEU C CD1 1 +ATOM 3296 C CD2 . LEU C 3 4 ? 28.603 -79.454 19.403 1.00 76.83 ? 4 LEU C CD2 1 +ATOM 3297 N N . GLN C 3 5 ? 30.627 -76.638 16.664 1.00 99.94 ? 5 GLN C N 1 +ATOM 3298 C CA . GLN C 3 5 ? 30.518 -75.200 16.868 1.00 101.79 ? 5 GLN C CA 1 +ATOM 3299 C C . GLN C 3 5 ? 31.237 -74.467 15.736 1.00 87.09 ? 5 GLN C C 1 +ATOM 3300 O O . GLN C 3 5 ? 32.455 -74.574 15.604 1.00 71.70 ? 5 GLN C O 1 +ATOM 3301 C CB . GLN C 3 5 ? 31.002 -74.795 18.266 1.00 97.06 ? 5 GLN C CB 1 +ATOM 3302 C CG . GLN C 3 5 ? 29.934 -74.103 19.109 1.00 101.80 ? 5 GLN C CG 1 +ATOM 3303 C CD . GLN C 3 5 ? 29.207 -72.989 18.389 1.00 129.20 ? 5 GLN C CD 1 +ATOM 3304 O OE1 . GLN C 3 5 ? 28.055 -73.128 17.977 1.00 107.64 ? 5 GLN C OE1 1 +ATOM 3305 N NE2 . GLN C 3 5 ? 29.887 -71.867 18.217 1.00 145.94 ? 5 GLN C NE2 1 +ATOM 3306 N N . GLU C 3 6 ? 30.456 -73.719 14.940 1.00 98.00 ? 6 GLU C N 1 +ATOM 3307 C CA . GLU C 3 6 ? 30.887 -73.032 13.727 1.00 83.45 ? 6 GLU C CA 1 +ATOM 3308 C C . GLU C 3 6 ? 32.072 -72.105 14.006 1.00 88.86 ? 6 GLU C C 1 +ATOM 3309 O O . GLU C 3 6 ? 32.146 -71.503 15.077 1.00 126.01 ? 6 GLU C O 1 +ATOM 3310 C CB . GLU C 3 6 ? 29.738 -72.207 13.142 1.00 88.31 ? 6 GLU C CB 1 +ATOM 3311 C CG . GLU C 3 6 ? 28.548 -73.038 12.688 1.00 116.43 ? 6 GLU C CG 1 +ATOM 3312 C CD . GLU C 3 6 ? 27.621 -72.384 11.673 1.00 125.12 ? 6 GLU C CD 1 +ATOM 3313 O OE1 . GLU C 3 6 ? 27.753 -71.158 11.434 1.00 107.72 ? 6 GLU C OE1 1 +ATOM 3314 O OE2 . GLU C 3 6 ? 26.771 -73.109 11.113 1.00 108.52 ? 6 GLU C OE2 1 +ATOM 3315 N N . PRO C 3 7 ? 33.033 -71.973 13.058 1.00 76.11 ? 7 PRO C N 1 +ATOM 3316 C CA . PRO C 3 7 ? 34.139 -71.014 13.168 1.00 75.16 ? 7 PRO C CA 1 +ATOM 3317 C C . PRO C 3 7 ? 33.793 -69.630 13.715 1.00 73.89 ? 7 PRO C C 1 +ATOM 3318 O O . PRO C 3 7 ? 32.804 -69.022 13.300 1.00 63.93 ? 7 PRO C O 1 +ATOM 3319 C CB . PRO C 3 7 ? 34.550 -70.878 11.695 1.00 63.37 ? 7 PRO C CB 1 +ATOM 3320 C CG . PRO C 3 7 ? 34.405 -72.283 11.178 1.00 55.96 ? 7 PRO C CG 1 +ATOM 3321 C CD . PRO C 3 7 ? 33.132 -72.778 11.829 1.00 62.11 ? 7 PRO C CD 1 +ATOM 3322 N N . THR C 3 8 ? 34.620 -69.159 14.662 1.00 71.65 ? 8 THR C N 1 +ATOM 3323 C CA . THR C 3 8 ? 34.537 -67.804 15.194 1.00 62.74 ? 8 THR C CA 1 +ATOM 3324 C C . THR C 3 8 ? 35.929 -67.210 15.344 1.00 69.61 ? 8 THR C C 1 +ATOM 3325 O O . THR C 3 8 ? 36.841 -67.851 15.870 1.00 67.04 ? 8 THR C O 1 +ATOM 3326 C CB . THR C 3 8 ? 33.804 -67.715 16.536 1.00 47.84 ? 8 THR C CB 1 +ATOM 3327 O OG1 . THR C 3 8 ? 33.998 -68.941 17.246 1.00 72.00 ? 8 THR C OG1 1 +ATOM 3328 C CG2 . THR C 3 8 ? 32.333 -67.410 16.358 1.00 47.41 ? 8 THR C CG2 1 +ATOM 3329 N N . CYS C 3 9 ? 36.042 -65.953 14.911 1.00 66.58 ? 9 CYS C N 1 +ATOM 3330 C CA . CYS C 3 9 ? 37.332 -65.340 14.665 1.00 67.16 ? 9 CYS C CA 1 +ATOM 3331 C C . CYS C 3 9 ? 37.494 -64.089 15.521 1.00 65.56 ? 9 CYS C C 1 +ATOM 3332 O O . CYS C 3 9 ? 36.507 -63.439 15.870 1.00 49.09 ? 9 CYS C O 1 +ATOM 3333 C CB . CYS C 3 9 ? 37.454 -64.978 13.191 1.00 95.26 ? 9 CYS C CB 1 +ATOM 3334 S SG . CYS C 3 9 ? 37.258 -66.393 12.077 1.00 98.57 ? 9 CYS C SG 1 +ATOM 3335 N N . VAL C 3 10 ? 38.757 -63.783 15.849 1.00 68.49 ? 10 VAL C N 1 +ATOM 3336 C CA . VAL C 3 10 ? 39.143 -62.564 16.544 1.00 71.66 ? 10 VAL C CA 1 +ATOM 3337 C C . VAL C 3 10 ? 40.525 -62.140 16.056 1.00 71.50 ? 10 VAL C C 1 +ATOM 3338 O O . VAL C 3 10 ? 41.491 -62.889 16.208 1.00 67.24 ? 10 VAL C O 1 +ATOM 3339 C CB . VAL C 3 10 ? 39.091 -62.700 18.082 1.00 64.11 ? 10 VAL C CB 1 +ATOM 3340 C CG1 . VAL C 3 10 ? 37.726 -62.336 18.646 1.00 81.76 ? 10 VAL C CG1 1 +ATOM 3341 C CG2 . VAL C 3 10 ? 39.536 -64.072 18.576 1.00 81.62 ? 10 VAL C CG2 1 +ATOM 3342 N N . SER C 3 11 ? 40.589 -60.936 15.465 1.00 59.21 ? 11 SER C N 1 +ATOM 3343 C CA . SER C 3 11 ? 41.820 -60.361 14.946 1.00 65.37 ? 11 SER C CA 1 +ATOM 3344 C C . SER C 3 11 ? 42.383 -59.316 15.907 1.00 71.30 ? 11 SER C C 1 +ATOM 3345 O O . SER C 3 11 ? 41.643 -58.711 16.679 1.00 74.34 ? 11 SER C O 1 +ATOM 3346 C CB . SER C 3 11 ? 41.615 -59.774 13.572 1.00 63.00 ? 11 SER C CB 1 +ATOM 3347 O OG . SER C 3 11 ? 40.811 -58.609 13.627 1.00 70.66 ? 11 SER C OG 1 +ATOM 3348 N N . ASP C 3 12 ? 43.702 -59.098 15.814 1.00 68.37 ? 12 ASP C N 1 +ATOM 3349 C CA . ASP C 3 12 ? 44.394 -58.052 16.548 1.00 64.77 ? 12 ASP C CA 1 +ATOM 3350 C C . ASP C 3 12 ? 44.429 -56.766 15.719 1.00 69.35 ? 12 ASP C C 1 +ATOM 3351 O O . ASP C 3 12 ? 45.036 -55.781 16.139 1.00 62.62 ? 12 ASP C O 1 +ATOM 3352 C CB . ASP C 3 12 ? 45.773 -58.530 17.019 1.00 67.04 ? 12 ASP C CB 1 +ATOM 3353 C CG . ASP C 3 12 ? 46.873 -58.471 15.967 1.00 78.26 ? 12 ASP C CG 1 +ATOM 3354 O OD1 . ASP C 3 12 ? 46.551 -58.515 14.759 1.00 71.15 ? 12 ASP C OD1 1 +ATOM 3355 O OD2 . ASP C 3 12 ? 48.054 -58.382 16.368 1.00 78.07 ? 12 ASP C OD2 1 +ATOM 3356 N N . TYR C 3 13 ? 43.797 -56.800 14.533 1.00 71.09 ? 13 TYR C N 1 +ATOM 3357 C CA . TYR C 3 13 ? 43.538 -55.633 13.697 1.00 71.39 ? 13 TYR C CA 1 +ATOM 3358 C C . TYR C 3 13 ? 44.821 -55.190 12.986 1.00 76.04 ? 13 TYR C C 1 +ATOM 3359 O O . TYR C 3 13 ? 44.948 -54.026 12.606 1.00 91.56 ? 13 TYR C O 1 +ATOM 3360 C CB . TYR C 3 13 ? 42.878 -54.521 14.527 1.00 74.88 ? 13 TYR C CB 1 +ATOM 3361 C CG . TYR C 3 13 ? 41.952 -53.557 13.824 1.00 63.36 ? 13 TYR C CG 1 +ATOM 3362 C CD1 . TYR C 3 13 ? 42.428 -52.632 12.900 1.00 58.10 ? 13 TYR C CD1 1 +ATOM 3363 C CD2 . TYR C 3 13 ? 40.600 -53.514 14.144 1.00 49.16 ? 13 TYR C CD2 1 +ATOM 3364 C CE1 . TYR C 3 13 ? 41.580 -51.730 12.274 1.00 47.39 ? 13 TYR C CE1 1 +ATOM 3365 C CE2 . TYR C 3 13 ? 39.739 -52.612 13.536 1.00 45.99 ? 13 TYR C CE2 1 +ATOM 3366 C CZ . TYR C 3 13 ? 40.233 -51.716 12.599 1.00 47.06 ? 13 TYR C CZ 1 +ATOM 3367 O OH . TYR C 3 13 ? 39.398 -50.827 11.986 1.00 44.07 ? 13 TYR C OH 1 +ATOM 3368 N N . MET C 3 14 ? 45.767 -56.119 12.777 1.00 70.21 ? 14 MET C N 1 +ATOM 3369 C CA . MET C 3 14 ? 47.000 -55.754 12.097 1.00 77.04 ? 14 MET C CA 1 +ATOM 3370 C C . MET C 3 14 ? 47.594 -56.913 11.298 1.00 77.61 ? 14 MET C C 1 +ATOM 3371 O O . MET C 3 14 ? 47.951 -56.723 10.140 1.00 92.76 ? 14 MET C O 1 +ATOM 3372 C CB . MET C 3 14 ? 48.056 -55.198 13.061 1.00 88.56 ? 14 MET C CB 1 +ATOM 3373 C CG . MET C 3 14 ? 48.967 -54.170 12.398 1.00 95.09 ? 14 MET C CG 1 +ATOM 3374 S SD . MET C 3 14 ? 50.498 -53.813 13.298 1.00 105.07 ? 14 MET C SD 1 +ATOM 3375 C CE . MET C 3 14 ? 51.520 -55.210 12.825 1.00 111.83 ? 14 MET C CE 1 +ATOM 3376 N N . SER C 3 15 ? 47.758 -58.088 11.918 1.00 82.68 ? 15 SER C N 1 +ATOM 3377 C CA . SER C 3 15 ? 48.583 -59.120 11.302 1.00 93.71 ? 15 SER C CA 1 +ATOM 3378 C C . SER C 3 15 ? 48.008 -60.524 11.476 1.00 80.96 ? 15 SER C C 1 +ATOM 3379 O O . SER C 3 15 ? 48.144 -61.348 10.575 1.00 78.35 ? 15 SER C O 1 +ATOM 3380 C CB . SER C 3 15 ? 50.025 -59.036 11.754 1.00 91.41 ? 15 SER C CB 1 +ATOM 3381 O OG . SER C 3 15 ? 50.138 -58.367 13.001 1.00 66.37 ? 15 SER C OG 1 +ATOM 3382 N N . ILE C 3 16 ? 47.387 -60.785 12.633 1.00 68.52 ? 16 ILE C N 1 +ATOM 3383 C CA . ILE C 3 16 ? 46.890 -62.107 12.986 1.00 65.80 ? 16 ILE C CA 1 +ATOM 3384 C C . ILE C 3 16 ? 45.377 -62.027 13.179 1.00 66.22 ? 16 ILE C C 1 +ATOM 3385 O O . ILE C 3 16 ? 44.851 -60.980 13.541 1.00 85.70 ? 16 ILE C O 1 +ATOM 3386 C CB . ILE C 3 16 ? 47.605 -62.669 14.238 1.00 61.34 ? 16 ILE C CB 1 +ATOM 3387 C CG1 . ILE C 3 16 ? 49.131 -62.542 14.164 1.00 76.46 ? 16 ILE C CG1 1 +ATOM 3388 C CG2 . ILE C 3 16 ? 47.196 -64.112 14.503 1.00 67.24 ? 16 ILE C CG2 1 +ATOM 3389 C CD1 . ILE C 3 16 ? 49.708 -61.386 14.954 1.00 94.91 ? 16 ILE C CD1 1 +ATOM 3390 N N . SER C 3 17 ? 44.695 -63.152 12.931 1.00 73.04 ? 17 SER C N 1 +ATOM 3391 C CA . SER C 3 17 ? 43.262 -63.296 13.128 1.00 51.75 ? 17 SER C CA 1 +ATOM 3392 C C . SER C 3 17 ? 42.962 -64.755 13.458 1.00 53.41 ? 17 SER C C 1 +ATOM 3393 O O . SER C 3 17 ? 43.030 -65.613 12.583 1.00 72.22 ? 17 SER C O 1 +ATOM 3394 C CB . SER C 3 17 ? 42.520 -62.831 11.905 1.00 50.59 ? 17 SER C CB 1 +ATOM 3395 O OG . SER C 3 17 ? 41.190 -62.462 12.228 1.00 73.38 ? 17 SER C OG 1 +ATOM 3396 N N . THR C 3 18 ? 42.675 -65.032 14.738 1.00 78.85 ? 18 THR C N 1 +ATOM 3397 C CA . THR C 3 18 ? 42.543 -66.396 15.232 1.00 74.97 ? 18 THR C CA 1 +ATOM 3398 C C . THR C 3 18 ? 41.102 -66.867 15.056 1.00 79.84 ? 18 THR C C 1 +ATOM 3399 O O . THR C 3 18 ? 40.186 -66.249 15.599 1.00 82.58 ? 18 THR C O 1 +ATOM 3400 C CB . THR C 3 18 ? 43.002 -66.543 16.692 1.00 63.11 ? 18 THR C CB 1 +ATOM 3401 O OG1 . THR C 3 18 ? 44.202 -65.811 16.950 1.00 64.54 ? 18 THR C OG1 1 +ATOM 3402 C CG2 . THR C 3 18 ? 43.237 -67.985 17.082 1.00 76.78 ? 18 THR C CG2 1 +ATOM 3403 N N . CYS C 3 19 ? 40.930 -67.965 14.300 1.00 77.02 ? 19 CYS C N 1 +ATOM 3404 C CA . CYS C 3 19 ? 39.629 -68.585 14.085 1.00 88.93 ? 19 CYS C CA 1 +ATOM 3405 C C . CYS C 3 19 ? 39.603 -69.980 14.703 1.00 84.30 ? 19 CYS C C 1 +ATOM 3406 O O . CYS C 3 19 ? 40.489 -70.793 14.441 1.00 76.12 ? 19 CYS C O 1 +ATOM 3407 C CB . CYS C 3 19 ? 39.270 -68.663 12.606 1.00 85.01 ? 19 CYS C CB 1 +ATOM 3408 S SG . CYS C 3 19 ? 39.172 -67.041 11.801 1.00 127.45 ? 19 CYS C SG 1 +ATOM 3409 N N . GLU C 3 20 ? 38.568 -70.229 15.519 1.00 84.25 ? 20 GLU C N 1 +ATOM 3410 C CA . GLU C 3 20 ? 38.410 -71.464 16.274 1.00 83.15 ? 20 GLU C CA 1 +ATOM 3411 C C . GLU C 3 20 ? 37.073 -72.124 15.937 1.00 80.47 ? 20 GLU C C 1 +ATOM 3412 O O . GLU C 3 20 ? 36.094 -71.431 15.648 1.00 82.38 ? 20 GLU C O 1 +ATOM 3413 C CB . GLU C 3 20 ? 38.564 -71.213 17.778 1.00 70.83 ? 20 GLU C CB 1 +ATOM 3414 C CG . GLU C 3 20 ? 37.583 -70.194 18.344 1.00 106.63 ? 20 GLU C CG 1 +ATOM 3415 C CD . GLU C 3 20 ? 37.255 -70.317 19.825 1.00 123.31 ? 20 GLU C CD 1 +ATOM 3416 O OE1 . GLU C 3 20 ? 37.200 -69.268 20.503 1.00 105.44 ? 20 GLU C OE1 1 +ATOM 3417 O OE2 . GLU C 3 20 ? 37.034 -71.457 20.296 1.00 119.67 ? 20 GLU C OE2 1 +ATOM 3418 N N . TRP C 3 21 ? 37.058 -73.469 15.971 1.00 63.04 ? 21 TRP C N 1 +ATOM 3419 C CA . TRP C 3 21 ? 35.836 -74.253 15.843 1.00 74.26 ? 21 TRP C CA 1 +ATOM 3420 C C . TRP C 3 21 ? 35.960 -75.574 16.602 1.00 88.00 ? 21 TRP C C 1 +ATOM 3421 O O . TRP C 3 21 ? 37.062 -76.093 16.777 1.00 82.45 ? 21 TRP C O 1 +ATOM 3422 C CB . TRP C 3 21 ? 35.422 -74.445 14.372 1.00 78.00 ? 21 TRP C CB 1 +ATOM 3423 C CG . TRP C 3 21 ? 36.285 -75.383 13.586 1.00 88.07 ? 21 TRP C CG 1 +ATOM 3424 C CD1 . TRP C 3 21 ? 36.072 -76.717 13.380 1.00 87.48 ? 21 TRP C CD1 1 +ATOM 3425 C CD2 . TRP C 3 21 ? 37.505 -75.063 12.891 1.00 84.24 ? 21 TRP C CD2 1 +ATOM 3426 N NE1 . TRP C 3 21 ? 37.074 -77.250 12.615 1.00 71.64 ? 21 TRP C NE1 1 +ATOM 3427 C CE2 . TRP C 3 21 ? 37.969 -76.261 12.301 1.00 75.23 ? 21 TRP C CE2 1 +ATOM 3428 C CE3 . TRP C 3 21 ? 38.253 -73.890 12.715 1.00 78.14 ? 21 TRP C CE3 1 +ATOM 3429 C CZ2 . TRP C 3 21 ? 39.147 -76.315 11.552 1.00 70.85 ? 21 TRP C CZ2 1 +ATOM 3430 C CZ3 . TRP C 3 21 ? 39.414 -73.944 11.973 1.00 71.96 ? 21 TRP C CZ3 1 +ATOM 3431 C CH2 . TRP C 3 21 ? 39.853 -75.141 11.400 1.00 74.83 ? 21 TRP C CH2 1 +ATOM 3432 N N . LYS C 3 22 ? 34.803 -76.085 17.053 1.00 107.16 ? 22 LYS C N 1 +ATOM 3433 C CA . LYS C 3 22 ? 34.662 -77.366 17.731 1.00 95.14 ? 22 LYS C CA 1 +ATOM 3434 C C . LYS C 3 22 ? 34.005 -78.363 16.780 1.00 91.74 ? 22 LYS C C 1 +ATOM 3435 O O . LYS C 3 22 ? 33.238 -77.968 15.902 1.00 106.40 ? 22 LYS C O 1 +ATOM 3436 C CB . LYS C 3 22 ? 33.757 -77.226 18.960 1.00 117.98 ? 22 LYS C CB 1 +ATOM 3437 C CG . LYS C 3 22 ? 34.203 -76.244 20.035 1.00 138.70 ? 22 LYS C CG 1 +ATOM 3438 C CD . LYS C 3 22 ? 33.147 -76.058 21.101 1.00 117.44 ? 22 LYS C CD 1 +ATOM 3439 C CE . LYS C 3 22 ? 33.620 -75.239 22.279 1.00 91.86 ? 22 LYS C CE 1 +ATOM 3440 N NZ . LYS C 3 22 ? 32.677 -75.369 23.411 1.00 94.12 ? 22 LYS C NZ 1 +ATOM 3441 N N . MET C 3 23 ? 34.283 -79.658 16.982 1.00 90.25 ? 23 MET C N 1 +ATOM 3442 C CA . MET C 3 23 ? 33.757 -80.696 16.104 1.00 96.84 ? 23 MET C CA 1 +ATOM 3443 C C . MET C 3 23 ? 33.036 -81.790 16.890 1.00 112.44 ? 23 MET C C 1 +ATOM 3444 O O . MET C 3 23 ? 33.294 -82.006 18.074 1.00 126.17 ? 23 MET C O 1 +ATOM 3445 C CB . MET C 3 23 ? 34.860 -81.321 15.246 1.00 68.94 ? 23 MET C CB 1 +ATOM 3446 C CG . MET C 3 23 ? 35.671 -80.287 14.503 1.00 77.04 ? 23 MET C CG 1 +ATOM 3447 S SD . MET C 3 23 ? 36.030 -80.792 12.823 1.00 84.50 ? 23 MET C SD 1 +ATOM 3448 C CE . MET C 3 23 ? 34.547 -80.262 11.970 1.00 95.08 ? 23 MET C CE 1 +ATOM 3449 N N . ASN C 3 24 ? 32.105 -82.454 16.193 1.00 117.67 ? 24 ASN C N 1 +ATOM 3450 C CA . ASN C 3 24 ? 31.457 -83.682 16.625 1.00 86.30 ? 24 ASN C CA 1 +ATOM 3451 C C . ASN C 3 24 ? 32.479 -84.808 16.481 1.00 71.73 ? 24 ASN C C 1 +ATOM 3452 O O . ASN C 3 24 ? 32.888 -85.136 15.367 1.00 106.78 ? 24 ASN C O 1 +ATOM 3453 C CB . ASN C 3 24 ? 30.090 -83.820 15.934 1.00 85.34 ? 24 ASN C CB 1 +ATOM 3454 C CG . ASN C 3 24 ? 29.705 -85.212 15.475 1.00 94.03 ? 24 ASN C CG 1 +ATOM 3455 O OD1 . ASN C 3 24 ? 30.185 -85.693 14.449 1.00 91.30 ? 24 ASN C OD1 1 +ATOM 3456 N ND2 . ASN C 3 24 ? 28.788 -85.840 16.193 1.00 112.41 ? 24 ASN C ND2 1 +ATOM 3457 N N . GLY C 3 25 ? 32.939 -85.328 17.629 1.00 61.23 ? 25 GLY C N 1 +ATOM 3458 C CA . GLY C 3 25 ? 33.966 -86.362 17.697 1.00 57.54 ? 25 GLY C CA 1 +ATOM 3459 C C . GLY C 3 25 ? 35.385 -85.804 17.540 1.00 53.39 ? 25 GLY C C 1 +ATOM 3460 O O . GLY C 3 25 ? 35.568 -84.751 16.931 1.00 56.22 ? 25 GLY C O 1 +ATOM 3461 N N . PRO C 3 26 ? 36.431 -86.472 18.093 1.00 50.72 ? 26 PRO C N 1 +ATOM 3462 C CA . PRO C 3 26 ? 37.809 -85.971 18.023 1.00 57.49 ? 26 PRO C CA 1 +ATOM 3463 C C . PRO C 3 26 ? 38.434 -86.014 16.633 1.00 69.64 ? 26 PRO C C 1 +ATOM 3464 O O . PRO C 3 26 ? 38.280 -86.991 15.897 1.00 62.34 ? 26 PRO C O 1 +ATOM 3465 C CB . PRO C 3 26 ? 38.615 -86.887 18.959 1.00 49.18 ? 26 PRO C CB 1 +ATOM 3466 C CG . PRO C 3 26 ? 37.559 -87.592 19.784 1.00 55.96 ? 26 PRO C CG 1 +ATOM 3467 C CD . PRO C 3 26 ? 36.348 -87.712 18.878 1.00 55.89 ? 26 PRO C CD 1 +ATOM 3468 N N . THR C 3 27 ? 39.152 -84.929 16.314 1.00 76.30 ? 27 THR C N 1 +ATOM 3469 C CA . THR C 3 27 ? 39.813 -84.743 15.034 1.00 65.55 ? 27 THR C CA 1 +ATOM 3470 C C . THR C 3 27 ? 41.289 -84.442 15.269 1.00 67.41 ? 27 THR C C 1 +ATOM 3471 O O . THR C 3 27 ? 41.653 -83.856 16.290 1.00 75.27 ? 27 THR C O 1 +ATOM 3472 C CB . THR C 3 27 ? 39.177 -83.604 14.224 1.00 77.76 ? 27 THR C CB 1 +ATOM 3473 O OG1 . THR C 3 27 ? 37.815 -83.401 14.605 1.00 97.38 ? 27 THR C OG1 1 +ATOM 3474 C CG2 . THR C 3 27 ? 39.246 -83.845 12.732 1.00 95.36 ? 27 THR C CG2 1 +ATOM 3475 N N . ASN C 3 28 ? 42.124 -84.894 14.325 1.00 68.66 ? 28 ASN C N 1 +ATOM 3476 C CA . ASN C 3 28 ? 43.467 -84.372 14.151 1.00 70.46 ? 28 ASN C CA 1 +ATOM 3477 C C . ASN C 3 28 ? 43.415 -83.318 13.048 1.00 77.66 ? 28 ASN C C 1 +ATOM 3478 O O . ASN C 3 28 ? 43.467 -83.643 11.859 1.00 81.36 ? 28 ASN C O 1 +ATOM 3479 C CB . ASN C 3 28 ? 44.485 -85.485 13.894 1.00 72.48 ? 28 ASN C CB 1 +ATOM 3480 C CG . ASN C 3 28 ? 45.925 -85.011 13.898 1.00 83.15 ? 28 ASN C CG 1 +ATOM 3481 O OD1 . ASN C 3 28 ? 46.206 -83.812 13.913 1.00 94.41 ? 28 ASN C OD1 1 +ATOM 3482 N ND2 . ASN C 3 28 ? 46.846 -85.962 13.884 1.00 83.18 ? 28 ASN C ND2 1 +ATOM 3483 N N . CYS C 3 29 ? 43.301 -82.056 13.482 1.00 70.44 ? 29 CYS C N 1 +ATOM 3484 C CA . CYS C 3 29 ? 43.116 -80.900 12.618 1.00 76.84 ? 29 CYS C CA 1 +ATOM 3485 C C . CYS C 3 29 ? 44.314 -80.760 11.684 1.00 72.80 ? 29 CYS C C 1 +ATOM 3486 O O . CYS C 3 29 ? 44.163 -80.332 10.540 1.00 58.02 ? 29 CYS C O 1 +ATOM 3487 C CB . CYS C 3 29 ? 42.998 -79.617 13.437 1.00 90.61 ? 29 CYS C CB 1 +ATOM 3488 S SG . CYS C 3 29 ? 42.005 -79.773 14.946 1.00 82.81 ? 29 CYS C SG 1 +ATOM 3489 N N . SER C 3 30 ? 45.489 -81.154 12.195 1.00 80.74 ? 30 SER C N 1 +ATOM 3490 C CA . SER C 3 30 ? 46.779 -80.969 11.548 1.00 80.31 ? 30 SER C CA 1 +ATOM 3491 C C . SER C 3 30 ? 46.877 -81.808 10.277 1.00 70.21 ? 30 SER C C 1 +ATOM 3492 O O . SER C 3 30 ? 47.805 -81.625 9.489 1.00 82.82 ? 30 SER C O 1 +ATOM 3493 C CB . SER C 3 30 ? 47.913 -81.290 12.501 1.00 84.46 ? 30 SER C CB 1 +ATOM 3494 O OG . SER C 3 30 ? 47.564 -80.987 13.847 1.00 115.59 ? 30 SER C OG 1 +ATOM 3495 N N . THR C 3 31 ? 45.913 -82.720 10.084 1.00 60.33 ? 31 THR C N 1 +ATOM 3496 C CA . THR C 3 31 ? 46.014 -83.731 9.042 1.00 85.22 ? 31 THR C CA 1 +ATOM 3497 C C . THR C 3 31 ? 44.726 -83.853 8.223 1.00 93.76 ? 31 THR C C 1 +ATOM 3498 O O . THR C 3 31 ? 44.794 -84.008 7.004 1.00 99.22 ? 31 THR C O 1 +ATOM 3499 C CB . THR C 3 31 ? 46.521 -85.064 9.610 1.00 77.11 ? 31 THR C CB 1 +ATOM 3500 O OG1 . THR C 3 31 ? 45.814 -85.355 10.815 1.00 86.46 ? 31 THR C OG1 1 +ATOM 3501 C CG2 . THR C 3 31 ? 48.009 -85.061 9.883 1.00 59.67 ? 31 THR C CG2 1 +ATOM 3502 N N . GLU C 3 32 ? 43.565 -83.782 8.891 1.00 81.73 ? 32 GLU C N 1 +ATOM 3503 C CA . GLU C 3 32 ? 42.278 -84.079 8.275 1.00 73.64 ? 32 GLU C CA 1 +ATOM 3504 C C . GLU C 3 32 ? 41.672 -82.839 7.612 1.00 73.54 ? 32 GLU C C 1 +ATOM 3505 O O . GLU C 3 32 ? 41.175 -82.924 6.487 1.00 65.82 ? 32 GLU C O 1 +ATOM 3506 C CB . GLU C 3 32 ? 41.332 -84.705 9.302 1.00 83.93 ? 32 GLU C CB 1 +ATOM 3507 C CG . GLU C 3 32 ? 41.657 -86.157 9.603 1.00 97.46 ? 32 GLU C CG 1 +ATOM 3508 C CD . GLU C 3 32 ? 41.284 -86.613 11.003 1.00 115.73 ? 32 GLU C CD 1 +ATOM 3509 O OE1 . GLU C 3 32 ? 42.205 -86.862 11.807 1.00 114.38 ? 32 GLU C OE1 1 +ATOM 3510 O OE2 . GLU C 3 32 ? 40.075 -86.726 11.285 1.00 115.26 ? 32 GLU C OE2 1 +ATOM 3511 N N . LEU C 3 33 ? 41.730 -81.694 8.311 1.00 73.55 ? 33 LEU C N 1 +ATOM 3512 C CA . LEU C 3 33 ? 41.042 -80.467 7.925 1.00 71.21 ? 33 LEU C CA 1 +ATOM 3513 C C . LEU C 3 33 ? 41.987 -79.497 7.216 1.00 60.59 ? 33 LEU C C 1 +ATOM 3514 O O . LEU C 3 33 ? 43.193 -79.511 7.464 1.00 59.41 ? 33 LEU C O 1 +ATOM 3515 C CB . LEU C 3 33 ? 40.469 -79.810 9.185 1.00 70.96 ? 33 LEU C CB 1 +ATOM 3516 C CG . LEU C 3 33 ? 39.326 -80.563 9.860 1.00 68.95 ? 33 LEU C CG 1 +ATOM 3517 C CD1 . LEU C 3 33 ? 39.519 -80.568 11.359 1.00 82.96 ? 33 LEU C CD1 1 +ATOM 3518 C CD2 . LEU C 3 33 ? 37.978 -79.961 9.500 1.00 66.02 ? 33 LEU C CD2 1 +ATOM 3519 N N . ARG C 3 34 ? 41.412 -78.652 6.342 1.00 59.62 ? 34 ARG C N 1 +ATOM 3520 C CA . ARG C 3 34 ? 42.106 -77.533 5.713 1.00 58.58 ? 34 ARG C CA 1 +ATOM 3521 C C . ARG C 3 34 ? 41.132 -76.375 5.499 1.00 66.05 ? 34 ARG C C 1 +ATOM 3522 O O . ARG C 3 34 ? 40.109 -76.542 4.837 1.00 78.82 ? 34 ARG C O 1 +ATOM 3523 C CB . ARG C 3 34 ? 42.738 -77.923 4.372 1.00 41.01 ? 34 ARG C CB 1 +ATOM 3524 C CG . ARG C 3 34 ? 43.888 -78.922 4.458 1.00 48.60 ? 34 ARG C CG 1 +ATOM 3525 C CD . ARG C 3 34 ? 45.261 -78.379 4.811 1.00 46.76 ? 34 ARG C CD 1 +ATOM 3526 N NE . ARG C 3 34 ? 46.262 -79.433 4.748 1.00 59.79 ? 34 ARG C NE 1 +ATOM 3527 C CZ . ARG C 3 34 ? 46.529 -80.302 5.724 1.00 97.22 ? 34 ARG C CZ 1 +ATOM 3528 N NH1 . ARG C 3 34 ? 45.935 -80.202 6.903 1.00 106.02 ? 34 ARG C NH1 1 +ATOM 3529 N NH2 . ARG C 3 34 ? 47.397 -81.275 5.518 1.00 113.68 ? 34 ARG C NH2 1 +ATOM 3530 N N . LEU C 3 35 ? 41.472 -75.205 6.061 1.00 62.79 ? 35 LEU C N 1 +ATOM 3531 C CA . LEU C 3 35 ? 40.641 -74.015 5.957 1.00 68.10 ? 35 LEU C CA 1 +ATOM 3532 C C . LEU C 3 35 ? 41.255 -73.015 4.978 1.00 63.77 ? 35 LEU C C 1 +ATOM 3533 O O . LEU C 3 35 ? 42.301 -72.428 5.253 1.00 65.68 ? 35 LEU C O 1 +ATOM 3534 C CB . LEU C 3 35 ? 40.460 -73.409 7.353 1.00 81.50 ? 35 LEU C CB 1 +ATOM 3535 C CG . LEU C 3 35 ? 39.816 -72.023 7.419 1.00 68.66 ? 35 LEU C CG 1 +ATOM 3536 C CD1 . LEU C 3 35 ? 38.344 -72.059 7.026 1.00 55.14 ? 35 LEU C CD1 1 +ATOM 3537 C CD2 . LEU C 3 35 ? 39.984 -71.435 8.809 1.00 79.38 ? 35 LEU C CD2 1 +ATOM 3538 N N . LEU C 3 36 ? 40.577 -72.851 3.835 1.00 74.78 ? 36 LEU C N 1 +ATOM 3539 C CA . LEU C 3 36 ? 40.940 -71.900 2.795 1.00 72.76 ? 36 LEU C CA 1 +ATOM 3540 C C . LEU C 3 36 ? 40.171 -70.611 3.040 1.00 71.77 ? 36 LEU C C 1 +ATOM 3541 O O . LEU C 3 36 ? 39.038 -70.657 3.522 1.00 98.13 ? 36 LEU C O 1 +ATOM 3542 C CB . LEU C 3 36 ? 40.568 -72.475 1.423 1.00 78.11 ? 36 LEU C CB 1 +ATOM 3543 C CG . LEU C 3 36 ? 41.396 -73.661 0.925 1.00 85.01 ? 36 LEU C CG 1 +ATOM 3544 C CD1 . LEU C 3 36 ? 40.634 -74.430 -0.139 1.00 80.90 ? 36 LEU C CD1 1 +ATOM 3545 C CD2 . LEU C 3 36 ? 42.741 -73.215 0.368 1.00 104.48 ? 36 LEU C CD2 1 +ATOM 3546 N N . TYR C 3 37 ? 40.793 -69.478 2.690 1.00 58.80 ? 37 TYR C N 1 +ATOM 3547 C CA . TYR C 3 37 ? 40.178 -68.171 2.882 1.00 55.34 ? 37 TYR C CA 1 +ATOM 3548 C C . TYR C 3 37 ? 40.602 -67.202 1.781 1.00 43.40 ? 37 TYR C C 1 +ATOM 3549 O O . TYR C 3 37 ? 41.655 -67.376 1.180 1.00 53.40 ? 37 TYR C O 1 +ATOM 3550 C CB . TYR C 3 37 ? 40.420 -67.649 4.303 1.00 58.60 ? 37 TYR C CB 1 +ATOM 3551 C CG . TYR C 3 37 ? 41.838 -67.278 4.659 1.00 54.00 ? 37 TYR C CG 1 +ATOM 3552 C CD1 . TYR C 3 37 ? 42.740 -68.232 5.117 1.00 57.19 ? 37 TYR C CD1 1 +ATOM 3553 C CD2 . TYR C 3 37 ? 42.269 -65.960 4.587 1.00 57.19 ? 37 TYR C CD2 1 +ATOM 3554 C CE1 . TYR C 3 37 ? 44.042 -67.895 5.466 1.00 59.15 ? 37 TYR C CE1 1 +ATOM 3555 C CE2 . TYR C 3 37 ? 43.562 -65.600 4.941 1.00 65.91 ? 37 TYR C CE2 1 +ATOM 3556 C CZ . TYR C 3 37 ? 44.450 -66.571 5.383 1.00 76.49 ? 37 TYR C CZ 1 +ATOM 3557 O OH . TYR C 3 37 ? 45.724 -66.221 5.726 1.00 71.01 ? 37 TYR C OH 1 +ATOM 3558 N N . GLN C 3 38 ? 39.781 -66.171 1.541 1.00 44.10 ? 38 GLN C N 1 +ATOM 3559 C CA . GLN C 3 38 ? 40.038 -65.207 0.478 1.00 54.75 ? 38 GLN C CA 1 +ATOM 3560 C C . GLN C 3 38 ? 39.411 -63.856 0.816 1.00 45.51 ? 38 GLN C C 1 +ATOM 3561 O O . GLN C 3 38 ? 38.204 -63.777 1.044 1.00 53.78 ? 38 GLN C O 1 +ATOM 3562 C CB . GLN C 3 38 ? 39.446 -65.747 -0.825 1.00 76.92 ? 38 GLN C CB 1 +ATOM 3563 C CG . GLN C 3 38 ? 39.849 -64.970 -2.068 1.00 76.23 ? 38 GLN C CG 1 +ATOM 3564 C CD . GLN C 3 38 ? 39.651 -65.768 -3.333 1.00 85.38 ? 38 GLN C CD 1 +ATOM 3565 O OE1 . GLN C 3 38 ? 38.886 -66.734 -3.387 1.00 66.73 ? 38 GLN C OE1 1 +ATOM 3566 N NE2 . GLN C 3 38 ? 40.358 -65.361 -4.373 1.00 87.27 ? 38 GLN C NE2 1 +ATOM 3567 N N . LEU C 3 39 ? 40.232 -62.794 0.829 1.00 49.64 ? 39 LEU C N 1 +ATOM 3568 C CA . LEU C 3 39 ? 39.703 -61.450 1.009 1.00 55.30 ? 39 LEU C CA 1 +ATOM 3569 C C . LEU C 3 39 ? 38.830 -61.102 -0.191 1.00 54.84 ? 39 LEU C C 1 +ATOM 3570 O O . LEU C 3 39 ? 39.305 -61.071 -1.321 1.00 59.73 ? 39 LEU C O 1 +ATOM 3571 C CB . LEU C 3 39 ? 40.814 -60.409 1.194 1.00 53.73 ? 39 LEU C CB 1 +ATOM 3572 C CG . LEU C 3 39 ? 40.314 -58.959 1.269 1.00 60.43 ? 39 LEU C CG 1 +ATOM 3573 C CD1 . LEU C 3 39 ? 40.086 -58.512 2.702 1.00 55.56 ? 39 LEU C CD1 1 +ATOM 3574 C CD2 . LEU C 3 39 ? 41.256 -57.989 0.569 1.00 53.76 ? 39 LEU C CD2 1 +ATOM 3575 N N . VAL C 3 40 ? 37.555 -60.837 0.106 1.00 62.22 ? 40 VAL C N 1 +ATOM 3576 C CA . VAL C 3 40 ? 36.512 -60.513 -0.852 1.00 52.22 ? 40 VAL C CA 1 +ATOM 3577 C C . VAL C 3 40 ? 36.860 -59.174 -1.502 1.00 54.07 ? 40 VAL C C 1 +ATOM 3578 O O . VAL C 3 40 ? 36.506 -58.104 -1.012 1.00 62.61 ? 40 VAL C O 1 +ATOM 3579 C CB . VAL C 3 40 ? 35.139 -60.504 -0.147 1.00 60.06 ? 40 VAL C CB 1 +ATOM 3580 C CG1 . VAL C 3 40 ? 33.978 -60.356 -1.117 1.00 60.69 ? 40 VAL C CG1 1 +ATOM 3581 C CG2 . VAL C 3 40 ? 34.953 -61.741 0.722 1.00 56.30 ? 40 VAL C CG2 1 +ATOM 3582 N N . PHE C 3 41 ? 37.614 -59.264 -2.595 1.00 60.13 ? 41 PHE C N 1 +ATOM 3583 C CA . PHE C 3 41 ? 38.127 -58.118 -3.318 1.00 55.28 ? 41 PHE C CA 1 +ATOM 3584 C C . PHE C 3 41 ? 38.567 -58.595 -4.694 1.00 61.14 ? 41 PHE C C 1 +ATOM 3585 O O . PHE C 3 41 ? 39.008 -59.732 -4.839 1.00 70.19 ? 41 PHE C O 1 +ATOM 3586 C CB . PHE C 3 41 ? 39.313 -57.507 -2.571 1.00 54.98 ? 41 PHE C CB 1 +ATOM 3587 C CG . PHE C 3 41 ? 39.781 -56.179 -3.108 1.00 65.58 ? 41 PHE C CG 1 +ATOM 3588 C CD1 . PHE C 3 41 ? 38.936 -55.076 -3.121 1.00 84.28 ? 41 PHE C CD1 1 +ATOM 3589 C CD2 . PHE C 3 41 ? 41.073 -56.027 -3.593 1.00 60.79 ? 41 PHE C CD2 1 +ATOM 3590 C CE1 . PHE C 3 41 ? 39.375 -53.854 -3.612 1.00 108.55 ? 41 PHE C CE1 1 +ATOM 3591 C CE2 . PHE C 3 41 ? 41.510 -54.804 -4.086 1.00 67.59 ? 41 PHE C CE2 1 +ATOM 3592 C CZ . PHE C 3 41 ? 40.663 -53.717 -4.091 1.00 73.79 ? 41 PHE C CZ 1 +ATOM 3593 N N . LEU C 3 42 ? 38.457 -57.707 -5.685 1.00 59.97 ? 42 LEU C N 1 +ATOM 3594 C CA . LEU C 3 42 ? 38.718 -58.047 -7.073 1.00 52.46 ? 42 LEU C CA 1 +ATOM 3595 C C . LEU C 3 42 ? 40.131 -58.602 -7.249 1.00 50.54 ? 42 LEU C C 1 +ATOM 3596 O O . LEU C 3 42 ? 41.108 -58.006 -6.792 1.00 48.92 ? 42 LEU C O 1 +ATOM 3597 C CB . LEU C 3 42 ? 38.491 -56.805 -7.936 1.00 51.74 ? 42 LEU C CB 1 +ATOM 3598 C CG . LEU C 3 42 ? 37.898 -57.064 -9.316 1.00 57.67 ? 42 LEU C CG 1 +ATOM 3599 C CD1 . LEU C 3 42 ? 36.420 -57.426 -9.214 1.00 53.15 ? 42 LEU C CD1 1 +ATOM 3600 C CD2 . LEU C 3 42 ? 38.078 -55.835 -10.191 1.00 66.20 ? 42 LEU C CD2 1 +ATOM 3601 N N . LEU C 3 43 ? 40.189 -59.782 -7.886 1.00 46.54 ? 43 LEU C N 1 +ATOM 3602 C CA . LEU C 3 43 ? 41.397 -60.436 -8.379 1.00 53.89 ? 43 LEU C CA 1 +ATOM 3603 C C . LEU C 3 43 ? 42.328 -60.857 -7.242 1.00 50.95 ? 43 LEU C C 1 +ATOM 3604 O O . LEU C 3 43 ? 43.538 -60.954 -7.431 1.00 70.23 ? 43 LEU C O 1 +ATOM 3605 C CB . LEU C 3 43 ? 42.089 -59.572 -9.447 1.00 45.21 ? 43 LEU C CB 1 +ATOM 3606 C CG . LEU C 3 43 ? 41.387 -59.550 -10.809 1.00 57.30 ? 43 LEU C CG 1 +ATOM 3607 C CD1 . LEU C 3 43 ? 41.661 -58.266 -11.583 1.00 49.80 ? 43 LEU C CD1 1 +ATOM 3608 C CD2 . LEU C 3 43 ? 41.741 -60.777 -11.636 1.00 55.47 ? 43 LEU C CD2 1 +ATOM 3609 N N . SER C 3 44 ? 41.743 -61.160 -6.079 1.00 48.62 ? 44 SER C N 1 +ATOM 3610 C CA . SER C 3 44 ? 42.459 -61.735 -4.950 1.00 55.47 ? 44 SER C CA 1 +ATOM 3611 C C . SER C 3 44 ? 42.674 -63.232 -5.170 1.00 62.71 ? 44 SER C C 1 +ATOM 3612 O O . SER C 3 44 ? 42.058 -63.840 -6.046 1.00 64.26 ? 44 SER C O 1 +ATOM 3613 C CB . SER C 3 44 ? 41.694 -61.501 -3.677 1.00 49.05 ? 44 SER C CB 1 +ATOM 3614 O OG . SER C 3 44 ? 40.432 -62.154 -3.743 1.00 35.90 ? 44 SER C OG 1 +ATOM 3615 N N . GLU C 3 45 ? 43.541 -63.818 -4.339 1.00 56.54 ? 45 GLU C N 1 +ATOM 3616 C CA . GLU C 3 45 ? 43.761 -65.253 -4.340 1.00 57.07 ? 45 GLU C CA 1 +ATOM 3617 C C . GLU C 3 45 ? 43.375 -65.826 -2.981 1.00 68.20 ? 45 GLU C C 1 +ATOM 3618 O O . GLU C 3 45 ? 43.696 -65.246 -1.944 1.00 83.56 ? 45 GLU C O 1 +ATOM 3619 C CB . GLU C 3 45 ? 45.229 -65.568 -4.625 1.00 56.30 ? 45 GLU C CB 1 +ATOM 3620 C CG . GLU C 3 45 ? 45.532 -65.769 -6.096 1.00 68.26 ? 45 GLU C CG 1 +ATOM 3621 C CD . GLU C 3 45 ? 47.012 -65.883 -6.416 1.00 88.67 ? 45 GLU C CD 1 +ATOM 3622 O OE1 . GLU C 3 45 ? 47.396 -65.532 -7.550 1.00 96.85 ? 45 GLU C OE1 1 +ATOM 3623 O OE2 . GLU C 3 45 ? 47.781 -66.331 -5.539 1.00 95.13 ? 45 GLU C OE2 1 +ATOM 3624 N N . ALA C 3 46 ? 42.695 -66.979 -3.013 1.00 73.79 ? 46 ALA C N 1 +ATOM 3625 C CA . ALA C 3 46 ? 42.462 -67.786 -1.825 1.00 61.77 ? 46 ALA C CA 1 +ATOM 3626 C C . ALA C 3 46 ? 43.801 -68.304 -1.308 1.00 53.17 ? 46 ALA C C 1 +ATOM 3627 O O . ALA C 3 46 ? 44.730 -68.498 -2.084 1.00 51.46 ? 46 ALA C O 1 +ATOM 3628 C CB . ALA C 3 46 ? 41.504 -68.913 -2.133 1.00 51.63 ? 46 ALA C CB 1 +ATOM 3629 N N . HIS C 3 47 ? 43.892 -68.499 0.010 1.00 58.70 ? 47 HIS C N 1 +ATOM 3630 C CA . HIS C 3 47 ? 45.087 -69.024 0.648 1.00 49.75 ? 47 HIS C CA 1 +ATOM 3631 C C . HIS C 3 47 ? 44.703 -70.145 1.605 1.00 58.50 ? 47 HIS C C 1 +ATOM 3632 O O . HIS C 3 47 ? 43.524 -70.342 1.895 1.00 70.04 ? 47 HIS C O 1 +ATOM 3633 C CB . HIS C 3 47 ? 45.818 -67.904 1.382 1.00 61.52 ? 47 HIS C CB 1 +ATOM 3634 C CG . HIS C 3 47 ? 46.537 -66.967 0.474 1.00 76.65 ? 47 HIS C CG 1 +ATOM 3635 N ND1 . HIS C 3 47 ? 45.891 -65.916 -0.158 1.00 66.29 ? 47 HIS C ND1 1 +ATOM 3636 C CD2 . HIS C 3 47 ? 47.836 -66.906 0.106 1.00 60.41 ? 47 HIS C CD2 1 +ATOM 3637 C CE1 . HIS C 3 47 ? 46.764 -65.242 -0.878 1.00 52.16 ? 47 HIS C CE1 1 +ATOM 3638 N NE2 . HIS C 3 47 ? 47.964 -65.831 -0.732 1.00 54.14 ? 47 HIS C NE2 1 +ATOM 3639 N N . THR C 3 48 ? 45.724 -70.833 2.123 1.00 63.31 ? 48 THR C N 1 +ATOM 3640 C CA . THR C 3 48 ? 45.557 -72.119 2.779 1.00 67.99 ? 48 THR C CA 1 +ATOM 3641 C C . THR C 3 48 ? 46.087 -72.024 4.208 1.00 66.93 ? 48 THR C C 1 +ATOM 3642 O O . THR C 3 48 ? 47.190 -71.527 4.424 1.00 72.34 ? 48 THR C O 1 +ATOM 3643 C CB . THR C 3 48 ? 46.264 -73.195 1.946 1.00 61.53 ? 48 THR C CB 1 +ATOM 3644 O OG1 . THR C 3 48 ? 46.000 -72.913 0.569 1.00 80.66 ? 48 THR C OG1 1 +ATOM 3645 C CG2 . THR C 3 48 ? 45.843 -74.607 2.283 1.00 46.47 ? 48 THR C CG2 1 +ATOM 3646 N N . CYS C 3 49 ? 45.284 -72.496 5.173 1.00 63.05 ? 49 CYS C N 1 +ATOM 3647 C CA . CYS C 3 49 ? 45.711 -72.559 6.562 1.00 72.96 ? 49 CYS C CA 1 +ATOM 3648 C C . CYS C 3 49 ? 45.523 -73.964 7.130 1.00 76.55 ? 49 CYS C C 1 +ATOM 3649 O O . CYS C 3 49 ? 44.405 -74.468 7.233 1.00 94.26 ? 49 CYS C O 1 +ATOM 3650 C CB . CYS C 3 49 ? 44.991 -71.531 7.426 1.00 74.79 ? 49 CYS C CB 1 +ATOM 3651 S SG . CYS C 3 49 ? 45.747 -71.343 9.063 1.00 81.11 ? 49 CYS C SG 1 +ATOM 3652 N N . ILE C 3 50 ? 46.652 -74.570 7.507 1.00 65.40 ? 50 ILE C N 1 +ATOM 3653 C CA . ILE C 3 50 ? 46.712 -75.891 8.108 1.00 66.93 ? 50 ILE C CA 1 +ATOM 3654 C C . ILE C 3 50 ? 46.553 -75.735 9.623 1.00 65.18 ? 50 ILE C C 1 +ATOM 3655 O O . ILE C 3 50 ? 47.432 -75.174 10.277 1.00 69.74 ? 50 ILE C O 1 +ATOM 3656 C CB . ILE C 3 50 ? 48.000 -76.632 7.657 1.00 66.07 ? 50 ILE C CB 1 +ATOM 3657 C CG1 . ILE C 3 50 ? 48.275 -77.908 8.459 1.00 72.73 ? 50 ILE C CG1 1 +ATOM 3658 C CG2 . ILE C 3 50 ? 49.215 -75.708 7.611 1.00 65.44 ? 50 ILE C CG2 1 +ATOM 3659 C CD1 . ILE C 3 50 ? 49.284 -78.845 7.820 1.00 89.26 ? 50 ILE C CD1 1 +ATOM 3660 N N . PRO C 3 51 ? 45.422 -76.197 10.222 1.00 68.42 ? 51 PRO C N 1 +ATOM 3661 C CA . PRO C 3 51 ? 45.096 -75.926 11.632 1.00 57.78 ? 51 PRO C CA 1 +ATOM 3662 C C . PRO C 3 51 ? 45.919 -76.668 12.685 1.00 64.55 ? 51 PRO C C 1 +ATOM 3663 O O . PRO C 3 51 ? 46.889 -77.348 12.356 1.00 78.18 ? 51 PRO C O 1 +ATOM 3664 C CB . PRO C 3 51 ? 43.614 -76.320 11.768 1.00 54.45 ? 51 PRO C CB 1 +ATOM 3665 C CG . PRO C 3 51 ? 43.136 -76.574 10.346 1.00 63.60 ? 51 PRO C CG 1 +ATOM 3666 C CD . PRO C 3 51 ? 44.364 -76.973 9.555 1.00 61.84 ? 51 PRO C CD 1 +ATOM 3667 N N . GLU C 3 52 ? 45.528 -76.505 13.958 1.00 71.62 ? 52 GLU C N 1 +ATOM 3668 C CA . GLU C 3 52 ? 46.155 -77.182 15.088 1.00 72.39 ? 52 GLU C CA 1 +ATOM 3669 C C . GLU C 3 52 ? 45.092 -77.533 16.134 1.00 66.56 ? 52 GLU C C 1 +ATOM 3670 O O . GLU C 3 52 ? 43.939 -77.133 16.005 1.00 74.18 ? 52 GLU C O 1 +ATOM 3671 C CB . GLU C 3 52 ? 47.311 -76.334 15.624 1.00 56.79 ? 52 GLU C CB 1 +ATOM 3672 N N . ASN C 3 53 ? 45.480 -78.282 17.173 1.00 64.75 ? 53 ASN C N 1 +ATOM 3673 C CA . ASN C 3 53 ? 44.520 -78.893 18.084 1.00 75.27 ? 53 ASN C CA 1 +ATOM 3674 C C . ASN C 3 53 ? 44.339 -78.078 19.363 1.00 67.03 ? 53 ASN C C 1 +ATOM 3675 O O . ASN C 3 53 ? 45.312 -77.704 20.022 1.00 56.14 ? 53 ASN C O 1 +ATOM 3676 C CB . ASN C 3 53 ? 44.857 -80.353 18.401 1.00 71.87 ? 53 ASN C CB 1 +ATOM 3677 C CG . ASN C 3 53 ? 44.278 -81.307 17.381 1.00 89.55 ? 53 ASN C CG 1 +ATOM 3678 O OD1 . ASN C 3 53 ? 44.860 -81.514 16.316 1.00 114.61 ? 53 ASN C OD1 1 +ATOM 3679 N ND2 . ASN C 3 53 ? 43.125 -81.875 17.693 1.00 81.65 ? 53 ASN C ND2 1 +ATOM 3680 N N . ASN C 3 54 ? 43.063 -77.846 19.702 1.00 46.16 ? 54 ASN C N 1 +ATOM 3681 C CA . ASN C 3 54 ? 42.650 -77.278 20.973 1.00 65.29 ? 54 ASN C CA 1 +ATOM 3682 C C . ASN C 3 54 ? 41.834 -78.335 21.709 1.00 72.04 ? 54 ASN C C 1 +ATOM 3683 O O . ASN C 3 54 ? 40.604 -78.305 21.693 1.00 83.69 ? 54 ASN C O 1 +ATOM 3684 C CB . ASN C 3 54 ? 41.905 -75.951 20.786 1.00 89.26 ? 54 ASN C CB 1 +ATOM 3685 C CG . ASN C 3 54 ? 41.949 -75.036 21.996 1.00 96.04 ? 54 ASN C CG 1 +ATOM 3686 O OD1 . ASN C 3 54 ? 42.785 -75.188 22.887 1.00 82.52 ? 54 ASN C OD1 1 +ATOM 3687 N ND2 . ASN C 3 54 ? 41.055 -74.064 22.028 1.00 100.89 ? 54 ASN C ND2 1 +ATOM 3688 N N . GLY C 3 55 ? 42.549 -79.275 22.339 1.00 83.02 ? 55 GLY C N 1 +ATOM 3689 C CA . GLY C 3 55 ? 41.959 -80.510 22.826 1.00 86.06 ? 55 GLY C CA 1 +ATOM 3690 C C . GLY C 3 55 ? 41.645 -81.459 21.672 1.00 90.76 ? 55 GLY C C 1 +ATOM 3691 O O . GLY C 3 55 ? 42.143 -81.271 20.561 1.00 114.49 ? 55 GLY C O 1 +ATOM 3692 N N . GLY C 3 56 ? 40.804 -82.462 21.953 1.00 74.91 ? 56 GLY C N 1 +ATOM 3693 C CA . GLY C 3 56 ? 40.444 -83.495 20.993 1.00 61.45 ? 56 GLY C CA 1 +ATOM 3694 C C . GLY C 3 56 ? 39.593 -82.961 19.841 1.00 72.00 ? 56 GLY C C 1 +ATOM 3695 O O . GLY C 3 56 ? 39.983 -83.081 18.680 1.00 88.68 ? 56 GLY C O 1 +ATOM 3696 N N . ALA C 3 57 ? 38.450 -82.351 20.186 1.00 66.10 ? 57 ALA C N 1 +ATOM 3697 C CA . ALA C 3 57 ? 37.402 -82.007 19.235 1.00 64.53 ? 57 ALA C CA 1 +ATOM 3698 C C . ALA C 3 57 ? 37.575 -80.598 18.656 1.00 72.72 ? 57 ALA C C 1 +ATOM 3699 O O . ALA C 3 57 ? 36.806 -80.201 17.778 1.00 78.89 ? 57 ALA C O 1 +ATOM 3700 C CB . ALA C 3 57 ? 36.055 -82.176 19.901 1.00 60.95 ? 57 ALA C CB 1 +ATOM 3701 N N . GLY C 3 58 ? 38.593 -79.856 19.122 1.00 67.93 ? 58 GLY C N 1 +ATOM 3702 C CA . GLY C 3 58 ? 38.697 -78.424 18.859 1.00 71.73 ? 58 GLY C CA 1 +ATOM 3703 C C . GLY C 3 58 ? 39.916 -78.032 18.025 1.00 50.53 ? 58 GLY C C 1 +ATOM 3704 O O . GLY C 3 58 ? 41.009 -78.556 18.234 1.00 55.75 ? 58 GLY C O 1 +ATOM 3705 N N . CYS C 3 59 ? 39.709 -77.085 17.098 1.00 50.96 ? 59 CYS C N 1 +ATOM 3706 C CA . CYS C 3 59 ? 40.745 -76.620 16.181 1.00 70.37 ? 59 CYS C CA 1 +ATOM 3707 C C . CYS C 3 59 ? 40.858 -75.095 16.211 1.00 75.17 ? 59 CYS C C 1 +ATOM 3708 O O . CYS C 3 59 ? 39.928 -74.399 16.614 1.00 82.03 ? 59 CYS C O 1 +ATOM 3709 C CB . CYS C 3 59 ? 40.499 -77.064 14.740 1.00 75.88 ? 59 CYS C CB 1 +ATOM 3710 S SG . CYS C 3 59 ? 40.232 -78.843 14.501 1.00 81.67 ? 59 CYS C SG 1 +ATOM 3711 N N . VAL C 3 60 ? 42.018 -74.608 15.749 1.00 88.58 ? 60 VAL C N 1 +ATOM 3712 C CA . VAL C 3 60 ? 42.476 -73.229 15.853 1.00 93.67 ? 60 VAL C CA 1 +ATOM 3713 C C . VAL C 3 60 ? 43.345 -72.937 14.626 1.00 86.47 ? 60 VAL C C 1 +ATOM 3714 O O . VAL C 3 60 ? 44.133 -73.788 14.210 1.00 88.60 ? 60 VAL C O 1 +ATOM 3715 C CB . VAL C 3 60 ? 43.245 -73.011 17.178 1.00 86.47 ? 60 VAL C CB 1 +ATOM 3716 C CG1 . VAL C 3 60 ? 44.066 -71.727 17.207 1.00 103.43 ? 60 VAL C CG1 1 +ATOM 3717 C CG2 . VAL C 3 60 ? 42.337 -73.078 18.397 1.00 91.53 ? 60 VAL C CG2 1 +ATOM 3718 N N . CYS C 3 61 ? 43.192 -71.729 14.060 1.00 78.43 ? 61 CYS C N 1 +ATOM 3719 C CA . CYS C 3 61 ? 43.901 -71.295 12.863 1.00 83.77 ? 61 CYS C CA 1 +ATOM 3720 C C . CYS C 3 61 ? 44.425 -69.871 13.038 1.00 77.74 ? 61 CYS C C 1 +ATOM 3721 O O . CYS C 3 61 ? 43.674 -68.962 13.390 1.00 79.31 ? 61 CYS C O 1 +ATOM 3722 C CB . CYS C 3 61 ? 42.980 -71.312 11.648 1.00 88.22 ? 61 CYS C CB 1 +ATOM 3723 S SG . CYS C 3 61 ? 43.228 -72.733 10.552 1.00 83.17 ? 61 CYS C SG 1 +ATOM 3724 N N . HIS C 3 62 ? 45.718 -69.686 12.753 1.00 69.04 ? 62 HIS C N 1 +ATOM 3725 C CA . HIS C 3 62 ? 46.312 -68.361 12.763 1.00 74.18 ? 62 HIS C CA 1 +ATOM 3726 C C . HIS C 3 62 ? 46.418 -67.855 11.327 1.00 66.33 ? 62 HIS C C 1 +ATOM 3727 O O . HIS C 3 62 ? 47.437 -68.067 10.672 1.00 78.29 ? 62 HIS C O 1 +ATOM 3728 C CB . HIS C 3 62 ? 47.666 -68.362 13.492 1.00 88.95 ? 62 HIS C CB 1 +ATOM 3729 C CG . HIS C 3 62 ? 47.700 -69.149 14.760 1.00 85.59 ? 62 HIS C CG 1 +ATOM 3730 N ND1 . HIS C 3 62 ? 47.306 -68.616 15.970 1.00 83.05 ? 62 HIS C ND1 1 +ATOM 3731 C CD2 . HIS C 3 62 ? 48.097 -70.416 15.011 1.00 86.18 ? 62 HIS C CD2 1 +ATOM 3732 C CE1 . HIS C 3 62 ? 47.450 -69.523 16.914 1.00 96.60 ? 62 HIS C CE1 1 +ATOM 3733 N NE2 . HIS C 3 62 ? 47.936 -70.636 16.351 1.00 101.68 ? 62 HIS C NE2 1 +ATOM 3734 N N . LEU C 3 63 ? 45.355 -67.190 10.852 1.00 55.23 ? 63 LEU C N 1 +ATOM 3735 C CA . LEU C 3 63 ? 45.329 -66.616 9.514 1.00 60.08 ? 63 LEU C CA 1 +ATOM 3736 C C . LEU C 3 63 ? 46.190 -65.355 9.476 1.00 67.34 ? 63 LEU C C 1 +ATOM 3737 O O . LEU C 3 63 ? 46.079 -64.493 10.347 1.00 73.58 ? 63 LEU C O 1 +ATOM 3738 C CB . LEU C 3 63 ? 43.896 -66.270 9.086 1.00 60.21 ? 63 LEU C CB 1 +ATOM 3739 C CG . LEU C 3 63 ? 42.777 -67.265 9.396 1.00 58.11 ? 63 LEU C CG 1 +ATOM 3740 C CD1 . LEU C 3 63 ? 41.464 -66.767 8.813 1.00 62.25 ? 63 LEU C CD1 1 +ATOM 3741 C CD2 . LEU C 3 63 ? 43.087 -68.657 8.865 1.00 81.83 ? 63 LEU C CD2 1 +ATOM 3742 N N . LEU C 3 64 ? 47.027 -65.260 8.436 1.00 66.20 ? 64 LEU C N 1 +ATOM 3743 C CA . LEU C 3 64 ? 47.863 -64.097 8.197 1.00 63.37 ? 64 LEU C CA 1 +ATOM 3744 C C . LEU C 3 64 ? 47.018 -62.984 7.587 1.00 66.56 ? 64 LEU C C 1 +ATOM 3745 O O . LEU C 3 64 ? 46.322 -63.187 6.593 1.00 72.28 ? 64 LEU C O 1 +ATOM 3746 C CB . LEU C 3 64 ? 49.014 -64.476 7.262 1.00 67.68 ? 64 LEU C CB 1 +ATOM 3747 C CG . LEU C 3 64 ? 49.785 -63.300 6.662 1.00 59.55 ? 64 LEU C CG 1 +ATOM 3748 C CD1 . LEU C 3 64 ? 50.986 -62.944 7.524 1.00 72.15 ? 64 LEU C CD1 1 +ATOM 3749 C CD2 . LEU C 3 64 ? 50.212 -63.596 5.233 1.00 46.95 ? 64 LEU C CD2 1 +ATOM 3750 N N . MET C 3 65 ? 47.129 -61.801 8.197 1.00 79.82 ? 65 MET C N 1 +ATOM 3751 C CA . MET C 3 65 ? 46.449 -60.602 7.748 1.00 66.03 ? 65 MET C CA 1 +ATOM 3752 C C . MET C 3 65 ? 47.494 -59.636 7.199 1.00 68.75 ? 65 MET C C 1 +ATOM 3753 O O . MET C 3 65 ? 48.539 -59.440 7.820 1.00 87.75 ? 65 MET C O 1 +ATOM 3754 C CB . MET C 3 65 ? 45.697 -59.949 8.912 1.00 59.13 ? 65 MET C CB 1 +ATOM 3755 C CG . MET C 3 65 ? 44.688 -60.867 9.577 1.00 66.51 ? 65 MET C CG 1 +ATOM 3756 S SD . MET C 3 65 ? 43.289 -61.277 8.493 1.00 76.88 ? 65 MET C SD 1 +ATOM 3757 C CE . MET C 3 65 ? 42.576 -59.649 8.275 1.00 81.44 ? 65 MET C CE 1 +ATOM 3758 N N . ASP C 3 66 ? 47.186 -59.056 6.027 1.00 66.88 ? 66 ASP C N 1 +ATOM 3759 C CA . ASP C 3 66 ? 47.992 -58.046 5.354 1.00 73.14 ? 66 ASP C CA 1 +ATOM 3760 C C . ASP C 3 66 ? 47.607 -56.669 5.892 1.00 77.66 ? 66 ASP C C 1 +ATOM 3761 O O . ASP C 3 66 ? 47.435 -55.723 5.121 1.00 74.93 ? 66 ASP C O 1 +ATOM 3762 C CB . ASP C 3 66 ? 47.749 -58.091 3.842 1.00 70.96 ? 66 ASP C CB 1 +ATOM 3763 C CG . ASP C 3 66 ? 48.893 -58.617 2.992 1.00 62.24 ? 66 ASP C CG 1 +ATOM 3764 O OD1 . ASP C 3 66 ? 49.225 -59.813 3.114 1.00 62.79 ? 66 ASP C OD1 1 +ATOM 3765 O OD2 . ASP C 3 66 ? 49.418 -57.827 2.181 1.00 69.91 ? 66 ASP C OD2 1 +ATOM 3766 N N . ASP C 3 67 ? 47.483 -56.580 7.225 1.00 81.58 ? 67 ASP C N 1 +ATOM 3767 C CA . ASP C 3 67 ? 46.867 -55.466 7.934 1.00 73.60 ? 67 ASP C CA 1 +ATOM 3768 C C . ASP C 3 67 ? 45.345 -55.578 7.783 1.00 69.38 ? 67 ASP C C 1 +ATOM 3769 O O . ASP C 3 67 ? 44.869 -56.364 6.963 1.00 63.06 ? 67 ASP C O 1 +ATOM 3770 C CB . ASP C 3 67 ? 47.594 -54.155 7.607 1.00 76.13 ? 67 ASP C CB 1 +ATOM 3771 C CG . ASP C 3 67 ? 46.903 -52.880 8.053 1.00 98.65 ? 67 ASP C CG 1 +ATOM 3772 O OD1 . ASP C 3 67 ? 46.646 -52.741 9.275 1.00 108.72 ? 67 ASP C OD1 1 +ATOM 3773 O OD2 . ASP C 3 67 ? 46.642 -52.027 7.170 1.00 62.11 ? 67 ASP C OD2 1 +ATOM 3774 N N . VAL C 3 68 ? 44.587 -54.863 8.634 1.00 55.28 ? 68 VAL C N 1 +ATOM 3775 C CA . VAL C 3 68 ? 43.131 -54.858 8.546 1.00 51.99 ? 68 VAL C CA 1 +ATOM 3776 C C . VAL C 3 68 ? 42.581 -53.436 8.591 1.00 58.16 ? 68 VAL C C 1 +ATOM 3777 O O . VAL C 3 68 ? 42.940 -52.643 9.461 1.00 82.78 ? 68 VAL C O 1 +ATOM 3778 C CB . VAL C 3 68 ? 42.410 -55.815 9.525 1.00 49.77 ? 68 VAL C CB 1 +ATOM 3779 C CG1 . VAL C 3 68 ? 43.333 -56.694 10.348 1.00 72.23 ? 68 VAL C CG1 1 +ATOM 3780 C CG2 . VAL C 3 68 ? 41.332 -55.157 10.378 1.00 43.25 ? 68 VAL C CG2 1 +ATOM 3781 N N . VAL C 3 69 ? 41.707 -53.147 7.620 1.00 50.30 ? 69 VAL C N 1 +ATOM 3782 C CA . VAL C 3 69 ? 40.837 -51.982 7.671 1.00 65.86 ? 69 VAL C CA 1 +ATOM 3783 C C . VAL C 3 69 ? 39.386 -52.453 7.819 1.00 66.34 ? 69 VAL C C 1 +ATOM 3784 O O . VAL C 3 69 ? 39.053 -53.608 7.519 1.00 42.97 ? 69 VAL C O 1 +ATOM 3785 C CB . VAL C 3 69 ? 41.059 -50.993 6.501 1.00 48.26 ? 69 VAL C CB 1 +ATOM 3786 C CG1 . VAL C 3 69 ? 42.516 -50.906 6.070 1.00 46.04 ? 69 VAL C CG1 1 +ATOM 3787 C CG2 . VAL C 3 69 ? 40.157 -51.242 5.303 1.00 41.54 ? 69 VAL C CG2 1 +ATOM 3788 N N . SER C 3 70 ? 38.541 -51.522 8.286 1.00 49.24 ? 70 SER C N 1 +ATOM 3789 C CA . SER C 3 70 ? 37.140 -51.734 8.618 1.00 53.23 ? 70 SER C CA 1 +ATOM 3790 C C . SER C 3 70 ? 36.383 -52.456 7.500 1.00 61.26 ? 70 SER C C 1 +ATOM 3791 O O . SER C 3 70 ? 35.510 -53.270 7.782 1.00 56.51 ? 70 SER C O 1 +ATOM 3792 C CB . SER C 3 70 ? 36.499 -50.417 8.965 1.00 53.34 ? 70 SER C CB 1 +ATOM 3793 O OG . SER C 3 70 ? 35.088 -50.527 8.979 1.00 74.53 ? 70 SER C OG 1 +ATOM 3794 N N . ALA C 3 71 ? 36.737 -52.162 6.241 1.00 65.41 ? 71 ALA C N 1 +ATOM 3795 C CA . ALA C 3 71 ? 35.983 -52.591 5.072 1.00 53.60 ? 71 ALA C CA 1 +ATOM 3796 C C . ALA C 3 71 ? 36.192 -54.078 4.774 1.00 56.71 ? 71 ALA C C 1 +ATOM 3797 O O . ALA C 3 71 ? 35.399 -54.663 4.040 1.00 63.27 ? 71 ALA C O 1 +ATOM 3798 C CB . ALA C 3 71 ? 36.359 -51.730 3.892 1.00 39.89 ? 71 ALA C CB 1 +ATOM 3799 N N . ASP C 3 72 ? 37.242 -54.682 5.353 1.00 47.00 ? 72 ASP C N 1 +ATOM 3800 C CA . ASP C 3 72 ? 37.683 -56.030 5.012 1.00 52.30 ? 72 ASP C CA 1 +ATOM 3801 C C . ASP C 3 72 ? 36.641 -57.063 5.424 1.00 50.62 ? 72 ASP C C 1 +ATOM 3802 O O . ASP C 3 72 ? 35.993 -56.928 6.455 1.00 69.99 ? 72 ASP C O 1 +ATOM 3803 C CB . ASP C 3 72 ? 39.028 -56.386 5.659 1.00 66.99 ? 72 ASP C CB 1 +ATOM 3804 C CG . ASP C 3 72 ? 40.255 -55.694 5.073 1.00 77.67 ? 72 ASP C CG 1 +ATOM 3805 O OD1 . ASP C 3 72 ? 40.155 -55.132 3.953 1.00 60.12 ? 72 ASP C OD1 1 +ATOM 3806 O OD2 . ASP C 3 72 ? 41.320 -55.736 5.741 1.00 64.19 ? 72 ASP C OD2 1 +ATOM 3807 N N . ASN C 3 73 ? 36.521 -58.100 4.596 1.00 64.88 ? 73 ASN C N 1 +ATOM 3808 C CA . ASN C 3 73 ? 35.606 -59.218 4.762 1.00 61.72 ? 73 ASN C CA 1 +ATOM 3809 C C . ASN C 3 73 ? 36.210 -60.383 3.982 1.00 74.67 ? 73 ASN C C 1 +ATOM 3810 O O . ASN C 3 73 ? 36.606 -60.211 2.824 1.00 57.21 ? 73 ASN C O 1 +ATOM 3811 C CB . ASN C 3 73 ? 34.184 -58.828 4.335 1.00 56.45 ? 73 ASN C CB 1 +ATOM 3812 C CG . ASN C 3 73 ? 33.194 -59.966 4.177 1.00 60.48 ? 73 ASN C CG 1 +ATOM 3813 O OD1 . ASN C 3 73 ? 33.339 -61.026 4.788 1.00 66.77 ? 73 ASN C OD1 1 +ATOM 3814 N ND2 . ASN C 3 73 ? 32.178 -59.738 3.353 1.00 70.91 ? 73 ASN C ND2 1 +ATOM 3815 N N . TYR C 3 74 ? 36.308 -61.538 4.655 1.00 67.41 ? 74 TYR C N 1 +ATOM 3816 C CA . TYR C 3 74 ? 37.015 -62.710 4.158 1.00 67.91 ? 74 TYR C CA 1 +ATOM 3817 C C . TYR C 3 74 ? 36.028 -63.855 3.974 1.00 64.22 ? 74 TYR C C 1 +ATOM 3818 O O . TYR C 3 74 ? 35.133 -64.007 4.800 1.00 62.25 ? 74 TYR C O 1 +ATOM 3819 C CB . TYR C 3 74 ? 38.089 -63.143 5.161 1.00 52.64 ? 74 TYR C CB 1 +ATOM 3820 C CG . TYR C 3 74 ? 39.369 -62.344 5.104 1.00 67.62 ? 74 TYR C CG 1 +ATOM 3821 C CD1 . TYR C 3 74 ? 39.483 -61.126 5.762 1.00 72.55 ? 74 TYR C CD1 1 +ATOM 3822 C CD2 . TYR C 3 74 ? 40.472 -62.801 4.391 1.00 57.53 ? 74 TYR C CD2 1 +ATOM 3823 C CE1 . TYR C 3 74 ? 40.655 -60.386 5.711 1.00 64.01 ? 74 TYR C CE1 1 +ATOM 3824 C CE2 . TYR C 3 74 ? 41.655 -62.075 4.338 1.00 56.20 ? 74 TYR C CE2 1 +ATOM 3825 C CZ . TYR C 3 74 ? 41.747 -60.861 5.002 1.00 65.41 ? 74 TYR C CZ 1 +ATOM 3826 O OH . TYR C 3 74 ? 42.900 -60.129 4.957 1.00 87.27 ? 74 TYR C OH 1 +ATOM 3827 N N . THR C 3 75 ? 36.204 -64.646 2.901 1.00 57.24 ? 75 THR C N 1 +ATOM 3828 C CA . THR C 3 75 ? 35.411 -65.853 2.698 1.00 52.60 ? 75 THR C CA 1 +ATOM 3829 C C . THR C 3 75 ? 36.179 -67.069 3.206 1.00 57.06 ? 75 THR C C 1 +ATOM 3830 O O . THR C 3 75 ? 37.252 -67.373 2.691 1.00 69.84 ? 75 THR C O 1 +ATOM 3831 C CB . THR C 3 75 ? 34.968 -66.070 1.246 1.00 51.36 ? 75 THR C CB 1 +ATOM 3832 O OG1 . THR C 3 75 ? 34.418 -64.860 0.731 1.00 74.93 ? 75 THR C OG1 1 +ATOM 3833 C CG2 . THR C 3 75 ? 33.920 -67.153 1.118 1.00 63.02 ? 75 THR C CG2 1 +ATOM 3834 N N . LEU C 3 76 ? 35.581 -67.751 4.196 1.00 62.64 ? 76 LEU C N 1 +ATOM 3835 C CA . LEU C 3 76 ? 36.125 -68.929 4.855 1.00 80.36 ? 76 LEU C CA 1 +ATOM 3836 C C . LEU C 3 76 ? 35.465 -70.183 4.287 1.00 92.51 ? 76 LEU C C 1 +ATOM 3837 O O . LEU C 3 76 ? 34.240 -70.240 4.164 1.00 96.66 ? 76 LEU C O 1 +ATOM 3838 C CB . LEU C 3 76 ? 35.831 -68.840 6.355 1.00 73.12 ? 76 LEU C CB 1 +ATOM 3839 C CG . LEU C 3 76 ? 36.516 -67.713 7.121 1.00 67.90 ? 76 LEU C CG 1 +ATOM 3840 C CD1 . LEU C 3 76 ? 35.734 -67.396 8.383 1.00 59.27 ? 76 LEU C CD1 1 +ATOM 3841 C CD2 . LEU C 3 76 ? 37.952 -68.082 7.467 1.00 71.32 ? 76 LEU C CD2 1 +ATOM 3842 N N . ASP C 3 77 ? 36.298 -71.185 3.969 1.00 69.66 ? 77 ASP C N 1 +ATOM 3843 C CA . ASP C 3 77 ? 35.834 -72.474 3.480 1.00 58.66 ? 77 ASP C CA 1 +ATOM 3844 C C . ASP C 3 77 ? 36.639 -73.573 4.159 1.00 56.96 ? 77 ASP C C 1 +ATOM 3845 O O . ASP C 3 77 ? 37.868 -73.572 4.089 1.00 54.05 ? 77 ASP C O 1 +ATOM 3846 C CB . ASP C 3 77 ? 35.951 -72.569 1.958 1.00 69.74 ? 77 ASP C CB 1 +ATOM 3847 C CG . ASP C 3 77 ? 35.128 -71.523 1.233 1.00 62.55 ? 77 ASP C CG 1 +ATOM 3848 O OD1 . ASP C 3 77 ? 35.661 -70.415 1.020 1.00 67.13 ? 77 ASP C OD1 1 +ATOM 3849 O OD2 . ASP C 3 77 ? 33.954 -71.813 0.927 1.00 52.04 ? 77 ASP C OD2 1 +ATOM 3850 N N . LEU C 3 78 ? 35.928 -74.488 4.825 1.00 60.24 ? 78 LEU C N 1 +ATOM 3851 C CA . LEU C 3 78 ? 36.555 -75.591 5.535 1.00 62.50 ? 78 LEU C CA 1 +ATOM 3852 C C . LEU C 3 78 ? 36.385 -76.886 4.737 1.00 75.32 ? 78 LEU C C 1 +ATOM 3853 O O . LEU C 3 78 ? 35.270 -77.289 4.397 1.00 66.80 ? 78 LEU C O 1 +ATOM 3854 C CB . LEU C 3 78 ? 35.955 -75.681 6.943 1.00 54.86 ? 78 LEU C CB 1 +ATOM 3855 C CG . LEU C 3 78 ? 36.569 -76.719 7.888 1.00 71.01 ? 78 LEU C CG 1 +ATOM 3856 C CD1 . LEU C 3 78 ? 38.035 -76.420 8.180 1.00 69.14 ? 78 LEU C CD1 1 +ATOM 3857 C CD2 . LEU C 3 78 ? 35.777 -76.803 9.186 1.00 56.41 ? 78 LEU C CD2 1 +ATOM 3858 N N . TRP C 3 79 ? 37.524 -77.516 4.428 1.00 76.59 ? 79 TRP C N 1 +ATOM 3859 C CA . TRP C 3 79 ? 37.571 -78.764 3.684 1.00 79.20 ? 79 TRP C CA 1 +ATOM 3860 C C . TRP C 3 79 ? 38.130 -79.879 4.565 1.00 81.63 ? 79 TRP C C 1 +ATOM 3861 O O . TRP C 3 79 ? 38.982 -79.643 5.422 1.00 62.70 ? 79 TRP C O 1 +ATOM 3862 C CB . TRP C 3 79 ? 38.402 -78.609 2.405 1.00 60.97 ? 79 TRP C CB 1 +ATOM 3863 C CG . TRP C 3 79 ? 37.877 -77.591 1.441 1.00 65.99 ? 79 TRP C CG 1 +ATOM 3864 C CD1 . TRP C 3 79 ? 38.159 -76.256 1.424 1.00 67.16 ? 79 TRP C CD1 1 +ATOM 3865 C CD2 . TRP C 3 79 ? 36.980 -77.821 0.340 1.00 79.17 ? 79 TRP C CD2 1 +ATOM 3866 N NE1 . TRP C 3 79 ? 37.499 -75.637 0.395 1.00 49.90 ? 79 TRP C NE1 1 +ATOM 3867 C CE2 . TRP C 3 79 ? 36.768 -76.571 -0.290 1.00 75.03 ? 79 TRP C CE2 1 +ATOM 3868 C CE3 . TRP C 3 79 ? 36.332 -78.952 -0.176 1.00 67.23 ? 79 TRP C CE3 1 +ATOM 3869 C CZ2 . TRP C 3 79 ? 35.939 -76.426 -1.406 1.00 85.23 ? 79 TRP C CZ2 1 +ATOM 3870 C CZ3 . TRP C 3 79 ? 35.509 -78.805 -1.273 1.00 76.31 ? 79 TRP C CZ3 1 +ATOM 3871 C CH2 . TRP C 3 79 ? 35.318 -77.561 -1.881 1.00 80.54 ? 79 TRP C CH2 1 +ATOM 3872 N N . ALA C 3 80 ? 37.614 -81.092 4.341 1.00 77.25 ? 80 ALA C N 1 +ATOM 3873 C CA . ALA C 3 80 ? 38.257 -82.314 4.789 1.00 82.33 ? 80 ALA C CA 1 +ATOM 3874 C C . ALA C 3 80 ? 38.575 -83.162 3.559 1.00 87.46 ? 80 ALA C C 1 +ATOM 3875 O O . ALA C 3 80 ? 37.684 -83.751 2.945 1.00 79.91 ? 80 ALA C O 1 +ATOM 3876 C CB . ALA C 3 80 ? 37.390 -83.031 5.798 1.00 80.04 ? 80 ALA C CB 1 +ATOM 3877 N N . GLY C 3 81 ? 39.863 -83.169 3.191 1.00 93.30 ? 81 GLY C N 1 +ATOM 3878 C CA . GLY C 3 81 ? 40.339 -83.795 1.971 1.00 66.86 ? 81 GLY C CA 1 +ATOM 3879 C C . GLY C 3 81 ? 39.872 -83.006 0.755 1.00 87.23 ? 81 GLY C C 1 +ATOM 3880 O O . GLY C 3 81 ? 40.560 -82.091 0.308 1.00 128.20 ? 81 GLY C O 1 +ATOM 3881 N N . GLN C 3 82 ? 38.690 -83.374 0.248 1.00 84.62 ? 82 GLN C N 1 +ATOM 3882 C CA . GLN C 3 82 ? 38.051 -82.697 -0.871 1.00 93.83 ? 82 GLN C CA 1 +ATOM 3883 C C . GLN C 3 82 ? 36.566 -82.498 -0.570 1.00 89.65 ? 82 GLN C C 1 +ATOM 3884 O O . GLN C 3 82 ? 35.803 -82.066 -1.433 1.00 76.14 ? 82 GLN C O 1 +ATOM 3885 C CB . GLN C 3 82 ? 38.281 -83.463 -2.177 1.00 85.90 ? 82 GLN C CB 1 +ATOM 3886 C CG . GLN C 3 82 ? 39.640 -83.193 -2.807 1.00 100.02 ? 82 GLN C CG 1 +ATOM 3887 C CD . GLN C 3 82 ? 39.743 -83.722 -4.216 1.00 127.45 ? 82 GLN C CD 1 +ATOM 3888 O OE1 . GLN C 3 82 ? 39.894 -82.966 -5.173 1.00 123.97 ? 82 GLN C OE1 1 +ATOM 3889 N NE2 . GLN C 3 82 ? 39.659 -85.036 -4.355 1.00 141.99 ? 82 GLN C NE2 1 +ATOM 3890 N N . GLN C 3 83 ? 36.175 -82.818 0.667 1.00 80.53 ? 83 GLN C N 1 +ATOM 3891 C CA . GLN C 3 83 ? 34.811 -82.631 1.128 1.00 84.08 ? 83 GLN C CA 1 +ATOM 3892 C C . GLN C 3 83 ? 34.708 -81.260 1.791 1.00 97.24 ? 83 GLN C C 1 +ATOM 3893 O O . GLN C 3 83 ? 35.483 -80.938 2.695 1.00 80.19 ? 83 GLN C O 1 +ATOM 3894 C CB . GLN C 3 83 ? 34.427 -83.742 2.110 1.00 92.32 ? 83 GLN C CB 1 +ATOM 3895 C CG . GLN C 3 83 ? 34.298 -85.124 1.480 1.00 86.78 ? 83 GLN C CG 1 +ATOM 3896 C CD . GLN C 3 83 ? 32.916 -85.399 0.934 1.00 108.52 ? 83 GLN C CD 1 +ATOM 3897 O OE1 . GLN C 3 83 ? 32.078 -84.506 0.819 1.00 110.58 ? 83 GLN C OE1 1 +ATOM 3898 N NE2 . GLN C 3 83 ? 32.664 -86.653 0.590 1.00 112.68 ? 83 GLN C NE2 1 +ATOM 3899 N N . LEU C 3 84 ? 33.758 -80.448 1.316 1.00 86.55 ? 84 LEU C N 1 +ATOM 3900 C CA . LEU C 3 84 ? 33.439 -79.202 1.992 1.00 73.86 ? 84 LEU C CA 1 +ATOM 3901 C C . LEU C 3 84 ? 32.640 -79.543 3.244 1.00 75.79 ? 84 LEU C C 1 +ATOM 3902 O O . LEU C 3 84 ? 31.627 -80.233 3.155 1.00 92.25 ? 84 LEU C O 1 +ATOM 3903 C CB . LEU C 3 84 ? 32.633 -78.297 1.052 1.00 66.77 ? 84 LEU C CB 1 +ATOM 3904 C CG . LEU C 3 84 ? 32.190 -76.963 1.655 1.00 71.89 ? 84 LEU C CG 1 +ATOM 3905 C CD1 . LEU C 3 84 ? 33.280 -75.911 1.513 1.00 62.70 ? 84 LEU C CD1 1 +ATOM 3906 C CD2 . LEU C 3 84 ? 30.885 -76.476 1.039 1.00 61.72 ? 84 LEU C CD2 1 +ATOM 3907 N N . LEU C 3 85 ? 33.114 -79.064 4.400 1.00 76.95 ? 85 LEU C N 1 +ATOM 3908 C CA . LEU C 3 85 ? 32.371 -79.213 5.641 1.00 71.74 ? 85 LEU C CA 1 +ATOM 3909 C C . LEU C 3 85 ? 31.511 -77.976 5.902 1.00 80.20 ? 85 LEU C C 1 +ATOM 3910 O O . LEU C 3 85 ? 30.365 -78.111 6.329 1.00 70.77 ? 85 LEU C O 1 +ATOM 3911 C CB . LEU C 3 85 ? 33.326 -79.502 6.808 1.00 73.98 ? 85 LEU C CB 1 +ATOM 3912 C CG . LEU C 3 85 ? 33.878 -80.926 6.903 1.00 78.64 ? 85 LEU C CG 1 +ATOM 3913 C CD1 . LEU C 3 85 ? 34.930 -81.015 7.991 1.00 91.49 ? 85 LEU C CD1 1 +ATOM 3914 C CD2 . LEU C 3 85 ? 32.777 -81.945 7.165 1.00 70.72 ? 85 LEU C CD2 1 +ATOM 3915 N N . TRP C 3 86 ? 32.063 -76.783 5.625 1.00 99.61 ? 86 TRP C N 1 +ATOM 3916 C CA . TRP C 3 86 ? 31.450 -75.531 6.047 1.00 102.11 ? 86 TRP C CA 1 +ATOM 3917 C C . TRP C 3 86 ? 31.832 -74.373 5.126 1.00 100.03 ? 86 TRP C C 1 +ATOM 3918 O O . TRP C 3 86 ? 32.967 -74.277 4.657 1.00 91.06 ? 86 TRP C O 1 +ATOM 3919 C CB . TRP C 3 86 ? 31.814 -75.230 7.506 1.00 93.84 ? 86 TRP C CB 1 +ATOM 3920 C CG . TRP C 3 86 ? 31.081 -74.066 8.099 1.00 95.38 ? 86 TRP C CG 1 +ATOM 3921 C CD1 . TRP C 3 86 ? 29.800 -74.055 8.567 1.00 107.07 ? 86 TRP C CD1 1 +ATOM 3922 C CD2 . TRP C 3 86 ? 31.594 -72.738 8.306 1.00 86.29 ? 86 TRP C CD2 1 +ATOM 3923 N NE1 . TRP C 3 86 ? 29.477 -72.814 9.045 1.00 95.69 ? 86 TRP C NE1 1 +ATOM 3924 C CE2 . TRP C 3 86 ? 30.557 -71.984 8.900 1.00 87.29 ? 86 TRP C CE2 1 +ATOM 3925 C CE3 . TRP C 3 86 ? 32.818 -72.109 8.044 1.00 75.99 ? 86 TRP C CE3 1 +ATOM 3926 C CZ2 . TRP C 3 86 ? 30.713 -70.639 9.237 1.00 79.72 ? 86 TRP C CZ2 1 +ATOM 3927 C CZ3 . TRP C 3 86 ? 32.970 -70.779 8.376 1.00 64.75 ? 86 TRP C CZ3 1 +ATOM 3928 C CH2 . TRP C 3 86 ? 31.934 -70.058 8.971 1.00 67.48 ? 86 TRP C CH2 1 +ATOM 3929 N N . LYS C 3 87 ? 30.852 -73.484 4.922 1.00 97.08 ? 87 LYS C N 1 +ATOM 3930 C CA . LYS C 3 87 ? 30.945 -72.278 4.114 1.00 98.71 ? 87 LYS C CA 1 +ATOM 3931 C C . LYS C 3 87 ? 30.641 -71.098 5.039 1.00 100.41 ? 87 LYS C C 1 +ATOM 3932 O O . LYS C 3 87 ? 29.778 -71.217 5.909 1.00 101.45 ? 87 LYS C O 1 +ATOM 3933 C CB . LYS C 3 87 ? 29.915 -72.412 2.985 1.00 78.10 ? 87 LYS C CB 1 +ATOM 3934 C CG . LYS C 3 87 ? 30.006 -71.458 1.802 1.00 71.71 ? 87 LYS C CG 1 +ATOM 3935 C CD . LYS C 3 87 ? 28.880 -71.732 0.815 1.00 79.49 ? 87 LYS C CD 1 +ATOM 3936 C CE . LYS C 3 87 ? 28.497 -70.556 -0.060 1.00 97.09 ? 87 LYS C CE 1 +ATOM 3937 N NZ . LYS C 3 87 ? 29.159 -70.597 -1.388 1.00 98.73 ? 87 LYS C NZ 1 +ATOM 3938 N N . GLY C 3 88 ? 31.362 -69.978 4.870 1.00 77.19 ? 88 GLY C N 1 +ATOM 3939 C CA . GLY C 3 88 ? 31.139 -68.810 5.711 1.00 58.37 ? 88 GLY C CA 1 +ATOM 3940 C C . GLY C 3 88 ? 31.924 -67.571 5.285 1.00 64.77 ? 88 GLY C C 1 +ATOM 3941 O O . GLY C 3 88 ? 32.586 -67.578 4.249 1.00 95.66 ? 88 GLY C O 1 +ATOM 3942 N N . SER C 3 89 ? 31.806 -66.507 6.094 1.00 63.50 ? 89 SER C N 1 +ATOM 3943 C CA . SER C 3 89 ? 32.539 -65.259 5.924 1.00 68.22 ? 89 SER C CA 1 +ATOM 3944 C C . SER C 3 89 ? 32.746 -64.578 7.278 1.00 70.73 ? 89 SER C C 1 +ATOM 3945 O O . SER C 3 89 ? 32.087 -64.942 8.250 1.00 74.23 ? 89 SER C O 1 +ATOM 3946 C CB . SER C 3 89 ? 31.863 -64.347 4.916 1.00 76.60 ? 89 SER C CB 1 +ATOM 3947 O OG . SER C 3 89 ? 30.825 -63.582 5.508 1.00 77.49 ? 89 SER C OG 1 +ATOM 3948 N N . PHE C 3 90 ? 33.681 -63.610 7.332 1.00 87.72 ? 90 PHE C N 1 +ATOM 3949 C CA . PHE C 3 90 ? 33.944 -62.804 8.521 1.00 69.51 ? 90 PHE C CA 1 +ATOM 3950 C C . PHE C 3 90 ? 34.679 -61.508 8.177 1.00 68.29 ? 90 PHE C C 1 +ATOM 3951 O O . PHE C 3 90 ? 35.527 -61.479 7.285 1.00 85.78 ? 90 PHE C O 1 +ATOM 3952 C CB . PHE C 3 90 ? 34.679 -63.607 9.599 1.00 56.38 ? 90 PHE C CB 1 +ATOM 3953 C CG . PHE C 3 90 ? 36.177 -63.445 9.690 1.00 55.27 ? 90 PHE C CG 1 +ATOM 3954 C CD1 . PHE C 3 90 ? 37.030 -64.180 8.873 1.00 68.68 ? 90 PHE C CD1 1 +ATOM 3955 C CD2 . PHE C 3 90 ? 36.745 -62.600 10.633 1.00 52.61 ? 90 PHE C CD2 1 +ATOM 3956 C CE1 . PHE C 3 90 ? 38.412 -64.057 8.978 1.00 59.60 ? 90 PHE C CE1 1 +ATOM 3957 C CE2 . PHE C 3 90 ? 38.127 -62.479 10.738 1.00 62.54 ? 90 PHE C CE2 1 +ATOM 3958 C CZ . PHE C 3 90 ? 38.960 -63.203 9.910 1.00 49.90 ? 90 PHE C CZ 1 +ATOM 3959 N N . LYS C 3 91 ? 34.321 -60.444 8.909 1.00 64.74 ? 91 LYS C N 1 +ATOM 3960 C CA . LYS C 3 91 ? 35.025 -59.173 8.913 1.00 50.42 ? 91 LYS C CA 1 +ATOM 3961 C C . LYS C 3 91 ? 35.915 -59.152 10.150 1.00 48.75 ? 91 LYS C C 1 +ATOM 3962 O O . LYS C 3 91 ? 35.415 -59.325 11.257 1.00 78.82 ? 91 LYS C O 1 +ATOM 3963 C CB . LYS C 3 91 ? 34.041 -57.998 8.931 1.00 57.75 ? 91 LYS C CB 1 +ATOM 3964 C CG . LYS C 3 91 ? 33.032 -57.952 7.785 1.00 67.84 ? 91 LYS C CG 1 +ATOM 3965 C CD . LYS C 3 91 ? 32.232 -56.656 7.676 1.00 62.68 ? 91 LYS C CD 1 +ATOM 3966 C CE . LYS C 3 91 ? 33.073 -55.449 7.308 1.00 57.26 ? 91 LYS C CE 1 +ATOM 3967 N NZ . LYS C 3 91 ? 32.251 -54.306 6.843 1.00 60.04 ? 91 LYS C NZ 1 +ATOM 3968 N N . PRO C 3 92 ? 37.251 -58.975 10.016 1.00 58.50 ? 92 PRO C N 1 +ATOM 3969 C CA . PRO C 3 92 ? 38.157 -59.082 11.165 1.00 59.55 ? 92 PRO C CA 1 +ATOM 3970 C C . PRO C 3 92 ? 38.030 -57.919 12.150 1.00 62.30 ? 92 PRO C C 1 +ATOM 3971 O O . PRO C 3 92 ? 38.206 -58.099 13.352 1.00 69.05 ? 92 PRO C O 1 +ATOM 3972 C CB . PRO C 3 92 ? 39.548 -59.140 10.515 1.00 55.37 ? 92 PRO C CB 1 +ATOM 3973 C CG . PRO C 3 92 ? 39.385 -58.393 9.202 1.00 60.69 ? 92 PRO C CG 1 +ATOM 3974 C CD . PRO C 3 92 ? 37.958 -58.647 8.765 1.00 61.17 ? 92 PRO C CD 1 +ATOM 3975 N N . SER C 3 93 ? 37.683 -56.740 11.620 1.00 62.72 ? 93 SER C N 1 +ATOM 3976 C CA . SER C 3 93 ? 37.563 -55.498 12.364 1.00 67.48 ? 93 SER C CA 1 +ATOM 3977 C C . SER C 3 93 ? 36.411 -55.559 13.366 1.00 71.63 ? 93 SER C C 1 +ATOM 3978 O O . SER C 3 93 ? 36.201 -54.615 14.126 1.00 96.35 ? 93 SER C O 1 +ATOM 3979 C CB . SER C 3 93 ? 37.376 -54.348 11.405 1.00 73.34 ? 93 SER C CB 1 +ATOM 3980 O OG . SER C 3 93 ? 36.242 -54.558 10.576 1.00 65.90 ? 93 SER C OG 1 +ATOM 3981 N N . GLU C 3 94 ? 35.685 -56.682 13.371 1.00 61.67 ? 94 GLU C N 1 +ATOM 3982 C CA . GLU C 3 94 ? 34.375 -56.755 13.998 1.00 53.60 ? 94 GLU C CA 1 +ATOM 3983 C C . GLU C 3 94 ? 34.426 -57.561 15.297 1.00 59.17 ? 94 GLU C C 1 +ATOM 3984 O O . GLU C 3 94 ? 33.418 -57.628 15.996 1.00 60.54 ? 94 GLU C O 1 +ATOM 3985 C CB . GLU C 3 94 ? 33.357 -57.296 12.995 1.00 46.31 ? 94 GLU C CB 1 +ATOM 3986 C CG . GLU C 3 94 ? 32.173 -56.375 12.787 1.00 62.91 ? 94 GLU C CG 1 +ATOM 3987 C CD . GLU C 3 94 ? 31.587 -56.383 11.383 1.00 91.76 ? 94 GLU C CD 1 +ATOM 3988 O OE1 . GLU C 3 94 ? 31.086 -57.449 10.949 1.00 90.82 ? 94 GLU C OE1 1 +ATOM 3989 O OE2 . GLU C 3 94 ? 31.637 -55.321 10.721 1.00 106.88 ? 94 GLU C OE2 1 +ATOM 3990 N N . HIS C 3 95 ? 35.592 -58.155 15.608 1.00 61.18 ? 95 HIS C N 1 +ATOM 3991 C CA . HIS C 3 95 ? 35.854 -58.869 16.853 1.00 65.84 ? 95 HIS C CA 1 +ATOM 3992 C C . HIS C 3 95 ? 37.331 -58.736 17.214 1.00 74.61 ? 95 HIS C C 1 +ATOM 3993 O O . HIS C 3 95 ? 38.156 -59.511 16.731 1.00 78.93 ? 95 HIS C O 1 +ATOM 3994 C CB . HIS C 3 95 ? 35.449 -60.347 16.748 1.00 63.83 ? 95 HIS C CB 1 +ATOM 3995 C CG . HIS C 3 95 ? 34.025 -60.617 17.092 1.00 86.75 ? 95 HIS C CG 1 +ATOM 3996 N ND1 . HIS C 3 95 ? 33.040 -60.737 16.125 1.00 92.03 ? 95 HIS C ND1 1 +ATOM 3997 C CD2 . HIS C 3 95 ? 33.414 -60.795 18.284 1.00 98.86 ? 95 HIS C CD2 1 +ATOM 3998 C CE1 . HIS C 3 95 ? 31.882 -60.976 16.708 1.00 96.61 ? 95 HIS C CE1 1 +ATOM 3999 N NE2 . HIS C 3 95 ? 32.085 -61.016 18.035 1.00 103.04 ? 95 HIS C NE2 1 +ATOM 4000 N N . VAL C 3 96 ? 37.653 -57.761 18.077 1.00 64.58 ? 96 VAL C N 1 +ATOM 4001 C CA . VAL C 3 96 ? 39.029 -57.304 18.202 1.00 60.78 ? 96 VAL C CA 1 +ATOM 4002 C C . VAL C 3 96 ? 39.564 -57.549 19.609 1.00 53.46 ? 96 VAL C C 1 +ATOM 4003 O O . VAL C 3 96 ? 38.913 -57.206 20.588 1.00 75.63 ? 96 VAL C O 1 +ATOM 4004 C CB . VAL C 3 96 ? 39.173 -55.826 17.798 1.00 60.02 ? 96 VAL C CB 1 +ATOM 4005 C CG1 . VAL C 3 96 ? 40.630 -55.391 17.788 1.00 58.66 ? 96 VAL C CG1 1 +ATOM 4006 C CG2 . VAL C 3 96 ? 38.523 -55.540 16.451 1.00 71.38 ? 96 VAL C CG2 1 +ATOM 4007 N N . LYS C 3 97 ? 40.764 -58.137 19.677 1.00 48.37 ? 97 LYS C N 1 +ATOM 4008 C CA . LYS C 3 97 ? 41.555 -58.230 20.893 1.00 59.48 ? 97 LYS C CA 1 +ATOM 4009 C C . LYS C 3 97 ? 42.859 -57.478 20.647 1.00 61.09 ? 97 LYS C C 1 +ATOM 4010 O O . LYS C 3 97 ? 43.725 -57.978 19.931 1.00 66.86 ? 97 LYS C O 1 +ATOM 4011 C CB . LYS C 3 97 ? 41.801 -59.696 21.275 1.00 86.65 ? 97 LYS C CB 1 +ATOM 4012 C CG . LYS C 3 97 ? 42.668 -59.947 22.509 1.00 105.57 ? 97 LYS C CG 1 +ATOM 4013 C CD . LYS C 3 97 ? 42.844 -61.428 22.824 1.00 103.34 ? 97 LYS C CD 1 +ATOM 4014 C CE . LYS C 3 97 ? 43.824 -61.717 23.941 1.00 78.73 ? 97 LYS C CE 1 +ATOM 4015 N NZ . LYS C 3 97 ? 43.206 -61.510 25.270 1.00 94.89 ? 97 LYS C NZ 1 +ATOM 4016 N N . PRO C 3 98 ? 43.024 -56.251 21.201 1.00 77.88 ? 98 PRO C N 1 +ATOM 4017 C CA . PRO C 3 98 ? 44.238 -55.454 20.992 1.00 73.18 ? 98 PRO C CA 1 +ATOM 4018 C C . PRO C 3 98 ? 45.528 -56.136 21.443 1.00 65.84 ? 98 PRO C C 1 +ATOM 4019 O O . PRO C 3 98 ? 45.535 -56.932 22.380 1.00 67.57 ? 98 PRO C O 1 +ATOM 4020 C CB . PRO C 3 98 ? 43.997 -54.194 21.837 1.00 69.73 ? 98 PRO C CB 1 +ATOM 4021 C CG . PRO C 3 98 ? 42.488 -54.100 21.922 1.00 73.01 ? 98 PRO C CG 1 +ATOM 4022 C CD . PRO C 3 98 ? 42.032 -55.540 22.023 1.00 72.27 ? 98 PRO C CD 1 +ATOM 4023 N N . ARG C 3 99 ? 46.610 -55.814 20.727 1.00 72.51 ? 99 ARG C N 1 +ATOM 4024 C CA . ARG C 3 99 ? 47.966 -56.228 21.052 1.00 65.14 ? 99 ARG C CA 1 +ATOM 4025 C C . ARG C 3 99 ? 48.406 -55.493 22.318 1.00 57.89 ? 99 ARG C C 1 +ATOM 4026 O O . ARG C 3 99 ? 47.873 -54.428 22.636 1.00 63.64 ? 99 ARG C O 1 +ATOM 4027 C CB . ARG C 3 99 ? 48.877 -55.936 19.851 1.00 73.11 ? 99 ARG C CB 1 +ATOM 4028 C CG . ARG C 3 99 ? 50.120 -56.812 19.766 1.00 94.58 ? 99 ARG C CG 1 +ATOM 4029 C CD . ARG C 3 99 ? 51.156 -56.319 18.771 1.00 90.10 ? 99 ARG C CD 1 +ATOM 4030 N NE . ARG C 3 99 ? 50.838 -56.588 17.373 1.00 96.13 ? 99 ARG C NE 1 +ATOM 4031 C CZ . ARG C 3 99 ? 51.170 -57.693 16.706 1.00 111.43 ? 99 ARG C CZ 1 +ATOM 4032 N NH1 . ARG C 3 99 ? 51.227 -58.864 17.323 1.00 99.75 ? 99 ARG C NH1 1 +ATOM 4033 N NH2 . ARG C 3 99 ? 51.408 -57.628 15.407 1.00 98.75 ? 99 ARG C NH2 1 +ATOM 4034 N N . ALA C 3 100 ? 49.384 -56.073 23.023 1.00 58.51 ? 100 ALA C N 1 +ATOM 4035 C CA . ALA C 3 100 ? 49.907 -55.538 24.271 1.00 62.22 ? 100 ALA C CA 1 +ATOM 4036 C C . ALA C 3 100 ? 50.838 -54.360 23.992 1.00 71.97 ? 100 ALA C C 1 +ATOM 4037 O O . ALA C 3 100 ? 51.522 -54.359 22.969 1.00 84.72 ? 100 ALA C O 1 +ATOM 4038 C CB . ALA C 3 100 ? 50.626 -56.625 25.033 1.00 82.92 ? 100 ALA C CB 1 +ATOM 4039 N N . PRO C 3 101 ? 50.898 -53.335 24.884 1.00 65.60 ? 101 PRO C N 1 +ATOM 4040 C CA . PRO C 3 101 ? 51.918 -52.286 24.799 1.00 61.39 ? 101 PRO C CA 1 +ATOM 4041 C C . PRO C 3 101 ? 53.295 -52.833 25.180 1.00 74.99 ? 101 PRO C C 1 +ATOM 4042 O O . PRO C 3 101 ? 53.390 -53.953 25.683 1.00 72.56 ? 101 PRO C O 1 +ATOM 4043 C CB . PRO C 3 101 ? 51.432 -51.218 25.789 1.00 55.43 ? 101 PRO C CB 1 +ATOM 4044 C CG . PRO C 3 101 ? 49.986 -51.589 26.061 1.00 68.32 ? 101 PRO C CG 1 +ATOM 4045 C CD . PRO C 3 101 ? 49.962 -53.099 25.994 1.00 57.33 ? 101 PRO C CD 1 +ATOM 4046 N N . GLY C 3 102 ? 54.347 -52.029 24.946 1.00 86.36 ? 102 GLY C N 1 +ATOM 4047 C CA . GLY C 3 102 ? 55.723 -52.506 24.948 1.00 94.11 ? 102 GLY C CA 1 +ATOM 4048 C C . GLY C 3 102 ? 56.572 -51.999 26.114 1.00 89.61 ? 102 GLY C C 1 +ATOM 4049 O O . GLY C 3 102 ? 56.203 -52.168 27.275 1.00 90.16 ? 102 GLY C O 1 +ATOM 4050 N N . ASN C 3 103 ? 57.715 -51.383 25.765 1.00 78.74 ? 103 ASN C N 1 +ATOM 4051 C CA . ASN C 3 103 ? 58.861 -51.192 26.645 1.00 77.02 ? 103 ASN C CA 1 +ATOM 4052 C C . ASN C 3 103 ? 58.507 -50.228 27.776 1.00 88.08 ? 103 ASN C C 1 +ATOM 4053 O O . ASN C 3 103 ? 58.592 -49.010 27.611 1.00 79.69 ? 103 ASN C O 1 +ATOM 4054 C CB . ASN C 3 103 ? 60.128 -50.731 25.906 1.00 79.87 ? 103 ASN C CB 1 +ATOM 4055 C CG . ASN C 3 103 ? 60.016 -50.685 24.393 1.00 108.82 ? 103 ASN C CG 1 +ATOM 4056 O OD1 . ASN C 3 103 ? 59.967 -51.720 23.732 1.00 105.33 ? 103 ASN C OD1 1 +ATOM 4057 N ND2 . ASN C 3 103 ? 60.005 -49.485 23.832 1.00 98.91 ? 103 ASN C ND2 1 +ATOM 4058 N N . LEU C 3 104 ? 58.141 -50.807 28.929 1.00 89.69 ? 104 LEU C N 1 +ATOM 4059 C CA . LEU C 3 104 ? 57.730 -50.074 30.119 1.00 85.99 ? 104 LEU C CA 1 +ATOM 4060 C C . LEU C 3 104 ? 58.949 -49.676 30.960 1.00 82.42 ? 104 LEU C C 1 +ATOM 4061 O O . LEU C 3 104 ? 59.545 -50.521 31.625 1.00 81.81 ? 104 LEU C O 1 +ATOM 4062 C CB . LEU C 3 104 ? 56.742 -50.951 30.899 1.00 67.74 ? 104 LEU C CB 1 +ATOM 4063 C CG . LEU C 3 104 ? 55.988 -50.278 32.046 1.00 74.50 ? 104 LEU C CG 1 +ATOM 4064 C CD1 . LEU C 3 104 ? 55.093 -49.155 31.540 1.00 80.72 ? 104 LEU C CD1 1 +ATOM 4065 C CD2 . LEU C 3 104 ? 55.172 -51.295 32.829 1.00 62.48 ? 104 LEU C CD2 1 +ATOM 4066 N N . THR C 3 105 ? 59.291 -48.375 30.934 1.00 82.66 ? 105 THR C N 1 +ATOM 4067 C CA . THR C 3 105 ? 60.460 -47.804 31.593 1.00 95.44 ? 105 THR C CA 1 +ATOM 4068 C C . THR C 3 105 ? 60.025 -46.797 32.661 1.00 115.16 ? 105 THR C C 1 +ATOM 4069 O O . THR C 3 105 ? 58.874 -46.363 32.660 1.00 130.59 ? 105 THR C O 1 +ATOM 4070 C CB . THR C 3 105 ? 61.371 -47.088 30.585 1.00 107.65 ? 105 THR C CB 1 +ATOM 4071 O OG1 . THR C 3 105 ? 61.107 -47.532 29.252 1.00 96.30 ? 105 THR C OG1 1 +ATOM 4072 C CG2 . THR C 3 105 ? 62.843 -47.225 30.918 1.00 111.49 ? 105 THR C CG2 1 +ATOM 4073 N N . VAL C 3 106 ? 60.960 -46.422 33.553 1.00 107.46 ? 106 VAL C N 1 +ATOM 4074 C CA . VAL C 3 106 ? 60.721 -45.457 34.622 1.00 98.50 ? 106 VAL C CA 1 +ATOM 4075 C C . VAL C 3 106 ? 61.683 -44.272 34.494 1.00 94.60 ? 106 VAL C C 1 +ATOM 4076 O O . VAL C 3 106 ? 62.578 -44.282 33.647 1.00 108.95 ? 106 VAL C O 1 +ATOM 4077 C CB . VAL C 3 106 ? 60.796 -46.119 36.013 1.00 88.73 ? 106 VAL C CB 1 +ATOM 4078 N N . HIS C 3 107 ? 61.470 -43.244 35.336 1.00 85.46 ? 107 HIS C N 1 +ATOM 4079 C CA . HIS C 3 107 ? 62.299 -42.045 35.390 1.00 90.14 ? 107 HIS C CA 1 +ATOM 4080 C C . HIS C 3 107 ? 63.298 -42.148 36.550 1.00 109.58 ? 107 HIS C C 1 +ATOM 4081 O O . HIS C 3 107 ? 64.006 -41.188 36.871 1.00 115.63 ? 107 HIS C O 1 +ATOM 4082 C CB . HIS C 3 107 ? 61.436 -40.780 35.516 1.00 66.59 ? 107 HIS C CB 1 +ATOM 4083 N N . ASP C 3 112 ? 59.886 -34.542 43.208 1.00 101.86 ? 112 ASP C N 1 +ATOM 4084 C CA . ASP C 3 112 ? 60.018 -34.468 41.739 1.00 115.55 ? 112 ASP C CA 1 +ATOM 4085 C C . ASP C 3 112 ? 59.131 -35.541 41.104 1.00 131.96 ? 112 ASP C C 1 +ATOM 4086 O O . ASP C 3 112 ? 58.146 -35.985 41.699 1.00 104.09 ? 112 ASP C O 1 +ATOM 4087 C CB . ASP C 3 112 ? 61.504 -34.520 41.279 1.00 113.30 ? 112 ASP C CB 1 +ATOM 4088 C CG . ASP C 3 112 ? 62.299 -35.750 41.797 1.00 129.74 ? 112 ASP C CG 1 +ATOM 4089 O OD1 . ASP C 3 112 ? 61.644 -36.606 42.476 1.00 125.86 ? 112 ASP C OD1 1 +ATOM 4090 O OD2 . ASP C 3 112 ? 63.587 -35.844 41.792 1.00 172.46 ? 112 ASP C OD2 1 +ATOM 4091 N N . THR C 3 113 ? 59.530 -35.975 39.902 1.00 143.70 ? 113 THR C N 1 +ATOM 4092 C CA . THR C 3 113 ? 58.643 -36.622 38.949 1.00 127.52 ? 113 THR C CA 1 +ATOM 4093 C C . THR C 3 113 ? 58.949 -38.119 38.856 1.00 128.77 ? 113 THR C C 1 +ATOM 4094 O O . THR C 3 113 ? 60.104 -38.531 38.980 1.00 138.38 ? 113 THR C O 1 +ATOM 4095 C CB . THR C 3 113 ? 58.678 -35.851 37.619 1.00 105.71 ? 113 THR C CB 1 +ATOM 4096 O OG1 . THR C 3 113 ? 57.495 -36.132 36.870 1.00 108.44 ? 113 THR C OG1 1 +ATOM 4097 C CG2 . THR C 3 113 ? 59.930 -36.086 36.796 1.00 85.83 ? 113 THR C CG2 1 +ATOM 4098 N N . LEU C 3 114 ? 57.891 -38.919 38.642 1.00 122.37 ? 114 LEU C N 1 +ATOM 4099 C CA . LEU C 3 114 ? 58.020 -40.335 38.324 1.00 107.94 ? 114 LEU C CA 1 +ATOM 4100 C C . LEU C 3 114 ? 57.285 -40.656 37.019 1.00 98.24 ? 114 LEU C C 1 +ATOM 4101 O O . LEU C 3 114 ? 56.065 -40.839 36.989 1.00 59.00 ? 114 LEU C O 1 +ATOM 4102 C CB . LEU C 3 114 ? 57.536 -41.189 39.502 1.00 100.98 ? 114 LEU C CB 1 +ATOM 4103 C CG . LEU C 3 114 ? 58.174 -42.577 39.608 1.00 126.20 ? 114 LEU C CG 1 +ATOM 4104 C CD1 . LEU C 3 114 ? 59.680 -42.487 39.836 1.00 124.33 ? 114 LEU C CD1 1 +ATOM 4105 C CD2 . LEU C 3 114 ? 57.519 -43.397 40.709 1.00 124.52 ? 114 LEU C CD2 1 +ATOM 4106 N N . LEU C 3 115 ? 58.073 -40.723 35.939 1.00 89.16 ? 115 LEU C N 1 +ATOM 4107 C CA . LEU C 3 115 ? 57.578 -40.869 34.581 1.00 88.29 ? 115 LEU C CA 1 +ATOM 4108 C C . LEU C 3 115 ? 57.670 -42.336 34.169 1.00 89.74 ? 115 LEU C C 1 +ATOM 4109 O O . LEU C 3 115 ? 58.712 -42.963 34.345 1.00 129.38 ? 115 LEU C O 1 +ATOM 4110 C CB . LEU C 3 115 ? 58.404 -39.957 33.663 1.00 81.80 ? 115 LEU C CB 1 +ATOM 4111 C CG . LEU C 3 115 ? 58.214 -40.120 32.152 1.00 84.35 ? 115 LEU C CG 1 +ATOM 4112 C CD1 . LEU C 3 115 ? 57.063 -39.266 31.632 1.00 81.17 ? 115 LEU C CD1 1 +ATOM 4113 C CD2 . LEU C 3 115 ? 59.494 -39.768 31.410 1.00 79.06 ? 115 LEU C CD2 1 +ATOM 4114 N N . LEU C 3 116 ? 56.556 -42.860 33.639 1.00 88.04 ? 116 LEU C N 1 +ATOM 4115 C CA . LEU C 3 116 ? 56.481 -44.180 33.028 1.00 85.15 ? 116 LEU C CA 1 +ATOM 4116 C C . LEU C 3 116 ? 56.261 -44.008 31.526 1.00 89.64 ? 116 LEU C C 1 +ATOM 4117 O O . LEU C 3 116 ? 55.403 -43.230 31.120 1.00 94.23 ? 116 LEU C O 1 +ATOM 4118 C CB . LEU C 3 116 ? 55.313 -44.946 33.661 1.00 79.54 ? 116 LEU C CB 1 +ATOM 4119 C CG . LEU C 3 116 ? 55.632 -45.945 34.778 1.00 70.41 ? 116 LEU C CG 1 +ATOM 4120 C CD1 . LEU C 3 116 ? 56.450 -45.322 35.901 1.00 76.34 ? 116 LEU C CD1 1 +ATOM 4121 C CD2 . LEU C 3 116 ? 54.343 -46.528 35.340 1.00 55.46 ? 116 LEU C CD2 1 +ATOM 4122 N N . THR C 3 117 ? 57.051 -44.719 30.712 1.00 88.63 ? 117 THR C N 1 +ATOM 4123 C CA . THR C 3 117 ? 56.927 -44.655 29.263 1.00 87.94 ? 117 THR C CA 1 +ATOM 4124 C C . THR C 3 117 ? 56.599 -46.046 28.729 1.00 99.03 ? 117 THR C C 1 +ATOM 4125 O O . THR C 3 117 ? 56.973 -47.038 29.352 1.00 77.06 ? 117 THR C O 1 +ATOM 4126 C CB . THR C 3 117 ? 58.204 -44.105 28.613 1.00 102.88 ? 117 THR C CB 1 +ATOM 4127 O OG1 . THR C 3 117 ? 58.840 -43.222 29.537 1.00 116.51 ? 117 THR C OG1 1 +ATOM 4128 C CG2 . THR C 3 117 ? 57.950 -43.385 27.305 1.00 100.43 ? 117 THR C CG2 1 +ATOM 4129 N N . TRP C 3 118 ? 55.877 -46.096 27.597 1.00 103.48 ? 118 TRP C N 1 +ATOM 4130 C CA . TRP C 3 118 ? 55.677 -47.328 26.845 1.00 91.12 ? 118 TRP C CA 1 +ATOM 4131 C C . TRP C 3 118 ? 55.565 -47.071 25.343 1.00 103.46 ? 118 TRP C C 1 +ATOM 4132 O O . TRP C 3 118 ? 55.494 -45.924 24.898 1.00 115.17 ? 118 TRP C O 1 +ATOM 4133 C CB . TRP C 3 118 ? 54.502 -48.156 27.383 1.00 101.89 ? 118 TRP C CB 1 +ATOM 4134 C CG . TRP C 3 118 ? 53.164 -47.484 27.357 1.00 104.84 ? 118 TRP C CG 1 +ATOM 4135 C CD1 . TRP C 3 118 ? 52.220 -47.552 26.372 1.00 90.13 ? 118 TRP C CD1 1 +ATOM 4136 C CD2 . TRP C 3 118 ? 52.592 -46.680 28.402 1.00 91.62 ? 118 TRP C CD2 1 +ATOM 4137 N NE1 . TRP C 3 118 ? 51.110 -46.832 26.723 1.00 71.62 ? 118 TRP C NE1 1 +ATOM 4138 C CE2 . TRP C 3 118 ? 51.307 -46.286 27.963 1.00 88.50 ? 118 TRP C CE2 1 +ATOM 4139 C CE3 . TRP C 3 118 ? 53.038 -46.254 29.660 1.00 75.60 ? 118 TRP C CE3 1 +ATOM 4140 C CZ2 . TRP C 3 118 ? 50.471 -45.482 28.740 1.00 91.24 ? 118 TRP C CZ2 1 +ATOM 4141 C CZ3 . TRP C 3 118 ? 52.208 -45.463 30.427 1.00 79.91 ? 118 TRP C CZ3 1 +ATOM 4142 C CH2 . TRP C 3 118 ? 50.945 -45.082 29.971 1.00 75.83 ? 118 TRP C CH2 1 +ATOM 4143 N N . SER C 3 119 ? 55.572 -48.176 24.581 1.00 98.24 ? 119 SER C N 1 +ATOM 4144 C CA . SER C 3 119 ? 55.441 -48.175 23.134 1.00 75.62 ? 119 SER C CA 1 +ATOM 4145 C C . SER C 3 119 ? 54.023 -48.592 22.731 1.00 85.25 ? 119 SER C C 1 +ATOM 4146 O O . SER C 3 119 ? 53.514 -49.615 23.193 1.00 74.93 ? 119 SER C O 1 +ATOM 4147 C CB . SER C 3 119 ? 56.491 -49.063 22.505 1.00 70.89 ? 119 SER C CB 1 +ATOM 4148 O OG . SER C 3 119 ? 56.071 -50.424 22.444 1.00 72.27 ? 119 SER C OG 1 +ATOM 4149 N N . ASN C 3 120 ? 53.393 -47.772 21.878 1.00 72.72 ? 120 ASN C N 1 +ATOM 4150 C CA . ASN C 3 120 ? 52.186 -48.148 21.160 1.00 75.16 ? 120 ASN C CA 1 +ATOM 4151 C C . ASN C 3 120 ? 52.565 -49.158 20.076 1.00 85.28 ? 120 ASN C C 1 +ATOM 4152 O O . ASN C 3 120 ? 53.263 -48.809 19.122 1.00 83.11 ? 120 ASN C O 1 +ATOM 4153 C CB . ASN C 3 120 ? 51.466 -46.918 20.594 1.00 82.72 ? 120 ASN C CB 1 +ATOM 4154 C CG . ASN C 3 120 ? 50.124 -47.211 19.951 1.00 96.99 ? 120 ASN C CG 1 +ATOM 4155 O OD1 . ASN C 3 120 ? 49.916 -48.262 19.344 1.00 75.03 ? 120 ASN C OD1 1 +ATOM 4156 N ND2 . ASN C 3 120 ? 49.204 -46.266 20.056 1.00 108.12 ? 120 ASN C ND2 1 +ATOM 4157 N N . PRO C 3 121 ? 52.098 -50.429 20.169 1.00 87.06 ? 121 PRO C N 1 +ATOM 4158 C CA . PRO C 3 121 ? 52.560 -51.493 19.270 1.00 76.82 ? 121 PRO C CA 1 +ATOM 4159 C C . PRO C 3 121 ? 52.093 -51.392 17.817 1.00 65.74 ? 121 PRO C C 1 +ATOM 4160 O O . PRO C 3 121 ? 52.542 -52.174 16.984 1.00 71.95 ? 121 PRO C O 1 +ATOM 4161 C CB . PRO C 3 121 ? 52.009 -52.768 19.928 1.00 77.56 ? 121 PRO C CB 1 +ATOM 4162 C CG . PRO C 3 121 ? 50.757 -52.302 20.648 1.00 73.79 ? 121 PRO C CG 1 +ATOM 4163 C CD . PRO C 3 121 ? 51.093 -50.909 21.137 1.00 83.57 ? 121 PRO C CD 1 +ATOM 4164 N N . TYR C 3 122 ? 51.205 -50.428 17.525 1.00 57.82 ? 122 TYR C N 1 +ATOM 4165 C CA . TYR C 3 122 ? 50.644 -50.222 16.195 1.00 68.84 ? 122 TYR C CA 1 +ATOM 4166 C C . TYR C 3 122 ? 51.315 -49.023 15.522 1.00 64.26 ? 122 TYR C C 1 +ATOM 4167 O O . TYR C 3 122 ? 51.574 -48.017 16.181 1.00 86.88 ? 122 TYR C O 1 +ATOM 4168 C CB . TYR C 3 122 ? 49.119 -50.052 16.253 1.00 65.08 ? 122 TYR C CB 1 +ATOM 4169 C CG . TYR C 3 122 ? 48.364 -51.253 16.766 1.00 70.16 ? 122 TYR C CG 1 +ATOM 4170 C CD1 . TYR C 3 122 ? 48.133 -51.425 18.123 1.00 75.69 ? 122 TYR C CD1 1 +ATOM 4171 C CD2 . TYR C 3 122 ? 47.886 -52.229 15.901 1.00 81.79 ? 122 TYR C CD2 1 +ATOM 4172 C CE1 . TYR C 3 122 ? 47.445 -52.527 18.610 1.00 86.68 ? 122 TYR C CE1 1 +ATOM 4173 C CE2 . TYR C 3 122 ? 47.195 -53.338 16.371 1.00 84.73 ? 122 TYR C CE2 1 +ATOM 4174 C CZ . TYR C 3 122 ? 46.976 -53.490 17.732 1.00 89.42 ? 122 TYR C CZ 1 +ATOM 4175 O OH . TYR C 3 122 ? 46.298 -54.572 18.218 1.00 78.31 ? 122 TYR C OH 1 +ATOM 4176 N N . PRO C 3 123 ? 51.592 -49.080 14.195 1.00 60.77 ? 123 PRO C N 1 +ATOM 4177 C CA . PRO C 3 123 ? 52.295 -48.003 13.496 1.00 50.27 ? 123 PRO C CA 1 +ATOM 4178 C C . PRO C 3 123 ? 51.360 -46.846 13.145 1.00 53.12 ? 123 PRO C C 1 +ATOM 4179 O O . PRO C 3 123 ? 50.142 -47.025 13.136 1.00 50.57 ? 123 PRO C O 1 +ATOM 4180 C CB . PRO C 3 123 ? 52.759 -48.703 12.209 1.00 56.02 ? 123 PRO C CB 1 +ATOM 4181 C CG . PRO C 3 123 ? 51.663 -49.699 11.916 1.00 62.93 ? 123 PRO C CG 1 +ATOM 4182 C CD . PRO C 3 123 ? 51.220 -50.178 13.282 1.00 73.30 ? 123 PRO C CD 1 +ATOM 4183 N N . PRO C 3 124 ? 51.901 -45.646 12.818 1.00 51.94 ? 124 PRO C N 1 +ATOM 4184 C CA . PRO C 3 124 ? 51.089 -44.456 12.528 1.00 57.65 ? 124 PRO C CA 1 +ATOM 4185 C C . PRO C 3 124 ? 49.913 -44.570 11.554 1.00 67.62 ? 124 PRO C C 1 +ATOM 4186 O O . PRO C 3 124 ? 48.954 -43.806 11.649 1.00 96.17 ? 124 PRO C O 1 +ATOM 4187 C CB . PRO C 3 124 ? 52.116 -43.466 11.951 1.00 65.04 ? 124 PRO C CB 1 +ATOM 4188 C CG . PRO C 3 124 ? 53.417 -43.849 12.617 1.00 57.42 ? 124 PRO C CG 1 +ATOM 4189 C CD . PRO C 3 124 ? 53.346 -45.355 12.751 1.00 56.67 ? 124 PRO C CD 1 +ATOM 4190 N N . ASP C 3 125 ? 49.992 -45.527 10.627 1.00 78.06 ? 125 ASP C N 1 +ATOM 4191 C CA . ASP C 3 125 ? 49.068 -45.623 9.507 1.00 75.07 ? 125 ASP C CA 1 +ATOM 4192 C C . ASP C 3 125 ? 47.927 -46.589 9.831 1.00 68.23 ? 125 ASP C C 1 +ATOM 4193 O O . ASP C 3 125 ? 47.099 -46.879 8.971 1.00 57.04 ? 125 ASP C O 1 +ATOM 4194 C CB . ASP C 3 125 ? 49.827 -46.048 8.249 1.00 86.46 ? 125 ASP C CB 1 +ATOM 4195 C CG . ASP C 3 125 ? 50.605 -47.340 8.443 1.00 89.73 ? 125 ASP C CG 1 +ATOM 4196 O OD1 . ASP C 3 125 ? 51.456 -47.386 9.364 1.00 84.87 ? 125 ASP C OD1 1 +ATOM 4197 O OD2 . ASP C 3 125 ? 50.341 -48.297 7.687 1.00 90.36 ? 125 ASP C OD2 1 +ATOM 4198 N N . ASN C 3 126 ? 47.892 -47.080 11.077 1.00 74.92 ? 126 ASN C N 1 +ATOM 4199 C CA . ASN C 3 126 ? 46.928 -48.072 11.523 1.00 54.21 ? 126 ASN C CA 1 +ATOM 4200 C C . ASN C 3 126 ? 45.833 -47.368 12.313 1.00 58.57 ? 126 ASN C C 1 +ATOM 4201 O O . ASN C 3 126 ? 46.092 -46.335 12.921 1.00 81.53 ? 126 ASN C O 1 +ATOM 4202 C CB . ASN C 3 126 ? 47.606 -49.142 12.380 1.00 68.65 ? 126 ASN C CB 1 +ATOM 4203 C CG . ASN C 3 126 ? 46.711 -50.326 12.672 1.00 68.90 ? 126 ASN C CG 1 +ATOM 4204 O OD1 . ASN C 3 126 ? 46.193 -50.450 13.778 1.00 65.15 ? 126 ASN C OD1 1 +ATOM 4205 N ND2 . ASN C 3 126 ? 46.512 -51.185 11.685 1.00 77.97 ? 126 ASN C ND2 1 +ATOM 4206 N N . TYR C 3 127 ? 44.622 -47.944 12.298 1.00 71.89 ? 127 TYR C N 1 +ATOM 4207 C CA . TYR C 3 127 ? 43.457 -47.388 12.974 1.00 76.43 ? 127 TYR C CA 1 +ATOM 4208 C C . TYR C 3 127 ? 43.650 -47.386 14.491 1.00 74.89 ? 127 TYR C C 1 +ATOM 4209 O O . TYR C 3 127 ? 43.237 -46.436 15.158 1.00 71.51 ? 127 TYR C O 1 +ATOM 4210 C CB . TYR C 3 127 ? 42.176 -48.135 12.586 1.00 89.35 ? 127 TYR C CB 1 +ATOM 4211 C CG . TYR C 3 127 ? 40.942 -47.739 13.364 1.00 87.83 ? 127 TYR C CG 1 +ATOM 4212 C CD1 . TYR C 3 127 ? 40.672 -48.281 14.618 1.00 74.59 ? 127 TYR C CD1 1 +ATOM 4213 C CD2 . TYR C 3 127 ? 40.037 -46.822 12.847 1.00 72.72 ? 127 TYR C CD2 1 +ATOM 4214 C CE1 . TYR C 3 127 ? 39.546 -47.918 15.341 1.00 58.82 ? 127 TYR C CE1 1 +ATOM 4215 C CE2 . TYR C 3 127 ? 38.903 -46.451 13.556 1.00 81.97 ? 127 TYR C CE2 1 +ATOM 4216 C CZ . TYR C 3 127 ? 38.660 -46.998 14.806 1.00 64.09 ? 127 TYR C CZ 1 +ATOM 4217 O OH . TYR C 3 127 ? 37.539 -46.641 15.494 1.00 67.74 ? 127 TYR C OH 1 +ATOM 4218 N N . LEU C 3 128 ? 44.260 -48.454 15.025 1.00 66.43 ? 128 LEU C N 1 +ATOM 4219 C CA . LEU C 3 128 ? 44.456 -48.580 16.464 1.00 70.45 ? 128 LEU C CA 1 +ATOM 4220 C C . LEU C 3 128 ? 45.600 -47.689 16.948 1.00 71.37 ? 128 LEU C C 1 +ATOM 4221 O O . LEU C 3 128 ? 45.922 -47.697 18.137 1.00 86.08 ? 128 LEU C O 1 +ATOM 4222 C CB . LEU C 3 128 ? 44.692 -50.047 16.851 1.00 49.07 ? 128 LEU C CB 1 +ATOM 4223 C CG . LEU C 3 128 ? 43.453 -50.939 16.941 1.00 53.32 ? 128 LEU C CG 1 +ATOM 4224 C CD1 . LEU C 3 128 ? 43.702 -52.100 17.888 1.00 71.41 ? 128 LEU C CD1 1 +ATOM 4225 C CD2 . LEU C 3 128 ? 42.212 -50.164 17.370 1.00 49.86 ? 128 LEU C CD2 1 +ATOM 4226 N N . TYR C 3 129 ? 46.197 -46.915 16.034 1.00 56.60 ? 129 TYR C N 1 +ATOM 4227 C CA . TYR C 3 129 ? 47.301 -46.043 16.399 1.00 73.81 ? 129 TYR C CA 1 +ATOM 4228 C C . TYR C 3 129 ? 46.833 -44.991 17.402 1.00 70.38 ? 129 TYR C C 1 +ATOM 4229 O O . TYR C 3 129 ? 47.551 -44.692 18.351 1.00 61.31 ? 129 TYR C O 1 +ATOM 4230 C CB . TYR C 3 129 ? 47.938 -45.396 15.167 1.00 64.82 ? 129 TYR C CB 1 +ATOM 4231 C CG . TYR C 3 129 ? 49.006 -44.371 15.467 1.00 80.59 ? 129 TYR C CG 1 +ATOM 4232 C CD1 . TYR C 3 129 ? 50.179 -44.727 16.125 1.00 82.77 ? 129 TYR C CD1 1 +ATOM 4233 C CD2 . TYR C 3 129 ? 48.851 -43.045 15.084 1.00 74.33 ? 129 TYR C CD2 1 +ATOM 4234 C CE1 . TYR C 3 129 ? 51.169 -43.793 16.398 1.00 73.68 ? 129 TYR C CE1 1 +ATOM 4235 C CE2 . TYR C 3 129 ? 49.832 -42.099 15.350 1.00 79.35 ? 129 TYR C CE2 1 +ATOM 4236 C CZ . TYR C 3 129 ? 50.992 -42.475 16.010 1.00 79.03 ? 129 TYR C CZ 1 +ATOM 4237 O OH . TYR C 3 129 ? 51.960 -41.551 16.278 1.00 88.83 ? 129 TYR C OH 1 +ATOM 4238 N N . ASN C 3 130 ? 45.634 -44.443 17.165 1.00 67.42 ? 130 ASN C N 1 +ATOM 4239 C CA . ASN C 3 130 ? 45.110 -43.325 17.932 1.00 62.09 ? 130 ASN C CA 1 +ATOM 4240 C C . ASN C 3 130 ? 43.701 -43.667 18.412 1.00 65.34 ? 130 ASN C C 1 +ATOM 4241 O O . ASN C 3 130 ? 42.834 -42.800 18.494 1.00 82.82 ? 130 ASN C O 1 +ATOM 4242 C CB . ASN C 3 130 ? 45.254 -41.992 17.183 1.00 57.80 ? 130 ASN C CB 1 +ATOM 4243 C CG . ASN C 3 130 ? 44.311 -41.822 16.008 1.00 77.22 ? 130 ASN C CG 1 +ATOM 4244 O OD1 . ASN C 3 130 ? 43.357 -41.049 16.079 1.00 89.03 ? 130 ASN C OD1 1 +ATOM 4245 N ND2 . ASN C 3 130 ? 44.572 -42.521 14.916 1.00 85.13 ? 130 ASN C ND2 1 +ATOM 4246 N N . HIS C 3 131 ? 43.487 -44.942 18.744 1.00 53.92 ? 131 HIS C N 1 +ATOM 4247 C CA . HIS C 3 131 ? 42.204 -45.368 19.274 1.00 51.54 ? 131 HIS C CA 1 +ATOM 4248 C C . HIS C 3 131 ? 42.405 -46.324 20.446 1.00 63.94 ? 131 HIS C C 1 +ATOM 4249 O O . HIS C 3 131 ? 41.484 -47.064 20.803 1.00 56.64 ? 131 HIS C O 1 +ATOM 4250 C CB . HIS C 3 131 ? 41.307 -45.920 18.160 1.00 60.58 ? 131 HIS C CB 1 +ATOM 4251 C CG . HIS C 3 131 ? 40.671 -44.870 17.313 1.00 64.39 ? 131 HIS C CG 1 +ATOM 4252 N ND1 . HIS C 3 131 ? 41.307 -44.323 16.213 1.00 61.58 ? 131 HIS C ND1 1 +ATOM 4253 C CD2 . HIS C 3 131 ? 39.462 -44.275 17.390 1.00 70.33 ? 131 HIS C CD2 1 +ATOM 4254 C CE1 . HIS C 3 131 ? 40.516 -43.429 15.652 1.00 76.60 ? 131 HIS C CE1 1 +ATOM 4255 N NE2 . HIS C 3 131 ? 39.377 -43.382 16.354 1.00 87.81 ? 131 HIS C NE2 1 +ATOM 4256 N N . LEU C 3 132 ? 43.602 -46.261 21.055 1.00 60.52 ? 132 LEU C N 1 +ATOM 4257 C CA . LEU C 3 132 ? 43.924 -47.058 22.228 1.00 67.09 ? 132 LEU C CA 1 +ATOM 4258 C C . LEU C 3 132 ? 43.915 -46.190 23.484 1.00 50.97 ? 132 LEU C C 1 +ATOM 4259 O O . LEU C 3 132 ? 44.589 -45.170 23.530 1.00 50.18 ? 132 LEU C O 1 +ATOM 4260 C CB . LEU C 3 132 ? 45.297 -47.713 22.040 1.00 74.53 ? 132 LEU C CB 1 +ATOM 4261 C CG . LEU C 3 132 ? 45.320 -49.038 21.278 1.00 70.54 ? 132 LEU C CG 1 +ATOM 4262 C CD1 . LEU C 3 132 ? 46.749 -49.410 20.903 1.00 55.28 ? 132 LEU C CD1 1 +ATOM 4263 C CD2 . LEU C 3 132 ? 44.675 -50.156 22.089 1.00 63.62 ? 132 LEU C CD2 1 +ATOM 4264 N N . THR C 3 133 ? 43.163 -46.623 24.504 1.00 54.15 ? 133 THR C N 1 +ATOM 4265 C CA . THR C 3 133 ? 43.248 -46.037 25.836 1.00 63.71 ? 133 THR C CA 1 +ATOM 4266 C C . THR C 3 133 ? 43.891 -47.044 26.783 1.00 66.95 ? 133 THR C C 1 +ATOM 4267 O O . THR C 3 133 ? 43.553 -48.230 26.750 1.00 69.66 ? 133 THR C O 1 +ATOM 4268 C CB . THR C 3 133 ? 41.889 -45.553 26.359 1.00 63.58 ? 133 THR C CB 1 +ATOM 4269 O OG1 . THR C 3 133 ? 40.996 -46.666 26.424 1.00 65.41 ? 133 THR C OG1 1 +ATOM 4270 C CG2 . THR C 3 133 ? 41.288 -44.448 25.516 1.00 67.81 ? 133 THR C CG2 1 +ATOM 4271 N N . TYR C 3 134 ? 44.806 -46.544 27.625 1.00 61.48 ? 134 TYR C N 1 +ATOM 4272 C CA . TYR C 3 134 ? 45.713 -47.391 28.386 1.00 66.80 ? 134 TYR C CA 1 +ATOM 4273 C C . TYR C 3 134 ? 45.306 -47.441 29.858 1.00 75.25 ? 134 TYR C C 1 +ATOM 4274 O O . TYR C 3 134 ? 44.793 -46.462 30.401 1.00 70.40 ? 134 TYR C O 1 +ATOM 4275 C CB . TYR C 3 134 ? 47.167 -46.941 28.201 1.00 61.28 ? 134 TYR C CB 1 +ATOM 4276 C CG . TYR C 3 134 ? 47.603 -46.743 26.768 1.00 71.22 ? 134 TYR C CG 1 +ATOM 4277 C CD1 . TYR C 3 134 ? 47.923 -47.821 25.950 1.00 67.12 ? 134 TYR C CD1 1 +ATOM 4278 C CD2 . TYR C 3 134 ? 47.702 -45.469 26.224 1.00 53.12 ? 134 TYR C CD2 1 +ATOM 4279 C CE1 . TYR C 3 134 ? 48.320 -47.640 24.632 1.00 51.32 ? 134 TYR C CE1 1 +ATOM 4280 C CE2 . TYR C 3 134 ? 48.096 -45.270 24.911 1.00 51.14 ? 134 TYR C CE2 1 +ATOM 4281 C CZ . TYR C 3 134 ? 48.405 -46.358 24.112 1.00 60.70 ? 134 TYR C CZ 1 +ATOM 4282 O OH . TYR C 3 134 ? 48.800 -46.155 22.820 1.00 68.74 ? 134 TYR C OH 1 +ATOM 4283 N N . ALA C 3 135 ? 45.548 -48.608 30.477 1.00 76.76 ? 135 ALA C N 1 +ATOM 4284 C CA . ALA C 3 135 ? 45.355 -48.844 31.901 1.00 80.28 ? 135 ALA C CA 1 +ATOM 4285 C C . ALA C 3 135 ? 46.681 -49.258 32.539 1.00 77.49 ? 135 ALA C C 1 +ATOM 4286 O O . ALA C 3 135 ? 47.371 -50.132 32.017 1.00 75.32 ? 135 ALA C O 1 +ATOM 4287 C CB . ALA C 3 135 ? 44.289 -49.893 32.108 1.00 76.53 ? 135 ALA C CB 1 +ATOM 4288 N N . VAL C 3 136 ? 47.017 -48.624 33.673 1.00 84.96 ? 136 VAL C N 1 +ATOM 4289 C CA . VAL C 3 136 ? 48.293 -48.801 34.360 1.00 76.27 ? 136 VAL C CA 1 +ATOM 4290 C C . VAL C 3 136 ? 48.032 -49.273 35.791 1.00 77.39 ? 136 VAL C C 1 +ATOM 4291 O O . VAL C 3 136 ? 47.376 -48.567 36.558 1.00 78.19 ? 136 VAL C O 1 +ATOM 4292 C CB . VAL C 3 136 ? 49.119 -47.496 34.353 1.00 65.60 ? 136 VAL C CB 1 +ATOM 4293 C CG1 . VAL C 3 136 ? 50.461 -47.652 35.061 1.00 54.40 ? 136 VAL C CG1 1 +ATOM 4294 C CG2 . VAL C 3 136 ? 49.304 -46.921 32.952 1.00 50.92 ? 136 VAL C CG2 1 +ATOM 4295 N N . ASN C 3 137 ? 48.579 -50.447 36.143 1.00 77.12 ? 137 ASN C N 1 +ATOM 4296 C CA . ASN C 3 137 ? 48.436 -51.016 37.478 1.00 89.48 ? 137 ASN C CA 1 +ATOM 4297 C C . ASN C 3 137 ? 49.726 -50.830 38.283 1.00 96.66 ? 137 ASN C C 1 +ATOM 4298 O O . ASN C 3 137 ? 50.820 -50.900 37.727 1.00 83.37 ? 137 ASN C O 1 +ATOM 4299 C CB . ASN C 3 137 ? 47.995 -52.482 37.431 1.00 83.37 ? 137 ASN C CB 1 +ATOM 4300 C CG . ASN C 3 137 ? 47.453 -52.970 38.758 1.00 103.31 ? 137 ASN C CG 1 +ATOM 4301 O OD1 . ASN C 3 137 ? 46.366 -52.573 39.175 1.00 141.49 ? 137 ASN C OD1 1 +ATOM 4302 N ND2 . ASN C 3 137 ? 48.199 -53.832 39.431 1.00 91.03 ? 137 ASN C ND2 1 +ATOM 4303 N N . ILE C 3 138 ? 49.580 -50.578 39.596 1.00 114.32 ? 138 ILE C N 1 +ATOM 4304 C CA . ILE C 3 138 ? 50.700 -50.478 40.527 1.00 111.11 ? 138 ILE C CA 1 +ATOM 4305 C C . ILE C 3 138 ? 50.417 -51.382 41.738 1.00 117.20 ? 138 ILE C C 1 +ATOM 4306 O O . ILE C 3 138 ? 51.329 -51.900 42.406 1.00 90.27 ? 138 ILE C O 1 +ATOM 4307 C CB . ILE C 3 138 ? 50.975 -49.019 40.963 1.00 106.09 ? 138 ILE C CB 1 +ATOM 4308 C CG1 . ILE C 3 138 ? 50.765 -47.981 39.850 1.00 84.19 ? 138 ILE C CG1 1 +ATOM 4309 C CG2 . ILE C 3 138 ? 52.350 -48.900 41.617 1.00 106.12 ? 138 ILE C CG2 1 +ATOM 4310 C CD1 . ILE C 3 138 ? 51.914 -47.837 38.867 1.00 78.82 ? 138 ILE C CD1 1 +ATOM 4311 N N . PRO C 3 144 ? 55.418 -56.089 47.088 1.00 91.76 ? 144 PRO C N 1 +ATOM 4312 C CA . PRO C 3 144 ? 54.062 -55.636 46.730 1.00 107.85 ? 144 PRO C CA 1 +ATOM 4313 C C . PRO C 3 144 ? 52.994 -56.248 47.641 1.00 102.51 ? 144 PRO C C 1 +ATOM 4314 O O . PRO C 3 144 ? 53.325 -57.043 48.524 1.00 96.72 ? 144 PRO C O 1 +ATOM 4315 C CB . PRO C 3 144 ? 53.917 -56.073 45.264 1.00 106.43 ? 144 PRO C CB 1 +ATOM 4316 C CG . PRO C 3 144 ? 55.330 -55.997 44.733 1.00 87.62 ? 144 PRO C CG 1 +ATOM 4317 C CD . PRO C 3 144 ? 56.189 -56.458 45.892 1.00 80.64 ? 144 PRO C CD 1 +ATOM 4318 N N . ALA C 3 145 ? 51.726 -55.842 47.435 1.00 83.30 ? 145 ALA C N 1 +ATOM 4319 C CA . ALA C 3 145 ? 50.582 -56.273 48.236 1.00 96.87 ? 145 ALA C CA 1 +ATOM 4320 C C . ALA C 3 145 ? 49.264 -55.951 47.525 1.00 83.71 ? 145 ALA C C 1 +ATOM 4321 O O . ALA C 3 145 ? 48.746 -56.798 46.801 1.00 83.93 ? 145 ALA C O 1 +ATOM 4322 C CB . ALA C 3 145 ? 50.641 -55.696 49.638 1.00 107.75 ? 145 ALA C CB 1 +ATOM 4323 N N . ASP C 3 146 ? 48.717 -54.745 47.763 1.00 91.31 ? 146 ASP C N 1 +ATOM 4324 C CA . ASP C 3 146 ? 47.566 -54.207 47.045 1.00 103.15 ? 146 ASP C CA 1 +ATOM 4325 C C . ASP C 3 146 ? 48.028 -53.117 46.073 1.00 119.73 ? 146 ASP C C 1 +ATOM 4326 O O . ASP C 3 146 ? 49.134 -52.593 46.205 1.00 113.60 ? 146 ASP C O 1 +ATOM 4327 C CB . ASP C 3 146 ? 46.476 -53.716 48.003 1.00 84.20 ? 146 ASP C CB 1 +ATOM 4328 N N . PHE C 3 147 ? 47.163 -52.776 45.104 1.00 137.21 ? 147 PHE C N 1 +ATOM 4329 C CA . PHE C 3 147 ? 47.542 -51.939 43.972 1.00 134.77 ? 147 PHE C CA 1 +ATOM 4330 C C . PHE C 3 147 ? 46.676 -50.679 43.877 1.00 125.48 ? 147 PHE C C 1 +ATOM 4331 O O . PHE C 3 147 ? 45.984 -50.323 44.831 1.00 112.99 ? 147 PHE C O 1 +ATOM 4332 C CB . PHE C 3 147 ? 47.534 -52.754 42.672 1.00 126.26 ? 147 PHE C CB 1 +ATOM 4333 C CG . PHE C 3 147 ? 46.275 -53.523 42.348 1.00 135.05 ? 147 PHE C CG 1 +ATOM 4334 C CD1 . PHE C 3 147 ? 45.050 -52.880 42.192 1.00 124.20 ? 147 PHE C CD1 1 +ATOM 4335 C CD2 . PHE C 3 147 ? 46.327 -54.898 42.147 1.00 141.70 ? 147 PHE C CD2 1 +ATOM 4336 C CE1 . PHE C 3 147 ? 43.904 -53.598 41.876 1.00 130.31 ? 147 PHE C CE1 1 +ATOM 4337 C CE2 . PHE C 3 147 ? 45.181 -55.616 41.828 1.00 136.75 ? 147 PHE C CE2 1 +ATOM 4338 C CZ . PHE C 3 147 ? 43.972 -54.964 41.691 1.00 138.36 ? 147 PHE C CZ 1 +ATOM 4339 N N . ARG C 3 148 ? 46.759 -50.009 42.714 1.00 105.82 ? 148 ARG C N 1 +ATOM 4340 C CA . ARG C 3 148 ? 45.931 -48.877 42.313 1.00 90.15 ? 148 ARG C CA 1 +ATOM 4341 C C . ARG C 3 148 ? 46.116 -48.653 40.813 1.00 82.43 ? 148 ARG C C 1 +ATOM 4342 O O . ARG C 3 148 ? 47.255 -48.647 40.346 1.00 77.49 ? 148 ARG C O 1 +ATOM 4343 C CB . ARG C 3 148 ? 46.323 -47.606 43.078 1.00 80.65 ? 148 ARG C CB 1 +ATOM 4344 N N . ILE C 3 149 ? 44.994 -48.467 40.087 1.00 87.08 ? 149 ILE C N 1 +ATOM 4345 C CA . ILE C 3 149 ? 44.950 -48.293 38.634 1.00 82.15 ? 149 ILE C CA 1 +ATOM 4346 C C . ILE C 3 149 ? 45.057 -46.811 38.263 1.00 98.65 ? 149 ILE C C 1 +ATOM 4347 O O . ILE C 3 149 ? 44.856 -45.938 39.106 1.00 146.50 ? 149 ILE C O 1 +ATOM 4348 C CB . ILE C 3 149 ? 43.695 -48.930 37.985 1.00 78.54 ? 149 ILE C CB 1 +ATOM 4349 C CG1 . ILE C 3 149 ? 42.384 -48.406 38.590 1.00 98.13 ? 149 ILE C CG1 1 +ATOM 4350 C CG2 . ILE C 3 149 ? 43.775 -50.452 37.998 1.00 60.49 ? 149 ILE C CG2 1 +ATOM 4351 C CD1 . ILE C 3 149 ? 41.325 -48.003 37.576 1.00 74.84 ? 149 ILE C CD1 1 +ATOM 4352 N N . TYR C 3 150 ? 45.363 -46.550 36.982 1.00 100.19 ? 150 TYR C N 1 +ATOM 4353 C CA . TYR C 3 150 ? 45.427 -45.215 36.405 1.00 88.58 ? 150 TYR C CA 1 +ATOM 4354 C C . TYR C 3 150 ? 45.053 -45.279 34.924 1.00 93.81 ? 150 TYR C C 1 +ATOM 4355 O O . TYR C 3 150 ? 45.819 -45.800 34.112 1.00 100.86 ? 150 TYR C O 1 +ATOM 4356 C CB . TYR C 3 150 ? 46.846 -44.647 36.499 1.00 92.71 ? 150 TYR C CB 1 +ATOM 4357 C CG . TYR C 3 150 ? 47.368 -44.307 37.872 1.00 87.00 ? 150 TYR C CG 1 +ATOM 4358 C CD1 . TYR C 3 150 ? 47.144 -43.057 38.432 1.00 89.14 ? 150 TYR C CD1 1 +ATOM 4359 C CD2 . TYR C 3 150 ? 48.137 -45.212 38.591 1.00 89.00 ? 150 TYR C CD2 1 +ATOM 4360 C CE1 . TYR C 3 150 ? 47.646 -42.726 39.682 1.00 105.53 ? 150 TYR C CE1 1 +ATOM 4361 C CE2 . TYR C 3 150 ? 48.645 -44.899 39.843 1.00 96.58 ? 150 TYR C CE2 1 +ATOM 4362 C CZ . TYR C 3 150 ? 48.398 -43.650 40.389 1.00 111.01 ? 150 TYR C CZ 1 +ATOM 4363 O OH . TYR C 3 150 ? 48.888 -43.327 41.621 1.00 118.97 ? 150 TYR C OH 1 +ATOM 4364 N N . ASN C 3 151 ? 43.882 -44.725 34.581 1.00 88.34 ? 151 ASN C N 1 +ATOM 4365 C CA . ASN C 3 151 ? 43.366 -44.713 33.220 1.00 58.67 ? 151 ASN C CA 1 +ATOM 4366 C C . ASN C 3 151 ? 43.966 -43.535 32.451 1.00 71.81 ? 151 ASN C C 1 +ATOM 4367 O O . ASN C 3 151 ? 43.620 -42.382 32.707 1.00 81.59 ? 151 ASN C O 1 +ATOM 4368 C CB . ASN C 3 151 ? 41.832 -44.699 33.201 1.00 56.85 ? 151 ASN C CB 1 +ATOM 4369 C CG . ASN C 3 151 ? 41.192 -45.902 33.869 1.00 70.55 ? 151 ASN C CG 1 +ATOM 4370 O OD1 . ASN C 3 151 ? 41.822 -46.950 33.989 1.00 81.67 ? 151 ASN C OD1 1 +ATOM 4371 N ND2 . ASN C 3 151 ? 39.940 -45.775 34.294 1.00 62.22 ? 151 ASN C ND2 1 +ATOM 4372 N N . VAL C 3 152 ? 44.876 -43.839 31.514 1.00 65.98 ? 152 VAL C N 1 +ATOM 4373 C CA . VAL C 3 152 ? 45.417 -42.855 30.585 1.00 61.58 ? 152 VAL C CA 1 +ATOM 4374 C C . VAL C 3 152 ? 44.520 -42.835 29.348 1.00 66.28 ? 152 VAL C C 1 +ATOM 4375 O O . VAL C 3 152 ? 44.311 -43.876 28.725 1.00 85.46 ? 152 VAL C O 1 +ATOM 4376 C CB . VAL C 3 152 ? 46.889 -43.165 30.230 1.00 62.66 ? 152 VAL C CB 1 +ATOM 4377 C CG1 . VAL C 3 152 ? 47.448 -42.256 29.140 1.00 60.05 ? 152 VAL C CG1 1 +ATOM 4378 C CG2 . VAL C 3 152 ? 47.788 -43.121 31.454 1.00 74.27 ? 152 VAL C CG2 1 +ATOM 4379 N N . THR C 3 153 ? 43.989 -41.650 29.005 1.00 64.44 ? 153 THR C N 1 +ATOM 4380 C CA . THR C 3 153 ? 43.081 -41.517 27.870 1.00 48.43 ? 153 THR C CA 1 +ATOM 4381 C C . THR C 3 153 ? 43.483 -40.358 26.959 1.00 44.50 ? 153 THR C C 1 +ATOM 4382 O O . THR C 3 153 ? 42.627 -39.738 26.325 1.00 55.78 ? 153 THR C O 1 +ATOM 4383 C CB . THR C 3 153 ? 41.612 -41.381 28.299 1.00 45.92 ? 153 THR C CB 1 +ATOM 4384 O OG1 . THR C 3 153 ? 41.402 -40.042 28.747 1.00 57.14 ? 153 THR C OG1 1 +ATOM 4385 C CG2 . THR C 3 153 ? 41.167 -42.390 29.341 1.00 44.48 ? 153 THR C CG2 1 +ATOM 4386 N N . TYR C 3 154 ? 44.784 -40.065 26.908 1.00 39.23 ? 154 TYR C N 1 +ATOM 4387 C CA . TYR C 3 154 ? 45.320 -39.168 25.897 1.00 48.57 ? 154 TYR C CA 1 +ATOM 4388 C C . TYR C 3 154 ? 46.300 -39.967 25.056 1.00 58.45 ? 154 TYR C C 1 +ATOM 4389 O O . TYR C 3 154 ? 46.729 -41.040 25.480 1.00 64.80 ? 154 TYR C O 1 +ATOM 4390 C CB . TYR C 3 154 ? 45.960 -37.920 26.508 1.00 52.46 ? 154 TYR C CB 1 +ATOM 4391 C CG . TYR C 3 154 ? 46.799 -38.185 27.730 1.00 58.47 ? 154 TYR C CG 1 +ATOM 4392 C CD1 . TYR C 3 154 ? 48.138 -38.526 27.613 1.00 59.20 ? 154 TYR C CD1 1 +ATOM 4393 C CD2 . TYR C 3 154 ? 46.248 -38.116 28.999 1.00 48.33 ? 154 TYR C CD2 1 +ATOM 4394 C CE1 . TYR C 3 154 ? 48.913 -38.791 28.730 1.00 54.18 ? 154 TYR C CE1 1 +ATOM 4395 C CE2 . TYR C 3 154 ? 47.007 -38.390 30.124 1.00 47.83 ? 154 TYR C CE2 1 +ATOM 4396 C CZ . TYR C 3 154 ? 48.344 -38.720 29.989 1.00 47.33 ? 154 TYR C CZ 1 +ATOM 4397 O OH . TYR C 3 154 ? 49.101 -38.979 31.094 1.00 67.10 ? 154 TYR C OH 1 +ATOM 4398 N N . LEU C 3 155 ? 46.641 -39.420 23.883 1.00 71.96 ? 155 LEU C N 1 +ATOM 4399 C CA . LEU C 3 155 ? 47.337 -40.156 22.839 1.00 58.43 ? 155 LEU C CA 1 +ATOM 4400 C C . LEU C 3 155 ? 48.769 -40.491 23.259 1.00 59.00 ? 155 LEU C C 1 +ATOM 4401 O O . LEU C 3 155 ? 49.290 -41.534 22.863 1.00 55.70 ? 155 LEU C O 1 +ATOM 4402 C CB . LEU C 3 155 ? 47.277 -39.366 21.525 1.00 60.49 ? 155 LEU C CB 1 +ATOM 4403 C CG . LEU C 3 155 ? 45.895 -39.227 20.873 1.00 68.78 ? 155 LEU C CG 1 +ATOM 4404 C CD1 . LEU C 3 155 ? 46.000 -38.558 19.508 1.00 72.59 ? 155 LEU C CD1 1 +ATOM 4405 C CD2 . LEU C 3 155 ? 45.186 -40.569 20.734 1.00 61.00 ? 155 LEU C CD2 1 +ATOM 4406 N N . GLU C 3 156 ? 49.367 -39.618 24.087 1.00 64.77 ? 156 GLU C N 1 +ATOM 4407 C CA . GLU C 3 156 ? 50.704 -39.780 24.645 1.00 65.85 ? 156 GLU C CA 1 +ATOM 4408 C C . GLU C 3 156 ? 50.778 -41.031 25.531 1.00 67.06 ? 156 GLU C C 1 +ATOM 4409 O O . GLU C 3 156 ? 49.961 -41.208 26.434 1.00 76.24 ? 156 GLU C O 1 +ATOM 4410 C CB . GLU C 3 156 ? 51.105 -38.501 25.385 1.00 72.83 ? 156 GLU C CB 1 +ATOM 4411 C CG . GLU C 3 156 ? 52.299 -38.657 26.319 1.00 87.72 ? 156 GLU C CG 1 +ATOM 4412 C CD . GLU C 3 156 ? 53.674 -38.822 25.689 1.00 99.90 ? 156 GLU C CD 1 +ATOM 4413 O OE1 . GLU C 3 156 ? 53.795 -38.660 24.458 1.00 146.23 ? 156 GLU C OE1 1 +ATOM 4414 O OE2 . GLU C 3 156 ? 54.628 -39.107 26.435 1.00 93.40 ? 156 GLU C OE2 1 +ATOM 4415 N N . PRO C 3 157 ? 51.732 -41.960 25.275 1.00 68.97 ? 157 PRO C N 1 +ATOM 4416 C CA . PRO C 3 157 ? 51.930 -43.132 26.133 1.00 69.68 ? 157 PRO C CA 1 +ATOM 4417 C C . PRO C 3 157 ? 52.890 -42.899 27.301 1.00 79.20 ? 157 PRO C C 1 +ATOM 4418 O O . PRO C 3 157 ? 53.955 -43.516 27.375 1.00 71.05 ? 157 PRO C O 1 +ATOM 4419 C CB . PRO C 3 157 ? 52.471 -44.184 25.148 1.00 66.10 ? 157 PRO C CB 1 +ATOM 4420 C CG . PRO C 3 157 ? 53.177 -43.393 24.054 1.00 61.74 ? 157 PRO C CG 1 +ATOM 4421 C CD . PRO C 3 157 ? 52.603 -41.990 24.087 1.00 69.54 ? 157 PRO C CD 1 +ATOM 4422 N N . SER C 3 158 ? 52.485 -42.005 28.215 1.00 79.66 ? 158 SER C N 1 +ATOM 4423 C CA . SER C 3 158 ? 53.236 -41.717 29.428 1.00 65.75 ? 158 SER C CA 1 +ATOM 4424 C C . SER C 3 158 ? 52.305 -41.559 30.630 1.00 77.45 ? 158 SER C C 1 +ATOM 4425 O O . SER C 3 158 ? 51.082 -41.546 30.485 1.00 94.01 ? 158 SER C O 1 +ATOM 4426 C CB . SER C 3 158 ? 54.136 -40.516 29.254 1.00 62.77 ? 158 SER C CB 1 +ATOM 4427 O OG . SER C 3 158 ? 53.483 -39.312 29.637 1.00 63.33 ? 158 SER C OG 1 +ATOM 4428 N N . LEU C 3 159 ? 52.921 -41.452 31.817 1.00 82.20 ? 159 LEU C N 1 +ATOM 4429 C CA . LEU C 3 159 ? 52.255 -41.159 33.077 1.00 79.60 ? 159 LEU C CA 1 +ATOM 4430 C C . LEU C 3 159 ? 53.276 -40.536 34.028 1.00 92.33 ? 159 LEU C C 1 +ATOM 4431 O O . LEU C 3 159 ? 54.443 -40.926 34.008 1.00 103.61 ? 159 LEU C O 1 +ATOM 4432 C CB . LEU C 3 159 ? 51.672 -42.460 33.645 1.00 57.85 ? 159 LEU C CB 1 +ATOM 4433 C CG . LEU C 3 159 ? 50.701 -42.344 34.826 1.00 59.34 ? 159 LEU C CG 1 +ATOM 4434 C CD1 . LEU C 3 159 ? 49.609 -41.299 34.596 1.00 45.54 ? 159 LEU C CD1 1 +ATOM 4435 C CD2 . LEU C 3 159 ? 50.076 -43.698 35.137 1.00 51.00 ? 159 LEU C CD2 1 +ATOM 4436 N N . ARG C 3 160 ? 52.815 -39.579 34.850 1.00 105.21 ? 160 ARG C N 1 +ATOM 4437 C CA . ARG C 3 160 ? 53.646 -38.822 35.780 1.00 88.13 ? 160 ARG C CA 1 +ATOM 4438 C C . ARG C 3 160 ? 52.955 -38.722 37.144 1.00 93.87 ? 160 ARG C C 1 +ATOM 4439 O O . ARG C 3 160 ? 51.731 -38.587 37.205 1.00 80.38 ? 160 ARG C O 1 +ATOM 4440 C CB . ARG C 3 160 ? 53.925 -37.430 35.200 1.00 73.84 ? 160 ARG C CB 1 +ATOM 4441 C CG . ARG C 3 160 ? 55.029 -37.382 34.151 1.00 81.08 ? 160 ARG C CG 1 +ATOM 4442 C CD . ARG C 3 160 ? 54.751 -36.475 32.962 1.00 87.51 ? 160 ARG C CD 1 +ATOM 4443 N N . ILE C 3 161 ? 53.745 -38.809 38.234 1.00 117.32 ? 161 ILE C N 1 +ATOM 4444 C CA . ILE C 3 161 ? 53.273 -38.589 39.602 1.00 129.26 ? 161 ILE C CA 1 +ATOM 4445 C C . ILE C 3 161 ? 54.430 -38.159 40.511 1.00 137.14 ? 161 ILE C C 1 +ATOM 4446 O O . ILE C 3 161 ? 55.576 -38.063 40.069 1.00 148.02 ? 161 ILE C O 1 +ATOM 4447 C CB . ILE C 3 161 ? 52.532 -39.811 40.198 1.00 97.13 ? 161 ILE C CB 1 +ATOM 4448 C CG1 . ILE C 3 161 ? 52.484 -41.026 39.266 1.00 88.77 ? 161 ILE C CG1 1 +ATOM 4449 C CG2 . ILE C 3 161 ? 51.152 -39.409 40.708 1.00 76.67 ? 161 ILE C CG2 1 +ATOM 4450 C CD1 . ILE C 3 161 ? 52.934 -42.312 39.915 1.00 89.43 ? 161 ILE C CD1 1 +ATOM 4451 N N . ALA C 3 162 ? 54.107 -37.909 41.793 1.00 112.03 ? 162 ALA C N 1 +ATOM 4452 C CA . ALA C 3 162 ? 55.078 -37.609 42.838 1.00 119.22 ? 162 ALA C CA 1 +ATOM 4453 C C . ALA C 3 162 ? 54.739 -38.372 44.121 1.00 135.28 ? 162 ALA C C 1 +ATOM 4454 O O . ALA C 3 162 ? 53.567 -38.618 44.407 1.00 156.16 ? 162 ALA C O 1 +ATOM 4455 C CB . ALA C 3 162 ? 55.118 -36.121 43.080 1.00 102.42 ? 162 ALA C CB 1 +ATOM 4456 N N . ALA C 3 163 ? 55.788 -38.726 44.885 1.00 125.67 ? 163 ALA C N 1 +ATOM 4457 C CA . ALA C 3 163 ? 55.717 -39.403 46.177 1.00 112.03 ? 163 ALA C CA 1 +ATOM 4458 C C . ALA C 3 163 ? 55.135 -40.814 46.025 1.00 108.03 ? 163 ALA C C 1 +ATOM 4459 O O . ALA C 3 163 ? 55.771 -41.801 46.404 1.00 79.92 ? 163 ALA C O 1 +ATOM 4460 C CB . ALA C 3 163 ? 54.953 -38.581 47.195 1.00 88.13 ? 163 ALA C CB 1 +ATOM 4461 N N . ARG C 3 173 ? 53.180 -55.236 41.693 1.00 112.93 ? 173 ARG C N 1 +ATOM 4462 C CA . ARG C 3 173 ? 53.657 -55.230 40.306 1.00 118.09 ? 173 ARG C CA 1 +ATOM 4463 C C . ARG C 3 173 ? 53.194 -53.948 39.614 1.00 135.70 ? 173 ARG C C 1 +ATOM 4464 O O . ARG C 3 173 ? 52.184 -53.370 40.009 1.00 133.00 ? 173 ARG C O 1 +ATOM 4465 C CB . ARG C 3 173 ? 53.157 -56.478 39.570 1.00 88.64 ? 173 ARG C CB 1 +ATOM 4466 N N . ALA C 3 174 ? 53.940 -53.524 38.580 1.00 150.26 ? 174 ALA C N 1 +ATOM 4467 C CA . ALA C 3 174 ? 53.627 -52.336 37.795 1.00 117.28 ? 174 ALA C CA 1 +ATOM 4468 C C . ALA C 3 174 ? 53.647 -52.654 36.297 1.00 113.54 ? 174 ALA C C 1 +ATOM 4469 O O . ALA C 3 174 ? 54.718 -52.806 35.711 1.00 112.76 ? 174 ALA C O 1 +ATOM 4470 C CB . ALA C 3 174 ? 54.579 -51.217 38.146 1.00 82.36 ? 174 ALA C CB 1 +ATOM 4471 N N . ARG C 3 175 ? 52.451 -52.719 35.689 1.00 100.47 ? 175 ARG C N 1 +ATOM 4472 C CA . ARG C 3 175 ? 52.264 -53.150 34.309 1.00 94.34 ? 175 ARG C CA 1 +ATOM 4473 C C . ARG C 3 175 ? 51.235 -52.261 33.606 1.00 89.40 ? 175 ARG C C 1 +ATOM 4474 O O . ARG C 3 175 ? 50.493 -51.534 34.264 1.00 106.29 ? 175 ARG C O 1 +ATOM 4475 C CB . ARG C 3 175 ? 51.830 -54.620 34.282 1.00 94.02 ? 175 ARG C CB 1 +ATOM 4476 N N . VAL C 3 176 ? 51.184 -52.352 32.265 1.00 79.79 ? 176 VAL C N 1 +ATOM 4477 C CA . VAL C 3 176 ? 50.279 -51.560 31.438 1.00 84.97 ? 176 VAL C CA 1 +ATOM 4478 C C . VAL C 3 176 ? 49.547 -52.454 30.427 1.00 77.17 ? 176 VAL C C 1 +ATOM 4479 O O . VAL C 3 176 ? 50.113 -53.428 29.935 1.00 81.35 ? 176 VAL C O 1 +ATOM 4480 C CB . VAL C 3 176 ? 51.011 -50.361 30.789 1.00 74.22 ? 176 VAL C CB 1 +ATOM 4481 C CG1 . VAL C 3 176 ? 52.174 -50.772 29.904 1.00 82.03 ? 176 VAL C CG1 1 +ATOM 4482 C CG2 . VAL C 3 176 ? 50.082 -49.415 30.040 1.00 58.88 ? 176 VAL C CG2 1 +ATOM 4483 N N . ARG C 3 177 ? 48.277 -52.108 30.139 1.00 72.99 ? 177 ARG C N 1 +ATOM 4484 C CA . ARG C 3 177 ? 47.439 -52.757 29.133 1.00 69.28 ? 177 ARG C CA 1 +ATOM 4485 C C . ARG C 3 177 ? 46.680 -51.723 28.289 1.00 68.46 ? 177 ARG C C 1 +ATOM 4486 O O . ARG C 3 177 ? 46.888 -50.520 28.434 1.00 69.54 ? 177 ARG C O 1 +ATOM 4487 C CB . ARG C 3 177 ? 46.535 -53.815 29.776 1.00 75.26 ? 177 ARG C CB 1 +ATOM 4488 C CG . ARG C 3 177 ? 45.404 -53.276 30.640 1.00 77.14 ? 177 ARG C CG 1 +ATOM 4489 C CD . ARG C 3 177 ? 44.527 -54.444 31.040 1.00 78.20 ? 177 ARG C CD 1 +ATOM 4490 N NE . ARG C 3 177 ? 43.335 -54.054 31.780 1.00 82.49 ? 177 ARG C NE 1 +ATOM 4491 C CZ . ARG C 3 177 ? 42.383 -54.891 32.184 1.00 88.96 ? 177 ARG C CZ 1 +ATOM 4492 N NH1 . ARG C 3 177 ? 42.483 -56.188 31.944 1.00 74.63 ? 177 ARG C NH1 1 +ATOM 4493 N NH2 . ARG C 3 177 ? 41.324 -54.422 32.820 1.00 94.64 ? 177 ARG C NH2 1 +ATOM 4494 N N . ALA C 3 178 ? 45.796 -52.200 27.397 1.00 68.69 ? 178 ALA C N 1 +ATOM 4495 C CA . ALA C 3 178 ? 45.249 -51.372 26.328 1.00 56.63 ? 178 ALA C CA 1 +ATOM 4496 C C . ALA C 3 178 ? 43.822 -51.784 25.961 1.00 62.50 ? 178 ALA C C 1 +ATOM 4497 O O . ALA C 3 178 ? 43.504 -52.971 25.867 1.00 66.10 ? 178 ALA C O 1 +ATOM 4498 C CB . ALA C 3 178 ? 46.164 -51.436 25.128 1.00 49.58 ? 178 ALA C CB 1 +ATOM 4499 N N . TRP C 3 179 ? 42.972 -50.773 25.736 1.00 57.26 ? 179 TRP C N 1 +ATOM 4500 C CA . TRP C 3 179 ? 41.621 -50.955 25.225 1.00 52.49 ? 179 TRP C CA 1 +ATOM 4501 C C . TRP C 3 179 ? 41.472 -50.174 23.919 1.00 54.91 ? 179 TRP C C 1 +ATOM 4502 O O . TRP C 3 179 ? 42.168 -49.185 23.686 1.00 49.99 ? 179 TRP C O 1 +ATOM 4503 C CB . TRP C 3 179 ? 40.589 -50.524 26.280 1.00 62.77 ? 179 TRP C CB 1 +ATOM 4504 C CG . TRP C 3 179 ? 39.145 -50.715 25.913 1.00 63.01 ? 179 TRP C CG 1 +ATOM 4505 C CD1 . TRP C 3 179 ? 38.367 -49.856 25.192 1.00 64.00 ? 179 TRP C CD1 1 +ATOM 4506 C CD2 . TRP C 3 179 ? 38.285 -51.813 26.280 1.00 67.23 ? 179 TRP C CD2 1 +ATOM 4507 N NE1 . TRP C 3 179 ? 37.093 -50.345 25.071 1.00 77.32 ? 179 TRP C NE1 1 +ATOM 4508 C CE2 . TRP C 3 179 ? 37.011 -51.546 25.723 1.00 59.51 ? 179 TRP C CE2 1 +ATOM 4509 C CE3 . TRP C 3 179 ? 38.460 -52.997 27.013 1.00 78.68 ? 179 TRP C CE3 1 +ATOM 4510 C CZ2 . TRP C 3 179 ? 35.926 -52.414 25.881 1.00 58.65 ? 179 TRP C CZ2 1 +ATOM 4511 C CZ3 . TRP C 3 179 ? 37.391 -53.859 27.163 1.00 82.79 ? 179 TRP C CZ3 1 +ATOM 4512 C CH2 . TRP C 3 179 ? 36.141 -53.571 26.602 1.00 64.67 ? 179 TRP C CH2 1 +ATOM 4513 N N . ALA C 3 180 ? 40.552 -50.631 23.070 1.00 49.33 ? 180 ALA C N 1 +ATOM 4514 C CA . ALA C 3 180 ? 40.323 -49.986 21.791 1.00 55.43 ? 180 ALA C CA 1 +ATOM 4515 C C . ALA C 3 180 ? 38.885 -49.475 21.696 1.00 60.28 ? 180 ALA C C 1 +ATOM 4516 O O . ALA C 3 180 ? 37.948 -50.119 22.168 1.00 50.76 ? 180 ALA C O 1 +ATOM 4517 C CB . ALA C 3 180 ? 40.675 -50.933 20.673 1.00 51.32 ? 180 ALA C CB 1 +ATOM 4518 N N . GLN C 3 181 ? 38.738 -48.308 21.061 1.00 56.99 ? 181 GLN C N 1 +ATOM 4519 C CA . GLN C 3 181 ? 37.458 -47.658 20.819 1.00 55.87 ? 181 GLN C CA 1 +ATOM 4520 C C . GLN C 3 181 ? 36.645 -48.473 19.809 1.00 55.36 ? 181 GLN C C 1 +ATOM 4521 O O . GLN C 3 181 ? 36.484 -48.060 18.663 1.00 73.22 ? 181 GLN C O 1 +ATOM 4522 C CB . GLN C 3 181 ? 37.738 -46.232 20.334 1.00 51.50 ? 181 GLN C CB 1 +ATOM 4523 C CG . GLN C 3 181 ? 36.535 -45.303 20.330 1.00 54.01 ? 181 GLN C CG 1 +ATOM 4524 C CD . GLN C 3 181 ? 36.966 -43.862 20.195 1.00 73.30 ? 181 GLN C CD 1 +ATOM 4525 O OE1 . GLN C 3 181 ? 37.473 -43.256 21.138 1.00 81.06 ? 181 GLN C OE1 1 +ATOM 4526 N NE2 . GLN C 3 181 ? 36.755 -43.293 19.017 1.00 66.49 ? 181 GLN C NE2 1 +ATOM 4527 N N . LEU C 3 182 ? 36.142 -49.639 20.238 1.00 46.06 ? 182 LEU C N 1 +ATOM 4528 C CA . LEU C 3 182 ? 35.356 -50.517 19.379 1.00 57.73 ? 182 LEU C CA 1 +ATOM 4529 C C . LEU C 3 182 ? 34.206 -51.124 20.182 1.00 73.51 ? 182 LEU C C 1 +ATOM 4530 O O . LEU C 3 182 ? 34.038 -50.813 21.360 1.00 79.66 ? 182 LEU C O 1 +ATOM 4531 C CB . LEU C 3 182 ? 36.249 -51.614 18.776 1.00 47.19 ? 182 LEU C CB 1 +ATOM 4532 C CG . LEU C 3 182 ? 37.373 -51.151 17.846 1.00 50.12 ? 182 LEU C CG 1 +ATOM 4533 C CD1 . LEU C 3 182 ? 38.513 -52.150 17.845 1.00 50.30 ? 182 LEU C CD1 1 +ATOM 4534 C CD2 . LEU C 3 182 ? 36.879 -50.893 16.426 1.00 54.36 ? 182 LEU C CD2 1 +ATOM 4535 N N . TYR C 3 183 ? 33.428 -52.002 19.535 1.00 88.22 ? 183 TYR C N 1 +ATOM 4536 C CA . TYR C 3 183 ? 32.268 -52.609 20.170 1.00 88.52 ? 183 TYR C CA 1 +ATOM 4537 C C . TYR C 3 183 ? 32.608 -54.008 20.681 1.00 98.65 ? 183 TYR C C 1 +ATOM 4538 O O . TYR C 3 183 ? 32.724 -54.206 21.890 1.00 102.69 ? 183 TYR C O 1 +ATOM 4539 C CB . TYR C 3 183 ? 31.010 -52.424 19.310 1.00 81.94 ? 183 TYR C CB 1 +ATOM 4540 C CG . TYR C 3 183 ? 30.260 -51.139 19.573 1.00 93.76 ? 183 TYR C CG 1 +ATOM 4541 C CD1 . TYR C 3 183 ? 30.895 -50.037 20.142 1.00 101.40 ? 183 TYR C CD1 1 +ATOM 4542 C CD2 . TYR C 3 183 ? 28.916 -51.010 19.247 1.00 80.75 ? 183 TYR C CD2 1 +ATOM 4543 C CE1 . TYR C 3 183 ? 30.223 -48.851 20.395 1.00 89.07 ? 183 TYR C CE1 1 +ATOM 4544 C CE2 . TYR C 3 183 ? 28.230 -49.826 19.483 1.00 92.26 ? 183 TYR C CE2 1 +ATOM 4545 C CZ . TYR C 3 183 ? 28.884 -48.745 20.059 1.00 92.15 ? 183 TYR C CZ 1 +ATOM 4546 O OH . TYR C 3 183 ? 28.224 -47.576 20.307 1.00 86.17 ? 183 TYR C OH 1 +ATOM 4547 N N . ASN C 3 184 ? 32.792 -54.961 19.760 1.00 92.39 ? 184 ASN C N 1 +ATOM 4548 C CA . ASN C 3 184 ? 33.146 -56.318 20.138 1.00 89.58 ? 184 ASN C CA 1 +ATOM 4549 C C . ASN C 3 184 ? 34.655 -56.368 20.373 1.00 85.82 ? 184 ASN C C 1 +ATOM 4550 O O . ASN C 3 184 ? 35.405 -56.868 19.534 1.00 94.54 ? 184 ASN C O 1 +ATOM 4551 C CB . ASN C 3 184 ? 32.638 -57.355 19.127 1.00 118.44 ? 184 ASN C CB 1 +ATOM 4552 C CG . ASN C 3 184 ? 31.185 -57.199 18.715 1.00 132.63 ? 184 ASN C CG 1 +ATOM 4553 O OD1 . ASN C 3 184 ? 30.348 -56.751 19.502 1.00 128.19 ? 184 ASN C OD1 1 +ATOM 4554 N ND2 . ASN C 3 184 ? 30.885 -57.574 17.476 1.00 152.50 ? 184 ASN C ND2 1 +ATOM 4555 N N . THR C 3 185 ? 35.081 -55.810 21.516 1.00 65.43 ? 185 THR C N 1 +ATOM 4556 C CA . THR C 3 185 ? 36.490 -55.707 21.877 1.00 52.32 ? 185 THR C CA 1 +ATOM 4557 C C . THR C 3 185 ? 36.727 -56.326 23.250 1.00 55.18 ? 185 THR C C 1 +ATOM 4558 O O . THR C 3 185 ? 35.779 -56.653 23.959 1.00 64.68 ? 185 THR C O 1 +ATOM 4559 C CB . THR C 3 185 ? 37.040 -54.275 21.759 1.00 73.05 ? 185 THR C CB 1 +ATOM 4560 O OG1 . THR C 3 185 ? 38.353 -54.233 22.323 1.00 82.02 ? 185 THR C OG1 1 +ATOM 4561 C CG2 . THR C 3 185 ? 36.181 -53.226 22.435 1.00 86.88 ? 185 THR C CG2 1 +ATOM 4562 N N . THR C 3 186 ? 38.010 -56.505 23.583 1.00 55.97 ? 186 THR C N 1 +ATOM 4563 C CA . THR C 3 186 ? 38.452 -56.979 24.885 1.00 64.93 ? 186 THR C CA 1 +ATOM 4564 C C . THR C 3 186 ? 39.761 -56.278 25.251 1.00 65.48 ? 186 THR C C 1 +ATOM 4565 O O . THR C 3 186 ? 40.218 -55.389 24.535 1.00 73.61 ? 186 THR C O 1 +ATOM 4566 C CB . THR C 3 186 ? 38.475 -58.514 24.953 1.00 63.49 ? 186 THR C CB 1 +ATOM 4567 O OG1 . THR C 3 186 ? 38.625 -58.884 26.323 1.00 68.04 ? 186 THR C OG1 1 +ATOM 4568 C CG2 . THR C 3 186 ? 39.578 -59.146 24.133 1.00 69.75 ? 186 THR C CG2 1 +ATOM 4569 N N . TRP C 3 187 ? 40.328 -56.672 26.393 1.00 75.15 ? 187 TRP C N 1 +ATOM 4570 C CA . TRP C 3 187 ? 41.552 -56.089 26.910 1.00 74.47 ? 187 TRP C CA 1 +ATOM 4571 C C . TRP C 3 187 ? 42.744 -56.784 26.272 1.00 66.04 ? 187 TRP C C 1 +ATOM 4572 O O . TRP C 3 187 ? 42.684 -57.974 25.968 1.00 80.89 ? 187 TRP C O 1 +ATOM 4573 C CB . TRP C 3 187 ? 41.607 -56.224 28.434 1.00 80.58 ? 187 TRP C CB 1 +ATOM 4574 C CG . TRP C 3 187 ? 40.719 -55.272 29.174 1.00 82.92 ? 187 TRP C CG 1 +ATOM 4575 C CD1 . TRP C 3 187 ? 39.512 -55.550 29.748 1.00 87.74 ? 187 TRP C CD1 1 +ATOM 4576 C CD2 . TRP C 3 187 ? 40.976 -53.881 29.432 1.00 81.84 ? 187 TRP C CD2 1 +ATOM 4577 N NE1 . TRP C 3 187 ? 38.999 -54.430 30.345 1.00 98.73 ? 187 TRP C NE1 1 +ATOM 4578 C CE2 . TRP C 3 187 ? 39.874 -53.390 30.169 1.00 101.86 ? 187 TRP C CE2 1 +ATOM 4579 C CE3 . TRP C 3 187 ? 42.019 -53.002 29.110 1.00 71.60 ? 187 TRP C CE3 1 +ATOM 4580 C CZ2 . TRP C 3 187 ? 39.794 -52.061 30.592 1.00 101.51 ? 187 TRP C CZ2 1 +ATOM 4581 C CZ3 . TRP C 3 187 ? 41.944 -51.693 29.536 1.00 80.59 ? 187 TRP C CZ3 1 +ATOM 4582 C CH2 . TRP C 3 187 ? 40.842 -51.229 30.261 1.00 81.94 ? 187 TRP C CH2 1 +ATOM 4583 N N . SER C 3 188 ? 43.820 -56.017 26.091 1.00 60.66 ? 188 SER C N 1 +ATOM 4584 C CA . SER C 3 188 ? 45.097 -56.567 25.676 1.00 73.65 ? 188 SER C CA 1 +ATOM 4585 C C . SER C 3 188 ? 45.681 -57.375 26.829 1.00 79.01 ? 188 SER C C 1 +ATOM 4586 O O . SER C 3 188 ? 45.292 -57.186 27.981 1.00 78.46 ? 188 SER C O 1 +ATOM 4587 C CB . SER C 3 188 ? 46.043 -55.472 25.253 1.00 88.41 ? 188 SER C CB 1 +ATOM 4588 O OG . SER C 3 188 ? 46.606 -54.819 26.383 1.00 103.28 ? 188 SER C OG 1 +ATOM 4589 N N . GLU C 3 189 ? 46.615 -58.271 26.494 1.00 95.02 ? 189 GLU C N 1 +ATOM 4590 C CA . GLU C 3 189 ? 47.483 -58.894 27.479 1.00 87.93 ? 189 GLU C CA 1 +ATOM 4591 C C . GLU C 3 189 ? 48.285 -57.790 28.160 1.00 89.85 ? 189 GLU C C 1 +ATOM 4592 O O . GLU C 3 189 ? 48.496 -56.720 27.583 1.00 81.04 ? 189 GLU C O 1 +ATOM 4593 C CB . GLU C 3 189 ? 48.429 -59.894 26.807 1.00 106.10 ? 189 GLU C CB 1 +ATOM 4594 C CG . GLU C 3 189 ? 47.736 -61.112 26.209 1.00 116.28 ? 189 GLU C CG 1 +ATOM 4595 C CD . GLU C 3 189 ? 47.531 -62.293 27.145 1.00 111.24 ? 189 GLU C CD 1 +ATOM 4596 O OE1 . GLU C 3 189 ? 48.477 -62.638 27.886 1.00 94.57 ? 189 GLU C OE1 1 +ATOM 4597 O OE2 . GLU C 3 189 ? 46.423 -62.872 27.128 1.00 102.68 ? 189 GLU C OE2 1 +ATOM 4598 N N . TRP C 3 190 ? 48.721 -58.065 29.394 1.00 100.37 ? 190 TRP C N 1 +ATOM 4599 C CA . TRP C 3 190 ? 49.576 -57.149 30.131 1.00 91.48 ? 190 TRP C CA 1 +ATOM 4600 C C . TRP C 3 190 ? 50.957 -57.082 29.480 1.00 89.26 ? 190 TRP C C 1 +ATOM 4601 O O . TRP C 3 190 ? 51.325 -57.949 28.685 1.00 88.08 ? 190 TRP C O 1 +ATOM 4602 C CB . TRP C 3 190 ? 49.643 -57.540 31.611 1.00 82.72 ? 190 TRP C CB 1 +ATOM 4603 C CG . TRP C 3 190 ? 48.332 -57.377 32.317 1.00 78.15 ? 190 TRP C CG 1 +ATOM 4604 C CD1 . TRP C 3 190 ? 47.375 -58.334 32.497 1.00 63.72 ? 190 TRP C CD1 1 +ATOM 4605 C CD2 . TRP C 3 190 ? 47.820 -56.176 32.925 1.00 90.40 ? 190 TRP C CD2 1 +ATOM 4606 N NE1 . TRP C 3 190 ? 46.308 -57.815 33.178 1.00 72.81 ? 190 TRP C NE1 1 +ATOM 4607 C CE2 . TRP C 3 190 ? 46.549 -56.495 33.458 1.00 82.91 ? 190 TRP C CE2 1 +ATOM 4608 C CE3 . TRP C 3 190 ? 48.306 -54.869 33.079 1.00 96.30 ? 190 TRP C CE3 1 +ATOM 4609 C CZ2 . TRP C 3 190 ? 45.763 -55.555 34.131 1.00 69.61 ? 190 TRP C CZ2 1 +ATOM 4610 C CZ3 . TRP C 3 190 ? 47.532 -53.942 33.746 1.00 101.29 ? 190 TRP C CZ3 1 +ATOM 4611 C CH2 . TRP C 3 190 ? 46.277 -54.283 34.262 1.00 91.76 ? 190 TRP C CH2 1 +ATOM 4612 N N . SER C 3 191 ? 51.692 -56.016 29.809 1.00 86.98 ? 191 SER C N 1 +ATOM 4613 C CA . SER C 3 191 ? 53.048 -55.808 29.329 1.00 94.51 ? 191 SER C CA 1 +ATOM 4614 C C . SER C 3 191 ? 54.043 -56.478 30.277 1.00 104.17 ? 191 SER C C 1 +ATOM 4615 O O . SER C 3 191 ? 53.665 -56.900 31.373 1.00 85.55 ? 191 SER C O 1 +ATOM 4616 C CB . SER C 3 191 ? 53.327 -54.333 29.205 1.00 95.60 ? 191 SER C CB 1 +ATOM 4617 O OG . SER C 3 191 ? 53.256 -53.707 30.478 1.00 100.27 ? 191 SER C OG 1 +ATOM 4618 N N . PRO C 3 192 ? 55.333 -56.620 29.878 1.00 109.58 ? 192 PRO C N 1 +ATOM 4619 C CA . PRO C 3 192 ? 56.423 -56.832 30.838 1.00 98.53 ? 192 PRO C CA 1 +ATOM 4620 C C . PRO C 3 192 ? 56.417 -55.747 31.916 1.00 99.29 ? 192 PRO C C 1 +ATOM 4621 O O . PRO C 3 192 ? 56.153 -54.584 31.613 1.00 87.99 ? 192 PRO C O 1 +ATOM 4622 C CB . PRO C 3 192 ? 57.686 -56.676 29.975 1.00 117.55 ? 192 PRO C CB 1 +ATOM 4623 C CG . PRO C 3 192 ? 57.247 -57.060 28.575 1.00 110.05 ? 192 PRO C CG 1 +ATOM 4624 C CD . PRO C 3 192 ? 55.800 -56.629 28.478 1.00 96.62 ? 192 PRO C CD 1 +ATOM 4625 N N . SER C 3 193 ? 56.724 -56.135 33.164 1.00 116.51 ? 193 SER C N 1 +ATOM 4626 C CA . SER C 3 193 ? 56.533 -55.279 34.330 1.00 121.19 ? 193 SER C CA 1 +ATOM 4627 C C . SER C 3 193 ? 57.860 -54.898 34.992 1.00 111.50 ? 193 SER C C 1 +ATOM 4628 O O . SER C 3 193 ? 58.803 -55.689 34.993 1.00 105.18 ? 193 SER C O 1 +ATOM 4629 C CB . SER C 3 193 ? 55.563 -55.901 35.316 1.00 133.42 ? 193 SER C CB 1 +ATOM 4630 O OG . SER C 3 193 ? 55.969 -57.206 35.705 1.00 113.36 ? 193 SER C OG 1 +ATOM 4631 N N . THR C 3 194 ? 57.906 -53.680 35.561 1.00 119.03 ? 194 THR C N 1 +ATOM 4632 C CA . THR C 3 194 ? 59.075 -53.140 36.250 1.00 113.93 ? 194 THR C CA 1 +ATOM 4633 C C . THR C 3 194 ? 58.732 -52.844 37.712 1.00 131.26 ? 194 THR C C 1 +ATOM 4634 O O . THR C 3 194 ? 57.559 -52.694 38.060 1.00 131.26 ? 194 THR C O 1 +ATOM 4635 C CB . THR C 3 194 ? 59.630 -51.884 35.557 1.00 98.00 ? 194 THR C CB 1 +ATOM 4636 O OG1 . THR C 3 194 ? 59.119 -51.763 34.229 1.00 105.47 ? 194 THR C OG1 1 +ATOM 4637 C CG2 . THR C 3 194 ? 61.143 -51.837 35.525 1.00 90.06 ? 194 THR C CG2 1 +ATOM 4638 N N . LYS C 3 195 ? 59.776 -52.752 38.553 1.00 131.20 ? 195 LYS C N 1 +ATOM 4639 C CA . LYS C 3 195 ? 59.647 -52.511 39.984 1.00 135.89 ? 195 LYS C CA 1 +ATOM 4640 C C . LYS C 3 195 ? 60.189 -51.123 40.322 1.00 129.14 ? 195 LYS C C 1 +ATOM 4641 O O . LYS C 3 195 ? 61.357 -50.830 40.065 1.00 116.08 ? 195 LYS C O 1 +ATOM 4642 C CB . LYS C 3 195 ? 60.372 -53.610 40.770 1.00 120.05 ? 195 LYS C CB 1 +ATOM 4643 N N . TRP C 3 196 ? 59.322 -50.279 40.900 1.00 114.61 ? 196 TRP C N 1 +ATOM 4644 C CA . TRP C 3 196 ? 59.667 -48.904 41.230 1.00 108.73 ? 196 TRP C CA 1 +ATOM 4645 C C . TRP C 3 196 ? 60.238 -48.838 42.654 1.00 106.05 ? 196 TRP C C 1 +ATOM 4646 O O . TRP C 3 196 ? 61.221 -49.518 42.986 1.00 67.80 ? 196 TRP C O 1 +ATOM 4647 C CB . TRP C 3 196 ? 58.455 -47.978 41.043 1.00 73.68 ? 196 TRP C CB 1 +HETATM 4648 C C1 . NAG D 4 . ? 48.253 -85.694 13.889 1.00 83.47 ? 1 NAG D C1 1 +HETATM 4649 C C2 . NAG D 4 . ? 48.861 -85.898 15.276 1.00 80.89 ? 1 NAG D C2 1 +HETATM 4650 C C3 . NAG D 4 . ? 50.367 -85.618 15.203 1.00 88.46 ? 1 NAG D C3 1 +HETATM 4651 C C4 . NAG D 4 . ? 51.079 -86.393 14.086 1.00 87.58 ? 1 NAG D C4 1 +HETATM 4652 C C5 . NAG D 4 . ? 50.315 -86.276 12.738 1.00 93.22 ? 1 NAG D C5 1 +HETATM 4653 C C6 . NAG D 4 . ? 50.770 -87.239 11.632 1.00 86.90 ? 1 NAG D C6 1 +HETATM 4654 C C7 . NAG D 4 . ? 47.228 -85.412 17.118 1.00 78.56 ? 1 NAG D C7 1 +HETATM 4655 C C8 . NAG D 4 . ? 46.756 -84.329 18.032 1.00 60.70 ? 1 NAG D C8 1 +HETATM 4656 N N2 . NAG D 4 . ? 48.211 -85.046 16.273 1.00 93.52 ? 1 NAG D N2 1 +HETATM 4657 O O3 . NAG D 4 . ? 50.995 -85.928 16.453 1.00 117.54 ? 1 NAG D O3 1 +HETATM 4658 O O4 . NAG D 4 . ? 52.450 -85.928 14.059 1.00 77.52 ? 1 NAG D O4 1 +HETATM 4659 O O5 . NAG D 4 . ? 48.917 -86.538 12.942 1.00 105.53 ? 1 NAG D O5 1 +HETATM 4660 O O6 . NAG D 4 . ? 50.401 -88.592 11.951 1.00 78.57 ? 1 NAG D O6 1 +HETATM 4661 O O7 . NAG D 4 . ? 46.719 -86.524 17.176 1.00 86.46 ? 1 NAG D O7 1 +HETATM 4662 C C1 . NAG D 4 . ? 53.429 -86.984 13.804 1.00 96.66 ? 2 NAG D C1 1 +HETATM 4663 C C2 . NAG D 4 . ? 54.787 -86.745 14.496 1.00 77.75 ? 2 NAG D C2 1 +HETATM 4664 C C3 . NAG D 4 . ? 55.765 -87.896 14.182 1.00 79.72 ? 2 NAG D C3 1 +HETATM 4665 C C4 . NAG D 4 . ? 55.097 -89.255 14.463 1.00 86.98 ? 2 NAG D C4 1 +HETATM 4666 C C5 . NAG D 4 . ? 53.859 -89.353 13.545 1.00 105.09 ? 2 NAG D C5 1 +HETATM 4667 C C6 . NAG D 4 . ? 53.160 -90.714 13.474 1.00 105.82 ? 2 NAG D C6 1 +HETATM 4668 C C7 . NAG D 4 . ? 55.332 -84.355 14.827 1.00 104.43 ? 2 NAG D C7 1 +HETATM 4669 C C8 . NAG D 4 . ? 56.007 -83.165 14.200 1.00 99.66 ? 2 NAG D C8 1 +HETATM 4670 N N2 . NAG D 4 . ? 55.364 -85.472 14.093 1.00 93.25 ? 2 NAG D N2 1 +HETATM 4671 O O3 . NAG D 4 . ? 57.021 -87.780 14.881 1.00 77.21 ? 2 NAG D O3 1 +HETATM 4672 O O4 . NAG D 4 . ? 56.035 -90.342 14.349 1.00 60.76 ? 2 NAG D O4 1 +HETATM 4673 O O5 . NAG D 4 . ? 52.948 -88.340 14.005 1.00 108.18 ? 2 NAG D O5 1 +HETATM 4674 O O6 . NAG D 4 . ? 52.015 -90.605 12.479 1.00 111.34 ? 2 NAG D O6 1 +HETATM 4675 O O7 . NAG D 4 . ? 54.798 -84.289 15.929 1.00 107.70 ? 2 NAG D O7 1 +HETATM 4676 C C1 . NAG E 4 . ? 31.108 -60.660 3.030 1.00 98.13 ? 1 NAG E C1 1 +HETATM 4677 C C2 . NAG E 4 . ? 29.699 -60.049 3.102 1.00 101.58 ? 1 NAG E C2 1 +HETATM 4678 C C3 . NAG E 4 . ? 28.616 -61.103 2.844 1.00 90.39 ? 1 NAG E C3 1 +HETATM 4679 C C4 . NAG E 4 . ? 28.886 -62.016 1.640 1.00 104.05 ? 1 NAG E C4 1 +HETATM 4680 C C5 . NAG E 4 . ? 30.378 -62.379 1.495 1.00 106.32 ? 1 NAG E C5 1 +HETATM 4681 C C6 . NAG E 4 . ? 30.682 -62.890 0.094 1.00 115.43 ? 1 NAG E C6 1 +HETATM 4682 C C7 . NAG E 4 . ? 29.656 -59.707 5.605 1.00 72.52 ? 1 NAG E C7 1 +HETATM 4683 C C8 . NAG E 4 . ? 29.036 -58.776 6.604 1.00 52.53 ? 1 NAG E C8 1 +HETATM 4684 N N2 . NAG E 4 . ? 29.340 -59.387 4.349 1.00 103.43 ? 1 NAG E N2 1 +HETATM 4685 O O3 . NAG E 4 . ? 27.383 -60.412 2.616 1.00 86.61 ? 1 NAG E O3 1 +HETATM 4686 O O4 . NAG E 4 . ? 28.047 -63.191 1.735 1.00 95.18 ? 1 NAG E O4 1 +HETATM 4687 O O5 . NAG E 4 . ? 31.245 -61.253 1.732 1.00 96.41 ? 1 NAG E O5 1 +HETATM 4688 O O6 . NAG E 4 . ? 31.047 -64.270 0.176 1.00 123.68 ? 1 NAG E O6 1 +HETATM 4689 O O7 . NAG E 4 . ? 30.379 -60.645 5.915 1.00 63.01 ? 1 NAG E O7 1 +HETATM 4690 C C1 . NAG E 4 . ? 26.980 -63.150 0.747 1.00 125.48 ? 2 NAG E C1 1 +HETATM 4691 C C2 . NAG E 4 . ? 26.385 -64.553 0.502 1.00 132.49 ? 2 NAG E C2 1 +HETATM 4692 C C3 . NAG E 4 . ? 25.043 -64.531 -0.260 1.00 146.07 ? 2 NAG E C3 1 +HETATM 4693 C C4 . NAG E 4 . ? 24.125 -63.323 0.004 1.00 139.63 ? 2 NAG E C4 1 +HETATM 4694 C C5 . NAG E 4 . ? 24.909 -62.014 0.157 1.00 134.82 ? 2 NAG E C5 1 +HETATM 4695 C C6 . NAG E 4 . ? 24.034 -60.865 0.646 1.00 122.00 ? 2 NAG E C6 1 +HETATM 4696 C C7 . NAG E 4 . ? 28.395 -66.030 0.237 1.00 99.82 ? 2 NAG E C7 1 +HETATM 4697 C C8 . NAG E 4 . ? 29.145 -66.869 -0.754 1.00 83.12 ? 2 NAG E C8 1 +HETATM 4698 N N2 . NAG E 4 . ? 27.300 -65.419 -0.239 1.00 118.32 ? 2 NAG E N2 1 +HETATM 4699 O O3 . NAG E 4 . ? 24.312 -65.727 0.040 1.00 149.87 ? 2 NAG E O3 1 +HETATM 4700 O O4 . NAG E 4 . ? 23.183 -63.209 -1.073 1.00 144.27 ? 2 NAG E O4 1 +HETATM 4701 O O5 . NAG E 4 . ? 25.961 -62.201 1.108 1.00 140.66 ? 2 NAG E O5 1 +HETATM 4702 O O6 . NAG E 4 . ? 23.376 -60.263 -0.472 1.00 124.93 ? 2 NAG E O6 1 +HETATM 4703 O O7 . NAG E 4 . ? 28.796 -65.924 1.384 1.00 101.03 ? 2 NAG E O7 1 +HETATM 4704 C C1 . NAG F 5 . ? 29.591 -57.551 16.804 1.00 140.19 ? 301 NAG C C1 1 +HETATM 4705 C C2 . NAG F 5 . ? 29.456 -56.578 15.606 1.00 126.57 ? 301 NAG C C2 1 +HETATM 4706 C C3 . NAG F 5 . ? 27.954 -56.571 15.259 1.00 112.77 ? 301 NAG C C3 1 +HETATM 4707 C C4 . NAG F 5 . ? 27.663 -57.943 14.629 1.00 93.00 ? 301 NAG C C4 1 +HETATM 4708 C C5 . NAG F 5 . ? 27.966 -59.078 15.634 1.00 107.15 ? 301 NAG C C5 1 +HETATM 4709 C C6 . NAG F 5 . ? 28.041 -60.445 14.949 1.00 98.87 ? 301 NAG C C6 1 +HETATM 4710 C C7 . NAG F 5 . ? 30.191 -54.169 15.089 1.00 110.84 ? 301 NAG C C7 1 +HETATM 4711 C C8 . NAG F 5 . ? 31.146 -53.135 15.614 1.00 134.85 ? 301 NAG C C8 1 +HETATM 4712 N N2 . NAG F 5 . ? 30.196 -55.320 15.790 1.00 102.83 ? 301 NAG C N2 1 +HETATM 4713 O O3 . NAG F 5 . ? 27.543 -55.507 14.393 1.00 135.99 ? 301 NAG C O3 1 +HETATM 4714 O O4 . NAG F 5 . ? 26.308 -58.014 14.155 1.00 81.17 ? 301 NAG C O4 1 +HETATM 4715 O O5 . NAG F 5 . ? 29.204 -58.884 16.365 1.00 121.05 ? 301 NAG C O5 1 +HETATM 4716 O O6 . NAG F 5 . ? 26.735 -60.872 14.537 1.00 102.31 ? 301 NAG C O6 1 +HETATM 4717 O O7 . NAG F 5 . ? 29.481 -53.916 14.121 1.00 92.15 ? 301 NAG C O7 1 +HETATM 4718 O O . HOH G 6 . ? 75.553 -43.834 -53.264 1.00 58.56 ? 301 HOH A O 1 +HETATM 4719 O O . HOH G 6 . ? 57.813 -52.586 -38.683 1.00 39.45 ? 302 HOH A O 1 +HETATM 4720 O O . HOH G 6 . ? 55.739 -53.236 -23.882 1.00 61.71 ? 303 HOH A O 1 +HETATM 4721 O O . HOH G 6 . ? 48.464 -57.569 -36.008 1.00 46.32 ? 304 HOH A O 1 +HETATM 4722 O O . HOH G 6 . ? 43.812 -51.009 1.677 1.00 29.18 ? 305 HOH A O 1 +HETATM 4723 O O . HOH G 6 . ? 29.087 -65.749 -12.555 1.00 65.84 ? 306 HOH A O 1 +HETATM 4724 O O . HOH H 6 . ? 24.389 -44.017 -9.457 1.00 44.81 ? 301 HOH B O 1 +HETATM 4725 O O . HOH H 6 . ? 45.690 -45.286 -32.524 1.00 62.34 ? 302 HOH B O 1 +HETATM 4726 O O . HOH H 6 . ? 57.079 -41.720 -57.033 1.00 48.46 ? 303 HOH B O 1 +HETATM 4727 O O . HOH H 6 . ? 26.791 -36.061 -6.890 1.00 47.52 ? 304 HOH B O 1 +HETATM 4728 O O . HOH H 6 . ? 41.489 -34.888 -52.242 1.00 63.82 ? 305 HOH B O 1 +HETATM 4729 O O . HOH H 6 . ? 31.722 -32.404 -22.834 1.00 65.58 ? 306 HOH B O 1 +HETATM 4730 O O . HOH H 6 . ? 45.618 -50.936 3.047 1.00 34.30 ? 307 HOH B O 1 +HETATM 4731 O O . HOH H 6 . ? 42.791 -52.632 -0.199 1.00 50.02 ? 308 HOH B O 1 +HETATM 4732 O O . HOH H 6 . ? 48.326 -45.116 -1.896 1.00 48.64 ? 309 HOH B O 1 +HETATM 4733 O O . HOH H 6 . ? 39.415 -47.398 7.157 1.00 25.47 ? 310 HOH B O 1 +HETATM 4734 O O . HOH H 6 . ? 56.931 -22.849 -45.856 1.00 56.82 ? 311 HOH B O 1 +HETATM 4735 O O . HOH I 6 . ? 61.073 -43.716 30.860 1.00 56.36 ? 401 HOH C O 1 +HETATM 4736 O O . HOH I 6 . ? 55.923 -52.929 21.504 1.00 60.87 ? 402 HOH C O 1 +HETATM 4737 O O . HOH I 6 . ? 50.956 -61.748 2.289 1.00 36.64 ? 403 HOH C O 1 +HETATM 4738 O O . HOH I 6 . ? 39.431 -48.989 9.889 1.00 36.86 ? 404 HOH C O 1 +HETATM 4739 O O . HOH I 6 . ? 44.620 -63.122 17.781 1.00 48.83 ? 405 HOH C O 1 +HETATM 4740 O O . HOH I 6 . ? 43.900 -37.775 16.094 1.00 41.23 ? 406 HOH C O 1 +HETATM 4741 O O . HOH I 6 . ? 34.601 -51.471 12.867 1.00 36.10 ? 407 HOH C O 1 +HETATM 4742 O O . HOH I 6 . ? 35.292 -47.262 11.162 1.00 27.65 ? 408 HOH C O 1 +HETATM 4743 O O . HOH I 6 . ? 28.061 -77.058 2.922 1.00 61.09 ? 409 HOH C O 1 +# diff --git a/tests/resources/7bz5.cif b/tests/resources/7bz5.cif new file mode 100644 index 0000000..23f20b7 --- /dev/null +++ b/tests/resources/7bz5.cif @@ -0,0 +1,14544 @@ +data_7BZ5 +# +_entry.id 7BZ5 +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.397 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 7BZ5 pdb_00007bz5 10.2210/pdb7bz5/pdb +WWPDB D_1300016749 ? ? +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2020-05-13 +2 'Structure model' 1 1 2020-05-27 +3 'Structure model' 1 2 2020-06-24 +4 'Structure model' 1 3 2020-07-29 +5 'Structure model' 1 4 2021-03-10 +6 'Structure model' 1 5 2023-11-29 +7 'Structure model' 1 6 2024-10-30 +# +loop_ +_pdbx_audit_revision_details.ordinal +_pdbx_audit_revision_details.revision_ordinal +_pdbx_audit_revision_details.data_content_type +_pdbx_audit_revision_details.provider +_pdbx_audit_revision_details.type +_pdbx_audit_revision_details.description +_pdbx_audit_revision_details.details +1 1 'Structure model' repository 'Initial release' ? ? +2 4 'Structure model' repository Remediation 'Carbohydrate remediation' ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Database references' +2 3 'Structure model' 'Database references' +3 4 'Structure model' 'Data collection' +4 4 'Structure model' 'Derived calculations' +5 4 'Structure model' 'Structure summary' +6 5 'Structure model' 'Structure summary' +7 6 'Structure model' 'Data collection' +8 6 'Structure model' 'Database references' +9 6 'Structure model' 'Refinement description' +10 7 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 2 'Structure model' citation +2 2 'Structure model' citation_author +3 3 'Structure model' citation +4 3 'Structure model' citation_author +5 4 'Structure model' chem_comp +6 4 'Structure model' entity +7 4 'Structure model' pdbx_chem_comp_identifier +8 4 'Structure model' pdbx_entity_nonpoly +9 4 'Structure model' struct_conn +10 4 'Structure model' struct_site +11 4 'Structure model' struct_site_gen +12 5 'Structure model' chem_comp +13 6 'Structure model' chem_comp_atom +14 6 'Structure model' chem_comp_bond +15 6 'Structure model' database_2 +16 6 'Structure model' pdbx_initial_refinement_model +17 7 'Structure model' pdbx_entry_details +18 7 'Structure model' pdbx_modification_feature +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 2 'Structure model' '_citation.pdbx_database_id_PubMed' +2 2 'Structure model' '_citation.title' +3 3 'Structure model' '_citation.journal_volume' +4 3 'Structure model' '_citation.page_first' +5 3 'Structure model' '_citation.page_last' +6 3 'Structure model' '_citation_author.identifier_ORCID' +7 4 'Structure model' '_chem_comp.name' +8 4 'Structure model' '_entity.pdbx_description' +9 4 'Structure model' '_pdbx_entity_nonpoly.name' +10 4 'Structure model' '_struct_conn.pdbx_role' +11 5 'Structure model' '_chem_comp.pdbx_synonyms' +12 6 'Structure model' '_database_2.pdbx_DOI' +13 6 'Structure model' '_database_2.pdbx_database_accession' +14 7 'Structure model' '_pdbx_entry_details.has_protein_modification' +# +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.entry_id 7BZ5 +_pdbx_database_status.recvd_initial_deposition_date 2020-04-26 +_pdbx_database_status.SG_entry N +_pdbx_database_status.deposit_site PDBJ +_pdbx_database_status.process_site PDBJ +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.status_code_nmr_data ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +_audit_author.identifier_ORCID +'Wu, Y.' 1 0000-0003-2734-0673 +'Qi, J.' 2 ? +'Gao, F.' 3 0000-0002-0670-010X +# +_citation.abstract ? +_citation.abstract_id_CAS ? +_citation.book_id_ISBN ? +_citation.book_publisher ? +_citation.book_publisher_city ? +_citation.book_title ? +_citation.coordinate_linkage ? +_citation.country US +_citation.database_id_Medline ? +_citation.details ? +_citation.id primary +_citation.journal_abbrev Science +_citation.journal_id_ASTM SCIEAS +_citation.journal_id_CSD 0038 +_citation.journal_id_ISSN 1095-9203 +_citation.journal_full ? +_citation.journal_issue ? +_citation.journal_volume 368 +_citation.language ? +_citation.page_first 1274 +_citation.page_last 1278 +_citation.title +'A noncompeting pair of human neutralizing antibodies block COVID-19 virus binding to its receptor ACE2.' +_citation.year 2020 +_citation.database_id_CSD ? +_citation.pdbx_database_id_DOI 10.1126/science.abc2241 +_citation.pdbx_database_id_PubMed 32404477 +_citation.unpublished_flag ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Wu, Y.' 1 0000-0003-2734-0673 +primary 'Wang, F.' 2 0000-0003-4568-9158 +primary 'Shen, C.' 3 0000-0001-8607-3750 +primary 'Peng, W.' 4 0000-0001-7069-9556 +primary 'Li, D.' 5 0000-0002-7967-1581 +primary 'Zhao, C.' 6 0000-0001-9800-9107 +primary 'Li, Z.' 7 0000-0003-4286-7772 +primary 'Li, S.' 8 0000-0003-3608-4106 +primary 'Bi, Y.' 9 0000-0002-5595-363X +primary 'Yang, Y.' 10 ? +primary 'Gong, Y.' 11 ? +primary 'Xiao, H.' 12 ? +primary 'Fan, Z.' 13 ? +primary 'Tan, S.' 14 ? +primary 'Wu, G.' 15 0000-0003-2778-4290 +primary 'Tan, W.' 16 0000-0002-5963-1136 +primary 'Lu, X.' 17 ? +primary 'Fan, C.' 18 0000-0001-5556-2025 +primary 'Wang, Q.' 19 ? +primary 'Liu, Y.' 20 ? +primary 'Zhang, C.' 21 ? +primary 'Qi, J.' 22 ? +primary 'Gao, G.F.' 23 0000-0002-3869-615X +primary 'Gao, F.' 24 0000-0002-0670-010X +primary 'Liu, L.' 25 0000-0001-9612-6844 +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Spike protein S1' 25951.219 1 ? ? ? ? +2 polymer man 'Heavy chain of B38' 23442.205 1 ? ? ? ? +3 polymer man 'Light chain of B38' 23745.365 1 ? ? ? ? +4 non-polymer man 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208 1 ? ? ? ? +5 water nat water 18.015 519 ? ? ? ? +# +_entity_name_com.entity_id 1 +_entity_name_com.name 'S glycoprotein,E2,Peplomer protein' +# +loop_ +_entity_poly.entity_id +_entity_poly.type +_entity_poly.nstd_linkage +_entity_poly.nstd_monomer +_entity_poly.pdbx_seq_one_letter_code +_entity_poly.pdbx_seq_one_letter_code_can +_entity_poly.pdbx_strand_id +_entity_poly.pdbx_target_identifier +1 'polypeptide(L)' no no +;RVQPTESIVRFPNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYAD +SFVIRGDEVRQIAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGST +PCNGVEGFNCYFPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNLVKNKCVNFHHHHHH +; +;RVQPTESIVRFPNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYAD +SFVIRGDEVRQIAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGST +PCNGVEGFNCYFPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNLVKNKCVNFHHHHHH +; +A ? +2 'polypeptide(L)' no no +;GDEVQLVESGGGLVQPGGSLRLSCAASGFIVSSNYMSWVRQAPGKGLEWVSVIYSGGSTYYADSVKGRFTISRHNSKNTL +YLQMNSLRAEDTAVYYCAREAYGMDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNS +GALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDK +; +;GDEVQLVESGGGLVQPGGSLRLSCAASGFIVSSNYMSWVRQAPGKGLEWVSVIYSGGSTYYADSVKGRFTISRHNSKNTL +YLQMNSLRAEDTAVYYCAREAYGMDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNS +GALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDK +; +H ? +3 'polypeptide(L)' no no +;GDDIVMTQSPSFLSASVGDRVTITCRASQGISSYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTEFTLTISSL +QPEDFATYYCQQLNSYPPYTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSG +NSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECS +; +;GDDIVMTQSPSFLSASVGDRVTITCRASQGISSYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTEFTLTISSL +QPEDFATYYCQQLNSYPPYTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSG +NSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECS +; +L ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +4 2-acetamido-2-deoxy-beta-D-glucopyranose NAG +5 water HOH +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 ARG n +1 2 VAL n +1 3 GLN n +1 4 PRO n +1 5 THR n +1 6 GLU n +1 7 SER n +1 8 ILE n +1 9 VAL n +1 10 ARG n +1 11 PHE n +1 12 PRO n +1 13 ASN n +1 14 ILE n +1 15 THR n +1 16 ASN n +1 17 LEU n +1 18 CYS n +1 19 PRO n +1 20 PHE n +1 21 GLY n +1 22 GLU n +1 23 VAL n +1 24 PHE n +1 25 ASN n +1 26 ALA n +1 27 THR n +1 28 ARG n +1 29 PHE n +1 30 ALA n +1 31 SER n +1 32 VAL n +1 33 TYR n +1 34 ALA n +1 35 TRP n +1 36 ASN n +1 37 ARG n +1 38 LYS n +1 39 ARG n +1 40 ILE n +1 41 SER n +1 42 ASN n +1 43 CYS n +1 44 VAL n +1 45 ALA n +1 46 ASP n +1 47 TYR n +1 48 SER n +1 49 VAL n +1 50 LEU n +1 51 TYR n +1 52 ASN n +1 53 SER n +1 54 ALA n +1 55 SER n +1 56 PHE n +1 57 SER n +1 58 THR n +1 59 PHE n +1 60 LYS n +1 61 CYS n +1 62 TYR n +1 63 GLY n +1 64 VAL n +1 65 SER n +1 66 PRO n +1 67 THR n +1 68 LYS n +1 69 LEU n +1 70 ASN n +1 71 ASP n +1 72 LEU n +1 73 CYS n +1 74 PHE n +1 75 THR n +1 76 ASN n +1 77 VAL n +1 78 TYR n +1 79 ALA n +1 80 ASP n +1 81 SER n +1 82 PHE n +1 83 VAL n +1 84 ILE n +1 85 ARG n +1 86 GLY n +1 87 ASP n +1 88 GLU n +1 89 VAL n +1 90 ARG n +1 91 GLN n +1 92 ILE n +1 93 ALA n +1 94 PRO n +1 95 GLY n +1 96 GLN n +1 97 THR n +1 98 GLY n +1 99 LYS n +1 100 ILE n +1 101 ALA n +1 102 ASP n +1 103 TYR n +1 104 ASN n +1 105 TYR n +1 106 LYS n +1 107 LEU n +1 108 PRO n +1 109 ASP n +1 110 ASP n +1 111 PHE n +1 112 THR n +1 113 GLY n +1 114 CYS n +1 115 VAL n +1 116 ILE n +1 117 ALA n +1 118 TRP n +1 119 ASN n +1 120 SER n +1 121 ASN n +1 122 ASN n +1 123 LEU n +1 124 ASP n +1 125 SER n +1 126 LYS n +1 127 VAL n +1 128 GLY n +1 129 GLY n +1 130 ASN n +1 131 TYR n +1 132 ASN n +1 133 TYR n +1 134 LEU n +1 135 TYR n +1 136 ARG n +1 137 LEU n +1 138 PHE n +1 139 ARG n +1 140 LYS n +1 141 SER n +1 142 ASN n +1 143 LEU n +1 144 LYS n +1 145 PRO n +1 146 PHE n +1 147 GLU n +1 148 ARG n +1 149 ASP n +1 150 ILE n +1 151 SER n +1 152 THR n +1 153 GLU n +1 154 ILE n +1 155 TYR n +1 156 GLN n +1 157 ALA n +1 158 GLY n +1 159 SER n +1 160 THR n +1 161 PRO n +1 162 CYS n +1 163 ASN n +1 164 GLY n +1 165 VAL n +1 166 GLU n +1 167 GLY n +1 168 PHE n +1 169 ASN n +1 170 CYS n +1 171 TYR n +1 172 PHE n +1 173 PRO n +1 174 LEU n +1 175 GLN n +1 176 SER n +1 177 TYR n +1 178 GLY n +1 179 PHE n +1 180 GLN n +1 181 PRO n +1 182 THR n +1 183 ASN n +1 184 GLY n +1 185 VAL n +1 186 GLY n +1 187 TYR n +1 188 GLN n +1 189 PRO n +1 190 TYR n +1 191 ARG n +1 192 VAL n +1 193 VAL n +1 194 VAL n +1 195 LEU n +1 196 SER n +1 197 PHE n +1 198 GLU n +1 199 LEU n +1 200 LEU n +1 201 HIS n +1 202 ALA n +1 203 PRO n +1 204 ALA n +1 205 THR n +1 206 VAL n +1 207 CYS n +1 208 GLY n +1 209 PRO n +1 210 LYS n +1 211 LYS n +1 212 SER n +1 213 THR n +1 214 ASN n +1 215 LEU n +1 216 VAL n +1 217 LYS n +1 218 ASN n +1 219 LYS n +1 220 CYS n +1 221 VAL n +1 222 ASN n +1 223 PHE n +1 224 HIS n +1 225 HIS n +1 226 HIS n +1 227 HIS n +1 228 HIS n +1 229 HIS n +2 1 GLY n +2 2 ASP n +2 3 GLU n +2 4 VAL n +2 5 GLN n +2 6 LEU n +2 7 VAL n +2 8 GLU n +2 9 SER n +2 10 GLY n +2 11 GLY n +2 12 GLY n +2 13 LEU n +2 14 VAL n +2 15 GLN n +2 16 PRO n +2 17 GLY n +2 18 GLY n +2 19 SER n +2 20 LEU n +2 21 ARG n +2 22 LEU n +2 23 SER n +2 24 CYS n +2 25 ALA n +2 26 ALA n +2 27 SER n +2 28 GLY n +2 29 PHE n +2 30 ILE n +2 31 VAL n +2 32 SER n +2 33 SER n +2 34 ASN n +2 35 TYR n +2 36 MET n +2 37 SER n +2 38 TRP n +2 39 VAL n +2 40 ARG n +2 41 GLN n +2 42 ALA n +2 43 PRO n +2 44 GLY n +2 45 LYS n +2 46 GLY n +2 47 LEU n +2 48 GLU n +2 49 TRP n +2 50 VAL n +2 51 SER n +2 52 VAL n +2 53 ILE n +2 54 TYR n +2 55 SER n +2 56 GLY n +2 57 GLY n +2 58 SER n +2 59 THR n +2 60 TYR n +2 61 TYR n +2 62 ALA n +2 63 ASP n +2 64 SER n +2 65 VAL n +2 66 LYS n +2 67 GLY n +2 68 ARG n +2 69 PHE n +2 70 THR n +2 71 ILE n +2 72 SER n +2 73 ARG n +2 74 HIS n +2 75 ASN n +2 76 SER n +2 77 LYS n +2 78 ASN n +2 79 THR n +2 80 LEU n +2 81 TYR n +2 82 LEU n +2 83 GLN n +2 84 MET n +2 85 ASN n +2 86 SER n +2 87 LEU n +2 88 ARG n +2 89 ALA n +2 90 GLU n +2 91 ASP n +2 92 THR n +2 93 ALA n +2 94 VAL n +2 95 TYR n +2 96 TYR n +2 97 CYS n +2 98 ALA n +2 99 ARG n +2 100 GLU n +2 101 ALA n +2 102 TYR n +2 103 GLY n +2 104 MET n +2 105 ASP n +2 106 VAL n +2 107 TRP n +2 108 GLY n +2 109 GLN n +2 110 GLY n +2 111 THR n +2 112 THR n +2 113 VAL n +2 114 THR n +2 115 VAL n +2 116 SER n +2 117 SER n +2 118 ALA n +2 119 SER n +2 120 THR n +2 121 LYS n +2 122 GLY n +2 123 PRO n +2 124 SER n +2 125 VAL n +2 126 PHE n +2 127 PRO n +2 128 LEU n +2 129 ALA n +2 130 PRO n +2 131 SER n +2 132 SER n +2 133 LYS n +2 134 SER n +2 135 THR n +2 136 SER n +2 137 GLY n +2 138 GLY n +2 139 THR n +2 140 ALA n +2 141 ALA n +2 142 LEU n +2 143 GLY n +2 144 CYS n +2 145 LEU n +2 146 VAL n +2 147 LYS n +2 148 ASP n +2 149 TYR n +2 150 PHE n +2 151 PRO n +2 152 GLU n +2 153 PRO n +2 154 VAL n +2 155 THR n +2 156 VAL n +2 157 SER n +2 158 TRP n +2 159 ASN n +2 160 SER n +2 161 GLY n +2 162 ALA n +2 163 LEU n +2 164 THR n +2 165 SER n +2 166 GLY n +2 167 VAL n +2 168 HIS n +2 169 THR n +2 170 PHE n +2 171 PRO n +2 172 ALA n +2 173 VAL n +2 174 LEU n +2 175 GLN n +2 176 SER n +2 177 SER n +2 178 GLY n +2 179 LEU n +2 180 TYR n +2 181 SER n +2 182 LEU n +2 183 SER n +2 184 SER n +2 185 VAL n +2 186 VAL n +2 187 THR n +2 188 VAL n +2 189 PRO n +2 190 SER n +2 191 SER n +2 192 SER n +2 193 LEU n +2 194 GLY n +2 195 THR n +2 196 GLN n +2 197 THR n +2 198 TYR n +2 199 ILE n +2 200 CYS n +2 201 ASN n +2 202 VAL n +2 203 ASN n +2 204 HIS n +2 205 LYS n +2 206 PRO n +2 207 SER n +2 208 ASN n +2 209 THR n +2 210 LYS n +2 211 VAL n +2 212 ASP n +2 213 LYS n +2 214 ARG n +2 215 VAL n +2 216 GLU n +2 217 PRO n +2 218 LYS n +2 219 SER n +2 220 CYS n +2 221 ASP n +2 222 LYS n +3 1 GLY n +3 2 ASP n +3 3 ASP n +3 4 ILE n +3 5 VAL n +3 6 MET n +3 7 THR n +3 8 GLN n +3 9 SER n +3 10 PRO n +3 11 SER n +3 12 PHE n +3 13 LEU n +3 14 SER n +3 15 ALA n +3 16 SER n +3 17 VAL n +3 18 GLY n +3 19 ASP n +3 20 ARG n +3 21 VAL n +3 22 THR n +3 23 ILE n +3 24 THR n +3 25 CYS n +3 26 ARG n +3 27 ALA n +3 28 SER n +3 29 GLN n +3 30 GLY n +3 31 ILE n +3 32 SER n +3 33 SER n +3 34 TYR n +3 35 LEU n +3 36 ALA n +3 37 TRP n +3 38 TYR n +3 39 GLN n +3 40 GLN n +3 41 LYS n +3 42 PRO n +3 43 GLY n +3 44 LYS n +3 45 ALA n +3 46 PRO n +3 47 LYS n +3 48 LEU n +3 49 LEU n +3 50 ILE n +3 51 TYR n +3 52 ALA n +3 53 ALA n +3 54 SER n +3 55 THR n +3 56 LEU n +3 57 GLN n +3 58 SER n +3 59 GLY n +3 60 VAL n +3 61 PRO n +3 62 SER n +3 63 ARG n +3 64 PHE n +3 65 SER n +3 66 GLY n +3 67 SER n +3 68 GLY n +3 69 SER n +3 70 GLY n +3 71 THR n +3 72 GLU n +3 73 PHE n +3 74 THR n +3 75 LEU n +3 76 THR n +3 77 ILE n +3 78 SER n +3 79 SER n +3 80 LEU n +3 81 GLN n +3 82 PRO n +3 83 GLU n +3 84 ASP n +3 85 PHE n +3 86 ALA n +3 87 THR n +3 88 TYR n +3 89 TYR n +3 90 CYS n +3 91 GLN n +3 92 GLN n +3 93 LEU n +3 94 ASN n +3 95 SER n +3 96 TYR n +3 97 PRO n +3 98 PRO n +3 99 TYR n +3 100 THR n +3 101 PHE n +3 102 GLY n +3 103 GLN n +3 104 GLY n +3 105 THR n +3 106 LYS n +3 107 LEU n +3 108 GLU n +3 109 ILE n +3 110 LYS n +3 111 ARG n +3 112 THR n +3 113 VAL n +3 114 ALA n +3 115 ALA n +3 116 PRO n +3 117 SER n +3 118 VAL n +3 119 PHE n +3 120 ILE n +3 121 PHE n +3 122 PRO n +3 123 PRO n +3 124 SER n +3 125 ASP n +3 126 GLU n +3 127 GLN n +3 128 LEU n +3 129 LYS n +3 130 SER n +3 131 GLY n +3 132 THR n +3 133 ALA n +3 134 SER n +3 135 VAL n +3 136 VAL n +3 137 CYS n +3 138 LEU n +3 139 LEU n +3 140 ASN n +3 141 ASN n +3 142 PHE n +3 143 TYR n +3 144 PRO n +3 145 ARG n +3 146 GLU n +3 147 ALA n +3 148 LYS n +3 149 VAL n +3 150 GLN n +3 151 TRP n +3 152 LYS n +3 153 VAL n +3 154 ASP n +3 155 ASN n +3 156 ALA n +3 157 LEU n +3 158 GLN n +3 159 SER n +3 160 GLY n +3 161 ASN n +3 162 SER n +3 163 GLN n +3 164 GLU n +3 165 SER n +3 166 VAL n +3 167 THR n +3 168 GLU n +3 169 GLN n +3 170 ASP n +3 171 SER n +3 172 LYS n +3 173 ASP n +3 174 SER n +3 175 THR n +3 176 TYR n +3 177 SER n +3 178 LEU n +3 179 SER n +3 180 SER n +3 181 THR n +3 182 LEU n +3 183 THR n +3 184 LEU n +3 185 SER n +3 186 LYS n +3 187 ALA n +3 188 ASP n +3 189 TYR n +3 190 GLU n +3 191 LYS n +3 192 HIS n +3 193 LYS n +3 194 VAL n +3 195 TYR n +3 196 ALA n +3 197 CYS n +3 198 GLU n +3 199 VAL n +3 200 THR n +3 201 HIS n +3 202 GLN n +3 203 GLY n +3 204 LEU n +3 205 SER n +3 206 SER n +3 207 PRO n +3 208 VAL n +3 209 THR n +3 210 LYS n +3 211 SER n +3 212 PHE n +3 213 ASN n +3 214 ARG n +3 215 GLY n +3 216 GLU n +3 217 CYS n +3 218 SER n +# +loop_ +_entity_src_gen.entity_id +_entity_src_gen.pdbx_src_id +_entity_src_gen.pdbx_alt_source_flag +_entity_src_gen.pdbx_seq_type +_entity_src_gen.pdbx_beg_seq_num +_entity_src_gen.pdbx_end_seq_num +_entity_src_gen.gene_src_common_name +_entity_src_gen.gene_src_genus +_entity_src_gen.pdbx_gene_src_gene +_entity_src_gen.gene_src_species +_entity_src_gen.gene_src_strain +_entity_src_gen.gene_src_tissue +_entity_src_gen.gene_src_tissue_fraction +_entity_src_gen.gene_src_details +_entity_src_gen.pdbx_gene_src_fragment +_entity_src_gen.pdbx_gene_src_scientific_name +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id +_entity_src_gen.pdbx_gene_src_variant +_entity_src_gen.pdbx_gene_src_cell_line +_entity_src_gen.pdbx_gene_src_atcc +_entity_src_gen.pdbx_gene_src_organ +_entity_src_gen.pdbx_gene_src_organelle +_entity_src_gen.pdbx_gene_src_cell +_entity_src_gen.pdbx_gene_src_cellular_location +_entity_src_gen.host_org_common_name +_entity_src_gen.pdbx_host_org_scientific_name +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id +_entity_src_gen.host_org_genus +_entity_src_gen.pdbx_host_org_gene +_entity_src_gen.pdbx_host_org_organ +_entity_src_gen.host_org_species +_entity_src_gen.pdbx_host_org_tissue +_entity_src_gen.pdbx_host_org_tissue_fraction +_entity_src_gen.pdbx_host_org_strain +_entity_src_gen.pdbx_host_org_variant +_entity_src_gen.pdbx_host_org_cell_line +_entity_src_gen.pdbx_host_org_atcc +_entity_src_gen.pdbx_host_org_culture_collection +_entity_src_gen.pdbx_host_org_cell +_entity_src_gen.pdbx_host_org_organelle +_entity_src_gen.pdbx_host_org_cellular_location +_entity_src_gen.pdbx_host_org_vector_type +_entity_src_gen.pdbx_host_org_vector +_entity_src_gen.host_org_details +_entity_src_gen.expression_system_id +_entity_src_gen.plasmid_name +_entity_src_gen.plasmid_details +_entity_src_gen.pdbx_description +1 1 sample 'Biological sequence' 1 229 2019-nCoV ? 'S, 2' ? ? ? ? ? ? 'Severe acute respiratory syndrome coronavirus 2' 2697049 ? +? ? ? ? ? ? ? 'Spodoptera frugiperda' 7108 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +2 1 sample 'Biological sequence' 1 222 ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? +? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +3 1 sample 'Biological sequence' 1 218 ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? +? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose +;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE +; +'C8 H15 N O6' 221.208 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_pdbx_chem_comp_identifier.comp_id +_pdbx_chem_comp_identifier.type +_pdbx_chem_comp_identifier.program +_pdbx_chem_comp_identifier.program_version +_pdbx_chem_comp_identifier.identifier +NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DGlcpNAcb +NAG 'COMMON NAME' GMML 1.0 N-acetyl-b-D-glucopyranosamine +NAG 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 b-D-GlcpNAc +NAG 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 GlcNAc +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 ARG 1 319 ? ? ? A . n +A 1 2 VAL 2 320 ? ? ? A . n +A 1 3 GLN 3 321 ? ? ? A . n +A 1 4 PRO 4 322 ? ? ? A . n +A 1 5 THR 5 323 ? ? ? A . n +A 1 6 GLU 6 324 ? ? ? A . n +A 1 7 SER 7 325 ? ? ? A . n +A 1 8 ILE 8 326 ? ? ? A . n +A 1 9 VAL 9 327 ? ? ? A . n +A 1 10 ARG 10 328 ? ? ? A . n +A 1 11 PHE 11 329 ? ? ? A . n +A 1 12 PRO 12 330 ? ? ? A . n +A 1 13 ASN 13 331 ? ? ? A . n +A 1 14 ILE 14 332 ? ? ? A . n +A 1 15 THR 15 333 ? ? ? A . n +A 1 16 ASN 16 334 334 ASN ASN A . n +A 1 17 LEU 17 335 335 LEU LEU A . n +A 1 18 CYS 18 336 336 CYS CYS A . n +A 1 19 PRO 19 337 337 PRO PRO A . n +A 1 20 PHE 20 338 338 PHE PHE A . n +A 1 21 GLY 21 339 339 GLY GLY A . n +A 1 22 GLU 22 340 340 GLU GLU A . n +A 1 23 VAL 23 341 341 VAL VAL A . n +A 1 24 PHE 24 342 342 PHE PHE A . n +A 1 25 ASN 25 343 343 ASN ASN A . n +A 1 26 ALA 26 344 344 ALA ALA A . n +A 1 27 THR 27 345 345 THR THR A . n +A 1 28 ARG 28 346 346 ARG ARG A . n +A 1 29 PHE 29 347 347 PHE PHE A . n +A 1 30 ALA 30 348 348 ALA ALA A . n +A 1 31 SER 31 349 349 SER SER A . n +A 1 32 VAL 32 350 350 VAL VAL A . n +A 1 33 TYR 33 351 351 TYR TYR A . n +A 1 34 ALA 34 352 352 ALA ALA A . n +A 1 35 TRP 35 353 353 TRP TRP A . n +A 1 36 ASN 36 354 354 ASN ASN A . n +A 1 37 ARG 37 355 355 ARG ARG A . n +A 1 38 LYS 38 356 356 LYS LYS A . n +A 1 39 ARG 39 357 357 ARG ARG A . n +A 1 40 ILE 40 358 358 ILE ILE A . n +A 1 41 SER 41 359 359 SER SER A . n +A 1 42 ASN 42 360 360 ASN ASN A . n +A 1 43 CYS 43 361 361 CYS CYS A . n +A 1 44 VAL 44 362 362 VAL VAL A . n +A 1 45 ALA 45 363 363 ALA ALA A . n +A 1 46 ASP 46 364 364 ASP ASP A . n +A 1 47 TYR 47 365 365 TYR TYR A . n +A 1 48 SER 48 366 366 SER SER A . n +A 1 49 VAL 49 367 367 VAL VAL A . n +A 1 50 LEU 50 368 368 LEU LEU A . n +A 1 51 TYR 51 369 369 TYR TYR A . n +A 1 52 ASN 52 370 370 ASN ASN A . n +A 1 53 SER 53 371 371 SER SER A . n +A 1 54 ALA 54 372 372 ALA ALA A . n +A 1 55 SER 55 373 373 SER SER A . n +A 1 56 PHE 56 374 374 PHE PHE A . n +A 1 57 SER 57 375 375 SER SER A . n +A 1 58 THR 58 376 376 THR THR A . n +A 1 59 PHE 59 377 377 PHE PHE A . n +A 1 60 LYS 60 378 378 LYS LYS A . n +A 1 61 CYS 61 379 379 CYS CYS A . n +A 1 62 TYR 62 380 380 TYR TYR A . n +A 1 63 GLY 63 381 381 GLY GLY A . n +A 1 64 VAL 64 382 382 VAL VAL A . n +A 1 65 SER 65 383 383 SER SER A . n +A 1 66 PRO 66 384 384 PRO PRO A . n +A 1 67 THR 67 385 385 THR THR A . n +A 1 68 LYS 68 386 386 LYS LYS A . n +A 1 69 LEU 69 387 387 LEU LEU A . n +A 1 70 ASN 70 388 388 ASN ASN A . n +A 1 71 ASP 71 389 389 ASP ASP A . n +A 1 72 LEU 72 390 390 LEU LEU A . n +A 1 73 CYS 73 391 391 CYS CYS A . n +A 1 74 PHE 74 392 392 PHE PHE A . n +A 1 75 THR 75 393 393 THR THR A . n +A 1 76 ASN 76 394 394 ASN ASN A . n +A 1 77 VAL 77 395 395 VAL VAL A . n +A 1 78 TYR 78 396 396 TYR TYR A . n +A 1 79 ALA 79 397 397 ALA ALA A . n +A 1 80 ASP 80 398 398 ASP ASP A . n +A 1 81 SER 81 399 399 SER SER A . n +A 1 82 PHE 82 400 400 PHE PHE A . n +A 1 83 VAL 83 401 401 VAL VAL A . n +A 1 84 ILE 84 402 402 ILE ILE A . n +A 1 85 ARG 85 403 403 ARG ARG A . n +A 1 86 GLY 86 404 404 GLY GLY A . n +A 1 87 ASP 87 405 405 ASP ASP A . n +A 1 88 GLU 88 406 406 GLU GLU A . n +A 1 89 VAL 89 407 407 VAL VAL A . n +A 1 90 ARG 90 408 408 ARG ARG A . n +A 1 91 GLN 91 409 409 GLN GLN A . n +A 1 92 ILE 92 410 410 ILE ILE A . n +A 1 93 ALA 93 411 411 ALA ALA A . n +A 1 94 PRO 94 412 412 PRO PRO A . n +A 1 95 GLY 95 413 413 GLY GLY A . n +A 1 96 GLN 96 414 414 GLN GLN A . n +A 1 97 THR 97 415 415 THR THR A . n +A 1 98 GLY 98 416 416 GLY GLY A . n +A 1 99 LYS 99 417 417 LYS LYS A . n +A 1 100 ILE 100 418 418 ILE ILE A . n +A 1 101 ALA 101 419 419 ALA ALA A . n +A 1 102 ASP 102 420 420 ASP ASP A . n +A 1 103 TYR 103 421 421 TYR TYR A . n +A 1 104 ASN 104 422 422 ASN ASN A . n +A 1 105 TYR 105 423 423 TYR TYR A . n +A 1 106 LYS 106 424 424 LYS LYS A . n +A 1 107 LEU 107 425 425 LEU LEU A . n +A 1 108 PRO 108 426 426 PRO PRO A . n +A 1 109 ASP 109 427 427 ASP ASP A . n +A 1 110 ASP 110 428 428 ASP ASP A . n +A 1 111 PHE 111 429 429 PHE PHE A . n +A 1 112 THR 112 430 430 THR THR A . n +A 1 113 GLY 113 431 431 GLY GLY A . n +A 1 114 CYS 114 432 432 CYS CYS A . n +A 1 115 VAL 115 433 433 VAL VAL A . n +A 1 116 ILE 116 434 434 ILE ILE A . n +A 1 117 ALA 117 435 435 ALA ALA A . n +A 1 118 TRP 118 436 436 TRP TRP A . n +A 1 119 ASN 119 437 437 ASN ASN A . n +A 1 120 SER 120 438 438 SER SER A . n +A 1 121 ASN 121 439 439 ASN ASN A . n +A 1 122 ASN 122 440 440 ASN ASN A . n +A 1 123 LEU 123 441 441 LEU LEU A . n +A 1 124 ASP 124 442 442 ASP ASP A . n +A 1 125 SER 125 443 443 SER SER A . n +A 1 126 LYS 126 444 444 LYS LYS A . n +A 1 127 VAL 127 445 445 VAL VAL A . n +A 1 128 GLY 128 446 446 GLY GLY A . n +A 1 129 GLY 129 447 447 GLY GLY A . n +A 1 130 ASN 130 448 448 ASN ASN A . n +A 1 131 TYR 131 449 449 TYR TYR A . n +A 1 132 ASN 132 450 450 ASN ASN A . n +A 1 133 TYR 133 451 451 TYR TYR A . n +A 1 134 LEU 134 452 452 LEU LEU A . n +A 1 135 TYR 135 453 453 TYR TYR A . n +A 1 136 ARG 136 454 454 ARG ARG A . n +A 1 137 LEU 137 455 455 LEU LEU A . n +A 1 138 PHE 138 456 456 PHE PHE A . n +A 1 139 ARG 139 457 457 ARG ARG A . n +A 1 140 LYS 140 458 458 LYS LYS A . n +A 1 141 SER 141 459 459 SER SER A . n +A 1 142 ASN 142 460 460 ASN ASN A . n +A 1 143 LEU 143 461 461 LEU LEU A . n +A 1 144 LYS 144 462 462 LYS LYS A . n +A 1 145 PRO 145 463 463 PRO PRO A . n +A 1 146 PHE 146 464 464 PHE PHE A . n +A 1 147 GLU 147 465 465 GLU GLU A . n +A 1 148 ARG 148 466 466 ARG ARG A . n +A 1 149 ASP 149 467 467 ASP ASP A . n +A 1 150 ILE 150 468 468 ILE ILE A . n +A 1 151 SER 151 469 469 SER SER A . n +A 1 152 THR 152 470 470 THR THR A . n +A 1 153 GLU 153 471 471 GLU GLU A . n +A 1 154 ILE 154 472 472 ILE ILE A . n +A 1 155 TYR 155 473 473 TYR TYR A . n +A 1 156 GLN 156 474 474 GLN GLN A . n +A 1 157 ALA 157 475 475 ALA ALA A . n +A 1 158 GLY 158 476 476 GLY GLY A . n +A 1 159 SER 159 477 477 SER SER A . n +A 1 160 THR 160 478 478 THR THR A . n +A 1 161 PRO 161 479 479 PRO PRO A . n +A 1 162 CYS 162 480 480 CYS CYS A . n +A 1 163 ASN 163 481 481 ASN ASN A . n +A 1 164 GLY 164 482 482 GLY GLY A . n +A 1 165 VAL 165 483 483 VAL VAL A . n +A 1 166 GLU 166 484 484 GLU GLU A . n +A 1 167 GLY 167 485 485 GLY GLY A . n +A 1 168 PHE 168 486 486 PHE PHE A . n +A 1 169 ASN 169 487 487 ASN ASN A . n +A 1 170 CYS 170 488 488 CYS CYS A . n +A 1 171 TYR 171 489 489 TYR TYR A . n +A 1 172 PHE 172 490 490 PHE PHE A . n +A 1 173 PRO 173 491 491 PRO PRO A . n +A 1 174 LEU 174 492 492 LEU LEU A . n +A 1 175 GLN 175 493 493 GLN GLN A . n +A 1 176 SER 176 494 494 SER SER A . n +A 1 177 TYR 177 495 495 TYR TYR A . n +A 1 178 GLY 178 496 496 GLY GLY A . n +A 1 179 PHE 179 497 497 PHE PHE A . n +A 1 180 GLN 180 498 498 GLN GLN A . n +A 1 181 PRO 181 499 499 PRO PRO A . n +A 1 182 THR 182 500 500 THR THR A . n +A 1 183 ASN 183 501 501 ASN ASN A . n +A 1 184 GLY 184 502 502 GLY GLY A . n +A 1 185 VAL 185 503 503 VAL VAL A . n +A 1 186 GLY 186 504 504 GLY GLY A . n +A 1 187 TYR 187 505 505 TYR TYR A . n +A 1 188 GLN 188 506 506 GLN GLN A . n +A 1 189 PRO 189 507 507 PRO PRO A . n +A 1 190 TYR 190 508 508 TYR TYR A . n +A 1 191 ARG 191 509 509 ARG ARG A . n +A 1 192 VAL 192 510 510 VAL VAL A . n +A 1 193 VAL 193 511 511 VAL VAL A . n +A 1 194 VAL 194 512 512 VAL VAL A . n +A 1 195 LEU 195 513 513 LEU LEU A . n +A 1 196 SER 196 514 514 SER SER A . n +A 1 197 PHE 197 515 515 PHE PHE A . n +A 1 198 GLU 198 516 516 GLU GLU A . n +A 1 199 LEU 199 517 517 LEU LEU A . n +A 1 200 LEU 200 518 518 LEU LEU A . n +A 1 201 HIS 201 519 ? ? ? A . n +A 1 202 ALA 202 520 520 ALA ALA A . n +A 1 203 PRO 203 521 521 PRO PRO A . n +A 1 204 ALA 204 522 522 ALA ALA A . n +A 1 205 THR 205 523 523 THR THR A . n +A 1 206 VAL 206 524 524 VAL VAL A . n +A 1 207 CYS 207 525 525 CYS CYS A . n +A 1 208 GLY 208 526 526 GLY GLY A . n +A 1 209 PRO 209 527 527 PRO PRO A . n +A 1 210 LYS 210 528 528 LYS LYS A . n +A 1 211 LYS 211 529 ? ? ? A . n +A 1 212 SER 212 530 ? ? ? A . n +A 1 213 THR 213 531 ? ? ? A . n +A 1 214 ASN 214 532 ? ? ? A . n +A 1 215 LEU 215 533 ? ? ? A . n +A 1 216 VAL 216 534 ? ? ? A . n +A 1 217 LYS 217 535 ? ? ? A . n +A 1 218 ASN 218 536 ? ? ? A . n +A 1 219 LYS 219 537 ? ? ? A . n +A 1 220 CYS 220 538 ? ? ? A . n +A 1 221 VAL 221 539 ? ? ? A . n +A 1 222 ASN 222 540 ? ? ? A . n +A 1 223 PHE 223 541 ? ? ? A . n +A 1 224 HIS 224 542 ? ? ? A . n +A 1 225 HIS 225 543 ? ? ? A . n +A 1 226 HIS 226 544 ? ? ? A . n +A 1 227 HIS 227 545 ? ? ? A . n +A 1 228 HIS 228 546 ? ? ? A . n +A 1 229 HIS 229 547 ? ? ? A . n +B 2 1 GLY 1 -1 ? ? ? H . n +B 2 2 ASP 2 0 0 ASP ASP H . n +B 2 3 GLU 3 1 1 GLU GLU H . n +B 2 4 VAL 4 2 2 VAL VAL H . n +B 2 5 GLN 5 3 3 GLN GLN H . n +B 2 6 LEU 6 4 4 LEU LEU H . n +B 2 7 VAL 7 5 5 VAL VAL H . n +B 2 8 GLU 8 6 6 GLU GLU H . n +B 2 9 SER 9 7 7 SER SER H . n +B 2 10 GLY 10 8 8 GLY GLY H . n +B 2 11 GLY 11 9 9 GLY GLY H . n +B 2 12 GLY 12 10 10 GLY GLY H . n +B 2 13 LEU 13 11 11 LEU LEU H . n +B 2 14 VAL 14 12 12 VAL VAL H . n +B 2 15 GLN 15 13 13 GLN GLN H . n +B 2 16 PRO 16 14 14 PRO PRO H . n +B 2 17 GLY 17 15 15 GLY GLY H . n +B 2 18 GLY 18 16 16 GLY GLY H . n +B 2 19 SER 19 17 17 SER SER H . n +B 2 20 LEU 20 18 18 LEU LEU H . n +B 2 21 ARG 21 19 19 ARG ARG H . n +B 2 22 LEU 22 20 20 LEU LEU H . n +B 2 23 SER 23 21 21 SER SER H . n +B 2 24 CYS 24 22 22 CYS CYS H . n +B 2 25 ALA 25 23 23 ALA ALA H . n +B 2 26 ALA 26 24 24 ALA ALA H . n +B 2 27 SER 27 25 25 SER SER H . n +B 2 28 GLY 28 26 26 GLY GLY H . n +B 2 29 PHE 29 27 27 PHE PHE H . n +B 2 30 ILE 30 28 28 ILE ILE H . n +B 2 31 VAL 31 29 29 VAL VAL H . n +B 2 32 SER 32 30 30 SER SER H . n +B 2 33 SER 33 31 31 SER SER H . n +B 2 34 ASN 34 32 32 ASN ASN H . n +B 2 35 TYR 35 33 33 TYR TYR H . n +B 2 36 MET 36 34 34 MET MET H . n +B 2 37 SER 37 35 35 SER SER H . n +B 2 38 TRP 38 36 36 TRP TRP H . n +B 2 39 VAL 39 37 37 VAL VAL H . n +B 2 40 ARG 40 38 38 ARG ARG H . n +B 2 41 GLN 41 39 39 GLN GLN H . n +B 2 42 ALA 42 40 40 ALA ALA H . n +B 2 43 PRO 43 41 41 PRO PRO H . n +B 2 44 GLY 44 42 42 GLY GLY H . n +B 2 45 LYS 45 43 43 LYS LYS H . n +B 2 46 GLY 46 44 44 GLY GLY H . n +B 2 47 LEU 47 45 45 LEU LEU H . n +B 2 48 GLU 48 46 46 GLU GLU H . n +B 2 49 TRP 49 47 47 TRP TRP H . n +B 2 50 VAL 50 48 48 VAL VAL H . n +B 2 51 SER 51 49 49 SER SER H . n +B 2 52 VAL 52 50 50 VAL VAL H . n +B 2 53 ILE 53 51 51 ILE ILE H . n +B 2 54 TYR 54 52 52 TYR TYR H . n +B 2 55 SER 55 53 53 SER SER H . n +B 2 56 GLY 56 54 54 GLY GLY H . n +B 2 57 GLY 57 55 55 GLY GLY H . n +B 2 58 SER 58 56 56 SER SER H . n +B 2 59 THR 59 57 57 THR THR H . n +B 2 60 TYR 60 58 58 TYR TYR H . n +B 2 61 TYR 61 59 59 TYR TYR H . n +B 2 62 ALA 62 60 60 ALA ALA H . n +B 2 63 ASP 63 61 61 ASP ASP H . n +B 2 64 SER 64 62 62 SER SER H . n +B 2 65 VAL 65 63 63 VAL VAL H . n +B 2 66 LYS 66 64 64 LYS LYS H . n +B 2 67 GLY 67 65 65 GLY GLY H . n +B 2 68 ARG 68 66 66 ARG ARG H . n +B 2 69 PHE 69 67 67 PHE PHE H . n +B 2 70 THR 70 68 68 THR THR H . n +B 2 71 ILE 71 69 69 ILE ILE H . n +B 2 72 SER 72 70 70 SER SER H . n +B 2 73 ARG 73 71 71 ARG ARG H . n +B 2 74 HIS 74 72 72 HIS HIS H . n +B 2 75 ASN 75 73 73 ASN ASN H . n +B 2 76 SER 76 74 74 SER SER H . n +B 2 77 LYS 77 75 75 LYS LYS H . n +B 2 78 ASN 78 76 76 ASN ASN H . n +B 2 79 THR 79 77 77 THR THR H . n +B 2 80 LEU 80 78 78 LEU LEU H . n +B 2 81 TYR 81 79 79 TYR TYR H . n +B 2 82 LEU 82 80 80 LEU LEU H . n +B 2 83 GLN 83 81 81 GLN GLN H . n +B 2 84 MET 84 82 82 MET MET H . n +B 2 85 ASN 85 83 83 ASN ASN H . n +B 2 86 SER 86 84 84 SER SER H . n +B 2 87 LEU 87 85 85 LEU LEU H . n +B 2 88 ARG 88 86 86 ARG ARG H . n +B 2 89 ALA 89 87 87 ALA ALA H . n +B 2 90 GLU 90 88 88 GLU GLU H . n +B 2 91 ASP 91 89 89 ASP ASP H . n +B 2 92 THR 92 90 90 THR THR H . n +B 2 93 ALA 93 91 91 ALA ALA H . n +B 2 94 VAL 94 92 92 VAL VAL H . n +B 2 95 TYR 95 93 93 TYR TYR H . n +B 2 96 TYR 96 94 94 TYR TYR H . n +B 2 97 CYS 97 95 95 CYS CYS H . n +B 2 98 ALA 98 96 96 ALA ALA H . n +B 2 99 ARG 99 97 97 ARG ARG H . n +B 2 100 GLU 100 98 98 GLU GLU H . n +B 2 101 ALA 101 99 99 ALA ALA H . n +B 2 102 TYR 102 100 100 TYR TYR H . n +B 2 103 GLY 103 101 101 GLY GLY H . n +B 2 104 MET 104 102 102 MET MET H . n +B 2 105 ASP 105 103 103 ASP ASP H . n +B 2 106 VAL 106 104 104 VAL VAL H . n +B 2 107 TRP 107 105 105 TRP TRP H . n +B 2 108 GLY 108 106 106 GLY GLY H . n +B 2 109 GLN 109 107 107 GLN GLN H . n +B 2 110 GLY 110 108 108 GLY GLY H . n +B 2 111 THR 111 109 109 THR THR H . n +B 2 112 THR 112 110 110 THR THR H . n +B 2 113 VAL 113 111 111 VAL VAL H . n +B 2 114 THR 114 112 112 THR THR H . n +B 2 115 VAL 115 113 113 VAL VAL H . n +B 2 116 SER 116 114 114 SER SER H . n +B 2 117 SER 117 115 115 SER SER H . n +B 2 118 ALA 118 116 116 ALA ALA H . n +B 2 119 SER 119 117 117 SER SER H . n +B 2 120 THR 120 118 118 THR THR H . n +B 2 121 LYS 121 119 119 LYS LYS H . n +B 2 122 GLY 122 120 120 GLY GLY H . n +B 2 123 PRO 123 121 121 PRO PRO H . n +B 2 124 SER 124 122 122 SER SER H . n +B 2 125 VAL 125 123 123 VAL VAL H . n +B 2 126 PHE 126 124 124 PHE PHE H . n +B 2 127 PRO 127 125 125 PRO PRO H . n +B 2 128 LEU 128 126 126 LEU LEU H . n +B 2 129 ALA 129 127 127 ALA ALA H . n +B 2 130 PRO 130 128 128 PRO PRO H . n +B 2 131 SER 131 129 129 SER SER H . n +B 2 132 SER 132 130 130 SER SER H . n +B 2 133 LYS 133 131 131 LYS LYS H . n +B 2 134 SER 134 132 132 SER SER H . n +B 2 135 THR 135 133 133 THR THR H . n +B 2 136 SER 136 134 134 SER SER H . n +B 2 137 GLY 137 135 135 GLY GLY H . n +B 2 138 GLY 138 136 136 GLY GLY H . n +B 2 139 THR 139 137 137 THR THR H . n +B 2 140 ALA 140 138 138 ALA ALA H . n +B 2 141 ALA 141 139 139 ALA ALA H . n +B 2 142 LEU 142 140 140 LEU LEU H . n +B 2 143 GLY 143 141 141 GLY GLY H . n +B 2 144 CYS 144 142 142 CYS CYS H . n +B 2 145 LEU 145 143 143 LEU LEU H . n +B 2 146 VAL 146 144 144 VAL VAL H . n +B 2 147 LYS 147 145 145 LYS LYS H . n +B 2 148 ASP 148 146 146 ASP ASP H . n +B 2 149 TYR 149 147 147 TYR TYR H . n +B 2 150 PHE 150 148 148 PHE PHE H . n +B 2 151 PRO 151 149 149 PRO PRO H . n +B 2 152 GLU 152 150 150 GLU GLU H . n +B 2 153 PRO 153 151 151 PRO PRO H . n +B 2 154 VAL 154 152 152 VAL VAL H . n +B 2 155 THR 155 153 153 THR THR H . n +B 2 156 VAL 156 154 154 VAL VAL H . n +B 2 157 SER 157 155 155 SER SER H . n +B 2 158 TRP 158 156 156 TRP TRP H . n +B 2 159 ASN 159 157 157 ASN ASN H . n +B 2 160 SER 160 158 158 SER SER H . n +B 2 161 GLY 161 159 159 GLY GLY H . n +B 2 162 ALA 162 160 160 ALA ALA H . n +B 2 163 LEU 163 161 161 LEU LEU H . n +B 2 164 THR 164 162 162 THR THR H . n +B 2 165 SER 165 163 163 SER SER H . n +B 2 166 GLY 166 164 164 GLY GLY H . n +B 2 167 VAL 167 165 165 VAL VAL H . n +B 2 168 HIS 168 166 166 HIS HIS H . n +B 2 169 THR 169 167 167 THR THR H . n +B 2 170 PHE 170 168 168 PHE PHE H . n +B 2 171 PRO 171 169 169 PRO PRO H . n +B 2 172 ALA 172 170 170 ALA ALA H . n +B 2 173 VAL 173 171 171 VAL VAL H . n +B 2 174 LEU 174 172 172 LEU LEU H . n +B 2 175 GLN 175 173 173 GLN GLN H . n +B 2 176 SER 176 174 174 SER SER H . n +B 2 177 SER 177 175 175 SER SER H . n +B 2 178 GLY 178 176 176 GLY GLY H . n +B 2 179 LEU 179 177 177 LEU LEU H . n +B 2 180 TYR 180 178 178 TYR TYR H . n +B 2 181 SER 181 179 179 SER SER H . n +B 2 182 LEU 182 180 180 LEU LEU H . n +B 2 183 SER 183 181 181 SER SER H . n +B 2 184 SER 184 182 182 SER SER H . n +B 2 185 VAL 185 183 183 VAL VAL H . n +B 2 186 VAL 186 184 184 VAL VAL H . n +B 2 187 THR 187 185 185 THR THR H . n +B 2 188 VAL 188 186 186 VAL VAL H . n +B 2 189 PRO 189 187 187 PRO PRO H . n +B 2 190 SER 190 188 188 SER SER H . n +B 2 191 SER 191 189 189 SER SER H . n +B 2 192 SER 192 190 190 SER SER H . n +B 2 193 LEU 193 191 191 LEU LEU H . n +B 2 194 GLY 194 192 192 GLY GLY H . n +B 2 195 THR 195 193 193 THR THR H . n +B 2 196 GLN 196 194 194 GLN GLN H . n +B 2 197 THR 197 195 195 THR THR H . n +B 2 198 TYR 198 196 196 TYR TYR H . n +B 2 199 ILE 199 197 197 ILE ILE H . n +B 2 200 CYS 200 198 198 CYS CYS H . n +B 2 201 ASN 201 199 199 ASN ASN H . n +B 2 202 VAL 202 200 200 VAL VAL H . n +B 2 203 ASN 203 201 201 ASN ASN H . n +B 2 204 HIS 204 202 202 HIS HIS H . n +B 2 205 LYS 205 203 203 LYS LYS H . n +B 2 206 PRO 206 204 204 PRO PRO H . n +B 2 207 SER 207 205 205 SER SER H . n +B 2 208 ASN 208 206 206 ASN ASN H . n +B 2 209 THR 209 207 207 THR THR H . n +B 2 210 LYS 210 208 208 LYS LYS H . n +B 2 211 VAL 211 209 209 VAL VAL H . n +B 2 212 ASP 212 210 210 ASP ASP H . n +B 2 213 LYS 213 211 211 LYS LYS H . n +B 2 214 ARG 214 212 212 ARG ARG H . n +B 2 215 VAL 215 213 213 VAL VAL H . n +B 2 216 GLU 216 214 214 GLU GLU H . n +B 2 217 PRO 217 215 215 PRO PRO H . n +B 2 218 LYS 218 216 216 LYS LYS H . n +B 2 219 SER 219 217 217 SER SER H . n +B 2 220 CYS 220 218 ? ? ? H . n +B 2 221 ASP 221 219 ? ? ? H . n +B 2 222 LYS 222 220 ? ? ? H . n +C 3 1 GLY 1 -1 ? ? ? L . n +C 3 2 ASP 2 0 0 ASP ASP L . n +C 3 3 ASP 3 1 1 ASP ASP L . n +C 3 4 ILE 4 2 2 ILE ILE L . n +C 3 5 VAL 5 3 3 VAL VAL L . n +C 3 6 MET 6 4 4 MET MET L . n +C 3 7 THR 7 5 5 THR THR L . n +C 3 8 GLN 8 6 6 GLN GLN L . n +C 3 9 SER 9 7 7 SER SER L . n +C 3 10 PRO 10 8 8 PRO PRO L . n +C 3 11 SER 11 9 9 SER SER L . n +C 3 12 PHE 12 10 10 PHE PHE L . n +C 3 13 LEU 13 11 11 LEU LEU L . n +C 3 14 SER 14 12 12 SER SER L . n +C 3 15 ALA 15 13 13 ALA ALA L . n +C 3 16 SER 16 14 14 SER SER L . n +C 3 17 VAL 17 15 15 VAL VAL L . n +C 3 18 GLY 18 16 16 GLY GLY L . n +C 3 19 ASP 19 17 17 ASP ASP L . n +C 3 20 ARG 20 18 18 ARG ARG L . n +C 3 21 VAL 21 19 19 VAL VAL L . n +C 3 22 THR 22 20 20 THR THR L . n +C 3 23 ILE 23 21 21 ILE ILE L . n +C 3 24 THR 24 22 22 THR THR L . n +C 3 25 CYS 25 23 23 CYS CYS L . n +C 3 26 ARG 26 24 24 ARG ARG L . n +C 3 27 ALA 27 25 25 ALA ALA L . n +C 3 28 SER 28 26 26 SER SER L . n +C 3 29 GLN 29 27 27 GLN GLN L . n +C 3 30 GLY 30 28 28 GLY GLY L . n +C 3 31 ILE 31 29 29 ILE ILE L . n +C 3 32 SER 32 30 30 SER SER L . n +C 3 33 SER 33 31 31 SER SER L . n +C 3 34 TYR 34 32 32 TYR TYR L . n +C 3 35 LEU 35 33 33 LEU LEU L . n +C 3 36 ALA 36 34 34 ALA ALA L . n +C 3 37 TRP 37 35 35 TRP TRP L . n +C 3 38 TYR 38 36 36 TYR TYR L . n +C 3 39 GLN 39 37 37 GLN GLN L . n +C 3 40 GLN 40 38 38 GLN GLN L . n +C 3 41 LYS 41 39 39 LYS LYS L . n +C 3 42 PRO 42 40 40 PRO PRO L . n +C 3 43 GLY 43 41 41 GLY GLY L . n +C 3 44 LYS 44 42 42 LYS LYS L . n +C 3 45 ALA 45 43 43 ALA ALA L . n +C 3 46 PRO 46 44 44 PRO PRO L . n +C 3 47 LYS 47 45 45 LYS LYS L . n +C 3 48 LEU 48 46 46 LEU LEU L . n +C 3 49 LEU 49 47 47 LEU LEU L . n +C 3 50 ILE 50 48 48 ILE ILE L . n +C 3 51 TYR 51 49 49 TYR TYR L . n +C 3 52 ALA 52 50 50 ALA ALA L . n +C 3 53 ALA 53 51 51 ALA ALA L . n +C 3 54 SER 54 52 52 SER SER L . n +C 3 55 THR 55 53 53 THR THR L . n +C 3 56 LEU 56 54 54 LEU LEU L . n +C 3 57 GLN 57 55 55 GLN GLN L . n +C 3 58 SER 58 56 56 SER SER L . n +C 3 59 GLY 59 57 57 GLY GLY L . n +C 3 60 VAL 60 58 58 VAL VAL L . n +C 3 61 PRO 61 59 59 PRO PRO L . n +C 3 62 SER 62 60 60 SER SER L . n +C 3 63 ARG 63 61 61 ARG ARG L . n +C 3 64 PHE 64 62 62 PHE PHE L . n +C 3 65 SER 65 63 63 SER SER L . n +C 3 66 GLY 66 64 64 GLY GLY L . n +C 3 67 SER 67 65 65 SER SER L . n +C 3 68 GLY 68 66 66 GLY GLY L . n +C 3 69 SER 69 67 67 SER SER L . n +C 3 70 GLY 70 68 68 GLY GLY L . n +C 3 71 THR 71 69 69 THR THR L . n +C 3 72 GLU 72 70 70 GLU GLU L . n +C 3 73 PHE 73 71 71 PHE PHE L . n +C 3 74 THR 74 72 72 THR THR L . n +C 3 75 LEU 75 73 73 LEU LEU L . n +C 3 76 THR 76 74 74 THR THR L . n +C 3 77 ILE 77 75 75 ILE ILE L . n +C 3 78 SER 78 76 76 SER SER L . n +C 3 79 SER 79 77 77 SER SER L . n +C 3 80 LEU 80 78 78 LEU LEU L . n +C 3 81 GLN 81 79 79 GLN GLN L . n +C 3 82 PRO 82 80 80 PRO PRO L . n +C 3 83 GLU 83 81 81 GLU GLU L . n +C 3 84 ASP 84 82 82 ASP ASP L . n +C 3 85 PHE 85 83 83 PHE PHE L . n +C 3 86 ALA 86 84 84 ALA ALA L . n +C 3 87 THR 87 85 85 THR THR L . n +C 3 88 TYR 88 86 86 TYR TYR L . n +C 3 89 TYR 89 87 87 TYR TYR L . n +C 3 90 CYS 90 88 88 CYS CYS L . n +C 3 91 GLN 91 89 89 GLN GLN L . n +C 3 92 GLN 92 90 90 GLN GLN L . n +C 3 93 LEU 93 91 91 LEU LEU L . n +C 3 94 ASN 94 92 92 ASN ASN L . n +C 3 95 SER 95 93 93 SER SER L . n +C 3 96 TYR 96 94 94 TYR TYR L . n +C 3 97 PRO 97 95 95 PRO PRO L . n +C 3 98 PRO 98 96 96 PRO PRO L . n +C 3 99 TYR 99 97 97 TYR TYR L . n +C 3 100 THR 100 98 98 THR THR L . n +C 3 101 PHE 101 99 99 PHE PHE L . n +C 3 102 GLY 102 100 100 GLY GLY L . n +C 3 103 GLN 103 101 101 GLN GLN L . n +C 3 104 GLY 104 102 102 GLY GLY L . n +C 3 105 THR 105 103 103 THR THR L . n +C 3 106 LYS 106 104 104 LYS LYS L . n +C 3 107 LEU 107 105 105 LEU LEU L . n +C 3 108 GLU 108 106 106 GLU GLU L . n +C 3 109 ILE 109 107 107 ILE ILE L . n +C 3 110 LYS 110 108 108 LYS LYS L . n +C 3 111 ARG 111 109 109 ARG ARG L . n +C 3 112 THR 112 110 110 THR THR L . n +C 3 113 VAL 113 111 111 VAL VAL L . n +C 3 114 ALA 114 112 112 ALA ALA L . n +C 3 115 ALA 115 113 113 ALA ALA L . n +C 3 116 PRO 116 114 114 PRO PRO L . n +C 3 117 SER 117 115 115 SER SER L . n +C 3 118 VAL 118 116 116 VAL VAL L . n +C 3 119 PHE 119 117 117 PHE PHE L . n +C 3 120 ILE 120 118 118 ILE ILE L . n +C 3 121 PHE 121 119 119 PHE PHE L . n +C 3 122 PRO 122 120 120 PRO PRO L . n +C 3 123 PRO 123 121 121 PRO PRO L . n +C 3 124 SER 124 122 122 SER SER L . n +C 3 125 ASP 125 123 123 ASP ASP L . n +C 3 126 GLU 126 124 124 GLU GLU L . n +C 3 127 GLN 127 125 125 GLN GLN L . n +C 3 128 LEU 128 126 126 LEU LEU L . n +C 3 129 LYS 129 127 127 LYS LYS L . n +C 3 130 SER 130 128 128 SER SER L . n +C 3 131 GLY 131 129 129 GLY GLY L . n +C 3 132 THR 132 130 130 THR THR L . n +C 3 133 ALA 133 131 131 ALA ALA L . n +C 3 134 SER 134 132 132 SER SER L . n +C 3 135 VAL 135 133 133 VAL VAL L . n +C 3 136 VAL 136 134 134 VAL VAL L . n +C 3 137 CYS 137 135 135 CYS CYS L . n +C 3 138 LEU 138 136 136 LEU LEU L . n +C 3 139 LEU 139 137 137 LEU LEU L . n +C 3 140 ASN 140 138 138 ASN ASN L . n +C 3 141 ASN 141 139 139 ASN ASN L . n +C 3 142 PHE 142 140 140 PHE PHE L . n +C 3 143 TYR 143 141 141 TYR TYR L . n +C 3 144 PRO 144 142 142 PRO PRO L . n +C 3 145 ARG 145 143 143 ARG ARG L . n +C 3 146 GLU 146 144 144 GLU GLU L . n +C 3 147 ALA 147 145 145 ALA ALA L . n +C 3 148 LYS 148 146 146 LYS LYS L . n +C 3 149 VAL 149 147 147 VAL VAL L . n +C 3 150 GLN 150 148 148 GLN GLN L . n +C 3 151 TRP 151 149 149 TRP TRP L . n +C 3 152 LYS 152 150 150 LYS LYS L . n +C 3 153 VAL 153 151 151 VAL VAL L . n +C 3 154 ASP 154 152 152 ASP ASP L . n +C 3 155 ASN 155 153 153 ASN ASN L . n +C 3 156 ALA 156 154 154 ALA ALA L . n +C 3 157 LEU 157 155 155 LEU LEU L . n +C 3 158 GLN 158 156 156 GLN GLN L . n +C 3 159 SER 159 157 157 SER SER L . n +C 3 160 GLY 160 158 158 GLY GLY L . n +C 3 161 ASN 161 159 159 ASN ASN L . n +C 3 162 SER 162 160 160 SER SER L . n +C 3 163 GLN 163 161 161 GLN GLN L . n +C 3 164 GLU 164 162 162 GLU GLU L . n +C 3 165 SER 165 163 163 SER SER L . n +C 3 166 VAL 166 164 164 VAL VAL L . n +C 3 167 THR 167 165 165 THR THR L . n +C 3 168 GLU 168 166 166 GLU GLU L . n +C 3 169 GLN 169 167 167 GLN GLN L . n +C 3 170 ASP 170 168 168 ASP ASP L . n +C 3 171 SER 171 169 169 SER SER L . n +C 3 172 LYS 172 170 170 LYS LYS L . n +C 3 173 ASP 173 171 171 ASP ASP L . n +C 3 174 SER 174 172 172 SER SER L . n +C 3 175 THR 175 173 173 THR THR L . n +C 3 176 TYR 176 174 174 TYR TYR L . n +C 3 177 SER 177 175 175 SER SER L . n +C 3 178 LEU 178 176 176 LEU LEU L . n +C 3 179 SER 179 177 177 SER SER L . n +C 3 180 SER 180 178 178 SER SER L . n +C 3 181 THR 181 179 179 THR THR L . n +C 3 182 LEU 182 180 180 LEU LEU L . n +C 3 183 THR 183 181 181 THR THR L . n +C 3 184 LEU 184 182 182 LEU LEU L . n +C 3 185 SER 185 183 183 SER SER L . n +C 3 186 LYS 186 184 184 LYS LYS L . n +C 3 187 ALA 187 185 185 ALA ALA L . n +C 3 188 ASP 188 186 186 ASP ASP L . n +C 3 189 TYR 189 187 187 TYR TYR L . n +C 3 190 GLU 190 188 188 GLU GLU L . n +C 3 191 LYS 191 189 189 LYS LYS L . n +C 3 192 HIS 192 190 190 HIS HIS L . n +C 3 193 LYS 193 191 191 LYS LYS L . n +C 3 194 VAL 194 192 192 VAL VAL L . n +C 3 195 TYR 195 193 193 TYR TYR L . n +C 3 196 ALA 196 194 194 ALA ALA L . n +C 3 197 CYS 197 195 195 CYS CYS L . n +C 3 198 GLU 198 196 196 GLU GLU L . n +C 3 199 VAL 199 197 197 VAL VAL L . n +C 3 200 THR 200 198 198 THR THR L . n +C 3 201 HIS 201 199 199 HIS HIS L . n +C 3 202 GLN 202 200 200 GLN GLN L . n +C 3 203 GLY 203 201 201 GLY GLY L . n +C 3 204 LEU 204 202 202 LEU LEU L . n +C 3 205 SER 205 203 203 SER SER L . n +C 3 206 SER 206 204 204 SER SER L . n +C 3 207 PRO 207 205 205 PRO PRO L . n +C 3 208 VAL 208 206 206 VAL VAL L . n +C 3 209 THR 209 207 207 THR THR L . n +C 3 210 LYS 210 208 208 LYS LYS L . n +C 3 211 SER 211 209 209 SER SER L . n +C 3 212 PHE 212 210 210 PHE PHE L . n +C 3 213 ASN 213 211 211 ASN ASN L . n +C 3 214 ARG 214 212 212 ARG ARG L . n +C 3 215 GLY 215 213 213 GLY GLY L . n +C 3 216 GLU 216 214 214 GLU GLU L . n +C 3 217 CYS 217 215 215 CYS CYS L . n +C 3 218 SER 218 216 ? ? ? L . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +D 4 NAG 1 601 619 NAG NAG A . +E 5 HOH 1 701 42 HOH HOH A . +E 5 HOH 2 702 36 HOH HOH A . +E 5 HOH 3 703 164 HOH HOH A . +E 5 HOH 4 704 478 HOH HOH A . +E 5 HOH 5 705 40 HOH HOH A . +E 5 HOH 6 706 384 HOH HOH A . +E 5 HOH 7 707 188 HOH HOH A . +E 5 HOH 8 708 90 HOH HOH A . +E 5 HOH 9 709 193 HOH HOH A . +E 5 HOH 10 710 112 HOH HOH A . +E 5 HOH 11 711 277 HOH HOH A . +E 5 HOH 12 712 502 HOH HOH A . +E 5 HOH 13 713 212 HOH HOH A . +E 5 HOH 14 714 380 HOH HOH A . +E 5 HOH 15 715 200 HOH HOH A . +E 5 HOH 16 716 439 HOH HOH A . +E 5 HOH 17 717 48 HOH HOH A . +E 5 HOH 18 718 265 HOH HOH A . +E 5 HOH 19 719 190 HOH HOH A . +E 5 HOH 20 720 60 HOH HOH A . +E 5 HOH 21 721 353 HOH HOH A . +E 5 HOH 22 722 16 HOH HOH A . +E 5 HOH 23 723 299 HOH HOH A . +E 5 HOH 24 724 20 HOH HOH A . +E 5 HOH 25 725 152 HOH HOH A . +E 5 HOH 26 726 14 HOH HOH A . +E 5 HOH 27 727 269 HOH HOH A . +E 5 HOH 28 728 135 HOH HOH A . +E 5 HOH 29 729 483 HOH HOH A . +E 5 HOH 30 730 246 HOH HOH A . +E 5 HOH 31 731 46 HOH HOH A . +E 5 HOH 32 732 8 HOH HOH A . +E 5 HOH 33 733 303 HOH HOH A . +E 5 HOH 34 734 113 HOH HOH A . +E 5 HOH 35 735 101 HOH HOH A . +E 5 HOH 36 736 12 HOH HOH A . +E 5 HOH 37 737 83 HOH HOH A . +E 5 HOH 38 738 196 HOH HOH A . +E 5 HOH 39 739 323 HOH HOH A . +E 5 HOH 40 740 149 HOH HOH A . +E 5 HOH 41 741 371 HOH HOH A . +E 5 HOH 42 742 151 HOH HOH A . +E 5 HOH 43 743 362 HOH HOH A . +E 5 HOH 44 744 4 HOH HOH A . +E 5 HOH 45 745 84 HOH HOH A . +E 5 HOH 46 746 259 HOH HOH A . +E 5 HOH 47 747 476 HOH HOH A . +E 5 HOH 48 748 264 HOH HOH A . +E 5 HOH 49 749 97 HOH HOH A . +E 5 HOH 50 750 25 HOH HOH A . +E 5 HOH 51 751 291 HOH HOH A . +E 5 HOH 52 752 2 HOH HOH A . +E 5 HOH 53 753 41 HOH HOH A . +E 5 HOH 54 754 1 HOH HOH A . +E 5 HOH 55 755 372 HOH HOH A . +E 5 HOH 56 756 67 HOH HOH A . +E 5 HOH 57 757 5 HOH HOH A . +E 5 HOH 58 758 517 HOH HOH A . +E 5 HOH 59 759 218 HOH HOH A . +E 5 HOH 60 760 82 HOH HOH A . +E 5 HOH 61 761 89 HOH HOH A . +E 5 HOH 62 762 328 HOH HOH A . +E 5 HOH 63 763 79 HOH HOH A . +E 5 HOH 64 764 317 HOH HOH A . +E 5 HOH 65 765 167 HOH HOH A . +E 5 HOH 66 766 226 HOH HOH A . +E 5 HOH 67 767 239 HOH HOH A . +E 5 HOH 68 768 102 HOH HOH A . +E 5 HOH 69 769 3 HOH HOH A . +E 5 HOH 70 770 415 HOH HOH A . +E 5 HOH 71 771 54 HOH HOH A . +E 5 HOH 72 772 315 HOH HOH A . +E 5 HOH 73 773 136 HOH HOH A . +E 5 HOH 74 774 340 HOH HOH A . +E 5 HOH 75 775 166 HOH HOH A . +E 5 HOH 76 776 108 HOH HOH A . +E 5 HOH 77 777 39 HOH HOH A . +E 5 HOH 78 778 305 HOH HOH A . +E 5 HOH 79 779 29 HOH HOH A . +E 5 HOH 80 780 383 HOH HOH A . +E 5 HOH 81 781 230 HOH HOH A . +E 5 HOH 82 782 499 HOH HOH A . +E 5 HOH 83 783 251 HOH HOH A . +E 5 HOH 84 784 471 HOH HOH A . +E 5 HOH 85 785 155 HOH HOH A . +E 5 HOH 86 786 109 HOH HOH A . +E 5 HOH 87 787 178 HOH HOH A . +E 5 HOH 88 788 245 HOH HOH A . +E 5 HOH 89 789 488 HOH HOH A . +E 5 HOH 90 790 133 HOH HOH A . +E 5 HOH 91 791 503 HOH HOH A . +E 5 HOH 92 792 50 HOH HOH A . +E 5 HOH 93 793 293 HOH HOH A . +E 5 HOH 94 794 311 HOH HOH A . +E 5 HOH 95 795 70 HOH HOH A . +E 5 HOH 96 796 339 HOH HOH A . +E 5 HOH 97 797 161 HOH HOH A . +E 5 HOH 98 798 203 HOH HOH A . +E 5 HOH 99 799 332 HOH HOH A . +E 5 HOH 100 800 390 HOH HOH A . +E 5 HOH 101 801 459 HOH HOH A . +E 5 HOH 102 802 100 HOH HOH A . +E 5 HOH 103 803 180 HOH HOH A . +E 5 HOH 104 804 442 HOH HOH A . +E 5 HOH 105 805 466 HOH HOH A . +E 5 HOH 106 806 430 HOH HOH A . +E 5 HOH 107 807 233 HOH HOH A . +E 5 HOH 108 808 427 HOH HOH A . +E 5 HOH 109 809 420 HOH HOH A . +E 5 HOH 110 810 460 HOH HOH A . +E 5 HOH 111 811 241 HOH HOH A . +E 5 HOH 112 812 294 HOH HOH A . +E 5 HOH 113 813 342 HOH HOH A . +E 5 HOH 114 814 194 HOH HOH A . +E 5 HOH 115 815 487 HOH HOH A . +E 5 HOH 116 816 318 HOH HOH A . +E 5 HOH 117 817 433 HOH HOH A . +E 5 HOH 118 818 262 HOH HOH A . +E 5 HOH 119 819 473 HOH HOH A . +E 5 HOH 120 820 453 HOH HOH A . +E 5 HOH 121 821 404 HOH HOH A . +E 5 HOH 122 822 276 HOH HOH A . +E 5 HOH 123 823 336 HOH HOH A . +E 5 HOH 124 824 506 HOH HOH A . +E 5 HOH 125 825 491 HOH HOH A . +E 5 HOH 126 826 516 HOH HOH A . +F 5 HOH 1 301 234 HOH HOH H . +F 5 HOH 2 302 295 HOH HOH H . +F 5 HOH 3 303 173 HOH HOH H . +F 5 HOH 4 304 45 HOH HOH H . +F 5 HOH 5 305 114 HOH HOH H . +F 5 HOH 6 306 373 HOH HOH H . +F 5 HOH 7 307 9 HOH HOH H . +F 5 HOH 8 308 209 HOH HOH H . +F 5 HOH 9 309 105 HOH HOH H . +F 5 HOH 10 310 296 HOH HOH H . +F 5 HOH 11 311 139 HOH HOH H . +F 5 HOH 12 312 159 HOH HOH H . +F 5 HOH 13 313 216 HOH HOH H . +F 5 HOH 14 314 106 HOH HOH H . +F 5 HOH 15 315 350 HOH HOH H . +F 5 HOH 16 316 10 HOH HOH H . +F 5 HOH 17 317 187 HOH HOH H . +F 5 HOH 18 318 231 HOH HOH H . +F 5 HOH 19 319 30 HOH HOH H . +F 5 HOH 20 320 207 HOH HOH H . +F 5 HOH 21 321 96 HOH HOH H . +F 5 HOH 22 322 118 HOH HOH H . +F 5 HOH 23 323 31 HOH HOH H . +F 5 HOH 24 324 392 HOH HOH H . +F 5 HOH 25 325 99 HOH HOH H . +F 5 HOH 26 326 72 HOH HOH H . +F 5 HOH 27 327 53 HOH HOH H . +F 5 HOH 28 328 142 HOH HOH H . +F 5 HOH 29 329 28 HOH HOH H . +F 5 HOH 30 330 273 HOH HOH H . +F 5 HOH 31 331 206 HOH HOH H . +F 5 HOH 32 332 198 HOH HOH H . +F 5 HOH 33 333 250 HOH HOH H . +F 5 HOH 34 334 355 HOH HOH H . +F 5 HOH 35 335 213 HOH HOH H . +F 5 HOH 36 336 117 HOH HOH H . +F 5 HOH 37 337 210 HOH HOH H . +F 5 HOH 38 338 116 HOH HOH H . +F 5 HOH 39 339 398 HOH HOH H . +F 5 HOH 40 340 134 HOH HOH H . +F 5 HOH 41 341 165 HOH HOH H . +F 5 HOH 42 342 22 HOH HOH H . +F 5 HOH 43 343 257 HOH HOH H . +F 5 HOH 44 344 104 HOH HOH H . +F 5 HOH 45 345 27 HOH HOH H . +F 5 HOH 46 346 512 HOH HOH H . +F 5 HOH 47 347 201 HOH HOH H . +F 5 HOH 48 348 278 HOH HOH H . +F 5 HOH 49 349 369 HOH HOH H . +F 5 HOH 50 350 298 HOH HOH H . +F 5 HOH 51 351 143 HOH HOH H . +F 5 HOH 52 352 51 HOH HOH H . +F 5 HOH 53 353 225 HOH HOH H . +F 5 HOH 54 354 184 HOH HOH H . +F 5 HOH 55 355 376 HOH HOH H . +F 5 HOH 56 356 370 HOH HOH H . +F 5 HOH 57 357 348 HOH HOH H . +F 5 HOH 58 358 77 HOH HOH H . +F 5 HOH 59 359 15 HOH HOH H . +F 5 HOH 60 360 312 HOH HOH H . +F 5 HOH 61 361 243 HOH HOH H . +F 5 HOH 62 362 429 HOH HOH H . +F 5 HOH 63 363 145 HOH HOH H . +F 5 HOH 64 364 92 HOH HOH H . +F 5 HOH 65 365 19 HOH HOH H . +F 5 HOH 66 366 55 HOH HOH H . +F 5 HOH 67 367 26 HOH HOH H . +F 5 HOH 68 368 130 HOH HOH H . +F 5 HOH 69 369 24 HOH HOH H . +F 5 HOH 70 370 474 HOH HOH H . +F 5 HOH 71 371 147 HOH HOH H . +F 5 HOH 72 372 260 HOH HOH H . +F 5 HOH 73 373 21 HOH HOH H . +F 5 HOH 74 374 267 HOH HOH H . +F 5 HOH 75 375 326 HOH HOH H . +F 5 HOH 76 376 35 HOH HOH H . +F 5 HOH 77 377 7 HOH HOH H . +F 5 HOH 78 378 419 HOH HOH H . +F 5 HOH 79 379 195 HOH HOH H . +F 5 HOH 80 380 37 HOH HOH H . +F 5 HOH 81 381 132 HOH HOH H . +F 5 HOH 82 382 414 HOH HOH H . +F 5 HOH 83 383 211 HOH HOH H . +F 5 HOH 84 384 162 HOH HOH H . +F 5 HOH 85 385 418 HOH HOH H . +F 5 HOH 86 386 59 HOH HOH H . +F 5 HOH 87 387 344 HOH HOH H . +F 5 HOH 88 388 242 HOH HOH H . +F 5 HOH 89 389 111 HOH HOH H . +F 5 HOH 90 390 17 HOH HOH H . +F 5 HOH 91 391 141 HOH HOH H . +F 5 HOH 92 392 308 HOH HOH H . +F 5 HOH 93 393 208 HOH HOH H . +F 5 HOH 94 394 6 HOH HOH H . +F 5 HOH 95 395 337 HOH HOH H . +F 5 HOH 96 396 107 HOH HOH H . +F 5 HOH 97 397 268 HOH HOH H . +F 5 HOH 98 398 150 HOH HOH H . +F 5 HOH 99 399 343 HOH HOH H . +F 5 HOH 100 400 160 HOH HOH H . +F 5 HOH 101 401 174 HOH HOH H . +F 5 HOH 102 402 229 HOH HOH H . +F 5 HOH 103 403 237 HOH HOH H . +F 5 HOH 104 404 224 HOH HOH H . +F 5 HOH 105 405 385 HOH HOH H . +F 5 HOH 106 406 86 HOH HOH H . +F 5 HOH 107 407 495 HOH HOH H . +F 5 HOH 108 408 175 HOH HOH H . +F 5 HOH 109 409 321 HOH HOH H . +F 5 HOH 110 410 156 HOH HOH H . +F 5 HOH 111 411 78 HOH HOH H . +F 5 HOH 112 412 256 HOH HOH H . +F 5 HOH 113 413 75 HOH HOH H . +F 5 HOH 114 414 496 HOH HOH H . +F 5 HOH 115 415 63 HOH HOH H . +F 5 HOH 116 416 115 HOH HOH H . +F 5 HOH 117 417 456 HOH HOH H . +F 5 HOH 118 418 345 HOH HOH H . +F 5 HOH 119 419 81 HOH HOH H . +F 5 HOH 120 420 163 HOH HOH H . +F 5 HOH 121 421 52 HOH HOH H . +F 5 HOH 122 422 49 HOH HOH H . +F 5 HOH 123 423 395 HOH HOH H . +F 5 HOH 124 424 217 HOH HOH H . +F 5 HOH 125 425 221 HOH HOH H . +F 5 HOH 126 426 128 HOH HOH H . +F 5 HOH 127 427 56 HOH HOH H . +F 5 HOH 128 428 403 HOH HOH H . +F 5 HOH 129 429 85 HOH HOH H . +F 5 HOH 130 430 238 HOH HOH H . +F 5 HOH 131 431 248 HOH HOH H . +F 5 HOH 132 432 110 HOH HOH H . +F 5 HOH 133 433 289 HOH HOH H . +F 5 HOH 134 434 444 HOH HOH H . +F 5 HOH 135 435 504 HOH HOH H . +F 5 HOH 136 436 465 HOH HOH H . +F 5 HOH 137 437 445 HOH HOH H . +F 5 HOH 138 438 202 HOH HOH H . +F 5 HOH 139 439 171 HOH HOH H . +F 5 HOH 140 440 64 HOH HOH H . +F 5 HOH 141 441 382 HOH HOH H . +F 5 HOH 142 442 301 HOH HOH H . +F 5 HOH 143 443 454 HOH HOH H . +F 5 HOH 144 444 320 HOH HOH H . +F 5 HOH 145 445 367 HOH HOH H . +F 5 HOH 146 446 62 HOH HOH H . +F 5 HOH 147 447 325 HOH HOH H . +F 5 HOH 148 448 431 HOH HOH H . +F 5 HOH 149 449 381 HOH HOH H . +F 5 HOH 150 450 391 HOH HOH H . +F 5 HOH 151 451 126 HOH HOH H . +F 5 HOH 152 452 436 HOH HOH H . +F 5 HOH 153 453 266 HOH HOH H . +F 5 HOH 154 454 189 HOH HOH H . +F 5 HOH 155 455 518 HOH HOH H . +F 5 HOH 156 456 408 HOH HOH H . +F 5 HOH 157 457 313 HOH HOH H . +F 5 HOH 158 458 462 HOH HOH H . +F 5 HOH 159 459 449 HOH HOH H . +F 5 HOH 160 460 154 HOH HOH H . +F 5 HOH 161 461 484 HOH HOH H . +F 5 HOH 162 462 509 HOH HOH H . +F 5 HOH 163 463 375 HOH HOH H . +F 5 HOH 164 464 464 HOH HOH H . +F 5 HOH 165 465 249 HOH HOH H . +F 5 HOH 166 466 402 HOH HOH H . +F 5 HOH 167 467 359 HOH HOH H . +F 5 HOH 168 468 179 HOH HOH H . +F 5 HOH 169 469 452 HOH HOH H . +F 5 HOH 170 470 364 HOH HOH H . +F 5 HOH 171 471 300 HOH HOH H . +F 5 HOH 172 472 281 HOH HOH H . +F 5 HOH 173 473 485 HOH HOH H . +F 5 HOH 174 474 223 HOH HOH H . +F 5 HOH 175 475 124 HOH HOH H . +F 5 HOH 176 476 508 HOH HOH H . +F 5 HOH 177 477 354 HOH HOH H . +F 5 HOH 178 478 261 HOH HOH H . +F 5 HOH 179 479 374 HOH HOH H . +F 5 HOH 180 480 399 HOH HOH H . +F 5 HOH 181 481 306 HOH HOH H . +F 5 HOH 182 482 347 HOH HOH H . +F 5 HOH 183 483 493 HOH HOH H . +F 5 HOH 184 484 406 HOH HOH H . +F 5 HOH 185 485 515 HOH HOH H . +F 5 HOH 186 486 480 HOH HOH H . +F 5 HOH 187 487 366 HOH HOH H . +F 5 HOH 188 488 379 HOH HOH H . +F 5 HOH 189 489 252 HOH HOH H . +F 5 HOH 190 490 393 HOH HOH H . +F 5 HOH 191 491 131 HOH HOH H . +F 5 HOH 192 492 468 HOH HOH H . +F 5 HOH 193 493 513 HOH HOH H . +F 5 HOH 194 494 235 HOH HOH H . +F 5 HOH 195 495 446 HOH HOH H . +F 5 HOH 196 496 438 HOH HOH H . +F 5 HOH 197 497 458 HOH HOH H . +F 5 HOH 198 498 514 HOH HOH H . +F 5 HOH 199 499 290 HOH HOH H . +F 5 HOH 200 500 137 HOH HOH H . +F 5 HOH 201 501 58 HOH HOH H . +F 5 HOH 202 502 236 HOH HOH H . +F 5 HOH 203 503 500 HOH HOH H . +F 5 HOH 204 504 351 HOH HOH H . +F 5 HOH 205 505 386 HOH HOH H . +F 5 HOH 206 506 363 HOH HOH H . +F 5 HOH 207 507 387 HOH HOH H . +F 5 HOH 208 508 279 HOH HOH H . +F 5 HOH 209 509 481 HOH HOH H . +G 5 HOH 1 301 148 HOH HOH L . +G 5 HOH 2 302 140 HOH HOH L . +G 5 HOH 3 303 69 HOH HOH L . +G 5 HOH 4 304 34 HOH HOH L . +G 5 HOH 5 305 346 HOH HOH L . +G 5 HOH 6 306 309 HOH HOH L . +G 5 HOH 7 307 191 HOH HOH L . +G 5 HOH 8 308 467 HOH HOH L . +G 5 HOH 9 309 304 HOH HOH L . +G 5 HOH 10 310 283 HOH HOH L . +G 5 HOH 11 311 421 HOH HOH L . +G 5 HOH 12 312 377 HOH HOH L . +G 5 HOH 13 313 365 HOH HOH L . +G 5 HOH 14 314 361 HOH HOH L . +G 5 HOH 15 315 310 HOH HOH L . +G 5 HOH 16 316 119 HOH HOH L . +G 5 HOH 17 317 204 HOH HOH L . +G 5 HOH 18 318 423 HOH HOH L . +G 5 HOH 19 319 122 HOH HOH L . +G 5 HOH 20 320 123 HOH HOH L . +G 5 HOH 21 321 153 HOH HOH L . +G 5 HOH 22 322 227 HOH HOH L . +G 5 HOH 23 323 501 HOH HOH L . +G 5 HOH 24 324 396 HOH HOH L . +G 5 HOH 25 325 426 HOH HOH L . +G 5 HOH 26 326 120 HOH HOH L . +G 5 HOH 27 327 33 HOH HOH L . +G 5 HOH 28 328 170 HOH HOH L . +G 5 HOH 29 329 127 HOH HOH L . +G 5 HOH 30 330 146 HOH HOH L . +G 5 HOH 31 331 331 HOH HOH L . +G 5 HOH 32 332 448 HOH HOH L . +G 5 HOH 33 333 286 HOH HOH L . +G 5 HOH 34 334 13 HOH HOH L . +G 5 HOH 35 335 32 HOH HOH L . +G 5 HOH 36 336 144 HOH HOH L . +G 5 HOH 37 337 18 HOH HOH L . +G 5 HOH 38 338 91 HOH HOH L . +G 5 HOH 39 339 103 HOH HOH L . +G 5 HOH 40 340 95 HOH HOH L . +G 5 HOH 41 341 80 HOH HOH L . +G 5 HOH 42 342 455 HOH HOH L . +G 5 HOH 43 343 360 HOH HOH L . +G 5 HOH 44 344 322 HOH HOH L . +G 5 HOH 45 345 292 HOH HOH L . +G 5 HOH 46 346 57 HOH HOH L . +G 5 HOH 47 347 263 HOH HOH L . +G 5 HOH 48 348 341 HOH HOH L . +G 5 HOH 49 349 327 HOH HOH L . +G 5 HOH 50 350 121 HOH HOH L . +G 5 HOH 51 351 47 HOH HOH L . +G 5 HOH 52 352 378 HOH HOH L . +G 5 HOH 53 353 88 HOH HOH L . +G 5 HOH 54 354 125 HOH HOH L . +G 5 HOH 55 355 437 HOH HOH L . +G 5 HOH 56 356 138 HOH HOH L . +G 5 HOH 57 357 288 HOH HOH L . +G 5 HOH 58 358 66 HOH HOH L . +G 5 HOH 59 359 333 HOH HOH L . +G 5 HOH 60 360 185 HOH HOH L . +G 5 HOH 61 361 319 HOH HOH L . +G 5 HOH 62 362 247 HOH HOH L . +G 5 HOH 63 363 417 HOH HOH L . +G 5 HOH 64 364 441 HOH HOH L . +G 5 HOH 65 365 43 HOH HOH L . +G 5 HOH 66 366 475 HOH HOH L . +G 5 HOH 67 367 93 HOH HOH L . +G 5 HOH 68 368 73 HOH HOH L . +G 5 HOH 69 369 65 HOH HOH L . +G 5 HOH 70 370 76 HOH HOH L . +G 5 HOH 71 371 275 HOH HOH L . +G 5 HOH 72 372 389 HOH HOH L . +G 5 HOH 73 373 489 HOH HOH L . +G 5 HOH 74 374 272 HOH HOH L . +G 5 HOH 75 375 222 HOH HOH L . +G 5 HOH 76 376 172 HOH HOH L . +G 5 HOH 77 377 215 HOH HOH L . +G 5 HOH 78 378 255 HOH HOH L . +G 5 HOH 79 379 307 HOH HOH L . +G 5 HOH 80 380 176 HOH HOH L . +G 5 HOH 81 381 23 HOH HOH L . +G 5 HOH 82 382 177 HOH HOH L . +G 5 HOH 83 383 183 HOH HOH L . +G 5 HOH 84 384 11 HOH HOH L . +G 5 HOH 85 385 335 HOH HOH L . +G 5 HOH 86 386 434 HOH HOH L . +G 5 HOH 87 387 38 HOH HOH L . +G 5 HOH 88 388 422 HOH HOH L . +G 5 HOH 89 389 302 HOH HOH L . +G 5 HOH 90 390 505 HOH HOH L . +G 5 HOH 91 391 410 HOH HOH L . +G 5 HOH 92 392 358 HOH HOH L . +G 5 HOH 93 393 329 HOH HOH L . +G 5 HOH 94 394 214 HOH HOH L . +G 5 HOH 95 395 199 HOH HOH L . +G 5 HOH 96 396 425 HOH HOH L . +G 5 HOH 97 397 428 HOH HOH L . +G 5 HOH 98 398 352 HOH HOH L . +G 5 HOH 99 399 270 HOH HOH L . +G 5 HOH 100 400 74 HOH HOH L . +G 5 HOH 101 401 197 HOH HOH L . +G 5 HOH 102 402 258 HOH HOH L . +G 5 HOH 103 403 314 HOH HOH L . +G 5 HOH 104 404 479 HOH HOH L . +G 5 HOH 105 405 158 HOH HOH L . +G 5 HOH 106 406 94 HOH HOH L . +G 5 HOH 107 407 87 HOH HOH L . +G 5 HOH 108 408 186 HOH HOH L . +G 5 HOH 109 409 507 HOH HOH L . +G 5 HOH 110 410 519 HOH HOH L . +G 5 HOH 111 411 388 HOH HOH L . +G 5 HOH 112 412 447 HOH HOH L . +G 5 HOH 113 413 220 HOH HOH L . +G 5 HOH 114 414 169 HOH HOH L . +G 5 HOH 115 415 205 HOH HOH L . +G 5 HOH 116 416 129 HOH HOH L . +G 5 HOH 117 417 357 HOH HOH L . +G 5 HOH 118 418 44 HOH HOH L . +G 5 HOH 119 419 510 HOH HOH L . +G 5 HOH 120 420 192 HOH HOH L . +G 5 HOH 121 421 338 HOH HOH L . +G 5 HOH 122 422 254 HOH HOH L . +G 5 HOH 123 423 181 HOH HOH L . +G 5 HOH 124 424 469 HOH HOH L . +G 5 HOH 125 425 61 HOH HOH L . +G 5 HOH 126 426 244 HOH HOH L . +G 5 HOH 127 427 68 HOH HOH L . +G 5 HOH 128 428 316 HOH HOH L . +G 5 HOH 129 429 284 HOH HOH L . +G 5 HOH 130 430 412 HOH HOH L . +G 5 HOH 131 431 219 HOH HOH L . +G 5 HOH 132 432 240 HOH HOH L . +G 5 HOH 133 433 324 HOH HOH L . +G 5 HOH 134 434 285 HOH HOH L . +G 5 HOH 135 435 397 HOH HOH L . +G 5 HOH 136 436 409 HOH HOH L . +G 5 HOH 137 437 334 HOH HOH L . +G 5 HOH 138 438 98 HOH HOH L . +G 5 HOH 139 439 416 HOH HOH L . +G 5 HOH 140 440 168 HOH HOH L . +G 5 HOH 141 441 271 HOH HOH L . +G 5 HOH 142 442 435 HOH HOH L . +G 5 HOH 143 443 232 HOH HOH L . +G 5 HOH 144 444 405 HOH HOH L . +G 5 HOH 145 445 443 HOH HOH L . +G 5 HOH 146 446 182 HOH HOH L . +G 5 HOH 147 447 280 HOH HOH L . +G 5 HOH 148 448 330 HOH HOH L . +G 5 HOH 149 449 497 HOH HOH L . +G 5 HOH 150 450 228 HOH HOH L . +G 5 HOH 151 451 472 HOH HOH L . +G 5 HOH 152 452 400 HOH HOH L . +G 5 HOH 153 453 411 HOH HOH L . +G 5 HOH 154 454 71 HOH HOH L . +G 5 HOH 155 455 482 HOH HOH L . +G 5 HOH 156 456 274 HOH HOH L . +G 5 HOH 157 457 470 HOH HOH L . +G 5 HOH 158 458 494 HOH HOH L . +G 5 HOH 159 459 486 HOH HOH L . +G 5 HOH 160 460 407 HOH HOH L . +G 5 HOH 161 461 394 HOH HOH L . +G 5 HOH 162 462 356 HOH HOH L . +G 5 HOH 163 463 287 HOH HOH L . +G 5 HOH 164 464 511 HOH HOH L . +G 5 HOH 165 465 424 HOH HOH L . +G 5 HOH 166 466 492 HOH HOH L . +G 5 HOH 167 467 349 HOH HOH L . +G 5 HOH 168 468 282 HOH HOH L . +G 5 HOH 169 469 157 HOH HOH L . +G 5 HOH 170 470 440 HOH HOH L . +G 5 HOH 171 471 457 HOH HOH L . +G 5 HOH 172 472 401 HOH HOH L . +G 5 HOH 173 473 461 HOH HOH L . +G 5 HOH 174 474 450 HOH HOH L . +G 5 HOH 175 475 253 HOH HOH L . +G 5 HOH 176 476 490 HOH HOH L . +G 5 HOH 177 477 413 HOH HOH L . +G 5 HOH 178 478 368 HOH HOH L . +G 5 HOH 179 479 477 HOH HOH L . +G 5 HOH 180 480 297 HOH HOH L . +G 5 HOH 181 481 498 HOH HOH L . +G 5 HOH 182 482 463 HOH HOH L . +G 5 HOH 183 483 451 HOH HOH L . +G 5 HOH 184 484 432 HOH HOH L . +# +loop_ +_software.citation_id +_software.classification +_software.compiler_name +_software.compiler_version +_software.contact_author +_software.contact_author_email +_software.date +_software.description +_software.dependencies +_software.hardware +_software.language +_software.location +_software.mods +_software.name +_software.os +_software.os_version +_software.type +_software.version +_software.pdbx_ordinal +? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 1 +? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.17.1_3660 2 +? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.25 3 +? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 4 +? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 5 +# +_cell.angle_alpha 90.000 +_cell.angle_alpha_esd ? +_cell.angle_beta 100.190 +_cell.angle_beta_esd ? +_cell.angle_gamma 90.000 +_cell.angle_gamma_esd ? +_cell.entry_id 7BZ5 +_cell.details ? +_cell.formula_units_Z ? +_cell.length_a 195.226 +_cell.length_a_esd ? +_cell.length_b 86.417 +_cell.length_b_esd ? +_cell.length_c 56.827 +_cell.length_c_esd ? +_cell.volume ? +_cell.volume_esd ? +_cell.Z_PDB 4 +_cell.reciprocal_angle_alpha ? +_cell.reciprocal_angle_beta ? +_cell.reciprocal_angle_gamma ? +_cell.reciprocal_angle_alpha_esd ? +_cell.reciprocal_angle_beta_esd ? +_cell.reciprocal_angle_gamma_esd ? +_cell.reciprocal_length_a ? +_cell.reciprocal_length_b ? +_cell.reciprocal_length_c ? +_cell.reciprocal_length_a_esd ? +_cell.reciprocal_length_b_esd ? +_cell.reciprocal_length_c_esd ? +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 7BZ5 +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 5 +_symmetry.space_group_name_Hall ? +_symmetry.space_group_name_H-M 'C 1 2 1' +_symmetry.pdbx_full_space_group_name_H-M ? +# +_exptl.absorpt_coefficient_mu ? +_exptl.absorpt_correction_T_max ? +_exptl.absorpt_correction_T_min ? +_exptl.absorpt_correction_type ? +_exptl.absorpt_process_details ? +_exptl.entry_id 7BZ5 +_exptl.crystals_number 1 +_exptl.details ? +_exptl.method 'X-RAY DIFFRACTION' +_exptl.method_details ? +# +_exptl_crystal.colour ? +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_Matthews 3.23 +_exptl_crystal.density_method ? +_exptl_crystal.density_percent_sol 61.86 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.id 1 +_exptl_crystal.preparation ? +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.colour_lustre ? +_exptl_crystal.colour_modifier ? +_exptl_crystal.colour_primary ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_esd ? +_exptl_crystal.density_meas_gt ? +_exptl_crystal.density_meas_lt ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_meas_temp_esd ? +_exptl_crystal.density_meas_temp_gt ? +_exptl_crystal.density_meas_temp_lt ? +_exptl_crystal.pdbx_crystal_image_url ? +_exptl_crystal.pdbx_crystal_image_format ? +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +# +_exptl_crystal_grow.apparatus ? +_exptl_crystal_grow.atmosphere ? +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.details ? +_exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' +_exptl_crystal_grow.method_ref ? +_exptl_crystal_grow.pH 6 +_exptl_crystal_grow.pressure ? +_exptl_crystal_grow.pressure_esd ? +_exptl_crystal_grow.seeding ? +_exptl_crystal_grow.seeding_ref ? +_exptl_crystal_grow.temp 291 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.temp_esd ? +_exptl_crystal_grow.time ? +_exptl_crystal_grow.pdbx_details '0.15 M ammonium sulfate, 0.1 M MES pH 6, 15% w/v PEG 400' +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.ambient_environment ? +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.ambient_temp_esd ? +_diffrn.crystal_id 1 +_diffrn.crystal_support ? +_diffrn.crystal_treatment ? +_diffrn.details ? +_diffrn.id 1 +_diffrn.ambient_pressure ? +_diffrn.ambient_pressure_esd ? +_diffrn.ambient_pressure_gt ? +_diffrn.ambient_pressure_lt ? +_diffrn.ambient_temp_gt ? +_diffrn.ambient_temp_lt ? +_diffrn.pdbx_serial_crystal_experiment N +# +_diffrn_detector.details ? +_diffrn_detector.detector PIXEL +_diffrn_detector.diffrn_id 1 +_diffrn_detector.type 'DECTRIS EIGER X 16M' +_diffrn_detector.area_resol_mean ? +_diffrn_detector.dtime ? +_diffrn_detector.pdbx_frames_total ? +_diffrn_detector.pdbx_collection_time_total ? +_diffrn_detector.pdbx_collection_date 2020-03-21 +_diffrn_detector.pdbx_frequency ? +# +_diffrn_radiation.collimation ? +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.filter_edge ? +_diffrn_radiation.inhomogeneity ? +_diffrn_radiation.monochromator ? +_diffrn_radiation.polarisn_norm ? +_diffrn_radiation.polarisn_ratio ? +_diffrn_radiation.probe ? +_diffrn_radiation.type ? +_diffrn_radiation.xray_symbol ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_wavelength_list ? +_diffrn_radiation.pdbx_wavelength ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_analyzer ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 0.97981 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.current ? +_diffrn_source.details ? +_diffrn_source.diffrn_id 1 +_diffrn_source.power ? +_diffrn_source.size ? +_diffrn_source.source SYNCHROTRON +_diffrn_source.target ? +_diffrn_source.type 'SSRF BEAMLINE BL17U1' +_diffrn_source.voltage ? +_diffrn_source.take-off_angle ? +_diffrn_source.pdbx_wavelength_list 0.97981 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_beamline BL17U1 +_diffrn_source.pdbx_synchrotron_site SSRF +# +_reflns.B_iso_Wilson_estimate 30.11 +_reflns.entry_id 7BZ5 +_reflns.data_reduction_details ? +_reflns.data_reduction_method ? +_reflns.d_resolution_high 1.84 +_reflns.d_resolution_low 50 +_reflns.details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.number_all ? +_reflns.number_obs 80095 +_reflns.observed_criterion ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.observed_criterion_I_max ? +_reflns.observed_criterion_I_min ? +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.percent_possible_obs 99.41 +_reflns.R_free_details ? +_reflns.Rmerge_F_all ? +_reflns.Rmerge_F_obs ? +_reflns.Friedel_coverage ? +_reflns.number_gt ? +_reflns.threshold_expression ? +_reflns.pdbx_redundancy 6.7 +_reflns.pdbx_Rmerge_I_obs ? +_reflns.pdbx_Rmerge_I_all ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_av_sigmaI ? +_reflns.pdbx_netI_over_sigmaI 16.9 +_reflns.pdbx_res_netI_over_av_sigmaI_2 ? +_reflns.pdbx_res_netI_over_sigmaI_2 ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_d_res_high_opt ? +_reflns.pdbx_d_res_low_opt ? +_reflns.pdbx_d_res_opt_method ? +_reflns.phase_calculation_details ? +_reflns.pdbx_Rrim_I_all ? +_reflns.pdbx_Rpim_I_all 0.044 +_reflns.pdbx_d_opt ? +_reflns.pdbx_number_measured_all ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.pdbx_CC_half 0.993 +_reflns.pdbx_CC_star ? +_reflns.pdbx_R_split ? +# +_reflns_shell.d_res_high 1.84 +_reflns_shell.d_res_low 1.92 +_reflns_shell.meanI_over_sigI_all ? +_reflns_shell.meanI_over_sigI_obs 1.4 +_reflns_shell.number_measured_all ? +_reflns_shell.number_measured_obs ? +_reflns_shell.number_possible ? +_reflns_shell.number_unique_all ? +_reflns_shell.number_unique_obs 7992 +_reflns_shell.percent_possible_all ? +_reflns_shell.percent_possible_obs ? +_reflns_shell.Rmerge_F_all ? +_reflns_shell.Rmerge_F_obs ? +_reflns_shell.Rmerge_I_all ? +_reflns_shell.Rmerge_I_obs ? +_reflns_shell.meanI_over_sigI_gt ? +_reflns_shell.meanI_over_uI_all ? +_reflns_shell.meanI_over_uI_gt ? +_reflns_shell.number_measured_gt ? +_reflns_shell.number_unique_gt ? +_reflns_shell.percent_possible_gt ? +_reflns_shell.Rmerge_F_gt ? +_reflns_shell.Rmerge_I_gt ? +_reflns_shell.pdbx_redundancy ? +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.pdbx_chi_squared ? +_reflns_shell.pdbx_netI_over_sigmaI_all ? +_reflns_shell.pdbx_netI_over_sigmaI_obs ? +_reflns_shell.pdbx_Rrim_I_all ? +_reflns_shell.pdbx_Rpim_I_all 0.526 +_reflns_shell.pdbx_rejects ? +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.pdbx_CC_half 0.662 +_reflns_shell.pdbx_CC_star ? +_reflns_shell.pdbx_R_split ? +# +_refine.aniso_B[1][1] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[2][3] ? +_refine.aniso_B[3][3] ? +_refine.B_iso_max 161.900 +_refine.B_iso_mean 39.9588 +_refine.B_iso_min 17.270 +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.details ? +_refine.diff_density_max ? +_refine.diff_density_max_esd ? +_refine.diff_density_min ? +_refine.diff_density_min_esd ? +_refine.diff_density_rms ? +_refine.diff_density_rms_esd ? +_refine.entry_id 7BZ5 +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.ls_abs_structure_details ? +_refine.ls_abs_structure_Flack ? +_refine.ls_abs_structure_Flack_esd ? +_refine.ls_abs_structure_Rogers ? +_refine.ls_abs_structure_Rogers_esd ? +_refine.ls_d_res_high 1.8400 +_refine.ls_d_res_low 28.4900 +_refine.ls_extinction_coef ? +_refine.ls_extinction_coef_esd ? +_refine.ls_extinction_expression ? +_refine.ls_extinction_method ? +_refine.ls_goodness_of_fit_all ? +_refine.ls_goodness_of_fit_all_esd ? +_refine.ls_goodness_of_fit_obs ? +_refine.ls_goodness_of_fit_obs_esd ? +_refine.ls_hydrogen_treatment ? +_refine.ls_matrix_type ? +_refine.ls_number_constraints ? +_refine.ls_number_parameters ? +_refine.ls_number_reflns_all ? +_refine.ls_number_reflns_obs 80064 +_refine.ls_number_reflns_R_free 2000 +_refine.ls_number_reflns_R_work ? +_refine.ls_number_restraints ? +_refine.ls_percent_reflns_obs 99.1800 +_refine.ls_percent_reflns_R_free 2.5000 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.1677 +_refine.ls_R_factor_R_free 0.1914 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_R_factor_R_work 0.1671 +_refine.ls_R_Fsqd_factor_obs ? +_refine.ls_R_I_factor_obs ? +_refine.ls_redundancy_reflns_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_restrained_S_all ? +_refine.ls_restrained_S_obs ? +_refine.ls_shift_over_esd_max ? +_refine.ls_shift_over_esd_mean ? +_refine.ls_structure_factor_coef ? +_refine.ls_weighting_details ? +_refine.ls_weighting_scheme ? +_refine.ls_wR_factor_all ? +_refine.ls_wR_factor_obs ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.solvent_model_details ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.pdbx_R_complete ? +_refine.ls_R_factor_gt ? +_refine.ls_goodness_of_fit_gt ? +_refine.ls_goodness_of_fit_ref ? +_refine.ls_shift_over_su_max ? +_refine.ls_shift_over_su_max_lt ? +_refine.ls_shift_over_su_mean ? +_refine.ls_shift_over_su_mean_lt ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 1.350 +_refine.pdbx_ls_sigma_Fsqd ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_starting_model '6LZG, 4TSA' +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_R_Free_selection_details ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.pdbx_solvent_vdw_probe_radii 1.1100 +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii 0.9000 +_refine.pdbx_real_space_R ? +_refine.pdbx_density_correlation ? +_refine.pdbx_pd_number_of_powder_patterns ? +_refine.pdbx_pd_number_of_points ? +_refine.pdbx_pd_meas_number_of_points ? +_refine.pdbx_pd_proc_ls_prof_R_factor ? +_refine.pdbx_pd_proc_ls_prof_wR_factor ? +_refine.pdbx_pd_Marquardt_correlation_coeff ? +_refine.pdbx_pd_Fsqrd_R_factor ? +_refine.pdbx_pd_ls_matrix_band_width ? +_refine.pdbx_overall_phase_error 19.8800 +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_diffrn_id 1 +_refine.overall_SU_B ? +_refine.overall_SU_ML 0.2200 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_average_fsc_overall ? +_refine.pdbx_average_fsc_work ? +_refine.pdbx_average_fsc_free ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id final +_refine_hist.details ? +_refine_hist.d_res_high 1.8400 +_refine_hist.d_res_low 28.4900 +_refine_hist.number_atoms_solvent 519 +_refine_hist.number_atoms_total 5345 +_refine_hist.number_reflns_all ? +_refine_hist.number_reflns_obs ? +_refine_hist.number_reflns_R_free ? +_refine_hist.number_reflns_R_work ? +_refine_hist.R_factor_all ? +_refine_hist.R_factor_obs ? +_refine_hist.R_factor_R_free ? +_refine_hist.R_factor_R_work ? +_refine_hist.pdbx_number_residues_total 628 +_refine_hist.pdbx_B_iso_mean_ligand 80.18 +_refine_hist.pdbx_B_iso_mean_solvent 45.16 +_refine_hist.pdbx_number_atoms_protein 4812 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 14 +_refine_hist.pdbx_number_atoms_lipid ? +_refine_hist.pdbx_number_atoms_carb ? +_refine_hist.pdbx_pseudo_atom_details ? +# +loop_ +_refine_ls_shell.pdbx_refine_id +_refine_ls_shell.d_res_high +_refine_ls_shell.d_res_low +_refine_ls_shell.number_reflns_all +_refine_ls_shell.number_reflns_obs +_refine_ls_shell.number_reflns_R_free +_refine_ls_shell.number_reflns_R_work +_refine_ls_shell.percent_reflns_obs +_refine_ls_shell.percent_reflns_R_free +_refine_ls_shell.R_factor_all +_refine_ls_shell.R_factor_obs +_refine_ls_shell.R_factor_R_free +_refine_ls_shell.R_factor_R_free_error +_refine_ls_shell.R_factor_R_work +_refine_ls_shell.redundancy_reflns_all +_refine_ls_shell.redundancy_reflns_obs +_refine_ls_shell.wR_factor_all +_refine_ls_shell.wR_factor_obs +_refine_ls_shell.wR_factor_R_free +_refine_ls_shell.wR_factor_R_work +_refine_ls_shell.pdbx_R_complete +_refine_ls_shell.pdbx_total_number_of_bins_used +_refine_ls_shell.pdbx_phase_error +_refine_ls_shell.pdbx_fsc_work +_refine_ls_shell.pdbx_fsc_free +'X-RAY DIFFRACTION' 1.8400 1.8800 5052 . 126 4926 89.0000 . . . 0.3419 0.0000 0.2920 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 1.8800 1.9400 5739 . 143 5596 100.0000 . . . 0.2787 0.0000 0.2440 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 1.9400 1.9900 5718 . 143 5575 100.0000 . . . 0.2473 0.0000 0.2092 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 1.9900 2.0600 5775 . 144 5631 100.0000 . . . 0.2209 0.0000 0.1959 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.0600 2.1300 5746 . 144 5602 100.0000 . . . 0.2231 0.0000 0.1884 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.1300 2.2200 5749 . 144 5605 100.0000 . . . 0.2119 0.0000 0.1833 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.2200 2.3200 5731 . 143 5588 100.0000 . . . 0.1767 0.0000 0.1765 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.3200 2.4400 5757 . 144 5613 100.0000 . . . 0.2018 0.0000 0.1795 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.4400 2.5900 5785 . 144 5641 100.0000 . . . 0.2385 0.0000 0.1797 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.5900 2.7900 5762 . 143 5619 100.0000 . . . 0.2055 0.0000 0.1825 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 2.7900 3.0700 5769 . 145 5624 100.0000 . . . 0.2287 0.0000 0.1781 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 3.0700 3.5100 5789 . 145 5644 100.0000 . . . 0.1790 0.0000 0.1676 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 3.5100 4.4300 5820 . 144 5676 100.0000 . . . 0.1738 0.0000 0.1380 . . . . . . . 14 . . . +'X-RAY DIFFRACTION' 4.4300 28.4900 5872 . 148 5724 100.0000 . . . 0.1448 0.0000 0.1405 . . . . . . . 14 . . . +# +_struct.entry_id 7BZ5 +_struct.title +'Structure of COVID-19 virus spike receptor-binding domain complexed with a neutralizing antibody' +_struct.pdbx_model_details ? +_struct.pdbx_formula_weight ? +_struct.pdbx_formula_weight_method ? +_struct.pdbx_model_type_details ? +_struct.pdbx_CASP_flag N +# +_struct_keywords.entry_id 7BZ5 +_struct_keywords.text 'covid-19 antibody, VIRAL PROTEIN, VIRAL PROTEIN-IMMUNE SYSTEM complex' +_struct_keywords.pdbx_keywords 'VIRAL PROTEIN/IMMUNE SYSTEM' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 3 ? +D N N 4 ? +E N N 5 ? +F N N 5 ? +G N N 5 ? +# +loop_ +_struct_ref.id +_struct_ref.db_name +_struct_ref.db_code +_struct_ref.pdbx_db_accession +_struct_ref.pdbx_db_isoform +_struct_ref.entity_id +_struct_ref.pdbx_seq_one_letter_code +_struct_ref.pdbx_align_begin +1 UNP SPIKE_SARS2 P0DTC2 ? 1 +;RVQPTESIVRFPNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYAD +SFVIRGDEVRQIAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGST +PCNGVEGFNCYFPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNLVKNKCVNF +; +319 +2 PDB 7BZ5 7BZ5 ? 2 ? 1 +3 PDB 7BZ5 7BZ5 ? 3 ? 1 +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 7BZ5 A 1 ? 223 ? P0DTC2 319 ? 541 ? 319 541 +2 2 7BZ5 H 1 ? 222 ? 7BZ5 -1 ? 220 ? -1 220 +3 3 7BZ5 L 1 ? 218 ? 7BZ5 -1 ? 216 ? -1 216 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +1 7BZ5 HIS A 224 ? UNP P0DTC2 ? ? 'expression tag' 542 1 +1 7BZ5 HIS A 225 ? UNP P0DTC2 ? ? 'expression tag' 543 2 +1 7BZ5 HIS A 226 ? UNP P0DTC2 ? ? 'expression tag' 544 3 +1 7BZ5 HIS A 227 ? UNP P0DTC2 ? ? 'expression tag' 545 4 +1 7BZ5 HIS A 228 ? UNP P0DTC2 ? ? 'expression tag' 546 5 +1 7BZ5 HIS A 229 ? UNP P0DTC2 ? ? 'expression tag' 547 6 +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_defined_assembly +_pdbx_struct_assembly.method_details ? +_pdbx_struct_assembly.oligomeric_details trimeric +_pdbx_struct_assembly.oligomeric_count 3 +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 5800 ? +1 MORE -15 ? +1 'SSA (A^2)' 27970 ? +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G +# +_pdbx_struct_assembly_auth_evidence.id 1 +_pdbx_struct_assembly_auth_evidence.assembly_id 1 +_pdbx_struct_assembly_auth_evidence.experimental_support 'gel filtration' +_pdbx_struct_assembly_auth_evidence.details ? +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 AA1 PRO A 19 ? ASN A 25 ? PRO A 337 ASN A 343 1 ? 7 +HELX_P HELX_P2 AA2 SER A 31 ? TRP A 35 ? SER A 349 TRP A 353 5 ? 5 +HELX_P HELX_P3 AA3 TYR A 47 ? ASN A 52 ? TYR A 365 ASN A 370 1 ? 6 +HELX_P HELX_P4 AA4 ASP A 87 ? ILE A 92 ? ASP A 405 ILE A 410 5 ? 6 +HELX_P HELX_P5 AA5 GLY A 98 ? ASN A 104 ? GLY A 416 ASN A 422 1 ? 7 +HELX_P HELX_P6 AA6 SER A 120 ? SER A 125 ? SER A 438 SER A 443 1 ? 6 +HELX_P HELX_P7 AA7 GLY A 184 ? TYR A 187 ? GLY A 502 TYR A 505 5 ? 4 +HELX_P HELX_P8 AA8 ILE B 30 ? ASN B 34 ? ILE H 28 ASN H 32 5 ? 5 +HELX_P HELX_P9 AA9 ASP B 63 ? LYS B 66 ? ASP H 61 LYS H 64 5 ? 4 +HELX_P HELX_P10 AB1 ARG B 88 ? THR B 92 ? ARG H 86 THR H 90 5 ? 5 +HELX_P HELX_P11 AB2 SER B 160 ? ALA B 162 ? SER H 158 ALA H 160 5 ? 3 +HELX_P HELX_P12 AB3 SER B 191 ? LEU B 193 ? SER H 189 LEU H 191 5 ? 3 +HELX_P HELX_P13 AB4 LYS B 205 ? ASN B 208 ? LYS H 203 ASN H 206 5 ? 4 +HELX_P HELX_P14 AB5 GLN C 81 ? PHE C 85 ? GLN L 79 PHE L 83 5 ? 5 +HELX_P HELX_P15 AB6 SER C 124 ? SER C 130 ? SER L 122 SER L 128 1 ? 7 +HELX_P HELX_P16 AB7 LYS C 186 ? GLU C 190 ? LYS L 184 GLU L 188 1 ? 5 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +disulf1 disulf ? ? A CYS 18 SG ? ? ? 1_555 A CYS 43 SG ? ? A CYS 336 A CYS 361 1_555 ? ? ? ? ? ? ? 2.046 ? ? +disulf2 disulf ? ? A CYS 61 SG ? ? ? 1_555 A CYS 114 SG ? ? A CYS 379 A CYS 432 1_555 ? ? ? ? ? ? ? 2.067 ? ? +disulf3 disulf ? ? A CYS 73 SG ? ? ? 1_555 A CYS 207 SG ? ? A CYS 391 A CYS 525 1_555 ? ? ? ? ? ? ? 2.036 ? ? +disulf4 disulf ? ? A CYS 162 SG ? ? ? 1_555 A CYS 170 SG ? ? A CYS 480 A CYS 488 1_555 ? ? ? ? ? ? ? 2.087 ? ? +disulf5 disulf ? ? B CYS 24 SG ? ? ? 1_555 B CYS 97 SG ? ? H CYS 22 H CYS 95 1_555 ? ? ? ? ? ? ? 2.041 ? ? +disulf6 disulf ? ? B CYS 144 SG ? ? ? 1_555 B CYS 200 SG ? ? H CYS 142 H CYS 198 1_555 ? ? ? ? ? ? ? 2.053 ? ? +disulf7 disulf ? ? C CYS 25 SG ? ? ? 1_555 C CYS 90 SG ? ? L CYS 23 L CYS 88 1_555 ? ? ? ? ? ? ? 2.091 ? ? +disulf8 disulf ? ? C CYS 137 SG ? ? ? 1_555 C CYS 197 SG A ? L CYS 135 L CYS 195 1_555 ? ? ? ? ? ? ? 2.045 ? ? +disulf9 disulf ? ? C CYS 137 SG ? ? ? 1_555 C CYS 197 SG B ? L CYS 135 L CYS 195 1_555 ? ? ? ? ? ? ? 2.064 ? ? +covale1 covale one ? A ASN 25 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 343 A NAG 601 1_555 ? ? ? ? ? ? ? 1.447 ? N-Glycosylation +# +loop_ +_struct_conn_type.id +_struct_conn_type.criteria +_struct_conn_type.reference +disulf ? ? +covale ? ? +# +loop_ +_pdbx_modification_feature.ordinal +_pdbx_modification_feature.label_comp_id +_pdbx_modification_feature.label_asym_id +_pdbx_modification_feature.label_seq_id +_pdbx_modification_feature.label_alt_id +_pdbx_modification_feature.modified_residue_label_comp_id +_pdbx_modification_feature.modified_residue_label_asym_id +_pdbx_modification_feature.modified_residue_label_seq_id +_pdbx_modification_feature.modified_residue_label_alt_id +_pdbx_modification_feature.auth_comp_id +_pdbx_modification_feature.auth_asym_id +_pdbx_modification_feature.auth_seq_id +_pdbx_modification_feature.PDB_ins_code +_pdbx_modification_feature.symmetry +_pdbx_modification_feature.modified_residue_auth_comp_id +_pdbx_modification_feature.modified_residue_auth_asym_id +_pdbx_modification_feature.modified_residue_auth_seq_id +_pdbx_modification_feature.modified_residue_PDB_ins_code +_pdbx_modification_feature.modified_residue_symmetry +_pdbx_modification_feature.comp_id_linking_atom +_pdbx_modification_feature.modified_residue_id_linking_atom +_pdbx_modification_feature.modified_residue_id +_pdbx_modification_feature.ref_pcm_id +_pdbx_modification_feature.ref_comp_id +_pdbx_modification_feature.type +_pdbx_modification_feature.category +1 NAG D . ? ASN A 25 ? NAG A 601 ? 1_555 ASN A 343 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate +2 CYS A 18 ? CYS A 43 ? CYS A 336 ? 1_555 CYS A 361 ? 1_555 SG SG . . . None 'Disulfide bridge' +3 CYS A 61 ? CYS A 114 ? CYS A 379 ? 1_555 CYS A 432 ? 1_555 SG SG . . . None 'Disulfide bridge' +4 CYS A 73 ? CYS A 207 ? CYS A 391 ? 1_555 CYS A 525 ? 1_555 SG SG . . . None 'Disulfide bridge' +5 CYS A 162 ? CYS A 170 ? CYS A 480 ? 1_555 CYS A 488 ? 1_555 SG SG . . . None 'Disulfide bridge' +6 CYS B 24 ? CYS B 97 ? CYS H 22 ? 1_555 CYS H 95 ? 1_555 SG SG . . . None 'Disulfide bridge' +7 CYS B 144 ? CYS B 200 ? CYS H 142 ? 1_555 CYS H 198 ? 1_555 SG SG . . . None 'Disulfide bridge' +8 CYS C 25 ? CYS C 90 ? CYS L 23 ? 1_555 CYS L 88 ? 1_555 SG SG . . . None 'Disulfide bridge' +9 CYS C 137 ? CYS C 197 A CYS L 135 ? 1_555 CYS L 195 ? 1_555 SG SG . . . None 'Disulfide bridge' +10 CYS C 137 ? CYS C 197 B CYS L 135 ? 1_555 CYS L 195 ? 1_555 SG SG . . . None 'Disulfide bridge' +# +loop_ +_struct_mon_prot_cis.pdbx_id +_struct_mon_prot_cis.label_comp_id +_struct_mon_prot_cis.label_seq_id +_struct_mon_prot_cis.label_asym_id +_struct_mon_prot_cis.label_alt_id +_struct_mon_prot_cis.pdbx_PDB_ins_code +_struct_mon_prot_cis.auth_comp_id +_struct_mon_prot_cis.auth_seq_id +_struct_mon_prot_cis.auth_asym_id +_struct_mon_prot_cis.pdbx_label_comp_id_2 +_struct_mon_prot_cis.pdbx_label_seq_id_2 +_struct_mon_prot_cis.pdbx_label_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 +_struct_mon_prot_cis.pdbx_auth_comp_id_2 +_struct_mon_prot_cis.pdbx_auth_seq_id_2 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 +_struct_mon_prot_cis.pdbx_PDB_model_num +_struct_mon_prot_cis.pdbx_omega_angle +1 PHE 150 B . ? PHE 148 H PRO 151 B ? PRO 149 H 1 -6.35 +2 GLU 152 B . ? GLU 150 H PRO 153 B ? PRO 151 H 1 -0.60 +3 SER 9 C . ? SER 7 L PRO 10 C ? PRO 8 L 1 -6.68 +4 TYR 96 C . ? TYR 94 L PRO 97 C ? PRO 95 L 1 7.41 +5 TYR 143 C . ? TYR 141 L PRO 144 C ? PRO 142 L 1 4.55 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +AA1 ? 5 ? +AA2 ? 3 ? +AA3 ? 2 ? +AA4 ? 2 ? +AA5 ? 4 ? +AA6 ? 6 ? +AA7 ? 4 ? +AA8 ? 4 ? +AA9 ? 4 ? +AB1 ? 3 ? +AB2 ? 4 ? +AB3 ? 6 ? +AB4 ? 4 ? +AB5 ? 4 ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +AA1 1 2 ? anti-parallel +AA1 2 3 ? anti-parallel +AA1 3 4 ? anti-parallel +AA1 4 5 ? anti-parallel +AA2 1 2 ? parallel +AA2 2 3 ? anti-parallel +AA3 1 2 ? anti-parallel +AA4 1 2 ? anti-parallel +AA5 1 2 ? anti-parallel +AA5 2 3 ? anti-parallel +AA5 3 4 ? anti-parallel +AA6 1 2 ? parallel +AA6 2 3 ? anti-parallel +AA6 3 4 ? anti-parallel +AA6 4 5 ? anti-parallel +AA6 5 6 ? anti-parallel +AA7 1 2 ? parallel +AA7 2 3 ? anti-parallel +AA7 3 4 ? anti-parallel +AA8 1 2 ? anti-parallel +AA8 2 3 ? anti-parallel +AA8 3 4 ? anti-parallel +AA9 1 2 ? anti-parallel +AA9 2 3 ? anti-parallel +AA9 3 4 ? anti-parallel +AB1 1 2 ? anti-parallel +AB1 2 3 ? anti-parallel +AB2 1 2 ? anti-parallel +AB2 2 3 ? anti-parallel +AB2 3 4 ? anti-parallel +AB3 1 2 ? parallel +AB3 2 3 ? anti-parallel +AB3 3 4 ? anti-parallel +AB3 4 5 ? anti-parallel +AB3 5 6 ? anti-parallel +AB4 1 2 ? anti-parallel +AB4 2 3 ? anti-parallel +AB4 3 4 ? anti-parallel +AB5 1 2 ? anti-parallel +AB5 2 3 ? anti-parallel +AB5 3 4 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA1 1 ASN A 36 ? ILE A 40 ? ASN A 354 ILE A 358 +AA1 2 ASN A 76 ? ARG A 85 ? ASN A 394 ARG A 403 +AA1 3 PRO A 189 ? GLU A 198 ? PRO A 507 GLU A 516 +AA1 4 GLY A 113 ? ASN A 119 ? GLY A 431 ASN A 437 +AA1 5 THR A 58 ? TYR A 62 ? THR A 376 TYR A 380 +AA2 1 CYS A 43 ? VAL A 44 ? CYS A 361 VAL A 362 +AA2 2 VAL A 206 ? CYS A 207 ? VAL A 524 CYS A 525 +AA2 3 CYS A 73 ? PHE A 74 ? CYS A 391 PHE A 392 +AA3 1 LEU A 134 ? ARG A 136 ? LEU A 452 ARG A 454 +AA3 2 LEU A 174 ? SER A 176 ? LEU A 492 SER A 494 +AA4 1 TYR A 155 ? GLN A 156 ? TYR A 473 GLN A 474 +AA4 2 CYS A 170 ? TYR A 171 ? CYS A 488 TYR A 489 +AA5 1 GLN B 5 ? SER B 9 ? GLN H 3 SER H 7 +AA5 2 LEU B 20 ? SER B 27 ? LEU H 18 SER H 25 +AA5 3 THR B 79 ? MET B 84 ? THR H 77 MET H 82 +AA5 4 PHE B 69 ? HIS B 74 ? PHE H 67 HIS H 72 +AA6 1 LEU B 13 ? VAL B 14 ? LEU H 11 VAL H 12 +AA6 2 THR B 111 ? VAL B 115 ? THR H 109 VAL H 113 +AA6 3 ALA B 93 ? GLU B 100 ? ALA H 91 GLU H 98 +AA6 4 TYR B 35 ? GLN B 41 ? TYR H 33 GLN H 39 +AA6 5 LEU B 47 ? ILE B 53 ? LEU H 45 ILE H 51 +AA6 6 THR B 59 ? TYR B 61 ? THR H 57 TYR H 59 +AA7 1 LEU B 13 ? VAL B 14 ? LEU H 11 VAL H 12 +AA7 2 THR B 111 ? VAL B 115 ? THR H 109 VAL H 113 +AA7 3 ALA B 93 ? GLU B 100 ? ALA H 91 GLU H 98 +AA7 4 MET B 104 ? TRP B 107 ? MET H 102 TRP H 105 +AA8 1 SER B 124 ? LEU B 128 ? SER H 122 LEU H 126 +AA8 2 THR B 139 ? TYR B 149 ? THR H 137 TYR H 147 +AA8 3 TYR B 180 ? PRO B 189 ? TYR H 178 PRO H 187 +AA8 4 VAL B 167 ? THR B 169 ? VAL H 165 THR H 167 +AA9 1 SER B 124 ? LEU B 128 ? SER H 122 LEU H 126 +AA9 2 THR B 139 ? TYR B 149 ? THR H 137 TYR H 147 +AA9 3 TYR B 180 ? PRO B 189 ? TYR H 178 PRO H 187 +AA9 4 VAL B 173 ? LEU B 174 ? VAL H 171 LEU H 172 +AB1 1 THR B 155 ? TRP B 158 ? THR H 153 TRP H 156 +AB1 2 ILE B 199 ? HIS B 204 ? ILE H 197 HIS H 202 +AB1 3 THR B 209 ? ARG B 214 ? THR H 207 ARG H 212 +AB2 1 MET C 6 ? SER C 9 ? MET L 4 SER L 7 +AB2 2 VAL C 21 ? ALA C 27 ? VAL L 19 ALA L 25 +AB2 3 GLU C 72 ? ILE C 77 ? GLU L 70 ILE L 75 +AB2 4 PHE C 64 ? GLY C 68 ? PHE L 62 GLY L 66 +AB3 1 PHE C 12 ? ALA C 15 ? PHE L 10 ALA L 13 +AB3 2 THR C 105 ? ILE C 109 ? THR L 103 ILE L 107 +AB3 3 THR C 87 ? GLN C 92 ? THR L 85 GLN L 90 +AB3 4 LEU C 35 ? GLN C 40 ? LEU L 33 GLN L 38 +AB3 5 LYS C 47 ? TYR C 51 ? LYS L 45 TYR L 49 +AB3 6 THR C 55 ? LEU C 56 ? THR L 53 LEU L 54 +AB4 1 SER C 117 ? PHE C 121 ? SER L 115 PHE L 119 +AB4 2 THR C 132 ? PHE C 142 ? THR L 130 PHE L 140 +AB4 3 TYR C 176 ? SER C 185 ? TYR L 174 SER L 183 +AB4 4 SER C 162 ? VAL C 166 ? SER L 160 VAL L 164 +AB5 1 ALA C 156 ? LEU C 157 ? ALA L 154 LEU L 155 +AB5 2 ALA C 147 ? VAL C 153 ? ALA L 145 VAL L 151 +AB5 3 VAL C 194 ? HIS C 201 ? VAL L 192 HIS L 199 +AB5 4 VAL C 208 ? ASN C 213 ? VAL L 206 ASN L 211 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +AA1 1 2 N ILE A 40 ? N ILE A 358 O VAL A 77 ? O VAL A 395 +AA1 2 3 N ASP A 80 ? N ASP A 398 O VAL A 194 ? O VAL A 512 +AA1 3 4 O VAL A 193 ? O VAL A 511 N ILE A 116 ? N ILE A 434 +AA1 4 5 O GLY A 113 ? O GLY A 431 N TYR A 62 ? N TYR A 380 +AA2 1 2 N CYS A 43 ? N CYS A 361 O CYS A 207 ? O CYS A 525 +AA2 2 3 O VAL A 206 ? O VAL A 524 N PHE A 74 ? N PHE A 392 +AA3 1 2 N TYR A 135 ? N TYR A 453 O GLN A 175 ? O GLN A 493 +AA4 1 2 N TYR A 155 ? N TYR A 473 O TYR A 171 ? O TYR A 489 +AA5 1 2 N SER B 9 ? N SER H 7 O SER B 23 ? O SER H 21 +AA5 2 3 N LEU B 20 ? N LEU H 18 O MET B 84 ? O MET H 82 +AA5 3 4 O GLN B 83 ? O GLN H 81 N THR B 70 ? N THR H 68 +AA6 1 2 N VAL B 14 ? N VAL H 12 O THR B 114 ? O THR H 112 +AA6 2 3 O THR B 111 ? O THR H 109 N TYR B 95 ? N TYR H 93 +AA6 3 4 O TYR B 96 ? O TYR H 94 N VAL B 39 ? N VAL H 37 +AA6 4 5 N ARG B 40 ? N ARG H 38 O GLU B 48 ? O GLU H 46 +AA6 5 6 N VAL B 52 ? N VAL H 50 O TYR B 60 ? O TYR H 58 +AA7 1 2 N VAL B 14 ? N VAL H 12 O THR B 114 ? O THR H 112 +AA7 2 3 O THR B 111 ? O THR H 109 N TYR B 95 ? N TYR H 93 +AA7 3 4 N ARG B 99 ? N ARG H 97 O VAL B 106 ? O VAL H 104 +AA8 1 2 N PHE B 126 ? N PHE H 124 O LEU B 145 ? O LEU H 143 +AA8 2 3 N VAL B 146 ? N VAL H 144 O LEU B 182 ? O LEU H 180 +AA8 3 4 O VAL B 185 ? O VAL H 183 N HIS B 168 ? N HIS H 166 +AA9 1 2 N PHE B 126 ? N PHE H 124 O LEU B 145 ? O LEU H 143 +AA9 2 3 N VAL B 146 ? N VAL H 144 O LEU B 182 ? O LEU H 180 +AA9 3 4 O SER B 181 ? O SER H 179 N VAL B 173 ? N VAL H 171 +AB1 1 2 N SER B 157 ? N SER H 155 O ASN B 201 ? O ASN H 199 +AB1 2 3 N VAL B 202 ? N VAL H 200 O VAL B 211 ? O VAL H 209 +AB2 1 2 N THR C 7 ? N THR L 5 O ARG C 26 ? O ARG L 24 +AB2 2 3 N CYS C 25 ? N CYS L 23 O PHE C 73 ? O PHE L 71 +AB2 3 4 O THR C 76 ? O THR L 74 N SER C 65 ? N SER L 63 +AB3 1 2 N LEU C 13 ? N LEU L 11 O GLU C 108 ? O GLU L 106 +AB3 2 3 O THR C 105 ? O THR L 103 N TYR C 88 ? N TYR L 86 +AB3 3 4 O THR C 87 ? O THR L 85 N GLN C 40 ? N GLN L 38 +AB3 4 5 N TRP C 37 ? N TRP L 35 O LEU C 49 ? O LEU L 47 +AB3 5 6 N TYR C 51 ? N TYR L 49 O THR C 55 ? O THR L 53 +AB4 1 2 N PHE C 119 ? N PHE L 117 O LEU C 138 ? O LEU L 136 +AB4 2 3 N ALA C 133 ? N ALA L 131 O LEU C 184 ? O LEU L 182 +AB4 3 4 O THR C 181 ? O THR L 179 N GLN C 163 ? N GLN L 161 +AB5 1 2 O ALA C 156 ? O ALA L 154 N VAL C 153 ? N VAL L 151 +AB5 2 3 N GLN C 150 ? N GLN L 148 O GLU C 198 ? O GLU L 196 +AB5 3 4 N VAL C 199 ? N VAL L 197 O VAL C 208 ? O VAL L 206 +# +_pdbx_entry_details.entry_id 7BZ5 +_pdbx_entry_details.has_ligand_of_interest N +_pdbx_entry_details.compound_details ? +_pdbx_entry_details.source_details ? +_pdbx_entry_details.nonpolymer_details ? +_pdbx_entry_details.sequence_details ? +_pdbx_entry_details.has_protein_modification Y +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 O A THR 393 ? ? OG1 A THR 523 ? ? 2.17 +2 1 O L HOH 394 ? ? O L HOH 472 ? ? 2.18 +3 1 OG A SER 371 ? ? OG A SER 373 ? ? 2.18 +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 ALA A 352 ? ? -109.75 42.40 +2 1 ALA A 372 ? ? 64.69 -8.11 +3 1 ASN A 422 ? ? -130.13 -53.68 +4 1 ASP A 428 ? ? -90.22 31.23 +5 1 ALA H 99 ? ? -120.97 -86.21 +6 1 SER H 134 ? ? 75.74 -13.06 +7 1 ASP H 146 ? ? 65.44 60.18 +8 1 SER L 30 ? ? 57.92 -123.55 +9 1 ALA L 51 ? ? 72.43 -32.75 +10 1 ALA L 84 ? ? 178.78 179.00 +11 1 GLU L 214 ? ? 36.89 65.43 +# +loop_ +_pdbx_refine_tls.id +_pdbx_refine_tls.pdbx_refine_id +_pdbx_refine_tls.details +_pdbx_refine_tls.method +_pdbx_refine_tls.origin_x +_pdbx_refine_tls.origin_y +_pdbx_refine_tls.origin_z +_pdbx_refine_tls.T[1][1] +_pdbx_refine_tls.T[1][1]_esd +_pdbx_refine_tls.T[1][2] +_pdbx_refine_tls.T[1][2]_esd +_pdbx_refine_tls.T[1][3] +_pdbx_refine_tls.T[1][3]_esd +_pdbx_refine_tls.T[2][2] +_pdbx_refine_tls.T[2][2]_esd +_pdbx_refine_tls.T[2][3] +_pdbx_refine_tls.T[2][3]_esd +_pdbx_refine_tls.T[3][3] +_pdbx_refine_tls.T[3][3]_esd +_pdbx_refine_tls.L[1][1] +_pdbx_refine_tls.L[1][1]_esd +_pdbx_refine_tls.L[1][2] +_pdbx_refine_tls.L[1][2]_esd +_pdbx_refine_tls.L[1][3] +_pdbx_refine_tls.L[1][3]_esd +_pdbx_refine_tls.L[2][2] +_pdbx_refine_tls.L[2][2]_esd +_pdbx_refine_tls.L[2][3] +_pdbx_refine_tls.L[2][3]_esd +_pdbx_refine_tls.L[3][3] +_pdbx_refine_tls.L[3][3]_esd +_pdbx_refine_tls.S[1][1] +_pdbx_refine_tls.S[1][1]_esd +_pdbx_refine_tls.S[1][2] +_pdbx_refine_tls.S[1][2]_esd +_pdbx_refine_tls.S[1][3] +_pdbx_refine_tls.S[1][3]_esd +_pdbx_refine_tls.S[2][1] +_pdbx_refine_tls.S[2][1]_esd +_pdbx_refine_tls.S[2][2] +_pdbx_refine_tls.S[2][2]_esd +_pdbx_refine_tls.S[2][3] +_pdbx_refine_tls.S[2][3]_esd +_pdbx_refine_tls.S[3][1] +_pdbx_refine_tls.S[3][1]_esd +_pdbx_refine_tls.S[3][2] +_pdbx_refine_tls.S[3][2]_esd +_pdbx_refine_tls.S[3][3] +_pdbx_refine_tls.S[3][3]_esd +1 'X-RAY DIFFRACTION' ? refined -72.7298 -29.7966 11.4994 0.2229 ? 0.0298 ? 0.0121 ? 0.2291 ? -0.0015 ? 0.3029 ? 1.8723 ? +-0.0539 ? -0.2794 ? 2.6028 ? 0.4999 ? 2.0675 ? -0.0548 ? -0.0302 ? 0.1654 ? 0.0528 ? -0.0678 ? 0.5655 ? -0.2185 ? -0.4295 ? +0.0624 ? +2 'X-RAY DIFFRACTION' ? refined -30.9878 -29.3986 -11.5244 0.2417 ? -0.0051 ? -0.0049 ? 0.1972 ? -0.0333 ? 0.1557 ? 2.2559 ? +0.7956 ? -0.3440 ? 0.7890 ? -0.0773 ? 0.4041 ? -0.0464 ? 0.1468 ? -0.1178 ? -0.0276 ? 0.0686 ? -0.0951 ? 0.0655 ? 0.0861 ? +-0.0272 ? +3 'X-RAY DIFFRACTION' ? refined -25.9253 -19.7176 2.5090 0.2344 ? 0.0036 ? -0.0236 ? 0.2512 ? -0.0314 ? 0.2069 ? 1.7018 ? +0.7451 ? -0.7778 ? 1.1866 ? -0.5968 ? 1.0630 ? 0.0237 ? -0.1136 ? 0.0812 ? 0.0612 ? 0.0108 ? 0.0225 ? 0.0447 ? 0.0103 ? +-0.0268 ? +# +loop_ +_pdbx_refine_tls_group.id +_pdbx_refine_tls_group.pdbx_refine_id +_pdbx_refine_tls_group.refine_tls_id +_pdbx_refine_tls_group.beg_label_asym_id +_pdbx_refine_tls_group.beg_label_seq_id +_pdbx_refine_tls_group.beg_auth_asym_id +_pdbx_refine_tls_group.beg_auth_seq_id +_pdbx_refine_tls_group.end_label_asym_id +_pdbx_refine_tls_group.end_label_seq_id +_pdbx_refine_tls_group.end_auth_asym_id +_pdbx_refine_tls_group.end_auth_seq_id +_pdbx_refine_tls_group.selection +_pdbx_refine_tls_group.selection_details +1 'X-RAY DIFFRACTION' 1 ? ? ? ? ? ? ? 619 ? 'chain A' +2 'X-RAY DIFFRACTION' 2 ? ? H 0 ? ? H 217 ? 'chain H' +3 'X-RAY DIFFRACTION' 3 ? ? L 0 ? ? L 215 ? 'chain L' +# +_pdbx_distant_solvent_atoms.id 1 +_pdbx_distant_solvent_atoms.PDB_model_num 1 +_pdbx_distant_solvent_atoms.auth_atom_id O +_pdbx_distant_solvent_atoms.label_alt_id ? +_pdbx_distant_solvent_atoms.auth_asym_id H +_pdbx_distant_solvent_atoms.auth_comp_id HOH +_pdbx_distant_solvent_atoms.auth_seq_id 509 +_pdbx_distant_solvent_atoms.PDB_ins_code ? +_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 6.76 +_pdbx_distant_solvent_atoms.neighbor_ligand_distance . +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A ARG 319 ? A ARG 1 +2 1 Y 1 A VAL 320 ? A VAL 2 +3 1 Y 1 A GLN 321 ? A GLN 3 +4 1 Y 1 A PRO 322 ? A PRO 4 +5 1 Y 1 A THR 323 ? A THR 5 +6 1 Y 1 A GLU 324 ? A GLU 6 +7 1 Y 1 A SER 325 ? A SER 7 +8 1 Y 1 A ILE 326 ? A ILE 8 +9 1 Y 1 A VAL 327 ? A VAL 9 +10 1 Y 1 A ARG 328 ? A ARG 10 +11 1 Y 1 A PHE 329 ? A PHE 11 +12 1 Y 1 A PRO 330 ? A PRO 12 +13 1 Y 1 A ASN 331 ? A ASN 13 +14 1 Y 1 A ILE 332 ? A ILE 14 +15 1 Y 1 A THR 333 ? A THR 15 +16 1 Y 1 A HIS 519 ? A HIS 201 +17 1 Y 1 A LYS 529 ? A LYS 211 +18 1 Y 1 A SER 530 ? A SER 212 +19 1 Y 1 A THR 531 ? A THR 213 +20 1 Y 1 A ASN 532 ? A ASN 214 +21 1 Y 1 A LEU 533 ? A LEU 215 +22 1 Y 1 A VAL 534 ? A VAL 216 +23 1 Y 1 A LYS 535 ? A LYS 217 +24 1 Y 1 A ASN 536 ? A ASN 218 +25 1 Y 1 A LYS 537 ? A LYS 219 +26 1 Y 1 A CYS 538 ? A CYS 220 +27 1 Y 1 A VAL 539 ? A VAL 221 +28 1 Y 1 A ASN 540 ? A ASN 222 +29 1 Y 1 A PHE 541 ? A PHE 223 +30 1 Y 1 A HIS 542 ? A HIS 224 +31 1 Y 1 A HIS 543 ? A HIS 225 +32 1 Y 1 A HIS 544 ? A HIS 226 +33 1 Y 1 A HIS 545 ? A HIS 227 +34 1 Y 1 A HIS 546 ? A HIS 228 +35 1 Y 1 A HIS 547 ? A HIS 229 +36 1 Y 1 H GLY -1 ? B GLY 1 +37 1 Y 1 H CYS 218 ? B CYS 220 +38 1 Y 1 H ASP 219 ? B ASP 221 +39 1 Y 1 H LYS 220 ? B LYS 222 +40 1 Y 1 L GLY -1 ? C GLY 1 +41 1 Y 1 L SER 216 ? C SER 218 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +GLN N N N N 88 +GLN CA C N S 89 +GLN C C N N 90 +GLN O O N N 91 +GLN CB C N N 92 +GLN CG C N N 93 +GLN CD C N N 94 +GLN OE1 O N N 95 +GLN NE2 N N N 96 +GLN OXT O N N 97 +GLN H H N N 98 +GLN H2 H N N 99 +GLN HA H N N 100 +GLN HB2 H N N 101 +GLN HB3 H N N 102 +GLN HG2 H N N 103 +GLN HG3 H N N 104 +GLN HE21 H N N 105 +GLN HE22 H N N 106 +GLN HXT H N N 107 +GLU N N N N 108 +GLU CA C N S 109 +GLU C C N N 110 +GLU O O N N 111 +GLU CB C N N 112 +GLU CG C N N 113 +GLU CD C N N 114 +GLU OE1 O N N 115 +GLU OE2 O N N 116 +GLU OXT O N N 117 +GLU H H N N 118 +GLU H2 H N N 119 +GLU HA H N N 120 +GLU HB2 H N N 121 +GLU HB3 H N N 122 +GLU HG2 H N N 123 +GLU HG3 H N N 124 +GLU HE2 H N N 125 +GLU HXT H N N 126 +GLY N N N N 127 +GLY CA C N N 128 +GLY C C N N 129 +GLY O O N N 130 +GLY OXT O N N 131 +GLY H H N N 132 +GLY H2 H N N 133 +GLY HA2 H N N 134 +GLY HA3 H N N 135 +GLY HXT H N N 136 +HIS N N N N 137 +HIS CA C N S 138 +HIS C C N N 139 +HIS O O N N 140 +HIS CB C N N 141 +HIS CG C Y N 142 +HIS ND1 N Y N 143 +HIS CD2 C Y N 144 +HIS CE1 C Y N 145 +HIS NE2 N Y N 146 +HIS OXT O N N 147 +HIS H H N N 148 +HIS H2 H N N 149 +HIS HA H N N 150 +HIS HB2 H N N 151 +HIS HB3 H N N 152 +HIS HD1 H N N 153 +HIS HD2 H N N 154 +HIS HE1 H N N 155 +HIS HE2 H N N 156 +HIS HXT H N N 157 +HOH O O N N 158 +HOH H1 H N N 159 +HOH H2 H N N 160 +ILE N N N N 161 +ILE CA C N S 162 +ILE C C N N 163 +ILE O O N N 164 +ILE CB C N S 165 +ILE CG1 C N N 166 +ILE CG2 C N N 167 +ILE CD1 C N N 168 +ILE OXT O N N 169 +ILE H H N N 170 +ILE H2 H N N 171 +ILE HA H N N 172 +ILE HB H N N 173 +ILE HG12 H N N 174 +ILE HG13 H N N 175 +ILE HG21 H N N 176 +ILE HG22 H N N 177 +ILE HG23 H N N 178 +ILE HD11 H N N 179 +ILE HD12 H N N 180 +ILE HD13 H N N 181 +ILE HXT H N N 182 +LEU N N N N 183 +LEU CA C N S 184 +LEU C C N N 185 +LEU O O N N 186 +LEU CB C N N 187 +LEU CG C N N 188 +LEU CD1 C N N 189 +LEU CD2 C N N 190 +LEU OXT O N N 191 +LEU H H N N 192 +LEU H2 H N N 193 +LEU HA H N N 194 +LEU HB2 H N N 195 +LEU HB3 H N N 196 +LEU HG H N N 197 +LEU HD11 H N N 198 +LEU HD12 H N N 199 +LEU HD13 H N N 200 +LEU HD21 H N N 201 +LEU HD22 H N N 202 +LEU HD23 H N N 203 +LEU HXT H N N 204 +LYS N N N N 205 +LYS CA C N S 206 +LYS C C N N 207 +LYS O O N N 208 +LYS CB C N N 209 +LYS CG C N N 210 +LYS CD C N N 211 +LYS CE C N N 212 +LYS NZ N N N 213 +LYS OXT O N N 214 +LYS H H N N 215 +LYS H2 H N N 216 +LYS HA H N N 217 +LYS HB2 H N N 218 +LYS HB3 H N N 219 +LYS HG2 H N N 220 +LYS HG3 H N N 221 +LYS HD2 H N N 222 +LYS HD3 H N N 223 +LYS HE2 H N N 224 +LYS HE3 H N N 225 +LYS HZ1 H N N 226 +LYS HZ2 H N N 227 +LYS HZ3 H N N 228 +LYS HXT H N N 229 +MET N N N N 230 +MET CA C N S 231 +MET C C N N 232 +MET O O N N 233 +MET CB C N N 234 +MET CG C N N 235 +MET SD S N N 236 +MET CE C N N 237 +MET OXT O N N 238 +MET H H N N 239 +MET H2 H N N 240 +MET HA H N N 241 +MET HB2 H N N 242 +MET HB3 H N N 243 +MET HG2 H N N 244 +MET HG3 H N N 245 +MET HE1 H N N 246 +MET HE2 H N N 247 +MET HE3 H N N 248 +MET HXT H N N 249 +NAG C1 C N R 250 +NAG C2 C N R 251 +NAG C3 C N R 252 +NAG C4 C N S 253 +NAG C5 C N R 254 +NAG C6 C N N 255 +NAG C7 C N N 256 +NAG C8 C N N 257 +NAG N2 N N N 258 +NAG O1 O N N 259 +NAG O3 O N N 260 +NAG O4 O N N 261 +NAG O5 O N N 262 +NAG O6 O N N 263 +NAG O7 O N N 264 +NAG H1 H N N 265 +NAG H2 H N N 266 +NAG H3 H N N 267 +NAG H4 H N N 268 +NAG H5 H N N 269 +NAG H61 H N N 270 +NAG H62 H N N 271 +NAG H81 H N N 272 +NAG H82 H N N 273 +NAG H83 H N N 274 +NAG HN2 H N N 275 +NAG HO1 H N N 276 +NAG HO3 H N N 277 +NAG HO4 H N N 278 +NAG HO6 H N N 279 +PHE N N N N 280 +PHE CA C N S 281 +PHE C C N N 282 +PHE O O N N 283 +PHE CB C N N 284 +PHE CG C Y N 285 +PHE CD1 C Y N 286 +PHE CD2 C Y N 287 +PHE CE1 C Y N 288 +PHE CE2 C Y N 289 +PHE CZ C Y N 290 +PHE OXT O N N 291 +PHE H H N N 292 +PHE H2 H N N 293 +PHE HA H N N 294 +PHE HB2 H N N 295 +PHE HB3 H N N 296 +PHE HD1 H N N 297 +PHE HD2 H N N 298 +PHE HE1 H N N 299 +PHE HE2 H N N 300 +PHE HZ H N N 301 +PHE HXT H N N 302 +PRO N N N N 303 +PRO CA C N S 304 +PRO C C N N 305 +PRO O O N N 306 +PRO CB C N N 307 +PRO CG C N N 308 +PRO CD C N N 309 +PRO OXT O N N 310 +PRO H H N N 311 +PRO HA H N N 312 +PRO HB2 H N N 313 +PRO HB3 H N N 314 +PRO HG2 H N N 315 +PRO HG3 H N N 316 +PRO HD2 H N N 317 +PRO HD3 H N N 318 +PRO HXT H N N 319 +SER N N N N 320 +SER CA C N S 321 +SER C C N N 322 +SER O O N N 323 +SER CB C N N 324 +SER OG O N N 325 +SER OXT O N N 326 +SER H H N N 327 +SER H2 H N N 328 +SER HA H N N 329 +SER HB2 H N N 330 +SER HB3 H N N 331 +SER HG H N N 332 +SER HXT H N N 333 +THR N N N N 334 +THR CA C N S 335 +THR C C N N 336 +THR O O N N 337 +THR CB C N R 338 +THR OG1 O N N 339 +THR CG2 C N N 340 +THR OXT O N N 341 +THR H H N N 342 +THR H2 H N N 343 +THR HA H N N 344 +THR HB H N N 345 +THR HG1 H N N 346 +THR HG21 H N N 347 +THR HG22 H N N 348 +THR HG23 H N N 349 +THR HXT H N N 350 +TRP N N N N 351 +TRP CA C N S 352 +TRP C C N N 353 +TRP O O N N 354 +TRP CB C N N 355 +TRP CG C Y N 356 +TRP CD1 C Y N 357 +TRP CD2 C Y N 358 +TRP NE1 N Y N 359 +TRP CE2 C Y N 360 +TRP CE3 C Y N 361 +TRP CZ2 C Y N 362 +TRP CZ3 C Y N 363 +TRP CH2 C Y N 364 +TRP OXT O N N 365 +TRP H H N N 366 +TRP H2 H N N 367 +TRP HA H N N 368 +TRP HB2 H N N 369 +TRP HB3 H N N 370 +TRP HD1 H N N 371 +TRP HE1 H N N 372 +TRP HE3 H N N 373 +TRP HZ2 H N N 374 +TRP HZ3 H N N 375 +TRP HH2 H N N 376 +TRP HXT H N N 377 +TYR N N N N 378 +TYR CA C N S 379 +TYR C C N N 380 +TYR O O N N 381 +TYR CB C N N 382 +TYR CG C Y N 383 +TYR CD1 C Y N 384 +TYR CD2 C Y N 385 +TYR CE1 C Y N 386 +TYR CE2 C Y N 387 +TYR CZ C Y N 388 +TYR OH O N N 389 +TYR OXT O N N 390 +TYR H H N N 391 +TYR H2 H N N 392 +TYR HA H N N 393 +TYR HB2 H N N 394 +TYR HB3 H N N 395 +TYR HD1 H N N 396 +TYR HD2 H N N 397 +TYR HE1 H N N 398 +TYR HE2 H N N 399 +TYR HH H N N 400 +TYR HXT H N N 401 +VAL N N N N 402 +VAL CA C N S 403 +VAL C C N N 404 +VAL O O N N 405 +VAL CB C N N 406 +VAL CG1 C N N 407 +VAL CG2 C N N 408 +VAL OXT O N N 409 +VAL H H N N 410 +VAL H2 H N N 411 +VAL HA H N N 412 +VAL HB H N N 413 +VAL HG11 H N N 414 +VAL HG12 H N N 415 +VAL HG13 H N N 416 +VAL HG21 H N N 417 +VAL HG22 H N N 418 +VAL HG23 H N N 419 +VAL HXT H N N 420 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +GLN N CA sing N N 83 +GLN N H sing N N 84 +GLN N H2 sing N N 85 +GLN CA C sing N N 86 +GLN CA CB sing N N 87 +GLN CA HA sing N N 88 +GLN C O doub N N 89 +GLN C OXT sing N N 90 +GLN CB CG sing N N 91 +GLN CB HB2 sing N N 92 +GLN CB HB3 sing N N 93 +GLN CG CD sing N N 94 +GLN CG HG2 sing N N 95 +GLN CG HG3 sing N N 96 +GLN CD OE1 doub N N 97 +GLN CD NE2 sing N N 98 +GLN NE2 HE21 sing N N 99 +GLN NE2 HE22 sing N N 100 +GLN OXT HXT sing N N 101 +GLU N CA sing N N 102 +GLU N H sing N N 103 +GLU N H2 sing N N 104 +GLU CA C sing N N 105 +GLU CA CB sing N N 106 +GLU CA HA sing N N 107 +GLU C O doub N N 108 +GLU C OXT sing N N 109 +GLU CB CG sing N N 110 +GLU CB HB2 sing N N 111 +GLU CB HB3 sing N N 112 +GLU CG CD sing N N 113 +GLU CG HG2 sing N N 114 +GLU CG HG3 sing N N 115 +GLU CD OE1 doub N N 116 +GLU CD OE2 sing N N 117 +GLU OE2 HE2 sing N N 118 +GLU OXT HXT sing N N 119 +GLY N CA sing N N 120 +GLY N H sing N N 121 +GLY N H2 sing N N 122 +GLY CA C sing N N 123 +GLY CA HA2 sing N N 124 +GLY CA HA3 sing N N 125 +GLY C O doub N N 126 +GLY C OXT sing N N 127 +GLY OXT HXT sing N N 128 +HIS N CA sing N N 129 +HIS N H sing N N 130 +HIS N H2 sing N N 131 +HIS CA C sing N N 132 +HIS CA CB sing N N 133 +HIS CA HA sing N N 134 +HIS C O doub N N 135 +HIS C OXT sing N N 136 +HIS CB CG sing N N 137 +HIS CB HB2 sing N N 138 +HIS CB HB3 sing N N 139 +HIS CG ND1 sing Y N 140 +HIS CG CD2 doub Y N 141 +HIS ND1 CE1 doub Y N 142 +HIS ND1 HD1 sing N N 143 +HIS CD2 NE2 sing Y N 144 +HIS CD2 HD2 sing N N 145 +HIS CE1 NE2 sing Y N 146 +HIS CE1 HE1 sing N N 147 +HIS NE2 HE2 sing N N 148 +HIS OXT HXT sing N N 149 +HOH O H1 sing N N 150 +HOH O H2 sing N N 151 +ILE N CA sing N N 152 +ILE N H sing N N 153 +ILE N H2 sing N N 154 +ILE CA C sing N N 155 +ILE CA CB sing N N 156 +ILE CA HA sing N N 157 +ILE C O doub N N 158 +ILE C OXT sing N N 159 +ILE CB CG1 sing N N 160 +ILE CB CG2 sing N N 161 +ILE CB HB sing N N 162 +ILE CG1 CD1 sing N N 163 +ILE CG1 HG12 sing N N 164 +ILE CG1 HG13 sing N N 165 +ILE CG2 HG21 sing N N 166 +ILE CG2 HG22 sing N N 167 +ILE CG2 HG23 sing N N 168 +ILE CD1 HD11 sing N N 169 +ILE CD1 HD12 sing N N 170 +ILE CD1 HD13 sing N N 171 +ILE OXT HXT sing N N 172 +LEU N CA sing N N 173 +LEU N H sing N N 174 +LEU N H2 sing N N 175 +LEU CA C sing N N 176 +LEU CA CB sing N N 177 +LEU CA HA sing N N 178 +LEU C O doub N N 179 +LEU C OXT sing N N 180 +LEU CB CG sing N N 181 +LEU CB HB2 sing N N 182 +LEU CB HB3 sing N N 183 +LEU CG CD1 sing N N 184 +LEU CG CD2 sing N N 185 +LEU CG HG sing N N 186 +LEU CD1 HD11 sing N N 187 +LEU CD1 HD12 sing N N 188 +LEU CD1 HD13 sing N N 189 +LEU CD2 HD21 sing N N 190 +LEU CD2 HD22 sing N N 191 +LEU CD2 HD23 sing N N 192 +LEU OXT HXT sing N N 193 +LYS N CA sing N N 194 +LYS N H sing N N 195 +LYS N H2 sing N N 196 +LYS CA C sing N N 197 +LYS CA CB sing N N 198 +LYS CA HA sing N N 199 +LYS C O doub N N 200 +LYS C OXT sing N N 201 +LYS CB CG sing N N 202 +LYS CB HB2 sing N N 203 +LYS CB HB3 sing N N 204 +LYS CG CD sing N N 205 +LYS CG HG2 sing N N 206 +LYS CG HG3 sing N N 207 +LYS CD CE sing N N 208 +LYS CD HD2 sing N N 209 +LYS CD HD3 sing N N 210 +LYS CE NZ sing N N 211 +LYS CE HE2 sing N N 212 +LYS CE HE3 sing N N 213 +LYS NZ HZ1 sing N N 214 +LYS NZ HZ2 sing N N 215 +LYS NZ HZ3 sing N N 216 +LYS OXT HXT sing N N 217 +MET N CA sing N N 218 +MET N H sing N N 219 +MET N H2 sing N N 220 +MET CA C sing N N 221 +MET CA CB sing N N 222 +MET CA HA sing N N 223 +MET C O doub N N 224 +MET C OXT sing N N 225 +MET CB CG sing N N 226 +MET CB HB2 sing N N 227 +MET CB HB3 sing N N 228 +MET CG SD sing N N 229 +MET CG HG2 sing N N 230 +MET CG HG3 sing N N 231 +MET SD CE sing N N 232 +MET CE HE1 sing N N 233 +MET CE HE2 sing N N 234 +MET CE HE3 sing N N 235 +MET OXT HXT sing N N 236 +NAG C1 C2 sing N N 237 +NAG C1 O1 sing N N 238 +NAG C1 O5 sing N N 239 +NAG C1 H1 sing N N 240 +NAG C2 C3 sing N N 241 +NAG C2 N2 sing N N 242 +NAG C2 H2 sing N N 243 +NAG C3 C4 sing N N 244 +NAG C3 O3 sing N N 245 +NAG C3 H3 sing N N 246 +NAG C4 C5 sing N N 247 +NAG C4 O4 sing N N 248 +NAG C4 H4 sing N N 249 +NAG C5 C6 sing N N 250 +NAG C5 O5 sing N N 251 +NAG C5 H5 sing N N 252 +NAG C6 O6 sing N N 253 +NAG C6 H61 sing N N 254 +NAG C6 H62 sing N N 255 +NAG C7 C8 sing N N 256 +NAG C7 N2 sing N N 257 +NAG C7 O7 doub N N 258 +NAG C8 H81 sing N N 259 +NAG C8 H82 sing N N 260 +NAG C8 H83 sing N N 261 +NAG N2 HN2 sing N N 262 +NAG O1 HO1 sing N N 263 +NAG O3 HO3 sing N N 264 +NAG O4 HO4 sing N N 265 +NAG O6 HO6 sing N N 266 +PHE N CA sing N N 267 +PHE N H sing N N 268 +PHE N H2 sing N N 269 +PHE CA C sing N N 270 +PHE CA CB sing N N 271 +PHE CA HA sing N N 272 +PHE C O doub N N 273 +PHE C OXT sing N N 274 +PHE CB CG sing N N 275 +PHE CB HB2 sing N N 276 +PHE CB HB3 sing N N 277 +PHE CG CD1 doub Y N 278 +PHE CG CD2 sing Y N 279 +PHE CD1 CE1 sing Y N 280 +PHE CD1 HD1 sing N N 281 +PHE CD2 CE2 doub Y N 282 +PHE CD2 HD2 sing N N 283 +PHE CE1 CZ doub Y N 284 +PHE CE1 HE1 sing N N 285 +PHE CE2 CZ sing Y N 286 +PHE CE2 HE2 sing N N 287 +PHE CZ HZ sing N N 288 +PHE OXT HXT sing N N 289 +PRO N CA sing N N 290 +PRO N CD sing N N 291 +PRO N H sing N N 292 +PRO CA C sing N N 293 +PRO CA CB sing N N 294 +PRO CA HA sing N N 295 +PRO C O doub N N 296 +PRO C OXT sing N N 297 +PRO CB CG sing N N 298 +PRO CB HB2 sing N N 299 +PRO CB HB3 sing N N 300 +PRO CG CD sing N N 301 +PRO CG HG2 sing N N 302 +PRO CG HG3 sing N N 303 +PRO CD HD2 sing N N 304 +PRO CD HD3 sing N N 305 +PRO OXT HXT sing N N 306 +SER N CA sing N N 307 +SER N H sing N N 308 +SER N H2 sing N N 309 +SER CA C sing N N 310 +SER CA CB sing N N 311 +SER CA HA sing N N 312 +SER C O doub N N 313 +SER C OXT sing N N 314 +SER CB OG sing N N 315 +SER CB HB2 sing N N 316 +SER CB HB3 sing N N 317 +SER OG HG sing N N 318 +SER OXT HXT sing N N 319 +THR N CA sing N N 320 +THR N H sing N N 321 +THR N H2 sing N N 322 +THR CA C sing N N 323 +THR CA CB sing N N 324 +THR CA HA sing N N 325 +THR C O doub N N 326 +THR C OXT sing N N 327 +THR CB OG1 sing N N 328 +THR CB CG2 sing N N 329 +THR CB HB sing N N 330 +THR OG1 HG1 sing N N 331 +THR CG2 HG21 sing N N 332 +THR CG2 HG22 sing N N 333 +THR CG2 HG23 sing N N 334 +THR OXT HXT sing N N 335 +TRP N CA sing N N 336 +TRP N H sing N N 337 +TRP N H2 sing N N 338 +TRP CA C sing N N 339 +TRP CA CB sing N N 340 +TRP CA HA sing N N 341 +TRP C O doub N N 342 +TRP C OXT sing N N 343 +TRP CB CG sing N N 344 +TRP CB HB2 sing N N 345 +TRP CB HB3 sing N N 346 +TRP CG CD1 doub Y N 347 +TRP CG CD2 sing Y N 348 +TRP CD1 NE1 sing Y N 349 +TRP CD1 HD1 sing N N 350 +TRP CD2 CE2 doub Y N 351 +TRP CD2 CE3 sing Y N 352 +TRP NE1 CE2 sing Y N 353 +TRP NE1 HE1 sing N N 354 +TRP CE2 CZ2 sing Y N 355 +TRP CE3 CZ3 doub Y N 356 +TRP CE3 HE3 sing N N 357 +TRP CZ2 CH2 doub Y N 358 +TRP CZ2 HZ2 sing N N 359 +TRP CZ3 CH2 sing Y N 360 +TRP CZ3 HZ3 sing N N 361 +TRP CH2 HH2 sing N N 362 +TRP OXT HXT sing N N 363 +TYR N CA sing N N 364 +TYR N H sing N N 365 +TYR N H2 sing N N 366 +TYR CA C sing N N 367 +TYR CA CB sing N N 368 +TYR CA HA sing N N 369 +TYR C O doub N N 370 +TYR C OXT sing N N 371 +TYR CB CG sing N N 372 +TYR CB HB2 sing N N 373 +TYR CB HB3 sing N N 374 +TYR CG CD1 doub Y N 375 +TYR CG CD2 sing Y N 376 +TYR CD1 CE1 sing Y N 377 +TYR CD1 HD1 sing N N 378 +TYR CD2 CE2 doub Y N 379 +TYR CD2 HD2 sing N N 380 +TYR CE1 CZ doub Y N 381 +TYR CE1 HE1 sing N N 382 +TYR CE2 CZ sing Y N 383 +TYR CE2 HE2 sing N N 384 +TYR CZ OH sing N N 385 +TYR OH HH sing N N 386 +TYR OXT HXT sing N N 387 +VAL N CA sing N N 388 +VAL N H sing N N 389 +VAL N H2 sing N N 390 +VAL CA C sing N N 391 +VAL CA CB sing N N 392 +VAL CA HA sing N N 393 +VAL C O doub N N 394 +VAL C OXT sing N N 395 +VAL CB CG1 sing N N 396 +VAL CB CG2 sing N N 397 +VAL CB HB sing N N 398 +VAL CG1 HG11 sing N N 399 +VAL CG1 HG12 sing N N 400 +VAL CG1 HG13 sing N N 401 +VAL CG2 HG21 sing N N 402 +VAL CG2 HG22 sing N N 403 +VAL CG2 HG23 sing N N 404 +VAL OXT HXT sing N N 405 +# +_pdbx_audit_support.funding_organization 'National Natural Science Foundation of China (NSFC)' +_pdbx_audit_support.country China +_pdbx_audit_support.grant_number '31872745, 81902058' +_pdbx_audit_support.ordinal 1 +# +loop_ +_pdbx_initial_refinement_model.id +_pdbx_initial_refinement_model.entity_id_list +_pdbx_initial_refinement_model.type +_pdbx_initial_refinement_model.source_name +_pdbx_initial_refinement_model.accession_code +_pdbx_initial_refinement_model.details +1 ? 'experimental model' PDB 6LZG '6LZG, 4TSA' +2 ? 'experimental model' PDB 4TSA '6LZG, 4TSA' +# +_atom_sites.entry_id 7BZ5 +_atom_sites.Cartn_transf_matrix[1][1] ? +_atom_sites.Cartn_transf_matrix[1][2] ? +_atom_sites.Cartn_transf_matrix[1][3] ? +_atom_sites.Cartn_transf_matrix[2][1] ? +_atom_sites.Cartn_transf_matrix[2][2] ? +_atom_sites.Cartn_transf_matrix[2][3] ? +_atom_sites.Cartn_transf_matrix[3][1] ? +_atom_sites.Cartn_transf_matrix[3][2] ? +_atom_sites.Cartn_transf_matrix[3][3] ? +_atom_sites.Cartn_transf_vector[1] ? +_atom_sites.Cartn_transf_vector[2] ? +_atom_sites.Cartn_transf_vector[3] ? +_atom_sites.fract_transf_matrix[1][1] 0.005122 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.000921 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.011572 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.017879 +_atom_sites.fract_transf_vector[1] 0.000000 +_atom_sites.fract_transf_vector[2] 0.000000 +_atom_sites.fract_transf_vector[3] 0.000000 +_atom_sites.solution_primary ? +_atom_sites.solution_secondary ? +_atom_sites.solution_hydrogens ? +_atom_sites.special_details ? +# +loop_ +_atom_type.symbol +C +N +O +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . ASN A 1 16 ? -97.586 -23.391 20.863 1.00 78.72 ? 334 ASN A N 1 +ATOM 2 C CA . ASN A 1 16 ? -96.574 -24.445 20.926 1.00 87.70 ? 334 ASN A CA 1 +ATOM 3 C C . ASN A 1 16 ? -95.340 -24.083 20.097 1.00 87.53 ? 334 ASN A C 1 +ATOM 4 O O . ASN A 1 16 ? -95.282 -24.384 18.912 1.00 82.66 ? 334 ASN A O 1 +ATOM 5 C CB . ASN A 1 16 ? -97.160 -25.779 20.445 1.00 96.18 ? 334 ASN A CB 1 +ATOM 6 C CG . ASN A 1 16 ? -96.964 -26.895 21.448 1.00 100.50 ? 334 ASN A CG 1 +ATOM 7 O OD1 . ASN A 1 16 ? -96.194 -26.760 22.402 1.00 102.51 ? 334 ASN A OD1 1 +ATOM 8 N ND2 . ASN A 1 16 ? -97.660 -28.007 21.239 1.00 100.03 ? 334 ASN A ND2 1 +ATOM 9 N N . LEU A 1 17 ? -94.361 -23.435 20.722 1.00 85.96 ? 335 LEU A N 1 +ATOM 10 C CA . LEU A 1 17 ? -93.211 -22.912 19.999 1.00 83.10 ? 335 LEU A CA 1 +ATOM 11 C C . LEU A 1 17 ? -92.115 -23.961 19.850 1.00 77.82 ? 335 LEU A C 1 +ATOM 12 O O . LEU A 1 17 ? -91.881 -24.783 20.739 1.00 80.53 ? 335 LEU A O 1 +ATOM 13 C CB . LEU A 1 17 ? -92.652 -21.665 20.689 1.00 78.66 ? 335 LEU A CB 1 +ATOM 14 C CG . LEU A 1 17 ? -93.584 -20.448 20.769 1.00 82.23 ? 335 LEU A CG 1 +ATOM 15 C CD1 . LEU A 1 17 ? -94.495 -20.484 22.000 1.00 84.72 ? 335 LEU A CD1 1 +ATOM 16 C CD2 . LEU A 1 17 ? -92.785 -19.146 20.707 1.00 78.16 ? 335 LEU A CD2 1 +ATOM 17 N N . CYS A 1 18 ? -91.437 -23.912 18.712 1.00 74.95 ? 336 CYS A N 1 +ATOM 18 C CA . CYS A 1 18 ? -90.423 -24.908 18.407 1.00 67.24 ? 336 CYS A CA 1 +ATOM 19 C C . CYS A 1 18 ? -89.238 -24.779 19.365 1.00 60.59 ? 336 CYS A C 1 +ATOM 20 O O . CYS A 1 18 ? -88.855 -23.667 19.742 1.00 57.89 ? 336 CYS A O 1 +ATOM 21 C CB . CYS A 1 18 ? -89.967 -24.763 16.959 1.00 75.83 ? 336 CYS A CB 1 +ATOM 22 S SG . CYS A 1 18 ? -91.319 -25.009 15.766 1.00 79.90 ? 336 CYS A SG 1 +ATOM 23 N N . PRO A 1 19 ? -88.641 -25.896 19.779 1.00 68.05 ? 337 PRO A N 1 +ATOM 24 C CA . PRO A 1 19 ? -87.626 -25.876 20.847 1.00 71.15 ? 337 PRO A CA 1 +ATOM 25 C C . PRO A 1 19 ? -86.213 -25.574 20.343 1.00 62.65 ? 337 PRO A C 1 +ATOM 26 O O . PRO A 1 19 ? -85.276 -26.348 20.554 1.00 59.13 ? 337 PRO A O 1 +ATOM 27 C CB . PRO A 1 19 ? -87.739 -27.292 21.417 1.00 72.88 ? 337 PRO A CB 1 +ATOM 28 C CG . PRO A 1 19 ? -88.055 -28.125 20.221 1.00 64.26 ? 337 PRO A CG 1 +ATOM 29 C CD . PRO A 1 19 ? -88.973 -27.273 19.368 1.00 69.51 ? 337 PRO A CD 1 +ATOM 30 N N . PHE A 1 20 ? -86.048 -24.417 19.694 1.00 65.97 ? 338 PHE A N 1 +ATOM 31 C CA . PHE A 1 20 ? -84.735 -24.050 19.165 1.00 62.37 ? 338 PHE A CA 1 +ATOM 32 C C . PHE A 1 20 ? -83.712 -23.845 20.275 1.00 59.74 ? 338 PHE A C 1 +ATOM 33 O O . PHE A 1 20 ? -82.519 -24.100 20.068 1.00 55.97 ? 338 PHE A O 1 +ATOM 34 C CB . PHE A 1 20 ? -84.846 -22.789 18.307 1.00 55.04 ? 338 PHE A CB 1 +ATOM 35 C CG . PHE A 1 20 ? -85.497 -23.024 16.977 1.00 59.71 ? 338 PHE A CG 1 +ATOM 36 C CD1 . PHE A 1 20 ? -85.200 -24.159 16.237 1.00 66.47 ? 338 PHE A CD1 1 +ATOM 37 C CD2 . PHE A 1 20 ? -86.422 -22.124 16.473 1.00 68.81 ? 338 PHE A CD2 1 +ATOM 38 C CE1 . PHE A 1 20 ? -85.804 -24.384 15.012 1.00 69.58 ? 338 PHE A CE1 1 +ATOM 39 C CE2 . PHE A 1 20 ? -87.030 -22.345 15.251 1.00 74.81 ? 338 PHE A CE2 1 +ATOM 40 C CZ . PHE A 1 20 ? -86.718 -23.478 14.519 1.00 72.80 ? 338 PHE A CZ 1 +ATOM 41 N N . GLY A 1 21 ? -84.154 -23.391 21.451 1.00 60.77 ? 339 GLY A N 1 +ATOM 42 C CA . GLY A 1 21 ? -83.227 -23.193 22.555 1.00 62.45 ? 339 GLY A CA 1 +ATOM 43 C C . GLY A 1 21 ? -82.541 -24.477 22.978 1.00 59.71 ? 339 GLY A C 1 +ATOM 44 O O . GLY A 1 21 ? -81.379 -24.464 23.393 1.00 58.25 ? 339 GLY A O 1 +ATOM 45 N N . GLU A 1 22 ? -83.252 -25.605 22.880 1.00 55.97 ? 340 GLU A N 1 +ATOM 46 C CA . GLU A 1 22 ? -82.633 -26.904 23.126 1.00 49.09 ? 340 GLU A CA 1 +ATOM 47 C C . GLU A 1 22 ? -81.449 -27.149 22.203 1.00 50.93 ? 340 GLU A C 1 +ATOM 48 O O . GLU A 1 22 ? -80.494 -27.833 22.588 1.00 51.89 ? 340 GLU A O 1 +ATOM 49 C CB . GLU A 1 22 ? -83.655 -28.026 22.938 1.00 59.74 ? 340 GLU A CB 1 +ATOM 50 C CG . GLU A 1 22 ? -84.388 -28.450 24.194 1.00 72.53 ? 340 GLU A CG 1 +ATOM 51 C CD . GLU A 1 22 ? -85.592 -29.322 23.893 1.00 80.52 ? 340 GLU A CD 1 +ATOM 52 O OE1 . GLU A 1 22 ? -85.417 -30.546 23.718 1.00 84.25 ? 340 GLU A OE1 1 +ATOM 53 O OE2 . GLU A 1 22 ? -86.717 -28.788 23.849 1.00 89.29 ? 340 GLU A OE2 1 +ATOM 54 N N . VAL A 1 23 ? -81.495 -26.622 20.984 1.00 43.96 ? 341 VAL A N 1 +ATOM 55 C CA . VAL A 1 23 ? -80.442 -26.893 20.010 1.00 41.77 ? 341 VAL A CA 1 +ATOM 56 C C . VAL A 1 23 ? -79.338 -25.848 20.082 1.00 43.19 ? 341 VAL A C 1 +ATOM 57 O O . VAL A 1 23 ? -78.156 -26.184 20.196 1.00 43.44 ? 341 VAL A O 1 +ATOM 58 C CB . VAL A 1 23 ? -81.043 -26.974 18.592 1.00 45.96 ? 341 VAL A CB 1 +ATOM 59 C CG1 . VAL A 1 23 ? -79.947 -27.183 17.571 1.00 42.03 ? 341 VAL A CG1 1 +ATOM 60 C CG2 . VAL A 1 23 ? -82.088 -28.086 18.510 1.00 51.22 ? 341 VAL A CG2 1 +ATOM 61 N N . PHE A 1 24 ? -79.710 -24.568 20.026 1.00 43.76 ? 342 PHE A N 1 +ATOM 62 C CA . PHE A 1 24 ? -78.708 -23.511 19.936 1.00 43.45 ? 342 PHE A CA 1 +ATOM 63 C C . PHE A 1 24 ? -77.973 -23.321 21.252 1.00 46.39 ? 342 PHE A C 1 +ATOM 64 O O . PHE A 1 24 ? -76.774 -23.028 21.261 1.00 43.00 ? 342 PHE A O 1 +ATOM 65 C CB . PHE A 1 24 ? -79.369 -22.207 19.497 1.00 40.64 ? 342 PHE A CB 1 +ATOM 66 C CG . PHE A 1 24 ? -79.679 -22.163 18.035 1.00 45.47 ? 342 PHE A CG 1 +ATOM 67 C CD1 . PHE A 1 24 ? -78.735 -21.709 17.128 1.00 38.95 ? 342 PHE A CD1 1 +ATOM 68 C CD2 . PHE A 1 24 ? -80.898 -22.614 17.560 1.00 49.23 ? 342 PHE A CD2 1 +ATOM 69 C CE1 . PHE A 1 24 ? -79.015 -21.680 15.770 1.00 38.54 ? 342 PHE A CE1 1 +ATOM 70 C CE2 . PHE A 1 24 ? -81.184 -22.590 16.207 1.00 45.68 ? 342 PHE A CE2 1 +ATOM 71 C CZ . PHE A 1 24 ? -80.240 -22.125 15.310 1.00 42.47 ? 342 PHE A CZ 1 +ATOM 72 N N . ASN A 1 25 ? -78.675 -23.477 22.371 1.00 48.13 ? 343 ASN A N 1 +ATOM 73 C CA . ASN A 1 25 ? -78.106 -23.236 23.688 1.00 47.52 ? 343 ASN A CA 1 +ATOM 74 C C . ASN A 1 25 ? -77.799 -24.532 24.428 1.00 46.72 ? 343 ASN A C 1 +ATOM 75 O O . ASN A 1 25 ? -77.755 -24.538 25.661 1.00 52.49 ? 343 ASN A O 1 +ATOM 76 C CB . ASN A 1 25 ? -79.048 -22.349 24.512 1.00 47.33 ? 343 ASN A CB 1 +ATOM 77 C CG . ASN A 1 25 ? -78.962 -20.873 24.118 1.00 60.57 ? 343 ASN A CG 1 +ATOM 78 O OD1 . ASN A 1 25 ? -77.982 -20.440 23.512 1.00 62.21 ? 343 ASN A OD1 1 +ATOM 79 N ND2 . ASN A 1 25 ? -79.992 -20.098 24.463 1.00 68.31 ? 343 ASN A ND2 1 +ATOM 80 N N . ALA A 1 26 ? -77.593 -25.629 23.703 1.00 42.47 ? 344 ALA A N 1 +ATOM 81 C CA . ALA A 1 26 ? -77.208 -26.882 24.339 1.00 46.50 ? 344 ALA A CA 1 +ATOM 82 C C . ALA A 1 26 ? -75.819 -26.759 24.954 1.00 43.43 ? 344 ALA A C 1 +ATOM 83 O O . ALA A 1 26 ? -74.913 -26.166 24.366 1.00 45.55 ? 344 ALA A O 1 +ATOM 84 C CB . ALA A 1 26 ? -77.236 -28.025 23.325 1.00 42.92 ? 344 ALA A CB 1 +ATOM 85 N N . THR A 1 27 ? -75.659 -27.316 26.156 1.00 46.34 ? 345 THR A N 1 +ATOM 86 C CA . THR A 1 27 ? -74.381 -27.208 26.857 1.00 48.88 ? 345 THR A CA 1 +ATOM 87 C C . THR A 1 27 ? -73.273 -27.919 26.096 1.00 48.61 ? 345 THR A C 1 +ATOM 88 O O . THR A 1 27 ? -72.169 -27.379 25.944 1.00 44.88 ? 345 THR A O 1 +ATOM 89 C CB . THR A 1 27 ? -74.506 -27.777 28.273 1.00 53.04 ? 345 THR A CB 1 +ATOM 90 O OG1 . THR A 1 27 ? -75.344 -26.924 29.054 1.00 60.85 ? 345 THR A OG1 1 +ATOM 91 C CG2 . THR A 1 27 ? -73.139 -27.880 28.937 1.00 50.32 ? 345 THR A CG2 1 +ATOM 92 N N . ARG A 1 28 ? -73.555 -29.123 25.601 1.00 50.75 ? 346 ARG A N 1 +ATOM 93 C CA . ARG A 1 28 ? -72.607 -29.920 24.835 1.00 50.79 ? 346 ARG A CA 1 +ATOM 94 C C . ARG A 1 28 ? -73.068 -30.033 23.384 1.00 33.76 ? 346 ARG A C 1 +ATOM 95 O O . ARG A 1 28 ? -74.267 -30.170 23.113 1.00 40.78 ? 346 ARG A O 1 +ATOM 96 C CB . ARG A 1 28 ? -72.460 -31.315 25.451 1.00 63.27 ? 346 ARG A CB 1 +ATOM 97 C CG . ARG A 1 28 ? -71.158 -31.549 26.210 1.00 80.87 ? 346 ARG A CG 1 +ATOM 98 C CD . ARG A 1 28 ? -70.021 -31.942 25.269 1.00 94.28 ? 346 ARG A CD 1 +ATOM 99 N NE . ARG A 1 28 ? -68.997 -32.744 25.941 1.00 102.82 ? 346 ARG A NE 1 +ATOM 100 C CZ . ARG A 1 28 ? -67.901 -33.215 25.352 1.00 102.70 ? 346 ARG A CZ 1 +ATOM 101 N NH1 . ARG A 1 28 ? -67.037 -33.937 26.048 1.00 105.36 ? 346 ARG A NH1 1 +ATOM 102 N NH2 . ARG A 1 28 ? -67.666 -32.973 24.068 1.00 97.17 ? 346 ARG A NH2 1 +ATOM 103 N N . PHE A 1 29 ? -72.111 -29.962 22.459 1.00 34.04 ? 347 PHE A N 1 +ATOM 104 C CA . PHE A 1 29 ? -72.343 -30.160 21.036 1.00 35.96 ? 347 PHE A CA 1 +ATOM 105 C C . PHE A 1 29 ? -71.629 -31.424 20.576 1.00 29.13 ? 347 PHE A C 1 +ATOM 106 O O . PHE A 1 29 ? -70.647 -31.855 21.185 1.00 29.76 ? 347 PHE A O 1 +ATOM 107 C CB . PHE A 1 29 ? -71.840 -28.963 20.215 1.00 34.48 ? 347 PHE A CB 1 +ATOM 108 C CG . PHE A 1 29 ? -72.902 -27.939 19.910 1.00 33.20 ? 347 PHE A CG 1 +ATOM 109 C CD1 . PHE A 1 29 ? -73.680 -27.407 20.927 1.00 32.27 ? 347 PHE A CD1 1 +ATOM 110 C CD2 . PHE A 1 29 ? -73.121 -27.514 18.608 1.00 28.85 ? 347 PHE A CD2 1 +ATOM 111 C CE1 . PHE A 1 29 ? -74.658 -26.462 20.647 1.00 39.21 ? 347 PHE A CE1 1 +ATOM 112 C CE2 . PHE A 1 29 ? -74.096 -26.575 18.319 1.00 29.82 ? 347 PHE A CE2 1 +ATOM 113 C CZ . PHE A 1 29 ? -74.871 -26.050 19.342 1.00 33.04 ? 347 PHE A CZ 1 +ATOM 114 N N . ALA A 1 30 ? -72.130 -32.018 19.498 1.00 26.44 ? 348 ALA A N 1 +ATOM 115 C CA . ALA A 1 30 ? -71.541 -33.245 18.977 1.00 25.84 ? 348 ALA A CA 1 +ATOM 116 C C . ALA A 1 30 ? -70.228 -32.972 18.250 1.00 24.11 ? 348 ALA A C 1 +ATOM 117 O O . ALA A 1 30 ? -69.998 -31.877 17.731 1.00 26.67 ? 348 ALA A O 1 +ATOM 118 C CB . ALA A 1 30 ? -72.511 -33.929 18.013 1.00 31.35 ? 348 ALA A CB 1 +ATOM 119 N N . SER A 1 31 ? -69.363 -33.993 18.202 1.00 23.95 ? 349 SER A N 1 +ATOM 120 C CA . SER A 1 31 ? -68.326 -34.014 17.171 1.00 23.10 ? 349 SER A CA 1 +ATOM 121 C C . SER A 1 31 ? -68.968 -34.112 15.794 1.00 25.95 ? 349 SER A C 1 +ATOM 122 O O . SER A 1 31 ? -70.016 -34.741 15.621 1.00 25.90 ? 349 SER A O 1 +ATOM 123 C CB . SER A 1 31 ? -67.359 -35.186 17.352 1.00 28.21 ? 349 SER A CB 1 +ATOM 124 O OG . SER A 1 31 ? -66.538 -35.039 18.501 1.00 27.05 ? 349 SER A OG 1 +ATOM 125 N N . VAL A 1 32 ? -68.307 -33.507 14.801 1.00 22.18 ? 350 VAL A N 1 +ATOM 126 C CA . VAL A 1 32 ? -68.897 -33.422 13.465 1.00 24.49 ? 350 VAL A CA 1 +ATOM 127 C C . VAL A 1 32 ? -69.064 -34.804 12.825 1.00 25.09 ? 350 VAL A C 1 +ATOM 128 O O . VAL A 1 32 ? -70.018 -35.025 12.070 1.00 29.02 ? 350 VAL A O 1 +ATOM 129 C CB . VAL A 1 32 ? -68.076 -32.460 12.579 1.00 22.36 ? 350 VAL A CB 1 +ATOM 130 C CG1 . VAL A 1 32 ? -66.648 -32.972 12.338 1.00 25.17 ? 350 VAL A CG1 1 +ATOM 131 C CG2 . VAL A 1 32 ? -68.798 -32.182 11.242 1.00 23.27 ? 350 VAL A CG2 1 +ATOM 132 N N . TYR A 1 33 ? -68.177 -35.763 13.109 1.00 24.45 ? 351 TYR A N 1 +ATOM 133 C CA . TYR A 1 33 ? -68.360 -37.078 12.486 1.00 25.50 ? 351 TYR A CA 1 +ATOM 134 C C . TYR A 1 33 ? -69.598 -37.759 13.039 1.00 26.31 ? 351 TYR A C 1 +ATOM 135 O O . TYR A 1 33 ? -70.228 -38.567 12.350 1.00 28.21 ? 351 TYR A O 1 +ATOM 136 C CB . TYR A 1 33 ? -67.130 -37.974 12.695 1.00 21.86 ? 351 TYR A CB 1 +ATOM 137 C CG . TYR A 1 33 ? -67.113 -38.678 14.036 1.00 25.34 ? 351 TYR A CG 1 +ATOM 138 C CD1 . TYR A 1 33 ? -66.622 -38.034 15.168 1.00 25.78 ? 351 TYR A CD1 1 +ATOM 139 C CD2 . TYR A 1 33 ? -67.597 -39.975 14.175 1.00 27.50 ? 351 TYR A CD2 1 +ATOM 140 C CE1 . TYR A 1 33 ? -66.625 -38.664 16.410 1.00 29.16 ? 351 TYR A CE1 1 +ATOM 141 C CE2 . TYR A 1 33 ? -67.607 -40.608 15.415 1.00 31.53 ? 351 TYR A CE2 1 +ATOM 142 C CZ . TYR A 1 33 ? -67.112 -39.943 16.525 1.00 32.61 ? 351 TYR A CZ 1 +ATOM 143 O OH . TYR A 1 33 ? -67.101 -40.564 17.756 1.00 34.38 ? 351 TYR A OH 1 +ATOM 144 N N . ALA A 1 34 ? -69.950 -37.444 14.275 1.00 22.43 ? 352 ALA A N 1 +ATOM 145 C CA . ALA A 1 34 ? -71.100 -38.015 14.957 1.00 22.62 ? 352 ALA A CA 1 +ATOM 146 C C . ALA A 1 34 ? -72.193 -36.964 15.123 1.00 29.19 ? 352 ALA A C 1 +ATOM 147 O O . ALA A 1 34 ? -72.855 -36.896 16.156 1.00 28.93 ? 352 ALA A O 1 +ATOM 148 C CB . ALA A 1 34 ? -70.683 -38.595 16.307 1.00 27.40 ? 352 ALA A CB 1 +ATOM 149 N N . TRP A 1 35 ? -72.417 -36.179 14.068 1.00 26.69 ? 353 TRP A N 1 +ATOM 150 C CA . TRP A 1 35 ? -73.259 -34.997 14.147 1.00 27.71 ? 353 TRP A CA 1 +ATOM 151 C C . TRP A 1 35 ? -74.661 -35.343 14.634 1.00 26.33 ? 353 TRP A C 1 +ATOM 152 O O . TRP A 1 35 ? -75.215 -36.402 14.320 1.00 26.97 ? 353 TRP A O 1 +ATOM 153 C CB . TRP A 1 35 ? -73.318 -34.294 12.783 1.00 24.08 ? 353 TRP A CB 1 +ATOM 154 C CG . TRP A 1 35 ? -73.639 -35.163 11.564 1.00 21.91 ? 353 TRP A CG 1 +ATOM 155 C CD1 . TRP A 1 35 ? -72.733 -35.827 10.760 1.00 23.37 ? 353 TRP A CD1 1 +ATOM 156 C CD2 . TRP A 1 35 ? -74.930 -35.380 10.969 1.00 21.74 ? 353 TRP A CD2 1 +ATOM 157 N NE1 . TRP A 1 35 ? -73.394 -36.467 9.730 1.00 22.83 ? 353 TRP A NE1 1 +ATOM 158 C CE2 . TRP A 1 35 ? -74.738 -36.205 9.836 1.00 23.24 ? 353 TRP A CE2 1 +ATOM 159 C CE3 . TRP A 1 35 ? -76.240 -34.969 11.295 1.00 23.84 ? 353 TRP A CE3 1 +ATOM 160 C CZ2 . TRP A 1 35 ? -75.802 -36.617 9.020 1.00 26.88 ? 353 TRP A CZ2 1 +ATOM 161 C CZ3 . TRP A 1 35 ? -77.293 -35.376 10.474 1.00 29.62 ? 353 TRP A CZ3 1 +ATOM 162 C CH2 . TRP A 1 35 ? -77.063 -36.202 9.358 1.00 28.80 ? 353 TRP A CH2 1 +ATOM 163 N N . ASN A 1 36 ? -75.235 -34.434 15.408 1.00 30.20 ? 354 ASN A N 1 +ATOM 164 C CA . ASN A 1 36 ? -76.531 -34.654 16.031 1.00 33.18 ? 354 ASN A CA 1 +ATOM 165 C C . ASN A 1 36 ? -77.646 -34.152 15.120 1.00 33.96 ? 354 ASN A C 1 +ATOM 166 O O . ASN A 1 36 ? -77.483 -33.153 14.421 1.00 32.95 ? 354 ASN A O 1 +ATOM 167 C CB . ASN A 1 36 ? -76.579 -33.940 17.381 1.00 36.70 ? 354 ASN A CB 1 +ATOM 168 C CG . ASN A 1 36 ? -77.679 -34.453 18.263 1.00 56.87 ? 354 ASN A CG 1 +ATOM 169 O OD1 . ASN A 1 36 ? -77.554 -35.513 18.880 1.00 75.99 ? 354 ASN A OD1 1 +ATOM 170 N ND2 . ASN A 1 36 ? -78.777 -33.713 18.321 1.00 52.10 ? 354 ASN A ND2 1 +ATOM 171 N N . ARG A 1 37 ? -78.777 -34.853 15.121 1.00 31.57 ? 355 ARG A N 1 +ATOM 172 C CA . ARG A 1 37 ? -79.962 -34.419 14.385 1.00 29.23 ? 355 ARG A CA 1 +ATOM 173 C C . ARG A 1 37 ? -81.152 -34.362 15.323 1.00 31.72 ? 355 ARG A C 1 +ATOM 174 O O . ARG A 1 37 ? -81.482 -35.358 15.975 1.00 33.88 ? 355 ARG A O 1 +ATOM 175 C CB . ARG A 1 37 ? -80.296 -35.348 13.214 1.00 30.63 ? 355 ARG A CB 1 +ATOM 176 C CG . ARG A 1 37 ? -81.694 -35.078 12.615 1.00 31.42 ? 355 ARG A CG 1 +ATOM 177 C CD . ARG A 1 37 ? -81.799 -35.614 11.188 1.00 34.94 ? 355 ARG A CD 1 +ATOM 178 N NE . ARG A 1 37 ? -81.014 -34.811 10.246 1.00 32.85 ? 355 ARG A NE 1 +ATOM 179 C CZ . ARG A 1 37 ? -81.164 -34.856 8.925 1.00 33.33 ? 355 ARG A CZ 1 +ATOM 180 N NH1 . ARG A 1 37 ? -82.058 -35.677 8.388 1.00 34.30 ? 355 ARG A NH1 1 +ATOM 181 N NH2 . ARG A 1 37 ? -80.420 -34.083 8.144 1.00 36.06 ? 355 ARG A NH2 1 +ATOM 182 N N . LYS A 1 38 ? -81.816 -33.214 15.350 1.00 31.33 ? 356 LYS A N 1 +ATOM 183 C CA . LYS A 1 38 ? -83.034 -33.019 16.118 1.00 35.59 ? 356 LYS A CA 1 +ATOM 184 C C . LYS A 1 38 ? -84.187 -32.817 15.144 1.00 41.97 ? 356 LYS A C 1 +ATOM 185 O O . LYS A 1 38 ? -84.090 -31.995 14.227 1.00 44.12 ? 356 LYS A O 1 +ATOM 186 C CB . LYS A 1 38 ? -82.892 -31.815 17.056 1.00 38.37 ? 356 LYS A CB 1 +ATOM 187 C CG . LYS A 1 38 ? -84.178 -31.429 17.793 1.00 46.86 ? 356 LYS A CG 1 +ATOM 188 C CD . LYS A 1 38 ? -84.342 -32.223 19.069 1.00 48.47 ? 356 LYS A CD 1 +ATOM 189 C CE . LYS A 1 38 ? -85.446 -31.641 19.941 1.00 59.93 ? 356 LYS A CE 1 +ATOM 190 N NZ . LYS A 1 38 ? -85.830 -32.576 21.030 1.00 62.85 ? 356 LYS A NZ 1 +ATOM 191 N N . ARG A 1 39 ? -85.255 -33.584 15.317 1.00 42.55 ? 357 ARG A N 1 +ATOM 192 C CA . ARG A 1 39 ? -86.444 -33.425 14.494 1.00 52.18 ? 357 ARG A CA 1 +ATOM 193 C C . ARG A 1 39 ? -87.369 -32.414 15.156 1.00 58.90 ? 357 ARG A C 1 +ATOM 194 O O . ARG A 1 39 ? -87.646 -32.510 16.356 1.00 65.40 ? 357 ARG A O 1 +ATOM 195 C CB . ARG A 1 39 ? -87.161 -34.762 14.300 1.00 62.00 ? 357 ARG A CB 1 +ATOM 196 C CG . ARG A 1 39 ? -88.603 -34.627 13.824 1.00 80.41 ? 357 ARG A CG 1 +ATOM 197 C CD . ARG A 1 39 ? -89.225 -35.989 13.550 1.00 92.56 ? 357 ARG A CD 1 +ATOM 198 N NE . ARG A 1 39 ? -88.546 -36.676 12.453 1.00 97.20 ? 357 ARG A NE 1 +ATOM 199 C CZ . ARG A 1 39 ? -89.149 -37.124 11.354 1.00 97.44 ? 357 ARG A CZ 1 +ATOM 200 N NH1 . ARG A 1 39 ? -90.461 -36.970 11.197 1.00 89.94 ? 357 ARG A NH1 1 +ATOM 201 N NH2 . ARG A 1 39 ? -88.437 -37.734 10.414 1.00 95.09 ? 357 ARG A NH2 1 +ATOM 202 N N . ILE A 1 40 ? -87.831 -31.438 14.381 1.00 55.82 ? 358 ILE A N 1 +ATOM 203 C CA . ILE A 1 40 ? -88.696 -30.380 14.888 1.00 56.77 ? 358 ILE A CA 1 +ATOM 204 C C . ILE A 1 40 ? -90.023 -30.453 14.142 1.00 55.50 ? 358 ILE A C 1 +ATOM 205 O O . ILE A 1 40 ? -90.051 -30.423 12.905 1.00 57.13 ? 358 ILE A O 1 +ATOM 206 C CB . ILE A 1 40 ? -88.037 -29.001 14.750 1.00 55.24 ? 358 ILE A CB 1 +ATOM 207 C CG1 . ILE A 1 40 ? -86.781 -28.958 15.618 1.00 57.25 ? 358 ILE A CG1 1 +ATOM 208 C CG2 . ILE A 1 40 ? -88.996 -27.907 15.162 1.00 62.54 ? 358 ILE A CG2 1 +ATOM 209 C CD1 . ILE A 1 40 ? -85.853 -27.832 15.296 1.00 58.28 ? 358 ILE A CD1 1 +ATOM 210 N N . SER A 1 41 ? -91.116 -30.578 14.890 1.00 58.14 ? 359 SER A N 1 +ATOM 211 C CA . SER A 1 41 ? -92.413 -30.786 14.267 1.00 66.23 ? 359 SER A CA 1 +ATOM 212 C C . SER A 1 41 ? -93.504 -30.316 15.218 1.00 68.08 ? 359 SER A C 1 +ATOM 213 O O . SER A 1 41 ? -93.281 -30.159 16.422 1.00 67.46 ? 359 SER A O 1 +ATOM 214 C CB . SER A 1 41 ? -92.622 -32.259 13.889 1.00 74.10 ? 359 SER A CB 1 +ATOM 215 O OG . SER A 1 41 ? -93.298 -32.965 14.920 1.00 83.70 ? 359 SER A OG 1 +ATOM 216 N N . ASN A 1 42 ? -94.686 -30.084 14.649 1.00 68.12 ? 360 ASN A N 1 +ATOM 217 C CA . ASN A 1 42 ? -95.894 -29.743 15.403 1.00 66.58 ? 360 ASN A CA 1 +ATOM 218 C C . ASN A 1 42 ? -95.634 -28.593 16.371 1.00 70.82 ? 360 ASN A C 1 +ATOM 219 O O . ASN A 1 42 ? -95.864 -28.689 17.578 1.00 69.66 ? 360 ASN A O 1 +ATOM 220 C CB . ASN A 1 42 ? -96.433 -30.970 16.134 1.00 71.75 ? 360 ASN A CB 1 +ATOM 221 C CG . ASN A 1 42 ? -96.712 -32.116 15.198 1.00 84.08 ? 360 ASN A CG 1 +ATOM 222 O OD1 . ASN A 1 42 ? -97.294 -31.928 14.128 1.00 92.12 ? 360 ASN A OD1 1 +ATOM 223 N ND2 . ASN A 1 42 ? -96.270 -33.311 15.575 1.00 83.46 ? 360 ASN A ND2 1 +ATOM 224 N N . CYS A 1 43 ? -95.134 -27.494 15.814 1.00 72.10 ? 361 CYS A N 1 +ATOM 225 C CA . CYS A 1 43 ? -94.812 -26.318 16.609 1.00 74.49 ? 361 CYS A CA 1 +ATOM 226 C C . CYS A 1 43 ? -94.770 -25.097 15.705 1.00 77.17 ? 361 CYS A C 1 +ATOM 227 O O . CYS A 1 43 ? -94.733 -25.205 14.476 1.00 71.41 ? 361 CYS A O 1 +ATOM 228 C CB . CYS A 1 43 ? -93.479 -26.481 17.337 1.00 66.06 ? 361 CYS A CB 1 +ATOM 229 S SG . CYS A 1 43 ? -92.107 -26.841 16.222 1.00 67.06 ? 361 CYS A SG 1 +ATOM 230 N N . VAL A 1 44 ? -94.770 -23.927 16.339 1.00 76.55 ? 362 VAL A N 1 +ATOM 231 C CA . VAL A 1 44 ? -94.645 -22.655 15.643 1.00 77.25 ? 362 VAL A CA 1 +ATOM 232 C C . VAL A 1 44 ? -93.222 -22.140 15.821 1.00 81.90 ? 362 VAL A C 1 +ATOM 233 O O . VAL A 1 44 ? -92.700 -22.091 16.943 1.00 77.33 ? 362 VAL A O 1 +ATOM 234 C CB . VAL A 1 44 ? -95.682 -21.633 16.145 1.00 80.93 ? 362 VAL A CB 1 +ATOM 235 C CG1 . VAL A 1 44 ? -95.667 -21.543 17.662 1.00 78.69 ? 362 VAL A CG1 1 +ATOM 236 C CG2 . VAL A 1 44 ? -95.426 -20.277 15.516 1.00 80.51 ? 362 VAL A CG2 1 +ATOM 237 N N . ALA A 1 45 ? -92.586 -21.775 14.714 1.00 83.73 ? 363 ALA A N 1 +ATOM 238 C CA . ALA A 1 45 ? -91.214 -21.291 14.713 1.00 83.54 ? 363 ALA A CA 1 +ATOM 239 C C . ALA A 1 45 ? -91.198 -19.828 14.300 1.00 87.05 ? 363 ALA A C 1 +ATOM 240 O O . ALA A 1 45 ? -91.804 -19.456 13.292 1.00 91.37 ? 363 ALA A O 1 +ATOM 241 C CB . ALA A 1 45 ? -90.351 -22.118 13.760 1.00 77.10 ? 363 ALA A CB 1 +ATOM 242 N N . ASP A 1 46 ? -90.513 -19.003 15.074 1.00 83.59 ? 364 ASP A N 1 +ATOM 243 C CA . ASP A 1 46 ? -90.270 -17.618 14.690 1.00 84.65 ? 364 ASP A CA 1 +ATOM 244 C C . ASP A 1 46 ? -88.782 -17.530 14.372 1.00 78.86 ? 364 ASP A C 1 +ATOM 245 O O . ASP A 1 46 ? -87.944 -17.457 15.271 1.00 77.73 ? 364 ASP A O 1 +ATOM 246 C CB . ASP A 1 46 ? -90.701 -16.616 15.760 1.00 89.57 ? 364 ASP A CB 1 +ATOM 247 C CG . ASP A 1 46 ? -90.589 -15.184 15.271 1.00 98.27 ? 364 ASP A CG 1 +ATOM 248 O OD1 . ASP A 1 46 ? -90.300 -14.290 16.078 1.00 101.71 ? 364 ASP A OD1 1 +ATOM 249 O OD2 . ASP A 1 46 ? -90.775 -14.955 14.056 1.00 101.66 ? 364 ASP A OD2 1 +ATOM 250 N N . TYR A 1 47 ? -88.462 -17.552 13.083 1.00 76.74 ? 365 TYR A N 1 +ATOM 251 C CA . TYR A 1 47 ? -87.085 -17.553 12.624 1.00 70.70 ? 365 TYR A CA 1 +ATOM 252 C C . TYR A 1 47 ? -86.466 -16.169 12.666 1.00 70.30 ? 365 TYR A C 1 +ATOM 253 O O . TYR A 1 47 ? -85.241 -16.064 12.713 1.00 62.92 ? 365 TYR A O 1 +ATOM 254 C CB . TYR A 1 47 ? -87.018 -18.116 11.202 1.00 69.94 ? 365 TYR A CB 1 +ATOM 255 C CG . TYR A 1 47 ? -87.506 -19.541 11.080 1.00 70.92 ? 365 TYR A CG 1 +ATOM 256 C CD1 . TYR A 1 47 ? -86.668 -20.616 11.370 1.00 70.22 ? 365 TYR A CD1 1 +ATOM 257 C CD2 . TYR A 1 47 ? -88.812 -19.809 10.705 1.00 71.22 ? 365 TYR A CD2 1 +ATOM 258 C CE1 . TYR A 1 47 ? -87.116 -21.916 11.265 1.00 70.98 ? 365 TYR A CE1 1 +ATOM 259 C CE2 . TYR A 1 47 ? -89.273 -21.105 10.599 1.00 72.58 ? 365 TYR A CE2 1 +ATOM 260 C CZ . TYR A 1 47 ? -88.422 -22.155 10.880 1.00 74.84 ? 365 TYR A CZ 1 +ATOM 261 O OH . TYR A 1 47 ? -88.877 -23.449 10.777 1.00 77.27 ? 365 TYR A OH 1 +ATOM 262 N N . SER A 1 48 ? -87.279 -15.109 12.665 1.00 76.85 ? 366 SER A N 1 +ATOM 263 C CA . SER A 1 48 ? -86.714 -13.766 12.699 1.00 81.98 ? 366 SER A CA 1 +ATOM 264 C C . SER A 1 48 ? -85.980 -13.490 14.005 1.00 83.97 ? 366 SER A C 1 +ATOM 265 O O . SER A 1 48 ? -85.029 -12.701 14.012 1.00 90.78 ? 366 SER A O 1 +ATOM 266 C CB . SER A 1 48 ? -87.807 -12.727 12.462 1.00 86.82 ? 366 SER A CB 1 +ATOM 267 O OG . SER A 1 48 ? -88.334 -12.839 11.150 1.00 89.83 ? 366 SER A OG 1 +ATOM 268 N N . VAL A 1 49 ? -86.377 -14.130 15.111 1.00 78.92 ? 367 VAL A N 1 +ATOM 269 C CA . VAL A 1 49 ? -85.623 -13.948 16.351 1.00 80.37 ? 367 VAL A CA 1 +ATOM 270 C C . VAL A 1 49 ? -84.202 -14.478 16.204 1.00 82.34 ? 367 VAL A C 1 +ATOM 271 O O . VAL A 1 49 ? -83.267 -13.943 16.813 1.00 85.09 ? 367 VAL A O 1 +ATOM 272 C CB . VAL A 1 49 ? -86.340 -14.599 17.552 1.00 82.80 ? 367 VAL A CB 1 +ATOM 273 C CG1 . VAL A 1 49 ? -87.783 -14.164 17.610 1.00 85.67 ? 367 VAL A CG1 1 +ATOM 274 C CG2 . VAL A 1 49 ? -86.225 -16.118 17.502 1.00 83.43 ? 367 VAL A CG2 1 +ATOM 275 N N . LEU A 1 50 ? -84.004 -15.527 15.403 1.00 75.45 ? 368 LEU A N 1 +ATOM 276 C CA . LEU A 1 50 ? -82.646 -16.004 15.182 1.00 72.22 ? 368 LEU A CA 1 +ATOM 277 C C . LEU A 1 50 ? -81.888 -15.084 14.234 1.00 73.80 ? 368 LEU A C 1 +ATOM 278 O O . LEU A 1 50 ? -80.769 -14.658 14.538 1.00 71.32 ? 368 LEU A O 1 +ATOM 279 C CB . LEU A 1 50 ? -82.660 -17.437 14.644 1.00 74.04 ? 368 LEU A CB 1 +ATOM 280 C CG . LEU A 1 50 ? -83.244 -18.543 15.524 1.00 71.03 ? 368 LEU A CG 1 +ATOM 281 C CD1 . LEU A 1 50 ? -83.478 -19.792 14.695 1.00 67.53 ? 368 LEU A CD1 1 +ATOM 282 C CD2 . LEU A 1 50 ? -82.317 -18.845 16.686 1.00 65.06 ? 368 LEU A CD2 1 +ATOM 283 N N . TYR A 1 51 ? -82.487 -14.758 13.084 1.00 76.80 ? 369 TYR A N 1 +ATOM 284 C CA . TYR A 1 51 ? -81.788 -13.947 12.090 1.00 84.43 ? 369 TYR A CA 1 +ATOM 285 C C . TYR A 1 51 ? -81.384 -12.595 12.665 1.00 86.13 ? 369 TYR A C 1 +ATOM 286 O O . TYR A 1 51 ? -80.301 -12.081 12.358 1.00 88.67 ? 369 TYR A O 1 +ATOM 287 C CB . TYR A 1 51 ? -82.659 -13.763 10.850 1.00 92.16 ? 369 TYR A CB 1 +ATOM 288 C CG . TYR A 1 51 ? -81.944 -13.099 9.693 1.00 99.01 ? 369 TYR A CG 1 +ATOM 289 C CD1 . TYR A 1 51 ? -80.673 -13.510 9.305 1.00 97.62 ? 369 TYR A CD1 1 +ATOM 290 C CD2 . TYR A 1 51 ? -82.545 -12.063 8.983 1.00 103.31 ? 369 TYR A CD2 1 +ATOM 291 C CE1 . TYR A 1 51 ? -80.017 -12.904 8.244 1.00 102.26 ? 369 TYR A CE1 1 +ATOM 292 C CE2 . TYR A 1 51 ? -81.899 -11.452 7.922 1.00 105.16 ? 369 TYR A CE2 1 +ATOM 293 C CZ . TYR A 1 51 ? -80.636 -11.876 7.556 1.00 106.59 ? 369 TYR A CZ 1 +ATOM 294 O OH . TYR A 1 51 ? -79.992 -11.270 6.500 1.00 108.07 ? 369 TYR A OH 1 +ATOM 295 N N . ASN A 1 52 ? -82.237 -12.008 13.505 1.00 79.90 ? 370 ASN A N 1 +ATOM 296 C CA . ASN A 1 52 ? -81.894 -10.789 14.237 1.00 84.52 ? 370 ASN A CA 1 +ATOM 297 C C . ASN A 1 52 ? -81.321 -11.203 15.586 1.00 91.96 ? 370 ASN A C 1 +ATOM 298 O O . ASN A 1 52 ? -82.028 -11.267 16.593 1.00 97.88 ? 370 ASN A O 1 +ATOM 299 C CB . ASN A 1 52 ? -83.109 -9.884 14.402 1.00 81.92 ? 370 ASN A CB 1 +ATOM 300 C CG . ASN A 1 52 ? -84.017 -9.892 13.187 1.00 88.14 ? 370 ASN A CG 1 +ATOM 301 O OD1 . ASN A 1 52 ? -85.235 -10.022 13.310 1.00 95.26 ? 370 ASN A OD1 1 +ATOM 302 N ND2 . ASN A 1 52 ? -83.429 -9.746 12.004 1.00 89.70 ? 370 ASN A ND2 1 +ATOM 303 N N . SER A 1 53 ? -80.021 -11.501 15.608 1.00 91.33 ? 371 SER A N 1 +ATOM 304 C CA . SER A 1 53 ? -79.357 -11.852 16.859 1.00 86.88 ? 371 SER A CA 1 +ATOM 305 C C . SER A 1 53 ? -77.991 -11.208 17.052 1.00 86.75 ? 371 SER A C 1 +ATOM 306 O O . SER A 1 53 ? -77.602 -10.993 18.205 1.00 91.25 ? 371 SER A O 1 +ATOM 307 C CB . SER A 1 53 ? -79.204 -13.373 16.977 1.00 82.31 ? 371 SER A CB 1 +ATOM 308 O OG . SER A 1 53 ? -78.601 -13.727 18.210 1.00 75.84 ? 371 SER A OG 1 +ATOM 309 N N . ALA A 1 54 ? -77.244 -10.912 15.985 1.00 82.27 ? 372 ALA A N 1 +ATOM 310 C CA . ALA A 1 54 ? -75.894 -10.349 16.053 1.00 78.36 ? 372 ALA A CA 1 +ATOM 311 C C . ALA A 1 54 ? -74.890 -11.303 16.699 1.00 71.20 ? 372 ALA A C 1 +ATOM 312 O O . ALA A 1 54 ? -73.683 -11.042 16.684 1.00 75.17 ? 372 ALA A O 1 +ATOM 313 C CB . ALA A 1 54 ? -75.898 -9.005 16.792 1.00 78.43 ? 372 ALA A CB 1 +ATOM 314 N N . SER A 1 55 ? -75.364 -12.413 17.256 1.00 59.82 ? 373 SER A N 1 +ATOM 315 C CA . SER A 1 55 ? -74.475 -13.404 17.842 1.00 60.08 ? 373 SER A CA 1 +ATOM 316 C C . SER A 1 55 ? -73.928 -14.395 16.822 1.00 55.27 ? 373 SER A C 1 +ATOM 317 O O . SER A 1 55 ? -73.014 -15.157 17.153 1.00 50.69 ? 373 SER A O 1 +ATOM 318 C CB . SER A 1 55 ? -75.199 -14.171 18.954 1.00 66.55 ? 373 SER A CB 1 +ATOM 319 O OG . SER A 1 55 ? -76.559 -14.380 18.623 1.00 71.20 ? 373 SER A OG 1 +ATOM 320 N N . PHE A 1 56 ? -74.451 -14.406 15.600 1.00 48.06 ? 374 PHE A N 1 +ATOM 321 C CA . PHE A 1 56 ? -74.066 -15.389 14.596 1.00 41.28 ? 374 PHE A CA 1 +ATOM 322 C C . PHE A 1 56 ? -73.138 -14.754 13.571 1.00 45.65 ? 374 PHE A C 1 +ATOM 323 O O . PHE A 1 56 ? -73.480 -13.732 12.967 1.00 53.08 ? 374 PHE A O 1 +ATOM 324 C CB . PHE A 1 56 ? -75.300 -15.964 13.902 1.00 41.21 ? 374 PHE A CB 1 +ATOM 325 C CG . PHE A 1 56 ? -76.261 -16.618 14.840 1.00 39.16 ? 374 PHE A CG 1 +ATOM 326 C CD1 . PHE A 1 56 ? -75.839 -17.646 15.673 1.00 39.87 ? 374 PHE A CD1 1 +ATOM 327 C CD2 . PHE A 1 56 ? -77.575 -16.202 14.905 1.00 44.40 ? 374 PHE A CD2 1 +ATOM 328 C CE1 . PHE A 1 56 ? -76.720 -18.259 16.545 1.00 39.08 ? 374 PHE A CE1 1 +ATOM 329 C CE2 . PHE A 1 56 ? -78.464 -16.805 15.782 1.00 46.91 ? 374 PHE A CE2 1 +ATOM 330 C CZ . PHE A 1 56 ? -78.036 -17.835 16.602 1.00 43.08 ? 374 PHE A CZ 1 +ATOM 331 N N . SER A 1 57 ? -71.971 -15.365 13.373 1.00 43.12 ? 375 SER A N 1 +ATOM 332 C CA . SER A 1 57 ? -71.066 -14.911 12.327 1.00 45.12 ? 375 SER A CA 1 +ATOM 333 C C . SER A 1 57 ? -71.416 -15.487 10.958 1.00 43.99 ? 375 SER A C 1 +ATOM 334 O O . SER A 1 57 ? -71.045 -14.899 9.939 1.00 46.17 ? 375 SER A O 1 +ATOM 335 C CB . SER A 1 57 ? -69.628 -15.271 12.691 1.00 37.42 ? 375 SER A CB 1 +ATOM 336 O OG . SER A 1 57 ? -69.519 -16.650 12.955 1.00 42.29 ? 375 SER A OG 1 +ATOM 337 N N . THR A 1 58 ? -72.107 -16.620 10.907 1.00 35.44 ? 376 THR A N 1 +ATOM 338 C CA . THR A 1 58 ? -72.647 -17.157 9.663 1.00 38.20 ? 376 THR A CA 1 +ATOM 339 C C . THR A 1 58 ? -74.149 -17.344 9.816 1.00 37.34 ? 376 THR A C 1 +ATOM 340 O O . THR A 1 58 ? -74.604 -17.940 10.794 1.00 38.80 ? 376 THR A O 1 +ATOM 341 C CB . THR A 1 58 ? -71.989 -18.494 9.303 1.00 39.37 ? 376 THR A CB 1 +ATOM 342 O OG1 . THR A 1 58 ? -70.624 -18.273 8.935 1.00 41.66 ? 376 THR A OG1 1 +ATOM 343 C CG2 . THR A 1 58 ? -72.726 -19.172 8.140 1.00 37.95 ? 376 THR A CG2 1 +ATOM 344 N N . PHE A 1 59 ? -74.917 -16.823 8.859 1.00 36.27 ? 377 PHE A N 1 +ATOM 345 C CA . PHE A 1 59 ? -76.349 -17.109 8.789 1.00 38.80 ? 377 PHE A CA 1 +ATOM 346 C C . PHE A 1 59 ? -76.731 -17.041 7.310 1.00 43.64 ? 377 PHE A C 1 +ATOM 347 O O . PHE A 1 59 ? -77.136 -15.990 6.812 1.00 44.13 ? 377 PHE A O 1 +ATOM 348 C CB . PHE A 1 59 ? -77.166 -16.142 9.633 1.00 41.78 ? 377 PHE A CB 1 +ATOM 349 C CG . PHE A 1 59 ? -78.523 -16.669 10.014 1.00 49.00 ? 377 PHE A CG 1 +ATOM 350 C CD1 . PHE A 1 59 ? -79.446 -17.019 9.039 1.00 52.32 ? 377 PHE A CD1 1 +ATOM 351 C CD2 . PHE A 1 59 ? -78.871 -16.823 11.346 1.00 50.52 ? 377 PHE A CD2 1 +ATOM 352 C CE1 . PHE A 1 59 ? -80.691 -17.507 9.383 1.00 54.45 ? 377 PHE A CE1 1 +ATOM 353 C CE2 . PHE A 1 59 ? -80.119 -17.306 11.696 1.00 53.49 ? 377 PHE A CE2 1 +ATOM 354 C CZ . PHE A 1 59 ? -81.027 -17.650 10.713 1.00 57.93 ? 377 PHE A CZ 1 +ATOM 355 N N . LYS A 1 60 ? -76.589 -18.169 6.621 1.00 43.27 ? 378 LYS A N 1 +ATOM 356 C CA . LYS A 1 60 ? -76.769 -18.237 5.177 1.00 45.98 ? 378 LYS A CA 1 +ATOM 357 C C . LYS A 1 60 ? -77.896 -19.201 4.848 1.00 44.05 ? 378 LYS A C 1 +ATOM 358 O O . LYS A 1 60 ? -77.898 -20.344 5.316 1.00 42.31 ? 378 LYS A O 1 +ATOM 359 C CB . LYS A 1 60 ? -75.478 -18.681 4.485 1.00 41.45 ? 378 LYS A CB 1 +ATOM 360 C CG . LYS A 1 60 ? -74.290 -17.780 4.785 1.00 55.02 ? 378 LYS A CG 1 +ATOM 361 C CD . LYS A 1 60 ? -73.082 -18.138 3.928 1.00 64.32 ? 378 LYS A CD 1 +ATOM 362 C CE . LYS A 1 60 ? -71.956 -17.126 4.109 1.00 74.13 ? 378 LYS A CE 1 +ATOM 363 N NZ . LYS A 1 60 ? -71.068 -17.059 2.913 1.00 79.62 ? 378 LYS A NZ 1 +ATOM 364 N N . CYS A 1 61 ? -78.837 -18.751 4.030 1.00 40.61 ? 379 CYS A N 1 +ATOM 365 C CA . CYS A 1 61 ? -79.974 -19.578 3.666 1.00 46.36 ? 379 CYS A CA 1 +ATOM 366 C C . CYS A 1 61 ? -79.928 -19.911 2.182 1.00 49.37 ? 379 CYS A C 1 +ATOM 367 O O . CYS A 1 61 ? -79.448 -19.126 1.361 1.00 46.10 ? 379 CYS A O 1 +ATOM 368 C CB . CYS A 1 61 ? -81.297 -18.891 4.020 1.00 51.28 ? 379 CYS A CB 1 +ATOM 369 S SG . CYS A 1 61 ? -81.561 -18.710 5.810 1.00 62.01 ? 379 CYS A SG 1 +ATOM 370 N N . TYR A 1 62 ? -80.434 -21.094 1.853 1.00 46.36 ? 380 TYR A N 1 +ATOM 371 C CA . TYR A 1 62 ? -80.402 -21.629 0.503 1.00 44.03 ? 380 TYR A CA 1 +ATOM 372 C C . TYR A 1 62 ? -81.810 -22.058 0.131 1.00 52.21 ? 380 TYR A C 1 +ATOM 373 O O . TYR A 1 62 ? -82.479 -22.743 0.912 1.00 51.79 ? 380 TYR A O 1 +ATOM 374 C CB . TYR A 1 62 ? -79.413 -22.800 0.410 1.00 38.14 ? 380 TYR A CB 1 +ATOM 375 C CG . TYR A 1 62 ? -78.006 -22.414 0.817 1.00 41.90 ? 380 TYR A CG 1 +ATOM 376 C CD1 . TYR A 1 62 ? -77.602 -22.465 2.150 1.00 36.44 ? 380 TYR A CD1 1 +ATOM 377 C CD2 . TYR A 1 62 ? -77.089 -21.972 -0.129 1.00 44.45 ? 380 TYR A CD2 1 +ATOM 378 C CE1 . TYR A 1 62 ? -76.319 -22.091 2.524 1.00 35.51 ? 380 TYR A CE1 1 +ATOM 379 C CE2 . TYR A 1 62 ? -75.812 -21.602 0.230 1.00 42.25 ? 380 TYR A CE2 1 +ATOM 380 C CZ . TYR A 1 62 ? -75.428 -21.662 1.556 1.00 39.99 ? 380 TYR A CZ 1 +ATOM 381 O OH . TYR A 1 62 ? -74.150 -21.295 1.907 1.00 41.46 ? 380 TYR A OH 1 +ATOM 382 N N . GLY A 1 63 ? -82.270 -21.627 -1.041 1.00 60.01 ? 381 GLY A N 1 +ATOM 383 C CA . GLY A 1 63 ? -83.615 -21.936 -1.488 1.00 61.21 ? 381 GLY A CA 1 +ATOM 384 C C . GLY A 1 63 ? -84.662 -20.971 -0.967 1.00 62.15 ? 381 GLY A C 1 +ATOM 385 O O . GLY A 1 63 ? -85.574 -20.572 -1.698 1.00 75.17 ? 381 GLY A O 1 +ATOM 386 N N . VAL A 1 64 ? -84.539 -20.594 0.300 1.00 61.73 ? 382 VAL A N 1 +ATOM 387 C CA . VAL A 1 64 ? -85.440 -19.649 0.942 1.00 62.18 ? 382 VAL A CA 1 +ATOM 388 C C . VAL A 1 64 ? -84.649 -18.396 1.290 1.00 66.33 ? 382 VAL A C 1 +ATOM 389 O O . VAL A 1 64 ? -83.414 -18.396 1.321 1.00 66.31 ? 382 VAL A O 1 +ATOM 390 C CB . VAL A 1 64 ? -86.091 -20.254 2.200 1.00 66.47 ? 382 VAL A CB 1 +ATOM 391 C CG1 . VAL A 1 64 ? -86.680 -21.612 1.881 1.00 69.24 ? 382 VAL A CG1 1 +ATOM 392 C CG2 . VAL A 1 64 ? -85.054 -20.388 3.306 1.00 69.63 ? 382 VAL A CG2 1 +ATOM 393 N N . SER A 1 65 ? -85.376 -17.314 1.565 1.00 68.74 ? 383 SER A N 1 +ATOM 394 C CA . SER A 1 65 ? -84.636 -16.104 1.891 1.00 71.77 ? 383 SER A CA 1 +ATOM 395 C C . SER A 1 65 ? -84.554 -15.922 3.405 1.00 78.23 ? 383 SER A C 1 +ATOM 396 O O . SER A 1 65 ? -85.461 -16.346 4.128 1.00 79.20 ? 383 SER A O 1 +ATOM 397 C CB . SER A 1 65 ? -85.307 -14.885 1.247 1.00 75.20 ? 383 SER A CB 1 +ATOM 398 O OG . SER A 1 65 ? -85.148 -13.723 2.041 1.00 80.77 ? 383 SER A OG 1 +ATOM 399 N N . PRO A 1 66 ? -83.454 -15.313 3.927 1.00 85.54 ? 384 PRO A N 1 +ATOM 400 C CA . PRO A 1 66 ? -83.302 -15.159 5.387 1.00 89.19 ? 384 PRO A CA 1 +ATOM 401 C C . PRO A 1 66 ? -84.486 -14.468 6.049 1.00 96.14 ? 384 PRO A C 1 +ATOM 402 O O . PRO A 1 66 ? -85.165 -15.066 6.888 1.00 92.49 ? 384 PRO A O 1 +ATOM 403 C CB . PRO A 1 66 ? -82.015 -14.329 5.530 1.00 88.68 ? 384 PRO A CB 1 +ATOM 404 C CG . PRO A 1 66 ? -81.654 -13.875 4.141 1.00 90.42 ? 384 PRO A CG 1 +ATOM 405 C CD . PRO A 1 66 ? -82.253 -14.869 3.202 1.00 88.23 ? 384 PRO A CD 1 +ATOM 406 N N . THR A 1 67 ? -84.745 -13.212 5.700 1.00 101.90 ? 385 THR A N 1 +ATOM 407 C CA . THR A 1 67 ? -86.052 -12.658 6.010 1.00 102.96 ? 385 THR A CA 1 +ATOM 408 C C . THR A 1 67 ? -87.101 -13.352 5.141 1.00 105.34 ? 385 THR A C 1 +ATOM 409 O O . THR A 1 67 ? -86.775 -14.129 4.243 1.00 110.52 ? 385 THR A O 1 +ATOM 410 C CB . THR A 1 67 ? -86.065 -11.145 5.794 1.00 101.56 ? 385 THR A CB 1 +ATOM 411 O OG1 . THR A 1 67 ? -87.418 -10.673 5.789 1.00 106.23 ? 385 THR A OG1 1 +ATOM 412 C CG2 . THR A 1 67 ? -85.394 -10.788 4.477 1.00 98.54 ? 385 THR A CG2 1 +ATOM 413 N N . LYS A 1 68 ? -88.376 -13.074 5.416 1.00 98.87 ? 386 LYS A N 1 +ATOM 414 C CA . LYS A 1 68 ? -89.496 -13.767 4.774 1.00 95.20 ? 386 LYS A CA 1 +ATOM 415 C C . LYS A 1 68 ? -89.579 -15.232 5.197 1.00 87.81 ? 386 LYS A C 1 +ATOM 416 O O . LYS A 1 68 ? -90.240 -16.037 4.532 1.00 81.58 ? 386 LYS A O 1 +ATOM 417 C CB . LYS A 1 68 ? -89.424 -13.688 3.237 1.00 91.77 ? 386 LYS A CB 1 +ATOM 418 C CG . LYS A 1 68 ? -89.318 -12.295 2.630 1.00 90.58 ? 386 LYS A CG 1 +ATOM 419 C CD . LYS A 1 68 ? -90.161 -12.187 1.363 1.00 91.18 ? 386 LYS A CD 1 +ATOM 420 C CE . LYS A 1 68 ? -90.418 -10.741 0.970 1.00 95.03 ? 386 LYS A CE 1 +ATOM 421 N NZ . LYS A 1 68 ? -89.724 -10.386 -0.301 1.00 96.01 ? 386 LYS A NZ 1 +ATOM 422 N N . LEU A 1 69 ? -88.908 -15.607 6.287 1.00 90.24 ? 387 LEU A N 1 +ATOM 423 C CA . LEU A 1 69 ? -88.874 -17.004 6.708 1.00 87.22 ? 387 LEU A CA 1 +ATOM 424 C C . LEU A 1 69 ? -90.090 -17.416 7.527 1.00 88.53 ? 387 LEU A C 1 +ATOM 425 O O . LEU A 1 69 ? -90.459 -18.598 7.522 1.00 81.42 ? 387 LEU A O 1 +ATOM 426 C CB . LEU A 1 69 ? -87.607 -17.288 7.520 1.00 83.12 ? 387 LEU A CB 1 +ATOM 427 C CG . LEU A 1 69 ? -86.449 -17.966 6.779 1.00 82.43 ? 387 LEU A CG 1 +ATOM 428 C CD1 . LEU A 1 69 ? -85.216 -18.070 7.661 1.00 75.50 ? 387 LEU A CD1 1 +ATOM 429 C CD2 . LEU A 1 69 ? -86.864 -19.337 6.270 1.00 85.38 ? 387 LEU A CD2 1 +ATOM 430 N N . ASN A 1 70 ? -90.725 -16.479 8.225 1.00 92.11 ? 388 ASN A N 1 +ATOM 431 C CA . ASN A 1 70 ? -91.833 -16.821 9.107 1.00 93.97 ? 388 ASN A CA 1 +ATOM 432 C C . ASN A 1 70 ? -93.151 -17.015 8.374 1.00 88.30 ? 388 ASN A C 1 +ATOM 433 O O . ASN A 1 70 ? -94.163 -17.298 9.022 1.00 89.85 ? 388 ASN A O 1 +ATOM 434 C CB . ASN A 1 70 ? -91.998 -15.749 10.180 1.00 100.06 ? 388 ASN A CB 1 +ATOM 435 C CG . ASN A 1 70 ? -90.774 -15.614 11.039 1.00 104.44 ? 388 ASN A CG 1 +ATOM 436 O OD1 . ASN A 1 70 ? -90.482 -16.485 11.850 1.00 105.28 ? 388 ASN A OD1 1 +ATOM 437 N ND2 . ASN A 1 70 ? -90.046 -14.521 10.868 1.00 107.70 ? 388 ASN A ND2 1 +ATOM 438 N N . ASP A 1 71 ? -93.172 -16.876 7.053 1.00 86.78 ? 389 ASP A N 1 +ATOM 439 C CA . ASP A 1 71 ? -94.387 -17.061 6.274 1.00 94.54 ? 389 ASP A CA 1 +ATOM 440 C C . ASP A 1 71 ? -94.468 -18.441 5.634 1.00 95.49 ? 389 ASP A C 1 +ATOM 441 O O . ASP A 1 71 ? -95.340 -18.671 4.791 1.00 97.94 ? 389 ASP A O 1 +ATOM 442 C CB . ASP A 1 71 ? -94.486 -15.977 5.198 1.00 97.40 ? 389 ASP A CB 1 +ATOM 443 C CG . ASP A 1 71 ? -94.212 -14.588 5.743 1.00 101.76 ? 389 ASP A CG 1 +ATOM 444 O OD1 . ASP A 1 71 ? -93.644 -13.761 4.998 1.00 103.13 ? 389 ASP A OD1 1 +ATOM 445 O OD2 . ASP A 1 71 ? -94.568 -14.323 6.912 1.00 103.15 ? 389 ASP A OD2 1 +ATOM 446 N N . LEU A 1 72 ? -93.592 -19.363 6.020 1.00 92.67 ? 390 LEU A N 1 +ATOM 447 C CA . LEU A 1 72 ? -93.488 -20.661 5.373 1.00 90.75 ? 390 LEU A CA 1 +ATOM 448 C C . LEU A 1 72 ? -93.960 -21.771 6.305 1.00 88.91 ? 390 LEU A C 1 +ATOM 449 O O . LEU A 1 72 ? -93.982 -21.621 7.530 1.00 90.06 ? 390 LEU A O 1 +ATOM 450 C CB . LEU A 1 72 ? -92.044 -20.931 4.928 1.00 92.72 ? 390 LEU A CB 1 +ATOM 451 C CG . LEU A 1 72 ? -91.640 -20.425 3.541 1.00 94.51 ? 390 LEU A CG 1 +ATOM 452 C CD1 . LEU A 1 72 ? -92.544 -21.034 2.474 1.00 98.95 ? 390 LEU A CD1 1 +ATOM 453 C CD2 . LEU A 1 72 ? -91.651 -18.898 3.467 1.00 90.27 ? 390 LEU A CD2 1 +ATOM 454 N N . CYS A 1 73 ? -94.338 -22.897 5.699 1.00 88.25 ? 391 CYS A N 1 +ATOM 455 C CA . CYS A 1 73 ? -94.726 -24.099 6.424 1.00 89.70 ? 391 CYS A CA 1 +ATOM 456 C C . CYS A 1 73 ? -94.034 -25.309 5.813 1.00 84.52 ? 391 CYS A C 1 +ATOM 457 O O . CYS A 1 73 ? -93.764 -25.348 4.609 1.00 81.80 ? 391 CYS A O 1 +ATOM 458 C CB . CYS A 1 73 ? -96.247 -24.306 6.406 1.00 99.27 ? 391 CYS A CB 1 +ATOM 459 S SG . CYS A 1 73 ? -97.179 -23.149 7.438 1.00 111.54 ? 391 CYS A SG 1 +ATOM 460 N N . PHE A 1 74 ? -93.749 -26.301 6.656 1.00 81.38 ? 392 PHE A N 1 +ATOM 461 C CA . PHE A 1 74 ? -93.051 -27.502 6.223 1.00 74.14 ? 392 PHE A CA 1 +ATOM 462 C C . PHE A 1 74 ? -93.594 -28.699 6.990 1.00 73.11 ? 392 PHE A C 1 +ATOM 463 O O . PHE A 1 74 ? -94.161 -28.559 8.076 1.00 68.11 ? 392 PHE A O 1 +ATOM 464 C CB . PHE A 1 74 ? -91.537 -27.376 6.428 1.00 70.23 ? 392 PHE A CB 1 +ATOM 465 C CG . PHE A 1 74 ? -90.923 -26.223 5.694 1.00 72.12 ? 392 PHE A CG 1 +ATOM 466 C CD1 . PHE A 1 74 ? -90.670 -26.309 4.333 1.00 71.90 ? 392 PHE A CD1 1 +ATOM 467 C CD2 . PHE A 1 74 ? -90.604 -25.048 6.363 1.00 73.14 ? 392 PHE A CD2 1 +ATOM 468 C CE1 . PHE A 1 74 ? -90.107 -25.246 3.651 1.00 77.99 ? 392 PHE A CE1 1 +ATOM 469 C CE2 . PHE A 1 74 ? -90.040 -23.980 5.688 1.00 74.15 ? 392 PHE A CE2 1 +ATOM 470 C CZ . PHE A 1 74 ? -89.790 -24.078 4.329 1.00 77.82 ? 392 PHE A CZ 1 +ATOM 471 N N . THR A 1 75 ? -93.420 -29.887 6.403 1.00 75.29 ? 393 THR A N 1 +ATOM 472 C CA . THR A 1 75 ? -93.804 -31.111 7.101 1.00 79.90 ? 393 THR A CA 1 +ATOM 473 C C . THR A 1 75 ? -92.852 -31.419 8.251 1.00 80.92 ? 393 THR A C 1 +ATOM 474 O O . THR A 1 75 ? -93.287 -31.840 9.328 1.00 85.82 ? 393 THR A O 1 +ATOM 475 C CB . THR A 1 75 ? -93.876 -32.288 6.126 1.00 86.85 ? 393 THR A CB 1 +ATOM 476 O OG1 . THR A 1 75 ? -92.551 -32.740 5.808 1.00 94.31 ? 393 THR A OG1 1 +ATOM 477 C CG2 . THR A 1 75 ? -94.632 -31.902 4.863 1.00 91.96 ? 393 THR A CG2 1 +ATOM 478 N N . ASN A 1 76 ? -91.553 -31.219 8.049 1.00 75.56 ? 394 ASN A N 1 +ATOM 479 C CA . ASN A 1 76 ? -90.592 -31.425 9.122 1.00 72.51 ? 394 ASN A CA 1 +ATOM 480 C C . ASN A 1 76 ? -89.430 -30.468 8.932 1.00 64.04 ? 394 ASN A C 1 +ATOM 481 O O . ASN A 1 76 ? -89.052 -30.154 7.802 1.00 66.95 ? 394 ASN A O 1 +ATOM 482 C CB . ASN A 1 76 ? -90.072 -32.872 9.175 1.00 73.88 ? 394 ASN A CB 1 +ATOM 483 C CG . ASN A 1 76 ? -91.140 -33.865 9.600 1.00 90.69 ? 394 ASN A CG 1 +ATOM 484 O OD1 . ASN A 1 76 ? -91.622 -34.659 8.792 1.00 96.63 ? 394 ASN A OD1 1 +ATOM 485 N ND2 . ASN A 1 76 ? -91.533 -33.809 10.871 1.00 93.60 ? 394 ASN A ND2 1 +ATOM 486 N N . VAL A 1 77 ? -88.888 -29.995 10.049 1.00 52.97 ? 395 VAL A N 1 +ATOM 487 C CA . VAL A 1 77 ? -87.628 -29.270 10.085 1.00 49.03 ? 395 VAL A CA 1 +ATOM 488 C C . VAL A 1 77 ? -86.638 -30.142 10.839 1.00 40.71 ? 395 VAL A C 1 +ATOM 489 O O . VAL A 1 77 ? -86.983 -30.721 11.876 1.00 48.53 ? 395 VAL A O 1 +ATOM 490 C CB . VAL A 1 77 ? -87.785 -27.896 10.759 1.00 49.27 ? 395 VAL A CB 1 +ATOM 491 C CG1 . VAL A 1 77 ? -86.424 -27.267 11.006 1.00 44.49 ? 395 VAL A CG1 1 +ATOM 492 C CG2 . VAL A 1 77 ? -88.649 -26.983 9.902 1.00 51.58 ? 395 VAL A CG2 1 +ATOM 493 N N . TYR A 1 78 ? -85.431 -30.277 10.300 1.00 37.39 ? 396 TYR A N 1 +ATOM 494 C CA . TYR A 1 78 ? -84.345 -30.930 11.008 1.00 35.58 ? 396 TYR A CA 1 +ATOM 495 C C . TYR A 1 78 ? -83.326 -29.883 11.417 1.00 39.17 ? 396 TYR A C 1 +ATOM 496 O O . TYR A 1 78 ? -83.055 -28.943 10.666 1.00 39.67 ? 396 TYR A O 1 +ATOM 497 C CB . TYR A 1 78 ? -83.657 -31.992 10.148 1.00 41.33 ? 396 TYR A CB 1 +ATOM 498 C CG . TYR A 1 78 ? -84.549 -33.146 9.772 1.00 44.99 ? 396 TYR A CG 1 +ATOM 499 C CD1 . TYR A 1 78 ? -85.037 -34.024 10.737 1.00 45.70 ? 396 TYR A CD1 1 +ATOM 500 C CD2 . TYR A 1 78 ? -84.898 -33.363 8.451 1.00 53.83 ? 396 TYR A CD2 1 +ATOM 501 C CE1 . TYR A 1 78 ? -85.862 -35.089 10.384 1.00 47.04 ? 396 TYR A CE1 1 +ATOM 502 C CE2 . TYR A 1 78 ? -85.711 -34.414 8.092 1.00 56.44 ? 396 TYR A CE2 1 +ATOM 503 C CZ . TYR A 1 78 ? -86.190 -35.275 9.056 1.00 54.73 ? 396 TYR A CZ 1 +ATOM 504 O OH . TYR A 1 78 ? -87.003 -36.318 8.678 1.00 60.56 ? 396 TYR A OH 1 +ATOM 505 N N . ALA A 1 79 ? -82.761 -30.054 12.603 1.00 36.92 ? 397 ALA A N 1 +ATOM 506 C CA . ALA A 1 79 ? -81.694 -29.192 13.094 1.00 34.83 ? 397 ALA A CA 1 +ATOM 507 C C . ALA A 1 79 ? -80.493 -30.074 13.387 1.00 34.72 ? 397 ALA A C 1 +ATOM 508 O O . ALA A 1 79 ? -80.496 -30.822 14.369 1.00 34.05 ? 397 ALA A O 1 +ATOM 509 C CB . ALA A 1 79 ? -82.146 -28.425 14.338 1.00 36.60 ? 397 ALA A CB 1 +ATOM 510 N N . ASP A 1 80 ? -79.480 -30.013 12.526 1.00 27.76 ? 398 ASP A N 1 +ATOM 511 C CA . ASP A 1 80 ? -78.254 -30.757 12.743 1.00 28.44 ? 398 ASP A CA 1 +ATOM 512 C C . ASP A 1 80 ? -77.236 -29.841 13.399 1.00 32.44 ? 398 ASP A C 1 +ATOM 513 O O . ASP A 1 80 ? -77.175 -28.651 13.088 1.00 33.49 ? 398 ASP A O 1 +ATOM 514 C CB . ASP A 1 80 ? -77.691 -31.302 11.426 1.00 27.42 ? 398 ASP A CB 1 +ATOM 515 C CG . ASP A 1 80 ? -78.686 -32.169 10.681 1.00 35.89 ? 398 ASP A CG 1 +ATOM 516 O OD1 . ASP A 1 80 ? -79.522 -32.820 11.343 1.00 33.04 ? 398 ASP A OD1 1 +ATOM 517 O OD2 . ASP A 1 80 ? -78.639 -32.189 9.432 1.00 30.99 ? 398 ASP A OD2 1 +ATOM 518 N N . SER A 1 81 ? -76.423 -30.395 14.299 1.00 28.23 ? 399 SER A N 1 +ATOM 519 C CA . SER A 1 81 ? -75.495 -29.525 15.013 1.00 28.80 ? 399 SER A CA 1 +ATOM 520 C C . SER A 1 81 ? -74.219 -30.275 15.376 1.00 31.73 ? 399 SER A C 1 +ATOM 521 O O . SER A 1 81 ? -74.225 -31.496 15.549 1.00 26.10 ? 399 SER A O 1 +ATOM 522 C CB . SER A 1 81 ? -76.144 -28.918 16.264 1.00 25.88 ? 399 SER A CB 1 +ATOM 523 O OG . SER A 1 81 ? -76.591 -29.911 17.171 1.00 33.93 ? 399 SER A OG 1 +ATOM 524 N N . PHE A 1 82 ? -73.126 -29.520 15.492 1.00 27.55 ? 400 PHE A N 1 +ATOM 525 C CA . PHE A 1 82 ? -71.782 -30.072 15.623 1.00 28.86 ? 400 PHE A CA 1 +ATOM 526 C C . PHE A 1 82 ? -70.801 -28.913 15.755 1.00 26.81 ? 400 PHE A C 1 +ATOM 527 O O . PHE A 1 82 ? -71.161 -27.748 15.563 1.00 24.21 ? 400 PHE A O 1 +ATOM 528 C CB . PHE A 1 82 ? -71.394 -30.948 14.421 1.00 23.91 ? 400 PHE A CB 1 +ATOM 529 C CG . PHE A 1 82 ? -71.634 -30.297 13.082 1.00 25.56 ? 400 PHE A CG 1 +ATOM 530 C CD1 . PHE A 1 82 ? -70.692 -29.425 12.532 1.00 23.59 ? 400 PHE A CD1 1 +ATOM 531 C CD2 . PHE A 1 82 ? -72.789 -30.561 12.360 1.00 27.69 ? 400 PHE A CD2 1 +ATOM 532 C CE1 . PHE A 1 82 ? -70.909 -28.819 11.303 1.00 25.65 ? 400 PHE A CE1 1 +ATOM 533 C CE2 . PHE A 1 82 ? -73.009 -29.961 11.123 1.00 27.35 ? 400 PHE A CE2 1 +ATOM 534 C CZ . PHE A 1 82 ? -72.062 -29.088 10.592 1.00 28.97 ? 400 PHE A CZ 1 +ATOM 535 N N . VAL A 1 83 ? -69.543 -29.260 16.045 1.00 26.51 ? 401 VAL A N 1 +ATOM 536 C CA . VAL A 1 83 ? -68.432 -28.319 16.156 1.00 24.12 ? 401 VAL A CA 1 +ATOM 537 C C . VAL A 1 83 ? -67.375 -28.653 15.103 1.00 23.74 ? 401 VAL A C 1 +ATOM 538 O O . VAL A 1 83 ? -67.040 -29.825 14.905 1.00 24.15 ? 401 VAL A O 1 +ATOM 539 C CB . VAL A 1 83 ? -67.818 -28.360 17.574 1.00 24.22 ? 401 VAL A CB 1 +ATOM 540 C CG1 . VAL A 1 83 ? -66.462 -27.685 17.580 1.00 27.24 ? 401 VAL A CG1 1 +ATOM 541 C CG2 . VAL A 1 83 ? -68.745 -27.678 18.574 1.00 29.40 ? 401 VAL A CG2 1 +ATOM 542 N N . ILE A 1 84 ? -66.863 -27.615 14.424 1.00 22.67 ? 402 ILE A N 1 +ATOM 543 C CA . ILE A 1 84 ? -65.741 -27.690 13.480 1.00 23.16 ? 402 ILE A CA 1 +ATOM 544 C C . ILE A 1 84 ? -64.850 -26.469 13.707 1.00 22.40 ? 402 ILE A C 1 +ATOM 545 O O . ILE A 1 84 ? -65.173 -25.591 14.499 1.00 24.76 ? 402 ILE A O 1 +ATOM 546 C CB . ILE A 1 84 ? -66.207 -27.737 12.008 1.00 23.55 ? 402 ILE A CB 1 +ATOM 547 C CG1 . ILE A 1 84 ? -67.145 -26.564 11.721 1.00 26.27 ? 402 ILE A CG1 1 +ATOM 548 C CG2 . ILE A 1 84 ? -66.886 -29.077 11.692 1.00 23.93 ? 402 ILE A CG2 1 +ATOM 549 C CD1 . ILE A 1 84 ? -67.642 -26.502 10.285 1.00 24.92 ? 402 ILE A CD1 1 +ATOM 550 N N . ARG A 1 85 ? -63.721 -26.395 12.994 1.00 23.30 ? 403 ARG A N 1 +ATOM 551 C CA . ARG A 1 85 ? -62.939 -25.174 13.149 1.00 23.28 ? 403 ARG A CA 1 +ATOM 552 C C . ARG A 1 85 ? -63.422 -24.089 12.186 1.00 24.12 ? 403 ARG A C 1 +ATOM 553 O O . ARG A 1 85 ? -64.134 -24.351 11.211 1.00 25.99 ? 403 ARG A O 1 +ATOM 554 C CB . ARG A 1 85 ? -61.428 -25.416 12.965 1.00 31.80 ? 403 ARG A CB 1 +ATOM 555 C CG . ARG A 1 85 ? -61.029 -26.325 11.860 1.00 38.10 ? 403 ARG A CG 1 +ATOM 556 C CD . ARG A 1 85 ? -59.501 -26.561 11.896 1.00 34.26 ? 403 ARG A CD 1 +ATOM 557 N NE . ARG A 1 85 ? -58.789 -25.454 11.268 1.00 26.99 ? 403 ARG A NE 1 +ATOM 558 C CZ . ARG A 1 85 ? -57.662 -25.600 10.581 1.00 32.12 ? 403 ARG A CZ 1 +ATOM 559 N NH1 . ARG A 1 85 ? -57.130 -26.804 10.456 1.00 28.62 ? 403 ARG A NH1 1 +ATOM 560 N NH2 . ARG A 1 85 ? -57.072 -24.553 10.029 1.00 32.91 ? 403 ARG A NH2 1 +ATOM 561 N N . GLY A 1 86 ? -63.044 -22.846 12.500 1.00 23.74 ? 404 GLY A N 1 +ATOM 562 C CA . GLY A 1 86 ? -63.536 -21.707 11.735 1.00 30.03 ? 404 GLY A CA 1 +ATOM 563 C C . GLY A 1 86 ? -63.193 -21.772 10.260 1.00 27.90 ? 404 GLY A C 1 +ATOM 564 O O . GLY A 1 86 ? -63.994 -21.367 9.414 1.00 29.72 ? 404 GLY A O 1 +ATOM 565 N N . ASP A 1 87 ? -61.996 -22.277 9.930 1.00 30.52 ? 405 ASP A N 1 +ATOM 566 C CA . ASP A 1 87 ? -61.577 -22.406 8.533 1.00 31.95 ? 405 ASP A CA 1 +ATOM 567 C C . ASP A 1 87 ? -62.444 -23.391 7.743 1.00 26.59 ? 405 ASP A C 1 +ATOM 568 O O . ASP A 1 87 ? -62.389 -23.399 6.504 1.00 27.32 ? 405 ASP A O 1 +ATOM 569 C CB . ASP A 1 87 ? -60.118 -22.870 8.457 1.00 34.70 ? 405 ASP A CB 1 +ATOM 570 C CG . ASP A 1 87 ? -59.129 -21.746 8.644 1.00 41.84 ? 405 ASP A CG 1 +ATOM 571 O OD1 . ASP A 1 87 ? -59.454 -20.586 8.309 1.00 38.05 ? 405 ASP A OD1 1 +ATOM 572 O OD2 . ASP A 1 87 ? -58.013 -22.034 9.132 1.00 39.76 ? 405 ASP A OD2 1 +ATOM 573 N N . GLU A 1 88 ? -63.226 -24.225 8.424 1.00 24.12 ? 406 GLU A N 1 +ATOM 574 C CA . GLU A 1 88 ? -64.054 -25.233 7.776 1.00 28.58 ? 406 GLU A CA 1 +ATOM 575 C C . GLU A 1 88 ? -65.523 -24.844 7.643 1.00 25.50 ? 406 GLU A C 1 +ATOM 576 O O . GLU A 1 88 ? -66.273 -25.570 6.982 1.00 27.03 ? 406 GLU A O 1 +ATOM 577 C CB . GLU A 1 88 ? -63.951 -26.563 8.539 1.00 28.94 ? 406 GLU A CB 1 +ATOM 578 C CG . GLU A 1 88 ? -62.555 -27.147 8.481 1.00 27.91 ? 406 GLU A CG 1 +ATOM 579 C CD . GLU A 1 88 ? -62.340 -28.273 9.479 1.00 33.09 ? 406 GLU A CD 1 +ATOM 580 O OE1 . GLU A 1 88 ? -63.045 -28.320 10.514 1.00 29.75 ? 406 GLU A OE1 1 +ATOM 581 O OE2 . GLU A 1 88 ? -61.451 -29.109 9.229 1.00 32.38 ? 406 GLU A OE2 1 +ATOM 582 N N . VAL A 1 89 ? -65.958 -23.724 8.236 1.00 27.24 ? 407 VAL A N 1 +ATOM 583 C CA . VAL A 1 89 ? -67.376 -23.374 8.159 1.00 27.45 ? 407 VAL A CA 1 +ATOM 584 C C . VAL A 1 89 ? -67.809 -23.182 6.709 1.00 28.10 ? 407 VAL A C 1 +ATOM 585 O O . VAL A 1 89 ? -68.962 -23.470 6.351 1.00 27.59 ? 407 VAL A O 1 +ATOM 586 C CB . VAL A 1 89 ? -67.666 -22.129 9.029 1.00 27.35 ? 407 VAL A CB 1 +ATOM 587 C CG1 . VAL A 1 89 ? -69.105 -21.642 8.853 1.00 27.81 ? 407 VAL A CG1 1 +ATOM 588 C CG2 . VAL A 1 89 ? -67.405 -22.463 10.495 1.00 30.44 ? 407 VAL A CG2 1 +ATOM 589 N N . ARG A 1 90 ? -66.889 -22.751 5.839 1.00 23.34 ? 408 ARG A N 1 +ATOM 590 C CA . ARG A 1 90 ? -67.236 -22.581 4.429 1.00 29.34 ? 408 ARG A CA 1 +ATOM 591 C C . ARG A 1 90 ? -67.589 -23.901 3.757 1.00 24.95 ? 408 ARG A C 1 +ATOM 592 O O . ARG A 1 90 ? -68.261 -23.892 2.712 1.00 27.56 ? 408 ARG A O 1 +ATOM 593 C CB . ARG A 1 90 ? -66.092 -21.904 3.670 1.00 30.76 ? 408 ARG A CB 1 +ATOM 594 C CG . ARG A 1 90 ? -64.785 -22.660 3.795 1.00 38.44 ? 408 ARG A CG 1 +ATOM 595 C CD . ARG A 1 90 ? -63.649 -21.972 3.055 1.00 52.91 ? 408 ARG A CD 1 +ATOM 596 N NE . ARG A 1 90 ? -64.065 -21.473 1.746 1.00 74.94 ? 408 ARG A NE 1 +ATOM 597 C CZ . ARG A 1 90 ? -64.365 -22.240 0.700 1.00 81.19 ? 408 ARG A CZ 1 +ATOM 598 N NH1 . ARG A 1 90 ? -64.297 -23.564 0.791 1.00 81.40 ? 408 ARG A NH1 1 +ATOM 599 N NH2 . ARG A 1 90 ? -64.733 -21.677 -0.445 1.00 81.02 ? 408 ARG A NH2 1 +ATOM 600 N N . GLN A 1 91 ? -67.184 -25.030 4.335 1.00 25.72 ? 409 GLN A N 1 +ATOM 601 C CA . GLN A 1 91 ? -67.531 -26.333 3.775 1.00 28.54 ? 409 GLN A CA 1 +ATOM 602 C C . GLN A 1 91 ? -68.969 -26.752 4.059 1.00 29.22 ? 409 GLN A C 1 +ATOM 603 O O . GLN A 1 91 ? -69.446 -27.709 3.436 1.00 27.98 ? 409 GLN A O 1 +ATOM 604 C CB . GLN A 1 91 ? -66.581 -27.411 4.302 1.00 27.57 ? 409 GLN A CB 1 +ATOM 605 C CG . GLN A 1 91 ? -65.190 -27.320 3.695 1.00 28.05 ? 409 GLN A CG 1 +ATOM 606 C CD . GLN A 1 91 ? -64.263 -28.392 4.229 1.00 26.39 ? 409 GLN A CD 1 +ATOM 607 O OE1 . GLN A 1 91 ? -64.601 -29.580 4.231 1.00 24.45 ? 409 GLN A OE1 1 +ATOM 608 N NE2 . GLN A 1 91 ? -63.080 -27.978 4.686 1.00 24.22 ? 409 GLN A NE2 1 +ATOM 609 N N . ILE A 1 92 ? -69.654 -26.087 4.984 1.00 26.18 ? 410 ILE A N 1 +ATOM 610 C CA . ILE A 1 92 ? -71.035 -26.433 5.298 1.00 26.99 ? 410 ILE A CA 1 +ATOM 611 C C . ILE A 1 92 ? -71.914 -25.626 4.358 1.00 27.86 ? 410 ILE A C 1 +ATOM 612 O O . ILE A 1 92 ? -72.543 -24.640 4.755 1.00 28.64 ? 410 ILE A O 1 +ATOM 613 C CB . ILE A 1 92 ? -71.375 -26.169 6.774 1.00 27.01 ? 410 ILE A CB 1 +ATOM 614 C CG1 . ILE A 1 92 ? -70.246 -26.678 7.694 1.00 24.36 ? 410 ILE A CG1 1 +ATOM 615 C CG2 . ILE A 1 92 ? -72.723 -26.839 7.139 1.00 27.93 ? 410 ILE A CG2 1 +ATOM 616 C CD1 . ILE A 1 92 ? -69.973 -28.188 7.564 1.00 27.38 ? 410 ILE A CD1 1 +ATOM 617 N N . ALA A 1 93 ? -71.923 -26.024 3.090 1.00 27.36 ? 411 ALA A N 1 +ATOM 618 C CA . ALA A 1 93 ? -72.691 -25.339 2.063 1.00 27.59 ? 411 ALA A CA 1 +ATOM 619 C C . ALA A 1 93 ? -72.829 -26.302 0.892 1.00 28.44 ? 411 ALA A C 1 +ATOM 620 O O . ALA A 1 93 ? -71.993 -27.198 0.745 1.00 31.47 ? 411 ALA A O 1 +ATOM 621 C CB . ALA A 1 93 ? -71.989 -24.040 1.628 1.00 28.44 ? 411 ALA A CB 1 +ATOM 622 N N . PRO A 1 94 ? -73.877 -26.164 0.074 1.00 32.78 ? 412 PRO A N 1 +ATOM 623 C CA . PRO A 1 94 ? -73.987 -27.059 -1.087 1.00 33.49 ? 412 PRO A CA 1 +ATOM 624 C C . PRO A 1 94 ? -72.787 -26.883 -2.005 1.00 33.48 ? 412 PRO A C 1 +ATOM 625 O O . PRO A 1 94 ? -72.258 -25.782 -2.156 1.00 34.00 ? 412 PRO A O 1 +ATOM 626 C CB . PRO A 1 94 ? -75.295 -26.617 -1.760 1.00 34.36 ? 412 PRO A CB 1 +ATOM 627 C CG . PRO A 1 94 ? -75.565 -25.231 -1.243 1.00 39.18 ? 412 PRO A CG 1 +ATOM 628 C CD . PRO A 1 94 ? -74.981 -25.191 0.142 1.00 37.79 ? 412 PRO A CD 1 +ATOM 629 N N . GLY A 1 95 ? -72.340 -27.989 -2.598 1.00 32.04 ? 413 GLY A N 1 +ATOM 630 C CA . GLY A 1 95 ? -71.317 -27.936 -3.625 1.00 38.24 ? 413 GLY A CA 1 +ATOM 631 C C . GLY A 1 95 ? -69.892 -27.771 -3.143 1.00 37.79 ? 413 GLY A C 1 +ATOM 632 O O . GLY A 1 95 ? -69.006 -27.518 -3.966 1.00 36.60 ? 413 GLY A O 1 +ATOM 633 N N . GLN A 1 96 ? -69.634 -27.911 -1.851 1.00 32.88 ? 414 GLN A N 1 +ATOM 634 C CA . GLN A 1 96 ? -68.297 -27.729 -1.304 1.00 34.71 ? 414 GLN A CA 1 +ATOM 635 C C . GLN A 1 96 ? -67.561 -29.060 -1.181 1.00 31.05 ? 414 GLN A C 1 +ATOM 636 O O . GLN A 1 96 ? -68.159 -30.136 -1.197 1.00 27.99 ? 414 GLN A O 1 +ATOM 637 C CB . GLN A 1 96 ? -68.369 -27.047 0.062 1.00 32.48 ? 414 GLN A CB 1 +ATOM 638 C CG . GLN A 1 96 ? -69.047 -25.699 0.010 1.00 32.69 ? 414 GLN A CG 1 +ATOM 639 C CD . GLN A 1 96 ? -68.488 -24.826 -1.087 1.00 39.10 ? 414 GLN A CD 1 +ATOM 640 O OE1 . GLN A 1 96 ? -67.309 -24.491 -1.083 1.00 41.82 ? 414 GLN A OE1 1 +ATOM 641 N NE2 . GLN A 1 96 ? -69.338 -24.456 -2.044 1.00 51.34 ? 414 GLN A NE2 1 +ATOM 642 N N . THR A 1 97 ? -66.234 -28.972 -1.069 1.00 28.23 ? 415 THR A N 1 +ATOM 643 C CA . THR A 1 97 ? -65.387 -30.137 -0.845 1.00 24.83 ? 415 THR A CA 1 +ATOM 644 C C . THR A 1 97 ? -64.429 -29.844 0.303 1.00 24.11 ? 415 THR A C 1 +ATOM 645 O O . THR A 1 97 ? -64.219 -28.692 0.687 1.00 24.93 ? 415 THR A O 1 +ATOM 646 C CB . THR A 1 97 ? -64.586 -30.512 -2.104 1.00 31.81 ? 415 THR A CB 1 +ATOM 647 O OG1 . THR A 1 97 ? -63.596 -29.504 -2.348 1.00 28.84 ? 415 THR A OG1 1 +ATOM 648 C CG2 . THR A 1 97 ? -65.500 -30.621 -3.324 1.00 38.27 ? 415 THR A CG2 1 +ATOM 649 N N . GLY A 1 98 ? -63.815 -30.898 0.818 1.00 23.60 ? 416 GLY A N 1 +ATOM 650 C CA . GLY A 1 98 ? -62.854 -30.755 1.904 1.00 21.50 ? 416 GLY A CA 1 +ATOM 651 C C . GLY A 1 98 ? -63.015 -31.900 2.870 1.00 22.47 ? 416 GLY A C 1 +ATOM 652 O O . GLY A 1 98 ? -63.929 -32.706 2.703 1.00 23.70 ? 416 GLY A O 1 +ATOM 653 N N . LYS A 1 99 ? -62.161 -31.988 3.898 1.00 20.88 ? 417 LYS A N 1 +ATOM 654 C CA . LYS A 1 99 ? -62.270 -33.105 4.825 1.00 19.23 ? 417 LYS A CA 1 +ATOM 655 C C . LYS A 1 99 ? -63.627 -33.145 5.512 1.00 20.09 ? 417 LYS A C 1 +ATOM 656 O O . LYS A 1 99 ? -64.148 -34.228 5.798 1.00 22.08 ? 417 LYS A O 1 +ATOM 657 C CB . LYS A 1 99 ? -61.165 -33.018 5.872 1.00 23.83 ? 417 LYS A CB 1 +ATOM 658 C CG . LYS A 1 99 ? -59.777 -33.247 5.288 1.00 24.60 ? 417 LYS A CG 1 +ATOM 659 C CD . LYS A 1 99 ? -58.722 -33.125 6.401 1.00 28.40 ? 417 LYS A CD 1 +ATOM 660 C CE . LYS A 1 99 ? -57.312 -33.308 5.842 1.00 39.02 ? 417 LYS A CE 1 +ATOM 661 N NZ . LYS A 1 99 ? -56.936 -32.203 4.923 1.00 48.89 ? 417 LYS A NZ 1 +ATOM 662 N N . ILE A 1 100 ? -64.225 -31.989 5.774 1.00 21.56 ? 418 ILE A N 1 +ATOM 663 C CA . ILE A 1 100 ? -65.510 -32.015 6.471 1.00 19.52 ? 418 ILE A CA 1 +ATOM 664 C C . ILE A 1 100 ? -66.629 -32.395 5.508 1.00 20.60 ? 418 ILE A C 1 +ATOM 665 O O . ILE A 1 100 ? -67.403 -33.326 5.767 1.00 22.84 ? 418 ILE A O 1 +ATOM 666 C CB . ILE A 1 100 ? -65.789 -30.664 7.158 1.00 24.29 ? 418 ILE A CB 1 +ATOM 667 C CG1 . ILE A 1 100 ? -64.723 -30.373 8.226 1.00 24.56 ? 418 ILE A CG1 1 +ATOM 668 C CG2 . ILE A 1 100 ? -67.159 -30.715 7.822 1.00 23.81 ? 418 ILE A CG2 1 +ATOM 669 C CD1 . ILE A 1 100 ? -64.451 -31.553 9.157 1.00 23.98 ? 418 ILE A CD1 1 +ATOM 670 N N . ALA A 1 101 ? -66.748 -31.675 4.387 1.00 21.00 ? 419 ALA A N 1 +ATOM 671 C CA . ALA A 1 101 ? -67.812 -32.001 3.437 1.00 24.03 ? 419 ALA A CA 1 +ATOM 672 C C . ALA A 1 101 ? -67.650 -33.410 2.878 1.00 29.29 ? 419 ALA A C 1 +ATOM 673 O O . ALA A 1 101 ? -68.642 -34.111 2.651 1.00 27.55 ? 419 ALA A O 1 +ATOM 674 C CB . ALA A 1 101 ? -67.849 -30.979 2.306 1.00 23.09 ? 419 ALA A CB 1 +ATOM 675 N N . ASP A 1 102 ? -66.408 -33.847 2.646 1.00 24.23 ? 420 ASP A N 1 +ATOM 676 C CA . ASP A 1 102 ? -66.208 -35.152 2.031 1.00 24.29 ? 420 ASP A CA 1 +ATOM 677 C C . ASP A 1 102 ? -66.430 -36.281 3.023 1.00 21.26 ? 420 ASP A C 1 +ATOM 678 O O . ASP A 1 102 ? -67.033 -37.295 2.676 1.00 24.87 ? 420 ASP A O 1 +ATOM 679 C CB . ASP A 1 102 ? -64.787 -35.288 1.457 1.00 24.99 ? 420 ASP A CB 1 +ATOM 680 C CG . ASP A 1 102 ? -64.492 -34.319 0.316 1.00 33.51 ? 420 ASP A CG 1 +ATOM 681 O OD1 . ASP A 1 102 ? -65.402 -33.622 -0.186 1.00 30.10 ? 420 ASP A OD1 1 +ATOM 682 O OD2 . ASP A 1 102 ? -63.308 -34.262 -0.082 1.00 28.29 ? 420 ASP A OD2 1 +ATOM 683 N N . TYR A 1 103 ? -65.910 -36.150 4.243 1.00 21.62 ? 421 TYR A N 1 +ATOM 684 C CA . TYR A 1 103 ? -65.811 -37.298 5.127 1.00 22.43 ? 421 TYR A CA 1 +ATOM 685 C C . TYR A 1 103 ? -66.613 -37.171 6.409 1.00 20.54 ? 421 TYR A C 1 +ATOM 686 O O . TYR A 1 103 ? -66.623 -38.124 7.198 1.00 23.89 ? 421 TYR A O 1 +ATOM 687 C CB . TYR A 1 103 ? -64.347 -37.571 5.483 1.00 21.15 ? 421 TYR A CB 1 +ATOM 688 C CG . TYR A 1 103 ? -63.469 -37.740 4.254 1.00 22.43 ? 421 TYR A CG 1 +ATOM 689 C CD1 . TYR A 1 103 ? -63.925 -38.434 3.139 1.00 22.73 ? 421 TYR A CD1 1 +ATOM 690 C CD2 . TYR A 1 103 ? -62.190 -37.202 4.215 1.00 25.79 ? 421 TYR A CD2 1 +ATOM 691 C CE1 . TYR A 1 103 ? -63.119 -38.595 2.011 1.00 22.66 ? 421 TYR A CE1 1 +ATOM 692 C CE2 . TYR A 1 103 ? -61.385 -37.348 3.097 1.00 27.31 ? 421 TYR A CE2 1 +ATOM 693 C CZ . TYR A 1 103 ? -61.850 -38.046 2.004 1.00 30.25 ? 421 TYR A CZ 1 +ATOM 694 O OH . TYR A 1 103 ? -61.041 -38.190 0.896 1.00 26.41 ? 421 TYR A OH 1 +ATOM 695 N N . ASN A 1 104 ? -67.288 -36.045 6.638 1.00 21.50 ? 422 ASN A N 1 +ATOM 696 C CA . ASN A 1 104 ? -67.933 -35.831 7.933 1.00 23.70 ? 422 ASN A CA 1 +ATOM 697 C C . ASN A 1 104 ? -69.393 -35.398 7.852 1.00 23.85 ? 422 ASN A C 1 +ATOM 698 O O . ASN A 1 104 ? -70.257 -36.004 8.503 1.00 23.81 ? 422 ASN A O 1 +ATOM 699 C CB . ASN A 1 104 ? -67.130 -34.800 8.724 1.00 22.57 ? 422 ASN A CB 1 +ATOM 700 C CG . ASN A 1 104 ? -65.841 -35.382 9.249 1.00 27.53 ? 422 ASN A CG 1 +ATOM 701 O OD1 . ASN A 1 104 ? -65.813 -35.941 10.335 1.00 24.02 ? 422 ASN A OD1 1 +ATOM 702 N ND2 . ASN A 1 104 ? -64.769 -35.286 8.458 1.00 21.48 ? 422 ASN A ND2 1 +ATOM 703 N N . TYR A 1 105 ? -69.678 -34.334 7.106 1.00 22.28 ? 423 TYR A N 1 +ATOM 704 C CA . TYR A 1 105 ? -71.053 -33.829 7.014 1.00 25.28 ? 423 TYR A CA 1 +ATOM 705 C C . TYR A 1 105 ? -71.240 -33.175 5.658 1.00 20.94 ? 423 TYR A C 1 +ATOM 706 O O . TYR A 1 105 ? -70.591 -32.160 5.372 1.00 24.42 ? 423 TYR A O 1 +ATOM 707 C CB . TYR A 1 105 ? -71.364 -32.821 8.132 1.00 22.33 ? 423 TYR A CB 1 +ATOM 708 C CG . TYR A 1 105 ? -72.811 -32.331 8.104 1.00 28.13 ? 423 TYR A CG 1 +ATOM 709 C CD1 . TYR A 1 105 ? -73.814 -33.048 8.735 1.00 26.57 ? 423 TYR A CD1 1 +ATOM 710 C CD2 . TYR A 1 105 ? -73.163 -31.157 7.443 1.00 24.88 ? 423 TYR A CD2 1 +ATOM 711 C CE1 . TYR A 1 105 ? -75.152 -32.613 8.716 1.00 25.00 ? 423 TYR A CE1 1 +ATOM 712 C CE2 . TYR A 1 105 ? -74.490 -30.703 7.417 1.00 26.66 ? 423 TYR A CE2 1 +ATOM 713 C CZ . TYR A 1 105 ? -75.479 -31.440 8.048 1.00 27.81 ? 423 TYR A CZ 1 +ATOM 714 O OH . TYR A 1 105 ? -76.783 -30.999 8.028 1.00 29.46 ? 423 TYR A OH 1 +ATOM 715 N N . LYS A 1 106 ? -72.151 -33.722 4.855 1.00 23.09 ? 424 LYS A N 1 +ATOM 716 C CA . LYS A 1 106 ? -72.306 -33.356 3.450 1.00 26.23 ? 424 LYS A CA 1 +ATOM 717 C C . LYS A 1 106 ? -73.707 -32.816 3.199 1.00 31.19 ? 424 LYS A C 1 +ATOM 718 O O . LYS A 1 106 ? -74.690 -33.541 3.371 1.00 31.28 ? 424 LYS A O 1 +ATOM 719 C CB . LYS A 1 106 ? -72.055 -34.560 2.540 1.00 26.92 ? 424 LYS A CB 1 +ATOM 720 C CG . LYS A 1 106 ? -72.230 -34.253 1.039 1.00 27.64 ? 424 LYS A CG 1 +ATOM 721 C CD . LYS A 1 106 ? -71.307 -33.107 0.598 1.00 25.74 ? 424 LYS A CD 1 +ATOM 722 C CE . LYS A 1 106 ? -71.293 -32.990 -0.930 1.00 32.18 ? 424 LYS A CE 1 +ATOM 723 N NZ . LYS A 1 106 ? -70.450 -31.825 -1.397 1.00 27.21 ? 424 LYS A NZ 1 +ATOM 724 N N . LEU A 1 107 ? -73.793 -31.543 2.735 1.00 30.20 ? 425 LEU A N 1 +ATOM 725 C CA . LEU A 1 107 ? -75.068 -31.007 2.276 1.00 27.12 ? 425 LEU A CA 1 +ATOM 726 C C . LEU A 1 107 ? -75.295 -31.350 0.807 1.00 30.05 ? 425 LEU A C 1 +ATOM 727 O O . LEU A 1 107 ? -74.340 -31.401 0.022 1.00 29.45 ? 425 LEU A O 1 +ATOM 728 C CB . LEU A 1 107 ? -75.096 -29.492 2.459 1.00 32.51 ? 425 LEU A CB 1 +ATOM 729 C CG . LEU A 1 107 ? -75.265 -28.988 3.898 1.00 36.21 ? 425 LEU A CG 1 +ATOM 730 C CD1 . LEU A 1 107 ? -75.410 -27.473 3.915 1.00 40.34 ? 425 LEU A CD1 1 +ATOM 731 C CD2 . LEU A 1 107 ? -76.473 -29.651 4.578 1.00 36.93 ? 425 LEU A CD2 1 +ATOM 732 N N . PRO A 1 108 ? -76.537 -31.571 0.389 1.00 30.62 ? 426 PRO A N 1 +ATOM 733 C CA . PRO A 1 108 ? -76.798 -31.863 -1.023 1.00 34.67 ? 426 PRO A CA 1 +ATOM 734 C C . PRO A 1 108 ? -76.733 -30.599 -1.872 1.00 38.68 ? 426 PRO A C 1 +ATOM 735 O O . PRO A 1 108 ? -76.845 -29.475 -1.380 1.00 39.68 ? 426 PRO A O 1 +ATOM 736 C CB . PRO A 1 108 ? -78.214 -32.446 -1.003 1.00 35.08 ? 426 PRO A CB 1 +ATOM 737 C CG . PRO A 1 108 ? -78.875 -31.730 0.118 1.00 35.90 ? 426 PRO A CG 1 +ATOM 738 C CD . PRO A 1 108 ? -77.781 -31.569 1.182 1.00 28.04 ? 426 PRO A CD 1 +ATOM 739 N N . ASP A 1 109 ? -76.535 -30.805 -3.175 1.00 41.18 ? 427 ASP A N 1 +ATOM 740 C CA . ASP A 1 109 ? -76.534 -29.680 -4.109 1.00 50.47 ? 427 ASP A CA 1 +ATOM 741 C C . ASP A 1 109 ? -77.840 -28.894 -4.048 1.00 48.17 ? 427 ASP A C 1 +ATOM 742 O O . ASP A 1 109 ? -77.830 -27.658 -4.094 1.00 52.35 ? 427 ASP A O 1 +ATOM 743 C CB . ASP A 1 109 ? -76.290 -30.177 -5.532 1.00 55.52 ? 427 ASP A CB 1 +ATOM 744 C CG . ASP A 1 109 ? -74.936 -30.824 -5.701 1.00 56.51 ? 427 ASP A CG 1 +ATOM 745 O OD1 . ASP A 1 109 ? -74.010 -30.493 -4.932 1.00 54.71 ? 427 ASP A OD1 1 +ATOM 746 O OD2 . ASP A 1 109 ? -74.798 -31.667 -6.613 1.00 61.45 ? 427 ASP A OD2 1 +ATOM 747 N N . ASP A 1 110 ? -78.976 -29.591 -3.950 1.00 48.45 ? 428 ASP A N 1 +ATOM 748 C CA . ASP A 1 110 ? -80.295 -28.965 -3.942 1.00 53.95 ? 428 ASP A CA 1 +ATOM 749 C C . ASP A 1 110 ? -80.772 -28.614 -2.536 1.00 50.96 ? 428 ASP A C 1 +ATOM 750 O O . ASP A 1 110 ? -81.980 -28.637 -2.264 1.00 56.23 ? 428 ASP A O 1 +ATOM 751 C CB . ASP A 1 110 ? -81.312 -29.868 -4.647 1.00 55.94 ? 428 ASP A CB 1 +ATOM 752 C CG . ASP A 1 110 ? -81.587 -31.167 -3.889 1.00 63.75 ? 428 ASP A CG 1 +ATOM 753 O OD1 . ASP A 1 110 ? -80.970 -31.413 -2.824 1.00 55.32 ? 428 ASP A OD1 1 +ATOM 754 O OD2 . ASP A 1 110 ? -82.440 -31.947 -4.366 1.00 65.32 ? 428 ASP A OD2 1 +ATOM 755 N N . PHE A 1 111 ? -79.850 -28.294 -1.637 1.00 45.19 ? 429 PHE A N 1 +ATOM 756 C CA . PHE A 1 111 ? -80.205 -28.001 -0.257 1.00 39.82 ? 429 PHE A CA 1 +ATOM 757 C C . PHE A 1 111 ? -81.131 -26.792 -0.167 1.00 41.11 ? 429 PHE A C 1 +ATOM 758 O O . PHE A 1 111 ? -80.888 -25.752 -0.786 1.00 48.98 ? 429 PHE A O 1 +ATOM 759 C CB . PHE A 1 111 ? -78.926 -27.762 0.540 1.00 35.34 ? 429 PHE A CB 1 +ATOM 760 C CG . PHE A 1 111 ? -79.155 -27.353 1.959 1.00 40.10 ? 429 PHE A CG 1 +ATOM 761 C CD1 . PHE A 1 111 ? -79.744 -28.225 2.861 1.00 43.93 ? 429 PHE A CD1 1 +ATOM 762 C CD2 . PHE A 1 111 ? -78.739 -26.108 2.405 1.00 39.39 ? 429 PHE A CD2 1 +ATOM 763 C CE1 . PHE A 1 111 ? -79.934 -27.853 4.180 1.00 45.52 ? 429 PHE A CE1 1 +ATOM 764 C CE2 . PHE A 1 111 ? -78.930 -25.731 3.723 1.00 38.41 ? 429 PHE A CE2 1 +ATOM 765 C CZ . PHE A 1 111 ? -79.530 -26.609 4.612 1.00 40.17 ? 429 PHE A CZ 1 +ATOM 766 N N . THR A 1 112 ? -82.211 -26.942 0.588 1.00 41.49 ? 430 THR A N 1 +ATOM 767 C CA . THR A 1 112 ? -83.064 -25.824 0.973 1.00 46.29 ? 430 THR A CA 1 +ATOM 768 C C . THR A 1 112 ? -83.048 -25.766 2.495 1.00 51.37 ? 430 THR A C 1 +ATOM 769 O O . THR A 1 112 ? -83.525 -26.690 3.164 1.00 49.25 ? 430 THR A O 1 +ATOM 770 C CB . THR A 1 112 ? -84.487 -25.968 0.428 1.00 54.52 ? 430 THR A CB 1 +ATOM 771 O OG1 . THR A 1 112 ? -85.136 -27.075 1.061 1.00 63.83 ? 430 THR A OG1 1 +ATOM 772 C CG2 . THR A 1 112 ? -84.464 -26.179 -1.077 1.00 46.72 ? 430 THR A CG2 1 +ATOM 773 N N . GLY A 1 113 ? -82.477 -24.699 3.037 1.00 49.75 ? 431 GLY A N 1 +ATOM 774 C CA . GLY A 1 113 ? -82.338 -24.576 4.471 1.00 46.44 ? 431 GLY A CA 1 +ATOM 775 C C . GLY A 1 113 ? -81.422 -23.418 4.807 1.00 46.26 ? 431 GLY A C 1 +ATOM 776 O O . GLY A 1 113 ? -81.158 -22.553 3.969 1.00 45.58 ? 431 GLY A O 1 +ATOM 777 N N . CYS A 1 114 ? -80.944 -23.414 6.053 1.00 37.32 ? 432 CYS A N 1 +ATOM 778 C CA . CYS A 1 114 ? -80.059 -22.354 6.513 1.00 35.74 ? 432 CYS A CA 1 +ATOM 779 C C . CYS A 1 114 ? -78.922 -22.950 7.320 1.00 37.88 ? 432 CYS A C 1 +ATOM 780 O O . CYS A 1 114 ? -79.105 -23.932 8.045 1.00 37.67 ? 432 CYS A O 1 +ATOM 781 C CB . CYS A 1 114 ? -80.793 -21.304 7.356 1.00 40.66 ? 432 CYS A CB 1 +ATOM 782 S SG . CYS A 1 114 ? -82.208 -20.541 6.519 1.00 57.69 ? 432 CYS A SG 1 +ATOM 783 N N . VAL A 1 115 ? -77.745 -22.357 7.171 1.00 35.62 ? 433 VAL A N 1 +ATOM 784 C CA . VAL A 1 115 ? -76.554 -22.758 7.904 1.00 28.39 ? 433 VAL A CA 1 +ATOM 785 C C . VAL A 1 115 ? -76.199 -21.617 8.840 1.00 31.41 ? 433 VAL A C 1 +ATOM 786 O O . VAL A 1 115 ? -76.067 -20.468 8.401 1.00 35.30 ? 433 VAL A O 1 +ATOM 787 C CB . VAL A 1 115 ? -75.384 -23.085 6.961 1.00 27.89 ? 433 VAL A CB 1 +ATOM 788 C CG1 . VAL A 1 115 ? -74.158 -23.457 7.773 1.00 27.45 ? 433 VAL A CG1 1 +ATOM 789 C CG2 . VAL A 1 115 ? -75.757 -24.207 6.014 1.00 33.25 ? 433 VAL A CG2 1 +ATOM 790 N N . ILE A 1 116 ? -76.058 -21.926 10.127 1.00 29.44 ? 434 ILE A N 1 +ATOM 791 C CA . ILE A 1 116 ? -75.856 -20.916 11.156 1.00 31.21 ? 434 ILE A CA 1 +ATOM 792 C C . ILE A 1 116 ? -74.631 -21.303 11.964 1.00 31.09 ? 434 ILE A C 1 +ATOM 793 O O . ILE A 1 116 ? -74.481 -22.470 12.344 1.00 32.96 ? 434 ILE A O 1 +ATOM 794 C CB . ILE A 1 116 ? -77.091 -20.774 12.064 1.00 33.39 ? 434 ILE A CB 1 +ATOM 795 C CG1 . ILE A 1 116 ? -78.329 -20.515 11.204 1.00 35.45 ? 434 ILE A CG1 1 +ATOM 796 C CG2 . ILE A 1 116 ? -76.901 -19.630 13.052 1.00 32.51 ? 434 ILE A CG2 1 +ATOM 797 C CD1 . ILE A 1 116 ? -79.633 -20.936 11.848 1.00 47.96 ? 434 ILE A CD1 1 +ATOM 798 N N . ALA A 1 117 ? -73.747 -20.340 12.212 1.00 30.36 ? 435 ALA A N 1 +ATOM 799 C CA . ALA A 1 117 ? -72.533 -20.683 12.941 1.00 28.67 ? 435 ALA A CA 1 +ATOM 800 C C . ALA A 1 117 ? -72.085 -19.499 13.777 1.00 27.55 ? 435 ALA A C 1 +ATOM 801 O O . ALA A 1 117 ? -72.425 -18.348 13.490 1.00 33.18 ? 435 ALA A O 1 +ATOM 802 C CB . ALA A 1 117 ? -71.403 -21.133 12.004 1.00 29.62 ? 435 ALA A CB 1 +ATOM 803 N N . TRP A 1 118 ? -71.331 -19.803 14.832 1.00 28.04 ? 436 TRP A N 1 +ATOM 804 C CA . TRP A 1 118 ? -70.813 -18.761 15.703 1.00 30.23 ? 436 TRP A CA 1 +ATOM 805 C C . TRP A 1 118 ? -69.569 -19.294 16.397 1.00 27.72 ? 436 TRP A C 1 +ATOM 806 O O . TRP A 1 118 ? -69.428 -20.498 16.614 1.00 29.52 ? 436 TRP A O 1 +ATOM 807 C CB . TRP A 1 118 ? -71.858 -18.294 16.728 1.00 33.37 ? 436 TRP A CB 1 +ATOM 808 C CG . TRP A 1 118 ? -72.299 -19.339 17.728 1.00 35.26 ? 436 TRP A CG 1 +ATOM 809 C CD1 . TRP A 1 118 ? -71.827 -19.512 19.001 1.00 36.63 ? 436 TRP A CD1 1 +ATOM 810 C CD2 . TRP A 1 118 ? -73.322 -20.329 17.543 1.00 30.80 ? 436 TRP A CD2 1 +ATOM 811 N NE1 . TRP A 1 118 ? -72.486 -20.556 19.616 1.00 34.86 ? 436 TRP A NE1 1 +ATOM 812 C CE2 . TRP A 1 118 ? -73.416 -21.066 18.746 1.00 34.86 ? 436 TRP A CE2 1 +ATOM 813 C CE3 . TRP A 1 118 ? -74.172 -20.660 16.480 1.00 31.96 ? 436 TRP A CE3 1 +ATOM 814 C CZ2 . TRP A 1 118 ? -74.322 -22.118 18.914 1.00 36.76 ? 436 TRP A CZ2 1 +ATOM 815 C CZ3 . TRP A 1 118 ? -75.081 -21.706 16.652 1.00 36.02 ? 436 TRP A CZ3 1 +ATOM 816 C CH2 . TRP A 1 118 ? -75.138 -22.426 17.857 1.00 37.95 ? 436 TRP A CH2 1 +ATOM 817 N N . ASN A 1 119 ? -68.661 -18.382 16.718 1.00 31.50 ? 437 ASN A N 1 +ATOM 818 C CA . ASN A 1 119 ? -67.426 -18.757 17.392 1.00 31.35 ? 437 ASN A CA 1 +ATOM 819 C C . ASN A 1 119 ? -67.739 -19.261 18.795 1.00 33.13 ? 437 ASN A C 1 +ATOM 820 O O . ASN A 1 119 ? -68.509 -18.634 19.526 1.00 31.71 ? 437 ASN A O 1 +ATOM 821 C CB . ASN A 1 119 ? -66.494 -17.545 17.442 1.00 31.74 ? 437 ASN A CB 1 +ATOM 822 C CG . ASN A 1 119 ? -65.142 -17.877 18.011 1.00 32.49 ? 437 ASN A CG 1 +ATOM 823 O OD1 . ASN A 1 119 ? -65.024 -18.185 19.195 1.00 32.04 ? 437 ASN A OD1 1 +ATOM 824 N ND2 . ASN A 1 119 ? -64.103 -17.796 17.175 1.00 28.45 ? 437 ASN A ND2 1 +ATOM 825 N N . SER A 1 120 ? -67.157 -20.401 19.177 1.00 29.60 ? 438 SER A N 1 +ATOM 826 C CA . SER A 1 120 ? -67.376 -20.968 20.508 1.00 31.20 ? 438 SER A CA 1 +ATOM 827 C C . SER A 1 120 ? -66.062 -21.191 21.252 1.00 32.87 ? 438 SER A C 1 +ATOM 828 O O . SER A 1 120 ? -65.956 -22.109 22.068 1.00 28.86 ? 438 SER A O 1 +ATOM 829 C CB . SER A 1 120 ? -68.158 -22.279 20.433 1.00 27.19 ? 438 SER A CB 1 +ATOM 830 O OG . SER A 1 120 ? -67.433 -23.271 19.706 1.00 33.11 ? 438 SER A OG 1 +ATOM 831 N N . ASN A 1 121 ? -65.063 -20.341 20.987 1.00 31.77 ? 439 ASN A N 1 +ATOM 832 C CA . ASN A 1 121 ? -63.770 -20.466 21.659 1.00 26.58 ? 439 ASN A CA 1 +ATOM 833 C C . ASN A 1 121 ? -63.915 -20.411 23.178 1.00 32.19 ? 439 ASN A C 1 +ATOM 834 O O . ASN A 1 121 ? -63.202 -21.115 23.901 1.00 33.89 ? 439 ASN A O 1 +ATOM 835 C CB . ASN A 1 121 ? -62.829 -19.361 21.175 1.00 27.45 ? 439 ASN A CB 1 +ATOM 836 C CG . ASN A 1 121 ? -61.372 -19.662 21.461 1.00 32.05 ? 439 ASN A CG 1 +ATOM 837 O OD1 . ASN A 1 121 ? -60.913 -20.794 21.302 1.00 29.03 ? 439 ASN A OD1 1 +ATOM 838 N ND2 . ASN A 1 121 ? -60.636 -18.640 21.886 1.00 33.96 ? 439 ASN A ND2 1 +ATOM 839 N N . ASN A 1 122 ? -64.836 -19.589 23.686 1.00 31.90 ? 440 ASN A N 1 +ATOM 840 C CA . ASN A 1 122 ? -64.942 -19.443 25.131 1.00 36.02 ? 440 ASN A CA 1 +ATOM 841 C C . ASN A 1 122 ? -65.593 -20.645 25.803 1.00 39.29 ? 440 ASN A C 1 +ATOM 842 O O . ASN A 1 122 ? -65.552 -20.739 27.030 1.00 44.65 ? 440 ASN A O 1 +ATOM 843 C CB . ASN A 1 122 ? -65.707 -18.156 25.480 1.00 42.88 ? 440 ASN A CB 1 +ATOM 844 C CG . ASN A 1 122 ? -67.137 -18.153 24.947 1.00 57.48 ? 440 ASN A CG 1 +ATOM 845 O OD1 . ASN A 1 122 ? -67.466 -18.860 23.987 1.00 47.86 ? 440 ASN A OD1 1 +ATOM 846 N ND2 . ASN A 1 122 ? -67.993 -17.343 25.564 1.00 69.32 ? 440 ASN A ND2 1 +ATOM 847 N N . LEU A 1 123 ? -66.174 -21.565 25.040 1.00 40.66 ? 441 LEU A N 1 +ATOM 848 C CA . LEU A 1 123 ? -66.839 -22.744 25.583 1.00 39.51 ? 441 LEU A CA 1 +ATOM 849 C C . LEU A 1 123 ? -66.144 -24.050 25.245 1.00 38.46 ? 441 LEU A C 1 +ATOM 850 O O . LEU A 1 123 ? -66.201 -24.989 26.043 1.00 34.28 ? 441 LEU A O 1 +ATOM 851 C CB . LEU A 1 123 ? -68.275 -22.833 25.053 1.00 45.10 ? 441 LEU A CB 1 +ATOM 852 C CG . LEU A 1 123 ? -69.207 -21.677 25.398 1.00 50.36 ? 441 LEU A CG 1 +ATOM 853 C CD1 . LEU A 1 123 ? -70.587 -21.942 24.819 1.00 45.73 ? 441 LEU A CD1 1 +ATOM 854 C CD2 . LEU A 1 123 ? -69.268 -21.505 26.900 1.00 51.45 ? 441 LEU A CD2 1 +ATOM 855 N N . ASP A 1 124 ? -65.502 -24.131 24.080 1.00 27.59 ? 442 ASP A N 1 +ATOM 856 C CA . ASP A 1 124 ? -65.027 -25.391 23.531 1.00 23.97 ? 442 ASP A CA 1 +ATOM 857 C C . ASP A 1 124 ? -63.504 -25.501 23.436 1.00 30.98 ? 442 ASP A C 1 +ATOM 858 O O . ASP A 1 124 ? -63.007 -26.573 23.080 1.00 30.39 ? 442 ASP A O 1 +ATOM 859 C CB . ASP A 1 124 ? -65.648 -25.627 22.139 1.00 25.98 ? 442 ASP A CB 1 +ATOM 860 C CG . ASP A 1 124 ? -67.156 -25.900 22.206 1.00 33.15 ? 442 ASP A CG 1 +ATOM 861 O OD1 . ASP A 1 124 ? -67.585 -26.621 23.134 1.00 30.30 ? 442 ASP A OD1 1 +ATOM 862 O OD2 . ASP A 1 124 ? -67.910 -25.410 21.329 1.00 30.62 ? 442 ASP A OD2 1 +ATOM 863 N N . SER A 1 125 ? -62.758 -24.438 23.728 1.00 29.77 ? 443 SER A N 1 +ATOM 864 C CA . SER A 1 125 ? -61.309 -24.519 23.846 1.00 28.85 ? 443 SER A CA 1 +ATOM 865 C C . SER A 1 125 ? -60.948 -24.695 25.309 1.00 31.68 ? 443 SER A C 1 +ATOM 866 O O . SER A 1 125 ? -61.701 -24.286 26.192 1.00 30.68 ? 443 SER A O 1 +ATOM 867 C CB . SER A 1 125 ? -60.634 -23.253 23.317 1.00 35.51 ? 443 SER A CB 1 +ATOM 868 O OG . SER A 1 125 ? -60.865 -23.111 21.931 1.00 44.54 ? 443 SER A OG 1 +ATOM 869 N N . LYS A 1 126 ? -59.781 -25.292 25.562 1.00 27.10 ? 444 LYS A N 1 +ATOM 870 C CA . LYS A 1 126 ? -59.276 -25.446 26.920 1.00 32.70 ? 444 LYS A CA 1 +ATOM 871 C C . LYS A 1 126 ? -57.772 -25.227 26.918 1.00 28.77 ? 444 LYS A C 1 +ATOM 872 O O . LYS A 1 126 ? -57.093 -25.584 25.953 1.00 28.99 ? 444 LYS A O 1 +ATOM 873 C CB . LYS A 1 126 ? -59.602 -26.841 27.495 1.00 41.71 ? 444 LYS A CB 1 +ATOM 874 C CG . LYS A 1 126 ? -61.092 -27.092 27.713 1.00 64.73 ? 444 LYS A CG 1 +ATOM 875 C CD . LYS A 1 126 ? -61.365 -28.466 28.317 1.00 81.72 ? 444 LYS A CD 1 +ATOM 876 C CE . LYS A 1 126 ? -62.717 -29.011 27.855 1.00 86.63 ? 444 LYS A CE 1 +ATOM 877 N NZ . LYS A 1 126 ? -62.853 -30.482 28.072 1.00 86.42 ? 444 LYS A NZ 1 +ATOM 878 N N . VAL A 1 127 ? -57.264 -24.630 27.997 1.00 30.78 ? 445 VAL A N 1 +ATOM 879 C CA . VAL A 1 127 ? -55.821 -24.547 28.180 1.00 33.25 ? 445 VAL A CA 1 +ATOM 880 C C . VAL A 1 127 ? -55.239 -25.952 28.183 1.00 39.38 ? 445 VAL A C 1 +ATOM 881 O O . VAL A 1 127 ? -55.733 -26.847 28.882 1.00 39.05 ? 445 VAL A O 1 +ATOM 882 C CB . VAL A 1 127 ? -55.487 -23.801 29.478 1.00 33.75 ? 445 VAL A CB 1 +ATOM 883 C CG1 . VAL A 1 127 ? -53.998 -23.874 29.750 1.00 35.55 ? 445 VAL A CG1 1 +ATOM 884 C CG2 . VAL A 1 127 ? -55.972 -22.360 29.406 1.00 37.71 ? 445 VAL A CG2 1 +ATOM 885 N N . GLY A 1 128 ? -54.168 -26.148 27.415 1.00 34.30 ? 446 GLY A N 1 +ATOM 886 C CA . GLY A 1 128 ? -53.612 -27.467 27.198 1.00 33.66 ? 446 GLY A CA 1 +ATOM 887 C C . GLY A 1 128 ? -54.312 -28.254 26.120 1.00 39.94 ? 446 GLY A C 1 +ATOM 888 O O . GLY A 1 128 ? -53.839 -29.335 25.751 1.00 39.18 ? 446 GLY A O 1 +ATOM 889 N N . GLY A 1 129 ? -55.425 -27.751 25.605 1.00 31.31 ? 447 GLY A N 1 +ATOM 890 C CA . GLY A 1 129 ? -56.102 -28.382 24.495 1.00 32.86 ? 447 GLY A CA 1 +ATOM 891 C C . GLY A 1 129 ? -57.337 -29.153 24.906 1.00 41.60 ? 447 GLY A C 1 +ATOM 892 O O . GLY A 1 129 ? -57.291 -29.973 25.827 1.00 39.68 ? 447 GLY A O 1 +ATOM 893 N N . ASN A 1 130 ? -58.455 -28.892 24.235 1.00 35.65 ? 448 ASN A N 1 +ATOM 894 C CA . ASN A 1 130 ? -59.649 -29.722 24.374 1.00 38.59 ? 448 ASN A CA 1 +ATOM 895 C C . ASN A 1 130 ? -59.602 -30.762 23.265 1.00 38.78 ? 448 ASN A C 1 +ATOM 896 O O . ASN A 1 130 ? -59.679 -30.416 22.086 1.00 42.28 ? 448 ASN A O 1 +ATOM 897 C CB . ASN A 1 130 ? -60.924 -28.888 24.281 1.00 40.18 ? 448 ASN A CB 1 +ATOM 898 C CG . ASN A 1 130 ? -62.181 -29.738 24.377 1.00 43.82 ? 448 ASN A CG 1 +ATOM 899 O OD1 . ASN A 1 130 ? -62.125 -30.910 24.764 1.00 38.30 ? 448 ASN A OD1 1 +ATOM 900 N ND2 . ASN A 1 130 ? -63.325 -29.148 24.038 1.00 40.50 ? 448 ASN A ND2 1 +ATOM 901 N N . TYR A 1 131 ? -59.470 -32.031 23.635 1.00 36.66 ? 449 TYR A N 1 +ATOM 902 C CA . TYR A 1 131 ? -59.353 -33.096 22.650 1.00 43.33 ? 449 TYR A CA 1 +ATOM 903 C C . TYR A 1 131 ? -60.637 -33.907 22.491 1.00 38.70 ? 449 TYR A C 1 +ATOM 904 O O . TYR A 1 131 ? -60.632 -34.931 21.802 1.00 46.39 ? 449 TYR A O 1 +ATOM 905 C CB . TYR A 1 131 ? -58.180 -34.008 23.009 1.00 48.25 ? 449 TYR A CB 1 +ATOM 906 C CG . TYR A 1 131 ? -56.859 -33.281 22.948 1.00 56.11 ? 449 TYR A CG 1 +ATOM 907 C CD1 . TYR A 1 131 ? -56.200 -33.099 21.738 1.00 51.72 ? 449 TYR A CD1 1 +ATOM 908 C CD2 . TYR A 1 131 ? -56.286 -32.749 24.096 1.00 58.66 ? 449 TYR A CD2 1 +ATOM 909 C CE1 . TYR A 1 131 ? -55.002 -32.420 21.676 1.00 59.55 ? 449 TYR A CE1 1 +ATOM 910 C CE2 . TYR A 1 131 ? -55.086 -32.070 24.043 1.00 61.75 ? 449 TYR A CE2 1 +ATOM 911 C CZ . TYR A 1 131 ? -54.451 -31.907 22.833 1.00 64.43 ? 449 TYR A CZ 1 +ATOM 912 O OH . TYR A 1 131 ? -53.258 -31.232 22.784 1.00 70.98 ? 449 TYR A OH 1 +ATOM 913 N N . ASN A 1 132 ? -61.741 -33.449 23.076 1.00 31.92 ? 450 ASN A N 1 +ATOM 914 C CA . ASN A 1 132 ? -62.988 -34.199 23.004 1.00 34.09 ? 450 ASN A CA 1 +ATOM 915 C C . ASN A 1 132 ? -63.632 -34.123 21.616 1.00 35.93 ? 450 ASN A C 1 +ATOM 916 O O . ASN A 1 132 ? -64.376 -35.033 21.238 1.00 35.78 ? 450 ASN A O 1 +ATOM 917 C CB . ASN A 1 132 ? -63.955 -33.690 24.067 1.00 41.46 ? 450 ASN A CB 1 +ATOM 918 C CG . ASN A 1 132 ? -63.456 -33.948 25.483 1.00 56.51 ? 450 ASN A CG 1 +ATOM 919 O OD1 . ASN A 1 132 ? -62.700 -34.891 25.724 1.00 62.77 ? 450 ASN A OD1 1 +ATOM 920 N ND2 . ASN A 1 132 ? -63.870 -33.102 26.423 1.00 55.49 ? 450 ASN A ND2 1 +ATOM 921 N N . TYR A 1 133 ? -63.375 -33.063 20.848 1.00 24.95 ? 451 TYR A N 1 +ATOM 922 C CA . TYR A 1 133 ? -63.996 -32.899 19.531 1.00 22.78 ? 451 TYR A CA 1 +ATOM 923 C C . TYR A 1 133 ? -63.132 -33.553 18.460 1.00 29.63 ? 451 TYR A C 1 +ATOM 924 O O . TYR A 1 133 ? -61.962 -33.190 18.295 1.00 30.15 ? 451 TYR A O 1 +ATOM 925 C CB . TYR A 1 133 ? -64.204 -31.422 19.194 1.00 22.85 ? 451 TYR A CB 1 +ATOM 926 C CG . TYR A 1 133 ? -65.324 -30.781 19.990 1.00 28.09 ? 451 TYR A CG 1 +ATOM 927 C CD1 . TYR A 1 133 ? -66.658 -31.081 19.716 1.00 24.54 ? 451 TYR A CD1 1 +ATOM 928 C CD2 . TYR A 1 133 ? -65.045 -29.897 21.020 1.00 27.08 ? 451 TYR A CD2 1 +ATOM 929 C CE1 . TYR A 1 133 ? -67.699 -30.493 20.456 1.00 24.94 ? 451 TYR A CE1 1 +ATOM 930 C CE2 . TYR A 1 133 ? -66.073 -29.299 21.770 1.00 28.50 ? 451 TYR A CE2 1 +ATOM 931 C CZ . TYR A 1 133 ? -67.398 -29.605 21.473 1.00 27.03 ? 451 TYR A CZ 1 +ATOM 932 O OH . TYR A 1 133 ? -68.412 -29.021 22.196 1.00 28.59 ? 451 TYR A OH 1 +ATOM 933 N N . LEU A 1 134 ? -63.727 -34.477 17.705 1.00 26.95 ? 452 LEU A N 1 +ATOM 934 C CA . LEU A 1 134 ? -63.049 -35.245 16.675 1.00 26.40 ? 452 LEU A CA 1 +ATOM 935 C C . LEU A 1 134 ? -63.654 -34.982 15.302 1.00 28.00 ? 452 LEU A C 1 +ATOM 936 O O . LEU A 1 134 ? -64.790 -34.524 15.168 1.00 25.91 ? 452 LEU A O 1 +ATOM 937 C CB . LEU A 1 134 ? -63.126 -36.749 16.959 1.00 27.48 ? 452 LEU A CB 1 +ATOM 938 C CG . LEU A 1 134 ? -62.980 -37.159 18.419 1.00 32.18 ? 452 LEU A CG 1 +ATOM 939 C CD1 . LEU A 1 134 ? -63.272 -38.648 18.575 1.00 32.73 ? 452 LEU A CD1 1 +ATOM 940 C CD2 . LEU A 1 134 ? -61.567 -36.820 18.865 1.00 31.77 ? 452 LEU A CD2 1 +ATOM 941 N N . TYR A 1 135 ? -62.872 -35.291 14.275 1.00 21.64 ? 453 TYR A N 1 +ATOM 942 C CA . TYR A 1 135 ? -63.380 -35.366 12.910 1.00 22.55 ? 453 TYR A CA 1 +ATOM 943 C C . TYR A 1 135 ? -62.776 -36.600 12.245 1.00 25.46 ? 453 TYR A C 1 +ATOM 944 O O . TYR A 1 135 ? -61.733 -37.106 12.668 1.00 24.08 ? 453 TYR A O 1 +ATOM 945 C CB . TYR A 1 135 ? -63.052 -34.095 12.111 1.00 22.18 ? 453 TYR A CB 1 +ATOM 946 C CG . TYR A 1 135 ? -61.563 -33.870 11.923 1.00 20.88 ? 453 TYR A CG 1 +ATOM 947 C CD1 . TYR A 1 135 ? -60.800 -33.258 12.918 1.00 21.88 ? 453 TYR A CD1 1 +ATOM 948 C CD2 . TYR A 1 135 ? -60.919 -34.298 10.766 1.00 30.48 ? 453 TYR A CD2 1 +ATOM 949 C CE1 . TYR A 1 135 ? -59.426 -33.050 12.747 1.00 30.03 ? 453 TYR A CE1 1 +ATOM 950 C CE2 . TYR A 1 135 ? -59.556 -34.110 10.591 1.00 34.18 ? 453 TYR A CE2 1 +ATOM 951 C CZ . TYR A 1 135 ? -58.817 -33.490 11.582 1.00 37.62 ? 453 TYR A CZ 1 +ATOM 952 O OH . TYR A 1 135 ? -57.467 -33.300 11.400 1.00 46.02 ? 453 TYR A OH 1 +ATOM 953 N N . ARG A 1 136 ? -63.449 -37.088 11.206 1.00 21.93 ? 454 ARG A N 1 +ATOM 954 C CA . ARG A 1 136 ? -62.949 -38.218 10.436 1.00 20.85 ? 454 ARG A CA 1 +ATOM 955 C C . ARG A 1 136 ? -61.918 -37.711 9.439 1.00 23.06 ? 454 ARG A C 1 +ATOM 956 O O . ARG A 1 136 ? -62.222 -36.864 8.595 1.00 21.02 ? 454 ARG A O 1 +ATOM 957 C CB . ARG A 1 136 ? -64.079 -38.956 9.714 1.00 23.14 ? 454 ARG A CB 1 +ATOM 958 C CG . ARG A 1 136 ? -63.589 -40.233 9.014 1.00 23.33 ? 454 ARG A CG 1 +ATOM 959 C CD . ARG A 1 136 ? -64.727 -41.063 8.433 1.00 21.74 ? 454 ARG A CD 1 +ATOM 960 N NE . ARG A 1 136 ? -65.684 -41.367 9.493 1.00 22.61 ? 454 ARG A NE 1 +ATOM 961 C CZ . ARG A 1 136 ? -65.549 -42.366 10.360 1.00 28.23 ? 454 ARG A CZ 1 +ATOM 962 N NH1 . ARG A 1 136 ? -64.512 -43.199 10.273 1.00 23.84 ? 454 ARG A NH1 1 +ATOM 963 N NH2 . ARG A 1 136 ? -66.453 -42.538 11.319 1.00 27.14 ? 454 ARG A NH2 1 +ATOM 964 N N . LEU A 1 137 ? -60.698 -38.226 9.548 1.00 20.07 ? 455 LEU A N 1 +ATOM 965 C CA . LEU A 1 137 ? -59.596 -37.837 8.680 1.00 19.28 ? 455 LEU A CA 1 +ATOM 966 C C . LEU A 1 137 ? -59.380 -38.800 7.519 1.00 22.77 ? 455 LEU A C 1 +ATOM 967 O O . LEU A 1 137 ? -58.998 -38.361 6.423 1.00 24.21 ? 455 LEU A O 1 +ATOM 968 C CB . LEU A 1 137 ? -58.305 -37.738 9.512 1.00 22.33 ? 455 LEU A CB 1 +ATOM 969 C CG . LEU A 1 137 ? -56.978 -37.496 8.791 1.00 24.46 ? 455 LEU A CG 1 +ATOM 970 C CD1 . LEU A 1 137 ? -56.987 -36.169 8.059 1.00 26.73 ? 455 LEU A CD1 1 +ATOM 971 C CD2 . LEU A 1 137 ? -55.835 -37.555 9.814 1.00 27.73 ? 455 LEU A CD2 1 +ATOM 972 N N . PHE A 1 138 ? -59.612 -40.097 7.722 1.00 21.01 ? 456 PHE A N 1 +ATOM 973 C CA . PHE A 1 138 ? -59.399 -41.104 6.688 1.00 25.15 ? 456 PHE A CA 1 +ATOM 974 C C . PHE A 1 138 ? -60.722 -41.752 6.310 1.00 23.72 ? 456 PHE A C 1 +ATOM 975 O O . PHE A 1 138 ? -61.445 -42.266 7.179 1.00 25.92 ? 456 PHE A O 1 +ATOM 976 C CB . PHE A 1 138 ? -58.411 -42.180 7.158 1.00 24.58 ? 456 PHE A CB 1 +ATOM 977 C CG . PHE A 1 138 ? -57.049 -41.639 7.479 1.00 24.57 ? 456 PHE A CG 1 +ATOM 978 C CD1 . PHE A 1 138 ? -56.171 -41.288 6.462 1.00 24.37 ? 456 PHE A CD1 1 +ATOM 979 C CD2 . PHE A 1 138 ? -56.660 -41.452 8.797 1.00 24.71 ? 456 PHE A CD2 1 +ATOM 980 C CE1 . PHE A 1 138 ? -54.924 -40.782 6.753 1.00 25.13 ? 456 PHE A CE1 1 +ATOM 981 C CE2 . PHE A 1 138 ? -55.420 -40.939 9.102 1.00 25.34 ? 456 PHE A CE2 1 +ATOM 982 C CZ . PHE A 1 138 ? -54.548 -40.603 8.081 1.00 23.91 ? 456 PHE A CZ 1 +ATOM 983 N N . ARG A 1 139 ? -61.014 -41.757 5.012 1.00 24.68 ? 457 ARG A N 1 +ATOM 984 C CA . ARG A 1 139 ? -62.190 -42.444 4.495 1.00 26.09 ? 457 ARG A CA 1 +ATOM 985 C C . ARG A 1 139 ? -61.970 -42.715 3.012 1.00 25.12 ? 457 ARG A C 1 +ATOM 986 O O . ARG A 1 139 ? -61.427 -41.873 2.296 1.00 25.20 ? 457 ARG A O 1 +ATOM 987 C CB . ARG A 1 139 ? -63.474 -41.625 4.720 1.00 24.53 ? 457 ARG A CB 1 +ATOM 988 C CG . ARG A 1 139 ? -64.737 -42.502 4.690 1.00 25.73 ? 457 ARG A CG 1 +ATOM 989 C CD . ARG A 1 139 ? -66.041 -41.691 4.818 1.00 26.06 ? 457 ARG A CD 1 +ATOM 990 N NE . ARG A 1 139 ? -67.161 -42.577 5.140 1.00 27.19 ? 457 ARG A NE 1 +ATOM 991 C CZ . ARG A 1 139 ? -68.020 -43.097 4.265 1.00 31.09 ? 457 ARG A CZ 1 +ATOM 992 N NH1 . ARG A 1 139 ? -67.921 -42.839 2.968 1.00 30.18 ? 457 ARG A NH1 1 +ATOM 993 N NH2 . ARG A 1 139 ? -68.993 -43.887 4.697 1.00 26.41 ? 457 ARG A NH2 1 +ATOM 994 N N . LYS A 1 140 ? -62.387 -43.898 2.558 1.00 24.03 ? 458 LYS A N 1 +ATOM 995 C CA . LYS A 1 140 ? -62.075 -44.299 1.190 1.00 27.52 ? 458 LYS A CA 1 +ATOM 996 C C . LYS A 1 140 ? -62.887 -43.498 0.172 1.00 27.39 ? 458 LYS A C 1 +ATOM 997 O O . LYS A 1 140 ? -62.377 -43.149 -0.896 1.00 28.54 ? 458 LYS A O 1 +ATOM 998 C CB . LYS A 1 140 ? -62.318 -45.802 1.023 1.00 32.35 ? 458 LYS A CB 1 +ATOM 999 C CG . LYS A 1 140 ? -62.063 -46.339 -0.378 1.00 50.08 ? 458 LYS A CG 1 +ATOM 1000 C CD . LYS A 1 140 ? -60.590 -46.210 -0.796 1.00 57.89 ? 458 LYS A CD 1 +ATOM 1001 C CE . LYS A 1 140 ? -60.290 -47.043 -2.055 1.00 54.23 ? 458 LYS A CE 1 +ATOM 1002 N NZ . LYS A 1 140 ? -58.859 -46.972 -2.498 1.00 37.06 ? 458 LYS A NZ 1 +ATOM 1003 N N A SER A 1 141 ? -64.140 -43.182 0.491 0.60 25.95 ? 459 SER A N 1 +ATOM 1004 N N B SER A 1 141 ? -64.145 -43.196 0.483 0.40 26.06 ? 459 SER A N 1 +ATOM 1005 C CA A SER A 1 141 ? -65.022 -42.501 -0.449 0.60 26.01 ? 459 SER A CA 1 +ATOM 1006 C CA B SER A 1 141 ? -65.025 -42.500 -0.447 0.40 26.27 ? 459 SER A CA 1 +ATOM 1007 C C A SER A 1 141 ? -65.763 -41.382 0.271 0.60 26.16 ? 459 SER A C 1 +ATOM 1008 C C B SER A 1 141 ? -65.750 -41.372 0.274 0.40 26.19 ? 459 SER A C 1 +ATOM 1009 O O A SER A 1 141 ? -65.858 -41.365 1.501 0.60 26.95 ? 459 SER A O 1 +ATOM 1010 O O B SER A 1 141 ? -65.823 -41.338 1.505 0.40 26.44 ? 459 SER A O 1 +ATOM 1011 C CB A SER A 1 141 ? -66.025 -43.474 -1.080 0.60 28.55 ? 459 SER A CB 1 +ATOM 1012 C CB B SER A 1 141 ? -66.045 -43.457 -1.080 0.40 28.33 ? 459 SER A CB 1 +ATOM 1013 O OG A SER A 1 141 ? -66.850 -44.047 -0.081 0.60 27.02 ? 459 SER A OG 1 +ATOM 1014 O OG B SER A 1 141 ? -65.403 -44.598 -1.615 0.40 26.97 ? 459 SER A OG 1 +ATOM 1015 N N . ASN A 1 142 ? -66.286 -40.441 -0.515 1.00 26.41 ? 460 ASN A N 1 +ATOM 1016 C CA . ASN A 1 142 ? -67.019 -39.311 0.043 1.00 23.40 ? 460 ASN A CA 1 +ATOM 1017 C C . ASN A 1 142 ? -68.363 -39.767 0.593 1.00 24.90 ? 460 ASN A C 1 +ATOM 1018 O O . ASN A 1 142 ? -68.973 -40.706 0.086 1.00 26.58 ? 460 ASN A O 1 +ATOM 1019 C CB . ASN A 1 142 ? -67.299 -38.243 -1.017 1.00 24.23 ? 460 ASN A CB 1 +ATOM 1020 C CG . ASN A 1 142 ? -66.049 -37.563 -1.539 1.00 32.36 ? 460 ASN A CG 1 +ATOM 1021 O OD1 . ASN A 1 142 ? -64.967 -37.710 -0.998 1.00 25.22 ? 460 ASN A OD1 1 +ATOM 1022 N ND2 . ASN A 1 142 ? -66.214 -36.795 -2.599 1.00 28.78 ? 460 ASN A ND2 1 +ATOM 1023 N N . LEU A 1 143 ? -68.834 -39.056 1.614 1.00 22.43 ? 461 LEU A N 1 +ATOM 1024 C CA . LEU A 1 143 ? -70.168 -39.285 2.155 1.00 25.84 ? 461 LEU A CA 1 +ATOM 1025 C C . LEU A 1 143 ? -71.234 -38.870 1.155 1.00 26.24 ? 461 LEU A C 1 +ATOM 1026 O O . LEU A 1 143 ? -71.057 -37.917 0.395 1.00 25.90 ? 461 LEU A O 1 +ATOM 1027 C CB . LEU A 1 143 ? -70.369 -38.470 3.432 1.00 26.53 ? 461 LEU A CB 1 +ATOM 1028 C CG . LEU A 1 143 ? -69.558 -38.860 4.664 1.00 30.38 ? 461 LEU A CG 1 +ATOM 1029 C CD1 . LEU A 1 143 ? -69.968 -37.947 5.811 1.00 25.96 ? 461 LEU A CD1 1 +ATOM 1030 C CD2 . LEU A 1 143 ? -69.826 -40.312 5.023 1.00 30.24 ? 461 LEU A CD2 1 +ATOM 1031 N N . LYS A 1 144 ? -72.363 -39.569 1.185 1.00 27.13 ? 462 LYS A N 1 +ATOM 1032 C CA . LYS A 1 144 ? -73.552 -39.062 0.526 1.00 27.32 ? 462 LYS A CA 1 +ATOM 1033 C C . LYS A 1 144 ? -74.135 -37.927 1.359 1.00 25.53 ? 462 LYS A C 1 +ATOM 1034 O O . LYS A 1 144 ? -73.824 -37.800 2.546 1.00 25.82 ? 462 LYS A O 1 +ATOM 1035 C CB . LYS A 1 144 ? -74.580 -40.181 0.358 1.00 32.01 ? 462 LYS A CB 1 +ATOM 1036 C CG . LYS A 1 144 ? -74.097 -41.359 -0.476 1.00 34.92 ? 462 LYS A CG 1 +ATOM 1037 C CD . LYS A 1 144 ? -75.183 -42.412 -0.585 1.00 45.36 ? 462 LYS A CD 1 +ATOM 1038 C CE . LYS A 1 144 ? -74.601 -43.794 -0.822 1.00 58.01 ? 462 LYS A CE 1 +ATOM 1039 N NZ . LYS A 1 144 ? -74.042 -43.923 -2.188 1.00 65.85 ? 462 LYS A NZ 1 +ATOM 1040 N N . PRO A 1 145 ? -74.991 -37.087 0.772 1.00 27.43 ? 463 PRO A N 1 +ATOM 1041 C CA . PRO A 1 145 ? -75.607 -36.012 1.559 1.00 31.81 ? 463 PRO A CA 1 +ATOM 1042 C C . PRO A 1 145 ? -76.375 -36.577 2.745 1.00 28.23 ? 463 PRO A C 1 +ATOM 1043 O O . PRO A 1 145 ? -77.086 -37.577 2.623 1.00 25.91 ? 463 PRO A O 1 +ATOM 1044 C CB . PRO A 1 145 ? -76.552 -35.330 0.558 1.00 35.13 ? 463 PRO A CB 1 +ATOM 1045 C CG . PRO A 1 145 ? -75.982 -35.666 -0.775 1.00 35.29 ? 463 PRO A CG 1 +ATOM 1046 C CD . PRO A 1 145 ? -75.432 -37.050 -0.632 1.00 29.26 ? 463 PRO A CD 1 +ATOM 1047 N N . PHE A 1 146 ? -76.193 -35.932 3.899 1.00 29.32 ? 464 PHE A N 1 +ATOM 1048 C CA . PHE A 1 146 ? -76.866 -36.286 5.149 1.00 31.45 ? 464 PHE A CA 1 +ATOM 1049 C C . PHE A 1 146 ? -76.515 -37.698 5.611 1.00 33.13 ? 464 PHE A C 1 +ATOM 1050 O O . PHE A 1 146 ? -77.280 -38.336 6.335 1.00 31.36 ? 464 PHE A O 1 +ATOM 1051 C CB . PHE A 1 146 ? -78.379 -36.109 5.029 1.00 31.67 ? 464 PHE A CB 1 +ATOM 1052 C CG . PHE A 1 146 ? -78.800 -34.688 4.802 1.00 29.66 ? 464 PHE A CG 1 +ATOM 1053 C CD1 . PHE A 1 146 ? -78.375 -33.679 5.660 1.00 32.28 ? 464 PHE A CD1 1 +ATOM 1054 C CD2 . PHE A 1 146 ? -79.625 -34.357 3.740 1.00 35.57 ? 464 PHE A CD2 1 +ATOM 1055 C CE1 . PHE A 1 146 ? -78.766 -32.365 5.458 1.00 34.85 ? 464 PHE A CE1 1 +ATOM 1056 C CE2 . PHE A 1 146 ? -80.022 -33.039 3.532 1.00 40.22 ? 464 PHE A CE2 1 +ATOM 1057 C CZ . PHE A 1 146 ? -79.584 -32.043 4.394 1.00 36.73 ? 464 PHE A CZ 1 +ATOM 1058 N N . GLU A 1 147 ? -75.351 -38.195 5.206 1.00 28.60 ? 465 GLU A N 1 +ATOM 1059 C CA . GLU A 1 147 ? -74.855 -39.466 5.715 1.00 27.39 ? 465 GLU A CA 1 +ATOM 1060 C C . GLU A 1 147 ? -74.050 -39.220 6.992 1.00 26.64 ? 465 GLU A C 1 +ATOM 1061 O O . GLU A 1 147 ? -73.376 -38.204 7.134 1.00 24.66 ? 465 GLU A O 1 +ATOM 1062 C CB . GLU A 1 147 ? -73.988 -40.173 4.657 1.00 25.94 ? 465 GLU A CB 1 +ATOM 1063 C CG . GLU A 1 147 ? -73.557 -41.587 5.030 1.00 32.85 ? 465 GLU A CG 1 +ATOM 1064 C CD . GLU A 1 147 ? -72.904 -42.351 3.873 1.00 38.48 ? 465 GLU A CD 1 +ATOM 1065 O OE1 . GLU A 1 147 ? -72.463 -41.719 2.888 1.00 32.85 ? 465 GLU A OE1 1 +ATOM 1066 O OE2 . GLU A 1 147 ? -72.838 -43.593 3.953 1.00 37.85 ? 465 GLU A OE2 1 +ATOM 1067 N N . ARG A 1 148 ? -74.124 -40.167 7.923 1.00 25.57 ? 466 ARG A N 1 +ATOM 1068 C CA . ARG A 1 148 ? -73.437 -40.056 9.208 1.00 22.47 ? 466 ARG A CA 1 +ATOM 1069 C C . ARG A 1 148 ? -72.693 -41.364 9.446 1.00 24.73 ? 466 ARG A C 1 +ATOM 1070 O O . ARG A 1 148 ? -73.327 -42.414 9.634 1.00 26.67 ? 466 ARG A O 1 +ATOM 1071 C CB . ARG A 1 148 ? -74.451 -39.781 10.326 1.00 26.56 ? 466 ARG A CB 1 +ATOM 1072 C CG . ARG A 1 148 ? -73.873 -39.577 11.727 1.00 25.60 ? 466 ARG A CG 1 +ATOM 1073 C CD . ARG A 1 148 ? -75.079 -39.306 12.670 1.00 35.45 ? 466 ARG A CD 1 +ATOM 1074 N NE . ARG A 1 148 ? -74.706 -39.196 14.074 1.00 42.15 ? 466 ARG A NE 1 +ATOM 1075 C CZ . ARG A 1 148 ? -74.667 -40.223 14.920 1.00 50.86 ? 466 ARG A CZ 1 +ATOM 1076 N NH1 . ARG A 1 148 ? -74.340 -40.026 16.191 1.00 44.47 ? 466 ARG A NH1 1 +ATOM 1077 N NH2 . ARG A 1 148 ? -74.967 -41.446 14.498 1.00 55.74 ? 466 ARG A NH2 1 +ATOM 1078 N N . ASP A 1 149 ? -71.357 -41.305 9.422 1.00 26.27 ? 467 ASP A N 1 +ATOM 1079 C CA . ASP A 1 149 ? -70.492 -42.476 9.574 1.00 27.16 ? 467 ASP A CA 1 +ATOM 1080 C C . ASP A 1 149 ? -69.861 -42.417 10.962 1.00 25.25 ? 467 ASP A C 1 +ATOM 1081 O O . ASP A 1 149 ? -69.074 -41.509 11.253 1.00 24.84 ? 467 ASP A O 1 +ATOM 1082 C CB . ASP A 1 149 ? -69.418 -42.484 8.478 1.00 25.51 ? 467 ASP A CB 1 +ATOM 1083 C CG . ASP A 1 149 ? -68.550 -43.737 8.495 1.00 30.53 ? 467 ASP A CG 1 +ATOM 1084 O OD1 . ASP A 1 149 ? -68.680 -44.572 9.415 1.00 28.68 ? 467 ASP A OD1 1 +ATOM 1085 O OD2 . ASP A 1 149 ? -67.724 -43.887 7.556 1.00 31.94 ? 467 ASP A OD2 1 +ATOM 1086 N N . ILE A 1 150 ? -70.192 -43.387 11.808 1.00 26.73 ? 468 ILE A N 1 +ATOM 1087 C CA . ILE A 1 150 ? -69.657 -43.438 13.162 1.00 25.46 ? 468 ILE A CA 1 +ATOM 1088 C C . ILE A 1 150 ? -68.680 -44.597 13.347 1.00 30.27 ? 468 ILE A C 1 +ATOM 1089 O O . ILE A 1 150 ? -68.313 -44.918 14.480 1.00 36.27 ? 468 ILE A O 1 +ATOM 1090 C CB . ILE A 1 150 ? -70.791 -43.488 14.197 1.00 28.23 ? 468 ILE A CB 1 +ATOM 1091 C CG1 . ILE A 1 150 ? -71.856 -44.500 13.774 1.00 34.58 ? 468 ILE A CG1 1 +ATOM 1092 C CG2 . ILE A 1 150 ? -71.410 -42.111 14.323 1.00 37.56 ? 468 ILE A CG2 1 +ATOM 1093 C CD1 . ILE A 1 150 ? -71.526 -45.930 14.123 1.00 41.06 ? 468 ILE A CD1 1 +ATOM 1094 N N . SER A 1 151 ? -68.250 -45.230 12.261 1.00 27.02 ? 469 SER A N 1 +ATOM 1095 C CA . SER A 1 151 ? -67.308 -46.340 12.356 1.00 33.98 ? 469 SER A CA 1 +ATOM 1096 C C . SER A 1 151 ? -65.986 -45.879 12.969 1.00 28.22 ? 469 SER A C 1 +ATOM 1097 O O . SER A 1 151 ? -65.529 -44.763 12.728 1.00 27.98 ? 469 SER A O 1 +ATOM 1098 C CB . SER A 1 151 ? -67.062 -46.920 10.959 1.00 34.86 ? 469 SER A CB 1 +ATOM 1099 O OG . SER A 1 151 ? -66.034 -47.891 10.977 1.00 44.74 ? 469 SER A OG 1 +ATOM 1100 N N . THR A 1 152 ? -65.357 -46.750 13.763 1.00 30.02 ? 470 THR A N 1 +ATOM 1101 C CA . THR A 1 152 ? -64.002 -46.485 14.240 1.00 32.33 ? 470 THR A CA 1 +ATOM 1102 C C . THR A 1 152 ? -63.047 -47.598 13.816 1.00 35.49 ? 470 THR A C 1 +ATOM 1103 O O . THR A 1 152 ? -62.038 -47.850 14.478 1.00 35.64 ? 470 THR A O 1 +ATOM 1104 C CB . THR A 1 152 ? -63.970 -46.305 15.756 1.00 33.38 ? 470 THR A CB 1 +ATOM 1105 O OG1 . THR A 1 152 ? -64.523 -47.467 16.375 1.00 33.48 ? 470 THR A OG1 1 +ATOM 1106 C CG2 . THR A 1 152 ? -64.753 -45.067 16.183 1.00 34.58 ? 470 THR A CG2 1 +ATOM 1107 N N . GLU A 1 153 ? -63.383 -48.289 12.733 1.00 29.02 ? 471 GLU A N 1 +ATOM 1108 C CA . GLU A 1 153 ? -62.531 -49.340 12.189 1.00 34.05 ? 471 GLU A CA 1 +ATOM 1109 C C . GLU A 1 153 ? -61.198 -48.755 11.731 1.00 27.31 ? 471 GLU A C 1 +ATOM 1110 O O . GLU A 1 153 ? -61.150 -47.669 11.151 1.00 26.26 ? 471 GLU A O 1 +ATOM 1111 C CB . GLU A 1 153 ? -63.242 -50.010 11.010 1.00 48.33 ? 471 GLU A CB 1 +ATOM 1112 C CG . GLU A 1 153 ? -62.376 -50.960 10.189 1.00 76.50 ? 471 GLU A CG 1 +ATOM 1113 C CD . GLU A 1 153 ? -63.136 -51.605 9.037 1.00 97.39 ? 471 GLU A CD 1 +ATOM 1114 O OE1 . GLU A 1 153 ? -64.075 -50.968 8.512 1.00 104.76 ? 471 GLU A OE1 1 +ATOM 1115 O OE2 . GLU A 1 153 ? -62.784 -52.740 8.647 1.00 103.50 ? 471 GLU A OE2 1 +ATOM 1116 N N . ILE A 1 154 ? -60.111 -49.501 11.946 1.00 25.55 ? 472 ILE A N 1 +ATOM 1117 C CA . ILE A 1 154 ? -58.806 -49.022 11.496 1.00 27.70 ? 472 ILE A CA 1 +ATOM 1118 C C . ILE A 1 154 ? -58.794 -48.892 9.979 1.00 27.29 ? 472 ILE A C 1 +ATOM 1119 O O . ILE A 1 154 ? -59.227 -49.794 9.250 1.00 30.17 ? 472 ILE A O 1 +ATOM 1120 C CB . ILE A 1 154 ? -57.683 -49.964 11.965 1.00 35.22 ? 472 ILE A CB 1 +ATOM 1121 C CG1 . ILE A 1 154 ? -57.690 -50.106 13.491 1.00 33.71 ? 472 ILE A CG1 1 +ATOM 1122 C CG2 . ILE A 1 154 ? -56.327 -49.467 11.437 1.00 29.25 ? 472 ILE A CG2 1 +ATOM 1123 C CD1 . ILE A 1 154 ? -57.663 -48.774 14.234 1.00 31.13 ? 472 ILE A CD1 1 +ATOM 1124 N N . TYR A 1 155 ? -58.246 -47.783 9.490 1.00 27.19 ? 473 TYR A N 1 +ATOM 1125 C CA . TYR A 1 155 ? -58.291 -47.462 8.072 1.00 21.02 ? 473 TYR A CA 1 +ATOM 1126 C C . TYR A 1 155 ? -57.132 -48.142 7.351 1.00 27.58 ? 473 TYR A C 1 +ATOM 1127 O O . TYR A 1 155 ? -55.966 -47.942 7.709 1.00 25.09 ? 473 TYR A O 1 +ATOM 1128 C CB . TYR A 1 155 ? -58.239 -45.950 7.877 1.00 21.72 ? 473 TYR A CB 1 +ATOM 1129 C CG . TYR A 1 155 ? -58.300 -45.545 6.428 1.00 21.85 ? 473 TYR A CG 1 +ATOM 1130 C CD1 . TYR A 1 155 ? -59.518 -45.489 5.761 1.00 24.12 ? 473 TYR A CD1 1 +ATOM 1131 C CD2 . TYR A 1 155 ? -57.131 -45.238 5.714 1.00 23.47 ? 473 TYR A CD2 1 +ATOM 1132 C CE1 . TYR A 1 155 ? -59.587 -45.105 4.430 1.00 26.20 ? 473 TYR A CE1 1 +ATOM 1133 C CE2 . TYR A 1 155 ? -57.184 -44.868 4.380 1.00 25.13 ? 473 TYR A CE2 1 +ATOM 1134 C CZ . TYR A 1 155 ? -58.419 -44.809 3.742 1.00 29.38 ? 473 TYR A CZ 1 +ATOM 1135 O OH . TYR A 1 155 ? -58.497 -44.445 2.418 1.00 26.92 ? 473 TYR A OH 1 +ATOM 1136 N N . GLN A 1 156 ? -57.452 -48.932 6.332 1.00 23.00 ? 474 GLN A N 1 +ATOM 1137 C CA . GLN A 1 156 ? -56.473 -49.746 5.618 1.00 23.58 ? 474 GLN A CA 1 +ATOM 1138 C C . GLN A 1 156 ? -55.992 -48.964 4.397 1.00 33.33 ? 474 GLN A C 1 +ATOM 1139 O O . GLN A 1 156 ? -56.697 -48.860 3.390 1.00 29.48 ? 474 GLN A O 1 +ATOM 1140 C CB . GLN A 1 156 ? -57.091 -51.085 5.235 1.00 26.84 ? 474 GLN A CB 1 +ATOM 1141 C CG . GLN A 1 156 ? -56.113 -52.049 4.595 1.00 29.40 ? 474 GLN A CG 1 +ATOM 1142 C CD . GLN A 1 156 ? -56.766 -53.337 4.159 1.00 32.84 ? 474 GLN A CD 1 +ATOM 1143 O OE1 . GLN A 1 156 ? -57.692 -53.833 4.807 1.00 30.99 ? 474 GLN A OE1 1 +ATOM 1144 N NE2 . GLN A 1 156 ? -56.287 -53.891 3.053 1.00 34.45 ? 474 GLN A NE2 1 +ATOM 1145 N N . ALA A 1 157 ? -54.780 -48.418 4.473 1.00 27.92 ? 475 ALA A N 1 +ATOM 1146 C CA . ALA A 1 157 ? -54.238 -47.579 3.407 1.00 25.25 ? 475 ALA A CA 1 +ATOM 1147 C C . ALA A 1 157 ? -53.340 -48.336 2.438 1.00 24.02 ? 475 ALA A C 1 +ATOM 1148 O O . ALA A 1 157 ? -52.815 -47.726 1.500 1.00 26.63 ? 475 ALA A O 1 +ATOM 1149 C CB . ALA A 1 157 ? -53.466 -46.394 4.010 1.00 26.16 ? 475 ALA A CB 1 +ATOM 1150 N N . GLY A 1 158 ? -53.133 -49.641 2.641 1.00 24.01 ? 476 GLY A N 1 +ATOM 1151 C CA . GLY A 1 158 ? -52.366 -50.469 1.720 1.00 22.80 ? 476 GLY A CA 1 +ATOM 1152 C C . GLY A 1 158 ? -53.059 -51.807 1.533 1.00 26.21 ? 476 GLY A C 1 +ATOM 1153 O O . GLY A 1 158 ? -54.215 -51.958 1.942 1.00 30.68 ? 476 GLY A O 1 +ATOM 1154 N N . SER A 1 159 ? -52.373 -52.788 0.954 1.00 30.82 ? 477 SER A N 1 +ATOM 1155 C CA A SER A 1 159 ? -52.972 -54.090 0.687 0.67 34.17 ? 477 SER A CA 1 +ATOM 1156 C CA B SER A 1 159 ? -52.991 -54.081 0.693 0.33 34.43 ? 477 SER A CA 1 +ATOM 1157 C C . SER A 1 159 ? -52.958 -55.015 1.896 1.00 37.41 ? 477 SER A C 1 +ATOM 1158 O O . SER A 1 159 ? -53.597 -56.068 1.850 1.00 38.94 ? 477 SER A O 1 +ATOM 1159 C CB A SER A 1 159 ? -52.251 -54.775 -0.481 0.67 37.11 ? 477 SER A CB 1 +ATOM 1160 C CB B SER A 1 159 ? -52.310 -54.759 -0.499 0.33 36.91 ? 477 SER A CB 1 +ATOM 1161 O OG A SER A 1 159 ? -50.902 -55.064 -0.146 0.67 38.93 ? 477 SER A OG 1 +ATOM 1162 O OG B SER A 1 159 ? -52.327 -53.913 -1.636 0.33 36.46 ? 477 SER A OG 1 +ATOM 1163 N N . THR A 1 160 ? -52.239 -54.657 2.977 1.00 35.03 ? 478 THR A N 1 +ATOM 1164 C CA . THR A 1 160 ? -52.175 -55.573 4.112 1.00 37.26 ? 478 THR A CA 1 +ATOM 1165 C C . THR A 1 160 ? -53.297 -55.266 5.099 1.00 30.16 ? 478 THR A C 1 +ATOM 1166 O O . THR A 1 160 ? -53.470 -54.104 5.490 1.00 27.34 ? 478 THR A O 1 +ATOM 1167 C CB . THR A 1 160 ? -50.831 -55.480 4.825 1.00 39.66 ? 478 THR A CB 1 +ATOM 1168 O OG1 . THR A 1 160 ? -49.770 -55.733 3.895 1.00 43.22 ? 478 THR A OG1 1 +ATOM 1169 C CG2 . THR A 1 160 ? -50.760 -56.508 5.954 1.00 40.29 ? 478 THR A CG2 1 +ATOM 1170 N N . PRO A 1 161 ? -54.069 -56.265 5.524 1.00 34.92 ? 479 PRO A N 1 +ATOM 1171 C CA . PRO A 1 161 ? -55.131 -56.005 6.502 1.00 34.16 ? 479 PRO A CA 1 +ATOM 1172 C C . PRO A 1 161 ? -54.550 -55.514 7.821 1.00 31.96 ? 479 PRO A C 1 +ATOM 1173 O O . PRO A 1 161 ? -53.448 -55.895 8.222 1.00 34.58 ? 479 PRO A O 1 +ATOM 1174 C CB . PRO A 1 161 ? -55.813 -57.371 6.658 1.00 46.44 ? 479 PRO A CB 1 +ATOM 1175 C CG . PRO A 1 161 ? -55.443 -58.126 5.408 1.00 50.66 ? 479 PRO A CG 1 +ATOM 1176 C CD . PRO A 1 161 ? -54.072 -57.659 5.046 1.00 44.90 ? 479 PRO A CD 1 +ATOM 1177 N N . CYS A 1 162 ? -55.304 -54.650 8.496 1.00 29.33 ? 480 CYS A N 1 +ATOM 1178 C CA . CYS A 1 162 ? -54.814 -54.063 9.736 1.00 36.47 ? 480 CYS A CA 1 +ATOM 1179 C C . CYS A 1 162 ? -55.111 -54.912 10.968 1.00 37.90 ? 480 CYS A C 1 +ATOM 1180 O O . CYS A 1 162 ? -54.379 -54.816 11.961 1.00 33.04 ? 480 CYS A O 1 +ATOM 1181 C CB . CYS A 1 162 ? -55.404 -52.667 9.913 1.00 41.91 ? 480 CYS A CB 1 +ATOM 1182 S SG . CYS A 1 162 ? -54.841 -51.535 8.603 1.00 47.91 ? 480 CYS A SG 1 +ATOM 1183 N N . ASN A 1 163 ? -56.156 -55.739 10.935 1.00 34.91 ? 481 ASN A N 1 +ATOM 1184 C CA . ASN A 1 163 ? -56.485 -56.621 12.063 1.00 41.74 ? 481 ASN A CA 1 +ATOM 1185 C C . ASN A 1 163 ? -56.599 -55.835 13.372 1.00 44.37 ? 481 ASN A C 1 +ATOM 1186 O O . ASN A 1 163 ? -56.174 -56.295 14.435 1.00 43.65 ? 481 ASN A O 1 +ATOM 1187 C CB . ASN A 1 163 ? -55.459 -57.747 12.207 1.00 42.43 ? 481 ASN A CB 1 +ATOM 1188 C CG . ASN A 1 163 ? -55.291 -58.558 10.937 1.00 49.19 ? 481 ASN A CG 1 +ATOM 1189 O OD1 . ASN A 1 163 ? -56.256 -59.095 10.399 1.00 46.66 ? 481 ASN A OD1 1 +ATOM 1190 N ND2 . ASN A 1 163 ? -54.057 -58.644 10.448 1.00 55.84 ? 481 ASN A ND2 1 +ATOM 1191 N N . GLY A 1 164 ? -57.138 -54.620 13.285 1.00 43.36 ? 482 GLY A N 1 +ATOM 1192 C CA . GLY A 1 164 ? -57.386 -53.806 14.462 1.00 38.06 ? 482 GLY A CA 1 +ATOM 1193 C C . GLY A 1 164 ? -56.166 -53.201 15.121 1.00 44.35 ? 482 GLY A C 1 +ATOM 1194 O O . GLY A 1 164 ? -56.284 -52.666 16.225 1.00 44.97 ? 482 GLY A O 1 +ATOM 1195 N N . VAL A 1 165 ? -54.999 -53.250 14.485 1.00 41.52 ? 483 VAL A N 1 +ATOM 1196 C CA . VAL A 1 165 ? -53.762 -52.726 15.060 1.00 36.21 ? 483 VAL A CA 1 +ATOM 1197 C C . VAL A 1 165 ? -53.318 -51.518 14.242 1.00 39.45 ? 483 VAL A C 1 +ATOM 1198 O O . VAL A 1 165 ? -53.105 -51.628 13.028 1.00 35.17 ? 483 VAL A O 1 +ATOM 1199 C CB . VAL A 1 165 ? -52.661 -53.792 15.089 1.00 34.91 ? 483 VAL A CB 1 +ATOM 1200 C CG1 . VAL A 1 165 ? -51.357 -53.191 15.603 1.00 39.69 ? 483 VAL A CG1 1 +ATOM 1201 C CG2 . VAL A 1 165 ? -53.095 -54.978 15.937 1.00 41.03 ? 483 VAL A CG2 1 +ATOM 1202 N N . GLU A 1 166 ? -53.161 -50.373 14.905 1.00 30.31 ? 484 GLU A N 1 +ATOM 1203 C CA . GLU A 1 166 ? -52.622 -49.193 14.244 1.00 30.65 ? 484 GLU A CA 1 +ATOM 1204 C C . GLU A 1 166 ? -51.144 -49.380 13.919 1.00 36.26 ? 484 GLU A C 1 +ATOM 1205 O O . GLU A 1 166 ? -50.392 -50.032 14.651 1.00 35.76 ? 484 GLU A O 1 +ATOM 1206 C CB . GLU A 1 166 ? -52.792 -47.948 15.115 1.00 37.11 ? 484 GLU A CB 1 +ATOM 1207 C CG . GLU A 1 166 ? -54.213 -47.640 15.533 1.00 39.57 ? 484 GLU A CG 1 +ATOM 1208 C CD . GLU A 1 166 ? -54.288 -46.453 16.493 1.00 46.98 ? 484 GLU A CD 1 +ATOM 1209 O OE1 . GLU A 1 166 ? -55.139 -46.483 17.404 1.00 53.97 ? 484 GLU A OE1 1 +ATOM 1210 O OE2 . GLU A 1 166 ? -53.502 -45.490 16.336 1.00 50.49 ? 484 GLU A OE2 1 +ATOM 1211 N N . GLY A 1 167 ? -50.723 -48.773 12.818 1.00 32.89 ? 485 GLY A N 1 +ATOM 1212 C CA . GLY A 1 167 ? -49.331 -48.856 12.420 1.00 34.17 ? 485 GLY A CA 1 +ATOM 1213 C C . GLY A 1 167 ? -49.163 -48.334 11.011 1.00 31.02 ? 485 GLY A C 1 +ATOM 1214 O O . GLY A 1 167 ? -49.988 -47.562 10.527 1.00 29.26 ? 485 GLY A O 1 +ATOM 1215 N N . PHE A 1 168 ? -48.080 -48.767 10.365 1.00 34.17 ? 486 PHE A N 1 +ATOM 1216 C CA . PHE A 1 168 ? -47.843 -48.355 8.987 1.00 34.71 ? 486 PHE A CA 1 +ATOM 1217 C C . PHE A 1 168 ? -49.005 -48.771 8.090 1.00 28.17 ? 486 PHE A C 1 +ATOM 1218 O O . PHE A 1 168 ? -49.382 -49.947 8.048 1.00 31.08 ? 486 PHE A O 1 +ATOM 1219 C CB . PHE A 1 168 ? -46.539 -48.958 8.466 1.00 35.61 ? 486 PHE A CB 1 +ATOM 1220 C CG . PHE A 1 168 ? -46.155 -48.455 7.106 1.00 39.25 ? 486 PHE A CG 1 +ATOM 1221 C CD1 . PHE A 1 168 ? -45.560 -47.207 6.960 1.00 38.86 ? 486 PHE A CD1 1 +ATOM 1222 C CD2 . PHE A 1 168 ? -46.398 -49.217 5.973 1.00 42.47 ? 486 PHE A CD2 1 +ATOM 1223 C CE1 . PHE A 1 168 ? -45.211 -46.733 5.712 1.00 34.88 ? 486 PHE A CE1 1 +ATOM 1224 C CE2 . PHE A 1 168 ? -46.054 -48.746 4.715 1.00 40.26 ? 486 PHE A CE2 1 +ATOM 1225 C CZ . PHE A 1 168 ? -45.467 -47.502 4.583 1.00 39.28 ? 486 PHE A CZ 1 +ATOM 1226 N N . ASN A 1 169 ? -49.559 -47.801 7.356 1.00 24.85 ? 487 ASN A N 1 +ATOM 1227 C CA . ASN A 1 169 ? -50.698 -48.010 6.455 1.00 22.33 ? 487 ASN A CA 1 +ATOM 1228 C C . ASN A 1 169 ? -51.961 -48.408 7.193 1.00 29.01 ? 487 ASN A C 1 +ATOM 1229 O O . ASN A 1 169 ? -52.889 -48.920 6.572 1.00 31.52 ? 487 ASN A O 1 +ATOM 1230 C CB . ASN A 1 169 ? -50.429 -49.091 5.398 1.00 22.54 ? 487 ASN A CB 1 +ATOM 1231 C CG . ASN A 1 169 ? -49.506 -48.626 4.289 1.00 27.02 ? 487 ASN A CG 1 +ATOM 1232 O OD1 . ASN A 1 169 ? -49.193 -47.442 4.183 1.00 28.35 ? 487 ASN A OD1 1 +ATOM 1233 N ND2 . ASN A 1 169 ? -49.087 -49.560 3.440 1.00 26.09 ? 487 ASN A ND2 1 +ATOM 1234 N N . CYS A 1 170 ? -52.017 -48.200 8.508 1.00 23.23 ? 488 CYS A N 1 +ATOM 1235 C CA . CYS A 1 170 ? -53.121 -48.694 9.342 1.00 26.40 ? 488 CYS A CA 1 +ATOM 1236 C C . CYS A 1 170 ? -53.464 -47.607 10.360 1.00 27.07 ? 488 CYS A C 1 +ATOM 1237 O O . CYS A 1 170 ? -52.860 -47.544 11.432 1.00 28.96 ? 488 CYS A O 1 +ATOM 1238 C CB . CYS A 1 170 ? -52.727 -50.003 10.017 1.00 27.33 ? 488 CYS A CB 1 +ATOM 1239 S SG . CYS A 1 170 ? -52.778 -51.394 8.885 1.00 34.30 ? 488 CYS A SG 1 +ATOM 1240 N N . TYR A 1 171 ? -54.436 -46.758 10.026 1.00 22.59 ? 489 TYR A N 1 +ATOM 1241 C CA . TYR A 1 171 ? -54.648 -45.503 10.740 1.00 23.37 ? 489 TYR A CA 1 +ATOM 1242 C C . TYR A 1 171 ? -55.990 -45.503 11.459 1.00 27.99 ? 489 TYR A C 1 +ATOM 1243 O O . TYR A 1 171 ? -57.019 -45.870 10.879 1.00 28.41 ? 489 TYR A O 1 +ATOM 1244 C CB . TYR A 1 171 ? -54.568 -44.308 9.771 1.00 24.29 ? 489 TYR A CB 1 +ATOM 1245 C CG . TYR A 1 171 ? -53.323 -44.345 8.915 1.00 25.74 ? 489 TYR A CG 1 +ATOM 1246 C CD1 . TYR A 1 171 ? -52.063 -44.495 9.492 1.00 29.96 ? 489 TYR A CD1 1 +ATOM 1247 C CD2 . TYR A 1 171 ? -53.404 -44.263 7.529 1.00 29.84 ? 489 TYR A CD2 1 +ATOM 1248 C CE1 . TYR A 1 171 ? -50.909 -44.553 8.699 1.00 28.47 ? 489 TYR A CE1 1 +ATOM 1249 C CE2 . TYR A 1 171 ? -52.256 -44.322 6.731 1.00 29.72 ? 489 TYR A CE2 1 +ATOM 1250 C CZ . TYR A 1 171 ? -51.024 -44.465 7.319 1.00 28.39 ? 489 TYR A CZ 1 +ATOM 1251 O OH . TYR A 1 171 ? -49.894 -44.517 6.527 1.00 31.39 ? 489 TYR A OH 1 +ATOM 1252 N N . PHE A 1 172 ? -55.977 -45.073 12.708 1.00 24.31 ? 490 PHE A N 1 +ATOM 1253 C CA . PHE A 1 172 ? -57.237 -44.784 13.383 1.00 21.59 ? 490 PHE A CA 1 +ATOM 1254 C C . PHE A 1 172 ? -57.921 -43.652 12.627 1.00 24.21 ? 490 PHE A C 1 +ATOM 1255 O O . PHE A 1 172 ? -57.269 -42.647 12.308 1.00 25.62 ? 490 PHE A O 1 +ATOM 1256 C CB . PHE A 1 172 ? -57.010 -44.405 14.840 1.00 26.86 ? 490 PHE A CB 1 +ATOM 1257 C CG . PHE A 1 172 ? -58.278 -44.355 15.634 1.00 27.73 ? 490 PHE A CG 1 +ATOM 1258 C CD1 . PHE A 1 172 ? -58.857 -45.528 16.095 1.00 31.89 ? 490 PHE A CD1 1 +ATOM 1259 C CD2 . PHE A 1 172 ? -58.912 -43.150 15.876 1.00 28.47 ? 490 PHE A CD2 1 +ATOM 1260 C CE1 . PHE A 1 172 ? -60.045 -45.505 16.810 1.00 36.28 ? 490 PHE A CE1 1 +ATOM 1261 C CE2 . PHE A 1 172 ? -60.109 -43.116 16.598 1.00 29.28 ? 490 PHE A CE2 1 +ATOM 1262 C CZ . PHE A 1 172 ? -60.667 -44.296 17.066 1.00 32.42 ? 490 PHE A CZ 1 +ATOM 1263 N N . PRO A 1 173 ? -59.194 -43.803 12.252 1.00 22.68 ? 491 PRO A N 1 +ATOM 1264 C CA . PRO A 1 173 ? -59.765 -42.904 11.233 1.00 25.03 ? 491 PRO A CA 1 +ATOM 1265 C C . PRO A 1 173 ? -60.136 -41.519 11.743 1.00 26.67 ? 491 PRO A C 1 +ATOM 1266 O O . PRO A 1 173 ? -60.290 -40.607 10.923 1.00 22.88 ? 491 PRO A O 1 +ATOM 1267 C CB . PRO A 1 173 ? -61.007 -43.667 10.750 1.00 27.01 ? 491 PRO A CB 1 +ATOM 1268 C CG . PRO A 1 173 ? -61.395 -44.540 11.916 1.00 28.70 ? 491 PRO A CG 1 +ATOM 1269 C CD . PRO A 1 173 ? -60.120 -44.881 12.648 1.00 28.39 ? 491 PRO A CD 1 +ATOM 1270 N N . LEU A 1 174 ? -60.303 -41.332 13.048 1.00 24.45 ? 492 LEU A N 1 +ATOM 1271 C CA . LEU A 1 174 ? -60.700 -40.054 13.619 1.00 24.70 ? 492 LEU A CA 1 +ATOM 1272 C C . LEU A 1 174 ? -59.496 -39.329 14.205 1.00 28.84 ? 492 LEU A C 1 +ATOM 1273 O O . LEU A 1 174 ? -58.570 -39.950 14.728 1.00 30.15 ? 492 LEU A O 1 +ATOM 1274 C CB . LEU A 1 174 ? -61.756 -40.255 14.708 1.00 22.53 ? 492 LEU A CB 1 +ATOM 1275 C CG . LEU A 1 174 ? -62.971 -41.094 14.339 1.00 24.87 ? 492 LEU A CG 1 +ATOM 1276 C CD1 . LEU A 1 174 ? -63.931 -41.158 15.525 1.00 26.75 ? 492 LEU A CD1 1 +ATOM 1277 C CD2 . LEU A 1 174 ? -63.659 -40.502 13.113 1.00 24.43 ? 492 LEU A CD2 1 +ATOM 1278 N N . GLN A 1 175 ? -59.520 -38.004 14.111 1.00 23.98 ? 493 GLN A N 1 +ATOM 1279 C CA . GLN A 1 175 ? -58.472 -37.156 14.657 1.00 25.06 ? 493 GLN A CA 1 +ATOM 1280 C C . GLN A 1 175 ? -59.106 -36.094 15.551 1.00 28.03 ? 493 GLN A C 1 +ATOM 1281 O O . GLN A 1 175 ? -60.218 -35.641 15.294 1.00 32.07 ? 493 GLN A O 1 +ATOM 1282 C CB . GLN A 1 175 ? -57.675 -36.492 13.508 1.00 30.19 ? 493 GLN A CB 1 +ATOM 1283 C CG . GLN A 1 175 ? -56.475 -35.696 13.942 1.00 45.16 ? 493 GLN A CG 1 +ATOM 1284 C CD . GLN A 1 175 ? -55.195 -36.497 13.826 1.00 57.01 ? 493 GLN A CD 1 +ATOM 1285 O OE1 . GLN A 1 175 ? -55.153 -37.679 14.172 1.00 60.86 ? 493 GLN A OE1 1 +ATOM 1286 N NE2 . GLN A 1 175 ? -54.152 -35.865 13.316 1.00 53.94 ? 493 GLN A NE2 1 +ATOM 1287 N N . SER A 1 176 ? -58.402 -35.700 16.611 1.00 26.61 ? 494 SER A N 1 +ATOM 1288 C CA . SER A 1 176 ? -58.908 -34.654 17.489 1.00 27.37 ? 494 SER A CA 1 +ATOM 1289 C C . SER A 1 176 ? -58.490 -33.270 16.999 1.00 30.05 ? 494 SER A C 1 +ATOM 1290 O O . SER A 1 176 ? -57.377 -33.084 16.496 1.00 30.06 ? 494 SER A O 1 +ATOM 1291 C CB . SER A 1 176 ? -58.409 -34.858 18.916 1.00 32.10 ? 494 SER A CB 1 +ATOM 1292 O OG . SER A 1 176 ? -58.801 -33.748 19.697 1.00 44.48 ? 494 SER A OG 1 +ATOM 1293 N N . TYR A 1 177 ? -59.394 -32.295 17.152 1.00 26.39 ? 495 TYR A N 1 +ATOM 1294 C CA . TYR A 1 177 ? -59.040 -30.904 16.891 1.00 26.46 ? 495 TYR A CA 1 +ATOM 1295 C C . TYR A 1 177 ? -58.073 -30.358 17.943 1.00 30.90 ? 495 TYR A C 1 +ATOM 1296 O O . TYR A 1 177 ? -57.200 -29.546 17.627 1.00 34.09 ? 495 TYR A O 1 +ATOM 1297 C CB . TYR A 1 177 ? -60.296 -30.043 16.869 1.00 24.75 ? 495 TYR A CB 1 +ATOM 1298 C CG . TYR A 1 177 ? -61.117 -30.109 15.609 1.00 22.13 ? 495 TYR A CG 1 +ATOM 1299 C CD1 . TYR A 1 177 ? -60.679 -29.513 14.440 1.00 24.71 ? 495 TYR A CD1 1 +ATOM 1300 C CD2 . TYR A 1 177 ? -62.354 -30.738 15.609 1.00 23.49 ? 495 TYR A CD2 1 +ATOM 1301 C CE1 . TYR A 1 177 ? -61.443 -29.561 13.284 1.00 24.34 ? 495 TYR A CE1 1 +ATOM 1302 C CE2 . TYR A 1 177 ? -63.142 -30.778 14.454 1.00 22.07 ? 495 TYR A CE2 1 +ATOM 1303 C CZ . TYR A 1 177 ? -62.686 -30.180 13.311 1.00 20.61 ? 495 TYR A CZ 1 +ATOM 1304 O OH . TYR A 1 177 ? -63.451 -30.210 12.166 1.00 25.43 ? 495 TYR A OH 1 +ATOM 1305 N N . GLY A 1 178 ? -58.232 -30.749 19.202 1.00 32.85 ? 496 GLY A N 1 +ATOM 1306 C CA . GLY A 1 178 ? -57.341 -30.194 20.226 1.00 42.75 ? 496 GLY A CA 1 +ATOM 1307 C C . GLY A 1 178 ? -57.392 -28.686 20.408 1.00 45.50 ? 496 GLY A C 1 +ATOM 1308 O O . GLY A 1 178 ? -56.348 -28.053 20.609 1.00 47.55 ? 496 GLY A O 1 +ATOM 1309 N N . PHE A 1 179 ? -58.591 -28.101 20.374 1.00 29.43 ? 497 PHE A N 1 +ATOM 1310 C CA . PHE A 1 179 ? -58.785 -26.653 20.475 1.00 26.67 ? 497 PHE A CA 1 +ATOM 1311 C C . PHE A 1 179 ? -58.122 -26.046 21.713 1.00 27.38 ? 497 PHE A C 1 +ATOM 1312 O O . PHE A 1 179 ? -58.394 -26.452 22.845 1.00 28.37 ? 497 PHE A O 1 +ATOM 1313 C CB . PHE A 1 179 ? -60.282 -26.348 20.521 1.00 26.13 ? 497 PHE A CB 1 +ATOM 1314 C CG . PHE A 1 179 ? -61.035 -26.737 19.271 1.00 27.06 ? 497 PHE A CG 1 +ATOM 1315 C CD1 . PHE A 1 179 ? -60.741 -26.137 18.060 1.00 24.42 ? 497 PHE A CD1 1 +ATOM 1316 C CD2 . PHE A 1 179 ? -62.073 -27.667 19.325 1.00 24.77 ? 497 PHE A CD2 1 +ATOM 1317 C CE1 . PHE A 1 179 ? -61.441 -26.468 16.906 1.00 24.59 ? 497 PHE A CE1 1 +ATOM 1318 C CE2 . PHE A 1 179 ? -62.789 -27.996 18.179 1.00 23.19 ? 497 PHE A CE2 1 +ATOM 1319 C CZ . PHE A 1 179 ? -62.470 -27.396 16.964 1.00 22.70 ? 497 PHE A CZ 1 +ATOM 1320 N N . GLN A 1 180 ? -57.293 -25.029 21.492 1.00 24.34 ? 498 GLN A N 1 +ATOM 1321 C CA . GLN A 1 180 ? -56.685 -24.235 22.548 1.00 24.30 ? 498 GLN A CA 1 +ATOM 1322 C C . GLN A 1 180 ? -57.102 -22.777 22.415 1.00 31.44 ? 498 GLN A C 1 +ATOM 1323 O O . GLN A 1 180 ? -57.189 -22.263 21.294 1.00 29.01 ? 498 GLN A O 1 +ATOM 1324 C CB . GLN A 1 180 ? -55.154 -24.307 22.494 1.00 33.90 ? 498 GLN A CB 1 +ATOM 1325 C CG . GLN A 1 180 ? -54.560 -25.699 22.522 1.00 41.29 ? 498 GLN A CG 1 +ATOM 1326 C CD . GLN A 1 180 ? -53.044 -25.647 22.581 1.00 53.13 ? 498 GLN A CD 1 +ATOM 1327 O OE1 . GLN A 1 180 ? -52.475 -24.965 23.427 1.00 49.26 ? 498 GLN A OE1 1 +ATOM 1328 N NE2 . GLN A 1 180 ? -52.387 -26.348 21.668 1.00 61.44 ? 498 GLN A NE2 1 +ATOM 1329 N N . PRO A 1 181 ? -57.309 -22.070 23.528 1.00 32.46 ? 499 PRO A N 1 +ATOM 1330 C CA . PRO A 1 181 ? -57.839 -20.701 23.436 1.00 30.84 ? 499 PRO A CA 1 +ATOM 1331 C C . PRO A 1 181 ? -56.935 -19.733 22.702 1.00 32.77 ? 499 PRO A C 1 +ATOM 1332 O O . PRO A 1 181 ? -57.442 -18.727 22.196 1.00 31.72 ? 499 PRO A O 1 +ATOM 1333 C CB . PRO A 1 181 ? -58.020 -20.296 24.902 1.00 35.29 ? 499 PRO A CB 1 +ATOM 1334 C CG . PRO A 1 181 ? -57.056 -21.155 25.643 1.00 40.06 ? 499 PRO A CG 1 +ATOM 1335 C CD . PRO A 1 181 ? -57.078 -22.466 24.928 1.00 32.31 ? 499 PRO A CD 1 +ATOM 1336 N N . THR A 1 182 ? -55.630 -20.007 22.611 1.00 31.38 ? 500 THR A N 1 +ATOM 1337 C CA . THR A 1 182 ? -54.675 -19.161 21.896 1.00 37.23 ? 500 THR A CA 1 +ATOM 1338 C C . THR A 1 182 ? -54.594 -19.455 20.393 1.00 34.80 ? 500 THR A C 1 +ATOM 1339 O O . THR A 1 182 ? -53.779 -18.832 19.698 1.00 35.21 ? 500 THR A O 1 +ATOM 1340 C CB . THR A 1 182 ? -53.277 -19.319 22.511 1.00 36.50 ? 500 THR A CB 1 +ATOM 1341 O OG1 . THR A 1 182 ? -52.881 -20.699 22.439 1.00 43.76 ? 500 THR A OG1 1 +ATOM 1342 C CG2 . THR A 1 182 ? -53.277 -18.851 23.955 1.00 43.93 ? 500 THR A CG2 1 +ATOM 1343 N N . ASN A 1 183 ? -55.393 -20.388 19.885 1.00 27.41 ? 501 ASN A N 1 +ATOM 1344 C CA . ASN A 1 183 ? -55.465 -20.648 18.449 1.00 26.04 ? 501 ASN A CA 1 +ATOM 1345 C C . ASN A 1 183 ? -55.838 -19.387 17.675 1.00 32.03 ? 501 ASN A C 1 +ATOM 1346 O O . ASN A 1 183 ? -56.621 -18.555 18.140 1.00 27.80 ? 501 ASN A O 1 +ATOM 1347 C CB . ASN A 1 183 ? -56.505 -21.730 18.157 1.00 26.69 ? 501 ASN A CB 1 +ATOM 1348 C CG . ASN A 1 183 ? -55.985 -23.127 18.437 1.00 32.09 ? 501 ASN A CG 1 +ATOM 1349 O OD1 . ASN A 1 183 ? -54.819 -23.301 18.791 1.00 34.47 ? 501 ASN A OD1 1 +ATOM 1350 N ND2 . ASN A 1 183 ? -56.853 -24.121 18.310 1.00 26.32 ? 501 ASN A ND2 1 +ATOM 1351 N N . GLY A 1 184 ? -55.282 -19.252 16.470 1.00 28.45 ? 502 GLY A N 1 +ATOM 1352 C CA . GLY A 1 184 ? -55.816 -18.279 15.536 1.00 29.60 ? 502 GLY A CA 1 +ATOM 1353 C C . GLY A 1 184 ? -57.260 -18.599 15.186 1.00 30.18 ? 502 GLY A C 1 +ATOM 1354 O O . GLY A 1 184 ? -57.710 -19.731 15.311 1.00 27.41 ? 502 GLY A O 1 +ATOM 1355 N N . VAL A 1 185 ? -57.995 -17.577 14.741 1.00 27.57 ? 503 VAL A N 1 +ATOM 1356 C CA . VAL A 1 185 ? -59.447 -17.715 14.585 1.00 30.60 ? 503 VAL A CA 1 +ATOM 1357 C C . VAL A 1 185 ? -59.803 -18.888 13.672 1.00 30.78 ? 503 VAL A C 1 +ATOM 1358 O O . VAL A 1 185 ? -60.780 -19.609 13.915 1.00 28.62 ? 503 VAL A O 1 +ATOM 1359 C CB . VAL A 1 185 ? -60.051 -16.387 14.085 1.00 30.33 ? 503 VAL A CB 1 +ATOM 1360 C CG1 . VAL A 1 185 ? -61.450 -16.597 13.558 1.00 41.30 ? 503 VAL A CG1 1 +ATOM 1361 C CG2 . VAL A 1 185 ? -60.072 -15.379 15.210 1.00 40.15 ? 503 VAL A CG2 1 +ATOM 1362 N N . GLY A 1 186 ? -59.004 -19.132 12.633 1.00 30.78 ? 504 GLY A N 1 +ATOM 1363 C CA . GLY A 1 186 ? -59.301 -20.243 11.739 1.00 30.46 ? 504 GLY A CA 1 +ATOM 1364 C C . GLY A 1 186 ? -59.145 -21.609 12.375 1.00 28.95 ? 504 GLY A C 1 +ATOM 1365 O O . GLY A 1 186 ? -59.723 -22.587 11.886 1.00 28.74 ? 504 GLY A O 1 +ATOM 1366 N N . TYR A 1 187 ? -58.381 -21.696 13.459 1.00 26.00 ? 505 TYR A N 1 +ATOM 1367 C CA . TYR A 1 187 ? -58.225 -22.927 14.214 1.00 23.64 ? 505 TYR A CA 1 +ATOM 1368 C C . TYR A 1 187 ? -59.144 -22.991 15.431 1.00 22.41 ? 505 TYR A C 1 +ATOM 1369 O O . TYR A 1 187 ? -59.109 -23.982 16.161 1.00 25.98 ? 505 TYR A O 1 +ATOM 1370 C CB . TYR A 1 187 ? -56.768 -23.078 14.666 1.00 26.10 ? 505 TYR A CB 1 +ATOM 1371 C CG . TYR A 1 187 ? -55.824 -23.561 13.570 1.00 29.12 ? 505 TYR A CG 1 +ATOM 1372 C CD1 . TYR A 1 187 ? -55.208 -22.662 12.699 1.00 32.41 ? 505 TYR A CD1 1 +ATOM 1373 C CD2 . TYR A 1 187 ? -55.560 -24.918 13.413 1.00 32.90 ? 505 TYR A CD2 1 +ATOM 1374 C CE1 . TYR A 1 187 ? -54.339 -23.116 11.696 1.00 30.46 ? 505 TYR A CE1 1 +ATOM 1375 C CE2 . TYR A 1 187 ? -54.699 -25.380 12.417 1.00 32.59 ? 505 TYR A CE2 1 +ATOM 1376 C CZ . TYR A 1 187 ? -54.098 -24.475 11.563 1.00 35.49 ? 505 TYR A CZ 1 +ATOM 1377 O OH . TYR A 1 187 ? -53.236 -24.942 10.584 1.00 37.26 ? 505 TYR A OH 1 +ATOM 1378 N N . GLN A 1 188 ? -59.942 -21.954 15.675 1.00 22.85 ? 506 GLN A N 1 +ATOM 1379 C CA . GLN A 1 188 ? -60.825 -21.942 16.836 1.00 22.79 ? 506 GLN A CA 1 +ATOM 1380 C C . GLN A 1 188 ? -62.111 -22.713 16.545 1.00 25.02 ? 506 GLN A C 1 +ATOM 1381 O O . GLN A 1 188 ? -62.518 -22.841 15.386 1.00 24.48 ? 506 GLN A O 1 +ATOM 1382 C CB . GLN A 1 188 ? -61.159 -20.503 17.228 1.00 25.51 ? 506 GLN A CB 1 +ATOM 1383 C CG . GLN A 1 188 ? -60.039 -19.789 18.011 1.00 25.86 ? 506 GLN A CG 1 +ATOM 1384 C CD . GLN A 1 188 ? -60.356 -18.328 18.289 1.00 35.16 ? 506 GLN A CD 1 +ATOM 1385 O OE1 . GLN A 1 188 ? -61.521 -17.923 18.299 1.00 32.05 ? 506 GLN A OE1 1 +ATOM 1386 N NE2 . GLN A 1 188 ? -59.313 -17.521 18.506 1.00 31.84 ? 506 GLN A NE2 1 +ATOM 1387 N N . PRO A 1 189 ? -62.770 -23.234 17.584 1.00 23.72 ? 507 PRO A N 1 +ATOM 1388 C CA . PRO A 1 189 ? -64.006 -23.992 17.364 1.00 24.40 ? 507 PRO A CA 1 +ATOM 1389 C C . PRO A 1 189 ? -65.171 -23.069 17.048 1.00 25.23 ? 507 PRO A C 1 +ATOM 1390 O O . PRO A 1 189 ? -65.305 -21.980 17.614 1.00 25.20 ? 507 PRO A O 1 +ATOM 1391 C CB . PRO A 1 189 ? -64.236 -24.704 18.702 1.00 22.29 ? 507 PRO A CB 1 +ATOM 1392 C CG . PRO A 1 189 ? -63.621 -23.781 19.719 1.00 24.97 ? 507 PRO A CG 1 +ATOM 1393 C CD . PRO A 1 189 ? -62.386 -23.199 19.006 1.00 22.97 ? 507 PRO A CD 1 +ATOM 1394 N N . TYR A 1 190 ? -66.025 -23.537 16.145 1.00 27.50 ? 508 TYR A N 1 +ATOM 1395 C CA . TYR A 1 190 ? -67.285 -22.881 15.818 1.00 25.23 ? 508 TYR A CA 1 +ATOM 1396 C C . TYR A 1 190 ? -68.407 -23.887 16.023 1.00 28.34 ? 508 TYR A C 1 +ATOM 1397 O O . TYR A 1 190 ? -68.290 -25.041 15.600 1.00 25.36 ? 508 TYR A O 1 +ATOM 1398 C CB . TYR A 1 190 ? -67.287 -22.364 14.364 1.00 24.06 ? 508 TYR A CB 1 +ATOM 1399 C CG . TYR A 1 190 ? -66.602 -21.028 14.256 1.00 28.41 ? 508 TYR A CG 1 +ATOM 1400 C CD1 . TYR A 1 190 ? -65.236 -20.915 14.510 1.00 26.22 ? 508 TYR A CD1 1 +ATOM 1401 C CD2 . TYR A 1 190 ? -67.320 -19.871 13.961 1.00 27.08 ? 508 TYR A CD2 1 +ATOM 1402 C CE1 . TYR A 1 190 ? -64.597 -19.682 14.448 1.00 26.97 ? 508 TYR A CE1 1 +ATOM 1403 C CE2 . TYR A 1 190 ? -66.687 -18.627 13.898 1.00 30.78 ? 508 TYR A CE2 1 +ATOM 1404 C CZ . TYR A 1 190 ? -65.326 -18.549 14.138 1.00 30.68 ? 508 TYR A CZ 1 +ATOM 1405 O OH . TYR A 1 190 ? -64.680 -17.337 14.086 1.00 31.93 ? 508 TYR A OH 1 +ATOM 1406 N N . ARG A 1 191 ? -69.480 -23.460 16.678 1.00 25.29 ? 509 ARG A N 1 +ATOM 1407 C CA . ARG A 1 191 ? -70.676 -24.281 16.767 1.00 30.17 ? 509 ARG A CA 1 +ATOM 1408 C C . ARG A 1 191 ? -71.537 -24.000 15.547 1.00 29.32 ? 509 ARG A C 1 +ATOM 1409 O O . ARG A 1 191 ? -71.649 -22.853 15.105 1.00 27.37 ? 509 ARG A O 1 +ATOM 1410 C CB . ARG A 1 191 ? -71.439 -24.001 18.066 1.00 28.99 ? 509 ARG A CB 1 +ATOM 1411 C CG . ARG A 1 191 ? -70.737 -24.628 19.254 1.00 29.08 ? 509 ARG A CG 1 +ATOM 1412 C CD . ARG A 1 191 ? -71.387 -24.330 20.599 1.00 31.46 ? 509 ARG A CD 1 +ATOM 1413 N NE . ARG A 1 191 ? -70.701 -25.115 21.622 1.00 33.78 ? 509 ARG A NE 1 +ATOM 1414 C CZ . ARG A 1 191 ? -71.209 -25.455 22.800 1.00 36.17 ? 509 ARG A CZ 1 +ATOM 1415 N NH1 . ARG A 1 191 ? -72.437 -25.074 23.135 1.00 31.39 ? 509 ARG A NH1 1 +ATOM 1416 N NH2 . ARG A 1 191 ? -70.479 -26.190 23.637 1.00 33.50 ? 509 ARG A NH2 1 +ATOM 1417 N N . VAL A 1 192 ? -72.103 -25.062 14.976 1.00 25.60 ? 510 VAL A N 1 +ATOM 1418 C CA . VAL A 1 192 ? -72.832 -24.981 13.713 1.00 30.60 ? 510 VAL A CA 1 +ATOM 1419 C C . VAL A 1 192 ? -74.194 -25.633 13.896 1.00 29.00 ? 510 VAL A C 1 +ATOM 1420 O O . VAL A 1 192 ? -74.287 -26.720 14.472 1.00 28.24 ? 510 VAL A O 1 +ATOM 1421 C CB . VAL A 1 192 ? -72.072 -25.679 12.571 1.00 26.26 ? 510 VAL A CB 1 +ATOM 1422 C CG1 . VAL A 1 192 ? -72.891 -25.611 11.275 1.00 28.47 ? 510 VAL A CG1 1 +ATOM 1423 C CG2 . VAL A 1 192 ? -70.697 -25.060 12.381 1.00 27.07 ? 510 VAL A CG2 1 +ATOM 1424 N N . VAL A 1 193 ? -75.241 -24.978 13.400 1.00 28.59 ? 511 VAL A N 1 +ATOM 1425 C CA . VAL A 1 193 ? -76.577 -25.549 13.317 1.00 28.06 ? 511 VAL A CA 1 +ATOM 1426 C C . VAL A 1 193 ? -77.013 -25.467 11.866 1.00 30.52 ? 511 VAL A C 1 +ATOM 1427 O O . VAL A 1 193 ? -76.995 -24.382 11.270 1.00 31.85 ? 511 VAL A O 1 +ATOM 1428 C CB . VAL A 1 193 ? -77.580 -24.823 14.225 1.00 31.15 ? 511 VAL A CB 1 +ATOM 1429 C CG1 . VAL A 1 193 ? -78.961 -25.480 14.117 1.00 35.51 ? 511 VAL A CG1 1 +ATOM 1430 C CG2 . VAL A 1 193 ? -77.091 -24.868 15.664 1.00 31.27 ? 511 VAL A CG2 1 +ATOM 1431 N N . VAL A 1 194 ? -77.412 -26.601 11.304 1.00 28.28 ? 512 VAL A N 1 +ATOM 1432 C CA . VAL A 1 194 ? -77.969 -26.666 9.961 1.00 30.79 ? 512 VAL A CA 1 +ATOM 1433 C C . VAL A 1 194 ? -79.461 -26.949 10.085 1.00 30.52 ? 512 VAL A C 1 +ATOM 1434 O O . VAL A 1 194 ? -79.861 -28.000 10.602 1.00 32.16 ? 512 VAL A O 1 +ATOM 1435 C CB . VAL A 1 194 ? -77.265 -27.736 9.112 1.00 29.64 ? 512 VAL A CB 1 +ATOM 1436 C CG1 . VAL A 1 194 ? -77.809 -27.721 7.701 1.00 35.28 ? 512 VAL A CG1 1 +ATOM 1437 C CG2 . VAL A 1 194 ? -75.768 -27.491 9.094 1.00 28.98 ? 512 VAL A CG2 1 +ATOM 1438 N N . LEU A 1 195 ? -80.284 -26.016 9.618 1.00 32.18 ? 513 LEU A N 1 +ATOM 1439 C CA . LEU A 1 195 ? -81.728 -26.206 9.556 1.00 39.96 ? 513 LEU A CA 1 +ATOM 1440 C C . LEU A 1 195 ? -82.091 -26.653 8.144 1.00 44.78 ? 513 LEU A C 1 +ATOM 1441 O O . LEU A 1 195 ? -81.788 -25.951 7.175 1.00 43.51 ? 513 LEU A O 1 +ATOM 1442 C CB . LEU A 1 195 ? -82.476 -24.921 9.919 1.00 41.99 ? 513 LEU A CB 1 +ATOM 1443 C CG . LEU A 1 195 ? -82.172 -24.304 11.288 1.00 41.55 ? 513 LEU A CG 1 +ATOM 1444 C CD1 . LEU A 1 195 ? -82.958 -23.012 11.506 1.00 42.98 ? 513 LEU A CD1 1 +ATOM 1445 C CD2 . LEU A 1 195 ? -82.451 -25.304 12.396 1.00 40.32 ? 513 LEU A CD2 1 +ATOM 1446 N N . SER A 1 196 ? -82.707 -27.830 8.031 1.00 47.16 ? 514 SER A N 1 +ATOM 1447 C CA . SER A 1 196 ? -83.196 -28.364 6.765 1.00 45.39 ? 514 SER A CA 1 +ATOM 1448 C C . SER A 1 196 ? -84.714 -28.312 6.768 1.00 44.51 ? 514 SER A C 1 +ATOM 1449 O O . SER A 1 196 ? -85.349 -28.681 7.759 1.00 48.00 ? 514 SER A O 1 +ATOM 1450 C CB . SER A 1 196 ? -82.735 -29.813 6.535 1.00 38.08 ? 514 SER A CB 1 +ATOM 1451 O OG . SER A 1 196 ? -81.341 -29.939 6.686 1.00 56.70 ? 514 SER A OG 1 +ATOM 1452 N N . PHE A 1 197 ? -85.297 -27.848 5.662 1.00 47.70 ? 515 PHE A N 1 +ATOM 1453 C CA . PHE A 1 197 ? -86.741 -27.666 5.554 1.00 56.88 ? 515 PHE A CA 1 +ATOM 1454 C C . PHE A 1 197 ? -87.297 -28.738 4.624 1.00 65.33 ? 515 PHE A C 1 +ATOM 1455 O O . PHE A 1 197 ? -87.022 -28.728 3.419 1.00 64.66 ? 515 PHE A O 1 +ATOM 1456 C CB . PHE A 1 197 ? -87.075 -26.259 5.062 1.00 59.10 ? 515 PHE A CB 1 +ATOM 1457 C CG . PHE A 1 197 ? -86.491 -25.172 5.919 1.00 62.68 ? 515 PHE A CG 1 +ATOM 1458 C CD1 . PHE A 1 197 ? -86.657 -25.195 7.293 1.00 63.43 ? 515 PHE A CD1 1 +ATOM 1459 C CD2 . PHE A 1 197 ? -85.763 -24.137 5.356 1.00 70.05 ? 515 PHE A CD2 1 +ATOM 1460 C CE1 . PHE A 1 197 ? -86.113 -24.203 8.094 1.00 61.41 ? 515 PHE A CE1 1 +ATOM 1461 C CE2 . PHE A 1 197 ? -85.215 -23.139 6.153 1.00 67.60 ? 515 PHE A CE2 1 +ATOM 1462 C CZ . PHE A 1 197 ? -85.392 -23.175 7.524 1.00 59.90 ? 515 PHE A CZ 1 +ATOM 1463 N N . GLU A 1 198 ? -88.079 -29.652 5.192 1.00 67.70 ? 516 GLU A N 1 +ATOM 1464 C CA . GLU A 1 198 ? -88.632 -30.805 4.494 1.00 77.39 ? 516 GLU A CA 1 +ATOM 1465 C C . GLU A 1 198 ? -90.124 -30.604 4.263 1.00 83.23 ? 516 GLU A C 1 +ATOM 1466 O O . GLU A 1 198 ? -90.849 -30.193 5.178 1.00 76.63 ? 516 GLU A O 1 +ATOM 1467 C CB . GLU A 1 198 ? -88.392 -32.079 5.311 1.00 83.63 ? 516 GLU A CB 1 +ATOM 1468 C CG . GLU A 1 198 ? -89.139 -33.315 4.829 1.00 90.66 ? 516 GLU A CG 1 +ATOM 1469 C CD . GLU A 1 198 ? -88.993 -34.496 5.779 1.00 93.13 ? 516 GLU A CD 1 +ATOM 1470 O OE1 . GLU A 1 198 ? -90.024 -35.085 6.164 1.00 99.12 ? 516 GLU A OE1 1 +ATOM 1471 O OE2 . GLU A 1 198 ? -87.849 -34.839 6.137 1.00 91.55 ? 516 GLU A OE2 1 +ATOM 1472 N N . LEU A 1 199 ? -90.582 -30.894 3.045 1.00 92.01 ? 517 LEU A N 1 +ATOM 1473 C CA . LEU A 1 199 ? -92.014 -30.940 2.759 1.00 99.84 ? 517 LEU A CA 1 +ATOM 1474 C C . LEU A 1 199 ? -92.306 -32.107 1.825 1.00 104.39 ? 517 LEU A C 1 +ATOM 1475 O O . LEU A 1 199 ? -91.767 -32.177 0.717 1.00 106.40 ? 517 LEU A O 1 +ATOM 1476 C CB . LEU A 1 199 ? -92.535 -29.616 2.175 1.00 95.11 ? 517 LEU A CB 1 +ATOM 1477 C CG . LEU A 1 199 ? -92.309 -29.155 0.731 1.00 90.57 ? 517 LEU A CG 1 +ATOM 1478 C CD1 . LEU A 1 199 ? -93.088 -27.873 0.476 1.00 86.69 ? 517 LEU A CD1 1 +ATOM 1479 C CD2 . LEU A 1 199 ? -90.827 -28.956 0.416 1.00 86.82 ? 517 LEU A CD2 1 +ATOM 1480 N N . LEU A 1 200 ? -93.141 -33.033 2.289 1.00 106.18 ? 518 LEU A N 1 +ATOM 1481 C CA . LEU A 1 200 ? -93.556 -34.193 1.505 1.00 106.20 ? 518 LEU A CA 1 +ATOM 1482 C C . LEU A 1 200 ? -95.038 -34.084 1.143 1.00 106.51 ? 518 LEU A C 1 +ATOM 1483 O O . LEU A 1 200 ? -95.818 -35.014 1.361 1.00 106.25 ? 518 LEU A O 1 +ATOM 1484 C CB . LEU A 1 200 ? -93.289 -35.492 2.271 1.00 105.50 ? 518 LEU A CB 1 +ATOM 1485 C CG . LEU A 1 200 ? -92.011 -35.573 3.115 1.00 102.48 ? 518 LEU A CG 1 +ATOM 1486 C CD1 . LEU A 1 200 ? -92.089 -36.728 4.111 1.00 102.44 ? 518 LEU A CD1 1 +ATOM 1487 C CD2 . LEU A 1 200 ? -90.771 -35.695 2.237 1.00 99.32 ? 518 LEU A CD2 1 +ATOM 1488 N N . ALA A 1 202 ? -97.964 -34.703 2.709 1.00 115.89 ? 520 ALA A N 1 +ATOM 1489 C CA . ALA A 1 202 ? -98.358 -34.754 4.115 1.00 116.61 ? 520 ALA A CA 1 +ATOM 1490 C C . ALA A 1 202 ? -98.658 -33.354 4.654 1.00 121.16 ? 520 ALA A C 1 +ATOM 1491 O O . ALA A 1 202 ? -98.070 -32.376 4.192 1.00 126.13 ? 520 ALA A O 1 +ATOM 1492 C CB . ALA A 1 202 ? -97.268 -35.422 4.944 1.00 106.78 ? 520 ALA A CB 1 +ATOM 1493 N N . PRO A 1 203 ? -99.579 -33.260 5.617 1.00 117.18 ? 521 PRO A N 1 +ATOM 1494 C CA . PRO A 1 203 ? -99.879 -31.957 6.225 1.00 111.91 ? 521 PRO A CA 1 +ATOM 1495 C C . PRO A 1 203 ? -98.639 -31.319 6.838 1.00 104.54 ? 521 PRO A C 1 +ATOM 1496 O O . PRO A 1 203 ? -97.753 -32.000 7.360 1.00 104.09 ? 521 PRO A O 1 +ATOM 1497 C CB . PRO A 1 203 ? -100.918 -32.297 7.299 1.00 112.58 ? 521 PRO A CB 1 +ATOM 1498 C CG . PRO A 1 203 ? -101.567 -33.544 6.811 1.00 114.60 ? 521 PRO A CG 1 +ATOM 1499 C CD . PRO A 1 203 ? -100.492 -34.315 6.095 1.00 115.34 ? 521 PRO A CD 1 +ATOM 1500 N N . ALA A 1 204 ? -98.586 -29.991 6.765 1.00 95.34 ? 522 ALA A N 1 +ATOM 1501 C CA . ALA A 1 204 ? -97.462 -29.252 7.324 1.00 88.35 ? 522 ALA A CA 1 +ATOM 1502 C C . ALA A 1 204 ? -97.527 -29.253 8.846 1.00 94.47 ? 522 ALA A C 1 +ATOM 1503 O O . ALA A 1 204 ? -98.592 -29.062 9.439 1.00 99.75 ? 522 ALA A O 1 +ATOM 1504 C CB . ALA A 1 204 ? -97.454 -27.818 6.796 1.00 82.29 ? 522 ALA A CB 1 +ATOM 1505 N N . THR A 1 205 ? -96.375 -29.466 9.482 1.00 93.75 ? 523 THR A N 1 +ATOM 1506 C CA . THR A 1 205 ? -96.292 -29.579 10.933 1.00 94.41 ? 523 THR A CA 1 +ATOM 1507 C C . THR A 1 205 ? -95.642 -28.385 11.611 1.00 86.30 ? 523 THR A C 1 +ATOM 1508 O O . THR A 1 205 ? -95.960 -28.101 12.766 1.00 86.28 ? 523 THR A O 1 +ATOM 1509 C CB . THR A 1 205 ? -95.515 -30.843 11.328 1.00 97.27 ? 523 THR A CB 1 +ATOM 1510 O OG1 . THR A 1 205 ? -94.133 -30.694 10.967 1.00 94.24 ? 523 THR A OG1 1 +ATOM 1511 C CG2 . THR A 1 205 ? -96.097 -32.067 10.633 1.00 99.21 ? 523 THR A CG2 1 +ATOM 1512 N N . VAL A 1 206 ? -94.747 -27.680 10.932 1.00 77.97 ? 524 VAL A N 1 +ATOM 1513 C CA . VAL A 1 206 ? -93.996 -26.580 11.524 1.00 77.86 ? 524 VAL A CA 1 +ATOM 1514 C C . VAL A 1 206 ? -94.248 -25.336 10.682 1.00 83.10 ? 524 VAL A C 1 +ATOM 1515 O O . VAL A 1 206 ? -93.929 -25.309 9.486 1.00 83.01 ? 524 VAL A O 1 +ATOM 1516 C CB . VAL A 1 206 ? -92.498 -26.916 11.626 1.00 68.83 ? 524 VAL A CB 1 +ATOM 1517 C CG1 . VAL A 1 206 ? -92.000 -27.449 10.300 1.00 68.49 ? 524 VAL A CG1 1 +ATOM 1518 C CG2 . VAL A 1 206 ? -91.690 -25.699 12.072 1.00 66.38 ? 524 VAL A CG2 1 +ATOM 1519 N N . CYS A 1 207 ? -94.842 -24.319 11.300 1.00 89.54 ? 525 CYS A N 1 +ATOM 1520 C CA . CYS A 1 207 ? -95.251 -23.110 10.604 1.00 95.22 ? 525 CYS A CA 1 +ATOM 1521 C C . CYS A 1 207 ? -94.758 -21.884 11.358 1.00 94.26 ? 525 CYS A C 1 +ATOM 1522 O O . CYS A 1 207 ? -94.420 -21.949 12.542 1.00 96.42 ? 525 CYS A O 1 +ATOM 1523 C CB . CYS A 1 207 ? -96.778 -23.041 10.448 1.00 105.61 ? 525 CYS A CB 1 +ATOM 1524 S SG . CYS A 1 207 ? -97.461 -24.147 9.190 1.00 112.54 ? 525 CYS A SG 1 +ATOM 1525 N N . GLY A 1 208 ? -94.721 -20.756 10.646 1.00 93.53 ? 526 GLY A N 1 +ATOM 1526 C CA . GLY A 1 208 ? -94.437 -19.495 11.266 1.00 91.89 ? 526 GLY A CA 1 +ATOM 1527 C C . GLY A 1 208 ? -95.607 -19.009 12.101 1.00 87.28 ? 526 GLY A C 1 +ATOM 1528 O O . GLY A 1 208 ? -96.661 -19.655 12.177 1.00 84.15 ? 526 GLY A O 1 +ATOM 1529 N N . PRO A 1 209 ? -95.430 -17.851 12.739 1.00 91.72 ? 527 PRO A N 1 +ATOM 1530 C CA . PRO A 1 209 ? -96.460 -17.344 13.655 1.00 99.00 ? 527 PRO A CA 1 +ATOM 1531 C C . PRO A 1 209 ? -97.784 -17.063 12.959 1.00 108.10 ? 527 PRO A C 1 +ATOM 1532 O O . PRO A 1 209 ? -97.876 -16.986 11.731 1.00 110.38 ? 527 PRO A O 1 +ATOM 1533 C CB . PRO A 1 209 ? -95.843 -16.052 14.210 1.00 96.97 ? 527 PRO A CB 1 +ATOM 1534 C CG . PRO A 1 209 ? -94.717 -15.716 13.277 1.00 95.68 ? 527 PRO A CG 1 +ATOM 1535 C CD . PRO A 1 209 ? -94.215 -17.022 12.757 1.00 89.18 ? 527 PRO A CD 1 +ATOM 1536 N N . LYS A 1 210 ? -98.821 -16.917 13.785 1.00 109.23 ? 528 LYS A N 1 +ATOM 1537 C CA . LYS A 1 210 ? -100.170 -16.537 13.362 1.00 107.92 ? 528 LYS A CA 1 +ATOM 1538 C C . LYS A 1 210 ? -100.716 -17.404 12.229 1.00 105.31 ? 528 LYS A C 1 +ATOM 1539 O O . LYS A 1 210 ? -101.909 -17.714 12.196 1.00 103.96 ? 528 LYS A O 1 +ATOM 1540 C CB . LYS A 1 210 ? -100.199 -15.059 12.953 1.00 106.29 ? 528 LYS A CB 1 +ATOM 1541 C CG . LYS A 1 210 ? -99.707 -14.106 14.042 1.00 103.33 ? 528 LYS A CG 1 +ATOM 1542 C CD . LYS A 1 210 ? -99.843 -12.646 13.619 1.00 104.42 ? 528 LYS A CD 1 +ATOM 1543 C CE . LYS A 1 210 ? -100.738 -11.861 14.579 1.00 102.52 ? 528 LYS A CE 1 +ATOM 1544 N NZ . LYS A 1 210 ? -100.074 -11.586 15.886 1.00 100.55 ? 528 LYS A NZ 1 +ATOM 1545 N N . ASP B 2 2 ? -44.347 -56.038 -0.596 1.00 48.53 ? 0 ASP H N 1 +ATOM 1546 C CA . ASP B 2 2 ? -43.617 -55.221 -1.560 1.00 48.54 ? 0 ASP H CA 1 +ATOM 1547 C C . ASP B 2 2 ? -42.894 -54.078 -0.865 1.00 47.26 ? 0 ASP H C 1 +ATOM 1548 O O . ASP B 2 2 ? -43.387 -53.558 0.135 1.00 44.41 ? 0 ASP H O 1 +ATOM 1549 C CB . ASP B 2 2 ? -44.581 -54.683 -2.612 1.00 55.71 ? 0 ASP H CB 1 +ATOM 1550 C CG . ASP B 2 2 ? -45.151 -55.786 -3.485 1.00 68.77 ? 0 ASP H CG 1 +ATOM 1551 O OD1 . ASP B 2 2 ? -45.506 -56.848 -2.940 1.00 76.18 ? 0 ASP H OD1 1 +ATOM 1552 O OD2 . ASP B 2 2 ? -45.269 -55.584 -4.706 1.00 75.84 ? 0 ASP H OD2 1 +ATOM 1553 N N . GLU B 2 3 ? -41.732 -53.694 -1.402 1.00 38.39 ? 1 GLU H N 1 +ATOM 1554 C CA . GLU B 2 3 ? -40.983 -52.562 -0.868 1.00 41.55 ? 1 GLU H CA 1 +ATOM 1555 C C . GLU B 2 3 ? -41.797 -51.277 -0.963 1.00 41.48 ? 1 GLU H C 1 +ATOM 1556 O O . GLU B 2 3 ? -42.517 -51.050 -1.938 1.00 40.10 ? 1 GLU H O 1 +ATOM 1557 C CB . GLU B 2 3 ? -39.674 -52.392 -1.640 1.00 56.18 ? 1 GLU H CB 1 +ATOM 1558 C CG . GLU B 2 3 ? -38.447 -52.261 -0.768 1.00 75.96 ? 1 GLU H CG 1 +ATOM 1559 C CD . GLU B 2 3 ? -38.264 -53.454 0.146 1.00 94.32 ? 1 GLU H CD 1 +ATOM 1560 O OE1 . GLU B 2 3 ? -38.559 -53.329 1.354 1.00 99.94 ? 1 GLU H OE1 1 +ATOM 1561 O OE2 . GLU B 2 3 ? -37.826 -54.517 -0.344 1.00 101.55 ? 1 GLU H OE2 1 +ATOM 1562 N N . VAL B 2 4 ? -41.668 -50.420 0.046 1.00 31.63 ? 2 VAL H N 1 +ATOM 1563 C CA . VAL B 2 4 ? -42.336 -49.122 0.016 1.00 29.33 ? 2 VAL H CA 1 +ATOM 1564 C C . VAL B 2 4 ? -41.484 -48.167 -0.807 1.00 31.66 ? 2 VAL H C 1 +ATOM 1565 O O . VAL B 2 4 ? -40.318 -47.930 -0.477 1.00 35.13 ? 2 VAL H O 1 +ATOM 1566 C CB . VAL B 2 4 ? -42.557 -48.581 1.435 1.00 29.06 ? 2 VAL H CB 1 +ATOM 1567 C CG1 . VAL B 2 4 ? -43.175 -47.175 1.385 1.00 34.98 ? 2 VAL H CG1 1 +ATOM 1568 C CG2 . VAL B 2 4 ? -43.421 -49.542 2.226 1.00 30.75 ? 2 VAL H CG2 1 +ATOM 1569 N N . GLN B 2 5 ? -42.054 -47.619 -1.881 1.00 27.84 ? 3 GLN H N 1 +ATOM 1570 C CA . GLN B 2 5 ? -41.288 -46.669 -2.677 1.00 32.62 ? 3 GLN H CA 1 +ATOM 1571 C C . GLN B 2 5 ? -42.205 -45.893 -3.606 1.00 26.58 ? 3 GLN H C 1 +ATOM 1572 O O . GLN B 2 5 ? -43.281 -46.368 -3.994 1.00 30.48 ? 3 GLN H O 1 +ATOM 1573 C CB . GLN B 2 5 ? -40.200 -47.368 -3.497 1.00 40.70 ? 3 GLN H CB 1 +ATOM 1574 C CG . GLN B 2 5 ? -40.731 -48.395 -4.472 1.00 47.34 ? 3 GLN H CG 1 +ATOM 1575 C CD . GLN B 2 5 ? -39.641 -48.955 -5.365 1.00 58.98 ? 3 GLN H CD 1 +ATOM 1576 O OE1 . GLN B 2 5 ? -38.488 -48.530 -5.293 1.00 59.31 ? 3 GLN H OE1 1 +ATOM 1577 N NE2 . GLN B 2 5 ? -40.002 -49.916 -6.211 1.00 64.83 ? 3 GLN H NE2 1 +ATOM 1578 N N . LEU B 2 6 ? -41.756 -44.693 -3.951 1.00 25.49 ? 4 LEU H N 1 +ATOM 1579 C CA . LEU B 2 6 ? -42.369 -43.855 -4.975 1.00 24.26 ? 4 LEU H CA 1 +ATOM 1580 C C . LEU B 2 6 ? -41.303 -43.579 -6.023 1.00 29.45 ? 4 LEU H C 1 +ATOM 1581 O O . LEU B 2 6 ? -40.219 -43.092 -5.686 1.00 28.03 ? 4 LEU H O 1 +ATOM 1582 C CB . LEU B 2 6 ? -42.886 -42.545 -4.377 1.00 26.14 ? 4 LEU H CB 1 +ATOM 1583 C CG . LEU B 2 6 ? -44.099 -42.682 -3.460 1.00 25.71 ? 4 LEU H CG 1 +ATOM 1584 C CD1 . LEU B 2 6 ? -44.341 -41.394 -2.690 1.00 21.89 ? 4 LEU H CD1 1 +ATOM 1585 C CD2 . LEU B 2 6 ? -45.309 -42.989 -4.342 1.00 28.08 ? 4 LEU H CD2 1 +ATOM 1586 N N . VAL B 2 7 ? -41.596 -43.895 -7.282 1.00 27.74 ? 5 VAL H N 1 +ATOM 1587 C CA . VAL B 2 7 ? -40.624 -43.757 -8.369 1.00 26.30 ? 5 VAL H CA 1 +ATOM 1588 C C . VAL B 2 7 ? -41.185 -42.778 -9.389 1.00 31.41 ? 5 VAL H C 1 +ATOM 1589 O O . VAL B 2 7 ? -42.154 -43.087 -10.094 1.00 27.77 ? 5 VAL H O 1 +ATOM 1590 C CB . VAL B 2 7 ? -40.294 -45.101 -9.021 1.00 30.91 ? 5 VAL H CB 1 +ATOM 1591 C CG1 . VAL B 2 7 ? -39.290 -44.894 -10.160 1.00 36.49 ? 5 VAL H CG1 1 +ATOM 1592 C CG2 . VAL B 2 7 ? -39.731 -46.060 -7.984 1.00 38.17 ? 5 VAL H CG2 1 +ATOM 1593 N N . GLU B 2 8 ? -40.563 -41.614 -9.491 1.00 28.08 ? 6 GLU H N 1 +ATOM 1594 C CA . GLU B 2 8 ? -41.046 -40.580 -10.385 1.00 30.74 ? 6 GLU H CA 1 +ATOM 1595 C C . GLU B 2 8 ? -40.344 -40.630 -11.733 1.00 31.76 ? 6 GLU H C 1 +ATOM 1596 O O . GLU B 2 8 ? -39.216 -41.112 -11.862 1.00 30.04 ? 6 GLU H O 1 +ATOM 1597 C CB . GLU B 2 8 ? -40.837 -39.216 -9.767 1.00 29.80 ? 6 GLU H CB 1 +ATOM 1598 C CG . GLU B 2 8 ? -41.245 -39.190 -8.337 1.00 34.37 ? 6 GLU H CG 1 +ATOM 1599 C CD . GLU B 2 8 ? -40.993 -37.868 -7.750 1.00 35.89 ? 6 GLU H CD 1 +ATOM 1600 O OE1 . GLU B 2 8 ? -40.630 -37.810 -6.560 1.00 29.46 ? 6 GLU H OE1 1 +ATOM 1601 O OE2 . GLU B 2 8 ? -41.151 -36.885 -8.499 1.00 34.13 ? 6 GLU H OE2 1 +ATOM 1602 N N . SER B 2 9 ? -41.027 -40.090 -12.737 1.00 28.86 ? 7 SER H N 1 +ATOM 1603 C CA . SER B 2 9 ? -40.459 -39.960 -14.069 1.00 30.28 ? 7 SER H CA 1 +ATOM 1604 C C . SER B 2 9 ? -41.210 -38.856 -14.799 1.00 31.12 ? 7 SER H C 1 +ATOM 1605 O O . SER B 2 9 ? -42.257 -38.381 -14.348 1.00 28.11 ? 7 SER H O 1 +ATOM 1606 C CB . SER B 2 9 ? -40.549 -41.280 -14.838 1.00 37.60 ? 7 SER H CB 1 +ATOM 1607 O OG . SER B 2 9 ? -41.904 -41.673 -14.942 1.00 36.75 ? 7 SER H OG 1 +ATOM 1608 N N . GLY B 2 10 ? -40.664 -38.455 -15.942 1.00 29.07 ? 8 GLY H N 1 +ATOM 1609 C CA . GLY B 2 10 ? -41.333 -37.517 -16.817 1.00 29.08 ? 8 GLY H CA 1 +ATOM 1610 C C . GLY B 2 10 ? -40.722 -36.134 -16.850 1.00 30.78 ? 8 GLY H C 1 +ATOM 1611 O O . GLY B 2 10 ? -41.116 -35.330 -17.698 1.00 33.71 ? 8 GLY H O 1 +ATOM 1612 N N . GLY B 2 11 ? -39.788 -35.822 -15.957 1.00 27.76 ? 9 GLY H N 1 +ATOM 1613 C CA . GLY B 2 11 ? -39.153 -34.520 -15.996 1.00 29.72 ? 9 GLY H CA 1 +ATOM 1614 C C . GLY B 2 11 ? -38.310 -34.347 -17.246 1.00 33.85 ? 9 GLY H C 1 +ATOM 1615 O O . GLY B 2 11 ? -37.842 -35.307 -17.853 1.00 36.86 ? 9 GLY H O 1 +ATOM 1616 N N . GLY B 2 12 ? -38.132 -33.097 -17.643 1.00 32.77 ? 10 GLY H N 1 +ATOM 1617 C CA . GLY B 2 12 ? -37.347 -32.801 -18.824 1.00 33.58 ? 10 GLY H CA 1 +ATOM 1618 C C . GLY B 2 12 ? -37.336 -31.313 -19.065 1.00 35.44 ? 10 GLY H C 1 +ATOM 1619 O O . GLY B 2 12 ? -37.733 -30.529 -18.200 1.00 32.10 ? 10 GLY H O 1 +ATOM 1620 N N . LEU B 2 13 ? -36.912 -30.937 -20.266 1.00 30.47 ? 11 LEU H N 1 +ATOM 1621 C CA . LEU B 2 13 ? -36.801 -29.544 -20.674 1.00 29.44 ? 11 LEU H CA 1 +ATOM 1622 C C . LEU B 2 13 ? -38.033 -29.152 -21.479 1.00 30.15 ? 11 LEU H C 1 +ATOM 1623 O O . LEU B 2 13 ? -38.447 -29.896 -22.367 1.00 29.48 ? 11 LEU H O 1 +ATOM 1624 C CB . LEU B 2 13 ? -35.539 -29.352 -21.514 1.00 33.13 ? 11 LEU H CB 1 +ATOM 1625 C CG . LEU B 2 13 ? -35.290 -28.009 -22.187 1.00 55.47 ? 11 LEU H CG 1 +ATOM 1626 C CD1 . LEU B 2 13 ? -35.373 -26.878 -21.169 1.00 62.40 ? 11 LEU H CD1 1 +ATOM 1627 C CD2 . LEU B 2 13 ? -33.921 -28.043 -22.855 1.00 55.38 ? 11 LEU H CD2 1 +ATOM 1628 N N . VAL B 2 14 ? -38.614 -27.988 -21.171 1.00 26.79 ? 12 VAL H N 1 +ATOM 1629 C CA . VAL B 2 14 ? -39.818 -27.502 -21.847 1.00 30.95 ? 12 VAL H CA 1 +ATOM 1630 C C . VAL B 2 14 ? -39.654 -26.015 -22.135 1.00 30.00 ? 12 VAL H C 1 +ATOM 1631 O O . VAL B 2 14 ? -39.005 -25.293 -21.380 1.00 25.00 ? 12 VAL H O 1 +ATOM 1632 C CB . VAL B 2 14 ? -41.102 -27.716 -20.995 1.00 34.39 ? 12 VAL H CB 1 +ATOM 1633 C CG1 . VAL B 2 14 ? -42.326 -27.719 -21.877 1.00 41.71 ? 12 VAL H CG1 1 +ATOM 1634 C CG2 . VAL B 2 14 ? -41.025 -28.995 -20.185 1.00 46.17 ? 12 VAL H CG2 1 +ATOM 1635 N N . GLN B 2 15 ? -40.262 -25.546 -23.222 1.00 26.66 ? 13 GLN H N 1 +ATOM 1636 C CA . GLN B 2 15 ? -40.281 -24.111 -23.474 1.00 26.12 ? 13 GLN H CA 1 +ATOM 1637 C C . GLN B 2 15 ? -41.407 -23.444 -22.680 1.00 24.71 ? 13 GLN H C 1 +ATOM 1638 O O . GLN B 2 15 ? -42.391 -24.090 -22.328 1.00 26.22 ? 13 GLN H O 1 +ATOM 1639 C CB . GLN B 2 15 ? -40.475 -23.830 -24.961 1.00 30.12 ? 13 GLN H CB 1 +ATOM 1640 C CG . GLN B 2 15 ? -39.336 -24.284 -25.856 1.00 38.41 ? 13 GLN H CG 1 +ATOM 1641 C CD . GLN B 2 15 ? -39.711 -24.158 -27.324 1.00 50.66 ? 13 GLN H CD 1 +ATOM 1642 O OE1 . GLN B 2 15 ? -39.598 -23.085 -27.912 1.00 58.88 ? 13 GLN H OE1 1 +ATOM 1643 N NE2 . GLN B 2 15 ? -40.189 -25.251 -27.911 1.00 53.51 ? 13 GLN H NE2 1 +ATOM 1644 N N . PRO B 2 16 ? -41.283 -22.147 -22.387 1.00 30.38 ? 14 PRO H N 1 +ATOM 1645 C CA . PRO B 2 16 ? -42.388 -21.429 -21.727 1.00 27.85 ? 14 PRO H CA 1 +ATOM 1646 C C . PRO B 2 16 ? -43.668 -21.521 -22.543 1.00 26.96 ? 14 PRO H C 1 +ATOM 1647 O O . PRO B 2 16 ? -43.669 -21.287 -23.753 1.00 30.32 ? 14 PRO H O 1 +ATOM 1648 C CB . PRO B 2 16 ? -41.882 -19.983 -21.654 1.00 33.07 ? 14 PRO H CB 1 +ATOM 1649 C CG . PRO B 2 16 ? -40.402 -20.098 -21.707 1.00 35.27 ? 14 PRO H CG 1 +ATOM 1650 C CD . PRO B 2 16 ? -40.102 -21.290 -22.577 1.00 32.92 ? 14 PRO H CD 1 +ATOM 1651 N N . GLY B 2 17 ? -44.767 -21.839 -21.864 1.00 30.32 ? 15 GLY H N 1 +ATOM 1652 C CA . GLY B 2 17 ? -46.026 -22.084 -22.529 1.00 32.45 ? 15 GLY H CA 1 +ATOM 1653 C C . GLY B 2 17 ? -46.273 -23.538 -22.855 1.00 30.22 ? 15 GLY H C 1 +ATOM 1654 O O . GLY B 2 17 ? -47.399 -23.892 -23.246 1.00 30.34 ? 15 GLY H O 1 +ATOM 1655 N N . GLY B 2 18 ? -45.259 -24.388 -22.697 1.00 29.82 ? 16 GLY H N 1 +ATOM 1656 C CA . GLY B 2 18 ? -45.358 -25.784 -23.043 1.00 29.85 ? 16 GLY H CA 1 +ATOM 1657 C C . GLY B 2 18 ? -45.973 -26.600 -21.930 1.00 30.42 ? 16 GLY H C 1 +ATOM 1658 O O . GLY B 2 18 ? -46.380 -26.094 -20.883 1.00 28.58 ? 16 GLY H O 1 +ATOM 1659 N N . SER B 2 19 ? -46.038 -27.905 -22.169 1.00 28.29 ? 17 SER H N 1 +ATOM 1660 C CA A SER B 2 19 ? -46.690 -28.821 -21.249 0.42 25.91 ? 17 SER H CA 1 +ATOM 1661 C CA B SER B 2 19 ? -46.709 -28.845 -21.281 0.58 25.92 ? 17 SER H CA 1 +ATOM 1662 C C . SER B 2 19 ? -45.792 -30.020 -20.986 1.00 29.28 ? 17 SER H C 1 +ATOM 1663 O O . SER B 2 19 ? -44.893 -30.342 -21.767 1.00 30.72 ? 17 SER H O 1 +ATOM 1664 C CB A SER B 2 19 ? -48.052 -29.288 -21.791 0.42 30.32 ? 17 SER H CB 1 +ATOM 1665 C CB B SER B 2 19 ? -48.021 -29.374 -21.895 0.58 29.93 ? 17 SER H CB 1 +ATOM 1666 O OG A SER B 2 19 ? -47.886 -30.083 -22.947 0.42 31.41 ? 17 SER H OG 1 +ATOM 1667 O OG B SER B 2 19 ? -48.919 -28.323 -22.181 0.58 33.23 ? 17 SER H OG 1 +ATOM 1668 N N . LEU B 2 20 ? -46.049 -30.674 -19.858 1.00 25.75 ? 18 LEU H N 1 +ATOM 1669 C CA . LEU B 2 20 ? -45.287 -31.836 -19.432 1.00 28.61 ? 18 LEU H CA 1 +ATOM 1670 C C . LEU B 2 20 ? -46.166 -32.628 -18.471 1.00 32.50 ? 18 LEU H C 1 +ATOM 1671 O O . LEU B 2 20 ? -46.931 -32.036 -17.707 1.00 33.17 ? 18 LEU H O 1 +ATOM 1672 C CB . LEU B 2 20 ? -43.980 -31.397 -18.758 1.00 32.51 ? 18 LEU H CB 1 +ATOM 1673 C CG . LEU B 2 20 ? -42.791 -32.343 -18.708 1.00 34.68 ? 18 LEU H CG 1 +ATOM 1674 C CD1 . LEU B 2 20 ? -42.302 -32.642 -20.108 1.00 37.24 ? 18 LEU H CD1 1 +ATOM 1675 C CD2 . LEU B 2 20 ? -41.682 -31.733 -17.851 1.00 37.00 ? 18 LEU H CD2 1 +ATOM 1676 N N . ARG B 2 21 ? -46.069 -33.954 -18.509 1.00 26.43 ? 19 ARG H N 1 +ATOM 1677 C CA . ARG B 2 21 ? -46.776 -34.796 -17.543 1.00 23.40 ? 19 ARG H CA 1 +ATOM 1678 C C . ARG B 2 21 ? -45.776 -35.587 -16.716 1.00 24.13 ? 19 ARG H C 1 +ATOM 1679 O O . ARG B 2 21 ? -44.930 -36.298 -17.274 1.00 25.34 ? 19 ARG H O 1 +ATOM 1680 C CB . ARG B 2 21 ? -47.748 -35.764 -18.229 1.00 27.99 ? 19 ARG H CB 1 +ATOM 1681 C CG . ARG B 2 21 ? -48.591 -36.527 -17.205 1.00 25.62 ? 19 ARG H CG 1 +ATOM 1682 C CD . ARG B 2 21 ? -49.679 -37.407 -17.835 1.00 40.27 ? 19 ARG H CD 1 +ATOM 1683 N NE . ARG B 2 21 ? -49.162 -38.718 -18.198 1.00 53.71 ? 19 ARG H NE 1 +ATOM 1684 C CZ . ARG B 2 21 ? -49.881 -39.836 -18.184 1.00 58.65 ? 19 ARG H CZ 1 +ATOM 1685 N NH1 . ARG B 2 21 ? -49.315 -40.984 -18.534 1.00 61.14 ? 19 ARG H NH1 1 +ATOM 1686 N NH2 . ARG B 2 21 ? -51.158 -39.811 -17.814 1.00 52.48 ? 19 ARG H NH2 1 +ATOM 1687 N N . LEU B 2 22 ? -45.868 -35.462 -15.395 1.00 21.75 ? 20 LEU H N 1 +ATOM 1688 C CA . LEU B 2 22 ? -45.059 -36.250 -14.480 1.00 21.69 ? 20 LEU H CA 1 +ATOM 1689 C C . LEU B 2 22 ? -45.850 -37.456 -13.989 1.00 26.60 ? 20 LEU H C 1 +ATOM 1690 O O . LEU B 2 22 ? -47.070 -37.394 -13.854 1.00 26.08 ? 20 LEU H O 1 +ATOM 1691 C CB . LEU B 2 22 ? -44.631 -35.421 -13.281 1.00 23.49 ? 20 LEU H CB 1 +ATOM 1692 C CG . LEU B 2 22 ? -44.026 -34.064 -13.636 1.00 28.40 ? 20 LEU H CG 1 +ATOM 1693 C CD1 . LEU B 2 22 ? -43.610 -33.351 -12.365 1.00 25.95 ? 20 LEU H CD1 1 +ATOM 1694 C CD2 . LEU B 2 22 ? -42.850 -34.264 -14.587 1.00 28.80 ? 20 LEU H CD2 1 +ATOM 1695 N N . SER B 2 23 ? -45.138 -38.542 -13.699 1.00 26.59 ? 21 SER H N 1 +ATOM 1696 C CA . SER B 2 23 ? -45.716 -39.786 -13.213 1.00 25.10 ? 21 SER H CA 1 +ATOM 1697 C C . SER B 2 23 ? -45.020 -40.183 -11.924 1.00 26.91 ? 21 SER H C 1 +ATOM 1698 O O . SER B 2 23 ? -43.841 -39.884 -11.728 1.00 30.05 ? 21 SER H O 1 +ATOM 1699 C CB . SER B 2 23 ? -45.548 -40.927 -14.229 1.00 30.86 ? 21 SER H CB 1 +ATOM 1700 O OG . SER B 2 23 ? -46.235 -40.649 -15.436 1.00 37.34 ? 21 SER H OG 1 +ATOM 1701 N N . CYS B 2 24 ? -45.744 -40.903 -11.066 1.00 26.03 ? 22 CYS H N 1 +ATOM 1702 C CA . CYS B 2 24 ? -45.194 -41.340 -9.783 1.00 26.69 ? 22 CYS H CA 1 +ATOM 1703 C C . CYS B 2 24 ? -45.785 -42.713 -9.476 1.00 31.82 ? 22 CYS H C 1 +ATOM 1704 O O . CYS B 2 24 ? -46.930 -42.806 -9.030 1.00 31.04 ? 22 CYS H O 1 +ATOM 1705 C CB . CYS B 2 24 ? -45.501 -40.308 -8.696 1.00 39.14 ? 22 CYS H CB 1 +ATOM 1706 S SG . CYS B 2 24 ? -45.108 -40.806 -7.004 1.00 48.56 ? 22 CYS H SG 1 +ATOM 1707 N N . ALA B 2 25 ? -45.017 -43.770 -9.752 1.00 27.65 ? 23 ALA H N 1 +ATOM 1708 C CA . ALA B 2 25 ? -45.458 -45.143 -9.553 1.00 28.20 ? 23 ALA H CA 1 +ATOM 1709 C C . ALA B 2 25 ? -45.176 -45.556 -8.112 1.00 30.49 ? 23 ALA H C 1 +ATOM 1710 O O . ALA B 2 25 ? -44.029 -45.485 -7.654 1.00 31.25 ? 23 ALA H O 1 +ATOM 1711 C CB . ALA B 2 25 ? -44.751 -46.081 -10.534 1.00 29.48 ? 23 ALA H CB 1 +ATOM 1712 N N . ALA B 2 26 ? -46.212 -46.002 -7.407 1.00 27.71 ? 24 ALA H N 1 +ATOM 1713 C CA . ALA B 2 26 ? -46.097 -46.331 -5.992 1.00 27.24 ? 24 ALA H CA 1 +ATOM 1714 C C . ALA B 2 26 ? -46.049 -47.837 -5.768 1.00 27.62 ? 24 ALA H C 1 +ATOM 1715 O O . ALA B 2 26 ? -46.675 -48.618 -6.488 1.00 25.71 ? 24 ALA H O 1 +ATOM 1716 C CB . ALA B 2 26 ? -47.263 -45.749 -5.191 1.00 24.84 ? 24 ALA H CB 1 +ATOM 1717 N N . SER B 2 27 ? -45.307 -48.239 -4.739 1.00 24.99 ? 25 SER H N 1 +ATOM 1718 C CA . SER B 2 27 ? -45.314 -49.608 -4.247 1.00 24.01 ? 25 SER H CA 1 +ATOM 1719 C C . SER B 2 27 ? -45.393 -49.583 -2.727 1.00 27.67 ? 25 SER H C 1 +ATOM 1720 O O . SER B 2 27 ? -44.833 -48.692 -2.084 1.00 29.82 ? 25 SER H O 1 +ATOM 1721 C CB . SER B 2 27 ? -44.040 -50.382 -4.663 1.00 37.21 ? 25 SER H CB 1 +ATOM 1722 O OG . SER B 2 27 ? -43.871 -50.375 -6.066 1.00 42.50 ? 25 SER H OG 1 +ATOM 1723 N N . GLY B 2 28 ? -46.072 -50.574 -2.157 1.00 26.80 ? 26 GLY H N 1 +ATOM 1724 C CA . GLY B 2 28 ? -46.134 -50.714 -0.719 1.00 29.25 ? 26 GLY H CA 1 +ATOM 1725 C C . GLY B 2 28 ? -47.270 -49.968 -0.044 1.00 28.69 ? 26 GLY H C 1 +ATOM 1726 O O . GLY B 2 28 ? -47.387 -50.040 1.187 1.00 30.70 ? 26 GLY H O 1 +ATOM 1727 N N . PHE B 2 29 ? -48.092 -49.254 -0.804 1.00 23.02 ? 27 PHE H N 1 +ATOM 1728 C CA . PHE B 2 29 ? -49.355 -48.683 -0.338 1.00 26.15 ? 27 PHE H CA 1 +ATOM 1729 C C . PHE B 2 29 ? -50.192 -48.407 -1.578 1.00 28.82 ? 27 PHE H C 1 +ATOM 1730 O O . PHE B 2 29 ? -49.706 -48.518 -2.703 1.00 29.31 ? 27 PHE H O 1 +ATOM 1731 C CB . PHE B 2 29 ? -49.167 -47.403 0.495 1.00 26.96 ? 27 PHE H CB 1 +ATOM 1732 C CG . PHE B 2 29 ? -48.455 -46.293 -0.227 1.00 26.53 ? 27 PHE H CG 1 +ATOM 1733 C CD1 . PHE B 2 29 ? -47.072 -46.233 -0.235 1.00 37.06 ? 27 PHE H CD1 1 +ATOM 1734 C CD2 . PHE B 2 29 ? -49.169 -45.301 -0.885 1.00 26.99 ? 27 PHE H CD2 1 +ATOM 1735 C CE1 . PHE B 2 29 ? -46.414 -45.213 -0.902 1.00 38.14 ? 27 PHE H CE1 1 +ATOM 1736 C CE2 . PHE B 2 29 ? -48.515 -44.270 -1.558 1.00 32.40 ? 27 PHE H CE2 1 +ATOM 1737 C CZ . PHE B 2 29 ? -47.142 -44.227 -1.566 1.00 30.46 ? 27 PHE H CZ 1 +ATOM 1738 N N . ILE B 2 30 ? -51.447 -48.011 -1.367 1.00 25.03 ? 28 ILE H N 1 +ATOM 1739 C CA . ILE B 2 30 ? -52.415 -47.890 -2.456 1.00 23.27 ? 28 ILE H CA 1 +ATOM 1740 C C . ILE B 2 30 ? -52.704 -46.415 -2.669 1.00 23.89 ? 28 ILE H C 1 +ATOM 1741 O O . ILE B 2 30 ? -53.315 -45.763 -1.814 1.00 23.49 ? 28 ILE H O 1 +ATOM 1742 C CB . ILE B 2 30 ? -53.701 -48.684 -2.165 1.00 24.09 ? 28 ILE H CB 1 +ATOM 1743 C CG1 . ILE B 2 30 ? -53.387 -50.161 -1.963 1.00 32.93 ? 28 ILE H CG1 1 +ATOM 1744 C CG2 . ILE B 2 30 ? -54.737 -48.477 -3.274 1.00 28.26 ? 28 ILE H CG2 1 +ATOM 1745 C CD1 . ILE B 2 30 ? -52.805 -50.831 -3.167 1.00 42.33 ? 28 ILE H CD1 1 +ATOM 1746 N N . VAL B 2 31 ? -52.278 -45.897 -3.827 1.00 25.02 ? 29 VAL H N 1 +ATOM 1747 C CA . VAL B 2 31 ? -52.377 -44.469 -4.129 1.00 26.53 ? 29 VAL H CA 1 +ATOM 1748 C C . VAL B 2 31 ? -53.803 -43.968 -3.920 1.00 27.58 ? 29 VAL H C 1 +ATOM 1749 O O . VAL B 2 31 ? -54.028 -42.907 -3.324 1.00 22.38 ? 29 VAL H O 1 +ATOM 1750 C CB . VAL B 2 31 ? -51.895 -44.196 -5.567 1.00 29.96 ? 29 VAL H CB 1 +ATOM 1751 C CG1 . VAL B 2 31 ? -52.354 -42.825 -6.034 1.00 31.35 ? 29 VAL H CG1 1 +ATOM 1752 C CG2 . VAL B 2 31 ? -50.370 -44.303 -5.647 1.00 27.61 ? 29 VAL H CG2 1 +ATOM 1753 N N . SER B 2 32 ? -54.789 -44.724 -4.408 1.00 22.35 ? 30 SER H N 1 +ATOM 1754 C CA . SER B 2 32 ? -56.161 -44.214 -4.351 1.00 25.12 ? 30 SER H CA 1 +ATOM 1755 C C . SER B 2 32 ? -56.745 -44.214 -2.941 1.00 29.98 ? 30 SER H C 1 +ATOM 1756 O O . SER B 2 32 ? -57.819 -43.637 -2.739 1.00 26.15 ? 30 SER H O 1 +ATOM 1757 C CB . SER B 2 32 ? -57.068 -45.033 -5.279 1.00 26.00 ? 30 SER H CB 1 +ATOM 1758 O OG . SER B 2 32 ? -57.145 -46.374 -4.831 1.00 28.90 ? 30 SER H OG 1 +ATOM 1759 N N . SER B 2 33 ? -56.068 -44.819 -1.964 1.00 26.29 ? 31 SER H N 1 +ATOM 1760 C CA . SER B 2 33 ? -56.528 -44.820 -0.577 1.00 21.85 ? 31 SER H CA 1 +ATOM 1761 C C . SER B 2 33 ? -55.879 -43.744 0.282 1.00 26.16 ? 31 SER H C 1 +ATOM 1762 O O . SER B 2 33 ? -56.164 -43.687 1.484 1.00 24.98 ? 31 SER H O 1 +ATOM 1763 C CB . SER B 2 33 ? -56.267 -46.184 0.068 1.00 26.32 ? 31 SER H CB 1 +ATOM 1764 O OG . SER B 2 33 ? -56.900 -47.216 -0.666 1.00 28.17 ? 31 SER H OG 1 +ATOM 1765 N N . ASN B 2 34 ? -55.031 -42.895 -0.292 1.00 23.76 ? 32 ASN H N 1 +ATOM 1766 C CA . ASN B 2 34 ? -54.170 -42.006 0.482 1.00 26.44 ? 32 ASN H CA 1 +ATOM 1767 C C . ASN B 2 34 ? -54.264 -40.560 0.020 1.00 22.63 ? 32 ASN H C 1 +ATOM 1768 O O . ASN B 2 34 ? -54.608 -40.265 -1.126 1.00 24.66 ? 32 ASN H O 1 +ATOM 1769 C CB . ASN B 2 34 ? -52.703 -42.440 0.379 1.00 21.81 ? 32 ASN H CB 1 +ATOM 1770 C CG . ASN B 2 34 ? -52.423 -43.654 1.218 1.00 24.02 ? 32 ASN H CG 1 +ATOM 1771 O OD1 . ASN B 2 34 ? -52.061 -43.534 2.397 1.00 24.54 ? 32 ASN H OD1 1 +ATOM 1772 N ND2 . ASN B 2 34 ? -52.622 -44.838 0.635 1.00 21.80 ? 32 ASN H ND2 1 +ATOM 1773 N N . TYR B 2 35 ? -53.917 -39.656 0.938 1.00 22.43 ? 33 TYR H N 1 +ATOM 1774 C CA . TYR B 2 35 ? -53.624 -38.271 0.590 1.00 23.54 ? 33 TYR H CA 1 +ATOM 1775 C C . TYR B 2 35 ? -52.294 -38.240 -0.151 1.00 28.94 ? 33 TYR H C 1 +ATOM 1776 O O . TYR B 2 35 ? -51.248 -38.487 0.455 1.00 25.92 ? 33 TYR H O 1 +ATOM 1777 C CB . TYR B 2 35 ? -53.520 -37.412 1.843 1.00 19.67 ? 33 TYR H CB 1 +ATOM 1778 C CG . TYR B 2 35 ? -54.832 -37.189 2.588 1.00 20.35 ? 33 TYR H CG 1 +ATOM 1779 C CD1 . TYR B 2 35 ? -55.694 -36.161 2.214 1.00 22.61 ? 33 TYR H CD1 1 +ATOM 1780 C CD2 . TYR B 2 35 ? -55.173 -37.970 3.679 1.00 21.10 ? 33 TYR H CD2 1 +ATOM 1781 C CE1 . TYR B 2 35 ? -56.889 -35.927 2.910 1.00 24.73 ? 33 TYR H CE1 1 +ATOM 1782 C CE2 . TYR B 2 35 ? -56.368 -37.748 4.382 1.00 23.65 ? 33 TYR H CE2 1 +ATOM 1783 C CZ . TYR B 2 35 ? -57.220 -36.723 3.983 1.00 24.20 ? 33 TYR H CZ 1 +ATOM 1784 O OH . TYR B 2 35 ? -58.411 -36.507 4.673 1.00 25.29 ? 33 TYR H OH 1 +ATOM 1785 N N . MET B 2 36 ? -52.307 -37.920 -1.436 1.00 20.41 ? 34 MET H N 1 +ATOM 1786 C CA . MET B 2 36 ? -51.070 -37.876 -2.211 1.00 20.51 ? 34 MET H CA 1 +ATOM 1787 C C . MET B 2 36 ? -50.811 -36.465 -2.707 1.00 23.52 ? 34 MET H C 1 +ATOM 1788 O O . MET B 2 36 ? -51.712 -35.820 -3.252 1.00 23.12 ? 34 MET H O 1 +ATOM 1789 C CB . MET B 2 36 ? -51.124 -38.833 -3.404 1.00 21.06 ? 34 MET H CB 1 +ATOM 1790 C CG . MET B 2 36 ? -51.449 -40.281 -3.031 1.00 22.42 ? 34 MET H CG 1 +ATOM 1791 S SD . MET B 2 36 ? -50.058 -41.030 -2.146 1.00 25.32 ? 34 MET H SD 1 +ATOM 1792 C CE . MET B 2 36 ? -48.741 -40.779 -3.353 1.00 24.88 ? 34 MET H CE 1 +ATOM 1793 N N . SER B 2 37 ? -49.558 -36.011 -2.588 1.00 23.48 ? 35 SER H N 1 +ATOM 1794 C CA . SER B 2 37 ? -49.209 -34.638 -2.932 1.00 19.06 ? 35 SER H CA 1 +ATOM 1795 C C . SER B 2 37 ? -48.032 -34.591 -3.895 1.00 24.32 ? 35 SER H C 1 +ATOM 1796 O O . SER B 2 37 ? -47.230 -35.518 -3.973 1.00 24.08 ? 35 SER H O 1 +ATOM 1797 C CB . SER B 2 37 ? -48.843 -33.802 -1.689 1.00 22.85 ? 35 SER H CB 1 +ATOM 1798 O OG . SER B 2 37 ? -50.009 -33.289 -1.057 1.00 27.45 ? 35 SER H OG 1 +ATOM 1799 N N . TRP B 2 38 ? -47.941 -33.478 -4.612 1.00 19.50 ? 36 TRP H N 1 +ATOM 1800 C CA . TRP B 2 38 ? -46.727 -33.075 -5.308 1.00 19.70 ? 36 TRP H CA 1 +ATOM 1801 C C . TRP B 2 38 ? -46.152 -31.876 -4.570 1.00 22.01 ? 36 TRP H C 1 +ATOM 1802 O O . TRP B 2 38 ? -46.894 -30.975 -4.164 1.00 21.09 ? 36 TRP H O 1 +ATOM 1803 C CB . TRP B 2 38 ? -47.003 -32.719 -6.769 1.00 19.26 ? 36 TRP H CB 1 +ATOM 1804 C CG . TRP B 2 38 ? -47.361 -33.892 -7.629 1.00 19.77 ? 36 TRP H CG 1 +ATOM 1805 C CD1 . TRP B 2 38 ? -48.626 -34.353 -7.900 1.00 22.16 ? 36 TRP H CD1 1 +ATOM 1806 C CD2 . TRP B 2 38 ? -46.458 -34.760 -8.332 1.00 23.41 ? 36 TRP H CD2 1 +ATOM 1807 N NE1 . TRP B 2 38 ? -48.561 -35.449 -8.731 1.00 23.44 ? 36 TRP H NE1 1 +ATOM 1808 C CE2 . TRP B 2 38 ? -47.242 -35.721 -9.007 1.00 21.79 ? 36 TRP H CE2 1 +ATOM 1809 C CE3 . TRP B 2 38 ? -45.060 -34.821 -8.454 1.00 24.41 ? 36 TRP H CE3 1 +ATOM 1810 C CZ2 . TRP B 2 38 ? -46.676 -36.735 -9.795 1.00 26.96 ? 36 TRP H CZ2 1 +ATOM 1811 C CZ3 . TRP B 2 38 ? -44.499 -35.825 -9.245 1.00 24.82 ? 36 TRP H CZ3 1 +ATOM 1812 C CH2 . TRP B 2 38 ? -45.310 -36.768 -9.907 1.00 25.28 ? 36 TRP H CH2 1 +ATOM 1813 N N . VAL B 2 39 ? -44.830 -31.900 -4.365 1.00 17.50 ? 37 VAL H N 1 +ATOM 1814 C CA . VAL B 2 39 ? -44.089 -30.855 -3.672 1.00 17.64 ? 37 VAL H CA 1 +ATOM 1815 C C . VAL B 2 39 ? -42.860 -30.553 -4.523 1.00 20.18 ? 37 VAL H C 1 +ATOM 1816 O O . VAL B 2 39 ? -42.198 -31.482 -4.991 1.00 22.17 ? 37 VAL H O 1 +ATOM 1817 C CB . VAL B 2 39 ? -43.667 -31.310 -2.257 1.00 19.93 ? 37 VAL H CB 1 +ATOM 1818 C CG1 . VAL B 2 39 ? -42.766 -30.286 -1.600 1.00 21.14 ? 37 VAL H CG1 1 +ATOM 1819 C CG2 . VAL B 2 39 ? -44.911 -31.563 -1.365 1.00 22.19 ? 37 VAL H CG2 1 +ATOM 1820 N N . ARG B 2 40 ? -42.542 -29.276 -4.717 1.00 18.24 ? 38 ARG H N 1 +ATOM 1821 C CA . ARG B 2 40 ? -41.401 -28.971 -5.592 1.00 18.30 ? 38 ARG H CA 1 +ATOM 1822 C C . ARG B 2 40 ? -40.382 -28.097 -4.878 1.00 17.27 ? 38 ARG H C 1 +ATOM 1823 O O . ARG B 2 40 ? -40.641 -27.515 -3.823 1.00 21.97 ? 38 ARG H O 1 +ATOM 1824 C CB . ARG B 2 40 ? -41.847 -28.291 -6.890 1.00 20.19 ? 38 ARG H CB 1 +ATOM 1825 C CG . ARG B 2 40 ? -42.329 -26.867 -6.705 1.00 23.58 ? 38 ARG H CG 1 +ATOM 1826 C CD . ARG B 2 40 ? -42.930 -26.306 -8.020 1.00 22.52 ? 38 ARG H CD 1 +ATOM 1827 N NE . ARG B 2 40 ? -43.483 -24.971 -7.798 1.00 23.61 ? 38 ARG H NE 1 +ATOM 1828 C CZ . ARG B 2 40 ? -44.089 -24.234 -8.725 1.00 28.32 ? 38 ARG H CZ 1 +ATOM 1829 N NH1 . ARG B 2 40 ? -44.233 -24.702 -9.958 1.00 23.45 ? 38 ARG H NH1 1 +ATOM 1830 N NH2 . ARG B 2 40 ? -44.555 -23.026 -8.411 1.00 26.03 ? 38 ARG H NH2 1 +ATOM 1831 N N . GLN B 2 41 ? -39.197 -28.003 -5.490 1.00 21.62 ? 39 GLN H N 1 +ATOM 1832 C CA . GLN B 2 41 ? -38.090 -27.281 -4.871 1.00 20.65 ? 39 GLN H CA 1 +ATOM 1833 C C . GLN B 2 41 ? -37.285 -26.642 -5.992 1.00 19.67 ? 39 GLN H C 1 +ATOM 1834 O O . GLN B 2 41 ? -36.578 -27.343 -6.729 1.00 21.30 ? 39 GLN H O 1 +ATOM 1835 C CB . GLN B 2 41 ? -37.232 -28.225 -4.039 1.00 23.27 ? 39 GLN H CB 1 +ATOM 1836 C CG . GLN B 2 41 ? -36.102 -27.530 -3.290 1.00 24.87 ? 39 GLN H CG 1 +ATOM 1837 C CD . GLN B 2 41 ? -35.458 -28.437 -2.260 1.00 29.05 ? 39 GLN H CD 1 +ATOM 1838 O OE1 . GLN B 2 41 ? -35.230 -29.624 -2.510 1.00 29.95 ? 39 GLN H OE1 1 +ATOM 1839 N NE2 . GLN B 2 41 ? -35.159 -27.880 -1.096 1.00 27.52 ? 39 GLN H NE2 1 +ATOM 1840 N N . ALA B 2 42 ? -37.426 -25.334 -6.154 1.00 23.93 ? 40 ALA H N 1 +ATOM 1841 C CA . ALA B 2 42 ? -36.636 -24.621 -7.155 1.00 23.97 ? 40 ALA H CA 1 +ATOM 1842 C C . ALA B 2 42 ? -35.166 -24.578 -6.733 1.00 33.44 ? 40 ALA H C 1 +ATOM 1843 O O . ALA B 2 42 ? -34.848 -24.733 -5.552 1.00 24.69 ? 40 ALA H O 1 +ATOM 1844 C CB . ALA B 2 42 ? -37.189 -23.213 -7.345 1.00 26.76 ? 40 ALA H CB 1 +ATOM 1845 N N . PRO B 2 43 ? -34.248 -24.386 -7.690 1.00 28.62 ? 41 PRO H N 1 +ATOM 1846 C CA . PRO B 2 43 ? -32.816 -24.459 -7.363 1.00 28.63 ? 41 PRO H CA 1 +ATOM 1847 C C . PRO B 2 43 ? -32.429 -23.464 -6.277 1.00 23.25 ? 41 PRO H C 1 +ATOM 1848 O O . PRO B 2 43 ? -32.753 -22.277 -6.349 1.00 29.96 ? 41 PRO H O 1 +ATOM 1849 C CB . PRO B 2 43 ? -32.130 -24.138 -8.700 1.00 35.40 ? 41 PRO H CB 1 +ATOM 1850 C CG . PRO B 2 43 ? -33.126 -24.572 -9.762 1.00 28.94 ? 41 PRO H CG 1 +ATOM 1851 C CD . PRO B 2 43 ? -34.486 -24.244 -9.145 1.00 25.47 ? 41 PRO H CD 1 +ATOM 1852 N N . GLY B 2 44 ? -31.758 -23.973 -5.246 1.00 30.38 ? 42 GLY H N 1 +ATOM 1853 C CA . GLY B 2 44 ? -31.326 -23.153 -4.131 1.00 31.00 ? 42 GLY H CA 1 +ATOM 1854 C C . GLY B 2 44 ? -32.420 -22.661 -3.207 1.00 38.96 ? 42 GLY H C 1 +ATOM 1855 O O . GLY B 2 44 ? -32.143 -21.834 -2.336 1.00 35.50 ? 42 GLY H O 1 +ATOM 1856 N N . LYS B 2 45 ? -33.651 -23.139 -3.353 1.00 27.05 ? 43 LYS H N 1 +ATOM 1857 C CA . LYS B 2 45 ? -34.786 -22.637 -2.577 1.00 23.96 ? 43 LYS H CA 1 +ATOM 1858 C C . LYS B 2 45 ? -35.365 -23.754 -1.707 1.00 20.62 ? 43 LYS H C 1 +ATOM 1859 O O . LYS B 2 45 ? -34.873 -24.877 -1.693 1.00 24.70 ? 43 LYS H O 1 +ATOM 1860 C CB . LYS B 2 45 ? -35.861 -22.055 -3.506 1.00 25.27 ? 43 LYS H CB 1 +ATOM 1861 C CG . LYS B 2 45 ? -35.359 -20.954 -4.444 1.00 41.88 ? 43 LYS H CG 1 +ATOM 1862 C CD . LYS B 2 45 ? -35.525 -19.580 -3.819 1.00 56.81 ? 43 LYS H CD 1 +ATOM 1863 C CE . LYS B 2 45 ? -35.406 -18.473 -4.861 1.00 67.13 ? 43 LYS H CE 1 +ATOM 1864 N NZ . LYS B 2 45 ? -34.019 -17.945 -4.959 1.00 71.32 ? 43 LYS H NZ 1 +ATOM 1865 N N . GLY B 2 46 ? -36.422 -23.423 -0.966 1.00 22.40 ? 44 GLY H N 1 +ATOM 1866 C CA . GLY B 2 46 ? -37.042 -24.357 -0.049 1.00 28.88 ? 44 GLY H CA 1 +ATOM 1867 C C . GLY B 2 46 ? -38.126 -25.189 -0.713 1.00 29.67 ? 44 GLY H C 1 +ATOM 1868 O O . GLY B 2 46 ? -38.322 -25.166 -1.929 1.00 28.42 ? 44 GLY H O 1 +ATOM 1869 N N . LEU B 2 47 ? -38.842 -25.939 0.113 1.00 26.61 ? 45 LEU H N 1 +ATOM 1870 C CA . LEU B 2 47 ? -39.935 -26.772 -0.375 1.00 23.61 ? 45 LEU H CA 1 +ATOM 1871 C C . LEU B 2 47 ? -41.205 -25.949 -0.565 1.00 24.09 ? 45 LEU H C 1 +ATOM 1872 O O . LEU B 2 47 ? -41.498 -25.041 0.218 1.00 23.52 ? 45 LEU H O 1 +ATOM 1873 C CB . LEU B 2 47 ? -40.201 -27.911 0.602 1.00 23.50 ? 45 LEU H CB 1 +ATOM 1874 C CG . LEU B 2 47 ? -38.978 -28.768 0.958 1.00 26.06 ? 45 LEU H CG 1 +ATOM 1875 C CD1 . LEU B 2 47 ? -39.298 -29.719 2.115 1.00 25.05 ? 45 LEU H CD1 1 +ATOM 1876 C CD2 . LEU B 2 47 ? -38.488 -29.544 -0.242 1.00 25.42 ? 45 LEU H CD2 1 +ATOM 1877 N N . GLU B 2 48 ? -41.962 -26.276 -1.612 1.00 23.86 ? 46 GLU H N 1 +ATOM 1878 C CA . GLU B 2 48 ? -43.230 -25.608 -1.895 1.00 26.33 ? 46 GLU H CA 1 +ATOM 1879 C C . GLU B 2 48 ? -44.254 -26.658 -2.291 1.00 20.95 ? 46 GLU H C 1 +ATOM 1880 O O . GLU B 2 48 ? -44.067 -27.339 -3.293 1.00 21.49 ? 46 GLU H O 1 +ATOM 1881 C CB . GLU B 2 48 ? -43.099 -24.579 -3.024 1.00 26.47 ? 46 GLU H CB 1 +ATOM 1882 C CG . GLU B 2 48 ? -44.423 -23.831 -3.278 1.00 29.47 ? 46 GLU H CG 1 +ATOM 1883 C CD . GLU B 2 48 ? -44.450 -23.018 -4.573 1.00 31.37 ? 46 GLU H CD 1 +ATOM 1884 O OE1 . GLU B 2 48 ? -43.617 -23.265 -5.474 1.00 30.75 ? 46 GLU H OE1 1 +ATOM 1885 O OE2 . GLU B 2 48 ? -45.320 -22.121 -4.687 1.00 34.64 ? 46 GLU H OE2 1 +ATOM 1886 N N . TRP B 2 49 ? -45.344 -26.761 -1.538 1.00 21.11 ? 47 TRP H N 1 +ATOM 1887 C CA . TRP B 2 49 ? -46.393 -27.702 -1.910 1.00 20.42 ? 47 TRP H CA 1 +ATOM 1888 C C . TRP B 2 49 ? -47.097 -27.229 -3.179 1.00 21.12 ? 47 TRP H C 1 +ATOM 1889 O O . TRP B 2 49 ? -47.307 -26.031 -3.379 1.00 22.55 ? 47 TRP H O 1 +ATOM 1890 C CB . TRP B 2 49 ? -47.394 -27.830 -0.754 1.00 24.62 ? 47 TRP H CB 1 +ATOM 1891 C CG . TRP B 2 49 ? -48.621 -28.583 -1.116 1.00 24.85 ? 47 TRP H CG 1 +ATOM 1892 C CD1 . TRP B 2 49 ? -48.774 -29.935 -1.146 1.00 27.51 ? 47 TRP H CD1 1 +ATOM 1893 C CD2 . TRP B 2 49 ? -49.887 -28.023 -1.495 1.00 23.98 ? 47 TRP H CD2 1 +ATOM 1894 N NE1 . TRP B 2 49 ? -50.070 -30.261 -1.516 1.00 24.97 ? 47 TRP H NE1 1 +ATOM 1895 C CE2 . TRP B 2 49 ? -50.767 -29.103 -1.745 1.00 23.43 ? 47 TRP H CE2 1 +ATOM 1896 C CE3 . TRP B 2 49 ? -50.365 -26.714 -1.640 1.00 23.97 ? 47 TRP H CE3 1 +ATOM 1897 C CZ2 . TRP B 2 49 ? -52.106 -28.914 -2.132 1.00 27.40 ? 47 TRP H CZ2 1 +ATOM 1898 C CZ3 . TRP B 2 49 ? -51.708 -26.527 -2.037 1.00 23.21 ? 47 TRP H CZ3 1 +ATOM 1899 C CH2 . TRP B 2 49 ? -52.553 -27.622 -2.269 1.00 25.15 ? 47 TRP H CH2 1 +ATOM 1900 N N . VAL B 2 50 ? -47.496 -28.178 -4.029 1.00 18.35 ? 48 VAL H N 1 +ATOM 1901 C CA . VAL B 2 50 ? -48.055 -27.890 -5.343 1.00 20.79 ? 48 VAL H CA 1 +ATOM 1902 C C . VAL B 2 50 ? -49.520 -28.318 -5.441 1.00 25.51 ? 48 VAL H C 1 +ATOM 1903 O O . VAL B 2 50 ? -50.379 -27.549 -5.894 1.00 22.46 ? 48 VAL H O 1 +ATOM 1904 C CB . VAL B 2 50 ? -47.221 -28.568 -6.458 1.00 26.99 ? 48 VAL H CB 1 +ATOM 1905 C CG1 . VAL B 2 50 ? -47.880 -28.417 -7.811 1.00 22.88 ? 48 VAL H CG1 1 +ATOM 1906 C CG2 . VAL B 2 50 ? -45.816 -27.991 -6.468 1.00 31.53 ? 48 VAL H CG2 1 +ATOM 1907 N N . SER B 2 51 ? -49.811 -29.563 -5.077 1.00 19.94 ? 49 SER H N 1 +ATOM 1908 C CA . SER B 2 51 ? -51.157 -30.066 -5.326 1.00 20.83 ? 49 SER H CA 1 +ATOM 1909 C C . SER B 2 51 ? -51.376 -31.329 -4.498 1.00 23.03 ? 49 SER H C 1 +ATOM 1910 O O . SER B 2 51 ? -50.421 -32.029 -4.155 1.00 23.43 ? 49 SER H O 1 +ATOM 1911 C CB . SER B 2 51 ? -51.365 -30.333 -6.819 1.00 27.72 ? 49 SER H CB 1 +ATOM 1912 O OG . SER B 2 51 ? -52.572 -31.033 -7.045 1.00 28.86 ? 49 SER H OG 1 +ATOM 1913 N N . VAL B 2 52 ? -52.638 -31.608 -4.166 1.00 23.24 ? 50 VAL H N 1 +ATOM 1914 C CA . VAL B 2 52 ? -52.987 -32.807 -3.406 1.00 23.80 ? 50 VAL H CA 1 +ATOM 1915 C C . VAL B 2 52 ? -54.234 -33.442 -4.015 1.00 22.75 ? 50 VAL H C 1 +ATOM 1916 O O . VAL B 2 52 ? -55.065 -32.758 -4.621 1.00 21.86 ? 50 VAL H O 1 +ATOM 1917 C CB . VAL B 2 52 ? -53.211 -32.491 -1.910 1.00 23.95 ? 50 VAL H CB 1 +ATOM 1918 C CG1 . VAL B 2 52 ? -54.513 -31.723 -1.713 1.00 21.46 ? 50 VAL H CG1 1 +ATOM 1919 C CG2 . VAL B 2 52 ? -53.231 -33.791 -1.077 1.00 25.42 ? 50 VAL H CG2 1 +ATOM 1920 N N . ILE B 2 53 ? -54.353 -34.764 -3.877 1.00 20.69 ? 51 ILE H N 1 +ATOM 1921 C CA . ILE B 2 53 ? -55.590 -35.464 -4.227 1.00 26.18 ? 51 ILE H CA 1 +ATOM 1922 C C . ILE B 2 53 ? -55.992 -36.368 -3.062 1.00 29.05 ? 51 ILE H C 1 +ATOM 1923 O O . ILE B 2 53 ? -55.169 -37.130 -2.538 1.00 25.62 ? 51 ILE H O 1 +ATOM 1924 C CB . ILE B 2 53 ? -55.473 -36.247 -5.557 1.00 22.92 ? 51 ILE H CB 1 +ATOM 1925 C CG1 . ILE B 2 53 ? -56.805 -36.918 -5.895 1.00 22.17 ? 51 ILE H CG1 1 +ATOM 1926 C CG2 . ILE B 2 53 ? -54.337 -37.295 -5.546 1.00 21.85 ? 51 ILE H CG2 1 +ATOM 1927 C CD1 . ILE B 2 53 ? -56.896 -37.384 -7.340 1.00 23.07 ? 51 ILE H CD1 1 +ATOM 1928 N N . TYR B 2 54 ? -57.250 -36.246 -2.627 1.00 21.29 ? 52 TYR H N 1 +ATOM 1929 C CA . TYR B 2 54 ? -57.761 -37.028 -1.515 1.00 19.69 ? 52 TYR H CA 1 +ATOM 1930 C C . TYR B 2 54 ? -58.193 -38.407 -1.996 1.00 22.65 ? 52 TYR H C 1 +ATOM 1931 O O . TYR B 2 54 ? -58.524 -38.604 -3.167 1.00 25.12 ? 52 TYR H O 1 +ATOM 1932 C CB . TYR B 2 54 ? -58.981 -36.335 -0.877 1.00 18.76 ? 52 TYR H CB 1 +ATOM 1933 C CG . TYR B 2 54 ? -58.718 -35.077 -0.094 1.00 22.78 ? 52 TYR H CG 1 +ATOM 1934 C CD1 . TYR B 2 54 ? -57.495 -34.415 -0.160 1.00 23.05 ? 52 TYR H CD1 1 +ATOM 1935 C CD2 . TYR B 2 54 ? -59.699 -34.559 0.745 1.00 20.94 ? 52 TYR H CD2 1 +ATOM 1936 C CE1 . TYR B 2 54 ? -57.263 -33.272 0.584 1.00 20.59 ? 52 TYR H CE1 1 +ATOM 1937 C CE2 . TYR B 2 54 ? -59.477 -33.405 1.478 1.00 21.66 ? 52 TYR H CE2 1 +ATOM 1938 C CZ . TYR B 2 54 ? -58.263 -32.761 1.389 1.00 26.21 ? 52 TYR H CZ 1 +ATOM 1939 O OH . TYR B 2 54 ? -58.046 -31.627 2.150 1.00 27.63 ? 52 TYR H OH 1 +ATOM 1940 N N . SER B 2 55 ? -58.257 -39.361 -1.059 1.00 20.96 ? 53 SER H N 1 +ATOM 1941 C CA . SER B 2 55 ? -58.740 -40.697 -1.417 1.00 20.45 ? 53 SER H CA 1 +ATOM 1942 C C . SER B 2 55 ? -60.121 -40.631 -2.065 1.00 27.91 ? 53 SER H C 1 +ATOM 1943 O O . SER B 2 55 ? -60.389 -41.334 -3.049 1.00 24.92 ? 53 SER H O 1 +ATOM 1944 C CB . SER B 2 55 ? -58.770 -41.595 -0.179 1.00 28.72 ? 53 SER H CB 1 +ATOM 1945 O OG . SER B 2 55 ? -59.628 -41.047 0.820 1.00 36.11 ? 53 SER H OG 1 +ATOM 1946 N N . GLY B 2 56 ? -61.008 -39.786 -1.535 1.00 27.18 ? 54 GLY H N 1 +ATOM 1947 C CA . GLY B 2 56 ? -62.329 -39.644 -2.125 1.00 28.75 ? 54 GLY H CA 1 +ATOM 1948 C C . GLY B 2 56 ? -62.383 -38.865 -3.425 1.00 28.95 ? 54 GLY H C 1 +ATOM 1949 O O . GLY B 2 56 ? -63.454 -38.791 -4.037 1.00 28.34 ? 54 GLY H O 1 +ATOM 1950 N N . GLY B 2 57 ? -61.273 -38.264 -3.853 1.00 26.03 ? 55 GLY H N 1 +ATOM 1951 C CA . GLY B 2 57 ? -61.176 -37.636 -5.157 1.00 26.72 ? 55 GLY H CA 1 +ATOM 1952 C C . GLY B 2 57 ? -61.046 -36.120 -5.162 1.00 26.74 ? 55 GLY H C 1 +ATOM 1953 O O . GLY B 2 57 ? -60.699 -35.554 -6.210 1.00 27.84 ? 55 GLY H O 1 +ATOM 1954 N N . SER B 2 58 ? -61.334 -35.434 -4.056 1.00 22.80 ? 56 SER H N 1 +ATOM 1955 C CA . SER B 2 58 ? -61.146 -33.985 -4.047 1.00 22.06 ? 56 SER H CA 1 +ATOM 1956 C C . SER B 2 58 ? -59.690 -33.640 -4.353 1.00 28.42 ? 56 SER H C 1 +ATOM 1957 O O . SER B 2 58 ? -58.770 -34.376 -3.986 1.00 24.30 ? 56 SER H O 1 +ATOM 1958 C CB . SER B 2 58 ? -61.552 -33.381 -2.698 1.00 24.74 ? 56 SER H CB 1 +ATOM 1959 O OG . SER B 2 58 ? -62.938 -33.579 -2.435 1.00 25.31 ? 56 SER H OG 1 +ATOM 1960 N N . THR B 2 59 ? -59.491 -32.512 -5.039 1.00 21.66 ? 57 THR H N 1 +ATOM 1961 C CA . THR B 2 59 ? -58.162 -32.038 -5.434 1.00 24.17 ? 57 THR H CA 1 +ATOM 1962 C C . THR B 2 59 ? -58.006 -30.569 -5.064 1.00 27.11 ? 57 THR H C 1 +ATOM 1963 O O . THR B 2 59 ? -58.968 -29.802 -5.111 1.00 25.24 ? 57 THR H O 1 +ATOM 1964 C CB . THR B 2 59 ? -57.933 -32.216 -6.953 1.00 25.79 ? 57 THR H CB 1 +ATOM 1965 O OG1 . THR B 2 59 ? -58.970 -31.529 -7.673 1.00 25.08 ? 57 THR H OG1 1 +ATOM 1966 C CG2 . THR B 2 59 ? -57.952 -33.689 -7.342 1.00 26.87 ? 57 THR H CG2 1 +ATOM 1967 N N . TYR B 2 60 ? -56.784 -30.179 -4.687 1.00 23.45 ? 58 TYR H N 1 +ATOM 1968 C CA . TYR B 2 60 ? -56.473 -28.789 -4.372 1.00 22.47 ? 58 TYR H CA 1 +ATOM 1969 C C . TYR B 2 60 ? -55.106 -28.443 -4.933 1.00 24.62 ? 58 TYR H C 1 +ATOM 1970 O O . TYR B 2 60 ? -54.270 -29.322 -5.134 1.00 23.13 ? 58 TYR H O 1 +ATOM 1971 C CB . TYR B 2 60 ? -56.487 -28.524 -2.866 1.00 22.75 ? 58 TYR H CB 1 +ATOM 1972 C CG . TYR B 2 60 ? -57.803 -28.960 -2.294 1.00 25.52 ? 58 TYR H CG 1 +ATOM 1973 C CD1 . TYR B 2 60 ? -58.912 -28.132 -2.361 1.00 29.23 ? 58 TYR H CD1 1 +ATOM 1974 C CD2 . TYR B 2 60 ? -57.958 -30.233 -1.774 1.00 27.05 ? 58 TYR H CD2 1 +ATOM 1975 C CE1 . TYR B 2 60 ? -60.142 -28.549 -1.882 1.00 30.22 ? 58 TYR H CE1 1 +ATOM 1976 C CE2 . TYR B 2 60 ? -59.186 -30.665 -1.289 1.00 31.61 ? 58 TYR H CE2 1 +ATOM 1977 C CZ . TYR B 2 60 ? -60.271 -29.813 -1.343 1.00 29.32 ? 58 TYR H CZ 1 +ATOM 1978 O OH . TYR B 2 60 ? -61.492 -30.241 -0.864 1.00 34.92 ? 58 TYR H OH 1 +ATOM 1979 N N . TYR B 2 61 ? -54.878 -27.141 -5.125 1.00 21.09 ? 59 TYR H N 1 +ATOM 1980 C CA . TYR B 2 61 ? -53.714 -26.630 -5.844 1.00 21.14 ? 59 TYR H CA 1 +ATOM 1981 C C . TYR B 2 61 ? -53.173 -25.396 -5.147 1.00 28.49 ? 59 TYR H C 1 +ATOM 1982 O O . TYR B 2 61 ? -53.945 -24.585 -4.639 1.00 23.99 ? 59 TYR H O 1 +ATOM 1983 C CB . TYR B 2 61 ? -54.085 -26.264 -7.290 1.00 22.20 ? 59 TYR H CB 1 +ATOM 1984 C CG . TYR B 2 61 ? -54.567 -27.456 -8.066 1.00 22.16 ? 59 TYR H CG 1 +ATOM 1985 C CD1 . TYR B 2 61 ? -53.660 -28.294 -8.708 1.00 22.81 ? 59 TYR H CD1 1 +ATOM 1986 C CD2 . TYR B 2 61 ? -55.919 -27.767 -8.134 1.00 25.96 ? 59 TYR H CD2 1 +ATOM 1987 C CE1 . TYR B 2 61 ? -54.087 -29.405 -9.407 1.00 22.72 ? 59 TYR H CE1 1 +ATOM 1988 C CE2 . TYR B 2 61 ? -56.362 -28.877 -8.833 1.00 28.12 ? 59 TYR H CE2 1 +ATOM 1989 C CZ . TYR B 2 61 ? -55.440 -29.688 -9.474 1.00 27.61 ? 59 TYR H CZ 1 +ATOM 1990 O OH . TYR B 2 61 ? -55.870 -30.794 -10.170 1.00 22.77 ? 59 TYR H OH 1 +ATOM 1991 N N . ALA B 2 62 ? -51.851 -25.236 -5.158 1.00 21.63 ? 60 ALA H N 1 +ATOM 1992 C CA . ALA B 2 62 ? -51.270 -23.986 -4.694 1.00 25.06 ? 60 ALA H CA 1 +ATOM 1993 C C . ALA B 2 62 ? -51.708 -22.837 -5.599 1.00 32.98 ? 60 ALA H C 1 +ATOM 1994 O O . ALA B 2 62 ? -51.894 -23.006 -6.802 1.00 25.11 ? 60 ALA H O 1 +ATOM 1995 C CB . ALA B 2 62 ? -49.743 -24.088 -4.674 1.00 26.50 ? 60 ALA H CB 1 +ATOM 1996 N N . ASP B 2 63 ? -51.863 -21.647 -5.015 1.00 28.56 ? 61 ASP H N 1 +ATOM 1997 C CA . ASP B 2 63 ? -52.317 -20.509 -5.812 1.00 30.29 ? 61 ASP H CA 1 +ATOM 1998 C C . ASP B 2 63 ? -51.398 -20.256 -7.006 1.00 33.77 ? 61 ASP H C 1 +ATOM 1999 O O . ASP B 2 63 ? -51.860 -19.817 -8.064 1.00 30.10 ? 61 ASP H O 1 +ATOM 2000 C CB . ASP B 2 63 ? -52.410 -19.261 -4.935 1.00 44.55 ? 61 ASP H CB 1 +ATOM 2001 C CG . ASP B 2 63 ? -52.985 -18.075 -5.677 1.00 78.77 ? 61 ASP H CG 1 +ATOM 2002 O OD1 . ASP B 2 63 ? -54.121 -18.195 -6.184 1.00 91.51 ? 61 ASP H OD1 1 +ATOM 2003 O OD2 . ASP B 2 63 ? -52.307 -17.026 -5.755 1.00 90.75 ? 61 ASP H OD2 1 +ATOM 2004 N N . SER B 2 64 ? -50.111 -20.557 -6.869 1.00 30.97 ? 62 SER H N 1 +ATOM 2005 C CA . SER B 2 64 ? -49.159 -20.288 -7.943 1.00 32.09 ? 62 SER H CA 1 +ATOM 2006 C C . SER B 2 64 ? -49.313 -21.206 -9.151 1.00 34.37 ? 62 SER H C 1 +ATOM 2007 O O . SER B 2 64 ? -48.693 -20.920 -10.185 1.00 32.89 ? 62 SER H O 1 +ATOM 2008 C CB . SER B 2 64 ? -47.726 -20.424 -7.433 1.00 33.72 ? 62 SER H CB 1 +ATOM 2009 O OG . SER B 2 64 ? -47.541 -21.699 -6.854 1.00 36.59 ? 62 SER H OG 1 +ATOM 2010 N N . VAL B 2 65 ? -50.071 -22.303 -9.052 1.00 23.98 ? 63 VAL H N 1 +ATOM 2011 C CA . VAL B 2 65 ? -50.238 -23.222 -10.174 1.00 25.08 ? 63 VAL H CA 1 +ATOM 2012 C C . VAL B 2 65 ? -51.696 -23.435 -10.557 1.00 30.14 ? 63 VAL H C 1 +ATOM 2013 O O . VAL B 2 65 ? -51.975 -24.215 -11.482 1.00 26.38 ? 63 VAL H O 1 +ATOM 2014 C CB . VAL B 2 65 ? -49.546 -24.580 -9.910 1.00 24.69 ? 63 VAL H CB 1 +ATOM 2015 C CG1 . VAL B 2 65 ? -48.081 -24.366 -9.528 1.00 24.71 ? 63 VAL H CG1 1 +ATOM 2016 C CG2 . VAL B 2 65 ? -50.282 -25.385 -8.834 1.00 23.30 ? 63 VAL H CG2 1 +ATOM 2017 N N . LYS B 2 66 ? -52.635 -22.740 -9.906 1.00 28.64 ? 64 LYS H N 1 +ATOM 2018 C CA . LYS B 2 66 ? -54.055 -22.947 -10.167 1.00 34.39 ? 64 LYS H CA 1 +ATOM 2019 C C . LYS B 2 66 ? -54.396 -22.632 -11.616 1.00 25.76 ? 64 LYS H C 1 +ATOM 2020 O O . LYS B 2 66 ? -53.937 -21.633 -12.177 1.00 29.14 ? 64 LYS H O 1 +ATOM 2021 C CB . LYS B 2 66 ? -54.905 -22.065 -9.245 1.00 47.85 ? 64 LYS H CB 1 +ATOM 2022 C CG . LYS B 2 66 ? -55.019 -22.565 -7.816 1.00 71.39 ? 64 LYS H CG 1 +ATOM 2023 C CD . LYS B 2 66 ? -56.434 -22.391 -7.275 1.00 78.20 ? 64 LYS H CD 1 +ATOM 2024 C CE . LYS B 2 66 ? -56.519 -22.848 -5.832 1.00 77.33 ? 64 LYS H CE 1 +ATOM 2025 N NZ . LYS B 2 66 ? -55.624 -22.049 -4.948 1.00 73.06 ? 64 LYS H NZ 1 +ATOM 2026 N N . GLY B 2 67 ? -55.218 -23.491 -12.212 1.00 29.48 ? 65 GLY H N 1 +ATOM 2027 C CA . GLY B 2 67 ? -55.624 -23.335 -13.595 1.00 35.05 ? 65 GLY H CA 1 +ATOM 2028 C C . GLY B 2 67 ? -54.637 -23.871 -14.612 1.00 35.05 ? 65 GLY H C 1 +ATOM 2029 O O . GLY B 2 67 ? -54.999 -24.018 -15.785 1.00 33.80 ? 65 GLY H O 1 +ATOM 2030 N N . ARG B 2 68 ? -53.403 -24.162 -14.206 1.00 28.02 ? 66 ARG H N 1 +ATOM 2031 C CA . ARG B 2 68 ? -52.361 -24.650 -15.104 1.00 26.46 ? 66 ARG H CA 1 +ATOM 2032 C C . ARG B 2 68 ? -52.003 -26.110 -14.883 1.00 30.33 ? 66 ARG H C 1 +ATOM 2033 O O . ARG B 2 68 ? -51.662 -26.803 -15.849 1.00 31.40 ? 66 ARG H O 1 +ATOM 2034 C CB . ARG B 2 68 ? -51.088 -23.799 -14.951 1.00 26.04 ? 66 ARG H CB 1 +ATOM 2035 C CG . ARG B 2 68 ? -51.352 -22.304 -15.097 1.00 28.07 ? 66 ARG H CG 1 +ATOM 2036 C CD . ARG B 2 68 ? -50.078 -21.484 -15.180 1.00 24.53 ? 66 ARG H CD 1 +ATOM 2037 N NE . ARG B 2 68 ? -49.318 -21.507 -13.929 1.00 26.31 ? 66 ARG H NE 1 +ATOM 2038 C CZ . ARG B 2 68 ? -48.082 -21.981 -13.819 1.00 29.19 ? 66 ARG H CZ 1 +ATOM 2039 N NH1 . ARG B 2 68 ? -47.467 -22.460 -14.894 1.00 24.97 ? 66 ARG H NH1 1 +ATOM 2040 N NH2 . ARG B 2 68 ? -47.449 -21.946 -12.650 1.00 26.54 ? 66 ARG H NH2 1 +ATOM 2041 N N . PHE B 2 69 ? -52.067 -26.585 -13.642 1.00 27.12 ? 67 PHE H N 1 +ATOM 2042 C CA . PHE B 2 69 ? -51.670 -27.934 -13.273 1.00 23.79 ? 67 PHE H CA 1 +ATOM 2043 C C . PHE B 2 69 ? -52.912 -28.748 -12.927 1.00 25.09 ? 67 PHE H C 1 +ATOM 2044 O O . PHE B 2 69 ? -53.884 -28.217 -12.378 1.00 25.12 ? 67 PHE H O 1 +ATOM 2045 C CB . PHE B 2 69 ? -50.712 -27.932 -12.057 1.00 19.86 ? 67 PHE H CB 1 +ATOM 2046 C CG . PHE B 2 69 ? -49.322 -27.409 -12.338 1.00 23.95 ? 67 PHE H CG 1 +ATOM 2047 C CD1 . PHE B 2 69 ? -49.030 -26.716 -13.496 1.00 29.16 ? 67 PHE H CD1 1 +ATOM 2048 C CD2 . PHE B 2 69 ? -48.307 -27.596 -11.407 1.00 27.45 ? 67 PHE H CD2 1 +ATOM 2049 C CE1 . PHE B 2 69 ? -47.757 -26.224 -13.726 1.00 27.07 ? 67 PHE H CE1 1 +ATOM 2050 C CE2 . PHE B 2 69 ? -47.023 -27.100 -11.634 1.00 24.09 ? 67 PHE H CE2 1 +ATOM 2051 C CZ . PHE B 2 69 ? -46.752 -26.420 -12.793 1.00 26.02 ? 67 PHE H CZ 1 +ATOM 2052 N N . THR B 2 70 ? -52.871 -30.046 -13.233 1.00 22.94 ? 68 THR H N 1 +ATOM 2053 C CA . THR B 2 70 ? -53.936 -30.973 -12.864 1.00 22.97 ? 68 THR H CA 1 +ATOM 2054 C C . THR B 2 70 ? -53.320 -32.232 -12.272 1.00 24.81 ? 68 THR H C 1 +ATOM 2055 O O . THR B 2 70 ? -52.481 -32.875 -12.912 1.00 25.81 ? 68 THR H O 1 +ATOM 2056 C CB . THR B 2 70 ? -54.809 -31.357 -14.069 1.00 26.11 ? 68 THR H CB 1 +ATOM 2057 O OG1 . THR B 2 70 ? -55.260 -30.177 -14.749 1.00 31.09 ? 68 THR H OG1 1 +ATOM 2058 C CG2 . THR B 2 70 ? -56.009 -32.172 -13.605 1.00 29.94 ? 68 THR H CG2 1 +ATOM 2059 N N . ILE B 2 71 ? -53.755 -32.598 -11.064 1.00 23.05 ? 69 ILE H N 1 +ATOM 2060 C CA . ILE B 2 71 ? -53.313 -33.834 -10.430 1.00 20.86 ? 69 ILE H CA 1 +ATOM 2061 C C . ILE B 2 71 ? -54.358 -34.904 -10.718 1.00 26.46 ? 69 ILE H C 1 +ATOM 2062 O O . ILE B 2 71 ? -55.559 -34.620 -10.836 1.00 27.48 ? 69 ILE H O 1 +ATOM 2063 C CB . ILE B 2 71 ? -53.080 -33.629 -8.922 1.00 21.71 ? 69 ILE H CB 1 +ATOM 2064 C CG1 . ILE B 2 71 ? -52.331 -34.813 -8.288 1.00 20.21 ? 69 ILE H CG1 1 +ATOM 2065 C CG2 . ILE B 2 71 ? -54.420 -33.364 -8.181 1.00 22.93 ? 69 ILE H CG2 1 +ATOM 2066 C CD1 . ILE B 2 71 ? -51.976 -34.541 -6.834 1.00 21.02 ? 69 ILE H CD1 1 +ATOM 2067 N N . SER B 2 72 ? -53.904 -36.145 -10.847 1.00 24.93 ? 70 SER H N 1 +ATOM 2068 C CA . SER B 2 72 ? -54.799 -37.255 -11.154 1.00 27.63 ? 70 SER H CA 1 +ATOM 2069 C C . SER B 2 72 ? -54.116 -38.562 -10.765 1.00 27.78 ? 70 SER H C 1 +ATOM 2070 O O . SER B 2 72 ? -52.947 -38.584 -10.382 1.00 27.16 ? 70 SER H O 1 +ATOM 2071 C CB . SER B 2 72 ? -55.178 -37.231 -12.639 1.00 28.17 ? 70 SER H CB 1 +ATOM 2072 O OG . SER B 2 72 ? -54.050 -37.606 -13.430 1.00 24.79 ? 70 SER H OG 1 +ATOM 2073 N N . ARG B 2 73 ? -54.854 -39.662 -10.880 1.00 24.45 ? 71 ARG H N 1 +ATOM 2074 C CA . ARG B 2 73 ? -54.274 -40.955 -10.560 1.00 22.43 ? 71 ARG H CA 1 +ATOM 2075 C C . ARG B 2 73 ? -54.919 -42.012 -11.432 1.00 26.51 ? 71 ARG H C 1 +ATOM 2076 O O . ARG B 2 73 ? -55.977 -41.795 -12.024 1.00 28.55 ? 71 ARG H O 1 +ATOM 2077 C CB . ARG B 2 73 ? -54.449 -41.298 -9.077 1.00 23.69 ? 71 ARG H CB 1 +ATOM 2078 C CG . ARG B 2 73 ? -55.909 -41.510 -8.702 1.00 28.48 ? 71 ARG H CG 1 +ATOM 2079 C CD . ARG B 2 73 ? -56.126 -41.543 -7.202 1.00 28.31 ? 71 ARG H CD 1 +ATOM 2080 N NE . ARG B 2 73 ? -57.541 -41.796 -6.916 1.00 33.62 ? 71 ARG H NE 1 +ATOM 2081 C CZ . ARG B 2 73 ? -58.193 -41.312 -5.861 1.00 32.64 ? 71 ARG H CZ 1 +ATOM 2082 N NH1 . ARG B 2 73 ? -57.557 -40.571 -4.967 1.00 26.86 ? 71 ARG H NH1 1 +ATOM 2083 N NH2 . ARG B 2 73 ? -59.484 -41.578 -5.701 1.00 31.43 ? 71 ARG H NH2 1 +ATOM 2084 N N . HIS B 2 74 ? -54.244 -43.150 -11.543 1.00 27.92 ? 72 HIS H N 1 +ATOM 2085 C CA . HIS B 2 74 ? -54.776 -44.311 -12.253 1.00 31.39 ? 72 HIS H CA 1 +ATOM 2086 C C . HIS B 2 74 ? -54.709 -45.477 -11.278 1.00 33.65 ? 72 HIS H C 1 +ATOM 2087 O O . HIS B 2 74 ? -53.615 -45.925 -10.918 1.00 34.55 ? 72 HIS H O 1 +ATOM 2088 C CB . HIS B 2 74 ? -53.982 -44.593 -13.532 1.00 36.67 ? 72 HIS H CB 1 +ATOM 2089 C CG . HIS B 2 74 ? -54.578 -45.668 -14.389 1.00 66.06 ? 72 HIS H CG 1 +ATOM 2090 N ND1 . HIS B 2 74 ? -55.095 -45.421 -15.643 1.00 73.55 ? 72 HIS H ND1 1 +ATOM 2091 C CD2 . HIS B 2 74 ? -54.742 -46.994 -14.170 1.00 70.71 ? 72 HIS H CD2 1 +ATOM 2092 C CE1 . HIS B 2 74 ? -55.552 -46.549 -16.160 1.00 71.18 ? 72 HIS H CE1 1 +ATOM 2093 N NE2 . HIS B 2 74 ? -55.351 -47.518 -15.285 1.00 70.52 ? 72 HIS H NE2 1 +ATOM 2094 N N . ASN B 2 75 ? -55.872 -45.953 -10.827 1.00 36.37 ? 73 ASN H N 1 +ATOM 2095 C CA . ASN B 2 75 ? -55.881 -46.921 -9.733 1.00 41.54 ? 73 ASN H CA 1 +ATOM 2096 C C . ASN B 2 75 ? -55.223 -48.242 -10.125 1.00 42.51 ? 73 ASN H C 1 +ATOM 2097 O O . ASN B 2 75 ? -54.450 -48.810 -9.342 1.00 43.29 ? 73 ASN H O 1 +ATOM 2098 C CB . ASN B 2 75 ? -57.308 -47.152 -9.236 1.00 51.47 ? 73 ASN H CB 1 +ATOM 2099 C CG . ASN B 2 75 ? -57.345 -47.947 -7.939 1.00 73.09 ? 73 ASN H CG 1 +ATOM 2100 O OD1 . ASN B 2 75 ? -56.699 -47.586 -6.952 1.00 69.86 ? 73 ASN H OD1 1 +ATOM 2101 N ND2 . ASN B 2 75 ? -58.106 -49.038 -7.936 1.00 81.52 ? 73 ASN H ND2 1 +ATOM 2102 N N . SER B 2 76 ? -55.504 -48.746 -11.330 1.00 38.90 ? 74 SER H N 1 +ATOM 2103 C CA . SER B 2 76 ? -54.972 -50.048 -11.709 1.00 44.81 ? 74 SER H CA 1 +ATOM 2104 C C . SER B 2 76 ? -53.453 -50.028 -11.847 1.00 47.94 ? 74 SER H C 1 +ATOM 2105 O O . SER B 2 76 ? -52.799 -51.047 -11.595 1.00 48.69 ? 74 SER H O 1 +ATOM 2106 C CB . SER B 2 76 ? -55.619 -50.529 -13.009 1.00 57.45 ? 74 SER H CB 1 +ATOM 2107 O OG . SER B 2 76 ? -55.041 -49.891 -14.135 1.00 67.39 ? 74 SER H OG 1 +ATOM 2108 N N . LYS B 2 77 ? -52.874 -48.897 -12.243 1.00 37.59 ? 75 LYS H N 1 +ATOM 2109 C CA . LYS B 2 77 ? -51.426 -48.759 -12.326 1.00 33.14 ? 75 LYS H CA 1 +ATOM 2110 C C . LYS B 2 77 ? -50.798 -48.286 -11.015 1.00 35.90 ? 75 LYS H C 1 +ATOM 2111 O O . LYS B 2 77 ? -49.569 -48.162 -10.946 1.00 33.53 ? 75 LYS H O 1 +ATOM 2112 C CB . LYS B 2 77 ? -51.059 -47.786 -13.449 1.00 38.41 ? 75 LYS H CB 1 +ATOM 2113 C CG . LYS B 2 77 ? -51.514 -48.242 -14.841 1.00 44.17 ? 75 LYS H CG 1 +ATOM 2114 C CD . LYS B 2 77 ? -50.811 -47.446 -15.927 1.00 45.45 ? 75 LYS H CD 1 +ATOM 2115 C CE . LYS B 2 77 ? -51.220 -47.922 -17.313 1.00 55.54 ? 75 LYS H CE 1 +ATOM 2116 N NZ . LYS B 2 77 ? -52.133 -46.944 -17.964 1.00 60.69 ? 75 LYS H NZ 1 +ATOM 2117 N N . ASN B 2 78 ? -51.614 -48.014 -9.993 1.00 29.50 ? 76 ASN H N 1 +ATOM 2118 C CA . ASN B 2 78 ? -51.150 -47.491 -8.706 1.00 28.08 ? 76 ASN H CA 1 +ATOM 2119 C C . ASN B 2 78 ? -50.158 -46.354 -8.911 1.00 24.15 ? 76 ASN H C 1 +ATOM 2120 O O . ASN B 2 78 ? -49.060 -46.350 -8.355 1.00 25.67 ? 76 ASN H O 1 +ATOM 2121 C CB . ASN B 2 78 ? -50.538 -48.597 -7.843 1.00 30.45 ? 76 ASN H CB 1 +ATOM 2122 C CG . ASN B 2 78 ? -50.639 -48.291 -6.357 1.00 32.37 ? 76 ASN H CG 1 +ATOM 2123 O OD1 . ASN B 2 78 ? -51.603 -47.670 -5.909 1.00 28.84 ? 76 ASN H OD1 1 +ATOM 2124 N ND2 . ASN B 2 78 ? -49.640 -48.712 -5.592 1.00 29.68 ? 76 ASN H ND2 1 +ATOM 2125 N N . THR B 2 79 ? -50.561 -45.377 -9.729 1.00 25.90 ? 77 THR H N 1 +ATOM 2126 C CA . THR B 2 79 ? -49.678 -44.306 -10.179 1.00 23.15 ? 77 THR H CA 1 +ATOM 2127 C C . THR B 2 79 ? -50.377 -42.962 -10.038 1.00 24.79 ? 77 THR H C 1 +ATOM 2128 O O . THR B 2 79 ? -51.577 -42.844 -10.308 1.00 25.61 ? 77 THR H O 1 +ATOM 2129 C CB . THR B 2 79 ? -49.262 -44.538 -11.641 1.00 30.48 ? 77 THR H CB 1 +ATOM 2130 O OG1 . THR B 2 79 ? -48.513 -45.752 -11.736 1.00 31.86 ? 77 THR H OG1 1 +ATOM 2131 C CG2 . THR B 2 79 ? -48.402 -43.367 -12.180 1.00 27.86 ? 77 THR H CG2 1 +ATOM 2132 N N . LEU B 2 80 ? -49.626 -41.961 -9.589 1.00 23.75 ? 78 LEU H N 1 +ATOM 2133 C CA . LEU B 2 80 ? -50.071 -40.580 -9.475 1.00 24.15 ? 78 LEU H CA 1 +ATOM 2134 C C . LEU B 2 80 ? -49.486 -39.775 -10.630 1.00 25.05 ? 78 LEU H C 1 +ATOM 2135 O O . LEU B 2 80 ? -48.381 -40.064 -11.100 1.00 27.25 ? 78 LEU H O 1 +ATOM 2136 C CB . LEU B 2 80 ? -49.600 -39.981 -8.142 1.00 21.04 ? 78 LEU H CB 1 +ATOM 2137 C CG . LEU B 2 80 ? -49.985 -38.555 -7.740 1.00 21.41 ? 78 LEU H CG 1 +ATOM 2138 C CD1 . LEU B 2 80 ? -51.413 -38.548 -7.251 1.00 28.11 ? 78 LEU H CD1 1 +ATOM 2139 C CD2 . LEU B 2 80 ? -49.038 -38.037 -6.638 1.00 27.05 ? 78 LEU H CD2 1 +ATOM 2140 N N . TYR B 2 81 ? -50.215 -38.746 -11.072 1.00 22.72 ? 79 TYR H N 1 +ATOM 2141 C CA . TYR B 2 81 ? -49.767 -37.920 -12.190 1.00 22.96 ? 79 TYR H CA 1 +ATOM 2142 C C . TYR B 2 81 ? -49.897 -36.438 -11.873 1.00 22.78 ? 79 TYR H C 1 +ATOM 2143 O O . TYR B 2 81 ? -50.751 -36.022 -11.091 1.00 24.35 ? 79 TYR H O 1 +ATOM 2144 C CB . TYR B 2 81 ? -50.573 -38.195 -13.477 1.00 26.08 ? 79 TYR H CB 1 +ATOM 2145 C CG . TYR B 2 81 ? -50.570 -39.635 -13.899 1.00 31.42 ? 79 TYR H CG 1 +ATOM 2146 C CD1 . TYR B 2 81 ? -49.528 -40.156 -14.667 1.00 27.99 ? 79 TYR H CD1 1 +ATOM 2147 C CD2 . TYR B 2 81 ? -51.601 -40.487 -13.525 1.00 26.70 ? 79 TYR H CD2 1 +ATOM 2148 C CE1 . TYR B 2 81 ? -49.519 -41.492 -15.056 1.00 32.18 ? 79 TYR H CE1 1 +ATOM 2149 C CE2 . TYR B 2 81 ? -51.589 -41.821 -13.906 1.00 34.65 ? 79 TYR H CE2 1 +ATOM 2150 C CZ . TYR B 2 81 ? -50.554 -42.314 -14.672 1.00 33.68 ? 79 TYR H CZ 1 +ATOM 2151 O OH . TYR B 2 81 ? -50.558 -43.639 -15.055 1.00 34.93 ? 79 TYR H OH 1 +ATOM 2152 N N . LEU B 2 82 ? -49.065 -35.635 -12.531 1.00 23.60 ? 80 LEU H N 1 +ATOM 2153 C CA . LEU B 2 82 ? -49.231 -34.185 -12.528 1.00 22.12 ? 80 LEU H CA 1 +ATOM 2154 C C . LEU B 2 82 ? -49.121 -33.711 -13.966 1.00 26.03 ? 80 LEU H C 1 +ATOM 2155 O O . LEU B 2 82 ? -48.057 -33.831 -14.590 1.00 24.25 ? 80 LEU H O 1 +ATOM 2156 C CB . LEU B 2 82 ? -48.198 -33.496 -11.629 1.00 21.54 ? 80 LEU H CB 1 +ATOM 2157 C CG . LEU B 2 82 ? -48.407 -31.994 -11.417 1.00 21.94 ? 80 LEU H CG 1 +ATOM 2158 C CD1 . LEU B 2 82 ? -49.670 -31.709 -10.574 1.00 21.74 ? 80 LEU H CD1 1 +ATOM 2159 C CD2 . LEU B 2 82 ? -47.169 -31.341 -10.764 1.00 23.46 ? 80 LEU H CD2 1 +ATOM 2160 N N . GLN B 2 83 ? -50.224 -33.211 -14.501 1.00 22.70 ? 81 GLN H N 1 +ATOM 2161 C CA . GLN B 2 83 ? -50.236 -32.623 -15.827 1.00 25.28 ? 81 GLN H CA 1 +ATOM 2162 C C . GLN B 2 83 ? -49.948 -31.136 -15.679 1.00 26.04 ? 81 GLN H C 1 +ATOM 2163 O O . GLN B 2 83 ? -50.670 -30.435 -14.967 1.00 27.24 ? 81 GLN H O 1 +ATOM 2164 C CB . GLN B 2 83 ? -51.587 -32.851 -16.499 1.00 24.35 ? 81 GLN H CB 1 +ATOM 2165 C CG . GLN B 2 83 ? -51.701 -32.202 -17.892 1.00 25.50 ? 81 GLN H CG 1 +ATOM 2166 C CD . GLN B 2 83 ? -50.717 -32.804 -18.880 1.00 33.53 ? 81 GLN H CD 1 +ATOM 2167 O OE1 . GLN B 2 83 ? -50.594 -34.019 -18.976 1.00 31.12 ? 81 GLN H OE1 1 +ATOM 2168 N NE2 . GLN B 2 83 ? -50.011 -31.953 -19.616 1.00 32.47 ? 81 GLN H NE2 1 +ATOM 2169 N N . MET B 2 84 ? -48.894 -30.656 -16.332 1.00 21.57 ? 82 MET H N 1 +ATOM 2170 C CA . MET B 2 84 ? -48.463 -29.268 -16.186 1.00 26.72 ? 82 MET H CA 1 +ATOM 2171 C C . MET B 2 84 ? -48.613 -28.583 -17.534 1.00 28.66 ? 82 MET H C 1 +ATOM 2172 O O . MET B 2 84 ? -47.933 -28.954 -18.490 1.00 31.72 ? 82 MET H O 1 +ATOM 2173 C CB . MET B 2 84 ? -47.014 -29.198 -15.684 1.00 24.51 ? 82 MET H CB 1 +ATOM 2174 C CG . MET B 2 84 ? -46.792 -29.915 -14.382 1.00 31.23 ? 82 MET H CG 1 +ATOM 2175 S SD . MET B 2 84 ? -45.085 -29.770 -13.763 1.00 38.28 ? 82 MET H SD 1 +ATOM 2176 C CE . MET B 2 84 ? -44.221 -30.710 -14.992 1.00 30.13 ? 82 MET H CE 1 +ATOM 2177 N N . ASN B 2 85 ? -49.505 -27.600 -17.616 1.00 24.78 ? 83 ASN H N 1 +ATOM 2178 C CA . ASN B 2 85 ? -49.703 -26.801 -18.817 1.00 26.97 ? 83 ASN H CA 1 +ATOM 2179 C C . ASN B 2 85 ? -49.238 -25.373 -18.576 1.00 30.51 ? 83 ASN H C 1 +ATOM 2180 O O . ASN B 2 85 ? -49.048 -24.942 -17.432 1.00 29.99 ? 83 ASN H O 1 +ATOM 2181 C CB . ASN B 2 85 ? -51.178 -26.781 -19.242 1.00 28.80 ? 83 ASN H CB 1 +ATOM 2182 C CG . ASN B 2 85 ? -51.722 -28.155 -19.563 1.00 39.31 ? 83 ASN H CG 1 +ATOM 2183 O OD1 . ASN B 2 85 ? -51.010 -29.010 -20.072 1.00 33.99 ? 83 ASN H OD1 1 +ATOM 2184 N ND2 . ASN B 2 85 ? -53.003 -28.364 -19.276 1.00 40.83 ? 83 ASN H ND2 1 +ATOM 2185 N N . SER B 2 86 ? -49.071 -24.641 -19.683 1.00 27.60 ? 84 SER H N 1 +ATOM 2186 C CA . SER B 2 86 ? -48.724 -23.220 -19.655 1.00 30.47 ? 84 SER H CA 1 +ATOM 2187 C C . SER B 2 86 ? -47.533 -22.981 -18.740 1.00 29.02 ? 84 SER H C 1 +ATOM 2188 O O . SER B 2 86 ? -47.568 -22.131 -17.852 1.00 27.92 ? 84 SER H O 1 +ATOM 2189 C CB . SER B 2 86 ? -49.910 -22.369 -19.202 1.00 37.52 ? 84 SER H CB 1 +ATOM 2190 O OG . SER B 2 86 ? -51.048 -22.617 -19.997 1.00 41.19 ? 84 SER H OG 1 +ATOM 2191 N N . LEU B 2 87 ? -46.473 -23.755 -18.945 1.00 24.10 ? 85 LEU H N 1 +ATOM 2192 C CA . LEU B 2 87 ? -45.364 -23.715 -18.002 1.00 22.88 ? 85 LEU H CA 1 +ATOM 2193 C C . LEU B 2 87 ? -44.609 -22.389 -18.096 1.00 24.68 ? 85 LEU H C 1 +ATOM 2194 O O . LEU B 2 87 ? -44.574 -21.734 -19.142 1.00 26.63 ? 85 LEU H O 1 +ATOM 2195 C CB . LEU B 2 87 ? -44.428 -24.902 -18.246 1.00 23.19 ? 85 LEU H CB 1 +ATOM 2196 C CG . LEU B 2 87 ? -44.923 -26.218 -17.626 1.00 27.23 ? 85 LEU H CG 1 +ATOM 2197 C CD1 . LEU B 2 87 ? -44.246 -27.423 -18.270 1.00 27.59 ? 85 LEU H CD1 1 +ATOM 2198 C CD2 . LEU B 2 87 ? -44.639 -26.204 -16.136 1.00 28.54 ? 85 LEU H CD2 1 +ATOM 2199 N N . ARG B 2 88 ? -43.992 -22.001 -16.980 1.00 24.85 ? 86 ARG H N 1 +ATOM 2200 C CA . ARG B 2 88 ? -43.268 -20.742 -16.876 1.00 27.58 ? 86 ARG H CA 1 +ATOM 2201 C C . ARG B 2 88 ? -41.885 -21.025 -16.311 1.00 27.96 ? 86 ARG H C 1 +ATOM 2202 O O . ARG B 2 88 ? -41.670 -22.038 -15.644 1.00 25.10 ? 86 ARG H O 1 +ATOM 2203 C CB . ARG B 2 88 ? -44.002 -19.732 -15.973 1.00 29.62 ? 86 ARG H CB 1 +ATOM 2204 C CG . ARG B 2 88 ? -45.459 -19.463 -16.334 1.00 37.52 ? 86 ARG H CG 1 +ATOM 2205 C CD . ARG B 2 88 ? -46.192 -18.828 -15.143 1.00 41.83 ? 86 ARG H CD 1 +ATOM 2206 N NE . ARG B 2 88 ? -47.596 -18.538 -15.424 1.00 42.94 ? 86 ARG H NE 1 +ATOM 2207 C CZ . ARG B 2 88 ? -48.496 -18.231 -14.493 1.00 45.19 ? 86 ARG H CZ 1 +ATOM 2208 N NH1 . ARG B 2 88 ? -48.144 -18.173 -13.215 1.00 47.51 ? 86 ARG H NH1 1 +ATOM 2209 N NH2 . ARG B 2 88 ? -49.753 -17.985 -14.838 1.00 50.78 ? 86 ARG H NH2 1 +ATOM 2210 N N . ALA B 2 89 ? -40.941 -20.116 -16.583 1.00 25.14 ? 87 ALA H N 1 +ATOM 2211 C CA . ALA B 2 89 ? -39.570 -20.327 -16.126 1.00 22.45 ? 87 ALA H CA 1 +ATOM 2212 C C . ALA B 2 89 ? -39.502 -20.589 -14.626 1.00 22.81 ? 87 ALA H C 1 +ATOM 2213 O O . ALA B 2 89 ? -38.676 -21.394 -14.172 1.00 27.70 ? 87 ALA H O 1 +ATOM 2214 C CB . ALA B 2 89 ? -38.698 -19.120 -16.481 1.00 27.70 ? 87 ALA H CB 1 +ATOM 2215 N N . GLU B 2 90 ? -40.362 -19.935 -13.845 1.00 23.41 ? 88 GLU H N 1 +ATOM 2216 C CA . GLU B 2 90 ? -40.333 -20.116 -12.396 1.00 29.10 ? 88 GLU H CA 1 +ATOM 2217 C C . GLU B 2 90 ? -40.899 -21.462 -11.960 1.00 30.61 ? 88 GLU H C 1 +ATOM 2218 O O . GLU B 2 90 ? -40.794 -21.803 -10.781 1.00 29.17 ? 88 GLU H O 1 +ATOM 2219 C CB . GLU B 2 90 ? -41.090 -18.972 -11.699 1.00 28.37 ? 88 GLU H CB 1 +ATOM 2220 C CG . GLU B 2 90 ? -42.553 -18.861 -12.074 1.00 28.95 ? 88 GLU H CG 1 +ATOM 2221 C CD . GLU B 2 90 ? -42.799 -17.895 -13.224 1.00 36.71 ? 88 GLU H CD 1 +ATOM 2222 O OE1 . GLU B 2 90 ? -41.858 -17.635 -14.012 1.00 35.20 ? 88 GLU H OE1 1 +ATOM 2223 O OE2 . GLU B 2 90 ? -43.940 -17.407 -13.354 1.00 38.50 ? 88 GLU H OE2 1 +ATOM 2224 N N . ASP B 2 91 ? -41.481 -22.243 -12.867 1.00 23.66 ? 89 ASP H N 1 +ATOM 2225 C CA . ASP B 2 91 ? -41.841 -23.618 -12.528 1.00 22.13 ? 89 ASP H CA 1 +ATOM 2226 C C . ASP B 2 91 ? -40.637 -24.555 -12.535 1.00 24.58 ? 89 ASP H C 1 +ATOM 2227 O O . ASP B 2 91 ? -40.784 -25.733 -12.192 1.00 23.35 ? 89 ASP H O 1 +ATOM 2228 C CB . ASP B 2 91 ? -42.919 -24.128 -13.502 1.00 23.49 ? 89 ASP H CB 1 +ATOM 2229 C CG . ASP B 2 91 ? -44.223 -23.346 -13.394 1.00 27.02 ? 89 ASP H CG 1 +ATOM 2230 O OD1 . ASP B 2 91 ? -44.687 -23.088 -12.256 1.00 25.75 ? 89 ASP H OD1 1 +ATOM 2231 O OD2 . ASP B 2 91 ? -44.795 -22.991 -14.452 1.00 27.79 ? 89 ASP H OD2 1 +ATOM 2232 N N . THR B 2 92 ? -39.453 -24.058 -12.919 1.00 22.89 ? 90 THR H N 1 +ATOM 2233 C CA . THR B 2 92 ? -38.250 -24.884 -12.939 1.00 23.33 ? 90 THR H CA 1 +ATOM 2234 C C . THR B 2 92 ? -37.936 -25.341 -11.522 1.00 25.18 ? 90 THR H C 1 +ATOM 2235 O O . THR B 2 92 ? -37.794 -24.506 -10.622 1.00 23.49 ? 90 THR H O 1 +ATOM 2236 C CB . THR B 2 92 ? -37.074 -24.091 -13.525 1.00 23.72 ? 90 THR H CB 1 +ATOM 2237 O OG1 . THR B 2 92 ? -37.356 -23.762 -14.897 1.00 24.01 ? 90 THR H OG1 1 +ATOM 2238 C CG2 . THR B 2 92 ? -35.772 -24.889 -13.450 1.00 22.61 ? 90 THR H CG2 1 +ATOM 2239 N N . ALA B 2 93 ? -37.835 -26.659 -11.323 1.00 20.59 ? 91 ALA H N 1 +ATOM 2240 C CA . ALA B 2 93 ? -37.680 -27.216 -9.977 1.00 20.93 ? 91 ALA H CA 1 +ATOM 2241 C C . ALA B 2 93 ? -37.528 -28.727 -10.063 1.00 22.51 ? 91 ALA H C 1 +ATOM 2242 O O . ALA B 2 93 ? -37.825 -29.343 -11.085 1.00 23.27 ? 91 ALA H O 1 +ATOM 2243 C CB . ALA B 2 93 ? -38.891 -26.893 -9.080 1.00 19.44 ? 91 ALA H CB 1 +ATOM 2244 N N . VAL B 2 94 ? -37.082 -29.319 -8.959 1.00 20.63 ? 92 VAL H N 1 +ATOM 2245 C CA . VAL B 2 94 ? -37.247 -30.746 -8.733 1.00 20.26 ? 92 VAL H CA 1 +ATOM 2246 C C . VAL B 2 94 ? -38.646 -30.971 -8.169 1.00 20.17 ? 92 VAL H C 1 +ATOM 2247 O O . VAL B 2 94 ? -39.042 -30.296 -7.218 1.00 21.53 ? 92 VAL H O 1 +ATOM 2248 C CB . VAL B 2 94 ? -36.180 -31.268 -7.754 1.00 23.64 ? 92 VAL H CB 1 +ATOM 2249 C CG1 . VAL B 2 94 ? -36.409 -32.742 -7.490 1.00 19.69 ? 92 VAL H CG1 1 +ATOM 2250 C CG2 . VAL B 2 94 ? -34.752 -31.009 -8.298 1.00 28.93 ? 92 VAL H CG2 1 +ATOM 2251 N N . TYR B 2 95 ? -39.393 -31.898 -8.763 1.00 21.11 ? 93 TYR H N 1 +ATOM 2252 C CA . TYR B 2 95 ? -40.761 -32.224 -8.347 1.00 19.36 ? 93 TYR H CA 1 +ATOM 2253 C C . TYR B 2 95 ? -40.744 -33.566 -7.636 1.00 21.46 ? 93 TYR H C 1 +ATOM 2254 O O . TYR B 2 95 ? -40.208 -34.536 -8.173 1.00 24.48 ? 93 TYR H O 1 +ATOM 2255 C CB . TYR B 2 95 ? -41.715 -32.288 -9.554 1.00 19.20 ? 93 TYR H CB 1 +ATOM 2256 C CG . TYR B 2 95 ? -42.073 -30.908 -10.051 1.00 20.60 ? 93 TYR H CG 1 +ATOM 2257 C CD1 . TYR B 2 95 ? -41.131 -30.133 -10.721 1.00 22.36 ? 93 TYR H CD1 1 +ATOM 2258 C CD2 . TYR B 2 95 ? -43.327 -30.347 -9.796 1.00 21.60 ? 93 TYR H CD2 1 +ATOM 2259 C CE1 . TYR B 2 95 ? -41.427 -28.849 -11.150 1.00 24.80 ? 93 TYR H CE1 1 +ATOM 2260 C CE2 . TYR B 2 95 ? -43.630 -29.048 -10.224 1.00 21.63 ? 93 TYR H CE2 1 +ATOM 2261 C CZ . TYR B 2 95 ? -42.667 -28.309 -10.897 1.00 22.92 ? 93 TYR H CZ 1 +ATOM 2262 O OH . TYR B 2 95 ? -42.943 -27.027 -11.331 1.00 24.40 ? 93 TYR H OH 1 +ATOM 2263 N N . TYR B 2 96 ? -41.294 -33.610 -6.423 1.00 21.23 ? 94 TYR H N 1 +ATOM 2264 C CA . TYR B 2 96 ? -41.408 -34.832 -5.636 1.00 19.13 ? 94 TYR H CA 1 +ATOM 2265 C C . TYR B 2 96 ? -42.879 -35.188 -5.468 1.00 21.31 ? 94 TYR H C 1 +ATOM 2266 O O . TYR B 2 96 ? -43.712 -34.297 -5.310 1.00 24.26 ? 94 TYR H O 1 +ATOM 2267 C CB . TYR B 2 96 ? -40.837 -34.658 -4.225 1.00 21.95 ? 94 TYR H CB 1 +ATOM 2268 C CG . TYR B 2 96 ? -39.378 -34.308 -4.138 1.00 24.34 ? 94 TYR H CG 1 +ATOM 2269 C CD1 . TYR B 2 96 ? -38.414 -35.303 -4.170 1.00 26.40 ? 94 TYR H CD1 1 +ATOM 2270 C CD2 . TYR B 2 96 ? -38.962 -32.991 -3.987 1.00 29.24 ? 94 TYR H CD2 1 +ATOM 2271 C CE1 . TYR B 2 96 ? -37.066 -34.996 -4.081 1.00 26.19 ? 94 TYR H CE1 1 +ATOM 2272 C CE2 . TYR B 2 96 ? -37.603 -32.673 -3.889 1.00 29.60 ? 94 TYR H CE2 1 +ATOM 2273 C CZ . TYR B 2 96 ? -36.662 -33.686 -3.943 1.00 31.32 ? 94 TYR H CZ 1 +ATOM 2274 O OH . TYR B 2 96 ? -35.302 -33.397 -3.840 1.00 28.14 ? 94 TYR H OH 1 +ATOM 2275 N N . CYS B 2 97 ? -43.198 -36.477 -5.474 1.00 24.55 ? 95 CYS H N 1 +ATOM 2276 C CA . CYS B 2 97 ? -44.510 -36.909 -5.005 1.00 23.46 ? 95 CYS H CA 1 +ATOM 2277 C C . CYS B 2 97 ? -44.351 -37.439 -3.588 1.00 24.77 ? 95 CYS H C 1 +ATOM 2278 O O . CYS B 2 97 ? -43.263 -37.881 -3.197 1.00 23.49 ? 95 CYS H O 1 +ATOM 2279 C CB . CYS B 2 97 ? -45.100 -37.979 -5.920 1.00 31.58 ? 95 CYS H CB 1 +ATOM 2280 S SG . CYS B 2 97 ? -43.960 -39.339 -6.170 1.00 42.69 ? 95 CYS H SG 1 +ATOM 2281 N N . ALA B 2 98 ? -45.423 -37.356 -2.796 1.00 23.06 ? 96 ALA H N 1 +ATOM 2282 C CA . ALA B 2 98 ? -45.324 -37.828 -1.424 1.00 21.49 ? 96 ALA H CA 1 +ATOM 2283 C C . ALA B 2 98 ? -46.692 -38.293 -0.938 1.00 22.24 ? 96 ALA H C 1 +ATOM 2284 O O . ALA B 2 98 ? -47.725 -37.774 -1.367 1.00 20.51 ? 96 ALA H O 1 +ATOM 2285 C CB . ALA B 2 98 ? -44.792 -36.756 -0.475 1.00 21.69 ? 96 ALA H CB 1 +ATOM 2286 N N . ARG B 2 99 ? -46.679 -39.275 -0.049 1.00 23.50 ? 97 ARG H N 1 +ATOM 2287 C CA . ARG B 2 99 ? -47.885 -39.730 0.646 1.00 22.69 ? 97 ARG H CA 1 +ATOM 2288 C C . ARG B 2 99 ? -47.975 -39.034 1.996 1.00 25.68 ? 97 ARG H C 1 +ATOM 2289 O O . ARG B 2 99 ? -46.998 -39.011 2.750 1.00 26.12 ? 97 ARG H O 1 +ATOM 2290 C CB . ARG B 2 99 ? -47.861 -41.244 0.833 1.00 21.28 ? 97 ARG H CB 1 +ATOM 2291 C CG . ARG B 2 99 ? -49.177 -41.870 1.387 1.00 23.49 ? 97 ARG H CG 1 +ATOM 2292 C CD . ARG B 2 99 ? -49.223 -41.907 2.924 1.00 25.98 ? 97 ARG H CD 1 +ATOM 2293 N NE . ARG B 2 99 ? -48.270 -42.831 3.562 1.00 23.01 ? 97 ARG H NE 1 +ATOM 2294 C CZ . ARG B 2 99 ? -48.451 -44.147 3.681 1.00 25.10 ? 97 ARG H CZ 1 +ATOM 2295 N NH1 . ARG B 2 99 ? -49.529 -44.737 3.174 1.00 25.00 ? 97 ARG H NH1 1 +ATOM 2296 N NH2 . ARG B 2 99 ? -47.544 -44.889 4.297 1.00 25.74 ? 97 ARG H NH2 1 +ATOM 2297 N N . GLU B 2 100 ? -49.148 -38.495 2.322 1.00 23.57 ? 98 GLU H N 1 +ATOM 2298 C CA . GLU B 2 100 ? -49.355 -37.856 3.616 1.00 25.31 ? 98 GLU H CA 1 +ATOM 2299 C C . GLU B 2 100 ? -50.254 -38.719 4.489 1.00 24.82 ? 98 GLU H C 1 +ATOM 2300 O O . GLU B 2 100 ? -51.357 -39.083 4.079 1.00 25.89 ? 98 GLU H O 1 +ATOM 2301 C CB . GLU B 2 100 ? -49.981 -36.467 3.468 1.00 30.10 ? 98 GLU H CB 1 +ATOM 2302 C CG . GLU B 2 100 ? -50.398 -35.868 4.815 1.00 35.84 ? 98 GLU H CG 1 +ATOM 2303 C CD . GLU B 2 100 ? -51.348 -34.695 4.678 1.00 49.75 ? 98 GLU H CD 1 +ATOM 2304 O OE1 . GLU B 2 100 ? -51.677 -34.084 5.713 1.00 54.11 ? 98 GLU H OE1 1 +ATOM 2305 O OE2 . GLU B 2 100 ? -51.755 -34.377 3.537 1.00 49.47 ? 98 GLU H OE2 1 +ATOM 2306 N N . ALA B 2 101 ? -49.769 -39.072 5.673 1.00 23.36 ? 99 ALA H N 1 +ATOM 2307 C CA . ALA B 2 101 ? -50.629 -39.714 6.658 1.00 31.95 ? 99 ALA H CA 1 +ATOM 2308 C C . ALA B 2 101 ? -50.637 -38.840 7.909 1.00 34.35 ? 99 ALA H C 1 +ATOM 2309 O O . ALA B 2 101 ? -51.514 -37.984 8.065 1.00 39.04 ? 99 ALA H O 1 +ATOM 2310 C CB . ALA B 2 101 ? -50.160 -41.140 6.941 1.00 30.44 ? 99 ALA H CB 1 +ATOM 2311 N N . TYR B 2 102 ? -49.666 -39.036 8.793 1.00 26.30 ? 100 TYR H N 1 +ATOM 2312 C CA . TYR B 2 102 ? -49.322 -38.066 9.832 1.00 26.56 ? 100 TYR H CA 1 +ATOM 2313 C C . TYR B 2 102 ? -48.005 -37.428 9.393 1.00 30.74 ? 100 TYR H C 1 +ATOM 2314 O O . TYR B 2 102 ? -46.924 -37.911 9.732 1.00 36.75 ? 100 TYR H O 1 +ATOM 2315 C CB . TYR B 2 102 ? -49.195 -38.726 11.171 1.00 30.25 ? 100 TYR H CB 1 +ATOM 2316 C CG . TYR B 2 102 ? -50.421 -39.511 11.537 1.00 34.28 ? 100 TYR H CG 1 +ATOM 2317 C CD1 . TYR B 2 102 ? -51.666 -38.894 11.600 1.00 39.61 ? 100 TYR H CD1 1 +ATOM 2318 C CD2 . TYR B 2 102 ? -50.347 -40.869 11.796 1.00 40.79 ? 100 TYR H CD2 1 +ATOM 2319 C CE1 . TYR B 2 102 ? -52.805 -39.613 11.933 1.00 38.49 ? 100 TYR H CE1 1 +ATOM 2320 C CE2 . TYR B 2 102 ? -51.479 -41.597 12.133 1.00 42.64 ? 100 TYR H CE2 1 +ATOM 2321 C CZ . TYR B 2 102 ? -52.702 -40.962 12.191 1.00 41.60 ? 100 TYR H CZ 1 +ATOM 2322 O OH . TYR B 2 102 ? -53.822 -41.679 12.519 1.00 41.33 ? 100 TYR H OH 1 +ATOM 2323 N N . GLY B 2 103 ? -48.106 -36.338 8.648 1.00 25.83 ? 101 GLY H N 1 +ATOM 2324 C CA . GLY B 2 103 ? -46.979 -35.816 7.905 1.00 30.04 ? 101 GLY H CA 1 +ATOM 2325 C C . GLY B 2 103 ? -46.696 -36.647 6.665 1.00 27.60 ? 101 GLY H C 1 +ATOM 2326 O O . GLY B 2 103 ? -47.245 -37.729 6.450 1.00 28.39 ? 101 GLY H O 1 +ATOM 2327 N N . MET B 2 104 ? -45.796 -36.136 5.840 1.00 23.48 ? 102 MET H N 1 +ATOM 2328 C CA . MET B 2 104 ? -45.462 -36.794 4.581 1.00 22.07 ? 102 MET H CA 1 +ATOM 2329 C C . MET B 2 104 ? -44.355 -37.805 4.851 1.00 27.61 ? 102 MET H C 1 +ATOM 2330 O O . MET B 2 104 ? -43.178 -37.442 4.933 1.00 27.27 ? 102 MET H O 1 +ATOM 2331 C CB . MET B 2 104 ? -45.060 -35.749 3.553 1.00 23.04 ? 102 MET H CB 1 +ATOM 2332 C CG . MET B 2 104 ? -46.259 -34.900 3.120 1.00 29.22 ? 102 MET H CG 1 +ATOM 2333 S SD . MET B 2 104 ? -45.774 -33.521 2.067 1.00 33.49 ? 102 MET H SD 1 +ATOM 2334 C CE . MET B 2 104 ? -47.372 -32.733 1.831 1.00 38.12 ? 102 MET H CE 1 +ATOM 2335 N N . ASP B 2 105 ? -44.729 -39.085 5.000 1.00 21.90 ? 103 ASP H N 1 +ATOM 2336 C CA . ASP B 2 105 ? -43.765 -40.080 5.465 1.00 23.56 ? 103 ASP H CA 1 +ATOM 2337 C C . ASP B 2 105 ? -43.036 -40.786 4.325 1.00 27.74 ? 103 ASP H C 1 +ATOM 2338 O O . ASP B 2 105 ? -41.923 -41.281 4.530 1.00 29.38 ? 103 ASP H O 1 +ATOM 2339 C CB . ASP B 2 105 ? -44.443 -41.117 6.376 1.00 24.86 ? 103 ASP H CB 1 +ATOM 2340 C CG . ASP B 2 105 ? -45.502 -41.939 5.655 1.00 30.89 ? 103 ASP H CG 1 +ATOM 2341 O OD1 . ASP B 2 105 ? -46.129 -41.403 4.709 1.00 28.57 ? 103 ASP H OD1 1 +ATOM 2342 O OD2 . ASP B 2 105 ? -45.713 -43.120 6.045 1.00 29.90 ? 103 ASP H OD2 1 +ATOM 2343 N N . VAL B 2 106 ? -43.616 -40.852 3.131 1.00 24.87 ? 104 VAL H N 1 +ATOM 2344 C CA . VAL B 2 106 ? -42.973 -41.499 1.986 1.00 27.11 ? 104 VAL H CA 1 +ATOM 2345 C C . VAL B 2 106 ? -42.828 -40.483 0.867 1.00 25.86 ? 104 VAL H C 1 +ATOM 2346 O O . VAL B 2 106 ? -43.815 -39.861 0.461 1.00 24.59 ? 104 VAL H O 1 +ATOM 2347 C CB . VAL B 2 106 ? -43.769 -42.722 1.483 1.00 31.64 ? 104 VAL H CB 1 +ATOM 2348 C CG1 . VAL B 2 106 ? -43.006 -43.425 0.347 1.00 26.58 ? 104 VAL H CG1 1 +ATOM 2349 C CG2 . VAL B 2 106 ? -44.053 -43.687 2.619 1.00 28.95 ? 104 VAL H CG2 1 +ATOM 2350 N N . TRP B 2 107 ? -41.611 -40.386 0.305 1.00 21.75 ? 105 TRP H N 1 +ATOM 2351 C CA . TRP B 2 107 ? -41.266 -39.423 -0.735 1.00 22.35 ? 105 TRP H CA 1 +ATOM 2352 C C . TRP B 2 107 ? -40.620 -40.137 -1.915 1.00 22.28 ? 105 TRP H C 1 +ATOM 2353 O O . TRP B 2 107 ? -39.857 -41.089 -1.723 1.00 27.70 ? 105 TRP H O 1 +ATOM 2354 C CB . TRP B 2 107 ? -40.252 -38.367 -0.229 1.00 22.56 ? 105 TRP H CB 1 +ATOM 2355 C CG . TRP B 2 107 ? -40.786 -37.420 0.796 1.00 24.87 ? 105 TRP H CG 1 +ATOM 2356 C CD1 . TRP B 2 107 ? -41.081 -37.698 2.093 1.00 27.51 ? 105 TRP H CD1 1 +ATOM 2357 C CD2 . TRP B 2 107 ? -41.088 -36.032 0.597 1.00 20.42 ? 105 TRP H CD2 1 +ATOM 2358 N NE1 . TRP B 2 107 ? -41.542 -36.559 2.728 1.00 27.15 ? 105 TRP H NE1 1 +ATOM 2359 C CE2 . TRP B 2 107 ? -41.559 -35.527 1.825 1.00 25.94 ? 105 TRP H CE2 1 +ATOM 2360 C CE3 . TRP B 2 107 ? -40.993 -35.167 -0.503 1.00 21.52 ? 105 TRP H CE3 1 +ATOM 2361 C CZ2 . TRP B 2 107 ? -41.935 -34.195 1.990 1.00 23.10 ? 105 TRP H CZ2 1 +ATOM 2362 C CZ3 . TRP B 2 107 ? -41.371 -33.837 -0.340 1.00 22.84 ? 105 TRP H CZ3 1 +ATOM 2363 C CH2 . TRP B 2 107 ? -41.837 -33.369 0.894 1.00 23.71 ? 105 TRP H CH2 1 +ATOM 2364 N N . GLY B 2 108 ? -40.917 -39.672 -3.121 1.00 24.17 ? 106 GLY H N 1 +ATOM 2365 C CA . GLY B 2 108 ? -40.209 -40.123 -4.304 1.00 28.23 ? 106 GLY H CA 1 +ATOM 2366 C C . GLY B 2 108 ? -38.806 -39.538 -4.367 1.00 28.65 ? 106 GLY H C 1 +ATOM 2367 O O . GLY B 2 108 ? -38.386 -38.719 -3.542 1.00 25.59 ? 106 GLY H O 1 +ATOM 2368 N N . GLN B 2 109 ? -38.064 -39.970 -5.386 1.00 26.59 ? 107 GLN H N 1 +ATOM 2369 C CA . GLN B 2 109 ? -36.676 -39.539 -5.511 1.00 28.85 ? 107 GLN H CA 1 +ATOM 2370 C C . GLN B 2 109 ? -36.548 -38.175 -6.169 1.00 31.23 ? 107 GLN H C 1 +ATOM 2371 O O . GLN B 2 109 ? -35.475 -37.574 -6.105 1.00 27.47 ? 107 GLN H O 1 +ATOM 2372 C CB . GLN B 2 109 ? -35.858 -40.583 -6.298 1.00 30.23 ? 107 GLN H CB 1 +ATOM 2373 C CG . GLN B 2 109 ? -35.834 -40.406 -7.826 1.00 30.13 ? 107 GLN H CG 1 +ATOM 2374 C CD . GLN B 2 109 ? -37.095 -40.929 -8.519 1.00 38.65 ? 107 GLN H CD 1 +ATOM 2375 O OE1 . GLN B 2 109 ? -38.030 -41.389 -7.874 1.00 35.58 ? 107 GLN H OE1 1 +ATOM 2376 N NE2 . GLN B 2 109 ? -37.110 -40.863 -9.848 1.00 37.84 ? 107 GLN H NE2 1 +ATOM 2377 N N . GLY B 2 110 ? -37.604 -37.675 -6.782 1.00 26.76 ? 108 GLY H N 1 +ATOM 2378 C CA . GLY B 2 110 ? -37.572 -36.386 -7.445 1.00 25.89 ? 108 GLY H CA 1 +ATOM 2379 C C . GLY B 2 110 ? -37.327 -36.526 -8.936 1.00 29.68 ? 108 GLY H C 1 +ATOM 2380 O O . GLY B 2 110 ? -36.612 -37.421 -9.396 1.00 27.89 ? 108 GLY H O 1 +ATOM 2381 N N . THR B 2 111 ? -37.946 -35.638 -9.713 1.00 25.78 ? 109 THR H N 1 +ATOM 2382 C CA . THR B 2 111 ? -37.678 -35.567 -11.142 1.00 29.27 ? 109 THR H CA 1 +ATOM 2383 C C . THR B 2 111 ? -37.540 -34.094 -11.518 1.00 28.07 ? 109 THR H C 1 +ATOM 2384 O O . THR B 2 111 ? -38.237 -33.239 -10.967 1.00 24.51 ? 109 THR H O 1 +ATOM 2385 C CB . THR B 2 111 ? -38.774 -36.292 -11.962 1.00 29.55 ? 109 THR H CB 1 +ATOM 2386 O OG1 . THR B 2 111 ? -38.345 -36.438 -13.323 1.00 32.30 ? 109 THR H OG1 1 +ATOM 2387 C CG2 . THR B 2 111 ? -40.116 -35.563 -11.930 1.00 25.73 ? 109 THR H CG2 1 +ATOM 2388 N N . THR B 2 112 ? -36.600 -33.785 -12.404 1.00 23.48 ? 110 THR H N 1 +ATOM 2389 C CA . THR B 2 112 ? -36.219 -32.396 -12.657 1.00 25.97 ? 110 THR H CA 1 +ATOM 2390 C C . THR B 2 112 ? -36.973 -31.848 -13.866 1.00 25.40 ? 110 THR H C 1 +ATOM 2391 O O . THR B 2 112 ? -37.017 -32.481 -14.922 1.00 28.49 ? 110 THR H O 1 +ATOM 2392 C CB . THR B 2 112 ? -34.706 -32.264 -12.876 1.00 32.42 ? 110 THR H CB 1 +ATOM 2393 O OG1 . THR B 2 112 ? -33.999 -32.683 -11.697 1.00 29.42 ? 110 THR H OG1 1 +ATOM 2394 C CG2 . THR B 2 112 ? -34.339 -30.808 -13.155 1.00 29.75 ? 110 THR H CG2 1 +ATOM 2395 N N . VAL B 2 113 ? -37.556 -30.666 -13.705 1.00 23.55 ? 111 VAL H N 1 +ATOM 2396 C CA . VAL B 2 113 ? -38.295 -29.986 -14.762 1.00 24.35 ? 111 VAL H CA 1 +ATOM 2397 C C . VAL B 2 113 ? -37.586 -28.664 -15.005 1.00 26.30 ? 111 VAL H C 1 +ATOM 2398 O O . VAL B 2 113 ? -37.378 -27.894 -14.059 1.00 25.13 ? 111 VAL H O 1 +ATOM 2399 C CB . VAL B 2 113 ? -39.759 -29.744 -14.359 1.00 25.40 ? 111 VAL H CB 1 +ATOM 2400 C CG1 . VAL B 2 113 ? -40.454 -28.821 -15.360 1.00 24.67 ? 111 VAL H CG1 1 +ATOM 2401 C CG2 . VAL B 2 113 ? -40.496 -31.073 -14.213 1.00 28.48 ? 111 VAL H CG2 1 +ATOM 2402 N N . THR B 2 114 ? -37.182 -28.413 -16.248 1.00 23.37 ? 112 THR H N 1 +ATOM 2403 C CA . THR B 2 114 ? -36.552 -27.146 -16.601 1.00 21.99 ? 112 THR H CA 1 +ATOM 2404 C C . THR B 2 114 ? -37.406 -26.451 -17.649 1.00 27.68 ? 112 THR H C 1 +ATOM 2405 O O . THR B 2 114 ? -37.722 -27.049 -18.676 1.00 29.90 ? 112 THR H O 1 +ATOM 2406 C CB . THR B 2 114 ? -35.122 -27.367 -17.117 1.00 30.16 ? 112 THR H CB 1 +ATOM 2407 O OG1 . THR B 2 114 ? -34.378 -28.113 -16.137 1.00 30.04 ? 112 THR H OG1 1 +ATOM 2408 C CG2 . THR B 2 114 ? -34.435 -26.021 -17.342 1.00 28.77 ? 112 THR H CG2 1 +ATOM 2409 N N . VAL B 2 115 ? -37.794 -25.200 -17.389 1.00 21.92 ? 113 VAL H N 1 +ATOM 2410 C CA . VAL B 2 115 ? -38.618 -24.428 -18.321 1.00 20.39 ? 113 VAL H CA 1 +ATOM 2411 C C . VAL B 2 115 ? -37.795 -23.239 -18.789 1.00 24.88 ? 113 VAL H C 1 +ATOM 2412 O O . VAL B 2 115 ? -37.420 -22.374 -17.981 1.00 25.22 ? 113 VAL H O 1 +ATOM 2413 C CB . VAL B 2 115 ? -39.936 -23.966 -17.681 1.00 22.57 ? 113 VAL H CB 1 +ATOM 2414 C CG1 . VAL B 2 115 ? -40.793 -23.225 -18.702 1.00 23.42 ? 113 VAL H CG1 1 +ATOM 2415 C CG2 . VAL B 2 115 ? -40.690 -25.156 -17.074 1.00 25.28 ? 113 VAL H CG2 1 +ATOM 2416 N N . SER B 2 116 ? -37.508 -23.192 -20.084 1.00 25.71 ? 114 SER H N 1 +ATOM 2417 C CA . SER B 2 116 ? -36.614 -22.154 -20.579 1.00 27.25 ? 114 SER H CA 1 +ATOM 2418 C C . SER B 2 116 ? -36.773 -21.982 -22.081 1.00 30.39 ? 114 SER H C 1 +ATOM 2419 O O . SER B 2 116 ? -36.995 -22.961 -22.799 1.00 26.75 ? 114 SER H O 1 +ATOM 2420 C CB . SER B 2 116 ? -35.163 -22.487 -20.271 1.00 28.42 ? 114 SER H CB 1 +ATOM 2421 O OG . SER B 2 116 ? -34.317 -21.659 -21.053 1.00 29.08 ? 114 SER H OG 1 +ATOM 2422 N N . SER B 2 117 ? -36.639 -20.726 -22.541 1.00 25.54 ? 115 SER H N 1 +ATOM 2423 C CA . SER B 2 117 ? -36.587 -20.367 -23.953 1.00 29.66 ? 115 SER H CA 1 +ATOM 2424 C C . SER B 2 117 ? -35.250 -20.696 -24.589 1.00 31.46 ? 115 SER H C 1 +ATOM 2425 O O . SER B 2 117 ? -35.156 -20.695 -25.810 1.00 29.65 ? 115 SER H O 1 +ATOM 2426 C CB . SER B 2 117 ? -36.823 -18.862 -24.135 1.00 33.84 ? 115 SER H CB 1 +ATOM 2427 O OG . SER B 2 117 ? -38.142 -18.495 -23.787 1.00 49.46 ? 115 SER H OG 1 +ATOM 2428 N N . ALA B 2 118 ? -34.214 -20.941 -23.795 1.00 30.85 ? 116 ALA H N 1 +ATOM 2429 C CA . ALA B 2 118 ? -32.881 -21.128 -24.347 1.00 32.70 ? 116 ALA H CA 1 +ATOM 2430 C C . ALA B 2 118 ? -32.800 -22.418 -25.154 1.00 34.07 ? 116 ALA H C 1 +ATOM 2431 O O . ALA B 2 118 ? -33.502 -23.393 -24.886 1.00 34.64 ? 116 ALA H O 1 +ATOM 2432 C CB . ALA B 2 118 ? -31.844 -21.156 -23.217 1.00 29.44 ? 116 ALA H CB 1 +ATOM 2433 N N . SER B 2 119 ? -31.909 -22.429 -26.136 1.00 34.89 ? 117 SER H N 1 +ATOM 2434 C CA . SER B 2 119 ? -31.621 -23.652 -26.866 1.00 44.88 ? 117 SER H CA 1 +ATOM 2435 C C . SER B 2 119 ? -30.290 -24.228 -26.408 1.00 43.33 ? 117 SER H C 1 +ATOM 2436 O O . SER B 2 119 ? -29.426 -23.518 -25.884 1.00 33.23 ? 117 SER H O 1 +ATOM 2437 C CB . SER B 2 119 ? -31.605 -23.401 -28.375 1.00 53.26 ? 117 SER H CB 1 +ATOM 2438 O OG . SER B 2 119 ? -32.927 -23.220 -28.846 1.00 62.51 ? 117 SER H OG 1 +ATOM 2439 N N . THR B 2 120 ? -30.149 -25.538 -26.587 1.00 42.13 ? 118 THR H N 1 +ATOM 2440 C CA . THR B 2 120 ? -28.929 -26.230 -26.196 1.00 44.98 ? 118 THR H CA 1 +ATOM 2441 C C . THR B 2 120 ? -27.707 -25.565 -26.820 1.00 41.55 ? 118 THR H C 1 +ATOM 2442 O O . THR B 2 120 ? -27.693 -25.253 -28.011 1.00 40.53 ? 118 THR H O 1 +ATOM 2443 C CB . THR B 2 120 ? -29.015 -27.698 -26.613 1.00 47.67 ? 118 THR H CB 1 +ATOM 2444 O OG1 . THR B 2 120 ? -30.086 -28.327 -25.902 1.00 50.84 ? 118 THR H OG1 1 +ATOM 2445 C CG2 . THR B 2 120 ? -27.714 -28.418 -26.297 1.00 44.55 ? 118 THR H CG2 1 +ATOM 2446 N N . LYS B 2 121 ? -26.684 -25.334 -25.997 1.00 36.47 ? 119 LYS H N 1 +ATOM 2447 C CA . LYS B 2 121 ? -25.513 -24.578 -26.417 1.00 32.17 ? 119 LYS H CA 1 +ATOM 2448 C C . LYS B 2 121 ? -24.343 -24.982 -25.535 1.00 32.60 ? 119 LYS H C 1 +ATOM 2449 O O . LYS B 2 121 ? -24.485 -25.025 -24.311 1.00 28.01 ? 119 LYS H O 1 +ATOM 2450 C CB . LYS B 2 121 ? -25.774 -23.071 -26.304 1.00 37.91 ? 119 LYS H CB 1 +ATOM 2451 C CG . LYS B 2 121 ? -24.609 -22.185 -26.705 1.00 44.47 ? 119 LYS H CG 1 +ATOM 2452 C CD . LYS B 2 121 ? -24.931 -20.717 -26.456 1.00 45.82 ? 119 LYS H CD 1 +ATOM 2453 C CE . LYS B 2 121 ? -23.760 -19.818 -26.809 1.00 47.80 ? 119 LYS H CE 1 +ATOM 2454 N NZ . LYS B 2 121 ? -22.489 -20.236 -26.119 1.00 52.80 ? 119 LYS H NZ 1 +ATOM 2455 N N . GLY B 2 122 ? -23.201 -25.293 -26.153 1.00 32.71 ? 120 GLY H N 1 +ATOM 2456 C CA . GLY B 2 122 ? -22.016 -25.641 -25.402 1.00 34.48 ? 120 GLY H CA 1 +ATOM 2457 C C . GLY B 2 122 ? -21.308 -24.410 -24.865 1.00 32.97 ? 120 GLY H C 1 +ATOM 2458 O O . GLY B 2 122 ? -21.469 -23.304 -25.386 1.00 34.73 ? 120 GLY H O 1 +ATOM 2459 N N . PRO B 2 123 ? -20.492 -24.580 -23.825 1.00 31.96 ? 121 PRO H N 1 +ATOM 2460 C CA . PRO B 2 123 ? -19.849 -23.422 -23.190 1.00 30.13 ? 121 PRO H CA 1 +ATOM 2461 C C . PRO B 2 123 ? -18.670 -22.893 -23.985 1.00 32.63 ? 121 PRO H C 1 +ATOM 2462 O O . PRO B 2 123 ? -18.003 -23.623 -24.717 1.00 33.13 ? 121 PRO H O 1 +ATOM 2463 C CB . PRO B 2 123 ? -19.365 -23.984 -21.848 1.00 30.49 ? 121 PRO H CB 1 +ATOM 2464 C CG . PRO B 2 123 ? -19.074 -25.439 -22.152 1.00 32.35 ? 121 PRO H CG 1 +ATOM 2465 C CD . PRO B 2 123 ? -20.123 -25.853 -23.181 1.00 32.46 ? 121 PRO H CD 1 +ATOM 2466 N N . SER B 2 124 ? -18.418 -21.595 -23.828 1.00 27.35 ? 122 SER H N 1 +ATOM 2467 C CA . SER B 2 124 ? -17.110 -21.041 -24.146 1.00 33.26 ? 122 SER H CA 1 +ATOM 2468 C C . SER B 2 124 ? -16.276 -21.120 -22.879 1.00 32.72 ? 122 SER H C 1 +ATOM 2469 O O . SER B 2 124 ? -16.792 -20.886 -21.790 1.00 34.21 ? 122 SER H O 1 +ATOM 2470 C CB . SER B 2 124 ? -17.207 -19.591 -24.627 1.00 39.14 ? 122 SER H CB 1 +ATOM 2471 O OG . SER B 2 124 ? -18.216 -19.437 -25.604 1.00 47.57 ? 122 SER H OG 1 +ATOM 2472 N N . VAL B 2 125 ? -15.002 -21.484 -23.015 1.00 29.60 ? 123 VAL H N 1 +ATOM 2473 C CA . VAL B 2 125 ? -14.137 -21.707 -21.857 1.00 28.91 ? 123 VAL H CA 1 +ATOM 2474 C C . VAL B 2 125 ? -12.996 -20.710 -21.917 1.00 30.08 ? 123 VAL H C 1 +ATOM 2475 O O . VAL B 2 125 ? -12.190 -20.735 -22.857 1.00 33.64 ? 123 VAL H O 1 +ATOM 2476 C CB . VAL B 2 125 ? -13.605 -23.146 -21.795 1.00 30.67 ? 123 VAL H CB 1 +ATOM 2477 C CG1 . VAL B 2 125 ? -12.688 -23.300 -20.586 1.00 28.14 ? 123 VAL H CG1 1 +ATOM 2478 C CG2 . VAL B 2 125 ? -14.777 -24.136 -21.703 1.00 29.49 ? 123 VAL H CG2 1 +ATOM 2479 N N . PHE B 2 126 ? -12.917 -19.842 -20.913 1.00 29.11 ? 124 PHE H N 1 +ATOM 2480 C CA . PHE B 2 126 ? -11.910 -18.798 -20.879 1.00 28.24 ? 124 PHE H CA 1 +ATOM 2481 C C . PHE B 2 126 ? -10.971 -19.003 -19.696 1.00 30.59 ? 124 PHE H C 1 +ATOM 2482 O O . PHE B 2 126 ? -11.392 -19.471 -18.635 1.00 28.81 ? 124 PHE H O 1 +ATOM 2483 C CB . PHE B 2 126 ? -12.558 -17.414 -20.768 1.00 29.51 ? 124 PHE H CB 1 +ATOM 2484 C CG . PHE B 2 126 ? -13.540 -17.114 -21.866 1.00 31.38 ? 124 PHE H CG 1 +ATOM 2485 C CD1 . PHE B 2 126 ? -13.110 -17.001 -23.180 1.00 33.44 ? 124 PHE H CD1 1 +ATOM 2486 C CD2 . PHE B 2 126 ? -14.882 -16.938 -21.585 1.00 32.05 ? 124 PHE H CD2 1 +ATOM 2487 C CE1 . PHE B 2 126 ? -14.008 -16.725 -24.203 1.00 32.36 ? 124 PHE H CE1 1 +ATOM 2488 C CE2 . PHE B 2 126 ? -15.788 -16.661 -22.605 1.00 32.70 ? 124 PHE H CE2 1 +ATOM 2489 C CZ . PHE B 2 126 ? -15.344 -16.548 -23.913 1.00 31.59 ? 124 PHE H CZ 1 +ATOM 2490 N N . PRO B 2 127 ? -9.700 -18.653 -19.845 1.00 29.22 ? 125 PRO H N 1 +ATOM 2491 C CA . PRO B 2 127 ? -8.759 -18.824 -18.734 1.00 28.24 ? 125 PRO H CA 1 +ATOM 2492 C C . PRO B 2 127 ? -8.940 -17.757 -17.666 1.00 31.71 ? 125 PRO H C 1 +ATOM 2493 O O . PRO B 2 127 ? -9.261 -16.600 -17.950 1.00 29.87 ? 125 PRO H O 1 +ATOM 2494 C CB . PRO B 2 127 ? -7.390 -18.697 -19.418 1.00 29.39 ? 125 PRO H CB 1 +ATOM 2495 C CG . PRO B 2 127 ? -7.656 -17.797 -20.583 1.00 34.73 ? 125 PRO H CG 1 +ATOM 2496 C CD . PRO B 2 127 ? -9.025 -18.187 -21.075 1.00 30.11 ? 125 PRO H CD 1 +ATOM 2497 N N . LEU B 2 128 ? -8.755 -18.175 -16.422 1.00 28.81 ? 126 LEU H N 1 +ATOM 2498 C CA . LEU B 2 128 ? -8.576 -17.269 -15.294 1.00 29.63 ? 126 LEU H CA 1 +ATOM 2499 C C . LEU B 2 128 ? -7.087 -17.333 -14.976 1.00 35.26 ? 126 LEU H C 1 +ATOM 2500 O O . LEU B 2 128 ? -6.638 -18.162 -14.185 1.00 28.54 ? 126 LEU H O 1 +ATOM 2501 C CB . LEU B 2 128 ? -9.448 -17.694 -14.118 1.00 24.15 ? 126 LEU H CB 1 +ATOM 2502 C CG . LEU B 2 128 ? -10.946 -17.614 -14.426 1.00 29.03 ? 126 LEU H CG 1 +ATOM 2503 C CD1 . LEU B 2 128 ? -11.749 -18.262 -13.320 1.00 28.13 ? 126 LEU H CD1 1 +ATOM 2504 C CD2 . LEU B 2 128 ? -11.350 -16.166 -14.540 1.00 30.55 ? 126 LEU H CD2 1 +ATOM 2505 N N . ALA B 2 129 ? -6.309 -16.450 -15.621 1.00 37.84 ? 127 ALA H N 1 +ATOM 2506 C CA . ALA B 2 129 ? -4.861 -16.607 -15.612 1.00 37.97 ? 127 ALA H CA 1 +ATOM 2507 C C . ALA B 2 129 ? -4.269 -16.165 -14.274 1.00 33.14 ? 127 ALA H C 1 +ATOM 2508 O O . ALA B 2 129 ? -4.683 -15.147 -13.713 1.00 32.78 ? 127 ALA H O 1 +ATOM 2509 C CB . ALA B 2 129 ? -4.226 -15.805 -16.751 1.00 40.15 ? 127 ALA H CB 1 +ATOM 2510 N N . PRO B 2 130 ? -3.266 -16.887 -13.770 1.00 33.91 ? 128 PRO H N 1 +ATOM 2511 C CA . PRO B 2 130 ? -2.637 -16.496 -12.503 1.00 33.84 ? 128 PRO H CA 1 +ATOM 2512 C C . PRO B 2 130 ? -1.920 -15.160 -12.620 1.00 44.57 ? 128 PRO H C 1 +ATOM 2513 O O . PRO B 2 130 ? -1.225 -14.886 -13.602 1.00 42.33 ? 128 PRO H O 1 +ATOM 2514 C CB . PRO B 2 130 ? -1.651 -17.640 -12.231 1.00 36.28 ? 128 PRO H CB 1 +ATOM 2515 C CG . PRO B 2 130 ? -1.340 -18.193 -13.597 1.00 40.62 ? 128 PRO H CG 1 +ATOM 2516 C CD . PRO B 2 130 ? -2.644 -18.090 -14.353 1.00 39.73 ? 128 PRO H CD 1 +ATOM 2517 N N . SER B 2 131 ? -2.076 -14.339 -11.586 1.00 44.06 ? 129 SER H N 1 +ATOM 2518 C CA . SER B 2 131 ? -1.461 -13.020 -11.561 1.00 49.24 ? 129 SER H CA 1 +ATOM 2519 C C . SER B 2 131 ? 0.055 -13.115 -11.701 1.00 54.53 ? 129 SER H C 1 +ATOM 2520 O O . SER B 2 131 ? 0.678 -14.123 -11.347 1.00 45.44 ? 129 SER H O 1 +ATOM 2521 C CB . SER B 2 131 ? -1.818 -12.300 -10.260 1.00 57.25 ? 129 SER H CB 1 +ATOM 2522 O OG . SER B 2 131 ? -1.303 -10.980 -10.252 1.00 65.09 ? 129 SER H OG 1 +ATOM 2523 N N . SER B 2 132 ? 0.646 -12.039 -12.223 1.00 58.76 ? 130 SER H N 1 +ATOM 2524 C CA . SER B 2 132 ? 2.090 -11.922 -12.394 1.00 67.63 ? 130 SER H CA 1 +ATOM 2525 C C . SER B 2 132 ? 2.829 -11.676 -11.086 1.00 74.56 ? 130 SER H C 1 +ATOM 2526 O O . SER B 2 132 ? 4.063 -11.617 -11.095 1.00 68.32 ? 130 SER H O 1 +ATOM 2527 C CB . SER B 2 132 ? 2.413 -10.790 -13.375 1.00 66.02 ? 130 SER H CB 1 +ATOM 2528 O OG . SER B 2 132 ? 2.200 -11.205 -14.714 1.00 71.52 ? 130 SER H OG 1 +ATOM 2529 N N . LYS B 2 133 ? 2.119 -11.523 -9.971 1.00 79.95 ? 131 LYS H N 1 +ATOM 2530 C CA . LYS B 2 133 ? 2.734 -11.231 -8.686 1.00 88.58 ? 131 LYS H CA 1 +ATOM 2531 C C . LYS B 2 133 ? 2.345 -12.288 -7.664 1.00 96.46 ? 131 LYS H C 1 +ATOM 2532 O O . LYS B 2 133 ? 1.155 -12.508 -7.413 1.00 99.97 ? 131 LYS H O 1 +ATOM 2533 C CB . LYS B 2 133 ? 2.335 -9.839 -8.192 1.00 83.66 ? 131 LYS H CB 1 +ATOM 2534 C CG . LYS B 2 133 ? 3.246 -8.759 -8.726 1.00 83.58 ? 131 LYS H CG 1 +ATOM 2535 C CD . LYS B 2 133 ? 4.566 -8.777 -7.971 1.00 89.37 ? 131 LYS H CD 1 +ATOM 2536 C CE . LYS B 2 133 ? 5.746 -8.569 -8.908 1.00 87.82 ? 131 LYS H CE 1 +ATOM 2537 N NZ . LYS B 2 133 ? 6.807 -7.738 -8.280 1.00 87.89 ? 131 LYS H NZ 1 +ATOM 2538 N N . SER B 2 134 ? 3.355 -12.946 -7.088 1.00 95.31 ? 132 SER H N 1 +ATOM 2539 C CA . SER B 2 134 ? 3.148 -13.816 -5.939 1.00 94.58 ? 132 SER H CA 1 +ATOM 2540 C C . SER B 2 134 ? 2.849 -12.957 -4.722 1.00 98.56 ? 132 SER H C 1 +ATOM 2541 O O . SER B 2 134 ? 3.770 -12.535 -4.015 1.00 89.88 ? 132 SER H O 1 +ATOM 2542 C CB . SER B 2 134 ? 4.374 -14.698 -5.684 1.00 94.02 ? 132 SER H CB 1 +ATOM 2543 O OG . SER B 2 134 ? 4.417 -15.134 -4.337 1.00 94.05 ? 132 SER H OG 1 +ATOM 2544 N N . THR B 2 135 ? 1.568 -12.686 -4.480 1.00 116.33 ? 133 THR H N 1 +ATOM 2545 C CA . THR B 2 135 ? 1.181 -11.752 -3.432 1.00 134.72 ? 133 THR H CA 1 +ATOM 2546 C C . THR B 2 135 ? 1.397 -12.328 -2.035 1.00 148.06 ? 133 THR H C 1 +ATOM 2547 O O . THR B 2 135 ? 0.434 -12.609 -1.313 1.00 149.05 ? 133 THR H O 1 +ATOM 2548 C CB . THR B 2 135 ? -0.275 -11.317 -3.623 1.00 135.58 ? 133 THR H CB 1 +ATOM 2549 O OG1 . THR B 2 135 ? -1.153 -12.356 -3.174 1.00 137.14 ? 133 THR H OG1 1 +ATOM 2550 C CG2 . THR B 2 135 ? -0.555 -11.002 -5.090 1.00 131.69 ? 133 THR H CG2 1 +ATOM 2551 N N . SER B 2 136 ? 2.668 -12.537 -1.674 1.00 154.94 ? 134 SER H N 1 +ATOM 2552 C CA . SER B 2 136 ? 3.137 -12.665 -0.294 1.00 154.98 ? 134 SER H CA 1 +ATOM 2553 C C . SER B 2 136 ? 2.832 -13.996 0.391 1.00 153.29 ? 134 SER H C 1 +ATOM 2554 O O . SER B 2 136 ? 3.401 -14.282 1.451 1.00 161.90 ? 134 SER H O 1 +ATOM 2555 C CB . SER B 2 136 ? 2.581 -11.516 0.553 1.00 150.40 ? 134 SER H CB 1 +ATOM 2556 O OG . SER B 2 136 ? 2.544 -10.302 -0.179 1.00 145.21 ? 134 SER H OG 1 +ATOM 2557 N N . GLY B 2 137 ? 1.961 -14.820 -0.183 1.00 135.76 ? 135 GLY H N 1 +ATOM 2558 C CA . GLY B 2 137 ? 1.652 -16.090 0.446 1.00 113.05 ? 135 GLY H CA 1 +ATOM 2559 C C . GLY B 2 137 ? 2.511 -17.245 -0.028 1.00 92.03 ? 135 GLY H C 1 +ATOM 2560 O O . GLY B 2 137 ? 2.964 -18.065 0.777 1.00 95.28 ? 135 GLY H O 1 +ATOM 2561 N N . GLY B 2 138 ? 2.765 -17.306 -1.333 1.00 61.48 ? 136 GLY H N 1 +ATOM 2562 C CA . GLY B 2 138 ? 3.355 -18.468 -1.956 1.00 50.31 ? 136 GLY H CA 1 +ATOM 2563 C C . GLY B 2 138 ? 2.363 -19.335 -2.689 1.00 39.23 ? 136 GLY H C 1 +ATOM 2564 O O . GLY B 2 138 ? 2.776 -20.237 -3.427 1.00 38.16 ? 136 GLY H O 1 +ATOM 2565 N N . THR B 2 139 ? 1.070 -19.082 -2.506 1.00 29.38 ? 137 THR H N 1 +ATOM 2566 C CA . THR B 2 139 ? 0.010 -19.805 -3.191 1.00 34.05 ? 137 THR H CA 1 +ATOM 2567 C C . THR B 2 139 ? -0.533 -18.947 -4.328 1.00 39.22 ? 137 THR H C 1 +ATOM 2568 O O . THR B 2 139 ? -0.838 -17.768 -4.124 1.00 45.33 ? 137 THR H O 1 +ATOM 2569 C CB . THR B 2 139 ? -1.108 -20.148 -2.206 1.00 37.01 ? 137 THR H CB 1 +ATOM 2570 O OG1 . THR B 2 139 ? -0.599 -21.028 -1.197 1.00 46.50 ? 137 THR H OG1 1 +ATOM 2571 C CG2 . THR B 2 139 ? -2.253 -20.819 -2.908 1.00 38.92 ? 137 THR H CG2 1 +ATOM 2572 N N . ALA B 2 140 ? -0.664 -19.543 -5.514 1.00 30.87 ? 138 ALA H N 1 +ATOM 2573 C CA . ALA B 2 140 ? -1.225 -18.874 -6.677 1.00 30.42 ? 138 ALA H CA 1 +ATOM 2574 C C . ALA B 2 140 ? -2.576 -19.490 -7.011 1.00 33.75 ? 138 ALA H C 1 +ATOM 2575 O O . ALA B 2 140 ? -2.810 -20.670 -6.751 1.00 30.55 ? 138 ALA H O 1 +ATOM 2576 C CB . ALA B 2 140 ? -0.284 -18.991 -7.885 1.00 27.89 ? 138 ALA H CB 1 +ATOM 2577 N N . ALA B 2 141 ? -3.470 -18.688 -7.590 1.00 27.63 ? 139 ALA H N 1 +ATOM 2578 C CA . ALA B 2 141 ? -4.785 -19.163 -7.985 1.00 24.13 ? 139 ALA H CA 1 +ATOM 2579 C C . ALA B 2 141 ? -4.947 -19.007 -9.486 1.00 24.46 ? 139 ALA H C 1 +ATOM 2580 O O . ALA B 2 141 ? -4.548 -17.990 -10.058 1.00 29.81 ? 139 ALA H O 1 +ATOM 2581 C CB . ALA B 2 141 ? -5.913 -18.395 -7.254 1.00 26.14 ? 139 ALA H CB 1 +ATOM 2582 N N . LEU B 2 142 ? -5.519 -20.028 -10.122 1.00 24.94 ? 140 LEU H N 1 +ATOM 2583 C CA . LEU B 2 142 ? -5.818 -19.978 -11.542 1.00 27.56 ? 140 LEU H CA 1 +ATOM 2584 C C . LEU B 2 142 ? -7.109 -20.744 -11.770 1.00 28.76 ? 140 LEU H C 1 +ATOM 2585 O O . LEU B 2 142 ? -7.625 -21.413 -10.867 1.00 27.33 ? 140 LEU H O 1 +ATOM 2586 C CB . LEU B 2 142 ? -4.660 -20.546 -12.379 1.00 29.80 ? 140 LEU H CB 1 +ATOM 2587 C CG . LEU B 2 142 ? -4.286 -21.987 -12.054 1.00 33.30 ? 140 LEU H CG 1 +ATOM 2588 C CD1 . LEU B 2 142 ? -4.822 -22.912 -13.125 1.00 36.78 ? 140 LEU H CD1 1 +ATOM 2589 C CD2 . LEU B 2 142 ? -2.766 -22.145 -11.923 1.00 39.35 ? 140 LEU H CD2 1 +ATOM 2590 N N . GLY B 2 143 ? -7.659 -20.638 -12.971 1.00 26.03 ? 141 GLY H N 1 +ATOM 2591 C CA . GLY B 2 143 ? -8.942 -21.289 -13.157 1.00 22.46 ? 141 GLY H CA 1 +ATOM 2592 C C . GLY B 2 143 ? -9.442 -21.183 -14.578 1.00 23.92 ? 141 GLY H C 1 +ATOM 2593 O O . GLY B 2 143 ? -8.741 -20.711 -15.474 1.00 25.82 ? 141 GLY H O 1 +ATOM 2594 N N . CYS B 2 144 ? -10.675 -21.658 -14.759 1.00 21.97 ? 142 CYS H N 1 +ATOM 2595 C CA . CYS B 2 144 ? -11.390 -21.590 -16.025 1.00 22.92 ? 142 CYS H CA 1 +ATOM 2596 C C . CYS B 2 144 ? -12.771 -21.008 -15.782 1.00 24.80 ? 142 CYS H C 1 +ATOM 2597 O O . CYS B 2 144 ? -13.450 -21.380 -14.819 1.00 28.57 ? 142 CYS H O 1 +ATOM 2598 C CB . CYS B 2 144 ? -11.532 -22.978 -16.664 1.00 29.24 ? 142 CYS H CB 1 +ATOM 2599 S SG . CYS B 2 144 ? -10.013 -23.488 -17.495 1.00 42.68 ? 142 CYS H SG 1 +ATOM 2600 N N . LEU B 2 145 ? -13.194 -20.110 -16.663 1.00 28.46 ? 143 LEU H N 1 +ATOM 2601 C CA . LEU B 2 145 ? -14.551 -19.592 -16.643 1.00 26.39 ? 143 LEU H CA 1 +ATOM 2602 C C . LEU B 2 145 ? -15.332 -20.286 -17.753 1.00 23.52 ? 143 LEU H C 1 +ATOM 2603 O O . LEU B 2 145 ? -14.937 -20.223 -18.924 1.00 26.40 ? 143 LEU H O 1 +ATOM 2604 C CB . LEU B 2 145 ? -14.543 -18.075 -16.817 1.00 29.38 ? 143 LEU H CB 1 +ATOM 2605 C CG . LEU B 2 145 ? -15.898 -17.406 -17.013 1.00 31.26 ? 143 LEU H CG 1 +ATOM 2606 C CD1 . LEU B 2 145 ? -16.768 -17.576 -15.782 1.00 30.62 ? 143 LEU H CD1 1 +ATOM 2607 C CD2 . LEU B 2 145 ? -15.689 -15.942 -17.350 1.00 32.51 ? 143 LEU H CD2 1 +ATOM 2608 N N . VAL B 2 146 ? -16.419 -20.964 -17.380 1.00 21.40 ? 144 VAL H N 1 +ATOM 2609 C CA . VAL B 2 146 ? -17.173 -21.827 -18.283 1.00 23.10 ? 144 VAL H CA 1 +ATOM 2610 C C . VAL B 2 146 ? -18.483 -21.104 -18.544 1.00 30.20 ? 144 VAL H C 1 +ATOM 2611 O O . VAL B 2 146 ? -19.411 -21.166 -17.731 1.00 27.10 ? 144 VAL H O 1 +ATOM 2612 C CB . VAL B 2 146 ? -17.392 -23.223 -17.688 1.00 27.92 ? 144 VAL H CB 1 +ATOM 2613 C CG1 . VAL B 2 146 ? -18.172 -24.126 -18.656 1.00 26.09 ? 144 VAL H CG1 1 +ATOM 2614 C CG2 . VAL B 2 146 ? -16.053 -23.861 -17.342 1.00 30.19 ? 144 VAL H CG2 1 +ATOM 2615 N N . LYS B 2 147 ? -18.560 -20.395 -19.660 1.00 29.50 ? 145 LYS H N 1 +ATOM 2616 C CA . LYS B 2 147 ? -19.557 -19.353 -19.836 1.00 34.17 ? 145 LYS H CA 1 +ATOM 2617 C C . LYS B 2 147 ? -20.565 -19.719 -20.921 1.00 31.93 ? 145 LYS H C 1 +ATOM 2618 O O . LYS B 2 147 ? -20.202 -20.279 -21.960 1.00 30.61 ? 145 LYS H O 1 +ATOM 2619 C CB . LYS B 2 147 ? -18.876 -18.020 -20.189 1.00 36.10 ? 145 LYS H CB 1 +ATOM 2620 C CG . LYS B 2 147 ? -19.602 -16.795 -19.638 1.00 42.89 ? 145 LYS H CG 1 +ATOM 2621 C CD . LYS B 2 147 ? -19.275 -15.576 -20.456 1.00 43.21 ? 145 LYS H CD 1 +ATOM 2622 C CE . LYS B 2 147 ? -19.839 -14.315 -19.858 1.00 44.76 ? 145 LYS H CE 1 +ATOM 2623 N NZ . LYS B 2 147 ? -21.308 -14.350 -19.698 1.00 42.19 ? 145 LYS H NZ 1 +ATOM 2624 N N . ASP B 2 148 ? -21.832 -19.387 -20.664 1.00 27.17 ? 146 ASP H N 1 +ATOM 2625 C CA . ASP B 2 148 ? -22.896 -19.349 -21.675 1.00 29.36 ? 146 ASP H CA 1 +ATOM 2626 C C . ASP B 2 148 ? -23.204 -20.734 -22.243 1.00 31.31 ? 146 ASP H C 1 +ATOM 2627 O O . ASP B 2 148 ? -23.107 -20.967 -23.453 1.00 32.81 ? 146 ASP H O 1 +ATOM 2628 C CB . ASP B 2 148 ? -22.541 -18.385 -22.819 1.00 30.34 ? 146 ASP H CB 1 +ATOM 2629 C CG . ASP B 2 148 ? -22.525 -16.930 -22.393 1.00 28.66 ? 146 ASP H CG 1 +ATOM 2630 O OD1 . ASP B 2 148 ? -23.151 -16.584 -21.365 1.00 34.61 ? 146 ASP H OD1 1 +ATOM 2631 O OD2 . ASP B 2 148 ? -21.893 -16.128 -23.107 1.00 35.82 ? 146 ASP H OD2 1 +ATOM 2632 N N . TYR B 2 149 ? -23.615 -21.647 -21.369 1.00 27.50 ? 147 TYR H N 1 +ATOM 2633 C CA . TYR B 2 149 ? -24.047 -22.959 -21.819 1.00 28.32 ? 147 TYR H CA 1 +ATOM 2634 C C . TYR B 2 149 ? -25.478 -23.228 -21.366 1.00 28.93 ? 147 TYR H C 1 +ATOM 2635 O O . TYR B 2 149 ? -26.005 -22.563 -20.472 1.00 26.39 ? 147 TYR H O 1 +ATOM 2636 C CB . TYR B 2 149 ? -23.116 -24.068 -21.313 1.00 28.74 ? 147 TYR H CB 1 +ATOM 2637 C CG . TYR B 2 149 ? -23.078 -24.218 -19.814 1.00 27.45 ? 147 TYR H CG 1 +ATOM 2638 C CD1 . TYR B 2 149 ? -22.189 -23.471 -19.041 1.00 28.25 ? 147 TYR H CD1 1 +ATOM 2639 C CD2 . TYR B 2 149 ? -23.909 -25.129 -19.164 1.00 26.52 ? 147 TYR H CD2 1 +ATOM 2640 C CE1 . TYR B 2 149 ? -22.145 -23.612 -17.655 1.00 27.44 ? 147 TYR H CE1 1 +ATOM 2641 C CE2 . TYR B 2 149 ? -23.872 -25.281 -17.766 1.00 28.44 ? 147 TYR H CE2 1 +ATOM 2642 C CZ . TYR B 2 149 ? -22.984 -24.516 -17.028 1.00 32.59 ? 147 TYR H CZ 1 +ATOM 2643 O OH . TYR B 2 149 ? -22.934 -24.653 -15.662 1.00 28.99 ? 147 TYR H OH 1 +ATOM 2644 N N . PHE B 2 150 ? -26.108 -24.218 -22.010 1.00 30.62 ? 148 PHE H N 1 +ATOM 2645 C CA . PHE B 2 150 ? -27.461 -24.622 -21.659 1.00 32.08 ? 148 PHE H CA 1 +ATOM 2646 C C . PHE B 2 150 ? -27.724 -26.002 -22.231 1.00 27.13 ? 148 PHE H C 1 +ATOM 2647 O O . PHE B 2 150 ? -27.337 -26.257 -23.376 1.00 30.26 ? 148 PHE H O 1 +ATOM 2648 C CB . PHE B 2 150 ? -28.514 -23.637 -22.189 1.00 30.99 ? 148 PHE H CB 1 +ATOM 2649 C CG . PHE B 2 150 ? -29.927 -24.020 -21.829 1.00 28.41 ? 148 PHE H CG 1 +ATOM 2650 C CD1 . PHE B 2 150 ? -30.480 -23.625 -20.625 1.00 26.71 ? 148 PHE H CD1 1 +ATOM 2651 C CD2 . PHE B 2 150 ? -30.699 -24.786 -22.696 1.00 31.22 ? 148 PHE H CD2 1 +ATOM 2652 C CE1 . PHE B 2 150 ? -31.779 -23.984 -20.273 1.00 27.76 ? 148 PHE H CE1 1 +ATOM 2653 C CE2 . PHE B 2 150 ? -31.998 -25.150 -22.348 1.00 32.44 ? 148 PHE H CE2 1 +ATOM 2654 C CZ . PHE B 2 150 ? -32.536 -24.744 -21.143 1.00 30.60 ? 148 PHE H CZ 1 +ATOM 2655 N N . PRO B 2 151 ? -28.396 -26.905 -21.490 1.00 30.71 ? 149 PRO H N 1 +ATOM 2656 C CA . PRO B 2 151 ? -28.816 -26.756 -20.092 1.00 33.87 ? 149 PRO H CA 1 +ATOM 2657 C C . PRO B 2 151 ? -27.724 -27.244 -19.158 1.00 31.03 ? 149 PRO H C 1 +ATOM 2658 O O . PRO B 2 151 ? -26.659 -27.608 -19.640 1.00 30.17 ? 149 PRO H O 1 +ATOM 2659 C CB . PRO B 2 151 ? -30.033 -27.670 -19.997 1.00 34.66 ? 149 PRO H CB 1 +ATOM 2660 C CG . PRO B 2 151 ? -29.683 -28.790 -20.922 1.00 34.18 ? 149 PRO H CG 1 +ATOM 2661 C CD . PRO B 2 151 ? -28.890 -28.167 -22.068 1.00 34.39 ? 149 PRO H CD 1 +ATOM 2662 N N . GLU B 2 152 ? -28.007 -27.283 -17.858 1.00 29.18 ? 150 GLU H N 1 +ATOM 2663 C CA . GLU B 2 152 ? -27.125 -27.961 -16.919 1.00 29.56 ? 150 GLU H CA 1 +ATOM 2664 C C . GLU B 2 152 ? -27.108 -29.453 -17.245 1.00 36.58 ? 150 GLU H C 1 +ATOM 2665 O O . GLU B 2 152 ? -28.042 -29.966 -17.868 1.00 40.55 ? 150 GLU H O 1 +ATOM 2666 C CB . GLU B 2 152 ? -27.604 -27.730 -15.491 1.00 28.99 ? 150 GLU H CB 1 +ATOM 2667 C CG . GLU B 2 152 ? -27.431 -26.304 -15.009 1.00 33.05 ? 150 GLU H CG 1 +ATOM 2668 C CD . GLU B 2 152 ? -26.174 -26.152 -14.174 1.00 50.32 ? 150 GLU H CD 1 +ATOM 2669 O OE1 . GLU B 2 152 ? -26.297 -25.766 -12.994 1.00 44.18 ? 150 GLU H OE1 1 +ATOM 2670 O OE2 . GLU B 2 152 ? -25.063 -26.424 -14.704 1.00 53.02 ? 150 GLU H OE2 1 +ATOM 2671 N N . PRO B 2 153 ? -26.041 -30.176 -16.855 1.00 38.78 ? 151 PRO H N 1 +ATOM 2672 C CA . PRO B 2 153 ? -24.842 -29.720 -16.146 1.00 38.52 ? 151 PRO H CA 1 +ATOM 2673 C C . PRO B 2 153 ? -23.581 -29.702 -17.005 1.00 33.64 ? 151 PRO H C 1 +ATOM 2674 O O . PRO B 2 153 ? -23.573 -30.239 -18.110 1.00 33.47 ? 151 PRO H O 1 +ATOM 2675 C CB . PRO B 2 153 ? -24.702 -30.774 -15.056 1.00 39.19 ? 151 PRO H CB 1 +ATOM 2676 C CG . PRO B 2 153 ? -25.032 -32.041 -15.815 1.00 41.21 ? 151 PRO H CG 1 +ATOM 2677 C CD . PRO B 2 153 ? -26.087 -31.649 -16.875 1.00 44.70 ? 151 PRO H CD 1 +ATOM 2678 N N . VAL B 2 154 ? -22.511 -29.103 -16.477 1.00 34.61 ? 152 VAL H N 1 +ATOM 2679 C CA . VAL B 2 154 ? -21.164 -29.277 -17.009 1.00 37.74 ? 152 VAL H CA 1 +ATOM 2680 C C . VAL B 2 154 ? -20.336 -29.956 -15.931 1.00 34.67 ? 152 VAL H C 1 +ATOM 2681 O O . VAL B 2 154 ? -20.601 -29.803 -14.734 1.00 34.65 ? 152 VAL H O 1 +ATOM 2682 C CB . VAL B 2 154 ? -20.472 -27.957 -17.426 1.00 40.15 ? 152 VAL H CB 1 +ATOM 2683 C CG1 . VAL B 2 154 ? -21.087 -27.381 -18.682 1.00 43.63 ? 152 VAL H CG1 1 +ATOM 2684 C CG2 . VAL B 2 154 ? -20.483 -26.963 -16.278 1.00 38.48 ? 152 VAL H CG2 1 +ATOM 2685 N N . THR B 2 155 ? -19.324 -30.699 -16.360 1.00 34.43 ? 153 THR H N 1 +ATOM 2686 C CA . THR B 2 155 ? -18.327 -31.242 -15.450 1.00 38.62 ? 153 THR H CA 1 +ATOM 2687 C C . THR B 2 155 ? -16.974 -30.635 -15.787 1.00 34.29 ? 153 THR H C 1 +ATOM 2688 O O . THR B 2 155 ? -16.672 -30.382 -16.957 1.00 35.17 ? 153 THR H O 1 +ATOM 2689 C CB . THR B 2 155 ? -18.250 -32.768 -15.538 1.00 41.83 ? 153 THR H CB 1 +ATOM 2690 O OG1 . THR B 2 155 ? -17.799 -33.146 -16.842 1.00 48.23 ? 153 THR H OG1 1 +ATOM 2691 C CG2 . THR B 2 155 ? -19.618 -33.385 -15.279 1.00 48.09 ? 153 THR H CG2 1 +ATOM 2692 N N . VAL B 2 156 ? -16.169 -30.381 -14.760 1.00 30.82 ? 154 VAL H N 1 +ATOM 2693 C CA . VAL B 2 156 ? -14.831 -29.836 -14.932 1.00 30.57 ? 154 VAL H CA 1 +ATOM 2694 C C . VAL B 2 156 ? -13.874 -30.719 -14.151 1.00 30.29 ? 154 VAL H C 1 +ATOM 2695 O O . VAL B 2 156 ? -14.133 -31.036 -12.987 1.00 34.43 ? 154 VAL H O 1 +ATOM 2696 C CB . VAL B 2 156 ? -14.721 -28.378 -14.438 1.00 32.85 ? 154 VAL H CB 1 +ATOM 2697 C CG1 . VAL B 2 156 ? -13.322 -27.857 -14.684 1.00 31.29 ? 154 VAL H CG1 1 +ATOM 2698 C CG2 . VAL B 2 156 ? -15.738 -27.490 -15.136 1.00 30.53 ? 154 VAL H CG2 1 +ATOM 2699 N N . SER B 2 157 ? -12.788 -31.125 -14.787 1.00 30.77 ? 155 SER H N 1 +ATOM 2700 C CA . SER B 2 157 ? -11.667 -31.717 -14.075 1.00 34.09 ? 155 SER H CA 1 +ATOM 2701 C C . SER B 2 157 ? -10.417 -30.923 -14.423 1.00 30.11 ? 155 SER H C 1 +ATOM 2702 O O . SER B 2 157 ? -10.434 -30.058 -15.298 1.00 35.33 ? 155 SER H O 1 +ATOM 2703 C CB . SER B 2 157 ? -11.501 -33.199 -14.428 1.00 37.58 ? 155 SER H CB 1 +ATOM 2704 O OG . SER B 2 157 ? -10.990 -33.342 -15.738 1.00 45.62 ? 155 SER H OG 1 +ATOM 2705 N N . TRP B 2 158 ? -9.327 -31.202 -13.716 1.00 30.34 ? 156 TRP H N 1 +ATOM 2706 C CA . TRP B 2 158 ? -8.056 -30.543 -13.970 1.00 27.68 ? 156 TRP H CA 1 +ATOM 2707 C C . TRP B 2 158 ? -6.995 -31.591 -14.264 1.00 31.89 ? 156 TRP H C 1 +ATOM 2708 O O . TRP B 2 158 ? -6.899 -32.595 -13.550 1.00 38.84 ? 156 TRP H O 1 +ATOM 2709 C CB . TRP B 2 158 ? -7.647 -29.678 -12.781 1.00 29.75 ? 156 TRP H CB 1 +ATOM 2710 C CG . TRP B 2 158 ? -8.463 -28.426 -12.719 1.00 30.05 ? 156 TRP H CG 1 +ATOM 2711 C CD1 . TRP B 2 158 ? -9.682 -28.261 -12.131 1.00 26.88 ? 156 TRP H CD1 1 +ATOM 2712 C CD2 . TRP B 2 158 ? -8.129 -27.178 -13.321 1.00 30.96 ? 156 TRP H CD2 1 +ATOM 2713 N NE1 . TRP B 2 158 ? -10.120 -26.966 -12.310 1.00 25.06 ? 156 TRP H NE1 1 +ATOM 2714 C CE2 . TRP B 2 158 ? -9.181 -26.283 -13.043 1.00 26.25 ? 156 TRP H CE2 1 +ATOM 2715 C CE3 . TRP B 2 158 ? -7.036 -26.728 -14.069 1.00 30.00 ? 156 TRP H CE3 1 +ATOM 2716 C CZ2 . TRP B 2 158 ? -9.166 -24.961 -13.477 1.00 27.38 ? 156 TRP H CZ2 1 +ATOM 2717 C CZ3 . TRP B 2 158 ? -7.024 -25.425 -14.503 1.00 33.58 ? 156 TRP H CZ3 1 +ATOM 2718 C CH2 . TRP B 2 158 ? -8.079 -24.550 -14.202 1.00 29.43 ? 156 TRP H CH2 1 +ATOM 2719 N N . ASN B 2 159 ? -6.209 -31.350 -15.314 1.00 29.99 ? 157 ASN H N 1 +ATOM 2720 C CA . ASN B 2 159 ? -5.140 -32.261 -15.746 1.00 34.70 ? 157 ASN H CA 1 +ATOM 2721 C C . ASN B 2 159 ? -5.659 -33.696 -15.853 1.00 38.03 ? 157 ASN H C 1 +ATOM 2722 O O . ASN B 2 159 ? -5.032 -34.650 -15.383 1.00 41.08 ? 157 ASN H O 1 +ATOM 2723 C CB . ASN B 2 159 ? -3.925 -32.174 -14.810 1.00 33.75 ? 157 ASN H CB 1 +ATOM 2724 C CG . ASN B 2 159 ? -3.205 -30.839 -14.916 1.00 37.81 ? 157 ASN H CG 1 +ATOM 2725 O OD1 . ASN B 2 159 ? -3.479 -30.050 -15.823 1.00 38.92 ? 157 ASN H OD1 1 +ATOM 2726 N ND2 . ASN B 2 159 ? -2.281 -30.576 -13.986 1.00 36.47 ? 157 ASN H ND2 1 +ATOM 2727 N N . SER B 2 160 ? -6.834 -33.834 -16.475 1.00 37.24 ? 158 SER H N 1 +ATOM 2728 C CA . SER B 2 160 ? -7.477 -35.132 -16.715 1.00 43.25 ? 158 SER H CA 1 +ATOM 2729 C C . SER B 2 160 ? -7.718 -35.899 -15.418 1.00 48.29 ? 158 SER H C 1 +ATOM 2730 O O . SER B 2 160 ? -7.658 -37.131 -15.394 1.00 54.44 ? 158 SER H O 1 +ATOM 2731 C CB . SER B 2 160 ? -6.670 -35.989 -17.697 1.00 44.99 ? 158 SER H CB 1 +ATOM 2732 O OG . SER B 2 160 ? -6.260 -35.243 -18.834 1.00 47.24 ? 158 SER H OG 1 +ATOM 2733 N N . GLY B 2 161 ? -7.997 -35.182 -14.329 1.00 41.77 ? 159 GLY H N 1 +ATOM 2734 C CA . GLY B 2 161 ? -8.280 -35.804 -13.055 1.00 39.70 ? 159 GLY H CA 1 +ATOM 2735 C C . GLY B 2 161 ? -7.076 -36.033 -12.165 1.00 43.51 ? 159 GLY H C 1 +ATOM 2736 O O . GLY B 2 161 ? -7.249 -36.469 -11.021 1.00 50.49 ? 159 GLY H O 1 +ATOM 2737 N N . ALA B 2 162 ? -5.865 -35.753 -12.646 1.00 38.63 ? 160 ALA H N 1 +ATOM 2738 C CA . ALA B 2 162 ? -4.677 -35.941 -11.824 1.00 40.70 ? 160 ALA H CA 1 +ATOM 2739 C C . ALA B 2 162 ? -4.509 -34.839 -10.786 1.00 43.28 ? 160 ALA H C 1 +ATOM 2740 O O . ALA B 2 162 ? -3.737 -35.009 -9.837 1.00 45.14 ? 160 ALA H O 1 +ATOM 2741 C CB . ALA B 2 162 ? -3.434 -36.012 -12.710 1.00 46.93 ? 160 ALA H CB 1 +ATOM 2742 N N . LEU B 2 163 ? -5.194 -33.714 -10.948 1.00 44.14 ? 161 LEU H N 1 +ATOM 2743 C CA . LEU B 2 163 ? -5.102 -32.590 -10.021 1.00 41.68 ? 161 LEU H CA 1 +ATOM 2744 C C . LEU B 2 163 ? -6.460 -32.429 -9.357 1.00 35.80 ? 161 LEU H C 1 +ATOM 2745 O O . LEU B 2 163 ? -7.438 -32.065 -10.018 1.00 30.50 ? 161 LEU H O 1 +ATOM 2746 C CB . LEU B 2 163 ? -4.689 -31.313 -10.744 1.00 38.55 ? 161 LEU H CB 1 +ATOM 2747 C CG . LEU B 2 163 ? -4.728 -30.023 -9.925 1.00 37.88 ? 161 LEU H CG 1 +ATOM 2748 C CD1 . LEU B 2 163 ? -3.810 -30.122 -8.719 1.00 37.85 ? 161 LEU H CD1 1 +ATOM 2749 C CD2 . LEU B 2 163 ? -4.350 -28.832 -10.805 1.00 31.46 ? 161 LEU H CD2 1 +ATOM 2750 N N . THR B 2 164 ? -6.525 -32.705 -8.056 1.00 35.06 ? 162 THR H N 1 +ATOM 2751 C CA . THR B 2 164 ? -7.792 -32.588 -7.339 1.00 35.32 ? 162 THR H CA 1 +ATOM 2752 C C . THR B 2 164 ? -7.636 -31.731 -6.091 1.00 29.24 ? 162 THR H C 1 +ATOM 2753 O O . THR B 2 164 ? -8.577 -31.048 -5.677 1.00 34.30 ? 162 THR H O 1 +ATOM 2754 C CB . THR B 2 164 ? -8.338 -33.968 -6.951 1.00 43.74 ? 162 THR H CB 1 +ATOM 2755 O OG1 . THR B 2 164 ? -7.326 -34.713 -6.263 1.00 49.90 ? 162 THR H OG1 1 +ATOM 2756 C CG2 . THR B 2 164 ? -8.797 -34.743 -8.191 1.00 43.88 ? 162 THR H CG2 1 +ATOM 2757 N N . SER B 2 165 ? -6.458 -31.785 -5.471 1.00 30.56 ? 163 SER H N 1 +ATOM 2758 C CA . SER B 2 165 ? -6.200 -30.995 -4.274 1.00 38.94 ? 163 SER H CA 1 +ATOM 2759 C C . SER B 2 165 ? -6.283 -29.497 -4.572 1.00 36.15 ? 163 SER H C 1 +ATOM 2760 O O . SER B 2 165 ? -5.676 -28.999 -5.525 1.00 36.23 ? 163 SER H O 1 +ATOM 2761 C CB . SER B 2 165 ? -4.827 -31.353 -3.709 1.00 44.06 ? 163 SER H CB 1 +ATOM 2762 O OG . SER B 2 165 ? -4.558 -30.616 -2.533 1.00 60.75 ? 163 SER H OG 1 +ATOM 2763 N N . GLY B 2 166 ? -7.047 -28.778 -3.756 1.00 33.74 ? 164 GLY H N 1 +ATOM 2764 C CA . GLY B 2 166 ? -7.168 -27.341 -3.912 1.00 29.71 ? 164 GLY H CA 1 +ATOM 2765 C C . GLY B 2 166 ? -8.108 -26.878 -5.006 1.00 32.77 ? 164 GLY H C 1 +ATOM 2766 O O . GLY B 2 166 ? -8.173 -25.670 -5.268 1.00 31.69 ? 164 GLY H O 1 +ATOM 2767 N N . VAL B 2 167 ? -8.848 -27.791 -5.647 1.00 24.06 ? 165 VAL H N 1 +ATOM 2768 C CA . VAL B 2 167 ? -9.790 -27.412 -6.695 1.00 23.31 ? 165 VAL H CA 1 +ATOM 2769 C C . VAL B 2 167 ? -11.113 -27.000 -6.061 1.00 27.83 ? 165 VAL H C 1 +ATOM 2770 O O . VAL B 2 167 ? -11.591 -27.647 -5.125 1.00 32.20 ? 165 VAL H O 1 +ATOM 2771 C CB . VAL B 2 167 ? -9.994 -28.583 -7.675 1.00 26.78 ? 165 VAL H CB 1 +ATOM 2772 C CG1 . VAL B 2 167 ? -11.090 -28.264 -8.668 1.00 23.22 ? 165 VAL H CG1 1 +ATOM 2773 C CG2 . VAL B 2 167 ? -8.671 -28.921 -8.405 1.00 27.58 ? 165 VAL H CG2 1 +ATOM 2774 N N . HIS B 2 168 ? -11.714 -25.920 -6.558 1.00 25.85 ? 166 HIS H N 1 +ATOM 2775 C CA . HIS B 2 168 ? -13.093 -25.570 -6.221 1.00 25.42 ? 166 HIS H CA 1 +ATOM 2776 C C . HIS B 2 168 ? -13.851 -25.317 -7.512 1.00 25.90 ? 166 HIS H C 1 +ATOM 2777 O O . HIS B 2 168 ? -13.522 -24.384 -8.249 1.00 29.24 ? 166 HIS H O 1 +ATOM 2778 C CB . HIS B 2 168 ? -13.175 -24.327 -5.338 1.00 25.07 ? 166 HIS H CB 1 +ATOM 2779 C CG . HIS B 2 168 ? -12.513 -24.479 -4.005 1.00 26.68 ? 166 HIS H CG 1 +ATOM 2780 N ND1 . HIS B 2 168 ? -12.983 -25.336 -3.031 1.00 29.58 ? 166 HIS H ND1 1 +ATOM 2781 C CD2 . HIS B 2 168 ? -11.435 -23.857 -3.473 1.00 27.56 ? 166 HIS H CD2 1 +ATOM 2782 C CE1 . HIS B 2 168 ? -12.204 -25.253 -1.965 1.00 30.09 ? 166 HIS H CE1 1 +ATOM 2783 N NE2 . HIS B 2 168 ? -11.263 -24.357 -2.204 1.00 31.26 ? 166 HIS H NE2 1 +ATOM 2784 N N . THR B 2 169 ? -14.867 -26.122 -7.781 1.00 21.36 ? 167 THR H N 1 +ATOM 2785 C CA . THR B 2 169 ? -15.768 -25.860 -8.897 1.00 20.54 ? 167 THR H CA 1 +ATOM 2786 C C . THR B 2 169 ? -17.083 -25.340 -8.328 1.00 24.71 ? 167 THR H C 1 +ATOM 2787 O O . THR B 2 169 ? -17.734 -26.026 -7.531 1.00 30.88 ? 167 THR H O 1 +ATOM 2788 C CB . THR B 2 169 ? -15.961 -27.117 -9.730 1.00 27.07 ? 167 THR H CB 1 +ATOM 2789 O OG1 . THR B 2 169 ? -14.688 -27.500 -10.264 1.00 28.42 ? 167 THR H OG1 1 +ATOM 2790 C CG2 . THR B 2 169 ? -16.930 -26.848 -10.879 1.00 30.41 ? 167 THR H CG2 1 +ATOM 2791 N N . PHE B 2 170 ? -17.455 -24.125 -8.714 1.00 22.93 ? 168 PHE H N 1 +ATOM 2792 C CA . PHE B 2 170 ? -18.546 -23.418 -8.060 1.00 20.72 ? 168 PHE H CA 1 +ATOM 2793 C C . PHE B 2 170 ? -19.880 -23.804 -8.666 1.00 24.60 ? 168 PHE H C 1 +ATOM 2794 O O . PHE B 2 170 ? -19.934 -24.290 -9.792 1.00 23.70 ? 168 PHE H O 1 +ATOM 2795 C CB . PHE B 2 170 ? -18.327 -21.912 -8.175 1.00 23.02 ? 168 PHE H CB 1 +ATOM 2796 C CG . PHE B 2 170 ? -17.177 -21.424 -7.336 1.00 25.64 ? 168 PHE H CG 1 +ATOM 2797 C CD1 . PHE B 2 170 ? -15.889 -21.415 -7.846 1.00 28.55 ? 168 PHE H CD1 1 +ATOM 2798 C CD2 . PHE B 2 170 ? -17.385 -21.016 -6.028 1.00 22.66 ? 168 PHE H CD2 1 +ATOM 2799 C CE1 . PHE B 2 170 ? -14.826 -20.999 -7.068 1.00 25.08 ? 168 PHE H CE1 1 +ATOM 2800 C CE2 . PHE B 2 170 ? -16.331 -20.587 -5.238 1.00 22.22 ? 168 PHE H CE2 1 +ATOM 2801 C CZ . PHE B 2 170 ? -15.049 -20.585 -5.758 1.00 24.71 ? 168 PHE H CZ 1 +ATOM 2802 N N . PRO B 2 171 ? -20.976 -23.637 -7.922 1.00 24.43 ? 169 PRO H N 1 +ATOM 2803 C CA . PRO B 2 171 ? -22.301 -23.831 -8.530 1.00 27.25 ? 169 PRO H CA 1 +ATOM 2804 C C . PRO B 2 171 ? -22.479 -22.857 -9.684 1.00 24.75 ? 169 PRO H C 1 +ATOM 2805 O O . PRO B 2 171 ? -22.045 -21.708 -9.614 1.00 26.49 ? 169 PRO H O 1 +ATOM 2806 C CB . PRO B 2 171 ? -23.282 -23.517 -7.390 1.00 26.76 ? 169 PRO H CB 1 +ATOM 2807 C CG . PRO B 2 171 ? -22.489 -23.613 -6.124 1.00 28.32 ? 169 PRO H CG 1 +ATOM 2808 C CD . PRO B 2 171 ? -21.048 -23.277 -6.496 1.00 24.24 ? 169 PRO H CD 1 +ATOM 2809 N N . ALA B 2 172 ? -23.145 -23.313 -10.744 1.00 25.32 ? 170 ALA H N 1 +ATOM 2810 C CA . ALA B 2 172 ? -23.436 -22.418 -11.854 1.00 27.97 ? 170 ALA H CA 1 +ATOM 2811 C C . ALA B 2 172 ? -24.441 -21.352 -11.435 1.00 32.78 ? 170 ALA H C 1 +ATOM 2812 O O . ALA B 2 172 ? -25.268 -21.562 -10.542 1.00 29.58 ? 170 ALA H O 1 +ATOM 2813 C CB . ALA B 2 172 ? -23.986 -23.203 -13.044 1.00 27.93 ? 170 ALA H CB 1 +ATOM 2814 N N . VAL B 2 173 ? -24.360 -20.194 -12.082 1.00 27.72 ? 171 VAL H N 1 +ATOM 2815 C CA . VAL B 2 173 ? -25.391 -19.173 -11.956 1.00 26.19 ? 171 VAL H CA 1 +ATOM 2816 C C . VAL B 2 173 ? -26.154 -19.110 -13.267 1.00 28.22 ? 171 VAL H C 1 +ATOM 2817 O O . VAL B 2 173 ? -25.605 -19.371 -14.344 1.00 23.74 ? 171 VAL H O 1 +ATOM 2818 C CB . VAL B 2 173 ? -24.846 -17.777 -11.590 1.00 27.21 ? 171 VAL H CB 1 +ATOM 2819 C CG1 . VAL B 2 173 ? -24.259 -17.800 -10.183 1.00 28.78 ? 171 VAL H CG1 1 +ATOM 2820 C CG2 . VAL B 2 173 ? -23.808 -17.292 -12.613 1.00 34.33 ? 171 VAL H CG2 1 +ATOM 2821 N N . LEU B 2 174 ? -27.433 -18.760 -13.166 1.00 25.34 ? 172 LEU H N 1 +ATOM 2822 C CA . LEU B 2 174 ? -28.287 -18.557 -14.332 1.00 23.86 ? 172 LEU H CA 1 +ATOM 2823 C C . LEU B 2 174 ? -28.247 -17.077 -14.675 1.00 25.29 ? 172 LEU H C 1 +ATOM 2824 O O . LEU B 2 174 ? -28.674 -16.238 -13.874 1.00 26.42 ? 172 LEU H O 1 +ATOM 2825 C CB . LEU B 2 174 ? -29.722 -19.014 -14.038 1.00 25.70 ? 172 LEU H CB 1 +ATOM 2826 C CG . LEU B 2 174 ? -30.738 -18.916 -15.187 1.00 28.83 ? 172 LEU H CG 1 +ATOM 2827 C CD1 . LEU B 2 174 ? -30.198 -19.592 -16.458 1.00 27.33 ? 172 LEU H CD1 1 +ATOM 2828 C CD2 . LEU B 2 174 ? -32.072 -19.532 -14.779 1.00 33.84 ? 172 LEU H CD2 1 +ATOM 2829 N N . GLN B 2 175 ? -27.700 -16.748 -15.834 1.00 25.21 ? 173 GLN H N 1 +ATOM 2830 C CA . GLN B 2 175 ? -27.604 -15.348 -16.210 1.00 30.99 ? 173 GLN H CA 1 +ATOM 2831 C C . GLN B 2 175 ? -28.937 -14.876 -16.788 1.00 38.28 ? 173 GLN H C 1 +ATOM 2832 O O . GLN B 2 175 ? -29.819 -15.676 -17.112 1.00 30.18 ? 173 GLN H O 1 +ATOM 2833 C CB . GLN B 2 175 ? -26.466 -15.151 -17.205 1.00 30.41 ? 173 GLN H CB 1 +ATOM 2834 C CG . GLN B 2 175 ? -25.179 -15.829 -16.746 1.00 30.16 ? 173 GLN H CG 1 +ATOM 2835 C CD . GLN B 2 175 ? -24.160 -15.980 -17.858 1.00 39.03 ? 173 GLN H CD 1 +ATOM 2836 O OE1 . GLN B 2 175 ? -23.151 -15.276 -17.885 1.00 42.77 ? 173 GLN H OE1 1 +ATOM 2837 N NE2 . GLN B 2 175 ? -24.410 -16.909 -18.771 1.00 30.84 ? 173 GLN H NE2 1 +ATOM 2838 N N . SER B 2 176 ? -29.089 -13.553 -16.910 1.00 38.85 ? 174 SER H N 1 +ATOM 2839 C CA . SER B 2 176 ? -30.344 -13.008 -17.425 1.00 38.09 ? 174 SER H CA 1 +ATOM 2840 C C . SER B 2 176 ? -30.576 -13.385 -18.882 1.00 39.13 ? 174 SER H C 1 +ATOM 2841 O O . SER B 2 176 ? -31.721 -13.345 -19.344 1.00 40.01 ? 174 SER H O 1 +ATOM 2842 C CB . SER B 2 176 ? -30.370 -11.486 -17.274 1.00 42.81 ? 174 SER H CB 1 +ATOM 2843 O OG . SER B 2 176 ? -29.226 -10.906 -17.871 1.00 48.45 ? 174 SER H OG 1 +ATOM 2844 N N . SER B 2 177 ? -29.517 -13.753 -19.607 1.00 34.13 ? 175 SER H N 1 +ATOM 2845 C CA . SER B 2 177 ? -29.629 -14.281 -20.961 1.00 32.97 ? 175 SER H CA 1 +ATOM 2846 C C . SER B 2 177 ? -30.324 -15.637 -21.025 1.00 35.24 ? 175 SER H C 1 +ATOM 2847 O O . SER B 2 177 ? -30.675 -16.084 -22.121 1.00 39.40 ? 175 SER H O 1 +ATOM 2848 C CB . SER B 2 177 ? -28.235 -14.418 -21.563 1.00 37.35 ? 175 SER H CB 1 +ATOM 2849 O OG . SER B 2 177 ? -27.506 -15.404 -20.843 1.00 31.68 ? 175 SER H OG 1 +ATOM 2850 N N . GLY B 2 178 ? -30.509 -16.309 -19.898 1.00 30.78 ? 176 GLY H N 1 +ATOM 2851 C CA . GLY B 2 178 ? -31.030 -17.657 -19.885 1.00 30.41 ? 176 GLY H CA 1 +ATOM 2852 C C . GLY B 2 178 ? -29.970 -18.731 -19.995 1.00 31.16 ? 176 GLY H C 1 +ATOM 2853 O O . GLY B 2 178 ? -30.305 -19.920 -19.948 1.00 28.77 ? 176 GLY H O 1 +ATOM 2854 N N . LEU B 2 179 ? -28.704 -18.352 -20.132 1.00 24.37 ? 177 LEU H N 1 +ATOM 2855 C CA . LEU B 2 179 ? -27.610 -19.303 -20.194 1.00 24.31 ? 177 LEU H CA 1 +ATOM 2856 C C . LEU B 2 179 ? -26.886 -19.349 -18.850 1.00 26.00 ? 177 LEU H C 1 +ATOM 2857 O O . LEU B 2 179 ? -26.877 -18.370 -18.099 1.00 27.19 ? 177 LEU H O 1 +ATOM 2858 C CB . LEU B 2 179 ? -26.621 -18.907 -21.292 1.00 22.34 ? 177 LEU H CB 1 +ATOM 2859 C CG . LEU B 2 179 ? -27.239 -18.701 -22.676 1.00 27.63 ? 177 LEU H CG 1 +ATOM 2860 C CD1 . LEU B 2 179 ? -26.152 -18.268 -23.664 1.00 28.90 ? 177 LEU H CD1 1 +ATOM 2861 C CD2 . LEU B 2 179 ? -27.866 -20.006 -23.113 1.00 27.73 ? 177 LEU H CD2 1 +ATOM 2862 N N . TYR B 2 180 ? -26.262 -20.491 -18.568 1.00 23.69 ? 178 TYR H N 1 +ATOM 2863 C CA . TYR B 2 180 ? -25.543 -20.709 -17.319 1.00 22.13 ? 178 TYR H CA 1 +ATOM 2864 C C . TYR B 2 180 ? -24.075 -20.333 -17.452 1.00 23.99 ? 178 TYR H C 1 +ATOM 2865 O O . TYR B 2 180 ? -23.507 -20.319 -18.544 1.00 25.06 ? 178 TYR H O 1 +ATOM 2866 C CB . TYR B 2 180 ? -25.647 -22.169 -16.896 1.00 25.23 ? 178 TYR H CB 1 +ATOM 2867 C CG . TYR B 2 180 ? -27.058 -22.570 -16.536 1.00 22.52 ? 178 TYR H CG 1 +ATOM 2868 C CD1 . TYR B 2 180 ? -27.534 -22.404 -15.239 1.00 22.65 ? 178 TYR H CD1 1 +ATOM 2869 C CD2 . TYR B 2 180 ? -27.913 -23.116 -17.498 1.00 28.21 ? 178 TYR H CD2 1 +ATOM 2870 C CE1 . TYR B 2 180 ? -28.839 -22.781 -14.898 1.00 28.66 ? 178 TYR H CE1 1 +ATOM 2871 C CE2 . TYR B 2 180 ? -29.229 -23.495 -17.158 1.00 30.14 ? 178 TYR H CE2 1 +ATOM 2872 C CZ . TYR B 2 180 ? -29.677 -23.323 -15.865 1.00 34.36 ? 178 TYR H CZ 1 +ATOM 2873 O OH . TYR B 2 180 ? -30.974 -23.691 -15.543 1.00 30.14 ? 178 TYR H OH 1 +ATOM 2874 N N . SER B 2 181 ? -23.441 -20.079 -16.302 1.00 24.33 ? 179 SER H N 1 +ATOM 2875 C CA . SER B 2 181 ? -22.015 -19.801 -16.310 1.00 22.77 ? 179 SER H CA 1 +ATOM 2876 C C . SER B 2 181 ? -21.472 -20.293 -14.978 1.00 27.56 ? 179 SER H C 1 +ATOM 2877 O O . SER B 2 181 ? -22.157 -20.227 -13.955 1.00 26.34 ? 179 SER H O 1 +ATOM 2878 C CB . SER B 2 181 ? -21.741 -18.307 -16.538 1.00 30.36 ? 179 SER H CB 1 +ATOM 2879 O OG . SER B 2 181 ? -20.411 -17.943 -16.219 1.00 43.38 ? 179 SER H OG 1 +ATOM 2880 N N . LEU B 2 182 ? -20.264 -20.831 -15.009 1.00 24.09 ? 180 LEU H N 1 +ATOM 2881 C CA . LEU B 2 182 ? -19.659 -21.457 -13.846 1.00 23.77 ? 180 LEU H CA 1 +ATOM 2882 C C . LEU B 2 182 ? -18.174 -21.158 -13.898 1.00 25.94 ? 180 LEU H C 1 +ATOM 2883 O O . LEU B 2 182 ? -17.618 -20.951 -14.976 1.00 28.97 ? 180 LEU H O 1 +ATOM 2884 C CB . LEU B 2 182 ? -19.917 -22.972 -13.880 1.00 31.83 ? 180 LEU H CB 1 +ATOM 2885 C CG . LEU B 2 182 ? -19.263 -24.062 -13.037 1.00 39.39 ? 180 LEU H CG 1 +ATOM 2886 C CD1 . LEU B 2 182 ? -20.185 -25.279 -12.998 1.00 37.09 ? 180 LEU H CD1 1 +ATOM 2887 C CD2 . LEU B 2 182 ? -17.909 -24.463 -13.599 1.00 32.47 ? 180 LEU H CD2 1 +ATOM 2888 N N . SER B 2 183 ? -17.534 -21.136 -12.739 1.00 26.41 ? 181 SER H N 1 +ATOM 2889 C CA A SER B 2 183 ? -16.088 -21.014 -12.668 0.33 29.14 ? 181 SER H CA 1 +ATOM 2890 C CA B SER B 2 183 ? -16.089 -21.015 -12.671 0.67 28.53 ? 181 SER H CA 1 +ATOM 2891 C C . SER B 2 183 ? -15.518 -22.194 -11.892 1.00 26.16 ? 181 SER H C 1 +ATOM 2892 O O . SER B 2 183 ? -16.162 -22.735 -10.993 1.00 23.91 ? 181 SER H O 1 +ATOM 2893 C CB A SER B 2 183 ? -15.666 -19.692 -12.012 0.33 32.33 ? 181 SER H CB 1 +ATOM 2894 C CB B SER B 2 183 ? -15.673 -19.696 -12.010 0.67 32.42 ? 181 SER H CB 1 +ATOM 2895 O OG A SER B 2 183 ? -15.200 -18.771 -12.985 0.33 35.23 ? 181 SER H OG 1 +ATOM 2896 O OG B SER B 2 183 ? -16.027 -19.692 -10.640 0.67 32.25 ? 181 SER H OG 1 +ATOM 2897 N N . SER B 2 184 ? -14.305 -22.595 -12.259 1.00 22.77 ? 182 SER H N 1 +ATOM 2898 C CA . SER B 2 184 ? -13.557 -23.624 -11.547 1.00 23.78 ? 182 SER H CA 1 +ATOM 2899 C C . SER B 2 184 ? -12.162 -23.085 -11.315 1.00 23.43 ? 182 SER H C 1 +ATOM 2900 O O . SER B 2 184 ? -11.514 -22.649 -12.270 1.00 24.98 ? 182 SER H O 1 +ATOM 2901 C CB . SER B 2 184 ? -13.477 -24.932 -12.340 1.00 27.06 ? 182 SER H CB 1 +ATOM 2902 O OG . SER B 2 184 ? -12.832 -25.949 -11.586 1.00 26.15 ? 182 SER H OG 1 +ATOM 2903 N N . VAL B 2 185 ? -11.697 -23.130 -10.064 1.00 25.28 ? 183 VAL H N 1 +ATOM 2904 C CA . VAL B 2 185 ? -10.390 -22.595 -9.714 1.00 26.72 ? 183 VAL H CA 1 +ATOM 2905 C C . VAL B 2 185 ? -9.582 -23.675 -9.009 1.00 28.72 ? 183 VAL H C 1 +ATOM 2906 O O . VAL B 2 185 ? -10.119 -24.662 -8.507 1.00 29.15 ? 183 VAL H O 1 +ATOM 2907 C CB . VAL B 2 185 ? -10.488 -21.345 -8.813 1.00 25.56 ? 183 VAL H CB 1 +ATOM 2908 C CG1 . VAL B 2 185 ? -11.283 -20.264 -9.523 1.00 27.74 ? 183 VAL H CG1 1 +ATOM 2909 C CG2 . VAL B 2 185 ? -11.154 -21.708 -7.474 1.00 23.80 ? 183 VAL H CG2 1 +ATOM 2910 N N . VAL B 2 186 ? -8.273 -23.473 -8.978 1.00 26.94 ? 184 VAL H N 1 +ATOM 2911 C CA . VAL B 2 186 ? -7.382 -24.313 -8.188 1.00 25.16 ? 184 VAL H CA 1 +ATOM 2912 C C . VAL B 2 186 ? -6.282 -23.414 -7.652 1.00 30.40 ? 184 VAL H C 1 +ATOM 2913 O O . VAL B 2 186 ? -5.879 -22.454 -8.318 1.00 27.26 ? 184 VAL H O 1 +ATOM 2914 C CB . VAL B 2 186 ? -6.816 -25.497 -9.015 1.00 29.10 ? 184 VAL H CB 1 +ATOM 2915 C CG1 . VAL B 2 186 ? -6.009 -25.001 -10.215 1.00 27.81 ? 184 VAL H CG1 1 +ATOM 2916 C CG2 . VAL B 2 186 ? -5.969 -26.418 -8.141 1.00 29.60 ? 184 VAL H CG2 1 +ATOM 2917 N N . THR B 2 187 ? -5.836 -23.682 -6.426 1.00 27.14 ? 185 THR H N 1 +ATOM 2918 C CA . THR B 2 187 ? -4.683 -22.994 -5.866 1.00 26.67 ? 185 THR H CA 1 +ATOM 2919 C C . THR B 2 187 ? -3.507 -23.957 -5.846 1.00 31.00 ? 185 THR H C 1 +ATOM 2920 O O . THR B 2 187 ? -3.666 -25.137 -5.519 1.00 30.88 ? 185 THR H O 1 +ATOM 2921 C CB . THR B 2 187 ? -4.965 -22.451 -4.461 1.00 32.08 ? 185 THR H CB 1 +ATOM 2922 O OG1 . THR B 2 187 ? -5.385 -23.519 -3.601 1.00 32.03 ? 185 THR H OG1 1 +ATOM 2923 C CG2 . THR B 2 187 ? -6.073 -21.379 -4.511 1.00 28.38 ? 185 THR H CG2 1 +ATOM 2924 N N . VAL B 2 188 ? -2.335 -23.450 -6.224 1.00 28.32 ? 186 VAL H N 1 +ATOM 2925 C CA . VAL B 2 188 ? -1.129 -24.252 -6.405 1.00 30.75 ? 186 VAL H CA 1 +ATOM 2926 C C . VAL B 2 188 ? 0.033 -23.449 -5.845 1.00 30.65 ? 186 VAL H C 1 +ATOM 2927 O O . VAL B 2 188 ? -0.107 -22.236 -5.633 1.00 31.91 ? 186 VAL H O 1 +ATOM 2928 C CB . VAL B 2 188 ? -0.889 -24.587 -7.887 1.00 33.41 ? 186 VAL H CB 1 +ATOM 2929 C CG1 . VAL B 2 188 ? -2.050 -25.392 -8.462 1.00 31.73 ? 186 VAL H CG1 1 +ATOM 2930 C CG2 . VAL B 2 188 ? -0.676 -23.306 -8.684 1.00 31.45 ? 186 VAL H CG2 1 +ATOM 2931 N N . PRO B 2 189 ? 1.187 -24.064 -5.592 1.00 35.76 ? 187 PRO H N 1 +ATOM 2932 C CA . PRO B 2 189 ? 2.366 -23.278 -5.213 1.00 35.84 ? 187 PRO H CA 1 +ATOM 2933 C C . PRO B 2 189 ? 2.780 -22.359 -6.351 1.00 37.90 ? 187 PRO H C 1 +ATOM 2934 O O . PRO B 2 189 ? 2.791 -22.755 -7.519 1.00 36.89 ? 187 PRO H O 1 +ATOM 2935 C CB . PRO B 2 189 ? 3.437 -24.344 -4.933 1.00 40.15 ? 187 PRO H CB 1 +ATOM 2936 C CG . PRO B 2 189 ? 2.675 -25.602 -4.659 1.00 41.70 ? 187 PRO H CG 1 +ATOM 2937 C CD . PRO B 2 189 ? 1.416 -25.515 -5.484 1.00 37.13 ? 187 PRO H CD 1 +ATOM 2938 N N . SER B 2 190 ? 3.125 -21.114 -6.003 1.00 33.02 ? 188 SER H N 1 +ATOM 2939 C CA . SER B 2 190 ? 3.531 -20.169 -7.038 1.00 38.45 ? 188 SER H CA 1 +ATOM 2940 C C . SER B 2 190 ? 4.759 -20.670 -7.787 1.00 34.64 ? 188 SER H C 1 +ATOM 2941 O O . SER B 2 190 ? 4.900 -20.418 -8.991 1.00 36.40 ? 188 SER H O 1 +ATOM 2942 C CB . SER B 2 190 ? 3.800 -18.794 -6.432 1.00 43.64 ? 188 SER H CB 1 +ATOM 2943 O OG . SER B 2 190 ? 4.657 -18.901 -5.316 1.00 53.63 ? 188 SER H OG 1 +ATOM 2944 N N . SER B 2 191 ? 5.640 -21.404 -7.103 1.00 31.57 ? 189 SER H N 1 +ATOM 2945 C CA . SER B 2 191 ? 6.824 -21.957 -7.754 1.00 33.14 ? 189 SER H CA 1 +ATOM 2946 C C . SER B 2 191 ? 6.481 -23.022 -8.794 1.00 34.13 ? 189 SER H C 1 +ATOM 2947 O O . SER B 2 191 ? 7.357 -23.407 -9.576 1.00 39.18 ? 189 SER H O 1 +ATOM 2948 C CB . SER B 2 191 ? 7.766 -22.535 -6.696 1.00 37.24 ? 189 SER H CB 1 +ATOM 2949 O OG . SER B 2 191 ? 7.185 -23.665 -6.073 1.00 47.76 ? 189 SER H OG 1 +ATOM 2950 N N . SER B 2 192 ? 5.240 -23.501 -8.822 1.00 32.34 ? 190 SER H N 1 +ATOM 2951 C CA . SER B 2 192 ? 4.774 -24.478 -9.798 1.00 41.23 ? 190 SER H CA 1 +ATOM 2952 C C . SER B 2 192 ? 4.349 -23.856 -11.121 1.00 44.59 ? 190 SER H C 1 +ATOM 2953 O O . SER B 2 192 ? 4.222 -24.583 -12.116 1.00 40.96 ? 190 SER H O 1 +ATOM 2954 C CB . SER B 2 192 ? 3.576 -25.266 -9.233 1.00 51.06 ? 190 SER H CB 1 +ATOM 2955 O OG . SER B 2 192 ? 3.994 -26.168 -8.225 1.00 58.91 ? 190 SER H OG 1 +ATOM 2956 N N . LEU B 2 193 ? 4.091 -22.544 -11.153 1.00 37.53 ? 191 LEU H N 1 +ATOM 2957 C CA . LEU B 2 193 ? 3.567 -21.929 -12.370 1.00 41.85 ? 191 LEU H CA 1 +ATOM 2958 C C . LEU B 2 193 ? 4.532 -22.074 -13.539 1.00 47.48 ? 191 LEU H C 1 +ATOM 2959 O O . LEU B 2 193 ? 4.098 -22.167 -14.692 1.00 49.18 ? 191 LEU H O 1 +ATOM 2960 C CB . LEU B 2 193 ? 3.251 -20.456 -12.123 1.00 35.46 ? 191 LEU H CB 1 +ATOM 2961 C CG . LEU B 2 193 ? 2.144 -20.234 -11.079 1.00 39.74 ? 191 LEU H CG 1 +ATOM 2962 C CD1 . LEU B 2 193 ? 1.971 -18.758 -10.764 1.00 38.66 ? 191 LEU H CD1 1 +ATOM 2963 C CD2 . LEU B 2 193 ? 0.826 -20.846 -11.519 1.00 41.40 ? 191 LEU H CD2 1 +ATOM 2964 N N . GLY B 2 194 ? 5.833 -22.100 -13.268 1.00 54.77 ? 192 GLY H N 1 +ATOM 2965 C CA . GLY B 2 194 ? 6.798 -22.285 -14.334 1.00 62.11 ? 192 GLY H CA 1 +ATOM 2966 C C . GLY B 2 194 ? 7.154 -23.716 -14.658 1.00 57.73 ? 192 GLY H C 1 +ATOM 2967 O O . GLY B 2 194 ? 7.839 -23.962 -15.654 1.00 56.56 ? 192 GLY H O 1 +ATOM 2968 N N . THR B 2 195 ? 6.708 -24.680 -13.850 1.00 47.46 ? 193 THR H N 1 +ATOM 2969 C CA . THR B 2 195 ? 7.128 -26.065 -14.020 1.00 49.86 ? 193 THR H CA 1 +ATOM 2970 C C . THR B 2 195 ? 6.001 -27.033 -14.331 1.00 44.47 ? 193 THR H C 1 +ATOM 2971 O O . THR B 2 195 ? 6.277 -28.122 -14.846 1.00 44.55 ? 193 THR H O 1 +ATOM 2972 C CB . THR B 2 195 ? 7.860 -26.570 -12.762 1.00 50.27 ? 193 THR H CB 1 +ATOM 2973 O OG1 . THR B 2 195 ? 6.937 -26.648 -11.664 1.00 50.43 ? 193 THR H OG1 1 +ATOM 2974 C CG2 . THR B 2 195 ? 9.001 -25.634 -12.398 1.00 48.84 ? 193 THR H CG2 1 +ATOM 2975 N N . GLN B 2 196 ? 4.755 -26.685 -14.041 1.00 39.65 ? 194 GLN H N 1 +ATOM 2976 C CA . GLN B 2 196 ? 3.641 -27.602 -14.215 1.00 40.44 ? 194 GLN H CA 1 +ATOM 2977 C C . GLN B 2 196 ? 2.615 -26.999 -15.166 1.00 40.98 ? 194 GLN H C 1 +ATOM 2978 O O . GLN B 2 196 ? 2.273 -25.819 -15.061 1.00 41.45 ? 194 GLN H O 1 +ATOM 2979 C CB . GLN B 2 196 ? 2.988 -27.928 -12.866 1.00 46.70 ? 194 GLN H CB 1 +ATOM 2980 C CG . GLN B 2 196 ? 1.719 -28.772 -12.970 1.00 51.78 ? 194 GLN H CG 1 +ATOM 2981 C CD . GLN B 2 196 ? 2.004 -30.216 -13.349 1.00 54.15 ? 194 GLN H CD 1 +ATOM 2982 O OE1 . GLN B 2 196 ? 2.858 -30.869 -12.749 1.00 54.29 ? 194 GLN H OE1 1 +ATOM 2983 N NE2 . GLN B 2 196 ? 1.285 -30.720 -14.349 1.00 50.56 ? 194 GLN H NE2 1 +ATOM 2984 N N . THR B 2 197 ? 2.128 -27.811 -16.094 1.00 35.22 ? 195 THR H N 1 +ATOM 2985 C CA . THR B 2 197 ? 1.050 -27.390 -16.976 1.00 33.00 ? 195 THR H CA 1 +ATOM 2986 C C . THR B 2 197 ? -0.300 -27.616 -16.299 1.00 36.13 ? 195 THR H C 1 +ATOM 2987 O O . THR B 2 197 ? -0.514 -28.632 -15.634 1.00 36.51 ? 195 THR H O 1 +ATOM 2988 C CB . THR B 2 197 ? 1.123 -28.152 -18.298 1.00 43.40 ? 195 THR H CB 1 +ATOM 2989 O OG1 . THR B 2 197 ? 2.469 -28.099 -18.786 1.00 43.01 ? 195 THR H OG1 1 +ATOM 2990 C CG2 . THR B 2 197 ? 0.194 -27.532 -19.334 1.00 49.72 ? 195 THR H CG2 1 +ATOM 2991 N N . TYR B 2 198 ? -1.208 -26.658 -16.470 1.00 35.74 ? 196 TYR H N 1 +ATOM 2992 C CA . TYR B 2 198 ? -2.544 -26.720 -15.885 1.00 29.93 ? 196 TYR H CA 1 +ATOM 2993 C C . TYR B 2 198 ? -3.581 -26.642 -16.998 1.00 29.97 ? 196 TYR H C 1 +ATOM 2994 O O . TYR B 2 198 ? -3.636 -25.651 -17.732 1.00 35.99 ? 196 TYR H O 1 +ATOM 2995 C CB . TYR B 2 198 ? -2.742 -25.594 -14.864 1.00 29.10 ? 196 TYR H CB 1 +ATOM 2996 C CG . TYR B 2 198 ? -1.817 -25.763 -13.686 1.00 29.12 ? 196 TYR H CG 1 +ATOM 2997 C CD1 . TYR B 2 198 ? -2.031 -26.779 -12.767 1.00 31.53 ? 196 TYR H CD1 1 +ATOM 2998 C CD2 . TYR B 2 198 ? -0.707 -24.943 -13.516 1.00 30.17 ? 196 TYR H CD2 1 +ATOM 2999 C CE1 . TYR B 2 198 ? -1.162 -26.970 -11.692 1.00 27.92 ? 196 TYR H CE1 1 +ATOM 3000 C CE2 . TYR B 2 198 ? 0.157 -25.121 -12.437 1.00 33.29 ? 196 TYR H CE2 1 +ATOM 3001 C CZ . TYR B 2 198 ? -0.089 -26.136 -11.529 1.00 29.14 ? 196 TYR H CZ 1 +ATOM 3002 O OH . TYR B 2 198 ? 0.744 -26.341 -10.451 1.00 33.31 ? 196 TYR H OH 1 +ATOM 3003 N N . ILE B 2 199 ? -4.387 -27.693 -17.127 1.00 29.14 ? 197 ILE H N 1 +ATOM 3004 C CA . ILE B 2 199 ? -5.417 -27.786 -18.158 1.00 28.63 ? 197 ILE H CA 1 +ATOM 3005 C C . ILE B 2 199 ? -6.736 -28.126 -17.485 1.00 30.68 ? 197 ILE H C 1 +ATOM 3006 O O . ILE B 2 199 ? -6.825 -29.110 -16.744 1.00 34.23 ? 197 ILE H O 1 +ATOM 3007 C CB . ILE B 2 199 ? -5.077 -28.852 -19.219 1.00 31.87 ? 197 ILE H CB 1 +ATOM 3008 C CG1 . ILE B 2 199 ? -3.726 -28.568 -19.870 1.00 36.96 ? 197 ILE H CG1 1 +ATOM 3009 C CG2 . ILE B 2 199 ? -6.165 -28.924 -20.282 1.00 34.90 ? 197 ILE H CG2 1 +ATOM 3010 C CD1 . ILE B 2 199 ? -3.154 -29.775 -20.599 1.00 41.32 ? 197 ILE H CD1 1 +ATOM 3011 N N . CYS B 2 200 ? -7.763 -27.331 -17.746 1.00 30.20 ? 198 CYS H N 1 +ATOM 3012 C CA . CYS B 2 200 ? -9.101 -27.661 -17.281 1.00 26.72 ? 198 CYS H CA 1 +ATOM 3013 C C . CYS B 2 200 ? -9.858 -28.369 -18.399 1.00 30.12 ? 198 CYS H C 1 +ATOM 3014 O O . CYS B 2 200 ? -9.815 -27.941 -19.561 1.00 32.68 ? 198 CYS H O 1 +ATOM 3015 C CB . CYS B 2 200 ? -9.843 -26.414 -16.812 1.00 37.69 ? 198 CYS H CB 1 +ATOM 3016 S SG . CYS B 2 200 ? -10.472 -25.385 -18.133 1.00 44.51 ? 198 CYS H SG 1 +ATOM 3017 N N . ASN B 2 201 ? -10.506 -29.475 -18.053 1.00 31.59 ? 199 ASN H N 1 +ATOM 3018 C CA . ASN B 2 201 ? -11.210 -30.328 -19.005 1.00 37.09 ? 199 ASN H CA 1 +ATOM 3019 C C . ASN B 2 201 ? -12.694 -30.140 -18.743 1.00 37.73 ? 199 ASN H C 1 +ATOM 3020 O O . ASN B 2 201 ? -13.195 -30.529 -17.685 1.00 36.66 ? 199 ASN H O 1 +ATOM 3021 C CB . ASN B 2 201 ? -10.805 -31.792 -18.848 1.00 37.74 ? 199 ASN H CB 1 +ATOM 3022 C CG . ASN B 2 201 ? -9.335 -31.961 -18.494 1.00 43.09 ? 199 ASN H CG 1 +ATOM 3023 O OD1 . ASN B 2 201 ? -8.994 -32.280 -17.354 1.00 40.45 ? 199 ASN H OD1 1 +ATOM 3024 N ND2 . ASN B 2 201 ? -8.459 -31.770 -19.477 1.00 37.60 ? 199 ASN H ND2 1 +ATOM 3025 N N . VAL B 2 202 ? -13.388 -29.518 -19.685 1.00 34.26 ? 200 VAL H N 1 +ATOM 3026 C CA . VAL B 2 202 ? -14.792 -29.176 -19.520 1.00 30.58 ? 200 VAL H CA 1 +ATOM 3027 C C . VAL B 2 202 ? -15.604 -30.103 -20.410 1.00 36.03 ? 200 VAL H C 1 +ATOM 3028 O O . VAL B 2 202 ? -15.300 -30.259 -21.599 1.00 39.86 ? 200 VAL H O 1 +ATOM 3029 C CB . VAL B 2 202 ? -15.053 -27.698 -19.855 1.00 30.43 ? 200 VAL H CB 1 +ATOM 3030 C CG1 . VAL B 2 202 ? -16.534 -27.376 -19.674 1.00 30.21 ? 200 VAL H CG1 1 +ATOM 3031 C CG2 . VAL B 2 202 ? -14.162 -26.783 -18.984 1.00 27.96 ? 200 VAL H CG2 1 +ATOM 3032 N N . ASN B 2 203 ? -16.617 -30.736 -19.833 1.00 35.90 ? 201 ASN H N 1 +ATOM 3033 C CA . ASN B 2 203 ? -17.479 -31.639 -20.581 1.00 37.58 ? 201 ASN H CA 1 +ATOM 3034 C C . ASN B 2 203 ? -18.920 -31.186 -20.403 1.00 37.66 ? 201 ASN H C 1 +ATOM 3035 O O . ASN B 2 203 ? -19.377 -30.985 -19.275 1.00 38.27 ? 201 ASN H O 1 +ATOM 3036 C CB . ASN B 2 203 ? -17.296 -33.089 -20.111 1.00 49.95 ? 201 ASN H CB 1 +ATOM 3037 C CG . ASN B 2 203 ? -18.018 -34.086 -20.999 1.00 67.97 ? 201 ASN H CG 1 +ATOM 3038 O OD1 . ASN B 2 203 ? -18.574 -33.725 -22.038 1.00 72.75 ? 201 ASN H OD1 1 +ATOM 3039 N ND2 . ASN B 2 203 ? -18.004 -35.352 -20.599 1.00 71.95 ? 201 ASN H ND2 1 +ATOM 3040 N N . HIS B 2 204 ? -19.619 -30.999 -21.519 1.00 36.79 ? 202 HIS H N 1 +ATOM 3041 C CA . HIS B 2 204 ? -21.028 -30.629 -21.532 1.00 36.98 ? 202 HIS H CA 1 +ATOM 3042 C C . HIS B 2 204 ? -21.733 -31.699 -22.369 1.00 39.09 ? 202 HIS H C 1 +ATOM 3043 O O . HIS B 2 204 ? -21.779 -31.612 -23.598 1.00 36.23 ? 202 HIS H O 1 +ATOM 3044 C CB . HIS B 2 204 ? -21.220 -29.222 -22.099 1.00 33.57 ? 202 HIS H CB 1 +ATOM 3045 C CG . HIS B 2 204 ? -22.636 -28.737 -22.051 1.00 35.90 ? 202 HIS H CG 1 +ATOM 3046 N ND1 . HIS B 2 204 ? -23.334 -28.366 -23.182 1.00 35.64 ? 202 HIS H ND1 1 +ATOM 3047 C CD2 . HIS B 2 204 ? -23.485 -28.570 -21.011 1.00 31.59 ? 202 HIS H CD2 1 +ATOM 3048 C CE1 . HIS B 2 204 ? -24.549 -27.978 -22.836 1.00 34.70 ? 202 HIS H CE1 1 +ATOM 3049 N NE2 . HIS B 2 204 ? -24.666 -28.091 -21.525 1.00 33.76 ? 202 HIS H NE2 1 +ATOM 3050 N N . LYS B 2 205 ? -22.259 -32.718 -21.700 1.00 37.17 ? 203 LYS H N 1 +ATOM 3051 C CA . LYS B 2 205 ? -22.850 -33.845 -22.419 1.00 47.82 ? 203 LYS H CA 1 +ATOM 3052 C C . LYS B 2 205 ? -24.110 -33.482 -23.209 1.00 41.14 ? 203 LYS H C 1 +ATOM 3053 O O . LYS B 2 205 ? -24.342 -34.080 -24.262 1.00 42.71 ? 203 LYS H O 1 +ATOM 3054 C CB . LYS B 2 205 ? -23.147 -35.005 -21.461 1.00 59.28 ? 203 LYS H CB 1 +ATOM 3055 C CG . LYS B 2 205 ? -22.084 -35.214 -20.387 1.00 76.10 ? 203 LYS H CG 1 +ATOM 3056 C CD . LYS B 2 205 ? -22.593 -36.079 -19.237 1.00 84.73 ? 203 LYS H CD 1 +ATOM 3057 C CE . LYS B 2 205 ? -23.818 -35.463 -18.565 1.00 85.06 ? 203 LYS H CE 1 +ATOM 3058 N NZ . LYS B 2 205 ? -23.468 -34.697 -17.334 1.00 80.75 ? 203 LYS H NZ 1 +ATOM 3059 N N . PRO B 2 206 ? -24.951 -32.538 -22.768 1.00 41.85 ? 204 PRO H N 1 +ATOM 3060 C CA . PRO B 2 206 ? -26.131 -32.211 -23.590 1.00 43.19 ? 204 PRO H CA 1 +ATOM 3061 C C . PRO B 2 206 ? -25.801 -31.668 -24.971 1.00 48.29 ? 204 PRO H C 1 +ATOM 3062 O O . PRO B 2 206 ? -26.592 -31.872 -25.900 1.00 47.45 ? 204 PRO H O 1 +ATOM 3063 C CB . PRO B 2 206 ? -26.880 -31.180 -22.735 1.00 36.85 ? 204 PRO H CB 1 +ATOM 3064 C CG . PRO B 2 206 ? -26.484 -31.518 -21.342 1.00 36.79 ? 204 PRO H CG 1 +ATOM 3065 C CD . PRO B 2 206 ? -25.053 -31.929 -21.429 1.00 34.32 ? 204 PRO H CD 1 +ATOM 3066 N N . SER B 2 207 ? -24.664 -30.992 -25.151 1.00 44.03 ? 205 SER H N 1 +ATOM 3067 C CA . SER B 2 207 ? -24.267 -30.538 -26.478 1.00 39.84 ? 205 SER H CA 1 +ATOM 3068 C C . SER B 2 207 ? -23.183 -31.406 -27.098 1.00 40.34 ? 205 SER H C 1 +ATOM 3069 O O . SER B 2 207 ? -22.698 -31.077 -28.183 1.00 40.91 ? 205 SER H O 1 +ATOM 3070 C CB . SER B 2 207 ? -23.779 -29.086 -26.430 1.00 44.42 ? 205 SER H CB 1 +ATOM 3071 O OG . SER B 2 207 ? -22.584 -28.981 -25.669 1.00 36.11 ? 205 SER H OG 1 +ATOM 3072 N N . ASN B 2 208 ? -22.788 -32.489 -26.430 1.00 45.89 ? 206 ASN H N 1 +ATOM 3073 C CA . ASN B 2 208 ? -21.657 -33.316 -26.849 1.00 49.50 ? 206 ASN H CA 1 +ATOM 3074 C C . ASN B 2 208 ? -20.412 -32.467 -27.106 1.00 47.61 ? 206 ASN H C 1 +ATOM 3075 O O . ASN B 2 208 ? -19.702 -32.635 -28.097 1.00 50.12 ? 206 ASN H O 1 +ATOM 3076 C CB . ASN B 2 208 ? -22.019 -34.155 -28.072 1.00 61.19 ? 206 ASN H CB 1 +ATOM 3077 C CG . ASN B 2 208 ? -22.251 -35.600 -27.722 1.00 80.86 ? 206 ASN H CG 1 +ATOM 3078 O OD1 . ASN B 2 208 ? -21.304 -36.370 -27.563 1.00 87.32 ? 206 ASN H OD1 1 +ATOM 3079 N ND2 . ASN B 2 208 ? -23.516 -35.978 -27.573 1.00 89.44 ? 206 ASN H ND2 1 +ATOM 3080 N N . THR B 2 209 ? -20.147 -31.541 -26.189 1.00 49.44 ? 207 THR H N 1 +ATOM 3081 C CA . THR B 2 209 ? -19.011 -30.636 -26.288 1.00 47.39 ? 207 THR H CA 1 +ATOM 3082 C C . THR B 2 209 ? -17.996 -30.991 -25.213 1.00 43.82 ? 207 THR H C 1 +ATOM 3083 O O . THR B 2 209 ? -18.362 -31.171 -24.048 1.00 44.56 ? 207 THR H O 1 +ATOM 3084 C CB . THR B 2 209 ? -19.456 -29.180 -26.129 1.00 50.09 ? 207 THR H CB 1 +ATOM 3085 O OG1 . THR B 2 209 ? -20.332 -28.829 -27.209 1.00 54.15 ? 207 THR H OG1 1 +ATOM 3086 C CG2 . THR B 2 209 ? -18.243 -28.236 -26.138 1.00 44.23 ? 207 THR H CG2 1 +ATOM 3087 N N . LYS B 2 210 ? -16.729 -31.100 -25.605 1.00 41.71 ? 208 LYS H N 1 +ATOM 3088 C CA . LYS B 2 210 ? -15.627 -31.272 -24.664 1.00 43.61 ? 208 LYS H CA 1 +ATOM 3089 C C . LYS B 2 210 ? -14.529 -30.290 -25.036 1.00 43.88 ? 208 LYS H C 1 +ATOM 3090 O O . LYS B 2 210 ? -14.154 -30.191 -26.207 1.00 43.88 ? 208 LYS H O 1 +ATOM 3091 C CB . LYS B 2 210 ? -15.079 -32.707 -24.664 1.00 50.69 ? 208 LYS H CB 1 +ATOM 3092 C CG . LYS B 2 210 ? -16.116 -33.775 -24.359 1.00 61.13 ? 208 LYS H CG 1 +ATOM 3093 C CD . LYS B 2 210 ? -15.632 -35.163 -24.769 1.00 71.91 ? 208 LYS H CD 1 +ATOM 3094 C CE . LYS B 2 210 ? -15.615 -36.125 -23.584 1.00 74.89 ? 208 LYS H CE 1 +ATOM 3095 N NZ . LYS B 2 210 ? -14.511 -37.122 -23.689 1.00 77.52 ? 208 LYS H NZ 1 +ATOM 3096 N N . VAL B 2 211 ? -14.037 -29.550 -24.046 1.00 39.76 ? 209 VAL H N 1 +ATOM 3097 C CA . VAL B 2 211 ? -13.023 -28.524 -24.246 1.00 40.29 ? 209 VAL H CA 1 +ATOM 3098 C C . VAL B 2 211 ? -11.919 -28.732 -23.224 1.00 43.77 ? 209 VAL H C 1 +ATOM 3099 O O . VAL B 2 211 ? -12.199 -28.913 -22.036 1.00 41.96 ? 209 VAL H O 1 +ATOM 3100 C CB . VAL B 2 211 ? -13.607 -27.102 -24.113 1.00 41.78 ? 209 VAL H CB 1 +ATOM 3101 C CG1 . VAL B 2 211 ? -12.549 -26.064 -24.460 1.00 46.54 ? 209 VAL H CG1 1 +ATOM 3102 C CG2 . VAL B 2 211 ? -14.820 -26.937 -25.021 1.00 43.07 ? 209 VAL H CG2 1 +ATOM 3103 N N . ASP B 2 212 ? -10.674 -28.717 -23.681 1.00 39.54 ? 210 ASP H N 1 +ATOM 3104 C CA . ASP B 2 212 ? -9.512 -28.655 -22.803 1.00 42.36 ? 210 ASP H CA 1 +ATOM 3105 C C . ASP B 2 212 ? -8.887 -27.281 -22.981 1.00 43.96 ? 210 ASP H C 1 +ATOM 3106 O O . ASP B 2 212 ? -8.537 -26.898 -24.101 1.00 54.72 ? 210 ASP H O 1 +ATOM 3107 C CB . ASP B 2 212 ? -8.500 -29.758 -23.129 1.00 45.76 ? 210 ASP H CB 1 +ATOM 3108 C CG . ASP B 2 212 ? -9.058 -31.156 -22.905 1.00 51.76 ? 210 ASP H CG 1 +ATOM 3109 O OD1 . ASP B 2 212 ? -9.880 -31.338 -21.989 1.00 48.10 ? 210 ASP H OD1 1 +ATOM 3110 O OD2 . ASP B 2 212 ? -8.686 -32.074 -23.664 1.00 58.61 ? 210 ASP H OD2 1 +ATOM 3111 N N . LYS B 2 213 ? -8.749 -26.537 -21.892 1.00 37.30 ? 211 LYS H N 1 +ATOM 3112 C CA . LYS B 2 213 ? -8.162 -25.204 -21.953 1.00 35.45 ? 211 LYS H CA 1 +ATOM 3113 C C . LYS B 2 213 ? -6.902 -25.175 -21.102 1.00 39.81 ? 211 LYS H C 1 +ATOM 3114 O O . LYS B 2 213 ? -6.962 -25.420 -19.893 1.00 32.75 ? 211 LYS H O 1 +ATOM 3115 C CB . LYS B 2 213 ? -9.157 -24.140 -21.484 1.00 33.98 ? 211 LYS H CB 1 +ATOM 3116 C CG . LYS B 2 213 ? -8.792 -22.725 -21.908 1.00 44.37 ? 211 LYS H CG 1 +ATOM 3117 C CD . LYS B 2 213 ? -8.727 -22.601 -23.426 1.00 56.60 ? 211 LYS H CD 1 +ATOM 3118 C CE . LYS B 2 213 ? -8.717 -21.148 -23.873 1.00 62.55 ? 211 LYS H CE 1 +ATOM 3119 N NZ . LYS B 2 213 ? -7.517 -20.407 -23.389 1.00 64.66 ? 211 LYS H NZ 1 +ATOM 3120 N N . ARG B 2 214 ? -5.764 -24.885 -21.729 1.00 32.28 ? 212 ARG H N 1 +ATOM 3121 C CA . ARG B 2 214 ? -4.547 -24.673 -20.962 1.00 29.78 ? 212 ARG H CA 1 +ATOM 3122 C C . ARG B 2 214 ? -4.568 -23.281 -20.351 1.00 34.78 ? 212 ARG H C 1 +ATOM 3123 O O . ARG B 2 214 ? -4.937 -22.302 -21.004 1.00 43.93 ? 212 ARG H O 1 +ATOM 3124 C CB . ARG B 2 214 ? -3.300 -24.845 -21.839 1.00 39.31 ? 212 ARG H CB 1 +ATOM 3125 C CG . ARG B 2 214 ? -2.016 -24.565 -21.067 1.00 51.28 ? 212 ARG H CG 1 +ATOM 3126 C CD . ARG B 2 214 ? -0.777 -25.097 -21.759 1.00 68.77 ? 212 ARG H CD 1 +ATOM 3127 N NE . ARG B 2 214 ? -0.693 -24.669 -23.148 1.00 82.60 ? 212 ARG H NE 1 +ATOM 3128 C CZ . ARG B 2 214 ? 0.401 -24.785 -23.891 1.00 94.80 ? 212 ARG H CZ 1 +ATOM 3129 N NH1 . ARG B 2 214 ? 0.396 -24.372 -25.153 1.00 97.08 ? 212 ARG H NH1 1 +ATOM 3130 N NH2 . ARG B 2 214 ? 1.501 -25.311 -23.369 1.00 98.61 ? 212 ARG H NH2 1 +ATOM 3131 N N . VAL B 2 215 ? -4.196 -23.194 -19.081 1.00 31.43 ? 213 VAL H N 1 +ATOM 3132 C CA . VAL B 2 215 ? -4.219 -21.930 -18.358 1.00 31.45 ? 213 VAL H CA 1 +ATOM 3133 C C . VAL B 2 215 ? -2.792 -21.619 -17.946 1.00 36.40 ? 213 VAL H C 1 +ATOM 3134 O O . VAL B 2 215 ? -2.186 -22.379 -17.181 1.00 35.19 ? 213 VAL H O 1 +ATOM 3135 C CB . VAL B 2 215 ? -5.150 -21.988 -17.139 1.00 30.24 ? 213 VAL H CB 1 +ATOM 3136 C CG1 . VAL B 2 215 ? -5.139 -20.659 -16.394 1.00 34.58 ? 213 VAL H CG1 1 +ATOM 3137 C CG2 . VAL B 2 215 ? -6.565 -22.343 -17.574 1.00 31.99 ? 213 VAL H CG2 1 +ATOM 3138 N N . GLU B 2 216 ? -2.260 -20.514 -18.442 1.00 43.55 ? 214 GLU H N 1 +ATOM 3139 C CA . GLU B 2 216 ? -0.875 -20.149 -18.186 1.00 49.91 ? 214 GLU H CA 1 +ATOM 3140 C C . GLU B 2 216 ? -0.770 -18.693 -17.781 1.00 49.17 ? 214 GLU H C 1 +ATOM 3141 O O . GLU B 2 216 ? -1.681 -17.895 -18.043 1.00 44.34 ? 214 GLU H O 1 +ATOM 3142 C CB . GLU B 2 216 ? -0.011 -20.413 -19.427 1.00 55.47 ? 214 GLU H CB 1 +ATOM 3143 C CG . GLU B 2 216 ? -0.740 -20.258 -20.737 1.00 65.72 ? 214 GLU H CG 1 +ATOM 3144 C CD . GLU B 2 216 ? 0.075 -20.788 -21.899 1.00 76.00 ? 214 GLU H CD 1 +ATOM 3145 O OE1 . GLU B 2 216 ? 0.557 -21.940 -21.815 1.00 76.72 ? 214 GLU H OE1 1 +ATOM 3146 O OE2 . GLU B 2 216 ? 0.246 -20.045 -22.887 1.00 77.28 ? 214 GLU H OE2 1 +ATOM 3147 N N . PRO B 2 217 ? 0.328 -18.303 -17.124 1.00 56.36 ? 215 PRO H N 1 +ATOM 3148 C CA . PRO B 2 217 ? 0.545 -16.882 -16.835 1.00 65.93 ? 215 PRO H CA 1 +ATOM 3149 C C . PRO B 2 217 ? 0.691 -16.081 -18.121 1.00 73.64 ? 215 PRO H C 1 +ATOM 3150 O O . PRO B 2 217 ? 1.198 -16.575 -19.130 1.00 70.93 ? 215 PRO H O 1 +ATOM 3151 C CB . PRO B 2 217 ? 1.847 -16.873 -16.022 1.00 63.21 ? 215 PRO H CB 1 +ATOM 3152 C CG . PRO B 2 217 ? 2.024 -18.283 -15.539 1.00 58.34 ? 215 PRO H CG 1 +ATOM 3153 C CD . PRO B 2 217 ? 1.406 -19.153 -16.580 1.00 55.55 ? 215 PRO H CD 1 +ATOM 3154 N N . LYS B 2 218 ? 0.237 -14.833 -18.080 1.00 83.12 ? 216 LYS H N 1 +ATOM 3155 C CA . LYS B 2 218 ? 0.360 -13.942 -19.224 1.00 92.91 ? 216 LYS H CA 1 +ATOM 3156 C C . LYS B 2 218 ? 1.669 -13.153 -19.159 1.00 96.73 ? 216 LYS H C 1 +ATOM 3157 O O . LYS B 2 218 ? 2.320 -13.073 -18.114 1.00 98.78 ? 216 LYS H O 1 +ATOM 3158 C CB . LYS B 2 218 ? -0.830 -12.981 -19.290 1.00 92.72 ? 216 LYS H CB 1 +ATOM 3159 C CG . LYS B 2 218 ? -1.272 -12.622 -20.704 1.00 92.57 ? 216 LYS H CG 1 +ATOM 3160 C CD . LYS B 2 218 ? -2.233 -11.442 -20.703 1.00 91.73 ? 216 LYS H CD 1 +ATOM 3161 C CE . LYS B 2 218 ? -3.497 -11.752 -21.492 1.00 90.95 ? 216 LYS H CE 1 +ATOM 3162 N NZ . LYS B 2 218 ? -3.202 -12.374 -22.815 1.00 92.30 ? 216 LYS H NZ 1 +ATOM 3163 N N . SER B 2 219 ? 2.041 -12.579 -20.309 1.00 96.97 ? 217 SER H N 1 +ATOM 3164 C CA . SER B 2 219 ? 3.218 -11.708 -20.508 1.00 92.07 ? 217 SER H CA 1 +ATOM 3165 C C . SER B 2 219 ? 4.242 -11.655 -19.372 1.00 95.93 ? 217 SER H C 1 +ATOM 3166 O O . SER B 2 219 ? 4.522 -10.584 -18.829 1.00 96.86 ? 217 SER H O 1 +ATOM 3167 C CB . SER B 2 219 ? 2.752 -10.278 -20.800 1.00 85.28 ? 217 SER H CB 1 +ATOM 3168 O OG . SER B 2 219 ? 1.656 -10.270 -21.695 1.00 85.29 ? 217 SER H OG 1 +ATOM 3169 N N . ASP C 3 2 ? -56.003 -13.168 7.345 1.00 55.18 ? 0 ASP L N 1 +ATOM 3170 C CA . ASP C 3 2 ? -54.631 -13.174 6.846 1.00 58.51 ? 0 ASP L CA 1 +ATOM 3171 C C . ASP C 3 2 ? -53.997 -14.554 7.012 1.00 53.05 ? 0 ASP L C 1 +ATOM 3172 O O . ASP C 3 2 ? -54.187 -15.221 8.030 1.00 54.11 ? 0 ASP L O 1 +ATOM 3173 C CB . ASP C 3 2 ? -53.793 -12.110 7.562 1.00 61.00 ? 0 ASP L CB 1 +ATOM 3174 C CG . ASP C 3 2 ? -53.930 -10.726 6.928 1.00 70.12 ? 0 ASP L CG 1 +ATOM 3175 O OD1 . ASP C 3 2 ? -54.945 -10.473 6.240 1.00 67.74 ? 0 ASP L OD1 1 +ATOM 3176 O OD2 . ASP C 3 2 ? -53.018 -9.890 7.119 1.00 69.54 ? 0 ASP L OD2 1 +ATOM 3177 N N . ASP C 3 3 ? -53.253 -14.976 5.993 1.00 44.72 ? 1 ASP L N 1 +ATOM 3178 C CA . ASP C 3 3 ? -52.607 -16.281 6.011 1.00 45.18 ? 1 ASP L CA 1 +ATOM 3179 C C . ASP C 3 3 ? -51.587 -16.370 7.139 1.00 47.40 ? 1 ASP L C 1 +ATOM 3180 O O . ASP C 3 3 ? -50.903 -15.399 7.474 1.00 42.06 ? 1 ASP L O 1 +ATOM 3181 C CB . ASP C 3 3 ? -51.905 -16.552 4.680 1.00 47.24 ? 1 ASP L CB 1 +ATOM 3182 C CG . ASP C 3 3 ? -52.872 -16.683 3.524 1.00 63.63 ? 1 ASP L CG 1 +ATOM 3183 O OD1 . ASP C 3 3 ? -54.100 -16.664 3.764 1.00 62.82 ? 1 ASP L OD1 1 +ATOM 3184 O OD2 . ASP C 3 3 ? -52.398 -16.810 2.376 1.00 70.42 ? 1 ASP L OD2 1 +ATOM 3185 N N . ILE C 3 4 ? -51.472 -17.558 7.711 1.00 43.06 ? 2 ILE L N 1 +ATOM 3186 C CA . ILE C 3 4 ? -50.456 -17.806 8.725 1.00 38.65 ? 2 ILE L CA 1 +ATOM 3187 C C . ILE C 3 4 ? -49.103 -17.971 8.042 1.00 41.84 ? 2 ILE L C 1 +ATOM 3188 O O . ILE C 3 4 ? -48.986 -18.659 7.025 1.00 41.45 ? 2 ILE L O 1 +ATOM 3189 C CB . ILE C 3 4 ? -50.825 -19.033 9.570 1.00 38.19 ? 2 ILE L CB 1 +ATOM 3190 C CG1 . ILE C 3 4 ? -52.051 -18.695 10.423 1.00 38.34 ? 2 ILE L CG1 1 +ATOM 3191 C CG2 . ILE C 3 4 ? -49.623 -19.475 10.427 1.00 37.57 ? 2 ILE L CG2 1 +ATOM 3192 C CD1 . ILE C 3 4 ? -52.646 -19.864 11.171 1.00 41.52 ? 2 ILE L CD1 1 +ATOM 3193 N N . VAL C 3 5 ? -48.084 -17.319 8.596 1.00 36.46 ? 3 VAL L N 1 +ATOM 3194 C CA . VAL C 3 5 ? -46.715 -17.377 8.094 1.00 38.29 ? 3 VAL L CA 1 +ATOM 3195 C C . VAL C 3 5 ? -45.870 -18.195 9.065 1.00 30.68 ? 3 VAL L C 1 +ATOM 3196 O O . VAL C 3 5 ? -45.932 -17.983 10.278 1.00 34.34 ? 3 VAL L O 1 +ATOM 3197 C CB . VAL C 3 5 ? -46.117 -15.965 7.932 1.00 41.65 ? 3 VAL L CB 1 +ATOM 3198 C CG1 . VAL C 3 5 ? -44.697 -16.047 7.405 1.00 46.46 ? 3 VAL L CG1 1 +ATOM 3199 C CG2 . VAL C 3 5 ? -46.981 -15.115 7.012 1.00 52.56 ? 3 VAL L CG2 1 +ATOM 3200 N N . MET C 3 6 ? -45.082 -19.124 8.523 1.00 29.35 ? 4 MET L N 1 +ATOM 3201 C CA . MET C 3 6 ? -44.139 -19.909 9.322 1.00 28.54 ? 4 MET L CA 1 +ATOM 3202 C C . MET C 3 6 ? -42.741 -19.335 9.137 1.00 37.02 ? 4 MET L C 1 +ATOM 3203 O O . MET C 3 6 ? -42.207 -19.344 8.022 1.00 37.77 ? 4 MET L O 1 +ATOM 3204 C CB . MET C 3 6 ? -44.149 -21.390 8.935 1.00 32.02 ? 4 MET L CB 1 +ATOM 3205 C CG . MET C 3 6 ? -45.534 -22.037 8.968 1.00 29.55 ? 4 MET L CG 1 +ATOM 3206 S SD . MET C 3 6 ? -46.316 -21.951 10.594 1.00 36.59 ? 4 MET L SD 1 +ATOM 3207 C CE . MET C 3 6 ? -45.166 -22.862 11.604 1.00 38.19 ? 4 MET L CE 1 +ATOM 3208 N N . THR C 3 7 ? -42.142 -18.846 10.224 1.00 28.12 ? 5 THR L N 1 +ATOM 3209 C CA . THR C 3 7 ? -40.800 -18.268 10.169 1.00 27.39 ? 5 THR L CA 1 +ATOM 3210 C C . THR C 3 7 ? -39.853 -19.172 10.941 1.00 29.45 ? 5 THR L C 1 +ATOM 3211 O O . THR C 3 7 ? -40.035 -19.375 12.146 1.00 28.62 ? 5 THR L O 1 +ATOM 3212 C CB . THR C 3 7 ? -40.781 -16.857 10.757 1.00 32.06 ? 5 THR L CB 1 +ATOM 3213 O OG1 . THR C 3 7 ? -41.731 -16.042 10.058 1.00 35.00 ? 5 THR L OG1 1 +ATOM 3214 C CG2 . THR C 3 7 ? -39.381 -16.248 10.639 1.00 34.03 ? 5 THR L CG2 1 +ATOM 3215 N N . GLN C 3 8 ? -38.851 -19.702 10.249 1.00 30.96 ? 6 GLN L N 1 +ATOM 3216 C CA . GLN C 3 8 ? -37.804 -20.504 10.865 1.00 36.59 ? 6 GLN L CA 1 +ATOM 3217 C C . GLN C 3 8 ? -36.590 -19.640 11.155 1.00 34.82 ? 6 GLN L C 1 +ATOM 3218 O O . GLN C 3 8 ? -36.195 -18.812 10.327 1.00 35.95 ? 6 GLN L O 1 +ATOM 3219 C CB . GLN C 3 8 ? -37.369 -21.649 9.949 1.00 34.95 ? 6 GLN L CB 1 +ATOM 3220 C CG . GLN C 3 8 ? -38.138 -22.913 10.126 1.00 34.43 ? 6 GLN L CG 1 +ATOM 3221 C CD . GLN C 3 8 ? -37.580 -24.025 9.280 1.00 28.91 ? 6 GLN L CD 1 +ATOM 3222 O OE1 . GLN C 3 8 ? -38.106 -24.312 8.217 1.00 29.99 ? 6 GLN L OE1 1 +ATOM 3223 N NE2 . GLN C 3 8 ? -36.490 -24.639 9.734 1.00 27.87 ? 6 GLN L NE2 1 +ATOM 3224 N N . SER C 3 9 ? -35.972 -19.878 12.304 1.00 33.55 ? 7 SER L N 1 +ATOM 3225 C CA . SER C 3 9 ? -34.733 -19.214 12.671 1.00 41.75 ? 7 SER L CA 1 +ATOM 3226 C C . SER C 3 9 ? -33.837 -20.207 13.398 1.00 47.01 ? 7 SER L C 1 +ATOM 3227 O O . SER C 3 9 ? -34.330 -21.094 14.106 1.00 41.30 ? 7 SER L O 1 +ATOM 3228 C CB . SER C 3 9 ? -34.982 -17.993 13.566 1.00 40.99 ? 7 SER L CB 1 +ATOM 3229 O OG . SER C 3 9 ? -35.788 -18.349 14.670 1.00 44.73 ? 7 SER L OG 1 +ATOM 3230 N N . PRO C 3 10 ? -32.519 -20.099 13.214 1.00 47.22 ? 8 PRO L N 1 +ATOM 3231 C CA . PRO C 3 10 ? -31.896 -19.184 12.256 1.00 35.38 ? 8 PRO L CA 1 +ATOM 3232 C C . PRO C 3 10 ? -31.863 -19.795 10.871 1.00 33.45 ? 8 PRO L C 1 +ATOM 3233 O O . PRO C 3 10 ? -32.167 -20.980 10.741 1.00 38.19 ? 8 PRO L O 1 +ATOM 3234 C CB . PRO C 3 10 ? -30.484 -19.015 12.814 1.00 40.94 ? 8 PRO L CB 1 +ATOM 3235 C CG . PRO C 3 10 ? -30.207 -20.335 13.466 1.00 43.28 ? 8 PRO L CG 1 +ATOM 3236 C CD . PRO C 3 10 ? -31.520 -20.822 14.024 1.00 44.25 ? 8 PRO L CD 1 +ATOM 3237 N N . SER C 3 11 ? -31.492 -19.023 9.850 1.00 32.98 ? 9 SER L N 1 +ATOM 3238 C CA . SER C 3 11 ? -31.391 -19.601 8.515 1.00 34.10 ? 9 SER L CA 1 +ATOM 3239 C C . SER C 3 11 ? -30.150 -20.464 8.360 1.00 36.40 ? 9 SER L C 1 +ATOM 3240 O O . SER C 3 11 ? -30.171 -21.432 7.597 1.00 27.17 ? 9 SER L O 1 +ATOM 3241 C CB . SER C 3 11 ? -31.398 -18.500 7.456 1.00 40.77 ? 9 SER L CB 1 +ATOM 3242 O OG . SER C 3 11 ? -32.592 -17.744 7.559 1.00 48.11 ? 9 SER L OG 1 +ATOM 3243 N N . PHE C 3 12 ? -29.065 -20.120 9.053 1.00 31.16 ? 10 PHE L N 1 +ATOM 3244 C CA . PHE C 3 12 ? -27.853 -20.919 9.081 1.00 29.95 ? 10 PHE L CA 1 +ATOM 3245 C C . PHE C 3 12 ? -27.416 -21.062 10.527 1.00 29.65 ? 10 PHE L C 1 +ATOM 3246 O O . PHE C 3 12 ? -27.485 -20.104 11.298 1.00 30.84 ? 10 PHE L O 1 +ATOM 3247 C CB . PHE C 3 12 ? -26.714 -20.280 8.262 1.00 36.85 ? 10 PHE L CB 1 +ATOM 3248 C CG . PHE C 3 12 ? -27.052 -20.069 6.819 1.00 38.57 ? 10 PHE L CG 1 +ATOM 3249 C CD1 . PHE C 3 12 ? -27.688 -18.903 6.405 1.00 41.26 ? 10 PHE L CD1 1 +ATOM 3250 C CD2 . PHE C 3 12 ? -26.747 -21.038 5.877 1.00 33.88 ? 10 PHE L CD2 1 +ATOM 3251 C CE1 . PHE C 3 12 ? -28.004 -18.709 5.070 1.00 43.45 ? 10 PHE L CE1 1 +ATOM 3252 C CE2 . PHE C 3 12 ? -27.067 -20.852 4.542 1.00 39.71 ? 10 PHE L CE2 1 +ATOM 3253 C CZ . PHE C 3 12 ? -27.695 -19.684 4.140 1.00 45.48 ? 10 PHE L CZ 1 +ATOM 3254 N N . LEU C 3 13 ? -26.967 -22.259 10.885 1.00 27.55 ? 11 LEU L N 1 +ATOM 3255 C CA . LEU C 3 13 ? -26.533 -22.555 12.240 1.00 34.50 ? 11 LEU L CA 1 +ATOM 3256 C C . LEU C 3 13 ? -25.305 -23.437 12.146 1.00 31.45 ? 11 LEU L C 1 +ATOM 3257 O O . LEU C 3 13 ? -25.297 -24.399 11.375 1.00 34.15 ? 11 LEU L O 1 +ATOM 3258 C CB . LEU C 3 13 ? -27.636 -23.271 13.031 1.00 34.95 ? 11 LEU L CB 1 +ATOM 3259 C CG . LEU C 3 13 ? -27.344 -23.594 14.495 1.00 45.20 ? 11 LEU L CG 1 +ATOM 3260 C CD1 . LEU C 3 13 ? -26.860 -22.355 15.222 1.00 49.86 ? 11 LEU L CD1 1 +ATOM 3261 C CD2 . LEU C 3 13 ? -28.589 -24.178 15.170 1.00 44.37 ? 11 LEU L CD2 1 +ATOM 3262 N N . SER C 3 14 ? -24.271 -23.115 12.917 1.00 28.56 ? 12 SER L N 1 +ATOM 3263 C CA . SER C 3 14 ? -23.071 -23.932 12.961 1.00 29.85 ? 12 SER L CA 1 +ATOM 3264 C C . SER C 3 14 ? -22.980 -24.591 14.329 1.00 31.49 ? 12 SER L C 1 +ATOM 3265 O O . SER C 3 14 ? -23.292 -23.968 15.345 1.00 37.37 ? 12 SER L O 1 +ATOM 3266 C CB . SER C 3 14 ? -21.822 -23.088 12.688 1.00 40.87 ? 12 SER L CB 1 +ATOM 3267 O OG . SER C 3 14 ? -21.611 -22.954 11.289 1.00 40.22 ? 12 SER L OG 1 +ATOM 3268 N N . ALA C 3 15 ? -22.580 -25.854 14.352 1.00 27.67 ? 13 ALA L N 1 +ATOM 3269 C CA . ALA C 3 15 ? -22.465 -26.581 15.606 1.00 27.54 ? 13 ALA L CA 1 +ATOM 3270 C C . ALA C 3 15 ? -21.414 -27.668 15.449 1.00 31.56 ? 13 ALA L C 1 +ATOM 3271 O O . ALA C 3 15 ? -20.950 -27.960 14.343 1.00 27.06 ? 13 ALA L O 1 +ATOM 3272 C CB . ALA C 3 15 ? -23.819 -27.169 16.027 1.00 32.14 ? 13 ALA L CB 1 +ATOM 3273 N N . SER C 3 16 ? -21.037 -28.263 16.575 1.00 33.12 ? 14 SER L N 1 +ATOM 3274 C CA . SER C 3 16 ? -20.036 -29.314 16.617 1.00 31.85 ? 14 SER L CA 1 +ATOM 3275 C C . SER C 3 16 ? -20.692 -30.648 16.941 1.00 34.51 ? 14 SER L C 1 +ATOM 3276 O O . SER C 3 16 ? -21.701 -30.698 17.647 1.00 33.01 ? 14 SER L O 1 +ATOM 3277 C CB . SER C 3 16 ? -18.968 -28.995 17.677 1.00 32.56 ? 14 SER L CB 1 +ATOM 3278 O OG . SER C 3 16 ? -18.249 -27.830 17.304 1.00 38.57 ? 14 SER L OG 1 +ATOM 3279 N N . VAL C 3 17 ? -20.102 -31.732 16.422 1.00 32.46 ? 15 VAL L N 1 +ATOM 3280 C CA . VAL C 3 17 ? -20.482 -33.074 16.852 1.00 32.60 ? 15 VAL L CA 1 +ATOM 3281 C C . VAL C 3 17 ? -20.498 -33.133 18.374 1.00 40.20 ? 15 VAL L C 1 +ATOM 3282 O O . VAL C 3 17 ? -19.553 -32.693 19.037 1.00 34.56 ? 15 VAL L O 1 +ATOM 3283 C CB . VAL C 3 17 ? -19.513 -34.114 16.261 1.00 37.14 ? 15 VAL L CB 1 +ATOM 3284 C CG1 . VAL C 3 17 ? -19.721 -35.479 16.905 1.00 37.38 ? 15 VAL L CG1 1 +ATOM 3285 C CG2 . VAL C 3 17 ? -19.690 -34.193 14.751 1.00 36.72 ? 15 VAL L CG2 1 +ATOM 3286 N N . GLY C 3 18 ? -21.580 -33.667 18.936 1.00 33.90 ? 16 GLY L N 1 +ATOM 3287 C CA . GLY C 3 18 ? -21.755 -33.736 20.366 1.00 43.20 ? 16 GLY L CA 1 +ATOM 3288 C C . GLY C 3 18 ? -22.557 -32.596 20.964 1.00 43.72 ? 16 GLY L C 1 +ATOM 3289 O O . GLY C 3 18 ? -23.013 -32.719 22.106 1.00 42.62 ? 16 GLY L O 1 +ATOM 3290 N N . ASP C 3 19 ? -22.740 -31.499 20.230 1.00 36.15 ? 17 ASP L N 1 +ATOM 3291 C CA . ASP C 3 19 ? -23.493 -30.356 20.733 1.00 39.00 ? 17 ASP L CA 1 +ATOM 3292 C C . ASP C 3 19 ? -24.982 -30.678 20.836 1.00 38.31 ? 17 ASP L C 1 +ATOM 3293 O O . ASP C 3 19 ? -25.514 -31.524 20.111 1.00 37.40 ? 17 ASP L O 1 +ATOM 3294 C CB . ASP C 3 19 ? -23.336 -29.137 19.812 1.00 34.16 ? 17 ASP L CB 1 +ATOM 3295 C CG . ASP C 3 19 ? -21.979 -28.446 19.932 1.00 45.63 ? 17 ASP L CG 1 +ATOM 3296 O OD1 . ASP C 3 19 ? -21.137 -28.865 20.755 1.00 43.25 ? 17 ASP L OD1 1 +ATOM 3297 O OD2 . ASP C 3 19 ? -21.764 -27.459 19.184 1.00 44.30 ? 17 ASP L OD2 1 +ATOM 3298 N N . ARG C 3 20 ? -25.658 -29.966 21.734 1.00 37.35 ? 18 ARG L N 1 +ATOM 3299 C CA . ARG C 3 20 ? -27.115 -29.902 21.745 1.00 39.63 ? 18 ARG L CA 1 +ATOM 3300 C C . ARG C 3 20 ? -27.542 -28.747 20.849 1.00 42.85 ? 18 ARG L C 1 +ATOM 3301 O O . ARG C 3 20 ? -27.070 -27.621 21.017 1.00 46.16 ? 18 ARG L O 1 +ATOM 3302 C CB . ARG C 3 20 ? -27.629 -29.708 23.174 1.00 41.30 ? 18 ARG L CB 1 +ATOM 3303 C CG . ARG C 3 20 ? -29.133 -29.830 23.380 1.00 45.47 ? 18 ARG L CG 1 +ATOM 3304 C CD . ARG C 3 20 ? -29.442 -29.619 24.863 1.00 53.86 ? 18 ARG L CD 1 +ATOM 3305 N NE . ARG C 3 20 ? -30.856 -29.752 25.198 1.00 59.55 ? 18 ARG L NE 1 +ATOM 3306 C CZ . ARG C 3 20 ? -31.753 -28.778 25.065 1.00 61.13 ? 18 ARG L CZ 1 +ATOM 3307 N NH1 . ARG C 3 20 ? -31.383 -27.593 24.596 1.00 56.96 ? 18 ARG L NH1 1 +ATOM 3308 N NH2 . ARG C 3 20 ? -33.021 -28.986 25.403 1.00 56.89 ? 18 ARG L NH2 1 +ATOM 3309 N N . VAL C 3 21 ? -28.403 -29.030 19.878 1.00 27.39 ? 19 VAL L N 1 +ATOM 3310 C CA . VAL C 3 21 ? -28.786 -28.050 18.868 1.00 30.97 ? 19 VAL L CA 1 +ATOM 3311 C C . VAL C 3 21 ? -30.291 -27.818 18.948 1.00 34.36 ? 19 VAL L C 1 +ATOM 3312 O O . VAL C 3 21 ? -31.059 -28.768 19.126 1.00 30.05 ? 19 VAL L O 1 +ATOM 3313 C CB . VAL C 3 21 ? -28.368 -28.528 17.461 1.00 35.11 ? 19 VAL L CB 1 +ATOM 3314 C CG1 . VAL C 3 21 ? -29.055 -27.731 16.373 1.00 37.01 ? 19 VAL L CG1 1 +ATOM 3315 C CG2 . VAL C 3 21 ? -26.865 -28.424 17.314 1.00 45.12 ? 19 VAL L CG2 1 +ATOM 3316 N N . THR C 3 22 ? -30.708 -26.554 18.814 1.00 34.28 ? 20 THR L N 1 +ATOM 3317 C CA . THR C 3 22 ? -32.118 -26.177 18.808 1.00 33.32 ? 20 THR L CA 1 +ATOM 3318 C C . THR C 3 22 ? -32.442 -25.331 17.581 1.00 39.84 ? 20 THR L C 1 +ATOM 3319 O O . THR C 3 22 ? -31.759 -24.341 17.302 1.00 38.23 ? 20 THR L O 1 +ATOM 3320 C CB . THR C 3 22 ? -32.489 -25.410 20.078 1.00 46.71 ? 20 THR L CB 1 +ATOM 3321 O OG1 . THR C 3 22 ? -32.120 -26.185 21.222 1.00 59.57 ? 20 THR L OG1 1 +ATOM 3322 C CG2 . THR C 3 22 ? -33.984 -25.147 20.118 1.00 51.81 ? 20 THR L CG2 1 +ATOM 3323 N N . ILE C 3 23 ? -33.489 -25.726 16.860 1.00 32.20 ? 21 ILE L N 1 +ATOM 3324 C CA . ILE C 3 23 ? -33.987 -25.035 15.675 1.00 30.76 ? 21 ILE L CA 1 +ATOM 3325 C C . ILE C 3 23 ? -35.424 -24.619 15.963 1.00 33.94 ? 21 ILE L C 1 +ATOM 3326 O O . ILE C 3 23 ? -36.183 -25.399 16.539 1.00 31.80 ? 21 ILE L O 1 +ATOM 3327 C CB . ILE C 3 23 ? -33.917 -25.949 14.435 1.00 28.23 ? 21 ILE L CB 1 +ATOM 3328 C CG1 . ILE C 3 23 ? -32.457 -26.255 14.084 1.00 36.60 ? 21 ILE L CG1 1 +ATOM 3329 C CG2 . ILE C 3 23 ? -34.664 -25.334 13.245 1.00 33.27 ? 21 ILE L CG2 1 +ATOM 3330 C CD1 . ILE C 3 23 ? -32.310 -27.439 13.151 1.00 41.64 ? 21 ILE L CD1 1 +ATOM 3331 N N . THR C 3 24 ? -35.800 -23.400 15.571 1.00 28.58 ? 22 THR L N 1 +ATOM 3332 C CA . THR C 3 24 ? -37.077 -22.825 15.983 1.00 28.64 ? 22 THR L CA 1 +ATOM 3333 C C . THR C 3 24 ? -37.936 -22.519 14.759 1.00 28.22 ? 22 THR L C 1 +ATOM 3334 O O . THR C 3 24 ? -37.429 -22.178 13.688 1.00 31.03 ? 22 THR L O 1 +ATOM 3335 C CB . THR C 3 24 ? -36.866 -21.543 16.812 1.00 36.84 ? 22 THR L CB 1 +ATOM 3336 O OG1 . THR C 3 24 ? -36.216 -21.872 18.045 1.00 41.61 ? 22 THR L OG1 1 +ATOM 3337 C CG2 . THR C 3 24 ? -38.197 -20.861 17.135 1.00 40.94 ? 22 THR L CG2 1 +ATOM 3338 N N . CYS C 3 25 ? -39.239 -22.672 14.933 1.00 26.83 ? 23 CYS L N 1 +ATOM 3339 C CA . CYS C 3 25 ? -40.245 -22.348 13.933 1.00 28.93 ? 23 CYS L CA 1 +ATOM 3340 C C . CYS C 3 25 ? -41.318 -21.549 14.666 1.00 32.53 ? 23 CYS L C 1 +ATOM 3341 O O . CYS C 3 25 ? -41.805 -21.993 15.708 1.00 37.19 ? 23 CYS L O 1 +ATOM 3342 C CB . CYS C 3 25 ? -40.788 -23.652 13.304 1.00 38.12 ? 23 CYS L CB 1 +ATOM 3343 S SG . CYS C 3 25 ? -41.959 -23.494 11.913 1.00 50.06 ? 23 CYS L SG 1 +ATOM 3344 N N . ARG C 3 26 ? -41.635 -20.350 14.173 1.00 29.22 ? 24 ARG L N 1 +ATOM 3345 C CA . ARG C 3 26 ? -42.655 -19.500 14.779 1.00 28.29 ? 24 ARG L CA 1 +ATOM 3346 C C . ARG C 3 26 ? -43.828 -19.328 13.822 1.00 28.60 ? 24 ARG L C 1 +ATOM 3347 O O . ARG C 3 26 ? -43.638 -18.968 12.660 1.00 31.81 ? 24 ARG L O 1 +ATOM 3348 C CB . ARG C 3 26 ? -42.090 -18.126 15.149 1.00 37.18 ? 24 ARG L CB 1 +ATOM 3349 C CG . ARG C 3 26 ? -41.543 -18.058 16.568 1.00 56.64 ? 24 ARG L CG 1 +ATOM 3350 C CD . ARG C 3 26 ? -41.033 -16.675 16.917 1.00 66.95 ? 24 ARG L CD 1 +ATOM 3351 N NE . ARG C 3 26 ? -40.050 -16.746 17.993 1.00 77.64 ? 24 ARG L NE 1 +ATOM 3352 C CZ . ARG C 3 26 ? -38.766 -17.036 17.808 1.00 83.49 ? 24 ARG L CZ 1 +ATOM 3353 N NH1 . ARG C 3 26 ? -38.309 -17.278 16.586 1.00 81.33 ? 24 ARG L NH1 1 +ATOM 3354 N NH2 . ARG C 3 26 ? -37.937 -17.084 18.842 1.00 86.18 ? 24 ARG L NH2 1 +ATOM 3355 N N . ALA C 3 27 ? -45.034 -19.556 14.316 1.00 29.76 ? 25 ALA L N 1 +ATOM 3356 C CA . ALA C 3 27 ? -46.236 -19.349 13.516 1.00 30.48 ? 25 ALA L CA 1 +ATOM 3357 C C . ALA C 3 27 ? -46.810 -17.970 13.819 1.00 35.64 ? 25 ALA L C 1 +ATOM 3358 O O . ALA C 3 27 ? -46.836 -17.547 14.978 1.00 37.39 ? 25 ALA L O 1 +ATOM 3359 C CB . ALA C 3 27 ? -47.289 -20.425 13.799 1.00 28.18 ? 25 ALA L CB 1 +ATOM 3360 N N . SER C 3 28 ? -47.289 -17.272 12.778 1.00 34.87 ? 26 SER L N 1 +ATOM 3361 C CA . SER C 3 28 ? -47.800 -15.915 12.986 1.00 44.23 ? 26 SER L CA 1 +ATOM 3362 C C . SER C 3 28 ? -49.082 -15.885 13.814 1.00 43.46 ? 26 SER L C 1 +ATOM 3363 O O . SER C 3 28 ? -49.427 -14.832 14.359 1.00 40.09 ? 26 SER L O 1 +ATOM 3364 C CB . SER C 3 28 ? -48.048 -15.208 11.647 1.00 46.24 ? 26 SER L CB 1 +ATOM 3365 O OG . SER C 3 28 ? -48.841 -15.998 10.781 1.00 38.92 ? 26 SER L OG 1 +ATOM 3366 N N . GLN C 3 29 ? -49.804 -17.000 13.910 1.00 38.16 ? 27 GLN L N 1 +ATOM 3367 C CA . GLN C 3 29 ? -50.957 -17.128 14.796 1.00 34.15 ? 27 GLN L CA 1 +ATOM 3368 C C . GLN C 3 29 ? -50.914 -18.512 15.435 1.00 32.27 ? 27 GLN L C 1 +ATOM 3369 O O . GLN C 3 29 ? -50.193 -19.395 14.976 1.00 32.26 ? 27 GLN L O 1 +ATOM 3370 C CB . GLN C 3 29 ? -52.287 -16.944 14.053 1.00 41.23 ? 27 GLN L CB 1 +ATOM 3371 C CG . GLN C 3 29 ? -52.423 -15.665 13.236 1.00 40.86 ? 27 GLN L CG 1 +ATOM 3372 C CD . GLN C 3 29 ? -53.612 -15.726 12.276 1.00 42.81 ? 27 GLN L CD 1 +ATOM 3373 O OE1 . GLN C 3 29 ? -54.673 -16.263 12.609 1.00 44.48 ? 27 GLN L OE1 1 +ATOM 3374 N NE2 . GLN C 3 29 ? -53.430 -15.190 11.074 1.00 47.84 ? 27 GLN L NE2 1 +ATOM 3375 N N . GLY C 3 30 ? -51.701 -18.707 16.490 1.00 33.28 ? 28 GLY L N 1 +ATOM 3376 C CA . GLY C 3 30 ? -51.718 -19.995 17.169 1.00 36.98 ? 28 GLY L CA 1 +ATOM 3377 C C . GLY C 3 30 ? -52.198 -21.141 16.296 1.00 36.47 ? 28 GLY L C 1 +ATOM 3378 O O . GLY C 3 30 ? -53.268 -21.035 15.690 1.00 33.06 ? 28 GLY L O 1 +ATOM 3379 N N . ILE C 3 31 ? -51.426 -22.234 16.227 1.00 34.14 ? 29 ILE L N 1 +ATOM 3380 C CA . ILE C 3 31 ? -51.791 -23.402 15.426 1.00 32.66 ? 29 ILE L CA 1 +ATOM 3381 C C . ILE C 3 31 ? -51.764 -24.699 16.239 1.00 38.50 ? 29 ILE L C 1 +ATOM 3382 O O . ILE C 3 31 ? -51.693 -25.792 15.665 1.00 44.35 ? 29 ILE L O 1 +ATOM 3383 C CB . ILE C 3 31 ? -50.858 -23.555 14.209 1.00 29.75 ? 29 ILE L CB 1 +ATOM 3384 C CG1 . ILE C 3 31 ? -49.427 -23.881 14.664 1.00 28.85 ? 29 ILE L CG1 1 +ATOM 3385 C CG2 . ILE C 3 31 ? -50.863 -22.307 13.312 1.00 30.99 ? 29 ILE L CG2 1 +ATOM 3386 C CD1 . ILE C 3 31 ? -48.497 -24.231 13.514 1.00 33.73 ? 29 ILE L CD1 1 +ATOM 3387 N N . SER C 3 32 ? -51.791 -24.601 17.569 1.00 32.29 ? 30 SER L N 1 +ATOM 3388 C CA . SER C 3 32 ? -51.831 -25.779 18.458 1.00 44.81 ? 30 SER L CA 1 +ATOM 3389 C C . SER C 3 32 ? -50.621 -26.663 18.178 1.00 44.79 ? 30 SER L C 1 +ATOM 3390 O O . SER C 3 32 ? -49.484 -26.167 18.272 1.00 42.40 ? 30 SER L O 1 +ATOM 3391 C CB . SER C 3 32 ? -53.185 -26.479 18.308 1.00 38.35 ? 30 SER L CB 1 +ATOM 3392 O OG . SER C 3 32 ? -54.114 -26.016 19.273 1.00 53.19 ? 30 SER L OG 1 +ATOM 3393 N N . SER C 3 33 ? -50.790 -27.949 17.840 1.00 38.72 ? 31 SER L N 1 +ATOM 3394 C CA . SER C 3 33 ? -49.669 -28.850 17.580 1.00 35.91 ? 31 SER L CA 1 +ATOM 3395 C C . SER C 3 33 ? -49.656 -29.335 16.134 1.00 36.37 ? 31 SER L C 1 +ATOM 3396 O O . SER C 3 33 ? -49.155 -30.425 15.841 1.00 34.36 ? 31 SER L O 1 +ATOM 3397 C CB . SER C 3 33 ? -49.701 -30.037 18.541 1.00 47.56 ? 31 SER L CB 1 +ATOM 3398 O OG . SER C 3 33 ? -49.272 -29.640 19.834 1.00 56.65 ? 31 SER L OG 1 +ATOM 3399 N N . TYR C 3 34 ? -50.196 -28.522 15.221 1.00 41.47 ? 32 TYR L N 1 +ATOM 3400 C CA . TYR C 3 34 ? -50.290 -28.857 13.799 1.00 42.99 ? 32 TYR L CA 1 +ATOM 3401 C C . TYR C 3 34 ? -48.963 -28.563 13.094 1.00 44.63 ? 32 TYR L C 1 +ATOM 3402 O O . TYR C 3 34 ? -48.841 -27.620 12.302 1.00 43.84 ? 32 TYR L O 1 +ATOM 3403 C CB . TYR C 3 34 ? -51.408 -28.061 13.138 1.00 36.34 ? 32 TYR L CB 1 +ATOM 3404 C CG . TYR C 3 34 ? -52.812 -28.489 13.490 1.00 36.70 ? 32 TYR L CG 1 +ATOM 3405 C CD1 . TYR C 3 34 ? -53.393 -28.127 14.704 1.00 38.83 ? 32 TYR L CD1 1 +ATOM 3406 C CD2 . TYR C 3 34 ? -53.573 -29.229 12.585 1.00 41.26 ? 32 TYR L CD2 1 +ATOM 3407 C CE1 . TYR C 3 34 ? -54.693 -28.510 15.013 1.00 45.49 ? 32 TYR L CE1 1 +ATOM 3408 C CE2 . TYR C 3 34 ? -54.862 -29.622 12.888 1.00 46.78 ? 32 TYR L CE2 1 +ATOM 3409 C CZ . TYR C 3 34 ? -55.420 -29.260 14.099 1.00 54.35 ? 32 TYR L CZ 1 +ATOM 3410 O OH . TYR C 3 34 ? -56.707 -29.649 14.386 1.00 60.77 ? 32 TYR L OH 1 +ATOM 3411 N N . LEU C 3 35 ? -47.957 -29.400 13.371 1.00 34.37 ? 33 LEU L N 1 +ATOM 3412 C CA . LEU C 3 35 ? -46.631 -29.106 12.833 1.00 26.04 ? 33 LEU L CA 1 +ATOM 3413 C C . LEU C 3 35 ? -45.810 -30.375 12.627 1.00 27.71 ? 33 LEU L C 1 +ATOM 3414 O O . LEU C 3 35 ? -45.826 -31.273 13.473 1.00 31.91 ? 33 LEU L O 1 +ATOM 3415 C CB . LEU C 3 35 ? -45.882 -28.151 13.769 1.00 28.51 ? 33 LEU L CB 1 +ATOM 3416 C CG . LEU C 3 35 ? -44.522 -27.788 13.187 1.00 35.55 ? 33 LEU L CG 1 +ATOM 3417 C CD1 . LEU C 3 35 ? -44.588 -26.398 12.630 1.00 39.21 ? 33 LEU L CD1 1 +ATOM 3418 C CD2 . LEU C 3 35 ? -43.435 -27.899 14.230 1.00 40.81 ? 33 LEU L CD2 1 +ATOM 3419 N N . ALA C 3 36 ? -45.054 -30.419 11.518 1.00 27.52 ? 34 ALA L N 1 +ATOM 3420 C CA . ALA C 3 36 ? -44.124 -31.500 11.231 1.00 24.77 ? 34 ALA L CA 1 +ATOM 3421 C C . ALA C 3 36 ? -42.742 -30.927 10.940 1.00 29.20 ? 34 ALA L C 1 +ATOM 3422 O O . ALA C 3 36 ? -42.616 -29.775 10.520 1.00 26.22 ? 34 ALA L O 1 +ATOM 3423 C CB . ALA C 3 36 ? -44.588 -32.352 10.036 1.00 29.23 ? 34 ALA L CB 1 +ATOM 3424 N N . TRP C 3 37 ? -41.708 -31.743 11.173 1.00 25.57 ? 35 TRP L N 1 +ATOM 3425 C CA . TRP C 3 37 ? -40.317 -31.388 10.888 1.00 23.27 ? 35 TRP L CA 1 +ATOM 3426 C C . TRP C 3 37 ? -39.727 -32.386 9.904 1.00 23.14 ? 35 TRP L C 1 +ATOM 3427 O O . TRP C 3 37 ? -39.951 -33.590 10.036 1.00 23.73 ? 35 TRP L O 1 +ATOM 3428 C CB . TRP C 3 37 ? -39.452 -31.396 12.172 1.00 23.42 ? 35 TRP L CB 1 +ATOM 3429 C CG . TRP C 3 37 ? -39.727 -30.288 13.137 1.00 24.37 ? 35 TRP L CG 1 +ATOM 3430 C CD1 . TRP C 3 37 ? -40.524 -30.340 14.237 1.00 27.30 ? 35 TRP L CD1 1 +ATOM 3431 C CD2 . TRP C 3 37 ? -39.192 -28.960 13.090 1.00 23.27 ? 35 TRP L CD2 1 +ATOM 3432 N NE1 . TRP C 3 37 ? -40.519 -29.127 14.889 1.00 24.41 ? 35 TRP L NE1 1 +ATOM 3433 C CE2 . TRP C 3 37 ? -39.711 -28.261 14.197 1.00 26.41 ? 35 TRP L CE2 1 +ATOM 3434 C CE3 . TRP C 3 37 ? -38.327 -28.296 12.218 1.00 23.29 ? 35 TRP L CE3 1 +ATOM 3435 C CZ2 . TRP C 3 37 ? -39.390 -26.927 14.459 1.00 26.19 ? 35 TRP L CZ2 1 +ATOM 3436 C CZ3 . TRP C 3 37 ? -38.003 -26.961 12.482 1.00 28.41 ? 35 TRP L CZ3 1 +ATOM 3437 C CH2 . TRP C 3 37 ? -38.534 -26.299 13.593 1.00 28.19 ? 35 TRP L CH2 1 +ATOM 3438 N N . TYR C 3 38 ? -38.928 -31.889 8.947 1.00 23.62 ? 36 TYR L N 1 +ATOM 3439 C CA . TYR C 3 38 ? -38.263 -32.718 7.951 1.00 24.54 ? 36 TYR L CA 1 +ATOM 3440 C C . TYR C 3 38 ? -36.777 -32.404 7.935 1.00 25.67 ? 36 TYR L C 1 +ATOM 3441 O O . TYR C 3 38 ? -36.374 -31.280 8.225 1.00 21.74 ? 36 TYR L O 1 +ATOM 3442 C CB . TYR C 3 38 ? -38.808 -32.473 6.538 1.00 22.46 ? 36 TYR L CB 1 +ATOM 3443 C CG . TYR C 3 38 ? -40.288 -32.753 6.423 1.00 24.64 ? 36 TYR L CG 1 +ATOM 3444 C CD1 . TYR C 3 38 ? -41.226 -31.786 6.778 1.00 23.59 ? 36 TYR L CD1 1 +ATOM 3445 C CD2 . TYR C 3 38 ? -40.747 -33.998 6.000 1.00 23.59 ? 36 TYR L CD2 1 +ATOM 3446 C CE1 . TYR C 3 38 ? -42.605 -32.053 6.704 1.00 23.64 ? 36 TYR L CE1 1 +ATOM 3447 C CE2 . TYR C 3 38 ? -42.109 -34.274 5.916 1.00 24.18 ? 36 TYR L CE2 1 +ATOM 3448 C CZ . TYR C 3 38 ? -43.034 -33.299 6.269 1.00 30.60 ? 36 TYR L CZ 1 +ATOM 3449 O OH . TYR C 3 38 ? -44.387 -33.569 6.177 1.00 24.88 ? 36 TYR L OH 1 +ATOM 3450 N N . GLN C 3 39 ? -35.983 -33.394 7.530 1.00 22.31 ? 37 GLN L N 1 +ATOM 3451 C CA . GLN C 3 39 ? -34.559 -33.243 7.268 1.00 22.03 ? 37 GLN L CA 1 +ATOM 3452 C C . GLN C 3 39 ? -34.318 -33.461 5.782 1.00 27.60 ? 37 GLN L C 1 +ATOM 3453 O O . GLN C 3 39 ? -34.933 -34.342 5.173 1.00 27.02 ? 37 GLN L O 1 +ATOM 3454 C CB . GLN C 3 39 ? -33.753 -34.271 8.077 1.00 23.91 ? 37 GLN L CB 1 +ATOM 3455 C CG . GLN C 3 39 ? -32.228 -34.230 7.875 1.00 25.70 ? 37 GLN L CG 1 +ATOM 3456 C CD . GLN C 3 39 ? -31.581 -35.486 8.427 1.00 28.10 ? 37 GLN L CD 1 +ATOM 3457 O OE1 . GLN C 3 39 ? -31.742 -36.564 7.867 1.00 31.89 ? 37 GLN L OE1 1 +ATOM 3458 N NE2 . GLN C 3 39 ? -30.892 -35.362 9.562 1.00 26.18 ? 37 GLN L NE2 1 +ATOM 3459 N N . GLN C 3 40 ? -33.423 -32.674 5.189 1.00 24.44 ? 38 GLN L N 1 +ATOM 3460 C CA . GLN C 3 40 ? -33.106 -32.897 3.784 1.00 25.59 ? 38 GLN L CA 1 +ATOM 3461 C C . GLN C 3 40 ? -31.623 -32.674 3.545 1.00 25.76 ? 38 GLN L C 1 +ATOM 3462 O O . GLN C 3 40 ? -31.073 -31.644 3.946 1.00 25.00 ? 38 GLN L O 1 +ATOM 3463 C CB . GLN C 3 40 ? -33.916 -31.976 2.862 1.00 24.71 ? 38 GLN L CB 1 +ATOM 3464 C CG . GLN C 3 40 ? -33.754 -32.328 1.375 1.00 25.49 ? 38 GLN L CG 1 +ATOM 3465 C CD . GLN C 3 40 ? -34.409 -31.314 0.457 1.00 28.81 ? 38 GLN L CD 1 +ATOM 3466 O OE1 . GLN C 3 40 ? -34.486 -30.131 0.785 1.00 27.38 ? 38 GLN L OE1 1 +ATOM 3467 N NE2 . GLN C 3 40 ? -34.874 -31.773 -0.707 1.00 26.29 ? 38 GLN L NE2 1 +ATOM 3468 N N . LYS C 3 41 ? -31.007 -33.607 2.881 1.00 29.07 ? 39 LYS L N 1 +ATOM 3469 C CA . LYS C 3 41 ? -29.616 -33.512 2.466 1.00 30.32 ? 39 LYS L CA 1 +ATOM 3470 C C . LYS C 3 41 ? -29.518 -33.222 0.979 1.00 35.80 ? 39 LYS L C 1 +ATOM 3471 O O . LYS C 3 41 ? -30.445 -33.521 0.215 1.00 30.07 ? 39 LYS L O 1 +ATOM 3472 C CB . LYS C 3 41 ? -28.890 -34.809 2.806 1.00 29.93 ? 39 LYS L CB 1 +ATOM 3473 C CG . LYS C 3 41 ? -28.975 -35.103 4.284 1.00 36.80 ? 39 LYS L CG 1 +ATOM 3474 C CD . LYS C 3 41 ? -28.138 -36.284 4.689 1.00 41.58 ? 39 LYS L CD 1 +ATOM 3475 C CE . LYS C 3 41 ? -28.195 -36.467 6.194 1.00 41.09 ? 39 LYS L CE 1 +ATOM 3476 N NZ . LYS C 3 41 ? -27.426 -37.656 6.641 1.00 42.38 ? 39 LYS L NZ 1 +ATOM 3477 N N . PRO C 3 42 ? -28.410 -32.621 0.538 1.00 37.73 ? 40 PRO L N 1 +ATOM 3478 C CA . PRO C 3 42 ? -28.306 -32.179 -0.860 1.00 40.05 ? 40 PRO L CA 1 +ATOM 3479 C C . PRO C 3 42 ? -28.574 -33.306 -1.845 1.00 34.85 ? 40 PRO L C 1 +ATOM 3480 O O . PRO C 3 42 ? -28.074 -34.424 -1.695 1.00 37.45 ? 40 PRO L O 1 +ATOM 3481 C CB . PRO C 3 42 ? -26.861 -31.672 -0.960 1.00 41.94 ? 40 PRO L CB 1 +ATOM 3482 C CG . PRO C 3 42 ? -26.525 -31.238 0.427 1.00 40.81 ? 40 PRO L CG 1 +ATOM 3483 C CD . PRO C 3 42 ? -27.254 -32.179 1.346 1.00 36.99 ? 40 PRO L CD 1 +ATOM 3484 N N . GLY C 3 43 ? -29.402 -33.013 -2.847 1.00 36.27 ? 41 GLY L N 1 +ATOM 3485 C CA . GLY C 3 43 ? -29.716 -34.001 -3.863 1.00 37.88 ? 41 GLY L CA 1 +ATOM 3486 C C . GLY C 3 43 ? -30.631 -35.126 -3.426 1.00 38.82 ? 41 GLY L C 1 +ATOM 3487 O O . GLY C 3 43 ? -30.842 -36.067 -4.194 1.00 41.81 ? 41 GLY L O 1 +ATOM 3488 N N . LYS C 3 44 ? -31.190 -35.070 -2.225 1.00 34.04 ? 42 LYS L N 1 +ATOM 3489 C CA . LYS C 3 44 ? -32.044 -36.142 -1.736 1.00 29.57 ? 42 LYS L CA 1 +ATOM 3490 C C . LYS C 3 44 ? -33.411 -35.591 -1.357 1.00 30.48 ? 42 LYS L C 1 +ATOM 3491 O O . LYS C 3 44 ? -33.586 -34.386 -1.168 1.00 28.25 ? 42 LYS L O 1 +ATOM 3492 C CB . LYS C 3 44 ? -31.410 -36.860 -0.537 1.00 34.01 ? 42 LYS L CB 1 +ATOM 3493 C CG . LYS C 3 44 ? -29.948 -37.215 -0.748 1.00 46.35 ? 42 LYS L CG 1 +ATOM 3494 C CD . LYS C 3 44 ? -29.786 -38.651 -1.228 1.00 58.53 ? 42 LYS L CD 1 +ATOM 3495 C CE . LYS C 3 44 ? -28.340 -38.927 -1.642 1.00 71.16 ? 42 LYS L CE 1 +ATOM 3496 N NZ . LYS C 3 44 ? -28.220 -40.062 -2.603 1.00 74.19 ? 42 LYS L NZ 1 +ATOM 3497 N N . ALA C 3 45 ? -34.384 -36.497 -1.278 1.00 30.88 ? 43 ALA L N 1 +ATOM 3498 C CA . ALA C 3 45 ? -35.721 -36.127 -0.845 1.00 28.19 ? 43 ALA L CA 1 +ATOM 3499 C C . ALA C 3 45 ? -35.730 -35.818 0.650 1.00 28.39 ? 43 ALA L C 1 +ATOM 3500 O O . ALA C 3 45 ? -34.924 -36.368 1.411 1.00 29.74 ? 43 ALA L O 1 +ATOM 3501 C CB . ALA C 3 45 ? -36.710 -37.252 -1.140 1.00 27.56 ? 43 ALA L CB 1 +ATOM 3502 N N . PRO C 3 46 ? -36.637 -34.942 1.095 1.00 27.05 ? 44 PRO L N 1 +ATOM 3503 C CA . PRO C 3 46 ? -36.822 -34.740 2.535 1.00 27.48 ? 44 PRO L CA 1 +ATOM 3504 C C . PRO C 3 46 ? -37.211 -36.037 3.219 1.00 28.85 ? 44 PRO L C 1 +ATOM 3505 O O . PRO C 3 46 ? -37.792 -36.936 2.608 1.00 28.67 ? 44 PRO L O 1 +ATOM 3506 C CB . PRO C 3 46 ? -37.970 -33.718 2.616 1.00 29.51 ? 44 PRO L CB 1 +ATOM 3507 C CG . PRO C 3 46 ? -38.090 -33.120 1.239 1.00 28.93 ? 44 PRO L CG 1 +ATOM 3508 C CD . PRO C 3 46 ? -37.599 -34.162 0.288 1.00 32.76 ? 44 PRO L CD 1 +ATOM 3509 N N . LYS C 3 47 ? -36.904 -36.113 4.510 1.00 26.13 ? 45 LYS L N 1 +ATOM 3510 C CA . LYS C 3 47 ? -37.294 -37.230 5.358 1.00 27.74 ? 45 LYS L CA 1 +ATOM 3511 C C . LYS C 3 47 ? -38.070 -36.699 6.556 1.00 24.62 ? 45 LYS L C 1 +ATOM 3512 O O . LYS C 3 47 ? -37.637 -35.740 7.203 1.00 23.85 ? 45 LYS L O 1 +ATOM 3513 C CB . LYS C 3 47 ? -36.048 -38.000 5.816 1.00 41.66 ? 45 LYS L CB 1 +ATOM 3514 C CG . LYS C 3 47 ? -36.308 -39.097 6.828 1.00 57.38 ? 45 LYS L CG 1 +ATOM 3515 C CD . LYS C 3 47 ? -35.011 -39.630 7.434 1.00 66.26 ? 45 LYS L CD 1 +ATOM 3516 C CE . LYS C 3 47 ? -33.839 -39.499 6.467 1.00 75.91 ? 45 LYS L CE 1 +ATOM 3517 N NZ . LYS C 3 47 ? -33.818 -40.528 5.386 1.00 80.41 ? 45 LYS L NZ 1 +ATOM 3518 N N . LEU C 3 48 ? -39.204 -37.327 6.861 1.00 24.91 ? 46 LEU L N 1 +ATOM 3519 C CA . LEU C 3 48 ? -40.002 -36.918 8.012 1.00 24.76 ? 46 LEU L CA 1 +ATOM 3520 C C . LEU C 3 48 ? -39.322 -37.307 9.321 1.00 26.80 ? 46 LEU L C 1 +ATOM 3521 O O . LEU C 3 48 ? -38.973 -38.471 9.519 1.00 27.54 ? 46 LEU L O 1 +ATOM 3522 C CB . LEU C 3 48 ? -41.378 -37.580 7.943 1.00 25.46 ? 46 LEU L CB 1 +ATOM 3523 C CG . LEU C 3 48 ? -42.354 -37.300 9.083 1.00 27.36 ? 46 LEU L CG 1 +ATOM 3524 C CD1 . LEU C 3 48 ? -42.805 -35.836 9.089 1.00 28.70 ? 46 LEU L CD1 1 +ATOM 3525 C CD2 . LEU C 3 48 ? -43.541 -38.221 8.927 1.00 28.82 ? 46 LEU L CD2 1 +ATOM 3526 N N . LEU C 3 49 ? -39.171 -36.341 10.231 1.00 24.59 ? 47 LEU L N 1 +ATOM 3527 C CA . LEU C 3 49 ? -38.619 -36.572 11.568 1.00 24.91 ? 47 LEU L CA 1 +ATOM 3528 C C . LEU C 3 49 ? -39.682 -36.600 12.659 1.00 25.40 ? 47 LEU L C 1 +ATOM 3529 O O . LEU C 3 49 ? -39.676 -37.490 13.511 1.00 32.31 ? 47 LEU L O 1 +ATOM 3530 C CB . LEU C 3 49 ? -37.618 -35.468 11.930 1.00 24.37 ? 47 LEU L CB 1 +ATOM 3531 C CG . LEU C 3 49 ? -36.432 -35.250 11.005 1.00 26.35 ? 47 LEU L CG 1 +ATOM 3532 C CD1 . LEU C 3 49 ? -35.715 -33.977 11.449 1.00 29.09 ? 47 LEU L CD1 1 +ATOM 3533 C CD2 . LEU C 3 49 ? -35.522 -36.448 11.119 1.00 32.40 ? 47 LEU L CD2 1 +ATOM 3534 N N . ILE C 3 50 ? -40.548 -35.591 12.682 1.00 27.62 ? 48 ILE L N 1 +ATOM 3535 C CA . ILE C 3 50 ? -41.484 -35.347 13.775 1.00 26.98 ? 48 ILE L CA 1 +ATOM 3536 C C . ILE C 3 50 ? -42.830 -34.991 13.172 1.00 28.08 ? 48 ILE L C 1 +ATOM 3537 O O . ILE C 3 50 ? -42.885 -34.268 12.176 1.00 26.72 ? 48 ILE L O 1 +ATOM 3538 C CB . ILE C 3 50 ? -41.004 -34.186 14.675 1.00 26.64 ? 48 ILE L CB 1 +ATOM 3539 C CG1 . ILE C 3 50 ? -39.627 -34.483 15.269 1.00 30.47 ? 48 ILE L CG1 1 +ATOM 3540 C CG2 . ILE C 3 50 ? -42.032 -33.867 15.764 1.00 28.04 ? 48 ILE L CG2 1 +ATOM 3541 C CD1 . ILE C 3 50 ? -39.649 -35.589 16.292 1.00 33.24 ? 48 ILE L CD1 1 +ATOM 3542 N N . TYR C 3 51 ? -43.919 -35.444 13.798 1.00 27.59 ? 49 TYR L N 1 +ATOM 3543 C CA . TYR C 3 51 ? -45.239 -34.946 13.439 1.00 28.46 ? 49 TYR L CA 1 +ATOM 3544 C C . TYR C 3 51 ? -46.034 -34.687 14.711 1.00 29.60 ? 49 TYR L C 1 +ATOM 3545 O O . TYR C 3 51 ? -45.656 -35.125 15.803 1.00 29.33 ? 49 TYR L O 1 +ATOM 3546 C CB . TYR C 3 51 ? -45.990 -35.906 12.499 1.00 26.96 ? 49 TYR L CB 1 +ATOM 3547 C CG . TYR C 3 51 ? -46.224 -37.288 13.057 1.00 32.75 ? 49 TYR L CG 1 +ATOM 3548 C CD1 . TYR C 3 51 ? -47.335 -37.563 13.854 1.00 35.85 ? 49 TYR L CD1 1 +ATOM 3549 C CD2 . TYR C 3 51 ? -45.350 -38.335 12.761 1.00 32.25 ? 49 TYR L CD2 1 +ATOM 3550 C CE1 . TYR C 3 51 ? -47.553 -38.837 14.362 1.00 36.27 ? 49 TYR L CE1 1 +ATOM 3551 C CE2 . TYR C 3 51 ? -45.559 -39.608 13.266 1.00 33.15 ? 49 TYR L CE2 1 +ATOM 3552 C CZ . TYR C 3 51 ? -46.662 -39.853 14.059 1.00 37.13 ? 49 TYR L CZ 1 +ATOM 3553 O OH . TYR C 3 51 ? -46.874 -41.118 14.554 1.00 41.72 ? 49 TYR L OH 1 +ATOM 3554 N N . ALA C 3 52 ? -47.153 -33.970 14.552 1.00 30.18 ? 50 ALA L N 1 +ATOM 3555 C CA . ALA C 3 52 ? -47.956 -33.496 15.686 1.00 31.14 ? 50 ALA L CA 1 +ATOM 3556 C C . ALA C 3 52 ? -47.072 -32.771 16.705 1.00 34.27 ? 50 ALA L C 1 +ATOM 3557 O O . ALA C 3 52 ? -47.261 -32.885 17.920 1.00 32.03 ? 50 ALA L O 1 +ATOM 3558 C CB . ALA C 3 52 ? -48.729 -34.641 16.337 1.00 33.92 ? 50 ALA L CB 1 +ATOM 3559 N N . ALA C 3 53 ? -46.067 -32.058 16.183 1.00 30.41 ? 51 ALA L N 1 +ATOM 3560 C CA . ALA C 3 53 ? -45.147 -31.182 16.910 1.00 30.58 ? 51 ALA L CA 1 +ATOM 3561 C C . ALA C 3 53 ? -44.132 -31.934 17.766 1.00 31.75 ? 51 ALA L C 1 +ATOM 3562 O O . ALA C 3 53 ? -43.007 -31.458 17.950 1.00 35.59 ? 51 ALA L O 1 +ATOM 3563 C CB . ALA C 3 53 ? -45.910 -30.185 17.792 1.00 30.39 ? 51 ALA L CB 1 +ATOM 3564 N N . SER C 3 54 ? -44.507 -33.083 18.314 1.00 30.90 ? 52 SER L N 1 +ATOM 3565 C CA . SER C 3 54 ? -43.612 -33.746 19.251 1.00 31.97 ? 52 SER L CA 1 +ATOM 3566 C C . SER C 3 54 ? -43.560 -35.256 19.101 1.00 36.18 ? 52 SER L C 1 +ATOM 3567 O O . SER C 3 54 ? -42.853 -35.904 19.881 1.00 35.58 ? 52 SER L O 1 +ATOM 3568 C CB . SER C 3 54 ? -44.004 -33.402 20.701 1.00 32.17 ? 52 SER L CB 1 +ATOM 3569 O OG . SER C 3 54 ? -45.303 -33.892 21.011 1.00 38.16 ? 52 SER L OG 1 +ATOM 3570 N N . THR C 3 55 ? -44.276 -35.843 18.148 1.00 29.77 ? 53 THR L N 1 +ATOM 3571 C CA . THR C 3 55 ? -44.281 -37.292 17.998 1.00 35.45 ? 53 THR L CA 1 +ATOM 3572 C C . THR C 3 55 ? -43.163 -37.701 17.054 1.00 33.34 ? 53 THR L C 1 +ATOM 3573 O O . THR C 3 55 ? -43.127 -37.279 15.890 1.00 29.54 ? 53 THR L O 1 +ATOM 3574 C CB . THR C 3 55 ? -45.627 -37.797 17.489 1.00 41.72 ? 53 THR L CB 1 +ATOM 3575 O OG1 . THR C 3 55 ? -46.661 -37.336 18.363 1.00 36.68 ? 53 THR L OG1 1 +ATOM 3576 C CG2 . THR C 3 55 ? -45.632 -39.322 17.447 1.00 39.37 ? 53 THR L CG2 1 +ATOM 3577 N N . LEU C 3 56 ? -42.251 -38.520 17.562 1.00 32.60 ? 54 LEU L N 1 +ATOM 3578 C CA . LEU C 3 56 ? -41.122 -38.984 16.771 1.00 34.11 ? 54 LEU L CA 1 +ATOM 3579 C C . LEU C 3 56 ? -41.582 -39.987 15.718 1.00 38.60 ? 54 LEU L C 1 +ATOM 3580 O O . LEU C 3 56 ? -42.273 -40.963 16.032 1.00 36.09 ? 54 LEU L O 1 +ATOM 3581 C CB . LEU C 3 56 ? -40.090 -39.618 17.702 1.00 38.89 ? 54 LEU L CB 1 +ATOM 3582 C CG . LEU C 3 56 ? -38.770 -40.094 17.116 1.00 44.52 ? 54 LEU L CG 1 +ATOM 3583 C CD1 . LEU C 3 56 ? -38.082 -38.948 16.397 1.00 40.38 ? 54 LEU L CD1 1 +ATOM 3584 C CD2 . LEU C 3 56 ? -37.890 -40.660 18.233 1.00 47.73 ? 54 LEU L CD2 1 +ATOM 3585 N N . GLN C 3 57 ? -41.197 -39.743 14.468 1.00 34.60 ? 55 GLN L N 1 +ATOM 3586 C CA . GLN C 3 57 ? -41.524 -40.650 13.378 1.00 35.25 ? 55 GLN L CA 1 +ATOM 3587 C C . GLN C 3 57 ? -40.782 -41.971 13.546 1.00 39.05 ? 55 GLN L C 1 +ATOM 3588 O O . GLN C 3 57 ? -39.657 -42.019 14.049 1.00 36.09 ? 55 GLN L O 1 +ATOM 3589 C CB . GLN C 3 57 ? -41.173 -39.996 12.036 1.00 35.47 ? 55 GLN L CB 1 +ATOM 3590 C CG . GLN C 3 57 ? -41.057 -40.927 10.832 1.00 37.55 ? 55 GLN L CG 1 +ATOM 3591 C CD . GLN C 3 57 ? -42.382 -41.558 10.428 1.00 41.45 ? 55 GLN L CD 1 +ATOM 3592 O OE1 . GLN C 3 57 ? -43.432 -41.256 10.994 1.00 38.27 ? 55 GLN L OE1 1 +ATOM 3593 N NE2 . GLN C 3 57 ? -42.335 -42.433 9.431 1.00 40.89 ? 55 GLN L NE2 1 +ATOM 3594 N N . SER C 3 58 ? -41.441 -43.054 13.135 1.00 40.05 ? 56 SER L N 1 +ATOM 3595 C CA . SER C 3 58 ? -40.875 -44.389 13.263 1.00 42.78 ? 56 SER L CA 1 +ATOM 3596 C C . SER C 3 58 ? -39.488 -44.456 12.639 1.00 39.61 ? 56 SER L C 1 +ATOM 3597 O O . SER C 3 58 ? -39.260 -43.936 11.543 1.00 42.11 ? 56 SER L O 1 +ATOM 3598 C CB . SER C 3 58 ? -41.801 -45.405 12.592 1.00 57.51 ? 56 SER L CB 1 +ATOM 3599 O OG . SER C 3 58 ? -43.157 -45.040 12.778 1.00 67.54 ? 56 SER L OG 1 +ATOM 3600 N N . GLY C 3 59 ? -38.552 -45.079 13.356 1.00 40.03 ? 57 GLY L N 1 +ATOM 3601 C CA . GLY C 3 59 ? -37.212 -45.281 12.844 1.00 47.14 ? 57 GLY L CA 1 +ATOM 3602 C C . GLY C 3 59 ? -36.258 -44.116 13.008 1.00 50.65 ? 57 GLY L C 1 +ATOM 3603 O O . GLY C 3 59 ? -35.061 -44.280 12.742 1.00 49.95 ? 57 GLY L O 1 +ATOM 3604 N N . VAL C 3 60 ? -36.734 -42.951 13.429 1.00 43.31 ? 58 VAL L N 1 +ATOM 3605 C CA . VAL C 3 60 ? -35.863 -41.782 13.583 1.00 42.75 ? 58 VAL L CA 1 +ATOM 3606 C C . VAL C 3 60 ? -35.163 -41.865 14.946 1.00 36.94 ? 58 VAL L C 1 +ATOM 3607 O O . VAL C 3 60 ? -35.823 -42.174 15.950 1.00 36.61 ? 58 VAL L O 1 +ATOM 3608 C CB . VAL C 3 60 ? -36.671 -40.491 13.452 1.00 40.18 ? 58 VAL L CB 1 +ATOM 3609 C CG1 . VAL C 3 60 ? -35.803 -39.262 13.726 1.00 37.56 ? 58 VAL L CG1 1 +ATOM 3610 C CG2 . VAL C 3 60 ? -37.305 -40.399 12.063 1.00 32.65 ? 58 VAL L CG2 1 +ATOM 3611 N N . PRO C 3 61 ? -33.856 -41.615 15.011 1.00 37.78 ? 59 PRO L N 1 +ATOM 3612 C CA . PRO C 3 61 ? -33.135 -41.764 16.285 1.00 41.24 ? 59 PRO L CA 1 +ATOM 3613 C C . PRO C 3 61 ? -33.703 -40.884 17.389 1.00 41.10 ? 59 PRO L C 1 +ATOM 3614 O O . PRO C 3 61 ? -34.170 -39.766 17.157 1.00 40.22 ? 59 PRO L O 1 +ATOM 3615 C CB . PRO C 3 61 ? -31.704 -41.343 15.934 1.00 42.26 ? 59 PRO L CB 1 +ATOM 3616 C CG . PRO C 3 61 ? -31.604 -41.486 14.466 1.00 40.72 ? 59 PRO L CG 1 +ATOM 3617 C CD . PRO C 3 61 ? -32.961 -41.244 13.900 1.00 34.47 ? 59 PRO L CD 1 +ATOM 3618 N N . SER C 3 62 ? -33.628 -41.399 18.616 1.00 39.58 ? 60 SER L N 1 +ATOM 3619 C CA . SER C 3 62 ? -34.202 -40.731 19.778 1.00 38.31 ? 60 SER L CA 1 +ATOM 3620 C C . SER C 3 62 ? -33.501 -39.423 20.135 1.00 41.35 ? 60 SER L C 1 +ATOM 3621 O O . SER C 3 62 ? -34.004 -38.696 21.004 1.00 34.78 ? 60 SER L O 1 +ATOM 3622 C CB . SER C 3 62 ? -34.174 -41.684 20.980 1.00 41.31 ? 60 SER L CB 1 +ATOM 3623 O OG . SER C 3 62 ? -32.833 -41.960 21.362 1.00 51.12 ? 60 SER L OG 1 +ATOM 3624 N N . ARG C 3 63 ? -32.366 -39.091 19.504 1.00 38.25 ? 61 ARG L N 1 +ATOM 3625 C CA . ARG C 3 63 ? -31.763 -37.804 19.827 1.00 36.54 ? 61 ARG L CA 1 +ATOM 3626 C C . ARG C 3 63 ? -32.549 -36.638 19.236 1.00 32.17 ? 61 ARG L C 1 +ATOM 3627 O O . ARG C 3 63 ? -32.307 -35.486 19.619 1.00 34.12 ? 61 ARG L O 1 +ATOM 3628 C CB . ARG C 3 63 ? -30.306 -37.756 19.360 1.00 33.81 ? 61 ARG L CB 1 +ATOM 3629 C CG . ARG C 3 63 ? -30.123 -37.908 17.861 1.00 33.25 ? 61 ARG L CG 1 +ATOM 3630 C CD . ARG C 3 63 ? -28.646 -37.761 17.481 1.00 39.55 ? 61 ARG L CD 1 +ATOM 3631 N NE . ARG C 3 63 ? -28.448 -37.962 16.051 1.00 33.20 ? 61 ARG L NE 1 +ATOM 3632 C CZ . ARG C 3 63 ? -28.369 -39.159 15.477 1.00 38.52 ? 61 ARG L CZ 1 +ATOM 3633 N NH1 . ARG C 3 63 ? -28.465 -40.258 16.216 1.00 40.66 ? 61 ARG L NH1 1 +ATOM 3634 N NH2 . ARG C 3 63 ? -28.193 -39.261 14.165 1.00 38.61 ? 61 ARG L NH2 1 +ATOM 3635 N N . PHE C 3 64 ? -33.476 -36.906 18.321 1.00 28.00 ? 62 PHE L N 1 +ATOM 3636 C CA . PHE C 3 64 ? -34.360 -35.877 17.787 1.00 30.10 ? 62 PHE L CA 1 +ATOM 3637 C C . PHE C 3 64 ? -35.609 -35.789 18.650 1.00 34.01 ? 62 PHE L C 1 +ATOM 3638 O O . PHE C 3 64 ? -36.208 -36.815 18.987 1.00 37.66 ? 62 PHE L O 1 +ATOM 3639 C CB . PHE C 3 64 ? -34.766 -36.183 16.346 1.00 27.97 ? 62 PHE L CB 1 +ATOM 3640 C CG . PHE C 3 64 ? -33.647 -36.065 15.360 1.00 31.74 ? 62 PHE L CG 1 +ATOM 3641 C CD1 . PHE C 3 64 ? -33.397 -34.864 14.726 1.00 27.90 ? 62 PHE L CD1 1 +ATOM 3642 C CD2 . PHE C 3 64 ? -32.864 -37.165 15.054 1.00 31.84 ? 62 PHE L CD2 1 +ATOM 3643 C CE1 . PHE C 3 64 ? -32.364 -34.757 13.798 1.00 30.95 ? 62 PHE L CE1 1 +ATOM 3644 C CE2 . PHE C 3 64 ? -31.833 -37.064 14.137 1.00 31.92 ? 62 PHE L CE2 1 +ATOM 3645 C CZ . PHE C 3 64 ? -31.588 -35.854 13.505 1.00 30.54 ? 62 PHE L CZ 1 +ATOM 3646 N N . SER C 3 65 ? -35.996 -34.571 19.010 1.00 31.60 ? 63 SER L N 1 +ATOM 3647 C CA . SER C 3 65 ? -37.244 -34.364 19.730 1.00 33.01 ? 63 SER L CA 1 +ATOM 3648 C C . SER C 3 65 ? -37.857 -33.056 19.262 1.00 38.88 ? 63 SER L C 1 +ATOM 3649 O O . SER C 3 65 ? -37.146 -32.121 18.885 1.00 29.99 ? 63 SER L O 1 +ATOM 3650 C CB . SER C 3 65 ? -37.046 -34.325 21.251 1.00 34.84 ? 63 SER L CB 1 +ATOM 3651 O OG . SER C 3 65 ? -36.205 -33.247 21.622 1.00 39.75 ? 63 SER L OG 1 +ATOM 3652 N N . GLY C 3 66 ? -39.185 -33.006 19.283 1.00 32.69 ? 64 GLY L N 1 +ATOM 3653 C CA . GLY C 3 66 ? -39.912 -31.798 18.958 1.00 33.43 ? 64 GLY L CA 1 +ATOM 3654 C C . GLY C 3 66 ? -40.683 -31.338 20.179 1.00 32.76 ? 64 GLY L C 1 +ATOM 3655 O O . GLY C 3 66 ? -41.101 -32.150 21.008 1.00 29.58 ? 64 GLY L O 1 +ATOM 3656 N N . SER C 3 67 ? -40.851 -30.027 20.296 1.00 28.79 ? 65 SER L N 1 +ATOM 3657 C CA . SER C 3 67 ? -41.641 -29.494 21.398 1.00 32.36 ? 65 SER L CA 1 +ATOM 3658 C C . SER C 3 67 ? -42.305 -28.199 20.953 1.00 33.33 ? 65 SER L C 1 +ATOM 3659 O O . SER C 3 67 ? -41.969 -27.625 19.916 1.00 32.89 ? 65 SER L O 1 +ATOM 3660 C CB . SER C 3 67 ? -40.777 -29.266 22.640 1.00 40.81 ? 65 SER L CB 1 +ATOM 3661 O OG . SER C 3 67 ? -39.821 -28.254 22.378 1.00 48.08 ? 65 SER L OG 1 +ATOM 3662 N N . GLY C 3 68 ? -43.250 -27.738 21.760 1.00 30.98 ? 66 GLY L N 1 +ATOM 3663 C CA . GLY C 3 68 ? -43.930 -26.499 21.454 1.00 35.13 ? 66 GLY L CA 1 +ATOM 3664 C C . GLY C 3 68 ? -45.408 -26.700 21.210 1.00 40.49 ? 66 GLY L C 1 +ATOM 3665 O O . GLY C 3 68 ? -45.849 -27.805 20.883 1.00 40.14 ? 66 GLY L O 1 +ATOM 3666 N N . SER C 3 69 ? -46.179 -25.629 21.381 1.00 34.79 ? 67 SER L N 1 +ATOM 3667 C CA . SER C 3 69 ? -47.604 -25.618 21.079 1.00 41.75 ? 67 SER L CA 1 +ATOM 3668 C C . SER C 3 69 ? -48.076 -24.174 21.041 1.00 49.80 ? 67 SER L C 1 +ATOM 3669 O O . SER C 3 69 ? -47.742 -23.388 21.930 1.00 59.46 ? 67 SER L O 1 +ATOM 3670 C CB . SER C 3 69 ? -48.409 -26.412 22.110 1.00 54.02 ? 67 SER L CB 1 +ATOM 3671 O OG . SER C 3 69 ? -49.577 -26.974 21.522 1.00 59.43 ? 67 SER L OG 1 +ATOM 3672 N N . GLY C 3 70 ? -48.838 -23.812 20.019 1.00 43.14 ? 68 GLY L N 1 +ATOM 3673 C CA . GLY C 3 70 ? -49.287 -22.443 19.887 1.00 40.61 ? 68 GLY L CA 1 +ATOM 3674 C C . GLY C 3 70 ? -48.553 -21.735 18.772 1.00 37.49 ? 68 GLY L C 1 +ATOM 3675 O O . GLY C 3 70 ? -48.857 -21.947 17.598 1.00 36.31 ? 68 GLY L O 1 +ATOM 3676 N N . THR C 3 71 ? -47.567 -20.906 19.111 1.00 30.98 ? 69 THR L N 1 +ATOM 3677 C CA . THR C 3 71 ? -46.857 -20.149 18.093 1.00 33.90 ? 69 THR L CA 1 +ATOM 3678 C C . THR C 3 71 ? -45.364 -20.421 18.043 1.00 37.08 ? 69 THR L C 1 +ATOM 3679 O O . THR C 3 71 ? -44.709 -19.971 17.098 1.00 37.33 ? 69 THR L O 1 +ATOM 3680 C CB . THR C 3 71 ? -47.070 -18.639 18.291 1.00 42.43 ? 69 THR L CB 1 +ATOM 3681 O OG1 . THR C 3 71 ? -46.594 -18.259 19.586 1.00 43.14 ? 69 THR L OG1 1 +ATOM 3682 C CG2 . THR C 3 71 ? -48.547 -18.288 18.172 1.00 40.59 ? 69 THR L CG2 1 +ATOM 3683 N N . GLU C 3 72 ? -44.797 -21.123 19.020 1.00 35.68 ? 70 GLU L N 1 +ATOM 3684 C CA . GLU C 3 72 ? -43.358 -21.350 19.034 1.00 37.02 ? 70 GLU L CA 1 +ATOM 3685 C C . GLU C 3 72 ? -43.086 -22.843 19.130 1.00 33.80 ? 70 GLU L C 1 +ATOM 3686 O O . GLU C 3 72 ? -43.522 -23.494 20.085 1.00 33.02 ? 70 GLU L O 1 +ATOM 3687 C CB . GLU C 3 72 ? -42.689 -20.597 20.189 1.00 45.75 ? 70 GLU L CB 1 +ATOM 3688 C CG . GLU C 3 72 ? -41.392 -19.932 19.756 1.00 67.12 ? 70 GLU L CG 1 +ATOM 3689 C CD . GLU C 3 72 ? -40.416 -19.745 20.893 1.00 84.85 ? 70 GLU L CD 1 +ATOM 3690 O OE1 . GLU C 3 72 ? -40.854 -19.743 22.065 1.00 91.30 ? 70 GLU L OE1 1 +ATOM 3691 O OE2 . GLU C 3 72 ? -39.206 -19.612 20.612 1.00 88.69 ? 70 GLU L OE2 1 +ATOM 3692 N N . PHE C 3 73 ? -42.355 -23.373 18.151 1.00 31.37 ? 71 PHE L N 1 +ATOM 3693 C CA . PHE C 3 73 ? -42.040 -24.789 18.070 1.00 30.85 ? 71 PHE L CA 1 +ATOM 3694 C C . PHE C 3 73 ? -40.532 -24.950 17.948 1.00 34.30 ? 71 PHE L C 1 +ATOM 3695 O O . PHE C 3 73 ? -39.844 -24.097 17.386 1.00 33.86 ? 71 PHE L O 1 +ATOM 3696 C CB . PHE C 3 73 ? -42.753 -25.458 16.877 1.00 28.56 ? 71 PHE L CB 1 +ATOM 3697 C CG . PHE C 3 73 ? -44.240 -25.316 16.924 1.00 32.69 ? 71 PHE L CG 1 +ATOM 3698 C CD1 . PHE C 3 73 ? -44.856 -24.167 16.440 1.00 34.40 ? 71 PHE L CD1 1 +ATOM 3699 C CD2 . PHE C 3 73 ? -45.027 -26.306 17.498 1.00 29.16 ? 71 PHE L CD2 1 +ATOM 3700 C CE1 . PHE C 3 73 ? -46.228 -24.016 16.511 1.00 37.02 ? 71 PHE L CE1 1 +ATOM 3701 C CE2 . PHE C 3 73 ? -46.394 -26.163 17.566 1.00 37.04 ? 71 PHE L CE2 1 +ATOM 3702 C CZ . PHE C 3 73 ? -46.998 -25.006 17.064 1.00 35.63 ? 71 PHE L CZ 1 +ATOM 3703 N N . THR C 3 74 ? -40.013 -26.039 18.502 1.00 31.85 ? 72 THR L N 1 +ATOM 3704 C CA . THR C 3 74 ? -38.579 -26.261 18.471 1.00 32.87 ? 72 THR L CA 1 +ATOM 3705 C C . THR C 3 74 ? -38.278 -27.711 18.137 1.00 27.63 ? 72 THR L C 1 +ATOM 3706 O O . THR C 3 74 ? -38.949 -28.629 18.621 1.00 31.33 ? 72 THR L O 1 +ATOM 3707 C CB . THR C 3 74 ? -37.921 -25.914 19.815 1.00 37.35 ? 72 THR L CB 1 +ATOM 3708 O OG1 . THR C 3 74 ? -38.439 -26.792 20.812 1.00 46.45 ? 72 THR L OG1 1 +ATOM 3709 C CG2 . THR C 3 74 ? -38.231 -24.482 20.225 1.00 34.06 ? 72 THR L CG2 1 +ATOM 3710 N N . LEU C 3 75 ? -37.258 -27.899 17.309 1.00 27.68 ? 73 LEU L N 1 +ATOM 3711 C CA . LEU C 3 75 ? -36.639 -29.193 17.067 1.00 26.84 ? 73 LEU L CA 1 +ATOM 3712 C C . LEU C 3 75 ? -35.308 -29.202 17.798 1.00 26.32 ? 73 LEU L C 1 +ATOM 3713 O O . LEU C 3 75 ? -34.492 -28.294 17.604 1.00 27.93 ? 73 LEU L O 1 +ATOM 3714 C CB . LEU C 3 75 ? -36.425 -29.429 15.569 1.00 28.26 ? 73 LEU L CB 1 +ATOM 3715 C CG . LEU C 3 75 ? -35.746 -30.731 15.132 1.00 28.38 ? 73 LEU L CG 1 +ATOM 3716 C CD1 . LEU C 3 75 ? -36.627 -31.941 15.415 1.00 28.61 ? 73 LEU L CD1 1 +ATOM 3717 C CD2 . LEU C 3 75 ? -35.376 -30.681 13.653 1.00 27.01 ? 73 LEU L CD2 1 +ATOM 3718 N N . THR C 3 76 ? -35.098 -30.201 18.649 1.00 25.94 ? 74 THR L N 1 +ATOM 3719 C CA . THR C 3 76 ? -33.862 -30.324 19.415 1.00 30.28 ? 74 THR L CA 1 +ATOM 3720 C C . THR C 3 76 ? -33.147 -31.608 19.030 1.00 32.69 ? 74 THR L C 1 +ATOM 3721 O O . THR C 3 76 ? -33.756 -32.683 19.021 1.00 32.79 ? 74 THR L O 1 +ATOM 3722 C CB . THR C 3 76 ? -34.135 -30.321 20.925 1.00 33.50 ? 74 THR L CB 1 +ATOM 3723 O OG1 . THR C 3 76 ? -34.798 -29.103 21.291 1.00 35.81 ? 74 THR L OG1 1 +ATOM 3724 C CG2 . THR C 3 76 ? -32.813 -30.450 21.730 1.00 29.24 ? 74 THR L CG2 1 +ATOM 3725 N N . ILE C 3 77 ? -31.857 -31.499 18.727 1.00 31.66 ? 75 ILE L N 1 +ATOM 3726 C CA . ILE C 3 77 ? -30.980 -32.657 18.594 1.00 28.01 ? 75 ILE L CA 1 +ATOM 3727 C C . ILE C 3 77 ? -30.076 -32.673 19.819 1.00 33.99 ? 75 ILE L C 1 +ATOM 3728 O O . ILE C 3 77 ? -29.300 -31.735 20.034 1.00 38.81 ? 75 ILE L O 1 +ATOM 3729 C CB . ILE C 3 77 ? -30.175 -32.604 17.290 1.00 34.33 ? 75 ILE L CB 1 +ATOM 3730 C CG1 . ILE C 3 77 ? -31.126 -32.386 16.118 1.00 35.11 ? 75 ILE L CG1 1 +ATOM 3731 C CG2 . ILE C 3 77 ? -29.355 -33.877 17.127 1.00 37.15 ? 75 ILE L CG2 1 +ATOM 3732 C CD1 . ILE C 3 77 ? -30.451 -31.912 14.840 1.00 42.23 ? 75 ILE L CD1 1 +ATOM 3733 N N . SER C 3 78 ? -30.197 -33.718 20.642 1.00 41.91 ? 76 SER L N 1 +ATOM 3734 C CA . SER C 3 78 ? -29.595 -33.661 21.972 1.00 43.23 ? 76 SER L CA 1 +ATOM 3735 C C . SER C 3 78 ? -28.078 -33.801 21.923 1.00 47.03 ? 76 SER L C 1 +ATOM 3736 O O . SER C 3 78 ? -27.374 -33.202 22.747 1.00 49.17 ? 76 SER L O 1 +ATOM 3737 C CB . SER C 3 78 ? -30.201 -34.733 22.875 1.00 44.19 ? 76 SER L CB 1 +ATOM 3738 O OG . SER C 3 78 ? -29.833 -36.030 22.444 1.00 46.08 ? 76 SER L OG 1 +ATOM 3739 N N . SER C 3 79 ? -27.553 -34.575 20.977 1.00 40.60 ? 77 SER L N 1 +ATOM 3740 C CA . SER C 3 79 ? -26.105 -34.733 20.857 1.00 37.80 ? 77 SER L CA 1 +ATOM 3741 C C . SER C 3 79 ? -25.804 -34.970 19.381 1.00 37.20 ? 77 SER L C 1 +ATOM 3742 O O . SER C 3 79 ? -25.957 -36.088 18.880 1.00 36.78 ? 77 SER L O 1 +ATOM 3743 C CB . SER C 3 79 ? -25.591 -35.870 21.731 1.00 47.12 ? 77 SER L CB 1 +ATOM 3744 O OG . SER C 3 79 ? -24.208 -36.067 21.509 1.00 49.78 ? 77 SER L OG 1 +ATOM 3745 N N . LEU C 3 80 ? -25.373 -33.913 18.700 1.00 35.24 ? 78 LEU L N 1 +ATOM 3746 C CA . LEU C 3 80 ? -25.278 -33.930 17.251 1.00 35.80 ? 78 LEU L CA 1 +ATOM 3747 C C . LEU C 3 80 ? -24.293 -34.989 16.768 1.00 35.49 ? 78 LEU L C 1 +ATOM 3748 O O . LEU C 3 80 ? -23.232 -35.195 17.360 1.00 34.65 ? 78 LEU L O 1 +ATOM 3749 C CB . LEU C 3 80 ? -24.853 -32.548 16.764 1.00 32.28 ? 78 LEU L CB 1 +ATOM 3750 C CG . LEU C 3 80 ? -25.126 -32.190 15.319 1.00 37.19 ? 78 LEU L CG 1 +ATOM 3751 C CD1 . LEU C 3 80 ? -26.626 -32.089 15.096 1.00 37.32 ? 78 LEU L CD1 1 +ATOM 3752 C CD2 . LEU C 3 80 ? -24.445 -30.869 15.026 1.00 37.16 ? 78 LEU L CD2 1 +ATOM 3753 N N . GLN C 3 81 ? -24.645 -35.647 15.672 1.00 33.50 ? 79 GLN L N 1 +ATOM 3754 C CA . GLN C 3 81 ? -23.828 -36.663 15.031 1.00 33.71 ? 79 GLN L CA 1 +ATOM 3755 C C . GLN C 3 81 ? -23.454 -36.199 13.629 1.00 30.03 ? 79 GLN L C 1 +ATOM 3756 O O . GLN C 3 81 ? -24.153 -35.365 13.039 1.00 33.91 ? 79 GLN L O 1 +ATOM 3757 C CB . GLN C 3 81 ? -24.584 -38.000 14.959 1.00 38.09 ? 79 GLN L CB 1 +ATOM 3758 C CG . GLN C 3 81 ? -24.926 -38.599 16.306 1.00 41.99 ? 79 GLN L CG 1 +ATOM 3759 C CD . GLN C 3 81 ? -23.695 -38.911 17.134 1.00 62.38 ? 79 GLN L CD 1 +ATOM 3760 O OE1 . GLN C 3 81 ? -22.720 -39.466 16.628 1.00 65.83 ? 79 GLN L OE1 1 +ATOM 3761 N NE2 . GLN C 3 81 ? -23.732 -38.550 18.412 1.00 70.80 ? 79 GLN L NE2 1 +ATOM 3762 N N . PRO C 3 82 ? -22.363 -36.728 13.054 1.00 36.92 ? 80 PRO L N 1 +ATOM 3763 C CA . PRO C 3 82 ? -21.926 -36.245 11.730 1.00 33.42 ? 80 PRO L CA 1 +ATOM 3764 C C . PRO C 3 82 ? -23.004 -36.335 10.668 1.00 33.42 ? 80 PRO L C 1 +ATOM 3765 O O . PRO C 3 82 ? -23.094 -35.457 9.800 1.00 34.88 ? 80 PRO L O 1 +ATOM 3766 C CB . PRO C 3 82 ? -20.738 -37.159 11.399 1.00 38.42 ? 80 PRO L CB 1 +ATOM 3767 C CG . PRO C 3 82 ? -20.255 -37.643 12.708 1.00 42.92 ? 80 PRO L CG 1 +ATOM 3768 C CD . PRO C 3 82 ? -21.462 -37.766 13.586 1.00 42.01 ? 80 PRO L CD 1 +ATOM 3769 N N . GLU C 3 83 ? -23.843 -37.363 10.721 1.00 33.09 ? 81 GLU L N 1 +ATOM 3770 C CA . GLU C 3 83 ? -24.876 -37.519 9.706 1.00 39.11 ? 81 GLU L CA 1 +ATOM 3771 C C . GLU C 3 83 ? -26.025 -36.527 9.869 1.00 35.06 ? 81 GLU L C 1 +ATOM 3772 O O . GLU C 3 83 ? -26.928 -36.514 9.026 1.00 32.49 ? 81 GLU L O 1 +ATOM 3773 C CB . GLU C 3 83 ? -25.410 -38.959 9.717 1.00 38.70 ? 81 GLU L CB 1 +ATOM 3774 C CG . GLU C 3 83 ? -26.003 -39.426 11.039 1.00 49.60 ? 81 GLU L CG 1 +ATOM 3775 C CD . GLU C 3 83 ? -24.966 -40.001 12.010 1.00 61.44 ? 81 GLU L CD 1 +ATOM 3776 O OE1 . GLU C 3 83 ? -23.777 -39.603 11.961 1.00 52.54 ? 81 GLU L OE1 1 +ATOM 3777 O OE2 . GLU C 3 83 ? -25.355 -40.859 12.832 1.00 66.67 ? 81 GLU L OE2 1 +ATOM 3778 N N . ASP C 3 84 ? -26.002 -35.681 10.905 1.00 30.89 ? 82 ASP L N 1 +ATOM 3779 C CA . ASP C 3 84 ? -27.090 -34.738 11.161 1.00 32.10 ? 82 ASP L CA 1 +ATOM 3780 C C . ASP C 3 84 ? -26.895 -33.377 10.501 1.00 28.53 ? 82 ASP L C 1 +ATOM 3781 O O . ASP C 3 84 ? -27.826 -32.558 10.518 1.00 25.44 ? 82 ASP L O 1 +ATOM 3782 C CB . ASP C 3 84 ? -27.278 -34.523 12.666 1.00 30.77 ? 82 ASP L CB 1 +ATOM 3783 C CG . ASP C 3 84 ? -27.618 -35.803 13.416 1.00 33.65 ? 82 ASP L CG 1 +ATOM 3784 O OD1 . ASP C 3 84 ? -28.148 -36.752 12.806 1.00 30.09 ? 82 ASP L OD1 1 +ATOM 3785 O OD2 . ASP C 3 84 ? -27.365 -35.846 14.640 1.00 32.22 ? 82 ASP L OD2 1 +ATOM 3786 N N . PHE C 3 85 ? -25.727 -33.095 9.927 1.00 26.79 ? 83 PHE L N 1 +ATOM 3787 C CA . PHE C 3 85 ? -25.578 -31.835 9.211 1.00 26.26 ? 83 PHE L CA 1 +ATOM 3788 C C . PHE C 3 85 ? -26.383 -31.927 7.926 1.00 30.25 ? 83 PHE L C 1 +ATOM 3789 O O . PHE C 3 85 ? -26.207 -32.866 7.146 1.00 34.49 ? 83 PHE L O 1 +ATOM 3790 C CB . PHE C 3 85 ? -24.110 -31.537 8.939 1.00 25.59 ? 83 PHE L CB 1 +ATOM 3791 C CG . PHE C 3 85 ? -23.307 -31.370 10.194 1.00 26.45 ? 83 PHE L CG 1 +ATOM 3792 C CD1 . PHE C 3 85 ? -23.355 -30.183 10.907 1.00 28.02 ? 83 PHE L CD1 1 +ATOM 3793 C CD2 . PHE C 3 85 ? -22.550 -32.421 10.690 1.00 30.62 ? 83 PHE L CD2 1 +ATOM 3794 C CE1 . PHE C 3 85 ? -22.636 -30.033 12.080 1.00 29.87 ? 83 PHE L CE1 1 +ATOM 3795 C CE2 . PHE C 3 85 ? -21.823 -32.277 11.863 1.00 37.20 ? 83 PHE L CE2 1 +ATOM 3796 C CZ . PHE C 3 85 ? -21.865 -31.079 12.555 1.00 34.50 ? 83 PHE L CZ 1 +ATOM 3797 N N . ALA C 3 86 ? -27.297 -30.979 7.743 1.00 25.90 ? 84 ALA L N 1 +ATOM 3798 C CA . ALA C 3 86 ? -28.374 -31.075 6.763 1.00 23.63 ? 84 ALA L CA 1 +ATOM 3799 C C . ALA C 3 86 ? -29.225 -29.823 6.870 1.00 23.92 ? 84 ALA L C 1 +ATOM 3800 O O . ALA C 3 86 ? -28.959 -28.960 7.711 1.00 27.04 ? 84 ALA L O 1 +ATOM 3801 C CB . ALA C 3 86 ? -29.247 -32.318 7.016 1.00 24.31 ? 84 ALA L CB 1 +ATOM 3802 N N . THR C 3 87 ? -30.255 -29.712 6.037 1.00 20.90 ? 85 THR L N 1 +ATOM 3803 C CA . THR C 3 87 ? -31.227 -28.644 6.165 1.00 20.04 ? 85 THR L CA 1 +ATOM 3804 C C . THR C 3 87 ? -32.494 -29.211 6.790 1.00 25.03 ? 85 THR L C 1 +ATOM 3805 O O . THR C 3 87 ? -32.863 -30.356 6.520 1.00 25.35 ? 85 THR L O 1 +ATOM 3806 C CB . THR C 3 87 ? -31.525 -28.014 4.800 1.00 25.11 ? 85 THR L CB 1 +ATOM 3807 O OG1 . THR C 3 87 ? -30.301 -27.458 4.283 1.00 26.17 ? 85 THR L OG1 1 +ATOM 3808 C CG2 . THR C 3 87 ? -32.583 -26.906 4.911 1.00 24.99 ? 85 THR L CG2 1 +ATOM 3809 N N . TYR C 3 88 ? -33.128 -28.420 7.649 1.00 21.03 ? 86 TYR L N 1 +ATOM 3810 C CA . TYR C 3 88 ? -34.335 -28.827 8.355 1.00 22.15 ? 86 TYR L CA 1 +ATOM 3811 C C . TYR C 3 88 ? -35.470 -27.862 8.017 1.00 24.65 ? 86 TYR L C 1 +ATOM 3812 O O . TYR C 3 88 ? -35.263 -26.645 7.960 1.00 25.89 ? 86 TYR L O 1 +ATOM 3813 C CB . TYR C 3 88 ? -34.081 -28.864 9.868 1.00 27.65 ? 86 TYR L CB 1 +ATOM 3814 C CG . TYR C 3 88 ? -33.065 -29.927 10.227 1.00 23.13 ? 86 TYR L CG 1 +ATOM 3815 C CD1 . TYR C 3 88 ? -31.695 -29.679 10.116 1.00 24.82 ? 86 TYR L CD1 1 +ATOM 3816 C CD2 . TYR C 3 88 ? -33.474 -31.196 10.627 1.00 22.01 ? 86 TYR L CD2 1 +ATOM 3817 C CE1 . TYR C 3 88 ? -30.758 -30.678 10.419 1.00 23.41 ? 86 TYR L CE1 1 +ATOM 3818 C CE2 . TYR C 3 88 ? -32.557 -32.188 10.922 1.00 27.88 ? 86 TYR L CE2 1 +ATOM 3819 C CZ . TYR C 3 88 ? -31.202 -31.923 10.823 1.00 25.47 ? 86 TYR L CZ 1 +ATOM 3820 O OH . TYR C 3 88 ? -30.312 -32.927 11.116 1.00 25.70 ? 86 TYR L OH 1 +ATOM 3821 N N . TYR C 3 89 ? -36.674 -28.407 7.812 1.00 21.25 ? 87 TYR L N 1 +ATOM 3822 C CA . TYR C 3 89 ? -37.853 -27.625 7.447 1.00 21.17 ? 87 TYR L CA 1 +ATOM 3823 C C . TYR C 3 89 ? -38.991 -27.972 8.396 1.00 23.50 ? 87 TYR L C 1 +ATOM 3824 O O . TYR C 3 89 ? -39.197 -29.144 8.700 1.00 23.30 ? 87 TYR L O 1 +ATOM 3825 C CB . TYR C 3 89 ? -38.339 -27.922 5.997 1.00 21.17 ? 87 TYR L CB 1 +ATOM 3826 C CG . TYR C 3 89 ? -37.389 -27.528 4.902 1.00 23.17 ? 87 TYR L CG 1 +ATOM 3827 C CD1 . TYR C 3 89 ? -37.354 -26.222 4.416 1.00 24.49 ? 87 TYR L CD1 1 +ATOM 3828 C CD2 . TYR C 3 89 ? -36.534 -28.463 4.340 1.00 23.58 ? 87 TYR L CD2 1 +ATOM 3829 C CE1 . TYR C 3 89 ? -36.462 -25.855 3.396 1.00 25.15 ? 87 TYR L CE1 1 +ATOM 3830 C CE2 . TYR C 3 89 ? -35.642 -28.111 3.325 1.00 25.98 ? 87 TYR L CE2 1 +ATOM 3831 C CZ . TYR C 3 89 ? -35.626 -26.808 2.860 1.00 25.75 ? 87 TYR L CZ 1 +ATOM 3832 O OH . TYR C 3 89 ? -34.760 -26.452 1.869 1.00 24.08 ? 87 TYR L OH 1 +ATOM 3833 N N . CYS C 3 90 ? -39.714 -26.963 8.875 1.00 23.07 ? 88 CYS L N 1 +ATOM 3834 C CA . CYS C 3 90 ? -40.986 -27.219 9.537 1.00 22.58 ? 88 CYS L CA 1 +ATOM 3835 C C . CYS C 3 90 ? -42.111 -27.078 8.515 1.00 22.83 ? 88 CYS L C 1 +ATOM 3836 O O . CYS C 3 90 ? -41.951 -26.452 7.465 1.00 24.17 ? 88 CYS L O 1 +ATOM 3837 C CB . CYS C 3 90 ? -41.209 -26.250 10.700 1.00 27.54 ? 88 CYS L CB 1 +ATOM 3838 S SG . CYS C 3 90 ? -41.213 -24.475 10.224 1.00 32.57 ? 88 CYS L SG 1 +ATOM 3839 N N . GLN C 3 91 ? -43.245 -27.686 8.828 1.00 23.41 ? 89 GLN L N 1 +ATOM 3840 C CA . GLN C 3 91 ? -44.389 -27.649 7.929 1.00 23.85 ? 89 GLN L CA 1 +ATOM 3841 C C . GLN C 3 91 ? -45.655 -27.543 8.757 1.00 26.74 ? 89 GLN L C 1 +ATOM 3842 O O . GLN C 3 91 ? -45.858 -28.351 9.666 1.00 27.54 ? 89 GLN L O 1 +ATOM 3843 C CB . GLN C 3 91 ? -44.438 -28.898 7.057 1.00 23.90 ? 89 GLN L CB 1 +ATOM 3844 C CG . GLN C 3 91 ? -45.597 -28.953 6.073 1.00 25.76 ? 89 GLN L CG 1 +ATOM 3845 C CD . GLN C 3 91 ? -45.732 -30.343 5.461 1.00 31.55 ? 89 GLN L CD 1 +ATOM 3846 O OE1 . GLN C 3 91 ? -45.661 -31.356 6.167 1.00 30.84 ? 89 GLN L OE1 1 +ATOM 3847 N NE2 . GLN C 3 91 ? -45.923 -30.397 4.151 1.00 32.74 ? 89 GLN L NE2 1 +ATOM 3848 N N . GLN C 3 92 ? -46.508 -26.567 8.419 1.00 25.30 ? 90 GLN L N 1 +ATOM 3849 C CA . GLN C 3 92 ? -47.792 -26.393 9.096 1.00 30.82 ? 90 GLN L CA 1 +ATOM 3850 C C . GLN C 3 92 ? -48.786 -27.390 8.530 1.00 36.65 ? 90 GLN L C 1 +ATOM 3851 O O . GLN C 3 92 ? -48.945 -27.501 7.309 1.00 34.15 ? 90 GLN L O 1 +ATOM 3852 C CB . GLN C 3 92 ? -48.301 -24.962 8.909 1.00 29.03 ? 90 GLN L CB 1 +ATOM 3853 C CG . GLN C 3 92 ? -49.436 -24.503 9.831 1.00 36.91 ? 90 GLN L CG 1 +ATOM 3854 C CD . GLN C 3 92 ? -50.032 -23.187 9.348 1.00 50.39 ? 90 GLN L CD 1 +ATOM 3855 O OE1 . GLN C 3 92 ? -49.424 -22.482 8.532 1.00 40.51 ? 90 GLN L OE1 1 +ATOM 3856 N NE2 . GLN C 3 92 ? -51.231 -22.863 9.823 1.00 57.22 ? 90 GLN L NE2 1 +ATOM 3857 N N . LEU C 3 93 ? -49.440 -28.129 9.415 1.00 40.09 ? 91 LEU L N 1 +ATOM 3858 C CA . LEU C 3 93 ? -50.367 -29.171 9.015 1.00 44.58 ? 91 LEU L CA 1 +ATOM 3859 C C . LEU C 3 93 ? -51.794 -28.646 9.098 1.00 39.34 ? 91 LEU L C 1 +ATOM 3860 O O . LEU C 3 93 ? -52.138 -27.868 10.000 1.00 43.86 ? 91 LEU L O 1 +ATOM 3861 C CB . LEU C 3 93 ? -50.197 -30.410 9.894 1.00 53.83 ? 91 LEU L CB 1 +ATOM 3862 C CG . LEU C 3 93 ? -48.779 -30.991 9.908 1.00 55.30 ? 91 LEU L CG 1 +ATOM 3863 C CD1 . LEU C 3 93 ? -48.586 -31.911 11.113 1.00 53.06 ? 91 LEU L CD1 1 +ATOM 3864 C CD2 . LEU C 3 93 ? -48.461 -31.716 8.592 1.00 50.87 ? 91 LEU L CD2 1 +ATOM 3865 N N . ASN C 3 94 ? -52.613 -29.074 8.146 1.00 33.06 ? 92 ASN L N 1 +ATOM 3866 C CA . ASN C 3 94 ? -54.004 -28.627 8.027 1.00 38.98 ? 92 ASN L CA 1 +ATOM 3867 C C . ASN C 3 94 ? -54.104 -27.102 8.012 1.00 39.67 ? 92 ASN L C 1 +ATOM 3868 O O . ASN C 3 94 ? -54.981 -26.501 8.635 1.00 40.23 ? 92 ASN L O 1 +ATOM 3869 C CB . ASN C 3 94 ? -54.875 -29.229 9.129 1.00 49.63 ? 92 ASN L CB 1 +ATOM 3870 C CG . ASN C 3 94 ? -56.287 -29.544 8.641 1.00 73.28 ? 92 ASN L CG 1 +ATOM 3871 O OD1 . ASN C 3 94 ? -56.709 -29.071 7.580 1.00 80.53 ? 92 ASN L OD1 1 +ATOM 3872 N ND2 . ASN C 3 94 ? -57.021 -30.349 9.409 1.00 76.81 ? 92 ASN L ND2 1 +ATOM 3873 N N . SER C 3 95 ? -53.210 -26.472 7.266 1.00 37.06 ? 93 SER L N 1 +ATOM 3874 C CA . SER C 3 95 ? -53.172 -25.023 7.145 1.00 35.16 ? 93 SER L CA 1 +ATOM 3875 C C . SER C 3 95 ? -54.022 -24.558 5.968 1.00 38.98 ? 93 SER L C 1 +ATOM 3876 O O . SER C 3 95 ? -54.412 -25.342 5.102 1.00 42.10 ? 93 SER L O 1 +ATOM 3877 C CB . SER C 3 95 ? -51.733 -24.543 6.988 1.00 36.05 ? 93 SER L CB 1 +ATOM 3878 O OG . SER C 3 95 ? -51.156 -25.010 5.787 1.00 36.01 ? 93 SER L OG 1 +ATOM 3879 N N . TYR C 3 96 ? -54.323 -23.262 5.965 1.00 38.56 ? 94 TYR L N 1 +ATOM 3880 C CA . TYR C 3 96 ? -55.131 -22.619 4.928 1.00 40.20 ? 94 TYR L CA 1 +ATOM 3881 C C . TYR C 3 96 ? -54.405 -21.339 4.552 1.00 50.63 ? 94 TYR L C 1 +ATOM 3882 O O . TYR C 3 96 ? -54.501 -20.338 5.284 1.00 52.06 ? 94 TYR L O 1 +ATOM 3883 C CB . TYR C 3 96 ? -56.545 -22.324 5.413 1.00 51.52 ? 94 TYR L CB 1 +ATOM 3884 C CG . TYR C 3 96 ? -57.437 -23.539 5.437 1.00 54.19 ? 94 TYR L CG 1 +ATOM 3885 C CD1 . TYR C 3 96 ? -57.422 -24.416 6.517 1.00 52.50 ? 94 TYR L CD1 1 +ATOM 3886 C CD2 . TYR C 3 96 ? -58.287 -23.820 4.373 1.00 57.76 ? 94 TYR L CD2 1 +ATOM 3887 C CE1 . TYR C 3 96 ? -58.233 -25.536 6.539 1.00 53.58 ? 94 TYR L CE1 1 +ATOM 3888 C CE2 . TYR C 3 96 ? -59.105 -24.939 4.385 1.00 59.62 ? 94 TYR L CE2 1 +ATOM 3889 C CZ . TYR C 3 96 ? -59.073 -25.793 5.471 1.00 59.78 ? 94 TYR L CZ 1 +ATOM 3890 O OH . TYR C 3 96 ? -59.880 -26.906 5.494 1.00 59.24 ? 94 TYR L OH 1 +ATOM 3891 N N . PRO C 3 97 ? -53.649 -21.327 3.437 1.00 50.86 ? 95 PRO L N 1 +ATOM 3892 C CA . PRO C 3 97 ? -53.526 -22.367 2.407 1.00 47.80 ? 95 PRO L CA 1 +ATOM 3893 C C . PRO C 3 97 ? -52.744 -23.608 2.865 1.00 47.64 ? 95 PRO L C 1 +ATOM 3894 O O . PRO C 3 97 ? -51.989 -23.533 3.844 1.00 39.62 ? 95 PRO L O 1 +ATOM 3895 C CB . PRO C 3 97 ? -52.782 -21.636 1.284 1.00 52.23 ? 95 PRO L CB 1 +ATOM 3896 C CG . PRO C 3 97 ? -51.900 -20.685 2.007 1.00 53.93 ? 95 PRO L CG 1 +ATOM 3897 C CD . PRO C 3 97 ? -52.667 -20.245 3.235 1.00 52.69 ? 95 PRO L CD 1 +ATOM 3898 N N . PRO C 3 98 ? -52.923 -24.726 2.161 1.00 43.91 ? 96 PRO L N 1 +ATOM 3899 C CA . PRO C 3 98 ? -52.400 -26.004 2.659 1.00 38.61 ? 96 PRO L CA 1 +ATOM 3900 C C . PRO C 3 98 ? -50.880 -26.092 2.630 1.00 28.50 ? 96 PRO L C 1 +ATOM 3901 O O . PRO C 3 98 ? -50.206 -25.475 1.798 1.00 35.28 ? 96 PRO L O 1 +ATOM 3902 C CB . PRO C 3 98 ? -53.021 -27.030 1.703 1.00 39.78 ? 96 PRO L CB 1 +ATOM 3903 C CG . PRO C 3 98 ? -54.202 -26.344 1.105 1.00 39.28 ? 96 PRO L CG 1 +ATOM 3904 C CD . PRO C 3 98 ? -53.789 -24.915 0.984 1.00 40.67 ? 96 PRO L CD 1 +ATOM 3905 N N . TYR C 3 99 ? -50.355 -26.876 3.579 1.00 30.92 ? 97 TYR L N 1 +ATOM 3906 C CA . TYR C 3 99 ? -48.970 -27.359 3.596 1.00 33.42 ? 97 TYR L CA 1 +ATOM 3907 C C . TYR C 3 99 ? -47.938 -26.234 3.483 1.00 36.73 ? 97 TYR L C 1 +ATOM 3908 O O . TYR C 3 99 ? -46.966 -26.324 2.732 1.00 31.96 ? 97 TYR L O 1 +ATOM 3909 C CB . TYR C 3 99 ? -48.745 -28.405 2.495 1.00 35.28 ? 97 TYR L CB 1 +ATOM 3910 C CG . TYR C 3 99 ? -49.800 -29.483 2.467 1.00 35.29 ? 97 TYR L CG 1 +ATOM 3911 C CD1 . TYR C 3 99 ? -49.775 -30.536 3.373 1.00 45.29 ? 97 TYR L CD1 1 +ATOM 3912 C CD2 . TYR C 3 99 ? -50.823 -29.442 1.543 1.00 40.95 ? 97 TYR L CD2 1 +ATOM 3913 C CE1 . TYR C 3 99 ? -50.757 -31.520 3.355 1.00 49.56 ? 97 TYR L CE1 1 +ATOM 3914 C CE2 . TYR C 3 99 ? -51.811 -30.408 1.516 1.00 51.93 ? 97 TYR L CE2 1 +ATOM 3915 C CZ . TYR C 3 99 ? -51.772 -31.451 2.418 1.00 56.10 ? 97 TYR L CZ 1 +ATOM 3916 O OH . TYR C 3 99 ? -52.764 -32.415 2.382 1.00 56.13 ? 97 TYR L OH 1 +ATOM 3917 N N . THR C 3 100 ? -48.124 -25.181 4.273 1.00 29.45 ? 98 THR L N 1 +ATOM 3918 C CA . THR C 3 100 ? -47.118 -24.123 4.345 1.00 28.64 ? 98 THR L CA 1 +ATOM 3919 C C . THR C 3 100 ? -45.833 -24.649 4.992 1.00 24.60 ? 98 THR L C 1 +ATOM 3920 O O . THR C 3 100 ? -45.878 -25.287 6.043 1.00 26.89 ? 98 THR L O 1 +ATOM 3921 C CB . THR C 3 100 ? -47.656 -22.930 5.143 1.00 37.31 ? 98 THR L CB 1 +ATOM 3922 O OG1 . THR C 3 100 ? -48.908 -22.496 4.599 1.00 34.13 ? 98 THR L OG1 1 +ATOM 3923 C CG2 . THR C 3 100 ? -46.673 -21.777 5.107 1.00 35.89 ? 98 THR L CG2 1 +ATOM 3924 N N . PHE C 3 101 ? -44.690 -24.397 4.356 1.00 26.35 ? 99 PHE L N 1 +ATOM 3925 C CA . PHE C 3 101 ? -43.382 -24.770 4.882 1.00 26.43 ? 99 PHE L CA 1 +ATOM 3926 C C . PHE C 3 101 ? -42.659 -23.560 5.456 1.00 26.77 ? 99 PHE L C 1 +ATOM 3927 O O . PHE C 3 101 ? -42.768 -22.450 4.932 1.00 27.03 ? 99 PHE L O 1 +ATOM 3928 C CB . PHE C 3 101 ? -42.480 -25.348 3.787 1.00 22.66 ? 99 PHE L CB 1 +ATOM 3929 C CG . PHE C 3 101 ? -42.794 -26.752 3.391 1.00 24.18 ? 99 PHE L CG 1 +ATOM 3930 C CD1 . PHE C 3 101 ? -42.273 -27.824 4.103 1.00 24.79 ? 99 PHE L CD1 1 +ATOM 3931 C CD2 . PHE C 3 101 ? -43.577 -27.005 2.265 1.00 25.91 ? 99 PHE L CD2 1 +ATOM 3932 C CE1 . PHE C 3 101 ? -42.547 -29.133 3.718 1.00 26.57 ? 99 PHE L CE1 1 +ATOM 3933 C CE2 . PHE C 3 101 ? -43.864 -28.305 1.881 1.00 30.07 ? 99 PHE L CE2 1 +ATOM 3934 C CZ . PHE C 3 101 ? -43.337 -29.373 2.601 1.00 29.06 ? 99 PHE L CZ 1 +ATOM 3935 N N . GLY C 3 102 ? -41.849 -23.795 6.493 1.00 23.63 ? 100 GLY L N 1 +ATOM 3936 C CA . GLY C 3 102 ? -40.836 -22.827 6.844 1.00 22.66 ? 100 GLY L CA 1 +ATOM 3937 C C . GLY C 3 102 ? -39.749 -22.757 5.777 1.00 28.23 ? 100 GLY L C 1 +ATOM 3938 O O . GLY C 3 102 ? -39.615 -23.628 4.918 1.00 26.34 ? 100 GLY L O 1 +ATOM 3939 N N . GLN C 3 103 ? -38.945 -21.702 5.822 1.00 22.24 ? 101 GLN L N 1 +ATOM 3940 C CA . GLN C 3 103 ? -37.938 -21.521 4.773 1.00 25.27 ? 101 GLN L CA 1 +ATOM 3941 C C . GLN C 3 103 ? -36.655 -22.308 5.012 1.00 29.43 ? 101 GLN L C 1 +ATOM 3942 O O . GLN C 3 103 ? -35.752 -22.264 4.163 1.00 27.17 ? 101 GLN L O 1 +ATOM 3943 C CB . GLN C 3 103 ? -37.626 -20.032 4.597 1.00 40.57 ? 101 GLN L CB 1 +ATOM 3944 C CG . GLN C 3 103 ? -38.889 -19.164 4.447 1.00 64.97 ? 101 GLN L CG 1 +ATOM 3945 C CD . GLN C 3 103 ? -39.633 -18.924 5.769 1.00 82.24 ? 101 GLN L CD 1 +ATOM 3946 O OE1 . GLN C 3 103 ? -39.111 -19.207 6.857 1.00 76.29 ? 101 GLN L OE1 1 +ATOM 3947 N NE2 . GLN C 3 103 ? -40.875 -18.445 5.672 1.00 83.30 ? 101 GLN L NE2 1 +ATOM 3948 N N . GLY C 3 104 ? -36.538 -23.013 6.121 1.00 25.89 ? 102 GLY L N 1 +ATOM 3949 C CA . GLY C 3 104 ? -35.443 -23.951 6.267 1.00 23.29 ? 102 GLY L CA 1 +ATOM 3950 C C . GLY C 3 104 ? -34.321 -23.403 7.125 1.00 27.28 ? 102 GLY L C 1 +ATOM 3951 O O . GLY C 3 104 ? -34.052 -22.198 7.155 1.00 25.60 ? 102 GLY L O 1 +ATOM 3952 N N . THR C 3 105 ? -33.652 -24.306 7.840 1.00 24.52 ? 103 THR L N 1 +ATOM 3953 C CA . THR C 3 105 ? -32.459 -23.988 8.626 1.00 23.22 ? 103 THR L CA 1 +ATOM 3954 C C . THR C 3 105 ? -31.365 -24.942 8.185 1.00 24.77 ? 103 THR L C 1 +ATOM 3955 O O . THR C 3 105 ? -31.539 -26.160 8.262 1.00 27.11 ? 103 THR L O 1 +ATOM 3956 C CB . THR C 3 105 ? -32.710 -24.152 10.130 1.00 29.13 ? 103 THR L CB 1 +ATOM 3957 O OG1 . THR C 3 105 ? -33.671 -23.188 10.579 1.00 27.25 ? 103 THR L OG1 1 +ATOM 3958 C CG2 . THR C 3 105 ? -31.399 -23.995 10.909 1.00 32.97 ? 103 THR L CG2 1 +ATOM 3959 N N . LYS C 3 106 ? -30.242 -24.405 7.732 1.00 24.76 ? 104 LYS L N 1 +ATOM 3960 C CA . LYS C 3 106 ? -29.124 -25.232 7.308 1.00 21.74 ? 104 LYS L CA 1 +ATOM 3961 C C . LYS C 3 106 ? -28.138 -25.356 8.467 1.00 24.48 ? 104 LYS L C 1 +ATOM 3962 O O . LYS C 3 106 ? -27.612 -24.350 8.956 1.00 28.99 ? 104 LYS L O 1 +ATOM 3963 C CB . LYS C 3 106 ? -28.430 -24.651 6.079 1.00 26.83 ? 104 LYS L CB 1 +ATOM 3964 C CG . LYS C 3 106 ? -27.384 -25.597 5.513 1.00 31.52 ? 104 LYS L CG 1 +ATOM 3965 C CD . LYS C 3 106 ? -26.830 -25.071 4.200 1.00 42.32 ? 104 LYS L CD 1 +ATOM 3966 C CE . LYS C 3 106 ? -25.987 -26.120 3.501 1.00 46.45 ? 104 LYS L CE 1 +ATOM 3967 N NZ . LYS C 3 106 ? -25.446 -25.600 2.220 1.00 53.29 ? 104 LYS L NZ 1 +ATOM 3968 N N . LEU C 3 107 ? -27.901 -26.584 8.903 1.00 25.90 ? 105 LEU L N 1 +ATOM 3969 C CA . LEU C 3 107 ? -27.009 -26.881 10.018 1.00 26.53 ? 105 LEU L CA 1 +ATOM 3970 C C . LEU C 3 107 ? -25.640 -27.256 9.453 1.00 28.48 ? 105 LEU L C 1 +ATOM 3971 O O . LEU C 3 107 ? -25.524 -28.225 8.701 1.00 27.71 ? 105 LEU L O 1 +ATOM 3972 C CB . LEU C 3 107 ? -27.594 -28.019 10.852 1.00 26.89 ? 105 LEU L CB 1 +ATOM 3973 C CG . LEU C 3 107 ? -26.835 -28.512 12.074 1.00 32.81 ? 105 LEU L CG 1 +ATOM 3974 C CD1 . LEU C 3 107 ? -26.610 -27.372 13.043 1.00 40.19 ? 105 LEU L CD1 1 +ATOM 3975 C CD2 . LEU C 3 107 ? -27.620 -29.639 12.719 1.00 32.93 ? 105 LEU L CD2 1 +ATOM 3976 N N . GLU C 3 108 ? -24.612 -26.500 9.824 1.00 25.96 ? 106 GLU L N 1 +ATOM 3977 C CA . GLU C 3 108 ? -23.274 -26.658 9.266 1.00 27.57 ? 106 GLU L CA 1 +ATOM 3978 C C . GLU C 3 108 ? -22.255 -26.890 10.375 1.00 26.84 ? 106 GLU L C 1 +ATOM 3979 O O . GLU C 3 108 ? -22.556 -26.768 11.562 1.00 27.74 ? 106 GLU L O 1 +ATOM 3980 C CB . GLU C 3 108 ? -22.903 -25.431 8.427 1.00 29.46 ? 106 GLU L CB 1 +ATOM 3981 C CG . GLU C 3 108 ? -23.864 -25.248 7.244 1.00 40.73 ? 106 GLU L CG 1 +ATOM 3982 C CD . GLU C 3 108 ? -23.477 -24.117 6.302 1.00 45.03 ? 106 GLU L CD 1 +ATOM 3983 O OE1 . GLU C 3 108 ? -23.616 -22.938 6.693 1.00 47.15 ? 106 GLU L OE1 1 +ATOM 3984 O OE2 . GLU C 3 108 ? -23.060 -24.413 5.162 1.00 49.73 ? 106 GLU L OE2 1 +ATOM 3985 N N . ILE C 3 109 ? -21.034 -27.237 9.972 1.00 26.05 ? 107 ILE L N 1 +ATOM 3986 C CA . ILE C 3 109 ? -19.977 -27.618 10.910 1.00 23.95 ? 107 ILE L CA 1 +ATOM 3987 C C . ILE C 3 109 ? -19.251 -26.373 11.401 1.00 28.28 ? 107 ILE L C 1 +ATOM 3988 O O . ILE C 3 109 ? -18.751 -25.576 10.598 1.00 29.66 ? 107 ILE L O 1 +ATOM 3989 C CB . ILE C 3 109 ? -18.990 -28.598 10.255 1.00 31.09 ? 107 ILE L CB 1 +ATOM 3990 C CG1 . ILE C 3 109 ? -19.718 -29.860 9.788 1.00 37.00 ? 107 ILE L CG1 1 +ATOM 3991 C CG2 . ILE C 3 109 ? -17.852 -28.944 11.230 1.00 35.16 ? 107 ILE L CG2 1 +ATOM 3992 C CD1 . ILE C 3 109 ? -18.943 -30.690 8.786 1.00 42.74 ? 107 ILE L CD1 1 +ATOM 3993 N N . LYS C 3 110 ? -19.164 -26.222 12.725 1.00 30.58 ? 108 LYS L N 1 +ATOM 3994 C CA . LYS C 3 110 ? -18.450 -25.105 13.322 1.00 29.97 ? 108 LYS L CA 1 +ATOM 3995 C C . LYS C 3 110 ? -16.945 -25.345 13.246 1.00 28.88 ? 108 LYS L C 1 +ATOM 3996 O O . LYS C 3 110 ? -16.472 -26.473 13.401 1.00 28.96 ? 108 LYS L O 1 +ATOM 3997 C CB . LYS C 3 110 ? -18.873 -24.917 14.782 1.00 30.17 ? 108 LYS L CB 1 +ATOM 3998 C CG . LYS C 3 110 ? -18.147 -23.783 15.503 1.00 36.45 ? 108 LYS L CG 1 +ATOM 3999 C CD . LYS C 3 110 ? -18.755 -23.496 16.868 1.00 54.83 ? 108 LYS L CD 1 +ATOM 4000 C CE . LYS C 3 110 ? -18.077 -24.309 17.964 1.00 77.59 ? 108 LYS L CE 1 +ATOM 4001 N NZ . LYS C 3 110 ? -17.780 -23.486 19.176 1.00 85.82 ? 108 LYS L NZ 1 +ATOM 4002 N N . ARG C 3 111 ? -16.197 -24.277 12.994 1.00 31.42 ? 109 ARG L N 1 +ATOM 4003 C CA . ARG C 3 111 ? -14.740 -24.303 13.109 1.00 33.86 ? 109 ARG L CA 1 +ATOM 4004 C C . ARG C 3 111 ? -14.280 -22.898 13.459 1.00 33.31 ? 109 ARG L C 1 +ATOM 4005 O O . ARG C 3 111 ? -15.087 -21.975 13.559 1.00 31.40 ? 109 ARG L O 1 +ATOM 4006 C CB . ARG C 3 111 ? -14.079 -24.800 11.818 1.00 31.78 ? 109 ARG L CB 1 +ATOM 4007 C CG . ARG C 3 111 ? -14.455 -23.993 10.583 1.00 27.40 ? 109 ARG L CG 1 +ATOM 4008 C CD . ARG C 3 111 ? -13.313 -23.979 9.551 1.00 31.71 ? 109 ARG L CD 1 +ATOM 4009 N NE . ARG C 3 111 ? -12.179 -23.214 10.053 1.00 34.54 ? 109 ARG L NE 1 +ATOM 4010 C CZ . ARG C 3 111 ? -10.906 -23.476 9.778 1.00 33.67 ? 109 ARG L CZ 1 +ATOM 4011 N NH1 . ARG C 3 111 ? -10.578 -24.506 9.000 1.00 28.59 ? 109 ARG L NH1 1 +ATOM 4012 N NH2 . ARG C 3 111 ? -9.960 -22.712 10.303 1.00 30.25 ? 109 ARG L NH2 1 +ATOM 4013 N N . THR C 3 112 ? -12.971 -22.728 13.634 1.00 29.73 ? 110 THR L N 1 +ATOM 4014 C CA . THR C 3 112 ? -12.478 -21.399 13.961 1.00 29.88 ? 110 THR L CA 1 +ATOM 4015 C C . THR C 3 112 ? -12.501 -20.486 12.733 1.00 31.52 ? 110 THR L C 1 +ATOM 4016 O O . THR C 3 112 ? -12.528 -20.932 11.579 1.00 28.59 ? 110 THR L O 1 +ATOM 4017 C CB . THR C 3 112 ? -11.067 -21.479 14.535 1.00 37.34 ? 110 THR L CB 1 +ATOM 4018 O OG1 . THR C 3 112 ? -10.225 -22.153 13.600 1.00 38.89 ? 110 THR L OG1 1 +ATOM 4019 C CG2 . THR C 3 112 ? -11.078 -22.250 15.835 1.00 40.24 ? 110 THR L CG2 1 +ATOM 4020 N N . VAL C 3 113 ? -12.516 -19.178 13.007 1.00 32.61 ? 111 VAL L N 1 +ATOM 4021 C CA . VAL C 3 113 ? -12.583 -18.175 11.949 1.00 30.42 ? 111 VAL L CA 1 +ATOM 4022 C C . VAL C 3 113 ? -11.341 -18.283 11.076 1.00 29.91 ? 111 VAL L C 1 +ATOM 4023 O O . VAL C 3 113 ? -10.236 -18.500 11.579 1.00 29.42 ? 111 VAL L O 1 +ATOM 4024 C CB . VAL C 3 113 ? -12.712 -16.774 12.574 1.00 35.82 ? 111 VAL L CB 1 +ATOM 4025 C CG1 . VAL C 3 113 ? -12.568 -15.688 11.532 1.00 32.41 ? 111 VAL L CG1 1 +ATOM 4026 C CG2 . VAL C 3 113 ? -14.047 -16.636 13.308 1.00 38.42 ? 111 VAL L CG2 1 +ATOM 4027 N N . ALA C 3 114 ? -11.525 -18.156 9.763 1.00 31.13 ? 112 ALA L N 1 +ATOM 4028 C CA . ALA C 3 114 ? -10.425 -18.209 8.798 1.00 31.85 ? 112 ALA L CA 1 +ATOM 4029 C C . ALA C 3 114 ? -10.659 -17.156 7.726 1.00 28.24 ? 112 ALA L C 1 +ATOM 4030 O O . ALA C 3 114 ? -11.684 -17.193 7.043 1.00 29.36 ? 112 ALA L O 1 +ATOM 4031 C CB . ALA C 3 114 ? -10.314 -19.599 8.154 1.00 31.73 ? 112 ALA L CB 1 +ATOM 4032 N N . ALA C 3 115 ? -9.712 -16.230 7.568 1.00 30.70 ? 113 ALA L N 1 +ATOM 4033 C CA . ALA C 3 115 ? -9.867 -15.172 6.581 1.00 30.88 ? 113 ALA L CA 1 +ATOM 4034 C C . ALA C 3 115 ? -9.687 -15.712 5.158 1.00 27.73 ? 113 ALA L C 1 +ATOM 4035 O O . ALA C 3 115 ? -8.868 -16.604 4.918 1.00 31.08 ? 113 ALA L O 1 +ATOM 4036 C CB . ALA C 3 115 ? -8.850 -14.059 6.836 1.00 35.56 ? 113 ALA L CB 1 +ATOM 4037 N N . PRO C 3 116 ? -10.416 -15.164 4.189 1.00 31.47 ? 114 PRO L N 1 +ATOM 4038 C CA . PRO C 3 116 ? -10.224 -15.595 2.802 1.00 28.43 ? 114 PRO L CA 1 +ATOM 4039 C C . PRO C 3 116 ? -8.928 -15.050 2.227 1.00 31.28 ? 114 PRO L C 1 +ATOM 4040 O O . PRO C 3 116 ? -8.475 -13.962 2.588 1.00 27.90 ? 114 PRO L O 1 +ATOM 4041 C CB . PRO C 3 116 ? -11.433 -14.993 2.079 1.00 29.42 ? 114 PRO L CB 1 +ATOM 4042 C CG . PRO C 3 116 ? -11.707 -13.740 2.833 1.00 30.56 ? 114 PRO L CG 1 +ATOM 4043 C CD . PRO C 3 116 ? -11.396 -14.066 4.287 1.00 31.30 ? 114 PRO L CD 1 +ATOM 4044 N N . SER C 3 117 ? -8.322 -15.837 1.342 1.00 29.50 ? 115 SER L N 1 +ATOM 4045 C CA . SER C 3 117 ? -7.357 -15.318 0.385 1.00 28.71 ? 115 SER L CA 1 +ATOM 4046 C C . SER C 3 117 ? -8.134 -14.830 -0.825 1.00 29.38 ? 115 SER L C 1 +ATOM 4047 O O . SER C 3 117 ? -9.016 -15.534 -1.318 1.00 28.74 ? 115 SER L O 1 +ATOM 4048 C CB . SER C 3 117 ? -6.355 -16.390 -0.014 1.00 34.98 ? 115 SER L CB 1 +ATOM 4049 O OG . SER C 3 117 ? -5.576 -16.715 1.114 1.00 44.75 ? 115 SER L OG 1 +ATOM 4050 N N . VAL C 3 118 ? -7.827 -13.621 -1.277 1.00 24.79 ? 116 VAL L N 1 +ATOM 4051 C CA . VAL C 3 118 ? -8.613 -12.944 -2.300 1.00 22.77 ? 116 VAL L CA 1 +ATOM 4052 C C . VAL C 3 118 ? -7.773 -12.816 -3.561 1.00 25.04 ? 116 VAL L C 1 +ATOM 4053 O O . VAL C 3 118 ? -6.582 -12.481 -3.488 1.00 24.38 ? 116 VAL L O 1 +ATOM 4054 C CB . VAL C 3 118 ? -9.075 -11.562 -1.801 1.00 30.18 ? 116 VAL L CB 1 +ATOM 4055 C CG1 . VAL C 3 118 ? -9.901 -10.866 -2.870 1.00 26.92 ? 116 VAL L CG1 1 +ATOM 4056 C CG2 . VAL C 3 118 ? -9.882 -11.714 -0.515 1.00 31.58 ? 116 VAL L CG2 1 +ATOM 4057 N N . PHE C 3 119 ? -8.388 -13.097 -4.713 1.00 21.77 ? 117 PHE L N 1 +ATOM 4058 C CA . PHE C 3 119 ? -7.734 -13.029 -6.020 1.00 24.55 ? 117 PHE L CA 1 +ATOM 4059 C C . PHE C 3 119 ? -8.679 -12.356 -7.007 1.00 29.29 ? 117 PHE L C 1 +ATOM 4060 O O . PHE C 3 119 ? -9.886 -12.614 -6.973 1.00 26.99 ? 117 PHE L O 1 +ATOM 4061 C CB . PHE C 3 119 ? -7.382 -14.424 -6.547 1.00 22.25 ? 117 PHE L CB 1 +ATOM 4062 C CG . PHE C 3 119 ? -6.532 -15.235 -5.616 1.00 26.33 ? 117 PHE L CG 1 +ATOM 4063 C CD1 . PHE C 3 119 ? -7.109 -16.004 -4.618 1.00 26.95 ? 117 PHE L CD1 1 +ATOM 4064 C CD2 . PHE C 3 119 ? -5.143 -15.241 -5.756 1.00 27.36 ? 117 PHE L CD2 1 +ATOM 4065 C CE1 . PHE C 3 119 ? -6.326 -16.763 -3.762 1.00 25.99 ? 117 PHE L CE1 1 +ATOM 4066 C CE2 . PHE C 3 119 ? -4.352 -15.998 -4.897 1.00 28.18 ? 117 PHE L CE2 1 +ATOM 4067 C CZ . PHE C 3 119 ? -4.949 -16.764 -3.902 1.00 29.83 ? 117 PHE L CZ 1 +ATOM 4068 N N . ILE C 3 120 ? -8.145 -11.505 -7.889 1.00 25.20 ? 118 ILE L N 1 +ATOM 4069 C CA . ILE C 3 120 ? -8.955 -10.871 -8.931 1.00 22.39 ? 118 ILE L CA 1 +ATOM 4070 C C . ILE C 3 120 ? -8.420 -11.281 -10.296 1.00 29.20 ? 118 ILE L C 1 +ATOM 4071 O O . ILE C 3 120 ? -7.205 -11.398 -10.486 1.00 27.31 ? 118 ILE L O 1 +ATOM 4072 C CB . ILE C 3 120 ? -8.991 -9.332 -8.785 1.00 24.94 ? 118 ILE L CB 1 +ATOM 4073 C CG1 . ILE C 3 120 ? -9.970 -8.714 -9.786 1.00 27.06 ? 118 ILE L CG1 1 +ATOM 4074 C CG2 . ILE C 3 120 ? -7.613 -8.711 -8.942 1.00 26.78 ? 118 ILE L CG2 1 +ATOM 4075 C CD1 . ILE C 3 120 ? -10.383 -7.282 -9.415 1.00 25.46 ? 118 ILE L CD1 1 +ATOM 4076 N N . PHE C 3 121 ? -9.324 -11.517 -11.247 1.00 27.40 ? 119 PHE L N 1 +ATOM 4077 C CA . PHE C 3 121 ? -8.940 -11.979 -12.580 1.00 27.64 ? 119 PHE L CA 1 +ATOM 4078 C C . PHE C 3 121 ? -9.519 -11.026 -13.625 1.00 29.17 ? 119 PHE L C 1 +ATOM 4079 O O . PHE C 3 121 ? -10.749 -10.859 -13.684 1.00 27.95 ? 119 PHE L O 1 +ATOM 4080 C CB . PHE C 3 121 ? -9.432 -13.402 -12.856 1.00 25.11 ? 119 PHE L CB 1 +ATOM 4081 C CG . PHE C 3 121 ? -8.865 -14.432 -11.932 1.00 26.48 ? 119 PHE L CG 1 +ATOM 4082 C CD1 . PHE C 3 121 ? -7.607 -14.986 -12.165 1.00 26.68 ? 119 PHE L CD1 1 +ATOM 4083 C CD2 . PHE C 3 121 ? -9.596 -14.873 -10.838 1.00 30.51 ? 119 PHE L CD2 1 +ATOM 4084 C CE1 . PHE C 3 121 ? -7.103 -15.958 -11.319 1.00 26.86 ? 119 PHE L CE1 1 +ATOM 4085 C CE2 . PHE C 3 121 ? -9.087 -15.839 -9.982 1.00 30.37 ? 119 PHE L CE2 1 +ATOM 4086 C CZ . PHE C 3 121 ? -7.837 -16.382 -10.228 1.00 30.67 ? 119 PHE L CZ 1 +ATOM 4087 N N . PRO C 3 122 ? -8.695 -10.410 -14.458 1.00 26.92 ? 120 PRO L N 1 +ATOM 4088 C CA . PRO C 3 122 ? -9.217 -9.611 -15.564 1.00 26.23 ? 120 PRO L CA 1 +ATOM 4089 C C . PRO C 3 122 ? -9.878 -10.504 -16.596 1.00 29.50 ? 120 PRO L C 1 +ATOM 4090 O O . PRO C 3 122 ? -9.634 -11.720 -16.629 1.00 24.76 ? 120 PRO L O 1 +ATOM 4091 C CB . PRO C 3 122 ? -7.958 -8.938 -16.144 1.00 27.25 ? 120 PRO L CB 1 +ATOM 4092 C CG . PRO C 3 122 ? -6.909 -9.081 -15.087 1.00 32.84 ? 120 PRO L CG 1 +ATOM 4093 C CD . PRO C 3 122 ? -7.227 -10.377 -14.397 1.00 30.40 ? 120 PRO L CD 1 +ATOM 4094 N N . PRO C 3 123 ? -10.716 -9.938 -17.461 1.00 27.04 ? 121 PRO L N 1 +ATOM 4095 C CA . PRO C 3 123 ? -11.230 -10.724 -18.584 1.00 30.15 ? 121 PRO L CA 1 +ATOM 4096 C C . PRO C 3 123 ? -10.093 -11.140 -19.499 1.00 34.76 ? 121 PRO L C 1 +ATOM 4097 O O . PRO C 3 123 ? -9.108 -10.417 -19.670 1.00 32.38 ? 121 PRO L O 1 +ATOM 4098 C CB . PRO C 3 123 ? -12.197 -9.762 -19.287 1.00 33.33 ? 121 PRO L CB 1 +ATOM 4099 C CG . PRO C 3 123 ? -11.718 -8.397 -18.916 1.00 32.97 ? 121 PRO L CG 1 +ATOM 4100 C CD . PRO C 3 123 ? -11.137 -8.527 -17.520 1.00 30.86 ? 121 PRO L CD 1 +ATOM 4101 N N . SER C 3 124 ? -10.237 -12.323 -20.085 1.00 33.18 ? 122 SER L N 1 +ATOM 4102 C CA . SER C 3 124 ? -9.260 -12.807 -21.051 1.00 35.30 ? 122 SER L CA 1 +ATOM 4103 C C . SER C 3 124 ? -9.373 -12.044 -22.366 1.00 36.98 ? 122 SER L C 1 +ATOM 4104 O O . SER C 3 124 ? -10.446 -11.571 -22.744 1.00 37.19 ? 122 SER L O 1 +ATOM 4105 C CB . SER C 3 124 ? -9.470 -14.302 -21.291 1.00 35.71 ? 122 SER L CB 1 +ATOM 4106 O OG . SER C 3 124 ? -10.676 -14.527 -22.002 1.00 33.75 ? 122 SER L OG 1 +ATOM 4107 N N . ASP C 3 125 ? -8.247 -11.938 -23.079 1.00 42.52 ? 123 ASP L N 1 +ATOM 4108 C CA . ASP C 3 125 ? -8.291 -11.325 -24.403 1.00 41.03 ? 123 ASP L CA 1 +ATOM 4109 C C . ASP C 3 125 ? -9.237 -12.073 -25.330 1.00 36.65 ? 123 ASP L C 1 +ATOM 4110 O O . ASP C 3 125 ? -9.915 -11.450 -26.157 1.00 38.88 ? 123 ASP L O 1 +ATOM 4111 C CB . ASP C 3 125 ? -6.890 -11.268 -25.018 1.00 50.60 ? 123 ASP L CB 1 +ATOM 4112 C CG . ASP C 3 125 ? -5.977 -10.289 -24.301 1.00 61.71 ? 123 ASP L CG 1 +ATOM 4113 O OD1 . ASP C 3 125 ? -4.753 -10.540 -24.256 1.00 65.66 ? 123 ASP L OD1 1 +ATOM 4114 O OD2 . ASP C 3 125 ? -6.482 -9.266 -23.787 1.00 62.71 ? 123 ASP L OD2 1 +ATOM 4115 N N . GLU C 3 126 ? -9.300 -13.401 -25.204 1.00 36.92 ? 124 GLU L N 1 +ATOM 4116 C CA . GLU C 3 126 ? -10.188 -14.188 -26.053 1.00 43.66 ? 124 GLU L CA 1 +ATOM 4117 C C . GLU C 3 126 ? -11.649 -13.799 -25.840 1.00 41.68 ? 124 GLU L C 1 +ATOM 4118 O O . GLU C 3 126 ? -12.401 -13.636 -26.807 1.00 40.23 ? 124 GLU L O 1 +ATOM 4119 C CB . GLU C 3 126 ? -9.983 -15.680 -25.785 1.00 54.18 ? 124 GLU L CB 1 +ATOM 4120 C CG . GLU C 3 126 ? -10.703 -16.596 -26.772 1.00 68.58 ? 124 GLU L CG 1 +ATOM 4121 C CD . GLU C 3 126 ? -10.783 -18.035 -26.288 1.00 79.11 ? 124 GLU L CD 1 +ATOM 4122 O OE1 . GLU C 3 126 ? -10.072 -18.380 -25.319 1.00 83.06 ? 124 GLU L OE1 1 +ATOM 4123 O OE2 . GLU C 3 126 ? -11.559 -18.821 -26.874 1.00 83.73 ? 124 GLU L OE2 1 +ATOM 4124 N N . GLN C 3 127 ? -12.073 -13.641 -24.583 1.00 34.43 ? 125 GLN L N 1 +ATOM 4125 C CA . GLN C 3 127 ? -13.453 -13.226 -24.342 1.00 34.04 ? 125 GLN L CA 1 +ATOM 4126 C C . GLN C 3 127 ? -13.710 -11.817 -24.872 1.00 34.55 ? 125 GLN L C 1 +ATOM 4127 O O . GLN C 3 127 ? -14.764 -11.556 -25.465 1.00 37.45 ? 125 GLN L O 1 +ATOM 4128 C CB . GLN C 3 127 ? -13.794 -13.305 -22.854 1.00 33.13 ? 125 GLN L CB 1 +ATOM 4129 C CG . GLN C 3 127 ? -15.285 -13.020 -22.596 1.00 34.29 ? 125 GLN L CG 1 +ATOM 4130 C CD . GLN C 3 127 ? -15.647 -12.869 -21.130 1.00 33.79 ? 125 GLN L CD 1 +ATOM 4131 O OE1 . GLN C 3 127 ? -14.795 -12.583 -20.284 1.00 31.67 ? 125 GLN L OE1 1 +ATOM 4132 N NE2 . GLN C 3 127 ? -16.935 -13.049 -20.822 1.00 29.29 ? 125 GLN L NE2 1 +ATOM 4133 N N . LEU C 3 128 ? -12.754 -10.902 -24.688 1.00 36.12 ? 126 LEU L N 1 +ATOM 4134 C CA . LEU C 3 128 ? -12.955 -9.519 -25.122 1.00 40.69 ? 126 LEU L CA 1 +ATOM 4135 C C . LEU C 3 128 ? -13.229 -9.433 -26.619 1.00 47.46 ? 126 LEU L C 1 +ATOM 4136 O O . LEU C 3 128 ? -14.052 -8.620 -27.056 1.00 50.88 ? 126 LEU L O 1 +ATOM 4137 C CB . LEU C 3 128 ? -11.742 -8.668 -24.749 1.00 41.76 ? 126 LEU L CB 1 +ATOM 4138 C CG . LEU C 3 128 ? -11.670 -8.315 -23.264 1.00 44.50 ? 126 LEU L CG 1 +ATOM 4139 C CD1 . LEU C 3 128 ? -10.435 -7.483 -22.952 1.00 50.89 ? 126 LEU L CD1 1 +ATOM 4140 C CD2 . LEU C 3 128 ? -12.936 -7.598 -22.836 1.00 42.85 ? 126 LEU L CD2 1 +ATOM 4141 N N . LYS C 3 129 ? -12.559 -10.270 -27.417 1.00 48.20 ? 127 LYS L N 1 +ATOM 4142 C CA . LYS C 3 129 ? -12.867 -10.360 -28.842 1.00 56.37 ? 127 LYS L CA 1 +ATOM 4143 C C . LYS C 3 129 ? -14.350 -10.604 -29.095 1.00 59.87 ? 127 LYS L C 1 +ATOM 4144 O O . LYS C 3 129 ? -14.869 -10.225 -30.152 1.00 57.84 ? 127 LYS L O 1 +ATOM 4145 C CB . LYS C 3 129 ? -12.054 -11.483 -29.491 1.00 62.90 ? 127 LYS L CB 1 +ATOM 4146 C CG . LYS C 3 129 ? -10.664 -11.081 -29.955 1.00 74.23 ? 127 LYS L CG 1 +ATOM 4147 C CD . LYS C 3 129 ? -10.058 -12.138 -30.877 1.00 79.63 ? 127 LYS L CD 1 +ATOM 4148 C CE . LYS C 3 129 ? -10.400 -13.553 -30.422 1.00 81.37 ? 127 LYS L CE 1 +ATOM 4149 N NZ . LYS C 3 129 ? -9.311 -14.172 -29.614 1.00 80.87 ? 127 LYS L NZ 1 +ATOM 4150 N N . SER C 3 130 ? -15.043 -11.241 -28.147 1.00 53.47 ? 128 SER L N 1 +ATOM 4151 C CA . SER C 3 130 ? -16.452 -11.580 -28.295 1.00 56.29 ? 128 SER L CA 1 +ATOM 4152 C C . SER C 3 130 ? -17.383 -10.417 -27.988 1.00 52.18 ? 128 SER L C 1 +ATOM 4153 O O . SER C 3 130 ? -18.574 -10.508 -28.298 1.00 54.09 ? 128 SER L O 1 +ATOM 4154 C CB . SER C 3 130 ? -16.814 -12.757 -27.377 1.00 63.20 ? 128 SER L CB 1 +ATOM 4155 O OG . SER C 3 130 ? -16.171 -13.945 -27.796 1.00 72.83 ? 128 SER L OG 1 +ATOM 4156 N N . GLY C 3 131 ? -16.893 -9.355 -27.351 1.00 45.05 ? 129 GLY L N 1 +ATOM 4157 C CA . GLY C 3 131 ? -17.716 -8.208 -27.027 1.00 43.87 ? 129 GLY L CA 1 +ATOM 4158 C C . GLY C 3 131 ? -18.189 -8.108 -25.591 1.00 45.20 ? 129 GLY L C 1 +ATOM 4159 O O . GLY C 3 131 ? -18.922 -7.166 -25.269 1.00 45.45 ? 129 GLY L O 1 +ATOM 4160 N N . THR C 3 132 ? -17.791 -9.032 -24.715 1.00 40.09 ? 130 THR L N 1 +ATOM 4161 C CA . THR C 3 132 ? -18.194 -9.007 -23.316 1.00 34.57 ? 130 THR L CA 1 +ATOM 4162 C C . THR C 3 132 ? -16.959 -9.177 -22.437 1.00 37.96 ? 130 THR L C 1 +ATOM 4163 O O . THR C 3 132 ? -15.976 -9.807 -22.836 1.00 40.64 ? 130 THR L O 1 +ATOM 4164 C CB . THR C 3 132 ? -19.239 -10.109 -23.020 1.00 41.27 ? 130 THR L CB 1 +ATOM 4165 O OG1 . THR C 3 132 ? -20.420 -9.871 -23.799 1.00 46.09 ? 130 THR L OG1 1 +ATOM 4166 C CG2 . THR C 3 132 ? -19.636 -10.117 -21.552 1.00 37.53 ? 130 THR L CG2 1 +ATOM 4167 N N . ALA C 3 133 ? -16.997 -8.578 -21.249 1.00 33.02 ? 131 ALA L N 1 +ATOM 4168 C CA . ALA C 3 133 ? -15.927 -8.705 -20.265 1.00 35.85 ? 131 ALA L CA 1 +ATOM 4169 C C . ALA C 3 133 ? -16.504 -9.261 -18.974 1.00 33.69 ? 131 ALA L C 1 +ATOM 4170 O O . ALA C 3 133 ? -17.444 -8.682 -18.417 1.00 35.73 ? 131 ALA L O 1 +ATOM 4171 C CB . ALA C 3 133 ? -15.262 -7.356 -19.999 1.00 35.79 ? 131 ALA L CB 1 +ATOM 4172 N N . SER C 3 134 ? -15.951 -10.378 -18.503 1.00 30.75 ? 132 SER L N 1 +ATOM 4173 C CA . SER C 3 134 ? -16.261 -10.899 -17.174 1.00 26.81 ? 132 SER L CA 1 +ATOM 4174 C C . SER C 3 134 ? -15.032 -10.755 -16.293 1.00 30.28 ? 132 SER L C 1 +ATOM 4175 O O . SER C 3 134 ? -13.953 -11.253 -16.636 1.00 28.48 ? 132 SER L O 1 +ATOM 4176 C CB . SER C 3 134 ? -16.729 -12.359 -17.194 1.00 31.79 ? 132 SER L CB 1 +ATOM 4177 O OG . SER C 3 134 ? -17.668 -12.619 -18.221 1.00 34.11 ? 132 SER L OG 1 +ATOM 4178 N N . VAL C 3 135 ? -15.197 -10.058 -15.174 1.00 25.62 ? 133 VAL L N 1 +ATOM 4179 C CA . VAL C 3 135 ? -14.161 -9.897 -14.165 1.00 22.60 ? 133 VAL L CA 1 +ATOM 4180 C C . VAL C 3 135 ? -14.531 -10.796 -13.004 1.00 25.01 ? 133 VAL L C 1 +ATOM 4181 O O . VAL C 3 135 ? -15.691 -10.801 -12.567 1.00 27.29 ? 133 VAL L O 1 +ATOM 4182 C CB . VAL C 3 135 ? -14.044 -8.438 -13.703 1.00 25.06 ? 133 VAL L CB 1 +ATOM 4183 C CG1 . VAL C 3 135 ? -12.730 -8.239 -12.930 1.00 24.60 ? 133 VAL L CG1 1 +ATOM 4184 C CG2 . VAL C 3 135 ? -14.142 -7.490 -14.880 1.00 29.65 ? 133 VAL L CG2 1 +ATOM 4185 N N . VAL C 3 136 ? -13.560 -11.545 -12.488 1.00 25.57 ? 134 VAL L N 1 +ATOM 4186 C CA . VAL C 3 136 ? -13.851 -12.567 -11.497 1.00 24.55 ? 134 VAL L CA 1 +ATOM 4187 C C . VAL C 3 136 ? -13.060 -12.280 -10.233 1.00 28.34 ? 134 VAL L C 1 +ATOM 4188 O O . VAL C 3 136 ? -11.868 -11.971 -10.290 1.00 25.32 ? 134 VAL L O 1 +ATOM 4189 C CB . VAL C 3 136 ? -13.553 -13.976 -12.029 1.00 23.00 ? 134 VAL L CB 1 +ATOM 4190 C CG1 . VAL C 3 136 ? -13.705 -14.985 -10.902 1.00 25.37 ? 134 VAL L CG1 1 +ATOM 4191 C CG2 . VAL C 3 136 ? -14.492 -14.299 -13.210 1.00 26.62 ? 134 VAL L CG2 1 +ATOM 4192 N N . CYS C 3 137 ? -13.737 -12.358 -9.096 1.00 24.08 ? 135 CYS L N 1 +ATOM 4193 C CA . CYS C 3 137 ? -13.119 -12.195 -7.790 1.00 25.64 ? 135 CYS L CA 1 +ATOM 4194 C C . CYS C 3 137 ? -13.299 -13.505 -7.041 1.00 28.92 ? 135 CYS L C 1 +ATOM 4195 O O . CYS C 3 137 ? -14.419 -14.028 -6.964 1.00 29.44 ? 135 CYS L O 1 +ATOM 4196 C CB . CYS C 3 137 ? -13.754 -11.012 -7.028 1.00 26.86 ? 135 CYS L CB 1 +ATOM 4197 S SG . CYS C 3 137 ? -12.961 -10.571 -5.470 1.00 36.71 ? 135 CYS L SG 1 +ATOM 4198 N N . LEU C 3 138 ? -12.207 -14.042 -6.506 1.00 23.62 ? 136 LEU L N 1 +ATOM 4199 C CA . LEU C 3 138 ? -12.208 -15.327 -5.823 1.00 21.87 ? 136 LEU L CA 1 +ATOM 4200 C C . LEU C 3 138 ? -11.866 -15.117 -4.355 1.00 24.39 ? 136 LEU L C 1 +ATOM 4201 O O . LEU C 3 138 ? -10.867 -14.465 -4.037 1.00 25.01 ? 136 LEU L O 1 +ATOM 4202 C CB . LEU C 3 138 ? -11.206 -16.298 -6.465 1.00 23.28 ? 136 LEU L CB 1 +ATOM 4203 C CG . LEU C 3 138 ? -10.870 -17.571 -5.674 1.00 26.63 ? 136 LEU L CG 1 +ATOM 4204 C CD1 . LEU C 3 138 ? -12.084 -18.476 -5.487 1.00 26.24 ? 136 LEU L CD1 1 +ATOM 4205 C CD2 . LEU C 3 138 ? -9.725 -18.354 -6.323 1.00 27.48 ? 136 LEU L CD2 1 +ATOM 4206 N N . LEU C 3 139 ? -12.723 -15.633 -3.465 1.00 21.83 ? 137 LEU L N 1 +ATOM 4207 C CA . LEU C 3 139 ? -12.494 -15.649 -2.020 1.00 22.73 ? 137 LEU L CA 1 +ATOM 4208 C C . LEU C 3 139 ? -12.293 -17.106 -1.641 1.00 28.84 ? 137 LEU L C 1 +ATOM 4209 O O . LEU C 3 139 ? -13.235 -17.902 -1.714 1.00 25.87 ? 137 LEU L O 1 +ATOM 4210 C CB . LEU C 3 139 ? -13.684 -15.057 -1.251 1.00 19.73 ? 137 LEU L CB 1 +ATOM 4211 C CG . LEU C 3 139 ? -13.905 -13.546 -1.228 1.00 27.03 ? 137 LEU L CG 1 +ATOM 4212 C CD1 . LEU C 3 139 ? -14.025 -12.953 -2.624 1.00 27.11 ? 137 LEU L CD1 1 +ATOM 4213 C CD2 . LEU C 3 139 ? -15.181 -13.251 -0.424 1.00 26.83 ? 137 LEU L CD2 1 +ATOM 4214 N N . ASN C 3 140 ? -11.085 -17.469 -1.240 1.00 22.12 ? 138 ASN L N 1 +ATOM 4215 C CA . ASN C 3 140 ? -10.742 -18.879 -1.113 1.00 23.90 ? 138 ASN L CA 1 +ATOM 4216 C C . ASN C 3 140 ? -10.576 -19.289 0.344 1.00 26.11 ? 138 ASN L C 1 +ATOM 4217 O O . ASN C 3 140 ? -9.845 -18.630 1.091 1.00 26.44 ? 138 ASN L O 1 +ATOM 4218 C CB . ASN C 3 140 ? -9.458 -19.180 -1.887 1.00 27.59 ? 138 ASN L CB 1 +ATOM 4219 C CG . ASN C 3 140 ? -9.313 -20.655 -2.203 1.00 37.86 ? 138 ASN L CG 1 +ATOM 4220 O OD1 . ASN C 3 140 ? -10.176 -21.246 -2.848 1.00 44.27 ? 138 ASN L OD1 1 +ATOM 4221 N ND2 . ASN C 3 140 ? -8.243 -21.259 -1.724 1.00 34.46 ? 138 ASN L ND2 1 +ATOM 4222 N N . ASN C 3 141 ? -11.262 -20.374 0.737 1.00 26.02 ? 139 ASN L N 1 +ATOM 4223 C CA . ASN C 3 141 ? -11.048 -21.103 1.998 1.00 26.89 ? 139 ASN L CA 1 +ATOM 4224 C C . ASN C 3 141 ? -11.221 -20.215 3.234 1.00 28.65 ? 139 ASN L C 1 +ATOM 4225 O O . ASN C 3 141 ? -10.294 -20.017 4.031 1.00 23.90 ? 139 ASN L O 1 +ATOM 4226 C CB . ASN C 3 141 ? -9.672 -21.781 2.007 1.00 29.86 ? 139 ASN L CB 1 +ATOM 4227 C CG . ASN C 3 141 ? -9.553 -22.865 0.952 1.00 38.40 ? 139 ASN L CG 1 +ATOM 4228 O OD1 . ASN C 3 141 ? -10.491 -23.114 0.206 1.00 34.50 ? 139 ASN L OD1 1 +ATOM 4229 N ND2 . ASN C 3 141 ? -8.393 -23.499 0.875 1.00 42.10 ? 139 ASN L ND2 1 +ATOM 4230 N N . PHE C 3 142 ? -12.445 -19.735 3.430 1.00 26.96 ? 140 PHE L N 1 +ATOM 4231 C CA . PHE C 3 142 ? -12.739 -18.857 4.554 1.00 24.44 ? 140 PHE L CA 1 +ATOM 4232 C C . PHE C 3 142 ? -13.839 -19.445 5.436 1.00 23.46 ? 140 PHE L C 1 +ATOM 4233 O O . PHE C 3 142 ? -14.560 -20.368 5.042 1.00 24.08 ? 140 PHE L O 1 +ATOM 4234 C CB . PHE C 3 142 ? -13.145 -17.452 4.074 1.00 25.80 ? 140 PHE L CB 1 +ATOM 4235 C CG . PHE C 3 142 ? -14.381 -17.424 3.205 1.00 26.23 ? 140 PHE L CG 1 +ATOM 4236 C CD1 . PHE C 3 142 ? -15.648 -17.280 3.778 1.00 26.47 ? 140 PHE L CD1 1 +ATOM 4237 C CD2 . PHE C 3 142 ? -14.278 -17.507 1.823 1.00 24.64 ? 140 PHE L CD2 1 +ATOM 4238 C CE1 . PHE C 3 142 ? -16.791 -17.235 2.980 1.00 27.19 ? 140 PHE L CE1 1 +ATOM 4239 C CE2 . PHE C 3 142 ? -15.424 -17.462 1.019 1.00 24.18 ? 140 PHE L CE2 1 +ATOM 4240 C CZ . PHE C 3 142 ? -16.674 -17.328 1.602 1.00 25.44 ? 140 PHE L CZ 1 +ATOM 4241 N N . TYR C 3 143 ? -13.939 -18.906 6.651 1.00 23.06 ? 141 TYR L N 1 +ATOM 4242 C CA . TYR C 3 143 ? -14.985 -19.319 7.579 1.00 23.70 ? 141 TYR L CA 1 +ATOM 4243 C C . TYR C 3 143 ? -15.185 -18.182 8.560 1.00 27.47 ? 141 TYR L C 1 +ATOM 4244 O O . TYR C 3 143 ? -14.190 -17.657 9.083 1.00 27.80 ? 141 TYR L O 1 +ATOM 4245 C CB . TYR C 3 143 ? -14.617 -20.609 8.334 1.00 25.59 ? 141 TYR L CB 1 +ATOM 4246 C CG . TYR C 3 143 ? -15.769 -21.087 9.184 1.00 26.28 ? 141 TYR L CG 1 +ATOM 4247 C CD1 . TYR C 3 143 ? -15.960 -20.583 10.467 1.00 26.59 ? 141 TYR L CD1 1 +ATOM 4248 C CD2 . TYR C 3 143 ? -16.693 -21.983 8.685 1.00 27.39 ? 141 TYR L CD2 1 +ATOM 4249 C CE1 . TYR C 3 143 ? -17.025 -20.968 11.232 1.00 29.28 ? 141 TYR L CE1 1 +ATOM 4250 C CE2 . TYR C 3 143 ? -17.788 -22.382 9.458 1.00 25.65 ? 141 TYR L CE2 1 +ATOM 4251 C CZ . TYR C 3 143 ? -17.930 -21.869 10.730 1.00 33.98 ? 141 TYR L CZ 1 +ATOM 4252 O OH . TYR C 3 143 ? -18.994 -22.248 11.515 1.00 35.80 ? 141 TYR L OH 1 +ATOM 4253 N N . PRO C 3 144 ? -16.435 -17.813 8.892 1.00 26.41 ? 142 PRO L N 1 +ATOM 4254 C CA . PRO C 3 144 ? -17.713 -18.422 8.502 1.00 22.55 ? 142 PRO L CA 1 +ATOM 4255 C C . PRO C 3 144 ? -18.196 -17.990 7.124 1.00 30.05 ? 142 PRO L C 1 +ATOM 4256 O O . PRO C 3 144 ? -17.482 -17.273 6.430 1.00 27.85 ? 142 PRO L O 1 +ATOM 4257 C CB . PRO C 3 144 ? -18.678 -17.922 9.588 1.00 28.75 ? 142 PRO L CB 1 +ATOM 4258 C CG . PRO C 3 144 ? -18.113 -16.602 9.975 1.00 32.08 ? 142 PRO L CG 1 +ATOM 4259 C CD . PRO C 3 144 ? -16.617 -16.748 9.892 1.00 31.07 ? 142 PRO L CD 1 +ATOM 4260 N N . ARG C 3 145 ? -19.403 -18.413 6.729 1.00 29.31 ? 143 ARG L N 1 +ATOM 4261 C CA . ARG C 3 145 ? -19.809 -18.220 5.339 1.00 27.95 ? 143 ARG L CA 1 +ATOM 4262 C C . ARG C 3 145 ? -20.132 -16.767 5.013 1.00 25.58 ? 143 ARG L C 1 +ATOM 4263 O O . ARG C 3 145 ? -20.122 -16.396 3.835 1.00 29.08 ? 143 ARG L O 1 +ATOM 4264 C CB . ARG C 3 145 ? -21.010 -19.114 5.000 1.00 29.79 ? 143 ARG L CB 1 +ATOM 4265 C CG . ARG C 3 145 ? -22.252 -18.868 5.841 1.00 45.72 ? 143 ARG L CG 1 +ATOM 4266 C CD . ARG C 3 145 ? -23.533 -19.310 5.093 1.00 48.93 ? 143 ARG L CD 1 +ATOM 4267 N NE . ARG C 3 145 ? -23.522 -20.735 4.763 1.00 52.54 ? 143 ARG L NE 1 +ATOM 4268 C CZ . ARG C 3 145 ? -23.520 -21.233 3.527 1.00 49.84 ? 143 ARG L CZ 1 +ATOM 4269 N NH1 . ARG C 3 145 ? -23.532 -20.424 2.472 1.00 52.68 ? 143 ARG L NH1 1 +ATOM 4270 N NH2 . ARG C 3 145 ? -23.509 -22.549 3.346 1.00 39.40 ? 143 ARG L NH2 1 +ATOM 4271 N N . GLU C 3 146 ? -20.424 -15.943 6.016 1.00 25.41 ? 144 GLU L N 1 +ATOM 4272 C CA . GLU C 3 146 ? -20.810 -14.549 5.796 1.00 32.75 ? 144 GLU L CA 1 +ATOM 4273 C C . GLU C 3 146 ? -19.638 -13.765 5.216 1.00 33.72 ? 144 GLU L C 1 +ATOM 4274 O O . GLU C 3 146 ? -18.628 -13.559 5.892 1.00 29.90 ? 144 GLU L O 1 +ATOM 4275 C CB . GLU C 3 146 ? -21.266 -13.908 7.107 1.00 37.00 ? 144 GLU L CB 1 +ATOM 4276 C CG . GLU C 3 146 ? -22.618 -14.392 7.688 1.00 63.83 ? 144 GLU L CG 1 +ATOM 4277 C CD . GLU C 3 146 ? -22.683 -15.891 8.031 1.00 67.92 ? 144 GLU L CD 1 +ATOM 4278 O OE1 . GLU C 3 146 ? -23.750 -16.506 7.780 1.00 71.00 ? 144 GLU L OE1 1 +ATOM 4279 O OE2 . GLU C 3 146 ? -21.694 -16.451 8.565 1.00 56.22 ? 144 GLU L OE2 1 +ATOM 4280 N N . ALA C 3 147 ? -19.785 -13.283 3.988 1.00 33.33 ? 145 ALA L N 1 +ATOM 4281 C CA . ALA C 3 147 ? -18.752 -12.473 3.355 1.00 32.59 ? 145 ALA L CA 1 +ATOM 4282 C C . ALA C 3 147 ? -19.425 -11.516 2.389 1.00 38.13 ? 145 ALA L C 1 +ATOM 4283 O O . ALA C 3 147 ? -20.476 -11.830 1.820 1.00 37.07 ? 145 ALA L O 1 +ATOM 4284 C CB . ALA C 3 147 ? -17.718 -13.338 2.624 1.00 33.71 ? 145 ALA L CB 1 +ATOM 4285 N N . LYS C 3 148 ? -18.828 -10.342 2.220 1.00 29.88 ? 146 LYS L N 1 +ATOM 4286 C CA . LYS C 3 148 ? -19.364 -9.319 1.333 1.00 32.05 ? 146 LYS L CA 1 +ATOM 4287 C C . LYS C 3 148 ? -18.312 -8.939 0.298 1.00 28.70 ? 146 LYS L C 1 +ATOM 4288 O O . LYS C 3 148 ? -17.189 -8.574 0.656 1.00 31.99 ? 146 LYS L O 1 +ATOM 4289 C CB . LYS C 3 148 ? -19.794 -8.074 2.119 1.00 38.56 ? 146 LYS L CB 1 +ATOM 4290 C CG . LYS C 3 148 ? -20.270 -6.916 1.240 1.00 56.71 ? 146 LYS L CG 1 +ATOM 4291 C CD . LYS C 3 148 ? -19.772 -5.553 1.728 1.00 69.32 ? 146 LYS L CD 1 +ATOM 4292 C CE . LYS C 3 148 ? -20.438 -5.140 3.036 1.00 78.19 ? 146 LYS L CE 1 +ATOM 4293 N NZ . LYS C 3 148 ? -19.500 -4.418 3.948 1.00 81.58 ? 146 LYS L NZ 1 +ATOM 4294 N N . VAL C 3 149 ? -18.689 -9.007 -0.974 1.00 25.02 ? 147 VAL L N 1 +ATOM 4295 C CA . VAL C 3 149 ? -17.851 -8.578 -2.087 1.00 25.34 ? 147 VAL L CA 1 +ATOM 4296 C C . VAL C 3 149 ? -18.437 -7.287 -2.629 1.00 31.45 ? 147 VAL L C 1 +ATOM 4297 O O . VAL C 3 149 ? -19.629 -7.230 -2.957 1.00 29.90 ? 147 VAL L O 1 +ATOM 4298 C CB . VAL C 3 149 ? -17.787 -9.654 -3.184 1.00 32.55 ? 147 VAL L CB 1 +ATOM 4299 C CG1 . VAL C 3 149 ? -17.052 -9.127 -4.425 1.00 32.69 ? 147 VAL L CG1 1 +ATOM 4300 C CG2 . VAL C 3 149 ? -17.123 -10.905 -2.649 1.00 38.66 ? 147 VAL L CG2 1 +ATOM 4301 N N . GLN C 3 150 ? -17.618 -6.247 -2.704 1.00 24.57 ? 148 GLN L N 1 +ATOM 4302 C CA . GLN C 3 150 ? -18.039 -4.965 -3.255 1.00 28.99 ? 148 GLN L CA 1 +ATOM 4303 C C . GLN C 3 150 ? -17.171 -4.696 -4.474 1.00 29.43 ? 148 GLN L C 1 +ATOM 4304 O O . GLN C 3 150 ? -15.969 -4.470 -4.330 1.00 29.94 ? 148 GLN L O 1 +ATOM 4305 C CB . GLN C 3 150 ? -17.889 -3.847 -2.225 1.00 27.73 ? 148 GLN L CB 1 +ATOM 4306 C CG . GLN C 3 150 ? -18.173 -2.448 -2.775 1.00 33.75 ? 148 GLN L CG 1 +ATOM 4307 C CD . GLN C 3 150 ? -19.624 -2.280 -3.186 1.00 39.99 ? 148 GLN L CD 1 +ATOM 4308 O OE1 . GLN C 3 150 ? -20.506 -2.156 -2.340 1.00 42.36 ? 148 GLN L OE1 1 +ATOM 4309 N NE2 . GLN C 3 150 ? -19.880 -2.288 -4.490 1.00 34.11 ? 148 GLN L NE2 1 +ATOM 4310 N N . TRP C 3 151 ? -17.772 -4.730 -5.663 1.00 29.11 ? 149 TRP L N 1 +ATOM 4311 C CA . TRP C 3 151 ? -17.059 -4.354 -6.882 1.00 28.84 ? 149 TRP L CA 1 +ATOM 4312 C C . TRP C 3 151 ? -16.962 -2.841 -6.991 1.00 31.51 ? 149 TRP L C 1 +ATOM 4313 O O . TRP C 3 151 ? -17.906 -2.115 -6.655 1.00 28.43 ? 149 TRP L O 1 +ATOM 4314 C CB . TRP C 3 151 ? -17.765 -4.904 -8.126 1.00 23.94 ? 149 TRP L CB 1 +ATOM 4315 C CG . TRP C 3 151 ? -17.586 -6.364 -8.332 1.00 24.12 ? 149 TRP L CG 1 +ATOM 4316 C CD1 . TRP C 3 151 ? -18.485 -7.347 -8.051 1.00 26.15 ? 149 TRP L CD1 1 +ATOM 4317 C CD2 . TRP C 3 151 ? -16.427 -7.016 -8.867 1.00 25.04 ? 149 TRP L CD2 1 +ATOM 4318 N NE1 . TRP C 3 151 ? -17.964 -8.571 -8.379 1.00 26.83 ? 149 TRP L NE1 1 +ATOM 4319 C CE2 . TRP C 3 151 ? -16.700 -8.392 -8.889 1.00 28.67 ? 149 TRP L CE2 1 +ATOM 4320 C CE3 . TRP C 3 151 ? -15.188 -6.559 -9.340 1.00 27.07 ? 149 TRP L CE3 1 +ATOM 4321 C CZ2 . TRP C 3 151 ? -15.783 -9.326 -9.359 1.00 23.13 ? 149 TRP L CZ2 1 +ATOM 4322 C CZ3 . TRP C 3 151 ? -14.270 -7.485 -9.816 1.00 24.71 ? 149 TRP L CZ3 1 +ATOM 4323 C CH2 . TRP C 3 151 ? -14.567 -8.855 -9.814 1.00 26.11 ? 149 TRP L CH2 1 +ATOM 4324 N N . LYS C 3 152 ? -15.817 -2.367 -7.482 1.00 26.10 ? 150 LYS L N 1 +ATOM 4325 C CA . LYS C 3 152 ? -15.592 -0.950 -7.713 1.00 28.29 ? 150 LYS L CA 1 +ATOM 4326 C C . LYS C 3 152 ? -14.932 -0.781 -9.068 1.00 32.13 ? 150 LYS L C 1 +ATOM 4327 O O . LYS C 3 152 ? -14.005 -1.519 -9.407 1.00 29.04 ? 150 LYS L O 1 +ATOM 4328 C CB . LYS C 3 152 ? -14.699 -0.322 -6.632 1.00 30.61 ? 150 LYS L CB 1 +ATOM 4329 C CG . LYS C 3 152 ? -15.241 -0.452 -5.214 1.00 34.94 ? 150 LYS L CG 1 +ATOM 4330 C CD . LYS C 3 152 ? -14.375 0.340 -4.243 1.00 41.34 ? 150 LYS L CD 1 +ATOM 4331 C CE . LYS C 3 152 ? -14.875 0.219 -2.814 1.00 46.93 ? 150 LYS L CE 1 +ATOM 4332 N NZ . LYS C 3 152 ? -14.059 1.057 -1.884 1.00 52.18 ? 150 LYS L NZ 1 +ATOM 4333 N N . VAL C 3 153 ? -15.420 0.185 -9.838 1.00 28.32 ? 151 VAL L N 1 +ATOM 4334 C CA . VAL C 3 153 ? -14.885 0.512 -11.154 1.00 30.50 ? 151 VAL L CA 1 +ATOM 4335 C C . VAL C 3 153 ? -14.548 1.997 -11.127 1.00 32.42 ? 151 VAL L C 1 +ATOM 4336 O O . VAL C 3 153 ? -15.452 2.835 -11.015 1.00 29.67 ? 151 VAL L O 1 +ATOM 4337 C CB . VAL C 3 153 ? -15.886 0.192 -12.275 1.00 33.32 ? 151 VAL L CB 1 +ATOM 4338 C CG1 . VAL C 3 153 ? -15.312 0.558 -13.614 1.00 33.90 ? 151 VAL L CG1 1 +ATOM 4339 C CG2 . VAL C 3 153 ? -16.261 -1.284 -12.243 1.00 31.33 ? 151 VAL L CG2 1 +ATOM 4340 N N . ASP C 3 154 ? -13.257 2.330 -11.209 1.00 30.66 ? 152 ASP L N 1 +ATOM 4341 C CA . ASP C 3 154 ? -12.803 3.714 -11.020 1.00 31.57 ? 152 ASP L CA 1 +ATOM 4342 C C . ASP C 3 154 ? -13.402 4.309 -9.748 1.00 30.61 ? 152 ASP L C 1 +ATOM 4343 O O . ASP C 3 154 ? -13.814 5.475 -9.705 1.00 28.82 ? 152 ASP L O 1 +ATOM 4344 C CB . ASP C 3 154 ? -13.132 4.587 -12.232 1.00 32.23 ? 152 ASP L CB 1 +ATOM 4345 C CG . ASP C 3 154 ? -12.191 4.345 -13.394 1.00 34.71 ? 152 ASP L CG 1 +ATOM 4346 O OD1 . ASP C 3 154 ? -11.085 3.833 -13.150 1.00 36.05 ? 152 ASP L OD1 1 +ATOM 4347 O OD2 . ASP C 3 154 ? -12.557 4.671 -14.543 1.00 36.85 ? 152 ASP L OD2 1 +ATOM 4348 N N . ASN C 3 155 ? -13.467 3.477 -8.709 1.00 30.72 ? 153 ASN L N 1 +ATOM 4349 C CA . ASN C 3 155 ? -13.952 3.795 -7.371 1.00 33.07 ? 153 ASN L CA 1 +ATOM 4350 C C . ASN C 3 155 ? -15.445 4.067 -7.309 1.00 32.70 ? 153 ASN L C 1 +ATOM 4351 O O . ASN C 3 155 ? -15.935 4.526 -6.273 1.00 36.35 ? 153 ASN L O 1 +ATOM 4352 C CB . ASN C 3 155 ? -13.195 4.967 -6.755 1.00 38.87 ? 153 ASN L CB 1 +ATOM 4353 C CG . ASN C 3 155 ? -11.959 4.510 -6.039 1.00 57.44 ? 153 ASN L CG 1 +ATOM 4354 O OD1 . ASN C 3 155 ? -12.042 3.871 -4.990 1.00 66.01 ? 153 ASN L OD1 1 +ATOM 4355 N ND2 . ASN C 3 155 ? -10.802 4.801 -6.612 1.00 57.91 ? 153 ASN L ND2 1 +ATOM 4356 N N . ALA C 3 156 ? -16.191 3.777 -8.368 1.00 32.09 ? 154 ALA L N 1 +ATOM 4357 C CA . ALA C 3 156 ? -17.648 3.780 -8.294 1.00 30.44 ? 154 ALA L CA 1 +ATOM 4358 C C . ALA C 3 156 ? -18.123 2.399 -7.849 1.00 26.38 ? 154 ALA L C 1 +ATOM 4359 O O . ALA C 3 156 ? -17.775 1.383 -8.463 1.00 28.37 ? 154 ALA L O 1 +ATOM 4360 C CB . ALA C 3 156 ? -18.262 4.163 -9.640 1.00 34.37 ? 154 ALA L CB 1 +ATOM 4361 N N . LEU C 3 157 ? -18.907 2.361 -6.775 1.00 28.57 ? 155 LEU L N 1 +ATOM 4362 C CA . LEU C 3 157 ? -19.404 1.093 -6.253 1.00 29.04 ? 155 LEU L CA 1 +ATOM 4363 C C . LEU C 3 157 ? -20.454 0.521 -7.203 1.00 32.76 ? 155 LEU L C 1 +ATOM 4364 O O . LEU C 3 157 ? -21.448 1.189 -7.503 1.00 32.96 ? 155 LEU L O 1 +ATOM 4365 C CB . LEU C 3 157 ? -19.996 1.302 -4.861 1.00 27.74 ? 155 LEU L CB 1 +ATOM 4366 C CG . LEU C 3 157 ? -18.996 1.366 -3.697 1.00 36.84 ? 155 LEU L CG 1 +ATOM 4367 C CD1 . LEU C 3 157 ? -18.092 2.595 -3.768 1.00 31.42 ? 155 LEU L CD1 1 +ATOM 4368 C CD2 . LEU C 3 157 ? -19.754 1.353 -2.385 1.00 33.92 ? 155 LEU L CD2 1 +ATOM 4369 N N . GLN C 3 158 ? -20.249 -0.720 -7.647 1.00 28.77 ? 156 GLN L N 1 +ATOM 4370 C CA . GLN C 3 158 ? -21.109 -1.361 -8.643 1.00 28.61 ? 156 GLN L CA 1 +ATOM 4371 C C . GLN C 3 158 ? -22.262 -2.105 -7.991 1.00 30.49 ? 156 GLN L C 1 +ATOM 4372 O O . GLN C 3 158 ? -22.055 -2.917 -7.087 1.00 36.43 ? 156 GLN L O 1 +ATOM 4373 C CB . GLN C 3 158 ? -20.310 -2.362 -9.474 1.00 31.88 ? 156 GLN L CB 1 +ATOM 4374 C CG . GLN C 3 158 ? -19.186 -1.739 -10.235 1.00 29.11 ? 156 GLN L CG 1 +ATOM 4375 C CD . GLN C 3 158 ? -19.671 -0.657 -11.157 1.00 36.09 ? 156 GLN L CD 1 +ATOM 4376 O OE1 . GLN C 3 158 ? -20.381 -0.926 -12.131 1.00 38.89 ? 156 GLN L OE1 1 +ATOM 4377 N NE2 . GLN C 3 158 ? -19.317 0.586 -10.844 1.00 33.27 ? 156 GLN L NE2 1 +ATOM 4378 N N . SER C 3 159 ? -23.465 -1.885 -8.500 1.00 29.56 ? 157 SER L N 1 +ATOM 4379 C CA . SER C 3 159 ? -24.618 -2.640 -8.041 1.00 28.74 ? 157 SER L CA 1 +ATOM 4380 C C . SER C 3 159 ? -25.434 -3.058 -9.255 1.00 33.02 ? 157 SER L C 1 +ATOM 4381 O O . SER C 3 159 ? -25.629 -2.264 -10.180 1.00 29.43 ? 157 SER L O 1 +ATOM 4382 C CB . SER C 3 159 ? -25.469 -1.807 -7.070 1.00 37.36 ? 157 SER L CB 1 +ATOM 4383 O OG . SER C 3 159 ? -26.674 -2.474 -6.740 1.00 41.79 ? 157 SER L OG 1 +ATOM 4384 N N . GLY C 3 160 ? -25.894 -4.304 -9.256 1.00 32.11 ? 158 GLY L N 1 +ATOM 4385 C CA . GLY C 3 160 ? -26.771 -4.781 -10.303 1.00 32.97 ? 158 GLY L CA 1 +ATOM 4386 C C . GLY C 3 160 ? -26.101 -5.479 -11.472 1.00 35.19 ? 158 GLY L C 1 +ATOM 4387 O O . GLY C 3 160 ? -26.809 -5.966 -12.361 1.00 34.73 ? 158 GLY L O 1 +ATOM 4388 N N . ASN C 3 161 ? -24.768 -5.559 -11.509 1.00 27.63 ? 159 ASN L N 1 +ATOM 4389 C CA . ASN C 3 161 ? -24.103 -6.195 -12.643 1.00 28.37 ? 159 ASN L CA 1 +ATOM 4390 C C . ASN C 3 161 ? -23.143 -7.297 -12.202 1.00 27.52 ? 159 ASN L C 1 +ATOM 4391 O O . ASN C 3 161 ? -22.178 -7.599 -12.908 1.00 26.03 ? 159 ASN L O 1 +ATOM 4392 C CB . ASN C 3 161 ? -23.370 -5.167 -13.507 1.00 31.04 ? 159 ASN L CB 1 +ATOM 4393 C CG . ASN C 3 161 ? -22.503 -4.209 -12.697 1.00 30.84 ? 159 ASN L CG 1 +ATOM 4394 O OD1 . ASN C 3 161 ? -22.323 -4.368 -11.486 1.00 33.43 ? 159 ASN L OD1 1 +ATOM 4395 N ND2 . ASN C 3 161 ? -21.965 -3.193 -13.372 1.00 32.93 ? 159 ASN L ND2 1 +ATOM 4396 N N . SER C 3 162 ? -23.414 -7.938 -11.067 1.00 23.99 ? 160 SER L N 1 +ATOM 4397 C CA . SER C 3 162 ? -22.594 -9.053 -10.620 1.00 25.15 ? 160 SER L CA 1 +ATOM 4398 C C . SER C 3 162 ? -23.473 -10.189 -10.127 1.00 30.94 ? 160 SER L C 1 +ATOM 4399 O O . SER C 3 162 ? -24.634 -9.999 -9.748 1.00 28.01 ? 160 SER L O 1 +ATOM 4400 C CB . SER C 3 162 ? -21.590 -8.632 -9.528 1.00 29.87 ? 160 SER L CB 1 +ATOM 4401 O OG . SER C 3 162 ? -22.234 -8.076 -8.397 1.00 32.86 ? 160 SER L OG 1 +ATOM 4402 N N . GLN C 3 163 ? -22.900 -11.388 -10.159 1.00 24.63 ? 161 GLN L N 1 +ATOM 4403 C CA . GLN C 3 163 ? -23.521 -12.586 -9.615 1.00 23.66 ? 161 GLN L CA 1 +ATOM 4404 C C . GLN C 3 163 ? -22.452 -13.359 -8.869 1.00 28.52 ? 161 GLN L C 1 +ATOM 4405 O O . GLN C 3 163 ? -21.284 -13.335 -9.255 1.00 27.71 ? 161 GLN L O 1 +ATOM 4406 C CB . GLN C 3 163 ? -24.124 -13.484 -10.708 1.00 25.18 ? 161 GLN L CB 1 +ATOM 4407 C CG . GLN C 3 163 ? -25.332 -12.909 -11.401 1.00 29.94 ? 161 GLN L CG 1 +ATOM 4408 C CD . GLN C 3 163 ? -25.967 -13.906 -12.350 1.00 37.90 ? 161 GLN L CD 1 +ATOM 4409 O OE1 . GLN C 3 163 ? -25.482 -14.111 -13.467 1.00 30.77 ? 161 GLN L OE1 1 +ATOM 4410 N NE2 . GLN C 3 163 ? -27.055 -14.540 -11.908 1.00 30.81 ? 161 GLN L NE2 1 +ATOM 4411 N N . GLU C 3 164 ? -22.850 -14.057 -7.808 1.00 25.40 ? 162 GLU L N 1 +ATOM 4412 C CA . GLU C 3 164 ? -21.873 -14.822 -7.048 1.00 26.38 ? 162 GLU L CA 1 +ATOM 4413 C C . GLU C 3 164 ? -22.420 -16.193 -6.689 1.00 33.71 ? 162 GLU L C 1 +ATOM 4414 O O . GLU C 3 164 ? -23.629 -16.436 -6.708 1.00 26.17 ? 162 GLU L O 1 +ATOM 4415 C CB . GLU C 3 164 ? -21.459 -14.088 -5.780 1.00 24.96 ? 162 GLU L CB 1 +ATOM 4416 C CG . GLU C 3 164 ? -22.580 -13.792 -4.829 1.00 28.60 ? 162 GLU L CG 1 +ATOM 4417 C CD . GLU C 3 164 ? -22.065 -13.207 -3.517 1.00 42.11 ? 162 GLU L CD 1 +ATOM 4418 O OE1 . GLU C 3 164 ? -22.476 -13.695 -2.442 1.00 46.55 ? 162 GLU L OE1 1 +ATOM 4419 O OE2 . GLU C 3 164 ? -21.240 -12.261 -3.569 1.00 35.40 ? 162 GLU L OE2 1 +ATOM 4420 N N . SER C 3 165 ? -21.502 -17.075 -6.302 1.00 23.48 ? 163 SER L N 1 +ATOM 4421 C CA . SER C 3 165 ? -21.825 -18.456 -6.001 1.00 22.57 ? 163 SER L CA 1 +ATOM 4422 C C . SER C 3 165 ? -20.832 -18.939 -4.943 1.00 24.55 ? 163 SER L C 1 +ATOM 4423 O O . SER C 3 165 ? -19.700 -18.456 -4.891 1.00 26.32 ? 163 SER L O 1 +ATOM 4424 C CB . SER C 3 165 ? -21.803 -19.226 -7.331 1.00 32.49 ? 163 SER L CB 1 +ATOM 4425 O OG . SER C 3 165 ? -21.382 -20.544 -7.245 1.00 38.29 ? 163 SER L OG 1 +ATOM 4426 N N . VAL C 3 166 ? -21.279 -19.842 -4.053 1.00 22.46 ? 164 VAL L N 1 +ATOM 4427 C CA A VAL C 3 166 ? -20.495 -20.279 -2.893 0.62 23.95 ? 164 VAL L CA 1 +ATOM 4428 C CA B VAL C 3 166 ? -20.472 -20.282 -2.915 0.38 24.30 ? 164 VAL L CA 1 +ATOM 4429 C C . VAL C 3 166 ? -20.456 -21.804 -2.868 1.00 28.24 ? 164 VAL L C 1 +ATOM 4430 O O . VAL C 3 166 ? -21.468 -22.459 -3.125 1.00 27.21 ? 164 VAL L O 1 +ATOM 4431 C CB A VAL C 3 166 ? -21.097 -19.733 -1.573 0.62 26.97 ? 164 VAL L CB 1 +ATOM 4432 C CB B VAL C 3 166 ? -20.989 -19.713 -1.572 0.38 27.05 ? 164 VAL L CB 1 +ATOM 4433 C CG1 A VAL C 3 166 ? -20.220 -20.071 -0.372 0.62 20.09 ? 164 VAL L CG1 1 +ATOM 4434 C CG1 B VAL C 3 166 ? -20.980 -18.201 -1.593 0.38 30.88 ? 164 VAL L CG1 1 +ATOM 4435 C CG2 A VAL C 3 166 ? -21.307 -18.233 -1.662 0.62 32.84 ? 164 VAL L CG2 1 +ATOM 4436 C CG2 B VAL C 3 166 ? -22.381 -20.234 -1.253 0.38 26.09 ? 164 VAL L CG2 1 +ATOM 4437 N N . THR C 3 167 ? -19.297 -22.368 -2.540 1.00 22.92 ? 165 THR L N 1 +ATOM 4438 C CA . THR C 3 167 ? -19.239 -23.817 -2.439 1.00 20.56 ? 165 THR L CA 1 +ATOM 4439 C C . THR C 3 167 ? -19.857 -24.281 -1.117 1.00 27.42 ? 165 THR L C 1 +ATOM 4440 O O . THR C 3 167 ? -20.105 -23.492 -0.193 1.00 26.64 ? 165 THR L O 1 +ATOM 4441 C CB . THR C 3 167 ? -17.802 -24.323 -2.536 1.00 27.15 ? 165 THR L CB 1 +ATOM 4442 O OG1 . THR C 3 167 ? -17.020 -23.695 -1.514 1.00 30.04 ? 165 THR L OG1 1 +ATOM 4443 C CG2 . THR C 3 167 ? -17.208 -24.025 -3.919 1.00 25.18 ? 165 THR L CG2 1 +ATOM 4444 N N . GLU C 3 168 ? -20.122 -25.584 -1.044 1.00 26.28 ? 166 GLU L N 1 +ATOM 4445 C CA . GLU C 3 168 ? -20.457 -26.211 0.224 1.00 25.73 ? 166 GLU L CA 1 +ATOM 4446 C C . GLU C 3 168 ? -19.188 -26.336 1.058 1.00 29.25 ? 166 GLU L C 1 +ATOM 4447 O O . GLU C 3 168 ? -18.075 -26.233 0.542 1.00 25.98 ? 166 GLU L O 1 +ATOM 4448 C CB . GLU C 3 168 ? -21.078 -27.593 -0.001 1.00 32.08 ? 166 GLU L CB 1 +ATOM 4449 C CG . GLU C 3 168 ? -22.404 -27.559 -0.767 1.00 34.21 ? 166 GLU L CG 1 +ATOM 4450 C CD . GLU C 3 168 ? -23.469 -26.770 -0.015 1.00 46.60 ? 166 GLU L CD 1 +ATOM 4451 O OE1 . GLU C 3 168 ? -23.848 -25.667 -0.476 1.00 43.66 ? 166 GLU L OE1 1 +ATOM 4452 O OE2 . GLU C 3 168 ? -23.915 -27.249 1.050 1.00 53.99 ? 166 GLU L OE2 1 +ATOM 4453 N N . GLN C 3 169 ? -19.358 -26.577 2.356 1.00 25.90 ? 167 GLN L N 1 +ATOM 4454 C CA . GLN C 3 169 ? -18.198 -26.696 3.243 1.00 25.44 ? 167 GLN L CA 1 +ATOM 4455 C C . GLN C 3 169 ? -17.234 -27.760 2.747 1.00 29.26 ? 167 GLN L C 1 +ATOM 4456 O O . GLN C 3 169 ? -17.641 -28.875 2.414 1.00 28.28 ? 167 GLN L O 1 +ATOM 4457 C CB . GLN C 3 169 ? -18.642 -27.049 4.655 1.00 31.03 ? 167 GLN L CB 1 +ATOM 4458 C CG . GLN C 3 169 ? -19.047 -25.868 5.474 1.00 35.36 ? 167 GLN L CG 1 +ATOM 4459 C CD . GLN C 3 169 ? -19.267 -26.259 6.915 1.00 36.75 ? 167 GLN L CD 1 +ATOM 4460 O OE1 . GLN C 3 169 ? -20.184 -27.031 7.217 1.00 29.22 ? 167 GLN L OE1 1 +ATOM 4461 N NE2 . GLN C 3 169 ? -18.421 -25.748 7.811 1.00 29.26 ? 167 GLN L NE2 1 +ATOM 4462 N N . ASP C 3 170 ? -15.953 -27.412 2.704 1.00 26.62 ? 168 ASP L N 1 +ATOM 4463 C CA . ASP C 3 170 ? -14.932 -28.357 2.270 1.00 29.70 ? 168 ASP L CA 1 +ATOM 4464 C C . ASP C 3 170 ? -14.894 -29.572 3.189 1.00 39.94 ? 168 ASP L C 1 +ATOM 4465 O O . ASP C 3 170 ? -15.003 -29.451 4.413 1.00 35.86 ? 168 ASP L O 1 +ATOM 4466 C CB . ASP C 3 170 ? -13.568 -27.670 2.246 1.00 31.76 ? 168 ASP L CB 1 +ATOM 4467 C CG . ASP C 3 170 ? -12.463 -28.577 1.716 1.00 43.64 ? 168 ASP L CG 1 +ATOM 4468 O OD1 . ASP C 3 170 ? -12.249 -28.591 0.488 1.00 47.19 ? 168 ASP L OD1 1 +ATOM 4469 O OD2 . ASP C 3 170 ? -11.813 -29.263 2.531 1.00 44.66 ? 168 ASP L OD2 1 +ATOM 4470 N N . SER C 3 171 ? -14.716 -30.756 2.592 1.00 35.99 ? 169 SER L N 1 +ATOM 4471 C CA . SER C 3 171 ? -14.828 -31.985 3.369 1.00 42.99 ? 169 SER L CA 1 +ATOM 4472 C C . SER C 3 171 ? -13.652 -32.182 4.315 1.00 44.84 ? 169 SER L C 1 +ATOM 4473 O O . SER C 3 171 ? -13.785 -32.913 5.300 1.00 50.76 ? 169 SER L O 1 +ATOM 4474 C CB . SER C 3 171 ? -14.958 -33.196 2.440 1.00 49.68 ? 169 SER L CB 1 +ATOM 4475 O OG . SER C 3 171 ? -13.908 -33.223 1.487 1.00 59.70 ? 169 SER L OG 1 +ATOM 4476 N N . LYS C 3 172 ? -12.511 -31.551 4.045 1.00 40.93 ? 170 LYS L N 1 +ATOM 4477 C CA . LYS C 3 172 ? -11.333 -31.688 4.890 1.00 50.03 ? 170 LYS L CA 1 +ATOM 4478 C C . LYS C 3 172 ? -11.184 -30.564 5.907 1.00 47.58 ? 170 LYS L C 1 +ATOM 4479 O O . LYS C 3 172 ? -10.858 -30.839 7.064 1.00 48.32 ? 170 LYS L O 1 +ATOM 4480 C CB . LYS C 3 172 ? -10.065 -31.768 4.031 1.00 56.66 ? 170 LYS L CB 1 +ATOM 4481 C CG . LYS C 3 172 ? -9.983 -33.021 3.164 1.00 70.88 ? 170 LYS L CG 1 +ATOM 4482 C CD . LYS C 3 172 ? -8.591 -33.218 2.575 1.00 81.41 ? 170 LYS L CD 1 +ATOM 4483 C CE . LYS C 3 172 ? -8.458 -34.575 1.892 1.00 85.71 ? 170 LYS L CE 1 +ATOM 4484 N NZ . LYS C 3 172 ? -9.528 -34.807 0.882 1.00 85.89 ? 170 LYS L NZ 1 +ATOM 4485 N N . ASP C 3 173 ? -11.416 -29.302 5.522 1.00 36.70 ? 171 ASP L N 1 +ATOM 4486 C CA . ASP C 3 173 ? -11.152 -28.181 6.420 1.00 38.59 ? 171 ASP L CA 1 +ATOM 4487 C C . ASP C 3 173 ? -12.378 -27.349 6.770 1.00 34.08 ? 171 ASP L C 1 +ATOM 4488 O O . ASP C 3 173 ? -12.232 -26.351 7.486 1.00 31.79 ? 171 ASP L O 1 +ATOM 4489 C CB . ASP C 3 173 ? -10.050 -27.272 5.842 1.00 37.55 ? 171 ASP L CB 1 +ATOM 4490 C CG . ASP C 3 173 ? -10.476 -26.507 4.573 1.00 42.22 ? 171 ASP L CG 1 +ATOM 4491 O OD1 . ASP C 3 173 ? -11.683 -26.367 4.281 1.00 37.27 ? 171 ASP L OD1 1 +ATOM 4492 O OD2 . ASP C 3 173 ? -9.569 -26.037 3.844 1.00 43.42 ? 171 ASP L OD2 1 +ATOM 4493 N N . SER C 3 174 ? -13.564 -27.703 6.263 1.00 28.39 ? 172 SER L N 1 +ATOM 4494 C CA . SER C 3 174 ? -14.832 -27.081 6.635 1.00 30.66 ? 172 SER L CA 1 +ATOM 4495 C C . SER C 3 174 ? -14.914 -25.602 6.247 1.00 29.84 ? 172 SER L C 1 +ATOM 4496 O O . SER C 3 174 ? -15.752 -24.871 6.780 1.00 26.15 ? 172 SER L O 1 +ATOM 4497 C CB . SER C 3 174 ? -15.111 -27.256 8.136 1.00 34.60 ? 172 SER L CB 1 +ATOM 4498 O OG . SER C 3 174 ? -15.200 -28.630 8.481 1.00 31.91 ? 172 SER L OG 1 +ATOM 4499 N N . THR C 3 175 ? -14.071 -25.133 5.322 1.00 25.95 ? 173 THR L N 1 +ATOM 4500 C CA . THR C 3 175 ? -14.171 -23.760 4.851 1.00 23.93 ? 173 THR L CA 1 +ATOM 4501 C C . THR C 3 175 ? -15.099 -23.663 3.647 1.00 22.78 ? 173 THR L C 1 +ATOM 4502 O O . THR C 3 175 ? -15.525 -24.662 3.066 1.00 25.41 ? 173 THR L O 1 +ATOM 4503 C CB . THR C 3 175 ? -12.802 -23.195 4.452 1.00 22.53 ? 173 THR L CB 1 +ATOM 4504 O OG1 . THR C 3 175 ? -12.234 -24.002 3.407 1.00 28.08 ? 173 THR L OG1 1 +ATOM 4505 C CG2 . THR C 3 175 ? -11.838 -23.142 5.664 1.00 23.79 ? 173 THR L CG2 1 +ATOM 4506 N N . TYR C 3 176 ? -15.384 -22.427 3.266 1.00 23.20 ? 174 TYR L N 1 +ATOM 4507 C CA . TYR C 3 176 ? -16.121 -22.082 2.062 1.00 22.10 ? 174 TYR L CA 1 +ATOM 4508 C C . TYR C 3 176 ? -15.194 -21.375 1.085 1.00 24.94 ? 174 TYR L C 1 +ATOM 4509 O O . TYR C 3 176 ? -14.164 -20.818 1.469 1.00 22.59 ? 174 TYR L O 1 +ATOM 4510 C CB . TYR C 3 176 ? -17.282 -21.146 2.381 1.00 23.18 ? 174 TYR L CB 1 +ATOM 4511 C CG . TYR C 3 176 ? -18.192 -21.651 3.473 1.00 26.70 ? 174 TYR L CG 1 +ATOM 4512 C CD1 . TYR C 3 176 ? -17.931 -21.362 4.806 1.00 27.24 ? 174 TYR L CD1 1 +ATOM 4513 C CD2 . TYR C 3 176 ? -19.312 -22.414 3.172 1.00 26.54 ? 174 TYR L CD2 1 +ATOM 4514 C CE1 . TYR C 3 176 ? -18.770 -21.821 5.820 1.00 31.48 ? 174 TYR L CE1 1 +ATOM 4515 C CE2 . TYR C 3 176 ? -20.164 -22.873 4.182 1.00 33.15 ? 174 TYR L CE2 1 +ATOM 4516 C CZ . TYR C 3 176 ? -19.876 -22.579 5.503 1.00 34.46 ? 174 TYR L CZ 1 +ATOM 4517 O OH . TYR C 3 176 ? -20.694 -23.024 6.525 1.00 33.48 ? 174 TYR L OH 1 +ATOM 4518 N N . SER C 3 177 ? -15.589 -21.383 -0.182 1.00 25.43 ? 175 SER L N 1 +ATOM 4519 C CA . SER C 3 177 ? -15.005 -20.509 -1.178 1.00 25.55 ? 175 SER L CA 1 +ATOM 4520 C C . SER C 3 177 ? -16.133 -19.842 -1.953 1.00 28.57 ? 175 SER L C 1 +ATOM 4521 O O . SER C 3 177 ? -17.242 -20.374 -2.056 1.00 24.78 ? 175 SER L O 1 +ATOM 4522 C CB . SER C 3 177 ? -14.044 -21.280 -2.113 1.00 24.47 ? 175 SER L CB 1 +ATOM 4523 O OG . SER C 3 177 ? -12.973 -21.824 -1.340 1.00 27.28 ? 175 SER L OG 1 +ATOM 4524 N N . LEU C 3 178 ? -15.855 -18.651 -2.462 1.00 22.68 ? 176 LEU L N 1 +ATOM 4525 C CA . LEU C 3 178 ? -16.879 -17.834 -3.102 1.00 23.83 ? 176 LEU L CA 1 +ATOM 4526 C C . LEU C 3 178 ? -16.309 -17.261 -4.389 1.00 24.32 ? 176 LEU L C 1 +ATOM 4527 O O . LEU C 3 178 ? -15.152 -16.837 -4.428 1.00 23.24 ? 176 LEU L O 1 +ATOM 4528 C CB . LEU C 3 178 ? -17.344 -16.700 -2.169 1.00 24.23 ? 176 LEU L CB 1 +ATOM 4529 C CG . LEU C 3 178 ? -18.425 -15.724 -2.678 1.00 28.91 ? 176 LEU L CG 1 +ATOM 4530 C CD1 . LEU C 3 178 ? -19.219 -15.144 -1.504 1.00 30.11 ? 176 LEU L CD1 1 +ATOM 4531 C CD2 . LEU C 3 178 ? -17.865 -14.584 -3.544 1.00 26.31 ? 176 LEU L CD2 1 +ATOM 4532 N N . SER C 3 179 ? -17.121 -17.219 -5.440 1.00 21.76 ? 177 SER L N 1 +ATOM 4533 C CA . SER C 3 179 ? -16.679 -16.594 -6.678 1.00 25.41 ? 177 SER L CA 1 +ATOM 4534 C C . SER C 3 179 ? -17.748 -15.600 -7.113 1.00 34.30 ? 177 SER L C 1 +ATOM 4535 O O . SER C 3 179 ? -18.937 -15.933 -7.133 1.00 28.09 ? 177 SER L O 1 +ATOM 4536 C CB . SER C 3 179 ? -16.410 -17.655 -7.760 1.00 36.11 ? 177 SER L CB 1 +ATOM 4537 O OG . SER C 3 179 ? -16.566 -17.143 -9.065 1.00 47.07 ? 177 SER L OG 1 +ATOM 4538 N N . SER C 3 180 ? -17.330 -14.377 -7.418 1.00 23.22 ? 178 SER L N 1 +ATOM 4539 C CA . SER C 3 180 ? -18.215 -13.323 -7.899 1.00 24.92 ? 178 SER L CA 1 +ATOM 4540 C C . SER C 3 180 ? -17.768 -12.885 -9.285 1.00 28.70 ? 178 SER L C 1 +ATOM 4541 O O . SER C 3 180 ? -16.567 -12.742 -9.540 1.00 27.57 ? 178 SER L O 1 +ATOM 4542 C CB . SER C 3 180 ? -18.214 -12.136 -6.942 1.00 25.53 ? 178 SER L CB 1 +ATOM 4543 O OG . SER C 3 180 ? -19.030 -11.081 -7.428 1.00 28.52 ? 178 SER L OG 1 +ATOM 4544 N N . THR C 3 181 ? -18.726 -12.697 -10.189 1.00 24.09 ? 179 THR L N 1 +ATOM 4545 C CA . THR C 3 181 ? -18.433 -12.266 -11.552 1.00 25.09 ? 179 THR L CA 1 +ATOM 4546 C C . THR C 3 181 ? -19.107 -10.930 -11.820 1.00 26.91 ? 179 THR L C 1 +ATOM 4547 O O . THR C 3 181 ? -20.330 -10.807 -11.678 1.00 24.75 ? 179 THR L O 1 +ATOM 4548 C CB . THR C 3 181 ? -18.902 -13.299 -12.580 1.00 31.54 ? 179 THR L CB 1 +ATOM 4549 O OG1 . THR C 3 181 ? -18.316 -14.567 -12.271 1.00 32.44 ? 179 THR L OG1 1 +ATOM 4550 C CG2 . THR C 3 181 ? -18.468 -12.887 -13.979 1.00 29.14 ? 179 THR L CG2 1 +ATOM 4551 N N . LEU C 3 182 ? -18.315 -9.949 -12.228 1.00 23.55 ? 180 LEU L N 1 +ATOM 4552 C CA . LEU C 3 182 ? -18.804 -8.661 -12.700 1.00 24.55 ? 180 LEU L CA 1 +ATOM 4553 C C . LEU C 3 182 ? -18.826 -8.708 -14.222 1.00 26.03 ? 180 LEU L C 1 +ATOM 4554 O O . LEU C 3 182 ? -17.801 -9.008 -14.845 1.00 27.25 ? 180 LEU L O 1 +ATOM 4555 C CB . LEU C 3 182 ? -17.892 -7.539 -12.196 1.00 27.85 ? 180 LEU L CB 1 +ATOM 4556 C CG . LEU C 3 182 ? -18.160 -6.112 -12.673 1.00 28.94 ? 180 LEU L CG 1 +ATOM 4557 C CD1 . LEU C 3 182 ? -19.386 -5.561 -11.988 1.00 29.39 ? 180 LEU L CD1 1 +ATOM 4558 C CD2 . LEU C 3 182 ? -16.941 -5.223 -12.381 1.00 26.43 ? 180 LEU L CD2 1 +ATOM 4559 N N . THR C 3 183 ? -19.979 -8.440 -14.825 1.00 30.07 ? 181 THR L N 1 +ATOM 4560 C CA . THR C 3 183 ? -20.113 -8.526 -16.274 1.00 28.43 ? 181 THR L CA 1 +ATOM 4561 C C . THR C 3 183 ? -20.401 -7.150 -16.860 1.00 32.66 ? 181 THR L C 1 +ATOM 4562 O O . THR C 3 183 ? -21.318 -6.457 -16.410 1.00 30.72 ? 181 THR L O 1 +ATOM 4563 C CB . THR C 3 183 ? -21.218 -9.503 -16.676 1.00 38.20 ? 181 THR L CB 1 +ATOM 4564 O OG1 . THR C 3 183 ? -20.965 -10.766 -16.059 1.00 41.10 ? 181 THR L OG1 1 +ATOM 4565 C CG2 . THR C 3 183 ? -21.226 -9.696 -18.187 1.00 39.68 ? 181 THR L CG2 1 +ATOM 4566 N N . LEU C 3 184 ? -19.599 -6.765 -17.846 1.00 30.45 ? 182 LEU L N 1 +ATOM 4567 C CA . LEU C 3 184 ? -19.734 -5.521 -18.588 1.00 34.45 ? 182 LEU L CA 1 +ATOM 4568 C C . LEU C 3 184 ? -19.610 -5.815 -20.071 1.00 36.87 ? 182 LEU L C 1 +ATOM 4569 O O . LEU C 3 184 ? -18.972 -6.790 -20.468 1.00 32.29 ? 182 LEU L O 1 +ATOM 4570 C CB . LEU C 3 184 ? -18.643 -4.502 -18.226 1.00 35.92 ? 182 LEU L CB 1 +ATOM 4571 C CG . LEU C 3 184 ? -18.326 -4.185 -16.776 1.00 51.96 ? 182 LEU L CG 1 +ATOM 4572 C CD1 . LEU C 3 184 ? -17.047 -4.890 -16.393 1.00 55.67 ? 182 LEU L CD1 1 +ATOM 4573 C CD2 . LEU C 3 184 ? -18.168 -2.691 -16.638 1.00 58.87 ? 182 LEU L CD2 1 +ATOM 4574 N N . SER C 3 185 ? -20.194 -4.946 -20.891 1.00 34.76 ? 183 SER L N 1 +ATOM 4575 C CA . SER C 3 185 ? -19.906 -5.002 -22.312 1.00 35.37 ? 183 SER L CA 1 +ATOM 4576 C C . SER C 3 185 ? -18.454 -4.601 -22.560 1.00 33.01 ? 183 SER L C 1 +ATOM 4577 O O . SER C 3 185 ? -17.821 -3.919 -21.747 1.00 34.04 ? 183 SER L O 1 +ATOM 4578 C CB . SER C 3 185 ? -20.843 -4.075 -23.085 1.00 39.42 ? 183 SER L CB 1 +ATOM 4579 O OG . SER C 3 185 ? -20.507 -2.719 -22.844 1.00 43.22 ? 183 SER L OG 1 +ATOM 4580 N N . LYS C 3 186 ? -17.918 -5.033 -23.700 1.00 37.92 ? 184 LYS L N 1 +ATOM 4581 C CA . LYS C 3 186 ? -16.547 -4.654 -24.022 1.00 35.34 ? 184 LYS L CA 1 +ATOM 4582 C C . LYS C 3 186 ? -16.411 -3.139 -24.098 1.00 37.43 ? 184 LYS L C 1 +ATOM 4583 O O . LYS C 3 186 ? -15.452 -2.567 -23.566 1.00 37.94 ? 184 LYS L O 1 +ATOM 4584 C CB . LYS C 3 186 ? -16.105 -5.299 -25.333 1.00 41.16 ? 184 LYS L CB 1 +ATOM 4585 C CG . LYS C 3 186 ? -14.708 -4.881 -25.795 1.00 42.62 ? 184 LYS L CG 1 +ATOM 4586 C CD . LYS C 3 186 ? -14.437 -5.399 -27.205 1.00 51.42 ? 184 LYS L CD 1 +ATOM 4587 C CE . LYS C 3 186 ? -12.989 -5.203 -27.626 1.00 61.59 ? 184 LYS L CE 1 +ATOM 4588 N NZ . LYS C 3 186 ? -12.657 -3.772 -27.881 1.00 63.81 ? 184 LYS L NZ 1 +ATOM 4589 N N . ALA C 3 187 ? -17.379 -2.470 -24.728 1.00 42.61 ? 185 ALA L N 1 +ATOM 4590 C CA . ALA C 3 187 ? -17.320 -1.015 -24.843 1.00 44.74 ? 185 ALA L CA 1 +ATOM 4591 C C . ALA C 3 187 ? -17.339 -0.352 -23.474 1.00 45.27 ? 185 ALA L C 1 +ATOM 4592 O O . ALA C 3 187 ? -16.618 0.624 -23.241 1.00 44.48 ? 185 ALA L O 1 +ATOM 4593 C CB . ALA C 3 187 ? -18.476 -0.507 -25.700 1.00 43.78 ? 185 ALA L CB 1 +ATOM 4594 N N . ASP C 3 188 ? -18.142 -0.881 -22.546 1.00 39.03 ? 186 ASP L N 1 +ATOM 4595 C CA . ASP C 3 188 ? -18.174 -0.328 -21.194 1.00 44.25 ? 186 ASP L CA 1 +ATOM 4596 C C . ASP C 3 188 ? -16.880 -0.615 -20.446 1.00 39.06 ? 186 ASP L C 1 +ATOM 4597 O O . ASP C 3 188 ? -16.360 0.253 -19.733 1.00 42.38 ? 186 ASP L O 1 +ATOM 4598 C CB . ASP C 3 188 ? -19.365 -0.894 -20.422 1.00 53.25 ? 186 ASP L CB 1 +ATOM 4599 C CG . ASP C 3 188 ? -20.554 0.048 -20.406 1.00 70.23 ? 186 ASP L CG 1 +ATOM 4600 O OD1 . ASP C 3 188 ? -20.769 0.769 -21.405 1.00 74.32 ? 186 ASP L OD1 1 +ATOM 4601 O OD2 . ASP C 3 188 ? -21.276 0.067 -19.388 1.00 74.87 ? 186 ASP L OD2 1 +ATOM 4602 N N . TYR C 3 189 ? -16.356 -1.837 -20.578 1.00 34.53 ? 187 TYR L N 1 +ATOM 4603 C CA . TYR C 3 189 ? -15.099 -2.188 -19.922 1.00 32.08 ? 187 TYR L CA 1 +ATOM 4604 C C . TYR C 3 189 ? -13.979 -1.234 -20.321 1.00 37.54 ? 187 TYR L C 1 +ATOM 4605 O O . TYR C 3 189 ? -13.137 -0.868 -19.494 1.00 35.51 ? 187 TYR L O 1 +ATOM 4606 C CB . TYR C 3 189 ? -14.726 -3.630 -20.269 1.00 32.42 ? 187 TYR L CB 1 +ATOM 4607 C CG . TYR C 3 189 ? -13.398 -4.107 -19.727 1.00 28.79 ? 187 TYR L CG 1 +ATOM 4608 C CD1 . TYR C 3 189 ? -13.216 -4.329 -18.372 1.00 27.83 ? 187 TYR L CD1 1 +ATOM 4609 C CD2 . TYR C 3 189 ? -12.336 -4.373 -20.578 1.00 29.53 ? 187 TYR L CD2 1 +ATOM 4610 C CE1 . TYR C 3 189 ? -12.010 -4.785 -17.873 1.00 27.49 ? 187 TYR L CE1 1 +ATOM 4611 C CE2 . TYR C 3 189 ? -11.125 -4.837 -20.089 1.00 31.36 ? 187 TYR L CE2 1 +ATOM 4612 C CZ . TYR C 3 189 ? -10.963 -5.031 -18.744 1.00 33.99 ? 187 TYR L CZ 1 +ATOM 4613 O OH . TYR C 3 189 ? -9.754 -5.492 -18.270 1.00 33.16 ? 187 TYR L OH 1 +ATOM 4614 N N . GLU C 3 190 ? -13.959 -0.810 -21.580 1.00 39.94 ? 188 GLU L N 1 +ATOM 4615 C CA . GLU C 3 190 ? -12.880 0.041 -22.063 1.00 43.71 ? 188 GLU L CA 1 +ATOM 4616 C C . GLU C 3 190 ? -13.054 1.504 -21.687 1.00 39.84 ? 188 GLU L C 1 +ATOM 4617 O O . GLU C 3 190 ? -12.164 2.308 -21.982 1.00 43.83 ? 188 GLU L O 1 +ATOM 4618 C CB . GLU C 3 190 ? -12.747 -0.096 -23.577 1.00 43.53 ? 188 GLU L CB 1 +ATOM 4619 C CG . GLU C 3 190 ? -12.168 -1.430 -23.994 1.00 54.73 ? 188 GLU L CG 1 +ATOM 4620 C CD . GLU C 3 190 ? -12.282 -1.671 -25.484 1.00 71.97 ? 188 GLU L CD 1 +ATOM 4621 O OE1 . GLU C 3 190 ? -13.177 -1.070 -26.119 1.00 78.47 ? 188 GLU L OE1 1 +ATOM 4622 O OE2 . GLU C 3 190 ? -11.482 -2.465 -26.020 1.00 76.48 ? 188 GLU L OE2 1 +ATOM 4623 N N . LYS C 3 191 ? -14.151 1.872 -21.036 1.00 39.00 ? 189 LYS L N 1 +ATOM 4624 C CA . LYS C 3 191 ? -14.336 3.241 -20.578 1.00 43.83 ? 189 LYS L CA 1 +ATOM 4625 C C . LYS C 3 191 ? -13.754 3.492 -19.191 1.00 47.97 ? 189 LYS L C 1 +ATOM 4626 O O . LYS C 3 191 ? -13.810 4.629 -18.709 1.00 46.55 ? 189 LYS L O 1 +ATOM 4627 C CB . LYS C 3 191 ? -15.820 3.606 -20.584 1.00 49.01 ? 189 LYS L CB 1 +ATOM 4628 C CG . LYS C 3 191 ? -16.431 3.663 -21.978 1.00 60.87 ? 189 LYS L CG 1 +ATOM 4629 C CD . LYS C 3 191 ? -17.954 3.590 -21.936 1.00 68.82 ? 189 LYS L CD 1 +ATOM 4630 C CE . LYS C 3 191 ? -18.512 4.010 -20.583 1.00 72.99 ? 189 LYS L CE 1 +ATOM 4631 N NZ . LYS C 3 191 ? -19.944 3.638 -20.438 1.00 80.45 ? 189 LYS L NZ 1 +ATOM 4632 N N . HIS C 3 192 ? -13.187 2.478 -18.543 1.00 40.14 ? 190 HIS L N 1 +ATOM 4633 C CA . HIS C 3 192 ? -12.702 2.632 -17.179 1.00 39.68 ? 190 HIS L CA 1 +ATOM 4634 C C . HIS C 3 192 ? -11.354 1.954 -17.016 1.00 33.13 ? 190 HIS L C 1 +ATOM 4635 O O . HIS C 3 192 ? -10.986 1.067 -17.785 1.00 37.47 ? 190 HIS L O 1 +ATOM 4636 C CB . HIS C 3 192 ? -13.693 2.055 -16.174 1.00 35.53 ? 190 HIS L CB 1 +ATOM 4637 C CG . HIS C 3 192 ? -15.071 2.607 -16.325 1.00 40.11 ? 190 HIS L CG 1 +ATOM 4638 N ND1 . HIS C 3 192 ? -15.387 3.908 -16.000 1.00 50.03 ? 190 HIS L ND1 1 +ATOM 4639 C CD2 . HIS C 3 192 ? -16.211 2.043 -16.786 1.00 47.31 ? 190 HIS L CD2 1 +ATOM 4640 C CE1 . HIS C 3 192 ? -16.668 4.118 -16.243 1.00 50.80 ? 190 HIS L CE1 1 +ATOM 4641 N NE2 . HIS C 3 192 ? -17.191 3.002 -16.718 1.00 50.81 ? 190 HIS L NE2 1 +ATOM 4642 N N . LYS C 3 193 ? -10.639 2.356 -15.969 1.00 32.63 ? 191 LYS L N 1 +ATOM 4643 C CA . LYS C 3 193 ? -9.271 1.911 -15.748 1.00 36.23 ? 191 LYS L CA 1 +ATOM 4644 C C . LYS C 3 193 ? -9.119 0.957 -14.572 1.00 34.88 ? 191 LYS L C 1 +ATOM 4645 O O . LYS C 3 193 ? -8.533 -0.116 -14.729 1.00 37.16 ? 191 LYS L O 1 +ATOM 4646 C CB . LYS C 3 193 ? -8.345 3.121 -15.545 1.00 39.45 ? 191 LYS L CB 1 +ATOM 4647 C CG . LYS C 3 193 ? -6.873 2.730 -15.446 1.00 44.19 ? 191 LYS L CG 1 +ATOM 4648 C CD . LYS C 3 193 ? -5.993 3.911 -15.044 1.00 59.89 ? 191 LYS L CD 1 +ATOM 4649 C CE . LYS C 3 193 ? -5.068 3.553 -13.885 1.00 64.98 ? 191 LYS L CE 1 +ATOM 4650 N NZ . LYS C 3 193 ? -3.841 4.401 -13.856 1.00 64.97 ? 191 LYS L NZ 1 +ATOM 4651 N N . VAL C 3 194 ? -9.611 1.318 -13.389 1.00 32.82 ? 192 VAL L N 1 +ATOM 4652 C CA . VAL C 3 194 ? -9.299 0.588 -12.163 1.00 28.97 ? 192 VAL L CA 1 +ATOM 4653 C C . VAL C 3 194 ? -10.456 -0.338 -11.823 1.00 35.65 ? 192 VAL L C 1 +ATOM 4654 O O . VAL C 3 194 ? -11.574 0.124 -11.563 1.00 32.33 ? 192 VAL L O 1 +ATOM 4655 C CB . VAL C 3 194 ? -9.008 1.541 -10.997 1.00 28.88 ? 192 VAL L CB 1 +ATOM 4656 C CG1 . VAL C 3 194 ? -8.646 0.730 -9.761 1.00 31.75 ? 192 VAL L CG1 1 +ATOM 4657 C CG2 . VAL C 3 194 ? -7.895 2.522 -11.372 1.00 34.46 ? 192 VAL L CG2 1 +ATOM 4658 N N . TYR C 3 195 ? -10.181 -1.641 -11.807 1.00 32.04 ? 193 TYR L N 1 +ATOM 4659 C CA . TYR C 3 195 ? -11.161 -2.672 -11.470 1.00 28.90 ? 193 TYR L CA 1 +ATOM 4660 C C . TYR C 3 195 ? -10.758 -3.310 -10.147 1.00 28.92 ? 193 TYR L C 1 +ATOM 4661 O O . TYR C 3 195 ? -9.633 -3.798 -10.006 1.00 28.99 ? 193 TYR L O 1 +ATOM 4662 C CB . TYR C 3 195 ? -11.250 -3.712 -12.589 1.00 27.52 ? 193 TYR L CB 1 +ATOM 4663 C CG . TYR C 3 195 ? -11.938 -3.138 -13.798 1.00 28.62 ? 193 TYR L CG 1 +ATOM 4664 C CD1 . TYR C 3 195 ? -11.235 -2.366 -14.723 1.00 30.85 ? 193 TYR L CD1 1 +ATOM 4665 C CD2 . TYR C 3 195 ? -13.304 -3.297 -13.978 1.00 26.91 ? 193 TYR L CD2 1 +ATOM 4666 C CE1 . TYR C 3 195 ? -11.879 -1.797 -15.816 1.00 32.58 ? 193 TYR L CE1 1 +ATOM 4667 C CE2 . TYR C 3 195 ? -13.953 -2.745 -15.069 1.00 27.77 ? 193 TYR L CE2 1 +ATOM 4668 C CZ . TYR C 3 195 ? -13.238 -1.992 -15.979 1.00 33.11 ? 193 TYR L CZ 1 +ATOM 4669 O OH . TYR C 3 195 ? -13.898 -1.438 -17.052 1.00 32.98 ? 193 TYR L OH 1 +ATOM 4670 N N . ALA C 3 196 ? -11.667 -3.303 -9.175 1.00 28.94 ? 194 ALA L N 1 +ATOM 4671 C CA . ALA C 3 196 ? -11.302 -3.723 -7.834 1.00 28.25 ? 194 ALA L CA 1 +ATOM 4672 C C . ALA C 3 196 ? -12.443 -4.490 -7.190 1.00 30.46 ? 194 ALA L C 1 +ATOM 4673 O O . ALA C 3 196 ? -13.617 -4.197 -7.422 1.00 28.04 ? 194 ALA L O 1 +ATOM 4674 C CB . ALA C 3 196 ? -10.951 -2.520 -6.961 1.00 28.11 ? 194 ALA L CB 1 +ATOM 4675 N N . CYS C 3 197 ? -12.107 -5.487 -6.384 1.00 27.61 ? 195 CYS L N 1 +ATOM 4676 C CA A CYS C 3 197 ? -13.096 -6.119 -5.525 0.01 33.22 ? 195 CYS L CA 1 +ATOM 4677 C CA B CYS C 3 197 ? -13.097 -6.116 -5.521 0.99 28.58 ? 195 CYS L CA 1 +ATOM 4678 C C . CYS C 3 197 ? -12.626 -5.983 -4.086 1.00 33.14 ? 195 CYS L C 1 +ATOM 4679 O O . CYS C 3 197 ? -11.475 -6.308 -3.765 1.00 30.20 ? 195 CYS L O 1 +ATOM 4680 C CB A CYS C 3 197 ? -13.369 -7.587 -5.905 0.01 37.44 ? 195 CYS L CB 1 +ATOM 4681 C CB B CYS C 3 197 ? -13.389 -7.583 -5.890 0.99 38.40 ? 195 CYS L CB 1 +ATOM 4682 S SG A CYS C 3 197 ? -12.019 -8.788 -5.809 0.01 40.06 ? 195 CYS L SG 1 +ATOM 4683 S SG B CYS C 3 197 ? -12.046 -8.754 -5.818 0.99 46.81 ? 195 CYS L SG 1 +ATOM 4684 N N . GLU C 3 198 ? -13.502 -5.448 -3.249 1.00 26.75 ? 196 GLU L N 1 +ATOM 4685 C CA . GLU C 3 198 ? -13.222 -5.190 -1.852 1.00 28.76 ? 196 GLU L CA 1 +ATOM 4686 C C . GLU C 3 198 ? -14.002 -6.200 -1.037 1.00 30.08 ? 196 GLU L C 1 +ATOM 4687 O O . GLU C 3 198 ? -15.219 -6.319 -1.202 1.00 32.37 ? 196 GLU L O 1 +ATOM 4688 C CB . GLU C 3 198 ? -13.631 -3.768 -1.476 1.00 32.60 ? 196 GLU L CB 1 +ATOM 4689 C CG . GLU C 3 198 ? -13.388 -3.408 -0.038 1.00 35.14 ? 196 GLU L CG 1 +ATOM 4690 C CD . GLU C 3 198 ? -14.168 -2.170 0.362 1.00 51.70 ? 196 GLU L CD 1 +ATOM 4691 O OE1 . GLU C 3 198 ? -15.418 -2.214 0.325 1.00 53.17 ? 196 GLU L OE1 1 +ATOM 4692 O OE2 . GLU C 3 198 ? -13.530 -1.153 0.692 1.00 57.93 ? 196 GLU L OE2 1 +ATOM 4693 N N . VAL C 3 199 ? -13.299 -6.930 -0.176 1.00 28.82 ? 197 VAL L N 1 +ATOM 4694 C CA . VAL C 3 199 ? -13.860 -8.048 0.570 1.00 30.14 ? 197 VAL L CA 1 +ATOM 4695 C C . VAL C 3 199 ? -13.887 -7.688 2.043 1.00 26.33 ? 197 VAL L C 1 +ATOM 4696 O O . VAL C 3 199 ? -12.866 -7.280 2.606 1.00 30.69 ? 197 VAL L O 1 +ATOM 4697 C CB . VAL C 3 199 ? -13.037 -9.328 0.350 1.00 30.70 ? 197 VAL L CB 1 +ATOM 4698 C CG1 . VAL C 3 199 ? -13.518 -10.427 1.276 1.00 27.86 ? 197 VAL L CG1 1 +ATOM 4699 C CG2 . VAL C 3 199 ? -13.116 -9.764 -1.099 1.00 28.22 ? 197 VAL L CG2 1 +ATOM 4700 N N . THR C 3 200 ? -15.042 -7.873 2.679 1.00 32.18 ? 198 THR L N 1 +ATOM 4701 C CA . THR C 3 200 ? -15.164 -7.720 4.122 1.00 35.60 ? 198 THR L CA 1 +ATOM 4702 C C . THR C 3 200 ? -15.564 -9.064 4.709 1.00 27.75 ? 198 THR L C 1 +ATOM 4703 O O . THR C 3 200 ? -16.432 -9.755 4.165 1.00 29.40 ? 198 THR L O 1 +ATOM 4704 C CB . THR C 3 200 ? -16.172 -6.622 4.507 1.00 42.89 ? 198 THR L CB 1 +ATOM 4705 O OG1 . THR C 3 200 ? -17.501 -7.079 4.252 1.00 58.96 ? 198 THR L OG1 1 +ATOM 4706 C CG2 . THR C 3 200 ? -15.922 -5.357 3.723 1.00 45.34 ? 198 THR L CG2 1 +ATOM 4707 N N . HIS C 3 201 ? -14.908 -9.442 5.799 1.00 28.69 ? 199 HIS L N 1 +ATOM 4708 C CA . HIS C 3 201 ? -15.100 -10.755 6.395 1.00 31.09 ? 199 HIS L CA 1 +ATOM 4709 C C . HIS C 3 201 ? -14.598 -10.685 7.825 1.00 33.35 ? 199 HIS L C 1 +ATOM 4710 O O . HIS C 3 201 ? -13.645 -9.960 8.120 1.00 36.41 ? 199 HIS L O 1 +ATOM 4711 C CB . HIS C 3 201 ? -14.358 -11.860 5.621 1.00 30.89 ? 199 HIS L CB 1 +ATOM 4712 C CG . HIS C 3 201 ? -14.593 -13.233 6.167 1.00 28.27 ? 199 HIS L CG 1 +ATOM 4713 N ND1 . HIS C 3 201 ? -13.763 -13.816 7.105 1.00 28.87 ? 199 HIS L ND1 1 +ATOM 4714 C CD2 . HIS C 3 201 ? -15.581 -14.130 5.927 1.00 26.70 ? 199 HIS L CD2 1 +ATOM 4715 C CE1 . HIS C 3 201 ? -14.230 -15.016 7.411 1.00 32.97 ? 199 HIS L CE1 1 +ATOM 4716 N NE2 . HIS C 3 201 ? -15.332 -15.230 6.711 1.00 28.61 ? 199 HIS L NE2 1 +ATOM 4717 N N . GLN C 3 202 ? -15.249 -11.455 8.704 1.00 32.72 ? 200 GLN L N 1 +ATOM 4718 C CA . GLN C 3 202 ? -14.900 -11.448 10.127 1.00 35.27 ? 200 GLN L CA 1 +ATOM 4719 C C . GLN C 3 202 ? -13.420 -11.737 10.368 1.00 38.66 ? 200 GLN L C 1 +ATOM 4720 O O . GLN C 3 202 ? -12.841 -11.253 11.350 1.00 37.86 ? 200 GLN L O 1 +ATOM 4721 C CB . GLN C 3 202 ? -15.778 -12.467 10.870 1.00 35.85 ? 200 GLN L CB 1 +ATOM 4722 C CG . GLN C 3 202 ? -15.593 -12.481 12.384 1.00 45.80 ? 200 GLN L CG 1 +ATOM 4723 C CD . GLN C 3 202 ? -16.493 -13.492 13.081 1.00 50.05 ? 200 GLN L CD 1 +ATOM 4724 O OE1 . GLN C 3 202 ? -17.464 -13.993 12.499 1.00 41.54 ? 200 GLN L OE1 1 +ATOM 4725 N NE2 . GLN C 3 202 ? -16.171 -13.798 14.336 1.00 49.17 ? 200 GLN L NE2 1 +ATOM 4726 N N . GLY C 3 203 ? -12.789 -12.512 9.488 1.00 35.27 ? 201 GLY L N 1 +ATOM 4727 C CA . GLY C 3 203 ? -11.375 -12.839 9.633 1.00 34.85 ? 201 GLY L CA 1 +ATOM 4728 C C . GLY C 3 203 ? -10.404 -11.745 9.230 1.00 38.12 ? 201 GLY L C 1 +ATOM 4729 O O . GLY C 3 203 ? -9.202 -11.875 9.489 1.00 39.62 ? 201 GLY L O 1 +ATOM 4730 N N . LEU C 3 204 ? -10.891 -10.672 8.614 1.00 35.64 ? 202 LEU L N 1 +ATOM 4731 C CA . LEU C 3 204 ? -10.069 -9.532 8.219 1.00 39.05 ? 202 LEU L CA 1 +ATOM 4732 C C . LEU C 3 204 ? -10.347 -8.359 9.149 1.00 39.59 ? 202 LEU L C 1 +ATOM 4733 O O . LEU C 3 204 ? -11.503 -7.946 9.301 1.00 44.01 ? 202 LEU L O 1 +ATOM 4734 C CB . LEU C 3 204 ? -10.367 -9.122 6.775 1.00 38.04 ? 202 LEU L CB 1 +ATOM 4735 C CG . LEU C 3 204 ? -10.385 -10.243 5.738 1.00 31.69 ? 202 LEU L CG 1 +ATOM 4736 C CD1 . LEU C 3 204 ? -11.188 -9.829 4.500 1.00 29.57 ? 202 LEU L CD1 1 +ATOM 4737 C CD2 . LEU C 3 204 ? -8.961 -10.613 5.359 1.00 32.53 ? 202 LEU L CD2 1 +ATOM 4738 N N . SER C 3 205 ? -9.293 -7.807 9.750 1.00 44.95 ? 203 SER L N 1 +ATOM 4739 C CA . SER C 3 205 ? -9.493 -6.662 10.634 1.00 53.84 ? 203 SER L CA 1 +ATOM 4740 C C . SER C 3 205 ? -9.989 -5.444 9.864 1.00 56.47 ? 203 SER L C 1 +ATOM 4741 O O . SER C 3 205 ? -10.719 -4.614 10.418 1.00 60.58 ? 203 SER L O 1 +ATOM 4742 C CB . SER C 3 205 ? -8.202 -6.328 11.381 1.00 51.51 ? 203 SER L CB 1 +ATOM 4743 O OG . SER C 3 205 ? -7.112 -6.237 10.487 1.00 58.85 ? 203 SER L OG 1 +ATOM 4744 N N . SER C 3 206 ? -9.613 -5.323 8.597 1.00 51.63 ? 204 SER L N 1 +ATOM 4745 C CA . SER C 3 206 ? -10.092 -4.275 7.711 1.00 50.91 ? 204 SER L CA 1 +ATOM 4746 C C . SER C 3 206 ? -10.318 -4.876 6.346 1.00 48.00 ? 204 SER L C 1 +ATOM 4747 O O . SER C 3 206 ? -9.696 -5.896 5.996 1.00 45.26 ? 204 SER L O 1 +ATOM 4748 C CB . SER C 3 206 ? -9.092 -3.110 7.623 1.00 56.18 ? 204 SER L CB 1 +ATOM 4749 O OG . SER C 3 206 ? -7.771 -3.596 7.469 1.00 66.87 ? 204 SER L OG 1 +ATOM 4750 N N . PRO C 3 207 ? -11.214 -4.309 5.532 1.00 41.25 ? 205 PRO L N 1 +ATOM 4751 C CA . PRO C 3 207 ? -11.513 -4.902 4.228 1.00 38.76 ? 205 PRO L CA 1 +ATOM 4752 C C . PRO C 3 207 ? -10.268 -4.997 3.354 1.00 36.59 ? 205 PRO L C 1 +ATOM 4753 O O . PRO C 3 207 ? -9.366 -4.161 3.423 1.00 37.79 ? 205 PRO L O 1 +ATOM 4754 C CB . PRO C 3 207 ? -12.553 -3.952 3.627 1.00 42.64 ? 205 PRO L CB 1 +ATOM 4755 C CG . PRO C 3 207 ? -13.191 -3.300 4.819 1.00 45.48 ? 205 PRO L CG 1 +ATOM 4756 C CD . PRO C 3 207 ? -12.094 -3.157 5.829 1.00 45.88 ? 205 PRO L CD 1 +ATOM 4757 N N . VAL C 3 208 ? -10.215 -6.048 2.539 1.00 33.18 ? 206 VAL L N 1 +ATOM 4758 C CA . VAL C 3 208 ? -9.090 -6.296 1.645 1.00 31.83 ? 206 VAL L CA 1 +ATOM 4759 C C . VAL C 3 208 ? -9.537 -5.977 0.226 1.00 36.68 ? 206 VAL L C 1 +ATOM 4760 O O . VAL C 3 208 ? -10.604 -6.426 -0.207 1.00 34.04 ? 206 VAL L O 1 +ATOM 4761 C CB . VAL C 3 208 ? -8.587 -7.746 1.754 1.00 38.83 ? 206 VAL L CB 1 +ATOM 4762 C CG1 . VAL C 3 208 ? -7.705 -8.099 0.568 1.00 41.06 ? 206 VAL L CG1 1 +ATOM 4763 C CG2 . VAL C 3 208 ? -7.826 -7.939 3.065 1.00 43.60 ? 206 VAL L CG2 1 +ATOM 4764 N N . THR C 3 209 ? -8.722 -5.216 -0.500 1.00 33.02 ? 207 THR L N 1 +ATOM 4765 C CA . THR C 3 209 ? -9.020 -4.876 -1.885 1.00 31.91 ? 207 THR L CA 1 +ATOM 4766 C C . THR C 3 209 ? -7.949 -5.452 -2.799 1.00 34.40 ? 207 THR L C 1 +ATOM 4767 O O . THR C 3 209 ? -6.753 -5.270 -2.558 1.00 32.51 ? 207 THR L O 1 +ATOM 4768 C CB . THR C 3 209 ? -9.114 -3.359 -2.082 1.00 39.41 ? 207 THR L CB 1 +ATOM 4769 O OG1 . THR C 3 209 ? -10.157 -2.831 -1.251 1.00 39.43 ? 207 THR L OG1 1 +ATOM 4770 C CG2 . THR C 3 209 ? -9.432 -3.032 -3.535 1.00 37.76 ? 207 THR L CG2 1 +ATOM 4771 N N . LYS C 3 210 ? -8.383 -6.154 -3.836 1.00 31.45 ? 208 LYS L N 1 +ATOM 4772 C CA . LYS C 3 210 ? -7.530 -6.580 -4.935 1.00 29.29 ? 208 LYS L CA 1 +ATOM 4773 C C . LYS C 3 210 ? -7.981 -5.851 -6.188 1.00 33.67 ? 208 LYS L C 1 +ATOM 4774 O O . LYS C 3 210 ? -9.180 -5.721 -6.442 1.00 28.38 ? 208 LYS L O 1 +ATOM 4775 C CB . LYS C 3 210 ? -7.604 -8.094 -5.151 1.00 28.13 ? 208 LYS L CB 1 +ATOM 4776 C CG . LYS C 3 210 ? -7.154 -8.890 -3.943 1.00 30.47 ? 208 LYS L CG 1 +ATOM 4777 C CD . LYS C 3 210 ? -5.672 -8.624 -3.674 1.00 38.39 ? 208 LYS L CD 1 +ATOM 4778 C CE . LYS C 3 210 ? -5.175 -9.412 -2.484 1.00 50.45 ? 208 LYS L CE 1 +ATOM 4779 N NZ . LYS C 3 210 ? -3.777 -9.029 -2.162 1.00 60.99 ? 208 LYS L NZ 1 +ATOM 4780 N N . SER C 3 211 ? -7.027 -5.355 -6.964 1.00 26.86 ? 209 SER L N 1 +ATOM 4781 C CA . SER C 3 211 ? -7.371 -4.508 -8.090 1.00 30.76 ? 209 SER L CA 1 +ATOM 4782 C C . SER C 3 211 ? -6.398 -4.765 -9.226 1.00 34.49 ? 209 SER L C 1 +ATOM 4783 O O . SER C 3 211 ? -5.307 -5.298 -9.024 1.00 28.37 ? 209 SER L O 1 +ATOM 4784 C CB . SER C 3 211 ? -7.340 -3.014 -7.709 1.00 34.00 ? 209 SER L CB 1 +ATOM 4785 O OG . SER C 3 211 ? -6.059 -2.635 -7.235 1.00 47.43 ? 209 SER L OG 1 +ATOM 4786 N N . PHE C 3 212 ? -6.815 -4.388 -10.431 1.00 33.94 ? 210 PHE L N 1 +ATOM 4787 C CA . PHE C 3 212 ? -5.894 -4.257 -11.549 1.00 33.55 ? 210 PHE L CA 1 +ATOM 4788 C C . PHE C 3 212 ? -6.299 -3.040 -12.369 1.00 37.17 ? 210 PHE L C 1 +ATOM 4789 O O . PHE C 3 212 ? -7.416 -2.533 -12.255 1.00 32.47 ? 210 PHE L O 1 +ATOM 4790 C CB . PHE C 3 212 ? -5.876 -5.514 -12.423 1.00 30.41 ? 210 PHE L CB 1 +ATOM 4791 C CG . PHE C 3 212 ? -7.180 -5.777 -13.123 1.00 29.18 ? 210 PHE L CG 1 +ATOM 4792 C CD1 . PHE C 3 212 ? -7.440 -5.216 -14.366 1.00 31.75 ? 210 PHE L CD1 1 +ATOM 4793 C CD2 . PHE C 3 212 ? -8.155 -6.580 -12.531 1.00 29.96 ? 210 PHE L CD2 1 +ATOM 4794 C CE1 . PHE C 3 212 ? -8.643 -5.449 -15.014 1.00 30.19 ? 210 PHE L CE1 1 +ATOM 4795 C CE2 . PHE C 3 212 ? -9.356 -6.830 -13.173 1.00 27.34 ? 210 PHE L CE2 1 +ATOM 4796 C CZ . PHE C 3 212 ? -9.608 -6.263 -14.412 1.00 29.32 ? 210 PHE L CZ 1 +ATOM 4797 N N . ASN C 3 213 ? -5.371 -2.565 -13.196 1.00 32.69 ? 211 ASN L N 1 +ATOM 4798 C CA . ASN C 3 213 ? -5.652 -1.511 -14.161 1.00 29.73 ? 211 ASN L CA 1 +ATOM 4799 C C . ASN C 3 213 ? -5.753 -2.132 -15.544 1.00 31.99 ? 211 ASN L C 1 +ATOM 4800 O O . ASN C 3 213 ? -4.847 -2.867 -15.966 1.00 39.75 ? 211 ASN L O 1 +ATOM 4801 C CB . ASN C 3 213 ? -4.559 -0.437 -14.149 1.00 37.70 ? 211 ASN L CB 1 +ATOM 4802 C CG . ASN C 3 213 ? -4.222 0.041 -12.751 1.00 43.53 ? 211 ASN L CG 1 +ATOM 4803 O OD1 . ASN C 3 213 ? -3.053 0.147 -12.388 1.00 51.16 ? 211 ASN L OD1 1 +ATOM 4804 N ND2 . ASN C 3 213 ? -5.243 0.329 -11.957 1.00 37.19 ? 211 ASN L ND2 1 +ATOM 4805 N N . ARG C 3 214 ? -6.843 -1.825 -16.244 1.00 29.34 ? 212 ARG L N 1 +ATOM 4806 C CA . ARG C 3 214 ? -7.080 -2.371 -17.570 1.00 32.55 ? 212 ARG L CA 1 +ATOM 4807 C C . ARG C 3 214 ? -5.860 -2.132 -18.451 1.00 41.01 ? 212 ARG L C 1 +ATOM 4808 O O . ARG C 3 214 ? -5.365 -1.007 -18.549 1.00 42.87 ? 212 ARG L O 1 +ATOM 4809 C CB . ARG C 3 214 ? -8.320 -1.729 -18.193 1.00 30.33 ? 212 ARG L CB 1 +ATOM 4810 C CG . ARG C 3 214 ? -8.669 -2.276 -19.568 1.00 35.17 ? 212 ARG L CG 1 +ATOM 4811 C CD . ARG C 3 214 ? -9.932 -1.639 -20.129 1.00 37.41 ? 212 ARG L CD 1 +ATOM 4812 N NE . ARG C 3 214 ? -9.929 -0.188 -19.983 1.00 36.25 ? 212 ARG L NE 1 +ATOM 4813 C CZ . ARG C 3 214 ? -9.197 0.642 -20.719 1.00 43.94 ? 212 ARG L CZ 1 +ATOM 4814 N NH1 . ARG C 3 214 ? -9.253 1.949 -20.498 1.00 45.18 ? 212 ARG L NH1 1 +ATOM 4815 N NH2 . ARG C 3 214 ? -8.410 0.168 -21.672 1.00 39.46 ? 212 ARG L NH2 1 +ATOM 4816 N N . GLY C 3 215 ? -5.364 -3.204 -19.060 1.00 49.35 ? 213 GLY L N 1 +ATOM 4817 C CA . GLY C 3 215 ? -4.141 -3.139 -19.830 1.00 62.00 ? 213 GLY L CA 1 +ATOM 4818 C C . GLY C 3 215 ? -2.867 -3.337 -19.040 1.00 69.57 ? 213 GLY L C 1 +ATOM 4819 O O . GLY C 3 215 ? -1.844 -2.747 -19.402 1.00 73.99 ? 213 GLY L O 1 +ATOM 4820 N N . GLU C 3 216 ? -2.892 -4.175 -17.993 1.00 76.98 ? 214 GLU L N 1 +ATOM 4821 C CA . GLU C 3 216 ? -1.775 -4.399 -17.073 1.00 80.31 ? 214 GLU L CA 1 +ATOM 4822 C C . GLU C 3 216 ? -1.016 -3.103 -16.819 1.00 89.53 ? 214 GLU L C 1 +ATOM 4823 O O . GLU C 3 216 ? 0.146 -2.964 -17.215 1.00 103.96 ? 214 GLU L O 1 +ATOM 4824 C CB . GLU C 3 216 ? -0.837 -5.491 -17.605 1.00 78.98 ? 214 GLU L CB 1 +ATOM 4825 C CG . GLU C 3 216 ? 0.311 -5.895 -16.656 1.00 78.15 ? 214 GLU L CG 1 +ATOM 4826 C CD . GLU C 3 216 ? -0.156 -6.702 -15.456 1.00 86.18 ? 214 GLU L CD 1 +ATOM 4827 O OE1 . GLU C 3 216 ? -0.476 -7.896 -15.629 1.00 88.89 ? 214 GLU L OE1 1 +ATOM 4828 O OE2 . GLU C 3 216 ? -0.199 -6.147 -14.337 1.00 88.72 ? 214 GLU L OE2 1 +ATOM 4829 N N . CYS C 3 217 ? -1.675 -2.142 -16.183 1.00 87.18 ? 215 CYS L N 1 +ATOM 4830 C CA . CYS C 3 217 ? -1.116 -0.806 -16.005 1.00 84.76 ? 215 CYS L CA 1 +ATOM 4831 C C . CYS C 3 217 ? -1.046 -0.420 -14.530 1.00 84.32 ? 215 CYS L C 1 +ATOM 4832 O O . CYS C 3 217 ? -0.145 0.305 -14.105 1.00 87.78 ? 215 CYS L O 1 +ATOM 4833 C CB . CYS C 3 217 ? -1.947 0.218 -16.785 1.00 86.37 ? 215 CYS L CB 1 +ATOM 4834 S SG . CYS C 3 217 ? -1.780 1.924 -16.222 1.00 92.27 ? 215 CYS L SG 1 +HETATM 4835 C C1 . NAG D 4 . ? -80.042 -18.681 24.176 1.00 71.95 ? 601 NAG A C1 1 +HETATM 4836 C C2 . NAG D 4 . ? -81.337 -18.290 23.438 1.00 77.70 ? 601 NAG A C2 1 +HETATM 4837 C C3 . NAG D 4 . ? -81.466 -16.766 23.332 1.00 84.27 ? 601 NAG A C3 1 +HETATM 4838 C C4 . NAG D 4 . ? -81.322 -16.115 24.700 1.00 91.71 ? 601 NAG A C4 1 +HETATM 4839 C C5 . NAG D 4 . ? -79.991 -16.531 25.314 1.00 87.06 ? 601 NAG A C5 1 +HETATM 4840 C C6 . NAG D 4 . ? -79.769 -15.969 26.701 1.00 86.35 ? 601 NAG A C6 1 +HETATM 4841 C C7 . NAG D 4 . ? -82.437 -19.545 21.630 1.00 68.41 ? 601 NAG A C7 1 +HETATM 4842 C C8 . NAG D 4 . ? -82.295 -20.093 20.243 1.00 64.17 ? 601 NAG A C8 1 +HETATM 4843 N N2 . NAG D 4 . ? -81.375 -18.892 22.113 1.00 71.81 ? 601 NAG A N2 1 +HETATM 4844 O O3 . NAG D 4 . ? -82.725 -16.425 22.763 1.00 79.86 ? 601 NAG A O3 1 +HETATM 4845 O O4 . NAG D 4 . ? -81.378 -14.697 24.578 1.00 98.68 ? 601 NAG A O4 1 +HETATM 4846 O O5 . NAG D 4 . ? -79.953 -17.961 25.429 1.00 80.34 ? 601 NAG A O5 1 +HETATM 4847 O O6 . NAG D 4 . ? -80.839 -16.284 27.582 1.00 89.81 ? 601 NAG A O6 1 +HETATM 4848 O O7 . NAG D 4 . ? -83.462 -19.692 22.284 1.00 70.44 ? 601 NAG A O7 1 +HETATM 4849 O O . HOH E 5 . ? -80.473 -30.214 8.743 1.00 38.93 ? 701 HOH A O 1 +HETATM 4850 O O . HOH E 5 . ? -61.044 -31.214 20.220 1.00 35.35 ? 702 HOH A O 1 +HETATM 4851 O O . HOH E 5 . ? -47.730 -44.203 7.676 1.00 39.46 ? 703 HOH A O 1 +HETATM 4852 O O . HOH E 5 . ? -63.029 -48.786 17.903 1.00 59.98 ? 704 HOH A O 1 +HETATM 4853 O O . HOH E 5 . ? -52.566 -22.407 19.451 1.00 34.36 ? 705 HOH A O 1 +HETATM 4854 O O . HOH E 5 . ? -59.415 -52.317 9.086 1.00 42.40 ? 706 HOH A O 1 +HETATM 4855 O O . HOH E 5 . ? -56.115 -20.403 9.539 1.00 35.34 ? 707 HOH A O 1 +HETATM 4856 O O . HOH E 5 . ? -60.113 -30.996 10.283 1.00 39.69 ? 708 HOH A O 1 +HETATM 4857 O O . HOH E 5 . ? -59.149 -23.023 19.861 1.00 43.03 ? 709 HOH A O 1 +HETATM 4858 O O . HOH E 5 . ? -68.889 -18.204 11.027 1.00 41.48 ? 710 HOH A O 1 +HETATM 4859 O O . HOH E 5 . ? -66.165 -15.209 13.794 1.00 45.89 ? 711 HOH A O 1 +HETATM 4860 O O . HOH E 5 . ? -47.355 -56.078 4.853 1.00 56.36 ? 712 HOH A O 1 +HETATM 4861 O O . HOH E 5 . ? -69.535 -16.217 19.428 1.00 37.76 ? 713 HOH A O 1 +HETATM 4862 O O . HOH E 5 . ? -67.546 -36.027 20.723 1.00 59.52 ? 714 HOH A O 1 +HETATM 4863 O O . HOH E 5 . ? -57.970 -53.971 7.422 1.00 35.63 ? 715 HOH A O 1 +HETATM 4864 O O . HOH E 5 . ? -63.991 -46.313 10.447 1.00 69.79 ? 716 HOH A O 1 +HETATM 4865 O O . HOH E 5 . ? -73.245 -30.558 -2.406 1.00 38.93 ? 717 HOH A O 1 +HETATM 4866 O O . HOH E 5 . ? -71.417 -29.762 0.485 1.00 35.99 ? 718 HOH A O 1 +HETATM 4867 O O . HOH E 5 . ? -53.316 -24.200 25.815 1.00 39.79 ? 719 HOH A O 1 +HETATM 4868 O O . HOH E 5 . ? -65.484 -45.276 7.327 1.00 29.37 ? 720 HOH A O 1 +HETATM 4869 O O . HOH E 5 . ? -74.793 -42.922 12.291 1.00 43.59 ? 721 HOH A O 1 +HETATM 4870 O O . HOH E 5 . ? -67.505 -39.337 9.405 1.00 26.62 ? 722 HOH A O 1 +HETATM 4871 O O . HOH E 5 . ? -79.191 -25.537 -2.843 1.00 52.52 ? 723 HOH A O 1 +HETATM 4872 O O . HOH E 5 . ? -61.873 -46.601 8.807 1.00 26.70 ? 724 HOH A O 1 +HETATM 4873 O O . HOH E 5 . ? -69.335 -41.560 -2.429 1.00 41.67 ? 725 HOH A O 1 +HETATM 4874 O O . HOH E 5 . ? -62.282 -25.299 4.616 1.00 30.81 ? 726 HOH A O 1 +HETATM 4875 O O . HOH E 5 . ? -72.875 -37.516 18.767 1.00 36.26 ? 727 HOH A O 1 +HETATM 4876 O O . HOH E 5 . ? -58.883 -53.753 11.431 1.00 40.80 ? 728 HOH A O 1 +HETATM 4877 O O . HOH E 5 . ? -81.144 -13.036 26.681 1.00 67.03 ? 729 HOH A O 1 +HETATM 4878 O O . HOH E 5 . ? -71.404 -37.163 -2.169 1.00 40.24 ? 730 HOH A O 1 +HETATM 4879 O O . HOH E 5 . ? -79.000 -31.052 16.680 1.00 30.13 ? 731 HOH A O 1 +HETATM 4880 O O . HOH E 5 . ? -64.797 -20.994 6.852 1.00 28.44 ? 732 HOH A O 1 +HETATM 4881 O O . HOH E 5 . ? -76.152 -30.460 21.185 1.00 39.06 ? 733 HOH A O 1 +HETATM 4882 O O . HOH E 5 . ? -58.179 -56.148 9.170 1.00 37.42 ? 734 HOH A O 1 +HETATM 4883 O O . HOH E 5 . ? -70.717 -42.912 1.180 1.00 38.37 ? 735 HOH A O 1 +HETATM 4884 O O . HOH E 5 . ? -63.076 -44.302 7.951 1.00 23.98 ? 736 HOH A O 1 +HETATM 4885 O O . HOH E 5 . ? -56.518 -26.819 18.177 1.00 42.54 ? 737 HOH A O 1 +HETATM 4886 O O . HOH E 5 . ? -73.108 -21.989 4.473 1.00 35.88 ? 738 HOH A O 1 +HETATM 4887 O O . HOH E 5 . ? -72.935 -23.148 -1.935 1.00 46.08 ? 739 HOH A O 1 +HETATM 4888 O O . HOH E 5 . ? -69.176 -21.774 1.246 1.00 37.85 ? 740 HOH A O 1 +HETATM 4889 O O . HOH E 5 . ? -68.612 -46.816 7.852 1.00 48.69 ? 741 HOH A O 1 +HETATM 4890 O O . HOH E 5 . ? -66.935 -28.119 25.332 1.00 42.42 ? 742 HOH A O 1 +HETATM 4891 O O . HOH E 5 . ? -67.608 -25.507 28.335 1.00 53.36 ? 743 HOH A O 1 +HETATM 4892 O O . HOH E 5 . ? -62.447 -36.487 -1.430 1.00 24.41 ? 744 HOH A O 1 +HETATM 4893 O O . HOH E 5 . ? -49.948 -51.966 -0.036 1.00 33.37 ? 745 HOH A O 1 +HETATM 4894 O O . HOH E 5 . ? -60.560 -49.254 16.318 1.00 43.46 ? 746 HOH A O 1 +HETATM 4895 O O . HOH E 5 . ? -75.754 -30.678 26.156 1.00 62.24 ? 747 HOH A O 1 +HETATM 4896 O O . HOH E 5 . ? -74.938 -45.274 4.525 1.00 47.78 ? 748 HOH A O 1 +HETATM 4897 O O . HOH E 5 . ? -56.085 -37.021 17.304 1.00 39.70 ? 749 HOH A O 1 +HETATM 4898 O O . HOH E 5 . ? -52.813 -51.455 5.108 1.00 29.41 ? 750 HOH A O 1 +HETATM 4899 O O . HOH E 5 . ? -72.121 -15.684 19.711 1.00 48.43 ? 751 HOH A O 1 +HETATM 4900 O O . HOH E 5 . ? -70.188 -38.575 9.586 1.00 23.57 ? 752 HOH A O 1 +HETATM 4901 O O . HOH E 5 . ? -65.677 -45.175 2.161 1.00 30.37 ? 753 HOH A O 1 +HETATM 4902 O O . HOH E 5 . ? -66.054 -32.092 16.161 1.00 24.84 ? 754 HOH A O 1 +HETATM 4903 O O . HOH E 5 . ? -76.816 -12.752 13.954 1.00 57.90 ? 755 HOH A O 1 +HETATM 4904 O O . HOH E 5 . ? -71.153 -30.127 3.569 1.00 30.87 ? 756 HOH A O 1 +HETATM 4905 O O . HOH E 5 . ? -68.047 -33.664 -1.028 1.00 29.46 ? 757 HOH A O 1 +HETATM 4906 O O . HOH E 5 . ? -50.123 -49.893 17.411 1.00 50.68 ? 758 HOH A O 1 +HETATM 4907 O O . HOH E 5 . ? -78.738 -37.097 16.759 1.00 50.91 ? 759 HOH A O 1 +HETATM 4908 O O . HOH E 5 . ? -56.408 -18.509 11.862 1.00 37.80 ? 760 HOH A O 1 +HETATM 4909 O O . HOH E 5 . ? -77.552 -28.919 19.596 1.00 34.12 ? 761 HOH A O 1 +HETATM 4910 O O . HOH E 5 . ? -55.836 -31.081 27.947 1.00 51.10 ? 762 HOH A O 1 +HETATM 4911 O O . HOH E 5 . ? -82.336 -35.027 5.678 1.00 39.68 ? 763 HOH A O 1 +HETATM 4912 O O . HOH E 5 . ? -62.381 -15.450 19.298 1.00 42.31 ? 764 HOH A O 1 +HETATM 4913 O O . HOH E 5 . ? -65.981 -17.273 21.666 1.00 37.75 ? 765 HOH A O 1 +HETATM 4914 O O . HOH E 5 . ? -70.543 -31.486 -4.180 1.00 41.75 ? 766 HOH A O 1 +HETATM 4915 O O . HOH E 5 . ? -69.664 -18.938 6.383 1.00 51.37 ? 767 HOH A O 1 +HETATM 4916 O O . HOH E 5 . ? -73.836 -35.585 6.231 1.00 34.43 ? 768 HOH A O 1 +HETATM 4917 O O . HOH E 5 . ? -69.209 -35.740 0.419 1.00 25.85 ? 769 HOH A O 1 +HETATM 4918 O O . HOH E 5 . ? -57.852 -26.399 15.403 1.00 48.73 ? 770 HOH A O 1 +HETATM 4919 O O . HOH E 5 . ? -56.582 -15.144 14.409 1.00 37.77 ? 771 HOH A O 1 +HETATM 4920 O O . HOH E 5 . ? -85.445 -35.319 17.553 1.00 38.40 ? 772 HOH A O 1 +HETATM 4921 O O . HOH E 5 . ? -46.187 -50.410 11.716 1.00 51.26 ? 773 HOH A O 1 +HETATM 4922 O O . HOH E 5 . ? -61.857 -16.124 22.434 1.00 62.49 ? 774 HOH A O 1 +HETATM 4923 O O . HOH E 5 . ? -68.910 -15.644 15.923 1.00 44.45 ? 775 HOH A O 1 +HETATM 4924 O O . HOH E 5 . ? -73.802 -15.073 6.877 1.00 42.77 ? 776 HOH A O 1 +HETATM 4925 O O . HOH E 5 . ? -74.895 -31.393 18.951 1.00 28.78 ? 777 HOH A O 1 +HETATM 4926 O O . HOH E 5 . ? -66.724 -49.242 14.281 1.00 41.03 ? 778 HOH A O 1 +HETATM 4927 O O . HOH E 5 . ? -63.173 -45.952 4.449 1.00 35.28 ? 779 HOH A O 1 +HETATM 4928 O O . HOH E 5 . ? -59.443 -37.562 22.092 1.00 56.42 ? 780 HOH A O 1 +HETATM 4929 O O . HOH E 5 . ? -70.650 -21.356 5.300 1.00 38.74 ? 781 HOH A O 1 +HETATM 4930 O O . HOH E 5 . ? -66.326 -26.485 -4.397 1.00 56.66 ? 782 HOH A O 1 +HETATM 4931 O O . HOH E 5 . ? -64.498 -37.808 22.105 1.00 49.00 ? 783 HOH A O 1 +HETATM 4932 O O . HOH E 5 . ? -77.765 -29.069 27.164 1.00 52.69 ? 784 HOH A O 1 +HETATM 4933 O O . HOH E 5 . ? -76.213 -33.548 -4.122 1.00 42.24 ? 785 HOH A O 1 +HETATM 4934 O O . HOH E 5 . ? -54.822 -28.527 31.107 1.00 38.52 ? 786 HOH A O 1 +HETATM 4935 O O . HOH E 5 . ? -61.112 -29.630 6.116 1.00 46.69 ? 787 HOH A O 1 +HETATM 4936 O O . HOH E 5 . ? -61.931 -30.370 -4.634 1.00 40.99 ? 788 HOH A O 1 +HETATM 4937 O O . HOH E 5 . ? -77.350 -18.358 -0.597 1.00 60.51 ? 789 HOH A O 1 +HETATM 4938 O O . HOH E 5 . ? -59.703 -32.690 26.536 1.00 41.99 ? 790 HOH A O 1 +HETATM 4939 O O . HOH E 5 . ? -57.152 -56.504 1.890 1.00 62.35 ? 791 HOH A O 1 +HETATM 4940 O O . HOH E 5 . ? -50.475 -52.191 3.806 1.00 34.88 ? 792 HOH A O 1 +HETATM 4941 O O . HOH E 5 . ? -48.351 -54.982 -1.719 1.00 55.10 ? 793 HOH A O 1 +HETATM 4942 O O . HOH E 5 . ? -64.699 -26.718 -2.536 1.00 50.74 ? 794 HOH A O 1 +HETATM 4943 O O . HOH E 5 . ? -70.077 -36.564 19.596 1.00 36.35 ? 795 HOH A O 1 +HETATM 4944 O O . HOH E 5 . ? -61.067 -21.240 4.868 1.00 48.89 ? 796 HOH A O 1 +HETATM 4945 O O . HOH E 5 . ? -51.076 -45.469 12.701 1.00 41.04 ? 797 HOH A O 1 +HETATM 4946 O O . HOH E 5 . ? -69.052 -36.547 -3.602 1.00 43.03 ? 798 HOH A O 1 +HETATM 4947 O O . HOH E 5 . ? -65.809 -30.514 25.084 1.00 48.88 ? 799 HOH A O 1 +HETATM 4948 O O . HOH E 5 . ? -80.206 -13.571 21.963 1.00 70.62 ? 800 HOH A O 1 +HETATM 4949 O O . HOH E 5 . ? -78.678 -15.720 3.493 1.00 54.20 ? 801 HOH A O 1 +HETATM 4950 O O . HOH E 5 . ? -54.318 -33.499 16.491 1.00 56.86 ? 802 HOH A O 1 +HETATM 4951 O O . HOH E 5 . ? -55.428 -60.810 7.969 1.00 43.82 ? 803 HOH A O 1 +HETATM 4952 O O . HOH E 5 . ? -79.037 -32.721 -4.873 1.00 58.98 ? 804 HOH A O 1 +HETATM 4953 O O . HOH E 5 . ? -51.391 -36.831 14.517 1.00 46.31 ? 805 HOH A O 1 +HETATM 4954 O O . HOH E 5 . ? -70.067 -20.075 3.332 1.00 63.59 ? 806 HOH A O 1 +HETATM 4955 O O . HOH E 5 . ? -67.482 -33.867 -3.735 1.00 43.75 ? 807 HOH A O 1 +HETATM 4956 O O . HOH E 5 . ? -70.789 -21.599 -0.874 1.00 48.16 ? 808 HOH A O 1 +HETATM 4957 O O . HOH E 5 . ? -51.544 -60.319 8.851 1.00 50.71 ? 809 HOH A O 1 +HETATM 4958 O O . HOH E 5 . ? -67.227 -38.401 20.452 1.00 68.01 ? 810 HOH A O 1 +HETATM 4959 O O . HOH E 5 . ? -76.040 -19.073 20.892 1.00 61.69 ? 811 HOH A O 1 +HETATM 4960 O O . HOH E 5 . ? -49.353 -52.421 -2.913 1.00 51.62 ? 812 HOH A O 1 +HETATM 4961 O O . HOH E 5 . ? -74.196 -17.613 21.104 1.00 57.76 ? 813 HOH A O 1 +HETATM 4962 O O . HOH E 5 . ? -64.197 -17.514 10.366 1.00 61.90 ? 814 HOH A O 1 +HETATM 4963 O O . HOH E 5 . ? -67.531 -18.386 3.231 1.00 54.14 ? 815 HOH A O 1 +HETATM 4964 O O . HOH E 5 . ? -66.020 -46.223 4.384 1.00 46.09 ? 816 HOH A O 1 +HETATM 4965 O O . HOH E 5 . ? -57.653 -60.482 7.070 1.00 50.69 ? 817 HOH A O 1 +HETATM 4966 O O . HOH E 5 . ? -66.356 -18.300 9.935 1.00 47.82 ? 818 HOH A O 1 +HETATM 4967 O O . HOH E 5 . ? -57.638 -51.654 0.035 1.00 60.16 ? 819 HOH A O 1 +HETATM 4968 O O . HOH E 5 . ? -66.696 -18.885 7.058 1.00 49.23 ? 820 HOH A O 1 +HETATM 4969 O O . HOH E 5 . ? -61.987 -48.321 6.236 1.00 42.32 ? 821 HOH A O 1 +HETATM 4970 O O . HOH E 5 . ? -66.887 -14.202 15.857 1.00 57.92 ? 822 HOH A O 1 +HETATM 4971 O O . HOH E 5 . ? -60.536 -51.917 15.932 1.00 49.07 ? 823 HOH A O 1 +HETATM 4972 O O . HOH E 5 . ? -51.289 -39.111 15.573 1.00 58.94 ? 824 HOH A O 1 +HETATM 4973 O O . HOH E 5 . ? -68.437 -32.240 -5.264 1.00 66.37 ? 825 HOH A O 1 +HETATM 4974 O O . HOH E 5 . ? -61.597 -26.196 -4.569 1.00 48.46 ? 826 HOH A O 1 +HETATM 4975 O O . HOH F 5 . ? 6.075 -28.830 -11.254 1.00 57.20 ? 301 HOH H O 1 +HETATM 4976 O O . HOH F 5 . ? -41.752 -16.289 -16.064 1.00 56.50 ? 302 HOH H O 1 +HETATM 4977 O O . HOH F 5 . ? -31.813 -23.964 -13.231 1.00 37.86 ? 303 HOH H O 1 +HETATM 4978 O O . HOH F 5 . ? -46.905 -21.626 -2.842 1.00 29.82 ? 304 HOH H O 1 +HETATM 4979 O O . HOH F 5 . ? -55.982 -40.482 12.984 1.00 40.60 ? 305 HOH H O 1 +HETATM 4980 O O . HOH F 5 . ? -28.170 -24.832 -11.595 1.00 64.90 ? 306 HOH H O 1 +HETATM 4981 O O . HOH F 5 . ? -58.366 -31.141 -10.255 1.00 27.65 ? 307 HOH H O 1 +HETATM 4982 O O . HOH F 5 . ? -33.745 -35.194 -4.733 1.00 42.98 ? 308 HOH H O 1 +HETATM 4983 O O . HOH F 5 . ? -14.490 -30.057 -10.370 1.00 41.63 ? 309 HOH H O 1 +HETATM 4984 O O . HOH F 5 . ? -48.446 -44.606 -16.152 1.00 41.50 ? 310 HOH H O 1 +HETATM 4985 O O . HOH F 5 . ? -42.446 -22.666 0.518 1.00 37.47 ? 311 HOH H O 1 +HETATM 4986 O O . HOH F 5 . ? -0.345 -24.135 -17.597 1.00 40.87 ? 312 HOH H O 1 +HETATM 4987 O O . HOH F 5 . ? -34.312 -30.851 -4.591 1.00 38.17 ? 313 HOH H O 1 +HETATM 4988 O O . HOH F 5 . ? -53.473 -29.163 -16.327 1.00 36.10 ? 314 HOH H O 1 +HETATM 4989 O O . HOH F 5 . ? 1.743 -23.070 -15.342 1.00 43.41 ? 315 HOH H O 1 +HETATM 4990 O O . HOH F 5 . ? -32.619 -20.789 -19.103 1.00 27.94 ? 316 HOH H O 1 +HETATM 4991 O O . HOH F 5 . ? -35.425 -24.809 -23.802 1.00 49.12 ? 317 HOH H O 1 +HETATM 4992 O O . HOH F 5 . ? -50.568 -35.020 0.842 1.00 30.70 ? 318 HOH H O 1 +HETATM 4993 O O . HOH F 5 . ? -64.656 -34.473 -4.214 1.00 29.66 ? 319 HOH H O 1 +HETATM 4994 O O . HOH F 5 . ? -58.039 -34.633 -11.712 1.00 44.33 ? 320 HOH H O 1 +HETATM 4995 O O . HOH F 5 . ? -44.407 -43.967 8.166 1.00 37.57 ? 321 HOH H O 1 +HETATM 4996 O O . HOH F 5 . ? -3.354 -27.769 -5.709 1.00 35.87 ? 322 HOH H O 1 +HETATM 4997 O O . HOH F 5 . ? -53.104 -40.948 3.429 1.00 23.07 ? 323 HOH H O 1 +HETATM 4998 O O . HOH F 5 . ? -44.410 -20.123 -6.154 1.00 44.88 ? 324 HOH H O 1 +HETATM 4999 O O . HOH F 5 . ? -42.260 -20.375 -25.793 1.00 35.54 ? 325 HOH H O 1 +HETATM 5000 O O . HOH F 5 . ? -7.968 -23.898 -3.187 1.00 31.06 ? 326 HOH H O 1 +HETATM 5001 O O . HOH F 5 . ? -60.707 -36.780 -8.554 1.00 33.14 ? 327 HOH H O 1 +HETATM 5002 O O . HOH F 5 . ? -46.379 -42.882 -16.847 1.00 38.65 ? 328 HOH H O 1 +HETATM 5003 O O . HOH F 5 . ? -54.242 -46.738 -6.456 1.00 27.64 ? 329 HOH H O 1 +HETATM 5004 O O . HOH F 5 . ? -20.559 -18.426 -26.305 1.00 55.03 ? 330 HOH H O 1 +HETATM 5005 O O . HOH F 5 . ? -42.951 -35.879 -19.538 1.00 46.58 ? 331 HOH H O 1 +HETATM 5006 O O . HOH F 5 . ? -19.852 -26.391 -5.970 1.00 41.91 ? 332 HOH H O 1 +HETATM 5007 O O . HOH F 5 . ? -36.562 -38.397 -13.532 1.00 49.60 ? 333 HOH H O 1 +HETATM 5008 O O . HOH F 5 . ? -46.650 -31.398 -24.901 1.00 63.59 ? 334 HOH H O 1 +HETATM 5009 O O . HOH F 5 . ? -45.027 -38.964 -17.248 1.00 35.68 ? 335 HOH H O 1 +HETATM 5010 O O . HOH F 5 . ? -56.281 -49.437 0.683 1.00 36.97 ? 336 HOH H O 1 +HETATM 5011 O O . HOH F 5 . ? -54.510 -38.884 -15.731 1.00 41.51 ? 337 HOH H O 1 +HETATM 5012 O O . HOH F 5 . ? -46.903 -46.235 -13.815 1.00 36.77 ? 338 HOH H O 1 +HETATM 5013 O O . HOH F 5 . ? -22.245 -32.479 -18.720 1.00 52.97 ? 339 HOH H O 1 +HETATM 5014 O O . HOH F 5 . ? -24.940 -14.593 -21.322 1.00 37.70 ? 340 HOH H O 1 +HETATM 5015 O O . HOH F 5 . ? -37.662 -43.895 -5.751 1.00 41.69 ? 341 HOH H O 1 +HETATM 5016 O O . HOH F 5 . ? -46.420 -52.019 2.732 1.00 31.84 ? 342 HOH H O 1 +HETATM 5017 O O . HOH F 5 . ? -42.801 -43.297 -12.698 1.00 37.12 ? 343 HOH H O 1 +HETATM 5018 O O . HOH F 5 . ? -20.699 -26.831 -10.267 1.00 39.46 ? 344 HOH H O 1 +HETATM 5019 O O . HOH F 5 . ? -39.582 -43.713 -2.297 1.00 29.96 ? 345 HOH H O 1 +HETATM 5020 O O . HOH F 5 . ? -2.715 -35.212 -16.658 1.00 68.06 ? 346 HOH H O 1 +HETATM 5021 O O . HOH F 5 . ? -40.067 -51.014 2.143 1.00 42.14 ? 347 HOH H O 1 +HETATM 5022 O O . HOH F 5 . ? -48.393 -19.229 -17.915 1.00 45.70 ? 348 HOH H O 1 +HETATM 5023 O O . HOH F 5 . ? -43.098 -31.607 -23.360 1.00 46.22 ? 349 HOH H O 1 +HETATM 5024 O O . HOH F 5 . ? -33.320 -38.181 -4.567 1.00 47.79 ? 350 HOH H O 1 +HETATM 5025 O O . HOH F 5 . ? -42.710 -47.836 -7.294 1.00 44.47 ? 351 HOH H O 1 +HETATM 5026 O O . HOH F 5 . ? -44.887 -21.102 -10.407 1.00 29.68 ? 352 HOH H O 1 +HETATM 5027 O O . HOH F 5 . ? -40.988 -23.600 -6.091 1.00 32.88 ? 353 HOH H O 1 +HETATM 5028 O O . HOH F 5 . ? -47.553 -56.546 -5.840 1.00 36.68 ? 354 HOH H O 1 +HETATM 5029 O O . HOH F 5 . ? -10.569 -28.233 -2.667 1.00 50.15 ? 355 HOH H O 1 +HETATM 5030 O O . HOH F 5 . ? -32.008 -31.339 -10.406 1.00 51.15 ? 356 HOH H O 1 +HETATM 5031 O O . HOH F 5 . ? -33.898 -27.842 -6.879 1.00 49.99 ? 357 HOH H O 1 +HETATM 5032 O O . HOH F 5 . ? -9.737 -32.793 -11.300 1.00 38.11 ? 358 HOH H O 1 +HETATM 5033 O O . HOH F 5 . ? -53.162 -35.172 -14.305 1.00 28.20 ? 359 HOH H O 1 +HETATM 5034 O O . HOH F 5 . ? -32.392 -25.963 -2.091 1.00 42.10 ? 360 HOH H O 1 +HETATM 5035 O O . HOH F 5 . ? -34.084 -20.654 -8.107 1.00 39.37 ? 361 HOH H O 1 +HETATM 5036 O O . HOH F 5 . ? 6.568 -26.151 -7.045 1.00 48.11 ? 362 HOH H O 1 +HETATM 5037 O O . HOH F 5 . ? -19.957 -20.382 -10.794 1.00 34.09 ? 363 HOH H O 1 +HETATM 5038 O O . HOH F 5 . ? -3.912 -15.410 -9.369 1.00 33.30 ? 364 HOH H O 1 +HETATM 5039 O O . HOH F 5 . ? -39.771 -39.799 5.385 1.00 27.51 ? 365 HOH H O 1 +HETATM 5040 O O . HOH F 5 . ? -4.326 -33.203 -6.481 1.00 39.76 ? 366 HOH H O 1 +HETATM 5041 O O . HOH F 5 . ? -35.368 -21.409 -16.413 1.00 33.18 ? 367 HOH H O 1 +HETATM 5042 O O . HOH F 5 . ? -5.698 -32.597 -19.376 1.00 36.67 ? 368 HOH H O 1 +HETATM 5043 O O . HOH F 5 . ? -47.628 -23.987 -1.552 1.00 27.10 ? 369 HOH H O 1 +HETATM 5044 O O . HOH F 5 . ? -45.660 -19.282 -19.799 1.00 49.59 ? 370 HOH H O 1 +HETATM 5045 O O . HOH F 5 . ? -1.511 -32.549 -12.210 1.00 40.04 ? 371 HOH H O 1 +HETATM 5046 O O . HOH F 5 . ? -53.303 -23.612 -18.743 1.00 42.48 ? 372 HOH H O 1 +HETATM 5047 O O . HOH F 5 . ? -49.429 -25.576 -22.261 1.00 29.84 ? 373 HOH H O 1 +HETATM 5048 O O . HOH F 5 . ? -34.241 -35.060 -10.302 1.00 51.23 ? 374 HOH H O 1 +HETATM 5049 O O . HOH F 5 . ? -14.831 -32.708 -17.196 1.00 49.33 ? 375 HOH H O 1 +HETATM 5050 O O . HOH F 5 . ? -51.203 -20.445 -12.197 1.00 33.32 ? 376 HOH H O 1 +HETATM 5051 O O . HOH F 5 . ? -65.565 -40.431 -3.298 1.00 27.34 ? 377 HOH H O 1 +HETATM 5052 O O . HOH F 5 . ? -55.579 -30.364 2.032 1.00 55.60 ? 378 HOH H O 1 +HETATM 5053 O O . HOH F 5 . ? -47.054 -48.790 -9.231 1.00 33.98 ? 379 HOH H O 1 +HETATM 5054 O O . HOH F 5 . ? -32.920 -22.567 -17.172 1.00 28.46 ? 380 HOH H O 1 +HETATM 5055 O O . HOH F 5 . ? -23.080 -28.060 -13.655 1.00 48.27 ? 381 HOH H O 1 +HETATM 5056 O O . HOH F 5 . ? 0.306 -15.747 -9.121 1.00 48.57 ? 382 HOH H O 1 +HETATM 5057 O O . HOH F 5 . ? -57.978 -38.655 1.616 1.00 44.36 ? 383 HOH H O 1 +HETATM 5058 O O . HOH F 5 . ? -45.276 -35.202 -20.864 1.00 41.30 ? 384 HOH H O 1 +HETATM 5059 O O . HOH F 5 . ? -55.703 -26.352 -11.396 1.00 40.43 ? 385 HOH H O 1 +HETATM 5060 O O . HOH F 5 . ? -41.397 -17.972 -18.303 1.00 33.06 ? 386 HOH H O 1 +HETATM 5061 O O . HOH F 5 . ? -29.031 -32.410 -18.786 1.00 49.28 ? 387 HOH H O 1 +HETATM 5062 O O . HOH F 5 . ? -21.453 -14.835 -15.713 1.00 37.46 ? 388 HOH H O 1 +HETATM 5063 O O . HOH F 5 . ? -37.132 -21.793 -10.765 1.00 36.64 ? 389 HOH H O 1 +HETATM 5064 O O . HOH F 5 . ? -38.981 -23.821 -4.294 1.00 27.06 ? 390 HOH H O 1 +HETATM 5065 O O . HOH F 5 . ? -53.388 -44.158 13.757 1.00 37.15 ? 391 HOH H O 1 +HETATM 5066 O O . HOH F 5 . ? -19.924 -16.412 -13.914 1.00 42.64 ? 392 HOH H O 1 +HETATM 5067 O O . HOH F 5 . ? -58.872 -40.275 3.422 1.00 40.39 ? 393 HOH H O 1 +HETATM 5068 O O . HOH F 5 . ? -54.940 -40.273 -3.924 1.00 27.40 ? 394 HOH H O 1 +HETATM 5069 O O . HOH F 5 . ? -54.427 -23.445 -2.107 1.00 69.84 ? 395 HOH H O 1 +HETATM 5070 O O . HOH F 5 . ? -26.053 -20.599 -8.006 1.00 40.61 ? 396 HOH H O 1 +HETATM 5071 O O . HOH F 5 . ? 0.392 -28.575 -8.755 1.00 38.19 ? 397 HOH H O 1 +HETATM 5072 O O . HOH F 5 . ? -28.632 -18.479 -10.617 1.00 32.70 ? 398 HOH H O 1 +HETATM 5073 O O . HOH F 5 . ? -37.374 -42.761 -13.248 1.00 46.94 ? 399 HOH H O 1 +HETATM 5074 O O . HOH F 5 . ? -41.681 -27.122 -25.108 1.00 35.94 ? 400 HOH H O 1 +HETATM 5075 O O . HOH F 5 . ? -60.018 -30.118 3.529 1.00 34.30 ? 401 HOH H O 1 +HETATM 5076 O O . HOH F 5 . ? -60.554 -44.203 -3.261 1.00 47.49 ? 402 HOH H O 1 +HETATM 5077 O O . HOH F 5 . ? 8.363 -26.565 -9.198 1.00 41.52 ? 403 HOH H O 1 +HETATM 5078 O O . HOH F 5 . ? -40.429 -26.000 -30.656 1.00 44.83 ? 404 HOH H O 1 +HETATM 5079 O O . HOH F 5 . ? -19.173 -16.403 -23.932 1.00 46.47 ? 405 HOH H O 1 +HETATM 5080 O O . HOH F 5 . ? -59.584 -27.119 -5.878 1.00 43.32 ? 406 HOH H O 1 +HETATM 5081 O O . HOH F 5 . ? -52.945 -35.581 -18.529 1.00 49.38 ? 407 HOH H O 1 +HETATM 5082 O O . HOH F 5 . ? -14.051 -22.535 -25.513 1.00 37.70 ? 408 HOH H O 1 +HETATM 5083 O O . HOH F 5 . ? -46.122 -18.702 -11.234 1.00 45.98 ? 409 HOH H O 1 +HETATM 5084 O O . HOH F 5 . ? -15.157 -27.132 -3.624 1.00 38.57 ? 410 HOH H O 1 +HETATM 5085 O O . HOH F 5 . ? -34.799 -35.764 -13.493 1.00 35.71 ? 411 HOH H O 1 +HETATM 5086 O O . HOH F 5 . ? -34.850 -30.883 -16.815 1.00 45.34 ? 412 HOH H O 1 +HETATM 5087 O O . HOH F 5 . ? -51.682 -21.646 -2.128 1.00 40.64 ? 413 HOH H O 1 +HETATM 5088 O O . HOH F 5 . ? -26.675 -23.892 -9.524 1.00 48.84 ? 414 HOH H O 1 +HETATM 5089 O O . HOH F 5 . ? -39.436 -41.875 1.534 1.00 31.47 ? 415 HOH H O 1 +HETATM 5090 O O . HOH F 5 . ? -36.374 -18.790 -20.383 1.00 38.17 ? 416 HOH H O 1 +HETATM 5091 O O . HOH F 5 . ? -22.834 -25.103 -29.037 1.00 52.71 ? 417 HOH H O 1 +HETATM 5092 O O . HOH F 5 . ? -35.254 -38.833 -11.557 1.00 63.08 ? 418 HOH H O 1 +HETATM 5093 O O . HOH F 5 . ? -15.272 -28.476 -6.092 1.00 33.32 ? 419 HOH H O 1 +HETATM 5094 O O . HOH F 5 . ? -35.835 -33.057 -21.972 1.00 43.60 ? 420 HOH H O 1 +HETATM 5095 O O . HOH F 5 . ? -57.735 -39.226 -11.197 1.00 30.09 ? 421 HOH H O 1 +HETATM 5096 O O . HOH F 5 . ? -57.407 -25.653 -4.994 1.00 28.94 ? 422 HOH H O 1 +HETATM 5097 O O . HOH F 5 . ? -32.734 -15.898 -16.808 1.00 56.56 ? 423 HOH H O 1 +HETATM 5098 O O . HOH F 5 . ? -5.619 -24.360 -24.623 1.00 46.86 ? 424 HOH H O 1 +HETATM 5099 O O . HOH F 5 . ? -43.115 -40.816 -17.488 1.00 51.71 ? 425 HOH H O 1 +HETATM 5100 O O . HOH F 5 . ? -24.126 -26.091 -10.910 1.00 41.39 ? 426 HOH H O 1 +HETATM 5101 O O . HOH F 5 . ? -48.985 -20.154 -4.161 1.00 31.48 ? 427 HOH H O 1 +HETATM 5102 O O . HOH F 5 . ? -11.955 -15.369 -17.751 1.00 38.15 ? 428 HOH H O 1 +HETATM 5103 O O . HOH F 5 . ? -61.507 -33.090 -7.721 1.00 38.28 ? 429 HOH H O 1 +HETATM 5104 O O . HOH F 5 . ? -17.440 -30.730 -12.087 1.00 37.70 ? 430 HOH H O 1 +HETATM 5105 O O . HOH F 5 . ? -13.347 -30.014 -5.597 1.00 45.40 ? 431 HOH H O 1 +HETATM 5106 O O . HOH F 5 . ? -30.685 -26.468 -16.811 1.00 35.01 ? 432 HOH H O 1 +HETATM 5107 O O . HOH F 5 . ? -3.309 -25.280 -2.361 1.00 48.78 ? 433 HOH H O 1 +HETATM 5108 O O . HOH F 5 . ? -53.962 -50.435 -6.871 1.00 52.55 ? 434 HOH H O 1 +HETATM 5109 O O . HOH F 5 . ? -32.769 -22.094 0.587 1.00 47.25 ? 435 HOH H O 1 +HETATM 5110 O O . HOH F 5 . ? -50.025 -51.702 -10.657 1.00 59.82 ? 436 HOH H O 1 +HETATM 5111 O O . HOH F 5 . ? -54.653 -26.074 -17.952 1.00 52.94 ? 437 HOH H O 1 +HETATM 5112 O O . HOH F 5 . ? 5.756 -21.491 -4.087 1.00 41.56 ? 438 HOH H O 1 +HETATM 5113 O O . HOH F 5 . ? -64.531 -36.629 -5.850 1.00 45.16 ? 439 HOH H O 1 +HETATM 5114 O O . HOH F 5 . ? -47.440 -52.503 -4.091 1.00 40.91 ? 440 HOH H O 1 +HETATM 5115 O O . HOH F 5 . ? -37.894 -28.772 -25.159 1.00 58.10 ? 441 HOH H O 1 +HETATM 5116 O O . HOH F 5 . ? -36.727 -40.659 -1.850 1.00 47.17 ? 442 HOH H O 1 +HETATM 5117 O O . HOH F 5 . ? -40.325 -28.066 -26.696 1.00 59.51 ? 443 HOH H O 1 +HETATM 5118 O O . HOH F 5 . ? -31.915 -27.006 -4.765 1.00 43.21 ? 444 HOH H O 1 +HETATM 5119 O O . HOH F 5 . ? -7.284 -34.391 -3.202 1.00 58.89 ? 445 HOH H O 1 +HETATM 5120 O O . HOH F 5 . ? -35.674 -20.725 -13.852 1.00 36.41 ? 446 HOH H O 1 +HETATM 5121 O O . HOH F 5 . ? -26.836 -11.999 -15.456 1.00 55.61 ? 447 HOH H O 1 +HETATM 5122 O O . HOH F 5 . ? -34.092 -15.264 -19.987 1.00 61.33 ? 448 HOH H O 1 +HETATM 5123 O O . HOH F 5 . ? -33.772 -35.878 -8.094 1.00 46.89 ? 449 HOH H O 1 +HETATM 5124 O O . HOH F 5 . ? 3.660 -30.427 -16.850 1.00 54.18 ? 450 HOH H O 1 +HETATM 5125 O O . HOH F 5 . ? -2.126 -15.829 -7.689 1.00 35.39 ? 451 HOH H O 1 +HETATM 5126 O O . HOH F 5 . ? -54.322 -31.054 -20.289 1.00 54.52 ? 452 HOH H O 1 +HETATM 5127 O O . HOH F 5 . ? -21.096 -22.246 -28.343 1.00 55.93 ? 453 HOH H O 1 +HETATM 5128 O O . HOH F 5 . ? -48.116 -33.144 -21.879 1.00 39.02 ? 454 HOH H O 1 +HETATM 5129 O O . HOH F 5 . ? -5.984 -37.114 -7.881 1.00 68.57 ? 455 HOH H O 1 +HETATM 5130 O O . HOH F 5 . ? -34.688 -27.622 -11.252 1.00 41.43 ? 456 HOH H O 1 +HETATM 5131 O O . HOH F 5 . ? -60.612 -44.446 -6.881 1.00 57.92 ? 457 HOH H O 1 +HETATM 5132 O O . HOH F 5 . ? -38.996 -44.978 0.211 1.00 54.04 ? 458 HOH H O 1 +HETATM 5133 O O . HOH F 5 . ? -50.520 -17.940 -10.513 1.00 64.29 ? 459 HOH H O 1 +HETATM 5134 O O . HOH F 5 . ? -42.889 -20.086 -8.371 1.00 35.71 ? 460 HOH H O 1 +HETATM 5135 O O . HOH F 5 . ? -57.247 -25.217 -10.043 1.00 57.97 ? 461 HOH H O 1 +HETATM 5136 O O . HOH F 5 . ? -4.074 -35.638 -5.347 1.00 65.22 ? 462 HOH H O 1 +HETATM 5137 O O . HOH F 5 . ? -35.950 -44.292 -8.011 1.00 44.24 ? 463 HOH H O 1 +HETATM 5138 O O . HOH F 5 . ? -32.777 -26.626 -13.300 1.00 46.95 ? 464 HOH H O 1 +HETATM 5139 O O . HOH F 5 . ? -20.393 -18.021 -11.749 1.00 56.10 ? 465 HOH H O 1 +HETATM 5140 O O . HOH F 5 . ? -58.768 -23.377 -11.595 1.00 52.20 ? 466 HOH H O 1 +HETATM 5141 O O . HOH F 5 . ? -3.047 -32.679 -18.382 1.00 45.48 ? 467 HOH H O 1 +HETATM 5142 O O . HOH F 5 . ? -34.791 -19.337 -18.156 1.00 36.13 ? 468 HOH H O 1 +HETATM 5143 O O . HOH F 5 . ? -36.664 -42.840 -3.419 1.00 58.09 ? 469 HOH H O 1 +HETATM 5144 O O . HOH F 5 . ? -58.132 -24.141 -3.020 1.00 62.24 ? 470 HOH H O 1 +HETATM 5145 O O . HOH F 5 . ? -44.598 -33.769 -23.398 1.00 57.28 ? 471 HOH H O 1 +HETATM 5146 O O . HOH F 5 . ? -59.482 -41.376 -10.493 1.00 60.13 ? 472 HOH H O 1 +HETATM 5147 O O . HOH F 5 . ? -34.360 -17.153 -21.525 1.00 54.96 ? 473 HOH H O 1 +HETATM 5148 O O . HOH F 5 . ? -21.556 -27.464 -7.520 1.00 49.83 ? 474 HOH H O 1 +HETATM 5149 O O . HOH F 5 . ? -48.333 -17.659 -4.733 1.00 38.99 ? 475 HOH H O 1 +HETATM 5150 O O . HOH F 5 . ? -11.854 -31.662 -9.726 1.00 50.90 ? 476 HOH H O 1 +HETATM 5151 O O . HOH F 5 . ? -45.696 -20.102 -1.212 1.00 45.00 ? 477 HOH H O 1 +HETATM 5152 O O . HOH F 5 . ? -54.713 -34.760 -16.270 1.00 44.95 ? 478 HOH H O 1 +HETATM 5153 O O . HOH F 5 . ? -28.957 -21.475 -7.636 1.00 57.61 ? 479 HOH H O 1 +HETATM 5154 O O . HOH F 5 . ? -46.279 -37.950 -21.041 1.00 56.43 ? 480 HOH H O 1 +HETATM 5155 O O . HOH F 5 . ? -42.894 -20.724 -1.624 1.00 46.74 ? 481 HOH H O 1 +HETATM 5156 O O . HOH F 5 . ? -59.440 -32.804 -11.660 1.00 42.94 ? 482 HOH H O 1 +HETATM 5157 O O . HOH F 5 . ? -44.869 -44.572 -14.039 1.00 60.39 ? 483 HOH H O 1 +HETATM 5158 O O . HOH F 5 . ? -30.059 -23.012 -11.451 1.00 43.87 ? 484 HOH H O 1 +HETATM 5159 O O . HOH F 5 . ? -41.618 -46.043 -13.125 1.00 58.73 ? 485 HOH H O 1 +HETATM 5160 O O . HOH F 5 . ? -59.862 -28.418 -10.496 1.00 64.19 ? 486 HOH H O 1 +HETATM 5161 O O . HOH F 5 . ? -0.713 -34.579 -14.046 1.00 61.19 ? 487 HOH H O 1 +HETATM 5162 O O . HOH F 5 . ? -61.840 -33.568 -10.171 1.00 56.05 ? 488 HOH H O 1 +HETATM 5163 O O . HOH F 5 . ? -59.326 -36.765 -10.619 1.00 46.77 ? 489 HOH H O 1 +HETATM 5164 O O . HOH F 5 . ? -64.214 -33.052 -6.923 1.00 64.02 ? 490 HOH H O 1 +HETATM 5165 O O . HOH F 5 . ? -38.835 -17.312 -19.627 1.00 38.10 ? 491 HOH H O 1 +HETATM 5166 O O . HOH F 5 . ? -57.613 -27.391 1.117 1.00 52.94 ? 492 HOH H O 1 +HETATM 5167 O O . HOH F 5 . ? -42.225 -48.875 -9.886 1.00 60.12 ? 493 HOH H O 1 +HETATM 5168 O O . HOH F 5 . ? -29.903 -20.738 -10.062 1.00 46.21 ? 494 HOH H O 1 +HETATM 5169 O O . HOH F 5 . ? -42.981 -20.249 -28.387 1.00 53.72 ? 495 HOH H O 1 +HETATM 5170 O O . HOH F 5 . ? -39.078 -20.126 -7.031 1.00 53.26 ? 496 HOH H O 1 +HETATM 5171 O O . HOH F 5 . ? -50.160 -19.547 -1.448 1.00 48.55 ? 497 HOH H O 1 +HETATM 5172 O O . HOH F 5 . ? -36.136 -26.998 -25.382 1.00 62.47 ? 498 HOH H O 1 +HETATM 5173 O O . HOH F 5 . ? -35.429 -18.225 -13.704 1.00 52.60 ? 499 HOH H O 1 +HETATM 5174 O O . HOH F 5 . ? -1.182 -28.982 -6.435 1.00 37.61 ? 500 HOH H O 1 +HETATM 5175 O O . HOH F 5 . ? -32.610 -20.356 -10.636 1.00 37.05 ? 501 HOH H O 1 +HETATM 5176 O O . HOH F 5 . ? -34.006 -21.781 -12.236 1.00 32.57 ? 502 HOH H O 1 +HETATM 5177 O O . HOH F 5 . ? -59.393 -26.382 -8.353 1.00 67.94 ? 503 HOH H O 1 +HETATM 5178 O O . HOH F 5 . ? -30.398 -32.785 -20.976 1.00 56.99 ? 504 HOH H O 1 +HETATM 5179 O O . HOH F 5 . ? -1.652 -31.875 -6.245 1.00 45.39 ? 505 HOH H O 1 +HETATM 5180 O O . HOH F 5 . ? -36.592 -20.069 -8.788 1.00 44.83 ? 506 HOH H O 1 +HETATM 5181 O O . HOH F 5 . ? -34.854 -17.241 -16.391 1.00 46.22 ? 507 HOH H O 1 +HETATM 5182 O O . HOH F 5 . ? -33.088 -17.795 -11.153 1.00 56.25 ? 508 HOH H O 1 +HETATM 5183 O O . HOH F 5 . ? -61.977 -25.067 -8.885 1.00 60.21 ? 509 HOH H O 1 +HETATM 5184 O O . HOH G 5 . ? -52.702 -19.769 6.587 1.00 41.78 ? 301 HOH L O 1 +HETATM 5185 O O . HOH G 5 . ? -57.967 -29.580 11.539 1.00 40.34 ? 302 HOH L O 1 +HETATM 5186 O O . HOH G 5 . ? -17.891 -12.650 8.072 1.00 33.15 ? 303 HOH L O 1 +HETATM 5187 O O . HOH G 5 . ? -20.120 -12.879 -17.089 1.00 38.10 ? 304 HOH L O 1 +HETATM 5188 O O . HOH G 5 . ? -6.214 -20.106 -0.821 1.00 51.69 ? 305 HOH L O 1 +HETATM 5189 O O . HOH G 5 . ? -38.505 -18.148 14.220 1.00 41.22 ? 306 HOH L O 1 +HETATM 5190 O O . HOH G 5 . ? -46.455 -21.217 21.723 1.00 45.17 ? 307 HOH L O 1 +HETATM 5191 O O . HOH G 5 . ? -37.714 -43.079 9.713 1.00 64.67 ? 308 HOH L O 1 +HETATM 5192 O O . HOH G 5 . ? -37.525 -31.476 22.901 1.00 47.79 ? 309 HOH L O 1 +HETATM 5193 O O . HOH G 5 . ? -48.884 -41.421 16.101 1.00 53.28 ? 310 HOH L O 1 +HETATM 5194 O O . HOH G 5 . ? -33.770 -36.732 22.633 1.00 47.40 ? 311 HOH L O 1 +HETATM 5195 O O . HOH G 5 . ? -21.834 -13.299 0.203 1.00 46.96 ? 312 HOH L O 1 +HETATM 5196 O O . HOH G 5 . ? -50.335 -20.825 6.589 1.00 56.18 ? 313 HOH L O 1 +HETATM 5197 O O . HOH G 5 . ? -59.422 -28.722 7.292 1.00 48.18 ? 314 HOH L O 1 +HETATM 5198 O O . HOH G 5 . ? -46.341 -36.650 20.847 1.00 56.05 ? 315 HOH L O 1 +HETATM 5199 O O . HOH G 5 . ? -20.913 -10.636 -5.693 1.00 32.94 ? 316 HOH L O 1 +HETATM 5200 O O . HOH G 5 . ? -14.110 -28.047 -1.245 1.00 54.34 ? 317 HOH L O 1 +HETATM 5201 O O . HOH G 5 . ? -15.830 5.438 -3.832 1.00 40.84 ? 318 HOH L O 1 +HETATM 5202 O O . HOH G 5 . ? -21.242 -10.545 -1.595 1.00 38.74 ? 319 HOH L O 1 +HETATM 5203 O O . HOH G 5 . ? -9.367 -2.448 1.217 1.00 42.52 ? 320 HOH L O 1 +HETATM 5204 O O . HOH G 5 . ? -7.717 -19.517 4.013 1.00 41.97 ? 321 HOH L O 1 +HETATM 5205 O O . HOH G 5 . ? -23.960 -29.557 2.306 1.00 40.60 ? 322 HOH L O 1 +HETATM 5206 O O . HOH G 5 . ? -11.326 -0.554 -1.850 1.00 49.32 ? 323 HOH L O 1 +HETATM 5207 O O . HOH G 5 . ? -33.557 -24.114 2.023 1.00 42.96 ? 324 HOH L O 1 +HETATM 5208 O O . HOH G 5 . ? -21.833 -28.781 6.135 1.00 49.36 ? 325 HOH L O 1 +HETATM 5209 O O . HOH G 5 . ? -40.313 -35.442 20.425 1.00 35.60 ? 326 HOH L O 1 +HETATM 5210 O O . HOH G 5 . ? -29.630 -37.652 10.802 1.00 33.46 ? 327 HOH L O 1 +HETATM 5211 O O . HOH G 5 . ? -23.136 -24.603 -2.798 1.00 31.57 ? 328 HOH L O 1 +HETATM 5212 O O . HOH G 5 . ? -44.099 -16.089 11.252 1.00 38.50 ? 329 HOH L O 1 +HETATM 5213 O O . HOH G 5 . ? -33.649 -33.963 21.607 1.00 35.71 ? 330 HOH L O 1 +HETATM 5214 O O . HOH G 5 . ? -7.894 -6.443 -19.918 1.00 51.23 ? 331 HOH L O 1 +HETATM 5215 O O . HOH G 5 . ? -48.961 -33.727 19.787 1.00 53.88 ? 332 HOH L O 1 +HETATM 5216 O O . HOH G 5 . ? -19.108 -13.471 10.463 1.00 45.10 ? 333 HOH L O 1 +HETATM 5217 O O . HOH G 5 . ? -12.154 -13.154 -16.085 1.00 30.54 ? 334 HOH L O 1 +HETATM 5218 O O . HOH G 5 . ? -22.124 -11.040 -13.663 1.00 29.45 ? 335 HOH L O 1 +HETATM 5219 O O . HOH G 5 . ? -22.866 -13.865 -13.995 1.00 40.74 ? 336 HOH L O 1 +HETATM 5220 O O . HOH G 5 . ? -42.200 -28.988 17.285 1.00 30.12 ? 337 HOH L O 1 +HETATM 5221 O O . HOH G 5 . ? -45.820 -40.771 9.869 1.00 41.22 ? 338 HOH L O 1 +HETATM 5222 O O . HOH G 5 . ? -32.673 -28.224 1.331 1.00 39.34 ? 339 HOH L O 1 +HETATM 5223 O O . HOH G 5 . ? -50.764 -14.223 10.153 1.00 42.89 ? 340 HOH L O 1 +HETATM 5224 O O . HOH G 5 . ? -25.879 -7.704 -9.095 1.00 36.98 ? 341 HOH L O 1 +HETATM 5225 O O . HOH G 5 . ? -19.692 -20.287 13.224 1.00 42.44 ? 342 HOH L O 1 +HETATM 5226 O O . HOH G 5 . ? -19.683 -31.178 21.264 1.00 60.66 ? 343 HOH L O 1 +HETATM 5227 O O . HOH G 5 . ? -19.713 -1.773 0.210 1.00 42.29 ? 344 HOH L O 1 +HETATM 5228 O O . HOH G 5 . ? -30.243 -25.469 2.457 1.00 41.97 ? 345 HOH L O 1 +HETATM 5229 O O . HOH G 5 . ? -12.469 -13.926 -19.989 1.00 31.95 ? 346 HOH L O 1 +HETATM 5230 O O . HOH G 5 . ? -16.357 -30.385 6.557 1.00 42.87 ? 347 HOH L O 1 +HETATM 5231 O O . HOH G 5 . ? -26.827 -18.978 13.665 1.00 50.56 ? 348 HOH L O 1 +HETATM 5232 O O . HOH G 5 . ? -24.982 -36.811 5.854 1.00 58.19 ? 349 HOH L O 1 +HETATM 5233 O O . HOH G 5 . ? -26.078 -32.610 4.456 1.00 38.11 ? 350 HOH L O 1 +HETATM 5234 O O . HOH G 5 . ? -37.441 -29.613 21.011 1.00 35.85 ? 351 HOH L O 1 +HETATM 5235 O O . HOH G 5 . ? -41.017 -15.352 7.540 1.00 48.98 ? 352 HOH L O 1 +HETATM 5236 O O . HOH G 5 . ? -22.660 -23.148 0.845 1.00 36.60 ? 353 HOH L O 1 +HETATM 5237 O O . HOH G 5 . ? -24.767 -28.787 6.162 1.00 32.42 ? 354 HOH L O 1 +HETATM 5238 O O . HOH G 5 . ? -26.111 -34.989 0.089 1.00 51.86 ? 355 HOH L O 1 +HETATM 5239 O O . HOH G 5 . ? -28.199 -28.848 3.279 1.00 37.59 ? 356 HOH L O 1 +HETATM 5240 O O . HOH G 5 . ? -25.790 -18.076 -6.674 1.00 40.86 ? 357 HOH L O 1 +HETATM 5241 O O . HOH G 5 . ? -22.355 -5.407 -8.870 1.00 37.29 ? 358 HOH L O 1 +HETATM 5242 O O . HOH G 5 . ? -37.755 -43.941 16.669 1.00 56.70 ? 359 HOH L O 1 +HETATM 5243 O O . HOH G 5 . ? -24.261 -34.857 7.421 1.00 37.82 ? 360 HOH L O 1 +HETATM 5244 O O . HOH G 5 . ? -38.772 -40.675 7.936 1.00 40.37 ? 361 HOH L O 1 +HETATM 5245 O O . HOH G 5 . ? -22.024 -3.177 -19.905 1.00 43.13 ? 362 HOH L O 1 +HETATM 5246 O O . HOH G 5 . ? -44.717 -23.242 22.535 1.00 45.41 ? 363 HOH L O 1 +HETATM 5247 O O . HOH G 5 . ? -47.971 -17.879 4.603 1.00 42.76 ? 364 HOH L O 1 +HETATM 5248 O O . HOH G 5 . ? -39.498 -23.992 2.204 1.00 30.37 ? 365 HOH L O 1 +HETATM 5249 O O . HOH G 5 . ? -9.282 -9.145 -27.514 1.00 52.93 ? 366 HOH L O 1 +HETATM 5250 O O . HOH G 5 . ? -16.778 -5.324 0.836 1.00 35.81 ? 367 HOH L O 1 +HETATM 5251 O O . HOH G 5 . ? -20.650 -5.030 -6.007 1.00 29.46 ? 368 HOH L O 1 +HETATM 5252 O O . HOH G 5 . ? -15.441 -25.457 -0.097 1.00 30.27 ? 369 HOH L O 1 +HETATM 5253 O O . HOH G 5 . ? -12.095 1.089 -8.551 1.00 31.93 ? 370 HOH L O 1 +HETATM 5254 O O . HOH G 5 . ? -21.714 -16.167 1.592 1.00 50.19 ? 371 HOH L O 1 +HETATM 5255 O O . HOH G 5 . ? -21.141 -7.800 -5.198 1.00 47.88 ? 372 HOH L O 1 +HETATM 5256 O O . HOH G 5 . ? -16.092 -19.817 14.989 1.00 51.95 ? 373 HOH L O 1 +HETATM 5257 O O . HOH G 5 . ? -23.311 -21.472 9.661 1.00 40.38 ? 374 HOH L O 1 +HETATM 5258 O O . HOH G 5 . ? -6.484 -4.005 0.626 1.00 40.14 ? 375 HOH L O 1 +HETATM 5259 O O . HOH G 5 . ? -4.236 -11.956 -4.897 1.00 35.40 ? 376 HOH L O 1 +HETATM 5260 O O . HOH G 5 . ? -30.974 -21.488 4.919 1.00 49.28 ? 377 HOH L O 1 +HETATM 5261 O O . HOH G 5 . ? -4.988 -1.392 -9.766 1.00 47.59 ? 378 HOH L O 1 +HETATM 5262 O O . HOH G 5 . ? -10.836 5.703 -16.507 1.00 42.80 ? 379 HOH L O 1 +HETATM 5263 O O . HOH G 5 . ? -32.330 -37.079 5.169 1.00 47.08 ? 380 HOH L O 1 +HETATM 5264 O O . HOH G 5 . ? -32.418 -36.054 2.662 1.00 30.47 ? 381 HOH L O 1 +HETATM 5265 O O . HOH G 5 . ? -2.853 -3.816 -12.951 1.00 39.38 ? 382 HOH L O 1 +HETATM 5266 O O . HOH G 5 . ? -16.918 4.193 -13.011 1.00 34.46 ? 383 HOH L O 1 +HETATM 5267 O O . HOH G 5 . ? -46.010 -24.873 0.505 1.00 26.52 ? 384 HOH L O 1 +HETATM 5268 O O . HOH G 5 . ? -16.945 -28.777 14.972 1.00 43.65 ? 385 HOH L O 1 +HETATM 5269 O O . HOH G 5 . ? -23.400 -17.738 1.578 1.00 66.40 ? 386 HOH L O 1 +HETATM 5270 O O . HOH G 5 . ? -13.330 -23.940 0.793 1.00 29.21 ? 387 HOH L O 1 +HETATM 5271 O O . HOH G 5 . ? -21.483 -14.577 10.684 1.00 47.98 ? 388 HOH L O 1 +HETATM 5272 O O . HOH G 5 . ? -48.855 -21.918 1.820 1.00 63.09 ? 389 HOH L O 1 +HETATM 5273 O O . HOH G 5 . ? -34.367 -39.149 1.536 1.00 48.49 ? 390 HOH L O 1 +HETATM 5274 O O . HOH G 5 . ? -28.119 -41.548 12.482 1.00 60.81 ? 391 HOH L O 1 +HETATM 5275 O O . HOH G 5 . ? -15.208 -30.946 -0.200 1.00 47.78 ? 392 HOH L O 1 +HETATM 5276 O O . HOH G 5 . ? -22.525 -1.070 -23.979 1.00 51.62 ? 393 HOH L O 1 +HETATM 5277 O O . HOH G 5 . ? -32.085 -39.164 8.989 1.00 46.56 ? 394 HOH L O 1 +HETATM 5278 O O . HOH G 5 . ? -24.156 -20.446 13.927 1.00 41.88 ? 395 HOH L O 1 +HETATM 5279 O O . HOH G 5 . ? -19.293 -3.743 -26.426 1.00 47.72 ? 396 HOH L O 1 +HETATM 5280 O O . HOH G 5 . ? -30.016 -30.113 1.772 1.00 45.33 ? 397 HOH L O 1 +HETATM 5281 O O . HOH G 5 . ? -27.433 -14.828 -9.076 1.00 49.45 ? 398 HOH L O 1 +HETATM 5282 O O . HOH G 5 . ? -23.300 -10.182 -6.757 1.00 44.83 ? 399 HOH L O 1 +HETATM 5283 O O . HOH G 5 . ? -12.538 -18.506 15.802 1.00 41.02 ? 400 HOH L O 1 +HETATM 5284 O O . HOH G 5 . ? -19.284 -16.378 -10.259 1.00 46.42 ? 401 HOH L O 1 +HETATM 5285 O O . HOH G 5 . ? -5.187 -13.127 -9.389 1.00 38.00 ? 402 HOH L O 1 +HETATM 5286 O O . HOH G 5 . ? -25.126 -5.959 -7.019 1.00 46.99 ? 403 HOH L O 1 +HETATM 5287 O O . HOH G 5 . ? -46.274 -15.463 16.895 1.00 61.77 ? 404 HOH L O 1 +HETATM 5288 O O . HOH G 5 . ? -25.676 -13.801 -7.270 1.00 40.11 ? 405 HOH L O 1 +HETATM 5289 O O . HOH G 5 . ? -24.139 -20.276 -4.026 1.00 32.50 ? 406 HOH L O 1 +HETATM 5290 O O . HOH G 5 . ? -18.650 -13.813 -23.028 1.00 33.10 ? 407 HOH L O 1 +HETATM 5291 O O . HOH G 5 . ? -5.883 -5.958 -18.319 1.00 44.36 ? 408 HOH L O 1 +HETATM 5292 O O . HOH G 5 . ? -38.401 -37.627 20.710 1.00 58.38 ? 409 HOH L O 1 +HETATM 5293 O O . HOH G 5 . ? -29.569 -25.153 22.176 1.00 64.28 ? 410 HOH L O 1 +HETATM 5294 O O . HOH G 5 . ? -42.407 -39.759 20.194 1.00 41.38 ? 411 HOH L O 1 +HETATM 5295 O O . HOH G 5 . ? -6.124 -11.838 0.276 1.00 44.18 ? 412 HOH L O 1 +HETATM 5296 O O . HOH G 5 . ? -38.272 -39.764 3.123 1.00 45.77 ? 413 HOH L O 1 +HETATM 5297 O O . HOH G 5 . ? -22.104 -26.636 3.335 1.00 32.46 ? 414 HOH L O 1 +HETATM 5298 O O . HOH G 5 . ? -17.724 -31.175 14.823 1.00 39.14 ? 415 HOH L O 1 +HETATM 5299 O O . HOH G 5 . ? -4.369 -6.178 -6.055 1.00 39.60 ? 416 HOH L O 1 +HETATM 5300 O O . HOH G 5 . ? -8.357 -25.663 -1.098 1.00 48.51 ? 417 HOH L O 1 +HETATM 5301 O O . HOH G 5 . ? -19.630 -27.266 -3.397 1.00 29.28 ? 418 HOH L O 1 +HETATM 5302 O O . HOH G 5 . ? -35.514 -16.043 11.043 1.00 63.84 ? 419 HOH L O 1 +HETATM 5303 O O . HOH G 5 . ? -7.182 -18.234 6.698 1.00 36.94 ? 420 HOH L O 1 +HETATM 5304 O O . HOH G 5 . ? -26.676 -23.051 1.403 1.00 44.36 ? 421 HOH L O 1 +HETATM 5305 O O . HOH G 5 . ? -7.353 -16.211 9.341 1.00 41.32 ? 422 HOH L O 1 +HETATM 5306 O O . HOH G 5 . ? -34.102 -39.289 -2.196 1.00 42.09 ? 423 HOH L O 1 +HETATM 5307 O O . HOH G 5 . ? -1.005 -9.743 -13.369 1.00 47.43 ? 424 HOH L O 1 +HETATM 5308 O O . HOH G 5 . ? -44.745 -22.869 1.814 1.00 31.97 ? 425 HOH L O 1 +HETATM 5309 O O . HOH G 5 . ? -53.819 -21.772 8.481 1.00 43.78 ? 426 HOH L O 1 +HETATM 5310 O O . HOH G 5 . ? -5.240 -11.114 -7.331 1.00 33.03 ? 427 HOH L O 1 +HETATM 5311 O O . HOH G 5 . ? -26.523 -11.197 -7.762 1.00 53.20 ? 428 HOH L O 1 +HETATM 5312 O O . HOH G 5 . ? -8.137 -14.196 11.047 1.00 56.17 ? 429 HOH L O 1 +HETATM 5313 O O . HOH G 5 . ? -28.686 -17.272 9.901 1.00 51.66 ? 430 HOH L O 1 +HETATM 5314 O O . HOH G 5 . ? -50.056 -23.370 -0.331 1.00 46.33 ? 431 HOH L O 1 +HETATM 5315 O O . HOH G 5 . ? -24.167 -28.029 23.470 1.00 42.09 ? 432 HOH L O 1 +HETATM 5316 O O . HOH G 5 . ? -22.003 -6.112 -1.494 1.00 54.54 ? 433 HOH L O 1 +HETATM 5317 O O . HOH G 5 . ? -44.349 -19.585 5.645 1.00 47.86 ? 434 HOH L O 1 +HETATM 5318 O O . HOH G 5 . ? -6.892 -19.403 1.492 1.00 45.94 ? 435 HOH L O 1 +HETATM 5319 O O . HOH G 5 . ? -29.657 -6.922 -12.003 1.00 52.93 ? 436 HOH L O 1 +HETATM 5320 O O . HOH G 5 . ? -46.542 -30.721 21.301 1.00 60.73 ? 437 HOH L O 1 +HETATM 5321 O O . HOH G 5 . ? -20.699 -20.567 8.414 1.00 29.57 ? 438 HOH L O 1 +HETATM 5322 O O . HOH G 5 . ? -4.371 -6.211 -0.931 1.00 51.43 ? 439 HOH L O 1 +HETATM 5323 O O . HOH G 5 . ? -53.252 -16.341 17.605 1.00 42.07 ? 440 HOH L O 1 +HETATM 5324 O O . HOH G 5 . ? -28.196 -43.058 15.041 1.00 52.05 ? 441 HOH L O 1 +HETATM 5325 O O . HOH G 5 . ? -11.177 5.036 -21.040 1.00 62.93 ? 442 HOH L O 1 +HETATM 5326 O O . HOH G 5 . ? -42.746 -42.129 18.817 1.00 52.71 ? 443 HOH L O 1 +HETATM 5327 O O . HOH G 5 . ? -32.752 -22.842 3.980 1.00 44.73 ? 444 HOH L O 1 +HETATM 5328 O O . HOH G 5 . ? -27.227 -5.732 -15.391 1.00 63.18 ? 445 HOH L O 1 +HETATM 5329 O O . HOH G 5 . ? -28.619 -24.309 18.997 1.00 41.37 ? 446 HOH L O 1 +HETATM 5330 O O . HOH G 5 . ? -13.487 -7.028 7.063 1.00 42.41 ? 447 HOH L O 1 +HETATM 5331 O O . HOH G 5 . ? -10.156 4.343 -18.730 1.00 44.04 ? 448 HOH L O 1 +HETATM 5332 O O . HOH G 5 . ? -32.068 -44.091 18.798 1.00 62.63 ? 449 HOH L O 1 +HETATM 5333 O O . HOH G 5 . ? -11.958 -25.488 14.724 1.00 42.84 ? 450 HOH L O 1 +HETATM 5334 O O . HOH G 5 . ? -17.012 -28.284 -1.591 1.00 63.56 ? 451 HOH L O 1 +HETATM 5335 O O . HOH G 5 . ? -20.333 -34.489 8.629 1.00 56.66 ? 452 HOH L O 1 +HETATM 5336 O O . HOH G 5 . ? -19.531 2.748 -13.127 1.00 41.48 ? 453 HOH L O 1 +HETATM 5337 O O . HOH G 5 . ? -24.491 -9.661 -13.901 1.00 37.37 ? 454 HOH L O 1 +HETATM 5338 O O . HOH G 5 . ? -26.762 -9.250 -12.252 1.00 51.50 ? 455 HOH L O 1 +HETATM 5339 O O . HOH G 5 . ? -40.966 -24.595 21.852 1.00 54.57 ? 456 HOH L O 1 +HETATM 5340 O O . HOH G 5 . ? -53.378 -30.194 17.824 1.00 64.08 ? 457 HOH L O 1 +HETATM 5341 O O . HOH G 5 . ? -14.827 -22.604 17.458 1.00 62.33 ? 458 HOH L O 1 +HETATM 5342 O O . HOH G 5 . ? -10.460 1.106 -6.534 1.00 44.79 ? 459 HOH L O 1 +HETATM 5343 O O . HOH G 5 . ? -59.971 -28.037 2.025 1.00 51.19 ? 460 HOH L O 1 +HETATM 5344 O O . HOH G 5 . ? -32.386 -34.328 -7.188 1.00 54.24 ? 461 HOH L O 1 +HETATM 5345 O O . HOH G 5 . ? -26.289 -14.552 -4.758 1.00 46.19 ? 462 HOH L O 1 +HETATM 5346 O O . HOH G 5 . ? -18.626 -9.840 7.814 1.00 46.08 ? 463 HOH L O 1 +HETATM 5347 O O . HOH G 5 . ? -31.753 -18.804 3.949 1.00 64.61 ? 464 HOH L O 1 +HETATM 5348 O O . HOH G 5 . ? -14.291 -24.901 16.556 1.00 55.13 ? 465 HOH L O 1 +HETATM 5349 O O . HOH G 5 . ? -29.488 -4.762 -5.273 1.00 60.93 ? 466 HOH L O 1 +HETATM 5350 O O . HOH G 5 . ? -43.993 -14.957 13.845 1.00 53.48 ? 467 HOH L O 1 +HETATM 5351 O O . HOH G 5 . ? -25.055 -17.834 -3.192 1.00 54.46 ? 468 HOH L O 1 +HETATM 5352 O O . HOH G 5 . ? -25.963 -29.942 4.059 1.00 34.56 ? 469 HOH L O 1 +HETATM 5353 O O . HOH G 5 . ? -54.685 -14.752 16.395 1.00 51.36 ? 470 HOH L O 1 +HETATM 5354 O O . HOH G 5 . ? -14.226 -28.379 16.716 1.00 69.67 ? 471 HOH L O 1 +HETATM 5355 O O . HOH G 5 . ? -31.500 -39.315 11.079 1.00 48.81 ? 472 HOH L O 1 +HETATM 5356 O O . HOH G 5 . ? -48.487 -11.907 7.496 1.00 60.29 ? 473 HOH L O 1 +HETATM 5357 O O . HOH G 5 . ? -9.232 -14.015 13.210 1.00 60.32 ? 474 HOH L O 1 +HETATM 5358 O O . HOH G 5 . ? -46.351 -20.657 1.593 1.00 45.66 ? 475 HOH L O 1 +HETATM 5359 O O . HOH G 5 . ? -31.202 -38.708 2.405 1.00 58.18 ? 476 HOH L O 1 +HETATM 5360 O O . HOH G 5 . ? -24.490 -34.319 3.332 1.00 48.06 ? 477 HOH L O 1 +HETATM 5361 O O . HOH G 5 . ? -18.832 -34.543 10.934 1.00 61.49 ? 478 HOH L O 1 +HETATM 5362 O O . HOH G 5 . ? -45.964 -18.832 3.585 1.00 53.07 ? 479 HOH L O 1 +HETATM 5363 O O . HOH G 5 . ? -30.302 -41.654 10.801 1.00 64.14 ? 480 HOH L O 1 +HETATM 5364 O O . HOH G 5 . ? -11.951 -27.765 13.115 1.00 47.08 ? 481 HOH L O 1 +HETATM 5365 O O . HOH G 5 . ? -26.426 -37.669 1.385 1.00 50.33 ? 482 HOH L O 1 +HETATM 5366 O O . HOH G 5 . ? -28.519 -39.329 2.278 1.00 57.81 ? 483 HOH L O 1 +HETATM 5367 O O . HOH G 5 . ? -17.234 -32.629 12.415 1.00 45.02 ? 484 HOH L O 1 +# +loop_ +_atom_site_anisotrop.id +_atom_site_anisotrop.type_symbol +_atom_site_anisotrop.pdbx_label_atom_id +_atom_site_anisotrop.pdbx_label_alt_id +_atom_site_anisotrop.pdbx_label_comp_id +_atom_site_anisotrop.pdbx_label_asym_id +_atom_site_anisotrop.pdbx_label_seq_id +_atom_site_anisotrop.pdbx_PDB_ins_code +_atom_site_anisotrop.U[1][1] +_atom_site_anisotrop.U[2][2] +_atom_site_anisotrop.U[3][3] +_atom_site_anisotrop.U[1][2] +_atom_site_anisotrop.U[1][3] +_atom_site_anisotrop.U[2][3] +_atom_site_anisotrop.pdbx_auth_seq_id +_atom_site_anisotrop.pdbx_auth_comp_id +_atom_site_anisotrop.pdbx_auth_asym_id +_atom_site_anisotrop.pdbx_auth_atom_id +1 N N . ASN A 16 ? 0.5664 1.0990 1.3257 0.1979 0.2175 -0.1656 334 ASN A N +2 C CA . ASN A 16 ? 0.6992 1.2104 1.4223 0.1743 0.2198 -0.1586 334 ASN A CA +3 C C . ASN A 16 ? 0.7200 1.1957 1.4101 0.1792 0.1957 -0.1504 334 ASN A C +4 O O . ASN A 16 ? 0.6503 1.1350 1.3554 0.1774 0.1711 -0.1445 334 ASN A O +5 C CB . ASN A 16 ? 0.7852 1.3296 1.5396 0.1529 0.2175 -0.1564 334 ASN A CB +6 C CG . ASN A 16 ? 0.8493 1.3877 1.5816 0.1284 0.2442 -0.1555 334 ASN A CG +7 O OD1 . ASN A 16 ? 0.9005 1.4069 1.5876 0.1261 0.2609 -0.1548 334 ASN A OD1 +8 N ND2 . ASN A 16 ? 0.8235 1.3912 1.5859 0.1100 0.2476 -0.1553 334 ASN A ND2 +9 N N . LEU A 17 ? 0.7287 1.1639 1.3733 0.1851 0.2027 -0.1506 335 LEU A N +10 C CA . LEU A 17 ? 0.7144 1.1142 1.3287 0.1921 0.1813 -0.1437 335 LEU A CA +11 C C . LEU A 17 ? 0.6639 1.0459 1.2471 0.1705 0.1795 -0.1362 335 LEU A C +12 O O . LEU A 17 ? 0.7060 1.0843 1.2695 0.1530 0.2005 -0.1367 335 LEU A O +13 C CB . LEU A 17 ? 0.6816 1.0446 1.2625 0.2086 0.1882 -0.1481 335 LEU A CB +14 C CG . LEU A 17 ? 0.7152 1.0874 1.3218 0.2334 0.1881 -0.1550 335 LEU A CG +15 C CD1 . LEU A 17 ? 0.7354 1.1286 1.3551 0.2332 0.2171 -0.1659 335 LEU A CD1 +16 C CD2 . LEU A 17 ? 0.6892 1.0171 1.2634 0.2513 0.1787 -0.1547 335 LEU A CD2 +17 N N . CYS A 18 ? 0.6338 1.0032 1.2109 0.1725 0.1540 -0.1285 336 CYS A N +18 C CA . CYS A 18 ? 0.5492 0.9042 1.1016 0.1534 0.1498 -0.1213 336 CYS A CA +19 C C . CYS A 18 ? 0.4949 0.8106 0.9966 0.1486 0.1652 -0.1211 336 CYS A C +20 O O . CYS A 18 ? 0.4763 0.7660 0.9571 0.1635 0.1662 -0.1244 336 CYS A O +21 C CB . CYS A 18 ? 0.6587 1.0081 1.2145 0.1589 0.1185 -0.1135 336 CYS A CB +22 S SG . CYS A 18 ? 0.6767 1.0722 1.2869 0.1630 0.0970 -0.1134 336 CYS A SG +23 N N . PRO A 19 ? 0.5991 0.9080 1.0785 0.1278 0.1770 -0.1172 337 PRO A N +24 C CA . PRO A 19 ? 0.6663 0.9409 1.0960 0.1219 0.1938 -0.1172 337 PRO A CA +25 C C . PRO A 19 ? 0.5813 0.8208 0.9782 0.1238 0.1791 -0.1116 337 PRO A C +26 O O . PRO A 19 ? 0.5524 0.7748 0.9194 0.1092 0.1841 -0.1059 337 PRO A O +27 C CB . PRO A 19 ? 0.6870 0.9717 1.1102 0.0991 0.2113 -0.1133 337 PRO A CB +28 C CG . PRO A 19 ? 0.5589 0.8675 1.0151 0.0902 0.1945 -0.1083 337 PRO A CG +29 C CD . PRO A 19 ? 0.6033 0.9361 1.1017 0.1081 0.1767 -0.1129 337 PRO A CD +30 N N . PHE A 20 ? 0.6262 0.8528 1.0274 0.1421 0.1612 -0.1125 338 PHE A N +31 C CA . PHE A 20 ? 0.6032 0.7942 0.9723 0.1436 0.1456 -0.1062 338 PHE A CA +32 C C . PHE A 20 ? 0.5998 0.7543 0.9155 0.1376 0.1590 -0.1075 338 PHE A C +33 O O . PHE A 20 ? 0.5746 0.7016 0.8504 0.1273 0.1480 -0.0981 338 PHE A O +34 C CB . PHE A 20 ? 0.5095 0.6903 0.8916 0.1646 0.1246 -0.1061 338 PHE A CB +35 C CG . PHE A 20 ? 0.5473 0.7549 0.9664 0.1688 0.1022 -0.1004 338 PHE A CG +36 C CD1 . PHE A 20 ? 0.6306 0.8480 1.0469 0.1519 0.0913 -0.0915 338 PHE A CD1 +37 C CD2 . PHE A 20 ? 0.6502 0.8691 1.0949 0.1872 0.0901 -0.1014 338 PHE A CD2 +38 C CE1 . PHE A 20 ? 0.6507 0.8933 1.0997 0.1556 0.0699 -0.0880 338 PHE A CE1 +39 C CE2 . PHE A 20 ? 0.7087 0.9516 1.1821 0.1906 0.0679 -0.0956 338 PHE A CE2 +40 C CZ . PHE A 20 ? 0.6777 0.9336 1.1549 0.1751 0.0575 -0.0900 338 PHE A CZ +41 N N . GLY A 21 ? 0.6144 0.7686 0.9261 0.1433 0.1808 -0.1186 339 GLY A N +42 C CA . GLY A 21 ? 0.6631 0.7847 0.9249 0.1384 0.1940 -0.1221 339 GLY A CA +43 C C . GLY A 21 ? 0.6408 0.7574 0.8705 0.1172 0.2007 -0.1132 339 GLY A C +44 O O . GLY A 21 ? 0.6486 0.7340 0.8308 0.1104 0.1968 -0.1093 339 GLY A O +45 N N . GLU A 22 ? 0.5745 0.7216 0.8306 0.1064 0.2100 -0.1099 340 GLU A N +46 C CA . GLU A 22 ? 0.4989 0.6394 0.7269 0.0865 0.2141 -0.0993 340 GLU A CA +47 C C . GLU A 22 ? 0.5373 0.6563 0.7416 0.0803 0.1882 -0.0870 340 GLU A C +48 O O . GLU A 22 ? 0.5690 0.6681 0.7344 0.0683 0.1885 -0.0792 340 GLU A O +49 C CB . GLU A 22 ? 0.6090 0.7851 0.8757 0.0756 0.2250 -0.0975 340 GLU A CB +50 C CG . GLU A 22 ? 0.7714 0.9556 1.0287 0.0684 0.2483 -0.0999 340 GLU A CG +51 C CD . GLU A 22 ? 0.8465 1.0663 1.1466 0.0591 0.2532 -0.0985 340 GLU A CD +52 O OE1 . GLU A 22 ? 0.8946 1.1155 1.1910 0.0421 0.2549 -0.0898 340 GLU A OE1 +53 O OE2 . GLU A 22 ? 0.9366 1.1822 1.2736 0.0686 0.2553 -0.1064 340 GLU A OE2 +54 N N . VAL A 23 ? 0.4402 0.5631 0.6670 0.0887 0.1660 -0.0848 341 VAL A N +55 C CA . VAL A 23 ? 0.4249 0.5302 0.6320 0.0822 0.1431 -0.0734 341 VAL A CA +56 C C . VAL A 23 ? 0.4662 0.5365 0.6382 0.0888 0.1324 -0.0731 341 VAL A C +57 O O . VAL A 23 ? 0.4888 0.5370 0.6247 0.0793 0.1268 -0.0665 341 VAL A O +58 C CB . VAL A 23 ? 0.4579 0.5850 0.7034 0.0860 0.1245 -0.0701 341 VAL A CB +59 C CG1 . VAL A 23 ? 0.4225 0.5299 0.6447 0.0800 0.1027 -0.0590 341 VAL A CG1 +60 C CG2 . VAL A 23 ? 0.5005 0.6633 0.7825 0.0766 0.1342 -0.0715 341 VAL A CG2 +61 N N . PHE A 24 ? 0.4713 0.5363 0.6553 0.1050 0.1297 -0.0808 342 PHE A N +62 C CA . PHE A 24 ? 0.4883 0.5189 0.6436 0.1105 0.1181 -0.0807 342 PHE A CA +63 C C . PHE A 24 ? 0.5463 0.5544 0.6618 0.1059 0.1310 -0.0870 342 PHE A C +64 O O . PHE A 24 ? 0.5231 0.5043 0.6063 0.1009 0.1211 -0.0839 342 PHE A O +65 C CB . PHE A 24 ? 0.4453 0.4735 0.6251 0.1297 0.1120 -0.0868 342 PHE A CB +66 C CG . PHE A 24 ? 0.4945 0.5332 0.6998 0.1350 0.0914 -0.0780 342 PHE A CG +67 C CD1 . PHE A 24 ? 0.4273 0.4400 0.6123 0.1342 0.0723 -0.0687 342 PHE A CD1 +68 C CD2 . PHE A 24 ? 0.5154 0.5907 0.7642 0.1397 0.0912 -0.0791 342 PHE A CD2 +69 C CE1 . PHE A 24 ? 0.4136 0.4341 0.6166 0.1391 0.0535 -0.0600 342 PHE A CE1 +70 C CE2 . PHE A 24 ? 0.4604 0.5456 0.7295 0.1448 0.0702 -0.0714 342 PHE A CE2 +71 C CZ . PHE A 24 ? 0.4378 0.4944 0.6815 0.1448 0.0513 -0.0614 342 PHE A CZ +72 N N . ASN A 25 ? 0.5641 0.5834 0.6813 0.1073 0.1531 -0.0963 343 ASN A N +73 C CA . ASN A 25 ? 0.5766 0.5750 0.6539 0.1046 0.1659 -0.1039 343 ASN A CA +74 C C . ASN A 25 ? 0.5732 0.5762 0.6257 0.0895 0.1772 -0.0978 343 ASN A C +75 O O . ASN A 25 ? 0.6584 0.6531 0.6829 0.0879 0.1937 -0.1048 343 ASN A O +76 C CB . ASN A 25 ? 0.5692 0.5711 0.6582 0.1184 0.1844 -0.1200 343 ASN A CB +77 C CG . ASN A 25 ? 0.7415 0.7229 0.8370 0.1337 0.1735 -0.1275 343 ASN A CG +78 O OD1 . ASN A 25 ? 0.7756 0.7333 0.8546 0.1314 0.1547 -0.1217 343 ASN A OD1 +79 N ND2 . ASN A 25 ? 0.8284 0.8181 0.9488 0.1493 0.1866 -0.1404 343 ASN A ND2 +80 N N . ALA A 26 ? 0.5132 0.5272 0.5734 0.0787 0.1687 -0.0850 344 ALA A N +81 C CA . ALA A 26 ? 0.5729 0.5861 0.6079 0.0648 0.1776 -0.0773 344 ALA A CA +82 C C . ALA A 26 ? 0.5600 0.5441 0.5462 0.0604 0.1700 -0.0755 344 ALA A C +83 O O . ALA A 26 ? 0.5946 0.5630 0.5729 0.0619 0.1512 -0.0740 344 ALA A O +84 C CB . ALA A 26 ? 0.5159 0.5438 0.5709 0.0550 0.1684 -0.0650 344 ALA A CB +85 N N . THR A 27 ? 0.6102 0.5873 0.5633 0.0547 0.1846 -0.0756 345 THR A N +86 C CA . THR A 27 ? 0.6664 0.6184 0.5726 0.0513 0.1765 -0.0750 345 THR A CA +87 C C . THR A 27 ? 0.6671 0.6132 0.5668 0.0433 0.1568 -0.0619 345 THR A C +88 O O . THR A 27 ? 0.6307 0.5608 0.5137 0.0434 0.1403 -0.0628 345 THR A O +89 C CB . THR A 27 ? 0.7331 0.6794 0.6029 0.0474 0.1959 -0.0759 345 THR A CB +90 O OG1 . THR A 27 ? 0.8316 0.7793 0.7012 0.0558 0.2140 -0.0908 345 THR A OG1 +91 C CG2 . THR A 27 ? 0.7225 0.6456 0.5439 0.0433 0.1839 -0.0731 345 THR A CG2 +92 N N . ARG A 28 ? 0.6848 0.6440 0.5996 0.0358 0.1589 -0.0506 346 ARG A N +93 C CA . ARG A 28 ? 0.6877 0.6427 0.5994 0.0287 0.1427 -0.0386 346 ARG A CA +94 C C . ARG A 28 ? 0.4532 0.4240 0.4056 0.0285 0.1337 -0.0352 346 ARG A C +95 O O . ARG A 28 ? 0.5254 0.5154 0.5086 0.0298 0.1436 -0.0376 346 ARG A O +96 C CB . ARG A 28 ? 0.8537 0.8059 0.7445 0.0201 0.1517 -0.0280 346 ARG A CB +97 C CG . ARG A 28 ? 1.0978 1.0298 0.9451 0.0184 0.1432 -0.0236 346 ARG A CG +98 C CD . ARG A 28 ? 1.2678 1.1958 1.1189 0.0153 0.1225 -0.0155 346 ARG A CD +99 N NE . ARG A 28 ? 1.3918 1.3062 1.2087 0.0124 0.1173 -0.0070 346 ARG A NE +100 C CZ . ARG A 28 ? 1.3918 1.3024 1.2079 0.0104 0.1011 0.0001 346 ARG A CZ +101 N NH1 . ARG A 28 ? 1.4392 1.3385 1.2254 0.0098 0.0964 0.0077 346 ARG A NH1 +102 N NH2 . ARG A 28 ? 1.3098 1.2278 1.1543 0.0097 0.0899 -0.0001 346 ARG A NH2 +103 N N . PHE A 29 ? 0.4591 0.4228 0.4115 0.0270 0.1148 -0.0301 347 PHE A N +104 C CA . PHE A 29 ? 0.4697 0.4447 0.4520 0.0259 0.1041 -0.0257 347 PHE A CA +105 C C . PHE A 29 ? 0.3862 0.3591 0.3616 0.0166 0.0979 -0.0150 347 PHE A C +106 O O . PHE A 29 ? 0.4079 0.3675 0.3553 0.0133 0.0962 -0.0107 347 PHE A O +107 C CB . PHE A 29 ? 0.4521 0.4184 0.4395 0.0320 0.0886 -0.0286 347 PHE A CB +108 C CG . PHE A 29 ? 0.4246 0.3993 0.4375 0.0423 0.0906 -0.0362 347 PHE A CG +109 C CD1 . PHE A 29 ? 0.4118 0.3891 0.4254 0.0488 0.1055 -0.0458 347 PHE A CD1 +110 C CD2 . PHE A 29 ? 0.3607 0.3398 0.3957 0.0464 0.0778 -0.0337 347 PHE A CD2 +111 C CE1 . PHE A 29 ? 0.4881 0.4736 0.5281 0.0602 0.1073 -0.0532 347 PHE A CE1 +112 C CE2 . PHE A 29 ? 0.3626 0.3488 0.4215 0.0579 0.0779 -0.0397 347 PHE A CE2 +113 C CZ . PHE A 29 ? 0.4007 0.3907 0.4642 0.0653 0.0927 -0.0497 347 PHE A CZ +114 N N . ALA A 30 ? 0.3391 0.3252 0.3404 0.0132 0.0940 -0.0113 348 ALA A N +115 C CA . ALA A 30 ? 0.3337 0.3171 0.3309 0.0048 0.0892 -0.0026 348 ALA A CA +116 C C . ALA A 30 ? 0.3197 0.2911 0.3052 0.0051 0.0728 0.0007 348 ALA A C +117 O O . ALA A 30 ? 0.3520 0.3205 0.3411 0.0103 0.0637 -0.0029 348 ALA A O +118 C CB . ALA A 30 ? 0.3871 0.3884 0.4156 0.0003 0.0896 -0.0020 348 ALA A CB +119 N N . SER A 31 ? 0.3246 0.2884 0.2968 -0.0005 0.0700 0.0077 349 SER A N +120 C CA . SER A 31 ? 0.3158 0.2746 0.2871 -0.0018 0.0563 0.0108 349 SER A CA +121 C C . SER A 31 ? 0.3405 0.3100 0.3356 -0.0033 0.0510 0.0104 349 SER A C +122 O O . SER A 31 ? 0.3303 0.3114 0.3425 -0.0063 0.0571 0.0097 349 SER A O +123 C CB . SER A 31 ? 0.3884 0.3386 0.3450 -0.0061 0.0552 0.0178 349 SER A CB +124 O OG . SER A 31 ? 0.3852 0.3252 0.3174 -0.0037 0.0553 0.0188 349 SER A OG +125 N N . VAL A 32 ? 0.2940 0.2596 0.2892 -0.0018 0.0394 0.0108 350 VAL A N +126 C CA . VAL A 32 ? 0.3147 0.2888 0.3272 -0.0018 0.0323 0.0104 350 VAL A CA +127 C C . VAL A 32 ? 0.3181 0.2976 0.3376 -0.0091 0.0329 0.0127 350 VAL A C +128 O O . VAL A 32 ? 0.3578 0.3495 0.3955 -0.0104 0.0304 0.0104 350 VAL A O +129 C CB . VAL A 32 ? 0.2931 0.2579 0.2987 0.0007 0.0215 0.0116 350 VAL A CB +130 C CG1 . VAL A 32 ? 0.3366 0.2921 0.3276 -0.0042 0.0185 0.0154 350 VAL A CG1 +131 C CG2 . VAL A 32 ? 0.2978 0.2697 0.3168 0.0027 0.0131 0.0117 350 VAL A CG2 +132 N N . TYR A 33 ? 0.3173 0.2879 0.3239 -0.0135 0.0355 0.0166 351 TYR A N +133 C CA . TYR A 33 ? 0.3277 0.3002 0.3411 -0.0203 0.0367 0.0178 351 TYR A CA +134 C C . TYR A 33 ? 0.3302 0.3118 0.3578 -0.0246 0.0470 0.0162 351 TYR A C +135 O O . TYR A 33 ? 0.3471 0.3355 0.3892 -0.0309 0.0470 0.0141 351 TYR A O +136 C CB . TYR A 33 ? 0.2913 0.2505 0.2889 -0.0224 0.0376 0.0226 351 TYR A CB +137 C CG . TYR A 33 ? 0.3410 0.2931 0.3286 -0.0231 0.0476 0.0266 351 TYR A CG +138 C CD1 . TYR A 33 ? 0.3536 0.3005 0.3255 -0.0181 0.0490 0.0280 351 TYR A CD1 +139 C CD2 . TYR A 33 ? 0.3683 0.3169 0.3599 -0.0292 0.0557 0.0289 351 TYR A CD2 +140 C CE1 . TYR A 33 ? 0.4038 0.3427 0.3613 -0.0183 0.0578 0.0326 351 TYR A CE1 +141 C CE2 . TYR A 33 ? 0.4269 0.3657 0.4055 -0.0298 0.0658 0.0345 351 TYR A CE2 +142 C CZ . TYR A 33 ? 0.4483 0.3824 0.4084 -0.0238 0.0664 0.0367 351 TYR A CZ +143 O OH . TYR A 33 ? 0.4805 0.4032 0.4224 -0.0239 0.0758 0.0430 351 TYR A OH +144 N N . ALA A 34 ? 0.2823 0.2642 0.3058 -0.0222 0.0565 0.0164 352 ALA A N +145 C CA . ALA A 34 ? 0.2776 0.2681 0.3138 -0.0269 0.0698 0.0151 352 ALA A CA +146 C C . ALA A 34 ? 0.3490 0.3563 0.4037 -0.0216 0.0722 0.0087 352 ALA A C +147 O O . ALA A 34 ? 0.3436 0.3554 0.4003 -0.0214 0.0856 0.0072 352 ALA A O +148 C CB . ALA A 34 ? 0.3503 0.3266 0.3641 -0.0282 0.0816 0.0209 352 ALA A CB +149 N N . TRP A 35 ? 0.3099 0.3261 0.3781 -0.0169 0.0597 0.0050 353 TRP A N +150 C CA . TRP A 35 ? 0.3133 0.3422 0.3974 -0.0084 0.0588 -0.0006 353 TRP A CA +151 C C . TRP A 35 ? 0.2800 0.3295 0.3910 -0.0111 0.0713 -0.0055 353 TRP A C +152 O O . TRP A 35 ? 0.2795 0.3389 0.4064 -0.0205 0.0747 -0.0060 353 TRP A O +153 C CB . TRP A 35 ? 0.2626 0.2962 0.3562 -0.0032 0.0420 -0.0018 353 TRP A CB +154 C CG . TRP A 35 ? 0.2276 0.2705 0.3342 -0.0100 0.0334 -0.0022 353 TRP A CG +155 C CD1 . TRP A 35 ? 0.2552 0.2864 0.3465 -0.0156 0.0265 0.0013 353 TRP A CD1 +156 C CD2 . TRP A 35 ? 0.2073 0.2739 0.3450 -0.0113 0.0297 -0.0078 353 TRP A CD2 +157 N NE1 . TRP A 35 ? 0.2387 0.2825 0.3463 -0.0208 0.0192 -0.0023 353 TRP A NE1 +158 C CE2 . TRP A 35 ? 0.2266 0.2929 0.3633 -0.0186 0.0200 -0.0078 353 TRP A CE2 +159 C CE3 . TRP A 35 ? 0.2159 0.3057 0.3842 -0.0069 0.0337 -0.0139 353 TRP A CE3 +160 C CZ2 . TRP A 35 ? 0.2566 0.3445 0.4200 -0.0224 0.0124 -0.0139 353 TRP A CZ2 +161 C CZ3 . TRP A 35 ? 0.2710 0.3847 0.4696 -0.0101 0.0261 -0.0194 353 TRP A CZ3 +162 C CH2 . TRP A 35 ? 0.2622 0.3747 0.4574 -0.0183 0.0149 -0.0195 353 TRP A CH2 +163 N N . ASN A 36 ? 0.3248 0.3807 0.4420 -0.0033 0.0790 -0.0101 354 ASN A N +164 C CA . ASN A 36 ? 0.3469 0.4236 0.4901 -0.0052 0.0942 -0.0156 354 ASN A CA +165 C C . ASN A 36 ? 0.3351 0.4380 0.5171 0.0005 0.0851 -0.0222 354 ASN A C +166 O O . ASN A 36 ? 0.3229 0.4236 0.5055 0.0109 0.0702 -0.0229 354 ASN A O +167 C CB . ASN A 36 ? 0.3983 0.4687 0.5275 0.0013 0.1087 -0.0184 354 ASN A CB +168 C CG . ASN A 36 ? 0.6424 0.7293 0.7892 -0.0039 0.1302 -0.0222 354 ASN A CG +169 O OD1 . ASN A 36 ? 0.8915 0.9708 1.0250 -0.0146 0.1430 -0.0171 354 ASN A OD1 +170 N ND2 . ASN A 36 ? 0.5642 0.6734 0.7420 0.0038 0.1352 -0.0309 354 ASN A ND2 +171 N N . ARG A 37 ? 0.2859 0.4132 0.5004 -0.0067 0.0935 -0.0267 355 ARG A N +172 C CA . ARG A 37 ? 0.2322 0.3898 0.4888 -0.0009 0.0852 -0.0343 355 ARG A CA +173 C C . ARG A 37 ? 0.2455 0.4273 0.5325 -0.0005 0.1052 -0.0417 355 ARG A C +174 O O . ARG A 37 ? 0.2697 0.4561 0.5615 -0.0137 0.1230 -0.0415 355 ARG A O +175 C CB . ARG A 37 ? 0.2387 0.4102 0.5148 -0.0109 0.0726 -0.0353 355 ARG A CB +176 C CG . ARG A 37 ? 0.2197 0.4289 0.5451 -0.0066 0.0653 -0.0445 355 ARG A CG +177 C CD . ARG A 37 ? 0.2578 0.4761 0.5935 -0.0121 0.0440 -0.0458 355 ARG A CD +178 N NE . ARG A 37 ? 0.2459 0.4463 0.5559 -0.0010 0.0230 -0.0405 355 ARG A NE +179 C CZ . ARG A 37 ? 0.2476 0.4557 0.5631 0.0001 0.0013 -0.0417 355 ARG A CZ +180 N NH1 . ARG A 37 ? 0.2404 0.4752 0.5878 -0.0095 -0.0039 -0.0492 355 ARG A NH1 +181 N NH2 . ARG A 37 ? 0.2977 0.4865 0.5859 0.0099 -0.0148 -0.0355 355 ARG A NH2 +182 N N . LYS A 38 ? 0.2283 0.4251 0.5368 0.0145 0.1027 -0.0481 356 LYS A N +183 C CA . LYS A 38 ? 0.2612 0.4857 0.6052 0.0174 0.1210 -0.0571 356 LYS A CA +184 C C . LYS A 38 ? 0.3125 0.5741 0.7082 0.0231 0.1073 -0.0645 356 LYS A C +185 O O . LYS A 38 ? 0.3391 0.5997 0.7375 0.0362 0.0851 -0.0638 356 LYS A O +186 C CB . LYS A 38 ? 0.3057 0.5179 0.6342 0.0321 0.1309 -0.0604 356 LYS A CB +187 C CG . LYS A 38 ? 0.3904 0.6324 0.7575 0.0386 0.1502 -0.0714 356 LYS A CG +188 C CD . LYS A 38 ? 0.4149 0.6556 0.7711 0.0256 0.1798 -0.0717 356 LYS A CD +189 C CE . LYS A 38 ? 0.5445 0.8068 0.9258 0.0337 0.1995 -0.0819 356 LYS A CE +190 N NZ . LYS A 38 ? 0.5869 0.8477 0.9535 0.0184 0.2227 -0.0792 356 LYS A NZ +191 N N . ARG A 39 ? 0.2955 0.5894 0.7318 0.0126 0.1196 -0.0710 357 ARG A N +192 C CA . ARG A 39 ? 0.3854 0.7204 0.8768 0.0177 0.1069 -0.0798 357 ARG A CA +193 C C . ARG A 39 ? 0.4568 0.8096 0.9716 0.0335 0.1167 -0.0869 357 ARG A C +194 O O . ARG A 39 ? 0.5430 0.8925 1.0492 0.0296 0.1415 -0.0883 357 ARG A O +195 C CB . ARG A 39 ? 0.4952 0.8504 1.0101 -0.0028 0.1116 -0.0823 357 ARG A CB +196 C CG . ARG A 39 ? 0.7007 1.0938 1.2607 0.0010 0.1021 -0.0901 357 ARG A CG +197 C CD . ARG A 39 ? 0.8443 1.2513 1.4211 -0.0206 0.1042 -0.0921 357 ARG A CD +198 N NE . ARG A 39 ? 0.9104 1.3070 1.4757 -0.0300 0.0848 -0.0898 357 ARG A NE +199 C CZ . ARG A 39 ? 0.8990 1.3160 1.4875 -0.0353 0.0645 -0.0948 357 ARG A CZ +200 N NH1 . ARG A 39 ? 0.7796 1.2306 1.4072 -0.0323 0.0605 -0.1019 357 ARG A NH1 +201 N NH2 . ARG A 39 ? 0.8794 1.2827 1.4511 -0.0438 0.0482 -0.0931 357 ARG A NH2 +202 N N . ILE A 40 ? 0.4059 0.7726 0.9425 0.0519 0.0959 -0.0899 358 ILE A N +203 C CA . ILE A 40 ? 0.4077 0.7870 0.9624 0.0693 0.1016 -0.0956 358 ILE A CA +204 C C . ILE A 40 ? 0.3639 0.7814 0.9636 0.0720 0.0875 -0.1004 358 ILE A C +205 O O . ILE A 40 ? 0.3786 0.8039 0.9880 0.0759 0.0607 -0.0984 358 ILE A O +206 C CB . ILE A 40 ? 0.4026 0.7578 0.9385 0.0914 0.0909 -0.0938 358 ILE A CB +207 C CG1 . ILE A 40 ? 0.4549 0.7735 0.9468 0.0873 0.1072 -0.0906 358 ILE A CG1 +208 C CG2 . ILE A 40 ? 0.4842 0.8517 1.0404 0.1101 0.0949 -0.0998 358 ILE A CG2 +209 C CD1 . ILE A 40 ? 0.4927 0.7743 0.9474 0.1020 0.0913 -0.0846 358 ILE A CD1 +210 N N . SER A 41 ? 0.3808 0.8221 1.0062 0.0695 0.1054 -0.1065 359 SER A N +211 C CA . SER A 41 ? 0.4550 0.9355 1.1260 0.0695 0.0945 -0.1117 359 SER A CA +212 C C . SER A 41 ? 0.4625 0.9646 1.1596 0.0770 0.1145 -0.1186 359 SER A C +213 O O . SER A 41 ? 0.4665 0.9533 1.1435 0.0761 0.1397 -0.1195 359 SER A O +214 C CB . SER A 41 ? 0.5470 1.0401 1.2281 0.0447 0.0942 -0.1118 359 SER A CB +215 O OG . SER A 41 ? 0.6607 1.1657 1.3538 0.0303 0.1215 -0.1153 359 SER A OG +216 N N . ASN A 42 ? 0.4365 0.9744 1.1774 0.0848 0.1023 -0.1237 360 ASN A N +217 C CA . ASN A 42 ? 0.3960 0.9625 1.1713 0.0911 0.1196 -0.1313 360 ASN A CA +218 C C . ASN A 42 ? 0.4629 1.0094 1.2185 0.1091 0.1353 -0.1327 360 ASN A C +219 O O . ASN A 42 ? 0.4504 0.9957 1.2005 0.1042 0.1635 -0.1365 360 ASN A O +220 C CB . ASN A 42 ? 0.4522 1.0340 1.2399 0.0670 0.1436 -0.1345 360 ASN A CB +221 C CG . ASN A 42 ? 0.5961 1.1954 1.4029 0.0484 0.1286 -0.1344 360 ASN A CG +222 O OD1 . ASN A 42 ? 0.6799 1.3038 1.5165 0.0556 0.1036 -0.1368 360 ASN A OD1 +223 N ND2 . ASN A 42 ? 0.6001 1.1843 1.3868 0.0248 0.1429 -0.1313 360 ASN A ND2 +224 N N . CYS A 43 ? 0.4899 1.0177 1.2317 0.1299 0.1164 -0.1295 361 CYS A N +225 C CA . CYS A 43 ? 0.5353 1.0392 1.2558 0.1481 0.1280 -0.1312 361 CYS A CA +226 C C . CYS A 43 ? 0.5711 1.0665 1.2947 0.1730 0.1021 -0.1281 361 CYS A C +227 O O . CYS A 43 ? 0.4935 0.9948 1.2250 0.1748 0.0748 -0.1227 361 CYS A O +228 C CB . CYS A 43 ? 0.4598 0.9222 1.1279 0.1391 0.1419 -0.1274 361 CYS A CB +229 S SG . CYS A 43 ? 0.4924 0.9264 1.1290 0.1325 0.1168 -0.1173 361 CYS A SG +230 N N . VAL A 44 ? 0.5720 1.0507 1.2859 0.1921 0.1111 -0.1311 362 VAL A N +231 C CA . VAL A 44 ? 0.5881 1.0495 1.2977 0.2168 0.0900 -0.1271 362 VAL A CA +232 C C . VAL A 44 ? 0.6812 1.0918 1.3388 0.2191 0.0893 -0.1220 362 VAL A C +233 O O . VAL A 44 ? 0.6393 1.0292 1.2699 0.2140 0.1121 -0.1264 362 VAL A O +234 C CB . VAL A 44 ? 0.6205 1.0968 1.3575 0.2381 0.0991 -0.1343 362 VAL A CB +235 C CG1 . VAL A 44 ? 0.5998 1.0676 1.3225 0.2347 0.1325 -0.1431 362 VAL A CG1 +236 C CG2 . VAL A 44 ? 0.6282 1.0775 1.3533 0.2634 0.0796 -0.1286 362 VAL A CG2 +237 N N . ALA A 45 ? 0.7164 1.1066 1.3583 0.2260 0.0629 -0.1126 363 ALA A N +238 C CA . ALA A 45 ? 0.7457 1.0879 1.3405 0.2277 0.0590 -0.1069 363 ALA A CA +239 C C . ALA A 45 ? 0.8016 1.1181 1.3880 0.2524 0.0453 -0.1028 363 ALA A C +240 O O . ALA A 45 ? 0.8453 1.1745 1.4518 0.2648 0.0237 -0.0971 363 ALA A O +241 C CB . ALA A 45 ? 0.6724 1.0066 1.2502 0.2133 0.0408 -0.0981 363 ALA A CB +242 N N . ASP A 46 ? 0.7807 1.0595 1.3357 0.2592 0.0577 -0.1054 364 ASP A N +243 C CA . ASP A 46 ? 0.8113 1.0553 1.3499 0.2800 0.0456 -0.1002 364 ASP A CA +244 C C . ASP A 46 ? 0.7681 0.9672 1.2609 0.2724 0.0369 -0.0923 364 ASP A C +245 O O . ASP A 46 ? 0.7726 0.9450 1.2356 0.2651 0.0529 -0.0975 364 ASP A O +246 C CB . ASP A 46 ? 0.8769 1.1101 1.4160 0.2949 0.0652 -0.1103 364 ASP A CB +247 C CG . ASP A 46 ? 1.0031 1.2012 1.5297 0.3170 0.0521 -0.1042 364 ASP A CG +248 O OD1 . ASP A 46 ? 1.0640 1.2311 1.5695 0.3255 0.0656 -0.1105 364 ASP A OD1 +249 O OD2 . ASP A 46 ? 1.0426 1.2422 1.5778 0.3253 0.0280 -0.0925 364 ASP A OD2 +250 N N . TYR A 47 ? 0.7460 0.9376 1.2324 0.2735 0.0114 -0.0798 365 TYR A N +251 C CA . TYR A 47 ? 0.6962 0.8485 1.1416 0.2653 0.0013 -0.0709 365 TYR A CA +252 C C . TYR A 47 ? 0.7181 0.8206 1.1325 0.2785 -0.0007 -0.0665 365 TYR A C +253 O O . TYR A 47 ? 0.6491 0.7147 1.0270 0.2700 -0.0010 -0.0629 365 TYR A O +254 C CB . TYR A 47 ? 0.6825 0.8454 1.1294 0.2610 -0.0249 -0.0589 365 TYR A CB +255 C CG . TYR A 47 ? 0.6709 0.8787 1.1451 0.2450 -0.0242 -0.0632 365 TYR A CG +256 C CD1 . TYR A 47 ? 0.6670 0.8738 1.1271 0.2248 -0.0162 -0.0650 365 TYR A CD1 +257 C CD2 . TYR A 47 ? 0.6468 0.8976 1.1618 0.2496 -0.0306 -0.0659 365 TYR A CD2 +258 C CE1 . TYR A 47 ? 0.6559 0.9007 1.1402 0.2089 -0.0142 -0.0687 365 TYR A CE1 +259 C CE2 . TYR A 47 ? 0.6426 0.9325 1.1824 0.2330 -0.0293 -0.0705 365 TYR A CE2 +260 C CZ . TYR A 47 ? 0.6781 0.9637 1.2017 0.2124 -0.0207 -0.0717 365 TYR A CZ +261 O OH . TYR A 47 ? 0.6894 1.0104 1.2363 0.1947 -0.0182 -0.0760 365 TYR A OH +262 N N . SER A 48 ? 0.7970 0.8970 1.2259 0.2985 -0.0014 -0.0670 366 SER A N +263 C CA . SER A 48 ? 0.8884 0.9384 1.2882 0.3102 -0.0021 -0.0627 366 SER A CA +264 C C . SER A 48 ? 0.9313 0.9537 1.3056 0.3037 0.0202 -0.0746 366 SER A C +265 O O . SER A 48 ? 1.0447 1.0199 1.3844 0.3035 0.0189 -0.0709 366 SER A O +266 C CB . SER A 48 ? 0.9402 0.9948 1.3638 0.3338 -0.0062 -0.0612 366 SER A CB +267 O OG . SER A 48 ? 0.9671 1.0395 1.4064 0.3403 -0.0300 -0.0484 366 SER A OG +268 N N . VAL A 49 ? 0.8534 0.9033 1.2418 0.2969 0.0407 -0.0887 367 VAL A N +269 C CA . VAL A 49 ? 0.8904 0.9141 1.2490 0.2890 0.0607 -0.1001 367 VAL A CA +270 C C . VAL A 49 ? 0.9352 0.9337 1.2595 0.2704 0.0560 -0.0953 367 VAL A C +271 O O . VAL A 49 ? 0.9941 0.9544 1.2844 0.2660 0.0631 -0.0999 367 VAL A O +272 C CB . VAL A 49 ? 0.9036 0.9622 1.2800 0.2838 0.0844 -0.1146 367 VAL A CB +273 C CG1 . VAL A 49 ? 0.9172 1.0056 1.3323 0.3016 0.0882 -0.1190 367 VAL A CG1 +274 C CG2 . VAL A 49 ? 0.8976 0.9887 1.2837 0.2637 0.0871 -0.1131 367 VAL A CG2 +275 N N . LEU A 50 ? 0.8383 0.8574 1.1709 0.2591 0.0439 -0.0867 368 LEU A N +276 C CA . LEU A 50 ? 0.8160 0.8107 1.1175 0.2431 0.0385 -0.0813 368 LEU A CA +277 C C . LEU A 50 ? 0.8588 0.8111 1.1343 0.2481 0.0200 -0.0686 368 LEU A C +278 O O . LEU A 50 ? 0.8515 0.7649 1.0934 0.2408 0.0226 -0.0691 368 LEU A O +279 C CB . LEU A 50 ? 0.8228 0.8514 1.1391 0.2290 0.0324 -0.0763 368 LEU A CB +280 C CG . LEU A 50 ? 0.7649 0.8326 1.1014 0.2178 0.0522 -0.0859 368 LEU A CG +281 C CD1 . LEU A 50 ? 0.7048 0.8047 1.0562 0.2050 0.0414 -0.0778 368 LEU A CD1 +282 C CD2 . LEU A 50 ? 0.7089 0.7565 1.0066 0.2015 0.0709 -0.0907 368 LEU A CD2 +283 N N . TYR A 51 ? 0.8902 0.8490 1.1791 0.2594 0.0017 -0.0568 369 TYR A N +284 C CA . TYR A 51 ? 1.0093 0.9279 1.2706 0.2622 -0.0147 -0.0420 369 TYR A CA +285 C C . TYR A 51 ? 1.0530 0.9270 1.2927 0.2689 -0.0053 -0.0453 369 TYR A C +286 O O . TYR A 51 ? 1.1096 0.9425 1.3168 0.2613 -0.0096 -0.0380 369 TYR A O +287 C CB . TYR A 51 ? 1.0958 1.0308 1.3751 0.2748 -0.0339 -0.0294 369 TYR A CB +288 C CG . TYR A 51 ? 1.2056 1.1023 1.4538 0.2749 -0.0505 -0.0118 369 TYR A CG +289 C CD1 . TYR A 51 ? 1.2072 1.0803 1.4216 0.2580 -0.0553 -0.0045 369 TYR A CD1 +290 C CD2 . TYR A 51 ? 1.2630 1.1472 1.5151 0.2916 -0.0603 -0.0018 369 TYR A CD2 +291 C CE1 . TYR A 51 ? 1.2875 1.1263 1.4718 0.2562 -0.0678 0.0121 369 TYR A CE1 +292 C CE2 . TYR A 51 ? 1.3082 1.1570 1.5304 0.2904 -0.0734 0.0153 369 TYR A CE2 +293 C CZ . TYR A 51 ? 1.3452 1.1718 1.5330 0.2719 -0.0762 0.0221 369 TYR A CZ +294 O OH . TYR A 51 ? 1.3855 1.1779 1.5427 0.2690 -0.0866 0.0391 369 TYR A OH +295 N N . ASN A 52 ? 0.9656 0.8471 1.2231 0.2821 0.0084 -0.0567 370 ASN A N +296 C CA . ASN A 52 ? 1.0445 0.8849 1.2819 0.2877 0.0201 -0.0635 370 ASN A CA +297 C C . ASN A 52 ? 1.1448 0.9831 1.3663 0.2749 0.0385 -0.0803 370 ASN A C +298 O O . ASN A 52 ? 1.2086 1.0670 1.4435 0.2805 0.0543 -0.0946 370 ASN A O +299 C CB . ASN A 52 ? 1.0015 0.8482 1.2631 0.3102 0.0247 -0.0671 370 ASN A CB +300 C CG . ASN A 52 ? 1.0634 0.9337 1.3520 0.3231 0.0067 -0.0532 370 ASN A CG +301 O OD1 . ASN A 52 ? 1.1294 1.0368 1.4531 0.3360 0.0088 -0.0581 370 ASN A OD1 +302 N ND2 . ASN A 52 ? 1.0958 0.9452 1.3673 0.3191 -0.0113 -0.0360 370 ASN A ND2 +303 N N . SER A 53 ? 1.1546 0.9692 1.3464 0.2571 0.0364 -0.0785 371 SER A N +304 C CA . SER A 53 ? 1.1063 0.9159 1.2787 0.2441 0.0519 -0.0937 371 SER A CA +305 C C . SER A 53 ? 1.1333 0.8952 1.2676 0.2321 0.0509 -0.0945 371 SER A C +306 O O . SER A 53 ? 1.2007 0.9503 1.3161 0.2265 0.0632 -0.1098 371 SER A O +307 C CB . SER A 53 ? 1.0334 0.8788 1.2153 0.2297 0.0546 -0.0945 371 SER A CB +308 O OG . SER A 53 ? 0.9600 0.8016 1.1198 0.2161 0.0711 -0.1069 371 SER A OG +309 N N . ALA A 54 ? 1.0890 0.8259 1.2109 0.2262 0.0364 -0.0792 372 ALA A N +310 C CA . ALA A 54 ? 1.0634 0.7593 1.1546 0.2108 0.0350 -0.0788 372 ALA A CA +311 C C . ALA A 54 ? 0.9781 0.6805 1.0468 0.1912 0.0385 -0.0854 372 ALA A C +312 O O . ALA A 54 ? 1.0463 0.7215 1.0883 0.1755 0.0356 -0.0835 372 ALA A O +313 C CB . ALA A 54 ? 1.0758 0.7411 1.1632 0.2144 0.0455 -0.0901 372 ALA A CB +314 N N . SER A 55 ? 0.8168 0.5600 0.8962 0.1874 0.0467 -0.0900 373 SER A N +315 C CA . SER A 55 ? 0.8231 0.5789 0.8807 0.1661 0.0511 -0.0914 373 SER A CA +316 C C . SER A 55 ? 0.7580 0.5297 0.8122 0.1528 0.0391 -0.0743 373 SER A C +317 O O . SER A 55 ? 0.7046 0.4818 0.7396 0.1352 0.0404 -0.0733 373 SER A O +318 C CB . SER A 55 ? 0.8913 0.6796 0.9578 0.1672 0.0671 -0.1032 373 SER A CB +319 O OG . SER A 55 ? 0.9284 0.7459 1.0311 0.1829 0.0693 -0.1023 373 SER A OG +320 N N . PHE A 56 ? 0.6588 0.4372 0.7300 0.1613 0.0272 -0.0612 374 PHE A N +321 C CA . PHE A 56 ? 0.5683 0.3633 0.6366 0.1501 0.0166 -0.0465 374 PHE A CA +322 C C . PHE A 56 ? 0.6412 0.4032 0.6902 0.1448 0.0048 -0.0340 374 PHE A C +323 O O . PHE A 56 ? 0.7420 0.4802 0.7945 0.1582 -0.0018 -0.0292 374 PHE A O +324 C CB . PHE A 56 ? 0.5460 0.3748 0.6449 0.1615 0.0106 -0.0411 374 PHE A CB +325 C CG . PHE A 56 ? 0.5009 0.3643 0.6226 0.1653 0.0238 -0.0527 374 PHE A CG +326 C CD1 . PHE A 56 ? 0.5083 0.3877 0.6188 0.1496 0.0348 -0.0572 374 PHE A CD1 +327 C CD2 . PHE A 56 ? 0.5509 0.4305 0.7055 0.1847 0.0261 -0.0587 374 PHE A CD2 +328 C CE1 . PHE A 56 ? 0.4824 0.3913 0.6112 0.1518 0.0492 -0.0668 374 PHE A CE1 +329 C CE2 . PHE A 56 ? 0.5641 0.4769 0.7413 0.1868 0.0410 -0.0698 374 PHE A CE2 +330 C CZ . PHE A 56 ? 0.5159 0.4422 0.6787 0.1696 0.0533 -0.0734 374 PHE A CZ +331 N N . SER A 57 ? 0.6164 0.3766 0.6451 0.1258 0.0030 -0.0285 375 SER A N +332 C CA . SER A 57 ? 0.6567 0.3899 0.6678 0.1184 -0.0060 -0.0158 375 SER A CA +333 C C . SER A 57 ? 0.6361 0.3835 0.6519 0.1209 -0.0178 -0.0005 375 SER A C +334 O O . SER A 57 ? 0.6762 0.3988 0.6791 0.1212 -0.0258 0.0115 375 SER A O +335 C CB . SER A 57 ? 0.5682 0.2950 0.5586 0.0973 -0.0024 -0.0175 375 SER A CB +336 O OG . SER A 57 ? 0.6178 0.3783 0.6108 0.0883 -0.0001 -0.0181 375 SER A OG +337 N N . THR A 58 ? 0.5098 0.2950 0.5417 0.1218 -0.0187 -0.0010 376 THR A N +338 C CA . THR A 58 ? 0.5369 0.3384 0.5760 0.1260 -0.0310 0.0106 376 THR A CA +339 C C . THR A 58 ? 0.5056 0.3364 0.5767 0.1423 -0.0328 0.0052 376 THR A C +340 O O . THR A 58 ? 0.5105 0.3662 0.5975 0.1409 -0.0222 -0.0058 376 THR A O +341 C CB . THR A 58 ? 0.5480 0.3696 0.5782 0.1089 -0.0314 0.0147 376 THR A CB +342 O OG1 . THR A 58 ? 0.5941 0.3907 0.5981 0.0953 -0.0311 0.0210 376 THR A OG1 +343 C CG2 . THR A 58 ? 0.5195 0.3628 0.5594 0.1134 -0.0437 0.0230 376 THR A CG2 +344 N N . PHE A 59 ? 0.4897 0.3179 0.5706 0.1578 -0.0461 0.0132 377 PHE A N +345 C CA . PHE A 59 ? 0.4987 0.3610 0.6146 0.1728 -0.0511 0.0090 377 PHE A CA +346 C C . PHE A 59 ? 0.5605 0.4230 0.6747 0.1812 -0.0714 0.0227 377 PHE A C +347 O O . PHE A 59 ? 0.5733 0.4151 0.6882 0.1985 -0.0812 0.0289 377 PHE A O +348 C CB . PHE A 59 ? 0.5306 0.3885 0.6683 0.1912 -0.0440 -0.0015 377 PHE A CB +349 C CG . PHE A 59 ? 0.5937 0.4955 0.7726 0.2016 -0.0413 -0.0110 377 PHE A CG +350 C CD1 . PHE A 59 ? 0.6189 0.5478 0.8212 0.2111 -0.0573 -0.0053 377 PHE A CD1 +351 C CD2 . PHE A 59 ? 0.6029 0.5197 0.7970 0.2010 -0.0225 -0.0261 377 PHE A CD2 +352 C CE1 . PHE A 59 ? 0.6172 0.5895 0.8620 0.2193 -0.0545 -0.0151 377 PHE A CE1 +353 C CE2 . PHE A 59 ? 0.6134 0.5716 0.8474 0.2093 -0.0175 -0.0350 377 PHE A CE2 +354 C CZ . PHE A 59 ? 0.6507 0.6378 0.9125 0.2180 -0.0334 -0.0298 377 PHE A CZ +355 N N . LYS A 60 ? 0.5501 0.4342 0.6598 0.1692 -0.0778 0.0272 378 LYS A N +356 C CA . LYS A 60 ? 0.5882 0.4711 0.6876 0.1735 -0.0972 0.0400 378 LYS A CA +357 C C . LYS A 60 ? 0.5381 0.4669 0.6688 0.1769 -0.1065 0.0352 378 LYS A C +358 O O . LYS A 60 ? 0.5032 0.4594 0.6452 0.1630 -0.0976 0.0271 378 LYS A O +359 C CB . LYS A 60 ? 0.5499 0.4136 0.6113 0.1548 -0.0972 0.0494 378 LYS A CB +360 C CG . LYS A 60 ? 0.7454 0.5665 0.7787 0.1484 -0.0875 0.0535 378 LYS A CG +361 C CD . LYS A 60 ? 0.8804 0.6842 0.8792 0.1317 -0.0881 0.0637 378 LYS A CD +362 C CE . LYS A 60 ? 1.0270 0.7884 1.0013 0.1254 -0.0796 0.0683 378 LYS A CE +363 N NZ . LYS A 60 ? 1.1153 0.8537 1.0562 0.1159 -0.0835 0.0825 378 LYS A NZ +364 N N . CYS A 61 ? 0.4873 0.4236 0.6319 0.1950 -0.1249 0.0403 379 CYS A N +365 C CA . CYS A 61 ? 0.5336 0.5156 0.7120 0.1989 -0.1362 0.0347 379 CYS A CA +366 C C . CYS A 61 ? 0.5793 0.5605 0.7362 0.1978 -0.1580 0.0459 379 CYS A C +367 O O . CYS A 61 ? 0.5606 0.5081 0.6829 0.2014 -0.1653 0.0595 379 CYS A O +368 C CB . CYS A 61 ? 0.5755 0.5782 0.7946 0.2201 -0.1391 0.0284 379 CYS A CB +369 S SG . CYS A 61 ? 0.6977 0.7101 0.9483 0.2231 -0.1135 0.0114 379 CYS A SG +370 N N . TYR A 62 ? 0.5226 0.5416 0.6973 0.1888 -0.1643 0.0395 380 TYR A N +371 C CA . TYR A 62 ? 0.4987 0.5215 0.6527 0.1848 -0.1840 0.0467 380 TYR A CA +372 C C . TYR A 62 ? 0.5741 0.6424 0.7671 0.1916 -0.1979 0.0391 380 TYR A C +373 O O . TYR A 62 ? 0.5423 0.6474 0.7782 0.1884 -0.1907 0.0254 380 TYR A O +374 C CB . TYR A 62 ? 0.4330 0.4538 0.5622 0.1596 -0.1733 0.0448 380 TYR A CB +375 C CG . TYR A 62 ? 0.5060 0.4868 0.5991 0.1494 -0.1560 0.0511 380 TYR A CG +376 C CD1 . TYR A 62 ? 0.4337 0.4129 0.5377 0.1422 -0.1343 0.0432 380 TYR A CD1 +377 C CD2 . TYR A 62 ? 0.5651 0.5104 0.6134 0.1469 -0.1616 0.0646 380 TYR A CD2 +378 C CE1 . TYR A 62 ? 0.4433 0.3888 0.5172 0.1329 -0.1206 0.0477 380 TYR A CE1 +379 C CE2 . TYR A 62 ? 0.5576 0.4697 0.5779 0.1367 -0.1458 0.0693 380 TYR A CE2 +380 C CZ . TYR A 62 ? 0.5238 0.4372 0.5584 0.1298 -0.1264 0.0604 380 TYR A CZ +381 O OH . TYR A 62 ? 0.5610 0.4440 0.5701 0.1193 -0.1127 0.0640 380 TYR A OH +382 N N . GLY A 63 ? 0.6786 0.7448 0.8566 0.1994 -0.2152 0.0481 381 GLY A N +383 C CA . GLY A 63 ? 0.6683 0.7765 0.8809 0.2054 -0.2292 0.0419 381 GLY A CA +384 C C . GLY A 63 ? 0.6641 0.7851 0.9122 0.2243 -0.2272 0.0400 381 GLY A C +385 O O . GLY A 63 ? 0.8208 0.9564 1.0790 0.2360 -0.2429 0.0438 381 GLY A O +386 N N . VAL A 64 ? 0.6543 0.7700 0.9210 0.2275 -0.2077 0.0338 382 VAL A N +387 C CA . VAL A 64 ? 0.6465 0.7707 0.9452 0.2453 -0.2017 0.0307 382 VAL A CA +388 C C . VAL A 64 ? 0.7254 0.8002 0.9947 0.2538 -0.1918 0.0400 382 VAL A C +389 O O . VAL A 64 ? 0.7493 0.7889 0.9811 0.2435 -0.1855 0.0456 382 VAL A O +390 C CB . VAL A 64 ? 0.6721 0.8340 1.0195 0.2414 -0.1842 0.0133 382 VAL A CB +391 C CG1 . VAL A 64 ? 0.6838 0.8902 1.0570 0.2275 -0.1911 0.0040 382 VAL A CG1 +392 C CG2 . VAL A 64 ? 0.7240 0.8631 1.0586 0.2319 -0.1626 0.0087 382 VAL A CG2 +393 N N . SER A 65 ? 0.7507 0.8229 1.0383 0.2723 -0.1900 0.0411 383 SER A N +394 C CA . SER A 65 ? 0.8145 0.8378 1.0746 0.2791 -0.1801 0.0491 383 SER A CA +395 C C . SER A 65 ? 0.8900 0.9122 1.1702 0.2794 -0.1566 0.0356 383 SER A C +396 O O . SER A 65 ? 0.8752 0.9365 1.1974 0.2823 -0.1490 0.0222 383 SER A O +397 C CB . SER A 65 ? 0.8621 0.8726 1.1225 0.2995 -0.1913 0.0602 383 SER A CB +398 O OG . SER A 65 ? 0.9430 0.9229 1.2031 0.3101 -0.1766 0.0600 383 SER A OG +399 N N . PRO A 66 ? 1.0075 0.9855 1.2572 0.2749 -0.1435 0.0383 384 PRO A N +400 C CA . PRO A 66 ? 1.0501 1.0248 1.3137 0.2739 -0.1210 0.0244 384 PRO A CA +401 C C . PRO A 66 ? 1.1198 1.1126 1.4205 0.2920 -0.1133 0.0159 384 PRO A C +402 O O . PRO A 66 ? 1.0499 1.0793 1.3850 0.2911 -0.1020 0.0016 384 PRO A O +403 C CB . PRO A 66 ? 1.0762 0.9955 1.2976 0.2685 -0.1134 0.0315 384 PRO A CB +404 C CG . PRO A 66 ? 1.1173 1.0112 1.3070 0.2693 -0.1303 0.0503 384 PRO A CG +405 C CD . PRO A 66 ? 1.0735 1.0049 1.2738 0.2672 -0.1479 0.0530 384 PRO A CD +406 N N . THR A 67 ? 1.2034 1.1704 1.4978 0.3082 -0.1178 0.0246 385 THR A N +407 C CA . THR A 67 ? 1.1958 1.1870 1.5290 0.3277 -0.1159 0.0188 385 THR A CA +408 C C . THR A 67 ? 1.2009 1.2389 1.5626 0.3317 -0.1346 0.0209 385 THR A C +409 O O . THR A 67 ? 1.2692 1.3147 1.6155 0.3202 -0.1494 0.0276 385 THR A O +410 C CB . THR A 67 ? 1.1961 1.1466 1.5161 0.3447 -0.1170 0.0285 385 THR A CB +411 O OG1 . THR A 67 ? 1.2334 1.2109 1.5920 0.3657 -0.1207 0.0260 385 THR A OG1 +412 C CG2 . THR A 67 ? 1.1813 1.0992 1.4634 0.3420 -0.1347 0.0484 385 THR A CG2 +413 N N . LYS A 68 ? 1.0944 1.1644 1.4978 0.3476 -0.1335 0.0142 386 LYS A N +414 C CA . LYS A 68 ? 1.0193 1.1401 1.4577 0.3505 -0.1491 0.0126 386 LYS A CA +415 C C . LYS A 68 ? 0.9056 1.0668 1.3639 0.3308 -0.1423 -0.0002 386 LYS A C +416 O O . LYS A 68 ? 0.8068 1.0065 1.2862 0.3263 -0.1567 -0.0012 386 LYS A O +417 C CB . LYS A 68 ? 0.9865 1.0985 1.4020 0.3530 -0.1764 0.0294 386 LYS A CB +418 C CG . LYS A 68 ? 0.9927 1.0633 1.3855 0.3709 -0.1850 0.0451 386 LYS A CG +419 C CD . LYS A 68 ? 0.9911 1.0811 1.3923 0.3830 -0.2113 0.0559 386 LYS A CD +420 C CE . LYS A 68 ? 1.0530 1.1110 1.4467 0.4057 -0.2175 0.0694 386 LYS A CE +421 N NZ . LYS A 68 ? 1.0935 1.1148 1.4395 0.4038 -0.2347 0.0893 386 LYS A NZ +422 N N . LEU A 69 ? 0.9418 1.0942 1.3929 0.3183 -0.1206 -0.0101 387 LEU A N +423 C CA . LEU A 69 ? 0.8872 1.0729 1.3537 0.2983 -0.1124 -0.0208 387 LEU A CA +424 C C . LEU A 69 ? 0.8709 1.1048 1.3880 0.2999 -0.0983 -0.0354 387 LEU A C +425 O O . LEU A 69 ? 0.7609 1.0323 1.3003 0.2849 -0.0974 -0.0423 387 LEU A O +426 C CB . LEU A 69 ? 0.8552 1.0114 1.2915 0.2836 -0.0953 -0.0243 387 LEU A CB +427 C CG . LEU A 69 ? 0.8652 1.0015 1.2651 0.2676 -0.1067 -0.0155 387 LEU A CG +428 C CD1 . LEU A 69 ? 0.7971 0.9024 1.1693 0.2560 -0.0894 -0.0190 387 LEU A CD1 +429 C CD2 . LEU A 69 ? 0.8819 1.0601 1.3022 0.2535 -0.1157 -0.0191 387 LEU A CD2 +430 N N . ASN A 70 ? 0.9107 1.1435 1.4456 0.3168 -0.0861 -0.0405 388 ASN A N +431 C CA . ASN A 70 ? 0.9047 1.1808 1.4848 0.3178 -0.0690 -0.0548 388 ASN A CA +432 C C . ASN A 70 ? 0.8035 1.1252 1.4264 0.3260 -0.0851 -0.0547 388 ASN A C +433 O O . ASN A 70 ? 0.7963 1.1572 1.4605 0.3268 -0.0719 -0.0661 388 ASN A O +434 C CB . ASN A 70 ? 0.9878 1.2450 1.5690 0.3330 -0.0485 -0.0615 388 ASN A CB +435 C CG . ASN A 70 ? 1.0701 1.2862 1.6117 0.3235 -0.0310 -0.0645 388 ASN A CG +436 O OD1 . ASN A 70 ? 1.0773 1.3049 1.6181 0.3064 -0.0137 -0.0735 388 ASN A OD1 +437 N ND2 . ASN A 70 ? 1.1390 1.3061 1.6469 0.3337 -0.0353 -0.0566 388 ASN A ND2 +438 N N . ASP A 71 ? 0.7887 1.1066 1.4020 0.3314 -0.1129 -0.0424 389 ASP A N +439 C CA . ASP A 71 ? 0.8600 1.2206 1.5114 0.3391 -0.1312 -0.0422 389 ASP A CA +440 C C . ASP A 71 ? 0.8588 1.2510 1.5184 0.3179 -0.1430 -0.0445 389 ASP A C +441 O O . ASP A 71 ? 0.8707 1.2952 1.5553 0.3217 -0.1627 -0.0434 389 ASP A O +442 C CB . ASP A 71 ? 0.9092 1.2467 1.5451 0.3602 -0.1551 -0.0270 389 ASP A CB +443 C CG . ASP A 71 ? 0.9833 1.2797 1.6035 0.3793 -0.1439 -0.0230 389 ASP A CG +444 O OD1 . ASP A 71 ? 1.0260 1.2813 1.6112 0.3890 -0.1577 -0.0082 389 ASP A OD1 +445 O OD2 . ASP A 71 ? 0.9914 1.2951 1.6327 0.3841 -0.1204 -0.0347 389 ASP A OD2 +446 N N . LEU A 72 ? 0.8327 1.2160 1.4721 0.2960 -0.1316 -0.0483 390 LEU A N +447 C CA . LEU A 72 ? 0.8012 1.2059 1.4410 0.2751 -0.1426 -0.0498 390 LEU A CA +448 C C . LEU A 72 ? 0.7543 1.1956 1.4281 0.2564 -0.1208 -0.0643 390 LEU A C +449 O O . LEU A 72 ? 0.7664 1.2064 1.4492 0.2560 -0.0945 -0.0719 390 LEU A O +450 C CB . LEU A 72 ? 0.8573 1.2210 1.4445 0.2635 -0.1486 -0.0409 390 LEU A CB +451 C CG . LEU A 72 ? 0.9004 1.2382 1.4522 0.2720 -0.1765 -0.0257 390 LEU A CG +452 C CD1 . LEU A 72 ? 0.9370 1.3124 1.5102 0.2695 -0.1995 -0.0263 390 LEU A CD1 +453 C CD2 . LEU A 72 ? 0.8618 1.1681 1.4001 0.2961 -0.1799 -0.0157 390 LEU A CD2 +454 N N . CYS A 73 ? 0.7304 1.2024 1.4202 0.2400 -0.1314 -0.0680 391 CYS A N +455 C CA . CYS A 73 ? 0.7289 1.2324 1.4469 0.2184 -0.1121 -0.0801 391 CYS A CA +456 C C . CYS A 73 ? 0.6717 1.1711 1.3687 0.1954 -0.1206 -0.0792 391 CYS A C +457 O O . CYS A 73 ? 0.6470 1.1379 1.3232 0.1967 -0.1465 -0.0719 391 CYS A O +458 C CB . CYS A 73 ? 0.8147 1.3693 1.5880 0.2208 -0.1137 -0.0888 391 CYS A CB +459 S SG . CYS A 73 ? 0.9545 1.5219 1.7616 0.2436 -0.0949 -0.0940 391 CYS A SG +460 N N . PHE A 74 ? 0.6291 1.1333 1.3295 0.1744 -0.0978 -0.0863 392 PHE A N +461 C CA . PHE A 74 ? 0.5459 1.0441 1.2269 0.1518 -0.1018 -0.0862 392 PHE A CA +462 C C . PHE A 74 ? 0.5139 1.0398 1.2242 0.1295 -0.0797 -0.0967 392 PHE A C +463 O O . PHE A 74 ? 0.4382 0.9776 1.1720 0.1305 -0.0560 -0.1026 392 PHE A O +464 C CB . PHE A 74 ? 0.5272 0.9807 1.1607 0.1493 -0.0965 -0.0790 392 PHE A CB +465 C CG . PHE A 74 ? 0.5732 0.9939 1.1733 0.1691 -0.1162 -0.0675 392 PHE A CG +466 C CD1 . PHE A 74 ? 0.5804 0.9933 1.1581 0.1698 -0.1441 -0.0601 392 PHE A CD1 +467 C CD2 . PHE A 74 ? 0.5987 0.9937 1.1865 0.1862 -0.1059 -0.0639 392 PHE A CD2 +468 C CE1 . PHE A 74 ? 0.6805 1.0596 1.2233 0.1868 -0.1604 -0.0477 392 PHE A CE1 +469 C CE2 . PHE A 74 ? 0.6338 0.9945 1.1889 0.2030 -0.1227 -0.0522 392 PHE A CE2 +470 C CZ . PHE A 74 ? 0.6909 1.0432 1.2229 0.2031 -0.1495 -0.0433 392 PHE A CZ +471 N N . THR A 75 ? 0.5408 1.0728 1.2471 0.1088 -0.0871 -0.0988 393 THR A N +472 C CA . THR A 75 ? 0.5860 1.1364 1.3134 0.0851 -0.0653 -0.1070 393 THR A CA +473 C C . THR A 75 ? 0.6164 1.1393 1.3187 0.0749 -0.0371 -0.1053 393 THR A C +474 O O . THR A 75 ? 0.6695 1.2029 1.3883 0.0650 -0.0104 -0.1102 393 THR A O +475 C CB . THR A 75 ? 0.6705 1.2310 1.3984 0.0659 -0.0812 -0.1100 393 THR A CB +476 O OG1 . THR A 75 ? 0.7908 1.3171 1.4756 0.0565 -0.0846 -0.1045 393 THR A OG1 +477 C CG2 . THR A 75 ? 0.7232 1.3053 1.4658 0.0775 -0.1129 -0.1102 393 THR A CG2 +478 N N . ASN A 76 ? 0.5741 1.0615 1.2354 0.0769 -0.0422 -0.0979 394 ASN A N +479 C CA . ASN A 76 ? 0.5528 1.0135 1.1888 0.0691 -0.0171 -0.0957 394 ASN A CA +480 C C . ASN A 76 ? 0.4693 0.8949 1.0690 0.0845 -0.0263 -0.0877 394 ASN A C +481 O O . ASN A 76 ? 0.5148 0.9304 1.0987 0.0921 -0.0525 -0.0822 394 ASN A O +482 C CB . ASN A 76 ? 0.5765 1.0302 1.2005 0.0427 -0.0077 -0.0964 394 ASN A CB +483 C CG . ASN A 76 ? 0.7696 1.2508 1.4253 0.0253 0.0073 -0.1036 394 ASN A CG +484 O OD1 . ASN A 76 ? 0.8344 1.3322 1.5049 0.0135 -0.0061 -0.1074 394 ASN A OD1 +485 N ND2 . ASN A 76 ? 0.8022 1.2873 1.4671 0.0236 0.0352 -0.1057 394 ASN A ND2 +486 N N . VAL A 77 ? 0.3409 0.7464 0.9253 0.0889 -0.0044 -0.0868 395 VAL A N +487 C CA . VAL A 77 ? 0.3157 0.6838 0.8633 0.0989 -0.0076 -0.0799 395 VAL A CA +488 C C . VAL A 77 ? 0.2320 0.5732 0.7416 0.0788 0.0129 -0.0758 395 VAL A C +489 O O . VAL A 77 ? 0.3225 0.6755 0.8460 0.0681 0.0381 -0.0812 395 VAL A O +490 C CB . VAL A 77 ? 0.3237 0.6795 0.8689 0.1202 0.0000 -0.0803 395 VAL A CB +491 C CG1 . VAL A 77 ? 0.2967 0.6040 0.7897 0.1241 0.0019 -0.0719 395 VAL A CG1 +492 C CG2 . VAL A 77 ? 0.3428 0.7112 0.9058 0.1395 -0.0225 -0.0788 395 VAL A CG2 +493 N N . TYR A 78 ? 0.2182 0.5233 0.6790 0.0734 0.0023 -0.0656 396 TYR A N +494 C CA . TYR A 78 ? 0.2192 0.4938 0.6387 0.0583 0.0190 -0.0601 396 TYR A CA +495 C C . TYR A 78 ? 0.2910 0.5277 0.6695 0.0692 0.0207 -0.0536 396 TYR A C +496 O O . TYR A 78 ? 0.3058 0.5287 0.6729 0.0827 0.0026 -0.0491 396 TYR A O +497 C CB . TYR A 78 ? 0.3035 0.5665 0.7003 0.0423 0.0079 -0.0549 396 TYR A CB +498 C CG . TYR A 78 ? 0.3267 0.6225 0.7601 0.0279 0.0070 -0.0623 396 TYR A CG +499 C CD1 . TYR A 78 ? 0.3243 0.6344 0.7777 0.0136 0.0309 -0.0674 396 TYR A CD1 +500 C CD2 . TYR A 78 ? 0.4293 0.7403 0.8757 0.0277 -0.0177 -0.0643 396 TYR A CD2 +501 C CE1 . TYR A 78 ? 0.3196 0.6589 0.8088 -0.0015 0.0308 -0.0749 396 TYR A CE1 +502 C CE2 . TYR A 78 ? 0.4408 0.7819 0.9217 0.0133 -0.0197 -0.0728 396 TYR A CE2 +503 C CZ . TYR A 78 ? 0.4068 0.7620 0.9107 -0.0018 0.0048 -0.0783 396 TYR A CZ +504 O OH . TYR A 78 ? 0.4588 0.8431 0.9990 -0.0179 0.0031 -0.0874 396 TYR A OH +505 N N . ALA A 79 ? 0.2762 0.4950 0.6314 0.0626 0.0422 -0.0531 397 ALA A N +506 C CA . ALA A 79 ? 0.2755 0.4579 0.5901 0.0694 0.0447 -0.0483 397 ALA A CA +507 C C . ALA A 79 ? 0.2954 0.4531 0.5705 0.0534 0.0507 -0.0414 397 ALA A C +508 O O . ALA A 79 ? 0.2880 0.4470 0.5585 0.0431 0.0697 -0.0429 397 ALA A O +509 C CB . ALA A 79 ? 0.2946 0.4788 0.6172 0.0792 0.0638 -0.0559 397 ALA A CB +510 N N . ASP A 80 ? 0.2241 0.3595 0.4711 0.0518 0.0348 -0.0336 398 ASP A N +511 C CA . ASP A 80 ? 0.2524 0.3645 0.4636 0.0391 0.0388 -0.0272 398 ASP A CA +512 C C . ASP A 80 ? 0.3236 0.4067 0.5023 0.0449 0.0419 -0.0249 398 ASP A C +513 O O . ASP A 80 ? 0.3409 0.4142 0.5175 0.0570 0.0332 -0.0250 398 ASP A O +514 C CB . ASP A 80 ? 0.2450 0.3513 0.4455 0.0328 0.0216 -0.0214 398 ASP A CB +515 C CG . ASP A 80 ? 0.3326 0.4669 0.5643 0.0266 0.0156 -0.0255 398 ASP A CG +516 O OD1 . ASP A 80 ? 0.2813 0.4361 0.5380 0.0203 0.0292 -0.0311 398 ASP A OD1 +517 O OD2 . ASP A 80 ? 0.2703 0.4060 0.5011 0.0275 -0.0026 -0.0234 398 ASP A OD2 +518 N N . SER A 81 ? 0.2838 0.3520 0.4367 0.0361 0.0536 -0.0227 399 SER A N +519 C CA . SER A 81 ? 0.3089 0.3524 0.4330 0.0407 0.0560 -0.0225 399 SER A CA +520 C C . SER A 81 ? 0.3626 0.3881 0.4550 0.0301 0.0579 -0.0166 399 SER A C +521 O O . SER A 81 ? 0.2896 0.3208 0.3813 0.0202 0.0642 -0.0138 399 SER A O +522 C CB . SER A 81 ? 0.2689 0.3162 0.3982 0.0478 0.0720 -0.0307 399 SER A CB +523 O OG . SER A 81 ? 0.3661 0.4249 0.4982 0.0394 0.0894 -0.0322 399 SER A OG +524 N N . PHE A 82 ? 0.3252 0.3287 0.3929 0.0325 0.0522 -0.0151 400 PHE A N +525 C CA . PHE A 82 ? 0.3558 0.3437 0.3968 0.0243 0.0496 -0.0096 400 PHE A CA +526 C C . PHE A 82 ? 0.3430 0.3106 0.3652 0.0283 0.0433 -0.0108 400 PHE A C +527 O O . PHE A 82 ? 0.3094 0.2721 0.3384 0.0368 0.0401 -0.0146 400 PHE A O +528 C CB . PHE A 82 ? 0.2913 0.2820 0.3351 0.0174 0.0401 -0.0032 400 PHE A CB +529 C CG . PHE A 82 ? 0.3079 0.3003 0.3629 0.0223 0.0268 -0.0019 400 PHE A CG +530 C CD1 . PHE A 82 ? 0.2939 0.2687 0.3336 0.0244 0.0177 0.0012 400 PHE A CD1 +531 C CD2 . PHE A 82 ? 0.3201 0.3317 0.4003 0.0242 0.0231 -0.0034 400 PHE A CD2 +532 C CE1 . PHE A 82 ? 0.3188 0.2918 0.3639 0.0291 0.0061 0.0041 400 PHE A CE1 +533 C CE2 . PHE A 82 ? 0.3136 0.3256 0.4000 0.0297 0.0090 -0.0013 400 PHE A CE2 +534 C CZ . PHE A 82 ? 0.3476 0.3386 0.4143 0.0325 0.0009 0.0032 400 PHE A CZ +535 N N . VAL A 83 ? 0.3505 0.3061 0.3506 0.0219 0.0411 -0.0076 401 VAL A N +536 C CA . VAL A 83 ? 0.3318 0.2695 0.3152 0.0223 0.0347 -0.0090 401 VAL A CA +537 C C . VAL A 83 ? 0.3298 0.2631 0.3091 0.0161 0.0248 -0.0023 401 VAL A C +538 O O . VAL A 83 ? 0.3334 0.2730 0.3113 0.0104 0.0251 0.0024 401 VAL A O +539 C CB . VAL A 83 ? 0.3427 0.2730 0.3045 0.0205 0.0405 -0.0132 401 VAL A CB +540 C CG1 . VAL A 83 ? 0.3908 0.3063 0.3378 0.0174 0.0317 -0.0144 401 VAL A CG1 +541 C CG2 . VAL A 83 ? 0.4084 0.3385 0.3702 0.0274 0.0507 -0.0219 401 VAL A CG2 +542 N N . ILE A 84 ? 0.3210 0.2420 0.2984 0.0173 0.0174 -0.0018 402 ILE A N +543 C CA . ILE A 84 ? 0.3313 0.2458 0.3028 0.0111 0.0102 0.0036 402 ILE A CA +544 C C . ILE A 84 ? 0.3306 0.2279 0.2926 0.0098 0.0073 0.0004 402 ILE A C +545 O O . ILE A 84 ? 0.3640 0.2531 0.3235 0.0144 0.0099 -0.0062 402 ILE A O +546 C CB . ILE A 84 ? 0.3323 0.2496 0.3128 0.0122 0.0045 0.0093 402 ILE A CB +547 C CG1 . ILE A 84 ? 0.3663 0.2775 0.3545 0.0215 0.0018 0.0080 402 ILE A CG1 +548 C CG2 . ILE A 84 ? 0.3282 0.2626 0.3183 0.0104 0.0062 0.0113 402 ILE A CG2 +549 C CD1 . ILE A 84 ? 0.3468 0.2594 0.3405 0.0243 -0.0063 0.0142 402 ILE A CD1 +550 N N . ARG A 85 ? 0.3455 0.2367 0.3030 0.0030 0.0029 0.0042 403 ARG A N +551 C CA . ARG A 85 ? 0.3529 0.2272 0.3044 0.0001 0.0008 0.0008 403 ARG A CA +552 C C . ARG A 85 ? 0.3680 0.2269 0.3217 0.0042 -0.0017 0.0044 403 ARG A C +553 O O . ARG A 85 ? 0.3886 0.2516 0.3472 0.0082 -0.0039 0.0107 403 ARG A O +554 C CB . ARG A 85 ? 0.4617 0.3366 0.4098 -0.0099 -0.0015 0.0019 403 ARG A CB +555 C CG . ARG A 85 ? 0.5375 0.4213 0.4889 -0.0139 -0.0020 0.0094 403 ARG A CG +556 C CD . ARG A 85 ? 0.4873 0.3751 0.4392 -0.0227 -0.0030 0.0085 403 ARG A CD +557 N NE . ARG A 85 ? 0.3999 0.2739 0.3517 -0.0293 -0.0031 0.0091 403 ARG A NE +558 C CZ . ARG A 85 ? 0.4625 0.3398 0.4182 -0.0375 -0.0017 0.0115 403 ARG A CZ +559 N NH1 . ARG A 85 ? 0.4109 0.3049 0.3714 -0.0386 -0.0010 0.0128 403 ARG A NH1 +560 N NH2 . ARG A 85 ? 0.4774 0.3404 0.4326 -0.0448 0.0001 0.0125 403 ARG A NH2 +561 N N . GLY A 86 ? 0.3712 0.2106 0.3203 0.0033 -0.0019 -0.0000 404 GLY A N +562 C CA . GLY A 86 ? 0.4575 0.2769 0.4066 0.0087 -0.0040 0.0038 404 GLY A CA +563 C C . GLY A 86 ? 0.4333 0.2477 0.3790 0.0048 -0.0071 0.0150 404 GLY A C +564 O O . GLY A 86 ? 0.4590 0.2655 0.4047 0.0126 -0.0106 0.0215 404 GLY A O +565 N N . ASP A 87 ? 0.4661 0.2852 0.4082 -0.0067 -0.0059 0.0173 405 ASP A N +566 C CA . ASP A 87 ? 0.4878 0.3025 0.4238 -0.0116 -0.0066 0.0273 405 ASP A CA +567 C C . ASP A 87 ? 0.4145 0.2444 0.3516 -0.0056 -0.0097 0.0328 405 ASP A C +568 O O . ASP A 87 ? 0.4287 0.2525 0.3569 -0.0069 -0.0115 0.0411 405 ASP A O +569 C CB . ASP A 87 ? 0.5202 0.3419 0.4564 -0.0246 -0.0028 0.0265 405 ASP A CB +570 C CG . ASP A 87 ? 0.6172 0.4206 0.5520 -0.0338 -0.0002 0.0240 405 ASP A CG +571 O OD1 . ASP A 87 ? 0.5796 0.3582 0.5080 -0.0318 -0.0002 0.0272 405 ASP A OD1 +572 O OD2 . ASP A 87 ? 0.5851 0.3991 0.5264 -0.0432 0.0016 0.0185 405 ASP A OD2 +573 N N . GLU A 88 ? 0.3738 0.2225 0.3203 -0.0001 -0.0101 0.0280 406 GLU A N +574 C CA . GLU A 88 ? 0.4235 0.2883 0.3742 0.0036 -0.0131 0.0311 406 GLU A CA +575 C C . GLU A 88 ? 0.3810 0.2479 0.3399 0.0155 -0.0181 0.0314 406 GLU A C +576 O O . GLU A 88 ? 0.3942 0.2746 0.3581 0.0183 -0.0224 0.0335 406 GLU A O +577 C CB . GLU A 88 ? 0.4190 0.3040 0.3767 0.0004 -0.0093 0.0263 406 GLU A CB +578 C CG . GLU A 88 ? 0.4069 0.2939 0.3596 -0.0092 -0.0061 0.0266 406 GLU A CG +579 C CD . GLU A 88 ? 0.4660 0.3676 0.4236 -0.0107 -0.0028 0.0224 406 GLU A CD +580 O OE1 . GLU A 88 ? 0.4210 0.3270 0.3824 -0.0061 -0.0012 0.0182 406 GLU A OE1 +581 O OE2 . GLU A 88 ? 0.4554 0.3629 0.4121 -0.0161 -0.0013 0.0234 406 GLU A OE2 +582 N N . VAL A 89 ? 0.4062 0.2606 0.3683 0.0229 -0.0179 0.0284 407 VAL A N +583 C CA . VAL A 89 ? 0.4029 0.2626 0.3775 0.0360 -0.0224 0.0278 407 VAL A CA +584 C C . VAL A 89 ? 0.4146 0.2693 0.3838 0.0407 -0.0323 0.0372 407 VAL A C +585 O O . VAL A 89 ? 0.3987 0.2689 0.3808 0.0493 -0.0388 0.0373 407 VAL A O +586 C CB . VAL A 89 ? 0.4059 0.2496 0.3838 0.0439 -0.0196 0.0222 407 VAL A CB +587 C CG1 . VAL A 89 ? 0.4049 0.2533 0.3984 0.0596 -0.0245 0.0218 407 VAL A CG1 +588 C CG2 . VAL A 89 ? 0.4414 0.2933 0.4220 0.0400 -0.0106 0.0119 407 VAL A CG2 +589 N N . ARG A 90 ? 0.3674 0.2021 0.3174 0.0346 -0.0336 0.0451 408 ARG A N +590 C CA . ARG A 90 ? 0.4497 0.2771 0.3879 0.0389 -0.0430 0.0551 408 ARG A CA +591 C C . ARG A 90 ? 0.3856 0.2367 0.3259 0.0359 -0.0474 0.0549 408 ARG A C +592 O O . ARG A 90 ? 0.4202 0.2723 0.3548 0.0421 -0.0581 0.0606 408 ARG A O +593 C CB . ARG A 90 ? 0.4848 0.2848 0.3991 0.0308 -0.0402 0.0639 408 ARG A CB +594 C CG . ARG A 90 ? 0.5818 0.3878 0.4910 0.0154 -0.0310 0.0613 408 ARG A CG +595 C CD . ARG A 90 ? 0.7800 0.5614 0.6692 0.0061 -0.0259 0.0693 408 ARG A CD +596 N NE . ARG A 90 ? 1.0715 0.8354 0.9406 0.0116 -0.0327 0.0812 408 ARG A NE +597 C CZ . ARG A 90 ? 1.1512 0.9248 1.0088 0.0123 -0.0381 0.0855 408 ARG A CZ +598 N NH1 . ARG A 90 ? 1.1423 0.9421 1.0085 0.0075 -0.0367 0.0784 408 ARG A NH1 +599 N NH2 . ARG A 90 ? 1.1626 0.9177 0.9980 0.0181 -0.0455 0.0969 408 ARG A NH2 +600 N N . GLN A 91 ? 0.3869 0.2558 0.3346 0.0271 -0.0405 0.0483 409 GLN A N +601 C CA . GLN A 91 ? 0.4147 0.3039 0.3657 0.0235 -0.0436 0.0465 409 GLN A CA +602 C C . GLN A 91 ? 0.4082 0.3197 0.3822 0.0314 -0.0492 0.0411 409 GLN A C +603 O O . GLN A 91 ? 0.3859 0.3133 0.3639 0.0289 -0.0543 0.0394 409 GLN A O +604 C CB . GLN A 91 ? 0.3996 0.2971 0.3509 0.0122 -0.0339 0.0420 409 GLN A CB +605 C CG . GLN A 91 ? 0.4170 0.2999 0.3490 0.0033 -0.0292 0.0465 409 GLN A CG +606 C CD . GLN A 91 ? 0.3914 0.2842 0.3271 -0.0054 -0.0209 0.0418 409 GLN A CD +607 O OE1 . GLN A 91 ? 0.3595 0.2673 0.3021 -0.0070 -0.0207 0.0380 409 GLN A OE1 +608 N NE2 . GLN A 91 ? 0.3679 0.2523 0.3002 -0.0110 -0.0144 0.0418 409 GLN A NE2 +609 N N . ILE A 92 ? 0.3635 0.2775 0.3539 0.0399 -0.0473 0.0373 410 ILE A N +610 C CA . ILE A 92 ? 0.3570 0.2950 0.3736 0.0472 -0.0506 0.0314 410 ILE A CA +611 C C . ILE A 92 ? 0.3678 0.3036 0.3871 0.0599 -0.0650 0.0363 410 ILE A C +612 O O . ILE A 92 ? 0.3752 0.3069 0.4061 0.0722 -0.0666 0.0357 410 ILE A O +613 C CB . ILE A 92 ? 0.3499 0.2934 0.3830 0.0507 -0.0398 0.0239 410 ILE A CB +614 C CG1 . ILE A 92 ? 0.3221 0.2597 0.3438 0.0395 -0.0277 0.0214 410 ILE A CG1 +615 C CG2 . ILE A 92 ? 0.3417 0.3151 0.4046 0.0544 -0.0391 0.0169 410 ILE A CG2 +616 C CD1 . ILE A 92 ? 0.3557 0.3074 0.3773 0.0286 -0.0247 0.0204 410 ILE A CD1 +617 N N . ALA A 93 ? 0.3653 0.3022 0.3719 0.0579 -0.0758 0.0413 411 ALA A N +618 C CA . ALA A 93 ? 0.3702 0.3041 0.3740 0.0701 -0.0922 0.0475 411 ALA A CA +619 C C . ALA A 93 ? 0.3804 0.3260 0.3742 0.0642 -0.1026 0.0481 411 ALA A C +620 O O . ALA A 93 ? 0.4237 0.3680 0.4040 0.0508 -0.0952 0.0465 411 ALA A O +621 C CB . ALA A 93 ? 0.4018 0.3000 0.3786 0.0750 -0.0936 0.0585 411 ALA A CB +622 N N . PRO A 94 ? 0.4289 0.3867 0.4298 0.0743 -0.1201 0.0494 412 PRO A N +623 C CA . PRO A 94 ? 0.4392 0.4065 0.4267 0.0681 -0.1313 0.0487 412 PRO A CA +624 C C . PRO A 94 ? 0.4636 0.4013 0.4071 0.0615 -0.1294 0.0582 412 PRO A C +625 O O . PRO A 94 ? 0.4862 0.3962 0.4093 0.0668 -0.1279 0.0686 412 PRO A O +626 C CB . PRO A 94 ? 0.4406 0.4230 0.4418 0.0833 -0.1529 0.0498 412 PRO A CB +627 C CG . PRO A 94 ? 0.5037 0.4719 0.5129 0.0990 -0.1531 0.0559 412 PRO A CG +628 C CD . PRO A 94 ? 0.4838 0.4471 0.5048 0.0925 -0.1314 0.0509 412 PRO A CD +629 N N . GLY A 95 ? 0.4483 0.3911 0.3778 0.0493 -0.1278 0.0541 413 GLY A N +630 C CA . GLY A 95 ? 0.5487 0.4674 0.4367 0.0431 -0.1262 0.0618 413 GLY A CA +631 C C . GLY A 95 ? 0.5543 0.4528 0.4288 0.0336 -0.1067 0.0650 413 GLY A C +632 O O . GLY A 95 ? 0.5574 0.4343 0.3987 0.0290 -0.1031 0.0725 413 GLY A O +633 N N . GLN A 96 ? 0.4818 0.3872 0.3804 0.0303 -0.0940 0.0594 414 GLN A N +634 C CA . GLN A 96 ? 0.5131 0.4027 0.4029 0.0219 -0.0776 0.0614 414 GLN A CA +635 C C . GLN A 96 ? 0.4630 0.3628 0.3539 0.0096 -0.0674 0.0539 414 GLN A C +636 O O . GLN A 96 ? 0.4136 0.3325 0.3173 0.0072 -0.0707 0.0460 414 GLN A O +637 C CB . GLN A 96 ? 0.4778 0.3667 0.3894 0.0261 -0.0708 0.0594 414 GLN A CB +638 C CG . GLN A 96 ? 0.4847 0.3605 0.3967 0.0393 -0.0793 0.0660 414 GLN A CG +639 C CD . GLN A 96 ? 0.5865 0.4336 0.4656 0.0403 -0.0828 0.0783 414 GLN A CD +640 O OE1 . GLN A 96 ? 0.6327 0.4607 0.4957 0.0316 -0.0716 0.0823 414 GLN A OE1 +641 N NE2 . GLN A 96 ? 0.7460 0.5899 0.6146 0.0508 -0.0984 0.0848 414 GLN A NE2 +642 N N . THR A 97 ? 0.4359 0.3223 0.3145 0.0018 -0.0547 0.0563 415 THR A N +643 C CA . THR A 97 ? 0.3892 0.2835 0.2707 -0.0080 -0.0440 0.0498 415 THR A CA +644 C C . THR A 97 ? 0.3777 0.2685 0.2699 -0.0115 -0.0323 0.0492 415 THR A C +645 O O . THR A 97 ? 0.3926 0.2708 0.2837 -0.0089 -0.0312 0.0539 415 THR A O +646 C CB . THR A 97 ? 0.4900 0.3747 0.3442 -0.0145 -0.0406 0.0519 415 THR A CB +647 O OG1 . THR A 97 ? 0.4644 0.3294 0.3020 -0.0171 -0.0331 0.0601 415 THR A OG1 +648 C CG2 . THR A 97 ? 0.5775 0.4624 0.4143 -0.0105 -0.0544 0.0531 415 THR A CG2 +649 N N . GLY A 98 ? 0.3649 0.2656 0.2663 -0.0174 -0.0242 0.0431 416 GLY A N +650 C CA . GLY A 98 ? 0.3353 0.2353 0.2465 -0.0206 -0.0151 0.0418 416 GLY A CA +651 C C . GLY A 98 ? 0.3369 0.2517 0.2653 -0.0212 -0.0121 0.0352 416 GLY A C +652 O O . GLY A 98 ? 0.3473 0.2715 0.2816 -0.0201 -0.0161 0.0317 416 GLY A O +653 N N . LYS A 99 ? 0.3136 0.2299 0.2497 -0.0233 -0.0056 0.0335 417 LYS A N +654 C CA . LYS A 99 ? 0.2852 0.2120 0.2334 -0.0233 -0.0025 0.0291 417 LYS A CA +655 C C . LYS A 99 ? 0.2901 0.2241 0.2493 -0.0188 -0.0058 0.0272 417 LYS A C +656 O O . LYS A 99 ? 0.3099 0.2519 0.2771 -0.0199 -0.0041 0.0242 417 LYS A O +657 C CB . LYS A 99 ? 0.3420 0.2689 0.2946 -0.0246 0.0024 0.0284 417 LYS A CB +658 C CG . LYS A 99 ? 0.3534 0.2791 0.3023 -0.0293 0.0072 0.0286 417 LYS A CG +659 C CD . LYS A 99 ? 0.3976 0.3270 0.3545 -0.0299 0.0093 0.0271 417 LYS A CD +660 C CE . LYS A 99 ? 0.5304 0.4627 0.4896 -0.0343 0.0145 0.0264 417 LYS A CE +661 N NZ . LYS A 99 ? 0.6607 0.5846 0.6122 -0.0394 0.0169 0.0292 417 LYS A NZ +662 N N . ILE A 100 ? 0.3092 0.2399 0.2702 -0.0139 -0.0095 0.0287 418 ILE A N +663 C CA . ILE A 100 ? 0.2755 0.2157 0.2502 -0.0092 -0.0108 0.0258 418 ILE A CA +664 C C . ILE A 100 ? 0.2844 0.2335 0.2647 -0.0079 -0.0177 0.0248 418 ILE A C +665 O O . ILE A 100 ? 0.3044 0.2659 0.2975 -0.0096 -0.0164 0.0209 418 ILE A O +666 C CB . ILE A 100 ? 0.3374 0.2713 0.3141 -0.0030 -0.0115 0.0261 418 ILE A CB +667 C CG1 . ILE A 100 ? 0.3448 0.2719 0.3166 -0.0053 -0.0057 0.0248 418 ILE A CG1 +668 C CG2 . ILE A 100 ? 0.3218 0.2680 0.3150 0.0026 -0.0110 0.0222 418 ILE A CG2 +669 C CD1 . ILE A 100 ? 0.3337 0.2690 0.3084 -0.0084 0.0001 0.0225 418 ILE A CD1 +670 N N . ALA A 101 ? 0.2951 0.2375 0.2653 -0.0051 -0.0257 0.0285 419 ALA A N +671 C CA . ALA A 101 ? 0.3289 0.2809 0.3031 -0.0033 -0.0353 0.0270 419 ALA A CA +672 C C . ALA A 101 ? 0.3944 0.3523 0.3663 -0.0112 -0.0340 0.0228 419 ALA A C +673 O O . ALA A 101 ? 0.3636 0.3352 0.3482 -0.0124 -0.0387 0.0177 419 ALA A O +674 C CB . ALA A 101 ? 0.3264 0.2667 0.2840 0.0017 -0.0449 0.0333 419 ALA A CB +675 N N . ASP A 102 ? 0.3384 0.2865 0.2960 -0.0168 -0.0273 0.0238 420 ASP A N +676 C CA . ASP A 102 ? 0.3395 0.2900 0.2933 -0.0233 -0.0256 0.0189 420 ASP A CA +677 C C . ASP A 102 ? 0.2930 0.2511 0.2636 -0.0268 -0.0185 0.0143 420 ASP A C +678 O O . ASP A 102 ? 0.3346 0.2989 0.3116 -0.0312 -0.0200 0.0086 420 ASP A O +679 C CB . ASP A 102 ? 0.3585 0.2969 0.2939 -0.0270 -0.0191 0.0207 420 ASP A CB +680 C CG . ASP A 102 ? 0.4772 0.4050 0.3912 -0.0257 -0.0236 0.0261 420 ASP A CG +681 O OD1 . ASP A 102 ? 0.4353 0.3633 0.3453 -0.0211 -0.0340 0.0287 420 ASP A OD1 +682 O OD2 . ASP A 102 ? 0.4184 0.3372 0.3192 -0.0292 -0.0161 0.0280 420 ASP A OD2 +683 N N . TYR A 103 ? 0.2966 0.2525 0.2724 -0.0254 -0.0108 0.0166 421 TYR A N +684 C CA . TYR A 103 ? 0.3035 0.2610 0.2878 -0.0288 -0.0029 0.0144 421 TYR A CA +685 C C . TYR A 103 ? 0.2726 0.2371 0.2707 -0.0267 0.0009 0.0147 421 TYR A C +686 O O . TYR A 103 ? 0.3137 0.2774 0.3165 -0.0296 0.0082 0.0143 421 TYR A O +687 C CB . TYR A 103 ? 0.2933 0.2417 0.2688 -0.0291 0.0035 0.0168 421 TYR A CB +688 C CG . TYR A 103 ? 0.3156 0.2580 0.2786 -0.0313 0.0030 0.0159 421 TYR A CG +689 C CD1 . TYR A 103 ? 0.3209 0.2633 0.2795 -0.0349 0.0001 0.0111 421 TYR A CD1 +690 C CD2 . TYR A 103 ? 0.3623 0.2997 0.3180 -0.0305 0.0062 0.0187 421 TYR A CD2 +691 C CE1 . TYR A 103 ? 0.3270 0.2630 0.2709 -0.0369 0.0015 0.0095 421 TYR A CE1 +692 C CE2 . TYR A 103 ? 0.3867 0.3196 0.3313 -0.0329 0.0084 0.0175 421 TYR A CE2 +693 C CZ . TYR A 103 ? 0.4269 0.3583 0.3641 -0.0357 0.0066 0.0130 421 TYR A CZ +694 O OH . TYR A 103 ? 0.3847 0.3107 0.3079 -0.0380 0.0105 0.0112 421 TYR A OH +695 N N . ASN A 104 ? 0.2811 0.2508 0.2848 -0.0215 -0.0030 0.0154 422 ASN A N +696 C CA . ASN A 104 ? 0.3034 0.2789 0.3180 -0.0189 0.0030 0.0149 422 ASN A CA +697 C C . ASN A 104 ? 0.2942 0.2844 0.3274 -0.0156 -0.0005 0.0115 422 ASN A C +698 O O . ASN A 104 ? 0.2851 0.2859 0.3338 -0.0183 0.0059 0.0085 422 ASN A O +699 C CB . ASN A 104 ? 0.2956 0.2620 0.2999 -0.0142 0.0050 0.0177 422 ASN A CB +700 C CG . ASN A 104 ? 0.3652 0.3229 0.3580 -0.0169 0.0097 0.0200 422 ASN A CG +701 O OD1 . ASN A 104 ? 0.3211 0.2783 0.3134 -0.0174 0.0162 0.0205 422 ASN A OD1 +702 N ND2 . ASN A 104 ? 0.2940 0.2450 0.2773 -0.0184 0.0065 0.0216 422 ASN A ND2 +703 N N . TYR A 105 ? 0.2744 0.2653 0.3070 -0.0095 -0.0101 0.0123 423 TYR A N +704 C CA . TYR A 105 ? 0.3002 0.3069 0.3534 -0.0039 -0.0152 0.0091 423 TYR A CA +705 C C . TYR A 105 ? 0.2476 0.2530 0.2950 0.0009 -0.0297 0.0111 423 TYR A C +706 O O . TYR A 105 ? 0.3022 0.2924 0.3333 0.0059 -0.0332 0.0162 423 TYR A O +707 C CB . TYR A 105 ? 0.2607 0.2674 0.3204 0.0039 -0.0094 0.0087 423 TYR A CB +708 C CG . TYR A 105 ? 0.3193 0.3448 0.4049 0.0113 -0.0133 0.0044 423 TYR A CG +709 C CD1 . TYR A 105 ? 0.2850 0.3301 0.3945 0.0078 -0.0052 -0.0011 423 TYR A CD1 +710 C CD2 . TYR A 105 ? 0.2782 0.3018 0.3654 0.0219 -0.0246 0.0062 423 TYR A CD2 +711 C CE1 . TYR A 105 ? 0.2481 0.3148 0.3869 0.0148 -0.0082 -0.0061 423 TYR A CE1 +712 C CE2 . TYR A 105 ? 0.2853 0.3281 0.3995 0.0307 -0.0292 0.0021 423 TYR A CE2 +713 C CZ . TYR A 105 ? 0.2828 0.3492 0.4246 0.0271 -0.0211 -0.0047 423 TYR A CZ +714 O OH . TYR A 105 ? 0.2855 0.3748 0.4589 0.0360 -0.0251 -0.0098 423 TYR A OH +715 N N . LYS A 106 ? 0.2654 0.2861 0.3257 -0.0009 -0.0383 0.0070 424 LYS A N +716 C CA . LYS A 106 ? 0.3093 0.3285 0.3590 0.0024 -0.0537 0.0088 424 LYS A CA +717 C C . LYS A 106 ? 0.3576 0.3965 0.4310 0.0112 -0.0652 0.0060 424 LYS A C +718 O O . LYS A 106 ? 0.3423 0.4038 0.4422 0.0074 -0.0656 -0.0014 424 LYS A O +719 C CB . LYS A 106 ? 0.3210 0.3406 0.3612 -0.0076 -0.0567 0.0051 424 LYS A CB +720 C CG . LYS A 106 ? 0.3363 0.3538 0.3602 -0.0047 -0.0731 0.0064 424 LYS A CG +721 C CD . LYS A 106 ? 0.3291 0.3241 0.3247 0.0016 -0.0747 0.0162 424 LYS A CD +722 C CE . LYS A 106 ? 0.4211 0.4095 0.3920 0.0026 -0.0884 0.0186 424 LYS A CE +723 N NZ . LYS A 106 ? 0.3758 0.3401 0.3181 0.0078 -0.0885 0.0295 424 LYS A NZ +724 N N . LEU A 107 ? 0.3508 0.3811 0.4156 0.0230 -0.0751 0.0120 425 LEU A N +725 C CA . LEU A 107 ? 0.2988 0.3473 0.3845 0.0337 -0.0898 0.0102 425 LEU A CA +726 C C . LEU A 107 ? 0.3391 0.3910 0.4119 0.0325 -0.1075 0.0104 425 LEU A C +727 O O . LEU A 107 ? 0.3496 0.3807 0.3886 0.0283 -0.1091 0.0157 425 LEU A O +728 C CB . LEU A 107 ? 0.3731 0.4077 0.4546 0.0485 -0.0929 0.0170 425 LEU A CB +729 C CG . LEU A 107 ? 0.4132 0.4494 0.5130 0.0530 -0.0785 0.0140 425 LEU A CG +730 C CD1 . LEU A 107 ? 0.4717 0.4927 0.5684 0.0687 -0.0838 0.0194 425 LEU A CD1 +731 C CD2 . LEU A 107 ? 0.3983 0.4673 0.5374 0.0519 -0.0738 0.0040 425 LEU A CD2 +732 N N . PRO A 108 ? 0.3288 0.4073 0.4273 0.0361 -0.1211 0.0041 426 PRO A N +733 C CA . PRO A 108 ? 0.3838 0.4660 0.4676 0.0355 -0.1405 0.0034 426 PRO A CA +734 C C . PRO A 108 ? 0.4484 0.5136 0.5078 0.0503 -0.1558 0.0145 426 PRO A C +735 O O . PRO A 108 ? 0.4619 0.5189 0.5268 0.0628 -0.1544 0.0209 426 PRO A O +736 C CB . PRO A 108 ? 0.3622 0.4822 0.4884 0.0348 -0.1501 -0.0081 426 PRO A CB +737 C CG . PRO A 108 ? 0.3570 0.4903 0.5169 0.0448 -0.1423 -0.0085 426 PRO A CG +738 C CD . PRO A 108 ? 0.2712 0.3796 0.4146 0.0406 -0.1196 -0.0035 426 PRO A CD +739 N N . ASP A 109 ? 0.4927 0.5498 0.5220 0.0485 -0.1700 0.0169 427 ASP A N +740 C CA . ASP A 109 ? 0.6258 0.6649 0.6271 0.0622 -0.1859 0.0288 427 ASP A CA +741 C C . ASP A 109 ? 0.5794 0.6390 0.6118 0.0798 -0.2029 0.0291 427 ASP A C +742 O O . ASP A 109 ? 0.6418 0.6832 0.6642 0.0947 -0.2075 0.0401 427 ASP A O +743 C CB . ASP A 109 ? 0.7046 0.7361 0.6689 0.0570 -0.1995 0.0293 427 ASP A CB +744 C CG . ASP A 109 ? 0.7354 0.7445 0.6672 0.0422 -0.1824 0.0297 427 ASP A CG +745 O OD1 . ASP A 109 ? 0.7200 0.7113 0.6474 0.0393 -0.1634 0.0349 427 ASP A OD1 +746 O OD2 . ASP A 109 ? 0.8045 0.8145 0.7156 0.0336 -0.1884 0.0240 427 ASP A OD2 +747 N N . ASP A 110 ? 0.5572 0.6545 0.6292 0.0784 -0.2119 0.0167 428 ASP A N +748 C CA . ASP A 110 ? 0.6058 0.7298 0.7141 0.0952 -0.2292 0.0147 428 ASP A CA +749 C C . ASP A 110 ? 0.5484 0.6874 0.7004 0.1004 -0.2133 0.0103 428 ASP A C +750 O O . ASP A 110 ? 0.5879 0.7625 0.7860 0.1075 -0.2210 0.0018 428 ASP A O +751 C CB . ASP A 110 ? 0.6112 0.7717 0.7425 0.0906 -0.2489 0.0025 428 ASP A CB +752 C CG . ASP A 110 ? 0.6895 0.8763 0.8563 0.0720 -0.2338 -0.0130 428 ASP A CG +753 O OD1 . ASP A 110 ? 0.5852 0.7611 0.7556 0.0634 -0.2084 -0.0133 428 ASP A OD1 +754 O OD2 . ASP A 110 ? 0.6911 0.9089 0.8819 0.0659 -0.2480 -0.0249 428 ASP A OD2 +755 N N . PHE A 111 ? 0.4882 0.6020 0.6269 0.0967 -0.1909 0.0149 429 PHE A N +756 C CA . PHE A 111 ? 0.4049 0.5297 0.5784 0.1004 -0.1737 0.0099 429 PHE A CA +757 C C . PHE A 111 ? 0.4104 0.5434 0.6081 0.1231 -0.1848 0.0125 429 PHE A C +758 O O . PHE A 111 ? 0.5272 0.6345 0.6992 0.1368 -0.1964 0.0241 429 PHE A O +759 C CB . PHE A 111 ? 0.3681 0.4599 0.5145 0.0934 -0.1517 0.0153 429 PHE A CB +760 C CG . PHE A 111 ? 0.4182 0.5149 0.5906 0.0975 -0.1338 0.0108 429 PHE A CG +761 C CD1 . PHE A 111 ? 0.4457 0.5709 0.6523 0.0889 -0.1209 -0.0005 429 PHE A CD1 +762 C CD2 . PHE A 111 ? 0.4222 0.4924 0.5820 0.1090 -0.1286 0.0175 429 PHE A CD2 +763 C CE1 . PHE A 111 ? 0.4586 0.5868 0.6843 0.0925 -0.1029 -0.0048 429 PHE A CE1 +764 C CE2 . PHE A 111 ? 0.4020 0.4752 0.5822 0.1126 -0.1117 0.0117 429 PHE A CE2 +765 C CZ . PHE A 111 ? 0.4038 0.5066 0.6158 0.1047 -0.0987 0.0007 429 PHE A CZ +766 N N . THR A 112 ? 0.3868 0.5551 0.6347 0.1273 -0.1806 0.0017 430 THR A N +767 C CA . THR A 112 ? 0.4344 0.6120 0.7122 0.1492 -0.1851 0.0018 430 THR A CA +768 C C . THR A 112 ? 0.4906 0.6714 0.7900 0.1462 -0.1578 -0.0054 430 THR A C +769 O O . THR A 112 ? 0.4435 0.6538 0.7739 0.1343 -0.1451 -0.0165 430 THR A O +770 C CB . THR A 112 ? 0.5109 0.7309 0.8297 0.1579 -0.2038 -0.0052 430 THR A CB +771 O OG1 . THR A 112 ? 0.6012 0.8609 0.9632 0.1442 -0.1933 -0.0201 430 THR A OG1 +772 C CG2 . THR A 112 ? 0.4243 0.6390 0.7117 0.1556 -0.2267 0.0014 430 THR A CG2 +773 N N . GLY A 113 ? 0.4870 0.6356 0.7677 0.1558 -0.1483 0.0009 431 GLY A N +774 C CA . GLY A 113 ? 0.4420 0.5882 0.7344 0.1530 -0.1228 -0.0058 431 GLY A CA +775 C C . GLY A 113 ? 0.4655 0.5675 0.7246 0.1605 -0.1161 0.0022 431 GLY A C +776 O O . GLY A 113 ? 0.4730 0.5495 0.7094 0.1717 -0.1312 0.0129 431 GLY A O +777 N N . CYS A 114 ? 0.3567 0.4489 0.6122 0.1535 -0.0933 -0.0031 432 CYS A N +778 C CA . CYS A 114 ? 0.3599 0.4115 0.5864 0.1582 -0.0854 0.0017 432 CYS A CA +779 C C . CYS A 114 ? 0.4006 0.4372 0.6015 0.1391 -0.0672 0.0001 432 CYS A C +780 O O . CYS A 114 ? 0.3860 0.4447 0.6007 0.1277 -0.0542 -0.0076 432 CYS A O +781 C CB . CYS A 114 ? 0.4136 0.4659 0.6653 0.1767 -0.0779 -0.0053 432 CYS A CB +782 S SG . CYS A 114 ? 0.6102 0.6829 0.8988 0.2033 -0.0997 -0.0042 432 CYS A SG +783 N N . VAL A 115 ? 0.3970 0.3957 0.5609 0.1356 -0.0667 0.0078 433 VAL A N +784 C CA . VAL A 115 ? 0.3191 0.3016 0.4580 0.1194 -0.0520 0.0067 433 VAL A CA +785 C C . VAL A 115 ? 0.3687 0.3254 0.4992 0.1262 -0.0419 0.0032 433 VAL A C +786 O O . VAL A 115 ? 0.4301 0.3606 0.5505 0.1370 -0.0494 0.0087 433 VAL A O +787 C CB . VAL A 115 ? 0.3307 0.2934 0.4357 0.1073 -0.0590 0.0169 433 VAL A CB +788 C CG1 . VAL A 115 ? 0.3367 0.2855 0.4207 0.0924 -0.0448 0.0150 433 VAL A CG1 +789 C CG2 . VAL A 115 ? 0.3887 0.3749 0.4998 0.1008 -0.0691 0.0186 433 VAL A CG2 +790 N N . ILE A 116 ? 0.3411 0.3033 0.4741 0.1200 -0.0249 -0.0061 434 ILE A N +791 C CA . ILE A 116 ? 0.3725 0.3138 0.4995 0.1263 -0.0142 -0.0130 434 ILE A CA +792 C C . ILE A 116 ? 0.3846 0.3120 0.4846 0.1103 -0.0036 -0.0150 434 ILE A C +793 O O . ILE A 116 ? 0.4024 0.3479 0.5019 0.0986 0.0030 -0.0165 434 ILE A O +794 C CB . ILE A 116 ? 0.3821 0.3462 0.5406 0.1379 -0.0035 -0.0248 434 ILE A CB +795 C CG1 . ILE A 116 ? 0.3904 0.3750 0.5814 0.1540 -0.0163 -0.0229 434 ILE A CG1 +796 C CG2 . ILE A 116 ? 0.3821 0.3212 0.5319 0.1460 0.0070 -0.0331 434 ILE A CG2 +797 C CD1 . ILE A 116 ? 0.5227 0.5456 0.7538 0.1604 -0.0063 -0.0339 434 ILE A CD1 +798 N N . ALA A 117 ? 0.3936 0.2885 0.4716 0.1098 -0.0026 -0.0151 435 ALA A N +799 C CA . ALA A 117 ? 0.3838 0.2677 0.4378 0.0949 0.0048 -0.0175 435 ALA A CA +800 C C . ALA A 117 ? 0.3832 0.2392 0.4245 0.0982 0.0106 -0.0254 435 ALA A C +801 O O . ALA A 117 ? 0.4596 0.2961 0.5049 0.1100 0.0068 -0.0256 435 ALA A O +802 C CB . ALA A 117 ? 0.4050 0.2801 0.4403 0.0821 -0.0034 -0.0069 435 ALA A CB +803 N N . TRP A 118 ? 0.3957 0.2489 0.4208 0.0879 0.0191 -0.0323 436 TRP A N +804 C CA . TRP A 118 ? 0.4369 0.2641 0.4474 0.0885 0.0241 -0.0420 436 TRP A CA +805 C C . TRP A 118 ? 0.4134 0.2381 0.4016 0.0729 0.0263 -0.0446 436 TRP A C +806 O O . TRP A 118 ? 0.4299 0.2756 0.4163 0.0654 0.0286 -0.0419 436 TRP A O +807 C CB . TRP A 118 ? 0.4716 0.3031 0.4932 0.1012 0.0355 -0.0551 436 TRP A CB +808 C CG . TRP A 118 ? 0.4861 0.3441 0.5096 0.0978 0.0476 -0.0612 436 TRP A CG +809 C CD1 . TRP A 118 ? 0.5115 0.3659 0.5143 0.0913 0.0572 -0.0706 436 TRP A CD1 +810 C CD2 . TRP A 118 ? 0.4111 0.3017 0.4573 0.1004 0.0516 -0.0581 436 TRP A CD2 +811 N NE1 . TRP A 118 ? 0.4784 0.3589 0.4871 0.0899 0.0682 -0.0720 436 TRP A NE1 +812 C CE2 . TRP A 118 ? 0.4614 0.3646 0.4986 0.0947 0.0657 -0.0649 436 TRP A CE2 +813 C CE3 . TRP A 118 ? 0.4105 0.3206 0.4833 0.1064 0.0443 -0.0505 436 TRP A CE3 +814 C CZ2 . TRP A 118 ? 0.4694 0.4026 0.5248 0.0937 0.0745 -0.0639 436 TRP A CZ2 +815 C CZ3 . TRP A 118 ? 0.4442 0.3868 0.5376 0.1053 0.0516 -0.0512 436 TRP A CZ3 +816 C CH2 . TRP A 118 ? 0.4679 0.4211 0.5531 0.0983 0.0675 -0.0576 436 TRP A CH2 +817 N N . ASN A 119 ? 0.4754 0.2735 0.4478 0.0680 0.0249 -0.0499 437 ASN A N +818 C CA . ASN A 119 ? 0.4805 0.2768 0.4337 0.0539 0.0246 -0.0536 437 ASN A CA +819 C C . ASN A 119 ? 0.5018 0.3107 0.4464 0.0549 0.0342 -0.0642 437 ASN A C +820 O O . ASN A 119 ? 0.4854 0.2883 0.4310 0.0645 0.0423 -0.0749 437 ASN A O +821 C CB . ASN A 119 ? 0.4996 0.2649 0.4415 0.0484 0.0209 -0.0589 437 ASN A CB +822 C CG . ASN A 119 ? 0.5142 0.2800 0.4405 0.0334 0.0179 -0.0629 437 ASN A CG +823 O OD1 . ASN A 119 ? 0.5101 0.2828 0.4245 0.0318 0.0216 -0.0728 437 ASN A OD1 +824 N ND2 . ASN A 119 ? 0.4653 0.2243 0.3913 0.0226 0.0111 -0.0553 437 ASN A ND2 +825 N N . SER A 120 ? 0.4550 0.2800 0.3897 0.0456 0.0340 -0.0611 438 SER A N +826 C CA . SER A 120 ? 0.4766 0.3115 0.3975 0.0457 0.0430 -0.0689 438 SER A CA +827 C C . SER A 120 ? 0.5073 0.3371 0.4046 0.0349 0.0377 -0.0726 438 SER A C +828 O O . SER A 120 ? 0.4573 0.2988 0.3406 0.0322 0.0412 -0.0725 438 SER A O +829 C CB . SER A 120 ? 0.4139 0.2745 0.3448 0.0469 0.0493 -0.0611 438 SER A CB +830 O OG . SER A 120 ? 0.4854 0.3555 0.4173 0.0381 0.0415 -0.0495 438 SER A OG +831 N N . ASN A 121 ? 0.5005 0.3126 0.3938 0.0286 0.0289 -0.0759 439 ASN A N +832 C CA . ASN A 121 ? 0.4415 0.2514 0.3169 0.0181 0.0216 -0.0809 439 ASN A CA +833 C C . ASN A 121 ? 0.5215 0.3288 0.3729 0.0204 0.0268 -0.0940 439 ASN A C +834 O O . ASN A 121 ? 0.5459 0.3617 0.3799 0.0150 0.0224 -0.0944 439 ASN A O +835 C CB . ASN A 121 ? 0.4581 0.2481 0.3367 0.0106 0.0135 -0.0849 439 ASN A CB +836 C CG . ASN A 121 ? 0.5172 0.3125 0.3879 -0.0020 0.0035 -0.0867 439 ASN A CG +837 O OD1 . ASN A 121 ? 0.4721 0.2869 0.3441 -0.0053 -0.0001 -0.0778 439 ASN A OD1 +838 N ND2 . ASN A 121 ? 0.5494 0.3274 0.4136 -0.0090 -0.0014 -0.0991 439 ASN A ND2 +839 N N . ASN A 122 ? 0.5227 0.3179 0.3714 0.0292 0.0363 -0.1047 440 ASN A N +840 C CA . ASN A 122 ? 0.5855 0.3757 0.4075 0.0311 0.0423 -0.1188 440 ASN A CA +841 C C . ASN A 122 ? 0.6242 0.4334 0.4352 0.0346 0.0523 -0.1136 440 ASN A C +842 O O . ASN A 122 ? 0.7026 0.5088 0.4852 0.0348 0.0569 -0.1227 440 ASN A O +843 C CB . ASN A 122 ? 0.6791 0.4488 0.5015 0.0399 0.0510 -0.1336 440 ASN A CB +844 C CG . ASN A 122 ? 0.8534 0.6309 0.6998 0.0528 0.0629 -0.1287 440 ASN A CG +845 O OD1 . ASN A 122 ? 0.7189 0.5132 0.5864 0.0536 0.0612 -0.1139 440 ASN A OD1 +846 N ND2 . ASN A 122 ? 1.0077 0.7740 0.8522 0.0632 0.0745 -0.1424 440 ASN A ND2 +847 N N . LEU A 123 ? 0.6290 0.4562 0.4598 0.0365 0.0560 -0.0993 441 LEU A N +848 C CA . LEU A 123 ? 0.6112 0.4550 0.4348 0.0383 0.0670 -0.0931 441 LEU A CA +849 C C . LEU A 123 ? 0.5942 0.4509 0.4161 0.0310 0.0594 -0.0787 441 LEU A C +850 O O . LEU A 123 ? 0.5457 0.4086 0.3481 0.0299 0.0650 -0.0749 441 LEU A O +851 C CB . LEU A 123 ? 0.6689 0.5246 0.5200 0.0466 0.0796 -0.0900 441 LEU A CB +852 C CG . LEU A 123 ? 0.7363 0.5829 0.5942 0.0571 0.0902 -0.1037 441 LEU A CG +853 C CD1 . LEU A 123 ? 0.6608 0.5258 0.5511 0.0653 0.1007 -0.0992 441 LEU A CD1 +854 C CD2 . LEU A 123 ? 0.7638 0.6022 0.5889 0.0583 0.1011 -0.1168 441 LEU A CD2 +855 N N . ASP A 124 ? 0.4494 0.3088 0.2901 0.0265 0.0477 -0.0704 442 ASP A N +856 C CA . ASP A 124 ? 0.3974 0.2699 0.2433 0.0213 0.0426 -0.0566 442 ASP A CA +857 C C . ASP A 124 ? 0.4894 0.3598 0.3277 0.0139 0.0275 -0.0550 442 ASP A C +858 O O . ASP A 124 ? 0.4777 0.3582 0.3189 0.0107 0.0232 -0.0445 442 ASP A O +859 C CB . ASP A 124 ? 0.4097 0.2914 0.2860 0.0226 0.0432 -0.0476 442 ASP A CB +860 C CG . ASP A 124 ? 0.4928 0.3847 0.3821 0.0291 0.0571 -0.0473 442 ASP A CG +861 O OD1 . ASP A 124 ? 0.4593 0.3566 0.3352 0.0293 0.0676 -0.0471 442 ASP A OD1 +862 O OD2 . ASP A 124 ? 0.4518 0.3468 0.3649 0.0339 0.0577 -0.0469 442 ASP A OD2 +863 N N . SER A 125 ? 0.4806 0.3388 0.3116 0.0110 0.0198 -0.0656 443 SER A N +864 C CA . SER A 125 ? 0.4707 0.3303 0.2954 0.0035 0.0057 -0.0664 443 SER A CA +865 C C . SER A 125 ? 0.5176 0.3752 0.3109 0.0041 0.0029 -0.0740 443 SER A C +866 O O . SER A 125 ? 0.5139 0.3629 0.2890 0.0088 0.0119 -0.0827 443 SER A O +867 C CB . SER A 125 ? 0.5551 0.4028 0.3913 -0.0023 -0.0016 -0.0743 443 SER A CB +868 O OG . SER A 125 ? 0.6613 0.5090 0.5220 -0.0029 0.0000 -0.0657 443 SER A OG +869 N N . LYS A 126 ? 0.4592 0.3250 0.2455 -0.0001 -0.0098 -0.0711 444 LYS A N +870 C CA . LYS A 126 ? 0.5414 0.4055 0.2955 0.0006 -0.0167 -0.0778 444 LYS A CA +871 C C . LYS A 126 ? 0.4877 0.3583 0.2469 -0.0065 -0.0355 -0.0826 444 LYS A C +872 O O . LYS A 126 ? 0.4784 0.3600 0.2631 -0.0103 -0.0414 -0.0748 444 LYS A O +873 C CB . LYS A 126 ? 0.6599 0.5304 0.3947 0.0060 -0.0119 -0.0656 444 LYS A CB +874 C CG . LYS A 126 ? 0.9551 0.8211 0.6833 0.0115 0.0081 -0.0625 444 LYS A CG +875 C CD . LYS A 126 ? 1.1761 1.0452 0.8836 0.0150 0.0140 -0.0499 444 LYS A CD +876 C CE . LYS A 126 ? 1.2323 1.1046 0.9546 0.0171 0.0330 -0.0418 444 LYS A CE +877 N NZ . LYS A 126 ? 1.2324 1.1071 0.9440 0.0179 0.0381 -0.0267 444 LYS A NZ +878 N N . VAL A 127 ? 0.5231 0.3878 0.2587 -0.0084 -0.0446 -0.0965 445 VAL A N +879 C CA . VAL A 127 ? 0.5495 0.4246 0.2893 -0.0149 -0.0643 -0.1019 445 VAL A CA +880 C C . VAL A 127 ? 0.6215 0.5137 0.3611 -0.0106 -0.0722 -0.0873 445 VAL A C +881 O O . VAL A 127 ? 0.6267 0.5171 0.3400 -0.0028 -0.0679 -0.0791 445 VAL A O +882 C CB . VAL A 127 ? 0.5691 0.4353 0.2781 -0.0168 -0.0737 -0.1199 445 VAL A CB +883 C CG1 . VAL A 127 ? 0.5849 0.4667 0.2991 -0.0229 -0.0963 -0.1252 445 VAL A CG1 +884 C CG2 . VAL A 127 ? 0.6247 0.4712 0.3369 -0.0213 -0.0661 -0.1357 445 VAL A CG2 +885 N N . GLY A 128 ? 0.5422 0.4500 0.3111 -0.0157 -0.0830 -0.0839 446 GLY A N +886 C CA . GLY A 128 ? 0.5264 0.4501 0.3025 -0.0106 -0.0891 -0.0698 446 GLY A CA +887 C C . GLY A 128 ? 0.5998 0.5240 0.3936 -0.0075 -0.0747 -0.0547 446 GLY A C +888 O O . GLY A 128 ? 0.5830 0.5186 0.3872 -0.0037 -0.0783 -0.0434 446 GLY A O +889 N N . GLY A 129 ? 0.4932 0.4053 0.2912 -0.0083 -0.0592 -0.0549 447 GLY A N +890 C CA . GLY A 129 ? 0.5061 0.4197 0.3229 -0.0066 -0.0472 -0.0427 447 GLY A CA +891 C C . GLY A 129 ? 0.6251 0.5318 0.4236 0.0003 -0.0340 -0.0346 447 GLY A C +892 O O . GLY A 129 ? 0.6090 0.5151 0.3835 0.0054 -0.0360 -0.0297 447 GLY A O +893 N N . ASN A 130 ? 0.5478 0.4493 0.3577 0.0005 -0.0205 -0.0330 448 ASN A N +894 C CA . ASN A 130 ? 0.5882 0.4874 0.3907 0.0053 -0.0065 -0.0247 448 ASN A CA +895 C C . ASN A 130 ? 0.5807 0.4882 0.4046 0.0046 -0.0050 -0.0126 448 ASN A C +896 O O . ASN A 130 ? 0.6160 0.5266 0.4639 0.0015 -0.0042 -0.0122 448 ASN A O +897 C CB . ASN A 130 ? 0.6093 0.5017 0.4158 0.0066 0.0064 -0.0309 448 ASN A CB +898 C CG . ASN A 130 ? 0.6553 0.5493 0.4602 0.0101 0.0216 -0.0233 448 ASN A CG +899 O OD1 . ASN A 130 ? 0.5889 0.4845 0.3818 0.0110 0.0237 -0.0140 448 ASN A OD1 +900 N ND2 . ASN A 130 ? 0.6091 0.5025 0.4272 0.0120 0.0325 -0.0274 448 ASN A ND2 +901 N N . TYR A 131 ? 0.5570 0.4659 0.3701 0.0077 -0.0047 -0.0027 449 TYR A N +902 C CA . TYR A 131 ? 0.6335 0.5479 0.4650 0.0072 -0.0034 0.0075 449 TYR A CA +903 C C . TYR A 131 ? 0.5757 0.4867 0.4081 0.0078 0.0114 0.0147 449 TYR A C +904 O O . TYR A 131 ? 0.6686 0.5816 0.5125 0.0072 0.0133 0.0228 449 TYR A O +905 C CB . TYR A 131 ? 0.6971 0.6147 0.5215 0.0106 -0.0145 0.0137 449 TYR A CB +906 C CG . TYR A 131 ? 0.7907 0.7172 0.6239 0.0086 -0.0296 0.0061 449 TYR A CG +907 C CD1 . TYR A 131 ? 0.7225 0.6585 0.5842 0.0045 -0.0329 0.0051 449 TYR A CD1 +908 C CD2 . TYR A 131 ? 0.8301 0.7558 0.6429 0.0100 -0.0399 -0.0009 449 TYR A CD2 +909 C CE1 . TYR A 131 ? 0.8146 0.7602 0.6878 0.0010 -0.0448 -0.0022 449 TYR A CE1 +910 C CE2 . TYR A 131 ? 0.8619 0.7979 0.6865 0.0066 -0.0540 -0.0093 449 TYR A CE2 +911 C CZ . TYR A 131 ? 0.8818 0.8282 0.7382 0.0017 -0.0557 -0.0097 449 TYR A CZ +912 O OH . TYR A 131 ? 0.9560 0.9140 0.8271 -0.0032 -0.0681 -0.0184 449 TYR A OH +913 N N . ASN A 132 ? 0.4944 0.4012 0.3173 0.0084 0.0224 0.0106 450 ASN A N +914 C CA . ASN A 132 ? 0.5206 0.4271 0.3476 0.0076 0.0374 0.0162 450 ASN A CA +915 C C . ASN A 132 ? 0.5306 0.4454 0.3891 0.0046 0.0403 0.0160 450 ASN A C +916 O O . ASN A 132 ? 0.5246 0.4418 0.3930 0.0024 0.0487 0.0217 450 ASN A O +917 C CB . ASN A 132 ? 0.6211 0.5233 0.4308 0.0094 0.0495 0.0107 450 ASN A CB +918 C CG . ASN A 132 ? 0.8277 0.7198 0.5997 0.0123 0.0481 0.0123 450 ASN A CG +919 O OD1 . ASN A 132 ? 0.9126 0.8003 0.6719 0.0136 0.0415 0.0215 450 ASN A OD1 +920 N ND2 . ASN A 132 ? 0.8228 0.7101 0.5755 0.0143 0.0539 0.0031 450 ASN A ND2 +921 N N . TYR A 133 ? 0.3855 0.3036 0.2588 0.0041 0.0332 0.0096 451 TYR A N +922 C CA . TYR A 133 ? 0.3474 0.2720 0.2462 0.0024 0.0344 0.0097 451 TYR A CA +923 C C . TYR A 133 ? 0.4298 0.3570 0.3390 -0.0006 0.0267 0.0151 451 TYR A C +924 O O . TYR A 133 ? 0.4372 0.3635 0.3448 -0.0013 0.0175 0.0138 451 TYR A O +925 C CB . TYR A 133 ? 0.3461 0.2691 0.2529 0.0041 0.0315 0.0016 451 TYR A CB +926 C CG . TYR A 133 ? 0.4140 0.3361 0.3174 0.0083 0.0414 -0.0049 451 TYR A CG +927 C CD1 . TYR A 133 ? 0.3606 0.2916 0.2801 0.0097 0.0511 -0.0041 451 TYR A CD1 +928 C CD2 . TYR A 133 ? 0.4099 0.3234 0.2955 0.0108 0.0412 -0.0130 451 TYR A CD2 +929 C CE1 . TYR A 133 ? 0.3651 0.2977 0.2849 0.0143 0.0619 -0.0110 451 TYR A CE1 +930 C CE2 . TYR A 133 ? 0.4297 0.3417 0.3115 0.0155 0.0520 -0.0204 451 TYR A CE2 +931 C CZ . TYR A 133 ? 0.4015 0.3239 0.3018 0.0176 0.0630 -0.0191 451 TYR A CZ +932 O OH . TYR A 133 ? 0.4208 0.3443 0.3211 0.0228 0.0751 -0.0271 451 TYR A OH +933 N N . LEU A 134 ? 0.3902 0.3216 0.3119 -0.0028 0.0311 0.0199 452 LEU A N +934 C CA . LEU A 134 ? 0.3799 0.3128 0.3103 -0.0054 0.0263 0.0241 452 LEU A CA +935 C C . LEU A 134 ? 0.3925 0.3308 0.3406 -0.0077 0.0254 0.0226 452 LEU A C +936 O O . LEU A 134 ? 0.3617 0.3043 0.3184 -0.0069 0.0290 0.0198 452 LEU A O +937 C CB . LEU A 134 ? 0.3962 0.3255 0.3223 -0.0064 0.0316 0.0307 452 LEU A CB +938 C CG . LEU A 134 ? 0.4654 0.3872 0.3701 -0.0035 0.0352 0.0344 452 LEU A CG +939 C CD1 . LEU A 134 ? 0.4758 0.3904 0.3772 -0.0051 0.0425 0.0423 452 LEU A CD1 +940 C CD2 . LEU A 134 ? 0.4644 0.3847 0.3580 0.0001 0.0241 0.0339 452 LEU A CD2 +941 N N . TYR A 135 ? 0.3101 0.2487 0.2632 -0.0099 0.0203 0.0242 453 TYR A N +942 C CA . TYR A 135 ? 0.3165 0.2589 0.2814 -0.0124 0.0190 0.0238 453 TYR A CA +943 C C . TYR A 135 ? 0.3533 0.2944 0.3196 -0.0151 0.0191 0.0265 453 TYR A C +944 O O . TYR A 135 ? 0.3387 0.2767 0.2994 -0.0138 0.0184 0.0286 453 TYR A O +945 C CB . TYR A 135 ? 0.3118 0.2527 0.2783 -0.0121 0.0131 0.0218 453 TYR A CB +946 C CG . TYR A 135 ? 0.2979 0.2357 0.2599 -0.0139 0.0093 0.0223 453 TYR A CG +947 C CD1 . TYR A 135 ? 0.3133 0.2490 0.2692 -0.0129 0.0072 0.0202 453 TYR A CD1 +948 C CD2 . TYR A 135 ? 0.4182 0.3568 0.3829 -0.0169 0.0083 0.0238 453 TYR A CD2 +949 C CE1 . TYR A 135 ? 0.4158 0.3525 0.3727 -0.0154 0.0034 0.0196 453 TYR A CE1 +950 C CE2 . TYR A 135 ? 0.4650 0.4039 0.4298 -0.0189 0.0067 0.0235 453 TYR A CE2 +951 C CZ . TYR A 135 ? 0.5091 0.4483 0.4720 -0.0184 0.0039 0.0215 453 TYR A CZ +952 O OH . TYR A 135 ? 0.6126 0.5556 0.5802 -0.0212 0.0020 0.0203 453 TYR A OH +953 N N . ARG A 136 ? 0.3050 0.2488 0.2793 -0.0181 0.0195 0.0255 454 ARG A N +954 C CA . ARG A 136 ? 0.2921 0.2330 0.2673 -0.0208 0.0202 0.0260 454 ARG A CA +955 C C . ARG A 136 ? 0.3209 0.2615 0.2937 -0.0211 0.0160 0.0251 454 ARG A C +956 O O . ARG A 136 ? 0.2946 0.2367 0.2673 -0.0220 0.0124 0.0238 454 ARG A O +957 C CB . ARG A 136 ? 0.3173 0.2610 0.3009 -0.0252 0.0219 0.0235 454 ARG A CB +958 C CG . ARG A 136 ? 0.3220 0.2594 0.3050 -0.0282 0.0238 0.0225 454 ARG A CG +959 C CD . ARG A 136 ? 0.2983 0.2375 0.2901 -0.0342 0.0253 0.0185 454 ARG A CD +960 N NE . ARG A 136 ? 0.3065 0.2476 0.3051 -0.0360 0.0314 0.0202 454 ARG A NE +961 C CZ . ARG A 136 ? 0.3821 0.3131 0.3775 -0.0371 0.0391 0.0241 454 ARG A CZ +962 N NH1 . ARG A 136 ? 0.3331 0.2516 0.3209 -0.0352 0.0401 0.0263 454 ARG A NH1 +963 N NH2 . ARG A 136 ? 0.3664 0.2989 0.3660 -0.0396 0.0464 0.0261 454 ARG A NH2 +964 N N . LEU A 137 ? 0.2844 0.2227 0.2553 -0.0198 0.0168 0.0261 455 LEU A N +965 C CA . LEU A 137 ? 0.2740 0.2137 0.2449 -0.0208 0.0154 0.0249 455 LEU A CA +966 C C . LEU A 137 ? 0.3188 0.2562 0.2901 -0.0228 0.0185 0.0226 455 LEU A C +967 O O . LEU A 137 ? 0.3380 0.2758 0.3062 -0.0254 0.0187 0.0209 455 LEU A O +968 C CB . LEU A 137 ? 0.3111 0.2536 0.2839 -0.0177 0.0141 0.0259 455 LEU A CB +969 C CG . LEU A 137 ? 0.3346 0.2819 0.3127 -0.0191 0.0147 0.0241 455 LEU A CG +970 C CD1 . LEU A 137 ? 0.3644 0.3113 0.3399 -0.0239 0.0141 0.0233 455 LEU A CD1 +971 C CD2 . LEU A 137 ? 0.3719 0.3257 0.3560 -0.0152 0.0114 0.0243 455 LEU A CD2 +972 N N . PHE A 138 ? 0.2974 0.2303 0.2707 -0.0221 0.0217 0.0223 456 PHE A N +973 C CA . PHE A 138 ? 0.3514 0.2797 0.3246 -0.0237 0.0252 0.0184 456 PHE A CA +974 C C . PHE A 138 ? 0.3344 0.2590 0.3077 -0.0283 0.0255 0.0156 456 PHE A C +975 O O . PHE A 138 ? 0.3621 0.2839 0.3390 -0.0288 0.0272 0.0177 456 PHE A O +976 C CB . PHE A 138 ? 0.3443 0.2679 0.3216 -0.0187 0.0288 0.0194 456 PHE A CB +977 C CG . PHE A 138 ? 0.3401 0.2714 0.3220 -0.0142 0.0275 0.0207 456 PHE A CG +978 C CD1 . PHE A 138 ? 0.3348 0.2717 0.3193 -0.0157 0.0301 0.0169 456 PHE A CD1 +979 C CD2 . PHE A 138 ? 0.3405 0.2745 0.3241 -0.0094 0.0236 0.0252 456 PHE A CD2 +980 C CE1 . PHE A 138 ? 0.3382 0.2852 0.3316 -0.0131 0.0295 0.0172 456 PHE A CE1 +981 C CE2 . PHE A 138 ? 0.3427 0.2866 0.3335 -0.0062 0.0206 0.0250 456 PHE A CE2 +982 C CZ . PHE A 138 ? 0.3196 0.2711 0.3177 -0.0084 0.0237 0.0208 456 PHE A CZ +983 N N . ARG A 139 ? 0.3481 0.2727 0.3169 -0.0322 0.0241 0.0105 457 ARG A N +984 C CA . ARG A 139 ? 0.3660 0.2889 0.3365 -0.0376 0.0228 0.0055 457 ARG A CA +985 C C . ARG A 139 ? 0.3580 0.2778 0.3187 -0.0406 0.0220 -0.0013 457 ARG A C +986 O O . ARG A 139 ? 0.3614 0.2835 0.3124 -0.0396 0.0205 -0.0005 457 ARG A O +987 C CB . ARG A 139 ? 0.3413 0.2737 0.3170 -0.0392 0.0169 0.0066 457 ARG A CB +988 C CG . ARG A 139 ? 0.3527 0.2866 0.3382 -0.0453 0.0168 0.0019 457 ARG A CG +989 C CD . ARG A 139 ? 0.3491 0.2967 0.3446 -0.0460 0.0108 0.0017 457 ARG A CD +990 N NE . ARG A 139 ? 0.3570 0.3086 0.3676 -0.0526 0.0135 -0.0023 457 ARG A NE +991 C CZ . ARG A 139 ? 0.4022 0.3593 0.4199 -0.0592 0.0085 -0.0103 457 ARG A CZ +992 N NH1 . ARG A 139 ? 0.3937 0.3521 0.4009 -0.0593 -0.0006 -0.0150 457 ARG A NH1 +993 N NH2 . ARG A 139 ? 0.3358 0.2971 0.3706 -0.0666 0.0126 -0.0139 457 ARG A NH2 +994 N N . LYS A 140 ? 0.3462 0.2590 0.3078 -0.0449 0.0239 -0.0082 458 LYS A N +995 C CA . LYS A 140 ? 0.3964 0.3038 0.3456 -0.0475 0.0244 -0.0163 458 LYS A CA +996 C C . LYS A 140 ? 0.3959 0.3105 0.3345 -0.0510 0.0149 -0.0188 458 LYS A C +997 O O . LYS A 140 ? 0.4168 0.3290 0.3384 -0.0510 0.0147 -0.0211 458 LYS A O +998 C CB . LYS A 140 ? 0.4604 0.3558 0.4130 -0.0516 0.0288 -0.0244 458 LYS A CB +999 C CG . LYS A 140 ? 0.6923 0.5803 0.6303 -0.0547 0.0299 -0.0353 458 LYS A CG +1000 C CD . LYS A 140 ? 0.7952 0.6799 0.7245 -0.0486 0.0380 -0.0351 458 LYS A CD +1001 C CE . LYS A 140 ? 0.7574 0.6310 0.6722 -0.0512 0.0427 -0.0478 458 LYS A CE +1002 N NZ . LYS A 140 ? 0.5424 0.4146 0.4512 -0.0454 0.0531 -0.0489 458 LYS A NZ +1003 N N A SER A 141 ? 0.3713 0.2949 0.3196 -0.0533 0.0072 -0.0181 459 SER A N +1004 N N B SER A 141 ? 0.3728 0.2963 0.3211 -0.0534 0.0072 -0.0182 459 SER A N +1005 C CA A SER A 141 ? 0.3720 0.3035 0.3127 -0.0550 -0.0043 -0.0205 459 SER A CA +1006 C CA B SER A 141 ? 0.3753 0.3069 0.3160 -0.0550 -0.0043 -0.0205 459 SER A CA +1007 C C A SER A 141 ? 0.3662 0.3095 0.3183 -0.0511 -0.0103 -0.0133 459 SER A C +1008 C C B SER A 141 ? 0.3666 0.3098 0.3186 -0.0510 -0.0102 -0.0132 459 SER A C +1009 O O A SER A 141 ? 0.3703 0.3164 0.3373 -0.0494 -0.0053 -0.0090 459 SER A O +1010 O O B SER A 141 ? 0.3640 0.3099 0.3306 -0.0492 -0.0052 -0.0087 459 SER A O +1011 C CB A SER A 141 ? 0.4023 0.3356 0.3469 -0.0625 -0.0099 -0.0315 459 SER A CB +1012 C CB B SER A 141 ? 0.3994 0.3329 0.3440 -0.0625 -0.0101 -0.0314 459 SER A CB +1013 O OG A SER A 141 ? 0.3733 0.3119 0.3414 -0.0662 -0.0077 -0.0321 459 SER A OG +1014 O OG B SER A 141 ? 0.3897 0.3096 0.3253 -0.0661 -0.0032 -0.0396 459 SER A OG +1015 N N . ASN A 142 ? 0.3706 0.3193 0.3136 -0.0489 -0.0210 -0.0119 460 ASN A N +1016 C CA . ASN A 142 ? 0.3256 0.2842 0.2793 -0.0435 -0.0273 -0.0059 460 ASN A CA +1017 C C . ASN A 142 ? 0.3313 0.3046 0.3102 -0.0462 -0.0309 -0.0107 460 ASN A C +1018 O O . ASN A 142 ? 0.3493 0.3269 0.3337 -0.0528 -0.0344 -0.0193 460 ASN A O +1019 C CB . ASN A 142 ? 0.3417 0.3002 0.2787 -0.0392 -0.0391 -0.0026 460 ASN A CB +1020 C CG . ASN A 142 ? 0.4577 0.4015 0.3703 -0.0373 -0.0341 0.0037 460 ASN A CG +1021 O OD1 . ASN A 142 ? 0.3693 0.3067 0.2820 -0.0382 -0.0226 0.0058 460 ASN A OD1 +1022 N ND2 . ASN A 142 ? 0.4208 0.3599 0.3128 -0.0347 -0.0430 0.0072 460 ASN A ND2 +1023 N N . LEU A 143 ? 0.2921 0.2735 0.2867 -0.0415 -0.0296 -0.0059 461 LEU A N +1024 C CA . LEU A 143 ? 0.3208 0.3193 0.3418 -0.0434 -0.0316 -0.0101 461 LEU A CA +1025 C C . LEU A 143 ? 0.3193 0.3321 0.3457 -0.0416 -0.0476 -0.0143 461 LEU A C +1026 O O . LEU A 143 ? 0.3217 0.3306 0.3316 -0.0348 -0.0571 -0.0100 461 LEU A O +1027 C CB . LEU A 143 ? 0.3239 0.3270 0.3572 -0.0372 -0.0256 -0.0045 461 LEU A CB +1028 C CG . LEU A 143 ? 0.3771 0.3696 0.4077 -0.0383 -0.0115 -0.0005 461 LEU A CG +1029 C CD1 . LEU A 143 ? 0.3156 0.3143 0.3564 -0.0321 -0.0075 0.0030 461 LEU A CD1 +1030 C CD2 . LEU A 143 ? 0.3722 0.3641 0.4128 -0.0473 -0.0034 -0.0048 461 LEU A CD2 +1031 N N . LYS A 144 ? 0.3169 0.3466 0.3674 -0.0476 -0.0509 -0.0225 462 LYS A N +1032 C CA . LYS A 144 ? 0.3079 0.3578 0.3726 -0.0441 -0.0671 -0.0265 462 LYS A CA +1033 C C . LYS A 144 ? 0.2751 0.3367 0.3581 -0.0338 -0.0668 -0.0211 462 LYS A C +1034 O O . LYS A 144 ? 0.2785 0.3353 0.3671 -0.0328 -0.0527 -0.0170 462 LYS A O +1035 C CB . LYS A 144 ? 0.3530 0.4202 0.4429 -0.0552 -0.0702 -0.0385 462 LYS A CB +1036 C CG . LYS A 144 ? 0.3998 0.4542 0.4727 -0.0658 -0.0705 -0.0462 462 LYS A CG +1037 C CD . LYS A 144 ? 0.5172 0.5884 0.6181 -0.0782 -0.0736 -0.0591 462 LYS A CD +1038 C CE . LYS A 144 ? 0.6874 0.7396 0.7770 -0.0903 -0.0649 -0.0663 462 LYS A CE +1039 N NZ . LYS A 144 ? 0.8014 0.8415 0.8591 -0.0903 -0.0757 -0.0713 462 LYS A NZ +1040 N N . PRO A 145 ? 0.2914 0.3677 0.3833 -0.0252 -0.0826 -0.0214 463 PRO A N +1041 C CA . PRO A 145 ? 0.3365 0.4236 0.4483 -0.0141 -0.0818 -0.0176 463 PRO A CA +1042 C C . PRO A 145 ? 0.2736 0.3790 0.4201 -0.0196 -0.0686 -0.0233 463 PRO A C +1043 O O . PRO A 145 ? 0.2317 0.3535 0.3995 -0.0299 -0.0689 -0.0320 463 PRO A O +1044 C CB . PRO A 145 ? 0.3706 0.4738 0.4904 -0.0047 -0.1036 -0.0189 463 PRO A CB +1045 C CG . PRO A 145 ? 0.3880 0.4776 0.4751 -0.0086 -0.1149 -0.0187 463 PRO A CG +1046 C CD . PRO A 145 ? 0.3155 0.3982 0.3980 -0.0239 -0.1027 -0.0251 463 PRO A CD +1047 N N . PHE A 146 ? 0.2878 0.3884 0.4378 -0.0136 -0.0559 -0.0185 464 PHE A N +1048 C CA . PHE A 146 ? 0.3007 0.4157 0.4785 -0.0173 -0.0405 -0.0223 464 PHE A CA +1049 C C . PHE A 146 ? 0.3252 0.4330 0.5007 -0.0325 -0.0267 -0.0245 464 PHE A C +1050 O O . PHE A 146 ? 0.2895 0.4118 0.4903 -0.0399 -0.0155 -0.0292 464 PHE A O +1051 C CB . PHE A 146 ? 0.2789 0.4274 0.4973 -0.0142 -0.0479 -0.0300 464 PHE A CB +1052 C CG . PHE A 146 ? 0.2492 0.4041 0.4736 0.0033 -0.0595 -0.0272 464 PHE A CG +1053 C CD1 . PHE A 146 ? 0.2905 0.4311 0.5048 0.0134 -0.0502 -0.0215 464 PHE A CD1 +1054 C CD2 . PHE A 146 ? 0.3128 0.4866 0.5521 0.0100 -0.0805 -0.0306 464 PHE A CD2 +1055 C CE1 . PHE A 146 ? 0.3206 0.4633 0.5404 0.0300 -0.0603 -0.0191 464 PHE A CE1 +1056 C CE2 . PHE A 146 ? 0.3689 0.5459 0.6133 0.0279 -0.0918 -0.0268 464 PHE A CE2 +1057 C CZ . PHE A 146 ? 0.3335 0.4936 0.5683 0.0379 -0.0809 -0.0209 464 PHE A CZ +1058 N N . GLU A 147 ? 0.2856 0.3701 0.4311 -0.0369 -0.0262 -0.0209 465 GLU A N +1059 C CA . GLU A 147 ? 0.2763 0.3483 0.4159 -0.0485 -0.0127 -0.0213 465 GLU A CA +1060 C C . GLU A 147 ? 0.2770 0.3330 0.4021 -0.0450 0.0020 -0.0135 465 GLU A C +1061 O O . GLU A 147 ? 0.2605 0.3071 0.3692 -0.0355 -0.0004 -0.0081 465 GLU A O +1062 C CB . GLU A 147 ? 0.2713 0.3267 0.3876 -0.0538 -0.0190 -0.0224 465 GLU A CB +1063 C CG . GLU A 147 ? 0.3647 0.4060 0.4774 -0.0651 -0.0067 -0.0239 465 GLU A CG +1064 C CD . GLU A 147 ? 0.4467 0.4744 0.5411 -0.0702 -0.0130 -0.0283 465 GLU A CD +1065 O OE1 . GLU A 147 ? 0.3822 0.4070 0.4588 -0.0645 -0.0245 -0.0277 465 GLU A OE1 +1066 O OE2 . GLU A 147 ? 0.4410 0.4593 0.5378 -0.0802 -0.0055 -0.0323 465 GLU A OE2 +1067 N N . ARG A 148 ? 0.2633 0.3151 0.3933 -0.0531 0.0169 -0.0131 466 ARG A N +1068 C CA . ARG A 148 ? 0.2340 0.2711 0.3485 -0.0501 0.0303 -0.0059 466 ARG A CA +1069 C C . ARG A 148 ? 0.2739 0.2914 0.3742 -0.0582 0.0386 -0.0029 466 ARG A C +1070 O O . ARG A 148 ? 0.2933 0.3127 0.4073 -0.0686 0.0467 -0.0056 466 ARG A O +1071 C CB . ARG A 148 ? 0.2744 0.3262 0.4085 -0.0497 0.0423 -0.0072 466 ARG A CB +1072 C CG . ARG A 148 ? 0.2733 0.3109 0.3885 -0.0461 0.0557 -0.0007 466 ARG A CG +1073 C CD . ARG A 148 ? 0.3849 0.4403 0.5219 -0.0463 0.0687 -0.0040 466 ARG A CD +1074 N NE . ARG A 148 ? 0.4804 0.5230 0.5979 -0.0440 0.0832 0.0012 466 ARG A NE +1075 C CZ . ARG A 148 ? 0.5976 0.6289 0.7058 -0.0522 0.0981 0.0058 466 ARG A CZ +1076 N NH1 . ARG A 148 ? 0.5280 0.5475 0.6143 -0.0488 0.1097 0.0107 466 ARG A NH1 +1077 N NH2 . ARG A 148 ? 0.6562 0.6864 0.7753 -0.0640 0.1012 0.0056 466 ARG A NH2 +1078 N N . ASP A 149 ? 0.3082 0.3068 0.3831 -0.0536 0.0367 0.0026 467 ASP A N +1079 C CA . ASP A 149 ? 0.3308 0.3094 0.3915 -0.0581 0.0426 0.0060 467 ASP A CA +1080 C C . ASP A 149 ? 0.3159 0.2823 0.3612 -0.0536 0.0523 0.0142 467 ASP A C +1081 O O . ASP A 149 ? 0.3162 0.2798 0.3479 -0.0453 0.0484 0.0175 467 ASP A O +1082 C CB . ASP A 149 ? 0.3181 0.2873 0.3639 -0.0554 0.0331 0.0051 467 ASP A CB +1083 C CG . ASP A 149 ? 0.3919 0.3413 0.4266 -0.0585 0.0387 0.0070 467 ASP A CG +1084 O OD1 . ASP A 149 ? 0.3716 0.3112 0.4068 -0.0620 0.0492 0.0109 467 ASP A OD1 +1085 O OD2 . ASP A 149 ? 0.4154 0.3580 0.4402 -0.0570 0.0331 0.0048 467 ASP A OD2 +1086 N N . ILE A 150 ? 0.3371 0.2952 0.3832 -0.0596 0.0648 0.0175 468 ILE A N +1087 C CA . ILE A 150 ? 0.3316 0.2766 0.3591 -0.0554 0.0736 0.0261 468 ILE A CA +1088 C C . ILE A 150 ? 0.4059 0.3274 0.4169 -0.0557 0.0764 0.0325 468 ILE A C +1089 O O . ILE A 150 ? 0.4921 0.3998 0.4862 -0.0530 0.0838 0.0407 468 ILE A O +1090 C CB . ILE A 150 ? 0.3616 0.3134 0.3976 -0.0600 0.0877 0.0270 468 ILE A CB +1091 C CG1 . ILE A 150 ? 0.4327 0.3895 0.4915 -0.0729 0.0946 0.0226 468 ILE A CG1 +1092 C CG2 . ILE A 150 ? 0.4695 0.4415 0.5159 -0.0542 0.0849 0.0221 468 ILE A CG2 +1093 C CD1 . ILE A 150 ? 0.5266 0.4588 0.5745 -0.0799 0.1042 0.0290 468 ILE A CD1 +1094 N N . SER A 151 ? 0.3657 0.2813 0.3798 -0.0580 0.0705 0.0288 469 SER A N +1095 C CA . SER A 151 ? 0.4657 0.3586 0.4668 -0.0566 0.0729 0.0339 469 SER A CA +1096 C C . SER A 151 ? 0.4012 0.2876 0.3833 -0.0449 0.0682 0.0408 469 SER A C +1097 O O . SER A 151 ? 0.3946 0.2932 0.3753 -0.0393 0.0598 0.0384 469 SER A O +1098 C CB . SER A 151 ? 0.4754 0.3655 0.4836 -0.0601 0.0670 0.0261 469 SER A CB +1099 O OG . SER A 151 ? 0.6115 0.4800 0.6085 -0.0562 0.0688 0.0299 469 SER A OG +1100 N N . THR A 152 ? 0.4354 0.3019 0.4032 -0.0413 0.0729 0.0494 470 THR A N +1101 C CA . THR A 152 ? 0.4715 0.3330 0.4241 -0.0298 0.0660 0.0549 470 THR A CA +1102 C C . THR A 152 ? 0.5178 0.3624 0.4684 -0.0255 0.0647 0.0569 470 THR A C +1103 O O . THR A 152 ? 0.5269 0.3620 0.4652 -0.0158 0.0615 0.0641 470 THR A O +1104 C CB . THR A 152 ? 0.4931 0.3481 0.4270 -0.0252 0.0699 0.0641 470 THR A CB +1105 O OG1 . THR A 152 ? 0.5035 0.3386 0.4301 -0.0299 0.0815 0.0716 470 THR A OG1 +1106 C CG2 . THR A 152 ? 0.5020 0.3743 0.4375 -0.0273 0.0711 0.0604 470 THR A CG2 +1107 N N . GLU A 153 ? 0.4332 0.2737 0.3957 -0.0321 0.0669 0.0500 471 GLU A N +1108 C CA . GLU A 153 ? 0.5026 0.3263 0.4649 -0.0279 0.0668 0.0494 471 GLU A CA +1109 C C . GLU A 153 ? 0.4137 0.2479 0.3762 -0.0178 0.0577 0.0470 471 GLU A C +1110 O O . GLU A 153 ? 0.3922 0.2459 0.3597 -0.0190 0.0521 0.0411 471 GLU A O +1111 C CB . GLU A 153 ? 0.6806 0.5006 0.6551 -0.0385 0.0702 0.0391 471 GLU A CB +1112 C CG . GLU A 153 ? 1.0422 0.8468 1.0176 -0.0344 0.0702 0.0346 471 GLU A CG +1113 C CD . GLU A 153 ? 1.3051 1.1052 1.2900 -0.0459 0.0729 0.0225 471 GLU A CD +1114 O OE1 . GLU A 153 ? 1.3899 1.2079 1.3826 -0.0549 0.0699 0.0156 471 GLU A OE1 +1115 O OE2 . GLU A 153 ? 1.3899 1.1683 1.3743 -0.0455 0.0772 0.0194 471 GLU A OE2 +1116 N N . ILE A 154 ? 0.3971 0.2180 0.3558 -0.0079 0.0567 0.0514 472 ILE A N +1117 C CA . ILE A 154 ? 0.4184 0.2519 0.3821 0.0012 0.0494 0.0481 472 ILE A CA +1118 C C . ILE A 154 ? 0.4072 0.2487 0.3808 -0.0042 0.0502 0.0361 472 ILE A C +1119 O O . ILE A 154 ? 0.4472 0.2756 0.4234 -0.0093 0.0556 0.0305 472 ILE A O +1120 C CB . ILE A 154 ? 0.5192 0.3380 0.4809 0.0142 0.0482 0.0544 472 ILE A CB +1121 C CG1 . ILE A 154 ? 0.5086 0.3172 0.4549 0.0203 0.0462 0.0676 472 ILE A CG1 +1122 C CG2 . ILE A 154 ? 0.4341 0.2705 0.4069 0.0228 0.0418 0.0494 472 ILE A CG2 +1123 C CD1 . ILE A 154 ? 0.4714 0.3000 0.4115 0.0204 0.0392 0.0694 472 ILE A CD1 +1124 N N . TYR A 155 ? 0.3981 0.2595 0.3755 -0.0031 0.0449 0.0320 473 TYR A N +1125 C CA . TYR A 155 ? 0.3159 0.1853 0.2974 -0.0087 0.0456 0.0219 473 TYR A CA +1126 C C . TYR A 155 ? 0.3987 0.2639 0.3854 -0.0020 0.0487 0.0169 473 TYR A C +1127 O O . TYR A 155 ? 0.3627 0.2355 0.3551 0.0071 0.0463 0.0196 473 TYR A O +1128 C CB . TYR A 155 ? 0.3184 0.2073 0.2996 -0.0110 0.0402 0.0211 473 TYR A CB +1129 C CG . TYR A 155 ? 0.3182 0.2133 0.2987 -0.0165 0.0407 0.0127 473 TYR A CG +1130 C CD1 . TYR A 155 ? 0.3484 0.2428 0.3254 -0.0249 0.0399 0.0082 473 TYR A CD1 +1131 C CD2 . TYR A 155 ? 0.3355 0.2377 0.3183 -0.0132 0.0421 0.0092 473 TYR A CD2 +1132 C CE1 . TYR A 155 ? 0.3751 0.2738 0.3467 -0.0292 0.0388 0.0013 473 TYR A CE1 +1133 C CE2 . TYR A 155 ? 0.3575 0.2629 0.3345 -0.0184 0.0438 0.0024 473 TYR A CE2 +1134 C CZ . TYR A 155 ? 0.4148 0.3173 0.3841 -0.0260 0.0414 -0.0011 473 TYR A CZ +1135 O OH . TYR A 155 ? 0.3865 0.2909 0.3455 -0.0305 0.0415 -0.0071 473 TYR A OH +1136 N N . GLN A 156 ? 0.3445 0.1988 0.3304 -0.0065 0.0538 0.0085 474 GLN A N +1137 C CA . GLN A 156 ? 0.3529 0.1997 0.3433 -0.0001 0.0592 0.0020 474 GLN A CA +1138 C C . GLN A 156 ? 0.4716 0.3337 0.4610 -0.0028 0.0603 -0.0063 474 GLN A C +1139 O O . GLN A 156 ? 0.4262 0.2871 0.4070 -0.0117 0.0612 -0.0139 474 GLN A O +1140 C CB . GLN A 156 ? 0.4031 0.2260 0.3909 -0.0039 0.0651 -0.0036 474 GLN A CB +1141 C CG . GLN A 156 ? 0.4379 0.2489 0.4301 0.0044 0.0718 -0.0109 474 GLN A CG +1142 C CD . GLN A 156 ? 0.4915 0.2759 0.4801 -0.0008 0.0778 -0.0183 474 GLN A CD +1143 O OE1 . GLN A 156 ? 0.4737 0.2435 0.4602 -0.0068 0.0779 -0.0133 474 GLN A OE1 +1144 N NE2 . GLN A 156 ? 0.5146 0.2919 0.5024 0.0007 0.0840 -0.0310 474 GLN A NE2 +1145 N N . ALA A 157 ? 0.3955 0.2721 0.3932 0.0044 0.0603 -0.0049 475 ALA A N +1146 C CA . ALA A 157 ? 0.3574 0.2484 0.3536 0.0010 0.0633 -0.0110 475 ALA A CA +1147 C C . ALA A 157 ? 0.3417 0.2291 0.3418 0.0057 0.0732 -0.0207 475 ALA A C +1148 O O . ALA A 157 ? 0.3721 0.2701 0.3695 0.0027 0.0785 -0.0260 475 ALA A O +1149 C CB . ALA A 157 ? 0.3593 0.2703 0.3643 0.0034 0.0589 -0.0049 475 ALA A CB +1150 N N . GLY A 158 ? 0.3451 0.2162 0.3509 0.0132 0.0771 -0.0231 476 GLY A N +1151 C CA . GLY A 158 ? 0.3307 0.1954 0.3402 0.0186 0.0876 -0.0341 476 GLY A CA +1152 C C . GLY A 158 ? 0.3854 0.2224 0.3880 0.0179 0.0909 -0.0397 476 GLY A C +1153 O O . GLY A 158 ? 0.4486 0.2744 0.4429 0.0102 0.0854 -0.0359 476 GLY A O +1154 N N . SER A 159 ? 0.4461 0.2714 0.4537 0.0256 0.1004 -0.0493 477 SER A N +1155 C CA A SER A 159 ? 0.5006 0.2962 0.5014 0.0242 0.1046 -0.0567 477 SER A CA +1156 C CA B SER A 159 ? 0.5040 0.2996 0.5046 0.0240 0.1044 -0.0566 477 SER A CA +1157 C C . SER A 159 ? 0.5449 0.3212 0.5553 0.0336 0.1019 -0.0469 477 SER A C +1158 O O . SER A 159 ? 0.5755 0.3238 0.5803 0.0306 0.1050 -0.0507 477 SER A O +1159 C CB A SER A 159 ? 0.5408 0.3286 0.5408 0.0289 0.1171 -0.0727 477 SER A CB +1160 C CB B SER A 159 ? 0.5386 0.3261 0.5376 0.0282 0.1169 -0.0728 477 SER A CB +1161 O OG A SER A 159 ? 0.5543 0.3493 0.5754 0.0457 0.1223 -0.0713 477 SER A OG +1162 O OG B SER A 159 ? 0.5324 0.3354 0.5175 0.0192 0.1201 -0.0809 477 SER A OG +1163 N N . THR A 160 ? 0.5061 0.2952 0.5296 0.0447 0.0960 -0.0343 478 THR A N +1164 C CA . THR A 160 ? 0.5398 0.3079 0.5681 0.0552 0.0931 -0.0236 478 THR A CA +1165 C C . THR A 160 ? 0.4554 0.2182 0.4724 0.0459 0.0856 -0.0113 478 THR A C +1166 O O . THR A 160 ? 0.4125 0.1984 0.4278 0.0410 0.0786 -0.0054 478 THR A O +1167 C CB . THR A 160 ? 0.5589 0.3420 0.6059 0.0735 0.0891 -0.0165 478 THR A CB +1168 O OG1 . THR A 160 ? 0.5964 0.3881 0.6578 0.0822 0.0979 -0.0288 478 THR A OG1 +1169 C CG2 . THR A 160 ? 0.5753 0.3324 0.6230 0.0861 0.0853 -0.0044 478 THR A CG2 +1170 N N . PRO A 161 ? 0.5282 0.2605 0.5379 0.0429 0.0881 -0.0077 479 PRO A N +1171 C CA . PRO A 161 ? 0.5233 0.2513 0.5232 0.0338 0.0835 0.0041 479 PRO A CA +1172 C C . PRO A 161 ? 0.4916 0.2303 0.4925 0.0450 0.0752 0.0197 479 PRO A C +1173 O O . PRO A 161 ? 0.5227 0.2595 0.5317 0.0616 0.0728 0.0243 479 PRO A O +1174 C CB . PRO A 161 ? 0.6935 0.3831 0.6879 0.0301 0.0905 0.0046 479 PRO A CB +1175 C CG . PRO A 161 ? 0.7497 0.4268 0.7484 0.0313 0.0981 -0.0121 479 PRO A CG +1176 C CD . PRO A 161 ? 0.6657 0.3651 0.6754 0.0458 0.0969 -0.0155 479 PRO A CD +1177 N N . CYS A 162 ? 0.4569 0.2078 0.4498 0.0364 0.0702 0.0271 480 CYS A N +1178 C CA . CYS A 162 ? 0.5443 0.3066 0.5346 0.0454 0.0615 0.0401 480 CYS A CA +1179 C C . CYS A 162 ? 0.5760 0.3106 0.5535 0.0507 0.0618 0.0547 480 CYS A C +1180 O O . CYS A 162 ? 0.5147 0.2520 0.4889 0.0637 0.0540 0.0656 480 CYS A O +1181 C CB . CYS A 162 ? 0.6062 0.3937 0.5923 0.0350 0.0566 0.0405 480 CYS A CB +1182 S SG . CYS A 162 ? 0.6681 0.4866 0.6659 0.0312 0.0553 0.0271 480 CYS A SG +1183 N N . ASN A 163 ? 0.5496 0.2576 0.5194 0.0404 0.0705 0.0554 481 ASN A N +1184 C CA . ASN A 163 ? 0.6506 0.3291 0.6061 0.0436 0.0730 0.0700 481 ASN A CA +1185 C C . ASN A 163 ? 0.6853 0.3741 0.6264 0.0459 0.0666 0.0836 481 ASN A C +1186 O O . ASN A 163 ? 0.6831 0.3625 0.6128 0.0561 0.0611 0.0957 481 ASN A O +1187 C CB . ASN A 163 ? 0.6641 0.3254 0.6229 0.0600 0.0704 0.0732 481 ASN A CB +1188 C CG . ASN A 163 ? 0.7491 0.3994 0.7206 0.0588 0.0773 0.0584 481 ASN A CG +1189 O OD1 . ASN A 163 ? 0.7214 0.3601 0.6915 0.0438 0.0844 0.0509 481 ASN A OD1 +1190 N ND2 . ASN A 163 ? 0.8270 0.4829 0.8119 0.0746 0.0752 0.0533 481 ASN A ND2 +1191 N N . GLY A 164 ? 0.6631 0.3791 0.6054 0.0357 0.0643 0.0790 482 GLY A N +1192 C CA . GLY A 164 ? 0.5973 0.3236 0.5251 0.0358 0.0596 0.0889 482 GLY A CA +1193 C C . GLY A 164 ? 0.6722 0.4150 0.5979 0.0511 0.0464 0.0940 482 GLY A C +1194 O O . GLY A 164 ? 0.6842 0.4309 0.5935 0.0529 0.0417 0.1027 482 GLY A O +1195 N N . VAL A 165 ? 0.6270 0.3812 0.5694 0.0618 0.0405 0.0877 483 VAL A N +1196 C CA . VAL A 165 ? 0.5522 0.3254 0.4984 0.0762 0.0270 0.0910 483 VAL A CA +1197 C C . VAL A 165 ? 0.5754 0.3835 0.5401 0.0712 0.0232 0.0781 483 VAL A C +1198 O O . VAL A 165 ? 0.5137 0.3278 0.4948 0.0683 0.0287 0.0672 483 VAL A O +1199 C CB . VAL A 165 ? 0.5374 0.2971 0.4919 0.0944 0.0232 0.0951 483 VAL A CB +1200 C CG1 . VAL A 165 ? 0.5859 0.3718 0.5503 0.1088 0.0078 0.0963 483 VAL A CG1 +1201 C CG2 . VAL A 165 ? 0.6353 0.3556 0.5682 0.0997 0.0271 0.1099 483 VAL A CG2 +1202 N N . GLU A 166 ? 0.4541 0.2832 0.4143 0.0701 0.0144 0.0794 484 GLU A N +1203 C CA . GLU A 166 ? 0.4426 0.3023 0.4197 0.0659 0.0104 0.0687 484 GLU A CA +1204 C C . GLU A 166 ? 0.5010 0.3762 0.5004 0.0785 0.0043 0.0647 484 GLU A C +1205 O O . GLU A 166 ? 0.4963 0.3662 0.4961 0.0933 -0.0035 0.0720 484 GLU A O +1206 C CB . GLU A 166 ? 0.5227 0.3978 0.4894 0.0616 0.0024 0.0704 484 GLU A CB +1207 C CG . GLU A 166 ? 0.5641 0.4282 0.5114 0.0504 0.0088 0.0735 484 GLU A CG +1208 C CD . GLU A 166 ? 0.6575 0.5346 0.5930 0.0485 0.0011 0.0744 484 GLU A CD +1209 O OE1 . GLU A 166 ? 0.7572 0.6218 0.6715 0.0460 0.0040 0.0810 484 GLU A OE1 +1210 O OE2 . GLU A 166 ? 0.6905 0.5896 0.6380 0.0488 -0.0068 0.0678 484 GLU A OE2 +1211 N N . GLY A 167 ? 0.4455 0.3406 0.4636 0.0730 0.0080 0.0534 485 GLY A N +1212 C CA . GLY A 167 ? 0.4468 0.3611 0.4904 0.0832 0.0048 0.0479 485 GLY A CA +1213 C C . GLY A 167 ? 0.3973 0.3261 0.4554 0.0738 0.0146 0.0356 485 GLY A C +1214 O O . GLY A 167 ? 0.3778 0.3076 0.4261 0.0598 0.0191 0.0324 485 GLY A O +1215 N N . PHE A 168 ? 0.4257 0.3655 0.5069 0.0824 0.0181 0.0291 486 PHE A N +1216 C CA . PHE A 168 ? 0.4248 0.3768 0.5172 0.0739 0.0296 0.0177 486 PHE A CA +1217 C C . PHE A 168 ? 0.3559 0.2849 0.4295 0.0638 0.0405 0.0142 486 PHE A C +1218 O O . PHE A 168 ? 0.4030 0.3080 0.4701 0.0689 0.0445 0.0153 486 PHE A O +1219 C CB . PHE A 168 ? 0.4227 0.3877 0.5427 0.0862 0.0342 0.0108 486 PHE A CB +1220 C CG . PHE A 168 ? 0.4603 0.4402 0.5909 0.0775 0.0473 -0.0009 486 PHE A CG +1221 C CD1 . PHE A 168 ? 0.4417 0.4495 0.5855 0.0695 0.0464 -0.0041 486 PHE A CD1 +1222 C CD2 . PHE A 168 ? 0.5081 0.4723 0.6334 0.0764 0.0612 -0.0087 486 PHE A CD2 +1223 C CE1 . PHE A 168 ? 0.3854 0.4043 0.5355 0.0608 0.0601 -0.0134 486 PHE A CE1 +1224 C CE2 . PHE A 168 ? 0.4745 0.4508 0.6044 0.0682 0.0742 -0.0190 486 PHE A CE2 +1225 C CZ . PHE A 168 ? 0.4492 0.4524 0.5907 0.0604 0.0742 -0.0205 486 PHE A CZ +1226 N N . ASN A 169 ? 0.3143 0.2502 0.3796 0.0495 0.0445 0.0097 487 ASN A N +1227 C CA . ASN A 169 ? 0.2939 0.2129 0.3417 0.0389 0.0521 0.0055 487 ASN A CA +1228 C C . ASN A 169 ? 0.3909 0.2896 0.4217 0.0354 0.0483 0.0127 487 ASN A C +1229 O O . ASN A 169 ? 0.4316 0.3143 0.4517 0.0284 0.0537 0.0089 487 ASN A O +1230 C CB . ASN A 169 ? 0.2995 0.2065 0.3506 0.0424 0.0631 -0.0036 487 ASN A CB +1231 C CG . ASN A 169 ? 0.3466 0.2716 0.4086 0.0410 0.0719 -0.0132 487 ASN A CG +1232 O OD1 . ASN A 169 ? 0.3557 0.3003 0.4212 0.0347 0.0705 -0.0127 487 ASN A OD1 +1233 N ND2 . ASN A 169 ? 0.3362 0.2527 0.4026 0.0462 0.0825 -0.0223 487 ASN A ND2 +1234 N N . CYS A 170 ? 0.3185 0.2180 0.3463 0.0397 0.0394 0.0224 488 CYS A N +1235 C CA . CYS A 170 ? 0.3706 0.2501 0.3826 0.0375 0.0380 0.0303 488 CYS A CA +1236 C C . CYS A 170 ? 0.3781 0.2683 0.3821 0.0342 0.0300 0.0367 488 CYS A C +1237 O O . CYS A 170 ? 0.4008 0.2950 0.4046 0.0428 0.0222 0.0433 488 CYS A O +1238 C CB . CYS A 170 ? 0.3887 0.2487 0.4010 0.0500 0.0378 0.0368 488 CYS A CB +1239 S SG . CYS A 170 ? 0.4831 0.3207 0.4995 0.0512 0.0492 0.0284 488 CYS A SG +1240 N N . TYR A 171 ? 0.3223 0.2169 0.3192 0.0225 0.0314 0.0341 489 TYR A N +1241 C CA . TYR A 171 ? 0.3295 0.2368 0.3215 0.0191 0.0250 0.0369 489 TYR A CA +1242 C C . TYR A 171 ? 0.3965 0.2928 0.3743 0.0137 0.0264 0.0419 489 TYR A C +1243 O O . TYR A 171 ? 0.4054 0.2932 0.3809 0.0063 0.0323 0.0393 489 TYR A O +1244 C CB . TYR A 171 ? 0.3344 0.2571 0.3315 0.0113 0.0255 0.0299 489 TYR A CB +1245 C CG . TYR A 171 ? 0.3443 0.2779 0.3558 0.0145 0.0279 0.0242 489 TYR A CG +1246 C CD1 . TYR A 171 ? 0.3899 0.3339 0.4144 0.0239 0.0233 0.0254 489 TYR A CD1 +1247 C CD2 . TYR A 171 ? 0.3958 0.3301 0.4079 0.0084 0.0350 0.0172 489 TYR A CD2 +1248 C CE1 . TYR A 171 ? 0.3609 0.3180 0.4030 0.0268 0.0273 0.0192 489 TYR A CE1 +1249 C CE2 . TYR A 171 ? 0.3868 0.3312 0.4114 0.0109 0.0401 0.0115 489 TYR A CE2 +1250 C CZ . TYR A 171 ? 0.3602 0.3167 0.4017 0.0199 0.0370 0.0123 489 TYR A CZ +1251 O OH . TYR A 171 ? 0.3885 0.3580 0.4464 0.0222 0.0436 0.0058 489 TYR A OH +1252 N N . PHE A 172 ? 0.3524 0.2503 0.3212 0.0170 0.0210 0.0480 490 PHE A N +1253 C CA . PHE A 172 ? 0.3240 0.2161 0.2804 0.0111 0.0239 0.0513 490 PHE A CA +1254 C C . PHE A 172 ? 0.3515 0.2555 0.3127 0.0024 0.0246 0.0445 490 PHE A C +1255 O O . PHE A 172 ? 0.3633 0.2804 0.3298 0.0023 0.0196 0.0405 490 PHE A O +1256 C CB . PHE A 172 ? 0.3953 0.2874 0.3378 0.0166 0.0181 0.0577 490 PHE A CB +1257 C CG . PHE A 172 ? 0.4140 0.2974 0.3422 0.0117 0.0242 0.0617 490 PHE A CG +1258 C CD1 . PHE A 172 ? 0.4763 0.3403 0.3950 0.0116 0.0318 0.0691 490 PHE A CD1 +1259 C CD2 . PHE A 172 ? 0.4208 0.3145 0.3464 0.0068 0.0240 0.0578 490 PHE A CD2 +1260 C CE1 . PHE A 172 ? 0.5379 0.3953 0.4454 0.0058 0.0400 0.0725 490 PHE A CE1 +1261 C CE2 . PHE A 172 ? 0.4366 0.3243 0.3516 0.0026 0.0316 0.0605 490 PHE A CE2 +1262 C CZ . PHE A 172 ? 0.4848 0.3556 0.3913 0.0017 0.0401 0.0678 490 PHE A CZ +1263 N N . PRO A 173 ? 0.3337 0.2334 0.2947 -0.0051 0.0303 0.0428 491 PRO A N +1264 C CA . PRO A 173 ? 0.3579 0.2680 0.3252 -0.0116 0.0295 0.0362 491 PRO A CA +1265 C C . PRO A 173 ? 0.3764 0.2960 0.3408 -0.0124 0.0260 0.0358 491 PRO A C +1266 O O . PRO A 173 ? 0.3245 0.2516 0.2930 -0.0154 0.0234 0.0316 491 PRO A O +1267 C CB . PRO A 173 ? 0.3840 0.2878 0.3546 -0.0185 0.0352 0.0341 491 PRO A CB +1268 C CG . PRO A 173 ? 0.4117 0.3030 0.3759 -0.0175 0.0408 0.0408 491 PRO A CG +1269 C CD . PRO A 173 ? 0.4122 0.2973 0.3691 -0.0081 0.0377 0.0467 491 PRO A CD +1270 N N . LEU A 174 ? 0.3520 0.2694 0.3076 -0.0096 0.0261 0.0400 492 LEU A N +1271 C CA . LEU A 174 ? 0.3542 0.2782 0.3060 -0.0099 0.0240 0.0382 492 LEU A CA +1272 C C . LEU A 174 ? 0.4069 0.3350 0.3540 -0.0055 0.0166 0.0379 492 LEU A C +1273 O O . LEU A 174 ? 0.4256 0.3512 0.3688 -0.0005 0.0135 0.0412 492 LEU A O +1274 C CB . LEU A 174 ? 0.3310 0.2504 0.2746 -0.0105 0.0305 0.0412 492 LEU A CB +1275 C CG . LEU A 174 ? 0.3590 0.2756 0.3102 -0.0162 0.0387 0.0414 492 LEU A CG +1276 C CD1 . LEU A 174 ? 0.3863 0.3001 0.3298 -0.0173 0.0473 0.0443 492 LEU A CD1 +1277 C CD2 . LEU A 174 ? 0.3452 0.2721 0.3109 -0.0205 0.0364 0.0350 492 LEU A CD2 +1278 N N . GLN A 175 ? 0.3428 0.2769 0.2913 -0.0072 0.0133 0.0335 493 GLN A N +1279 C CA . GLN A 175 ? 0.3560 0.2944 0.3019 -0.0053 0.0062 0.0311 493 GLN A CA +1280 C C . GLN A 175 ? 0.3973 0.3340 0.3338 -0.0054 0.0060 0.0281 493 GLN A C +1281 O O . GLN A 175 ? 0.4482 0.3837 0.3865 -0.0071 0.0106 0.0265 493 GLN A O +1282 C CB . GLN A 175 ? 0.4149 0.3595 0.3728 -0.0089 0.0035 0.0275 493 GLN A CB +1283 C CG . GLN A 175 ? 0.6014 0.5525 0.5621 -0.0092 -0.0034 0.0241 493 GLN A CG +1284 C CD . GLN A 175 ? 0.7456 0.7046 0.7158 -0.0062 -0.0065 0.0250 493 GLN A CD +1285 O OE1 . GLN A 175 ? 0.7963 0.7525 0.7636 -0.0006 -0.0061 0.0293 493 GLN A OE1 +1286 N NE2 . GLN A 175 ? 0.6993 0.6677 0.6823 -0.0098 -0.0089 0.0209 493 GLN A NE2 +1287 N N . SER A 176 ? 0.3824 0.3196 0.3091 -0.0028 0.0001 0.0264 494 SER A N +1288 C CA . SER A 176 ? 0.3968 0.3308 0.3124 -0.0027 0.0001 0.0215 494 SER A CA +1289 C C . SER A 176 ? 0.4274 0.3632 0.3512 -0.0065 -0.0043 0.0147 494 SER A C +1290 O O . SER A 176 ? 0.4225 0.3638 0.3560 -0.0092 -0.0099 0.0133 494 SER A O +1291 C CB . SER A 176 ? 0.4638 0.3955 0.3604 0.0015 -0.0047 0.0219 494 SER A CB +1292 O OG . SER A 176 ? 0.6256 0.5536 0.5108 0.0012 -0.0047 0.0149 494 SER A OG +1293 N N . TYR A 177 ? 0.3839 0.3143 0.3047 -0.0068 -0.0008 0.0104 495 TYR A N +1294 C CA . TYR A 177 ? 0.3846 0.3113 0.3096 -0.0101 -0.0045 0.0039 495 TYR A CA +1295 C C . TYR A 177 ? 0.4439 0.3705 0.3598 -0.0112 -0.0121 -0.0026 495 TYR A C +1296 O O . TYR A 177 ? 0.4816 0.4084 0.4053 -0.0164 -0.0174 -0.0072 495 TYR A O +1297 C CB . TYR A 177 ? 0.3656 0.2849 0.2899 -0.0080 0.0010 0.0008 495 TYR A CB +1298 C CG . TYR A 177 ? 0.3279 0.2481 0.2647 -0.0078 0.0045 0.0051 495 TYR A CG +1299 C CD1 . TYR A 177 ? 0.3591 0.2760 0.3039 -0.0113 0.0015 0.0064 495 TYR A CD1 +1300 C CD2 . TYR A 177 ? 0.3429 0.2671 0.2827 -0.0045 0.0108 0.0076 495 TYR A CD2 +1301 C CE1 . TYR A 177 ? 0.3520 0.2688 0.3041 -0.0104 0.0030 0.0105 495 TYR A CE1 +1302 C CE2 . TYR A 177 ? 0.3199 0.2468 0.2717 -0.0041 0.0117 0.0103 495 TYR A CE2 +1303 C CZ . TYR A 177 ? 0.3014 0.2242 0.2575 -0.0064 0.0069 0.0119 495 TYR A CZ +1304 O OH . TYR A 177 ? 0.3592 0.2839 0.3232 -0.0054 0.0059 0.0149 495 TYR A OH +1305 N N . GLY A 178 ? 0.4749 0.4003 0.3731 -0.0070 -0.0128 -0.0035 496 GLY A N +1306 C CA . GLY A 178 ? 0.6040 0.5295 0.4909 -0.0080 -0.0221 -0.0111 496 GLY A CA +1307 C C . GLY A 178 ? 0.6421 0.5589 0.5279 -0.0118 -0.0234 -0.0220 496 GLY A C +1308 O O . GLY A 178 ? 0.6662 0.5852 0.5554 -0.0169 -0.0325 -0.0291 496 GLY A O +1309 N N . PHE A 179 ? 0.4429 0.3498 0.3256 -0.0094 -0.0144 -0.0242 497 PHE A N +1310 C CA . PHE A 179 ? 0.4122 0.3066 0.2943 -0.0114 -0.0141 -0.0342 497 PHE A CA +1311 C C . PHE A 179 ? 0.4284 0.3184 0.2934 -0.0134 -0.0216 -0.0459 497 PHE A C +1312 O O . PHE A 179 ? 0.4483 0.3381 0.2915 -0.0089 -0.0208 -0.0481 497 PHE A O +1313 C CB . PHE A 179 ? 0.4087 0.2955 0.2885 -0.0051 -0.0030 -0.0348 497 PHE A CB +1314 C CG . PHE A 179 ? 0.4132 0.3042 0.3108 -0.0033 0.0023 -0.0256 497 PHE A CG +1315 C CD1 . PHE A 179 ? 0.3763 0.2630 0.2886 -0.0069 -0.0005 -0.0231 497 PHE A CD1 +1316 C CD2 . PHE A 179 ? 0.3815 0.2798 0.2798 0.0014 0.0103 -0.0199 497 PHE A CD2 +1317 C CE1 . PHE A 179 ? 0.3731 0.2631 0.2981 -0.0049 0.0027 -0.0152 497 PHE A CE1 +1318 C CE2 . PHE A 179 ? 0.3542 0.2576 0.2693 0.0025 0.0134 -0.0132 497 PHE A CE2 +1319 C CZ . PHE A 179 ? 0.3453 0.2447 0.2725 -0.0001 0.0087 -0.0110 497 PHE A CZ +1320 N N . GLN A 180 ? 0.3888 0.2737 0.2622 -0.0208 -0.0282 -0.0538 498 GLN A N +1321 C CA . GLN A 180 ? 0.3948 0.2738 0.2546 -0.0246 -0.0362 -0.0678 498 GLN A CA +1322 C C . GLN A 180 ? 0.4915 0.3500 0.3531 -0.0273 -0.0319 -0.0778 498 GLN A C +1323 O O . GLN A 180 ? 0.4571 0.3086 0.3367 -0.0304 -0.0281 -0.0734 498 GLN A O +1324 C CB . GLN A 180 ? 0.5081 0.4003 0.3795 -0.0330 -0.0495 -0.0706 498 GLN A CB +1325 C CG . GLN A 180 ? 0.5943 0.5064 0.4684 -0.0295 -0.0553 -0.0608 498 GLN A CG +1326 C CD . GLN A 180 ? 0.7340 0.6618 0.6229 -0.0368 -0.0693 -0.0661 498 GLN A CD +1327 O OE1 . GLN A 180 ? 0.6878 0.6149 0.5689 -0.0413 -0.0794 -0.0788 498 GLN A OE1 +1328 N NE2 . GLN A 180 ? 0.8265 0.7695 0.7382 -0.0382 -0.0699 -0.0575 498 GLN A NE2 +1329 N N . PRO A 181 ? 0.5151 0.3616 0.3567 -0.0261 -0.0327 -0.0915 499 PRO A N +1330 C CA . PRO A 181 ? 0.5019 0.3253 0.3446 -0.0266 -0.0270 -0.1014 499 PRO A CA +1331 C C . PRO A 181 ? 0.5235 0.3373 0.3843 -0.0382 -0.0324 -0.1054 499 PRO A C +1332 O O . PRO A 181 ? 0.5152 0.3079 0.3822 -0.0378 -0.0261 -0.1076 499 PRO A O +1333 C CB . PRO A 181 ? 0.5706 0.3851 0.3851 -0.0240 -0.0280 -0.1170 499 PRO A CB +1334 C CG . PRO A 181 ? 0.6293 0.4617 0.4313 -0.0270 -0.0403 -0.1171 499 PRO A CG +1335 C CD . PRO A 181 ? 0.5207 0.3718 0.3352 -0.0236 -0.0387 -0.0988 499 PRO A CD +1336 N N . THR A 182 ? 0.4978 0.3260 0.3685 -0.0482 -0.0431 -0.1059 500 THR A N +1337 C CA . THR A 182 ? 0.5673 0.3892 0.4581 -0.0616 -0.0466 -0.1093 500 THR A CA +1338 C C . THR A 182 ? 0.5279 0.3541 0.4403 -0.0639 -0.0406 -0.0935 500 THR A C +1339 O O . THR A 182 ? 0.5292 0.3506 0.4582 -0.0759 -0.0412 -0.0942 500 THR A O +1340 C CB . THR A 182 ? 0.5505 0.3903 0.4460 -0.0719 -0.0609 -0.1185 500 THR A CB +1341 O OG1 . THR A 182 ? 0.6318 0.4992 0.5318 -0.0673 -0.0656 -0.1076 500 THR A OG1 +1342 C CG2 . THR A 182 ? 0.6552 0.4876 0.5264 -0.0714 -0.0685 -0.1361 500 THR A CG2 +1343 N N . ASN A 183 ? 0.4318 0.2664 0.3433 -0.0538 -0.0344 -0.0801 501 ASN A N +1344 C CA . ASN A 183 ? 0.4088 0.2450 0.3358 -0.0548 -0.0286 -0.0661 501 ASN A CA +1345 C C . ASN A 183 ? 0.4924 0.3015 0.4232 -0.0577 -0.0225 -0.0655 501 ASN A C +1346 O O . ASN A 183 ? 0.4488 0.2376 0.3697 -0.0522 -0.0197 -0.0723 501 ASN A O +1347 C CB . ASN A 183 ? 0.4151 0.2610 0.3380 -0.0429 -0.0232 -0.0547 501 ASN A CB +1348 C CG . ASN A 183 ? 0.4750 0.3456 0.3986 -0.0414 -0.0276 -0.0499 501 ASN A CG +1349 O OD1 . ASN A 183 ? 0.4994 0.3821 0.4283 -0.0480 -0.0356 -0.0544 501 ASN A OD1 +1350 N ND2 . ASN A 183 ? 0.4009 0.2788 0.3203 -0.0325 -0.0228 -0.0413 501 ASN A ND2 +1351 N N . GLY A 184 ? 0.4432 0.2505 0.3872 -0.0655 -0.0197 -0.0568 502 GLY A N +1352 C CA . GLY A 184 ? 0.4668 0.2472 0.4107 -0.0652 -0.0132 -0.0508 502 GLY A CA +1353 C C . GLY A 184 ? 0.4776 0.2546 0.4144 -0.0498 -0.0093 -0.0423 502 GLY A C +1354 O O . GLY A 184 ? 0.4359 0.2337 0.3718 -0.0424 -0.0097 -0.0379 502 GLY A O +1355 N N . VAL A 185 ? 0.4547 0.2048 0.3881 -0.0448 -0.0057 -0.0401 503 VAL A N +1356 C CA . VAL A 185 ? 0.4949 0.2429 0.4249 -0.0288 -0.0033 -0.0351 503 VAL A CA +1357 C C . VAL A 185 ? 0.4889 0.2577 0.4231 -0.0247 -0.0032 -0.0220 503 VAL A C +1358 O O . VAL A 185 ? 0.4565 0.2397 0.3912 -0.0142 -0.0025 -0.0208 503 VAL A O +1359 C CB . VAL A 185 ? 0.5034 0.2179 0.4311 -0.0235 -0.0009 -0.0332 503 VAL A CB +1360 C CG1 . VAL A 185 ? 0.6411 0.3576 0.5705 -0.0072 -0.0002 -0.0248 503 VAL A CG1 +1361 C CG2 . VAL A 185 ? 0.6360 0.3308 0.5586 -0.0233 -0.0002 -0.0490 503 VAL A CG2 +1362 N N . GLY A 186 ? 0.4870 0.2583 0.4243 -0.0337 -0.0029 -0.0131 504 GLY A N +1363 C CA . GLY A 186 ? 0.4763 0.2655 0.4155 -0.0303 -0.0028 -0.0023 504 GLY A CA +1364 C C . GLY A 186 ? 0.4467 0.2642 0.3893 -0.0296 -0.0040 -0.0051 504 GLY A C +1365 O O . GLY A 186 ? 0.4388 0.2703 0.3828 -0.0243 -0.0037 0.0014 504 GLY A O +1366 N N . TYR A 187 ? 0.4067 0.2316 0.3497 -0.0348 -0.0061 -0.0145 505 TYR A N +1367 C CA . TYR A 187 ? 0.3692 0.2170 0.3122 -0.0328 -0.0081 -0.0166 505 TYR A CA +1368 C C . TYR A 187 ? 0.3562 0.2046 0.2906 -0.0240 -0.0075 -0.0234 505 TYR A C +1369 O O . TYR A 187 ? 0.3977 0.2615 0.3281 -0.0217 -0.0083 -0.0243 505 TYR A O +1370 C CB . TYR A 187 ? 0.3952 0.2533 0.3432 -0.0429 -0.0124 -0.0220 505 TYR A CB +1371 C CG . TYR A 187 ? 0.4264 0.2944 0.3855 -0.0504 -0.0110 -0.0150 505 TYR A CG +1372 C CD1 . TYR A 187 ? 0.4704 0.3258 0.4351 -0.0600 -0.0077 -0.0131 505 TYR A CD1 +1373 C CD2 . TYR A 187 ? 0.4661 0.3545 0.4296 -0.0480 -0.0114 -0.0104 505 TYR A CD2 +1374 C CE1 . TYR A 187 ? 0.4393 0.3047 0.4135 -0.0672 -0.0040 -0.0073 505 TYR A CE1 +1375 C CE2 . TYR A 187 ? 0.4555 0.3534 0.4295 -0.0540 -0.0085 -0.0054 505 TYR A CE2 +1376 C CZ . TYR A 187 ? 0.4940 0.3814 0.4731 -0.0636 -0.0044 -0.0041 505 TYR A CZ +1377 O OH . TYR A 187 ? 0.5098 0.4074 0.4986 -0.0698 0.0007 0.0003 505 TYR A OH +1378 N N . GLN A 188 ? 0.3689 0.1997 0.2997 -0.0186 -0.0051 -0.0282 506 GLN A N +1379 C CA . GLN A 188 ? 0.3707 0.2020 0.2933 -0.0102 -0.0021 -0.0360 506 GLN A CA +1380 C C . GLN A 188 ? 0.3934 0.2362 0.3209 -0.0006 0.0028 -0.0294 506 GLN A C +1381 O O . GLN A 188 ? 0.3832 0.2270 0.3199 0.0014 0.0025 -0.0204 506 GLN A O +1382 C CB . GLN A 188 ? 0.4144 0.2219 0.3330 -0.0076 -0.0005 -0.0455 506 GLN A CB +1383 C CG . GLN A 188 ? 0.4248 0.2221 0.3358 -0.0173 -0.0050 -0.0573 506 GLN A CG +1384 C CD . GLN A 188 ? 0.5530 0.3223 0.4604 -0.0154 -0.0029 -0.0672 506 GLN A CD +1385 O OE1 . GLN A 188 ? 0.5168 0.2767 0.4245 -0.0038 0.0026 -0.0679 506 GLN A OE1 +1386 N NE2 . GLN A 188 ? 0.5160 0.2717 0.4220 -0.0268 -0.0072 -0.0756 506 GLN A NE2 +1387 N N . PRO A 189 ? 0.3762 0.2278 0.2972 0.0049 0.0076 -0.0339 507 PRO A N +1388 C CA . PRO A 189 ? 0.3776 0.2423 0.3070 0.0123 0.0134 -0.0287 507 PRO A CA +1389 C C . PRO A 189 ? 0.3877 0.2441 0.3270 0.0219 0.0168 -0.0310 507 PRO A C +1390 O O . PRO A 189 ? 0.3941 0.2348 0.3286 0.0256 0.0187 -0.0399 507 PRO A O +1391 C CB . PRO A 189 ? 0.3522 0.2257 0.2690 0.0138 0.0193 -0.0333 507 PRO A CB +1392 C CG . PRO A 189 ? 0.3961 0.2556 0.2969 0.0121 0.0174 -0.0449 507 PRO A CG +1393 C CD . PRO A 189 ? 0.3725 0.2232 0.2771 0.0037 0.0079 -0.0439 507 PRO A CD +1394 N N . TYR A 190 ? 0.4078 0.2751 0.3617 0.0263 0.0169 -0.0234 508 TYR A N +1395 C CA . TYR A 190 ? 0.3749 0.2409 0.3428 0.0376 0.0190 -0.0247 508 TYR A CA +1396 C C . TYR A 190 ? 0.4021 0.2916 0.3830 0.0416 0.0254 -0.0239 508 TYR A C +1397 O O . TYR A 190 ? 0.3588 0.2625 0.3424 0.0357 0.0241 -0.0173 508 TYR A O +1398 C CB . TYR A 190 ? 0.3607 0.2176 0.3357 0.0394 0.0105 -0.0160 508 TYR A CB +1399 C CG . TYR A 190 ? 0.4281 0.2572 0.3941 0.0384 0.0074 -0.0181 508 TYR A CG +1400 C CD1 . TYR A 190 ? 0.4080 0.2274 0.3610 0.0265 0.0059 -0.0198 508 TYR A CD1 +1401 C CD2 . TYR A 190 ? 0.4149 0.2271 0.3869 0.0493 0.0063 -0.0190 508 TYR A CD2 +1402 C CE1 . TYR A 190 ? 0.4283 0.2216 0.3748 0.0234 0.0041 -0.0228 508 TYR A CE1 +1403 C CE2 . TYR A 190 ? 0.4748 0.2571 0.4377 0.0475 0.0046 -0.0211 508 TYR A CE2 +1404 C CZ . TYR A 190 ? 0.4808 0.2538 0.4311 0.0334 0.0040 -0.0231 508 TYR A CZ +1405 O OH . TYR A 190 ? 0.5088 0.2522 0.4520 0.0293 0.0031 -0.0259 508 TYR A OH +1406 N N . ARG A 191 ? 0.3592 0.2526 0.3492 0.0510 0.0332 -0.0313 509 ARG A N +1407 C CA . ARG A 191 ? 0.4070 0.3242 0.4152 0.0546 0.0404 -0.0311 509 ARG A CA +1408 C C . ARG A 191 ? 0.3857 0.3107 0.4175 0.0625 0.0327 -0.0265 509 ARG A C +1409 O O . ARG A 191 ? 0.3651 0.2751 0.3998 0.0709 0.0269 -0.0271 509 ARG A O +1410 C CB . ARG A 191 ? 0.3907 0.3115 0.3993 0.0609 0.0544 -0.0420 509 ARG A CB +1411 C CG . ARG A 191 ? 0.4012 0.3192 0.3844 0.0527 0.0617 -0.0446 509 ARG A CG +1412 C CD . ARG A 191 ? 0.4336 0.3520 0.4096 0.0580 0.0769 -0.0557 509 ARG A CD +1413 N NE . ARG A 191 ? 0.4731 0.3892 0.4212 0.0497 0.0819 -0.0553 509 ARG A NE +1414 C CZ . ARG A 191 ? 0.5061 0.4265 0.4418 0.0504 0.0969 -0.0605 509 ARG A CZ +1415 N NH1 . ARG A 191 ? 0.4368 0.3667 0.3890 0.0587 0.1105 -0.0681 509 ARG A NH1 +1416 N NH2 . ARG A 191 ? 0.4836 0.3992 0.3901 0.0433 0.0986 -0.0578 509 ARG A NH2 +1417 N N . VAL A 192 ? 0.3263 0.2731 0.3732 0.0594 0.0315 -0.0217 510 VAL A N +1418 C CA . VAL A 192 ? 0.3796 0.3364 0.4466 0.0653 0.0210 -0.0168 510 VAL A CA +1419 C C . VAL A 192 ? 0.3400 0.3261 0.4356 0.0686 0.0274 -0.0209 510 VAL A C +1420 O O . VAL A 192 ? 0.3257 0.3251 0.4222 0.0598 0.0369 -0.0220 510 VAL A O +1421 C CB . VAL A 192 ? 0.3286 0.2835 0.3858 0.0560 0.0105 -0.0074 510 VAL A CB +1422 C CG1 . VAL A 192 ? 0.3473 0.3129 0.4217 0.0624 -0.0016 -0.0030 510 VAL A CG1 +1423 C CG2 . VAL A 192 ? 0.3558 0.2846 0.3881 0.0512 0.0061 -0.0036 510 VAL A CG2 +1424 N N . VAL A 193 ? 0.3233 0.3194 0.4435 0.0813 0.0220 -0.0229 511 VAL A N +1425 C CA . VAL A 193 ? 0.2944 0.3228 0.4489 0.0845 0.0249 -0.0269 511 VAL A CA +1426 C C . VAL A 193 ? 0.3178 0.3549 0.4868 0.0898 0.0062 -0.0212 511 VAL A C +1427 O O . VAL A 193 ? 0.3408 0.3626 0.5068 0.1015 -0.0048 -0.0180 511 VAL A O +1428 C CB . VAL A 193 ? 0.3230 0.3613 0.4991 0.0971 0.0367 -0.0371 511 VAL A CB +1429 C CG1 . VAL A 193 ? 0.3519 0.4284 0.5688 0.0990 0.0405 -0.0418 511 VAL A CG1 +1430 C CG2 . VAL A 193 ? 0.3356 0.3623 0.4903 0.0918 0.0548 -0.0431 511 VAL A CG2 +1431 N N . VAL A 194 ? 0.2774 0.3369 0.4603 0.0813 0.0025 -0.0199 512 VAL A N +1432 C CA . VAL A 194 ? 0.2999 0.3725 0.4976 0.0856 -0.0159 -0.0163 512 VAL A CA +1433 C C . VAL A 194 ? 0.2692 0.3791 0.5114 0.0911 -0.0142 -0.0244 512 VAL A C +1434 O O . VAL A 194 ? 0.2779 0.4085 0.5355 0.0799 -0.0025 -0.0294 512 VAL A O +1435 C CB . VAL A 194 ? 0.2922 0.3620 0.4720 0.0712 -0.0232 -0.0105 512 VAL A CB +1436 C CG1 . VAL A 194 ? 0.3568 0.4375 0.5461 0.0761 -0.0436 -0.0073 512 VAL A CG1 +1437 C CG2 . VAL A 194 ? 0.3079 0.3447 0.4485 0.0653 -0.0223 -0.0036 512 VAL A CG2 +1438 N N . LEU A 195 ? 0.2800 0.3985 0.5440 0.1082 -0.0255 -0.0256 513 LEU A N +1439 C CA . LEU A 195 ? 0.3494 0.5076 0.6612 0.1152 -0.0275 -0.0336 513 LEU A CA +1440 C C . LEU A 195 ? 0.4023 0.5761 0.7231 0.1142 -0.0505 -0.0299 513 LEU A C +1441 O O . LEU A 195 ? 0.3982 0.5541 0.7010 0.1238 -0.0690 -0.0218 513 LEU A O +1442 C CB . LEU A 195 ? 0.3667 0.5277 0.7010 0.1369 -0.0269 -0.0382 513 LEU A CB +1443 C CG . LEU A 195 ? 0.3708 0.5139 0.6941 0.1401 -0.0052 -0.0437 513 LEU A CG +1444 C CD1 . LEU A 195 ? 0.3804 0.5251 0.7276 0.1634 -0.0060 -0.0491 513 LEU A CD1 +1445 C CD2 . LEU A 195 ? 0.3447 0.5080 0.6794 0.1262 0.0179 -0.0516 513 LEU A CD2 +1446 N N . SER A 196 ? 0.4136 0.6186 0.7597 0.1018 -0.0490 -0.0358 514 SER A N +1447 C CA . SER A 196 ? 0.3802 0.6052 0.7392 0.0995 -0.0707 -0.0357 514 SER A CA +1448 C C . SER A 196 ? 0.3352 0.6051 0.7510 0.1085 -0.0755 -0.0457 514 SER A C +1449 O O . SER A 196 ? 0.3612 0.6542 0.8084 0.1038 -0.0561 -0.0547 514 SER A O +1450 C CB . SER A 196 ? 0.2914 0.5177 0.6378 0.0768 -0.0670 -0.0365 514 SER A CB +1451 O OG . SER A 196 ? 0.5553 0.7443 0.8550 0.0686 -0.0597 -0.0286 514 SER A OG +1452 N N . PHE A 197 ? 0.3670 0.6498 0.7958 0.1218 -0.1014 -0.0441 515 PHE A N +1453 C CA . PHE A 197 ? 0.4492 0.7769 0.9349 0.1336 -0.1102 -0.0534 515 PHE A CA +1454 C C . PHE A 197 ? 0.5432 0.8976 1.0413 0.1194 -0.1250 -0.0575 515 PHE A C +1455 O O . PHE A 197 ? 0.5464 0.8905 1.0199 0.1211 -0.1486 -0.0513 515 PHE A O +1456 C CB . PHE A 197 ? 0.4846 0.7989 0.9620 0.1576 -0.1252 -0.0457 515 PHE A CB +1457 C CG . PHE A 197 ? 0.5459 0.8285 1.0071 0.1707 -0.1112 -0.0423 515 PHE A CG +1458 C CD1 . PHE A 197 ? 0.5467 0.8367 1.0267 0.1682 -0.0840 -0.0512 515 PHE A CD1 +1459 C CD2 . PHE A 197 ? 0.6652 0.9079 1.0886 0.1839 -0.1239 -0.0303 515 PHE A CD2 +1460 C CE1 . PHE A 197 ? 0.5372 0.7964 0.9996 0.1794 -0.0710 -0.0498 515 PHE A CE1 +1461 C CE2 . PHE A 197 ? 0.6501 0.8609 1.0576 0.1941 -0.1106 -0.0283 515 PHE A CE2 +1462 C CZ . PHE A 197 ? 0.5436 0.7627 0.9698 0.1916 -0.0845 -0.0387 515 PHE A CZ +1463 N N . GLU A 198 ? 0.5510 0.9371 1.0841 0.1048 -0.1100 -0.0679 516 GLU A N +1464 C CA . GLU A 198 ? 0.6607 1.0714 1.2085 0.0877 -0.1194 -0.0741 516 GLU A CA +1465 C C . GLU A 198 ? 0.7091 1.1567 1.2968 0.0945 -0.1269 -0.0797 516 GLU A C +1466 O O . GLU A 198 ? 0.6102 1.0741 1.2273 0.1011 -0.1101 -0.0839 516 GLU A O +1467 C CB . GLU A 198 ? 0.7355 1.1506 1.2914 0.0635 -0.0954 -0.0807 516 GLU A CB +1468 C CG . GLU A 198 ? 0.8091 1.2496 1.3859 0.0440 -0.0993 -0.0889 516 GLU A CG +1469 C CD . GLU A 198 ? 0.8383 1.2784 1.4219 0.0210 -0.0718 -0.0937 516 GLU A CD +1470 O OE1 . GLU A 198 ? 0.8948 1.3606 1.5108 0.0107 -0.0607 -0.1007 516 GLU A OE1 +1471 O OE2 . GLU A 198 ? 0.8367 1.2495 1.3922 0.0131 -0.0612 -0.0895 516 GLU A OE2 +1472 N N . LEU A 199 ? 0.8156 1.2766 1.4039 0.0929 -0.1517 -0.0803 517 LEU A N +1473 C CA . LEU A 199 ? 0.8876 1.3882 1.5176 0.0956 -0.1600 -0.0871 517 LEU A CA +1474 C C . LEU A 199 ? 0.9391 1.4555 1.5716 0.0770 -0.1747 -0.0933 517 LEU A C +1475 O O . LEU A 199 ? 0.9814 1.4812 1.5801 0.0771 -0.1963 -0.0886 517 LEU A O +1476 C CB . LEU A 199 ? 0.8264 1.3292 1.4581 0.1219 -0.1797 -0.0801 517 LEU A CB +1477 C CG . LEU A 199 ? 0.7845 1.2728 1.3837 0.1327 -0.2112 -0.0710 517 LEU A CG +1478 C CD1 . LEU A 199 ? 0.7282 1.2243 1.3413 0.1584 -0.2238 -0.0651 517 LEU A CD1 +1479 C CD2 . LEU A 199 ? 0.7712 1.2131 1.3143 0.1327 -0.2142 -0.0606 517 LEU A CD2 +1480 N N . LEU A 200 ? 0.9394 1.4853 1.6096 0.0603 -0.1616 -0.1039 518 LEU A N +1481 C CA . LEU A 200 ? 0.9315 1.4940 1.6096 0.0411 -0.1732 -0.1117 518 LEU A CA +1482 C C . LEU A 200 ? 0.9058 1.5114 1.6295 0.0459 -0.1856 -0.1185 518 LEU A C +1483 O O . LEU A 200 ? 0.8828 1.5146 1.6398 0.0285 -0.1774 -0.1285 518 LEU A O +1484 C CB . LEU A 200 ? 0.9225 1.4806 1.6053 0.0150 -0.1481 -0.1181 518 LEU A CB +1485 C CG . LEU A 200 ? 0.9067 1.4291 1.5580 0.0105 -0.1267 -0.1122 518 LEU A CG +1486 C CD1 . LEU A 200 ? 0.9013 1.4247 1.5663 -0.0126 -0.0978 -0.1176 518 LEU A CD1 +1487 C CD2 . LEU A 200 ? 0.8937 1.3832 1.4966 0.0092 -0.1425 -0.1065 518 LEU A CD2 +1488 N N . ALA A 202 ? 0.9525 1.6490 1.8018 0.0334 -0.1532 -0.1397 520 ALA A N +1489 C CA . ALA A 202 ? 0.9492 1.6556 1.8257 0.0292 -0.1202 -0.1431 520 ALA A CA +1490 C C . ALA A 202 ? 1.0012 1.7128 1.8897 0.0559 -0.1159 -0.1388 520 ALA A C +1491 O O . ALA A 202 ? 1.0807 1.7708 1.9409 0.0758 -0.1314 -0.1302 520 ALA A O +1492 C CB . ALA A 202 ? 0.8475 1.5184 1.6911 0.0130 -0.0946 -0.1400 520 ALA A CB +1493 N N . PRO A 203 ? 0.9280 1.6667 1.8574 0.0564 -0.0943 -0.1448 521 PRO A N +1494 C CA . PRO A 203 ? 0.8563 1.5986 1.7973 0.0815 -0.0871 -0.1420 521 PRO A CA +1495 C C . PRO A 203 ? 0.7930 1.4906 1.6884 0.0904 -0.0742 -0.1334 521 PRO A C +1496 O O . PRO A 203 ? 0.8057 1.4769 1.6723 0.0740 -0.0572 -0.1317 521 PRO A O +1497 C CB . PRO A 203 ? 0.8388 1.6134 1.8255 0.0731 -0.0595 -0.1511 521 PRO A CB +1498 C CG . PRO A 203 ? 0.8466 1.6480 1.8598 0.0496 -0.0653 -0.1591 521 PRO A CG +1499 C CD . PRO A 203 ? 0.8813 1.6505 1.8504 0.0347 -0.0775 -0.1549 521 PRO A CD +1500 N N . ALA A 204 ? 0.6817 1.3701 1.5706 0.1170 -0.0829 -0.1277 522 ALA A N +1501 C CA . ALA A 204 ? 0.6210 1.2673 1.4687 0.1274 -0.0722 -0.1201 522 ALA A CA +1502 C C . ALA A 204 ? 0.6967 1.3410 1.5516 0.1231 -0.0359 -0.1246 522 ALA A C +1503 O O . ALA A 204 ? 0.7403 1.4150 1.6346 0.1275 -0.0228 -0.1315 522 ALA A O +1504 C CB . ALA A 204 ? 0.5512 1.1857 1.3898 0.1568 -0.0916 -0.1126 522 ALA A CB +1505 N N . THR A 205 ? 0.7126 1.3211 1.5282 0.1145 -0.0196 -0.1207 523 THR A N +1506 C CA . THR A 205 ? 0.7243 1.3257 1.5370 0.1080 0.0152 -0.1240 523 THR A CA +1507 C C . THR A 205 ? 0.6408 1.2117 1.4265 0.1272 0.0248 -0.1203 523 THR A C +1508 O O . THR A 205 ? 0.6376 1.2108 1.4297 0.1298 0.0505 -0.1249 523 THR A O +1509 C CB . THR A 205 ? 0.7748 1.3584 1.5627 0.0815 0.0307 -0.1229 523 THR A CB +1510 O OG1 . THR A 205 ? 0.7644 1.3094 1.5070 0.0829 0.0210 -0.1149 523 THR A OG1 +1511 C CG2 . THR A 205 ? 0.7833 1.3919 1.5944 0.0611 0.0212 -0.1270 523 THR A CG2 +1512 N N . VAL A 206 ? 0.5558 1.0968 1.3098 0.1401 0.0053 -0.1124 524 VAL A N +1513 C CA . VAL A 206 ? 0.5760 1.0823 1.3000 0.1565 0.0134 -0.1088 524 VAL A CA +1514 C C . VAL A 206 ? 0.6430 1.1446 1.3700 0.1823 -0.0111 -0.1038 524 VAL A C +1515 O O . VAL A 206 ? 0.6484 1.1426 1.3629 0.1852 -0.0383 -0.0966 524 VAL A O +1516 C CB . VAL A 206 ? 0.4904 0.9573 1.1675 0.1460 0.0164 -0.1028 524 VAL A CB +1517 C CG1 . VAL A 206 ? 0.4917 0.9542 1.1565 0.1390 -0.0109 -0.0966 524 VAL A CG1 +1518 C CG2 . VAL A 206 ? 0.4827 0.9116 1.1280 0.1636 0.0203 -0.0991 524 VAL A CG2 +1519 N N . CYS A 207 ? 0.7186 1.2233 1.4603 0.2011 -0.0010 -0.1072 525 CYS A N +1520 C CA . CYS A 207 ? 0.7891 1.2908 1.5379 0.2268 -0.0214 -0.1024 525 CYS A CA +1521 C C . CYS A 207 ? 0.7970 1.2630 1.5216 0.2444 -0.0088 -0.1013 525 CYS A C +1522 O O . CYS A 207 ? 0.8324 1.2864 1.5446 0.2381 0.0178 -0.1073 525 CYS A O +1523 C CB . CYS A 207 ? 0.8870 1.4361 1.6895 0.2350 -0.0251 -0.1087 525 CYS A CB +1524 S SG . CYS A 207 ? 0.9520 1.5408 1.7830 0.2207 -0.0505 -0.1089 525 CYS A SG +1525 N N . GLY A 208 ? 0.7973 1.2439 1.5125 0.2663 -0.0284 -0.0934 526 GLY A N +1526 C CA . GLY A 208 ? 0.7936 1.2073 1.4906 0.2850 -0.0183 -0.0929 526 GLY A CA +1527 C C . GLY A 208 ? 0.7135 1.1542 1.4486 0.2979 -0.0006 -0.1031 526 GLY A C +1528 O O . GLY A 208 ? 0.6443 1.1312 1.4220 0.2920 0.0035 -0.1101 526 GLY A O +1529 N N . PRO A 209 ? 0.7845 1.1959 1.5045 0.3153 0.0105 -0.1046 527 PRO A N +1530 C CA . PRO A 209 ? 0.8587 1.2920 1.6107 0.3281 0.0305 -0.1155 527 PRO A CA +1531 C C . PRO A 209 ? 0.9444 1.4176 1.7454 0.3443 0.0151 -0.1150 527 PRO A C +1532 O O . PRO A 209 ? 0.9708 1.4475 1.7758 0.3501 -0.0133 -0.1050 527 PRO A O +1533 C CB . PRO A 209 ? 0.8605 1.2453 1.5788 0.3451 0.0390 -0.1152 527 PRO A CB +1534 C CG . PRO A 209 ? 0.8719 1.2139 1.5495 0.3456 0.0170 -0.1015 527 PRO A CG +1535 C CD . PRO A 209 ? 0.7875 1.1426 1.4582 0.3215 0.0081 -0.0977 527 PRO A CD +1536 N N . LYS A 210 ? 0.9360 1.4401 1.7740 0.3513 0.0347 -0.1263 528 LYS A N +1537 C CA . LYS A 210 ? 0.8887 1.4334 1.7785 0.3692 0.0249 -0.1284 528 LYS A CA +1538 C C . LYS A 210 ? 0.8328 1.4164 1.7521 0.3596 0.0003 -0.1241 528 LYS A C +1539 O O . LYS A 210 ? 0.7823 1.4150 1.7526 0.3613 0.0008 -0.1308 528 LYS A O +1540 C CB . LYS A 210 ? 0.8805 1.3960 1.7622 0.3995 0.0119 -0.1212 528 LYS A CB +1541 C CG . LYS A 210 ? 0.8663 1.3411 1.7188 0.4106 0.0352 -0.1267 528 LYS A CG +1542 C CD . LYS A 210 ? 0.8910 1.3372 1.7394 0.4409 0.0231 -0.1197 528 LYS A CD +1543 C CE . LYS A 210 ? 0.8537 1.3119 1.7297 0.4608 0.0450 -0.1318 528 LYS A CE +1544 N NZ . LYS A 210 ? 0.8516 1.2762 1.6925 0.4558 0.0739 -0.1421 528 LYS A NZ +1545 N N . ASP B 2 ? 0.6265 0.4065 0.8109 0.0028 0.0123 0.0737 0 ASP H N +1546 C CA . ASP B 2 ? 0.6287 0.4134 0.8021 0.0050 0.0135 0.0570 0 ASP H CA +1547 C C . ASP B 2 ? 0.6158 0.4138 0.7659 0.0066 0.0057 0.0669 0 ASP H C +1548 O O . ASP B 2 ? 0.5841 0.3894 0.7138 0.0035 0.0006 0.0792 0 ASP H O +1549 C CB . ASP B 2 ? 0.7262 0.5108 0.8798 0.0001 0.0178 0.0356 0 ASP H CB +1550 C CG . ASP B 2 ? 0.8876 0.6607 1.0647 -0.0023 0.0262 0.0219 0 ASP H CG +1551 O OD1 . ASP B 2 ? 0.9766 0.7411 1.1766 -0.0025 0.0279 0.0320 0 ASP H OD1 +1552 O OD2 . ASP B 2 ? 0.9784 0.7522 1.1511 -0.0047 0.0311 0.0010 0 ASP H OD2 +1553 N N . GLU B 3 ? 0.5011 0.3028 0.6547 0.0108 0.0056 0.0603 1 GLU H N +1554 C CA . GLU B 3 ? 0.5440 0.3585 0.6761 0.0120 -0.0011 0.0670 1 GLU H CA +1555 C C . GLU B 3 ? 0.5530 0.3743 0.6487 0.0073 -0.0024 0.0586 1 GLU H C +1556 O O . GLU B 3 ? 0.5395 0.3573 0.6270 0.0048 0.0023 0.0421 1 GLU H O +1557 C CB . GLU B 3 ? 0.7249 0.5412 0.8683 0.0169 0.0005 0.0581 1 GLU H CB +1558 C CG . GLU B 3 ? 0.9701 0.7951 1.1207 0.0209 -0.0062 0.0751 1 GLU H CG +1559 C CD . GLU B 3 ? 1.1941 1.0158 1.3739 0.0230 -0.0087 0.0959 1 GLU H CD +1560 O OE1 . GLU B 3 ? 1.2665 1.0957 1.4351 0.0201 -0.0153 0.1144 1 GLU H OE1 +1561 O OE2 . GLU B 3 ? 1.2771 1.0892 1.4920 0.0270 -0.0038 0.0938 1 GLU H OE2 +1562 N N . VAL B 4 ? 0.4315 0.2637 0.5066 0.0058 -0.0086 0.0699 2 VAL H N +1563 C CA . VAL B 4 ? 0.4104 0.2495 0.4545 0.0018 -0.0094 0.0622 2 VAL H CA +1564 C C . VAL B 4 ? 0.4412 0.2851 0.4765 0.0042 -0.0093 0.0502 2 VAL H C +1565 O O . VAL B 4 ? 0.4820 0.3322 0.5206 0.0072 -0.0128 0.0564 2 VAL H O +1566 C CB . VAL B 4 ? 0.4094 0.2588 0.4359 -0.0020 -0.0148 0.0770 2 VAL H CB +1567 C CG1 . VAL B 4 ? 0.4916 0.3478 0.4897 -0.0057 -0.0145 0.0674 2 VAL H CG1 +1568 C CG2 . VAL B 4 ? 0.4293 0.2749 0.4642 -0.0051 -0.0146 0.0894 2 VAL H CG2 +1569 N N . GLN B 5 ? 0.3970 0.2391 0.4216 0.0025 -0.0054 0.0341 3 GLN H N +1570 C CA . GLN B 5 ? 0.4587 0.3063 0.4744 0.0041 -0.0053 0.0238 3 GLN H CA +1571 C C . GLN B 5 ? 0.3872 0.2359 0.3868 0.0005 -0.0026 0.0103 3 GLN H C +1572 O O . GLN B 5 ? 0.4378 0.2813 0.4392 -0.0024 0.0004 0.0053 3 GLN H O +1573 C CB . GLN B 5 ? 0.5549 0.3991 0.5925 0.0083 -0.0023 0.0177 3 GLN H CB +1574 C CG . GLN B 5 ? 0.6366 0.4714 0.6907 0.0072 0.0042 0.0063 3 GLN H CG +1575 C CD . GLN B 5 ? 0.7777 0.6105 0.8528 0.0106 0.0087 -0.0031 3 GLN H CD +1576 O OE1 . GLN B 5 ? 0.7795 0.6179 0.8562 0.0141 0.0066 -0.0007 3 GLN H OE1 +1577 N NE2 . GLN B 5 ? 0.8486 0.6739 0.9409 0.0090 0.0155 -0.0148 3 GLN H NE2 +1578 N N . LEU B 6 ? 0.3758 0.2319 0.3608 0.0006 -0.0040 0.0055 4 LEU H N +1579 C CA . LEU B 6 ? 0.3634 0.2226 0.3357 -0.0022 -0.0021 -0.0060 4 LEU H CA +1580 C C . LEU B 6 ? 0.4269 0.2897 0.4023 -0.0004 -0.0006 -0.0149 4 LEU H C +1581 O O . LEU B 6 ? 0.4078 0.2750 0.3823 0.0024 -0.0030 -0.0111 4 LEU H O +1582 C CB . LEU B 6 ? 0.3914 0.2570 0.3446 -0.0044 -0.0048 -0.0025 4 LEU H CB +1583 C CG . LEU B 6 ? 0.3883 0.2518 0.3366 -0.0075 -0.0051 0.0039 4 LEU H CG +1584 C CD1 . LEU B 6 ? 0.3429 0.2134 0.2755 -0.0094 -0.0069 0.0070 4 LEU H CD1 +1585 C CD2 . LEU B 6 ? 0.4191 0.2792 0.3686 -0.0105 -0.0021 -0.0040 4 LEU H CD2 +1586 N N . VAL B 7 ? 0.4043 0.2666 0.3832 -0.0028 0.0034 -0.0270 5 VAL H N +1587 C CA . VAL B 7 ? 0.3833 0.2502 0.3658 -0.0022 0.0060 -0.0368 5 VAL H CA +1588 C C . VAL B 7 ? 0.4507 0.3256 0.4173 -0.0068 0.0062 -0.0445 5 VAL H C +1589 O O . VAL B 7 ? 0.4048 0.2802 0.3700 -0.0113 0.0083 -0.0512 5 VAL H O +1590 C CB . VAL B 7 ? 0.4365 0.2978 0.4400 -0.0020 0.0116 -0.0455 5 VAL H CB +1591 C CG1 . VAL B 7 ? 0.5041 0.3720 0.5103 -0.0024 0.0151 -0.0571 5 VAL H CG1 +1592 C CG2 . VAL B 7 ? 0.5247 0.3782 0.5476 0.0030 0.0109 -0.0352 5 VAL H CG2 +1593 N N . GLU B 8 ? 0.4095 0.2917 0.3657 -0.0060 0.0038 -0.0430 6 GLU H N +1594 C CA . GLU B 8 ? 0.4448 0.3356 0.3875 -0.0101 0.0032 -0.0470 6 GLU H CA +1595 C C . GLU B 8 ? 0.4548 0.3529 0.3991 -0.0126 0.0065 -0.0577 6 GLU H C +1596 O O . GLU B 8 ? 0.4299 0.3271 0.3843 -0.0100 0.0091 -0.0615 6 GLU H O +1597 C CB . GLU B 8 ? 0.4353 0.3301 0.3670 -0.0085 -0.0006 -0.0394 6 GLU H CB +1598 C CG . GLU B 8 ? 0.4953 0.3847 0.4259 -0.0065 -0.0030 -0.0301 6 GLU H CG +1599 C CD . GLU B 8 ? 0.5161 0.4099 0.4375 -0.0059 -0.0055 -0.0251 6 GLU H CD +1600 O OE1 . GLU B 8 ? 0.4353 0.3277 0.3564 -0.0040 -0.0073 -0.0185 6 GLU H OE1 +1601 O OE2 . GLU B 8 ? 0.4939 0.3937 0.4091 -0.0079 -0.0057 -0.0275 6 GLU H OE2 +1602 N N . SER B 9 ? 0.4184 0.3252 0.3531 -0.0182 0.0065 -0.0621 7 SER H N +1603 C CA . SER B 9 ? 0.4335 0.3510 0.3660 -0.0225 0.0093 -0.0715 7 SER H CA +1604 C C . SER B 9 ? 0.4449 0.3738 0.3637 -0.0277 0.0062 -0.0689 7 SER H C +1605 O O . SER B 9 ? 0.4087 0.3363 0.3228 -0.0280 0.0027 -0.0616 7 SER H O +1606 C CB . SER B 9 ? 0.5230 0.4399 0.4657 -0.0264 0.0151 -0.0845 7 SER H CB +1607 O OG . SER B 9 ? 0.5133 0.4293 0.4540 -0.0306 0.0146 -0.0854 7 SER H OG +1608 N N . GLY B 10 ? 0.4165 0.3577 0.3303 -0.0322 0.0076 -0.0743 8 GLY H N +1609 C CA . GLY B 10 ? 0.4158 0.3706 0.3185 -0.0383 0.0045 -0.0711 8 GLY H CA +1610 C C . GLY B 10 ? 0.4373 0.3982 0.3342 -0.0368 0.0016 -0.0628 8 GLY H C +1611 O O . GLY B 10 ? 0.4724 0.4463 0.3621 -0.0421 -0.0009 -0.0590 8 GLY H O +1612 N N . GLY B 11 ? 0.4004 0.3533 0.3010 -0.0301 0.0015 -0.0591 9 GLY H N +1613 C CA . GLY B 11 ? 0.4248 0.3831 0.3214 -0.0290 -0.0007 -0.0523 9 GLY H CA +1614 C C . GLY B 11 ? 0.4738 0.4455 0.3669 -0.0339 0.0017 -0.0579 9 GLY H C +1615 O O . GLY B 11 ? 0.5101 0.4845 0.4060 -0.0364 0.0062 -0.0689 9 GLY H O +1616 N N . GLY B 12 ? 0.4588 0.4392 0.3470 -0.0358 -0.0008 -0.0505 10 GLY H N +1617 C CA . GLY B 12 ? 0.4657 0.4606 0.3495 -0.0412 0.0012 -0.0540 10 GLY H CA +1618 C C . GLY B 12 ? 0.4877 0.4904 0.3684 -0.0426 -0.0025 -0.0422 10 GLY H C +1619 O O . GLY B 12 ? 0.4469 0.4418 0.3310 -0.0381 -0.0056 -0.0332 10 GLY H O +1620 N N . LEU B 13 ? 0.4213 0.4402 0.2963 -0.0494 -0.0017 -0.0426 11 LEU H N +1621 C CA . LEU B 13 ? 0.4055 0.4339 0.2792 -0.0517 -0.0049 -0.0305 11 LEU H CA +1622 C C . LEU B 13 ? 0.4115 0.4529 0.2811 -0.0587 -0.0092 -0.0219 11 LEU H C +1623 O O . LEU B 13 ? 0.4014 0.4545 0.2643 -0.0661 -0.0084 -0.0282 11 LEU H O +1624 C CB . LEU B 13 ? 0.4495 0.4896 0.3197 -0.0556 -0.0015 -0.0346 11 LEU H CB +1625 C CG . LEU B 13 ? 0.7285 0.7818 0.5972 -0.0599 -0.0041 -0.0224 11 LEU H CG +1626 C CD1 . LEU B 13 ? 0.8172 0.8585 0.6951 -0.0529 -0.0072 -0.0111 11 LEU H CD1 +1627 C CD2 . LEU B 13 ? 0.7252 0.7879 0.5909 -0.0631 0.0005 -0.0292 11 LEU H CD2 +1628 N N . VAL B 14 ? 0.3673 0.4078 0.2427 -0.0569 -0.0136 -0.0077 12 VAL H N +1629 C CA . VAL B 14 ? 0.4158 0.4688 0.2912 -0.0627 -0.0187 0.0035 12 VAL H CA +1630 C C . VAL B 14 ? 0.3991 0.4595 0.2813 -0.0635 -0.0218 0.0191 12 VAL H C +1631 O O . VAL B 14 ? 0.3369 0.3863 0.2267 -0.0574 -0.0204 0.0216 12 VAL H O +1632 C CB . VAL B 14 ? 0.4612 0.5026 0.3430 -0.0585 -0.0209 0.0060 12 VAL H CB +1633 C CG1 . VAL B 14 ? 0.5493 0.6063 0.4293 -0.0660 -0.0255 0.0132 12 VAL H CG1 +1634 C CG2 . VAL B 14 ? 0.6159 0.6424 0.4959 -0.0540 -0.0171 -0.0078 12 VAL H CG2 +1635 N N . GLN B 15 ? 0.3509 0.4307 0.2313 -0.0716 -0.0261 0.0303 13 GLN H N +1636 C CA . GLN B 15 ? 0.3384 0.4249 0.2293 -0.0722 -0.0297 0.0480 13 GLN H CA +1637 C C . GLN B 15 ? 0.3185 0.3948 0.2257 -0.0667 -0.0327 0.0585 13 GLN H C +1638 O O . GLN B 15 ? 0.3392 0.4106 0.2463 -0.0656 -0.0338 0.0549 13 GLN H O +1639 C CB . GLN B 15 ? 0.3822 0.4960 0.2664 -0.0837 -0.0338 0.0584 13 GLN H CB +1640 C CG . GLN B 15 ? 0.4876 0.6149 0.3570 -0.0908 -0.0300 0.0491 13 GLN H CG +1641 C CD . GLN B 15 ? 0.6359 0.7931 0.4959 -0.1041 -0.0343 0.0584 13 GLN H CD +1642 O OE1 . GLN B 15 ? 0.7337 0.9046 0.5988 -0.1082 -0.0380 0.0756 13 GLN H OE1 +1643 N NE2 . GLN B 15 ? 0.6725 0.8410 0.5197 -0.1116 -0.0338 0.0475 13 GLN H NE2 +1644 N N . PRO B 16 ? 0.3862 0.4590 0.3090 -0.0634 -0.0336 0.0709 14 PRO H N +1645 C CA . PRO B 16 ? 0.3506 0.4154 0.2923 -0.0589 -0.0357 0.0809 14 PRO H CA +1646 C C . PRO B 16 ? 0.3332 0.4142 0.2771 -0.0649 -0.0418 0.0921 14 PRO H C +1647 O O . PRO B 16 ? 0.3700 0.4725 0.3097 -0.0732 -0.0461 0.1028 14 PRO H O +1648 C CB . PRO B 16 ? 0.4113 0.4749 0.3703 -0.0569 -0.0352 0.0931 14 PRO H CB +1649 C CG . PRO B 16 ? 0.4434 0.5054 0.3915 -0.0570 -0.0313 0.0841 14 PRO H CG +1650 C CD . PRO B 16 ? 0.4167 0.4914 0.3427 -0.0634 -0.0316 0.0749 14 PRO H CD +1651 N N . GLY B 17 ? 0.3764 0.4484 0.3272 -0.0612 -0.0423 0.0903 15 GLY H N +1652 C CA . GLY B 17 ? 0.3979 0.4845 0.3505 -0.0667 -0.0480 0.0990 15 GLY H CA +1653 C C . GLY B 17 ? 0.3747 0.4661 0.3075 -0.0714 -0.0479 0.0852 15 GLY H C +1654 O O . GLY B 17 ? 0.3725 0.4741 0.3062 -0.0756 -0.0522 0.0896 15 GLY H O +1655 N N . GLY B 18 ? 0.3772 0.4615 0.2942 -0.0707 -0.0429 0.0686 16 GLY H N +1656 C CA . GLY B 18 ? 0.3817 0.4699 0.2825 -0.0754 -0.0415 0.0541 16 GLY H CA +1657 C C . GLY B 18 ? 0.3945 0.4638 0.2977 -0.0691 -0.0387 0.0438 16 GLY H C +1658 O O . GLY B 18 ? 0.3719 0.4262 0.2879 -0.0616 -0.0379 0.0474 16 GLY H O +1659 N N . SER B 19 ? 0.3710 0.4415 0.2622 -0.0727 -0.0367 0.0300 17 SER H N +1660 C CA A SER B 19 ? 0.3456 0.4005 0.2384 -0.0683 -0.0343 0.0207 17 SER H CA +1661 C CA B SER B 19 ? 0.3457 0.4011 0.2382 -0.0686 -0.0344 0.0206 17 SER H CA +1662 C C . SER B 19 ? 0.3947 0.4396 0.2781 -0.0669 -0.0284 0.0033 17 SER H C +1663 O O . SER B 19 ? 0.4129 0.4670 0.2875 -0.0716 -0.0263 -0.0036 17 SER H O +1664 C CB A SER B 19 ? 0.3974 0.4643 0.2902 -0.0747 -0.0384 0.0233 17 SER H CB +1665 C CB B SER B 19 ? 0.3925 0.4608 0.2839 -0.0756 -0.0384 0.0224 17 SER H CB +1666 O OG A SER B 19 ? 0.4098 0.4940 0.2895 -0.0848 -0.0385 0.0152 17 SER H OG +1667 O OG B SER B 19 ? 0.4269 0.5061 0.3296 -0.0771 -0.0444 0.0398 17 SER H OG +1668 N N . LEU B 20 ? 0.3549 0.3814 0.2421 -0.0604 -0.0256 -0.0033 18 LEU H N +1669 C CA . LEU B 20 ? 0.3964 0.4114 0.2793 -0.0578 -0.0203 -0.0178 18 LEU H CA +1670 C C . LEU B 20 ? 0.4488 0.4498 0.3364 -0.0541 -0.0193 -0.0213 18 LEU H C +1671 O O . LEU B 20 ? 0.4570 0.4516 0.3515 -0.0503 -0.0212 -0.0132 18 LEU H O +1672 C CB . LEU B 20 ? 0.4487 0.4533 0.3332 -0.0511 -0.0176 -0.0186 18 LEU H CB +1673 C CG . LEU B 20 ? 0.4791 0.4781 0.3604 -0.0496 -0.0126 -0.0312 18 LEU H CG +1674 C CD1 . LEU B 20 ? 0.5083 0.5245 0.3822 -0.0580 -0.0111 -0.0377 18 LEU H CD1 +1675 C CD2 . LEU B 20 ? 0.5106 0.4997 0.3954 -0.0425 -0.0112 -0.0290 18 LEU H CD2 +1676 N N . ARG B 21 ? 0.3741 0.3707 0.2594 -0.0556 -0.0157 -0.0336 19 ARG H N +1677 C CA . ARG B 21 ? 0.3387 0.3211 0.2291 -0.0521 -0.0141 -0.0368 19 ARG H CA +1678 C C . ARG B 21 ? 0.3522 0.3195 0.2452 -0.0461 -0.0096 -0.0443 19 ARG H C +1679 O O . ARG B 21 ? 0.3672 0.3367 0.2590 -0.0481 -0.0061 -0.0540 19 ARG H O +1680 C CB . ARG B 21 ? 0.3948 0.3845 0.2842 -0.0593 -0.0141 -0.0434 19 ARG H CB +1681 C CG . ARG B 21 ? 0.3675 0.3428 0.2632 -0.0558 -0.0128 -0.0447 19 ARG H CG +1682 C CD . ARG B 21 ? 0.5505 0.5330 0.4466 -0.0633 -0.0129 -0.0507 19 ARG H CD +1683 N NE . ARG B 21 ? 0.7214 0.7010 0.6182 -0.0663 -0.0076 -0.0654 19 ARG H NE +1684 C CZ . ARG B 21 ? 0.7836 0.7596 0.6851 -0.0697 -0.0051 -0.0733 19 ARG H CZ +1685 N NH1 . ARG B 21 ? 0.8149 0.7879 0.7203 -0.0723 0.0007 -0.0873 19 ARG H NH1 +1686 N NH2 . ARG B 21 ? 0.7048 0.6799 0.6093 -0.0705 -0.0080 -0.0676 19 ARG H NH2 +1687 N N . LEU B 22 ? 0.3252 0.2786 0.2226 -0.0394 -0.0095 -0.0396 20 LEU H N +1688 C CA . LEU B 22 ? 0.3276 0.2677 0.2288 -0.0339 -0.0063 -0.0439 20 LEU H CA +1689 C C . LEU B 22 ? 0.3910 0.3223 0.2972 -0.0341 -0.0046 -0.0475 20 LEU H C +1690 O O . LEU B 22 ? 0.3841 0.3161 0.2908 -0.0362 -0.0062 -0.0441 20 LEU H O +1691 C CB . LEU B 22 ? 0.3527 0.2851 0.2548 -0.0277 -0.0073 -0.0364 20 LEU H CB +1692 C CG . LEU B 22 ? 0.4133 0.3533 0.3126 -0.0275 -0.0091 -0.0314 20 LEU H CG +1693 C CD1 . LEU B 22 ? 0.3842 0.3163 0.2853 -0.0222 -0.0092 -0.0263 20 LEU H CD1 +1694 C CD2 . LEU B 22 ? 0.4169 0.3639 0.3137 -0.0293 -0.0074 -0.0374 20 LEU H CD2 +1695 N N . SER B 23 ? 0.3917 0.3148 0.3038 -0.0318 -0.0011 -0.0538 21 SER H N +1696 C CA . SER B 23 ? 0.3735 0.2871 0.2932 -0.0317 0.0012 -0.0569 21 SER H CA +1697 C C . SER B 23 ? 0.3984 0.2996 0.3244 -0.0250 0.0019 -0.0523 21 SER H C +1698 O O . SER B 23 ? 0.4381 0.3391 0.3646 -0.0214 0.0019 -0.0512 21 SER H O +1699 C CB . SER B 23 ? 0.4436 0.3600 0.3690 -0.0365 0.0055 -0.0698 21 SER H CB +1700 O OG . SER B 23 ? 0.5233 0.4538 0.4418 -0.0443 0.0046 -0.0742 21 SER H OG +1701 N N . CYS B 24 ? 0.3885 0.2808 0.3198 -0.0240 0.0023 -0.0491 22 CYS H N +1702 C CA . CYS B 24 ? 0.3981 0.2808 0.3353 -0.0188 0.0023 -0.0425 22 CYS H CA +1703 C C . CYS B 24 ? 0.4622 0.3362 0.4107 -0.0196 0.0048 -0.0438 22 CYS H C +1704 O O . CYS B 24 ? 0.4536 0.3253 0.4005 -0.0216 0.0042 -0.0403 22 CYS H O +1705 C CB . CYS B 24 ? 0.5585 0.4413 0.4874 -0.0169 -0.0008 -0.0328 22 CYS H CB +1706 S SG . CYS B 24 ? 0.6791 0.5539 0.6121 -0.0129 -0.0017 -0.0230 22 CYS H SG +1707 N N . ALA B 25 ? 0.4065 0.2758 0.3684 -0.0183 0.0082 -0.0492 23 ALA H N +1708 C CA . ALA B 25 ? 0.4115 0.2718 0.3883 -0.0191 0.0115 -0.0511 23 ALA H CA +1709 C C . ALA B 25 ? 0.4408 0.2928 0.4247 -0.0143 0.0097 -0.0383 23 ALA H C +1710 O O . ALA B 25 ? 0.4492 0.3008 0.4375 -0.0098 0.0084 -0.0333 23 ALA H O +1711 C CB . ALA B 25 ? 0.4232 0.2825 0.4146 -0.0203 0.0169 -0.0637 23 ALA H CB +1712 N N . ALA B 26 ? 0.4068 0.2537 0.3923 -0.0159 0.0094 -0.0324 24 ALA H N +1713 C CA . ALA B 26 ? 0.4011 0.2429 0.3908 -0.0130 0.0072 -0.0186 24 ALA H CA +1714 C C . ALA B 26 ? 0.4019 0.2337 0.4138 -0.0121 0.0103 -0.0166 24 ALA H C +1715 O O . ALA B 26 ? 0.3758 0.2035 0.3975 -0.0153 0.0144 -0.0257 24 ALA H O +1716 C CB . ALA B 26 ? 0.3745 0.2182 0.3511 -0.0157 0.0051 -0.0118 24 ALA H CB +1717 N N . SER B 27 ? 0.3665 0.1955 0.3876 -0.0083 0.0081 -0.0040 25 SER H N +1718 C CA . SER B 27 ? 0.3496 0.1693 0.3935 -0.0071 0.0101 0.0029 25 SER H CA +1719 C C . SER B 27 ? 0.3967 0.2179 0.4367 -0.0066 0.0054 0.0217 25 SER H C +1720 O O . SER B 27 ? 0.4259 0.2552 0.4519 -0.0053 0.0009 0.0287 25 SER H O +1721 C CB . SER B 27 ? 0.5103 0.3258 0.5778 -0.0027 0.0126 0.0003 25 SER H CB +1722 O OG . SER B 27 ? 0.5761 0.3924 0.6461 -0.0042 0.0176 -0.0181 25 SER H OG +1723 N N . GLY B 28 ? 0.3837 0.1982 0.4363 -0.0082 0.0066 0.0296 26 GLY H N +1724 C CA . GLY B 28 ? 0.4144 0.2317 0.4651 -0.0088 0.0024 0.0485 26 GLY H CA +1725 C C . GLY B 28 ? 0.4130 0.2361 0.4410 -0.0138 0.0010 0.0516 26 GLY H C +1726 O O . GLY B 28 ? 0.4383 0.2660 0.4622 -0.0158 -0.0020 0.0666 26 GLY H O +1727 N N . PHE B 29 ? 0.3453 0.1698 0.3595 -0.0164 0.0032 0.0381 27 PHE H N +1728 C CA . PHE B 29 ? 0.3890 0.2175 0.3872 -0.0212 0.0036 0.0387 27 PHE H CA +1729 C C . PHE B 29 ? 0.4243 0.2512 0.4194 -0.0232 0.0067 0.0230 27 PHE H C +1730 O O . PHE B 29 ? 0.4291 0.2542 0.4305 -0.0214 0.0082 0.0122 27 PHE H O +1731 C CB . PHE B 29 ? 0.4026 0.2420 0.3797 -0.0222 0.0003 0.0434 27 PHE H CB +1732 C CG . PHE B 29 ? 0.3987 0.2432 0.3660 -0.0196 -0.0008 0.0340 27 PHE H CG +1733 C CD1 . PHE B 29 ? 0.5301 0.3766 0.5014 -0.0156 -0.0034 0.0366 27 PHE H CD1 +1734 C CD2 . PHE B 29 ? 0.4074 0.2552 0.3630 -0.0214 0.0006 0.0236 27 PHE H CD2 +1735 C CE1 . PHE B 29 ? 0.5450 0.3963 0.5077 -0.0136 -0.0041 0.0283 27 PHE H CE1 +1736 C CE2 . PHE B 29 ? 0.4769 0.3296 0.4247 -0.0193 -0.0005 0.0163 27 PHE H CE2 +1737 C CZ . PHE B 29 ? 0.4508 0.3050 0.4016 -0.0156 -0.0027 0.0184 27 PHE H CZ +1738 N N . ILE B 30 ? 0.3788 0.2083 0.3641 -0.0273 0.0077 0.0219 28 ILE H N +1739 C CA . ILE B 30 ? 0.3567 0.1861 0.3413 -0.0302 0.0101 0.0094 28 ILE H CA +1740 C C . ILE B 30 ? 0.3672 0.2059 0.3344 -0.0308 0.0085 0.0051 28 ILE H C +1741 O O . ILE B 30 ? 0.3638 0.2070 0.3215 -0.0326 0.0082 0.0103 28 ILE H O +1742 C CB . ILE B 30 ? 0.3662 0.1912 0.3578 -0.0346 0.0128 0.0113 28 ILE H CB +1743 C CG1 . ILE B 30 ? 0.4747 0.2896 0.4870 -0.0339 0.0148 0.0163 28 ILE H CG1 +1744 C CG2 . ILE B 30 ? 0.4186 0.2462 0.4088 -0.0382 0.0144 -0.0011 28 ILE H CG2 +1745 C CD1 . ILE B 30 ? 0.5905 0.4001 0.6177 -0.0325 0.0173 0.0047 28 ILE H CD1 +1746 N N . VAL B 31 ? 0.3813 0.2235 0.3461 -0.0297 0.0079 -0.0045 29 VAL H N +1747 C CA . VAL B 31 ? 0.4019 0.2528 0.3534 -0.0296 0.0061 -0.0075 29 VAL H CA +1748 C C . VAL B 31 ? 0.4153 0.2700 0.3625 -0.0333 0.0069 -0.0073 29 VAL H C +1749 O O . VAL B 31 ? 0.3506 0.2104 0.2893 -0.0333 0.0065 -0.0043 29 VAL H O +1750 C CB . VAL B 31 ? 0.4440 0.2988 0.3956 -0.0294 0.0056 -0.0175 29 VAL H CB +1751 C CG1 . VAL B 31 ? 0.4619 0.3260 0.4033 -0.0305 0.0038 -0.0196 29 VAL H CG1 +1752 C CG2 . VAL B 31 ? 0.4140 0.2673 0.3679 -0.0252 0.0049 -0.0175 29 VAL H CG2 +1753 N N . SER B 32 ? 0.3474 0.1999 0.3020 -0.0368 0.0086 -0.0112 30 SER H N +1754 C CA . SER B 32 ? 0.3816 0.2389 0.3339 -0.0402 0.0092 -0.0115 30 SER H CA +1755 C C . SER B 32 ? 0.4444 0.3001 0.3947 -0.0414 0.0110 -0.0033 30 SER H C +1756 O O . SER B 32 ? 0.3948 0.2552 0.3437 -0.0439 0.0122 -0.0034 30 SER H O +1757 C CB . SER B 32 ? 0.3901 0.2470 0.3509 -0.0445 0.0103 -0.0182 30 SER H CB +1758 O OG . SER B 32 ? 0.4265 0.2742 0.3974 -0.0456 0.0128 -0.0163 30 SER H OG +1759 N N . SER B 33 ? 0.3991 0.2499 0.3500 -0.0401 0.0114 0.0041 31 SER H N +1760 C CA . SER B 33 ? 0.3438 0.1957 0.2908 -0.0424 0.0131 0.0126 31 SER H CA +1761 C C . SER B 33 ? 0.4002 0.2586 0.3354 -0.0414 0.0123 0.0160 31 SER H C +1762 O O . SER B 33 ? 0.3857 0.2474 0.3159 -0.0444 0.0140 0.0224 31 SER H O +1763 C CB . SER B 33 ? 0.3999 0.2446 0.3554 -0.0431 0.0136 0.0209 31 SER H CB +1764 O OG . SER B 33 ? 0.4213 0.2594 0.3896 -0.0447 0.0152 0.0167 31 SER H OG +1765 N N . ASN B 34 ? 0.3702 0.2315 0.3010 -0.0381 0.0102 0.0117 32 ASN H N +1766 C CA . ASN B 34 ? 0.4055 0.2724 0.3267 -0.0371 0.0093 0.0144 32 ASN H CA +1767 C C . ASN B 34 ? 0.3568 0.2295 0.2736 -0.0362 0.0097 0.0077 32 ASN H C +1768 O O . ASN B 34 ? 0.3811 0.2538 0.3021 -0.0351 0.0090 0.0021 32 ASN H O +1769 C CB . ASN B 34 ? 0.3473 0.2117 0.2697 -0.0333 0.0060 0.0177 32 ASN H CB +1770 C CG . ASN B 34 ? 0.3747 0.2356 0.3023 -0.0341 0.0054 0.0278 32 ASN H CG +1771 O OD1 . ASN B 34 ? 0.3817 0.2480 0.3026 -0.0361 0.0045 0.0359 32 ASN H OD1 +1772 N ND2 . ASN B 34 ? 0.3451 0.1977 0.2855 -0.0333 0.0059 0.0277 32 ASN H ND2 +1773 N N . TYR B 35 ? 0.3549 0.2335 0.2639 -0.0374 0.0109 0.0087 33 TYR H N +1774 C CA . TYR B 35 ? 0.3682 0.2515 0.2749 -0.0359 0.0112 0.0032 33 TYR H CA +1775 C C . TYR B 35 ? 0.4372 0.3192 0.3431 -0.0317 0.0073 0.0026 33 TYR H C +1776 O O . TYR B 35 ? 0.4002 0.2829 0.3017 -0.0309 0.0056 0.0066 33 TYR H O +1777 C CB . TYR B 35 ? 0.3193 0.2095 0.2188 -0.0392 0.0143 0.0030 33 TYR H CB +1778 C CG . TYR B 35 ? 0.3264 0.2198 0.2271 -0.0440 0.0197 0.0015 33 TYR H CG +1779 C CD1 . TYR B 35 ? 0.3517 0.2475 0.2598 -0.0442 0.0232 -0.0047 33 TYR H CD1 +1780 C CD2 . TYR B 35 ? 0.3367 0.2320 0.2328 -0.0486 0.0214 0.0068 33 TYR H CD2 +1781 C CE1 . TYR B 35 ? 0.3763 0.2755 0.2878 -0.0486 0.0289 -0.0070 33 TYR H CE1 +1782 C CE2 . TYR B 35 ? 0.3674 0.2668 0.2645 -0.0537 0.0271 0.0047 33 TYR H CE2 +1783 C CZ . TYR B 35 ? 0.3710 0.2721 0.2763 -0.0534 0.0311 -0.0030 33 TYR H CZ +1784 O OH . TYR B 35 ? 0.3823 0.2876 0.2909 -0.0583 0.0376 -0.0060 33 TYR H OH +1785 N N . MET B 36 ? 0.3280 0.2094 0.2382 -0.0294 0.0059 -0.0020 34 MET H N +1786 C CA . MET B 36 ? 0.3295 0.2106 0.2391 -0.0260 0.0029 -0.0034 34 MET H CA +1787 C C . MET B 36 ? 0.3663 0.2526 0.2748 -0.0249 0.0027 -0.0068 34 MET H C +1788 O O . MET B 36 ? 0.3589 0.2479 0.2718 -0.0259 0.0036 -0.0087 34 MET H O +1789 C CB . MET B 36 ? 0.3358 0.2132 0.2513 -0.0252 0.0015 -0.0062 34 MET H CB +1790 C CG . MET B 36 ? 0.3534 0.2243 0.2740 -0.0262 0.0023 -0.0033 34 MET H CG +1791 S SD . MET B 36 ? 0.3911 0.2588 0.3123 -0.0236 0.0008 0.0034 34 MET H SD +1792 C CE . MET B 36 ? 0.3845 0.2533 0.3074 -0.0198 -0.0011 -0.0025 34 MET H CE +1793 N N . SER B 37 ? 0.3665 0.2547 0.2711 -0.0229 0.0014 -0.0068 35 SER H N +1794 C CA . SER B 37 ? 0.3089 0.2017 0.2136 -0.0221 0.0016 -0.0093 35 SER H CA +1795 C C . SER B 37 ? 0.3754 0.2691 0.2796 -0.0193 -0.0012 -0.0106 35 SER H C +1796 O O . SER B 37 ? 0.3735 0.2646 0.2768 -0.0177 -0.0028 -0.0098 35 SER H O +1797 C CB . SER B 37 ? 0.3572 0.2533 0.2576 -0.0236 0.0039 -0.0096 35 SER H CB +1798 O OG . SER B 37 ? 0.4140 0.3117 0.3172 -0.0267 0.0080 -0.0111 35 SER H OG +1799 N N . TRP B 38 ? 0.3122 0.2101 0.2188 -0.0189 -0.0014 -0.0121 36 TRP H N +1800 C CA . TRP B 38 ? 0.3143 0.2148 0.2196 -0.0169 -0.0032 -0.0132 36 TRP H CA +1801 C C . TRP B 38 ? 0.3428 0.2460 0.2474 -0.0168 -0.0018 -0.0135 36 TRP H C +1802 O O . TRP B 38 ? 0.3293 0.2338 0.2380 -0.0184 0.0009 -0.0140 36 TRP H O +1803 C CB . TRP B 38 ? 0.3059 0.2110 0.2148 -0.0175 -0.0047 -0.0137 36 TRP H CB +1804 C CG . TRP B 38 ? 0.3125 0.2171 0.2214 -0.0187 -0.0059 -0.0156 36 TRP H CG +1805 C CD1 . TRP B 38 ? 0.3418 0.2465 0.2537 -0.0211 -0.0058 -0.0155 36 TRP H CD1 +1806 C CD2 . TRP B 38 ? 0.3593 0.2636 0.2666 -0.0181 -0.0066 -0.0192 36 TRP H CD2 +1807 N NE1 . TRP B 38 ? 0.3581 0.2628 0.2697 -0.0226 -0.0064 -0.0193 36 TRP H NE1 +1808 C CE2 . TRP B 38 ? 0.3380 0.2423 0.2474 -0.0207 -0.0065 -0.0220 36 TRP H CE2 +1809 C CE3 . TRP B 38 ? 0.3723 0.2770 0.2781 -0.0158 -0.0068 -0.0209 36 TRP H CE3 +1810 C CZ2 . TRP B 38 ? 0.4032 0.3074 0.3137 -0.0215 -0.0058 -0.0278 36 TRP H CZ2 +1811 C CZ3 . TRP B 38 ? 0.3770 0.2816 0.2846 -0.0160 -0.0063 -0.0258 36 TRP H CZ3 +1812 C CH2 . TRP B 38 ? 0.3820 0.2863 0.2922 -0.0190 -0.0055 -0.0298 36 TRP H CH2 +1813 N N . VAL B 39 ? 0.2866 0.1908 0.1874 -0.0153 -0.0031 -0.0138 37 VAL H N +1814 C CA . VAL B 39 ? 0.2877 0.1952 0.1874 -0.0158 -0.0019 -0.0151 37 VAL H CA +1815 C C . VAL B 39 ? 0.3189 0.2290 0.2189 -0.0137 -0.0039 -0.0157 37 VAL H C +1816 O O . VAL B 39 ? 0.3449 0.2541 0.2435 -0.0118 -0.0060 -0.0153 37 VAL H O +1817 C CB . VAL B 39 ? 0.3184 0.2268 0.2119 -0.0173 -0.0018 -0.0141 37 VAL H CB +1818 C CG1 . VAL B 39 ? 0.3326 0.2463 0.2242 -0.0188 -0.0009 -0.0166 37 VAL H CG1 +1819 C CG2 . VAL B 39 ? 0.3478 0.2551 0.2402 -0.0205 0.0009 -0.0136 37 VAL H CG2 +1820 N N . ARG B 40 ? 0.2921 0.2054 0.1956 -0.0142 -0.0027 -0.0170 38 ARG H N +1821 C CA . ARG B 40 ? 0.2916 0.2081 0.1957 -0.0126 -0.0043 -0.0172 38 ARG H CA +1822 C C . ARG B 40 ? 0.2776 0.1970 0.1814 -0.0131 -0.0034 -0.0191 38 ARG H C +1823 O O . ARG B 40 ? 0.3369 0.2569 0.2411 -0.0154 -0.0009 -0.0212 38 ARG H O +1824 C CB . ARG B 40 ? 0.3127 0.2319 0.2225 -0.0130 -0.0045 -0.0154 38 ARG H CB +1825 C CG . ARG B 40 ? 0.3522 0.2727 0.2708 -0.0143 -0.0020 -0.0145 38 ARG H CG +1826 C CD . ARG B 40 ? 0.3349 0.2596 0.2611 -0.0150 -0.0032 -0.0096 38 ARG H CD +1827 N NE . ARG B 40 ? 0.3442 0.2692 0.2835 -0.0158 -0.0004 -0.0076 38 ARG H NE +1828 C CZ . ARG B 40 ? 0.3988 0.3280 0.3491 -0.0165 -0.0013 -0.0012 38 ARG H CZ +1829 N NH1 . ARG B 40 ? 0.3364 0.2715 0.2831 -0.0174 -0.0053 0.0035 38 ARG H NH1 +1830 N NH2 . ARG B 40 ? 0.3648 0.2933 0.3309 -0.0168 0.0020 0.0005 38 ARG H NH2 +1831 N N . GLN B 41 ? 0.3318 0.2543 0.2355 -0.0116 -0.0050 -0.0193 39 GLN H N +1832 C CA . GLN B 41 ? 0.3183 0.2445 0.2219 -0.0123 -0.0046 -0.0213 39 GLN H CA +1833 C C . GLN B 41 ? 0.3034 0.2329 0.2110 -0.0114 -0.0050 -0.0210 39 GLN H C +1834 O O . GLN B 41 ? 0.3241 0.2551 0.2299 -0.0095 -0.0068 -0.0206 39 GLN H O +1835 C CB . GLN B 41 ? 0.3527 0.2804 0.2509 -0.0115 -0.0071 -0.0207 39 GLN H CB +1836 C CG . GLN B 41 ? 0.3713 0.3050 0.2688 -0.0131 -0.0074 -0.0226 39 GLN H CG +1837 C CD . GLN B 41 ? 0.4246 0.3619 0.3173 -0.0133 -0.0105 -0.0199 39 GLN H CD +1838 O OE1 . GLN B 41 ? 0.4364 0.3717 0.3299 -0.0102 -0.0131 -0.0161 39 GLN H OE1 +1839 N NE2 . GLN B 41 ? 0.4043 0.3479 0.2934 -0.0175 -0.0102 -0.0217 39 GLN H NE2 +1840 N N . ALA B 42 ? 0.3547 0.2855 0.2691 -0.0131 -0.0027 -0.0213 40 ALA H N +1841 C CA . ALA B 42 ? 0.3524 0.2872 0.2712 -0.0129 -0.0028 -0.0198 40 ALA H CA +1842 C C . ALA B 42 ? 0.4720 0.4102 0.3884 -0.0126 -0.0036 -0.0226 40 ALA H C +1843 O O . ALA B 42 ? 0.3621 0.3007 0.2752 -0.0134 -0.0036 -0.0254 40 ALA H O +1844 C CB . ALA B 42 ? 0.3839 0.3187 0.3141 -0.0147 -0.0000 -0.0181 40 ALA H CB +1845 N N . PRO B 43 ? 0.4090 0.3515 0.3270 -0.0120 -0.0042 -0.0216 41 PRO H N +1846 C CA . PRO B 43 ? 0.4081 0.3547 0.3249 -0.0114 -0.0052 -0.0241 41 PRO H CA +1847 C C . PRO B 43 ? 0.3385 0.2866 0.2584 -0.0139 -0.0035 -0.0273 41 PRO H C +1848 O O . PRO B 43 ? 0.4212 0.3686 0.3486 -0.0161 -0.0006 -0.0277 41 PRO H O +1849 C CB . PRO B 43 ? 0.4914 0.4426 0.4109 -0.0114 -0.0049 -0.0225 41 PRO H CB +1850 C CG . PRO B 43 ? 0.4103 0.3610 0.3282 -0.0116 -0.0052 -0.0195 41 PRO H CG +1851 C CD . PRO B 43 ? 0.3675 0.3128 0.2875 -0.0123 -0.0045 -0.0179 41 PRO H CD +1852 N N . GLY B 44 ? 0.4293 0.3802 0.3446 -0.0141 -0.0054 -0.0294 42 GLY H N +1853 C CA . GLY B 44 ? 0.4356 0.3905 0.3519 -0.0178 -0.0040 -0.0336 42 GLY H CA +1854 C C . GLY B 44 ? 0.5372 0.4896 0.4536 -0.0214 -0.0008 -0.0370 42 GLY H C +1855 O O . GLY B 44 ? 0.4912 0.4477 0.4097 -0.0258 0.0017 -0.0426 42 GLY H O +1856 N N . LYS B 45 ? 0.3887 0.3354 0.3037 -0.0202 -0.0002 -0.0347 43 LYS H N +1857 C CA . LYS B 45 ? 0.3496 0.2939 0.2669 -0.0235 0.0038 -0.0383 43 LYS H CA +1858 C C . LYS B 45 ? 0.3106 0.2549 0.2180 -0.0240 0.0020 -0.0371 43 LYS H C +1859 O O . LYS B 45 ? 0.3641 0.3097 0.2647 -0.0217 -0.0025 -0.0329 43 LYS H O +1860 C CB . LYS B 45 ? 0.3649 0.3032 0.2923 -0.0221 0.0065 -0.0359 43 LYS H CB +1861 C CG . LYS B 45 ? 0.5712 0.5100 0.5099 -0.0218 0.0080 -0.0344 43 LYS H CG +1862 C CD . LYS B 45 ? 0.7561 0.6947 0.7076 -0.0256 0.0139 -0.0404 43 LYS H CD +1863 C CE . LYS B 45 ? 0.8821 0.8195 0.8492 -0.0250 0.0157 -0.0362 43 LYS H CE +1864 N NZ . LYS B 45 ? 0.9331 0.8749 0.9016 -0.0262 0.0155 -0.0383 43 LYS H NZ +1865 N N . GLY B 46 ? 0.3333 0.2762 0.2417 -0.0274 0.0060 -0.0408 44 GLY H N +1866 C CA . GLY B 46 ? 0.4179 0.3619 0.3173 -0.0292 0.0051 -0.0397 44 GLY H CA +1867 C C . GLY B 46 ? 0.4303 0.3670 0.3299 -0.0255 0.0041 -0.0346 44 GLY H C +1868 O O . GLY B 46 ? 0.4142 0.3463 0.3194 -0.0217 0.0032 -0.0315 44 GLY H O +1869 N N . LEU B 47 ? 0.3937 0.3306 0.2868 -0.0275 0.0042 -0.0336 45 LEU H N +1870 C CA . LEU B 47 ? 0.3577 0.2881 0.2512 -0.0249 0.0035 -0.0294 45 LEU H CA +1871 C C . LEU B 47 ? 0.3619 0.2888 0.2645 -0.0261 0.0087 -0.0327 45 LEU H C +1872 O O . LEU B 47 ? 0.3526 0.2822 0.2590 -0.0304 0.0139 -0.0390 45 LEU H O +1873 C CB . LEU B 47 ? 0.3587 0.2911 0.2432 -0.0268 0.0017 -0.0260 45 LEU H CB +1874 C CG . LEU B 47 ? 0.3914 0.3286 0.2700 -0.0258 -0.0037 -0.0209 45 LEU H CG +1875 C CD1 . LEU B 47 ? 0.3799 0.3211 0.2509 -0.0291 -0.0053 -0.0160 45 LEU H CD1 +1876 C CD2 . LEU B 47 ? 0.3838 0.3156 0.2665 -0.0197 -0.0072 -0.0167 45 LEU H CD2 +1877 N N . GLU B 48 ? 0.3592 0.2809 0.2666 -0.0228 0.0075 -0.0287 46 GLU H N +1878 C CA . GLU B 48 ? 0.3877 0.3067 0.3061 -0.0233 0.0114 -0.0296 46 GLU H CA +1879 C C . GLU B 48 ? 0.3215 0.2369 0.2378 -0.0218 0.0095 -0.0254 46 GLU H C +1880 O O . GLU B 48 ? 0.3294 0.2435 0.2437 -0.0190 0.0053 -0.0212 46 GLU H O +1881 C CB . GLU B 48 ? 0.3854 0.3042 0.3160 -0.0214 0.0116 -0.0278 46 GLU H CB +1882 C CG . GLU B 48 ? 0.4190 0.3359 0.3648 -0.0218 0.0154 -0.0271 46 GLU H CG +1883 C CD . GLU B 48 ? 0.4384 0.3563 0.3972 -0.0197 0.0139 -0.0212 46 GLU H CD +1884 O OE1 . GLU B 48 ? 0.4317 0.3517 0.3849 -0.0181 0.0095 -0.0172 46 GLU H OE1 +1885 O OE2 . GLU B 48 ? 0.4743 0.3917 0.4503 -0.0201 0.0174 -0.0200 46 GLU H OE2 +1886 N N . TRP B 49 ? 0.3232 0.2378 0.2409 -0.0244 0.0130 -0.0272 47 TRP H N +1887 C CA . TRP B 49 ? 0.3157 0.2271 0.2330 -0.0234 0.0115 -0.0235 47 TRP H CA +1888 C C . TRP B 49 ? 0.3209 0.2317 0.2499 -0.0214 0.0106 -0.0203 47 TRP H C +1889 O O . TRP B 49 ? 0.3344 0.2466 0.2757 -0.0216 0.0134 -0.0211 47 TRP H O +1890 C CB . TRP B 49 ? 0.3689 0.2807 0.2858 -0.0272 0.0161 -0.0265 47 TRP H CB +1891 C CG . TRP B 49 ? 0.3719 0.2807 0.2915 -0.0267 0.0156 -0.0233 47 TRP H CG +1892 C CD1 . TRP B 49 ? 0.4090 0.3153 0.3209 -0.0262 0.0124 -0.0196 47 TRP H CD1 +1893 C CD2 . TRP B 49 ? 0.3565 0.2650 0.2896 -0.0268 0.0185 -0.0235 47 TRP H CD2 +1894 N NE1 . TRP B 49 ? 0.3754 0.2798 0.2935 -0.0265 0.0132 -0.0182 47 TRP H NE1 +1895 C CE2 . TRP B 49 ? 0.3511 0.2573 0.2820 -0.0268 0.0166 -0.0201 47 TRP H CE2 +1896 C CE3 . TRP B 49 ? 0.3506 0.2605 0.2997 -0.0270 0.0227 -0.0257 47 TRP H CE3 +1897 C CZ2 . TRP B 49 ? 0.3972 0.3038 0.3401 -0.0271 0.0182 -0.0189 47 TRP H CZ2 +1898 C CZ3 . TRP B 49 ? 0.3364 0.2463 0.2993 -0.0268 0.0243 -0.0236 47 TRP H CZ3 +1899 C CH2 . TRP B 49 ? 0.3627 0.2714 0.3215 -0.0269 0.0218 -0.0202 47 TRP H CH2 +1900 N N . VAL B 50 ? 0.2871 0.1967 0.2134 -0.0200 0.0068 -0.0163 48 VAL H N +1901 C CA . VAL B 50 ? 0.3144 0.2265 0.2491 -0.0191 0.0045 -0.0121 48 VAL H CA +1902 C C . VAL B 50 ? 0.3726 0.2843 0.3126 -0.0203 0.0049 -0.0103 48 VAL H C +1903 O O . VAL B 50 ? 0.3284 0.2431 0.2817 -0.0206 0.0056 -0.0072 48 VAL H O +1904 C CB . VAL B 50 ? 0.3947 0.3086 0.3220 -0.0178 -0.0003 -0.0102 48 VAL H CB +1905 C CG1 . VAL B 50 ? 0.3388 0.2582 0.2722 -0.0187 -0.0031 -0.0056 48 VAL H CG1 +1906 C CG2 . VAL B 50 ? 0.4527 0.3680 0.3774 -0.0167 -0.0006 -0.0115 48 VAL H CG2 +1907 N N . SER B 51 ? 0.3057 0.2143 0.2375 -0.0209 0.0043 -0.0113 49 SER H N +1908 C CA . SER B 51 ? 0.3154 0.2241 0.2520 -0.0223 0.0042 -0.0095 49 SER H CA +1909 C C . SER B 51 ? 0.3476 0.2516 0.2759 -0.0235 0.0050 -0.0112 49 SER H C +1910 O O . SER B 51 ? 0.3566 0.2579 0.2758 -0.0227 0.0039 -0.0119 49 SER H O +1911 C CB . SER B 51 ? 0.4005 0.3140 0.3390 -0.0226 -0.0005 -0.0061 49 SER H CB +1912 O OG . SER B 51 ? 0.4135 0.3278 0.3550 -0.0245 -0.0011 -0.0052 49 SER H OG +1913 N N . VAL B 52 ? 0.3488 0.2522 0.2819 -0.0253 0.0071 -0.0109 50 VAL H N +1914 C CA . VAL B 52 ? 0.3594 0.2587 0.2864 -0.0270 0.0081 -0.0112 50 VAL H CA +1915 C C . VAL B 52 ? 0.3439 0.2436 0.2767 -0.0285 0.0072 -0.0099 50 VAL H C +1916 O O . VAL B 52 ? 0.3278 0.2320 0.2707 -0.0289 0.0071 -0.0087 50 VAL H O +1917 C CB . VAL B 52 ? 0.3619 0.2610 0.2869 -0.0293 0.0133 -0.0131 50 VAL H CB +1918 C CG1 . VAL B 52 ? 0.3255 0.2273 0.2625 -0.0311 0.0177 -0.0147 50 VAL H CG1 +1919 C CG2 . VAL B 52 ? 0.3844 0.2803 0.3010 -0.0312 0.0134 -0.0112 50 VAL H CG2 +1920 N N . ILE B 53 ? 0.3209 0.2163 0.2490 -0.0295 0.0065 -0.0096 51 ILE H N +1921 C CA . ILE B 53 ? 0.3886 0.2841 0.3221 -0.0319 0.0065 -0.0093 51 ILE H CA +1922 C C . ILE B 53 ? 0.4275 0.3182 0.3581 -0.0339 0.0095 -0.0084 51 ILE H C +1923 O O . ILE B 53 ? 0.3878 0.2740 0.3118 -0.0333 0.0091 -0.0070 51 ILE H O +1924 C CB . ILE B 53 ? 0.3469 0.2436 0.2805 -0.0324 0.0025 -0.0105 51 ILE H CB +1925 C CG1 . ILE B 53 ? 0.3349 0.2330 0.2747 -0.0358 0.0025 -0.0108 51 ILE H CG1 +1926 C CG2 . ILE B 53 ? 0.3375 0.2283 0.2646 -0.0311 0.0016 -0.0121 51 ILE H CG2 +1927 C CD1 . ILE B 53 ? 0.3441 0.2475 0.2850 -0.0380 -0.0012 -0.0132 51 ILE H CD1 +1928 N N . TYR B 54 ? 0.3266 0.2189 0.2634 -0.0364 0.0126 -0.0083 52 TYR H N +1929 C CA . TYR B 54 ? 0.3082 0.1974 0.2424 -0.0393 0.0160 -0.0068 52 TYR H CA +1930 C C . TYR B 54 ? 0.3464 0.2313 0.2828 -0.0406 0.0142 -0.0057 52 TYR H C +1931 O O . TYR B 54 ? 0.3755 0.2619 0.3169 -0.0407 0.0114 -0.0076 52 TYR H O +1932 C CB . TYR B 54 ? 0.2926 0.1861 0.2342 -0.0420 0.0211 -0.0082 52 TYR H CB +1933 C CG . TYR B 54 ? 0.3422 0.2395 0.2838 -0.0421 0.0253 -0.0110 52 TYR H CG +1934 C CD1 . TYR B 54 ? 0.3473 0.2450 0.2836 -0.0397 0.0237 -0.0120 52 TYR H CD1 +1935 C CD2 . TYR B 54 ? 0.3155 0.2165 0.2635 -0.0454 0.0317 -0.0137 52 TYR H CD2 +1936 C CE1 . TYR B 54 ? 0.3144 0.2159 0.2519 -0.0407 0.0283 -0.0159 52 TYR H CE1 +1937 C CE2 . TYR B 54 ? 0.3228 0.2277 0.2726 -0.0464 0.0369 -0.0185 52 TYR H CE2 +1938 C CZ . TYR B 54 ? 0.3820 0.2870 0.3267 -0.0442 0.0351 -0.0197 52 TYR H CZ +1939 O OH . TYR B 54 ? 0.3977 0.3069 0.3451 -0.0461 0.0410 -0.0258 52 TYR H OH +1940 N N . SER B 55 ? 0.3275 0.2080 0.2608 -0.0427 0.0161 -0.0025 53 SER H N +1941 C CA . SER B 55 ? 0.3211 0.1966 0.2592 -0.0444 0.0155 -0.0017 53 SER H CA +1942 C C . SER B 55 ? 0.4115 0.2905 0.3583 -0.0469 0.0161 -0.0045 53 SER H C +1943 O O . SER B 55 ? 0.3723 0.2504 0.3241 -0.0479 0.0139 -0.0071 53 SER H O +1944 C CB . SER B 55 ? 0.4280 0.2996 0.3637 -0.0468 0.0179 0.0042 53 SER H CB +1945 O OG . SER B 55 ? 0.5204 0.3969 0.4546 -0.0502 0.0222 0.0052 53 SER H OG +1946 N N . GLY B 56 ? 0.3994 0.2837 0.3495 -0.0484 0.0193 -0.0046 54 GLY H N +1947 C CA . GLY B 56 ? 0.4142 0.3033 0.3748 -0.0506 0.0196 -0.0062 54 GLY H CA +1948 C C . GLY B 56 ? 0.4128 0.3085 0.3788 -0.0490 0.0155 -0.0080 54 GLY H C +1949 O O . GLY B 56 ? 0.3998 0.3014 0.3754 -0.0511 0.0144 -0.0082 54 GLY H O +1950 N N . GLY B 57 ? 0.3774 0.2737 0.3380 -0.0457 0.0128 -0.0083 55 GLY H N +1951 C CA . GLY B 57 ? 0.3824 0.2860 0.3468 -0.0449 0.0082 -0.0086 55 GLY H CA +1952 C C . GLY B 57 ? 0.3791 0.2881 0.3487 -0.0423 0.0085 -0.0066 55 GLY H C +1953 O O . GLY B 57 ? 0.3905 0.3056 0.3618 -0.0414 0.0043 -0.0052 55 GLY H O +1954 N N . SER B 58 ? 0.3284 0.2362 0.3016 -0.0418 0.0137 -0.0067 56 SER H N +1955 C CA . SER B 58 ? 0.3151 0.2271 0.2961 -0.0394 0.0149 -0.0060 56 SER H CA +1956 C C . SER B 58 ? 0.3993 0.3095 0.3708 -0.0366 0.0123 -0.0062 56 SER H C +1957 O O . SER B 58 ? 0.3534 0.2579 0.3120 -0.0362 0.0119 -0.0078 56 SER H O +1958 C CB . SER B 58 ? 0.3479 0.2587 0.3335 -0.0402 0.0225 -0.0089 56 SER H CB +1959 O OG . SER B 58 ? 0.3505 0.2639 0.3471 -0.0428 0.0257 -0.0089 56 SER H OG +1960 N N . THR B 59 ? 0.3092 0.2248 0.2890 -0.0347 0.0104 -0.0038 57 THR H N +1961 C CA . THR B 59 ? 0.3434 0.2586 0.3163 -0.0322 0.0079 -0.0036 57 THR H CA +1962 C C . THR B 59 ? 0.3764 0.2933 0.3603 -0.0304 0.0114 -0.0034 57 THR H C +1963 O O . THR B 59 ? 0.3456 0.2666 0.3466 -0.0305 0.0134 -0.0012 57 THR H O +1964 C CB . THR B 59 ? 0.3622 0.2838 0.3340 -0.0327 0.0013 -0.0002 57 THR H CB +1965 O OG1 . THR B 59 ? 0.3450 0.2757 0.3323 -0.0337 -0.0009 0.0053 57 THR H OG1 +1966 C CG2 . THR B 59 ? 0.3799 0.2994 0.3418 -0.0351 -0.0011 -0.0029 57 THR H CG2 +1967 N N . TYR B 60 ? 0.3338 0.2476 0.3097 -0.0288 0.0123 -0.0058 58 TYR H N +1968 C CA . TYR B 60 ? 0.3175 0.2324 0.3039 -0.0275 0.0160 -0.0069 58 TYR H CA +1969 C C . TYR B 60 ? 0.3470 0.2621 0.3263 -0.0255 0.0125 -0.0058 58 TYR H C +1970 O O . TYR B 60 ? 0.3340 0.2468 0.2980 -0.0253 0.0092 -0.0065 58 TYR H O +1971 C CB . TYR B 60 ? 0.3225 0.2341 0.3077 -0.0292 0.0236 -0.0139 58 TYR H CB +1972 C CG . TYR B 60 ? 0.3555 0.2675 0.3465 -0.0317 0.0274 -0.0153 58 TYR H CG +1973 C CD1 . TYR B 60 ? 0.3942 0.3097 0.4067 -0.0318 0.0312 -0.0148 58 TYR H CD1 +1974 C CD2 . TYR B 60 ? 0.3805 0.2897 0.3577 -0.0339 0.0271 -0.0160 58 TYR H CD2 +1975 C CE1 . TYR B 60 ? 0.4043 0.3208 0.4231 -0.0341 0.0349 -0.0162 58 TYR H CE1 +1976 C CE2 . TYR B 60 ? 0.4362 0.3461 0.4188 -0.0366 0.0306 -0.0168 58 TYR H CE2 +1977 C CZ . TYR B 60 ? 0.3991 0.3129 0.4020 -0.0367 0.0346 -0.0174 58 TYR H CZ +1978 O OH . TYR B 60 ? 0.4676 0.3826 0.4767 -0.0394 0.0385 -0.0186 58 TYR H OH +1979 N N . TYR B 61 ? 0.2971 0.2146 0.2895 -0.0242 0.0141 -0.0043 59 TYR H N +1980 C CA . TYR B 61 ? 0.2982 0.2173 0.2876 -0.0226 0.0107 -0.0018 59 TYR H CA +1981 C C . TYR B 61 ? 0.3888 0.3062 0.3874 -0.0220 0.0161 -0.0057 59 TYR H C +1982 O O . TYR B 61 ? 0.3261 0.2435 0.3421 -0.0224 0.0216 -0.0075 59 TYR H O +1983 C CB . TYR B 61 ? 0.3056 0.2326 0.3052 -0.0223 0.0051 0.0074 59 TYR H CB +1984 C CG . TYR B 61 ? 0.3070 0.2376 0.2972 -0.0241 -0.0001 0.0097 59 TYR H CG +1985 C CD1 . TYR B 61 ? 0.3205 0.2518 0.2942 -0.0247 -0.0041 0.0084 59 TYR H CD1 +1986 C CD2 . TYR B 61 ? 0.3512 0.2847 0.3503 -0.0256 -0.0003 0.0120 59 TYR H CD2 +1987 C CE1 . TYR B 61 ? 0.3208 0.2555 0.2872 -0.0272 -0.0078 0.0084 59 TYR H CE1 +1988 C CE2 . TYR B 61 ? 0.3801 0.3174 0.3710 -0.0282 -0.0047 0.0129 59 TYR H CE2 +1989 C CZ . TYR B 61 ? 0.3789 0.3167 0.3535 -0.0292 -0.0082 0.0106 59 TYR H CZ +1990 O OH . TYR B 61 ? 0.3185 0.2602 0.2864 -0.0325 -0.0115 0.0095 59 TYR H OH +1991 N N . ALA B 62 ? 0.3057 0.2220 0.2944 -0.0212 0.0149 -0.0075 60 ALA H N +1992 C CA . ALA B 62 ? 0.3459 0.2615 0.3449 -0.0211 0.0196 -0.0110 60 ALA H CA +1993 C C . ALA B 62 ? 0.4372 0.3565 0.4593 -0.0197 0.0192 -0.0035 60 ALA H C +1994 O O . ALA B 62 ? 0.3354 0.2597 0.3590 -0.0189 0.0130 0.0056 60 ALA H O +1995 C CB . ALA B 62 ? 0.3691 0.2841 0.3535 -0.0207 0.0175 -0.0133 60 ALA H CB +1996 N N . ASP B 63 ? 0.3753 0.2930 0.4166 -0.0200 0.0260 -0.0073 61 ASP H N +1997 C CA . ASP B 63 ? 0.3873 0.3082 0.4553 -0.0184 0.0259 0.0012 61 ASP H CA +1998 C C . ASP B 63 ? 0.4311 0.3562 0.4959 -0.0173 0.0193 0.0104 61 ASP H C +1999 O O . ASP B 63 ? 0.3776 0.3089 0.4571 -0.0165 0.0150 0.0224 61 ASP H O +2000 C CB . ASP B 63 ? 0.5616 0.4789 0.6522 -0.0191 0.0356 -0.0063 61 ASP H CB +2001 C CG . ASP B 63 ? 0.9830 0.9029 1.1069 -0.0171 0.0363 0.0035 61 ASP H CG +2002 O OD1 . ASP B 63 ? 1.1386 1.0624 1.2758 -0.0161 0.0338 0.0118 61 ASP H OD1 +2003 O OD2 . ASP B 63 ? 1.1304 1.0489 1.2686 -0.0167 0.0392 0.0036 61 ASP H OD2 +2004 N N . SER B 64 ? 0.4025 0.3259 0.4482 -0.0176 0.0180 0.0057 62 SER H N +2005 C CA . SER B 64 ? 0.4164 0.3442 0.4587 -0.0170 0.0127 0.0132 62 SER H CA +2006 C C . SER B 64 ? 0.4471 0.3819 0.4767 -0.0175 0.0046 0.0214 62 SER H C +2007 O O . SER B 64 ? 0.4266 0.3677 0.4553 -0.0180 0.0003 0.0288 62 SER H O +2008 C CB . SER B 64 ? 0.4436 0.3683 0.4694 -0.0173 0.0138 0.0052 62 SER H CB +2009 O OG . SER B 64 ? 0.4882 0.4104 0.4918 -0.0178 0.0127 -0.0013 62 SER H OG +2010 N N . VAL B 65 ? 0.3191 0.2538 0.3384 -0.0182 0.0029 0.0195 63 VAL H N +2011 C CA . VAL B 65 ? 0.3344 0.2764 0.3419 -0.0198 -0.0039 0.0250 63 VAL H CA +2012 C C . VAL B 65 ? 0.3933 0.3406 0.4111 -0.0210 -0.0061 0.0310 63 VAL H C +2013 O O . VAL B 65 ? 0.3464 0.3012 0.3550 -0.0234 -0.0116 0.0348 63 VAL H O +2014 C CB . VAL B 65 ? 0.3389 0.2770 0.3223 -0.0201 -0.0049 0.0167 63 VAL H CB +2015 C CG1 . VAL B 65 ? 0.3432 0.2776 0.3180 -0.0189 -0.0032 0.0116 63 VAL H CG1 +2016 C CG2 . VAL B 65 ? 0.3251 0.2562 0.3041 -0.0199 -0.0017 0.0100 63 VAL H CG2 +2017 N N . LYS B 66 ? 0.3686 0.3131 0.4065 -0.0198 -0.0017 0.0317 64 LYS H N +2018 C CA . LYS B 66 ? 0.4358 0.3853 0.4854 -0.0208 -0.0035 0.0371 64 LYS H CA +2019 C C . LYS B 66 ? 0.3191 0.2824 0.3773 -0.0227 -0.0110 0.0514 64 LYS H C +2020 O O . LYS B 66 ? 0.3564 0.3244 0.4265 -0.0223 -0.0124 0.0599 64 LYS H O +2021 C CB . LYS B 66 ? 0.5997 0.5445 0.6739 -0.0191 0.0036 0.0353 64 LYS H CB +2022 C CG . LYS B 66 ? 0.9039 0.8390 0.9694 -0.0191 0.0108 0.0218 64 LYS H CG +2023 C CD . LYS B 66 ? 0.9839 0.9189 1.0687 -0.0192 0.0154 0.0210 64 LYS H CD +2024 C CE . LYS B 66 ? 0.9786 0.9059 1.0537 -0.0205 0.0230 0.0077 64 LYS H CE +2025 N NZ . LYS B 66 ? 0.9258 0.8478 1.0023 -0.0206 0.0298 -0.0011 64 LYS H NZ +2026 N N . GLY B 67 ? 0.3656 0.3365 0.4179 -0.0255 -0.0159 0.0545 65 GLY H N +2027 C CA . GLY B 67 ? 0.4289 0.4162 0.4866 -0.0291 -0.0238 0.0680 65 GLY H CA +2028 C C . GLY B 67 ? 0.4335 0.4289 0.4694 -0.0328 -0.0289 0.0683 65 GLY H C +2029 O O . GLY B 67 ? 0.4128 0.4242 0.4474 -0.0377 -0.0357 0.0775 65 GLY H O +2030 N N . ARG B 68 ? 0.3529 0.3391 0.3724 -0.0312 -0.0256 0.0585 66 ARG H N +2031 C CA . ARG B 68 ? 0.3374 0.3304 0.3377 -0.0345 -0.0290 0.0570 66 ARG H CA +2032 C C . ARG B 68 ? 0.3955 0.3827 0.3740 -0.0356 -0.0277 0.0439 66 ARG H C +2033 O O . ARG B 68 ? 0.4104 0.4071 0.3754 -0.0402 -0.0310 0.0423 66 ARG H O +2034 C CB . ARG B 68 ? 0.3332 0.3218 0.3343 -0.0320 -0.0265 0.0571 66 ARG H CB +2035 C CG . ARG B 68 ? 0.3493 0.3417 0.3755 -0.0306 -0.0267 0.0698 66 ARG H CG +2036 C CD . ARG B 68 ? 0.3049 0.2954 0.3318 -0.0294 -0.0250 0.0710 66 ARG H CD +2037 N NE . ARG B 68 ? 0.3343 0.3091 0.3562 -0.0254 -0.0183 0.0579 66 ARG H NE +2038 C CZ . ARG B 68 ? 0.3780 0.3492 0.3818 -0.0252 -0.0172 0.0495 66 ARG H CZ +2039 N NH1 . ARG B 68 ? 0.3261 0.3072 0.3156 -0.0287 -0.0214 0.0516 66 ARG H NH1 +2040 N NH2 . ARG B 68 ? 0.3495 0.3086 0.3502 -0.0222 -0.0119 0.0391 66 ARG H NH2 +2041 N N . PHE B 69 ? 0.3606 0.3334 0.3366 -0.0319 -0.0227 0.0346 67 PHE H N +2042 C CA . PHE B 69 ? 0.3265 0.2919 0.2856 -0.0321 -0.0209 0.0235 67 PHE H CA +2043 C C . PHE B 69 ? 0.3430 0.3063 0.3038 -0.0333 -0.0206 0.0212 67 PHE H C +2044 O O . PHE B 69 ? 0.3393 0.3010 0.3140 -0.0320 -0.0192 0.0249 67 PHE H O +2045 C CB . PHE B 69 ? 0.2830 0.2347 0.2370 -0.0276 -0.0159 0.0159 67 PHE H CB +2046 C CG . PHE B 69 ? 0.3360 0.2887 0.2853 -0.0266 -0.0159 0.0157 67 PHE H CG +2047 C CD1 . PHE B 69 ? 0.3971 0.3613 0.3495 -0.0290 -0.0194 0.0232 67 PHE H CD1 +2048 C CD2 . PHE B 69 ? 0.3858 0.3289 0.3281 -0.0235 -0.0126 0.0087 67 PHE H CD2 +2049 C CE1 . PHE B 69 ? 0.3716 0.3367 0.3202 -0.0282 -0.0189 0.0229 67 PHE H CE1 +2050 C CE2 . PHE B 69 ? 0.3439 0.2883 0.2830 -0.0226 -0.0125 0.0083 67 PHE H CE2 +2051 C CZ . PHE B 69 ? 0.3638 0.3186 0.3061 -0.0249 -0.0153 0.0150 67 PHE H CZ +2052 N N . THR B 70 ? 0.3200 0.2833 0.2685 -0.0361 -0.0213 0.0144 68 THR H N +2053 C CA . THR B 70 ? 0.3211 0.2813 0.2704 -0.0375 -0.0205 0.0109 68 THR H CA +2054 C C . THR B 70 ? 0.3520 0.3010 0.2897 -0.0364 -0.0174 0.0010 68 THR H C +2055 O O . THR B 70 ? 0.3670 0.3180 0.2955 -0.0381 -0.0180 -0.0040 68 THR H O +2056 C CB . THR B 70 ? 0.3557 0.3304 0.3058 -0.0438 -0.0254 0.0140 68 THR H CB +2057 O OG1 . THR B 70 ? 0.4106 0.3981 0.3724 -0.0451 -0.0295 0.0257 68 THR H OG1 +2058 C CG2 . THR B 70 ? 0.4042 0.3755 0.3580 -0.0452 -0.0243 0.0111 68 THR H CG2 +2059 N N . ILE B 71 ? 0.3326 0.2709 0.2723 -0.0340 -0.0137 -0.0014 69 ILE H N +2060 C CA . ILE B 71 ? 0.3108 0.2391 0.2427 -0.0332 -0.0112 -0.0082 69 ILE H CA +2061 C C . ILE B 71 ? 0.3809 0.3102 0.3141 -0.0370 -0.0116 -0.0108 69 ILE H C +2062 O O . ILE B 71 ? 0.3895 0.3241 0.3304 -0.0391 -0.0126 -0.0071 69 ILE H O +2063 C CB . ILE B 71 ? 0.3251 0.2430 0.2569 -0.0294 -0.0072 -0.0084 69 ILE H CB +2064 C CG1 . ILE B 71 ? 0.3115 0.2205 0.2359 -0.0282 -0.0055 -0.0127 69 ILE H CG1 +2065 C CG2 . ILE B 71 ? 0.3380 0.2549 0.2783 -0.0302 -0.0050 -0.0061 69 ILE H CG2 +2066 C CD1 . ILE B 71 ? 0.3245 0.2270 0.2470 -0.0258 -0.0026 -0.0117 69 ILE H CD1 +2067 N N . SER B 72 ? 0.3649 0.2895 0.2928 -0.0381 -0.0104 -0.0173 70 SER H N +2068 C CA . SER B 72 ? 0.3983 0.3232 0.3284 -0.0424 -0.0102 -0.0213 70 SER H CA +2069 C C . SER B 72 ? 0.4044 0.3187 0.3324 -0.0414 -0.0071 -0.0276 70 SER H C +2070 O O . SER B 72 ? 0.3995 0.3080 0.3243 -0.0376 -0.0059 -0.0283 70 SER H O +2071 C CB . SER B 72 ? 0.4004 0.3402 0.3299 -0.0484 -0.0138 -0.0228 70 SER H CB +2072 O OG . SER B 72 ? 0.3587 0.3013 0.2817 -0.0498 -0.0135 -0.0291 70 SER H OG +2073 N N . ARG B 73 ? 0.3617 0.2737 0.2935 -0.0449 -0.0058 -0.0318 71 ARG H N +2074 C CA . ARG B 73 ? 0.3389 0.2405 0.2731 -0.0441 -0.0025 -0.0372 71 ARG H CA +2075 C C . ARG B 73 ? 0.3878 0.2927 0.3266 -0.0503 -0.0014 -0.0453 71 ARG H C +2076 O O . ARG B 73 ? 0.4103 0.3248 0.3497 -0.0552 -0.0036 -0.0454 71 ARG H O +2077 C CB . ARG B 73 ? 0.3578 0.2477 0.2947 -0.0406 -0.0002 -0.0317 71 ARG H CB +2078 C CG . ARG B 73 ? 0.4169 0.3069 0.3583 -0.0436 0.0004 -0.0295 71 ARG H CG +2079 C CD . ARG B 73 ? 0.4173 0.2991 0.3592 -0.0410 0.0026 -0.0230 71 ARG H CD +2080 N NE . ARG B 73 ? 0.4826 0.3652 0.4297 -0.0444 0.0038 -0.0218 71 ARG H NE +2081 C CZ . ARG B 73 ? 0.4704 0.3522 0.4175 -0.0439 0.0055 -0.0165 71 ARG H CZ +2082 N NH1 . ARG B 73 ? 0.3995 0.2800 0.3412 -0.0407 0.0063 -0.0127 71 ARG H NH1 +2083 N NH2 . ARG B 73 ? 0.4527 0.3358 0.4056 -0.0473 0.0069 -0.0160 71 ARG H NH2 +2084 N N . HIS B 74 ? 0.4067 0.3043 0.3501 -0.0505 0.0020 -0.0525 72 HIS H N +2085 C CA . HIS B 74 ? 0.4480 0.3465 0.3983 -0.0567 0.0046 -0.0624 72 HIS H CA +2086 C C . HIS B 74 ? 0.4781 0.3610 0.4393 -0.0540 0.0086 -0.0618 72 HIS H C +2087 O O . HIS B 74 ? 0.4909 0.3653 0.4567 -0.0497 0.0109 -0.0620 72 HIS H O +2088 C CB . HIS B 74 ? 0.5126 0.4193 0.4615 -0.0609 0.0060 -0.0738 72 HIS H CB +2089 C CG . HIS B 74 ? 0.8812 0.7920 0.8366 -0.0691 0.0091 -0.0862 72 HIS H CG +2090 N ND1 . HIS B 74 ? 0.9722 0.9009 0.9214 -0.0778 0.0070 -0.0926 72 HIS H ND1 +2091 C CD2 . HIS B 74 ? 0.9393 0.8396 0.9077 -0.0707 0.0143 -0.0934 72 HIS H CD2 +2092 C CE1 . HIS B 74 ? 0.9393 0.8688 0.8964 -0.0848 0.0110 -0.1048 72 HIS H CE1 +2093 N NE2 . HIS B 74 ? 0.9327 0.8442 0.9025 -0.0804 0.0158 -0.1057 72 HIS H NE2 +2094 N N . ASN B 75 ? 0.5119 0.3915 0.4783 -0.0565 0.0093 -0.0597 73 ASN H N +2095 C CA . ASN B 75 ? 0.5789 0.4441 0.5553 -0.0538 0.0126 -0.0554 73 ASN H CA +2096 C C . ASN B 75 ? 0.5893 0.4467 0.5794 -0.0548 0.0173 -0.0644 73 ASN H C +2097 O O . ASN B 75 ? 0.6000 0.4463 0.5985 -0.0500 0.0192 -0.0594 73 ASN H O +2098 C CB . ASN B 75 ? 0.7038 0.5682 0.6834 -0.0571 0.0128 -0.0516 73 ASN H CB +2099 C CG . ASN B 75 ? 0.9793 0.8305 0.9672 -0.0543 0.0154 -0.0437 73 ASN H CG +2100 O OD1 . ASN B 75 ? 0.9412 0.7881 0.9250 -0.0492 0.0146 -0.0345 73 ASN H OD1 +2101 N ND2 . ASN B 75 ? 1.0840 0.9299 1.0836 -0.0584 0.0186 -0.0469 73 ASN H ND2 +2102 N N . SER B 76 ? 0.5401 0.4040 0.5340 -0.0616 0.0194 -0.0777 74 SER H N +2103 C CA . SER B 76 ? 0.6121 0.4681 0.6225 -0.0634 0.0255 -0.0884 74 SER H CA +2104 C C . SER B 76 ? 0.6518 0.5049 0.6648 -0.0584 0.0271 -0.0907 74 SER H C +2105 O O . SER B 76 ? 0.6591 0.5010 0.6898 -0.0560 0.0319 -0.0932 74 SER H O +2106 C CB . SER B 76 ? 0.7680 0.6342 0.7806 -0.0733 0.0280 -0.1043 74 SER H CB +2107 O OG . SER B 76 ? 0.8927 0.7731 0.8945 -0.0765 0.0268 -0.1126 74 SER H OG +2108 N N . LYS B 77 ? 0.5224 0.3855 0.5205 -0.0568 0.0234 -0.0893 75 LYS H N +2109 C CA . LYS B 77 ? 0.4660 0.3274 0.4658 -0.0519 0.0246 -0.0904 75 LYS H CA +2110 C C . LYS B 77 ? 0.5042 0.3577 0.5019 -0.0433 0.0214 -0.0750 75 LYS H C +2111 O O . LYS B 77 ? 0.4740 0.3259 0.4740 -0.0386 0.0218 -0.0742 75 LYS H O +2112 C CB . LYS B 77 ? 0.5324 0.4096 0.5175 -0.0553 0.0224 -0.0966 75 LYS H CB +2113 C CG . LYS B 77 ? 0.6013 0.4902 0.5867 -0.0654 0.0256 -0.1129 75 LYS H CG +2114 C CD . LYS B 77 ? 0.6165 0.5209 0.5897 -0.0686 0.0245 -0.1188 75 LYS H CD +2115 C CE . LYS B 77 ? 0.7397 0.6588 0.7119 -0.0803 0.0278 -0.1355 75 LYS H CE +2116 N NZ . LYS B 77 ? 0.8044 0.7418 0.7599 -0.0866 0.0212 -0.1309 75 LYS H NZ +2117 N N . ASN B 78 ? 0.4259 0.2759 0.4192 -0.0418 0.0184 -0.0634 76 ASN H N +2118 C CA . ASN B 78 ? 0.4108 0.2564 0.3996 -0.0355 0.0154 -0.0492 76 ASN H CA +2119 C C . ASN B 78 ? 0.3626 0.2153 0.3397 -0.0322 0.0125 -0.0480 76 ASN H C +2120 O O . ASN B 78 ? 0.3820 0.2311 0.3622 -0.0271 0.0119 -0.0429 76 ASN H O +2121 C CB . ASN B 78 ? 0.4393 0.2728 0.4448 -0.0316 0.0176 -0.0431 76 ASN H CB +2122 C CG . ASN B 78 ? 0.4662 0.2968 0.4668 -0.0284 0.0144 -0.0272 76 ASN H CG +2123 O OD1 . ASN B 78 ? 0.4240 0.2583 0.4134 -0.0305 0.0126 -0.0229 76 ASN H OD1 +2124 N ND2 . ASN B 78 ? 0.4310 0.2564 0.4403 -0.0238 0.0139 -0.0186 76 ASN H ND2 +2125 N N . THR B 79 ? 0.3851 0.2490 0.3501 -0.0353 0.0103 -0.0520 77 THR H N +2126 C CA . THR B 79 ? 0.3509 0.2227 0.3061 -0.0334 0.0081 -0.0523 77 THR H CA +2127 C C . THR B 79 ? 0.3731 0.2527 0.3160 -0.0340 0.0042 -0.0461 77 THR H C +2128 O O . THR B 79 ? 0.3826 0.2666 0.3240 -0.0382 0.0033 -0.0464 77 THR H O +2129 C CB . THR B 79 ? 0.4407 0.3204 0.3969 -0.0378 0.0103 -0.0651 77 THR H CB +2130 O OG1 . THR B 79 ? 0.4559 0.3277 0.4269 -0.0368 0.0152 -0.0721 77 THR H OG1 +2131 C CG2 . THR B 79 ? 0.4078 0.2972 0.3533 -0.0366 0.0079 -0.0647 77 THR H CG2 +2132 N N . LEU B 80 ? 0.3617 0.2430 0.2978 -0.0300 0.0020 -0.0403 78 LEU H N +2133 C CA . LEU B 80 ? 0.3672 0.2554 0.2948 -0.0300 -0.0008 -0.0350 78 LEU H CA +2134 C C . LEU B 80 ? 0.3769 0.2755 0.2994 -0.0314 -0.0024 -0.0384 78 LEU H C +2135 O O . LEU B 80 ? 0.4044 0.3035 0.3276 -0.0304 -0.0012 -0.0431 78 LEU H O +2136 C CB . LEU B 80 ? 0.3303 0.2141 0.2550 -0.0255 -0.0014 -0.0271 78 LEU H CB +2137 C CG . LEU B 80 ? 0.3351 0.2239 0.2543 -0.0251 -0.0029 -0.0222 78 LEU H CG +2138 C CD1 . LEU B 80 ? 0.4196 0.3077 0.3409 -0.0274 -0.0021 -0.0196 78 LEU H CD1 +2139 C CD2 . LEU B 80 ? 0.4086 0.2949 0.3242 -0.0215 -0.0029 -0.0178 78 LEU H CD2 +2140 N N . TYR B 81 ? 0.3456 0.2532 0.2644 -0.0337 -0.0050 -0.0351 79 TYR H N +2141 C CA . TYR B 81 ? 0.3463 0.2656 0.2606 -0.0358 -0.0070 -0.0360 79 TYR H CA +2142 C C . TYR B 81 ? 0.3432 0.2664 0.2561 -0.0337 -0.0094 -0.0277 79 TYR H C +2143 O O . TYR B 81 ? 0.3630 0.2832 0.2791 -0.0326 -0.0094 -0.0226 79 TYR H O +2144 C CB . TYR B 81 ? 0.3820 0.3132 0.2957 -0.0431 -0.0083 -0.0403 79 TYR H CB +2145 C CG . TYR B 81 ? 0.4494 0.3779 0.3663 -0.0466 -0.0051 -0.0507 79 TYR H CG +2146 C CD1 . TYR B 81 ? 0.4053 0.3367 0.3216 -0.0483 -0.0024 -0.0598 79 TYR H CD1 +2147 C CD2 . TYR B 81 ? 0.3896 0.3127 0.3121 -0.0485 -0.0038 -0.0523 79 TYR H CD2 +2148 C CE1 . TYR B 81 ? 0.4573 0.3857 0.3798 -0.0519 0.0018 -0.0710 79 TYR H CE1 +2149 C CE2 . TYR B 81 ? 0.4895 0.4092 0.4177 -0.0519 -0.0001 -0.0626 79 TYR H CE2 +2150 C CZ . TYR B 81 ? 0.4762 0.3984 0.4050 -0.0536 0.0029 -0.0723 79 TYR H CZ +2151 O OH . TYR B 81 ? 0.4903 0.4090 0.4279 -0.0574 0.0078 -0.0840 79 TYR H OH +2152 N N . LEU B 82 ? 0.3522 0.2827 0.2618 -0.0337 -0.0107 -0.0267 80 LEU H N +2153 C CA . LEU B 82 ? 0.3310 0.2671 0.2423 -0.0327 -0.0129 -0.0188 80 LEU H CA +2154 C C . LEU B 82 ? 0.3764 0.3273 0.2853 -0.0375 -0.0157 -0.0175 80 LEU H C +2155 O O . LEU B 82 ? 0.3542 0.3090 0.2582 -0.0384 -0.0151 -0.0216 80 LEU H O +2156 C CB . LEU B 82 ? 0.3261 0.2557 0.2368 -0.0276 -0.0115 -0.0170 80 LEU H CB +2157 C CG . LEU B 82 ? 0.3283 0.2612 0.2441 -0.0264 -0.0123 -0.0099 80 LEU H CG +2158 C CD1 . LEU B 82 ? 0.3247 0.2539 0.2476 -0.0260 -0.0112 -0.0067 80 LEU H CD1 +2159 C CD2 . LEU B 82 ? 0.3495 0.2783 0.2638 -0.0228 -0.0109 -0.0101 80 LEU H CD2 +2160 N N . GLN B 83 ? 0.3297 0.2902 0.2428 -0.0411 -0.0188 -0.0115 81 GLN H N +2161 C CA . GLN B 83 ? 0.3572 0.3346 0.2687 -0.0465 -0.0226 -0.0071 81 GLN H CA +2162 C C . GLN B 83 ? 0.3640 0.3436 0.2818 -0.0434 -0.0240 0.0029 81 GLN H C +2163 O O . GLN B 83 ? 0.3773 0.3525 0.3053 -0.0403 -0.0240 0.0092 81 GLN H O +2164 C CB . GLN B 83 ? 0.3406 0.3295 0.2552 -0.0524 -0.0260 -0.0041 81 GLN H CB +2165 C CG . GLN B 83 ? 0.3486 0.3587 0.2616 -0.0593 -0.0310 0.0030 81 GLN H CG +2166 C CD . GLN B 83 ? 0.4514 0.4702 0.3523 -0.0648 -0.0299 -0.0057 81 GLN H CD +2167 O OE1 . GLN B 83 ? 0.4237 0.4392 0.3194 -0.0672 -0.0267 -0.0180 81 GLN H OE1 +2168 N NE2 . GLN B 83 ? 0.4351 0.4654 0.3331 -0.0669 -0.0320 0.0002 81 GLN H NE2 +2169 N N . MET B 84 ? 0.3066 0.2928 0.2200 -0.0444 -0.0246 0.0039 82 MET H N +2170 C CA . MET B 84 ? 0.3692 0.3562 0.2897 -0.0415 -0.0253 0.0128 82 MET H CA +2171 C C . MET B 84 ? 0.3871 0.3932 0.3088 -0.0475 -0.0300 0.0223 82 MET H C +2172 O O . MET B 84 ? 0.4258 0.4422 0.3372 -0.0524 -0.0306 0.0187 82 MET H O +2173 C CB . MET B 84 ? 0.3457 0.3241 0.2613 -0.0374 -0.0219 0.0072 82 MET H CB +2174 C CG . MET B 84 ? 0.4368 0.3992 0.3506 -0.0324 -0.0182 -0.0004 82 MET H CG +2175 S SD . MET B 84 ? 0.5300 0.4848 0.4398 -0.0279 -0.0153 -0.0053 82 MET H SD +2176 C CE . MET B 84 ? 0.4270 0.3903 0.3277 -0.0319 -0.0151 -0.0125 82 MET H CE +2177 N N . ASN B 85 ? 0.3315 0.3433 0.2668 -0.0476 -0.0331 0.0346 83 ASN H N +2178 C CA . ASN B 85 ? 0.3513 0.3824 0.2911 -0.0532 -0.0384 0.0475 83 ASN H CA +2179 C C . ASN B 85 ? 0.3924 0.4211 0.3458 -0.0493 -0.0380 0.0577 83 ASN H C +2180 O O . ASN B 85 ? 0.3883 0.4012 0.3500 -0.0426 -0.0337 0.0547 83 ASN H O +2181 C CB . ASN B 85 ? 0.3676 0.4101 0.3164 -0.0571 -0.0433 0.0564 83 ASN H CB +2182 C CG . ASN B 85 ? 0.5035 0.5500 0.4402 -0.0622 -0.0438 0.0464 83 ASN H CG +2183 O OD1 . ASN B 85 ? 0.4401 0.4899 0.3614 -0.0662 -0.0422 0.0359 83 ASN H OD1 +2184 N ND2 . ASN B 85 ? 0.5198 0.5662 0.4654 -0.0624 -0.0454 0.0490 83 ASN H ND2 +2185 N N . SER B 86 ? 0.3489 0.3947 0.3051 -0.0543 -0.0425 0.0700 84 SER H N +2186 C CA . SER B 86 ? 0.3795 0.4258 0.3522 -0.0517 -0.0428 0.0823 84 SER H CA +2187 C C . SER B 86 ? 0.3675 0.3970 0.3380 -0.0457 -0.0367 0.0729 84 SER H C +2188 O O . SER B 86 ? 0.3522 0.3702 0.3386 -0.0402 -0.0334 0.0748 84 SER H O +2189 C CB . SER B 86 ? 0.4614 0.5053 0.4591 -0.0484 -0.0439 0.0936 84 SER H CB +2190 O OG . SER B 86 ? 0.5013 0.5615 0.5022 -0.0539 -0.0501 0.1029 84 SER H OG +2191 N N . LEU B 87 ? 0.3117 0.3407 0.2635 -0.0471 -0.0348 0.0619 85 LEU H N +2192 C CA . LEU B 87 ? 0.3023 0.3160 0.2511 -0.0416 -0.0294 0.0521 85 LEU H CA +2193 C C . LEU B 87 ? 0.3209 0.3358 0.2809 -0.0404 -0.0288 0.0605 85 LEU H C +2194 O O . LEU B 87 ? 0.3393 0.3690 0.3036 -0.0450 -0.0324 0.0727 85 LEU H O +2195 C CB . LEU B 87 ? 0.3127 0.3263 0.2421 -0.0432 -0.0276 0.0390 85 LEU H CB +2196 C CG . LEU B 87 ? 0.3695 0.3737 0.2913 -0.0416 -0.0258 0.0276 85 LEU H CG +2197 C CD1 . LEU B 87 ? 0.3775 0.3865 0.2842 -0.0453 -0.0246 0.0167 85 LEU H CD1 +2198 C CD2 . LEU B 87 ? 0.3909 0.3769 0.3166 -0.0345 -0.0217 0.0214 85 LEU H CD2 +2199 N N . ARG B 88 ? 0.3264 0.3265 0.2913 -0.0349 -0.0240 0.0541 86 ARG H N +2200 C CA . ARG B 88 ? 0.3572 0.3559 0.3348 -0.0335 -0.0222 0.0598 86 ARG H CA +2201 C C . ARG B 88 ? 0.3683 0.3591 0.3349 -0.0311 -0.0185 0.0482 86 ARG H C +2202 O O . ARG B 88 ? 0.3387 0.3217 0.2933 -0.0290 -0.0167 0.0365 86 ARG H O +2203 C CB . ARG B 88 ? 0.3785 0.3678 0.3790 -0.0296 -0.0194 0.0637 86 ARG H CB +2204 C CG . ARG B 88 ? 0.4715 0.4670 0.4871 -0.0308 -0.0226 0.0749 86 ARG H CG +2205 C CD . ARG B 88 ? 0.5236 0.5064 0.5594 -0.0263 -0.0177 0.0724 86 ARG H CD +2206 N NE . ARG B 88 ? 0.5298 0.5182 0.5836 -0.0268 -0.0202 0.0831 86 ARG H NE +2207 C CZ . ARG B 88 ? 0.5556 0.5351 0.6265 -0.0237 -0.0159 0.0801 86 ARG H CZ +2208 N NH1 . ARG B 88 ? 0.5898 0.5554 0.6601 -0.0207 -0.0089 0.0664 86 ARG H NH1 +2209 N NH2 . ARG B 88 ? 0.6182 0.6042 0.7069 -0.0242 -0.0186 0.0907 86 ARG H NH2 +2210 N N . ALA B 89 ? 0.3298 0.3234 0.3021 -0.0317 -0.0175 0.0524 87 ALA H N +2211 C CA . ALA B 89 ? 0.3006 0.2888 0.2638 -0.0299 -0.0143 0.0423 87 ALA H CA +2212 C C . ALA B 89 ? 0.3100 0.2834 0.2732 -0.0252 -0.0106 0.0312 87 ALA H C +2213 O O . ALA B 89 ? 0.3773 0.3468 0.3281 -0.0236 -0.0094 0.0213 87 ALA H O +2214 C CB . ALA B 89 ? 0.3623 0.3544 0.3359 -0.0311 -0.0133 0.0491 87 ALA H CB +2215 N N . GLU B 90 ? 0.3151 0.2814 0.2928 -0.0233 -0.0086 0.0328 88 GLU H N +2216 C CA . GLU B 90 ? 0.3912 0.3460 0.3682 -0.0204 -0.0047 0.0222 88 GLU H CA +2217 C C . GLU B 90 ? 0.4162 0.3673 0.3797 -0.0194 -0.0057 0.0159 88 GLU H C +2218 O O . GLU B 90 ? 0.4018 0.3453 0.3614 -0.0176 -0.0031 0.0077 88 GLU H O +2219 C CB . GLU B 90 ? 0.3768 0.3261 0.3750 -0.0196 -0.0008 0.0242 88 GLU H CB +2220 C CG . GLU B 90 ? 0.3795 0.3311 0.3894 -0.0199 -0.0024 0.0324 88 GLU H CG +2221 C CD . GLU B 90 ? 0.4693 0.4299 0.4957 -0.0217 -0.0051 0.0473 88 GLU H CD +2222 O OE1 . GLU B 90 ? 0.4493 0.4166 0.4716 -0.0236 -0.0070 0.0518 88 GLU H OE1 +2223 O OE2 . GLU B 90 ? 0.4856 0.4476 0.5298 -0.0216 -0.0054 0.0553 88 GLU H OE2 +2224 N N . ASP B 91 ? 0.3284 0.2857 0.2850 -0.0211 -0.0093 0.0194 89 ASP H N +2225 C CA . ASP B 91 ? 0.3144 0.2680 0.2584 -0.0204 -0.0099 0.0127 89 ASP H CA +2226 C C . ASP B 91 ? 0.3502 0.3033 0.2806 -0.0197 -0.0099 0.0052 89 ASP H C +2227 O O . ASP B 91 ? 0.3387 0.2878 0.2609 -0.0188 -0.0099 -0.0004 89 ASP H O +2228 C CB . ASP B 91 ? 0.3295 0.2907 0.2722 -0.0233 -0.0134 0.0179 89 ASP H CB +2229 C CG . ASP B 91 ? 0.3688 0.3304 0.3272 -0.0235 -0.0137 0.0257 89 ASP H CG +2230 O OD1 . ASP B 91 ? 0.3533 0.3059 0.3192 -0.0210 -0.0102 0.0222 89 ASP H OD1 +2231 O OD2 . ASP B 91 ? 0.3730 0.3454 0.3373 -0.0266 -0.0172 0.0355 89 ASP H OD2 +2232 N N . THR B 92 ? 0.3276 0.2847 0.2575 -0.0200 -0.0095 0.0054 90 THR H N +2233 C CA . THR B 92 ? 0.3364 0.2936 0.2565 -0.0191 -0.0090 -0.0015 90 THR H CA +2234 C C . THR B 92 ? 0.3636 0.3114 0.2817 -0.0157 -0.0075 -0.0078 90 THR H C +2235 O O . THR B 92 ? 0.3416 0.2857 0.2653 -0.0149 -0.0059 -0.0080 90 THR H O +2236 C CB . THR B 92 ? 0.3385 0.3021 0.2606 -0.0203 -0.0085 0.0004 90 THR H CB +2237 O OG1 . THR B 92 ? 0.3384 0.3132 0.2609 -0.0245 -0.0103 0.0073 90 THR H OG1 +2238 C CG2 . THR B 92 ? 0.3268 0.2905 0.2417 -0.0188 -0.0076 -0.0071 90 THR H CG2 +2239 N N . ALA B 93 ? 0.3088 0.2537 0.2198 -0.0144 -0.0080 -0.0126 91 ALA H N +2240 C CA . ALA B 93 ? 0.3163 0.2538 0.2253 -0.0118 -0.0074 -0.0161 91 ALA H CA +2241 C C . ALA B 93 ? 0.3385 0.2739 0.2431 -0.0105 -0.0080 -0.0197 91 ALA H C +2242 O O . ALA B 93 ? 0.3476 0.2860 0.2505 -0.0121 -0.0082 -0.0210 91 ALA H O +2243 C CB . ALA B 93 ? 0.2981 0.2306 0.2100 -0.0122 -0.0065 -0.0146 91 ALA H CB +2244 N N . VAL B 94 ? 0.3164 0.2473 0.2201 -0.0083 -0.0083 -0.0211 92 VAL H N +2245 C CA . VAL B 94 ? 0.3135 0.2400 0.2165 -0.0068 -0.0087 -0.0227 92 VAL H CA +2246 C C . VAL B 94 ? 0.3143 0.2360 0.2161 -0.0078 -0.0086 -0.0207 92 VAL H C +2247 O O . VAL B 94 ? 0.3321 0.2525 0.2334 -0.0085 -0.0082 -0.0189 92 VAL H O +2248 C CB . VAL B 94 ? 0.3561 0.2815 0.2606 -0.0041 -0.0097 -0.0224 92 VAL H CB +2249 C CG1 . VAL B 94 ? 0.3068 0.2271 0.2141 -0.0025 -0.0100 -0.0222 92 VAL H CG1 +2250 C CG2 . VAL B 94 ? 0.4204 0.3512 0.3276 -0.0030 -0.0096 -0.0245 92 VAL H CG2 +2251 N N . TYR B 95 ? 0.3267 0.2465 0.2288 -0.0086 -0.0084 -0.0221 93 TYR H N +2252 C CA . TYR B 95 ? 0.3061 0.2217 0.2079 -0.0099 -0.0082 -0.0205 93 TYR H CA +2253 C C . TYR B 95 ? 0.3342 0.2438 0.2373 -0.0083 -0.0082 -0.0206 93 TYR H C +2254 O O . TYR B 95 ? 0.3717 0.2803 0.2781 -0.0072 -0.0078 -0.0235 93 TYR H O +2255 C CB . TYR B 95 ? 0.3028 0.2219 0.2050 -0.0128 -0.0082 -0.0214 93 TYR H CB +2256 C CG . TYR B 95 ? 0.3180 0.2431 0.2217 -0.0145 -0.0088 -0.0178 93 TYR H CG +2257 C CD1 . TYR B 95 ? 0.3382 0.2694 0.2419 -0.0148 -0.0091 -0.0173 93 TYR H CD1 +2258 C CD2 . TYR B 95 ? 0.3296 0.2542 0.2368 -0.0158 -0.0087 -0.0143 93 TYR H CD2 +2259 C CE1 . TYR B 95 ? 0.3661 0.3025 0.2739 -0.0164 -0.0096 -0.0125 93 TYR H CE1 +2260 C CE2 . TYR B 95 ? 0.3264 0.2562 0.2392 -0.0170 -0.0091 -0.0097 93 TYR H CE2 +2261 C CZ . TYR B 95 ? 0.3406 0.2761 0.2539 -0.0173 -0.0097 -0.0084 93 TYR H CZ +2262 O OH . TYR B 95 ? 0.3550 0.2956 0.2764 -0.0185 -0.0100 -0.0024 93 TYR H OH +2263 N N . TYR B 96 ? 0.3329 0.2391 0.2345 -0.0085 -0.0083 -0.0173 94 TYR H N +2264 C CA . TYR B 96 ? 0.3075 0.2086 0.2109 -0.0076 -0.0086 -0.0148 94 TYR H CA +2265 C C . TYR B 96 ? 0.3363 0.2339 0.2396 -0.0099 -0.0075 -0.0140 94 TYR H C +2266 O O . TYR B 96 ? 0.3738 0.2731 0.2748 -0.0118 -0.0066 -0.0138 94 TYR H O +2267 C CB . TYR B 96 ? 0.3435 0.2461 0.2442 -0.0074 -0.0099 -0.0103 94 TYR H CB +2268 C CG . TYR B 96 ? 0.3721 0.2792 0.2734 -0.0056 -0.0114 -0.0101 94 TYR H CG +2269 C CD1 . TYR B 96 ? 0.3963 0.3026 0.3042 -0.0027 -0.0129 -0.0082 94 TYR H CD1 +2270 C CD2 . TYR B 96 ? 0.4337 0.3460 0.3313 -0.0068 -0.0112 -0.0118 94 TYR H CD2 +2271 C CE1 . TYR B 96 ? 0.3913 0.3027 0.3012 -0.0009 -0.0145 -0.0077 94 TYR H CE1 +2272 C CE2 . TYR B 96 ? 0.4363 0.3534 0.3349 -0.0054 -0.0127 -0.0118 94 TYR H CE2 +2273 C CZ . TYR B 96 ? 0.4563 0.3733 0.3606 -0.0025 -0.0146 -0.0096 94 TYR H CZ +2274 O OH . TYR B 96 ? 0.4133 0.3359 0.3200 -0.0011 -0.0162 -0.0092 94 TYR H OH +2275 N N . CYS B 97 ? 0.3776 0.2701 0.2852 -0.0096 -0.0072 -0.0136 95 CYS H N +2276 C CA . CYS B 97 ? 0.3649 0.2539 0.2726 -0.0118 -0.0062 -0.0117 95 CYS H CA +2277 C C . CYS B 97 ? 0.3824 0.2693 0.2895 -0.0117 -0.0068 -0.0053 95 CYS H C +2278 O O . CYS B 97 ? 0.3652 0.2523 0.2749 -0.0095 -0.0085 -0.0020 95 CYS H O +2279 C CB . CYS B 97 ? 0.4670 0.3523 0.3805 -0.0127 -0.0051 -0.0155 95 CYS H CB +2280 S SG . CYS B 97 ? 0.6060 0.4868 0.5295 -0.0099 -0.0047 -0.0170 95 CYS H SG +2281 N N . ALA B 98 ? 0.3619 0.2483 0.2660 -0.0145 -0.0056 -0.0028 96 ALA H N +2282 C CA . ALA B 98 ? 0.3426 0.2295 0.2445 -0.0159 -0.0062 0.0042 96 ALA H CA +2283 C C . ALA B 98 ? 0.3530 0.2372 0.2550 -0.0190 -0.0041 0.0062 96 ALA H C +2284 O O . ALA B 98 ? 0.3312 0.2153 0.2328 -0.0206 -0.0020 0.0019 96 ALA H O +2285 C CB . ALA B 98 ? 0.3453 0.2397 0.2391 -0.0177 -0.0065 0.0052 96 ALA H CB +2286 N N . ARG B 99 ? 0.3688 0.2516 0.2725 -0.0201 -0.0049 0.0137 97 ARG H N +2287 C CA . ARG B 99 ? 0.3592 0.2407 0.2622 -0.0239 -0.0028 0.0171 97 ARG H CA +2288 C C . ARG B 99 ? 0.3976 0.2876 0.2904 -0.0283 -0.0020 0.0203 97 ARG H C +2289 O O . ARG B 99 ? 0.4027 0.2985 0.2914 -0.0289 -0.0045 0.0256 97 ARG H O +2290 C CB . ARG B 99 ? 0.3402 0.2157 0.2525 -0.0232 -0.0039 0.0244 97 ARG H CB +2291 C CG . ARG B 99 ? 0.3686 0.2417 0.2822 -0.0272 -0.0015 0.0279 97 ARG H CG +2292 C CD . ARG B 99 ? 0.4003 0.2805 0.3064 -0.0317 -0.0018 0.0376 97 ARG H CD +2293 N NE . ARG B 99 ? 0.3605 0.2417 0.2720 -0.0308 -0.0056 0.0495 97 ARG H NE +2294 C CZ . ARG B 99 ? 0.3850 0.2601 0.3087 -0.0304 -0.0061 0.0578 97 ARG H CZ +2295 N NH1 . ARG B 99 ? 0.3840 0.2510 0.3148 -0.0311 -0.0029 0.0542 97 ARG H NH1 +2296 N NH2 . ARG B 99 ? 0.3900 0.2672 0.3208 -0.0294 -0.0099 0.0703 97 ARG H NH2 +2297 N N . GLU B 100 ? 0.3715 0.2634 0.2609 -0.0321 0.0019 0.0167 98 GLU H N +2298 C CA . GLU B 100 ? 0.3936 0.2945 0.2737 -0.0377 0.0043 0.0176 98 GLU H CA +2299 C C . GLU B 100 ? 0.3875 0.2891 0.2665 -0.0424 0.0060 0.0240 98 GLU H C +2300 O O . GLU B 100 ? 0.4009 0.2970 0.2856 -0.0425 0.0084 0.0222 98 GLU H O +2301 C CB . GLU B 100 ? 0.4535 0.3574 0.3326 -0.0393 0.0089 0.0078 98 GLU H CB +2302 C CG . GLU B 100 ? 0.5257 0.4392 0.3969 -0.0464 0.0134 0.0060 98 GLU H CG +2303 C CD . GLU B 100 ? 0.7000 0.6146 0.5758 -0.0481 0.0195 -0.0038 98 GLU H CD +2304 O OE1 . GLU B 100 ? 0.7540 0.6768 0.6251 -0.0542 0.0247 -0.0081 98 GLU H OE1 +2305 O OE2 . GLU B 100 ? 0.6954 0.6038 0.5805 -0.0436 0.0194 -0.0071 98 GLU H OE2 +2306 N N . ALA B 101 ? 0.3686 0.2782 0.2407 -0.0466 0.0044 0.0324 99 ALA H N +2307 C CA . ALA B 101 ? 0.4772 0.3905 0.3462 -0.0526 0.0066 0.0390 99 ALA H CA +2308 C C . ALA B 101 ? 0.5071 0.4350 0.3628 -0.0606 0.0096 0.0368 99 ALA H C +2309 O O . ALA B 101 ? 0.5664 0.4970 0.4198 -0.0640 0.0158 0.0271 99 ALA H O +2310 C CB . ALA B 101 ? 0.4570 0.3679 0.3318 -0.0516 0.0019 0.0533 99 ALA H CB +2311 N N . TYR B 102 ? 0.4043 0.3427 0.2524 -0.0640 0.0057 0.0453 100 TYR H N +2312 C CA . TYR B 102 ? 0.4067 0.3611 0.2415 -0.0717 0.0078 0.0410 100 TYR H CA +2313 C C . TYR B 102 ? 0.4592 0.4147 0.2940 -0.0674 0.0040 0.0378 100 TYR H C +2314 O O . TYR B 102 ? 0.5339 0.4954 0.3670 -0.0672 -0.0023 0.0479 100 TYR H O +2315 C CB . TYR B 102 ? 0.4519 0.4206 0.2770 -0.0802 0.0057 0.0537 100 TYR H CB +2316 C CG . TYR B 102 ? 0.5031 0.4697 0.3296 -0.0840 0.0090 0.0590 100 TYR H CG +2317 C CD1 . TYR B 102 ? 0.5713 0.5373 0.3965 -0.0876 0.0173 0.0472 100 TYR H CD1 +2318 C CD2 . TYR B 102 ? 0.5844 0.5494 0.4161 -0.0837 0.0041 0.0759 100 TYR H CD2 +2319 C CE1 . TYR B 102 ? 0.5569 0.5215 0.3840 -0.0913 0.0206 0.0518 100 TYR H CE1 +2320 C CE2 . TYR B 102 ? 0.6078 0.5709 0.4416 -0.0875 0.0074 0.0811 100 TYR H CE2 +2321 C CZ . TYR B 102 ? 0.5956 0.5586 0.4262 -0.0913 0.0156 0.0687 100 TYR H CZ +2322 O OH . TYR B 102 ? 0.5919 0.5534 0.4250 -0.0953 0.0190 0.0736 100 TYR H OH +2323 N N . GLY B 103 ? 0.3976 0.3481 0.2357 -0.0642 0.0076 0.0245 101 GLY H N +2324 C CA . GLY B 103 ? 0.4507 0.3985 0.2921 -0.0585 0.0042 0.0212 101 GLY H CA +2325 C C . GLY B 103 ? 0.4205 0.3546 0.2735 -0.0494 -0.0001 0.0257 101 GLY H C +2326 O O . GLY B 103 ? 0.4310 0.3579 0.2899 -0.0475 -0.0010 0.0322 101 GLY H O +2327 N N . MET B 104 ? 0.3680 0.2991 0.2249 -0.0441 -0.0022 0.0214 102 MET H N +2328 C CA . MET B 104 ? 0.3503 0.2702 0.2179 -0.0363 -0.0051 0.0229 102 MET H CA +2329 C C . MET B 104 ? 0.4188 0.3405 0.2899 -0.0342 -0.0110 0.0340 102 MET H C +2330 O O . MET B 104 ? 0.4129 0.3405 0.2828 -0.0331 -0.0141 0.0348 102 MET H O +2331 C CB . MET B 104 ? 0.3627 0.2797 0.2329 -0.0325 -0.0041 0.0134 102 MET H CB +2332 C CG . MET B 104 ? 0.4415 0.3553 0.3136 -0.0335 0.0012 0.0048 102 MET H CG +2333 S SD . MET B 104 ? 0.4943 0.4073 0.3707 -0.0302 0.0022 -0.0039 102 MET H SD +2334 C CE . MET B 104 ? 0.5518 0.4625 0.4339 -0.0322 0.0081 -0.0102 102 MET H CE +2335 N N . ASP B 105 ? 0.3458 0.2628 0.2235 -0.0336 -0.0124 0.0431 103 ASP H N +2336 C CA . ASP B 105 ? 0.3637 0.2838 0.2478 -0.0322 -0.0178 0.0562 103 ASP H CA +2337 C C . ASP B 105 ? 0.4148 0.3248 0.3145 -0.0243 -0.0197 0.0560 103 ASP H C +2338 O O . ASP B 105 ? 0.4319 0.3453 0.3392 -0.0219 -0.0241 0.0644 103 ASP H O +2339 C CB . ASP B 105 ? 0.3792 0.3010 0.2646 -0.0364 -0.0184 0.0683 103 ASP H CB +2340 C CG . ASP B 105 ? 0.4567 0.3648 0.3522 -0.0339 -0.0152 0.0664 103 ASP H CG +2341 O OD1 . ASP B 105 ? 0.4298 0.3307 0.3252 -0.0319 -0.0114 0.0540 103 ASP H OD1 +2342 O OD2 . ASP B 105 ? 0.4420 0.3474 0.3466 -0.0344 -0.0166 0.0779 103 ASP H OD2 +2343 N N . VAL B 106 ? 0.3802 0.2791 0.2857 -0.0209 -0.0163 0.0466 104 VAL H N +2344 C CA . VAL B 106 ? 0.4065 0.2971 0.3265 -0.0147 -0.0168 0.0438 104 VAL H CA +2345 C C . VAL B 106 ? 0.3925 0.2820 0.3083 -0.0127 -0.0147 0.0310 104 VAL H C +2346 O O . VAL B 106 ? 0.3790 0.2668 0.2886 -0.0146 -0.0117 0.0236 104 VAL H O +2347 C CB . VAL B 106 ? 0.4632 0.3429 0.3960 -0.0135 -0.0145 0.0444 104 VAL H CB +2348 C CG1 . VAL B 106 ? 0.3961 0.2685 0.3452 -0.0081 -0.0139 0.0398 104 VAL H CG1 +2349 C CG2 . VAL B 106 ? 0.4272 0.3080 0.3647 -0.0161 -0.0162 0.0585 104 VAL H CG2 +2350 N N . TRP B 107 ? 0.3382 0.2288 0.2595 -0.0087 -0.0164 0.0290 105 TRP H N +2351 C CA . TRP B 107 ? 0.3466 0.2379 0.2644 -0.0071 -0.0150 0.0187 105 TRP H CA +2352 C C . TRP B 107 ? 0.3432 0.2292 0.2740 -0.0028 -0.0141 0.0141 105 TRP H C +2353 O O . TRP B 107 ? 0.4083 0.2926 0.3517 -0.0000 -0.0155 0.0196 105 TRP H O +2354 C CB . TRP B 107 ? 0.3488 0.2494 0.2591 -0.0076 -0.0172 0.0192 105 TRP H CB +2355 C CG . TRP B 107 ? 0.3800 0.2876 0.2775 -0.0128 -0.0167 0.0197 105 TRP H CG +2356 C CD1 . TRP B 107 ? 0.4133 0.3263 0.3056 -0.0170 -0.0180 0.0274 105 TRP H CD1 +2357 C CD2 . TRP B 107 ? 0.3252 0.2357 0.2148 -0.0149 -0.0141 0.0116 105 TRP H CD2 +2358 N NE1 . TRP B 107 ? 0.4104 0.3300 0.2912 -0.0221 -0.0156 0.0228 105 TRP H NE1 +2359 C CE2 . TRP B 107 ? 0.3959 0.3131 0.2765 -0.0205 -0.0131 0.0131 105 TRP H CE2 +2360 C CE3 . TRP B 107 ? 0.3394 0.2482 0.2300 -0.0131 -0.0123 0.0037 105 TRP H CE3 +2361 C CZ2 . TRP B 107 ? 0.3606 0.2816 0.2355 -0.0238 -0.0095 0.0056 105 TRP H CZ2 +2362 C CZ3 . TRP B 107 ? 0.3567 0.2691 0.2421 -0.0159 -0.0097 -0.0015 105 TRP H CZ3 +2363 C CH2 . TRP B 107 ? 0.3681 0.2858 0.2469 -0.0210 -0.0080 -0.0012 105 TRP H CH2 +2364 N N . GLY B 108 ? 0.3684 0.2529 0.2972 -0.0028 -0.0115 0.0042 106 GLY H N +2365 C CA . GLY B 108 ? 0.4173 0.2998 0.3557 -0.0002 -0.0098 -0.0026 106 GLY H CA +2366 C C . GLY B 108 ? 0.4204 0.3089 0.3592 0.0023 -0.0115 -0.0027 106 GLY H C +2367 O O . GLY B 108 ? 0.3823 0.2766 0.3133 0.0017 -0.0141 0.0019 106 GLY H O +2368 N N . GLN B 109 ? 0.3913 0.2790 0.3398 0.0045 -0.0094 -0.0091 107 GLN H N +2369 C CA . GLN B 109 ? 0.4172 0.3105 0.3686 0.0070 -0.0105 -0.0095 107 GLN H CA +2370 C C . GLN B 109 ? 0.4493 0.3489 0.3886 0.0051 -0.0101 -0.0152 107 GLN H C +2371 O O . GLN B 109 ? 0.3998 0.3049 0.3388 0.0065 -0.0113 -0.0148 107 GLN H O +2372 C CB . GLN B 109 ? 0.4295 0.3202 0.3988 0.0100 -0.0074 -0.0146 107 GLN H CB +2373 C CG . GLN B 109 ? 0.4280 0.3206 0.3963 0.0081 -0.0028 -0.0276 107 GLN H CG +2374 C CD . GLN B 109 ? 0.5378 0.4261 0.5047 0.0045 0.0003 -0.0341 107 GLN H CD +2375 O OE1 . GLN B 109 ? 0.5007 0.3834 0.4676 0.0037 -0.0006 -0.0291 107 GLN H OE1 +2376 N NE2 . GLN B 109 ? 0.5266 0.4189 0.4921 0.0014 0.0042 -0.0452 107 GLN H NE2 +2377 N N . GLY B 110 ? 0.3956 0.2948 0.3264 0.0019 -0.0085 -0.0196 108 GLY H N +2378 C CA . GLY B 110 ? 0.3856 0.2908 0.3074 -0.0001 -0.0083 -0.0231 108 GLY H CA +2379 C C . GLY B 110 ? 0.4317 0.3402 0.3558 -0.0013 -0.0055 -0.0312 108 GLY H C +2380 O O . GLY B 110 ? 0.4060 0.3137 0.3398 0.0002 -0.0033 -0.0357 108 GLY H O +2381 N N . THR B 111 ? 0.3833 0.2966 0.2996 -0.0047 -0.0053 -0.0332 109 THR H N +2382 C CA . THR B 111 ? 0.4254 0.3455 0.3411 -0.0076 -0.0031 -0.0399 109 THR H CA +2383 C C . THR B 111 ? 0.4101 0.3377 0.3188 -0.0093 -0.0045 -0.0371 109 THR H C +2384 O O . THR B 111 ? 0.3665 0.2931 0.2714 -0.0097 -0.0063 -0.0317 109 THR H O +2385 C CB . THR B 111 ? 0.4290 0.3494 0.3444 -0.0116 -0.0014 -0.0449 109 THR H CB +2386 O OG1 . THR B 111 ? 0.4611 0.3900 0.3762 -0.0154 0.0014 -0.0530 109 THR H OG1 +2387 C CG2 . THR B 111 ? 0.3824 0.3044 0.2910 -0.0144 -0.0036 -0.0402 109 THR H CG2 +2388 N N . THR B 112 ? 0.3496 0.2845 0.2582 -0.0105 -0.0031 -0.0407 110 THR H N +2389 C CA . THR B 112 ? 0.3802 0.3217 0.2848 -0.0116 -0.0043 -0.0369 110 THR H CA +2390 C C . THR B 112 ? 0.3716 0.3221 0.2713 -0.0171 -0.0045 -0.0361 110 THR H C +2391 O O . THR B 112 ? 0.4092 0.3659 0.3073 -0.0209 -0.0027 -0.0419 110 THR H O +2392 C CB . THR B 112 ? 0.4594 0.4052 0.3671 -0.0101 -0.0029 -0.0397 110 THR H CB +2393 O OG1 . THR B 112 ? 0.4217 0.3612 0.3349 -0.0053 -0.0037 -0.0383 110 THR H OG1 +2394 C CG2 . THR B 112 ? 0.4244 0.3768 0.3291 -0.0117 -0.0038 -0.0354 110 THR H CG2 +2395 N N . VAL B 113 ? 0.3481 0.3002 0.2465 -0.0179 -0.0067 -0.0289 111 VAL H N +2396 C CA . VAL B 113 ? 0.3558 0.3176 0.2518 -0.0229 -0.0081 -0.0246 111 VAL H CA +2397 C C . VAL B 113 ? 0.3780 0.3454 0.2757 -0.0234 -0.0085 -0.0192 111 VAL H C +2398 O O . VAL B 113 ? 0.3638 0.3252 0.2657 -0.0201 -0.0087 -0.0160 111 VAL H O +2399 C CB . VAL B 113 ? 0.3697 0.3280 0.2675 -0.0233 -0.0100 -0.0192 111 VAL H CB +2400 C CG1 . VAL B 113 ? 0.3564 0.3260 0.2551 -0.0280 -0.0124 -0.0117 111 VAL H CG1 +2401 C CG2 . VAL B 113 ? 0.4107 0.3641 0.3072 -0.0237 -0.0094 -0.0244 111 VAL H CG2 +2402 N N . THR B 114 ? 0.3379 0.3176 0.2326 -0.0280 -0.0083 -0.0188 112 THR H N +2403 C CA . THR B 114 ? 0.3174 0.3036 0.2146 -0.0292 -0.0088 -0.0124 112 THR H CA +2404 C C . THR B 114 ? 0.3854 0.3837 0.2826 -0.0350 -0.0115 -0.0032 112 THR H C +2405 O O . THR B 114 ? 0.4122 0.4211 0.3028 -0.0405 -0.0119 -0.0053 112 THR H O +2406 C CB . THR B 114 ? 0.4197 0.4116 0.3144 -0.0300 -0.0061 -0.0183 112 THR H CB +2407 O OG1 . THR B 114 ? 0.4209 0.4026 0.3178 -0.0246 -0.0043 -0.0255 112 THR H OG1 +2408 C CG2 . THR B 114 ? 0.3991 0.3964 0.2976 -0.0310 -0.0064 -0.0112 112 THR H CG2 +2409 N N . VAL B 115 ? 0.3099 0.3073 0.2157 -0.0342 -0.0132 0.0069 113 VAL H N +2410 C CA . VAL B 115 ? 0.2852 0.2946 0.1950 -0.0392 -0.0165 0.0187 113 VAL H CA +2411 C C . VAL B 115 ? 0.3379 0.3543 0.2533 -0.0409 -0.0165 0.0266 113 VAL H C +2412 O O . VAL B 115 ? 0.3417 0.3493 0.2671 -0.0368 -0.0149 0.0286 113 VAL H O +2413 C CB . VAL B 115 ? 0.3115 0.3144 0.2318 -0.0369 -0.0184 0.0255 113 VAL H CB +2414 C CG1 . VAL B 115 ? 0.3153 0.3323 0.2422 -0.0421 -0.0225 0.0395 113 VAL H CG1 +2415 C CG2 . VAL B 115 ? 0.3503 0.3449 0.2654 -0.0349 -0.0179 0.0173 113 VAL H CG2 +2416 N N . SER B 116 ? 0.3448 0.3779 0.2540 -0.0476 -0.0177 0.0306 114 SER H N +2417 C CA . SER B 116 ? 0.3604 0.4010 0.2741 -0.0498 -0.0173 0.0380 114 SER H CA +2418 C C . SER B 116 ? 0.3948 0.4574 0.3026 -0.0590 -0.0201 0.0471 114 SER H C +2419 O O . SER B 116 ? 0.3495 0.4222 0.2445 -0.0643 -0.0204 0.0408 114 SER H O +2420 C CB . SER B 116 ? 0.3784 0.4145 0.2871 -0.0474 -0.0130 0.0269 114 SER H CB +2421 O OG . SER B 116 ? 0.3824 0.4299 0.2926 -0.0515 -0.0125 0.0336 114 SER H OG +2422 N N . SER B 117 ? 0.3273 0.3979 0.2453 -0.0616 -0.0220 0.0619 115 SER H N +2423 C CA . SER B 117 ? 0.3734 0.4671 0.2865 -0.0711 -0.0249 0.0732 115 SER H CA +2424 C C . SER B 117 ? 0.3972 0.5003 0.2979 -0.0755 -0.0210 0.0649 115 SER H C +2425 O O . SER B 117 ? 0.3700 0.4946 0.2618 -0.0850 -0.0225 0.0704 115 SER H O +2426 C CB . SER B 117 ? 0.4187 0.5165 0.3506 -0.0717 -0.0280 0.0934 115 SER H CB +2427 O OG . SER B 117 ? 0.6134 0.7068 0.5592 -0.0692 -0.0317 0.1033 115 SER H OG +2428 N N . ALA B 118 ? 0.3942 0.4832 0.2949 -0.0694 -0.0161 0.0523 116 ALA H N +2429 C CA . ALA B 118 ? 0.4173 0.5149 0.3101 -0.0728 -0.0120 0.0450 116 ALA H CA +2430 C C . ALA B 118 ? 0.4361 0.5458 0.3124 -0.0791 -0.0096 0.0322 116 ALA H C +2431 O O . ALA B 118 ? 0.4467 0.5508 0.3186 -0.0776 -0.0098 0.0237 116 ALA H O +2432 C CB . ALA B 118 ? 0.3801 0.4599 0.2786 -0.0644 -0.0078 0.0346 116 ALA H CB +2433 N N . SER B 119 ? 0.4436 0.5701 0.3119 -0.0866 -0.0067 0.0300 117 SER H N +2434 C CA . SER B 119 ? 0.5708 0.7087 0.4255 -0.0929 -0.0023 0.0143 117 SER H CA +2435 C C . SER B 119 ? 0.5538 0.6823 0.4102 -0.0878 0.0046 -0.0017 117 SER H C +2436 O O . SER B 119 ? 0.4257 0.5465 0.2903 -0.0827 0.0056 0.0015 117 SER H O +2437 C CB . SER B 119 ? 0.6711 0.8379 0.5145 -0.1067 -0.0028 0.0208 117 SER H CB +2438 O OG . SER B 119 ? 0.7855 0.9632 0.6262 -0.1122 -0.0094 0.0331 117 SER H OG +2439 N N . THR B 120 ? 0.5404 0.6696 0.3908 -0.0892 0.0094 -0.0191 118 THR H N +2440 C CA . THR B 120 ? 0.5776 0.6989 0.4325 -0.0844 0.0160 -0.0345 118 THR H CA +2441 C C . THR B 120 ? 0.5301 0.6641 0.3845 -0.0888 0.0196 -0.0330 118 THR H C +2442 O O . THR B 120 ? 0.5129 0.6689 0.3580 -0.0998 0.0203 -0.0291 118 THR H O +2443 C CB . THR B 120 ? 0.6120 0.7369 0.4623 -0.0879 0.0216 -0.0529 118 THR H CB +2444 O OG1 . THR B 120 ? 0.6561 0.7668 0.5086 -0.0829 0.0185 -0.0541 118 THR H OG1 +2445 C CG2 . THR B 120 ? 0.5719 0.6902 0.4306 -0.0831 0.0290 -0.0682 118 THR H CG2 +2446 N N . LYS B 121 ? 0.4666 0.5880 0.3312 -0.0807 0.0216 -0.0355 119 LYS H N +2447 C CA . LYS B 121 ? 0.4082 0.5393 0.2748 -0.0836 0.0245 -0.0327 119 LYS H CA +2448 C C . LYS B 121 ? 0.4143 0.5323 0.2919 -0.0748 0.0285 -0.0434 119 LYS H C +2449 O O . LYS B 121 ? 0.3598 0.4591 0.2455 -0.0653 0.0254 -0.0424 119 LYS H O +2450 C CB . LYS B 121 ? 0.4795 0.6108 0.3500 -0.0837 0.0188 -0.0129 119 LYS H CB +2451 C CG . LYS B 121 ? 0.5584 0.6991 0.4323 -0.0869 0.0215 -0.0082 119 LYS H CG +2452 C CD . LYS B 121 ? 0.5737 0.7113 0.4559 -0.0860 0.0162 0.0112 119 LYS H CD +2453 C CE . LYS B 121 ? 0.5944 0.7403 0.4816 -0.0891 0.0190 0.0162 119 LYS H CE +2454 N NZ . LYS B 121 ? 0.6587 0.7954 0.5521 -0.0828 0.0240 0.0021 119 LYS H NZ +2455 N N . GLY B 122 ? 0.4118 0.5409 0.2900 -0.0786 0.0353 -0.0534 120 GLY H N +2456 C CA . GLY B 122 ? 0.4334 0.5527 0.3241 -0.0708 0.0389 -0.0624 120 GLY H CA +2457 C C . GLY B 122 ? 0.4131 0.5286 0.3108 -0.0674 0.0362 -0.0517 120 GLY H C +2458 O O . GLY B 122 ? 0.4338 0.5582 0.3273 -0.0730 0.0339 -0.0391 120 GLY H O +2459 N N . PRO B 123 ? 0.4005 0.5037 0.3101 -0.0587 0.0365 -0.0561 121 PRO H N +2460 C CA . PRO B 123 ? 0.3763 0.4751 0.2934 -0.0556 0.0339 -0.0472 121 PRO H CA +2461 C C . PRO B 123 ? 0.4024 0.5160 0.3214 -0.0612 0.0388 -0.0481 121 PRO H C +2462 O O . PRO B 123 ? 0.4052 0.5298 0.3237 -0.0649 0.0453 -0.0592 121 PRO H O +2463 C CB . PRO B 123 ? 0.3821 0.4660 0.3104 -0.0456 0.0325 -0.0531 121 PRO H CB +2464 C CG . PRO B 123 ? 0.4041 0.4900 0.3351 -0.0446 0.0376 -0.0672 121 PRO H CG +2465 C CD . PRO B 123 ? 0.4070 0.5008 0.3254 -0.0518 0.0391 -0.0689 121 PRO H CD +2466 N N . SER B 124 ? 0.3342 0.4482 0.2568 -0.0622 0.0363 -0.0366 122 SER H N +2467 C CA . SER B 124 ? 0.4038 0.5272 0.3326 -0.0649 0.0404 -0.0374 122 SER H CA +2468 C C . SER B 124 ? 0.3968 0.5078 0.3386 -0.0560 0.0393 -0.0423 122 SER H C +2469 O O . SER B 124 ? 0.4193 0.5161 0.3645 -0.0501 0.0340 -0.0383 122 SER H O +2470 C CB . SER B 124 ? 0.4761 0.6064 0.4045 -0.0709 0.0386 -0.0221 122 SER H CB +2471 O OG . SER B 124 ? 0.5832 0.7238 0.5004 -0.0785 0.0371 -0.0136 122 SER H OG +2472 N N . VAL B 125 ? 0.3524 0.4703 0.3019 -0.0555 0.0443 -0.0512 123 VAL H N +2473 C CA . VAL B 125 ? 0.3421 0.4515 0.3050 -0.0476 0.0429 -0.0560 123 VAL H CA +2474 C C . VAL B 125 ? 0.3518 0.4684 0.3226 -0.0500 0.0447 -0.0529 123 VAL H C +2475 O O . VAL B 125 ? 0.3919 0.5224 0.3637 -0.0553 0.0508 -0.0571 123 VAL H O +2476 C CB . VAL B 125 ? 0.3618 0.4717 0.3319 -0.0433 0.0468 -0.0693 123 VAL H CB +2477 C CG1 . VAL B 125 ? 0.3269 0.4302 0.3120 -0.0355 0.0442 -0.0713 123 VAL H CG1 +2478 C CG2 . VAL B 125 ? 0.3518 0.4535 0.3153 -0.0411 0.0452 -0.0723 123 VAL H CG2 +2479 N N . PHE B 126 ? 0.3404 0.4481 0.3173 -0.0469 0.0399 -0.0466 124 PHE H N +2480 C CA . PHE B 126 ? 0.3248 0.4381 0.3103 -0.0495 0.0413 -0.0433 124 PHE H CA +2481 C C . PHE B 126 ? 0.3518 0.4608 0.3498 -0.0433 0.0391 -0.0488 124 PHE H C +2482 O O . PHE B 126 ? 0.3324 0.4309 0.3312 -0.0374 0.0343 -0.0501 124 PHE H O +2483 C CB . PHE B 126 ? 0.3426 0.4512 0.3273 -0.0529 0.0383 -0.0311 124 PHE H CB +2484 C CG . PHE B 126 ? 0.3680 0.4819 0.3423 -0.0592 0.0389 -0.0224 124 PHE H CG +2485 C CD1 . PHE B 126 ? 0.3902 0.5205 0.3599 -0.0669 0.0438 -0.0207 124 PHE H CD1 +2486 C CD2 . PHE B 126 ? 0.3815 0.4857 0.3507 -0.0579 0.0345 -0.0156 124 PHE H CD2 +2487 C CE1 . PHE B 126 ? 0.3773 0.5155 0.3368 -0.0738 0.0436 -0.0113 124 PHE H CE1 +2488 C CE2 . PHE B 126 ? 0.3902 0.5013 0.3511 -0.0640 0.0342 -0.0062 124 PHE H CE2 +2489 C CZ . PHE B 126 ? 0.3720 0.5006 0.3277 -0.0721 0.0384 -0.0035 124 PHE H CZ +2490 N N . PRO B 127 ? 0.3280 0.4463 0.3358 -0.0450 0.0423 -0.0514 125 PRO H N +2491 C CA . PRO B 127 ? 0.3120 0.4287 0.3325 -0.0399 0.0396 -0.0557 125 PRO H CA +2492 C C . PRO B 127 ? 0.3575 0.4664 0.3808 -0.0398 0.0344 -0.0502 125 PRO H C +2493 O O . PRO B 127 ? 0.3351 0.4429 0.3567 -0.0448 0.0351 -0.0435 125 PRO H O +2494 C CB . PRO B 127 ? 0.3185 0.4494 0.3487 -0.0430 0.0455 -0.0599 125 PRO H CB +2495 C CG . PRO B 127 ? 0.3865 0.5241 0.4089 -0.0513 0.0496 -0.0537 125 PRO H CG +2496 C CD . PRO B 127 ? 0.3345 0.4671 0.3424 -0.0523 0.0487 -0.0507 125 PRO H CD +2497 N N . LEU B 128 ? 0.3207 0.4248 0.3490 -0.0346 0.0294 -0.0530 126 LEU H N +2498 C CA . LEU B 128 ? 0.3306 0.4313 0.3639 -0.0354 0.0253 -0.0512 126 LEU H CA +2499 C C . LEU B 128 ? 0.3938 0.5054 0.4405 -0.0350 0.0255 -0.0555 126 LEU H C +2500 O O . LEU B 128 ? 0.3060 0.4199 0.3586 -0.0303 0.0217 -0.0584 126 LEU H O +2501 C CB . LEU B 128 ? 0.2662 0.3570 0.2943 -0.0315 0.0194 -0.0509 126 LEU H CB +2502 C CG . LEU B 128 ? 0.3355 0.4157 0.3517 -0.0319 0.0193 -0.0467 126 LEU H CG +2503 C CD1 . LEU B 128 ? 0.3287 0.4004 0.3398 -0.0277 0.0141 -0.0473 126 LEU H CD1 +2504 C CD2 . LEU B 128 ? 0.3556 0.4323 0.3729 -0.0372 0.0208 -0.0418 126 LEU H CD2 +2505 N N . ALA B 129 ? 0.4218 0.5412 0.4747 -0.0401 0.0299 -0.0548 127 ALA H N +2506 C CA . ALA B 129 ? 0.4149 0.5466 0.4812 -0.0399 0.0314 -0.0592 127 ALA H CA +2507 C C . ALA B 129 ? 0.3503 0.4838 0.4251 -0.0398 0.0259 -0.0604 127 ALA H C +2508 O O . ALA B 129 ? 0.3482 0.4762 0.4209 -0.0436 0.0242 -0.0585 127 ALA H O +2509 C CB . ALA B 129 ? 0.4384 0.5788 0.5083 -0.0461 0.0382 -0.0579 127 ALA H CB +2510 N N . PRO B 130 ? 0.3533 0.4959 0.4393 -0.0363 0.0234 -0.0638 128 PRO H N +2511 C CA . PRO B 130 ? 0.3481 0.4960 0.4419 -0.0374 0.0174 -0.0646 128 PRO H CA +2512 C C . PRO B 130 ? 0.4797 0.6333 0.5805 -0.0444 0.0204 -0.0656 128 PRO H C +2513 O O . PRO B 130 ? 0.4470 0.6073 0.5541 -0.0467 0.0263 -0.0662 128 PRO H O +2514 C CB . PRO B 130 ? 0.3709 0.5295 0.4780 -0.0319 0.0148 -0.0663 128 PRO H CB +2515 C CG . PRO B 130 ? 0.4236 0.5853 0.5347 -0.0303 0.0226 -0.0689 128 PRO H CG +2516 C CD . PRO B 130 ? 0.4219 0.5716 0.5161 -0.0316 0.0261 -0.0672 128 PRO H CD +2517 N N . SER B 131 ? 0.4740 0.6257 0.5743 -0.0483 0.0166 -0.0664 129 SER H N +2518 C CA . SER B 131 ? 0.5355 0.6914 0.6441 -0.0555 0.0194 -0.0682 129 SER H CA +2519 C C . SER B 131 ? 0.5923 0.7640 0.7157 -0.0563 0.0200 -0.0708 129 SER H C +2520 O O . SER B 131 ? 0.4721 0.6527 0.6016 -0.0515 0.0160 -0.0715 129 SER H O +2521 C CB . SER B 131 ? 0.6384 0.7915 0.7455 -0.0599 0.0152 -0.0713 129 SER H CB +2522 O OG . SER B 131 ? 0.7335 0.8892 0.8503 -0.0674 0.0189 -0.0740 129 SER H OG +2523 N N . SER B 132 ? 0.6420 0.8174 0.7734 -0.0624 0.0253 -0.0714 130 SER H N +2524 C CA . SER B 132 ? 0.7442 0.9347 0.8909 -0.0644 0.0268 -0.0741 130 SER H CA +2525 C C . SER B 132 ? 0.8256 1.0263 0.9811 -0.0672 0.0204 -0.0782 130 SER H C +2526 O O . SER B 132 ? 0.7371 0.9520 0.9066 -0.0688 0.0205 -0.0804 130 SER H O +2527 C CB . SER B 132 ? 0.7218 0.9128 0.8740 -0.0709 0.0346 -0.0725 130 SER H CB +2528 O OG . SER B 132 ? 0.7935 0.9835 0.9405 -0.0692 0.0406 -0.0689 130 SER H OG +2529 N N . LYS B 133 ? 0.8981 1.0937 1.0459 -0.0686 0.0149 -0.0796 131 LYS H N +2530 C CA . LYS B 133 ? 1.0016 1.2087 1.1553 -0.0732 0.0087 -0.0840 131 LYS H CA +2531 C C . LYS B 133 ? 1.1029 1.3129 1.2492 -0.0688 -0.0001 -0.0821 131 LYS H C +2532 O O . LYS B 133 ? 1.1560 1.3537 1.2886 -0.0668 -0.0011 -0.0808 131 LYS H O +2533 C CB . LYS B 133 ? 0.9414 1.1426 1.0946 -0.0821 0.0113 -0.0892 131 LYS H CB +2534 C CG . LYS B 133 ? 0.9338 1.1404 1.1014 -0.0886 0.0173 -0.0918 131 LYS H CG +2535 C CD . LYS B 133 ? 0.9964 1.2230 1.1761 -0.0923 0.0124 -0.0963 131 LYS H CD +2536 C CE . LYS B 133 ? 0.9688 1.2048 1.1633 -0.0930 0.0173 -0.0953 131 LYS H CE +2537 N NZ . LYS B 133 ? 0.9602 1.2104 1.1686 -0.1015 0.0163 -0.1018 131 LYS H NZ +2538 N N . SER B 134 ? 1.0793 1.3063 1.2357 -0.0673 -0.0065 -0.0811 132 SER H N +2539 C CA . SER B 134 ? 1.0693 1.3031 1.2212 -0.0650 -0.0160 -0.0779 132 SER H CA +2540 C C . SER B 134 ? 1.1209 1.3586 1.2654 -0.0743 -0.0198 -0.0832 132 SER H C +2541 O O . SER B 134 ? 1.0024 1.2573 1.1554 -0.0809 -0.0237 -0.0865 132 SER H O +2542 C CB . SER B 134 ? 1.0504 1.3033 1.2188 -0.0612 -0.0221 -0.0736 132 SER H CB +2543 O OG . SER B 134 ? 1.0472 1.3127 1.2137 -0.0631 -0.0326 -0.0703 132 SER H OG +2544 N N . THR B 135 ? 1.3558 1.5788 1.4853 -0.0756 -0.0180 -0.0850 133 THR H N +2545 C CA . THR B 135 ? 1.5902 1.8152 1.7134 -0.0855 -0.0189 -0.0926 133 THR H CA +2546 C C . THR B 135 ? 1.7547 1.9973 1.8735 -0.0888 -0.0293 -0.0914 133 THR H C +2547 O O . THR B 135 ? 1.7732 2.0116 1.8782 -0.0897 -0.0322 -0.0912 133 THR H O +2548 C CB . THR B 135 ? 1.6121 1.8162 1.7229 -0.0855 -0.0133 -0.0947 133 THR H CB +2549 O OG1 . THR B 135 ? 1.6377 1.8375 1.7355 -0.0802 -0.0184 -0.0895 133 THR H OG1 +2550 C CG2 . THR B 135 ? 1.5670 1.7555 1.6813 -0.0810 -0.0047 -0.0919 133 THR H CG2 +2551 N N . SER B 136 ? 1.8308 2.0944 1.9617 -0.0908 -0.0351 -0.0898 134 SER H N +2552 C CA . SER B 136 ? 1.8243 2.1106 1.9538 -0.0983 -0.0448 -0.0901 134 SER H CA +2553 C C . SER B 136 ? 1.8025 2.0961 1.9256 -0.0930 -0.0546 -0.0790 134 SER H C +2554 O O . SER B 136 ? 1.9035 2.2199 2.0281 -0.0984 -0.0642 -0.0757 134 SER H O +2555 C CB . SER B 136 ? 1.7696 2.0559 1.8891 -0.1108 -0.0420 -0.1024 134 SER H CB +2556 O OG . SER B 136 ? 1.7060 1.9793 1.8319 -0.1144 -0.0314 -0.1115 134 SER H OG +2557 N N . GLY B 137 ? 1.5884 1.8646 1.7055 -0.0830 -0.0527 -0.0727 135 GLY H N +2558 C CA . GLY B 137 ? 1.3002 1.5821 1.4133 -0.0779 -0.0616 -0.0615 135 GLY H CA +2559 C C . GLY B 137 ? 1.0254 1.3147 1.1569 -0.0679 -0.0657 -0.0505 135 GLY H C +2560 O O . GLY B 137 ? 1.0585 1.3654 1.1965 -0.0672 -0.0759 -0.0405 135 GLY H O +2561 N N . GLY B 138 ? 0.6391 0.9162 0.7806 -0.0607 -0.0577 -0.0521 136 GLY H N +2562 C CA . GLY B 138 ? 0.4911 0.7703 0.6504 -0.0502 -0.0587 -0.0438 136 GLY H CA +2563 C C . GLY B 138 ? 0.3593 0.6181 0.5130 -0.0409 -0.0542 -0.0409 136 GLY H C +2564 O O . GLY B 138 ? 0.3410 0.5984 0.5104 -0.0322 -0.0521 -0.0370 136 GLY H O +2565 N N . THR B 139 ? 0.2465 0.4903 0.3796 -0.0429 -0.0523 -0.0434 137 THR H N +2566 C CA . THR B 139 ? 0.3146 0.5388 0.4403 -0.0353 -0.0479 -0.0416 137 THR H CA +2567 C C . THR B 139 ? 0.3885 0.5957 0.5058 -0.0364 -0.0370 -0.0501 137 THR H C +2568 O O . THR B 139 ? 0.4702 0.6745 0.5778 -0.0440 -0.0344 -0.0565 137 THR H O +2569 C CB . THR B 139 ? 0.3589 0.5791 0.4682 -0.0368 -0.0534 -0.0375 137 THR H CB +2570 O OG1 . THR B 139 ? 0.4704 0.7078 0.5885 -0.0359 -0.0640 -0.0270 137 THR H OG1 +2571 C CG2 . THR B 139 ? 0.3926 0.5924 0.4938 -0.0298 -0.0486 -0.0363 137 THR H CG2 +2572 N N . ALA B 140 ? 0.2847 0.4817 0.4067 -0.0293 -0.0307 -0.0499 138 ALA H N +2573 C CA . ALA B 140 ? 0.2865 0.4691 0.4003 -0.0302 -0.0211 -0.0556 138 ALA H CA +2574 C C . ALA B 140 ? 0.3386 0.5045 0.4391 -0.0258 -0.0191 -0.0538 138 ALA H C +2575 O O . ALA B 140 ? 0.2974 0.4625 0.4008 -0.0198 -0.0229 -0.0489 138 ALA H O +2576 C CB . ALA B 140 ? 0.2483 0.4350 0.3766 -0.0275 -0.0143 -0.0580 138 ALA H CB +2577 N N . ALA B 141 ? 0.2697 0.4227 0.3575 -0.0289 -0.0134 -0.0571 139 ALA H N +2578 C CA . ALA B 141 ? 0.2346 0.3724 0.3097 -0.0255 -0.0113 -0.0557 139 ALA H CA +2579 C C . ALA B 141 ? 0.2414 0.3725 0.3156 -0.0247 -0.0027 -0.0578 139 ALA H C +2580 O O . ALA B 141 ? 0.3076 0.4409 0.3839 -0.0294 0.0019 -0.0602 139 ALA H O +2581 C CB . ALA B 141 ? 0.2679 0.3970 0.3283 -0.0303 -0.0127 -0.0565 139 ALA H CB +2582 N N . LEU B 142 ? 0.2506 0.3750 0.3221 -0.0194 -0.0007 -0.0569 140 LEU H N +2583 C CA . LEU B 142 ? 0.2865 0.4062 0.3543 -0.0197 0.0071 -0.0590 140 LEU H CA +2584 C C . LEU B 142 ? 0.3095 0.4174 0.3660 -0.0164 0.0073 -0.0576 140 LEU H C +2585 O O . LEU B 142 ? 0.2935 0.3972 0.3475 -0.0131 0.0018 -0.0551 140 LEU H O +2586 C CB . LEU B 142 ? 0.3066 0.4367 0.3891 -0.0176 0.0118 -0.0624 140 LEU H CB +2587 C CG . LEU B 142 ? 0.3456 0.4788 0.4407 -0.0105 0.0093 -0.0624 140 LEU H CG +2588 C CD1 . LEU B 142 ? 0.3921 0.5197 0.4855 -0.0076 0.0156 -0.0661 140 LEU H CD1 +2589 C CD2 . LEU B 142 ? 0.4103 0.5583 0.5264 -0.0092 0.0090 -0.0637 140 LEU H CD2 +2590 N N . GLY B 143 ? 0.2787 0.3823 0.3279 -0.0181 0.0134 -0.0589 141 GLY H N +2591 C CA . GLY B 143 ? 0.2407 0.3338 0.2788 -0.0158 0.0132 -0.0577 141 GLY H CA +2592 C C . GLY B 143 ? 0.2621 0.3542 0.2925 -0.0189 0.0198 -0.0590 141 GLY H C +2593 O O . GLY B 143 ? 0.2823 0.3827 0.3162 -0.0226 0.0249 -0.0607 141 GLY H O +2594 N N . CYS B 144 ? 0.2439 0.3271 0.2636 -0.0178 0.0193 -0.0578 142 CYS H N +2595 C CA . CYS B 144 ? 0.2593 0.3423 0.2691 -0.0215 0.0242 -0.0578 142 CYS H CA +2596 C C . CYS B 144 ? 0.2906 0.3634 0.2883 -0.0231 0.0212 -0.0519 142 CYS H C +2597 O O . CYS B 144 ? 0.3421 0.4062 0.3372 -0.0196 0.0166 -0.0506 142 CYS H O +2598 C CB . CYS B 144 ? 0.3388 0.4227 0.3496 -0.0188 0.0278 -0.0640 142 CYS H CB +2599 S SG . CYS B 144 ? 0.4993 0.5973 0.5248 -0.0193 0.0350 -0.0724 142 CYS H SG +2600 N N . LEU B 145 ? 0.3383 0.4131 0.3300 -0.0287 0.0239 -0.0475 143 LEU H N +2601 C CA . LEU B 145 ? 0.3178 0.3843 0.3007 -0.0303 0.0218 -0.0411 143 LEU H CA +2602 C C . LEU B 145 ? 0.2838 0.3526 0.2571 -0.0322 0.0242 -0.0414 143 LEU H C +2603 O O . LEU B 145 ? 0.3173 0.3969 0.2888 -0.0369 0.0287 -0.0419 143 LEU H O +2604 C CB . LEU B 145 ? 0.3543 0.4217 0.3403 -0.0354 0.0225 -0.0343 143 LEU H CB +2605 C CG . LEU B 145 ? 0.3820 0.4426 0.3629 -0.0377 0.0212 -0.0262 143 LEU H CG +2606 C CD1 . LEU B 145 ? 0.3785 0.4269 0.3580 -0.0336 0.0171 -0.0272 143 LEU H CD1 +2607 C CD2 . LEU B 145 ? 0.3945 0.4576 0.3833 -0.0428 0.0231 -0.0188 143 LEU H CD2 +2608 N N . VAL B 146 ? 0.2620 0.3221 0.2290 -0.0292 0.0214 -0.0414 144 VAL H N +2609 C CA . VAL B 146 ? 0.2857 0.3478 0.2442 -0.0307 0.0234 -0.0436 144 VAL H CA +2610 C C . VAL B 146 ? 0.3795 0.4379 0.3302 -0.0339 0.0211 -0.0347 144 VAL H C +2611 O O . VAL B 146 ? 0.3445 0.3921 0.2933 -0.0308 0.0173 -0.0324 144 VAL H O +2612 C CB . VAL B 146 ? 0.3485 0.4039 0.3084 -0.0248 0.0223 -0.0503 144 VAL H CB +2613 C CG1 . VAL B 146 ? 0.3271 0.3850 0.2791 -0.0273 0.0251 -0.0543 144 VAL H CG1 +2614 C CG2 . VAL B 146 ? 0.3719 0.4312 0.3440 -0.0210 0.0240 -0.0570 144 VAL H CG2 +2615 N N . LYS B 147 ? 0.3685 0.4366 0.3156 -0.0405 0.0233 -0.0289 145 LYS H N +2616 C CA . LYS B 147 ? 0.4290 0.4949 0.3746 -0.0437 0.0207 -0.0173 145 LYS H CA +2617 C C . LYS B 147 ? 0.4017 0.4747 0.3367 -0.0486 0.0206 -0.0136 145 LYS H C +2618 O O . LYS B 147 ? 0.3829 0.4687 0.3115 -0.0533 0.0242 -0.0179 145 LYS H O +2619 C CB . LYS B 147 ? 0.4487 0.5210 0.4019 -0.0481 0.0222 -0.0098 145 LYS H CB +2620 C CG . LYS B 147 ? 0.5350 0.5986 0.4962 -0.0481 0.0195 0.0002 145 LYS H CG +2621 C CD . LYS B 147 ? 0.5339 0.6062 0.5018 -0.0543 0.0212 0.0110 145 LYS H CD +2622 C CE . LYS B 147 ? 0.5522 0.6151 0.5336 -0.0540 0.0197 0.0197 145 LYS H CE +2623 N NZ . LYS B 147 ? 0.5224 0.5781 0.5026 -0.0525 0.0165 0.0254 145 LYS H NZ +2624 N N . ASP B 148 ? 0.3442 0.4102 0.2780 -0.0480 0.0168 -0.0060 146 ASP H N +2625 C CA . ASP B 148 ? 0.3718 0.4460 0.2979 -0.0537 0.0153 0.0020 146 ASP H CA +2626 C C . ASP B 148 ? 0.3984 0.4781 0.3131 -0.0552 0.0169 -0.0075 146 ASP H C +2627 O O . ASP B 148 ? 0.4148 0.5104 0.3215 -0.0627 0.0193 -0.0078 146 ASP H O +2628 C CB . ASP B 148 ? 0.3788 0.4685 0.3055 -0.0618 0.0166 0.0126 146 ASP H CB +2629 C CG . ASP B 148 ? 0.3547 0.4389 0.2953 -0.0613 0.0151 0.0244 146 ASP H CG +2630 O OD1 . ASP B 148 ? 0.4323 0.5019 0.3808 -0.0560 0.0127 0.0258 146 ASP H OD1 +2631 O OD2 . ASP B 148 ? 0.4405 0.5354 0.3850 -0.0667 0.0168 0.0319 146 ASP H OD2 +2632 N N . TYR B 149 ? 0.3543 0.4216 0.2687 -0.0489 0.0157 -0.0152 147 TYR H N +2633 C CA . TYR B 149 ? 0.3665 0.4367 0.2728 -0.0501 0.0173 -0.0242 147 TYR H CA +2634 C C . TYR B 149 ? 0.3783 0.4392 0.2817 -0.0479 0.0130 -0.0207 147 TYR H C +2635 O O . TYR B 149 ? 0.3480 0.3979 0.2569 -0.0438 0.0095 -0.0138 147 TYR H O +2636 C CB . TYR B 149 ? 0.3720 0.4373 0.2829 -0.0449 0.0208 -0.0380 147 TYR H CB +2637 C CG . TYR B 149 ? 0.3585 0.4074 0.2771 -0.0362 0.0177 -0.0388 147 TYR H CG +2638 C CD1 . TYR B 149 ? 0.3671 0.4125 0.2939 -0.0330 0.0169 -0.0365 147 TYR H CD1 +2639 C CD2 . TYR B 149 ? 0.3505 0.3890 0.2680 -0.0320 0.0157 -0.0419 147 TYR H CD2 +2640 C CE1 . TYR B 149 ? 0.3590 0.3924 0.2914 -0.0264 0.0139 -0.0373 147 TYR H CE1 +2641 C CE2 . TYR B 149 ? 0.3771 0.4028 0.3006 -0.0250 0.0127 -0.0418 147 TYR H CE2 +2642 C CZ . TYR B 149 ? 0.4279 0.4520 0.3582 -0.0227 0.0117 -0.0396 147 TYR H CZ +2643 O OH . TYR B 149 ? 0.3841 0.3986 0.3187 -0.0174 0.0086 -0.0394 147 TYR H OH +2644 N N . PHE B 150 ? 0.4006 0.4668 0.2960 -0.0512 0.0141 -0.0264 148 PHE H N +2645 C CA . PHE B 150 ? 0.4226 0.4811 0.3151 -0.0497 0.0105 -0.0243 148 PHE H CA +2646 C C . PHE B 150 ? 0.3605 0.4236 0.2466 -0.0525 0.0136 -0.0361 148 PHE H C +2647 O O . PHE B 150 ? 0.3969 0.4757 0.2771 -0.0600 0.0174 -0.0412 148 PHE H O +2648 C CB . PHE B 150 ? 0.4073 0.4726 0.2975 -0.0546 0.0062 -0.0099 148 PHE H CB +2649 C CG . PHE B 150 ? 0.3775 0.4357 0.2662 -0.0531 0.0026 -0.0075 148 PHE H CG +2650 C CD1 . PHE B 150 ? 0.3586 0.4011 0.2550 -0.0463 -0.0001 -0.0033 148 PHE H CD1 +2651 C CD2 . PHE B 150 ? 0.4128 0.4811 0.2924 -0.0591 0.0024 -0.0104 148 PHE H CD2 +2652 C CE1 . PHE B 150 ? 0.3743 0.4105 0.2700 -0.0450 -0.0030 -0.0014 148 PHE H CE1 +2653 C CE2 . PHE B 150 ? 0.4306 0.4924 0.3095 -0.0577 -0.0010 -0.0083 148 PHE H CE2 +2654 C CZ . PHE B 150 ? 0.4099 0.4555 0.2971 -0.0504 -0.0036 -0.0035 148 PHE H CZ +2655 N N . PRO B 151 ? 0.4095 0.4601 0.2972 -0.0476 0.0126 -0.0412 149 PRO H N +2656 C CA . PRO B 151 ? 0.4532 0.4866 0.3470 -0.0395 0.0089 -0.0370 149 PRO H CA +2657 C C . PRO B 151 ? 0.4176 0.4419 0.3196 -0.0326 0.0108 -0.0438 149 PRO H C +2658 O O . PRO B 151 ? 0.4035 0.4345 0.3082 -0.0337 0.0150 -0.0511 149 PRO H O +2659 C CB . PRO B 151 ? 0.4661 0.4944 0.3565 -0.0395 0.0076 -0.0398 149 PRO H CB +2660 C CG . PRO B 151 ? 0.4580 0.4952 0.3454 -0.0440 0.0127 -0.0522 149 PRO H CG +2661 C CD . PRO B 151 ? 0.4564 0.5108 0.3395 -0.0511 0.0154 -0.0517 149 PRO H CD +2662 N N . GLU B 152 ? 0.3971 0.4079 0.3037 -0.0263 0.0078 -0.0414 150 GLU H N +2663 C CA . GLU B 152 ? 0.4017 0.4051 0.3161 -0.0201 0.0086 -0.0467 150 GLU H CA +2664 C C . GLU B 152 ? 0.4900 0.4927 0.4073 -0.0195 0.0119 -0.0565 150 GLU H C +2665 O O . GLU B 152 ? 0.5415 0.5458 0.4534 -0.0231 0.0128 -0.0590 150 GLU H O +2666 C CB . GLU B 152 ? 0.3978 0.3894 0.3143 -0.0152 0.0044 -0.0415 150 GLU H CB +2667 C CG . GLU B 152 ? 0.4489 0.4404 0.3664 -0.0156 0.0024 -0.0346 150 GLU H CG +2668 C CD . GLU B 152 ? 0.6657 0.6565 0.5898 -0.0123 0.0022 -0.0363 150 GLU H CD +2669 O OE1 . GLU B 152 ? 0.5893 0.5742 0.5151 -0.0101 -0.0003 -0.0337 150 GLU H OE1 +2670 O OE2 . GLU B 152 ? 0.6963 0.6939 0.6244 -0.0124 0.0048 -0.0407 150 GLU H OE2 +2671 N N . PRO B 153 ? 0.5150 0.5157 0.4428 -0.0152 0.0142 -0.0623 151 PRO H N +2672 C CA . PRO B 153 ? 0.5092 0.5098 0.4446 -0.0113 0.0132 -0.0601 151 PRO H CA +2673 C C . PRO B 153 ? 0.4420 0.4534 0.3829 -0.0134 0.0182 -0.0665 151 PRO H C +2674 O O . PRO B 153 ? 0.4378 0.4566 0.3775 -0.0178 0.0233 -0.0744 151 PRO H O +2675 C CB . PRO B 153 ? 0.5174 0.5087 0.4629 -0.0049 0.0115 -0.0609 151 PRO H CB +2676 C CG . PRO B 153 ? 0.5418 0.5328 0.4914 -0.0061 0.0162 -0.0698 151 PRO H CG +2677 C CD . PRO B 153 ? 0.5887 0.5851 0.5245 -0.0131 0.0173 -0.0707 151 PRO H CD +2678 N N . VAL B 154 ? 0.4515 0.4648 0.3986 -0.0109 0.0170 -0.0639 152 VAL H N +2679 C CA . VAL B 154 ? 0.4851 0.5072 0.4416 -0.0112 0.0217 -0.0703 152 VAL H CA +2680 C C . VAL B 154 ? 0.4428 0.4600 0.4145 -0.0041 0.0199 -0.0704 152 VAL H C +2681 O O . VAL B 154 ? 0.4449 0.4549 0.4166 -0.0004 0.0141 -0.0634 152 VAL H O +2682 C CB . VAL B 154 ? 0.5137 0.5449 0.4667 -0.0151 0.0221 -0.0666 152 VAL H CB +2683 C CG1 . VAL B 154 ? 0.5590 0.5989 0.4998 -0.0229 0.0244 -0.0655 152 VAL H CG1 +2684 C CG2 . VAL B 154 ? 0.4947 0.5201 0.4471 -0.0126 0.0163 -0.0577 152 VAL H CG2 +2685 N N . THR B 155 ? 0.4334 0.4559 0.4189 -0.0027 0.0250 -0.0782 153 THR H N +2686 C CA . THR B 155 ? 0.4810 0.5021 0.4844 0.0038 0.0231 -0.0769 153 THR H CA +2687 C C . THR B 155 ? 0.4202 0.4520 0.4307 0.0028 0.0257 -0.0791 153 THR H C +2688 O O . THR B 155 ? 0.4294 0.4700 0.4368 -0.0023 0.0319 -0.0859 153 THR H O +2689 C CB . THR B 155 ? 0.5173 0.5345 0.5376 0.0076 0.0271 -0.0837 153 THR H CB +2690 O OG1 . THR B 155 ? 0.5939 0.6192 0.6193 0.0037 0.0362 -0.0961 153 THR H OG1 +2691 C CG2 . THR B 155 ? 0.6024 0.6092 0.6157 0.0079 0.0252 -0.0821 153 THR H CG2 +2692 N N . VAL B 156 ? 0.3729 0.4055 0.3925 0.0068 0.0208 -0.0730 154 VAL H N +2693 C CA . VAL B 156 ? 0.3633 0.4062 0.3919 0.0063 0.0226 -0.0745 154 VAL H CA +2694 C C . VAL B 156 ? 0.3518 0.3960 0.4030 0.0129 0.0207 -0.0732 154 VAL H C +2695 O O . VAL B 156 ? 0.4051 0.4439 0.4592 0.0169 0.0138 -0.0652 154 VAL H O +2696 C CB . VAL B 156 ? 0.3952 0.4404 0.4127 0.0034 0.0178 -0.0674 154 VAL H CB +2697 C CG1 . VAL B 156 ? 0.3683 0.4246 0.3961 0.0025 0.0201 -0.0695 154 VAL H CG1 +2698 C CG2 . VAL B 156 ? 0.3726 0.4161 0.3713 -0.0025 0.0189 -0.0662 154 VAL H CG2 +2699 N N . SER B 157 ? 0.3495 0.4018 0.4177 0.0138 0.0267 -0.0804 155 SER H N +2700 C CA . SER B 157 ? 0.3821 0.4386 0.4747 0.0198 0.0246 -0.0776 155 SER H CA +2701 C C . SER B 157 ? 0.3256 0.3944 0.4239 0.0176 0.0269 -0.0800 155 SER H C +2702 O O . SER B 157 ? 0.3948 0.4681 0.4794 0.0116 0.0312 -0.0844 155 SER H O +2703 C CB . SER B 157 ? 0.4195 0.4733 0.5351 0.0243 0.0305 -0.0845 155 SER H CB +2704 O OG . SER B 157 ? 0.5169 0.5778 0.6385 0.0208 0.0412 -0.0979 155 SER H OG +2705 N N . TRP B 158 ? 0.3195 0.3945 0.4388 0.0223 0.0236 -0.0758 156 TRP H N +2706 C CA . TRP B 158 ? 0.2788 0.3661 0.4069 0.0207 0.0257 -0.0780 156 TRP H CA +2707 C C . TRP B 158 ? 0.3195 0.4131 0.4790 0.0257 0.0312 -0.0835 156 TRP H C +2708 O O . TRP B 158 ? 0.4021 0.4926 0.5812 0.0321 0.0277 -0.0784 156 TRP H O +2709 C CB . TRP B 158 ? 0.3046 0.3964 0.4292 0.0205 0.0159 -0.0674 156 TRP H CB +2710 C CG . TRP B 158 ? 0.3188 0.4066 0.4163 0.0145 0.0133 -0.0650 156 TRP H CG +2711 C CD1 . TRP B 158 ? 0.2878 0.3656 0.3679 0.0136 0.0085 -0.0599 156 TRP H CD1 +2712 C CD2 . TRP B 158 ? 0.3318 0.4253 0.4191 0.0084 0.0164 -0.0677 156 TRP H CD2 +2713 N NE1 . TRP B 158 ? 0.2713 0.3481 0.3327 0.0077 0.0084 -0.0595 156 TRP H NE1 +2714 C CE2 . TRP B 158 ? 0.2818 0.3679 0.3475 0.0044 0.0131 -0.0637 156 TRP H CE2 +2715 C CE3 . TRP B 158 ? 0.3132 0.4175 0.4091 0.0058 0.0220 -0.0729 156 TRP H CE3 +2716 C CZ2 . TRP B 158 ? 0.2990 0.3877 0.3536 -0.0017 0.0150 -0.0638 156 TRP H CZ2 +2717 C CZ3 . TRP B 158 ? 0.3620 0.4692 0.4446 -0.0006 0.0237 -0.0728 156 TRP H CZ3 +2718 C CH2 . TRP B 158 ? 0.3187 0.4179 0.3817 -0.0042 0.0200 -0.0679 156 TRP H CH2 +2719 N N . ASN B 159 ? 0.2905 0.3932 0.4560 0.0224 0.0401 -0.0937 157 ASN H N +2720 C CA . ASN B 159 ? 0.3371 0.4470 0.5343 0.0263 0.0476 -0.1015 157 ASN H CA +2721 C C . ASN B 159 ? 0.3767 0.4777 0.5905 0.0311 0.0517 -0.1062 157 ASN H C +2722 O O . ASN B 159 ? 0.4047 0.5065 0.6498 0.0381 0.0514 -0.1039 157 ASN H O +2723 C CB . ASN B 159 ? 0.3145 0.4336 0.5341 0.0311 0.0410 -0.0927 157 ASN H CB +2724 C CG . ASN B 159 ? 0.3661 0.4958 0.5748 0.0258 0.0398 -0.0918 157 ASN H CG +2725 O OD1 . ASN B 159 ? 0.3864 0.5174 0.5750 0.0189 0.0454 -0.0983 157 ASN H OD1 +2726 N ND2 . ASN B 159 ? 0.3416 0.4799 0.5643 0.0286 0.0322 -0.0830 157 ASN H ND2 +2727 N N . SER B 160 ? 0.3761 0.4688 0.5699 0.0270 0.0555 -0.1122 158 SER H N +2728 C CA . SER B 160 ? 0.4511 0.5347 0.6575 0.0298 0.0607 -0.1188 158 SER H CA +2729 C C . SER B 160 ? 0.5128 0.5875 0.7346 0.0378 0.0515 -0.1056 158 SER H C +2730 O O . SER B 160 ? 0.5832 0.6532 0.8320 0.0430 0.0555 -0.1087 158 SER H O +2731 C CB . SER B 160 ? 0.4617 0.5519 0.6957 0.0299 0.0742 -0.1350 158 SER H CB +2732 O OG . SER B 160 ? 0.4906 0.5925 0.7118 0.0219 0.0825 -0.1461 158 SER H OG +2733 N N . GLY B 161 ? 0.4359 0.5091 0.6418 0.0385 0.0394 -0.0907 159 GLY H N +2734 C CA . GLY B 161 ? 0.4084 0.4756 0.6246 0.0445 0.0298 -0.0766 159 GLY H CA +2735 C C . GLY B 161 ? 0.4443 0.5208 0.6880 0.0502 0.0236 -0.0660 159 GLY H C +2736 O O . GLY B 161 ? 0.5309 0.6054 0.7822 0.0543 0.0142 -0.0518 159 GLY H O +2737 N N . ALA B 162 ? 0.3735 0.4617 0.6327 0.0501 0.0283 -0.0718 160 ALA H N +2738 C CA . ALA B 162 ? 0.3868 0.4859 0.6737 0.0553 0.0220 -0.0613 160 ALA H CA +2739 C C . ALA B 162 ? 0.4234 0.5301 0.6911 0.0524 0.0098 -0.0486 160 ALA H C +2740 O O . ALA B 162 ? 0.4374 0.5538 0.7238 0.0559 0.0014 -0.0362 160 ALA H O +2741 C CB . ALA B 162 ? 0.4542 0.5637 0.7653 0.0560 0.0318 -0.0727 160 ALA H CB +2742 N N . LEU B 163 ? 0.4470 0.5507 0.6794 0.0455 0.0088 -0.0514 161 LEU H N +2743 C CA . LEU B 163 ? 0.4199 0.5302 0.6336 0.0415 -0.0010 -0.0422 161 LEU H CA +2744 C C . LEU B 163 ? 0.3574 0.4572 0.5455 0.0393 -0.0070 -0.0361 161 LEU H C +2745 O O . LEU B 163 ? 0.3010 0.3909 0.4669 0.0356 -0.0022 -0.0433 161 LEU H O +2746 C CB . LEU B 163 ? 0.3834 0.4996 0.5816 0.0351 0.0036 -0.0507 161 LEU H CB +2747 C CG . LEU B 163 ? 0.3802 0.5014 0.5575 0.0295 -0.0045 -0.0444 161 LEU H CG +2748 C CD1 . LEU B 163 ? 0.3700 0.5042 0.5638 0.0316 -0.0144 -0.0331 161 LEU H CD1 +2749 C CD2 . LEU B 163 ? 0.3015 0.4269 0.4669 0.0234 0.0017 -0.0531 161 LEU H CD2 +2750 N N . THR B 164 ? 0.3459 0.4489 0.5374 0.0410 -0.0175 -0.0224 162 THR H N +2751 C CA . THR B 164 ? 0.3598 0.4541 0.5280 0.0385 -0.0230 -0.0165 162 THR H CA +2752 C C . THR B 164 ? 0.2838 0.3884 0.4389 0.0339 -0.0334 -0.0071 162 THR H C +2753 O O . THR B 164 ? 0.3581 0.4575 0.4876 0.0289 -0.0357 -0.0069 162 THR H O +2754 C CB . THR B 164 ? 0.4640 0.5507 0.6471 0.0442 -0.0249 -0.0091 162 THR H CB +2755 O OG1 . THR B 164 ? 0.5283 0.6260 0.7417 0.0492 -0.0307 0.0022 162 THR H OG1 +2756 C CG2 . THR B 164 ? 0.4673 0.5418 0.6581 0.0470 -0.0137 -0.0211 162 THR H CG2 +2757 N N . SER B 165 ? 0.2891 0.4092 0.4629 0.0350 -0.0393 0.0004 163 SER H N +2758 C CA . SER B 165 ? 0.3947 0.5279 0.5571 0.0293 -0.0491 0.0084 163 SER H CA +2759 C C . SER B 165 ? 0.3670 0.5004 0.5062 0.0218 -0.0458 -0.0017 163 SER H C +2760 O O . SER B 165 ? 0.3663 0.5005 0.5099 0.0214 -0.0389 -0.0109 163 SER H O +2761 C CB . SER B 165 ? 0.4443 0.5960 0.6337 0.0317 -0.0556 0.0178 163 SER H CB +2762 O OG . SER B 165 ? 0.6544 0.8214 0.8325 0.0249 -0.0654 0.0251 163 SER H OG +2763 N N . GLY B 166 ? 0.3444 0.4772 0.4604 0.0156 -0.0503 0.0000 164 GLY H N +2764 C CA . GLY B 166 ? 0.2998 0.4324 0.3968 0.0083 -0.0474 -0.0087 164 GLY H CA +2765 C C . GLY B 166 ? 0.3490 0.4651 0.4312 0.0077 -0.0383 -0.0185 164 GLY H C +2766 O O . GLY B 166 ? 0.3395 0.4548 0.4098 0.0021 -0.0350 -0.0251 164 GLY H O +2767 N N . VAL B 167 ? 0.2424 0.3459 0.3259 0.0127 -0.0342 -0.0193 165 VAL H N +2768 C CA . VAL B 167 ? 0.2421 0.3320 0.3113 0.0116 -0.0263 -0.0275 165 VAL H CA +2769 C C . VAL B 167 ? 0.3093 0.3907 0.3575 0.0079 -0.0288 -0.0258 165 VAL H C +2770 O O . VAL B 167 ? 0.3653 0.4462 0.4120 0.0090 -0.0345 -0.0187 165 VAL H O +2771 C CB . VAL B 167 ? 0.2851 0.3672 0.3654 0.0174 -0.0205 -0.0305 165 VAL H CB +2772 C CG1 . VAL B 167 ? 0.2496 0.3196 0.3132 0.0152 -0.0138 -0.0375 165 VAL H CG1 +2773 C CG2 . VAL B 167 ? 0.2848 0.3757 0.3873 0.0205 -0.0161 -0.0346 165 VAL H CG2 +2774 N N . HIS B 168 ? 0.2913 0.3665 0.3246 0.0033 -0.0244 -0.0317 166 HIS H N +2775 C CA . HIS B 168 ? 0.2949 0.3600 0.3108 0.0006 -0.0246 -0.0315 166 HIS H CA +2776 C C . HIS B 168 ? 0.3069 0.3615 0.3157 0.0005 -0.0174 -0.0367 166 HIS H C +2777 O O . HIS B 168 ? 0.3491 0.4053 0.3568 -0.0026 -0.0132 -0.0408 166 HIS H O +2778 C CB . HIS B 168 ? 0.2923 0.3618 0.2985 -0.0063 -0.0270 -0.0326 166 HIS H CB +2779 C CG . HIS B 168 ? 0.3070 0.3897 0.3169 -0.0084 -0.0345 -0.0277 166 HIS H CG +2780 N ND1 . HIS B 168 ? 0.3441 0.4282 0.3515 -0.0073 -0.0404 -0.0206 166 HIS H ND1 +2781 C CD2 . HIS B 168 ? 0.3117 0.4082 0.3273 -0.0124 -0.0375 -0.0284 166 HIS H CD2 +2782 C CE1 . HIS B 168 ? 0.3442 0.4438 0.3551 -0.0108 -0.0470 -0.0163 166 HIS H CE1 +2783 N NE2 . HIS B 168 ? 0.3549 0.4623 0.3707 -0.0140 -0.0454 -0.0215 166 HIS H NE2 +2784 N N . THR B 169 ? 0.2542 0.2990 0.2583 0.0033 -0.0163 -0.0360 167 THR H N +2785 C CA . THR B 169 ? 0.2496 0.2860 0.2447 0.0020 -0.0107 -0.0398 167 THR H CA +2786 C C . THR B 169 ? 0.3097 0.3380 0.2909 -0.0008 -0.0123 -0.0378 167 THR H C +2787 O O . THR B 169 ? 0.3903 0.4145 0.3685 0.0009 -0.0158 -0.0344 167 THR H O +2788 C CB . THR B 169 ? 0.3316 0.3641 0.3327 0.0062 -0.0073 -0.0421 167 THR H CB +2789 O OG1 . THR B 169 ? 0.3409 0.3816 0.3572 0.0082 -0.0046 -0.0453 167 THR H OG1 +2790 C CG2 . THR B 169 ? 0.3795 0.4059 0.3698 0.0035 -0.0022 -0.0457 167 THR H CG2 +2791 N N . PHE B 170 ? 0.2901 0.3165 0.2646 -0.0051 -0.0095 -0.0396 168 PHE H N +2792 C CA . PHE B 170 ? 0.2673 0.2875 0.2325 -0.0082 -0.0105 -0.0385 168 PHE H CA +2793 C C . PHE B 170 ? 0.3220 0.3327 0.2799 -0.0072 -0.0086 -0.0376 168 PHE H C +2794 O O . PHE B 170 ? 0.3106 0.3205 0.2692 -0.0058 -0.0056 -0.0386 168 PHE H O +2795 C CB . PHE B 170 ? 0.2955 0.3177 0.2614 -0.0132 -0.0079 -0.0404 168 PHE H CB +2796 C CG . PHE B 170 ? 0.3235 0.3553 0.2954 -0.0156 -0.0103 -0.0421 168 PHE H CG +2797 C CD1 . PHE B 170 ? 0.3545 0.3948 0.3353 -0.0150 -0.0094 -0.0432 168 PHE H CD1 +2798 C CD2 . PHE B 170 ? 0.2861 0.3199 0.2547 -0.0191 -0.0131 -0.0432 168 PHE H CD2 +2799 C CE1 . PHE B 170 ? 0.3052 0.3556 0.2921 -0.0175 -0.0120 -0.0446 168 PHE H CE1 +2800 C CE2 . PHE B 170 ? 0.2753 0.3201 0.2487 -0.0225 -0.0156 -0.0452 168 PHE H CE2 +2801 C CZ . PHE B 170 ? 0.3010 0.3540 0.2838 -0.0214 -0.0154 -0.0455 168 PHE H CZ +2802 N N . PRO B 171 ? 0.3243 0.3287 0.2753 -0.0084 -0.0100 -0.0362 169 PRO H N +2803 C CA . PRO B 171 ? 0.3649 0.3609 0.3097 -0.0080 -0.0081 -0.0351 169 PRO H CA +2804 C C . PRO B 171 ? 0.3329 0.3291 0.2782 -0.0108 -0.0042 -0.0348 169 PRO H C +2805 O O . PRO B 171 ? 0.3527 0.3518 0.3019 -0.0139 -0.0029 -0.0351 169 PRO H O +2806 C CB . PRO B 171 ? 0.3620 0.3531 0.3014 -0.0099 -0.0097 -0.0343 169 PRO H CB +2807 C CG . PRO B 171 ? 0.3792 0.3769 0.3200 -0.0107 -0.0133 -0.0346 169 PRO H CG +2808 C CD . PRO B 171 ? 0.3220 0.3283 0.2706 -0.0109 -0.0131 -0.0361 169 PRO H CD +2809 N N . ALA B 172 ? 0.3420 0.3361 0.2839 -0.0104 -0.0025 -0.0338 170 ALA H N +2810 C CA . ALA B 172 ? 0.3749 0.3711 0.3167 -0.0139 0.0003 -0.0312 170 ALA H CA +2811 C C . ALA B 172 ? 0.4375 0.4281 0.3799 -0.0161 0.0003 -0.0277 170 ALA H C +2812 O O . ALA B 172 ? 0.3999 0.3842 0.3398 -0.0151 -0.0011 -0.0281 170 ALA H O +2813 C CB . ALA B 172 ? 0.3757 0.3732 0.3124 -0.0142 0.0017 -0.0311 170 ALA H CB +2814 N N . VAL B 173 ? 0.3708 0.3641 0.3184 -0.0195 0.0025 -0.0241 171 VAL H N +2815 C CA . VAL B 173 ? 0.3515 0.3397 0.3039 -0.0215 0.0034 -0.0196 171 VAL H CA +2816 C C . VAL B 173 ? 0.3768 0.3678 0.3277 -0.0233 0.0036 -0.0125 171 VAL H C +2817 O O . VAL B 173 ? 0.3183 0.3175 0.2661 -0.0250 0.0042 -0.0111 171 VAL H O +2818 C CB . VAL B 173 ? 0.3604 0.3491 0.3242 -0.0244 0.0057 -0.0195 171 VAL H CB +2819 C CG1 . VAL B 173 ? 0.3806 0.3682 0.3448 -0.0241 0.0051 -0.0271 171 VAL H CG1 +2820 C CG2 . VAL B 173 ? 0.4465 0.4435 0.4144 -0.0267 0.0073 -0.0166 171 VAL H CG2 +2821 N N . LEU B 174 ? 0.3412 0.3269 0.2947 -0.0237 0.0032 -0.0081 172 LEU H N +2822 C CA . LEU B 174 ? 0.3209 0.3107 0.2748 -0.0261 0.0026 0.0006 172 LEU H CA +2823 C C . LEU B 174 ? 0.3337 0.3254 0.3018 -0.0291 0.0043 0.0087 172 LEU H C +2824 O O . LEU B 174 ? 0.3465 0.3309 0.3263 -0.0287 0.0058 0.0088 172 LEU H O +2825 C CB . LEU B 174 ? 0.3471 0.3309 0.2985 -0.0247 0.0010 0.0020 172 LEU H CB +2826 C CG . LEU B 174 ? 0.3848 0.3744 0.3363 -0.0275 -0.0007 0.0116 172 LEU H CG +2827 C CD1 . LEU B 174 ? 0.3654 0.3667 0.3064 -0.0306 -0.0013 0.0120 172 LEU H CD1 +2828 C CD2 . LEU B 174 ? 0.4512 0.4347 0.3998 -0.0257 -0.0023 0.0111 172 LEU H CD2 +2829 N N . GLN B 175 ? 0.3292 0.3309 0.2977 -0.0326 0.0045 0.0150 173 GLN H N +2830 C CA . GLN B 175 ? 0.3965 0.4005 0.3805 -0.0357 0.0060 0.0244 173 GLN H CA +2831 C C . GLN B 175 ? 0.4859 0.4910 0.4777 -0.0373 0.0042 0.0368 173 GLN H C +2832 O O . GLN B 175 ? 0.3859 0.3927 0.3682 -0.0370 0.0015 0.0380 173 GLN H O +2833 C CB . GLN B 175 ? 0.3860 0.4017 0.3678 -0.0394 0.0071 0.0275 173 GLN H CB +2834 C CG . GLN B 175 ? 0.3852 0.4015 0.3592 -0.0375 0.0084 0.0154 173 GLN H CG +2835 C CD . GLN B 175 ? 0.4950 0.5244 0.4638 -0.0413 0.0098 0.0167 173 GLN H CD +2836 O OE1 . GLN B 175 ? 0.5388 0.5714 0.5150 -0.0430 0.0120 0.0169 173 GLN H OE1 +2837 N NE2 . GLN B 175 ? 0.3926 0.4304 0.3488 -0.0432 0.0090 0.0165 173 GLN H NE2 +2838 N N . SER B 176 ? 0.4870 0.4912 0.4981 -0.0391 0.0057 0.0463 174 SER H N +2839 C CA . SER B 176 ? 0.4728 0.4785 0.4961 -0.0404 0.0037 0.0600 174 SER H CA +2840 C C . SER B 176 ? 0.4840 0.5055 0.4971 -0.0450 -0.0003 0.0715 174 SER H C +2841 O O . SER B 176 ? 0.4926 0.5178 0.5097 -0.0461 -0.0035 0.0818 174 SER H O +2842 C CB . SER B 176 ? 0.5248 0.5265 0.5753 -0.0414 0.0067 0.0686 174 SER H CB +2843 O OG . SER B 176 ? 0.5928 0.6017 0.6465 -0.0449 0.0080 0.0729 174 SER H OG +2844 N N . SER B 177 ? 0.4216 0.4536 0.4218 -0.0483 -0.0000 0.0695 175 SER H N +2845 C CA . SER B 177 ? 0.4056 0.4549 0.3922 -0.0541 -0.0029 0.0767 175 SER H CA +2846 C C . SER B 177 ? 0.4399 0.4903 0.4088 -0.0533 -0.0051 0.0688 175 SER H C +2847 O O . SER B 177 ? 0.4912 0.5564 0.4494 -0.0589 -0.0077 0.0743 175 SER H O +2848 C CB . SER B 177 ? 0.4608 0.5202 0.4382 -0.0577 -0.0004 0.0726 175 SER H CB +2849 O OG . SER B 177 ? 0.3951 0.4473 0.3612 -0.0535 0.0020 0.0549 175 SER H OG +2850 N N . GLY B 178 ? 0.3892 0.4254 0.3548 -0.0472 -0.0040 0.0560 176 GLY H N +2851 C CA . GLY B 178 ? 0.3898 0.4257 0.3400 -0.0462 -0.0054 0.0473 176 GLY H CA +2852 C C . GLY B 178 ? 0.4031 0.4419 0.3390 -0.0461 -0.0030 0.0339 176 GLY H C +2853 O O . GLY B 178 ? 0.3768 0.4143 0.3020 -0.0450 -0.0033 0.0254 176 GLY H O +2854 N N . LEU B 179 ? 0.3153 0.3577 0.2529 -0.0470 -0.0003 0.0318 177 LEU H N +2855 C CA . LEU B 179 ? 0.3168 0.3619 0.2449 -0.0464 0.0026 0.0192 177 LEU H CA +2856 C C . LEU B 179 ? 0.3407 0.3727 0.2745 -0.0399 0.0040 0.0103 177 LEU H C +2857 O O . LEU B 179 ? 0.3546 0.3791 0.2995 -0.0380 0.0040 0.0139 177 LEU H O +2858 C CB . LEU B 179 ? 0.2873 0.3478 0.2136 -0.0525 0.0049 0.0223 177 LEU H CB +2859 C CG . LEU B 179 ? 0.3506 0.4282 0.2710 -0.0609 0.0031 0.0333 177 LEU H CG +2860 C CD1 . LEU B 179 ? 0.3621 0.4555 0.2805 -0.0675 0.0060 0.0362 177 LEU H CD1 +2861 C CD2 . LEU B 179 ? 0.3548 0.4373 0.2616 -0.0628 0.0028 0.0252 177 LEU H CD2 +2862 N N . TYR B 180 ? 0.3141 0.3445 0.2415 -0.0371 0.0055 -0.0013 178 TYR H N +2863 C CA . TYR B 180 ? 0.2960 0.3169 0.2277 -0.0315 0.0059 -0.0089 178 TYR H CA +2864 C C . TYR B 180 ? 0.3161 0.3431 0.2524 -0.0324 0.0085 -0.0116 178 TYR H C +2865 O O . TYR B 180 ? 0.3266 0.3653 0.2603 -0.0367 0.0108 -0.0110 178 TYR H O +2866 C CB . TYR B 180 ? 0.3388 0.3550 0.2647 -0.0277 0.0056 -0.0179 178 TYR H CB +2867 C CG . TYR B 180 ? 0.3082 0.3168 0.2305 -0.0263 0.0032 -0.0160 178 TYR H CG +2868 C CD1 . TYR B 180 ? 0.3125 0.3099 0.2383 -0.0224 0.0014 -0.0160 178 TYR H CD1 +2869 C CD2 . TYR B 180 ? 0.3808 0.3949 0.2961 -0.0297 0.0029 -0.0148 178 TYR H CD2 +2870 C CE1 . TYR B 180 ? 0.3917 0.3825 0.3147 -0.0214 -0.0004 -0.0145 178 TYR H CE1 +2871 C CE2 . TYR B 180 ? 0.4082 0.4157 0.3211 -0.0286 0.0006 -0.0131 178 TYR H CE2 +2872 C CZ . TYR B 180 ? 0.4643 0.4598 0.3815 -0.0241 -0.0009 -0.0128 178 TYR H CZ +2873 O OH . TYR B 180 ? 0.4135 0.4030 0.3287 -0.0233 -0.0027 -0.0112 178 TYR H OH +2874 N N . SER B 181 ? 0.3205 0.3409 0.2631 -0.0288 0.0081 -0.0153 179 SER H N +2875 C CA . SER B 181 ? 0.2970 0.3232 0.2449 -0.0292 0.0102 -0.0187 179 SER H CA +2876 C C . SER B 181 ? 0.3587 0.3788 0.3095 -0.0244 0.0085 -0.0254 179 SER H C +2877 O O . SER B 181 ? 0.3461 0.3577 0.2969 -0.0223 0.0062 -0.0253 179 SER H O +2878 C CB . SER B 181 ? 0.3894 0.4184 0.3458 -0.0331 0.0114 -0.0116 179 SER H CB +2879 O OG . SER B 181 ? 0.5509 0.5835 0.5140 -0.0331 0.0130 -0.0155 179 SER H OG +2880 N N . LEU B 182 ? 0.3120 0.3379 0.2656 -0.0230 0.0098 -0.0309 180 LEU H N +2881 C CA . LEU B 182 ? 0.3076 0.3308 0.2649 -0.0186 0.0074 -0.0358 180 LEU H CA +2882 C C . LEU B 182 ? 0.3295 0.3611 0.2949 -0.0192 0.0090 -0.0385 180 LEU H C +2883 O O . LEU B 182 ? 0.3649 0.4045 0.3315 -0.0221 0.0126 -0.0387 180 LEU H O +2884 C CB . LEU B 182 ? 0.4113 0.4323 0.3658 -0.0148 0.0069 -0.0397 180 LEU H CB +2885 C CG . LEU B 182 ? 0.5054 0.5257 0.4657 -0.0098 0.0049 -0.0434 180 LEU H CG +2886 C CD1 . LEU B 182 ? 0.4797 0.4934 0.4364 -0.0069 0.0041 -0.0445 180 LEU H CD1 +2887 C CD2 . LEU B 182 ? 0.4116 0.4410 0.3810 -0.0090 0.0079 -0.0479 180 LEU H CD2 +2888 N N . SER B 183 ? 0.3338 0.3652 0.3044 -0.0172 0.0062 -0.0404 181 SER H N +2889 C CA A SER B 183 ? 0.3624 0.4028 0.3421 -0.0173 0.0069 -0.0432 181 SER H CA +2890 C CA B SER B 183 ? 0.3547 0.3951 0.3344 -0.0173 0.0069 -0.0432 181 SER H CA +2891 C C . SER B 183 ? 0.3224 0.3644 0.3071 -0.0124 0.0037 -0.0457 181 SER H C +2892 O O . SER B 183 ? 0.2970 0.3332 0.2783 -0.0099 -0.0001 -0.0443 181 SER H O +2893 C CB A SER B 183 ? 0.4008 0.4426 0.3852 -0.0209 0.0063 -0.0423 181 SER H CB +2894 C CB B SER B 183 ? 0.4019 0.4436 0.3862 -0.0209 0.0063 -0.0423 181 SER H CB +2895 O OG A SER B 183 ? 0.4346 0.4815 0.4227 -0.0250 0.0104 -0.0407 181 SER H OG +2896 O OG B SER B 183 ? 0.4017 0.4393 0.3845 -0.0201 0.0021 -0.0429 181 SER H OG +2897 N N . SER B 184 ? 0.2734 0.3241 0.2678 -0.0111 0.0054 -0.0487 182 SER H N +2898 C CA . SER B 184 ? 0.2815 0.3359 0.2859 -0.0063 0.0023 -0.0496 182 SER H CA +2899 C C . SER B 184 ? 0.2699 0.3350 0.2851 -0.0076 0.0020 -0.0506 182 SER H C +2900 O O . SER B 184 ? 0.2864 0.3575 0.3053 -0.0100 0.0069 -0.0533 182 SER H O +2901 C CB . SER B 184 ? 0.3211 0.3756 0.3313 -0.0025 0.0059 -0.0532 182 SER H CB +2902 O OG . SER B 184 ? 0.3043 0.3614 0.3278 0.0026 0.0025 -0.0523 182 SER H OG +2903 N N . VAL B 185 ? 0.2904 0.3596 0.3105 -0.0066 -0.0039 -0.0482 183 VAL H N +2904 C CA . VAL B 185 ? 0.3013 0.3820 0.3319 -0.0084 -0.0052 -0.0489 183 VAL H CA +2905 C C . VAL B 185 ? 0.3196 0.4078 0.3637 -0.0036 -0.0100 -0.0463 183 VAL H C +2906 O O . VAL B 185 ? 0.3265 0.4104 0.3706 0.0003 -0.0135 -0.0427 183 VAL H O +2907 C CB . VAL B 185 ? 0.2881 0.3700 0.3129 -0.0141 -0.0080 -0.0485 183 VAL H CB +2908 C CG1 . VAL B 185 ? 0.3214 0.3954 0.3374 -0.0183 -0.0031 -0.0497 183 VAL H CG1 +2909 C CG2 . VAL B 185 ? 0.2688 0.3484 0.2870 -0.0138 -0.0144 -0.0453 183 VAL H CG2 +2910 N N . VAL B 186 ? 0.2887 0.3889 0.3461 -0.0040 -0.0104 -0.0472 184 VAL H N +2911 C CA . VAL B 186 ? 0.2575 0.3677 0.3307 -0.0002 -0.0161 -0.0428 184 VAL H CA +2912 C C . VAL B 186 ? 0.3174 0.4411 0.3968 -0.0046 -0.0190 -0.0430 184 VAL H C +2913 O O . VAL B 186 ? 0.2773 0.4028 0.3557 -0.0086 -0.0140 -0.0479 184 VAL H O +2914 C CB . VAL B 186 ? 0.3010 0.4127 0.3919 0.0061 -0.0118 -0.0446 184 VAL H CB +2915 C CG1 . VAL B 186 ? 0.2809 0.3978 0.3780 0.0041 -0.0039 -0.0518 184 VAL H CG1 +2916 C CG2 . VAL B 186 ? 0.2973 0.4190 0.4082 0.0108 -0.0184 -0.0378 184 VAL H CG2 +2917 N N . THR B 187 ? 0.2707 0.4046 0.3559 -0.0048 -0.0273 -0.0371 185 THR H N +2918 C CA . THR B 187 ? 0.2567 0.4063 0.3503 -0.0091 -0.0309 -0.0371 185 THR H CA +2919 C C . THR B 187 ? 0.2995 0.4614 0.4169 -0.0036 -0.0338 -0.0325 185 THR H C +2920 O O . THR B 187 ? 0.2953 0.4566 0.4214 0.0021 -0.0375 -0.0258 185 THR H O +2921 C CB . THR B 187 ? 0.3267 0.4828 0.4093 -0.0155 -0.0385 -0.0344 185 THR H CB +2922 O OG1 . THR B 187 ? 0.3255 0.4832 0.4082 -0.0122 -0.0455 -0.0257 185 THR H OG1 +2923 C CG2 . THR B 187 ? 0.2904 0.4344 0.3534 -0.0212 -0.0342 -0.0404 185 THR H CG2 +2924 N N . VAL B 188 ? 0.2578 0.4305 0.3876 -0.0054 -0.0315 -0.0359 186 VAL H N +2925 C CA . VAL B 188 ? 0.2759 0.4606 0.4318 -0.0001 -0.0323 -0.0331 186 VAL H CA +2926 C C . VAL B 188 ? 0.2660 0.4685 0.4301 -0.0054 -0.0366 -0.0327 186 VAL H C +2927 O O . VAL B 188 ? 0.2866 0.4895 0.4363 -0.0131 -0.0361 -0.0374 186 VAL H O +2928 C CB . VAL B 188 ? 0.3085 0.4870 0.4738 0.0039 -0.0215 -0.0405 186 VAL H CB +2929 C CG1 . VAL B 188 ? 0.2955 0.4576 0.4525 0.0082 -0.0170 -0.0420 186 VAL H CG1 +2930 C CG2 . VAL B 188 ? 0.2870 0.4651 0.4428 -0.0025 -0.0145 -0.0486 186 VAL H CG2 +2931 N N . PRO B 189 ? 0.3174 0.5353 0.5060 -0.0019 -0.0407 -0.0275 187 PRO H N +2932 C CA . PRO B 189 ? 0.3094 0.5453 0.5072 -0.0073 -0.0439 -0.0282 187 PRO H CA +2933 C C . PRO B 189 ? 0.3368 0.5695 0.5338 -0.0104 -0.0337 -0.0389 187 PRO H C +2934 O O . PRO B 189 ? 0.3245 0.5493 0.5277 -0.0060 -0.0247 -0.0437 187 PRO H O +2935 C CB . PRO B 189 ? 0.3486 0.5998 0.5769 -0.0009 -0.0492 -0.0196 187 PRO H CB +2936 C CG . PRO B 189 ? 0.3701 0.6129 0.6016 0.0061 -0.0524 -0.0114 187 PRO H CG +2937 C CD . PRO B 189 ? 0.3267 0.5469 0.5370 0.0068 -0.0436 -0.0194 187 PRO H CD +2938 N N . SER B 190 ? 0.2752 0.5149 0.4646 -0.0189 -0.0347 -0.0428 188 SER H N +2939 C CA . SER B 190 ? 0.3447 0.5821 0.5340 -0.0226 -0.0253 -0.0514 188 SER H CA +2940 C C . SER B 190 ? 0.2846 0.5326 0.4990 -0.0182 -0.0211 -0.0525 188 SER H C +2941 O O . SER B 190 ? 0.3083 0.5511 0.5237 -0.0183 -0.0110 -0.0590 188 SER H O +2942 C CB . SER B 190 ? 0.4106 0.6550 0.5924 -0.0326 -0.0274 -0.0551 188 SER H CB +2943 O OG . SER B 190 ? 0.5268 0.7910 0.7199 -0.0351 -0.0371 -0.0506 188 SER H OG +2944 N N . SER B 191 ? 0.2334 0.4971 0.4689 -0.0147 -0.0285 -0.0459 189 SER H N +2945 C CA . SER B 191 ? 0.2405 0.5150 0.5038 -0.0099 -0.0243 -0.0469 189 SER H CA +2946 C C . SER B 191 ? 0.2541 0.5172 0.5255 -0.0019 -0.0157 -0.0499 189 SER H C +2947 O O . SER B 191 ? 0.3086 0.5783 0.6017 0.0014 -0.0089 -0.0541 189 SER H O +2948 C CB . SER B 191 ? 0.2780 0.5728 0.5643 -0.0077 -0.0353 -0.0371 189 SER H CB +2949 O OG . SER B 191 ? 0.4112 0.7026 0.7008 -0.0015 -0.0421 -0.0276 189 SER H OG +2950 N N . SER B 192 ? 0.2423 0.4892 0.4974 0.0008 -0.0154 -0.0487 190 SER H N +2951 C CA . SER B 192 ? 0.3570 0.5924 0.6171 0.0071 -0.0069 -0.0530 190 SER H CA +2952 C C . SER B 192 ? 0.4083 0.6338 0.6523 0.0030 0.0049 -0.0635 190 SER H C +2953 O O . SER B 192 ? 0.3618 0.5823 0.6123 0.0065 0.0138 -0.0696 190 SER H O +2954 C CB . SER B 192 ? 0.4894 0.7121 0.7387 0.0110 -0.0121 -0.0469 190 SER H CB +2955 O OG . SER B 192 ? 0.5789 0.8111 0.8485 0.0162 -0.0215 -0.0361 190 SER H OG +2956 N N . LEU B 193 ? 0.3263 0.5497 0.5502 -0.0048 0.0053 -0.0654 191 LEU H N +2957 C CA . LEU B 193 ? 0.3893 0.6038 0.5971 -0.0092 0.0153 -0.0723 191 LEU H CA +2958 C C . LEU B 193 ? 0.4522 0.6758 0.6760 -0.0094 0.0256 -0.0797 191 LEU H C +2959 O O . LEU B 193 ? 0.4784 0.6964 0.6937 -0.0109 0.0349 -0.0857 191 LEU H O +2960 C CB . LEU B 193 ? 0.3154 0.5273 0.5048 -0.0174 0.0137 -0.0716 191 LEU H CB +2961 C CG . LEU B 193 ? 0.3788 0.5807 0.5503 -0.0183 0.0056 -0.0666 191 LEU H CG +2962 C CD1 . LEU B 193 ? 0.3697 0.5704 0.5289 -0.0267 0.0048 -0.0674 191 LEU H CD1 +2963 C CD2 . LEU B 193 ? 0.4100 0.5962 0.5667 -0.0151 0.0081 -0.0665 191 LEU H CD2 +2964 N N . GLY B 194 ? 0.5317 0.7707 0.7785 -0.0085 0.0243 -0.0796 192 GLY H N +2965 C CA . GLY B 194 ? 0.6157 0.8644 0.8799 -0.0087 0.0347 -0.0873 192 GLY H CA +2966 C C . GLY B 194 ? 0.5512 0.8026 0.8397 -0.0007 0.0390 -0.0908 192 GLY H C +2967 O O . GLY B 194 ? 0.5292 0.7880 0.8319 -0.0012 0.0497 -0.0994 192 GLY H O +2968 N N . THR B 195 ? 0.4206 0.6666 0.7160 0.0062 0.0317 -0.0846 193 THR H N +2969 C CA . THR B 195 ? 0.4403 0.6890 0.7651 0.0144 0.0353 -0.0867 193 THR H CA +2970 C C . THR B 195 ? 0.3795 0.6130 0.6973 0.0184 0.0385 -0.0892 193 THR H C +2971 O O . THR B 195 ? 0.3723 0.6065 0.7137 0.0237 0.0459 -0.0953 193 THR H O +2972 C CB . THR B 195 ? 0.4335 0.6929 0.7839 0.0201 0.0237 -0.0754 193 THR H CB +2973 O OG1 . THR B 195 ? 0.4436 0.6949 0.7777 0.0211 0.0120 -0.0647 193 THR H OG1 +2974 C CG2 . THR B 195 ? 0.4071 0.6832 0.7655 0.0156 0.0198 -0.0731 193 THR H CG2 +2975 N N . GLN B 196 ? 0.3326 0.5529 0.6209 0.0160 0.0339 -0.0853 194 GLN H N +2976 C CA . GLN B 196 ? 0.3496 0.5556 0.6311 0.0196 0.0357 -0.0866 194 GLN H CA +2977 C C . GLN B 196 ? 0.3702 0.5663 0.6207 0.0130 0.0424 -0.0934 194 GLN H C +2978 O O . GLN B 196 ? 0.3844 0.5788 0.6118 0.0068 0.0393 -0.0903 194 GLN H O +2979 C CB . GLN B 196 ? 0.4325 0.6322 0.7095 0.0235 0.0227 -0.0739 194 GLN H CB +2980 C CG . GLN B 196 ? 0.5055 0.6894 0.7725 0.0266 0.0238 -0.0743 194 GLN H CG +2981 C CD . GLN B 196 ? 0.5257 0.7087 0.8231 0.0339 0.0300 -0.0786 194 GLN H CD +2982 O OE1 . GLN B 196 ? 0.5144 0.7059 0.8425 0.0399 0.0259 -0.0723 194 GLN H OE1 +2983 N NE2 . GLN B 196 ? 0.4856 0.6590 0.7763 0.0331 0.0400 -0.0893 194 GLN H NE2 +2984 N N . THR B 197 ? 0.2988 0.4891 0.5503 0.0140 0.0517 -0.1025 195 THR H N +2985 C CA . THR B 197 ? 0.2830 0.4651 0.5056 0.0077 0.0570 -0.1075 195 THR H CA +2986 C C . THR B 197 ? 0.3337 0.5008 0.5383 0.0098 0.0493 -0.1004 195 THR H C +2987 O O . THR B 197 ? 0.3358 0.4974 0.5539 0.0166 0.0452 -0.0968 195 THR H O +2988 C CB . THR B 197 ? 0.4112 0.5962 0.6417 0.0061 0.0708 -0.1217 195 THR H CB +2989 O OG1 . THR B 197 ? 0.3939 0.5938 0.6463 0.0052 0.0780 -0.1285 195 THR H OG1 +2990 C CG2 . THR B 197 ? 0.5023 0.6844 0.7024 -0.0027 0.0763 -0.1262 195 THR H CG2 +2991 N N . TYR B 198 ? 0.3405 0.5012 0.5162 0.0038 0.0475 -0.0977 196 TYR H N +2992 C CA . TYR B 198 ? 0.2778 0.4248 0.4347 0.0048 0.0409 -0.0914 196 TYR H CA +2993 C C . TYR B 198 ? 0.2870 0.4281 0.4234 -0.0004 0.0477 -0.0971 196 TYR H C +2994 O O . TYR B 198 ? 0.3668 0.5119 0.4887 -0.0075 0.0513 -0.0981 196 TYR H O +2995 C CB . TYR B 198 ? 0.2723 0.4175 0.4157 0.0024 0.0313 -0.0818 196 TYR H CB +2996 C CG . TYR B 198 ? 0.2639 0.4167 0.4258 0.0065 0.0234 -0.0756 196 TYR H CG +2997 C CD1 . TYR B 198 ? 0.2920 0.4413 0.4646 0.0130 0.0169 -0.0697 196 TYR H CD1 +2998 C CD2 . TYR B 198 ? 0.2705 0.4354 0.4406 0.0036 0.0224 -0.0750 196 TYR H CD2 +2999 C CE1 . TYR B 198 ? 0.2370 0.3962 0.4275 0.0162 0.0088 -0.0622 196 TYR H CE1 +3000 C CE2 . TYR B 198 ? 0.3009 0.4753 0.4885 0.0067 0.0145 -0.0689 196 TYR H CE2 +3001 C CZ . TYR B 198 ? 0.2460 0.4180 0.4432 0.0129 0.0075 -0.0620 196 TYR H CZ +3002 O OH . TYR B 198 ? 0.2890 0.4727 0.5037 0.0153 -0.0013 -0.0540 196 TYR H OH +3003 N N . ILE B 199 ? 0.2793 0.4119 0.4158 0.0028 0.0493 -0.1002 197 ILE H N +3004 C CA . ILE B 199 ? 0.2805 0.4089 0.3986 -0.0023 0.0553 -0.1060 197 ILE H CA +3005 C C . ILE B 199 ? 0.3154 0.4295 0.4209 0.0005 0.0485 -0.0999 197 ILE H C +3006 O O . ILE B 199 ? 0.3577 0.4659 0.4769 0.0072 0.0451 -0.0981 197 ILE H O +3007 C CB . ILE B 199 ? 0.3149 0.4489 0.4471 -0.0027 0.0668 -0.1199 197 ILE H CB +3008 C CG1 . ILE B 199 ? 0.3695 0.5187 0.5161 -0.0056 0.0743 -0.1268 197 ILE H CG1 +3009 C CG2 . ILE B 199 ? 0.3608 0.4931 0.4722 -0.0095 0.0724 -0.1260 197 ILE H CG2 +3010 C CD1 . ILE B 199 ? 0.4151 0.5701 0.5849 -0.0040 0.0856 -0.1412 197 ILE H CD1 +3011 N N . CYS B 200 ? 0.3188 0.4282 0.4003 -0.0047 0.0467 -0.0961 198 CYS H N +3012 C CA . CYS B 200 ? 0.2833 0.3799 0.3522 -0.0030 0.0418 -0.0917 198 CYS H CA +3013 C C . CYS B 200 ? 0.3288 0.4246 0.3908 -0.0063 0.0491 -0.1004 198 CYS H C +3014 O O . CYS B 200 ? 0.3614 0.4660 0.4143 -0.0135 0.0556 -0.1055 198 CYS H O +3015 C CB . CYS B 200 ? 0.4303 0.5219 0.4799 -0.0063 0.0354 -0.0823 198 CYS H CB +3016 S SG . CYS B 200 ? 0.5219 0.6179 0.5514 -0.0157 0.0402 -0.0824 198 CYS H SG +3017 N N . ASN B 201 ? 0.3488 0.4354 0.4159 -0.0018 0.0482 -0.1021 199 ASN H N +3018 C CA . ASN B 201 ? 0.4199 0.5055 0.4837 -0.0047 0.0553 -0.1119 199 ASN H CA +3019 C C . ASN B 201 ? 0.4382 0.5135 0.4819 -0.0060 0.0497 -0.1054 199 ASN H C +3020 O O . ASN B 201 ? 0.4273 0.4918 0.4736 -0.0003 0.0431 -0.0988 199 ASN H O +3021 C CB . ASN B 201 ? 0.4207 0.5034 0.5098 0.0014 0.0596 -0.1197 199 ASN H CB +3022 C CG . ASN B 201 ? 0.4776 0.5674 0.5922 0.0062 0.0608 -0.1205 199 ASN H CG +3023 O OD1 . ASN B 201 ? 0.4407 0.5260 0.5701 0.0135 0.0539 -0.1121 199 ASN H OD1 +3024 N ND2 . ASN B 201 ? 0.4019 0.5044 0.5224 0.0017 0.0697 -0.1302 199 ASN H ND2 +3025 N N . VAL B 202 ? 0.3993 0.4791 0.4235 -0.0138 0.0520 -0.1062 200 VAL H N +3026 C CA . VAL B 202 ? 0.3616 0.4333 0.3673 -0.0157 0.0467 -0.0992 200 VAL H CA +3027 C C . VAL B 202 ? 0.4318 0.5043 0.4328 -0.0196 0.0523 -0.1084 200 VAL H C +3028 O O . VAL B 202 ? 0.4769 0.5615 0.4761 -0.0263 0.0603 -0.1181 200 VAL H O +3029 C CB . VAL B 202 ? 0.3635 0.4401 0.3527 -0.0217 0.0441 -0.0906 200 VAL H CB +3030 C CG1 . VAL B 202 ? 0.3686 0.4370 0.3422 -0.0232 0.0388 -0.0831 200 VAL H CG1 +3031 C CG2 . VAL B 202 ? 0.3299 0.4065 0.3260 -0.0187 0.0397 -0.0835 200 VAL H CG2 +3032 N N . ASN B 203 ? 0.4348 0.4954 0.4337 -0.0161 0.0485 -0.1062 201 ASN H N +3033 C CA . ASN B 203 ? 0.4575 0.5180 0.4524 -0.0199 0.0532 -0.1152 201 ASN H CA +3034 C C . ASN B 203 ? 0.4668 0.5209 0.4431 -0.0221 0.0469 -0.1064 201 ASN H C +3035 O O . ASN B 203 ? 0.4785 0.5212 0.4542 -0.0165 0.0396 -0.0968 201 ASN H O +3036 C CB . ASN B 203 ? 0.6100 0.6621 0.6259 -0.0134 0.0561 -0.1226 201 ASN H CB +3037 C CG . ASN B 203 ? 0.8380 0.8914 0.8531 -0.0183 0.0631 -0.1353 201 ASN H CG +3038 O OD1 . ASN B 203 ? 0.9010 0.9642 0.8989 -0.0274 0.0660 -0.1393 201 ASN H OD1 +3039 N ND2 . ASN B 203 ? 0.8848 0.9294 0.9197 -0.0129 0.0659 -0.1414 201 ASN H ND2 +3040 N N . HIS B 204 ? 0.4577 0.5209 0.4192 -0.0308 0.0498 -0.1095 202 HIS H N +3041 C CA . HIS B 204 ? 0.4666 0.5262 0.4123 -0.0337 0.0445 -0.1018 202 HIS H CA +3042 C C . HIS B 204 ? 0.4930 0.5564 0.4359 -0.0390 0.0498 -0.1133 202 HIS H C +3043 O O . HIS B 204 ? 0.4547 0.5334 0.3884 -0.0485 0.0548 -0.1195 202 HIS H O +3044 C CB . HIS B 204 ? 0.4250 0.4944 0.3562 -0.0401 0.0417 -0.0917 202 HIS H CB +3045 C CG . HIS B 204 ? 0.4600 0.5258 0.3784 -0.0424 0.0357 -0.0819 202 HIS H CG +3046 N ND1 . HIS B 204 ? 0.4567 0.5357 0.3617 -0.0519 0.0362 -0.0795 202 HIS H ND1 +3047 C CD2 . HIS B 204 ? 0.4102 0.4620 0.3280 -0.0369 0.0293 -0.0737 202 HIS H CD2 +3048 C CE1 . HIS B 204 ? 0.4491 0.5217 0.3476 -0.0514 0.0300 -0.0697 202 HIS H CE1 +3049 N NE2 . HIS B 204 ? 0.4403 0.4961 0.3464 -0.0423 0.0263 -0.0668 202 HIS H NE2 +3050 N N . LYS B 205 ? 0.4702 0.5207 0.4215 -0.0336 0.0490 -0.1164 203 LYS H N +3051 C CA . LYS B 205 ? 0.6038 0.6568 0.5562 -0.0383 0.0550 -0.1294 203 LYS H CA +3052 C C . LYS B 205 ? 0.5233 0.5843 0.4556 -0.0473 0.0529 -0.1268 203 LYS H C +3053 O O . LYS B 205 ? 0.5406 0.6130 0.4692 -0.0558 0.0593 -0.1392 203 LYS H O +3054 C CB . LYS B 205 ? 0.7492 0.7857 0.7174 -0.0302 0.0543 -0.1316 203 LYS H CB +3055 C CG . LYS B 205 ? 0.9588 0.9864 0.9464 -0.0202 0.0528 -0.1277 203 LYS H CG +3056 C CD . LYS B 205 ? 1.0696 1.0808 1.0688 -0.0124 0.0489 -0.1231 203 LYS H CD +3057 C CE . LYS B 205 ? 1.0820 1.0858 1.0643 -0.0119 0.0402 -0.1104 203 LYS H CE +3058 N NZ . LYS B 205 ? 1.0293 1.0274 1.0115 -0.0057 0.0325 -0.0969 203 LYS H NZ +3059 N N . PRO B 206 ? 0.5376 0.5947 0.4580 -0.0465 0.0444 -0.1118 204 PRO H N +3060 C CA . PRO B 206 ? 0.5568 0.6237 0.4605 -0.0554 0.0422 -0.1085 204 PRO H CA +3061 C C . PRO B 206 ? 0.6177 0.7069 0.5102 -0.0667 0.0459 -0.1109 204 PRO H C +3062 O O . PRO B 206 ? 0.6065 0.7084 0.4878 -0.0762 0.0469 -0.1143 204 PRO H O +3063 C CB . PRO B 206 ? 0.4814 0.5390 0.3797 -0.0508 0.0329 -0.0911 204 PRO H CB +3064 C CG . PRO B 206 ? 0.4823 0.5221 0.3935 -0.0398 0.0309 -0.0896 204 PRO H CG +3065 C CD . PRO B 206 ? 0.4461 0.4887 0.3694 -0.0376 0.0367 -0.0986 204 PRO H CD +3066 N N . SER B 207 ? 0.5606 0.6566 0.4556 -0.0669 0.0480 -0.1092 205 SER H N +3067 C CA . SER B 207 ? 0.5035 0.6222 0.3882 -0.0784 0.0523 -0.1118 205 SER H CA +3068 C C . SER B 207 ? 0.5039 0.6315 0.3972 -0.0817 0.0632 -0.1307 205 SER H C +3069 O O . SER B 207 ? 0.5071 0.6548 0.3925 -0.0918 0.0681 -0.1346 205 SER H O +3070 C CB . SER B 207 ? 0.5611 0.6843 0.4423 -0.0784 0.0479 -0.0964 205 SER H CB +3071 O OG . SER B 207 ? 0.4543 0.5683 0.3494 -0.0701 0.0496 -0.0980 205 SER H OG +3072 N N . ASN B 208 ? 0.5731 0.6867 0.4838 -0.0737 0.0673 -0.1419 206 ASN H N +3073 C CA . ASN B 208 ? 0.6120 0.7313 0.5374 -0.0747 0.0781 -0.1596 206 ASN H CA +3074 C C . ASN B 208 ? 0.5842 0.7135 0.5111 -0.0757 0.0803 -0.1567 206 ASN H C +3075 O O . ASN B 208 ? 0.6103 0.7566 0.5374 -0.0839 0.0894 -0.1689 206 ASN H O +3076 C CB . ASN B 208 ? 0.7565 0.8908 0.6777 -0.0863 0.0863 -0.1757 206 ASN H CB +3077 C CG . ASN B 208 ? 1.0038 1.1249 0.9437 -0.0815 0.0907 -0.1883 206 ASN H CG +3078 O OD1 . ASN B 208 ? 1.0798 1.1964 1.0417 -0.0769 0.0981 -0.1996 206 ASN H OD1 +3079 N ND2 . ASN B 208 ? 1.1167 1.2314 1.0501 -0.0824 0.0863 -0.1857 206 ASN H ND2 +3080 N N . THR B 209 ? 0.6102 0.7295 0.5389 -0.0678 0.0725 -0.1410 207 THR H N +3081 C CA . THR B 209 ? 0.5808 0.7078 0.5118 -0.0680 0.0734 -0.1362 207 THR H CA +3082 C C . THR B 209 ? 0.5328 0.6465 0.4856 -0.0563 0.0736 -0.1380 207 THR H C +3083 O O . THR B 209 ? 0.5457 0.6423 0.5050 -0.0470 0.0670 -0.1310 207 THR H O +3084 C CB . THR B 209 ? 0.6193 0.7472 0.5368 -0.0693 0.0645 -0.1168 207 THR H CB +3085 O OG1 . THR B 209 ? 0.6717 0.8150 0.5708 -0.0808 0.0640 -0.1133 207 THR H OG1 +3086 C CG2 . THR B 209 ? 0.5414 0.6756 0.4636 -0.0691 0.0655 -0.1117 207 THR H CG2 +3087 N N . LYS B 210 ? 0.4991 0.6222 0.4635 -0.0574 0.0810 -0.1470 208 LYS H N +3088 C CA . LYS B 210 ? 0.5190 0.6333 0.5047 -0.0473 0.0807 -0.1467 208 LYS H CA +3089 C C . LYS B 210 ? 0.5183 0.6451 0.5038 -0.0506 0.0827 -0.1437 208 LYS H C +3090 O O . LYS B 210 ? 0.5145 0.6586 0.4942 -0.0602 0.0906 -0.1520 208 LYS H O +3091 C CB . LYS B 210 ? 0.6019 0.7133 0.6110 -0.0434 0.0892 -0.1630 208 LYS H CB +3092 C CG . LYS B 210 ? 0.7371 0.8364 0.7493 -0.0406 0.0885 -0.1673 208 LYS H CG +3093 C CD . LYS B 210 ? 0.8654 0.9661 0.9007 -0.0403 0.0999 -0.1865 208 LYS H CD +3094 C CE . LYS B 210 ? 0.9013 0.9835 0.9606 -0.0283 0.0968 -0.1839 208 LYS H CE +3095 N NZ . LYS B 210 ? 0.9233 1.0070 1.0150 -0.0244 0.1067 -0.1976 208 LYS H NZ +3096 N N . VAL B 211 ? 0.4669 0.5859 0.4579 -0.0436 0.0757 -0.1320 209 VAL H N +3097 C CA . VAL B 211 ? 0.4700 0.5990 0.4618 -0.0461 0.0765 -0.1274 209 VAL H CA +3098 C C . VAL B 211 ? 0.5089 0.6313 0.5227 -0.0365 0.0750 -0.1273 209 VAL H C +3099 O O . VAL B 211 ? 0.4888 0.5972 0.5084 -0.0282 0.0675 -0.1204 209 VAL H O +3100 C CB . VAL B 211 ? 0.4949 0.6230 0.4697 -0.0491 0.0686 -0.1110 209 VAL H CB +3101 C CG1 . VAL B 211 ? 0.5506 0.6902 0.5273 -0.0530 0.0707 -0.1071 209 VAL H CG1 +3102 C CG2 . VAL B 211 ? 0.5157 0.6502 0.4706 -0.0579 0.0684 -0.1084 209 VAL H CG2 +3103 N N . ASP B 212 ? 0.4474 0.5815 0.4735 -0.0382 0.0819 -0.1346 210 ASP H N +3104 C CA . ASP B 212 ? 0.4771 0.6089 0.5234 -0.0306 0.0798 -0.1323 210 ASP H CA +3105 C C . ASP B 212 ? 0.4968 0.6375 0.5361 -0.0351 0.0783 -0.1245 210 ASP H C +3106 O O . ASP B 212 ? 0.6304 0.7856 0.6631 -0.0438 0.0854 -0.1291 210 ASP H O +3107 C CB . ASP B 212 ? 0.5099 0.6479 0.5809 -0.0281 0.0893 -0.1470 210 ASP H CB +3108 C CG . ASP B 212 ? 0.5852 0.7134 0.6682 -0.0231 0.0914 -0.1548 210 ASP H CG +3109 O OD1 . ASP B 212 ? 0.5447 0.6588 0.6240 -0.0175 0.0829 -0.1459 210 ASP H OD1 +3110 O OD2 . ASP B 212 ? 0.6651 0.7999 0.7619 -0.0254 0.1023 -0.1704 210 ASP H OD2 +3111 N N . LYS B 213 ? 0.4145 0.5474 0.4553 -0.0302 0.0695 -0.1130 211 LYS H N +3112 C CA . LYS B 213 ? 0.3902 0.5299 0.4269 -0.0342 0.0679 -0.1055 211 LYS H CA +3113 C C . LYS B 213 ? 0.4382 0.5793 0.4952 -0.0283 0.0660 -0.1054 211 LYS H C +3114 O O . LYS B 213 ? 0.3494 0.4808 0.4139 -0.0210 0.0586 -0.1006 211 LYS H O +3115 C CB . LYS B 213 ? 0.3799 0.5109 0.4003 -0.0356 0.0597 -0.0924 211 LYS H CB +3116 C CG . LYS B 213 ? 0.5108 0.6497 0.5254 -0.0423 0.0600 -0.0849 211 LYS H CG +3117 C CD . LYS B 213 ? 0.6636 0.8179 0.6692 -0.0520 0.0681 -0.0884 211 LYS H CD +3118 C CE . LYS B 213 ? 0.7395 0.9001 0.7371 -0.0593 0.0671 -0.0770 211 LYS H CE +3119 N NZ . LYS B 213 ? 0.7608 0.9241 0.7718 -0.0580 0.0669 -0.0752 211 LYS H NZ +3120 N N . ARG B 214 ? 0.3352 0.4899 0.4013 -0.0319 0.0725 -0.1104 212 ARG H N +3121 C CA . ARG B 214 ? 0.2962 0.4541 0.3810 -0.0274 0.0701 -0.1089 212 ARG H CA +3122 C C . ARG B 214 ? 0.3632 0.5186 0.4396 -0.0295 0.0630 -0.0975 212 ARG H C +3123 O O . ARG B 214 ? 0.4830 0.6413 0.5449 -0.0367 0.0644 -0.0929 212 ARG H O +3124 C CB . ARG B 214 ? 0.4069 0.5806 0.5060 -0.0307 0.0802 -0.1188 212 ARG H CB +3125 C CG . ARG B 214 ? 0.5501 0.7287 0.6696 -0.0264 0.0773 -0.1167 212 ARG H CG +3126 C CD . ARG B 214 ? 0.7599 0.9527 0.9002 -0.0271 0.0874 -0.1280 212 ARG H CD +3127 N NE . ARG B 214 ? 0.9350 1.1400 1.0636 -0.0373 0.0973 -0.1340 212 ARG H NE +3128 C CZ . ARG B 214 ? 1.0798 1.2999 1.2222 -0.0408 0.1072 -0.1435 212 ARG H CZ +3129 N NH1 . ARG B 214 ? 1.1090 1.3417 1.2380 -0.0514 0.1159 -0.1481 212 ARG H NH1 +3130 N NH2 . ARG B 214 ? 1.1175 1.3414 1.2878 -0.0341 0.1081 -0.1477 212 ARG H NH2 +3131 N N . VAL B 215 ? 0.3191 0.4696 0.4056 -0.0236 0.0554 -0.0927 213 VAL H N +3132 C CA . VAL B 215 ? 0.3222 0.4699 0.4028 -0.0257 0.0490 -0.0840 213 VAL H CA +3133 C C . VAL B 215 ? 0.3755 0.5335 0.4741 -0.0250 0.0487 -0.0851 213 VAL H C +3134 O O . VAL B 215 ? 0.3543 0.5140 0.4690 -0.0188 0.0454 -0.0864 213 VAL H O +3135 C CB . VAL B 215 ? 0.3136 0.4481 0.3875 -0.0214 0.0398 -0.0777 213 VAL H CB +3136 C CG1 . VAL B 215 ? 0.3706 0.5030 0.4402 -0.0246 0.0346 -0.0711 213 VAL H CG1 +3137 C CG2 . VAL B 215 ? 0.3444 0.4692 0.4019 -0.0221 0.0403 -0.0768 213 VAL H CG2 +3138 N N . GLU B 216 ? 0.4640 0.6294 0.5611 -0.0314 0.0519 -0.0835 214 GLU H N +3139 C CA . GLU B 216 ? 0.5352 0.7119 0.6494 -0.0318 0.0525 -0.0851 214 GLU H CA +3140 C C . GLU B 216 ? 0.5274 0.7035 0.6373 -0.0371 0.0492 -0.0788 214 GLU H C +3141 O O . GLU B 216 ? 0.4736 0.6425 0.5686 -0.0414 0.0489 -0.0735 214 GLU H O +3142 C CB . GLU B 216 ? 0.5983 0.7884 0.7207 -0.0353 0.0629 -0.0927 214 GLU H CB +3143 C CG . GLU B 216 ? 0.7334 0.9249 0.8389 -0.0420 0.0700 -0.0938 214 GLU H CG +3144 C CD . GLU B 216 ? 0.8559 1.0620 0.9698 -0.0455 0.0810 -0.1038 214 GLU H CD +3145 O OE1 . GLU B 216 ? 0.8589 1.0675 0.9887 -0.0399 0.0840 -0.1125 214 GLU H OE1 +3146 O OE2 . GLU B 216 ? 0.8716 1.0873 0.9775 -0.0541 0.0870 -0.1028 214 GLU H OE2 +3147 N N . PRO B 217 ? 0.6110 0.7950 0.7354 -0.0370 0.0467 -0.0791 215 PRO H N +3148 C CA . PRO B 217 ? 0.7325 0.9171 0.8556 -0.0431 0.0451 -0.0750 215 PRO H CA +3149 C C . PRO B 217 ? 0.8297 1.0197 0.9486 -0.0505 0.0533 -0.0738 215 PRO H C +3150 O O . PRO B 217 ? 0.7909 0.9905 0.9134 -0.0517 0.0606 -0.0782 215 PRO H O +3151 C CB . PRO B 217 ? 0.6881 0.8837 0.8300 -0.0416 0.0418 -0.0773 215 PRO H CB +3152 C CG . PRO B 217 ? 0.6226 0.8199 0.7741 -0.0334 0.0384 -0.0796 215 PRO H CG +3153 C CD . PRO B 217 ? 0.5909 0.7840 0.7357 -0.0314 0.0448 -0.0829 215 PRO H CD +3154 N N . LYS B 218 ? 0.9537 1.1383 1.0662 -0.0561 0.0525 -0.0676 216 LYS H N +3155 C CA . LYS B 218 ? 1.0768 1.2669 1.1867 -0.0638 0.0593 -0.0635 216 LYS H CA +3156 C C . LYS B 218 ? 1.1164 1.3173 1.2417 -0.0681 0.0617 -0.0648 216 LYS H C +3157 O O . LYS B 218 ? 1.1380 1.3405 1.2745 -0.0658 0.0571 -0.0679 216 LYS H O +3158 C CB . LYS B 218 ? 1.0818 1.2604 1.1807 -0.0676 0.0576 -0.0546 216 LYS H CB +3159 C CG . LYS B 218 ? 1.0816 1.2647 1.1711 -0.0740 0.0636 -0.0480 216 LYS H CG +3160 C CD . LYS B 218 ? 1.0754 1.2487 1.1611 -0.0782 0.0618 -0.0371 216 LYS H CD +3161 C CE . LYS B 218 ? 1.0719 1.2418 1.1419 -0.0791 0.0619 -0.0307 216 LYS H CE +3162 N NZ . LYS B 218 ? 1.0867 1.2711 1.1491 -0.0832 0.0682 -0.0322 216 LYS H NZ +3163 N N . SER B 219 ? 1.1164 1.3262 1.2418 -0.0751 0.0691 -0.0619 217 SER H N +3164 C CA . SER B 219 ? 1.0461 1.2668 1.1853 -0.0808 0.0730 -0.0618 217 SER H CA +3165 C C . SER B 219 ? 1.0881 1.3128 1.2438 -0.0781 0.0687 -0.0674 217 SER H C +3166 O O . SER B 219 ? 1.0980 1.3212 1.2611 -0.0821 0.0669 -0.0651 217 SER H O +3167 C CB . SER B 219 ? 0.9626 1.1781 1.0996 -0.0882 0.0741 -0.0516 217 SER H CB +3168 O OG . SER B 219 ? 0.9691 1.1806 1.0909 -0.0907 0.0760 -0.0440 217 SER H OG +3169 N N . ASP C 2 ? 0.4834 0.7107 0.9027 0.0553 0.1228 0.1342 0 ASP L N +3170 C CA . ASP C 2 ? 0.5410 0.7522 0.9298 0.0515 0.1112 0.1234 0 ASP L CA +3171 C C . ASP C 2 ? 0.4879 0.6923 0.8355 0.0395 0.0971 0.1110 0 ASP L C +3172 O O . ASP C 2 ? 0.5084 0.7061 0.8413 0.0362 0.1033 0.1012 0 ASP L O +3173 C CB . ASP C 2 ? 0.5839 0.7678 0.9659 0.0587 0.1278 0.1078 0 ASP L CB +3174 C CG . ASP C 2 ? 0.6871 0.8737 1.1036 0.0693 0.1359 0.1201 0 ASP L CG +3175 O OD1 . ASP C 2 ? 0.6366 0.8476 1.0897 0.0736 0.1343 0.1421 0 ASP L OD1 +3176 O OD2 . ASP C 2 ? 0.6898 0.8547 1.0977 0.0730 0.1439 0.1086 0 ASP L OD2 +3177 N N . ASP C 3 ? 0.3877 0.5937 0.7177 0.0332 0.0788 0.1121 1 ASP L N +3178 C CA . ASP C 3 ? 0.4081 0.6070 0.7015 0.0224 0.0658 0.1016 1 ASP L CA +3179 C C . ASP C 3 ? 0.4552 0.6275 0.7184 0.0228 0.0738 0.0807 1 ASP L C +3180 O O . ASP C 3 ? 0.3931 0.5501 0.6550 0.0290 0.0832 0.0724 1 ASP L O +3181 C CB . ASP C 3 ? 0.4369 0.6401 0.7181 0.0164 0.0475 0.1055 1 ASP L CB +3182 C CG . ASP C 3 ? 0.6271 0.8590 0.9317 0.0123 0.0363 0.1260 1 ASP L CG +3183 O OD1 . ASP C 3 ? 0.6019 0.8518 0.9331 0.0138 0.0416 0.1377 1 ASP L OD1 +3184 O OD2 . ASP C 3 ? 0.7140 0.9515 1.0103 0.0068 0.0222 0.1305 1 ASP L OD2 +3185 N N . ILE C 4 ? 0.4099 0.5774 0.6488 0.0153 0.0697 0.0728 2 ILE L N +3186 C CA . ILE C 4 ? 0.3716 0.5171 0.5797 0.0140 0.0742 0.0551 2 ILE L CA +3187 C C . ILE C 4 ? 0.4234 0.5581 0.6084 0.0111 0.0618 0.0487 2 ILE L C +3188 O O . ILE C 4 ? 0.4175 0.5598 0.5974 0.0054 0.0473 0.0546 2 ILE L O +3189 C CB . ILE C 4 ? 0.3713 0.5165 0.5634 0.0075 0.0743 0.0512 2 ILE L CB +3190 C CG1 . ILE C 4 ? 0.3632 0.5163 0.5772 0.0113 0.0902 0.0552 2 ILE L CG1 +3191 C CG2 . ILE C 4 ? 0.3816 0.5068 0.5390 0.0045 0.0744 0.0354 2 ILE L CG2 +3192 C CD1 . ILE C 4 ? 0.4057 0.5622 0.6096 0.0049 0.0909 0.0547 2 ILE L CD1 +3193 N N . VAL C 5 ? 0.3656 0.4830 0.5370 0.0143 0.0680 0.0363 3 VAL L N +3194 C CA . VAL C 5 ? 0.3993 0.5058 0.5498 0.0124 0.0583 0.0294 3 VAL L CA +3195 C C . VAL C 5 ? 0.3176 0.4108 0.4373 0.0077 0.0574 0.0167 3 VAL L C +3196 O O . VAL C 5 ? 0.3684 0.4545 0.4819 0.0085 0.0689 0.0086 3 VAL L O +3197 C CB . VAL C 5 ? 0.4416 0.5397 0.6013 0.0189 0.0652 0.0261 3 VAL L CB +3198 C CG1 . VAL C 5 ? 0.5127 0.6009 0.6516 0.0165 0.0551 0.0194 3 VAL L CG1 +3199 C CG2 . VAL C 5 ? 0.5640 0.6760 0.7571 0.0244 0.0670 0.0410 3 VAL L CG2 +3200 N N . MET C 6 ? 0.3080 0.3983 0.4088 0.0027 0.0445 0.0154 4 MET L N +3201 C CA . MET C 6 ? 0.3108 0.3896 0.3842 -0.0009 0.0423 0.0057 4 MET L CA +3202 C C . MET C 6 ? 0.4257 0.4938 0.4872 0.0007 0.0394 -0.0020 4 MET L C +3203 O O . MET C 6 ? 0.4347 0.5036 0.4967 0.0005 0.0304 0.0011 4 MET L O +3204 C CB . MET C 6 ? 0.3580 0.4390 0.4194 -0.0072 0.0317 0.0093 4 MET L CB +3205 C CG . MET C 6 ? 0.3189 0.4116 0.3925 -0.0104 0.0329 0.0176 4 MET L CG +3206 S SD . MET C 6 ? 0.4076 0.5001 0.4825 -0.0091 0.0475 0.0144 4 MET L SD +3207 C CE . MET C 6 ? 0.4431 0.5219 0.4862 -0.0127 0.0455 0.0052 4 MET L CE +3208 N N . THR C 7 ? 0.3198 0.3788 0.3700 0.0013 0.0472 -0.0120 5 THR L N +3209 C CA . THR C 7 ? 0.3173 0.3671 0.3563 0.0017 0.0449 -0.0197 5 THR L CA +3210 C C . THR C 7 ? 0.3534 0.3980 0.3674 -0.0027 0.0401 -0.0254 5 THR L C +3211 O O . THR C 7 ? 0.3468 0.3901 0.3507 -0.0052 0.0464 -0.0299 5 THR L O +3212 C CB . THR C 7 ? 0.3759 0.4198 0.4225 0.0046 0.0577 -0.0269 5 THR L CB +3213 O OG1 . THR C 7 ? 0.4022 0.4517 0.4757 0.0099 0.0632 -0.0192 5 THR L OG1 +3214 C CG2 . THR C 7 ? 0.4074 0.4426 0.4431 0.0039 0.0548 -0.0347 5 THR L CG2 +3215 N N . GLN C 8 ? 0.3763 0.4187 0.3812 -0.0036 0.0295 -0.0246 6 GLN L N +3216 C CA . GLN C 8 ? 0.4558 0.4942 0.4403 -0.0067 0.0244 -0.0280 6 GLN L CA +3217 C C . GLN C 8 ? 0.4375 0.4710 0.4144 -0.0068 0.0249 -0.0358 6 GLN L C +3218 O O . GLN C 8 ? 0.4496 0.4813 0.4352 -0.0043 0.0239 -0.0367 6 GLN L O +3219 C CB . GLN C 8 ? 0.4365 0.4745 0.4168 -0.0075 0.0140 -0.0224 6 GLN L CB +3220 C CG . GLN C 8 ? 0.4301 0.4703 0.4079 -0.0102 0.0126 -0.0169 6 GLN L CG +3221 C CD . GLN C 8 ? 0.3632 0.3999 0.3354 -0.0117 0.0043 -0.0133 6 GLN L CD +3222 O OE1 . GLN C 8 ? 0.3737 0.4123 0.3534 -0.0130 0.0010 -0.0093 6 GLN L OE1 +3223 N NE2 . GLN C 8 ? 0.3560 0.3878 0.3152 -0.0118 0.0014 -0.0145 6 GLN L NE2 +3224 N N . SER C 9 ? 0.4273 0.4598 0.3877 -0.0105 0.0258 -0.0406 7 SER L N +3225 C CA . SER C 9 ? 0.5352 0.5651 0.4860 -0.0126 0.0247 -0.0477 7 SER L CA +3226 C C . SER C 9 ? 0.6066 0.6396 0.5398 -0.0162 0.0179 -0.0460 7 SER L C +3227 O O . SER C 9 ? 0.5357 0.5716 0.4618 -0.0181 0.0185 -0.0422 7 SER L O +3228 C CB . SER C 9 ? 0.5269 0.5538 0.4766 -0.0153 0.0363 -0.0574 7 SER L CB +3229 O OG . SER C 9 ? 0.5761 0.6050 0.5185 -0.0184 0.0431 -0.0586 7 SER L OG +3230 N N . PRO C 10 ? 0.6110 0.6445 0.5387 -0.0169 0.0114 -0.0472 8 PRO L N +3231 C CA . PRO C 10 ? 0.4591 0.4893 0.3959 -0.0145 0.0100 -0.0503 8 PRO L CA +3232 C C . PRO C 10 ? 0.4319 0.4608 0.3783 -0.0098 0.0037 -0.0431 8 PRO L C +3233 O O . PRO C 10 ? 0.4923 0.5221 0.4366 -0.0090 0.0002 -0.0367 8 PRO L O +3234 C CB . PRO C 10 ? 0.5323 0.5658 0.4575 -0.0187 0.0054 -0.0537 8 PRO L CB +3235 C CG . PRO C 10 ? 0.5636 0.6028 0.4779 -0.0201 -0.0003 -0.0468 8 PRO L CG +3236 C CD . PRO C 10 ? 0.5766 0.6153 0.4894 -0.0205 0.0054 -0.0449 8 PRO L CD +3237 N N . SER C 11 ? 0.4236 0.4500 0.3795 -0.0073 0.0027 -0.0442 9 SER L N +3238 C CA . SER C 11 ? 0.4359 0.4615 0.3982 -0.0042 -0.0031 -0.0381 9 SER L CA +3239 C C . SER C 11 ? 0.4677 0.4933 0.4220 -0.0042 -0.0100 -0.0357 9 SER L C +3240 O O . SER C 11 ? 0.3512 0.3750 0.3062 -0.0028 -0.0136 -0.0307 9 SER L O +3241 C CB . SER C 11 ? 0.5169 0.5407 0.4915 -0.0019 -0.0018 -0.0388 9 SER L CB +3242 O OG . SER C 11 ? 0.6060 0.6303 0.5915 -0.0009 0.0053 -0.0388 9 SER L OG +3243 N N . PHE C 12 ? 0.4027 0.4308 0.3504 -0.0060 -0.0114 -0.0392 10 PHE L N +3244 C CA . PHE C 12 ? 0.3882 0.4189 0.3307 -0.0056 -0.0175 -0.0355 10 PHE L CA +3245 C C . PHE C 12 ? 0.3859 0.4232 0.3174 -0.0097 -0.0183 -0.0361 10 PHE L C +3246 O O . PHE C 12 ? 0.4018 0.4411 0.3290 -0.0140 -0.0147 -0.0429 10 PHE L O +3247 C CB . PHE C 12 ? 0.4740 0.5045 0.4216 -0.0043 -0.0202 -0.0372 10 PHE L CB +3248 C CG . PHE C 12 ? 0.4945 0.5197 0.4512 -0.0013 -0.0197 -0.0361 10 PHE L CG +3249 C CD1 . PHE C 12 ? 0.5267 0.5500 0.4910 -0.0013 -0.0157 -0.0395 10 PHE L CD1 +3250 C CD2 . PHE C 12 ? 0.4357 0.4581 0.3934 0.0011 -0.0225 -0.0314 10 PHE L CD2 +3251 C CE1 . PHE C 12 ? 0.5525 0.5735 0.5250 0.0008 -0.0162 -0.0367 10 PHE L CE1 +3252 C CE2 . PHE C 12 ? 0.5089 0.5276 0.4724 0.0021 -0.0223 -0.0305 10 PHE L CE2 +3253 C CZ . PHE C 12 ? 0.5794 0.5986 0.5501 0.0018 -0.0200 -0.0325 10 PHE L CZ +3254 N N . LEU C 13 ? 0.3597 0.4003 0.2867 -0.0088 -0.0224 -0.0288 11 LEU L N +3255 C CA . LEU C 13 ? 0.4483 0.4979 0.3647 -0.0130 -0.0245 -0.0265 11 LEU L CA +3256 C C . LEU C 13 ? 0.4072 0.4621 0.3256 -0.0104 -0.0308 -0.0176 11 LEU L C +3257 O O . LEU C 13 ? 0.4413 0.4903 0.3661 -0.0051 -0.0312 -0.0116 11 LEU L O +3258 C CB . LEU C 13 ? 0.4563 0.5055 0.3663 -0.0144 -0.0213 -0.0235 11 LEU L CB +3259 C CG . LEU C 13 ? 0.5870 0.6463 0.4840 -0.0198 -0.0231 -0.0203 11 LEU L CG +3260 C CD1 . LEU C 13 ? 0.6467 0.7123 0.5354 -0.0269 -0.0224 -0.0292 11 LEU L CD1 +3261 C CD2 . LEU C 13 ? 0.5789 0.6365 0.4704 -0.0213 -0.0184 -0.0183 11 LEU L CD2 +3262 N N . SER C 14 ? 0.3684 0.4347 0.2819 -0.0144 -0.0352 -0.0167 12 SER L N +3263 C CA . SER C 14 ? 0.3806 0.4552 0.2984 -0.0117 -0.0412 -0.0062 12 SER L CA +3264 C C . SER C 14 ? 0.4007 0.4871 0.3089 -0.0156 -0.0445 0.0019 12 SER L C +3265 O O . SER C 14 ? 0.4772 0.5699 0.3728 -0.0235 -0.0440 -0.0034 12 SER L O +3266 C CB . SER C 14 ? 0.5162 0.5981 0.4384 -0.0134 -0.0451 -0.0088 12 SER L CB +3267 O OG . SER C 14 ? 0.5074 0.5797 0.4410 -0.0076 -0.0432 -0.0108 12 SER L OG +3268 N N . ALA C 15 ? 0.3496 0.4383 0.2636 -0.0105 -0.0469 0.0149 13 ALA L N +3269 C CA . ALA C 15 ? 0.3462 0.4472 0.2528 -0.0136 -0.0504 0.0256 13 ALA L CA +3270 C C . ALA C 15 ? 0.3910 0.4981 0.3101 -0.0070 -0.0543 0.0412 13 ALA L C +3271 O O . ALA C 15 ? 0.3323 0.4310 0.2649 0.0002 -0.0525 0.0424 13 ALA L O +3272 C CB . ALA C 15 ? 0.4096 0.5025 0.3089 -0.0142 -0.0452 0.0258 13 ALA L CB +3273 N N . SER C 16 ? 0.4070 0.5293 0.3220 -0.0096 -0.0592 0.0539 14 SER L N +3274 C CA . SER C 16 ? 0.3834 0.5144 0.3123 -0.0032 -0.0627 0.0717 14 SER L CA +3275 C C . SER C 16 ? 0.4188 0.5428 0.3495 0.0013 -0.0590 0.0831 14 SER L C +3276 O O . SER C 16 ? 0.4049 0.5272 0.3220 -0.0038 -0.0571 0.0805 14 SER L O +3277 C CB . SER C 16 ? 0.3847 0.5424 0.3101 -0.0099 -0.0724 0.0810 14 SER L CB +3278 O OG . SER C 16 ? 0.4587 0.6222 0.3847 -0.0140 -0.0756 0.0711 14 SER L OG +3279 N N . VAL C 17 ? 0.3886 0.5079 0.3368 0.0108 -0.0568 0.0959 15 VAL L N +3280 C CA . VAL C 17 ? 0.3904 0.5053 0.3430 0.0150 -0.0535 0.1101 15 VAL L CA +3281 C C . VAL C 17 ? 0.4837 0.6195 0.4241 0.0079 -0.0603 0.1209 15 VAL L C +3282 O O . VAL C 17 ? 0.4051 0.5636 0.3444 0.0036 -0.0689 0.1279 15 VAL L O +3283 C CB . VAL C 17 ? 0.4414 0.5528 0.4168 0.0259 -0.0506 0.1246 15 VAL L CB +3284 C CG1 . VAL C 17 ? 0.4428 0.5530 0.4246 0.0302 -0.0477 0.1426 15 VAL L CG1 +3285 C CG2 . VAL C 17 ? 0.4413 0.5290 0.4251 0.0316 -0.0419 0.1127 15 VAL L CG2 +3286 N N . GLY C 18 ? 0.4094 0.5386 0.3400 0.0055 -0.0566 0.1223 16 GLY L N +3287 C CA . GLY C 18 ? 0.5259 0.6733 0.4421 -0.0023 -0.0618 0.1315 16 GLY L CA +3288 C C . GLY C 18 ? 0.5390 0.6900 0.4321 -0.0139 -0.0622 0.1150 16 GLY L C +3289 O O . GLY C 18 ? 0.5267 0.6880 0.4047 -0.0211 -0.0637 0.1198 16 GLY L O +3290 N N . ASP C 19 ? 0.4470 0.5892 0.3374 -0.0157 -0.0601 0.0961 17 ASP L N +3291 C CA . ASP C 19 ? 0.4891 0.6324 0.3603 -0.0258 -0.0583 0.0797 17 ASP L CA +3292 C C . ASP C 19 ? 0.4875 0.6164 0.3518 -0.0263 -0.0500 0.0743 17 ASP L C +3293 O O . ASP C 19 ? 0.4774 0.5906 0.3530 -0.0188 -0.0450 0.0773 17 ASP L O +3294 C CB . ASP C 19 ? 0.4295 0.5651 0.3033 -0.0262 -0.0568 0.0623 17 ASP L CB +3295 C CG . ASP C 19 ? 0.5687 0.7210 0.4441 -0.0299 -0.0649 0.0635 17 ASP L CG +3296 O OD1 . ASP C 19 ? 0.5323 0.7046 0.4066 -0.0329 -0.0725 0.0780 17 ASP L OD1 +3297 O OD2 . ASP C 19 ? 0.5528 0.6992 0.4313 -0.0302 -0.0637 0.0505 17 ASP L OD2 +3298 N N . ARG C 20 ? 0.4797 0.6138 0.3255 -0.0359 -0.0479 0.0654 18 ARG L N +3299 C CA . ARG C 20 ? 0.5149 0.6358 0.3550 -0.0372 -0.0389 0.0562 18 ARG L CA +3300 C C . ARG C 20 ? 0.5585 0.6675 0.4021 -0.0366 -0.0340 0.0379 18 ARG L C +3301 O O . ARG C 20 ? 0.6007 0.7157 0.4376 -0.0422 -0.0355 0.0280 18 ARG L O +3302 C CB . ARG C 20 ? 0.5392 0.6716 0.3583 -0.0477 -0.0374 0.0560 18 ARG L CB +3303 C CG . ARG C 20 ? 0.5973 0.7190 0.4114 -0.0490 -0.0276 0.0500 18 ARG L CG +3304 C CD . ARG C 20 ? 0.7067 0.8416 0.4982 -0.0604 -0.0260 0.0502 18 ARG L CD +3305 N NE . ARG C 20 ? 0.7832 0.9099 0.5695 -0.0622 -0.0160 0.0455 18 ARG L NE +3306 C CZ . ARG C 20 ? 0.8070 0.9251 0.5906 -0.0647 -0.0067 0.0289 18 ARG L CZ +3307 N NH1 . ARG C 20 ? 0.7546 0.8698 0.5398 -0.0657 -0.0061 0.0152 18 ARG L NH1 +3308 N NH2 . ARG C 20 ? 0.7560 0.8686 0.5371 -0.0659 0.0025 0.0268 18 ARG L NH2 +3309 N N . VAL C 21 ? 0.3644 0.4572 0.2191 -0.0304 -0.0284 0.0341 19 VAL L N +3310 C CA . VAL C 21 ? 0.4109 0.4932 0.2725 -0.0285 -0.0245 0.0201 19 VAL L CA +3311 C C . VAL C 21 ? 0.4572 0.5316 0.3167 -0.0303 -0.0158 0.0126 19 VAL L C +3312 O O . VAL C 21 ? 0.4035 0.4743 0.2639 -0.0291 -0.0131 0.0194 19 VAL L O +3313 C CB . VAL C 21 ? 0.4612 0.5332 0.3395 -0.0200 -0.0263 0.0228 19 VAL L CB +3314 C CG1 . VAL C 21 ? 0.4866 0.5475 0.3722 -0.0181 -0.0218 0.0109 19 VAL L CG1 +3315 C CG2 . VAL C 21 ? 0.5839 0.6643 0.4662 -0.0182 -0.0334 0.0275 19 VAL L CG2 +3316 N N . THR C 22 ? 0.4575 0.5293 0.3157 -0.0329 -0.0110 -0.0007 20 THR L N +3317 C CA . THR C 22 ? 0.4468 0.5121 0.3069 -0.0337 -0.0019 -0.0077 20 THR L CA +3318 C C . THR C 22 ? 0.5277 0.5843 0.4019 -0.0294 0.0007 -0.0159 20 THR L C +3319 O O . THR C 22 ? 0.5069 0.5638 0.3820 -0.0300 -0.0004 -0.0230 20 THR L O +3320 C CB . THR C 22 ? 0.6196 0.6909 0.4643 -0.0420 0.0044 -0.0152 20 THR L CB +3321 O OG1 . THR C 22 ? 0.7839 0.8655 0.6140 -0.0470 0.0009 -0.0063 20 THR L OG1 +3322 C CG2 . THR C 22 ? 0.6847 0.7499 0.5340 -0.0418 0.0151 -0.0205 20 THR L CG2 +3323 N N . ILE C 23 ? 0.4294 0.4794 0.3147 -0.0258 0.0040 -0.0142 21 ILE L N +3324 C CA . ILE C 23 ? 0.4084 0.4523 0.3080 -0.0221 0.0062 -0.0193 21 ILE L CA +3325 C C . ILE C 23 ? 0.4472 0.4908 0.3515 -0.0233 0.0153 -0.0227 21 ILE L C +3326 O O . ILE C 23 ? 0.4207 0.4659 0.3219 -0.0251 0.0181 -0.0180 21 ILE L O +3327 C CB . ILE C 23 ? 0.3749 0.4132 0.2844 -0.0177 0.0011 -0.0130 21 ILE L CB +3328 C CG1 . ILE C 23 ? 0.4817 0.5198 0.3892 -0.0155 -0.0062 -0.0100 21 ILE L CG1 +3329 C CG2 . ILE C 23 ? 0.4354 0.4700 0.3588 -0.0154 0.0030 -0.0164 21 ILE L CG2 +3330 C CD1 . ILE C 23 ? 0.5458 0.5771 0.4595 -0.0123 -0.0093 -0.0032 21 ILE L CD1 +3331 N N . THR C 24 ? 0.3770 0.4187 0.2903 -0.0221 0.0207 -0.0301 22 THR L N +3332 C CA . THR C 24 ? 0.3755 0.4178 0.2950 -0.0228 0.0313 -0.0336 22 THR L CA +3333 C C . THR C 24 ? 0.3637 0.4047 0.3037 -0.0181 0.0324 -0.0311 22 THR L C +3334 O O . THR C 24 ? 0.3975 0.4363 0.3452 -0.0151 0.0271 -0.0309 22 THR L O +3335 C CB . THR C 24 ? 0.4819 0.5232 0.3948 -0.0261 0.0397 -0.0444 22 THR L CB +3336 O OG1 . THR C 24 ? 0.5479 0.5932 0.4398 -0.0325 0.0386 -0.0460 22 THR L OG1 +3337 C CG2 . THR C 24 ? 0.5308 0.5711 0.4537 -0.0256 0.0529 -0.0482 22 THR L CG2 +3338 N N . CYS C 25 ? 0.3422 0.3861 0.2910 -0.0181 0.0389 -0.0283 23 CYS L N +3339 C CA . CYS C 25 ? 0.3610 0.4075 0.3308 -0.0146 0.0406 -0.0243 23 CYS L CA +3340 C C . CYS C 25 ? 0.4028 0.4517 0.3815 -0.0142 0.0540 -0.0274 23 CYS L C +3341 O O . CYS C 25 ? 0.4640 0.5146 0.4344 -0.0174 0.0599 -0.0278 23 CYS L O +3342 C CB . CYS C 25 ? 0.4753 0.5245 0.4486 -0.0159 0.0339 -0.0153 23 CYS L CB +3343 S SG . CYS C 25 ? 0.6161 0.6724 0.6136 -0.0142 0.0322 -0.0080 23 CYS L SG +3344 N N . ARG C 26 ? 0.3554 0.4039 0.3508 -0.0102 0.0600 -0.0296 24 ARG L N +3345 C CA . ARG C 26 ? 0.3392 0.3888 0.3470 -0.0086 0.0748 -0.0323 24 ARG L CA +3346 C C . ARG C 26 ? 0.3312 0.3891 0.3664 -0.0040 0.0759 -0.0224 24 ARG L C +3347 O O . ARG C 26 ? 0.3671 0.4269 0.4146 -0.0009 0.0694 -0.0179 24 ARG L O +3348 C CB . ARG C 26 ? 0.4548 0.4962 0.4615 -0.0077 0.0840 -0.0429 24 ARG L CB +3349 C CG . ARG C 26 ? 0.7111 0.7472 0.6936 -0.0142 0.0903 -0.0538 24 ARG L CG +3350 C CD . ARG C 26 ? 0.8452 0.8721 0.8263 -0.0150 0.1005 -0.0657 24 ARG L CD +3351 N NE . ARG C 26 ? 0.9911 1.0147 0.9441 -0.0234 0.0998 -0.0754 24 ARG L NE +3352 C CZ . ARG C 26 ? 1.0698 1.0939 1.0085 -0.0263 0.0871 -0.0760 24 ARG L CZ +3353 N NH1 . ARG C 26 ? 1.0385 1.0641 0.9875 -0.0213 0.0754 -0.0688 24 ARG L NH1 +3354 N NH2 . ARG C 26 ? 1.1119 1.1361 1.0263 -0.0348 0.0864 -0.0834 24 ARG L NH2 +3355 N N . ALA C 27 ? 0.3405 0.4047 0.3857 -0.0041 0.0842 -0.0185 25 ALA L N +3356 C CA . ALA C 27 ? 0.3364 0.4117 0.4101 -0.0002 0.0859 -0.0078 25 ALA L CA +3357 C C . ALA C 27 ? 0.3955 0.4694 0.4893 0.0055 0.1022 -0.0104 25 ALA L C +3358 O O . ALA C 27 ? 0.4229 0.4895 0.5082 0.0045 0.1156 -0.0199 25 ALA L O +3359 C CB . ALA C 27 ? 0.3030 0.3879 0.3800 -0.0036 0.0857 -0.0004 25 ALA L CB +3360 N N . SER C 28 ? 0.3744 0.4554 0.4950 0.0111 0.1017 -0.0014 26 SER L N +3361 C CA . SER C 28 ? 0.4862 0.5647 0.6296 0.0177 0.1182 -0.0025 26 SER L CA +3362 C C . SER C 28 ? 0.4695 0.5538 0.6279 0.0193 0.1336 -0.0001 26 SER L C +3363 O O . SER C 28 ? 0.4245 0.5023 0.5962 0.0239 0.1515 -0.0050 26 SER L O +3364 C CB . SER C 28 ? 0.4996 0.5865 0.6707 0.0238 0.1136 0.0095 26 SER L CB +3365 O OG . SER C 28 ? 0.3965 0.5013 0.5809 0.0224 0.1022 0.0242 26 SER L OG +3366 N N . GLN C 29 ? 0.3989 0.4945 0.5564 0.0156 0.1282 0.0070 27 GLN L N +3367 C CA . GLN C 29 ? 0.3426 0.4440 0.5109 0.0159 0.1424 0.0087 27 GLN L CA +3368 C C . GLN C 29 ? 0.3267 0.4292 0.4700 0.0078 0.1355 0.0068 27 GLN L C +3369 O O . GLN C 29 ? 0.3331 0.4347 0.4582 0.0031 0.1193 0.0076 27 GLN L O +3370 C CB . GLN C 29 ? 0.4131 0.5335 0.6198 0.0211 0.1443 0.0255 27 GLN L CB +3371 C CG . GLN C 29 ? 0.3977 0.5205 0.6342 0.0298 0.1491 0.0323 27 GLN L CG +3372 C CD . GLN C 29 ? 0.4025 0.5491 0.6750 0.0331 0.1443 0.0526 27 GLN L CD +3373 O OE1 . GLN C 29 ? 0.4150 0.5748 0.7002 0.0318 0.1484 0.0599 27 GLN L OE1 +3374 N NE2 . GLN C 29 ? 0.4583 0.6121 0.7473 0.0367 0.1352 0.0626 27 GLN L NE2 +3375 N N . GLY C 30 ? 0.3388 0.4431 0.4824 0.0064 0.1489 0.0049 28 GLY L N +3376 C CA . GLY C 30 ? 0.3929 0.4982 0.5141 -0.0012 0.1439 0.0042 28 GLY L CA +3377 C C . GLY C 30 ? 0.3796 0.4981 0.5082 -0.0045 0.1286 0.0172 28 GLY L C +3378 O O . GLY C 30 ? 0.3217 0.4550 0.4794 -0.0020 0.1297 0.0287 28 GLY L O +3379 N N . ILE C 31 ? 0.3599 0.4735 0.4637 -0.0107 0.1149 0.0157 29 ILE L N +3380 C CA . ILE C 31 ? 0.3370 0.4598 0.4441 -0.0156 0.1012 0.0259 29 ILE L CA +3381 C C . ILE C 31 ? 0.4192 0.5385 0.5051 -0.0225 0.0996 0.0252 29 ILE L C +3382 O O . ILE C 31 ? 0.4947 0.6154 0.5751 -0.0278 0.0876 0.0304 29 ILE L O +3383 C CB . ILE C 31 ? 0.3033 0.4227 0.4045 -0.0162 0.0851 0.0267 29 ILE L CB +3384 C CG1 . ILE C 31 ? 0.3075 0.4110 0.3777 -0.0180 0.0802 0.0168 29 ILE L CG1 +3385 C CG2 . ILE C 31 ? 0.3105 0.4341 0.4328 -0.0096 0.0856 0.0292 29 ILE L CG2 +3386 C CD1 . ILE C 31 ? 0.3730 0.4725 0.4359 -0.0192 0.0651 0.0176 29 ILE L CD1 +3387 N N . SER C 32 ? 0.3466 0.4607 0.4196 -0.0233 0.1118 0.0187 30 SER L N +3388 C CA . SER C 32 ? 0.5124 0.6243 0.5661 -0.0297 0.1118 0.0196 30 SER L CA +3389 C C . SER C 32 ? 0.5230 0.6253 0.5536 -0.0331 0.0973 0.0184 30 SER L C +3390 O O . SER C 32 ? 0.5007 0.5940 0.5165 -0.0312 0.0946 0.0109 30 SER L O +3391 C CB . SER C 32 ? 0.4198 0.5449 0.4926 -0.0328 0.1136 0.0301 30 SER L CB +3392 O OG . SER C 32 ? 0.6028 0.7333 0.6850 -0.0314 0.1307 0.0294 30 SER L OG +3393 N N . SER C 33 ? 0.4467 0.5501 0.4744 -0.0382 0.0887 0.0256 31 SER L N +3394 C CA . SER C 33 ? 0.4209 0.5142 0.4292 -0.0408 0.0769 0.0253 31 SER L CA +3395 C C . SER C 33 ? 0.4232 0.5173 0.4413 -0.0425 0.0649 0.0299 31 SER L C +3396 O O . SER C 33 ? 0.4038 0.4906 0.4110 -0.0464 0.0571 0.0321 31 SER L O +3397 C CB . SER C 33 ? 0.5750 0.6649 0.5674 -0.0460 0.0785 0.0290 31 SER L CB +3398 O OG . SER C 33 ? 0.6968 0.7839 0.6719 -0.0456 0.0865 0.0236 31 SER L OG +3399 N N . TYR C 34 ? 0.4779 0.5810 0.5168 -0.0399 0.0641 0.0316 32 TYR L N +3400 C CA . TYR C 34 ? 0.4927 0.5995 0.5411 -0.0429 0.0529 0.0361 32 TYR L CA +3401 C C . TYR C 34 ? 0.5206 0.6173 0.5577 -0.0401 0.0446 0.0307 32 TYR L C +3402 O O . TYR C 34 ? 0.5056 0.6064 0.5536 -0.0364 0.0422 0.0302 32 TYR L O +3403 C CB . TYR C 34 ? 0.3938 0.5172 0.4700 -0.0414 0.0550 0.0423 32 TYR L CB +3404 C CG . TYR C 34 ? 0.3885 0.5252 0.4807 -0.0455 0.0608 0.0501 32 TYR L CG +3405 C CD1 . TYR C 34 ? 0.4133 0.5527 0.5094 -0.0424 0.0746 0.0492 32 TYR L CD1 +3406 C CD2 . TYR C 34 ? 0.4390 0.5864 0.5424 -0.0534 0.0528 0.0581 32 TYR L CD2 +3407 C CE1 . TYR C 34 ? 0.4878 0.6404 0.6003 -0.0461 0.0806 0.0569 32 TYR L CE1 +3408 C CE2 . TYR C 34 ? 0.4989 0.6601 0.6184 -0.0579 0.0577 0.0658 32 TYR L CE2 +3409 C CZ . TYR C 34 ? 0.5921 0.7561 0.7170 -0.0536 0.0717 0.0656 32 TYR L CZ +3410 O OH . TYR C 34 ? 0.6626 0.8412 0.8050 -0.0579 0.0771 0.0737 32 TYR L OH +3411 N N . LEU C 35 ? 0.4019 0.4857 0.4183 -0.0417 0.0405 0.0277 33 LEU L N +3412 C CA . LEU C 35 ? 0.3030 0.3775 0.3089 -0.0385 0.0339 0.0225 33 LEU L CA +3413 C C . LEU C 35 ? 0.3332 0.3959 0.3238 -0.0420 0.0275 0.0230 33 LEU L C +3414 O O . LEU C 35 ? 0.3910 0.4492 0.3722 -0.0444 0.0302 0.0253 33 LEU L O +3415 C CB . LEU C 35 ? 0.3385 0.4094 0.3355 -0.0329 0.0395 0.0158 33 LEU L CB +3416 C CG . LEU C 35 ? 0.4331 0.4961 0.4215 -0.0298 0.0327 0.0110 33 LEU L CG +3417 C CD1 . LEU C 35 ? 0.4735 0.5411 0.4751 -0.0253 0.0344 0.0082 33 LEU L CD1 +3418 C CD2 . LEU C 35 ? 0.5085 0.5645 0.4777 -0.0288 0.0337 0.0069 33 LEU L CD2 +3419 N N . ALA C 36 ? 0.3333 0.3905 0.3218 -0.0420 0.0199 0.0210 34 ALA L N +3420 C CA . ALA C 36 ? 0.3072 0.3514 0.2827 -0.0440 0.0153 0.0206 34 ALA L CA +3421 C C . ALA C 36 ? 0.3679 0.4057 0.3360 -0.0384 0.0116 0.0157 34 ALA L C +3422 O O . ALA C 36 ? 0.3262 0.3694 0.3006 -0.0350 0.0107 0.0126 34 ALA L O +3423 C CB . ALA C 36 ? 0.3630 0.4051 0.3425 -0.0515 0.0106 0.0226 34 ALA L CB +3424 N N . TRP C 37 ? 0.3295 0.3564 0.2857 -0.0375 0.0100 0.0159 35 TRP L N +3425 C CA . TRP C 37 ? 0.3045 0.3256 0.2543 -0.0327 0.0064 0.0124 35 TRP L CA +3426 C C . TRP C 37 ? 0.3077 0.3172 0.2544 -0.0349 0.0031 0.0127 35 TRP L C +3427 O O . TRP C 37 ? 0.3185 0.3205 0.2626 -0.0385 0.0050 0.0163 35 TRP L O +3428 C CB . TRP C 37 ? 0.3102 0.3304 0.2495 -0.0289 0.0080 0.0134 35 TRP L CB +3429 C CG . TRP C 37 ? 0.3194 0.3487 0.2579 -0.0273 0.0121 0.0104 35 TRP L CG +3430 C CD1 . TRP C 37 ? 0.3554 0.3901 0.2917 -0.0293 0.0180 0.0123 35 TRP L CD1 +3431 C CD2 . TRP C 37 ? 0.3040 0.3369 0.2433 -0.0239 0.0119 0.0042 35 TRP L CD2 +3432 N NE1 . TRP C 37 ? 0.3173 0.3579 0.2522 -0.0277 0.0222 0.0068 35 TRP L NE1 +3433 C CE2 . TRP C 37 ? 0.3423 0.3815 0.2794 -0.0245 0.0185 0.0017 35 TRP L CE2 +3434 C CE3 . TRP C 37 ? 0.3043 0.3349 0.2458 -0.0210 0.0075 0.0002 35 TRP L CE3 +3435 C CZ2 . TRP C 37 ? 0.3387 0.3806 0.2757 -0.0225 0.0215 -0.0053 35 TRP L CZ2 +3436 C CZ3 . TRP C 37 ? 0.3676 0.4020 0.3099 -0.0187 0.0096 -0.0058 35 TRP L CZ3 +3437 C CH2 . TRP C 37 ? 0.3640 0.4033 0.3040 -0.0196 0.0167 -0.0088 35 TRP L CH2 +3438 N N . TYR C 38 ? 0.3144 0.3214 0.2614 -0.0327 -0.0007 0.0087 36 TYR L N +3439 C CA . TYR C 38 ? 0.3312 0.3264 0.2747 -0.0346 -0.0023 0.0075 36 TYR L CA +3440 C C . TYR C 38 ? 0.3484 0.3392 0.2878 -0.0281 -0.0040 0.0057 36 TYR L C +3441 O O . TYR C 38 ? 0.2957 0.2941 0.2362 -0.0238 -0.0056 0.0036 36 TYR L O +3442 C CB . TYR C 38 ? 0.3028 0.3001 0.2505 -0.0404 -0.0054 0.0044 36 TYR L CB +3443 C CG . TYR C 38 ? 0.3260 0.3305 0.2797 -0.0480 -0.0050 0.0071 36 TYR L CG +3444 C CD1 . TYR C 38 ? 0.3044 0.3239 0.2679 -0.0470 -0.0049 0.0092 36 TYR L CD1 +3445 C CD2 . TYR C 38 ? 0.3165 0.3126 0.2670 -0.0563 -0.0036 0.0075 36 TYR L CD2 +3446 C CE1 . TYR C 38 ? 0.2994 0.3279 0.2710 -0.0538 -0.0044 0.0130 36 TYR L CE1 +3447 C CE2 . TYR C 38 ? 0.3192 0.3236 0.2759 -0.0643 -0.0037 0.0104 36 TYR L CE2 +3448 C CZ . TYR C 38 ? 0.3911 0.4127 0.3589 -0.0628 -0.0045 0.0137 36 TYR L CZ +3449 O OH . TYR C 38 ? 0.3124 0.3444 0.2886 -0.0707 -0.0045 0.0178 36 TYR L OH +3450 N N . GLN C 39 ? 0.3112 0.2894 0.2471 -0.0278 -0.0028 0.0065 37 GLN L N +3451 C CA . GLN C 39 ? 0.3097 0.2834 0.2441 -0.0220 -0.0038 0.0054 37 GLN L CA +3452 C C . GLN C 39 ? 0.3833 0.3483 0.3172 -0.0254 -0.0038 0.0004 37 GLN L C +3453 O O . GLN C 39 ? 0.3793 0.3358 0.3115 -0.0321 -0.0012 -0.0008 37 GLN L O +3454 C CB . GLN C 39 ? 0.3364 0.3028 0.2690 -0.0180 -0.0010 0.0120 37 GLN L CB +3455 C CG . GLN C 39 ? 0.3598 0.3229 0.2936 -0.0115 -0.0016 0.0130 37 GLN L CG +3456 C CD . GLN C 39 ? 0.3926 0.3469 0.3282 -0.0080 0.0024 0.0214 37 GLN L CD +3457 O OE1 . GLN C 39 ? 0.4450 0.3849 0.3820 -0.0103 0.0079 0.0216 37 GLN L OE1 +3458 N NE2 . GLN C 39 ? 0.3650 0.3286 0.3009 -0.0030 0.0001 0.0289 37 GLN L NE2 +3459 N N . GLN C 40 ? 0.3424 0.3092 0.2769 -0.0217 -0.0062 -0.0030 38 GLN L N +3460 C CA . GLN C 40 ? 0.3605 0.3189 0.2929 -0.0253 -0.0053 -0.0078 38 GLN L CA +3461 C C . GLN C 40 ? 0.3636 0.3184 0.2967 -0.0187 -0.0048 -0.0087 38 GLN L C +3462 O O . GLN C 40 ? 0.3499 0.3144 0.2858 -0.0136 -0.0083 -0.0083 38 GLN L O +3463 C CB . GLN C 40 ? 0.3459 0.3136 0.2793 -0.0307 -0.0095 -0.0113 38 GLN L CB +3464 C CG . GLN C 40 ? 0.3602 0.3199 0.2884 -0.0373 -0.0087 -0.0163 38 GLN L CG +3465 C CD . GLN C 40 ? 0.3976 0.3695 0.3275 -0.0421 -0.0140 -0.0174 38 GLN L CD +3466 O OE1 . GLN C 40 ? 0.3733 0.3572 0.3099 -0.0373 -0.0174 -0.0153 38 GLN L OE1 +3467 N NE2 . GLN C 40 ? 0.3687 0.3376 0.2925 -0.0522 -0.0143 -0.0204 38 GLN L NE2 +3468 N N . LYS C 41 ? 0.4108 0.3517 0.3420 -0.0193 0.0003 -0.0102 39 LYS L N +3469 C CA . LYS C 41 ? 0.4274 0.3639 0.3608 -0.0135 0.0023 -0.0109 39 LYS L CA +3470 C C . LYS C 41 ? 0.4997 0.4319 0.4286 -0.0186 0.0031 -0.0182 39 LYS L C +3471 O O . LYS C 41 ? 0.4304 0.3589 0.3533 -0.0277 0.0036 -0.0223 39 LYS L O +3472 C CB . LYS C 41 ? 0.4259 0.3489 0.3625 -0.0094 0.0095 -0.0064 39 LYS L CB +3473 C CG . LYS C 41 ? 0.5096 0.4387 0.4499 -0.0049 0.0081 0.0025 39 LYS L CG +3474 C CD . LYS C 41 ? 0.5716 0.4901 0.5183 0.0008 0.0147 0.0099 39 LYS L CD +3475 C CE . LYS C 41 ? 0.5612 0.4892 0.5107 0.0048 0.0119 0.0204 39 LYS L CE +3476 N NZ . LYS C 41 ? 0.5778 0.4968 0.5357 0.0108 0.0182 0.0305 39 LYS L NZ +3477 N N . PRO C 42 ? 0.5227 0.4567 0.4541 -0.0138 0.0028 -0.0196 40 PRO L N +3478 C CA . PRO C 42 ? 0.5544 0.4866 0.4806 -0.0189 0.0030 -0.0260 40 PRO L CA +3479 C C . PRO C 42 ? 0.4968 0.4128 0.4146 -0.0271 0.0102 -0.0315 40 PRO L C +3480 O O . PRO C 42 ? 0.5341 0.4355 0.4531 -0.0250 0.0184 -0.0312 40 PRO L O +3481 C CB . PRO C 42 ? 0.5761 0.5099 0.5077 -0.0110 0.0040 -0.0253 40 PRO L CB +3482 C CG . PRO C 42 ? 0.5556 0.5001 0.4949 -0.0035 -0.0003 -0.0189 40 PRO L CG +3483 C CD . PRO C 42 ? 0.5087 0.4494 0.4475 -0.0043 0.0013 -0.0148 40 PRO L CD +3484 N N . GLY C 43 ? 0.5164 0.4355 0.4261 -0.0373 0.0075 -0.0361 41 GLY L N +3485 C CA . GLY C 43 ? 0.5453 0.4501 0.4441 -0.0481 0.0139 -0.0430 41 GLY L CA +3486 C C . GLY C 43 ? 0.5609 0.4569 0.4573 -0.0542 0.0172 -0.0429 41 GLY L C +3487 O O . GLY C 43 ? 0.6068 0.4881 0.4937 -0.0640 0.0241 -0.0496 41 GLY L O +3488 N N . LYS C 44 ? 0.4952 0.3990 0.3990 -0.0497 0.0133 -0.0362 42 LYS L N +3489 C CA . LYS C 44 ? 0.4418 0.3375 0.3444 -0.0551 0.0167 -0.0352 42 LYS L CA +3490 C C . LYS C 44 ? 0.4470 0.3596 0.3515 -0.0602 0.0084 -0.0317 42 LYS L C +3491 O O . LYS C 44 ? 0.4114 0.3411 0.3209 -0.0563 0.0009 -0.0286 42 LYS L O +3492 C CB . LYS C 44 ? 0.4980 0.3854 0.4089 -0.0449 0.0220 -0.0289 42 LYS L CB +3493 C CG . LYS C 44 ? 0.6571 0.5324 0.5717 -0.0368 0.0296 -0.0292 42 LYS L CG +3494 C CD . LYS C 44 ? 0.8205 0.6715 0.7319 -0.0414 0.0424 -0.0335 42 LYS L CD +3495 C CE . LYS C 44 ? 0.9827 0.8219 0.8991 -0.0335 0.0514 -0.0345 42 LYS L CE +3496 N NZ . LYS C 44 ? 1.0316 0.8460 0.9413 -0.0412 0.0652 -0.0434 42 LYS L NZ +3497 N N . ALA C 45 ? 0.4550 0.3620 0.3564 -0.0692 0.0107 -0.0324 43 ALA L N +3498 C CA . ALA C 45 ? 0.4144 0.3371 0.3196 -0.0740 0.0041 -0.0281 43 ALA L CA +3499 C C . ALA C 45 ? 0.4112 0.3414 0.3259 -0.0631 0.0028 -0.0204 43 ALA L C +3500 O O . ALA C 45 ? 0.4310 0.3512 0.3477 -0.0551 0.0077 -0.0177 43 ALA L O +3501 C CB . ALA C 45 ? 0.4110 0.3255 0.3106 -0.0874 0.0075 -0.0309 43 ALA L CB +3502 N N . PRO C 46 ? 0.3861 0.3345 0.3071 -0.0628 -0.0034 -0.0163 44 PRO L N +3503 C CA . PRO C 46 ? 0.3872 0.3421 0.3148 -0.0551 -0.0034 -0.0101 44 PRO L CA +3504 C C . PRO C 46 ? 0.4086 0.3526 0.3349 -0.0580 0.0021 -0.0074 44 PRO L C +3505 O O . PRO C 46 ? 0.4106 0.3461 0.3329 -0.0681 0.0048 -0.0102 44 PRO L O +3506 C CB . PRO C 46 ? 0.4040 0.3783 0.3387 -0.0573 -0.0090 -0.0074 44 PRO L CB +3507 C CG . PRO C 46 ? 0.3952 0.3755 0.3287 -0.0632 -0.0135 -0.0105 44 PRO L CG +3508 C CD . PRO C 46 ? 0.4527 0.4167 0.3754 -0.0705 -0.0099 -0.0163 44 PRO L CD +3509 N N . LYS C 47 ? 0.3728 0.3178 0.3021 -0.0499 0.0038 -0.0018 45 LYS L N +3510 C CA . LYS C 47 ? 0.3957 0.3329 0.3252 -0.0514 0.0088 0.0031 45 LYS L CA +3511 C C . LYS C 47 ? 0.3500 0.3019 0.2835 -0.0490 0.0068 0.0085 45 LYS L C +3512 O O . LYS C 47 ? 0.3364 0.2985 0.2712 -0.0417 0.0040 0.0099 45 LYS L O +3513 C CB . LYS C 47 ? 0.5767 0.5002 0.5058 -0.0438 0.0139 0.0067 45 LYS L CB +3514 C CG . LYS C 47 ? 0.7778 0.6939 0.7084 -0.0434 0.0192 0.0142 45 LYS L CG +3515 C CD . LYS C 47 ? 0.8920 0.8001 0.8253 -0.0337 0.0228 0.0211 45 LYS L CD +3516 C CE . LYS C 47 ? 1.0169 0.9168 0.9506 -0.0299 0.0242 0.0162 45 LYS L CE +3517 N NZ . LYS C 47 ? 1.0814 0.9604 1.0134 -0.0362 0.0322 0.0103 45 LYS L NZ +3518 N N . LEU C 48 ? 0.3530 0.3056 0.2881 -0.0559 0.0089 0.0111 46 LEU L N +3519 C CA . LEU C 48 ? 0.3454 0.3111 0.2842 -0.0543 0.0088 0.0161 46 LEU L CA +3520 C C . LEU C 48 ? 0.3732 0.3357 0.3092 -0.0471 0.0118 0.0226 46 LEU L C +3521 O O . LEU C 48 ? 0.3877 0.3367 0.3218 -0.0474 0.0162 0.0265 46 LEU L O +3522 C CB . LEU C 48 ? 0.3526 0.3200 0.2947 -0.0643 0.0107 0.0178 46 LEU L CB +3523 C CG . LEU C 48 ? 0.3707 0.3511 0.3177 -0.0639 0.0123 0.0231 46 LEU L CG +3524 C CD1 . LEU C 48 ? 0.3795 0.3779 0.3332 -0.0608 0.0089 0.0216 46 LEU L CD1 +3525 C CD2 . LEU C 48 ? 0.3886 0.3676 0.3389 -0.0745 0.0148 0.0252 46 LEU L CD2 +3526 N N . LEU C 49 ? 0.3412 0.3163 0.2768 -0.0413 0.0100 0.0241 47 LEU L N +3527 C CA . LEU C 49 ? 0.3462 0.3228 0.2774 -0.0362 0.0118 0.0308 47 LEU L CA +3528 C C . LEU C 49 ? 0.3497 0.3350 0.2805 -0.0390 0.0149 0.0350 47 LEU L C +3529 O O . LEU C 49 ? 0.4394 0.4210 0.3672 -0.0392 0.0181 0.0426 47 LEU L O +3530 C CB . LEU C 49 ? 0.3376 0.3224 0.2658 -0.0294 0.0081 0.0288 47 LEU L CB +3531 C CG . LEU C 49 ? 0.3644 0.3434 0.2933 -0.0255 0.0050 0.0252 47 LEU L CG +3532 C CD1 . LEU C 49 ? 0.3962 0.3862 0.3229 -0.0207 0.0014 0.0225 47 LEU L CD1 +3533 C CD2 . LEU C 49 ? 0.4452 0.4122 0.3736 -0.0225 0.0074 0.0318 47 LEU L CD2 +3534 N N . ILE C 50 ? 0.3725 0.3699 0.3071 -0.0406 0.0146 0.0310 48 ILE L N +3535 C CA . ILE C 50 ? 0.3610 0.3685 0.2956 -0.0423 0.0187 0.0338 48 ILE L CA +3536 C C . ILE C 50 ? 0.3689 0.3839 0.3142 -0.0473 0.0197 0.0314 48 ILE L C +3537 O O . ILE C 50 ? 0.3484 0.3667 0.3000 -0.0472 0.0162 0.0266 48 ILE L O +3538 C CB . ILE C 50 ? 0.3553 0.3725 0.2844 -0.0375 0.0189 0.0312 48 ILE L CB +3539 C CG1 . ILE C 50 ? 0.4084 0.4219 0.3275 -0.0334 0.0164 0.0348 48 ILE L CG1 +3540 C CG2 . ILE C 50 ? 0.3699 0.3969 0.2984 -0.0399 0.0251 0.0325 48 ILE L CG2 +3541 C CD1 . ILE C 50 ? 0.4462 0.4576 0.3593 -0.0348 0.0192 0.0445 48 ILE L CD1 +3542 N N . TYR C 51 ? 0.3602 0.3796 0.3086 -0.0517 0.0244 0.0357 49 TYR L N +3543 C CA . TYR C 51 ? 0.3631 0.3940 0.3241 -0.0558 0.0259 0.0350 49 TYR L CA +3544 C C . TYR C 51 ? 0.3741 0.4145 0.3361 -0.0555 0.0331 0.0380 49 TYR L C +3545 O O . TYR C 51 ? 0.3754 0.4125 0.3267 -0.0544 0.0364 0.0413 49 TYR L O +3546 C CB . TYR C 51 ? 0.3432 0.3707 0.3106 -0.0645 0.0242 0.0369 49 TYR L CB +3547 C CG . TYR C 51 ? 0.4211 0.4393 0.3840 -0.0694 0.0281 0.0424 49 TYR L CG +3548 C CD1 . TYR C 51 ? 0.4561 0.4821 0.4240 -0.0733 0.0335 0.0474 49 TYR L CD1 +3549 C CD2 . TYR C 51 ? 0.4231 0.4241 0.3781 -0.0701 0.0274 0.0430 49 TYR L CD2 +3550 C CE1 . TYR C 51 ? 0.4657 0.4826 0.4298 -0.0780 0.0375 0.0531 49 TYR L CE1 +3551 C CE2 . TYR C 51 ? 0.4387 0.4296 0.3911 -0.0742 0.0320 0.0488 49 TYR L CE2 +3552 C CZ . TYR C 51 ? 0.4850 0.4840 0.4416 -0.0784 0.0366 0.0540 49 TYR L CZ +3553 O OH . TYR C 51 ? 0.5473 0.5360 0.5019 -0.0828 0.0415 0.0604 49 TYR L OH +3554 N N . ALA C 52 ? 0.3726 0.4257 0.3484 -0.0569 0.0360 0.0377 50 ALA L N +3555 C CA . ALA C 52 ? 0.3805 0.4433 0.3593 -0.0560 0.0447 0.0392 50 ALA L CA +3556 C C . ALA C 52 ? 0.4252 0.4864 0.3906 -0.0504 0.0480 0.0348 50 ALA L C +3557 O O . ALA C 52 ? 0.3988 0.4621 0.3559 -0.0512 0.0547 0.0364 50 ALA L O +3558 C CB . ALA C 52 ? 0.4162 0.4786 0.3941 -0.0620 0.0491 0.0459 50 ALA L CB +3559 N N . ALA C 53 ? 0.3786 0.4361 0.3406 -0.0459 0.0429 0.0294 51 ALA L N +3560 C CA . ALA C 53 ? 0.3849 0.4417 0.3354 -0.0416 0.0446 0.0238 51 ALA L CA +3561 C C . ALA C 53 ? 0.4078 0.4586 0.3398 -0.0421 0.0425 0.0267 51 ALA L C +3562 O O . ALA C 53 ? 0.4605 0.5092 0.3827 -0.0393 0.0392 0.0231 51 ALA L O +3563 C CB . ALA C 53 ? 0.3786 0.4437 0.3325 -0.0409 0.0552 0.0201 51 ALA L CB +3564 N N . SER C 54 ? 0.3991 0.4480 0.3269 -0.0458 0.0443 0.0341 52 SER L N +3565 C CA . SER C 54 ? 0.4191 0.4649 0.3307 -0.0460 0.0429 0.0392 52 SER L CA +3566 C C . SER C 54 ? 0.4752 0.5126 0.3870 -0.0481 0.0406 0.0486 52 SER L C +3567 O O . SER C 54 ? 0.4719 0.5073 0.3727 -0.0478 0.0396 0.0556 52 SER L O +3568 C CB . SER C 54 ? 0.4225 0.4765 0.3232 -0.0486 0.0508 0.0394 52 SER L CB +3569 O OG . SER C 54 ? 0.4951 0.5523 0.4026 -0.0525 0.0578 0.0435 52 SER L OG +3570 N N . THR C 55 ? 0.3916 0.4241 0.3154 -0.0508 0.0401 0.0496 53 THR L N +3571 C CA . THR C 55 ? 0.4669 0.4890 0.3911 -0.0538 0.0398 0.0574 53 THR L CA +3572 C C . THR C 55 ? 0.4442 0.4543 0.3683 -0.0508 0.0338 0.0565 53 THR L C +3573 O O . THR C 55 ? 0.3945 0.4026 0.3252 -0.0506 0.0303 0.0498 53 THR L O +3574 C CB . THR C 55 ? 0.5422 0.5647 0.4781 -0.0604 0.0429 0.0583 53 THR L CB +3575 O OG1 . THR C 55 ? 0.4736 0.5084 0.4116 -0.0624 0.0495 0.0592 53 THR L OG1 +3576 C CG2 . THR C 55 ? 0.5170 0.5267 0.4523 -0.0645 0.0442 0.0659 53 THR L CG2 +3577 N N . LEU C 56 ? 0.4395 0.4425 0.3568 -0.0483 0.0332 0.0641 54 LEU L N +3578 C CA . LEU C 56 ? 0.4622 0.4532 0.3805 -0.0445 0.0294 0.0644 54 LEU L CA +3579 C C . LEU C 56 ? 0.5213 0.4980 0.4474 -0.0493 0.0314 0.0636 54 LEU L C +3580 O O . LEU C 56 ? 0.4906 0.4619 0.4187 -0.0541 0.0361 0.0695 54 LEU L O +3581 C CB . LEU C 56 ? 0.5256 0.5149 0.4373 -0.0402 0.0291 0.0753 54 LEU L CB +3582 C CG . LEU C 56 ? 0.5995 0.5783 0.5139 -0.0346 0.0263 0.0781 54 LEU L CG +3583 C CD1 . LEU C 56 ? 0.5455 0.5288 0.4599 -0.0311 0.0209 0.0682 54 LEU L CD1 +3584 C CD2 . LEU C 56 ? 0.6404 0.6227 0.5503 -0.0306 0.0258 0.0919 54 LEU L CD2 +3585 N N . GLN C 57 ? 0.4715 0.4421 0.4012 -0.0490 0.0282 0.0560 55 GLN L N +3586 C CA . GLN C 57 ? 0.4829 0.4391 0.4173 -0.0551 0.0302 0.0533 55 GLN L CA +3587 C C . GLN C 57 ? 0.5370 0.4758 0.4710 -0.0532 0.0348 0.0607 55 GLN L C +3588 O O . GLN C 57 ? 0.5007 0.4382 0.4325 -0.0453 0.0340 0.0665 55 GLN L O +3589 C CB . GLN C 57 ? 0.4856 0.4405 0.4216 -0.0554 0.0258 0.0435 55 GLN L CB +3590 C CG . GLN C 57 ? 0.5175 0.4548 0.4545 -0.0612 0.0280 0.0393 55 GLN L CG +3591 C CD . GLN C 57 ? 0.5664 0.5019 0.5066 -0.0731 0.0305 0.0378 55 GLN L CD +3592 O OE1 . GLN C 57 ? 0.5205 0.4693 0.4641 -0.0762 0.0302 0.0405 55 GLN L OE1 +3593 N NE2 . GLN C 57 ? 0.5652 0.4842 0.5042 -0.0804 0.0335 0.0331 55 GLN L NE2 +3594 N N . SER C 58 ? 0.5530 0.4785 0.4902 -0.0609 0.0400 0.0611 56 SER L N +3595 C CA . SER C 58 ? 0.5933 0.4996 0.5325 -0.0597 0.0466 0.0684 56 SER L CA +3596 C C . SER C 58 ? 0.5565 0.4519 0.4965 -0.0524 0.0466 0.0667 56 SER L C +3597 O O . SER C 58 ? 0.5891 0.4828 0.5281 -0.0539 0.0438 0.0562 56 SER L O +3598 C CB . SER C 58 ? 0.7838 0.6754 0.7260 -0.0711 0.0526 0.0649 56 SER L CB +3599 O OG . SER C 58 ? 0.9058 0.8114 0.8489 -0.0791 0.0507 0.0631 56 SER L OG +3600 N N . GLY C 59 ? 0.5630 0.4525 0.5056 -0.0445 0.0497 0.0781 57 GLY L N +3601 C CA . GLY C 59 ? 0.6552 0.5341 0.6017 -0.0368 0.0512 0.0788 57 GLY L CA +3602 C C . GLY C 59 ? 0.6950 0.5901 0.6392 -0.0287 0.0431 0.0781 57 GLY L C +3603 O O . GLY C 59 ? 0.6866 0.5757 0.6356 -0.0213 0.0442 0.0811 57 GLY L O +3604 N N . VAL C 60 ? 0.5977 0.5123 0.5355 -0.0299 0.0360 0.0742 58 VAL L N +3605 C CA . VAL C 60 ? 0.5866 0.5159 0.5216 -0.0236 0.0288 0.0722 58 VAL L CA +3606 C C . VAL C 60 ? 0.5099 0.4503 0.4433 -0.0177 0.0267 0.0859 58 VAL L C +3607 O O . VAL C 60 ? 0.5050 0.4513 0.4348 -0.0204 0.0281 0.0933 58 VAL L O +3608 C CB . VAL C 60 ? 0.5509 0.4948 0.4808 -0.0278 0.0237 0.0620 58 VAL L CB +3609 C CG1 . VAL C 60 ? 0.5142 0.4723 0.4407 -0.0221 0.0173 0.0597 58 VAL L CG1 +3610 C CG2 . VAL C 60 ? 0.4575 0.3935 0.3896 -0.0341 0.0244 0.0506 58 VAL L CG2 +3611 N N . PRO C 61 ? 0.5183 0.4631 0.4542 -0.0103 0.0233 0.0902 59 PRO L N +3612 C CA . PRO C 61 ? 0.5582 0.5158 0.4930 -0.0057 0.0204 0.1052 59 PRO L CA +3613 C C . PRO C 61 ? 0.5541 0.5312 0.4765 -0.0099 0.0157 0.1046 59 PRO L C +3614 O O . PRO C 61 ? 0.5425 0.5269 0.4589 -0.0132 0.0128 0.0921 59 PRO L O +3615 C CB . PRO C 61 ? 0.5679 0.5299 0.5079 0.0015 0.0162 0.1064 59 PRO L CB +3616 C CG . PRO C 61 ? 0.5522 0.4967 0.4985 0.0019 0.0204 0.0954 59 PRO L CG +3617 C CD . PRO C 61 ? 0.4767 0.4157 0.4173 -0.0064 0.0221 0.0827 59 PRO L CD +3618 N N . SER C 62 ? 0.5331 0.5186 0.4522 -0.0098 0.0156 0.1189 60 SER L N +3619 C CA . SER C 62 ? 0.5158 0.5186 0.4213 -0.0150 0.0130 0.1192 60 SER L CA +3620 C C . SER C 62 ? 0.5515 0.5716 0.4481 -0.0150 0.0057 0.1135 60 SER L C +3621 O O . SER C 62 ? 0.4682 0.5013 0.3521 -0.0204 0.0049 0.1100 60 SER L O +3622 C CB . SER C 62 ? 0.5528 0.5608 0.4561 -0.0153 0.0146 0.1377 60 SER L CB +3623 O OG . SER C 62 ? 0.6730 0.6888 0.5805 -0.0095 0.0098 0.1515 60 SER L OG +3624 N N . ARG C 63 ? 0.5100 0.5304 0.4127 -0.0098 0.0014 0.1118 61 ARG L N +3625 C CA . ARG C 63 ? 0.4860 0.5222 0.3800 -0.0113 -0.0051 0.1051 61 ARG L CA +3626 C C . ARG C 63 ? 0.4327 0.4671 0.3226 -0.0149 -0.0038 0.0867 61 ARG L C +3627 O O . ARG C 63 ? 0.4563 0.5024 0.3375 -0.0177 -0.0072 0.0793 61 ARG L O +3628 C CB . ARG C 63 ? 0.4476 0.4865 0.3505 -0.0050 -0.0102 0.1095 61 ARG L CB +3629 C CG . ARG C 63 ? 0.4422 0.4637 0.3576 -0.0002 -0.0071 0.1015 61 ARG L CG +3630 C CD . ARG C 63 ? 0.5175 0.5436 0.4417 0.0060 -0.0115 0.1058 61 ARG L CD +3631 N NE . ARG C 63 ? 0.4392 0.4481 0.3742 0.0101 -0.0073 0.0981 61 ARG L NE +3632 C CZ . ARG C 63 ? 0.5085 0.5004 0.4547 0.0142 -0.0005 0.1040 61 ARG L CZ +3633 N NH1 . ARG C 63 ? 0.5351 0.5248 0.4851 0.0157 0.0028 0.1188 61 ARG L NH1 +3634 N NH2 . ARG C 63 ? 0.5125 0.4889 0.4657 0.0163 0.0039 0.0951 61 ARG L NH2 +3635 N N . PHE C 64 ? 0.3823 0.4027 0.2789 -0.0155 0.0011 0.0796 62 PHE L N +3636 C CA . PHE C 64 ? 0.4094 0.4297 0.3048 -0.0187 0.0027 0.0650 62 PHE L CA +3637 C C . PHE C 64 ? 0.4594 0.4850 0.3479 -0.0244 0.0073 0.0644 62 PHE L C +3638 O O . PHE C 64 ? 0.5067 0.5276 0.3964 -0.0261 0.0111 0.0724 62 PHE L O +3639 C CB . PHE C 64 ? 0.3837 0.3894 0.2897 -0.0178 0.0049 0.0587 62 PHE L CB +3640 C CG . PHE C 64 ? 0.4313 0.4314 0.3434 -0.0129 0.0017 0.0562 62 PHE L CG +3641 C CD1 . PHE C 64 ? 0.3813 0.3853 0.2936 -0.0124 -0.0014 0.0457 62 PHE L CD1 +3642 C CD2 . PHE C 64 ? 0.4337 0.4238 0.3525 -0.0088 0.0030 0.0647 62 PHE L CD2 +3643 C CE1 . PHE C 64 ? 0.4197 0.4188 0.3376 -0.0081 -0.0038 0.0436 62 PHE L CE1 +3644 C CE2 . PHE C 64 ? 0.4343 0.4190 0.3594 -0.0041 0.0014 0.0622 62 PHE L CE2 +3645 C CZ . PHE C 64 ? 0.4155 0.4053 0.3396 -0.0041 -0.0023 0.0515 62 PHE L CZ +3646 N N . SER C 65 ? 0.4280 0.4626 0.3101 -0.0273 0.0081 0.0549 63 SER L N +3647 C CA . SER C 65 ? 0.4458 0.4851 0.3232 -0.0323 0.0143 0.0527 63 SER L CA +3648 C C . SER C 65 ? 0.5183 0.5596 0.3993 -0.0331 0.0170 0.0393 63 SER L C +3649 O O . SER C 65 ? 0.4051 0.4483 0.2861 -0.0310 0.0137 0.0323 63 SER L O +3650 C CB . SER C 65 ? 0.4703 0.5214 0.3322 -0.0363 0.0151 0.0584 63 SER L CB +3651 O OG . SER C 65 ? 0.5324 0.5926 0.3853 -0.0373 0.0116 0.0521 63 SER L OG +3652 N N . GLY C 66 ? 0.4382 0.4797 0.3240 -0.0358 0.0233 0.0369 64 GLY L N +3653 C CA . GLY C 66 ? 0.4445 0.4893 0.3365 -0.0361 0.0275 0.0266 64 GLY L CA +3654 C C . GLY C 66 ? 0.4360 0.4885 0.3201 -0.0402 0.0358 0.0244 64 GLY L C +3655 O O . GLY C 66 ? 0.3971 0.4517 0.2749 -0.0434 0.0389 0.0317 64 GLY L O +3656 N N . SER C 67 ? 0.3844 0.4405 0.2689 -0.0401 0.0404 0.0144 65 SER L N +3657 C CA . SER C 67 ? 0.4300 0.4919 0.3077 -0.0442 0.0508 0.0104 65 SER L CA +3658 C C . SER C 67 ? 0.4379 0.5000 0.3283 -0.0420 0.0580 0.0006 65 SER L C +3659 O O . SER C 67 ? 0.4299 0.4888 0.3311 -0.0379 0.0538 -0.0031 65 SER L O +3660 C CB . SER C 67 ? 0.5427 0.6097 0.3982 -0.0488 0.0508 0.0090 65 SER L CB +3661 O OG . SER C 67 ? 0.6359 0.7024 0.4883 -0.0478 0.0474 0.0006 65 SER L OG +3662 N N . GLY C 68 ? 0.4072 0.4731 0.2970 -0.0447 0.0698 -0.0032 66 GLY L N +3663 C CA . GLY C 68 ? 0.4550 0.5208 0.3589 -0.0421 0.0790 -0.0114 66 GLY L CA +3664 C C . GLY C 68 ? 0.5151 0.5851 0.4382 -0.0408 0.0864 -0.0069 66 GLY L C +3665 O O . GLY C 68 ? 0.5084 0.5799 0.4367 -0.0417 0.0815 0.0022 66 GLY L O +3666 N N . SER C 69 ? 0.4386 0.5102 0.3731 -0.0391 0.0988 -0.0132 67 SER L N +3667 C CA . SER C 69 ? 0.5170 0.5948 0.4746 -0.0370 0.1065 -0.0084 67 SER L CA +3668 C C . SER C 69 ? 0.6139 0.6916 0.5868 -0.0328 0.1192 -0.0159 67 SER L C +3669 O O . SER C 69 ? 0.7422 0.8151 0.7021 -0.0348 0.1292 -0.0261 67 SER L O +3670 C CB . SER C 69 ? 0.6731 0.7556 0.6238 -0.0419 0.1141 -0.0040 67 SER L CB +3671 O OG . SER C 69 ? 0.7320 0.8216 0.7045 -0.0410 0.1143 0.0052 67 SER L OG +3672 N N . GLY C 70 ? 0.5186 0.6014 0.5193 -0.0276 0.1193 -0.0107 68 GLY L N +3673 C CA . GLY C 70 ? 0.4803 0.5628 0.4998 -0.0222 0.1316 -0.0157 68 GLY L CA +3674 C C . GLY C 70 ? 0.4393 0.5180 0.4673 -0.0175 0.1232 -0.0169 68 GLY L C +3675 O O . GLY C 70 ? 0.4160 0.5014 0.4622 -0.0147 0.1139 -0.0079 68 GLY L O +3676 N N . THR C 71 ? 0.3647 0.4336 0.3788 -0.0177 0.1259 -0.0278 69 THR L N +3677 C CA . THR C 71 ? 0.4002 0.4651 0.4229 -0.0133 0.1192 -0.0292 69 THR L CA +3678 C C . THR C 71 ? 0.4507 0.5088 0.4493 -0.0167 0.1069 -0.0341 69 THR L C +3679 O O . THR C 71 ? 0.4528 0.5082 0.4575 -0.0135 0.0993 -0.0340 69 THR L O +3680 C CB . THR C 71 ? 0.5057 0.5646 0.5417 -0.0092 0.1352 -0.0371 69 THR L CB +3681 O OG1 . THR C 71 ? 0.5255 0.5754 0.5381 -0.0148 0.1459 -0.0504 69 THR L OG1 +3682 C CG2 . THR C 71 ? 0.4697 0.5367 0.5359 -0.0040 0.1477 -0.0299 69 THR L CG2 +3683 N N . GLU C 72 ? 0.4422 0.4984 0.4149 -0.0229 0.1047 -0.0374 70 GLU L N +3684 C CA . GLU C 72 ? 0.4675 0.5194 0.4196 -0.0259 0.0933 -0.0408 70 GLU L CA +3685 C C . GLU C 72 ? 0.4298 0.4852 0.3695 -0.0289 0.0820 -0.0322 70 GLU L C +3686 O O . GLU C 72 ? 0.4224 0.4808 0.3515 -0.0331 0.0863 -0.0302 70 GLU L O +3687 C CB . GLU C 72 ? 0.5866 0.6334 0.5183 -0.0315 0.1015 -0.0531 70 GLU L CB +3688 C CG . GLU C 72 ? 0.8610 0.9025 0.7866 -0.0316 0.0945 -0.0592 70 GLU L CG +3689 C CD . GLU C 72 ? 1.0952 1.1353 0.9933 -0.0402 0.0952 -0.0681 70 GLU L CD +3690 O OE1 . GLU C 72 ? 1.1811 1.2222 1.0656 -0.0462 0.1054 -0.0729 70 GLU L OE1 +3691 O OE2 . GLU C 72 ? 1.1469 1.1861 1.0368 -0.0416 0.0854 -0.0700 70 GLU L OE2 +3692 N N . PHE C 73 ? 0.3988 0.4531 0.3399 -0.0268 0.0686 -0.0272 71 PHE L N +3693 C CA . PHE C 73 ? 0.3948 0.4500 0.3273 -0.0287 0.0586 -0.0189 71 PHE L CA +3694 C C . PHE C 73 ? 0.4442 0.4959 0.3631 -0.0291 0.0486 -0.0200 71 PHE L C +3695 O O . PHE C 73 ? 0.4385 0.4875 0.3606 -0.0267 0.0462 -0.0253 71 PHE L O +3696 C CB . PHE C 73 ? 0.3595 0.4164 0.3095 -0.0264 0.0531 -0.0107 71 PHE L CB +3697 C CG . PHE C 73 ? 0.4041 0.4673 0.3706 -0.0262 0.0619 -0.0077 71 PHE L CG +3698 C CD1 . PHE C 73 ? 0.4184 0.4846 0.4039 -0.0222 0.0682 -0.0099 71 PHE L CD1 +3699 C CD2 . PHE C 73 ? 0.3589 0.4256 0.3233 -0.0298 0.0645 -0.0018 71 PHE L CD2 +3700 C CE1 . PHE C 73 ? 0.4431 0.5169 0.4466 -0.0215 0.0769 -0.0058 71 PHE L CE1 +3701 C CE2 . PHE C 73 ? 0.4508 0.5248 0.4318 -0.0298 0.0729 0.0014 71 PHE L CE2 +3702 C CZ . PHE C 73 ? 0.4247 0.5029 0.4261 -0.0254 0.0790 -0.0003 71 PHE L CZ +3703 N N . THR C 74 ? 0.4175 0.4701 0.3225 -0.0319 0.0431 -0.0142 72 THR L N +3704 C CA . THR C 74 ? 0.4345 0.4859 0.3285 -0.0319 0.0340 -0.0133 72 THR L CA +3705 C C . THR C 74 ? 0.3689 0.4184 0.2624 -0.0309 0.0263 -0.0027 72 THR L C +3706 O O . THR C 74 ? 0.4161 0.4665 0.3076 -0.0329 0.0286 0.0038 72 THR L O +3707 C CB . THR C 74 ? 0.4963 0.5526 0.3704 -0.0375 0.0360 -0.0172 72 THR L CB +3708 O OG1 . THR C 74 ? 0.6134 0.6738 0.4776 -0.0414 0.0390 -0.0108 72 THR L OG1 +3709 C CG2 . THR C 74 ? 0.4552 0.5108 0.3283 -0.0397 0.0460 -0.0295 72 THR L CG2 +3710 N N . LEU C 75 ? 0.3699 0.4158 0.2659 -0.0277 0.0182 -0.0011 73 LEU L N +3711 C CA . LEU C 75 ? 0.3610 0.4034 0.2555 -0.0263 0.0119 0.0081 73 LEU L CA +3712 C C . LEU C 75 ? 0.3567 0.4041 0.2393 -0.0269 0.0069 0.0107 73 LEU L C +3713 O O . LEU C 75 ? 0.3767 0.4262 0.2581 -0.0263 0.0042 0.0047 73 LEU L O +3714 C CB . LEU C 75 ? 0.3775 0.4123 0.2840 -0.0226 0.0075 0.0081 73 LEU L CB +3715 C CG . LEU C 75 ? 0.3811 0.4090 0.2882 -0.0207 0.0030 0.0161 73 LEU L CG +3716 C CD1 . LEU C 75 ? 0.3850 0.4092 0.2928 -0.0232 0.0063 0.0232 73 LEU L CD1 +3717 C CD2 . LEU C 75 ? 0.3632 0.3838 0.2792 -0.0180 -0.0002 0.0131 73 LEU L CD2 +3718 N N . THR C 76 ? 0.3535 0.4041 0.2281 -0.0286 0.0056 0.0204 74 THR L N +3719 C CA . THR C 76 ? 0.4091 0.4679 0.2734 -0.0298 -0.0001 0.0259 74 THR L CA +3720 C C . THR C 76 ? 0.4390 0.4936 0.3096 -0.0252 -0.0050 0.0383 74 THR L C +3721 O O . THR C 76 ? 0.4410 0.4897 0.3153 -0.0244 -0.0024 0.0458 74 THR L O +3722 C CB . THR C 76 ? 0.4519 0.5209 0.2999 -0.0365 0.0028 0.0285 74 THR L CB +3723 O OG1 . THR C 76 ? 0.4825 0.5532 0.3249 -0.0409 0.0097 0.0157 74 THR L OG1 +3724 C CG2 . THR C 76 ? 0.3976 0.4787 0.2347 -0.0390 -0.0047 0.0361 74 THR L CG2 +3725 N N . ILE C 77 ? 0.4241 0.4816 0.2971 -0.0221 -0.0112 0.0407 75 ILE L N +3726 C CA . ILE C 77 ? 0.3763 0.4323 0.2558 -0.0175 -0.0151 0.0540 75 ILE L CA +3727 C C . ILE C 77 ? 0.4498 0.5223 0.3193 -0.0205 -0.0204 0.0634 75 ILE L C +3728 O O . ILE C 77 ? 0.5094 0.5919 0.3735 -0.0230 -0.0249 0.0585 75 ILE L O +3729 C CB . ILE C 77 ? 0.4548 0.5029 0.3466 -0.0115 -0.0175 0.0513 75 ILE L CB +3730 C CG1 . ILE C 77 ? 0.4668 0.5018 0.3654 -0.0109 -0.0130 0.0411 75 ILE L CG1 +3731 C CG2 . ILE C 77 ? 0.4889 0.5330 0.3898 -0.0059 -0.0187 0.0652 75 ILE L CG2 +3732 C CD1 . ILE C 77 ? 0.5560 0.5853 0.4631 -0.0071 -0.0150 0.0348 75 ILE L CD1 +3733 N N . SER C 78 ? 0.5499 0.6261 0.4164 -0.0211 -0.0202 0.0772 76 SER L N +3734 C CA . SER C 78 ? 0.5647 0.6597 0.4183 -0.0264 -0.0252 0.0863 76 SER L CA +3735 C C . SER C 78 ? 0.6069 0.7125 0.4674 -0.0229 -0.0334 0.0966 76 SER L C +3736 O O . SER C 78 ? 0.6317 0.7553 0.4812 -0.0290 -0.0396 0.0983 76 SER L O +3737 C CB . SER C 78 ? 0.5777 0.6747 0.4265 -0.0283 -0.0224 0.0997 76 SER L CB +3738 O OG . SER C 78 ? 0.5993 0.6882 0.4635 -0.0207 -0.0223 0.1143 76 SER L OG +3739 N N . SER C 79 ? 0.5230 0.6182 0.4013 -0.0139 -0.0332 0.1033 77 SER L N +3740 C CA . SER C 79 ? 0.4808 0.5861 0.3693 -0.0094 -0.0398 0.1139 77 SER L CA +3741 C C . SER C 79 ? 0.4732 0.5610 0.3792 -0.0008 -0.0363 0.1091 77 SER L C +3742 O O . SER C 79 ? 0.4687 0.5423 0.3867 0.0054 -0.0310 0.1166 77 SER L O +3743 C CB . SER C 79 ? 0.5938 0.7102 0.4865 -0.0073 -0.0428 0.1368 77 SER L CB +3744 O OG . SER C 79 ? 0.6195 0.7456 0.5264 -0.0016 -0.0484 0.1484 77 SER L OG +3745 N N . LEU C 80 ? 0.4480 0.5362 0.3547 -0.0012 -0.0384 0.0964 78 LEU L N +3746 C CA . LEU C 80 ? 0.4565 0.5279 0.3757 0.0049 -0.0344 0.0884 78 LEU L CA +3747 C C . LEU C 80 ? 0.4481 0.5152 0.3850 0.0137 -0.0333 0.1019 78 LEU L C +3748 O O . LEU C 80 ? 0.4304 0.5131 0.3729 0.0158 -0.0386 0.1155 78 LEU L O +3749 C CB . LEU C 80 ? 0.4113 0.4872 0.3278 0.0024 -0.0377 0.0747 78 LEU L CB +3750 C CG . LEU C 80 ? 0.4767 0.5363 0.4001 0.0055 -0.0334 0.0622 78 LEU L CG +3751 C CD1 . LEU C 80 ? 0.4843 0.5324 0.4014 0.0022 -0.0279 0.0526 78 LEU L CD1 +3752 C CD2 . LEU C 80 ? 0.4741 0.5415 0.3962 0.0034 -0.0375 0.0527 78 LEU L CD2 +3753 N N . GLN C 81 ? 0.4269 0.4731 0.3730 0.0184 -0.0258 0.0982 79 GLN L N +3754 C CA . GLN C 81 ? 0.4269 0.4635 0.3905 0.0269 -0.0213 0.1080 79 GLN L CA +3755 C C . GLN C 81 ? 0.3820 0.4074 0.3518 0.0295 -0.0183 0.0956 79 GLN L C +3756 O O . GLN C 81 ? 0.4357 0.4559 0.3967 0.0249 -0.0183 0.0801 79 GLN L O +3757 C CB . GLN C 81 ? 0.4868 0.5056 0.4547 0.0288 -0.0127 0.1141 79 GLN L CB +3758 C CG . GLN C 81 ? 0.5344 0.5633 0.4978 0.0268 -0.0146 0.1285 79 GLN L CG +3759 C CD . GLN C 81 ? 0.7832 0.8310 0.7559 0.0314 -0.0201 0.1481 79 GLN L CD +3760 O OE1 . GLN C 81 ? 0.8222 0.8663 0.8128 0.0395 -0.0172 0.1569 79 GLN L OE1 +3761 N NE2 . GLN C 81 ? 0.8867 0.9558 0.8476 0.0257 -0.0278 0.1555 79 GLN L NE2 +3762 N N . PRO C 82 ? 0.4651 0.4868 0.4508 0.0371 -0.0152 0.1027 80 PRO L N +3763 C CA . PRO C 82 ? 0.4223 0.4345 0.4128 0.0391 -0.0122 0.0911 80 PRO L CA +3764 C C . PRO C 82 ? 0.4316 0.4228 0.4154 0.0354 -0.0055 0.0764 80 PRO L C +3765 O O . PRO C 82 ? 0.4524 0.4412 0.4317 0.0328 -0.0064 0.0634 80 PRO L O +3766 C CB . PRO C 82 ? 0.4802 0.4888 0.4907 0.0485 -0.0067 0.1037 80 PRO L CB +3767 C CG . PRO C 82 ? 0.5294 0.5554 0.5459 0.0510 -0.0116 0.1230 80 PRO L CG +3768 C CD . PRO C 82 ? 0.5226 0.5495 0.5241 0.0444 -0.0137 0.1227 80 PRO L CD +3769 N N . GLU C 83 ? 0.4325 0.4095 0.4153 0.0344 0.0009 0.0788 81 GLU L N +3770 C CA . GLU C 83 ? 0.5171 0.4756 0.4934 0.0293 0.0067 0.0656 81 GLU L CA +3771 C C . GLU C 83 ? 0.4680 0.4336 0.4305 0.0215 0.0012 0.0551 81 GLU L C +3772 O O . GLU C 83 ? 0.4408 0.3953 0.3984 0.0164 0.0043 0.0449 81 GLU L O +3773 C CB . GLU C 83 ? 0.5164 0.4571 0.4968 0.0294 0.0159 0.0713 81 GLU L CB +3774 C CG . GLU C 83 ? 0.6531 0.6012 0.6304 0.0281 0.0137 0.0823 81 GLU L CG +3775 C CD . GLU C 83 ? 0.7957 0.7542 0.7846 0.0357 0.0125 0.1013 81 GLU L CD +3776 O OE1 . GLU C 83 ? 0.6766 0.6458 0.6738 0.0411 0.0091 0.1059 81 GLU L OE1 +3777 O OE2 . GLU C 83 ? 0.8619 0.8190 0.8522 0.0359 0.0148 0.1128 81 GLU L OE2 +3778 N N . ASP C 84 ? 0.4109 0.3951 0.3676 0.0200 -0.0064 0.0575 82 ASP L N +3779 C CA . ASP C 84 ? 0.4279 0.4183 0.3734 0.0134 -0.0098 0.0482 82 ASP L CA +3780 C C . ASP C 84 ? 0.3817 0.3774 0.3250 0.0120 -0.0134 0.0370 82 ASP L C +3781 O O . ASP C 84 ? 0.3436 0.3424 0.2805 0.0073 -0.0146 0.0289 82 ASP L O +3782 C CB . ASP C 84 ? 0.4083 0.4140 0.3466 0.0111 -0.0140 0.0550 82 ASP L CB +3783 C CG . ASP C 84 ? 0.4456 0.4475 0.3852 0.0118 -0.0106 0.0672 82 ASP L CG +3784 O OD1 . ASP C 84 ? 0.4047 0.3901 0.3485 0.0120 -0.0041 0.0672 82 ASP L OD1 +3785 O OD2 . ASP C 84 ? 0.4244 0.4401 0.3599 0.0112 -0.0143 0.0768 82 ASP L OD2 +3786 N N . PHE C 85 ? 0.3570 0.3540 0.3068 0.0161 -0.0146 0.0369 83 PHE L N +3787 C CA . PHE C 85 ? 0.3496 0.3501 0.2980 0.0145 -0.0173 0.0265 83 PHE L CA +3788 C C . PHE C 85 ? 0.4050 0.3918 0.3526 0.0119 -0.0132 0.0179 83 PHE L C +3789 O O . PHE C 85 ? 0.4619 0.4355 0.4132 0.0133 -0.0079 0.0188 83 PHE L O +3790 C CB . PHE C 85 ? 0.3366 0.3428 0.2927 0.0191 -0.0195 0.0292 83 PHE L CB +3791 C CG . PHE C 85 ? 0.3417 0.3649 0.2984 0.0200 -0.0251 0.0382 83 PHE L CG +3792 C CD1 . PHE C 85 ? 0.3597 0.3964 0.3086 0.0152 -0.0306 0.0334 83 PHE L CD1 +3793 C CD2 . PHE C 85 ? 0.3908 0.4168 0.3559 0.0250 -0.0244 0.0519 83 PHE L CD2 +3794 C CE1 . PHE C 85 ? 0.3782 0.4318 0.3250 0.0137 -0.0362 0.0412 83 PHE L CE1 +3795 C CE2 . PHE C 85 ? 0.4678 0.5125 0.4330 0.0246 -0.0308 0.0619 83 PHE L CE2 +3796 C CZ . PHE C 85 ? 0.4323 0.4914 0.3872 0.0182 -0.0372 0.0560 83 PHE L CZ +3797 N N . ALA C 86 ? 0.3504 0.3405 0.2931 0.0074 -0.0150 0.0102 84 ALA L N +3798 C CA . ALA C 86 ? 0.3251 0.3067 0.2661 0.0030 -0.0125 0.0042 84 ALA L CA +3799 C C . ALA C 86 ? 0.3264 0.3169 0.2656 -0.0002 -0.0153 -0.0013 84 ALA L C +3800 O O . ALA C 86 ? 0.3630 0.3634 0.3010 0.0008 -0.0177 -0.0017 84 ALA L O +3801 C CB . ALA C 86 ? 0.3371 0.3102 0.2763 0.0003 -0.0085 0.0079 84 ALA L CB +3802 N N . THR C 87 ? 0.2891 0.2765 0.2284 -0.0045 -0.0144 -0.0052 85 THR L N +3803 C CA . THR C 87 ? 0.2749 0.2706 0.2157 -0.0069 -0.0157 -0.0083 85 THR L CA +3804 C C . THR C 87 ? 0.3383 0.3348 0.2779 -0.0104 -0.0136 -0.0057 85 THR L C +3805 O O . THR C 87 ? 0.3454 0.3342 0.2836 -0.0132 -0.0116 -0.0035 85 THR L O +3806 C CB . THR C 87 ? 0.3382 0.3337 0.2823 -0.0092 -0.0169 -0.0122 85 THR L CB +3807 O OG1 . THR C 87 ? 0.3514 0.3464 0.2966 -0.0059 -0.0183 -0.0143 85 THR L OG1 +3808 C CG2 . THR C 87 ? 0.3317 0.3365 0.2812 -0.0107 -0.0174 -0.0133 85 THR L CG2 +3809 N N . TYR C 88 ? 0.2845 0.2896 0.2251 -0.0106 -0.0129 -0.0064 86 TYR L N +3810 C CA . TYR C 88 ? 0.2978 0.3055 0.2382 -0.0137 -0.0101 -0.0038 86 TYR L CA +3811 C C . TYR C 88 ? 0.3245 0.3394 0.2728 -0.0155 -0.0091 -0.0061 86 TYR L C +3812 O O . TYR C 88 ? 0.3374 0.3569 0.2895 -0.0132 -0.0091 -0.0095 86 TYR L O +3813 C CB . TYR C 88 ? 0.3681 0.3801 0.3024 -0.0124 -0.0086 -0.0016 86 TYR L CB +3814 C CG . TYR C 88 ? 0.3142 0.3212 0.2436 -0.0103 -0.0098 0.0039 86 TYR L CG +3815 C CD1 . TYR C 88 ? 0.3356 0.3432 0.2644 -0.0066 -0.0128 0.0039 86 TYR L CD1 +3816 C CD2 . TYR C 88 ? 0.3023 0.3043 0.2298 -0.0119 -0.0075 0.0100 86 TYR L CD2 +3817 C CE1 . TYR C 88 ? 0.3191 0.3234 0.2469 -0.0039 -0.0135 0.0109 86 TYR L CE1 +3818 C CE2 . TYR C 88 ? 0.3788 0.3758 0.3048 -0.0091 -0.0077 0.0168 86 TYR L CE2 +3819 C CZ . TYR C 88 ? 0.3474 0.3461 0.2743 -0.0047 -0.0106 0.0176 86 TYR L CZ +3820 O OH . TYR C 88 ? 0.3510 0.3461 0.2796 -0.0012 -0.0103 0.0262 86 TYR L OH +3821 N N . TYR C 89 ? 0.2797 0.2959 0.2317 -0.0198 -0.0078 -0.0034 87 TYR L N +3822 C CA . TYR C 89 ? 0.2722 0.2973 0.2348 -0.0215 -0.0068 -0.0029 87 TYR L CA +3823 C C . TYR C 89 ? 0.2994 0.3292 0.2643 -0.0237 -0.0024 0.0001 87 TYR L C +3824 O O . TYR C 89 ? 0.3002 0.3254 0.2599 -0.0269 -0.0018 0.0030 87 TYR L O +3825 C CB . TYR C 89 ? 0.2705 0.2963 0.2377 -0.0265 -0.0107 -0.0014 87 TYR L CB +3826 C CG . TYR C 89 ? 0.2975 0.3199 0.2630 -0.0254 -0.0145 -0.0041 87 TYR L CG +3827 C CD1 . TYR C 89 ? 0.3092 0.3385 0.2828 -0.0226 -0.0156 -0.0046 87 TYR L CD1 +3828 C CD2 . TYR C 89 ? 0.3093 0.3208 0.2658 -0.0270 -0.0158 -0.0059 87 TYR L CD2 +3829 C CE1 . TYR C 89 ? 0.3191 0.3456 0.2908 -0.0219 -0.0189 -0.0066 87 TYR L CE1 +3830 C CE2 . TYR C 89 ? 0.3415 0.3498 0.2960 -0.0262 -0.0182 -0.0087 87 TYR L CE2 +3831 C CZ . TYR C 89 ? 0.3334 0.3498 0.2950 -0.0239 -0.0202 -0.0089 87 TYR L CZ +3832 O OH . TYR C 89 ? 0.3140 0.3277 0.2734 -0.0234 -0.0224 -0.0110 87 TYR L OH +3833 N N . CYS C 90 ? 0.2882 0.3265 0.2617 -0.0220 0.0018 -0.0003 88 CYS L N +3834 C CA . CYS C 90 ? 0.2780 0.3226 0.2573 -0.0245 0.0068 0.0032 88 CYS L CA +3835 C C . CYS C 90 ? 0.2732 0.3267 0.2674 -0.0277 0.0049 0.0077 88 CYS L C +3836 O O . CYS C 90 ? 0.2870 0.3434 0.2878 -0.0270 0.0009 0.0080 88 CYS L O +3837 C CB . CYS C 90 ? 0.3390 0.3876 0.3198 -0.0211 0.0144 0.0001 88 CYS L CB +3838 S SG . CYS C 90 ? 0.3965 0.4496 0.3912 -0.0162 0.0174 -0.0033 88 CYS L SG +3839 N N . GLN C 91 ? 0.2770 0.3360 0.2766 -0.0319 0.0074 0.0122 89 GLN L N +3840 C CA . GLN C 91 ? 0.2737 0.3443 0.2882 -0.0363 0.0049 0.0180 89 GLN L CA +3841 C C . GLN C 91 ? 0.3030 0.3836 0.3294 -0.0367 0.0119 0.0224 89 GLN L C +3842 O O . GLN C 91 ? 0.3169 0.3936 0.3357 -0.0388 0.0157 0.0224 89 GLN L O +3843 C CB . GLN C 91 ? 0.2780 0.3444 0.2858 -0.0448 -0.0013 0.0195 89 GLN L CB +3844 C CG . GLN C 91 ? 0.2925 0.3727 0.3135 -0.0521 -0.0055 0.0258 89 GLN L CG +3845 C CD . GLN C 91 ? 0.3711 0.4451 0.3826 -0.0627 -0.0095 0.0255 89 GLN L CD +3846 O OE1 . GLN C 91 ? 0.3684 0.4323 0.3709 -0.0648 -0.0061 0.0241 89 GLN L OE1 +3847 N NE2 . GLN C 91 ? 0.3838 0.4635 0.3967 -0.0701 -0.0163 0.0270 89 GLN L NE2 +3848 N N . GLN C 92 ? 0.2737 0.3678 0.3199 -0.0345 0.0141 0.0270 90 GLN L N +3849 C CA . GLN C 92 ? 0.3346 0.4401 0.3963 -0.0343 0.0217 0.0322 90 GLN L CA +3850 C C . GLN C 92 ? 0.4031 0.5182 0.4713 -0.0433 0.0168 0.0395 90 GLN L C +3851 O O . GLN C 92 ? 0.3674 0.4893 0.4407 -0.0484 0.0083 0.0435 90 GLN L O +3852 C CB . GLN C 92 ? 0.3011 0.4173 0.3848 -0.0277 0.0269 0.0357 90 GLN L CB +3853 C CG . GLN C 92 ? 0.3921 0.5175 0.4928 -0.0246 0.0388 0.0392 90 GLN L CG +3854 C CD . GLN C 92 ? 0.5499 0.6873 0.6776 -0.0183 0.0432 0.0455 90 GLN L CD +3855 O OE1 . GLN C 92 ? 0.4242 0.5603 0.5546 -0.0152 0.0385 0.0456 90 GLN L OE1 +3856 N NE2 . GLN C 92 ? 0.6251 0.7745 0.7743 -0.0161 0.0527 0.0519 90 GLN L NE2 +3857 N N . LEU C 93 ? 0.4469 0.5625 0.5137 -0.0464 0.0220 0.0409 91 LEU L N +3858 C CA . LEU C 93 ? 0.4997 0.6229 0.5713 -0.0562 0.0182 0.0470 91 LEU L CA +3859 C C . LEU C 93 ? 0.4177 0.5616 0.5154 -0.0562 0.0228 0.0561 91 LEU L C +3860 O O . LEU C 93 ? 0.4706 0.6179 0.5780 -0.0489 0.0331 0.0562 91 LEU L O +3861 C CB . LEU C 93 ? 0.6264 0.7373 0.6815 -0.0602 0.0212 0.0443 91 LEU L CB +3862 C CG . LEU C 93 ? 0.6592 0.7505 0.6913 -0.0592 0.0178 0.0372 91 LEU L CG +3863 C CD1 . LEU C 93 ? 0.6389 0.7197 0.6576 -0.0598 0.0233 0.0365 91 LEU L CD1 +3864 C CD2 . LEU C 93 ? 0.6068 0.6931 0.6331 -0.0670 0.0087 0.0365 91 LEU L CD2 +3865 N N . ASN C 94 ? 0.3297 0.4877 0.4387 -0.0650 0.0154 0.0637 92 ASN L N +3866 C CA . ASN C 94 ? 0.3874 0.5691 0.5246 -0.0661 0.0177 0.0750 92 ASN L CA +3867 C C . ASN C 94 ? 0.3864 0.5771 0.5437 -0.0548 0.0231 0.0786 92 ASN L C +3868 O O . ASN C 94 ? 0.3826 0.5847 0.5612 -0.0494 0.0330 0.0842 92 ASN L O +3869 C CB . ASN C 94 ? 0.5198 0.7045 0.6616 -0.0681 0.0267 0.0772 92 ASN L CB +3870 C CG . ASN C 94 ? 0.8036 1.0122 0.9685 -0.0767 0.0236 0.0892 92 ASN L CG +3871 O OD1 . ASN C 94 ? 0.8840 1.1102 1.0654 -0.0794 0.0159 0.0974 92 ASN L OD1 +3872 N ND2 . ASN C 94 ? 0.8472 1.0578 1.0134 -0.0818 0.0292 0.0912 92 ASN L ND2 +3873 N N . SER C 95 ? 0.3570 0.5421 0.5088 -0.0512 0.0175 0.0756 93 SER L N +3874 C CA . SER C 95 ? 0.3250 0.5159 0.4950 -0.0407 0.0224 0.0788 93 SER L CA +3875 C C . SER C 95 ? 0.3567 0.5721 0.5524 -0.0434 0.0150 0.0934 93 SER L C +3876 O O . SER C 95 ? 0.3931 0.6195 0.5872 -0.0548 0.0039 0.0989 93 SER L O +3877 C CB . SER C 95 ? 0.3486 0.5212 0.4999 -0.0354 0.0206 0.0687 93 SER L CB +3878 O OG . SER C 95 ? 0.3525 0.5238 0.4919 -0.0424 0.0076 0.0686 93 SER L OG +3879 N N . TYR C 96 ? 0.3402 0.5645 0.5604 -0.0333 0.0219 0.1000 94 TYR L N +3880 C CA . TYR C 96 ? 0.3428 0.5924 0.5922 -0.0335 0.0162 0.1165 94 TYR L CA +3881 C C . TYR C 96 ? 0.4747 0.7186 0.7305 -0.0234 0.0185 0.1164 94 TYR L C +3882 O O . TYR C 96 ? 0.4892 0.7283 0.7604 -0.0119 0.0326 0.1156 94 TYR L O +3883 C CB . TYR C 96 ? 0.4682 0.7386 0.7507 -0.0303 0.0252 0.1291 94 TYR L CB +3884 C CG . TYR C 96 ? 0.4978 0.7811 0.7800 -0.0425 0.0197 0.1337 94 TYR L CG +3885 C CD1 . TYR C 96 ? 0.4870 0.7560 0.7517 -0.0452 0.0266 0.1235 94 TYR L CD1 +3886 C CD2 . TYR C 96 ? 0.5284 0.8390 0.8274 -0.0524 0.0075 0.1488 94 TYR L CD2 +3887 C CE1 . TYR C 96 ? 0.4970 0.7768 0.7618 -0.0568 0.0222 0.1277 94 TYR L CE1 +3888 C CE2 . TYR C 96 ? 0.5481 0.8705 0.8465 -0.0651 0.0026 0.1525 94 TYR L CE2 +3889 C CZ . TYR C 96 ? 0.5612 0.8672 0.8429 -0.0669 0.0104 0.1417 94 TYR L CZ +3890 O OH . TYR C 96 ? 0.5508 0.8674 0.8325 -0.0799 0.0062 0.1453 94 TYR L OH +3891 N N . PRO C 97 ? 0.4821 0.7247 0.7256 -0.0276 0.0062 0.1164 95 PRO L N +3892 C CA . PRO C 97 ? 0.4473 0.6955 0.6734 -0.0417 -0.0094 0.1174 95 PRO L CA +3893 C C . PRO C 97 ? 0.4643 0.6900 0.6559 -0.0485 -0.0110 0.1015 95 PRO L C +3894 O O . PRO C 97 ? 0.3742 0.5791 0.5520 -0.0415 -0.0023 0.0895 95 PRO L O +3895 C CB . PRO C 97 ? 0.5036 0.7528 0.7280 -0.0403 -0.0172 0.1205 95 PRO L CB +3896 C CG . PRO C 97 ? 0.5326 0.7618 0.7546 -0.0271 -0.0060 0.1111 95 PRO L CG +3897 C CD . PRO C 97 ? 0.5100 0.7402 0.7517 -0.0184 0.0092 0.1122 95 PRO L CD +3898 N N . PRO C 98 ? 0.4199 0.6502 0.5985 -0.0624 -0.0216 0.1020 96 PRO L N +3899 C CA . PRO C 98 ? 0.3686 0.5789 0.5197 -0.0689 -0.0213 0.0893 96 PRO L CA +3900 C C . PRO C 98 ? 0.2575 0.4429 0.3823 -0.0656 -0.0217 0.0760 96 PRO L C +3901 O O . PRO C 98 ? 0.3446 0.5293 0.4667 -0.0637 -0.0266 0.0760 96 PRO L O +3902 C CB . PRO C 98 ? 0.3807 0.6035 0.5274 -0.0857 -0.0323 0.0940 96 PRO L CB +3903 C CG . PRO C 98 ? 0.3538 0.6080 0.5308 -0.0875 -0.0365 0.1112 96 PRO L CG +3904 C CD . PRO C 98 ? 0.3660 0.6221 0.5572 -0.0739 -0.0332 0.1154 96 PRO L CD +3905 N N . TYR C 99 ? 0.3007 0.4668 0.4073 -0.0648 -0.0162 0.0656 97 TYR L N +3906 C CA . TYR C 99 ? 0.3487 0.4917 0.4293 -0.0640 -0.0173 0.0538 97 TYR L CA +3907 C C . TYR C 99 ? 0.3934 0.5294 0.4727 -0.0539 -0.0160 0.0500 97 TYR L C +3908 O O . TYR C 99 ? 0.3407 0.4676 0.4061 -0.0555 -0.0213 0.0452 97 TYR L O +3909 C CB . TYR C 99 ? 0.3787 0.5180 0.4438 -0.0769 -0.0263 0.0515 97 TYR L CB +3910 C CG . TYR C 99 ? 0.3757 0.5226 0.4427 -0.0891 -0.0280 0.0552 97 TYR L CG +3911 C CD1 . TYR C 99 ? 0.5106 0.6436 0.5668 -0.0910 -0.0226 0.0501 97 TYR L CD1 +3912 C CD2 . TYR C 99 ? 0.4355 0.6046 0.5156 -0.0991 -0.0354 0.0648 97 TYR L CD2 +3913 C CE1 . TYR C 99 ? 0.5618 0.7011 0.6203 -0.1027 -0.0236 0.0535 97 TYR L CE1 +3914 C CE2 . TYR C 99 ? 0.5710 0.7485 0.6535 -0.1115 -0.0373 0.0682 97 TYR L CE2 +3915 C CZ . TYR C 99 ? 0.6328 0.7943 0.7044 -0.1133 -0.0310 0.0620 97 TYR L CZ +3916 O OH . TYR C 99 ? 0.6298 0.7989 0.7042 -0.1264 -0.0324 0.0653 97 TYR L OH +3917 N N . THR C 100 ? 0.2955 0.4344 0.3889 -0.0437 -0.0077 0.0514 98 THR L N +3918 C CA . THR C 100 ? 0.2891 0.4189 0.3803 -0.0346 -0.0048 0.0463 98 THR L CA +3919 C C . THR C 100 ? 0.2531 0.3620 0.3198 -0.0329 -0.0033 0.0345 98 THR L C +3920 O O . THR C 100 ? 0.2871 0.3891 0.3453 -0.0331 0.0016 0.0306 98 THR L O +3921 C CB . THR C 100 ? 0.3902 0.5256 0.5016 -0.0252 0.0059 0.0491 98 THR L CB +3922 O OG1 . THR C 100 ? 0.3342 0.4908 0.4720 -0.0259 0.0052 0.0623 98 THR L OG1 +3923 C CG2 . THR C 100 ? 0.3756 0.5019 0.4862 -0.0171 0.0090 0.0440 98 THR L CG2 +3924 N N . PHE C 101 ? 0.2816 0.3819 0.3378 -0.0315 -0.0078 0.0299 99 PHE L N +3925 C CA . PHE C 101 ? 0.2950 0.3779 0.3312 -0.0291 -0.0068 0.0203 99 PHE L CA +3926 C C . PHE C 101 ? 0.3003 0.3785 0.3386 -0.0206 -0.0014 0.0156 99 PHE L C +3927 O O . PHE C 101 ? 0.2970 0.3813 0.3488 -0.0169 -0.0008 0.0187 99 PHE L O +3928 C CB . PHE C 101 ? 0.2542 0.3299 0.2771 -0.0336 -0.0145 0.0177 99 PHE L CB +3929 C CG . PHE C 101 ? 0.2775 0.3503 0.2910 -0.0429 -0.0182 0.0181 99 PHE L CG +3930 C CD1 . PHE C 101 ? 0.2945 0.3537 0.2937 -0.0438 -0.0157 0.0133 99 PHE L CD1 +3931 C CD2 . PHE C 101 ? 0.2940 0.3778 0.3127 -0.0517 -0.0242 0.0235 99 PHE L CD2 +3932 C CE1 . PHE C 101 ? 0.3215 0.3754 0.3127 -0.0526 -0.0177 0.0131 99 PHE L CE1 +3933 C CE2 . PHE C 101 ? 0.3514 0.4310 0.3602 -0.0620 -0.0267 0.0224 99 PHE L CE2 +3934 C CZ . PHE C 101 ? 0.3486 0.4118 0.3438 -0.0622 -0.0228 0.0167 99 PHE L CZ +3935 N N . GLY C 102 ? 0.2689 0.3360 0.2930 -0.0183 0.0022 0.0083 100 GLY L N +3936 C CA . GLY C 102 ? 0.2600 0.3206 0.2805 -0.0128 0.0051 0.0021 100 GLY L CA +3937 C C . GLY C 102 ? 0.3340 0.3899 0.3486 -0.0129 -0.0020 0.0006 100 GLY L C +3938 O O . GLY C 102 ? 0.3126 0.3672 0.3212 -0.0174 -0.0083 0.0025 100 GLY L O +3939 N N . GLN C 103 ? 0.2591 0.3114 0.2747 -0.0084 -0.0000 -0.0036 101 GLN L N +3940 C CA . GLN C 103 ? 0.2999 0.3487 0.3116 -0.0082 -0.0059 -0.0045 101 GLN L CA +3941 C C . GLN C 103 ? 0.3615 0.4007 0.3560 -0.0089 -0.0090 -0.0097 101 GLN L C +3942 O O . GLN C 103 ? 0.3352 0.3710 0.3260 -0.0088 -0.0131 -0.0108 101 GLN L O +3943 C CB . GLN C 103 ? 0.4899 0.5395 0.5122 -0.0035 -0.0025 -0.0057 101 GLN L CB +3944 C CG . GLN C 103 ? 0.7887 0.8479 0.8320 -0.0013 0.0023 0.0010 101 GLN L CG +3945 C CD . GLN C 103 ? 1.0058 1.0651 1.0538 0.0006 0.0120 -0.0015 101 GLN L CD +3946 O OE1 . GLN C 103 ? 0.9375 0.9895 0.9716 0.0000 0.0152 -0.0092 101 GLN L OE1 +3947 N NE2 . GLN C 103 ? 1.0096 1.0783 1.0773 0.0025 0.0168 0.0057 101 GLN L NE2 +3948 N N . GLY C 104 ? 0.3209 0.3566 0.3061 -0.0094 -0.0068 -0.0120 102 GLY L N +3949 C CA . GLY C 104 ? 0.2949 0.3231 0.2668 -0.0099 -0.0100 -0.0138 102 GLY L CA +3950 C C . GLY C 104 ? 0.3484 0.3744 0.3139 -0.0071 -0.0088 -0.0185 102 GLY L C +3951 O O . GLY C 104 ? 0.3250 0.3526 0.2953 -0.0052 -0.0068 -0.0220 102 GLY L O +3952 N N . THR C 105 ? 0.3179 0.3408 0.2730 -0.0075 -0.0100 -0.0180 103 THR L N +3953 C CA . THR C 105 ? 0.3036 0.3269 0.2516 -0.0062 -0.0108 -0.0208 103 THR L CA +3954 C C . THR C 105 ? 0.3261 0.3451 0.2699 -0.0049 -0.0151 -0.0178 103 THR L C +3955 O O . THR C 105 ? 0.3580 0.3734 0.2988 -0.0055 -0.0153 -0.0133 103 THR L O +3956 C CB . THR C 105 ? 0.3800 0.4068 0.3201 -0.0081 -0.0076 -0.0210 103 THR L CB +3957 O OG1 . THR C 105 ? 0.3537 0.3834 0.2982 -0.0091 -0.0015 -0.0250 103 THR L OG1 +3958 C CG2 . THR C 105 ? 0.4305 0.4602 0.3618 -0.0085 -0.0102 -0.0224 103 THR L CG2 +3959 N N . LYS C 106 ? 0.3257 0.3446 0.2706 -0.0030 -0.0176 -0.0199 104 LYS L N +3960 C CA . LYS C 106 ? 0.2891 0.3043 0.2324 -0.0009 -0.0203 -0.0168 104 LYS L CA +3961 C C . LYS C 106 ? 0.3236 0.3445 0.2620 -0.0002 -0.0222 -0.0146 104 LYS L C +3962 O O . LYS C 106 ? 0.3791 0.4060 0.3162 -0.0013 -0.0231 -0.0184 104 LYS L O +3963 C CB . LYS C 106 ? 0.3527 0.3658 0.3010 0.0006 -0.0218 -0.0194 104 LYS L CB +3964 C CG . LYS C 106 ? 0.4139 0.4218 0.3620 0.0030 -0.0226 -0.0163 104 LYS L CG +3965 C CD . LYS C 106 ? 0.5502 0.5554 0.5022 0.0037 -0.0230 -0.0191 104 LYS L CD +3966 C CE . LYS C 106 ? 0.6051 0.6028 0.5571 0.0056 -0.0214 -0.0169 104 LYS L CE +3967 N NZ . LYS C 106 ? 0.6917 0.6871 0.6460 0.0056 -0.0210 -0.0199 104 LYS L NZ +3968 N N . LEU C 107 ? 0.3430 0.3624 0.2788 0.0009 -0.0226 -0.0079 105 LEU L N +3969 C CA . LEU C 107 ? 0.3496 0.3768 0.2814 0.0013 -0.0253 -0.0026 105 LEU L CA +3970 C C . LEU C 107 ? 0.3724 0.3994 0.3103 0.0054 -0.0276 0.0016 105 LEU L C +3971 O O . LEU C 107 ? 0.3641 0.3820 0.3066 0.0085 -0.0253 0.0051 105 LEU L O +3972 C CB . LEU C 107 ? 0.3558 0.3824 0.2834 0.0006 -0.0238 0.0045 105 LEU L CB +3973 C CG . LEU C 107 ? 0.4290 0.4653 0.3523 0.0005 -0.0269 0.0131 105 LEU L CG +3974 C CD1 . LEU C 107 ? 0.5212 0.5695 0.4364 -0.0044 -0.0292 0.0084 105 LEU L CD1 +3975 C CD2 . LEU C 107 ? 0.4326 0.4660 0.3526 -0.0002 -0.0243 0.0202 105 LEU L CD2 +3976 N N . GLU C 108 ? 0.3371 0.3738 0.2754 0.0049 -0.0312 0.0010 106 GLU L N +3977 C CA . GLU C 108 ? 0.3542 0.3928 0.3004 0.0088 -0.0332 0.0047 106 GLU L CA +3978 C C . GLU C 108 ? 0.3402 0.3932 0.2864 0.0086 -0.0380 0.0133 106 GLU L C +3979 O O . GLU C 108 ? 0.3516 0.4133 0.2892 0.0041 -0.0402 0.0148 106 GLU L O +3980 C CB . GLU C 108 ? 0.3772 0.4157 0.3267 0.0080 -0.0336 -0.0035 106 GLU L CB +3981 C CG . GLU C 108 ? 0.5235 0.5502 0.4740 0.0082 -0.0297 -0.0095 106 GLU L CG +3982 C CD . GLU C 108 ? 0.5767 0.6028 0.5315 0.0079 -0.0298 -0.0156 106 GLU L CD +3983 O OE1 . GLU C 108 ? 0.6024 0.6332 0.5558 0.0049 -0.0304 -0.0209 106 GLU L OE1 +3984 O OE2 . GLU C 108 ? 0.6367 0.6568 0.5960 0.0104 -0.0283 -0.0153 106 GLU L OE2 +3985 N N . ILE C 109 ? 0.3257 0.3821 0.2819 0.0130 -0.0394 0.0195 107 ILE L N +3986 C CA . ILE C 109 ? 0.2926 0.3647 0.2526 0.0136 -0.0445 0.0310 107 ILE L CA +3987 C C . ILE C 109 ? 0.3436 0.4308 0.3004 0.0077 -0.0503 0.0267 107 ILE L C +3988 O O . ILE C 109 ? 0.3599 0.4455 0.3216 0.0079 -0.0500 0.0201 107 ILE L O +3989 C CB . ILE C 109 ? 0.3788 0.4483 0.3543 0.0217 -0.0421 0.0409 107 ILE L CB +3990 C CG1 . ILE C 109 ? 0.4586 0.5109 0.4363 0.0263 -0.0349 0.0439 107 ILE L CG1 +3991 C CG2 . ILE C 109 ? 0.4213 0.5106 0.4039 0.0227 -0.0482 0.0554 107 ILE L CG2 +3992 C CD1 . ILE C 109 ? 0.5298 0.5722 0.5217 0.0338 -0.0287 0.0486 107 ILE L CD1 +3993 N N . LYS C 110 ? 0.3707 0.4728 0.3185 0.0015 -0.0554 0.0305 108 LYS L N +3994 C CA . LYS C 110 ? 0.3595 0.4769 0.3023 -0.0064 -0.0610 0.0263 108 LYS L CA +3995 C C . LYS C 110 ? 0.3362 0.4687 0.2925 -0.0038 -0.0666 0.0373 108 LYS L C +3996 O O . LYS C 110 ? 0.3321 0.4700 0.2982 0.0022 -0.0678 0.0520 108 LYS L O +3997 C CB . LYS C 110 ? 0.3636 0.4925 0.2901 -0.0157 -0.0643 0.0264 108 LYS L CB +3998 C CG . LYS C 110 ? 0.4406 0.5854 0.3589 -0.0265 -0.0698 0.0209 108 LYS L CG +3999 C CD . LYS C 110 ? 0.6774 0.8300 0.5758 -0.0373 -0.0707 0.0173 108 LYS L CD +4000 C CE . LYS C 110 ? 0.9594 1.1340 0.8546 -0.0407 -0.0790 0.0336 108 LYS L CE +4001 N NZ . LYS C 110 ? 1.0639 1.2559 0.9409 -0.0560 -0.0840 0.0287 108 LYS L NZ +4002 N N . ARG C 111 ? 0.3653 0.5046 0.3237 -0.0082 -0.0692 0.0307 109 ARG L N +4003 C CA . ARG C 111 ? 0.3859 0.5442 0.3565 -0.0082 -0.0756 0.0408 109 ARG L CA +4004 C C . ARG C 111 ? 0.3780 0.5466 0.3411 -0.0194 -0.0798 0.0306 109 ARG L C +4005 O O . ARG C 111 ? 0.3614 0.5202 0.3113 -0.0257 -0.0764 0.0161 109 ARG L O +4006 C CB . ARG C 111 ? 0.3557 0.5060 0.3456 0.0026 -0.0713 0.0455 109 ARG L CB +4007 C CG . ARG C 111 ? 0.3063 0.4386 0.2961 0.0039 -0.0651 0.0310 109 ARG L CG +4008 C CD . ARG C 111 ? 0.3546 0.4885 0.3618 0.0097 -0.0635 0.0345 109 ARG L CD +4009 N NE . ARG C 111 ? 0.3820 0.5369 0.3937 0.0033 -0.0707 0.0369 109 ARG L NE +4010 C CZ . ARG C 111 ? 0.3606 0.5287 0.3900 0.0073 -0.0727 0.0472 109 ARG L CZ +4011 N NH1 . ARG C 111 ? 0.2937 0.4544 0.3382 0.0185 -0.0666 0.0557 109 ARG L NH1 +4012 N NH2 . ARG C 111 ? 0.3094 0.4982 0.3416 -0.0006 -0.0801 0.0489 109 ARG L NH2 +4013 N N . THR C 112 ? 0.3228 0.5111 0.2956 -0.0220 -0.0866 0.0384 110 THR L N +4014 C CA . THR C 112 ? 0.3238 0.5219 0.2896 -0.0341 -0.0904 0.0283 110 THR L CA +4015 C C . THR C 112 ? 0.3481 0.5297 0.3199 -0.0316 -0.0841 0.0155 110 THR L C +4016 O O . THR C 112 ? 0.3113 0.4798 0.2954 -0.0207 -0.0787 0.0173 110 THR L O +4017 C CB . THR C 112 ? 0.4056 0.6326 0.3807 -0.0390 -0.1004 0.0412 110 THR L CB +4018 O OG1 . THR C 112 ? 0.4168 0.6453 0.4155 -0.0270 -0.0992 0.0527 110 THR L OG1 +4019 C CG2 . THR C 112 ? 0.4386 0.6843 0.4059 -0.0435 -0.1076 0.0544 110 THR L CG2 +4020 N N . VAL C 113 ? 0.3652 0.5469 0.3270 -0.0427 -0.0841 0.0020 111 VAL L N +4021 C CA . VAL C 113 ? 0.3409 0.5075 0.3075 -0.0416 -0.0780 -0.0099 111 VAL L CA +4022 C C . VAL C 113 ? 0.3254 0.4998 0.3112 -0.0363 -0.0800 -0.0022 111 VAL L C +4023 O O . VAL C 113 ? 0.3094 0.5059 0.3024 -0.0398 -0.0876 0.0078 111 VAL L O +4024 C CB . VAL C 113 ? 0.4137 0.5802 0.3670 -0.0557 -0.0771 -0.0246 111 VAL L CB +4025 C CG1 . VAL C 113 ? 0.3722 0.5258 0.3332 -0.0552 -0.0715 -0.0345 111 VAL L CG1 +4026 C CG2 . VAL C 113 ? 0.4563 0.6115 0.3919 -0.0597 -0.0721 -0.0334 111 VAL L CG2 +4027 N N . ALA C 114 ? 0.3435 0.5012 0.3381 -0.0280 -0.0732 -0.0059 112 ALA L N +4028 C CA . ALA C 114 ? 0.3451 0.5074 0.3576 -0.0225 -0.0729 -0.0002 112 ALA L CA +4029 C C . ALA C 114 ? 0.3044 0.4507 0.3180 -0.0226 -0.0666 -0.0117 112 ALA L C +4030 O O . ALA C 114 ? 0.3262 0.4537 0.3356 -0.0175 -0.0602 -0.0170 112 ALA L O +4031 C CB . ALA C 114 ? 0.3411 0.4994 0.3652 -0.0095 -0.0700 0.0116 112 ALA L CB +4032 N N . ALA C 115 ? 0.3304 0.4853 0.3507 -0.0287 -0.0684 -0.0144 113 ALA L N +4033 C CA . ALA C 115 ? 0.3367 0.4774 0.3592 -0.0293 -0.0623 -0.0240 113 ALA L CA +4034 C C . ALA C 115 ? 0.2960 0.4275 0.3302 -0.0180 -0.0570 -0.0191 113 ALA L C +4035 O O . ALA C 115 ? 0.3314 0.4724 0.3772 -0.0120 -0.0582 -0.0087 113 ALA L O +4036 C CB . ALA C 115 ? 0.3905 0.5433 0.4173 -0.0398 -0.0655 -0.0280 113 ALA L CB +4037 N N . PRO C 116 ? 0.3500 0.4637 0.3819 -0.0156 -0.0505 -0.0261 114 PRO L N +4038 C CA . PRO C 116 ? 0.3115 0.4170 0.3517 -0.0071 -0.0452 -0.0225 114 PRO L CA +4039 C C . PRO C 116 ? 0.3403 0.4547 0.3936 -0.0084 -0.0450 -0.0204 114 PRO L C +4040 O O . PRO C 116 ? 0.2950 0.4156 0.3497 -0.0167 -0.0472 -0.0251 114 PRO L O +4041 C CB . PRO C 116 ? 0.3327 0.4199 0.3653 -0.0064 -0.0398 -0.0300 114 PRO L CB +4042 C CG . PRO C 116 ? 0.3488 0.4360 0.3764 -0.0153 -0.0408 -0.0383 114 PRO L CG +4043 C CD . PRO C 116 ? 0.3552 0.4564 0.3778 -0.0209 -0.0471 -0.0370 114 PRO L CD +4044 N N . SER C 117 ? 0.3143 0.4289 0.3776 -0.0007 -0.0414 -0.0135 115 SER L N +4045 C CA . SER C 117 ? 0.2996 0.4169 0.3745 -0.0003 -0.0379 -0.0126 115 SER L CA +4046 C C . SER C 117 ? 0.3162 0.4152 0.3848 0.0013 -0.0314 -0.0185 115 SER L C +4047 O O . SER C 117 ? 0.3147 0.4015 0.3757 0.0062 -0.0279 -0.0188 115 SER L O +4048 C CB . SER C 117 ? 0.3716 0.4971 0.4605 0.0073 -0.0354 -0.0025 115 SER L CB +4049 O OG . SER C 117 ? 0.4858 0.6316 0.5830 0.0052 -0.0425 0.0051 115 SER L OG +4050 N N . VAL C 118 ? 0.2573 0.3554 0.3292 -0.0036 -0.0300 -0.0226 116 VAL L N +4051 C CA . VAL C 118 ? 0.2385 0.3215 0.3050 -0.0034 -0.0249 -0.0270 116 VAL L CA +4052 C C . VAL C 118 ? 0.2645 0.3475 0.3394 -0.0011 -0.0195 -0.0239 116 VAL L C +4053 O O . VAL C 118 ? 0.2484 0.3431 0.3350 -0.0034 -0.0202 -0.0215 116 VAL L O +4054 C CB . VAL C 118 ? 0.3345 0.4139 0.3981 -0.0109 -0.0260 -0.0340 116 VAL L CB +4055 C CG1 . VAL C 118 ? 0.2988 0.3642 0.3597 -0.0098 -0.0207 -0.0358 116 VAL L CG1 +4056 C CG2 . VAL C 118 ? 0.3554 0.4348 0.4097 -0.0137 -0.0299 -0.0377 116 VAL L CG2 +4057 N N . PHE C 119 ? 0.2291 0.3003 0.2979 0.0026 -0.0142 -0.0237 117 PHE L N +4058 C CA . PHE C 119 ? 0.2633 0.3328 0.3367 0.0043 -0.0080 -0.0212 117 PHE L CA +4059 C C . PHE C 119 ? 0.3301 0.3879 0.3949 0.0026 -0.0051 -0.0231 117 PHE L C +4060 O O . PHE C 119 ? 0.3071 0.3569 0.3615 0.0033 -0.0063 -0.0245 117 PHE L O +4061 C CB . PHE C 119 ? 0.2346 0.3028 0.3081 0.0106 -0.0030 -0.0177 117 PHE L CB +4062 C CG . PHE C 119 ? 0.2787 0.3588 0.3628 0.0139 -0.0053 -0.0132 117 PHE L CG +4063 C CD1 . PHE C 119 ? 0.2880 0.3685 0.3675 0.0157 -0.0097 -0.0124 117 PHE L CD1 +4064 C CD2 . PHE C 119 ? 0.2824 0.3747 0.3825 0.0152 -0.0030 -0.0083 117 PHE L CD2 +4065 C CE1 . PHE C 119 ? 0.2680 0.3612 0.3583 0.0188 -0.0122 -0.0060 117 PHE L CE1 +4066 C CE2 . PHE C 119 ? 0.2841 0.3901 0.3965 0.0186 -0.0056 -0.0017 117 PHE L CE2 +4067 C CZ . PHE C 119 ? 0.3065 0.4130 0.4139 0.0204 -0.0104 -0.0001 117 PHE L CZ +4068 N N . ILE C 120 ? 0.2765 0.3345 0.3465 0.0004 -0.0015 -0.0218 118 ILE L N +4069 C CA . ILE C 120 ? 0.2461 0.2952 0.3093 -0.0012 0.0012 -0.0209 118 ILE L CA +4070 C C . ILE C 120 ? 0.3336 0.3815 0.3944 -0.0001 0.0078 -0.0179 118 ILE L C +4071 O O . ILE C 120 ? 0.3045 0.3589 0.3744 0.0007 0.0112 -0.0166 118 ILE L O +4072 C CB . ILE C 120 ? 0.2762 0.3247 0.3466 -0.0059 0.0005 -0.0215 118 ILE L CB +4073 C CG1 . ILE C 120 ? 0.3076 0.3480 0.3727 -0.0066 0.0027 -0.0181 118 ILE L CG1 +4074 C CG2 . ILE C 120 ? 0.2930 0.3490 0.3757 -0.0086 0.0028 -0.0205 118 ILE L CG2 +4075 C CD1 . ILE C 120 ? 0.2861 0.3226 0.3587 -0.0099 0.0026 -0.0185 118 ILE L CD1 +4076 N N . PHE C 121 ? 0.3174 0.3578 0.3658 -0.0006 0.0097 -0.0168 119 PHE L N +4077 C CA . PHE C 121 ? 0.3234 0.3615 0.3652 -0.0011 0.0166 -0.0151 119 PHE L CA +4078 C C . PHE C 121 ? 0.3453 0.3812 0.3817 -0.0054 0.0172 -0.0109 119 PHE L C +4079 O O . PHE C 121 ? 0.3335 0.3660 0.3625 -0.0069 0.0133 -0.0094 119 PHE L O +4080 C CB . PHE C 121 ? 0.2978 0.3297 0.3267 0.0005 0.0193 -0.0176 119 PHE L CB +4081 C CG . PHE C 121 ? 0.3124 0.3461 0.3477 0.0056 0.0198 -0.0197 119 PHE L CG +4082 C CD1 . PHE C 121 ? 0.3109 0.3479 0.3549 0.0087 0.0268 -0.0190 119 PHE L CD1 +4083 C CD2 . PHE C 121 ? 0.3642 0.3970 0.3979 0.0074 0.0139 -0.0212 119 PHE L CD2 +4084 C CE1 . PHE C 121 ? 0.3095 0.3494 0.3618 0.0140 0.0275 -0.0186 119 PHE L CE1 +4085 C CE2 . PHE C 121 ? 0.3595 0.3949 0.3995 0.0120 0.0142 -0.0212 119 PHE L CE2 +4086 C CZ . PHE C 121 ? 0.3586 0.3979 0.4086 0.0156 0.0208 -0.0193 119 PHE L CZ +4087 N N . PRO C 122 ? 0.3144 0.3530 0.3553 -0.0075 0.0220 -0.0079 120 PRO L N +4088 C CA . PRO C 122 ? 0.3081 0.3456 0.3431 -0.0118 0.0229 -0.0021 120 PRO L CA +4089 C C . PRO C 122 ? 0.3570 0.3910 0.3728 -0.0145 0.0252 -0.0018 120 PRO L C +4090 O O . PRO C 122 ? 0.3005 0.3313 0.3088 -0.0132 0.0290 -0.0070 120 PRO L O +4091 C CB . PRO C 122 ? 0.3164 0.3582 0.3608 -0.0132 0.0287 0.0005 120 PRO L CB +4092 C CG . PRO C 122 ? 0.3807 0.4273 0.4397 -0.0101 0.0285 -0.0037 120 PRO L CG +4093 C CD . PRO C 122 ? 0.3524 0.3970 0.4056 -0.0062 0.0266 -0.0084 120 PRO L CD +4094 N N . PRO C 123 ? 0.3283 0.3629 0.3361 -0.0190 0.0233 0.0046 121 PRO L N +4095 C CA . PRO C 123 ? 0.3749 0.4081 0.3624 -0.0243 0.0257 0.0050 121 PRO L CA +4096 C C . PRO C 123 ? 0.4356 0.4681 0.4172 -0.0265 0.0354 0.0025 121 PRO L C +4097 O O . PRO C 123 ? 0.4006 0.4364 0.3934 -0.0256 0.0392 0.0050 121 PRO L O +4098 C CB . PRO C 123 ? 0.4146 0.4526 0.3992 -0.0288 0.0208 0.0154 121 PRO L CB +4099 C CG . PRO C 123 ? 0.4028 0.4430 0.4068 -0.0260 0.0204 0.0205 121 PRO L CG +4100 C CD . PRO C 123 ? 0.3726 0.4099 0.3902 -0.0201 0.0199 0.0126 121 PRO L CD +4101 N N . SER C 124 ? 0.4230 0.4506 0.3872 -0.0298 0.0404 -0.0030 122 SER L N +4102 C CA . SER C 124 ? 0.4533 0.4785 0.4094 -0.0327 0.0517 -0.0064 122 SER L CA +4103 C C . SER C 124 ? 0.4766 0.5069 0.4216 -0.0408 0.0531 0.0008 122 SER L C +4104 O O . SER C 124 ? 0.4805 0.5152 0.4172 -0.0459 0.0456 0.0076 122 SER L O +4105 C CB . SER C 124 ? 0.4671 0.4831 0.4066 -0.0349 0.0580 -0.0153 122 SER L CB +4106 O OG . SER C 124 ? 0.4495 0.4650 0.3677 -0.0438 0.0540 -0.0143 122 SER L OG +4107 N N . ASP C 125 ? 0.5463 0.5772 0.4919 -0.0420 0.0630 0.0003 123 ASP L N +4108 C CA . ASP C 125 ? 0.5303 0.5661 0.4626 -0.0506 0.0656 0.0070 123 ASP L CA +4109 C C . ASP C 125 ? 0.4850 0.5189 0.3888 -0.0608 0.0657 0.0050 123 ASP L C +4110 O O . ASP C 125 ? 0.5144 0.5559 0.4069 -0.0687 0.0607 0.0141 123 ASP L O +4111 C CB . ASP C 125 ? 0.6502 0.6861 0.5863 -0.0506 0.0781 0.0053 123 ASP L CB +4112 C CG . ASP C 125 ? 0.7801 0.8211 0.7435 -0.0434 0.0770 0.0096 123 ASP L CG +4113 O OD1 . ASP C 125 ? 0.8267 0.8675 0.8007 -0.0398 0.0863 0.0058 123 ASP L OD1 +4114 O OD2 . ASP C 125 ? 0.7875 0.8327 0.7625 -0.0419 0.0673 0.0168 123 ASP L OD2 +4115 N N . GLU C 126 ? 0.4953 0.5197 0.3878 -0.0614 0.0714 -0.0062 124 GLU L N +4116 C CA . GLU C 126 ? 0.5911 0.6127 0.4551 -0.0729 0.0721 -0.0100 124 GLU L CA +4117 C C . GLU C 126 ? 0.5646 0.5939 0.4251 -0.0764 0.0572 -0.0021 124 GLU L C +4118 O O . GLU C 126 ? 0.5501 0.5867 0.3915 -0.0877 0.0533 0.0036 124 GLU L O +4119 C CB . GLU C 126 ? 0.7317 0.7392 0.5879 -0.0718 0.0817 -0.0241 124 GLU L CB +4120 C CG . GLU C 126 ? 0.9264 0.9285 0.7507 -0.0858 0.0859 -0.0310 124 GLU L CG +4121 C CD . GLU C 126 ? 1.0667 1.0533 0.8859 -0.0841 0.0933 -0.0441 124 GLU L CD +4122 O OE1 . GLU C 126 ? 1.1116 1.0921 0.9522 -0.0716 0.0975 -0.0473 124 GLU L OE1 +4123 O OE2 . GLU C 126 ? 1.1352 1.1164 0.9296 -0.0959 0.0949 -0.0506 124 GLU L OE2 +4124 N N . GLN C 127 ? 0.4667 0.4958 0.3458 -0.0672 0.0489 -0.0009 125 GLN L N +4125 C CA . GLN C 127 ? 0.4592 0.4961 0.3383 -0.0695 0.0359 0.0074 125 GLN L CA +4126 C C . GLN C 127 ? 0.4591 0.5084 0.3451 -0.0715 0.0297 0.0226 125 GLN L C +4127 O O . GLN C 127 ? 0.4959 0.5549 0.3721 -0.0791 0.0221 0.0318 125 GLN L O +4128 C CB . GLN C 127 ? 0.4425 0.4759 0.3403 -0.0591 0.0299 0.0051 125 GLN L CB +4129 C CG . GLN C 127 ? 0.4548 0.4955 0.3526 -0.0614 0.0181 0.0127 125 GLN L CG +4130 C CD . GLN C 127 ? 0.4427 0.4811 0.3600 -0.0514 0.0125 0.0117 125 GLN L CD +4131 O OE1 . GLN C 127 ? 0.4117 0.4460 0.3455 -0.0429 0.0152 0.0084 125 GLN L OE1 +4132 N NE2 . GLN C 127 ? 0.3852 0.4273 0.3003 -0.0533 0.0046 0.0149 125 GLN L NE2 +4133 N N . LEU C 128 ? 0.4728 0.5229 0.3767 -0.0652 0.0330 0.0263 126 LEU L N +4134 C CA . LEU C 128 ? 0.5241 0.5842 0.4378 -0.0661 0.0282 0.0413 126 LEU L CA +4135 C C . LEU C 128 ? 0.6142 0.6831 0.5060 -0.0784 0.0289 0.0492 126 LEU L C +4136 O O . LEU C 128 ? 0.6532 0.7334 0.5468 -0.0820 0.0210 0.0640 126 LEU L O +4137 C CB . LEU C 128 ? 0.5315 0.5893 0.4659 -0.0589 0.0336 0.0420 126 LEU L CB +4138 C CG . LEU C 128 ? 0.5597 0.6130 0.5180 -0.0485 0.0300 0.0387 126 LEU L CG +4139 C CD1 . LEU C 128 ? 0.6347 0.6870 0.6120 -0.0438 0.0352 0.0389 126 LEU L CD1 +4140 C CD2 . LEU C 128 ? 0.5343 0.5919 0.5017 -0.0469 0.0203 0.0481 126 LEU L CD2 +4141 N N . LYS C 129 ? 0.6320 0.6963 0.5032 -0.0854 0.0386 0.0401 127 LYS L N +4142 C CA . LYS C 129 ? 0.7414 0.8140 0.5864 -0.0996 0.0396 0.0454 127 LYS L CA +4143 C C . LYS C 129 ? 0.7871 0.8691 0.6185 -0.1080 0.0282 0.0518 127 LYS L C +4144 O O . LYS C 129 ? 0.7620 0.8572 0.5785 -0.1191 0.0238 0.0635 127 LYS L O +4145 C CB . LYS C 129 ? 0.8348 0.8974 0.6575 -0.1061 0.0533 0.0305 127 LYS L CB +4146 C CG . LYS C 129 ? 0.9775 1.0377 0.8052 -0.1041 0.0653 0.0295 127 LYS L CG +4147 C CD . LYS C 129 ? 1.0573 1.1094 0.8587 -0.1135 0.0798 0.0166 127 LYS L CD +4148 C CE . LYS C 129 ? 1.0873 1.1265 0.8779 -0.1141 0.0835 0.0011 127 LYS L CE +4149 N NZ . LYS C 129 ? 1.0796 1.1055 0.8878 -0.1020 0.0947 -0.0104 127 LYS L NZ +4150 N N . SER C 130 ? 0.7061 0.7830 0.5426 -0.1035 0.0232 0.0453 128 SER L N +4151 C CA . SER C 130 ? 0.7425 0.8285 0.5677 -0.1114 0.0127 0.0504 128 SER L CA +4152 C C . SER C 130 ? 0.6790 0.7788 0.5249 -0.1068 0.0006 0.0690 128 SER L C +4153 O O . SER C 130 ? 0.7015 0.8138 0.5399 -0.1143 -0.0089 0.0777 128 SER L O +4154 C CB . SER C 130 ? 0.8346 0.9088 0.6578 -0.1083 0.0132 0.0361 128 SER L CB +4155 O OG . SER C 130 ? 0.9679 1.0294 0.7698 -0.1145 0.0248 0.0200 128 SER L OG +4156 N N . GLY C 131 ? 0.5804 0.6782 0.4532 -0.0948 0.0012 0.0751 129 GLY L N +4157 C CA . GLY C 131 ? 0.5544 0.6627 0.4497 -0.0894 -0.0076 0.0922 129 GLY L CA +4158 C C . GLY C 131 ? 0.5661 0.6676 0.4839 -0.0776 -0.0110 0.0887 129 GLY L C +4159 O O . GLY C 131 ? 0.5601 0.6688 0.4980 -0.0726 -0.0167 0.1022 129 GLY L O +4160 N N . THR C 132 ? 0.5064 0.5946 0.4222 -0.0730 -0.0069 0.0716 130 THR L N +4161 C CA . THR C 132 ? 0.4324 0.5143 0.3670 -0.0628 -0.0096 0.0672 130 THR L CA +4162 C C . THR C 132 ? 0.4769 0.5451 0.4205 -0.0546 -0.0020 0.0537 130 THR L C +4163 O O . THR C 132 ? 0.5166 0.5790 0.4483 -0.0571 0.0054 0.0446 130 THR L O +4164 C CB . THR C 132 ? 0.5209 0.6036 0.4435 -0.0668 -0.0148 0.0618 130 THR L CB +4165 O OG1 . THR C 132 ? 0.5786 0.6772 0.4955 -0.0749 -0.0231 0.0761 130 THR L OG1 +4166 C CG2 . THR C 132 ? 0.4697 0.5458 0.4104 -0.0565 -0.0169 0.0570 130 THR L CG2 +4167 N N . ALA C 133 ? 0.4085 0.4724 0.3737 -0.0452 -0.0032 0.0531 131 ALA L N +4168 C CA . ALA C 133 ? 0.4444 0.4982 0.4196 -0.0380 0.0021 0.0416 131 ALA L CA +4169 C C . ALA C 133 ? 0.4169 0.4657 0.3974 -0.0327 -0.0013 0.0342 131 ALA L C +4170 O O . ALA C 133 ? 0.4381 0.4894 0.4301 -0.0298 -0.0061 0.0400 131 ALA L O +4171 C CB . ALA C 133 ? 0.4371 0.4902 0.4327 -0.0334 0.0046 0.0468 131 ALA L CB +4172 N N . SER C 134 ? 0.3845 0.4264 0.3576 -0.0314 0.0019 0.0222 132 SER L N +4173 C CA . SER C 134 ? 0.3343 0.3712 0.3133 -0.0258 -0.0004 0.0150 132 SER L CA +4174 C C . SER C 134 ? 0.3756 0.4080 0.3668 -0.0200 0.0036 0.0082 132 SER L C +4175 O O . SER C 134 ? 0.3548 0.3852 0.3422 -0.0202 0.0093 0.0035 132 SER L O +4176 C CB . SER C 134 ? 0.4040 0.4372 0.3665 -0.0289 -0.0006 0.0081 132 SER L CB +4177 O OG . SER C 134 ? 0.4367 0.4752 0.3842 -0.0371 -0.0036 0.0133 132 SER L OG +4178 N N . VAL C 135 ? 0.3119 0.3436 0.3180 -0.0154 0.0009 0.0079 133 VAL L N +4179 C CA . VAL C 135 ? 0.2705 0.3002 0.2880 -0.0113 0.0028 0.0016 133 VAL L CA +4180 C C . VAL C 135 ? 0.3025 0.3296 0.3181 -0.0082 0.0001 -0.0050 133 VAL L C +4181 O O . VAL C 135 ? 0.3320 0.3584 0.3464 -0.0079 -0.0039 -0.0037 133 VAL L O +4182 C CB . VAL C 135 ? 0.2961 0.3261 0.3299 -0.0102 0.0027 0.0048 133 VAL L CB +4183 C CG1 . VAL C 135 ? 0.2869 0.3172 0.3306 -0.0088 0.0050 -0.0013 133 VAL L CG1 +4184 C CG2 . VAL C 135 ? 0.3526 0.3852 0.3887 -0.0132 0.0044 0.0145 133 VAL L CG2 +4185 N N . VAL C 136 ? 0.3096 0.3361 0.3260 -0.0059 0.0023 -0.0108 134 VAL L N +4186 C CA . VAL C 136 ? 0.2983 0.3227 0.3116 -0.0031 0.0001 -0.0157 134 VAL L CA +4187 C C . VAL C 136 ? 0.3413 0.3689 0.3665 -0.0004 -0.0013 -0.0189 134 VAL L C +4188 O O . VAL C 136 ? 0.2990 0.3306 0.3324 -0.0002 0.0012 -0.0190 134 VAL L O +4189 C CB . VAL C 136 ? 0.2835 0.3043 0.2861 -0.0030 0.0043 -0.0185 134 VAL L CB +4190 C CG1 . VAL C 136 ? 0.3142 0.3330 0.3167 0.0006 0.0025 -0.0223 134 VAL L CG1 +4191 C CG2 . VAL C 136 ? 0.3354 0.3534 0.3228 -0.0082 0.0048 -0.0164 134 VAL L CG2 +4192 N N . CYS C 137 ? 0.2873 0.3144 0.3132 0.0007 -0.0054 -0.0212 135 CYS L N +4193 C CA . CYS C 137 ? 0.3030 0.3344 0.3369 0.0016 -0.0077 -0.0246 135 CYS L CA +4194 C C . CYS C 137 ? 0.3463 0.3777 0.3747 0.0044 -0.0095 -0.0264 135 CYS L C +4195 O O . CYS C 137 ? 0.3572 0.3841 0.3775 0.0047 -0.0109 -0.0266 135 CYS L O +4196 C CB . CYS C 137 ? 0.3171 0.3474 0.3562 -0.0005 -0.0097 -0.0262 135 CYS L CB +4197 S SG . CYS C 137 ? 0.4376 0.4736 0.4839 -0.0029 -0.0122 -0.0316 135 CYS L SG +4198 N N . LEU C 138 ? 0.2754 0.3127 0.3095 0.0063 -0.0095 -0.0265 136 LEU L N +4199 C CA . LEU C 138 ? 0.2538 0.2919 0.2853 0.0096 -0.0104 -0.0262 136 LEU L CA +4200 C C . LEU C 138 ? 0.2809 0.3277 0.3179 0.0087 -0.0157 -0.0268 136 LEU L C +4201 O O . LEU C 138 ? 0.2829 0.3384 0.3291 0.0066 -0.0169 -0.0265 136 LEU L O +4202 C CB . LEU C 138 ? 0.2704 0.3090 0.3053 0.0132 -0.0050 -0.0237 136 LEU L CB +4203 C CG . LEU C 138 ? 0.3109 0.3519 0.3489 0.0177 -0.0049 -0.0212 136 LEU L CG +4204 C CD1 . LEU C 138 ? 0.3129 0.3447 0.3393 0.0184 -0.0053 -0.0227 136 LEU L CD1 +4205 C CD2 . LEU C 138 ? 0.3187 0.3605 0.3647 0.0220 0.0024 -0.0181 136 LEU L CD2 +4206 N N . LEU C 139 ? 0.2513 0.2964 0.2819 0.0091 -0.0188 -0.0278 137 LEU L N +4207 C CA . LEU C 139 ? 0.2591 0.3129 0.2915 0.0074 -0.0238 -0.0281 137 LEU L CA +4208 C C . LEU C 139 ? 0.3358 0.3918 0.3680 0.0121 -0.0240 -0.0233 137 LEU L C +4209 O O . LEU C 139 ? 0.3037 0.3514 0.3280 0.0142 -0.0227 -0.0234 137 LEU L O +4210 C CB . LEU C 139 ? 0.2249 0.2747 0.2500 0.0040 -0.0260 -0.0326 137 LEU L CB +4211 C CG . LEU C 139 ? 0.3173 0.3650 0.3448 -0.0009 -0.0251 -0.0374 137 LEU L CG +4212 C CD1 . LEU C 139 ? 0.3195 0.3606 0.3500 0.0001 -0.0211 -0.0361 137 LEU L CD1 +4213 C CD2 . LEU C 139 ? 0.3187 0.3613 0.3396 -0.0028 -0.0253 -0.0413 137 LEU L CD2 +4214 N N . ASN C 140 ? 0.2436 0.3110 0.2858 0.0137 -0.0253 -0.0184 138 ASN L N +4215 C CA . ASN C 140 ? 0.2645 0.3330 0.3106 0.0197 -0.0233 -0.0119 138 ASN L CA +4216 C C . ASN C 140 ? 0.2879 0.3685 0.3357 0.0191 -0.0298 -0.0071 138 ASN L C +4217 O O . ASN C 140 ? 0.2854 0.3805 0.3387 0.0147 -0.0352 -0.0057 138 ASN L O +4218 C CB . ASN C 140 ? 0.3054 0.3782 0.3646 0.0238 -0.0183 -0.0072 138 ASN L CB +4219 C CG . ASN C 140 ? 0.4364 0.5029 0.4991 0.0310 -0.0118 -0.0022 138 ASN L CG +4220 O OD1 . ASN C 140 ? 0.5260 0.5774 0.5785 0.0320 -0.0068 -0.0058 138 ASN L OD1 +4221 N ND2 . ASN C 140 ? 0.3843 0.4627 0.4622 0.0354 -0.0117 0.0066 138 ASN L ND2 +4222 N N . ASN C 141 ? 0.2904 0.3654 0.3329 0.0224 -0.0291 -0.0043 139 ASN L N +4223 C CA . ASN C 141 ? 0.2967 0.3830 0.3419 0.0234 -0.0340 0.0034 139 ASN L CA +4224 C C . ASN C 141 ? 0.3173 0.4152 0.3560 0.0154 -0.0421 0.0006 139 ASN L C +4225 O O . ASN C 141 ? 0.2490 0.3646 0.2944 0.0123 -0.0478 0.0059 139 ASN L O +4226 C CB . ASN C 141 ? 0.3244 0.4229 0.3872 0.0288 -0.0330 0.0142 139 ASN L CB +4227 C CG . ASN C 141 ? 0.4351 0.5202 0.5038 0.0369 -0.0228 0.0167 139 ASN L CG +4228 O OD1 . ASN C 141 ? 0.3953 0.4627 0.4530 0.0372 -0.0175 0.0100 139 ASN L OD1 +4229 N ND2 . ASN C 141 ? 0.4732 0.5669 0.5595 0.0429 -0.0196 0.0265 139 ASN L ND2 +4230 N N . PHE C 142 ? 0.3036 0.3918 0.3290 0.0115 -0.0421 -0.0074 140 PHE L N +4231 C CA . PHE C 142 ? 0.2719 0.3674 0.2892 0.0033 -0.0472 -0.0123 140 PHE L CA +4232 C C . PHE C 142 ? 0.2645 0.3566 0.2704 0.0027 -0.0483 -0.0122 140 PHE L C +4233 O O . PHE C 142 ? 0.2767 0.3581 0.2803 0.0081 -0.0447 -0.0101 140 PHE L O +4234 C CB . PHE C 142 ? 0.2930 0.3806 0.3068 -0.0016 -0.0448 -0.0227 140 PHE L CB +4235 C CG . PHE C 142 ? 0.3059 0.3764 0.3143 0.0015 -0.0394 -0.0271 140 PHE L CG +4236 C CD1 . PHE C 142 ? 0.3143 0.3785 0.3129 -0.0007 -0.0388 -0.0315 140 PHE L CD1 +4237 C CD2 . PHE C 142 ? 0.2869 0.3492 0.3001 0.0058 -0.0350 -0.0265 140 PHE L CD2 +4238 C CE1 . PHE C 142 ? 0.3286 0.3801 0.3244 0.0017 -0.0346 -0.0340 140 PHE L CE1 +4239 C CE2 . PHE C 142 ? 0.2871 0.3366 0.2949 0.0072 -0.0313 -0.0294 140 PHE L CE2 +4240 C CZ . PHE C 142 ? 0.3072 0.3522 0.3074 0.0053 -0.0315 -0.0326 140 PHE L CZ +4241 N N . TYR C 143 ? 0.2590 0.3603 0.2570 -0.0050 -0.0527 -0.0150 141 TYR L N +4242 C CA . TYR C 143 ? 0.2718 0.3707 0.2579 -0.0069 -0.0532 -0.0157 141 TYR L CA +4243 C C . TYR C 143 ? 0.3213 0.4251 0.2972 -0.0173 -0.0550 -0.0245 141 TYR L C +4244 O O . TYR C 143 ? 0.3204 0.4382 0.2977 -0.0240 -0.0597 -0.0243 141 TYR L O +4245 C CB . TYR C 143 ? 0.2916 0.4013 0.2794 -0.0039 -0.0573 -0.0035 141 TYR L CB +4246 C CG . TYR C 143 ? 0.3057 0.4115 0.2811 -0.0055 -0.0568 -0.0040 141 TYR L CG +4247 C CD1 . TYR C 143 ? 0.3105 0.4260 0.2739 -0.0146 -0.0605 -0.0072 141 TYR L CD1 +4248 C CD2 . TYR C 143 ? 0.3246 0.4165 0.2993 0.0009 -0.0521 -0.0023 141 TYR L CD2 +4249 C CE1 . TYR C 143 ? 0.3497 0.4615 0.3015 -0.0164 -0.0591 -0.0080 141 TYR L CE1 +4250 C CE2 . TYR C 143 ? 0.3073 0.3958 0.2713 -0.0010 -0.0513 -0.0028 141 TYR L CE2 +4251 C CZ . TYR C 143 ? 0.4132 0.5119 0.3662 -0.0092 -0.0546 -0.0053 141 TYR L CZ +4252 O OH . TYR C 143 ? 0.4407 0.5366 0.3829 -0.0113 -0.0531 -0.0058 141 TYR L OH +4253 N N . PRO C 144 ? 0.3148 0.4083 0.2805 -0.0198 -0.0509 -0.0322 142 PRO L N +4254 C CA . PRO C 144 ? 0.2713 0.3514 0.2343 -0.0140 -0.0463 -0.0321 142 PRO L CA +4255 C C . PRO C 144 ? 0.3685 0.4350 0.3382 -0.0093 -0.0411 -0.0358 142 PRO L C +4256 O O . PRO C 144 ? 0.3383 0.4049 0.3150 -0.0096 -0.0407 -0.0379 142 PRO L O +4257 C CB . PRO C 144 ? 0.3543 0.4330 0.3049 -0.0206 -0.0440 -0.0392 142 PRO L CB +4258 C CG . PRO C 144 ? 0.3960 0.4787 0.3444 -0.0292 -0.0438 -0.0478 142 PRO L CG +4259 C CD . PRO C 144 ? 0.3762 0.4728 0.3315 -0.0303 -0.0504 -0.0417 142 PRO L CD +4260 N N . ARG C 145 ? 0.3635 0.4194 0.3309 -0.0056 -0.0374 -0.0360 143 ARG L N +4261 C CA . ARG C 145 ? 0.3475 0.3934 0.3211 -0.0015 -0.0339 -0.0369 143 ARG L CA +4262 C C . ARG C 145 ? 0.3181 0.3593 0.2947 -0.0043 -0.0304 -0.0439 143 ARG L C +4263 O O . ARG C 145 ? 0.3619 0.3980 0.3449 -0.0019 -0.0286 -0.0434 143 ARG L O +4264 C CB . ARG C 145 ? 0.3744 0.4124 0.3450 0.0018 -0.0318 -0.0343 143 ARG L CB +4265 C CG . ARG C 145 ? 0.5787 0.6149 0.5435 -0.0009 -0.0295 -0.0377 143 ARG L CG +4266 C CD . ARG C 145 ? 0.6216 0.6500 0.5874 0.0016 -0.0268 -0.0361 143 ARG L CD +4267 N NE . ARG C 145 ? 0.6690 0.6949 0.6326 0.0043 -0.0281 -0.0304 143 ARG L NE +4268 C CZ . ARG C 145 ? 0.6358 0.6560 0.6019 0.0064 -0.0273 -0.0285 143 ARG L CZ +4269 N NH1 . ARG C 145 ? 0.6710 0.6891 0.6415 0.0062 -0.0264 -0.0304 143 ARG L NH1 +4270 N NH2 . ARG C 145 ? 0.5057 0.5217 0.4695 0.0080 -0.0268 -0.0245 143 ARG L NH2 +4271 N N . GLU C 146 ? 0.3169 0.3594 0.2892 -0.0097 -0.0286 -0.0501 144 GLU L N +4272 C CA . GLU C 146 ? 0.4106 0.4466 0.3873 -0.0122 -0.0232 -0.0569 144 GLU L CA +4273 C C . GLU C 146 ? 0.4199 0.4579 0.4035 -0.0139 -0.0241 -0.0582 144 GLU L C +4274 O O . GLU C 146 ? 0.3696 0.4157 0.3507 -0.0192 -0.0272 -0.0603 144 GLU L O +4275 C CB . GLU C 146 ? 0.4669 0.5027 0.4362 -0.0186 -0.0195 -0.0646 144 GLU L CB +4276 C CG . GLU C 146 ? 0.8096 0.8421 0.7736 -0.0174 -0.0161 -0.0645 144 GLU L CG +4277 C CD . GLU C 146 ? 0.8616 0.8999 0.8189 -0.0150 -0.0215 -0.0573 144 GLU L CD +4278 O OE1 . GLU C 146 ? 0.9018 0.9359 0.8598 -0.0111 -0.0197 -0.0539 144 GLU L OE1 +4279 O OE2 . GLU C 146 ? 0.7121 0.7596 0.6644 -0.0172 -0.0272 -0.0543 144 GLU L OE2 +4280 N N . ALA C 147 ? 0.4141 0.4458 0.4064 -0.0103 -0.0215 -0.0565 145 ALA L N +4281 C CA . ALA C 147 ? 0.4020 0.4346 0.4016 -0.0118 -0.0214 -0.0574 145 ALA L CA +4282 C C . ALA C 147 ? 0.4723 0.4959 0.4805 -0.0097 -0.0160 -0.0572 145 ALA L C +4283 O O . ALA C 147 ? 0.4598 0.4794 0.4693 -0.0055 -0.0146 -0.0532 145 ALA L O +4284 C CB . ALA C 147 ? 0.4134 0.4521 0.4154 -0.0085 -0.0259 -0.0510 145 ALA L CB +4285 N N . LYS C 148 ? 0.3663 0.3877 0.3811 -0.0130 -0.0129 -0.0609 146 LYS L N +4286 C CA . LYS C 148 ? 0.3931 0.4063 0.4182 -0.0110 -0.0073 -0.0593 146 LYS L CA +4287 C C . LYS C 148 ? 0.3480 0.3629 0.3798 -0.0109 -0.0084 -0.0560 146 LYS L C +4288 O O . LYS C 148 ? 0.3881 0.4069 0.4205 -0.0156 -0.0095 -0.0599 146 LYS L O +4289 C CB . LYS C 148 ? 0.4769 0.4822 0.5058 -0.0153 0.0005 -0.0671 146 LYS L CB +4290 C CG . LYS C 148 ? 0.7050 0.7016 0.7480 -0.0127 0.0074 -0.0640 146 LYS L CG +4291 C CD . LYS C 148 ? 0.8655 0.8544 0.9141 -0.0188 0.0148 -0.0724 146 LYS L CD +4292 C CE . LYS C 148 ? 0.9815 0.9636 1.0257 -0.0232 0.0220 -0.0822 146 LYS L CE +4293 N NZ . LYS C 148 ? 1.0270 1.0069 1.0657 -0.0337 0.0249 -0.0940 146 LYS L NZ +4294 N N . VAL C 149 ? 0.3003 0.3134 0.3368 -0.0063 -0.0081 -0.0486 147 VAL L N +4295 C CA . VAL C 149 ? 0.3020 0.3159 0.3448 -0.0061 -0.0079 -0.0447 147 VAL L CA +4296 C C . VAL C 149 ? 0.3780 0.3848 0.4320 -0.0056 -0.0019 -0.0422 147 VAL L C +4297 O O . VAL C 149 ? 0.3583 0.3624 0.4155 -0.0023 -0.0002 -0.0372 147 VAL L O +4298 C CB . VAL C 149 ? 0.3937 0.4114 0.4318 -0.0025 -0.0115 -0.0379 147 VAL L CB +4299 C CG1 . VAL C 149 ? 0.3934 0.4115 0.4372 -0.0026 -0.0100 -0.0334 147 VAL L CG1 +4300 C CG2 . VAL C 149 ? 0.4717 0.4952 0.5019 -0.0021 -0.0157 -0.0396 147 VAL L CG2 +4301 N N . GLN C 150 ? 0.2893 0.2934 0.3507 -0.0091 0.0015 -0.0447 148 GLN L N +4302 C CA . GLN C 150 ? 0.3436 0.3399 0.4179 -0.0084 0.0082 -0.0412 148 GLN L CA +4303 C C . GLN C 150 ? 0.3466 0.3458 0.4256 -0.0084 0.0074 -0.0349 148 GLN L C +4304 O O . GLN C 150 ? 0.3521 0.3536 0.4316 -0.0125 0.0070 -0.0392 148 GLN L O +4305 C CB . GLN C 150 ? 0.3286 0.3166 0.4084 -0.0136 0.0152 -0.0507 148 GLN L CB +4306 C CG . GLN C 150 ? 0.4029 0.3809 0.4986 -0.0129 0.0240 -0.0471 148 GLN L CG +4307 C CD . GLN C 150 ? 0.4801 0.4546 0.5845 -0.0062 0.0276 -0.0384 148 GLN L CD +4308 O OE1 . GLN C 150 ? 0.5116 0.4807 0.6173 -0.0054 0.0325 -0.0427 148 GLN L OE1 +4309 N NE2 . GLN C 150 ? 0.4023 0.3811 0.5128 -0.0019 0.0253 -0.0255 148 GLN L NE2 +4310 N N . TRP C 151 ? 0.3412 0.3416 0.4233 -0.0045 0.0070 -0.0245 149 TRP L N +4311 C CA . TRP C 151 ? 0.3356 0.3383 0.4218 -0.0049 0.0073 -0.0176 149 TRP L CA +4312 C C . TRP C 151 ? 0.3670 0.3619 0.4684 -0.0063 0.0146 -0.0159 149 TRP L C +4313 O O . TRP C 151 ? 0.3272 0.3151 0.4381 -0.0044 0.0198 -0.0145 149 TRP L O +4314 C CB . TRP C 151 ? 0.2732 0.2810 0.3554 -0.0020 0.0042 -0.0067 149 TRP L CB +4315 C CG . TRP C 151 ? 0.2785 0.2923 0.3457 -0.0019 -0.0014 -0.0083 149 TRP L CG +4316 C CD1 . TRP C 151 ? 0.3064 0.3220 0.3652 -0.0003 -0.0049 -0.0087 149 TRP L CD1 +4317 C CD2 . TRP C 151 ? 0.2912 0.3090 0.3513 -0.0033 -0.0028 -0.0098 149 TRP L CD2 +4318 N NE1 . TRP C 151 ? 0.3179 0.3370 0.3644 -0.0009 -0.0080 -0.0106 149 TRP L NE1 +4319 C CE2 . TRP C 151 ? 0.3405 0.3609 0.3881 -0.0023 -0.0063 -0.0112 149 TRP L CE2 +4320 C CE3 . TRP C 151 ? 0.3150 0.3342 0.3794 -0.0053 -0.0004 -0.0097 149 TRP L CE3 +4321 C CZ2 . TRP C 151 ? 0.2719 0.2951 0.3118 -0.0027 -0.0066 -0.0129 149 TRP L CZ2 +4322 C CZ3 . TRP C 151 ? 0.2861 0.3098 0.3430 -0.0055 -0.0012 -0.0109 149 TRP L CZ3 +4323 C CH2 . TRP C 151 ? 0.3073 0.3324 0.3523 -0.0040 -0.0038 -0.0126 149 TRP L CH2 +4324 N N . LYS C 152 ? 0.2970 0.2927 0.4020 -0.0094 0.0159 -0.0157 150 LYS L N +4325 C CA . LYS C 152 ? 0.3225 0.3102 0.4423 -0.0113 0.0232 -0.0133 150 LYS L CA +4326 C C . LYS C 152 ? 0.3687 0.3613 0.4907 -0.0114 0.0227 -0.0038 150 LYS L C +4327 O O . LYS C 152 ? 0.3299 0.3302 0.4433 -0.0130 0.0186 -0.0054 150 LYS L O +4328 C CB . LYS C 152 ? 0.3527 0.3351 0.4754 -0.0179 0.0269 -0.0258 150 LYS L CB +4329 C CG . LYS C 152 ? 0.4107 0.3884 0.5286 -0.0197 0.0281 -0.0367 150 LYS L CG +4330 C CD . LYS C 152 ? 0.4927 0.4650 0.6129 -0.0286 0.0324 -0.0489 150 LYS L CD +4331 C CE . LYS C 152 ? 0.5674 0.5356 0.6801 -0.0321 0.0340 -0.0604 150 LYS L CE +4332 N NZ . LYS C 152 ? 0.6355 0.5983 0.7486 -0.0430 0.0386 -0.0731 150 LYS L NZ +4333 N N . VAL C 153 ? 0.3178 0.3061 0.4522 -0.0095 0.0275 0.0068 151 VAL L N +4334 C CA . VAL C 153 ? 0.3429 0.3356 0.4802 -0.0101 0.0279 0.0174 151 VAL L CA +4335 C C . VAL C 153 ? 0.3648 0.3472 0.5198 -0.0122 0.0366 0.0192 151 VAL L C +4336 O O . VAL C 153 ? 0.3282 0.3025 0.4967 -0.0092 0.0423 0.0247 151 VAL L O +4337 C CB . VAL C 153 ? 0.3772 0.3770 0.5118 -0.0064 0.0245 0.0320 151 VAL L CB +4338 C CG1 . VAL C 153 ? 0.3826 0.3873 0.5183 -0.0083 0.0252 0.0430 151 VAL L CG1 +4339 C CG2 . VAL C 153 ? 0.3553 0.3630 0.4720 -0.0056 0.0169 0.0287 151 VAL L CG2 +4340 N N . ASP C 154 ? 0.3420 0.3244 0.4986 -0.0173 0.0384 0.0147 152 ASP L N +4341 C CA . ASP C 154 ? 0.3519 0.3231 0.5246 -0.0211 0.0472 0.0134 152 ASP L CA +4342 C C . ASP C 154 ? 0.3418 0.2999 0.5214 -0.0220 0.0533 0.0035 152 ASP L C +4343 O O . ASP C 154 ? 0.3179 0.2633 0.5137 -0.0216 0.0627 0.0067 152 ASP L O +4344 C CB . ASP C 154 ? 0.3566 0.3258 0.5421 -0.0183 0.0519 0.0302 152 ASP L CB +4345 C CG . ASP C 154 ? 0.3866 0.3657 0.5666 -0.0205 0.0491 0.0374 152 ASP L CG +4346 O OD1 . ASP C 154 ? 0.4044 0.3888 0.5766 -0.0247 0.0464 0.0280 152 ASP L OD1 +4347 O OD2 . ASP C 154 ? 0.4112 0.3938 0.5953 -0.0181 0.0498 0.0529 152 ASP L OD2 +4348 N N . ASN C 155 ? 0.3463 0.3074 0.5137 -0.0234 0.0486 -0.0084 153 ASN L N +4349 C CA . ASN C 155 ? 0.3791 0.3300 0.5475 -0.0258 0.0534 -0.0205 153 ASN L CA +4350 C C . ASN C 155 ? 0.3742 0.3176 0.5507 -0.0189 0.0584 -0.0143 153 ASN L C +4351 O O . ASN C 155 ? 0.4230 0.3551 0.6030 -0.0205 0.0655 -0.0237 153 ASN L O +4352 C CB . ASN C 155 ? 0.4535 0.3924 0.6310 -0.0344 0.0622 -0.0305 153 ASN L CB +4353 C CG . ASN C 155 ? 0.6897 0.6370 0.8560 -0.0433 0.0564 -0.0428 153 ASN L CG +4354 O OD1 . ASN C 155 ? 0.8008 0.7518 0.9554 -0.0461 0.0523 -0.0530 153 ASN L OD1 +4355 N ND2 . ASN C 155 ? 0.6925 0.6448 0.8630 -0.0478 0.0557 -0.0407 153 ASN L ND2 +4356 N N . ALA C 156 ? 0.3632 0.3135 0.5426 -0.0117 0.0550 0.0012 154 ALA L N +4357 C CA . ALA C 156 ? 0.3406 0.2889 0.5270 -0.0048 0.0573 0.0084 154 ALA L CA +4358 C C . ALA C 156 ? 0.2916 0.2499 0.4607 -0.0032 0.0482 0.0039 154 ALA L C +4359 O O . ALA C 156 ? 0.3172 0.2878 0.4727 -0.0033 0.0388 0.0069 154 ALA L O +4360 C CB . ALA C 156 ? 0.3846 0.3381 0.5833 0.0009 0.0573 0.0290 154 ALA L CB +4361 N N . LEU C 157 ? 0.3213 0.2734 0.4908 -0.0021 0.0520 -0.0039 155 LEU L N +4362 C CA . LEU C 157 ? 0.3295 0.2900 0.4837 -0.0009 0.0443 -0.0083 155 LEU L CA +4363 C C . LEU C 157 ? 0.3728 0.3436 0.5284 0.0054 0.0388 0.0069 155 LEU L C +4364 O O . LEU C 157 ? 0.3707 0.3390 0.5426 0.0103 0.0441 0.0176 155 LEU L O +4365 C CB . LEU C 157 ? 0.3161 0.2668 0.4709 -0.0019 0.0512 -0.0201 155 LEU L CB +4366 C CG . LEU C 157 ? 0.4366 0.3823 0.5808 -0.0106 0.0525 -0.0377 155 LEU L CG +4367 C CD1 . LEU C 157 ? 0.3680 0.3034 0.5222 -0.0163 0.0604 -0.0418 155 LEU L CD1 +4368 C CD2 . LEU C 157 ? 0.4032 0.3417 0.5439 -0.0119 0.0583 -0.0484 155 LEU L CD2 +4369 N N . GLN C 158 ? 0.3238 0.3063 0.4629 0.0048 0.0286 0.0081 156 GLN L N +4370 C CA . GLN C 158 ? 0.3189 0.3126 0.4555 0.0080 0.0222 0.0214 156 GLN L CA +4371 C C . GLN C 158 ? 0.3430 0.3396 0.4758 0.0105 0.0199 0.0200 156 GLN L C +4372 O O . GLN C 158 ? 0.4227 0.4185 0.5427 0.0087 0.0174 0.0083 156 GLN L O +4373 C CB . GLN C 158 ? 0.3629 0.3658 0.4824 0.0049 0.0141 0.0219 156 GLN L CB +4374 C CG . GLN C 158 ? 0.3272 0.3293 0.4495 0.0023 0.0160 0.0245 156 GLN L CG +4375 C CD . GLN C 158 ? 0.4102 0.4125 0.5487 0.0044 0.0199 0.0397 156 GLN L CD +4376 O OE1 . GLN C 158 ? 0.4427 0.4549 0.5799 0.0054 0.0154 0.0528 156 GLN L OE1 +4377 N NE2 . GLN C 158 ? 0.3727 0.3645 0.5270 0.0045 0.0283 0.0387 156 GLN L NE2 +4378 N N . SER C 159 ? 0.3257 0.3276 0.4699 0.0145 0.0201 0.0332 157 SER L N +4379 C CA . SER C 159 ? 0.3144 0.3216 0.4560 0.0166 0.0173 0.0339 157 SER L CA +4380 C C . SER C 159 ? 0.3635 0.3854 0.5056 0.0170 0.0100 0.0502 157 SER L C +4381 O O . SER C 159 ? 0.3121 0.3385 0.4675 0.0185 0.0111 0.0645 157 SER L O +4382 C CB . SER C 159 ? 0.4206 0.4189 0.5799 0.0209 0.0275 0.0323 157 SER L CB +4383 O OG . SER C 159 ? 0.4744 0.4795 0.6340 0.0233 0.0252 0.0355 157 SER L OG +4384 N N . GLY C 160 ? 0.3543 0.3842 0.4816 0.0149 0.0026 0.0485 158 GLY L N +4385 C CA . GLY C 160 ? 0.3606 0.4055 0.4865 0.0133 -0.0048 0.0626 158 GLY L CA +4386 C C . GLY C 160 ? 0.3926 0.4446 0.5000 0.0072 -0.0120 0.0647 158 GLY L C +4387 O O . GLY C 160 ? 0.3840 0.4490 0.4864 0.0036 -0.0187 0.0751 158 GLY L O +4388 N N . ASN C 161 ? 0.3028 0.3474 0.3998 0.0052 -0.0106 0.0550 159 ASN L N +4389 C CA . ASN C 161 ? 0.3159 0.3661 0.3959 -0.0005 -0.0154 0.0565 159 ASN L CA +4390 C C . ASN C 161 ? 0.3134 0.3572 0.3750 -0.0027 -0.0161 0.0413 159 ASN L C +4391 O O . ASN C 161 ? 0.2981 0.3419 0.3490 -0.0061 -0.0163 0.0390 159 ASN L O +4392 C CB . ASN C 161 ? 0.3473 0.3976 0.4346 -0.0010 -0.0125 0.0643 159 ASN L CB +4393 C CG . ASN C 161 ? 0.3448 0.3825 0.4444 0.0026 -0.0049 0.0567 159 ASN L CG +4394 O OD1 . ASN C 161 ? 0.3803 0.4096 0.4801 0.0045 -0.0021 0.0443 159 ASN L OD1 +4395 N ND2 . ASN C 161 ? 0.3683 0.4052 0.4776 0.0025 -0.0013 0.0643 159 ASN L ND2 +4396 N N . SER C 162 ? 0.2712 0.3105 0.3299 -0.0008 -0.0161 0.0318 160 SER L N +4397 C CA . SER C 162 ? 0.2926 0.3272 0.3360 -0.0023 -0.0170 0.0197 160 SER L CA +4398 C C . SER C 162 ? 0.3682 0.4043 0.4029 -0.0030 -0.0204 0.0166 160 SER L C +4399 O O . SER C 162 ? 0.3273 0.3667 0.3700 -0.0015 -0.0211 0.0212 160 SER L O +4400 C CB . SER C 162 ? 0.3533 0.3797 0.4018 0.0003 -0.0127 0.0096 160 SER L CB +4401 O OG . SER C 162 ? 0.3889 0.4115 0.4479 0.0033 -0.0100 0.0070 160 SER L OG +4402 N N . GLN C 163 ? 0.2943 0.3279 0.3138 -0.0053 -0.0216 0.0093 161 GLN L N +4403 C CA . GLN C 163 ? 0.2852 0.3180 0.2956 -0.0062 -0.0238 0.0049 161 GLN L CA +4404 C C . GLN C 163 ? 0.3514 0.3773 0.3551 -0.0045 -0.0219 -0.0051 161 GLN L C +4405 O O . GLN C 163 ? 0.3424 0.3663 0.3440 -0.0046 -0.0197 -0.0076 161 GLN L O +4406 C CB . GLN C 163 ? 0.3073 0.3449 0.3045 -0.0126 -0.0273 0.0088 161 GLN L CB +4407 C CG . GLN C 163 ? 0.3620 0.4102 0.3655 -0.0153 -0.0310 0.0207 161 GLN L CG +4408 C CD . GLN C 163 ? 0.4659 0.5200 0.4540 -0.0238 -0.0353 0.0231 161 GLN L CD +4409 O OE1 . GLN C 163 ? 0.3791 0.4347 0.3553 -0.0297 -0.0354 0.0240 161 GLN L OE1 +4410 N NE2 . GLN C 163 ? 0.3753 0.4326 0.3626 -0.0255 -0.0382 0.0237 161 GLN L NE2 +4411 N N . GLU C 164 ? 0.3134 0.3369 0.3149 -0.0029 -0.0225 -0.0098 162 GLU L N +4412 C CA . GLU C 164 ? 0.3289 0.3479 0.3257 -0.0010 -0.0212 -0.0170 162 GLU L CA +4413 C C . GLU C 164 ? 0.4257 0.4422 0.4130 -0.0019 -0.0224 -0.0193 162 GLU L C +4414 O O . GLU C 164 ? 0.3300 0.3484 0.3157 -0.0038 -0.0244 -0.0166 162 GLU L O +4415 C CB . GLU C 164 ? 0.3082 0.3266 0.3137 0.0020 -0.0202 -0.0209 162 GLU L CB +4416 C CG . GLU C 164 ? 0.3527 0.3714 0.3625 0.0029 -0.0203 -0.0211 162 GLU L CG +4417 C CD . GLU C 164 ? 0.5228 0.5402 0.5371 0.0039 -0.0185 -0.0270 162 GLU L CD +4418 O OE1 . GLU C 164 ? 0.5803 0.5974 0.5910 0.0042 -0.0189 -0.0302 162 GLU L OE1 +4419 O OE2 . GLU C 164 ? 0.4359 0.4528 0.4565 0.0035 -0.0166 -0.0285 162 GLU L OE2 +4420 N N . SER C 165 ? 0.2988 0.3115 0.2818 -0.0003 -0.0208 -0.0236 163 SER L N +4421 C CA . SER C 165 ? 0.2915 0.2998 0.2662 -0.0007 -0.0204 -0.0256 163 SER L CA +4422 C C . SER C 165 ? 0.3160 0.3232 0.2935 0.0035 -0.0193 -0.0282 163 SER L C +4423 O O . SER C 165 ? 0.3357 0.3454 0.3190 0.0055 -0.0184 -0.0288 163 SER L O +4424 C CB . SER C 165 ? 0.4219 0.4261 0.3863 -0.0052 -0.0181 -0.0258 163 SER L CB +4425 O OG . SER C 165 ? 0.5000 0.4967 0.4581 -0.0047 -0.0144 -0.0291 163 SER L OG +4426 N N . VAL C 166 ? 0.2912 0.2965 0.2657 0.0045 -0.0199 -0.0288 164 VAL L N +4427 C CA A VAL C 166 ? 0.3084 0.3154 0.2861 0.0081 -0.0202 -0.0291 164 VAL L CA +4428 C CA B VAL C 166 ? 0.3128 0.3198 0.2906 0.0081 -0.0201 -0.0291 164 VAL L CA +4429 C C . VAL C 166 ? 0.3666 0.3671 0.3394 0.0093 -0.0174 -0.0283 164 VAL L C +4430 O O . VAL C 166 ? 0.3575 0.3528 0.3235 0.0065 -0.0167 -0.0287 164 VAL L O +4431 C CB A VAL C 166 ? 0.3444 0.3563 0.3242 0.0081 -0.0232 -0.0297 164 VAL L CB +4432 C CB B VAL C 166 ? 0.3452 0.3573 0.3254 0.0082 -0.0232 -0.0297 164 VAL L CB +4433 C CG1 A VAL C 166 ? 0.2549 0.2715 0.2368 0.0103 -0.0246 -0.0290 164 VAL L CG1 +4434 C CG1 B VAL C 166 ? 0.3905 0.4064 0.3766 0.0070 -0.0238 -0.0312 164 VAL L CG1 +4435 C CG2 A VAL C 166 ? 0.4158 0.4310 0.4011 0.0067 -0.0238 -0.0310 164 VAL L CG2 +4436 C CG2 B VAL C 166 ? 0.3356 0.3452 0.3106 0.0066 -0.0237 -0.0292 164 VAL L CG2 +4437 N N . THR C 167 ? 0.2975 0.2985 0.2750 0.0132 -0.0153 -0.0266 165 THR L N +4438 C CA . THR C 167 ? 0.2708 0.2644 0.2462 0.0152 -0.0113 -0.0249 165 THR L CA +4439 C C . THR C 167 ? 0.3571 0.3532 0.3317 0.0160 -0.0144 -0.0223 165 THR L C +4440 O O . THR C 167 ? 0.3440 0.3484 0.3197 0.0153 -0.0193 -0.0222 165 THR L O +4441 C CB . THR C 167 ? 0.3513 0.3452 0.3352 0.0202 -0.0070 -0.0220 165 THR L CB +4442 O OG1 . THR C 167 ? 0.3806 0.3873 0.3733 0.0227 -0.0119 -0.0185 165 THR L OG1 +4443 C CG2 . THR C 167 ? 0.3277 0.3176 0.3112 0.0190 -0.0020 -0.0250 165 THR L CG2 +4444 N N . GLU C 168 ? 0.3463 0.3339 0.3182 0.0169 -0.0106 -0.0206 166 GLU L N +4445 C CA . GLU C 168 ? 0.3384 0.3284 0.3108 0.0186 -0.0126 -0.0163 166 GLU L CA +4446 C C . GLU C 168 ? 0.3767 0.3757 0.3588 0.0238 -0.0139 -0.0099 166 GLU L C +4447 O O . GLU C 168 ? 0.3323 0.3329 0.3218 0.0268 -0.0115 -0.0087 166 GLU L O +4448 C CB . GLU C 168 ? 0.4247 0.4019 0.3925 0.0178 -0.0072 -0.0157 166 GLU L CB +4449 C CG . GLU C 168 ? 0.4570 0.4279 0.4150 0.0110 -0.0070 -0.0211 166 GLU L CG +4450 C CD . GLU C 168 ? 0.6118 0.5913 0.5677 0.0084 -0.0131 -0.0212 166 GLU L CD +4451 O OE1 . GLU C 168 ? 0.5729 0.5576 0.5283 0.0059 -0.0161 -0.0239 166 GLU L OE1 +4452 O OE2 . GLU C 168 ? 0.7050 0.6860 0.6605 0.0092 -0.0142 -0.0180 166 GLU L OE2 +4453 N N . GLN C 169 ? 0.3319 0.3380 0.3142 0.0245 -0.0177 -0.0050 167 GLN L N +4454 C CA . GLN C 169 ? 0.3191 0.3373 0.3104 0.0282 -0.0205 0.0029 167 GLN L CA +4455 C C . GLN C 169 ? 0.3656 0.3786 0.3676 0.0345 -0.0141 0.0091 167 GLN L C +4456 O O . GLN C 169 ? 0.3579 0.3575 0.3590 0.0362 -0.0076 0.0102 167 GLN L O +4457 C CB . GLN C 169 ? 0.3885 0.4140 0.3764 0.0272 -0.0247 0.0083 167 GLN L CB +4458 C CG . GLN C 169 ? 0.4423 0.4781 0.4231 0.0217 -0.0309 0.0039 167 GLN L CG +4459 C CD . GLN C 169 ? 0.4582 0.5032 0.4349 0.0202 -0.0347 0.0100 167 GLN L CD +4460 O OE1 . GLN C 169 ? 0.3668 0.4051 0.3385 0.0201 -0.0326 0.0118 167 GLN L OE1 +4461 N NE2 . GLN C 169 ? 0.3575 0.4186 0.3357 0.0180 -0.0404 0.0137 167 GLN L NE2 +4462 N N . ASP C 170 ? 0.3250 0.3482 0.3382 0.0376 -0.0150 0.0132 168 ASP L N +4463 C CA . ASP C 170 ? 0.3605 0.3803 0.3875 0.0445 -0.0078 0.0202 168 ASP L CA +4464 C C . ASP C 170 ? 0.4878 0.5084 0.5213 0.0491 -0.0066 0.0315 168 ASP L C +4465 O O . ASP C 170 ? 0.4321 0.4662 0.4644 0.0476 -0.0143 0.0378 168 ASP L O +4466 C CB . ASP C 170 ? 0.3773 0.4123 0.4170 0.0466 -0.0105 0.0242 168 ASP L CB +4467 C CG . ASP C 170 ? 0.5231 0.5552 0.5798 0.0546 -0.0015 0.0318 168 ASP L CG +4468 O OD1 . ASP C 170 ? 0.5719 0.5921 0.6289 0.0555 0.0068 0.0255 168 ASP L OD1 +4469 O OD2 . ASP C 170 ? 0.5281 0.5703 0.5984 0.0599 -0.0024 0.0447 168 ASP L OD2 +4470 N N . SER C 171 ? 0.4404 0.4462 0.4810 0.0544 0.0041 0.0344 169 SER L N +4471 C CA . SER C 171 ? 0.5278 0.5307 0.5750 0.0589 0.0070 0.0452 169 SER L CA +4472 C C . SER C 171 ? 0.5386 0.5613 0.6039 0.0651 0.0029 0.0614 169 SER L C +4473 O O . SER C 171 ? 0.6105 0.6382 0.6799 0.0675 0.0009 0.0728 169 SER L O +4474 C CB . SER C 171 ? 0.6194 0.5984 0.6698 0.0624 0.0214 0.0430 169 SER L CB +4475 O OG . SER C 171 ? 0.7437 0.7189 0.8055 0.0669 0.0298 0.0421 169 SER L OG +4476 N N . LYS C 172 ? 0.4809 0.5165 0.5577 0.0673 0.0011 0.0637 170 LYS L N +4477 C CA . LYS C 172 ? 0.5824 0.6404 0.6782 0.0723 -0.0037 0.0802 170 LYS L CA +4478 C C . LYS C 172 ? 0.5454 0.6280 0.6346 0.0651 -0.0185 0.0815 170 LYS L C +4479 O O . LYS C 172 ? 0.5466 0.6475 0.6417 0.0654 -0.0257 0.0951 170 LYS L O +4480 C CB . LYS C 172 ? 0.6593 0.7186 0.7748 0.0791 0.0041 0.0838 170 LYS L CB +4481 C CG . LYS C 172 ? 0.8438 0.8799 0.9694 0.0870 0.0209 0.0848 170 LYS L CG +4482 C CD . LYS C 172 ? 0.9673 1.0085 1.1173 0.0953 0.0293 0.0924 170 LYS L CD +4483 C CE . LYS C 172 ? 1.0256 1.0433 1.1879 0.1038 0.0479 0.0949 170 LYS L CE +4484 N NZ . LYS C 172 ? 1.0448 1.0331 1.1855 0.0980 0.0571 0.0766 170 LYS L NZ +4485 N N . ASP C 173 ? 0.4113 0.4949 0.4881 0.0578 -0.0229 0.0680 171 ASP L N +4486 C CA . ASP C 173 ? 0.4298 0.5352 0.5012 0.0501 -0.0351 0.0678 171 ASP L CA +4487 C C . ASP C 173 ? 0.3819 0.4820 0.4309 0.0411 -0.0398 0.0548 171 ASP L C +4488 O O . ASP C 173 ? 0.3500 0.4652 0.3926 0.0336 -0.0482 0.0521 171 ASP L O +4489 C CB . ASP C 173 ? 0.4098 0.5257 0.4913 0.0492 -0.0364 0.0656 171 ASP L CB +4490 C CG . ASP C 173 ? 0.4776 0.5764 0.5501 0.0469 -0.0309 0.0497 171 ASP L CG +4491 O OD1 . ASP C 173 ? 0.4256 0.5085 0.4820 0.0437 -0.0290 0.0392 171 ASP L OD1 +4492 O OD2 . ASP C 173 ? 0.4881 0.5907 0.5709 0.0483 -0.0285 0.0488 171 ASP L OD2 +4493 N N . SER C 174 ? 0.3204 0.4000 0.3583 0.0413 -0.0339 0.0466 172 SER L N +4494 C CA . SER C 174 ? 0.3569 0.4315 0.3765 0.0341 -0.0370 0.0365 172 SER L CA +4495 C C . SER C 174 ? 0.3482 0.4244 0.3611 0.0279 -0.0397 0.0244 172 SER L C +4496 O O . SER C 174 ? 0.3055 0.3821 0.3060 0.0216 -0.0429 0.0172 172 SER L O +4497 C CB . SER C 174 ? 0.4045 0.4924 0.4176 0.0303 -0.0439 0.0434 172 SER L CB +4498 O OG . SER C 174 ? 0.3697 0.4542 0.3887 0.0360 -0.0408 0.0550 172 SER L OG +4499 N N . THR C 175 ? 0.2961 0.3724 0.3177 0.0297 -0.0375 0.0222 173 THR L N +4500 C CA . THR C 175 ? 0.2722 0.3480 0.2888 0.0243 -0.0389 0.0115 173 THR L CA +4501 C C . THR C 175 ? 0.2660 0.3232 0.2762 0.0249 -0.0327 0.0028 173 THR L C +4502 O O . THR C 175 ? 0.3038 0.3486 0.3133 0.0287 -0.0271 0.0040 173 THR L O +4503 C CB . THR C 175 ? 0.2468 0.3334 0.2759 0.0249 -0.0400 0.0138 173 THR L CB +4504 O OG1 . THR C 175 ? 0.3160 0.3947 0.3560 0.0323 -0.0325 0.0178 173 THR L OG1 +4505 C CG2 . THR C 175 ? 0.2529 0.3622 0.2888 0.0223 -0.0478 0.0230 173 THR L CG2 +4506 N N . TYR C 176 ? 0.2733 0.3293 0.2791 0.0203 -0.0337 -0.0056 174 TYR L N +4507 C CA . TYR C 176 ? 0.2652 0.3079 0.2664 0.0198 -0.0293 -0.0124 174 TYR L CA +4508 C C . TYR C 176 ? 0.2984 0.3425 0.3069 0.0201 -0.0273 -0.0141 174 TYR L C +4509 O O . TYR C 176 ? 0.2622 0.3179 0.2781 0.0191 -0.0304 -0.0122 174 TYR L O +4510 C CB . TYR C 176 ? 0.2826 0.3229 0.2752 0.0148 -0.0311 -0.0191 174 TYR L CB +4511 C CG . TYR C 176 ? 0.3294 0.3702 0.3147 0.0135 -0.0329 -0.0180 174 TYR L CG +4512 C CD1 . TYR C 176 ? 0.3332 0.3853 0.3164 0.0102 -0.0374 -0.0168 174 TYR L CD1 +4513 C CD2 . TYR C 176 ? 0.3326 0.3634 0.3124 0.0144 -0.0302 -0.0181 174 TYR L CD2 +4514 C CE1 . TYR C 176 ? 0.3893 0.4421 0.3646 0.0085 -0.0384 -0.0157 174 TYR L CE1 +4515 C CE2 . TYR C 176 ? 0.4182 0.4497 0.3918 0.0130 -0.0313 -0.0168 174 TYR L CE2 +4516 C CZ . TYR C 176 ? 0.4319 0.4742 0.4032 0.0105 -0.0352 -0.0154 174 TYR L CZ +4517 O OH . TYR C 176 ? 0.4215 0.4650 0.3856 0.0086 -0.0358 -0.0139 174 TYR L OH +4518 N N . SER C 177 ? 0.3092 0.3422 0.3147 0.0205 -0.0225 -0.0176 175 SER L N +4519 C CA . SER C 177 ? 0.3094 0.3426 0.3189 0.0194 -0.0206 -0.0202 175 SER L CA +4520 C C . SER C 177 ? 0.3529 0.3781 0.3545 0.0160 -0.0198 -0.0250 175 SER L C +4521 O O . SER C 177 ? 0.3098 0.3280 0.3036 0.0151 -0.0192 -0.0260 175 SER L O +4522 C CB . SER C 177 ? 0.2947 0.3245 0.3105 0.0236 -0.0142 -0.0173 175 SER L CB +4523 O OG . SER C 177 ? 0.3233 0.3631 0.3502 0.0276 -0.0152 -0.0105 175 SER L OG +4524 N N . LEU C 178 ? 0.2764 0.3040 0.2813 0.0137 -0.0200 -0.0271 176 LEU L N +4525 C CA . LEU C 178 ? 0.2940 0.3168 0.2946 0.0106 -0.0198 -0.0295 176 LEU L CA +4526 C C . LEU C 178 ? 0.2996 0.3213 0.3030 0.0098 -0.0168 -0.0291 176 LEU L C +4527 O O . LEU C 178 ? 0.2818 0.3085 0.2926 0.0104 -0.0161 -0.0286 176 LEU L O +4528 C CB . LEU C 178 ? 0.2971 0.3235 0.2999 0.0081 -0.0228 -0.0321 176 LEU L CB +4529 C CG . LEU C 178 ? 0.3577 0.3803 0.3606 0.0061 -0.0219 -0.0329 176 LEU L CG +4530 C CD1 . LEU C 178 ? 0.3725 0.3958 0.3757 0.0046 -0.0227 -0.0358 176 LEU L CD1 +4531 C CD2 . LEU C 178 ? 0.3223 0.3454 0.3319 0.0048 -0.0201 -0.0323 176 LEU L CD2 +4532 N N . SER C 179 ? 0.2711 0.2875 0.2683 0.0078 -0.0153 -0.0287 177 SER L N +4533 C CA . SER C 179 ? 0.3171 0.3332 0.3153 0.0060 -0.0126 -0.0276 177 SER L CA +4534 C C . SER C 179 ? 0.4297 0.4461 0.4275 0.0032 -0.0146 -0.0255 177 SER L C +4535 O O . SER C 179 ? 0.3534 0.3681 0.3457 0.0018 -0.0163 -0.0245 177 SER L O +4536 C CB . SER C 179 ? 0.4570 0.4676 0.4473 0.0055 -0.0077 -0.0278 177 SER L CB +4537 O OG . SER C 179 ? 0.5976 0.6074 0.5832 0.0016 -0.0059 -0.0264 177 SER L OG +4538 N N . SER C 180 ? 0.2859 0.3049 0.2914 0.0024 -0.0140 -0.0240 178 SER L N +4539 C CA . SER C 180 ? 0.3061 0.3258 0.3150 0.0006 -0.0148 -0.0200 178 SER L CA +4540 C C . SER C 180 ? 0.3538 0.3746 0.3620 -0.0017 -0.0126 -0.0158 178 SER L C +4541 O O . SER C 180 ? 0.3382 0.3598 0.3494 -0.0013 -0.0099 -0.0171 178 SER L O +4542 C CB . SER C 180 ? 0.3099 0.3302 0.3298 0.0014 -0.0148 -0.0216 178 SER L CB +4543 O OG . SER C 180 ? 0.3456 0.3657 0.3721 0.0008 -0.0140 -0.0164 178 SER L OG +4544 N N . THR C 181 ? 0.2962 0.3185 0.3005 -0.0044 -0.0138 -0.0101 179 THR L N +4545 C CA . THR C 181 ? 0.3089 0.3337 0.3107 -0.0077 -0.0122 -0.0048 179 THR L CA +4546 C C . THR C 181 ? 0.3271 0.3556 0.3397 -0.0079 -0.0134 0.0035 179 THR L C +4547 O O . THR C 181 ? 0.2982 0.3293 0.3131 -0.0079 -0.0163 0.0080 179 THR L O +4548 C CB . THR C 181 ? 0.3959 0.4210 0.3816 -0.0127 -0.0126 -0.0038 179 THR L CB +4549 O OG1 . THR C 181 ? 0.4118 0.4312 0.3895 -0.0119 -0.0098 -0.0115 179 THR L OG1 +4550 C CG2 . THR C 181 ? 0.3661 0.3943 0.3467 -0.0173 -0.0104 0.0011 179 THR L CG2 +4551 N N . LEU C 182 ? 0.2817 0.3107 0.3023 -0.0078 -0.0106 0.0062 180 LEU L N +4552 C CA . LEU C 182 ? 0.2898 0.3215 0.3217 -0.0079 -0.0103 0.0158 180 LEU L CA +4553 C C . LEU C 182 ? 0.3095 0.3471 0.3326 -0.0127 -0.0109 0.0240 180 LEU L C +4554 O O . LEU C 182 ? 0.3276 0.3646 0.3433 -0.0150 -0.0081 0.0213 180 LEU L O +4555 C CB . LEU C 182 ? 0.3282 0.3560 0.3741 -0.0059 -0.0062 0.0135 180 LEU L CB +4556 C CG . LEU C 182 ? 0.3371 0.3651 0.3974 -0.0055 -0.0037 0.0233 180 LEU L CG +4557 C CD1 . LEU C 182 ? 0.3396 0.3660 0.4113 -0.0024 -0.0036 0.0266 180 LEU L CD1 +4558 C CD2 . LEU C 182 ? 0.3035 0.3269 0.3738 -0.0057 0.0011 0.0192 180 LEU L CD2 +4559 N N . THR C 183 ? 0.3580 0.4025 0.3820 -0.0148 -0.0145 0.0346 181 THR L N +4560 C CA . THR C 183 ? 0.3382 0.3907 0.3514 -0.0211 -0.0162 0.0434 181 THR L CA +4561 C C . THR C 183 ? 0.3849 0.4433 0.4128 -0.0205 -0.0161 0.0578 181 THR L C +4562 O O . THR C 183 ? 0.3544 0.4149 0.3980 -0.0167 -0.0174 0.0651 181 THR L O +4563 C CB . THR C 183 ? 0.4643 0.5233 0.4637 -0.0265 -0.0216 0.0455 181 THR L CB +4564 O OG1 . THR C 183 ? 0.5074 0.5589 0.4952 -0.0265 -0.0206 0.0325 181 THR L OG1 +4565 C CG2 . THR C 183 ? 0.4855 0.5529 0.4693 -0.0355 -0.0233 0.0526 181 THR L CG2 +4566 N N . LEU C 184 ? 0.3574 0.4180 0.3814 -0.0239 -0.0136 0.0621 182 LEU L N +4567 C CA . LEU C 184 ? 0.4020 0.4687 0.4384 -0.0242 -0.0131 0.0772 182 LEU L CA +4568 C C . LEU C 184 ? 0.4352 0.5116 0.4542 -0.0328 -0.0150 0.0849 182 LEU L C +4569 O O . LEU C 184 ? 0.3845 0.4586 0.3838 -0.0376 -0.0133 0.0753 182 LEU L O +4570 C CB . LEU C 184 ? 0.4185 0.4766 0.4697 -0.0201 -0.0064 0.0747 182 LEU L CB +4571 C CG . LEU C 184 ? 0.6208 0.6678 0.6856 -0.0140 -0.0028 0.0637 182 LEU L CG +4572 C CD1 . LEU C 184 ? 0.6728 0.7141 0.7282 -0.0147 -0.0003 0.0493 182 LEU L CD1 +4573 C CD2 . LEU C 184 ? 0.7026 0.7451 0.7890 -0.0108 0.0022 0.0708 182 LEU L CD2 +4574 N N . SER C 185 ? 0.4023 0.4895 0.4289 -0.0347 -0.0176 0.1026 183 SER L N +4575 C CA . SER C 185 ? 0.4121 0.5090 0.4228 -0.0436 -0.0185 0.1109 183 SER L CA +4576 C C . SER C 185 ? 0.3849 0.4739 0.3955 -0.0430 -0.0108 0.1056 183 SER L C +4577 O O . SER C 185 ? 0.3953 0.4743 0.4236 -0.0359 -0.0058 0.1009 183 SER L O +4578 C CB . SER C 185 ? 0.4546 0.5667 0.4762 -0.0454 -0.0235 0.1337 183 SER L CB +4579 O OG . SER C 185 ? 0.4961 0.6034 0.5426 -0.0382 -0.0185 0.1423 183 SER L OG +4580 N N . LYS C 186 ? 0.4523 0.5462 0.4425 -0.0515 -0.0093 0.1060 184 LYS L N +4581 C CA . LYS C 186 ? 0.4214 0.5094 0.4121 -0.0514 -0.0014 0.1022 184 LYS L CA +4582 C C . LYS C 186 ? 0.4396 0.5289 0.4535 -0.0472 0.0004 0.1162 184 LYS L C +4583 O O . LYS C 186 ? 0.4447 0.5245 0.4723 -0.0423 0.0066 0.1105 184 LYS L O +4584 C CB . LYS C 186 ? 0.5019 0.5958 0.4664 -0.0620 0.0008 0.1018 184 LYS L CB +4585 C CG . LYS C 186 ? 0.5215 0.6111 0.4868 -0.0625 0.0097 0.0995 184 LYS L CG +4586 C CD . LYS C 186 ? 0.6395 0.7363 0.5779 -0.0741 0.0125 0.1014 184 LYS L CD +4587 C CE . LYS C 186 ? 0.7703 0.8621 0.7079 -0.0746 0.0229 0.0965 184 LYS L CE +4588 N NZ . LYS C 186 ? 0.7907 0.8863 0.7473 -0.0721 0.0240 0.1111 184 LYS L NZ +4589 N N . ALA C 187 ? 0.4993 0.6005 0.5191 -0.0492 -0.0047 0.1353 185 ALA L N +4590 C CA . ALA C 187 ? 0.5181 0.6198 0.5619 -0.0448 -0.0020 0.1506 185 ALA L CA +4591 C C . ALA C 187 ? 0.5207 0.6090 0.5902 -0.0346 0.0017 0.1445 185 ALA L C +4592 O O . ALA C 187 ? 0.5080 0.5878 0.5943 -0.0311 0.0083 0.1454 185 ALA L O +4593 C CB . ALA C 187 ? 0.4991 0.6177 0.5467 -0.0481 -0.0088 0.1740 185 ALA L CB +4594 N N . ASP C 188 ? 0.4418 0.5274 0.5136 -0.0308 -0.0019 0.1373 186 ASP L N +4595 C CA . ASP C 188 ? 0.5053 0.5777 0.5983 -0.0224 0.0023 0.1295 186 ASP L CA +4596 C C . ASP C 188 ? 0.4449 0.5049 0.5344 -0.0215 0.0077 0.1102 186 ASP L C +4597 O O . ASP C 188 ? 0.4846 0.5342 0.5916 -0.0178 0.0136 0.1063 186 ASP L O +4598 C CB . ASP C 188 ? 0.6183 0.6923 0.7128 -0.0192 -0.0026 0.1268 186 ASP L CB +4599 C CG . ASP C 188 ? 0.8239 0.9032 0.9412 -0.0145 -0.0033 0.1446 186 ASP L CG +4600 O OD1 . ASP C 188 ? 0.8702 0.9592 0.9945 -0.0162 -0.0041 0.1636 186 ASP L OD1 +4601 O OD2 . ASP C 188 ? 0.8806 0.9547 1.0096 -0.0089 -0.0026 0.1403 186 ASP L OD2 +4602 N N . TYR C 189 ? 0.3943 0.4554 0.4623 -0.0254 0.0061 0.0983 187 TYR L N +4603 C CA . TYR C 189 ? 0.3668 0.4191 0.4329 -0.0244 0.0107 0.0821 187 TYR L CA +4604 C C . TYR C 189 ? 0.4335 0.4832 0.5095 -0.0255 0.0170 0.0854 187 TYR L C +4605 O O . TYR C 189 ? 0.4068 0.4487 0.4938 -0.0234 0.0212 0.0761 187 TYR L O +4606 C CB . TYR C 189 ? 0.3781 0.4330 0.4208 -0.0283 0.0094 0.0723 187 TYR L CB +4607 C CG . TYR C 189 ? 0.3345 0.3832 0.3762 -0.0271 0.0142 0.0582 187 TYR L CG +4608 C CD1 . TYR C 189 ? 0.3218 0.3642 0.3715 -0.0225 0.0138 0.0470 187 TYR L CD1 +4609 C CD2 . TYR C 189 ? 0.3462 0.3970 0.3789 -0.0309 0.0193 0.0568 187 TYR L CD2 +4610 C CE1 . TYR C 189 ? 0.3181 0.3579 0.3684 -0.0215 0.0172 0.0363 187 TYR L CE1 +4611 C CE2 . TYR C 189 ? 0.3700 0.4171 0.4045 -0.0292 0.0238 0.0455 187 TYR L CE2 +4612 C CZ . TYR C 189 ? 0.4016 0.4441 0.4457 -0.0245 0.0222 0.0361 187 TYR L CZ +4613 O OH . TYR C 189 ? 0.3902 0.4321 0.4378 -0.0230 0.0259 0.0271 187 TYR L OH +4614 N N . GLU C 190 ? 0.4627 0.5200 0.5349 -0.0297 0.0177 0.0989 188 GLU L N +4615 C CA . GLU C 190 ? 0.5082 0.5637 0.5886 -0.0315 0.0242 0.1027 188 GLU L CA +4616 C C . GLU C 190 ? 0.4529 0.5020 0.5589 -0.0278 0.0278 0.1116 188 GLU L C +4617 O O . GLU C 190 ? 0.5013 0.5474 0.6167 -0.0293 0.0337 0.1145 188 GLU L O +4618 C CB . GLU C 190 ? 0.5077 0.5738 0.5724 -0.0382 0.0243 0.1139 188 GLU L CB +4619 C CG . GLU C 190 ? 0.6569 0.7254 0.6972 -0.0428 0.0251 0.1023 188 GLU L CG +4620 C CD . GLU C 190 ? 0.8784 0.9576 0.8987 -0.0512 0.0249 0.1124 188 GLU L CD +4621 O OE1 . GLU C 190 ? 0.9572 1.0451 0.9792 -0.0535 0.0204 0.1293 188 GLU L OE1 +4622 O OE2 . GLU C 190 ? 0.9412 1.0206 0.9442 -0.0557 0.0297 0.1039 188 GLU L OE2 +4623 N N . LYS C 191 ? 0.4391 0.4852 0.5574 -0.0231 0.0255 0.1154 189 LYS L N +4624 C CA . LYS C 191 ? 0.4947 0.5317 0.6388 -0.0192 0.0312 0.1221 189 LYS L CA +4625 C C . LYS C 191 ? 0.5483 0.5715 0.7028 -0.0172 0.0359 0.1049 189 LYS L C +4626 O O . LYS C 191 ? 0.5270 0.5396 0.7020 -0.0151 0.0423 0.1071 189 LYS L O +4627 C CB . LYS C 191 ? 0.5555 0.5959 0.7107 -0.0148 0.0283 0.1361 189 LYS L CB +4628 C CG . LYS C 191 ? 0.7023 0.7585 0.8521 -0.0178 0.0236 0.1573 189 LYS L CG +4629 C CD . LYS C 191 ? 0.7979 0.8626 0.9544 -0.0143 0.0180 0.1694 189 LYS L CD +4630 C CE . LYS C 191 ? 0.8484 0.9000 1.0248 -0.0067 0.0224 0.1619 189 LYS L CE +4631 N NZ . LYS C 191 ? 0.9388 0.9996 1.1185 -0.0036 0.0165 0.1702 189 LYS L NZ +4632 N N . HIS C 192 ? 0.4538 0.4767 0.5947 -0.0184 0.0332 0.0882 190 HIS L N +4633 C CA . HIS C 192 ? 0.4487 0.4615 0.5973 -0.0178 0.0361 0.0725 190 HIS L CA +4634 C C . HIS C 192 ? 0.3680 0.3837 0.5069 -0.0213 0.0358 0.0604 190 HIS L C +4635 O O . HIS C 192 ? 0.4253 0.4495 0.5491 -0.0229 0.0333 0.0612 190 HIS L O +4636 C CB . HIS C 192 ? 0.3980 0.4083 0.5437 -0.0141 0.0323 0.0654 190 HIS L CB +4637 C CG . HIS C 192 ? 0.4527 0.4622 0.6093 -0.0099 0.0325 0.0780 190 HIS L CG +4638 N ND1 . HIS C 192 ? 0.5744 0.5736 0.7529 -0.0076 0.0401 0.0833 190 HIS L ND1 +4639 C CD2 . HIS C 192 ? 0.5430 0.5615 0.6932 -0.0078 0.0267 0.0873 190 HIS L CD2 +4640 C CE1 . HIS C 192 ? 0.5804 0.5826 0.7672 -0.0031 0.0391 0.0962 190 HIS L CE1 +4641 N NE2 . HIS C 192 ? 0.5819 0.5970 0.7517 -0.0035 0.0303 0.0991 190 HIS L NE2 +4642 N N . LYS C 193 ? 0.3610 0.3699 0.5090 -0.0231 0.0388 0.0488 191 LYS L N +4643 C CA . LYS C 193 ? 0.4063 0.4196 0.5507 -0.0266 0.0390 0.0392 191 LYS L CA +4644 C C . LYS C 193 ? 0.3911 0.4062 0.5282 -0.0260 0.0344 0.0255 191 LYS L C +4645 O O . LYS C 193 ? 0.4207 0.4438 0.5474 -0.0258 0.0317 0.0218 191 LYS L O +4646 C CB . LYS C 193 ? 0.4435 0.4512 0.6043 -0.0313 0.0454 0.0378 191 LYS L CB +4647 C CG . LYS C 193 ? 0.5013 0.5166 0.6611 -0.0355 0.0456 0.0305 191 LYS L CG +4648 C CD . LYS C 193 ? 0.6964 0.7064 0.8726 -0.0417 0.0512 0.0271 191 LYS L CD +4649 C CE . LYS C 193 ? 0.7589 0.7740 0.9362 -0.0462 0.0484 0.0135 191 LYS L CE +4650 N NZ . LYS C 193 ? 0.7539 0.7702 0.9445 -0.0539 0.0529 0.0116 191 LYS L NZ +4651 N N . VAL C 194 ? 0.3655 0.3731 0.5084 -0.0260 0.0344 0.0181 192 VAL L N +4652 C CA . VAL C 194 ? 0.3177 0.3279 0.4552 -0.0270 0.0303 0.0053 192 VAL L CA +4653 C C . VAL C 194 ? 0.4058 0.4163 0.5323 -0.0222 0.0255 0.0044 192 VAL L C +4654 O O . VAL C 194 ? 0.3649 0.3683 0.4952 -0.0199 0.0268 0.0068 192 VAL L O +4655 C CB . VAL C 194 ? 0.3155 0.3180 0.4637 -0.0323 0.0337 -0.0040 192 VAL L CB +4656 C CG1 . VAL C 194 ? 0.3525 0.3607 0.4933 -0.0344 0.0284 -0.0157 192 VAL L CG1 +4657 C CG2 . VAL C 194 ? 0.3826 0.3842 0.5427 -0.0381 0.0389 -0.0027 192 VAL L CG2 +4658 N N . TYR C 195 ? 0.3616 0.3800 0.4758 -0.0205 0.0207 0.0012 193 TYR L N +4659 C CA . TYR C 195 ? 0.3254 0.3445 0.4282 -0.0167 0.0160 -0.0004 193 TYR L CA +4660 C C . TYR C 195 ? 0.3257 0.3474 0.4256 -0.0175 0.0127 -0.0110 193 TYR L C +4661 O O . TYR C 195 ? 0.3242 0.3531 0.4240 -0.0190 0.0116 -0.0143 193 TYR L O +4662 C CB . TYR C 195 ? 0.3102 0.3351 0.4003 -0.0147 0.0143 0.0052 193 TYR L CB +4663 C CG . TYR C 195 ? 0.3243 0.3485 0.4147 -0.0147 0.0159 0.0168 193 TYR L CG +4664 C CD1 . TYR C 195 ? 0.3501 0.3756 0.4465 -0.0173 0.0202 0.0234 193 TYR L CD1 +4665 C CD2 . TYR C 195 ? 0.3042 0.3278 0.3904 -0.0126 0.0131 0.0224 193 TYR L CD2 +4666 C CE1 . TYR C 195 ? 0.3715 0.3979 0.4685 -0.0177 0.0212 0.0360 193 TYR L CE1 +4667 C CE2 . TYR C 195 ? 0.3139 0.3397 0.4015 -0.0131 0.0136 0.0352 193 TYR L CE2 +4668 C CZ . TYR C 195 ? 0.3793 0.4066 0.4721 -0.0156 0.0175 0.0423 193 TYR L CZ +4669 O OH . TYR C 195 ? 0.3759 0.4070 0.4703 -0.0165 0.0175 0.0568 193 TYR L OH +4670 N N . ALA C 196 ? 0.3280 0.3450 0.4265 -0.0166 0.0112 -0.0155 194 ALA L N +4671 C CA . ALA C 196 ? 0.3193 0.3391 0.4151 -0.0189 0.0082 -0.0251 194 ALA L CA +4672 C C . ALA C 196 ? 0.3508 0.3687 0.4377 -0.0155 0.0050 -0.0272 194 ALA L C +4673 O O . ALA C 196 ? 0.3220 0.3339 0.4096 -0.0129 0.0066 -0.0234 194 ALA L O +4674 C CB . ALA C 196 ? 0.3160 0.3307 0.4211 -0.0251 0.0117 -0.0319 194 ALA L CB +4675 N N . CYS C 197 ? 0.3151 0.3392 0.3949 -0.0155 0.0005 -0.0321 195 CYS L N +4676 C CA A CYS C 197 ? 0.3893 0.4117 0.4613 -0.0135 -0.0021 -0.0353 195 CYS L CA +4677 C CA B CYS C 197 ? 0.3305 0.3529 0.4026 -0.0136 -0.0021 -0.0353 195 CYS L CA +4678 C C . CYS C 197 ? 0.3875 0.4128 0.4589 -0.0186 -0.0038 -0.0439 195 CYS L C +4679 O O . CYS C 197 ? 0.3468 0.3815 0.4192 -0.0214 -0.0068 -0.0454 195 CYS L O +4680 C CB A CYS C 197 ? 0.4447 0.4711 0.5066 -0.0089 -0.0058 -0.0319 195 CYS L CB +4681 C CB B CYS C 197 ? 0.4570 0.4833 0.5189 -0.0089 -0.0058 -0.0320 195 CYS L CB +4682 S SG A CYS C 197 ? 0.4752 0.5119 0.5348 -0.0080 -0.0088 -0.0322 195 CYS L SG +4683 S SG B CYS C 197 ? 0.5608 0.5972 0.6204 -0.0080 -0.0087 -0.0322 195 CYS L SG +4684 N N . GLU C 198 ? 0.3092 0.3274 0.3798 -0.0204 -0.0014 -0.0489 196 GLU L N +4685 C CA . GLU C 198 ? 0.3351 0.3549 0.4026 -0.0271 -0.0020 -0.0582 196 GLU L CA +4686 C C . GLU C 198 ? 0.3547 0.3766 0.4115 -0.0247 -0.0056 -0.0597 196 GLU L C +4687 O O . GLU C 198 ? 0.3865 0.4017 0.4418 -0.0202 -0.0034 -0.0576 196 GLU L O +4688 C CB . GLU C 198 ? 0.3857 0.3935 0.4597 -0.0319 0.0058 -0.0642 196 GLU L CB +4689 C CG . GLU C 198 ? 0.4197 0.4276 0.4880 -0.0410 0.0065 -0.0756 196 GLU L CG +4690 C CD . GLU C 198 ? 0.6330 0.6250 0.7063 -0.0442 0.0168 -0.0824 196 GLU L CD +4691 O OE1 . GLU C 198 ? 0.6539 0.6382 0.7280 -0.0383 0.0208 -0.0802 196 GLU L OE1 +4692 O OE2 . GLU C 198 ? 0.7121 0.6993 0.7896 -0.0528 0.0216 -0.0896 196 GLU L OE2 +4693 N N . VAL C 199 ? 0.3373 0.3699 0.3878 -0.0279 -0.0113 -0.0621 197 VAL L N +4694 C CA . VAL C 199 ? 0.3560 0.3926 0.3966 -0.0255 -0.0154 -0.0618 197 VAL L CA +4695 C C . VAL C 199 ? 0.3094 0.3480 0.3431 -0.0337 -0.0157 -0.0704 197 VAL L C +4696 O O . VAL C 199 ? 0.3618 0.4082 0.3961 -0.0416 -0.0180 -0.0743 197 VAL L O +4697 C CB . VAL C 199 ? 0.3596 0.4079 0.3990 -0.0218 -0.0215 -0.0553 197 VAL L CB +4698 C CG1 . VAL C 199 ? 0.3253 0.3779 0.3553 -0.0203 -0.0255 -0.0547 197 VAL L CG1 +4699 C CG2 . VAL C 199 ? 0.3282 0.3728 0.3711 -0.0147 -0.0197 -0.0484 197 VAL L CG2 +4700 N N . THR C 200 ? 0.3879 0.4205 0.4144 -0.0326 -0.0135 -0.0734 198 THR L N +4701 C CA . THR C 200 ? 0.4337 0.4685 0.4503 -0.0407 -0.0135 -0.0816 198 THR L CA +4702 C C . THR C 200 ? 0.3350 0.3772 0.3420 -0.0373 -0.0191 -0.0774 198 THR L C +4703 O O . THR C 200 ? 0.3574 0.3951 0.3646 -0.0292 -0.0186 -0.0720 198 THR L O +4704 C CB . THR C 200 ? 0.5309 0.5509 0.5479 -0.0436 -0.0036 -0.0900 198 THR L CB +4705 O OG1 . THR C 200 ? 0.7366 0.7500 0.7536 -0.0356 -0.0009 -0.0860 198 THR L OG1 +4706 C CG2 . THR C 200 ? 0.5611 0.5714 0.5904 -0.0446 0.0031 -0.0916 198 THR L CG2 +4707 N N . HIS C 201 ? 0.3455 0.4001 0.3443 -0.0441 -0.0246 -0.0792 199 HIS L N +4708 C CA . HIS C 201 ? 0.3757 0.4391 0.3666 -0.0412 -0.0304 -0.0734 199 HIS L CA +4709 C C . HIS C 201 ? 0.4039 0.4792 0.3840 -0.0523 -0.0346 -0.0779 199 HIS L C +4710 O O . HIS C 201 ? 0.4400 0.5224 0.4211 -0.0613 -0.0363 -0.0821 199 HIS L O +4711 C CB . HIS C 201 ? 0.3679 0.4398 0.3659 -0.0335 -0.0361 -0.0622 199 HIS L CB +4712 C CG . HIS C 201 ? 0.3345 0.4132 0.3265 -0.0295 -0.0407 -0.0553 199 HIS L CG +4713 N ND1 . HIS C 201 ? 0.3374 0.4328 0.3266 -0.0336 -0.0476 -0.0507 199 HIS L ND1 +4714 C CD2 . HIS C 201 ? 0.3180 0.3896 0.3069 -0.0224 -0.0392 -0.0516 199 HIS L CD2 +4715 C CE1 . HIS C 201 ? 0.3902 0.4871 0.3754 -0.0284 -0.0496 -0.0440 199 HIS L CE1 +4716 N NE2 . HIS C 201 ? 0.3401 0.4223 0.3247 -0.0219 -0.0444 -0.0452 199 HIS L NE2 +4717 N N . GLN C 202 ? 0.3985 0.4769 0.3676 -0.0524 -0.0363 -0.0767 200 GLN L N +4718 C CA . GLN C 202 ? 0.4312 0.5220 0.3871 -0.0639 -0.0404 -0.0804 200 GLN L CA +4719 C C . GLN C 202 ? 0.4659 0.5775 0.4254 -0.0689 -0.0501 -0.0737 200 GLN L C +4720 O O . GLN C 202 ? 0.4549 0.5779 0.4055 -0.0821 -0.0535 -0.0787 200 GLN L O +4721 C CB . GLN C 202 ? 0.4415 0.5340 0.3868 -0.0611 -0.0416 -0.0765 200 GLN L CB +4722 C CG . GLN C 202 ? 0.5688 0.6739 0.4974 -0.0737 -0.0453 -0.0801 200 GLN L CG +4723 C CD . GLN C 202 ? 0.6256 0.7319 0.5441 -0.0707 -0.0458 -0.0754 200 GLN L CD +4724 O OE1 . GLN C 202 ? 0.5202 0.6148 0.4433 -0.0603 -0.0415 -0.0725 200 GLN L OE1 +4725 N NE2 . GLN C 202 ? 0.6139 0.7357 0.5184 -0.0805 -0.0514 -0.0741 200 GLN L NE2 +4726 N N . GLY C 203 ? 0.4168 0.5342 0.3893 -0.0593 -0.0542 -0.0623 201 GLY L N +4727 C CA . GLY C 203 ? 0.4018 0.5401 0.3820 -0.0623 -0.0627 -0.0537 201 GLY L CA +4728 C C . GLY C 203 ? 0.4395 0.5811 0.4279 -0.0692 -0.0624 -0.0586 201 GLY L C +4729 O O . GLY C 203 ? 0.4497 0.6112 0.4446 -0.0741 -0.0698 -0.0522 201 GLY L O +4730 N N . LEU C 204 ? 0.4137 0.5371 0.4034 -0.0699 -0.0541 -0.0688 202 LEU L N +4731 C CA . LEU C 204 ? 0.4542 0.5778 0.4517 -0.0771 -0.0523 -0.0744 202 LEU L CA +4732 C C . LEU C 204 ? 0.4671 0.5847 0.4523 -0.0918 -0.0480 -0.0891 202 LEU L C +4733 O O . LEU C 204 ? 0.5315 0.6314 0.5093 -0.0910 -0.0397 -0.0974 202 LEU L O +4734 C CB . LEU C 204 ? 0.4432 0.5498 0.4524 -0.0674 -0.0449 -0.0742 202 LEU L CB +4735 C CG . LEU C 204 ? 0.3598 0.4663 0.3779 -0.0531 -0.0460 -0.0625 202 LEU L CG +4736 C CD1 . LEU C 204 ? 0.3378 0.4250 0.3608 -0.0452 -0.0380 -0.0641 202 LEU L CD1 +4737 C CD2 . LEU C 204 ? 0.3607 0.4841 0.3914 -0.0522 -0.0514 -0.0536 202 LEU L CD2 +4738 N N . SER C 205 ? 0.5306 0.6628 0.5143 -0.1056 -0.0528 -0.0924 203 SER L N +4739 C CA . SER C 205 ? 0.6499 0.7752 0.6205 -0.1216 -0.0475 -0.1082 203 SER L CA +4740 C C . SER C 205 ? 0.6893 0.7896 0.6667 -0.1203 -0.0349 -0.1183 203 SER L C +4741 O O . SER C 205 ? 0.7498 0.8345 0.7175 -0.1278 -0.0255 -0.1316 203 SER L O +4742 C CB . SER C 205 ? 0.6140 0.7616 0.5815 -0.1384 -0.0560 -0.1095 203 SER L CB +4743 O OG . SER C 205 ? 0.6976 0.8546 0.6836 -0.1353 -0.0598 -0.1017 203 SER L OG +4744 N N . SER C 206 ? 0.6236 0.7200 0.6182 -0.1109 -0.0336 -0.1116 204 SER L N +4745 C CA . SER C 206 ? 0.6188 0.6929 0.6226 -0.1073 -0.0223 -0.1172 204 SER L CA +4746 C C . SER C 206 ? 0.5789 0.6491 0.5959 -0.0905 -0.0224 -0.1051 204 SER L C +4747 O O . SER C 206 ? 0.5376 0.6228 0.5592 -0.0841 -0.0306 -0.0940 204 SER L O +4748 C CB . SER C 206 ? 0.6833 0.7579 0.6935 -0.1196 -0.0201 -0.1241 204 SER L CB +4749 O OG . SER C 206 ? 0.8086 0.9062 0.8260 -0.1219 -0.0307 -0.1152 204 SER L OG +4750 N N . PRO C 207 ? 0.4978 0.5482 0.5213 -0.0830 -0.0130 -0.1063 205 PRO L N +4751 C CA . PRO C 207 ? 0.4641 0.5114 0.4972 -0.0686 -0.0133 -0.0950 205 PRO L CA +4752 C C . PRO C 207 ? 0.4293 0.4873 0.4738 -0.0672 -0.0176 -0.0876 205 PRO L C +4753 O O . PRO C 207 ? 0.4416 0.5029 0.4913 -0.0762 -0.0169 -0.0917 205 PRO L O +4754 C CB . PRO C 207 ? 0.5180 0.5446 0.5574 -0.0645 -0.0023 -0.0980 205 PRO L CB +4755 C CG . PRO C 207 ? 0.5602 0.5776 0.5904 -0.0732 0.0042 -0.1103 205 PRO L CG +4756 C CD . PRO C 207 ? 0.5636 0.5939 0.5855 -0.0874 -0.0011 -0.1174 205 PRO L CD +4757 N N . VAL C 208 ? 0.3830 0.4464 0.4312 -0.0563 -0.0214 -0.0771 206 VAL L N +4758 C CA . VAL C 208 ? 0.3590 0.4321 0.4180 -0.0534 -0.0241 -0.0694 206 VAL L CA +4759 C C . VAL C 208 ? 0.4225 0.4828 0.4885 -0.0454 -0.0179 -0.0651 206 VAL L C +4760 O O . VAL C 208 ? 0.3934 0.4448 0.4553 -0.0377 -0.0159 -0.0623 206 VAL L O +4761 C CB . VAL C 208 ? 0.4428 0.5312 0.5013 -0.0477 -0.0314 -0.0606 206 VAL L CB +4762 C CG1 . VAL C 208 ? 0.4653 0.5590 0.5357 -0.0415 -0.0309 -0.0522 206 VAL L CG1 +4763 C CG2 . VAL C 208 ? 0.4984 0.6047 0.5534 -0.0570 -0.0388 -0.0619 206 VAL L CG2 +4764 N N . THR C 209 ? 0.3725 0.4331 0.4489 -0.0480 -0.0152 -0.0639 207 THR L N +4765 C CA . THR C 209 ? 0.3596 0.4104 0.4424 -0.0416 -0.0097 -0.0585 207 THR L CA +4766 C C . THR C 209 ? 0.3853 0.4466 0.4751 -0.0379 -0.0115 -0.0508 207 THR L C +4767 O O . THR C 209 ? 0.3551 0.4282 0.4520 -0.0434 -0.0138 -0.0509 207 THR L O +4768 C CB . THR C 209 ? 0.4561 0.4950 0.5462 -0.0472 -0.0025 -0.0630 207 THR L CB +4769 O OG1 . THR C 209 ? 0.4620 0.4893 0.5468 -0.0499 0.0014 -0.0704 207 THR L OG1 +4770 C CG2 . THR C 209 ? 0.4356 0.4665 0.5325 -0.0406 0.0024 -0.0550 207 THR L CG2 +4771 N N . LYS C 210 ? 0.3499 0.4075 0.4375 -0.0293 -0.0100 -0.0442 208 LYS L N +4772 C CA . LYS C 210 ? 0.3187 0.3820 0.4121 -0.0255 -0.0086 -0.0375 208 LYS L CA +4773 C C . LYS C 210 ? 0.3771 0.4299 0.4724 -0.0237 -0.0028 -0.0340 208 LYS L C +4774 O O . LYS C 210 ? 0.3153 0.3581 0.4050 -0.0210 -0.0013 -0.0333 208 LYS L O +4775 C CB . LYS C 210 ? 0.3046 0.3721 0.3923 -0.0181 -0.0106 -0.0332 208 LYS L CB +4776 C CG . LYS C 210 ? 0.3303 0.4096 0.4177 -0.0189 -0.0165 -0.0339 208 LYS L CG +4777 C CD . LYS C 210 ? 0.4213 0.5160 0.5212 -0.0236 -0.0184 -0.0321 208 LYS L CD +4778 C CE . LYS C 210 ? 0.5686 0.6784 0.6697 -0.0248 -0.0252 -0.0304 208 LYS L CE +4779 N NZ . LYS C 210 ? 0.6919 0.8192 0.8063 -0.0310 -0.0282 -0.0280 208 LYS L NZ +4780 N N . SER C 211 ? 0.2867 0.3430 0.3908 -0.0256 0.0004 -0.0309 209 SER L N +4781 C CA . SER C 211 ? 0.3382 0.3857 0.4450 -0.0252 0.0058 -0.0265 209 SER L CA +4782 C C . SER C 211 ? 0.3820 0.4356 0.4928 -0.0238 0.0090 -0.0207 209 SER L C +4783 O O . SER C 211 ? 0.2991 0.3637 0.4150 -0.0241 0.0079 -0.0208 209 SER L O +4784 C CB . SER C 211 ? 0.3785 0.4193 0.4942 -0.0319 0.0090 -0.0301 209 SER L CB +4785 O OG . SER C 211 ? 0.5426 0.5924 0.6670 -0.0386 0.0083 -0.0334 209 SER L OG +4786 N N . PHE C 212 ? 0.3778 0.4251 0.4867 -0.0222 0.0132 -0.0148 210 PHE L N +4787 C CA . PHE C 212 ? 0.3699 0.4215 0.4833 -0.0228 0.0180 -0.0096 210 PHE L CA +4788 C C . PHE C 212 ? 0.4171 0.4610 0.5343 -0.0251 0.0221 -0.0040 210 PHE L C +4789 O O . PHE C 212 ? 0.3609 0.3965 0.4764 -0.0244 0.0216 -0.0027 210 PHE L O +4790 C CB . PHE C 212 ? 0.3329 0.3869 0.4358 -0.0181 0.0196 -0.0066 210 PHE L CB +4791 C CG . PHE C 212 ? 0.3242 0.3705 0.4138 -0.0159 0.0194 -0.0033 210 PHE L CG +4792 C CD1 . PHE C 212 ? 0.3586 0.4023 0.4452 -0.0175 0.0230 0.0038 210 PHE L CD1 +4793 C CD2 . PHE C 212 ? 0.3383 0.3816 0.4186 -0.0130 0.0151 -0.0063 210 PHE L CD2 +4794 C CE1 . PHE C 212 ? 0.3443 0.3839 0.4190 -0.0168 0.0217 0.0083 210 PHE L CE1 +4795 C CE2 . PHE C 212 ? 0.3105 0.3488 0.3794 -0.0121 0.0142 -0.0027 210 PHE L CE2 +4796 C CZ . PHE C 212 ? 0.3369 0.3741 0.4030 -0.0142 0.0171 0.0048 210 PHE L CZ +4797 N N . ASN C 213 ? 0.3569 0.4043 0.4809 -0.0275 0.0268 0.0003 211 ASN L N +4798 C CA . ASN C 213 ? 0.3202 0.3618 0.4478 -0.0293 0.0314 0.0080 211 ASN L CA +4799 C C . ASN C 213 ? 0.3517 0.3958 0.4681 -0.0272 0.0340 0.0152 211 ASN L C +4800 O O . ASN C 213 ? 0.4484 0.4994 0.5623 -0.0268 0.0365 0.0144 211 ASN L O +4801 C CB . ASN C 213 ? 0.4154 0.4586 0.5583 -0.0350 0.0355 0.0082 211 ASN L CB +4802 C CG . ASN C 213 ? 0.4864 0.5293 0.6384 -0.0396 0.0331 -0.0009 211 ASN L CG +4803 O OD1 . ASN C 213 ? 0.5772 0.6286 0.7380 -0.0442 0.0332 -0.0042 211 ASN L OD1 +4804 N ND2 . ASN C 213 ? 0.4098 0.4437 0.5595 -0.0393 0.0311 -0.0050 211 ASN L ND2 +4805 N N . ARG C 214 ? 0.3218 0.3610 0.4319 -0.0263 0.0338 0.0227 212 ARG L N +4806 C CA . ARG C 214 ? 0.3662 0.4083 0.4625 -0.0263 0.0356 0.0296 212 ARG L CA +4807 C C . ARG C 214 ? 0.4705 0.5175 0.5701 -0.0294 0.0421 0.0328 212 ARG L C +4808 O O . ARG C 214 ? 0.4899 0.5361 0.6028 -0.0321 0.0452 0.0368 212 ARG L O +4809 C CB . ARG C 214 ? 0.3400 0.3788 0.4337 -0.0266 0.0340 0.0400 212 ARG L CB +4810 C CG . ARG C 214 ? 0.4052 0.4489 0.4820 -0.0287 0.0347 0.0477 212 ARG L CG +4811 C CD . ARG C 214 ? 0.4337 0.4777 0.5099 -0.0292 0.0316 0.0602 212 ARG L CD +4812 N NE . ARG C 214 ? 0.4139 0.4538 0.5095 -0.0289 0.0342 0.0677 212 ARG L NE +4813 C CZ . ARG C 214 ? 0.5086 0.5496 0.6113 -0.0318 0.0395 0.0751 212 ARG L CZ +4814 N NH1 . ARG C 214 ? 0.5200 0.5551 0.6416 -0.0314 0.0426 0.0814 212 ARG L NH1 +4815 N NH2 . ARG C 214 ? 0.4537 0.5008 0.5447 -0.0354 0.0427 0.0760 212 ARG L NH2 +4816 N N . GLY C 215 ? 0.5785 0.6300 0.6667 -0.0290 0.0451 0.0306 213 GLY L N +4817 C CA . GLY C 215 ? 0.7359 0.7926 0.8273 -0.0313 0.0525 0.0324 213 GLY L CA +4818 C C . GLY C 215 ? 0.8250 0.8873 0.9309 -0.0302 0.0543 0.0258 213 GLY L C +4819 O O . GLY C 215 ? 0.8758 0.9427 0.9927 -0.0330 0.0596 0.0286 213 GLY L O +4820 N N . GLU C 216 ? 0.9182 0.9816 1.0249 -0.0266 0.0500 0.0183 214 GLU L N +4821 C CA . GLU C 216 ? 0.9527 1.0243 1.0744 -0.0257 0.0496 0.0135 214 GLU L CA +4822 C C . GLU C 216 ? 1.0625 1.1377 1.2017 -0.0308 0.0504 0.0153 214 GLU L C +4823 O O . GLU C 216 ? 1.2392 1.3222 1.3886 -0.0326 0.0558 0.0174 214 GLU L O +4824 C CB . GLU C 216 ? 0.9340 1.0119 1.0550 -0.0227 0.0567 0.0128 214 GLU L CB +4825 C CG . GLU C 216 ? 0.9138 1.0032 1.0523 -0.0207 0.0558 0.0101 214 GLU L CG +4826 C CD . GLU C 216 ? 1.0158 1.1058 1.1528 -0.0169 0.0485 0.0053 214 GLU L CD +4827 O OE1 . GLU C 216 ? 1.0546 1.1412 1.1817 -0.0119 0.0507 0.0036 214 GLU L OE1 +4828 O OE2 . GLU C 216 ? 1.0442 1.1375 1.1892 -0.0195 0.0410 0.0030 214 GLU L OE2 +4829 N N . CYS C 217 ? 1.0336 1.1023 1.1767 -0.0335 0.0460 0.0145 215 CYS L N +4830 C CA . CYS C 217 ? 0.9980 1.0663 1.1562 -0.0395 0.0478 0.0158 215 CYS L CA +4831 C C . CYS C 217 ? 0.9893 1.0581 1.1564 -0.0430 0.0423 0.0079 215 CYS L C +4832 O O . CYS C 217 ? 1.0269 1.1006 1.2078 -0.0493 0.0431 0.0059 215 CYS L O +4833 C CB . CYS C 217 ? 1.0227 1.0805 1.1787 -0.0410 0.0506 0.0232 215 CYS L CB +4834 S SG . CYS C 217 ? 1.0938 1.1441 1.2678 -0.0478 0.0526 0.0229 215 CYS L SG +4835 C C1 . NAG D . ? 0.8791 0.8474 1.0074 0.1659 0.1788 -0.1483 601 NAG A C1 +4836 C C2 . NAG D . ? 0.9265 0.9212 1.1046 0.1817 0.1738 -0.1476 601 NAG A C2 +4837 C C3 . NAG D . ? 1.0180 0.9876 1.1963 0.1991 0.1657 -0.1542 601 NAG A C3 +4838 C C4 . NAG D . ? 1.1295 1.0798 1.2753 0.2002 0.1800 -0.1689 601 NAG A C4 +4839 C C5 . NAG D . ? 1.0942 1.0203 1.1932 0.1828 0.1818 -0.1696 601 NAG A C5 +4840 C C6 . NAG D . ? 1.1033 1.0114 1.1662 0.1819 0.1935 -0.1843 601 NAG A C6 +4841 C C7 . NAG D . ? 0.7670 0.8177 1.0146 0.1813 0.1584 -0.1312 601 NAG A C7 +4842 C C8 . NAG D . ? 0.7043 0.7659 0.9681 0.1768 0.1359 -0.1167 601 NAG A C8 +4843 N N2 . NAG D . ? 0.8372 0.8482 1.0430 0.1795 0.1577 -0.1345 601 NAG A N2 +4844 O O3 . NAG D . ? 0.9393 0.9343 1.1605 0.2149 0.1620 -0.1531 601 NAG A O3 +4845 O O4 . NAG D . ? 1.2271 1.1506 1.3718 0.2156 0.1721 -0.1752 601 NAG A O4 +4846 O O5 . NAG D . ? 1.0016 0.9517 1.0993 0.1684 0.1900 -0.1617 601 NAG A O5 +4847 O O6 . NAG D . ? 1.1350 1.0702 1.2070 0.1852 0.2127 -0.1909 601 NAG A O6 +4848 O O7 . NAG D . ? 0.7786 0.8547 1.0430 0.1838 0.1732 -0.1375 601 NAG A O7 +# diff --git a/tests/resources/README.md b/tests/resources/README.md new file mode 100644 index 0000000..01dddab --- /dev/null +++ b/tests/resources/README.md @@ -0,0 +1,27 @@ +# Test Fixtures + +The files in this directory are local fixtures used to keep the test suite +deterministic and offline-friendly. + +## Downloaded mmCIF fixtures + +Most `*.cif` files here are direct RCSB downloads saved with lowercase names, for +example: + +```bash +curl -fL https://files.rcsb.org/download/7BZ5.cif -o tests/resources/7bz5.cif +curl -fL https://files.rcsb.org/download/5JG9.cif -o tests/resources/5jg9.cif +``` + +## Generated Chroma sample + +`steps200_seed42_len100.cif` is a deterministic sample used by +`tests/models/test_chroma.py`. Regenerate it from the `chroma` Conda environment +with the public backbone and design weights available locally or via API access: + +```bash +conda run -n chroma python -c "import torch; from chroma.models.chroma import Chroma; torch.manual_seed(42); chroma = Chroma('https://chroma-weights.generatebiomedicines.com/downloads?weights=chroma_backbone_v1.0.pt', 'https://chroma-weights.generatebiomedicines.com/downloads?weights=chroma_design_v1.0.pt', device='cpu'); protein = chroma.sample(chain_lengths=[100], steps=200); protein.to_CIF('tests/resources/steps200_seed42_len100.cif')" +``` + +If this fixture changes, update the expected ELBO constant in +`tests/models/test_chroma.py` to match the regenerated sample. diff --git a/tests/resources/chroma_trajectory.cif b/tests/resources/chroma_trajectory.cif new file mode 100644 index 0000000..55d2cf6 --- /dev/null +++ b/tests/resources/chroma_trajectory.cif @@ -0,0 +1,114 @@ +data_GNR8 +# +_entry.id system +# +loop_ +_entity.id +_entity.type +_entity.pdbx_description +_entity.pdbx_number_of_molecules +1 polymer 'chain A' 1 +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 ALA n +1 2 CYS n +1 3 ASP n +1 4 GLU n +1 5 PHE n +1 6 GLY n +1 7 HIS n +1 8 ILE n +# +loop_ +_entity_poly.entity_id +_entity_poly.type +1 polypeptide(L) +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_PDB_model_num +_atom_site.auth_seq_id +_atom_site.auth_asym_id +_atom_site.type_symbol +ATOM 1 N . ALA A 1 1 . 0.0368266 -1.40164 -0.00301769 1 0 0 1 A N +ATOM 2 CA . ALA A 1 1 . 2.21793 -3.35389 1.01283 1 0 0 1 A C +ATOM 3 C . ALA A 1 1 . -0.7515 1.55134 0.760284 1 0 0 1 A C +ATOM 4 O . ALA A 1 1 . -0.842956 -1.12829 1.07429 1 0 0 1 A O +ATOM 5 N . CYS A 1 2 . -0.624572 -0.794433 0.145451 1 0 0 2 A N +ATOM 6 CA . CYS A 1 2 . 0.420539 -0.544435 -1.10318 1 0 0 2 A C +ATOM 7 C . CYS A 1 2 . 0.152728 0.285949 0.383029 1 0 0 2 A C +ATOM 8 O . CYS A 1 2 . 1.81273 -0.793462 1.95203 1 0 0 2 A O +ATOM 9 N . ASP A 1 3 . -0.514125 -0.382224 -0.917516 1 0 0 3 A N +ATOM 10 CA . ASP A 1 3 . 0.654973 -1.63837 -0.221337 1 0 0 3 A C +ATOM 11 C . ASP A 1 3 . -0.892567 -0.595605 -0.443462 1 0 0 3 A C +ATOM 12 O . ASP A 1 3 . 1.28307 1.57873 -2.219 1 0 0 3 A O +ATOM 13 N . GLU A 1 4 . -0.931004 -1.79696 -0.193254 1 0 0 4 A N +ATOM 14 CA . GLU A 1 4 . 1.0524 -0.452262 -0.858065 1 0 0 4 A C +ATOM 15 C . GLU A 1 4 . 0.632706 -0.236422 -1.34071 1 0 0 4 A C +ATOM 16 O . GLU A 1 4 . -1.80066 0.525813 0.987336 1 0 0 4 A O +ATOM 17 N . PHE A 1 5 . 1.48716 0.872406 0.111391 1 0 0 5 A N +ATOM 18 CA . PHE A 1 5 . 1.15139 -0.491362 1.18455 1 0 0 5 A C +ATOM 19 C . PHE A 1 5 . -0.305146 1.01256 0.468906 1 0 0 5 A C +ATOM 20 O . PHE A 1 5 . -0.574328 -0.775362 0.122655 1 0 0 5 A O +ATOM 21 N . GLY A 1 6 . 0.845479 -0.0942903 0.739694 1 0 0 6 A N +ATOM 22 CA . GLY A 1 6 . -0.617897 -0.232519 -0.953056 1 0 0 6 A C +ATOM 23 C . GLY A 1 6 . 1.05153 1.9906 0.558171 1 0 0 6 A C +ATOM 24 O . GLY A 1 6 . 0.154393 -0.850268 -0.681111 1 0 0 6 A O +ATOM 25 N . HIS A 1 7 . 2.22192 1.6301 0.139814 1 0 0 7 A N +ATOM 26 CA . HIS A 1 7 . 0.529398 0.250595 0.145039 1 0 0 7 A C +ATOM 27 C . HIS A 1 7 . 0.250074 -1.05516 0.0582739 1 0 0 7 A C +ATOM 28 O . HIS A 1 7 . 1.86966 1.15565 -0.0374324 1 0 0 7 A O +ATOM 29 N . ILE A 1 8 . -1.84956 1.09425 -0.193077 1 0 0 8 A N +ATOM 30 CA . ILE A 1 8 . 0.120166 -0.501098 0.829663 1 0 0 8 A C +ATOM 31 C . ILE A 1 8 . -1.05326 -0.287924 -0.748598 1 0 0 8 A C +ATOM 32 O . ILE A 1 8 . 1.37899 -0.306305 1.04983 1 0 0 8 A O +ATOM 33 N . ALA A 1 1 . 0.136827 -1.30164 0.0969823 1 0 1 1 A N +ATOM 34 CA . ALA A 1 1 . 2.31793 -3.25389 1.11283 1 0 1 1 A C +ATOM 35 C . ALA A 1 1 . -0.6515 1.65134 0.860284 1 0 1 1 A C +ATOM 36 O . ALA A 1 1 . -0.742956 -1.02829 1.17429 1 0 1 1 A O +ATOM 37 N . CYS A 1 2 . -0.524572 -0.694433 0.245451 1 0 1 2 A N +ATOM 38 CA . CYS A 1 2 . 0.520539 -0.444435 -1.00318 1 0 1 2 A C +ATOM 39 C . CYS A 1 2 . 0.252728 0.385949 0.483029 1 0 1 2 A C +ATOM 40 O . CYS A 1 2 . 1.91273 -0.693462 2.05203 1 0 1 2 A O +ATOM 41 N . ASP A 1 3 . -0.414125 -0.282224 -0.817516 1 0 1 3 A N +ATOM 42 CA . ASP A 1 3 . 0.754973 -1.53837 -0.121337 1 0 1 3 A C +ATOM 43 C . ASP A 1 3 . -0.792567 -0.495605 -0.343462 1 0 1 3 A C +ATOM 44 O . ASP A 1 3 . 1.38307 1.67873 -2.119 1 0 1 3 A O +ATOM 45 N . GLU A 1 4 . -0.831004 -1.69696 -0.0932544 1 0 1 4 A N +ATOM 46 CA . GLU A 1 4 . 1.1524 -0.352262 -0.758065 1 0 1 4 A C +ATOM 47 C . GLU A 1 4 . 0.732706 -0.136422 -1.24071 1 0 1 4 A C +ATOM 48 O . GLU A 1 4 . -1.70066 0.625813 1.08734 1 0 1 4 A O +ATOM 49 N . PHE A 1 5 . 1.58716 0.972406 0.211391 1 0 1 5 A N +ATOM 50 CA . PHE A 1 5 . 1.25139 -0.391362 1.28455 1 0 1 5 A C +ATOM 51 C . PHE A 1 5 . -0.205146 1.11256 0.568906 1 0 1 5 A C +ATOM 52 O . PHE A 1 5 . -0.474328 -0.675362 0.222655 1 0 1 5 A O +ATOM 53 N . GLY A 1 6 . 0.945479 0.00570974 0.839694 1 0 1 6 A N +ATOM 54 CA . GLY A 1 6 . -0.517897 -0.132519 -0.853056 1 0 1 6 A C +ATOM 55 C . GLY A 1 6 . 1.15153 2.0906 0.658171 1 0 1 6 A C +ATOM 56 O . GLY A 1 6 . 0.254393 -0.750268 -0.581111 1 0 1 6 A O +ATOM 57 N . HIS A 1 7 . 2.32192 1.7301 0.239814 1 0 1 7 A N +ATOM 58 CA . HIS A 1 7 . 0.629398 0.350595 0.245039 1 0 1 7 A C +ATOM 59 C . HIS A 1 7 . 0.350074 -0.95516 0.158274 1 0 1 7 A C +ATOM 60 O . HIS A 1 7 . 1.96966 1.25565 0.0625676 1 0 1 7 A O +ATOM 61 N . ILE A 1 8 . -1.74956 1.19425 -0.0930771 1 0 1 8 A N +ATOM 62 CA . ILE A 1 8 . 0.220166 -0.401098 0.929663 1 0 1 8 A C +ATOM 63 C . ILE A 1 8 . -0.953259 -0.187924 -0.648598 1 0 1 8 A C +ATOM 64 O . ILE A 1 8 . 1.47899 -0.206305 1.14983 1 0 1 8 A O +# diff --git a/tests/resources/steps200_seed42_len100.cif b/tests/resources/steps200_seed42_len100.cif new file mode 100644 index 0000000..c2bacc4 --- /dev/null +++ b/tests/resources/steps200_seed42_len100.cif @@ -0,0 +1,961 @@ +data_GNR8 +# +_entry.id system +# +loop_ +_entity.id +_entity.type +_entity.pdbx_description +_entity.pdbx_number_of_molecules +1 polymer 'chain A' 1 +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 MET n +1 2 GLU n +1 3 LYS n +1 4 ILE n +1 5 LYS n +1 6 ILE n +1 7 TYR n +1 8 LYS n +1 9 PRO n +1 10 LYS n +1 11 LYS n +1 12 TYR n +1 13 LYS n +1 14 GLU n +1 15 GLY n +1 16 ASN n +1 17 ASP n +1 18 VAL n +1 19 TYR n +1 20 GLU n +1 21 VAL n +1 22 TRP n +1 23 VAL n +1 24 ILE n +1 25 LEU n +1 26 ALA n +1 27 ASP n +1 28 THR n +1 29 GLU n +1 30 GLU n +1 31 ALA n +1 32 ALA n +1 33 LYS n +1 34 LYS n +1 35 ALA n +1 36 ILE n +1 37 GLU n +1 38 GLU n +1 39 LEU n +1 40 LYS n +1 41 LYS n +1 42 GLN n +1 43 PRO n +1 44 GLU n +1 45 PHE n +1 46 LYS n +1 47 ASP n +1 48 TYR n +1 49 LYS n +1 50 PHE n +1 51 THR n +1 52 VAL n +1 53 ILE n +1 54 LYS n +1 55 ARG n +1 56 GLU n +1 57 GLY n +1 58 LYS n +1 59 PRO n +1 60 ILE n +1 61 ILE n +1 62 VAL n +1 63 LEU n +1 64 ALA n +1 65 ALA n +1 66 LYS n +1 67 LYS n +1 68 ASN n +1 69 LYS n +1 70 LYS n +1 71 GLU n +1 72 THR n +1 73 LEU n +1 74 PRO n +1 75 ASP n +1 76 GLY n +1 77 THR n +1 78 VAL n +1 79 VAL n +1 80 THR n +1 81 TYR n +1 82 ASN n +1 83 GLY n +1 84 ASP n +1 85 LYS n +1 86 ALA n +1 87 ILE n +1 88 LYS n +1 89 LYS n +1 90 ALA n +1 91 LEU n +1 92 GLU n +1 93 GLU n +1 94 ILE n +1 95 GLU n +1 96 LYS n +1 97 LYS n +1 98 GLU n +1 99 LYS n +1 100 GLU n +# +loop_ +_entity_poly.entity_id +_entity_poly.type +1 polypeptide(L) +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_PDB_model_num +_atom_site.auth_seq_id +_atom_site.auth_asym_id +_atom_site.type_symbol +ATOM 1 N . MET A 1 1 . -1.16275 5.86282 -15.6465 1 0 0 1 A N +ATOM 2 CA . MET A 1 1 . -2.01747 5.76493 -14.431 1 0 0 1 A C +ATOM 3 C . MET A 1 1 . -1.47514 4.71486 -13.4719 1 0 0 1 A C +ATOM 4 O . MET A 1 1 . -1.09049 3.6213 -13.8961 1 0 0 1 A O +ATOM 5 CB . MET A 1 1 . -3.47194 5.45311 -14.8666 1 0 0 1 A C +ATOM 6 CG . MET A 1 1 . -4.50883 5.32258 -13.7219 1 0 0 1 A C +ATOM 7 SD . MET A 1 1 . -6.18407 5.13128 -14.407 1 0 0 1 A S +ATOM 8 CE . MET A 1 1 . -5.88986 3.68684 -15.4745 1 0 0 1 A C +ATOM 9 N . GLU A 1 2 . -1.44819 5.04976 -12.1924 1 0 0 2 A N +ATOM 10 CA . GLU A 1 2 . -0.966431 4.1304 -11.1659 1 0 0 2 A C +ATOM 11 C . GLU A 1 2 . -1.89995 2.93506 -11.0373 1 0 0 2 A C +ATOM 12 O . GLU A 1 2 . -3.11838 3.09412 -10.931 1 0 0 2 A O +ATOM 13 CB . GLU A 1 2 . -0.822857 4.89278 -9.82405 1 0 0 2 A C +ATOM 14 CG . GLU A 1 2 . 0.268316 6.00722 -9.79281 1 0 0 2 A C +ATOM 15 CD . GLU A 1 2 . -0.181966 7.39112 -10.265 1 0 0 2 A C +ATOM 16 OE1 . GLU A 1 2 . -1.22572 7.3992 -10.9708 1 0 0 2 A O +ATOM 17 OE2 . GLU A 1 2 . 0.483206 8.40441 -9.95957 1 0 0 2 A O +ATOM 18 N . LYS A 1 3 . -1.32328 1.73342 -11.0439 1 0 0 3 A N +ATOM 19 CA . LYS A 1 3 . -2.09765 0.503637 -10.9171 1 0 0 3 A C +ATOM 20 C . LYS A 1 3 . -2.47659 0.255205 -9.46068 1 0 0 3 A C +ATOM 21 O . LYS A 1 3 . -1.61101 0.237177 -8.58197 1 0 0 3 A O +ATOM 22 CB . LYS A 1 3 . -1.28511 -0.691446 -11.5046 1 0 0 3 A C +ATOM 23 CG . LYS A 1 3 . -2.0401 -2.03007 -11.603 1 0 0 3 A C +ATOM 24 CD . LYS A 1 3 . -1.18881 -3.16662 -12.1989 1 0 0 3 A C +ATOM 25 CE . LYS A 1 3 . -2.00384 -4.4391 -12.4385 1 0 0 3 A C +ATOM 26 NZ . LYS A 1 3 . -1.15991 -5.48628 -13.0067 1 0 0 3 A N +ATOM 27 N . ILE A 1 4 . -3.76456 0.0705073 -9.22479 1 0 0 4 A N +ATOM 28 CA . ILE A 1 4 . -4.28571 -0.192689 -7.88587 1 0 0 4 A C +ATOM 29 C . ILE A 1 4 . -4.85798 -1.6024 -7.8164 1 0 0 4 A C +ATOM 30 O . ILE A 1 4 . -5.66028 -1.99862 -8.66162 1 0 0 4 A O +ATOM 31 CB . ILE A 1 4 . -5.32259 0.909666 -7.46802 1 0 0 4 A C +ATOM 32 CG1 . ILE A 1 4 . -4.71197 2.33077 -7.3675 1 0 0 4 A C +ATOM 33 CG2 . ILE A 1 4 . -6.15811 0.544132 -6.21471 1 0 0 4 A C +ATOM 34 CD1 . ILE A 1 4 . -5.72267 3.42252 -6.96982 1 0 0 4 A C +ATOM 35 N . LYS A 1 5 . -4.43753 -2.35276 -6.79354 1 0 0 5 A N +ATOM 36 CA . LYS A 1 5 . -4.94657 -3.69408 -6.54027 1 0 0 5 A C +ATOM 37 C . LYS A 1 5 . -5.71305 -3.70409 -5.22561 1 0 0 5 A C +ATOM 38 O . LYS A 1 5 . -5.22284 -3.21381 -4.20921 1 0 0 5 A O +ATOM 39 CB . LYS A 1 5 . -3.7751 -4.72411 -6.52283 1 0 0 5 A C +ATOM 40 CG . LYS A 1 5 . -3.01955 -4.90098 -7.85304 1 0 0 5 A C +ATOM 41 CD . LYS A 1 5 . -1.98703 -6.04307 -7.81936 1 0 0 5 A C +ATOM 42 CE . LYS A 1 5 . -1.39719 -6.3344 -9.20071 1 0 0 5 A C +ATOM 43 NZ . LYS A 1 5 . -0.549117 -7.52188 -9.1534 1 0 0 5 A N +ATOM 44 N . ILE A 1 6 . -6.91831 -4.27139 -5.25479 1 0 0 6 A N +ATOM 45 CA . ILE A 1 6 . -7.77858 -4.35311 -4.07676 1 0 0 6 A C +ATOM 46 C . ILE A 1 6 . -8.04669 -5.80831 -3.72141 1 0 0 6 A C +ATOM 47 O . ILE A 1 6 . -8.62263 -6.54873 -4.52112 1 0 0 6 A O +ATOM 48 CB . ILE A 1 6 . -9.09404 -3.52453 -4.29566 1 0 0 6 A C +ATOM 49 CG1 . ILE A 1 6 . -8.84146 -2.0232 -4.5867 1 0 0 6 A C +ATOM 50 CG2 . ILE A 1 6 . -10.1596 -3.73272 -3.18944 1 0 0 6 A C +ATOM 51 CD1 . ILE A 1 6 . -10.1096 -1.23328 -4.96009 1 0 0 6 A C +ATOM 52 N . TYR A 1 7 . -7.621 -6.19695 -2.53112 1 0 0 7 A N +ATOM 53 CA . TYR A 1 7 . -7.82268 -7.55663 -2.04014 1 0 0 7 A C +ATOM 54 C . TYR A 1 7 . -9.01176 -7.60693 -1.09334 1 0 0 7 A C +ATOM 55 O . TYR A 1 7 . -9.15203 -6.75839 -0.210705 1 0 0 7 A O +ATOM 56 CB . TYR A 1 7 . -6.50852 -8.06278 -1.36902 1 0 0 7 A C +ATOM 57 CG . TYR A 1 7 . -5.37611 -8.23999 -2.35205 1 0 0 7 A C +ATOM 58 CD1 . TYR A 1 7 . -4.62316 -7.12884 -2.78392 1 0 0 7 A C +ATOM 59 CD2 . TYR A 1 7 . -5.10396 -9.5068 -2.90813 1 0 0 7 A C +ATOM 60 CE1 . TYR A 1 7 . -3.6362 -7.28006 -3.76527 1 0 0 7 A C +ATOM 61 CE2 . TYR A 1 7 . -4.11908 -9.65564 -3.89193 1 0 0 7 A C +ATOM 62 CZ . TYR A 1 7 . -3.38762 -8.54013 -4.32243 1 0 0 7 A C +ATOM 63 OH . TYR A 1 7 . -2.41361 -8.67619 -5.33282 1 0 0 7 A O +ATOM 64 N . LYS A 1 8 . -9.86993 -8.60677 -1.28189 1 0 0 8 A N +ATOM 65 CA . LYS A 1 8 . -11.0465 -8.79119 -0.43697 1 0 0 8 A C +ATOM 66 C . LYS A 1 8 . -10.6345 -9.14228 0.989232 1 0 0 8 A C +ATOM 67 O . LYS A 1 8 . -9.54601 -9.67644 1.20381 1 0 0 8 A O +ATOM 68 CB . LYS A 1 8 . -11.9657 -9.89235 -1.05023 1 0 0 8 A C +ATOM 69 CG . LYS A 1 8 . -12.618 -9.54372 -2.40098 1 0 0 8 A C +ATOM 70 CD . LYS A 1 8 . -13.6915 -10.5576 -2.83817 1 0 0 8 A C +ATOM 71 CE . LYS A 1 8 . -14.3256 -10.1901 -4.18123 1 0 0 8 A C +ATOM 72 NZ . LYS A 1 8 . -15.4272 -11.097 -4.4907 1 0 0 8 A N +ATOM 73 N . PRO A 1 9 . -11.4996 -8.8303 1.97813 1 0 0 9 A N +ATOM 74 CA . PRO A 1 9 . -11.1799 -9.15238 3.37344 1 0 0 9 A C +ATOM 75 C . PRO A 1 9 . -10.884 -10.6335 3.59396 1 0 0 9 A C +ATOM 76 O . PRO A 1 9 . -11.5499 -11.4924 3.00604 1 0 0 9 A O +ATOM 77 CB . PRO A 1 9 . -12.4703 -8.71542 4.09146 1 0 0 9 A C +ATOM 78 CG . PRO A 1 9 . -13.5211 -8.65388 2.98109 1 0 0 9 A C +ATOM 79 CD . PRO A 1 9 . -12.7397 -8.09367 1.79091 1 0 0 9 A C +ATOM 80 N . LYS A 1 10 . -9.89167 -10.9144 4.42177 1 0 0 10 A N +ATOM 81 CA . LYS A 1 10 . -9.50046 -12.2808 4.75286 1 0 0 10 A C +ATOM 82 C . LYS A 1 10 . -9.44491 -12.455 6.26352 1 0 0 10 A C +ATOM 83 O . LYS A 1 10 . -8.96453 -11.5731 6.97742 1 0 0 10 A O +ATOM 84 CB . LYS A 1 10 . -8.12866 -12.6183 4.09116 1 0 0 10 A C +ATOM 85 CG . LYS A 1 10 . -8.08976 -12.5395 2.55368 1 0 0 10 A C +ATOM 86 CD . LYS A 1 10 . -6.72934 -12.9463 1.95759 1 0 0 10 A C +ATOM 87 CE . LYS A 1 10 . -6.77857 -13.0793 0.434173 1 0 0 10 A C +ATOM 88 NZ . LYS A 1 10 . -5.53493 -13.656 -0.0682377 1 0 0 10 A N +ATOM 89 N . LYS A 1 11 . -9.93999 -13.5907 6.73083 1 0 0 11 A N +ATOM 90 CA . LYS A 1 11 . -9.97001 -13.8969 8.15665 1 0 0 11 A C +ATOM 91 C . LYS A 1 11 . -8.85646 -14.8681 8.52772 1 0 0 11 A C +ATOM 92 O . LYS A 1 11 . -8.61605 -15.8523 7.82779 1 0 0 11 A O +ATOM 93 CB . LYS A 1 11 . -11.3713 -14.4666 8.53784 1 0 0 11 A C +ATOM 94 CG . LYS A 1 11 . -12.5598 -13.5071 8.34205 1 0 0 11 A C +ATOM 95 CD . LYS A 1 11 . -13.9061 -14.1065 8.78907 1 0 0 11 A C +ATOM 96 CE . LYS A 1 11 . -15.0378 -13.0772 8.76352 1 0 0 11 A C +ATOM 97 NZ . LYS A 1 11 . -16.2897 -13.6842 9.20617 1 0 0 11 A N +ATOM 98 N . TYR A 1 12 . -8.17594 -14.5752 9.63927 1 0 0 12 A N +ATOM 99 CA . TYR A 1 12 . -7.15992 -15.4583 10.2037 1 0 0 12 A C +ATOM 100 C . TYR A 1 12 . -7.46413 -15.6864 11.6782 1 0 0 12 A C +ATOM 101 O . TYR A 1 12 . -7.79494 -14.7466 12.4025 1 0 0 12 A O +ATOM 102 CB . TYR A 1 12 . -5.7399 -14.8532 9.97789 1 0 0 12 A C +ATOM 103 CG . TYR A 1 12 . -5.4167 -14.6389 8.51854 1 0 0 12 A C +ATOM 104 CD1 . TYR A 1 12 . -5.87882 -13.4897 7.84472 1 0 0 12 A C +ATOM 105 CD2 . TYR A 1 12 . -4.71214 -15.6198 7.79092 1 0 0 12 A C +ATOM 106 CE1 . TYR A 1 12 . -5.65902 -13.3379 6.47045 1 0 0 12 A C +ATOM 107 CE2 . TYR A 1 12 . -4.49627 -15.4681 6.41601 1 0 0 12 A C +ATOM 108 CZ . TYR A 1 12 . -4.97347 -14.3274 5.75573 1 0 0 12 A C +ATOM 109 OH . TYR A 1 12 . -4.78508 -14.1801 4.36616 1 0 0 12 A O +ATOM 110 N . LYS A 1 13 . -7.35048 -16.9401 12.1105 1 0 0 13 A N +ATOM 111 CA . LYS A 1 13 . -7.65993 -17.3197 13.4836 1 0 0 13 A C +ATOM 112 C . LYS A 1 13 . -6.41803 -17.8159 14.2078 1 0 0 13 A C +ATOM 113 O . LYS A 1 13 . -5.6801 -18.6564 13.688 1 0 0 13 A O +ATOM 114 CB . LYS A 1 13 . -8.78595 -18.3993 13.4815 1 0 0 13 A C +ATOM 115 CG . LYS A 1 13 . -9.28275 -18.8509 14.8675 1 0 0 13 A C +ATOM 116 CD . LYS A 1 13 . -10.5252 -19.7584 14.8028 1 0 0 13 A C +ATOM 117 CE . LYS A 1 13 . -11.0012 -20.1923 16.1906 1 0 0 13 A C +ATOM 118 NZ . LYS A 1 13 . -9.95182 -20.9372 16.8802 1 0 0 13 A N +ATOM 119 N . GLU A 1 14 . -6.2055 -17.2871 15.4021 1 0 0 14 A N +ATOM 120 CA . GLU A 1 14 . -5.15657 -17.758 16.3027 1 0 0 14 A C +ATOM 121 C . GLU A 1 14 . -5.77599 -17.9463 17.6781 1 0 0 14 A C +ATOM 122 O . GLU A 1 14 . -6.24891 -16.9841 18.2891 1 0 0 14 A O +ATOM 123 CB . GLU A 1 14 . -3.97319 -16.7576 16.339 1 0 0 14 A C +ATOM 124 CG . GLU A 1 14 . -2.76314 -17.1735 17.2314 1 0 0 14 A C +ATOM 125 CD . GLU A 1 14 . -1.66392 -16.1215 17.3923 1 0 0 14 A C +ATOM 126 OE1 . GLU A 1 14 . -2.02433 -15.0583 17.9644 1 0 0 14 A O +ATOM 127 OE2 . GLU A 1 14 . -0.514534 -16.3443 16.9544 1 0 0 14 A O +ATOM 128 N . GLY A 1 15 . -5.78 -19.1839 18.1593 1 0 0 15 A N +ATOM 129 CA . GLY A 1 15 . -6.4357 -19.5122 19.4158 1 0 0 15 A C +ATOM 130 C . GLY A 1 15 . -7.90134 -19.133 19.3776 1 0 0 15 A C +ATOM 131 O . GLY A 1 15 . -8.62016 -19.5023 18.4488 1 0 0 15 A O +ATOM 132 N . ASN A 1 16 . -8.34497 -18.3875 20.3908 1 0 0 16 A N +ATOM 133 CA . ASN A 1 16 . -9.73001 -17.9228 20.4643 1 0 0 16 A C +ATOM 134 C . ASN A 1 16 . -9.93335 -16.5836 19.7576 1 0 0 16 A C +ATOM 135 O . ASN A 1 16 . -11.0391 -16.0344 19.7679 1 0 0 16 A O +ATOM 136 CB . ASN A 1 16 . -10.1154 -17.8804 21.9753 1 0 0 16 A C +ATOM 137 CG . ASN A 1 16 . -11.6149 -17.7279 22.2386 1 0 0 16 A C +ATOM 138 OD1 . ASN A 1 16 . -12.464 -18.3685 21.6208 1 0 0 16 A O +ATOM 139 ND2 . ASN A 1 16 . -11.9646 -16.8303 23.1844 1 0 0 16 A N +ATOM 140 N . ASP A 1 17 . -8.87495 -16.0705 19.1521 1 0 0 17 A N +ATOM 141 CA . ASP A 1 17 . -8.91903 -14.7759 18.4794 1 0 0 17 A C +ATOM 142 C . ASP A 1 17 . -9.20659 -14.9163 16.9893 1 0 0 17 A C +ATOM 143 O . ASP A 1 17 . -8.81894 -15.9006 16.3586 1 0 0 17 A O +ATOM 144 CB . ASP A 1 17 . -7.58511 -14.0349 18.8036 1 0 0 17 A C +ATOM 145 CG . ASP A 1 17 . -7.40063 -13.7886 20.2922 1 0 0 17 A C +ATOM 146 OD1 . ASP A 1 17 . -6.90079 -14.7133 20.987 1 0 0 17 A O +ATOM 147 OD2 . ASP A 1 17 . -7.9216 -12.7626 20.7803 1 0 0 17 A O +ATOM 148 N . VAL A 1 18 . -9.88755 -13.913 16.4434 1 0 0 18 A N +ATOM 149 CA . VAL A 1 18 . -10.1799 -13.8404 15.0167 1 0 0 18 A C +ATOM 150 C . VAL A 1 18 . -9.78221 -12.4638 14.5004 1 0 0 18 A C +ATOM 151 O . VAL A 1 18 . -10.0601 -11.4505 15.1417 1 0 0 18 A O +ATOM 152 CB . VAL A 1 18 . -11.6945 -14.1391 14.7308 1 0 0 18 A C +ATOM 153 CG1 . VAL A 1 18 . -12.1257 -13.8528 13.2804 1 0 0 18 A C +ATOM 154 CG2 . VAL A 1 18 . -12.0771 -15.5891 15.0812 1 0 0 18 A C +ATOM 155 N . TYR A 1 19 . -9.13186 -12.4342 13.3363 1 0 0 19 A N +ATOM 156 CA . TYR A 1 19 . -8.68818 -11.1874 12.7287 1 0 0 19 A C +ATOM 157 C . TYR A 1 19 . -9.10624 -11.0833 11.2796 1 0 0 19 A C +ATOM 158 O . TYR A 1 19 . -9.04188 -12.0649 10.5374 1 0 0 19 A O +ATOM 159 CB . TYR A 1 19 . -7.14283 -11.0745 12.9096 1 0 0 19 A C +ATOM 160 CG . TYR A 1 19 . -6.66597 -11.603 14.2413 1 0 0 19 A C +ATOM 161 CD1 . TYR A 1 19 . -6.79077 -10.8206 15.4077 1 0 0 19 A C +ATOM 162 CD2 . TYR A 1 19 . -6.02223 -12.8547 14.3245 1 0 0 19 A C +ATOM 163 CE1 . TYR A 1 19 . -6.26375 -11.2724 16.6235 1 0 0 19 A C +ATOM 164 CE2 . TYR A 1 19 . -5.49268 -13.3034 15.5404 1 0 0 19 A C +ATOM 165 CZ . TYR A 1 19 . -5.61118 -12.5092 16.6893 1 0 0 19 A C +ATOM 166 OH . TYR A 1 19 . -5.05599 -12.9408 17.9114 1 0 0 19 A O +ATOM 167 N . GLU A 1 20 . -9.53648 -9.89432 10.8854 1 0 0 20 A N +ATOM 168 CA . GLU A 1 20 . -9.95471 -9.62157 9.51356 1 0 0 20 A C +ATOM 169 C . GLU A 1 20 . -9.1155 -8.48875 8.94197 1 0 0 20 A C +ATOM 170 O . GLU A 1 20 . -8.9165 -7.46166 9.59538 1 0 0 20 A O +ATOM 171 CB . GLU A 1 20 . -11.4677 -9.28655 9.48206 1 0 0 20 A C +ATOM 172 CG . GLU A 1 20 . -12.1469 -9.35691 8.07943 1 0 0 20 A C +ATOM 173 CD . GLU A 1 20 . -13.6717 -9.23063 8.07265 1 0 0 20 A C +ATOM 174 OE1 . GLU A 1 20 . -14.1699 -8.74115 9.12134 1 0 0 20 A O +ATOM 175 OE2 . GLU A 1 20 . -14.3279 -9.61645 7.08117 1 0 0 20 A O +ATOM 176 N . VAL A 1 21 . -8.62647 -8.67917 7.71618 1 0 0 21 A N +ATOM 177 CA . VAL A 1 21 . -7.75629 -7.70825 7.06058 1 0 0 21 A C +ATOM 178 C . VAL A 1 21 . -8.10197 -7.55605 5.58702 1 0 0 21 A C +ATOM 179 O . VAL A 1 21 . -8.29445 -8.55113 4.88298 1 0 0 21 A O +ATOM 180 CB . VAL A 1 21 . -6.25462 -8.12439 7.25222 1 0 0 21 A C +ATOM 181 CG1 . VAL A 1 21 . -5.24834 -7.14405 6.6214 1 0 0 21 A C +ATOM 182 CG2 . VAL A 1 21 . -5.88993 -8.31759 8.73588 1 0 0 21 A C +ATOM 183 N . TRP A 1 22 . -8.17987 -6.31228 5.1418 1 0 0 22 A N +ATOM 184 CA . TRP A 1 22 . -8.27474 -5.98406 3.72386 1 0 0 22 A C +ATOM 185 C . TRP A 1 22 . -6.96969 -5.33239 3.28655 1 0 0 22 A C +ATOM 186 O . TRP A 1 22 . -6.34374 -4.6115 4.06639 1 0 0 22 A O +ATOM 187 CB . TRP A 1 22 . -9.49371 -5.05236 3.44164 1 0 0 22 A C +ATOM 188 CG . TRP A 1 22 . -10.8569 -5.70143 3.6173 1 0 0 22 A C +ATOM 189 CD2 . TRP A 1 22 . -11.4863 -5.91713 4.89436 1 0 0 22 A C +ATOM 190 CD1 . TRP A 1 22 . -11.6561 -6.30301 2.68125 1 0 0 22 A C +ATOM 191 CE2 . TRP A 1 22 . -12.6618 -6.65511 4.64588 1 0 0 22 A C +ATOM 192 NE1 . TRP A 1 22 . -12.7408 -6.8781 3.29646 1 0 0 22 A N +ATOM 193 CE3 . TRP A 1 22 . -11.1301 -5.55377 6.19862 1 0 0 22 A C +ATOM 194 CZ3 . TRP A 1 22 . -11.975 -5.93974 7.24609 1 0 0 22 A C +ATOM 195 CH2 . TRP A 1 22 . -13.1429 -6.67069 6.99763 1 0 0 22 A C +ATOM 196 CZ2 . TRP A 1 22 . -13.4979 -7.03606 5.69361 1 0 0 22 A C +ATOM 197 N . VAL A 1 23 . -6.57009 -5.59237 2.05131 1 0 0 23 A N +ATOM 198 CA . VAL A 1 23 . -5.29233 -5.11638 1.53615 1 0 0 23 A C +ATOM 199 C . VAL A 1 23 . -5.47325 -4.37054 0.222789 1 0 0 23 A C +ATOM 200 O . VAL A 1 23 . -6.13874 -4.85225 -0.692826 1 0 0 23 A O +ATOM 201 CB . VAL A 1 23 . -4.29677 -6.31952 1.37423 1 0 0 23 A C +ATOM 202 CG1 . VAL A 1 23 . -2.86319 -5.89934 1.00019 1 0 0 23 A C +ATOM 203 CG2 . VAL A 1 23 . -4.23845 -7.19949 2.6367 1 0 0 23 A C +ATOM 204 N . ILE A 1 24 . -4.86864 -3.17431 0.144241 1 0 0 24 A N +ATOM 205 CA . ILE A 1 24 . -4.84496 -2.38098 -1.07949 1 0 0 24 A C +ATOM 206 C . ILE A 1 24 . -3.40037 -2.07652 -1.44548 1 0 0 24 A C +ATOM 207 O . ILE A 1 24 . -2.62773 -1.60768 -0.607201 1 0 0 24 A O +ATOM 208 CB . ILE A 1 24 . -5.72529 -1.08882 -0.937241 1 0 0 24 A C +ATOM 209 CG1 . ILE A 1 24 . -5.48035 -0.312264 0.381644 1 0 0 24 A C +ATOM 210 CG2 . ILE A 1 24 . -7.23402 -1.32344 -1.20407 1 0 0 24 A C +ATOM 211 CD1 . ILE A 1 24 . -6.1676 1.06476 0.437222 1 0 0 24 A C +ATOM 212 N . LEU A 1 25 . -3.04439 -2.35036 -2.69399 1 0 0 25 A N +ATOM 213 CA . LEU A 1 25 . -1.69474 -2.10533 -3.19294 1 0 0 25 A C +ATOM 214 C . LEU A 1 25 . -1.71866 -1.01351 -4.25277 1 0 0 25 A C +ATOM 215 O . LEU A 1 25 . -2.49381 -1.08888 -5.20505 1 0 0 25 A O +ATOM 216 CB . LEU A 1 25 . -1.10933 -3.43362 -3.73648 1 0 0 25 A C +ATOM 217 CG . LEU A 1 25 . -1.19004 -4.67926 -2.81759 1 0 0 25 A C +ATOM 218 CD1 . LEU A 1 25 . -0.451109 -5.86943 -3.45718 1 0 0 25 A C +ATOM 219 CD2 . LEU A 1 25 . -0.557738 -4.43557 -1.43469 1 0 0 25 A C +ATOM 220 N . ALA A 1 26 . -0.867132 -0.014628 -4.06936 1 0 0 26 A N +ATOM 221 CA . ALA A 1 26 . -0.766637 1.10755 -4.99849 1 0 0 26 A C +ATOM 222 C . ALA A 1 26 . 0.681846 1.3021 -5.41729 1 0 0 26 A C +ATOM 223 O . ALA A 1 26 . 1.59038 1.23928 -4.58913 1 0 0 26 A O +ATOM 224 CB . ALA A 1 26 . -1.34478 2.40206 -4.37201 1 0 0 26 A C +ATOM 225 N . ASP A 1 27 . 0.893637 1.54718 -6.71368 1 0 0 27 A N +ATOM 226 CA . ASP A 1 27 . 2.23861 1.73315 -7.25742 1 0 0 27 A C +ATOM 227 C . ASP A 1 27 . 2.81503 3.09561 -6.88749 1 0 0 27 A C +ATOM 228 O . ASP A 1 27 . 4.03104 3.24691 -6.76304 1 0 0 27 A O +ATOM 229 CB . ASP A 1 27 . 2.1666 1.46759 -8.79296 1 0 0 27 A C +ATOM 230 CG . ASP A 1 27 . 2.08782 -0.0132474 -9.12659 1 0 0 27 A C +ATOM 231 OD1 . ASP A 1 27 . 2.43575 -0.838432 -8.24025 1 0 0 27 A O +ATOM 232 OD2 . ASP A 1 27 . 1.86291 -0.33002 -10.3147 1 0 0 27 A O +ATOM 233 N . THR A 1 28 . 1.93633 4.08085 -6.71487 1 0 0 28 A N +ATOM 234 CA . THR A 1 28 . 2.3433 5.44037 -6.37563 1 0 0 28 A C +ATOM 235 C . THR A 1 28 . 1.57846 5.939 -5.16166 1 0 0 28 A C +ATOM 236 O . THR A 1 28 . 0.554936 5.37226 -4.78273 1 0 0 28 A O +ATOM 237 CB . THR A 1 28 . 2.23648 6.41435 -7.60235 1 0 0 28 A C +ATOM 238 OG1 . THR A 1 28 . 0.880522 6.63528 -7.99919 1 0 0 28 A O +ATOM 239 CG2 . THR A 1 28 . 3.02343 6.00728 -8.84971 1 0 0 28 A C +ATOM 240 N . GLU A 1 29 . 2.0907 7.01193 -4.54881 1 0 0 29 A N +ATOM 241 CA . GLU A 1 29 . 1.45418 7.60947 -3.37721 1 0 0 29 A C +ATOM 242 C . GLU A 1 29 . 0.0481812 8.11002 -3.69667 1 0 0 29 A C +ATOM 243 O . GLU A 1 29 . -0.878548 7.93027 -2.90704 1 0 0 29 A O +ATOM 244 CB . GLU A 1 29 . 2.36124 8.74837 -2.84555 1 0 0 29 A C +ATOM 245 CG . GLU A 1 29 . 1.94266 9.36165 -1.47359 1 0 0 29 A C +ATOM 246 CD . GLU A 1 29 . 2.84229 10.4801 -0.943814 1 0 0 29 A C +ATOM 247 OE1 . GLU A 1 29 . 3.77127 10.8288 -1.72033 1 0 0 29 A O +ATOM 248 OE2 . GLU A 1 29 . 2.63757 10.9647 0.190084 1 0 0 29 A O +ATOM 249 N . GLU A 1 30 . -0.110559 8.73554 -4.86363 1 0 0 30 A N +ATOM 250 CA . GLU A 1 30 . -1.40867 9.24484 -5.29771 1 0 0 30 A C +ATOM 251 C . GLU A 1 30 . -2.42601 8.11427 -5.43227 1 0 0 30 A C +ATOM 252 O . GLU A 1 30 . -3.56881 8.24933 -4.99879 1 0 0 30 A O +ATOM 253 CB . GLU A 1 30 . -1.22722 10.0146 -6.6308 1 0 0 30 A C +ATOM 254 CG . GLU A 1 30 . -0.304595 11.2708 -6.56616 1 0 0 30 A C +ATOM 255 CD . GLU A 1 30 . 1.19862 10.9954 -6.63966 1 0 0 30 A C +ATOM 256 OE1 . GLU A 1 30 . 1.51725 9.77637 -6.63584 1 0 0 30 A O +ATOM 257 OE2 . GLU A 1 30 . 2.00856 11.9466 -6.68064 1 0 0 30 A O +ATOM 258 N . ALA A 1 31 . -1.99813 7.00917 -6.03497 1 0 0 31 A N +ATOM 259 CA . ALA A 1 31 . -2.86534 5.84593 -6.20333 1 0 0 31 A C +ATOM 260 C . ALA A 1 31 . -3.25222 5.24929 -4.85786 1 0 0 31 A C +ATOM 261 O . ALA A 1 31 . -4.40572 4.88152 -4.64121 1 0 0 31 A O +ATOM 262 CB . ALA A 1 31 . -2.17804 4.78915 -7.10518 1 0 0 31 A C +ATOM 263 N . ALA A 1 32 . -2.27767 5.15069 -3.95064 1 0 0 32 A N +ATOM 264 CA . ALA A 1 32 . -2.521 4.61669 -2.61538 1 0 0 32 A C +ATOM 265 C . ALA A 1 32 . -3.52546 5.47669 -1.85717 1 0 0 32 A C +ATOM 266 O . ALA A 1 32 . -4.45772 4.95373 -1.24205 1 0 0 32 A O +ATOM 267 CB . ALA A 1 32 . -1.18898 4.4936 -1.8324 1 0 0 32 A C +ATOM 268 N . LYS A 1 33 . -3.33479 6.79031 -1.9011 1 0 0 33 A N +ATOM 269 CA . LYS A 1 33 . -4.23704 7.72443 -1.23022 1 0 0 33 A C +ATOM 270 C . LYS A 1 33 . -5.66208 7.59249 -1.75586 1 0 0 33 A C +ATOM 271 O . LYS A 1 33 . -6.61683 7.56116 -0.977423 1 0 0 33 A O +ATOM 272 CB . LYS A 1 33 . -3.69857 9.17786 -1.40682 1 0 0 33 A C +ATOM 273 CG . LYS A 1 33 . -2.44164 9.52985 -0.589616 1 0 0 33 A C +ATOM 274 CD . LYS A 1 33 . -2.01854 11.0041 -0.728391 1 0 0 33 A C +ATOM 275 CE . LYS A 1 33 . -0.86109 11.3669 0.204112 1 0 0 33 A C +ATOM 276 NZ . LYS A 1 33 . -0.499449 12.7725 0.0456637 1 0 0 33 A N +ATOM 277 N . LYS A 1 34 . -5.80108 7.51396 -3.07587 1 0 0 34 A N +ATOM 278 CA . LYS A 1 34 . -7.11228 7.36797 -3.70558 1 0 0 34 A C +ATOM 279 C . LYS A 1 34 . -7.79243 6.07055 -3.28198 1 0 0 34 A C +ATOM 280 O . LYS A 1 34 . -8.98524 6.05708 -2.97255 1 0 0 34 A O +ATOM 281 CB . LYS A 1 34 . -6.9493 7.44442 -5.25516 1 0 0 34 A C +ATOM 282 CG . LYS A 1 34 . -8.25368 7.36571 -6.07002 1 0 0 34 A C +ATOM 283 CD . LYS A 1 34 . -8.05842 7.68552 -7.56374 1 0 0 34 A C +ATOM 284 CE . LYS A 1 34 . -9.37012 7.61975 -8.3486 1 0 0 34 A C +ATOM 285 NZ . LYS A 1 34 . -9.15889 8.0376 -9.73149 1 0 0 34 A N +ATOM 286 N . ALA A 1 35 . -7.03226 4.97581 -3.26065 1 0 0 35 A N +ATOM 287 CA . ALA A 1 35 . -7.5579 3.67811 -2.84407 1 0 0 35 A C +ATOM 288 C . ALA A 1 35 . -7.99576 3.70919 -1.3847 1 0 0 35 A C +ATOM 289 O . ALA A 1 35 . -9.06335 3.20428 -1.04247 1 0 0 35 A O +ATOM 290 CB . ALA A 1 35 . -6.50586 2.56608 -3.08716 1 0 0 35 A C +ATOM 291 N . ILE A 1 36 . -7.16559 4.31175 -0.540335 1 0 0 36 A N +ATOM 292 CA . ILE A 1 36 . -7.47822 4.42722 0.881658 1 0 0 36 A C +ATOM 293 C . ILE A 1 36 . -8.76611 5.21637 1.10121 1 0 0 36 A C +ATOM 294 O . ILE A 1 36 . -9.61026 4.82634 1.90716 1 0 0 36 A O +ATOM 295 CB . ILE A 1 36 . -6.25175 5.0309 1.65383 1 0 0 36 A C +ATOM 296 CG1 . ILE A 1 36 . -5.02077 4.09002 1.69742 1 0 0 36 A C +ATOM 297 CG2 . ILE A 1 36 . -6.60547 5.59345 3.05416 1 0 0 36 A C +ATOM 298 CD1 . ILE A 1 36 . -3.80506 4.67929 2.43661 1 0 0 36 A C +ATOM 299 N . GLU A 1 37 . -8.90982 6.33087 0.378934 1 0 0 37 A N +ATOM 300 CA . GLU A 1 37 . -10.1016 7.1657 0.482523 1 0 0 37 A C +ATOM 301 C . GLU A 1 37 . -11.3522 6.40602 0.0617892 1 0 0 37 A C +ATOM 302 O . GLU A 1 37 . -12.3988 6.51223 0.707727 1 0 0 37 A O +ATOM 303 CB . GLU A 1 37 . -9.89172 8.4422 -0.371296 1 0 0 37 A C +ATOM 304 CG . GLU A 1 37 . -8.79931 9.42901 0.144877 1 0 0 37 A C +ATOM 305 CD . GLU A 1 37 . -8.5044 10.6263 -0.760849 1 0 0 37 A C +ATOM 306 OE1 . GLU A 1 37 . -9.06688 10.5926 -1.88783 1 0 0 37 A O +ATOM 307 OE2 . GLU A 1 37 . -7.74039 11.5349 -0.369334 1 0 0 37 A O +ATOM 308 N . GLU A 1 38 . -11.2437 5.63992 -1.018 1 0 0 38 A N +ATOM 309 CA . GLU A 1 38 . -12.3604 4.8299 -1.50212 1 0 0 38 A C +ATOM 310 C . GLU A 1 38 . -12.7647 3.78017 -0.474087 1 0 0 38 A C +ATOM 311 O . GLU A 1 38 . -13.9501 3.56922 -0.219945 1 0 0 38 A O +ATOM 312 CB . GLU A 1 38 . -11.9645 4.185 -2.85484 1 0 0 38 A C +ATOM 313 CG . GLU A 1 38 . -11.7749 5.17443 -4.04592 1 0 0 38 A C +ATOM 314 CD . GLU A 1 38 . -11.1792 4.57316 -5.3205 1 0 0 38 A C +ATOM 315 OE1 . GLU A 1 38 . -10.8945 3.34786 -5.24841 1 0 0 38 A O +ATOM 316 OE2 . GLU A 1 38 . -10.993 5.29317 -6.32519 1 0 0 38 A O +ATOM 317 N . LEU A 1 39 . -11.7667 3.12032 0.125243 1 0 0 39 A N +ATOM 318 CA . LEU A 1 39 . -12.0145 2.12535 1.16445 1 0 0 39 A C +ATOM 319 C . LEU A 1 39 . -12.6816 2.76073 2.37981 1 0 0 39 A C +ATOM 320 O . LEU A 1 39 . -13.6467 2.21809 2.91871 1 0 0 39 A O +ATOM 321 CB . LEU A 1 39 . -10.6692 1.44555 1.52595 1 0 0 39 A C +ATOM 322 CG . LEU A 1 39 . -10.119 0.381593 0.542215 1 0 0 39 A C +ATOM 323 CD1 . LEU A 1 39 . -8.80355 -0.215982 1.0753 1 0 0 39 A C +ATOM 324 CD2 . LEU A 1 39 . -11.0993 -0.78612 0.325499 1 0 0 39 A C +ATOM 325 N . LYS A 1 40 . -12.163 3.90681 2.80157 1 0 0 40 A N +ATOM 326 CA . LYS A 1 40 . -12.7168 4.63259 3.94463 1 0 0 40 A C +ATOM 327 C . LYS A 1 40 . -14.178 5.01301 3.7129 1 0 0 40 A C +ATOM 328 O . LYS A 1 40 . -14.9981 4.94615 4.63059 1 0 0 40 A O +ATOM 329 CB . LYS A 1 40 . -11.8396 5.8916 4.22564 1 0 0 40 A C +ATOM 330 CG . LYS A 1 40 . -10.5081 5.6306 4.95413 1 0 0 40 A C +ATOM 331 CD . LYS A 1 40 . -9.72155 6.91773 5.26429 1 0 0 40 A C +ATOM 332 CE . LYS A 1 40 . -8.43759 6.63962 6.0485 1 0 0 40 A C +ATOM 333 NZ . LYS A 1 40 . -7.64707 7.85973 6.18259 1 0 0 40 A N +ATOM 334 N . LYS A 1 41 . -14.5037 5.4088 2.4815 1 0 0 41 A N +ATOM 335 CA . LYS A 1 41 . -15.8628 5.80918 2.12988 1 0 0 41 A C +ATOM 336 C . LYS A 1 41 . -16.8172 4.62186 2.0327 1 0 0 41 A C +ATOM 337 O . LYS A 1 41 . -18.0348 4.80946 2.004 1 0 0 41 A O +ATOM 338 CB . LYS A 1 41 . -15.8147 6.61048 0.79227 1 0 0 41 A C +ATOM 339 CG . LYS A 1 41 . -14.9944 7.9135 0.821768 1 0 0 41 A C +ATOM 340 CD . LYS A 1 41 . -14.8121 8.54951 -0.568853 1 0 0 41 A C +ATOM 341 CE . LYS A 1 41 . -13.927 9.79677 -0.52608 1 0 0 41 A C +ATOM 342 NZ . LYS A 1 41 . -13.6939 10.3037 -1.87527 1 0 0 41 A N +ATOM 343 N . GLN A 1 42 . -16.2688 3.41642 1.97387 1 0 0 42 A N +ATOM 344 CA . GLN A 1 42 . -17.0802 2.20501 1.88729 1 0 0 42 A C +ATOM 345 C . GLN A 1 42 . -17.5744 1.79007 3.26459 1 0 0 42 A C +ATOM 346 O . GLN A 1 42 . -16.8118 1.80322 4.23531 1 0 0 42 A O +ATOM 347 CB . GLN A 1 42 . -16.2502 1.08211 1.21448 1 0 0 42 A C +ATOM 348 CG . GLN A 1 42 . -15.9658 1.27609 -0.296796 1 0 0 42 A C +ATOM 349 CD . GLN A 1 42 . -15.2118 0.0929937 -0.907245 1 0 0 42 A C +ATOM 350 OE1 . GLN A 1 42 . -15.2833 -1.03479 -0.421564 1 0 0 42 A O +ATOM 351 NE2 . GLN A 1 42 . -14.4723 0.344216 -2.00839 1 0 0 42 A N +ATOM 352 N . PRO A 1 43 . -18.8465 1.41989 3.34337 1 0 0 43 A N +ATOM 353 CA . PRO A 1 43 . -19.4595 1.00866 4.60607 1 0 0 43 A C +ATOM 354 C . PRO A 1 43 . -18.7192 -0.161412 5.25171 1 0 0 43 A C +ATOM 355 O . PRO A 1 43 . -18.7096 -0.29842 6.47777 1 0 0 43 A O +ATOM 356 CB . PRO A 1 43 . -20.8769 0.60846 4.15628 1 0 0 43 A C +ATOM 357 CG . PRO A 1 43 . -21.1238 1.43778 2.89445 1 0 0 43 A C +ATOM 358 CD . PRO A 1 43 . -19.7448 1.48774 2.23357 1 0 0 43 A C +ATOM 359 N . GLU A 1 44 . -18.1059 -1.00672 4.42563 1 0 0 44 A N +ATOM 360 CA . GLU A 1 44 . -17.3563 -2.16374 4.91345 1 0 0 44 A C +ATOM 361 C . GLU A 1 44 . -16.1194 -1.76237 5.71851 1 0 0 44 A C +ATOM 362 O . GLU A 1 44 . -15.5792 -2.57245 6.47162 1 0 0 44 A O +ATOM 363 CB . GLU A 1 44 . -16.9856 -3.04841 3.69587 1 0 0 44 A C +ATOM 364 CG . GLU A 1 44 . -18.1858 -3.7081 2.94893 1 0 0 44 A C +ATOM 365 CD . GLU A 1 44 . -18.9199 -2.81176 1.94965 1 0 0 44 A C +ATOM 366 OE1 . GLU A 1 44 . -18.4607 -1.64305 1.84559 1 0 0 44 A O +ATOM 367 OE2 . GLU A 1 44 . -19.9077 -3.25099 1.32211 1 0 0 44 A O +ATOM 368 N . PHE A 1 45 . -15.6804 -0.518252 5.55466 1 0 0 45 A N +ATOM 369 CA . PHE A 1 45 . -14.4957 -0.0127379 6.2484 1 0 0 45 A C +ATOM 370 C . PHE A 1 45 . -14.8327 0.737372 7.53397 1 0 0 45 A C +ATOM 371 O . PHE A 1 45 . -13.9384 1.27877 8.18907 1 0 0 45 A O +ATOM 372 CB . PHE A 1 45 . -13.687 0.863119 5.24219 1 0 0 45 A C +ATOM 373 CG . PHE A 1 45 . -12.7122 0.0565995 4.41789 1 0 0 45 A C +ATOM 374 CD1 . PHE A 1 45 . -13.1442 -1.09694 3.73174 1 0 0 45 A C +ATOM 375 CD2 . PHE A 1 45 . -11.3505 0.416742 4.35485 1 0 0 45 A C +ATOM 376 CE1 . PHE A 1 45 . -12.2353 -1.88016 3.0104 1 0 0 45 A C +ATOM 377 CE2 . PHE A 1 45 . -10.4383 -0.366146 3.63717 1 0 0 45 A C +ATOM 378 CZ . PHE A 1 45 . -10.8837 -1.51788 2.96443 1 0 0 45 A C +ATOM 379 N . LYS A 1 46 . -16.1089 0.765209 7.90353 1 0 0 46 A N +ATOM 380 CA . LYS A 1 46 . -16.5393 1.43713 9.12771 1 0 0 46 A C +ATOM 381 C . LYS A 1 46 . -15.8469 0.843409 10.3495 1 0 0 46 A C +ATOM 382 O . LYS A 1 46 . -15.8182 -0.377939 10.5205 1 0 0 46 A O +ATOM 383 CB . LYS A 1 46 . -18.0915 1.34427 9.25321 1 0 0 46 A C +ATOM 384 CG . LYS A 1 46 . -18.6864 1.84227 10.5835 1 0 0 46 A C +ATOM 385 CD . LYS A 1 46 . -20.2001 1.58721 10.7067 1 0 0 46 A C +ATOM 386 CE . LYS A 1 46 . -20.738 1.94 12.0949 1 0 0 46 A C +ATOM 387 NZ . LYS A 1 46 . -22.1679 1.65609 12.1754 1 0 0 46 A N +ATOM 388 N . ASP A 1 47 . -15.2916 1.71181 11.1793 1 0 0 47 A N +ATOM 389 CA . ASP A 1 47 . -14.6159 1.29128 12.399 1 0 0 47 A C +ATOM 390 C . ASP A 1 47 . -13.3007 0.568997 12.165 1 0 0 47 A C +ATOM 391 O . ASP A 1 47 . -12.8273 -0.164357 13.0334 1 0 0 47 A O +ATOM 392 CB . ASP A 1 47 . -15.6609 0.464828 13.2105 1 0 0 47 A C +ATOM 393 CG . ASP A 1 47 . -16.8415 1.30531 13.6691 1 0 0 47 A C +ATOM 394 OD1 . ASP A 1 47 . -16.6118 2.4758 14.075 1 0 0 47 A O +ATOM 395 OD2 . ASP A 1 47 . -17.9464 0.734792 13.7963 1 0 0 47 A O +ATOM 396 N . TYR A 1 48 . -12.7004 0.786928 10.9917 1 0 0 48 A N +ATOM 397 CA . TYR A 1 48 . -11.4467 0.126813 10.6216 1 0 0 48 A C +ATOM 398 C . TYR A 1 48 . -10.2421 1.02276 10.8659 1 0 0 48 A C +ATOM 399 O . TYR A 1 48 . -10.3461 2.25361 10.788 1 0 0 48 A O +ATOM 400 CB . TYR A 1 48 . -11.5508 -0.33451 9.13499 1 0 0 48 A C +ATOM 401 CG . TYR A 1 48 . -12.0294 -1.75959 8.99313 1 0 0 48 A C +ATOM 402 CD1 . TYR A 1 48 . -13.2386 -2.17099 9.5905 1 0 0 48 A C +ATOM 403 CD2 . TYR A 1 48 . -11.238 -2.71626 8.32488 1 0 0 48 A C +ATOM 404 CE1 . TYR A 1 48 . -13.634 -3.51295 9.5381 1 0 0 48 A C +ATOM 405 CE2 . TYR A 1 48 . -11.6332 -4.05846 8.27644 1 0 0 48 A C +ATOM 406 CZ . TYR A 1 48 . -12.8306 -4.45652 8.88677 1 0 0 48 A C +ATOM 407 OH . TYR A 1 48 . -13.2219 -5.81099 8.86702 1 0 0 48 A O +ATOM 408 N . LYS A 1 49 . -9.11736 0.400895 11.1639 1 0 0 49 A N +ATOM 409 CA . LYS A 1 49 . -7.83733 1.09234 11.2737 1 0 0 49 A C +ATOM 410 C . LYS A 1 49 . -7.05693 0.891445 9.98147 1 0 0 49 A C +ATOM 411 O . LYS A 1 49 . -6.98858 -0.221738 9.46182 1 0 0 49 A O +ATOM 412 CB . LYS A 1 49 . -7.0364 0.573293 12.5077 1 0 0 49 A C +ATOM 413 CG . LYS A 1 49 . -5.60439 1.12045 12.6545 1 0 0 49 A C +ATOM 414 CD . LYS A 1 49 . -4.81071 0.451145 13.7919 1 0 0 49 A C +ATOM 415 CE . LYS A 1 49 . -3.36456 0.945916 13.861 1 0 0 49 A C +ATOM 416 NZ . LYS A 1 49 . -2.5967 0.146966 14.8116 1 0 0 49 A N +ATOM 417 N . PHE A 1 50 . -6.4869 1.97677 9.4726 1 0 0 50 A N +ATOM 418 CA . PHE A 1 50 . -5.74643 1.94743 8.21516 1 0 0 50 A C +ATOM 419 C . PHE A 1 50 . -4.26038 2.17539 8.45725 1 0 0 50 A C +ATOM 420 O . PHE A 1 50 . -3.86736 3.1492 9.10255 1 0 0 50 A O +ATOM 421 CB . PHE A 1 50 . -6.3582 2.99618 7.23564 1 0 0 50 A C +ATOM 422 CG . PHE A 1 50 . -7.73531 2.60971 6.75157 1 0 0 50 A C +ATOM 423 CD1 . PHE A 1 50 . -8.86043 2.80041 7.57972 1 0 0 50 A C +ATOM 424 CD2 . PHE A 1 50 . -7.91413 2.01465 5.48586 1 0 0 50 A C +ATOM 425 CE1 . PHE A 1 50 . -10.1326 2.39421 7.15939 1 0 0 50 A C +ATOM 426 CE2 . PHE A 1 50 . -9.18438 1.60428 5.06388 1 0 0 50 A C +ATOM 427 CZ . PHE A 1 50 . -10.2953 1.7947 5.90476 1 0 0 50 A C +ATOM 428 N . THR A 1 51 . -3.43395 1.26376 7.92877 1 0 0 51 A N +ATOM 429 CA . THR A 1 51 . -1.98004 1.35336 8.04176 1 0 0 51 A C +ATOM 430 C . THR A 1 51 . -1.35381 1.32639 6.65775 1 0 0 51 A C +ATOM 431 O . THR A 1 51 . -1.7214 0.491305 5.82967 1 0 0 51 A O +ATOM 432 CB . THR A 1 51 . -1.38035 0.264335 9.00055 1 0 0 51 A C +ATOM 433 OG1 . THR A 1 51 . -1.99597 0.283937 10.2911 1 0 0 51 A O +ATOM 434 CG2 . THR A 1 51 . 0.134376 0.318438 9.20932 1 0 0 51 A C +ATOM 435 N . VAL A 1 52 . -0.430899 2.23592 6.42403 1 0 0 52 A N +ATOM 436 CA . VAL A 1 52 . 0.251793 2.34021 5.13475 1 0 0 52 A C +ATOM 437 C . VAL A 1 52 . 1.73007 2.01676 5.29198 1 0 0 52 A C +ATOM 438 O . VAL A 1 52 . 2.41039 2.57214 6.1567 1 0 0 52 A O +ATOM 439 CB . VAL A 1 52 . 0.044935 3.76909 4.51799 1 0 0 52 A C +ATOM 440 CG1 . VAL A 1 52 . 0.583204 3.91483 3.0825 1 0 0 52 A C +ATOM 441 CG2 . VAL A 1 52 . -1.43303 4.20141 4.53597 1 0 0 52 A C +ATOM 442 N . ILE A 1 53 . 2.21933 1.10965 4.44285 1 0 0 53 A N +ATOM 443 CA . ILE A 1 53 . 3.62645 0.72147 4.43567 1 0 0 53 A C +ATOM 444 C . ILE A 1 53 . 4.22494 0.986205 3.06162 1 0 0 53 A C +ATOM 445 O . ILE A 1 53 . 3.61821 0.677231 2.03676 1 0 0 53 A O +ATOM 446 CB . ILE A 1 53 . 3.79799 -0.768172 4.9009 1 0 0 53 A C +ATOM 447 CG1 . ILE A 1 53 . 3.21154 -1.05122 6.30748 1 0 0 53 A C +ATOM 448 CG2 . ILE A 1 53 . 5.242 -1.31126 4.75122 1 0 0 53 A C +ATOM 449 CD1 . ILE A 1 53 . 3.2288 -2.53808 6.70815 1 0 0 53 A C +ATOM 450 N . LYS A 1 54 . 5.43215 1.56742 3.04967 1 0 0 54 A N +ATOM 451 CA . LYS A 1 54 . 6.15075 1.86845 1.81574 1 0 0 54 A C +ATOM 452 C . LYS A 1 54 . 7.56638 1.31023 1.88525 1 0 0 54 A C +ATOM 453 O . LYS A 1 54 . 8.28531 1.54505 2.85821 1 0 0 54 A O +ATOM 454 CB . LYS A 1 54 . 6.1588 3.40835 1.56627 1 0 0 54 A C +ATOM 455 CG . LYS A 1 54 . 7.05325 3.89449 0.410748 1 0 0 54 A C +ATOM 456 CD . LYS A 1 54 . 6.84256 5.37944 0.0612388 1 0 0 54 A C +ATOM 457 CE . LYS A 1 54 . 7.8167 5.86772 -1.01279 1 0 0 54 A C +ATOM 458 NZ . LYS A 1 54 . 7.78329 4.98185 -2.17284 1 0 0 54 A N +ATOM 459 N . ARG A 1 55 . 7.94611 0.57516 0.851828 1 0 0 55 A N +ATOM 460 CA . ARG A 1 55 . 9.27452 -0.0237285 0.760014 1 0 0 55 A C +ATOM 461 C . ARG A 1 55 . 9.91216 0.345325 -0.575756 1 0 0 55 A C +ATOM 462 O . ARG A 1 55 . 9.21958 0.417003 -1.59313 1 0 0 55 A O +ATOM 463 CB . ARG A 1 55 . 9.20303 -1.56729 0.974294 1 0 0 55 A C +ATOM 464 CG . ARG A 1 55 . 8.71125 -2.03662 2.36727 1 0 0 55 A C +ATOM 465 CD . ARG A 1 55 . 8.46346 -3.55334 2.46602 1 0 0 55 A C +ATOM 466 NE . ARG A 1 55 . 8.10257 -3.84914 3.89159 1 0 0 55 A N +ATOM 467 CZ . ARG A 1 55 . 7.76896 -5.07348 4.32204 1 0 0 55 A C +ATOM 468 NH1 . ARG A 1 55 . 7.75997 -6.06672 3.43757 1 0 0 55 A N +ATOM 469 NH2 . ARG A 1 55 . 7.4777 -5.32061 5.59601 1 0 0 55 A N +ATOM 470 N . GLU A 1 56 . 11.237 0.593029 -0.583865 1 0 0 56 A N +ATOM 471 CA . GLU A 1 56 . 11.9157 0.917164 -1.84112 1 0 0 56 A C +ATOM 472 C . GLU A 1 56 . 11.8184 -0.20904 -2.86402 1 0 0 56 A C +ATOM 473 O . GLU A 1 56 . 12.08 -1.3704 -2.53342 1 0 0 56 A O +ATOM 474 CB . GLU A 1 56 . 13.3894 1.27215 -1.51752 1 0 0 56 A C +ATOM 475 CG . GLU A 1 56 . 13.6248 2.68587 -0.901434 1 0 0 56 A C +ATOM 476 CD . GLU A 1 56 . 15.0846 3.06081 -0.637828 1 0 0 56 A C +ATOM 477 OE1 . GLU A 1 56 . 15.9158 2.13427 -0.833272 1 0 0 56 A O +ATOM 478 OE2 . GLU A 1 56 . 15.3744 4.21043 -0.241766 1 0 0 56 A O +ATOM 479 N . GLY A 1 57 . 11.4309 0.131721 -4.08384 1 0 0 57 A N +ATOM 480 CA . GLY A 1 57 . 11.3133 -0.838477 -5.16495 1 0 0 57 A C +ATOM 481 C . GLY A 1 57 . 10.0463 -1.67591 -5.1261 1 0 0 57 A C +ATOM 482 O . GLY A 1 57 . 9.85559 -2.54938 -5.97095 1 0 0 57 A O +ATOM 483 N . LYS A 1 58 . 9.18235 -1.40981 -4.14535 1 0 0 58 A N +ATOM 484 CA . LYS A 1 58 . 7.93591 -2.15497 -3.97496 1 0 0 58 A C +ATOM 485 C . LYS A 1 58 . 6.74602 -1.2003 -3.93975 1 0 0 58 A C +ATOM 486 O . LYS A 1 58 . 6.91621 -0.0129554 -3.65437 1 0 0 58 A O +ATOM 487 CB . LYS A 1 58 . 8.00998 -3.01867 -2.67799 1 0 0 58 A C +ATOM 488 CG . LYS A 1 58 . 9.07822 -4.12792 -2.67267 1 0 0 58 A C +ATOM 489 CD . LYS A 1 58 . 8.98729 -5.05461 -1.44606 1 0 0 58 A C +ATOM 490 CE . LYS A 1 58 . 9.92604 -6.25778 -1.55562 1 0 0 58 A C +ATOM 491 NZ . LYS A 1 58 . 9.7006 -7.1834 -0.449266 1 0 0 58 A N +ATOM 492 N . PRO A 1 59 . 5.53751 -1.70964 -4.23267 1 0 0 59 A N +ATOM 493 CA . PRO A 1 59 . 4.35647 -0.849837 -4.13675 1 0 0 59 A C +ATOM 494 C . PRO A 1 59 . 4.02541 -0.48779 -2.69482 1 0 0 59 A C +ATOM 495 O . PRO A 1 59 . 4.47888 -1.15951 -1.76928 1 0 0 59 A O +ATOM 496 CB . PRO A 1 59 . 3.26581 -1.73555 -4.76729 1 0 0 59 A C +ATOM 497 CG . PRO A 1 59 . 3.7839 -3.1637 -4.58599 1 0 0 59 A C +ATOM 498 CD . PRO A 1 59 . 5.28454 -3.02759 -4.85145 1 0 0 59 A C +ATOM 499 N . ILE A 1 60 . 3.2386 0.570258 -2.51171 1 0 0 60 A N +ATOM 500 CA . ILE A 1 60 . 2.72886 0.927842 -1.19147 1 0 0 60 A C +ATOM 501 C . ILE A 1 60 . 1.59294 -0.0180402 -0.821434 1 0 0 60 A C +ATOM 502 O . ILE A 1 60 . 0.746791 -0.338041 -1.6584 1 0 0 60 A O +ATOM 503 CB . ILE A 1 60 . 2.30881 2.43957 -1.13549 1 0 0 60 A C +ATOM 504 CG1 . ILE A 1 60 . 3.50798 3.42007 -1.19141 1 0 0 60 A C +ATOM 505 CG2 . ILE A 1 60 . 1.33207 2.77836 0.0193653 1 0 0 60 A C +ATOM 506 CD1 . ILE A 1 60 . 3.10435 4.8991 -1.33685 1 0 0 60 A C +ATOM 507 N . ILE A 1 61 . 1.58457 -0.459799 0.433461 1 0 0 61 A N +ATOM 508 CA . ILE A 1 61 . 0.577803 -1.39685 0.927063 1 0 0 61 A C +ATOM 509 C . ILE A 1 61 . -0.27097 -0.743104 2.00613 1 0 0 61 A C +ATOM 510 O . ILE A 1 61 . 0.253053 -0.255033 3.00768 1 0 0 61 A O +ATOM 511 CB . ILE A 1 61 . 1.25607 -2.72936 1.40591 1 0 0 61 A C +ATOM 512 CG1 . ILE A 1 61 . 2.14395 -3.39771 0.325414 1 0 0 61 A C +ATOM 513 CG2 . ILE A 1 61 . 0.273901 -3.73583 2.05773 1 0 0 61 A C +ATOM 514 CD1 . ILE A 1 61 . 2.97312 -4.58837 0.841554 1 0 0 61 A C +ATOM 515 N . VAL A 1 62 . -1.5861 -0.73413 1.7857 1 0 0 62 A N +ATOM 516 CA . VAL A 1 62 . -2.54534 -0.217609 2.75966 1 0 0 62 A C +ATOM 517 C . VAL A 1 62 . -3.35832 -1.37142 3.33441 1 0 0 62 A C +ATOM 518 O . VAL A 1 62 . -3.99951 -2.11231 2.5896 1 0 0 62 A O +ATOM 519 CB . VAL A 1 62 . -3.477 0.865456 2.1086 1 0 0 62 A C +ATOM 520 CG1 . VAL A 1 62 . -4.49751 1.48086 3.08402 1 0 0 62 A C +ATOM 521 CG2 . VAL A 1 62 . -2.67413 2.00421 1.45268 1 0 0 62 A C +ATOM 522 N . LEU A 1 63 . -3.32231 -1.50329 4.64935 1 0 0 63 A N +ATOM 523 CA . LEU A 1 63 . -4.0583 -2.55088 5.349 1 0 0 63 A C +ATOM 524 C . LEU A 1 63 . -5.17835 -1.94384 6.17975 1 0 0 63 A C +ATOM 525 O . LEU A 1 63 . -4.96204 -0.983174 6.92136 1 0 0 63 A O +ATOM 526 CB . LEU A 1 63 . -3.06615 -3.36805 6.21524 1 0 0 63 A C +ATOM 527 CG . LEU A 1 63 . -1.81806 -3.9567 5.50937 1 0 0 63 A C +ATOM 528 CD1 . LEU A 1 63 . -0.608296 -3.01992 5.68405 1 0 0 63 A C +ATOM 529 CD2 . LEU A 1 63 . -1.41697 -5.33409 6.0693 1 0 0 63 A C +ATOM 530 N . ALA A 1 64 . -6.37487 -2.51011 6.04776 1 0 0 64 A N +ATOM 531 CA . ALA A 1 64 . -7.53139 -2.11251 6.84188 1 0 0 64 A C +ATOM 532 C . ALA A 1 64 . -7.96676 -3.28378 7.7098 1 0 0 64 A C +ATOM 533 O . ALA A 1 64 . -8.22453 -4.37612 7.19971 1 0 0 64 A O +ATOM 534 CB . ALA A 1 64 . -8.69442 -1.62255 5.94199 1 0 0 64 A C +ATOM 535 N . ALA A 1 65 . -8.0416 -3.04808 9.01136 1 0 0 65 A N +ATOM 536 CA . ALA A 1 65 . -8.40738 -4.08091 9.97548 1 0 0 65 A C +ATOM 537 C . ALA A 1 65 . -9.49157 -3.5798 10.9179 1 0 0 65 A C +ATOM 538 O . ALA A 1 65 . -9.56954 -2.38546 11.2108 1 0 0 65 A O +ATOM 539 CB . ALA A 1 65 . -7.15945 -4.55527 10.763 1 0 0 65 A C +ATOM 540 N . LYS A 1 66 . -10.3244 -4.50194 11.403 1 0 0 66 A N +ATOM 541 CA . LYS A 1 66 . -11.3702 -4.17267 12.3637 1 0 0 66 A C +ATOM 542 C . LYS A 1 66 . -10.7664 -3.80069 13.7104 1 0 0 66 A C +ATOM 543 O . LYS A 1 66 . -9.66726 -4.24038 14.0506 1 0 0 66 A O +ATOM 544 CB . LYS A 1 66 . -12.3571 -5.37358 12.4957 1 0 0 66 A C +ATOM 545 CG . LYS A 1 66 . -11.7699 -6.65809 13.1096 1 0 0 66 A C +ATOM 546 CD . LYS A 1 66 . -12.7955 -7.8009 13.2263 1 0 0 66 A C +ATOM 547 CE . LYS A 1 66 . -13.3504 -8.22533 11.8651 1 0 0 66 A C +ATOM 548 NZ . LYS A 1 66 . -14.1326 -9.45147 11.9926 1 0 0 66 A N +ATOM 549 N . LYS A 1 67 . -11.494 -2.98559 14.4789 1 0 0 67 A N +ATOM 550 CA . LYS A 1 67 . -11.0612 -2.60483 15.8188 1 0 0 67 A C +ATOM 551 C . LYS A 1 67 . -11.2068 -3.77692 16.7768 1 0 0 67 A C +ATOM 552 O . LYS A 1 67 . -11.9797 -4.70117 16.5313 1 0 0 67 A O +ATOM 553 CB . LYS A 1 67 . -11.8781 -1.36819 16.3057 1 0 0 67 A C +ATOM 554 CG . LYS A 1 67 . -13.3819 -1.60759 16.5351 1 0 0 67 A C +ATOM 555 CD . LYS A 1 67 . -14.1208 -0.367397 17.0714 1 0 0 67 A C +ATOM 556 CE . LYS A 1 67 . -15.6054 -0.638846 17.323 1 0 0 67 A C +ATOM 557 NZ . LYS A 1 67 . -16.2879 0.588173 17.7233 1 0 0 67 A N +ATOM 558 N . ASN A 1 68 . -10.4479 -3.73493 17.8718 1 0 0 68 A N +ATOM 559 CA . ASN A 1 68 . -10.5018 -4.78022 18.8848 1 0 0 68 A C +ATOM 560 C . ASN A 1 68 . -11.8764 -4.81518 19.5431 1 0 0 68 A C +ATOM 561 O . ASN A 1 68 . -12.4426 -3.76953 19.8627 1 0 0 68 A O +ATOM 562 CB . ASN A 1 68 . -9.34475 -4.52802 19.9003 1 0 0 68 A C +ATOM 563 CG . ASN A 1 68 . -7.94564 -4.56321 19.2821 1 0 0 68 A C +ATOM 564 OD1 . ASN A 1 68 . -7.72411 -5.04576 18.1726 1 0 0 68 A O +ATOM 565 ND2 . ASN A 1 68 . -6.95018 -4.04594 20.033 1 0 0 68 A N +ATOM 566 N . LYS A 1 69 . -12.4027 -6.01941 19.7338 1 0 0 69 A N +ATOM 567 CA . LYS A 1 69 . -13.7047 -6.19349 20.3647 1 0 0 69 A C +ATOM 568 C . LYS A 1 69 . -13.883 -7.61078 20.8944 1 0 0 69 A C +ATOM 569 O . LYS A 1 69 . -13.1738 -8.52997 20.4907 1 0 0 69 A O +ATOM 570 CB . LYS A 1 69 . -14.8236 -5.82407 19.3423 1 0 0 69 A C +ATOM 571 CG . LYS A 1 69 . -14.9637 -6.76772 18.1334 1 0 0 69 A C +ATOM 572 CD . LYS A 1 69 . -16.166 -6.42878 17.2328 1 0 0 69 A C +ATOM 573 CE . LYS A 1 69 . -16.3087 -7.40382 16.0624 1 0 0 69 A C +ATOM 574 NZ . LYS A 1 69 . -17.5755 -7.18739 15.3694 1 0 0 69 A N +ATOM 575 N . LYS A 1 70 . -14.8448 -7.76955 21.8073 1 0 0 70 A N +ATOM 576 CA . LYS A 1 70 . -15.17 -9.06397 22.3897 1 0 0 70 A C +ATOM 577 C . LYS A 1 70 . -16.6309 -9.40234 22.1319 1 0 0 70 A C +ATOM 578 O . LYS A 1 70 . -17.5097 -8.54411 22.2591 1 0 0 70 A O +ATOM 579 CB . LYS A 1 70 . -14.8494 -9.05589 23.9164 1 0 0 70 A C +ATOM 580 CG . LYS A 1 70 . -13.3562 -8.9847 24.2863 1 0 0 70 A C +ATOM 581 CD . LYS A 1 70 . -13.1034 -9.01435 25.8051 1 0 0 70 A C +ATOM 582 CE . LYS A 1 70 . -11.6195 -9.16832 26.1445 1 0 0 70 A C +ATOM 583 NZ . LYS A 1 70 . -10.8428 -8.09108 25.538 1 0 0 70 A N +ATOM 584 N . GLU A 1 71 . -16.8887 -10.6591 21.7644 1 0 0 71 A N +ATOM 585 CA . GLU A 1 71 . -18.2433 -11.1466 21.5104 1 0 0 71 A C +ATOM 586 C . GLU A 1 71 . -18.4927 -12.4419 22.2755 1 0 0 71 A C +ATOM 587 O . GLU A 1 71 . -17.5781 -13.2386 22.4788 1 0 0 71 A O +ATOM 588 CB . GLU A 1 71 . -18.4448 -11.3338 19.985 1 0 0 71 A C +ATOM 589 CG . GLU A 1 71 . -18.3843 -10.0304 19.1299 1 0 0 71 A C +ATOM 590 CD . GLU A 1 71 . -18.6708 -10.2017 17.6367 1 0 0 71 A C +ATOM 591 OE1 . GLU A 1 71 . -18.8809 -11.388 17.2677 1 0 0 71 A O +ATOM 592 OE2 . GLU A 1 71 . -18.6669 -9.20694 16.8799 1 0 0 71 A O +ATOM 593 N . THR A 1 72 . -19.7409 -12.6329 22.6878 1 0 0 72 A N +ATOM 594 CA . THR A 1 72 . -20.1428 -13.8323 23.4161 1 0 0 72 A C +ATOM 595 C . THR A 1 72 . -20.9261 -14.775 22.5097 1 0 0 72 A C +ATOM 596 O . THR A 1 72 . -21.782 -14.3378 21.7377 1 0 0 72 A O +ATOM 597 CB . THR A 1 72 . -20.9095 -13.4891 24.7424 1 0 0 72 A C +ATOM 598 OG1 . THR A 1 72 . -20.1645 -12.6034 25.5824 1 0 0 72 A O +ATOM 599 CG2 . THR A 1 72 . -21.3383 -14.6847 25.5953 1 0 0 72 A C +ATOM 600 N . LEU A 1 73 . -20.6248 -16.0645 22.6104 1 0 0 73 A N +ATOM 601 CA . LEU A 1 73 . -21.3453 -17.0871 21.8609 1 0 0 73 A C +ATOM 602 C . LEU A 1 73 . -22.5779 -17.5425 22.6353 1 0 0 73 A C +ATOM 603 O . LEU A 1 73 . -22.7892 -17.1327 23.777 1 0 0 73 A O +ATOM 604 CB . LEU A 1 73 . -20.3791 -18.2609 21.5588 1 0 0 73 A C +ATOM 605 CG . LEU A 1 73 . -19.1607 -17.9671 20.6468 1 0 0 73 A C +ATOM 606 CD1 . LEU A 1 73 . -18.3196 -19.2412 20.4445 1 0 0 73 A C +ATOM 607 CD2 . LEU A 1 73 . -19.5746 -17.4637 19.2515 1 0 0 73 A C +ATOM 608 N . PRO A 1 74 . -23.3853 -18.3896 22.0045 1 0 0 74 A N +ATOM 609 CA . PRO A 1 74 . -24.6014 -18.9096 22.6264 1 0 0 74 A C +ATOM 610 C . PRO A 1 74 . -24.2981 -19.655 23.9202 1 0 0 74 A C +ATOM 611 O . PRO A 1 74 . -25.0734 -19.5977 24.8799 1 0 0 74 A O +ATOM 612 CB . PRO A 1 74 . -25.144 -19.854 21.5377 1 0 0 74 A C +ATOM 613 CG . PRO A 1 74 . -24.6479 -19.2453 20.2246 1 0 0 74 A C +ATOM 614 CD . PRO A 1 74 . -23.2531 -18.7288 20.5835 1 0 0 74 A C +ATOM 615 N . ASP A 1 75 . -23.162 -20.3599 23.9495 1 0 0 75 A N +ATOM 616 CA . ASP A 1 75 . -22.7511 -21.133 25.1199 1 0 0 75 A C +ATOM 617 C . ASP A 1 75 . -21.9837 -20.2967 26.1434 1 0 0 75 A C +ATOM 618 O . ASP A 1 75 . -21.5335 -20.8197 27.1611 1 0 0 75 A O +ATOM 619 CB . ASP A 1 75 . -21.9652 -22.3731 24.5927 1 0 0 75 A C +ATOM 620 CG . ASP A 1 75 . -20.6499 -21.9936 23.9322 1 0 0 75 A C +ATOM 621 OD1 . ASP A 1 75 . -20.3787 -20.7687 23.8152 1 0 0 75 A O +ATOM 622 OD2 . ASP A 1 75 . -19.9961 -22.9018 23.3751 1 0 0 75 A O +ATOM 623 N . GLY A 1 76 . -21.8393 -19.001 25.8681 1 0 0 76 A N +ATOM 624 CA . GLY A 1 76 . -21.1701 -18.087 26.7833 1 0 0 76 A C +ATOM 625 C . GLY A 1 76 . -19.6843 -17.9033 26.5368 1 0 0 76 A C +ATOM 626 O . GLY A 1 76 . -19.0383 -17.1194 27.2374 1 0 0 76 A O +ATOM 627 N . THR A 1 77 . -19.1427 -18.6108 25.5588 1 0 0 77 A N +ATOM 628 CA . THR A 1 77 . -17.7201 -18.5154 25.2358 1 0 0 77 A C +ATOM 629 C . THR A 1 77 . -17.3848 -17.1304 24.6943 1 0 0 77 A C +ATOM 630 O . THR A 1 77 . -18.0725 -16.6226 23.8075 1 0 0 77 A O +ATOM 631 CB . THR A 1 77 . -17.2512 -19.6702 24.2811 1 0 0 77 A C +ATOM 632 OG1 . THR A 1 77 . -17.5619 -20.9636 24.806 1 0 0 77 A O +ATOM 633 CG2 . THR A 1 77 . -15.7678 -19.6668 23.9063 1 0 0 77 A C +ATOM 634 N . VAL A 1 78 . -16.3372 -16.5383 25.2416 1 0 0 78 A N +ATOM 635 CA . VAL A 1 78 . -15.8986 -15.2109 24.8309 1 0 0 78 A C +ATOM 636 C . VAL A 1 78 . -14.8943 -15.3047 23.6904 1 0 0 78 A C +ATOM 637 O . VAL A 1 78 . -13.8503 -15.9436 23.8234 1 0 0 78 A O +ATOM 638 CB . VAL A 1 78 . -15.2972 -14.4339 26.0555 1 0 0 78 A C +ATOM 639 CG1 . VAL A 1 78 . -14.7817 -13.0245 25.7102 1 0 0 78 A C +ATOM 640 CG2 . VAL A 1 78 . -16.2984 -14.3205 27.2202 1 0 0 78 A C +ATOM 641 N . VAL A 1 79 . -15.2254 -14.6583 22.5683 1 0 0 79 A N +ATOM 642 CA . VAL A 1 79 . -14.3457 -14.6026 21.4067 1 0 0 79 A C +ATOM 643 C . VAL A 1 79 . -13.7753 -13.2004 21.2661 1 0 0 79 A C +ATOM 644 O . VAL A 1 79 . -14.501 -12.2117 21.3748 1 0 0 79 A O +ATOM 645 CB . VAL A 1 79 . -15.1086 -15.0391 20.1058 1 0 0 79 A C +ATOM 646 CG1 . VAL A 1 79 . -14.3184 -14.7977 18.8063 1 0 0 79 A C +ATOM 647 CG2 . VAL A 1 79 . -15.5393 -16.5169 20.1529 1 0 0 79 A C +ATOM 648 N . THR A 1 80 . -12.467 -13.1187 21.0198 1 0 0 80 A N +ATOM 649 CA . THR A 1 80 . -11.7796 -11.8437 20.8637 1 0 0 80 A C +ATOM 650 C . THR A 1 80 . -11.4479 -11.5904 19.4004 1 0 0 80 A C +ATOM 651 O . THR A 1 80 . -10.8789 -12.4558 18.7289 1 0 0 80 A O +ATOM 652 CB . THR A 1 80 . -10.524 -11.7294 21.7992 1 0 0 80 A C +ATOM 653 OG1 . THR A 1 80 . -10.8594 -11.9132 23.1771 1 0 0 80 A O +ATOM 654 CG2 . THR A 1 80 . -9.72267 -10.4309 21.6871 1 0 0 80 A C +ATOM 655 N . TYR A 1 81 . -11.8148 -10.4144 18.9243 1 0 0 81 A N +ATOM 656 CA . TYR A 1 81 . -11.4558 -9.96531 17.5832 1 0 0 81 A C +ATOM 657 C . TYR A 1 81 . -10.3174 -8.96407 17.7049 1 0 0 81 A C +ATOM 658 O . TYR A 1 81 . -10.4898 -7.88635 18.2718 1 0 0 81 A O +ATOM 659 CB . TYR A 1 81 . -12.6992 -9.36421 16.8578 1 0 0 81 A C +ATOM 660 CG . TYR A 1 81 . -13.8266 -10.3566 16.7022 1 0 0 81 A C +ATOM 661 CD1 . TYR A 1 81 . -14.7471 -10.5637 17.75 1 0 0 81 A C +ATOM 662 CD2 . TYR A 1 81 . -13.9307 -11.1432 15.5366 1 0 0 81 A C +ATOM 663 CE1 . TYR A 1 81 . -15.7344 -11.5503 17.641 1 0 0 81 A C +ATOM 664 CE2 . TYR A 1 81 . -14.9164 -12.1317 15.4307 1 0 0 81 A C +ATOM 665 CZ . TYR A 1 81 . -15.8162 -12.3368 16.4857 1 0 0 81 A C +ATOM 666 OH . TYR A 1 81 . -16.7939 -13.349 16.3988 1 0 0 81 A O +ATOM 667 N . ASN A 1 82 . -9.15059 -9.33229 17.1706 1 0 0 82 A N +ATOM 668 CA . ASN A 1 82 . -7.95438 -8.50444 17.2732 1 0 0 82 A C +ATOM 669 C . ASN A 1 82 . -7.49477 -8.051 15.894 1 0 0 82 A C +ATOM 670 O . ASN A 1 82 . -6.95049 -8.83696 15.1171 1 0 0 82 A O +ATOM 671 CB . ASN A 1 82 . -6.86936 -9.32178 18.0402 1 0 0 82 A C +ATOM 672 CG . ASN A 1 82 . -5.73432 -8.47421 18.6183 1 0 0 82 A C +ATOM 673 OD1 . ASN A 1 82 . -5.24216 -7.52434 18.0113 1 0 0 82 A O +ATOM 674 ND2 . ASN A 1 82 . -5.28271 -8.83675 19.8378 1 0 0 82 A N +ATOM 675 N . GLY A 1 83 . -7.71353 -6.76494 15.5912 1 0 0 83 A N +ATOM 676 CA . GLY A 1 83 . -7.32069 -6.1968 14.3082 1 0 0 83 A C +ATOM 677 C . GLY A 1 83 . -5.81981 -6.22031 14.0943 1 0 0 83 A C +ATOM 678 O . GLY A 1 83 . -5.34971 -6.54002 13.0018 1 0 0 83 A O +ATOM 679 N . ASP A 1 84 . -5.06983 -5.87527 15.1348 1 0 0 84 A N +ATOM 680 CA . ASP A 1 84 . -3.61167 -5.87707 15.0683 1 0 0 84 A C +ATOM 681 C . ASP A 1 84 . -3.07593 -7.27503 14.78 1 0 0 84 A C +ATOM 682 O . ASP A 1 84 . -2.18855 -7.44568 13.9439 1 0 0 84 A O +ATOM 683 CB . ASP A 1 84 . -3.0697 -5.24685 16.3884 1 0 0 84 A C +ATOM 684 CG . ASP A 1 84 . -3.45114 -3.78296 16.5364 1 0 0 84 A C +ATOM 685 OD1 . ASP A 1 84 . -3.61704 -3.10604 15.4867 1 0 0 84 A O +ATOM 686 OD2 . ASP A 1 84 . -3.39802 -3.28144 17.6801 1 0 0 84 A O +ATOM 687 N . LYS A 1 85 . -3.62101 -8.26981 15.4781 1 0 0 85 A N +ATOM 688 CA . LYS A 1 85 . -3.22163 -9.65894 15.2659 1 0 0 85 A C +ATOM 689 C . LYS A 1 85 . -3.57624 -10.1195 13.8556 1 0 0 85 A C +ATOM 690 O . LYS A 1 85 . -2.79709 -10.8199 13.2076 1 0 0 85 A O +ATOM 691 CB . LYS A 1 85 . -3.89305 -10.5639 16.3448 1 0 0 85 A C +ATOM 692 CG . LYS A 1 85 . -3.29002 -10.4788 17.7593 1 0 0 85 A C +ATOM 693 CD . LYS A 1 85 . -3.96424 -11.4287 18.7665 1 0 0 85 A C +ATOM 694 CE . LYS A 1 85 . -3.31443 -11.3651 20.1502 1 0 0 85 A C +ATOM 695 NZ . LYS A 1 85 . -4.10573 -12.1159 21.1206 1 0 0 85 A N +ATOM 696 N . ALA A 1 86 . -4.75748 -9.72084 13.3796 1 0 0 86 A N +ATOM 697 CA . ALA A 1 86 . -5.19287 -10.0447 12.0275 1 0 0 86 A C +ATOM 698 C . ALA A 1 86 . -4.27432 -9.45332 10.9753 1 0 0 86 A C +ATOM 699 O . ALA A 1 86 . -3.87446 -10.1377 10.0297 1 0 0 86 A O +ATOM 700 CB . ALA A 1 86 . -6.65483 -9.57339 11.8201 1 0 0 86 A C +ATOM 701 N . ILE A 1 87 . -3.92772 -8.18197 11.1444 1 0 0 87 A N +ATOM 702 CA . ILE A 1 87 . -3.02521 -7.49681 10.2206 1 0 0 87 A C +ATOM 703 C . ILE A 1 87 . -1.64465 -8.14613 10.2179 1 0 0 87 A C +ATOM 704 O . ILE A 1 87 . -1.03352 -8.32719 9.15949 1 0 0 87 A O +ATOM 705 CB . ILE A 1 87 . -2.97904 -5.96283 10.5518 1 0 0 87 A C +ATOM 706 CG1 . ILE A 1 87 . -4.27487 -5.20473 10.1664 1 0 0 87 A C +ATOM 707 CG2 . ILE A 1 87 . -1.70727 -5.24537 10.0319 1 0 0 87 A C +ATOM 708 CD1 . ILE A 1 87 . -4.30179 -3.73391 10.6219 1 0 0 87 A C +ATOM 709 N . LYS A 1 88 . -1.14725 -8.49994 11.4001 1 0 0 88 A N +ATOM 710 CA . LYS A 1 88 . 0.152902 -9.1482 11.5305 1 0 0 88 A C +ATOM 711 C . LYS A 1 88 . 0.179445 -10.4803 10.7888 1 0 0 88 A C +ATOM 712 O . LYS A 1 88 . 1.13975 -10.7853 10.0827 1 0 0 88 A O +ATOM 713 CB . LYS A 1 88 . 0.490486 -9.33284 13.0423 1 0 0 88 A C +ATOM 714 CG . LYS A 1 88 . 1.84163 -10.0051 13.3491 1 0 0 88 A C +ATOM 715 CD . LYS A 1 88 . 2.04688 -10.3037 14.8459 1 0 0 88 A C +ATOM 716 CE . LYS A 1 88 . 3.37483 -11.0123 15.1205 1 0 0 88 A C +ATOM 717 NZ . LYS A 1 88 . 3.45269 -11.4266 16.5183 1 0 0 88 A N +ATOM 718 N . LYS A 1 89 . -0.877888 -11.2748 10.959 1 0 0 89 A N +ATOM 719 CA . LYS A 1 89 . -0.982416 -12.5703 10.2927 1 0 0 89 A C +ATOM 720 C . LYS A 1 89 . -1.02112 -12.4054 8.7758 1 0 0 89 A C +ATOM 721 O . LYS A 1 89 . -0.37137 -13.1538 8.04827 1 0 0 89 A O +ATOM 722 CB . LYS A 1 89 . -2.24569 -13.3219 10.815 1 0 0 89 A C +ATOM 723 CG . LYS A 1 89 . -2.12729 -13.9306 12.2247 1 0 0 89 A C +ATOM 724 CD . LYS A 1 89 . -1.08433 -15.0601 12.3143 1 0 0 89 A C +ATOM 725 CE . LYS A 1 89 . -1.0531 -15.714 13.6971 1 0 0 89 A C +ATOM 726 NZ . LYS A 1 89 . -0.0823821 -16.8043 13.7243 1 0 0 89 A N +ATOM 727 N . ALA A 1 90 . -1.7929 -11.4222 8.3034 1 0 0 90 A N +ATOM 728 CA . ALA A 1 90 . -1.8951 -11.1492 6.87355 1 0 0 90 A C +ATOM 729 C . ALA A 1 90 . -0.548028 -10.7254 6.29792 1 0 0 90 A C +ATOM 730 O . ALA A 1 90 . -0.138905 -11.1976 5.23517 1 0 0 90 A O +ATOM 731 CB . ALA A 1 90 . -2.97887 -10.0736 6.60672 1 0 0 90 A C +ATOM 732 N . LEU A 1 91 . 0.153748 -9.83104 7.00278 1 0 0 91 A N +ATOM 733 CA . LEU A 1 91 . 1.4694 -9.36022 6.56889 1 0 0 91 A C +ATOM 734 C . LEU A 1 91 . 2.46442 -10.511 6.49335 1 0 0 91 A C +ATOM 735 O . LEU A 1 91 . 3.2324 -10.6127 5.5331 1 0 0 91 A O +ATOM 736 CB . LEU A 1 91 . 1.93745 -8.24673 7.54027 1 0 0 91 A C +ATOM 737 CG . LEU A 1 91 . 1.35265 -6.82616 7.33415 1 0 0 91 A C +ATOM 738 CD1 . LEU A 1 91 . 1.76249 -5.90109 8.49513 1 0 0 91 A C +ATOM 739 CD2 . LEU A 1 91 . 1.8408 -6.16959 6.02946 1 0 0 91 A C +ATOM 740 N . GLU A 1 92 . 2.44455 -11.3717 7.5042 1 0 0 92 A N +ATOM 741 CA . GLU A 1 92 . 3.34081 -12.5239 7.55274 1 0 0 92 A C +ATOM 742 C . GLU A 1 92 . 3.0707 -13.481 6.39692 1 0 0 92 A C +ATOM 743 O . GLU A 1 92 . 4.00087 -13.9387 5.72795 1 0 0 92 A O +ATOM 744 CB . GLU A 1 92 . 3.184 -13.2249 8.92623 1 0 0 92 A C +ATOM 745 CG . GLU A 1 92 . 3.76527 -12.452 10.1503 1 0 0 92 A C +ATOM 746 CD . GLU A 1 92 . 3.59098 -13.1327 11.5094 1 0 0 92 A C +ATOM 747 OE1 . GLU A 1 92 . 2.76801 -14.0866 11.5253 1 0 0 92 A O +ATOM 748 OE2 . GLU A 1 92 . 4.22906 -12.7214 12.5025 1 0 0 92 A O +ATOM 749 N . GLU A 1 93 . 1.79303 -13.7791 6.15772 1 0 0 93 A N +ATOM 750 CA . GLU A 1 93 . 1.39799 -14.682 5.07955 1 0 0 93 A C +ATOM 751 C . GLU A 1 93 . 1.80206 -14.1208 3.71961 1 0 0 93 A C +ATOM 752 O . GLU A 1 93 . 2.32978 -14.8484 2.87802 1 0 0 93 A O +ATOM 753 CB . GLU A 1 93 . -0.129175 -14.9328 5.16556 1 0 0 93 A C +ATOM 754 CG . GLU A 1 93 . -0.682459 -16.0606 4.24068 1 0 0 93 A C +ATOM 755 CD . GLU A 1 93 . -2.14952 -16.4371 4.45712 1 0 0 93 A C +ATOM 756 OE1 . GLU A 1 93 . -2.9841 -15.6225 3.98016 1 0 0 93 A O +ATOM 757 OE2 . GLU A 1 93 . -2.4433 -17.4783 5.08343 1 0 0 93 A O +ATOM 758 N . ILE A 1 94 . 1.55367 -12.833 3.51828 1 0 0 94 A N +ATOM 759 CA . ILE A 1 94 . 1.90204 -12.171 2.25949 1 0 0 94 A C +ATOM 760 C . ILE A 1 94 . 3.40692 -12.2145 2.01783 1 0 0 94 A C +ATOM 761 O . ILE A 1 94 . 3.85381 -12.5146 0.91057 1 0 0 94 A O +ATOM 762 CB . ILE A 1 94 . 1.32091 -10.7126 2.23726 1 0 0 94 A C +ATOM 763 CG1 . ILE A 1 94 . -0.228191 -10.6609 2.24778 1 0 0 94 A C +ATOM 764 CG2 . ILE A 1 94 . 1.92685 -9.81118 1.13151 1 0 0 94 A C +ATOM 765 CD1 . ILE A 1 94 . -0.808616 -9.2495 2.45409 1 0 0 94 A C +ATOM 766 N . GLU A 1 95 . 4.17626 -11.9209 3.05842 1 0 0 95 A N +ATOM 767 CA . GLU A 1 95 . 5.6331 -11.9306 2.95991 1 0 0 95 A C +ATOM 768 C . GLU A 1 95 . 6.15501 -13.3198 2.6081 1 0 0 95 A C +ATOM 769 O . GLU A 1 95 . 7.0581 -13.4555 1.78072 1 0 0 95 A O +ATOM 770 CB . GLU A 1 95 . 6.22887 -11.4154 4.29487 1 0 0 95 A C +ATOM 771 CG . GLU A 1 95 . 6.22211 -9.8671 4.48554 1 0 0 95 A C +ATOM 772 CD . GLU A 1 95 . 6.61252 -9.36763 5.87802 1 0 0 95 A C +ATOM 773 OE1 . GLU A 1 95 . 6.88923 -10.2726 6.70991 1 0 0 95 A O +ATOM 774 OE2 . GLU A 1 95 . 6.62267 -8.14211 6.12398 1 0 0 95 A O +ATOM 775 N . LYS A 1 96 . 5.5822 -14.3374 3.23048 1 0 0 96 A N +ATOM 776 CA . LYS A 1 96 . 5.97709 -15.7175 2.96303 1 0 0 96 A C +ATOM 777 C . LYS A 1 96 . 5.67366 -16.1107 1.52212 1 0 0 96 A C +ATOM 778 O . LYS A 1 96 . 6.49538 -16.7448 0.858273 1 0 0 96 A O +ATOM 779 CB . LYS A 1 96 . 5.25893 -16.6643 3.97365 1 0 0 96 A C +ATOM 780 CG . LYS A 1 96 . 5.87446 -16.7287 5.38381 1 0 0 96 A C +ATOM 781 CD . LYS A 1 96 . 5.27009 -17.8405 6.26151 1 0 0 96 A C +ATOM 782 CE . LYS A 1 96 . 6.01311 -18.0014 7.58925 1 0 0 96 A C +ATOM 783 NZ . LYS A 1 96 . 5.44174 -19.0991 8.36404 1 0 0 96 A N +ATOM 784 N . LYS A 1 97 . 4.49564 -15.7339 1.04334 1 0 0 97 A N +ATOM 785 CA . LYS A 1 97 . 4.07651 -16.0485 -0.321375 1 0 0 97 A C +ATOM 786 C . LYS A 1 97 . 4.9948 -15.3946 -1.34824 1 0 0 97 A C +ATOM 787 O . LYS A 1 97 . 5.42815 -16.0406 -2.30186 1 0 0 97 A O +ATOM 788 CB . LYS A 1 97 . 2.59436 -15.6043 -0.520281 1 0 0 97 A C +ATOM 789 CG . LYS A 1 97 . 1.53894 -16.4413 0.226135 1 0 0 97 A C +ATOM 790 CD . LYS A 1 97 . 0.0933118 -15.9963 -0.0631632 1 0 0 97 A C +ATOM 791 CE . LYS A 1 97 . -0.939996 -16.9205 0.584189 1 0 0 97 A C +ATOM 792 NZ . LYS A 1 97 . -2.28572 -16.3808 0.412808 1 0 0 97 A N +ATOM 793 N . GLU A 1 98 . 5.28377 -14.108 -1.14752 1 0 0 98 A N +ATOM 794 CA . GLU A 1 98 . 6.15351 -13.3658 -2.05638 1 0 0 98 A C +ATOM 795 C . GLU A 1 98 . 7.5621 -13.9461 -2.08166 1 0 0 98 A C +ATOM 796 O . GLU A 1 98 . 8.1815 -14.0471 -3.14027 1 0 0 98 A O +ATOM 797 CB . GLU A 1 98 . 6.15546 -11.8741 -1.63539 1 0 0 98 A C +ATOM 798 CG . GLU A 1 98 . 4.79087 -11.1308 -1.77312 1 0 0 98 A C +ATOM 799 CD . GLU A 1 98 . 4.81741 -9.63162 -1.46852 1 0 0 98 A C +ATOM 800 OE1 . GLU A 1 98 . 5.94112 -9.17851 -1.12273 1 0 0 98 A O +ATOM 801 OE2 . GLU A 1 98 . 3.76916 -8.95615 -1.55463 1 0 0 98 A O +ATOM 802 N . LYS A 1 99 . 8.06262 -14.3269 -0.90837 1 0 0 99 A N +ATOM 803 CA . LYS A 1 99 . 9.41539 -14.8636 -0.786226 1 0 0 99 A C +ATOM 804 C . LYS A 1 99 . 9.52822 -16.2765 -1.3481 1 0 0 99 A C +ATOM 805 O . LYS A 1 99 . 10.4951 -16.5988 -2.04012 1 0 0 99 A O +ATOM 806 CB . LYS A 1 99 . 9.84252 -14.8127 0.713296 1 0 0 99 A C +ATOM 807 CG . LYS A 1 99 . 11.1673 -15.5191 1.05623 1 0 0 99 A C +ATOM 808 CD . LYS A 1 99 . 11.4635 -15.5571 2.567 1 0 0 99 A C +ATOM 809 CE . LYS A 1 99 . 12.6659 -16.442 2.90156 1 0 0 99 A C +ATOM 810 NZ . LYS A 1 99 . 12.829 -16.5559 4.34794 1 0 0 99 A N +ATOM 811 N . GLU A 1 100 . 8.54236 -17.1176 -1.04413 1 0 0 100 A N +ATOM 812 CA . GLU A 1 100 . 8.62634 -18.4841 -1.33121 1 0 0 100 A C +ATOM 813 C . GLU A 1 100 . 8.19862 -18.8163 -2.71914 1 0 0 100 A C +ATOM 814 O . GLU A 1 100 . 8.27537 -20.5208 -3.06902 1 0 0 100 A O +ATOM 815 CB . GLU A 1 100 . 7.7852 -19.2445 -0.274498 1 0 0 100 A C +ATOM 816 CG . GLU A 1 100 . 8.31244 -19.1687 1.19174 1 0 0 100 A C +ATOM 817 CD . GLU A 1 100 . 7.47268 -19.9036 2.23844 1 0 0 100 A C +ATOM 818 OE1 . GLU A 1 100 . 6.39992 -20.4028 1.80533 1 0 0 100 A O +ATOM 819 OE2 . GLU A 1 100 . 7.85988 -19.9595 3.42564 1 0 0 100 A O +# diff --git a/tests/utility/test_api.py b/tests/utility/test_api.py index ca88cdc..a7feee7 100644 --- a/tests/utility/test_api.py +++ b/tests/utility/test_api.py @@ -1,4 +1,5 @@ import os +import socket import tempfile import pytest @@ -8,11 +9,13 @@ from chroma.models.graph_backbone import GraphBackbone from chroma.utility.model import load_model +pytestmark = pytest.mark.integration + KEY_PATH = os.path.dirname(os.path.dirname(chroma.__file__)) KEY_PATH = os.path.join(KEY_PATH, "config.json") -@pytest.mark.skipif(not os.path.exists(KEY_PATH), reason="requires file.txt") +@pytest.mark.skipif(not os.path.exists(KEY_PATH), reason="requires config.json") def test_api(): # Test Key Registration @@ -23,6 +26,11 @@ def test_api(): api.read_key() # Test Download + try: + socket.getaddrinfo("chroma-weights.generatebiomedicines.com", 443) + except socket.gaierror: + pytest.skip("requires network access") + api.download_from_generate( "https://chroma-weights.generatebiomedicines.com/", "chroma_backbone_v1.0.pt" ) diff --git a/tests/utility/test_init_imports.py b/tests/utility/test_init_imports.py new file mode 100644 index 0000000..1b4da69 --- /dev/null +++ b/tests/utility/test_init_imports.py @@ -0,0 +1,25 @@ +import subprocess +import sys +from pathlib import Path + + +PROJECT_ROOT = Path(__file__).resolve().parents[2] + + +def test_package_imports_do_not_eagerly_import_torch(): + completed = subprocess.run( + [ + sys.executable, + "-c", + ( + "import sys; " + "import chroma, chroma.data, chroma.layers, chroma.models, chroma.utility; " + "assert 'torch' not in sys.modules" + ), + ], + cwd=PROJECT_ROOT, + text=True, + capture_output=True, + ) + + assert completed.returncode == 0, completed.stderr diff --git a/tests/utility/test_packaging.py b/tests/utility/test_packaging.py new file mode 100644 index 0000000..c563cdd --- /dev/null +++ b/tests/utility/test_packaging.py @@ -0,0 +1,78 @@ +import os +import subprocess +import sys +import venv +from pathlib import Path + +import pytest + +pytestmark = [pytest.mark.integration, pytest.mark.slow] + + +PROJECT_ROOT = Path(__file__).resolve().parents[2] + + +def _run(command, cwd): + completed = subprocess.run( + command, + cwd=cwd, + text=True, + capture_output=True, + ) + if completed.returncode != 0: + raise AssertionError( + f"command failed: {' '.join(command)}\n" + f"stdout:\n{completed.stdout}\n" + f"stderr:\n{completed.stderr}" + ) + return completed + + +def test_build_and_import_wheel(tmp_path): + pytest.importorskip("build") + + dist_dir = tmp_path / "dist" + dist_dir.mkdir() + _run( + [ + sys.executable, + "-m", + "build", + "--wheel", + "--sdist", + "--outdir", + str(dist_dir), + ], + cwd=PROJECT_ROOT, + ) + + wheel = next(dist_dir.glob("chroma-*.whl")) + sdist = next(dist_dir.glob("chroma-*.tar.gz")) + assert wheel.is_file() + assert sdist.is_file() + + venv_dir = tmp_path / "venv" + venv.EnvBuilder(with_pip=True, system_site_packages=True).create(venv_dir) + bin_dir = "Scripts" if os.name == "nt" else "bin" + python = venv_dir / bin_dir / "python" + + _run( + [str(python), "-m", "pip", "install", "--no-deps", "--force-reinstall", str(wheel)], + cwd=tmp_path, + ) + result = _run( + [ + str(python), + "-c", + ( + "from importlib import resources; " + "import chroma, chroma.data, chroma.layers, chroma.models, chroma.utility; " + "data = resources.files('chroma').joinpath('assets', 'centering', 'centering_2g3n.params'); " + "assert data.is_file(); " + "assert 'site-packages' in chroma.__file__; " + "print(chroma.__file__)" + ), + ], + cwd=tmp_path, + ) + assert str(venv_dir) in result.stdout diff --git a/tests/utility/test_torch.py b/tests/utility/test_torch.py new file mode 100644 index 0000000..1077aa7 --- /dev/null +++ b/tests/utility/test_torch.py @@ -0,0 +1,91 @@ +import warnings + +import torch + +from chroma.utility import torch as torch_utils + + +def test_call_with_mps_cpu_fallback_passthrough_tensor_output(): + torch_utils._MPS_OP_SUPPORT_CACHE.clear() + x = torch.tensor([[2.0, 0.0], [0.0, 3.0]]) + result = torch_utils.call_with_mps_cpu_fallback(torch.linalg.cholesky, x) + expected = torch.linalg.cholesky(x) + + assert torch.allclose(result, expected) + assert result.device == x.device + + +def test_call_with_mps_cpu_fallback_passthrough_tuple_output(): + torch_utils._MPS_OP_SUPPORT_CACHE.clear() + x = torch.tensor([[3.0, 1.0], [1.0, 3.0]]) + values, vectors = torch_utils.call_with_mps_cpu_fallback(torch.linalg.eigh, x) + expected_values, expected_vectors = torch.linalg.eigh(x) + + assert torch.allclose(values, expected_values) + assert torch.allclose(vectors.abs(), expected_vectors.abs()) + assert values.device == x.device + assert vectors.device == x.device + + +def test_call_with_mps_cpu_fallback_retries_after_mps_error(monkeypatch): + torch_utils._MPS_OP_SUPPORT_CACHE.clear() + calls = {"count": 0} + x = torch.tensor([1.0, 2.0, 3.0]) + + def flaky_op(tensor): + calls["count"] += 1 + raise RuntimeError("MPS backend: operation not implemented") + + monkeypatch.setattr( + torch_utils, "_find_mps_device", lambda _: torch.device("cpu") + ) + monkeypatch.setattr( + torch_utils, "_call_on_cpu", lambda op, args, kwargs, mps_device: x + 1 + ) + + result = torch_utils.call_with_mps_cpu_fallback(flaky_op, x) + result_cached = torch_utils.call_with_mps_cpu_fallback(flaky_op, x) + + assert calls["count"] == 1 + assert torch.equal(result, x + 1) + assert torch.equal(result_cached, x + 1) + assert result.device == x.device + + +def test_call_with_explicit_mps_cpu_fallback_passthrough(): + torch_utils._MPS_OP_SUPPORT_CACHE.clear() + x = torch.tensor([[1.0, 2.0], [3.0, 4.0]]) + result = torch_utils.call_with_explicit_mps_cpu_fallback(torch.linalg.det, x) + + assert torch.allclose(result, torch.linalg.det(x)) + + +def test_call_with_explicit_mps_cpu_fallback_uses_cpu_path_once(monkeypatch): + torch_utils._MPS_OP_SUPPORT_CACHE.clear() + calls = {"count": 0} + x = torch.tensor([[2.0, 0.0], [0.0, 5.0]]) + + def op(tensor): + calls["count"] += 1 + warnings.warn( + "The operator 'aten::linalg_svd' is not currently supported on the MPS backend and will fall back to run on the CPU.", + UserWarning, + ) + return torch.linalg.det(tensor) + + monkeypatch.setattr( + torch_utils, "_find_mps_device", lambda _: torch.device("cpu") + ) + monkeypatch.setattr( + torch_utils, + "_call_on_cpu", + lambda op, args, kwargs, mps_device: torch.linalg.det(x), + ) + + result = torch_utils.call_with_explicit_mps_cpu_fallback(op, x) + result_cached = torch_utils.call_with_explicit_mps_cpu_fallback(op, x) + + assert calls["count"] == 1 + assert torch.allclose(result, torch.linalg.det(x)) + assert torch.allclose(result_cached, torch.linalg.det(x)) + assert result.device == x.device